A0A5K4F1F8_SCHMA Loading...

EGF-like domain-containing protein AlphaSync Fragmented

AlphaFold DB , UniProt , Accession A0A5K4F1F8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 3,772 aa.

						>A0A5K4F1F8_SCHMA|A0A5K4F1F8
MSDKLLRLEDSLRNNTSVSINGGNIINGDSPLNQNSHYSSRSYSNDHGSESALLEDCDRDFVTKPVVTRPTLGDKRNSTATGSSSSGIGTMPGGSNRTGSNIVALSGFEKDKFPLTSREGVKQSKMPVVTQDHSNDSQNKSRESYRTQLTDSQLMRRKTYGNARSSSPTVSTDTNSETHVPNENCIDHSALSRSRKRARSEVPRMGSTGSNNLSSNPLLRSVNDDQEDSEDGERVALNKGNSRSDIEEDGFHTGNDFDVGIRGRHRRQTYQLNTRQRDSSLGRYTRSTAYGSSGGTLPRRQRITGSLTRATTISGVDPHGTLRSACRLAHSIRAGIIPPPPSEPPPATPLSGSLISELESIGPNAATGLINPFALQLHNSQQQQALAAAVAAAGGFPQVLSGVNQNNLTNSYMLSPALLNSETNKLLQLQQAKLIAQHQVGLVEQQLRQQQQQQQQQLLAAAVAANNLMQNPTINGHTLSNGSYLQGFGTYGRTSRPGSTIPPSMQSYLSPGNLLAVQQQQQQQQLEANQLLLLNDANVQMPTLNFTGSPSVNLLNSELNEAASISKSSADGGGGGGGSGSVVYENSYSSFNKLLTNSVLPDSSLCQPGLQSFISTNGSNPNDAIYIGTSQNVSIMNGTIGNDNNTAPPLVQTYISSVQQSQQQQGRPNNPGLIDSTRSIEPTYSTTNDALRAKSKSHSDSVVVVERKSKHHCPWYYWIISILILAFLLALVLAVSFSEEKKRLDHRLQERFAQDPAIIGLFDPNSPPYILEANKLVNIVLEPMKSWSGQWHMPTARYIRYNITVSSLASSVGVFMRHNTMPTIIHYDIFDRITGHNLLANSGRQELGSRTKRDTQPTNRNSKSLIHISSKDELRETGRLHYLDEGIWFLALVNDQPRREPIKFAIGDAVMRRGCPNDCSNRGVCDGGVCDCVNGFKGPDCSIAELPKVCSGHGDYASGACRCYPEWKGHECQILWSECEDSTCSGNGRCVVGECQCYEGYAGNLCQTRTCISFNCSGHGVCMNGNCRCFNGWSGIGCELPVPNHLINSELIHPSNGASASGNTGNGRNHNNNNNKMSNRLMMKSVSSTSSSSARAMGLSSAPVRLLLDAAPEQECTLDCSSHGVCEYMDGYDQPVCRCFSGWTGSDCNTKRCDTRCFINGYCTNGTCICKVGWNGKYCTLDGCPDHCNGHGQCTMYPLSSSYYCQCSPGWSGSACQRQIETICDDGIDNDHDDLVDCLDPDCCTSTHCDRLIKLGPNAGGVAADNAQQSCAHSESFDYYLLITPIAPLDSAFYGQLEFLLRRERIVVENFDPRRISVVRGVIRQWDGTVFWGCRVSDRANMQNGYTLTDKSGRFDLPVDGGTIVQLEFLRYPTDQFSAVHNLYVPVNQIINMGDFYMYDAKQLSNNDLPTTITTKTTTSNILSGDFGGTLGPSPIHGDLWTINSFMPKFSDKNMVVENVCSSGNIHDTVTLGGPYIQSNSLMDISNVCLDEQNIICVRNGALMYNIPIKDTQLRLIYRSDRTSGYKPGISIHLLASNRAPPLNLKEIHLVIDIAGQRHVKLLEPEPGLLSTFYWNKTDGYNRSVYGLAEAKVSVGYVYTKCPRIFWEYRVVQLPGNELISSDLANWNLNILHTYAVSHGIIYRGDGSHFYLKQTDWHISAVIGLTEQRRSPNDCSRCSINDKPTRQLSLYNPYCLLTDSAGNLLIGDGGFLRWLNSTKPAEEYKSSAALSSSSQSSSSFRMPLIRSDSLNSPFQEQLKRNDRRKWETIIDYKLDFLQSNFDEDQLTTYFITVHPNYIYHANDYSILTLLGNSGNVGGADFSNGLFLSHTSSKTIWWLKTTPNLSAHLLIGEDCQSPSAKSNINSESSSTAFNYQEFCIKQNLKSPKGIVATQTELYFIDSQSIWSLSLRQTGSNMIPFSRLVIGSDPNYSSNPKSLNTTTSGTSIPKTTPSSSTPPCDRSVPGNQMLLNNPEHLAFSILEQALYFSDNDHVYRYHLVNQMVSLAAGRLKGCPIKTDDWSFAPLATQVELGDIRGLSVSPQGDLFIAGPQHIWIRRSNDNRLYPVTGIHPSQPRQFKGDVNNSKKRHSSTDESVVDLGLVNEFSFNSISSITVSLFGELFVADNSHNRVYRIHYQLPEISETGNTYRILHSQTDEIDSFGSYGQLISTESTSTQMISHRLDYRNNEVSGWLSQIRGDDHSIKLSIHRDTHGNLLRLQTPTGHLYNVTLEPGSGQRISTLVDPVNGGLWKFLYSFDGLLTYLKNPQDSSYIQFHYAPESGRLLQITYPNAKSIDVTRIVRSQIPVNMRFHTLDEVSYQDNTPKSVSTNTPDQLSTVIMIQTTDSNKHEMEIDYGDSNNLWKVRLAQVYQVQKDLYAPVQLIRQITIPGNNLRSAIENTNVWTYHLNDQSNPRILDTHTSIDGRGYSDFGVNFDKQSQPYQFFKNHFRRSISAQNYRSGSDVHSSKRQMSDPFSKRFTIRANYNNNNERNYNNLGEEVDWHYQKTLTVNGQNLLNVKFNWALQLETYQHASTGHVLLQIVYNANFQPMIFNASANYLQSTGAHEMFYPTKADYIRPATLILAYTKTGHLSAVEWGNTSYHFSYDVLNRLKAADLGRPADTLSFQYGIQNIPFQPTMVSVSGSGLYTLLYSDSFIESSEYQEASSLSSSKSDYMGLSGVITPTSLRRQFTRINGIKVNRLMFTPWLDSPGPWIYEWGSDVGSSMKLSSDHSHLLRFIWPSNYRRISIFPKQNFVIYDKTSVRWDSNGLKQPINILTAPLVQLTDTASGFRLQYQRIFQGSLLQSLHINHRLPGVKTAHPNLGGILNAKFTYGYDLNMNLVSIHTSLFIRNNEDDFGNTINSDDKTVLNEESSIRLDSLTGRVLTMNEFTINYQSSSLHITYNLKNMQLYRQWDDRQRIIQCVLHSLNSRRELLYNLSLSYQPNALQALQQREEREGQVPRWITYVHGPGGRLEAVDREEAGTSLRSHSQLIYNAEGRIAHLRIATSDPQLPSNERSESGLTSRSEELQFIYDSRGLLVRRGNWHYNFDEDGFLVKRHLHNLYITDQFAYNSKGLLIWAERTVDKSVDSSSMNNFHSTPSSSPLDQWALEDDAGLKRSYSVQFIYDSEDRLIIVRDTLIVRDSVQYFYADPKHPTRVTHIFNHGRLKTIRLLYDPIHGHVFALEQYDNGGLNANNGKRNHLNSNSIPSPMNSFDDNQFHHDSNTSAQKRVFFIITNHEGSPTAAFSENGKLAWAAEYSATGSRRLTLSSRNNFFTRALIEEVDLPLGHASCITDFHTGFLFCPPTSRAYDPLGATFTSPDWHGLISTRLSNIKRDPSVLDTHKWGLIEQEALGTGPNGLFAELRKAMTSPIWWLKQVGFNLDNFLTKFDTFEGKVESSKNALKNSLPLFPIDMTSIHSFDRTHNQGYKQLNSKFEHLSMLKSNQLTPGGPHGSGLSSFLLDSTDVNDEMSLPLSPPNTMFGPQVSYVVDDDTGYVKVISINQSQTTKTHFKAASIDGSLETKLASILVSDTNLVDWWSYLKSSFPSSPSPSTTQTEVPQLSTTLFTQLFLSTKKDFHSTVKQLATLGFQLPMYDRVNGINFTIMNTNEKYKELWITRYNLQWRIRYFNSPYPLSPMTAWSVLVNSTIDDAKRRGKTLAWLNEVKLIQQFIPTLKSTPTSKIDHLNINQNDFVYHKLTSKYILGFNYPWNRHELSELVQNNTVMNYRWIPTIDFLQYSSSPSLSSDTSAMCRLYDHSSMYQIRPKELHKHKEKDLQK
					

Structure and PAE viewers are unavailable as this is a multi-fragment structure.

Download 13 Fragment Structures AlphaSync Parameters PDBs Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.7	Very low	36.3	Very low	229 Å²	229	170.7 Å²	170.7	100%	1.128	87%	0.869	S	S	*	*				0	79.7	0	-63.8	-171.1	-169.6	0	0	109
2	S	32.8	Very low	36.3	Very low	99 Å²	99	171.7 Å²	171.7	69%	0.692	88%	0.876	S	S	*	*			cis	21.6	138.8	-5.6	-48.9	0	0	0	0	120.9
3	D	39.2	Very low	36.4	Very low	160 Å²	160	175.4 Å²	175.4	86%	0.856	87%	0.872	S	S	*	*	S	Bend	trans	84.9	12.1	166.6	-44.3	-22.5	0	0	0	118.4
4	K	37.9	Very low	36.4	Very low	194 Å²	194	173.6 Å²	173.6	84%	0.843	87%	0.868	S	S	*	*			trans	-137.9	25	166.1	-73.8	-162.5	175.1	-176.3	0	115.2	L6	K4-L6 VanDerWaalsContact C-N 3.28Å; K4-L6 PolarHBondContact O-N 2.99Å
5	L	36.6	Very low	36.1	Very low	173 Å²	173	172.2 Å²	172.2	91%	0.906	86%	0.864	S	S	*	*	S	Bend	trans	-94.5	38.8	177.2	-140.8	170.3	0	0	0	111.9
6	L	37.2	Very low	36.1	Very low	155 Å²	155	169.1 Å²	169.1	81%	0.812	86%	0.857	S	S	*	*			trans	-148.2	147	-177.7	-84.4	164.1	0	0	0	108.5	K4	K4-L6 VanDerWaalsContact C-N 3.28Å; K4-L6 PolarHBondContact O-N 2.99Å
7	R	39	Very low	36.1	Very low	242 Å²	242	165.6 Å²	165.6	91%	0.913	85%	0.852	S	S	*	*			trans	77	48.4	-172.2	-52	179	176.7	167.5	-1.1	116.2
8	L	34	Very low	35.9	Very low	182 Å²	182	163.8 Å²	163.8	95%	0.953	85%	0.849	S	S	*	*			trans	-119.1	14.1	154.7	-114.5	170.9	0	0	0	112.9
9	E	35.4	Very low	35.7	Very low	167 Å²	167	160.1 Å²	160.1	78%	0.78	84%	0.839	S	S	*	*			trans	-91	168.8	154.1	-67	173.9	112.2	0	0	108.6
10	D	36.9	Very low	35.6	Very low	159 Å²	159	159.2 Å²	159.2	85%	0.85	83%	0.833	S	S	*	*	S	Bend	trans	66.9	62	179.8	-62.4	-26.7	0	0	0	118
11	S	35.4	Very low	35.5	Very low	118 Å²	118	159.4 Å²	159.4	83%	0.825	84%	0.836	S	S	*	*			trans	-165.7	30	134.7	-84	0	0	0	0	115.7	R13	S11-R13 PolarHBondContact O-N 2.84Å
12	L	36.8	Very low	35.5	Very low	182 Å²	182	152.3 Å²	152.3	95%	0.953	82%	0.821	S	S	*	*	S	Bend	trans	-80.7	65.1	159.6	-99.4	169.5	0	0	0	110.1
13	R	37.7	Very low	35.6	Very low	220 Å²	220	151.4 Å²	151.4	83%	0.83	83%	0.827	S	S	*	*			trans	-158.7	138.4	172.7	-109.6	165.4	-149.1	-106.5	0.8	113.4	S11	S11-R13 PolarHBondContact O-N 2.84Å
14	N	35.7	Very low	35.2	Very low	151 Å²	151	150.9 Å²	150.9	81%	0.807	82%	0.824	S	S	*	*			trans	70.1	94	159.8	-59.6	5.1	0	0	0	118.3
15	N	32.1	Very low	34.9	Very low	152 Å²	152	148.2 Å²	148.2	81%	0.813	82%	0.818	S	S	*	*			trans	-60.6	177.8	155	-67.4	-33.1	0	0	0	113
16	T	37.1	Very low	34.8	Very low	123 Å²	123	146.5 Å²	146.5	76%	0.755	81%	0.808	S	S	*	*			trans	101	107.2	151.6	69.6	0	0	0	0	120.5
17	S	35.2	Very low	34.4	Very low	109 Å²	109	146.8 Å²	146.8	76%	0.762	81%	0.811	S	S	*	*				74.3	160.2	127.7	82.6	0	0	0	0	119.8
18	V	33	Very low	34.2	Very low	133 Å²	133	138.3 Å²	138.3	81%	0.806	80%	0.799	S	S	*	*			cis	-167.7	160.4	-21.3	129.5	0	0	0	0	108.2
19	S	32.6	Very low	34.3	Very low	94 Å²	94	137.7 Å²	137.7	66%	0.657	80%	0.796	S	S	*	*			trans	74.4	130.9	168.4	-162.5	0	0	0	0	116.3
20	I	32.6	Very low	34.2	Very low	141 Å²	141	135.1 Å²	135.1	72%	0.723	80%	0.796	S	S	*	*			cis	99.4	134.4	25.5	-63	165.1	0	0	0	114.1
21	N	34	Very low	34.2	Very low	165 Å²	165	132.9 Å²	132.9	88%	0.882	79%	0.791	S	S	*	*			trans	76.8	146.1	172.8	-67.9	-23.5	0	0	0	119.4
22	G	34	Very low	34.1	Very low	80 Å²	80	134.6 Å²	134.6	83%	0.825	79%	0.79	S	S	*	*			trans	-173.7	-90.2	-177.2	0	0	0	0	0	115.4
23	G	34.5	Very low	33.7	Very low	79 Å²	79	131.7 Å²	131.7	81%	0.814	78%	0.775	S	S	*	*			trans	77.5	-171.8	-171.6	0	0	0	0	0	113.5
24	N	31.3	Very low	33.6	Very low	149 Å²	149	130.3 Å²	130.3	80%	0.797	78%	0.778	S	S	*	*			cis	-165.2	155	-24	-158.7	4	0	0	0	110.3
25	I	31.9	Very low	33.3	Very low	139 Å²	139	130.6 Å²	130.6	71%	0.713	78%	0.78	S	S	*	*			trans	63.5	148.7	160.5	-4.1	174.6	0	0	0	123.5
26	I	34.7	Very low	33.4	Very low	137 Å²	137	129 Å²	129	70%	0.703	78%	0.781	S	S	*	*			trans	91.7	106.5	151.7	-60.8	171.4	0	0	0	121.7
27	N	29	Very low	33.1	Very low	161 Å²	161	131.4 Å²	131.4	86%	0.861	78%	0.783	S	S	*	*			trans	37.3	150	130.5	-48	-7.4	0	0	0	125.5
28	G	34.3	Very low	32.9	Very low	64 Å²	64	137.2 Å²	137.2	66%	0.66	79%	0.79	S	S	*	*			trans	104.6	143.6	158.3	0	0	0	0	0	114.4
29	D	36.7	Very low	32.7	Very low	169 Å²	169	135.3 Å²	135.3	90%	0.904	78%	0.782	S	S	*	*			cis	-156.9	168.5	-15	-104.2	-47.5	0	0	0	109.4
30	S	32.4	Very low	32.6	Very low	112 Å²	112	136 Å²	136	78%	0.783	79%	0.787	S	S	*	*			trans	-84.9	155.3	173	-58.4	0	0	0	0	111.7
31	P	37.7	Very low	32.5	Very low	112 Å²	112	140.1 Å²	140.1	73%	0.727	79%	0.793	S	S	*	*				-156.8	160.4	94.4	40.6	-21.8	0	0	0	118.6
32	L	32.6	Very low	32.2	Very low	155 Å²	155	137 Å²	137	81%	0.812	79%	0.785	S	S	*	*			trans	39.8	119.1	136.1	-59.5	169.4	0	0	0	120.4
33	N	28.7	Very low	32.1	Very low	121 Å²	121	144.4 Å²	144.4	65%	0.647	79%	0.789	S	S	*	*				82	114.5	62.3	174.9	39.2	0	0	0	115.7
34	Q	35.8	Very low	32	Very low	191 Å²	191	145.1 Å²	145.1	89%	0.893	78%	0.782	S	S	*	*			trans	-164.1	147.4	136.1	-111.8	161.4	70	0	0	113.3
35	N	28.5	Very low	32	Very low	157 Å²	157	144.8 Å²	144.8	84%	0.84	78%	0.78	S	S	*	*			trans	-107	155	177.5	-77.5	-45.9	0	0	0	111.5
36	S	34.4	Very low	32.2	Very low	119 Å²	119	145 Å²	145	83%	0.832	78%	0.782	S	S	*	*			trans	-152.5	130.2	151.7	60.7	0	0	0	0	112.5
37	H	31.2	Very low	32.2	Very low	173 Å²	173	146.8 Å²	146.8	80%	0.801	79%	0.788	S	S	*	*			trans	-68.8	157	170	-75.9	-113.9	0	0	0	111.8
38	Y	31.9	Very low	32.5	Very low	231 Å²	231	142 Å²	142	91%	0.906	78%	0.777	S	S	*	*				-154.8	163.8	126.7	-123.9	-85.8	0	0	0	110.9
39	S	28	Very low	32.4	Very low	92 Å²	92	144 Å²	144	64%	0.643	78%	0.78	S	S	*	*			trans	-148.8	162.6	-175.3	-62.5	0	0	0	0	113.6
40	S	29.5	Very low	32.4	Very low	109 Å²	109	145 Å²	145	76%	0.762	78%	0.78	S	S	*	*			trans	106.2	148.9	141.5	84.1	0	0	0	0	121.1
41	R	30.9	Very low	32.3	Very low	227 Å²	227	145 Å²	145	86%	0.857	78%	0.78	S	S	*	*			trans	73.4	92	154	-73.1	177.4	173.2	-178.8	-2.3	121.3
42	S	27.4	Very low	32.1	Very low	100 Å²	100	144.1 Å²	144.1	70%	0.699	78%	0.782	S	S	*	*				4.8	137.5	118.4	58.6	0	0	0	0	119.9
43	Y	32.6	Very low	32.1	Very low	236 Å²	236	144 Å²	144	93%	0.925	78%	0.781	S	S	*	*			trans	-141	162	145.9	-120.7	-91.6	0	0	0	109.7
44	S	31.6	Very low	32	Very low	93 Å²	93	145.3 Å²	145.3	65%	0.65	79%	0.787	S	S	*	*			trans	-135.8	170.1	-166.4	-50.5	0	0	0	0	113.7
45	N	32.5	Very low	31.9	Very low	142 Å²	142	144.8 Å²	144.8	76%	0.759	79%	0.785	S	S	*	*			trans	82.9	129.6	160	-58	1.9	0	0	0	119.1
46	D	34.8	Very low	31.9	Very low	143 Å²	143	144.4 Å²	144.4	77%	0.765	78%	0.783	S	S	*	*				144.4	145	127.1	-79.7	-8.2	0	0	0	113
47	H	34.7	Very low	31.4	Very low	176 Å²	176	143.9 Å²	143.9	82%	0.815	78%	0.778	S	S	*	*			cis	-160.1	146.8	-38.3	-146.1	-75.8	0	0	0	110.6
48	G	35.5	Very low	31.3	Very low	61 Å²	61	141.4 Å²	141.4	63%	0.629	77%	0.77	S	S	*	*			trans	90.7	167.8	153.2	0	0	0	0	0	120
49	S	33.7	Very low	31.2	Very low	105 Å²	105	138.9 Å²	138.9	73%	0.734	76%	0.759	S	S	*	*			cis	173.8	119.5	-33.7	41.9	0	0	0	0	111.3
50	E	35.5	Very low	31.2	Very low	191 Å²	191	139.4 Å²	139.4	89%	0.893	76%	0.755	S	S	*	*			trans	168	123.8	146.7	-97.6	177.7	124.1	0	0	107.1
51	S	31.5	Very low	31.1	Very low	112 Å²	112	142 Å²	142	78%	0.783	75%	0.753	S	S	*	*			cis	94	148.3	18.7	-52.7	0	0	0	0	115.4
52	A	33.2	Very low	31	Very low	93 Å²	93	136.2 Å²	136.2	77%	0.769	74%	0.742	S	S	*	*			trans	70.3	148.3	-179.2	0	0	0	0	0	116.8
53	L	31.5	Very low	31	Very low	151 Å²	151	137.7 Å²	137.7	79%	0.791	75%	0.747	S	S	*	*			cis	-155.3	136.1	-20.8	-97.3	168.1	0	0	0	104.7
54	L	27.4	Very low	31	Very low	150 Å²	150	135.7 Å²	135.7	79%	0.785	74%	0.743	S	S	*	*				74.1	154.4	85.9	-154.9	71.4	0	0	0	115
55	E	33.2	Very low	31.1	Very low	179 Å²	179	136.7 Å²	136.7	84%	0.836	75%	0.748	S	S	*	*			trans	73.4	110.3	179.3	-55.2	-174.9	139.5	0	0	114
56	D	28.2	Very low	31	Very low	150 Å²	150	136 Å²	136	80%	0.802	75%	0.748	S	S	*	*			cis	86.4	148.9	29.4	-155.7	14.8	0	0	0	114.3
57	C	25.7	Very low	30.8	Very low	107 Å²	107	134.8 Å²	134.8	72%	0.723	75%	0.746	S	S	*	*			trans	64.2	147.7	179	-72.8	0	0	0	0	117.3
58	D	29.1	Very low	30.5	Very low	121 Å²	121	129.6 Å²	129.6	65%	0.647	73%	0.727	S	S	*	*			cis	-160.2	169	-20.2	-154.4	3	0	0	0	110.3
59	R	29.2	Very low	30.6	Very low	178 Å²	178	134.9 Å²	134.9	67%	0.672	73%	0.728	S	S	*	*			trans	56.9	137.4	141.7	-83.5	170.4	-170.2	-77.7	-4.7	126.2
60	D	28.2	Very low	30.6	Very low	103 Å²	103	134.4 Å²	134.4	55%	0.551	72%	0.722	S	S	*	*				66.5	148.8	127.5	-57	-17.2	0	0	0	119.8
61	F	27.2	Very low	30.5	Very low	164 Å²	164	129.4 Å²	129.4	72%	0.719	70%	0.704	S	S	*	*			cis	-159	154.5	0.6	-129.6	-149.1	0	0	0	110.9
62	V	28	Very low	30.4	Very low	106 Å²	106	130.3 Å²	130.3	64%	0.642	70%	0.7	S	S	*	*				40.1	128.4	118.5	168.1	0	0	0	0	117.9
63	T	27.8	Very low	30.2	Very low	131 Å²	131	128.9 Å²	128.9	80%	0.804	70%	0.695	S	S	*	*			cis	-163.9	-177.9	19.2	1.9	0	0	0	0	115.4
64	K	33	Very low	30.2	Very low	193 Å²	193	127.5 Å²	127.5	84%	0.839	69%	0.688	S	S	*	*			trans	-71.2	-163.5	160.9	-56.3	175.4	-178.9	171.5	0	110.8
65	P	33.4	Very low	30.4	Very low	115 Å²	115	127.4 Å²	127.4	75%	0.747	68%	0.681	S	S	*	*			cis	-149.4	176.7	5.1	46.5	-25.4	0	0	0	120.2
66	V	29.8	Very low	30.3	Very low	126 Å²	126	129.7 Å²	129.7	76%	0.764	68%	0.682	S	S	*	*			trans	59.2	112.9	135.1	170	0	0	0	0	124.9
67	V	31.2	Very low	30.5	Very low	118 Å²	118	129.1 Å²	129.1	72%	0.715	68%	0.679	S	S	*	*				48.1	134.1	126.5	-168.5	0	0	0	0	124.2
68	T	28.8	Very low	30.9	Very low	68 Å²	68	130.1 Å²	130.1	42%	0.417	69%	0.687	S	S	.	*				173.6	-177.6	124	38.4	0	0	0	0	114.6	G294 T296	T68-G294 WeakPolarHBondContact CB-O 3.37Å; T68-G294 WeakPolarHBondContact CG2-O 3.47Å; T68-T296 CarbonylContact C-O 3.52Å; T68-T296 VanDerWaalsContact CA-O 3.28Å; T68-T296 WeakPolarHBondContact CA-O 3.33Å; T68-T296 VanDerWaalsContact CB-N 3.31Å; T68-T296 PolarHBondContact N-O 2.94Å; T68-T296 CarbonylContact O-C 3.57Å; T68-T296 PolarHBondContact OG1-N 2.86Å; T68-T296 PolarHBondContact OG1-O 2.87Å; T68-T296 VanDerWaalsContact OG1-O 3.06Å
69	R	37.4	Very low	31	Very low	172 Å²	172	130.6 Å²	130.6	65%	0.649	70%	0.695	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-139.6	143.5	-168.8	-49.3	158.4	165.7	-177.8	-2.7	117.9	S293 G294 G295	R69-S293 WeakPolarHBondContact CD-O 3.21Å; R69-S293 PolarHBondContact NH1-O 3.47Å; R69-G294 VanDerWaalsContact N-C 3.3Å; R69-G294 PolarHBondContact N-O 2.96Å; R69-G294 CarbonylContact O-C 3.59Å; R69-G294 WeakPolarHBondContact O-CA 3.24Å; R69-G294 PolarHBondContact O-N 2.79Å; R69-G295 CarbonylContact C-O 3.57Å; R69-G295 VanDerWaalsContact N-C 3.34Å; R69-G295 CarbonylContact O-C 3.54Å; R69-G295 WeakPolarHBondContact O-CA 3.48Å; R69-G295 PolarHBondContact O-N 2.97Å; R69-G295 VanDerWaalsContact O-O 3.08Å
70	P	33.7	Very low	31.2	Very low	95 Å²	95	126.4 Å²	126.4	62%	0.617	70%	0.698	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-78.1	161.9	161.4	-18.5	33.3	0	0	0	112.9	S292 S293 G295	P70-S292 PolarHBondContact O-OG 3.17Å; P70-S293 PolarHBondContact O-N 2.73Å; P70-S293 VanDerWaalsContact O-N 3.11Å; P70-G295 WeakPolarHBondContact CD-O 3.31Å; P70-G295 VanDerWaalsContact N-O 3.09Å
71	T	32.3	Very low	31.2	Very low	85 Å²	85	128 Å²	128	52%	0.521	71%	0.712	S	S	.	*			cis	106	126.8	-8.2	-50.4	0	0	0	0	114.3	S292 S293	T71-S292 VanDerWaalsContact N-CB 3.32Å; T71-S292 PolarHBondContact N-OG 3.4Å; T71-S293 VanDerWaalsContact OG1-CA 3.32Å; T71-S293 WeakPolarHBondContact OG1-CA 3.39Å; T71-S293 VanDerWaalsContact OG1-CB 3.25Å; T71-S293 WeakPolarHBondContact OG1-CB 3.43Å
72	L	30.7	Very low	31.4	Very low	131 Å²	131	123.8 Å²	123.8	69%	0.686	71%	0.714	S	S	*	*			cis	-159.7	154.7	-37.3	-170.9	82.2	0	0	0	107.7
73	G	29.2	Very low	31.5	Very low	64 Å²	64	123.8 Å²	123.8	66%	0.66	72%	0.719	S	S	*	*			trans	107.5	155.3	164.4	0	0	0	0	0	116.4
74	D	31	Very low	31.7	Very low	121 Å²	121	122.9 Å²	122.9	65%	0.647	72%	0.718	S	S	*	*			cis	-163.4	150.9	-7.4	-151.5	9.3	0	0	0	112.9
75	K	30.6	Very low	31.6	Very low	149 Å²	149	119.6 Å²	119.6	65%	0.648	72%	0.719	S	S	*	*			trans	32	133.8	153.3	-71.1	158.1	-159.5	124.4	0	120.7
76	R	32.9	Very low	31.5	Very low	226 Å²	226	119.9 Å²	119.9	85%	0.853	72%	0.724	S	S	*	*				-166.4	158.2	62	-105.5	116.4	-167.3	-120.5	10.9	115
77	N	30.6	Very low	31.7	Very low	139 Å²	139	117.2 Å²	117.2	74%	0.743	72%	0.722	S	S	*	*			trans	-38.7	157.3	165.6	-42.7	-4.7	0	0	0	117.4
78	S	34.7	Very low	31.6	Very low	127 Å²	127	119.4 Å²	119.4	89%	0.888	73%	0.728	S	S	*	*				-159.3	157.8	103.9	-79.4	0	0	0	0	112.9
79	T	30.5	Very low	31.8	Very low	132 Å²	132	119.2 Å²	119.2	81%	0.81	74%	0.74	S	S	*	*			trans	-122.9	140.3	-165.1	47.2	0	0	0	0	113.5
80	A	34	Very low	31.5	Very low	89 Å²	89	116.9 Å²	116.9	74%	0.736	75%	0.745	S	S	*	*			trans	-165.4	125.5	144	0	0	0	0	0	107.5
81	T	29.4	Very low	31.5	Very low	137 Å²	137	120.8 Å²	120.8	84%	0.84	76%	0.757	S	S	*	*				65	106.9	50.1	71.1	0	0	0	0	114
82	G	30.8	Very low	32	Very low	75 Å²	75	122.4 Å²	122.4	77%	0.773	77%	0.769	S	S	*	*			trans	-168.2	41.7	-173.2	0	0	0	0	0	117.3
83	S	30.4	Very low	32.1	Very low	107 Å²	107	119.9 Å²	119.9	75%	0.748	78%	0.775	S	S	*	*			trans	24.1	110	150.8	56.1	0	0	0	0	122.1
84	S	30.5	Very low	32.3	Very low	111 Å²	111	120.3 Å²	120.3	78%	0.776	78%	0.779	S	S	*	*				39.3	136	123.9	64.2	0	0	0	0	123.4
85	S	32.1	Very low	32.5	Very low	124 Å²	124	120.1 Å²	120.1	87%	0.867	79%	0.788	S	S	*	*				-170.4	173.2	125.7	41.4	0	0	0	0	112
86	S	31.9	Very low	32.6	Very low	122 Å²	122	119.5 Å²	119.5	85%	0.853	79%	0.791	S	S	*	*			trans	-132.5	154.2	-163.8	-45.6	0	0	0	0	114.1
87	G	32.9	Very low	32.6	Very low	70 Å²	70	119.1 Å²	119.1	72%	0.722	79%	0.79	S	S	*	*			trans	-168.6	123.6	161.7	0	0	0	0	0	108.8
88	I	28.9	Very low	32.7	Very low	163 Å²	163	118.7 Å²	118.7	84%	0.836	79%	0.792	S	S	*	*			cis	86.6	121	36.9	-57.6	174.1	0	0	0	112.6
89	G	32.8	Very low	32.6	Very low	65 Å²	65	116 Å²	116	67%	0.67	79%	0.785	S	S	*	*			trans	149.6	68.1	-173.4	0	0	0	0	0	112.5
90	T	32.3	Very low	32.8	Very low	122 Å²	122	114.8 Å²	114.8	75%	0.748	78%	0.782	S	S	*	*				48.9	131.6	74.2	54	0	0	0	0	114.1
91	M	33.4	Very low	32.8	Very low	177 Å²	177	117.1 Å²	117.1	87%	0.872	78%	0.781	S	S	*	*			cis	-153.6	-177.4	36.1	-107.2	-121	160.6	0	0	114.5
92	P	42.9	Very low	32.9	Very low	119 Å²	119	116.9 Å²	116.9	77%	0.773	77%	0.774	S	S	*	*			trans	-128.9	-156.1	-145.3	48.5	-37.5	0	0	0	116.7
93	G	32.4	Very low	32.8	Very low	78 Å²	78	120 Å²	120	80%	0.804	78%	0.778	S	S	*	*			trans	-158.7	-2.1	178.4	0	0	0	0	0	124
94	G	33.9	Very low	32.8	Very low	73 Å²	73	118.8 Å²	118.8	75%	0.753	77%	0.774	S	S	*	*			trans	72.3	-178.1	176.4	0	0	0	0	0	116.3
95	S	35.3	Very low	32.7	Very low	118 Å²	118	121.3 Å²	121.3	83%	0.825	78%	0.778	S	S	*	*			cis	-178.8	161.3	-11.5	-98.4	0	0	0	0	109.6
96	N	32	Very low	32.8	Very low	136 Å²	136	120.8 Å²	120.8	73%	0.727	77%	0.774	S	S	*	*			cis	-172.2	164.2	-27.6	-154.5	-41.5	0	0	0	109.9
97	R	33.1	Very low	32.7	Very low	218 Å²	218	118 Å²	118	82%	0.823	77%	0.765	S	S	*	*			trans	70.3	153.3	163	-59.7	-169.1	172.8	172.2	-3.1	120
98	T	33.6	Very low	32.7	Very low	130 Å²	130	124.1 Å²	124.1	80%	0.798	77%	0.772	S	S	*	*			cis	-164.7	139.7	-17.3	24	0	0	0	0	113.6
99	G	32.1	Very low	32.8	Very low	70 Å²	70	122.2 Å²	122.2	72%	0.722	76%	0.76	S	S	*	*			trans	75.5	165	141.9	0	0	0	0	0	121.4
100	S	33.8	Very low	32.7	Very low	107 Å²	107	126.9 Å²	126.9	75%	0.748	76%	0.762	S	S	*	*			cis	-169.6	157	-15.5	-90.2	0	0	0	0	113.1
101	N	34.2	Very low	32.7	Very low	137 Å²	137	126.3 Å²	126.3	73%	0.733	75%	0.754	S	S	*	*			trans	69.3	135.9	162.3	-53.5	-20.3	0	0	0	118.5
102	I	31	Very low	32.6	Very low	133 Å²	133	125 Å²	125	68%	0.682	74%	0.743	S	S	*	*			cis	101.2	117.8	16.2	-60.1	161.9	0	0	0	114.8
103	V	30.4	Very low	32	Very low	140 Å²	140	128.3 Å²	128.3	85%	0.848	75%	0.746	S	S	*	*			trans	173.2	150.6	131.6	153.8	0	0	0	0	109.1
104	A	29.5	Very low	32.1	Very low	82 Å²	82	129.2 Å²	129.2	68%	0.678	74%	0.737	S	S	*	*			trans	-123.8	174.3	-173.4	0	0	0	0	0	113.1
105	L	29.4	Very low	31.7	Very low	163 Å²	163	133 Å²	133	85%	0.853	74%	0.739	S	S	*	*			trans	-178	142	145.4	-102.3	161.3	0	0	0	114
106	S	32.4	Very low	31.3	Very low	113 Å²	113	133.4 Å²	133.4	79%	0.79	74%	0.737	S	S	*	*			trans	26.2	150.2	152.3	57.6	0	0	0	0	122.9
107	G	30	Very low	31	Very low	64 Å²	64	131.9 Å²	131.9	66%	0.66	74%	0.737	S	S	*	*			cis	144.1	164.8	3.6	0	0	0	0	0	112.7
108	F	32.5	Very low	30.9	Very low	198 Å²	198	130.9 Å²	130.9	87%	0.868	73%	0.733	S	S	*	*			trans	68.8	157.8	176.6	-70.5	-97.7	0	0	0	118.9
109	E	32.2	Very low	30.7	Very low	123 Å²	123	132 Å²	132	58%	0.575	73%	0.73	S	S	*	*				177.1	130.1	-55	161.6	168.3	165.2	0	0	112.5
110	K	31.4	Very low	30.7	Very low	164 Å²	164	132.3 Å²	132.3	71%	0.713	73%	0.732	S	S	*	*			trans	61	174.8	157.5	-77.2	171.8	-160.1	157.1	0	118.4
111	D	32.1	Very low	30.7	Very low	109 Å²	109	132.8 Å²	132.8	58%	0.583	73%	0.731	S	S	*	*			cis	-145.2	155.7	-3.4	-133.3	-12.5	0	0	0	114.6
112	K	30	Very low	30.6	Very low	151 Å²	151	134.1 Å²	134.1	66%	0.657	73%	0.73	S	S	*	*			trans	28.1	132	142.9	-77.7	169.1	-172.2	167.3	0	126
113	F	29.9	Very low	30.7	Very low	188 Å²	188	135.9 Å²	135.9	83%	0.825	74%	0.735	S	S	*	*			trans	64.5	175.3	130.8	-77.8	-52.1	0	0	0	120.6
114	P	35.4	Very low	30.7	Very low	96 Å²	96	134.2 Å²	134.2	62%	0.623	73%	0.73	S	S	*	*			cis	-137.8	-177	-34.6	34.7	-15.6	0	0	0	115.6
115	L	25.1	Very low	30.8	Very low	152 Å²	152	140.1 Å²	140.1	80%	0.796	74%	0.74	S	S	*	*			trans	71.3	156.1	140.2	-87.8	163.6	0	0	0	123.4
116	T	27.4	Very low	30.8	Very low	127 Å²	127	140.7 Å²	140.7	78%	0.779	74%	0.74	S	S	*	*			trans	67.1	138.8	172.4	63.2	0	0	0	0	117
117	S	26.2	Very low	31.1	Very low	104 Å²	104	140.8 Å²	140.8	73%	0.727	74%	0.738	S	S	*	*			cis	88.9	113.2	23.1	-169.1	0	0	0	0	115.9
118	R	29.7	Very low	31.2	Very low	197 Å²	197	144.3 Å²	144.3	74%	0.743	75%	0.747	S	S	*	*				178.8	132.8	121.7	-95.2	179.1	98.8	125.4	16.7	114.6
119	E	29.5	Very low	31	Very low	155 Å²	155	140.5 Å²	140.5	72%	0.724	74%	0.74	S	S	*	*			trans	39.7	123	134.1	-58.8	170.3	161.5	0	0	122.8
120	G	32.6	Very low	31	Very low	75 Å²	75	141 Å²	141	77%	0.773	75%	0.752	S	S	*	*				129.9	156.9	117.1	0	0	0	0	0	119.4
121	V	33.3	Very low	30.9	Very low	118 Å²	118	140.1 Å²	140.1	72%	0.715	75%	0.75	S	S	*	*			cis	-167.2	142.7	-23.4	96.5	0	0	0	0	110.9
122	K	33.1	Very low	30.7	Very low	165 Å²	165	140.1 Å²	140.1	72%	0.717	75%	0.75	S	S	*	*			trans	64.3	164.2	162.8	-66.5	169.2	-163.7	169	0	116.6
123	Q	32.9	Very low	30.9	Very low	170 Å²	170	141 Å²	141	79%	0.794	76%	0.756	S	S	*	*			cis	-145.8	158.1	-4.8	-134.9	149.8	-17.4	0	0	113.2
124	S	30	Very low	31	Very low	104 Å²	104	136.1 Å²	136.1	73%	0.727	75%	0.745	S	S	*	*			trans	-92.7	160.2	-178.7	48.8	0	0	0	0	114.3
125	K	32.3	Very low	30.9	Very low	206 Å²	206	138.1 Å²	138.1	90%	0.896	75%	0.75	S	S	*	*				-172.7	147.3	120.8	-108	179.3	176.9	-175.6	0	115.8
126	M	28.9	Very low	31.2	Very low	175 Å²	175	136.7 Å²	136.7	86%	0.862	74%	0.744	S	S	*	*			trans	-95.1	-163.7	163.6	-65.1	174.8	160.3	0	0	109.8
127	P	37.9	Very low	31.5	Very low	115 Å²	115	134.7 Å²	134.7	75%	0.747	74%	0.735	S	S	*	*				-122.4	-162.7	-61.2	34.4	-17.5	0	0	0	110.2
128	V	32.4	Very low	31.9	Very low	139 Å²	139	137.5 Å²	137.5	84%	0.842	74%	0.737	S	S	*	*			trans	-172	158.9	131.9	137.8	0	0	0	0	111.5
129	V	28.2	Very low	32.1	Very low	118 Å²	118	133.2 Å²	133.2	72%	0.715	73%	0.729	S	S	*	*			trans	-101.8	147.2	-172.3	174.5	0	0	0	0	112.1
130	T	32.1	Very low	32.3	Very low	134 Å²	134	134.1 Å²	134.1	82%	0.822	73%	0.73	S	S	*	*			trans	159.7	167.8	139.6	35	0	0	0	0	109.6
131	Q	29.1	Very low	32.2	Very low	145 Å²	145	135.3 Å²	135.3	68%	0.678	73%	0.727	S	S	*	*				-171.9	155.2	-59.5	-143.8	-175.6	-74.5	0	0	105.7
132	D	29.5	Very low	32.2	Very low	109 Å²	109	139.1 Å²	139.1	58%	0.583	73%	0.728	S	S	*	*			trans	77.2	137.6	153.2	-59.9	-29.4	0	0	0	124.1
133	H	33.5	Very low	32.1	Very low	169 Å²	169	137.9 Å²	137.9	78%	0.782	73%	0.725	S	S	*	*			trans	70	147.5	149.5	-68	-38.3	0	0	0	121.2
134	S	31.7	Very low	31.9	Very low	86 Å²	86	134.6 Å²	134.6	60%	0.601	72%	0.721	S	S	*	*			cis	-177.8	169.5	-27.2	-114.6	0	0	0	0	109.8
135	N	32.8	Very low	31.9	Very low	137 Å²	137	139 Å²	139	73%	0.733	72%	0.723	S	S	*	*			trans	74	118.6	160.4	-64.1	4.8	0	0	0	116
136	D	33.3	Very low	31.9	Very low	122 Å²	122	139 Å²	139	65%	0.652	72%	0.717	S	S	*	*				79.7	139	78.2	-90.9	-43.2	0	0	0	113.2
137	S	32.5	Very low	32	Very low	86 Å²	86	136.9 Å²	136.9	60%	0.601	71%	0.714	S	S	*	*			cis	-167.7	170.2	-7.7	-137.6	0	0	0	0	112.8
138	Q	35.1	Very low	31.7	Very low	162 Å²	162	139.8 Å²	139.8	76%	0.757	72%	0.718	S	S	*	*			trans	73.2	134.1	147.5	-76.5	-177.4	32.2	0	0	124.6
139	N	33.8	Very low	31.7	Very low	108 Å²	108	140.2 Å²	140.2	58%	0.578	72%	0.715	S	S	*	*			trans	88.4	104	133.8	-76.7	-32.9	0	0	0	123.4
140	K	32.7	Very low	31.9	Very low	174 Å²	174	140 Å²	140	76%	0.757	71%	0.714	S	S	*	*				74.1	107.2	117.3	-70.9	176.5	-177.1	176.7	0	121.3
141	S	32.3	Very low	31.7	Very low	100 Å²	100	139.9 Å²	139.9	70%	0.699	71%	0.708	S	S	*	*				88.2	132.7	111.1	77.5	0	0	0	0	122.4
142	R	32.2	Very low	31.7	Very low	198 Å²	198	137.4 Å²	137.4	75%	0.747	71%	0.707	S	S	*	*			trans	79.5	131.5	148.9	-71.3	179.4	89.7	135.2	10.9	120.5
143	E	31.9	Very low	31.7	Very low	139 Å²	139	140.3 Å²	140.3	65%	0.65	72%	0.717	S	S	*	*			trans	64.6	92.1	138.1	-71.4	151.6	177.1	0	0	120.2
144	S	28.5	Very low	31.4	Very low	101 Å²	101	138.1 Å²	138.1	71%	0.706	71%	0.71	S	S	*	*				42.3	111	115.6	-167.5	0	0	0	0	119
145	Y	30.5	Very low	31.3	Very low	195 Å²	195	139.3 Å²	139.3	77%	0.765	71%	0.708	S	S	*	*				-173.9	164.8	113.5	-110.2	-77.9	0	0	0	110.7
146	R	30.3	Very low	31.2	Very low	208 Å²	208	141.7 Å²	141.7	79%	0.785	71%	0.706	S	S	*	*			trans	8.4	142.3	159	-77	168.9	175.1	128	-1.2	118.7
147	T	32.5	Very low	31.1	Very low	130 Å²	130	145 Å²	145	80%	0.798	71%	0.709	S	S	*	*			cis	-157.9	-172.7	49.4	-29.2	0	0	0	0	113.1
148	Q	31.2	Very low	31.1	Very low	176 Å²	176	150.7 Å²	150.7	82%	0.822	72%	0.724	S	S	*	*			trans	-86.4	-176.5	-171	-61.3	170.6	-39	0	0	114
149	L	31.9	Very low	31.1	Very low	148 Å²	148	147.2 Å²	147.2	78%	0.775	71%	0.713	S	S	*	*			trans	105.1	83.4	159.5	-67.1	141.6	0	0	0	117.7
150	T	32.6	Very low	31	Very low	114 Å²	114	152.7 Å²	152.7	70%	0.699	73%	0.727	S	S	*	*				58.1	140.1	117.7	54.7	0	0	0	0	122.4
151	D	28.9	Very low	31.2	Very low	131 Å²	131	147.3 Å²	147.3	70%	0.701	72%	0.722	S	S	*	*			trans	79.6	115.2	147.7	-86.8	-59.1	0	0	0	120.3
152	S	28	Very low	31.3	Very low	93 Å²	93	150.3 Å²	150.3	65%	0.65	73%	0.73	S	S	*	*				38.3	92.4	110.2	-46.1	0	0	0	0	116.3
153	Q	28.9	Very low	31.5	Very low	169 Å²	169	144.7 Å²	144.7	79%	0.79	73%	0.726	S	S	*	*				-172.9	155	112.5	-104.6	175.4	36	0	0	115
154	L	28.4	Very low	31.5	Very low	124 Å²	124	149.5 Å²	149.5	65%	0.649	74%	0.738	S	S	*	*			trans	86.4	138.7	136.5	-105.8	54.1	0	0	0	123.5
155	M	29.4	Very low	31.8	Very low	111 Å²	111	149 Å²	149	55%	0.547	74%	0.735	S	S	.	*			trans	72.8	120.7	150.9	-61	-31.6	178.4	0	0	117.9
156	R	30	Very low	32	Very low	187 Å²	187	144.5 Å²	144.5	71%	0.706	73%	0.732	S	S	*	*				65.3	143.3	66.8	-63.6	-173.8	-161.4	153.3	-0.8	110.8
157	R	32.2	Very low	32	Very low	190 Å²	190	140 Å²	140	72%	0.717	73%	0.732	S	S	*	*			cis	-168.2	148.5	35.2	-147.8	166.7	-172.3	172.9	-0.5	112.3	T159	R157-T159 HydrophobicContact CG-CG2 3.84Å
158	K	32.2	Very low	32.3	Very low	207 Å²	207	138.9 Å²	138.9	90%	0.9	73%	0.727	S	S	*	*			trans	161.9	73.3	159.8	-95.3	167.5	-178	-178.9	0	106.9
159	T	34.2	Very low	32.3	Very low	88 Å²	88	136.4 Å²	136.4	54%	0.54	72%	0.724	S	S	.	*				44.1	100.3	55.8	63.3	0	0	0	0	115.1	R157	R157-T159 HydrophobicContact CG-CG2 3.84Å
160	Y	33.1	Very low	32.2	Very low	223 Å²	223	135.1 Å²	135.1	88%	0.875	72%	0.722	S	S	*	*				167.8	132.6	117.5	-95	-74.4	0	0	0	109.1
161	G	35.8	Very low	32.1	Very low	62 Å²	62	133.9 Å²	133.9	64%	0.639	72%	0.718	S	S	*	*			cis	168.5	168.4	-11.4	0	0	0	0	0	113.3
162	N	34.5	Very low	32.2	Very low	162 Å²	162	133.4 Å²	133.4	87%	0.866	72%	0.72	S	S	*	*			trans	65.7	149.1	164.8	-61.8	-14.8	0	0	0	118
163	A	36	Very low	32.4	Very low	81 Å²	81	135 Å²	135	67%	0.669	72%	0.722	S	S	*	*			cis	-146.2	153	8.5	0	0	0	0	0	113.7
164	R	33.2	Very low	32.6	Very low	239 Å²	239	131.7 Å²	131.7	90%	0.902	71%	0.713	S	S	*	*			trans	45.5	147.1	138.4	-70.1	-179.9	178.1	-176.9	-1.9	121.6
165	S	34.1	Very low	32.7	Very low	91 Å²	91	133.2 Å²	133.2	64%	0.636	72%	0.722	S	S	*	*			cis	179.7	157.1	-17.6	48.2	0	0	0	0	109.7
166	S	34.7	Very low	32.8	Very low	100 Å²	100	131.9 Å²	131.9	70%	0.699	72%	0.724	S	S	*	*			trans	59	129.7	156.4	52.5	0	0	0	0	118.2
167	S	31.3	Very low	33	Very low	114 Å²	114	130.9 Å²	130.9	80%	0.797	73%	0.727	S	S	*	*			cis	67.5	148.8	37.4	-41.9	0	0	0	0	113.9
168	P	38.5	Very low	33	Very low	106 Å²	106	127.3 Å²	127.3	69%	0.688	73%	0.726	S	S	*	*			cis	-136.2	-163.9	-10	34.6	-11.9	0	0	0	113.9
169	T	30.5	Very low	33	Very low	125 Å²	125	125.8 Å²	125.8	77%	0.767	72%	0.722	S	S	*	*			trans	66.8	156.3	146.4	49.8	0	0	0	0	120.3
170	V	30.5	Very low	33	Very low	120 Å²	120	127.3 Å²	127.3	73%	0.727	73%	0.731	S	S	*	*			cis	-164.6	165.4	-17.6	127.3	0	0	0	0	108.8
171	S	29.5	Very low	33.2	Very low	88 Å²	88	122.3 Å²	122.3	62%	0.615	73%	0.726	S	S	*	*			trans	60.5	115.5	160.7	63.9	0	0	0	0	119.7
172	T	30.8	Very low	32.9	Very low	121 Å²	121	125.4 Å²	125.4	74%	0.742	73%	0.728	S	S	*	*				75.6	161.7	103.9	74.9	0	0	0	0	113.8
173	D	32.1	Very low	32.9	Very low	127 Å²	127	126.2 Å²	126.2	68%	0.679	73%	0.726	S	S	*	*			cis	-150	157	20.3	-109.1	-52.1	0	0	0	114.5
174	T	33.1	Very low	32.7	Very low	100 Å²	100	128.3 Å²	128.3	61%	0.613	73%	0.726	S	S	*	*			trans	53.7	127.1	146.2	59	0	0	0	0	125
175	N	30.6	Very low	32.3	Very low	155 Å²	155	122.3 Å²	122.3	83%	0.829	72%	0.72	S	S	*	*				66.7	159.9	127.2	-50.7	-11.7	0	0	0	119.4
176	S	32.8	Very low	32.3	Very low	84 Å²	84	126 Å²	126	59%	0.587	73%	0.73	S	S	*	*			cis	-147.2	162.9	7.3	75.1	0	0	0	0	113.5
177	E	33.2	Very low	32.1	Very low	166 Å²	166	127.1 Å²	127.1	78%	0.776	73%	0.729	S	S	*	*			trans	57.8	145.4	140.6	-64.9	159.9	138.3	0	0	121.1
178	T	31.6	Very low	32.1	Very low	115 Å²	115	129 Å²	129	71%	0.706	72%	0.724	S	S	*	*			cis	-162.4	168	-6.1	14.5	0	0	0	0	113.2
179	H	34	Very low	31.7	Very low	175 Å²	175	129.5 Å²	129.5	81%	0.81	73%	0.731	S	S	*	*			trans	79.1	96.5	148.3	-87.5	-64.8	0	0	0	124
180	V	32.5	Very low	31.7	Very low	119 Å²	119	127.7 Å²	127.7	72%	0.721	73%	0.728	S	S	*	*			trans	-63.3	144.4	140.8	169.3	0	0	0	0	109.5	N182	V180-N182 HydrophobicContact CG1-CB 4.19Å
181	P	38.4	Very low	31.5	Very low	119 Å²	119	129.5 Å²	129.5	77%	0.773	73%	0.733	S	S	*	*				-133.1	169.3	63.5	24.4	-0.3	0	0	0	115.7
182	N	28.3	Very low	31.5	Very low	126 Å²	126	130.2 Å²	130.2	67%	0.674	74%	0.738	S	S	*	*			cis	95.9	92.8	17.5	-169.4	85.8	0	0	0	117.5	V180	V180-N182 HydrophobicContact CG1-CB 4.19Å
183	E	35.3	Very low	31.4	Very low	179 Å²	179	135.3 Å²	135.3	84%	0.836	74%	0.744	S	S	*	*			trans	-148.6	116.4	154.4	-92.5	176.2	169.7	0	0	106.8
184	N	32.2	Very low	31.4	Very low	126 Å²	126	134.4 Å²	134.4	67%	0.674	75%	0.747	S	S	*	*				60.2	108.4	85.4	-65.4	-19.2	0	0	0	113.1
185	C	24.4	Very low	31.5	Very low	113 Å²	113	140.8 Å²	140.8	76%	0.764	76%	0.76	S	S	*	*				85.6	153.8	54.9	-68.6	0	0	0	0	114.4
186	I	33.6	Very low	31.6	Very low	167 Å²	167	142.5 Å²	142.5	86%	0.856	76%	0.76	S	S	*	*			trans	79.1	132	176.4	-52.1	169.9	0	0	0	114.6
187	D	30.5	Very low	32	Very low	124 Å²	124	150 Å²	150	66%	0.663	78%	0.775	S	S	*	*			cis	-165.9	174.7	-30.7	-143	-43.9	0	0	0	110.8
188	H	32.5	Very low	32	Very low	154 Å²	154	146.5 Å²	146.5	71%	0.713	78%	0.775	S	S	*	*			trans	71.4	108.9	152.1	-64	-6.8	0	0	0	121.8
189	S	29.7	Very low	32.1	Very low	117 Å²	117	152.2 Å²	152.2	82%	0.818	78%	0.783	S	S	*	*				103.1	138.4	121	77.9	0	0	0	0	123
190	A	29.5	Very low	32	Very low	86 Å²	86	148.3 Å²	148.3	71%	0.711	78%	0.776	S	S	*	*			trans	77.4	112.8	148.8	0	0	0	0	0	123.1
191	L	28	Very low	32	Very low	159 Å²	159	151.7 Å²	151.7	83%	0.832	78%	0.784	S	S	*	*			trans	51.7	113.9	141.9	-76	82.5	0	0	0	122.4
192	S	28.6	Very low	31.8	Very low	103 Å²	103	151.6 Å²	151.6	72%	0.72	78%	0.781	S	S	*	*			trans	80.4	156.2	132.2	83	0	0	0	0	121.7
193	R	29.3	Very low	32.4	Very low	228 Å²	228	151.3 Å²	151.3	86%	0.86	79%	0.786	S	S	*	*			trans	70.9	116.5	161.2	-68.1	179.3	167.9	-172.8	-4	120.3
194	S	30.9	Very low	32.2	Very low	107 Å²	107	153.3 Å²	153.3	75%	0.748	79%	0.786	S	S	*	*				58.7	126.6	126.5	-55.3	0	0	0	0	123.1
195	R	36.6	Very low	32.1	Very low	235 Å²	235	156.4 Å²	156.4	89%	0.887	80%	0.799	S	S	*	*			trans	34.6	115	140.9	-66.5	177.8	169.9	175.4	-3.1	118.3
196	K	32.1	Very low	32.3	Very low	191 Å²	191	154.8 Å²	154.8	83%	0.83	80%	0.801	S	S	*	*				176.8	131.8	115	-96.3	151.1	-170	168.4	0	117.6
197	R	40.4	Very low	32	Very low	241 Å²	241	151.4 Å²	151.4	91%	0.909	79%	0.792	S	S	*	*				25.2	133.5	123.2	-57.7	-179.1	178	-176.9	-1.3	121.4
198	A	33.6	Very low	31.8	Very low	93 Å²	93	152 Å²	152	77%	0.769	80%	0.801	S	S	*	*			trans	-157.3	155.2	140.8	0	0	0	0	0	108.2
199	R	34.3	Very low	31.6	Very low	234 Å²	234	147.9 Å²	147.9	88%	0.883	80%	0.799	S	S	*	*			cis	-157.4	132.8	-14.5	-109.1	175.2	171.5	158.8	-4.1	104.8
200	S	32	Very low	31.5	Very low	93 Å²	93	147.1 Å²	147.1	65%	0.65	79%	0.794	S	S	*	*				86.3	102.9	68.5	-178.8	0	0	0	0	114.8
201	E	32.1	Very low	31.4	Very low	190 Å²	190	149.7 Å²	149.7	89%	0.888	80%	0.796	S	S	*	*			trans	-119	164.6	143.9	-75.5	-138.1	125.4	0	0	109.7
202	V	34	Very low	31.4	Very low	117 Å²	117	148.8 Å²	148.8	71%	0.709	79%	0.792	S	S	*	*			trans	-123.8	140.2	-143.6	174.1	0	0	0	0	113.8
203	P	41.7	Very low	31.4	Very low	121 Å²	121	150.5 Å²	150.5	79%	0.786	79%	0.792	S	S	*	*			trans	-80.1	160.6	178.9	33.3	-38	0	0	0	114.6
204	R	30.4	Very low	31.2	Very low	220 Å²	220	144.2 Å²	144.2	83%	0.83	78%	0.783	S	S	*	*			trans	-149	106.5	165.9	-147.3	174	-171.2	138	0.3	107.7
205	M	30.7	Very low	31.1	Very low	192 Å²	192	143.8 Å²	143.8	95%	0.946	78%	0.78	S	S	*	*				55.9	116.4	76.2	-87.3	-163.3	168.1	0	0	115.5
206	G	27.6	Very low	31.3	Very low	79 Å²	79	140 Å²	140	81%	0.814	78%	0.777	S	S	*	*			trans	116.7	140.5	171.4	0	0	0	0	0	112.5
207	S	27	Very low	31.7	Very low	96 Å²	96	135.2 Å²	135.2	67%	0.671	77%	0.766	S	S	*	*			cis	-175.2	150.2	-12.7	176.9	0	0	0	0	108
208	T	27.4	Very low	31.1	Very low	137 Å²	137	130.2 Å²	130.2	84%	0.84	76%	0.757	S	S	*	*			trans	59.5	152	154.3	39.1	0	0	0	0	120.2
209	G	28.1	Very low	30.8	Very low	66 Å²	66	132.2 Å²	132.2	68%	0.68	75%	0.754	S	S	*	*			trans	90.2	90.1	174.2	0	0	0	0	0	112
210	S	28.1	Very low	30.5	Very low	102 Å²	102	131.3 Å²	131.3	71%	0.713	75%	0.75	S	S	*	*			cis	71.3	118.7	43.6	-45	0	0	0	0	114.4
211	N	27.6	Very low	30.4	Very low	139 Å²	139	131.7 Å²	131.7	74%	0.743	75%	0.753	S	S	*	*			trans	74.8	138.7	152.4	-53.7	-13.2	0	0	0	119.3
212	N	27.4	Very low	30.4	Very low	141 Å²	141	127.8 Å²	127.8	75%	0.754	74%	0.742	S	S	*	*			trans	68.4	154.9	143.3	-66	-0.5	0	0	0	118.9
213	L	27.2	Very low	30.2	Very low	139 Å²	139	128.2 Å²	128.2	73%	0.728	74%	0.74	S	S	*	*			cis	-169	145.8	-34.4	-154.1	79.3	0	0	0	106.4
214	S	26.9	Very low	29.6	Very low	95 Å²	95	128.1 Å²	128.1	66%	0.664	73%	0.733	S	S	*	*			trans	59	166.5	153.1	56.8	0	0	0	0	121
215	S	28.8	Very low	29.6	Very low	98 Å²	98	123.9 Å²	123.9	69%	0.685	73%	0.727	S	S	*	*			trans	55.9	106.7	145.3	56	0	0	0	0	117.7
216	N	40.7	Very low	29.5	Very low	155 Å²	155	121.5 Å²	121.5	83%	0.829	71%	0.713	S	S	*	*				48.1	149.6	50	-127.3	13.9	0	0	0	112.1
217	P	39	Very low	29.6	Very low	92 Å²	92	125.1 Å²	125.1	60%	0.597	71%	0.709	S	S	*	*			cis	-141.5	-151.1	6.2	23	6.6	0	0	0	112.6
218	L	28.1	Very low	29.7	Very low	136 Å²	136	127.1 Å²	127.1	71%	0.712	71%	0.712	S	S	*	*			trans	98.5	121.7	142.9	-66.4	174.4	0	0	0	121.8
219	L	28.1	Very low	29.8	Very low	134 Å²	134	125 Å²	125	70%	0.702	70%	0.703	S	S	*	*			trans	68.6	149.4	138.6	-58.1	166.7	0	0	0	117.2
220	R	28.1	Very low	29.8	Very low	216 Å²	216	130.4 Å²	130.4	82%	0.815	71%	0.711	S	S	*	*			cis	-144.8	129.9	0	-120.9	152.1	171.4	-178.8	-4.4	105.7
221	S	28.7	Very low	29.9	Very low	100 Å²	100	133.5 Å²	133.5	70%	0.699	72%	0.719	S	S	*	*				88.8	160.4	69.7	-169.7	0	0	0	0	112.3
222	V	31.8	Very low	30	Very low	109 Å²	109	129.8 Å²	129.8	66%	0.661	71%	0.714	S	S	*	*			trans	90.6	92.1	165.6	-170.4	0	0	0	0	115.9
223	N	30.6	Very low	30.1	Very low	126 Å²	126	129.2 Å²	129.2	67%	0.674	71%	0.706	S	S	*	*				61.9	166	129.1	-58.2	39.3	0	0	0	120
224	D	29.1	Very low	30.1	Very low	118 Å²	118	132.3 Å²	132.3	63%	0.631	71%	0.709	S	S	*	*			cis	-165.2	151.5	-33.3	-89.8	-18.4	0	0	0	106.5
225	D	30.1	Very low	30.3	Very low	131 Å²	131	133.7 Å²	133.7	70%	0.701	71%	0.713	S	S	*	*			trans	47.1	179.6	144.3	-56	-23.3	0	0	0	122
226	Q	29.1	Very low	30.3	Very low	142 Å²	142	133.2 Å²	133.2	66%	0.664	72%	0.715	S	S	*	*			trans	54.4	118	-177.1	-84.7	53.3	75.7	0	0	116
227	E	29.5	Very low	29.9	Very low	156 Å²	156	133 Å²	133	73%	0.729	71%	0.713	S	S	*	*				68.5	153.4	54.5	-58.4	179.4	132.7	0	0	114.1
228	D	28.8	Very low	29.6	Very low	138 Å²	138	135 Å²	135	74%	0.738	72%	0.718	S	S	*	*			trans	69.6	124.6	172.8	-68.1	-44.2	0	0	0	118.2
229	S	29.5	Very low	29.9	Very low	93 Å²	93	137.9 Å²	137.9	65%	0.65	73%	0.725	S	S	*	*			cis	89.1	154.4	49.6	-61.2	0	0	0	0	111.3
230	E	29.7	Very low	30.1	Very low	178 Å²	178	134.4 Å²	134.4	83%	0.832	72%	0.722	S	S	*	*			trans	64.9	108.8	170.8	-65.7	-179.1	-173.8	0	0	114.8
231	D	29.4	Very low	30.4	Very low	168 Å²	168	132 Å²	132	90%	0.898	73%	0.725	S	S	*	*				79.5	158.7	78.4	-93.4	-51.7	0	0	0	113.9
232	G	29.6	Very low	30.8	Very low	61 Å²	61	131.6 Å²	131.6	63%	0.629	72%	0.722	S	S	*	*			trans	118.6	141.3	154.7	0	0	0	0	0	117.4
233	E	28.7	Very low	30.8	Very low	128 Å²	128	136.6 Å²	136.6	60%	0.598	73%	0.729	S	S	*	*			trans	53.4	94.5	152.7	-89.7	16.4	-133.8	0	0	118.7
234	R	28	Very low	30.9	Very low	205 Å²	205	135.1 Å²	135.1	77%	0.774	73%	0.728	S	S	*	*				70.8	-179.1	56.1	-54.9	-174.3	170.6	95.9	-1.9	113.9
235	V	30.3	Very low	31.1	Very low	123 Å²	123	135 Å²	135	75%	0.745	73%	0.728	S	S	*	*			trans	67	60.4	-179.7	-161.3	0	0	0	0	112.2
236	A	30	Very low	31.3	Very low	89 Å²	89	135.5 Å²	135.5	74%	0.736	73%	0.729	S	S	*	*				67.1	138.4	64.9	0	0	0	0	0	114.8
237	L	32.1	Very low	31.5	Very low	151 Å²	151	136.9 Å²	136.9	79%	0.791	74%	0.735	S	S	*	*			trans	-175	117.1	132.3	-98.7	166.7	0	0	0	111.6
238	N	31.6	Very low	31.7	Very low	132 Å²	132	138 Å²	138	71%	0.706	74%	0.741	S	S	*	*			trans	39.2	127.5	130.7	-74.2	-21.5	0	0	0	120
239	K	34.3	Very low	32	Very low	198 Å²	198	139.5 Å²	139.5	86%	0.861	75%	0.749	S	S	*	*			cis	-154.9	165.4	13.9	-84	140.4	177.8	179.7	0	108.3
240	G	33.3	Very low	32.2	Very low	61 Å²	61	138.2 Å²	138.2	63%	0.629	75%	0.75	S	S	*	*			cis	148.9	153.1	-0.5	0	0	0	0	0	111.6
241	N	34.8	Very low	32.3	Very low	165 Å²	165	138.8 Å²	138.8	88%	0.882	75%	0.75	S	S	*	*			trans	66.3	140.5	-178.8	-62.6	10	0	0	0	115.6
242	S	36.2	Very low	32.6	Very low	91 Å²	91	137.2 Å²	137.2	64%	0.636	74%	0.737	S	S	*	*			cis	-160.1	141.3	-7	-101.9	0	0	0	0	108.2
243	R	32	Very low	33	Very low	215 Å²	215	140.4 Å²	140.4	81%	0.811	75%	0.745	S	S	*	*				58.7	123.7	89.5	-156.1	173.4	-177.1	-180	3.3	110.8
244	S	33.3	Very low	33.2	Very low	94 Å²	94	137.8 Å²	137.8	66%	0.657	75%	0.753	S	S	*	*			cis	-179.2	169.9	31.6	20.7	0	0	0	0	108.4
245	D	32.6	Very low	33.3	Very low	115 Å²	115	135.2 Å²	135.2	62%	0.615	75%	0.754	S	S	*	*			cis	-170	168.3	-15.2	-83.3	-21.3	0	0	0	106.6
246	I	34.5	Very low	33.4	Very low	143 Å²	143	135.7 Å²	135.7	73%	0.733	75%	0.752	S	S	*	*			trans	68.4	133.2	152.3	-72.1	157.4	0	0	0	118
247	E	34.4	Very low	33.6	Very low	170 Å²	170	139.5 Å²	139.5	79%	0.794	75%	0.753	S	S	*	*			cis	-156.9	-179.8	-8.9	-122.8	161.9	-161.6	0	0	111.7
248	E	33.2	Very low	33.4	Very low	181 Å²	181	139.8 Å²	139.8	85%	0.846	76%	0.755	S	S	*	*			trans	-74.2	156.1	-165.2	-51.1	175.7	122.1	0	0	115.9
249	D	34.6	Very low	33.6	Very low	169 Å²	169	138.6 Å²	138.6	90%	0.904	75%	0.752	S	S	*	*				-173	156.9	115.5	-133.4	-26.3	0	0	0	113.2
250	G	34.4	Very low	33.4	Very low	66 Å²	66	132.6 Å²	132.6	68%	0.68	75%	0.746	S	S	*	*			trans	101.2	39.2	141.4	0	0	0	0	0	123.7
251	F	31.1	Very low	33.4	Very low	189 Å²	189	137.2 Å²	137.2	83%	0.829	76%	0.755	S	S	*	*			trans	56.8	108.3	140.8	-126.3	-108.3	0	0	0	122.9
252	H	35.5	Very low	33.1	Very low	135 Å²	135	141.2 Å²	141.2	63%	0.625	76%	0.758	S	S	*	*			trans	70.3	111.5	135.6	-84.7	-95.7	0	0	0	124.6
253	T	38	Very low	32.8	Very low	128 Å²	128	140.7 Å²	140.7	79%	0.785	77%	0.767	S	S	*	*			trans	50.3	125.8	130.9	58.2	0	0	0	0	120.9
254	G	33.4	Very low	32.8	Very low	74 Å²	74	141.8 Å²	141.8	76%	0.763	77%	0.771	S	S	*	*			cis	-179	143.4	-2.2	0	0	0	0	0	112.6
255	N	30.5	Very low	32.5	Very low	151 Å²	151	145.8 Å²	145.8	81%	0.807	78%	0.779	S	S	*	*			trans	-94.4	-166	176.5	-70.2	-21.6	0	0	0	111
256	D	31.6	Very low	32.4	Very low	132 Å²	132	150.9 Å²	150.9	71%	0.706	79%	0.79	S	S	*	*			trans	85	146.3	160.7	-60.7	-13.3	0	0	0	117
257	F	34.2	Very low	32.1	Very low	169 Å²	169	155.9 Å²	155.9	74%	0.741	80%	0.799	S	S	*	*			cis	-140.1	139.1	1.5	-123	-55.9	0	0	0	111.4	V259	F257-V259 HydrophobicContact CB-CG2 4.48Å; F257-V259 HydrophobicContact CD1-CG2 3.69Å; F257-V259 HydrophobicContact CE1-CG2 4.31Å; F257-V259 HydrophobicContact CG-CG2 4.24Å
258	D	28.3	Very low	31.8	Very low	158 Å²	158	154.3 Å²	154.3	85%	0.845	79%	0.792	S	S	*	*			trans	-100.5	107.5	167.3	-179.3	16.9	0	0	0	110
259	V	35.5	Very low	31.5	Very low	106 Å²	106	152 Å²	152	64%	0.642	79%	0.79	S	S	*	*			trans	-148.2	111.3	178.4	-174.4	0	0	0	0	111.1	F257	F257-V259 HydrophobicContact CB-CG2 4.48Å; F257-V259 HydrophobicContact CD1-CG2 3.69Å; F257-V259 HydrophobicContact CE1-CG2 4.31Å; F257-V259 HydrophobicContact CG-CG2 4.24Å
260	G	30.5	Very low	31.2	Very low	72 Å²	72	153.5 Å²	153.5	74%	0.742	79%	0.785	S	S	*	*			trans	-96.5	144.5	169.6	0	0	0	0	0	113.5
261	I	33.4	Very low	30.9	Very low	159 Å²	159	159 Å²	159	82%	0.815	79%	0.793	S	S	*	*			trans	-139.4	147.1	173.4	-93.8	164.4	0	0	0	111.1
262	R	28.2	Very low	30.9	Very low	249 Å²	249	158 Å²	158	94%	0.94	80%	0.795	S	S	*	*			trans	-82.5	133.8	179.6	-59	170.4	178.5	164.7	-2.5	111.3
263	G	30.4	Very low	30.6	Very low	80 Å²	80	158.9 Å²	158.9	83%	0.825	80%	0.804	S	S	*	*			trans	-148.7	110	-179.2	0	0	0	0	0	115.2
264	R	30.2	Very low	30.1	Very low	237 Å²	237	159.4 Å²	159.4	89%	0.894	81%	0.807	S	S	*	*			trans	-58.4	153.5	177	-75.9	170.1	162.5	160.4	-7.3	115.2
265	H	28.9	Very low	30	Very low	179 Å²	179	167.6 Å²	167.6	83%	0.829	82%	0.815	S	S	*	*			trans	32.9	115.5	146.7	-71.8	-82.8	0	0	0	119.4
266	R	28.8	Very low	29.8	Very low	222 Å²	222	169.1 Å²	169.1	84%	0.838	82%	0.818	S	S	*	*				-157.7	143.2	117	-119	169.4	178.5	163.2	-0.9	112	Q268	R266-Q268 HydrophobicContact CB-CG 4.43Å; R266-Q268 PolarHBondContact O-N 2.63Å
267	R	29	Very low	29.6	Very low	248 Å²	248	173.3 Å²	173.3	94%	0.936	82%	0.824	S	S	*	*			trans	-65.7	119.5	152.6	-77.1	-179.8	171.8	177.3	-4.6	106.4
268	Q	28.4	Very low	29.4	Very low	137 Å²	137	173.5 Å²	173.5	64%	0.64	83%	0.832	S	S	*	*			trans	-122.9	93.8	164.3	-83.8	-176.2	-44.1	0	0	108.4	R266 Y270	R266-Q268 HydrophobicContact CB-CG 4.43Å; R266-Q268 PolarHBondContact O-N 2.63Å; Q268-Y270 PolarHBondContact O-N 2.8Å; Q268-Y270 VanDerWaalsContact O-N 3.08Å
269	T	26.8	Very low	29.3	Very low	131 Å²	131	170 Å²	170	80%	0.804	82%	0.821	S	S	*	*			trans	-57.7	105.6	154.9	45	0	0	0	0	107.4	Q271	T269-Q271 PolarHBondContact O-N 2.72Å
270	Y	28.6	Very low	29	Very low	201 Å²	201	170.4 Å²	170.4	79%	0.788	83%	0.828	S	S	*	*			trans	-68.6	98.8	169	-81.8	-88.9	0	0	0	108	Q268 L272	Q268-Y270 PolarHBondContact O-N 2.8Å; Q268-Y270 VanDerWaalsContact O-N 3.08Å; Y270-L272 PolarHBondContact O-N 3.49Å
271	Q	28	Very low	29.1	Very low	183 Å²	183	174.2 Å²	174.2	86%	0.855	83%	0.831	S	S	*	*			trans	-62.7	103.9	161.4	-75.3	-170.8	-48.3	0	0	107.3	T269 N273	T269-Q271 PolarHBondContact O-N 2.72Å; Q271-N273 PolarHBondContact O-N 3.18Å; Q271-N273 VanDerWaalsContact O-N 3.16Å
272	L	31.4	Very low	28.8	Very low	167 Å²	167	170.6 Å²	170.6	87%	0.874	83%	0.832	S	S	*	*			trans	-57.8	117.2	163.8	-82	160.7	0	0	0	107.3	Y270 T274	Y270-L272 PolarHBondContact O-N 3.49Å; L272-T274 PolarHBondContact O-N 2.8Å
273	N	29.1	Very low	28.9	Very low	153 Å²	153	167.5 Å²	167.5	82%	0.818	82%	0.821	S	S	*	*			trans	-52.8	133.8	169.7	-95.5	-18.6	0	0	0	108.5	Q271 R275	Q271-N273 PolarHBondContact O-N 3.18Å; Q271-N273 VanDerWaalsContact O-N 3.16Å; N273-R275 PolarHBondContact O-N 2.96Å
274	T	27.8	Very low	28.9	Very low	139 Å²	139	174.8 Å²	174.8	85%	0.853	83%	0.825	S	S	*	*			trans	-57.7	95	-176.7	51.1	0	0	0	0	110.9	L272 Q276	L272-T274 PolarHBondContact O-N 2.8Å; T274-Q276 PolarHBondContact O-N 2.9Å
275	R	29.3	Very low	29	Very low	246 Å²	246	169.9 Å²	169.9	93%	0.928	82%	0.821	S	S	*	*			trans	-69.2	115.8	168.2	-94.2	-170	169.5	-175.9	-2.4	107.7	N273	N273-R275 PolarHBondContact O-N 2.96Å
276	Q	28.3	Very low	29.1	Very low	184 Å²	184	172.9 Å²	172.9	86%	0.86	83%	0.825	S	S	*	*			trans	-57.5	144.2	179.5	-172.7	171	-19.4	0	0	110.4	T274 D278	T274-Q276 PolarHBondContact O-N 2.9Å; Q276-D278 PolarHBondContact O-N 2.81Å
277	R	26.9	Very low	29.2	Very low	219 Å²	219	166.8 Å²	166.8	83%	0.826	82%	0.817	S	S	*	*			trans	-54.6	129.7	-176.1	-62.6	173.5	179.5	158.6	-5	112.3
278	D	29.1	Very low	29.2	Very low	173 Å²	173	161.1 Å²	161.1	93%	0.925	81%	0.81	S	S	*	*			trans	-113	69.4	150.1	-85.7	-43.8	0	0	0	109.1	Q276	Q276-D278 PolarHBondContact O-N 2.81Å
279	S	27.3	Very low	29.2	Very low	86 Å²	86	158.6 Å²	158.6	60%	0.601	81%	0.813	S	S	*	*			trans	-83.8	125	171.6	-53.9	0	0	0	0	109.7
280	S	28.1	Very low	29.4	Very low	114 Å²	114	163.4 Å²	163.4	80%	0.797	82%	0.817	S	S	*	*			trans	65.7	137.4	173.1	80.9	0	0	0	0	117.5
281	L	32.5	Very low	29.5	Very low	152 Å²	152	157.1 Å²	157.1	80%	0.796	81%	0.814	S	S	*	*			trans	-159.5	41.5	142.9	-118.8	171.5	0	0	0	114.8	R283	L281-R283 VanDerWaalsContact C-N 3.25Å; L281-R283 PolarHBondContact O-N 3.22Å
282	G	28.1	Very low	30	Very low	82 Å²	82	150.3 Å²	150.3	85%	0.845	79%	0.786	S	S	*	*			trans	-75.5	66.5	167.9	0	0	0	0	0	112.9
283	R	30.9	Very low	30	Very low	185 Å²	185	144.8 Å²	144.8	70%	0.698	76%	0.762	S	S	*	*			trans	-159.6	118	171.9	-111.2	173.8	-163.8	174.6	8.8	113.5	L281	L281-R283 VanDerWaalsContact C-N 3.25Å; L281-R283 PolarHBondContact O-N 3.22Å
284	Y	29.6	Very low	30.1	Very low	233 Å²	233	139.5 Å²	139.5	91%	0.914	74%	0.743	S	S	*	*			trans	-142.7	89.7	162.5	-104.6	-70.7	0	0	0	111.9
285	T	33.3	Very low	30.2	Very low	134 Å²	134	134.4 Å²	134.4	82%	0.822	72%	0.719	S	S	*	*			trans	-132.6	151.1	168	48.7	0	0	0	0	110.4
286	R	30.8	Very low	30.2	Very low	242 Å²	242	127.5 Å²	127.5	91%	0.913	70%	0.704	S	S	*	*			trans	-47.9	154.7	178.7	-63.8	170.1	173.7	170.3	-3.6	112
287	S	31	Very low	30.5	Very low	94 Å²	94	124.4 Å²	124.4	66%	0.657	69%	0.693	S	S	*	*			cis	-167.7	145.6	46.3	-159.3	0	0	0	0	116.7
288	T	28.3	Very low	30.7	Very low	128 Å²	128	119.6 Å²	119.6	79%	0.785	69%	0.69	S	S	*	*			trans	47.8	141.1	142.6	50.3	0	0	0	0	124.9
289	A	28.7	Very low	30.8	Very low	85 Å²	85	119.9 Å²	119.9	70%	0.702	68%	0.678	S	S	*	*			trans	80.8	103.1	152.4	0	0	0	0	0	117.7
290	Y	29.9	Very low	31	Very low	231 Å²	231	122.2 Å²	122.2	91%	0.906	67%	0.674	S	S	*	*				83.7	120.5	79.2	-95.5	-74.3	0	0	0	112.3
291	G	31.5	Very low	31.3	Very low	69 Å²	69	126.1 Å²	126.1	71%	0.711	68%	0.679	S	S	*	*			cis	-163.7	-160.9	-3	0	0	0	0	0	109.7
292	S	37.5	Very low	31.2	Very low	40 Å²	40	127 Å²	127	28%	0.28	67%	0.672	S	S	.	*			cis	-175.5	173.3	2.6	-126.9	0	0	0	0	111.1	P70 T71	P70-S292 PolarHBondContact O-OG 3.17Å; T71-S292 VanDerWaalsContact N-CB 3.32Å; T71-S292 PolarHBondContact N-OG 3.4Å
293	S	32.9	Very low	31.5	Very low	51 Å²	51	130.7 Å²	130.7	36%	0.357	67%	0.671	S	S	.	*	E	Extended strand (participates in β ladder)	trans	93.2	152.4	167.3	78.4	0	0	0	0	118.2	R69 P70 T71	R69-S293 WeakPolarHBondContact CD-O 3.21Å; R69-S293 PolarHBondContact NH1-O 3.47Å; P70-S293 PolarHBondContact O-N 2.73Å; P70-S293 VanDerWaalsContact O-N 3.11Å; T71-S293 VanDerWaalsContact OG1-CA 3.32Å; T71-S293 WeakPolarHBondContact OG1-CA 3.39Å; T71-S293 VanDerWaalsContact OG1-CB 3.25Å; T71-S293 WeakPolarHBondContact OG1-CB 3.43Å
294	G	30.9	Very low	31.4	Very low	42 Å²	42	127.1 Å²	127.1	43%	0.433	67%	0.67	S	S	.	*	E	Extended strand (participates in β ladder)	cis	-143	160.5	-4.3	0	0	0	0	0	111.1	T68 R69	T68-G294 WeakPolarHBondContact CB-O 3.37Å; T68-G294 WeakPolarHBondContact CG2-O 3.47Å; R69-G294 VanDerWaalsContact N-C 3.3Å; R69-G294 PolarHBondContact N-O 2.96Å; R69-G294 CarbonylContact O-C 3.59Å; R69-G294 WeakPolarHBondContact O-CA 3.24Å; R69-G294 PolarHBondContact O-N 2.79Å
295	G	29.2	Very low	31.6	Very low	33 Å²	33	119.9 Å²	119.9	34%	0.34	67%	0.666	S	S	.	*			cis	-105.5	-50.7	-33.9	0	0	0	0	0	120	R69 P70	R69-G295 CarbonylContact C-O 3.57Å; R69-G295 VanDerWaalsContact N-C 3.34Å; R69-G295 CarbonylContact O-C 3.54Å; R69-G295 WeakPolarHBondContact O-CA 3.48Å; R69-G295 PolarHBondContact O-N 2.97Å; R69-G295 VanDerWaalsContact O-O 3.08Å; P70-G295 WeakPolarHBondContact CD-O 3.31Å; P70-G295 VanDerWaalsContact N-O 3.09Å
296	T	30.2	Very low	31.3	Very low	100 Å²	100	118.7 Å²	118.7	61%	0.613	66%	0.663	S	S	*	*			trans	-147.3	165.6	-159.6	-18.7	0	0	0	0	119.4	T68	T68-T296 CarbonylContact C-O 3.52Å; T68-T296 VanDerWaalsContact CA-O 3.28Å; T68-T296 WeakPolarHBondContact CA-O 3.33Å; T68-T296 VanDerWaalsContact CB-N 3.31Å; T68-T296 PolarHBondContact N-O 2.94Å; T68-T296 CarbonylContact O-C 3.57Å; T68-T296 PolarHBondContact OG1-N 2.86Å; T68-T296 PolarHBondContact OG1-O 2.87Å; T68-T296 VanDerWaalsContact OG1-O 3.06Å
297	L	33.8	Very low	31.1	Very low	120 Å²	120	114 Å²	114	63%	0.628	66%	0.655	S	S	*	*			trans	-156.1	157.4	177.8	-148.8	-175.9	0	0	0	109	R299	L297-R299 HydrophobicContact CD2-CB 4.44Å
298	P	31.2	Very low	31.1	Very low	117 Å²	117	115 Å²	115	76%	0.76	66%	0.658	S	S	*	*			trans	-143.7	140.6	137.9	34	-18	0	0	0	113.8
299	R	31.1	Very low	31.1	Very low	180 Å²	180	120.7 Å²	120.7	68%	0.679	67%	0.665	S	S	*	*			cis	69.9	142.2	12.4	-100.9	-166.3	-179.5	175.1	6.5	115.1	L297	L297-R299 HydrophobicContact CD2-CB 4.44Å
300	R	31.5	Very low	31.1	Very low	135 Å²	135	120 Å²	120	51%	0.509	66%	0.659	S	S	.	*			cis	-175.8	153.6	4.4	-164.3	-169.3	-153.2	175.5	5.6	111.4	R302	R300-R302 HydrophobicContact CG-CB 4.17Å
301	Q	33.4	Very low	31.1	Very low	195 Å²	195	114.9 Å²	114.9	91%	0.911	65%	0.652	S	S	*	*			trans	179.4	124.5	143	-102.3	166.5	15.8	0	0	107.8
302	R	31.2	Very low	30.9	Very low	170 Å²	170	118.2 Å²	118.2	64%	0.642	66%	0.659	S	S	*	*			cis	87.9	97	4.5	-154.5	-157.4	-155.5	-156	2.5	118.6	R300	R300-R302 HydrophobicContact CG-CB 4.17Å
303	I	34.1	Very low	30.5	Very low	161 Å²	161	124 Å²	124	83%	0.826	69%	0.685	S	S	*	*			trans	-161.7	153.3	153.1	-93.3	145.3	0	0	0	105.3
304	T	29.8	Very low	30.2	Very low	110 Å²	110	127.2 Å²	127.2	68%	0.675	71%	0.707	S	S	*	*				178.4	132.4	-57.3	27.3	0	0	0	0	106.2
305	G	32.2	Very low	30.1	Very low	81 Å²	81	128.9 Å²	128.9	84%	0.835	72%	0.724	S	S	*	*			trans	98.7	160.5	173.3	0	0	0	0	0	115.5
306	S	27.4	Very low	30.2	Very low	108 Å²	108	133.6 Å²	133.6	76%	0.755	75%	0.746	S	S	*	*			cis	-167.8	132.9	-22.3	-163.8	0	0	0	0	111.2
307	L	27.8	Very low	30.3	Very low	145 Å²	145	136.3 Å²	136.3	76%	0.759	76%	0.757	S	S	*	*			trans	36.4	119.1	154.1	-85.3	82.8	0	0	0	123.6
308	T	29.9	Very low	30.4	Very low	115 Å²	115	135.1 Å²	135.1	71%	0.706	76%	0.756	S	S	*	*				70.8	137.1	125	62	0	0	0	0	125.1
309	R	28.2	Very low	30.3	Very low	246 Å²	246	138.1 Å²	138.1	93%	0.928	76%	0.76	S	S	*	*			trans	68	151.5	146.1	-79.5	-171.8	164.8	174.6	-5.4	117.7
310	A	29.4	Very low	30.4	Very low	71 Å²	71	133.1 Å²	133.1	59%	0.587	77%	0.765	S	S	*	*			cis	-163	166.6	-14.6	0	0	0	0	0	110.1
311	T	29.4	Very low	30.6	Very low	124 Å²	124	132 Å²	132	76%	0.761	77%	0.773	S	S	*	*			trans	44.4	129.8	153.1	51.6	0	0	0	0	119.5
312	T	27.5	Very low	30.5	Very low	138 Å²	138	129.3 Å²	129.3	85%	0.847	76%	0.764	S	S	*	*				-173.1	167	82.6	28.2	0	0	0	0	111.9
313	I	30	Very low	30.5	Very low	163 Å²	163	133.3 Å²	133.3	84%	0.836	78%	0.779	S	S	*	*			trans	-87.3	118.5	166.8	-64.3	170	0	0	0	109.3
314	S	26.8	Very low	30.6	Very low	117 Å²	117	130.9 Å²	130.9	82%	0.818	78%	0.776	S	S	*	*			trans	161.6	156.3	144.2	-78.3	0	0	0	0	111.4
315	G	28.4	Very low	30.9	Very low	77 Å²	77	129.6 Å²	129.6	79%	0.794	78%	0.777	S	S	*	*			trans	100.5	103.7	158.8	0	0	0	0	0	115.8
316	V	30.5	Very low	30.9	Very low	133 Å²	133	130 Å²	130	81%	0.806	77%	0.766	S	S	*	*			trans	-67.2	144.2	161.8	174.7	0	0	0	0	109.8
317	D	33.2	Very low	31.3	Very low	156 Å²	156	135.6 Å²	135.6	83%	0.834	77%	0.771	S	S	*	*			trans	-161.7	159.4	138.8	-110.6	-2.4	0	0	0	112
318	P	35.9	Very low	31.9	Very low	95 Å²	95	135.2 Å²	135.2	62%	0.617	77%	0.769	S	S	*	*			trans	-120.8	179.8	-144.5	44.2	-36.1	0	0	0	116.6
319	H	29.5	Very low	32.4	Very low	180 Å²	180	132.8 Å²	132.8	83%	0.833	76%	0.76	S	S	*	*			trans	61.9	88.1	169.2	-75.6	-89.9	0	0	0	117.5
320	G	32.2	Very low	33.1	Very low	76 Å²	76	127.7 Å²	127.7	78%	0.784	75%	0.747	S	S	*	*			trans	-131.9	9.6	175.8	0	0	0	0	0	117.3
321	T	36.3	Very low	33.8	Very low	111 Å²	111	127.3 Å²	127.3	68%	0.681	74%	0.74	S	S	*	*			trans	25.9	128.9	162	47.4	0	0	0	0	122.8
322	L	30.8	Very low	34.5	Very low	139 Å²	139	128 Å²	128	73%	0.728	74%	0.738	S	S	*	*			trans	66.1	96.3	138.5	-62.4	166.7	0	0	0	119.8
323	R	30.5	Very low	35.3	Very low	254 Å²	254	132 Å²	132	96%	0.958	74%	0.737	S	S	*	*	S	Bend	trans	-171	29	136.2	-105.5	160.2	-156.8	-105.4	3.6	118.7
324	S	36.6	Very low	36	Very low	109 Å²	109	127.2 Å²	127.2	76%	0.762	72%	0.722	S	S	*	*	S	Bend	trans	-135.4	-46.8	173.7	-49.3	0	0	0	0	115.6	C326 R327	S324-C326 VanDerWaalsContact C-N 3.26Å; S324-C326 PolarHBondContact O-N 2.71Å; S324-C326 VanDerWaalsContact O-N 3.08Å; S324-R327 PolarHBondContact O-N 3.3Å
325	A	36	Very low	36.5	Very low	83 Å²	83	125 Å²	125	69%	0.686	72%	0.718	S	S	*	*	G	3₁₀ helix	trans	-62.6	-22.4	-167.8	0	0	0	0	0	115.8	R327	A325-R327 VanDerWaalsContact C-N 3.29Å; A325-R327 PolarHBondContact O-N 3.25Å
326	C	33.8	Very low	37.2	Very low	91 Å²	91	128.2 Å²	128.2	62%	0.615	72%	0.715	S	S	*	*	G	3₁₀ helix	trans	-75.6	-6.4	-173.7	-57.7	0	0	0	0	115.2	S324	S324-C326 VanDerWaalsContact C-N 3.26Å; S324-C326 PolarHBondContact O-N 2.71Å; S324-C326 VanDerWaalsContact O-N 3.08Å
327	R	35.5	Very low	37.7	Very low	224 Å²	224	128.1 Å²	128.1	85%	0.845	71%	0.709	S	S	*	*	G	3₁₀ helix	trans	-91.4	-20.3	177.7	-84.6	-174.1	171.4	174.5	-3.4	115.2	S324 A325	S324-R327 PolarHBondContact O-N 3.3Å; A325-R327 VanDerWaalsContact C-N 3.29Å; A325-R327 PolarHBondContact O-N 3.25Å
328	L	39.1	Very low	38.2	Very low	137 Å²	137	125.9 Å²	125.9	72%	0.717	70%	0.703	S	S	*	*	H	α-helix	trans	-85.9	-40.8	172.9	-127.7	74.8	0	0	0	111.9	H330 S331 I332	L328-H330 PolarHBondContact O-N 3.04Å; L328-H330 VanDerWaalsContact O-N 3.15Å; L328-S331 PolarHBondContact O-N 3.26Å; L328-I332 PolarHBondContact O-N 2.82Å
329	A	40.5	Very low	38.6	Very low	64 Å²	64	126.9 Å²	126.9	53%	0.529	71%	0.71	S	S	.	*	H	α-helix	trans	-67.2	-13.8	-176.4	0	0	0	0	0	114.7
330	H	42.6	Very low	39.3	Very low	140 Å²	140	123.6 Å²	123.6	65%	0.648	70%	0.704	S	S	*	*	H	α-helix	trans	-90	-35.8	175.3	-126.9	66.2	0	0	0	112.8	L328 I332 R333 A334	L328-H330 PolarHBondContact O-N 3.04Å; L328-H330 VanDerWaalsContact O-N 3.15Å; H330-I332 VanDerWaalsContact C-N 3.29Å; H330-I332 PolarHBondContact O-N 3.34Å; H330-R333 WeakPolarHBondContact O-CA 3.48Å; H330-R333 PolarHBondContact O-N 2.79Å; H330-A334 PolarHBondContact O-N 2.86Å
331	S	44	Very low	39.7	Very low	63 Å²	63	126 Å²	126	44%	0.441	71%	0.706	S	S	.	*	H	α-helix	trans	-62.3	-36.1	175	-58.4	0	0	0	0	112.4	L328 R333 A334	L328-S331 PolarHBondContact O-N 3.26Å; S331-R333 PolarHBondContact O-N 2.92Å; S331-A334 PolarHBondContact O-N 2.77Å; S331-A334 VanDerWaalsContact O-N 3.1Å
332	I	44.5	Very low	39.8	Very low	139 Å²	139	126 Å²	126	71%	0.713	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	-24.8	175.2	-62.6	169.7	0	0	0	111.7	L328 H330	L328-I332 PolarHBondContact O-N 2.82Å; H330-I332 VanDerWaalsContact C-N 3.29Å; H330-I332 PolarHBondContact O-N 3.34Å
333	R	44	Very low	40.1	Very low	221 Å²	221	128 Å²	128	83%	0.834	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	-5.1	173.9	-107.8	-177.6	-174.2	-178.4	3	114.5	H330 S331	H330-R333 WeakPolarHBondContact O-CA 3.48Å; H330-R333 PolarHBondContact O-N 2.79Å; S331-R333 PolarHBondContact O-N 2.92Å
334	A	46.2	Very low	40.8	Very low	62 Å²	62	119.9 Å²	119.9	51%	0.512	70%	0.696	S	S	.	*	T	Hydrogen-bonded Turn	trans	-103.4	-8.7	-175.1	0	0	0	0	0	114.5	H330 S331 I336	H330-A334 PolarHBondContact O-N 2.86Å; S331-A334 PolarHBondContact O-N 2.77Å; S331-A334 VanDerWaalsContact O-N 3.1Å; A334-I336 HydrophobicContact CB-CD1 4.38Å; A334-I336 HydrophobicContact CB-CG1 4.47Å; A334-I336 PolarHBondContact O-N 2.85Å
335	G	36.3	Very low	40.9	Very low	72 Å²	72	120.2 Å²	120.2	74%	0.742	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	76	19.4	170.6	0	0	0	0	0	116.7
336	I	44.3	Very low	40.9	Very low	144 Å²	144	121.2 Å²	121.2	74%	0.738	70%	0.695	S	S	*	*			trans	-94.6	-5.7	-171.8	-58.6	177.4	0	0	0	113.2	A334	A334-I336 HydrophobicContact CB-CD1 4.38Å; A334-I336 HydrophobicContact CB-CG1 4.47Å; A334-I336 PolarHBondContact O-N 2.85Å
337	I	40	Very low	40.9	Very low	131 Å²	131	119.9 Å²	119.9	67%	0.672	69%	0.691	S	S	*	*	S	Bend	trans	-125.5	125.9	-178.6	-56.5	176.1	0	0	0	109.3
338	P	43.1	Very low	40.8	Very low	109 Å²	109	114.4 Å²	114.4	71%	0.708	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-68.7	146.2	174.5	29.5	-34.4	0	0	0	111
339	P	44.1	Very low	40.6	Very low	116 Å²	116	113.9 Å²	113.9	75%	0.753	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-65.4	143.7	176.5	28.4	-34.4	0	0	0	110.9
340	P	44.7	Very low	40.1	Very low	110 Å²	110	117.4 Å²	117.4	71%	0.714	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-66.6	150.9	174	29.7	-35.1	0	0	0	110.9	S342	P340-S342 PolarHBondContact O-N 2.81Å
341	P	41.9	Very low	39.6	Very low	127 Å²	127	115 Å²	115	83%	0.825	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-63.4	123.8	177.1	26.2	-33.6	0	0	0	111	E343	P341-E343 PolarHBondContact O-N 2.99Å
342	S	37.6	Very low	38.9	Very low	111 Å²	111	115.2 Å²	115.2	78%	0.776	71%	0.708	S	S	*	*			trans	-88.6	71.6	-179.3	43.7	0	0	0	0	111.9	P340	P340-S342 PolarHBondContact O-N 2.81Å
343	E	37.3	Very low	38.1	Very low	182 Å²	182	113.7 Å²	113.7	85%	0.85	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-80.5	123.3	174	-163.7	157.9	-124	0	0	110.2	P341	P341-E343 PolarHBondContact O-N 2.99Å
344	P	43.8	Very low	37.3	Very low	83 Å²	83	109.6 Å²	109.6	54%	0.539	70%	0.703	S	S	.	*	P	Polyproline II helix	trans	-75.4	151	179	31.6	-34.4	0	0	0	111.1
345	P	40.1	Very low	36.4	Very low	115 Å²	115	110.1 Å²	110.1	75%	0.747	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-63.6	145.7	177.3	27.9	-35	0	0	0	111.4	A347	P345-A347 PolarHBondContact O-N 2.94Å
346	P	34.7	Very low	36.1	Very low	104 Å²	104	111.5 Å²	111.5	68%	0.675	70%	0.695	S	S	*	*			trans	-67.8	114.6	177.7	27.6	-33.7	0	0	0	110.6	T348	P346-T348 PolarHBondContact O-N 2.78Å
347	A	35.3	Very low	35.4	Very low	64 Å²	64	111.7 Å²	111.7	53%	0.529	69%	0.692	S	S	.	*			trans	-72.4	113	174.1	0	0	0	0	0	110.2	P345 Y827	P345-A347 PolarHBondContact O-N 2.94Å; A347-Y827 WeakPolarHBondContact CB-OH 3.31Å
348	T	33.3	Very low	34.9	Very low	109 Å²	109	113.4 Å²	113.4	67%	0.669	70%	0.702	S	S	*	*			trans	-87.9	129.7	172.3	42.3	0	0	0	0	109.8	P346 L350	P346-T348 PolarHBondContact O-N 2.78Å; T348-L350 PolarHBondContact O-N 2.92Å
349	P	35.2	Very low	34.1	Very low	126 Å²	126	115.5 Å²	115.5	82%	0.818	70%	0.702	S	S	*	*			trans	-75.6	96.1	-177.5	29.1	-33.9	0	0	0	111.4	S351	P349-S351 PolarHBondContact O-N 2.96Å; P349-S351 VanDerWaalsContact O-N 3.14Å
350	L	29.8	Very low	33.4	Very low	137 Å²	137	115.4 Å²	115.4	72%	0.717	71%	0.705	S	S	*	*			trans	-78.7	86.3	168.2	-85.5	168.3	0	0	0	110.4	T348	T348-L350 PolarHBondContact O-N 2.92Å
351	S	32.1	Very low	32.9	Very low	90 Å²	90	118.4 Å²	118.4	63%	0.629	71%	0.713	S	S	*	*			trans	-157.4	118	168.7	-80.6	0	0	0	0	113.4	P349	P349-S351 PolarHBondContact O-N 2.96Å; P349-S351 VanDerWaalsContact O-N 3.14Å
352	G	28.6	Very low	32.3	Very low	68 Å²	68	115.5 Å²	115.5	70%	0.701	71%	0.706	S	S	*	*	S	Bend	trans	97	33.6	135.2	0	0	0	0	0	121.2
353	S	27.2	Very low	32.3	Very low	106 Å²	106	116 Å²	116	74%	0.741	71%	0.706	S	S	*	*			trans	-150.8	93.1	146.9	-160.9	0	0	0	0	113.2
354	L	26.7	Very low	32.2	Very low	135 Å²	135	115.1 Å²	115.1	71%	0.707	71%	0.708	S	S	*	*			trans	-102.8	167.1	147	-82.8	168.9	0	0	0	107.2
355	I	28.8	Very low	31.7	Very low	74 Å²	74	115.6 Å²	115.6	38%	0.379	72%	0.718	S	S	.	*			trans	69.8	82.9	177.6	-45.5	102.2	0	0	0	114.5	Q445	I355-Q445 HydrophobicContact CD1-CG 3.74Å; I355-Q445 HydrophobicContact CG1-CG 4.3Å
356	S	29.9	Very low	31.3	Very low	100 Å²	100	114.2 Å²	114.2	70%	0.699	72%	0.717	S	S	*	*	S	Bend	trans	-150.3	48.5	150.4	-76.6	0	0	0	0	110.9
357	E	29.6	Very low	31.2	Very low	148 Å²	148	116.4 Å²	116.4	69%	0.692	73%	0.728	S	S	*	*	S	Bend	trans	-162.7	52.5	168.6	-140.6	174.7	-145.7	0	0	113.2
358	L	28.3	Very low	31.1	Very low	168 Å²	168	116.6 Å²	116.6	88%	0.88	74%	0.737	S	S	*	*			trans	-165.5	59.3	169.4	-120.9	164.1	0	0	0	114.8
359	E	27.2	Very low	31	Very low	152 Å²	152	118.9 Å²	118.9	71%	0.71	74%	0.744	S	S	*	*			trans	-152.2	67.1	165.5	-141.6	166.3	-142	0	0	114.2
360	S	28.7	Very low	30.7	Very low	115 Å²	115	119.6 Å²	119.6	80%	0.804	74%	0.74	S	S	*	*			trans	-146.6	57.8	166.1	73.4	0	0	0	0	113.5
361	I	34.1	Very low	30.8	Very low	173 Å²	173	120.4 Å²	120.4	89%	0.887	75%	0.745	S	S	*	*	S	Bend	trans	-159.5	124.8	150.4	-98.9	144.8	0	0	0	107.6
362	G	30.5	Very low	30.8	Very low	65 Å²	65	121.1 Å²	121.1	67%	0.67	75%	0.747	S	S	*	*			trans	-75.7	162.2	178.5	0	0	0	0	0	113.2
363	P	36.9	Very low	30.8	Very low	121 Å²	121	128 Å²	128	79%	0.786	76%	0.758	S	S	*	*			trans	-93.7	164.9	-161.2	36.9	-38	0	0	0	114.8
364	N	35.4	Very low	31	Very low	165 Å²	165	127.4 Å²	127.4	88%	0.882	76%	0.76	S	S	*	*			trans	-164.8	128.6	140.2	-100.6	-40.5	0	0	0	112.3
365	A	34.2	Very low	31.2	Very low	92 Å²	92	128.5 Å²	128.5	76%	0.76	77%	0.766	S	S	*	*			trans	53.3	125.7	167.3	0	0	0	0	0	118.5
366	A	31.3	Very low	31.3	Very low	87 Å²	87	132.4 Å²	132.4	72%	0.719	78%	0.782	S	S	*	*			cis	63.1	130.9	48	0	0	0	0	0	113
367	T	33	Very low	31.4	Very low	149 Å²	149	134.1 Å²	134.1	91%	0.914	78%	0.783	S	S	*	*			cis	-167.2	161.7	3.6	7.9	0	0	0	0	108.7
368	G	32.4	Very low	31.4	Very low	69 Å²	69	135.6 Å²	135.6	71%	0.711	79%	0.79	S	S	*	*			trans	131.1	68.8	151.7	0	0	0	0	0	121.4
369	L	30.9	Very low	31.7	Very low	157 Å²	157	133.8 Å²	133.8	82%	0.822	78%	0.781	S	S	*	*			trans	45.8	113.8	134.4	-58	171.3	0	0	0	123
370	I	29.9	Very low	31.8	Very low	140 Å²	140	131 Å²	131	72%	0.718	78%	0.778	S	S	*	*				84.8	132.2	124.8	-65.9	174.7	0	0	0	121.8
371	N	30.1	Very low	31.8	Very low	155 Å²	155	133.9 Å²	133.9	83%	0.829	78%	0.778	S	S	*	*			trans	83.6	150.9	161	-80.4	-9.8	0	0	0	120.6
372	P	33	Very low	31.6	Very low	105 Å²	105	132.6 Å²	132.6	68%	0.682	77%	0.769	S	S	*	*			trans	-125.2	-175.6	-147.5	39.6	-22.6	0	0	0	116.2
373	F	28.4	Very low	31.6	Very low	211 Å²	211	136.4 Å²	136.4	93%	0.925	77%	0.769	S	S	*	*			trans	95.4	147	178.9	-75.4	-90.1	0	0	0	118.2
374	A	32.2	Very low	31.3	Very low	94 Å²	94	139.3 Å²	139.3	78%	0.777	77%	0.772	S	S	*	*			trans	79.3	73.3	160.8	0	0	0	0	0	121.3
375	L	30.2	Very low	30.9	Very low	159 Å²	159	136.6 Å²	136.6	83%	0.832	77%	0.772	S	S	*	*				14	125.2	122.6	-90.3	161.4	0	0	0	121.2
376	Q	31.1	Very low	30.5	Very low	155 Å²	155	140.4 Å²	140.4	72%	0.724	78%	0.779	S	S	*	*				117.3	121.2	110.6	-165	161.4	9.4	0	0	122.1
377	L	31.1	Very low	30.3	Very low	137 Å²	137	140.8 Å²	140.8	72%	0.717	78%	0.782	S	S	*	*			trans	53.7	124.8	152	-77.7	165.4	0	0	0	123.2
378	H	31.3	Very low	29.9	Very low	179 Å²	179	138.2 Å²	138.2	83%	0.829	78%	0.776	S	S	*	*				-158.7	-174.8	92.1	-155.4	-107.4	0	0	0	112.1
379	N	32.8	Very low	29.5	Very low	130 Å²	130	139.5 Å²	139.5	70%	0.695	78%	0.78	S	S	*	*			trans	-137.7	167.3	-155.2	-171	8.1	0	0	0	114.5
380	S	29.3	Very low	29.3	Very low	92 Å²	92	138.7 Å²	138.7	64%	0.643	78%	0.782	S	S	*	*			trans	108.6	117.6	151.4	74.5	0	0	0	0	121.1
381	Q	29	Very low	29	Very low	176 Å²	176	136 Å²	136	82%	0.822	78%	0.78	S	S	*	*			trans	50.1	142.1	138	-58.9	-175	-1.9	0	0	120.3
382	Q	30.1	Very low	28.8	Very low	147 Å²	147	133.2 Å²	133.2	69%	0.687	78%	0.778	S	S	*	*			cis	-166.6	162.1	44.8	-145.3	172.3	21.4	0	0	114.3
383	Q	30.7	Very low	28.6	Very low	144 Å²	144	133.6 Å²	133.6	67%	0.673	79%	0.791	S	S	*	*			trans	61.6	108.4	151	-83.7	153.8	8.9	0	0	124.2
384	Q	30.4	Very low	28.7	Very low	183 Å²	183	127.5 Å²	127.5	86%	0.855	79%	0.787	S	S	*	*				22.7	127.7	112.7	-62	170.7	-31.2	0	0	120.4
385	A	27.5	Very low	28.6	Very low	107 Å²	107	126.3 Å²	126.3	88%	0.884	78%	0.784	S	S	*	*				-177.1	159.5	114.8	0	0	0	0	0	112.3
386	L	26.4	Very low	28.7	Very low	173 Å²	173	128.5 Å²	128.5	91%	0.906	79%	0.787	S	S	*	*			trans	-132.5	95.2	177.6	-169.6	171.7	0	0	0	109.9
387	A	25.6	Very low	29	Very low	95 Å²	95	125.8 Å²	125.8	79%	0.785	78%	0.783	S	S	*	*			trans	-169.1	133.1	163.8	0	0	0	0	0	114.7
388	A	24.8	Very low	29	Very low	95 Å²	95	127.5 Å²	127.5	79%	0.785	79%	0.787	S	S	*	*			trans	43.8	102.1	140.3	0	0	0	0	0	123.4
389	A	24.7	Very low	28.8	Very low	96 Å²	96	125 Å²	125	79%	0.793	78%	0.784	S	S	*	*				70.3	172.2	119.2	0	0	0	0	0	122.7
390	V	26.1	Very low	28.5	Very low	140 Å²	140	125.7 Å²	125.7	85%	0.848	79%	0.787	S	S	*	*			trans	87.5	128.3	168.9	-172.6	0	0	0	0	117.9
391	A	24.9	Very low	28.4	Very low	84 Å²	84	126.2 Å²	126.2	69%	0.694	79%	0.791	S	S	*	*			trans	30.2	129	159.6	0	0	0	0	0	120.7
392	A	25.6	Very low	28.3	Very low	95 Å²	95	121.5 Å²	121.5	79%	0.785	79%	0.789	S	S	*	*				74.7	129.2	50.6	0	0	0	0	0	114.9
393	A	29.2	Very low	28.3	Very low	114 Å²	114	121.2 Å²	121.2	94%	0.942	80%	0.797	S	S	*	*			trans	64.4	143.4	-163.8	0	0	0	0	0	114.2
394	G	29	Very low	28.1	Very low	82 Å²	82	120.2 Å²	120.2	85%	0.845	80%	0.797	S	S	*	*			cis	161.3	161.6	-3.3	0	0	0	0	0	108.9
395	G	31.2	Very low	28.1	Very low	69 Å²	69	119.5 Å²	119.5	71%	0.711	79%	0.793	S	S	*	*			cis	-126	-178.2	-10.5	0	0	0	0	0	110.3
396	F	31.4	Very low	28	Very low	205 Å²	205	120.4 Å²	120.4	90%	0.899	78%	0.783	S	S	*	*				55.3	137.3	58.2	-90.5	-114.2	0	0	0	114.2
397	P	38.7	Very low	28.1	Very low	99 Å²	99	119 Å²	119	64%	0.643	78%	0.776	S	S	*	*			cis	-147.7	-179.5	-17.4	42.6	-23.6	0	0	0	117
398	Q	30.1	Very low	28.4	Very low	172 Å²	172	121.5 Å²	121.5	80%	0.804	78%	0.776	S	S	*	*			trans	27.7	141.1	134.2	-58.8	-91.7	-3.4	0	0	120.7
399	V	27.2	Very low	28.5	Very low	127 Å²	127	121.8 Å²	121.8	77%	0.77	77%	0.768	S	S	*	*				-168	121.2	127.2	136.3	0	0	0	0	111.3
400	L	26	Very low	28.6	Very low	145 Å²	145	123.9 Å²	123.9	76%	0.759	77%	0.766	S	S	*	*			trans	35	155.1	145	-74.8	87.6	0	0	0	122.7
401	S	27	Very low	28.7	Very low	103 Å²	103	121.7 Å²	121.7	72%	0.72	76%	0.757	S	S	*	*			cis	-179.9	150.5	-17.4	55.2	0	0	0	0	111.1
402	G	26.9	Very low	28.8	Very low	75.5 Å²	75.5	127 Å²	127	78%	0.778	76%	0.761	S	S	*	*			trans	79	162.4	166	0	0	0	0	0	114.8
403	V	30.5	Very low	28.9	Very low	142.5 Å²	142.5	130.2 Å²	130.2	86%	0.864	76%	0.761	S	S	*	*			cis	-134.1	133	6.3	169.7	0	0	0	0	107.7
404	N	26.8	Very low	29	Very low	123 Å²	123	132 Å²	132	66%	0.658	75%	0.754	S	S	*	*				-16.7	138.5	129.5	-175.4	17.7	0	0	0	113.1
405	Q	29.6	Very low	29	Very low	167 Å²	167	132.9 Å²	132.9	78%	0.78	75%	0.747	S	S	*	*			trans	129.7	131.8	158.8	-78.8	172.9	30.6	0	0	115.8
406	N	27	Very low	29.1	Very low	125.5 Å²	125.5	135.3 Å²	135.3	67%	0.671	75%	0.751	S	S	*	*				101.1	148.1	52.1	-72.4	-15.5	0	0	0	113.7
407	N	28.2	Very low	28.9	Very low	144 Å²	144	129.6 Å²	129.6	77%	0.77	74%	0.741	S	S	*	*				126.3	158.9	125.9	-96.1	-19.1	0	0	0	117.5
408	L	30.7	Very low	28.4	Very low	147 Å²	147	132.8 Å²	132.8	77%	0.77	75%	0.752	S	S	*	*			trans	60.4	105.3	160.5	-59.9	158.8	0	0	0	116.9
409	T	27.2	Very low	28.4	Very low	103 Å²	103	131.8 Å²	131.8	63%	0.632	75%	0.752	S	S	*	*			cis	107.2	129	22.6	59.4	0	0	0	0	111.6
410	N	27.6	Very low	28.8	Very low	139.5 Å²	139.5	132.4 Å²	132.4	75%	0.746	75%	0.75	S	S	*	*			trans	69.2	144.3	157.9	-53.4	-16.6	0	0	0	116.6
411	S	28.3	Very low	29.2	Very low	94 Å²	94	129.2 Å²	129.2	66%	0.657	74%	0.74	S	S	*	*			cis	-164.8	146.9	18.6	-13.8	0	0	0	0	113.4
412	Y	27.6	Very low	29.8	Very low	196 Å²	196	131.7 Å²	131.7	77%	0.769	74%	0.74	S	S	*	*			trans	18.2	133.4	145.8	-43	-65.7	0	0	0	120.3
413	M	27.2	Very low	30.6	Very low	160.5 Å²	160.5	132.4 Å²	132.4	79%	0.791	73%	0.729	S	S	*	*				-173.6	160.3	62.1	-88.8	-107.8	167.4	0	0	112.6
414	L	29.8	Very low	31.3	Very low	152.5 Å²	152.5	130.8 Å²	130.8	80%	0.798	72%	0.716	S	S	*	*				133.2	137.2	75.2	-93.4	166	0	0	0	115.7
415	S	30	Very low	32.2	Very low	100.5 Å²	100.5	131.4 Å²	131.4	70%	0.703	71%	0.713	S	S	*	*			trans	-80.7	164	160.4	14.5	0	0	0	0	110.6
416	P	33.7	Very low	33.2	Very low	120.5 Å²	120.5	129 Å²	129	78%	0.782	71%	0.705	S	S	*	*			cis	-142.4	166.1	49.4	40.1	-20.7	0	0	0	117
417	A	27.2	Very low	34.5	Very low	84.5 Å²	84.5	128.2 Å²	128.2	70%	0.698	70%	0.7	S	S	*	*				72.9	116	85.5	0	0	0	0	0	119.1
418	L	26.9	Very low	35.7	Very low	166.5 Å²	166.5	127.8 Å²	127.8	87%	0.872	69%	0.694	S	S	*	*			trans	121.2	116.8	154.5	-84.1	161	0	0	0	114.7
419	L	30.4	Very low	37.1	Very low	151.5 Å²	151.5	126.6 Å²	126.6	79%	0.793	69%	0.687	S	S	*	*	S	Bend	trans	115.6	32.1	162.6	-102.4	72.8	0	0	0	114.6	S421	L419-S421 PolarHBondContact O-N 3.49Å
420	N	35.5	Very low	38.6	Very low	138.5 Å²	138.5	127.9 Å²	127.9	74%	0.741	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.7	56.1	161.7	-76	-19.1	0	0	0	113.7	N424	N420-N424 PolarHBondContact O-ND2 3.18Å
421	S	35.8	Very low	40.3	Very low	77.5 Å²	77.5	127.3 Å²	127.3	54%	0.542	68%	0.679	S	S	.	*	T	Hydrogen-bonded Turn	trans	-107.3	-15.1	176.2	122.3	0	0	0	0	113.1	L419 K425	L419-S421 PolarHBondContact O-N 3.49Å; S421-K425 WeakPolarHBondContact O-CD 3.32Å; S421-K425 WeakPolarHBondContact O-CG 3.31Å; S421-K425 PolarHBondContact O-N 3.07Å
422	E	38.4	Very low	41.8	Very low	155.5 Å²	155.5	125.4 Å²	125.4	73%	0.727	67%	0.669	S	S	*	*	H	α-helix	trans	-96.1	-35.6	-170.9	-61.8	-171.8	131.9	0	0	112.8	N424 K425 L426	E422-N424 PolarHBondContact O-N 3.29Å; E422-K425 PolarHBondContact O-N 2.99Å; E422-L426 WeakPolarHBondContact O-CB 3.32Å; E422-L426 PolarHBondContact O-N 3.12Å
423	T	44.7	Very low	43.5	Very low	90.5 Å²	90.5	121.9 Å²	121.9	56%	0.555	66%	0.658	S	S	*	*	H	α-helix	trans	-62.4	-44.9	177.7	47	0	0	0	0	112.7	K425 L426 L427	T423-K425 VanDerWaalsContact C-N 3.31Å; T423-K425 PolarHBondContact O-N 3.49Å; T423-L426 PolarHBondContact O-N 3.15Å; T423-L427 WeakPolarHBondContact O-CB 3.31Å; T423-L427 PolarHBondContact O-N 3.13Å
424	N	45	Very low	45.4	Very low	110 Å²	110	120.1 Å²	120.1	59%	0.588	65%	0.651	S	S	*	*	H	α-helix	trans	-69.2	-32	176.6	-74.2	-35.6	0	0	0	112.7	N420 E422 L427 Q428	N420-N424 PolarHBondContact O-ND2 3.18Å; E422-N424 PolarHBondContact O-N 3.29Å; N424-L427 PolarHBondContact O-N 2.69Å; N424-Q428 PolarHBondContact O-N 2.79Å
425	K	46.1	Very low	47.3	Very low	135 Å²	135	117.7 Å²	117.7	59%	0.587	64%	0.638	S	S	*	*	H	α-helix	trans	-67.4	-40	171.9	-76.2	-175.7	178.4	-179	0	111.9	S421 E422 T423 L427 Q428 L429	S421-K425 WeakPolarHBondContact O-CD 3.32Å; S421-K425 WeakPolarHBondContact O-CG 3.31Å; S421-K425 PolarHBondContact O-N 3.07Å; E422-K425 PolarHBondContact O-N 2.99Å; T423-K425 VanDerWaalsContact C-N 3.31Å; T423-K425 PolarHBondContact O-N 3.49Å; K425-L427 PolarHBondContact O-N 3.49Å; K425-Q428 PolarHBondContact O-N 2.8Å; K425-L429 WeakPolarHBondContact O-CB 3.33Å; K425-L429 PolarHBondContact O-N 2.49Å
426	L	49.3	Very low	48.8	Very low	117.5 Å²	117.5	115.2 Å²	115.2	62%	0.615	62%	0.623	S	S	*	*	H	α-helix	trans	-62.7	-43.1	179	-157.7	79	0	0	0	111.4	E422 T423 L429 Q430	E422-L426 WeakPolarHBondContact O-CB 3.32Å; E422-L426 PolarHBondContact O-N 3.12Å; T423-L426 PolarHBondContact O-N 3.15Å; L426-L429 PolarHBondContact O-N 3.26Å; L426-Q430 WeakPolarHBondContact O-CB 3.44Å; L426-Q430 PolarHBondContact O-N 3.05Å
427	L	54.8	Low	50.3	Low	108 Å²	108	115.3 Å²	115.3	57%	0.565	61%	0.613	S	S	*	*	H	α-helix	trans	-63.4	-43.3	177.5	-170.5	66.7	0	0	0	112	T423 N424 K425 Q430 Q431	T423-L427 WeakPolarHBondContact O-CB 3.31Å; T423-L427 PolarHBondContact O-N 3.13Å; N424-L427 PolarHBondContact O-N 2.69Å; K425-L427 PolarHBondContact O-N 3.49Å; L427-Q430 PolarHBondContact O-N 2.92Å; L427-Q431 PolarHBondContact O-N 3.04Å
428	Q	53.9	Low	52.4	Low	135.5 Å²	135.5	117.5 Å²	117.5	63%	0.633	61%	0.609	S	S	*	*	H	α-helix	trans	-65.3	-39.9	174.6	-74.6	-172.6	-20	0	0	112.5	N424 K425 Q430 Q431 A432	N424-Q428 PolarHBondContact O-N 2.79Å; K425-Q428 PolarHBondContact O-N 2.8Å; Q428-Q430 VanDerWaalsContact C-N 3.32Å; Q428-Q430 PolarHBondContact O-N 2.95Å; Q428-Q431 PolarHBondContact O-N 3.31Å; Q428-A432 VanDerWaalsContact O-CB 3.3Å; Q428-A432 WeakPolarHBondContact O-CB 3.38Å; Q428-A432 PolarHBondContact O-N 2.91Å
429	L	58.8	Low	54.3	Low	122 Å²	122	115.5 Å²	115.5	64%	0.639	60%	0.595	S	S	*	*	H	α-helix	trans	-62.3	-38.8	173.8	-107.3	156.3	0	0	0	112.2	K425 L426 A432 K433	K425-L429 WeakPolarHBondContact O-CB 3.33Å; K425-L429 PolarHBondContact O-N 2.49Å; L426-L429 PolarHBondContact O-N 3.26Å; L429-A432 PolarHBondContact O-N 2.86Å; L429-K433 VanDerWaalsContact O-CB 3.3Å; L429-K433 WeakPolarHBondContact O-CB 3.46Å; L429-K433 PolarHBondContact O-N 2.72Å
430	Q	60.3	Low	56.2	Low	129 Å²	129	112.8 Å²	112.8	60%	0.603	58%	0.584	S	S	*	*	H	α-helix	trans	-70.6	-39.2	178.3	-167.5	166.9	-3.6	0	0	111.9	L426 L427 Q428 L434	L426-Q430 WeakPolarHBondContact O-CB 3.44Å; L426-Q430 PolarHBondContact O-N 3.05Å; L427-Q430 PolarHBondContact O-N 2.92Å; Q428-Q430 VanDerWaalsContact C-N 3.32Å; Q428-Q430 PolarHBondContact O-N 2.95Å; Q430-L434 WeakPolarHBondContact O-CB 3.39Å; Q430-L434 PolarHBondContact O-N 3.28Å
431	Q	61.7	Low	57.8	Low	127 Å²	127	107.8 Å²	107.8	59%	0.593	57%	0.566	S	S	*	*	H	α-helix	trans	-66.5	-43.5	172.1	-127.7	175.7	-8.5	0	0	112.1	L427 Q428 K433 L434 I435	L427-Q431 PolarHBondContact O-N 3.04Å; Q428-Q431 PolarHBondContact O-N 3.31Å; Q431-K433 VanDerWaalsContact C-N 3.3Å; Q431-K433 PolarHBondContact O-N 2.86Å; Q431-L434 WeakPolarHBondContact O-CB 3.3Å; Q431-L434 PolarHBondContact O-N 2.89Å; Q431-L434 VanDerWaalsContact O-N 3.14Å; Q431-I435 WeakPolarHBondContact O-CG1 3.36Å; Q431-I435 PolarHBondContact O-N 3.13Å
432	A	60.6	Low	59.7	Low	55.5 Å²	55.5	108 Å²	108	46%	0.459	56%	0.561	S	S	.	*	H	α-helix	trans	-62.3	-40.3	175.9	0	0	0	0	0	112.2	Q428 L429 L434 I435 A436	Q428-A432 VanDerWaalsContact O-CB 3.3Å; Q428-A432 WeakPolarHBondContact O-CB 3.38Å; Q428-A432 PolarHBondContact O-N 2.91Å; L429-A432 PolarHBondContact O-N 2.86Å; A432-L434 VanDerWaalsContact C-N 3.33Å; A432-L434 PolarHBondContact O-N 2.85Å; A432-I435 PolarHBondContact O-N 3.03Å; A432-A436 WeakPolarHBondContact O-CB 3.28Å; A432-A436 PolarHBondContact O-N 3.21Å
433	K	63.6	Low	61.3	Low	121 Å²	121	104.4 Å²	104.4	53%	0.526	55%	0.549	S	S	.	.	H	α-helix	trans	-62.8	-40.6	175.5	-171.3	172.5	-178.2	176	0	112	L429 Q431 A436 Q437	L429-K433 VanDerWaalsContact O-CB 3.3Å; L429-K433 WeakPolarHBondContact O-CB 3.46Å; L429-K433 PolarHBondContact O-N 2.72Å; Q431-K433 VanDerWaalsContact C-N 3.3Å; Q431-K433 PolarHBondContact O-N 2.86Å; K433-A436 PolarHBondContact O-N 3.14Å; K433-Q437 WeakPolarHBondContact O-CG 3.39Å; K433-Q437 PolarHBondContact O-N 3.01Å
434	L	66.3	Low	62.6	Low	123.5 Å²	123.5	104.5 Å²	104.5	65%	0.647	54%	0.543	S	S	*	.	H	α-helix	trans	-63.3	-43.9	176.1	-129.7	120.4	0	0	0	112.2	Q430 Q431 A432 Q437 H438	Q430-L434 WeakPolarHBondContact O-CB 3.39Å; Q430-L434 PolarHBondContact O-N 3.28Å; Q431-L434 WeakPolarHBondContact O-CB 3.3Å; Q431-L434 PolarHBondContact O-N 2.89Å; Q431-L434 VanDerWaalsContact O-N 3.14Å; A432-L434 VanDerWaalsContact C-N 3.33Å; A432-L434 PolarHBondContact O-N 2.85Å; L434-Q437 PolarHBondContact O-N 3.11Å; L434-H438 PolarHBondContact O-N 3.26Å
435	I	70.2	Confident	64	Low	101.5 Å²	101.5	103.5 Å²	103.5	52%	0.521	54%	0.535	S	S	.	.	H	α-helix	trans	-64.5	-44.1	176.9	-65.8	165.4	0	0	0	110.7	Q431 A432 Q437 H438 Q439	Q431-I435 WeakPolarHBondContact O-CG1 3.36Å; Q431-I435 PolarHBondContact O-N 3.13Å; A432-I435 PolarHBondContact O-N 3.03Å; I435-Q437 PolarHBondContact O-N 3.23Å; I435-H438 WeakPolarHBondContact O-CB 3.46Å; I435-H438 PolarHBondContact O-N 2.93Å; I435-H438 VanDerWaalsContact O-N 3.16Å; I435-Q439 PolarHBondContact O-N 3.25Å; I435-Q439 VanDerWaalsContact O-N 3.09Å
436	A	61.3	Low	65.5	Low	48 Å²	48	103.1 Å²	103.1	40%	0.397	54%	0.535	S	S	.	.	H	α-helix	trans	-62.1	-42	176.8	0	0	0	0	0	112.3	A432 K433 H438 Q439 V440	A432-A436 WeakPolarHBondContact O-CB 3.28Å; A432-A436 PolarHBondContact O-N 3.21Å; K433-A436 PolarHBondContact O-N 3.14Å; A436-H438 VanDerWaalsContact C-N 3.33Å; A436-H438 PolarHBondContact O-N 3.22Å; A436-Q439 PolarHBondContact O-N 3.14Å; A436-V440 WeakPolarHBondContact O-CG2 3.36Å; A436-V440 PolarHBondContact O-N 3.03Å
437	Q	66	Low	66.6	Low	123.5 Å²	123.5	102.2 Å²	102.2	58%	0.577	53%	0.53	S	S	*	.	H	α-helix	trans	-63.5	-37.4	175.3	-73.8	-177	-91.7	0	0	112.3	K433 L434 I435 G441	K433-Q437 WeakPolarHBondContact O-CG 3.39Å; K433-Q437 PolarHBondContact O-N 3.01Å; L434-Q437 PolarHBondContact O-N 3.11Å; I435-Q437 PolarHBondContact O-N 3.23Å; Q437-G441 PolarHBondContact O-N 2.91Å
438	H	69.8	Low	67.6	Low	130 Å²	130	104 Å²	104	60%	0.602	53%	0.529	S	S	*	.	H	α-helix	trans	-66.7	-38.3	174.9	-167.8	-60.1	0	0	0	112.4	L434 I435 A436 G441 L442	L434-H438 PolarHBondContact O-N 3.26Å; I435-H438 WeakPolarHBondContact O-CB 3.46Å; I435-H438 PolarHBondContact O-N 2.93Å; I435-H438 VanDerWaalsContact O-N 3.16Å; A436-H438 VanDerWaalsContact C-N 3.33Å; A436-H438 PolarHBondContact O-N 3.22Å; H438-G441 PolarHBondContact O-N 2.78Å; H438-L442 PolarHBondContact O-N 3.03Å
439	Q	67.7	Low	68.8	Low	124 Å²	124	101.6 Å²	101.6	58%	0.579	52%	0.519	S	S	*	.	H	α-helix	trans	-68.4	-41.7	176.1	-73.9	-176.8	-27.2	0	0	112.4	I435 A436 G441 L442 V443	I435-Q439 PolarHBondContact O-N 3.25Å; I435-Q439 VanDerWaalsContact O-N 3.09Å; A436-Q439 PolarHBondContact O-N 3.14Å; Q439-G441 VanDerWaalsContact C-N 3.32Å; Q439-G441 PolarHBondContact O-N 3.07Å; Q439-L442 PolarHBondContact O-N 2.48Å; Q439-V443 WeakPolarHBondContact O-CG2 3.48Å; Q439-V443 PolarHBondContact O-N 3.29Å; Q439-V443 VanDerWaalsContact O-N 3.11Å
440	V	70.4	Confident	69.7	Low	95 Å²	95	101.1 Å²	101.1	58%	0.576	51%	0.513	S	S	*	.	H	α-helix	trans	-61.4	-41.3	175.2	172.4	0	0	0	0	111.3	A436 L442 V443 E444	A436-V440 WeakPolarHBondContact O-CG2 3.36Å; A436-V440 PolarHBondContact O-N 3.03Å; V440-L442 PolarHBondContact O-N 3.05Å; V440-V443 PolarHBondContact O-N 2.72Å; V440-E444 PolarHBondContact O-N 2.9Å
441	G	70	Confident	70.5	Confident	34.5 Å²	34.5	101.2 Å²	101.2	36%	0.356	51%	0.513	S	S	.	.	H	α-helix	trans	-60.4	-40.7	175.7	0	0	0	0	0	113.6	Q437 H438 Q439 E444 Q445	Q437-G441 PolarHBondContact O-N 2.91Å; H438-G441 PolarHBondContact O-N 2.78Å; Q439-G441 VanDerWaalsContact C-N 3.32Å; Q439-G441 PolarHBondContact O-N 3.07Å; G441-E444 PolarHBondContact O-N 2.84Å; G441-Q445 WeakPolarHBondContact O-CB 3.33Å; G441-Q445 WeakPolarHBondContact O-CG 3.31Å; G441-Q445 PolarHBondContact O-N 2.86Å; G441-Q445 VanDerWaalsContact O-N 3.07Å
442	L	73.9	Confident	71.4	Confident	82 Å²	82	100.6 Å²	100.6	43%	0.429	51%	0.511	S	S	.	.	H	α-helix	trans	-65.5	-40.9	175.3	-76.9	167.2	0	0	0	112.5	H438 Q439 V440 Q445 Q446	H438-L442 PolarHBondContact O-N 3.03Å; Q439-L442 PolarHBondContact O-N 2.48Å; V440-L442 PolarHBondContact O-N 3.05Å; L442-Q445 WeakPolarHBondContact O-CB 3Å; L442-Q445 PolarHBondContact O-N 2.63Å; L442-Q446 PolarHBondContact O-N 3.18Å
443	V	71.9	Confident	72.2	Confident	78.5 Å²	78.5	103.9 Å²	103.9	48%	0.476	52%	0.517	S	S	.	.	H	α-helix	trans	-67.5	-41	177.4	174.3	0	0	0	0	111.2	Q439 V440 Q445 Q446 L447 L533	Q439-V443 WeakPolarHBondContact O-CG2 3.48Å; Q439-V443 PolarHBondContact O-N 3.29Å; Q439-V443 VanDerWaalsContact O-N 3.11Å; V440-V443 PolarHBondContact O-N 2.72Å; V443-Q445 VanDerWaalsContact C-N 3.28Å; V443-Q445 PolarHBondContact O-N 3.46Å; V443-Q446 PolarHBondContact O-N 3.17Å; V443-L447 WeakPolarHBondContact O-CB 3.35Å; V443-L447 PolarHBondContact O-N 3.08Å; V443-L533 HydrophobicContact CG1-CD1 4.36Å
444	E	72.1	Confident	72.7	Confident	94.5 Å²	94.5	102.5 Å²	102.5	44%	0.442	51%	0.512	S	S	.	.	H	α-helix	trans	-62.5	-39.2	173.2	-123.6	-160.9	164.5	0	0	111.9	V440 G441 L447 R448	V440-E444 PolarHBondContact O-N 2.9Å; G441-E444 PolarHBondContact O-N 2.84Å; E444-L447 PolarHBondContact O-N 3.18Å; E444-R448 WeakPolarHBondContact O-CB 3.37Å; E444-R448 VanDerWaalsContact O-CG 3.31Å; E444-R448 WeakPolarHBondContact O-CG 3.34Å; E444-R448 PolarHBondContact O-N 2.75Å; E444-R448 IonicContact OE1-CZ 3.64Å; E444-R448 VanDerWaalsContact OE1-CZ 3.23Å; E444-R448 IonicContact OE1-NE 3.75Å; E444-R448 PolarHBondContact OE1-NE 2.97Å; E444-R448 IonicContact OE1-NH2 2.75Å; E444-R448 PolarHBondContact OE1-NH2 3.03Å; E444-R448 IonicContact OE2-CZ 2.97Å; E444-R448 IonicContact OE2-NE 2.7Å; E444-R448 IonicContact OE2-NH2 3.7Å; E444-R448 PolarHBondContact OE2-NH2 3.24Å
445	Q	75.2	Confident	73.2	Confident	88.5 Å²	88.5	102.9 Å²	102.9	41%	0.414	51%	0.51	S	S	.	.	H	α-helix	trans	-63	-46.6	176.4	-124	172	-54.9	0	0	112.1	I355 G441 L442 V443 L447 R448 Q449	I355-Q445 HydrophobicContact CD1-CG 3.74Å; I355-Q445 HydrophobicContact CG1-CG 4.3Å; G441-Q445 WeakPolarHBondContact O-CB 3.33Å; G441-Q445 WeakPolarHBondContact O-CG 3.31Å; G441-Q445 PolarHBondContact O-N 2.86Å; G441-Q445 VanDerWaalsContact O-N 3.07Å; L442-Q445 WeakPolarHBondContact O-CB 3Å; L442-Q445 PolarHBondContact O-N 2.63Å; V443-Q445 VanDerWaalsContact C-N 3.28Å; V443-Q445 PolarHBondContact O-N 3.46Å; Q445-L447 VanDerWaalsContact C-N 3.27Å; Q445-L447 PolarHBondContact O-N 3.46Å; Q445-R448 PolarHBondContact O-N 3.36Å; Q445-Q449 WeakPolarHBondContact O-CG 3Å; Q445-Q449 PolarHBondContact O-N 3.29Å; Q445-Q449 VanDerWaalsContact O-N 3.14Å
446	Q	76.7	Confident	73.5	Confident	127 Å²	127	104.8 Å²	104.8	59%	0.593	52%	0.517	S	S	*	.	H	α-helix	trans	-62	-42.1	175.7	-74.2	-171.2	-55.4	0	0	111.6	L442 V443 R448 Q449 Q450	L442-Q446 PolarHBondContact O-N 3.18Å; V443-Q446 PolarHBondContact O-N 3.17Å; Q446-R448 VanDerWaalsContact C-N 3.35Å; Q446-R448 PolarHBondContact O-N 3.02Å; Q446-Q449 PolarHBondContact O-N 2.91Å; Q446-Q450 WeakPolarHBondContact O-CB 3.25Å; Q446-Q450 PolarHBondContact O-N 2.43Å
447	L	72.8	Confident	74.2	Confident	98 Å²	98	108.7 Å²	108.7	51%	0.513	53%	0.527	S	S	.	.	H	α-helix	trans	-63.2	-42.5	178.4	-166.6	69.9	0	0	0	111.8	V443 E444 Q445 Q450 Q451 L526	V443-L447 WeakPolarHBondContact O-CB 3.35Å; V443-L447 PolarHBondContact O-N 3.08Å; E444-L447 PolarHBondContact O-N 3.18Å; Q445-L447 VanDerWaalsContact C-N 3.27Å; Q445-L447 PolarHBondContact O-N 3.46Å; L447-Q450 PolarHBondContact O-N 3.01Å; L447-Q451 WeakPolarHBondContact O-CB 3.28Å; L447-Q451 PolarHBondContact O-N 3.08Å; L447-L526 HydrophobicContact CD1-CD1 4.39Å
448	R	77.4	Confident	74.3	Confident	144.5 Å²	144.5	108 Å²	108	55%	0.545	53%	0.527	S	S	.	.	H	α-helix	trans	-64.3	-41.2	174.9	-71.2	178.6	-165.5	-142.9	8	112.4	E444 Q445 Q446 Q451 Q452	E444-R448 WeakPolarHBondContact O-CB 3.37Å; E444-R448 VanDerWaalsContact O-CG 3.31Å; E444-R448 WeakPolarHBondContact O-CG 3.34Å; E444-R448 PolarHBondContact O-N 2.75Å; E444-R448 IonicContact OE1-CZ 3.64Å; E444-R448 VanDerWaalsContact OE1-CZ 3.23Å; E444-R448 IonicContact OE1-NE 3.75Å; E444-R448 PolarHBondContact OE1-NE 2.97Å; E444-R448 IonicContact OE1-NH2 2.75Å; E444-R448 PolarHBondContact OE1-NH2 3.03Å; E444-R448 IonicContact OE2-CZ 2.97Å; E444-R448 IonicContact OE2-NE 2.7Å; E444-R448 IonicContact OE2-NH2 3.7Å; E444-R448 PolarHBondContact OE2-NH2 3.24Å; Q445-R448 PolarHBondContact O-N 3.36Å; Q446-R448 VanDerWaalsContact C-N 3.35Å; Q446-R448 PolarHBondContact O-N 3.02Å; R448-Q451 PolarHBondContact O-N 2.88Å; R448-Q452 WeakPolarHBondContact O-CB 3.17Å; R448-Q452 WeakPolarHBondContact O-CG 3.35Å; R448-Q452 PolarHBondContact O-N 3.2Å
449	Q	78.3	Confident	74.3	Confident	87 Å²	87	107.2 Å²	107.2	41%	0.407	53%	0.526	S	S	.	.	H	α-helix	trans	-63.8	-43.9	175.5	-76.7	-179.8	-18.6	0	0	111.8	Q445 Q446 Q451 Q452 Q453	Q445-Q449 WeakPolarHBondContact O-CG 3Å; Q445-Q449 PolarHBondContact O-N 3.29Å; Q445-Q449 VanDerWaalsContact O-N 3.14Å; Q446-Q449 PolarHBondContact O-N 2.91Å; Q449-Q451 VanDerWaalsContact C-N 3.32Å; Q449-Q451 PolarHBondContact O-N 2.69Å; Q449-Q452 PolarHBondContact O-N 3.22Å; Q449-Q453 PolarHBondContact O-N 3.07Å
450	Q	76.6	Confident	74.2	Confident	111.5 Å²	111.5	104.2 Å²	104.2	52%	0.521	52%	0.523	S	S	.	.	H	α-helix	trans	-62.6	-40.7	176.8	-165.4	176.6	32.3	0	0	111.4	Q446 L447 Q453 Q454	Q446-Q450 WeakPolarHBondContact O-CB 3.25Å; Q446-Q450 PolarHBondContact O-N 2.43Å; L447-Q450 PolarHBondContact O-N 3.01Å; Q450-Q453 PolarHBondContact O-N 3.46Å; Q450-Q454 WeakPolarHBondContact O-CB 3.36Å; Q450-Q454 PolarHBondContact O-N 2.47Å
451	Q	78.5	Confident	73.7	Confident	130.5 Å²	130.5	102.5 Å²	102.5	61%	0.61	52%	0.519	S	S	*	.	H	α-helix	trans	-66.3	-39.2	176	-162.8	172.2	34.6	0	0	112.3	L447 R448 Q449 Q454 Q455	L447-Q451 WeakPolarHBondContact O-CB 3.28Å; L447-Q451 PolarHBondContact O-N 3.08Å; R448-Q451 PolarHBondContact O-N 2.88Å; Q449-Q451 VanDerWaalsContact C-N 3.32Å; Q449-Q451 PolarHBondContact O-N 2.69Å; Q451-Q454 PolarHBondContact O-N 3.08Å; Q451-Q455 WeakPolarHBondContact O-CB 3.31Å; Q451-Q455 PolarHBondContact O-N 3.01Å
452	Q	79.4	Confident	73.1	Confident	114.5 Å²	114.5	103.1 Å²	103.1	54%	0.535	52%	0.521	S	S	.	.	H	α-helix	trans	-65.2	-42.8	173.5	-78	-178	-19.3	0	0	112.6	R448 Q449 Q454 Q455 Q456	R448-Q452 WeakPolarHBondContact O-CB 3.17Å; R448-Q452 WeakPolarHBondContact O-CG 3.35Å; R448-Q452 PolarHBondContact O-N 3.2Å; Q449-Q452 PolarHBondContact O-N 3.22Å; Q452-Q454 VanDerWaalsContact C-N 3.33Å; Q452-Q454 PolarHBondContact O-N 2.84Å; Q452-Q455 PolarHBondContact O-N 3.07Å; Q452-Q456 WeakPolarHBondContact O-CG 3.17Å; Q452-Q456 PolarHBondContact O-N 2.81Å
453	Q	77.5	Confident	72.5	Confident	125 Å²	125	103.2 Å²	103.2	58%	0.584	52%	0.524	S	S	*	.	H	α-helix	trans	-61.2	-43.3	174.7	-75.1	-175.1	-9.5	0	0	111.7	Q449 Q450 Q455 Q456 Q457	Q449-Q453 PolarHBondContact O-N 3.07Å; Q450-Q453 PolarHBondContact O-N 3.46Å; Q453-Q455 VanDerWaalsContact C-N 3.33Å; Q453-Q455 PolarHBondContact O-N 2.99Å; Q453-Q456 PolarHBondContact O-N 3.24Å; Q453-Q457 WeakPolarHBondContact O-CG 3.23Å; Q453-Q457 PolarHBondContact O-N 2.89Å
454	Q	74.8	Confident	71.7	Confident	91 Å²	91	102.5 Å²	102.5	43%	0.425	53%	0.527	S	S	.	.	H	α-helix	trans	-64.5	-37.7	177	-164.1	175.1	32.8	0	0	112	Q450 Q451 Q452 Q457 L458	Q450-Q454 WeakPolarHBondContact O-CB 3.36Å; Q450-Q454 PolarHBondContact O-N 2.47Å; Q451-Q454 PolarHBondContact O-N 3.08Å; Q452-Q454 VanDerWaalsContact C-N 3.33Å; Q452-Q454 PolarHBondContact O-N 2.84Å; Q454-Q457 PolarHBondContact O-N 3.27Å; Q454-L458 PolarHBondContact O-N 3.1Å
455	Q	77.6	Confident	70.6	Confident	131 Å²	131	101.1 Å²	101.1	61%	0.612	53%	0.531	S	S	*	.	H	α-helix	trans	-67.6	-38.5	175.4	-163.1	173	37	0	0	112.1	Q451 Q452 Q453 L458 L459	Q451-Q455 WeakPolarHBondContact O-CB 3.31Å; Q451-Q455 PolarHBondContact O-N 3.01Å; Q452-Q455 PolarHBondContact O-N 3.07Å; Q453-Q455 VanDerWaalsContact C-N 3.33Å; Q453-Q455 PolarHBondContact O-N 2.99Å; Q455-L458 PolarHBondContact O-N 3.16Å; Q455-L459 HydrophobicContact CG-CD1 4.43Å; Q455-L459 WeakPolarHBondContact O-CB 3.35Å; Q455-L459 WeakPolarHBondContact O-CD1 3.41Å; Q455-L459 PolarHBondContact O-N 3.22Å
456	Q	76.4	Confident	69.2	Low	141.5 Å²	141.5	102.4 Å²	102.4	66%	0.661	54%	0.541	S	S	*	.	H	α-helix	trans	-65.2	-40.6	172.8	-74.3	-177.9	-4	0	0	112.3	Q452 Q453 L459 A460	Q452-Q456 WeakPolarHBondContact O-CG 3.17Å; Q452-Q456 PolarHBondContact O-N 2.81Å; Q453-Q456 PolarHBondContact O-N 3.24Å; Q456-L459 PolarHBondContact O-N 3.06Å; Q456-A460 WeakPolarHBondContact O-CB 3.44Å; Q456-A460 PolarHBondContact O-N 3.13Å
457	Q	74.6	Confident	67.6	Low	131 Å²	131	102.6 Å²	102.6	61%	0.612	55%	0.546	S	S	*	.	H	α-helix	trans	-63.7	-40.5	174.8	-73.1	178.7	-0.2	0	0	112.1	Q453 Q454 A460 A461	Q453-Q457 WeakPolarHBondContact O-CG 3.23Å; Q453-Q457 PolarHBondContact O-N 2.89Å; Q454-Q457 PolarHBondContact O-N 3.27Å; Q457-A460 PolarHBondContact O-N 3.28Å; Q457-A461 WeakPolarHBondContact O-CB 3.44Å; Q457-A461 PolarHBondContact O-N 3.01Å
458	L	68	Low	66.1	Low	108 Å²	108	105.3 Å²	105.3	57%	0.565	56%	0.56	S	S	*	*	H	α-helix	trans	-63.5	-40.3	173.4	-92.7	161.2	0	0	0	112.7	Q454 Q455 A461 A462 L515	Q454-L458 PolarHBondContact O-N 3.1Å; Q455-L458 PolarHBondContact O-N 3.16Å; L458-A461 PolarHBondContact O-N 3.16Å; L458-A462 WeakPolarHBondContact O-CB 3.38Å; L458-A462 PolarHBondContact O-N 3.33Å; L458-L515 HydrophobicContact CD2-CD1 4.28Å
459	L	70.6	Confident	64.2	Low	113 Å²	113	106.5 Å²	106.5	59%	0.592	57%	0.574	S	S	*	*	H	α-helix	trans	-67.5	-41.1	175.6	-120.5	124	0	0	0	111.7	Q455 Q456 A461 A462 V463	Q455-L459 HydrophobicContact CG-CD1 4.43Å; Q455-L459 WeakPolarHBondContact O-CB 3.35Å; Q455-L459 WeakPolarHBondContact O-CD1 3.41Å; Q455-L459 PolarHBondContact O-N 3.22Å; Q456-L459 PolarHBondContact O-N 3.06Å; L459-A461 PolarHBondContact O-N 3.32Å; L459-A462 PolarHBondContact O-N 3.19Å; L459-V463 HydrophobicContact CD2-CG2 4.02Å; L459-V463 WeakPolarHBondContact O-CB 3.32Å; L459-V463 WeakPolarHBondContact O-CG2 3.41Å; L459-V463 PolarHBondContact O-N 3.03Å
460	A	64.8	Low	62.2	Low	62 Å²	62	110.9 Å²	110.9	51%	0.512	60%	0.595	S	S	.	*	H	α-helix	trans	-61.6	-43.1	174.7	0	0	0	0	0	111.9	Q456 Q457 V463 A464	Q456-A460 WeakPolarHBondContact O-CB 3.44Å; Q456-A460 PolarHBondContact O-N 3.13Å; Q457-A460 PolarHBondContact O-N 3.28Å; A460-V463 PolarHBondContact O-N 3.06Å; A460-A464 WeakPolarHBondContact O-CB 3.42Å; A460-A464 PolarHBondContact O-N 3.16Å
461	A	61.3	Low	60.2	Low	59.5 Å²	59.5	112.5 Å²	112.5	49%	0.492	61%	0.607	S	S	.	*	H	α-helix	trans	-63.7	-40.4	174.4	0	0	0	0	0	112.3	Q457 L458 L459 V463 A464 A465	Q457-A461 WeakPolarHBondContact O-CB 3.44Å; Q457-A461 PolarHBondContact O-N 3.01Å; L458-A461 PolarHBondContact O-N 3.16Å; L459-A461 PolarHBondContact O-N 3.32Å; A461-V463 VanDerWaalsContact C-N 3.35Å; A461-V463 PolarHBondContact O-N 2.67Å; A461-A464 PolarHBondContact O-N 3.12Å; A461-A465 WeakPolarHBondContact O-CB 3.15Å; A461-A465 PolarHBondContact O-N 2.82Å
462	A	57.5	Low	58.3	Low	47.5 Å²	47.5	111.2 Å²	111.2	39%	0.393	61%	0.61	S	S	.	*	H	α-helix	trans	-67	-34.9	176.4	0	0	0	0	0	113	L458 L459 A465 N466	L458-A462 WeakPolarHBondContact O-CB 3.38Å; L458-A462 PolarHBondContact O-N 3.33Å; L459-A462 PolarHBondContact O-N 3.19Å; A462-A465 PolarHBondContact O-N 3.35Å; A462-N466 WeakPolarHBondContact O-CB 3.27Å; A462-N466 PolarHBondContact O-N 3.12Å; A462-N466 PolarHBondContact O-ND2 3.2Å
463	V	60.9	Low	56.1	Low	82.5 Å²	82.5	111.2 Å²	111.2	50%	0.5	62%	0.618	S	S	.	*	H	α-helix	trans	-72.2	-37.1	174.3	171	0	0	0	0	111.4	L459 A460 A461 N466 N467	L459-V463 HydrophobicContact CD2-CG2 4.02Å; L459-V463 WeakPolarHBondContact O-CB 3.32Å; L459-V463 WeakPolarHBondContact O-CG2 3.41Å; L459-V463 PolarHBondContact O-N 3.03Å; A460-V463 PolarHBondContact O-N 3.06Å; A461-V463 VanDerWaalsContact C-N 3.35Å; A461-V463 PolarHBondContact O-N 2.67Å; V463-N466 PolarHBondContact O-N 2.86Å; V463-N467 WeakPolarHBondContact CG1-ND2 3.29Å; V463-N467 WeakPolarHBondContact O-CB 3.43Å; V463-N467 PolarHBondContact O-N 2.85Å; V463-N467 PolarHBondContact O-ND2 2.96Å
464	A	54	Low	54.2	Low	64.5 Å²	64.5	111.9 Å²	111.9	53%	0.533	62%	0.624	S	S	.	*	H	α-helix	trans	-63.9	-42	172.7	0	0	0	0	0	112.1	A460 A461 N467 L468	A460-A464 WeakPolarHBondContact O-CB 3.42Å; A460-A464 PolarHBondContact O-N 3.16Å; A461-A464 PolarHBondContact O-N 3.12Å; A464-N467 PolarHBondContact O-N 2.77Å; A464-L468 PolarHBondContact O-N 2.85Å
465	A	50.2	Low	52.2	Low	64.5 Å²	64.5	115 Å²	115	53%	0.533	64%	0.643	S	S	.	*	H	α-helix	trans	-67.2	-35.2	179	0	0	0	0	0	113.6	A461 A462 L468 M469	A461-A465 WeakPolarHBondContact O-CB 3.15Å; A461-A465 PolarHBondContact O-N 2.82Å; A462-A465 PolarHBondContact O-N 3.35Å; A465-L468 PolarHBondContact O-N 3.09Å; A465-M469 PolarHBondContact O-N 2.88Å
466	N	46	Very low	50	Low	117 Å²	117	112 Å²	112	63%	0.626	65%	0.648	S	S	*	*	H	α-helix	trans	-76.6	-20.3	-177.1	-82.7	-48.4	0	0	0	114.1	A462 V463 L468 M469 Q470	A462-N466 WeakPolarHBondContact O-CB 3.27Å; A462-N466 PolarHBondContact O-N 3.12Å; A462-N466 PolarHBondContact O-ND2 3.2Å; V463-N466 PolarHBondContact O-N 2.86Å; N466-L468 PolarHBondContact O-N 2.89Å; N466-M469 PolarHBondContact O-N 2.82Å; N466-M469 VanDerWaalsContact O-N 3.13Å; N466-Q470 PolarHBondContact O-N 3.02Å
467	N	42.5	Very low	48	Very low	130.5 Å²	130.5	113.5 Å²	113.5	70%	0.698	66%	0.655	S	S	*	*	H	α-helix	trans	-80.2	-6.4	177.3	-80.5	-64.5	0	0	0	113.9	V463 A464	V463-N467 WeakPolarHBondContact CG1-ND2 3.29Å; V463-N467 WeakPolarHBondContact O-CB 3.43Å; V463-N467 PolarHBondContact O-N 2.85Å; V463-N467 PolarHBondContact O-ND2 2.96Å; A464-N467 PolarHBondContact O-N 2.77Å
468	L	40.6	Very low	46	Very low	155.5 Å²	155.5	112.5 Å²	112.5	81%	0.814	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.9	11.6	-179	-91.7	162.9	0	0	0	115.4	A464 A465 N466	A464-L468 PolarHBondContact O-N 2.85Å; A465-L468 PolarHBondContact O-N 3.09Å; N466-L468 PolarHBondContact O-N 2.89Å
469	M	38.9	Very low	44.3	Very low	169 Å²	169	114.7 Å²	114.7	83%	0.833	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.3	49	168.9	-76.7	-152.4	-125.2	0	0	114.6	A465 N466	A465-M469 PolarHBondContact O-N 2.88Å; N466-M469 PolarHBondContact O-N 2.82Å; N466-M469 VanDerWaalsContact O-N 3.13Å
470	Q	36.3	Very low	42.6	Very low	179.5 Å²	179.5	114 Å²	114	84%	0.839	67%	0.674	S	S	*	*	S	Bend	trans	-122.1	107.4	162.5	-69.4	-163.4	6.9	0	0	112	N466	N466-Q470 PolarHBondContact O-N 3.02Å
471	N	32.9	Very low	41.2	Very low	145 Å²	145	118.6 Å²	118.6	78%	0.775	69%	0.69	S	S	*	*			trans	-141.2	160	179.6	-133.6	-35.4	0	0	0	110.4
472	P	39.6	Very low	39.9	Very low	102.5 Å²	102.5	119 Å²	119	67%	0.666	70%	0.7	S	S	*	*			trans	-136	152.1	168.1	38.7	-20.4	0	0	0	115.8
473	T	34	Very low	38.7	Very low	115.5 Å²	115.5	121.5 Å²	121.5	71%	0.709	71%	0.714	S	S	*	*				123.9	141.4	124.6	49.7	0	0	0	0	120.2
474	I	36.9	Very low	37.4	Very low	139 Å²	139	128 Å²	128	71%	0.713	73%	0.731	S	S	*	*			trans	76.5	93.2	140.2	-64.6	160.8	0	0	0	121.2
475	N	31.9	Very low	36.4	Very low	155.5 Å²	155.5	131.2 Å²	131.2	83%	0.832	74%	0.739	S	S	*	*				51.8	123.8	124.6	-53.8	-12	0	0	0	123.5
476	G	32.2	Very low	35.5	Very low	69.5 Å²	69.5	136.6 Å²	136.6	72%	0.716	75%	0.753	S	S	*	*			trans	-172.3	106.1	157.1	0	0	0	0	0	116.3
477	H	34.7	Very low	34.8	Very low	172.5 Å²	172.5	134 Å²	134	80%	0.799	75%	0.753	S	S	*	*			trans	-2.2	146.9	150	-60.3	-81.5	0	0	0	119.5
478	T	33	Very low	34.4	Very low	110.5 Å²	110.5	138.1 Å²	138.1	68%	0.678	77%	0.765	S	S	*	*			cis	-172.4	167.6	12.3	9.5	0	0	0	0	113.1
479	L	31.4	Very low	34	Very low	154.5 Å²	154.5	133.3 Å²	133.3	81%	0.809	75%	0.753	S	S	*	*			trans	73.5	138.7	153.5	-70.8	153.1	0	0	0	119.5
480	S	35.3	Very low	33.8	Very low	97.5 Å²	97.5	129.1 Å²	129.1	68%	0.682	74%	0.737	S	S	*	*				148.3	140.2	78.1	68.1	0	0	0	0	116.1
481	N	35	Very low	33.7	Very low	159 Å²	159	128.8 Å²	128.8	85%	0.85	73%	0.729	S	S	*	*				119.3	143.3	63.3	-84.6	-8.5	0	0	0	115.9
482	G	33.9	Very low	33.6	Very low	67.5 Å²	67.5	124.5 Å²	124.5	70%	0.696	72%	0.719	S	S	*	*				120.3	150	89.5	0	0	0	0	0	111.9
483	S	33.5	Very low	33.4	Very low	100 Å²	100	128.5 Å²	128.5	70%	0.699	72%	0.721	S	S	*	*			cis	129.2	126.7	8.3	71.5	0	0	0	0	113
484	Y	33	Very low	33.3	Very low	219.5 Å²	219.5	129.5 Å²	129.5	86%	0.861	73%	0.728	S	S	*	*				-162.1	125.8	78.5	-113.8	-109.7	0	0	0	108.3
485	L	31.8	Very low	33.2	Very low	131 Å²	131	128.3 Å²	128.3	69%	0.686	73%	0.732	S	S	*	*				56.4	143.2	78	-83.4	169.2	0	0	0	118.7
486	Q	32.2	Very low	33.4	Very low	179 Å²	179	132.3 Å²	132.3	84%	0.836	74%	0.735	S	S	*	*				146.5	163.6	89.8	-81.3	159.5	7.3	0	0	113.2
487	G	32.2	Very low	33.6	Very low	60.5 Å²	60.5	134.8 Å²	134.8	62%	0.624	74%	0.739	S	S	*	*			cis	-174.2	-173.8	0.9	0	0	0	0	0	109.8	G489	G487-G489 PolarHBondContact O-N 3.45Å
488	F	32.8	Very low	33.6	Very low	218.5 Å²	218.5	129.9 Å²	129.9	96%	0.958	74%	0.735	S	S	*	*				-103.5	134.5	91	-69.5	-104.9	0	0	0	108.5
489	G	33.1	Very low	33.6	Very low	54 Å²	54	129.9 Å²	129.9	56%	0.557	74%	0.739	S	S	*	*				-167.9	145.4	-82.6	0	0	0	0	0	114.3	G487	G487-G489 PolarHBondContact O-N 3.45Å
490	T	34.8	Very low	33.8	Very low	81.5 Å²	81.5	127.8 Å²	127.8	50%	0.5	73%	0.733	S	S	.	*			trans	129.7	149	-170.1	64.9	0	0	0	0	113.2	Q631 N632 V633	T490-Q631 HydrophobicContact CG2-CB 3.3Å; T490-Q631 HydrophobicContact CG2-CG 3.62Å; T490-N632 HydrophobicContact CG2-CB 4.39Å; T490-V633 WeakPolarHBondContact O-CG1 3.4Å; T490-V633 VanDerWaalsContact OG1-CB 3.29Å; T490-V633 WeakPolarHBondContact OG1-CB 3.22Å
491	Y	32.6	Very low	33.8	Very low	171.5 Å²	171.5	130.4 Å²	130.4	67%	0.673	74%	0.738	S	S	*	*			cis	-123.1	174.5	-6.4	-118.3	-37.7	0	0	0	109.9	T629 S630 Q631 N632	Y491-T629 WeakPolarHBondContact CD1-O 3.39Å; Y491-T629 WeakPolarHBondContact CE1-O 3.2Å; Y491-S630 WeakPolarHBondContact CD1-O 3.02Å; Y491-Q631 VanDerWaalsContact CD1-N 3.33Å; Y491-Q631 WeakPolarHBondContact CD2-O 3.06Å; Y491-Q631 WeakPolarHBondContact CE2-O 3Å; Y491-N632 WeakPolarHBondContact CB-O 3.01Å; Y491-N632 WeakPolarHBondContact CD2-O 3.01Å
492	G	32.6	Very low	33.9	Very low	55 Å²	55	128.2 Å²	128.2	57%	0.567	73%	0.732	S	S	*	*				-144.7	-79.1	74.7	0	0	0	0	0	119.2
493	R	34.3	Very low	34.1	Very low	186 Å²	186	130.7 Å²	130.7	70%	0.702	74%	0.736	S	S	*	*			trans	141	135.2	167.9	-141.3	178.9	-169.1	173.2	6.2	119.3	Y626 I627	R493-Y626 PolarHBondContact NH2-O 2.89Å; R493-Y626 VanDerWaalsContact NH2-O 3.11Å; R493-I627 VanDerWaalsContact CZ-O 3.25Å; R493-I627 PolarHBondContact NH1-O 3.34Å; R493-I627 PolarHBondContact NH2-O 2.88Å
494	T	32	Very low	34	Very low	137.5 Å²	137.5	131.1 Å²	131.1	84%	0.844	74%	0.739	S	S	*	*			trans	-158.8	157.4	166.7	34.4	0	0	0	0	110.8
495	S	35.8	Very low	33.9	Very low	114 Å²	114	128.9 Å²	128.9	80%	0.797	74%	0.739	S	S	*	*				-156.2	151.6	88.6	-3.1	0	0	0	0	111.3
496	R	35.5	Very low	33.7	Very low	238.5 Å²	238.5	130.5 Å²	130.5	90%	0.9	74%	0.742	S	S	*	*			trans	174.1	167.9	153.1	-96.5	-168.1	166.7	-176.4	-3.6	114.9
497	P	37.3	Very low	33.7	Very low	123 Å²	123	126.7 Å²	126.7	80%	0.799	74%	0.736	S	S	*	*			trans	-122.2	-178	-140.4	45	-35.6	0	0	0	117
498	G	34.2	Very low	33.7	Very low	69.5 Å²	69.5	133.5 Å²	133.5	72%	0.716	74%	0.744	S	S	*	*			trans	-175.9	147.1	169.6	0	0	0	0	0	110.7
499	S	33.1	Very low	33.7	Very low	109.5 Å²	109.5	130 Å²	130	77%	0.766	74%	0.735	S	S	*	*				-173.9	170.6	114	65.3	0	0	0	0	112.9
500	T	35.6	Very low	33.6	Very low	111 Å²	111	131.3 Å²	131.3	68%	0.681	74%	0.735	S	S	*	*				130.1	120.3	92.7	11	0	0	0	0	117.2
501	I	33.6	Very low	34	Very low	152.5 Å²	152.5	133.4 Å²	133.4	78%	0.782	75%	0.75	S	S	*	*				71.2	144.8	125	-73.7	175.9	0	0	0	119.8
502	P	38.8	Very low	34.5	Very low	113 Å²	113	127.6 Å²	127.6	73%	0.734	74%	0.742	S	S	*	*			trans	-104.6	-138.3	-139.1	31.2	-18.5	0	0	0	116.6
503	P	38	Very low	35	Very low	119.5 Å²	119.5	131 Å²	131	78%	0.776	75%	0.748	S	S	*	*			trans	-140.3	168.4	172.9	41.7	-26.1	0	0	0	117.4
504	S	30.2	Very low	35.2	Very low	108 Å²	108	128.4 Å²	128.4	76%	0.755	75%	0.747	S	S	*	*			trans	-130.1	132.6	152.5	57.9	0	0	0	0	112.8
505	M	31.3	Very low	35.6	Very low	174.5 Å²	174.5	127.8 Å²	127.8	86%	0.86	74%	0.738	S	S	*	*			trans	125.4	143.5	155.5	-82.6	-176.6	177.8	0	0	115.8
506	Q	28.8	Very low	36.2	Very low	163 Å²	163	125.4 Å²	125.4	76%	0.762	73%	0.725	S	S	*	*				10.9	132.5	104.9	-59.6	171	-37.1	0	0	117.2
507	S	30.9	Very low	36.9	Very low	99.5 Å²	99.5	119.3 Å²	119.3	70%	0.696	71%	0.714	S	S	*	*			trans	105.7	141.5	139.9	58.7	0	0	0	0	115.3
508	Y	31.9	Very low	37.4	Very low	204.5 Å²	204.5	119.5 Å²	119.5	80%	0.802	70%	0.704	S	S	*	*			cis	-170.4	140.5	13.4	-105.5	-66.5	0	0	0	110.3
509	L	32.5	Very low	38.1	Very low	145 Å²	145	122.8 Å²	122.8	76%	0.759	70%	0.701	S	S	*	*			trans	121.6	120.2	153	-83.7	163.4	0	0	0	113.1	N513	L509-N513 HydrophobicContact CD2-CB 4.05Å
510	S	32.9	Very low	39	Very low	80 Å²	80	124.1 Å²	124.1	56%	0.559	70%	0.695	S	S	*	*				-6.5	155.3	119.3	82.9	0	0	0	0	112.7	G512 N513	S510-G512 PolarHBondContact O-N 3.08Å; S510-N513 PolarHBondContact O-N 2.8Å; S510-N513 VanDerWaalsContact O-N 3.16Å; S510-N513 PolarHBondContact OG-N 2.73Å; S510-N513 PolarHBondContact OG-OD1 2.73Å
511	P	42.8	Very low	39.8	Very low	125.5 Å²	125.5	125.6 Å²	125.6	82%	0.815	69%	0.694	S	S	*	*	H	α-helix	trans	-95.9	-103.9	-153.2	5.9	9	0	0	0	115.4	N513 L514 L515	P511-N513 PolarHBondContact O-N 2.88Å; P511-L514 PolarHBondContact O-N 3.04Å; P511-L515 PolarHBondContact O-N 3.1Å; P511-L515 VanDerWaalsContact O-N 3.09Å
512	G	42.5	Very low	40.3	Very low	50.5 Å²	50.5	122.7 Å²	122.7	52%	0.521	68%	0.678	S	S	.	*	H	α-helix	trans	-128.9	47.2	172.5	0	0	0	0	0	113.1	S510 L515 A516	S510-G512 PolarHBondContact O-N 3.08Å; G512-L515 PolarHBondContact O-N 2.64Å; G512-A516 WeakPolarHBondContact O-CB 3.27Å; G512-A516 PolarHBondContact O-N 2.83Å
513	N	43	Very low	40.8	Very low	126.5 Å²	126.5	124.9 Å²	124.9	68%	0.676	68%	0.678	S	S	*	*	H	α-helix		3.8	53.2	127.4	-75.7	5.6	0	0	0	112.5	L509 S510 P511 V517	L509-N513 HydrophobicContact CD2-CB 4.05Å; S510-N513 PolarHBondContact O-N 2.8Å; S510-N513 VanDerWaalsContact O-N 3.16Å; S510-N513 PolarHBondContact OG-N 2.73Å; S510-N513 PolarHBondContact OG-OD1 2.73Å; P511-N513 PolarHBondContact O-N 2.88Å; N513-V517 WeakPolarHBondContact O-CG2 3.48Å; N513-V517 PolarHBondContact O-N 3.45Å
514	L	39.3	Very low	41.4	Very low	132 Å²	132	126 Å²	126	69%	0.691	67%	0.673	S	S	*	*	H	α-helix		-115.6	-116.7	89	-133.6	123.9	0	0	0	110.6	P511 A516 V517 Q518	P511-L514 PolarHBondContact O-N 3.04Å; L514-A516 PolarHBondContact O-N 3.16Å; L514-V517 PolarHBondContact O-N 3.44Å; L514-Q518 WeakPolarHBondContact O-CB 3.01Å; L514-Q518 PolarHBondContact O-N 3.46Å; L514-Q518 VanDerWaalsContact O-N 3.08Å
515	L	40.7	Very low	42.2	Very low	124.5 Å²	124.5	128 Å²	128	65%	0.652	67%	0.67	S	S	*	*	H	α-helix	trans	6.6	-128	169.8	-106.4	116	0	0	0	115.1	L458 P511 G512 Q518 Q519	L458-L515 HydrophobicContact CD2-CD1 4.28Å; P511-L515 PolarHBondContact O-N 3.1Å; P511-L515 VanDerWaalsContact O-N 3.09Å; G512-L515 PolarHBondContact O-N 2.64Å; L515-Q518 PolarHBondContact O-N 2.64Å; L515-Q519 VanDerWaalsContact O-CB 3.3Å; L515-Q519 WeakPolarHBondContact O-CB 3.45Å; L515-Q519 PolarHBondContact O-N 3.02Å
516	A	46.5	Very low	42.8	Very low	63.5 Å²	63.5	125.3 Å²	125.3	53%	0.525	66%	0.658	S	S	.	*	H	α-helix		-118.2	-110.8	-99.1	0	0	0	0	0	112.5	G512 L514 Q519 Q520	G512-A516 WeakPolarHBondContact O-CB 3.27Å; G512-A516 PolarHBondContact O-N 2.83Å; L514-A516 PolarHBondContact O-N 3.16Å; A516-Q519 PolarHBondContact O-N 3.04Å; A516-Q520 WeakPolarHBondContact O-CB 3.03Å; A516-Q520 PolarHBondContact O-N 2.68Å
517	V	50.1	Low	43.5	Very low	109.5 Å²	109.5	125.2 Å²	125.2	66%	0.664	66%	0.658	S	S	*	*	H	α-helix	trans	6.7	41.4	169.7	179.5	0	0	0	0	113.1	N513 L514 Q520 Q521	N513-V517 WeakPolarHBondContact O-CG2 3.48Å; N513-V517 PolarHBondContact O-N 3.45Å; L514-V517 PolarHBondContact O-N 3.44Å; V517-Q520 PolarHBondContact O-N 3.03Å; V517-Q521 PolarHBondContact O-N 2.91Å
518	Q	47.9	Very low	44.2	Very low	127.5 Å²	127.5	123.5 Å²	123.5	60%	0.596	65%	0.65	S	S	*	*	H	α-helix		-104.5	-123.7	90.1	-164.7	162.8	-10	0	0	113.3	L514 L515 Q520 Q521 Q522	L514-Q518 WeakPolarHBondContact O-CB 3.01Å; L514-Q518 PolarHBondContact O-N 3.46Å; L514-Q518 VanDerWaalsContact O-N 3.08Å; L515-Q518 PolarHBondContact O-N 2.64Å; Q518-Q520 VanDerWaalsContact C-N 3.35Å; Q518-Q520 PolarHBondContact O-N 3.36Å; Q518-Q521 PolarHBondContact O-N 3.08Å; Q518-Q522 WeakPolarHBondContact O-CB 3.22Å; Q518-Q522 PolarHBondContact O-N 2.72Å
519	Q	50.8	Low	44.6	Very low	139 Å²	139	119.9 Å²	119.9	65%	0.65	65%	0.645	S	S	*	*	H	α-helix	trans	-48.7	-116.3	168.8	-114.1	166.3	-1.1	0	0	114.6	L515 A516 Q522 Q523	L515-Q519 VanDerWaalsContact O-CB 3.3Å; L515-Q519 WeakPolarHBondContact O-CB 3.45Å; L515-Q519 PolarHBondContact O-N 3.02Å; A516-Q519 PolarHBondContact O-N 3.04Å; Q519-Q522 PolarHBondContact O-N 3.21Å; Q519-Q523 PolarHBondContact O-N 2.04Å
520	Q	51.7	Low	44.9	Very low	136.5 Å²	136.5	120.3 Å²	120.3	64%	0.638	64%	0.643	S	S	*	*	H	α-helix		-113	-98.4	88.2	-145.1	173.6	15	0	0	110.3	A516 V517 Q518 Q523 Q524	A516-Q520 WeakPolarHBondContact O-CB 3.03Å; A516-Q520 PolarHBondContact O-N 2.68Å; V517-Q520 PolarHBondContact O-N 3.03Å; Q518-Q520 VanDerWaalsContact C-N 3.35Å; Q518-Q520 PolarHBondContact O-N 3.36Å; Q520-Q523 PolarHBondContact O-N 2.88Å; Q520-Q524 PolarHBondContact O-N 3Å
521	Q	51.6	Low	45.1	Very low	144 Å²	144	122.6 Å²	122.6	67%	0.673	65%	0.648	S	S	*	*	H	α-helix		-112.9	-122.1	89.2	-114.7	178.5	-22.4	0	0	109.8	V517 Q518 Q523 Q524 Q525	V517-Q521 PolarHBondContact O-N 2.91Å; Q518-Q521 PolarHBondContact O-N 3.08Å; Q521-Q523 VanDerWaalsContact C-N 3.3Å; Q521-Q523 PolarHBondContact O-N 3.29Å; Q521-Q524 PolarHBondContact O-N 3.38Å; Q521-Q525 PolarHBondContact O-N 2.56Å; Q521-Q525 VanDerWaalsContact O-N 3.09Å
522	Q	44.9	Very low	44.7	Very low	91.5 Å²	91.5	123.4 Å²	123.4	43%	0.428	65%	0.645	S	S	.	*	H	α-helix		-109.5	53.7	-110.8	-177.4	174.9	12.6	0	0	109.6	Q518 Q519 Q525 L526	Q518-Q522 WeakPolarHBondContact O-CB 3.22Å; Q518-Q522 PolarHBondContact O-N 2.72Å; Q519-Q522 PolarHBondContact O-N 3.21Å; Q522-Q525 PolarHBondContact O-N 3.1Å; Q522-L526 PolarHBondContact O-N 3.34Å
523	Q	48	Very low	44.3	Very low	158.5 Å²	158.5	127.1 Å²	127.1	74%	0.741	65%	0.652	S	S	*	*	H	α-helix	trans	-92.9	39.8	176.8	-169.8	172	12.9	0	0	111.5	Q519 Q520 Q521 Q525 L526 E527	Q519-Q523 PolarHBondContact O-N 2.04Å; Q520-Q523 PolarHBondContact O-N 2.88Å; Q521-Q523 VanDerWaalsContact C-N 3.3Å; Q521-Q523 PolarHBondContact O-N 3.29Å; Q523-Q525 VanDerWaalsContact C-N 3.32Å; Q523-Q525 PolarHBondContact O-N 3.37Å; Q523-L526 WeakPolarHBondContact O-CB 3.36Å; Q523-L526 PolarHBondContact O-N 2.75Å; Q523-E527 PolarHBondContact O-N 3.34Å; Q523-E527 VanDerWaalsContact O-N 3.11Å
524	Q	51.4	Low	43.8	Very low	142 Å²	142	127.8 Å²	127.8	66%	0.664	66%	0.655	S	S	*	*	H	α-helix	trans	-107.4	-123.2	170.2	-69.7	-173.2	-25.5	0	0	109.6	Q520 Q521 L526 A528	Q520-Q524 PolarHBondContact O-N 3Å; Q521-Q524 PolarHBondContact O-N 3.38Å; Q524-L526 VanDerWaalsContact C-N 3.35Å; Q524-A528 WeakPolarHBondContact O-CB 3.46Å; Q524-A528 PolarHBondContact O-N 3.5Å
525	Q	47.2	Very low	43.7	Very low	149.5 Å²	149.5	127.9 Å²	127.9	70%	0.699	66%	0.656	S	S	*	*	H	α-helix		-101	-121.9	92.1	-82.3	170.3	-40.8	0	0	111.4	Q521 Q522 Q523 N529	Q521-Q525 PolarHBondContact O-N 2.56Å; Q521-Q525 VanDerWaalsContact O-N 3.09Å; Q522-Q525 PolarHBondContact O-N 3.1Å; Q523-Q525 VanDerWaalsContact C-N 3.32Å; Q523-Q525 PolarHBondContact O-N 3.37Å; Q525-N529 PolarHBondContact O-N 3.09Å; Q525-N529 VanDerWaalsContact O-N 3.11Å
526	L	43.3	Very low	43.2	Very low	118.5 Å²	118.5	129.3 Å²	129.3	62%	0.62	66%	0.664	S	S	*	*	H	α-helix	trans	-127.6	31.2	142.1	-114.3	114.8	0	0	0	112.1	L447 Q522 Q523 Q524 N529 Q530	L447-L526 HydrophobicContact CD1-CD1 4.39Å; Q522-L526 PolarHBondContact O-N 3.34Å; Q523-L526 WeakPolarHBondContact O-CB 3.36Å; Q523-L526 PolarHBondContact O-N 2.75Å; Q524-L526 VanDerWaalsContact C-N 3.35Å; L526-N529 PolarHBondContact O-N 3.08Å; L526-Q530 PolarHBondContact O-N 3.5Å
527	E	44.3	Very low	42.5	Very low	160.5 Å²	160.5	130.9 Å²	130.9	75%	0.75	68%	0.677	S	S	*	*	H	α-helix	trans	-93.3	-127.6	159.6	-78.8	-169.6	136.1	0	0	109.6	Q523 N529 Q530 L531	Q523-E527 PolarHBondContact O-N 3.34Å; Q523-E527 VanDerWaalsContact O-N 3.11Å; E527-N529 VanDerWaalsContact C-N 3.35Å; E527-N529 PolarHBondContact O-N 3.41Å; E527-Q530 PolarHBondContact O-N 3.28Å; E527-L531 PolarHBondContact O-N 3.22Å
528	A	45.2	Very low	41.5	Very low	64.5 Å²	64.5	132.5 Å²	132.5	53%	0.533	68%	0.682	S	S	.	*	H	α-helix	trans	-107	25.7	172	0	0	0	0	0	111.9	Q524 L531 L532	Q524-A528 WeakPolarHBondContact O-CB 3.46Å; Q524-A528 PolarHBondContact O-N 3.5Å; A528-L531 PolarHBondContact O-N 2.97Å; A528-L532 PolarHBondContact O-N 3.18Å
529	N	40.7	Very low	40.8	Very low	128 Å²	128	132.3 Å²	132.3	68%	0.684	69%	0.69	S	S	*	*	H	α-helix	trans	-2.5	37.2	166	-64.2	-11	0	0	0	116.4	Q525 L526 E527 L531 L532 L533	Q525-N529 PolarHBondContact O-N 3.09Å; Q525-N529 VanDerWaalsContact O-N 3.11Å; L526-N529 PolarHBondContact O-N 3.08Å; E527-N529 VanDerWaalsContact C-N 3.35Å; E527-N529 PolarHBondContact O-N 3.41Å; N529-L531 VanDerWaalsContact C-N 3.34Å; N529-L532 PolarHBondContact O-N 2.88Å; N529-L533 PolarHBondContact O-N 3.47Å
530	Q	38.6	Very low	39.8	Very low	154.5 Å²	154.5	133.9 Å²	133.9	72%	0.722	70%	0.697	S	S	*	*	H	α-helix	trans	-75.4	-116.6	151.6	-70.1	-174.6	-2.3	0	0	111.3	L526 E527 L532	L526-Q530 PolarHBondContact O-N 3.5Å; E527-Q530 PolarHBondContact O-N 3.28Å; Q530-L532 VanDerWaalsContact C-N 3.32Å; Q530-L532 PolarHBondContact O-N 3.35Å
531	L	37.3	Very low	38.7	Very low	128.5 Å²	128.5	135.6 Å²	135.6	67%	0.673	71%	0.707	S	S	*	*	H	α-helix	trans	-139	51.2	150.5	-85.4	162.7	0	0	0	113.4	E527 A528 N529 N535	E527-L531 PolarHBondContact O-N 3.22Å; A528-L531 PolarHBondContact O-N 2.97Å; N529-L531 VanDerWaalsContact C-N 3.34Å; L531-N535 PolarHBondContact O-ND2 3.43Å
532	L	34.8	Very low	37.8	Very low	141 Å²	141	134.1 Å²	134.1	74%	0.738	71%	0.71	S	S	*	*	H	α-helix	trans	-122.7	-109.3	143.6	-96.4	162	0	0	0	112.2	A528 N529 Q530 L534 N535	A528-L532 PolarHBondContact O-N 3.18Å; N529-L532 PolarHBondContact O-N 2.88Å; Q530-L532 VanDerWaalsContact C-N 3.32Å; Q530-L532 PolarHBondContact O-N 3.35Å; L532-L534 PolarHBondContact O-N 3.13Å; L532-L534 VanDerWaalsContact O-N 3.1Å; L532-N535 PolarHBondContact O-N 3.4Å
533	L	32.5	Very low	36.9	Very low	130 Å²	130	135.4 Å²	135.4	68%	0.681	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.3	78.5	-163.6	-78.2	165.5	0	0	0	115	V443 N529	V443-L533 HydrophobicContact CG1-CD1 4.36Å; N529-L533 PolarHBondContact O-N 3.47Å
534	L	34.4	Very low	36.1	Very low	139.5 Å²	139.5	136.5 Å²	136.5	73%	0.73	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-17.1	53.4	164.6	-75.5	163.1	0	0	0	117.5	L532	L532-L534 PolarHBondContact O-N 3.13Å; L532-L534 VanDerWaalsContact O-N 3.1Å
535	N	35.3	Very low	34.8	Very low	135.5 Å²	135.5	136 Å²	136	73%	0.725	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-147.5	70.9	147.5	-85.3	-40.5	0	0	0	115.1	L531 L532 A537	L531-N535 PolarHBondContact O-ND2 3.43Å; L532-N535 PolarHBondContact O-N 3.4Å; N535-A537 PolarHBondContact O-N 3.22Å
536	D	30.4	Very low	33.8	Very low	152.5 Å²	152.5	138 Å²	138	82%	0.816	74%	0.743	S	S	*	*			trans	-83.8	80.7	-177.4	-68.7	-65.3	0	0	0	115.3	N538	D536-N538 PolarHBondContact O-N 2.81Å
537	A	32.7	Very low	33	Very low	97 Å²	97	138.6 Å²	138.6	80%	0.802	75%	0.752	S	S	*	*			trans	-135.6	90.2	145	0	0	0	0	0	114.9	N535	N535-A537 PolarHBondContact O-N 3.22Å
538	N	29.4	Very low	32.3	Very low	143 Å²	143	134.4 Å²	134.4	77%	0.765	75%	0.751	S	S	*	*			trans	139.9	89.4	164.1	-160.4	16.3	0	0	0	119	D536	D536-N538 PolarHBondContact O-N 2.81Å
539	V	32.9	Very low	31.6	Very low	124.5 Å²	124.5	136.9 Å²	136.9	76%	0.755	77%	0.765	S	S	*	*			trans	-158.3	105.2	140.3	171.7	0	0	0	0	111.7
540	Q	29.6	Very low	31.4	Very low	173 Å²	173	136.3 Å²	136.3	81%	0.808	77%	0.768	S	S	*	*			trans	26.9	119.3	155.9	-63.4	166.1	-6.5	0	0	119.8
541	M	28	Very low	31	Very low	172 Å²	172	134.1 Å²	134.1	85%	0.847	77%	0.769	S	S	*	*				149.5	147.6	96.6	-81.7	-75.8	-88	0	0	112.1
542	P	32.5	Very low	30.8	Very low	111.5 Å²	111.5	133.7 Å²	133.7	72%	0.724	77%	0.772	S	S	*	*				-104.4	160.8	-76.7	33.6	-30.2	0	0	0	116.5
543	T	26.9	Very low	30.7	Very low	120 Å²	120	133.5 Å²	133.5	74%	0.736	77%	0.772	S	S	*	*			trans	-77.6	156.3	170.8	50.6	0	0	0	0	113.1
544	L	29.9	Very low	30.6	Very low	180 Å²	180	133.8 Å²	133.8	94%	0.942	77%	0.774	S	S	*	*			trans	-127.4	136.8	151.2	-92.9	174.4	0	0	0	109.9
545	N	24.5	Very low	30.5	Very low	132.5 Å²	132.5	133.9 Å²	133.9	71%	0.709	77%	0.774	S	S	*	*			trans	-119.6	137.4	-172.9	-110.3	-12.2	0	0	0	111.8
546	F	27.2	Very low	30.3	Very low	191.5 Å²	191.5	133.4 Å²	133.4	84%	0.84	77%	0.771	S	S	*	*			trans	131.2	109.5	147.7	-105.5	-80.2	0	0	0	118.6
547	T	26.4	Very low	30.3	Very low	132 Å²	132	130 Å²	130	81%	0.81	76%	0.76	S	S	*	*			trans	64.3	126.8	151.4	61.1	0	0	0	0	121.6
548	G	29.6	Very low	30.2	Very low	71.5 Å²	71.5	133.6 Å²	133.6	74%	0.737	76%	0.76	S	S	*	*			trans	155.7	96.4	166.7	0	0	0	0	0	113.5
549	S	29.4	Very low	30.1	Very low	117 Å²	117	133.6 Å²	133.6	82%	0.818	76%	0.759	S	S	*	*				150.1	162.1	129.2	-49.9	0	0	0	0	111.1
550	P	37.5	Very low	29.9	Very low	114.5 Å²	114.5	134 Å²	134	74%	0.744	76%	0.757	S	S	*	*				-140	-174	-53.3	40.2	-21.5	0	0	0	115.7
551	S	30.9	Very low	29.9	Very low	108.5 Å²	108.5	133.9 Å²	133.9	76%	0.759	76%	0.756	S	S	*	*			trans	73.2	158.9	153.8	7.4	0	0	0	0	120.6
552	V	33.2	Very low	29.8	Very low	121 Å²	121	130.4 Å²	130.4	73%	0.733	76%	0.755	S	S	*	*				151.5	127.4	90.7	177.4	0	0	0	0	114.1
553	N	31.6	Very low	29.7	Very low	137.5 Å²	137.5	129.3 Å²	129.3	74%	0.735	76%	0.755	S	S	*	*				115.8	178.4	65.3	-77.7	-3.9	0	0	0	115
554	L	31.2	Very low	29.7	Very low	136 Å²	136	128.9 Å²	128.9	71%	0.712	76%	0.758	S	S	*	*			cis	-160.6	168.8	9.8	-146.5	119.6	0	0	0	110.4
555	L	31.2	Very low	29.7	Very low	140.5 Å²	140.5	128.4 Å²	128.4	74%	0.736	75%	0.754	S	S	*	*			trans	40.9	140.5	155.8	-55.4	172.7	0	0	0	119.6
556	N	30.9	Very low	29.8	Very low	124.5 Å²	124.5	127 Å²	127	67%	0.666	75%	0.754	S	S	*	*			cis	-167.4	161.2	-3.1	-133.5	24.7	0	0	0	113.9
557	S	30.6	Very low	29.9	Very low	82.5 Å²	82.5	127.5 Å²	127.5	58%	0.577	76%	0.756	S	S	*	*			trans	44.2	150.2	142.4	-77	0	0	0	0	122.2
558	E	30.5	Very low	29.9	Very low	171.5 Å²	171.5	126 Å²	126	80%	0.801	75%	0.751	S	S	*	*			cis	-157.7	-177.5	-3.1	-131	154.3	129	0	0	112.9
559	L	28.4	Very low	29.9	Very low	143.5 Å²	143.5	127.9 Å²	127.9	75%	0.751	75%	0.753	S	S	*	*			trans	-88.8	159.4	180	-83	70.3	0	0	0	114
560	N	28.5	Very low	29.8	Very low	134 Å²	134	126.5 Å²	126.5	72%	0.717	75%	0.749	S	S	*	*				138.3	150.5	117.6	-92.9	-18	0	0	0	120.8
561	E	28.5	Very low	29.3	Very low	169.5 Å²	169.5	129.2 Å²	129.2	79%	0.792	76%	0.757	S	S	*	*			trans	58.6	98.3	147.3	-67.7	-178.1	129.8	0	0	123.5
562	A	26.4	Very low	29.2	Very low	99 Å²	99	127.9 Å²	127.9	82%	0.818	76%	0.761	S	S	*	*				50.7	155.2	112	0	0	0	0	0	122.6
563	A	30.1	Very low	28.9	Very low	88.5 Å²	88.5	126.3 Å²	126.3	73%	0.731	77%	0.769	S	S	*	*			trans	124.3	109.1	138	0	0	0	0	0	118
564	S	26.8	Very low	28.7	Very low	112 Å²	112	123.6 Å²	123.6	78%	0.783	77%	0.774	S	S	*	*			trans	44.8	147.4	141.2	69.1	0	0	0	0	120.1
565	I	30.8	Very low	28.5	Very low	169 Å²	169	121.3 Å²	121.3	87%	0.867	78%	0.783	S	S	*	*				-142.9	152.5	68.9	-85.6	162.7	0	0	0	110.1
566	S	27.1	Very low	28.4	Very low	102.5 Å²	102.5	118.5 Å²	118.5	72%	0.717	79%	0.787	S	S	*	*			trans	-114.1	156.3	-177.7	57.1	0	0	0	0	113.9
567	K	28.8	Very low	28.4	Very low	202 Å²	202	116.7 Å²	116.7	88%	0.878	80%	0.799	S	S	*	*			trans	-177.1	140.7	142.4	-102.4	164.1	-177.7	-178.4	0	110.6
568	S	26.5	Very low	28.2	Very low	101 Å²	101	116.2 Å²	116.2	71%	0.706	81%	0.807	S	S	*	*				139	152.2	129.7	73.4	0	0	0	0	112
569	S	28.1	Very low	28.2	Very low	110.5 Å²	110.5	114.2 Å²	114.2	77%	0.773	81%	0.811	S	S	*	*				138	150.1	84.1	-11.1	0	0	0	0	116.4
570	A	28.8	Very low	28.2	Very low	87.5 Å²	87.5	110.8 Å²	110.8	72%	0.723	81%	0.811	S	S	*	*			trans	85.3	118.3	147.9	0	0	0	0	0	121.3
571	D	26.3	Very low	28.1	Very low	171.5 Å²	171.5	109.7 Å²	109.7	92%	0.917	81%	0.814	S	S	*	*			trans	46.2	144.2	136.5	-62	-36.8	0	0	0	123.9
572	G	28	Very low	28	Very low	81.5 Å²	81.5	107.8 Å²	107.8	84%	0.84	81%	0.814	S	S	*	*			trans	157.9	29	159.8	0	0	0	0	0	118.7
573	G	27	Very low	28	Very low	87.5 Å²	87.5	108.6 Å²	108.6	90%	0.902	81%	0.808	S	S	*	*			trans	-11.8	179.1	177.4	0	0	0	0	0	117.8
574	G	27.8	Very low	27.8	Very low	82 Å²	82	113.9 Å²	113.9	85%	0.845	81%	0.81	S	S	*	*			trans	137.5	76.1	156	0	0	0	0	0	120.6
575	G	28.4	Very low	27.8	Very low	87.5 Å²	87.5	116.5 Å²	116.5	90%	0.902	81%	0.81	S	S	*	*			trans	73.1	163.4	153.2	0	0	0	0	0	119.1
576	G	29.1	Very low	27.7	Very low	80.5 Å²	80.5	114.6 Å²	114.6	83%	0.83	80%	0.802	S	S	*	*			cis	170.5	142.5	-9.9	0	0	0	0	0	115
577	G	28.9	Very low	27.6	Very low	87 Å²	87	114.5 Å²	114.5	90%	0.897	80%	0.801	S	S	*	*			trans	86.6	145.4	173.4	0	0	0	0	0	115.3
578	G	28.2	Very low	27.5	Very low	72.5 Å²	72.5	114.8 Å²	114.8	75%	0.747	80%	0.798	S	S	*	*			cis	132.6	132.8	-3.1	0	0	0	0	0	113.2
579	S	30	Very low	27.6	Very low	129 Å²	129	114.8 Å²	114.8	90%	0.902	80%	0.798	S	S	*	*				130.1	157.7	91.6	-69.5	0	0	0	0	111.8
580	G	27.5	Very low	27.6	Very low	71.5 Å²	71.5	114 Å²	114	74%	0.737	79%	0.792	S	S	*	*			cis	134.8	134.8	3.3	0	0	0	0	0	111.4
581	S	26	Very low	27.6	Very low	112 Å²	112	118 Å²	118	78%	0.783	79%	0.794	S	S	*	*			trans	136.5	136.4	176.9	-147	0	0	0	0	114.6
582	V	26.3	Very low	27.8	Very low	130 Å²	130	116 Å²	116	79%	0.788	78%	0.783	S	S	*	*				-58.4	139.9	85.4	-176.1	0	0	0	0	115.2
583	V	27.1	Very low	28	Very low	115.5 Å²	115.5	120.5 Å²	120.5	70%	0.7	78%	0.78	S	S	*	*			trans	-115.7	135.5	169.5	173.2	0	0	0	0	110.6	E585	V583-E585 HydrophobicContact CG1-CG 3.89Å
584	Y	26.2	Very low	28.3	Very low	199 Å²	199	122.1 Å²	122.1	78%	0.78	77%	0.767	S	S	*	*			trans	-129.4	127.8	144.6	-104.8	-78.9	0	0	0	108.5	K948	Y584-K948 VanDerWaalsContact CZ-NZ 3.25Å; Y584-K948 PolarHBondContact OH-NZ 2.86Å
585	E	27.5	Very low	28.5	Very low	166 Å²	166	126.2 Å²	126.2	78%	0.776	77%	0.768	S	S	*	*			trans	-133.6	143.9	171.4	-99.6	-166.2	139.8	0	0	110.7	V583	V583-E585 HydrophobicContact CG1-CG 3.89Å
586	N	27.7	Very low	28.6	Very low	130.5 Å²	130.5	126.5 Å²	126.5	70%	0.698	75%	0.753	S	S	*	*			trans	-21.7	127.2	164	-64.5	-26.5	0	0	0	115.8
587	S	25.9	Very low	28.7	Very low	99 Å²	99	130.2 Å²	130.2	69%	0.692	75%	0.753	S	S	*	*				50	139.6	129.6	-48.1	0	0	0	0	120.2
588	Y	26.7	Very low	28.8	Very low	209.5 Å²	209.5	131.6 Å²	131.6	82%	0.822	75%	0.75	S	S	*	*			trans	129.9	118.9	136.2	-86.8	-78.9	0	0	0	116.1
589	S	27.9	Very low	28.9	Very low	100.5 Å²	100.5	134.2 Å²	134.2	70%	0.703	75%	0.751	S	S	*	*			trans	-117	123.7	160.7	56.5	0	0	0	0	113.2
590	S	27.7	Very low	28.9	Very low	93 Å²	93	135.3 Å²	135.3	65%	0.65	75%	0.746	S	S	*	*			trans	-65	55	165.1	-54.5	0	0	0	0	118.1
591	F	29.2	Very low	29.2	Very low	172 Å²	172	137 Å²	137	75%	0.754	74%	0.744	S	S	*	*	S	Bend	trans	-123.9	47.2	161.7	-129.8	-94	0	0	0	113.3	K593	F591-K593 VanDerWaalsContact C-N 3.33Å; F591-K593 PolarHBondContact O-N 3.32Å
592	N	30.5	Very low	29.4	Very low	130 Å²	130	138.5 Å²	138.5	70%	0.695	74%	0.743	S	S	*	*	G	3₁₀ helix	trans	-84.4	67.4	174.5	-84.7	-38.9	0	0	0	112.2
593	K	33.2	Very low	29.5	Very low	177 Å²	177	137.7 Å²	137.7	77%	0.77	74%	0.743	S	S	*	*	G	3₁₀ helix	trans	-134.6	74.5	150.4	-90	-178.5	177	179	0	116.1	F591	F591-K593 VanDerWaalsContact C-N 3.33Å; F591-K593 PolarHBondContact O-N 3.32Å
594	L	31.8	Very low	29.6	Very low	121 Å²	121	137 Å²	137	63%	0.634	74%	0.743	S	S	*	*	G	3₁₀ helix	trans	-10.5	63.5	161.2	-77.8	168.2	0	0	0	119.4	T596	L594-T596 HydrophobicContact CB-CG2 4.13Å; L594-T596 HydrophobicContact CD1-CG2 4.04Å; L594-T596 HydrophobicContact CD2-CG2 3.83Å; L594-T596 HydrophobicContact CG-CG2 4.2Å
595	L	31.9	Very low	29.7	Very low	167 Å²	167	134.9 Å²	134.9	87%	0.874	75%	0.745	S	S	*	*	S	Bend	trans	-118.4	78.1	156.5	-83.9	166.5	0	0	0	111
596	T	30.7	Very low	29.6	Very low	94 Å²	94	132.4 Å²	132.4	58%	0.577	74%	0.744	S	S	*	*	S	Bend	trans	-143.2	132.5	-169.1	49.6	0	0	0	0	112.9	L594	L594-T596 HydrophobicContact CB-CG2 4.13Å; L594-T596 HydrophobicContact CD1-CG2 4.04Å; L594-T596 HydrophobicContact CD2-CG2 3.83Å; L594-T596 HydrophobicContact CG-CG2 4.2Å
597	N	31.1	Very low	29.7	Very low	157.5 Å²	157.5	135.2 Å²	135.2	84%	0.842	75%	0.754	S	S	*	*			trans	138.3	125.2	153.1	-71.9	-15.7	0	0	0	112.5
598	S	31	Very low	30.2	Very low	118 Å²	118	136.6 Å²	136.6	83%	0.825	76%	0.76	S	S	*	*				-145.3	120	89.6	53.3	0	0	0	0	109.7
599	V	31.6	Very low	30.3	Very low	126 Å²	126	130 Å²	130	76%	0.764	76%	0.755	S	S	*	*				-149.7	144.3	89.4	148.9	0	0	0	0	107
600	L	30.2	Very low	30.3	Very low	152 Å²	152	132.5 Å²	132.5	80%	0.796	76%	0.761	S	S	*	*			trans	-11.1	164.2	131.9	-65.8	131.7	0	0	0	114.6
601	P	33.7	Very low	30.3	Very low	107 Å²	107	136.1 Å²	136.1	70%	0.695	77%	0.767	S	S	*	*				-97.2	165.1	72.2	18.1	-5.3	0	0	0	114.2
602	D	28.7	Very low	30.2	Very low	143.667 Å²	143.667	132 Å²	132	77%	0.768	76%	0.76	S	S	*	*				154.1	144.8	103.6	-89.9	-21.6	0	0	0	114.8
603	S	29	Very low	30.1	Very low	113.667 Å²	113.667	134.4 Å²	134.4	80%	0.795	76%	0.764	S	S	*	*				84.6	161.5	127	67	0	0	0	0	117.3
604	S	29.2	Very low	29.9	Very low	99.6667 Å²	99.6667	133 Å²	133	70%	0.697	76%	0.763	S	S	*	*			trans	-157.1	140.3	174.3	63.4	0	0	0	0	117.9
605	L	29	Very low	29.6	Very low	156 Å²	156	131.5 Å²	131.5	82%	0.817	76%	0.763	S	S	*	*			trans	104.2	120	135.2	-87.7	103.7	0	0	0	119.2
606	C	24.8	Very low	29.5	Very low	113 Å²	113	128.9 Å²	128.9	76%	0.764	75%	0.754	S	S	*	*			trans	54.5	127.5	140.1	-61.7	0	0	0	0	124
607	Q	30.3	Very low	29.4	Very low	190.667 Å²	190.667	132.1 Å²	132.1	89%	0.891	77%	0.768	S	S	*	*			trans	78.1	163.7	148.6	-67.9	-165.9	-56.9	0	0	119.3
608	P	34.8	Very low	29.2	Very low	126.667 Å²	126.667	127.8 Å²	127.8	82%	0.823	76%	0.761	S	S	*	*			trans	-133.1	170.9	-130.2	42.8	-26.2	0	0	0	117.9
609	G	29	Very low	29.2	Very low	71 Å²	71	127.7 Å²	127.7	73%	0.732	76%	0.761	S	S	*	*			trans	169	139.1	166.1	0	0	0	0	0	112.3
610	L	28.1	Very low	29	Very low	154.667 Å²	154.667	129.6 Å²	129.6	81%	0.81	77%	0.766	S	S	*	*				-124.2	145.1	67.8	-101.8	130.3	0	0	0	111.7
611	Q	27.6	Very low	29.5	Very low	168.333 Å²	168.333	127.1 Å²	127.1	79%	0.787	76%	0.759	S	S	*	*				88.6	154.3	92.1	-92.5	169.4	0.4	0	0	115.5
612	S	27.8	Very low	29.1	Very low	85.6667 Å²	85.6667	128.7 Å²	128.7	60%	0.599	76%	0.762	S	S	*	*			cis	158.7	152.5	-13.5	55.1	0	0	0	0	112.9
613	F	28.5	Very low	29.1	Very low	179.333 Å²	179.333	129.7 Å²	129.7	79%	0.787	77%	0.767	S	S	*	*				166.6	132.1	68.5	-84.9	-65.2	0	0	0	113.3
614	I	28.4	Very low	29.1	Very low	148 Å²	148	128.5 Å²	128.5	76%	0.759	77%	0.765	S	S	*	*				71.2	116.2	118.7	-68.4	166.8	0	0	0	116.6
615	S	27.1	Very low	29	Very low	89 Å²	89	131.2 Å²	131.2	62%	0.622	77%	0.769	S	S	*	*			cis	166.2	139.3	32.3	-143.1	0	0	0	0	116.6
616	T	28.7	Very low	28.8	Very low	113 Å²	113	133.1 Å²	133.1	69%	0.693	77%	0.767	S	S	*	*			trans	58.6	133.7	140.5	52	0	0	0	0	121.5
617	N	27.9	Very low	28.9	Very low	160.333 Å²	160.333	134.2 Å²	134.2	86%	0.857	76%	0.764	S	S	*	*				97.8	138.4	74.3	-85.4	-10.1	0	0	0	115.8
618	G	27.8	Very low	28.8	Very low	68.3333 Å²	68.3333	128.1 Å²	128.1	70%	0.704	75%	0.753	S	S	*	*			trans	131.3	97.5	155.3	0	0	0	0	0	119.4
619	S	30.7	Very low	28.5	Very low	116.333 Å²	116.333	127.7 Å²	127.7	81%	0.814	75%	0.748	S	S	*	*				45.2	126.3	112.6	29.6	0	0	0	0	119.5
620	N	28.4	Very low	28.6	Very low	165.333 Å²	165.333	128.8 Å²	128.8	88%	0.884	75%	0.745	S	S	*	*			trans	66	166.8	144.9	-93.4	10.7	0	0	0	121.1
621	P	39.3	Very low	28.8	Very low	99.6667 Å²	99.6667	128.2 Å²	128.2	65%	0.647	74%	0.738	S	S	*	*			trans	-118.1	-165	-152.1	43.6	-32.6	0	0	0	115.1
622	N	26.5	Very low	29	Very low	141.333 Å²	141.333	126.4 Å²	126.4	76%	0.756	73%	0.733	S	S	*	*			trans	87.5	138.9	177.1	-54	-8.8	0	0	0	113.9
623	D	28.5	Very low	29	Very low	162.667 Å²	162.667	127.8 Å²	127.8	87%	0.87	74%	0.738	S	S	*	*				-171.6	170.8	72.3	-81.9	-34.5	0	0	0	116.1
624	A	27.9	Very low	29	Very low	90 Å²	90	123.8 Å²	123.8	74%	0.744	73%	0.732	S	S	*	*			trans	-101.8	149.6	180	0	0	0	0	0	114.9
625	I	27.1	Very low	29.1	Very low	155.667 Å²	155.667	123.9 Å²	123.9	80%	0.798	73%	0.732	S	S	*	*			trans	97.5	101.2	146.1	-54.6	179.8	0	0	0	112.7
626	Y	25.8	Very low	29.3	Very low	196.333 Å²	196.333	127.5 Å²	127.5	77%	0.77	74%	0.742	S	S	*	*				105.3	119.2	108.5	-108.3	-103.6	0	0	0	118.7	R493	R493-Y626 PolarHBondContact NH2-O 2.89Å; R493-Y626 VanDerWaalsContact NH2-O 3.11Å
627	I	26.3	Very low	29.4	Very low	135.333 Å²	135.333	129.6 Å²	129.6	69%	0.694	75%	0.749	S	S	*	*			trans	38.7	135.5	152.9	-59.9	177.1	0	0	0	118.8	R493	R493-I627 VanDerWaalsContact CZ-O 3.25Å; R493-I627 PolarHBondContact NH1-O 3.34Å; R493-I627 PolarHBondContact NH2-O 2.88Å
628	G	28.2	Very low	29.6	Very low	63.6667 Å²	63.6667	125 Å²	125	66%	0.656	74%	0.739	S	S	*	*			trans	162.7	115.5	154.8	0	0	0	0	0	116.3	S630	G628-S630 PolarHBondContact O-N 3.48Å; G628-S630 VanDerWaalsContact O-N 3.14Å
629	T	29.5	Very low	29.8	Very low	117.667 Å²	117.667	127.9 Å²	127.9	72%	0.722	74%	0.744	S	S	*	*			trans	-107.9	129.8	-174.9	37.6	0	0	0	0	112.5	Y491	Y491-T629 WeakPolarHBondContact CD1-O 3.39Å; Y491-T629 WeakPolarHBondContact CE1-O 3.2Å
630	S	29.7	Very low	29.9	Very low	95 Å²	95	130.3 Å²	130.3	66%	0.664	75%	0.745	S	S	*	*			trans	65.4	138.7	150.7	73.7	0	0	0	0	120.2	Y491 G628	Y491-S630 WeakPolarHBondContact CD1-O 3.02Å; G628-S630 PolarHBondContact O-N 3.48Å; G628-S630 VanDerWaalsContact O-N 3.14Å
631	Q	33.3	Very low	30.1	Very low	141.333 Å²	141.333	125.3 Å²	125.3	66%	0.66	73%	0.733	S	S	*	*				118.8	154.5	123.4	-53.6	169.8	-11.7	0	0	118.6	T490 Y491	T490-Q631 HydrophobicContact CG2-CB 3.3Å; T490-Q631 HydrophobicContact CG2-CG 3.62Å; Y491-Q631 VanDerWaalsContact CD1-N 3.33Å; Y491-Q631 WeakPolarHBondContact CD2-O 3.06Å; Y491-Q631 WeakPolarHBondContact CE2-O 3Å
632	N	30.8	Very low	29.9	Very low	130 Å²	130	127 Å²	127	70%	0.695	74%	0.737	S	S	*	*			trans	162.4	168.3	143.9	-69.6	-19.7	0	0	0	118.5	T490 Y491	T490-N632 HydrophobicContact CG2-CB 4.39Å; Y491-N632 WeakPolarHBondContact CB-O 3.01Å; Y491-N632 WeakPolarHBondContact CD2-O 3.01Å
633	V	29.6	Very low	30.3	Very low	116 Å²	116	126.1 Å²	126.1	70%	0.703	73%	0.732	S	S	*	*			trans	92.4	135	144.2	158.7	0	0	0	0	115.6	T490	T490-V633 WeakPolarHBondContact O-CG1 3.4Å; T490-V633 VanDerWaalsContact OG1-CB 3.29Å; T490-V633 WeakPolarHBondContact OG1-CB 3.22Å
634	S	28.7	Very low	30.5	Very low	94 Å²	94	124.6 Å²	124.6	66%	0.657	72%	0.724	S	S	*	*				-178.7	134.5	53.2	49.5	0	0	0	0	117.2
635	I	29.7	Very low	30.8	Very low	150 Å²	150	126.8 Å²	126.8	77%	0.769	72%	0.723	S	S	*	*			trans	66.1	118.3	138.3	-52.6	167.6	0	0	0	114.8
636	M	31.3	Very low	31.1	Very low	165.667 Å²	165.667	126 Å²	126	82%	0.816	73%	0.726	S	S	*	*				137	125.1	106.5	-83.9	-162.2	-168.5	0	0	114.9
637	N	29.7	Very low	31.4	Very low	157.333 Å²	157.333	121.1 Å²	121.1	84%	0.841	73%	0.726	S	S	*	*				150	143.3	102	-96.9	-22.2	0	0	0	115.7
638	G	33.3	Very low	32.2	Very low	63.6667 Å²	63.6667	120.4 Å²	120.4	66%	0.656	73%	0.73	S	S	*	*				132.5	167	117	0	0	0	0	0	115.8
639	T	32.4	Very low	32.9	Very low	129.667 Å²	129.667	122.8 Å²	122.8	80%	0.796	73%	0.734	S	S	*	*			cis	-163.9	149.2	2.3	24.1	0	0	0	0	111.5
640	I	33	Very low	33.1	Very low	165 Å²	165	125.2 Å²	125.2	85%	0.846	74%	0.742	S	S	*	*				100.2	141.2	123.7	-78.9	163.3	0	0	0	115.7
641	G	32.7	Very low	33.3	Very low	61.6667 Å²	61.6667	126.9 Å²	126.9	64%	0.636	75%	0.748	S	S	*	*			trans	124.6	124.2	154.2	0	0	0	0	0	114.7
642	N	34.1	Very low	33.1	Very low	134.667 Å²	134.667	127.9 Å²	127.9	72%	0.72	75%	0.752	S	S	*	*				106.7	138.1	57.2	-92.4	60.1	0	0	0	113.6
643	D	34	Very low	33	Very low	123.333 Å²	123.333	126.6 Å²	126.6	66%	0.66	75%	0.75	S	S	*	*				94.8	137.9	116.1	-66.9	-24.4	0	0	0	118
644	N	33.9	Very low	33.2	Very low	130.667 Å²	130.667	131.1 Å²	131.1	70%	0.699	76%	0.755	S	S	*	*			cis	166	144.6	25.3	-103.6	-40.8	0	0	0	116.3
645	N	34.7	Very low	33.4	Very low	135.667 Å²	135.667	133.2 Å²	133.2	73%	0.725	76%	0.758	S	S	*	*			trans	66.4	136.3	147.6	-62.9	-25.7	0	0	0	122.7
646	T	33.6	Very low	33.5	Very low	139.667 Å²	139.667	131.1 Å²	131.1	86%	0.857	76%	0.756	S	S	*	*				110.3	132.8	108.8	30.9	0	0	0	0	119.6
647	A	30.6	Very low	33.5	Very low	93.3333 Å²	93.3333	128.3 Å²	128.3	77%	0.771	75%	0.753	S	S	*	*			trans	-162.7	-173.1	160.3	0	0	0	0	0	114.5
648	P	43.7	Very low	33.7	Very low	120.667 Å²	120.667	126.7 Å²	126.7	78%	0.784	75%	0.749	S	S	*	*				-121.9	-135.2	-52.3	36	-15.8	0	0	0	114.8
649	P	43.3	Very low	33.6	Very low	114 Å²	114	131 Å²	131	74%	0.74	75%	0.752	S	S	*	*				-134.2	-170.2	77.1	39.9	-20.5	0	0	0	116.2
650	L	32.4	Very low	33.6	Very low	168 Å²	168	132.6 Å²	132.6	88%	0.88	75%	0.75	S	S	*	*			trans	-159.3	167.9	-176.3	-104.2	164.5	0	0	0	113.8
651	V	34	Very low	33.3	Very low	130.333 Å²	130.333	129.5 Å²	129.5	79%	0.79	74%	0.743	S	S	*	*			trans	-133.1	150.5	177.3	144.2	0	0	0	0	113.8
652	Q	30.2	Very low	33.2	Very low	161.667 Å²	161.667	134.3 Å²	134.3	76%	0.755	75%	0.749	S	S	*	*			trans	166.7	153	-169.6	-160.2	-178.4	-37	0	0	117.6
653	T	29.2	Very low	33	Very low	104 Å²	104	134.6 Å²	134.6	64%	0.638	75%	0.746	S	S	*	*			trans	77.7	133.5	155.4	44.3	0	0	0	0	123.1	I655	T653-I655 HydrophobicContact CG2-CD1 4.1Å
654	Y	32.9	Very low	32.9	Very low	210 Å²	210	136.4 Å²	136.4	82%	0.824	75%	0.751	S	S	*	*			trans	142.2	133	130.7	-100.7	-101.8	0	0	0	115.8
655	I	32.2	Very low	32.7	Very low	137.667 Å²	137.667	138.6 Å²	138.6	71%	0.706	76%	0.757	S	S	*	*				53.2	126	119.6	-43.3	177.2	0	0	0	119.1	T653	T653-I655 HydrophobicContact CG2-CD1 4.1Å
656	S	31.7	Very low	32.5	Very low	106.333 Å²	106.333	135.8 Å²	135.8	74%	0.744	76%	0.76	S	S	*	*				157.5	142.4	117.4	-67.3	0	0	0	0	118.9
657	S	32	Very low	32.4	Very low	106 Å²	106	140.7 Å²	140.7	74%	0.741	76%	0.763	S	S	*	*			trans	7	141.8	156.7	57.7	0	0	0	0	120.1
658	V	33.4	Very low	32.9	Very low	125 Å²	125	141 Å²	141	76%	0.758	76%	0.757	S	S	*	*				160.4	145	91.2	166.5	0	0	0	0	113.1
659	Q	32.5	Very low	32.3	Very low	154.333 Å²	154.333	142.1 Å²	142.1	72%	0.721	76%	0.756	S	S	*	*			trans	-131.6	153.1	178.9	-78.3	166	-81.9	0	0	115.1
660	Q	31	Very low	31.9	Very low	163.333 Å²	163.333	144.1 Å²	144.1	76%	0.763	76%	0.76	S	S	*	*				103.4	144.2	111.5	-91.2	170.8	-16.9	0	0	115.9
661	S	28.2	Very low	32.1	Very low	100 Å²	100	142 Å²	142	70%	0.699	76%	0.757	S	S	*	*			cis	169.5	154.1	23.7	60.3	0	0	0	0	114.8
662	Q	30.2	Very low	32	Very low	162 Å²	162	139.4 Å²	139.4	76%	0.757	76%	0.756	S	S	*	*			trans	37.2	148.4	160.6	-67.8	179.1	8.9	0	0	118.1
663	Q	29.6	Very low	32	Very low	141 Å²	141	139.3 Å²	139.3	66%	0.659	76%	0.76	S	S	*	*			cis	173.3	158	28.2	-112	174.6	15.2	0	0	116
664	Q	32.5	Very low	32.1	Very low	160.667 Å²	160.667	141.2 Å²	141.2	75%	0.751	77%	0.765	S	S	*	*			trans	-54.6	149.3	158.2	-64.3	175.7	12.7	0	0	113.7
665	Q	28.3	Very low	32	Very low	177.667 Å²	177.667	137.9 Å²	137.9	83%	0.83	76%	0.761	S	S	*	*			trans	-170.5	161.6	141.1	-91.6	-179.7	8.3	0	0	110.8
666	G	30.6	Very low	31.9	Very low	76 Å²	76	135.3 Å²	135.3	78%	0.784	76%	0.755	S	S	*	*			trans	-125	154.2	179.8	0	0	0	0	0	113.9
667	R	31.6	Very low	31.9	Very low	243.667 Å²	243.667	136.2 Å²	136.2	92%	0.919	76%	0.756	S	S	*	*			trans	-103.3	164.2	171.4	-106.3	-175.4	171.8	-178.4	-2.6	110.3
668	P	40.8	Very low	31.8	Very low	99.6667 Å²	99.6667	141.8 Å²	141.8	65%	0.647	76%	0.761	S	S	*	*			cis	-134.2	-175.8	-19.6	35.4	-15.2	0	0	0	114.8
669	N	32.5	Very low	31.6	Very low	143 Å²	143	140.3 Å²	140.3	77%	0.765	76%	0.756	S	S	*	*			trans	76.6	106.3	158.3	-57.9	-12.1	0	0	0	119.9
670	N	34.5	Very low	31.5	Very low	156 Å²	156	139.8 Å²	139.8	83%	0.834	76%	0.757	S	S	*	*				36.7	151.9	113.2	-87.3	-5.8	0	0	0	116.2
671	P	35.6	Very low	31.3	Very low	123.667 Å²	123.667	140.2 Å²	140.2	80%	0.803	76%	0.759	S	S	*	*			cis	-140.2	164.4	7.9	38.1	-21.7	0	0	0	115.6
672	G	31.7	Very low	31.9	Very low	75.6667 Å²	75.6667	140.4 Å²	140.4	78%	0.78	76%	0.758	S	S	*	*			trans	103.6	106.2	160.8	0	0	0	0	0	117
673	L	31.1	Very low	32	Very low	159.333 Å²	159.333	138.1 Å²	138.1	83%	0.834	76%	0.755	S	S	*	*			cis	-162.4	146.7	32.1	-162.7	69.8	0	0	0	110.2
674	I	30.6	Very low	32.1	Very low	144.333 Å²	144.333	141.9 Å²	141.9	74%	0.74	77%	0.765	S	S	*	*			trans	97.2	128.7	139.7	-32	169.6	0	0	0	112.9
675	D	30.9	Very low	31.9	Very low	140.333 Å²	140.333	138.7 Å²	138.7	75%	0.75	76%	0.76	S	S	*	*				158.2	151	58.1	-145.7	16.8	0	0	0	112.8
676	S	31.8	Very low	31.9	Very low	82.3333 Å²	82.3333	135.9 Å²	135.9	58%	0.576	76%	0.755	S	S	*	*			trans	56.3	147	134.2	-92.9	0	0	0	0	120.8
677	T	31.5	Very low	32	Very low	125.667 Å²	125.667	137.6 Å²	137.6	77%	0.771	75%	0.751	S	S	*	*			trans	60.1	145.9	147.6	63.4	0	0	0	0	120.5
678	R	28.7	Very low	32	Very low	224.333 Å²	224.333	132.8 Å²	132.8	85%	0.847	74%	0.743	S	S	*	*			cis	98.9	128.3	20.7	-157.9	-171.7	-174.6	174.2	1.5	109.7
679	S	28.7	Very low	31.6	Very low	93.3333 Å²	93.3333	135.6 Å²	135.6	65%	0.653	75%	0.753	S	S	*	*				110.1	160.4	79.5	120.8	0	0	0	0	115.4
680	I	30.9	Very low	31.5	Very low	143.333 Å²	143.333	132.4 Å²	132.4	74%	0.735	75%	0.746	S	S	*	*			trans	78.5	113.7	161.2	-65.3	161.6	0	0	0	116.6
681	E	28	Very low	31.5	Very low	172 Å²	172	131.9 Å²	131.9	80%	0.804	74%	0.743	S	S	*	*				61	175.4	111.1	-84.2	178.8	142.8	0	0	116.7
682	P	40.5	Very low	31.3	Very low	104.667 Å²	104.667	136.7 Å²	136.7	68%	0.68	75%	0.745	S	S	*	*				-117.2	-164.6	-82.6	34	-19.5	0	0	0	113.6
683	T	31	Very low	31.3	Very low	113.667 Å²	113.667	137.2 Å²	137.2	70%	0.697	74%	0.742	S	S	*	*			trans	112.1	130.2	133.4	-1	0	0	0	0	116.4
684	Y	31.3	Very low	31.4	Very low	221.333 Å²	221.333	139.1 Å²	139.1	87%	0.868	74%	0.743	S	S	*	*			trans	5	156.5	152.9	-80	-75.7	0	0	0	118.4
685	S	28.2	Very low	31.6	Very low	92 Å²	92	136.8 Å²	136.8	64%	0.643	74%	0.74	S	S	*	*			trans	119.1	139.5	159.5	63.8	0	0	0	0	118.7
686	T	30.1	Very low	31.5	Very low	119.333 Å²	119.333	138.6 Å²	138.6	73%	0.732	74%	0.742	S	S	*	*			trans	61.9	137.9	139	50.5	0	0	0	0	123
687	T	32.7	Very low	31.6	Very low	112 Å²	112	139.6 Å²	139.6	69%	0.687	75%	0.748	S	S	*	*				97.3	118.6	123.5	39.2	0	0	0	0	115.7
688	N	31.1	Very low	31.8	Very low	142 Å²	142	140.8 Å²	140.8	76%	0.759	75%	0.745	S	S	*	*				55.4	132.6	112.1	-60.3	8.7	0	0	0	117.9
689	D	31.6	Very low	32	Very low	158.667 Å²	158.667	134.2 Å²	134.2	85%	0.848	73%	0.733	S	S	*	*			trans	85.6	138.4	131.5	-99.4	-15.6	0	0	0	114.4
690	A	31.8	Very low	32.3	Very low	76 Å²	76	136.7 Å²	136.7	63%	0.628	74%	0.739	S	S	*	*			cis	-165.9	179.7	-30.7	0	0	0	0	0	109.6
691	L	33.7	Very low	32.4	Very low	146.333 Å²	146.333	134.7 Å²	134.7	77%	0.766	74%	0.738	S	S	*	*			trans	54.8	140	154.8	-54.8	174.2	0	0	0	116.7
692	R	31	Very low	32.8	Very low	223 Å²	223	133 Å²	133	84%	0.842	74%	0.739	S	S	*	*			cis	-163.5	154.6	-0.1	-163.3	178.4	-144	157.9	-0.4	111
693	A	31.9	Very low	32.5	Very low	87.3333 Å²	87.3333	134 Å²	134	72%	0.722	74%	0.743	S	S	*	*			trans	-30.1	154.5	168.2	0	0	0	0	0	116.3
694	K	33.3	Very low	32.7	Very low	199 Å²	199	135 Å²	135	87%	0.865	75%	0.748	S	S	*	*				-151.3	141	102.3	-101.3	168.8	-176.3	178.6	0	111.5
695	S	34.5	Very low	33	Very low	95.6667 Å²	95.6667	130.7 Å²	130.7	67%	0.669	75%	0.745	S	S	*	*				88.3	125.4	77.2	98.5	0	0	0	0	114.7
696	K	30	Very low	33.4	Very low	179.333 Å²	179.333	132.8 Å²	132.8	78%	0.78	75%	0.745	S	S	*	*			trans	76.5	159.2	137.4	-63.9	-173.1	-176	-176.8	0	116.9	H698	K696-H698 HydrophobicContact CB-CB 3.66Å; K696-H698 HydrophobicContact CD-CB 4.31Å; K696-H698 WeakPolarHBondContact CD-CD2 2.99Å
697	S	33.2	Very low	33.6	Very low	102 Å²	102	137.1 Å²	137.1	71%	0.713	75%	0.747	S	S	*	*			cis	28.7	-173	6.5	53	0	0	0	0	114.6
698	H	34.5	Very low	33.7	Very low	151.667 Å²	151.667	140.2 Å²	140.2	70%	0.702	75%	0.751	S	S	*	*				-172.8	143.8	56.1	-133	-94.2	0	0	0	115.6	K696	K696-H698 HydrophobicContact CB-CB 3.66Å; K696-H698 HydrophobicContact CD-CB 4.31Å; K696-H698 WeakPolarHBondContact CD-CD2 2.99Å
699	S	33.5	Very low	34.2	Very low	84.6667 Å²	84.6667	138.3 Å²	138.3	59%	0.592	75%	0.75	S	S	*	*			trans	28	156.7	152.4	65.8	0	0	0	0	116.9
700	D	34.7	Very low	34.6	Very low	146.667 Å²	146.667	139.6 Å²	139.6	78%	0.784	75%	0.748	S	S	*	*			cis	-164.3	170.5	26.8	-102.1	-30.6	0	0	0	111.1
701	S	34.3	Very low	35.3	Very low	101.333 Å²	101.333	144.8 Å²	144.8	71%	0.709	76%	0.758	S	S	*	*			trans	-38.3	132.3	176.7	61	0	0	0	0	119.2
702	V	34.9	Very low	35.9	Very low	136.667 Å²	136.667	146.2 Å²	146.2	83%	0.828	76%	0.76	S	S	*	*				93.7	122.4	123.4	176.6	0	0	0	0	114.1
703	V	35.4	Very low	37.1	Very low	126 Å²	126	140.9 Å²	140.9	76%	0.764	76%	0.757	S	S	*	*			trans	-132.9	148	134.1	-178.6	0	0	0	0	114.9
704	V	34.9	Very low	38.8	Very low	134 Å²	134	139.2 Å²	139.2	81%	0.812	74%	0.738	S	S	*	*			trans	74.1	141.7	148.3	-169.5	0	0	0	0	115.7
705	V	38.3	Very low	40.8	Very low	131.333 Å²	131.333	138.9 Å²	138.9	80%	0.796	73%	0.732	S	S	*	*				-128.2	147.9	123.7	178.2	0	0	0	0	111.1
706	E	35.3	Very low	43	Very low	136.667 Å²	136.667	139.6 Å²	139.6	64%	0.639	72%	0.72	S	S	*	*			trans	-114.3	142.9	164.3	-146.1	-149.1	-162.2	0	0	114.3	K708	E706-K708 HydrophobicContact CG-CG 4.21Å; E706-K708 WeakPolarHBondContact OE1-CE 3.39Å; E706-K708 WeakPolarHBondContact OE1-CG 3.48Å; E706-K708 IonicContact OE1-NZ 2.74Å; E706-K708 PolarHBondContact OE1-NZ 2.74Å; E706-K708 IonicContact OE2-NZ 3.52Å; E706-K708 PolarHBondContact OE2-NZ 3.49Å
707	R	35.9	Very low	45.5	Very low	208.333 Å²	208.333	137.6 Å²	137.6	79%	0.786	71%	0.709	S	S	*	*			trans	89.9	128.4	151.8	-68.1	-176.1	-179.4	170.3	-0.7	117.2
708	K	33.5	Very low	47.7	Very low	177 Å²	177	141.8 Å²	141.8	77%	0.77	71%	0.709	S	S	*	*				-122.8	138.8	123.7	-82.4	175.3	177.3	152.1	0	111.5	E706	E706-K708 HydrophobicContact CG-CG 4.21Å; E706-K708 WeakPolarHBondContact OE1-CE 3.39Å; E706-K708 WeakPolarHBondContact OE1-CG 3.48Å; E706-K708 IonicContact OE1-NZ 2.74Å; E706-K708 PolarHBondContact OE1-NZ 2.74Å; E706-K708 IonicContact OE2-NZ 3.52Å; E706-K708 PolarHBondContact OE2-NZ 3.49Å
709	S	41.3	Very low	50.1	Low	103.667 Å²	103.667	138.3 Å²	138.3	73%	0.725	70%	0.695	S	S	*	*			cis	-164.2	147.5	31.5	48.8	0	0	0	0	110.8
710	K	40.8	Very low	52.7	Low	185.667 Å²	185.667	138.2 Å²	138.2	81%	0.807	69%	0.687	S	S	*	*			trans	10.3	111.7	164.8	-66.9	-175.7	177.3	-177.1	0	117.2
711	H	45.3	Very low	55.1	Low	185.333 Å²	185.333	134.5 Å²	134.5	86%	0.858	67%	0.673	S	S	*	*			trans	-95.6	136.8	151.6	-73.6	-81.3	0	0	0	111.1	C713	H711-C713 PolarHBondContact O-N 2.91Å; H711-C713 VanDerWaalsContact O-N 3.15Å
712	H	47.7	Very low	57.9	Low	174.333 Å²	174.333	134.7 Å²	134.7	81%	0.807	66%	0.664	S	S	*	*			trans	-84.9	123.8	171	-73.5	11	0	0	0	110.1	P714	H712-P714 WeakPolarHBondContact O-CD 3.43Å
713	C	54.9	Low	60.6	Low	113 Å²	113	133.5 Å²	133.5	76%	0.764	65%	0.653	S	S	*	*			trans	-77.4	125.4	164.2	-68.8	0	0	0	0	108.6	H711 W715	H711-C713 PolarHBondContact O-N 2.91Å; H711-C713 VanDerWaalsContact O-N 3.15Å; C713-W715 PolarHBondContact O-N 3.09Å
714	P	68.9	Low	63.4	Low	51.3333 Å²	51.3333	132 Å²	132	33%	0.333	64%	0.64	S	S	.	*			trans	-78.4	140.2	-169.6	15.3	-13.2	0	0	0	112.2	H712 Y716 Y717	H712-P714 WeakPolarHBondContact O-CD 3.43Å; P714-Y716 HydrophobicContact CB-CD1 3.65Å; P714-Y716 HydrophobicContact CB-CE1 3.57Å; P714-Y716 VanDerWaalsContact CB-CE1 3.46Å; P714-Y716 HydrophobicContact CB-CG 4.45Å; P714-Y716 HydrophobicContact CG-CD1 4Å; P714-Y716 HydrophobicContact CG-CE1 3.45Å; P714-Y716 VanDerWaalsContact CG-CE1 3.46Å; P714-Y716 HydrophobicContact CG-CE2 4.38Å; P714-Y716 PolarHBondContact O-N 3.27Å; P714-Y717 HydrophobicContact CG-CD2 3.77Å; P714-Y717 HydrophobicContact CG-CE2 3.81Å; P714-Y717 PolarHBondContact O-N 3.22Å
715	W	75.4	Confident	66.1	Low	193 Å²	193	130.9 Å²	130.9	73%	0.731	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.4	-22.5	-178	60.8	-77.9	0	0	0	115.2	C713 Y717 W718 I719	C713-W715 PolarHBondContact O-N 3.09Å; W715-Y717 PolarHBondContact O-N 3.16Å; W715-W718 WeakPolarHBondContact O-CB 3.43Å; W715-W718 PolarHBondContact O-N 2.93Å; W715-W718 VanDerWaalsContact O-N 3.08Å; W715-I719 HydrophobicContact CE3-CD1 3.53Å; W715-I719 HydrophobicContact CE3-CG1 4.36Å; W715-I719 HydrophobicContact CZ3-CD1 3.39Å; W715-I719 VanDerWaalsContact CZ3-CD1 3.44Å; W715-I719 PolarHBondContact O-N 2.99Å
716	Y	81.2	Confident	68.6	Low	109.333 Å²	109.333	127.2 Å²	127.2	43%	0.429	61%	0.612	S	S	.	*	H	α-helix	trans	-59.9	-31	176.8	70.2	-111.7	0	0	0	113	P714 W718 I719 I720	P714-Y716 HydrophobicContact CB-CD1 3.65Å; P714-Y716 HydrophobicContact CB-CE1 3.57Å; P714-Y716 VanDerWaalsContact CB-CE1 3.46Å; P714-Y716 HydrophobicContact CB-CG 4.45Å; P714-Y716 HydrophobicContact CG-CD1 4Å; P714-Y716 HydrophobicContact CG-CE1 3.45Å; P714-Y716 VanDerWaalsContact CG-CE1 3.46Å; P714-Y716 HydrophobicContact CG-CE2 4.38Å; P714-Y716 PolarHBondContact O-N 3.27Å; Y716-W718 VanDerWaalsContact C-N 3.3Å; Y716-W718 PolarHBondContact O-N 3.1Å; Y716-I719 PolarHBondContact O-N 3.16Å; Y716-I720 HydrophobicContact CD2-CD1 3.97Å; Y716-I720 VanDerWaalsContact O-CG1 3.32Å; Y716-I720 WeakPolarHBondContact O-CG1 3.31Å; Y716-I720 PolarHBondContact O-N 3.21Å
717	Y	80.9	Confident	71.4	Confident	138 Å²	138	127.3 Å²	127.3	54%	0.541	61%	0.61	S	S	.	*	H	α-helix	trans	-65.4	-33.3	175.9	-76.8	-66.6	0	0	0	112.6	P714 W715 S721	P714-Y717 HydrophobicContact CG-CD2 3.77Å; P714-Y717 HydrophobicContact CG-CE2 3.81Å; P714-Y717 PolarHBondContact O-N 3.22Å; W715-Y717 PolarHBondContact O-N 3.16Å; Y717-S721 VanDerWaalsContact O-CB 3.27Å; Y717-S721 WeakPolarHBondContact O-CB 3.34Å; Y717-S721 PolarHBondContact O-N 2.98Å
718	W	79.4	Confident	74.2	Confident	190.333 Å²	190.333	121.8 Å²	121.8	72%	0.721	60%	0.596	S	S	*	*	H	α-helix	trans	-68.5	-41	174	-79	96.9	0	0	0	111.5	W715 Y716 S721 I722	W715-W718 WeakPolarHBondContact O-CB 3.43Å; W715-W718 PolarHBondContact O-N 2.93Å; W715-W718 VanDerWaalsContact O-N 3.08Å; Y716-W718 VanDerWaalsContact C-N 3.3Å; Y716-W718 PolarHBondContact O-N 3.1Å; W718-S721 PolarHBondContact O-N 3.23Å; W718-I722 WeakPolarHBondContact O-CB 3.38Å; W718-I722 WeakPolarHBondContact O-CD1 3.23Å; W718-I722 VanDerWaalsContact O-CG1 3.25Å; W718-I722 WeakPolarHBondContact O-CG1 3.26Å; W718-I722 PolarHBondContact O-N 2.94Å
719	I	85.6	Confident	76.9	Confident	77.6667 Å²	77.6667	118.1 Å²	118.1	40%	0.398	58%	0.584	S	S	.	*	H	α-helix	trans	-66.2	-44.1	175.7	-66.7	-175.1	0	0	0	111.3	W715 Y716 S721 I722 L723	W715-I719 HydrophobicContact CE3-CD1 3.53Å; W715-I719 HydrophobicContact CE3-CG1 4.36Å; W715-I719 HydrophobicContact CZ3-CD1 3.39Å; W715-I719 VanDerWaalsContact CZ3-CD1 3.44Å; W715-I719 PolarHBondContact O-N 2.99Å; Y716-I719 PolarHBondContact O-N 3.16Å; I719-S721 VanDerWaalsContact C-N 3.31Å; I719-S721 PolarHBondContact O-N 2.85Å; I719-I722 PolarHBondContact O-N 2.99Å; I719-L723 HydrophobicContact CG2-CD1 3.84Å; I719-L723 HydrophobicContact CG2-CG 4.26Å; I719-L723 WeakPolarHBondContact O-CB 3.3Å; I719-L723 VanDerWaalsContact O-CG 3.3Å; I719-L723 WeakPolarHBondContact O-CG 3.32Å; I719-L723 PolarHBondContact O-N 3.44Å
720	I	88.1	Confident	79.3	Confident	82.6667 Å²	82.6667	115.7 Å²	115.7	42%	0.424	57%	0.571	S	S	.	*	H	α-helix	trans	-60.5	-42.6	175.2	-68.5	171.2	0	0	0	110.5	Y716 L723 I724	Y716-I720 HydrophobicContact CD2-CD1 3.97Å; Y716-I720 VanDerWaalsContact O-CG1 3.32Å; Y716-I720 WeakPolarHBondContact O-CG1 3.31Å; Y716-I720 PolarHBondContact O-N 3.21Å; I720-L723 PolarHBondContact O-N 2.57Å; I720-I724 HydrophobicContact CG2-CD1 3.71Å; I720-I724 HydrophobicContact CG2-CG1 4.41Å; I720-I724 WeakPolarHBondContact O-CB 3.39Å; I720-I724 VanDerWaalsContact O-CG1 3.26Å; I720-I724 WeakPolarHBondContact O-CG1 3.31Å; I720-I724 PolarHBondContact O-N 3.03Å
721	S	86.1	Confident	81.7	Confident	69 Å²	69	110.9 Å²	110.9	48%	0.483	55%	0.553	S	S	.	*	H	α-helix	trans	-61.6	-44.4	175.5	-171.5	0	0	0	0	112.4	Y717 W718 I719 I724 L725	Y717-S721 VanDerWaalsContact O-CB 3.27Å; Y717-S721 WeakPolarHBondContact O-CB 3.34Å; Y717-S721 PolarHBondContact O-N 2.98Å; W718-S721 PolarHBondContact O-N 3.23Å; I719-S721 VanDerWaalsContact C-N 3.31Å; I719-S721 PolarHBondContact O-N 2.85Å; S721-I724 PolarHBondContact O-N 2.96Å; S721-L725 WeakPolarHBondContact O-CB 3.39Å; S721-L725 PolarHBondContact O-N 3.07Å
722	I	91.5	Very high	83.7	Confident	105 Å²	105	106.3 Å²	106.3	54%	0.538	54%	0.539	S	S	.	.	H	α-helix	trans	-64.9	-41.4	176.6	-70	163.9	0	0	0	111.4	W718 I719 L725 A726	W718-I722 WeakPolarHBondContact O-CB 3.38Å; W718-I722 WeakPolarHBondContact O-CD1 3.23Å; W718-I722 VanDerWaalsContact O-CG1 3.25Å; W718-I722 WeakPolarHBondContact O-CG1 3.26Å; W718-I722 PolarHBondContact O-N 2.94Å; I719-I722 PolarHBondContact O-N 2.99Å; I722-L725 PolarHBondContact O-N 2.93Å; I722-A726 VanDerWaalsContact O-CB 3.3Å; I722-A726 WeakPolarHBondContact O-CB 3.27Å; I722-A726 PolarHBondContact O-N 2.99Å
723	L	92.4	Very high	85.5	Confident	112 Å²	112	102.5 Å²	102.5	59%	0.586	52%	0.524	S	S	*	.	H	α-helix	trans	-66.5	-39.9	176.8	-71.7	172.1	0	0	0	112	I719 I720 A726 F727	I719-L723 HydrophobicContact CG2-CD1 3.84Å; I719-L723 HydrophobicContact CG2-CG 4.26Å; I719-L723 WeakPolarHBondContact O-CB 3.3Å; I719-L723 VanDerWaalsContact O-CG 3.3Å; I719-L723 WeakPolarHBondContact O-CG 3.32Å; I719-L723 PolarHBondContact O-N 3.44Å; I720-L723 PolarHBondContact O-N 2.57Å; L723-A726 PolarHBondContact O-N 3.11Å; L723-F727 VanDerWaalsContact O-CB 3.29Å; L723-F727 WeakPolarHBondContact O-CB 3.42Å; L723-F727 PolarHBondContact O-N 3.11Å
724	I	93	Very high	86.8	Confident	95 Å²	95	99.9 Å²	99.9	49%	0.487	51%	0.51	S	S	.	.	H	α-helix	trans	-64.8	-43.8	173.4	-70.4	167.9	0	0	0	110.4	I720 S721 A726 F727 L728	I720-I724 HydrophobicContact CG2-CD1 3.71Å; I720-I724 HydrophobicContact CG2-CG1 4.41Å; I720-I724 WeakPolarHBondContact O-CB 3.39Å; I720-I724 VanDerWaalsContact O-CG1 3.26Å; I720-I724 WeakPolarHBondContact O-CG1 3.31Å; I720-I724 PolarHBondContact O-N 3.03Å; S721-I724 PolarHBondContact O-N 2.96Å; I724-A726 PolarHBondContact O-N 2.66Å; I724-F727 PolarHBondContact O-N 2.82Å; I724-L728 HydrophobicContact CG2-CD1 3.9Å; I724-L728 HydrophobicContact CG2-CG 4.39Å; I724-L728 WeakPolarHBondContact O-CB 3.27Å; I724-L728 VanDerWaalsContact O-CG 3.29Å; I724-L728 WeakPolarHBondContact O-CG 3.2Å; I724-L728 PolarHBondContact O-N 3.08Å
725	L	92.4	Very high	87.6	Confident	109.333 Å²	109.333	101.3 Å²	101.3	57%	0.572	52%	0.518	S	S	*	.	H	α-helix	trans	-62.8	-43.2	177.3	-169.2	74.4	0	0	0	111.7	S721 I722 L728 L729	S721-L725 WeakPolarHBondContact O-CB 3.39Å; S721-L725 PolarHBondContact O-N 3.07Å; I722-L725 PolarHBondContact O-N 2.93Å; L725-L728 PolarHBondContact O-N 3.24Å; L725-L729 HydrophobicContact CG-CD1 4.27Å; L725-L729 WeakPolarHBondContact O-CB 3.49Å; L725-L729 WeakPolarHBondContact O-CG 3.42Å; L725-L729 PolarHBondContact O-N 2.94Å
726	A	91.9	Very high	87.7	Confident	54 Å²	54	94.9 Å²	94.9	45%	0.446	50%	0.502	S	S	.	.	H	α-helix	trans	-65.3	-40.6	176.3	0	0	0	0	0	112.1	I722 L723 I724 L729 A730	I722-A726 VanDerWaalsContact O-CB 3.3Å; I722-A726 WeakPolarHBondContact O-CB 3.27Å; I722-A726 PolarHBondContact O-N 2.99Å; L723-A726 PolarHBondContact O-N 3.11Å; I724-A726 PolarHBondContact O-N 2.66Å; A726-L729 PolarHBondContact O-N 3.13Å; A726-A730 WeakPolarHBondContact O-CB 3.26Å; A726-A730 PolarHBondContact O-N 3.2Å
727	F	94.3	Very high	87.4	Confident	138.667 Å²	138.667	96.2 Å²	96.2	61%	0.608	51%	0.51	S	S	*	.	H	α-helix	trans	-65.4	-41.8	174.9	-176.9	-102.3	0	0	0	112	L723 I724 A730 L731	L723-F727 VanDerWaalsContact O-CB 3.29Å; L723-F727 WeakPolarHBondContact O-CB 3.42Å; L723-F727 PolarHBondContact O-N 3.11Å; I724-F727 PolarHBondContact O-N 2.82Å; F727-A730 PolarHBondContact O-N 3.03Å; F727-L731 HydrophobicContact CD1-CD1 4.15Å; F727-L731 HydrophobicContact CE1-CD1 3.66Å; F727-L731 VanDerWaalsContact CE1-CD1 3.41Å; F727-L731 HydrophobicContact CE1-CG 4.28Å; F727-L731 HydrophobicContact CZ-CD1 4.1Å; F727-L731 HydrophobicContact CZ-CG 4.33Å; F727-L731 WeakPolarHBondContact O-CB 3.3Å; F727-L731 PolarHBondContact O-N 3.05Å
728	L	93	Very high	87.1	Confident	92.6667 Å²	92.6667	92.3 Å²	92.3	49%	0.485	50%	0.503	S	S	.	.	H	α-helix	trans	-65.2	-40.8	174.6	-72.2	171.5	0	0	0	112	I724 L725 L731 V732	I724-L728 HydrophobicContact CG2-CD1 3.9Å; I724-L728 HydrophobicContact CG2-CG 4.39Å; I724-L728 WeakPolarHBondContact O-CB 3.27Å; I724-L728 VanDerWaalsContact O-CG 3.29Å; I724-L728 WeakPolarHBondContact O-CG 3.2Å; I724-L728 PolarHBondContact O-N 3.08Å; L725-L728 PolarHBondContact O-N 3.24Å; L728-L731 PolarHBondContact O-N 3.1Å; L728-V732 WeakPolarHBondContact O-CB 3.31Å; L728-V732 WeakPolarHBondContact O-CG2 3.1Å; L728-V732 PolarHBondContact O-N 3.03Å
729	L	91.6	Very high	86.8	Confident	100 Å²	100	89.8 Å²	89.8	52%	0.524	50%	0.5	S	S	.	.	H	α-helix	trans	-62.3	-43.7	172.7	-91.7	165.3	0	0	0	111.9	L725 A726 L731 V732 L733	L725-L729 HydrophobicContact CG-CD1 4.27Å; L725-L729 WeakPolarHBondContact O-CB 3.49Å; L725-L729 WeakPolarHBondContact O-CG 3.42Å; L725-L729 PolarHBondContact O-N 2.94Å; A726-L729 PolarHBondContact O-N 3.13Å; L729-L731 VanDerWaalsContact C-N 3.31Å; L729-L731 PolarHBondContact O-N 3.35Å; L729-V732 PolarHBondContact O-N 2.91Å; L729-L733 WeakPolarHBondContact O-CB 3.32Å; L729-L733 VanDerWaalsContact O-CG 3.29Å; L729-L733 WeakPolarHBondContact O-CG 3.35Å; L729-L733 PolarHBondContact O-N 3.34Å
730	A	90	Very high	86	Confident	54.3333 Å²	54.3333	92.3 Å²	92.3	45%	0.449	51%	0.509	S	S	.	.	H	α-helix	trans	-63	-38.2	175.2	0	0	0	0	0	112.1	A726 F727 A734	A726-A730 WeakPolarHBondContact O-CB 3.26Å; A726-A730 PolarHBondContact O-N 3.2Å; F727-A730 PolarHBondContact O-N 3.03Å; A730-A734 VanDerWaalsContact O-CB 3.24Å; A730-A734 WeakPolarHBondContact O-CB 3.31Å; A730-A734 PolarHBondContact O-N 3.34Å
731	L	91.3	Very high	85.1	Confident	83.3333 Å²	83.3333	94.6 Å²	94.6	44%	0.436	52%	0.517	S	S	.	.	H	α-helix	trans	-67.6	-44	175.2	-121.3	168.6	0	0	0	111.9	F727 L728 L729 A734 V735	F727-L731 HydrophobicContact CD1-CD1 4.15Å; F727-L731 HydrophobicContact CE1-CD1 3.66Å; F727-L731 VanDerWaalsContact CE1-CD1 3.41Å; F727-L731 HydrophobicContact CE1-CG 4.28Å; F727-L731 HydrophobicContact CZ-CD1 4.1Å; F727-L731 HydrophobicContact CZ-CG 4.33Å; F727-L731 WeakPolarHBondContact O-CB 3.3Å; F727-L731 PolarHBondContact O-N 3.05Å; L728-L731 PolarHBondContact O-N 3.1Å; L729-L731 VanDerWaalsContact C-N 3.31Å; L729-L731 PolarHBondContact O-N 3.35Å; L731-A734 PolarHBondContact O-N 3.1Å; L731-V735 HydrophobicContact CD2-CG2 4.28Å; L731-V735 WeakPolarHBondContact O-CB 3.12Å; L731-V735 WeakPolarHBondContact O-CG2 3.42Å; L731-V735 PolarHBondContact O-N 3.28Å
732	V	88.3	Confident	84.5	Confident	90 Å²	90	98.2 Å²	98.2	55%	0.545	52%	0.524	S	S	.	.	H	α-helix	trans	-62.4	-44.2	175.2	168.8	0	0	0	0	110.9	L728 L729 V735 S736	L728-V732 WeakPolarHBondContact O-CB 3.31Å; L728-V732 WeakPolarHBondContact O-CG2 3.1Å; L728-V732 PolarHBondContact O-N 3.03Å; L729-V732 PolarHBondContact O-N 2.91Å; V732-V735 PolarHBondContact O-N 3.09Å; V732-S736 WeakPolarHBondContact O-CB 3.26Å; V732-S736 PolarHBondContact O-N 3.03Å; V732-S736 PolarHBondContact O-OG 3.16Å; V732-S736 VanDerWaalsContact O-OG 3.09Å
733	L	84.4	Confident	83.5	Confident	94 Å²	94	102.3 Å²	102.3	49%	0.492	53%	0.532	S	S	.	.	H	α-helix	trans	-62.6	-43.5	174.5	-73	169	0	0	0	111.5	L729 V735 S736 F737	L729-L733 WeakPolarHBondContact O-CB 3.32Å; L729-L733 VanDerWaalsContact O-CG 3.29Å; L729-L733 WeakPolarHBondContact O-CG 3.35Å; L729-L733 PolarHBondContact O-N 3.34Å; L733-V735 VanDerWaalsContact C-N 3.34Å; L733-V735 PolarHBondContact O-N 3.13Å; L733-S736 WeakPolarHBondContact O-CB 3.36Å; L733-S736 PolarHBondContact O-N 3.12Å; L733-F737 HydrophobicContact CB-CD2 4.46Å; L733-F737 HydrophobicContact CD2-CE2 4.45Å; L733-F737 WeakPolarHBondContact O-CB 3.43Å; L733-F737 VanDerWaalsContact O-CD2 3.28Å; L733-F737 WeakPolarHBondContact O-CD2 3.32Å; L733-F737 PolarHBondContact O-N 3.07Å
734	A	83.4	Confident	82	Confident	58.6667 Å²	58.6667	102.1 Å²	102.1	49%	0.485	53%	0.531	S	S	.	.	H	α-helix	trans	-64	-36	177	0	0	0	0	0	112.9	A730 L731 S738	A730-A734 VanDerWaalsContact O-CB 3.24Å; A730-A734 WeakPolarHBondContact O-CB 3.31Å; A730-A734 PolarHBondContact O-N 3.34Å; L731-A734 PolarHBondContact O-N 3.1Å; A734-S738 WeakPolarHBondContact O-CB 3.27Å; A734-S738 PolarHBondContact O-N 3.15Å
735	V	84.9	Confident	80.7	Confident	80.3333 Å²	80.3333	101.2 Å²	101.2	49%	0.487	53%	0.527	S	S	.	.	H	α-helix	trans	-69	-45.2	172.6	171.1	0	0	0	0	110.8	L731 V732 L733 F737 S738 E739	L731-V735 HydrophobicContact CD2-CG2 4.28Å; L731-V735 WeakPolarHBondContact O-CB 3.12Å; L731-V735 WeakPolarHBondContact O-CG2 3.42Å; L731-V735 PolarHBondContact O-N 3.28Å; V732-V735 PolarHBondContact O-N 3.09Å; L733-V735 VanDerWaalsContact C-N 3.34Å; L733-V735 PolarHBondContact O-N 3.13Å; V735-F737 PolarHBondContact O-N 3.17Å; V735-S738 CarbonylContact O-C 3.52Å; V735-S738 WeakPolarHBondContact O-CA 3.48Å; V735-S738 WeakPolarHBondContact O-CB 3.32Å; V735-S738 PolarHBondContact O-N 3.01Å; V735-S738 VanDerWaalsContact O-N 3.14Å; V735-E739 PolarHBondContact O-N 3.24Å
736	S	77.8	Confident	79.5	Confident	58.3333 Å²	58.3333	101.3 Å²	101.3	41%	0.408	53%	0.525	S	S	.	.	H	α-helix	trans	-59.3	-48.1	177	-57.8	0	0	0	0	111.7	V732 L733 S738 E739 E740	V732-S736 WeakPolarHBondContact O-CB 3.26Å; V732-S736 PolarHBondContact O-N 3.03Å; V732-S736 PolarHBondContact O-OG 3.16Å; V732-S736 VanDerWaalsContact O-OG 3.09Å; L733-S736 WeakPolarHBondContact O-CB 3.36Å; L733-S736 PolarHBondContact O-N 3.12Å; S736-S738 VanDerWaalsContact C-N 3.29Å; S736-S738 PolarHBondContact O-N 3.17Å; S736-E739 PolarHBondContact O-N 2.91Å; S736-E740 WeakPolarHBondContact O-CB 3.36Å; S736-E740 PolarHBondContact O-N 2.94Å
737	F	74.2	Confident	77.9	Confident	136 Å²	136	107.1 Å²	107.1	60%	0.596	54%	0.535	S	S	*	.	H	α-helix	trans	-67.1	-26.1	174.4	-78.5	-61.3	0	0	0	113.1	L733 V735 K741	L733-F737 HydrophobicContact CB-CD2 4.46Å; L733-F737 HydrophobicContact CD2-CE2 4.45Å; L733-F737 WeakPolarHBondContact O-CB 3.43Å; L733-F737 VanDerWaalsContact O-CD2 3.28Å; L733-F737 WeakPolarHBondContact O-CD2 3.32Å; L733-F737 PolarHBondContact O-N 3.07Å; V735-F737 PolarHBondContact O-N 3.17Å; F737-K741 WeakPolarHBondContact O-CA 3.47Å; F737-K741 WeakPolarHBondContact O-CB 3.25Å; F737-K741 PolarHBondContact O-N 3.08Å
738	S	76.3	Confident	75.9	Confident	57 Å²	57	103.7 Å²	103.7	40%	0.399	52%	0.523	S	S	.	.	H	α-helix	trans	-73.8	-38.5	173.6	-174.5	0	0	0	0	112.2	A734 V735 S736 K741 K742	A734-S738 WeakPolarHBondContact O-CB 3.27Å; A734-S738 PolarHBondContact O-N 3.15Å; V735-S738 CarbonylContact O-C 3.52Å; V735-S738 WeakPolarHBondContact O-CA 3.48Å; V735-S738 WeakPolarHBondContact O-CB 3.32Å; V735-S738 PolarHBondContact O-N 3.01Å; V735-S738 VanDerWaalsContact O-N 3.14Å; S736-S738 VanDerWaalsContact C-N 3.29Å; S736-S738 PolarHBondContact O-N 3.17Å; S738-K741 PolarHBondContact O-N 3.39Å; S738-K742 WeakPolarHBondContact O-CB 3.36Å; S738-K742 VanDerWaalsContact O-CG 3.29Å; S738-K742 WeakPolarHBondContact O-CG 3.47Å; S738-K742 PolarHBondContact O-N 3.15Å
739	E	72	Confident	74.1	Confident	137.667 Å²	137.667	106.1 Å²	106.1	64%	0.643	53%	0.532	S	S	*	.	H	α-helix	trans	-72.8	-42.2	174.6	-95.6	-170.7	171.2	0	0	111.8	V735 S736 K741 K742 R743	V735-E739 PolarHBondContact O-N 3.24Å; S736-E739 PolarHBondContact O-N 2.91Å; E739-K741 PolarHBondContact O-N 3.29Å; E739-K742 PolarHBondContact O-N 2.74Å; E739-R743 WeakPolarHBondContact O-CB 3.23Å; E739-R743 PolarHBondContact O-N 2.95Å
740	E	68.9	Low	72.3	Confident	129.333 Å²	129.333	105.8 Å²	105.8	60%	0.604	53%	0.528	S	S	*	.	H	α-helix	trans	-61.6	-43.5	169.6	-77	-151.4	128.1	0	0	111.6	S736 K742 R743 L744	S736-E740 WeakPolarHBondContact O-CB 3.36Å; S736-E740 PolarHBondContact O-N 2.94Å; E740-K742 VanDerWaalsContact C-N 3.34Å; E740-K742 PolarHBondContact O-N 3.04Å; E740-R743 CarbonylContact O-C 3.53Å; E740-R743 WeakPolarHBondContact O-CA 3.47Å; E740-R743 WeakPolarHBondContact O-CB 3.06Å; E740-R743 PolarHBondContact O-N 3.11Å; E740-R743 VanDerWaalsContact O-N 3.09Å; E740-L744 WeakPolarHBondContact O-CA 3.46Å; E740-L744 VanDerWaalsContact O-CB 3.31Å; E740-L744 WeakPolarHBondContact O-CB 3.31Å; E740-L744 PolarHBondContact O-N 2.64Å
741	K	70.5	Confident	70.1	Confident	132.667 Å²	132.667	111.5 Å²	111.5	58%	0.577	54%	0.538	S	S	*	.	H	α-helix	trans	-58.4	-46.3	175.7	179.5	174.2	178.3	178.3	0	111.6	F737 S738 E739 R743 L744 D745	F737-K741 WeakPolarHBondContact O-CA 3.47Å; F737-K741 WeakPolarHBondContact O-CB 3.25Å; F737-K741 PolarHBondContact O-N 3.08Å; S738-K741 PolarHBondContact O-N 3.39Å; E739-K741 PolarHBondContact O-N 3.29Å; K741-R743 VanDerWaalsContact C-N 3.27Å; K741-R743 PolarHBondContact O-N 2.97Å; K741-L744 PolarHBondContact O-N 3.12Å; K741-L744 VanDerWaalsContact O-N 3.16Å; K741-D745 WeakPolarHBondContact O-CB 3.35Å; K741-D745 VanDerWaalsContact O-CG 3.31Å; K741-D745 PolarHBondContact O-N 3.33Å
742	K	72.9	Confident	67.7	Low	144.333 Å²	144.333	113.2 Å²	113.2	63%	0.628	54%	0.542	S	S	*	.	H	α-helix	trans	-63.6	-38.5	176.8	-74.9	174.7	-179.7	177.7	0	112.7	S738 E739 E740 L744 H746	S738-K742 WeakPolarHBondContact O-CB 3.36Å; S738-K742 VanDerWaalsContact O-CG 3.29Å; S738-K742 WeakPolarHBondContact O-CG 3.47Å; S738-K742 PolarHBondContact O-N 3.15Å; E739-K742 PolarHBondContact O-N 2.74Å; E740-K742 VanDerWaalsContact C-N 3.34Å; E740-K742 PolarHBondContact O-N 3.04Å; K742-L744 VanDerWaalsContact C-N 3.34Å; K742-H746 WeakPolarHBondContact O-CB 3.3Å; K742-H746 PolarHBondContact O-N 3.1Å
743	R	70.4	Confident	65.6	Low	190.667 Å²	190.667	113 Å²	113	72%	0.719	55%	0.549	S	S	*	.	H	α-helix	trans	-70.1	-32.5	176.4	-137.5	179.3	-157.3	168.3	2.7	112	E739 E740 K741 R747	E739-R743 WeakPolarHBondContact O-CB 3.23Å; E739-R743 PolarHBondContact O-N 2.95Å; E740-R743 CarbonylContact O-C 3.53Å; E740-R743 WeakPolarHBondContact O-CA 3.47Å; E740-R743 WeakPolarHBondContact O-CB 3.06Å; E740-R743 PolarHBondContact O-N 3.11Å; E740-R743 VanDerWaalsContact O-N 3.09Å; K741-R743 VanDerWaalsContact C-N 3.27Å; K741-R743 PolarHBondContact O-N 2.97Å; R743-R747 VanDerWaalsContact O-CB 3.24Å; R743-R747 WeakPolarHBondContact O-CB 3.18Å; R743-R747 WeakPolarHBondContact O-CG 3.22Å; R743-R747 PolarHBondContact O-N 3.06Å; R743-R747 VanDerWaalsContact O-N 3.09Å
744	L	61	Low	63.7	Low	108.333 Å²	108.333	115.6 Å²	115.6	57%	0.567	56%	0.559	S	S	*	*	H	α-helix	trans	-76.3	-42.6	176.1	-167.4	69.5	0	0	0	111.1	E740 K741 K742 H746 R747 L748	E740-L744 WeakPolarHBondContact O-CA 3.46Å; E740-L744 VanDerWaalsContact O-CB 3.31Å; E740-L744 WeakPolarHBondContact O-CB 3.31Å; E740-L744 PolarHBondContact O-N 2.64Å; K741-L744 PolarHBondContact O-N 3.12Å; K741-L744 VanDerWaalsContact O-N 3.16Å; K742-L744 VanDerWaalsContact C-N 3.34Å; L744-H746 VanDerWaalsContact C-N 3.33Å; L744-H746 PolarHBondContact O-N 2.92Å; L744-R747 PolarHBondContact O-N 3.18Å; L744-L748 HydrophobicContact CD1-CD1 4.45Å; L744-L748 HydrophobicContact CD1-CG 4.3Å; L744-L748 HydrophobicContact CD2-CD1 4.45Å; L744-L748 HydrophobicContact CG-CD1 4.06Å; L744-L748 HydrophobicContact CG-CG 4.2Å; L744-L748 WeakPolarHBondContact O-CA 3.3Å; L744-L748 VanDerWaalsContact O-CB 3.28Å; L744-L748 WeakPolarHBondContact O-CB 3.36Å; L744-L748 VanDerWaalsContact O-CG 3.32Å; L744-L748 WeakPolarHBondContact O-CG 3.41Å; L744-L748 PolarHBondContact O-N 3Å
745	D	64.9	Low	61.5	Low	75.6667 Å²	75.6667	116.4 Å²	116.4	41%	0.405	56%	0.555	S	S	.	*	H	α-helix	trans	-56.3	-46.9	170.7	-82.7	-21.9	0	0	0	110.2	K741 R747 L748 Q749	K741-D745 WeakPolarHBondContact O-CB 3.35Å; K741-D745 VanDerWaalsContact O-CG 3.31Å; K741-D745 PolarHBondContact O-N 3.33Å; D745-R747 PolarHBondContact O-N 3.08Å; D745-L748 WeakPolarHBondContact O-CB 3.1Å; D745-L748 PolarHBondContact O-N 3.13Å; D745-Q749 WeakPolarHBondContact O-CB 3.4Å; D745-Q749 WeakPolarHBondContact O-CG 3.34Å; D745-Q749 PolarHBondContact O-N 3.07Å
746	H	67	Low	59.4	Low	111.333 Å²	111.333	117.3 Å²	117.3	52%	0.515	56%	0.562	S	S	.	*	H	α-helix	trans	-63.1	-46.2	177.2	-163.1	-72.2	0	0	0	112.3	K742 L744 L748 Q749 E750	K742-H746 WeakPolarHBondContact O-CB 3.3Å; K742-H746 PolarHBondContact O-N 3.1Å; L744-H746 VanDerWaalsContact C-N 3.33Å; L744-H746 PolarHBondContact O-N 2.92Å; H746-L748 VanDerWaalsContact C-N 3.3Å; H746-L748 PolarHBondContact O-N 3.03Å; H746-Q749 PolarHBondContact O-N 3.17Å; H746-Q749 VanDerWaalsContact O-N 3.16Å; H746-E750 IonicContact CE1-OE1 3.14Å; H746-E750 PolarHBondContact CE1-OE1 2.99Å; H746-E750 IonicContact CE1-OE2 2.94Å; H746-E750 PolarHBondContact CE1-OE2 3.34Å; H746-E750 IonicContact ND1-OE1 3.24Å; H746-E750 IonicContact ND1-OE2 2.95Å; H746-E750 PolarHBondContact ND1-OE2 3.22Å; H746-E750 VanDerWaalsContact O-CB 3.3Å; H746-E750 WeakPolarHBondContact O-CB 3.41Å; H746-E750 VanDerWaalsContact O-CG 3.27Å; H746-E750 WeakPolarHBondContact O-CG 3.4Å; H746-E750 PolarHBondContact O-N 3.06Å
747	R	58.6	Low	57.6	Low	175 Å²	175	117.5 Å²	117.5	66%	0.66	57%	0.568	S	S	*	*	H	α-helix	trans	-66.8	-32.2	176.3	-74.7	-135.1	-155.5	-164.8	11.2	113.2	R743 L744 D745 R751	R743-R747 VanDerWaalsContact O-CB 3.24Å; R743-R747 WeakPolarHBondContact O-CB 3.18Å; R743-R747 WeakPolarHBondContact O-CG 3.22Å; R743-R747 PolarHBondContact O-N 3.06Å; R743-R747 VanDerWaalsContact O-N 3.09Å; L744-R747 PolarHBondContact O-N 3.18Å; D745-R747 PolarHBondContact O-N 3.08Å; R747-R751 WeakPolarHBondContact O-CB 3.26Å; R747-R751 VanDerWaalsContact O-CG 3.26Å; R747-R751 WeakPolarHBondContact O-CG 3.33Å; R747-R751 PolarHBondContact O-N 3Å; R747-R751 VanDerWaalsContact O-N 3.12Å
748	L	51.8	Low	56	Low	69 Å²	69	115.7 Å²	115.7	36%	0.361	56%	0.563	S	S	.	*	H	α-helix	trans	-67.5	-46.5	173	-82.8	164.9	0	0	0	109.6	L744 D745 H746 E750 R751 F752	L744-L748 HydrophobicContact CD1-CD1 4.45Å; L744-L748 HydrophobicContact CD1-CG 4.3Å; L744-L748 HydrophobicContact CD2-CD1 4.45Å; L744-L748 HydrophobicContact CG-CD1 4.06Å; L744-L748 HydrophobicContact CG-CG 4.2Å; L744-L748 WeakPolarHBondContact O-CA 3.3Å; L744-L748 VanDerWaalsContact O-CB 3.28Å; L744-L748 WeakPolarHBondContact O-CB 3.36Å; L744-L748 VanDerWaalsContact O-CG 3.32Å; L744-L748 WeakPolarHBondContact O-CG 3.41Å; L744-L748 PolarHBondContact O-N 3Å; D745-L748 WeakPolarHBondContact O-CB 3.1Å; D745-L748 PolarHBondContact O-N 3.13Å; H746-L748 VanDerWaalsContact C-N 3.3Å; H746-L748 PolarHBondContact O-N 3.03Å; L748-E750 VanDerWaalsContact C-N 3.33Å; L748-E750 PolarHBondContact O-N 2.99Å; L748-R751 CarbonylContact O-C 3.58Å; L748-R751 PolarHBondContact O-N 3.21Å; L748-R751 VanDerWaalsContact O-N 3.14Å; L748-F752 HydrophobicContact CB-CD2 4.26Å; L748-F752 HydrophobicContact CB-CE2 4.14Å; L748-F752 HydrophobicContact CD2-CE2 4.13Å; L748-F752 HydrophobicContact CD2-CZ 3.97Å; L748-F752 HydrophobicContact CG-CE2 4.45Å; L748-F752 WeakPolarHBondContact O-CB 3.36Å; L748-F752 WeakPolarHBondContact O-CD2 3.29Å; L748-F752 WeakPolarHBondContact O-CG 3.38Å; L748-F752 PolarHBondContact O-N 3.33Å
749	Q	55.8	Low	54.4	Low	141.333 Å²	141.333	118.7 Å²	118.7	66%	0.66	57%	0.573	S	S	*	*	H	α-helix	trans	-66.3	-34.1	177.3	-99.6	177.3	-46.6	0	0	112.6	D745 H746 R751 F752 A753	D745-Q749 WeakPolarHBondContact O-CB 3.4Å; D745-Q749 WeakPolarHBondContact O-CG 3.34Å; D745-Q749 PolarHBondContact O-N 3.07Å; H746-Q749 PolarHBondContact O-N 3.17Å; H746-Q749 VanDerWaalsContact O-N 3.16Å; Q749-R751 VanDerWaalsContact C-N 3.34Å; Q749-R751 PolarHBondContact O-N 3.39Å; Q749-F752 PolarHBondContact O-N 2.79Å; Q749-A753 VanDerWaalsContact O-CB 3.23Å; Q749-A753 WeakPolarHBondContact O-CB 3.29Å; Q749-A753 PolarHBondContact O-N 3.18Å
750	E	53.8	Low	53.2	Low	94.6667 Å²	94.6667	113.9 Å²	113.9	44%	0.442	56%	0.561	S	S	.	*	H	α-helix	trans	-67.2	-38.6	170.3	-74.3	172.2	128.6	0	0	112.3	H746 L748 A753 Q754	H746-E750 IonicContact CE1-OE1 3.14Å; H746-E750 PolarHBondContact CE1-OE1 2.99Å; H746-E750 IonicContact CE1-OE2 2.94Å; H746-E750 PolarHBondContact CE1-OE2 3.34Å; H746-E750 IonicContact ND1-OE1 3.24Å; H746-E750 IonicContact ND1-OE2 2.95Å; H746-E750 PolarHBondContact ND1-OE2 3.22Å; H746-E750 VanDerWaalsContact O-CB 3.3Å; H746-E750 WeakPolarHBondContact O-CB 3.41Å; H746-E750 VanDerWaalsContact O-CG 3.27Å; H746-E750 WeakPolarHBondContact O-CG 3.4Å; H746-E750 PolarHBondContact O-N 3.06Å; L748-E750 VanDerWaalsContact C-N 3.33Å; L748-E750 PolarHBondContact O-N 2.99Å; E750-A753 CarbonylContact O-C 3.46Å; E750-A753 PolarHBondContact O-N 2.7Å; E750-Q754 WeakPolarHBondContact O-CB 3.41Å; E750-Q754 VanDerWaalsContact O-CG 3.27Å; E750-Q754 WeakPolarHBondContact O-CG 3.3Å; E750-Q754 PolarHBondContact O-N 3.34Å
751	R	44.2	Very low	52.7	Low	174.333 Å²	174.333	108.1 Å²	108.1	66%	0.658	54%	0.535	S	S	*	.	H	α-helix	trans	-68.4	-44.5	172	-76.8	-129.3	-163.9	-172.7	8.4	112.5	R747 L748 Q749 A753 Q754 D755	R747-R751 WeakPolarHBondContact O-CB 3.26Å; R747-R751 VanDerWaalsContact O-CG 3.26Å; R747-R751 WeakPolarHBondContact O-CG 3.33Å; R747-R751 PolarHBondContact O-N 3Å; R747-R751 VanDerWaalsContact O-N 3.12Å; L748-R751 CarbonylContact O-C 3.58Å; L748-R751 PolarHBondContact O-N 3.21Å; L748-R751 VanDerWaalsContact O-N 3.14Å; Q749-R751 VanDerWaalsContact C-N 3.34Å; Q749-R751 PolarHBondContact O-N 3.39Å; R751-A753 PolarHBondContact O-N 3.4Å; R751-A753 VanDerWaalsContact O-N 3.17Å; R751-Q754 CarbonylContact O-C 3.32Å; R751-Q754 PolarHBondContact O-N 2.96Å; R751-D755 WeakPolarHBondContact O-CA 3.48Å; R751-D755 WeakPolarHBondContact O-CB 3.33Å; R751-D755 PolarHBondContact O-N 2.9Å
752	F	40.8	Very low	52.2	Low	119.333 Å²	119.333	105 Å²	105	52%	0.523	52%	0.521	S	S	.	.	H	α-helix	trans	-62	-24	176.6	-76.7	-54.5	0	0	0	112.5	L748 Q749 I759	L748-F752 HydrophobicContact CB-CD2 4.26Å; L748-F752 HydrophobicContact CB-CE2 4.14Å; L748-F752 HydrophobicContact CD2-CE2 4.13Å; L748-F752 HydrophobicContact CD2-CZ 3.97Å; L748-F752 HydrophobicContact CG-CE2 4.45Å; L748-F752 WeakPolarHBondContact O-CB 3.36Å; L748-F752 WeakPolarHBondContact O-CD2 3.29Å; L748-F752 WeakPolarHBondContact O-CG 3.38Å; L748-F752 PolarHBondContact O-N 3.33Å; Q749-F752 PolarHBondContact O-N 2.79Å; F752-I759 HydrophobicContact CD1-CD1 4.33Å; F752-I759 HydrophobicContact CE1-CD1 3.62Å; F752-I759 HydrophobicContact CZ-CD1 4.3Å
753	A	44.2	Very low	51.8	Low	84 Å²	84	101.7 Å²	101.7	69%	0.694	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-10	174.1	0	0	0	0	0	114.3	Q749 E750 R751	Q749-A753 VanDerWaalsContact O-CB 3.23Å; Q749-A753 WeakPolarHBondContact O-CB 3.29Å; Q749-A753 PolarHBondContact O-N 3.18Å; E750-A753 CarbonylContact O-C 3.46Å; E750-A753 PolarHBondContact O-N 2.7Å; R751-A753 PolarHBondContact O-N 3.4Å; R751-A753 VanDerWaalsContact O-N 3.17Å
754	Q	45	Very low	51.2	Low	149.333 Å²	149.333	97.7 Å²	97.7	70%	0.698	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.8	-24.9	-176.5	-71.8	-178.5	-10.7	0	0	114.1	E750 R751 P756 M784	E750-Q754 WeakPolarHBondContact O-CB 3.41Å; E750-Q754 VanDerWaalsContact O-CG 3.27Å; E750-Q754 WeakPolarHBondContact O-CG 3.3Å; E750-Q754 PolarHBondContact O-N 3.34Å; R751-Q754 CarbonylContact O-C 3.32Å; R751-Q754 PolarHBondContact O-N 2.96Å; Q754-P756 VanDerWaalsContact O-CD 3.29Å; Q754-P756 WeakPolarHBondContact O-CD 3.31Å; Q754-M784 VanDerWaalsContact O-CE 3.31Å; Q754-M784 WeakPolarHBondContact O-CE 3.43Å
755	D	37.4	Very low	51.4	Low	75.3333 Å²	75.3333	99.4 Å²	99.4	40%	0.403	52%	0.519	S	S	.	.			trans	-133.6	89.2	-178.8	-107.3	-39.2	0	0	0	112	R751 A757 I758	R751-D755 WeakPolarHBondContact O-CA 3.48Å; R751-D755 WeakPolarHBondContact O-CB 3.33Å; R751-D755 PolarHBondContact O-N 2.9Å; D755-A757 PolarHBondContact O-N 3.05Å; D755-A757 VanDerWaalsContact O-N 3.15Å; D755-I758 HydrophobicContact CB-CB 4.49Å; D755-I758 HydrophobicContact CB-CD1 3.93Å; D755-I758 HydrophobicContact CB-CG1 4.14Å; D755-I758 PolarHBondContact O-N 2.86Å
756	P	40.4	Very low	51.5	Low	99.6667 Å²	99.6667	98.4 Å²	98.4	65%	0.647	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-2.2	176	31.1	-35.4	0	0	0	113.5	Q754 I758 M784	Q754-P756 VanDerWaalsContact O-CD 3.29Å; Q754-P756 WeakPolarHBondContact O-CD 3.31Å; P756-I758 VanDerWaalsContact C-N 3.25Å; P756-I758 PolarHBondContact O-N 3.5Å; P756-M784 WeakPolarHBondContact CG-O 3.39Å
757	A	40	Very low	52	Low	63 Å²	63	98.5 Å²	98.5	52%	0.521	53%	0.529	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-17.2	178.8	0	0	0	0	0	114.1	D755 I759 I824	D755-A757 PolarHBondContact O-N 3.05Å; D755-A757 VanDerWaalsContact O-N 3.15Å; A757-I759 PolarHBondContact O-N 2.85Å; A757-I824 HydrophobicContact CB-CD1 3.62Å
758	I	40.5	Very low	53.1	Low	97.6667 Å²	97.6667	91.6 Å²	91.6	50%	0.501	51%	0.506	S	S	.	.	S	Bend	trans	-104.7	67.1	-164.4	-58.9	-179.2	0	0	0	112.4	D755 P756	D755-I758 HydrophobicContact CB-CB 4.49Å; D755-I758 HydrophobicContact CB-CD1 3.93Å; D755-I758 HydrophobicContact CB-CG1 4.14Å; D755-I758 PolarHBondContact O-N 2.86Å; P756-I758 VanDerWaalsContact C-N 3.25Å; P756-I758 PolarHBondContact O-N 3.5Å
759	I	41.8	Very low	54.9	Low	119 Å²	119	93 Å²	93	61%	0.61	51%	0.507	S	S	*	.	S	Bend	trans	95.8	94.9	168.3	-51.7	171.9	0	0	0	114.4	F752 A757	F752-I759 HydrophobicContact CD1-CD1 4.33Å; F752-I759 HydrophobicContact CE1-CD1 3.62Å; F752-I759 HydrophobicContact CZ-CD1 4.3Å; A757-I759 PolarHBondContact O-N 2.85Å
760	G	47.6	Very low	56.6	Low	38.3333 Å²	38.3333	91.8 Å²	91.8	40%	0.395	50%	0.504	S	S	.	.			trans	111.3	112.8	164.4	0	0	0	0	0	114.4	F762	G760-F762 PolarHBondContact O-N 2.98Å; G760-F762 VanDerWaalsContact O-N 3.12Å
761	L	58.4	Low	58.3	Low	7.66667 Å²	7.66667	87.8 Å²	87.8	4%	0.04	49%	0.485	C	S	.	.	S	Bend	trans	-78.8	19.5	173.6	-69.7	-179.8	0	0	0	113.4	S786 S788 F815 I824 A891 V893	L761-S786 WeakPolarHBondContact O-CB 3.27Å; L761-S786 PolarHBondContact O-OG 2.84Å; L761-S788 PolarHBondContact O-OG 3.37Å; L761-F815 HydrophobicContact CD1-CB 4.28Å; L761-F815 HydrophobicContact CD1-CD1 4.25Å; L761-F815 HydrophobicContact CD1-CD2 3.72Å; L761-F815 HydrophobicContact CD1-CE1 4.27Å; L761-F815 HydrophobicContact CD1-CE2 4.03Å; L761-F815 HydrophobicContact CD1-CG 3.84Å; L761-F815 HydrophobicContact CD1-CZ 4.3Å; L761-I824 HydrophobicContact CD1-CG1 4.07Å; L761-I824 HydrophobicContact CD2-CD1 3.97Å; L761-I824 HydrophobicContact CD2-CG1 3.65Å; L761-I824 HydrophobicContact CG-CG1 3.97Å; L761-A891 HydrophobicContact CB-CB 3.9Å; L761-A891 HydrophobicContact CD1-CB 4.01Å; L761-A891 HydrophobicContact CG-CB 4.44Å; L761-V893 HydrophobicContact CD1-CG2 3.96Å; L761-V893 HydrophobicContact CD2-CG1 4.25Å; L761-V893 HydrophobicContact CD2-CG2 3.57Å; L761-V893 HydrophobicContact CG-CG2 4.33Å
762	F	60.3	Low	60.4	Low	66.3333 Å²	66.3333	84.3 Å²	84.3	29%	0.291	48%	0.477	S	S	.	.	S	Bend	trans	-136.9	129.9	-172.7	105.6	-88.1	0	0	0	109.7	G760 P764 S766 S788 M821 P822 A891	G760-F762 PolarHBondContact O-N 2.98Å; G760-F762 VanDerWaalsContact O-N 3.12Å; F762-P764 HydrophobicContact CD2-CB 4.34Å; F762-P764 HydrophobicContact CE1-CB 4Å; F762-P764 HydrophobicContact CE2-CB 3.71Å; F762-P764 HydrophobicContact CZ-CB 4.34Å; F762-P764 WeakPolarHBondContact O-CD 3.41Å; F762-S766 VanDerWaalsContact CE2-O 3.31Å; F762-S766 WeakPolarHBondContact CE2-O 3.34Å; F762-S788 VanDerWaalsContact CD1-CB 3.41Å; F762-M821 HydrophobicContact CB-CE 4.05Å; F762-M821 HydrophobicContact CB-CG 4.07Å; F762-M821 HydrophobicContact CB-SD 3.93Å; F762-M821 VanDerWaalsContact CB-SD 3.53Å; F762-M821 HydrophobicContact CD1-CE 3.54Å; F762-M821 HydrophobicContact CD1-CG 4.12Å; F762-M821 HydrophobicContact CD1-SD 3.78Å; F762-M821 VanDerWaalsContact CD1-SD 3.53Å; F762-M821 HydrophobicContact CD2-CB 4.11Å; F762-M821 HydrophobicContact CD2-CE 4.46Å; F762-M821 HydrophobicContact CD2-CG 4.29Å; F762-M821 HydrophobicContact CD2-SD 3.77Å; F762-M821 HydrophobicContact CE1-CB 4.2Å; F762-M821 HydrophobicContact CE1-CE 3.88Å; F762-M821 HydrophobicContact CE1-CG 3.72Å; F762-M821 HydrophobicContact CE1-SD 3.8Å; F762-M821 HydrophobicContact CE2-CB 3.51Å; F762-M821 HydrophobicContact CE2-CG 3.93Å; F762-M821 HydrophobicContact CE2-SD 4.25Å; F762-M821 HydrophobicContact CG-CE 4.23Å; F762-M821 HydrophobicContact CG-CG 4.41Å; F762-M821 HydrophobicContact CG-SD 3.53Å; F762-M821 VanDerWaalsContact CG-SD 3.56Å; F762-M821 WeakPolarHBondContact CG-SD 3.5Å; F762-M821 HydrophobicContact CZ-CB 3.58Å; F762-M821 HydrophobicContact CZ-CG 3.64Å; F762-M821 HydrophobicContact CZ-SD 4.07Å; F762-P822 WeakPolarHBondContact CE2-O 3.25Å; F762-P822 HydrophobicContact CZ-CG 4.07Å; F762-P822 WeakPolarHBondContact CZ-O 3.32Å; F762-A891 HydrophobicContact CE1-CB 4.12Å; F762-A891 HydrophobicContact CZ-CB 4.08Å
763	D	63.2	Low	62.6	Low	75 Å²	75	81.6 Å²	81.6	40%	0.401	48%	0.476	S	S	.	.			trans	-77.7	116.2	162.9	-176.8	-23.1	0	0	0	107.6	N765 S766	D763-N765 PolarHBondContact O-N 3.14Å; D763-N765 VanDerWaalsContact OD1-CB 3.31Å; D763-N765 WeakPolarHBondContact OD1-CB 3.37Å; D763-N765 PolarHBondContact OD1-N 2.93Å; D763-N765 PolarHBondContact OD1-ND2 2.92Å; D763-S766 PolarHBondContact O-N 2.67Å; D763-S766 PolarHBondContact O-OG 3.19Å; D763-S766 VanDerWaalsContact O-OG 3.08Å
764	P	59	Low	64.4	Low	108.333 Å²	108.333	83.2 Å²	83.2	70%	0.703	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-8.7	-176.8	27.8	-35.7	0	0	0	113.7	F762	F762-P764 HydrophobicContact CD2-CB 4.34Å; F762-P764 HydrophobicContact CE1-CB 4Å; F762-P764 HydrophobicContact CE2-CB 3.71Å; F762-P764 HydrophobicContact CZ-CB 4.34Å; F762-P764 WeakPolarHBondContact O-CD 3.41Å
765	N	64.1	Low	66.6	Low	143.333 Å²	143.333	80.3 Å²	80.3	77%	0.766	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-8.3	175.1	-51.3	-83	0	0	0	112.9	D763	D763-N765 PolarHBondContact O-N 3.14Å; D763-N765 VanDerWaalsContact OD1-CB 3.31Å; D763-N765 WeakPolarHBondContact OD1-CB 3.37Å; D763-N765 PolarHBondContact OD1-N 2.93Å; D763-N765 PolarHBondContact OD1-ND2 2.92Å
766	S	68.4	Low	69	Low	55.3333 Å²	55.3333	81.4 Å²	81.4	39%	0.387	46%	0.464	S	S	.	.	S	Bend	trans	-121.8	114.8	178.7	63.4	0	0	0	0	111.9	F762 D763	F762-S766 VanDerWaalsContact CE2-O 3.31Å; F762-S766 WeakPolarHBondContact CE2-O 3.34Å; D763-S766 PolarHBondContact O-N 2.67Å; D763-S766 PolarHBondContact O-OG 3.19Å; D763-S766 VanDerWaalsContact O-OG 3.08Å
767	P	76.3	Confident	71.5	Confident	113.333 Å²	113.333	77.3 Å²	77.3	74%	0.736	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-67.6	150.6	174.4	29	-34.3	0	0	0	111.3
768	P	81.9	Confident	74	Confident	28.3333 Å²	28.3333	79.9 Å²	79.9	18%	0.184	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-65.1	142.1	-179.3	28	-35.3	0	0	0	111.9	I770 S788 Q790 M821 F889	P768-I770 PolarHBondContact O-N 3.24Å; P768-S788 WeakPolarHBondContact CA-O 3.19Å; P768-Q790 HydrophobicContact CB-CB 4.28Å; P768-Q790 HydrophobicContact CG-CB 4.33Å; P768-M821 HydrophobicContact CB-CE 3.89Å; P768-M821 HydrophobicContact CG-CE 3.81Å; P768-F889 HydrophobicContact CG-CD1 4.24Å; P768-F889 HydrophobicContact CG-CE1 4.08Å
769	Y	89.2	Confident	76.4	Confident	100.333 Å²	100.333	75.6 Å²	75.6	39%	0.393	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	123.4	179.9	-175.8	-86.6	0	0	0	111.6	L771 V777 W787 S788 G789 Q790	Y769-L771 HydrophobicContact CD1-CD2 4.33Å; Y769-L771 HydrophobicContact CD1-CG 4.36Å; Y769-L771 HydrophobicContact CE1-CD2 4.47Å; Y769-L771 PolarHBondContact O-N 3.21Å; Y769-V777 HydrophobicContact CD1-CG1 4.46Å; Y769-V777 HydrophobicContact CD1-CG2 4.36Å; Y769-V777 HydrophobicContact CE1-CG1 4.13Å; Y769-V777 HydrophobicContact CE1-CG2 3.69Å; Y769-W787 VanDerWaalsContact CB-CZ2 3.49Å; Y769-W787 HydrophobicContact CD1-CH2 4.44Å; Y769-W787 AromaticContact CD1-CZ2 3.99Å; Y769-W787 HydrophobicContact CD1-CZ2 4Å; Y769-W787 AromaticContact CG-CZ2 3.91Å; Y769-W787 HydrophobicContact CG-CZ2 3.91Å; Y769-S788 PolarHBondContact N-O 3.01Å; Y769-G789 CarbonylContact O-C 3.54Å; Y769-G789 VanDerWaalsContact O-CA 3.23Å; Y769-G789 WeakPolarHBondContact O-CA 3.38Å; Y769-Q790 PolarHBondContact O-N 3.19Å
770	I	91	Very high	78.7	Confident	115.333 Å²	115.333	74.4 Å²	74.4	59%	0.591	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.6	121.7	178.7	-57	176.1	0	0	0	109.8	P768	P768-I770 PolarHBondContact O-N 3.24Å
771	L	90.4	Very high	80.7	Confident	9.66667 Å²	9.66667	72.7 Å²	72.7	5%	0.051	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-90.5	135.5	-178.3	-72.7	159.3	0	0	0	111.4	Y769 V777 W787 Q790 W791 L890 F904 I906	Y769-L771 HydrophobicContact CD1-CD2 4.33Å; Y769-L771 HydrophobicContact CD1-CG 4.36Å; Y769-L771 HydrophobicContact CE1-CD2 4.47Å; Y769-L771 PolarHBondContact O-N 3.21Å; L771-V777 HydrophobicContact CD2-CG2 3.84Å; L771-W787 HydrophobicContact CD1-CH2 4.43Å; L771-W787 HydrophobicContact CD2-CH2 4.28Å; L771-Q790 WeakPolarHBondContact CB-O 3.21Å; L771-Q790 PolarHBondContact N-O 2.99Å; L771-W791 HydrophobicContact CB-CE3 3.93Å; L771-L890 HydrophobicContact CD1-CD1 4.16Å; L771-L890 HydrophobicContact CD1-CD2 3.78Å; L771-L890 HydrophobicContact CD1-CG 4.11Å; L771-F904 HydrophobicContact CD1-CE1 4.18Å; L771-F904 HydrophobicContact CD2-CD1 4.17Å; L771-F904 HydrophobicContact CD2-CE1 4.3Å; L771-I906 HydrophobicContact CB-CG2 3.99Å; L771-I906 HydrophobicContact CD1-CG2 4.15Å; L771-I906 HydrophobicContact CD2-CG2 4.32Å; L771-I906 HydrophobicContact CG-CG2 4.39Å
772	E	89.4	Confident	82	Confident	100.667 Å²	100.667	75.4 Å²	75.4	47%	0.47	41%	0.412	S	S	.	.			trans	-109.2	146.8	176.1	-71.4	164.8	-122.7	0	0	110.8	N774 K775	E772-N774 PolarHBondContact O-N 3.04Å; E772-K775 HydrophobicContact CB-CB 3.87Å; E772-K775 HydrophobicContact CB-CD 3.7Å; E772-K775 HydrophobicContact CB-CG 4.47Å; E772-K775 VanDerWaalsContact CD-CD 3.48Å; E772-K775 HydrophobicContact CG-CD 4.18Å; E772-K775 VanDerWaalsContact O-CB 3.31Å; E772-K775 WeakPolarHBondContact O-CB 3.33Å; E772-K775 PolarHBondContact O-N 3.01Å; E772-K775 VanDerWaalsContact O-N 3.12Å; E772-K775 IonicContact OE1-NZ 3.02Å; E772-K775 PolarHBondContact OE1-NZ 3.11Å; E772-K775 VanDerWaalsContact OE2-CD 3.25Å; E772-K775 WeakPolarHBondContact OE2-CD 3.31Å; E772-K775 IonicContact OE2-NZ 2.67Å; E772-K775 PolarHBondContact OE2-NZ 3.16Å
773	A	85.9	Confident	83	Confident	63 Å²	63	74.7 Å²	74.7	52%	0.521	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	125.5	-172.3	0	0	0	0	0	113	K775 W791 I906	A773-K775 PolarHBondContact O-N 3.13Å; A773-K775 VanDerWaalsContact O-N 3.11Å; A773-W791 HydrophobicContact CB-CH2 3.84Å; A773-W791 HydrophobicContact CB-CZ3 4.31Å; A773-I906 CarbonylContact C-O 3.55Å; A773-I906 WeakPolarHBondContact CA-O 3.24Å
774	N	83.2	Confident	83.6	Confident	117.667 Å²	117.667	76.9 Å²	76.9	63%	0.629	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	15.5	-176.7	-61.3	-47.8	0	0	0	115.1	E772 I906	E772-N774 PolarHBondContact O-N 3.04Å; N774-I906 PolarHBondContact N-O 3.07Å
775	K	90.8	Very high	84.8	Confident	89.6667 Å²	89.6667	77.3 Å²	77.3	39%	0.39	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-84.4	126.6	176.1	-167.2	172.9	-171.4	169.6	0	110.2	E772 A773 V777 A905	E772-K775 HydrophobicContact CB-CB 3.87Å; E772-K775 HydrophobicContact CB-CD 3.7Å; E772-K775 HydrophobicContact CB-CG 4.47Å; E772-K775 VanDerWaalsContact CD-CD 3.48Å; E772-K775 HydrophobicContact CG-CD 4.18Å; E772-K775 VanDerWaalsContact O-CB 3.31Å; E772-K775 WeakPolarHBondContact O-CB 3.33Å; E772-K775 PolarHBondContact O-N 3.01Å; E772-K775 VanDerWaalsContact O-N 3.12Å; E772-K775 IonicContact OE1-NZ 3.02Å; E772-K775 PolarHBondContact OE1-NZ 3.11Å; E772-K775 VanDerWaalsContact OE2-CD 3.25Å; E772-K775 WeakPolarHBondContact OE2-CD 3.31Å; E772-K775 IonicContact OE2-NZ 2.67Å; E772-K775 PolarHBondContact OE2-NZ 3.16Å; A773-K775 PolarHBondContact O-N 3.13Å; A773-K775 VanDerWaalsContact O-N 3.11Å; K775-V777 PolarHBondContact O-N 3.04Å; K775-A905 WeakPolarHBondContact O-CB 3.48Å
776	L	88.1	Confident	85.9	Confident	97.6667 Å²	97.6667	72.3 Å²	72.3	51%	0.511	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-82.7	120.1	179.8	-171.9	130.4	0	0	0	110.9	K903 A905	L776-K903 HydrophobicContact CD1-CB 4.1Å; L776-K903 HydrophobicContact CD1-CD 4.4Å; L776-K903 HydrophobicContact CD2-CB 4.18Å; L776-K903 HydrophobicContact CD2-CD 4.25Å; L776-K903 HydrophobicContact CD2-CG 4.43Å; L776-K903 HydrophobicContact CG-CB 4.21Å; L776-A905 HydrophobicContact CB-CB 4.42Å; L776-A905 HydrophobicContact CD1-CB 4.45Å
777	V	92.2	Very high	87	Confident	13.3333 Å²	13.3333	72.2 Å²	72.2	8%	0.081	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	129.2	175.1	-171	0	0	0	0	108.7	Y769 L771 K775 I779 W787 K903 F904	Y769-V777 HydrophobicContact CD1-CG1 4.46Å; Y769-V777 HydrophobicContact CD1-CG2 4.36Å; Y769-V777 HydrophobicContact CE1-CG1 4.13Å; Y769-V777 HydrophobicContact CE1-CG2 3.69Å; L771-V777 HydrophobicContact CD2-CG2 3.84Å; K775-V777 PolarHBondContact O-N 3.04Å; V777-I779 HydrophobicContact CB-CD1 4.4Å; V777-I779 HydrophobicContact CB-CG1 4.4Å; V777-I779 HydrophobicContact CG1-CD1 4.21Å; V777-I779 HydrophobicContact CG1-CG1 3.79Å; V777-W787 HydrophobicContact CG1-CZ2 4.36Å; V777-K903 WeakPolarHBondContact O-CA 3.45Å; V777-F904 PolarHBondContact N-O 3.21Å; V777-F904 PolarHBondContact O-N 3.07Å
778	N	92.3	Very high	87.6	Confident	117 Å²	117	67.3 Å²	67.3	63%	0.626	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94	125.1	170.9	-59.2	-67.4	0	0	0	108.7	K903	N778-K903 WeakPolarHBondContact OD1-CG 3.38Å
779	I	91.2	Very high	88.1	Confident	9 Å²	9	65.9 Å²	65.9	5%	0.046	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	137.8	-172.4	-56	170.5	0	0	0	107.2	V777 L781 W787 L892 I902 F904	V777-I779 HydrophobicContact CB-CD1 4.4Å; V777-I779 HydrophobicContact CB-CG1 4.4Å; V777-I779 HydrophobicContact CG1-CD1 4.21Å; V777-I779 HydrophobicContact CG1-CG1 3.79Å; I779-L781 HydrophobicContact CG2-CD2 3.96Å; I779-L781 HydrophobicContact CG2-CG 4.34Å; I779-W787 HydrophobicContact CD1-CD2 3.76Å; I779-W787 HydrophobicContact CD1-CE3 3.76Å; I779-W787 HydrophobicContact CD1-CG 4.47Å; I779-W787 HydrophobicContact CD1-CH2 3.73Å; I779-W787 HydrophobicContact CD1-CZ2 3.7Å; I779-W787 HydrophobicContact CD1-CZ3 3.75Å; I779-W787 HydrophobicContact CG1-CD2 4.35Å; I779-W787 HydrophobicContact CG1-CZ2 4.24Å; I779-W787 HydrophobicContact CG2-CB 4.01Å; I779-W787 HydrophobicContact CG2-CD2 4.15Å; I779-W787 HydrophobicContact CG2-CG 3.75Å; I779-L892 HydrophobicContact CD1-CD1 3.56Å; I779-I902 HydrophobicContact CB-CB 4.43Å; I779-I902 PolarHBondContact N-O 2.99Å; I779-I902 PolarHBondContact O-N 3.06Å; I779-I902 VanDerWaalsContact O-O 3.08Å; I779-F904 HydrophobicContact CD1-CB 3.92Å
780	V	90.7	Very high	88.2	Confident	93.3333 Å²	93.3333	63.4 Å²	63.4	57%	0.566	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.9	106.9	169.9	-179.6	0	0	0	0	106.9	E782	V780-E782 PolarHBondContact O-N 3.43Å
781	L	87.9	Confident	88.4	Confident	2.66667 Å²	2.66667	58.5 Å²	58.5	1%	0.014	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	124.9	173.3	-62.9	-177.8	0	0	0	109.2	I779 W787 V812 L892 N894 R899 E900 I902	I779-L781 HydrophobicContact CG2-CD2 3.96Å; I779-L781 HydrophobicContact CG2-CG 4.34Å; L781-W787 HydrophobicContact CD2-CB 3.49Å; L781-W787 VanDerWaalsContact CD2-CB 3.49Å; L781-V812 HydrophobicContact CD1-CG1 4.15Å; L781-L892 HydrophobicContact CD1-CB 4.17Å; L781-L892 HydrophobicContact CD2-CB 4.4Å; L781-N894 HydrophobicContact CB-CB 3.67Å; L781-N894 HydrophobicContact CD1-CB 3.78Å; L781-N894 HydrophobicContact CG-CB 4.35Å; L781-R899 WeakPolarHBondContact O-CA 3.38Å; L781-E900 HydrophobicContact CB-CB 4.47Å; L781-E900 PolarHBondContact N-O 2.94Å; L781-E900 PolarHBondContact O-N 3.08Å; L781-I902 HydrophobicContact CD1-CD1 3.46Å; L781-I902 VanDerWaalsContact CD1-CD1 3.46Å; L781-I902 HydrophobicContact CG-CD1 3.97Å
782	E	86.2	Confident	88.5	Confident	65 Å²	65	63.6 Å²	63.6	30%	0.304	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-67.1	160.1	167.9	-67.5	-64.3	158.1	0	0	110.8	V780 M784 K785 N894 R899	V780-E782 PolarHBondContact O-N 3.43Å; E782-M784 PolarHBondContact O-N 3.02Å; E782-K785 HydrophobicContact CB-CB 3.92Å; E782-K785 HydrophobicContact CB-CD 3.98Å; E782-K785 HydrophobicContact CB-CG 3.86Å; E782-K785 HydrophobicContact CG-CD 4.42Å; E782-K785 PolarHBondContact O-N 3.11Å; E782-N894 PolarHBondContact O-ND2 3.4Å; E782-R899 VanDerWaalsContact CD-NE 3.3Å; E782-R899 IonicContact OE1-CZ 3.22Å; E782-R899 VanDerWaalsContact OE1-CZ 3.27Å; E782-R899 IonicContact OE1-NE 2.73Å; E782-R899 PolarHBondContact OE1-NE 3.22Å; E782-R899 VanDerWaalsContact OE1-NE 3.13Å; E782-R899 IonicContact OE1-NH1 3.33Å; E782-R899 IonicContact OE1-NH2 3.09Å; E782-R899 PolarHBondContact OE1-NH2 3.13Å; E782-R899 WeakPolarHBondContact OE2-CG 3.32Å; E782-R899 IonicContact OE2-CZ 3.42Å; E782-R899 IonicContact OE2-NE 2.81Å; E782-R899 PolarHBondContact OE2-NE 2.95Å; E782-R899 IonicContact OE2-NH2 3.46Å; E782-R899 PolarHBondContact OE2-NH2 3Å
783	P	81.4	Confident	88.5	Confident	50.3333 Å²	50.3333	58.8 Å²	58.8	33%	0.327	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	131.8	174.2	-25	34.7	0	0	0	111.7	K785 Q896 R899	P783-K785 PolarHBondContact O-N 3.35Å; P783-K785 VanDerWaalsContact O-N 3.09Å; P783-Q896 WeakPolarHBondContact CA-O 3.39Å; P783-R899 HydrophobicContact CG-CG 4.4Å
784	M	76.7	Confident	88.4	Confident	120.667 Å²	120.667	58.9 Å²	58.9	59%	0.594	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	23.8	177.9	-57.6	-139.5	103.4	0	0	115.1	Q754 P756 E782 N894 D895 Q896	Q754-M784 VanDerWaalsContact O-CE 3.31Å; Q754-M784 WeakPolarHBondContact O-CE 3.43Å; P756-M784 WeakPolarHBondContact CG-O 3.39Å; E782-M784 PolarHBondContact O-N 3.02Å; M784-N894 VanDerWaalsContact CA-O 3.26Å; M784-N894 WeakPolarHBondContact CA-O 3.28Å; M784-N894 PolarHBondContact N-O 3.01Å; M784-D895 WeakPolarHBondContact CE-O 3.33Å; M784-Q896 PolarHBondContact N-O 3.14Å
785	K	83.4	Confident	88.3	Confident	117.667 Å²	117.667	56.5 Å²	56.5	51%	0.512	29%	0.293	S	S	.	.			trans	-111.3	161.6	179.1	-74.4	-143.4	175.4	-165.4	0	112.9	E782 P783 N894	E782-K785 HydrophobicContact CB-CB 3.92Å; E782-K785 HydrophobicContact CB-CD 3.98Å; E782-K785 HydrophobicContact CB-CG 3.86Å; E782-K785 HydrophobicContact CG-CD 4.42Å; E782-K785 PolarHBondContact O-N 3.11Å; P783-K785 PolarHBondContact O-N 3.35Å; P783-K785 VanDerWaalsContact O-N 3.09Å; K785-N894 PolarHBondContact O-N 3.24Å
786	S	87.2	Confident	87.9	Confident	38.3333 Å²	38.3333	54 Å²	54	27%	0.268	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	164.3	169.6	63.8	0	0	0	0	113.4	L761 L892	L761-S786 WeakPolarHBondContact O-CB 3.27Å; L761-S786 PolarHBondContact O-OG 2.84Å; S786-L892 CarbonylContact C-O 3.49Å; S786-L892 WeakPolarHBondContact CA-O 3.32Å; S786-L892 VanDerWaalsContact CB-O 3.3Å; S786-L892 WeakPolarHBondContact CB-O 3.46Å
787	W	90.5	Very high	87.6	Confident	52.6667 Å²	52.6667	53.3 Å²	53.3	20%	0.199	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	147.3	163.7	169.7	95.6	0	0	0	108.5	Y769 L771 V777 I779 L781 L890 A891 L892	Y769-W787 VanDerWaalsContact CB-CZ2 3.49Å; Y769-W787 HydrophobicContact CD1-CH2 4.44Å; Y769-W787 AromaticContact CD1-CZ2 3.99Å; Y769-W787 HydrophobicContact CD1-CZ2 4Å; Y769-W787 AromaticContact CG-CZ2 3.91Å; Y769-W787 HydrophobicContact CG-CZ2 3.91Å; L771-W787 HydrophobicContact CD1-CH2 4.43Å; L771-W787 HydrophobicContact CD2-CH2 4.28Å; V777-W787 HydrophobicContact CG1-CZ2 4.36Å; I779-W787 HydrophobicContact CD1-CD2 3.76Å; I779-W787 HydrophobicContact CD1-CE3 3.76Å; I779-W787 HydrophobicContact CD1-CG 4.47Å; I779-W787 HydrophobicContact CD1-CH2 3.73Å; I779-W787 HydrophobicContact CD1-CZ2 3.7Å; I779-W787 HydrophobicContact CD1-CZ3 3.75Å; I779-W787 HydrophobicContact CG1-CD2 4.35Å; I779-W787 HydrophobicContact CG1-CZ2 4.24Å; I779-W787 HydrophobicContact CG2-CB 4.01Å; I779-W787 HydrophobicContact CG2-CD2 4.15Å; I779-W787 HydrophobicContact CG2-CG 3.75Å; L781-W787 HydrophobicContact CD2-CB 3.49Å; L781-W787 VanDerWaalsContact CD2-CB 3.49Å; W787-L890 HydrophobicContact CZ3-CD1 3.72Å; W787-L890 HydrophobicContact CZ3-CD2 3.97Å; W787-L890 HydrophobicContact CZ3-CG 4.48Å; W787-A891 CarbonylContact O-C 3.45Å; W787-A891 VanDerWaalsContact O-CA 3.29Å; W787-A891 WeakPolarHBondContact O-CA 3.3Å; W787-L892 HydrophobicContact CE3-CB 4.27Å; W787-L892 HydrophobicContact CE3-CD1 3.75Å; W787-L892 HydrophobicContact CE3-CG 3.9Å; W787-L892 HydrophobicContact CZ3-CD1 3.99Å; W787-L892 HydrophobicContact CZ3-CG 4.23Å; W787-L892 PolarHBondContact N-O 3.17Å; W787-L892 PolarHBondContact O-N 2.88Å
788	S	90.2	Very high	87.1	Confident	10.3333 Å²	10.3333	56.8 Å²	56.8	7%	0.072	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	138.5	-172.4	-24.8	0	0	0	0	112.9	L761 F762 P768 Y769 M821 L890	L761-S788 PolarHBondContact O-OG 3.37Å; F762-S788 VanDerWaalsContact CD1-CB 3.41Å; P768-S788 WeakPolarHBondContact CA-O 3.19Å; Y769-S788 PolarHBondContact N-O 3.01Å; S788-M821 WeakPolarHBondContact OG-CE 3.45Å; S788-L890 CarbonylContact C-O 3.6Å; S788-L890 WeakPolarHBondContact CA-O 3.36Å
789	G	91.4	Very high	86.8	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	161.7	178.9	0	0	0	0	0	113.1	Y769 L890	Y769-G789 CarbonylContact O-C 3.54Å; Y769-G789 VanDerWaalsContact O-CA 3.23Å; Y769-G789 WeakPolarHBondContact O-CA 3.38Å; G789-L890 PolarHBondContact N-O 3.17Å; G789-L890 PolarHBondContact O-N 3.13Å
790	Q	92.9	Very high	86.6	Confident	46.6667 Å²	46.6667	55.7 Å²	55.7	22%	0.218	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	128.8	176.2	-177.5	-176.1	-25.6	0	0	109.6	P768 Y769 L771 I887 W888 F889	P768-Q790 HydrophobicContact CB-CB 4.28Å; P768-Q790 HydrophobicContact CG-CB 4.33Å; Y769-Q790 PolarHBondContact O-N 3.19Å; L771-Q790 WeakPolarHBondContact CB-O 3.21Å; L771-Q790 PolarHBondContact N-O 2.99Å; Q790-I887 HydrophobicContact CG-CG2 3.66Å; Q790-W888 CarbonylContact C-O 3.5Å; Q790-W888 WeakPolarHBondContact CA-O 3.25Å; Q790-F889 HydrophobicContact CB-CD1 4.23Å; Q790-F889 HydrophobicContact CB-CE1 4.23Å; Q790-F889 HydrophobicContact CG-CD1 4.22Å; Q790-F889 HydrophobicContact CG-CE1 3.91Å; Q790-F889 HydrophobicContact CG-CZ 4.47Å
791	W	93.5	Very high	86.5	Confident	13.3333 Å²	13.3333	51.3 Å²	51.3	5%	0.051	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	143.3	176.3	175.9	-112	0	0	0	109.6	L771 A773 M793 I799 W888 I906	L771-W791 HydrophobicContact CB-CE3 3.93Å; A773-W791 HydrophobicContact CB-CH2 3.84Å; A773-W791 HydrophobicContact CB-CZ3 4.31Å; W791-M793 HydrophobicContact CZ2-SD 4.43Å; W791-M793 PolarHBondContact NE1-SD 3.48Å; W791-I799 HydrophobicContact CZ2-CG2 4.29Å; W791-W888 HydrophobicContact CB-CB 4.29Å; W791-W888 PolarHBondContact N-O 2.86Å; W791-W888 PolarHBondContact O-N 3.16Å; W791-I906 HydrophobicContact CD2-CD1 4.3Å; W791-I906 HydrophobicContact CD2-CG1 4.38Å; W791-I906 HydrophobicContact CD2-CG2 4.18Å; W791-I906 HydrophobicContact CE3-CG2 3.63Å; W791-I906 HydrophobicContact CG-CD1 4.27Å; W791-I906 HydrophobicContact CH2-CG2 4.43Å; W791-I906 HydrophobicContact CZ3-CG2 3.77Å
792	H	92.9	Very high	86.6	Confident	116.333 Å²	116.333	53.1 Å²	53.1	54%	0.539	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	115.9	176.6	179.5	-78.2	0	0	0	109.6	P794	H792-P794 WeakPolarHBondContact O-CD 3.42Å
793	M	89.2	Confident	86.8	Confident	0.333333 Å²	0.333333	50 Å²	50	0%	0.002	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	103.4	-177.3	-165.6	59.4	166.1	0	0	109.7	W791 T795 R797 I799 L883 D884 E885 G886	W791-M793 HydrophobicContact CZ2-SD 4.43Å; W791-M793 PolarHBondContact NE1-SD 3.48Å; M793-T795 VanDerWaalsContact C-N 3.33Å; M793-T795 WeakPolarHBondContact CE-O 3.3Å; M793-T795 PolarHBondContact O-N 2.9Å; M793-R797 HydrophobicContact CE-CB 4.39Å; M793-R797 HydrophobicContact CE-CG 3.4Å; M793-R797 VanDerWaalsContact CE-CG 3.44Å; M793-R797 WeakPolarHBondContact CE-O 3.44Å; M793-R797 HydrophobicContact SD-CG 4.11Å; M793-I799 HydrophobicContact CE-CG2 3.59Å; M793-I799 HydrophobicContact SD-CG2 4Å; M793-L883 HydrophobicContact CE-CB 4.12Å; M793-L883 WeakPolarHBondContact CE-O 3.46Å; M793-L883 HydrophobicContact CG-CB 4.09Å; M793-L883 HydrophobicContact SD-CB 4.3Å; M793-L883 HydrophobicContact SD-CD1 4.37Å; M793-D884 WeakPolarHBondContact CB-O 3.38Å; M793-D884 VanDerWaalsContact CG-O 3.29Å; M793-D884 WeakPolarHBondContact CG-O 3.27Å; M793-E885 WeakPolarHBondContact O-CA 3.37Å; M793-G886 PolarHBondContact N-O 3.15Å; M793-G886 PolarHBondContact O-N 2.95Å
794	P	85.1	Confident	87.2	Confident	65 Å²	65	48.1 Å²	48.1	42%	0.422	23%	0.234	S	C	.	.	S	Bend	trans	-80.5	-11.9	-169.9	33.3	-37.7	0	0	0	114.5	H792	H792-P794 WeakPolarHBondContact O-CD 3.42Å
795	T	80	Confident	87.7	Confident	66.6667 Å²	66.6667	42.3 Å²	42.3	41%	0.409	21%	0.206	S	C	.	.	S	Bend	trans	-157.8	144.2	174.3	53.9	0	0	0	0	107.5	M793 R797	M793-T795 VanDerWaalsContact C-N 3.33Å; M793-T795 WeakPolarHBondContact CE-O 3.3Å; M793-T795 PolarHBondContact O-N 2.9Å; T795-R797 WeakPolarHBondContact O-CG 3.3Å; T795-R797 PolarHBondContact O-N 3.3Å; T795-R797 WeakPolarHBondContact OG1-CD 3.43Å; T795-R797 PolarHBondContact OG1-NE 3.06Å; T795-R797 VanDerWaalsContact OG1-NE 3.13Å; T795-R797 PolarHBondContact OG1-NH1 3.34Å
796	A	82.9	Confident	87.7	Confident	38 Å²	38	37.7 Å²	37.7	31%	0.314	19%	0.189	S	C	.	.	S	Bend	trans	-64.5	126.7	176.9	0	0	0	0	0	112	Y882 L883	A796-Y882 HydrophobicContact CB-CE1 4.05Å; A796-Y882 VanDerWaalsContact CB-OH 3.32Å; A796-Y882 WeakPolarHBondContact CB-OH 3.3Å; A796-L883 VanDerWaalsContact CA-O 3.27Å; A796-L883 WeakPolarHBondContact CA-O 3.32Å
797	R	82.3	Confident	87.4	Confident	81.6667 Å²	81.6667	37.4 Å²	37.4	31%	0.308	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.7	171.3	-179	56.8	-160.4	176.8	150.5	20.2	112.1	M793 T795 L883 D908	M793-R797 HydrophobicContact CE-CB 4.39Å; M793-R797 HydrophobicContact CE-CG 3.4Å; M793-R797 VanDerWaalsContact CE-CG 3.44Å; M793-R797 WeakPolarHBondContact CE-O 3.44Å; M793-R797 HydrophobicContact SD-CG 4.11Å; T795-R797 WeakPolarHBondContact O-CG 3.3Å; T795-R797 PolarHBondContact O-N 3.3Å; T795-R797 WeakPolarHBondContact OG1-CD 3.43Å; T795-R797 PolarHBondContact OG1-NE 3.06Å; T795-R797 VanDerWaalsContact OG1-NE 3.13Å; T795-R797 PolarHBondContact OG1-NH1 3.34Å; R797-L883 PolarHBondContact N-O 3.1Å; R797-L883 VanDerWaalsContact N-O 3.09Å; R797-L883 PolarHBondContact O-N 2.83Å; R797-L883 VanDerWaalsContact O-N 3.12Å; R797-D908 IonicContact CZ-OD1 3.39Å; R797-D908 VanDerWaalsContact CZ-OD1 3.27Å; R797-D908 IonicContact CZ-OD2 3.07Å; R797-D908 IonicContact NE-OD1 3.68Å; R797-D908 PolarHBondContact NE-OD1 3.02Å; R797-D908 IonicContact NE-OD2 2.71Å; R797-D908 IonicContact NH1-OD1 3.06Å; R797-D908 PolarHBondContact NH1-OD1 3.06Å; R797-D908 IonicContact NH1-OD2 2.72Å; R797-D908 PolarHBondContact NH1-OD2 3.22Å; R797-D908 IonicContact NH2-OD1 2.68Å; R797-D908 PolarHBondContact NH2-OD1 2.87Å; R797-D908 IonicContact NH2-OD2 3.32Å; R797-D908 PolarHBondContact NH2-OD2 2.86Å
798	Y	81.5	Confident	86.7	Confident	87 Å²	87	39.5 Å²	39.5	34%	0.341	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	130.4	172.3	-71.5	-82.6	0	0	0	112.5	L880 H881 Y882 A909 V929	Y798-L880 HydrophobicContact CD1-CD2 4.26Å; Y798-L880 HydrophobicContact CG-CD2 4.47Å; Y798-H881 CarbonylContact C-O 3.58Å; Y798-H881 WeakPolarHBondContact CA-O 3.26Å; Y798-Y882 HydrophobicContact CD1-CD2 4.35Å; Y798-Y882 AromaticContact CD2-CD2 3.84Å; Y798-Y882 HydrophobicContact CD2-CD2 3.84Å; Y798-Y882 HydrophobicContact CD2-CE2 4.37Å; Y798-Y882 HydrophobicContact CE1-CD2 4.31Å; Y798-Y882 HydrophobicContact CE1-CG 4.47Å; Y798-Y882 AromaticContact CE2-CD2 3.78Å; Y798-Y882 HydrophobicContact CE2-CD2 3.78Å; Y798-Y882 HydrophobicContact CE2-CE2 4.26Å; Y798-Y882 HydrophobicContact CG-CD2 4.12Å; Y798-Y882 AromaticContact CZ-CD2 3.86Å; Y798-A909 VanDerWaalsContact O-CB 3.25Å; Y798-A909 WeakPolarHBondContact O-CB 3.22Å; Y798-A909 PolarHBondContact O-N 3.06Å; Y798-A909 VanDerWaalsContact O-N 3.08Å; Y798-V929 HydrophobicContact CD1-CG1 3.91Å; Y798-V929 HydrophobicContact CD1-CG2 4.46Å; Y798-V929 HydrophobicContact CD2-CB 3.83Å; Y798-V929 HydrophobicContact CD2-CG1 4.11Å; Y798-V929 HydrophobicContact CD2-CG2 3.37Å; Y798-V929 HydrophobicContact CE1-CB 4.22Å; Y798-V929 HydrophobicContact CE1-CG1 3.58Å; Y798-V929 HydrophobicContact CE2-CB 3.46Å; Y798-V929 VanDerWaalsContact CE2-CB 3.46Å; Y798-V929 HydrophobicContact CE2-CG1 3.8Å; Y798-V929 HydrophobicContact CE2-CG2 3.57Å; Y798-V929 HydrophobicContact CG-CB 4.35Å; Y798-V929 HydrophobicContact CG-CG1 4.16Å; Y798-V929 HydrophobicContact CG-CG2 3.86Å
799	I	86.3	Confident	86	Confident	0.666667 Å²	0.666667	42 Å²	42	0%	0.003	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	160.3	165.5	54.1	124.3	0	0	0	110.6	W791 M793 M816 L880 H881 L883 I906 G907	W791-I799 HydrophobicContact CZ2-CG2 4.29Å; M793-I799 HydrophobicContact CE-CG2 3.59Å; M793-I799 HydrophobicContact SD-CG2 4Å; I799-M816 HydrophobicContact CD1-CE 4.47Å; I799-L880 VanDerWaalsContact O-CA 3.32Å; I799-L880 WeakPolarHBondContact O-CA 3.28Å; I799-L880 WeakPolarHBondContact O-CG 3.19Å; I799-H881 HydrophobicContact CD1-CB 4.1Å; I799-H881 WeakPolarHBondContact CG1-O 3.29Å; I799-H881 PolarHBondContact N-O 3.09Å; I799-H881 PolarHBondContact O-N 2.97Å; I799-L883 HydrophobicContact CD1-CD1 3.59Å; I799-L883 HydrophobicContact CD1-CG 3.92Å; I799-L883 HydrophobicContact CG1-CD1 3.79Å; I799-L883 VanDerWaalsContact CG1-CD1 3.49Å; I799-L883 HydrophobicContact CG1-CG 3.82Å; I799-I906 HydrophobicContact CB-CG1 4.46Å; I799-I906 HydrophobicContact CD1-CD1 3.73Å; I799-I906 HydrophobicContact CD1-CG1 3.94Å; I799-I906 HydrophobicContact CG1-CD1 4.2Å; I799-I906 HydrophobicContact CG1-CG1 4.38Å; I799-G907 CarbonylContact C-O 3.58Å; I799-G907 VanDerWaalsContact CA-O 3.28Å; I799-G907 WeakPolarHBondContact CA-O 3.41Å; I799-G907 VanDerWaalsContact CB-O 3.3Å; I799-G907 WeakPolarHBondContact CB-O 3.37Å
800	R	85.7	Confident	85.7	Confident	102.667 Å²	102.667	42.1 Å²	42.1	39%	0.387	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	135.9	165.3	-179.7	172.2	165.6	151.6	0.8	108.6	N802 R879 L880 I906 G907 A909 D931	R800-N802 VanDerWaalsContact CZ-OD1 3.29Å; R800-N802 PolarHBondContact NE-OD1 3.05Å; R800-N802 PolarHBondContact NH2-OD1 2.89Å; R800-N802 VanDerWaalsContact NH2-OD1 3.07Å; R800-R879 CarbonylContact C-O 3.6Å; R800-R879 VanDerWaalsContact CA-O 3.27Å; R800-R879 WeakPolarHBondContact CA-O 3.44Å; R800-L880 HydrophobicContact CB-CD1 3.74Å; R800-L880 HydrophobicContact CB-CG 4.38Å; R800-L880 HydrophobicContact CG-CD1 4Å; R800-I906 WeakPolarHBondContact O-CA 3.42Å; R800-G907 PolarHBondContact N-O 3.27Å; R800-G907 PolarHBondContact O-N 3.15Å; R800-G907 VanDerWaalsContact O-O 3.09Å; R800-A909 HydrophobicContact CB-CB 4.43Å; R800-D931 IonicContact NH1-OD2 3.41Å
801	Y	90.1	Very high	85.4	Confident	0.5 Å²	0.5	40.3 Å²	40.3	0%	0.002	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	140.4	160.3	80.3	-102.3	0	0	0	110.3	I803 V814 M816 D831 I833 G878 R879 H881 F904 A905	Y801-I803 HydrophobicContact CD2-CB 4.3Å; Y801-I803 HydrophobicContact CD2-CG2 4.4Å; Y801-I803 HydrophobicContact CE2-CB 4.15Å; Y801-I803 HydrophobicContact CE2-CG2 3.88Å; Y801-V814 HydrophobicContact CE1-CG1 4.26Å; Y801-V814 HydrophobicContact CE2-CG1 4.27Å; Y801-V814 HydrophobicContact CE2-CG2 4.35Å; Y801-V814 WeakPolarHBondContact OH-CB 3.46Å; Y801-V814 WeakPolarHBondContact OH-CG2 3.01Å; Y801-M816 HydrophobicContact CD1-CE 3.41Å; Y801-M816 VanDerWaalsContact CD1-CE 3.41Å; Y801-M816 HydrophobicContact CE1-CE 3.5Å; Y801-M816 VanDerWaalsContact CE1-CE 3.5Å; Y801-M816 HydrophobicContact CG-CE 4.1Å; Y801-D831 WeakPolarHBondContact CE1-OD2 2.99Å; Y801-D831 VanDerWaalsContact OH-CB 3.31Å; Y801-D831 WeakPolarHBondContact OH-CB 3.19Å; Y801-D831 VanDerWaalsContact OH-CG 3.29Å; Y801-D831 PolarHBondContact OH-OD2 3.1Å; Y801-I833 HydrophobicContact CE2-CD1 4.11Å; Y801-G878 CarbonylContact O-C 3.54Å; Y801-G878 VanDerWaalsContact O-CA 3.27Å; Y801-G878 WeakPolarHBondContact O-CA 3.36Å; Y801-R879 HydrophobicContact CD1-CB 4.01Å; Y801-R879 HydrophobicContact CE1-CB 3.52Å; Y801-R879 VanDerWaalsContact CE1-CB 3.49Å; Y801-R879 HydrophobicContact CE1-CG 4.16Å; Y801-R879 HydrophobicContact CE2-CB 4.24Å; Y801-R879 HydrophobicContact CE2-CG 4.3Å; Y801-R879 HydrophobicContact CG-CB 4.47Å; Y801-R879 PolarHBondContact N-O 3.12Å; Y801-R879 PolarHBondContact O-N 3.04Å; Y801-R879 WeakPolarHBondContact OH-CG 3.45Å; Y801-H881 AromaticContact CE1-CD2 3.82Å; Y801-F904 HydrophobicContact CD2-CD2 4.21Å; Y801-F904 AromaticContact CD2-CE2 3.4Å; Y801-F904 HydrophobicContact CD2-CE2 3.4Å; Y801-F904 VanDerWaalsContact CD2-CE2 3.43Å; Y801-F904 AromaticContact CD2-CZ 3.95Å; Y801-F904 HydrophobicContact CD2-CZ 3.95Å; Y801-F904 AromaticContact CE2-CE2 3.93Å; Y801-F904 HydrophobicContact CE2-CE2 3.93Å; Y801-F904 AromaticContact CG-CE2 3.92Å; Y801-F904 HydrophobicContact CG-CE2 3.92Å; Y801-F904 AromaticContact CG-CZ 3.94Å; Y801-F904 HydrophobicContact CG-CZ 3.98Å; Y801-A905 CarbonylContact C-O 3.48Å; Y801-A905 WeakPolarHBondContact CA-O 3.4Å; Y801-A905 WeakPolarHBondContact CB-O 3.41Å
802	N	88.2	Confident	85.2	Confident	40.25 Å²	40.25	39.6 Å²	39.6	22%	0.215	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	140.3	169.3	-77	12.7	0	0	0	108.9	R800 E876 T877 F904 A905	R800-N802 VanDerWaalsContact CZ-OD1 3.29Å; R800-N802 PolarHBondContact NE-OD1 3.05Å; R800-N802 PolarHBondContact NH2-OD1 2.89Å; R800-N802 VanDerWaalsContact NH2-OD1 3.07Å; N802-E876 PolarHBondContact ND2-OE1 3.15Å; N802-T877 CarbonylContact C-O 3.47Å; N802-T877 VanDerWaalsContact CA-O 3.3Å; N802-T877 WeakPolarHBondContact CA-O 3.36Å; N802-F904 WeakPolarHBondContact O-CA 3.24Å; N802-A905 PolarHBondContact N-O 2.91Å; N802-A905 PolarHBondContact O-N 3.1Å
803	I	90.7	Very high	85.1	Confident	0.25 Å²	0.25	34.3 Å²	34.3	0%	0.001	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	144.3	176.8	-168.4	173	0	0	0	110	Y801 V812 V814 I833 E876 T877 L892 I902 K903 F904	Y801-I803 HydrophobicContact CD2-CB 4.3Å; Y801-I803 HydrophobicContact CD2-CG2 4.4Å; Y801-I803 HydrophobicContact CE2-CB 4.15Å; Y801-I803 HydrophobicContact CE2-CG2 3.88Å; I803-V812 HydrophobicContact CD1-CG1 4.38Å; I803-V814 HydrophobicContact CD1-CG2 3.93Å; I803-I833 HydrophobicContact CD1-CG1 4.43Å; I803-I833 HydrophobicContact CG2-CD1 3.93Å; I803-I833 VanDerWaalsContact CG2-CD1 3.42Å; I803-I833 HydrophobicContact CG2-CG1 4Å; I803-I833 HydrophobicContact CG2-CG2 4.16Å; I803-E876 WeakPolarHBondContact O-CA 3.36Å; I803-T877 HydrophobicContact CG2-CG2 3.55Å; I803-T877 PolarHBondContact N-O 2.78Å; I803-T877 PolarHBondContact O-N 2.83Å; I803-L892 HydrophobicContact CD1-CD2 3.99Å; I803-I902 HydrophobicContact CD1-CG2 4.04Å; I803-I902 HydrophobicContact CG1-CG2 3.58Å; I803-K903 CarbonylContact C-O 3.55Å; I803-K903 VanDerWaalsContact CA-O 3.31Å; I803-K903 WeakPolarHBondContact CA-O 3.27Å; I803-F904 HydrophobicContact CB-CD2 4.1Å; I803-F904 HydrophobicContact CD1-CD2 4.11Å; I803-F904 HydrophobicContact CG1-CD2 4.08Å
804	T	89.6	Confident	85.2	Confident	10.75 Å²	10.75	34.3 Å²	34.3	7%	0.066	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	146.1	174.9	52.5	0	0	0	0	112	L874 R875 E876 I902 K903	T804-L874 HydrophobicContact CG2-CB 4.47Å; T804-L874 HydrophobicContact CG2-CD2 4.36Å; T804-R875 CarbonylContact C-O 3.24Å; T804-R875 VanDerWaalsContact CA-O 3.27Å; T804-R875 WeakPolarHBondContact CA-O 3.34Å; T804-E876 HydrophobicContact CG2-CB 3.76Å; T804-E876 HydrophobicContact CG2-CG 3.85Å; T804-I902 WeakPolarHBondContact O-CA 3.18Å; T804-K903 HydrophobicContact CG2-CB 3.98Å; T804-K903 HydrophobicContact CG2-CD 4.46Å; T804-K903 PolarHBondContact N-O 2.71Å; T804-K903 WeakPolarHBondContact OG1-CA 3.25Å; T804-K903 WeakPolarHBondContact OG1-CB 3.39Å; T804-K903 WeakPolarHBondContact OG1-CG 3.28Å; T804-K903 PolarHBondContact OG1-N 3.18Å; T804-K903 PolarHBondContact OG1-O 3.08Å; T804-K903 VanDerWaalsContact OG1-O 3.12Å
805	V	88.2	Confident	85.6	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	154	170.9	-61.2	0	0	0	0	110.9	V812 I833 L838 R875	V805-V812 HydrophobicContact CG1-CG2 3.94Å; V805-I833 HydrophobicContact CG1-CG2 4Å; V805-L838 HydrophobicContact CG2-CD1 4.01Å; V805-R875 HydrophobicContact CG2-CB 4.19Å; V805-R875 PolarHBondContact N-O 3.15Å; V805-R875 PolarHBondContact O-N 3.22Å
806	S	84.2	Confident	86.1	Confident	21.25 Å²	21.25	28.9 Å²	28.9	15%	0.149	15%	0.154	C	C	.	.	S	Bend	trans	-81.1	-25.3	-169.7	63.9	0	0	0	0	115.3	S810 R898 E900	S806-S810 PolarHBondContact OG-OG 3.34Å; S806-R898 PolarHBondContact OG-NH2 3.46Å; S806-E900 VanDerWaalsContact CB-OE1 3.24Å; S806-E900 WeakPolarHBondContact CB-OE1 3.4Å; S806-E900 PolarHBondContact N-OE1 2.97Å; S806-E900 VanDerWaalsContact OG-CD 3.31Å; S806-E900 PolarHBondContact OG-OE1 2.9Å; S806-E900 PolarHBondContact OG-OE2 3.04Å
807	S	80	Confident	86.5	Confident	31 Å²	31	29.8 Å²	29.8	22%	0.217	15%	0.149	C	C	.	.	S	Bend	trans	-155.8	165.6	-170.4	69.5	0	0	0	0	114.3	A809 S810 G835 R898	S807-A809 VanDerWaalsContact C-N 3.28Å; S807-A809 PolarHBondContact O-N 2.99Å; S807-S810 PolarHBondContact N-OG 3.08Å; S807-S810 VanDerWaalsContact N-OG 3.08Å; S807-S810 VanDerWaalsContact O-CB 3.27Å; S807-S810 WeakPolarHBondContact O-CB 3.35Å; S807-S810 PolarHBondContact O-N 3.2Å; S807-S810 VanDerWaalsContact O-N 3.12Å; S807-S810 PolarHBondContact O-OG 2.98Å; S807-S810 PolarHBondContact OG-N 3.23Å; S807-S810 PolarHBondContact OG-OG 2.94Å; S807-G835 WeakPolarHBondContact O-CA 3.34Å; S807-R898 VanDerWaalsContact OG-CZ 3.26Å; S807-R898 PolarHBondContact OG-NH1 2.94Å; S807-R898 PolarHBondContact OG-NH2 2.93Å
808	L	76.2	Confident	86.8	Confident	96.5 Å²	96.5	28.5 Å²	28.5	51%	0.505	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-39.7	175.5	-78.2	163.1	0	0	0	113.6	S810 G835 H836 R875	L808-S810 VanDerWaalsContact C-N 3.28Å; L808-S810 PolarHBondContact O-N 3.17Å; L808-G835 CarbonylContact O-C 3.42Å; L808-G835 VanDerWaalsContact O-C 3.29Å; L808-G835 WeakPolarHBondContact O-CA 3.23Å; L808-H836 PolarHBondContact O-N 3.01Å; L808-R875 VanDerWaalsContact CD2-NH1 3.28Å
809	A	75.8	Confident	87	Confident	63.75 Å²	63.75	28.9 Å²	28.9	53%	0.527	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	5.3	-177.9	0	0	0	0	0	113.5	S807 Q896 R898	S807-A809 VanDerWaalsContact C-N 3.28Å; S807-A809 PolarHBondContact O-N 2.99Å; A809-Q896 VanDerWaalsContact O-CD 3.32Å; A809-Q896 WeakPolarHBondContact O-CG 3.5Å; A809-Q896 PolarHBondContact O-NE2 3.09Å; A809-Q896 PolarHBondContact O-OE1 3.31Å; A809-R898 PolarHBondContact O-NH2 2.82Å; A809-R898 VanDerWaalsContact O-NH2 3.11Å
810	S	84.1	Confident	87	Confident	1.5 Å²	1.5	31.9 Å²	31.9	1%	0.01	17%	0.173	C	C	.	.			trans	-73.5	138.2	179.6	-57.3	0	0	0	0	110.4	S806 S807 L808 T834 G835 R898 E900	S806-S810 PolarHBondContact OG-OG 3.34Å; S807-S810 PolarHBondContact N-OG 3.08Å; S807-S810 VanDerWaalsContact N-OG 3.08Å; S807-S810 VanDerWaalsContact O-CB 3.27Å; S807-S810 WeakPolarHBondContact O-CB 3.35Å; S807-S810 PolarHBondContact O-N 3.2Å; S807-S810 VanDerWaalsContact O-N 3.12Å; S807-S810 PolarHBondContact O-OG 2.98Å; S807-S810 PolarHBondContact OG-N 3.23Å; S807-S810 PolarHBondContact OG-OG 2.94Å; L808-S810 VanDerWaalsContact C-N 3.28Å; L808-S810 PolarHBondContact O-N 3.17Å; S810-T834 CarbonylContact O-C 3.32Å; S810-T834 VanDerWaalsContact O-CA 3.24Å; S810-T834 WeakPolarHBondContact O-CA 3.44Å; S810-G835 PolarHBondContact O-N 3.12Å; S810-R898 VanDerWaalsContact CA-NH2 3.3Å; S810-R898 VanDerWaalsContact N-NH2 3.13Å; S810-R898 PolarHBondContact OG-NH2 3.16Å; S810-E900 WeakPolarHBondContact CB-OE2 3.43Å; S810-E900 PolarHBondContact OG-OE1 3.02Å; S810-E900 VanDerWaalsContact OG-OE1 3.1Å; S810-E900 PolarHBondContact OG-OE2 2.97Å
811	S	87.6	Confident	86.8	Confident	8.25 Å²	8.25	29.5 Å²	29.5	6%	0.058	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	127.9	173.5	-179.7	0	0	0	0	109.6	R832 I833 T834 D895	S811-R832 PolarHBondContact OG-NE 2.94Å; S811-R832 VanDerWaalsContact OG-NE 3.14Å; S811-I833 CarbonylContact C-O 3.58Å; S811-I833 VanDerWaalsContact CA-O 3.3Å; S811-I833 WeakPolarHBondContact CA-O 3.35Å; S811-T834 WeakPolarHBondContact OG-CG2 3.31Å; S811-D895 WeakPolarHBondContact CB-OD1 3.17Å; S811-D895 VanDerWaalsContact CB-OD2 3.24Å; S811-D895 WeakPolarHBondContact CB-OD2 3.28Å; S811-D895 WeakPolarHBondContact O-CB 3.26Å; S811-D895 PolarHBondContact O-N 2.94Å; S811-D895 VanDerWaalsContact O-N 3.13Å; S811-D895 VanDerWaalsContact O-OD1 3.12Å; S811-D895 VanDerWaalsContact OG-CG 3.24Å; S811-D895 PolarHBondContact OG-OD1 3.42Å; S811-D895 PolarHBondContact OG-OD2 3.21Å
812	V	89.7	Confident	86.5	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	126.6	-174.5	-176.7	0	0	0	0	109.1	L781 I803 V805 I833 V893 E900 I902	L781-V812 HydrophobicContact CD1-CG1 4.15Å; I803-V812 HydrophobicContact CD1-CG1 4.38Å; V805-V812 HydrophobicContact CG1-CG2 3.94Å; V812-I833 HydrophobicContact CB-CB 4.44Å; V812-I833 PolarHBondContact N-O 3.03Å; V812-I833 PolarHBondContact O-N 3.16Å; V812-V893 CarbonylContact C-O 3.53Å; V812-V893 VanDerWaalsContact CA-O 3.28Å; V812-V893 WeakPolarHBondContact CA-O 3.33Å; V812-V893 WeakPolarHBondContact CG1-O 3.38Å; V812-E900 HydrophobicContact CG2-CG 4.09Å; V812-I902 HydrophobicContact CB-CD1 4.41Å; V812-I902 HydrophobicContact CG1-CD1 3.81Å; V812-I902 HydrophobicContact CG2-CD1 3.74Å
813	G	90.2	Very high	86.1	Confident	4.25 Å²	4.25	29.1 Å²	29.1	4%	0.044	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	132.9	168.2	0	0	0	0	0	111.1	L892 V893	G813-L892 CarbonylContact O-C 3.53Å; G813-L892 WeakPolarHBondContact O-CA 3.38Å; G813-V893 PolarHBondContact N-O 3.23Å; G813-V893 PolarHBondContact O-N 3.08Å
814	V	92.1	Very high	85.2	Confident	0.75 Å²	0.75	33.1 Å²	33.1	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	109.7	174	-173.7	0	0	0	0	107.4	Y801 I803 M816 F830 D831 I833 L890 L892	Y801-V814 HydrophobicContact CE1-CG1 4.26Å; Y801-V814 HydrophobicContact CE2-CG1 4.27Å; Y801-V814 HydrophobicContact CE2-CG2 4.35Å; Y801-V814 WeakPolarHBondContact OH-CB 3.46Å; Y801-V814 WeakPolarHBondContact OH-CG2 3.01Å; I803-V814 HydrophobicContact CD1-CG2 3.93Å; V814-M816 HydrophobicContact CG1-CE 3.7Å; V814-F830 CarbonylContact O-C 3.38Å; V814-F830 VanDerWaalsContact O-CA 3.3Å; V814-F830 WeakPolarHBondContact O-CA 3.4Å; V814-F830 WeakPolarHBondContact O-CD2 3.33Å; V814-D831 HydrophobicContact CB-CB 4.17Å; V814-D831 HydrophobicContact CG2-CB 4.49Å; V814-D831 PolarHBondContact N-O 3.24Å; V814-D831 PolarHBondContact O-N 3.05Å; V814-I833 HydrophobicContact CG2-CD1 3.78Å; V814-I833 HydrophobicContact CG2-CG1 3.95Å; V814-L890 HydrophobicContact CG1-CD1 3.64Å; V814-L892 HydrophobicContact CB-CD2 4.13Å; V814-L892 HydrophobicContact CG1-CD2 3.83Å; V814-L892 HydrophobicContact CG2-CD2 3.69Å
815	F	92	Very high	84.5	Confident	14.75 Å²	14.75	38.9 Å²	38.9	7%	0.065	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	134.3	-179.8	-60.4	-101.4	0	0	0	109.7	L761 P822 I824 Y827 I829 F830 L890 A891 V893	L761-F815 HydrophobicContact CD1-CB 4.28Å; L761-F815 HydrophobicContact CD1-CD1 4.25Å; L761-F815 HydrophobicContact CD1-CD2 3.72Å; L761-F815 HydrophobicContact CD1-CE1 4.27Å; L761-F815 HydrophobicContact CD1-CE2 4.03Å; L761-F815 HydrophobicContact CD1-CG 3.84Å; L761-F815 HydrophobicContact CD1-CZ 4.3Å; F815-P822 HydrophobicContact CB-CB 3.83Å; F815-P822 HydrophobicContact CB-CG 4.19Å; F815-I824 HydrophobicContact CZ-CG1 4.4Å; F815-Y827 AromaticContact CD1-CD1 3.55Å; F815-Y827 HydrophobicContact CD1-CD1 3.55Å; F815-Y827 HydrophobicContact CD1-CE1 4.15Å; F815-Y827 AromaticContact CD1-CG 3.89Å; F815-Y827 HydrophobicContact CD1-CG 3.89Å; F815-Y827 AromaticContact CE1-CD1 3.81Å; F815-Y827 HydrophobicContact CE1-CD1 3.81Å; F815-Y827 AromaticContact CE1-CE1 3.97Å; F815-Y827 HydrophobicContact CE1-CE1 3.99Å; F815-I829 CarbonylContact C-O 3.39Å; F815-I829 WeakPolarHBondContact CA-O 3.35Å; F815-F830 HydrophobicContact CD1-CB 4.37Å; F815-F830 AromaticContact CD1-CD2 3.56Å; F815-F830 HydrophobicContact CD1-CD2 3.56Å; F815-F830 HydrophobicContact CD1-CE2 4.25Å; F815-F830 HydrophobicContact CD1-CG 4.28Å; F815-F830 AromaticContact CD2-CD2 3.96Å; F815-F830 HydrophobicContact CD2-CD2 4.02Å; F815-F830 HydrophobicContact CD2-CE2 4.19Å; F815-F830 AromaticContact CE1-CD2 3.41Å; F815-F830 HydrophobicContact CE1-CD2 3.41Å; F815-F830 VanDerWaalsContact CE1-CD2 3.47Å; F815-F830 AromaticContact CE1-CE2 3.73Å; F815-F830 HydrophobicContact CE1-CE2 3.73Å; F815-F830 HydrophobicContact CE1-CG 4.17Å; F815-F830 AromaticContact CE2-CD2 3.89Å; F815-F830 HydrophobicContact CE2-CD2 3.89Å; F815-F830 AromaticContact CE2-CE2 3.64Å; F815-F830 HydrophobicContact CE2-CE2 3.64Å; F815-F830 AromaticContact CG-CD2 3.87Å; F815-F830 HydrophobicContact CG-CD2 3.87Å; F815-F830 HydrophobicContact CG-CE2 4.42Å; F815-F830 AromaticContact CZ-CD2 3.59Å; F815-F830 HydrophobicContact CZ-CD2 3.59Å; F815-F830 AromaticContact CZ-CE2 3.39Å; F815-F830 HydrophobicContact CZ-CE2 3.39Å; F815-F830 VanDerWaalsContact CZ-CE2 3.43Å; F815-F830 HydrophobicContact CZ-CZ 4.33Å; F815-L890 CarbonylContact O-C 3.52Å; F815-L890 WeakPolarHBondContact O-CA 3.32Å; F815-L890 VanDerWaalsContact O-CB 3.31Å; F815-L890 WeakPolarHBondContact O-CB 3.45Å; F815-A891 HydrophobicContact CB-CB 4.44Å; F815-A891 PolarHBondContact N-O 2.98Å; F815-A891 PolarHBondContact O-N 3.26Å; F815-V893 HydrophobicContact CD2-CG2 3.7Å; F815-V893 HydrophobicContact CE2-CB 4.11Å; F815-V893 HydrophobicContact CE2-CG2 3.57Å
816	M	91.5	Very high	83.8	Confident	2.25 Å²	2.25	43.4 Å²	43.4	1%	0.011	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	150.2	173.4	-45.8	-176.4	81.2	0	0	111.4	I799 Y801 V814 D828 I829 L883 W888 F889 L890 F904 I906	I799-M816 HydrophobicContact CD1-CE 4.47Å; Y801-M816 HydrophobicContact CD1-CE 3.41Å; Y801-M816 VanDerWaalsContact CD1-CE 3.41Å; Y801-M816 HydrophobicContact CE1-CE 3.5Å; Y801-M816 VanDerWaalsContact CE1-CE 3.5Å; Y801-M816 HydrophobicContact CG-CE 4.1Å; V814-M816 HydrophobicContact CG1-CE 3.7Å; M816-D828 PolarHBondContact O-N 3.34Å; M816-I829 HydrophobicContact CB-CB 4.13Å; M816-I829 HydrophobicContact CB-CD1 4.44Å; M816-I829 HydrophobicContact CG-CB 4.22Å; M816-I829 HydrophobicContact CG-CG2 4.4Å; M816-I829 PolarHBondContact N-O 3.13Å; M816-I829 PolarHBondContact O-N 3.13Å; M816-I829 VanDerWaalsContact O-N 3.08Å; M816-I829 HydrophobicContact SD-CD1 4.22Å; M816-I829 HydrophobicContact SD-CG2 4.43Å; M816-L883 HydrophobicContact CE-CD1 3.9Å; M816-L883 HydrophobicContact CE-CD2 4.2Å; M816-W888 HydrophobicContact CB-CE3 4.29Å; M816-F889 CarbonylContact C-O 3.53Å; M816-F889 VanDerWaalsContact CA-O 3.29Å; M816-F889 WeakPolarHBondContact CA-O 3.33Å; M816-L890 HydrophobicContact CB-CB 4.23Å; M816-L890 HydrophobicContact CE-CD2 4.09Å; M816-L890 HydrophobicContact CG-CB 3.8Å; M816-L890 HydrophobicContact CG-CD1 3.71Å; M816-L890 HydrophobicContact SD-CB 4.42Å; M816-L890 HydrophobicContact SD-CD1 4.42Å; M816-L890 HydrophobicContact SD-CD2 4.18Å; M816-F904 HydrophobicContact CE-CZ 4.5Å; M816-I906 HydrophobicContact CE-CD1 4.18Å
817	R	90.6	Very high	83.9	Confident	57.5 Å²	57.5	46.5 Å²	46.5	22%	0.217	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	144	178.9	-167.1	176.1	-167.1	-157.8	-2.3	112.7	T820 M821 P822 D828 W888 F889	R817-T820 WeakPolarHBondContact CB-O 3.38Å; R817-T820 VanDerWaalsContact CD-OG1 3.3Å; R817-T820 WeakPolarHBondContact CD-OG1 3.3Å; R817-T820 WeakPolarHBondContact CG-O 3.41Å; R817-T820 VanDerWaalsContact CZ-OG1 3.27Å; R817-T820 PolarHBondContact NE-OG1 3.17Å; R817-T820 VanDerWaalsContact NE-OG1 3.14Å; R817-T820 PolarHBondContact NH1-OG1 3.34Å; R817-M821 WeakPolarHBondContact CD-O 3.47Å; R817-M821 PolarHBondContact NH1-O 2.71Å; R817-P822 HydrophobicContact CB-CB 3.9Å; R817-P822 HydrophobicContact CB-CG 4.32Å; R817-D828 VanDerWaalsContact CA-OD2 3.29Å; R817-D828 WeakPolarHBondContact CA-OD2 3.27Å; R817-D828 VanDerWaalsContact CG-OD2 3.31Å; R817-D828 WeakPolarHBondContact CG-OD2 3.35Å; R817-D828 IonicContact NE-OD1 3.41Å; R817-W888 VanDerWaalsContact C-CE3 3.46Å; R817-W888 CarbonylContact O-C 3.47Å; R817-W888 WeakPolarHBondContact O-CA 3.31Å; R817-F889 PolarHBondContact N-O 3.17Å; R817-F889 PolarHBondContact O-N 3Å
818	H	89.7	Confident	84.1	Confident	54.5 Å²	54.5	49 Å²	49	25%	0.252	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	136.7	179.2	-169.5	-127.7	0	0	0	111.5	T820 D828 E885 W888	H818-T820 PolarHBondContact O-N 3.3Å; H818-T820 PolarHBondContact O-OG1 3.03Å; H818-D828 PolarHBondContact N-OD2 3.19Å; H818-E885 PolarHBondContact NE2-O 3.19Å; H818-W888 HydrophobicContact CB-CD2 4.31Å; H818-W888 HydrophobicContact CB-CE3 4.31Å; H818-W888 HydrophobicContact CB-CH2 3.94Å; H818-W888 HydrophobicContact CB-CZ2 3.92Å; H818-W888 HydrophobicContact CB-CZ3 4.14Å; H818-W888 AromaticContact CD2-CE2 3.57Å; H818-W888 AromaticContact CD2-CZ2 3.85Å; H818-W888 AromaticContact CD2-NE1 3.46Å; H818-W888 PolarHBondContact CD2-NE1 2.86Å
819	N	84.4	Confident	84.5	Confident	95 Å²	95	45.6 Å²	45.6	51%	0.508	24%	0.238	S	C	.	.	S	Bend	trans	52.9	-7.3	176.9	-66.9	-38	0	0	0	117.7	I887	N819-I887 WeakPolarHBondContact CA-O 3.41Å; N819-I887 PolarHBondContact N-O 2.88Å; N819-I887 PolarHBondContact OD1-N 3.06Å
820	T	85.8	Confident	85.2	Confident	64.75 Å²	64.75	46.1 Å²	46.1	40%	0.397	23%	0.229	S	C	.	.	S	Bend	trans	-144.2	156.8	-176.5	61.5	0	0	0	0	110.5	R817 H818 F889	R817-T820 WeakPolarHBondContact CB-O 3.38Å; R817-T820 VanDerWaalsContact CD-OG1 3.3Å; R817-T820 WeakPolarHBondContact CD-OG1 3.3Å; R817-T820 WeakPolarHBondContact CG-O 3.41Å; R817-T820 VanDerWaalsContact CZ-OG1 3.27Å; R817-T820 PolarHBondContact NE-OG1 3.17Å; R817-T820 VanDerWaalsContact NE-OG1 3.14Å; R817-T820 PolarHBondContact NH1-OG1 3.34Å; H818-T820 PolarHBondContact O-N 3.3Å; H818-T820 PolarHBondContact O-OG1 3.03Å; T820-F889 VanDerWaalsContact C-CD2 3.49Å; T820-F889 WeakPolarHBondContact O-CD2 3.13Å
821	M	81.9	Confident	85.2	Confident	51.5 Å²	51.5	46.7 Å²	46.7	25%	0.254	23%	0.232	S	C	.	.			trans	-69.7	137.1	-178.8	-104.4	178.3	-178.1	0	0	112.6	F762 P768 S788 R817 F889 A891	F762-M821 HydrophobicContact CB-CE 4.05Å; F762-M821 HydrophobicContact CB-CG 4.07Å; F762-M821 HydrophobicContact CB-SD 3.93Å; F762-M821 VanDerWaalsContact CB-SD 3.53Å; F762-M821 HydrophobicContact CD1-CE 3.54Å; F762-M821 HydrophobicContact CD1-CG 4.12Å; F762-M821 HydrophobicContact CD1-SD 3.78Å; F762-M821 VanDerWaalsContact CD1-SD 3.53Å; F762-M821 HydrophobicContact CD2-CB 4.11Å; F762-M821 HydrophobicContact CD2-CE 4.46Å; F762-M821 HydrophobicContact CD2-CG 4.29Å; F762-M821 HydrophobicContact CD2-SD 3.77Å; F762-M821 HydrophobicContact CE1-CB 4.2Å; F762-M821 HydrophobicContact CE1-CE 3.88Å; F762-M821 HydrophobicContact CE1-CG 3.72Å; F762-M821 HydrophobicContact CE1-SD 3.8Å; F762-M821 HydrophobicContact CE2-CB 3.51Å; F762-M821 HydrophobicContact CE2-CG 3.93Å; F762-M821 HydrophobicContact CE2-SD 4.25Å; F762-M821 HydrophobicContact CG-CE 4.23Å; F762-M821 HydrophobicContact CG-CG 4.41Å; F762-M821 HydrophobicContact CG-SD 3.53Å; F762-M821 VanDerWaalsContact CG-SD 3.56Å; F762-M821 WeakPolarHBondContact CG-SD 3.5Å; F762-M821 HydrophobicContact CZ-CB 3.58Å; F762-M821 HydrophobicContact CZ-CG 3.64Å; F762-M821 HydrophobicContact CZ-SD 4.07Å; P768-M821 HydrophobicContact CB-CE 3.89Å; P768-M821 HydrophobicContact CG-CE 3.81Å; S788-M821 WeakPolarHBondContact OG-CE 3.45Å; R817-M821 WeakPolarHBondContact CD-O 3.47Å; R817-M821 PolarHBondContact NH1-O 2.71Å; M821-F889 HydrophobicContact CE-CD1 4.23Å; M821-F889 HydrophobicContact CE-CE1 4.33Å; M821-F889 HydrophobicContact CG-CB 4.19Å; M821-F889 HydrophobicContact CG-CD1 4.12Å; M821-F889 HydrophobicContact CG-CG 4.09Å; M821-F889 HydrophobicContact SD-CB 3.82Å; M821-F889 HydrophobicContact SD-CD1 3.88Å; M821-F889 VanDerWaalsContact SD-CD1 3.52Å; M821-F889 HydrophobicContact SD-CE1 4.35Å; M821-F889 HydrophobicContact SD-CG 4.04Å; M821-A891 HydrophobicContact CE-CB 4.24Å
822	P	84.2	Confident	85.2	Confident	0.75 Å²	0.75	51.9 Å²	51.9	1%	0.005	25%	0.25	C	S	.	.			trans	-71.9	145	174.2	27.1	-33.5	0	0	0	112.8	F762 F815 R817 H826 A891	F762-P822 WeakPolarHBondContact CE2-O 3.25Å; F762-P822 HydrophobicContact CZ-CG 4.07Å; F762-P822 WeakPolarHBondContact CZ-O 3.32Å; F815-P822 HydrophobicContact CB-CB 3.83Å; F815-P822 HydrophobicContact CB-CG 4.19Å; R817-P822 HydrophobicContact CB-CB 3.9Å; R817-P822 HydrophobicContact CB-CG 4.32Å; P822-H826 CarbonylContact C-O 2.89Å; P822-H826 WeakPolarHBondContact CA-O 3.4Å; P822-A891 HydrophobicContact CG-CB 3.97Å
823	T	78.9	Confident	85	Confident	32.5 Å²	32.5	52 Å²	52	20%	0.199	25%	0.251	C	S	.	.	B	Isolated β-bridge	trans	-126.1	164.3	169.7	67.5	0	0	0	0	109.5	I825 H826	T823-I825 PolarHBondContact O-N 3.19Å; T823-I825 VanDerWaalsContact O-N 3.1Å; T823-I825 WeakPolarHBondContact OG1-CG1 3.32Å; T823-H826 PolarHBondContact N-O 2.99Å; T823-H826 CarbonylContact O-C 3.57Å; T823-H826 PolarHBondContact O-N 3.11Å; T823-H826 VanDerWaalsContact O-N 3.12Å; T823-H826 VanDerWaalsContact O-O 3.08Å; T823-H826 WeakPolarHBondContact OG1-CB 3.45Å; T823-H826 PolarHBondContact OG1-N 2.8Å; T823-H826 VanDerWaalsContact OG1-N 3.12Å; T823-H826 PolarHBondContact OG1-O 3.45Å
824	I	73.5	Confident	84.6	Confident	83.5 Å²	83.5	53 Å²	53	43%	0.428	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-27.6	178.9	-61.5	179.3	0	0	0	112.5	A757 L761 F815 Y827	A757-I824 HydrophobicContact CB-CD1 3.62Å; L761-I824 HydrophobicContact CD1-CG1 4.07Å; L761-I824 HydrophobicContact CD2-CD1 3.97Å; L761-I824 HydrophobicContact CD2-CG1 3.65Å; L761-I824 HydrophobicContact CG-CG1 3.97Å; F815-I824 HydrophobicContact CZ-CG1 4.4Å; I824-Y827 WeakPolarHBondContact O-CE1 3.39Å
825	I	73.2	Confident	83.9	Confident	131.75 Å²	131.75	52.9 Å²	52.9	68%	0.676	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.6	-9.8	-179.1	54.3	166.9	0	0	0	114.7	T823	T823-I825 PolarHBondContact O-N 3.19Å; T823-I825 VanDerWaalsContact O-N 3.1Å; T823-I825 WeakPolarHBondContact OG1-CG1 3.32Å
826	H	73.4	Confident	82.9	Confident	95 Å²	95	57.6 Å²	57.6	44%	0.44	28%	0.278	S	S	.	.	B	Isolated β-bridge	trans	-144.5	103.6	179.3	-73.6	73.3	0	0	0	110.2	P822 T823	P822-H826 CarbonylContact C-O 2.89Å; P822-H826 WeakPolarHBondContact CA-O 3.4Å; T823-H826 PolarHBondContact N-O 2.99Å; T823-H826 CarbonylContact O-C 3.57Å; T823-H826 PolarHBondContact O-N 3.11Å; T823-H826 VanDerWaalsContact O-N 3.12Å; T823-H826 VanDerWaalsContact O-O 3.08Å; T823-H826 WeakPolarHBondContact OG1-CB 3.45Å; T823-H826 PolarHBondContact OG1-N 2.8Å; T823-H826 VanDerWaalsContact OG1-N 3.12Å; T823-H826 PolarHBondContact OG1-O 3.45Å
827	Y	87.2	Confident	81.7	Confident	86.75 Å²	86.75	62.9 Å²	62.9	34%	0.34	31%	0.306	S	S	.	.			trans	-146.4	161.1	176.3	55.2	-97.7	0	0	0	108.1	A347 F815 I824 F830	A347-Y827 WeakPolarHBondContact CB-OH 3.31Å; F815-Y827 AromaticContact CD1-CD1 3.55Å; F815-Y827 HydrophobicContact CD1-CD1 3.55Å; F815-Y827 HydrophobicContact CD1-CE1 4.15Å; F815-Y827 AromaticContact CD1-CG 3.89Å; F815-Y827 HydrophobicContact CD1-CG 3.89Å; F815-Y827 AromaticContact CE1-CD1 3.81Å; F815-Y827 HydrophobicContact CE1-CD1 3.81Å; F815-Y827 AromaticContact CE1-CE1 3.97Å; F815-Y827 HydrophobicContact CE1-CE1 3.99Å; I824-Y827 WeakPolarHBondContact O-CE1 3.39Å; Y827-F830 HydrophobicContact CD2-CB 3.64Å; Y827-F830 HydrophobicContact CE1-CB 4.36Å; Y827-F830 HydrophobicContact CE2-CB 3.36Å; Y827-F830 VanDerWaalsContact CE2-CB 3.41Å; Y827-F830 HydrophobicContact CE2-CG 4.4Å; Y827-F830 HydrophobicContact CG-CB 4.27Å
828	D	83.7	Confident	80.6	Confident	83.5 Å²	83.5	60.9 Å²	60.9	45%	0.447	30%	0.3	S	S	.	.	S	Bend	trans	-100.7	-27.7	176	-50.4	-27.9	0	0	0	110.8	M816 R817 H818 W888	M816-D828 PolarHBondContact O-N 3.34Å; R817-D828 VanDerWaalsContact CA-OD2 3.29Å; R817-D828 WeakPolarHBondContact CA-OD2 3.27Å; R817-D828 VanDerWaalsContact CG-OD2 3.31Å; R817-D828 WeakPolarHBondContact CG-OD2 3.35Å; R817-D828 IonicContact NE-OD1 3.41Å; H818-D828 PolarHBondContact N-OD2 3.19Å; D828-W888 HydrophobicContact CB-CH2 4.47Å; D828-W888 HydrophobicContact CB-CZ3 4.19Å
829	I	86	Confident	78.9	Confident	24.5 Å²	24.5	65.8 Å²	65.8	13%	0.126	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	138.4	175.6	-56.7	173.1	0	0	0	109.3	F815 M816 H881 L883 W888	F815-I829 CarbonylContact C-O 3.39Å; F815-I829 WeakPolarHBondContact CA-O 3.35Å; M816-I829 HydrophobicContact CB-CB 4.13Å; M816-I829 HydrophobicContact CB-CD1 4.44Å; M816-I829 HydrophobicContact CG-CB 4.22Å; M816-I829 HydrophobicContact CG-CG2 4.4Å; M816-I829 PolarHBondContact N-O 3.13Å; M816-I829 PolarHBondContact O-N 3.13Å; M816-I829 VanDerWaalsContact O-N 3.08Å; M816-I829 HydrophobicContact SD-CD1 4.22Å; M816-I829 HydrophobicContact SD-CG2 4.43Å; I829-H881 HydrophobicContact CD1-CB 4.12Å; I829-H881 VanDerWaalsContact CG2-CE1 3.42Å; I829-H881 WeakPolarHBondContact CG2-CE1 3.27Å; I829-H881 WeakPolarHBondContact CG2-NE2 3.44Å; I829-L883 HydrophobicContact CD1-CD2 3.46Å; I829-L883 VanDerWaalsContact CD1-CD2 3.47Å; I829-W888 HydrophobicContact CD1-CH2 4.43Å; I829-W888 HydrophobicContact CD1-CZ3 4.2Å; I829-W888 HydrophobicContact CG1-CZ3 4.49Å
830	F	89.3	Confident	77.4	Confident	74 Å²	74	62.5 Å²	62.5	33%	0.325	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	128.1	170.8	171	-109.2	0	0	0	112	V814 F815 Y827 R832	V814-F830 CarbonylContact O-C 3.38Å; V814-F830 VanDerWaalsContact O-CA 3.3Å; V814-F830 WeakPolarHBondContact O-CA 3.4Å; V814-F830 WeakPolarHBondContact O-CD2 3.33Å; F815-F830 HydrophobicContact CD1-CB 4.37Å; F815-F830 AromaticContact CD1-CD2 3.56Å; F815-F830 HydrophobicContact CD1-CD2 3.56Å; F815-F830 HydrophobicContact CD1-CE2 4.25Å; F815-F830 HydrophobicContact CD1-CG 4.28Å; F815-F830 AromaticContact CD2-CD2 3.96Å; F815-F830 HydrophobicContact CD2-CD2 4.02Å; F815-F830 HydrophobicContact CD2-CE2 4.19Å; F815-F830 AromaticContact CE1-CD2 3.41Å; F815-F830 HydrophobicContact CE1-CD2 3.41Å; F815-F830 VanDerWaalsContact CE1-CD2 3.47Å; F815-F830 AromaticContact CE1-CE2 3.73Å; F815-F830 HydrophobicContact CE1-CE2 3.73Å; F815-F830 HydrophobicContact CE1-CG 4.17Å; F815-F830 AromaticContact CE2-CD2 3.89Å; F815-F830 HydrophobicContact CE2-CD2 3.89Å; F815-F830 AromaticContact CE2-CE2 3.64Å; F815-F830 HydrophobicContact CE2-CE2 3.64Å; F815-F830 AromaticContact CG-CD2 3.87Å; F815-F830 HydrophobicContact CG-CD2 3.87Å; F815-F830 HydrophobicContact CG-CE2 4.42Å; F815-F830 AromaticContact CZ-CD2 3.59Å; F815-F830 HydrophobicContact CZ-CD2 3.59Å; F815-F830 AromaticContact CZ-CE2 3.39Å; F815-F830 HydrophobicContact CZ-CE2 3.39Å; F815-F830 VanDerWaalsContact CZ-CE2 3.43Å; F815-F830 HydrophobicContact CZ-CZ 4.33Å; Y827-F830 HydrophobicContact CD2-CB 3.64Å; Y827-F830 HydrophobicContact CE1-CB 4.36Å; Y827-F830 HydrophobicContact CE2-CB 3.36Å; Y827-F830 VanDerWaalsContact CE2-CB 3.41Å; Y827-F830 HydrophobicContact CE2-CG 4.4Å; Y827-F830 HydrophobicContact CG-CB 4.27Å; F830-R832 HydrophobicContact CE1-CB 4.12Å; F830-R832 HydrophobicContact CZ-CB 3.87Å; F830-R832 HydrophobicContact CZ-CG 4.46Å
831	D	85.4	Confident	75.7	Confident	14.5 Å²	14.5	64 Å²	64	8%	0.078	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	129.3	169.3	-82.4	-61.8	0	0	0	110.1	Y801 V814 I833 R879 H881	Y801-D831 WeakPolarHBondContact CE1-OD2 2.99Å; Y801-D831 VanDerWaalsContact OH-CB 3.31Å; Y801-D831 WeakPolarHBondContact OH-CB 3.19Å; Y801-D831 VanDerWaalsContact OH-CG 3.29Å; Y801-D831 PolarHBondContact OH-OD2 3.1Å; V814-D831 HydrophobicContact CB-CB 4.17Å; V814-D831 HydrophobicContact CG2-CB 4.49Å; V814-D831 PolarHBondContact N-O 3.24Å; V814-D831 PolarHBondContact O-N 3.05Å; D831-I833 HydrophobicContact CB-CD1 4.19Å; D831-I833 HydrophobicContact CB-CG1 4.44Å; D831-R879 VanDerWaalsContact OD1-CD 3.22Å; D831-R879 WeakPolarHBondContact OD1-CD 3.25Å; D831-R879 IonicContact OD1-CZ 2.77Å; D831-R879 IonicContact OD1-NE 3.3Å; D831-R879 PolarHBondContact OD1-NE 2.74Å; D831-R879 IonicContact OD1-NH1 3.64Å; D831-R879 PolarHBondContact OD1-NH1 3.38Å; D831-R879 IonicContact OD1-NH2 3.92Å; D831-R879 PolarHBondContact OD1-NH2 2.84Å; D831-R879 WeakPolarHBondContact OD2-CG 3.18Å; D831-H881 IonicContact OD1-CE1 2.8Å; D831-H881 IonicContact OD1-NE2 3.23Å; D831-H881 PolarHBondContact OD1-NE2 3.12Å; D831-H881 IonicContact OD2-CD2 3.53Å; D831-H881 IonicContact OD2-CE1 3.3Å; D831-H881 IonicContact OD2-NE2 3.54Å; D831-H881 PolarHBondContact OD2-NE2 2.9Å
832	R	86.8	Confident	73.5	Confident	118 Å²	118	66.4 Å²	66.4	45%	0.445	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	117.9	164	-163.8	175.2	129.9	176.4	4.2	110.2	S811 F830 T834 D895 G952 H953	S811-R832 PolarHBondContact OG-NE 2.94Å; S811-R832 VanDerWaalsContact OG-NE 3.14Å; F830-R832 HydrophobicContact CE1-CB 4.12Å; F830-R832 HydrophobicContact CZ-CB 3.87Å; F830-R832 HydrophobicContact CZ-CG 4.46Å; R832-T834 HydrophobicContact CG-CG2 4.23Å; R832-D895 IonicContact CZ-OD2 3.57Å; R832-D895 IonicContact NE-OD2 3.69Å; R832-D895 PolarHBondContact NE-OD2 2.6Å; R832-D895 IonicContact NH2-OD2 3.36Å; R832-D895 PolarHBondContact NH2-OD2 2.99Å; R832-G952 PolarHBondContact NH2-O 3.01Å; R832-H953 PolarHBondContact NH1-CE1 2.99Å; R832-H953 PolarHBondContact NH1-NE2 3.42Å
833	I	84.8	Confident	71.1	Confident	3 Å²	3	69.6 Å²	69.6	2%	0.015	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	108.2	-178.5	-56	-81.8	0	0	0	108.4	Y801 I803 V805 S811 V812 V814 D831 L838 T877 R879	Y801-I833 HydrophobicContact CE2-CD1 4.11Å; I803-I833 HydrophobicContact CD1-CG1 4.43Å; I803-I833 HydrophobicContact CG2-CD1 3.93Å; I803-I833 VanDerWaalsContact CG2-CD1 3.42Å; I803-I833 HydrophobicContact CG2-CG1 4Å; I803-I833 HydrophobicContact CG2-CG2 4.16Å; V805-I833 HydrophobicContact CG1-CG2 4Å; S811-I833 CarbonylContact C-O 3.58Å; S811-I833 VanDerWaalsContact CA-O 3.3Å; S811-I833 WeakPolarHBondContact CA-O 3.35Å; V812-I833 HydrophobicContact CB-CB 4.44Å; V812-I833 PolarHBondContact N-O 3.03Å; V812-I833 PolarHBondContact O-N 3.16Å; V814-I833 HydrophobicContact CG2-CD1 3.78Å; V814-I833 HydrophobicContact CG2-CG1 3.95Å; D831-I833 HydrophobicContact CB-CD1 4.19Å; D831-I833 HydrophobicContact CB-CG1 4.44Å; I833-L838 HydrophobicContact CG2-CD1 4.02Å; I833-T877 HydrophobicContact CD1-CG2 4Å; I833-T877 HydrophobicContact CG2-CG2 3.96Å; I833-R879 HydrophobicContact CD1-CG 4.3Å
834	T	82.3	Confident	68.9	Low	23.5 Å²	23.5	79.1 Å²	79.1	14%	0.144	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	126.1	-178.4	48.8	0	0	0	0	111	S810 S811 R832 H836 N837	S810-T834 CarbonylContact O-C 3.32Å; S810-T834 VanDerWaalsContact O-CA 3.24Å; S810-T834 WeakPolarHBondContact O-CA 3.44Å; S811-T834 WeakPolarHBondContact OG-CG2 3.31Å; R832-T834 HydrophobicContact CG-CG2 4.23Å; T834-H836 VanDerWaalsContact CB-CE1 3.43Å; T834-H836 WeakPolarHBondContact CB-CE1 3.22Å; T834-H836 PolarHBondContact O-N 2.68Å; T834-H836 VanDerWaalsContact O-N 3.13Å; T834-H836 PolarHBondContact OG1-CE1 3.23Å; T834-H836 VanDerWaalsContact OG1-CE1 3.3Å; T834-H836 PolarHBondContact OG1-ND1 3.26Å; T834-H836 VanDerWaalsContact OG1-ND1 3.1Å; T834-H836 PolarHBondContact OG1-NE2 3.11Å; T834-N837 PolarHBondContact O-N 3.2Å; T834-N837 PolarHBondContact OG1-ND2 3.21Å
835	G	76.4	Confident	66.9	Low	0 Å²	0	83.4 Å²	83.4	0%	0	42%	0.423	C	S	.	.	G	3₁₀ helix	trans	-62.9	-21.5	-173.9	0	0	0	0	0	114.9	S807 L808 S810 N837 L838	S807-G835 WeakPolarHBondContact O-CA 3.34Å; L808-G835 CarbonylContact O-C 3.42Å; L808-G835 VanDerWaalsContact O-C 3.29Å; L808-G835 WeakPolarHBondContact O-CA 3.23Å; S810-G835 PolarHBondContact O-N 3.12Å; G835-N837 VanDerWaalsContact C-N 3.3Å; G835-N837 PolarHBondContact O-N 3.03Å; G835-L838 PolarHBondContact O-N 3.12Å
836	H	72.6	Confident	64.8	Low	112.75 Å²	112.75	86.3 Å²	86.3	52%	0.522	43%	0.434	S	S	.	.	G	3₁₀ helix	trans	-68	-28.6	175	91	-83	0	0	0	112.8	L808 T834 L838 K948	L808-H836 PolarHBondContact O-N 3.01Å; T834-H836 VanDerWaalsContact CB-CE1 3.43Å; T834-H836 WeakPolarHBondContact CB-CE1 3.22Å; T834-H836 PolarHBondContact O-N 2.68Å; T834-H836 VanDerWaalsContact O-N 3.13Å; T834-H836 PolarHBondContact OG1-CE1 3.23Å; T834-H836 VanDerWaalsContact OG1-CE1 3.3Å; T834-H836 PolarHBondContact OG1-ND1 3.26Å; T834-H836 VanDerWaalsContact OG1-ND1 3.1Å; T834-H836 PolarHBondContact OG1-NE2 3.11Å; H836-L838 VanDerWaalsContact C-N 3.35Å; H836-K948 PolarHBondContact NE2-NZ 3.14Å
837	N	65.2	Low	62.8	Low	114.25 Å²	114.25	89.8 Å²	89.8	61%	0.611	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-89.5	-2.5	179.2	-71	-20.9	0	0	0	113	T834 G835	T834-N837 PolarHBondContact O-N 3.2Å; T834-N837 PolarHBondContact OG1-ND2 3.21Å; G835-N837 VanDerWaalsContact C-N 3.3Å; G835-N837 PolarHBondContact O-N 3.03Å
838	L	66.9	Low	60.1	Low	15.75 Å²	15.75	88.7 Å²	88.7	8%	0.082	47%	0.471	C	S	.	.	S	Bend	trans	-106.5	125.7	-178.8	-56.1	-170	0	0	0	110.3	V805 I833 G835 H836 R875 T877	V805-L838 HydrophobicContact CG2-CD1 4.01Å; I833-L838 HydrophobicContact CG2-CD1 4.02Å; G835-L838 PolarHBondContact O-N 3.12Å; H836-L838 VanDerWaalsContact C-N 3.35Å; L838-R875 HydrophobicContact CB-CB 3.93Å; L838-R875 HydrophobicContact CD1-CB 4.32Å; L838-R875 WeakPolarHBondContact O-CD 3.46Å; L838-R875 PolarHBondContact O-NH1 3.1Å; L838-T877 HydrophobicContact CD1-CG2 3.76Å; L838-T877 VanDerWaalsContact CD2-CB 3.49Å; L838-T877 HydrophobicContact CD2-CG2 3.96Å; L838-T877 HydrophobicContact CG-CG2 4.5Å
839	L	55.3	Low	57.6	Low	157.25 Å²	157.25	89.9 Å²	89.9	82%	0.823	49%	0.486	S	S	*	.			trans	-66	145	170.3	-66.1	172.7	0	0	0	110.1
840	A	53.4	Low	55	Low	24 Å²	24	99.4 Å²	99.4	20%	0.198	52%	0.52	C	S	.	.			trans	-65.5	141.2	170.2	0	0	0	0	0	109.6	S842 E873	A840-S842 VanDerWaalsContact C-N 3.29Å; A840-S842 PolarHBondContact O-N 3.06Å; A840-S842 PolarHBondContact O-OG 3.31Å; A840-E873 HydrophobicContact CB-CB 4.37Å; A840-E873 WeakPolarHBondContact CB-OE2 3.26Å
841	N	49.7	Very low	52.3	Low	97.5 Å²	97.5	102.1 Å²	102.1	52%	0.521	54%	0.542	S	S	.	.			trans	-78.2	68	-168.1	-152.7	-3.3	0	0	0	111.5	G843 E876	N841-G843 PolarHBondContact O-N 3.3Å; N841-G843 VanDerWaalsContact O-N 3.14Å; N841-E876 PolarHBondContact ND2-OE2 3.18Å; N841-E876 VanDerWaalsContact ND2-OE2 3.11Å
842	S	35.3	Very low	50	Low	101.75 Å²	101.75	111.2 Å²	111.2	71%	0.712	58%	0.581	S	S	*	*			trans	-58.7	111.7	177.6	-73.6	0	0	0	0	109.4	A840 R844	A840-S842 VanDerWaalsContact C-N 3.29Å; A840-S842 PolarHBondContact O-N 3.06Å; A840-S842 PolarHBondContact O-OG 3.31Å; S842-R844 PolarHBondContact O-N 3.09Å
843	G	33.5	Very low	47.4	Very low	67.75 Å²	67.75	116.3 Å²	116.3	70%	0.698	60%	0.601	S	S	*	*			trans	-54.1	111.2	-162.2	0	0	0	0	0	113.9	N841 Q845	N841-G843 PolarHBondContact O-N 3.3Å; N841-G843 VanDerWaalsContact O-N 3.14Å; G843-Q845 PolarHBondContact O-N 3.1Å
844	R	32	Very low	45	Very low	231.75 Å²	231.75	122.8 Å²	122.8	88%	0.875	64%	0.636	S	S	*	*			trans	-73.2	72.7	174.8	-164.1	174.3	-169.4	164.6	1.8	110.2	S842 E846 D926	S842-R844 PolarHBondContact O-N 3.09Å; R844-E846 PolarHBondContact O-N 2.86Å; R844-D926 IonicContact NH2-OD2 2.82Å; R844-D926 PolarHBondContact NH2-OD2 2.86Å
845	Q	32.1	Very low	42.8	Very low	173.75 Å²	173.75	127.7 Å²	127.7	81%	0.812	67%	0.665	S	S	*	*			trans	-56.8	135	173.1	-80.5	-171.6	-24.8	0	0	110.4	G843 L847	G843-Q845 PolarHBondContact O-N 3.1Å; Q845-L847 PolarHBondContact O-N 3.05Å; Q845-L847 VanDerWaalsContact O-N 3.13Å
846	E	29.6	Very low	40.9	Very low	192.75 Å²	192.75	136.4 Å²	136.4	90%	0.901	71%	0.706	S	S	*	*			trans	-70	101.3	174.6	-61.3	-177.4	122.9	0	0	110.2	R844 G848	R844-E846 PolarHBondContact O-N 2.86Å; E846-G848 VanDerWaalsContact C-N 3.3Å; E846-G848 PolarHBondContact O-N 2.9Å
847	L	31.8	Very low	39.3	Very low	168.5 Å²	168.5	136.1 Å²	136.1	88%	0.882	71%	0.714	S	S	*	*			trans	-100	80	166.6	-132.7	78.6	0	0	0	110.5	Q845 S849	Q845-L847 PolarHBondContact O-N 3.05Å; Q845-L847 VanDerWaalsContact O-N 3.13Å; L847-S849 PolarHBondContact O-N 3.09Å
848	G	29	Very low	37.9	Very low	64.75 Å²	64.75	136.8 Å²	136.8	67%	0.668	72%	0.723	S	S	*	*			trans	-75.6	122.9	154.9	0	0	0	0	0	111.3	E846	E846-G848 VanDerWaalsContact C-N 3.3Å; E846-G848 PolarHBondContact O-N 2.9Å
849	S	32.1	Very low	36.2	Very low	108.5 Å²	108.5	142.1 Å²	142.1	76%	0.759	75%	0.751	S	S	*	*			trans	68.6	117.2	166.1	-162.2	0	0	0	0	119.3	L847	L847-S849 PolarHBondContact O-N 3.09Å
850	R	31.2	Very low	35.2	Very low	222.75 Å²	222.75	145 Å²	145	84%	0.841	75%	0.751	S	S	*	*			trans	23.2	119.8	143.1	-63.1	169.2	167.1	169.6	-4.8	116.4
851	T	33.6	Very low	34.1	Very low	130.75 Å²	130.75	151 Å²	151	80%	0.802	78%	0.78	S	S	*	*				-171.2	131.8	111.6	45	0	0	0	0	114.9
852	K	36.8	Very low	33.4	Very low	206.25 Å²	206.25	152 Å²	152	90%	0.897	79%	0.794	S	S	*	*			trans	58.8	159.3	144.7	-84.1	179.2	178	-178.1	0	116
853	R	31.2	Very low	33.3	Very low	225.5 Å²	225.5	157.2 Å²	157.2	85%	0.851	80%	0.804	S	S	*	*			trans	-75	166.3	171.8	-54.6	175.2	-179	143.4	-0.9	110.2
854	D	34.1	Very low	33.2	Very low	140 Å²	140	159.1 Å²	159.1	75%	0.749	81%	0.807	S	S	*	*				-177	150.2	86.1	-92.7	-41.8	0	0	0	112.9
855	T	37.1	Very low	33.2	Very low	125.75 Å²	125.75	155.4 Å²	155.4	77%	0.771	80%	0.804	S	S	*	*				66.8	135.2	101.9	18.7	0	0	0	0	117.7
856	Q	36.8	Very low	33.2	Very low	182.5 Å²	182.5	154.2 Å²	154.2	85%	0.853	80%	0.801	S	S	*	*			trans	-92.5	171.8	148.5	-103.6	179.9	-6.8	0	0	112.2
857	P	38	Very low	33.1	Very low	107 Å²	107	153.3 Å²	153.3	70%	0.695	80%	0.797	S	S	*	*				-125.2	165.8	-106.7	37.1	-23.4	0	0	0	117.1
858	T	35.3	Very low	33.1	Very low	127.75 Å²	127.75	152.5 Å²	152.5	78%	0.784	79%	0.792	S	S	*	*			trans	178	134.2	142.5	49.1	0	0	0	0	116.4
859	N	32.8	Very low	33.2	Very low	128.25 Å²	128.25	154.3 Å²	154.3	69%	0.686	79%	0.794	S	S	*	*				80.1	102.2	127.1	-100.8	-27.6	0	0	0	120.9
860	R	33.4	Very low	33.3	Very low	216.5 Å²	216.5	154 Å²	154	82%	0.817	79%	0.792	S	S	*	*				91.3	126.4	119.7	-79.5	173	-179.1	-168.2	-2.5	120.2
861	N	31.2	Very low	33.6	Very low	150 Å²	150	152.1 Å²	152.1	80%	0.802	79%	0.79	S	S	*	*			trans	50.2	110.6	145.7	-57.6	-3.4	0	0	0	118.7
862	S	35.1	Very low	34.2	Very low	118.75 Å²	118.75	152.3 Å²	152.3	83%	0.83	79%	0.786	S	S	*	*			trans	-155.6	125.9	139.4	-63.1	0	0	0	0	110.2	S864	S862-S864 VanDerWaalsContact C-N 3.35Å; S862-S864 PolarHBondContact O-N 3.18Å; S862-S864 VanDerWaalsContact O-N 3.17Å
863	K	32.3	Very low	35.1	Very low	211.75 Å²	211.75	148 Å²	148	92%	0.921	77%	0.769	S	S	*	*			trans	-79.5	115.6	154.1	-76.9	-175.4	175.2	-178.4	0	110.9
864	S	32.6	Very low	36.7	Very low	107.25 Å²	107.25	140.1 Å²	140.1	75%	0.75	74%	0.743	S	S	*	*			trans	-139.8	127.7	164.8	52.8	0	0	0	0	113.3	S862	S862-S864 VanDerWaalsContact C-N 3.35Å; S862-S864 PolarHBondContact O-N 3.18Å; S862-S864 VanDerWaalsContact O-N 3.17Å
865	L	31	Very low	38.8	Very low	154.5 Å²	154.5	135.5 Å²	135.5	81%	0.809	72%	0.716	S	S	*	*			trans	-37.8	132.6	147.5	-103.6	78.1	0	0	0	115.1	H867	L865-H867 PolarHBondContact O-N 2.89Å; L865-H867 VanDerWaalsContact O-N 3.11Å
866	I	31.6	Very low	40.8	Very low	149.25 Å²	149.25	133.3 Å²	133.3	77%	0.765	70%	0.696	S	S	*	*			trans	128.4	112.2	151.5	-57	171.6	0	0	0	111.2	I868	I866-I868 HydrophobicContact CG2-CD1 4.08Å; I866-I868 HydrophobicContact CG2-CG1 4.07Å; I866-I868 PolarHBondContact O-N 3.05Å
867	H	28.2	Very low	42.9	Very low	172.75 Å²	172.75	125.5 Å²	125.5	80%	0.8	66%	0.662	S	S	*	*			trans	-12.1	113.1	143.2	-118.5	-71.6	0	0	0	112.9	L865 S869	L865-H867 PolarHBondContact O-N 2.89Å; L865-H867 VanDerWaalsContact O-N 3.11Å; H867-S869 VanDerWaalsContact C-N 3.3Å; H867-S869 PolarHBondContact O-N 3.47Å
868	I	30.9	Very low	45	Very low	152.5 Å²	152.5	121.6 Å²	121.6	78%	0.782	64%	0.64	S	S	*	*			trans	-82.1	126.2	162.6	-58.3	177.2	0	0	0	109.1	I866	I866-I868 HydrophobicContact CG2-CD1 4.08Å; I866-I868 HydrophobicContact CG2-CG1 4.07Å; I866-I868 PolarHBondContact O-N 3.05Å
869	S	31.8	Very low	47.1	Very low	101.5 Å²	101.5	119.3 Å²	119.3	71%	0.71	62%	0.617	S	S	*	*			trans	-96.4	130.7	157	-167.6	0	0	0	0	113.7	H867 K871	H867-S869 VanDerWaalsContact C-N 3.3Å; H867-S869 PolarHBondContact O-N 3.47Å; S869-K871 PolarHBondContact O-N 2.82Å
870	S	33.9	Very low	49.4	Very low	103.5 Å²	103.5	115.1 Å²	115.1	72%	0.724	60%	0.595	S	S	*	*			trans	-84.1	141.7	168.3	51.1	0	0	0	0	111.7
871	K	37.4	Very low	51.7	Low	182.75 Å²	182.75	106.7 Å²	106.7	80%	0.795	57%	0.565	S	S	*	*			trans	-119.5	148.3	164	-84.1	172.4	-178.8	178.1	0	110.3	S869 E873	S869-K871 PolarHBondContact O-N 2.82Å; K871-E873 PolarHBondContact O-N 3.29Å
872	D	47.7	Very low	54.2	Low	134.5 Å²	134.5	104.3 Å²	104.3	72%	0.719	55%	0.545	S	S	*	.			trans	-5.7	67.1	172.7	-49.7	-56.9	0	0	0	114.8	L874	D872-L874 VanDerWaalsContact C-N 3.33Å; D872-L874 PolarHBondContact O-N 3.03Å
873	E	54.6	Low	56.6	Low	115.25 Å²	115.25	98.7 Å²	98.7	54%	0.539	51%	0.506	S	S	.	.			trans	-72.6	97.2	166.4	-71.5	-167.7	151.4	0	0	111.2	A840 K871 R875	A840-E873 HydrophobicContact CB-CB 4.37Å; A840-E873 WeakPolarHBondContact CB-OE2 3.26Å; K871-E873 PolarHBondContact O-N 3.29Å; E873-R875 WeakPolarHBondContact O-CG 3.5Å; E873-R875 PolarHBondContact O-N 3.08Å
874	L	65.3	Low	59.1	Low	59.25 Å²	59.25	92.8 Å²	92.8	31%	0.31	48%	0.484	S	S	.	.			trans	-55.6	127.9	171.9	-83.6	111	0	0	0	111.2	T804 D872 K903	T804-L874 HydrophobicContact CG2-CB 4.47Å; T804-L874 HydrophobicContact CG2-CD2 4.36Å; D872-L874 VanDerWaalsContact C-N 3.33Å; D872-L874 PolarHBondContact O-N 3.03Å; L874-K903 HydrophobicContact CD1-CD 4.1Å; L874-K903 HydrophobicContact CD2-CD 4Å; L874-K903 HydrophobicContact CD2-CG 4.33Å
875	R	76.8	Confident	61.8	Low	44 Å²	44	93.7 Å²	93.7	17%	0.166	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	117.7	180	-56.3	-173.2	170.1	-131.4	-5.8	109	T804 V805 L808 L838 E873	T804-R875 CarbonylContact C-O 3.24Å; T804-R875 VanDerWaalsContact CA-O 3.27Å; T804-R875 WeakPolarHBondContact CA-O 3.34Å; V805-R875 HydrophobicContact CG2-CB 4.19Å; V805-R875 PolarHBondContact N-O 3.15Å; V805-R875 PolarHBondContact O-N 3.22Å; L808-R875 VanDerWaalsContact CD2-NH1 3.28Å; L838-R875 HydrophobicContact CB-CB 3.93Å; L838-R875 HydrophobicContact CD1-CB 4.32Å; L838-R875 WeakPolarHBondContact O-CD 3.46Å; L838-R875 PolarHBondContact O-NH1 3.1Å; E873-R875 WeakPolarHBondContact O-CG 3.5Å; E873-R875 PolarHBondContact O-N 3.08Å
876	E	80.7	Confident	64.6	Low	79.25 Å²	79.25	87.2 Å²	87.2	37%	0.37	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	144.2	-178.3	-169.1	172.3	-177	0	0	111.2	N802 I803 T804 N841	N802-E876 PolarHBondContact ND2-OE1 3.15Å; I803-E876 WeakPolarHBondContact O-CA 3.36Å; T804-E876 HydrophobicContact CG2-CB 3.76Å; T804-E876 HydrophobicContact CG2-CG 3.85Å; N841-E876 PolarHBondContact ND2-OE2 3.18Å; N841-E876 VanDerWaalsContact ND2-OE2 3.11Å
877	T	80.2	Confident	67.4	Low	20.25 Å²	20.25	82.8 Å²	82.8	12%	0.124	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	151.9	167.2	-169	0	0	0	0	110.8	N802 I803 I833 L838 R879 N934	N802-T877 CarbonylContact C-O 3.47Å; N802-T877 VanDerWaalsContact CA-O 3.3Å; N802-T877 WeakPolarHBondContact CA-O 3.36Å; I803-T877 HydrophobicContact CG2-CG2 3.55Å; I803-T877 PolarHBondContact N-O 2.78Å; I803-T877 PolarHBondContact O-N 2.83Å; I833-T877 HydrophobicContact CD1-CG2 4Å; I833-T877 HydrophobicContact CG2-CG2 3.96Å; L838-T877 HydrophobicContact CD1-CG2 3.76Å; L838-T877 VanDerWaalsContact CD2-CB 3.49Å; L838-T877 HydrophobicContact CD2-CG2 3.96Å; L838-T877 HydrophobicContact CG-CG2 4.5Å; T877-R879 PolarHBondContact OG1-NH1 3.04Å; T877-N934 PolarHBondContact OG1-ND2 2.8Å; T877-N934 VanDerWaalsContact OG1-ND2 3.16Å
878	G	81.2	Confident	70.5	Confident	23.5 Å²	23.5	75.2 Å²	75.2	24%	0.242	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	141.7	170.8	0	0	0	0	0	110.8	Y801	Y801-G878 CarbonylContact O-C 3.54Å; Y801-G878 VanDerWaalsContact O-CA 3.27Å; Y801-G878 WeakPolarHBondContact O-CA 3.36Å
879	R	80.9	Confident	73.4	Confident	79.75 Å²	79.75	69.6 Å²	69.6	30%	0.301	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	140.6	169.9	-72.4	-73.5	-176.8	-171.8	-5.5	109.3	R800 Y801 D831 I833 T877	R800-R879 CarbonylContact C-O 3.6Å; R800-R879 VanDerWaalsContact CA-O 3.27Å; R800-R879 WeakPolarHBondContact CA-O 3.44Å; Y801-R879 HydrophobicContact CD1-CB 4.01Å; Y801-R879 HydrophobicContact CE1-CB 3.52Å; Y801-R879 VanDerWaalsContact CE1-CB 3.49Å; Y801-R879 HydrophobicContact CE1-CG 4.16Å; Y801-R879 HydrophobicContact CE2-CB 4.24Å; Y801-R879 HydrophobicContact CE2-CG 4.3Å; Y801-R879 HydrophobicContact CG-CB 4.47Å; Y801-R879 PolarHBondContact N-O 3.12Å; Y801-R879 PolarHBondContact O-N 3.04Å; Y801-R879 WeakPolarHBondContact OH-CG 3.45Å; D831-R879 VanDerWaalsContact OD1-CD 3.22Å; D831-R879 WeakPolarHBondContact OD1-CD 3.25Å; D831-R879 IonicContact OD1-CZ 2.77Å; D831-R879 IonicContact OD1-NE 3.3Å; D831-R879 PolarHBondContact OD1-NE 2.74Å; D831-R879 IonicContact OD1-NH1 3.64Å; D831-R879 PolarHBondContact OD1-NH1 3.38Å; D831-R879 IonicContact OD1-NH2 3.92Å; D831-R879 PolarHBondContact OD1-NH2 2.84Å; D831-R879 WeakPolarHBondContact OD2-CG 3.18Å; I833-R879 HydrophobicContact CD1-CG 4.3Å; T877-R879 PolarHBondContact OG1-NH1 3.04Å
880	L	79.8	Confident	76.3	Confident	41.25 Å²	41.25	64.8 Å²	64.8	22%	0.216	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	134.8	173	-124.1	78.5	0	0	0	108.7	Y798 I799 R800 A909 M911 P916 N917 V924	Y798-L880 HydrophobicContact CD1-CD2 4.26Å; Y798-L880 HydrophobicContact CG-CD2 4.47Å; I799-L880 VanDerWaalsContact O-CA 3.32Å; I799-L880 WeakPolarHBondContact O-CA 3.28Å; I799-L880 WeakPolarHBondContact O-CG 3.19Å; R800-L880 HydrophobicContact CB-CD1 3.74Å; R800-L880 HydrophobicContact CB-CG 4.38Å; R800-L880 HydrophobicContact CG-CD1 4Å; L880-A909 HydrophobicContact CD1-CB 3.86Å; L880-A909 HydrophobicContact CD2-CB 4.22Å; L880-A909 HydrophobicContact CG-CB 4.13Å; L880-M911 HydrophobicContact CD1-CE 4.43Å; L880-M911 HydrophobicContact CD2-CE 3.37Å; L880-M911 HydrophobicContact CD2-SD 4Å; L880-P916 HydrophobicContact CD2-CB 3.79Å; L880-N917 VanDerWaalsContact CD2-OD1 3.27Å; L880-N917 WeakPolarHBondContact CD2-OD1 3.49Å; L880-V924 HydrophobicContact CD1-CG2 3.67Å
881	H	82.5	Confident	79	Confident	39.75 Å²	39.75	59.9 Å²	59.9	18%	0.184	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	143.9	173	-74.5	-66.6	0	0	0	110	Y798 I799 Y801 I829 D831 L883	Y798-H881 CarbonylContact C-O 3.58Å; Y798-H881 WeakPolarHBondContact CA-O 3.26Å; I799-H881 HydrophobicContact CD1-CB 4.1Å; I799-H881 WeakPolarHBondContact CG1-O 3.29Å; I799-H881 PolarHBondContact N-O 3.09Å; I799-H881 PolarHBondContact O-N 2.97Å; Y801-H881 AromaticContact CE1-CD2 3.82Å; I829-H881 HydrophobicContact CD1-CB 4.12Å; I829-H881 VanDerWaalsContact CG2-CE1 3.42Å; I829-H881 WeakPolarHBondContact CG2-CE1 3.27Å; I829-H881 WeakPolarHBondContact CG2-NE2 3.44Å; D831-H881 IonicContact OD1-CE1 2.8Å; D831-H881 IonicContact OD1-NE2 3.23Å; D831-H881 PolarHBondContact OD1-NE2 3.12Å; D831-H881 IonicContact OD2-CD2 3.53Å; D831-H881 IonicContact OD2-CE1 3.3Å; D831-H881 IonicContact OD2-NE2 3.54Å; D831-H881 PolarHBondContact OD2-NE2 2.9Å; H881-L883 HydrophobicContact CB-CD2 4.32Å
882	Y	83.1	Confident	81.6	Confident	100 Å²	100	51.2 Å²	51.2	39%	0.392	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	127.9	165.3	-170.7	-92.4	0	0	0	108.2	A796 Y798 P939 I943	A796-Y882 HydrophobicContact CB-CE1 4.05Å; A796-Y882 VanDerWaalsContact CB-OH 3.32Å; A796-Y882 WeakPolarHBondContact CB-OH 3.3Å; Y798-Y882 HydrophobicContact CD1-CD2 4.35Å; Y798-Y882 AromaticContact CD2-CD2 3.84Å; Y798-Y882 HydrophobicContact CD2-CD2 3.84Å; Y798-Y882 HydrophobicContact CD2-CE2 4.37Å; Y798-Y882 HydrophobicContact CE1-CD2 4.31Å; Y798-Y882 HydrophobicContact CE1-CG 4.47Å; Y798-Y882 AromaticContact CE2-CD2 3.78Å; Y798-Y882 HydrophobicContact CE2-CD2 3.78Å; Y798-Y882 HydrophobicContact CE2-CE2 4.26Å; Y798-Y882 HydrophobicContact CG-CD2 4.12Å; Y798-Y882 AromaticContact CZ-CD2 3.86Å; Y882-P939 HydrophobicContact CD2-CG 3.39Å; Y882-P939 HydrophobicContact CE2-CG 3.42Å; Y882-P939 VanDerWaalsContact CE2-CG 3.42Å; Y882-P939 HydrophobicContact CG-CG 4.29Å; Y882-I943 HydrophobicContact CD1-CD1 4.12Å
883	L	85.5	Confident	83.6	Confident	0.25 Å²	0.25	45.8 Å²	45.8	0%	0.001	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	135.7	172.8	-60.2	-174.8	0	0	0	109.9	M793 A796 R797 I799 M816 I829 H881 W888	M793-L883 HydrophobicContact CE-CB 4.12Å; M793-L883 WeakPolarHBondContact CE-O 3.46Å; M793-L883 HydrophobicContact CG-CB 4.09Å; M793-L883 HydrophobicContact SD-CB 4.3Å; M793-L883 HydrophobicContact SD-CD1 4.37Å; A796-L883 VanDerWaalsContact CA-O 3.27Å; A796-L883 WeakPolarHBondContact CA-O 3.32Å; R797-L883 PolarHBondContact N-O 3.1Å; R797-L883 VanDerWaalsContact N-O 3.09Å; R797-L883 PolarHBondContact O-N 2.83Å; R797-L883 VanDerWaalsContact O-N 3.12Å; I799-L883 HydrophobicContact CD1-CD1 3.59Å; I799-L883 HydrophobicContact CD1-CG 3.92Å; I799-L883 HydrophobicContact CG1-CD1 3.79Å; I799-L883 VanDerWaalsContact CG1-CD1 3.49Å; I799-L883 HydrophobicContact CG1-CG 3.82Å; M816-L883 HydrophobicContact CE-CD1 3.9Å; M816-L883 HydrophobicContact CE-CD2 4.2Å; I829-L883 HydrophobicContact CD1-CD2 3.46Å; I829-L883 VanDerWaalsContact CD1-CD2 3.47Å; H881-L883 HydrophobicContact CB-CD2 4.32Å; L883-W888 HydrophobicContact CB-CD2 4.37Å; L883-W888 HydrophobicContact CB-CZ2 4.05Å; L883-W888 HydrophobicContact CD1-CB 4.43Å; L883-W888 HydrophobicContact CD1-CD2 4.07Å; L883-W888 HydrophobicContact CD1-CE3 4.45Å; L883-W888 HydrophobicContact CD1-CG 3.97Å; L883-W888 HydrophobicContact CD2-CD2 3.84Å; L883-W888 HydrophobicContact CD2-CE3 3.84Å; L883-W888 HydrophobicContact CD2-CH2 3.86Å; L883-W888 HydrophobicContact CD2-CZ2 3.86Å; L883-W888 HydrophobicContact CD2-CZ3 3.84Å; L883-W888 HydrophobicContact CG-CD2 4.33Å; L883-W888 HydrophobicContact CG-CZ2 4.45Å
884	D	86	Confident	85.2	Confident	87.5 Å²	87.5	40.4 Å²	40.4	47%	0.468	20%	0.2	S	C	.	.			trans	-69.6	161.9	170	-70	-44.9	0	0	0	112.4	M793 W888	M793-D884 WeakPolarHBondContact CB-O 3.38Å; M793-D884 VanDerWaalsContact CG-O 3.29Å; M793-D884 WeakPolarHBondContact CG-O 3.27Å; D884-W888 HydrophobicContact CB-CZ2 4.4Å; D884-W888 PolarHBondContact O-NE1 3.16Å
885	E	88.3	Confident	86	Confident	126 Å²	126	40.5 Å²	40.5	59%	0.589	20%	0.201	S	C	*	.	S	Bend	trans	-62.3	139.3	176.4	-171.2	177.3	139.4	0	0	111.7	M793 H818	M793-E885 WeakPolarHBondContact O-CA 3.37Å; H818-E885 PolarHBondContact NE2-O 3.19Å
886	G	89.5	Confident	86.1	Confident	19 Å²	19	40.6 Å²	40.6	20%	0.196	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	129.2	-161.7	178.3	0	0	0	0	0	113.9	M793	M793-G886 PolarHBondContact N-O 3.15Å; M793-G886 PolarHBondContact O-N 2.95Å
887	I	90.9	Very high	86	Confident	56.75 Å²	56.75	41.8 Å²	41.8	29%	0.291	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	129.9	-179.6	-61.4	174.4	0	0	0	109.1	Q790 N819 F889	Q790-I887 HydrophobicContact CG-CG2 3.66Å; N819-I887 WeakPolarHBondContact CA-O 3.41Å; N819-I887 PolarHBondContact N-O 2.88Å; N819-I887 PolarHBondContact OD1-N 3.06Å; I887-F889 HydrophobicContact CG2-CD2 4.27Å; I887-F889 HydrophobicContact CG2-CE1 4.4Å; I887-F889 HydrophobicContact CG2-CE2 3.71Å; I887-F889 HydrophobicContact CG2-CZ 3.78Å
888	W	93.2	Very high	86.1	Confident	13.5 Å²	13.5	44.8 Å²	44.8	5%	0.051	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	130.2	175.1	-74.8	82.5	0	0	0	110	Q790 W791 M816 R817 H818 D828 I829 L883 D884	Q790-W888 CarbonylContact C-O 3.5Å; Q790-W888 WeakPolarHBondContact CA-O 3.25Å; W791-W888 HydrophobicContact CB-CB 4.29Å; W791-W888 PolarHBondContact N-O 2.86Å; W791-W888 PolarHBondContact O-N 3.16Å; M816-W888 HydrophobicContact CB-CE3 4.29Å; R817-W888 VanDerWaalsContact C-CE3 3.46Å; R817-W888 CarbonylContact O-C 3.47Å; R817-W888 WeakPolarHBondContact O-CA 3.31Å; H818-W888 HydrophobicContact CB-CD2 4.31Å; H818-W888 HydrophobicContact CB-CE3 4.31Å; H818-W888 HydrophobicContact CB-CH2 3.94Å; H818-W888 HydrophobicContact CB-CZ2 3.92Å; H818-W888 HydrophobicContact CB-CZ3 4.14Å; H818-W888 AromaticContact CD2-CE2 3.57Å; H818-W888 AromaticContact CD2-CZ2 3.85Å; H818-W888 AromaticContact CD2-NE1 3.46Å; H818-W888 PolarHBondContact CD2-NE1 2.86Å; D828-W888 HydrophobicContact CB-CH2 4.47Å; D828-W888 HydrophobicContact CB-CZ3 4.19Å; I829-W888 HydrophobicContact CD1-CH2 4.43Å; I829-W888 HydrophobicContact CD1-CZ3 4.2Å; I829-W888 HydrophobicContact CG1-CZ3 4.49Å; L883-W888 HydrophobicContact CB-CD2 4.37Å; L883-W888 HydrophobicContact CB-CZ2 4.05Å; L883-W888 HydrophobicContact CD1-CB 4.43Å; L883-W888 HydrophobicContact CD1-CD2 4.07Å; L883-W888 HydrophobicContact CD1-CE3 4.45Å; L883-W888 HydrophobicContact CD1-CG 3.97Å; L883-W888 HydrophobicContact CD2-CD2 3.84Å; L883-W888 HydrophobicContact CD2-CE3 3.84Å; L883-W888 HydrophobicContact CD2-CH2 3.86Å; L883-W888 HydrophobicContact CD2-CZ2 3.86Å; L883-W888 HydrophobicContact CD2-CZ3 3.84Å; L883-W888 HydrophobicContact CG-CD2 4.33Å; L883-W888 HydrophobicContact CG-CZ2 4.45Å; D884-W888 HydrophobicContact CB-CZ2 4.4Å; D884-W888 PolarHBondContact O-NE1 3.16Å
889	F	92.8	Very high	86.3	Confident	33.5 Å²	33.5	51.2 Å²	51.2	15%	0.147	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	138.5	172.4	-65.2	-83.3	0	0	0	109.7	P768 Q790 M816 R817 T820 M821 I887	P768-F889 HydrophobicContact CG-CD1 4.24Å; P768-F889 HydrophobicContact CG-CE1 4.08Å; Q790-F889 HydrophobicContact CB-CD1 4.23Å; Q790-F889 HydrophobicContact CB-CE1 4.23Å; Q790-F889 HydrophobicContact CG-CD1 4.22Å; Q790-F889 HydrophobicContact CG-CE1 3.91Å; Q790-F889 HydrophobicContact CG-CZ 4.47Å; M816-F889 CarbonylContact C-O 3.53Å; M816-F889 VanDerWaalsContact CA-O 3.29Å; M816-F889 WeakPolarHBondContact CA-O 3.33Å; R817-F889 PolarHBondContact N-O 3.17Å; R817-F889 PolarHBondContact O-N 3Å; T820-F889 VanDerWaalsContact C-CD2 3.49Å; T820-F889 WeakPolarHBondContact O-CD2 3.13Å; M821-F889 HydrophobicContact CE-CD1 4.23Å; M821-F889 HydrophobicContact CE-CE1 4.33Å; M821-F889 HydrophobicContact CG-CB 4.19Å; M821-F889 HydrophobicContact CG-CD1 4.12Å; M821-F889 HydrophobicContact CG-CG 4.09Å; M821-F889 HydrophobicContact SD-CB 3.82Å; M821-F889 HydrophobicContact SD-CD1 3.88Å; M821-F889 VanDerWaalsContact SD-CD1 3.52Å; M821-F889 HydrophobicContact SD-CE1 4.35Å; M821-F889 HydrophobicContact SD-CG 4.04Å; I887-F889 HydrophobicContact CG2-CD2 4.27Å; I887-F889 HydrophobicContact CG2-CE1 4.4Å; I887-F889 HydrophobicContact CG2-CE2 3.71Å; I887-F889 HydrophobicContact CG2-CZ 3.78Å
890	L	92.1	Very high	86.6	Confident	2 Å²	2	47.4 Å²	47.4	1%	0.01	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	142.3	-178.4	151.4	73.6	0	0	0	109.8	L771 W787 S788 G789 V814 F815 M816 L892 F904 I906	L771-L890 HydrophobicContact CD1-CD1 4.16Å; L771-L890 HydrophobicContact CD1-CD2 3.78Å; L771-L890 HydrophobicContact CD1-CG 4.11Å; W787-L890 HydrophobicContact CZ3-CD1 3.72Å; W787-L890 HydrophobicContact CZ3-CD2 3.97Å; W787-L890 HydrophobicContact CZ3-CG 4.48Å; S788-L890 CarbonylContact C-O 3.6Å; S788-L890 WeakPolarHBondContact CA-O 3.36Å; G789-L890 PolarHBondContact N-O 3.17Å; G789-L890 PolarHBondContact O-N 3.13Å; V814-L890 HydrophobicContact CG1-CD1 3.64Å; F815-L890 CarbonylContact O-C 3.52Å; F815-L890 WeakPolarHBondContact O-CA 3.32Å; F815-L890 VanDerWaalsContact O-CB 3.31Å; F815-L890 WeakPolarHBondContact O-CB 3.45Å; M816-L890 HydrophobicContact CB-CB 4.23Å; M816-L890 HydrophobicContact CE-CD2 4.09Å; M816-L890 HydrophobicContact CG-CB 3.8Å; M816-L890 HydrophobicContact CG-CD1 3.71Å; M816-L890 HydrophobicContact SD-CB 4.42Å; M816-L890 HydrophobicContact SD-CD1 4.42Å; M816-L890 HydrophobicContact SD-CD2 4.18Å; L890-L892 HydrophobicContact CD1-CD2 4.31Å; L890-F904 HydrophobicContact CD1-CE1 4.33Å; L890-F904 HydrophobicContact CD1-CZ 4.35Å; L890-F904 HydrophobicContact CD2-CD1 4.35Å; L890-F904 HydrophobicContact CD2-CE1 3.7Å; L890-F904 HydrophobicContact CD2-CE2 4.19Å; L890-F904 HydrophobicContact CD2-CZ 3.58Å; L890-F904 VanDerWaalsContact CD2-CZ 3.46Å; L890-I906 HydrophobicContact CD2-CD1 4.03Å
891	A	91.1	Very high	87.1	Confident	0.5 Å²	0.5	48.3 Å²	48.3	0%	0.004	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	127.8	167.9	0	0	0	0	0	110.6	L761 F762 W787 F815 M821 P822	L761-A891 HydrophobicContact CB-CB 3.9Å; L761-A891 HydrophobicContact CD1-CB 4.01Å; L761-A891 HydrophobicContact CG-CB 4.44Å; F762-A891 HydrophobicContact CE1-CB 4.12Å; F762-A891 HydrophobicContact CZ-CB 4.08Å; W787-A891 CarbonylContact O-C 3.45Å; W787-A891 VanDerWaalsContact O-CA 3.29Å; W787-A891 WeakPolarHBondContact O-CA 3.3Å; F815-A891 HydrophobicContact CB-CB 4.44Å; F815-A891 PolarHBondContact N-O 2.98Å; F815-A891 PolarHBondContact O-N 3.26Å; M821-A891 HydrophobicContact CE-CB 4.24Å; P822-A891 HydrophobicContact CG-CB 3.97Å
892	L	91.7	Very high	87.5	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	132.7	168	-61	178.2	0	0	0	108.2	I779 L781 S786 W787 I803 G813 V814 L890 I902 F904	I779-L892 HydrophobicContact CD1-CD1 3.56Å; L781-L892 HydrophobicContact CD1-CB 4.17Å; L781-L892 HydrophobicContact CD2-CB 4.4Å; S786-L892 CarbonylContact C-O 3.49Å; S786-L892 WeakPolarHBondContact CA-O 3.32Å; S786-L892 VanDerWaalsContact CB-O 3.3Å; S786-L892 WeakPolarHBondContact CB-O 3.46Å; W787-L892 HydrophobicContact CE3-CB 4.27Å; W787-L892 HydrophobicContact CE3-CD1 3.75Å; W787-L892 HydrophobicContact CE3-CG 3.9Å; W787-L892 HydrophobicContact CZ3-CD1 3.99Å; W787-L892 HydrophobicContact CZ3-CG 4.23Å; W787-L892 PolarHBondContact N-O 3.17Å; W787-L892 PolarHBondContact O-N 2.88Å; I803-L892 HydrophobicContact CD1-CD2 3.99Å; G813-L892 CarbonylContact O-C 3.53Å; G813-L892 WeakPolarHBondContact O-CA 3.38Å; V814-L892 HydrophobicContact CB-CD2 4.13Å; V814-L892 HydrophobicContact CG1-CD2 3.83Å; V814-L892 HydrophobicContact CG2-CD2 3.69Å; L890-L892 HydrophobicContact CD1-CD2 4.31Å; L892-I902 HydrophobicContact CD1-CG2 4.48Å; L892-F904 HydrophobicContact CD1-CB 4.39Å; L892-F904 HydrophobicContact CD1-CD2 4.11Å; L892-F904 HydrophobicContact CD1-CG 4.32Å; L892-F904 HydrophobicContact CD2-CD2 4.18Å; L892-F904 HydrophobicContact CD2-CE2 4.13Å
893	V	89.1	Confident	87.9	Confident	21.25 Å²	21.25	45.9 Å²	45.9	13%	0.129	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	126.7	-173.7	-172.1	0	0	0	0	109.7	L761 V812 G813 F815 D895	L761-V893 HydrophobicContact CD1-CG2 3.96Å; L761-V893 HydrophobicContact CD2-CG1 4.25Å; L761-V893 HydrophobicContact CD2-CG2 3.57Å; L761-V893 HydrophobicContact CG-CG2 4.33Å; V812-V893 CarbonylContact C-O 3.53Å; V812-V893 VanDerWaalsContact CA-O 3.28Å; V812-V893 WeakPolarHBondContact CA-O 3.33Å; V812-V893 WeakPolarHBondContact CG1-O 3.38Å; G813-V893 PolarHBondContact N-O 3.23Å; G813-V893 PolarHBondContact O-N 3.08Å; F815-V893 HydrophobicContact CD2-CG2 3.7Å; F815-V893 HydrophobicContact CE2-CB 4.11Å; F815-V893 HydrophobicContact CE2-CG2 3.57Å; V893-D895 PolarHBondContact O-N 3.43Å
894	N	89.4	Confident	88.2	Confident	1.25 Å²	1.25	45.9 Å²	45.9	1%	0.007	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	108.3	177.9	178.7	15.2	0	0	0	110.4	L781 E782 M784 K785 Q896 R898	L781-N894 HydrophobicContact CB-CB 3.67Å; L781-N894 HydrophobicContact CD1-CB 3.78Å; L781-N894 HydrophobicContact CG-CB 4.35Å; E782-N894 PolarHBondContact O-ND2 3.4Å; M784-N894 VanDerWaalsContact CA-O 3.26Å; M784-N894 WeakPolarHBondContact CA-O 3.28Å; M784-N894 PolarHBondContact N-O 3.01Å; K785-N894 PolarHBondContact O-N 3.24Å; N894-Q896 VanDerWaalsContact C-N 3.26Å; N894-Q896 PolarHBondContact O-N 3.18Å; N894-Q896 VanDerWaalsContact O-N 3.16Å; N894-Q896 VanDerWaalsContact OD1-CB 3.29Å; N894-Q896 WeakPolarHBondContact OD1-CB 3.33Å; N894-Q896 PolarHBondContact OD1-N 3.08Å; N894-Q896 VanDerWaalsContact OD1-N 3.08Å; N894-Q896 PolarHBondContact OD1-O 3.01Å; N894-R898 PolarHBondContact ND2-O 3.17Å
895	D	80.6	Confident	88.5	Confident	60.5 Å²	60.5	42.5 Å²	42.5	32%	0.324	21%	0.213	S	C	.	.			trans	-82.1	7.2	179.9	76.4	16	0	0	0	112.8	M784 S811 R832 V893	M784-D895 WeakPolarHBondContact CE-O 3.33Å; S811-D895 WeakPolarHBondContact CB-OD1 3.17Å; S811-D895 VanDerWaalsContact CB-OD2 3.24Å; S811-D895 WeakPolarHBondContact CB-OD2 3.28Å; S811-D895 WeakPolarHBondContact O-CB 3.26Å; S811-D895 PolarHBondContact O-N 2.94Å; S811-D895 VanDerWaalsContact O-N 3.13Å; S811-D895 VanDerWaalsContact O-OD1 3.12Å; S811-D895 VanDerWaalsContact OG-CG 3.24Å; S811-D895 PolarHBondContact OG-OD1 3.42Å; S811-D895 PolarHBondContact OG-OD2 3.21Å; R832-D895 IonicContact CZ-OD2 3.57Å; R832-D895 IonicContact NE-OD2 3.69Å; R832-D895 PolarHBondContact NE-OD2 2.6Å; R832-D895 IonicContact NH2-OD2 3.36Å; R832-D895 PolarHBondContact NH2-OD2 2.99Å; V893-D895 PolarHBondContact O-N 3.43Å
896	Q	80	Confident	88.6	Confident	46.25 Å²	46.25	36.6 Å²	36.6	22%	0.216	19%	0.185	C	C	.	.	S	Bend	trans	-109.1	148.8	-176.8	-63.1	-76.5	-59.9	0	0	112.8	P783 M784 A809 N894 R898	P783-Q896 WeakPolarHBondContact CA-O 3.39Å; M784-Q896 PolarHBondContact N-O 3.14Å; A809-Q896 VanDerWaalsContact O-CD 3.32Å; A809-Q896 WeakPolarHBondContact O-CG 3.5Å; A809-Q896 PolarHBondContact O-NE2 3.09Å; A809-Q896 PolarHBondContact O-OE1 3.31Å; N894-Q896 VanDerWaalsContact C-N 3.26Å; N894-Q896 PolarHBondContact O-N 3.18Å; N894-Q896 VanDerWaalsContact O-N 3.16Å; N894-Q896 VanDerWaalsContact OD1-CB 3.29Å; N894-Q896 WeakPolarHBondContact OD1-CB 3.33Å; N894-Q896 PolarHBondContact OD1-N 3.08Å; N894-Q896 VanDerWaalsContact OD1-N 3.08Å; N894-Q896 PolarHBondContact OD1-O 3.01Å; Q896-R898 HydrophobicContact CB-CG 4.03Å; Q896-R898 PolarHBondContact O-N 3.06Å
897	P	78.2	Confident	88.5	Confident	106 Å²	106	35.7 Å²	35.7	69%	0.688	18%	0.176	S	C	*	.	S	Bend	trans	-78.5	28.1	177.1	34.6	-37.8	0	0	0	113.5
898	R	81.5	Confident	87.9	Confident	81.5 Å²	81.5	35.9 Å²	35.9	31%	0.308	18%	0.178	S	C	.	.	S	Bend	trans	-144.1	157.8	-177	64.4	-173.1	177.5	126.1	3	110.7	S806 S807 A809 S810 N894 Q896 E900	S806-R898 PolarHBondContact OG-NH2 3.46Å; S807-R898 VanDerWaalsContact OG-CZ 3.26Å; S807-R898 PolarHBondContact OG-NH1 2.94Å; S807-R898 PolarHBondContact OG-NH2 2.93Å; A809-R898 PolarHBondContact O-NH2 2.82Å; A809-R898 VanDerWaalsContact O-NH2 3.11Å; S810-R898 VanDerWaalsContact CA-NH2 3.3Å; S810-R898 VanDerWaalsContact N-NH2 3.13Å; S810-R898 PolarHBondContact OG-NH2 3.16Å; N894-R898 PolarHBondContact ND2-O 3.17Å; Q896-R898 HydrophobicContact CB-CG 4.03Å; Q896-R898 PolarHBondContact O-N 3.06Å; R898-E900 IonicContact CZ-OE2 3.8Å; R898-E900 IonicContact NE-OE2 2.86Å; R898-E900 PolarHBondContact NE-OE2 3.39Å; R898-E900 VanDerWaalsContact NE-OE2 3.14Å; R898-E900 IonicContact NH1-OE2 2.77Å; R898-E900 IonicContact NH2-OE1 3.78Å; R898-E900 IonicContact NH2-OE2 3.23Å; R898-E900 PolarHBondContact NH2-OE2 2.9Å
899	R	86.3	Confident	86.6	Confident	158.25 Å²	158.25	36.3 Å²	36.3	60%	0.597	18%	0.184	S	C	*	.			trans	-67.2	136.3	176.8	-72.7	178.7	171.2	-175	-9.4	111.2	L781 E782 P783	L781-R899 WeakPolarHBondContact O-CA 3.38Å; E782-R899 VanDerWaalsContact CD-NE 3.3Å; E782-R899 IonicContact OE1-CZ 3.22Å; E782-R899 VanDerWaalsContact OE1-CZ 3.27Å; E782-R899 IonicContact OE1-NE 2.73Å; E782-R899 PolarHBondContact OE1-NE 3.22Å; E782-R899 VanDerWaalsContact OE1-NE 3.13Å; E782-R899 IonicContact OE1-NH1 3.33Å; E782-R899 IonicContact OE1-NH2 3.09Å; E782-R899 PolarHBondContact OE1-NH2 3.13Å; E782-R899 WeakPolarHBondContact OE2-CG 3.32Å; E782-R899 IonicContact OE2-CZ 3.42Å; E782-R899 IonicContact OE2-NE 2.81Å; E782-R899 PolarHBondContact OE2-NE 2.95Å; E782-R899 IonicContact OE2-NH2 3.46Å; E782-R899 PolarHBondContact OE2-NH2 3Å; P783-R899 HydrophobicContact CG-CG 4.4Å
900	E	87.7	Confident	84.9	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	107.8	-179.3	-168.2	61.6	-127.8	0	0	110	L781 S806 S810 V812 R898 I902	L781-E900 HydrophobicContact CB-CB 4.47Å; L781-E900 PolarHBondContact N-O 2.94Å; L781-E900 PolarHBondContact O-N 3.08Å; S806-E900 VanDerWaalsContact CB-OE1 3.24Å; S806-E900 WeakPolarHBondContact CB-OE1 3.4Å; S806-E900 PolarHBondContact N-OE1 2.97Å; S806-E900 VanDerWaalsContact OG-CD 3.31Å; S806-E900 PolarHBondContact OG-OE1 2.9Å; S806-E900 PolarHBondContact OG-OE2 3.04Å; S810-E900 WeakPolarHBondContact CB-OE2 3.43Å; S810-E900 PolarHBondContact OG-OE1 3.02Å; S810-E900 VanDerWaalsContact OG-OE1 3.1Å; S810-E900 PolarHBondContact OG-OE2 2.97Å; V812-E900 HydrophobicContact CG2-CG 4.09Å; R898-E900 IonicContact CZ-OE2 3.8Å; R898-E900 IonicContact NE-OE2 2.86Å; R898-E900 PolarHBondContact NE-OE2 3.39Å; R898-E900 VanDerWaalsContact NE-OE2 3.14Å; R898-E900 IonicContact NH1-OE2 2.77Å; R898-E900 IonicContact NH2-OE1 3.78Å; R898-E900 IonicContact NH2-OE2 3.23Å; R898-E900 PolarHBondContact NH2-OE2 2.9Å; E900-I902 HydrophobicContact CG-CD1 4.31Å; E900-I902 HydrophobicContact CG-CG1 4.06Å; E900-I902 PolarHBondContact O-N 2.79Å
901	P	90.4	Very high	82.9	Confident	61 Å²	61	43 Å²	43	40%	0.396	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	117.9	176.1	31.6	-31.5	0	0	0	110.5
902	I	89.9	Confident	80.9	Confident	2.75 Å²	2.75	53.2 Å²	53.2	1%	0.014	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	135.6	-174	-63.1	-178.7	0	0	0	109.8	I779 L781 I803 T804 V812 L892 E900 F904	I779-I902 HydrophobicContact CB-CB 4.43Å; I779-I902 PolarHBondContact N-O 2.99Å; I779-I902 PolarHBondContact O-N 3.06Å; I779-I902 VanDerWaalsContact O-O 3.08Å; L781-I902 HydrophobicContact CD1-CD1 3.46Å; L781-I902 VanDerWaalsContact CD1-CD1 3.46Å; L781-I902 HydrophobicContact CG-CD1 3.97Å; I803-I902 HydrophobicContact CD1-CG2 4.04Å; I803-I902 HydrophobicContact CG1-CG2 3.58Å; T804-I902 WeakPolarHBondContact O-CA 3.18Å; V812-I902 HydrophobicContact CB-CD1 4.41Å; V812-I902 HydrophobicContact CG1-CD1 3.81Å; V812-I902 HydrophobicContact CG2-CD1 3.74Å; L892-I902 HydrophobicContact CD1-CG2 4.48Å; E900-I902 HydrophobicContact CG-CD1 4.31Å; E900-I902 HydrophobicContact CG-CG1 4.06Å; E900-I902 PolarHBondContact O-N 2.79Å; I902-F904 HydrophobicContact CG2-CB 4.36Å
903	K	91.5	Very high	78.9	Confident	86.25 Å²	86.25	64.6 Å²	64.6	38%	0.375	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	128.2	160	-47.4	-179.8	174.8	174.6	0	108	L776 V777 N778 I803 T804 L874	L776-K903 HydrophobicContact CD1-CB 4.1Å; L776-K903 HydrophobicContact CD1-CD 4.4Å; L776-K903 HydrophobicContact CD2-CB 4.18Å; L776-K903 HydrophobicContact CD2-CD 4.25Å; L776-K903 HydrophobicContact CD2-CG 4.43Å; L776-K903 HydrophobicContact CG-CB 4.21Å; V777-K903 WeakPolarHBondContact O-CA 3.45Å; N778-K903 WeakPolarHBondContact OD1-CG 3.38Å; I803-K903 CarbonylContact C-O 3.55Å; I803-K903 VanDerWaalsContact CA-O 3.31Å; I803-K903 WeakPolarHBondContact CA-O 3.27Å; T804-K903 HydrophobicContact CG2-CB 3.98Å; T804-K903 HydrophobicContact CG2-CD 4.46Å; T804-K903 PolarHBondContact N-O 2.71Å; T804-K903 WeakPolarHBondContact OG1-CA 3.25Å; T804-K903 WeakPolarHBondContact OG1-CB 3.39Å; T804-K903 WeakPolarHBondContact OG1-CG 3.28Å; T804-K903 PolarHBondContact OG1-N 3.18Å; T804-K903 PolarHBondContact OG1-O 3.08Å; T804-K903 VanDerWaalsContact OG1-O 3.12Å; L874-K903 HydrophobicContact CD1-CD 4.1Å; L874-K903 HydrophobicContact CD2-CD 4Å; L874-K903 HydrophobicContact CD2-CG 4.33Å
904	F	92.8	Very high	77.7	Confident	0.5 Å²	0.5	66 Å²	66	0%	0.002	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	138.6	-178.5	-174.1	-89.9	0	0	0	110.3	L771 V777 I779 Y801 N802 I803 M816 L890 L892 I902 I906	L771-F904 HydrophobicContact CD1-CE1 4.18Å; L771-F904 HydrophobicContact CD2-CD1 4.17Å; L771-F904 HydrophobicContact CD2-CE1 4.3Å; V777-F904 PolarHBondContact N-O 3.21Å; V777-F904 PolarHBondContact O-N 3.07Å; I779-F904 HydrophobicContact CD1-CB 3.92Å; Y801-F904 HydrophobicContact CD2-CD2 4.21Å; Y801-F904 AromaticContact CD2-CE2 3.4Å; Y801-F904 HydrophobicContact CD2-CE2 3.4Å; Y801-F904 VanDerWaalsContact CD2-CE2 3.43Å; Y801-F904 AromaticContact CD2-CZ 3.95Å; Y801-F904 HydrophobicContact CD2-CZ 3.95Å; Y801-F904 AromaticContact CE2-CE2 3.93Å; Y801-F904 HydrophobicContact CE2-CE2 3.93Å; Y801-F904 AromaticContact CG-CE2 3.92Å; Y801-F904 HydrophobicContact CG-CE2 3.92Å; Y801-F904 AromaticContact CG-CZ 3.94Å; Y801-F904 HydrophobicContact CG-CZ 3.98Å; N802-F904 WeakPolarHBondContact O-CA 3.24Å; I803-F904 HydrophobicContact CB-CD2 4.1Å; I803-F904 HydrophobicContact CD1-CD2 4.11Å; I803-F904 HydrophobicContact CG1-CD2 4.08Å; M816-F904 HydrophobicContact CE-CZ 4.5Å; L890-F904 HydrophobicContact CD1-CE1 4.33Å; L890-F904 HydrophobicContact CD1-CZ 4.35Å; L890-F904 HydrophobicContact CD2-CD1 4.35Å; L890-F904 HydrophobicContact CD2-CE1 3.7Å; L890-F904 HydrophobicContact CD2-CE2 4.19Å; L890-F904 HydrophobicContact CD2-CZ 3.58Å; L890-F904 VanDerWaalsContact CD2-CZ 3.46Å; L892-F904 HydrophobicContact CD1-CB 4.39Å; L892-F904 HydrophobicContact CD1-CD2 4.11Å; L892-F904 HydrophobicContact CD1-CG 4.32Å; L892-F904 HydrophobicContact CD2-CD2 4.18Å; L892-F904 HydrophobicContact CD2-CE2 4.13Å; I902-F904 HydrophobicContact CG2-CB 4.36Å; F904-I906 HydrophobicContact CE1-CB 4.02Å; F904-I906 HydrophobicContact CE1-CG2 4.14Å; F904-I906 HydrophobicContact CZ-CB 4.46Å
905	A	91.5	Very high	76.7	Confident	16 Å²	16	66.5 Å²	66.5	13%	0.132	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	147.8	173.1	0	0	0	0	0	109.8	K775 L776 Y801 N802	K775-A905 WeakPolarHBondContact O-CB 3.48Å; L776-A905 HydrophobicContact CB-CB 4.42Å; L776-A905 HydrophobicContact CD1-CB 4.45Å; Y801-A905 CarbonylContact C-O 3.48Å; Y801-A905 WeakPolarHBondContact CA-O 3.4Å; Y801-A905 WeakPolarHBondContact CB-O 3.41Å; N802-A905 PolarHBondContact N-O 2.91Å; N802-A905 PolarHBondContact O-N 3.1Å
906	I	91.1	Very high	76.2	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.005	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	138.8	-177.5	-174.5	165	0	0	0	110.3	L771 A773 N774 W791 I799 R800 M816 L890 F904	L771-I906 HydrophobicContact CB-CG2 3.99Å; L771-I906 HydrophobicContact CD1-CG2 4.15Å; L771-I906 HydrophobicContact CD2-CG2 4.32Å; L771-I906 HydrophobicContact CG-CG2 4.39Å; A773-I906 CarbonylContact C-O 3.55Å; A773-I906 WeakPolarHBondContact CA-O 3.24Å; N774-I906 PolarHBondContact N-O 3.07Å; W791-I906 HydrophobicContact CD2-CD1 4.3Å; W791-I906 HydrophobicContact CD2-CG1 4.38Å; W791-I906 HydrophobicContact CD2-CG2 4.18Å; W791-I906 HydrophobicContact CE3-CG2 3.63Å; W791-I906 HydrophobicContact CG-CD1 4.27Å; W791-I906 HydrophobicContact CH2-CG2 4.43Å; W791-I906 HydrophobicContact CZ3-CG2 3.77Å; I799-I906 HydrophobicContact CB-CG1 4.46Å; I799-I906 HydrophobicContact CD1-CD1 3.73Å; I799-I906 HydrophobicContact CD1-CG1 3.94Å; I799-I906 HydrophobicContact CG1-CD1 4.2Å; I799-I906 HydrophobicContact CG1-CG1 4.38Å; R800-I906 WeakPolarHBondContact O-CA 3.42Å; M816-I906 HydrophobicContact CE-CD1 4.18Å; L890-I906 HydrophobicContact CD2-CD1 4.03Å; F904-I906 HydrophobicContact CE1-CB 4.02Å; F904-I906 HydrophobicContact CE1-CG2 4.14Å; F904-I906 HydrophobicContact CZ-CB 4.46Å
907	G	86.9	Confident	75.6	Confident	0.25 Å²	0.25	67.8 Å²	67.8	0%	0.003	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179	-176.3	-177.4	0	0	0	0	0	114	I799 R800	I799-G907 CarbonylContact C-O 3.58Å; I799-G907 VanDerWaalsContact CA-O 3.28Å; I799-G907 WeakPolarHBondContact CA-O 3.41Å; I799-G907 VanDerWaalsContact CB-O 3.3Å; I799-G907 WeakPolarHBondContact CB-O 3.37Å; R800-G907 PolarHBondContact N-O 3.27Å; R800-G907 PolarHBondContact O-N 3.15Å; R800-G907 VanDerWaalsContact O-O 3.09Å
908	D	77.8	Confident	75.5	Confident	60.75 Å²	60.75	67.6 Å²	67.6	33%	0.325	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	135.9	-171.9	-63.8	-23.6	0	0	0	113.8	R797 V910	R797-D908 IonicContact CZ-OD1 3.39Å; R797-D908 VanDerWaalsContact CZ-OD1 3.27Å; R797-D908 IonicContact CZ-OD2 3.07Å; R797-D908 IonicContact NE-OD1 3.68Å; R797-D908 PolarHBondContact NE-OD1 3.02Å; R797-D908 IonicContact NE-OD2 2.71Å; R797-D908 IonicContact NH1-OD1 3.06Å; R797-D908 PolarHBondContact NH1-OD1 3.06Å; R797-D908 IonicContact NH1-OD2 2.72Å; R797-D908 PolarHBondContact NH1-OD2 3.22Å; R797-D908 IonicContact NH2-OD1 2.68Å; R797-D908 PolarHBondContact NH2-OD1 2.87Å; R797-D908 IonicContact NH2-OD2 3.32Å; R797-D908 PolarHBondContact NH2-OD2 2.86Å; D908-V910 VanDerWaalsContact C-N 3.28Å; D908-V910 HydrophobicContact CB-CG2 4.35Å; D908-V910 PolarHBondContact O-N 3Å
909	A	65.7	Low	75.1	Confident	23 Å²	23	63.8 Å²	63.8	19%	0.19	32%	0.317	C	S	.	.			trans	-80.8	93.4	176.3	0	0	0	0	0	112	Y798 R800 L880 M911	Y798-A909 VanDerWaalsContact O-CB 3.25Å; Y798-A909 WeakPolarHBondContact O-CB 3.22Å; Y798-A909 PolarHBondContact O-N 3.06Å; Y798-A909 VanDerWaalsContact O-N 3.08Å; R800-A909 HydrophobicContact CB-CB 4.43Å; L880-A909 HydrophobicContact CD1-CB 3.86Å; L880-A909 HydrophobicContact CD2-CB 4.22Å; L880-A909 HydrophobicContact CG-CB 4.13Å; A909-M911 VanDerWaalsContact C-N 3.34Å; A909-M911 PolarHBondContact O-N 2.96Å; A909-M911 VanDerWaalsContact O-N 3.14Å
910	V	57.1	Low	74.6	Confident	104.5 Å²	104.5	57.8 Å²	57.8	63%	0.633	30%	0.299	S	S	*	.			trans	-82	87.1	179.9	-173.7	0	0	0	0	111.3	D908 R912	D908-V910 VanDerWaalsContact C-N 3.28Å; D908-V910 HydrophobicContact CB-CG2 4.35Å; D908-V910 PolarHBondContact O-N 3Å; V910-R912 HydrophobicContact CG1-CG 4.16Å; V910-R912 PolarHBondContact O-N 3.19Å
911	M	51.2	Low	73.6	Confident	71 Å²	71	64.1 Å²	64.1	35%	0.35	33%	0.333	S	S	.	.			trans	-76.6	102	174	-72.5	-174.8	82.2	0	0	111.5	L880 A909 R913 G914 P916 D918 G928 V929	L880-M911 HydrophobicContact CD1-CE 4.43Å; L880-M911 HydrophobicContact CD2-CE 3.37Å; L880-M911 HydrophobicContact CD2-SD 4Å; A909-M911 VanDerWaalsContact C-N 3.34Å; A909-M911 PolarHBondContact O-N 2.96Å; A909-M911 VanDerWaalsContact O-N 3.14Å; M911-R913 PolarHBondContact O-N 3.33Å; M911-R913 VanDerWaalsContact O-N 3.17Å; M911-G914 WeakPolarHBondContact CE-O 3.22Å; M911-G914 VanDerWaalsContact SD-O 3.37Å; M911-P916 HydrophobicContact CE-CB 4.08Å; M911-P916 VanDerWaalsContact CE-CD 3.44Å; M911-P916 HydrophobicContact CE-CG 3.81Å; M911-P916 HydrophobicContact SD-CB 3.94Å; M911-P916 HydrophobicContact SD-CG 3.88Å; M911-D918 HydrophobicContact CE-CB 3.88Å; M911-G928 WeakPolarHBondContact CE-O 3.39Å; M911-V929 HydrophobicContact SD-CG2 3.68Å
912	R	48.5	Very low	72.7	Confident	215.25 Å²	215.25	65.8 Å²	65.8	81%	0.812	33%	0.331	S	S	*	.			trans	-91.2	73.1	179.9	-72.8	-177.7	175.4	-176.8	-0.1	112.3	V910 G914 C925	V910-R912 HydrophobicContact CG1-CG 4.16Å; V910-R912 PolarHBondContact O-N 3.19Å; R912-G914 VanDerWaalsContact C-N 3.32Å; R912-G914 PolarHBondContact O-N 2.96Å; R912-C925 PolarHBondContact O-SG 3.02Å
913	R	48.9	Very low	72	Confident	239.25 Å²	239.25	66.4 Å²	66.4	90%	0.903	34%	0.338	S	S	*	.	S	Bend	trans	67.6	115.1	173.9	-69.8	173.7	-177.6	-179.4	-0.8	112.3	M911	M911-R913 PolarHBondContact O-N 3.33Å; M911-R913 VanDerWaalsContact O-N 3.17Å
914	G	63.7	Low	71.1	Confident	50 Å²	50	65.3 Å²	65.3	52%	0.515	34%	0.338	S	S	.	.	S	Bend	trans	120.8	143.3	174.4	0	0	0	0	0	112.2	M911 R912	M911-G914 WeakPolarHBondContact CE-O 3.22Å; M911-G914 VanDerWaalsContact SD-O 3.37Å; R912-G914 VanDerWaalsContact C-N 3.32Å; R912-G914 PolarHBondContact O-N 2.96Å
915	C	69.8	Low	70.3	Confident	12.75 Å²	12.75	67.4 Å²	67.4	9%	0.086	35%	0.353	C	S	.	.			trans	-83.3	151	175.8	-62.4	0	0	0	0	111.6	N917 D918 C925 G928 V929 C930	C915-N917 PolarHBondContact O-N 3.1Å; C915-D918 PolarHBondContact O-N 2.94Å; C915-C925 HydrophobicContact CB-CB 3.75Å; C915-C925 WeakPolarHBondContact CB-SG 3.24Å; C915-C925 PolarHBondContact N-SG 3.32Å; C915-C925 WeakPolarHBondContact SG-CA 3.37Å; C915-C925 WeakPolarHBondContact SG-CB 3.27Å; C915-C925 CovalentContact SG-SG 2.03Å; C915-C925 PolarHBondContact SG-SG 3.27Å; C915-G928 VanDerWaalsContact SG-CA 3.51Å; C915-G928 WeakPolarHBondContact SG-CA 3.45Å; C915-V929 PolarHBondContact SG-N 3.18Å; C915-V929 VanDerWaalsContact SG-N 3.42Å; C915-V929 PolarHBondContact SG-O 2.76Å; C915-V929 VanDerWaalsContact SG-O 3.37Å; C915-C930 VanDerWaalsContact CB-SG 3.52Å
916	P	68.7	Low	69.4	Low	37.25 Å²	37.25	71.9 Å²	71.9	24%	0.242	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-63.3	136.7	176.5	12.1	-9.9	0	0	0	110.9	L880 M911 D918 C919 P939 D940	L880-P916 HydrophobicContact CD2-CB 3.79Å; M911-P916 HydrophobicContact CE-CB 4.08Å; M911-P916 VanDerWaalsContact CE-CD 3.44Å; M911-P916 HydrophobicContact CE-CG 3.81Å; M911-P916 HydrophobicContact SD-CB 3.94Å; M911-P916 HydrophobicContact SD-CG 3.88Å; P916-D918 PolarHBondContact O-N 3.32Å; P916-C919 PolarHBondContact O-N 3.16Å; P916-P939 HydrophobicContact CB-CB 4.29Å; P916-P939 WeakPolarHBondContact CB-O 3.25Å; P916-P939 WeakPolarHBondContact CD-O 3.36Å; P916-P939 HydrophobicContact CG-CB 4.19Å; P916-P939 VanDerWaalsContact CG-O 3.27Å; P916-P939 WeakPolarHBondContact CG-O 3.35Å; P916-D940 HydrophobicContact CB-CB 3.99Å; P916-D940 HydrophobicContact CG-CB 4.01Å; P916-D940 WeakPolarHBondContact O-CA 3.31Å; P916-D940 VanDerWaalsContact O-CB 3.23Å; P916-D940 WeakPolarHBondContact O-CB 3.36Å
917	N	68.8	Low	68.2	Low	96.75 Å²	96.75	75.6 Å²	75.6	52%	0.517	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	43.6	28.5	-177.5	-60.2	-28.2	0	0	0	116	L880 C915 C919 S920 D940	L880-N917 VanDerWaalsContact CD2-OD1 3.27Å; L880-N917 WeakPolarHBondContact CD2-OD1 3.49Å; C915-N917 PolarHBondContact O-N 3.1Å; N917-C919 PolarHBondContact O-N 3.11Å; N917-C919 VanDerWaalsContact O-N 3.15Å; N917-S920 WeakPolarHBondContact O-CA 3.14Å; N917-S920 PolarHBondContact O-N 3.25Å; N917-D940 HydrophobicContact CB-CB 4.04Å; N917-D940 PolarHBondContact ND2-OD2 2.95Å
918	D	75.5	Confident	67.4	Low	102.5 Å²	102.5	76.6 Å²	76.6	55%	0.548	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	46.7	42.6	-171.9	-130.5	4.8	0	0	0	112.7	M911 C915 P916 S920 N921	M911-D918 HydrophobicContact CE-CB 3.88Å; C915-D918 PolarHBondContact O-N 2.94Å; P916-D918 PolarHBondContact O-N 3.32Å; D918-S920 PolarHBondContact O-N 2.92Å; D918-S920 VanDerWaalsContact O-N 3.14Å; D918-N921 PolarHBondContact O-N 2.94Å
919	C	73.7	Confident	67.2	Low	0.5 Å²	0.5	77.5 Å²	77.5	0%	0.003	43%	0.431	C	S	.	.	G	3₁₀ helix	trans	56.2	26.7	-176.5	-51.1	0	0	0	0	114.4	P916 N917 N921 R922 G923 C925 C930 D940 C941	P916-C919 PolarHBondContact O-N 3.16Å; N917-C919 PolarHBondContact O-N 3.11Å; N917-C919 VanDerWaalsContact O-N 3.15Å; C919-N921 PolarHBondContact O-N 3.33Å; C919-R922 CarbonylContact O-C 3.51Å; C919-R922 WeakPolarHBondContact O-CA 3.43Å; C919-R922 PolarHBondContact O-N 2.95Å; C919-G923 WeakPolarHBondContact CB-O 3.11Å; C919-G923 PolarHBondContact O-N 3.38Å; C919-C925 VanDerWaalsContact SG-CA 3.57Å; C919-C925 PolarHBondContact SG-N 3.07Å; C919-C930 WeakPolarHBondContact CA-SG 3.35Å; C919-C930 HydrophobicContact CB-CB 3.68Å; C919-C930 WeakPolarHBondContact CB-SG 3.28Å; C919-C930 VanDerWaalsContact SG-CA 3.56Å; C919-C930 WeakPolarHBondContact SG-CA 3.1Å; C919-C930 WeakPolarHBondContact SG-CB 3.21Å; C919-C930 CovalentContact SG-SG 2.03Å; C919-C930 PolarHBondContact SG-SG 3.28Å; C919-D940 CarbonylContact C-O 3.5Å; C919-D940 VanDerWaalsContact CA-O 3.24Å; C919-D940 WeakPolarHBondContact CA-O 3.23Å; C919-D940 VanDerWaalsContact O-O 3.12Å; C919-C941 WeakPolarHBondContact O-CB 3.45Å
920	S	75.6	Confident	67.8	Low	32.25 Å²	32.25	77 Å²	77	23%	0.226	43%	0.426	C	S	.	.	G	3₁₀ helix	trans	54.1	18.9	-177.8	-54	0	0	0	0	114.3	N917 D918 R922 D940 S942	N917-S920 WeakPolarHBondContact O-CA 3.14Å; N917-S920 PolarHBondContact O-N 3.25Å; D918-S920 PolarHBondContact O-N 2.92Å; D918-S920 VanDerWaalsContact O-N 3.14Å; S920-R922 PolarHBondContact O-N 2.97Å; S920-D940 VanDerWaalsContact CB-O 3.25Å; S920-D940 WeakPolarHBondContact CB-O 3.33Å; S920-D940 PolarHBondContact N-O 3.26Å; S920-D940 VanDerWaalsContact N-O 3.16Å; S920-D940 PolarHBondContact OG-O 3.04Å; S920-S942 WeakPolarHBondContact OG-CA 3.37Å; S920-S942 WeakPolarHBondContact OG-CB 3.42Å; S920-S942 PolarHBondContact OG-N 3.05Å
921	N	66.9	Low	68.8	Low	133.25 Å²	133.25	76.2 Å²	76.2	71%	0.713	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	56	25.5	-164.9	-53	-82.3	0	0	0	114.2	D918 C919	D918-N921 PolarHBondContact O-N 2.94Å; C919-N921 PolarHBondContact O-N 3.33Å
922	R	70.9	Confident	70.1	Confident	95 Å²	95	74.5 Å²	74.5	36%	0.358	41%	0.412	S	S	.	.	S	Bend	trans	-125.8	19.2	-177.6	-65.7	175.2	-175.5	-160.9	-2.6	112.8	C919 S920 V933 F936 C941 E1304	C919-R922 CarbonylContact O-C 3.51Å; C919-R922 WeakPolarHBondContact O-CA 3.43Å; C919-R922 PolarHBondContact O-N 2.95Å; S920-R922 PolarHBondContact O-N 2.97Å; R922-V933 HydrophobicContact CB-CG2 4.47Å; R922-V933 WeakPolarHBondContact O-CB 3.41Å; R922-V933 WeakPolarHBondContact O-CG2 3.48Å; R922-V933 PolarHBondContact O-N 3.06Å; R922-V933 VanDerWaalsContact O-N 3.1Å; R922-F936 HydrophobicContact CB-CB 4.45Å; R922-F936 HydrophobicContact CB-CD1 4.49Å; R922-F936 HydrophobicContact CB-CD2 4.29Å; R922-F936 HydrophobicContact CB-CE2 4.42Å; R922-F936 HydrophobicContact CB-CG 4.25Å; R922-F936 HydrophobicContact CG-CD2 4.38Å; R922-F936 HydrophobicContact CG-CE2 4.31Å; R922-F936 HydrophobicContact CG-CG 4.42Å; R922-F936 VanDerWaalsContact CZ-CZ 3.45Å; R922-C941 HydrophobicContact CB-CB 3.84Å; R922-C941 WeakPolarHBondContact CD-O 3.48Å; R922-C941 VanDerWaalsContact O-CB 3.31Å; R922-C941 WeakPolarHBondContact O-CB 3.38Å; R922-E1304 VanDerWaalsContact CZ-CD 3.41Å; R922-E1304 IonicContact CZ-OE1 2.97Å; R922-E1304 IonicContact CZ-OE2 3.73Å; R922-E1304 VanDerWaalsContact CZ-OE2 3.32Å; R922-E1304 IonicContact NE-OE1 3.06Å; R922-E1304 IonicContact NH1-OE1 3.07Å; R922-E1304 PolarHBondContact NH1-OE1 2.82Å; R922-E1304 IonicContact NH1-OE2 3.98Å; R922-E1304 PolarHBondContact NH1-OE2 2.85Å; R922-E1304 IonicContact NH2-OE1 3.45Å; R922-E1304 PolarHBondContact NH2-OE1 2.68Å; R922-E1304 IonicContact NH2-OE2 3.86Å; R922-E1304 PolarHBondContact NH2-OE2 3.45Å
923	G	75.3	Confident	71	Confident	15.75 Å²	15.75	67.4 Å²	67.4	16%	0.162	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.2	170.6	175.4	0	0	0	0	0	111.9	C919 D931	C919-G923 WeakPolarHBondContact CB-O 3.11Å; C919-G923 PolarHBondContact O-N 3.38Å; G923-D931 CarbonylContact C-O 3.48Å; G923-D931 WeakPolarHBondContact CA-O 3.38Å
924	V	73.4	Confident	71.6	Confident	62.75 Å²	62.75	62.2 Å²	62.2	38%	0.38	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	128	175.5	-177.5	0	0	0	0	109.1	L880 D926 D931	L880-V924 HydrophobicContact CD1-CG2 3.67Å; V924-D926 PolarHBondContact O-N 3.1Å; V924-D931 HydrophobicContact CB-CB 4.48Å; V924-D931 PolarHBondContact N-O 2.86Å; V924-D931 WeakPolarHBondContact O-CB 3.28Å; V924-D931 PolarHBondContact O-N 3.21Å
925	C	76	Confident	71.4	Confident	45 Å²	45	61.1 Å²	61.1	30%	0.304	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	115	175.2	179.4	0	0	0	0	111	R912 C915 C919	R912-C925 PolarHBondContact O-SG 3.02Å; C915-C925 HydrophobicContact CB-CB 3.75Å; C915-C925 WeakPolarHBondContact CB-SG 3.24Å; C915-C925 PolarHBondContact N-SG 3.32Å; C915-C925 WeakPolarHBondContact SG-CA 3.37Å; C915-C925 WeakPolarHBondContact SG-CB 3.27Å; C915-C925 CovalentContact SG-SG 2.03Å; C915-C925 PolarHBondContact SG-SG 3.27Å; C919-C925 VanDerWaalsContact SG-CA 3.57Å; C919-C925 PolarHBondContact SG-N 3.07Å
926	D	71.5	Confident	71.4	Confident	112 Å²	112	62.8 Å²	62.8	60%	0.599	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.5	130.2	170.7	-172.8	20.8	0	0	0	111.1	R844 V924 G928 V929	R844-D926 IonicContact NH2-OD2 2.82Å; R844-D926 PolarHBondContact NH2-OD2 2.86Å; V924-D926 PolarHBondContact O-N 3.1Å; D926-G928 PolarHBondContact O-N 3.18Å; D926-V929 PolarHBondContact N-O 3.12Å; D926-V929 PolarHBondContact O-N 3.24Å; D926-V929 VanDerWaalsContact O-O 3.04Å
927	G	65.1	Low	71.7	Confident	78.5 Å²	78.5	65.3 Å²	65.3	81%	0.809	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.2	-2	179.3	0	0	0	0	0	117.4
928	G	71	Confident	71.9	Confident	20.75 Å²	20.75	61.8 Å²	61.8	21%	0.214	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	104.8	5	-168.1	0	0	0	0	0	114.4	M911 C915 D926	M911-G928 WeakPolarHBondContact CE-O 3.39Å; C915-G928 VanDerWaalsContact SG-CA 3.51Å; C915-G928 WeakPolarHBondContact SG-CA 3.45Å; D926-G928 PolarHBondContact O-N 3.18Å
929	V	73.4	Confident	71.8	Confident	80.5 Å²	80.5	60.4 Å²	60.4	49%	0.488	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	147	173.8	-174	0	0	0	0	109.3	Y798 M911 C915 D926	Y798-V929 HydrophobicContact CD1-CG1 3.91Å; Y798-V929 HydrophobicContact CD1-CG2 4.46Å; Y798-V929 HydrophobicContact CD2-CB 3.83Å; Y798-V929 HydrophobicContact CD2-CG1 4.11Å; Y798-V929 HydrophobicContact CD2-CG2 3.37Å; Y798-V929 HydrophobicContact CE1-CB 4.22Å; Y798-V929 HydrophobicContact CE1-CG1 3.58Å; Y798-V929 HydrophobicContact CE2-CB 3.46Å; Y798-V929 VanDerWaalsContact CE2-CB 3.46Å; Y798-V929 HydrophobicContact CE2-CG1 3.8Å; Y798-V929 HydrophobicContact CE2-CG2 3.57Å; Y798-V929 HydrophobicContact CG-CB 4.35Å; Y798-V929 HydrophobicContact CG-CG1 4.16Å; Y798-V929 HydrophobicContact CG-CG2 3.86Å; M911-V929 HydrophobicContact SD-CG2 3.68Å; C915-V929 PolarHBondContact SG-N 3.18Å; C915-V929 VanDerWaalsContact SG-N 3.42Å; C915-V929 PolarHBondContact SG-O 2.76Å; C915-V929 VanDerWaalsContact SG-O 3.37Å; D926-V929 PolarHBondContact N-O 3.12Å; D926-V929 PolarHBondContact O-N 3.24Å; D926-V929 VanDerWaalsContact O-O 3.04Å
930	C	78	Confident	72.2	Confident	11.75 Å²	11.75	60.9 Å²	60.9	8%	0.079	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	123.6	177.6	-66	0	0	0	0	112.2	C915 C919 C932 P939 C941	C915-C930 VanDerWaalsContact CB-SG 3.52Å; C919-C930 WeakPolarHBondContact CA-SG 3.35Å; C919-C930 HydrophobicContact CB-CB 3.68Å; C919-C930 WeakPolarHBondContact CB-SG 3.28Å; C919-C930 VanDerWaalsContact SG-CA 3.56Å; C919-C930 WeakPolarHBondContact SG-CA 3.1Å; C919-C930 WeakPolarHBondContact SG-CB 3.21Å; C919-C930 CovalentContact SG-SG 2.03Å; C919-C930 PolarHBondContact SG-SG 3.28Å; C930-C932 PolarHBondContact O-N 2.74Å; C930-P939 VanDerWaalsContact CB-O 3.3Å; C930-P939 WeakPolarHBondContact CB-O 3.27Å; C930-P939 PolarHBondContact SG-O 3.04Å; C930-P939 VanDerWaalsContact SG-O 3.35Å; C930-C941 VanDerWaalsContact CB-SG 3.55Å; C930-C941 WeakPolarHBondContact CB-SG 3.27Å
931	D	79.4	Confident	72.3	Confident	87.75 Å²	87.75	59.3 Å²	59.3	47%	0.469	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	100.7	169.1	-167.4	32.9	0	0	0	108.3	R800 G923 V924 L1744 R1746	R800-D931 IonicContact NH1-OD2 3.41Å; G923-D931 CarbonylContact C-O 3.48Å; G923-D931 WeakPolarHBondContact CA-O 3.38Å; V924-D931 HydrophobicContact CB-CB 4.48Å; V924-D931 PolarHBondContact N-O 2.86Å; V924-D931 WeakPolarHBondContact O-CB 3.28Å; V924-D931 PolarHBondContact O-N 3.21Å; D931-L1744 WeakPolarHBondContact OD2-CD1 3.44Å; D931-R1746 IonicContact OD1-CZ 3.43Å; D931-R1746 IonicContact OD1-NE 3.34Å; D931-R1746 IonicContact OD1-NH2 3.21Å; D931-R1746 PolarHBondContact OD1-NH2 2.86Å
932	C	77.9	Confident	72.7	Confident	34 Å²	34	55.8 Å²	55.8	23%	0.23	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	145.4	-166.6	-58.8	0	0	0	0	113.5	C930 F936 G938 C941	C930-C932 PolarHBondContact O-N 2.74Å; C932-F936 HydrophobicContact CB-CB 4.3Å; C932-F936 VanDerWaalsContact CB-O 3.22Å; C932-F936 WeakPolarHBondContact CB-O 3.19Å; C932-G938 PolarHBondContact SG-O 3.47Å; C932-C941 WeakPolarHBondContact CA-SG 3.33Å; C932-C941 HydrophobicContact CB-CB 3.8Å; C932-C941 WeakPolarHBondContact CB-SG 3.27Å; C932-C941 WeakPolarHBondContact SG-CA 3.37Å; C932-C941 WeakPolarHBondContact SG-CB 3.34Å; C932-C941 CovalentContact SG-SG 2.04Å; C932-C941 PolarHBondContact SG-SG 3.04Å
933	V	67.9	Low	72.7	Confident	67.75 Å²	67.75	55.2 Å²	55.2	41%	0.411	35%	0.349	S	S	.	.			trans	-69.1	139.3	171	-137.7	0	0	0	0	110.2	R922 G935 F936	R922-V933 HydrophobicContact CB-CG2 4.47Å; R922-V933 WeakPolarHBondContact O-CB 3.41Å; R922-V933 WeakPolarHBondContact O-CG2 3.48Å; R922-V933 PolarHBondContact O-N 3.06Å; R922-V933 VanDerWaalsContact O-N 3.1Å; V933-G935 PolarHBondContact O-N 3.14Å; V933-G935 VanDerWaalsContact O-N 3.16Å; V933-F936 HydrophobicContact CG2-CD2 4.43Å; V933-F936 PolarHBondContact O-N 3.18Å
934	N	61.4	Low	71.7	Confident	130.25 Å²	130.25	56.6 Å²	56.6	70%	0.697	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.4	124.5	-179.5	-72.3	-36.2	0	0	0	112.2	T877 R1302	T877-N934 PolarHBondContact OG1-ND2 2.8Å; T877-N934 VanDerWaalsContact OG1-ND2 3.16Å; N934-R1302 HydrophobicContact CB-CG 4.48Å
935	G	58.8	Low	70.9	Confident	26.5 Å²	26.5	57.6 Å²	57.6	27%	0.273	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	100.4	-1.3	-171.5	0	0	0	0	0	114.3	V933 A944 E945	V933-G935 PolarHBondContact O-N 3.14Å; V933-G935 VanDerWaalsContact O-N 3.16Å; G935-A944 CarbonylContact O-C 3.54Å; G935-A944 WeakPolarHBondContact O-CA 3.37Å; G935-E945 VanDerWaalsContact C-CB 3.45Å; G935-E945 CarbonylContact C-O 3.57Å; G935-E945 VanDerWaalsContact CA-O 3.26Å; G935-E945 WeakPolarHBondContact CA-O 3.38Å; G935-E945 CarbonylContact O-C 3.57Å; G935-E945 WeakPolarHBondContact O-CA 3.27Å; G935-E945 PolarHBondContact O-N 3.13Å
936	F	69.6	Low	69.6	Low	48 Å²	48	61.3 Å²	61.3	21%	0.211	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	146.4	171.8	-62.3	-75	0	0	0	112.4	R922 C932 V933 C941 I943 A944 E1304	R922-F936 HydrophobicContact CB-CB 4.45Å; R922-F936 HydrophobicContact CB-CD1 4.49Å; R922-F936 HydrophobicContact CB-CD2 4.29Å; R922-F936 HydrophobicContact CB-CE2 4.42Å; R922-F936 HydrophobicContact CB-CG 4.25Å; R922-F936 HydrophobicContact CG-CD2 4.38Å; R922-F936 HydrophobicContact CG-CE2 4.31Å; R922-F936 HydrophobicContact CG-CG 4.42Å; R922-F936 VanDerWaalsContact CZ-CZ 3.45Å; C932-F936 HydrophobicContact CB-CB 4.3Å; C932-F936 VanDerWaalsContact CB-O 3.22Å; C932-F936 WeakPolarHBondContact CB-O 3.19Å; V933-F936 HydrophobicContact CG2-CD2 4.43Å; V933-F936 PolarHBondContact O-N 3.18Å; F936-C941 HydrophobicContact CB-CB 4.28Å; F936-I943 CarbonylContact C-O 3.52Å; F936-I943 WeakPolarHBondContact CA-O 3.38Å; F936-A944 HydrophobicContact CD1-CB 4.32Å; F936-A944 HydrophobicContact CE1-CB 4.06Å; F936-E1304 WeakPolarHBondContact CE1-OE1 3.17Å; F936-E1304 HydrophobicContact CZ-CG 4.3Å; F936-E1304 WeakPolarHBondContact CZ-OE1 3.3Å
937	K	75.3	Confident	68.6	Low	88.75 Å²	88.75	59.4 Å²	59.4	39%	0.386	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	-175.3	178.6	47.4	-176.3	172	-141.8	0	111.1	C941 S942 I943 E945	K937-C941 CarbonylContact O-C 3.36Å; K937-C941 VanDerWaalsContact O-CA 3.3Å; K937-C941 WeakPolarHBondContact O-CA 3.3Å; K937-S942 PolarHBondContact O-N 2.77Å; K937-I943 HydrophobicContact CB-CB 4.5Å; K937-I943 HydrophobicContact CG-CB 4.12Å; K937-I943 HydrophobicContact CG-CG2 4.19Å; K937-I943 PolarHBondContact N-O 2.98Å; K937-I943 VanDerWaalsContact O-CB 3.32Å; K937-I943 WeakPolarHBondContact O-CB 3.42Å; K937-I943 PolarHBondContact O-N 3.16Å; K937-E945 HydrophobicContact CB-CB 4.49Å; K937-E945 HydrophobicContact CD-CB 4.15Å; K937-E945 HydrophobicContact CD-CG 4.33Å; K937-E945 VanDerWaalsContact CD-OE1 3.29Å; K937-E945 WeakPolarHBondContact CD-OE1 3.43Å; K937-E945 WeakPolarHBondContact CE-OE1 3.29Å; K937-E945 WeakPolarHBondContact CE-OE2 3.42Å; K937-E945 HydrophobicContact CG-CB 4.08Å; K937-E945 HydrophobicContact CG-CG 4.36Å; K937-E945 VanDerWaalsContact CG-OE2 3.29Å; K937-E945 WeakPolarHBondContact CG-OE2 3.03Å; K937-E945 IonicContact NZ-OE1 3.22Å; K937-E945 PolarHBondContact NZ-OE1 2.94Å; K937-E945 IonicContact NZ-OE2 3.52Å; K937-E945 PolarHBondContact NZ-OE2 2.85Å
938	G	72.4	Confident	68.1	Low	24.5 Å²	24.5	62.2 Å²	62.2	25%	0.253	36%	0.359	S	S	.	.	S	Bend	trans	92.2	161.9	-173.1	0	0	0	0	0	111.2	C932 D940 C941	C932-G938 PolarHBondContact SG-O 3.47Å; G938-D940 PolarHBondContact O-N 3.07Å; G938-D940 VanDerWaalsContact O-N 3.12Å; G938-C941 PolarHBondContact O-N 3.17Å; G938-C941 VanDerWaalsContact O-N 3.15Å
939	P	75.1	Confident	67.9	Low	73 Å²	73	63.7 Å²	63.7	47%	0.474	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-11.8	-172.7	22.5	-24.6	0	0	0	113.5	Y882 P916 C930	Y882-P939 HydrophobicContact CD2-CG 3.39Å; Y882-P939 HydrophobicContact CE2-CG 3.42Å; Y882-P939 VanDerWaalsContact CE2-CG 3.42Å; Y882-P939 HydrophobicContact CG-CG 4.29Å; P916-P939 HydrophobicContact CB-CB 4.29Å; P916-P939 WeakPolarHBondContact CB-O 3.25Å; P916-P939 WeakPolarHBondContact CD-O 3.36Å; P916-P939 HydrophobicContact CG-CB 4.19Å; P916-P939 VanDerWaalsContact CG-O 3.27Å; P916-P939 WeakPolarHBondContact CG-O 3.35Å; C930-P939 VanDerWaalsContact CB-O 3.3Å; C930-P939 WeakPolarHBondContact CB-O 3.27Å; C930-P939 PolarHBondContact SG-O 3.04Å; C930-P939 VanDerWaalsContact SG-O 3.35Å
940	D	81.6	Confident	67.9	Low	10.25 Å²	10.25	59.9 Å²	59.9	6%	0.055	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.2	14.4	177.2	68.6	-16.6	0	0	0	113.1	P916 N917 C919 S920 G938 S942	P916-D940 HydrophobicContact CB-CB 3.99Å; P916-D940 HydrophobicContact CG-CB 4.01Å; P916-D940 WeakPolarHBondContact O-CA 3.31Å; P916-D940 VanDerWaalsContact O-CB 3.23Å; P916-D940 WeakPolarHBondContact O-CB 3.36Å; N917-D940 HydrophobicContact CB-CB 4.04Å; N917-D940 PolarHBondContact ND2-OD2 2.95Å; C919-D940 CarbonylContact C-O 3.5Å; C919-D940 VanDerWaalsContact CA-O 3.24Å; C919-D940 WeakPolarHBondContact CA-O 3.23Å; C919-D940 VanDerWaalsContact O-O 3.12Å; S920-D940 VanDerWaalsContact CB-O 3.25Å; S920-D940 WeakPolarHBondContact CB-O 3.33Å; S920-D940 PolarHBondContact N-O 3.26Å; S920-D940 VanDerWaalsContact N-O 3.16Å; S920-D940 PolarHBondContact OG-O 3.04Å; G938-D940 PolarHBondContact O-N 3.07Å; G938-D940 VanDerWaalsContact O-N 3.12Å; D940-S942 PolarHBondContact O-N 3.36Å; D940-S942 VanDerWaalsContact O-N 3.11Å; D940-S942 VanDerWaalsContact OD1-CB 3.26Å; D940-S942 WeakPolarHBondContact OD1-CB 3.32Å; D940-S942 PolarHBondContact OD1-N 2.69Å; D940-S942 PolarHBondContact OD1-OG 3.07Å; D940-S942 VanDerWaalsContact OD2-CB 3.23Å; D940-S942 WeakPolarHBondContact OD2-CB 3.05Å; D940-S942 PolarHBondContact OD2-OG 2.92Å; D940-S942 VanDerWaalsContact OD2-OG 3.08Å
941	C	77.8	Confident	67.9	Low	0 Å²	0	61.2 Å²	61.2	0%	0	35%	0.35	C	S	.	.	S	Bend	trans	55.8	20.2	-177.4	-44.4	0	0	0	0	115.9	C919 R922 C930 C932 F936 K937 G938 I943	C919-C941 WeakPolarHBondContact O-CB 3.45Å; R922-C941 HydrophobicContact CB-CB 3.84Å; R922-C941 WeakPolarHBondContact CD-O 3.48Å; R922-C941 VanDerWaalsContact O-CB 3.31Å; R922-C941 WeakPolarHBondContact O-CB 3.38Å; C930-C941 VanDerWaalsContact CB-SG 3.55Å; C930-C941 WeakPolarHBondContact CB-SG 3.27Å; C932-C941 WeakPolarHBondContact CA-SG 3.33Å; C932-C941 HydrophobicContact CB-CB 3.8Å; C932-C941 WeakPolarHBondContact CB-SG 3.27Å; C932-C941 WeakPolarHBondContact SG-CA 3.37Å; C932-C941 WeakPolarHBondContact SG-CB 3.34Å; C932-C941 CovalentContact SG-SG 2.04Å; C932-C941 PolarHBondContact SG-SG 3.04Å; F936-C941 HydrophobicContact CB-CB 4.28Å; K937-C941 CarbonylContact O-C 3.36Å; K937-C941 VanDerWaalsContact O-CA 3.3Å; K937-C941 WeakPolarHBondContact O-CA 3.3Å; G938-C941 PolarHBondContact O-N 3.17Å; G938-C941 VanDerWaalsContact O-N 3.15Å; C941-I943 VanDerWaalsContact C-N 3.29Å; C941-I943 PolarHBondContact O-N 2.72Å
942	S	75.4	Confident	67.6	Low	59.5 Å²	59.5	58.7 Å²	58.7	42%	0.416	35%	0.345	S	S	.	.			trans	-73.2	-26.5	177.7	58.3	0	0	0	0	113.5	S920 K937 D940 A944	S920-S942 WeakPolarHBondContact OG-CA 3.37Å; S920-S942 WeakPolarHBondContact OG-CB 3.42Å; S920-S942 PolarHBondContact OG-N 3.05Å; K937-S942 PolarHBondContact O-N 2.77Å; D940-S942 PolarHBondContact O-N 3.36Å; D940-S942 VanDerWaalsContact O-N 3.11Å; D940-S942 VanDerWaalsContact OD1-CB 3.26Å; D940-S942 WeakPolarHBondContact OD1-CB 3.32Å; D940-S942 PolarHBondContact OD1-N 2.69Å; D940-S942 PolarHBondContact OD1-OG 3.07Å; D940-S942 VanDerWaalsContact OD2-CB 3.23Å; D940-S942 WeakPolarHBondContact OD2-CB 3.05Å; D940-S942 PolarHBondContact OD2-OG 2.92Å; D940-S942 VanDerWaalsContact OD2-OG 3.08Å; S942-A944 PolarHBondContact O-N 2.04Å
943	I	69.8	Low	67.6	Low	82.5 Å²	82.5	59.5 Å²	59.5	42%	0.423	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	117	-173.1	-49.4	176.7	0	0	0	108.8	Y882 F936 K937 C941 E945	Y882-I943 HydrophobicContact CD1-CD1 4.12Å; F936-I943 CarbonylContact C-O 3.52Å; F936-I943 WeakPolarHBondContact CA-O 3.38Å; K937-I943 HydrophobicContact CB-CB 4.5Å; K937-I943 HydrophobicContact CG-CB 4.12Å; K937-I943 HydrophobicContact CG-CG2 4.19Å; K937-I943 PolarHBondContact N-O 2.98Å; K937-I943 VanDerWaalsContact O-CB 3.32Å; K937-I943 WeakPolarHBondContact O-CB 3.42Å; K937-I943 PolarHBondContact O-N 3.16Å; C941-I943 VanDerWaalsContact C-N 3.29Å; C941-I943 PolarHBondContact O-N 2.72Å; I943-E945 PolarHBondContact O-N 3.08Å
944	A	56	Low	68.1	Low	43.75 Å²	43.75	56.7 Å²	56.7	36%	0.362	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	128.8	169.3	0	0	0	0	0	110.3	G935 F936 S942 L946	G935-A944 CarbonylContact O-C 3.54Å; G935-A944 WeakPolarHBondContact O-CA 3.37Å; F936-A944 HydrophobicContact CD1-CB 4.32Å; F936-A944 HydrophobicContact CE1-CB 4.06Å; S942-A944 PolarHBondContact O-N 2.04Å; A944-L946 HydrophobicContact CB-CD1 4.41Å; A944-L946 HydrophobicContact CB-CD2 4.46Å; A944-L946 HydrophobicContact CB-CG 4.48Å; A944-L946 PolarHBondContact O-N 3.11Å; A944-L946 VanDerWaalsContact O-N 3.12Å
945	E	55.3	Low	68.6	Low	84.5 Å²	84.5	53.5 Å²	53.5	40%	0.395	31%	0.313	S	S	.	.			trans	-83.8	89.1	167.2	-177	146.4	-125.2	0	0	108.8	G935 K937 I943 P947 Y1279	G935-E945 VanDerWaalsContact C-CB 3.45Å; G935-E945 CarbonylContact C-O 3.57Å; G935-E945 VanDerWaalsContact CA-O 3.26Å; G935-E945 WeakPolarHBondContact CA-O 3.38Å; G935-E945 CarbonylContact O-C 3.57Å; G935-E945 WeakPolarHBondContact O-CA 3.27Å; G935-E945 PolarHBondContact O-N 3.13Å; K937-E945 HydrophobicContact CB-CB 4.49Å; K937-E945 HydrophobicContact CD-CB 4.15Å; K937-E945 HydrophobicContact CD-CG 4.33Å; K937-E945 VanDerWaalsContact CD-OE1 3.29Å; K937-E945 WeakPolarHBondContact CD-OE1 3.43Å; K937-E945 WeakPolarHBondContact CE-OE1 3.29Å; K937-E945 WeakPolarHBondContact CE-OE2 3.42Å; K937-E945 HydrophobicContact CG-CB 4.08Å; K937-E945 HydrophobicContact CG-CG 4.36Å; K937-E945 VanDerWaalsContact CG-OE2 3.29Å; K937-E945 WeakPolarHBondContact CG-OE2 3.03Å; K937-E945 IonicContact NZ-OE1 3.22Å; K937-E945 PolarHBondContact NZ-OE1 2.94Å; K937-E945 IonicContact NZ-OE2 3.52Å; K937-E945 PolarHBondContact NZ-OE2 2.85Å; I943-E945 PolarHBondContact O-N 3.08Å; E945-P947 VanDerWaalsContact C-N 3.27Å; E945-P947 HydrophobicContact CG-CB 4.06Å; E945-P947 HydrophobicContact CG-CG 3.93Å; E945-P947 WeakPolarHBondContact O-CD 3.34Å; E945-Y1279 PolarHBondContact O-OH 3.39Å; E945-Y1279 VanDerWaalsContact O-OH 3.09Å
946	L	48.9	Very low	69.1	Low	122.25 Å²	122.25	57.5 Å²	57.5	64%	0.64	32%	0.321	S	S	*	.			trans	-63.1	118.2	161.4	-70.9	100.3	0	0	0	108.7	A944 K948 Y1279	A944-L946 HydrophobicContact CB-CD1 4.41Å; A944-L946 HydrophobicContact CB-CD2 4.46Å; A944-L946 HydrophobicContact CB-CG 4.48Å; A944-L946 PolarHBondContact O-N 3.11Å; A944-L946 VanDerWaalsContact O-N 3.12Å; L946-K948 PolarHBondContact O-N 2.87Å; L946-Y1279 WeakPolarHBondContact CA-OH 2.98Å; L946-Y1279 HydrophobicContact CB-CD2 4.44Å; L946-Y1279 HydrophobicContact CB-CE2 3.77Å; L946-Y1279 HydrophobicContact CD2-CD2 3.67Å; L946-Y1279 HydrophobicContact CD2-CE2 3.79Å; L946-Y1279 HydrophobicContact CD2-CG 4.27Å; L946-Y1279 VanDerWaalsContact CD2-OH 3.22Å; L946-Y1279 WeakPolarHBondContact CD2-OH 3.03Å; L946-Y1279 HydrophobicContact CG-CD2 4.03Å; L946-Y1279 HydrophobicContact CG-CE2 3.61Å
947	P	50.1	Low	68.8	Low	73.25 Å²	73.25	57.6 Å²	57.6	48%	0.476	33%	0.33	S	S	.	.			trans	-70	150.1	159.3	17.9	-12.4	0	0	0	108.7	E945 V949 Y1279 I1283	E945-P947 VanDerWaalsContact C-N 3.27Å; E945-P947 HydrophobicContact CG-CB 4.06Å; E945-P947 HydrophobicContact CG-CG 3.93Å; E945-P947 WeakPolarHBondContact O-CD 3.34Å; P947-V949 HydrophobicContact CB-CG2 3.74Å; P947-V949 HydrophobicContact CG-CG2 3.59Å; P947-V949 WeakPolarHBondContact O-CG2 3.32Å; P947-V949 PolarHBondContact O-N 2.79Å; P947-Y1279 HydrophobicContact CG-CE2 4.21Å; P947-I1283 HydrophobicContact CG-CB 3.64Å; P947-I1283 VanDerWaalsContact CG-CB 3.42Å; P947-I1283 HydrophobicContact CG-CG2 3.53Å; P947-I1283 WeakPolarHBondContact CG-O 3.45Å
948	K	56	Low	68.2	Low	135.75 Å²	135.75	59.9 Å²	59.9	59%	0.59	36%	0.357	S	S	*	.			trans	-87.4	82.5	173.8	-68.6	-172.5	178.1	-173.5	0	110.3	Y584 H836 L946 C950 S951	Y584-K948 VanDerWaalsContact CZ-NZ 3.25Å; Y584-K948 PolarHBondContact OH-NZ 2.86Å; H836-K948 PolarHBondContact NE2-NZ 3.14Å; L946-K948 PolarHBondContact O-N 2.87Å; K948-C950 PolarHBondContact O-N 2.87Å; K948-S951 VanDerWaalsContact O-CA 3.31Å; K948-S951 WeakPolarHBondContact O-CA 3.48Å; K948-S951 PolarHBondContact O-N 3.3Å; K948-S951 VanDerWaalsContact O-N 3.15Å
949	V	65.7	Low	67.9	Low	52.5 Å²	52.5	60.7 Å²	60.7	32%	0.318	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-60.4	140.9	165.8	-160.3	0	0	0	0	107.8	P947 S951 G952 Y956 L1282 I1283	P947-V949 HydrophobicContact CB-CG2 3.74Å; P947-V949 HydrophobicContact CG-CG2 3.59Å; P947-V949 WeakPolarHBondContact O-CG2 3.32Å; P947-V949 PolarHBondContact O-N 2.79Å; V949-S951 PolarHBondContact O-N 3.16Å; V949-S951 VanDerWaalsContact O-N 3.16Å; V949-G952 PolarHBondContact O-N 3.02Å; V949-Y956 HydrophobicContact CB-CD2 4.39Å; V949-Y956 HydrophobicContact CB-CG 4.16Å; V949-Y956 HydrophobicContact CG1-CD1 4.27Å; V949-Y956 HydrophobicContact CG1-CD2 3.51Å; V949-Y956 VanDerWaalsContact CG1-CD2 3.5Å; V949-Y956 HydrophobicContact CG1-CE2 4.06Å; V949-Y956 HydrophobicContact CG1-CG 3.71Å; V949-L1282 HydrophobicContact CB-CD1 4.43Å; V949-L1282 HydrophobicContact CG1-CD1 3.44Å; V949-L1282 VanDerWaalsContact CG1-CD1 3.44Å; V949-L1282 HydrophobicContact CG1-CG 4.43Å; V949-L1282 HydrophobicContact CG2-CB 3.93Å; V949-L1282 HydrophobicContact CG2-CD1 4.07Å; V949-I1283 HydrophobicContact CG2-CG2 4.4Å
950	C	74.2	Confident	67.8	Low	2 Å²	2	59.6 Å²	59.6	1%	0.014	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	57.1	34.6	-177.1	-45.1	0	0	0	0	113.2	K948 G952 H953 G954 C961 E971 C972	K948-C950 PolarHBondContact O-N 2.87Å; C950-G952 PolarHBondContact O-N 3.22Å; C950-H953 CarbonylContact O-C 3.52Å; C950-H953 WeakPolarHBondContact O-CA 3.37Å; C950-H953 PolarHBondContact O-N 2.87Å; C950-G954 WeakPolarHBondContact CB-O 3.38Å; C950-G954 PolarHBondContact O-N 3.06Å; C950-C961 WeakPolarHBondContact CA-SG 3.34Å; C950-C961 HydrophobicContact CB-CB 3.67Å; C950-C961 WeakPolarHBondContact CB-SG 3.44Å; C950-C961 PolarHBondContact N-SG 3.41Å; C950-C961 WeakPolarHBondContact SG-CA 3.33Å; C950-C961 WeakPolarHBondContact SG-CB 3.26Å; C950-C961 CovalentContact SG-SG 2.03Å; C950-C961 PolarHBondContact SG-SG 2.79Å; C950-E971 CarbonylContact C-O 3.38Å; C950-E971 VanDerWaalsContact CA-O 3.27Å; C950-E971 WeakPolarHBondContact CA-O 3.37Å; C950-E971 PolarHBondContact N-OE2 2.87Å; C950-E971 VanDerWaalsContact O-O 3.05Å; C950-C972 HydrophobicContact CB-CB 4.22Å; C950-C972 WeakPolarHBondContact O-CB 3.4Å
951	S	77.6	Confident	67.6	Low	37.75 Å²	37.75	60.3 Å²	60.3	26%	0.264	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	56.3	3.9	-178.5	-55.5	0	0	0	0	116.5	K948 V949 H953 E971 Q973	K948-S951 VanDerWaalsContact O-CA 3.31Å; K948-S951 WeakPolarHBondContact O-CA 3.48Å; K948-S951 PolarHBondContact O-N 3.3Å; K948-S951 VanDerWaalsContact O-N 3.15Å; V949-S951 PolarHBondContact O-N 3.16Å; V949-S951 VanDerWaalsContact O-N 3.16Å; S951-H953 VanDerWaalsContact C-N 3.35Å; S951-H953 PolarHBondContact O-CD2 3.3Å; S951-H953 VanDerWaalsContact O-CD2 3.27Å; S951-E971 WeakPolarHBondContact CB-O 3.41Å; S951-E971 PolarHBondContact N-O 3.27Å; S951-E971 VanDerWaalsContact N-O 3.15Å; S951-E971 PolarHBondContact OG-O 3.2Å; S951-E971 VanDerWaalsContact OG-O 3.12Å; S951-Q973 VanDerWaalsContact OG-CB 3.27Å; S951-Q973 WeakPolarHBondContact OG-CB 3.28Å
952	G	72.1	Confident	67.9	Low	35.25 Å²	35.25	68.3 Å²	68.3	36%	0.363	40%	0.399	S	S	.	.	G	3₁₀ helix	trans	82.7	14	-165.2	0	0	0	0	0	114.4	R832 V949 C950	R832-G952 PolarHBondContact NH2-O 3.01Å; V949-G952 PolarHBondContact O-N 3.02Å; C950-G952 PolarHBondContact O-N 3.22Å
953	H	79.1	Confident	68.2	Low	51.5 Å²	51.5	67.3 Å²	67.3	24%	0.238	39%	0.391	C	S	.	.	S	Bend	trans	-125.6	18.5	-173.5	-63.9	-61.2	0	0	0	113.4	R832 C950 S951 C963 Y964 W967 C972	R832-H953 PolarHBondContact NH1-CE1 2.99Å; R832-H953 PolarHBondContact NH1-NE2 3.42Å; C950-H953 CarbonylContact O-C 3.52Å; C950-H953 WeakPolarHBondContact O-CA 3.37Å; C950-H953 PolarHBondContact O-N 2.87Å; S951-H953 VanDerWaalsContact C-N 3.35Å; S951-H953 PolarHBondContact O-CD2 3.3Å; S951-H953 VanDerWaalsContact O-CD2 3.27Å; H953-C963 WeakPolarHBondContact O-CA 3.39Å; H953-Y964 WeakPolarHBondContact O-CD2 3.23Å; H953-Y964 PolarHBondContact O-N 2.99Å; H953-W967 HydrophobicContact CB-CB 4.23Å; H953-W967 HydrophobicContact CB-CD2 3.75Å; H953-W967 HydrophobicContact CB-CE3 4.05Å; H953-W967 HydrophobicContact CB-CG 3.8Å; H953-W967 AromaticContact CD2-CD2 3.8Å; H953-W967 AromaticContact CD2-CE2 3.82Å; H953-W967 AromaticContact CD2-CE3 3.63Å; H953-W967 AromaticContact CD2-CH2 3.52Å; H953-W967 VanDerWaalsContact CD2-CH2 3.48Å; H953-W967 WeakPolarHBondContact CD2-CH2 3.13Å; H953-W967 AromaticContact CD2-CZ2 3.71Å; H953-W967 AromaticContact CD2-CZ3 3.47Å; H953-W967 VanDerWaalsContact CD2-CZ3 3.47Å; H953-W967 WeakPolarHBondContact CD2-CZ3 3.35Å; H953-W967 AromaticContact CE1-CE2 3.72Å; H953-W967 VanDerWaalsContact CE1-CE2 3.48Å; H953-W967 AromaticContact CE1-CH2 3.65Å; H953-W967 AromaticContact CE1-CZ2 3.43Å; H953-W967 WeakPolarHBondContact CE1-CZ2 3.44Å; H953-W967 AromaticContact CE1-NE1 3.99Å; H953-W967 AromaticContact CG-CD2 3.67Å; H953-W967 AromaticContact CG-CE2 3.72Å; H953-W967 AromaticContact CG-CE3 3.88Å; H953-W967 AromaticContact CG-CZ2 3.88Å; H953-W967 AromaticContact CG-CZ3 3.96Å; H953-W967 AromaticContact CG-NE1 3.98Å; H953-W967 AromaticContact ND1-CD1 3.82Å; H953-W967 AromaticContact ND1-CD2 3.48Å; H953-W967 VanDerWaalsContact ND1-CD2 3.34Å; H953-W967 AromaticContact ND1-CE2 3.42Å; H953-W967 AromaticContact ND1-CE3 3.83Å; H953-W967 AromaticContact ND1-CG 3.88Å; H953-W967 AromaticContact ND1-CH2 3.78Å; H953-W967 AromaticContact ND1-CZ2 3.57Å; H953-W967 VanDerWaalsContact ND1-CZ2 3.27Å; H953-W967 WeakPolarHBondContact ND1-CZ2 3.02Å; H953-W967 AromaticContact ND1-CZ3 3.99Å; H953-W967 AromaticContact ND1-NE1 3.6Å; H953-W967 PolarHBondContact ND1-NE1 2.81Å; H953-W967 AromaticContact NE2-CH2 3.64Å; H953-W967 WeakPolarHBondContact NE2-CH2 3.39Å; H953-W967 AromaticContact NE2-CZ2 3.72Å; H953-W967 AromaticContact NE2-CZ3 3.87Å; H953-C972 HydrophobicContact CB-CB 4Å; H953-C972 VanDerWaalsContact CB-O 3.23Å; H953-C972 WeakPolarHBondContact CB-O 3.45Å; H953-C972 WeakPolarHBondContact O-CB 3.46Å
954	G	77.8	Confident	68.8	Low	8.5 Å²	8.5	68 Å²	68	9%	0.088	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.8	167.7	172.1	0	0	0	0	0	113.8	C950 R962	C950-G954 WeakPolarHBondContact CB-O 3.38Å; C950-G954 PolarHBondContact O-N 3.06Å; G954-R962 CarbonylContact C-O 3.5Å; G954-R962 VanDerWaalsContact CA-O 3.25Å; G954-R962 WeakPolarHBondContact CA-O 3.39Å
955	D	72.6	Confident	69.7	Low	62.5 Å²	62.5	71.2 Å²	71.2	33%	0.334	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	130.9	172.3	-50.8	-61.1	0	0	0	110.1	A957 R962 Y964	D955-A957 PolarHBondContact O-N 2.78Å; D955-R962 PolarHBondContact N-O 2.95Å; D955-R962 WeakPolarHBondContact O-CB 3.27Å; D955-R962 PolarHBondContact O-N 3.09Å; D955-R962 IonicContact OD2-CZ 3.18Å; D955-R962 VanDerWaalsContact OD2-CZ 3.25Å; D955-R962 IonicContact OD2-NE 2.99Å; D955-R962 PolarHBondContact OD2-NE 3.1Å; D955-R962 VanDerWaalsContact OD2-NE 3.17Å; D955-R962 IonicContact OD2-NH2 2.86Å; D955-R962 PolarHBondContact OD2-NH2 2.99Å; D955-Y964 VanDerWaalsContact OD1-CE1 3.25Å; D955-Y964 WeakPolarHBondContact OD1-CE1 3.24Å; D955-Y964 PolarHBondContact OD1-OH 2.77Å
956	Y	69.6	Low	70.9	Confident	112.25 Å²	112.25	72.5 Å²	72.5	44%	0.44	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	120.8	172.3	-168.7	-104.8	0	0	0	110.9	V949 G959 A960 D1278 L1282	V949-Y956 HydrophobicContact CB-CD2 4.39Å; V949-Y956 HydrophobicContact CB-CG 4.16Å; V949-Y956 HydrophobicContact CG1-CD1 4.27Å; V949-Y956 HydrophobicContact CG1-CD2 3.51Å; V949-Y956 VanDerWaalsContact CG1-CD2 3.5Å; V949-Y956 HydrophobicContact CG1-CE2 4.06Å; V949-Y956 HydrophobicContact CG1-CG 3.71Å; Y956-G959 VanDerWaalsContact OH-CA 3.3Å; Y956-G959 WeakPolarHBondContact OH-CA 3.38Å; Y956-G959 PolarHBondContact OH-O 3.02Å; Y956-A960 WeakPolarHBondContact CD2-O 3.31Å; Y956-D1278 HydrophobicContact CD1-CB 3.97Å; Y956-D1278 HydrophobicContact CE1-CB 4.24Å; Y956-L1282 HydrophobicContact CD1-CD1 3.66Å; Y956-L1282 HydrophobicContact CD2-CD1 3.66Å; Y956-L1282 HydrophobicContact CE1-CD1 3.65Å; Y956-L1282 HydrophobicContact CE2-CD1 3.64Å; Y956-L1282 HydrophobicContact CE2-CD2 3.98Å; Y956-L1282 HydrophobicContact CE2-CG 4.46Å; Y956-L1282 HydrophobicContact CG-CD1 3.66Å
957	A	61.8	Low	72.6	Confident	49 Å²	49	70.1 Å²	70.1	41%	0.405	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	135.8	-177.4	0	0	0	0	0	112.1	D955 G959 A960	D955-A957 PolarHBondContact O-N 2.78Å; A957-G959 PolarHBondContact O-N 2.98Å; A957-G959 VanDerWaalsContact O-N 3.1Å; A957-A960 PolarHBondContact N-O 3.11Å; A957-A960 PolarHBondContact O-N 3.13Å; A957-A960 VanDerWaalsContact O-N 3.11Å
958	S	63.3	Low	74.3	Confident	136.5 Å²	136.5	69.3 Å²	69.3	96%	0.955	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	28.9	175.5	-52	0	0	0	0	115.4
959	G	66.8	Low	75.4	Confident	42.25 Å²	42.25	63.9 Å²	63.9	44%	0.436	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.6	5	-179.9	0	0	0	0	0	115.4	Y956 A957	Y956-G959 VanDerWaalsContact OH-CA 3.3Å; Y956-G959 WeakPolarHBondContact OH-CA 3.38Å; Y956-G959 PolarHBondContact OH-O 3.02Å; A957-G959 PolarHBondContact O-N 2.98Å; A957-G959 VanDerWaalsContact O-N 3.1Å
960	A	72.1	Confident	76.2	Confident	49.25 Å²	49.25	68.1 Å²	68.1	41%	0.407	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	161.7	178.3	0	0	0	0	0	111.7	Y956 A957	Y956-A960 WeakPolarHBondContact CD2-O 3.31Å; A957-A960 PolarHBondContact N-O 3.11Å; A957-A960 PolarHBondContact O-N 3.13Å; A957-A960 VanDerWaalsContact O-N 3.11Å
961	C	78.2	Confident	76.7	Confident	24.75 Å²	24.75	72.8 Å²	72.8	17%	0.167	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	127.3	174.7	-74.6	0	0	0	0	112.2	C950 H970 C972	C950-C961 WeakPolarHBondContact CA-SG 3.34Å; C950-C961 HydrophobicContact CB-CB 3.67Å; C950-C961 WeakPolarHBondContact CB-SG 3.44Å; C950-C961 PolarHBondContact N-SG 3.41Å; C950-C961 WeakPolarHBondContact SG-CA 3.33Å; C950-C961 WeakPolarHBondContact SG-CB 3.26Å; C950-C961 CovalentContact SG-SG 2.03Å; C950-C961 PolarHBondContact SG-SG 2.79Å; C961-H970 VanDerWaalsContact CB-O 3.25Å; C961-H970 WeakPolarHBondContact CB-O 3.38Å; C961-H970 PolarHBondContact SG-O 3.46Å; C961-H970 VanDerWaalsContact SG-O 3.36Å; C961-C972 VanDerWaalsContact CB-SG 3.56Å
962	R	82.7	Confident	77.1	Confident	169.5 Å²	169.5	71 Å²	71	64%	0.64	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.8	97.2	170.9	-174.4	-172	95.6	169.6	1.6	108.8	G954 D955	G954-R962 CarbonylContact C-O 3.5Å; G954-R962 VanDerWaalsContact CA-O 3.25Å; G954-R962 WeakPolarHBondContact CA-O 3.39Å; D955-R962 PolarHBondContact N-O 2.95Å; D955-R962 WeakPolarHBondContact O-CB 3.27Å; D955-R962 PolarHBondContact O-N 3.09Å; D955-R962 IonicContact OD2-CZ 3.18Å; D955-R962 VanDerWaalsContact OD2-CZ 3.25Å; D955-R962 IonicContact OD2-NE 2.99Å; D955-R962 PolarHBondContact OD2-NE 3.1Å; D955-R962 VanDerWaalsContact OD2-NE 3.17Å; D955-R962 IonicContact OD2-NH2 2.86Å; D955-R962 PolarHBondContact OD2-NH2 2.99Å
963	C	82.9	Confident	77.7	Confident	36.75 Å²	36.75	73.7 Å²	73.7	25%	0.248	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	147.6	-174.1	-49.9	0	0	0	0	113.4	H953 W967 C972	H953-C963 WeakPolarHBondContact O-CA 3.39Å; C963-W967 HydrophobicContact CB-CB 4.15Å; C963-W967 VanDerWaalsContact CB-O 3.25Å; C963-W967 WeakPolarHBondContact CB-O 3.32Å; C963-C972 WeakPolarHBondContact CA-SG 3.29Å; C963-C972 HydrophobicContact CB-CB 3.71Å; C963-C972 WeakPolarHBondContact CB-SG 3.37Å; C963-C972 PolarHBondContact N-SG 3.16Å; C963-C972 VanDerWaalsContact N-SG 3.42Å; C963-C972 VanDerWaalsContact SG-CA 3.52Å; C963-C972 WeakPolarHBondContact SG-CA 3.38Å; C963-C972 WeakPolarHBondContact SG-CB 3.28Å; C963-C972 CovalentContact SG-SG 2.03Å; C963-C972 PolarHBondContact SG-SG 3.18Å
964	Y	81.6	Confident	77.8	Confident	98.25 Å²	98.25	72.1 Å²	72.1	39%	0.385	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-68	160	168.3	-59.2	-38.5	0	0	0	110.3	H953 D955 W967	H953-Y964 WeakPolarHBondContact O-CD2 3.23Å; H953-Y964 PolarHBondContact O-N 2.99Å; D955-Y964 VanDerWaalsContact OD1-CE1 3.25Å; D955-Y964 WeakPolarHBondContact OD1-CE1 3.24Å; D955-Y964 PolarHBondContact OD1-OH 2.77Å; Y964-W967 PolarHBondContact O-N 2.64Å; Y964-W967 VanDerWaalsContact O-N 3.1Å
965	P	75	Confident	77.8	Confident	110 Å²	110	74.6 Å²	74.6	71%	0.714	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.6	147.9	168.7	-26.3	35.6	0	0	0	111.7	W967	P965-W967 VanDerWaalsContact C-N 3.29Å; P965-W967 VanDerWaalsContact O-CD1 3.3Å; P965-W967 PolarHBondContact O-N 2.98Å
966	E	80.4	Confident	78.3	Confident	112 Å²	112	77.9 Å²	77.9	52%	0.523	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	70	0.3	-168.5	-47.9	-58.6	124.6	0	0	117	L975 W976	E966-L975 CarbonylContact O-C 3.48Å; E966-L975 VanDerWaalsContact O-CA 3.32Å; E966-L975 WeakPolarHBondContact O-CA 3.35Å; E966-W976 PolarHBondContact O-N 2.86Å; E966-W976 VanDerWaalsContact OE2-CD1 3.27Å; E966-W976 PolarHBondContact OE2-NE1 2.81Å
967	W	85.9	Confident	78.9	Confident	72.75 Å²	72.75	75 Å²	75	28%	0.276	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	152.1	-178.6	-63.4	86.2	0	0	0	114.5	H953 C963 Y964 P965 C972 I974 L975	H953-W967 HydrophobicContact CB-CB 4.23Å; H953-W967 HydrophobicContact CB-CD2 3.75Å; H953-W967 HydrophobicContact CB-CE3 4.05Å; H953-W967 HydrophobicContact CB-CG 3.8Å; H953-W967 AromaticContact CD2-CD2 3.8Å; H953-W967 AromaticContact CD2-CE2 3.82Å; H953-W967 AromaticContact CD2-CE3 3.63Å; H953-W967 AromaticContact CD2-CH2 3.52Å; H953-W967 VanDerWaalsContact CD2-CH2 3.48Å; H953-W967 WeakPolarHBondContact CD2-CH2 3.13Å; H953-W967 AromaticContact CD2-CZ2 3.71Å; H953-W967 AromaticContact CD2-CZ3 3.47Å; H953-W967 VanDerWaalsContact CD2-CZ3 3.47Å; H953-W967 WeakPolarHBondContact CD2-CZ3 3.35Å; H953-W967 AromaticContact CE1-CE2 3.72Å; H953-W967 VanDerWaalsContact CE1-CE2 3.48Å; H953-W967 AromaticContact CE1-CH2 3.65Å; H953-W967 AromaticContact CE1-CZ2 3.43Å; H953-W967 WeakPolarHBondContact CE1-CZ2 3.44Å; H953-W967 AromaticContact CE1-NE1 3.99Å; H953-W967 AromaticContact CG-CD2 3.67Å; H953-W967 AromaticContact CG-CE2 3.72Å; H953-W967 AromaticContact CG-CE3 3.88Å; H953-W967 AromaticContact CG-CZ2 3.88Å; H953-W967 AromaticContact CG-CZ3 3.96Å; H953-W967 AromaticContact CG-NE1 3.98Å; H953-W967 AromaticContact ND1-CD1 3.82Å; H953-W967 AromaticContact ND1-CD2 3.48Å; H953-W967 VanDerWaalsContact ND1-CD2 3.34Å; H953-W967 AromaticContact ND1-CE2 3.42Å; H953-W967 AromaticContact ND1-CE3 3.83Å; H953-W967 AromaticContact ND1-CG 3.88Å; H953-W967 AromaticContact ND1-CH2 3.78Å; H953-W967 AromaticContact ND1-CZ2 3.57Å; H953-W967 VanDerWaalsContact ND1-CZ2 3.27Å; H953-W967 WeakPolarHBondContact ND1-CZ2 3.02Å; H953-W967 AromaticContact ND1-CZ3 3.99Å; H953-W967 AromaticContact ND1-NE1 3.6Å; H953-W967 PolarHBondContact ND1-NE1 2.81Å; H953-W967 AromaticContact NE2-CH2 3.64Å; H953-W967 WeakPolarHBondContact NE2-CH2 3.39Å; H953-W967 AromaticContact NE2-CZ2 3.72Å; H953-W967 AromaticContact NE2-CZ3 3.87Å; C963-W967 HydrophobicContact CB-CB 4.15Å; C963-W967 VanDerWaalsContact CB-O 3.25Å; C963-W967 WeakPolarHBondContact CB-O 3.32Å; Y964-W967 PolarHBondContact O-N 2.64Å; Y964-W967 VanDerWaalsContact O-N 3.1Å; P965-W967 VanDerWaalsContact C-N 3.29Å; P965-W967 VanDerWaalsContact O-CD1 3.3Å; P965-W967 PolarHBondContact O-N 2.98Å; W967-C972 HydrophobicContact CB-CB 4.41Å; W967-C972 VanDerWaalsContact CE3-O 3.26Å; W967-I974 CarbonylContact C-O 3.55Å; W967-I974 WeakPolarHBondContact CA-O 3.44Å; W967-L975 HydrophobicContact CD2-CD1 4.24Å; W967-L975 HydrophobicContact CE3-CD1 4.14Å; W967-L975 HydrophobicContact CE3-CG 4.35Å; W967-L975 HydrophobicContact CH2-CD1 3.49Å; W967-L975 VanDerWaalsContact CH2-CD1 3.48Å; W967-L975 HydrophobicContact CH2-CG 4.15Å; W967-L975 HydrophobicContact CZ2-CD1 4.01Å; W967-L975 HydrophobicContact CZ2-CG 4.21Å; W967-L975 HydrophobicContact CZ3-CD1 3.56Å; W967-L975 HydrophobicContact CZ3-CG 4.21Å
968	K	84.2	Confident	79.9	Confident	57.25 Å²	57.25	77.5 Å²	77.5	25%	0.249	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	-178.9	177	70.3	-175.6	-179.1	-163	0	112.3	C972 Q973 I974 L975 W976 E978 G993	K968-C972 CarbonylContact O-C 3.45Å; K968-C972 VanDerWaalsContact O-C 3.25Å; K968-C972 VanDerWaalsContact O-CA 3.24Å; K968-C972 WeakPolarHBondContact O-CA 3.42Å; K968-Q973 PolarHBondContact O-N 2.96Å; K968-Q973 VanDerWaalsContact O-N 3.17Å; K968-I974 HydrophobicContact CG-CB 4.17Å; K968-I974 HydrophobicContact CG-CG2 4.37Å; K968-I974 PolarHBondContact N-O 2.94Å; K968-I974 WeakPolarHBondContact O-CB 3.4Å; K968-I974 PolarHBondContact O-N 3.06Å; K968-I974 VanDerWaalsContact O-N 3.09Å; K968-I974 VanDerWaalsContact O-O 3.1Å; K968-L975 VanDerWaalsContact CE-O 3.27Å; K968-L975 WeakPolarHBondContact CE-O 3.27Å; K968-W976 WeakPolarHBondContact CE-O 3.41Å; K968-W976 PolarHBondContact NZ-O 2.98Å; K968-E978 WeakPolarHBondContact CE-O 3.4Å; K968-E978 PolarHBondContact NZ-O 3.22Å; K968-G993 VanDerWaalsContact NZ-CA 3.33Å; K968-G993 PolarHBondContact NZ-O 2.91Å
969	G	79.6	Confident	80.9	Confident	22 Å²	22	71.7 Å²	71.7	23%	0.227	37%	0.365	C	S	.	.	S	Bend	trans	99.1	162.5	-174.5	0	0	0	0	0	112.2	E971 C972	G969-E971 VanDerWaalsContact C-N 3.25Å; G969-E971 PolarHBondContact O-N 3.02Å; G969-E971 VanDerWaalsContact O-N 3.12Å; G969-C972 PolarHBondContact O-N 2.99Å
970	H	82.5	Confident	81.7	Confident	140.25 Å²	140.25	75.5 Å²	75.5	65%	0.649	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-27.4	-174.2	-164.7	-38.1	0	0	0	113.7	C961	C961-H970 VanDerWaalsContact CB-O 3.25Å; C961-H970 WeakPolarHBondContact CB-O 3.38Å; C961-H970 PolarHBondContact SG-O 3.46Å; C961-H970 VanDerWaalsContact SG-O 3.36Å
971	E	84.3	Confident	82.2	Confident	101 Å²	101	75.1 Å²	75.1	47%	0.472	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.7	25	172.8	-63	-143.9	161.5	0	0	111.6	C950 S951 G969 Q973	C950-E971 CarbonylContact C-O 3.38Å; C950-E971 VanDerWaalsContact CA-O 3.27Å; C950-E971 WeakPolarHBondContact CA-O 3.37Å; C950-E971 PolarHBondContact N-OE2 2.87Å; C950-E971 VanDerWaalsContact O-O 3.05Å; S951-E971 WeakPolarHBondContact CB-O 3.41Å; S951-E971 PolarHBondContact N-O 3.27Å; S951-E971 VanDerWaalsContact N-O 3.15Å; S951-E971 PolarHBondContact OG-O 3.2Å; S951-E971 VanDerWaalsContact OG-O 3.12Å; G969-E971 VanDerWaalsContact C-N 3.25Å; G969-E971 PolarHBondContact O-N 3.02Å; G969-E971 VanDerWaalsContact O-N 3.12Å; E971-Q973 VanDerWaalsContact C-OE1 3.31Å; E971-Q973 PolarHBondContact O-N 3.03Å; E971-Q973 VanDerWaalsContact O-N 3.08Å
972	C	86.1	Confident	82.3	Confident	0 Å²	0	78.7 Å²	78.7	0%	0	39%	0.388	C	S	.	.	S	Bend	trans	52.8	32	-178.8	-52.1	0	0	0	0	114.4	C950 H953 C961 C963 W967 K968 G969	C950-C972 HydrophobicContact CB-CB 4.22Å; C950-C972 WeakPolarHBondContact O-CB 3.4Å; H953-C972 HydrophobicContact CB-CB 4Å; H953-C972 VanDerWaalsContact CB-O 3.23Å; H953-C972 WeakPolarHBondContact CB-O 3.45Å; H953-C972 WeakPolarHBondContact O-CB 3.46Å; C961-C972 VanDerWaalsContact CB-SG 3.56Å; C963-C972 WeakPolarHBondContact CA-SG 3.29Å; C963-C972 HydrophobicContact CB-CB 3.71Å; C963-C972 WeakPolarHBondContact CB-SG 3.37Å; C963-C972 PolarHBondContact N-SG 3.16Å; C963-C972 VanDerWaalsContact N-SG 3.42Å; C963-C972 VanDerWaalsContact SG-CA 3.52Å; C963-C972 WeakPolarHBondContact SG-CA 3.38Å; C963-C972 WeakPolarHBondContact SG-CB 3.28Å; C963-C972 CovalentContact SG-SG 2.03Å; C963-C972 PolarHBondContact SG-SG 3.18Å; W967-C972 HydrophobicContact CB-CB 4.41Å; W967-C972 VanDerWaalsContact CE3-O 3.26Å; K968-C972 CarbonylContact O-C 3.45Å; K968-C972 VanDerWaalsContact O-C 3.25Å; K968-C972 VanDerWaalsContact O-CA 3.24Å; K968-C972 WeakPolarHBondContact O-CA 3.42Å; G969-C972 PolarHBondContact O-N 2.99Å
973	Q	84.3	Confident	82.4	Confident	92 Å²	92	74.3 Å²	74.3	43%	0.43	38%	0.38	S	S	.	.			trans	-90	-0.5	-171.6	78.3	-73.8	7.1	0	0	114.3	S951 K968 E971	S951-Q973 VanDerWaalsContact OG-CB 3.27Å; S951-Q973 WeakPolarHBondContact OG-CB 3.28Å; K968-Q973 PolarHBondContact O-N 2.96Å; K968-Q973 VanDerWaalsContact O-N 3.17Å; E971-Q973 VanDerWaalsContact C-OE1 3.31Å; E971-Q973 PolarHBondContact O-N 3.03Å; E971-Q973 VanDerWaalsContact O-N 3.08Å
974	I	82	Confident	82.6	Confident	17.75 Å²	17.75	72.6 Å²	72.6	9%	0.091	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	135.5	-172.7	-49.9	160.2	0	0	0	108.3	W967 K968 E978 E980	W967-I974 CarbonylContact C-O 3.55Å; W967-I974 WeakPolarHBondContact CA-O 3.44Å; K968-I974 HydrophobicContact CG-CB 4.17Å; K968-I974 HydrophobicContact CG-CG2 4.37Å; K968-I974 PolarHBondContact N-O 2.94Å; K968-I974 WeakPolarHBondContact O-CB 3.4Å; K968-I974 PolarHBondContact O-N 3.06Å; K968-I974 VanDerWaalsContact O-N 3.09Å; K968-I974 VanDerWaalsContact O-O 3.1Å; I974-E978 HydrophobicContact CG2-CB 3.96Å; I974-E980 HydrophobicContact CD1-CB 3.79Å; I974-E980 HydrophobicContact CD1-CG 3.79Å
975	L	79	Confident	82.8	Confident	61.5 Å²	61.5	70.2 Å²	70.2	32%	0.322	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	151.2	172.5	-87.1	77	0	0	0	110.8	E966 W967 K968 S977 E978	E966-L975 CarbonylContact O-C 3.48Å; E966-L975 VanDerWaalsContact O-CA 3.32Å; E966-L975 WeakPolarHBondContact O-CA 3.35Å; W967-L975 HydrophobicContact CD2-CD1 4.24Å; W967-L975 HydrophobicContact CE3-CD1 4.14Å; W967-L975 HydrophobicContact CE3-CG 4.35Å; W967-L975 HydrophobicContact CH2-CD1 3.49Å; W967-L975 VanDerWaalsContact CH2-CD1 3.48Å; W967-L975 HydrophobicContact CH2-CG 4.15Å; W967-L975 HydrophobicContact CZ2-CD1 4.01Å; W967-L975 HydrophobicContact CZ2-CG 4.21Å; W967-L975 HydrophobicContact CZ3-CD1 3.56Å; W967-L975 HydrophobicContact CZ3-CG 4.21Å; K968-L975 VanDerWaalsContact CE-O 3.27Å; K968-L975 WeakPolarHBondContact CE-O 3.27Å; L975-S977 PolarHBondContact O-N 3.23Å; L975-S977 VanDerWaalsContact O-N 3.09Å; L975-E978 HydrophobicContact CB-CB 4.44Å; L975-E978 HydrophobicContact CB-CG 4.11Å; L975-E978 PolarHBondContact N-OE2 2.4Å; L975-E978 PolarHBondContact O-N 3.26Å; L975-E978 VanDerWaalsContact O-N 3.09Å
976	W	82.7	Confident	83.4	Confident	130 Å²	130	67.4 Å²	67.4	49%	0.492	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-35.1	179.8	107.7	-91.2	0	0	0	112.5	E966 K968 E978 V992 G993	E966-W976 PolarHBondContact O-N 2.86Å; E966-W976 VanDerWaalsContact OE2-CD1 3.27Å; E966-W976 PolarHBondContact OE2-NE1 2.81Å; K968-W976 WeakPolarHBondContact CE-O 3.41Å; K968-W976 PolarHBondContact NZ-O 2.98Å; W976-E978 VanDerWaalsContact C-N 3.33Å; W976-E978 PolarHBondContact O-N 2.04Å; W976-V992 HydrophobicContact CE3-CG1 4.49Å; W976-V992 HydrophobicContact CH2-CG1 3.86Å; W976-V992 VanDerWaalsContact CH2-CG1 3.46Å; W976-V992 HydrophobicContact CZ2-CG1 4.18Å; W976-V992 HydrophobicContact CZ3-CG1 3.66Å; W976-G993 VanDerWaalsContact O-CA 3.3Å; W976-G993 WeakPolarHBondContact O-CA 3.41Å
977	S	81.7	Confident	83.8	Confident	52.5 Å²	52.5	64.1 Å²	64.1	37%	0.367	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-8	-179.7	53.7	0	0	0	0	115.3	L975 V992 G993	L975-S977 PolarHBondContact O-N 3.23Å; L975-S977 VanDerWaalsContact O-N 3.09Å; S977-V992 CarbonylContact O-C 3.55Å; S977-G993 VanDerWaalsContact C-CA 3.42Å; S977-G993 VanDerWaalsContact C-N 3.29Å; S977-G993 WeakPolarHBondContact O-CA 3.39Å; S977-G993 PolarHBondContact O-N 3.1Å
978	E	83.1	Confident	83.9	Confident	101.75 Å²	101.75	60.9 Å²	60.9	48%	0.475	33%	0.333	S	S	.	.	S	Bend	trans	-105.2	154.5	-179.1	-64.7	-179.6	148.6	0	0	110.8	K968 I974 L975 W976 G993	K968-E978 WeakPolarHBondContact CE-O 3.4Å; K968-E978 PolarHBondContact NZ-O 3.22Å; I974-E978 HydrophobicContact CG2-CB 3.96Å; L975-E978 HydrophobicContact CB-CB 4.44Å; L975-E978 HydrophobicContact CB-CG 4.11Å; L975-E978 PolarHBondContact N-OE2 2.4Å; L975-E978 PolarHBondContact O-N 3.26Å; L975-E978 VanDerWaalsContact O-N 3.09Å; W976-E978 VanDerWaalsContact C-N 3.33Å; W976-E978 PolarHBondContact O-N 2.04Å; E978-G993 VanDerWaalsContact O-CA 3.31Å; E978-G993 WeakPolarHBondContact O-CA 3.25Å
979	C	84.7	Confident	84.2	Confident	13.75 Å²	13.75	65.4 Å²	65.4	9%	0.093	35%	0.348	C	S	.	.			trans	-96.7	143.5	179.6	-61.5	0	0	0	0	111	D981 S982 C990 G993 E994	C979-D981 VanDerWaalsContact CB-O 3.3Å; C979-D981 WeakPolarHBondContact CB-O 3.36Å; C979-D981 CarbonylContact O-C 3.46Å; C979-D981 PolarHBondContact O-N 3.01Å; C979-S982 PolarHBondContact O-N 2.75Å; C979-C990 HydrophobicContact CB-CB 3.76Å; C979-C990 WeakPolarHBondContact CB-SG 3.23Å; C979-C990 PolarHBondContact N-SG 3.13Å; C979-C990 VanDerWaalsContact N-SG 3.38Å; C979-C990 WeakPolarHBondContact SG-CA 3.3Å; C979-C990 WeakPolarHBondContact SG-CB 3.37Å; C979-C990 CovalentContact SG-SG 2.03Å; C979-C990 PolarHBondContact SG-SG 3.16Å; C979-G993 VanDerWaalsContact SG-C 3.51Å; C979-E994 VanDerWaalsContact SG-C 3.57Å; C979-E994 PolarHBondContact SG-O 3.39Å
980	E	81.8	Confident	84.5	Confident	121.5 Å²	121.5	66.3 Å²	66.3	57%	0.568	35%	0.351	S	S	*	.	S	Bend	trans	-61.2	-29.2	179.1	-180	167.5	-130.6	0	0	112.7	I974 L1005	I974-E980 HydrophobicContact CD1-CB 3.79Å; I974-E980 HydrophobicContact CD1-CG 3.79Å; E980-L1005 HydrophobicContact CB-CD2 4.23Å
981	D	83.1	Confident	84.7	Confident	42 Å²	42	62.1 Å²	62.1	23%	0.225	34%	0.335	C	S	.	.	S	Bend	trans	-116.1	114.6	157.2	-179.6	-8.2	0	0	0	108.6	C979 T983 C984 S985 L1005	C979-D981 VanDerWaalsContact CB-O 3.3Å; C979-D981 WeakPolarHBondContact CB-O 3.36Å; C979-D981 CarbonylContact O-C 3.46Å; C979-D981 PolarHBondContact O-N 3.01Å; D981-T983 PolarHBondContact O-N 2.79Å; D981-T983 WeakPolarHBondContact OD1-CA 3.26Å; D981-T983 WeakPolarHBondContact OD1-CB 3.35Å; D981-T983 PolarHBondContact OD1-N 3.05Å; D981-T983 PolarHBondContact OD1-OG1 3.18Å; D981-T983 PolarHBondContact OD2-OG1 2.74Å; D981-C984 PolarHBondContact O-N 2.99Å; D981-C984 VanDerWaalsContact O-N 3.08Å; D981-C984 PolarHBondContact OD1-N 3.27Å; D981-S985 WeakPolarHBondContact OD2-CA 3.18Å; D981-S985 PolarHBondContact OD2-N 3.19Å; D981-S985 PolarHBondContact OD2-OG 3.12Å; D981-L1005 HydrophobicContact CB-CD2 4.2Å
982	S	81.5	Confident	84.7	Confident	100.5 Å²	100.5	61.9 Å²	61.9	70%	0.703	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-18.4	177.4	60.2	0	0	0	0	113.8	C979	C979-S982 PolarHBondContact O-N 2.75Å
983	T	84.4	Confident	84.4	Confident	77.75 Å²	77.75	62.5 Å²	62.5	48%	0.477	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-8.5	177	75.3	0	0	0	0	113.7	D981 S985 G986	D981-T983 PolarHBondContact O-N 2.79Å; D981-T983 WeakPolarHBondContact OD1-CA 3.26Å; D981-T983 WeakPolarHBondContact OD1-CB 3.35Å; D981-T983 PolarHBondContact OD1-N 3.05Å; D981-T983 PolarHBondContact OD1-OG1 3.18Å; D981-T983 PolarHBondContact OD2-OG1 2.74Å; T983-S985 VanDerWaalsContact C-N 3.34Å; T983-S985 PolarHBondContact O-N 3.12Å; T983-G986 VanDerWaalsContact O-CA 3.27Å; T983-G986 WeakPolarHBondContact O-CA 3.4Å; T983-G986 PolarHBondContact O-N 3.17Å; T983-G986 VanDerWaalsContact O-N 3.1Å; T983-G986 PolarHBondContact OG1-N 3.03Å
984	C	86.7	Confident	84.4	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	49.2	56.9	-174.8	-59.4	0	0	0	0	112.6	D981 G986 N987 G988 R989 C990 C995 L1005 C1006	D981-C984 PolarHBondContact O-N 2.99Å; D981-C984 VanDerWaalsContact O-N 3.08Å; D981-C984 PolarHBondContact OD1-N 3.27Å; C984-G986 PolarHBondContact O-N 2.93Å; C984-G986 VanDerWaalsContact O-N 3.1Å; C984-N987 CarbonylContact O-C 3.12Å; C984-N987 PolarHBondContact O-N 3.4Å; C984-G988 PolarHBondContact O-N 3.26Å; C984-R989 VanDerWaalsContact SG-C 3.56Å; C984-C990 PolarHBondContact SG-N 3.33Å; C984-C990 VanDerWaalsContact SG-N 3.45Å; C984-C995 VanDerWaalsContact CA-SG 3.56Å; C984-C995 HydrophobicContact CB-CB 3.69Å; C984-C995 WeakPolarHBondContact CB-SG 3.14Å; C984-C995 VanDerWaalsContact SG-CA 3.51Å; C984-C995 WeakPolarHBondContact SG-CA 3.24Å; C984-C995 WeakPolarHBondContact SG-CB 3.24Å; C984-C995 CovalentContact SG-SG 2.04Å; C984-C995 PolarHBondContact SG-SG 3.14Å; C984-L1005 CarbonylContact C-O 3.53Å; C984-L1005 VanDerWaalsContact O-O 3.1Å; C984-C1006 HydrophobicContact CB-CB 4.41Å; C984-C1006 WeakPolarHBondContact O-CB 3.29Å
985	S	86.5	Confident	84.7	Confident	47.75 Å²	47.75	65.5 Å²	65.5	33%	0.334	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	53.9	22.6	-172.8	-54.5	0	0	0	0	114.4	D981 T983 N987 L1005	D981-S985 WeakPolarHBondContact OD2-CA 3.18Å; D981-S985 PolarHBondContact OD2-N 3.19Å; D981-S985 PolarHBondContact OD2-OG 3.12Å; T983-S985 VanDerWaalsContact C-N 3.34Å; T983-S985 PolarHBondContact O-N 3.12Å; S985-N987 PolarHBondContact O-N 3.1Å; S985-N987 VanDerWaalsContact O-N 3.08Å; S985-N987 PolarHBondContact O-ND2 2.96Å; S985-L1005 VanDerWaalsContact CB-O 3.29Å; S985-L1005 WeakPolarHBondContact CB-O 3.42Å; S985-L1005 PolarHBondContact N-O 3.03Å; S985-L1005 PolarHBondContact OG-O 2.91Å
986	G	86.3	Confident	85.1	Confident	51.75 Å²	51.75	68.2 Å²	68.2	53%	0.534	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	70.1	1.9	-168.9	0	0	0	0	0	115.3	T983 C984	T983-G986 VanDerWaalsContact O-CA 3.27Å; T983-G986 WeakPolarHBondContact O-CA 3.4Å; T983-G986 PolarHBondContact O-N 3.17Å; T983-G986 VanDerWaalsContact O-N 3.1Å; T983-G986 PolarHBondContact OG1-N 3.03Å; C984-G986 PolarHBondContact O-N 2.93Å; C984-G986 VanDerWaalsContact O-N 3.1Å
987	N	88.6	Confident	85.4	Confident	41.75 Å²	41.75	64 Å²	64	22%	0.223	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.7	16.6	-169.7	-61.7	-57.5	0	0	0	113.6	C984 S985 Y998 Y1001 C1006	C984-N987 CarbonylContact O-C 3.12Å; C984-N987 PolarHBondContact O-N 3.4Å; S985-N987 PolarHBondContact O-N 3.1Å; S985-N987 VanDerWaalsContact O-N 3.08Å; S985-N987 PolarHBondContact O-ND2 2.96Å; N987-Y998 VanDerWaalsContact O-CD2 3.28Å; N987-Y998 WeakPolarHBondContact O-CD2 3.4Å; N987-Y998 PolarHBondContact O-N 3.07Å; N987-Y1001 HydrophobicContact CB-CD1 3.67Å; N987-Y1001 HydrophobicContact CB-CD2 3.97Å; N987-Y1001 HydrophobicContact CB-CE1 4.03Å; N987-Y1001 HydrophobicContact CB-CE2 4.22Å; N987-Y1001 HydrophobicContact CB-CG 3.64Å; N987-Y1001 WeakPolarHBondContact ND2-CE1 3.36Å; N987-Y1001 WeakPolarHBondContact OD1-CE1 3.39Å; N987-Y1001 WeakPolarHBondContact OD1-CE2 3.45Å; N987-Y1001 VanDerWaalsContact OD1-CZ 3.25Å; N987-Y1001 PolarHBondContact OD1-OH 2.96Å; N987-C1006 HydrophobicContact CB-CB 4.02Å; N987-C1006 WeakPolarHBondContact CB-O 3.31Å; N987-C1006 PolarHBondContact ND2-O 3.29Å; N987-C1006 VanDerWaalsContact ND2-O 3.16Å
988	G	88.5	Confident	85.6	Confident	6 Å²	6	67.6 Å²	67.6	6%	0.062	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	-170.9	174.1	0	0	0	0	0	112.9	C984 Q996 Y998	C984-G988 PolarHBondContact O-N 3.26Å; G988-Q996 CarbonylContact C-O 3.41Å; G988-Q996 VanDerWaalsContact CA-O 3.28Å; G988-Q996 WeakPolarHBondContact CA-O 3.31Å; G988-Y998 VanDerWaalsContact C-CE2 3.47Å; G988-Y998 VanDerWaalsContact C-CZ 3.41Å; G988-Y998 VanDerWaalsContact CA-CE2 3.5Å; G988-Y998 VanDerWaalsContact O-CE2 3.3Å; G988-Y998 WeakPolarHBondContact O-CE2 3.16Å; G988-Y998 PolarHBondContact O-OH 3.12Å; G988-Y998 VanDerWaalsContact O-OH 3.07Å
989	R	89.7	Confident	85.5	Confident	151.75 Å²	151.75	71.8 Å²	71.8	57%	0.573	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.2	133.5	174	159.2	-175	-179.8	-153.3	-2	109.6	C984 V991 Q996 Y998	C984-R989 VanDerWaalsContact SG-C 3.56Å; R989-V991 HydrophobicContact CB-CG2 4.49Å; R989-V991 HydrophobicContact CG-CG2 3.9Å; R989-V991 VanDerWaalsContact NE-CG2 3.35Å; R989-V991 PolarHBondContact O-N 3.35Å; R989-Q996 PolarHBondContact N-O 3.05Å; R989-Q996 WeakPolarHBondContact O-CB 3.32Å; R989-Q996 PolarHBondContact O-N 2.98Å; R989-Y998 HydrophobicContact CB-CE1 4.48Å
990	C	87.2	Confident	85.1	Confident	41 Å²	41	72.5 Å²	72.5	28%	0.277	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	130	170.1	-171	0	0	0	0	111.1	C979 C984	C979-C990 HydrophobicContact CB-CB 3.76Å; C979-C990 WeakPolarHBondContact CB-SG 3.23Å; C979-C990 PolarHBondContact N-SG 3.13Å; C979-C990 VanDerWaalsContact N-SG 3.38Å; C979-C990 WeakPolarHBondContact SG-CA 3.3Å; C979-C990 WeakPolarHBondContact SG-CB 3.37Å; C979-C990 CovalentContact SG-SG 2.03Å; C979-C990 PolarHBondContact SG-SG 3.16Å; C984-C990 PolarHBondContact SG-N 3.33Å; C984-C990 VanDerWaalsContact SG-N 3.45Å
991	V	86.2	Confident	85.2	Confident	52 Å²	52	69.4 Å²	69.4	32%	0.315	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	110.6	176.7	-176.7	0	0	0	0	108.7	R989 G993 E994 Q996	R989-V991 HydrophobicContact CB-CG2 4.49Å; R989-V991 HydrophobicContact CG-CG2 3.9Å; R989-V991 VanDerWaalsContact NE-CG2 3.35Å; R989-V991 PolarHBondContact O-N 3.35Å; V991-G993 VanDerWaalsContact C-N 3.26Å; V991-G993 PolarHBondContact O-N 3.24Å; V991-G993 VanDerWaalsContact O-N 3.15Å; V991-E994 PolarHBondContact N-O 3.04Å; V991-E994 PolarHBondContact O-N 3.16Å; V991-E994 VanDerWaalsContact O-N 3.13Å; V991-Q996 HydrophobicContact CB-CB 4.36Å; V991-Q996 HydrophobicContact CG2-CB 4.16Å
992	V	84.9	Confident	85.1	Confident	97.75 Å²	97.75	69 Å²	69	59%	0.592	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.9	45.5	-179.6	-161.1	0	0	0	0	112.1	W976 S977 E994	W976-V992 HydrophobicContact CE3-CG1 4.49Å; W976-V992 HydrophobicContact CH2-CG1 3.86Å; W976-V992 VanDerWaalsContact CH2-CG1 3.46Å; W976-V992 HydrophobicContact CZ2-CG1 4.18Å; W976-V992 HydrophobicContact CZ3-CG1 3.66Å; S977-V992 CarbonylContact O-C 3.55Å; V992-E994 VanDerWaalsContact C-N 3.32Å; V992-E994 PolarHBondContact O-N 3.13Å
993	G	79.6	Confident	85.1	Confident	12.5 Å²	12.5	65.8 Å²	65.8	13%	0.129	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.5	-1.8	175.4	0	0	0	0	0	116.9	K968 W976 S977 E978 C979 V991	K968-G993 VanDerWaalsContact NZ-CA 3.33Å; K968-G993 PolarHBondContact NZ-O 2.91Å; W976-G993 VanDerWaalsContact O-CA 3.3Å; W976-G993 WeakPolarHBondContact O-CA 3.41Å; S977-G993 VanDerWaalsContact C-CA 3.42Å; S977-G993 VanDerWaalsContact C-N 3.29Å; S977-G993 WeakPolarHBondContact O-CA 3.39Å; S977-G993 PolarHBondContact O-N 3.1Å; E978-G993 VanDerWaalsContact O-CA 3.31Å; E978-G993 WeakPolarHBondContact O-CA 3.25Å; C979-G993 VanDerWaalsContact SG-C 3.51Å; V991-G993 VanDerWaalsContact C-N 3.26Å; V991-G993 PolarHBondContact O-N 3.24Å; V991-G993 VanDerWaalsContact O-N 3.15Å
994	E	83.9	Confident	85	Confident	155.75 Å²	155.75	68.9 Å²	68.9	73%	0.728	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.1	143	171.1	-118.2	-177.6	171.2	0	0	111.1	C979 V991 V992 Q996	C979-E994 VanDerWaalsContact SG-C 3.57Å; C979-E994 PolarHBondContact SG-O 3.39Å; V991-E994 PolarHBondContact N-O 3.04Å; V991-E994 PolarHBondContact O-N 3.16Å; V991-E994 VanDerWaalsContact O-N 3.13Å; V992-E994 VanDerWaalsContact C-N 3.32Å; V992-E994 PolarHBondContact O-N 3.13Å; E994-Q996 PolarHBondContact O-N 3.04Å; E994-Q996 VanDerWaalsContact O-N 3.17Å
995	C	87.8	Confident	84.9	Confident	17 Å²	17	71.1 Å²	71.1	12%	0.115	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	105.1	176.5	-83.6	0	0	0	0	111.1	C984 C997 N1004	C984-C995 VanDerWaalsContact CA-SG 3.56Å; C984-C995 HydrophobicContact CB-CB 3.69Å; C984-C995 WeakPolarHBondContact CB-SG 3.14Å; C984-C995 VanDerWaalsContact SG-CA 3.51Å; C984-C995 WeakPolarHBondContact SG-CA 3.24Å; C984-C995 WeakPolarHBondContact SG-CB 3.24Å; C984-C995 CovalentContact SG-SG 2.04Å; C984-C995 PolarHBondContact SG-SG 3.14Å; C995-C997 PolarHBondContact O-N 3.12Å; C995-C997 VanDerWaalsContact O-N 3.12Å; C995-C997 PolarHBondContact O-SG 3.24Å; C995-N1004 WeakPolarHBondContact CB-O 3.29Å
996	Q	88.7	Confident	85	Confident	117.5 Å²	117.5	68.8 Å²	68.8	55%	0.549	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	102.5	174	-173.1	171.1	56.8	0	0	109.6	G988 R989 V991 E994	G988-Q996 CarbonylContact C-O 3.41Å; G988-Q996 VanDerWaalsContact CA-O 3.28Å; G988-Q996 WeakPolarHBondContact CA-O 3.31Å; R989-Q996 PolarHBondContact N-O 3.05Å; R989-Q996 WeakPolarHBondContact O-CB 3.32Å; R989-Q996 PolarHBondContact O-N 2.98Å; V991-Q996 HydrophobicContact CB-CB 4.36Å; V991-Q996 HydrophobicContact CG2-CB 4.16Å; E994-Q996 PolarHBondContact O-N 3.04Å; E994-Q996 VanDerWaalsContact O-N 3.17Å
997	C	88	Confident	84.9	Confident	40.75 Å²	40.75	71.3 Å²	71.3	28%	0.275	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	148.8	-173.6	-52.7	0	0	0	0	113.9	C995 Y1001 C1006	C995-C997 PolarHBondContact O-N 3.12Å; C995-C997 VanDerWaalsContact O-N 3.12Å; C995-C997 PolarHBondContact O-SG 3.24Å; C997-Y1001 VanDerWaalsContact CB-O 3.28Å; C997-Y1001 WeakPolarHBondContact CB-O 3.37Å; C997-C1006 WeakPolarHBondContact CA-SG 3.3Å; C997-C1006 HydrophobicContact CB-CB 3.77Å; C997-C1006 WeakPolarHBondContact CB-SG 3.39Å; C997-C1006 WeakPolarHBondContact SG-CA 3.26Å; C997-C1006 WeakPolarHBondContact SG-CB 3.32Å; C997-C1006 CovalentContact SG-SG 2.04Å; C997-C1006 PolarHBondContact SG-SG 3.12Å
998	Y	86.2	Confident	84.5	Confident	128.75 Å²	128.75	72.8 Å²	72.8	51%	0.505	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-74.5	159.8	168.5	-54.3	-46.7	0	0	0	110.9	N987 G988 R989 G1000 Y1001	N987-Y998 VanDerWaalsContact O-CD2 3.28Å; N987-Y998 WeakPolarHBondContact O-CD2 3.4Å; N987-Y998 PolarHBondContact O-N 3.07Å; G988-Y998 VanDerWaalsContact C-CE2 3.47Å; G988-Y998 VanDerWaalsContact C-CZ 3.41Å; G988-Y998 VanDerWaalsContact CA-CE2 3.5Å; G988-Y998 VanDerWaalsContact O-CE2 3.3Å; G988-Y998 WeakPolarHBondContact O-CE2 3.16Å; G988-Y998 PolarHBondContact O-OH 3.12Å; G988-Y998 VanDerWaalsContact O-OH 3.07Å; R989-Y998 HydrophobicContact CB-CE1 4.48Å; Y998-G1000 PolarHBondContact O-N 2.98Å; Y998-Y1001 PolarHBondContact O-N 2.98Å; Y998-Y1001 VanDerWaalsContact O-N 3.08Å
999	E	81.6	Confident	84	Confident	191 Å²	191	79 Å²	79	89%	0.893	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	137.6	-179.2	-68.6	-169.5	132.6	0	0	112.3	Y1001	E999-Y1001 VanDerWaalsContact C-N 3.32Å
1000	G	75.9	Confident	83.3	Confident	27.5 Å²	27.5	74.5 Å²	74.5	28%	0.284	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.9	2.9	-173.1	0	0	0	0	0	115	Y998 R1009 T1010	Y998-G1000 PolarHBondContact O-N 2.98Å; G1000-R1009 CarbonylContact O-C 3.57Å; G1000-R1009 VanDerWaalsContact O-CA 3.28Å; G1000-R1009 WeakPolarHBondContact O-CA 3.3Å; G1000-R1009 VanDerWaalsContact O-CG 3.24Å; G1000-R1009 WeakPolarHBondContact O-CG 3.27Å; G1000-T1010 CarbonylContact C-O 3.41Å; G1000-T1010 VanDerWaalsContact C-OG1 3.23Å; G1000-T1010 VanDerWaalsContact CA-O 3.3Å; G1000-T1010 WeakPolarHBondContact CA-O 3.32Å; G1000-T1010 WeakPolarHBondContact CA-OG1 3.15Å; G1000-T1010 PolarHBondContact O-N 3.14Å; G1000-T1010 VanDerWaalsContact O-O 3.04Å; G1000-T1010 PolarHBondContact O-OG1 3.35Å
1001	Y	84.5	Confident	82.8	Confident	57.6 Å²	57.6	73.3 Å²	73.3	23%	0.226	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	152.1	174.6	-62.4	-90.9	0	0	0	112.8	N987 C997 Y998 E999 T1008 R1009 T1010	N987-Y1001 HydrophobicContact CB-CD1 3.67Å; N987-Y1001 HydrophobicContact CB-CD2 3.97Å; N987-Y1001 HydrophobicContact CB-CE1 4.03Å; N987-Y1001 HydrophobicContact CB-CE2 4.22Å; N987-Y1001 HydrophobicContact CB-CG 3.64Å; N987-Y1001 WeakPolarHBondContact ND2-CE1 3.36Å; N987-Y1001 WeakPolarHBondContact OD1-CE1 3.39Å; N987-Y1001 WeakPolarHBondContact OD1-CE2 3.45Å; N987-Y1001 VanDerWaalsContact OD1-CZ 3.25Å; N987-Y1001 PolarHBondContact OD1-OH 2.96Å; C997-Y1001 VanDerWaalsContact CB-O 3.28Å; C997-Y1001 WeakPolarHBondContact CB-O 3.37Å; Y998-Y1001 PolarHBondContact O-N 2.98Å; Y998-Y1001 VanDerWaalsContact O-N 3.08Å; E999-Y1001 VanDerWaalsContact C-N 3.32Å; Y1001-T1008 CarbonylContact C-O 3.54Å; Y1001-T1008 VanDerWaalsContact CA-O 3.27Å; Y1001-T1008 WeakPolarHBondContact CA-O 3.22Å; Y1001-R1009 HydrophobicContact CD1-CB 4.42Å; Y1001-R1009 HydrophobicContact CD1-CG 3.95Å; Y1001-R1009 HydrophobicContact CE1-CB 4.25Å; Y1001-R1009 HydrophobicContact CE1-CG 3.6Å; Y1001-R1009 VanDerWaalsContact CE1-CG 3.45Å; Y1001-R1009 HydrophobicContact CG-CG 4.48Å; Y1001-R1009 PolarHBondContact OH-NE 3.12Å; Y1001-R1009 VanDerWaalsContact OH-NE 3.11Å; Y1001-R1009 PolarHBondContact OH-NH2 2.83Å; Y1001-T1010 WeakPolarHBondContact CA-OG1 3.43Å; Y1001-T1010 PolarHBondContact N-OG1 3.04Å; Y1001-T1010 PolarHBondContact O-OG1 2.95Å; Y1001-T1010 VanDerWaalsContact O-OG1 3.09Å
1002	A	81.1	Confident	82.1	Confident	32.2 Å²	32.2	77.2 Å²	77.2	27%	0.266	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159	-178.1	-179.6	0	0	0	0	0	111.4	C1006 Q1007 T1008 T1010	A1002-C1006 CarbonylContact O-C 3.54Å; A1002-C1006 WeakPolarHBondContact O-CA 3.31Å; A1002-Q1007 PolarHBondContact O-N 2.97Å; A1002-T1008 CarbonylContact C-O 3.51Å; A1002-T1008 PolarHBondContact N-O 2.98Å; A1002-T1008 WeakPolarHBondContact O-CA 3.33Å; A1002-T1008 WeakPolarHBondContact O-CB 3.27Å; A1002-T1008 PolarHBondContact O-N 2.89Å; A1002-T1008 PolarHBondContact O-OG1 3.2Å; A1002-T1010 HydrophobicContact CB-CG2 3.52Å; A1002-T1010 VanDerWaalsContact CB-CG2 3.47Å; A1002-T1010 WeakPolarHBondContact CB-OG1 3.37Å
1003	G	80.6	Confident	81.4	Confident	33 Å²	33	73.9 Å²	73.9	34%	0.34	39%	0.386	S	S	.	.	S	Bend	trans	87.6	160.8	-172	0	0	0	0	0	111.6	L1005 C1006 Q1007	G1003-L1005 PolarHBondContact O-N 3.03Å; G1003-C1006 PolarHBondContact O-N 3.07Å; G1003-Q1007 VanDerWaalsContact C-OE1 3.3Å
1004	N	82.1	Confident	80.9	Confident	144.4 Å²	144.4	83.1 Å²	83.1	77%	0.772	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-22.5	-166.5	-49.4	22.2	0	0	0	114.3	C995	C995-N1004 WeakPolarHBondContact CB-O 3.29Å
1005	L	85.8	Confident	80.5	Confident	45.4 Å²	45.4	81.1 Å²	81.1	24%	0.238	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.6	17.8	178.9	-56.8	174.8	0	0	0	111.4	E980 D981 C984 S985 G1003 Q1007	E980-L1005 HydrophobicContact CB-CD2 4.23Å; D981-L1005 HydrophobicContact CB-CD2 4.2Å; C984-L1005 CarbonylContact C-O 3.53Å; C984-L1005 VanDerWaalsContact O-O 3.1Å; S985-L1005 VanDerWaalsContact CB-O 3.29Å; S985-L1005 WeakPolarHBondContact CB-O 3.42Å; S985-L1005 PolarHBondContact N-O 3.03Å; S985-L1005 PolarHBondContact OG-O 2.91Å; G1003-L1005 PolarHBondContact O-N 3.03Å; L1005-Q1007 VanDerWaalsContact N-OE1 3.13Å; L1005-Q1007 PolarHBondContact O-N 3Å; L1005-Q1007 VanDerWaalsContact O-N 3.15Å
1006	C	87.1	Confident	80.2	Confident	0 Å²	0	80.3 Å²	80.3	0%	0	41%	0.412	C	S	.	.	S	Bend	trans	57.2	25.9	-175	-50	0	0	0	0	115.1	C984 N987 C997 A1002 G1003 T1008	C984-C1006 HydrophobicContact CB-CB 4.41Å; C984-C1006 WeakPolarHBondContact O-CB 3.29Å; N987-C1006 HydrophobicContact CB-CB 4.02Å; N987-C1006 WeakPolarHBondContact CB-O 3.31Å; N987-C1006 PolarHBondContact ND2-O 3.29Å; N987-C1006 VanDerWaalsContact ND2-O 3.16Å; C997-C1006 WeakPolarHBondContact CA-SG 3.3Å; C997-C1006 HydrophobicContact CB-CB 3.77Å; C997-C1006 WeakPolarHBondContact CB-SG 3.39Å; C997-C1006 WeakPolarHBondContact SG-CA 3.26Å; C997-C1006 WeakPolarHBondContact SG-CB 3.32Å; C997-C1006 CovalentContact SG-SG 2.04Å; C997-C1006 PolarHBondContact SG-SG 3.12Å; A1002-C1006 CarbonylContact O-C 3.54Å; A1002-C1006 WeakPolarHBondContact O-CA 3.31Å; G1003-C1006 PolarHBondContact O-N 3.07Å; C1006-T1008 VanDerWaalsContact C-N 3.34Å; C1006-T1008 PolarHBondContact O-N 2.91Å
1007	Q	85.6	Confident	80.1	Confident	104.2 Å²	104.2	77.1 Å²	77.1	49%	0.487	40%	0.403	S	S	.	.			trans	-78.1	-16.1	-177.3	74	-82.5	42.8	0	0	114.1	A1002 G1003 L1005	A1002-Q1007 PolarHBondContact O-N 2.97Å; G1003-Q1007 VanDerWaalsContact C-OE1 3.3Å; L1005-Q1007 VanDerWaalsContact N-OE1 3.13Å; L1005-Q1007 PolarHBondContact O-N 3Å; L1005-Q1007 VanDerWaalsContact O-N 3.15Å
1008	T	80.5	Confident	79.8	Confident	72.4 Å²	72.4	77.2 Å²	77.2	44%	0.444	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	121.9	-173.1	-47.7	0	0	0	0	110.4	Y1001 A1002 C1006 T1010	Y1001-T1008 CarbonylContact C-O 3.54Å; Y1001-T1008 VanDerWaalsContact CA-O 3.27Å; Y1001-T1008 WeakPolarHBondContact CA-O 3.22Å; A1002-T1008 CarbonylContact C-O 3.51Å; A1002-T1008 PolarHBondContact N-O 2.98Å; A1002-T1008 WeakPolarHBondContact O-CA 3.33Å; A1002-T1008 WeakPolarHBondContact O-CB 3.27Å; A1002-T1008 PolarHBondContact O-N 2.89Å; A1002-T1008 PolarHBondContact O-OG1 3.2Å; C1006-T1008 VanDerWaalsContact C-N 3.34Å; C1006-T1008 PolarHBondContact O-N 2.91Å; T1008-T1010 PolarHBondContact O-N 3.04Å
1009	R	76.8	Confident	79.9	Confident	136 Å²	136	73.9 Å²	73.9	51%	0.513	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	125.6	171.4	-99.6	-170.1	-174.7	-173.3	-1.4	111.8	G1000 Y1001 N1024 G1025	G1000-R1009 CarbonylContact O-C 3.57Å; G1000-R1009 VanDerWaalsContact O-CA 3.28Å; G1000-R1009 WeakPolarHBondContact O-CA 3.3Å; G1000-R1009 VanDerWaalsContact O-CG 3.24Å; G1000-R1009 WeakPolarHBondContact O-CG 3.27Å; Y1001-R1009 HydrophobicContact CD1-CB 4.42Å; Y1001-R1009 HydrophobicContact CD1-CG 3.95Å; Y1001-R1009 HydrophobicContact CE1-CB 4.25Å; Y1001-R1009 HydrophobicContact CE1-CG 3.6Å; Y1001-R1009 VanDerWaalsContact CE1-CG 3.45Å; Y1001-R1009 HydrophobicContact CG-CG 4.48Å; Y1001-R1009 PolarHBondContact OH-NE 3.12Å; Y1001-R1009 VanDerWaalsContact OH-NE 3.11Å; Y1001-R1009 PolarHBondContact OH-NH2 2.83Å; R1009-N1024 VanDerWaalsContact CB-C 3.48Å; R1009-N1024 WeakPolarHBondContact CB-O 3.37Å; R1009-G1025 PolarHBondContact O-N 3.04Å
1010	T	76	Confident	80.1	Confident	57.2 Å²	57.2	64.9 Å²	64.9	35%	0.351	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-94.8	154	172.4	39.3	0	0	0	0	110.8	G1000 Y1001 A1002 T1008 G1025	G1000-T1010 CarbonylContact C-O 3.41Å; G1000-T1010 VanDerWaalsContact C-OG1 3.23Å; G1000-T1010 VanDerWaalsContact CA-O 3.3Å; G1000-T1010 WeakPolarHBondContact CA-O 3.32Å; G1000-T1010 WeakPolarHBondContact CA-OG1 3.15Å; G1000-T1010 PolarHBondContact O-N 3.14Å; G1000-T1010 VanDerWaalsContact O-O 3.04Å; G1000-T1010 PolarHBondContact O-OG1 3.35Å; Y1001-T1010 WeakPolarHBondContact CA-OG1 3.43Å; Y1001-T1010 PolarHBondContact N-OG1 3.04Å; Y1001-T1010 PolarHBondContact O-OG1 2.95Å; Y1001-T1010 VanDerWaalsContact O-OG1 3.09Å; A1002-T1010 HydrophobicContact CB-CG2 3.52Å; A1002-T1010 VanDerWaalsContact CB-CG2 3.47Å; A1002-T1010 WeakPolarHBondContact CB-OG1 3.37Å; T1008-T1010 PolarHBondContact O-N 3.04Å; T1010-G1025 WeakPolarHBondContact O-CA 3.31Å
1011	C	76	Confident	80.5	Confident	16.8 Å²	16.8	67.2 Å²	67.2	11%	0.114	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-81.4	146.9	179.2	-65.1	0	0	0	0	111.8	S1013 C1022 G1025 N1026 C1027	C1011-S1013 VanDerWaalsContact C-N 3.29Å; C1011-S1013 PolarHBondContact O-N 2.95Å; C1011-S1013 VanDerWaalsContact O-N 3.09Å; C1011-C1022 HydrophobicContact CB-CB 3.9Å; C1011-C1022 WeakPolarHBondContact CB-SG 3.42Å; C1011-C1022 PolarHBondContact N-SG 3.04Å; C1011-C1022 VanDerWaalsContact N-SG 3.41Å; C1011-C1022 WeakPolarHBondContact SG-CA 3.45Å; C1011-C1022 WeakPolarHBondContact SG-CB 3.3Å; C1011-C1022 CovalentContact SG-SG 2.03Å; C1011-C1022 PolarHBondContact SG-SG 3.08Å; C1011-G1025 WeakPolarHBondContact CA-O 3.28Å; C1011-G1025 PolarHBondContact SG-O 3.31Å; C1011-G1025 VanDerWaalsContact SG-O 3.4Å; C1011-N1026 VanDerWaalsContact SG-C 3.5Å; C1011-N1026 PolarHBondContact SG-N 2.96Å; C1011-N1026 PolarHBondContact SG-O 2.95Å; C1011-N1026 VanDerWaalsContact SG-O 3.39Å; C1011-C1027 VanDerWaalsContact CB-SG 3.56Å
1012	I	72.4	Confident	80.4	Confident	134.4 Å²	134.4	67 Å²	67	69%	0.689	37%	0.373	S	S	*	.	S	Bend	trans	-55.1	-27.8	-177	-79	167.5	0	0	0	113.5	I1036	I1012-I1036 HydrophobicContact CB-CG2 4.43Å; I1012-I1036 HydrophobicContact CD1-CG2 3.97Å; I1012-I1036 HydrophobicContact CG2-CG2 4.22Å
1013	S	68.8	Low	80.2	Confident	28.4 Å²	28.4	70 Å²	70	20%	0.199	38%	0.382	C	S	.	.	S	Bend	trans	-117.4	132.4	175.4	1.7	0	0	0	0	110.9	C1011 N1015 C1016 S1017 G1037	C1011-S1013 VanDerWaalsContact C-N 3.29Å; C1011-S1013 PolarHBondContact O-N 2.95Å; C1011-S1013 VanDerWaalsContact O-N 3.09Å; S1013-N1015 PolarHBondContact O-N 3.06Å; S1013-N1015 VanDerWaalsContact O-N 3.17Å; S1013-C1016 PolarHBondContact O-N 2.97Å; S1013-C1016 WeakPolarHBondContact OG-CA 3.35Å; S1013-S1017 PolarHBondContact OG-N 3.34Å; S1013-S1017 PolarHBondContact OG-OG 2.89Å; S1013-G1037 WeakPolarHBondContact OG-CA 3.26Å; S1013-G1037 PolarHBondContact OG-O 2.94Å
1014	F	69.1	Low	79.8	Confident	205 Å²	205	75.7 Å²	75.7	90%	0.899	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-58.3	121	179.3	-149.5	-91	0	0	0	110.3	C1016 S1017	F1014-C1016 PolarHBondContact O-N 3.27Å; F1014-C1016 VanDerWaalsContact O-N 3.12Å; F1014-S1017 PolarHBondContact O-N 3.23Å
1015	N	75	Confident	79.4	Confident	114.2 Å²	114.2	69.4 Å²	69.4	61%	0.611	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	48.9	34.7	-172.8	-163	40.7	0	0	0	114.7	S1013 S1017 G1018	S1013-N1015 PolarHBondContact O-N 3.06Å; S1013-N1015 VanDerWaalsContact O-N 3.17Å; N1015-S1017 VanDerWaalsContact C-N 3.29Å; N1015-S1017 PolarHBondContact O-N 3.2Å; N1015-G1018 WeakPolarHBondContact O-CA 3.36Å; N1015-G1018 PolarHBondContact O-N 3.01Å
1016	C	83	Confident	79.1	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	39%	0.391	C	S	.	.	G	3₁₀ helix	trans	50.2	48.3	178	-60.7	0	0	0	0	113.2	S1013 F1014 G1018 H1019 G1020 V1021 C1022 C1027 G1037	S1013-C1016 PolarHBondContact O-N 2.97Å; S1013-C1016 WeakPolarHBondContact OG-CA 3.35Å; F1014-C1016 PolarHBondContact O-N 3.27Å; F1014-C1016 VanDerWaalsContact O-N 3.12Å; C1016-G1018 PolarHBondContact O-N 3.07Å; C1016-H1019 CarbonylContact O-C 3.34Å; C1016-H1019 WeakPolarHBondContact O-CA 3.02Å; C1016-H1019 PolarHBondContact O-N 2.99Å; C1016-G1020 PolarHBondContact O-N 2.94Å; C1016-V1021 VanDerWaalsContact SG-C 3.56Å; C1016-C1022 PolarHBondContact SG-N 3.46Å; C1016-C1027 VanDerWaalsContact CA-SG 3.55Å; C1016-C1027 WeakPolarHBondContact CA-SG 3.43Å; C1016-C1027 HydrophobicContact CB-CB 3.69Å; C1016-C1027 WeakPolarHBondContact CB-SG 3.42Å; C1016-C1027 VanDerWaalsContact SG-CA 3.52Å; C1016-C1027 WeakPolarHBondContact SG-CA 3.43Å; C1016-C1027 WeakPolarHBondContact SG-CB 3.24Å; C1016-C1027 CovalentContact SG-SG 2.03Å; C1016-C1027 PolarHBondContact SG-SG 2.99Å; C1016-G1037 CarbonylContact C-O 3.24Å; C1016-G1037 WeakPolarHBondContact CA-O 3.37Å; C1016-G1037 VanDerWaalsContact O-O 3.09Å
1017	S	85.2	Confident	78.8	Confident	50.8 Å²	50.8	73.6 Å²	73.6	36%	0.355	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	57.3	16.2	-177.4	-49.8	0	0	0	0	114.9	S1013 F1014 N1015 H1019 G1037	S1013-S1017 PolarHBondContact OG-N 3.34Å; S1013-S1017 PolarHBondContact OG-OG 2.89Å; F1014-S1017 PolarHBondContact O-N 3.23Å; N1015-S1017 VanDerWaalsContact C-N 3.29Å; N1015-S1017 PolarHBondContact O-N 3.2Å; S1017-H1019 VanDerWaalsContact C-N 3.26Å; S1017-H1019 PolarHBondContact O-CD2 3.09Å; S1017-H1019 PolarHBondContact O-N 2.97Å; S1017-G1037 VanDerWaalsContact CB-O 3.28Å; S1017-G1037 WeakPolarHBondContact CB-O 3.27Å; S1017-G1037 PolarHBondContact N-O 3.05Å; S1017-G1037 PolarHBondContact OG-O 3.14Å
1018	G	83.6	Confident	78.7	Confident	41 Å²	41	77 Å²	77	42%	0.423	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	76.3	5.8	-170.4	0	0	0	0	0	114.3	N1015 C1016	N1015-G1018 WeakPolarHBondContact O-CA 3.36Å; N1015-G1018 PolarHBondContact O-N 3.01Å; C1016-G1018 PolarHBondContact O-N 3.07Å
1019	H	87.7	Confident	79	Confident	60 Å²	60	75.6 Å²	75.6	28%	0.278	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.6	16.1	-169.1	-62.6	-34.2	0	0	0	113.5	C1016 S1017 C1029 F1030 W1033 C1038	C1016-H1019 CarbonylContact O-C 3.34Å; C1016-H1019 WeakPolarHBondContact O-CA 3.02Å; C1016-H1019 PolarHBondContact O-N 2.99Å; S1017-H1019 VanDerWaalsContact C-N 3.26Å; S1017-H1019 PolarHBondContact O-CD2 3.09Å; S1017-H1019 PolarHBondContact O-N 2.97Å; H1019-C1029 CarbonylContact O-C 3.39Å; H1019-C1029 VanDerWaalsContact O-CA 3.32Å; H1019-C1029 WeakPolarHBondContact O-CA 3.37Å; H1019-F1030 WeakPolarHBondContact O-CD2 3.3Å; H1019-F1030 PolarHBondContact O-N 3.1Å; H1019-W1033 HydrophobicContact CB-CB 4.07Å; H1019-W1033 HydrophobicContact CB-CD2 3.73Å; H1019-W1033 HydrophobicContact CB-CE3 4.06Å; H1019-W1033 HydrophobicContact CB-CG 3.7Å; H1019-W1033 AromaticContact CD2-CD2 3.65Å; H1019-W1033 AromaticContact CD2-CE2 3.77Å; H1019-W1033 AromaticContact CD2-CE3 3.41Å; H1019-W1033 VanDerWaalsContact CD2-CE3 3.46Å; H1019-W1033 AromaticContact CD2-CH2 3.48Å; H1019-W1033 VanDerWaalsContact CD2-CH2 3.48Å; H1019-W1033 WeakPolarHBondContact CD2-CH2 3.41Å; H1019-W1033 AromaticContact CD2-CZ2 3.72Å; H1019-W1033 AromaticContact CD2-CZ3 3.32Å; H1019-W1033 VanDerWaalsContact CD2-CZ3 3.41Å; H1019-W1033 WeakPolarHBondContact CD2-CZ3 3.35Å; H1019-W1033 AromaticContact CE1-CE2 3.94Å; H1019-W1033 AromaticContact CE1-CH2 3.93Å; H1019-W1033 AromaticContact CE1-CZ2 3.64Å; H1019-W1033 AromaticContact CG-CD2 3.55Å; H1019-W1033 AromaticContact CG-CE2 3.65Å; H1019-W1033 AromaticContact CG-CE3 3.79Å; H1019-W1033 AromaticContact CG-CG 3.98Å; H1019-W1033 AromaticContact CG-CZ2 3.96Å; H1019-W1033 AromaticContact ND1-CE2 3.76Å; H1019-W1033 AromaticContact ND1-CZ2 3.92Å; H1019-W1033 AromaticContact ND1-NE1 3.96Å; H1019-W1033 AromaticContact NE2-CE2 3.93Å; H1019-W1033 AromaticContact NE2-CH2 3.3Å; H1019-W1033 VanDerWaalsContact NE2-CH2 3.29Å; H1019-W1033 WeakPolarHBondContact NE2-CH2 3.28Å; H1019-W1033 AromaticContact NE2-CZ2 3.48Å; H1019-W1033 WeakPolarHBondContact NE2-CZ2 3.4Å; H1019-W1033 AromaticContact NE2-CZ3 3.66Å; H1019-C1038 HydrophobicContact CB-CB 3.93Å; H1019-C1038 WeakPolarHBondContact CB-O 3.35Å; H1019-C1038 WeakPolarHBondContact O-CB 3.29Å
1020	G	86.2	Confident	79.3	Confident	2.6 Å²	2.6	74.1 Å²	74.1	3%	0.027	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.9	-177.1	171.4	0	0	0	0	0	113.8	C1016 R1028	C1016-G1020 PolarHBondContact O-N 2.94Å; G1020-R1028 CarbonylContact C-O 3.54Å; G1020-R1028 WeakPolarHBondContact CA-O 3.47Å
1021	V	83.8	Confident	79.5	Confident	75.4 Å²	75.4	79.2 Å²	79.2	46%	0.457	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	132.1	174.9	-176.7	0	0	0	0	109.3	C1016 M1023 R1028 F1030	C1016-V1021 VanDerWaalsContact SG-C 3.56Å; V1021-M1023 HydrophobicContact CG1-CG 4.36Å; V1021-R1028 PolarHBondContact N-O 3.11Å; V1021-R1028 PolarHBondContact O-N 2.88Å; V1021-F1030 HydrophobicContact CG2-CE1 3.7Å; V1021-F1030 HydrophobicContact CG2-CZ 3.85Å
1022	C	81	Confident	79.6	Confident	54 Å²	54	79.9 Å²	79.9	37%	0.365	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	127.9	176.5	-176.5	0	0	0	0	111.1	C1011 C1016	C1011-C1022 HydrophobicContact CB-CB 3.9Å; C1011-C1022 WeakPolarHBondContact CB-SG 3.42Å; C1011-C1022 PolarHBondContact N-SG 3.04Å; C1011-C1022 VanDerWaalsContact N-SG 3.41Å; C1011-C1022 WeakPolarHBondContact SG-CA 3.45Å; C1011-C1022 WeakPolarHBondContact SG-CB 3.3Å; C1011-C1022 CovalentContact SG-SG 2.03Å; C1011-C1022 PolarHBondContact SG-SG 3.08Å; C1016-C1022 PolarHBondContact SG-N 3.46Å
1023	M	77.6	Confident	80.3	Confident	95.6 Å²	95.6	77.5 Å²	77.5	47%	0.471	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	118.2	173.2	-55.1	-166.5	-36.3	0	0	110.3	V1021 G1025 N1026 R1028	V1021-M1023 HydrophobicContact CG1-CG 4.36Å; M1023-G1025 PolarHBondContact O-N 2.89Å; M1023-G1025 VanDerWaalsContact O-N 3.11Å; M1023-N1026 PolarHBondContact N-O 2.93Å; M1023-N1026 PolarHBondContact O-N 3.25Å; M1023-N1026 VanDerWaalsContact O-O 3.09Å; M1023-R1028 VanDerWaalsContact CE-CD 3.49Å; M1023-R1028 HydrophobicContact CE-CG 4.07Å; M1023-R1028 HydrophobicContact SD-CG 4.37Å
1024	N	72.9	Confident	80.9	Confident	151.2 Å²	151.2	78.2 Å²	78.2	81%	0.809	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	34	177.8	-61.8	-1.3	0	0	0	114.8	R1009	R1009-N1024 VanDerWaalsContact CB-C 3.48Å; R1009-N1024 WeakPolarHBondContact CB-O 3.37Å
1025	G	72.8	Confident	81.5	Confident	13.2 Å²	13.2	70 Å²	70	14%	0.136	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	90.9	-8	-178.9	0	0	0	0	0	116.1	R1009 T1010 C1011 M1023	R1009-G1025 PolarHBondContact O-N 3.04Å; T1010-G1025 WeakPolarHBondContact O-CA 3.31Å; C1011-G1025 WeakPolarHBondContact CA-O 3.28Å; C1011-G1025 PolarHBondContact SG-O 3.31Å; C1011-G1025 VanDerWaalsContact SG-O 3.4Å; M1023-G1025 PolarHBondContact O-N 2.89Å; M1023-G1025 VanDerWaalsContact O-N 3.11Å
1026	N	79.2	Confident	81.7	Confident	111.2 Å²	111.2	70.3 Å²	70.3	60%	0.595	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.7	136.7	173.5	-78.8	20.1	0	0	0	111.3	C1011 M1023	C1011-N1026 VanDerWaalsContact SG-C 3.5Å; C1011-N1026 PolarHBondContact SG-N 2.96Å; C1011-N1026 PolarHBondContact SG-O 2.95Å; C1011-N1026 VanDerWaalsContact SG-O 3.39Å; M1023-N1026 PolarHBondContact N-O 2.93Å; M1023-N1026 PolarHBondContact O-N 3.25Å; M1023-N1026 VanDerWaalsContact O-O 3.09Å
1027	C	81.4	Confident	81.7	Confident	21.6 Å²	21.6	70.4 Å²	70.4	15%	0.146	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	133.7	172.8	-73.6	0	0	0	0	111.7	C1011 C1016 I1036 C1038	C1011-C1027 VanDerWaalsContact CB-SG 3.56Å; C1016-C1027 VanDerWaalsContact CA-SG 3.55Å; C1016-C1027 WeakPolarHBondContact CA-SG 3.43Å; C1016-C1027 HydrophobicContact CB-CB 3.69Å; C1016-C1027 WeakPolarHBondContact CB-SG 3.42Å; C1016-C1027 VanDerWaalsContact SG-CA 3.52Å; C1016-C1027 WeakPolarHBondContact SG-CA 3.43Å; C1016-C1027 WeakPolarHBondContact SG-CB 3.24Å; C1016-C1027 CovalentContact SG-SG 2.03Å; C1016-C1027 PolarHBondContact SG-SG 2.99Å; C1027-I1036 WeakPolarHBondContact CB-O 3.39Å; C1027-C1038 VanDerWaalsContact CB-SG 3.6Å
1028	R	84	Confident	81.7	Confident	177 Å²	177	68 Å²	68	67%	0.668	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.3	112.3	166.7	-94.7	-164.3	175.6	-150.9	-0.9	109.8	G1020 V1021 M1023	G1020-R1028 CarbonylContact C-O 3.54Å; G1020-R1028 WeakPolarHBondContact CA-O 3.47Å; V1021-R1028 PolarHBondContact N-O 3.11Å; V1021-R1028 PolarHBondContact O-N 2.88Å; M1023-R1028 VanDerWaalsContact CE-CD 3.49Å; M1023-R1028 HydrophobicContact CE-CG 4.07Å; M1023-R1028 HydrophobicContact SD-CG 4.37Å
1029	C	86.2	Confident	81.9	Confident	42 Å²	42	70.2 Å²	70.2	28%	0.284	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	149.5	-172.8	-48.6	0	0	0	0	113.1	H1019 W1033 C1038	H1019-C1029 CarbonylContact O-C 3.39Å; H1019-C1029 VanDerWaalsContact O-CA 3.32Å; H1019-C1029 WeakPolarHBondContact O-CA 3.37Å; C1029-W1033 HydrophobicContact CB-CB 4.09Å; C1029-W1033 VanDerWaalsContact CB-O 3.28Å; C1029-W1033 WeakPolarHBondContact CB-O 3.26Å; C1029-C1038 WeakPolarHBondContact CA-SG 3.43Å; C1029-C1038 HydrophobicContact CB-CB 3.73Å; C1029-C1038 WeakPolarHBondContact CB-SG 3.37Å; C1029-C1038 PolarHBondContact N-SG 3.04Å; C1029-C1038 VanDerWaalsContact N-SG 3.42Å; C1029-C1038 WeakPolarHBondContact SG-CA 3.28Å; C1029-C1038 WeakPolarHBondContact SG-CB 3.3Å; C1029-C1038 CovalentContact SG-SG 2.04Å; C1029-C1038 PolarHBondContact SG-SG 3.1Å
1030	F	83.4	Confident	81.6	Confident	104 Å²	104	71.8 Å²	71.8	46%	0.456	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-72.8	158.6	169	-56.5	-49.4	0	0	0	110.5	H1019 V1021 G1032 W1033	H1019-F1030 WeakPolarHBondContact O-CD2 3.3Å; H1019-F1030 PolarHBondContact O-N 3.1Å; V1021-F1030 HydrophobicContact CG2-CE1 3.7Å; V1021-F1030 HydrophobicContact CG2-CZ 3.85Å; F1030-G1032 PolarHBondContact O-N 2.94Å; F1030-W1033 WeakPolarHBondContact O-CB 3.49Å; F1030-W1033 PolarHBondContact O-N 3.09Å; F1030-W1033 VanDerWaalsContact O-N 3.09Å
1031	N	79.7	Confident	81	Confident	165 Å²	165	75.7 Å²	75.7	88%	0.882	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	134.2	179.4	-76.1	5.6	0	0	0	111.3	W1033	N1031-W1033 VanDerWaalsContact C-N 3.31Å
1032	G	78.4	Confident	80.3	Confident	30.6 Å²	30.6	75.3 Å²	75.3	32%	0.315	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.8	0.7	-173.6	0	0	0	0	0	114.8	F1030 P1041 V1042	F1030-G1032 PolarHBondContact O-N 2.94Å; G1032-P1041 CarbonylContact O-C 3.36Å; G1032-P1041 VanDerWaalsContact O-CA 3.3Å; G1032-P1041 WeakPolarHBondContact O-CA 3.28Å; G1032-V1042 PolarHBondContact O-N 2.99Å
1033	W	86.3	Confident	79.1	Confident	85.2 Å²	85.2	77.7 Å²	77.7	32%	0.323	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	153.1	178.4	-62.2	89.6	0	0	0	112.7	H1019 C1029 F1030 N1031 L1040 P1041	H1019-W1033 HydrophobicContact CB-CB 4.07Å; H1019-W1033 HydrophobicContact CB-CD2 3.73Å; H1019-W1033 HydrophobicContact CB-CE3 4.06Å; H1019-W1033 HydrophobicContact CB-CG 3.7Å; H1019-W1033 AromaticContact CD2-CD2 3.65Å; H1019-W1033 AromaticContact CD2-CE2 3.77Å; H1019-W1033 AromaticContact CD2-CE3 3.41Å; H1019-W1033 VanDerWaalsContact CD2-CE3 3.46Å; H1019-W1033 AromaticContact CD2-CH2 3.48Å; H1019-W1033 VanDerWaalsContact CD2-CH2 3.48Å; H1019-W1033 WeakPolarHBondContact CD2-CH2 3.41Å; H1019-W1033 AromaticContact CD2-CZ2 3.72Å; H1019-W1033 AromaticContact CD2-CZ3 3.32Å; H1019-W1033 VanDerWaalsContact CD2-CZ3 3.41Å; H1019-W1033 WeakPolarHBondContact CD2-CZ3 3.35Å; H1019-W1033 AromaticContact CE1-CE2 3.94Å; H1019-W1033 AromaticContact CE1-CH2 3.93Å; H1019-W1033 AromaticContact CE1-CZ2 3.64Å; H1019-W1033 AromaticContact CG-CD2 3.55Å; H1019-W1033 AromaticContact CG-CE2 3.65Å; H1019-W1033 AromaticContact CG-CE3 3.79Å; H1019-W1033 AromaticContact CG-CG 3.98Å; H1019-W1033 AromaticContact CG-CZ2 3.96Å; H1019-W1033 AromaticContact ND1-CE2 3.76Å; H1019-W1033 AromaticContact ND1-CZ2 3.92Å; H1019-W1033 AromaticContact ND1-NE1 3.96Å; H1019-W1033 AromaticContact NE2-CE2 3.93Å; H1019-W1033 AromaticContact NE2-CH2 3.3Å; H1019-W1033 VanDerWaalsContact NE2-CH2 3.29Å; H1019-W1033 WeakPolarHBondContact NE2-CH2 3.28Å; H1019-W1033 AromaticContact NE2-CZ2 3.48Å; H1019-W1033 WeakPolarHBondContact NE2-CZ2 3.4Å; H1019-W1033 AromaticContact NE2-CZ3 3.66Å; C1029-W1033 HydrophobicContact CB-CB 4.09Å; C1029-W1033 VanDerWaalsContact CB-O 3.28Å; C1029-W1033 WeakPolarHBondContact CB-O 3.26Å; F1030-W1033 WeakPolarHBondContact O-CB 3.49Å; F1030-W1033 PolarHBondContact O-N 3.09Å; F1030-W1033 VanDerWaalsContact O-N 3.09Å; N1031-W1033 VanDerWaalsContact C-N 3.31Å; W1033-L1040 CarbonylContact C-O 3.37Å; W1033-L1040 WeakPolarHBondContact CA-O 3.45Å; W1033-P1041 HydrophobicContact CD2-CB 4.43Å; W1033-P1041 HydrophobicContact CE3-CB 3.99Å; W1033-P1041 HydrophobicContact CH2-CB 4.01Å; W1033-P1041 HydrophobicContact CH2-CG 4.43Å; W1033-P1041 HydrophobicContact CZ2-CB 4.43Å; W1033-P1041 HydrophobicContact CZ3-CB 3.75Å; W1033-P1041 HydrophobicContact CZ3-CG 4.07Å
1034	S	82.9	Confident	77.5	Confident	43.4 Å²	43.4	79.5 Å²	79.5	30%	0.303	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	179.7	-173.7	64.6	0	0	0	0	110.2	C1038 E1039 L1040 V1042	S1034-C1038 CarbonylContact O-C 3.39Å; S1034-C1038 VanDerWaalsContact O-CA 3.23Å; S1034-C1038 WeakPolarHBondContact O-CA 3.32Å; S1034-E1039 PolarHBondContact O-N 3.04Å; S1034-L1040 WeakPolarHBondContact CA-O 3.37Å; S1034-L1040 PolarHBondContact N-O 3.02Å; S1034-L1040 WeakPolarHBondContact O-CA 3.38Å; S1034-L1040 WeakPolarHBondContact O-CB 3.38Å; S1034-L1040 PolarHBondContact O-N 2.94Å; S1034-L1040 WeakPolarHBondContact OG-CB 3.32Å; S1034-L1040 PolarHBondContact OG-O 3.16Å; S1034-V1042 WeakPolarHBondContact OG-CG2 3.4Å
1035	G	81	Confident	76.2	Confident	31 Å²	31	80.7 Å²	80.7	32%	0.32	44%	0.435	S	S	.	.	S	Bend	trans	98.6	171.2	-171.4	0	0	0	0	0	112.5	G1037 C1038 E1039	G1035-G1037 VanDerWaalsContact C-N 3.32Å; G1035-G1037 PolarHBondContact O-N 3.03Å; G1035-C1038 PolarHBondContact O-N 2.78Å; G1035-E1039 VanDerWaalsContact CA-OE1 3.24Å; G1035-E1039 WeakPolarHBondContact CA-OE1 3.32Å
1036	I	79	Confident	74.6	Confident	121 Å²	121	87.9 Å²	87.9	62%	0.621	47%	0.47	S	S	*	.	S	Bend	trans	-77	-29.2	-171.4	-66.6	172.7	0	0	0	111.4	I1012 C1027 E1039	I1012-I1036 HydrophobicContact CB-CG2 4.43Å; I1012-I1036 HydrophobicContact CD1-CG2 3.97Å; I1012-I1036 HydrophobicContact CG2-CG2 4.22Å; C1027-I1036 WeakPolarHBondContact CB-O 3.39Å; I1036-E1039 PolarHBondContact N-OE1 3.11Å; I1036-E1039 VanDerWaalsContact N-OE1 3.11Å; I1036-E1039 PolarHBondContact N-OE2 3Å; I1036-E1039 VanDerWaalsContact N-OE2 3.15Å
1037	G	82.8	Confident	72.6	Confident	2.4 Å²	2.4	88.8 Å²	88.8	3%	0.025	47%	0.473	C	S	.	.	S	Bend	trans	-113.6	19.3	171.3	0	0	0	0	0	113.4	S1013 C1016 S1017 G1035 E1039	S1013-G1037 WeakPolarHBondContact OG-CA 3.26Å; S1013-G1037 PolarHBondContact OG-O 2.94Å; C1016-G1037 CarbonylContact C-O 3.24Å; C1016-G1037 WeakPolarHBondContact CA-O 3.37Å; C1016-G1037 VanDerWaalsContact O-O 3.09Å; S1017-G1037 VanDerWaalsContact CB-O 3.28Å; S1017-G1037 WeakPolarHBondContact CB-O 3.27Å; S1017-G1037 PolarHBondContact N-O 3.05Å; S1017-G1037 PolarHBondContact OG-O 3.14Å; G1035-G1037 VanDerWaalsContact C-N 3.32Å; G1035-G1037 PolarHBondContact O-N 3.03Å; G1037-E1039 VanDerWaalsContact C-N 3.3Å; G1037-E1039 VanDerWaalsContact CA-OE2 3.22Å; G1037-E1039 WeakPolarHBondContact CA-OE2 3.35Å; G1037-E1039 PolarHBondContact N-OE2 2.83Å; G1037-E1039 PolarHBondContact O-N 2.92Å
1038	C	86.7	Confident	70.3	Confident	0 Å²	0	95.4 Å²	95.4	0%	0	51%	0.507	C	S	.	.	S	Bend	trans	63.1	26.8	-176.7	-52.1	0	0	0	0	115.8	H1019 C1027 C1029 S1034 G1035 L1040	H1019-C1038 HydrophobicContact CB-CB 3.93Å; H1019-C1038 WeakPolarHBondContact CB-O 3.35Å; H1019-C1038 WeakPolarHBondContact O-CB 3.29Å; C1027-C1038 VanDerWaalsContact CB-SG 3.6Å; C1029-C1038 WeakPolarHBondContact CA-SG 3.43Å; C1029-C1038 HydrophobicContact CB-CB 3.73Å; C1029-C1038 WeakPolarHBondContact CB-SG 3.37Å; C1029-C1038 PolarHBondContact N-SG 3.04Å; C1029-C1038 VanDerWaalsContact N-SG 3.42Å; C1029-C1038 WeakPolarHBondContact SG-CA 3.28Å; C1029-C1038 WeakPolarHBondContact SG-CB 3.3Å; C1029-C1038 CovalentContact SG-SG 2.04Å; C1029-C1038 PolarHBondContact SG-SG 3.1Å; S1034-C1038 CarbonylContact O-C 3.39Å; S1034-C1038 VanDerWaalsContact O-CA 3.23Å; S1034-C1038 WeakPolarHBondContact O-CA 3.32Å; G1035-C1038 PolarHBondContact O-N 2.78Å; C1038-L1040 PolarHBondContact O-N 3.07Å
1039	E	86.1	Confident	68.1	Low	87.8 Å²	87.8	92.5 Å²	92.5	41%	0.41	51%	0.514	S	S	.	.			trans	-77.1	-12.4	-176.6	69.1	-71.4	168.7	0	0	115.6	S1034 G1035 I1036 G1037	S1034-E1039 PolarHBondContact O-N 3.04Å; G1035-E1039 VanDerWaalsContact CA-OE1 3.24Å; G1035-E1039 WeakPolarHBondContact CA-OE1 3.32Å; I1036-E1039 PolarHBondContact N-OE1 3.11Å; I1036-E1039 VanDerWaalsContact N-OE1 3.11Å; I1036-E1039 PolarHBondContact N-OE2 3Å; I1036-E1039 VanDerWaalsContact N-OE2 3.15Å; G1037-E1039 VanDerWaalsContact C-N 3.3Å; G1037-E1039 VanDerWaalsContact CA-OE2 3.22Å; G1037-E1039 WeakPolarHBondContact CA-OE2 3.35Å; G1037-E1039 PolarHBondContact N-OE2 2.83Å; G1037-E1039 PolarHBondContact O-N 2.92Å
1040	L	81.4	Confident	65.6	Low	94 Å²	94	99.2 Å²	99.2	49%	0.492	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	110.5	-172.6	-57.1	178.8	0	0	0	112.2	W1033 S1034 C1038 V1042	W1033-L1040 CarbonylContact C-O 3.37Å; W1033-L1040 WeakPolarHBondContact CA-O 3.45Å; S1034-L1040 WeakPolarHBondContact CA-O 3.37Å; S1034-L1040 PolarHBondContact N-O 3.02Å; S1034-L1040 WeakPolarHBondContact O-CA 3.38Å; S1034-L1040 WeakPolarHBondContact O-CB 3.38Å; S1034-L1040 PolarHBondContact O-N 2.94Å; S1034-L1040 WeakPolarHBondContact OG-CB 3.32Å; S1034-L1040 PolarHBondContact OG-O 3.16Å; C1038-L1040 PolarHBondContact O-N 3.07Å; L1040-V1042 PolarHBondContact O-N 3.05Å
1041	P	73.5	Confident	63.3	Low	84.2 Å²	84.2	101.6 Å²	101.6	55%	0.547	56%	0.558	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-70.5	134.8	173.9	28.3	-32.5	0	0	0	111.3	G1032 W1033 P1043	G1032-P1041 CarbonylContact O-C 3.36Å; G1032-P1041 VanDerWaalsContact O-CA 3.3Å; G1032-P1041 WeakPolarHBondContact O-CA 3.28Å; W1033-P1041 HydrophobicContact CD2-CB 4.43Å; W1033-P1041 HydrophobicContact CE3-CB 3.99Å; W1033-P1041 HydrophobicContact CH2-CB 4.01Å; W1033-P1041 HydrophobicContact CH2-CG 4.43Å; W1033-P1041 HydrophobicContact CZ2-CB 4.43Å; W1033-P1041 HydrophobicContact CZ3-CB 3.75Å; W1033-P1041 HydrophobicContact CZ3-CG 4.07Å; P1041-P1043 WeakPolarHBondContact O-CD 3.36Å
1042	V	70	Confident	61.1	Low	66.6 Å²	66.6	101 Å²	101	40%	0.404	55%	0.553	S	S	.	*	P	Polyproline II helix	trans	-87.6	121.3	-179	-175.2	0	0	0	0	109.6	G1032 S1034 L1040 N1044	G1032-V1042 PolarHBondContact O-N 2.99Å; S1034-V1042 WeakPolarHBondContact OG-CG2 3.4Å; L1040-V1042 PolarHBondContact O-N 3.05Å; V1042-N1044 PolarHBondContact O-N 3.3Å
1043	P	55.5	Low	58.9	Low	105.6 Å²	105.6	107.9 Å²	107.9	69%	0.686	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-64.2	131.3	-177.9	-24.9	35.6	0	0	0	113.8	P1041 H1045 L1046	P1041-P1043 WeakPolarHBondContact O-CD 3.36Å; P1043-H1045 VanDerWaalsContact C-N 3.28Å; P1043-H1045 PolarHBondContact O-N 3.17Å; P1043-H1045 VanDerWaalsContact O-N 3.07Å; P1043-L1046 PolarHBondContact O-N 2.8Å
1044	N	45.4	Very low	56.5	Low	133.2 Å²	133.2	109.3 Å²	109.3	71%	0.712	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	56.6	-177.1	-78	-25.2	0	0	0	114.4	V1042 I1047	V1042-N1044 PolarHBondContact O-N 3.3Å; N1044-I1047 HydrophobicContact CB-CD1 4.2Å; N1044-I1047 WeakPolarHBondContact OD1-CD1 3.33Å
1045	H	45.3	Very low	54.2	Low	176.2 Å²	176.2	111.7 Å²	111.7	82%	0.816	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.9	6.7	175	-82.7	-57.4	0	0	0	115.4	P1043	P1043-H1045 VanDerWaalsContact C-N 3.28Å; P1043-H1045 PolarHBondContact O-N 3.17Å; P1043-H1045 VanDerWaalsContact O-N 3.07Å
1046	L	37.9	Very low	51.9	Low	163.6 Å²	163.6	118 Å²	118	86%	0.857	64%	0.64	S	S	*	*			trans	-126.3	50.1	172.4	-72.5	174.3	0	0	0	113	P1043 N1048	P1043-L1046 PolarHBondContact O-N 2.8Å; L1046-N1048 VanDerWaalsContact C-N 3.3Å; L1046-N1048 PolarHBondContact O-N 3.04Å; L1046-N1048 VanDerWaalsContact O-N 3.17Å
1047	I	38	Very low	49.7	Very low	130.6 Å²	130.6	116 Å²	116	67%	0.67	65%	0.649	S	S	*	*			trans	-101.2	79.6	175.8	-58.3	175.4	0	0	0	109.3	N1044	N1044-I1047 HydrophobicContact CB-CD1 4.2Å; N1044-I1047 WeakPolarHBondContact OD1-CD1 3.33Å
1048	N	33	Very low	47.4	Very low	160.2 Å²	160.2	120.4 Å²	120.4	86%	0.857	69%	0.685	S	S	*	*			trans	-158.2	74.4	168.5	-85.1	-13.7	0	0	0	112.8	L1046	L1046-N1048 VanDerWaalsContact C-N 3.3Å; L1046-N1048 PolarHBondContact O-N 3.04Å; L1046-N1048 VanDerWaalsContact O-N 3.17Å
1049	S	37.6	Very low	44.9	Very low	116.6 Å²	116.6	126 Å²	126	82%	0.815	72%	0.724	S	S	*	*			trans	-155.3	132.2	152.6	-129.7	0	0	0	0	109.8	L1051	S1049-L1051 PolarHBondContact O-N 3.15Å
1050	E	34.6	Very low	42.6	Very low	181.2 Å²	181.2	126.7 Å²	126.7	85%	0.847	75%	0.745	S	S	*	*			trans	-89.3	148.6	-176.4	-141.1	170.7	156.1	0	0	111.6
1051	L	33.6	Very low	40.6	Very low	154.2 Å²	154.2	128.2 Å²	128.2	81%	0.807	76%	0.763	S	S	*	*			trans	84.6	138.3	168.7	-67.2	140.7	0	0	0	116	S1049	S1049-L1051 PolarHBondContact O-N 3.15Å
1052	I	34.1	Very low	38.9	Very low	152.4 Å²	152.4	127.4 Å²	127.4	78%	0.782	77%	0.77	S	S	*	*			trans	87.8	93.8	157.3	-54.7	173.8	0	0	0	114.8
1053	H	32.5	Very low	37.4	Very low	176.8 Å²	176.8	131.5 Å²	131.5	82%	0.819	79%	0.79	S	S	*	*			trans	-93.3	145.5	131.8	-84.8	-71.2	0	0	0	111.3	S1055	H1053-S1055 WeakPolarHBondContact CB-OG 3.49Å; H1053-S1055 PolarHBondContact ND1-OG 3.12Å
1054	P	36.5	Very low	36.5	Very low	114.2 Å²	114.2	133 Å²	133	74%	0.742	80%	0.797	S	S	*	*				-124	144.7	106.7	32.6	-20.5	0	0	0	113.6
1055	S	33.9	Very low	36.1	Very low	93.8 Å²	93.8	130.2 Å²	130.2	66%	0.656	80%	0.799	S	S	*	*			trans	-77.1	139.6	154.3	55.1	0	0	0	0	112.2	H1053	H1053-S1055 WeakPolarHBondContact CB-OG 3.49Å; H1053-S1055 PolarHBondContact ND1-OG 3.12Å
1056	N	32.7	Very low	35.8	Very low	164.2 Å²	164.2	130 Å²	130	88%	0.878	80%	0.804	S	S	*	*			trans	66.1	131.1	130.5	-64.9	-23.2	0	0	0	116.2
1057	G	33	Very low	35.8	Very low	77.8 Å²	77.8	125.7 Å²	125.7	80%	0.802	80%	0.799	S	S	*	*			trans	172	80.2	165	0	0	0	0	0	115.3	S1059	G1057-S1059 PolarHBondContact O-N 2.72Å
1058	A	34.1	Very low	35.9	Very low	94.6 Å²	94.6	130.5 Å²	130.5	78%	0.782	81%	0.809	S	S	*	*			trans	-121.2	131.6	166.1	0	0	0	0	0	113
1059	S	35.4	Very low	36.3	Very low	119.2 Å²	119.2	128.9 Å²	128.9	83%	0.834	80%	0.801	S	S	*	*			trans	86.7	112.5	136.1	-67	0	0	0	0	118.6	G1057	G1057-S1059 PolarHBondContact O-N 2.72Å
1060	A	36.5	Very low	36.8	Very low	100.8 Å²	100.8	130.6 Å²	130.6	83%	0.833	80%	0.796	S	S	*	*			trans	121.4	123.6	142.1	0	0	0	0	0	115.9
1061	S	40.2	Very low	37.2	Very low	127 Å²	127	127.7 Å²	127.7	89%	0.888	79%	0.786	S	S	*	*			trans	104.9	146.7	158.3	-150.3	0	0	0	0	115
1062	G	37.1	Very low	37.6	Very low	66.6 Å²	66.6	126.6 Å²	126.6	69%	0.687	78%	0.781	S	S	*	*			trans	162.2	16.2	179.8	0	0	0	0	0	114.8
1063	N	37.8	Very low	38	Very low	152.8 Å²	152.8	125.6 Å²	125.6	82%	0.817	78%	0.777	S	S	*	*			trans	80.9	141.2	140.5	-126.5	-5	0	0	0	115.7
1064	T	36.9	Very low	38.4	Very low	136.6 Å²	136.6	123.6 Å²	123.6	84%	0.838	77%	0.772	S	S	*	*			trans	120.2	139.6	145.9	52.8	0	0	0	0	116.3
1065	G	38	Very low	38.6	Very low	73.8 Å²	73.8	125 Å²	125	76%	0.761	77%	0.774	S	S	*	*			trans	154.6	108.1	157.8	0	0	0	0	0	117
1066	N	37.6	Very low	38.6	Very low	172 Å²	172	129.1 Å²	129.1	92%	0.92	78%	0.78	S	S	*	*			trans	34.2	132.6	178.4	-87.4	-17.8	0	0	0	116.9
1067	G	39.2	Very low	38.6	Very low	73.4 Å²	73.4	129.1 Å²	129.1	76%	0.757	78%	0.776	S	S	*	*			trans	167.6	84.6	173.9	0	0	0	0	0	118.8
1068	R	39.5	Very low	38.6	Very low	231.4 Å²	231.4	130.2 Å²	130.2	87%	0.873	77%	0.772	S	S	*	*			trans	73.5	136.8	168.4	-90.2	-179.1	-178.4	159.6	0.4	117.4
1069	N	42.3	Very low	38.7	Very low	128.2 Å²	128.2	132.5 Å²	132.5	69%	0.686	77%	0.771	S	S	*	*			trans	89.7	131.3	146.6	-70.5	9.1	0	0	0	118.2
1070	H	46.3	Very low	38.7	Very low	152 Å²	152	137.2 Å²	137.2	70%	0.704	77%	0.771	S	S	*	*				162.6	135.1	76.4	-95.7	-50	0	0	0	116.8
1071	N	44.2	Very low	38.5	Very low	119.6 Å²	119.6	139.3 Å²	139.3	64%	0.64	77%	0.767	S	S	*	*				76.5	126	116.4	-76.5	5.1	0	0	0	122.6
1072	N	41.8	Very low	38.2	Very low	131.4 Å²	131.4	141 Å²	141	70%	0.703	76%	0.763	S	S	*	*				49.1	136.5	127.5	-63.5	-5.7	0	0	0	120.8
1073	N	42.8	Very low	38	Very low	130.6 Å²	130.6	145.7 Å²	145.7	70%	0.698	77%	0.769	S	S	*	*			cis	177.6	143.8	30.6	-105.5	-17.2	0	0	0	114.6
1074	N	40.8	Very low	37.7	Very low	134.6 Å²	134.6	146.9 Å²	146.9	72%	0.72	77%	0.767	S	S	*	*			trans	105.1	138	134.8	-83	-17.6	0	0	0	117.3
1075	N	40.7	Very low	37.5	Very low	143.8 Å²	143.8	145.4 Å²	145.4	77%	0.769	76%	0.762	S	S	*	*				-165.1	134.6	129.9	-99	-24.4	0	0	0	116.1
1076	K	32.9	Very low	37.3	Very low	180.6 Å²	180.6	147.8 Å²	147.8	79%	0.785	76%	0.762	S	S	*	*				67.7	125	118.7	-98.3	-173.2	175.5	-178.7	0	117
1077	M	33.2	Very low	37	Very low	164.6 Å²	164.6	144.7 Å²	144.7	81%	0.811	75%	0.753	S	S	*	*				160.8	138.3	90.7	-114.3	171.9	173.1	0	0	114.4
1078	S	34	Very low	36.6	Very low	100.4 Å²	100.4	146 Å²	146	70%	0.702	75%	0.75	S	S	*	*				-139.3	167	105	-66.8	0	0	0	0	115.4
1079	N	35.4	Very low	36.2	Very low	143.4 Å²	143.4	140.9 Å²	140.9	77%	0.767	75%	0.745	S	S	*	*				-173.2	146.4	107.8	-106.3	-25.7	0	0	0	111
1080	R	35.1	Very low	35.8	Very low	218.6 Å²	218.6	139.6 Å²	139.6	83%	0.825	75%	0.747	S	S	*	*				83.4	129.7	75.8	-94.2	-173.3	-165.3	-167.2	-0.3	114.5
1081	L	33.6	Very low	35.2	Very low	144.6 Å²	144.6	137.6 Å²	137.6	76%	0.757	75%	0.749	S	S	*	*				172	140.3	64.3	-78.4	153.9	0	0	0	111.6
1082	M	32.4	Very low	34.7	Very low	162.4 Å²	162.4	137.1 Å²	137.1	80%	0.8	76%	0.756	S	S	*	*				147	137.9	79.3	-88.2	-141.4	-175	0	0	113.2
1083	M	33.3	Very low	34.5	Very low	165.4 Å²	165.4	136.5 Å²	136.5	82%	0.815	76%	0.762	S	S	*	*			cis	-152.7	146.5	32.8	-117.1	-174.4	176.9	0	0	110.2
1084	K	31.7	Very low	34	Very low	177.4 Å²	177.4	134.5 Å²	134.5	77%	0.771	76%	0.763	S	S	*	*				26.4	126.8	126.2	-103.7	-177.4	178.8	-178.2	0	113.3
1085	S	32.6	Very low	33.7	Very low	106 Å²	106	139.3 Å²	139.3	74%	0.741	77%	0.771	S	S	*	*				-44.6	151.3	110.6	36.4	0	0	0	0	114.3
1086	V	33.9	Very low	33.3	Very low	123.6 Å²	123.6	136.8 Å²	136.8	75%	0.749	77%	0.77	S	S	*	*			trans	-167.9	133.5	140.3	166.2	0	0	0	0	109.9
1087	S	31.5	Very low	33.4	Very low	107 Å²	107	136.8 Å²	136.8	75%	0.748	78%	0.775	S	S	*	*			trans	174.2	120.1	167	57.5	0	0	0	0	115.1
1088	S	31.2	Very low	33.3	Very low	99.6 Å²	99.6	132.5 Å²	132.5	70%	0.697	77%	0.773	S	S	*	*			trans	166	144.7	136	62.4	0	0	0	0	114.2	S1090	S1088-S1090 PolarHBondContact O-N 2.03Å; S1088-S1090 VanDerWaalsContact O-N 3.13Å
1089	T	30.4	Very low	33.3	Very low	125.2 Å²	125.2	135.5 Å²	135.5	77%	0.768	78%	0.78	S	S	*	*			trans	13.6	136.2	152.7	56.5	0	0	0	0	116.6
1090	S	33.2	Very low	33.1	Very low	101.8 Å²	101.8	133.6 Å²	133.6	71%	0.712	78%	0.778	S	S	*	*				-178.7	131.3	113.8	58.2	0	0	0	0	116.1	S1088 S1092	S1088-S1090 PolarHBondContact O-N 2.03Å; S1088-S1090 VanDerWaalsContact O-N 3.13Å; S1090-S1092 PolarHBondContact O-N 2.84Å
1091	S	33.8	Very low	33.1	Very low	108.8 Å²	108.8	128.7 Å²	128.7	76%	0.761	78%	0.777	S	S	*	*				-43.9	151	119.6	64.3	0	0	0	0	114.1
1092	S	34.9	Very low	33.1	Very low	109.8 Å²	109.8	126.6 Å²	126.6	77%	0.768	78%	0.78	S	S	*	*			trans	-156	130.3	155.3	20.5	0	0	0	0	115.1	S1090	S1090-S1092 PolarHBondContact O-N 2.84Å
1093	S	36.4	Very low	33.6	Very low	119.2 Å²	119.2	124.4 Å²	124.4	83%	0.834	78%	0.778	S	S	*	*			trans	178.8	132.6	133.5	-126.1	0	0	0	0	113.1	R1095	S1093-R1095 PolarHBondContact O-N 3.02Å; S1093-R1095 VanDerWaalsContact O-N 3.12Å
1094	A	33.4	Very low	33.6	Very low	87.4 Å²	87.4	122.4 Å²	122.4	72%	0.722	78%	0.776	S	S	*	*			trans	100.6	131	147	0	0	0	0	0	115.6
1095	R	34.3	Very low	33.9	Very low	236 Å²	236	125 Å²	125	89%	0.891	78%	0.78	S	S	*	*			trans	79.2	116.4	170.1	-71.8	173.3	-176.8	178.7	0.7	114.2	S1093 M1097	S1093-R1095 PolarHBondContact O-N 3.02Å; S1093-R1095 VanDerWaalsContact O-N 3.12Å; R1095-M1097 PolarHBondContact O-N 3.46Å
1096	A	32.2	Very low	33.9	Very low	90 Å²	90	126.8 Å²	126.8	74%	0.744	78%	0.781	S	S	*	*				86.8	135.2	54.3	0	0	0	0	0	114.5
1097	M	35.2	Very low	33.8	Very low	182.4 Å²	182.4	127.5 Å²	127.5	90%	0.899	78%	0.78	S	S	*	*			trans	108.3	138.4	167.8	-64.7	-159.4	-104.5	0	0	112.7	R1095 L1099	R1095-M1097 PolarHBondContact O-N 3.46Å; M1097-L1099 HydrophobicContact CB-CD1 4.31Å; M1097-L1099 HydrophobicContact CB-CG 4.31Å; M1097-L1099 HydrophobicContact SD-CD2 4.43Å
1098	G	31.6	Very low	34	Very low	73.6 Å²	73.6	129.1 Å²	129.1	76%	0.759	78%	0.779	S	S	*	*			trans	155.5	102.8	157.2	0	0	0	0	0	114.5
1099	L	32.4	Very low	34	Very low	163.4 Å²	163.4	131.4 Å²	131.4	86%	0.855	78%	0.784	S	S	*	*			trans	82.7	114.3	-174.6	-83.3	165.1	0	0	0	114.5	M1097	M1097-L1099 HydrophobicContact CB-CD1 4.31Å; M1097-L1099 HydrophobicContact CB-CG 4.31Å; M1097-L1099 HydrophobicContact SD-CD2 4.43Å
1100	S	32.8	Very low	34.4	Very low	104.4 Å²	104.4	130.4 Å²	130.4	73%	0.73	79%	0.788	S	S	*	*				109.7	128.2	128.3	67.1	0	0	0	0	115.4
1101	S	34.2	Very low	34.8	Very low	114.2 Å²	114.2	129.6 Å²	129.6	80%	0.799	79%	0.788	S	S	*	*			trans	107.3	136.7	141.5	61	0	0	0	0	116.6
1102	A	34	Very low	35.4	Very low	100 Å²	100	130.4 Å²	130.4	83%	0.826	79%	0.79	S	S	*	*			trans	-150.7	145.5	162.1	0	0	0	0	0	111
1103	P	42	Very low	35.9	Very low	116.4 Å²	116.4	134.2 Å²	134.2	76%	0.756	80%	0.796	S	S	*	*			trans	-121	159.5	179.5	28.7	-13	0	0	0	114.3
1104	V	34.7	Very low	36.8	Very low	125 Å²	125	135.2 Å²	135.2	76%	0.758	79%	0.787	S	S	*	*			trans	159.3	123.2	155.8	173.1	0	0	0	0	114.3	L1106	V1104-L1106 HydrophobicContact CG1-CB 4.16Å; V1104-L1106 HydrophobicContact CG1-CD1 4.22Å; V1104-L1106 HydrophobicContact CG1-CG 3.87Å
1105	R	36.1	Very low	37.9	Very low	231.6 Å²	231.6	139 Å²	139	87%	0.874	79%	0.79	S	S	*	*			trans	72.2	122.5	131.8	-101.6	-176.9	-176.6	-160.1	-1.2	117.9
1106	L	33.8	Very low	39.8	Very low	142.6 Å²	142.6	129.8 Å²	129.8	75%	0.747	76%	0.761	S	S	*	*				-176.6	140.3	129	-79.3	174.5	0	0	0	112.4	V1104	V1104-L1106 HydrophobicContact CG1-CB 4.16Å; V1104-L1106 HydrophobicContact CG1-CD1 4.22Å; V1104-L1106 HydrophobicContact CG1-CG 3.87Å
1107	L	31.7	Very low	41.8	Very low	139.2 Å²	139.2	131.5 Å²	131.5	73%	0.729	76%	0.763	S	S	*	*				-170.2	155.4	109.1	-93.9	129.4	0	0	0	112
1108	L	34.6	Very low	43.8	Very low	140 Å²	140	125.8 Å²	125.8	73%	0.733	74%	0.736	S	S	*	*				101.2	146.4	122	-73	107.2	0	0	0	117.2
1109	D	32.9	Very low	46.3	Very low	148.4 Å²	148.4	128.4 Å²	128.4	79%	0.794	73%	0.732	S	S	*	*			trans	61.4	100.6	141.5	-62	-15	0	0	0	117.1	A1111	D1109-A1111 PolarHBondContact O-N 2.6Å
1110	A	37.8	Very low	49	Very low	103.4 Å²	103.4	120.9 Å²	120.9	86%	0.855	69%	0.694	S	S	*	*			trans	-103.5	137.8	158.7	0	0	0	0	0	110.6
1111	A	42.7	Very low	51.2	Low	86.6 Å²	86.6	118 Å²	118	72%	0.716	67%	0.673	S	S	*	*			trans	-76.4	152.4	169.8	0	0	0	0	0	110.4	D1109 E1113	D1109-A1111 PolarHBondContact O-N 2.6Å; A1111-E1113 PolarHBondContact O-N 3.19Å
1112	P	45.1	Very low	53.7	Low	125 Å²	125	116.8 Å²	116.8	81%	0.812	67%	0.665	S	S	*	*			trans	-67.2	124.1	176.5	28.4	-34.4	0	0	0	110.7	Q1114	P1112-Q1114 PolarHBondContact O-N 3.14Å; P1112-Q1114 VanDerWaalsContact O-N 3.16Å
1113	E	45.4	Very low	56.3	Low	189.2 Å²	189.2	114.6 Å²	114.6	88%	0.884	64%	0.637	S	S	*	*			trans	-60.2	121.4	162.2	-68	-176.4	138.4	0	0	108	A1111 E1115	A1111-E1113 PolarHBondContact O-N 3.19Å; E1113-E1115 VanDerWaalsContact C-N 3.28Å; E1113-E1115 PolarHBondContact O-N 2.97Å
1114	Q	55.5	Low	58.5	Low	140.4 Å²	140.4	109.6 Å²	109.6	66%	0.656	61%	0.607	S	S	*	*			trans	-78.1	91.3	-173.2	-172.9	171	-32.6	0	0	109.7	P1112 C1116 Y1128	P1112-Q1114 PolarHBondContact O-N 3.14Å; P1112-Q1114 VanDerWaalsContact O-N 3.16Å; Q1114-C1116 PolarHBondContact O-N 3Å; Q1114-C1116 VanDerWaalsContact O-N 3.12Å; Q1114-Y1128 HydrophobicContact CB-CE2 4.35Å; Q1114-Y1128 HydrophobicContact CG-CE2 4.27Å; Q1114-Y1128 VanDerWaalsContact NE2-CZ 3.28Å; Q1114-Y1128 PolarHBondContact NE2-OH 3.13Å; Q1114-Y1128 WeakPolarHBondContact O-CE2 3.42Å
1115	E	57.7	Low	61.1	Low	167.2 Å²	167.2	106.5 Å²	106.5	78%	0.781	59%	0.588	S	S	*	*			trans	-47.9	124.4	-179.4	-102.1	172.4	153.7	0	0	111	E1113 T1117	E1113-E1115 VanDerWaalsContact C-N 3.28Å; E1113-E1115 PolarHBondContact O-N 2.97Å; E1115-T1117 VanDerWaalsContact C-N 3.33Å; E1115-T1117 HydrophobicContact CB-CG2 4.45Å; E1115-T1117 WeakPolarHBondContact O-CG2 3.44Å; E1115-T1117 PolarHBondContact O-N 3.27Å; E1115-T1117 VanDerWaalsContact O-N 3.08Å; E1115-T1117 PolarHBondContact O-OG1 3.47Å; E1115-T1117 VanDerWaalsContact O-OG1 3.08Å
1116	C	73.2	Confident	63.6	Low	42.2 Å²	42.2	96.8 Å²	96.8	29%	0.285	56%	0.556	S	S	.	*			trans	-82.7	86.5	-171.9	-157.4	0	0	0	0	109.2	Q1114 L1118 C1126 E1127 Y1128 P1135	Q1114-C1116 PolarHBondContact O-N 3Å; Q1114-C1116 VanDerWaalsContact O-N 3.12Å; C1116-L1118 VanDerWaalsContact C-N 3.29Å; C1116-L1118 PolarHBondContact O-N 3Å; C1116-L1118 VanDerWaalsContact O-N 3.08Å; C1116-C1126 VanDerWaalsContact C-SG 3.58Å; C1116-C1126 VanDerWaalsContact CA-SG 3.59Å; C1116-C1126 HydrophobicContact CB-CB 3.7Å; C1116-C1126 WeakPolarHBondContact CB-SG 3.45Å; C1116-C1126 PolarHBondContact O-SG 3.28Å; C1116-C1126 VanDerWaalsContact O-SG 3.38Å; C1116-C1126 WeakPolarHBondContact SG-CB 3.31Å; C1116-C1126 PolarHBondContact SG-O 2.86Å; C1116-C1126 VanDerWaalsContact SG-O 3.39Å; C1116-C1126 CovalentContact SG-SG 2.03Å; C1116-C1126 PolarHBondContact SG-SG 3.11Å; C1116-E1127 PolarHBondContact SG-N 3.22Å; C1116-E1127 VanDerWaalsContact SG-N 3.43Å; C1116-Y1128 HydrophobicContact CB-CE2 4.13Å; C1116-P1135 VanDerWaalsContact SG-CB 3.51Å; C1116-P1135 WeakPolarHBondContact SG-CB 3.34Å
1117	T	74.6	Confident	66.1	Low	125.6 Å²	125.6	92.4 Å²	92.4	77%	0.771	53%	0.531	S	S	*	.			trans	-79.7	17.1	-167.7	55.2	0	0	0	0	115.2	E1115	E1115-T1117 VanDerWaalsContact C-N 3.33Å; E1115-T1117 HydrophobicContact CB-CG2 4.45Å; E1115-T1117 WeakPolarHBondContact O-CG2 3.44Å; E1115-T1117 PolarHBondContact O-N 3.27Å; E1115-T1117 VanDerWaalsContact O-N 3.08Å; E1115-T1117 PolarHBondContact O-OG1 3.47Å; E1115-T1117 VanDerWaalsContact O-OG1 3.08Å
1118	L	77.4	Confident	68.4	Low	64 Å²	64	90 Å²	90	34%	0.335	51%	0.513	S	S	.	.			trans	-92.3	117.4	176.9	-166.6	68.9	0	0	0	109.6	C1116 C1120 C1126 P1135 C1137	C1116-L1118 VanDerWaalsContact C-N 3.29Å; C1116-L1118 PolarHBondContact O-N 3Å; C1116-L1118 VanDerWaalsContact O-N 3.08Å; L1118-C1120 PolarHBondContact O-N 2.98Å; L1118-C1120 VanDerWaalsContact O-N 3.12Å; L1118-C1120 PolarHBondContact O-SG 3.19Å; L1118-C1126 VanDerWaalsContact CB-SG 3.53Å; L1118-C1126 WeakPolarHBondContact CB-SG 3.48Å; L1118-P1135 HydrophobicContact CB-CB 4.36Å; L1118-P1135 HydrophobicContact CB-CG 4.2Å; L1118-P1135 WeakPolarHBondContact CD2-O 3.35Å; L1118-C1137 HydrophobicContact CD2-CB 4.49Å; L1118-C1137 VanDerWaalsContact CD2-SG 3.56Å; L1118-C1137 WeakPolarHBondContact CD2-SG 3.01Å
1119	D	83.5	Confident	70	Confident	127 Å²	127	88.6 Å²	88.6	68%	0.679	50%	0.504	S	S	*	.			trans	-74.9	107.6	177.6	-173.9	-3.7	0	0	0	110.4	S1121 D1147	D1119-S1121 PolarHBondContact O-N 2.72Å; D1119-S1121 VanDerWaalsContact O-N 3.08Å; D1119-S1121 WeakPolarHBondContact OD1-CA 3.42Å; D1119-S1121 PolarHBondContact OD1-N 3Å; D1119-D1147 WeakPolarHBondContact O-CB 3.49Å
1120	C	88.3	Confident	71.6	Confident	7.2 Å²	7.2	90.1 Å²	90.1	5%	0.049	51%	0.512	C	S	.	.			trans	-86.3	25.9	178.8	-54.4	0	0	0	0	113.4	L1118 S1122 H1123 G1124 C1126 C1137 D1147 C1148	L1118-C1120 PolarHBondContact O-N 2.98Å; L1118-C1120 VanDerWaalsContact O-N 3.12Å; L1118-C1120 PolarHBondContact O-SG 3.19Å; C1120-S1122 PolarHBondContact O-N 2.95Å; C1120-S1122 VanDerWaalsContact O-N 3.08Å; C1120-H1123 CarbonylContact O-C 3.18Å; C1120-H1123 WeakPolarHBondContact O-CA 3.28Å; C1120-H1123 PolarHBondContact O-N 2.91Å; C1120-G1124 WeakPolarHBondContact CB-O 3.34Å; C1120-G1124 PolarHBondContact O-N 3.05Å; C1120-G1124 VanDerWaalsContact O-N 3.16Å; C1120-C1126 VanDerWaalsContact SG-CA 3.51Å; C1120-C1126 PolarHBondContact SG-N 3.09Å; C1120-C1126 VanDerWaalsContact SG-N 3.41Å; C1120-C1137 WeakPolarHBondContact CA-SG 3.31Å; C1120-C1137 HydrophobicContact CB-CB 3.67Å; C1120-C1137 WeakPolarHBondContact CB-SG 3.33Å; C1120-C1137 VanDerWaalsContact SG-CA 3.55Å; C1120-C1137 WeakPolarHBondContact SG-CA 3.36Å; C1120-C1137 WeakPolarHBondContact SG-CB 3.36Å; C1120-C1137 CovalentContact SG-SG 2.03Å; C1120-C1137 PolarHBondContact SG-SG 3.21Å; C1120-D1147 CarbonylContact C-O 3.45Å; C1120-D1147 WeakPolarHBondContact CA-O 3.28Å; C1120-C1148 WeakPolarHBondContact O-CB 3.23Å
1121	S	80.2	Confident	73	Confident	41.8 Å²	41.8	88.9 Å²	88.9	29%	0.292	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.2	58.8	-178.8	-66.8	0	0	0	0	113.5	D1119 H1123 D1147 N1149	D1119-S1121 PolarHBondContact O-N 2.72Å; D1119-S1121 VanDerWaalsContact O-N 3.08Å; D1119-S1121 WeakPolarHBondContact OD1-CA 3.42Å; D1119-S1121 PolarHBondContact OD1-N 3Å; S1121-H1123 PolarHBondContact O-N 3.08Å; S1121-H1123 VanDerWaalsContact O-N 3.12Å; S1121-D1147 VanDerWaalsContact CB-O 3.24Å; S1121-D1147 WeakPolarHBondContact CB-O 3.28Å; S1121-D1147 PolarHBondContact N-O 3.13Å; S1121-D1147 PolarHBondContact OG-O 3.06Å; S1121-N1149 WeakPolarHBondContact CB-OD1 3.1Å; S1121-N1149 PolarHBondContact OG-OD1 3.13Å
1122	S	87.3	Confident	74	Confident	90.4 Å²	90.4	93.2 Å²	93.2	63%	0.632	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	15.2	14.6	-176.8	65.9	0	0	0	0	115	C1120	C1120-S1122 PolarHBondContact O-N 2.95Å; C1120-S1122 VanDerWaalsContact O-N 3.08Å
1123	H	87.5	Confident	75.2	Confident	52.4 Å²	52.4	95.2 Å²	95.2	24%	0.243	51%	0.513	C	S	.	.	S	Bend	trans	-128.7	12.7	-165.7	-63.9	-19.4	0	0	0	114.1	C1120 S1121 C1139 F1140 W1143 C1148	C1120-H1123 CarbonylContact O-C 3.18Å; C1120-H1123 WeakPolarHBondContact O-CA 3.28Å; C1120-H1123 PolarHBondContact O-N 2.91Å; S1121-H1123 PolarHBondContact O-N 3.08Å; S1121-H1123 VanDerWaalsContact O-N 3.12Å; H1123-C1139 WeakPolarHBondContact O-CA 3.42Å; H1123-F1140 VanDerWaalsContact C-CD2 3.43Å; H1123-F1140 WeakPolarHBondContact O-CD2 3.21Å; H1123-F1140 PolarHBondContact O-N 3.05Å; H1123-W1143 HydrophobicContact CB-CB 4.26Å; H1123-W1143 HydrophobicContact CB-CD2 3.86Å; H1123-W1143 HydrophobicContact CB-CE3 4.32Å; H1123-W1143 HydrophobicContact CB-CG 3.8Å; H1123-W1143 AromaticContact CD2-CD2 3.61Å; H1123-W1143 VanDerWaalsContact CD2-CD2 3.5Å; H1123-W1143 AromaticContact CD2-CE2 3.46Å; H1123-W1143 VanDerWaalsContact CD2-CE2 3.44Å; H1123-W1143 AromaticContact CD2-CE3 3.61Å; H1123-W1143 VanDerWaalsContact CD2-CE3 3.5Å; H1123-W1143 AromaticContact CD2-CH2 3.39Å; H1123-W1143 VanDerWaalsContact CD2-CH2 3.42Å; H1123-W1143 WeakPolarHBondContact CD2-CH2 3.32Å; H1123-W1143 AromaticContact CD2-CZ2 3.38Å; H1123-W1143 VanDerWaalsContact CD2-CZ2 3.44Å; H1123-W1143 WeakPolarHBondContact CD2-CZ2 3.37Å; H1123-W1143 AromaticContact CD2-CZ3 3.51Å; H1123-W1143 VanDerWaalsContact CD2-CZ3 3.43Å; H1123-W1143 WeakPolarHBondContact CD2-CZ3 2.97Å; H1123-W1143 AromaticContact CD2-NE1 3.94Å; H1123-W1143 AromaticContact CE1-CZ2 3.79Å; H1123-W1143 AromaticContact CG-CD2 3.78Å; H1123-W1143 AromaticContact CG-CE2 3.67Å; H1123-W1143 AromaticContact CG-CZ2 3.9Å; H1123-W1143 AromaticContact CG-NE1 3.88Å; H1123-W1143 AromaticContact ND1-CE2 3.93Å; H1123-W1143 AromaticContact ND1-NE1 3.97Å; H1123-W1143 AromaticContact NE2-CE2 3.86Å; H1123-W1143 AromaticContact NE2-CH2 3.47Å; H1123-W1143 WeakPolarHBondContact NE2-CH2 3.3Å; H1123-W1143 AromaticContact NE2-CZ2 3.36Å; H1123-W1143 VanDerWaalsContact NE2-CZ2 3.27Å; H1123-W1143 WeakPolarHBondContact NE2-CZ2 3.28Å; H1123-W1143 AromaticContact NE2-CZ3 3.97Å; H1123-C1148 HydrophobicContact CB-CB 4.13Å; H1123-C1148 WeakPolarHBondContact O-CB 3.3Å
1124	G	88.3	Confident	76.6	Confident	12.6 Å²	12.6	92.9 Å²	92.9	13%	0.13	50%	0.503	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	-178.8	170.1	0	0	0	0	0	112.5	C1120 R1138	C1120-G1124 WeakPolarHBondContact CB-O 3.34Å; C1120-G1124 PolarHBondContact O-N 3.05Å; C1120-G1124 VanDerWaalsContact O-N 3.16Å; G1124-R1138 CarbonylContact C-O 3.53Å; G1124-R1138 VanDerWaalsContact CA-O 3.24Å; G1124-R1138 WeakPolarHBondContact CA-O 3.32Å
1125	V	90.1	Very high	77.8	Confident	59.4 Å²	59.4	87.6 Å²	87.6	36%	0.36	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	132.8	174.3	-174.7	0	0	0	0	108.9	E1127 C1137 R1138 F1140	V1125-E1127 HydrophobicContact CB-CG 4.44Å; V1125-E1127 WeakPolarHBondContact CB-OE1 3.2Å; V1125-E1127 HydrophobicContact CG1-CG 4.04Å; V1125-E1127 WeakPolarHBondContact CG1-OE1 3.31Å; V1125-E1127 PolarHBondContact O-N 2.86Å; V1125-C1137 CarbonylContact O-C 3.47Å; V1125-C1137 WeakPolarHBondContact O-CA 3.26Å; V1125-R1138 PolarHBondContact N-O 3.04Å; V1125-R1138 PolarHBondContact O-N 3.21Å; V1125-F1140 HydrophobicContact CG2-CE1 3.72Å; V1125-F1140 HydrophobicContact CG2-CZ 4.11Å
1126	C	88.1	Confident	79.2	Confident	27.4 Å²	27.4	82.5 Å²	82.5	19%	0.185	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	121.2	174.7	-174.3	0	0	0	0	109.4	C1116 L1118 C1120	C1116-C1126 VanDerWaalsContact C-SG 3.58Å; C1116-C1126 VanDerWaalsContact CA-SG 3.59Å; C1116-C1126 HydrophobicContact CB-CB 3.7Å; C1116-C1126 WeakPolarHBondContact CB-SG 3.45Å; C1116-C1126 PolarHBondContact O-SG 3.28Å; C1116-C1126 VanDerWaalsContact O-SG 3.38Å; C1116-C1126 WeakPolarHBondContact SG-CB 3.31Å; C1116-C1126 PolarHBondContact SG-O 2.86Å; C1116-C1126 VanDerWaalsContact SG-O 3.39Å; C1116-C1126 CovalentContact SG-SG 2.03Å; C1116-C1126 PolarHBondContact SG-SG 3.11Å; L1118-C1126 VanDerWaalsContact CB-SG 3.53Å; L1118-C1126 WeakPolarHBondContact CB-SG 3.48Å; C1120-C1126 VanDerWaalsContact SG-CA 3.51Å; C1120-C1126 PolarHBondContact SG-N 3.09Å; C1120-C1126 VanDerWaalsContact SG-N 3.41Å
1127	E	86.2	Confident	79.9	Confident	50.8 Å²	50.8	81 Å²	81	24%	0.237	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	141.9	-178.3	-67	178.4	177	0	0	110.9	C1116 V1125 P1135 V1136 R1138	C1116-E1127 PolarHBondContact SG-N 3.22Å; C1116-E1127 VanDerWaalsContact SG-N 3.43Å; V1125-E1127 HydrophobicContact CB-CG 4.44Å; V1125-E1127 WeakPolarHBondContact CB-OE1 3.2Å; V1125-E1127 HydrophobicContact CG1-CG 4.04Å; V1125-E1127 WeakPolarHBondContact CG1-OE1 3.31Å; V1125-E1127 PolarHBondContact O-N 2.86Å; E1127-P1135 WeakPolarHBondContact O-CA 3.45Å; E1127-V1136 PolarHBondContact N-O 3.19Å; E1127-V1136 PolarHBondContact O-N 3.19Å; E1127-V1136 VanDerWaalsContact O-O 3.1Å; E1127-R1138 WeakPolarHBondContact OE1-CB 3.46Å; E1127-R1138 IonicContact OE1-CZ 2.95Å; E1127-R1138 IonicContact OE1-NE 3.3Å; E1127-R1138 PolarHBondContact OE1-NE 3.09Å; E1127-R1138 IonicContact OE1-NH1 3.01Å; E1127-R1138 PolarHBondContact OE1-NH1 3.18Å; E1127-R1138 IonicContact OE1-NH2 3.29Å; E1127-R1138 PolarHBondContact OE1-NH2 3.01Å; E1127-R1138 WeakPolarHBondContact OE2-CD 3.14Å; E1127-R1138 IonicContact OE2-CZ 3.07Å; E1127-R1138 IonicContact OE2-NE 3.25Å; E1127-R1138 PolarHBondContact OE2-NE 3.1Å; E1127-R1138 VanDerWaalsContact OE2-NE 3.1Å; E1127-R1138 IonicContact OE2-NH1 3.16Å; E1127-R1138 PolarHBondContact OE2-NH1 2.89Å; E1127-R1138 IonicContact OE2-NH2 3.59Å; E1127-R1138 PolarHBondContact OE2-NH2 3.16Å; E1127-R1138 VanDerWaalsContact OE2-NH2 3.13Å
1128	Y	79	Confident	80.6	Confident	88.6 Å²	88.6	81.8 Å²	81.8	35%	0.347	44%	0.439	S	S	.	.			trans	-86.8	130.9	166.3	-71.7	-91.8	0	0	0	108.7	Q1114 C1116 P1135	Q1114-Y1128 HydrophobicContact CB-CE2 4.35Å; Q1114-Y1128 HydrophobicContact CG-CE2 4.27Å; Q1114-Y1128 VanDerWaalsContact NE2-CZ 3.28Å; Q1114-Y1128 PolarHBondContact NE2-OH 3.13Å; Q1114-Y1128 WeakPolarHBondContact O-CE2 3.42Å; C1116-Y1128 HydrophobicContact CB-CE2 4.13Å; Y1128-P1135 HydrophobicContact CD1-CB 4.18Å; Y1128-P1135 HydrophobicContact CD2-CB 4.29Å; Y1128-P1135 HydrophobicContact CE1-CB 3.89Å; Y1128-P1135 VanDerWaalsContact CE1-CD 3.48Å; Y1128-P1135 HydrophobicContact CE1-CG 4.1Å; Y1128-P1135 HydrophobicContact CE2-CB 4.04Å; Y1128-P1135 HydrophobicContact CG-CB 4.34Å
1129	M	69.9	Low	81.2	Confident	110 Å²	110	80.6 Å²	80.6	54%	0.542	44%	0.436	S	S	.	.			trans	-107.1	135	178.8	-73.3	-112.2	-119.2	0	0	110.4	G1131 Y1132 V1136	M1129-G1131 PolarHBondContact O-N 3.17Å; M1129-G1131 VanDerWaalsContact O-N 3.1Å; M1129-Y1132 PolarHBondContact O-N 3.08Å; M1129-Y1132 VanDerWaalsContact O-N 3.1Å; M1129-V1136 HydrophobicContact CE-CB 4.16Å; M1129-V1136 HydrophobicContact CE-CG1 4.15Å; M1129-V1136 HydrophobicContact CE-CG2 4.21Å
1130	D	65	Low	81.4	Confident	180 Å²	180	79.6 Å²	79.6	96%	0.963	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	119	177.8	-74.5	-47.6	0	0	0	111.3
1131	G	68.7	Low	81.3	Confident	79.8 Å²	79.8	85.4 Å²	85.4	82%	0.823	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.7	5.3	-178.5	0	0	0	0	0	116.1	M1129	M1129-G1131 PolarHBondContact O-N 3.17Å; M1129-G1131 VanDerWaalsContact O-N 3.1Å
1132	Y	62.3	Low	81.3	Confident	176.4 Å²	176.4	84.9 Å²	84.9	69%	0.692	47%	0.468	S	S	*	.			trans	-129.3	125.7	169.8	-101.9	-102.3	0	0	0	111.9	M1129 Q1134	M1129-Y1132 PolarHBondContact O-N 3.08Å; M1129-Y1132 VanDerWaalsContact O-N 3.1Å; Y1132-Q1134 HydrophobicContact CD1-CB 4.36Å; Y1132-Q1134 PolarHBondContact O-N 3.22Å; Y1132-Q1134 VanDerWaalsContact O-N 3.11Å
1133	D	70.6	Confident	81.2	Confident	166 Å²	166	83.8 Å²	83.8	89%	0.888	45%	0.45	S	S	*	.	S	Bend	trans	-73.4	5.8	-179.5	-64.9	-35.2	0	0	0	114.3
1134	Q	74.4	Confident	81.1	Confident	142 Å²	142	83.8 Å²	83.8	66%	0.664	45%	0.454	S	S	*	.	S	Bend	trans	-131.2	144.3	-178.7	-68.1	-150	-28.9	0	0	110.9	Y1132	Y1132-Q1134 HydrophobicContact CD1-CB 4.36Å; Y1132-Q1134 PolarHBondContact O-N 3.22Å; Y1132-Q1134 VanDerWaalsContact O-N 3.11Å
1135	P	81.1	Confident	80.9	Confident	27.8 Å²	27.8	84.8 Å²	84.8	18%	0.181	46%	0.463	C	S	.	.			trans	-68	152.4	177.1	29.6	-33.7	0	0	0	111.3	C1116 L1118 E1127 Y1128	C1116-P1135 VanDerWaalsContact SG-CB 3.51Å; C1116-P1135 WeakPolarHBondContact SG-CB 3.34Å; L1118-P1135 HydrophobicContact CB-CB 4.36Å; L1118-P1135 HydrophobicContact CB-CG 4.2Å; L1118-P1135 WeakPolarHBondContact CD2-O 3.35Å; E1127-P1135 WeakPolarHBondContact O-CA 3.45Å; Y1128-P1135 HydrophobicContact CD1-CB 4.18Å; Y1128-P1135 HydrophobicContact CD2-CB 4.29Å; Y1128-P1135 HydrophobicContact CE1-CB 3.89Å; Y1128-P1135 VanDerWaalsContact CE1-CD 3.48Å; Y1128-P1135 HydrophobicContact CE1-CG 4.1Å; Y1128-P1135 HydrophobicContact CE2-CB 4.04Å; Y1128-P1135 HydrophobicContact CG-CB 4.34Å
1136	V	87	Confident	80.8	Confident	60.8 Å²	60.8	86.3 Å²	86.3	37%	0.368	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	139.2	-179	-178.9	0	0	0	0	109.5	E1127 M1129 R1138	E1127-V1136 PolarHBondContact N-O 3.19Å; E1127-V1136 PolarHBondContact O-N 3.19Å; E1127-V1136 VanDerWaalsContact O-O 3.1Å; M1129-V1136 HydrophobicContact CE-CB 4.16Å; M1129-V1136 HydrophobicContact CE-CG1 4.15Å; M1129-V1136 HydrophobicContact CE-CG2 4.21Å; V1136-R1138 PolarHBondContact O-N 3.1Å
1137	C	88.4	Confident	80.7	Confident	10.2 Å²	10.2	87.5 Å²	87.5	7%	0.069	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	116.9	174.9	-67.9	0	0	0	0	112.1	L1118 C1120 V1125 C1139 S1146 C1148	L1118-C1137 HydrophobicContact CD2-CB 4.49Å; L1118-C1137 VanDerWaalsContact CD2-SG 3.56Å; L1118-C1137 WeakPolarHBondContact CD2-SG 3.01Å; C1120-C1137 WeakPolarHBondContact CA-SG 3.31Å; C1120-C1137 HydrophobicContact CB-CB 3.67Å; C1120-C1137 WeakPolarHBondContact CB-SG 3.33Å; C1120-C1137 VanDerWaalsContact SG-CA 3.55Å; C1120-C1137 WeakPolarHBondContact SG-CA 3.36Å; C1120-C1137 WeakPolarHBondContact SG-CB 3.36Å; C1120-C1137 CovalentContact SG-SG 2.03Å; C1120-C1137 PolarHBondContact SG-SG 3.21Å; V1125-C1137 CarbonylContact O-C 3.47Å; V1125-C1137 WeakPolarHBondContact O-CA 3.26Å; C1137-C1139 PolarHBondContact O-N 2.92Å; C1137-S1146 VanDerWaalsContact CB-O 3.27Å; C1137-S1146 WeakPolarHBondContact CB-O 3.3Å; C1137-S1146 PolarHBondContact SG-O 3.09Å; C1137-S1146 VanDerWaalsContact SG-O 3.38Å; C1137-C1148 VanDerWaalsContact CB-SG 3.54Å; C1137-C1148 WeakPolarHBondContact CB-SG 3.49Å
1138	R	90.5	Very high	80.8	Confident	143.8 Å²	143.8	85.1 Å²	85.1	54%	0.543	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	100	167.5	-170.2	179.9	68.3	-150.6	-11.2	109.6	G1124 V1125 E1127 V1136	G1124-R1138 CarbonylContact C-O 3.53Å; G1124-R1138 VanDerWaalsContact CA-O 3.24Å; G1124-R1138 WeakPolarHBondContact CA-O 3.32Å; V1125-R1138 PolarHBondContact N-O 3.04Å; V1125-R1138 PolarHBondContact O-N 3.21Å; E1127-R1138 WeakPolarHBondContact OE1-CB 3.46Å; E1127-R1138 IonicContact OE1-CZ 2.95Å; E1127-R1138 IonicContact OE1-NE 3.3Å; E1127-R1138 PolarHBondContact OE1-NE 3.09Å; E1127-R1138 IonicContact OE1-NH1 3.01Å; E1127-R1138 PolarHBondContact OE1-NH1 3.18Å; E1127-R1138 IonicContact OE1-NH2 3.29Å; E1127-R1138 PolarHBondContact OE1-NH2 3.01Å; E1127-R1138 WeakPolarHBondContact OE2-CD 3.14Å; E1127-R1138 IonicContact OE2-CZ 3.07Å; E1127-R1138 IonicContact OE2-NE 3.25Å; E1127-R1138 PolarHBondContact OE2-NE 3.1Å; E1127-R1138 VanDerWaalsContact OE2-NE 3.1Å; E1127-R1138 IonicContact OE2-NH1 3.16Å; E1127-R1138 PolarHBondContact OE2-NH1 2.89Å; E1127-R1138 IonicContact OE2-NH2 3.59Å; E1127-R1138 PolarHBondContact OE2-NH2 3.16Å; E1127-R1138 VanDerWaalsContact OE2-NH2 3.13Å; V1136-R1138 PolarHBondContact O-N 3.1Å
1139	C	89.1	Confident	81.2	Confident	39 Å²	39	84.5 Å²	84.5	26%	0.264	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	148.2	-175.5	-51.6	0	0	0	0	114.1	H1123 C1137 W1143 C1148	H1123-C1139 WeakPolarHBondContact O-CA 3.42Å; C1137-C1139 PolarHBondContact O-N 2.92Å; C1139-W1143 HydrophobicContact CB-CB 4.15Å; C1139-C1148 WeakPolarHBondContact CA-SG 3.36Å; C1139-C1148 HydrophobicContact CB-CB 3.77Å; C1139-C1148 WeakPolarHBondContact CB-SG 3.36Å; C1139-C1148 PolarHBondContact N-SG 2.9Å; C1139-C1148 VanDerWaalsContact N-SG 3.42Å; C1139-C1148 WeakPolarHBondContact SG-CA 3.34Å; C1139-C1148 WeakPolarHBondContact SG-CB 3.38Å; C1139-C1148 CovalentContact SG-SG 2.04Å; C1139-C1148 PolarHBondContact SG-SG 2.86Å
1140	F	88.6	Confident	81.8	Confident	104.8 Å²	104.8	82.1 Å²	82.1	46%	0.46	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-69.5	159.6	169.5	-57.9	-38	0	0	0	111.3	H1123 V1125 G1142 W1143	H1123-F1140 VanDerWaalsContact C-CD2 3.43Å; H1123-F1140 WeakPolarHBondContact O-CD2 3.21Å; H1123-F1140 PolarHBondContact O-N 3.05Å; V1125-F1140 HydrophobicContact CG2-CE1 3.72Å; V1125-F1140 HydrophobicContact CG2-CZ 4.11Å; F1140-G1142 PolarHBondContact O-N 2.97Å; F1140-G1142 VanDerWaalsContact O-N 3.11Å; F1140-W1143 PolarHBondContact O-N 3.09Å
1141	S	84.1	Confident	82.6	Confident	128.4 Å²	128.4	78.6 Å²	78.6	90%	0.898	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	129.1	179.3	-179.5	0	0	0	0	111.5
1142	G	80.2	Confident	83.3	Confident	33 Å²	33	81.6 Å²	81.6	34%	0.34	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.2	-0.2	-174.7	0	0	0	0	0	115.5	F1140 R1152	F1140-G1142 PolarHBondContact O-N 2.97Å; F1140-G1142 VanDerWaalsContact O-N 3.11Å; G1142-R1152 WeakPolarHBondContact O-CB 3.36Å; G1142-R1152 PolarHBondContact O-N 3.2Å
1143	W	87	Confident	84.5	Confident	66.6 Å²	66.6	73.7 Å²	73.7	25%	0.252	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	158.8	178.3	-63	94.2	0	0	0	112.6	H1123 C1139 F1140 C1148 T1150 K1151	H1123-W1143 HydrophobicContact CB-CB 4.26Å; H1123-W1143 HydrophobicContact CB-CD2 3.86Å; H1123-W1143 HydrophobicContact CB-CE3 4.32Å; H1123-W1143 HydrophobicContact CB-CG 3.8Å; H1123-W1143 AromaticContact CD2-CD2 3.61Å; H1123-W1143 VanDerWaalsContact CD2-CD2 3.5Å; H1123-W1143 AromaticContact CD2-CE2 3.46Å; H1123-W1143 VanDerWaalsContact CD2-CE2 3.44Å; H1123-W1143 AromaticContact CD2-CE3 3.61Å; H1123-W1143 VanDerWaalsContact CD2-CE3 3.5Å; H1123-W1143 AromaticContact CD2-CH2 3.39Å; H1123-W1143 VanDerWaalsContact CD2-CH2 3.42Å; H1123-W1143 WeakPolarHBondContact CD2-CH2 3.32Å; H1123-W1143 AromaticContact CD2-CZ2 3.38Å; H1123-W1143 VanDerWaalsContact CD2-CZ2 3.44Å; H1123-W1143 WeakPolarHBondContact CD2-CZ2 3.37Å; H1123-W1143 AromaticContact CD2-CZ3 3.51Å; H1123-W1143 VanDerWaalsContact CD2-CZ3 3.43Å; H1123-W1143 WeakPolarHBondContact CD2-CZ3 2.97Å; H1123-W1143 AromaticContact CD2-NE1 3.94Å; H1123-W1143 AromaticContact CE1-CZ2 3.79Å; H1123-W1143 AromaticContact CG-CD2 3.78Å; H1123-W1143 AromaticContact CG-CE2 3.67Å; H1123-W1143 AromaticContact CG-CZ2 3.9Å; H1123-W1143 AromaticContact CG-NE1 3.88Å; H1123-W1143 AromaticContact ND1-CE2 3.93Å; H1123-W1143 AromaticContact ND1-NE1 3.97Å; H1123-W1143 AromaticContact NE2-CE2 3.86Å; H1123-W1143 AromaticContact NE2-CH2 3.47Å; H1123-W1143 WeakPolarHBondContact NE2-CH2 3.3Å; H1123-W1143 AromaticContact NE2-CZ2 3.36Å; H1123-W1143 VanDerWaalsContact NE2-CZ2 3.27Å; H1123-W1143 WeakPolarHBondContact NE2-CZ2 3.28Å; H1123-W1143 AromaticContact NE2-CZ3 3.97Å; C1139-W1143 HydrophobicContact CB-CB 4.15Å; F1140-W1143 PolarHBondContact O-N 3.09Å; W1143-C1148 HydrophobicContact CB-CB 4.47Å; W1143-C1148 VanDerWaalsContact CE3-O 3.32Å; W1143-T1150 CarbonylContact C-O 3.44Å; W1143-T1150 WeakPolarHBondContact CA-O 3.2Å; W1143-K1151 HydrophobicContact CD2-CG 4.46Å; W1143-K1151 HydrophobicContact CE3-CB 4.03Å; W1143-K1151 HydrophobicContact CE3-CG 4.36Å; W1143-K1151 HydrophobicContact CH2-CB 4.1Å; W1143-K1151 HydrophobicContact CH2-CD 4.25Å; W1143-K1151 HydrophobicContact CH2-CG 4.24Å; W1143-K1151 HydrophobicContact CZ2-CD 4.37Å; W1143-K1151 HydrophobicContact CZ2-CG 4.35Å; W1143-K1151 HydrophobicContact CZ3-CB 3.74Å; W1143-K1151 HydrophobicContact CZ3-CG 4.28Å
1144	T	85.4	Confident	85.2	Confident	53 Å²	53	68.1 Å²	68.1	33%	0.325	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162	176.3	-177.2	-164.1	0	0	0	0	110.8	C1148 T1150 R1152	T1144-C1148 CarbonylContact O-C 3.56Å; T1144-C1148 VanDerWaalsContact O-C 3.32Å; T1144-C1148 VanDerWaalsContact O-CA 3.3Å; T1144-C1148 WeakPolarHBondContact O-CA 3.28Å; T1144-T1150 HydrophobicContact CG2-CG2 4.06Å; T1144-T1150 WeakPolarHBondContact CG2-O 3.39Å; T1144-T1150 PolarHBondContact N-O 3.05Å; T1144-T1150 WeakPolarHBondContact O-CA 3.3Å; T1144-T1150 VanDerWaalsContact O-CB 3.27Å; T1144-T1150 WeakPolarHBondContact O-CB 3.3Å; T1144-T1150 PolarHBondContact O-N 2.89Å; T1144-R1152 HydrophobicContact CG2-CB 4.23Å; T1144-R1152 HydrophobicContact CG2-CG 4.44Å
1145	G	84.3	Confident	85.7	Confident	32.4 Å²	32.4	66.2 Å²	66.2	33%	0.334	37%	0.366	S	S	.	.	S	Bend	trans	99.1	162.5	-169.6	0	0	0	0	0	111.6	D1147 C1148	G1145-D1147 PolarHBondContact O-N 3.09Å; G1145-C1148 PolarHBondContact O-N 3.12Å
1146	S	86.3	Confident	86	Confident	91.8 Å²	91.8	68.5 Å²	68.5	64%	0.642	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-27.7	-179.4	43.3	0	0	0	0	113.6	C1137	C1137-S1146 VanDerWaalsContact CB-O 3.27Å; C1137-S1146 WeakPolarHBondContact CB-O 3.3Å; C1137-S1146 PolarHBondContact SG-O 3.09Å; C1137-S1146 VanDerWaalsContact SG-O 3.38Å
1147	D	87.4	Confident	86.1	Confident	52.6 Å²	52.6	65.6 Å²	65.6	28%	0.281	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.2	11.9	-174.8	24.4	-25.7	0	0	0	111	D1119 C1120 S1121 G1145 N1149	D1119-D1147 WeakPolarHBondContact O-CB 3.49Å; C1120-D1147 CarbonylContact C-O 3.45Å; C1120-D1147 WeakPolarHBondContact CA-O 3.28Å; S1121-D1147 VanDerWaalsContact CB-O 3.24Å; S1121-D1147 WeakPolarHBondContact CB-O 3.28Å; S1121-D1147 PolarHBondContact N-O 3.13Å; S1121-D1147 PolarHBondContact OG-O 3.06Å; G1145-D1147 PolarHBondContact O-N 3.09Å; D1147-N1149 PolarHBondContact O-N 2.88Å; D1147-N1149 VanDerWaalsContact O-N 3.09Å; D1147-N1149 WeakPolarHBondContact OD1-CB 3.33Å; D1147-N1149 PolarHBondContact OD1-N 3.03Å; D1147-N1149 VanDerWaalsContact OD1-N 3.15Å; D1147-N1149 PolarHBondContact OD1-ND2 3.19Å; D1147-N1149 PolarHBondContact OD2-ND2 3.01Å; D1147-N1149 VanDerWaalsContact OD2-ND2 3.12Å
1148	C	88.7	Confident	86.2	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	38%	0.375	C	S	.	.	S	Bend	trans	55.1	16.4	-176.4	-53.4	0	0	0	0	116.6	C1120 H1123 C1137 C1139 W1143 T1144 G1145 T1150	C1120-C1148 WeakPolarHBondContact O-CB 3.23Å; H1123-C1148 HydrophobicContact CB-CB 4.13Å; H1123-C1148 WeakPolarHBondContact O-CB 3.3Å; C1137-C1148 VanDerWaalsContact CB-SG 3.54Å; C1137-C1148 WeakPolarHBondContact CB-SG 3.49Å; C1139-C1148 WeakPolarHBondContact CA-SG 3.36Å; C1139-C1148 HydrophobicContact CB-CB 3.77Å; C1139-C1148 WeakPolarHBondContact CB-SG 3.36Å; C1139-C1148 PolarHBondContact N-SG 2.9Å; C1139-C1148 VanDerWaalsContact N-SG 3.42Å; C1139-C1148 WeakPolarHBondContact SG-CA 3.34Å; C1139-C1148 WeakPolarHBondContact SG-CB 3.38Å; C1139-C1148 CovalentContact SG-SG 2.04Å; C1139-C1148 PolarHBondContact SG-SG 2.86Å; W1143-C1148 HydrophobicContact CB-CB 4.47Å; W1143-C1148 VanDerWaalsContact CE3-O 3.32Å; T1144-C1148 CarbonylContact O-C 3.56Å; T1144-C1148 VanDerWaalsContact O-C 3.32Å; T1144-C1148 VanDerWaalsContact O-CA 3.3Å; T1144-C1148 WeakPolarHBondContact O-CA 3.28Å; G1145-C1148 PolarHBondContact O-N 3.12Å; C1148-T1150 VanDerWaalsContact C-N 3.27Å; C1148-T1150 PolarHBondContact O-N 3.05Å
1149	N	86.4	Confident	86.1	Confident	75.6 Å²	75.6	69.2 Å²	69.2	40%	0.404	38%	0.376	S	S	.	.			trans	-69.4	-16.6	-179.1	51.3	10.7	0	0	0	114.7	S1121 D1147	S1121-N1149 WeakPolarHBondContact CB-OD1 3.1Å; S1121-N1149 PolarHBondContact OG-OD1 3.13Å; D1147-N1149 PolarHBondContact O-N 2.88Å; D1147-N1149 VanDerWaalsContact O-N 3.09Å; D1147-N1149 WeakPolarHBondContact OD1-CB 3.33Å; D1147-N1149 PolarHBondContact OD1-N 3.03Å; D1147-N1149 VanDerWaalsContact OD1-N 3.15Å; D1147-N1149 PolarHBondContact OD1-ND2 3.19Å; D1147-N1149 PolarHBondContact OD2-ND2 3.01Å; D1147-N1149 VanDerWaalsContact OD2-ND2 3.12Å
1150	T	82.5	Confident	86.2	Confident	59.8 Å²	59.8	68.6 Å²	68.6	37%	0.367	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	121.2	-170.5	-58.1	0	0	0	0	110.9	W1143 T1144 C1148 R1152	W1143-T1150 CarbonylContact C-O 3.44Å; W1143-T1150 WeakPolarHBondContact CA-O 3.2Å; T1144-T1150 HydrophobicContact CG2-CG2 4.06Å; T1144-T1150 WeakPolarHBondContact CG2-O 3.39Å; T1144-T1150 PolarHBondContact N-O 3.05Å; T1144-T1150 WeakPolarHBondContact O-CA 3.3Å; T1144-T1150 VanDerWaalsContact O-CB 3.27Å; T1144-T1150 WeakPolarHBondContact O-CB 3.3Å; T1144-T1150 PolarHBondContact O-N 2.89Å; C1148-T1150 VanDerWaalsContact C-N 3.27Å; C1148-T1150 PolarHBondContact O-N 3.05Å; T1150-R1152 PolarHBondContact O-N 2.83Å
1151	K	81.3	Confident	86.3	Confident	106.4 Å²	106.4	63.8 Å²	63.8	46%	0.463	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	128.3	176.8	-161.8	172.8	-174.9	176.9	0	111	W1143 N1165 G1166	W1143-K1151 HydrophobicContact CD2-CG 4.46Å; W1143-K1151 HydrophobicContact CE3-CB 4.03Å; W1143-K1151 HydrophobicContact CE3-CG 4.36Å; W1143-K1151 HydrophobicContact CH2-CB 4.1Å; W1143-K1151 HydrophobicContact CH2-CD 4.25Å; W1143-K1151 HydrophobicContact CH2-CG 4.24Å; W1143-K1151 HydrophobicContact CZ2-CD 4.37Å; W1143-K1151 HydrophobicContact CZ2-CG 4.35Å; W1143-K1151 HydrophobicContact CZ3-CB 3.74Å; W1143-K1151 HydrophobicContact CZ3-CG 4.28Å; K1151-N1165 PolarHBondContact N-OD1 3.44Å; K1151-G1166 VanDerWaalsContact O-CA 3.3Å; K1151-G1166 WeakPolarHBondContact O-CA 3.23Å; K1151-G1166 PolarHBondContact O-N 3.07Å; K1151-G1166 VanDerWaalsContact O-N 3.1Å
1152	R	84.2	Confident	86.7	Confident	144.2 Å²	144.2	64.6 Å²	64.6	54%	0.544	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-85.2	128.5	-174.4	-171	-178.9	-179.8	109.6	0.2	111	G1142 T1144 T1150	G1142-R1152 WeakPolarHBondContact O-CB 3.36Å; G1142-R1152 PolarHBondContact O-N 3.2Å; T1144-R1152 HydrophobicContact CG2-CB 4.23Å; T1144-R1152 HydrophobicContact CG2-CG 4.44Å; T1150-R1152 PolarHBondContact O-N 2.83Å
1153	C	86.2	Confident	87.1	Confident	10.2 Å²	10.2	65.1 Å²	65.1	7%	0.069	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-76.7	160.1	171.9	-58.5	0	0	0	0	112.6	C1157 F1158 C1163 G1166	C1153-C1157 HydrophobicContact CB-CB 4.18Å; C1153-F1158 HydrophobicContact CB-CE2 4.42Å; C1153-F1158 HydrophobicContact CB-CZ 4.37Å; C1153-C1163 HydrophobicContact CB-CB 3.72Å; C1153-C1163 WeakPolarHBondContact CB-SG 3.26Å; C1153-C1163 PolarHBondContact N-SG 2.93Å; C1153-C1163 VanDerWaalsContact SG-CA 3.53Å; C1153-C1163 WeakPolarHBondContact SG-CA 3.23Å; C1153-C1163 WeakPolarHBondContact SG-CB 3.35Å; C1153-C1163 CovalentContact SG-SG 2.03Å; C1153-C1163 PolarHBondContact SG-SG 3.06Å; C1153-G1166 VanDerWaalsContact SG-C 3.53Å; C1153-G1166 VanDerWaalsContact SG-CA 3.54Å
1154	D	85.9	Confident	87.1	Confident	47.8 Å²	47.8	65 Å²	65	26%	0.256	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-55.4	143.1	166.8	-170.8	-61	0	0	0	111	R1156 C1157 Y1178	D1154-R1156 PolarHBondContact O-N 3.12Å; D1154-R1156 VanDerWaalsContact OD1-CB 3.26Å; D1154-R1156 WeakPolarHBondContact OD1-CB 3.32Å; D1154-R1156 VanDerWaalsContact OD1-CG 3.28Å; D1154-R1156 WeakPolarHBondContact OD1-CG 3.36Å; D1154-R1156 IonicContact OD1-CZ 3.44Å; D1154-R1156 PolarHBondContact OD1-N 3.15Å; D1154-R1156 IonicContact OD1-NE 3.11Å; D1154-R1156 PolarHBondContact OD1-NE 2.94Å; D1154-R1156 IonicContact OD1-NH2 3.35Å; D1154-R1156 IonicContact OD2-CZ 3.12Å; D1154-R1156 IonicContact OD2-NE 3.23Å; D1154-R1156 PolarHBondContact OD2-NE 3.1Å; D1154-R1156 VanDerWaalsContact OD2-NE 3.14Å; D1154-R1156 IonicContact OD2-NH2 3.32Å; D1154-R1156 PolarHBondContact OD2-NH2 3.1Å; D1154-C1157 WeakPolarHBondContact O-CB 3.38Å; D1154-C1157 PolarHBondContact O-N 2.88Å; D1154-C1157 VanDerWaalsContact O-N 3.13Å; D1154-Y1178 HydrophobicContact CB-CD1 3.38Å; D1154-Y1178 VanDerWaalsContact CB-CD1 3.47Å; D1154-Y1178 HydrophobicContact CB-CE1 3.6Å; D1154-Y1178 HydrophobicContact CB-CG 4.28Å
1155	T	86.4	Confident	87	Confident	102.4 Å²	102.4	68.4 Å²	68.4	63%	0.628	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-25.7	-178.9	43.3	0	0	0	0	113.7	C1157 F1158	T1155-C1157 VanDerWaalsContact C-N 3.27Å; T1155-C1157 PolarHBondContact O-N 3.08Å; T1155-F1158 PolarHBondContact O-N 2.9Å
1156	R	86.4	Confident	86.8	Confident	74.8 Å²	74.8	68.1 Å²	68.1	28%	0.282	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-30.1	176.7	-64.8	173.4	-70.4	168.8	-3.9	112.6	D1154 F1158 I1159 Y1178 T1180 P1565	D1154-R1156 PolarHBondContact O-N 3.12Å; D1154-R1156 VanDerWaalsContact OD1-CB 3.26Å; D1154-R1156 WeakPolarHBondContact OD1-CB 3.32Å; D1154-R1156 VanDerWaalsContact OD1-CG 3.28Å; D1154-R1156 WeakPolarHBondContact OD1-CG 3.36Å; D1154-R1156 IonicContact OD1-CZ 3.44Å; D1154-R1156 PolarHBondContact OD1-N 3.15Å; D1154-R1156 IonicContact OD1-NE 3.11Å; D1154-R1156 PolarHBondContact OD1-NE 2.94Å; D1154-R1156 IonicContact OD1-NH2 3.35Å; D1154-R1156 IonicContact OD2-CZ 3.12Å; D1154-R1156 IonicContact OD2-NE 3.23Å; D1154-R1156 PolarHBondContact OD2-NE 3.1Å; D1154-R1156 VanDerWaalsContact OD2-NE 3.14Å; D1154-R1156 IonicContact OD2-NH2 3.32Å; D1154-R1156 PolarHBondContact OD2-NH2 3.1Å; R1156-F1158 VanDerWaalsContact C-N 3.26Å; R1156-F1158 PolarHBondContact O-N 3.22Å; R1156-I1159 WeakPolarHBondContact O-CB 3.19Å; R1156-I1159 WeakPolarHBondContact O-CG1 3.27Å; R1156-I1159 PolarHBondContact O-N 3.16Å; R1156-Y1178 VanDerWaalsContact NH2-CD2 3.27Å; R1156-Y1178 VanDerWaalsContact NH2-CE2 3.29Å; R1156-T1180 HydrophobicContact CB-CG2 3.67Å; R1156-T1180 HydrophobicContact CG-CG2 4.31Å; R1156-P1565 PolarHBondContact NH1-O 3.14Å; R1156-P1565 PolarHBondContact NH2-O 2.84Å
1157	C	89.7	Confident	86.8	Confident	0.2 Å²	0.2	68.1 Å²	68.1	0%	0.001	35%	0.349	C	S	.	.	H	α-helix	trans	-53.1	-41.4	178.8	177.3	0	0	0	0	113	C1153 D1154 T1155 I1159 N1160 G1161 C1168 Y1178	C1153-C1157 HydrophobicContact CB-CB 4.18Å; D1154-C1157 WeakPolarHBondContact O-CB 3.38Å; D1154-C1157 PolarHBondContact O-N 2.88Å; D1154-C1157 VanDerWaalsContact O-N 3.13Å; T1155-C1157 VanDerWaalsContact C-N 3.27Å; T1155-C1157 PolarHBondContact O-N 3.08Å; C1157-I1159 PolarHBondContact O-N 2.99Å; C1157-I1159 VanDerWaalsContact O-N 3.15Å; C1157-N1160 PolarHBondContact O-N 3.14Å; C1157-G1161 CarbonylContact O-C 3.39Å; C1157-G1161 WeakPolarHBondContact O-CA 3.32Å; C1157-G1161 PolarHBondContact O-N 3.16Å; C1157-C1168 WeakPolarHBondContact CA-SG 3.27Å; C1157-C1168 HydrophobicContact CB-CB 3.85Å; C1157-C1168 WeakPolarHBondContact CB-SG 3.33Å; C1157-C1168 VanDerWaalsContact SG-CA 3.59Å; C1157-C1168 WeakPolarHBondContact SG-CB 3.27Å; C1157-C1168 CovalentContact SG-SG 2.03Å; C1157-C1168 PolarHBondContact SG-SG 2.88Å; C1157-Y1178 WeakPolarHBondContact CA-O 3.3Å
1158	F	89.7	Confident	86.9	Confident	119 Å²	119	66.4 Å²	66.4	52%	0.522	34%	0.341	S	S	.	.	H	α-helix	trans	-71.5	-10.8	-171.4	-58.6	-80.8	0	0	0	114.2	C1153 T1155 R1156 C1163	C1153-F1158 HydrophobicContact CB-CE2 4.42Å; C1153-F1158 HydrophobicContact CB-CZ 4.37Å; T1155-F1158 PolarHBondContact O-N 2.9Å; R1156-F1158 VanDerWaalsContact C-N 3.26Å; R1156-F1158 PolarHBondContact O-N 3.22Å; F1158-C1163 HydrophobicContact CE1-CB 3.67Å; F1158-C1163 HydrophobicContact CZ-CB 3.79Å
1159	I	89.2	Confident	87	Confident	110.4 Å²	110.4	70.6 Å²	70.6	57%	0.566	36%	0.363	S	S	*	.	H	α-helix	trans	-71.1	-53.6	173.4	-51.4	172.9	0	0	0	109.1	R1156 C1157 K1171	R1156-I1159 WeakPolarHBondContact O-CB 3.19Å; R1156-I1159 WeakPolarHBondContact O-CG1 3.27Å; R1156-I1159 PolarHBondContact O-N 3.16Å; C1157-I1159 PolarHBondContact O-N 2.99Å; C1157-I1159 VanDerWaalsContact O-N 3.15Å; I1159-K1171 PolarHBondContact O-NZ 2.99Å
1160	N	90.4	Very high	87.2	Confident	28 Å²	28	68.5 Å²	68.5	15%	0.15	35%	0.354	C	S	.	.	H	α-helix	trans	-127	8	-163.5	-73.4	-22.9	0	0	0	114.8	C1157 K1171 W1174 C1179	C1157-N1160 PolarHBondContact O-N 3.14Å; N1160-K1171 VanDerWaalsContact O-CB 3.28Å; N1160-K1171 WeakPolarHBondContact O-CB 3.36Å; N1160-K1171 WeakPolarHBondContact O-CD 3.32Å; N1160-K1171 VanDerWaalsContact O-CG 3.26Å; N1160-K1171 WeakPolarHBondContact O-CG 3.39Å; N1160-K1171 PolarHBondContact O-N 2.97Å; N1160-W1174 HydrophobicContact CB-CB 4.21Å; N1160-W1174 HydrophobicContact CB-CD2 3.68Å; N1160-W1174 HydrophobicContact CB-CE3 4.07Å; N1160-W1174 HydrophobicContact CB-CG 3.71Å; N1160-W1174 VanDerWaalsContact CG-CD2 3.44Å; N1160-W1174 VanDerWaalsContact CG-CE2 3.44Å; N1160-W1174 VanDerWaalsContact ND2-CD2 3.3Å; N1160-W1174 VanDerWaalsContact ND2-CE2 3.3Å; N1160-W1174 VanDerWaalsContact ND2-CH2 3.27Å; N1160-W1174 WeakPolarHBondContact ND2-CH2 3.3Å; N1160-W1174 VanDerWaalsContact ND2-CZ2 3.34Å; N1160-W1174 WeakPolarHBondContact ND2-CZ2 3.25Å; N1160-W1174 WeakPolarHBondContact ND2-CZ3 3.4Å; N1160-C1179 HydrophobicContact CB-CB 4.06Å; N1160-C1179 WeakPolarHBondContact CB-O 3.31Å; N1160-C1179 PolarHBondContact ND2-O 3.06Å
1161	G	91.6	Very high	87.5	Confident	3.8 Å²	3.8	69.3 Å²	69.3	4%	0.039	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	-170.6	176.2	0	0	0	0	0	112.6	C1157 I1169	C1157-G1161 CarbonylContact O-C 3.39Å; C1157-G1161 WeakPolarHBondContact O-CA 3.32Å; C1157-G1161 PolarHBondContact O-N 3.16Å; G1161-I1169 CarbonylContact C-O 3.4Å; G1161-I1169 WeakPolarHBondContact CA-O 3.42Å
1162	Y	91.9	Very high	87.8	Confident	144.6 Å²	144.6	69.4 Å²	69.4	57%	0.567	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.2	133.1	177.8	-41.4	-77	0	0	0	109.5	T1164 I1169 K1171	Y1162-T1164 HydrophobicContact CD2-CG2 3.99Å; Y1162-T1164 HydrophobicContact CE2-CG2 4.19Å; Y1162-T1164 PolarHBondContact O-N 3.22Å; Y1162-T1164 PolarHBondContact O-OG1 2.99Å; Y1162-I1169 HydrophobicContact CD1-CB 4.2Å; Y1162-I1169 VanDerWaalsContact CD1-O 3.25Å; Y1162-I1169 WeakPolarHBondContact CD1-O 3.18Å; Y1162-I1169 HydrophobicContact CD2-CB 4.3Å; Y1162-I1169 HydrophobicContact CE1-CB 3.79Å; Y1162-I1169 HydrophobicContact CE1-CG2 3.68Å; Y1162-I1169 HydrophobicContact CE2-CB 3.91Å; Y1162-I1169 HydrophobicContact CE2-CD1 3.79Å; Y1162-I1169 HydrophobicContact CE2-CG1 4.36Å; Y1162-I1169 HydrophobicContact CE2-CG2 4.24Å; Y1162-I1169 HydrophobicContact CG-CB 4.44Å; Y1162-I1169 PolarHBondContact N-O 3.02Å; Y1162-I1169 PolarHBondContact O-N 2.87Å; Y1162-I1169 WeakPolarHBondContact OH-CG2 3.43Å; Y1162-K1171 HydrophobicContact CD2-CG 4.38Å; Y1162-K1171 HydrophobicContact CE2-CD 4.42Å; Y1162-K1171 HydrophobicContact CE2-CG 3.69Å
1163	C	87.5	Confident	87.9	Confident	43.4 Å²	43.4	62.8 Å²	62.8	29%	0.293	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	122.9	-179.4	-176.6	0	0	0	0	111.1	C1153 F1158	C1153-C1163 HydrophobicContact CB-CB 3.72Å; C1153-C1163 WeakPolarHBondContact CB-SG 3.26Å; C1153-C1163 PolarHBondContact N-SG 2.93Å; C1153-C1163 VanDerWaalsContact SG-CA 3.53Å; C1153-C1163 WeakPolarHBondContact SG-CA 3.23Å; C1153-C1163 WeakPolarHBondContact SG-CB 3.35Å; C1153-C1163 CovalentContact SG-SG 2.03Å; C1153-C1163 PolarHBondContact SG-SG 3.06Å; F1158-C1163 HydrophobicContact CE1-CB 3.67Å; F1158-C1163 HydrophobicContact CZ-CB 3.79Å
1164	T	88.1	Confident	88.1	Confident	65.2 Å²	65.2	64.9 Å²	64.9	40%	0.4	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	107.4	175.3	42.1	0	0	0	0	109.6	Y1162 G1166 T1167 I1169	Y1162-T1164 HydrophobicContact CD2-CG2 3.99Å; Y1162-T1164 HydrophobicContact CE2-CG2 4.19Å; Y1162-T1164 PolarHBondContact O-N 3.22Å; Y1162-T1164 PolarHBondContact O-OG1 2.99Å; T1164-G1166 VanDerWaalsContact C-N 3.3Å; T1164-G1166 PolarHBondContact O-N 2.79Å; T1164-G1166 VanDerWaalsContact O-N 3.13Å; T1164-T1167 PolarHBondContact N-O 2.91Å; T1164-T1167 WeakPolarHBondContact O-CB 3.13Å; T1164-T1167 PolarHBondContact O-N 3.18Å; T1164-T1167 PolarHBondContact OG1-O 2.97Å; T1164-I1169 HydrophobicContact CG2-CD1 3.94Å; T1164-I1169 HydrophobicContact CG2-CG1 4.47Å; T1164-I1169 VanDerWaalsContact OG1-CD1 3.3Å; T1164-I1169 WeakPolarHBondContact OG1-CD1 3.37Å
1165	N	83.4	Confident	88.2	Confident	124 Å²	124	64.3 Å²	64.3	66%	0.663	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.7	43.1	179.9	-145.3	8	0	0	0	114.8	K1151 T1167	K1151-N1165 PolarHBondContact N-OD1 3.44Å; N1165-T1167 VanDerWaalsContact C-N 3.31Å; N1165-T1167 PolarHBondContact O-N 2.78Å
1166	G	80.4	Confident	88.2	Confident	26.4 Å²	26.4	61.3 Å²	61.3	27%	0.272	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.8	-6.3	-179.2	0	0	0	0	0	115.8	K1151 C1153 T1164	K1151-G1166 VanDerWaalsContact O-CA 3.3Å; K1151-G1166 WeakPolarHBondContact O-CA 3.23Å; K1151-G1166 PolarHBondContact O-N 3.07Å; K1151-G1166 VanDerWaalsContact O-N 3.1Å; C1153-G1166 VanDerWaalsContact SG-C 3.53Å; C1153-G1166 VanDerWaalsContact SG-CA 3.54Å; T1164-G1166 VanDerWaalsContact C-N 3.3Å; T1164-G1166 PolarHBondContact O-N 2.79Å; T1164-G1166 VanDerWaalsContact O-N 3.13Å
1167	T	86.3	Confident	88.2	Confident	91.6 Å²	91.6	63.6 Å²	63.6	56%	0.562	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.5	135.7	170.3	-58.2	0	0	0	0	109.6	T1164 N1165	T1164-T1167 PolarHBondContact N-O 2.91Å; T1164-T1167 WeakPolarHBondContact O-CB 3.13Å; T1164-T1167 PolarHBondContact O-N 3.18Å; T1164-T1167 PolarHBondContact OG1-O 2.97Å; N1165-T1167 VanDerWaalsContact C-N 3.31Å; N1165-T1167 PolarHBondContact O-N 2.78Å
1168	C	89.4	Confident	88.2	Confident	17.2 Å²	17.2	65.5 Å²	65.5	12%	0.116	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	129	169.7	-159.1	0	0	0	0	110	C1157 K1177 C1179	C1157-C1168 WeakPolarHBondContact CA-SG 3.27Å; C1157-C1168 HydrophobicContact CB-CB 3.85Å; C1157-C1168 WeakPolarHBondContact CB-SG 3.33Å; C1157-C1168 VanDerWaalsContact SG-CA 3.59Å; C1157-C1168 WeakPolarHBondContact SG-CB 3.27Å; C1157-C1168 CovalentContact SG-SG 2.03Å; C1157-C1168 PolarHBondContact SG-SG 2.88Å; C1168-K1177 VanDerWaalsContact CB-O 3.3Å; C1168-K1177 WeakPolarHBondContact CB-O 3.27Å; C1168-C1179 PolarHBondContact SG-SG 2.89Å
1169	I	90.2	Very high	88.2	Confident	87.4 Å²	87.4	59.9 Å²	59.9	45%	0.448	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	119.7	170.3	-58.6	179.4	0	0	0	107.8	G1161 Y1162 T1164	G1161-I1169 CarbonylContact C-O 3.4Å; G1161-I1169 WeakPolarHBondContact CA-O 3.42Å; Y1162-I1169 HydrophobicContact CD1-CB 4.2Å; Y1162-I1169 VanDerWaalsContact CD1-O 3.25Å; Y1162-I1169 WeakPolarHBondContact CD1-O 3.18Å; Y1162-I1169 HydrophobicContact CD2-CB 4.3Å; Y1162-I1169 HydrophobicContact CE1-CB 3.79Å; Y1162-I1169 HydrophobicContact CE1-CG2 3.68Å; Y1162-I1169 HydrophobicContact CE2-CB 3.91Å; Y1162-I1169 HydrophobicContact CE2-CD1 3.79Å; Y1162-I1169 HydrophobicContact CE2-CG1 4.36Å; Y1162-I1169 HydrophobicContact CE2-CG2 4.24Å; Y1162-I1169 HydrophobicContact CG-CB 4.44Å; Y1162-I1169 PolarHBondContact N-O 3.02Å; Y1162-I1169 PolarHBondContact O-N 2.87Å; Y1162-I1169 WeakPolarHBondContact OH-CG2 3.43Å; T1164-I1169 HydrophobicContact CG2-CD1 3.94Å; T1164-I1169 HydrophobicContact CG2-CG1 4.47Å; T1164-I1169 VanDerWaalsContact OG1-CD1 3.3Å; T1164-I1169 WeakPolarHBondContact OG1-CD1 3.37Å
1170	C	89.8	Confident	88.1	Confident	32.6 Å²	32.6	56.5 Å²	56.5	22%	0.22	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	149.4	-174.4	-53.8	0	0	0	0	113.1	W1174 G1176 C1179	C1170-W1174 HydrophobicContact CB-CB 4.07Å; C1170-W1174 WeakPolarHBondContact CB-O 3.35Å; C1170-G1176 PolarHBondContact SG-O 2.81Å; C1170-C1179 WeakPolarHBondContact CA-SG 3.39Å; C1170-C1179 HydrophobicContact CB-CB 3.77Å; C1170-C1179 WeakPolarHBondContact CB-SG 3.32Å; C1170-C1179 PolarHBondContact N-SG 3.01Å; C1170-C1179 VanDerWaalsContact N-SG 3.42Å; C1170-C1179 VanDerWaalsContact SG-CA 3.52Å; C1170-C1179 WeakPolarHBondContact SG-CA 3.21Å; C1170-C1179 WeakPolarHBondContact SG-CB 3.29Å; C1170-C1179 CovalentContact SG-SG 2.04Å; C1170-C1179 PolarHBondContact SG-SG 2.9Å
1171	K	90.3	Very high	88	Confident	76.6 Å²	76.6	56.6 Å²	56.6	33%	0.333	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-66.9	158.6	164.3	-64.4	166.8	-166.9	172.4	0	108.9	I1159 N1160 Y1162 G1173 W1174	I1159-K1171 PolarHBondContact O-NZ 2.99Å; N1160-K1171 VanDerWaalsContact O-CB 3.28Å; N1160-K1171 WeakPolarHBondContact O-CB 3.36Å; N1160-K1171 WeakPolarHBondContact O-CD 3.32Å; N1160-K1171 VanDerWaalsContact O-CG 3.26Å; N1160-K1171 WeakPolarHBondContact O-CG 3.39Å; N1160-K1171 PolarHBondContact O-N 2.97Å; Y1162-K1171 HydrophobicContact CD2-CG 4.38Å; Y1162-K1171 HydrophobicContact CE2-CD 4.42Å; Y1162-K1171 HydrophobicContact CE2-CG 3.69Å; K1171-G1173 PolarHBondContact O-N 3.23Å; K1171-W1174 PolarHBondContact O-N 2.93Å; K1171-W1174 VanDerWaalsContact O-N 3.09Å
1172	V	87.2	Confident	87.7	Confident	107 Å²	107	58.8 Å²	58.8	65%	0.648	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	132.2	175.5	-179.3	0	0	0	0	109.7	C1194 Y1203	V1172-C1194 HydrophobicContact CG1-CB 4.39Å; V1172-Y1203 HydrophobicContact CB-CE1 4.35Å; V1172-Y1203 HydrophobicContact CG1-CD1 4.36Å; V1172-Y1203 HydrophobicContact CG1-CE1 3.87Å; V1172-Y1203 HydrophobicContact CG2-CE1 4.39Å
1173	G	86.5	Confident	87.4	Confident	5.2 Å²	5.2	52.3 Å²	52.3	5%	0.054	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.6	-3.2	-176.9	0	0	0	0	0	115.9	K1171 G1183 C1184 C1194 Y1203	K1171-G1173 PolarHBondContact O-N 3.23Å; G1173-G1183 CarbonylContact O-C 3.56Å; G1173-G1183 VanDerWaalsContact O-CA 3.28Å; G1173-G1183 WeakPolarHBondContact O-CA 3.21Å; G1173-G1183 PolarHBondContact O-N 2.89Å; G1173-C1184 PolarHBondContact O-N 2.87Å; G1173-C1194 WeakPolarHBondContact CA-SG 3.3Å; G1173-Y1203 VanDerWaalsContact N-CZ 3.3Å
1174	W	89.6	Confident	87.5	Confident	55.8 Å²	55.8	50.4 Å²	50.4	21%	0.211	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	139.4	178.8	-69	88.5	0	0	0	112.5	N1160 C1170 K1171 C1179 L1181 D1182 H1187 Y1203	N1160-W1174 HydrophobicContact CB-CB 4.21Å; N1160-W1174 HydrophobicContact CB-CD2 3.68Å; N1160-W1174 HydrophobicContact CB-CE3 4.07Å; N1160-W1174 HydrophobicContact CB-CG 3.71Å; N1160-W1174 VanDerWaalsContact CG-CD2 3.44Å; N1160-W1174 VanDerWaalsContact CG-CE2 3.44Å; N1160-W1174 VanDerWaalsContact ND2-CD2 3.3Å; N1160-W1174 VanDerWaalsContact ND2-CE2 3.3Å; N1160-W1174 VanDerWaalsContact ND2-CH2 3.27Å; N1160-W1174 WeakPolarHBondContact ND2-CH2 3.3Å; N1160-W1174 VanDerWaalsContact ND2-CZ2 3.34Å; N1160-W1174 WeakPolarHBondContact ND2-CZ2 3.25Å; N1160-W1174 WeakPolarHBondContact ND2-CZ3 3.4Å; C1170-W1174 HydrophobicContact CB-CB 4.07Å; C1170-W1174 WeakPolarHBondContact CB-O 3.35Å; K1171-W1174 PolarHBondContact O-N 2.93Å; K1171-W1174 VanDerWaalsContact O-N 3.09Å; W1174-C1179 HydrophobicContact CB-CB 4.29Å; W1174-C1179 VanDerWaalsContact CE3-O 3.27Å; W1174-L1181 VanDerWaalsContact CE3-O 3.31Å; W1174-D1182 HydrophobicContact CH2-CB 4.24Å; W1174-D1182 HydrophobicContact CZ3-CB 4.03Å; W1174-H1187 AromaticContact CH2-CE1 3.86Å; W1174-H1187 AromaticContact CZ2-CE1 3.47Å; W1174-H1187 VanDerWaalsContact CZ2-CE1 3.47Å; W1174-H1187 WeakPolarHBondContact CZ2-CE1 3.47Å; W1174-H1187 AromaticContact CZ2-NE2 3.47Å; W1174-H1187 WeakPolarHBondContact CZ2-NE2 3.4Å; W1174-Y1203 WeakPolarHBondContact O-CD2 3.32Å; W1174-Y1203 WeakPolarHBondContact O-CE2 3.38Å
1175	N	88	Confident	87.4	Confident	34.6 Å²	34.6	48.2 Å²	48.2	19%	0.185	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	159.6	-172.5	-81.5	-29.2	0	0	0	112.2	C1179 T1180 L1181 G1183 S1202 Y1203	N1175-C1179 CarbonylContact O-C 3.55Å; N1175-C1179 VanDerWaalsContact O-CA 3.29Å; N1175-C1179 WeakPolarHBondContact O-CA 3.19Å; N1175-T1180 PolarHBondContact O-N 3.03Å; N1175-L1181 HydrophobicContact CB-CB 3.95Å; N1175-L1181 PolarHBondContact N-O 2.96Å; N1175-L1181 WeakPolarHBondContact O-CB 3.3Å; N1175-L1181 PolarHBondContact O-N 2.94Å; N1175-L1181 VanDerWaalsContact O-N 3.14Å; N1175-G1183 WeakPolarHBondContact ND2-CA 3.38Å; N1175-S1202 VanDerWaalsContact OD1-CA 3.29Å; N1175-S1202 WeakPolarHBondContact OD1-CA 3.2Å; N1175-Y1203 PolarHBondContact ND2-N 3.03Å; N1175-Y1203 PolarHBondContact ND2-O 2.91Å; N1175-Y1203 WeakPolarHBondContact OD1-CD2 3.39Å; N1175-Y1203 PolarHBondContact OD1-N 3Å
1176	G	86.5	Confident	87.5	Confident	40.2 Å²	40.2	46.6 Å²	46.6	41%	0.414	26%	0.264	S	S	.	.	S	Bend	trans	101.8	178.3	174.6	0	0	0	0	0	114.6	C1170 Y1178 C1179 E1564	C1170-G1176 PolarHBondContact SG-O 2.81Å; G1176-Y1178 PolarHBondContact O-N 2.86Å; G1176-C1179 PolarHBondContact O-N 2.87Å; G1176-E1564 WeakPolarHBondContact CA-OE2 3.33Å
1177	K	86.8	Confident	87.9	Confident	122.8 Å²	122.8	52 Å²	52	53%	0.534	28%	0.282	S	S	.	.	S	Bend	trans	-74.4	-25.4	179.5	-178	178.4	176.4	-176.9	0	112.8	C1168 E1564 E1566	C1168-K1177 VanDerWaalsContact CB-O 3.3Å; C1168-K1177 WeakPolarHBondContact CB-O 3.27Å; K1177-E1564 WeakPolarHBondContact CA-OE2 3.35Å; K1177-E1564 WeakPolarHBondContact CB-OE2 3.26Å; K1177-E1564 PolarHBondContact N-OE2 2.89Å; K1177-E1566 WeakPolarHBondContact CD-OE2 3.21Å; K1177-E1566 WeakPolarHBondContact CE-OE2 3.3Å; K1177-E1566 VanDerWaalsContact NZ-CD 3.26Å; K1177-E1566 IonicContact NZ-OE1 3.41Å; K1177-E1566 PolarHBondContact NZ-OE1 3.03Å; K1177-E1566 IonicContact NZ-OE2 3.8Å; K1177-E1566 PolarHBondContact NZ-OE2 2.75Å
1178	Y	88.9	Confident	88.1	Confident	40.6 Å²	40.6	47.6 Å²	47.6	16%	0.159	26%	0.255	C	S	.	.	S	Bend	trans	-117.8	4.3	179.2	-49.8	-62.6	0	0	0	113	D1154 R1156 C1157 G1176 T1180 E1564 E1566	D1154-Y1178 HydrophobicContact CB-CD1 3.38Å; D1154-Y1178 VanDerWaalsContact CB-CD1 3.47Å; D1154-Y1178 HydrophobicContact CB-CE1 3.6Å; D1154-Y1178 HydrophobicContact CB-CG 4.28Å; R1156-Y1178 VanDerWaalsContact NH2-CD2 3.27Å; R1156-Y1178 VanDerWaalsContact NH2-CE2 3.29Å; C1157-Y1178 WeakPolarHBondContact CA-O 3.3Å; G1176-Y1178 PolarHBondContact O-N 2.86Å; Y1178-T1180 VanDerWaalsContact C-N 3.28Å; Y1178-T1180 PolarHBondContact O-N 2.86Å; Y1178-E1564 HydrophobicContact CD2-CB 4.28Å; Y1178-E1564 WeakPolarHBondContact CD2-OE2 3.39Å; Y1178-E1564 PolarHBondContact N-OE1 2.92Å; Y1178-E1564 PolarHBondContact N-OE2 3.21Å; Y1178-E1566 HydrophobicContact CE2-CB 4.03Å; Y1178-E1566 VanDerWaalsContact CE2-OE2 3.3Å; Y1178-E1566 WeakPolarHBondContact CE2-OE2 3.3Å; Y1178-E1566 VanDerWaalsContact CZ-OE2 3.31Å; Y1178-E1566 PolarHBondContact OH-OE2 3.15Å
1179	C	90.2	Very high	88.1	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.267	C	S	.	.	S	Bend	trans	60	33.2	-179.7	-49.4	0	0	0	0	113.7	N1160 C1168 C1170 W1174 N1175 G1176 E1564	N1160-C1179 HydrophobicContact CB-CB 4.06Å; N1160-C1179 WeakPolarHBondContact CB-O 3.31Å; N1160-C1179 PolarHBondContact ND2-O 3.06Å; C1168-C1179 PolarHBondContact SG-SG 2.89Å; C1170-C1179 WeakPolarHBondContact CA-SG 3.39Å; C1170-C1179 HydrophobicContact CB-CB 3.77Å; C1170-C1179 WeakPolarHBondContact CB-SG 3.32Å; C1170-C1179 PolarHBondContact N-SG 3.01Å; C1170-C1179 VanDerWaalsContact N-SG 3.42Å; C1170-C1179 VanDerWaalsContact SG-CA 3.52Å; C1170-C1179 WeakPolarHBondContact SG-CA 3.21Å; C1170-C1179 WeakPolarHBondContact SG-CB 3.29Å; C1170-C1179 CovalentContact SG-SG 2.04Å; C1170-C1179 PolarHBondContact SG-SG 2.9Å; W1174-C1179 HydrophobicContact CB-CB 4.29Å; W1174-C1179 VanDerWaalsContact CE3-O 3.27Å; N1175-C1179 CarbonylContact O-C 3.55Å; N1175-C1179 VanDerWaalsContact O-CA 3.29Å; N1175-C1179 WeakPolarHBondContact O-CA 3.19Å; G1176-C1179 PolarHBondContact O-N 2.87Å; C1179-E1564 PolarHBondContact N-OE1 3.08Å; C1179-E1564 VanDerWaalsContact N-OE1 3.15Å
1180	T	87.5	Confident	88.2	Confident	38.8 Å²	38.8	49.3 Å²	49.3	24%	0.238	28%	0.28	C	S	.	.			trans	-99.2	-11.5	-178.4	56.3	0	0	0	0	114.2	R1156 N1175 Y1178 E1564	R1156-T1180 HydrophobicContact CB-CG2 3.67Å; R1156-T1180 HydrophobicContact CG-CG2 4.31Å; N1175-T1180 PolarHBondContact O-N 3.03Å; Y1178-T1180 VanDerWaalsContact C-N 3.28Å; Y1178-T1180 PolarHBondContact O-N 2.86Å; T1180-E1564 WeakPolarHBondContact CA-OE1 3.32Å; T1180-E1564 WeakPolarHBondContact CB-OE1 3.3Å; T1180-E1564 PolarHBondContact N-OE1 2.85Å; T1180-E1564 VanDerWaalsContact OG1-CD 3.29Å; T1180-E1564 WeakPolarHBondContact OG1-CG 3.17Å; T1180-E1564 PolarHBondContact OG1-OE1 3.07Å
1181	L	88.2	Confident	88.4	Confident	31.8 Å²	31.8	51 Å²	51	17%	0.166	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	128.4	171.1	-54.3	178.6	0	0	0	109.1	W1174 N1175 G1183 E1547 L1562 E1564	W1174-L1181 VanDerWaalsContact CE3-O 3.31Å; N1175-L1181 HydrophobicContact CB-CB 3.95Å; N1175-L1181 PolarHBondContact N-O 2.96Å; N1175-L1181 WeakPolarHBondContact O-CB 3.3Å; N1175-L1181 PolarHBondContact O-N 2.94Å; N1175-L1181 VanDerWaalsContact O-N 3.14Å; L1181-G1183 PolarHBondContact O-N 2.86Å; L1181-E1547 HydrophobicContact CD2-CB 4.08Å; L1181-L1562 HydrophobicContact CB-CD2 4.34Å; L1181-L1562 HydrophobicContact CD1-CB 4.42Å; L1181-L1562 HydrophobicContact CD1-CD2 4.12Å; L1181-L1562 HydrophobicContact CD1-CG 3.95Å; L1181-L1562 HydrophobicContact CD2-CD1 4.48Å; L1181-L1562 HydrophobicContact CD2-CD2 4.03Å; L1181-L1562 HydrophobicContact CD2-CG 3.95Å; L1181-L1562 HydrophobicContact CG-CD2 4.37Å; L1181-L1562 HydrophobicContact CG-CG 4.43Å; L1181-E1564 HydrophobicContact CD1-CG 3.94Å; L1181-E1564 HydrophobicContact CD2-CG 3.82Å; L1181-E1564 HydrophobicContact CG-CG 3.54Å
1182	D	84.6	Confident	88.5	Confident	49.2 Å²	49.2	48.2 Å²	48.2	26%	0.263	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	129.7	166.9	-163.7	-20.5	0	0	0	108.8	W1174 C1184 P1185 D1186 H1187	W1174-D1182 HydrophobicContact CH2-CB 4.24Å; W1174-D1182 HydrophobicContact CZ3-CB 4.03Å; D1182-C1184 VanDerWaalsContact OD1-C 3.23Å; D1182-C1184 PolarHBondContact OD1-N 2.92Å; D1182-C1184 VanDerWaalsContact OD2-O 3.13Å; D1182-P1185 WeakPolarHBondContact OD2-CA 3.33Å; D1182-D1186 PolarHBondContact OD2-N 2.95Å; D1182-H1187 IonicContact OD1-CE1 2.63Å; D1182-H1187 IonicContact OD1-ND1 2.8Å; D1182-H1187 IonicContact OD2-CE1 2.67Å; D1182-H1187 PolarHBondContact OD2-CE1 2.94Å; D1182-H1187 IonicContact OD2-ND1 3.47Å; D1182-H1187 PolarHBondContact OD2-ND1 3.28Å
1183	G	85.7	Confident	88.9	Confident	8 Å²	8	49.7 Å²	49.7	8%	0.082	28%	0.278	C	S	.	.	S	Bend	trans	-99	-14.4	176.4	0	0	0	0	0	113.6	G1173 N1175 L1181 Y1203 Y1204	G1173-G1183 CarbonylContact O-C 3.56Å; G1173-G1183 VanDerWaalsContact O-CA 3.28Å; G1173-G1183 WeakPolarHBondContact O-CA 3.21Å; G1173-G1183 PolarHBondContact O-N 2.89Å; N1175-G1183 WeakPolarHBondContact ND2-CA 3.38Å; L1181-G1183 PolarHBondContact O-N 2.86Å; G1183-Y1203 CarbonylContact O-C 3.45Å; G1183-Y1203 VanDerWaalsContact O-C 3.25Å; G1183-Y1203 WeakPolarHBondContact O-CB 3.43Å; G1183-Y1203 VanDerWaalsContact O-O 3.07Å; G1183-Y1204 VanDerWaalsContact O-CA 3.28Å; G1183-Y1204 WeakPolarHBondContact O-CA 3.21Å; G1183-Y1204 PolarHBondContact O-N 2.82Å
1184	C	90.3	Very high	89.1	Confident	3.4 Å²	3.4	51.1 Å²	51.1	2%	0.023	29%	0.286	C	S	.	.	S	Bend	trans	-137.8	82.6	-179.6	-74.5	0	0	0	0	108.6	G1173 D1182 D1186 H1187 C1188 C1194 Y1204 C1205	G1173-C1184 PolarHBondContact O-N 2.87Å; D1182-C1184 VanDerWaalsContact OD1-C 3.23Å; D1182-C1184 PolarHBondContact OD1-N 2.92Å; D1182-C1184 VanDerWaalsContact OD2-O 3.13Å; C1184-D1186 PolarHBondContact O-N 3.15Å; C1184-H1187 VanDerWaalsContact O-CA 3.26Å; C1184-H1187 WeakPolarHBondContact O-CA 3.4Å; C1184-H1187 PolarHBondContact O-N 3.13Å; C1184-C1188 PolarHBondContact O-N 2.97Å; C1184-C1194 HydrophobicContact CB-CB 3.74Å; C1184-C1194 WeakPolarHBondContact CB-SG 3.45Å; C1184-C1194 WeakPolarHBondContact SG-CA 3.28Å; C1184-C1194 WeakPolarHBondContact SG-CB 3.31Å; C1184-C1194 CovalentContact SG-SG 2.03Å; C1184-C1194 PolarHBondContact SG-SG 3.08Å; C1184-Y1204 PolarHBondContact SG-O 3.18Å; C1184-Y1204 VanDerWaalsContact SG-O 3.35Å; C1184-C1205 VanDerWaalsContact CA-SG 3.57Å
1185	P	86.5	Confident	89.2	Confident	19 Å²	19	49.6 Å²	49.6	12%	0.123	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-54.2	138.5	-168.8	-14.9	21.2	0	0	0	112	D1182 H1187 C1188 A1215 L1440 F1446	D1182-P1185 WeakPolarHBondContact OD2-CA 3.33Å; P1185-H1187 PolarHBondContact O-N 3.08Å; P1185-C1188 PolarHBondContact O-N 3.18Å; P1185-A1215 HydrophobicContact CB-CB 4.04Å; P1185-A1215 HydrophobicContact CG-CB 4.3Å; P1185-A1215 VanDerWaalsContact O-CB 3.28Å; P1185-A1215 WeakPolarHBondContact O-CB 3.29Å; P1185-L1440 HydrophobicContact CB-CD1 3.97Å; P1185-L1440 HydrophobicContact CB-CD2 4.42Å; P1185-L1440 HydrophobicContact CG-CD1 4.18Å; P1185-F1446 HydrophobicContact CB-CZ 4.14Å; P1185-F1446 HydrophobicContact CG-CZ 4.27Å
1186	D	84.7	Confident	89.1	Confident	91.2 Å²	91.2	52.4 Å²	52.4	49%	0.488	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	49.6	29.2	-174.9	-62.4	-50.2	0	0	0	114.1	D1182 C1184 C1188 N1189	D1182-D1186 PolarHBondContact OD2-N 2.95Å; C1184-D1186 PolarHBondContact O-N 3.15Å; D1186-C1188 VanDerWaalsContact C-N 3.3Å; D1186-C1188 PolarHBondContact O-N 2.99Å; D1186-C1188 VanDerWaalsContact O-N 3.13Å; D1186-N1189 WeakPolarHBondContact O-CA 3.37Å; D1186-N1189 PolarHBondContact O-N 2.88Å
1187	H	88.2	Confident	88.9	Confident	139.2 Å²	139.2	55.9 Å²	55.9	64%	0.644	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	54.2	38.2	-174.1	-57.7	65.4	0	0	0	113	W1174 D1182 C1184 P1185 N1189 G1190	W1174-H1187 AromaticContact CH2-CE1 3.86Å; W1174-H1187 AromaticContact CZ2-CE1 3.47Å; W1174-H1187 VanDerWaalsContact CZ2-CE1 3.47Å; W1174-H1187 WeakPolarHBondContact CZ2-CE1 3.47Å; W1174-H1187 AromaticContact CZ2-NE2 3.47Å; W1174-H1187 WeakPolarHBondContact CZ2-NE2 3.4Å; D1182-H1187 IonicContact OD1-CE1 2.63Å; D1182-H1187 IonicContact OD1-ND1 2.8Å; D1182-H1187 IonicContact OD2-CE1 2.67Å; D1182-H1187 PolarHBondContact OD2-CE1 2.94Å; D1182-H1187 IonicContact OD2-ND1 3.47Å; D1182-H1187 PolarHBondContact OD2-ND1 3.28Å; C1184-H1187 VanDerWaalsContact O-CA 3.26Å; C1184-H1187 WeakPolarHBondContact O-CA 3.4Å; C1184-H1187 PolarHBondContact O-N 3.13Å; P1185-H1187 PolarHBondContact O-N 3.08Å; H1187-N1189 PolarHBondContact O-N 3.18Å; H1187-G1190 PolarHBondContact O-N 2.92Å
1188	C	91.4	Very high	88.4	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	57.4	29.5	-173.1	-46.3	0	0	0	0	113.2	C1184 P1185 D1186 G1190 H1191 G1192 C1205 A1215 C1216	C1184-C1188 PolarHBondContact O-N 2.97Å; P1185-C1188 PolarHBondContact O-N 3.18Å; D1186-C1188 VanDerWaalsContact C-N 3.3Å; D1186-C1188 PolarHBondContact O-N 2.99Å; D1186-C1188 VanDerWaalsContact O-N 3.13Å; C1188-G1190 PolarHBondContact O-N 3.05Å; C1188-H1191 PolarHBondContact O-N 3.02Å; C1188-G1192 PolarHBondContact O-N 3.04Å; C1188-C1205 WeakPolarHBondContact CA-SG 3.38Å; C1188-C1205 HydrophobicContact CB-CB 3.74Å; C1188-C1205 WeakPolarHBondContact CB-SG 3.39Å; C1188-C1205 WeakPolarHBondContact SG-CA 3.36Å; C1188-C1205 WeakPolarHBondContact SG-CB 3.45Å; C1188-C1205 CovalentContact SG-SG 2.03Å; C1188-C1205 PolarHBondContact SG-SG 3.11Å; C1188-A1215 CarbonylContact C-O 3.5Å; C1188-A1215 WeakPolarHBondContact CA-O 3.26Å; C1188-C1216 HydrophobicContact CB-CB 4.43Å
1189	N	90.1	Very high	87.6	Confident	68.2 Å²	68.2	60.7 Å²	60.7	37%	0.365	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	50.8	15.2	-175	-72.2	-86.1	0	0	0	115.4	D1186 H1187 H1191 A1215	D1186-N1189 WeakPolarHBondContact O-CA 3.37Å; D1186-N1189 PolarHBondContact O-N 2.88Å; H1187-N1189 PolarHBondContact O-N 3.18Å; N1189-H1191 PolarHBondContact O-CD2 3.21Å; N1189-H1191 PolarHBondContact O-N 3.17Å; N1189-A1215 PolarHBondContact N-O 2.99Å; N1189-A1215 VanDerWaalsContact ND2-CB 3.34Å; N1189-A1215 WeakPolarHBondContact ND2-CB 3.35Å; N1189-A1215 PolarHBondContact ND2-O 3.15Å
1190	G	91.8	Very high	86.7	Confident	70.8 Å²	70.8	64 Å²	64	73%	0.73	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	74.4	-0.3	-168.8	0	0	0	0	0	115	H1187 C1188	H1187-G1190 PolarHBondContact O-N 2.92Å; C1188-G1190 PolarHBondContact O-N 3.05Å
1191	H	93.6	Very high	86.2	Confident	68.2 Å²	68.2	66.2 Å²	66.2	32%	0.316	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	0.6	-178.7	-65	-73.4	0	0	0	113.6	C1188 N1189 S1208 W1211 C1216	C1188-H1191 PolarHBondContact O-N 3.02Å; N1189-H1191 PolarHBondContact O-CD2 3.21Å; N1189-H1191 PolarHBondContact O-N 3.17Å; H1191-S1208 WeakPolarHBondContact O-CB 3.23Å; H1191-S1208 PolarHBondContact O-N 3.02Å; H1191-S1208 PolarHBondContact O-OG 3.16Å; H1191-W1211 HydrophobicContact CB-CB 4.24Å; H1191-W1211 HydrophobicContact CB-CD2 3.63Å; H1191-W1211 HydrophobicContact CB-CE3 3.8Å; H1191-W1211 HydrophobicContact CB-CG 3.78Å; H1191-W1211 HydrophobicContact CB-CZ3 4.46Å; H1191-W1211 AromaticContact CD2-CE3 3.95Å; H1191-W1211 AromaticContact CD2-CH2 3.99Å; H1191-W1211 AromaticContact CD2-CZ3 3.81Å; H1191-W1211 AromaticContact CE1-CE2 3.73Å; H1191-W1211 AromaticContact CE1-CH2 3.48Å; H1191-W1211 VanDerWaalsContact CE1-CH2 3.45Å; H1191-W1211 WeakPolarHBondContact CE1-CH2 3.4Å; H1191-W1211 AromaticContact CE1-CZ2 3.33Å; H1191-W1211 WeakPolarHBondContact CE1-CZ2 3.46Å; H1191-W1211 AromaticContact CE1-CZ3 3.97Å; H1191-W1211 AromaticContact CG-CD2 3.57Å; H1191-W1211 AromaticContact CG-CE2 3.76Å; H1191-W1211 AromaticContact CG-CE3 3.62Å; H1191-W1211 AromaticContact CG-CZ3 3.87Å; H1191-W1211 AromaticContact ND1-CD2 3.54Å; H1191-W1211 AromaticContact ND1-CE2 3.2Å; H1191-W1211 AromaticContact ND1-CE3 3.88Å; H1191-W1211 AromaticContact ND1-CH2 3.74Å; H1191-W1211 AromaticContact ND1-CZ2 3.34Å; H1191-W1211 VanDerWaalsContact ND1-CZ2 3.33Å; H1191-W1211 WeakPolarHBondContact ND1-CZ2 3.34Å; H1191-W1211 AromaticContact ND1-CZ3 3.95Å; H1191-W1211 AromaticContact ND1-NE1 3.64Å; H1191-W1211 AromaticContact NE2-CH2 3.72Å; H1191-W1211 AromaticContact NE2-CZ2 3.95Å; H1191-W1211 AromaticContact NE2-CZ3 3.91Å; H1191-C1216 HydrophobicContact CB-CB 4.1Å
1192	G	93.1	Very high	86.1	Confident	18.6 Å²	18.6	66.6 Å²	66.6	19%	0.192	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	167	174.8	0	0	0	0	0	113.9	C1188 Q1206	C1188-G1192 PolarHBondContact O-N 3.04Å; G1192-Q1206 CarbonylContact C-O 3.49Å; G1192-Q1206 VanDerWaalsContact CA-O 3.25Å; G1192-Q1206 WeakPolarHBondContact CA-O 3.47Å
1193	Q	93.8	Very high	86.4	Confident	137.2 Å²	137.2	66.4 Å²	66.4	64%	0.641	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.8	126.1	170.3	-158.7	178.9	-9.9	0	0	109.9	T1195 Q1206	Q1193-T1195 HydrophobicContact CB-CG2 4.31Å; Q1193-T1195 HydrophobicContact CG-CG2 3.93Å; Q1193-T1195 PolarHBondContact O-N 2.74Å; Q1193-Q1206 PolarHBondContact N-O 3.13Å; Q1193-Q1206 WeakPolarHBondContact O-CB 3.36Å; Q1193-Q1206 PolarHBondContact O-N 2.88Å
1194	C	92.5	Very high	86.6	Confident	35 Å²	35	70 Å²	70	24%	0.236	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	116.6	171.4	-177.6	0	0	0	0	110.3	V1172 G1173 C1184	V1172-C1194 HydrophobicContact CG1-CB 4.39Å; G1173-C1194 WeakPolarHBondContact CA-SG 3.3Å; C1184-C1194 HydrophobicContact CB-CB 3.74Å; C1184-C1194 WeakPolarHBondContact CB-SG 3.45Å; C1184-C1194 WeakPolarHBondContact SG-CA 3.28Å; C1184-C1194 WeakPolarHBondContact SG-CB 3.31Å; C1184-C1194 CovalentContact SG-SG 2.03Å; C1184-C1194 PolarHBondContact SG-SG 3.08Å
1195	T	91.3	Very high	86.7	Confident	25.4 Å²	25.4	70.6 Å²	70.6	16%	0.156	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	155.5	-174.5	55.7	0	0	0	0	111.4	Q1193 Y1203 Y1204 Q1206	Q1193-T1195 HydrophobicContact CB-CG2 4.31Å; Q1193-T1195 HydrophobicContact CG-CG2 3.93Å; Q1193-T1195 PolarHBondContact O-N 2.74Å; T1195-Y1203 CarbonylContact O-C 3.57Å; T1195-Y1203 VanDerWaalsContact O-CA 3.27Å; T1195-Y1203 WeakPolarHBondContact O-CA 3.35Å; T1195-Y1203 WeakPolarHBondContact O-CD1 3.32Å; T1195-Y1204 PolarHBondContact N-O 3.01Å; T1195-Y1204 VanDerWaalsContact O-CD1 3.29Å; T1195-Y1204 WeakPolarHBondContact O-CD1 3.38Å; T1195-Y1204 WeakPolarHBondContact O-CE1 3.24Å; T1195-Y1204 PolarHBondContact O-N 2.89Å; T1195-Y1204 VanDerWaalsContact O-O 3.13Å; T1195-Y1204 VanDerWaalsContact OG1-CE1 3.25Å; T1195-Y1204 WeakPolarHBondContact OG1-CE1 3.2Å; T1195-Y1204 PolarHBondContact OG1-O 2.88Å; T1195-Y1204 PolarHBondContact OG1-OH 2.84Å; T1195-Q1206 HydrophobicContact CG2-CB 4.29Å; T1195-Q1206 WeakPolarHBondContact OG1-CB 3.42Å
1196	M	86.1	Confident	87.1	Confident	92 Å²	92	74.6 Å²	74.6	45%	0.453	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	129.6	-179.9	-165.6	-170.6	67.4	0	0	110.8	P1198 S1202 Y1203	M1196-P1198 WeakPolarHBondContact O-CD 3.43Å; M1196-S1202 WeakPolarHBondContact CG-O 3.38Å; M1196-Y1203 HydrophobicContact CB-CD1 4.12Å; M1196-Y1203 HydrophobicContact CB-CE1 3.97Å; M1196-Y1203 HydrophobicContact CE-CE1 4.18Å; M1196-Y1203 HydrophobicContact CE-CE2 4.02Å; M1196-Y1203 VanDerWaalsContact CE-OH 3.31Å; M1196-Y1203 WeakPolarHBondContact CE-OH 3.39Å; M1196-Y1203 HydrophobicContact CG-CD1 4.35Å; M1196-Y1203 HydrophobicContact CG-CE1 4.24Å
1197	Y	80.6	Confident	87.6	Confident	115 Å²	115	72.2 Å²	72.2	45%	0.451	40%	0.401	S	S	.	.			trans	-71.7	124.3	-179.9	-151.6	-88.8	0	0	0	110.9	L1199 S1200 S1201 S1202 Y1204	Y1197-L1199 VanDerWaalsContact C-N 3.29Å; Y1197-L1199 HydrophobicContact CD1-CB 4.34Å; Y1197-L1199 HydrophobicContact CE1-CB 4.27Å; Y1197-L1199 HydrophobicContact CE1-CD1 4.16Å; Y1197-L1199 PolarHBondContact O-N 3.09Å; Y1197-L1199 VanDerWaalsContact O-N 3.1Å; Y1197-S1200 WeakPolarHBondContact CB-OG 3.26Å; Y1197-S1200 VanDerWaalsContact CD1-OG 3.31Å; Y1197-S1200 WeakPolarHBondContact CD1-OG 3.3Å; Y1197-S1200 PolarHBondContact O-N 3.08Å; Y1197-S1201 PolarHBondContact O-N 3.01Å; Y1197-S1201 VanDerWaalsContact O-N 3.11Å; Y1197-S1202 WeakPolarHBondContact CB-O 3.46Å; Y1197-S1202 PolarHBondContact N-O 3.22Å; Y1197-Y1204 AromaticContact CD2-CD1 3.74Å; Y1197-Y1204 HydrophobicContact CD2-CD1 3.74Å; Y1197-Y1204 VanDerWaalsContact CD2-CD1 3.41Å; Y1197-Y1204 HydrophobicContact CD2-CD2 4.41Å; Y1197-Y1204 AromaticContact CD2-CE1 3.68Å; Y1197-Y1204 HydrophobicContact CD2-CE1 3.68Å; Y1197-Y1204 AromaticContact CD2-CG 3.86Å; Y1197-Y1204 HydrophobicContact CD2-CG 4.24Å; Y1197-Y1204 HydrophobicContact CE2-CD1 4.19Å; Y1197-Y1204 HydrophobicContact CE2-CD2 4.44Å; Y1197-Y1204 HydrophobicContact CE2-CE1 4.17Å; Y1197-Y1204 HydrophobicContact CE2-CE2 4.46Å; Y1197-Y1204 HydrophobicContact CE2-CG 4.31Å; Y1197-Y1204 HydrophobicContact CG-CD1 4.33Å; Y1197-Y1204 HydrophobicContact CG-CE1 4.29Å
1198	P	76.7	Confident	87.9	Confident	111.2 Å²	111.2	68.1 Å²	68.1	72%	0.722	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-26.6	-167	-26.7	34.9	0	0	0	116.2	M1196	M1196-P1198 WeakPolarHBondContact O-CD 3.43Å
1199	L	71.7	Confident	88	Confident	152.6 Å²	152.6	74.4 Å²	74.4	80%	0.799	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-29.7	-174.8	-73.2	116.8	0	0	0	113.8	Y1197	Y1197-L1199 VanDerWaalsContact C-N 3.29Å; Y1197-L1199 HydrophobicContact CD1-CB 4.34Å; Y1197-L1199 HydrophobicContact CE1-CB 4.27Å; Y1197-L1199 HydrophobicContact CE1-CD1 4.16Å; Y1197-L1199 PolarHBondContact O-N 3.09Å; Y1197-L1199 VanDerWaalsContact O-N 3.1Å
1200	S	72.1	Confident	88	Confident	69.4 Å²	69.4	72.1 Å²	72.1	49%	0.485	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.2	-9.4	-173.4	53	0	0	0	0	114.2	Y1197 S1202	Y1197-S1200 WeakPolarHBondContact CB-OG 3.26Å; Y1197-S1200 VanDerWaalsContact CD1-OG 3.31Å; Y1197-S1200 WeakPolarHBondContact CD1-OG 3.3Å; Y1197-S1200 PolarHBondContact O-N 3.08Å; S1200-S1202 PolarHBondContact O-N 3.1Å; S1200-S1202 VanDerWaalsContact O-N 3.16Å; S1200-S1202 PolarHBondContact OG-OG 3.17Å
1201	S	78.3	Confident	88	Confident	84.4 Å²	84.4	71.7 Å²	71.7	59%	0.59	40%	0.398	S	S	*	.			trans	55.5	28.4	-174	-52.7	0	0	0	0	113.8	Y1197	Y1197-S1201 PolarHBondContact O-N 3.01Å; Y1197-S1201 VanDerWaalsContact O-N 3.11Å
1202	S	84.8	Confident	87.9	Confident	40.2 Å²	40.2	70.1 Å²	70.1	28%	0.281	40%	0.395	S	S	.	.			trans	-105.6	138.9	177.1	57.5	0	0	0	0	110.6	N1175 M1196 Y1197 S1200	N1175-S1202 VanDerWaalsContact OD1-CA 3.29Å; N1175-S1202 WeakPolarHBondContact OD1-CA 3.2Å; M1196-S1202 WeakPolarHBondContact CG-O 3.38Å; Y1197-S1202 WeakPolarHBondContact CB-O 3.46Å; Y1197-S1202 PolarHBondContact N-O 3.22Å; S1200-S1202 PolarHBondContact O-N 3.1Å; S1200-S1202 VanDerWaalsContact O-N 3.16Å; S1200-S1202 PolarHBondContact OG-OG 3.17Å
1203	Y	90.5	Very high	87.6	Confident	45.2 Å²	45.2	70.4 Å²	70.4	18%	0.177	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	149.8	170.2	-70.3	-80.7	0	0	0	111.7	V1172 G1173 W1174 N1175 G1183 T1195 M1196	V1172-Y1203 HydrophobicContact CB-CE1 4.35Å; V1172-Y1203 HydrophobicContact CG1-CD1 4.36Å; V1172-Y1203 HydrophobicContact CG1-CE1 3.87Å; V1172-Y1203 HydrophobicContact CG2-CE1 4.39Å; G1173-Y1203 VanDerWaalsContact N-CZ 3.3Å; W1174-Y1203 WeakPolarHBondContact O-CD2 3.32Å; W1174-Y1203 WeakPolarHBondContact O-CE2 3.38Å; N1175-Y1203 PolarHBondContact ND2-N 3.03Å; N1175-Y1203 PolarHBondContact ND2-O 2.91Å; N1175-Y1203 WeakPolarHBondContact OD1-CD2 3.39Å; N1175-Y1203 PolarHBondContact OD1-N 3Å; G1183-Y1203 CarbonylContact O-C 3.45Å; G1183-Y1203 VanDerWaalsContact O-C 3.25Å; G1183-Y1203 WeakPolarHBondContact O-CB 3.43Å; G1183-Y1203 VanDerWaalsContact O-O 3.07Å; T1195-Y1203 CarbonylContact O-C 3.57Å; T1195-Y1203 VanDerWaalsContact O-CA 3.27Å; T1195-Y1203 WeakPolarHBondContact O-CA 3.35Å; T1195-Y1203 WeakPolarHBondContact O-CD1 3.32Å; M1196-Y1203 HydrophobicContact CB-CD1 4.12Å; M1196-Y1203 HydrophobicContact CB-CE1 3.97Å; M1196-Y1203 HydrophobicContact CE-CE1 4.18Å; M1196-Y1203 HydrophobicContact CE-CE2 4.02Å; M1196-Y1203 VanDerWaalsContact CE-OH 3.31Å; M1196-Y1203 WeakPolarHBondContact CE-OH 3.39Å; M1196-Y1203 HydrophobicContact CG-CD1 4.35Å; M1196-Y1203 HydrophobicContact CG-CE1 4.24Å
1204	Y	91.3	Very high	87.3	Confident	84.2 Å²	84.2	65.8 Å²	65.8	33%	0.33	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	161.1	171.7	75.4	-76.6	0	0	0	109.9	G1183 C1184 T1195 Y1197 Q1206	G1183-Y1204 VanDerWaalsContact O-CA 3.28Å; G1183-Y1204 WeakPolarHBondContact O-CA 3.21Å; G1183-Y1204 PolarHBondContact O-N 2.82Å; C1184-Y1204 PolarHBondContact SG-O 3.18Å; C1184-Y1204 VanDerWaalsContact SG-O 3.35Å; T1195-Y1204 PolarHBondContact N-O 3.01Å; T1195-Y1204 VanDerWaalsContact O-CD1 3.29Å; T1195-Y1204 WeakPolarHBondContact O-CD1 3.38Å; T1195-Y1204 WeakPolarHBondContact O-CE1 3.24Å; T1195-Y1204 PolarHBondContact O-N 2.89Å; T1195-Y1204 VanDerWaalsContact O-O 3.13Å; T1195-Y1204 VanDerWaalsContact OG1-CE1 3.25Å; T1195-Y1204 WeakPolarHBondContact OG1-CE1 3.2Å; T1195-Y1204 PolarHBondContact OG1-O 2.88Å; T1195-Y1204 PolarHBondContact OG1-OH 2.84Å; Y1197-Y1204 AromaticContact CD2-CD1 3.74Å; Y1197-Y1204 HydrophobicContact CD2-CD1 3.74Å; Y1197-Y1204 VanDerWaalsContact CD2-CD1 3.41Å; Y1197-Y1204 HydrophobicContact CD2-CD2 4.41Å; Y1197-Y1204 AromaticContact CD2-CE1 3.68Å; Y1197-Y1204 HydrophobicContact CD2-CE1 3.68Å; Y1197-Y1204 AromaticContact CD2-CG 3.86Å; Y1197-Y1204 HydrophobicContact CD2-CG 4.24Å; Y1197-Y1204 HydrophobicContact CE2-CD1 4.19Å; Y1197-Y1204 HydrophobicContact CE2-CD2 4.44Å; Y1197-Y1204 HydrophobicContact CE2-CE1 4.17Å; Y1197-Y1204 HydrophobicContact CE2-CE2 4.46Å; Y1197-Y1204 HydrophobicContact CE2-CG 4.31Å; Y1197-Y1204 HydrophobicContact CG-CD1 4.33Å; Y1197-Y1204 HydrophobicContact CG-CE1 4.29Å; Y1204-Q1206 HydrophobicContact CE2-CB 4.13Å
1205	C	92.5	Very high	87.2	Confident	15.8 Å²	15.8	64.1 Å²	64.1	11%	0.107	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	121.3	174.5	-70.6	0	0	0	0	112	C1184 C1188 S1214	C1184-C1205 VanDerWaalsContact CA-SG 3.57Å; C1188-C1205 WeakPolarHBondContact CA-SG 3.38Å; C1188-C1205 HydrophobicContact CB-CB 3.74Å; C1188-C1205 WeakPolarHBondContact CB-SG 3.39Å; C1188-C1205 WeakPolarHBondContact SG-CA 3.36Å; C1188-C1205 WeakPolarHBondContact SG-CB 3.45Å; C1188-C1205 CovalentContact SG-SG 2.03Å; C1188-C1205 PolarHBondContact SG-SG 3.11Å; C1205-S1214 WeakPolarHBondContact CB-O 3.46Å
1206	Q	94.7	Very high	87.2	Confident	103.2 Å²	103.2	62.9 Å²	62.9	48%	0.482	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	105.5	166.5	-179.4	176.5	-8.7	0	0	108.8	G1192 Q1193 T1195 Y1204	G1192-Q1206 CarbonylContact C-O 3.49Å; G1192-Q1206 VanDerWaalsContact CA-O 3.25Å; G1192-Q1206 WeakPolarHBondContact CA-O 3.47Å; Q1193-Q1206 PolarHBondContact N-O 3.13Å; Q1193-Q1206 WeakPolarHBondContact O-CB 3.36Å; Q1193-Q1206 PolarHBondContact O-N 2.88Å; T1195-Q1206 HydrophobicContact CG2-CB 4.29Å; T1195-Q1206 WeakPolarHBondContact OG1-CB 3.42Å; Y1204-Q1206 HydrophobicContact CE2-CB 4.13Å
1207	C	94.2	Very high	87.4	Confident	39.4 Å²	39.4	60.3 Å²	60.3	27%	0.266	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	151.3	-174.2	-52.5	0	0	0	0	113.4	W1211 G1213 C1216	C1207-W1211 HydrophobicContact CB-CB 4.17Å; C1207-W1211 VanDerWaalsContact CB-O 3.23Å; C1207-W1211 WeakPolarHBondContact CB-O 3.2Å; C1207-G1213 PolarHBondContact SG-O 3.45Å; C1207-C1216 WeakPolarHBondContact CA-SG 3.2Å; C1207-C1216 HydrophobicContact CB-CB 3.79Å; C1207-C1216 WeakPolarHBondContact CB-SG 3.32Å; C1207-C1216 PolarHBondContact N-SG 2.58Å; C1207-C1216 WeakPolarHBondContact SG-CA 3.31Å; C1207-C1216 WeakPolarHBondContact SG-CB 3.28Å; C1207-C1216 CovalentContact SG-SG 2.04Å; C1207-C1216 PolarHBondContact SG-SG 3.02Å
1208	S	95.5	Very high	87.7	Confident	54 Å²	54	56 Å²	56	38%	0.378	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-70.4	158.5	171.2	-54.7	0	0	0	0	110.5	H1191 G1210 W1211	H1191-S1208 WeakPolarHBondContact O-CB 3.23Å; H1191-S1208 PolarHBondContact O-N 3.02Å; H1191-S1208 PolarHBondContact O-OG 3.16Å; S1208-G1210 PolarHBondContact O-N 3.08Å; S1208-W1211 PolarHBondContact O-N 3.02Å; S1208-W1211 VanDerWaalsContact O-N 3.08Å
1209	P	92.4	Very high	88.3	Confident	133 Å²	133	54.3 Å²	54.3	86%	0.864	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	135.1	169.7	-24.4	34.6	0	0	0	111.1
1210	G	90.1	Very high	89.2	Confident	19.2 Å²	19.2	48.9 Å²	48.9	20%	0.198	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.7	5.1	-174.2	0	0	0	0	0	115.3	S1208 Q1219 I1220	S1208-G1210 PolarHBondContact O-N 3.08Å; G1210-Q1219 CarbonylContact O-C 3.48Å; G1210-Q1219 VanDerWaalsContact O-CA 3.24Å; G1210-Q1219 WeakPolarHBondContact O-CA 3.4Å; G1210-Q1219 VanDerWaalsContact O-CG 3.25Å; G1210-Q1219 WeakPolarHBondContact O-CG 3.34Å; G1210-I1220 VanDerWaalsContact C-CG1 3.48Å; G1210-I1220 PolarHBondContact O-N 3.05Å; G1210-I1220 VanDerWaalsContact O-N 3.11Å
1211	W	92.6	Very high	90.1	Very high	63.4 Å²	63.4	45.8 Å²	45.8	24%	0.24	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	147	-179.2	-66	83.4	0	0	0	113.1	H1191 C1207 S1208 C1216 R1218 Q1219	H1191-W1211 HydrophobicContact CB-CB 4.24Å; H1191-W1211 HydrophobicContact CB-CD2 3.63Å; H1191-W1211 HydrophobicContact CB-CE3 3.8Å; H1191-W1211 HydrophobicContact CB-CG 3.78Å; H1191-W1211 HydrophobicContact CB-CZ3 4.46Å; H1191-W1211 AromaticContact CD2-CE3 3.95Å; H1191-W1211 AromaticContact CD2-CH2 3.99Å; H1191-W1211 AromaticContact CD2-CZ3 3.81Å; H1191-W1211 AromaticContact CE1-CE2 3.73Å; H1191-W1211 AromaticContact CE1-CH2 3.48Å; H1191-W1211 VanDerWaalsContact CE1-CH2 3.45Å; H1191-W1211 WeakPolarHBondContact CE1-CH2 3.4Å; H1191-W1211 AromaticContact CE1-CZ2 3.33Å; H1191-W1211 WeakPolarHBondContact CE1-CZ2 3.46Å; H1191-W1211 AromaticContact CE1-CZ3 3.97Å; H1191-W1211 AromaticContact CG-CD2 3.57Å; H1191-W1211 AromaticContact CG-CE2 3.76Å; H1191-W1211 AromaticContact CG-CE3 3.62Å; H1191-W1211 AromaticContact CG-CZ3 3.87Å; H1191-W1211 AromaticContact ND1-CD2 3.54Å; H1191-W1211 AromaticContact ND1-CE2 3.2Å; H1191-W1211 AromaticContact ND1-CE3 3.88Å; H1191-W1211 AromaticContact ND1-CH2 3.74Å; H1191-W1211 AromaticContact ND1-CZ2 3.34Å; H1191-W1211 VanDerWaalsContact ND1-CZ2 3.33Å; H1191-W1211 WeakPolarHBondContact ND1-CZ2 3.34Å; H1191-W1211 AromaticContact ND1-CZ3 3.95Å; H1191-W1211 AromaticContact ND1-NE1 3.64Å; H1191-W1211 AromaticContact NE2-CH2 3.72Å; H1191-W1211 AromaticContact NE2-CZ2 3.95Å; H1191-W1211 AromaticContact NE2-CZ3 3.91Å; C1207-W1211 HydrophobicContact CB-CB 4.17Å; C1207-W1211 VanDerWaalsContact CB-O 3.23Å; C1207-W1211 WeakPolarHBondContact CB-O 3.2Å; S1208-W1211 PolarHBondContact O-N 3.02Å; S1208-W1211 VanDerWaalsContact O-N 3.08Å; W1211-C1216 HydrophobicContact CB-CB 4.48Å; W1211-C1216 VanDerWaalsContact CE3-O 3.32Å; W1211-R1218 CarbonylContact C-O 3.47Å; W1211-R1218 VanDerWaalsContact CA-O 3.29Å; W1211-R1218 WeakPolarHBondContact CA-O 3.31Å; W1211-R1218 VanDerWaalsContact CE3-O 3.24Å; W1211-Q1219 HydrophobicContact CD2-CB 4.45Å; W1211-Q1219 HydrophobicContact CE3-CB 4.31Å; W1211-Q1219 HydrophobicContact CH2-CB 4.03Å; W1211-Q1219 HydrophobicContact CH2-CG 4.27Å; W1211-Q1219 HydrophobicContact CZ2-CB 4.19Å; W1211-Q1219 HydrophobicContact CZ2-CG 4.15Å; W1211-Q1219 HydrophobicContact CZ3-CB 4.06Å
1212	S	90.8	Very high	90.7	Very high	34 Å²	34	46.4 Å²	46.4	24%	0.238	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	179.6	-175.2	148.5	0	0	0	0	112.7	C1216 Q1217 R1218 I1220	S1212-C1216 CarbonylContact O-C 3.54Å; S1212-C1216 VanDerWaalsContact O-C 3.25Å; S1212-C1216 VanDerWaalsContact O-CA 3.24Å; S1212-C1216 WeakPolarHBondContact O-CA 3.16Å; S1212-Q1217 PolarHBondContact O-N 3.16Å; S1212-Q1217 VanDerWaalsContact O-N 3.14Å; S1212-R1218 VanDerWaalsContact CB-CZ 3.44Å; S1212-R1218 VanDerWaalsContact CB-NH2 3.3Å; S1212-R1218 PolarHBondContact N-O 2.91Å; S1212-R1218 WeakPolarHBondContact O-CB 3.44Å; S1212-R1218 PolarHBondContact O-N 3.27Å; S1212-R1218 PolarHBondContact OG-NE 3.18Å; S1212-R1218 PolarHBondContact OG-NH1 3.47Å; S1212-R1218 PolarHBondContact OG-NH2 3.18Å; S1212-R1218 VanDerWaalsContact OG-NH2 3.16Å; S1212-I1220 VanDerWaalsContact CB-CG2 3.42Å
1213	G	87.5	Confident	91.1	Very high	25.4 Å²	25.4	48.2 Å²	48.2	26%	0.262	27%	0.269	S	S	.	.	S	Bend	trans	91.8	163.6	-171.7	0	0	0	0	0	113	C1207 A1215 C1216	C1207-G1213 PolarHBondContact SG-O 3.45Å; G1213-A1215 PolarHBondContact O-N 3.1Å; G1213-A1215 VanDerWaalsContact O-N 3.16Å; G1213-C1216 PolarHBondContact O-N 3.1Å; G1213-C1216 VanDerWaalsContact O-N 3.09Å
1214	S	87.1	Confident	91.2	Very high	39.6 Å²	39.6	46.5 Å²	46.5	28%	0.277	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-19.6	-174.7	62.5	0	0	0	0	114.2	C1205 D1439 L1440	C1205-S1214 WeakPolarHBondContact CB-O 3.46Å; S1214-D1439 WeakPolarHBondContact CB-OD1 3.44Å; S1214-D1439 VanDerWaalsContact CB-OD2 3.28Å; S1214-D1439 WeakPolarHBondContact CB-OD2 3.41Å; S1214-D1439 PolarHBondContact N-OD2 2.75Å; S1214-D1439 VanDerWaalsContact OG-CG 3.27Å; S1214-D1439 PolarHBondContact OG-OD1 3.2Å; S1214-D1439 PolarHBondContact OG-OD2 2.83Å; S1214-L1440 VanDerWaalsContact OG-CD1 3.25Å; S1214-L1440 WeakPolarHBondContact OG-CD1 3.24Å; S1214-L1440 WeakPolarHBondContact OG-CG 3.42Å
1215	A	90.2	Very high	91.3	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119	18.3	172.6	0	0	0	0	0	112.9	P1185 C1188 N1189 G1213 Q1217 L1440	P1185-A1215 HydrophobicContact CB-CB 4.04Å; P1185-A1215 HydrophobicContact CG-CB 4.3Å; P1185-A1215 VanDerWaalsContact O-CB 3.28Å; P1185-A1215 WeakPolarHBondContact O-CB 3.29Å; C1188-A1215 CarbonylContact C-O 3.5Å; C1188-A1215 WeakPolarHBondContact CA-O 3.26Å; N1189-A1215 PolarHBondContact N-O 2.99Å; N1189-A1215 VanDerWaalsContact ND2-CB 3.34Å; N1189-A1215 WeakPolarHBondContact ND2-CB 3.35Å; N1189-A1215 PolarHBondContact ND2-O 3.15Å; G1213-A1215 PolarHBondContact O-N 3.1Å; G1213-A1215 VanDerWaalsContact O-N 3.16Å; A1215-Q1217 VanDerWaalsContact C-OE1 3.3Å; A1215-Q1217 HydrophobicContact CB-CB 4.46Å; A1215-Q1217 PolarHBondContact O-N 3.34Å; A1215-L1440 HydrophobicContact CB-CD1 3.94Å; A1215-L1440 HydrophobicContact CB-CD2 4.04Å; A1215-L1440 HydrophobicContact CB-CG 4.38Å
1216	C	92.6	Very high	91.3	Very high	0 Å²	0	50 Å²	50	0%	0	29%	0.287	C	S	.	.	S	Bend	trans	53.5	35.3	-174.6	-48.7	0	0	0	0	113.3	C1188 H1191 C1207 W1211 S1212 G1213	C1188-C1216 HydrophobicContact CB-CB 4.43Å; H1191-C1216 HydrophobicContact CB-CB 4.1Å; C1207-C1216 WeakPolarHBondContact CA-SG 3.2Å; C1207-C1216 HydrophobicContact CB-CB 3.79Å; C1207-C1216 WeakPolarHBondContact CB-SG 3.32Å; C1207-C1216 PolarHBondContact N-SG 2.58Å; C1207-C1216 WeakPolarHBondContact SG-CA 3.31Å; C1207-C1216 WeakPolarHBondContact SG-CB 3.28Å; C1207-C1216 CovalentContact SG-SG 2.04Å; C1207-C1216 PolarHBondContact SG-SG 3.02Å; W1211-C1216 HydrophobicContact CB-CB 4.48Å; W1211-C1216 VanDerWaalsContact CE3-O 3.32Å; S1212-C1216 CarbonylContact O-C 3.54Å; S1212-C1216 VanDerWaalsContact O-C 3.25Å; S1212-C1216 VanDerWaalsContact O-CA 3.24Å; S1212-C1216 WeakPolarHBondContact O-CA 3.16Å; G1213-C1216 PolarHBondContact O-N 3.1Å; G1213-C1216 VanDerWaalsContact O-N 3.09Å
1217	Q	88.4	Confident	91.1	Very high	36.6 Å²	36.6	47.3 Å²	47.3	17%	0.171	29%	0.287	C	S	.	.			trans	-85.1	-15.8	-174.7	74.3	-79.1	3.8	0	0	113.9	S1212 A1215 D1439 L1440 I1443	S1212-Q1217 PolarHBondContact O-N 3.16Å; S1212-Q1217 VanDerWaalsContact O-N 3.14Å; A1215-Q1217 VanDerWaalsContact C-OE1 3.3Å; A1215-Q1217 HydrophobicContact CB-CB 4.46Å; A1215-Q1217 PolarHBondContact O-N 3.34Å; Q1217-D1439 PolarHBondContact NE2-OD2 2.98Å; Q1217-L1440 HydrophobicContact CB-CD2 4.3Å; Q1217-L1440 VanDerWaalsContact CD-CD2 3.47Å; Q1217-L1440 HydrophobicContact CG-CD2 3.86Å; Q1217-I1443 HydrophobicContact CG-CB 4.33Å; Q1217-I1443 HydrophobicContact CG-CD1 3.7Å; Q1217-I1443 VanDerWaalsContact CG-CD1 3.48Å; Q1217-I1443 HydrophobicContact CG-CG2 4.05Å
1218	R	87.2	Confident	91	Very high	24.2 Å²	24.2	50.2 Å²	50.2	9%	0.091	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	133.7	-178.3	-159.9	-164.8	70.7	173.9	1.3	109.2	W1211 S1212 D1242 D1327 T1329 I1443	W1211-R1218 CarbonylContact C-O 3.47Å; W1211-R1218 VanDerWaalsContact CA-O 3.29Å; W1211-R1218 WeakPolarHBondContact CA-O 3.31Å; W1211-R1218 VanDerWaalsContact CE3-O 3.24Å; S1212-R1218 VanDerWaalsContact CB-CZ 3.44Å; S1212-R1218 VanDerWaalsContact CB-NH2 3.3Å; S1212-R1218 PolarHBondContact N-O 2.91Å; S1212-R1218 WeakPolarHBondContact O-CB 3.44Å; S1212-R1218 PolarHBondContact O-N 3.27Å; S1212-R1218 PolarHBondContact OG-NE 3.18Å; S1212-R1218 PolarHBondContact OG-NH1 3.47Å; S1212-R1218 PolarHBondContact OG-NH2 3.18Å; S1212-R1218 VanDerWaalsContact OG-NH2 3.16Å; R1218-D1242 IonicContact CZ-OD1 3.47Å; R1218-D1242 IonicContact CZ-OD2 2.97Å; R1218-D1242 VanDerWaalsContact CZ-OD2 3.24Å; R1218-D1242 IonicContact NE-OD2 3.55Å; R1218-D1242 IonicContact NH1-OD1 3.43Å; R1218-D1242 PolarHBondContact NH1-OD1 3.5Å; R1218-D1242 VanDerWaalsContact NH1-OD1 3.17Å; R1218-D1242 IonicContact NH1-OD2 3Å; R1218-D1242 PolarHBondContact NH1-OD2 3.19Å; R1218-D1242 IonicContact NH2-OD1 3.33Å; R1218-D1242 PolarHBondContact NH2-OD1 2.91Å; R1218-D1242 VanDerWaalsContact NH2-OD1 3.14Å; R1218-D1242 IonicContact NH2-OD2 3.42Å; R1218-D1242 PolarHBondContact NH2-OD2 3.01Å; R1218-D1242 VanDerWaalsContact NH2-OD2 3.12Å; R1218-D1327 VanDerWaalsContact CD-CG 3.5Å; R1218-D1327 WeakPolarHBondContact CD-O 3.33Å; R1218-D1327 WeakPolarHBondContact CD-OD1 3.09Å; R1218-D1327 WeakPolarHBondContact CD-OD2 3.42Å; R1218-D1327 HydrophobicContact CG-CB 4.24Å; R1218-D1327 IonicContact CZ-OD1 3.3Å; R1218-D1327 IonicContact NE-OD1 2.72Å; R1218-D1327 IonicContact NH1-OD1 3.02Å; R1218-D1327 PolarHBondContact NH1-OD1 2.92Å; R1218-D1327 IonicContact NH1-OD2 2.87Å; R1218-T1329 VanDerWaalsContact CD-OG1 3.3Å; R1218-T1329 WeakPolarHBondContact CD-OG1 3.21Å; R1218-T1329 VanDerWaalsContact CZ-OG1 3.25Å; R1218-T1329 PolarHBondContact NE-OG1 2.81Å; R1218-T1329 VanDerWaalsContact NH1-CA 3.29Å; R1218-T1329 PolarHBondContact NH1-OG1 2.93Å; R1218-I1443 HydrophobicContact CB-CD1 4.49Å
1219	Q	88.9	Confident	90.8	Very high	76.8 Å²	76.8	49.3 Å²	49.3	36%	0.359	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	176.2	164.4	-166.7	175.4	-65.8	0	0	108.7	G1210 W1211 N1230 D1231	G1210-Q1219 CarbonylContact O-C 3.48Å; G1210-Q1219 VanDerWaalsContact O-CA 3.24Å; G1210-Q1219 WeakPolarHBondContact O-CA 3.4Å; G1210-Q1219 VanDerWaalsContact O-CG 3.25Å; G1210-Q1219 WeakPolarHBondContact O-CG 3.34Å; W1211-Q1219 HydrophobicContact CD2-CB 4.45Å; W1211-Q1219 HydrophobicContact CE3-CB 4.31Å; W1211-Q1219 HydrophobicContact CH2-CB 4.03Å; W1211-Q1219 HydrophobicContact CH2-CG 4.27Å; W1211-Q1219 HydrophobicContact CZ2-CB 4.19Å; W1211-Q1219 HydrophobicContact CZ2-CG 4.15Å; W1211-Q1219 HydrophobicContact CZ3-CB 4.06Å; Q1219-N1230 PolarHBondContact NE2-O 2.92Å; Q1219-D1231 HydrophobicContact CB-CB 3.77Å; Q1219-D1231 HydrophobicContact CG-CB 3.91Å
1220	I	91	Very high	90.7	Very high	39 Å²	39	44.8 Å²	44.8	20%	0.2	26%	0.258	C	S	.	.			trans	-137.8	138.1	178.6	-8.9	-174.9	0	0	0	108.7	G1210 S1212 T1222 D1231 D1242	G1210-I1220 VanDerWaalsContact C-CG1 3.48Å; G1210-I1220 PolarHBondContact O-N 3.05Å; G1210-I1220 VanDerWaalsContact O-N 3.11Å; S1212-I1220 VanDerWaalsContact CB-CG2 3.42Å; I1220-T1222 HydrophobicContact CB-CG2 4.43Å; I1220-T1222 HydrophobicContact CD1-CG2 4.12Å; I1220-T1222 HydrophobicContact CG1-CG2 3.65Å; I1220-T1222 HydrophobicContact CG2-CG2 4.29Å; I1220-T1222 PolarHBondContact O-N 2.94Å; I1220-D1231 VanDerWaalsContact C-CG 3.48Å; I1220-D1231 VanDerWaalsContact C-OD2 3.25Å; I1220-D1231 WeakPolarHBondContact CA-OD2 3.39Å; I1220-D1231 PolarHBondContact N-OD2 3.14Å; I1220-D1242 HydrophobicContact CB-CB 4.38Å; I1220-D1242 WeakPolarHBondContact CB-OD2 3.34Å; I1220-D1242 HydrophobicContact CG2-CB 3.69Å; I1220-D1242 VanDerWaalsContact CG2-OD2 3.28Å; I1220-D1242 WeakPolarHBondContact CG2-OD2 3.28Å
1221	E	92.6	Very high	90.7	Very high	5.2 Å²	5.2	44.9 Å²	44.9	2%	0.024	26%	0.255	C	S	.	.			trans	-63.3	128.6	167.7	-165.8	168.2	-118	0	0	109.8	I1223 I1228 N1230 D1231 D1237 D1240 C1243	E1221-I1223 VanDerWaalsContact CG-O 3.29Å; E1221-I1223 WeakPolarHBondContact CG-O 3.32Å; E1221-I1228 VanDerWaalsContact OE1-O 3.08Å; E1221-N1230 HydrophobicContact CB-CB 4.42Å; E1221-N1230 HydrophobicContact CG-CB 4.06Å; E1221-N1230 WeakPolarHBondContact OE1-CB 3.49Å; E1221-N1230 PolarHBondContact OE1-N 2.84Å; E1221-D1231 WeakPolarHBondContact CB-OD1 3.47Å; E1221-D1231 VanDerWaalsContact N-CG 3.31Å; E1221-D1231 PolarHBondContact N-OD1 3.11Å; E1221-D1231 PolarHBondContact N-OD2 3.09Å; E1221-D1231 VanDerWaalsContact N-OD2 3.07Å; E1221-D1237 VanDerWaalsContact CD-N 3.34Å; E1221-D1237 PolarHBondContact OE1-N 2.68Å; E1221-D1237 WeakPolarHBondContact OE2-CA 3.24Å; E1221-D1237 PolarHBondContact OE2-N 2.8Å; E1221-D1240 WeakPolarHBondContact CB-OD2 3.4Å; E1221-D1240 WeakPolarHBondContact OE2-CB 3.04Å; E1221-C1243 WeakPolarHBondContact CG-SG 3.34Å; E1221-C1243 PolarHBondContact OE2-SG 3.08Å; E1221-C1243 VanDerWaalsContact OE2-SG 3.39Å
1222	T	89.8	Confident	90.5	Very high	95.6 Å²	95.6	49.1 Å²	49.1	59%	0.587	28%	0.277	S	S	*	.			trans	-129.4	-11.1	-176.8	52.3	0	0	0	0	113.8	I1220	I1220-T1222 HydrophobicContact CB-CG2 4.43Å; I1220-T1222 HydrophobicContact CD1-CG2 4.12Å; I1220-T1222 HydrophobicContact CG1-CG2 3.65Å; I1220-T1222 HydrophobicContact CG2-CG2 4.29Å; I1220-T1222 PolarHBondContact O-N 2.94Å
1223	I	92.9	Very high	90.2	Very high	77.8 Å²	77.8	47.9 Å²	47.9	40%	0.399	27%	0.268	S	S	.	.			trans	-110.9	111.4	168.7	-53.4	177.1	0	0	0	104.7	E1221 D1226 N1230	E1221-I1223 VanDerWaalsContact CG-O 3.29Å; E1221-I1223 WeakPolarHBondContact CG-O 3.32Å; I1223-D1226 HydrophobicContact CG2-CB 3.85Å; I1223-N1230 VanDerWaalsContact CB-OD1 3.31Å; I1223-N1230 WeakPolarHBondContact CB-OD1 3.15Å
1224	C	93.7	Very high	90.1	Very high	10 Å²	10	50.8 Å²	50.8	7%	0.068	28%	0.277	C	S	.	.			trans	-113.8	23.6	-168.2	-53.5	0	0	0	0	112.3	D1237 C1243 S1246 H1248	C1224-D1237 VanDerWaalsContact C-OD1 3.22Å; C1224-C1243 VanDerWaalsContact CA-SG 3.56Å; C1224-C1243 HydrophobicContact CB-CB 3.67Å; C1224-C1243 WeakPolarHBondContact CB-SG 3.22Å; C1224-C1243 VanDerWaalsContact SG-CA 3.53Å; C1224-C1243 WeakPolarHBondContact SG-CA 3.17Å; C1224-C1243 WeakPolarHBondContact SG-CB 3.33Å; C1224-C1243 CovalentContact SG-SG 2.03Å; C1224-C1243 PolarHBondContact SG-SG 3.01Å; C1224-S1246 WeakPolarHBondContact SG-CB 3.38Å; C1224-H1248 PolarHBondContact O-CD2 2.93Å; C1224-H1248 VanDerWaalsContact O-CD2 3.25Å
1225	D	92.1	Very high	90.2	Very high	104.8 Å²	104.8	49.1 Å²	49.1	56%	0.56	27%	0.265	S	S	*	.	S	Bend	trans	-152.8	28.7	-179.3	64.3	-8	0	0	0	114.9	D1237 H1248	D1225-D1237 VanDerWaalsContact CA-OD1 3.28Å; D1225-D1237 WeakPolarHBondContact CA-OD1 3.36Å; D1225-D1237 PolarHBondContact N-OD1 3.02Å; D1225-H1248 HydrophobicContact CB-CB 4.41Å; D1225-H1248 WeakPolarHBondContact CB-CE1 3.3Å; D1225-H1248 WeakPolarHBondContact CB-ND1 3.26Å; D1225-H1248 IonicContact OD2-CE1 3.13Å; D1225-H1248 PolarHBondContact OD2-CE1 2.77Å; D1225-H1248 IonicContact OD2-CG 2.76Å; D1225-H1248 IonicContact OD2-ND1 2.95Å; D1225-H1248 PolarHBondContact OD2-ND1 3.24Å
1226	D	92.8	Very high	90.3	Very high	68.6 Å²	68.6	51.3 Å²	51.3	37%	0.367	28%	0.278	S	S	.	.	S	Bend	trans	-110.8	-12.1	176.4	77.3	2.1	0	0	0	114.5	I1223 I1228 N1230 D1237	I1223-D1226 HydrophobicContact CG2-CB 3.85Å; D1226-I1228 VanDerWaalsContact C-N 3.31Å; D1226-I1228 WeakPolarHBondContact OD1-CB 3.29Å; D1226-I1228 PolarHBondContact OD1-N 3.11Å; D1226-N1230 PolarHBondContact OD1-ND2 3.16Å; D1226-N1230 PolarHBondContact OD2-ND2 3.5Å; D1226-D1237 PolarHBondContact N-OD1 3.2Å
1227	G	90.8	Very high	90.3	Very high	46.4 Å²	46.4	52.8 Å²	52.8	48%	0.478	29%	0.286	S	S	.	.	S	Bend	trans	76.5	23.2	179.4	0	0	0	0	0	114.4	V1236 D1237	G1227-V1236 VanDerWaalsContact C-CG1 3.41Å; G1227-D1237 VanDerWaalsContact CA-OD2 3.28Å; G1227-D1237 WeakPolarHBondContact CA-OD2 3.29Å; G1227-D1237 PolarHBondContact N-OD1 3.06Å; G1227-D1237 PolarHBondContact N-OD2 3.2Å
1228	I	93	Very high	90.5	Very high	101.2 Å²	101.2	51.2 Å²	51.2	52%	0.519	28%	0.279	S	S	.	.	S	Bend	trans	-127.1	124.7	-177.7	-53.7	175.2	0	0	0	109.7	E1221 D1226 N1230	E1221-I1228 VanDerWaalsContact OE1-O 3.08Å; D1226-I1228 VanDerWaalsContact C-N 3.31Å; D1226-I1228 WeakPolarHBondContact OD1-CB 3.29Å; D1226-I1228 PolarHBondContact OD1-N 3.11Å; I1228-N1230 PolarHBondContact O-N 3.07Å; I1228-N1230 PolarHBondContact O-ND2 3.12Å
1229	D	91	Very high	90.8	Very high	34.8 Å²	34.8	51.5 Å²	51.5	19%	0.186	28%	0.282	C	S	.	.			trans	-57.3	105.2	166	179.9	-8.9	0	0	0	109.7	D1231 H1232 D1233 D1234 L1235 V1236	D1229-D1231 PolarHBondContact OD1-N 2.97Å; D1229-H1232 WeakPolarHBondContact OD1-CA 3.35Å; D1229-H1232 PolarHBondContact OD1-N 3.18Å; D1229-H1232 WeakPolarHBondContact OD2-CA 3.43Å; D1229-D1233 PolarHBondContact OD1-N 3.17Å; D1229-D1233 PolarHBondContact OD2-N 3.08Å; D1229-D1234 VanDerWaalsContact OD2-CA 3.3Å; D1229-D1234 WeakPolarHBondContact OD2-CA 3.35Å; D1229-D1234 PolarHBondContact OD2-N 2.72Å; D1229-L1235 VanDerWaalsContact CB-O 3.24Å; D1229-L1235 WeakPolarHBondContact CB-O 3.37Å; D1229-L1235 VanDerWaalsContact CG-O 3.29Å; D1229-V1236 HydrophobicContact CB-CG2 4.07Å
1230	N	90.5	Very high	90.9	Very high	37.8 Å²	37.8	47.9 Å²	47.9	20%	0.202	27%	0.265	C	S	.	.	S	Bend	trans	-84.4	-32.1	-172.9	-84.4	-136.8	0	0	0	112.9	Q1219 E1221 I1223 D1226 I1228 H1232	Q1219-N1230 PolarHBondContact NE2-O 2.92Å; E1221-N1230 HydrophobicContact CB-CB 4.42Å; E1221-N1230 HydrophobicContact CG-CB 4.06Å; E1221-N1230 WeakPolarHBondContact OE1-CB 3.49Å; E1221-N1230 PolarHBondContact OE1-N 2.84Å; I1223-N1230 VanDerWaalsContact CB-OD1 3.31Å; I1223-N1230 WeakPolarHBondContact CB-OD1 3.15Å; D1226-N1230 PolarHBondContact OD1-ND2 3.16Å; D1226-N1230 PolarHBondContact OD2-ND2 3.5Å; I1228-N1230 PolarHBondContact O-N 3.07Å; I1228-N1230 PolarHBondContact O-ND2 3.12Å; N1230-H1232 PolarHBondContact O-CE1 3.24Å; N1230-H1232 PolarHBondContact O-ND1 3.1Å
1231	D	89	Confident	90.9	Very high	22.6 Å²	22.6	46.1 Å²	46.1	12%	0.121	26%	0.256	C	S	.	.	S	Bend	trans	-111.2	-0.9	-173.8	58.9	-27	0	0	0	115.2	Q1219 I1220 E1221 D1229	Q1219-D1231 HydrophobicContact CB-CB 3.77Å; Q1219-D1231 HydrophobicContact CG-CB 3.91Å; I1220-D1231 VanDerWaalsContact C-CG 3.48Å; I1220-D1231 VanDerWaalsContact C-OD2 3.25Å; I1220-D1231 WeakPolarHBondContact CA-OD2 3.39Å; I1220-D1231 PolarHBondContact N-OD2 3.14Å; E1221-D1231 WeakPolarHBondContact CB-OD1 3.47Å; E1221-D1231 VanDerWaalsContact N-CG 3.31Å; E1221-D1231 PolarHBondContact N-OD1 3.11Å; E1221-D1231 PolarHBondContact N-OD2 3.09Å; E1221-D1231 VanDerWaalsContact N-OD2 3.07Å; D1229-D1231 PolarHBondContact OD1-N 2.97Å
1232	H	87.6	Confident	90.9	Very high	151.4 Å²	151.4	47.2 Å²	47.2	70%	0.701	26%	0.262	S	S	*	.	S	Bend	trans	71.7	46.3	167.3	-55.1	43.7	0	0	0	113.1	D1229 N1230	D1229-H1232 WeakPolarHBondContact OD1-CA 3.35Å; D1229-H1232 PolarHBondContact OD1-N 3.18Å; D1229-H1232 WeakPolarHBondContact OD2-CA 3.43Å; N1230-H1232 PolarHBondContact O-CE1 3.24Å; N1230-H1232 PolarHBondContact O-ND1 3.1Å
1233	D	84.7	Confident	91.1	Very high	8.8 Å²	8.8	42.7 Å²	42.7	5%	0.047	24%	0.235	C	C	.	.	S	Bend	trans	-103.1	2.2	179.2	95.2	-33.3	0	0	0	114.6	D1229 L1235 Q1325	D1229-D1233 PolarHBondContact OD1-N 3.17Å; D1229-D1233 PolarHBondContact OD2-N 3.08Å; D1233-L1235 VanDerWaalsContact C-N 3.26Å; D1233-L1235 PolarHBondContact O-N 3.42Å; D1233-L1235 WeakPolarHBondContact OD1-CA 3.39Å; D1233-L1235 VanDerWaalsContact OD1-CB 3.23Å; D1233-L1235 WeakPolarHBondContact OD1-CB 3.31Å; D1233-L1235 VanDerWaalsContact OD1-CG 3.28Å; D1233-L1235 WeakPolarHBondContact OD1-CG 3.49Å; D1233-L1235 PolarHBondContact OD1-N 3.07Å; D1233-L1235 WeakPolarHBondContact OD2-CD1 3.27Å; D1233-Q1325 PolarHBondContact OD2-NE2 3.18Å; D1233-Q1325 PolarHBondContact OD2-OE1 2.8Å
1234	D	86.3	Confident	91	Very high	86.4 Å²	86.4	39.2 Å²	39.2	46%	0.462	22%	0.217	S	C	.	.	S	Bend	trans	71.7	13.7	-172.3	-70.2	-55.2	0	0	0	115.4	D1229 Q1403	D1229-D1234 VanDerWaalsContact OD2-CA 3.3Å; D1229-D1234 WeakPolarHBondContact OD2-CA 3.35Å; D1229-D1234 PolarHBondContact OD2-N 2.72Å; D1234-Q1403 WeakPolarHBondContact OD2-CG 3.39Å; D1234-Q1403 PolarHBondContact OD2-NE2 3.11Å
1235	L	89.6	Confident	90.8	Very high	2.8 Å²	2.8	43.7 Å²	43.7	2%	0.015	24%	0.244	C	C	.	.			trans	-109.1	164.2	168.1	-52.8	179.3	0	0	0	111.3	D1229 D1233 L1239 D1240 F1377	D1229-L1235 VanDerWaalsContact CB-O 3.24Å; D1229-L1235 WeakPolarHBondContact CB-O 3.37Å; D1229-L1235 VanDerWaalsContact CG-O 3.29Å; D1233-L1235 VanDerWaalsContact C-N 3.26Å; D1233-L1235 PolarHBondContact O-N 3.42Å; D1233-L1235 WeakPolarHBondContact OD1-CA 3.39Å; D1233-L1235 VanDerWaalsContact OD1-CB 3.23Å; D1233-L1235 WeakPolarHBondContact OD1-CB 3.31Å; D1233-L1235 VanDerWaalsContact OD1-CG 3.28Å; D1233-L1235 WeakPolarHBondContact OD1-CG 3.49Å; D1233-L1235 PolarHBondContact OD1-N 3.07Å; D1233-L1235 WeakPolarHBondContact OD2-CD1 3.27Å; L1235-L1239 HydrophobicContact CB-CB 4.38Å; L1235-L1239 HydrophobicContact CD2-CB 4.48Å; L1235-D1240 HydrophobicContact CB-CB 3.95Å; L1235-D1240 HydrophobicContact CD1-CB 4.4Å; L1235-F1377 HydrophobicContact CD1-CE2 4.12Å; L1235-F1377 HydrophobicContact CD1-CZ 4.17Å; L1235-F1377 HydrophobicContact CD2-CE2 3.72Å; L1235-F1377 HydrophobicContact CD2-CZ 4.01Å; L1235-F1377 HydrophobicContact CG-CE2 4.41Å; L1235-F1377 HydrophobicContact CG-CZ 4.45Å
1236	V	92	Very high	90.8	Very high	45.6 Å²	45.6	39.8 Å²	39.8	28%	0.276	23%	0.225	S	C	.	.			trans	-148.3	132.7	-173.3	-177.8	0	0	0	0	111.1	G1227 D1229 C1238 L1239	G1227-V1236 VanDerWaalsContact C-CG1 3.41Å; D1229-V1236 HydrophobicContact CB-CG2 4.07Å; V1236-C1238 PolarHBondContact O-N 3.04Å; V1236-L1239 WeakPolarHBondContact O-CB 3.35Å; V1236-L1239 PolarHBondContact O-N 3.12Å
1237	D	93	Very high	90.8	Very high	31.6 Å²	31.6	41.7 Å²	41.7	17%	0.169	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	46.2	-133.2	-179.2	-56.2	-51.8	0	0	0	110.8	E1221 C1224 D1225 D1226 G1227 L1239 D1240 C1243	E1221-D1237 VanDerWaalsContact CD-N 3.34Å; E1221-D1237 PolarHBondContact OE1-N 2.68Å; E1221-D1237 WeakPolarHBondContact OE2-CA 3.24Å; E1221-D1237 PolarHBondContact OE2-N 2.8Å; C1224-D1237 VanDerWaalsContact C-OD1 3.22Å; D1225-D1237 VanDerWaalsContact CA-OD1 3.28Å; D1225-D1237 WeakPolarHBondContact CA-OD1 3.36Å; D1225-D1237 PolarHBondContact N-OD1 3.02Å; D1226-D1237 PolarHBondContact N-OD1 3.2Å; G1227-D1237 VanDerWaalsContact CA-OD2 3.28Å; G1227-D1237 WeakPolarHBondContact CA-OD2 3.29Å; G1227-D1237 PolarHBondContact N-OD1 3.06Å; G1227-D1237 PolarHBondContact N-OD2 3.2Å; D1237-L1239 PolarHBondContact O-N 3.02Å; D1237-D1240 WeakPolarHBondContact O-CB 3.31Å; D1237-D1240 PolarHBondContact O-N 3.17Å; D1237-C1243 VanDerWaalsContact O-CB 3.28Å; D1237-C1243 WeakPolarHBondContact O-CB 3.43Å
1238	C	92.7	Very high	90.9	Very high	3.8 Å²	3.8	42.2 Å²	42.2	3%	0.026	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-64	1.6	179.3	-52	0	0	0	0	115.9	V1236 D1240 C1249 A1267 S1270 C1271	V1236-C1238 PolarHBondContact O-N 3.04Å; C1238-D1240 VanDerWaalsContact C-N 3.26Å; C1238-C1249 WeakPolarHBondContact CA-SG 3.4Å; C1238-C1249 HydrophobicContact CB-CB 3.84Å; C1238-C1249 WeakPolarHBondContact CB-SG 3.38Å; C1238-C1249 WeakPolarHBondContact SG-CA 3.31Å; C1238-C1249 WeakPolarHBondContact SG-CB 3.35Å; C1238-C1249 CovalentContact SG-SG 2.03Å; C1238-C1249 PolarHBondContact SG-SG 3.03Å; C1238-A1267 HydrophobicContact CB-CB 3.62Å; C1238-S1270 VanDerWaalsContact O-CB 3.27Å; C1238-S1270 WeakPolarHBondContact O-CB 3.44Å; C1238-S1270 PolarHBondContact O-OG 3.05Å; C1238-C1271 PolarHBondContact O-SG 3.38Å
1239	L	91.6	Very high	90.8	Very high	30.8 Å²	30.8	37.4 Å²	37.4	16%	0.161	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-74.2	-34.4	166.4	-70.6	172.1	0	0	0	111.5	L1235 V1236 D1237 N1266 R1371 Y1372 P1373	L1235-L1239 HydrophobicContact CB-CB 4.38Å; L1235-L1239 HydrophobicContact CD2-CB 4.48Å; V1236-L1239 WeakPolarHBondContact O-CB 3.35Å; V1236-L1239 PolarHBondContact O-N 3.12Å; D1237-L1239 PolarHBondContact O-N 3.02Å; L1239-N1266 HydrophobicContact CD2-CB 3.76Å; L1239-N1266 HydrophobicContact CG-CB 4.14Å; L1239-R1371 PolarHBondContact O-NH1 3.01Å; L1239-R1371 PolarHBondContact O-NH2 3.05Å; L1239-R1371 VanDerWaalsContact O-NH2 3.12Å; L1239-Y1372 HydrophobicContact CD2-CD1 4.07Å; L1239-Y1372 HydrophobicContact CD2-CE1 3.75Å; L1239-P1373 HydrophobicContact CD2-CG 4.42Å
1240	D	92.2	Very high	90.7	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.212	C	C	.	.	S	Bend	trans	-67.8	128.6	176.2	168.5	27.1	0	0	0	111.2	E1221 L1235 D1237 C1238 D1242 C1243 C1244	E1221-D1240 WeakPolarHBondContact CB-OD2 3.4Å; E1221-D1240 WeakPolarHBondContact OE2-CB 3.04Å; L1235-D1240 HydrophobicContact CB-CB 3.95Å; L1235-D1240 HydrophobicContact CD1-CB 4.4Å; D1237-D1240 WeakPolarHBondContact O-CB 3.31Å; D1237-D1240 PolarHBondContact O-N 3.17Å; C1238-D1240 VanDerWaalsContact C-N 3.26Å; D1240-D1242 VanDerWaalsContact C-N 3.34Å; D1240-D1242 VanDerWaalsContact CG-N 3.28Å; D1240-D1242 PolarHBondContact O-N 2.97Å; D1240-D1242 WeakPolarHBondContact OD1-CB 2.87Å; D1240-D1242 PolarHBondContact OD1-N 3.07Å; D1240-D1242 WeakPolarHBondContact OD2-CA 3.33Å; D1240-D1242 VanDerWaalsContact OD2-CB 3.26Å; D1240-D1242 WeakPolarHBondContact OD2-CB 3.44Å; D1240-D1242 PolarHBondContact OD2-N 2.97Å; D1240-D1242 VanDerWaalsContact OD2-N 3.16Å; D1240-C1243 HydrophobicContact CB-CB 4.38Å; D1240-C1243 PolarHBondContact O-N 2.98Å; D1240-C1243 VanDerWaalsContact O-N 3.16Å; D1240-C1243 PolarHBondContact OD2-N 3.05Å; D1240-C1244 PolarHBondContact O-N 3.14Å; D1240-C1244 PolarHBondContact O-SG 2.89Å; D1240-C1244 VanDerWaalsContact O-SG 3.39Å
1241	P	91.2	Very high	90.6	Very high	1.2 Å²	1.2	44.7 Å²	44.7	1%	0.008	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-30.7	169.6	-18.8	25.7	0	0	0	116.8	C1243 C1244 T1329 V1330 F1331	P1241-C1243 PolarHBondContact O-N 3.32Å; P1241-C1244 VanDerWaalsContact O-CB 3.28Å; P1241-C1244 WeakPolarHBondContact O-CB 3.34Å; P1241-C1244 PolarHBondContact O-N 3.12Å; P1241-T1329 HydrophobicContact CB-CG2 3.88Å; P1241-T1329 HydrophobicContact CG-CG2 3.92Å; P1241-V1330 VanDerWaalsContact CB-O 3.22Å; P1241-V1330 WeakPolarHBondContact CB-O 3.41Å; P1241-F1331 HydrophobicContact CB-CD1 4.45Å; P1241-F1331 HydrophobicContact CG-CD1 3.56Å; P1241-F1331 HydrophobicContact CG-CE1 3.8Å
1242	D	91.9	Very high	90.5	Very high	29.8 Å²	29.8	44.8 Å²	44.8	16%	0.159	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-42.7	178.1	-68	-31.2	0	0	0	110.3	R1218 I1220 D1240 C1244 T1245	R1218-D1242 IonicContact CZ-OD1 3.47Å; R1218-D1242 IonicContact CZ-OD2 2.97Å; R1218-D1242 VanDerWaalsContact CZ-OD2 3.24Å; R1218-D1242 IonicContact NE-OD2 3.55Å; R1218-D1242 IonicContact NH1-OD1 3.43Å; R1218-D1242 PolarHBondContact NH1-OD1 3.5Å; R1218-D1242 VanDerWaalsContact NH1-OD1 3.17Å; R1218-D1242 IonicContact NH1-OD2 3Å; R1218-D1242 PolarHBondContact NH1-OD2 3.19Å; R1218-D1242 IonicContact NH2-OD1 3.33Å; R1218-D1242 PolarHBondContact NH2-OD1 2.91Å; R1218-D1242 VanDerWaalsContact NH2-OD1 3.14Å; R1218-D1242 IonicContact NH2-OD2 3.42Å; R1218-D1242 PolarHBondContact NH2-OD2 3.01Å; R1218-D1242 VanDerWaalsContact NH2-OD2 3.12Å; I1220-D1242 HydrophobicContact CB-CB 4.38Å; I1220-D1242 WeakPolarHBondContact CB-OD2 3.34Å; I1220-D1242 HydrophobicContact CG2-CB 3.69Å; I1220-D1242 VanDerWaalsContact CG2-OD2 3.28Å; I1220-D1242 WeakPolarHBondContact CG2-OD2 3.28Å; D1240-D1242 VanDerWaalsContact C-N 3.34Å; D1240-D1242 VanDerWaalsContact CG-N 3.28Å; D1240-D1242 PolarHBondContact O-N 2.97Å; D1240-D1242 WeakPolarHBondContact OD1-CB 2.87Å; D1240-D1242 PolarHBondContact OD1-N 3.07Å; D1240-D1242 WeakPolarHBondContact OD2-CA 3.33Å; D1240-D1242 VanDerWaalsContact OD2-CB 3.26Å; D1240-D1242 WeakPolarHBondContact OD2-CB 3.44Å; D1240-D1242 PolarHBondContact OD2-N 2.97Å; D1240-D1242 VanDerWaalsContact OD2-N 3.16Å; D1242-C1244 PolarHBondContact O-N 3.15Å; D1242-C1244 VanDerWaalsContact O-N 3.14Å; D1242-T1245 PolarHBondContact O-N 3.06Å; D1242-T1245 VanDerWaalsContact O-N 3.13Å; D1242-T1245 PolarHBondContact O-OG1 2.97Å
1243	C	93.6	Very high	90.3	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.007	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-65.3	-14.9	174.5	-88.1	0	0	0	0	115.2	E1221 C1224 D1237 D1240 P1241 T1245 S1246 C1249	E1221-C1243 WeakPolarHBondContact CG-SG 3.34Å; E1221-C1243 PolarHBondContact OE2-SG 3.08Å; E1221-C1243 VanDerWaalsContact OE2-SG 3.39Å; C1224-C1243 VanDerWaalsContact CA-SG 3.56Å; C1224-C1243 HydrophobicContact CB-CB 3.67Å; C1224-C1243 WeakPolarHBondContact CB-SG 3.22Å; C1224-C1243 VanDerWaalsContact SG-CA 3.53Å; C1224-C1243 WeakPolarHBondContact SG-CA 3.17Å; C1224-C1243 WeakPolarHBondContact SG-CB 3.33Å; C1224-C1243 CovalentContact SG-SG 2.03Å; C1224-C1243 PolarHBondContact SG-SG 3.01Å; D1237-C1243 VanDerWaalsContact O-CB 3.28Å; D1237-C1243 WeakPolarHBondContact O-CB 3.43Å; D1240-C1243 HydrophobicContact CB-CB 4.38Å; D1240-C1243 PolarHBondContact O-N 2.98Å; D1240-C1243 VanDerWaalsContact O-N 3.16Å; D1240-C1243 PolarHBondContact OD2-N 3.05Å; P1241-C1243 PolarHBondContact O-N 3.32Å; C1243-T1245 PolarHBondContact O-N 2.97Å; C1243-T1245 VanDerWaalsContact O-N 3.12Å; C1243-S1246 WeakPolarHBondContact O-CB 3.29Å; C1243-S1246 PolarHBondContact O-N 3.01Å; C1243-S1246 PolarHBondContact O-OG 2.87Å; C1243-C1249 WeakPolarHBondContact O-CB 3.24Å; C1243-C1249 PolarHBondContact O-SG 3.05Å; C1243-C1249 VanDerWaalsContact O-SG 3.32Å
1244	C	91.7	Very high	90.2	Very high	4.4 Å²	4.4	46.8 Å²	46.8	3%	0.03	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-60.8	-19.1	172.8	-68.6	0	0	0	0	114.3	D1240 P1241 D1242 C1271 W1332	D1240-C1244 PolarHBondContact O-N 3.14Å; D1240-C1244 PolarHBondContact O-SG 2.89Å; D1240-C1244 VanDerWaalsContact O-SG 3.39Å; P1241-C1244 VanDerWaalsContact O-CB 3.28Å; P1241-C1244 WeakPolarHBondContact O-CB 3.34Å; P1241-C1244 PolarHBondContact O-N 3.12Å; D1242-C1244 PolarHBondContact O-N 3.15Å; D1242-C1244 VanDerWaalsContact O-N 3.14Å; C1244-C1271 WeakPolarHBondContact CA-SG 3.33Å; C1244-C1271 HydrophobicContact CB-CB 3.64Å; C1244-C1271 WeakPolarHBondContact CB-SG 3.41Å; C1244-C1271 WeakPolarHBondContact SG-CA 3.25Å; C1244-C1271 WeakPolarHBondContact SG-CB 3.4Å; C1244-C1271 CovalentContact SG-SG 2.03Å; C1244-C1271 PolarHBondContact SG-SG 3.04Å; C1244-W1332 HydrophobicContact CB-CD2 3.87Å; C1244-W1332 HydrophobicContact CB-CE3 3.9Å; C1244-W1332 HydrophobicContact CB-CG 4.34Å; C1244-W1332 HydrophobicContact CB-CH2 4.29Å; C1244-W1332 HydrophobicContact CB-CZ2 4.27Å; C1244-W1332 HydrophobicContact CB-CZ3 4.11Å
1245	T	89.8	Confident	89.9	Confident	104.2 Å²	104.2	47 Å²	47	64%	0.639	24%	0.241	S	C	*	.	G	3₁₀ helix	trans	-85	-10.5	173	62.5	0	0	0	0	113.9	D1242 C1243 W1332	D1242-T1245 PolarHBondContact O-N 3.06Å; D1242-T1245 VanDerWaalsContact O-N 3.13Å; D1242-T1245 PolarHBondContact O-OG1 2.97Å; C1243-T1245 PolarHBondContact O-N 2.97Å; C1243-T1245 VanDerWaalsContact O-N 3.12Å; T1245-W1332 HydrophobicContact CG2-CH2 3.95Å; T1245-W1332 HydrophobicContact CG2-CZ2 3.57Å; T1245-W1332 VanDerWaalsContact CG2-CZ2 3.49Å
1246	S	92.6	Very high	88.7	Confident	23 Å²	23	47.8 Å²	47.8	16%	0.161	25%	0.249	C	C	.	.	S	Bend	trans	-69.4	150.7	-175.2	77.5	0	0	0	0	112.7	C1224 C1243 H1248 C1249 D1250	C1224-S1246 WeakPolarHBondContact SG-CB 3.38Å; C1243-S1246 WeakPolarHBondContact O-CB 3.29Å; C1243-S1246 PolarHBondContact O-N 3.01Å; C1243-S1246 PolarHBondContact O-OG 2.87Å; S1246-H1248 PolarHBondContact O-N 3.07Å; S1246-H1248 VanDerWaalsContact O-N 3.12Å; S1246-H1248 PolarHBondContact OG-N 3.24Å; S1246-C1249 PolarHBondContact O-N 2.95Å; S1246-C1249 PolarHBondContact OG-N 3.1Å; S1246-C1249 PolarHBondContact OG-SG 3.02Å; S1246-D1250 VanDerWaalsContact O-CB 3.28Å; S1246-D1250 WeakPolarHBondContact O-CB 3.32Å; S1246-D1250 PolarHBondContact O-N 3.05Å; S1246-D1250 VanDerWaalsContact O-N 3.1Å
1247	T	91.9	Very high	87.2	Confident	107.8 Å²	107.8	50.5 Å²	50.5	66%	0.661	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-12.4	175.7	63.8	0	0	0	0	113.6	R1251	T1247-R1251 WeakPolarHBondContact O-CB 3.34Å; T1247-R1251 WeakPolarHBondContact O-CD 3.32Å; T1247-R1251 VanDerWaalsContact O-CG 3.26Å; T1247-R1251 WeakPolarHBondContact O-CG 3.39Å; T1247-R1251 PolarHBondContact O-N 2.79Å; T1247-R1251 PolarHBondContact O-NE 2.76Å
1248	H	92.3	Very high	85.7	Confident	58 Å²	58	56.3 Å²	56.3	27%	0.269	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-59.6	172.6	-170.8	101.6	0	0	0	109.9	C1224 D1225 S1246 D1250 R1251 L1252	C1224-H1248 PolarHBondContact O-CD2 2.93Å; C1224-H1248 VanDerWaalsContact O-CD2 3.25Å; D1225-H1248 HydrophobicContact CB-CB 4.41Å; D1225-H1248 WeakPolarHBondContact CB-CE1 3.3Å; D1225-H1248 WeakPolarHBondContact CB-ND1 3.26Å; D1225-H1248 IonicContact OD2-CE1 3.13Å; D1225-H1248 PolarHBondContact OD2-CE1 2.77Å; D1225-H1248 IonicContact OD2-CG 2.76Å; D1225-H1248 IonicContact OD2-ND1 2.95Å; D1225-H1248 PolarHBondContact OD2-ND1 3.24Å; S1246-H1248 PolarHBondContact O-N 3.07Å; S1246-H1248 VanDerWaalsContact O-N 3.12Å; S1246-H1248 PolarHBondContact OG-N 3.24Å; H1248-D1250 PolarHBondContact O-N 3.04Å; H1248-R1251 WeakPolarHBondContact O-CB 3.28Å; H1248-R1251 PolarHBondContact O-N 3.06Å; H1248-R1251 VanDerWaalsContact O-N 3.11Å; H1248-L1252 WeakPolarHBondContact NE2-CD1 3.34Å; H1248-L1252 PolarHBondContact O-N 3Å; H1248-L1252 VanDerWaalsContact O-N 3.14Å
1249	C	91.6	Very high	84.4	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-64	-41.2	-176.8	-54.6	0	0	0	0	112.3	C1238 C1243 S1246 R1251 L1252 I1253	C1238-C1249 WeakPolarHBondContact CA-SG 3.4Å; C1238-C1249 HydrophobicContact CB-CB 3.84Å; C1238-C1249 WeakPolarHBondContact CB-SG 3.38Å; C1238-C1249 WeakPolarHBondContact SG-CA 3.31Å; C1238-C1249 WeakPolarHBondContact SG-CB 3.35Å; C1238-C1249 CovalentContact SG-SG 2.03Å; C1238-C1249 PolarHBondContact SG-SG 3.03Å; C1243-C1249 WeakPolarHBondContact O-CB 3.24Å; C1243-C1249 PolarHBondContact O-SG 3.05Å; C1243-C1249 VanDerWaalsContact O-SG 3.32Å; S1246-C1249 PolarHBondContact O-N 2.95Å; S1246-C1249 PolarHBondContact OG-N 3.1Å; S1246-C1249 PolarHBondContact OG-SG 3.02Å; C1249-R1251 VanDerWaalsContact C-N 3.27Å; C1249-R1251 PolarHBondContact O-N 3Å; C1249-L1252 PolarHBondContact O-N 2.97Å; C1249-L1252 VanDerWaalsContact O-N 3.1Å; C1249-I1253 WeakPolarHBondContact O-CD1 3.3Å; C1249-I1253 VanDerWaalsContact O-CG1 3.28Å; C1249-I1253 WeakPolarHBondContact O-CG1 3.29Å; C1249-I1253 PolarHBondContact O-N 2.98Å
1250	D	88.8	Confident	83.1	Confident	62.2 Å²	62.2	59.2 Å²	59.2	33%	0.333	33%	0.332	S	S	.	.	H	α-helix	trans	-56.9	-35.9	174.3	176.7	68.6	0	0	0	112.9	S1246 H1248 K1254	S1246-D1250 VanDerWaalsContact O-CB 3.28Å; S1246-D1250 WeakPolarHBondContact O-CB 3.32Å; S1246-D1250 PolarHBondContact O-N 3.05Å; S1246-D1250 VanDerWaalsContact O-N 3.1Å; H1248-D1250 PolarHBondContact O-N 3.04Å; D1250-K1254 VanDerWaalsContact CG-NZ 3.34Å; D1250-K1254 WeakPolarHBondContact O-CB 3.42Å; D1250-K1254 VanDerWaalsContact O-CD 3.25Å; D1250-K1254 WeakPolarHBondContact O-CD 3.47Å; D1250-K1254 WeakPolarHBondContact O-CE 3.24Å; D1250-K1254 VanDerWaalsContact O-CG 3.28Å; D1250-K1254 WeakPolarHBondContact O-CG 3.33Å; D1250-K1254 PolarHBondContact O-N 3.13Å; D1250-K1254 VanDerWaalsContact O-N 3.13Å; D1250-K1254 WeakPolarHBondContact OD1-CE 3.4Å; D1250-K1254 IonicContact OD1-NZ 3.42Å; D1250-K1254 PolarHBondContact OD1-NZ 3.09Å; D1250-K1254 WeakPolarHBondContact OD2-CD 3.43Å; D1250-K1254 WeakPolarHBondContact OD2-CE 3.32Å; D1250-K1254 IonicContact OD2-NZ 3.48Å; D1250-K1254 PolarHBondContact OD2-NZ 2.97Å
1251	R	88	Confident	82.5	Confident	163.8 Å²	163.8	61.1 Å²	61.1	62%	0.618	35%	0.352	S	S	*	.	H	α-helix	trans	-72.1	-42.3	175	-110.1	177.8	-131.7	154.9	4.9	111.8	T1247 H1248 C1249 I1253 K1254 L1255	T1247-R1251 WeakPolarHBondContact O-CB 3.34Å; T1247-R1251 WeakPolarHBondContact O-CD 3.32Å; T1247-R1251 VanDerWaalsContact O-CG 3.26Å; T1247-R1251 WeakPolarHBondContact O-CG 3.39Å; T1247-R1251 PolarHBondContact O-N 2.79Å; T1247-R1251 PolarHBondContact O-NE 2.76Å; H1248-R1251 WeakPolarHBondContact O-CB 3.28Å; H1248-R1251 PolarHBondContact O-N 3.06Å; H1248-R1251 VanDerWaalsContact O-N 3.11Å; C1249-R1251 VanDerWaalsContact C-N 3.27Å; C1249-R1251 PolarHBondContact O-N 3Å; R1251-I1253 VanDerWaalsContact C-N 3.32Å; R1251-I1253 PolarHBondContact O-N 3.12Å; R1251-K1254 PolarHBondContact O-N 2.98Å; R1251-K1254 VanDerWaalsContact O-N 3.11Å; R1251-L1255 HydrophobicContact CG-CD1 4.05Å; R1251-L1255 HydrophobicContact CG-CG 4.45Å; R1251-L1255 WeakPolarHBondContact O-CB 3.47Å; R1251-L1255 VanDerWaalsContact O-CG 3.27Å; R1251-L1255 WeakPolarHBondContact O-CG 3.39Å; R1251-L1255 PolarHBondContact O-N 2.86Å; R1251-L1255 VanDerWaalsContact O-N 3.14Å
1252	L	87.3	Confident	82	Confident	25.2 Å²	25.2	66.1 Å²	66.1	13%	0.132	38%	0.383	C	S	.	.	H	α-helix	trans	-61.9	-39.6	178.9	-69.4	-177.1	0	0	0	112.2	H1248 C1249 K1254 L1255 G1256 A1259 A1263 A1264 A1267 Q1268	H1248-L1252 WeakPolarHBondContact NE2-CD1 3.34Å; H1248-L1252 PolarHBondContact O-N 3Å; H1248-L1252 VanDerWaalsContact O-N 3.14Å; C1249-L1252 PolarHBondContact O-N 2.97Å; C1249-L1252 VanDerWaalsContact O-N 3.1Å; L1252-K1254 PolarHBondContact O-N 3.1Å; L1252-L1255 HydrophobicContact CD2-CD1 4.12Å; L1252-L1255 WeakPolarHBondContact O-CB 3.49Å; L1252-L1255 PolarHBondContact O-N 3.03Å; L1252-G1256 PolarHBondContact O-N 2.63Å; L1252-A1259 HydrophobicContact CD2-CB 4.45Å; L1252-A1263 HydrophobicContact CD1-CB 4.06Å; L1252-A1263 WeakPolarHBondContact CD1-O 3.5Å; L1252-A1264 HydrophobicContact CB-CB 4.43Å; L1252-A1264 HydrophobicContact CD2-CB 4.25Å; L1252-A1267 HydrophobicContact CB-CB 3.85Å; L1252-A1267 HydrophobicContact CD1-CB 4.2Å; L1252-Q1268 PolarHBondContact O-NE2 3.08Å
1253	I	83.7	Confident	81.6	Confident	53 Å²	53	67 Å²	67	27%	0.272	39%	0.394	S	S	.	.	H	α-helix	trans	-61	-44.7	174.2	-61.8	160.2	0	0	0	110.7	C1249 R1251 L1255 G1256 A1267 C1271	C1249-I1253 WeakPolarHBondContact O-CD1 3.3Å; C1249-I1253 VanDerWaalsContact O-CG1 3.28Å; C1249-I1253 WeakPolarHBondContact O-CG1 3.29Å; C1249-I1253 PolarHBondContact O-N 2.98Å; R1251-I1253 VanDerWaalsContact C-N 3.32Å; R1251-I1253 PolarHBondContact O-N 3.12Å; I1253-L1255 VanDerWaalsContact C-N 3.32Å; I1253-L1255 PolarHBondContact O-N 3.19Å; I1253-G1256 PolarHBondContact O-N 2.97Å; I1253-A1267 HydrophobicContact CG1-CB 4.22Å; I1253-C1271 HydrophobicContact CD1-CB 3.48Å; I1253-C1271 VanDerWaalsContact CD1-CB 3.48Å; I1253-C1271 HydrophobicContact CG1-CB 4.31Å
1254	K	83.1	Confident	81.1	Confident	147.4 Å²	147.4	67.1 Å²	67.1	64%	0.641	40%	0.395	S	S	*	.	H	α-helix	trans	-72.9	-19.6	-176.5	-73	168.9	-176.9	162.8	0	114.5	D1250 R1251 L1252 G1256	D1250-K1254 VanDerWaalsContact CG-NZ 3.34Å; D1250-K1254 WeakPolarHBondContact O-CB 3.42Å; D1250-K1254 VanDerWaalsContact O-CD 3.25Å; D1250-K1254 WeakPolarHBondContact O-CD 3.47Å; D1250-K1254 WeakPolarHBondContact O-CE 3.24Å; D1250-K1254 VanDerWaalsContact O-CG 3.28Å; D1250-K1254 WeakPolarHBondContact O-CG 3.33Å; D1250-K1254 PolarHBondContact O-N 3.13Å; D1250-K1254 VanDerWaalsContact O-N 3.13Å; D1250-K1254 WeakPolarHBondContact OD1-CE 3.4Å; D1250-K1254 IonicContact OD1-NZ 3.42Å; D1250-K1254 PolarHBondContact OD1-NZ 3.09Å; D1250-K1254 WeakPolarHBondContact OD2-CD 3.43Å; D1250-K1254 WeakPolarHBondContact OD2-CE 3.32Å; D1250-K1254 IonicContact OD2-NZ 3.48Å; D1250-K1254 PolarHBondContact OD2-NZ 2.97Å; R1251-K1254 PolarHBondContact O-N 2.98Å; R1251-K1254 VanDerWaalsContact O-N 3.11Å; L1252-K1254 PolarHBondContact O-N 3.1Å; K1254-G1256 VanDerWaalsContact C-N 3.31Å
1255	L	78.4	Confident	80.7	Confident	92 Å²	92	70.2 Å²	70.2	48%	0.482	41%	0.411	S	S	.	.	H	α-helix	trans	-75.1	-18.3	172.9	-70.2	168	0	0	0	112.1	R1251 L1252 I1253 N1258 A1259 A1264 Q1268	R1251-L1255 HydrophobicContact CG-CD1 4.05Å; R1251-L1255 HydrophobicContact CG-CG 4.45Å; R1251-L1255 WeakPolarHBondContact O-CB 3.47Å; R1251-L1255 VanDerWaalsContact O-CG 3.27Å; R1251-L1255 WeakPolarHBondContact O-CG 3.39Å; R1251-L1255 PolarHBondContact O-N 2.86Å; R1251-L1255 VanDerWaalsContact O-N 3.14Å; L1252-L1255 HydrophobicContact CD2-CD1 4.12Å; L1252-L1255 WeakPolarHBondContact O-CB 3.49Å; L1252-L1255 PolarHBondContact O-N 3.03Å; I1253-L1255 VanDerWaalsContact C-N 3.32Å; I1253-L1255 PolarHBondContact O-N 3.19Å; L1255-N1258 WeakPolarHBondContact O-CB 3.13Å; L1255-N1258 PolarHBondContact O-N 2.68Å; L1255-N1258 PolarHBondContact O-ND2 3.03Å; L1255-N1258 VanDerWaalsContact O-ND2 3.16Å; L1255-A1259 HydrophobicContact CB-CB 3.91Å; L1255-A1259 HydrophobicContact CD1-CB 4.25Å; L1255-A1264 HydrophobicContact CD1-CB 4.5Å; L1255-Q1268 PolarHBondContact O-NE2 3.49Å
1256	G	64.8	Low	80.5	Confident	18.6 Å²	18.6	66.5 Å²	66.5	19%	0.192	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	48.5	-165.5	178.2	0	0	0	0	0	113.2	L1252 I1253 K1254 N1258 A1259 Q1268	L1252-G1256 PolarHBondContact O-N 2.63Å; I1253-G1256 PolarHBondContact O-N 2.97Å; K1254-G1256 VanDerWaalsContact C-N 3.31Å; G1256-N1258 PolarHBondContact O-N 3.06Å; G1256-A1259 VanDerWaalsContact O-CB 3.31Å; G1256-A1259 WeakPolarHBondContact O-CB 3.48Å; G1256-A1259 PolarHBondContact O-N 3.06Å; G1256-A1259 VanDerWaalsContact O-N 3.07Å; G1256-Q1268 VanDerWaalsContact C-OE1 3.25Å; G1256-Q1268 PolarHBondContact O-NE2 2.85Å
1257	P	61.3	Low	80.3	Confident	102.2 Å²	102.2	65.4 Å²	65.4	66%	0.664	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-65.7	-0.3	-173.8	26.1	-35.2	0	0	0	114.9	A1259	P1257-A1259 VanDerWaalsContact C-N 3.29Å
1258	N	61.8	Low	79.9	Confident	153.6 Å²	153.6	62.5 Å²	62.5	82%	0.821	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-94.9	-8	175.1	-56.4	-57.1	0	0	0	113.3	L1255 G1256	L1255-N1258 WeakPolarHBondContact O-CB 3.13Å; L1255-N1258 PolarHBondContact O-N 2.68Å; L1255-N1258 PolarHBondContact O-ND2 3.03Å; L1255-N1258 VanDerWaalsContact O-ND2 3.16Å; G1256-N1258 PolarHBondContact O-N 3.06Å
1259	A	65.5	Low	79.5	Confident	45.6 Å²	45.6	63.7 Å²	63.7	38%	0.377	36%	0.364	S	S	.	.	S	Bend	trans	-77.9	-37.4	-179.8	0	0	0	0	0	112.6	L1252 L1255 G1256 P1257 A1264	L1252-A1259 HydrophobicContact CD2-CB 4.45Å; L1255-A1259 HydrophobicContact CB-CB 3.91Å; L1255-A1259 HydrophobicContact CD1-CB 4.25Å; G1256-A1259 VanDerWaalsContact O-CB 3.31Å; G1256-A1259 WeakPolarHBondContact O-CB 3.48Å; G1256-A1259 PolarHBondContact O-N 3.06Å; G1256-A1259 VanDerWaalsContact O-N 3.07Å; P1257-A1259 VanDerWaalsContact C-N 3.29Å; A1259-A1264 HydrophobicContact CB-CB 3.78Å
1260	G	63.5	Low	79.3	Confident	50 Å²	50	63.7 Å²	63.7	52%	0.515	36%	0.364	S	S	.	.			trans	85.1	109.5	176.7	0	0	0	0	0	115.5	A1264	G1260-A1264 WeakPolarHBondContact O-CB 3.48Å; G1260-A1264 PolarHBondContact O-N 2.73Å
1261	G	79.3	Confident	79.3	Confident	40.8 Å²	40.8	60.8 Å²	60.8	42%	0.421	35%	0.349	S	S	.	.	S	Bend	trans	101.4	166.7	174.9	0	0	0	0	0	113.7	A1263 A1264 D1265	G1261-A1263 VanDerWaalsContact C-N 3.33Å; G1261-A1263 PolarHBondContact O-N 2.92Å; G1261-A1263 VanDerWaalsContact O-N 3.12Å; G1261-A1264 WeakPolarHBondContact O-CA 3.29Å; G1261-A1264 WeakPolarHBondContact O-CB 3.43Å; G1261-A1264 PolarHBondContact O-N 3.09Å; G1261-D1265 VanDerWaalsContact C-OD2 3.3Å; G1261-D1265 PolarHBondContact O-N 3.01Å; G1261-D1265 VanDerWaalsContact O-N 3.08Å
1262	V	82	Confident	79.1	Confident	106.2 Å²	106.2	54.6 Å²	54.6	64%	0.644	33%	0.333	S	S	*	.	H	α-helix	trans	-55.8	-41.1	-165.8	-175.9	0	0	0	0	113.3	A1264 D1265 N1266	V1262-A1264 VanDerWaalsContact C-N 3.32Å; V1262-A1264 PolarHBondContact O-N 3.08Å; V1262-D1265 PolarHBondContact O-N 2.87Å; V1262-N1266 VanDerWaalsContact O-CB 3.25Å; V1262-N1266 WeakPolarHBondContact O-CB 3.34Å; V1262-N1266 VanDerWaalsContact O-CG 3.25Å; V1262-N1266 PolarHBondContact O-N 2.92Å; V1262-N1266 PolarHBondContact O-OD1 3.03Å
1263	A	82.6	Confident	79	Confident	47.8 Å²	47.8	56.8 Å²	56.8	40%	0.395	34%	0.342	S	S	.	.	H	α-helix	trans	-62	-38	177.6	0	0	0	0	0	112.7	L1252 G1261 A1267	L1252-A1263 HydrophobicContact CD1-CB 4.06Å; L1252-A1263 WeakPolarHBondContact CD1-O 3.5Å; G1261-A1263 VanDerWaalsContact C-N 3.33Å; G1261-A1263 PolarHBondContact O-N 2.92Å; G1261-A1263 VanDerWaalsContact O-N 3.12Å; A1263-A1267 WeakPolarHBondContact O-CB 3.42Å; A1263-A1267 PolarHBondContact O-N 3.02Å
1264	A	83.3	Confident	78.9	Confident	3.6 Å²	3.6	55.2 Å²	55.2	3%	0.03	34%	0.336	C	S	.	.	H	α-helix	trans	-72.6	-41.6	176	0	0	0	0	0	112	L1252 L1255 A1259 G1260 G1261 V1262 N1266 A1267 Q1268	L1252-A1264 HydrophobicContact CB-CB 4.43Å; L1252-A1264 HydrophobicContact CD2-CB 4.25Å; L1255-A1264 HydrophobicContact CD1-CB 4.5Å; A1259-A1264 HydrophobicContact CB-CB 3.78Å; G1260-A1264 WeakPolarHBondContact O-CB 3.48Å; G1260-A1264 PolarHBondContact O-N 2.73Å; G1261-A1264 WeakPolarHBondContact O-CA 3.29Å; G1261-A1264 WeakPolarHBondContact O-CB 3.43Å; G1261-A1264 PolarHBondContact O-N 3.09Å; V1262-A1264 VanDerWaalsContact C-N 3.32Å; V1262-A1264 PolarHBondContact O-N 3.08Å; A1264-N1266 VanDerWaalsContact C-N 3.31Å; A1264-N1266 PolarHBondContact O-N 3.26Å; A1264-A1267 PolarHBondContact O-N 3.07Å; A1264-Q1268 VanDerWaalsContact O-CB 3.25Å; A1264-Q1268 WeakPolarHBondContact O-CB 3.32Å; A1264-Q1268 VanDerWaalsContact O-CG 3.25Å; A1264-Q1268 WeakPolarHBondContact O-CG 3.28Å; A1264-Q1268 PolarHBondContact O-N 3.15Å
1265	D	83.1	Confident	78.6	Confident	69 Å²	69	54.2 Å²	54.2	37%	0.369	33%	0.334	S	S	.	.	H	α-helix	trans	-64.1	-37.1	176.2	-64.2	-37.6	0	0	0	111.5	G1261 V1262 Q1269	G1261-D1265 VanDerWaalsContact C-OD2 3.3Å; G1261-D1265 PolarHBondContact O-N 3.01Å; G1261-D1265 VanDerWaalsContact O-N 3.08Å; V1262-D1265 PolarHBondContact O-N 2.87Å; D1265-Q1269 WeakPolarHBondContact O-CB 3.3Å; D1265-Q1269 WeakPolarHBondContact O-CG 3.25Å; D1265-Q1269 PolarHBondContact O-N 3.09Å; D1265-Q1269 PolarHBondContact O-NE2 2.87Å
1266	N	86.5	Confident	78.3	Confident	26.2 Å²	26.2	51.6 Å²	51.6	14%	0.14	32%	0.323	C	S	.	.	H	α-helix	trans	-61.7	-62.6	171.4	-74.7	-3.7	0	0	0	109.7	L1239 V1262 A1264 Q1268 Q1269 S1270 Y1372	L1239-N1266 HydrophobicContact CD2-CB 3.76Å; L1239-N1266 HydrophobicContact CG-CB 4.14Å; V1262-N1266 VanDerWaalsContact O-CB 3.25Å; V1262-N1266 WeakPolarHBondContact O-CB 3.34Å; V1262-N1266 VanDerWaalsContact O-CG 3.25Å; V1262-N1266 PolarHBondContact O-N 2.92Å; V1262-N1266 PolarHBondContact O-OD1 3.03Å; A1264-N1266 VanDerWaalsContact C-N 3.31Å; A1264-N1266 PolarHBondContact O-N 3.26Å; N1266-Q1268 VanDerWaalsContact C-N 3.27Å; N1266-Q1268 PolarHBondContact O-N 3.29Å; N1266-Q1268 VanDerWaalsContact O-N 3.11Å; N1266-Q1269 PolarHBondContact O-N 2.94Å; N1266-S1270 WeakPolarHBondContact O-CB 3.46Å; N1266-S1270 PolarHBondContact O-N 3.1Å; N1266-S1270 PolarHBondContact O-OG 3.07Å; N1266-Y1372 HydrophobicContact CB-CE1 4.48Å; N1266-Y1372 WeakPolarHBondContact OD1-CE1 3.25Å; N1266-Y1372 PolarHBondContact OD1-OH 2.89Å
1267	A	86.9	Confident	78.8	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-53.5	-38.2	-177.5	0	0	0	0	0	113.2	C1238 L1252 I1253 A1263 A1264 Q1269 S1270 C1271	C1238-A1267 HydrophobicContact CB-CB 3.62Å; L1252-A1267 HydrophobicContact CB-CB 3.85Å; L1252-A1267 HydrophobicContact CD1-CB 4.2Å; I1253-A1267 HydrophobicContact CG1-CB 4.22Å; A1263-A1267 WeakPolarHBondContact O-CB 3.42Å; A1263-A1267 PolarHBondContact O-N 3.02Å; A1264-A1267 PolarHBondContact O-N 3.07Å; A1267-Q1269 VanDerWaalsContact C-N 3.29Å; A1267-Q1269 PolarHBondContact O-N 2.82Å; A1267-S1270 WeakPolarHBondContact CA-OG 3.37Å; A1267-C1271 VanDerWaalsContact O-CB 3.28Å; A1267-C1271 WeakPolarHBondContact O-CB 3.37Å; A1267-C1271 PolarHBondContact O-N 3.05Å; A1267-C1271 VanDerWaalsContact O-N 3.12Å
1268	Q	84	Confident	79.3	Confident	46.4 Å²	46.4	49.7 Å²	49.7	22%	0.217	30%	0.302	C	S	.	.	H	α-helix	trans	-72.7	-17.2	179.1	-87.5	172.8	26.4	0	0	113.9	L1252 L1255 G1256 A1264 N1266 A1272	L1252-Q1268 PolarHBondContact O-NE2 3.08Å; L1255-Q1268 PolarHBondContact O-NE2 3.49Å; G1256-Q1268 VanDerWaalsContact C-OE1 3.25Å; G1256-Q1268 PolarHBondContact O-NE2 2.85Å; A1264-Q1268 VanDerWaalsContact O-CB 3.25Å; A1264-Q1268 WeakPolarHBondContact O-CB 3.32Å; A1264-Q1268 VanDerWaalsContact O-CG 3.25Å; A1264-Q1268 WeakPolarHBondContact O-CG 3.28Å; A1264-Q1268 PolarHBondContact O-N 3.15Å; N1266-Q1268 VanDerWaalsContact C-N 3.27Å; N1266-Q1268 PolarHBondContact O-N 3.29Å; N1266-Q1268 VanDerWaalsContact O-N 3.11Å; Q1268-A1272 WeakPolarHBondContact O-CB 3.32Å
1269	Q	83.4	Confident	79.7	Confident	84 Å²	84	46.4 Å²	46.4	39%	0.393	28%	0.279	S	S	.	.	H	α-helix	trans	-105.5	-34.9	178	-70.6	176.2	90.5	0	0	113.1	D1265 N1266 A1267 Y1372	D1265-Q1269 WeakPolarHBondContact O-CB 3.3Å; D1265-Q1269 WeakPolarHBondContact O-CG 3.25Å; D1265-Q1269 PolarHBondContact O-N 3.09Å; D1265-Q1269 PolarHBondContact O-NE2 2.87Å; N1266-Q1269 PolarHBondContact O-N 2.94Å; A1267-Q1269 VanDerWaalsContact C-N 3.29Å; A1267-Q1269 PolarHBondContact O-N 2.82Å; Q1269-Y1372 HydrophobicContact CB-CD1 3.66Å; Q1269-Y1372 HydrophobicContact CB-CD2 4.22Å; Q1269-Y1372 HydrophobicContact CB-CE1 4.15Å; Q1269-Y1372 HydrophobicContact CB-CG 3.7Å; Q1269-Y1372 VanDerWaalsContact OE1-CD2 3.27Å
1270	S	87.5	Confident	80	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-79.8	-41.3	180	56	0	0	0	0	113.2	C1238 N1266 A1267 W1332 R1371	C1238-S1270 VanDerWaalsContact O-CB 3.27Å; C1238-S1270 WeakPolarHBondContact O-CB 3.44Å; C1238-S1270 PolarHBondContact O-OG 3.05Å; N1266-S1270 WeakPolarHBondContact O-CB 3.46Å; N1266-S1270 PolarHBondContact O-N 3.1Å; N1266-S1270 PolarHBondContact O-OG 3.07Å; A1267-S1270 WeakPolarHBondContact CA-OG 3.37Å; S1270-W1332 VanDerWaalsContact O-O 3.08Å; S1270-R1371 VanDerWaalsContact CA-CZ 3.47Å; S1270-R1371 VanDerWaalsContact CA-NH1 3.3Å; S1270-R1371 VanDerWaalsContact O-CZ 3.28Å; S1270-R1371 PolarHBondContact O-NE 2.99Å; S1270-R1371 VanDerWaalsContact O-NE 3.08Å; S1270-R1371 PolarHBondContact O-NH2 2.86Å
1271	C	89	Confident	80.6	Confident	0.8 Å²	0.8	45.6 Å²	45.6	1%	0.005	25%	0.254	C	S	.	.	S	Bend	trans	-103.5	2.3	-174.1	-54.9	0	0	0	0	113.4	C1238 C1244 I1253 A1267 H1273	C1238-C1271 PolarHBondContact O-SG 3.38Å; C1244-C1271 WeakPolarHBondContact CA-SG 3.33Å; C1244-C1271 HydrophobicContact CB-CB 3.64Å; C1244-C1271 WeakPolarHBondContact CB-SG 3.41Å; C1244-C1271 WeakPolarHBondContact SG-CA 3.25Å; C1244-C1271 WeakPolarHBondContact SG-CB 3.4Å; C1244-C1271 CovalentContact SG-SG 2.03Å; C1244-C1271 PolarHBondContact SG-SG 3.04Å; I1253-C1271 HydrophobicContact CD1-CB 3.48Å; I1253-C1271 VanDerWaalsContact CD1-CB 3.48Å; I1253-C1271 HydrophobicContact CG1-CB 4.31Å; A1267-C1271 VanDerWaalsContact O-CB 3.28Å; A1267-C1271 WeakPolarHBondContact O-CB 3.37Å; A1267-C1271 PolarHBondContact O-N 3.05Å; A1267-C1271 VanDerWaalsContact O-N 3.12Å; C1271-H1273 PolarHBondContact O-CD2 2.83Å; C1271-H1273 PolarHBondContact O-N 3Å; C1271-H1273 PolarHBondContact O-ND1 3.31Å; C1271-H1273 VanDerWaalsContact O-ND1 3.1Å
1272	A	84.3	Confident	80.2	Confident	35 Å²	35	48.6 Å²	48.6	29%	0.289	26%	0.259	S	S	.	.			trans	-58.9	132.3	165.1	0	0	0	0	0	109.7	Q1268 W1332 G1333	Q1268-A1272 WeakPolarHBondContact O-CB 3.32Å; A1272-W1332 CarbonylContact O-C 3.43Å; A1272-G1333 WeakPolarHBondContact O-CA 3.37Å; A1272-G1333 PolarHBondContact O-N 3Å; A1272-G1333 VanDerWaalsContact O-N 3.14Å
1273	H	85.8	Confident	79.7	Confident	70 Å²	70	46.7 Å²	46.7	32%	0.324	25%	0.245	S	C	.	.			trans	-143.9	164.6	-179.9	61.1	-36.7	0	0	0	110.4	C1271 W1332 T1349 K1351	C1271-H1273 PolarHBondContact O-CD2 2.83Å; C1271-H1273 PolarHBondContact O-N 3Å; C1271-H1273 PolarHBondContact O-ND1 3.31Å; C1271-H1273 VanDerWaalsContact O-ND1 3.1Å; H1273-W1332 HydrophobicContact CB-CE3 4.35Å; H1273-W1332 AromaticContact CD2-CE3 3.58Å; H1273-W1332 VanDerWaalsContact CD2-CE3 3.49Å; H1273-W1332 AromaticContact CD2-CZ3 3.7Å; H1273-W1332 AromaticContact CE1-CE3 3.85Å; H1273-W1332 AromaticContact CE1-CZ3 3.57Å; H1273-W1332 AromaticContact CG-CE3 3.9Å; H1273-W1332 AromaticContact ND1-CE3 3.39Å; H1273-W1332 AromaticContact ND1-CZ3 3.62Å; H1273-T1349 VanDerWaalsContact CA-O 3.31Å; H1273-T1349 WeakPolarHBondContact CA-O 3.36Å; H1273-T1349 VanDerWaalsContact CB-O 3.28Å; H1273-T1349 WeakPolarHBondContact CB-O 3.26Å; H1273-K1351 WeakPolarHBondContact CD2-CG 3.32Å; H1273-K1351 VanDerWaalsContact CE1-CE 3.42Å; H1273-K1351 WeakPolarHBondContact CE1-CE 3.43Å; H1273-K1351 WeakPolarHBondContact NE2-CE 3.25Å
1274	S	81.4	Confident	79.2	Confident	20.2 Å²	20.2	45.2 Å²	45.2	14%	0.141	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-79	147.9	168.9	63.7	0	0	0	0	111.4	R1303 L1348 T1349 D1350	S1274-R1303 PolarHBondContact OG-NH2 2.93Å; S1274-L1348 VanDerWaalsContact CB-O 3.27Å; S1274-L1348 WeakPolarHBondContact CB-O 3.43Å; S1274-L1348 PolarHBondContact OG-O 2.93Å; S1274-T1349 PolarHBondContact N-O 2.93Å; S1274-T1349 VanDerWaalsContact N-O 3.14Å; S1274-T1349 PolarHBondContact OG-O 2.8Å; S1274-D1350 PolarHBondContact OG-N 2.89Å
1275	E	75.9	Confident	78.5	Confident	126.8 Å²	126.8	49.2 Å²	49.2	59%	0.593	26%	0.256	S	S	*	.	P	Polyproline II helix	trans	-65.8	148.3	166.4	-67.9	-151.3	167	0	0	110.5	F1277 Y1280 R1303	E1275-F1277 PolarHBondContact O-N 3Å; E1275-Y1280 HydrophobicContact CB-CE2 4.49Å; E1275-R1303 PolarHBondContact O-NH2 2.73Å; E1275-R1303 VanDerWaalsContact O-NH2 3.13Å
1276	S	73.1	Confident	77.9	Confident	37.2 Å²	37.2	53.7 Å²	53.7	26%	0.26	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-61.4	143.1	-179.2	158	0	0	0	0	111.1	D1278 Y1279 R1354	S1276-D1278 VanDerWaalsContact CB-OD2 3.28Å; S1276-D1278 WeakPolarHBondContact CB-OD2 3.4Å; S1276-D1278 PolarHBondContact O-N 3.01Å; S1276-D1278 VanDerWaalsContact O-N 3.11Å; S1276-D1278 WeakPolarHBondContact OG-CB 3.43Å; S1276-D1278 VanDerWaalsContact OG-CG 3.23Å; S1276-D1278 PolarHBondContact OG-N 2.91Å; S1276-D1278 PolarHBondContact OG-OD2 3.09Å; S1276-D1278 VanDerWaalsContact OG-OD2 3.1Å; S1276-Y1279 PolarHBondContact O-N 2.87Å; S1276-R1354 PolarHBondContact OG-NH2 2.82Å; S1276-R1354 VanDerWaalsContact OG-NH2 3.17Å
1277	F	74.4	Confident	77.3	Confident	14.8 Å²	14.8	53.8 Å²	53.8	7%	0.065	28%	0.283	C	S	.	.	H	α-helix	trans	-63.1	-16.1	177.5	62.1	-103.4	0	0	0	112.5	E1275 Y1279 Y1280 L1281 F1299 R1303 D1356 Y1581	E1275-F1277 PolarHBondContact O-N 3Å; F1277-Y1279 PolarHBondContact O-N 2.98Å; F1277-Y1279 VanDerWaalsContact O-N 3.16Å; F1277-Y1280 CarbonylContact O-C 3.6Å; F1277-Y1280 WeakPolarHBondContact O-CA 3.18Å; F1277-Y1280 WeakPolarHBondContact O-CB 3.37Å; F1277-Y1280 PolarHBondContact O-N 3.15Å; F1277-L1281 HydrophobicContact CD2-CB 4.35Å; F1277-L1281 HydrophobicContact CD2-CD1 3.5Å; F1277-L1281 VanDerWaalsContact CD2-CD1 3.49Å; F1277-L1281 HydrophobicContact CD2-CG 4.12Å; F1277-L1281 HydrophobicContact CE2-CD1 3.78Å; F1277-L1281 HydrophobicContact CE2-CD2 4.35Å; F1277-L1281 WeakPolarHBondContact O-CB 3.19Å; F1277-L1281 WeakPolarHBondContact O-CG 3.47Å; F1277-L1281 PolarHBondContact O-N 3.09Å; F1277-F1299 HydrophobicContact CB-CD2 4.49Å; F1277-F1299 HydrophobicContact CD2-CD2 4.46Å; F1277-F1299 HydrophobicContact CD2-CE2 4.04Å; F1277-F1299 HydrophobicContact CG-CE2 4.37Å; F1277-R1303 VanDerWaalsContact CA-NH2 3.35Å; F1277-R1303 VanDerWaalsContact CB-NH2 3.32Å; F1277-D1356 VanDerWaalsContact CD1-OD2 3.29Å; F1277-D1356 WeakPolarHBondContact CD1-OD2 3.45Å; F1277-D1356 WeakPolarHBondContact CE1-OD2 3.43Å; F1277-Y1581 HydrophobicContact CD1-CD1 4.38Å; F1277-Y1581 HydrophobicContact CD1-CE1 4.31Å; F1277-Y1581 AromaticContact CD2-CD1 3.84Å; F1277-Y1581 HydrophobicContact CD2-CD1 3.88Å; F1277-Y1581 HydrophobicContact CD2-CE1 4.43Å; F1277-Y1581 HydrophobicContact CE1-CD1 4.3Å; F1277-Y1581 HydrophobicContact CE1-CE1 4.43Å; F1277-Y1581 AromaticContact CE2-CD1 3.89Å; F1277-Y1581 HydrophobicContact CE2-CD1 3.89Å; F1277-Y1581 HydrophobicContact CE2-CE1 4.48Å; F1277-Y1581 HydrophobicContact CG-CD1 4.21Å; F1277-Y1581 HydrophobicContact CG-CE1 4.39Å; F1277-Y1581 HydrophobicContact CZ-CD1 4.2Å
1278	D	73	Confident	76.7	Confident	65 Å²	65	57.3 Å²	57.3	35%	0.348	31%	0.306	S	S	.	.	H	α-helix	trans	-51.9	-40.3	177.9	-58.1	-56	0	0	0	111.6	Y956 S1276 L1282	Y956-D1278 HydrophobicContact CD1-CB 3.97Å; Y956-D1278 HydrophobicContact CE1-CB 4.24Å; S1276-D1278 VanDerWaalsContact CB-OD2 3.28Å; S1276-D1278 WeakPolarHBondContact CB-OD2 3.4Å; S1276-D1278 PolarHBondContact O-N 3.01Å; S1276-D1278 VanDerWaalsContact O-N 3.11Å; S1276-D1278 WeakPolarHBondContact OG-CB 3.43Å; S1276-D1278 VanDerWaalsContact OG-CG 3.23Å; S1276-D1278 PolarHBondContact OG-N 2.91Å; S1276-D1278 PolarHBondContact OG-OD2 3.09Å; S1276-D1278 VanDerWaalsContact OG-OD2 3.1Å; D1278-L1282 WeakPolarHBondContact O-CB 3.07Å; D1278-L1282 WeakPolarHBondContact O-CD1 3.38Å; D1278-L1282 VanDerWaalsContact O-CG 3.28Å; D1278-L1282 WeakPolarHBondContact O-CG 3.31Å; D1278-L1282 PolarHBondContact O-N 3.08Å; D1278-L1282 VanDerWaalsContact O-N 3.09Å
1279	Y	68.7	Low	76.1	Confident	84.6 Å²	84.6	59.4 Å²	59.4	33%	0.332	32%	0.318	S	S	.	.	H	α-helix	trans	-62.3	-52.1	175.2	176.1	-111.5	0	0	0	111.7	E945 L946 P947 S1276 F1277 L1281 L1282 I1283	E945-Y1279 PolarHBondContact O-OH 3.39Å; E945-Y1279 VanDerWaalsContact O-OH 3.09Å; L946-Y1279 WeakPolarHBondContact CA-OH 2.98Å; L946-Y1279 HydrophobicContact CB-CD2 4.44Å; L946-Y1279 HydrophobicContact CB-CE2 3.77Å; L946-Y1279 HydrophobicContact CD2-CD2 3.67Å; L946-Y1279 HydrophobicContact CD2-CE2 3.79Å; L946-Y1279 HydrophobicContact CD2-CG 4.27Å; L946-Y1279 VanDerWaalsContact CD2-OH 3.22Å; L946-Y1279 WeakPolarHBondContact CD2-OH 3.03Å; L946-Y1279 HydrophobicContact CG-CD2 4.03Å; L946-Y1279 HydrophobicContact CG-CE2 3.61Å; P947-Y1279 HydrophobicContact CG-CE2 4.21Å; S1276-Y1279 PolarHBondContact O-N 2.87Å; F1277-Y1279 PolarHBondContact O-N 2.98Å; F1277-Y1279 VanDerWaalsContact O-N 3.16Å; Y1279-L1281 VanDerWaalsContact C-N 3.3Å; Y1279-L1281 PolarHBondContact O-N 3.11Å; Y1279-L1282 PolarHBondContact O-N 3.3Å; Y1279-L1282 VanDerWaalsContact O-N 3.07Å; Y1279-I1283 HydrophobicContact CD1-CD1 4.29Å; Y1279-I1283 HydrophobicContact CD2-CG2 4.09Å; Y1279-I1283 HydrophobicContact CE1-CD1 3.86Å; Y1279-I1283 HydrophobicContact CE1-CG1 4.41Å; Y1279-I1283 HydrophobicContact CE1-CG2 4.22Å; Y1279-I1283 HydrophobicContact CE2-CD1 4.5Å; Y1279-I1283 HydrophobicContact CE2-CG2 3.73Å; Y1279-I1283 HydrophobicContact CG-CG2 4.36Å; Y1279-I1283 VanDerWaalsContact CZ-CG2 3.49Å; Y1279-I1283 WeakPolarHBondContact O-CG1 3.37Å; Y1279-I1283 VanDerWaalsContact O-CG2 3.24Å; Y1279-I1283 WeakPolarHBondContact O-CG2 3.35Å; Y1279-I1283 PolarHBondContact O-N 3.27Å; Y1279-I1283 VanDerWaalsContact O-N 3.1Å
1280	Y	72	Confident	75.7	Confident	39.4 Å²	39.4	58.5 Å²	58.5	16%	0.155	32%	0.316	C	S	.	.	H	α-helix	trans	-61.9	-36.9	-179.6	-72.2	-85.1	0	0	0	112.8	E1275 F1277 L1282 I1283 T1284 F1299 R1302 R1303 E1304	E1275-Y1280 HydrophobicContact CB-CE2 4.49Å; F1277-Y1280 CarbonylContact O-C 3.6Å; F1277-Y1280 WeakPolarHBondContact O-CA 3.18Å; F1277-Y1280 WeakPolarHBondContact O-CB 3.37Å; F1277-Y1280 PolarHBondContact O-N 3.15Å; Y1280-L1282 VanDerWaalsContact C-N 3.32Å; Y1280-L1282 PolarHBondContact O-N 3.24Å; Y1280-I1283 HydrophobicContact CD1-CD1 4.09Å; Y1280-I1283 WeakPolarHBondContact O-CG1 3.39Å; Y1280-I1283 PolarHBondContact O-N 2.88Å; Y1280-T1284 VanDerWaalsContact O-CB 3.3Å; Y1280-T1284 WeakPolarHBondContact O-CB 3.38Å; Y1280-T1284 WeakPolarHBondContact O-CG2 3.34Å; Y1280-T1284 PolarHBondContact O-N 3.19Å; Y1280-T1284 VanDerWaalsContact O-N 3.07Å; Y1280-T1284 PolarHBondContact O-OG1 3Å; Y1280-T1284 VanDerWaalsContact O-OG1 3.07Å; Y1280-F1299 WeakPolarHBondContact CB-O 3.41Å; Y1280-R1302 HydrophobicContact CD1-CB 4.19Å; Y1280-R1302 HydrophobicContact CE1-CB 4.39Å; Y1280-R1302 WeakPolarHBondContact CE1-O 3.5Å; Y1280-R1303 HydrophobicContact CD1-CG 4.16Å; Y1280-R1303 HydrophobicContact CD2-CG 4.15Å; Y1280-R1303 HydrophobicContact CE1-CB 4.45Å; Y1280-R1303 HydrophobicContact CE1-CG 4.08Å; Y1280-R1303 HydrophobicContact CE2-CG 4.12Å; Y1280-R1303 HydrophobicContact CG-CG 4.16Å; Y1280-E1304 PolarHBondContact OH-OE1 2.98Å
1281	L	76	Confident	75.3	Confident	39.2 Å²	39.2	59 Å²	59	21%	0.205	32%	0.32	C	S	.	.	H	α-helix	trans	-60	-38.2	173.6	-91.6	161.1	0	0	0	112.6	F1277 Y1279 T1284 F1299 R1583	F1277-L1281 HydrophobicContact CD2-CB 4.35Å; F1277-L1281 HydrophobicContact CD2-CD1 3.5Å; F1277-L1281 VanDerWaalsContact CD2-CD1 3.49Å; F1277-L1281 HydrophobicContact CD2-CG 4.12Å; F1277-L1281 HydrophobicContact CE2-CD1 3.78Å; F1277-L1281 HydrophobicContact CE2-CD2 4.35Å; F1277-L1281 WeakPolarHBondContact O-CB 3.19Å; F1277-L1281 WeakPolarHBondContact O-CG 3.47Å; F1277-L1281 PolarHBondContact O-N 3.09Å; Y1279-L1281 VanDerWaalsContact C-N 3.3Å; Y1279-L1281 PolarHBondContact O-N 3.11Å; L1281-T1284 PolarHBondContact O-OG1 3.11Å; L1281-F1299 HydrophobicContact CB-CD2 4.26Å; L1281-F1299 HydrophobicContact CD1-CD1 4.42Å; L1281-F1299 HydrophobicContact CD1-CD2 3.68Å; L1281-F1299 HydrophobicContact CD1-CE1 4.44Å; L1281-F1299 HydrophobicContact CD1-CE2 3.68Å; L1281-F1299 HydrophobicContact CD1-CG 4.07Å; L1281-F1299 HydrophobicContact CD1-CZ 4.08Å; L1281-F1299 HydrophobicContact CD2-CB 4.42Å; L1281-F1299 HydrophobicContact CD2-CD1 4.24Å; L1281-F1299 HydrophobicContact CD2-CD2 3.43Å; L1281-F1299 VanDerWaalsContact CD2-CD2 3.45Å; L1281-F1299 HydrophobicContact CD2-CE1 4.29Å; L1281-F1299 HydrophobicContact CD2-CE2 3.61Å; L1281-F1299 HydrophobicContact CD2-CG 3.77Å; L1281-F1299 HydrophobicContact CD2-CZ 4.11Å; L1281-F1299 HydrophobicContact CG-CD2 3.86Å; L1281-F1299 HydrophobicContact CG-CE2 4.1Å; L1281-F1299 HydrophobicContact CG-CG 4.41Å; L1281-R1583 HydrophobicContact CD2-CG 4.31Å
1282	L	71.8	Confident	74.9	Confident	104.2 Å²	104.2	60.6 Å²	60.6	55%	0.546	33%	0.333	S	S	.	.	H	α-helix	trans	-80	-27.7	-177.3	-69.7	165.2	0	0	0	113.1	V949 Y956 D1278 Y1279 Y1280	V949-L1282 HydrophobicContact CB-CD1 4.43Å; V949-L1282 HydrophobicContact CG1-CD1 3.44Å; V949-L1282 VanDerWaalsContact CG1-CD1 3.44Å; V949-L1282 HydrophobicContact CG1-CG 4.43Å; V949-L1282 HydrophobicContact CG2-CB 3.93Å; V949-L1282 HydrophobicContact CG2-CD1 4.07Å; Y956-L1282 HydrophobicContact CD1-CD1 3.66Å; Y956-L1282 HydrophobicContact CD2-CD1 3.66Å; Y956-L1282 HydrophobicContact CE1-CD1 3.65Å; Y956-L1282 HydrophobicContact CE2-CD1 3.64Å; Y956-L1282 HydrophobicContact CE2-CD2 3.98Å; Y956-L1282 HydrophobicContact CE2-CG 4.46Å; Y956-L1282 HydrophobicContact CG-CD1 3.66Å; D1278-L1282 WeakPolarHBondContact O-CB 3.07Å; D1278-L1282 WeakPolarHBondContact O-CD1 3.38Å; D1278-L1282 VanDerWaalsContact O-CG 3.28Å; D1278-L1282 WeakPolarHBondContact O-CG 3.31Å; D1278-L1282 PolarHBondContact O-N 3.08Å; D1278-L1282 VanDerWaalsContact O-N 3.09Å; Y1279-L1282 PolarHBondContact O-N 3.3Å; Y1279-L1282 VanDerWaalsContact O-N 3.07Å; Y1280-L1282 VanDerWaalsContact C-N 3.32Å; Y1280-L1282 PolarHBondContact O-N 3.24Å
1283	I	71.3	Confident	75	Confident	65.6 Å²	65.6	60.4 Å²	60.4	34%	0.336	33%	0.326	S	S	.	.	H	α-helix	trans	-91	-17.5	179.9	69.6	166.5	0	0	0	114.1	P947 V949 Y1279 Y1280	P947-I1283 HydrophobicContact CG-CB 3.64Å; P947-I1283 VanDerWaalsContact CG-CB 3.42Å; P947-I1283 HydrophobicContact CG-CG2 3.53Å; P947-I1283 WeakPolarHBondContact CG-O 3.45Å; V949-I1283 HydrophobicContact CG2-CG2 4.4Å; Y1279-I1283 HydrophobicContact CD1-CD1 4.29Å; Y1279-I1283 HydrophobicContact CD2-CG2 4.09Å; Y1279-I1283 HydrophobicContact CE1-CD1 3.86Å; Y1279-I1283 HydrophobicContact CE1-CG1 4.41Å; Y1279-I1283 HydrophobicContact CE1-CG2 4.22Å; Y1279-I1283 HydrophobicContact CE2-CD1 4.5Å; Y1279-I1283 HydrophobicContact CE2-CG2 3.73Å; Y1279-I1283 HydrophobicContact CG-CG2 4.36Å; Y1279-I1283 VanDerWaalsContact CZ-CG2 3.49Å; Y1279-I1283 WeakPolarHBondContact O-CG1 3.37Å; Y1279-I1283 VanDerWaalsContact O-CG2 3.24Å; Y1279-I1283 WeakPolarHBondContact O-CG2 3.35Å; Y1279-I1283 PolarHBondContact O-N 3.27Å; Y1279-I1283 VanDerWaalsContact O-N 3.1Å; Y1280-I1283 HydrophobicContact CD1-CD1 4.09Å; Y1280-I1283 WeakPolarHBondContact O-CG1 3.39Å; Y1280-I1283 PolarHBondContact O-N 2.88Å
1284	T	72.1	Confident	75.1	Confident	17.8 Å²	17.8	58.4 Å²	58.4	11%	0.109	32%	0.315	C	S	.	.	S	Bend	trans	-87.2	135.3	-178.7	-17.2	0	0	0	0	110.9	Y1280 L1281 I1286 E1298 F1299 R1302	Y1280-T1284 VanDerWaalsContact O-CB 3.3Å; Y1280-T1284 WeakPolarHBondContact O-CB 3.38Å; Y1280-T1284 WeakPolarHBondContact O-CG2 3.34Å; Y1280-T1284 PolarHBondContact O-N 3.19Å; Y1280-T1284 VanDerWaalsContact O-N 3.07Å; Y1280-T1284 PolarHBondContact O-OG1 3Å; Y1280-T1284 VanDerWaalsContact O-OG1 3.07Å; L1281-T1284 PolarHBondContact O-OG1 3.11Å; T1284-I1286 PolarHBondContact O-N 2.93Å; T1284-E1298 HydrophobicContact CG2-CB 4.22Å; T1284-E1298 HydrophobicContact CG2-CG 4.07Å; T1284-F1299 HydrophobicContact CG2-CB 3.94Å; T1284-F1299 WeakPolarHBondContact OG1-CA 3.43Å; T1284-F1299 WeakPolarHBondContact OG1-CB 3.26Å; T1284-R1302 WeakPolarHBondContact OG1-CD 3.35Å
1285	P	68.9	Low	75.1	Confident	86.2 Å²	86.2	58 Å²	58	56%	0.56	31%	0.314	S	S	*	.	P	Polyproline II helix	trans	-55.1	139.3	173.1	-15.7	22.5	0	0	0	111.6	A1287	P1285-A1287 PolarHBondContact O-N 2.95Å; P1285-A1287 VanDerWaalsContact O-N 3.13Å
1286	I	70.8	Confident	75.5	Confident	164 Å²	164	54.1 Å²	54.1	84%	0.841	30%	0.296	S	S	*	.	P	Polyproline II helix	trans	-62.8	121.2	174.4	-60.3	173	0	0	0	108	T1284	T1284-I1286 PolarHBondContact O-N 2.93Å
1287	A	73.1	Confident	76.2	Confident	28 Å²	28	52.3 Å²	52.3	23%	0.231	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-60	141.2	178.9	0	0	0	0	0	110.6	P1285 S1291 Q1296	P1285-A1287 PolarHBondContact O-N 2.95Å; P1285-A1287 VanDerWaalsContact O-N 3.13Å; A1287-S1291 WeakPolarHBondContact CB-OG 3.22Å; A1287-Q1296 HydrophobicContact CB-CB 4.49Å; A1287-Q1296 HydrophobicContact CB-CG 4.33Å
1288	P	73.4	Confident	76.6	Confident	74.6 Å²	74.6	53.2 Å²	53.2	48%	0.484	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-50.6	147.8	176	-28.9	34.7	0	0	0	113	D1290 S1291	P1288-D1290 VanDerWaalsContact C-N 3.27Å; P1288-D1290 WeakPolarHBondContact CB-OD1 3.17Å; P1288-D1290 PolarHBondContact O-N 3.09Å; P1288-D1290 VanDerWaalsContact O-N 3.1Å; P1288-S1291 VanDerWaalsContact CD-OG 3.24Å; P1288-S1291 WeakPolarHBondContact CD-OG 3.38Å; P1288-S1291 VanDerWaalsContact N-OG 3.09Å; P1288-S1291 WeakPolarHBondContact O-CB 3.37Å; P1288-S1291 PolarHBondContact O-N 3.18Å; P1288-S1291 PolarHBondContact O-OG 3.12Å
1289	L	73	Confident	77	Confident	89.6 Å²	89.6	50.4 Å²	50.4	47%	0.469	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-24.3	-173.4	-60.8	161.8	0	0	0	113.8	S1291 Y1586 L1619	L1289-S1291 VanDerWaalsContact C-N 3.3Å; L1289-S1291 PolarHBondContact O-N 2.87Å; L1289-Y1586 HydrophobicContact CB-CE2 4.48Å; L1289-Y1586 HydrophobicContact CD2-CE1 4.34Å; L1289-Y1586 HydrophobicContact CD2-CE2 3.88Å; L1289-Y1586 WeakPolarHBondContact CD2-OH 3.2Å; L1289-L1619 HydrophobicContact CB-CD2 3.44Å; L1289-L1619 VanDerWaalsContact CB-CD2 3.46Å; L1289-L1619 HydrophobicContact CD1-CD2 4.34Å; L1289-L1619 HydrophobicContact CG-CD2 4.48Å
1290	D	75.4	Confident	77.8	Confident	65.2 Å²	65.2	46.4 Å²	46.4	35%	0.349	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	16.3	174.3	109.3	-8.5	0	0	0	112.9	P1288 A1292 L1619 V1637 S1638 H1639	P1288-D1290 VanDerWaalsContact C-N 3.27Å; P1288-D1290 WeakPolarHBondContact CB-OD1 3.17Å; P1288-D1290 PolarHBondContact O-N 3.09Å; P1288-D1290 VanDerWaalsContact O-N 3.1Å; D1290-A1292 PolarHBondContact O-N 2.79Å; D1290-L1619 HydrophobicContact CB-CD1 3.97Å; D1290-V1637 PolarHBondContact OD1-N 3.04Å; D1290-V1637 WeakPolarHBondContact OD2-CA 3.3Å; D1290-V1637 VanDerWaalsContact OD2-CB 3.28Å; D1290-V1637 WeakPolarHBondContact OD2-CB 3.41Å; D1290-V1637 PolarHBondContact OD2-N 3.19Å; D1290-S1638 VanDerWaalsContact O-CB 3.3Å; D1290-S1638 WeakPolarHBondContact O-CB 3.24Å; D1290-S1638 PolarHBondContact O-OG 3.05Å; D1290-S1638 WeakPolarHBondContact OD1-CB 3.38Å; D1290-S1638 PolarHBondContact OD1-N 3.18Å; D1290-S1638 VanDerWaalsContact OD1-N 3.1Å; D1290-S1638 PolarHBondContact OD1-OG 2.8Å; D1290-S1638 PolarHBondContact OD2-N 2.99Å; D1290-H1639 IonicContact OD1-CD2 3.2Å; D1290-H1639 PolarHBondContact OD1-CD2 3.19Å
1291	S	77.5	Confident	78.4	Confident	10 Å²	10	44.9 Å²	44.9	7%	0.07	25%	0.252	C	S	.	.			trans	-66.4	137.6	177.1	19.6	0	0	0	0	111.9	A1287 P1288 L1289 Q1296 N1751	A1287-S1291 WeakPolarHBondContact CB-OG 3.22Å; P1288-S1291 VanDerWaalsContact CD-OG 3.24Å; P1288-S1291 WeakPolarHBondContact CD-OG 3.38Å; P1288-S1291 VanDerWaalsContact N-OG 3.09Å; P1288-S1291 WeakPolarHBondContact O-CB 3.37Å; P1288-S1291 PolarHBondContact O-N 3.18Å; P1288-S1291 PolarHBondContact O-OG 3.12Å; L1289-S1291 VanDerWaalsContact C-N 3.3Å; L1289-S1291 PolarHBondContact O-N 2.87Å; S1291-Q1296 PolarHBondContact O-NE2 3.19Å; S1291-Q1296 WeakPolarHBondContact OG-CG 3.36Å; S1291-N1751 WeakPolarHBondContact CA-OD1 3.38Å; S1291-N1751 WeakPolarHBondContact CB-ND2 3.3Å; S1291-N1751 WeakPolarHBondContact CB-OD1 3.47Å; S1291-N1751 PolarHBondContact OG-ND2 2.83Å
1292	A	81.2	Confident	78.3	Confident	34.6 Å²	34.6	47.8 Å²	47.8	29%	0.286	26%	0.26	S	S	.	.			trans	-64.9	156.6	168.4	0	0	0	0	0	111.2	D1290 Y1294 G1295 Q1296 N1751 F1754 K1759	D1290-A1292 PolarHBondContact O-N 2.79Å; A1292-Y1294 VanDerWaalsContact C-N 3.31Å; A1292-Y1294 PolarHBondContact O-N 2.85Å; A1292-Y1294 VanDerWaalsContact O-N 3.16Å; A1292-G1295 WeakPolarHBondContact O-CA 3.27Å; A1292-G1295 PolarHBondContact O-N 3.02Å; A1292-Q1296 WeakPolarHBondContact O-CG 3.28Å; A1292-Q1296 PolarHBondContact O-N 3.21Å; A1292-Q1296 VanDerWaalsContact O-N 3.1Å; A1292-N1751 PolarHBondContact N-OD1 3.23Å; A1292-N1751 VanDerWaalsContact N-OD1 3.16Å; A1292-F1754 HydrophobicContact CB-CD1 3.61Å; A1292-F1754 HydrophobicContact CB-CE1 3.24Å; A1292-F1754 HydrophobicContact CB-CG 4.23Å; A1292-F1754 HydrophobicContact CB-CZ 4.09Å; A1292-K1759 HydrophobicContact CB-CD 4.05Å
1293	F	87.1	Confident	78.3	Confident	31.8 Å²	31.8	43.9 Å²	43.9	14%	0.139	24%	0.238	C	C	.	.	H	α-helix	trans	-50	-45.1	-175.3	-177.7	-98.4	0	0	0	113.6	G1295 Q1296 L1297 I1316 N1388 I1390	F1293-G1295 VanDerWaalsContact C-N 3.31Å; F1293-G1295 PolarHBondContact O-N 2.96Å; F1293-Q1296 CarbonylContact O-C 3.42Å; F1293-Q1296 WeakPolarHBondContact O-CA 3.4Å; F1293-Q1296 VanDerWaalsContact O-CB 3.3Å; F1293-Q1296 WeakPolarHBondContact O-CB 3.3Å; F1293-Q1296 PolarHBondContact O-N 3.21Å; F1293-Q1296 VanDerWaalsContact O-N 3.09Å; F1293-L1297 HydrophobicContact CD1-CD1 4.16Å; F1293-L1297 HydrophobicContact CD1-CG 4.41Å; F1293-L1297 HydrophobicContact CE1-CD1 3.63Å; F1293-L1297 HydrophobicContact CE1-CD2 4.3Å; F1293-L1297 HydrophobicContact CE1-CG 4.08Å; F1293-L1297 HydrophobicContact CE2-CD2 4.49Å; F1293-L1297 HydrophobicContact CZ-CD1 4.22Å; F1293-L1297 HydrophobicContact CZ-CD2 4.11Å; F1293-L1297 HydrophobicContact CZ-CG 4.39Å; F1293-L1297 PolarHBondContact O-N 3.07Å; F1293-L1297 VanDerWaalsContact O-N 3.15Å; F1293-I1316 HydrophobicContact CD1-CG2 4.16Å; F1293-I1316 WeakPolarHBondContact CD1-O 3.31Å; F1293-I1316 HydrophobicContact CE1-CG2 4.43Å; F1293-I1316 VanDerWaalsContact CE1-O 3.27Å; F1293-I1316 WeakPolarHBondContact CE1-O 3.35Å; F1293-N1388 HydrophobicContact CB-CB 3.94Å; F1293-N1388 HydrophobicContact CD1-CB 3.94Å; F1293-N1388 WeakPolarHBondContact CD1-OD1 3.46Å; F1293-N1388 HydrophobicContact CD2-CB 4.5Å; F1293-N1388 WeakPolarHBondContact CD2-O 3.19Å; F1293-N1388 WeakPolarHBondContact CE2-O 3.27Å; F1293-N1388 HydrophobicContact CG-CB 3.9Å; F1293-I1390 HydrophobicContact CE2-CD1 4.44Å; F1293-I1390 HydrophobicContact CE2-CG1 4Å; F1293-I1390 HydrophobicContact CZ-CG1 3.91Å
1294	Y	86.1	Confident	77.9	Confident	27.2 Å²	27.2	46.2 Å²	46.2	11%	0.107	25%	0.248	C	C	.	.	H	α-helix	trans	-53.5	-45	173.3	174.6	-97.1	0	0	0	113.5	A1292 Q1296 L1297 L1301 V1308 P1313 I1316 L1750 F1754 Q1755	A1292-Y1294 VanDerWaalsContact C-N 3.31Å; A1292-Y1294 PolarHBondContact O-N 2.85Å; A1292-Y1294 VanDerWaalsContact O-N 3.16Å; Y1294-Q1296 VanDerWaalsContact C-N 3.29Å; Y1294-Q1296 PolarHBondContact O-N 2.84Å; Y1294-L1297 WeakPolarHBondContact O-CB 3.3Å; Y1294-L1297 PolarHBondContact O-N 2.97Å; Y1294-L1301 HydrophobicContact CD2-CD1 3.99Å; Y1294-L1301 HydrophobicContact CE1-CD1 4.43Å; Y1294-L1301 HydrophobicContact CE2-CD1 3.67Å; Y1294-V1308 HydrophobicContact CE2-CG1 4.43Å; Y1294-V1308 VanDerWaalsContact OH-CG1 3.3Å; Y1294-V1308 WeakPolarHBondContact OH-CG1 3.33Å; Y1294-P1313 WeakPolarHBondContact CB-O 3.39Å; Y1294-P1313 HydrophobicContact CD1-CB 4.01Å; Y1294-P1313 HydrophobicContact CD1-CG 4.4Å; Y1294-P1313 HydrophobicContact CD2-CB 3.86Å; Y1294-P1313 HydrophobicContact CD2-CG 4.07Å; Y1294-P1313 HydrophobicContact CE1-CB 4.37Å; Y1294-P1313 HydrophobicContact CE1-CG 4.23Å; Y1294-P1313 HydrophobicContact CE2-CB 4.22Å; Y1294-P1313 HydrophobicContact CE2-CG 4.23Å; Y1294-P1313 HydrophobicContact CG-CB 3.71Å; Y1294-P1313 HydrophobicContact CG-CG 4.36Å; Y1294-I1316 HydrophobicContact CD2-CB 4.4Å; Y1294-I1316 HydrophobicContact CD2-CD1 3.89Å; Y1294-I1316 HydrophobicContact CD2-CG2 3.86Å; Y1294-I1316 HydrophobicContact CE2-CD1 4.19Å; Y1294-I1316 HydrophobicContact CG-CG2 4.34Å; Y1294-L1750 HydrophobicContact CD1-CB 4.23Å; Y1294-L1750 WeakPolarHBondContact CD1-O 3.18Å; Y1294-L1750 HydrophobicContact CE1-CB 3.97Å; Y1294-L1750 HydrophobicContact CE1-CD2 4.13Å; Y1294-L1750 WeakPolarHBondContact CE1-O 3.46Å; Y1294-F1754 HydrophobicContact CD1-CB 4.39Å; Y1294-Q1755 PolarHBondContact OH-NE2 2.95Å
1295	G	82.4	Confident	78.1	Confident	11.4 Å²	11.4	51 Å²	51	12%	0.118	26%	0.264	C	S	.	.	H	α-helix	trans	-66.6	-27.2	177.4	0	0	0	0	0	112.9	A1292 F1293 L1297 E1298	A1292-G1295 WeakPolarHBondContact O-CA 3.27Å; A1292-G1295 PolarHBondContact O-N 3.02Å; F1293-G1295 VanDerWaalsContact C-N 3.31Å; F1293-G1295 PolarHBondContact O-N 2.96Å; G1295-L1297 VanDerWaalsContact C-N 3.3Å; G1295-L1297 PolarHBondContact O-N 3.12Å; G1295-E1298 WeakPolarHBondContact O-CB 3.26Å; G1295-E1298 PolarHBondContact O-N 3.41Å
1296	Q	85.2	Confident	78.7	Confident	45 Å²	45	47.9 Å²	47.9	21%	0.21	24%	0.242	C	C	.	.	H	α-helix	trans	-73.4	-17	172.2	-56.6	176	15.5	0	0	112.3	A1287 S1291 A1292 F1293 Y1294 E1298 F1299 R1583	A1287-Q1296 HydrophobicContact CB-CB 4.49Å; A1287-Q1296 HydrophobicContact CB-CG 4.33Å; S1291-Q1296 PolarHBondContact O-NE2 3.19Å; S1291-Q1296 WeakPolarHBondContact OG-CG 3.36Å; A1292-Q1296 WeakPolarHBondContact O-CG 3.28Å; A1292-Q1296 PolarHBondContact O-N 3.21Å; A1292-Q1296 VanDerWaalsContact O-N 3.1Å; F1293-Q1296 CarbonylContact O-C 3.42Å; F1293-Q1296 WeakPolarHBondContact O-CA 3.4Å; F1293-Q1296 VanDerWaalsContact O-CB 3.3Å; F1293-Q1296 WeakPolarHBondContact O-CB 3.3Å; F1293-Q1296 PolarHBondContact O-N 3.21Å; F1293-Q1296 VanDerWaalsContact O-N 3.09Å; Y1294-Q1296 VanDerWaalsContact C-N 3.29Å; Y1294-Q1296 PolarHBondContact O-N 2.84Å; Q1296-E1298 VanDerWaalsContact C-N 3.32Å; Q1296-E1298 PolarHBondContact O-N 2.83Å; Q1296-F1299 WeakPolarHBondContact O-CD1 3.34Å; Q1296-F1299 WeakPolarHBondContact O-CE1 3.31Å; Q1296-R1583 PolarHBondContact O-NH1 3.1Å; Q1296-R1583 PolarHBondContact O-NH2 2.85Å
1297	L	87.5	Confident	79.2	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	5.2	179.3	-62.4	-173.4	0	0	0	114.2	F1293 Y1294 G1295 F1299 L1300 L1301 I1316 V1318	F1293-L1297 HydrophobicContact CD1-CD1 4.16Å; F1293-L1297 HydrophobicContact CD1-CG 4.41Å; F1293-L1297 HydrophobicContact CE1-CD1 3.63Å; F1293-L1297 HydrophobicContact CE1-CD2 4.3Å; F1293-L1297 HydrophobicContact CE1-CG 4.08Å; F1293-L1297 HydrophobicContact CE2-CD2 4.49Å; F1293-L1297 HydrophobicContact CZ-CD1 4.22Å; F1293-L1297 HydrophobicContact CZ-CD2 4.11Å; F1293-L1297 HydrophobicContact CZ-CG 4.39Å; F1293-L1297 PolarHBondContact O-N 3.07Å; F1293-L1297 VanDerWaalsContact O-N 3.15Å; Y1294-L1297 WeakPolarHBondContact O-CB 3.3Å; Y1294-L1297 PolarHBondContact O-N 2.97Å; G1295-L1297 VanDerWaalsContact C-N 3.3Å; G1295-L1297 PolarHBondContact O-N 3.12Å; L1297-F1299 HydrophobicContact CD2-CE1 4.47Å; L1297-F1299 PolarHBondContact O-N 3.07Å; L1297-F1299 VanDerWaalsContact O-N 3.1Å; L1297-L1300 HydrophobicContact CD2-CD1 4.34Å; L1297-L1300 WeakPolarHBondContact O-CB 3.39Å; L1297-L1300 PolarHBondContact O-N 3.24Å; L1297-L1301 HydrophobicContact CB-CD1 4.02Å; L1297-L1301 HydrophobicContact CB-CG 4.17Å; L1297-L1301 WeakPolarHBondContact O-CG 3.42Å; L1297-L1301 PolarHBondContact O-N 2.99Å; L1297-I1316 HydrophobicContact CD1-CD1 4.15Å; L1297-I1316 HydrophobicContact CD1-CG1 4.11Å; L1297-I1316 HydrophobicContact CD1-CG2 4.1Å; L1297-V1318 HydrophobicContact CD1-CG2 3.59Å; L1297-V1318 HydrophobicContact CD2-CG2 3.63Å; L1297-V1318 HydrophobicContact CG-CG2 4.26Å
1298	E	82.3	Confident	79.5	Confident	33.8 Å²	33.8	43.2 Å²	43.2	16%	0.158	22%	0.218	C	C	.	.	H	α-helix	trans	-53.7	-36.6	-173.7	-172.1	167.8	176.5	0	0	113.8	T1284 G1295 Q1296 L1300 L1301 R1302 S1749 L1750	T1284-E1298 HydrophobicContact CG2-CB 4.22Å; T1284-E1298 HydrophobicContact CG2-CG 4.07Å; G1295-E1298 WeakPolarHBondContact O-CB 3.26Å; G1295-E1298 PolarHBondContact O-N 3.41Å; Q1296-E1298 VanDerWaalsContact C-N 3.32Å; Q1296-E1298 PolarHBondContact O-N 2.83Å; E1298-L1300 VanDerWaalsContact C-N 3.3Å; E1298-L1300 PolarHBondContact O-N 3.13Å; E1298-L1301 PolarHBondContact O-N 2.97Å; E1298-R1302 HydrophobicContact CG-CG 4.36Å; E1298-R1302 VanDerWaalsContact O-CB 3.31Å; E1298-R1302 WeakPolarHBondContact O-CB 3.33Å; E1298-R1302 WeakPolarHBondContact O-CD 3.28Å; E1298-R1302 VanDerWaalsContact O-CG 3.25Å; E1298-R1302 WeakPolarHBondContact O-CG 3.34Å; E1298-R1302 PolarHBondContact O-N 3.33Å; E1298-R1302 IonicContact OE1-CZ 3.06Å; E1298-R1302 VanDerWaalsContact OE1-CZ 3.25Å; E1298-R1302 IonicContact OE1-NE 3.2Å; E1298-R1302 PolarHBondContact OE1-NE 3.08Å; E1298-R1302 VanDerWaalsContact OE1-NE 3.08Å; E1298-R1302 IonicContact OE1-NH2 3.37Å; E1298-R1302 PolarHBondContact OE1-NH2 3.16Å; E1298-S1749 WeakPolarHBondContact OE1-CA 3.31Å; E1298-S1749 VanDerWaalsContact OE2-CA 3.32Å; E1298-S1749 WeakPolarHBondContact OE2-CA 3.44Å; E1298-S1749 WeakPolarHBondContact OE2-CB 3.28Å; E1298-S1749 PolarHBondContact OE2-OG 3.22Å; E1298-L1750 HydrophobicContact CB-CD1 3.88Å; E1298-L1750 HydrophobicContact CB-CG 4.36Å; E1298-L1750 HydrophobicContact CG-CD1 3.84Å; E1298-L1750 HydrophobicContact CG-CG 4.11Å; E1298-L1750 PolarHBondContact OE1-N 3.36Å; E1298-L1750 PolarHBondContact OE2-N 3.11Å
1299	F	82.3	Confident	79.7	Confident	5.4 Å²	5.4	47 Å²	47	2%	0.024	23%	0.229	C	C	.	.	H	α-helix	trans	-63.8	-33.4	176.8	77.6	-76.1	0	0	0	113.7	F1277 Y1280 L1281 T1284 Q1296 L1297 Y1581 R1583	F1277-F1299 HydrophobicContact CB-CD2 4.49Å; F1277-F1299 HydrophobicContact CD2-CD2 4.46Å; F1277-F1299 HydrophobicContact CD2-CE2 4.04Å; F1277-F1299 HydrophobicContact CG-CE2 4.37Å; Y1280-F1299 WeakPolarHBondContact CB-O 3.41Å; L1281-F1299 HydrophobicContact CB-CD2 4.26Å; L1281-F1299 HydrophobicContact CD1-CD1 4.42Å; L1281-F1299 HydrophobicContact CD1-CD2 3.68Å; L1281-F1299 HydrophobicContact CD1-CE1 4.44Å; L1281-F1299 HydrophobicContact CD1-CE2 3.68Å; L1281-F1299 HydrophobicContact CD1-CG 4.07Å; L1281-F1299 HydrophobicContact CD1-CZ 4.08Å; L1281-F1299 HydrophobicContact CD2-CB 4.42Å; L1281-F1299 HydrophobicContact CD2-CD1 4.24Å; L1281-F1299 HydrophobicContact CD2-CD2 3.43Å; L1281-F1299 VanDerWaalsContact CD2-CD2 3.45Å; L1281-F1299 HydrophobicContact CD2-CE1 4.29Å; L1281-F1299 HydrophobicContact CD2-CE2 3.61Å; L1281-F1299 HydrophobicContact CD2-CG 3.77Å; L1281-F1299 HydrophobicContact CD2-CZ 4.11Å; L1281-F1299 HydrophobicContact CG-CD2 3.86Å; L1281-F1299 HydrophobicContact CG-CE2 4.1Å; L1281-F1299 HydrophobicContact CG-CG 4.41Å; T1284-F1299 HydrophobicContact CG2-CB 3.94Å; T1284-F1299 WeakPolarHBondContact OG1-CA 3.43Å; T1284-F1299 WeakPolarHBondContact OG1-CB 3.26Å; Q1296-F1299 WeakPolarHBondContact O-CD1 3.34Å; Q1296-F1299 WeakPolarHBondContact O-CE1 3.31Å; L1297-F1299 HydrophobicContact CD2-CE1 4.47Å; L1297-F1299 PolarHBondContact O-N 3.07Å; L1297-F1299 VanDerWaalsContact O-N 3.1Å; F1299-Y1581 AromaticContact CE2-CD1 3.67Å; F1299-Y1581 HydrophobicContact CE2-CD1 3.99Å; F1299-Y1581 HydrophobicContact CE2-CD2 4.45Å; F1299-Y1581 AromaticContact CE2-CE1 3.84Å; F1299-Y1581 HydrophobicContact CE2-CE1 4.17Å; F1299-Y1581 HydrophobicContact CE2-CG 4.18Å; F1299-Y1581 AromaticContact CZ-CD1 3.66Å; F1299-Y1581 HydrophobicContact CZ-CD1 3.99Å; F1299-Y1581 AromaticContact CZ-CD2 3.7Å; F1299-Y1581 HydrophobicContact CZ-CD2 3.7Å; F1299-Y1581 AromaticContact CZ-CE1 3.77Å; F1299-Y1581 HydrophobicContact CZ-CE1 4.1Å; F1299-Y1581 AromaticContact CZ-CE2 3.81Å; F1299-Y1581 HydrophobicContact CZ-CE2 3.81Å; F1299-Y1581 AromaticContact CZ-CG 3.81Å; F1299-Y1581 HydrophobicContact CZ-CG 3.81Å; F1299-Y1581 AromaticContact CZ-CZ 3.94Å; F1299-R1583 VanDerWaalsContact CE1-CZ 3.46Å; F1299-R1583 VanDerWaalsContact CE1-NH1 3.28Å
1300	L	85.1	Confident	80.2	Confident	1.4 Å²	1.4	46.3 Å²	46.3	1%	0.007	23%	0.226	C	C	.	.	H	α-helix	trans	-84	-39.2	178.3	-138.4	102.7	0	0	0	111	L1297 E1298 R1302 R1303 I1306 V1318 D1356 P1358 Y1581	L1297-L1300 HydrophobicContact CD2-CD1 4.34Å; L1297-L1300 WeakPolarHBondContact O-CB 3.39Å; L1297-L1300 PolarHBondContact O-N 3.24Å; E1298-L1300 VanDerWaalsContact C-N 3.3Å; E1298-L1300 PolarHBondContact O-N 3.13Å; L1300-R1302 VanDerWaalsContact C-N 3.3Å; L1300-R1302 PolarHBondContact O-N 2.93Å; L1300-R1302 VanDerWaalsContact O-N 3.08Å; L1300-R1303 VanDerWaalsContact O-CB 3.25Å; L1300-R1303 WeakPolarHBondContact O-CB 3.27Å; L1300-R1303 WeakPolarHBondContact O-CG 3.48Å; L1300-R1303 PolarHBondContact O-N 3.02Å; L1300-R1303 VanDerWaalsContact O-N 3.14Å; L1300-I1306 WeakPolarHBondContact O-CD1 3.1Å; L1300-V1318 HydrophobicContact CD1-CG1 4.03Å; L1300-V1318 HydrophobicContact CD1-CG2 3.92Å; L1300-V1318 HydrophobicContact CD2-CB 4.34Å; L1300-V1318 HydrophobicContact CD2-CG1 3.67Å; L1300-V1318 HydrophobicContact CD2-CG2 3.64Å; L1300-D1356 HydrophobicContact CD1-CB 3.72Å; L1300-D1356 HydrophobicContact CD2-CB 4.08Å; L1300-P1358 HydrophobicContact CB-CG 4.46Å; L1300-P1358 HydrophobicContact CD2-CG 3.81Å; L1300-P1358 HydrophobicContact CG-CG 3.9Å; L1300-Y1581 HydrophobicContact CD1-CE2 4.24Å
1301	L	83.6	Confident	80.6	Confident	7.6 Å²	7.6	43.9 Å²	43.9	4%	0.04	21%	0.212	C	C	.	.	H	α-helix	trans	-68.7	-19.5	178.7	-67.6	173.9	0	0	0	113.2	Y1294 L1297 E1298 R1303 I1306 V1308 F1311 I1316 P1358 L1750	Y1294-L1301 HydrophobicContact CD2-CD1 3.99Å; Y1294-L1301 HydrophobicContact CE1-CD1 4.43Å; Y1294-L1301 HydrophobicContact CE2-CD1 3.67Å; L1297-L1301 HydrophobicContact CB-CD1 4.02Å; L1297-L1301 HydrophobicContact CB-CG 4.17Å; L1297-L1301 WeakPolarHBondContact O-CG 3.42Å; L1297-L1301 PolarHBondContact O-N 2.99Å; E1298-L1301 PolarHBondContact O-N 2.97Å; L1301-R1303 VanDerWaalsContact C-N 3.31Å; L1301-R1303 PolarHBondContact O-N 3.44Å; L1301-I1306 HydrophobicContact CD2-CG2 4.16Å; L1301-V1308 HydrophobicContact CB-CG1 4.45Å; L1301-V1308 HydrophobicContact CB-CG2 3.97Å; L1301-V1308 HydrophobicContact CD1-CG1 4.37Å; L1301-V1308 HydrophobicContact CD2-CG1 4.42Å; L1301-V1308 HydrophobicContact CD2-CG2 4.41Å; L1301-V1308 VanDerWaalsContact O-CG2 3.24Å; L1301-V1308 WeakPolarHBondContact O-CG2 3.37Å; L1301-F1311 HydrophobicContact CD2-CD2 4.46Å; L1301-F1311 HydrophobicContact CD2-CE2 4.35Å; L1301-I1316 HydrophobicContact CD1-CD1 4.28Å; L1301-I1316 HydrophobicContact CD2-CD1 3.93Å; L1301-P1358 HydrophobicContact CD2-CB 4.15Å; L1301-P1358 HydrophobicContact CD2-CG 4.12Å; L1301-L1750 HydrophobicContact CB-CD1 4.01Å; L1301-L1750 HydrophobicContact CD1-CD1 3.71Å; L1301-L1750 HydrophobicContact CG-CD1 4.46Å
1302	R	74.2	Confident	80.8	Confident	100.8 Å²	100.8	45.1 Å²	45.1	38%	0.38	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-1.3	172	-74.8	171.9	174.8	-132.8	5	114.3	N934 Y1280 T1284 E1298 L1300 D1748	N934-R1302 HydrophobicContact CB-CG 4.48Å; Y1280-R1302 HydrophobicContact CD1-CB 4.19Å; Y1280-R1302 HydrophobicContact CE1-CB 4.39Å; Y1280-R1302 WeakPolarHBondContact CE1-O 3.5Å; T1284-R1302 WeakPolarHBondContact OG1-CD 3.35Å; E1298-R1302 HydrophobicContact CG-CG 4.36Å; E1298-R1302 VanDerWaalsContact O-CB 3.31Å; E1298-R1302 WeakPolarHBondContact O-CB 3.33Å; E1298-R1302 WeakPolarHBondContact O-CD 3.28Å; E1298-R1302 VanDerWaalsContact O-CG 3.25Å; E1298-R1302 WeakPolarHBondContact O-CG 3.34Å; E1298-R1302 PolarHBondContact O-N 3.33Å; E1298-R1302 IonicContact OE1-CZ 3.06Å; E1298-R1302 VanDerWaalsContact OE1-CZ 3.25Å; E1298-R1302 IonicContact OE1-NE 3.2Å; E1298-R1302 PolarHBondContact OE1-NE 3.08Å; E1298-R1302 VanDerWaalsContact OE1-NE 3.08Å; E1298-R1302 IonicContact OE1-NH2 3.37Å; E1298-R1302 PolarHBondContact OE1-NH2 3.16Å; L1300-R1302 VanDerWaalsContact C-N 3.3Å; L1300-R1302 PolarHBondContact O-N 2.93Å; L1300-R1302 VanDerWaalsContact O-N 3.08Å; R1302-D1748 PolarHBondContact NH2-O 3.43Å
1303	R	72	Confident	80.8	Confident	22.4 Å²	22.4	44.8 Å²	44.8	9%	0.085	21%	0.214	C	C	.	.	S	Bend	trans	-66.9	141.6	173.7	-82.9	-176.8	156.7	161.5	-12	111.2	S1274 E1275 F1277 Y1280 L1300 L1301 R1305 I1306 D1356	S1274-R1303 PolarHBondContact OG-NH2 2.93Å; E1275-R1303 PolarHBondContact O-NH2 2.73Å; E1275-R1303 VanDerWaalsContact O-NH2 3.13Å; F1277-R1303 VanDerWaalsContact CA-NH2 3.35Å; F1277-R1303 VanDerWaalsContact CB-NH2 3.32Å; Y1280-R1303 HydrophobicContact CD1-CG 4.16Å; Y1280-R1303 HydrophobicContact CD2-CG 4.15Å; Y1280-R1303 HydrophobicContact CE1-CB 4.45Å; Y1280-R1303 HydrophobicContact CE1-CG 4.08Å; Y1280-R1303 HydrophobicContact CE2-CG 4.12Å; Y1280-R1303 HydrophobicContact CG-CG 4.16Å; L1300-R1303 VanDerWaalsContact O-CB 3.25Å; L1300-R1303 WeakPolarHBondContact O-CB 3.27Å; L1300-R1303 WeakPolarHBondContact O-CG 3.48Å; L1300-R1303 PolarHBondContact O-N 3.02Å; L1300-R1303 VanDerWaalsContact O-N 3.14Å; L1301-R1303 VanDerWaalsContact C-N 3.31Å; L1301-R1303 PolarHBondContact O-N 3.44Å; R1303-R1305 PolarHBondContact O-N 3.08Å; R1303-I1306 HydrophobicContact CB-CD1 3.98Å; R1303-I1306 HydrophobicContact CB-CG1 4.41Å; R1303-I1306 PolarHBondContact O-N 3.03Å; R1303-D1356 IonicContact CZ-OD2 3.05Å; R1303-D1356 IonicContact NH1-OD2 3.39Å; R1303-D1356 PolarHBondContact NH1-OD2 3.09Å; R1303-D1356 IonicContact NH2-OD2 2.66Å
1304	E	61.9	Low	80.5	Confident	113.6 Å²	113.6	47.3 Å²	47.3	53%	0.531	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	130.1	173.7	-59.3	-176.2	170.9	0	0	111.4	R922 F936 Y1280 I1306	R922-E1304 VanDerWaalsContact CZ-CD 3.41Å; R922-E1304 IonicContact CZ-OE1 2.97Å; R922-E1304 IonicContact CZ-OE2 3.73Å; R922-E1304 VanDerWaalsContact CZ-OE2 3.32Å; R922-E1304 IonicContact NE-OE1 3.06Å; R922-E1304 IonicContact NH1-OE1 3.07Å; R922-E1304 PolarHBondContact NH1-OE1 2.82Å; R922-E1304 IonicContact NH1-OE2 3.98Å; R922-E1304 PolarHBondContact NH1-OE2 2.85Å; R922-E1304 IonicContact NH2-OE1 3.45Å; R922-E1304 PolarHBondContact NH2-OE1 2.68Å; R922-E1304 IonicContact NH2-OE2 3.86Å; R922-E1304 PolarHBondContact NH2-OE2 3.45Å; F936-E1304 WeakPolarHBondContact CE1-OE1 3.17Å; F936-E1304 HydrophobicContact CZ-CG 4.3Å; F936-E1304 WeakPolarHBondContact CZ-OE1 3.3Å; Y1280-E1304 PolarHBondContact OH-OE1 2.98Å; E1304-I1306 VanDerWaalsContact C-N 3.31Å
1305	R	76.7	Confident	80.6	Confident	119 Å²	119	47.8 Å²	47.8	45%	0.449	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.6	6	179.2	-49	-160.7	-174.9	-137.1	5.6	116.3	R1303 G1345 Y1346	R1303-R1305 PolarHBondContact O-N 3.08Å; R1305-G1345 CarbonylContact O-C 3.55Å; R1305-G1345 VanDerWaalsContact O-CA 3.23Å; R1305-G1345 WeakPolarHBondContact O-CA 3.3Å; R1305-Y1346 HydrophobicContact CB-CD1 4.2Å; R1305-Y1346 HydrophobicContact CB-CE1 4.18Å; R1305-Y1346 HydrophobicContact CB-CE2 4.46Å; R1305-Y1346 HydrophobicContact CB-CG 4.41Å; R1305-Y1346 WeakPolarHBondContact CB-O 3.34Å; R1305-Y1346 WeakPolarHBondContact CD-OH 2.99Å; R1305-Y1346 HydrophobicContact CG-CD1 4.36Å; R1305-Y1346 HydrophobicContact CG-CE1 4.19Å; R1305-Y1346 HydrophobicContact CG-CE2 4.18Å; R1305-Y1346 PolarHBondContact NE-OH 3.18Å; R1305-Y1346 PolarHBondContact NH1-OH 3.22Å; R1305-Y1346 PolarHBondContact O-N 3.19Å; R1305-Y1346 VanDerWaalsContact O-N 3.17Å
1306	I	82	Confident	81	Confident	20.2 Å²	20.2	47.3 Å²	47.3	10%	0.104	22%	0.218	C	C	.	.	B	Isolated β-bridge	trans	-102.5	133.5	171.2	-59	-100	0	0	0	110.1	L1300 L1301 R1303 E1304 V1308 F1311 L1357 P1358	L1300-I1306 WeakPolarHBondContact O-CD1 3.1Å; L1301-I1306 HydrophobicContact CD2-CG2 4.16Å; R1303-I1306 HydrophobicContact CB-CD1 3.98Å; R1303-I1306 HydrophobicContact CB-CG1 4.41Å; R1303-I1306 PolarHBondContact O-N 3.03Å; E1304-I1306 VanDerWaalsContact C-N 3.31Å; I1306-V1308 HydrophobicContact CG2-CG2 4.49Å; I1306-V1308 PolarHBondContact O-N 2.98Å; I1306-F1311 HydrophobicContact CG2-CE2 3.71Å; I1306-F1311 HydrophobicContact CG2-CZ 4.14Å; I1306-L1357 HydrophobicContact CD1-CD1 4.38Å; I1306-P1358 HydrophobicContact CD1-CG 4.22Å; I1306-P1358 HydrophobicContact CG1-CG 4.48Å; I1306-P1358 HydrophobicContact CG2-CG 4.41Å
1307	V	82.2	Confident	81.5	Confident	56.2 Å²	56.2	45.1 Å²	45.1	34%	0.341	21%	0.208	S	C	.	.			trans	-103.2	89.4	-179.3	-171.4	0	0	0	0	110.1	E1309 N1310 F1311 Q1343 N1344	V1307-E1309 VanDerWaalsContact C-N 3.27Å; V1307-E1309 PolarHBondContact O-N 3.15Å; V1307-E1309 VanDerWaalsContact O-N 3.12Å; V1307-N1310 VanDerWaalsContact CG1-ND2 3.35Å; V1307-N1310 WeakPolarHBondContact CG1-ND2 3.33Å; V1307-N1310 PolarHBondContact O-N 3.14Å; V1307-N1310 VanDerWaalsContact O-N 3.13Å; V1307-F1311 WeakPolarHBondContact O-CD2 3.14Å; V1307-F1311 WeakPolarHBondContact O-CE2 3.34Å; V1307-Q1343 WeakPolarHBondContact CB-O 3.39Å; V1307-Q1343 WeakPolarHBondContact CG2-O 3.37Å; V1307-N1344 PolarHBondContact N-O 2.87Å
1308	V	78.7	Confident	81.8	Confident	37.2 Å²	37.2	45.1 Å²	45.1	23%	0.225	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-58.7	-30.2	-170.8	-174.1	0	0	0	0	113.8	Y1294 L1301 I1306 N1310 L1750	Y1294-V1308 HydrophobicContact CE2-CG1 4.43Å; Y1294-V1308 VanDerWaalsContact OH-CG1 3.3Å; Y1294-V1308 WeakPolarHBondContact OH-CG1 3.33Å; L1301-V1308 HydrophobicContact CB-CG1 4.45Å; L1301-V1308 HydrophobicContact CB-CG2 3.97Å; L1301-V1308 HydrophobicContact CD1-CG1 4.37Å; L1301-V1308 HydrophobicContact CD2-CG1 4.42Å; L1301-V1308 HydrophobicContact CD2-CG2 4.41Å; L1301-V1308 VanDerWaalsContact O-CG2 3.24Å; L1301-V1308 WeakPolarHBondContact O-CG2 3.37Å; I1306-V1308 HydrophobicContact CG2-CG2 4.49Å; I1306-V1308 PolarHBondContact O-N 2.98Å; V1308-N1310 VanDerWaalsContact C-N 3.25Å; V1308-N1310 PolarHBondContact O-N 3.07Å; V1308-L1750 HydrophobicContact CG1-CD1 4.38Å; V1308-L1750 HydrophobicContact CG1-CD2 4.12Å
1309	E	77.8	Confident	82.4	Confident	155.2 Å²	155.2	43.5 Å²	43.5	73%	0.725	20%	0.201	S	C	*	.	G	3₁₀ helix	trans	-68.6	-16	-177.8	-63.3	-175.6	-180	0	0	114.3	V1307 L1744	V1307-E1309 VanDerWaalsContact C-N 3.27Å; V1307-E1309 PolarHBondContact O-N 3.15Å; V1307-E1309 VanDerWaalsContact O-N 3.12Å; E1309-L1744 VanDerWaalsContact OE1-CD2 3.3Å; E1309-L1744 WeakPolarHBondContact OE1-CD2 3.34Å
1310	N	82.5	Confident	83	Confident	74.4 Å²	74.4	44.9 Å²	44.9	40%	0.398	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-92	-12.9	-173.2	-68.7	-20.1	0	0	0	114.7	V1307 V1308 Q1343 N1344	V1307-N1310 VanDerWaalsContact CG1-ND2 3.35Å; V1307-N1310 WeakPolarHBondContact CG1-ND2 3.33Å; V1307-N1310 PolarHBondContact O-N 3.14Å; V1307-N1310 VanDerWaalsContact O-N 3.13Å; V1308-N1310 VanDerWaalsContact C-N 3.25Å; V1308-N1310 PolarHBondContact O-N 3.07Å; N1310-Q1343 PolarHBondContact ND2-O 3.09Å; N1310-N1344 WeakPolarHBondContact CB-OD1 3.36Å
1311	F	84.1	Confident	83.4	Confident	13.8 Å²	13.8	45 Å²	45	6%	0.061	21%	0.207	C	C	.	.	S	Bend	trans	-86.9	148.1	-178.1	-62.3	-83.4	0	0	0	112.6	L1301 I1306 V1307 P1313 I1316 N1344 P1358 D1360	L1301-F1311 HydrophobicContact CD2-CD2 4.46Å; L1301-F1311 HydrophobicContact CD2-CE2 4.35Å; I1306-F1311 HydrophobicContact CG2-CE2 3.71Å; I1306-F1311 HydrophobicContact CG2-CZ 4.14Å; V1307-F1311 WeakPolarHBondContact O-CD2 3.14Å; V1307-F1311 WeakPolarHBondContact O-CE2 3.34Å; F1311-P1313 VanDerWaalsContact O-CD 3.29Å; F1311-P1313 WeakPolarHBondContact O-CD 3.35Å; F1311-I1316 HydrophobicContact CB-CB 4.46Å; F1311-I1316 HydrophobicContact CB-CD1 3.93Å; F1311-I1316 HydrophobicContact CB-CG1 4.39Å; F1311-I1316 HydrophobicContact CD1-CD1 4.1Å; F1311-I1316 HydrophobicContact CD1-CG1 4.19Å; F1311-I1316 HydrophobicContact CD2-CD1 4.34Å; F1311-I1316 HydrophobicContact CG-CD1 3.87Å; F1311-I1316 HydrophobicContact CG-CG1 4.39Å; F1311-N1344 WeakPolarHBondContact CD1-ND2 3.2Å; F1311-N1344 HydrophobicContact CE1-CB 3.9Å; F1311-N1344 VanDerWaalsContact CE1-ND2 3.31Å; F1311-N1344 WeakPolarHBondContact CE1-ND2 3.36Å; F1311-N1344 HydrophobicContact CE2-CB 4.25Å; F1311-N1344 HydrophobicContact CZ-CB 3.67Å; F1311-P1358 HydrophobicContact CE1-CB 4.06Å; F1311-P1358 VanDerWaalsContact CE1-O 3.29Å; F1311-P1358 WeakPolarHBondContact CE1-O 3.41Å; F1311-P1358 HydrophobicContact CE2-CB 4.45Å; F1311-P1358 HydrophobicContact CZ-CB 3.87Å; F1311-P1358 WeakPolarHBondContact CZ-O 3.44Å; F1311-D1360 WeakPolarHBondContact CA-OD1 3.3Å; F1311-D1360 WeakPolarHBondContact CD1-OD2 3.28Å
1312	D	81.8	Confident	83.9	Confident	35.2 Å²	35.2	45.8 Å²	45.8	19%	0.188	21%	0.212	C	C	.	.			trans	-82.5	114	165.4	-179.8	-10	0	0	0	109.8	R1314 R1315 I1316 D1360	D1312-R1314 PolarHBondContact O-N 3.08Å; D1312-R1314 VanDerWaalsContact OD1-CB 3.28Å; D1312-R1314 WeakPolarHBondContact OD1-CB 3.24Å; D1312-R1314 VanDerWaalsContact OD1-CG 3.29Å; D1312-R1314 WeakPolarHBondContact OD1-CG 3.29Å; D1312-R1314 IonicContact OD1-CZ 3.33Å; D1312-R1314 PolarHBondContact OD1-N 3.15Å; D1312-R1314 IonicContact OD1-NE 3.19Å; D1312-R1314 PolarHBondContact OD1-NE 2.93Å; D1312-R1314 VanDerWaalsContact OD1-NE 3.11Å; D1312-R1314 IonicContact OD1-NH2 3.32Å; D1312-R1314 IonicContact OD2-CZ 3.21Å; D1312-R1314 VanDerWaalsContact OD2-CZ 3.26Å; D1312-R1314 IonicContact OD2-NE 3.63Å; D1312-R1314 PolarHBondContact OD2-NE 3.04Å; D1312-R1314 VanDerWaalsContact OD2-NE 3.16Å; D1312-R1314 IonicContact OD2-NH2 3.02Å; D1312-R1314 PolarHBondContact OD2-NH2 3.16Å; D1312-R1315 HydrophobicContact CB-CB 4.13Å; D1312-R1315 HydrophobicContact CB-CG 4.28Å; D1312-R1315 PolarHBondContact O-N 3Å; D1312-R1315 VanDerWaalsContact OD2-CD 3.29Å; D1312-R1315 WeakPolarHBondContact OD2-CD 3.32Å; D1312-R1315 WeakPolarHBondContact OD2-CG 3.2Å; D1312-I1316 PolarHBondContact O-N 3.12Å; D1312-D1360 PolarHBondContact N-OD1 3.07Å
1313	P	81.6	Confident	84.9	Confident	30.2 Å²	30.2	41 Å²	41	20%	0.196	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-13.1	-178.4	-16.3	25	0	0	0	114.9	Y1294 F1311 F1754	Y1294-P1313 WeakPolarHBondContact CB-O 3.39Å; Y1294-P1313 HydrophobicContact CD1-CB 4.01Å; Y1294-P1313 HydrophobicContact CD1-CG 4.4Å; Y1294-P1313 HydrophobicContact CD2-CB 3.86Å; Y1294-P1313 HydrophobicContact CD2-CG 4.07Å; Y1294-P1313 HydrophobicContact CE1-CB 4.37Å; Y1294-P1313 HydrophobicContact CE1-CG 4.23Å; Y1294-P1313 HydrophobicContact CE2-CB 4.22Å; Y1294-P1313 HydrophobicContact CE2-CG 4.23Å; Y1294-P1313 HydrophobicContact CG-CB 3.71Å; Y1294-P1313 HydrophobicContact CG-CG 4.36Å; F1311-P1313 VanDerWaalsContact O-CD 3.29Å; F1311-P1313 WeakPolarHBondContact O-CD 3.35Å; P1313-F1754 HydrophobicContact CB-CB 4.29Å; P1313-F1754 HydrophobicContact CB-CD2 3.53Å; P1313-F1754 HydrophobicContact CB-CE2 3.59Å; P1313-F1754 HydrophobicContact CB-CG 4.38Å; P1313-F1754 HydrophobicContact CG-CD2 4.25Å; P1313-F1754 WeakPolarHBondContact O-CE2 3.47Å
1314	R	81.5	Confident	85.8	Confident	82.4 Å²	82.4	42.7 Å²	42.7	31%	0.311	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-20.1	175.8	-53.5	170.2	-62.6	163.7	4.8	113.1	D1312 V1387 N1388 T1718 F1754 N1761 F2116	D1312-R1314 PolarHBondContact O-N 3.08Å; D1312-R1314 VanDerWaalsContact OD1-CB 3.28Å; D1312-R1314 WeakPolarHBondContact OD1-CB 3.24Å; D1312-R1314 VanDerWaalsContact OD1-CG 3.29Å; D1312-R1314 WeakPolarHBondContact OD1-CG 3.29Å; D1312-R1314 IonicContact OD1-CZ 3.33Å; D1312-R1314 PolarHBondContact OD1-N 3.15Å; D1312-R1314 IonicContact OD1-NE 3.19Å; D1312-R1314 PolarHBondContact OD1-NE 2.93Å; D1312-R1314 VanDerWaalsContact OD1-NE 3.11Å; D1312-R1314 IonicContact OD1-NH2 3.32Å; D1312-R1314 IonicContact OD2-CZ 3.21Å; D1312-R1314 VanDerWaalsContact OD2-CZ 3.26Å; D1312-R1314 IonicContact OD2-NE 3.63Å; D1312-R1314 PolarHBondContact OD2-NE 3.04Å; D1312-R1314 VanDerWaalsContact OD2-NE 3.16Å; D1312-R1314 IonicContact OD2-NH2 3.02Å; D1312-R1314 PolarHBondContact OD2-NH2 3.16Å; R1314-V1387 WeakPolarHBondContact O-CG1 3.46Å; R1314-N1388 PolarHBondContact O-ND2 3.27Å; R1314-N1388 PolarHBondContact O-OD1 3.35Å; R1314-T1718 PolarHBondContact NH1-OG1 3.33Å; R1314-T1718 VanDerWaalsContact NH1-OG1 3.1Å; R1314-F1754 HydrophobicContact CB-CE2 4.17Å; R1314-F1754 HydrophobicContact CG-CD2 4.41Å; R1314-F1754 HydrophobicContact CG-CE2 3.81Å; R1314-N1761 PolarHBondContact NH1-ND2 3.2Å; R1314-F2116 HydrophobicContact CB-CE1 3.99Å; R1314-F2116 HydrophobicContact CB-CZ 4.43Å
1315	R	87.3	Confident	87	Confident	39 Å²	39	37.3 Å²	37.3	15%	0.147	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.9	-22.1	-174	-66.4	177.8	57.4	-155.2	-7.6	113.1	D1312 S1317 D1360 G1361 T1363 V1387 S1700 F2116	D1312-R1315 HydrophobicContact CB-CB 4.13Å; D1312-R1315 HydrophobicContact CB-CG 4.28Å; D1312-R1315 PolarHBondContact O-N 3Å; D1312-R1315 VanDerWaalsContact OD2-CD 3.29Å; D1312-R1315 WeakPolarHBondContact OD2-CD 3.32Å; D1312-R1315 WeakPolarHBondContact OD2-CG 3.2Å; R1315-S1317 PolarHBondContact O-N 2.96Å; R1315-S1317 PolarHBondContact O-OG 2.7Å; R1315-S1317 VanDerWaalsContact O-OG 3.05Å; R1315-D1360 PolarHBondContact NH2-O 3.02Å; R1315-G1361 VanDerWaalsContact CZ-O 3.3Å; R1315-G1361 PolarHBondContact NE-O 2.92Å; R1315-G1361 PolarHBondContact NH2-O 3.27Å; R1315-G1361 VanDerWaalsContact O-CA 3.26Å; R1315-G1361 WeakPolarHBondContact O-CA 3.37Å; R1315-G1361 PolarHBondContact O-N 3.17Å; R1315-T1363 VanDerWaalsContact NH2-CG2 3.3Å; R1315-V1387 HydrophobicContact CB-CG1 4.01Å; R1315-V1387 HydrophobicContact CB-CG2 4.47Å; R1315-V1387 HydrophobicContact CG-CG1 4.12Å; R1315-V1387 HydrophobicContact CG-CG2 4.41Å; R1315-S1700 PolarHBondContact NE-O 3.12Å; R1315-S1700 PolarHBondContact NH2-O 3.11Å; R1315-S1700 VanDerWaalsContact NH2-O 3.15Å; R1315-F2116 HydrophobicContact CG-CE1 4.29Å; R1315-F2116 HydrophobicContact CG-CZ 3.9Å
1316	I	91.1	Very high	87.2	Confident	0 Å²	0	35 Å²	35	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-48.4	137.3	-175.1	-161	168.7	0	0	0	112.4	F1293 Y1294 L1297 L1301 F1311 D1312 P1358 V1359 N1388	F1293-I1316 HydrophobicContact CD1-CG2 4.16Å; F1293-I1316 WeakPolarHBondContact CD1-O 3.31Å; F1293-I1316 HydrophobicContact CE1-CG2 4.43Å; F1293-I1316 VanDerWaalsContact CE1-O 3.27Å; F1293-I1316 WeakPolarHBondContact CE1-O 3.35Å; Y1294-I1316 HydrophobicContact CD2-CB 4.4Å; Y1294-I1316 HydrophobicContact CD2-CD1 3.89Å; Y1294-I1316 HydrophobicContact CD2-CG2 3.86Å; Y1294-I1316 HydrophobicContact CE2-CD1 4.19Å; Y1294-I1316 HydrophobicContact CG-CG2 4.34Å; L1297-I1316 HydrophobicContact CD1-CD1 4.15Å; L1297-I1316 HydrophobicContact CD1-CG1 4.11Å; L1297-I1316 HydrophobicContact CD1-CG2 4.1Å; L1301-I1316 HydrophobicContact CD1-CD1 4.28Å; L1301-I1316 HydrophobicContact CD2-CD1 3.93Å; F1311-I1316 HydrophobicContact CB-CB 4.46Å; F1311-I1316 HydrophobicContact CB-CD1 3.93Å; F1311-I1316 HydrophobicContact CB-CG1 4.39Å; F1311-I1316 HydrophobicContact CD1-CD1 4.1Å; F1311-I1316 HydrophobicContact CD1-CG1 4.19Å; F1311-I1316 HydrophobicContact CD2-CD1 4.34Å; F1311-I1316 HydrophobicContact CG-CD1 3.87Å; F1311-I1316 HydrophobicContact CG-CG1 4.39Å; D1312-I1316 PolarHBondContact O-N 3.12Å; I1316-P1358 HydrophobicContact CD1-CB 4.3Å; I1316-P1358 HydrophobicContact CG1-CB 4.4Å; I1316-V1359 CarbonylContact C-O 3.53Å; I1316-V1359 WeakPolarHBondContact CA-O 3.29Å; I1316-N1388 VanDerWaalsContact O-CA 3.29Å; I1316-N1388 WeakPolarHBondContact O-CA 3.32Å; I1316-N1388 PolarHBondContact O-N 3.24Å; I1316-N1388 VanDerWaalsContact O-N 3.17Å; I1316-N1388 PolarHBondContact O-OD1 3.08Å
1317	S	94.4	Very high	87.1	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	168.3	-178.1	-67	0	0	0	0	108.6	R1315 P1358 V1359 V1385 P1386 V1387 N1388 Q1389	R1315-S1317 PolarHBondContact O-N 2.96Å; R1315-S1317 PolarHBondContact O-OG 2.7Å; R1315-S1317 VanDerWaalsContact O-OG 3.05Å; S1317-P1358 CarbonylContact O-C 3.32Å; S1317-P1358 VanDerWaalsContact O-CA 3.31Å; S1317-P1358 WeakPolarHBondContact O-CA 3.19Å; S1317-V1359 PolarHBondContact N-O 2.91Å; S1317-V1359 PolarHBondContact O-N 3.12Å; S1317-V1385 VanDerWaalsContact CB-CG1 3.45Å; S1317-P1386 WeakPolarHBondContact CB-O 3.28Å; S1317-P1386 PolarHBondContact OG-O 3.23Å; S1317-V1387 WeakPolarHBondContact OG-CA 3.36Å; S1317-N1388 PolarHBondContact OG-N 3.11Å; S1317-Q1389 WeakPolarHBondContact CA-O 3.27Å; S1317-Q1389 VanDerWaalsContact CB-O 3.26Å; S1317-Q1389 WeakPolarHBondContact CB-O 3.35Å; S1317-Q1389 PolarHBondContact OG-N 3.16Å; S1317-Q1389 VanDerWaalsContact OG-N 3.11Å; S1317-Q1389 PolarHBondContact OG-O 2.77Å
1318	V	95.1	Very high	87.2	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	127.3	177.5	-176.5	0	0	0	0	109.7	L1297 L1300 D1356 L1357 Q1389 I1390 I1391 Y1581	L1297-V1318 HydrophobicContact CD1-CG2 3.59Å; L1297-V1318 HydrophobicContact CD2-CG2 3.63Å; L1297-V1318 HydrophobicContact CG-CG2 4.26Å; L1300-V1318 HydrophobicContact CD1-CG1 4.03Å; L1300-V1318 HydrophobicContact CD1-CG2 3.92Å; L1300-V1318 HydrophobicContact CD2-CB 4.34Å; L1300-V1318 HydrophobicContact CD2-CG1 3.67Å; L1300-V1318 HydrophobicContact CD2-CG2 3.64Å; V1318-D1356 HydrophobicContact CG1-CB 4.25Å; V1318-L1357 WeakPolarHBondContact CA-O 3.22Å; V1318-Q1389 PolarHBondContact N-O 3.2Å; V1318-I1390 HydrophobicContact CB-CG1 4.39Å; V1318-I1390 HydrophobicContact CB-CG2 4.33Å; V1318-I1390 HydrophobicContact CG1-CG2 4.46Å; V1318-I1390 CarbonylContact O-C 3.31Å; V1318-I1390 WeakPolarHBondContact O-CA 3.28Å; V1318-I1391 PolarHBondContact O-N 2.94Å; V1318-Y1581 WeakPolarHBondContact CG1-OH 3.45Å
1319	V	95.5	Very high	87.7	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	130.4	165.2	-179.3	0	0	0	0	108.4	F1355 D1356 L1357 V1359 L1367 L1383 V1385 M1393	V1319-F1355 HydrophobicContact CB-CE2 4.46Å; V1319-F1355 HydrophobicContact CG1-CE2 3.97Å; V1319-F1355 HydrophobicContact CG1-CZ 4.09Å; V1319-D1356 CarbonylContact O-C 3.53Å; V1319-D1356 WeakPolarHBondContact O-CA 3.27Å; V1319-L1357 PolarHBondContact N-O 3Å; V1319-L1357 PolarHBondContact O-N 3.1Å; V1319-V1359 HydrophobicContact CG2-CG1 4.39Å; V1319-V1359 HydrophobicContact CG2-CG2 3.92Å; V1319-L1367 HydrophobicContact CB-CD2 4.5Å; V1319-L1367 HydrophobicContact CG1-CD1 3.97Å; V1319-L1367 HydrophobicContact CG1-CD2 4.4Å; V1319-L1367 HydrophobicContact CG2-CD2 4.5Å; V1319-L1383 HydrophobicContact CB-CD2 4.46Å; V1319-L1383 HydrophobicContact CG1-CD2 3.65Å; V1319-L1383 HydrophobicContact CG2-CD2 3.95Å; V1319-V1385 HydrophobicContact CG2-CG1 4.38Å; V1319-V1385 HydrophobicContact CG2-CG2 3.56Å; V1319-M1393 HydrophobicContact CG1-SD 4.05Å
1320	R	94.1	Very high	88.3	Confident	33.8 Å²	33.8	24.8 Å²	24.8	13%	0.128	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	147.9	170.7	74	177.2	-76.3	169.4	-10.5	110.9	F1355 D1356 I1390 I1391 N1392 M1393 G1556 G1580 Y1581	R1320-F1355 VanDerWaalsContact CA-O 3.23Å; R1320-F1355 WeakPolarHBondContact CA-O 3.25Å; R1320-F1355 VanDerWaalsContact CB-O 3.29Å; R1320-F1355 WeakPolarHBondContact CB-O 3.17Å; R1320-D1356 HydrophobicContact CB-CB 4.45Å; R1320-D1356 WeakPolarHBondContact CB-OD1 3.23Å; R1320-D1356 IonicContact CZ-OD1 3.33Å; R1320-D1356 VanDerWaalsContact CZ-OD1 3.26Å; R1320-D1356 IonicContact CZ-OD2 3.01Å; R1320-D1356 IonicContact NE-OD1 3.43Å; R1320-D1356 PolarHBondContact NE-OD1 3.07Å; R1320-D1356 IonicContact NE-OD2 3.16Å; R1320-D1356 IonicContact NH1-OD1 3Å; R1320-D1356 VanDerWaalsContact NH2-CG 3.34Å; R1320-D1356 IonicContact NH2-OD1 3.03Å; R1320-D1356 PolarHBondContact NH2-OD1 3.47Å; R1320-D1356 IonicContact NH2-OD2 2.95Å; R1320-D1356 PolarHBondContact NH2-OD2 2.76Å; R1320-I1390 HydrophobicContact CG-CG2 4.19Å; R1320-I1391 VanDerWaalsContact CG-O 3.25Å; R1320-I1391 WeakPolarHBondContact CG-O 3.42Å; R1320-I1391 PolarHBondContact N-O 3.01Å; R1320-N1392 HydrophobicContact CG-CB 4.16Å; R1320-N1392 CarbonylContact O-C 3.56Å; R1320-N1392 WeakPolarHBondContact O-CA 3.36Å; R1320-M1393 PolarHBondContact O-N 2.94Å; R1320-G1556 WeakPolarHBondContact CD-O 3.31Å; R1320-G1556 PolarHBondContact NE-O 3.01Å; R1320-G1580 PolarHBondContact NH1-O 3.12Å; R1320-G1580 PolarHBondContact NH2-O 3.13Å; R1320-Y1581 VanDerWaalsContact NH1-CE1 3.31Å; R1320-Y1581 VanDerWaalsContact NH1-CZ 3.31Å
1321	G	93.7	Very high	88.7	Confident	4 Å²	4	21.3 Å²	21.3	4%	0.041	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167	-175.8	178.7	0	0	0	0	0	111.8	R1354 F1355 G1394	G1321-R1354 VanDerWaalsContact O-CA 3.3Å; G1321-R1354 WeakPolarHBondContact O-CA 3.36Å; G1321-F1355 VanDerWaalsContact CA-CE1 3.45Å; G1321-F1355 PolarHBondContact N-O 3.02Å; G1321-F1355 WeakPolarHBondContact O-CD1 3.18Å; G1321-F1355 PolarHBondContact O-N 3.06Å; G1321-F1355 VanDerWaalsContact O-N 3.07Å; G1321-G1394 CarbonylContact C-O 3.56Å; G1321-G1394 VanDerWaalsContact CA-O 3.27Å; G1321-G1394 WeakPolarHBondContact CA-O 3.29Å
1322	V	94.1	Very high	88.9	Confident	23.6 Å²	23.6	21.6 Å²	21.6	14%	0.143	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	128.6	172.7	-172.6	0	0	0	0	107.7	R1324 V1330 S1352 G1353 R1354 G1394 D1395 F1396	V1322-R1324 HydrophobicContact CG1-CG 4.24Å; V1322-V1330 HydrophobicContact CG1-CG1 4.42Å; V1322-S1352 WeakPolarHBondContact CG1-O 3.24Å; V1322-G1353 CarbonylContact C-O 3.3Å; V1322-G1353 VanDerWaalsContact CA-O 3.31Å; V1322-G1353 WeakPolarHBondContact CA-O 3.39Å; V1322-R1354 HydrophobicContact CG2-CG 4.2Å; V1322-G1394 PolarHBondContact N-O 3.32Å; V1322-D1395 HydrophobicContact CB-CB 4.37Å; V1322-D1395 WeakPolarHBondContact CB-OD1 3.15Å; V1322-D1395 WeakPolarHBondContact CG2-OD1 3.09Å; V1322-D1395 CarbonylContact O-C 3.44Å; V1322-D1395 WeakPolarHBondContact O-CA 3.26Å; V1322-F1396 PolarHBondContact O-N 3.07Å
1323	I	94.3	Very high	89	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	131.9	171.4	-47.8	-55.7	0	0	0	109.1	F1331 C1334 V1336 T1349 G1353 F1355 F1369 M1393 F1396 M1398	I1323-F1331 HydrophobicContact CB-CB 4.3Å; I1323-F1331 HydrophobicContact CG2-CB 4.01Å; I1323-F1331 HydrophobicContact CG2-CD2 3.99Å; I1323-F1331 HydrophobicContact CG2-CG 4.44Å; I1323-F1331 PolarHBondContact O-N 2.9Å; I1323-C1334 HydrophobicContact CB-CB 4.35Å; I1323-C1334 HydrophobicContact CG1-CB 4.36Å; I1323-C1334 HydrophobicContact CG2-CB 4.22Å; I1323-V1336 HydrophobicContact CG1-CG2 4.43Å; I1323-T1349 HydrophobicContact CB-CG2 4.04Å; I1323-T1349 HydrophobicContact CG1-CG2 3.62Å; I1323-G1353 PolarHBondContact N-O 3.06Å; I1323-F1355 HydrophobicContact CD1-CD1 3.92Å; I1323-F1355 HydrophobicContact CD1-CE1 3.61Å; I1323-F1355 HydrophobicContact CG1-CD1 3.98Å; I1323-F1355 HydrophobicContact CG1-CE1 4.21Å; I1323-F1369 HydrophobicContact CD1-CD1 3.49Å; I1323-F1369 VanDerWaalsContact CD1-CD1 3.45Å; I1323-F1369 HydrophobicContact CD1-CE1 3.47Å; I1323-F1369 VanDerWaalsContact CD1-CE1 3.47Å; I1323-F1369 HydrophobicContact CD1-CG 4.36Å; I1323-F1369 HydrophobicContact CD1-CZ 4.3Å; I1323-F1369 HydrophobicContact CG1-CD1 4.25Å; I1323-F1369 HydrophobicContact CG1-CE1 4.49Å; I1323-M1393 HydrophobicContact CD1-CE 4.07Å; I1323-F1396 WeakPolarHBondContact CA-O 2.99Å; I1323-F1396 HydrophobicContact CD1-CB 4.1Å; I1323-F1396 HydrophobicContact CD1-CD1 4.35Å; I1323-F1396 HydrophobicContact CD1-CG 4.47Å; I1323-M1398 HydrophobicContact CG2-CG 3.98Å; I1323-M1398 HydrophobicContact CG2-SD 3.58Å; I1323-M1398 VanDerWaalsContact CG2-SD 3.57Å
1324	R	91.8	Very high	89.5	Confident	59.6 Å²	59.6	19 Å²	19	23%	0.225	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	162.9	176.2	-62.4	-178.1	-176.4	-82.3	-3.5	110.9	V1322 G1328 T1329 V1330 D1395 F1396 Y1397 M1398	V1322-R1324 HydrophobicContact CG1-CG 4.24Å; R1324-G1328 WeakPolarHBondContact CD-O 3.39Å; R1324-G1328 PolarHBondContact NH1-O 3.14Å; R1324-T1329 CarbonylContact C-O 3.36Å; R1324-T1329 WeakPolarHBondContact CA-O 3.24Å; R1324-T1329 VanDerWaalsContact CB-O 3.31Å; R1324-T1329 WeakPolarHBondContact CB-O 3.29Å; R1324-V1330 HydrophobicContact CG-CG1 4.48Å; R1324-D1395 IonicContact CZ-OD2 3.46Å; R1324-D1395 VanDerWaalsContact CZ-OD2 3.23Å; R1324-D1395 VanDerWaalsContact NE-CG 3.34Å; R1324-D1395 IonicContact NE-OD2 3.24Å; R1324-D1395 PolarHBondContact NE-OD2 3.09Å; R1324-D1395 IonicContact NH2-OD2 3.27Å; R1324-D1395 PolarHBondContact NH2-OD2 2.99Å; R1324-F1396 PolarHBondContact N-O 3.04Å; R1324-Y1397 HydrophobicContact CB-CD1 4.17Å; R1324-Y1397 HydrophobicContact CB-CE1 4.35Å; R1324-Y1397 CarbonylContact O-C 3.45Å; R1324-Y1397 WeakPolarHBondContact O-CA 3.31Å; R1324-M1398 PolarHBondContact O-N 3Å
1325	Q	87.4	Confident	89.9	Confident	0 Å²	0	17.8 Å²	17.8	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	165.4	157.5	-174.2	161.8	-69.5	0	0	110.7	D1233 D1327 G1328 T1329 F1331 F1377 Y1397 M1398	D1233-Q1325 PolarHBondContact OD2-NE2 3.18Å; D1233-Q1325 PolarHBondContact OD2-OE1 2.8Å; Q1325-D1327 VanDerWaalsContact CB-OD1 3.23Å; Q1325-D1327 WeakPolarHBondContact CB-OD1 3.44Å; Q1325-D1327 WeakPolarHBondContact CB-OD2 3.48Å; Q1325-D1327 VanDerWaalsContact CG-OD1 3.28Å; Q1325-D1327 WeakPolarHBondContact CG-OD1 3.31Å; Q1325-D1327 WeakPolarHBondContact CG-OD2 3.02Å; Q1325-D1327 PolarHBondContact NE2-OD1 3.4Å; Q1325-D1327 PolarHBondContact NE2-OD2 3.22Å; Q1325-D1327 VanDerWaalsContact NE2-OD2 3.09Å; Q1325-D1327 PolarHBondContact O-N 3.08Å; Q1325-D1327 VanDerWaalsContact O-N 3.14Å; Q1325-G1328 PolarHBondContact O-N 3.11Å; Q1325-G1328 VanDerWaalsContact O-N 3.08Å; Q1325-T1329 WeakPolarHBondContact CB-OG1 3.26Å; Q1325-T1329 PolarHBondContact N-O 2.97Å; Q1325-F1331 HydrophobicContact CB-CD1 4.22Å; Q1325-F1331 HydrophobicContact CB-CE1 3.64Å; Q1325-F1331 HydrophobicContact CB-CE2 4.41Å; Q1325-F1331 HydrophobicContact CB-CZ 3.86Å; Q1325-F1331 HydrophobicContact CG-CE1 4.26Å; Q1325-F1331 HydrophobicContact CG-CZ 4.22Å; Q1325-F1331 VanDerWaalsContact OE1-CE1 3.25Å; Q1325-F1377 HydrophobicContact CG-CE1 4.49Å; Q1325-F1377 VanDerWaalsContact OE1-CZ 3.23Å; Q1325-Y1397 VanDerWaalsContact O-CD1 3.29Å; Q1325-Y1397 WeakPolarHBondContact O-CD1 3.4Å; Q1325-M1398 CarbonylContact C-O 3.44Å; Q1325-M1398 WeakPolarHBondContact CA-O 3.42Å
1326	W	81	Confident	90.2	Very high	69.8 Å²	69.8	16 Å²	16	26%	0.264	8%	0.075	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-28.5	-177.5	66.1	-89.5	0	0	0	114.8	G1328 M1398 Y1399 T1442 I1443	W1326-G1328 PolarHBondContact O-N 3Å; W1326-M1398 PolarHBondContact N-O 3.13Å; W1326-Y1399 HydrophobicContact CB-CD1 3.53Å; W1326-Y1399 VanDerWaalsContact CB-CD1 3.44Å; W1326-Y1399 HydrophobicContact CB-CE1 3.82Å; W1326-Y1399 HydrophobicContact CB-CG 4.4Å; W1326-Y1399 HydrophobicContact CG-CD1 4.31Å; W1326-T1442 HydrophobicContact CB-CG2 4.37Å; W1326-T1442 WeakPolarHBondContact O-CB 3.17Å; W1326-T1442 WeakPolarHBondContact O-CG2 3.29Å; W1326-T1442 PolarHBondContact O-OG1 3.5Å; W1326-I1443 HydrophobicContact CE3-CG1 4.17Å; W1326-I1443 HydrophobicContact CE3-CG2 3.8Å; W1326-I1443 HydrophobicContact CZ3-CB 4.37Å; W1326-I1443 HydrophobicContact CZ3-CG1 4.15Å; W1326-I1443 HydrophobicContact CZ3-CG2 3.82Å; W1326-I1443 WeakPolarHBondContact O-CG2 3.33Å
1327	D	79.6	Confident	90.1	Very high	9.4 Å²	9.4	16 Å²	16	5%	0.05	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-14	177.5	63.5	3.6	0	0	0	114.2	R1218 Q1325 T1329 I1443	R1218-D1327 VanDerWaalsContact CD-CG 3.5Å; R1218-D1327 WeakPolarHBondContact CD-O 3.33Å; R1218-D1327 WeakPolarHBondContact CD-OD1 3.09Å; R1218-D1327 WeakPolarHBondContact CD-OD2 3.42Å; R1218-D1327 HydrophobicContact CG-CB 4.24Å; R1218-D1327 IonicContact CZ-OD1 3.3Å; R1218-D1327 IonicContact NE-OD1 2.72Å; R1218-D1327 IonicContact NH1-OD1 3.02Å; R1218-D1327 PolarHBondContact NH1-OD1 2.92Å; R1218-D1327 IonicContact NH1-OD2 2.87Å; Q1325-D1327 VanDerWaalsContact CB-OD1 3.23Å; Q1325-D1327 WeakPolarHBondContact CB-OD1 3.44Å; Q1325-D1327 WeakPolarHBondContact CB-OD2 3.48Å; Q1325-D1327 VanDerWaalsContact CG-OD1 3.28Å; Q1325-D1327 WeakPolarHBondContact CG-OD1 3.31Å; Q1325-D1327 WeakPolarHBondContact CG-OD2 3.02Å; Q1325-D1327 PolarHBondContact NE2-OD1 3.4Å; Q1325-D1327 PolarHBondContact NE2-OD2 3.22Å; Q1325-D1327 VanDerWaalsContact NE2-OD2 3.09Å; Q1325-D1327 PolarHBondContact O-N 3.08Å; Q1325-D1327 VanDerWaalsContact O-N 3.14Å; D1327-T1329 VanDerWaalsContact CG-OG1 3.27Å; D1327-T1329 VanDerWaalsContact OD1-CB 3.3Å; D1327-T1329 WeakPolarHBondContact OD1-CB 3.26Å; D1327-T1329 WeakPolarHBondContact OD1-CG2 3.43Å; D1327-T1329 PolarHBondContact OD1-N 2.97Å; D1327-T1329 VanDerWaalsContact OD1-N 3.14Å; D1327-T1329 PolarHBondContact OD1-OG1 3.14Å; D1327-T1329 VanDerWaalsContact OD1-OG1 3.08Å; D1327-T1329 PolarHBondContact OD2-OG1 2.71Å; D1327-I1443 HydrophobicContact CB-CG1 4.39Å; D1327-I1443 WeakPolarHBondContact O-CD1 3.24Å
1328	G	84.1	Confident	89.9	Confident	9.8 Å²	9.8	16.4 Å²	16.4	10%	0.101	8%	0.077	C	C	.	.	S	Bend	trans	108.2	-5	-176.7	0	0	0	0	0	116.3	R1324 Q1325 W1326 V1330	R1324-G1328 WeakPolarHBondContact CD-O 3.39Å; R1324-G1328 PolarHBondContact NH1-O 3.14Å; Q1325-G1328 PolarHBondContact O-N 3.11Å; Q1325-G1328 VanDerWaalsContact O-N 3.08Å; W1326-G1328 PolarHBondContact O-N 3Å; G1328-V1330 PolarHBondContact O-N 3.32Å
1329	T	88.5	Confident	89.5	Confident	1 Å²	1	20.9 Å²	20.9	1%	0.006	9%	0.094	C	C	.	.			trans	-58.1	135.7	177	-38.9	0	0	0	0	110.7	R1218 P1241 R1324 Q1325 D1327 F1331	R1218-T1329 VanDerWaalsContact CD-OG1 3.3Å; R1218-T1329 WeakPolarHBondContact CD-OG1 3.21Å; R1218-T1329 VanDerWaalsContact CZ-OG1 3.25Å; R1218-T1329 PolarHBondContact NE-OG1 2.81Å; R1218-T1329 VanDerWaalsContact NH1-CA 3.29Å; R1218-T1329 PolarHBondContact NH1-OG1 2.93Å; P1241-T1329 HydrophobicContact CB-CG2 3.88Å; P1241-T1329 HydrophobicContact CG-CG2 3.92Å; R1324-T1329 CarbonylContact C-O 3.36Å; R1324-T1329 WeakPolarHBondContact CA-O 3.24Å; R1324-T1329 VanDerWaalsContact CB-O 3.31Å; R1324-T1329 WeakPolarHBondContact CB-O 3.29Å; Q1325-T1329 WeakPolarHBondContact CB-OG1 3.26Å; Q1325-T1329 PolarHBondContact N-O 2.97Å; D1327-T1329 VanDerWaalsContact CG-OG1 3.27Å; D1327-T1329 VanDerWaalsContact OD1-CB 3.3Å; D1327-T1329 WeakPolarHBondContact OD1-CB 3.26Å; D1327-T1329 WeakPolarHBondContact OD1-CG2 3.43Å; D1327-T1329 PolarHBondContact OD1-N 2.97Å; D1327-T1329 VanDerWaalsContact OD1-N 3.14Å; D1327-T1329 PolarHBondContact OD1-OG1 3.14Å; D1327-T1329 VanDerWaalsContact OD1-OG1 3.08Å; D1327-T1329 PolarHBondContact OD2-OG1 2.71Å; T1329-F1331 PolarHBondContact O-N 3.09Å
1330	V	91.2	Very high	88.7	Confident	35 Å²	35	22.7 Å²	22.7	21%	0.212	11%	0.109	C	C	.	.	B	Isolated β-bridge	trans	-80.1	125.8	-178.8	-71.9	0	0	0	0	110.8	P1241 V1322 R1324 G1328 W1332	P1241-V1330 VanDerWaalsContact CB-O 3.22Å; P1241-V1330 WeakPolarHBondContact CB-O 3.41Å; V1322-V1330 HydrophobicContact CG1-CG1 4.42Å; R1324-V1330 HydrophobicContact CG-CG1 4.48Å; G1328-V1330 PolarHBondContact O-N 3.32Å; V1330-W1332 PolarHBondContact O-N 3.01Å; V1330-W1332 VanDerWaalsContact O-N 3.11Å
1331	F	90.4	Very high	88.1	Confident	0.2 Å²	0.2	23.3 Å²	23.3	0%	0.001	11%	0.114	C	C	.	.			trans	-83.2	108.1	179.7	-88.3	-1.6	0	0	0	111.9	P1241 I1323 Q1325 T1329 C1334 T1349 G1353 R1371 F1377 M1398	P1241-F1331 HydrophobicContact CB-CD1 4.45Å; P1241-F1331 HydrophobicContact CG-CD1 3.56Å; P1241-F1331 HydrophobicContact CG-CE1 3.8Å; I1323-F1331 HydrophobicContact CB-CB 4.3Å; I1323-F1331 HydrophobicContact CG2-CB 4.01Å; I1323-F1331 HydrophobicContact CG2-CD2 3.99Å; I1323-F1331 HydrophobicContact CG2-CG 4.44Å; I1323-F1331 PolarHBondContact O-N 2.9Å; Q1325-F1331 HydrophobicContact CB-CD1 4.22Å; Q1325-F1331 HydrophobicContact CB-CE1 3.64Å; Q1325-F1331 HydrophobicContact CB-CE2 4.41Å; Q1325-F1331 HydrophobicContact CB-CZ 3.86Å; Q1325-F1331 HydrophobicContact CG-CE1 4.26Å; Q1325-F1331 HydrophobicContact CG-CZ 4.22Å; Q1325-F1331 VanDerWaalsContact OE1-CE1 3.25Å; T1329-F1331 PolarHBondContact O-N 3.09Å; F1331-C1334 HydrophobicContact CB-CB 4.25Å; F1331-T1349 WeakPolarHBondContact O-CB 3.32Å; F1331-T1349 PolarHBondContact O-OG1 3.04Å; F1331-G1353 VanDerWaalsContact O-CA 3.3Å; F1331-G1353 WeakPolarHBondContact O-CA 3.46Å; F1331-R1371 HydrophobicContact CD2-CB 4.11Å; F1331-R1371 HydrophobicContact CD2-CG 4.04Å; F1331-R1371 HydrophobicContact CE2-CB 4.22Å; F1331-R1371 HydrophobicContact CE2-CG 4.11Å; F1331-R1371 HydrophobicContact CG-CG 4.32Å; F1331-R1371 HydrophobicContact CZ-CG 4.41Å; F1331-F1377 HydrophobicContact CE2-CB 4.16Å; F1331-F1377 AromaticContact CE2-CD1 3.78Å; F1331-F1377 HydrophobicContact CE2-CD1 3.83Å; F1331-F1377 HydrophobicContact CE2-CE1 4.4Å; F1331-F1377 AromaticContact CE2-CG 3.94Å; F1331-F1377 HydrophobicContact CE2-CG 3.98Å; F1331-F1377 HydrophobicContact CZ-CB 4.48Å; F1331-F1377 AromaticContact CZ-CD1 3.64Å; F1331-F1377 HydrophobicContact CZ-CD1 3.64Å; F1331-F1377 HydrophobicContact CZ-CD2 4.34Å; F1331-F1377 AromaticContact CZ-CE1 3.81Å; F1331-F1377 HydrophobicContact CZ-CE1 3.81Å; F1331-F1377 HydrophobicContact CZ-CE2 4.32Å; F1331-F1377 AromaticContact CZ-CG 3.91Å; F1331-F1377 HydrophobicContact CZ-CG 3.91Å; F1331-F1377 HydrophobicContact CZ-CZ 4.24Å; F1331-M1398 HydrophobicContact CD2-CB 4.37Å; F1331-M1398 HydrophobicContact CD2-CG 4.45Å; F1331-M1398 HydrophobicContact CD2-SD 3.77Å; F1331-M1398 HydrophobicContact CE2-CB 3.85Å; F1331-M1398 HydrophobicContact CE2-CE 4.49Å; F1331-M1398 HydrophobicContact CE2-CG 4.38Å; F1331-M1398 HydrophobicContact CE2-SD 3.9Å
1332	W	89.1	Confident	87.5	Confident	21.6 Å²	21.6	26.8 Å²	26.8	8%	0.082	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	142.7	166.1	-64.9	49.8	0	0	0	109.5	C1244 T1245 S1270 A1272 H1273 V1330 C1334 K1351 R1371	C1244-W1332 HydrophobicContact CB-CD2 3.87Å; C1244-W1332 HydrophobicContact CB-CE3 3.9Å; C1244-W1332 HydrophobicContact CB-CG 4.34Å; C1244-W1332 HydrophobicContact CB-CH2 4.29Å; C1244-W1332 HydrophobicContact CB-CZ2 4.27Å; C1244-W1332 HydrophobicContact CB-CZ3 4.11Å; T1245-W1332 HydrophobicContact CG2-CH2 3.95Å; T1245-W1332 HydrophobicContact CG2-CZ2 3.57Å; T1245-W1332 VanDerWaalsContact CG2-CZ2 3.49Å; S1270-W1332 VanDerWaalsContact O-O 3.08Å; A1272-W1332 CarbonylContact O-C 3.43Å; H1273-W1332 HydrophobicContact CB-CE3 4.35Å; H1273-W1332 AromaticContact CD2-CE3 3.58Å; H1273-W1332 VanDerWaalsContact CD2-CE3 3.49Å; H1273-W1332 AromaticContact CD2-CZ3 3.7Å; H1273-W1332 AromaticContact CE1-CE3 3.85Å; H1273-W1332 AromaticContact CE1-CZ3 3.57Å; H1273-W1332 AromaticContact CG-CE3 3.9Å; H1273-W1332 AromaticContact ND1-CE3 3.39Å; H1273-W1332 AromaticContact ND1-CZ3 3.62Å; V1330-W1332 PolarHBondContact O-N 3.01Å; V1330-W1332 VanDerWaalsContact O-N 3.11Å; W1332-C1334 PolarHBondContact O-N 3.2Å; W1332-C1334 VanDerWaalsContact O-N 3.1Å; W1332-K1351 HydrophobicContact CD2-CB 4.13Å; W1332-K1351 HydrophobicContact CD2-CG 4.34Å; W1332-K1351 HydrophobicContact CE3-CB 4.04Å; W1332-K1351 HydrophobicContact CE3-CG 3.97Å; W1332-K1351 HydrophobicContact CH2-CB 3.76Å; W1332-K1351 HydrophobicContact CH2-CD 3.86Å; W1332-K1351 HydrophobicContact CH2-CG 3.67Å; W1332-K1351 HydrophobicContact CZ2-CB 3.71Å; W1332-K1351 HydrophobicContact CZ2-CD 4.23Å; W1332-K1351 HydrophobicContact CZ2-CG 4.02Å; W1332-K1351 HydrophobicContact CZ3-CB 3.97Å; W1332-K1351 HydrophobicContact CZ3-CD 3.83Å; W1332-K1351 HydrophobicContact CZ3-CG 3.64Å; W1332-K1351 PolarHBondContact NE1-O 3.05Å; W1332-R1371 WeakPolarHBondContact O-CD 3.31Å; W1332-R1371 PolarHBondContact O-NE 3.11Å; W1332-R1371 VanDerWaalsContact O-NE 3.07Å
1333	G	83.5	Confident	86.8	Confident	9.8 Å²	9.8	30.6 Å²	30.6	10%	0.101	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	68	6.6	169.4	0	0	0	0	0	117.2	A1272 R1335 L1348 T1349	A1272-G1333 WeakPolarHBondContact O-CA 3.37Å; A1272-G1333 PolarHBondContact O-N 3Å; A1272-G1333 VanDerWaalsContact O-N 3.14Å; G1333-R1335 PolarHBondContact O-N 3.13Å; G1333-R1335 VanDerWaalsContact O-N 3.1Å; G1333-L1348 WeakPolarHBondContact O-CD2 3.36Å; G1333-T1349 PolarHBondContact N-O 3.06Å; G1333-T1349 PolarHBondContact N-OG1 2.98Å
1334	C	91	Very high	86.3	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.15	C	C	.	.			trans	-60.8	119.7	174.2	-175.3	0	0	0	0	108.9	I1323 F1331 W1332 L1348 T1349 R1371	I1323-C1334 HydrophobicContact CB-CB 4.35Å; I1323-C1334 HydrophobicContact CG1-CB 4.36Å; I1323-C1334 HydrophobicContact CG2-CB 4.22Å; F1331-C1334 HydrophobicContact CB-CB 4.25Å; W1332-C1334 PolarHBondContact O-N 3.2Å; W1332-C1334 VanDerWaalsContact O-N 3.1Å; C1334-L1348 CarbonylContact O-C 3.33Å; C1334-L1348 WeakPolarHBondContact O-CA 3.43Å; C1334-T1349 HydrophobicContact CB-CG2 3.91Å; C1334-T1349 PolarHBondContact N-OG1 3.1Å; C1334-T1349 PolarHBondContact O-N 3.16Å; C1334-R1371 HydrophobicContact CB-CB 4.34Å
1335	R	90.4	Very high	86	Confident	57.8 Å²	57.8	28.7 Å²	28.7	22%	0.218	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	130	174	166.4	173.4	170.3	-165.5	-8.7	109	G1333 S1337 Y1346 T1347 L1348 F1369 L1370	G1333-R1335 PolarHBondContact O-N 3.13Å; G1333-R1335 VanDerWaalsContact O-N 3.1Å; R1335-S1337 PolarHBondContact NE-OG 3.1Å; R1335-S1337 VanDerWaalsContact NE-OG 3.16Å; R1335-S1337 PolarHBondContact NH2-OG 3.38Å; R1335-S1337 VanDerWaalsContact NH2-OG 3.16Å; R1335-Y1346 HydrophobicContact CB-CD2 4.36Å; R1335-Y1346 HydrophobicContact CG-CD2 3.7Å; R1335-Y1346 HydrophobicContact CG-CE2 4.33Å; R1335-Y1346 HydrophobicContact CG-CG 4.14Å; R1335-T1347 WeakPolarHBondContact CA-O 3.44Å; R1335-L1348 HydrophobicContact CB-CD2 3.79Å; R1335-L1348 HydrophobicContact CG-CD2 4.42Å; R1335-F1369 CarbonylContact O-C 3.35Å; R1335-F1369 VanDerWaalsContact O-CA 3.31Å; R1335-F1369 WeakPolarHBondContact O-CA 3.32Å; R1335-L1370 HydrophobicContact CB-CB 4.35Å; R1335-L1370 PolarHBondContact N-O 3Å; R1335-L1370 PolarHBondContact O-N 3.23Å
1336	V	92.9	Very high	86.1	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	122.9	174.5	-164.3	0	0	0	0	109.5	I1323 Y1346 T1347 T1349 F1355 L1357 L1367 E1368 F1369	I1323-V1336 HydrophobicContact CG1-CG2 4.43Å; V1336-Y1346 WeakPolarHBondContact O-CA 3.38Å; V1336-Y1346 WeakPolarHBondContact O-CB 3.4Å; V1336-T1347 HydrophobicContact CB-CG2 3.88Å; V1336-T1347 HydrophobicContact CG2-CG2 4.42Å; V1336-T1347 PolarHBondContact N-O 2.94Å; V1336-T1347 PolarHBondContact O-N 3.15Å; V1336-T1349 HydrophobicContact CG2-CG2 4.38Å; V1336-F1355 HydrophobicContact CB-CD2 4.1Å; V1336-F1355 HydrophobicContact CB-CE2 4.46Å; V1336-F1355 HydrophobicContact CB-CG 4.3Å; V1336-F1355 HydrophobicContact CG1-CD2 3.94Å; V1336-F1355 HydrophobicContact CG1-CE2 3.81Å; V1336-F1355 HydrophobicContact CG1-CG 4.43Å; V1336-F1355 HydrophobicContact CG1-CZ 4.2Å; V1336-F1355 HydrophobicContact CG2-CB 4.03Å; V1336-F1355 HydrophobicContact CG2-CD1 4.03Å; V1336-F1355 HydrophobicContact CG2-CD2 4.08Å; V1336-F1355 HydrophobicContact CG2-CE1 4.42Å; V1336-F1355 HydrophobicContact CG2-CG 3.77Å; V1336-L1357 HydrophobicContact CG1-CD2 4.23Å; V1336-L1367 HydrophobicContact CG1-CD2 4.5Å; V1336-E1368 WeakPolarHBondContact CA-O 3.39Å; V1336-F1369 HydrophobicContact CB-CD1 4.33Å; V1336-F1369 HydrophobicContact CG1-CD1 3.73Å; V1336-F1369 HydrophobicContact CG1-CE1 3.58Å; V1336-F1369 HydrophobicContact CG2-CD1 3.9Å; V1336-F1369 HydrophobicContact CG2-CE1 4.31Å
1337	S	90.8	Very high	86.4	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	158.8	178.3	-1.5	0	0	0	0	111.2	R1335 R1339 L1367 E1368	R1335-S1337 PolarHBondContact NE-OG 3.1Å; R1335-S1337 VanDerWaalsContact NE-OG 3.16Å; R1335-S1337 PolarHBondContact NH2-OG 3.38Å; R1335-S1337 VanDerWaalsContact NH2-OG 3.16Å; S1337-R1339 PolarHBondContact O-N 3.17Å; S1337-L1367 WeakPolarHBondContact O-CA 3.41Å; S1337-E1368 PolarHBondContact N-O 2.7Å; S1337-E1368 PolarHBondContact O-N 3.2Å
1338	D	90.1	Very high	86.9	Confident	8.6 Å²	8.6	29.2 Å²	29.2	5%	0.046	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	116.8	158.7	-178.8	-6.1	0	0	0	108.4	A1340 N1341 M1342 V1365 Q1366	D1338-A1340 VanDerWaalsContact C-N 3.3Å; D1338-A1340 PolarHBondContact O-N 2.83Å; D1338-A1340 WeakPolarHBondContact OD1-CB 3.45Å; D1338-A1340 PolarHBondContact OD1-N 3.05Å; D1338-N1341 HydrophobicContact CB-CB 4.27Å; D1338-N1341 CarbonylContact O-C 3.42Å; D1338-N1341 VanDerWaalsContact O-C 3.28Å; D1338-N1341 PolarHBondContact O-N 3.25Å; D1338-N1341 PolarHBondContact OD1-N 3.12Å; D1338-N1341 WeakPolarHBondContact OD2-CB 3.4Å; D1338-N1341 PolarHBondContact OD2-ND2 2.96Å; D1338-M1342 WeakPolarHBondContact O-CA 3.39Å; D1338-M1342 WeakPolarHBondContact O-CG 3.42Å; D1338-M1342 PolarHBondContact O-N 2.92Å; D1338-M1342 VanDerWaalsContact O-N 3.09Å; D1338-V1365 HydrophobicContact CB-CG1 4.09Å; D1338-Q1366 WeakPolarHBondContact CA-O 3.26Å
1339	R	85.2	Confident	87.2	Confident	95.6 Å²	95.6	28.8 Å²	28.8	36%	0.361	14%	0.143	S	C	.	.	S	Bend	trans	-65.9	-31.8	-179.5	-163.3	177.9	-172.9	-151.5	-1.9	112.9	S1337 N1341 M1342 Q1366 E1368 S1813	S1337-R1339 PolarHBondContact O-N 3.17Å; R1339-N1341 VanDerWaalsContact C-N 3.35Å; R1339-M1342 WeakPolarHBondContact O-CG 3.46Å; R1339-Q1366 HydrophobicContact CB-CB 3.98Å; R1339-Q1366 VanDerWaalsContact CB-O 3.3Å; R1339-Q1366 WeakPolarHBondContact CB-O 3.25Å; R1339-Q1366 PolarHBondContact N-O 3.12Å; R1339-E1368 HydrophobicContact CB-CB 4.09Å; R1339-E1368 VanDerWaalsContact CD-OE1 3.28Å; R1339-E1368 WeakPolarHBondContact CD-OE1 3.25Å; R1339-E1368 HydrophobicContact CG-CB 4.34Å; R1339-E1368 WeakPolarHBondContact CG-OE1 3.31Å; R1339-E1368 IonicContact CZ-OE1 3.29Å; R1339-E1368 IonicContact NE-OE1 3.47Å; R1339-E1368 PolarHBondContact NE-OE1 3.36Å; R1339-E1368 IonicContact NH2-OE1 3.36Å; R1339-S1813 PolarHBondContact NH2-OG 3.41Å
1340	A	78.9	Confident	87.3	Confident	37.2 Å²	37.2	29.1 Å²	29.1	31%	0.307	15%	0.145	S	C	.	.	S	Bend	trans	-78	-29.6	177.3	0	0	0	0	0	111.7	D1338 S1805 I1806	D1338-A1340 VanDerWaalsContact C-N 3.3Å; D1338-A1340 PolarHBondContact O-N 2.83Å; D1338-A1340 WeakPolarHBondContact OD1-CB 3.45Å; D1338-A1340 PolarHBondContact OD1-N 3.05Å; A1340-S1805 PolarHBondContact O-OG 3.48Å; A1340-I1806 HydrophobicContact CB-CD1 3.75Å
1341	N	82.5	Confident	87.2	Confident	45.4 Å²	45.4	33 Å²	33	24%	0.243	16%	0.159	C	C	.	.			trans	-124.9	49	-174.5	-59.3	-68.5	0	0	0	112.7	D1338 R1339 Q1343 N1344	D1338-N1341 HydrophobicContact CB-CB 4.27Å; D1338-N1341 CarbonylContact O-C 3.42Å; D1338-N1341 VanDerWaalsContact O-C 3.28Å; D1338-N1341 PolarHBondContact O-N 3.25Å; D1338-N1341 PolarHBondContact OD1-N 3.12Å; D1338-N1341 WeakPolarHBondContact OD2-CB 3.4Å; D1338-N1341 PolarHBondContact OD2-ND2 2.96Å; R1339-N1341 VanDerWaalsContact C-N 3.35Å; N1341-Q1343 VanDerWaalsContact C-OE1 3.25Å; N1341-Q1343 VanDerWaalsContact CA-OE1 3.31Å; N1341-Q1343 PolarHBondContact O-N 3.07Å; N1341-Q1343 PolarHBondContact OD1-NE2 2.99Å; N1341-Q1343 VanDerWaalsContact OD1-NE2 3.17Å; N1341-N1344 HydrophobicContact CB-CB 4.47Å; N1341-N1344 VanDerWaalsContact O-CB 3.3Å; N1341-N1344 WeakPolarHBondContact O-CB 3.41Å; N1341-N1344 PolarHBondContact O-N 3.01Å
1342	M	81	Confident	87.2	Confident	78.8 Å²	78.8	35.2 Å²	35.2	39%	0.388	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	-57.3	-23.1	-178.1	-59	-179.6	83.2	0	0	113.4	D1338 R1339 N1344 G1345	D1338-M1342 WeakPolarHBondContact O-CA 3.39Å; D1338-M1342 WeakPolarHBondContact O-CG 3.42Å; D1338-M1342 PolarHBondContact O-N 2.92Å; D1338-M1342 VanDerWaalsContact O-N 3.09Å; R1339-M1342 WeakPolarHBondContact O-CG 3.46Å; M1342-N1344 PolarHBondContact O-N 2.89Å; M1342-G1345 PolarHBondContact O-N 2.98Å; M1342-G1345 VanDerWaalsContact O-N 3.17Å
1343	Q	79.4	Confident	87.3	Confident	104 Å²	104	34.2 Å²	34.2	49%	0.486	17%	0.17	S	C	.	.	G	3₁₀ helix	trans	-62.9	-23.6	173	57.9	-75.8	-11.2	0	0	113.6	V1307 N1310 N1341 G1345	V1307-Q1343 WeakPolarHBondContact CB-O 3.39Å; V1307-Q1343 WeakPolarHBondContact CG2-O 3.37Å; N1310-Q1343 PolarHBondContact ND2-O 3.09Å; N1341-Q1343 VanDerWaalsContact C-OE1 3.25Å; N1341-Q1343 VanDerWaalsContact CA-OE1 3.31Å; N1341-Q1343 PolarHBondContact O-N 3.07Å; N1341-Q1343 PolarHBondContact OD1-NE2 2.99Å; N1341-Q1343 VanDerWaalsContact OD1-NE2 3.17Å; Q1343-G1345 VanDerWaalsContact C-N 3.26Å; Q1343-G1345 PolarHBondContact O-N 3.04Å
1344	N	84.4	Confident	87.8	Confident	9.6 Å²	9.6	37.8 Å²	37.8	5%	0.051	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-73.5	-16.5	178.6	-67.6	17.4	0	0	0	111.9	V1307 N1310 F1311 N1341 M1342 D1360	V1307-N1344 PolarHBondContact N-O 2.87Å; N1310-N1344 WeakPolarHBondContact CB-OD1 3.36Å; F1311-N1344 WeakPolarHBondContact CD1-ND2 3.2Å; F1311-N1344 HydrophobicContact CE1-CB 3.9Å; F1311-N1344 VanDerWaalsContact CE1-ND2 3.31Å; F1311-N1344 WeakPolarHBondContact CE1-ND2 3.36Å; F1311-N1344 HydrophobicContact CE2-CB 4.25Å; F1311-N1344 HydrophobicContact CZ-CB 3.67Å; N1341-N1344 HydrophobicContact CB-CB 4.47Å; N1341-N1344 VanDerWaalsContact O-CB 3.3Å; N1341-N1344 WeakPolarHBondContact O-CB 3.41Å; N1341-N1344 PolarHBondContact O-N 3.01Å; M1342-N1344 PolarHBondContact O-N 2.89Å; N1344-D1360 PolarHBondContact ND2-OD2 3.07Å
1345	G	85.4	Confident	87.8	Confident	8.4 Å²	8.4	37.9 Å²	37.9	9%	0.087	18%	0.181	C	C	.	.	B	Isolated β-bridge	trans	112.9	-161.7	176.8	0	0	0	0	0	113.9	R1305 M1342 Q1343	R1305-G1345 CarbonylContact O-C 3.55Å; R1305-G1345 VanDerWaalsContact O-CA 3.23Å; R1305-G1345 WeakPolarHBondContact O-CA 3.3Å; M1342-G1345 PolarHBondContact O-N 2.98Å; M1342-G1345 VanDerWaalsContact O-N 3.17Å; Q1343-G1345 VanDerWaalsContact C-N 3.26Å; Q1343-G1345 PolarHBondContact O-N 3.04Å
1346	Y	88.2	Confident	88	Confident	52.2 Å²	52.2	35.3 Å²	35.3	21%	0.205	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	163.6	176.2	68.1	-86.3	0	0	0	111.1	R1305 R1335 V1336 L1348	R1305-Y1346 HydrophobicContact CB-CD1 4.2Å; R1305-Y1346 HydrophobicContact CB-CE1 4.18Å; R1305-Y1346 HydrophobicContact CB-CE2 4.46Å; R1305-Y1346 HydrophobicContact CB-CG 4.41Å; R1305-Y1346 WeakPolarHBondContact CB-O 3.34Å; R1305-Y1346 WeakPolarHBondContact CD-OH 2.99Å; R1305-Y1346 HydrophobicContact CG-CD1 4.36Å; R1305-Y1346 HydrophobicContact CG-CE1 4.19Å; R1305-Y1346 HydrophobicContact CG-CE2 4.18Å; R1305-Y1346 PolarHBondContact NE-OH 3.18Å; R1305-Y1346 PolarHBondContact NH1-OH 3.22Å; R1305-Y1346 PolarHBondContact O-N 3.19Å; R1305-Y1346 VanDerWaalsContact O-N 3.17Å; R1335-Y1346 HydrophobicContact CB-CD2 4.36Å; R1335-Y1346 HydrophobicContact CG-CD2 3.7Å; R1335-Y1346 HydrophobicContact CG-CE2 4.33Å; R1335-Y1346 HydrophobicContact CG-CG 4.14Å; V1336-Y1346 WeakPolarHBondContact O-CA 3.38Å; V1336-Y1346 WeakPolarHBondContact O-CB 3.4Å; Y1346-L1348 HydrophobicContact CD2-CD2 4.22Å; Y1346-L1348 HydrophobicContact CD2-CG 4.42Å; Y1346-L1348 HydrophobicContact CE2-CD2 3.97Å; Y1346-L1348 HydrophobicContact CE2-CG 4.21Å
1347	T	88.3	Confident	88	Confident	8 Å²	8	35.6 Å²	35.6	5%	0.049	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	163.2	171.9	-167.3	0	0	0	0	110.1	R1335 V1336 F1355 D1356 L1357	R1335-T1347 WeakPolarHBondContact CA-O 3.44Å; V1336-T1347 HydrophobicContact CB-CG2 3.88Å; V1336-T1347 HydrophobicContact CG2-CG2 4.42Å; V1336-T1347 PolarHBondContact N-O 2.94Å; V1336-T1347 PolarHBondContact O-N 3.15Å; T1347-F1355 HydrophobicContact CG2-CB 3.91Å; T1347-F1355 HydrophobicContact CG2-CD2 4.12Å; T1347-F1355 HydrophobicContact CG2-CG 4.44Å; T1347-D1356 WeakPolarHBondContact CB-O 3.21Å; T1347-D1356 WeakPolarHBondContact CG2-O 3.5Å; T1347-D1356 PolarHBondContact OG1-O 3.04Å; T1347-D1356 VanDerWaalsContact OG1-O 3.07Å; T1347-L1357 HydrophobicContact CG2-CB 4.01Å; T1347-L1357 HydrophobicContact CG2-CD1 4.21Å
1348	L	88.9	Confident	88.1	Confident	31 Å²	31	35.8 Å²	35.8	16%	0.162	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	147.9	168.8	-60	-179.4	0	0	0	108.7	S1274 G1333 C1334 R1335 Y1346	S1274-L1348 VanDerWaalsContact CB-O 3.27Å; S1274-L1348 WeakPolarHBondContact CB-O 3.43Å; S1274-L1348 PolarHBondContact OG-O 2.93Å; G1333-L1348 WeakPolarHBondContact O-CD2 3.36Å; C1334-L1348 CarbonylContact O-C 3.33Å; C1334-L1348 WeakPolarHBondContact O-CA 3.43Å; R1335-L1348 HydrophobicContact CB-CD2 3.79Å; R1335-L1348 HydrophobicContact CG-CD2 4.42Å; Y1346-L1348 HydrophobicContact CD2-CD2 4.22Å; Y1346-L1348 HydrophobicContact CD2-CG 4.42Å; Y1346-L1348 HydrophobicContact CE2-CD2 3.97Å; Y1346-L1348 HydrophobicContact CE2-CG 4.21Å
1349	T	91.9	Very high	88.3	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.173	C	C	.	.			trans	-65.4	150.1	170.9	52.7	0	0	0	0	112.3	H1273 S1274 I1323 F1331 G1333 C1334 V1336 G1353 R1354 F1355	H1273-T1349 VanDerWaalsContact CA-O 3.31Å; H1273-T1349 WeakPolarHBondContact CA-O 3.36Å; H1273-T1349 VanDerWaalsContact CB-O 3.28Å; H1273-T1349 WeakPolarHBondContact CB-O 3.26Å; S1274-T1349 PolarHBondContact N-O 2.93Å; S1274-T1349 VanDerWaalsContact N-O 3.14Å; S1274-T1349 PolarHBondContact OG-O 2.8Å; I1323-T1349 HydrophobicContact CB-CG2 4.04Å; I1323-T1349 HydrophobicContact CG1-CG2 3.62Å; F1331-T1349 WeakPolarHBondContact O-CB 3.32Å; F1331-T1349 PolarHBondContact O-OG1 3.04Å; G1333-T1349 PolarHBondContact N-O 3.06Å; G1333-T1349 PolarHBondContact N-OG1 2.98Å; C1334-T1349 HydrophobicContact CB-CG2 3.91Å; C1334-T1349 PolarHBondContact N-OG1 3.1Å; C1334-T1349 PolarHBondContact O-N 3.16Å; V1336-T1349 HydrophobicContact CG2-CG2 4.38Å; T1349-G1353 VanDerWaalsContact CG2-O 3.24Å; T1349-G1353 WeakPolarHBondContact CG2-O 3.32Å; T1349-R1354 CarbonylContact C-O 3.51Å; T1349-R1354 VanDerWaalsContact CA-O 3.25Å; T1349-R1354 WeakPolarHBondContact CA-O 3.37Å; T1349-F1355 HydrophobicContact CG2-CB 4.05Å; T1349-F1355 HydrophobicContact CG2-CD1 4.45Å
1350	D	89.5	Confident	88.5	Confident	7 Å²	7	31.7 Å²	31.7	4%	0.037	16%	0.16	C	C	.	.			trans	-81.1	-179.2	171	76.7	6.9	0	0	0	112.1	S1274 S1352 G1353 R1354	S1274-D1350 PolarHBondContact OG-N 2.89Å; D1350-S1352 VanDerWaalsContact CG-OG 3.31Å; D1350-S1352 PolarHBondContact O-N 3.03Å; D1350-S1352 VanDerWaalsContact O-N 3.09Å; D1350-S1352 VanDerWaalsContact OD1-CA 3.31Å; D1350-S1352 WeakPolarHBondContact OD1-CA 3.35Å; D1350-S1352 WeakPolarHBondContact OD1-CB 3.35Å; D1350-S1352 PolarHBondContact OD1-N 3Å; D1350-S1352 PolarHBondContact OD1-OG 3.06Å; D1350-S1352 PolarHBondContact OD2-OG 2.95Å; D1350-G1353 PolarHBondContact O-N 3.15Å; D1350-G1353 PolarHBondContact OD1-N 3.02Å; D1350-R1354 PolarHBondContact N-O 3.09Å; D1350-R1354 WeakPolarHBondContact OD1-CB 3.33Å; D1350-R1354 PolarHBondContact OD1-N 3.08Å; D1350-R1354 IonicContact OD1-NE 3.38Å; D1350-R1354 IonicContact OD2-CZ 3.55Å; D1350-R1354 VanDerWaalsContact OD2-CZ 3.26Å; D1350-R1354 IonicContact OD2-NE 3.12Å; D1350-R1354 PolarHBondContact OD2-NE 3.06Å; D1350-R1354 IonicContact OD2-NH2 2.93Å; D1350-R1354 PolarHBondContact OD2-NH2 3Å
1351	K	89.7	Confident	89.1	Confident	118.4 Å²	118.4	29.9 Å²	29.9	52%	0.515	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-3.1	177.2	26.1	-179.4	179.5	-177.4	0	115.8	H1273 W1332	H1273-K1351 WeakPolarHBondContact CD2-CG 3.32Å; H1273-K1351 VanDerWaalsContact CE1-CE 3.42Å; H1273-K1351 WeakPolarHBondContact CE1-CE 3.43Å; H1273-K1351 WeakPolarHBondContact NE2-CE 3.25Å; W1332-K1351 HydrophobicContact CD2-CB 4.13Å; W1332-K1351 HydrophobicContact CD2-CG 4.34Å; W1332-K1351 HydrophobicContact CE3-CB 4.04Å; W1332-K1351 HydrophobicContact CE3-CG 3.97Å; W1332-K1351 HydrophobicContact CH2-CB 3.76Å; W1332-K1351 HydrophobicContact CH2-CD 3.86Å; W1332-K1351 HydrophobicContact CH2-CG 3.67Å; W1332-K1351 HydrophobicContact CZ2-CB 3.71Å; W1332-K1351 HydrophobicContact CZ2-CD 4.23Å; W1332-K1351 HydrophobicContact CZ2-CG 4.02Å; W1332-K1351 HydrophobicContact CZ3-CB 3.97Å; W1332-K1351 HydrophobicContact CZ3-CD 3.83Å; W1332-K1351 HydrophobicContact CZ3-CG 3.64Å; W1332-K1351 PolarHBondContact NE1-O 3.05Å
1352	S	90.4	Very high	89.3	Confident	45.8 Å²	45.8	28.6 Å²	28.6	32%	0.32	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.3	15.7	175.1	41.5	0	0	0	0	112	V1322 D1350 R1354	V1322-S1352 WeakPolarHBondContact CG1-O 3.24Å; D1350-S1352 VanDerWaalsContact CG-OG 3.31Å; D1350-S1352 PolarHBondContact O-N 3.03Å; D1350-S1352 VanDerWaalsContact O-N 3.09Å; D1350-S1352 VanDerWaalsContact OD1-CA 3.31Å; D1350-S1352 WeakPolarHBondContact OD1-CA 3.35Å; D1350-S1352 WeakPolarHBondContact OD1-CB 3.35Å; D1350-S1352 PolarHBondContact OD1-N 3Å; D1350-S1352 PolarHBondContact OD1-OG 3.06Å; D1350-S1352 PolarHBondContact OD2-OG 2.95Å; S1352-R1354 PolarHBondContact O-N 3.04Å; S1352-R1354 WeakPolarHBondContact OG-CG 3.14Å; S1352-R1354 VanDerWaalsContact OG-CZ 3.28Å; S1352-R1354 PolarHBondContact OG-NE 2.94Å
1353	G	91.8	Very high	89.6	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.132	C	C	.	.	S	Bend	trans	73.2	3.9	-177.9	0	0	0	0	0	114.3	V1322 I1323 F1331 T1349 D1350	V1322-G1353 CarbonylContact C-O 3.3Å; V1322-G1353 VanDerWaalsContact CA-O 3.31Å; V1322-G1353 WeakPolarHBondContact CA-O 3.39Å; I1323-G1353 PolarHBondContact N-O 3.06Å; F1331-G1353 VanDerWaalsContact O-CA 3.3Å; F1331-G1353 WeakPolarHBondContact O-CA 3.46Å; T1349-G1353 VanDerWaalsContact CG2-O 3.24Å; T1349-G1353 WeakPolarHBondContact CG2-O 3.32Å; D1350-G1353 PolarHBondContact O-N 3.15Å; D1350-G1353 PolarHBondContact OD1-N 3.02Å
1354	R	92.8	Very high	90	Very high	85.8 Å²	85.8	23.3 Å²	23.3	32%	0.324	12%	0.12	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	140	-174.1	-58.5	178.8	-58.5	-170.6	2.9	111.2	S1276 G1321 V1322 T1349 D1350 S1352	S1276-R1354 PolarHBondContact OG-NH2 2.82Å; S1276-R1354 VanDerWaalsContact OG-NH2 3.17Å; G1321-R1354 VanDerWaalsContact O-CA 3.3Å; G1321-R1354 WeakPolarHBondContact O-CA 3.36Å; V1322-R1354 HydrophobicContact CG2-CG 4.2Å; T1349-R1354 CarbonylContact C-O 3.51Å; T1349-R1354 VanDerWaalsContact CA-O 3.25Å; T1349-R1354 WeakPolarHBondContact CA-O 3.37Å; D1350-R1354 PolarHBondContact N-O 3.09Å; D1350-R1354 WeakPolarHBondContact OD1-CB 3.33Å; D1350-R1354 PolarHBondContact OD1-N 3.08Å; D1350-R1354 IonicContact OD1-NE 3.38Å; D1350-R1354 IonicContact OD2-CZ 3.55Å; D1350-R1354 VanDerWaalsContact OD2-CZ 3.26Å; D1350-R1354 IonicContact OD2-NE 3.12Å; D1350-R1354 PolarHBondContact OD2-NE 3.06Å; D1350-R1354 IonicContact OD2-NH2 2.93Å; D1350-R1354 PolarHBondContact OD2-NH2 3Å; S1352-R1354 PolarHBondContact O-N 3.04Å; S1352-R1354 WeakPolarHBondContact OG-CG 3.14Å; S1352-R1354 VanDerWaalsContact OG-CZ 3.28Å; S1352-R1354 PolarHBondContact OG-NE 2.94Å
1355	F	92.3	Very high	90.2	Very high	1.4 Å²	1.4	22.9 Å²	22.9	1%	0.006	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	156.6	169	74.6	-84.9	0	0	0	111.5	V1319 R1320 G1321 I1323 V1336 T1347 T1349 L1357 F1369 M1393	V1319-F1355 HydrophobicContact CB-CE2 4.46Å; V1319-F1355 HydrophobicContact CG1-CE2 3.97Å; V1319-F1355 HydrophobicContact CG1-CZ 4.09Å; R1320-F1355 VanDerWaalsContact CA-O 3.23Å; R1320-F1355 WeakPolarHBondContact CA-O 3.25Å; R1320-F1355 VanDerWaalsContact CB-O 3.29Å; R1320-F1355 WeakPolarHBondContact CB-O 3.17Å; G1321-F1355 VanDerWaalsContact CA-CE1 3.45Å; G1321-F1355 PolarHBondContact N-O 3.02Å; G1321-F1355 WeakPolarHBondContact O-CD1 3.18Å; G1321-F1355 PolarHBondContact O-N 3.06Å; G1321-F1355 VanDerWaalsContact O-N 3.07Å; I1323-F1355 HydrophobicContact CD1-CD1 3.92Å; I1323-F1355 HydrophobicContact CD1-CE1 3.61Å; I1323-F1355 HydrophobicContact CG1-CD1 3.98Å; I1323-F1355 HydrophobicContact CG1-CE1 4.21Å; V1336-F1355 HydrophobicContact CB-CD2 4.1Å; V1336-F1355 HydrophobicContact CB-CE2 4.46Å; V1336-F1355 HydrophobicContact CB-CG 4.3Å; V1336-F1355 HydrophobicContact CG1-CD2 3.94Å; V1336-F1355 HydrophobicContact CG1-CE2 3.81Å; V1336-F1355 HydrophobicContact CG1-CG 4.43Å; V1336-F1355 HydrophobicContact CG1-CZ 4.2Å; V1336-F1355 HydrophobicContact CG2-CB 4.03Å; V1336-F1355 HydrophobicContact CG2-CD1 4.03Å; V1336-F1355 HydrophobicContact CG2-CD2 4.08Å; V1336-F1355 HydrophobicContact CG2-CE1 4.42Å; V1336-F1355 HydrophobicContact CG2-CG 3.77Å; T1347-F1355 HydrophobicContact CG2-CB 3.91Å; T1347-F1355 HydrophobicContact CG2-CD2 4.12Å; T1347-F1355 HydrophobicContact CG2-CG 4.44Å; T1349-F1355 HydrophobicContact CG2-CB 4.05Å; T1349-F1355 HydrophobicContact CG2-CD1 4.45Å; F1355-L1357 HydrophobicContact CD2-CB 4.18Å; F1355-L1357 HydrophobicContact CE2-CB 4.32Å; F1355-F1369 HydrophobicContact CE1-CE1 4.31Å; F1355-F1369 HydrophobicContact CZ-CE1 4.25Å; F1355-M1393 HydrophobicContact CE1-CE 3.64Å; F1355-M1393 HydrophobicContact CE1-SD 4.22Å; F1355-M1393 HydrophobicContact CZ-CE 3.69Å; F1355-M1393 HydrophobicContact CZ-CG 4.48Å; F1355-M1393 HydrophobicContact CZ-SD 3.7Å
1356	D	92.6	Very high	90.4	Very high	5 Å²	5	24.2 Å²	24.2	3%	0.027	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	121	167.6	-49.1	-83.6	0	0	0	107.9	F1277 L1300 R1303 V1318 V1319 R1320 T1347 Y1581	F1277-D1356 VanDerWaalsContact CD1-OD2 3.29Å; F1277-D1356 WeakPolarHBondContact CD1-OD2 3.45Å; F1277-D1356 WeakPolarHBondContact CE1-OD2 3.43Å; L1300-D1356 HydrophobicContact CD1-CB 3.72Å; L1300-D1356 HydrophobicContact CD2-CB 4.08Å; R1303-D1356 IonicContact CZ-OD2 3.05Å; R1303-D1356 IonicContact NH1-OD2 3.39Å; R1303-D1356 PolarHBondContact NH1-OD2 3.09Å; R1303-D1356 IonicContact NH2-OD2 2.66Å; V1318-D1356 HydrophobicContact CG1-CB 4.25Å; V1319-D1356 CarbonylContact O-C 3.53Å; V1319-D1356 WeakPolarHBondContact O-CA 3.27Å; R1320-D1356 HydrophobicContact CB-CB 4.45Å; R1320-D1356 WeakPolarHBondContact CB-OD1 3.23Å; R1320-D1356 IonicContact CZ-OD1 3.33Å; R1320-D1356 VanDerWaalsContact CZ-OD1 3.26Å; R1320-D1356 IonicContact CZ-OD2 3.01Å; R1320-D1356 IonicContact NE-OD1 3.43Å; R1320-D1356 PolarHBondContact NE-OD1 3.07Å; R1320-D1356 IonicContact NE-OD2 3.16Å; R1320-D1356 IonicContact NH1-OD1 3Å; R1320-D1356 VanDerWaalsContact NH2-CG 3.34Å; R1320-D1356 IonicContact NH2-OD1 3.03Å; R1320-D1356 PolarHBondContact NH2-OD1 3.47Å; R1320-D1356 IonicContact NH2-OD2 2.95Å; R1320-D1356 PolarHBondContact NH2-OD2 2.76Å; T1347-D1356 WeakPolarHBondContact CB-O 3.21Å; T1347-D1356 WeakPolarHBondContact CG2-O 3.5Å; T1347-D1356 PolarHBondContact OG1-O 3.04Å; T1347-D1356 VanDerWaalsContact OG1-O 3.07Å; D1356-Y1581 WeakPolarHBondContact OD1-CE1 3.21Å; D1356-Y1581 VanDerWaalsContact OD1-CZ 3.29Å; D1356-Y1581 PolarHBondContact OD1-OH 2.97Å
1357	L	93.4	Very high	90.6	Very high	5.2 Å²	5.2	21.7 Å²	21.7	3%	0.027	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	116.1	-177.9	-179	66.4	0	0	0	110.2	I1306 V1318 V1319 V1336 T1347 F1355 V1359 L1367	I1306-L1357 HydrophobicContact CD1-CD1 4.38Å; V1318-L1357 WeakPolarHBondContact CA-O 3.22Å; V1319-L1357 PolarHBondContact N-O 3Å; V1319-L1357 PolarHBondContact O-N 3.1Å; V1336-L1357 HydrophobicContact CG1-CD2 4.23Å; T1347-L1357 HydrophobicContact CG2-CB 4.01Å; T1347-L1357 HydrophobicContact CG2-CD1 4.21Å; F1355-L1357 HydrophobicContact CD2-CB 4.18Å; F1355-L1357 HydrophobicContact CE2-CB 4.32Å; L1357-V1359 HydrophobicContact CD2-CG1 3.99Å; L1357-V1359 HydrophobicContact CG-CG1 3.92Å; L1357-L1367 HydrophobicContact CD2-CD2 3.96Å
1358	P	94.2	Very high	90.7	Very high	3.6 Å²	3.6	22.5 Å²	22.5	2%	0.023	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	136.4	166.2	-19.6	33.1	0	0	0	111.3	L1300 L1301 I1306 F1311 I1316 S1317	L1300-P1358 HydrophobicContact CB-CG 4.46Å; L1300-P1358 HydrophobicContact CD2-CG 3.81Å; L1300-P1358 HydrophobicContact CG-CG 3.9Å; L1301-P1358 HydrophobicContact CD2-CB 4.15Å; L1301-P1358 HydrophobicContact CD2-CG 4.12Å; I1306-P1358 HydrophobicContact CD1-CG 4.22Å; I1306-P1358 HydrophobicContact CG1-CG 4.48Å; I1306-P1358 HydrophobicContact CG2-CG 4.41Å; F1311-P1358 HydrophobicContact CE1-CB 4.06Å; F1311-P1358 VanDerWaalsContact CE1-O 3.29Å; F1311-P1358 WeakPolarHBondContact CE1-O 3.41Å; F1311-P1358 HydrophobicContact CE2-CB 4.45Å; F1311-P1358 HydrophobicContact CZ-CB 3.87Å; F1311-P1358 WeakPolarHBondContact CZ-O 3.44Å; I1316-P1358 HydrophobicContact CD1-CB 4.3Å; I1316-P1358 HydrophobicContact CG1-CB 4.4Å; S1317-P1358 CarbonylContact O-C 3.32Å; S1317-P1358 VanDerWaalsContact O-CA 3.31Å; S1317-P1358 WeakPolarHBondContact O-CA 3.19Å
1359	V	93.4	Very high	90.8	Very high	1.4 Å²	1.4	21 Å²	21	1%	0.008	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	157.9	-177.2	-60.5	0	0	0	0	110.7	I1316 S1317 V1319 L1357 G1361 V1365 V1385	I1316-V1359 CarbonylContact C-O 3.53Å; I1316-V1359 WeakPolarHBondContact CA-O 3.29Å; S1317-V1359 PolarHBondContact N-O 2.91Å; S1317-V1359 PolarHBondContact O-N 3.12Å; V1319-V1359 HydrophobicContact CG2-CG1 4.39Å; V1319-V1359 HydrophobicContact CG2-CG2 3.92Å; L1357-V1359 HydrophobicContact CD2-CG1 3.99Å; L1357-V1359 HydrophobicContact CG-CG1 3.92Å; V1359-G1361 PolarHBondContact O-N 3.07Å; V1359-V1365 HydrophobicContact CB-CG1 4.46Å; V1359-V1365 HydrophobicContact CB-CG2 4.06Å; V1359-V1365 HydrophobicContact CG1-CG1 4.08Å; V1359-V1365 HydrophobicContact CG1-CG2 4.42Å; V1359-V1365 HydrophobicContact CG2-CG2 4.08Å; V1359-V1385 HydrophobicContact CG2-CB 4.35Å; V1359-V1385 HydrophobicContact CG2-CG1 3.85Å; V1359-V1385 HydrophobicContact CG2-CG2 4.26Å
1360	D	90.3	Very high	90.7	Very high	17 Å²	17	22.6 Å²	22.6	9%	0.091	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	108.1	172	-71.6	-71.3	0	0	0	110.9	F1311 D1312 R1315 N1344 T1363	F1311-D1360 WeakPolarHBondContact CA-OD1 3.3Å; F1311-D1360 WeakPolarHBondContact CD1-OD2 3.28Å; D1312-D1360 PolarHBondContact N-OD1 3.07Å; R1315-D1360 PolarHBondContact NH2-O 3.02Å; N1344-D1360 PolarHBondContact ND2-OD2 3.07Å; D1360-T1363 WeakPolarHBondContact O-CG2 3.41Å; D1360-T1363 PolarHBondContact O-OG1 3.22Å
1361	G	90.6	Very high	90.7	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.114	C	C	.	.			trans	-72.2	175.7	-178.7	0	0	0	0	0	114.6	R1315 V1359 T1363 V1385 V1387	R1315-G1361 VanDerWaalsContact CZ-O 3.3Å; R1315-G1361 PolarHBondContact NE-O 2.92Å; R1315-G1361 PolarHBondContact NH2-O 3.27Å; R1315-G1361 VanDerWaalsContact O-CA 3.26Å; R1315-G1361 WeakPolarHBondContact O-CA 3.37Å; R1315-G1361 PolarHBondContact O-N 3.17Å; V1359-G1361 PolarHBondContact O-N 3.07Å; G1361-T1363 VanDerWaalsContact C-N 3.34Å; G1361-V1385 CarbonylContact C-O 3.49Å; G1361-V1385 VanDerWaalsContact CA-O 3.3Å; G1361-V1385 WeakPolarHBondContact CA-O 3.33Å; G1361-V1387 VanDerWaalsContact C-CG1 3.42Å; G1361-V1387 VanDerWaalsContact C-CG2 3.49Å; G1361-V1387 WeakPolarHBondContact O-CG1 3.16Å
1362	G	87.5	Confident	90.5	Very high	19 Å²	19	19.8 Å²	19.8	20%	0.196	10%	0.102	C	C	.	.	S	Bend	trans	88.2	3.3	-175.5	0	0	0	0	0	114.1	V1385 S1700	G1362-V1385 PolarHBondContact N-O 2.99Å; G1362-S1700 VanDerWaalsContact O-CB 3.32Å; G1362-S1700 WeakPolarHBondContact O-CB 3.43Å
1363	T	87.1	Confident	90.2	Very high	25.8 Å²	25.8	18.4 Å²	18.4	16%	0.158	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	172.5	-174	175.5	0	0	0	0	111.4	R1315 D1360 G1361 V1365 Y1384 V1385 P1795 N1796	R1315-T1363 VanDerWaalsContact NH2-CG2 3.3Å; D1360-T1363 WeakPolarHBondContact O-CG2 3.41Å; D1360-T1363 PolarHBondContact O-OG1 3.22Å; G1361-T1363 VanDerWaalsContact C-N 3.34Å; T1363-V1365 HydrophobicContact CG2-CG2 4.3Å; T1363-Y1384 WeakPolarHBondContact O-CD2 3.36Å; T1363-V1385 PolarHBondContact O-N 3.15Å; T1363-V1385 VanDerWaalsContact O-N 3.09Å; T1363-P1795 PolarHBondContact OG1-O 3.21Å; T1363-N1796 WeakPolarHBondContact OG1-CA 3.28Å; T1363-N1796 PolarHBondContact OG1-OD1 2.57Å
1364	I	87.3	Confident	89.8	Confident	44 Å²	44	21.4 Å²	21.4	23%	0.226	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	114.7	165.7	-51.4	174.1	0	0	0	108.1	N1382 L1383 Y1384 P1795 N1796 Q1893 I1979	I1364-N1382 HydrophobicContact CG2-CB 3.95Å; I1364-L1383 CarbonylContact C-O 3.4Å; I1364-L1383 WeakPolarHBondContact CA-O 3.4Å; I1364-Y1384 HydrophobicContact CG1-CD2 4.19Å; I1364-P1795 HydrophobicContact CD1-CB 3.87Å; I1364-P1795 HydrophobicContact CD1-CG 4.28Å; I1364-P1795 HydrophobicContact CG1-CB 4.14Å; I1364-N1796 VanDerWaalsContact CA-OD1 3.3Å; I1364-N1796 WeakPolarHBondContact CA-OD1 3.31Å; I1364-N1796 WeakPolarHBondContact CB-OD1 3.22Å; I1364-N1796 VanDerWaalsContact CG1-OD1 3.27Å; I1364-N1796 WeakPolarHBondContact CG1-OD1 3.32Å; I1364-N1796 PolarHBondContact N-OD1 2.96Å; I1364-N1796 PolarHBondContact O-ND2 3.33Å; I1364-N1796 PolarHBondContact O-OD1 2.96Å; I1364-Q1893 HydrophobicContact CD1-CB 3.69Å; I1364-Q1893 HydrophobicContact CD1-CG 3.58Å; I1364-I1979 HydrophobicContact CD1-CD1 4.41Å; I1364-I1979 HydrophobicContact CG1-CD1 4.37Å
1365	V	89.1	Confident	89.1	Confident	1.8 Å²	1.8	22.4 Å²	22.4	1%	0.011	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	135.5	175.4	176.7	0	0	0	0	108.9	D1338 V1359 T1363 L1367 N1382 L1383 V1385	D1338-V1365 HydrophobicContact CB-CG1 4.09Å; V1359-V1365 HydrophobicContact CB-CG1 4.46Å; V1359-V1365 HydrophobicContact CB-CG2 4.06Å; V1359-V1365 HydrophobicContact CG1-CG1 4.08Å; V1359-V1365 HydrophobicContact CG1-CG2 4.42Å; V1359-V1365 HydrophobicContact CG2-CG2 4.08Å; T1363-V1365 HydrophobicContact CG2-CG2 4.3Å; V1365-L1367 HydrophobicContact CG1-CD2 3.79Å; V1365-L1367 HydrophobicContact CG1-CG 4.21Å; V1365-L1367 PolarHBondContact O-N 3.49Å; V1365-N1382 WeakPolarHBondContact O-CA 3.44Å; V1365-L1383 PolarHBondContact N-O 2.99Å; V1365-L1383 PolarHBondContact O-N 3.02Å; V1365-V1385 HydrophobicContact CB-CG2 4.19Å; V1365-V1385 HydrophobicContact CG2-CB 4.21Å; V1365-V1385 HydrophobicContact CG2-CG2 3.72Å
1366	Q	89.1	Confident	88.7	Confident	36.4 Å²	36.4	23.2 Å²	23.2	17%	0.17	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	91.7	174	-60.6	-160.2	-17.3	0	0	109	D1338 R1339 E1368 H1381 N1382	D1338-Q1366 WeakPolarHBondContact CA-O 3.26Å; R1339-Q1366 HydrophobicContact CB-CB 3.98Å; R1339-Q1366 VanDerWaalsContact CB-O 3.3Å; R1339-Q1366 WeakPolarHBondContact CB-O 3.25Å; R1339-Q1366 PolarHBondContact N-O 3.12Å; Q1366-E1368 PolarHBondContact O-N 3.13Å; Q1366-H1381 CarbonylContact C-O 3.43Å; Q1366-N1382 WeakPolarHBondContact CG-OD1 3.27Å; Q1366-N1382 PolarHBondContact NE2-OD1 3.48Å
1367	L	92.1	Very high	88.4	Confident	0 Å²	0	23 Å²	23	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	125.9	177.5	-60	170.5	0	0	0	109.1	V1319 V1336 S1337 L1357 V1365 F1369 V1380 H1381 L1383 M1393	V1319-L1367 HydrophobicContact CB-CD2 4.5Å; V1319-L1367 HydrophobicContact CG1-CD1 3.97Å; V1319-L1367 HydrophobicContact CG1-CD2 4.4Å; V1319-L1367 HydrophobicContact CG2-CD2 4.5Å; V1336-L1367 HydrophobicContact CG1-CD2 4.5Å; S1337-L1367 WeakPolarHBondContact O-CA 3.41Å; L1357-L1367 HydrophobicContact CD2-CD2 3.96Å; V1365-L1367 HydrophobicContact CG1-CD2 3.79Å; V1365-L1367 HydrophobicContact CG1-CG 4.21Å; V1365-L1367 PolarHBondContact O-N 3.49Å; L1367-F1369 HydrophobicContact CB-CE1 4.17Å; L1367-F1369 HydrophobicContact CB-CE2 4Å; L1367-F1369 HydrophobicContact CB-CZ 3.6Å; L1367-F1369 HydrophobicContact CD1-CZ 4.01Å; L1367-F1369 HydrophobicContact CG-CZ 4.44Å; L1367-V1380 CarbonylContact O-C 3.36Å; L1367-V1380 VanDerWaalsContact O-CA 3.24Å; L1367-V1380 WeakPolarHBondContact O-CA 3.32Å; L1367-H1381 PolarHBondContact N-O 3.01Å; L1367-H1381 PolarHBondContact O-N 2.86Å; L1367-L1383 HydrophobicContact CD1-CB 4.11Å; L1367-L1383 HydrophobicContact CD1-CD2 4.01Å; L1367-M1393 HydrophobicContact CD1-CE 4.29Å; L1367-M1393 HydrophobicContact CD1-SD 3.77Å
1368	E	90.2	Very high	88.1	Confident	23.6 Å²	23.6	25 Å²	25	11%	0.11	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	125.3	173.3	-178.7	178.7	-101.8	0	0	109.1	V1336 S1337 R1339 Q1366 L1370 A1379 V1380	V1336-E1368 WeakPolarHBondContact CA-O 3.39Å; S1337-E1368 PolarHBondContact N-O 2.7Å; S1337-E1368 PolarHBondContact O-N 3.2Å; R1339-E1368 HydrophobicContact CB-CB 4.09Å; R1339-E1368 VanDerWaalsContact CD-OE1 3.28Å; R1339-E1368 WeakPolarHBondContact CD-OE1 3.25Å; R1339-E1368 HydrophobicContact CG-CB 4.34Å; R1339-E1368 WeakPolarHBondContact CG-OE1 3.31Å; R1339-E1368 IonicContact CZ-OE1 3.29Å; R1339-E1368 IonicContact NE-OE1 3.47Å; R1339-E1368 PolarHBondContact NE-OE1 3.36Å; R1339-E1368 IonicContact NH2-OE1 3.36Å; Q1366-E1368 PolarHBondContact O-N 3.13Å; E1368-L1370 HydrophobicContact CG-CD1 4.36Å; E1368-L1370 HydrophobicContact CG-CD2 4.4Å; E1368-L1370 HydrophobicContact CG-CG 4.15Å; E1368-A1379 WeakPolarHBondContact CA-O 3.47Å; E1368-V1380 HydrophobicContact CG-CG2 4.42Å
1369	F	92	Very high	87.8	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	123.6	-179	-48.5	-77.3	0	0	0	109.6	I1323 R1335 V1336 F1355 L1367 S1378 A1379 H1381 M1393 F1396 M1398	I1323-F1369 HydrophobicContact CD1-CD1 3.49Å; I1323-F1369 VanDerWaalsContact CD1-CD1 3.45Å; I1323-F1369 HydrophobicContact CD1-CE1 3.47Å; I1323-F1369 VanDerWaalsContact CD1-CE1 3.47Å; I1323-F1369 HydrophobicContact CD1-CG 4.36Å; I1323-F1369 HydrophobicContact CD1-CZ 4.3Å; I1323-F1369 HydrophobicContact CG1-CD1 4.25Å; I1323-F1369 HydrophobicContact CG1-CE1 4.49Å; R1335-F1369 CarbonylContact O-C 3.35Å; R1335-F1369 VanDerWaalsContact O-CA 3.31Å; R1335-F1369 WeakPolarHBondContact O-CA 3.32Å; V1336-F1369 HydrophobicContact CB-CD1 4.33Å; V1336-F1369 HydrophobicContact CG1-CD1 3.73Å; V1336-F1369 HydrophobicContact CG1-CE1 3.58Å; V1336-F1369 HydrophobicContact CG2-CD1 3.9Å; V1336-F1369 HydrophobicContact CG2-CE1 4.31Å; F1355-F1369 HydrophobicContact CE1-CE1 4.31Å; F1355-F1369 HydrophobicContact CZ-CE1 4.25Å; L1367-F1369 HydrophobicContact CB-CE1 4.17Å; L1367-F1369 HydrophobicContact CB-CE2 4Å; L1367-F1369 HydrophobicContact CB-CZ 3.6Å; L1367-F1369 HydrophobicContact CD1-CZ 4.01Å; L1367-F1369 HydrophobicContact CG-CZ 4.44Å; F1369-S1378 WeakPolarHBondContact O-CA 3.33Å; F1369-A1379 HydrophobicContact CB-CB 4.27Å; F1369-A1379 HydrophobicContact CD2-CB 4.02Å; F1369-A1379 PolarHBondContact N-O 2.81Å; F1369-A1379 PolarHBondContact O-N 3.14Å; F1369-H1381 HydrophobicContact CE2-CB 3.69Å; F1369-H1381 HydrophobicContact CZ-CB 4.31Å; F1369-M1393 HydrophobicContact CE1-CE 3.89Å; F1369-M1393 HydrophobicContact CZ-CE 3.95Å; F1369-M1393 HydrophobicContact CZ-SD 4.44Å; F1369-F1396 AromaticContact CD2-CD1 3.93Å; F1369-F1396 HydrophobicContact CD2-CD1 3.98Å; F1369-F1396 AromaticContact CD2-CE1 3.5Å; F1369-F1396 HydrophobicContact CD2-CE1 3.5Å; F1369-F1396 VanDerWaalsContact CD2-CE1 3.47Å; F1369-F1396 AromaticContact CD2-CZ 3.92Å; F1369-F1396 HydrophobicContact CD2-CZ 3.92Å; F1369-F1396 AromaticContact CE2-CD1 3.87Å; F1369-F1396 HydrophobicContact CE2-CD1 3.87Å; F1369-F1396 HydrophobicContact CE2-CD2 4.31Å; F1369-F1396 AromaticContact CE2-CE1 3.58Å; F1369-F1396 HydrophobicContact CE2-CE1 3.58Å; F1369-F1396 HydrophobicContact CE2-CE2 4.06Å; F1369-F1396 HydrophobicContact CE2-CG 4.23Å; F1369-F1396 AromaticContact CE2-CZ 3.68Å; F1369-F1396 HydrophobicContact CE2-CZ 3.68Å; F1369-F1396 HydrophobicContact CG-CD1 4.42Å; F1369-F1396 HydrophobicContact CG-CE1 4.27Å; F1369-F1396 HydrophobicContact CZ-CD1 4.29Å; F1369-F1396 HydrophobicContact CZ-CE1 4.41Å; F1369-F1396 HydrophobicContact CZ-CG 4.38Å; F1369-M1398 HydrophobicContact CB-CE 4.06Å; F1369-M1398 HydrophobicContact CB-SD 3.91Å
1370	L	88.8	Confident	87.4	Confident	32.6 Å²	32.6	25.5 Å²	25.5	17%	0.171	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	117.9	-178.6	-61.5	171.6	0	0	0	110	R1335 E1368 T1374 S1378	R1335-L1370 HydrophobicContact CB-CB 4.35Å; R1335-L1370 PolarHBondContact N-O 3Å; R1335-L1370 PolarHBondContact O-N 3.23Å; E1368-L1370 HydrophobicContact CG-CD1 4.36Å; E1368-L1370 HydrophobicContact CG-CD2 4.4Å; E1368-L1370 HydrophobicContact CG-CG 4.15Å; L1370-T1374 HydrophobicContact CB-CG2 4.17Å; L1370-S1378 VanDerWaalsContact CD2-OG 3.27Å; L1370-S1378 WeakPolarHBondContact CD2-OG 3.31Å
1371	R	89.6	Confident	87.3	Confident	1.4 Å²	1.4	25.5 Å²	25.5	1%	0.005	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	135.4	172.7	172.5	54.6	164	61.3	7.1	108.6	L1239 S1270 F1331 W1332 C1334 P1373 T1374 F1377 M1398	L1239-R1371 PolarHBondContact O-NH1 3.01Å; L1239-R1371 PolarHBondContact O-NH2 3.05Å; L1239-R1371 VanDerWaalsContact O-NH2 3.12Å; S1270-R1371 VanDerWaalsContact CA-CZ 3.47Å; S1270-R1371 VanDerWaalsContact CA-NH1 3.3Å; S1270-R1371 VanDerWaalsContact O-CZ 3.28Å; S1270-R1371 PolarHBondContact O-NE 2.99Å; S1270-R1371 VanDerWaalsContact O-NE 3.08Å; S1270-R1371 PolarHBondContact O-NH2 2.86Å; F1331-R1371 HydrophobicContact CD2-CB 4.11Å; F1331-R1371 HydrophobicContact CD2-CG 4.04Å; F1331-R1371 HydrophobicContact CE2-CB 4.22Å; F1331-R1371 HydrophobicContact CE2-CG 4.11Å; F1331-R1371 HydrophobicContact CG-CG 4.32Å; F1331-R1371 HydrophobicContact CZ-CG 4.41Å; W1332-R1371 WeakPolarHBondContact O-CD 3.31Å; W1332-R1371 PolarHBondContact O-NE 3.11Å; W1332-R1371 VanDerWaalsContact O-NE 3.07Å; C1334-R1371 HydrophobicContact CB-CB 4.34Å; R1371-P1373 CarbonylContact O-C 3.56Å; R1371-P1373 VanDerWaalsContact O-O 3.11Å; R1371-T1374 VanDerWaalsContact O-CA 3.26Å; R1371-T1374 WeakPolarHBondContact O-CA 3.34Å; R1371-T1374 WeakPolarHBondContact O-CG2 3.31Å; R1371-T1374 PolarHBondContact O-N 3.1Å; R1371-F1377 HydrophobicContact CB-CB 3.94Å; R1371-F1377 HydrophobicContact CG-CB 4.46Å; R1371-F1377 HydrophobicContact CG-CD2 4.41Å; R1371-F1377 PolarHBondContact N-O 3.17Å; R1371-F1377 VanDerWaalsContact N-O 3.12Å; R1371-M1398 HydrophobicContact CB-CE 4.43Å
1372	Y	85.2	Confident	87.1	Confident	66.6 Å²	66.6	26.7 Å²	26.7	26%	0.261	15%	0.147	S	C	.	.	S	Bend	trans	-66.1	134.5	172.9	-179.5	-98.7	0	0	0	110.7	L1239 N1266 Q1269	L1239-Y1372 HydrophobicContact CD2-CD1 4.07Å; L1239-Y1372 HydrophobicContact CD2-CE1 3.75Å; N1266-Y1372 HydrophobicContact CB-CE1 4.48Å; N1266-Y1372 WeakPolarHBondContact OD1-CE1 3.25Å; N1266-Y1372 PolarHBondContact OD1-OH 2.89Å; Q1269-Y1372 HydrophobicContact CB-CD1 3.66Å; Q1269-Y1372 HydrophobicContact CB-CD2 4.22Å; Q1269-Y1372 HydrophobicContact CB-CE1 4.15Å; Q1269-Y1372 HydrophobicContact CB-CG 3.7Å; Q1269-Y1372 VanDerWaalsContact OE1-CD2 3.27Å
1373	P	84.9	Confident	87.2	Confident	16.8 Å²	16.8	27 Å²	27	11%	0.109	14%	0.144	C	C	.	.	S	Bend	cis	-72.8	123.5	-5.4	11.2	-7.6	0	0	0	112.4	L1239 R1371 D1375 Q1376 F1377	L1239-P1373 HydrophobicContact CD2-CG 4.42Å; R1371-P1373 CarbonylContact O-C 3.56Å; R1371-P1373 VanDerWaalsContact O-O 3.11Å; P1373-D1375 VanDerWaalsContact C-N 3.26Å; P1373-D1375 VanDerWaalsContact CB-OD1 3.29Å; P1373-D1375 WeakPolarHBondContact CB-OD1 3.41Å; P1373-D1375 PolarHBondContact O-N 2.99Å; P1373-Q1376 HydrophobicContact CB-CB 4.41Å; P1373-Q1376 HydrophobicContact CG-CB 4.04Å; P1373-Q1376 HydrophobicContact CG-CG 4.25Å; P1373-Q1376 VanDerWaalsContact CG-OE1 3.24Å; P1373-Q1376 WeakPolarHBondContact O-CA 3.49Å; P1373-Q1376 WeakPolarHBondContact O-CB 3.3Å; P1373-Q1376 PolarHBondContact O-N 3.04Å; P1373-F1377 PolarHBondContact O-N 3.07Å; P1373-F1377 VanDerWaalsContact O-N 3.09Å
1374	T	83.3	Confident	87.3	Confident	62.6 Å²	62.6	30 Å²	30	38%	0.384	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-11.6	-168	52.4	0	0	0	0	114.5	L1370 R1371 Q1376 S1378	L1370-T1374 HydrophobicContact CB-CG2 4.17Å; R1371-T1374 VanDerWaalsContact O-CA 3.26Å; R1371-T1374 WeakPolarHBondContact O-CA 3.34Å; R1371-T1374 WeakPolarHBondContact O-CG2 3.31Å; R1371-T1374 PolarHBondContact O-N 3.1Å; T1374-Q1376 VanDerWaalsContact C-N 3.31Å; T1374-S1378 VanDerWaalsContact O-CB 3.32Å; T1374-S1378 WeakPolarHBondContact O-CB 3.35Å
1375	D	79.1	Confident	87.6	Confident	105.8 Å²	105.8	27.9 Å²	27.9	57%	0.566	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-15.3	169.3	58.5	-57.3	0	0	0	112.8	P1373 K1402	P1373-D1375 VanDerWaalsContact C-N 3.26Å; P1373-D1375 VanDerWaalsContact CB-OD1 3.29Å; P1373-D1375 WeakPolarHBondContact CB-OD1 3.41Å; P1373-D1375 PolarHBondContact O-N 2.99Å; D1375-K1402 VanDerWaalsContact O-CE 3.25Å; D1375-K1402 WeakPolarHBondContact O-CE 3.19Å; D1375-K1402 WeakPolarHBondContact OD2-CE 3.39Å; D1375-K1402 IonicContact OD2-NZ 3.65Å; D1375-K1402 PolarHBondContact OD2-NZ 3Å
1376	Q	82.3	Confident	87.7	Confident	18.4 Å²	18.4	29 Å²	29	9%	0.086	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-50.2	170.1	-126.9	176.2	-43.9	0	0	110.7	P1373 T1374 S1378 D1400 A1401 K1402	P1373-Q1376 HydrophobicContact CB-CB 4.41Å; P1373-Q1376 HydrophobicContact CG-CB 4.04Å; P1373-Q1376 HydrophobicContact CG-CG 4.25Å; P1373-Q1376 VanDerWaalsContact CG-OE1 3.24Å; P1373-Q1376 WeakPolarHBondContact O-CA 3.49Å; P1373-Q1376 WeakPolarHBondContact O-CB 3.3Å; P1373-Q1376 PolarHBondContact O-N 3.04Å; T1374-Q1376 VanDerWaalsContact C-N 3.31Å; Q1376-S1378 PolarHBondContact O-N 3.26Å; Q1376-D1400 WeakPolarHBondContact CA-OD1 3.15Å; Q1376-D1400 WeakPolarHBondContact CB-OD1 3.25Å; Q1376-D1400 HydrophobicContact CG-CB 4.15Å; Q1376-D1400 VanDerWaalsContact CG-OD1 3.3Å; Q1376-D1400 WeakPolarHBondContact CG-OD1 3.29Å; Q1376-D1400 VanDerWaalsContact CG-OD2 3.29Å; Q1376-D1400 WeakPolarHBondContact CG-OD2 3.31Å; Q1376-D1400 VanDerWaalsContact NE2-CG 3.33Å; Q1376-D1400 PolarHBondContact NE2-OD1 3.34Å; Q1376-D1400 PolarHBondContact NE2-OD2 3.1Å; Q1376-A1401 VanDerWaalsContact O-CB 3.3Å; Q1376-A1401 WeakPolarHBondContact O-CB 3.36Å; Q1376-A1401 PolarHBondContact O-N 2.95Å; Q1376-A1401 VanDerWaalsContact O-N 3.08Å; Q1376-K1402 HydrophobicContact CB-CD 4.36Å; Q1376-K1402 HydrophobicContact CG-CD 3.87Å; Q1376-K1402 HydrophobicContact CG-CG 4.13Å; Q1376-K1402 VanDerWaalsContact CG-NZ 3.29Å
1377	F	86.5	Confident	87.8	Confident	2 Å²	2	29.5 Å²	29.5	1%	0.009	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	83.6	-172.7	-55.7	-71.9	0	0	0	112.2	L1235 Q1325 F1331 R1371 P1373 M1398 D1400	L1235-F1377 HydrophobicContact CD1-CE2 4.12Å; L1235-F1377 HydrophobicContact CD1-CZ 4.17Å; L1235-F1377 HydrophobicContact CD2-CE2 3.72Å; L1235-F1377 HydrophobicContact CD2-CZ 4.01Å; L1235-F1377 HydrophobicContact CG-CE2 4.41Å; L1235-F1377 HydrophobicContact CG-CZ 4.45Å; Q1325-F1377 HydrophobicContact CG-CE1 4.49Å; Q1325-F1377 VanDerWaalsContact OE1-CZ 3.23Å; F1331-F1377 HydrophobicContact CE2-CB 4.16Å; F1331-F1377 AromaticContact CE2-CD1 3.78Å; F1331-F1377 HydrophobicContact CE2-CD1 3.83Å; F1331-F1377 HydrophobicContact CE2-CE1 4.4Å; F1331-F1377 AromaticContact CE2-CG 3.94Å; F1331-F1377 HydrophobicContact CE2-CG 3.98Å; F1331-F1377 HydrophobicContact CZ-CB 4.48Å; F1331-F1377 AromaticContact CZ-CD1 3.64Å; F1331-F1377 HydrophobicContact CZ-CD1 3.64Å; F1331-F1377 HydrophobicContact CZ-CD2 4.34Å; F1331-F1377 AromaticContact CZ-CE1 3.81Å; F1331-F1377 HydrophobicContact CZ-CE1 3.81Å; F1331-F1377 HydrophobicContact CZ-CE2 4.32Å; F1331-F1377 AromaticContact CZ-CG 3.91Å; F1331-F1377 HydrophobicContact CZ-CG 3.91Å; F1331-F1377 HydrophobicContact CZ-CZ 4.24Å; R1371-F1377 HydrophobicContact CB-CB 3.94Å; R1371-F1377 HydrophobicContact CG-CB 4.46Å; R1371-F1377 HydrophobicContact CG-CD2 4.41Å; R1371-F1377 PolarHBondContact N-O 3.17Å; R1371-F1377 VanDerWaalsContact N-O 3.12Å; P1373-F1377 PolarHBondContact O-N 3.07Å; P1373-F1377 VanDerWaalsContact O-N 3.09Å; F1377-M1398 VanDerWaalsContact C-CE 3.44Å; F1377-M1398 HydrophobicContact CB-CE 3.9Å; F1377-M1398 WeakPolarHBondContact O-CE 3.37Å; F1377-D1400 HydrophobicContact CE1-CB 4.13Å; F1377-D1400 HydrophobicContact CZ-CB 4.36Å
1378	S	87.3	Confident	87.7	Confident	46.8 Å²	46.8	32.4 Å²	32.4	33%	0.327	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	127.8	171	175.3	0	0	0	0	109.7	F1369 L1370 T1374 Q1376 G1428	F1369-S1378 WeakPolarHBondContact O-CA 3.33Å; L1370-S1378 VanDerWaalsContact CD2-OG 3.27Å; L1370-S1378 WeakPolarHBondContact CD2-OG 3.31Å; T1374-S1378 VanDerWaalsContact O-CB 3.32Å; T1374-S1378 WeakPolarHBondContact O-CB 3.35Å; Q1376-S1378 PolarHBondContact O-N 3.26Å; S1378-G1428 WeakPolarHBondContact O-CA 3.39Å
1379	A	87.4	Confident	87.8	Confident	0.8 Å²	0.8	33.5 Å²	33.5	1%	0.007	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	154	180	0	0	0	0	0	112.8	E1368 F1369 F1396 M1398 F1427 G1428	E1368-A1379 WeakPolarHBondContact CA-O 3.47Å; F1369-A1379 HydrophobicContact CB-CB 4.27Å; F1369-A1379 HydrophobicContact CD2-CB 4.02Å; F1369-A1379 PolarHBondContact N-O 2.81Å; F1369-A1379 PolarHBondContact O-N 3.14Å; A1379-F1396 HydrophobicContact CB-CE1 3.82Å; A1379-F1396 HydrophobicContact CB-CZ 4.13Å; A1379-M1398 HydrophobicContact CB-CE 3.94Å; A1379-M1398 HydrophobicContact CB-CG 4.24Å; A1379-F1427 CarbonylContact C-O 3.57Å; A1379-F1427 VanDerWaalsContact CA-O 3.3Å; A1379-F1427 WeakPolarHBondContact CA-O 3.35Å; A1379-F1427 VanDerWaalsContact CB-O 3.25Å; A1379-F1427 WeakPolarHBondContact CB-O 3.38Å; A1379-G1428 VanDerWaalsContact CB-C 3.49Å
1380	V	86	Confident	87.9	Confident	14.2 Å²	14.2	34.2 Å²	34.2	9%	0.086	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	138.5	172.9	-180	0	0	0	0	108.7	L1367 E1368 D1426 F1427	L1367-V1380 CarbonylContact O-C 3.36Å; L1367-V1380 VanDerWaalsContact O-CA 3.24Å; L1367-V1380 WeakPolarHBondContact O-CA 3.32Å; E1368-V1380 HydrophobicContact CG-CG2 4.42Å; V1380-D1426 CarbonylContact O-C 3.58Å; V1380-D1426 VanDerWaalsContact O-CA 3.28Å; V1380-D1426 WeakPolarHBondContact O-CA 3.43Å; V1380-D1426 WeakPolarHBondContact O-CB 3.21Å; V1380-D1426 VanDerWaalsContact O-CG 3.3Å; V1380-F1427 PolarHBondContact N-O 3.29Å; V1380-F1427 PolarHBondContact O-N 2.93Å; V1380-F1427 VanDerWaalsContact O-N 3.09Å
1381	H	87.7	Confident	88.1	Confident	16.4 Å²	16.4	34.2 Å²	34.2	8%	0.076	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	138.7	174.7	-179.5	56.8	0	0	0	111.8	Q1366 L1367 F1369 M1393 F1396 D1426 L1431	Q1366-H1381 CarbonylContact C-O 3.43Å; L1367-H1381 PolarHBondContact N-O 3.01Å; L1367-H1381 PolarHBondContact O-N 2.86Å; F1369-H1381 HydrophobicContact CE2-CB 3.69Å; F1369-H1381 HydrophobicContact CZ-CB 4.31Å; H1381-M1393 VanDerWaalsContact CD2-CE 3.46Å; H1381-M1393 WeakPolarHBondContact CD2-CE 3.27Å; H1381-F1396 HydrophobicContact CB-CD2 4.45Å; H1381-F1396 HydrophobicContact CB-CE2 3.72Å; H1381-F1396 HydrophobicContact CB-CZ 4.12Å; H1381-F1396 AromaticContact CG-CE2 3.88Å; H1381-D1426 VanDerWaalsContact CA-OD1 3.24Å; H1381-D1426 WeakPolarHBondContact CA-OD1 3.32Å; H1381-D1426 IonicContact CE1-OD1 3.4Å; H1381-D1426 IonicContact CE1-OD2 3.19Å; H1381-D1426 PolarHBondContact CE1-OD2 3.28Å; H1381-D1426 IonicContact CG-OD1 3.52Å; H1381-D1426 IonicContact CG-OD2 3.75Å; H1381-D1426 IonicContact ND1-OD1 3.04Å; H1381-D1426 PolarHBondContact ND1-OD1 2.9Å; H1381-D1426 IonicContact ND1-OD2 3.09Å; H1381-D1426 PolarHBondContact ND1-OD2 3.34Å; H1381-L1431 WeakPolarHBondContact NE2-CD1 3.4Å
1382	N	86.6	Confident	88.3	Confident	25 Å²	25	35.3 Å²	35.3	13%	0.134	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	107.6	-177.9	-65.3	-84.1	0	0	0	110.9	I1364 V1365 Q1366 S1424 G1425 D1426 Q1893 R1910	I1364-N1382 HydrophobicContact CG2-CB 3.95Å; V1365-N1382 WeakPolarHBondContact O-CA 3.44Å; Q1366-N1382 WeakPolarHBondContact CG-OD1 3.27Å; Q1366-N1382 PolarHBondContact NE2-OD1 3.48Å; N1382-S1424 PolarHBondContact ND2-O 3.12Å; N1382-G1425 VanDerWaalsContact ND2-CA 3.31Å; N1382-G1425 WeakPolarHBondContact ND2-CA 3.38Å; N1382-G1425 PolarHBondContact ND2-O 3.02Å; N1382-G1425 VanDerWaalsContact ND2-O 3.13Å; N1382-D1426 PolarHBondContact N-OD1 3.05Å; N1382-D1426 PolarHBondContact ND2-OD1 2.45Å; N1382-Q1893 PolarHBondContact ND2-NE2 3.4Å; N1382-R1910 PolarHBondContact ND2-NH2 3.13Å
1383	L	89.3	Confident	88.5	Confident	26.4 Å²	26.4	32.7 Å²	32.7	14%	0.138	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	124.3	-175.3	-179	64.9	0	0	0	111.8	V1319 I1364 V1365 L1367 V1385 I1391 M1393	V1319-L1383 HydrophobicContact CB-CD2 4.46Å; V1319-L1383 HydrophobicContact CG1-CD2 3.65Å; V1319-L1383 HydrophobicContact CG2-CD2 3.95Å; I1364-L1383 CarbonylContact C-O 3.4Å; I1364-L1383 WeakPolarHBondContact CA-O 3.4Å; V1365-L1383 PolarHBondContact N-O 2.99Å; V1365-L1383 PolarHBondContact O-N 3.02Å; L1367-L1383 HydrophobicContact CD1-CB 4.11Å; L1367-L1383 HydrophobicContact CD1-CD2 4.01Å; L1383-V1385 HydrophobicContact CD2-CG2 4.25Å; L1383-V1385 HydrophobicContact CG-CG2 4.16Å; L1383-V1385 PolarHBondContact O-N 2.95Å; L1383-I1391 HydrophobicContact CD2-CG2 4.38Å; L1383-M1393 HydrophobicContact CD2-CB 4.22Å; L1383-M1393 HydrophobicContact CD2-SD 4.39Å
1384	Y	90.2	Very high	88.8	Confident	88.8 Å²	88.8	32 Å²	32	35%	0.348	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	127	168.3	179.9	-104.1	0	0	0	111	T1363 I1364 P1386 I1979	T1363-Y1384 WeakPolarHBondContact O-CD2 3.36Å; I1364-Y1384 HydrophobicContact CG1-CD2 4.19Å; Y1384-P1386 HydrophobicContact CD1-CG 4.36Å; Y1384-P1386 HydrophobicContact CE1-CB 4.44Å; Y1384-P1386 HydrophobicContact CE1-CG 3.98Å; Y1384-I1979 HydrophobicContact CD1-CD1 4.23Å; Y1384-I1979 HydrophobicContact CD1-CG1 4.24Å; Y1384-I1979 HydrophobicContact CD1-CG2 3.89Å; Y1384-I1979 HydrophobicContact CD2-CD1 3.49Å; Y1384-I1979 VanDerWaalsContact CD2-CD1 3.41Å; Y1384-I1979 HydrophobicContact CD2-CG1 4.36Å; Y1384-I1979 HydrophobicContact CE1-CG2 3.67Å; Y1384-I1979 HydrophobicContact CE2-CD1 4.08Å; Y1384-I1979 HydrophobicContact CE2-CG2 4.38Å; Y1384-I1979 HydrophobicContact CG-CD1 3.56Å; Y1384-I1979 HydrophobicContact CG-CG1 3.99Å; Y1384-I1979 HydrophobicContact CG-CG2 4.33Å
1385	V	92.3	Very high	89.2	Confident	0 Å²	0	31 Å²	31	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	110.4	-178.3	-175	0	0	0	0	109.7	S1317 V1319 V1359 G1361 G1362 T1363 V1365 L1383 I1391	S1317-V1385 VanDerWaalsContact CB-CG1 3.45Å; V1319-V1385 HydrophobicContact CG2-CG1 4.38Å; V1319-V1385 HydrophobicContact CG2-CG2 3.56Å; V1359-V1385 HydrophobicContact CG2-CB 4.35Å; V1359-V1385 HydrophobicContact CG2-CG1 3.85Å; V1359-V1385 HydrophobicContact CG2-CG2 4.26Å; G1361-V1385 CarbonylContact C-O 3.49Å; G1361-V1385 VanDerWaalsContact CA-O 3.3Å; G1361-V1385 WeakPolarHBondContact CA-O 3.33Å; G1362-V1385 PolarHBondContact N-O 2.99Å; T1363-V1385 PolarHBondContact O-N 3.15Å; T1363-V1385 VanDerWaalsContact O-N 3.09Å; V1365-V1385 HydrophobicContact CB-CG2 4.19Å; V1365-V1385 HydrophobicContact CG2-CB 4.21Å; V1365-V1385 HydrophobicContact CG2-CG2 3.72Å; L1383-V1385 HydrophobicContact CD2-CG2 4.25Å; L1383-V1385 HydrophobicContact CG-CG2 4.16Å; L1383-V1385 PolarHBondContact O-N 2.95Å; V1385-I1391 HydrophobicContact CG1-CG1 4.16Å
1386	P	91.8	Very high	89.8	Confident	25 Å²	25	25.9 Å²	25.9	16%	0.162	14%	0.137	C	C	.	.			trans	-60.3	152	170.9	-20.8	32.1	0	0	0	112.2	S1317 Y1384 Q1389 I1391	S1317-P1386 WeakPolarHBondContact CB-O 3.28Å; S1317-P1386 PolarHBondContact OG-O 3.23Å; Y1384-P1386 HydrophobicContact CD1-CG 4.36Å; Y1384-P1386 HydrophobicContact CE1-CB 4.44Å; Y1384-P1386 HydrophobicContact CE1-CG 3.98Å; P1386-Q1389 HydrophobicContact CB-CB 4.45Å; P1386-Q1389 HydrophobicContact CB-CG 4.23Å; P1386-I1391 HydrophobicContact CG-CD1 4.15Å
1387	V	91.1	Very high	90.1	Very high	47.2 Å²	47.2	25.4 Å²	25.4	29%	0.286	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	142.8	177.6	-82.6	0	0	0	0	112.9	R1314 R1315 S1317 G1361 Q1389 L2115	R1314-V1387 WeakPolarHBondContact O-CG1 3.46Å; R1315-V1387 HydrophobicContact CB-CG1 4.01Å; R1315-V1387 HydrophobicContact CB-CG2 4.47Å; R1315-V1387 HydrophobicContact CG-CG1 4.12Å; R1315-V1387 HydrophobicContact CG-CG2 4.41Å; S1317-V1387 WeakPolarHBondContact OG-CA 3.36Å; G1361-V1387 VanDerWaalsContact C-CG1 3.42Å; G1361-V1387 VanDerWaalsContact C-CG2 3.49Å; G1361-V1387 WeakPolarHBondContact O-CG1 3.16Å; V1387-Q1389 VanDerWaalsContact C-N 3.32Å; V1387-Q1389 PolarHBondContact O-N 2.85Å; V1387-L2115 HydrophobicContact CB-CD1 4.39Å; V1387-L2115 HydrophobicContact CG1-CD1 3.49Å; V1387-L2115 VanDerWaalsContact CG1-CD1 3.49Å; V1387-L2115 HydrophobicContact CG2-CD1 4.05Å
1388	N	90.9	Very high	90.2	Very high	59 Å²	59	25.3 Å²	25.3	32%	0.316	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	38	176.9	-56.8	-72.4	0	0	0	114.3	F1293 R1314 I1316 S1317	F1293-N1388 HydrophobicContact CB-CB 3.94Å; F1293-N1388 HydrophobicContact CD1-CB 3.94Å; F1293-N1388 WeakPolarHBondContact CD1-OD1 3.46Å; F1293-N1388 HydrophobicContact CD2-CB 4.5Å; F1293-N1388 WeakPolarHBondContact CD2-O 3.19Å; F1293-N1388 WeakPolarHBondContact CE2-O 3.27Å; F1293-N1388 HydrophobicContact CG-CB 3.9Å; R1314-N1388 PolarHBondContact O-ND2 3.27Å; R1314-N1388 PolarHBondContact O-OD1 3.35Å; I1316-N1388 VanDerWaalsContact O-CA 3.29Å; I1316-N1388 WeakPolarHBondContact O-CA 3.32Å; I1316-N1388 PolarHBondContact O-N 3.24Å; I1316-N1388 VanDerWaalsContact O-N 3.17Å; I1316-N1388 PolarHBondContact O-OD1 3.08Å; S1317-N1388 PolarHBondContact OG-N 3.11Å
1389	Q	92.1	Very high	90	Very high	47 Å²	47	25.5 Å²	25.5	22%	0.22	13%	0.128	C	C	.	.			trans	-128.2	155	178.9	-64.9	-168	14.4	0	0	112.8	S1317 V1318 P1386 V1387 I1391 E1590	S1317-Q1389 WeakPolarHBondContact CA-O 3.27Å; S1317-Q1389 VanDerWaalsContact CB-O 3.26Å; S1317-Q1389 WeakPolarHBondContact CB-O 3.35Å; S1317-Q1389 PolarHBondContact OG-N 3.16Å; S1317-Q1389 VanDerWaalsContact OG-N 3.11Å; S1317-Q1389 PolarHBondContact OG-O 2.77Å; V1318-Q1389 PolarHBondContact N-O 3.2Å; P1386-Q1389 HydrophobicContact CB-CB 4.45Å; P1386-Q1389 HydrophobicContact CB-CG 4.23Å; V1387-Q1389 VanDerWaalsContact C-N 3.32Å; V1387-Q1389 PolarHBondContact O-N 2.85Å; Q1389-I1391 HydrophobicContact CB-CD1 3.97Å; Q1389-I1391 HydrophobicContact CB-CG1 4.37Å; Q1389-E1590 VanDerWaalsContact NE2-CD 3.31Å; Q1389-E1590 PolarHBondContact NE2-OE2 3.15Å
1390	I	94.1	Very high	89.7	Confident	15.2 Å²	15.2	25.9 Å²	25.9	8%	0.078	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	107.2	166.9	-54.7	158.6	0	0	0	106.7	F1293 V1318 R1320 G1556 D1579 Y1581	F1293-I1390 HydrophobicContact CE2-CD1 4.44Å; F1293-I1390 HydrophobicContact CE2-CG1 4Å; F1293-I1390 HydrophobicContact CZ-CG1 3.91Å; V1318-I1390 HydrophobicContact CB-CG1 4.39Å; V1318-I1390 HydrophobicContact CB-CG2 4.33Å; V1318-I1390 HydrophobicContact CG1-CG2 4.46Å; V1318-I1390 CarbonylContact O-C 3.31Å; V1318-I1390 WeakPolarHBondContact O-CA 3.28Å; R1320-I1390 HydrophobicContact CG-CG2 4.19Å; I1390-G1556 WeakPolarHBondContact O-CA 3.41Å; I1390-G1556 PolarHBondContact O-N 3.11Å; I1390-D1579 HydrophobicContact CD1-CB 4.23Å; I1390-Y1581 HydrophobicContact CD1-CD2 4.18Å; I1390-Y1581 HydrophobicContact CD1-CE2 3.8Å; I1390-Y1581 HydrophobicContact CG1-CE2 4.4Å; I1390-Y1581 HydrophobicContact CG2-CE2 4.23Å
1391	I	93.3	Very high	89	Confident	33.4 Å²	33.4	27.2 Å²	27.2	17%	0.171	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	124.5	-178.3	-59.3	-57.4	0	0	0	109.5	V1318 R1320 L1383 V1385 P1386 Q1389	V1318-I1391 PolarHBondContact O-N 2.94Å; R1320-I1391 VanDerWaalsContact CG-O 3.25Å; R1320-I1391 WeakPolarHBondContact CG-O 3.42Å; R1320-I1391 PolarHBondContact N-O 3.01Å; L1383-I1391 HydrophobicContact CD2-CG2 4.38Å; V1385-I1391 HydrophobicContact CG1-CG1 4.16Å; P1386-I1391 HydrophobicContact CG-CD1 4.15Å; Q1389-I1391 HydrophobicContact CB-CD1 3.97Å; Q1389-I1391 HydrophobicContact CB-CG1 4.37Å
1392	N	92.6	Very high	88.1	Confident	24.4 Å²	24.4	30.5 Å²	30.5	13%	0.13	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	109.2	172.3	-167.5	-30.1	0	0	0	108.9	R1320 G1394 G1556 R1558	R1320-N1392 HydrophobicContact CG-CB 4.16Å; R1320-N1392 CarbonylContact O-C 3.56Å; R1320-N1392 WeakPolarHBondContact O-CA 3.36Å; N1392-G1394 VanDerWaalsContact C-N 3.33Å; N1392-G1394 WeakPolarHBondContact OD1-CA 3.33Å; N1392-G1394 PolarHBondContact OD1-N 3.04Å; N1392-G1556 PolarHBondContact ND2-O 2.79Å; N1392-G1556 VanDerWaalsContact ND2-O 3.11Å; N1392-R1558 HydrophobicContact CB-CB 4.45Å; N1392-R1558 WeakPolarHBondContact ND2-CB 3.43Å; N1392-R1558 PolarHBondContact O-NH2 3.19Å
1393	M	90.5	Very high	87	Confident	11 Å²	11	33.4 Å²	33.4	5%	0.054	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	-25.4	175.2	72.4	-171.3	-103.7	0	0	111.8	V1319 R1320 I1323 F1355 L1367 F1369 H1381 L1383 F1396 L1431 R1558	V1319-M1393 HydrophobicContact CG1-SD 4.05Å; R1320-M1393 PolarHBondContact O-N 2.94Å; I1323-M1393 HydrophobicContact CD1-CE 4.07Å; F1355-M1393 HydrophobicContact CE1-CE 3.64Å; F1355-M1393 HydrophobicContact CE1-SD 4.22Å; F1355-M1393 HydrophobicContact CZ-CE 3.69Å; F1355-M1393 HydrophobicContact CZ-CG 4.48Å; F1355-M1393 HydrophobicContact CZ-SD 3.7Å; L1367-M1393 HydrophobicContact CD1-CE 4.29Å; L1367-M1393 HydrophobicContact CD1-SD 3.77Å; F1369-M1393 HydrophobicContact CE1-CE 3.89Å; F1369-M1393 HydrophobicContact CZ-CE 3.95Å; F1369-M1393 HydrophobicContact CZ-SD 4.44Å; H1381-M1393 VanDerWaalsContact CD2-CE 3.46Å; H1381-M1393 WeakPolarHBondContact CD2-CE 3.27Å; L1383-M1393 HydrophobicContact CD2-CB 4.22Å; L1383-M1393 HydrophobicContact CD2-SD 4.39Å; M1393-F1396 HydrophobicContact CE-CB 3.85Å; M1393-F1396 HydrophobicContact CE-CD2 4Å; M1393-F1396 HydrophobicContact CE-CG 4.19Å; M1393-L1431 HydrophobicContact CB-CD2 4.33Å; M1393-L1431 HydrophobicContact CE-CD1 4.5Å; M1393-L1431 HydrophobicContact CE-CD2 3.66Å; M1393-L1431 HydrophobicContact CE-CG 4.24Å; M1393-L1431 HydrophobicContact CG-CD2 4.31Å; M1393-R1558 VanDerWaalsContact C-NH1 3.3Å; M1393-R1558 PolarHBondContact O-NH1 3.11Å
1394	G	90.4	Very high	85.5	Confident	2 Å²	2	36 Å²	36	2%	0.021	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	83.8	-145.6	-173.8	0	0	0	0	0	112.5	G1321 V1322 N1392	G1321-G1394 CarbonylContact C-O 3.56Å; G1321-G1394 VanDerWaalsContact CA-O 3.27Å; G1321-G1394 WeakPolarHBondContact CA-O 3.29Å; V1322-G1394 PolarHBondContact N-O 3.32Å; N1392-G1394 VanDerWaalsContact C-N 3.33Å; N1392-G1394 WeakPolarHBondContact OD1-CA 3.33Å; N1392-G1394 PolarHBondContact OD1-N 3.04Å
1395	D	91	Very high	83.7	Confident	41.2 Å²	41.2	35.7 Å²	35.7	22%	0.22	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	119	-169.3	-60.8	34.8	0	0	0	110.4	V1322 R1324 Y1397 L1431 G1432	V1322-D1395 HydrophobicContact CB-CB 4.37Å; V1322-D1395 WeakPolarHBondContact CB-OD1 3.15Å; V1322-D1395 WeakPolarHBondContact CG2-OD1 3.09Å; V1322-D1395 CarbonylContact O-C 3.44Å; V1322-D1395 WeakPolarHBondContact O-CA 3.26Å; R1324-D1395 IonicContact CZ-OD2 3.46Å; R1324-D1395 VanDerWaalsContact CZ-OD2 3.23Å; R1324-D1395 VanDerWaalsContact NE-CG 3.34Å; R1324-D1395 IonicContact NE-OD2 3.24Å; R1324-D1395 PolarHBondContact NE-OD2 3.09Å; R1324-D1395 IonicContact NH2-OD2 3.27Å; R1324-D1395 PolarHBondContact NH2-OD2 2.99Å; D1395-Y1397 HydrophobicContact CB-CE2 3.75Å; D1395-Y1397 WeakPolarHBondContact O-CD2 3.41Å; D1395-Y1397 WeakPolarHBondContact O-CE2 3.33Å; D1395-L1431 WeakPolarHBondContact O-CD2 3.45Å; D1395-G1432 PolarHBondContact O-N 2.97Å
1396	F	92.1	Very high	81.3	Confident	0.2 Å²	0.2	41.4 Å²	41.4	0%	0.001	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	125.5	176.7	-174.5	-93.6	0	0	0	109.5	V1322 I1323 R1324 F1369 A1379 H1381 M1393 M1398 G1429 T1430 L1431	V1322-F1396 PolarHBondContact O-N 3.07Å; I1323-F1396 WeakPolarHBondContact CA-O 2.99Å; I1323-F1396 HydrophobicContact CD1-CB 4.1Å; I1323-F1396 HydrophobicContact CD1-CD1 4.35Å; I1323-F1396 HydrophobicContact CD1-CG 4.47Å; R1324-F1396 PolarHBondContact N-O 3.04Å; F1369-F1396 AromaticContact CD2-CD1 3.93Å; F1369-F1396 HydrophobicContact CD2-CD1 3.98Å; F1369-F1396 AromaticContact CD2-CE1 3.5Å; F1369-F1396 HydrophobicContact CD2-CE1 3.5Å; F1369-F1396 VanDerWaalsContact CD2-CE1 3.47Å; F1369-F1396 AromaticContact CD2-CZ 3.92Å; F1369-F1396 HydrophobicContact CD2-CZ 3.92Å; F1369-F1396 AromaticContact CE2-CD1 3.87Å; F1369-F1396 HydrophobicContact CE2-CD1 3.87Å; F1369-F1396 HydrophobicContact CE2-CD2 4.31Å; F1369-F1396 AromaticContact CE2-CE1 3.58Å; F1369-F1396 HydrophobicContact CE2-CE1 3.58Å; F1369-F1396 HydrophobicContact CE2-CE2 4.06Å; F1369-F1396 HydrophobicContact CE2-CG 4.23Å; F1369-F1396 AromaticContact CE2-CZ 3.68Å; F1369-F1396 HydrophobicContact CE2-CZ 3.68Å; F1369-F1396 HydrophobicContact CG-CD1 4.42Å; F1369-F1396 HydrophobicContact CG-CE1 4.27Å; F1369-F1396 HydrophobicContact CZ-CD1 4.29Å; F1369-F1396 HydrophobicContact CZ-CE1 4.41Å; F1369-F1396 HydrophobicContact CZ-CG 4.38Å; A1379-F1396 HydrophobicContact CB-CE1 3.82Å; A1379-F1396 HydrophobicContact CB-CZ 4.13Å; H1381-F1396 HydrophobicContact CB-CD2 4.45Å; H1381-F1396 HydrophobicContact CB-CE2 3.72Å; H1381-F1396 HydrophobicContact CB-CZ 4.12Å; H1381-F1396 AromaticContact CG-CE2 3.88Å; M1393-F1396 HydrophobicContact CE-CB 3.85Å; M1393-F1396 HydrophobicContact CE-CD2 4Å; M1393-F1396 HydrophobicContact CE-CG 4.19Å; F1396-M1398 HydrophobicContact CD1-CG 4.08Å; F1396-M1398 HydrophobicContact CE1-CG 3.95Å; F1396-G1429 VanDerWaalsContact CZ-C 3.49Å; F1396-T1430 CarbonylContact C-O 3.43Å; F1396-T1430 WeakPolarHBondContact CA-O 3.2Å; F1396-T1430 WeakPolarHBondContact CD2-O 3.34Å; F1396-L1431 HydrophobicContact CB-CD2 4.23Å; F1396-L1431 HydrophobicContact CD2-CD2 4.07Å; F1396-L1431 HydrophobicContact CD2-CG 4.13Å
1397	Y	89.3	Confident	78.6	Confident	8.2 Å²	8.2	47.4 Å²	47.4	3%	0.032	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	114.6	-172.6	-63.4	-103.6	0	0	0	108.6	R1324 Q1325 D1395 G1429 T1430 G1438 D1439 T1442	R1324-Y1397 HydrophobicContact CB-CD1 4.17Å; R1324-Y1397 HydrophobicContact CB-CE1 4.35Å; R1324-Y1397 CarbonylContact O-C 3.45Å; R1324-Y1397 WeakPolarHBondContact O-CA 3.31Å; Q1325-Y1397 VanDerWaalsContact O-CD1 3.29Å; Q1325-Y1397 WeakPolarHBondContact O-CD1 3.4Å; D1395-Y1397 HydrophobicContact CB-CE2 3.75Å; D1395-Y1397 WeakPolarHBondContact O-CD2 3.41Å; D1395-Y1397 WeakPolarHBondContact O-CE2 3.33Å; Y1397-G1429 CarbonylContact O-C 3.48Å; Y1397-G1429 WeakPolarHBondContact O-CA 3.37Å; Y1397-T1430 PolarHBondContact N-O 3.2Å; Y1397-T1430 PolarHBondContact O-N 3.12Å; Y1397-G1438 WeakPolarHBondContact OH-CA 3.49Å; Y1397-D1439 HydrophobicContact CE1-CB 4.35Å; Y1397-D1439 PolarHBondContact OH-N 2.97Å; Y1397-T1442 HydrophobicContact CD1-CG2 4Å; Y1397-T1442 HydrophobicContact CE1-CG2 4.04Å; Y1397-T1442 HydrophobicContact CG-CG2 4.1Å
1398	M	88	Confident	76.1	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	139.8	174.6	-67	-177.6	71.5	0	0	110.4	I1323 R1324 Q1325 W1326 F1331 F1369 R1371 F1377 A1379 F1396 G1428	I1323-M1398 HydrophobicContact CG2-CG 3.98Å; I1323-M1398 HydrophobicContact CG2-SD 3.58Å; I1323-M1398 VanDerWaalsContact CG2-SD 3.57Å; R1324-M1398 PolarHBondContact O-N 3Å; Q1325-M1398 CarbonylContact C-O 3.44Å; Q1325-M1398 WeakPolarHBondContact CA-O 3.42Å; W1326-M1398 PolarHBondContact N-O 3.13Å; F1331-M1398 HydrophobicContact CD2-CB 4.37Å; F1331-M1398 HydrophobicContact CD2-CG 4.45Å; F1331-M1398 HydrophobicContact CD2-SD 3.77Å; F1331-M1398 HydrophobicContact CE2-CB 3.85Å; F1331-M1398 HydrophobicContact CE2-CE 4.49Å; F1331-M1398 HydrophobicContact CE2-CG 4.38Å; F1331-M1398 HydrophobicContact CE2-SD 3.9Å; F1369-M1398 HydrophobicContact CB-CE 4.06Å; F1369-M1398 HydrophobicContact CB-SD 3.91Å; R1371-M1398 HydrophobicContact CB-CE 4.43Å; F1377-M1398 VanDerWaalsContact C-CE 3.44Å; F1377-M1398 HydrophobicContact CB-CE 3.9Å; F1377-M1398 WeakPolarHBondContact O-CE 3.37Å; A1379-M1398 HydrophobicContact CB-CE 3.94Å; A1379-M1398 HydrophobicContact CB-CG 4.24Å; F1396-M1398 HydrophobicContact CD1-CG 4.08Å; F1396-M1398 HydrophobicContact CE1-CG 3.95Å; M1398-G1428 WeakPolarHBondContact CA-O 3.27Å
1399	Y	83.5	Confident	73.5	Confident	51 Å²	51	52.1 Å²	52.1	20%	0.2	28%	0.277	C	S	.	.			trans	-102.5	155.6	175.4	-59.5	-73.9	0	0	0	110.3	W1326 A1401 L1404 I1413 G1428 T1430 T1442	W1326-Y1399 HydrophobicContact CB-CD1 3.53Å; W1326-Y1399 VanDerWaalsContact CB-CD1 3.44Å; W1326-Y1399 HydrophobicContact CB-CE1 3.82Å; W1326-Y1399 HydrophobicContact CB-CG 4.4Å; W1326-Y1399 HydrophobicContact CG-CD1 4.31Å; Y1399-A1401 PolarHBondContact O-N 3Å; Y1399-L1404 HydrophobicContact CG-CD1 4.37Å; Y1399-I1413 HydrophobicContact CE1-CD1 4.39Å; Y1399-G1428 PolarHBondContact N-O 2.97Å; Y1399-T1430 HydrophobicContact CE2-CG2 4Å; Y1399-T1430 VanDerWaalsContact OH-CG2 3.27Å; Y1399-T1430 WeakPolarHBondContact OH-CG2 3.32Å; Y1399-T1442 HydrophobicContact CE1-CG2 4.02Å; Y1399-T1442 WeakPolarHBondContact OH-CG2 3.18Å
1400	D	80.4	Confident	70.7	Confident	8 Å²	8	53.1 Å²	53.1	4%	0.043	29%	0.288	C	S	.	.			trans	-73.7	119.7	166.7	-177.7	-3	0	0	0	110.4	Q1376 F1377 K1402 Q1403 L1404	Q1376-D1400 WeakPolarHBondContact CA-OD1 3.15Å; Q1376-D1400 WeakPolarHBondContact CB-OD1 3.25Å; Q1376-D1400 HydrophobicContact CG-CB 4.15Å; Q1376-D1400 VanDerWaalsContact CG-OD1 3.3Å; Q1376-D1400 WeakPolarHBondContact CG-OD1 3.29Å; Q1376-D1400 VanDerWaalsContact CG-OD2 3.29Å; Q1376-D1400 WeakPolarHBondContact CG-OD2 3.31Å; Q1376-D1400 VanDerWaalsContact NE2-CG 3.33Å; Q1376-D1400 PolarHBondContact NE2-OD1 3.34Å; Q1376-D1400 PolarHBondContact NE2-OD2 3.1Å; F1377-D1400 HydrophobicContact CE1-CB 4.13Å; F1377-D1400 HydrophobicContact CZ-CB 4.36Å; D1400-K1402 VanDerWaalsContact C-N 3.27Å; D1400-K1402 VanDerWaalsContact CG-N 3.3Å; D1400-K1402 PolarHBondContact O-N 2.73Å; D1400-K1402 WeakPolarHBondContact OD1-CA 3.22Å; D1400-K1402 VanDerWaalsContact OD1-CB 3.31Å; D1400-K1402 WeakPolarHBondContact OD1-CB 3.33Å; D1400-K1402 WeakPolarHBondContact OD1-CG 3.44Å; D1400-K1402 PolarHBondContact OD1-N 2.83Å; D1400-K1402 WeakPolarHBondContact OD2-CA 3.45Å; D1400-K1402 VanDerWaalsContact OD2-CB 3.29Å; D1400-K1402 WeakPolarHBondContact OD2-CB 3.39Å; D1400-K1402 PolarHBondContact OD2-N 2.81Å; D1400-Q1403 HydrophobicContact CB-CB 4.28Å; D1400-Q1403 HydrophobicContact CB-CG 4.19Å; D1400-Q1403 PolarHBondContact O-N 3.11Å; D1400-Q1403 PolarHBondContact OD2-N 3.48Å; D1400-L1404 WeakPolarHBondContact O-CD1 3.27Å; D1400-L1404 PolarHBondContact O-N 3.23Å
1401	A	72	Confident	67.8	Low	40.8 Å²	40.8	57.3 Å²	57.3	34%	0.337	31%	0.314	S	S	.	.	H	α-helix	trans	-62	-26.8	175.6	0	0	0	0	0	113.6	Q1376 Y1399 L1404 S1405	Q1376-A1401 VanDerWaalsContact O-CB 3.3Å; Q1376-A1401 WeakPolarHBondContact O-CB 3.36Å; Q1376-A1401 PolarHBondContact O-N 2.95Å; Q1376-A1401 VanDerWaalsContact O-N 3.08Å; Y1399-A1401 PolarHBondContact O-N 3Å; A1401-L1404 WeakPolarHBondContact O-CB 3.49Å; A1401-L1404 PolarHBondContact O-N 3.03Å; A1401-S1405 PolarHBondContact O-N 3.12Å; A1401-S1405 VanDerWaalsContact O-N 3.17Å
1402	K	68.4	Low	64.9	Low	87 Å²	87	58.9 Å²	58.9	38%	0.378	33%	0.326	S	S	.	.	H	α-helix	trans	-73.3	-43.3	177.3	-61.4	175.6	-174.9	161.4	0	111.5	D1375 Q1376 D1400 L1404 S1405 N1406	D1375-K1402 VanDerWaalsContact O-CE 3.25Å; D1375-K1402 WeakPolarHBondContact O-CE 3.19Å; D1375-K1402 WeakPolarHBondContact OD2-CE 3.39Å; D1375-K1402 IonicContact OD2-NZ 3.65Å; D1375-K1402 PolarHBondContact OD2-NZ 3Å; Q1376-K1402 HydrophobicContact CB-CD 4.36Å; Q1376-K1402 HydrophobicContact CG-CD 3.87Å; Q1376-K1402 HydrophobicContact CG-CG 4.13Å; Q1376-K1402 VanDerWaalsContact CG-NZ 3.29Å; D1400-K1402 VanDerWaalsContact C-N 3.27Å; D1400-K1402 VanDerWaalsContact CG-N 3.3Å; D1400-K1402 PolarHBondContact O-N 2.73Å; D1400-K1402 WeakPolarHBondContact OD1-CA 3.22Å; D1400-K1402 VanDerWaalsContact OD1-CB 3.31Å; D1400-K1402 WeakPolarHBondContact OD1-CB 3.33Å; D1400-K1402 WeakPolarHBondContact OD1-CG 3.44Å; D1400-K1402 PolarHBondContact OD1-N 2.83Å; D1400-K1402 WeakPolarHBondContact OD2-CA 3.45Å; D1400-K1402 VanDerWaalsContact OD2-CB 3.29Å; D1400-K1402 WeakPolarHBondContact OD2-CB 3.39Å; D1400-K1402 PolarHBondContact OD2-N 2.81Å; K1402-L1404 VanDerWaalsContact C-N 3.29Å; K1402-L1404 PolarHBondContact O-N 3.08Å; K1402-S1405 WeakPolarHBondContact O-CB 3.4Å; K1402-S1405 PolarHBondContact O-N 3.09Å; K1402-S1405 PolarHBondContact O-OG 2.96Å; K1402-N1406 PolarHBondContact O-N 3.09Å; K1402-N1406 PolarHBondContact O-ND2 3.14Å
1403	Q	63.4	Low	62.1	Low	85.6 Å²	85.6	61.4 Å²	61.4	40%	0.4	34%	0.338	S	S	.	.	H	α-helix	trans	-58.7	-41.1	172.5	-74.2	-163.2	5.1	0	0	111.3	D1234 D1400 S1405 N1406	D1234-Q1403 WeakPolarHBondContact OD2-CG 3.39Å; D1234-Q1403 PolarHBondContact OD2-NE2 3.11Å; D1400-Q1403 HydrophobicContact CB-CB 4.28Å; D1400-Q1403 HydrophobicContact CB-CG 4.19Å; D1400-Q1403 PolarHBondContact O-N 3.11Å; D1400-Q1403 PolarHBondContact OD2-N 3.48Å; Q1403-S1405 VanDerWaalsContact C-N 3.28Å; Q1403-S1405 PolarHBondContact O-N 3.02Å; Q1403-S1405 VanDerWaalsContact O-N 3.08Å; Q1403-N1406 PolarHBondContact O-N 3.08Å; Q1403-N1406 VanDerWaalsContact O-N 3.15Å
1404	L	58.2	Low	59.3	Low	80.2 Å²	80.2	65.2 Å²	65.2	42%	0.42	36%	0.362	S	S	.	.	H	α-helix	trans	-61	-23.1	176.3	-103.6	110.8	0	0	0	114.2	Y1399 D1400 A1401 K1402 N1406 L1409 T1411	Y1399-L1404 HydrophobicContact CG-CD1 4.37Å; D1400-L1404 WeakPolarHBondContact O-CD1 3.27Å; D1400-L1404 PolarHBondContact O-N 3.23Å; A1401-L1404 WeakPolarHBondContact O-CB 3.49Å; A1401-L1404 PolarHBondContact O-N 3.03Å; K1402-L1404 VanDerWaalsContact C-N 3.29Å; K1402-L1404 PolarHBondContact O-N 3.08Å; L1404-N1406 PolarHBondContact O-N 3.1Å; L1404-L1409 HydrophobicContact CD1-CD1 4.09Å; L1404-L1409 HydrophobicContact CD2-CB 3.69Å; L1404-L1409 HydrophobicContact CD2-CD2 3.77Å; L1404-L1409 HydrophobicContact CD2-CG 4.04Å; L1404-L1409 HydrophobicContact CG-CD1 4.33Å; L1404-L1409 HydrophobicContact CG-CD2 4.08Å; L1404-T1411 HydrophobicContact CD2-CG2 4.25Å
1405	S	52.1	Low	56.4	Low	84.2 Å²	84.2	67.4 Å²	67.4	59%	0.589	38%	0.376	S	S	*	.	H	α-helix	trans	-85.1	-19.2	179.9	77.8	0	0	0	0	114.3	A1401 K1402 Q1403 N1407	A1401-S1405 PolarHBondContact O-N 3.12Å; A1401-S1405 VanDerWaalsContact O-N 3.17Å; K1402-S1405 WeakPolarHBondContact O-CB 3.4Å; K1402-S1405 PolarHBondContact O-N 3.09Å; K1402-S1405 PolarHBondContact O-OG 2.96Å; Q1403-S1405 VanDerWaalsContact C-N 3.28Å; Q1403-S1405 PolarHBondContact O-N 3.02Å; Q1403-S1405 VanDerWaalsContact O-N 3.08Å; S1405-N1407 PolarHBondContact O-N 3.08Å
1406	N	42.5	Very low	53.5	Low	119.4 Å²	119.4	72.9 Å²	72.9	64%	0.639	40%	0.398	S	S	*	.	S	Bend	trans	-106	65.3	-170.5	-80.2	-28.5	0	0	0	113.2	K1402 Q1403 L1404 D1408	K1402-N1406 PolarHBondContact O-N 3.09Å; K1402-N1406 PolarHBondContact O-ND2 3.14Å; Q1403-N1406 PolarHBondContact O-N 3.08Å; Q1403-N1406 VanDerWaalsContact O-N 3.15Å; L1404-N1406 PolarHBondContact O-N 3.1Å; N1406-D1408 VanDerWaalsContact C-N 3.25Å; N1406-D1408 PolarHBondContact O-N 2.96Å
1407	N	34.4	Very low	50.5	Low	151 Å²	151	75.5 Å²	75.5	81%	0.807	41%	0.414	S	S	*	.	S	Bend	trans	62.4	113.4	168.1	-66.4	-46.2	0	0	0	119.2	S1405 L1409	S1405-N1407 PolarHBondContact O-N 3.08Å; N1407-L1409 VanDerWaalsContact C-N 3.3Å; N1407-L1409 PolarHBondContact O-N 3.19Å
1408	D	37.9	Very low	47.6	Very low	136.4 Å²	136.4	79.6 Å²	79.6	73%	0.729	44%	0.439	S	S	*	.			trans	13.2	25.1	173.1	-76.3	-26.9	0	0	0	116.8	N1406 P1410 S1451 K1453	N1406-D1408 VanDerWaalsContact C-N 3.25Å; N1406-D1408 PolarHBondContact O-N 2.96Å; D1408-P1410 WeakPolarHBondContact O-CD 3.43Å; D1408-P1410 VanDerWaalsContact O-N 3.15Å; D1408-S1451 PolarHBondContact O-N 3.04Å; D1408-S1451 WeakPolarHBondContact OD1-CB 3.2Å; D1408-S1451 PolarHBondContact OD1-OG 3.25Å; D1408-K1453 IonicContact OD1-NZ 2.68Å; D1408-K1453 PolarHBondContact OD1-NZ 3.14Å
1409	L	36.8	Very low	44.8	Very low	67.4 Å²	67.4	82.9 Å²	82.9	35%	0.353	46%	0.46	S	S	.	.			trans	-72.7	123.2	151.4	-163.5	75.1	0	0	0	108.4	L1404 N1407 T1411 I1413 T1414 F1450	L1404-L1409 HydrophobicContact CD1-CD1 4.09Å; L1404-L1409 HydrophobicContact CD2-CB 3.69Å; L1404-L1409 HydrophobicContact CD2-CD2 3.77Å; L1404-L1409 HydrophobicContact CD2-CG 4.04Å; L1404-L1409 HydrophobicContact CG-CD1 4.33Å; L1404-L1409 HydrophobicContact CG-CD2 4.08Å; N1407-L1409 VanDerWaalsContact C-N 3.3Å; N1407-L1409 PolarHBondContact O-N 3.19Å; L1409-T1411 HydrophobicContact CD2-CG2 4.24Å; L1409-T1411 PolarHBondContact O-N 3.24Å; L1409-T1411 VanDerWaalsContact O-N 3.11Å; L1409-I1413 HydrophobicContact CD1-CB 4.24Å; L1409-I1413 HydrophobicContact CD1-CD1 3.85Å; L1409-I1413 VanDerWaalsContact CD1-CD1 3.41Å; L1409-I1413 HydrophobicContact CD1-CG2 4.3Å; L1409-I1413 HydrophobicContact CD2-CB 3.72Å; L1409-I1413 HydrophobicContact CD2-CD1 3.7Å; L1409-I1413 HydrophobicContact CD2-CG1 4.08Å; L1409-I1413 HydrophobicContact CD2-CG2 3.78Å; L1409-I1413 VanDerWaalsContact CD2-CG2 3.49Å; L1409-I1413 HydrophobicContact CG-CB 3.96Å; L1409-I1413 HydrophobicContact CG-CD1 3.96Å; L1409-I1413 VanDerWaalsContact CG-CD1 3.44Å; L1409-I1413 HydrophobicContact CG-CG1 4.04Å; L1409-I1413 HydrophobicContact CG-CG2 4.43Å; L1409-T1414 HydrophobicContact CD2-CG2 3.71Å; L1409-F1450 HydrophobicContact CD1-CB 3.61Å; L1409-F1450 HydrophobicContact CD1-CD1 4.41Å; L1409-F1450 HydrophobicContact CD1-CD2 3.34Å; L1409-F1450 HydrophobicContact CD1-CE2 4.26Å; L1409-F1450 HydrophobicContact CD1-CG 3.56Å
1410	P	33.4	Very low	42.2	Very low	68.2 Å²	68.2	83.7 Å²	83.7	44%	0.443	47%	0.473	S	S	.	.			trans	-62.1	123.1	175.1	6.9	-6.1	0	0	0	109.1	D1408 T1412 I1413 F1450	D1408-P1410 WeakPolarHBondContact O-CD 3.43Å; D1408-P1410 VanDerWaalsContact O-N 3.15Å; P1410-T1412 WeakPolarHBondContact CB-OG1 2.96Å; P1410-T1412 WeakPolarHBondContact O-CA 3.48Å; P1410-T1412 PolarHBondContact O-N 3.12Å; P1410-T1412 PolarHBondContact O-OG1 3.34Å; P1410-I1413 PolarHBondContact O-N 2.88Å; P1410-I1413 VanDerWaalsContact O-N 3.14Å; P1410-F1450 HydrophobicContact CG-CB 3.71Å; P1410-F1450 HydrophobicContact CG-CD1 3.26Å; P1410-F1450 HydrophobicContact CG-CD2 4.35Å; P1410-F1450 HydrophobicContact CG-CE1 3.86Å; P1410-F1450 HydrophobicContact CG-CG 3.54Å
1411	T	33	Very low	39.8	Very low	103 Å²	103	87.6 Å²	87.6	63%	0.632	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	12.3	175.4	44.3	0	0	0	0	112.3	L1404 L1409 I1413 T1414 T1415	L1404-T1411 HydrophobicContact CD2-CG2 4.25Å; L1409-T1411 HydrophobicContact CD2-CG2 4.24Å; L1409-T1411 PolarHBondContact O-N 3.24Å; L1409-T1411 VanDerWaalsContact O-N 3.11Å; T1411-I1413 PolarHBondContact O-N 2.91Å; T1411-T1414 PolarHBondContact O-OG1 3.09Å; T1411-T1414 VanDerWaalsContact O-OG1 3.06Å; T1411-T1415 WeakPolarHBondContact O-CA 3.41Å; T1411-T1415 VanDerWaalsContact O-CB 3.22Å; T1411-T1415 WeakPolarHBondContact O-CB 3.36Å; T1411-T1415 VanDerWaalsContact O-CG2 3.28Å; T1411-T1415 WeakPolarHBondContact O-CG2 3.35Å; T1411-T1415 PolarHBondContact O-N 2.87Å; T1411-T1415 PolarHBondContact O-OG1 2.86Å
1412	T	32.3	Very low	37.9	Very low	67.6 Å²	67.6	90.8 Å²	90.8	42%	0.415	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-10.3	175.2	-28.9	0	0	0	0	113.2	P1410 T1414 T1415 M1447 V1457	P1410-T1412 WeakPolarHBondContact CB-OG1 2.96Å; P1410-T1412 WeakPolarHBondContact O-CA 3.48Å; P1410-T1412 PolarHBondContact O-N 3.12Å; P1410-T1412 PolarHBondContact O-OG1 3.34Å; T1412-T1414 PolarHBondContact O-N 2.79Å; T1412-T1415 WeakPolarHBondContact CA-OG1 3.21Å; T1412-T1415 HydrophobicContact CG2-CG2 4.39Å; T1412-T1415 WeakPolarHBondContact O-CG2 3.42Å; T1412-T1415 PolarHBondContact O-N 2.94Å; T1412-T1415 PolarHBondContact O-OG1 3.11Å; T1412-M1447 HydrophobicContact CG2-CB 4.01Å; T1412-M1447 HydrophobicContact CG2-CG 4.26Å; T1412-V1457 HydrophobicContact CG2-CG2 3.84Å
1413	I	35.2	Very low	36.2	Very low	76.6 Å²	76.6	91.6 Å²	91.6	39%	0.393	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-16.7	167.2	-60.5	173.4	0	0	0	110.2	Y1399 L1409 P1410 T1411 T1415 I1422 N1444	Y1399-I1413 HydrophobicContact CE1-CD1 4.39Å; L1409-I1413 HydrophobicContact CD1-CB 4.24Å; L1409-I1413 HydrophobicContact CD1-CD1 3.85Å; L1409-I1413 VanDerWaalsContact CD1-CD1 3.41Å; L1409-I1413 HydrophobicContact CD1-CG2 4.3Å; L1409-I1413 HydrophobicContact CD2-CB 3.72Å; L1409-I1413 HydrophobicContact CD2-CD1 3.7Å; L1409-I1413 HydrophobicContact CD2-CG1 4.08Å; L1409-I1413 HydrophobicContact CD2-CG2 3.78Å; L1409-I1413 VanDerWaalsContact CD2-CG2 3.49Å; L1409-I1413 HydrophobicContact CG-CB 3.96Å; L1409-I1413 HydrophobicContact CG-CD1 3.96Å; L1409-I1413 VanDerWaalsContact CG-CD1 3.44Å; L1409-I1413 HydrophobicContact CG-CG1 4.04Å; L1409-I1413 HydrophobicContact CG-CG2 4.43Å; P1410-I1413 PolarHBondContact O-N 2.88Å; P1410-I1413 VanDerWaalsContact O-N 3.14Å; T1411-I1413 PolarHBondContact O-N 2.91Å; I1413-T1415 VanDerWaalsContact C-N 3.31Å; I1413-T1415 HydrophobicContact CG2-CG2 4.15Å; I1413-T1415 PolarHBondContact O-N 3.08Å; I1413-I1422 HydrophobicContact CG2-CD1 3.82Å; I1413-I1422 HydrophobicContact CG2-CG2 4.24Å; I1413-I1422 WeakPolarHBondContact O-CD1 3.27Å; I1413-N1444 VanDerWaalsContact CD1-ND2 3.31Å; I1413-N1444 WeakPolarHBondContact CD1-ND2 3.4Å; I1413-N1444 VanDerWaalsContact CG1-ND2 3.29Å; I1413-N1444 WeakPolarHBondContact CG1-ND2 3.44Å
1414	T	30.2	Very low	35	Very low	90.6 Å²	90.6	90.1 Å²	90.1	56%	0.556	51%	0.511	S	S	*	.	S	Bend	trans	-89.8	36.1	169.1	46	0	0	0	0	112.3	L1409 T1411 T1412 K1416	L1409-T1414 HydrophobicContact CD2-CG2 3.71Å; T1411-T1414 PolarHBondContact O-OG1 3.09Å; T1411-T1414 VanDerWaalsContact O-OG1 3.06Å; T1412-T1414 PolarHBondContact O-N 2.79Å; T1414-K1416 VanDerWaalsContact C-N 3.3Å; T1414-K1416 PolarHBondContact O-N 3Å; T1414-K1416 VanDerWaalsContact O-N 3.08Å
1415	T	30.1	Very low	34.2	Very low	49 Å²	49	87.1 Å²	87.1	30%	0.301	50%	0.499	S	S	.	.	S	Bend	trans	-58.5	100.1	163.4	51.6	0	0	0	0	111.7	T1411 T1412 I1413 T1417 I1422 V1457	T1411-T1415 WeakPolarHBondContact O-CA 3.41Å; T1411-T1415 VanDerWaalsContact O-CB 3.22Å; T1411-T1415 WeakPolarHBondContact O-CB 3.36Å; T1411-T1415 VanDerWaalsContact O-CG2 3.28Å; T1411-T1415 WeakPolarHBondContact O-CG2 3.35Å; T1411-T1415 PolarHBondContact O-N 2.87Å; T1411-T1415 PolarHBondContact O-OG1 2.86Å; T1412-T1415 WeakPolarHBondContact CA-OG1 3.21Å; T1412-T1415 HydrophobicContact CG2-CG2 4.39Å; T1412-T1415 WeakPolarHBondContact O-CG2 3.42Å; T1412-T1415 PolarHBondContact O-N 2.94Å; T1412-T1415 PolarHBondContact O-OG1 3.11Å; I1413-T1415 VanDerWaalsContact C-N 3.31Å; I1413-T1415 HydrophobicContact CG2-CG2 4.15Å; I1413-T1415 PolarHBondContact O-N 3.08Å; T1415-T1417 VanDerWaalsContact CB-OG1 3.28Å; T1415-T1417 WeakPolarHBondContact CB-OG1 3.39Å; T1415-T1417 PolarHBondContact O-N 3.12Å; T1415-T1417 PolarHBondContact O-OG1 2.87Å; T1415-T1417 PolarHBondContact OG1-OG1 3.33Å; T1415-I1422 WeakPolarHBondContact O-CD1 3.47Å; T1415-I1422 WeakPolarHBondContact O-CG2 3.32Å; T1415-I1422 WeakPolarHBondContact OG1-CD1 3.23Å; T1415-V1457 HydrophobicContact CG2-CB 3.95Å; T1415-V1457 HydrophobicContact CG2-CG1 3.92Å; T1415-V1457 HydrophobicContact CG2-CG2 3.93Å; T1415-V1457 WeakPolarHBondContact O-CB 3.44Å; T1415-V1457 WeakPolarHBondContact OG1-CG2 3.39Å
1416	K	30.9	Very low	34.3	Very low	156.8 Å²	156.8	85.4 Å²	85.4	68%	0.682	48%	0.484	S	S	*	.			trans	8.2	42.1	135	-66	178.1	178.7	-168.7	0	113.7	T1414 T1418 V1456 E1458	T1414-K1416 VanDerWaalsContact C-N 3.3Å; T1414-K1416 PolarHBondContact O-N 3Å; T1414-K1416 VanDerWaalsContact O-N 3.08Å; K1416-T1418 VanDerWaalsContact O-CG2 3.26Å; K1416-T1418 WeakPolarHBondContact O-CG2 3.41Å; K1416-T1418 PolarHBondContact O-N 3.13Å; K1416-V1456 HydrophobicContact CB-CG1 4.35Å; K1416-V1456 HydrophobicContact CD-CG1 3.56Å; K1416-V1456 WeakPolarHBondContact O-CG1 3.43Å; K1416-E1458 WeakPolarHBondContact CA-OE1 3.33Å; K1416-E1458 HydrophobicContact CB-CG 4.18Å; K1416-E1458 WeakPolarHBondContact CB-OE1 3.4Å; K1416-E1458 HydrophobicContact CD-CB 3.99Å; K1416-E1458 HydrophobicContact CD-CG 3.86Å; K1416-E1458 WeakPolarHBondContact CD-OE1 3.37Å; K1416-E1458 WeakPolarHBondContact CE-OE1 3.29Å; K1416-E1458 HydrophobicContact CG-CG 4.19Å; K1416-E1458 VanDerWaalsContact CG-OE1 3.31Å; K1416-E1458 WeakPolarHBondContact CG-OE1 3.33Å; K1416-E1458 IonicContact NZ-OE1 2.73Å; K1416-E1458 PolarHBondContact NZ-OE1 3.48Å; K1416-E1458 IonicContact NZ-OE2 3.45Å; K1416-E1458 PolarHBondContact NZ-OE2 2.9Å; K1416-E1458 WeakPolarHBondContact O-CG 3.46Å; K1416-E1458 VanDerWaalsContact O-OE1 3.14Å
1417	T	29.1	Very low	35.4	Very low	55.2 Å²	55.2	86.3 Å²	86.3	34%	0.339	48%	0.482	S	S	.	.			trans	-99.1	107.2	157.4	47.5	0	0	0	0	108.1	T1415 T1419 I1422 M1447 V1457 E1458	T1415-T1417 VanDerWaalsContact CB-OG1 3.28Å; T1415-T1417 WeakPolarHBondContact CB-OG1 3.39Å; T1415-T1417 PolarHBondContact O-N 3.12Å; T1415-T1417 PolarHBondContact O-OG1 2.87Å; T1415-T1417 PolarHBondContact OG1-OG1 3.33Å; T1417-T1419 PolarHBondContact O-N 3.04Å; T1417-I1422 WeakPolarHBondContact OG1-CD1 3.07Å; T1417-M1447 HydrophobicContact CG2-CE 3.91Å; T1417-V1457 HydrophobicContact CG2-CB 4.14Å; T1417-V1457 HydrophobicContact CG2-CG1 4.16Å; T1417-E1458 PolarHBondContact N-OE1 3.34Å
1418	T	28.5	Very low	37.3	Very low	92.8 Å²	92.8	79.9 Å²	79.9	57%	0.569	45%	0.452	S	S	*	.	S	Bend	trans	-60	58.7	168	45.6	0	0	0	0	113.2	K1416 E1458 S1462 R1604 R1921	K1416-T1418 VanDerWaalsContact O-CG2 3.26Å; K1416-T1418 WeakPolarHBondContact O-CG2 3.41Å; K1416-T1418 PolarHBondContact O-N 3.13Å; T1418-E1458 VanDerWaalsContact CB-CD 3.41Å; T1418-E1458 WeakPolarHBondContact CB-OE2 3.47Å; T1418-E1458 HydrophobicContact CG2-CB 4.33Å; T1418-E1458 VanDerWaalsContact CG2-CD 3.42Å; T1418-E1458 HydrophobicContact CG2-CG 3.52Å; T1418-E1458 VanDerWaalsContact CG2-OE1 3.23Å; T1418-E1458 WeakPolarHBondContact CG2-OE1 3.15Å; T1418-E1458 VanDerWaalsContact CG2-OE2 3.29Å; T1418-E1458 WeakPolarHBondContact CG2-OE2 3.45Å; T1418-E1458 PolarHBondContact N-OE1 2.9Å; T1418-E1458 WeakPolarHBondContact OG1-CG 3.46Å; T1418-S1462 PolarHBondContact OG1-OG 3.27Å; T1418-R1604 VanDerWaalsContact CB-CZ 3.42Å; T1418-R1604 HydrophobicContact CG2-CB 3.91Å; T1418-R1604 HydrophobicContact CG2-CG 3.63Å; T1418-R1604 VanDerWaalsContact CG2-CZ 3.44Å; T1418-R1604 PolarHBondContact O-NH1 2.54Å; T1418-R1604 VanDerWaalsContact O-NH1 3.13Å; T1418-R1921 PolarHBondContact OG1-NH1 2.85Å
1419	T	29	Very low	39.4	Very low	69.6 Å²	69.6	73.8 Å²	73.8	43%	0.427	42%	0.421	S	S	.	.			trans	-137.5	107.6	167.2	57.7	0	0	0	0	108.3	T1417 N1421 I1422 R1604 Q2000	T1417-T1419 PolarHBondContact O-N 3.04Å; T1419-N1421 PolarHBondContact O-N 3.05Å; T1419-N1421 VanDerWaalsContact O-N 3.13Å; T1419-N1421 PolarHBondContact OG1-ND2 2.74Å; T1419-I1422 PolarHBondContact O-N 3.44Å; T1419-R1604 HydrophobicContact CG2-CG 4.25Å; T1419-R1604 VanDerWaalsContact CG2-NE 3.31Å; T1419-R1604 VanDerWaalsContact OG1-CZ 3.28Å; T1419-R1604 PolarHBondContact OG1-NH1 2.84Å; T1419-R1604 PolarHBondContact OG1-NH2 3.05Å; T1419-Q2000 HydrophobicContact CG2-CG 3.98Å
1420	S	27.9	Very low	41.6	Very low	68.4 Å²	68.4	72.8 Å²	72.8	48%	0.478	42%	0.418	S	S	.	.			trans	-69.3	70.2	175	29	0	0	0	0	112.8	I1422 L1423 E1895	S1420-I1422 VanDerWaalsContact C-N 3.33Å; S1420-I1422 PolarHBondContact O-N 3.03Å; S1420-L1423 PolarHBondContact O-N 3.15Å; S1420-E1895 VanDerWaalsContact CB-CD 3.44Å; S1420-E1895 WeakPolarHBondContact CB-OE2 3.4Å; S1420-E1895 VanDerWaalsContact OG-CD 3.23Å; S1420-E1895 PolarHBondContact OG-OE2 3.04Å
1421	N	30.5	Very low	44	Very low	89.8 Å²	89.8	71.9 Å²	71.9	48%	0.48	41%	0.409	S	S	.	.			trans	-124.1	23	175	-81.1	-11.9	0	0	0	113.1	T1419 L1423 S1424 E1458 T1894	T1419-N1421 PolarHBondContact O-N 3.05Å; T1419-N1421 VanDerWaalsContact O-N 3.13Å; T1419-N1421 PolarHBondContact OG1-ND2 2.74Å; N1421-L1423 PolarHBondContact O-N 3.13Å; N1421-L1423 VanDerWaalsContact O-N 3.13Å; N1421-S1424 WeakPolarHBondContact O-CB 3.29Å; N1421-S1424 PolarHBondContact O-N 3.43Å; N1421-S1424 PolarHBondContact O-OG 3.42Å; N1421-E1458 PolarHBondContact ND2-OE1 2.76Å; N1421-E1458 PolarHBondContact ND2-OE2 2.97Å; N1421-T1894 PolarHBondContact OD1-OG1 2.74Å
1422	I	31.4	Very low	45.9	Very low	108.6 Å²	108.6	67.9 Å²	67.9	56%	0.557	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	50	166.3	-61.2	169.6	0	0	0	108.8	I1413 T1415 T1417 T1419 S1420 S1424 T1912	I1413-I1422 HydrophobicContact CG2-CD1 3.82Å; I1413-I1422 HydrophobicContact CG2-CG2 4.24Å; I1413-I1422 WeakPolarHBondContact O-CD1 3.27Å; T1415-I1422 WeakPolarHBondContact O-CD1 3.47Å; T1415-I1422 WeakPolarHBondContact O-CG2 3.32Å; T1415-I1422 WeakPolarHBondContact OG1-CD1 3.23Å; T1417-I1422 WeakPolarHBondContact OG1-CD1 3.07Å; T1419-I1422 PolarHBondContact O-N 3.44Å; S1420-I1422 VanDerWaalsContact C-N 3.33Å; S1420-I1422 PolarHBondContact O-N 3.03Å; I1422-S1424 VanDerWaalsContact C-N 3.31Å; I1422-S1424 PolarHBondContact O-N 3.19Å; I1422-T1912 HydrophobicContact CD1-CG2 3.76Å
1423	L	33.9	Very low	47.9	Very low	102.8 Å²	102.8	67.4 Å²	67.4	54%	0.538	39%	0.386	S	S	.	.			trans	-87.3	53.5	171.9	-84.5	160.8	0	0	0	111.3	S1420 N1421 G1425 F1450 T1894 T1912	S1420-L1423 PolarHBondContact O-N 3.15Å; N1421-L1423 PolarHBondContact O-N 3.13Å; N1421-L1423 VanDerWaalsContact O-N 3.13Å; L1423-G1425 PolarHBondContact O-N 2.97Å; L1423-F1450 HydrophobicContact CD1-CE1 3.58Å; L1423-F1450 HydrophobicContact CD1-CZ 3.66Å; L1423-T1894 WeakPolarHBondContact O-CG2 3.33Å; L1423-T1912 HydrophobicContact CD1-CG2 4.4Å; L1423-T1912 HydrophobicContact CD2-CG2 3.76Å
1424	S	37.6	Very low	50.1	Low	53.8 Å²	53.8	63.8 Å²	63.8	38%	0.376	37%	0.367	S	S	.	.	S	Bend	trans	-69.7	34.7	-174.2	-59	0	0	0	0	114.4	N1382 N1421 I1422 D1426 Q1893	N1382-S1424 PolarHBondContact ND2-O 3.12Å; N1421-S1424 WeakPolarHBondContact O-CB 3.29Å; N1421-S1424 PolarHBondContact O-N 3.43Å; N1421-S1424 PolarHBondContact O-OG 3.42Å; I1422-S1424 VanDerWaalsContact C-N 3.31Å; I1422-S1424 PolarHBondContact O-N 3.19Å; S1424-D1426 VanDerWaalsContact C-N 3.27Å; S1424-D1426 PolarHBondContact O-N 2.91Å; S1424-Q1893 PolarHBondContact O-NE2 3.14Å
1425	G	42.5	Very low	52.6	Low	18 Å²	18	61.8 Å²	61.8	19%	0.186	36%	0.356	C	S	.	.			trans	86.3	24.7	-179.5	0	0	0	0	0	115	N1382 L1423 F1427	N1382-G1425 VanDerWaalsContact ND2-CA 3.31Å; N1382-G1425 WeakPolarHBondContact ND2-CA 3.38Å; N1382-G1425 PolarHBondContact ND2-O 3.02Å; N1382-G1425 VanDerWaalsContact ND2-O 3.13Å; L1423-G1425 PolarHBondContact O-N 2.97Å; G1425-F1427 WeakPolarHBondContact O-CD2 3.37Å; G1425-F1427 PolarHBondContact O-N 2.83Å
1426	D	52.8	Low	55	Low	48 Å²	48	60.6 Å²	60.6	26%	0.257	35%	0.348	S	S	.	.			trans	-82.5	106.1	170.3	-67.8	3.5	0	0	0	108.8	V1380 H1381 N1382 S1424 G1429	V1380-D1426 CarbonylContact O-C 3.58Å; V1380-D1426 VanDerWaalsContact O-CA 3.28Å; V1380-D1426 WeakPolarHBondContact O-CA 3.43Å; V1380-D1426 WeakPolarHBondContact O-CB 3.21Å; V1380-D1426 VanDerWaalsContact O-CG 3.3Å; H1381-D1426 VanDerWaalsContact CA-OD1 3.24Å; H1381-D1426 WeakPolarHBondContact CA-OD1 3.32Å; H1381-D1426 IonicContact CE1-OD1 3.4Å; H1381-D1426 IonicContact CE1-OD2 3.19Å; H1381-D1426 PolarHBondContact CE1-OD2 3.28Å; H1381-D1426 IonicContact CG-OD1 3.52Å; H1381-D1426 IonicContact CG-OD2 3.75Å; H1381-D1426 IonicContact ND1-OD1 3.04Å; H1381-D1426 PolarHBondContact ND1-OD1 2.9Å; H1381-D1426 IonicContact ND1-OD2 3.09Å; H1381-D1426 PolarHBondContact ND1-OD2 3.34Å; N1382-D1426 PolarHBondContact N-OD1 3.05Å; N1382-D1426 PolarHBondContact ND2-OD1 2.45Å; S1424-D1426 VanDerWaalsContact C-N 3.27Å; S1424-D1426 PolarHBondContact O-N 2.91Å; D1426-G1429 WeakPolarHBondContact CB-O 3.01Å
1427	F	66.2	Low	57.1	Low	139 Å²	139	55.5 Å²	55.5	61%	0.61	33%	0.326	S	S	*	.	B	Isolated β-bridge	trans	-107.3	139.2	177.9	-84.9	-86.1	0	0	0	108.7	A1379 V1380 G1425 G1429	A1379-F1427 CarbonylContact C-O 3.57Å; A1379-F1427 VanDerWaalsContact CA-O 3.3Å; A1379-F1427 WeakPolarHBondContact CA-O 3.35Å; A1379-F1427 VanDerWaalsContact CB-O 3.25Å; A1379-F1427 WeakPolarHBondContact CB-O 3.38Å; V1380-F1427 PolarHBondContact N-O 3.29Å; V1380-F1427 PolarHBondContact O-N 2.93Å; V1380-F1427 VanDerWaalsContact O-N 3.09Å; G1425-F1427 WeakPolarHBondContact O-CD2 3.37Å; G1425-F1427 PolarHBondContact O-N 2.83Å; F1427-G1429 VanDerWaalsContact C-N 3.27Å; F1427-G1429 PolarHBondContact O-N 3.09Å
1428	G	75	Confident	59.2	Low	17.2 Å²	17.2	53.1 Å²	53.1	18%	0.177	31%	0.313	C	S	.	.	S	Bend	trans	75.2	0.1	173.1	0	0	0	0	0	116.9	S1378 A1379 M1398 Y1399	S1378-G1428 WeakPolarHBondContact O-CA 3.39Å; A1379-G1428 VanDerWaalsContact CB-C 3.49Å; M1398-G1428 WeakPolarHBondContact CA-O 3.27Å; Y1399-G1428 PolarHBondContact N-O 2.97Å
1429	G	81.5	Confident	61.3	Low	7 Å²	7	49.7 Å²	49.7	7%	0.072	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.8	177.1	177.3	0	0	0	0	0	113.9	F1396 Y1397 D1426 F1427	F1396-G1429 VanDerWaalsContact CZ-C 3.49Å; Y1397-G1429 CarbonylContact O-C 3.48Å; Y1397-G1429 WeakPolarHBondContact O-CA 3.37Å; D1426-G1429 WeakPolarHBondContact CB-O 3.01Å; F1427-G1429 VanDerWaalsContact C-N 3.27Å; F1427-G1429 PolarHBondContact O-N 3.09Å
1430	T	83	Confident	63.4	Low	46.8 Å²	46.8	47.5 Å²	47.5	29%	0.287	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	157.3	176	-161.9	0	0	0	0	112.4	F1396 Y1397 Y1399 W1441 T1442 M1447	F1396-T1430 CarbonylContact C-O 3.43Å; F1396-T1430 WeakPolarHBondContact CA-O 3.2Å; F1396-T1430 WeakPolarHBondContact CD2-O 3.34Å; Y1397-T1430 PolarHBondContact N-O 3.2Å; Y1397-T1430 PolarHBondContact O-N 3.12Å; Y1399-T1430 HydrophobicContact CE2-CG2 4Å; Y1399-T1430 VanDerWaalsContact OH-CG2 3.27Å; Y1399-T1430 WeakPolarHBondContact OH-CG2 3.32Å; T1430-W1441 HydrophobicContact CG2-CH2 3.69Å; T1430-W1441 HydrophobicContact CG2-CZ3 3.74Å; T1430-T1442 HydrophobicContact CG2-CG2 4.49Å; T1430-M1447 HydrophobicContact CG2-CE 4.47Å
1431	L	82.5	Confident	65.3	Low	49.6 Å²	49.6	45 Å²	45	26%	0.26	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	141.1	163.3	-74.9	174.1	0	0	0	110.1	H1381 M1393 D1395 F1396	H1381-L1431 WeakPolarHBondContact NE2-CD1 3.4Å; M1393-L1431 HydrophobicContact CB-CD2 4.33Å; M1393-L1431 HydrophobicContact CE-CD1 4.5Å; M1393-L1431 HydrophobicContact CE-CD2 3.66Å; M1393-L1431 HydrophobicContact CE-CG 4.24Å; M1393-L1431 HydrophobicContact CG-CD2 4.31Å; D1395-L1431 WeakPolarHBondContact O-CD2 3.45Å; F1396-L1431 HydrophobicContact CB-CD2 4.23Å; F1396-L1431 HydrophobicContact CD2-CD2 4.07Å; F1396-L1431 HydrophobicContact CD2-CG 4.13Å
1432	G	74.8	Confident	66.9	Low	17.8 Å²	17.8	41.2 Å²	41.2	18%	0.184	24%	0.237	C	C	.	.			trans	-58.7	135.5	171.7	0	0	0	0	0	111.3	D1395 S1434	D1395-G1432 PolarHBondContact O-N 2.97Å; G1432-S1434 PolarHBondContact O-N 3.03Å; G1432-S1434 VanDerWaalsContact O-N 3.13Å
1433	P	74.2	Confident	68.5	Low	57.4 Å²	57.4	38.3 Å²	38.3	37%	0.373	22%	0.222	S	C	.	.	S	Bend	trans	-57.8	-23.5	-178.6	-7.6	7.9	0	0	0	114	W1441 I1605 W1607	P1433-W1441 HydrophobicContact CB-CB 4.46Å; P1433-W1441 HydrophobicContact CB-CD2 4.41Å; P1433-W1441 HydrophobicContact CB-CE3 4.48Å; P1433-W1441 HydrophobicContact CB-CG 4.39Å; P1433-W1441 HydrophobicContact CG-CB 3.95Å; P1433-W1441 HydrophobicContact CG-CD2 3.79Å; P1433-W1441 HydrophobicContact CG-CE3 4.15Å; P1433-W1441 HydrophobicContact CG-CG 3.94Å; P1433-I1605 HydrophobicContact CB-CD1 4.25Å; P1433-W1607 WeakPolarHBondContact O-CZ2 3.22Å; P1433-W1607 PolarHBondContact O-NE1 2.7Å
1434	S	81.4	Confident	69.7	Low	1 Å²	1	36.7 Å²	36.7	1%	0.007	21%	0.214	C	C	.	.			trans	-147.3	146.1	166.3	-174.7	0	0	0	0	110.3	G1432 I1436 H1437 G1438 H1549	G1432-S1434 PolarHBondContact O-N 3.03Å; G1432-S1434 VanDerWaalsContact O-N 3.13Å; S1434-I1436 PolarHBondContact O-N 3.05Å; S1434-I1436 VanDerWaalsContact O-N 3.15Å; S1434-I1436 WeakPolarHBondContact OG-CB 3.41Å; S1434-I1436 PolarHBondContact OG-N 2.96Å; S1434-H1437 PolarHBondContact O-N 2.89Å; S1434-G1438 VanDerWaalsContact O-CA 3.28Å; S1434-G1438 WeakPolarHBondContact O-CA 3.31Å; S1434-G1438 PolarHBondContact O-N 3.5Å; S1434-H1549 VanDerWaalsContact CB-ND1 3.27Å; S1434-H1549 WeakPolarHBondContact CB-ND1 3.37Å; S1434-H1549 PolarHBondContact OG-ND1 2.98Å
1435	P	81.2	Confident	70.5	Confident	49.2 Å²	49.2	37.2 Å²	37.2	32%	0.319	22%	0.218	S	C	.	.	S	Bend	trans	-69.6	-6.9	168.2	30	-36.2	0	0	0	113.5	H1437 V1551 V1560	P1435-H1437 PolarHBondContact O-N 2.86Å; P1435-V1551 HydrophobicContact CG-CB 4.49Å; P1435-V1551 HydrophobicContact CG-CG1 4.3Å; P1435-V1551 HydrophobicContact CG-CG2 3.62Å; P1435-V1560 HydrophobicContact CB-CG1 4.25Å; P1435-V1560 HydrophobicContact CB-CG2 4.11Å; P1435-V1560 HydrophobicContact CG-CG1 3.93Å; P1435-V1560 HydrophobicContact CG-CG2 3.79Å
1436	I	81.2	Confident	71	Confident	24.8 Å²	24.8	40.1 Å²	40.1	13%	0.127	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	75.3	176	-59.3	177.4	0	0	0	109.9	S1434 G1438 W1441 H1549 V1560 K1561 L1562	S1434-I1436 PolarHBondContact O-N 3.05Å; S1434-I1436 VanDerWaalsContact O-N 3.15Å; S1434-I1436 WeakPolarHBondContact OG-CB 3.41Å; S1434-I1436 PolarHBondContact OG-N 2.96Å; I1436-G1438 VanDerWaalsContact C-N 3.3Å; I1436-G1438 PolarHBondContact O-N 2.95Å; I1436-W1441 VanDerWaalsContact O-CD1 3.26Å; I1436-W1441 PolarHBondContact O-NE1 3.06Å; I1436-W1441 VanDerWaalsContact O-NE1 3.08Å; I1436-H1549 HydrophobicContact CD1-CB 3.84Å; I1436-V1560 HydrophobicContact CD1-CB 4.35Å; I1436-V1560 HydrophobicContact CD1-CG1 3.74Å; I1436-V1560 HydrophobicContact CG1-CB 3.89Å; I1436-V1560 HydrophobicContact CG1-CG1 3.25Å; I1436-V1560 HydrophobicContact CG1-CG2 4.34Å; I1436-K1561 VanDerWaalsContact CD1-O 3.3Å; I1436-K1561 WeakPolarHBondContact CD1-O 3.38Å; I1436-L1562 HydrophobicContact CD1-CB 4.16Å; I1436-L1562 HydrophobicContact CD1-CD1 4.07Å; I1436-L1562 HydrophobicContact CG2-CB 4.26Å; I1436-L1562 HydrophobicContact CG2-CD1 4.39Å; I1436-L1562 HydrophobicContact CG2-CD2 4.39Å; I1436-L1562 HydrophobicContact CG2-CG 4.48Å
1437	H	75.8	Confident	70.8	Confident	48 Å²	48	40 Å²	40	22%	0.222	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	34.1	38.1	-176.4	-56.1	138.2	0	0	0	111.9	S1434 P1435 D1439 L1440 W1441 F1446 E1547 H1549	S1434-H1437 PolarHBondContact O-N 2.89Å; P1435-H1437 PolarHBondContact O-N 2.86Å; H1437-D1439 VanDerWaalsContact C-N 3.31Å; H1437-D1439 VanDerWaalsContact C-OD1 3.23Å; H1437-D1439 WeakPolarHBondContact CA-OD1 3.29Å; H1437-D1439 PolarHBondContact O-N 3.1Å; H1437-L1440 HydrophobicContact CB-CB 4.29Å; H1437-L1440 HydrophobicContact CB-CD1 4.23Å; H1437-L1440 HydrophobicContact CB-CG 4.4Å; H1437-L1440 WeakPolarHBondContact O-CA 3.04Å; H1437-L1440 WeakPolarHBondContact O-CB 3Å; H1437-L1440 PolarHBondContact O-N 3.16Å; H1437-W1441 PolarHBondContact O-N 2.88Å; H1437-W1441 VanDerWaalsContact O-N 3.15Å; H1437-F1446 HydrophobicContact CB-CD2 4.22Å; H1437-F1446 HydrophobicContact CB-CE2 3.63Å; H1437-F1446 VanDerWaalsContact CB-CE2 3.47Å; H1437-F1446 HydrophobicContact CB-CZ 4Å; H1437-F1446 AromaticContact CG-CE2 3.87Å; H1437-F1446 AromaticContact ND1-CE2 3.59Å; H1437-F1446 AromaticContact ND1-CZ 3.77Å; H1437-F1446 WeakPolarHBondContact ND1-CZ 3.49Å; H1437-E1547 IonicContact CE1-OE2 3.16Å; H1437-E1547 PolarHBondContact CE1-OE2 3.11Å; H1437-H1549 AromaticContact CE1-CE1 3.81Å; H1437-H1549 AromaticContact CE1-NE2 3.42Å; H1437-H1549 PolarHBondContact CE1-NE2 3.42Å; H1437-H1549 AromaticContact ND1-CE1 3.55Å; H1437-H1549 PolarHBondContact ND1-CE1 3.28Å; H1437-H1549 AromaticContact ND1-NE2 3.58Å
1438	G	72.1	Confident	69.6	Low	6.4 Å²	6.4	35.9 Å²	35.9	7%	0.066	21%	0.211	C	C	.	.	H	α-helix	trans	-53.4	-38	-170.2	0	0	0	0	0	113.7	Y1397 S1434 I1436 W1441 T1442	Y1397-G1438 WeakPolarHBondContact OH-CA 3.49Å; S1434-G1438 VanDerWaalsContact O-CA 3.28Å; S1434-G1438 WeakPolarHBondContact O-CA 3.31Å; S1434-G1438 PolarHBondContact O-N 3.5Å; I1436-G1438 VanDerWaalsContact C-N 3.3Å; I1436-G1438 PolarHBondContact O-N 2.95Å; G1438-W1441 PolarHBondContact O-N 3.14Å; G1438-W1441 PolarHBondContact O-NE1 3.22Å; G1438-T1442 PolarHBondContact O-N 2.97Å; G1438-T1442 PolarHBondContact O-OG1 3.29Å; G1438-T1442 VanDerWaalsContact O-OG1 3.07Å
1439	D	72.5	Confident	68	Low	20 Å²	20	43.5 Å²	43.5	11%	0.107	24%	0.239	C	C	.	.	H	α-helix	trans	-70.2	-38.7	174.9	43.4	-32	0	0	0	112.9	S1214 Q1217 Y1397 H1437 W1441 T1442 I1443	S1214-D1439 WeakPolarHBondContact CB-OD1 3.44Å; S1214-D1439 VanDerWaalsContact CB-OD2 3.28Å; S1214-D1439 WeakPolarHBondContact CB-OD2 3.41Å; S1214-D1439 PolarHBondContact N-OD2 2.75Å; S1214-D1439 VanDerWaalsContact OG-CG 3.27Å; S1214-D1439 PolarHBondContact OG-OD1 3.2Å; S1214-D1439 PolarHBondContact OG-OD2 2.83Å; Q1217-D1439 PolarHBondContact NE2-OD2 2.98Å; Y1397-D1439 HydrophobicContact CE1-CB 4.35Å; Y1397-D1439 PolarHBondContact OH-N 2.97Å; H1437-D1439 VanDerWaalsContact C-N 3.31Å; H1437-D1439 VanDerWaalsContact C-OD1 3.23Å; H1437-D1439 WeakPolarHBondContact CA-OD1 3.29Å; H1437-D1439 PolarHBondContact O-N 3.1Å; D1439-W1441 VanDerWaalsContact C-N 3.29Å; D1439-W1441 PolarHBondContact O-N 3.23Å; D1439-T1442 PolarHBondContact O-N 2.97Å; D1439-T1442 VanDerWaalsContact O-N 3.16Å; D1439-T1442 PolarHBondContact O-OG1 3.18Å; D1439-I1443 WeakPolarHBondContact O-CB 3.46Å; D1439-I1443 WeakPolarHBondContact O-CD1 3.35Å; D1439-I1443 VanDerWaalsContact O-CG1 3.28Å; D1439-I1443 WeakPolarHBondContact O-CG1 3.21Å; D1439-I1443 WeakPolarHBondContact O-CG2 3.47Å; D1439-I1443 PolarHBondContact O-N 3.21Å; D1439-I1443 VanDerWaalsContact O-N 3.13Å
1440	L	72.5	Confident	66.1	Low	23.4 Å²	23.4	47.3 Å²	47.3	12%	0.123	25%	0.254	C	S	.	.	H	α-helix	trans	-70	-25.1	178.5	-76.6	166.2	0	0	0	113.1	P1185 S1214 A1215 Q1217 H1437 T1442 I1443 N1444 S1445 F1446	P1185-L1440 HydrophobicContact CB-CD1 3.97Å; P1185-L1440 HydrophobicContact CB-CD2 4.42Å; P1185-L1440 HydrophobicContact CG-CD1 4.18Å; S1214-L1440 VanDerWaalsContact OG-CD1 3.25Å; S1214-L1440 WeakPolarHBondContact OG-CD1 3.24Å; S1214-L1440 WeakPolarHBondContact OG-CG 3.42Å; A1215-L1440 HydrophobicContact CB-CD1 3.94Å; A1215-L1440 HydrophobicContact CB-CD2 4.04Å; A1215-L1440 HydrophobicContact CB-CG 4.38Å; Q1217-L1440 HydrophobicContact CB-CD2 4.3Å; Q1217-L1440 VanDerWaalsContact CD-CD2 3.47Å; Q1217-L1440 HydrophobicContact CG-CD2 3.86Å; H1437-L1440 HydrophobicContact CB-CB 4.29Å; H1437-L1440 HydrophobicContact CB-CD1 4.23Å; H1437-L1440 HydrophobicContact CB-CG 4.4Å; H1437-L1440 WeakPolarHBondContact O-CA 3.04Å; H1437-L1440 WeakPolarHBondContact O-CB 3Å; H1437-L1440 PolarHBondContact O-N 3.16Å; L1440-T1442 VanDerWaalsContact C-N 3.31Å; L1440-I1443 HydrophobicContact CD2-CD1 4.03Å; L1440-I1443 HydrophobicContact CG-CD1 4.5Å; L1440-I1443 PolarHBondContact O-N 2.9Å; L1440-N1444 PolarHBondContact O-N 2.76Å; L1440-S1445 WeakPolarHBondContact O-CB 3.32Å; L1440-S1445 PolarHBondContact O-N 3.24Å; L1440-F1446 HydrophobicContact CB-CD2 3.75Å; L1440-F1446 VanDerWaalsContact CB-CD2 3.45Å; L1440-F1446 HydrophobicContact CB-CE2 3.41Å; L1440-F1446 HydrophobicContact CB-CZ 3.74Å; L1440-F1446 HydrophobicContact CD1-CD2 4.46Å; L1440-F1446 HydrophobicContact CD1-CE1 4.36Å; L1440-F1446 HydrophobicContact CD1-CE2 4.01Å; L1440-F1446 HydrophobicContact CD1-CZ 3.92Å; L1440-F1446 HydrophobicContact CG-CE2 4.36Å; L1440-F1446 HydrophobicContact CG-CZ 4.36Å; L1440-F1446 PolarHBondContact O-N 3.15Å
1441	W	68.8	Low	64	Low	16.8 Å²	16.8	49.7 Å²	49.7	6%	0.064	27%	0.272	C	S	.	.	H	α-helix	trans	-71.8	-39.4	172.5	-60.4	97	0	0	0	112	T1430 P1433 I1436 H1437 G1438 D1439 I1443 N1444 F1446 M1447 H1549 V1598 I1605	T1430-W1441 HydrophobicContact CG2-CH2 3.69Å; T1430-W1441 HydrophobicContact CG2-CZ3 3.74Å; P1433-W1441 HydrophobicContact CB-CB 4.46Å; P1433-W1441 HydrophobicContact CB-CD2 4.41Å; P1433-W1441 HydrophobicContact CB-CE3 4.48Å; P1433-W1441 HydrophobicContact CB-CG 4.39Å; P1433-W1441 HydrophobicContact CG-CB 3.95Å; P1433-W1441 HydrophobicContact CG-CD2 3.79Å; P1433-W1441 HydrophobicContact CG-CE3 4.15Å; P1433-W1441 HydrophobicContact CG-CG 3.94Å; I1436-W1441 VanDerWaalsContact O-CD1 3.26Å; I1436-W1441 PolarHBondContact O-NE1 3.06Å; I1436-W1441 VanDerWaalsContact O-NE1 3.08Å; H1437-W1441 PolarHBondContact O-N 2.88Å; H1437-W1441 VanDerWaalsContact O-N 3.15Å; G1438-W1441 PolarHBondContact O-N 3.14Å; G1438-W1441 PolarHBondContact O-NE1 3.22Å; D1439-W1441 VanDerWaalsContact C-N 3.29Å; D1439-W1441 PolarHBondContact O-N 3.23Å; W1441-I1443 PolarHBondContact O-N 2.99Å; W1441-N1444 WeakPolarHBondContact O-CA 3.35Å; W1441-N1444 PolarHBondContact O-N 2.98Å; W1441-N1444 VanDerWaalsContact O-N 3.13Å; W1441-F1446 HydrophobicContact CB-CB 4.25Å; W1441-F1446 AromaticContact CD1-CD2 3.83Å; W1441-F1446 AromaticContact CD1-CE2 3.89Å; W1441-F1446 HydrophobicContact CD2-CB 4.21Å; W1441-F1446 AromaticContact CD2-CD2 3.61Å; W1441-F1446 HydrophobicContact CD2-CD2 4.01Å; W1441-F1446 HydrophobicContact CD2-CE2 4.3Å; W1441-F1446 HydrophobicContact CD2-CG 4.37Å; W1441-F1446 AromaticContact CE2-CD2 3.58Å; W1441-F1446 AromaticContact CE2-CE2 3.85Å; W1441-F1446 AromaticContact CE2-CG 3.99Å; W1441-F1446 HydrophobicContact CE3-CB 3.89Å; W1441-F1446 AromaticContact CE3-CD2 3.84Å; W1441-F1446 HydrophobicContact CE3-CD2 4Å; W1441-F1446 AromaticContact CE3-CG 3.84Å; W1441-F1446 HydrophobicContact CE3-CG 4.16Å; W1441-F1446 HydrophobicContact CG-CB 4.35Å; W1441-F1446 AromaticContact CG-CD2 3.82Å; W1441-F1446 HydrophobicContact CG-CD2 4.02Å; W1441-F1446 HydrophobicContact CG-CE2 4.23Å; W1441-F1446 HydrophobicContact CH2-CB 4.36Å; W1441-F1446 AromaticContact CH2-CD2 3.68Å; W1441-F1446 HydrophobicContact CH2-CD2 4.07Å; W1441-F1446 HydrophobicContact CH2-CE2 4.09Å; W1441-F1446 HydrophobicContact CH2-CG 4.16Å; W1441-F1446 HydrophobicContact CZ2-CB 4.08Å; W1441-F1446 HydrophobicContact CZ2-CD2 4.18Å; W1441-F1446 HydrophobicContact CZ2-CE2 4.45Å; W1441-F1446 HydrophobicContact CZ2-CG 4.34Å; W1441-F1446 HydrophobicContact CZ3-CB 3.92Å; W1441-F1446 HydrophobicContact CZ3-CD1 4.32Å; W1441-F1446 AromaticContact CZ3-CD2 3.32Å; W1441-F1446 HydrophobicContact CZ3-CD2 3.86Å; W1441-F1446 HydrophobicContact CZ3-CE2 4.16Å; W1441-F1446 AromaticContact CZ3-CG 3.42Å; W1441-F1446 HydrophobicContact CZ3-CG 3.42Å; W1441-F1446 VanDerWaalsContact CZ3-CG 3.42Å; W1441-F1446 AromaticContact NE1-CD2 3.8Å; W1441-F1446 AromaticContact NE1-CE2 3.69Å; W1441-M1447 HydrophobicContact CE3-CE 3.78Å; W1441-M1447 HydrophobicContact CE3-SD 4.17Å; W1441-M1447 HydrophobicContact CH2-CE 3.81Å; W1441-M1447 HydrophobicContact CZ3-CE 3.76Å; W1441-M1447 HydrophobicContact CZ3-SD 4.2Å; W1441-M1447 PolarHBondContact O-N 2.7Å; W1441-H1549 AromaticContact CZ2-CE1 3.96Å; W1441-V1598 HydrophobicContact CH2-CG1 4.34Å; W1441-I1605 HydrophobicContact CD2-CD1 4.4Å; W1441-I1605 HydrophobicContact CH2-CD1 4.08Å; W1441-I1605 HydrophobicContact CH2-CG1 4.12Å; W1441-I1605 HydrophobicContact CZ2-CD1 3.86Å; W1441-I1605 HydrophobicContact CZ2-CG1 4.3Å; W1441-I1605 HydrophobicContact CZ3-CD1 4.43Å; W1441-I1605 HydrophobicContact CZ3-CG1 4.37Å
1442	T	65	Low	61.9	Low	9.6 Å²	9.6	52.8 Å²	52.8	6%	0.059	29%	0.289	C	S	.	.	H	α-helix	trans	-68.3	-36.3	-179.3	-15.5	0	0	0	0	112.5	W1326 Y1397 Y1399 T1430 G1438 D1439 L1440 N1444	W1326-T1442 HydrophobicContact CB-CG2 4.37Å; W1326-T1442 WeakPolarHBondContact O-CB 3.17Å; W1326-T1442 WeakPolarHBondContact O-CG2 3.29Å; W1326-T1442 PolarHBondContact O-OG1 3.5Å; Y1397-T1442 HydrophobicContact CD1-CG2 4Å; Y1397-T1442 HydrophobicContact CE1-CG2 4.04Å; Y1397-T1442 HydrophobicContact CG-CG2 4.1Å; Y1399-T1442 HydrophobicContact CE1-CG2 4.02Å; Y1399-T1442 WeakPolarHBondContact OH-CG2 3.18Å; T1430-T1442 HydrophobicContact CG2-CG2 4.49Å; G1438-T1442 PolarHBondContact O-N 2.97Å; G1438-T1442 PolarHBondContact O-OG1 3.29Å; G1438-T1442 VanDerWaalsContact O-OG1 3.07Å; D1439-T1442 PolarHBondContact O-N 2.97Å; D1439-T1442 VanDerWaalsContact O-N 3.16Å; D1439-T1442 PolarHBondContact O-OG1 3.18Å; L1440-T1442 VanDerWaalsContact C-N 3.31Å; T1442-N1444 PolarHBondContact O-N 3.01Å; T1442-N1444 VanDerWaalsContact O-N 3.17Å; T1442-N1444 PolarHBondContact O-ND2 3.32Å
1443	I	63.2	Low	60.4	Low	48.4 Å²	48.4	60.9 Å²	60.9	25%	0.248	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	6.9	178.1	-16.2	173.3	0	0	0	111.9	Q1217 R1218 W1326 D1327 D1439 L1440 W1441 S1445 F1446	Q1217-I1443 HydrophobicContact CG-CB 4.33Å; Q1217-I1443 HydrophobicContact CG-CD1 3.7Å; Q1217-I1443 VanDerWaalsContact CG-CD1 3.48Å; Q1217-I1443 HydrophobicContact CG-CG2 4.05Å; R1218-I1443 HydrophobicContact CB-CD1 4.49Å; W1326-I1443 HydrophobicContact CE3-CG1 4.17Å; W1326-I1443 HydrophobicContact CE3-CG2 3.8Å; W1326-I1443 HydrophobicContact CZ3-CB 4.37Å; W1326-I1443 HydrophobicContact CZ3-CG1 4.15Å; W1326-I1443 HydrophobicContact CZ3-CG2 3.82Å; W1326-I1443 WeakPolarHBondContact O-CG2 3.33Å; D1327-I1443 HydrophobicContact CB-CG1 4.39Å; D1327-I1443 WeakPolarHBondContact O-CD1 3.24Å; D1439-I1443 WeakPolarHBondContact O-CB 3.46Å; D1439-I1443 WeakPolarHBondContact O-CD1 3.35Å; D1439-I1443 VanDerWaalsContact O-CG1 3.28Å; D1439-I1443 WeakPolarHBondContact O-CG1 3.21Å; D1439-I1443 WeakPolarHBondContact O-CG2 3.47Å; D1439-I1443 PolarHBondContact O-N 3.21Å; D1439-I1443 VanDerWaalsContact O-N 3.13Å; L1440-I1443 HydrophobicContact CD2-CD1 4.03Å; L1440-I1443 HydrophobicContact CG-CD1 4.5Å; L1440-I1443 PolarHBondContact O-N 2.9Å; W1441-I1443 PolarHBondContact O-N 2.99Å; I1443-S1445 VanDerWaalsContact C-N 3.29Å; I1443-S1445 WeakPolarHBondContact CD1-OG 3.24Å; I1443-S1445 WeakPolarHBondContact CG1-OG 3.34Å; I1443-S1445 PolarHBondContact O-N 3.19Å; I1443-F1446 PolarHBondContact O-N 2.89Å
1444	N	58.9	Low	58.7	Low	69 Å²	69	65.3 Å²	65.3	37%	0.369	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.8	5.7	-176.4	-75.2	-62.2	0	0	0	117.3	I1413 L1440 W1441 T1442 F1446 M1447 K1449	I1413-N1444 VanDerWaalsContact CD1-ND2 3.31Å; I1413-N1444 WeakPolarHBondContact CD1-ND2 3.4Å; I1413-N1444 VanDerWaalsContact CG1-ND2 3.29Å; I1413-N1444 WeakPolarHBondContact CG1-ND2 3.44Å; L1440-N1444 PolarHBondContact O-N 2.76Å; W1441-N1444 WeakPolarHBondContact O-CA 3.35Å; W1441-N1444 PolarHBondContact O-N 2.98Å; W1441-N1444 VanDerWaalsContact O-N 3.13Å; T1442-N1444 PolarHBondContact O-N 3.01Å; T1442-N1444 VanDerWaalsContact O-N 3.17Å; T1442-N1444 PolarHBondContact O-ND2 3.32Å; N1444-F1446 VanDerWaalsContact C-N 3.29Å; N1444-F1446 PolarHBondContact O-N 2.96Å; N1444-M1447 HydrophobicContact CB-CB 4.19Å; N1444-M1447 HydrophobicContact CB-CG 3.93Å; N1444-M1447 WeakPolarHBondContact O-CA 3.32Å; N1444-M1447 VanDerWaalsContact O-CB 3.3Å; N1444-M1447 WeakPolarHBondContact O-CB 3.21Å; N1444-M1447 PolarHBondContact O-N 2.86Å; N1444-M1447 VanDerWaalsContact O-N 3.11Å; N1444-M1447 WeakPolarHBondContact OD1-CG 3.49Å; N1444-K1449 WeakPolarHBondContact O-CE 3.45Å; N1444-K1449 PolarHBondContact OD1-NZ 3.36Å
1445	S	55.6	Low	56.7	Low	64.8 Å²	64.8	69.3 Å²	69.3	45%	0.453	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-27.1	-177.5	-64.6	0	0	0	0	114.1	L1440 I1443 M1447	L1440-S1445 WeakPolarHBondContact O-CB 3.32Å; L1440-S1445 PolarHBondContact O-N 3.24Å; I1443-S1445 VanDerWaalsContact C-N 3.29Å; I1443-S1445 WeakPolarHBondContact CD1-OG 3.24Å; I1443-S1445 WeakPolarHBondContact CG1-OG 3.34Å; I1443-S1445 PolarHBondContact O-N 3.19Å; S1445-M1447 VanDerWaalsContact C-N 3.31Å; S1445-M1447 PolarHBondContact O-N 3.32Å
1446	F	52.3	Low	54.9	Low	77.6 Å²	77.6	70.3 Å²	70.3	34%	0.34	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-7.3	176.7	-72.9	-62.8	0	0	0	115.2	P1185 H1437 L1440 W1441 I1443 N1444 P1448 P1603	P1185-F1446 HydrophobicContact CB-CZ 4.14Å; P1185-F1446 HydrophobicContact CG-CZ 4.27Å; H1437-F1446 HydrophobicContact CB-CD2 4.22Å; H1437-F1446 HydrophobicContact CB-CE2 3.63Å; H1437-F1446 VanDerWaalsContact CB-CE2 3.47Å; H1437-F1446 HydrophobicContact CB-CZ 4Å; H1437-F1446 AromaticContact CG-CE2 3.87Å; H1437-F1446 AromaticContact ND1-CE2 3.59Å; H1437-F1446 AromaticContact ND1-CZ 3.77Å; H1437-F1446 WeakPolarHBondContact ND1-CZ 3.49Å; L1440-F1446 HydrophobicContact CB-CD2 3.75Å; L1440-F1446 VanDerWaalsContact CB-CD2 3.45Å; L1440-F1446 HydrophobicContact CB-CE2 3.41Å; L1440-F1446 HydrophobicContact CB-CZ 3.74Å; L1440-F1446 HydrophobicContact CD1-CD2 4.46Å; L1440-F1446 HydrophobicContact CD1-CE1 4.36Å; L1440-F1446 HydrophobicContact CD1-CE2 4.01Å; L1440-F1446 HydrophobicContact CD1-CZ 3.92Å; L1440-F1446 HydrophobicContact CG-CE2 4.36Å; L1440-F1446 HydrophobicContact CG-CZ 4.36Å; L1440-F1446 PolarHBondContact O-N 3.15Å; W1441-F1446 HydrophobicContact CB-CB 4.25Å; W1441-F1446 AromaticContact CD1-CD2 3.83Å; W1441-F1446 AromaticContact CD1-CE2 3.89Å; W1441-F1446 HydrophobicContact CD2-CB 4.21Å; W1441-F1446 AromaticContact CD2-CD2 3.61Å; W1441-F1446 HydrophobicContact CD2-CD2 4.01Å; W1441-F1446 HydrophobicContact CD2-CE2 4.3Å; W1441-F1446 HydrophobicContact CD2-CG 4.37Å; W1441-F1446 AromaticContact CE2-CD2 3.58Å; W1441-F1446 AromaticContact CE2-CE2 3.85Å; W1441-F1446 AromaticContact CE2-CG 3.99Å; W1441-F1446 HydrophobicContact CE3-CB 3.89Å; W1441-F1446 AromaticContact CE3-CD2 3.84Å; W1441-F1446 HydrophobicContact CE3-CD2 4Å; W1441-F1446 AromaticContact CE3-CG 3.84Å; W1441-F1446 HydrophobicContact CE3-CG 4.16Å; W1441-F1446 HydrophobicContact CG-CB 4.35Å; W1441-F1446 AromaticContact CG-CD2 3.82Å; W1441-F1446 HydrophobicContact CG-CD2 4.02Å; W1441-F1446 HydrophobicContact CG-CE2 4.23Å; W1441-F1446 HydrophobicContact CH2-CB 4.36Å; W1441-F1446 AromaticContact CH2-CD2 3.68Å; W1441-F1446 HydrophobicContact CH2-CD2 4.07Å; W1441-F1446 HydrophobicContact CH2-CE2 4.09Å; W1441-F1446 HydrophobicContact CH2-CG 4.16Å; W1441-F1446 HydrophobicContact CZ2-CB 4.08Å; W1441-F1446 HydrophobicContact CZ2-CD2 4.18Å; W1441-F1446 HydrophobicContact CZ2-CE2 4.45Å; W1441-F1446 HydrophobicContact CZ2-CG 4.34Å; W1441-F1446 HydrophobicContact CZ3-CB 3.92Å; W1441-F1446 HydrophobicContact CZ3-CD1 4.32Å; W1441-F1446 AromaticContact CZ3-CD2 3.32Å; W1441-F1446 HydrophobicContact CZ3-CD2 3.86Å; W1441-F1446 HydrophobicContact CZ3-CE2 4.16Å; W1441-F1446 AromaticContact CZ3-CG 3.42Å; W1441-F1446 HydrophobicContact CZ3-CG 3.42Å; W1441-F1446 VanDerWaalsContact CZ3-CG 3.42Å; W1441-F1446 AromaticContact NE1-CD2 3.8Å; W1441-F1446 AromaticContact NE1-CE2 3.69Å; I1443-F1446 PolarHBondContact O-N 2.89Å; N1444-F1446 VanDerWaalsContact C-N 3.29Å; N1444-F1446 PolarHBondContact O-N 2.96Å; F1446-P1448 WeakPolarHBondContact O-CD 2.97Å; F1446-P1448 VanDerWaalsContact O-N 3.11Å; F1446-P1603 HydrophobicContact CD1-CB 4.28Å; F1446-P1603 HydrophobicContact CE1-CB 4.25Å
1447	M	48.4	Very low	53.3	Low	45.2 Å²	45.2	70.7 Å²	70.7	22%	0.223	37%	0.368	C	S	.	.	S	Bend	trans	-73.8	129.7	168.8	-71.4	-65.6	169.4	0	0	109.3	T1412 T1417 T1430 W1441 N1444 S1445 K1449 P1603	T1412-M1447 HydrophobicContact CG2-CB 4.01Å; T1412-M1447 HydrophobicContact CG2-CG 4.26Å; T1417-M1447 HydrophobicContact CG2-CE 3.91Å; T1430-M1447 HydrophobicContact CG2-CE 4.47Å; W1441-M1447 HydrophobicContact CE3-CE 3.78Å; W1441-M1447 HydrophobicContact CE3-SD 4.17Å; W1441-M1447 HydrophobicContact CH2-CE 3.81Å; W1441-M1447 HydrophobicContact CZ3-CE 3.76Å; W1441-M1447 HydrophobicContact CZ3-SD 4.2Å; W1441-M1447 PolarHBondContact O-N 2.7Å; N1444-M1447 HydrophobicContact CB-CB 4.19Å; N1444-M1447 HydrophobicContact CB-CG 3.93Å; N1444-M1447 WeakPolarHBondContact O-CA 3.32Å; N1444-M1447 VanDerWaalsContact O-CB 3.3Å; N1444-M1447 WeakPolarHBondContact O-CB 3.21Å; N1444-M1447 PolarHBondContact O-N 2.86Å; N1444-M1447 VanDerWaalsContact O-N 3.11Å; N1444-M1447 WeakPolarHBondContact OD1-CG 3.49Å; S1445-M1447 VanDerWaalsContact C-N 3.31Å; S1445-M1447 PolarHBondContact O-N 3.32Å; M1447-K1449 PolarHBondContact O-N 2.93Å; M1447-K1449 VanDerWaalsContact O-N 3.09Å; M1447-P1603 HydrophobicContact CE-CB 3.75Å; M1447-P1603 HydrophobicContact CE-CG 4.15Å; M1447-P1603 HydrophobicContact SD-CB 3.31Å; M1447-P1603 WeakPolarHBondContact SD-CB 3.37Å; M1447-P1603 HydrophobicContact SD-CG 4.04Å
1448	P	42.2	Very low	51.7	Low	53 Å²	53	72.2 Å²	72.2	34%	0.344	38%	0.375	S	S	.	.			trans	-58.1	123.6	171.5	-19.2	30.7	0	0	0	109.5	F1446 F1450 M1455	F1446-P1448 WeakPolarHBondContact O-CD 2.97Å; F1446-P1448 VanDerWaalsContact O-N 3.11Å; P1448-F1450 HydrophobicContact CB-CD1 4.09Å; P1448-F1450 HydrophobicContact CB-CD2 4.09Å; P1448-F1450 HydrophobicContact CB-CE1 3.96Å; P1448-F1450 HydrophobicContact CB-CE2 3.75Å; P1448-F1450 HydrophobicContact CB-CG 4.49Å; P1448-F1450 HydrophobicContact CB-CZ 3.93Å; P1448-F1450 HydrophobicContact CG-CD2 4.36Å; P1448-F1450 HydrophobicContact CG-CE1 4.37Å; P1448-F1450 HydrophobicContact CG-CE2 3.81Å; P1448-F1450 HydrophobicContact CG-CZ 4.05Å; P1448-F1450 VanDerWaalsContact O-CD2 3.23Å; P1448-F1450 WeakPolarHBondContact O-CD2 3.19Å; P1448-F1450 PolarHBondContact O-N 2.94Å; P1448-M1455 VanDerWaalsContact CA-CE 3.41Å; P1448-M1455 HydrophobicContact CB-CE 3.35Å; P1448-M1455 VanDerWaalsContact CB-CE 3.43Å; P1448-M1455 HydrophobicContact CB-SD 3.3Å; P1448-M1455 WeakPolarHBondContact CB-SD 3.31Å; P1448-M1455 HydrophobicContact CG-CE 4.35Å
1449	K	40.7	Very low	50.6	Low	177.4 Å²	177.4	77.3 Å²	77.3	77%	0.771	40%	0.401	S	S	*	.			trans	-68.4	83	171.1	-70.3	-174.1	178.5	-179.3	0	108.9	N1444 M1447 S1451 D1452 M1455	N1444-K1449 WeakPolarHBondContact O-CE 3.45Å; N1444-K1449 PolarHBondContact OD1-NZ 3.36Å; M1447-K1449 PolarHBondContact O-N 2.93Å; M1447-K1449 VanDerWaalsContact O-N 3.09Å; K1449-S1451 PolarHBondContact O-N 3.03Å; K1449-S1451 VanDerWaalsContact O-N 3.07Å; K1449-D1452 PolarHBondContact O-N 3.17Å; K1449-D1452 VanDerWaalsContact O-N 3.14Å; K1449-M1455 VanDerWaalsContact O-SD 3.39Å
1450	F	42.5	Very low	49.9	Very low	86.6 Å²	86.6	78.7 Å²	78.7	38%	0.38	41%	0.41	S	S	.	.			trans	-66.2	67.6	-179.9	-72.3	-70.8	0	0	0	111.5	L1409 P1410 L1423 P1448 D1452 M1455 V1460	L1409-F1450 HydrophobicContact CD1-CB 3.61Å; L1409-F1450 HydrophobicContact CD1-CD1 4.41Å; L1409-F1450 HydrophobicContact CD1-CD2 3.34Å; L1409-F1450 HydrophobicContact CD1-CE2 4.26Å; L1409-F1450 HydrophobicContact CD1-CG 3.56Å; P1410-F1450 HydrophobicContact CG-CB 3.71Å; P1410-F1450 HydrophobicContact CG-CD1 3.26Å; P1410-F1450 HydrophobicContact CG-CD2 4.35Å; P1410-F1450 HydrophobicContact CG-CE1 3.86Å; P1410-F1450 HydrophobicContact CG-CG 3.54Å; L1423-F1450 HydrophobicContact CD1-CE1 3.58Å; L1423-F1450 HydrophobicContact CD1-CZ 3.66Å; P1448-F1450 HydrophobicContact CB-CD1 4.09Å; P1448-F1450 HydrophobicContact CB-CD2 4.09Å; P1448-F1450 HydrophobicContact CB-CE1 3.96Å; P1448-F1450 HydrophobicContact CB-CE2 3.75Å; P1448-F1450 HydrophobicContact CB-CG 4.49Å; P1448-F1450 HydrophobicContact CB-CZ 3.93Å; P1448-F1450 HydrophobicContact CG-CD2 4.36Å; P1448-F1450 HydrophobicContact CG-CE1 4.37Å; P1448-F1450 HydrophobicContact CG-CE2 3.81Å; P1448-F1450 HydrophobicContact CG-CZ 4.05Å; P1448-F1450 VanDerWaalsContact O-CD2 3.23Å; P1448-F1450 WeakPolarHBondContact O-CD2 3.19Å; P1448-F1450 PolarHBondContact O-N 2.94Å; F1450-D1452 VanDerWaalsContact C-N 3.3Å; F1450-D1452 PolarHBondContact O-N 2.76Å; F1450-M1455 HydrophobicContact CD1-CE 3.75Å; F1450-M1455 VanDerWaalsContact CD1-CE 3.49Å; F1450-M1455 HydrophobicContact CD2-CE 4.3Å; F1450-M1455 HydrophobicContact CE1-CE 3.76Å; F1450-M1455 HydrophobicContact CE2-CE 4.26Å; F1450-M1455 HydrophobicContact CG-CE 4.15Å; F1450-M1455 HydrophobicContact CZ-CE 3.97Å; F1450-V1460 HydrophobicContact CZ-CG1 3.89Å; F1450-V1460 HydrophobicContact CZ-CG2 4.42Å
1451	S	39.1	Very low	49.6	Very low	96.8 Å²	96.8	78.4 Å²	78.4	68%	0.677	41%	0.41	S	S	*	.			trans	-69.4	-19.7	177.9	76.9	0	0	0	0	114	D1408 K1449 K1453	D1408-S1451 PolarHBondContact O-N 3.04Å; D1408-S1451 WeakPolarHBondContact OD1-CB 3.2Å; D1408-S1451 PolarHBondContact OD1-OG 3.25Å; K1449-S1451 PolarHBondContact O-N 3.03Å; K1449-S1451 VanDerWaalsContact O-N 3.07Å; S1451-K1453 VanDerWaalsContact C-N 3.33Å; S1451-K1453 PolarHBondContact O-N 3.11Å; S1451-K1453 VanDerWaalsContact O-N 3.1Å
1452	D	37.9	Very low	49	Very low	114.6 Å²	114.6	80.9 Å²	80.9	61%	0.613	43%	0.429	S	S	*	.			trans	-85.5	101.3	179	-80.5	-33.3	0	0	0	110.9	K1449 F1450 N1454 M1455	K1449-D1452 PolarHBondContact O-N 3.17Å; K1449-D1452 VanDerWaalsContact O-N 3.14Å; F1450-D1452 VanDerWaalsContact C-N 3.3Å; F1450-D1452 PolarHBondContact O-N 2.76Å; D1452-N1454 CarbonylContact O-C 3.27Å; D1452-N1454 PolarHBondContact O-N 3.27Å; D1452-M1455 HydrophobicContact CB-CB 4.38Å; D1452-M1455 WeakPolarHBondContact O-CB 3.15Å; D1452-M1455 PolarHBondContact O-N 2.97Å; D1452-M1455 VanDerWaalsContact O-N 3.12Å
1453	K	42.7	Very low	48.5	Very low	188.4 Å²	188.4	84.2 Å²	84.2	82%	0.819	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-0.8	177.3	-70.8	-174.6	174.3	-177.8	0	115.4	D1408 S1451	D1408-K1453 IonicContact OD1-NZ 2.68Å; D1408-K1453 PolarHBondContact OD1-NZ 3.14Å; S1451-K1453 VanDerWaalsContact C-N 3.33Å; S1451-K1453 PolarHBondContact O-N 3.11Å; S1451-K1453 VanDerWaalsContact O-N 3.1Å
1454	N	38.8	Very low	48	Very low	151 Å²	151	84.4 Å²	84.4	81%	0.807	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.7	7.6	-179	-76.7	-18.3	0	0	0	113.9	D1452 V1456	D1452-N1454 CarbonylContact O-C 3.27Å; D1452-N1454 PolarHBondContact O-N 3.27Å; N1454-V1456 VanDerWaalsContact C-N 3.3Å; N1454-V1456 WeakPolarHBondContact O-CG2 3.39Å; N1454-V1456 PolarHBondContact O-N 3.16Å
1455	M	39.1	Very low	48.2	Very low	84.8 Å²	84.8	86.2 Å²	86.2	42%	0.418	48%	0.477	S	S	.	.			trans	-81.9	103.7	-176.5	-152.4	172.1	66.9	0	0	112.1	P1448 K1449 F1450 D1452 V1457 V1460	P1448-M1455 VanDerWaalsContact CA-CE 3.41Å; P1448-M1455 HydrophobicContact CB-CE 3.35Å; P1448-M1455 VanDerWaalsContact CB-CE 3.43Å; P1448-M1455 HydrophobicContact CB-SD 3.3Å; P1448-M1455 WeakPolarHBondContact CB-SD 3.31Å; P1448-M1455 HydrophobicContact CG-CE 4.35Å; K1449-M1455 VanDerWaalsContact O-SD 3.39Å; F1450-M1455 HydrophobicContact CD1-CE 3.75Å; F1450-M1455 VanDerWaalsContact CD1-CE 3.49Å; F1450-M1455 HydrophobicContact CD2-CE 4.3Å; F1450-M1455 HydrophobicContact CE1-CE 3.76Å; F1450-M1455 HydrophobicContact CE2-CE 4.26Å; F1450-M1455 HydrophobicContact CG-CE 4.15Å; F1450-M1455 HydrophobicContact CZ-CE 3.97Å; D1452-M1455 HydrophobicContact CB-CB 4.38Å; D1452-M1455 WeakPolarHBondContact O-CB 3.15Å; D1452-M1455 PolarHBondContact O-N 2.97Å; D1452-M1455 VanDerWaalsContact O-N 3.12Å; M1455-V1457 VanDerWaalsContact C-N 3.3Å; M1455-V1457 HydrophobicContact CE-CG2 3.95Å; M1455-V1457 VanDerWaalsContact CE-CG2 3.46Å; M1455-V1457 HydrophobicContact CG-CB 4.28Å; M1455-V1457 HydrophobicContact CG-CG2 3.7Å; M1455-V1457 PolarHBondContact O-N 3.21Å; M1455-V1457 HydrophobicContact SD-CG2 4.07Å; M1455-V1460 HydrophobicContact CE-CG2 3.85Å
1456	V	43.9	Very low	49.1	Very low	70.2 Å²	70.2	85.1 Å²	85.1	43%	0.425	47%	0.465	S	S	.	.			trans	-71	92.4	177.5	-173.2	0	0	0	0	110	K1416 N1454 E1458 N1459 V1460	K1416-V1456 HydrophobicContact CB-CG1 4.35Å; K1416-V1456 HydrophobicContact CD-CG1 3.56Å; K1416-V1456 WeakPolarHBondContact O-CG1 3.43Å; N1454-V1456 VanDerWaalsContact C-N 3.3Å; N1454-V1456 WeakPolarHBondContact O-CG2 3.39Å; N1454-V1456 PolarHBondContact O-N 3.16Å; V1456-E1458 VanDerWaalsContact C-N 3.29Å; V1456-E1458 HydrophobicContact CG1-CB 3.83Å; V1456-E1458 HydrophobicContact CG1-CG 3.96Å; V1456-E1458 PolarHBondContact O-N 3Å; V1456-E1458 VanDerWaalsContact O-N 3.08Å; V1456-N1459 HydrophobicContact CB-CB 4.27Å; V1456-N1459 HydrophobicContact CG1-CB 3.43Å; V1456-N1459 VanDerWaalsContact CG1-CB 3.47Å; V1456-N1459 WeakPolarHBondContact CG1-ND2 3.35Å; V1456-N1459 CarbonylContact O-C 3.54Å; V1456-N1459 VanDerWaalsContact O-C 3.27Å; V1456-N1459 WeakPolarHBondContact O-CA 3.46Å; V1456-N1459 VanDerWaalsContact O-CB 3.3Å; V1456-N1459 WeakPolarHBondContact O-CB 3.45Å; V1456-N1459 PolarHBondContact O-N 3.15Å; V1456-N1459 VanDerWaalsContact O-N 3.1Å; V1456-V1460 HydrophobicContact CB-CG2 4.28Å; V1456-V1460 HydrophobicContact CG1-CG2 3.87Å; V1456-V1460 VanDerWaalsContact O-CG2 3.28Å; V1456-V1460 WeakPolarHBondContact O-CG2 3.32Å; V1456-V1460 PolarHBondContact O-N 2.94Å
1457	V	46.4	Very low	50.5	Low	32.2 Å²	32.2	82 Å²	82	20%	0.195	45%	0.451	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-34.1	-174.9	178.6	0	0	0	0	112.7	T1412 T1415 T1417 M1455 N1459 V1460 C1461 P1603	T1412-V1457 HydrophobicContact CG2-CG2 3.84Å; T1415-V1457 HydrophobicContact CG2-CB 3.95Å; T1415-V1457 HydrophobicContact CG2-CG1 3.92Å; T1415-V1457 HydrophobicContact CG2-CG2 3.93Å; T1415-V1457 WeakPolarHBondContact O-CB 3.44Å; T1415-V1457 WeakPolarHBondContact OG1-CG2 3.39Å; T1417-V1457 HydrophobicContact CG2-CB 4.14Å; T1417-V1457 HydrophobicContact CG2-CG1 4.16Å; M1455-V1457 VanDerWaalsContact C-N 3.3Å; M1455-V1457 HydrophobicContact CE-CG2 3.95Å; M1455-V1457 VanDerWaalsContact CE-CG2 3.46Å; M1455-V1457 HydrophobicContact CG-CB 4.28Å; M1455-V1457 HydrophobicContact CG-CG2 3.7Å; M1455-V1457 PolarHBondContact O-N 3.21Å; M1455-V1457 HydrophobicContact SD-CG2 4.07Å; V1457-N1459 VanDerWaalsContact C-N 3.35Å; V1457-N1459 PolarHBondContact O-N 3.19Å; V1457-N1459 VanDerWaalsContact O-N 3.16Å; V1457-V1460 WeakPolarHBondContact O-CB 3.29Å; V1457-V1460 PolarHBondContact O-N 3.01Å; V1457-C1461 PolarHBondContact O-N 3.17Å; V1457-P1603 HydrophobicContact CG1-CG 3.84Å
1458	E	43.9	Very low	52.2	Low	79 Å²	79	80.9 Å²	80.9	37%	0.369	45%	0.447	S	S	.	.	H	α-helix	trans	-55.9	-36.4	174.5	-79.2	-179.9	169.1	0	0	113	K1416 T1417 T1418 N1421 V1456 V1460 C1461 S1462	K1416-E1458 WeakPolarHBondContact CA-OE1 3.33Å; K1416-E1458 HydrophobicContact CB-CG 4.18Å; K1416-E1458 WeakPolarHBondContact CB-OE1 3.4Å; K1416-E1458 HydrophobicContact CD-CB 3.99Å; K1416-E1458 HydrophobicContact CD-CG 3.86Å; K1416-E1458 WeakPolarHBondContact CD-OE1 3.37Å; K1416-E1458 WeakPolarHBondContact CE-OE1 3.29Å; K1416-E1458 HydrophobicContact CG-CG 4.19Å; K1416-E1458 VanDerWaalsContact CG-OE1 3.31Å; K1416-E1458 WeakPolarHBondContact CG-OE1 3.33Å; K1416-E1458 IonicContact NZ-OE1 2.73Å; K1416-E1458 PolarHBondContact NZ-OE1 3.48Å; K1416-E1458 IonicContact NZ-OE2 3.45Å; K1416-E1458 PolarHBondContact NZ-OE2 2.9Å; K1416-E1458 WeakPolarHBondContact O-CG 3.46Å; K1416-E1458 VanDerWaalsContact O-OE1 3.14Å; T1417-E1458 PolarHBondContact N-OE1 3.34Å; T1418-E1458 VanDerWaalsContact CB-CD 3.41Å; T1418-E1458 WeakPolarHBondContact CB-OE2 3.47Å; T1418-E1458 HydrophobicContact CG2-CB 4.33Å; T1418-E1458 VanDerWaalsContact CG2-CD 3.42Å; T1418-E1458 HydrophobicContact CG2-CG 3.52Å; T1418-E1458 VanDerWaalsContact CG2-OE1 3.23Å; T1418-E1458 WeakPolarHBondContact CG2-OE1 3.15Å; T1418-E1458 VanDerWaalsContact CG2-OE2 3.29Å; T1418-E1458 WeakPolarHBondContact CG2-OE2 3.45Å; T1418-E1458 PolarHBondContact N-OE1 2.9Å; T1418-E1458 WeakPolarHBondContact OG1-CG 3.46Å; N1421-E1458 PolarHBondContact ND2-OE1 2.76Å; N1421-E1458 PolarHBondContact ND2-OE2 2.97Å; V1456-E1458 VanDerWaalsContact C-N 3.29Å; V1456-E1458 HydrophobicContact CG1-CB 3.83Å; V1456-E1458 HydrophobicContact CG1-CG 3.96Å; V1456-E1458 PolarHBondContact O-N 3Å; V1456-E1458 VanDerWaalsContact O-N 3.08Å; E1458-V1460 VanDerWaalsContact C-N 3.27Å; E1458-V1460 PolarHBondContact O-N 3.16Å; E1458-V1460 VanDerWaalsContact O-N 3.13Å; E1458-C1461 PolarHBondContact O-N 2.98Å; E1458-C1461 VanDerWaalsContact O-N 3.16Å; E1458-S1462 WeakPolarHBondContact O-CA 3.02Å; E1458-S1462 VanDerWaalsContact O-CB 3.22Å; E1458-S1462 WeakPolarHBondContact O-CB 3.32Å; E1458-S1462 PolarHBondContact O-N 3.18Å; E1458-S1462 PolarHBondContact O-OG 3.11Å; E1458-S1462 VanDerWaalsContact O-OG 3.05Å
1459	N	48.5	Very low	54	Low	114.6 Å²	114.6	79.2 Å²	79.2	61%	0.613	44%	0.435	S	S	*	.	H	α-helix	trans	-75.2	-21	179.8	-72.9	-19.5	0	0	0	113.2	V1456 V1457 C1461 S1462 S1463	V1456-N1459 HydrophobicContact CB-CB 4.27Å; V1456-N1459 HydrophobicContact CG1-CB 3.43Å; V1456-N1459 VanDerWaalsContact CG1-CB 3.47Å; V1456-N1459 WeakPolarHBondContact CG1-ND2 3.35Å; V1456-N1459 CarbonylContact O-C 3.54Å; V1456-N1459 VanDerWaalsContact O-C 3.27Å; V1456-N1459 WeakPolarHBondContact O-CA 3.46Å; V1456-N1459 VanDerWaalsContact O-CB 3.3Å; V1456-N1459 WeakPolarHBondContact O-CB 3.45Å; V1456-N1459 PolarHBondContact O-N 3.15Å; V1456-N1459 VanDerWaalsContact O-N 3.1Å; V1457-N1459 VanDerWaalsContact C-N 3.35Å; V1457-N1459 PolarHBondContact O-N 3.19Å; V1457-N1459 VanDerWaalsContact O-N 3.16Å; N1459-C1461 PolarHBondContact O-N 2.86Å; N1459-S1462 VanDerWaalsContact CA-OG 3.3Å; N1459-S1462 WeakPolarHBondContact CA-OG 3.34Å; N1459-S1462 PolarHBondContact N-OG 3.32Å; N1459-S1462 CarbonylContact O-C 3.53Å; N1459-S1462 PolarHBondContact O-N 3.42Å; N1459-S1463 VanDerWaalsContact O-CA 3.27Å; N1459-S1463 WeakPolarHBondContact O-CA 3.21Å; N1459-S1463 VanDerWaalsContact O-CB 3.26Å; N1459-S1463 WeakPolarHBondContact O-CB 3.35Å; N1459-S1463 PolarHBondContact O-N 3.05Å; N1459-S1463 PolarHBondContact O-OG 3.06Å
1460	V	57.8	Low	55.9	Low	50 Å²	50	73.6 Å²	73.6	30%	0.303	42%	0.416	S	S	.	.	H	α-helix	trans	-75.2	-38.6	-177.1	-175.7	0	0	0	0	111.8	F1450 M1455 V1456 V1457 E1458 I1466 K1601	F1450-V1460 HydrophobicContact CZ-CG1 3.89Å; F1450-V1460 HydrophobicContact CZ-CG2 4.42Å; M1455-V1460 HydrophobicContact CE-CG2 3.85Å; V1456-V1460 HydrophobicContact CB-CG2 4.28Å; V1456-V1460 HydrophobicContact CG1-CG2 3.87Å; V1456-V1460 VanDerWaalsContact O-CG2 3.28Å; V1456-V1460 WeakPolarHBondContact O-CG2 3.32Å; V1456-V1460 PolarHBondContact O-N 2.94Å; V1457-V1460 WeakPolarHBondContact O-CB 3.29Å; V1457-V1460 PolarHBondContact O-N 3.01Å; E1458-V1460 VanDerWaalsContact C-N 3.27Å; E1458-V1460 PolarHBondContact O-N 3.16Å; E1458-V1460 VanDerWaalsContact O-N 3.13Å; V1460-I1466 WeakPolarHBondContact O-CD1 3.13Å; V1460-K1601 WeakPolarHBondContact CG1-O 3.36Å
1461	C	65	Low	57.7	Low	16.6 Å²	16.6	72 Å²	72	11%	0.112	41%	0.413	C	S	.	.	H	α-helix	trans	-91.7	-12.6	175.9	-60.6	0	0	0	0	113.2	V1457 E1458 N1459 S1463 I1466 C1602 P1603	V1457-C1461 PolarHBondContact O-N 3.17Å; E1458-C1461 PolarHBondContact O-N 2.98Å; E1458-C1461 VanDerWaalsContact O-N 3.16Å; N1459-C1461 PolarHBondContact O-N 2.86Å; C1461-S1463 PolarHBondContact O-N 3.3Å; C1461-I1466 HydrophobicContact CB-CD1 4.42Å; C1461-I1466 WeakPolarHBondContact O-CD1 3.29Å; C1461-C1602 HydrophobicContact CB-CB 4.25Å; C1461-C1602 WeakPolarHBondContact CB-SG 3.35Å; C1461-C1602 VanDerWaalsContact SG-CA 3.54Å; C1461-C1602 WeakPolarHBondContact SG-CA 3.38Å; C1461-C1602 WeakPolarHBondContact SG-CB 3.36Å; C1461-C1602 CovalentContact SG-SG 2.05Å; C1461-C1602 PolarHBondContact SG-SG 3.02Å; C1461-P1603 VanDerWaalsContact SG-CD 3.57Å
1462	S	56.5	Low	59.9	Low	68.2 Å²	68.2	67.8 Å²	67.8	48%	0.477	38%	0.383	S	S	.	.			trans	-94.6	-0.4	-169	-57.2	0	0	0	0	115.2	T1418 E1458 N1459 G1464	T1418-S1462 PolarHBondContact OG1-OG 3.27Å; E1458-S1462 WeakPolarHBondContact O-CA 3.02Å; E1458-S1462 VanDerWaalsContact O-CB 3.22Å; E1458-S1462 WeakPolarHBondContact O-CB 3.32Å; E1458-S1462 PolarHBondContact O-N 3.18Å; E1458-S1462 PolarHBondContact O-OG 3.11Å; E1458-S1462 VanDerWaalsContact O-OG 3.05Å; N1459-S1462 VanDerWaalsContact CA-OG 3.3Å; N1459-S1462 WeakPolarHBondContact CA-OG 3.34Å; N1459-S1462 PolarHBondContact N-OG 3.32Å; N1459-S1462 CarbonylContact O-C 3.53Å; N1459-S1462 PolarHBondContact O-N 3.42Å; S1462-G1464 VanDerWaalsContact C-N 3.31Å; S1462-G1464 PolarHBondContact O-N 3.2Å; S1462-G1464 VanDerWaalsContact O-N 3.13Å
1463	S	54.7	Low	61.9	Low	80.6 Å²	80.6	64.1 Å²	64.1	56%	0.564	37%	0.372	S	S	*	.	S	Bend	trans	-72	86.1	166	40.1	0	0	0	0	109.2	N1459 C1461 N1465 I1466	N1459-S1463 VanDerWaalsContact O-CA 3.27Å; N1459-S1463 WeakPolarHBondContact O-CA 3.21Å; N1459-S1463 VanDerWaalsContact O-CB 3.26Å; N1459-S1463 WeakPolarHBondContact O-CB 3.35Å; N1459-S1463 PolarHBondContact O-N 3.05Å; N1459-S1463 PolarHBondContact O-OG 3.06Å; C1461-S1463 PolarHBondContact O-N 3.3Å; S1463-N1465 PolarHBondContact O-N 3.25Å; S1463-I1466 WeakPolarHBondContact O-CG1 3.36Å; S1463-I1466 PolarHBondContact O-N 3.19Å; S1463-I1466 WeakPolarHBondContact OG-CD1 3.42Å
1464	G	54	Low	63.5	Low	51 Å²	51	55.6 Å²	55.6	53%	0.526	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-20.9	18.4	-179.7	0	0	0	0	0	115.5	S1462 I1466 M2001	S1462-G1464 VanDerWaalsContact C-N 3.31Å; S1462-G1464 PolarHBondContact O-N 3.2Å; S1462-G1464 VanDerWaalsContact O-N 3.13Å; G1464-I1466 VanDerWaalsContact C-N 3.28Å; G1464-I1466 PolarHBondContact O-N 3.13Å; G1464-M2001 WeakPolarHBondContact O-CE 3.19Å
1465	N	62.8	Low	65.9	Low	108.6 Å²	108.6	48.6 Å²	48.6	58%	0.581	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	30.8	179.3	-59.7	-14.2	0	0	0	113.8	S1463 H1467 P1963	S1463-N1465 PolarHBondContact O-N 3.25Å; N1465-H1467 VanDerWaalsContact C-N 3.28Å; N1465-H1467 CarbonylContact O-C 3.32Å; N1465-H1467 PolarHBondContact O-CD2 2.87Å; N1465-H1467 VanDerWaalsContact O-CD2 3.31Å; N1465-H1467 PolarHBondContact O-N 3.08Å; N1465-H1467 VanDerWaalsContact O-N 3.14Å; N1465-H1467 PolarHBondContact O-NE2 2.82Å; N1465-P1963 WeakPolarHBondContact OD1-CG 3.47Å
1466	I	74.2	Confident	68.2	Low	39.8 Å²	39.8	49.8 Å²	49.8	20%	0.204	30%	0.302	C	S	.	.	S	Bend	trans	-60.5	-30.3	176	-70.9	174	0	0	0	111.3	V1460 C1461 S1463 G1464 D1468 Y1599 F1606 P1963 M2001	V1460-I1466 WeakPolarHBondContact O-CD1 3.13Å; C1461-I1466 HydrophobicContact CB-CD1 4.42Å; C1461-I1466 WeakPolarHBondContact O-CD1 3.29Å; S1463-I1466 WeakPolarHBondContact O-CG1 3.36Å; S1463-I1466 PolarHBondContact O-N 3.19Å; S1463-I1466 WeakPolarHBondContact OG-CD1 3.42Å; G1464-I1466 VanDerWaalsContact C-N 3.28Å; G1464-I1466 PolarHBondContact O-N 3.13Å; I1466-D1468 PolarHBondContact O-N 3.43Å; I1466-Y1599 HydrophobicContact CG2-CD1 3.89Å; I1466-Y1599 HydrophobicContact CG2-CD2 3.88Å; I1466-Y1599 HydrophobicContact CG2-CE1 4.2Å; I1466-Y1599 HydrophobicContact CG2-CE2 4.2Å; I1466-Y1599 HydrophobicContact CG2-CG 3.7Å; I1466-Y1599 VanDerWaalsContact O-CE1 3.29Å; I1466-Y1599 WeakPolarHBondContact O-CE1 3.32Å; I1466-Y1599 VanDerWaalsContact O-CZ 3.27Å; I1466-Y1599 PolarHBondContact O-OH 3.11Å; I1466-F1606 HydrophobicContact CG2-CE2 4.2Å; I1466-F1606 HydrophobicContact CG2-CZ 4.06Å; I1466-P1963 HydrophobicContact CD1-CB 4.06Å; I1466-P1963 HydrophobicContact CD1-CG 3.44Å; I1466-P1963 VanDerWaalsContact CD1-CG 3.44Å; I1466-M2001 HydrophobicContact CB-CE 4.42Å; I1466-M2001 HydrophobicContact CB-SD 4.28Å; I1466-M2001 HydrophobicContact CG2-CE 3.79Å; I1466-M2001 HydrophobicContact CG2-CG 3.57Å; I1466-M2001 HydrophobicContact CG2-SD 3.23Å; I1466-M2001 WeakPolarHBondContact CG2-SD 3.27Å
1467	H	81.9	Confident	70.3	Confident	12.8 Å²	12.8	47.1 Å²	47.1	6%	0.059	29%	0.285	C	S	.	.			trans	-114.7	105.5	-179.8	-163	65.3	0	0	0	111.1	N1465 T1469 L1472 Y1597 Y1599 F1606 N1999	N1465-H1467 VanDerWaalsContact C-N 3.28Å; N1465-H1467 CarbonylContact O-C 3.32Å; N1465-H1467 PolarHBondContact O-CD2 2.87Å; N1465-H1467 VanDerWaalsContact O-CD2 3.31Å; N1465-H1467 PolarHBondContact O-N 3.08Å; N1465-H1467 VanDerWaalsContact O-N 3.14Å; N1465-H1467 PolarHBondContact O-NE2 2.82Å; H1467-T1469 VanDerWaalsContact NE2-CG2 3.27Å; H1467-T1469 WeakPolarHBondContact NE2-CG2 3.23Å; H1467-T1469 PolarHBondContact O-N 2.96Å; H1467-L1472 VanDerWaalsContact CE1-CD1 3.44Å; H1467-L1472 WeakPolarHBondContact CE1-CD1 3.23Å; H1467-Y1597 AromaticContact CE1-CD2 3.29Å; H1467-Y1597 VanDerWaalsContact CE1-CD2 3.44Å; H1467-Y1597 WeakPolarHBondContact CE1-CD2 3.27Å; H1467-Y1597 AromaticContact CE1-CE2 3.8Å; H1467-Y1597 AromaticContact CE1-CG 3.68Å; H1467-Y1597 AromaticContact ND1-CD2 3.95Å; H1467-Y1597 AromaticContact ND1-CG 3.96Å; H1467-Y1597 AromaticContact NE2-CD2 3.85Å; H1467-Y1599 WeakPolarHBondContact CA-OH 3.4Å; H1467-Y1599 HydrophobicContact CB-CD2 4.11Å; H1467-Y1599 HydrophobicContact CB-CE2 3.79Å; H1467-Y1599 WeakPolarHBondContact CE1-CB 3.46Å; H1467-Y1599 AromaticContact CE1-CD1 3.56Å; H1467-Y1599 AromaticContact CE1-CD2 3.71Å; H1467-Y1599 AromaticContact CE1-CG 3.25Å; H1467-Y1599 AromaticContact CG-CD2 3.6Å; H1467-Y1599 AromaticContact CG-CE2 3.64Å; H1467-Y1599 AromaticContact CG-CG 3.92Å; H1467-Y1599 AromaticContact CG-CZ 3.98Å; H1467-Y1599 AromaticContact ND1-CD1 3.24Å; H1467-Y1599 WeakPolarHBondContact ND1-CD1 3.44Å; H1467-Y1599 AromaticContact ND1-CD2 3.34Å; H1467-Y1599 VanDerWaalsContact ND1-CD2 3.34Å; H1467-Y1599 WeakPolarHBondContact ND1-CD2 3.43Å; H1467-Y1599 AromaticContact ND1-CE1 3.44Å; H1467-Y1599 WeakPolarHBondContact ND1-CE1 3.15Å; H1467-Y1599 AromaticContact ND1-CE2 3.67Å; H1467-Y1599 AromaticContact ND1-CG 3.17Å; H1467-Y1599 AromaticContact ND1-CZ 3.78Å; H1467-Y1599 PolarHBondContact ND1-OH 3.19Å; H1467-Y1599 AromaticContact NE2-CG 4Å; H1467-F1606 HydrophobicContact CB-CB 4.22Å; H1467-F1606 HydrophobicContact CB-CD1 3.66Å; H1467-F1606 VanDerWaalsContact CB-CD1 3.45Å; H1467-F1606 HydrophobicContact CB-CD2 3.99Å; H1467-F1606 HydrophobicContact CB-CE1 4.02Å; H1467-F1606 HydrophobicContact CB-CE2 4.09Å; H1467-F1606 HydrophobicContact CB-CG 3.67Å; H1467-F1606 HydrophobicContact CB-CZ 4.1Å; H1467-F1606 VanDerWaalsContact CD2-CB 3.43Å; H1467-F1606 WeakPolarHBondContact CD2-CB 3.36Å; H1467-F1606 AromaticContact CD2-CD1 3.85Å; H1467-F1606 AromaticContact CD2-CE2 3.32Å; H1467-F1606 WeakPolarHBondContact CD2-CE2 3.42Å; H1467-F1606 AromaticContact CD2-CG 3.75Å; H1467-F1606 AromaticContact CD2-CZ 3.41Å; H1467-F1606 VanDerWaalsContact CD2-CZ 3.41Å; H1467-F1606 WeakPolarHBondContact CD2-CZ 3.43Å; H1467-F1606 AromaticContact CG-CD1 3.87Å; H1467-F1606 AromaticContact CG-CE2 3.72Å; H1467-F1606 AromaticContact CG-CG 3.66Å; H1467-F1606 AromaticContact CG-CZ 4Å; H1467-F1606 WeakPolarHBondContact ND1-CB 3.32Å; H1467-F1606 AromaticContact ND1-CG 3.88Å; H1467-N1999 PolarHBondContact O-ND2 2.85Å
1468	D	83	Confident	72	Confident	23.4 Å²	23.4	50.4 Å²	50.4	13%	0.125	30%	0.298	C	S	.	.			trans	-115.4	107.5	174.7	175.3	-0.4	0	0	0	109.9	I1466 V1470 T1471 L1472 R1960 S1961 M2001	I1466-D1468 PolarHBondContact O-N 3.43Å; D1468-V1470 VanDerWaalsContact C-N 3.27Å; D1468-V1470 PolarHBondContact O-N 3.14Å; D1468-V1470 VanDerWaalsContact OD1-CA 3.32Å; D1468-V1470 WeakPolarHBondContact OD1-CA 3.38Å; D1468-V1470 VanDerWaalsContact OD1-CB 3.25Å; D1468-V1470 WeakPolarHBondContact OD1-CB 3.2Å; D1468-V1470 PolarHBondContact OD1-N 3.23Å; D1468-T1471 HydrophobicContact CB-CG2 3.97Å; D1468-T1471 WeakPolarHBondContact CB-OG1 3.3Å; D1468-T1471 VanDerWaalsContact CG-CG2 3.45Å; D1468-T1471 PolarHBondContact O-N 2.88Å; D1468-T1471 VanDerWaalsContact O-N 3.17Å; D1468-T1471 PolarHBondContact O-OG1 2.94Å; D1468-T1471 VanDerWaalsContact O-OG1 3.11Å; D1468-T1471 PolarHBondContact OD1-N 3.13Å; D1468-T1471 VanDerWaalsContact OD1-N 3.12Å; D1468-T1471 WeakPolarHBondContact OD2-CB 3.36Å; D1468-T1471 VanDerWaalsContact OD2-CG2 3.28Å; D1468-T1471 WeakPolarHBondContact OD2-CG2 3.38Å; D1468-T1471 PolarHBondContact OD2-N 3.02Å; D1468-T1471 PolarHBondContact OD2-OG1 3.39Å; D1468-L1472 VanDerWaalsContact O-CG 3.23Å; D1468-L1472 WeakPolarHBondContact O-CG 3.38Å; D1468-L1472 PolarHBondContact O-N 3.04Å; D1468-R1960 WeakPolarHBondContact OD2-CA 2.99Å; D1468-S1961 VanDerWaalsContact OD1-CB 3.23Å; D1468-S1961 WeakPolarHBondContact OD1-CB 3.25Å; D1468-S1961 PolarHBondContact OD1-N 2.73Å; D1468-S1961 PolarHBondContact OD1-OG 3.05Å; D1468-S1961 PolarHBondContact OD2-N 2.84Å; D1468-M2001 HydrophobicContact CB-CE 4.11Å
1469	T	80.6	Confident	73.4	Confident	17 Å²	17	48.3 Å²	48.3	10%	0.104	29%	0.292	C	S	.	.	H	α-helix	trans	-64.3	-27.3	-179.5	34.2	0	0	0	0	113.2	H1467 T1471 L1472 G1473 G1474 Y1597 F1606 E1608 R1994	H1467-T1469 VanDerWaalsContact NE2-CG2 3.27Å; H1467-T1469 WeakPolarHBondContact NE2-CG2 3.23Å; H1467-T1469 PolarHBondContact O-N 2.96Å; T1469-T1471 VanDerWaalsContact C-N 3.3Å; T1469-T1471 PolarHBondContact O-N 3.43Å; T1469-L1472 HydrophobicContact CG2-CD1 4.35Å; T1469-L1472 WeakPolarHBondContact O-CB 3.29Å; T1469-L1472 PolarHBondContact O-N 3.06Å; T1469-G1473 CarbonylContact O-C 3.58Å; T1469-G1473 WeakPolarHBondContact O-CA 3.18Å; T1469-G1473 PolarHBondContact O-N 3Å; T1469-G1473 VanDerWaalsContact O-N 3.12Å; T1469-G1474 WeakPolarHBondContact CB-O 3.38Å; T1469-G1474 WeakPolarHBondContact CG2-O 3.08Å; T1469-G1474 WeakPolarHBondContact O-CA 3.37Å; T1469-G1474 PolarHBondContact O-N 3.04Å; T1469-Y1597 HydrophobicContact CG2-CD2 4.16Å; T1469-F1606 HydrophobicContact CG2-CB 4.15Å; T1469-E1608 WeakPolarHBondContact CB-OE1 3.44Å; T1469-E1608 VanDerWaalsContact CG2-CD 3.48Å; T1469-E1608 HydrophobicContact CG2-CG 3.8Å; T1469-E1608 WeakPolarHBondContact CG2-OE1 3.34Å; T1469-E1608 PolarHBondContact OG1-OE1 3.24Å; T1469-R1994 PolarHBondContact OG1-NH2 3.21Å
1470	V	81.1	Confident	74.1	Confident	58.4 Å²	58.4	46.9 Å²	46.9	35%	0.354	28%	0.284	S	S	.	.	H	α-helix	trans	-72.8	-34.7	178.9	-171.7	0	0	0	0	111	D1468 L1472 G1473 R1539 D1959 S1961	D1468-V1470 VanDerWaalsContact C-N 3.27Å; D1468-V1470 PolarHBondContact O-N 3.14Å; D1468-V1470 VanDerWaalsContact OD1-CA 3.32Å; D1468-V1470 WeakPolarHBondContact OD1-CA 3.38Å; D1468-V1470 VanDerWaalsContact OD1-CB 3.25Å; D1468-V1470 WeakPolarHBondContact OD1-CB 3.2Å; D1468-V1470 PolarHBondContact OD1-N 3.23Å; V1470-L1472 PolarHBondContact O-N 2.99Å; V1470-L1472 VanDerWaalsContact O-N 3.14Å; V1470-G1473 PolarHBondContact O-N 2.98Å; V1470-R1539 PolarHBondContact O-NH1 3.17Å; V1470-D1959 WeakPolarHBondContact CG1-O 3.23Å; V1470-S1961 WeakPolarHBondContact CG2-OG 3.38Å
1471	T	80.4	Confident	74	Confident	54.4 Å²	54.4	46.9 Å²	46.9	33%	0.334	29%	0.287	S	S	.	.	H	α-helix	trans	-68	-38.7	173.6	44.7	0	0	0	0	112.4	D1468 T1469 G1473 R1539 R1960	D1468-T1471 HydrophobicContact CB-CG2 3.97Å; D1468-T1471 WeakPolarHBondContact CB-OG1 3.3Å; D1468-T1471 VanDerWaalsContact CG-CG2 3.45Å; D1468-T1471 PolarHBondContact O-N 2.88Å; D1468-T1471 VanDerWaalsContact O-N 3.17Å; D1468-T1471 PolarHBondContact O-OG1 2.94Å; D1468-T1471 VanDerWaalsContact O-OG1 3.11Å; D1468-T1471 PolarHBondContact OD1-N 3.13Å; D1468-T1471 VanDerWaalsContact OD1-N 3.12Å; D1468-T1471 WeakPolarHBondContact OD2-CB 3.36Å; D1468-T1471 VanDerWaalsContact OD2-CG2 3.28Å; D1468-T1471 WeakPolarHBondContact OD2-CG2 3.38Å; D1468-T1471 PolarHBondContact OD2-N 3.02Å; D1468-T1471 PolarHBondContact OD2-OG1 3.39Å; T1469-T1471 VanDerWaalsContact C-N 3.3Å; T1469-T1471 PolarHBondContact O-N 3.43Å; T1471-G1473 VanDerWaalsContact C-N 3.27Å; T1471-G1473 PolarHBondContact O-N 2.87Å; T1471-R1539 VanDerWaalsContact O-CD 3.28Å; T1471-R1539 WeakPolarHBondContact O-CD 3.37Å; T1471-R1539 PolarHBondContact O-NH1 2.93Å; T1471-R1539 VanDerWaalsContact O-NH1 3.08Å; T1471-R1960 HydrophobicContact CG2-CG 4.04Å
1472	L	85.2	Confident	73.5	Confident	7.2 Å²	7.2	49 Å²	49	4%	0.038	30%	0.296	C	S	.	.	H	α-helix	trans	-65.9	-27.2	175.9	-63.5	171.2	0	0	0	112.5	H1467 D1468 T1469 V1470 G1474 L1535 A1536 P1542 L1545 Y1597	H1467-L1472 VanDerWaalsContact CE1-CD1 3.44Å; H1467-L1472 WeakPolarHBondContact CE1-CD1 3.23Å; D1468-L1472 VanDerWaalsContact O-CG 3.23Å; D1468-L1472 WeakPolarHBondContact O-CG 3.38Å; D1468-L1472 PolarHBondContact O-N 3.04Å; T1469-L1472 HydrophobicContact CG2-CD1 4.35Å; T1469-L1472 WeakPolarHBondContact O-CB 3.29Å; T1469-L1472 PolarHBondContact O-N 3.06Å; V1470-L1472 PolarHBondContact O-N 2.99Å; V1470-L1472 VanDerWaalsContact O-N 3.14Å; L1472-G1474 VanDerWaalsContact C-N 3.25Å; L1472-G1474 PolarHBondContact O-N 3.11Å; L1472-L1535 HydrophobicContact CB-CD2 4.25Å; L1472-L1535 HydrophobicContact CD2-CD2 3.75Å; L1472-L1535 HydrophobicContact CG-CD2 4.43Å; L1472-L1535 CarbonylContact O-C 3.58Å; L1472-L1535 WeakPolarHBondContact O-CA 3.44Å; L1472-A1536 WeakPolarHBondContact O-CB 3.25Å; L1472-A1536 PolarHBondContact O-N 3.05Å; L1472-P1542 VanDerWaalsContact CD2-CD 3.42Å; L1472-P1542 HydrophobicContact CD2-CG 3.89Å; L1472-L1545 HydrophobicContact CD2-CD2 4.23Å; L1472-Y1597 HydrophobicContact CD1-CD1 3.93Å; L1472-Y1597 VanDerWaalsContact CD1-CD1 3.42Å; L1472-Y1597 HydrophobicContact CD1-CD2 3.78Å; L1472-Y1597 HydrophobicContact CD1-CE1 3.86Å; L1472-Y1597 VanDerWaalsContact CD1-CE1 3.47Å; L1472-Y1597 HydrophobicContact CD1-CE2 4.15Å; L1472-Y1597 HydrophobicContact CD1-CG 4.24Å
1473	G	79.5	Confident	73.1	Confident	38.2 Å²	38.2	51.5 Å²	51.5	39%	0.394	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.5	9.2	-175.9	0	0	0	0	0	114.1	T1469 V1470 T1471	T1469-G1473 CarbonylContact O-C 3.58Å; T1469-G1473 WeakPolarHBondContact O-CA 3.18Å; T1469-G1473 PolarHBondContact O-N 3Å; T1469-G1473 VanDerWaalsContact O-N 3.12Å; V1470-G1473 PolarHBondContact O-N 2.98Å; T1471-G1473 VanDerWaalsContact C-N 3.27Å; T1471-G1473 PolarHBondContact O-N 2.87Å
1474	G	76.8	Confident	72.9	Confident	9.2 Å²	9.2	52.3 Å²	52.3	10%	0.095	30%	0.3	C	S	.	.			trans	157.7	169.7	-178.9	0	0	0	0	0	112.7	T1469 L1472 Y1476 Y1597	T1469-G1474 WeakPolarHBondContact CB-O 3.38Å; T1469-G1474 WeakPolarHBondContact CG2-O 3.08Å; T1469-G1474 WeakPolarHBondContact O-CA 3.37Å; T1469-G1474 PolarHBondContact O-N 3.04Å; L1472-G1474 VanDerWaalsContact C-N 3.25Å; L1472-G1474 PolarHBondContact O-N 3.11Å; G1474-Y1476 PolarHBondContact O-N 3.02Å; G1474-Y1597 PolarHBondContact O-OH 3.3Å
1475	P	88.5	Confident	73	Confident	3.8 Å²	3.8	53.7 Å²	53.7	3%	0.025	30%	0.295	C	S	.	.			cis	-78.3	137.3	17.4	31.6	-33.2	0	0	0	111.8	H1533 L1534 V1595 Y1597 E1608 R1610	P1475-H1533 VanDerWaalsContact CA-O 3.26Å; P1475-H1533 WeakPolarHBondContact CA-O 3.41Å; P1475-L1534 HydrophobicContact CB-CD2 4.47Å; P1475-V1595 HydrophobicContact CB-CB 4.42Å; P1475-V1595 HydrophobicContact CB-CG2 3.9Å; P1475-V1595 HydrophobicContact CG-CB 4.26Å; P1475-V1595 HydrophobicContact CG-CG2 4.19Å; P1475-Y1597 WeakPolarHBondContact CD-OH 3.37Å; P1475-E1608 VanDerWaalsContact CD-CB 3.49Å; P1475-E1608 HydrophobicContact CG-CB 3.73Å; P1475-E1608 HydrophobicContact CG-CG 4.38Å; P1475-R1610 HydrophobicContact CG-CG 4.31Å; P1475-R1610 PolarHBondContact O-NE 3.04Å; P1475-R1610 PolarHBondContact O-NH2 3.03Å; P1475-R1610 VanDerWaalsContact O-NH2 3.09Å
1476	Y	87.1	Confident	73.1	Confident	111 Å²	111	52.4 Å²	52.4	44%	0.435	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	146	166.6	91.3	-96.6	0	0	0	110.2	G1474 Q1478 H1533	G1474-Y1476 PolarHBondContact O-N 3.02Å; Y1476-Q1478 HydrophobicContact CE1-CB 4.03Å; Y1476-H1533 HydrophobicContact CD1-CB 3.81Å; Y1476-H1533 VanDerWaalsContact CD1-CB 3.44Å; Y1476-H1533 AromaticContact CD1-CD2 3.91Å; Y1476-H1533 HydrophobicContact CD2-CB 4.24Å; Y1476-H1533 AromaticContact CD2-CD2 3.89Å; Y1476-H1533 HydrophobicContact CE1-CB 3.29Å; Y1476-H1533 AromaticContact CE1-CD2 3.96Å; Y1476-H1533 AromaticContact CE1-CG 3.7Å; Y1476-H1533 VanDerWaalsContact CE1-CG 3.44Å; Y1476-H1533 AromaticContact CE1-ND1 3.98Å; Y1476-H1533 HydrophobicContact CE2-CB 3.93Å; Y1476-H1533 AromaticContact CE2-CD2 3.31Å; Y1476-H1533 WeakPolarHBondContact CE2-CD2 3.32Å; Y1476-H1533 AromaticContact CE2-CG 3.65Å; Y1476-H1533 VanDerWaalsContact CE2-CG 3.48Å; Y1476-H1533 AromaticContact CE2-NE2 3.86Å; Y1476-H1533 HydrophobicContact CG-CB 4.12Å; Y1476-H1533 VanDerWaalsContact CZ-CB 3.49Å; Y1476-H1533 AromaticContact CZ-CD2 3.43Å; Y1476-H1533 VanDerWaalsContact CZ-CD2 3.46Å; Y1476-H1533 AromaticContact CZ-CE1 3.81Å; Y1476-H1533 AromaticContact CZ-CG 3.27Å; Y1476-H1533 AromaticContact CZ-ND1 3.78Å; Y1476-H1533 AromaticContact CZ-NE2 3.64Å; Y1476-H1533 PolarHBondContact N-O 3.13Å; Y1476-H1533 VanDerWaalsContact N-O 3.16Å; Y1476-H1533 PolarHBondContact O-N 2.79Å; Y1476-H1533 PolarHBondContact OH-CD2 2.96Å; Y1476-H1533 VanDerWaalsContact OH-CD2 3.25Å; Y1476-H1533 PolarHBondContact OH-CE1 3.22Å; Y1476-H1533 PolarHBondContact OH-ND1 3.12Å; Y1476-H1533 PolarHBondContact OH-NE2 2.87Å
1477	I	88.7	Confident	73.1	Confident	13.8 Å²	13.8	53.6 Å²	53.6	7%	0.071	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	118.3	-175.8	-56.4	174.2	0	0	0	109.1	S1479 I1530 I1532 V1593 R1610 V1612 N2058	I1477-S1479 PolarHBondContact O-N 2.85Å; I1477-I1530 HydrophobicContact CG2-CB 3.88Å; I1477-I1530 HydrophobicContact CG2-CD1 4.21Å; I1477-I1530 HydrophobicContact CG2-CG1 4.42Å; I1477-I1530 HydrophobicContact CG2-CG2 4.04Å; I1477-I1532 HydrophobicContact CG1-CG1 4.47Å; I1477-I1532 HydrophobicContact CG1-CG2 4.32Å; I1477-I1532 HydrophobicContact CG2-CG1 4.47Å; I1477-V1593 HydrophobicContact CD1-CB 3.8Å; I1477-V1593 HydrophobicContact CD1-CG1 4.21Å; I1477-V1593 HydrophobicContact CD1-CG2 3.66Å; I1477-R1610 HydrophobicContact CD1-CB 3.57Å; I1477-R1610 VanDerWaalsContact CD1-CB 3.48Å; I1477-R1610 HydrophobicContact CD1-CG 4.34Å; I1477-R1610 HydrophobicContact CG1-CB 4.23Å; I1477-V1612 HydrophobicContact CB-CG1 4.09Å; I1477-V1612 HydrophobicContact CD1-CB 4.2Å; I1477-V1612 HydrophobicContact CD1-CG1 4Å; I1477-V1612 HydrophobicContact CD1-CG2 4.48Å; I1477-V1612 HydrophobicContact CG2-CB 4.35Å; I1477-V1612 HydrophobicContact CG2-CG1 4.19Å; I1477-V1612 HydrophobicContact CG2-CG2 4.31Å; I1477-N2058 HydrophobicContact CB-CB 4.41Å; I1477-N2058 PolarHBondContact N-O 3.19Å
1478	Q	82.3	Confident	73.1	Confident	100.2 Å²	100.2	56.1 Å²	56.1	47%	0.468	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	107	166.8	-173.5	174.8	2.8	0	0	108.6	Y1476 S1531 H1533	Y1476-Q1478 HydrophobicContact CE1-CB 4.03Å; Q1478-S1531 PolarHBondContact N-O 2.89Å; Q1478-S1531 WeakPolarHBondContact O-CB 3.37Å; Q1478-S1531 PolarHBondContact O-N 2.79Å; Q1478-S1531 VanDerWaalsContact O-N 3.12Å; Q1478-H1533 PolarHBondContact OE1-NE2 3.05Å
1479	S	72	Confident	73.3	Confident	35.4 Å²	35.4	56.5 Å²	56.5	25%	0.248	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	143.9	166.8	174.9	0	0	0	0	109.8	I1477 S1481	I1477-S1479 PolarHBondContact O-N 2.85Å; S1479-S1481 VanDerWaalsContact C-N 3.32Å; S1479-S1481 PolarHBondContact O-N 3.07Å
1480	N	63.3	Low	73.6	Confident	85.4 Å²	85.4	60.2 Å²	60.2	46%	0.457	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-68.8	107	167.8	-73.4	1.3	0	0	0	109.1	L1482 N1500	N1480-L1482 PolarHBondContact O-N 2.98Å; N1480-N1500 PolarHBondContact ND2-ND2 3.23Å; N1480-N1500 PolarHBondContact O-ND2 3.2Å
1481	S	56.3	Low	73.7	Confident	50.6 Å²	50.6	59.5 Å²	59.5	35%	0.354	33%	0.334	S	S	.	.			trans	-65.1	123.6	-171.1	-160.5	0	0	0	0	112.2	S1479 M1483 D1484 I1485 N1500	S1479-S1481 VanDerWaalsContact C-N 3.32Å; S1479-S1481 PolarHBondContact O-N 3.07Å; S1481-M1483 VanDerWaalsContact C-N 3.32Å; S1481-M1483 PolarHBondContact O-N 3.11Å; S1481-M1483 WeakPolarHBondContact OG-CG 3.11Å; S1481-M1483 PolarHBondContact OG-N 2.87Å; S1481-M1483 PolarHBondContact OG-O 3.09Å; S1481-D1484 PolarHBondContact OG-N 3.47Å; S1481-I1485 VanDerWaalsContact O-CD1 3.25Å; S1481-I1485 WeakPolarHBondContact O-CD1 3.44Å; S1481-N1500 PolarHBondContact O-ND2 3.12Å
1482	L	54.4	Low	73.6	Confident	60 Å²	60	65.6 Å²	65.6	31%	0.314	36%	0.359	S	S	.	.	S	Bend	trans	-76	-14.9	174.3	-72.3	166.6	0	0	0	112.6	N1480 L1588 Q1613 P1615 Y1651 Q1654	N1480-L1482 PolarHBondContact O-N 2.98Å; L1482-L1588 HydrophobicContact CD1-CD1 4.3Å; L1482-L1588 HydrophobicContact CD1-CD2 4.02Å; L1482-L1588 HydrophobicContact CD2-CD2 4.06Å; L1482-Q1613 HydrophobicContact CD1-CB 4.16Å; L1482-Q1613 WeakPolarHBondContact CD1-O 3.39Å; L1482-P1615 HydrophobicContact CD2-CB 4.27Å; L1482-P1615 HydrophobicContact CD2-CG 4.16Å; L1482-Y1651 HydrophobicContact CB-CD2 4.35Å; L1482-Y1651 HydrophobicContact CB-CE2 3.9Å; L1482-Y1651 HydrophobicContact CD1-CD2 4.37Å; L1482-Y1651 HydrophobicContact CD1-CE2 3.68Å; L1482-Y1651 HydrophobicContact CD2-CE2 4.27Å; L1482-Y1651 HydrophobicContact CG-CE2 4.49Å; L1482-Y1651 WeakPolarHBondContact O-CE2 3.4Å; L1482-Q1654 VanDerWaalsContact CD1-NE2 3.35Å
1483	M	49.1	Very low	73.5	Confident	120 Å²	120	71.2 Å²	71.2	59%	0.591	39%	0.385	S	S	*	.	S	Bend	trans	-84.5	135.4	178	-66	-106.8	-171.3	0	0	111.4	S1481 I1485 N1500 Y1651 Q1654 T1655 F2021	S1481-M1483 VanDerWaalsContact C-N 3.32Å; S1481-M1483 PolarHBondContact O-N 3.11Å; S1481-M1483 WeakPolarHBondContact OG-CG 3.11Å; S1481-M1483 PolarHBondContact OG-N 2.87Å; S1481-M1483 PolarHBondContact OG-O 3.09Å; M1483-I1485 HydrophobicContact CB-CG1 4.15Å; M1483-I1485 PolarHBondContact O-N 2.95Å; M1483-N1500 PolarHBondContact O-ND2 2.88Å; M1483-Y1651 HydrophobicContact CE-CD2 3.73Å; M1483-Y1651 HydrophobicContact CE-CG 4.14Å; M1483-Y1651 HydrophobicContact SD-CD2 3.95Å; M1483-Q1654 HydrophobicContact CE-CB 3.68Å; M1483-T1655 HydrophobicContact CE-CG2 3.63Å; M1483-T1655 HydrophobicContact SD-CG2 4.34Å; M1483-F2021 HydrophobicContact CE-CD1 4.43Å; M1483-F2021 HydrophobicContact CE-CE1 4.01Å
1484	D	49.8	Very low	73.8	Confident	98.6 Å²	98.6	72.7 Å²	72.7	53%	0.527	38%	0.384	S	S	.	.			trans	-77.6	94.2	-173.8	-108.4	-23.2	0	0	0	111.9	S1481 S1486 R1499	S1481-D1484 PolarHBondContact OG-N 3.47Å; D1484-S1486 PolarHBondContact O-N 2.79Å; D1484-R1499 VanDerWaalsContact CG-NH2 3.26Å; D1484-R1499 IonicContact OD1-CZ 3.26Å; D1484-R1499 VanDerWaalsContact OD1-CZ 3.22Å; D1484-R1499 IonicContact OD1-NE 3.17Å; D1484-R1499 PolarHBondContact OD1-NE 3.22Å; D1484-R1499 IonicContact OD1-NH1 3.48Å; D1484-R1499 PolarHBondContact OD1-NH1 2.85Å; D1484-R1499 IonicContact OD1-NH2 2.94Å; D1484-R1499 PolarHBondContact OD1-NH2 3.04Å; D1484-R1499 IonicContact OD2-CZ 2.81Å; D1484-R1499 IonicContact OD2-NH1 2.7Å; D1484-R1499 PolarHBondContact OD2-NH1 3.05Å; D1484-R1499 IonicContact OD2-NH2 3.49Å; D1484-R1499 PolarHBondContact OD2-NH2 2.9Å; D1484-R1499 VanDerWaalsContact OD2-NH2 3.12Å
1485	I	57.2	Low	74.4	Confident	80.8 Å²	80.8	74.3 Å²	74.3	41%	0.414	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-86.2	129.5	166.2	-53.1	170.3	0	0	0	107.6	S1481 M1483 N1487 R1499 N1500	S1481-I1485 VanDerWaalsContact O-CD1 3.25Å; S1481-I1485 WeakPolarHBondContact O-CD1 3.44Å; M1483-I1485 HydrophobicContact CB-CG1 4.15Å; M1483-I1485 PolarHBondContact O-N 2.95Å; I1485-N1487 PolarHBondContact O-N 3.06Å; I1485-R1499 HydrophobicContact CB-CG 4.06Å; I1485-R1499 HydrophobicContact CG2-CG 3.5Å; I1485-R1499 VanDerWaalsContact CG2-CG 3.5Å; I1485-N1500 VanDerWaalsContact CB-OD1 3.26Å; I1485-N1500 WeakPolarHBondContact CB-OD1 3.28Å; I1485-N1500 WeakPolarHBondContact CD1-ND2 3.33Å; I1485-N1500 VanDerWaalsContact CD1-OD1 3.31Å; I1485-N1500 WeakPolarHBondContact CD1-OD1 3.27Å; I1485-N1500 VanDerWaalsContact CG1-ND2 3.31Å; I1485-N1500 WeakPolarHBondContact CG1-ND2 3.32Å; I1485-N1500 WeakPolarHBondContact CG1-OD1 3.35Å; I1485-N1500 HydrophobicContact CG2-CB 4.19Å; I1485-N1500 WeakPolarHBondContact CG2-OD1 3.42Å; I1485-N1500 PolarHBondContact N-OD1 2.87Å
1486	S	63.5	Low	74.6	Confident	80.8 Å²	80.8	75.8 Å²	75.8	57%	0.565	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-56.9	133.9	179.8	48.9	0	0	0	0	112.1	D1484 V1488 Q2301 L2332	D1484-S1486 PolarHBondContact O-N 2.79Å; S1486-V1488 PolarHBondContact O-N 2.97Å; S1486-Q2301 PolarHBondContact OG-NE2 3.27Å; S1486-L2332 WeakPolarHBondContact CB-O 3.23Å; S1486-L2332 PolarHBondContact OG-O 2.82Å
1487	N	74.9	Confident	74.7	Confident	64.4 Å²	64.4	70.6 Å²	70.6	34%	0.344	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-63.5	126	175.6	-77.9	-12.5	0	0	0	109.9	I1485 C1497 R1499 M1504	I1485-N1487 PolarHBondContact O-N 3.06Å; N1487-C1497 HydrophobicContact CB-CB 4.38Å; N1487-R1499 WeakPolarHBondContact OD1-CB 3.27Å; N1487-R1499 WeakPolarHBondContact OD1-CD 3.36Å; N1487-R1499 WeakPolarHBondContact OD1-CG 3.24Å; N1487-R1499 PolarHBondContact OD1-NE 3.46Å; N1487-M1504 WeakPolarHBondContact ND2-CE 3.45Å
1488	V	82.5	Confident	74.6	Confident	64.6 Å²	64.6	71.6 Å²	71.6	39%	0.392	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	107.9	171.3	-175.5	0	0	0	0	108.5	S1486 C1497 V1498 I2297 Q2301 I2336	S1486-V1488 PolarHBondContact O-N 2.97Å; V1488-C1497 CarbonylContact O-C 3.49Å; V1488-C1497 WeakPolarHBondContact O-CA 3.3Å; V1488-V1498 PolarHBondContact N-O 3.07Å; V1488-V1498 PolarHBondContact O-N 2.94Å; V1488-I2297 HydrophobicContact CB-CG2 4.3Å; V1488-I2297 HydrophobicContact CG1-CG2 3.63Å; V1488-I2297 HydrophobicContact CG2-CG2 4.49Å; V1488-Q2301 HydrophobicContact CG2-CG 3.8Å; V1488-Q2301 VanDerWaalsContact CG2-NE2 3.25Å; V1488-I2336 HydrophobicContact CG1-CD1 4.03Å; V1488-I2336 HydrophobicContact CG1-CG1 4.29Å
1489	C	86.8	Confident	74.5	Confident	31.8 Å²	31.8	68.4 Å²	68.4	22%	0.215	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	142.1	178.5	-58.8	0	0	0	0	111.4	D1491 N1494 I1496 C1497	C1489-D1491 VanDerWaalsContact C-N 3.34Å; C1489-N1494 HydrophobicContact CB-CB 4.33Å; C1489-N1494 VanDerWaalsContact CB-OD1 3.24Å; C1489-N1494 WeakPolarHBondContact CB-OD1 3.39Å; C1489-N1494 PolarHBondContact SG-OD1 2.93Å; C1489-I1496 WeakPolarHBondContact CA-O 3.34Å; C1489-C1497 HydrophobicContact CB-CB 4.03Å; C1489-C1497 WeakPolarHBondContact CB-SG 3.25Å; C1489-C1497 WeakPolarHBondContact SG-CB 3.3Å; C1489-C1497 CovalentContact SG-SG 2.04Å; C1489-C1497 PolarHBondContact SG-SG 3.09Å
1490	L	86	Confident	74.7	Confident	96 Å²	96	68.8 Å²	68.8	50%	0.503	37%	0.367	S	S	.	.	S	Bend	trans	-89.1	-8.4	-177.1	-61.4	176.1	0	0	0	112.9	I1496 I2284 I2292 I2297	L1490-I1496 HydrophobicContact CD1-CB 4.34Å; L1490-I1496 HydrophobicContact CD1-CG2 3.91Å; L1490-I1496 HydrophobicContact CG-CG2 4.44Å; L1490-I1496 PolarHBondContact N-O 3.14Å; L1490-I2284 HydrophobicContact CD1-CD1 3.4Å; L1490-I2284 VanDerWaalsContact CD1-CD1 3.4Å; L1490-I2292 HydrophobicContact CD1-CD1 4.17Å; L1490-I2292 HydrophobicContact CD1-CG2 4.47Å; L1490-I2292 HydrophobicContact CD2-CG2 4.47Å; L1490-I2297 HydrophobicContact CD2-CD1 3.55Å
1491	D	82.8	Confident	75.5	Confident	42.4 Å²	42.4	66.8 Å²	66.8	23%	0.227	37%	0.366	C	S	.	.	S	Bend	trans	-142.4	152.3	-176.2	69.2	-84.5	0	0	0	111.2	C1489 Q1493 N1494 I1495 I1496	C1489-D1491 VanDerWaalsContact C-N 3.34Å; D1491-Q1493 PolarHBondContact O-N 2.94Å; D1491-Q1493 VanDerWaalsContact O-N 3.15Å; D1491-Q1493 VanDerWaalsContact OD1-C 3.26Å; D1491-Q1493 WeakPolarHBondContact OD1-CA 3.48Å; D1491-Q1493 WeakPolarHBondContact OD1-CB 3.13Å; D1491-Q1493 PolarHBondContact OD1-N 3.23Å; D1491-Q1493 VanDerWaalsContact OD2-C 3.28Å; D1491-Q1493 VanDerWaalsContact OD2-CA 3.32Å; D1491-Q1493 WeakPolarHBondContact OD2-CA 3.27Å; D1491-Q1493 WeakPolarHBondContact OD2-CB 3.24Å; D1491-Q1493 PolarHBondContact OD2-N 2.92Å; D1491-N1494 PolarHBondContact O-N 3.15Å; D1491-N1494 VanDerWaalsContact O-N 3.13Å; D1491-N1494 PolarHBondContact O-OD1 2.88Å; D1491-N1494 PolarHBondContact OD1-N 2.99Å; D1491-N1494 PolarHBondContact OD2-N 3.1Å; D1491-I1495 VanDerWaalsContact CG-N 3.28Å; D1491-I1495 PolarHBondContact OD1-N 3.07Å; D1491-I1495 WeakPolarHBondContact OD2-CA 3.32Å; D1491-I1495 WeakPolarHBondContact OD2-CB 3.18Å; D1491-I1495 PolarHBondContact OD2-N 3.12Å; D1491-I1496 PolarHBondContact OD1-N 2.73Å; D1491-I1496 PolarHBondContact OD2-N 2.78Å
1492	E	79.8	Confident	76.9	Confident	183 Å²	183	64.5 Å²	64.5	86%	0.855	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-19.8	-178.5	-61.9	-177.7	162.5	0	0	113.7	N1494	E1492-N1494 VanDerWaalsContact C-N 3.31Å; E1492-N1494 PolarHBondContact O-N 2.78Å; E1492-N1494 PolarHBondContact O-ND2 3.07Å
1493	Q	81.7	Confident	78.7	Confident	125.8 Å²	125.8	63.5 Å²	63.5	59%	0.588	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-3.7	-179.7	-62.6	147.3	20.9	0	0	112	D1491 I1495 R1515	D1491-Q1493 PolarHBondContact O-N 2.94Å; D1491-Q1493 VanDerWaalsContact O-N 3.15Å; D1491-Q1493 VanDerWaalsContact OD1-C 3.26Å; D1491-Q1493 WeakPolarHBondContact OD1-CA 3.48Å; D1491-Q1493 WeakPolarHBondContact OD1-CB 3.13Å; D1491-Q1493 PolarHBondContact OD1-N 3.23Å; D1491-Q1493 VanDerWaalsContact OD2-C 3.28Å; D1491-Q1493 VanDerWaalsContact OD2-CA 3.32Å; D1491-Q1493 WeakPolarHBondContact OD2-CA 3.27Å; D1491-Q1493 WeakPolarHBondContact OD2-CB 3.24Å; D1491-Q1493 PolarHBondContact OD2-N 2.92Å; Q1493-I1495 VanDerWaalsContact C-N 3.3Å; Q1493-I1495 HydrophobicContact CB-CD1 3.94Å; Q1493-I1495 HydrophobicContact CB-CG1 3.89Å; Q1493-I1495 PolarHBondContact O-N 2.99Å; Q1493-R1515 PolarHBondContact O-NH1 3.13Å; Q1493-R1515 PolarHBondContact O-NH2 3.28Å
1494	N	86.5	Confident	80.7	Confident	70 Å²	70	58.3 Å²	58.3	37%	0.374	32%	0.319	S	S	.	.			trans	54.3	44.3	-174.7	-57	-47.3	0	0	0	112.3	C1489 D1491 E1492 N1506 R1515	C1489-N1494 HydrophobicContact CB-CB 4.33Å; C1489-N1494 VanDerWaalsContact CB-OD1 3.24Å; C1489-N1494 WeakPolarHBondContact CB-OD1 3.39Å; C1489-N1494 PolarHBondContact SG-OD1 2.93Å; D1491-N1494 PolarHBondContact O-N 3.15Å; D1491-N1494 VanDerWaalsContact O-N 3.13Å; D1491-N1494 PolarHBondContact O-OD1 2.88Å; D1491-N1494 PolarHBondContact OD1-N 2.99Å; D1491-N1494 PolarHBondContact OD2-N 3.1Å; E1492-N1494 VanDerWaalsContact C-N 3.31Å; E1492-N1494 PolarHBondContact O-N 2.78Å; E1492-N1494 PolarHBondContact O-ND2 3.07Å; N1494-N1506 WeakPolarHBondContact O-CB 3.21Å; N1494-N1506 PolarHBondContact O-ND2 3.08Å; N1494-R1515 PolarHBondContact O-NH1 3.19Å; N1494-R1515 VanDerWaalsContact O-NH1 3.12Å
1495	I	89.7	Confident	82.7	Confident	42.6 Å²	42.6	56.1 Å²	56.1	22%	0.218	30%	0.304	C	S	.	.			trans	-80	-43.8	177.6	-64	171.3	0	0	0	110.8	D1491 Q1493 Y1505 N1506 I1507	D1491-I1495 VanDerWaalsContact CG-N 3.28Å; D1491-I1495 PolarHBondContact OD1-N 3.07Å; D1491-I1495 WeakPolarHBondContact OD2-CA 3.32Å; D1491-I1495 WeakPolarHBondContact OD2-CB 3.18Å; D1491-I1495 PolarHBondContact OD2-N 3.12Å; Q1493-I1495 VanDerWaalsContact C-N 3.3Å; Q1493-I1495 HydrophobicContact CB-CD1 3.94Å; Q1493-I1495 HydrophobicContact CB-CG1 3.89Å; Q1493-I1495 PolarHBondContact O-N 2.99Å; I1495-Y1505 HydrophobicContact CG2-CD2 4.19Å; I1495-Y1505 HydrophobicContact CG2-CE2 3.52Å; I1495-Y1505 VanDerWaalsContact CG2-CE2 3.49Å; I1495-Y1505 CarbonylContact O-C 3.54Å; I1495-Y1505 VanDerWaalsContact O-CA 3.29Å; I1495-Y1505 WeakPolarHBondContact O-CA 3.35Å; I1495-N1506 WeakPolarHBondContact CG2-O 3.42Å; I1495-N1506 PolarHBondContact O-N 3.11Å; I1495-I1507 HydrophobicContact CG2-CG1 4.39Å
1496	I	91.6	Very high	84.3	Confident	34.6 Å²	34.6	53 Å²	53	18%	0.177	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	113.9	178.1	-49.8	-179.4	0	0	0	108.9	C1489 L1490 D1491 L1503 M1504 Y1505 I2284 Y2286	C1489-I1496 WeakPolarHBondContact CA-O 3.34Å; L1490-I1496 HydrophobicContact CD1-CB 4.34Å; L1490-I1496 HydrophobicContact CD1-CG2 3.91Å; L1490-I1496 HydrophobicContact CG-CG2 4.44Å; L1490-I1496 PolarHBondContact N-O 3.14Å; D1491-I1496 PolarHBondContact OD1-N 2.73Å; D1491-I1496 PolarHBondContact OD2-N 2.78Å; I1496-L1503 HydrophobicContact CG2-CD1 3.82Å; I1496-M1504 WeakPolarHBondContact CA-O 3.36Å; I1496-Y1505 HydrophobicContact CD1-CD1 4.38Å; I1496-Y1505 HydrophobicContact CD1-CE1 3.75Å; I1496-Y1505 HydrophobicContact CD1-CE2 4.23Å; I1496-Y1505 HydrophobicContact CG1-CD1 3.91Å; I1496-Y1505 HydrophobicContact CG1-CD2 3.84Å; I1496-Y1505 HydrophobicContact CG1-CE1 3.77Å; I1496-Y1505 HydrophobicContact CG1-CE2 3.87Å; I1496-Y1505 HydrophobicContact CG2-CD1 4.5Å; I1496-Y1505 HydrophobicContact CG2-CE1 4.22Å; I1496-I2284 HydrophobicContact CG2-CD1 3.89Å; I1496-Y2286 HydrophobicContact CD1-CE1 4.11Å; I1496-Y2286 WeakPolarHBondContact CD1-OH 2.99Å
1497	C	89.6	Confident	85.7	Confident	0.8 Å²	0.8	51.3 Å²	51.3	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	157.1	178.5	-49.6	0	0	0	0	111.8	N1487 V1488 C1489 M1504	N1487-C1497 HydrophobicContact CB-CB 4.38Å; V1488-C1497 CarbonylContact O-C 3.49Å; V1488-C1497 WeakPolarHBondContact O-CA 3.3Å; C1489-C1497 HydrophobicContact CB-CB 4.03Å; C1489-C1497 WeakPolarHBondContact CB-SG 3.25Å; C1489-C1497 WeakPolarHBondContact SG-CB 3.3Å; C1489-C1497 CovalentContact SG-SG 2.04Å; C1489-C1497 PolarHBondContact SG-SG 3.09Å; C1497-M1504 HydrophobicContact CB-CB 4.25Å; C1497-M1504 HydrophobicContact CB-CE 3.86Å; C1497-M1504 HydrophobicContact CB-SD 4.45Å; C1497-M1504 PolarHBondContact N-O 3.12Å; C1497-M1504 PolarHBondContact O-N 3.14Å; C1497-M1504 VanDerWaalsContact O-O 3.14Å
1498	V	86.8	Confident	86.5	Confident	35.8 Å²	35.8	51.2 Å²	51.2	22%	0.217	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	131.3	172	-178.3	0	0	0	0	108.9	V1488 A1502 L1503 L2281 V2294 V2298	V1488-V1498 PolarHBondContact N-O 3.07Å; V1488-V1498 PolarHBondContact O-N 2.94Å; V1498-A1502 VanDerWaalsContact CA-O 3.31Å; V1498-A1502 WeakPolarHBondContact CA-O 3.34Å; V1498-L1503 HydrophobicContact CG2-CD1 4.4Å; V1498-L2281 HydrophobicContact CG2-CD2 3.95Å; V1498-V2294 HydrophobicContact CB-CG1 4.26Å; V1498-V2294 HydrophobicContact CG1-CG1 3.67Å; V1498-V2294 HydrophobicContact CG2-CG1 3.9Å; V1498-V2298 HydrophobicContact CG1-CG2 4.03Å
1499	R	79.7	Confident	86.8	Confident	33.8 Å²	33.8	49.5 Å²	49.5	13%	0.128	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	123.6	176.9	-174.1	-174.1	-175.1	-175	-0.7	108.8	D1484 I1485 N1487 G1501 A1502 D1521 D1646 G1647	D1484-R1499 VanDerWaalsContact CG-NH2 3.26Å; D1484-R1499 IonicContact OD1-CZ 3.26Å; D1484-R1499 VanDerWaalsContact OD1-CZ 3.22Å; D1484-R1499 IonicContact OD1-NE 3.17Å; D1484-R1499 PolarHBondContact OD1-NE 3.22Å; D1484-R1499 IonicContact OD1-NH1 3.48Å; D1484-R1499 PolarHBondContact OD1-NH1 2.85Å; D1484-R1499 IonicContact OD1-NH2 2.94Å; D1484-R1499 PolarHBondContact OD1-NH2 3.04Å; D1484-R1499 IonicContact OD2-CZ 2.81Å; D1484-R1499 IonicContact OD2-NH1 2.7Å; D1484-R1499 PolarHBondContact OD2-NH1 3.05Å; D1484-R1499 IonicContact OD2-NH2 3.49Å; D1484-R1499 PolarHBondContact OD2-NH2 2.9Å; D1484-R1499 VanDerWaalsContact OD2-NH2 3.12Å; I1485-R1499 HydrophobicContact CB-CG 4.06Å; I1485-R1499 HydrophobicContact CG2-CG 3.5Å; I1485-R1499 VanDerWaalsContact CG2-CG 3.5Å; N1487-R1499 WeakPolarHBondContact OD1-CB 3.27Å; N1487-R1499 WeakPolarHBondContact OD1-CD 3.36Å; N1487-R1499 WeakPolarHBondContact OD1-CG 3.24Å; N1487-R1499 PolarHBondContact OD1-NE 3.46Å; R1499-G1501 PolarHBondContact O-N 2.95Å; R1499-G1501 VanDerWaalsContact O-N 3.11Å; R1499-A1502 PolarHBondContact N-O 3.12Å; R1499-A1502 WeakPolarHBondContact O-CA 3.4Å; R1499-A1502 VanDerWaalsContact O-CB 3.25Å; R1499-A1502 WeakPolarHBondContact O-CB 3.4Å; R1499-A1502 PolarHBondContact O-N 3.24Å; R1499-D1521 IonicContact CZ-OD2 3.8Å; R1499-D1521 IonicContact NE-OD2 2.81Å; R1499-D1521 IonicContact NH2-OD2 3.8Å; R1499-D1521 PolarHBondContact NH2-OD2 3.42Å; R1499-D1646 IonicContact NH1-OD2 3.25Å; R1499-D1646 PolarHBondContact NH1-OD2 2.84Å; R1499-G1647 PolarHBondContact NH1-O 3.03Å; R1499-G1647 PolarHBondContact NH2-O 2.77Å
1500	N	76.5	Confident	86.8	Confident	43.6 Å²	43.6	54.5 Å²	54.5	23%	0.233	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.2	28.8	-178	-69.7	5.1	0	0	0	114.8	N1480 S1481 M1483 I1485 A1502 Y1526	N1480-N1500 PolarHBondContact ND2-ND2 3.23Å; N1480-N1500 PolarHBondContact O-ND2 3.2Å; S1481-N1500 PolarHBondContact O-ND2 3.12Å; M1483-N1500 PolarHBondContact O-ND2 2.88Å; I1485-N1500 VanDerWaalsContact CB-OD1 3.26Å; I1485-N1500 WeakPolarHBondContact CB-OD1 3.28Å; I1485-N1500 WeakPolarHBondContact CD1-ND2 3.33Å; I1485-N1500 VanDerWaalsContact CD1-OD1 3.31Å; I1485-N1500 WeakPolarHBondContact CD1-OD1 3.27Å; I1485-N1500 VanDerWaalsContact CG1-ND2 3.31Å; I1485-N1500 WeakPolarHBondContact CG1-ND2 3.32Å; I1485-N1500 WeakPolarHBondContact CG1-OD1 3.35Å; I1485-N1500 HydrophobicContact CG2-CB 4.19Å; I1485-N1500 WeakPolarHBondContact CG2-OD1 3.42Å; I1485-N1500 PolarHBondContact N-OD1 2.87Å; N1500-A1502 VanDerWaalsContact C-N 3.29Å; N1500-A1502 PolarHBondContact O-N 3.22Å; N1500-Y1526 PolarHBondContact O-OH 3.07Å; N1500-Y1526 VanDerWaalsContact O-OH 3.05Å
1501	G	80.9	Confident	86.8	Confident	43.2 Å²	43.2	56.4 Å²	56.4	45%	0.445	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	80	-0.1	-174.6	0	0	0	0	0	114.9	R1499 R2280 L2281	R1499-G1501 PolarHBondContact O-N 2.95Å; R1499-G1501 VanDerWaalsContact O-N 3.11Å; G1501-R2280 CarbonylContact O-C 3.53Å; G1501-R2280 VanDerWaalsContact O-CA 3.31Å; G1501-R2280 WeakPolarHBondContact O-CA 3.39Å; G1501-L2281 PolarHBondContact O-N 3.44Å
1502	A	85.9	Confident	87	Confident	2.8 Å²	2.8	56.7 Å²	56.7	2%	0.023	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	141.9	170.3	0	0	0	0	0	111	V1498 R1499 N1500 S1520 D1521 Y1526	V1498-A1502 VanDerWaalsContact CA-O 3.31Å; V1498-A1502 WeakPolarHBondContact CA-O 3.34Å; R1499-A1502 PolarHBondContact N-O 3.12Å; R1499-A1502 WeakPolarHBondContact O-CA 3.4Å; R1499-A1502 VanDerWaalsContact O-CB 3.25Å; R1499-A1502 WeakPolarHBondContact O-CB 3.4Å; R1499-A1502 PolarHBondContact O-N 3.24Å; N1500-A1502 VanDerWaalsContact C-N 3.29Å; N1500-A1502 PolarHBondContact O-N 3.22Å; A1502-S1520 VanDerWaalsContact CA-OG 3.28Å; A1502-S1520 WeakPolarHBondContact CA-OG 3.29Å; A1502-S1520 WeakPolarHBondContact CB-OG 3.13Å; A1502-D1521 HydrophobicContact CB-CB 3.68Å; A1502-Y1526 HydrophobicContact CB-CD2 4.23Å; A1502-Y1526 HydrophobicContact CB-CE2 3.86Å
1503	L	90.9	Very high	87.3	Confident	37.4 Å²	37.4	56.4 Å²	56.4	20%	0.196	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	130	173.3	-179.8	64.9	0	0	0	109.7	I1496 V1498 Y1505 Y1518 R1519 S1520 L2258 F2272 Y2274 L2281	I1496-L1503 HydrophobicContact CG2-CD1 3.82Å; V1498-L1503 HydrophobicContact CG2-CD1 4.4Å; L1503-Y1505 HydrophobicContact CD2-CD2 4.45Å; L1503-Y1505 HydrophobicContact CD2-CE2 3.64Å; L1503-Y1505 HydrophobicContact CG-CD2 4.43Å; L1503-Y1505 HydrophobicContact CG-CE2 4.02Å; L1503-Y1518 HydrophobicContact CD2-CD1 4.47Å; L1503-Y1518 HydrophobicContact CD2-CE1 4.24Å; L1503-R1519 CarbonylContact O-C 3.54Å; L1503-R1519 WeakPolarHBondContact O-CA 3.28Å; L1503-S1520 PolarHBondContact N-OG 3.08Å; L1503-S1520 PolarHBondContact O-N 3.03Å; L1503-S1520 PolarHBondContact O-OG 2.85Å; L1503-L2258 HydrophobicContact CD2-CB 4.39Å; L1503-L2258 HydrophobicContact CD2-CD2 4.19Å; L1503-F2272 HydrophobicContact CD1-CD1 4.14Å; L1503-F2272 HydrophobicContact CD1-CE1 3.73Å; L1503-F2272 HydrophobicContact CD1-CZ 4.4Å; L1503-F2272 HydrophobicContact CD2-CD1 3.66Å; L1503-F2272 HydrophobicContact CD2-CD2 4.12Å; L1503-F2272 HydrophobicContact CD2-CE1 3.65Å; L1503-F2272 HydrophobicContact CD2-CE2 4.09Å; L1503-F2272 HydrophobicContact CD2-CG 3.91Å; L1503-F2272 HydrophobicContact CD2-CZ 3.87Å; L1503-F2272 HydrophobicContact CG-CE1 4.37Å; L1503-Y2274 WeakPolarHBondContact CD2-OH 3.39Å; L1503-L2281 HydrophobicContact CB-CD2 4.19Å; L1503-L2281 HydrophobicContact CD1-CD2 4.16Å
1504	M	91.1	Very high	87.6	Confident	11.6 Å²	11.6	51.6 Å²	51.6	6%	0.057	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	125.1	172.2	-175.7	175.3	84.4	0	0	109.7	N1487 I1496 C1497 I1517 Y1518 R1519 D1646	N1487-M1504 WeakPolarHBondContact ND2-CE 3.45Å; I1496-M1504 WeakPolarHBondContact CA-O 3.36Å; C1497-M1504 HydrophobicContact CB-CB 4.25Å; C1497-M1504 HydrophobicContact CB-CE 3.86Å; C1497-M1504 HydrophobicContact CB-SD 4.45Å; C1497-M1504 PolarHBondContact N-O 3.12Å; C1497-M1504 PolarHBondContact O-N 3.14Å; C1497-M1504 VanDerWaalsContact O-O 3.14Å; M1504-I1517 HydrophobicContact CE-CD1 3.66Å; M1504-I1517 HydrophobicContact CE-CG1 4.34Å; M1504-I1517 HydrophobicContact CE-CG2 3.61Å; M1504-I1517 HydrophobicContact CG-CG2 4.14Å; M1504-I1517 HydrophobicContact SD-CG2 4.28Å; M1504-Y1518 CarbonylContact C-O 3.54Å; M1504-Y1518 VanDerWaalsContact CA-O 3.28Å; M1504-Y1518 WeakPolarHBondContact CA-O 3.43Å; M1504-Y1518 WeakPolarHBondContact CG-O 3.43Å; M1504-R1519 HydrophobicContact CB-CG 4.18Å; M1504-R1519 HydrophobicContact CG-CG 3.92Å; M1504-R1519 HydrophobicContact SD-CG 4.28Å; M1504-D1646 WeakPolarHBondContact CE-O 3.47Å
1505	Y	92.4	Very high	87.8	Confident	52.8 Å²	52.8	52.2 Å²	52.2	21%	0.207	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	134.4	170.6	-108.8	-90.9	0	0	0	110.1	I1495 I1496 L1503 I1507 I1517 Y1518 W1627 F2250 L2261 N2263	I1495-Y1505 HydrophobicContact CG2-CD2 4.19Å; I1495-Y1505 HydrophobicContact CG2-CE2 3.52Å; I1495-Y1505 VanDerWaalsContact CG2-CE2 3.49Å; I1495-Y1505 CarbonylContact O-C 3.54Å; I1495-Y1505 VanDerWaalsContact O-CA 3.29Å; I1495-Y1505 WeakPolarHBondContact O-CA 3.35Å; I1496-Y1505 HydrophobicContact CD1-CD1 4.38Å; I1496-Y1505 HydrophobicContact CD1-CE1 3.75Å; I1496-Y1505 HydrophobicContact CD1-CE2 4.23Å; I1496-Y1505 HydrophobicContact CG1-CD1 3.91Å; I1496-Y1505 HydrophobicContact CG1-CD2 3.84Å; I1496-Y1505 HydrophobicContact CG1-CE1 3.77Å; I1496-Y1505 HydrophobicContact CG1-CE2 3.87Å; I1496-Y1505 HydrophobicContact CG2-CD1 4.5Å; I1496-Y1505 HydrophobicContact CG2-CE1 4.22Å; L1503-Y1505 HydrophobicContact CD2-CD2 4.45Å; L1503-Y1505 HydrophobicContact CD2-CE2 3.64Å; L1503-Y1505 HydrophobicContact CG-CD2 4.43Å; L1503-Y1505 HydrophobicContact CG-CE2 4.02Å; Y1505-I1507 HydrophobicContact CD1-CD1 4.46Å; Y1505-I1507 HydrophobicContact CD1-CG1 4.02Å; Y1505-I1507 HydrophobicContact CE1-CD1 4.01Å; Y1505-I1507 HydrophobicContact CE1-CG1 3.55Å; Y1505-I1507 VanDerWaalsContact CE1-CG1 3.43Å; Y1505-I1517 VanDerWaalsContact O-CA 3.28Å; Y1505-I1517 WeakPolarHBondContact O-CA 3.37Å; Y1505-Y1518 AromaticContact CD2-CD1 3.94Å; Y1505-Y1518 HydrophobicContact CD2-CD1 3.94Å; Y1505-Y1518 HydrophobicContact CD2-CE1 4.46Å; Y1505-Y1518 PolarHBondContact N-O 3.04Å; Y1505-Y1518 PolarHBondContact O-N 3.2Å; Y1505-W1627 AromaticContact CD1-CH2 3.83Å; Y1505-W1627 HydrophobicContact CD1-CH2 3.83Å; Y1505-W1627 HydrophobicContact CD1-CZ3 4.15Å; Y1505-W1627 HydrophobicContact CE1-CH2 4.31Å; Y1505-W1627 HydrophobicContact CG-CH2 4.28Å; Y1505-F2250 HydrophobicContact CE1-CE1 4.27Å; Y1505-L2261 HydrophobicContact CD1-CD2 4.46Å; Y1505-L2261 HydrophobicContact CD2-CD2 3.79Å; Y1505-L2261 HydrophobicContact CE1-CD1 4.15Å; Y1505-L2261 HydrophobicContact CE1-CD2 3.93Å; Y1505-L2261 HydrophobicContact CE2-CD2 3.21Å; Y1505-L2261 HydrophobicContact CG-CD2 4.39Å; Y1505-N2263 PolarHBondContact OH-OD1 3.34Å
1506	N	91.5	Very high	87.9	Confident	15.2 Å²	15.2	51.3 Å²	51.3	8%	0.081	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	90.1	-170.7	-140.9	7.4	0	0	0	110.6	N1494 I1495 R1515 L1516 I1517	N1494-N1506 WeakPolarHBondContact O-CB 3.21Å; N1494-N1506 PolarHBondContact O-ND2 3.08Å; I1495-N1506 WeakPolarHBondContact CG2-O 3.42Å; I1495-N1506 PolarHBondContact O-N 3.11Å; N1506-R1515 PolarHBondContact ND2-NH1 2.63Å; N1506-R1515 VanDerWaalsContact ND2-NH1 3.12Å; N1506-R1515 WeakPolarHBondContact OD1-CB 3.33Å; N1506-R1515 WeakPolarHBondContact OD1-CD 3.34Å; N1506-L1516 CarbonylContact C-O 3.58Å; N1506-L1516 WeakPolarHBondContact CA-O 3.14Å; N1506-I1517 HydrophobicContact CB-CG1 4.19Å; N1506-I1517 VanDerWaalsContact OD1-CD1 3.31Å; N1506-I1517 WeakPolarHBondContact OD1-CD1 3.39Å; N1506-I1517 VanDerWaalsContact OD1-CG1 3.24Å; N1506-I1517 WeakPolarHBondContact OD1-CG1 3.38Å; N1506-I1517 WeakPolarHBondContact OD1-CG2 3.36Å
1507	I	92	Very high	87.9	Confident	44.8 Å²	44.8	49.9 Å²	49.9	23%	0.23	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	117.5	-174.6	-57.3	176.7	0	0	0	109.4	I1495 Y1505 I1509 R1515 L1516 W1627 L2239 W2248 F2250	I1495-I1507 HydrophobicContact CG2-CG1 4.39Å; Y1505-I1507 HydrophobicContact CD1-CD1 4.46Å; Y1505-I1507 HydrophobicContact CD1-CG1 4.02Å; Y1505-I1507 HydrophobicContact CE1-CD1 4.01Å; Y1505-I1507 HydrophobicContact CE1-CG1 3.55Å; Y1505-I1507 VanDerWaalsContact CE1-CG1 3.43Å; I1507-I1509 PolarHBondContact O-N 2.94Å; I1507-R1515 CarbonylContact O-C 3.56Å; I1507-R1515 VanDerWaalsContact O-CA 3.3Å; I1507-R1515 WeakPolarHBondContact O-CA 3.18Å; I1507-L1516 HydrophobicContact CB-CB 4.4Å; I1507-L1516 PolarHBondContact N-O 2.95Å; I1507-L1516 PolarHBondContact O-N 3.1Å; I1507-W1627 HydrophobicContact CD1-CH2 3.73Å; I1507-W1627 HydrophobicContact CD1-CZ3 3.86Å; I1507-W1627 HydrophobicContact CG1-CH2 4.41Å; I1507-W1627 HydrophobicContact CG1-CZ3 4.18Å; I1507-L2239 HydrophobicContact CD1-CD2 3.93Å; I1507-L2239 HydrophobicContact CG2-CD2 4.43Å; I1507-W2248 HydrophobicContact CD1-CD2 4.46Å; I1507-W2248 HydrophobicContact CD1-CG 4.39Å; I1507-W2248 HydrophobicContact CG2-CH2 4.16Å; I1507-W2248 HydrophobicContact CG2-CZ2 3.93Å; I1507-F2250 HydrophobicContact CD1-CE1 4.2Å; I1507-F2250 HydrophobicContact CD1-CZ 3.68Å
1508	P	91	Very high	88	Confident	63.4 Å²	63.4	51.6 Å²	51.6	41%	0.412	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	129.7	175.4	19.1	-21.6	0	0	0	111.4	K1510	P1508-K1510 PolarHBondContact O-N 3.1Å
1509	I	89.8	Confident	88.1	Confident	28.2 Å²	28.2	50.4 Å²	50.4	15%	0.145	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-83.4	117.3	173.1	-60.2	-172	0	0	0	107.6	I1507 T1512 L1514 L1516 L1629 L2203 L2216 T2218 Y2224	I1507-I1509 PolarHBondContact O-N 2.94Å; I1509-T1512 WeakPolarHBondContact CB-OG1 3.48Å; I1509-T1512 HydrophobicContact CG2-CG2 4.33Å; I1509-T1512 PolarHBondContact O-N 2.99Å; I1509-T1512 PolarHBondContact O-OG1 3.2Å; I1509-L1514 HydrophobicContact CB-CB 4.31Å; I1509-L1514 WeakPolarHBondContact CB-O 3.22Å; I1509-L1514 HydrophobicContact CD1-CB 3.99Å; I1509-L1514 HydrophobicContact CG1-CB 4.36Å; I1509-L1514 PolarHBondContact N-O 2.98Å; I1509-L1516 HydrophobicContact CD1-CB 4.34Å; I1509-L1516 HydrophobicContact CD1-CD1 4.04Å; I1509-L1516 HydrophobicContact CG1-CB 4.44Å; I1509-L1629 HydrophobicContact CD1-CD2 3.7Å; I1509-L2203 HydrophobicContact CD1-CD1 4.42Å; I1509-L2203 HydrophobicContact CD1-CD2 3.9Å; I1509-L2203 HydrophobicContact CG2-CD1 4.09Å; I1509-L2216 HydrophobicContact CD1-CD1 4.36Å; I1509-T2218 HydrophobicContact CG2-CG2 3.93Å; I1509-Y2224 HydrophobicContact CG2-CE2 3.93Å
1510	K	86.7	Confident	88.6	Confident	137.4 Å²	137.4	49.7 Å²	49.7	60%	0.597	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	145.9	-176.5	-70.1	-160.2	177.4	-179.9	0	112	P1508 T1512 T2218 Y2224 D2241 P2242 V2243	P1508-K1510 PolarHBondContact O-N 3.1Å; K1510-T1512 PolarHBondContact O-N 2.6Å; K1510-T1512 VanDerWaalsContact O-N 3.14Å; K1510-T2218 WeakPolarHBondContact O-CG2 3.4Å; K1510-Y2224 WeakPolarHBondContact CB-OH 3.24Å; K1510-Y2224 WeakPolarHBondContact CG-OH 3.35Å; K1510-Y2224 PolarHBondContact N-OH 3.11Å; K1510-D2241 IonicContact NZ-OD1 3.34Å; K1510-D2241 PolarHBondContact NZ-OD1 2.76Å; K1510-D2241 IonicContact NZ-OD2 3.06Å; K1510-P2242 HydrophobicContact CD-CG 4.35Å; K1510-V2243 HydrophobicContact CD-CG2 3.46Å; K1510-V2243 VanDerWaalsContact CD-CG2 3.46Å; K1510-V2243 VanDerWaalsContact NZ-CB 3.26Å
1511	D	85.7	Confident	89.1	Confident	135.2 Å²	135.2	48.6 Å²	48.6	72%	0.723	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.3	19.8	178.5	-45	-43.1	0	0	0	114.4	T2220 H2222	D1511-T2220 HydrophobicContact CB-CG2 3.77Å; D1511-T2220 WeakPolarHBondContact OD2-CB 3.4Å; D1511-T2220 VanDerWaalsContact OD2-CG2 3.32Å; D1511-T2220 WeakPolarHBondContact OD2-CG2 3.3Å; D1511-T2220 PolarHBondContact OD2-OG1 2.83Å; D1511-H2222 IonicContact OD2-CD2 2.99Å; D1511-H2222 PolarHBondContact OD2-CD2 3.35Å; D1511-H2222 IonicContact OD2-NE2 3.61Å
1512	T	87.8	Confident	89.3	Confident	49.2 Å²	49.2	47.6 Å²	47.6	30%	0.302	23%	0.233	S	C	.	.	S	Bend	trans	-140	168.3	175.4	76.2	0	0	0	0	111.2	I1509 K1510 L1514 P2219	I1509-T1512 WeakPolarHBondContact CB-OG1 3.48Å; I1509-T1512 HydrophobicContact CG2-CG2 4.33Å; I1509-T1512 PolarHBondContact O-N 2.99Å; I1509-T1512 PolarHBondContact O-OG1 3.2Å; K1510-T1512 PolarHBondContact O-N 2.6Å; K1510-T1512 VanDerWaalsContact O-N 3.14Å; T1512-L1514 VanDerWaalsContact C-N 3.28Å; T1512-L1514 WeakPolarHBondContact OG1-CB 3.3Å; T1512-L1514 PolarHBondContact OG1-N 3.03Å; T1512-L1514 VanDerWaalsContact OG1-N 3.08Å; T1512-P2219 HydrophobicContact CG2-CG 4.39Å
1513	Q	84.6	Confident	89.3	Confident	175.8 Å²	175.8	48.7 Å²	48.7	82%	0.821	24%	0.239	S	C	*	.	S	Bend	trans	-89.4	9.2	167.1	-61.8	-78.1	-13.4	0	0	112.7	N1630	Q1513-N1630 PolarHBondContact O-ND2 3.14Å
1514	L	89.5	Confident	88.9	Confident	25.2 Å²	25.2	51.7 Å²	51.7	13%	0.132	26%	0.264	C	S	.	.			trans	-83.8	143.4	-177.5	-55.8	177.8	0	0	0	110.6	I1509 T1512 L1629 N1630 I1631 I2194 I2201 L2203	I1509-L1514 HydrophobicContact CB-CB 4.31Å; I1509-L1514 WeakPolarHBondContact CB-O 3.22Å; I1509-L1514 HydrophobicContact CD1-CB 3.99Å; I1509-L1514 HydrophobicContact CG1-CB 4.36Å; I1509-L1514 PolarHBondContact N-O 2.98Å; T1512-L1514 VanDerWaalsContact C-N 3.28Å; T1512-L1514 WeakPolarHBondContact OG1-CB 3.3Å; T1512-L1514 PolarHBondContact OG1-N 3.03Å; T1512-L1514 VanDerWaalsContact OG1-N 3.08Å; L1514-L1629 HydrophobicContact CB-CD2 4.32Å; L1514-L1629 HydrophobicContact CD1-CD2 4.42Å; L1514-N1630 WeakPolarHBondContact CA-OD1 3.4Å; L1514-I1631 HydrophobicContact CD2-CD1 3.38Å; L1514-I1631 VanDerWaalsContact CD2-CD1 3.43Å; L1514-I1631 HydrophobicContact CD2-CG1 3.68Å; L1514-I1631 HydrophobicContact CD2-CG2 4.24Å; L1514-I2194 HydrophobicContact CD1-CD1 4.24Å; L1514-I2201 HydrophobicContact CD1-CG2 3.99Å; L1514-I2201 HydrophobicContact CD2-CG2 4.39Å; L1514-I2201 HydrophobicContact CG-CG2 4.3Å; L1514-L2203 HydrophobicContact CD1-CB 3.83Å; L1514-L2203 HydrophobicContact CD1-CD2 3.7Å; L1514-L2203 HydrophobicContact CD1-CG 4.33Å
1515	R	90.6	Very high	88.7	Confident	82.4 Å²	82.4	52.9 Å²	52.9	31%	0.311	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	135.1	170.3	-58.7	-169	178	-161.5	1	109.5	Q1493 N1494 N1506 I1507 I1517 L1629 N1630	Q1493-R1515 PolarHBondContact O-NH1 3.13Å; Q1493-R1515 PolarHBondContact O-NH2 3.28Å; N1494-R1515 PolarHBondContact O-NH1 3.19Å; N1494-R1515 VanDerWaalsContact O-NH1 3.12Å; N1506-R1515 PolarHBondContact ND2-NH1 2.63Å; N1506-R1515 VanDerWaalsContact ND2-NH1 3.12Å; N1506-R1515 WeakPolarHBondContact OD1-CB 3.33Å; N1506-R1515 WeakPolarHBondContact OD1-CD 3.34Å; I1507-R1515 CarbonylContact O-C 3.56Å; I1507-R1515 VanDerWaalsContact O-CA 3.3Å; I1507-R1515 WeakPolarHBondContact O-CA 3.18Å; R1515-I1517 HydrophobicContact CB-CD1 4.4Å; R1515-I1517 HydrophobicContact CB-CG1 4.31Å; R1515-L1629 WeakPolarHBondContact O-CA 3.37Å; R1515-N1630 HydrophobicContact CB-CB 4.24Å; R1515-N1630 VanDerWaalsContact N-CG 3.31Å; R1515-N1630 PolarHBondContact N-OD1 2.93Å; R1515-N1630 PolarHBondContact O-N 2.96Å; R1515-N1630 VanDerWaalsContact O-N 3.14Å; R1515-N1630 PolarHBondContact O-OD1 2.91Å
1516	L	91.6	Very high	88.5	Confident	23.6 Å²	23.6	52.8 Å²	52.8	12%	0.124	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	116.9	170.3	-160.2	75	0	0	0	108	N1506 I1507 I1509 L1624 W1627 L1629 I2236 L2239	N1506-L1516 CarbonylContact C-O 3.58Å; N1506-L1516 WeakPolarHBondContact CA-O 3.14Å; I1507-L1516 HydrophobicContact CB-CB 4.4Å; I1507-L1516 PolarHBondContact N-O 2.95Å; I1507-L1516 PolarHBondContact O-N 3.1Å; I1509-L1516 HydrophobicContact CD1-CB 4.34Å; I1509-L1516 HydrophobicContact CD1-CD1 4.04Å; I1509-L1516 HydrophobicContact CG1-CB 4.44Å; L1516-L1624 HydrophobicContact CD1-CD1 4.23Å; L1516-W1627 HydrophobicContact CB-CE3 4.24Å; L1516-W1627 HydrophobicContact CB-CZ3 4.28Å; L1516-W1627 HydrophobicContact CD1-CB 3.94Å; L1516-W1627 HydrophobicContact CD2-CB 4.29Å; L1516-W1627 HydrophobicContact CD2-CD2 4.03Å; L1516-W1627 HydrophobicContact CD2-CE3 3.82Å; L1516-W1627 HydrophobicContact CD2-CG 4.23Å; L1516-W1627 HydrophobicContact CD2-CZ3 4.36Å; L1516-W1627 HydrophobicContact CG-CB 4.05Å; L1516-W1627 HydrophobicContact CG-CD2 4.14Å; L1516-W1627 HydrophobicContact CG-CE3 3.66Å; L1516-W1627 HydrophobicContact CG-CG 4.34Å; L1516-W1627 HydrophobicContact CG-CZ3 4.43Å; L1516-L1629 HydrophobicContact CB-CD2 4.47Å; L1516-L1629 HydrophobicContact CD1-CD2 4.02Å; L1516-I2236 HydrophobicContact CD2-CD1 4.22Å; L1516-L2239 HydrophobicContact CD2-CD2 4.37Å
1517	I	91.4	Very high	88.4	Confident	6.2 Å²	6.2	56.5 Å²	56.5	3%	0.032	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	125.2	-170.9	-63.6	179.3	0	0	0	110.1	M1504 Y1505 N1506 R1515 R1519 W1627 N1628 N1630 G1645 D1646	M1504-I1517 HydrophobicContact CE-CD1 3.66Å; M1504-I1517 HydrophobicContact CE-CG1 4.34Å; M1504-I1517 HydrophobicContact CE-CG2 3.61Å; M1504-I1517 HydrophobicContact CG-CG2 4.14Å; M1504-I1517 HydrophobicContact SD-CG2 4.28Å; Y1505-I1517 VanDerWaalsContact O-CA 3.28Å; Y1505-I1517 WeakPolarHBondContact O-CA 3.37Å; N1506-I1517 HydrophobicContact CB-CG1 4.19Å; N1506-I1517 VanDerWaalsContact OD1-CD1 3.31Å; N1506-I1517 WeakPolarHBondContact OD1-CD1 3.39Å; N1506-I1517 VanDerWaalsContact OD1-CG1 3.24Å; N1506-I1517 WeakPolarHBondContact OD1-CG1 3.38Å; N1506-I1517 WeakPolarHBondContact OD1-CG2 3.36Å; R1515-I1517 HydrophobicContact CB-CD1 4.4Å; R1515-I1517 HydrophobicContact CB-CG1 4.31Å; I1517-R1519 HydrophobicContact CG2-CG 4.14Å; I1517-W1627 CarbonylContact O-C 3.34Å; I1517-W1627 WeakPolarHBondContact O-CA 3.41Å; I1517-N1628 PolarHBondContact N-O 3.08Å; I1517-N1628 PolarHBondContact O-N 2.89Å; I1517-N1630 HydrophobicContact CD1-CB 3.7Å; I1517-N1630 HydrophobicContact CG1-CB 4.34Å; I1517-G1645 WeakPolarHBondContact CD1-O 3.48Å; I1517-D1646 HydrophobicContact CD1-CB 4.23Å
1518	Y	91.5	Very high	88.3	Confident	37 Å²	37	54.6 Å²	54.6	15%	0.145	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	141.1	168.1	167.5	-86.7	0	0	0	108.9	L1503 M1504 Y1505 T1523 N1626 W1627 Y2252 G2256 L2257 L2258	L1503-Y1518 HydrophobicContact CD2-CD1 4.47Å; L1503-Y1518 HydrophobicContact CD2-CE1 4.24Å; M1504-Y1518 CarbonylContact C-O 3.54Å; M1504-Y1518 VanDerWaalsContact CA-O 3.28Å; M1504-Y1518 WeakPolarHBondContact CA-O 3.43Å; M1504-Y1518 WeakPolarHBondContact CG-O 3.43Å; Y1505-Y1518 AromaticContact CD2-CD1 3.94Å; Y1505-Y1518 HydrophobicContact CD2-CD1 3.94Å; Y1505-Y1518 HydrophobicContact CD2-CE1 4.46Å; Y1505-Y1518 PolarHBondContact N-O 3.04Å; Y1505-Y1518 PolarHBondContact O-N 3.2Å; Y1518-T1523 HydrophobicContact CE2-CG2 4.23Å; Y1518-T1523 WeakPolarHBondContact OH-CG2 3.38Å; Y1518-N1626 HydrophobicContact CD2-CB 4.47Å; Y1518-N1626 HydrophobicContact CE2-CB 4.45Å; Y1518-W1627 VanDerWaalsContact CB-CE3 3.47Å; Y1518-W1627 VanDerWaalsContact CB-CH2 3.5Å; Y1518-W1627 VanDerWaalsContact CB-CZ3 3.42Å; Y1518-W1627 HydrophobicContact CD2-CZ2 4.45Å; Y1518-W1627 HydrophobicContact CG-CD2 4.48Å; Y1518-W1627 HydrophobicContact CG-CH2 4.45Å; Y1518-W1627 HydrophobicContact CG-CZ2 4.34Å; Y1518-Y2252 HydrophobicContact CD2-CE1 4.07Å; Y1518-Y2252 HydrophobicContact CE2-CD1 4.23Å; Y1518-Y2252 AromaticContact CE2-CE1 3.65Å; Y1518-Y2252 HydrophobicContact CE2-CE1 3.65Å; Y1518-G2256 PolarHBondContact OH-O 3.45Å; Y1518-L2257 WeakPolarHBondContact OH-CA 3.45Å; Y1518-L2258 HydrophobicContact CD1-CB 4.18Å; Y1518-L2258 HydrophobicContact CD1-CD2 4.16Å; Y1518-L2258 HydrophobicContact CE1-CB 3.53Å; Y1518-L2258 HydrophobicContact CE1-CD2 4.31Å; Y1518-L2258 HydrophobicContact CE2-CB 4.42Å; Y1518-L2258 PolarHBondContact OH-N 2.77Å
1519	R	89.7	Confident	88.3	Confident	10.4 Å²	10.4	52 Å²	52	4%	0.039	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	127.8	175.2	-84.3	176.7	55.9	-157	-6.7	110	L1503 M1504 I1517 D1521 R1522 E1618 D1646 G1647 H1649	L1503-R1519 CarbonylContact O-C 3.54Å; L1503-R1519 WeakPolarHBondContact O-CA 3.28Å; M1504-R1519 HydrophobicContact CB-CG 4.18Å; M1504-R1519 HydrophobicContact CG-CG 3.92Å; M1504-R1519 HydrophobicContact SD-CG 4.28Å; I1517-R1519 HydrophobicContact CG2-CG 4.14Å; R1519-D1521 VanDerWaalsContact C-N 3.3Å; R1519-D1521 VanDerWaalsContact CB-OD1 3.29Å; R1519-D1521 WeakPolarHBondContact CB-OD1 3.34Å; R1519-D1521 IonicContact CZ-OD1 3.2Å; R1519-D1521 VanDerWaalsContact CZ-OD1 3.31Å; R1519-D1521 IonicContact CZ-OD2 3.18Å; R1519-D1521 IonicContact NE-OD1 3.32Å; R1519-D1521 PolarHBondContact NE-OD1 3.25Å; R1519-D1521 IonicContact NE-OD2 3.3Å; R1519-D1521 PolarHBondContact NE-OD2 2.73Å; R1519-D1521 IonicContact NH2-OD1 2.88Å; R1519-D1521 PolarHBondContact NH2-OD1 2.99Å; R1519-D1521 IonicContact NH2-OD2 3.32Å; R1519-D1521 PolarHBondContact NH2-OD2 3.09Å; R1519-D1521 PolarHBondContact O-N 3.11Å; R1519-R1522 HydrophobicContact CB-CG 4.19Å; R1519-R1522 VanDerWaalsContact NH1-CZ 3.33Å; R1519-R1522 VanDerWaalsContact NH1-NH2 3.16Å; R1519-R1522 WeakPolarHBondContact O-CB 3.27Å; R1519-R1522 PolarHBondContact O-N 3.08Å; R1519-R1522 VanDerWaalsContact O-N 3.15Å; R1519-E1618 IonicContact CZ-OE1 3Å; R1519-E1618 IonicContact NH1-OE1 2.96Å; R1519-E1618 PolarHBondContact NH1-OE1 2.97Å; R1519-E1618 VanDerWaalsContact NH1-OE1 3.08Å; R1519-E1618 IonicContact NH1-OE2 2.77Å; R1519-E1618 PolarHBondContact NH1-OE2 2.81Å; R1519-E1618 VanDerWaalsContact NH1-OE2 3.13Å; R1519-E1618 IonicContact NH2-OE1 3.51Å; R1519-E1618 PolarHBondContact NH2-OE1 2.5Å; R1519-E1618 IonicContact NH2-OE2 3.36Å; R1519-D1646 WeakPolarHBondContact CD-O 3.49Å; R1519-D1646 PolarHBondContact NH1-O 3.11Å; R1519-G1647 PolarHBondContact NH1-O 3.02Å; R1519-G1647 PolarHBondContact NH2-O 3.3Å; R1519-H1649 PolarHBondContact NH1-NE2 2.83Å
1520	S	90.2	Very high	88.4	Confident	17.6 Å²	17.6	50.7 Å²	50.7	12%	0.123	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-67.9	-25.9	-177.4	67.6	0	0	0	0	113.2	A1502 L1503 R1522 T1523 Y1526	A1502-S1520 VanDerWaalsContact CA-OG 3.28Å; A1502-S1520 WeakPolarHBondContact CA-OG 3.29Å; A1502-S1520 WeakPolarHBondContact CB-OG 3.13Å; L1503-S1520 PolarHBondContact N-OG 3.08Å; L1503-S1520 PolarHBondContact O-N 3.03Å; L1503-S1520 PolarHBondContact O-OG 2.85Å; S1520-R1522 VanDerWaalsContact C-N 3.28Å; S1520-R1522 PolarHBondContact O-N 3.01Å; S1520-T1523 WeakPolarHBondContact O-CB 3.3Å; S1520-T1523 WeakPolarHBondContact O-CG2 3.41Å; S1520-T1523 PolarHBondContact O-N 2.95Å; S1520-T1523 VanDerWaalsContact O-N 3.14Å; S1520-T1523 PolarHBondContact O-OG1 3.27Å; S1520-Y1526 VanDerWaalsContact O-CB 3.28Å; S1520-Y1526 WeakPolarHBondContact O-CB 3.3Å
1521	D	86.8	Confident	88.6	Confident	20.8 Å²	20.8	45.5 Å²	45.5	11%	0.111	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-72.6	-15.1	179.4	54.9	-13.6	0	0	0	114.9	R1499 A1502 R1519 T1523 Y1526 K1577	R1499-D1521 IonicContact CZ-OD2 3.8Å; R1499-D1521 IonicContact NE-OD2 2.81Å; R1499-D1521 IonicContact NH2-OD2 3.8Å; R1499-D1521 PolarHBondContact NH2-OD2 3.42Å; A1502-D1521 HydrophobicContact CB-CB 3.68Å; R1519-D1521 VanDerWaalsContact C-N 3.3Å; R1519-D1521 VanDerWaalsContact CB-OD1 3.29Å; R1519-D1521 WeakPolarHBondContact CB-OD1 3.34Å; R1519-D1521 IonicContact CZ-OD1 3.2Å; R1519-D1521 VanDerWaalsContact CZ-OD1 3.31Å; R1519-D1521 IonicContact CZ-OD2 3.18Å; R1519-D1521 IonicContact NE-OD1 3.32Å; R1519-D1521 PolarHBondContact NE-OD1 3.25Å; R1519-D1521 IonicContact NE-OD2 3.3Å; R1519-D1521 PolarHBondContact NE-OD2 2.73Å; R1519-D1521 IonicContact NH2-OD1 2.88Å; R1519-D1521 PolarHBondContact NH2-OD1 2.99Å; R1519-D1521 IonicContact NH2-OD2 3.32Å; R1519-D1521 PolarHBondContact NH2-OD2 3.09Å; R1519-D1521 PolarHBondContact O-N 3.11Å; D1521-T1523 VanDerWaalsContact C-N 3.3Å; D1521-T1523 PolarHBondContact O-N 3.05Å; D1521-Y1526 VanDerWaalsContact CA-CG 3.44Å; D1521-Y1526 HydrophobicContact CB-CD1 3.6Å; D1521-Y1526 VanDerWaalsContact CB-CD1 3.46Å; D1521-Y1526 HydrophobicContact CB-CD2 4.06Å; D1521-Y1526 HydrophobicContact CB-CE1 3.72Å; D1521-Y1526 HydrophobicContact CB-CE2 4.17Å; D1521-Y1526 HydrophobicContact CB-CG 3.78Å; D1521-Y1526 VanDerWaalsContact O-CD1 3.22Å; D1521-Y1526 WeakPolarHBondContact O-CD1 3.33Å; D1521-K1577 PolarHBondContact O-NZ 3.03Å
1522	R	84.9	Confident	89	Confident	22.6 Å²	22.6	39.1 Å²	39.1	9%	0.085	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-78.6	-11.8	169.8	-64.6	-177.3	153.2	169.5	-2.4	113.5	R1519 S1520 E1618 I1620 N1628 R1644	R1519-R1522 HydrophobicContact CB-CG 4.19Å; R1519-R1522 VanDerWaalsContact NH1-CZ 3.33Å; R1519-R1522 VanDerWaalsContact NH1-NH2 3.16Å; R1519-R1522 WeakPolarHBondContact O-CB 3.27Å; R1519-R1522 PolarHBondContact O-N 3.08Å; R1519-R1522 VanDerWaalsContact O-N 3.15Å; S1520-R1522 VanDerWaalsContact C-N 3.28Å; S1520-R1522 PolarHBondContact O-N 3.01Å; R1522-E1618 IonicContact CZ-OE2 3.28Å; R1522-E1618 IonicContact NE-OE1 3.73Å; R1522-E1618 IonicContact NE-OE2 3.19Å; R1522-E1618 PolarHBondContact NE-OE2 3.09Å; R1522-E1618 IonicContact NH2-OE2 3.44Å; R1522-E1618 PolarHBondContact NH2-OE2 3.12Å; R1522-E1618 VanDerWaalsContact NH2-OE2 3.14Å; R1522-I1620 HydrophobicContact CB-CD1 4.18Å; R1522-I1620 HydrophobicContact CG-CD1 4.22Å; R1522-N1628 PolarHBondContact NH1-ND2 3.16Å; R1522-R1644 PolarHBondContact NH1-O 3.32Å; R1522-R1644 PolarHBondContact NH2-O 3.19Å; R1522-R1644 VanDerWaalsContact NH2-O 3.12Å
1523	T	84.6	Confident	89.2	Confident	25 Å²	25	38.3 Å²	38.3	15%	0.153	20%	0.202	C	C	.	.	S	Bend	trans	-82.5	156.3	-178.9	72.3	0	0	0	0	111.8	Y1518 S1520 D1521 G1525 Y1526 K1577 D2255 G2256 L2257	Y1518-T1523 HydrophobicContact CE2-CG2 4.23Å; Y1518-T1523 WeakPolarHBondContact OH-CG2 3.38Å; S1520-T1523 WeakPolarHBondContact O-CB 3.3Å; S1520-T1523 WeakPolarHBondContact O-CG2 3.41Å; S1520-T1523 PolarHBondContact O-N 2.95Å; S1520-T1523 VanDerWaalsContact O-N 3.14Å; S1520-T1523 PolarHBondContact O-OG1 3.27Å; D1521-T1523 VanDerWaalsContact C-N 3.3Å; D1521-T1523 PolarHBondContact O-N 3.05Å; T1523-G1525 PolarHBondContact O-N 3.1Å; T1523-G1525 VanDerWaalsContact O-N 3.16Å; T1523-G1525 PolarHBondContact OG1-N 3.16Å; T1523-Y1526 PolarHBondContact O-N 3.01Å; T1523-Y1526 VanDerWaalsContact O-N 3.09Å; T1523-K1577 PolarHBondContact O-NZ 3.34Å; T1523-D2255 WeakPolarHBondContact CB-O 3.43Å; T1523-G2256 WeakPolarHBondContact CG2-O 3.22Å; T1523-L2257 WeakPolarHBondContact OG1-CD2 3.26Å
1524	S	83.4	Confident	89.6	Confident	100.6 Å²	100.6	30 Å²	30	70%	0.703	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-20	173.5	51.5	0	0	0	0	113.7	Y1526 D2255	S1524-Y1526 VanDerWaalsContact C-N 3.34Å; S1524-D2255 PolarHBondContact N-O 3.33Å; S1524-D2255 WeakPolarHBondContact OG-CA 3.01Å; S1524-D2255 PolarHBondContact OG-O 2.77Å
1525	G	86.2	Confident	89.8	Confident	37.8 Å²	37.8	29.1 Å²	29.1	39%	0.39	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-25.2	175.5	0	0	0	0	0	113.8	T1523 K1527 D2255 G2279	T1523-G1525 PolarHBondContact O-N 3.1Å; T1523-G1525 VanDerWaalsContact O-N 3.16Å; T1523-G1525 PolarHBondContact OG1-N 3.16Å; G1525-K1527 PolarHBondContact O-N 2.91Å; G1525-D2255 WeakPolarHBondContact CA-OD2 3.35Å; G1525-D2255 PolarHBondContact N-O 3.06Å; G1525-D2255 VanDerWaalsContact N-O 3.09Å; G1525-G2279 VanDerWaalsContact O-CA 3.25Å; G1525-G2279 WeakPolarHBondContact O-CA 2.95Å
1526	Y	88.7	Confident	89.7	Confident	50.2 Å²	50.2	26.1 Å²	26.1	20%	0.197	15%	0.151	C	C	.	.			trans	-85.3	111.2	178.8	-173.4	-91.3	0	0	0	111.5	N1500 A1502 S1520 D1521 T1523 S1524 K1577 R2280	N1500-Y1526 PolarHBondContact O-OH 3.07Å; N1500-Y1526 VanDerWaalsContact O-OH 3.05Å; A1502-Y1526 HydrophobicContact CB-CD2 4.23Å; A1502-Y1526 HydrophobicContact CB-CE2 3.86Å; S1520-Y1526 VanDerWaalsContact O-CB 3.28Å; S1520-Y1526 WeakPolarHBondContact O-CB 3.3Å; D1521-Y1526 VanDerWaalsContact CA-CG 3.44Å; D1521-Y1526 HydrophobicContact CB-CD1 3.6Å; D1521-Y1526 VanDerWaalsContact CB-CD1 3.46Å; D1521-Y1526 HydrophobicContact CB-CD2 4.06Å; D1521-Y1526 HydrophobicContact CB-CE1 3.72Å; D1521-Y1526 HydrophobicContact CB-CE2 4.17Å; D1521-Y1526 HydrophobicContact CB-CG 3.78Å; D1521-Y1526 VanDerWaalsContact O-CD1 3.22Å; D1521-Y1526 WeakPolarHBondContact O-CD1 3.33Å; T1523-Y1526 PolarHBondContact O-N 3.01Å; T1523-Y1526 VanDerWaalsContact O-N 3.09Å; S1524-Y1526 VanDerWaalsContact C-N 3.34Å; Y1526-K1577 VanDerWaalsContact O-CE 3.27Å; Y1526-K1577 WeakPolarHBondContact O-CE 3.33Å; Y1526-K1577 PolarHBondContact O-NZ 3.1Å; Y1526-K1577 VanDerWaalsContact O-NZ 3.07Å; Y1526-R2280 HydrophobicContact CD2-CG 4.45Å; Y1526-R2280 HydrophobicContact CE2-CG 3.77Å
1527	K	90.4	Very high	89.4	Confident	93.4 Å²	93.4	29.6 Å²	29.6	41%	0.406	18%	0.178	S	C	.	.			trans	-100.2	116.8	-178.7	-64.9	-178.2	-174.2	173.9	0	110.2	G1525 Y1574 W1575 S2278 R2280	G1525-K1527 PolarHBondContact O-N 2.91Å; K1527-Y1574 HydrophobicContact CB-CD1 4.46Å; K1527-W1575 WeakPolarHBondContact CA-O 3.28Å; K1527-W1575 VanDerWaalsContact CB-O 3.27Å; K1527-W1575 WeakPolarHBondContact CB-O 3.37Å; K1527-S2278 PolarHBondContact N-O 2.97Å; K1527-R2280 PolarHBondContact O-NH1 3.39Å; K1527-R2280 VanDerWaalsContact O-NH1 3.11Å
1528	P	89.9	Confident	89	Confident	5.4 Å²	5.4	35.2 Å²	35.2	4%	0.035	21%	0.208	C	C	.	.			trans	-57.9	147.2	170	29.2	-40	0	0	0	109.8	Y1574 W1575 K1577 L1614 P1615	P1528-Y1574 CarbonylContact O-C 3.49Å; P1528-Y1574 WeakPolarHBondContact O-CA 3.33Å; P1528-W1575 VanDerWaalsContact CD-O 3.25Å; P1528-W1575 WeakPolarHBondContact CD-O 3.43Å; P1528-W1575 HydrophobicContact CG-CB 4.35Å; P1528-W1575 HydrophobicContact CG-CE3 3.87Å; P1528-W1575 PolarHBondContact O-N 3.01Å; P1528-K1577 VanDerWaalsContact CD-CE 3.47Å; P1528-K1577 HydrophobicContact CG-CG 3.95Å; P1528-L1614 HydrophobicContact CB-CD2 4.32Å; P1528-P1615 HydrophobicContact CB-CG 4.16Å; P1528-P1615 VanDerWaalsContact CG-O 3.3Å; P1528-P1615 WeakPolarHBondContact CG-O 3.36Å
1529	G	89.3	Confident	88.5	Confident	7.2 Å²	7.2	38 Å²	38	7%	0.074	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	162.5	-177.3	0	0	0	0	0	114	F1573	G1529-F1573 CarbonylContact C-O 3.53Å; G1529-F1573 WeakPolarHBondContact CA-O 3.24Å
1530	I	92.1	Very high	88.2	Confident	1.2 Å²	1.2	41.5 Å²	41.5	1%	0.006	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	146.2	178.7	53.6	175.8	0	0	0	110.3	I1477 I1532 T1572 F1573 V1593 V1612 L1614	I1477-I1530 HydrophobicContact CG2-CB 3.88Å; I1477-I1530 HydrophobicContact CG2-CD1 4.21Å; I1477-I1530 HydrophobicContact CG2-CG1 4.42Å; I1477-I1530 HydrophobicContact CG2-CG2 4.04Å; I1530-I1532 HydrophobicContact CD1-CD1 3.88Å; I1530-I1532 HydrophobicContact CD1-CG1 3.94Å; I1530-I1532 HydrophobicContact CG1-CD1 4.2Å; I1530-I1532 HydrophobicContact CG1-CG1 4.07Å; I1530-T1572 CarbonylContact O-C 3.59Å; I1530-T1572 WeakPolarHBondContact O-CA 3.34Å; I1530-T1572 WeakPolarHBondContact O-CG2 3.44Å; I1530-F1573 HydrophobicContact CD1-CD1 4.38Å; I1530-F1573 HydrophobicContact CG1-CB 4.06Å; I1530-F1573 HydrophobicContact CG1-CD1 4.17Å; I1530-F1573 PolarHBondContact N-O 3.29Å; I1530-F1573 PolarHBondContact O-N 3.1Å; I1530-V1593 HydrophobicContact CD1-CG2 3.76Å; I1530-V1612 HydrophobicContact CD1-CG1 3.95Å; I1530-V1612 HydrophobicContact CD1-CG2 4.05Å; I1530-V1612 HydrophobicContact CG2-CG1 4.11Å; I1530-V1612 HydrophobicContact CG2-CG2 4.32Å; I1530-L1614 HydrophobicContact CG2-CD1 4.28Å; I1530-L1614 HydrophobicContact CG2-CD2 3.73Å; I1530-L1614 HydrophobicContact CG2-CG 4.25Å
1531	S	91.8	Very high	88	Confident	28.6 Å²	28.6	42.1 Å²	42.1	20%	0.2	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	113.2	172.1	-75.3	0	0	0	0	108.9	Q1478	Q1478-S1531 PolarHBondContact N-O 2.89Å; Q1478-S1531 WeakPolarHBondContact O-CB 3.37Å; Q1478-S1531 PolarHBondContact O-N 2.79Å; Q1478-S1531 VanDerWaalsContact O-N 3.12Å
1532	I	93.7	Very high	88	Confident	0 Å²	0	43 Å²	43	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	106.1	-174.9	-52.4	163.4	0	0	0	107.8	I1477 I1530 L1534 L1550 I1552 L1570 S1571 F1573 V1593	I1477-I1532 HydrophobicContact CG1-CG1 4.47Å; I1477-I1532 HydrophobicContact CG1-CG2 4.32Å; I1477-I1532 HydrophobicContact CG2-CG1 4.47Å; I1530-I1532 HydrophobicContact CD1-CD1 3.88Å; I1530-I1532 HydrophobicContact CD1-CG1 3.94Å; I1530-I1532 HydrophobicContact CG1-CD1 4.2Å; I1530-I1532 HydrophobicContact CG1-CG1 4.07Å; I1532-L1534 HydrophobicContact CG2-CD2 3.7Å; I1532-L1534 HydrophobicContact CG2-CG 4.25Å; I1532-L1534 PolarHBondContact O-N 3.43Å; I1532-L1550 HydrophobicContact CD1-CD1 4.12Å; I1532-L1550 HydrophobicContact CD1-CD2 4.25Å; I1532-L1550 HydrophobicContact CG2-CD1 4.41Å; I1532-I1552 HydrophobicContact CD1-CD1 3.57Å; I1532-I1552 HydrophobicContact CD1-CG1 4.27Å; I1532-L1570 CarbonylContact O-C 3.57Å; I1532-L1570 WeakPolarHBondContact O-CA 3.34Å; I1532-L1570 WeakPolarHBondContact O-CD1 3.38Å; I1532-S1571 VanDerWaalsContact CB-O 3.32Å; I1532-S1571 WeakPolarHBondContact CB-O 3.28Å; I1532-S1571 PolarHBondContact N-O 3.01Å; I1532-S1571 PolarHBondContact O-N 3.02Å; I1532-F1573 HydrophobicContact CD1-CB 4.4Å; I1532-V1593 HydrophobicContact CD1-CG1 3.93Å; I1532-V1593 HydrophobicContact CD1-CG2 4.24Å; I1532-V1593 HydrophobicContact CG1-CG1 4.41Å; I1532-V1593 HydrophobicContact CG2-CG1 4.11Å
1533	H	92.5	Very high	87.9	Confident	33.8 Å²	33.8	50.7 Å²	50.7	16%	0.156	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	116.8	175.4	-67	-96.9	0	0	0	108.6	P1475 Y1476 Q1478	P1475-H1533 VanDerWaalsContact CA-O 3.26Å; P1475-H1533 WeakPolarHBondContact CA-O 3.41Å; Y1476-H1533 HydrophobicContact CD1-CB 3.81Å; Y1476-H1533 VanDerWaalsContact CD1-CB 3.44Å; Y1476-H1533 AromaticContact CD1-CD2 3.91Å; Y1476-H1533 HydrophobicContact CD2-CB 4.24Å; Y1476-H1533 AromaticContact CD2-CD2 3.89Å; Y1476-H1533 HydrophobicContact CE1-CB 3.29Å; Y1476-H1533 AromaticContact CE1-CD2 3.96Å; Y1476-H1533 AromaticContact CE1-CG 3.7Å; Y1476-H1533 VanDerWaalsContact CE1-CG 3.44Å; Y1476-H1533 AromaticContact CE1-ND1 3.98Å; Y1476-H1533 HydrophobicContact CE2-CB 3.93Å; Y1476-H1533 AromaticContact CE2-CD2 3.31Å; Y1476-H1533 WeakPolarHBondContact CE2-CD2 3.32Å; Y1476-H1533 AromaticContact CE2-CG 3.65Å; Y1476-H1533 VanDerWaalsContact CE2-CG 3.48Å; Y1476-H1533 AromaticContact CE2-NE2 3.86Å; Y1476-H1533 HydrophobicContact CG-CB 4.12Å; Y1476-H1533 VanDerWaalsContact CZ-CB 3.49Å; Y1476-H1533 AromaticContact CZ-CD2 3.43Å; Y1476-H1533 VanDerWaalsContact CZ-CD2 3.46Å; Y1476-H1533 AromaticContact CZ-CE1 3.81Å; Y1476-H1533 AromaticContact CZ-CG 3.27Å; Y1476-H1533 AromaticContact CZ-ND1 3.78Å; Y1476-H1533 AromaticContact CZ-NE2 3.64Å; Y1476-H1533 PolarHBondContact N-O 3.13Å; Y1476-H1533 VanDerWaalsContact N-O 3.16Å; Y1476-H1533 PolarHBondContact O-N 2.79Å; Y1476-H1533 PolarHBondContact OH-CD2 2.96Å; Y1476-H1533 VanDerWaalsContact OH-CD2 3.25Å; Y1476-H1533 PolarHBondContact OH-CE1 3.22Å; Y1476-H1533 PolarHBondContact OH-ND1 3.12Å; Y1476-H1533 PolarHBondContact OH-NE2 2.87Å; Q1478-H1533 PolarHBondContact OE1-NE2 3.05Å
1534	L	93.3	Very high	88	Confident	0 Å²	0	52 Å²	52	0%	0	31%	0.307	C	S	.	.			trans	-99.8	-32	-171.1	-61.9	168.5	0	0	0	111.9	P1475 I1532 I1548 L1550 L1563 L1569 V1595 Y1597	P1475-L1534 HydrophobicContact CB-CD2 4.47Å; I1532-L1534 HydrophobicContact CG2-CD2 3.7Å; I1532-L1534 HydrophobicContact CG2-CG 4.25Å; I1532-L1534 PolarHBondContact O-N 3.43Å; L1534-I1548 HydrophobicContact CD1-CG2 4.38Å; L1534-L1550 HydrophobicContact CD2-CD1 4.4Å; L1534-L1563 HydrophobicContact CD1-CD1 3.33Å; L1534-L1563 VanDerWaalsContact CD1-CD1 3.42Å; L1534-L1569 HydrophobicContact CB-CB 4.39Å; L1534-L1569 HydrophobicContact CB-CD2 4.05Å; L1534-L1569 HydrophobicContact CB-CG 4.22Å; L1534-L1569 WeakPolarHBondContact CB-O 3.37Å; L1534-L1569 HydrophobicContact CD1-CD2 3.78Å; L1534-L1569 HydrophobicContact CD1-CG 3.98Å; L1534-L1569 PolarHBondContact N-O 3.22Å; L1534-V1595 HydrophobicContact CD2-CB 4.26Å; L1534-V1595 HydrophobicContact CD2-CG1 3.64Å; L1534-V1595 HydrophobicContact CD2-CG2 3.54Å; L1534-V1595 VanDerWaalsContact CD2-CG2 3.48Å; L1534-Y1597 PolarHBondContact O-OH 3.13Å; L1534-Y1597 VanDerWaalsContact O-OH 3.12Å
1535	L	93.1	Very high	88.3	Confident	7.6 Å²	7.6	47.8 Å²	47.8	4%	0.04	28%	0.277	C	S	.	.	S	Bend	trans	-138.1	145.2	-179.7	-64.5	173	0	0	0	110.4	L1472 P1541 L1545 I1548 P1565 E1566 G1568 L1569 Y1597	L1472-L1535 HydrophobicContact CB-CD2 4.25Å; L1472-L1535 HydrophobicContact CD2-CD2 3.75Å; L1472-L1535 HydrophobicContact CG-CD2 4.43Å; L1472-L1535 CarbonylContact O-C 3.58Å; L1472-L1535 WeakPolarHBondContact O-CA 3.44Å; L1535-P1541 HydrophobicContact CD1-CB 4.12Å; L1535-P1541 HydrophobicContact CD1-CG 4.06Å; L1535-L1545 HydrophobicContact CD2-CD2 4.25Å; L1535-I1548 HydrophobicContact CD1-CD1 3.69Å; L1535-I1548 HydrophobicContact CD2-CD1 4.27Å; L1535-I1548 HydrophobicContact CG-CD1 3.97Å; L1535-P1565 HydrophobicContact CD1-CB 4.2Å; L1535-E1566 WeakPolarHBondContact CB-O 3.33Å; L1535-E1566 WeakPolarHBondContact CD1-O 3.33Å; L1535-G1568 CarbonylContact O-C 3.51Å; L1535-G1568 VanDerWaalsContact O-CA 3.24Å; L1535-G1568 WeakPolarHBondContact O-CA 3.34Å; L1535-G1568 PolarHBondContact O-N 3.14Å; L1535-L1569 HydrophobicContact CB-CB 4.13Å; L1535-L1569 HydrophobicContact CD1-CB 3.99Å; L1535-L1569 HydrophobicContact CD1-CD2 4.27Å; L1535-L1569 HydrophobicContact CG-CB 4.23Å; L1535-L1569 PolarHBondContact N-O 3.03Å; L1535-Y1597 HydrophobicContact CD2-CE1 4.21Å
1536	A	88.1	Confident	88.4	Confident	18.4 Å²	18.4	50.2 Å²	50.2	15%	0.152	28%	0.277	C	S	.	.			trans	-63.8	139.8	177.6	0	0	0	0	0	112.6	L1472 N1538 R1539 G1568	L1472-A1536 WeakPolarHBondContact O-CB 3.25Å; L1472-A1536 PolarHBondContact O-N 3.05Å; A1536-N1538 VanDerWaalsContact C-N 3.3Å; A1536-N1538 PolarHBondContact O-N 3.05Å; A1536-R1539 HydrophobicContact CB-CB 4.41Å; A1536-G1568 PolarHBondContact O-N 3.11Å; A1536-G1568 VanDerWaalsContact O-N 3.07Å
1537	S	85.4	Confident	88.5	Confident	97.4 Å²	97.4	48.5 Å²	48.5	68%	0.681	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-19.8	-179.9	18.4	0	0	0	0	114.5	G1568	S1537-G1568 VanDerWaalsContact CA-CA 3.47Å; S1537-G1568 WeakPolarHBondContact OG-CA 3.18Å
1538	N	83.9	Confident	88.6	Confident	124 Å²	124	44.1 Å²	44.1	66%	0.663	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	8.5	-176	66.9	-17.8	0	0	0	113.8	A1536	A1536-N1538 VanDerWaalsContact C-N 3.3Å; A1536-N1538 PolarHBondContact O-N 3.05Å
1539	R	80.9	Confident	88.8	Confident	95.6 Å²	95.6	43.9 Å²	43.9	36%	0.361	25%	0.25	S	S	.	.	S	Bend	trans	-137.7	144.7	-177.9	-66.7	175.5	-176.8	172.6	-1.1	110.4	V1470 T1471 A1536 P1567 D1959	V1470-R1539 PolarHBondContact O-NH1 3.17Å; T1471-R1539 VanDerWaalsContact O-CD 3.28Å; T1471-R1539 WeakPolarHBondContact O-CD 3.37Å; T1471-R1539 PolarHBondContact O-NH1 2.93Å; T1471-R1539 VanDerWaalsContact O-NH1 3.08Å; A1536-R1539 HydrophobicContact CB-CB 4.41Å; R1539-P1567 WeakPolarHBondContact O-CB 3.29Å; R1539-D1959 IonicContact CZ-OD2 2.75Å; R1539-D1959 IonicContact NH1-OD2 3.41Å; R1539-D1959 PolarHBondContact NH1-OD2 2.7Å; R1539-D1959 IonicContact NH2-OD2 3.1Å; R1539-D1959 PolarHBondContact NH2-OD2 3.09Å
1540	A	83.2	Confident	89.2	Confident	85 Å²	85	43.7 Å²	43.7	70%	0.702	25%	0.248	S	C	*	.	P	Polyproline II helix	trans	-74.6	140.4	168.9	0	0	0	0	0	110
1541	P	86.6	Confident	89.3	Confident	29 Å²	29	43.9 Å²	43.9	19%	0.188	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-61.8	153.7	171.4	7.2	-7.3	0	0	0	111.3	L1535 L1543 L1545 P1565 E1566	L1535-P1541 HydrophobicContact CD1-CB 4.12Å; L1535-P1541 HydrophobicContact CD1-CG 4.06Å; P1541-L1543 PolarHBondContact O-N 3.2Å; P1541-L1545 HydrophobicContact CB-CD2 4.28Å; P1541-P1565 HydrophobicContact CB-CB 4.09Å; P1541-P1565 HydrophobicContact CG-CB 4.23Å; P1541-E1566 VanDerWaalsContact CG-C 3.49Å
1542	P	86.3	Confident	89.5	Confident	40.4 Å²	40.4	42.7 Å²	42.7	26%	0.262	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-56.2	135.4	174.1	-24.3	34.1	0	0	0	111.8	L1472 N1544 L1545 Y1599	L1472-P1542 VanDerWaalsContact CD2-CD 3.42Å; L1472-P1542 HydrophobicContact CD2-CG 3.89Å; P1542-N1544 VanDerWaalsContact CB-OD1 3.24Å; P1542-N1544 WeakPolarHBondContact CB-OD1 3.36Å; P1542-N1544 PolarHBondContact O-N 2.94Å; P1542-N1544 VanDerWaalsContact O-N 3.1Å; P1542-L1545 HydrophobicContact CB-CB 4.36Å; P1542-L1545 VanDerWaalsContact O-CB 3.31Å; P1542-L1545 WeakPolarHBondContact O-CB 3.39Å; P1542-L1545 PolarHBondContact O-N 3Å; P1542-Y1599 HydrophobicContact CB-CE1 4.39Å; P1542-Y1599 HydrophobicContact CG-CE1 4.48Å
1543	L	82.6	Confident	89.6	Confident	185 Å²	185	43.8 Å²	43.8	97%	0.969	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-21.5	-177.7	-76.3	158.7	0	0	0	114.2	P1541	P1541-L1543 PolarHBondContact O-N 3.2Å
1544	N	87.1	Confident	89.7	Confident	50.6 Å²	50.6	42.2 Å²	42.2	27%	0.271	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-3.7	177.8	64.2	-32	0	0	0	113.4	P1542 K1546 Y1599 T1600	P1542-N1544 VanDerWaalsContact CB-OD1 3.24Å; P1542-N1544 WeakPolarHBondContact CB-OD1 3.36Å; P1542-N1544 PolarHBondContact O-N 2.94Å; P1542-N1544 VanDerWaalsContact O-N 3.1Å; N1544-K1546 PolarHBondContact O-N 3.05Å; N1544-Y1599 HydrophobicContact CB-CD1 4.46Å; N1544-Y1599 VanDerWaalsContact ND2-CD1 3.35Å; N1544-Y1599 WeakPolarHBondContact ND2-CD1 3.36Å; N1544-Y1599 CarbonylContact O-C 3.51Å; N1544-Y1599 VanDerWaalsContact O-CA 3.25Å; N1544-Y1599 WeakPolarHBondContact O-CA 3.4Å; N1544-T1600 WeakPolarHBondContact CA-OG1 3.42Å; N1544-T1600 WeakPolarHBondContact CB-OG1 3.28Å; N1544-T1600 PolarHBondContact O-N 2.86Å; N1544-T1600 PolarHBondContact O-OG1 3.11Å
1545	L	90.1	Very high	89.7	Confident	13 Å²	13	43.2 Å²	43.2	7%	0.068	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	116.7	173.3	-175.6	63	0	0	0	108	L1472 L1535 P1541 P1542 I1548 P1565 Y1597 Y1599	L1472-L1545 HydrophobicContact CD2-CD2 4.23Å; L1535-L1545 HydrophobicContact CD2-CD2 4.25Å; P1541-L1545 HydrophobicContact CB-CD2 4.28Å; P1542-L1545 HydrophobicContact CB-CB 4.36Å; P1542-L1545 VanDerWaalsContact O-CB 3.31Å; P1542-L1545 WeakPolarHBondContact O-CB 3.39Å; P1542-L1545 PolarHBondContact O-N 3Å; L1545-I1548 HydrophobicContact CD2-CD1 4.21Å; L1545-I1548 HydrophobicContact CD2-CG1 4.39Å; L1545-P1565 HydrophobicContact CB-CG 4.35Å; L1545-P1565 HydrophobicContact CD2-CB 3.96Å; L1545-P1565 HydrophobicContact CD2-CG 4.06Å; L1545-P1565 HydrophobicContact CG-CB 4.15Å; L1545-P1565 HydrophobicContact CG-CG 3.75Å; L1545-Y1597 HydrophobicContact CD1-CD1 4.15Å; L1545-Y1597 HydrophobicContact CD1-CG 4.49Å; L1545-Y1597 HydrophobicContact CD2-CD1 4.26Å; L1545-Y1599 HydrophobicContact CB-CD1 4.12Å; L1545-Y1599 HydrophobicContact CB-CE1 3.96Å; L1545-Y1599 HydrophobicContact CD1-CD1 4.11Å; L1545-Y1599 HydrophobicContact CD1-CD2 4.4Å; L1545-Y1599 HydrophobicContact CD1-CE1 3.83Å; L1545-Y1599 HydrophobicContact CD1-CE2 4.13Å; L1545-Y1599 HydrophobicContact CD1-CG 4.4Å; L1545-Y1599 HydrophobicContact CG-CE1 4.42Å
1546	K	87.3	Confident	89.7	Confident	87.8 Å²	87.8	42.9 Å²	42.9	38%	0.382	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	-53.4	-174.4	-176	-165.7	170.1	-143.8	0	111.1	N1544 P1565 V1598 T1600	N1544-K1546 PolarHBondContact O-N 3.05Å; K1546-P1565 VanDerWaalsContact O-CD 3.25Å; K1546-P1565 WeakPolarHBondContact O-CD 3.24Å; K1546-V1598 WeakPolarHBondContact CB-O 3.45Å; K1546-V1598 PolarHBondContact N-O 3.31Å; K1546-T1600 HydrophobicContact CB-CG2 4.02Å; K1546-T1600 HydrophobicContact CG-CG2 4.31Å
1547	E	90.6	Very high	90	Very high	15.4 Å²	15.4	43.4 Å²	43.4	7%	0.072	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	156.6	-169.1	46.6	-166.8	171.5	0	0	110.7	L1181 H1437 H1549 L1562 V1598	L1181-E1547 HydrophobicContact CD2-CB 4.08Å; H1437-E1547 IonicContact CE1-OE2 3.16Å; H1437-E1547 PolarHBondContact CE1-OE2 3.11Å; E1547-H1549 IonicContact OE1-NE2 3.24Å; E1547-H1549 IonicContact OE2-NE2 2.94Å; E1547-L1562 HydrophobicContact CB-CD1 4.04Å; E1547-L1562 HydrophobicContact CG-CD1 4.23Å; E1547-V1598 HydrophobicContact CB-CB 4.04Å; E1547-V1598 HydrophobicContact CB-CG2 4.26Å; E1547-V1598 HydrophobicContact CG-CB 3.65Å; E1547-V1598 HydrophobicContact CG-CG1 4.05Å; E1547-V1598 HydrophobicContact CG-CG2 4.07Å; E1547-V1598 PolarHBondContact N-O 3.08Å; E1547-V1598 PolarHBondContact O-N 3.17Å; E1547-V1598 VanDerWaalsContact O-N 3.08Å
1548	I	93.7	Very high	90.4	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	124.9	178.7	-63.8	169.5	0	0	0	108.7	L1534 L1535 L1545 L1563 P1565 L1569 V1595 G1596 Y1597	L1534-I1548 HydrophobicContact CD1-CG2 4.38Å; L1535-I1548 HydrophobicContact CD1-CD1 3.69Å; L1535-I1548 HydrophobicContact CD2-CD1 4.27Å; L1535-I1548 HydrophobicContact CG-CD1 3.97Å; L1545-I1548 HydrophobicContact CD2-CD1 4.21Å; L1545-I1548 HydrophobicContact CD2-CG1 4.39Å; I1548-L1563 HydrophobicContact CB-CB 4.25Å; I1548-L1563 PolarHBondContact N-O 3Å; I1548-L1563 WeakPolarHBondContact O-CB 3.43Å; I1548-L1563 PolarHBondContact O-N 3.28Å; I1548-P1565 HydrophobicContact CD1-CB 4.36Å; I1548-P1565 HydrophobicContact CD1-CG 4.38Å; I1548-P1565 HydrophobicContact CG1-CG 4.4Å; I1548-L1569 HydrophobicContact CD1-CD2 3.64Å; I1548-V1595 HydrophobicContact CG2-CG1 3.83Å; I1548-G1596 CarbonylContact C-O 3.54Å; I1548-G1596 WeakPolarHBondContact CA-O 3.4Å; I1548-Y1597 HydrophobicContact CD1-CD1 4.28Å; I1548-Y1597 HydrophobicContact CD1-CE1 4.2Å; I1548-Y1597 HydrophobicContact CG1-CD1 4.01Å; I1548-Y1597 HydrophobicContact CG1-CE1 4.34Å; I1548-Y1597 HydrophobicContact CG2-CE1 4.38Å
1549	H	93.7	Very high	90.9	Very high	2 Å²	2	39.5 Å²	39.5	1%	0.009	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	120.5	178.5	-66.9	-152.9	0	0	0	108.6	S1434 I1436 H1437 W1441 E1547 L1562 V1595 G1596 W1607	S1434-H1549 VanDerWaalsContact CB-ND1 3.27Å; S1434-H1549 WeakPolarHBondContact CB-ND1 3.37Å; S1434-H1549 PolarHBondContact OG-ND1 2.98Å; I1436-H1549 HydrophobicContact CD1-CB 3.84Å; H1437-H1549 AromaticContact CE1-CE1 3.81Å; H1437-H1549 AromaticContact CE1-NE2 3.42Å; H1437-H1549 PolarHBondContact CE1-NE2 3.42Å; H1437-H1549 AromaticContact ND1-CE1 3.55Å; H1437-H1549 PolarHBondContact ND1-CE1 3.28Å; H1437-H1549 AromaticContact ND1-NE2 3.58Å; W1441-H1549 AromaticContact CZ2-CE1 3.96Å; E1547-H1549 IonicContact OE1-NE2 3.24Å; E1547-H1549 IonicContact OE2-NE2 2.94Å; H1549-L1562 VanDerWaalsContact CD2-CD1 3.49Å; H1549-L1562 WeakPolarHBondContact CD2-CD1 3.34Å; H1549-L1562 WeakPolarHBondContact NE2-CD1 3.3Å; H1549-V1595 CarbonylContact O-C 3.56Å; H1549-V1595 VanDerWaalsContact O-CA 3.29Å; H1549-V1595 WeakPolarHBondContact O-CA 3.35Å; H1549-G1596 PolarHBondContact N-O 3Å; H1549-G1596 PolarHBondContact O-N 3.28Å; H1549-W1607 HydrophobicContact CB-CH2 3.84Å; H1549-W1607 HydrophobicContact CB-CZ2 4.45Å; H1549-W1607 HydrophobicContact CB-CZ3 4.36Å
1550	L	96.1	Very high	91.4	Very high	3 Å²	3	38.1 Å²	38.1	2%	0.016	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	123.2	175.6	174.3	62.8	0	0	0	109.5	I1532 L1534 I1552 V1560 K1561 L1563 S1571 V1593 V1595	I1532-L1550 HydrophobicContact CD1-CD1 4.12Å; I1532-L1550 HydrophobicContact CD1-CD2 4.25Å; I1532-L1550 HydrophobicContact CG2-CD1 4.41Å; L1534-L1550 HydrophobicContact CD2-CD1 4.4Å; L1550-I1552 HydrophobicContact CD1-CD1 4.43Å; L1550-I1552 HydrophobicContact CD1-CG1 4.13Å; L1550-I1552 HydrophobicContact CD2-CD1 4.37Å; L1550-I1552 HydrophobicContact CG-CD1 4.41Å; L1550-I1552 HydrophobicContact CG-CG1 4.27Å; L1550-V1560 CarbonylContact O-C 3.44Å; L1550-V1560 WeakPolarHBondContact O-CA 3.39Å; L1550-K1561 HydrophobicContact CB-CB 4.36Å; L1550-K1561 HydrophobicContact CD2-CD 4.41Å; L1550-K1561 PolarHBondContact N-O 3.01Å; L1550-K1561 PolarHBondContact O-N 3.17Å; L1550-L1563 HydrophobicContact CB-CD1 4.18Å; L1550-L1563 HydrophobicContact CD2-CD1 4.21Å; L1550-S1571 WeakPolarHBondContact CD2-OG 3.33Å; L1550-V1593 HydrophobicContact CD1-CG1 3.84Å; L1550-V1595 HydrophobicContact CD1-CG2 4.05Å
1551	V	95.4	Very high	91.9	Very high	4.8 Å²	4.8	38.6 Å²	38.6	3%	0.029	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	131	175.6	-176.5	0	0	0	0	108.8	P1435 R1558 H1559 V1560 S1594 W1607	P1435-V1551 HydrophobicContact CG-CB 4.49Å; P1435-V1551 HydrophobicContact CG-CG1 4.3Å; P1435-V1551 HydrophobicContact CG-CG2 3.62Å; V1551-R1558 HydrophobicContact CG1-CG 4.1Å; V1551-H1559 CarbonylContact C-O 3.48Å; V1551-H1559 VanDerWaalsContact CA-O 3.32Å; V1551-H1559 WeakPolarHBondContact CA-O 3.32Å; V1551-V1560 HydrophobicContact CG1-CG1 4.27Å; V1551-V1560 HydrophobicContact CG1-CG2 4.42Å; V1551-V1560 HydrophobicContact CG2-CG1 4.32Å; V1551-V1560 HydrophobicContact CG2-CG2 4.42Å; V1551-S1594 PolarHBondContact N-O 2.93Å; V1551-S1594 PolarHBondContact O-N 2.92Å; V1551-W1607 HydrophobicContact CG2-CH2 3.77Å; V1551-W1607 HydrophobicContact CG2-CZ3 4.03Å
1552	I	95.8	Very high	92.1	Very high	4.8 Å²	4.8	39.6 Å²	39.6	3%	0.025	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	112.6	178.9	-54.1	173.8	0	0	0	108.1	I1532 L1550 R1558 H1559 F1573 K1592 V1593	I1532-I1552 HydrophobicContact CD1-CD1 3.57Å; I1532-I1552 HydrophobicContact CD1-CG1 4.27Å; L1550-I1552 HydrophobicContact CD1-CD1 4.43Å; L1550-I1552 HydrophobicContact CD1-CG1 4.13Å; L1550-I1552 HydrophobicContact CD2-CD1 4.37Å; L1550-I1552 HydrophobicContact CG-CD1 4.41Å; L1550-I1552 HydrophobicContact CG-CG1 4.27Å; I1552-R1558 WeakPolarHBondContact O-CA 3.48Å; I1552-H1559 HydrophobicContact CB-CB 4.38Å; I1552-H1559 PolarHBondContact N-O 2.96Å; I1552-H1559 PolarHBondContact O-N 3.11Å; I1552-F1573 HydrophobicContact CD1-CB 3.49Å; I1552-F1573 VanDerWaalsContact CD1-CB 3.48Å; I1552-F1573 HydrophobicContact CD1-CD1 4.03Å; I1552-F1573 HydrophobicContact CD1-CD2 3.81Å; I1552-F1573 HydrophobicContact CD1-CE2 4.48Å; I1552-F1573 HydrophobicContact CD1-CG 3.5Å; I1552-F1573 VanDerWaalsContact CD1-CG 3.46Å; I1552-F1573 HydrophobicContact CG2-CD1 4.01Å; I1552-F1573 HydrophobicContact CG2-CE1 3.87Å; I1552-F1573 HydrophobicContact CG2-CG 4.43Å; I1552-F1573 HydrophobicContact CG2-CZ 4.21Å; I1552-K1592 WeakPolarHBondContact CA-O 3.23Å; I1552-V1593 HydrophobicContact CG1-CG1 4.46Å; I1552-V1593 HydrophobicContact CG1-CG2 4.36Å; I1552-V1593 HydrophobicContact CG2-CG2 4.37Å
1553	D	95.1	Very high	92.4	Very high	21.8 Å²	21.8	38.8 Å²	38.8	12%	0.117	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	122.8	175.3	-65.1	-42.1	0	0	0	109.4	Q1557 R1558 A1591 K1592	D1553-Q1557 CarbonylContact C-O 3.53Å; D1553-Q1557 VanDerWaalsContact CA-O 3.26Å; D1553-Q1557 WeakPolarHBondContact CA-O 3.31Å; D1553-R1558 VanDerWaalsContact CG-NH2 3.31Å; D1553-R1558 WeakPolarHBondContact OD1-CA 3.16Å; D1553-R1558 VanDerWaalsContact OD1-CB 3.25Å; D1553-R1558 WeakPolarHBondContact OD1-CB 3.24Å; D1553-R1558 VanDerWaalsContact OD1-CG 3.31Å; D1553-R1558 WeakPolarHBondContact OD1-CG 3.39Å; D1553-R1558 IonicContact OD1-CZ 3.45Å; D1553-R1558 IonicContact OD1-NE 3.34Å; D1553-R1558 PolarHBondContact OD1-NE 3.06Å; D1553-R1558 IonicContact OD1-NH2 3.25Å; D1553-R1558 PolarHBondContact OD1-NH2 3.16Å; D1553-R1558 VanDerWaalsContact OD1-NH2 3.16Å; D1553-R1558 IonicContact OD2-CZ 3Å; D1553-R1558 IonicContact OD2-NE 3.15Å; D1553-R1558 IonicContact OD2-NH2 3.27Å; D1553-R1558 PolarHBondContact OD2-NH2 2.98Å; D1553-A1591 CarbonylContact O-C 3.53Å; D1553-A1591 VanDerWaalsContact O-CA 3.26Å; D1553-A1591 WeakPolarHBondContact O-CA 3.35Å; D1553-K1592 HydrophobicContact CB-CB 4.42Å; D1553-K1592 PolarHBondContact N-O 3.09Å; D1553-K1592 PolarHBondContact O-N 3.17Å
1554	I	95.3	Very high	92.9	Very high	1 Å²	1	32 Å²	32	1%	0.005	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	124.5	179.3	-177	171.2	0	0	0	110.4	G1556 Q1557 F1573 W1575 A1589 A1591 L1614	I1554-G1556 PolarHBondContact O-N 3.24Å; I1554-G1556 VanDerWaalsContact O-N 3.08Å; I1554-Q1557 HydrophobicContact CG2-CB 4.43Å; I1554-Q1557 PolarHBondContact N-O 3.12Å; I1554-Q1557 WeakPolarHBondContact O-CB 3.36Å; I1554-Q1557 PolarHBondContact O-N 2.91Å; I1554-F1573 HydrophobicContact CG2-CE1 4.26Å; I1554-F1573 HydrophobicContact CG2-CZ 4.09Å; I1554-W1575 HydrophobicContact CD1-CB 4.3Å; I1554-W1575 HydrophobicContact CD1-CD2 3.45Å; I1554-W1575 VanDerWaalsContact CD1-CD2 3.45Å; I1554-W1575 HydrophobicContact CD1-CE3 3.69Å; I1554-W1575 HydrophobicContact CD1-CG 3.76Å; I1554-W1575 HydrophobicContact CD1-CH2 4.39Å; I1554-W1575 HydrophobicContact CD1-CZ2 4.21Å; I1554-W1575 HydrophobicContact CD1-CZ3 4.15Å; I1554-W1575 HydrophobicContact CG1-CD2 4.35Å; I1554-W1575 HydrophobicContact CG1-CZ2 4.39Å; I1554-W1575 HydrophobicContact CG2-CG 4.43Å; I1554-A1589 HydrophobicContact CD1-CB 4.41Å; I1554-A1589 HydrophobicContact CG1-CB 4.32Å; I1554-A1591 HydrophobicContact CB-CB 4.07Å; I1554-A1591 HydrophobicContact CD1-CB 4Å; I1554-A1591 HydrophobicContact CG1-CB 4.16Å; I1554-L1614 HydrophobicContact CD1-CB 4.3Å; I1554-L1614 HydrophobicContact CD1-CD1 3.93Å
1555	A	93.9	Very high	93.1	Very high	20.4 Å²	20.4	30 Å²	30	17%	0.169	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.3	37.8	178.8	0	0	0	0	0	114.2	Q1557 W1575 D1579 G1580 V1585	A1555-Q1557 VanDerWaalsContact C-N 3.31Å; A1555-Q1557 PolarHBondContact O-N 3.2Å; A1555-W1575 HydrophobicContact CB-CZ2 4.32Å; A1555-D1579 HydrophobicContact CB-CB 4.05Å; A1555-D1579 CarbonylContact O-C 3.46Å; A1555-D1579 VanDerWaalsContact O-CA 3.3Å; A1555-D1579 WeakPolarHBondContact O-CA 3.28Å; A1555-D1579 WeakPolarHBondContact O-CB 3.35Å; A1555-G1580 PolarHBondContact O-N 3.09Å; A1555-V1585 HydrophobicContact CB-CG2 4.13Å
1556	G	93.1	Very high	93.1	Very high	2.4 Å²	2.4	31.9 Å²	31.9	3%	0.025	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	83	-9.1	-177.6	0	0	0	0	0	116.1	R1320 I1390 N1392 I1554	R1320-G1556 WeakPolarHBondContact CD-O 3.31Å; R1320-G1556 PolarHBondContact NE-O 3.01Å; I1390-G1556 WeakPolarHBondContact O-CA 3.41Å; I1390-G1556 PolarHBondContact O-N 3.11Å; N1392-G1556 PolarHBondContact ND2-O 2.79Å; N1392-G1556 VanDerWaalsContact ND2-O 3.11Å; I1554-G1556 PolarHBondContact O-N 3.24Å; I1554-G1556 VanDerWaalsContact O-N 3.08Å
1557	Q	93.9	Very high	93.2	Very high	27.4 Å²	27.4	31.2 Å²	31.2	13%	0.128	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	142.3	166.7	-59.7	-175	1.8	0	0	110	D1553 I1554 A1555 H1559 N1576 T1578 D1579	D1553-Q1557 CarbonylContact C-O 3.53Å; D1553-Q1557 VanDerWaalsContact CA-O 3.26Å; D1553-Q1557 WeakPolarHBondContact CA-O 3.31Å; I1554-Q1557 HydrophobicContact CG2-CB 4.43Å; I1554-Q1557 PolarHBondContact N-O 3.12Å; I1554-Q1557 WeakPolarHBondContact O-CB 3.36Å; I1554-Q1557 PolarHBondContact O-N 2.91Å; A1555-Q1557 VanDerWaalsContact C-N 3.31Å; A1555-Q1557 PolarHBondContact O-N 3.2Å; Q1557-H1559 PolarHBondContact OE1-NE2 2.9Å; Q1557-H1559 VanDerWaalsContact OE1-NE2 3.1Å; Q1557-N1576 PolarHBondContact NE2-OD1 3.11Å; Q1557-T1578 PolarHBondContact NE2-O 3.1Å; Q1557-T1578 VanDerWaalsContact NE2-O 3.11Å; Q1557-T1578 PolarHBondContact NE2-OG1 2.87Å; Q1557-T1578 VanDerWaalsContact NE2-OG1 3.15Å; Q1557-D1579 WeakPolarHBondContact CG-O 3.37Å; Q1557-D1579 PolarHBondContact NE2-O 3.18Å; Q1557-D1579 VanDerWaalsContact NE2-O 3.11Å
1558	R	93.4	Very high	93.1	Very high	68.8 Å²	68.8	31.4 Å²	31.4	26%	0.26	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	122.7	171.4	171	162.7	-77	177	0.6	109.2	N1392 M1393 V1551 I1552 D1553 V1560	N1392-R1558 HydrophobicContact CB-CB 4.45Å; N1392-R1558 WeakPolarHBondContact ND2-CB 3.43Å; N1392-R1558 PolarHBondContact O-NH2 3.19Å; M1393-R1558 VanDerWaalsContact C-NH1 3.3Å; M1393-R1558 PolarHBondContact O-NH1 3.11Å; V1551-R1558 HydrophobicContact CG1-CG 4.1Å; I1552-R1558 WeakPolarHBondContact O-CA 3.48Å; D1553-R1558 VanDerWaalsContact CG-NH2 3.31Å; D1553-R1558 WeakPolarHBondContact OD1-CA 3.16Å; D1553-R1558 VanDerWaalsContact OD1-CB 3.25Å; D1553-R1558 WeakPolarHBondContact OD1-CB 3.24Å; D1553-R1558 VanDerWaalsContact OD1-CG 3.31Å; D1553-R1558 WeakPolarHBondContact OD1-CG 3.39Å; D1553-R1558 IonicContact OD1-CZ 3.45Å; D1553-R1558 IonicContact OD1-NE 3.34Å; D1553-R1558 PolarHBondContact OD1-NE 3.06Å; D1553-R1558 IonicContact OD1-NH2 3.25Å; D1553-R1558 PolarHBondContact OD1-NH2 3.16Å; D1553-R1558 VanDerWaalsContact OD1-NH2 3.16Å; D1553-R1558 IonicContact OD2-CZ 3Å; D1553-R1558 IonicContact OD2-NE 3.15Å; D1553-R1558 IonicContact OD2-NH2 3.27Å; D1553-R1558 PolarHBondContact OD2-NH2 2.98Å; R1558-V1560 HydrophobicContact CG-CG1 3.87Å; R1558-V1560 HydrophobicContact CG-CG2 3.84Å
1559	H	93.8	Very high	93.1	Very high	72.2 Å²	72.2	32.1 Å²	32.1	33%	0.334	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	133.6	175.3	-64.3	-93	0	0	0	109.4	V1551 I1552 Q1557 F1573	V1551-H1559 CarbonylContact C-O 3.48Å; V1551-H1559 VanDerWaalsContact CA-O 3.32Å; V1551-H1559 WeakPolarHBondContact CA-O 3.32Å; I1552-H1559 HydrophobicContact CB-CB 4.38Å; I1552-H1559 PolarHBondContact N-O 2.96Å; I1552-H1559 PolarHBondContact O-N 3.11Å; Q1557-H1559 PolarHBondContact OE1-NE2 2.9Å; Q1557-H1559 VanDerWaalsContact OE1-NE2 3.1Å; H1559-F1573 HydrophobicContact CB-CE2 4.06Å; H1559-F1573 AromaticContact CD2-CE2 3.63Å; H1559-F1573 VanDerWaalsContact CD2-CE2 3.41Å; H1559-F1573 WeakPolarHBondContact CD2-CE2 3.14Å; H1559-F1573 AromaticContact CD2-CZ 3.71Å; H1559-F1573 AromaticContact CG-CE2 3.6Å; H1559-F1573 AromaticContact ND1-CE2 3.89Å; H1559-F1573 AromaticContact NE2-CE2 3.92Å; H1559-F1573 AromaticContact NE2-CZ 3.9Å
1560	V	93.1	Very high	93.1	Very high	65.2 Å²	65.2	35.8 Å²	35.8	40%	0.395	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	139.6	-173.4	-134.4	0	0	0	0	110.6	P1435 I1436 L1550 V1551 R1558	P1435-V1560 HydrophobicContact CB-CG1 4.25Å; P1435-V1560 HydrophobicContact CB-CG2 4.11Å; P1435-V1560 HydrophobicContact CG-CG1 3.93Å; P1435-V1560 HydrophobicContact CG-CG2 3.79Å; I1436-V1560 HydrophobicContact CD1-CB 4.35Å; I1436-V1560 HydrophobicContact CD1-CG1 3.74Å; I1436-V1560 HydrophobicContact CG1-CB 3.89Å; I1436-V1560 HydrophobicContact CG1-CG1 3.25Å; I1436-V1560 HydrophobicContact CG1-CG2 4.34Å; L1550-V1560 CarbonylContact O-C 3.44Å; L1550-V1560 WeakPolarHBondContact O-CA 3.39Å; V1551-V1560 HydrophobicContact CG1-CG1 4.27Å; V1551-V1560 HydrophobicContact CG1-CG2 4.42Å; V1551-V1560 HydrophobicContact CG2-CG1 4.32Å; V1551-V1560 HydrophobicContact CG2-CG2 4.42Å; R1558-V1560 HydrophobicContact CG-CG1 3.87Å; R1558-V1560 HydrophobicContact CG-CG2 3.84Å
1561	K	92.1	Very high	93	Very high	95.4 Å²	95.4	36 Å²	36	42%	0.415	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	132.4	177.3	-130	-178.9	-175.6	-176.8	0	111.2	I1436 L1550 L1563 S1571 T1572	I1436-K1561 VanDerWaalsContact CD1-O 3.3Å; I1436-K1561 WeakPolarHBondContact CD1-O 3.38Å; L1550-K1561 HydrophobicContact CB-CB 4.36Å; L1550-K1561 HydrophobicContact CD2-CD 4.41Å; L1550-K1561 PolarHBondContact N-O 3.01Å; L1550-K1561 PolarHBondContact O-N 3.17Å; K1561-L1563 HydrophobicContact CB-CD2 4.37Å; K1561-L1563 HydrophobicContact CB-CG 4.38Å; K1561-L1563 HydrophobicContact CD-CD1 4.4Å; K1561-L1563 HydrophobicContact CD-CD2 3.88Å; K1561-L1563 HydrophobicContact CD-CG 4.32Å; K1561-L1563 HydrophobicContact CG-CD2 4.06Å; K1561-L1563 HydrophobicContact CG-CG 4.2Å; K1561-S1571 PolarHBondContact NZ-OG 3.23Å; K1561-T1572 PolarHBondContact NZ-O 3.16Å
1562	L	91.9	Very high	92.9	Very high	49.6 Å²	49.6	38.3 Å²	38.3	26%	0.26	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	135.4	167.8	-171	60.2	0	0	0	109.4	L1181 I1436 E1547 H1549	L1181-L1562 HydrophobicContact CB-CD2 4.34Å; L1181-L1562 HydrophobicContact CD1-CB 4.42Å; L1181-L1562 HydrophobicContact CD1-CD2 4.12Å; L1181-L1562 HydrophobicContact CD1-CG 3.95Å; L1181-L1562 HydrophobicContact CD2-CD1 4.48Å; L1181-L1562 HydrophobicContact CD2-CD2 4.03Å; L1181-L1562 HydrophobicContact CD2-CG 3.95Å; L1181-L1562 HydrophobicContact CG-CD2 4.37Å; L1181-L1562 HydrophobicContact CG-CG 4.43Å; I1436-L1562 HydrophobicContact CD1-CB 4.16Å; I1436-L1562 HydrophobicContact CD1-CD1 4.07Å; I1436-L1562 HydrophobicContact CG2-CB 4.26Å; I1436-L1562 HydrophobicContact CG2-CD1 4.39Å; I1436-L1562 HydrophobicContact CG2-CD2 4.39Å; I1436-L1562 HydrophobicContact CG2-CG 4.48Å; E1547-L1562 HydrophobicContact CB-CD1 4.04Å; E1547-L1562 HydrophobicContact CG-CD1 4.23Å; H1549-L1562 VanDerWaalsContact CD2-CD1 3.49Å; H1549-L1562 WeakPolarHBondContact CD2-CD1 3.34Å; H1549-L1562 WeakPolarHBondContact NE2-CD1 3.3Å
1563	L	93.5	Very high	92.8	Very high	24 Å²	24	38.9 Å²	38.9	13%	0.126	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	144	-173.4	-63.8	171.8	0	0	0	111.8	L1534 I1548 L1550 K1561 L1569	L1534-L1563 HydrophobicContact CD1-CD1 3.33Å; L1534-L1563 VanDerWaalsContact CD1-CD1 3.42Å; I1548-L1563 HydrophobicContact CB-CB 4.25Å; I1548-L1563 PolarHBondContact N-O 3Å; I1548-L1563 WeakPolarHBondContact O-CB 3.43Å; I1548-L1563 PolarHBondContact O-N 3.28Å; L1550-L1563 HydrophobicContact CB-CD1 4.18Å; L1550-L1563 HydrophobicContact CD2-CD1 4.21Å; K1561-L1563 HydrophobicContact CB-CD2 4.37Å; K1561-L1563 HydrophobicContact CB-CG 4.38Å; K1561-L1563 HydrophobicContact CD-CD1 4.4Å; K1561-L1563 HydrophobicContact CD-CD2 3.88Å; K1561-L1563 HydrophobicContact CD-CG 4.32Å; K1561-L1563 HydrophobicContact CG-CD2 4.06Å; K1561-L1563 HydrophobicContact CG-CG 4.2Å; L1563-L1569 HydrophobicContact CB-CD2 4.19Å; L1563-L1569 HydrophobicContact CD1-CD2 4.36Å
1564	E	91.6	Very high	92.7	Very high	42 Å²	42	43.5 Å²	43.5	20%	0.196	22%	0.224	C	C	.	.			trans	-84.1	140.9	172.3	-65.9	-177.7	140	0	0	111.1	G1176 K1177 Y1178 C1179 T1180 L1181 E1566	G1176-E1564 WeakPolarHBondContact CA-OE2 3.33Å; K1177-E1564 WeakPolarHBondContact CA-OE2 3.35Å; K1177-E1564 WeakPolarHBondContact CB-OE2 3.26Å; K1177-E1564 PolarHBondContact N-OE2 2.89Å; Y1178-E1564 HydrophobicContact CD2-CB 4.28Å; Y1178-E1564 WeakPolarHBondContact CD2-OE2 3.39Å; Y1178-E1564 PolarHBondContact N-OE1 2.92Å; Y1178-E1564 PolarHBondContact N-OE2 3.21Å; C1179-E1564 PolarHBondContact N-OE1 3.08Å; C1179-E1564 VanDerWaalsContact N-OE1 3.15Å; T1180-E1564 WeakPolarHBondContact CA-OE1 3.32Å; T1180-E1564 WeakPolarHBondContact CB-OE1 3.3Å; T1180-E1564 PolarHBondContact N-OE1 2.85Å; T1180-E1564 VanDerWaalsContact OG1-CD 3.29Å; T1180-E1564 WeakPolarHBondContact OG1-CG 3.17Å; T1180-E1564 PolarHBondContact OG1-OE1 3.07Å; L1181-E1564 HydrophobicContact CD1-CG 3.94Å; L1181-E1564 HydrophobicContact CD2-CG 3.82Å; L1181-E1564 HydrophobicContact CG-CG 3.54Å; E1564-E1566 PolarHBondContact O-N 3.12Å
1565	P	92.1	Very high	92.7	Very high	8.6 Å²	8.6	43.5 Å²	43.5	6%	0.056	22%	0.224	C	C	.	.			trans	-67.6	126.7	176.3	-21.8	34.7	0	0	0	112.6	R1156 L1535 P1541 L1545 K1546 I1548	R1156-P1565 PolarHBondContact NH1-O 3.14Å; R1156-P1565 PolarHBondContact NH2-O 2.84Å; L1535-P1565 HydrophobicContact CD1-CB 4.2Å; P1541-P1565 HydrophobicContact CB-CB 4.09Å; P1541-P1565 HydrophobicContact CG-CB 4.23Å; L1545-P1565 HydrophobicContact CB-CG 4.35Å; L1545-P1565 HydrophobicContact CD2-CB 3.96Å; L1545-P1565 HydrophobicContact CD2-CG 4.06Å; L1545-P1565 HydrophobicContact CG-CB 4.15Å; L1545-P1565 HydrophobicContact CG-CG 3.75Å; K1546-P1565 VanDerWaalsContact O-CD 3.25Å; K1546-P1565 WeakPolarHBondContact O-CD 3.24Å; I1548-P1565 HydrophobicContact CD1-CB 4.36Å; I1548-P1565 HydrophobicContact CD1-CG 4.38Å; I1548-P1565 HydrophobicContact CG1-CG 4.4Å
1566	E	89.7	Confident	92.5	Very high	53.6 Å²	53.6	45.7 Å²	45.7	25%	0.25	23%	0.233	S	C	.	.			trans	-145.5	152.3	170.7	53.3	-179.3	176.9	0	0	112.5	K1177 Y1178 L1535 P1541 E1564 G1568 L1569	K1177-E1566 WeakPolarHBondContact CD-OE2 3.21Å; K1177-E1566 WeakPolarHBondContact CE-OE2 3.3Å; K1177-E1566 VanDerWaalsContact NZ-CD 3.26Å; K1177-E1566 IonicContact NZ-OE1 3.41Å; K1177-E1566 PolarHBondContact NZ-OE1 3.03Å; K1177-E1566 IonicContact NZ-OE2 3.8Å; K1177-E1566 PolarHBondContact NZ-OE2 2.75Å; Y1178-E1566 HydrophobicContact CE2-CB 4.03Å; Y1178-E1566 VanDerWaalsContact CE2-OE2 3.3Å; Y1178-E1566 WeakPolarHBondContact CE2-OE2 3.3Å; Y1178-E1566 VanDerWaalsContact CZ-OE2 3.31Å; Y1178-E1566 PolarHBondContact OH-OE2 3.15Å; L1535-E1566 WeakPolarHBondContact CB-O 3.33Å; L1535-E1566 WeakPolarHBondContact CD1-O 3.33Å; P1541-E1566 VanDerWaalsContact CG-C 3.49Å; E1564-E1566 PolarHBondContact O-N 3.12Å; E1566-G1568 PolarHBondContact O-N 3.08Å; E1566-L1569 HydrophobicContact CG-CB 3.87Å; E1566-L1569 HydrophobicContact CG-CD1 3.9Å; E1566-L1569 HydrophobicContact CG-CG 4.41Å; E1566-L1569 VanDerWaalsContact O-CB 3.25Å; E1566-L1569 WeakPolarHBondContact O-CB 3.35Å; E1566-L1569 PolarHBondContact O-N 3.17Å; E1566-L1569 VanDerWaalsContact O-N 3.14Å
1567	P	89.1	Confident	92.5	Very high	72.2 Å²	72.2	46.2 Å²	46.2	47%	0.469	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	127.5	173.1	-20.3	30.5	0	0	0	110.8	R1539 L1569	R1539-P1567 WeakPolarHBondContact O-CB 3.29Å; P1567-L1569 VanDerWaalsContact C-N 3.3Å; P1567-L1569 PolarHBondContact O-N 3.08Å
1568	G	89.6	Confident	92.5	Very high	20.4 Å²	20.4	45.7 Å²	45.7	21%	0.21	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.9	18.4	179.1	0	0	0	0	0	115.2	L1535 A1536 S1537 E1566 L1570	L1535-G1568 CarbonylContact O-C 3.51Å; L1535-G1568 VanDerWaalsContact O-CA 3.24Å; L1535-G1568 WeakPolarHBondContact O-CA 3.34Å; L1535-G1568 PolarHBondContact O-N 3.14Å; A1536-G1568 PolarHBondContact O-N 3.11Å; A1536-G1568 VanDerWaalsContact O-N 3.07Å; S1537-G1568 VanDerWaalsContact CA-CA 3.47Å; S1537-G1568 WeakPolarHBondContact OG-CA 3.18Å; E1566-G1568 PolarHBondContact O-N 3.08Å; G1568-L1570 PolarHBondContact O-N 3.09Å; G1568-L1570 VanDerWaalsContact O-N 3.13Å
1569	L	93.7	Very high	92.4	Very high	13.6 Å²	13.6	42.6 Å²	42.6	7%	0.071	22%	0.222	C	C	.	.			trans	-50.6	120.3	179.5	179.7	68.4	0	0	0	111.2	L1534 L1535 I1548 L1563 E1566 P1567	L1534-L1569 HydrophobicContact CB-CB 4.39Å; L1534-L1569 HydrophobicContact CB-CD2 4.05Å; L1534-L1569 HydrophobicContact CB-CG 4.22Å; L1534-L1569 WeakPolarHBondContact CB-O 3.37Å; L1534-L1569 HydrophobicContact CD1-CD2 3.78Å; L1534-L1569 HydrophobicContact CD1-CG 3.98Å; L1534-L1569 PolarHBondContact N-O 3.22Å; L1535-L1569 HydrophobicContact CB-CB 4.13Å; L1535-L1569 HydrophobicContact CD1-CB 3.99Å; L1535-L1569 HydrophobicContact CD1-CD2 4.27Å; L1535-L1569 HydrophobicContact CG-CB 4.23Å; L1535-L1569 PolarHBondContact N-O 3.03Å; I1548-L1569 HydrophobicContact CD1-CD2 3.64Å; L1563-L1569 HydrophobicContact CB-CD2 4.19Å; L1563-L1569 HydrophobicContact CD1-CD2 4.36Å; E1566-L1569 HydrophobicContact CG-CB 3.87Å; E1566-L1569 HydrophobicContact CG-CD1 3.9Å; E1566-L1569 HydrophobicContact CG-CG 4.41Å; E1566-L1569 VanDerWaalsContact O-CB 3.25Å; E1566-L1569 WeakPolarHBondContact O-CB 3.35Å; E1566-L1569 PolarHBondContact O-N 3.17Å; E1566-L1569 VanDerWaalsContact O-N 3.14Å; P1567-L1569 VanDerWaalsContact C-N 3.3Å; P1567-L1569 PolarHBondContact O-N 3.08Å
1570	L	92.8	Very high	92.2	Very high	81.4 Å²	81.4	39.8 Å²	39.8	43%	0.426	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	133.3	-179.3	155	66.3	0	0	0	109.1	I1532 G1568	I1532-L1570 CarbonylContact O-C 3.57Å; I1532-L1570 WeakPolarHBondContact O-CA 3.34Å; I1532-L1570 WeakPolarHBondContact O-CD1 3.38Å; G1568-L1570 PolarHBondContact O-N 3.09Å; G1568-L1570 VanDerWaalsContact O-N 3.13Å
1571	S	93.8	Very high	92	Very high	6.2 Å²	6.2	37.2 Å²	37.2	4%	0.043	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	123.7	171.3	-174.5	0	0	0	0	110.1	I1532 L1550 K1561	I1532-S1571 VanDerWaalsContact CB-O 3.32Å; I1532-S1571 WeakPolarHBondContact CB-O 3.28Å; I1532-S1571 PolarHBondContact N-O 3.01Å; I1532-S1571 PolarHBondContact O-N 3.02Å; L1550-S1571 WeakPolarHBondContact CD2-OG 3.33Å; K1561-S1571 PolarHBondContact NZ-OG 3.23Å
1572	T	92.7	Very high	91.9	Very high	54.2 Å²	54.2	37.8 Å²	37.8	33%	0.333	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	139.4	172.1	-32.3	0	0	0	0	110.1	I1530 K1561 Y1574	I1530-T1572 CarbonylContact O-C 3.59Å; I1530-T1572 WeakPolarHBondContact O-CA 3.34Å; I1530-T1572 WeakPolarHBondContact O-CG2 3.44Å; K1561-T1572 PolarHBondContact NZ-O 3.16Å; T1572-Y1574 HydrophobicContact CG2-CD2 4.29Å; T1572-Y1574 HydrophobicContact CG2-CE1 4.17Å; T1572-Y1574 HydrophobicContact CG2-CE2 3.69Å; T1572-Y1574 VanDerWaalsContact CG2-CZ 3.46Å; T1572-Y1574 WeakPolarHBondContact CG2-OH 3.37Å
1573	F	94.5	Very high	91.6	Very high	16.4 Å²	16.4	38.2 Å²	38.2	7%	0.072	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	139.2	173.2	170.7	-109	0	0	0	109.7	G1529 I1530 I1532 I1552 I1554 H1559 W1575 L1614	G1529-F1573 CarbonylContact C-O 3.53Å; G1529-F1573 WeakPolarHBondContact CA-O 3.24Å; I1530-F1573 HydrophobicContact CD1-CD1 4.38Å; I1530-F1573 HydrophobicContact CG1-CB 4.06Å; I1530-F1573 HydrophobicContact CG1-CD1 4.17Å; I1530-F1573 PolarHBondContact N-O 3.29Å; I1530-F1573 PolarHBondContact O-N 3.1Å; I1532-F1573 HydrophobicContact CD1-CB 4.4Å; I1552-F1573 HydrophobicContact CD1-CB 3.49Å; I1552-F1573 VanDerWaalsContact CD1-CB 3.48Å; I1552-F1573 HydrophobicContact CD1-CD1 4.03Å; I1552-F1573 HydrophobicContact CD1-CD2 3.81Å; I1552-F1573 HydrophobicContact CD1-CE2 4.48Å; I1552-F1573 HydrophobicContact CD1-CG 3.5Å; I1552-F1573 VanDerWaalsContact CD1-CG 3.46Å; I1552-F1573 HydrophobicContact CG2-CD1 4.01Å; I1552-F1573 HydrophobicContact CG2-CE1 3.87Å; I1552-F1573 HydrophobicContact CG2-CG 4.43Å; I1552-F1573 HydrophobicContact CG2-CZ 4.21Å; I1554-F1573 HydrophobicContact CG2-CE1 4.26Å; I1554-F1573 HydrophobicContact CG2-CZ 4.09Å; H1559-F1573 HydrophobicContact CB-CE2 4.06Å; H1559-F1573 AromaticContact CD2-CE2 3.63Å; H1559-F1573 VanDerWaalsContact CD2-CE2 3.41Å; H1559-F1573 WeakPolarHBondContact CD2-CE2 3.14Å; H1559-F1573 AromaticContact CD2-CZ 3.71Å; H1559-F1573 AromaticContact CG-CE2 3.6Å; H1559-F1573 AromaticContact ND1-CE2 3.89Å; H1559-F1573 AromaticContact NE2-CE2 3.92Å; H1559-F1573 AromaticContact NE2-CZ 3.9Å; F1573-W1575 HydrophobicContact CE1-CB 3.88Å; F1573-W1575 HydrophobicContact CZ-CB 4.1Å; F1573-L1614 HydrophobicContact CE1-CD1 4.41Å
1574	Y	93.4	Very high	91.3	Very high	118.2 Å²	118.2	40.2 Å²	40.2	46%	0.464	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	127.6	176.9	-64.3	-72.9	0	0	0	109.6	K1527 P1528 T1572 E2277 S2278	K1527-Y1574 HydrophobicContact CB-CD1 4.46Å; P1528-Y1574 CarbonylContact O-C 3.49Å; P1528-Y1574 WeakPolarHBondContact O-CA 3.33Å; T1572-Y1574 HydrophobicContact CG2-CD2 4.29Å; T1572-Y1574 HydrophobicContact CG2-CE1 4.17Å; T1572-Y1574 HydrophobicContact CG2-CE2 3.69Å; T1572-Y1574 VanDerWaalsContact CG2-CZ 3.46Å; T1572-Y1574 WeakPolarHBondContact CG2-OH 3.37Å; Y1574-E2277 HydrophobicContact CD2-CB 4.22Å; Y1574-E2277 HydrophobicContact CE2-CB 4.09Å; Y1574-S2278 VanDerWaalsContact CZ-CB 3.44Å
1575	W	94.1	Very high	91.3	Very high	1.2 Å²	1.2	39.2 Å²	39.2	1%	0.005	21%	0.214	C	C	.	.			trans	-101.4	142.8	-179.8	177.5	51.3	0	0	0	111	K1527 P1528 I1554 A1555 F1573 K1577 T1578 V1585 A1589 L1614	K1527-W1575 WeakPolarHBondContact CA-O 3.28Å; K1527-W1575 VanDerWaalsContact CB-O 3.27Å; K1527-W1575 WeakPolarHBondContact CB-O 3.37Å; P1528-W1575 VanDerWaalsContact CD-O 3.25Å; P1528-W1575 WeakPolarHBondContact CD-O 3.43Å; P1528-W1575 HydrophobicContact CG-CB 4.35Å; P1528-W1575 HydrophobicContact CG-CE3 3.87Å; P1528-W1575 PolarHBondContact O-N 3.01Å; I1554-W1575 HydrophobicContact CD1-CB 4.3Å; I1554-W1575 HydrophobicContact CD1-CD2 3.45Å; I1554-W1575 VanDerWaalsContact CD1-CD2 3.45Å; I1554-W1575 HydrophobicContact CD1-CE3 3.69Å; I1554-W1575 HydrophobicContact CD1-CG 3.76Å; I1554-W1575 HydrophobicContact CD1-CH2 4.39Å; I1554-W1575 HydrophobicContact CD1-CZ2 4.21Å; I1554-W1575 HydrophobicContact CD1-CZ3 4.15Å; I1554-W1575 HydrophobicContact CG1-CD2 4.35Å; I1554-W1575 HydrophobicContact CG1-CZ2 4.39Å; I1554-W1575 HydrophobicContact CG2-CG 4.43Å; A1555-W1575 HydrophobicContact CB-CZ2 4.32Å; F1573-W1575 HydrophobicContact CE1-CB 3.88Å; F1573-W1575 HydrophobicContact CZ-CB 4.1Å; W1575-K1577 VanDerWaalsContact C-N 3.29Å; W1575-K1577 VanDerWaalsContact CE2-CA 3.46Å; W1575-K1577 HydrophobicContact CE3-CB 4.43Å; W1575-K1577 HydrophobicContact CE3-CG 4.33Å; W1575-K1577 HydrophobicContact CH2-CB 4.4Å; W1575-K1577 VanDerWaalsContact CZ2-C 3.46Å; W1575-K1577 VanDerWaalsContact CZ2-CA 3.47Å; W1575-K1577 HydrophobicContact CZ3-CB 4.32Å; W1575-K1577 HydrophobicContact CZ3-CG 4.35Å; W1575-K1577 PolarHBondContact O-N 2.86Å; W1575-T1578 WeakPolarHBondContact CZ2-O 3.29Å; W1575-T1578 PolarHBondContact NE1-O 2.96Å; W1575-V1585 HydrophobicContact CH2-CB 3.72Å; W1575-V1585 HydrophobicContact CH2-CG1 3.81Å; W1575-V1585 HydrophobicContact CH2-CG2 4.31Å; W1575-V1585 HydrophobicContact CZ2-CB 3.86Å; W1575-V1585 HydrophobicContact CZ2-CG1 4.29Å; W1575-V1585 HydrophobicContact CZ2-CG2 3.96Å; W1575-A1589 HydrophobicContact CH2-CB 3.55Å; W1575-A1589 VanDerWaalsContact CH2-CB 3.48Å; W1575-A1589 HydrophobicContact CZ2-CB 4.28Å; W1575-A1589 HydrophobicContact CZ3-CB 3.94Å; W1575-L1614 HydrophobicContact CB-CD1 4.4Å; W1575-L1614 HydrophobicContact CE3-CB 4.25Å; W1575-L1614 HydrophobicContact CZ3-CB 4.44Å
1576	N	91.5	Very high	91.1	Very high	67.6 Å²	67.6	41 Å²	41	36%	0.361	22%	0.221	S	C	.	.			trans	-86.5	9.8	-179.3	67.1	-15.5	0	0	0	113.7	Q1557 T1578	Q1557-N1576 PolarHBondContact NE2-OD1 3.11Å; N1576-T1578 VanDerWaalsContact C-N 3.28Å; N1576-T1578 VanDerWaalsContact CG-OG1 3.3Å; N1576-T1578 PolarHBondContact ND2-OG1 3.15Å; N1576-T1578 PolarHBondContact O-N 2.83Å; N1576-T1578 PolarHBondContact OD1-N 2.86Å; N1576-T1578 VanDerWaalsContact OD1-N 3.16Å; N1576-T1578 PolarHBondContact OD1-OG1 3.12Å
1577	K	92.8	Very high	90.9	Very high	12 Å²	12	38.6 Å²	38.6	5%	0.052	21%	0.21	C	C	.	.	S	Bend	trans	61.5	25.1	-176.5	-51	172.5	175.3	-179.6	0	114	D1521 T1523 Y1526 P1528 W1575 V1585 G1616 N1617	D1521-K1577 PolarHBondContact O-NZ 3.03Å; T1523-K1577 PolarHBondContact O-NZ 3.34Å; Y1526-K1577 VanDerWaalsContact O-CE 3.27Å; Y1526-K1577 WeakPolarHBondContact O-CE 3.33Å; Y1526-K1577 PolarHBondContact O-NZ 3.1Å; Y1526-K1577 VanDerWaalsContact O-NZ 3.07Å; P1528-K1577 VanDerWaalsContact CD-CE 3.47Å; P1528-K1577 HydrophobicContact CG-CG 3.95Å; W1575-K1577 VanDerWaalsContact C-N 3.29Å; W1575-K1577 VanDerWaalsContact CE2-CA 3.46Å; W1575-K1577 HydrophobicContact CE3-CB 4.43Å; W1575-K1577 HydrophobicContact CE3-CG 4.33Å; W1575-K1577 HydrophobicContact CH2-CB 4.4Å; W1575-K1577 VanDerWaalsContact CZ2-C 3.46Å; W1575-K1577 VanDerWaalsContact CZ2-CA 3.47Å; W1575-K1577 HydrophobicContact CZ3-CB 4.32Å; W1575-K1577 HydrophobicContact CZ3-CG 4.35Å; W1575-K1577 PolarHBondContact O-N 2.86Å; K1577-V1585 PolarHBondContact O-N 3.22Å; K1577-G1616 VanDerWaalsContact CD-O 3.27Å; K1577-G1616 WeakPolarHBondContact CD-O 3.37Å; K1577-G1616 WeakPolarHBondContact CE-O 3.45Å; K1577-G1616 PolarHBondContact NZ-O 3.03Å; K1577-N1617 WeakPolarHBondContact CB-ND2 3.37Å; K1577-N1617 VanDerWaalsContact CD-OD1 3.23Å; K1577-N1617 WeakPolarHBondContact CD-OD1 3.34Å; K1577-N1617 PolarHBondContact O-ND2 3.13Å; K1577-N1617 VanDerWaalsContact O-ND2 3.13Å
1578	T	92.6	Very high	90.9	Very high	16 Å²	16	37.4 Å²	37.4	10%	0.098	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	-116.6	157.3	175	70	0	0	0	0	113.6	Q1557 W1575 N1576 N1582 R1583	Q1557-T1578 PolarHBondContact NE2-O 3.1Å; Q1557-T1578 VanDerWaalsContact NE2-O 3.11Å; Q1557-T1578 PolarHBondContact NE2-OG1 2.87Å; Q1557-T1578 VanDerWaalsContact NE2-OG1 3.15Å; W1575-T1578 WeakPolarHBondContact CZ2-O 3.29Å; W1575-T1578 PolarHBondContact NE1-O 2.96Å; N1576-T1578 VanDerWaalsContact C-N 3.28Å; N1576-T1578 VanDerWaalsContact CG-OG1 3.3Å; N1576-T1578 PolarHBondContact ND2-OG1 3.15Å; N1576-T1578 PolarHBondContact O-N 2.83Å; N1576-T1578 PolarHBondContact OD1-N 2.86Å; N1576-T1578 VanDerWaalsContact OD1-N 3.16Å; N1576-T1578 PolarHBondContact OD1-OG1 3.12Å; T1578-N1582 PolarHBondContact OG1-OD1 3.21Å; T1578-R1583 CarbonylContact C-O 3.25Å; T1578-R1583 WeakPolarHBondContact CA-O 3.19Å; T1578-R1583 WeakPolarHBondContact CB-O 3.37Å
1579	D	92.2	Very high	91	Very high	4.6 Å²	4.6	36.9 Å²	36.9	3%	0.025	19%	0.193	C	C	.	.			trans	-85	-178.7	175.2	69.7	6.6	0	0	0	112.2	I1390 A1555 Q1557 Y1581 N1582 R1583 V1585	I1390-D1579 HydrophobicContact CD1-CB 4.23Å; A1555-D1579 HydrophobicContact CB-CB 4.05Å; A1555-D1579 CarbonylContact O-C 3.46Å; A1555-D1579 VanDerWaalsContact O-CA 3.3Å; A1555-D1579 WeakPolarHBondContact O-CA 3.28Å; A1555-D1579 WeakPolarHBondContact O-CB 3.35Å; Q1557-D1579 WeakPolarHBondContact CG-O 3.37Å; Q1557-D1579 PolarHBondContact NE2-O 3.18Å; Q1557-D1579 VanDerWaalsContact NE2-O 3.11Å; D1579-Y1581 PolarHBondContact O-N 3.3Å; D1579-Y1581 VanDerWaalsContact O-N 3.12Å; D1579-Y1581 VanDerWaalsContact OD1-C 3.26Å; D1579-Y1581 VanDerWaalsContact OD1-CA 3.27Å; D1579-Y1581 WeakPolarHBondContact OD1-CA 3.31Å; D1579-Y1581 WeakPolarHBondContact OD1-CB 3.35Å; D1579-Y1581 PolarHBondContact OD1-N 3.14Å; D1579-N1582 PolarHBondContact O-N 3.01Å; D1579-N1582 PolarHBondContact OD1-N 2.97Å; D1579-N1582 VanDerWaalsContact OD1-N 3.08Å; D1579-R1583 PolarHBondContact N-O 3.06Å; D1579-R1583 WeakPolarHBondContact OD1-CB 3.13Å; D1579-R1583 PolarHBondContact OD1-N 3.02Å; D1579-R1583 IonicContact OD1-NE 3.25Å; D1579-R1583 IonicContact OD2-CZ 3.2Å; D1579-R1583 VanDerWaalsContact OD2-CZ 3.27Å; D1579-R1583 IonicContact OD2-NE 3.46Å; D1579-R1583 PolarHBondContact OD2-NE 3.11Å; D1579-R1583 IonicContact OD2-NH2 3.3Å; D1579-R1583 PolarHBondContact OD2-NH2 3.04Å; D1579-V1585 HydrophobicContact CB-CG2 3.71Å
1580	G	89.3	Confident	90.9	Very high	14.4 Å²	14.4	38.8 Å²	38.8	15%	0.148	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-2.8	175.5	0	0	0	0	0	115.1	R1320 A1555	R1320-G1580 PolarHBondContact NH1-O 3.12Å; R1320-G1580 PolarHBondContact NH2-O 3.13Å; A1555-G1580 PolarHBondContact O-N 3.09Å
1581	Y	89.5	Confident	90.9	Very high	9.2 Å²	9.2	34.9 Å²	34.9	4%	0.036	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.4	11.3	174.6	-51.5	-70.8	0	0	0	111.5	F1277 F1299 L1300 V1318 R1320 D1356 I1390 D1579 R1583	F1277-Y1581 HydrophobicContact CD1-CD1 4.38Å; F1277-Y1581 HydrophobicContact CD1-CE1 4.31Å; F1277-Y1581 AromaticContact CD2-CD1 3.84Å; F1277-Y1581 HydrophobicContact CD2-CD1 3.88Å; F1277-Y1581 HydrophobicContact CD2-CE1 4.43Å; F1277-Y1581 HydrophobicContact CE1-CD1 4.3Å; F1277-Y1581 HydrophobicContact CE1-CE1 4.43Å; F1277-Y1581 AromaticContact CE2-CD1 3.89Å; F1277-Y1581 HydrophobicContact CE2-CD1 3.89Å; F1277-Y1581 HydrophobicContact CE2-CE1 4.48Å; F1277-Y1581 HydrophobicContact CG-CD1 4.21Å; F1277-Y1581 HydrophobicContact CG-CE1 4.39Å; F1277-Y1581 HydrophobicContact CZ-CD1 4.2Å; F1299-Y1581 AromaticContact CE2-CD1 3.67Å; F1299-Y1581 HydrophobicContact CE2-CD1 3.99Å; F1299-Y1581 HydrophobicContact CE2-CD2 4.45Å; F1299-Y1581 AromaticContact CE2-CE1 3.84Å; F1299-Y1581 HydrophobicContact CE2-CE1 4.17Å; F1299-Y1581 HydrophobicContact CE2-CG 4.18Å; F1299-Y1581 AromaticContact CZ-CD1 3.66Å; F1299-Y1581 HydrophobicContact CZ-CD1 3.99Å; F1299-Y1581 AromaticContact CZ-CD2 3.7Å; F1299-Y1581 HydrophobicContact CZ-CD2 3.7Å; F1299-Y1581 AromaticContact CZ-CE1 3.77Å; F1299-Y1581 HydrophobicContact CZ-CE1 4.1Å; F1299-Y1581 AromaticContact CZ-CE2 3.81Å; F1299-Y1581 HydrophobicContact CZ-CE2 3.81Å; F1299-Y1581 AromaticContact CZ-CG 3.81Å; F1299-Y1581 HydrophobicContact CZ-CG 3.81Å; F1299-Y1581 AromaticContact CZ-CZ 3.94Å; L1300-Y1581 HydrophobicContact CD1-CE2 4.24Å; V1318-Y1581 WeakPolarHBondContact CG1-OH 3.45Å; R1320-Y1581 VanDerWaalsContact NH1-CE1 3.31Å; R1320-Y1581 VanDerWaalsContact NH1-CZ 3.31Å; D1356-Y1581 WeakPolarHBondContact OD1-CE1 3.21Å; D1356-Y1581 VanDerWaalsContact OD1-CZ 3.29Å; D1356-Y1581 PolarHBondContact OD1-OH 2.97Å; I1390-Y1581 HydrophobicContact CD1-CD2 4.18Å; I1390-Y1581 HydrophobicContact CD1-CE2 3.8Å; I1390-Y1581 HydrophobicContact CG1-CE2 4.4Å; I1390-Y1581 HydrophobicContact CG2-CE2 4.23Å; D1579-Y1581 PolarHBondContact O-N 3.3Å; D1579-Y1581 VanDerWaalsContact O-N 3.12Å; D1579-Y1581 VanDerWaalsContact OD1-C 3.26Å; D1579-Y1581 VanDerWaalsContact OD1-CA 3.27Å; D1579-Y1581 WeakPolarHBondContact OD1-CA 3.31Å; D1579-Y1581 WeakPolarHBondContact OD1-CB 3.35Å; D1579-Y1581 PolarHBondContact OD1-N 3.14Å; Y1581-R1583 VanDerWaalsContact C-N 3.26Å; Y1581-R1583 PolarHBondContact O-N 3.06Å
1582	N	88.5	Confident	90.9	Very high	107.8 Å²	107.8	38.1 Å²	38.1	58%	0.576	19%	0.194	S	C	*	.	S	Bend	trans	59.5	25.7	-176.6	-146	21.7	0	0	0	115	T1578 D1579	T1578-N1582 PolarHBondContact OG1-OD1 3.21Å; D1579-N1582 PolarHBondContact O-N 3.01Å; D1579-N1582 PolarHBondContact OD1-N 2.97Å; D1579-N1582 VanDerWaalsContact OD1-N 3.08Å
1583	R	86.5	Confident	91	Very high	59.2 Å²	59.2	35.6 Å²	35.6	22%	0.223	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-93.8	147.7	176.1	-52.3	179.4	-58.9	161.8	8	110.9	L1281 Q1296 F1299 T1578 D1579 Y1581 V1585	L1281-R1583 HydrophobicContact CD2-CG 4.31Å; Q1296-R1583 PolarHBondContact O-NH1 3.1Å; Q1296-R1583 PolarHBondContact O-NH2 2.85Å; F1299-R1583 VanDerWaalsContact CE1-CZ 3.46Å; F1299-R1583 VanDerWaalsContact CE1-NH1 3.28Å; T1578-R1583 CarbonylContact C-O 3.25Å; T1578-R1583 WeakPolarHBondContact CA-O 3.19Å; T1578-R1583 WeakPolarHBondContact CB-O 3.37Å; D1579-R1583 PolarHBondContact N-O 3.06Å; D1579-R1583 WeakPolarHBondContact OD1-CB 3.13Å; D1579-R1583 PolarHBondContact OD1-N 3.02Å; D1579-R1583 IonicContact OD1-NE 3.25Å; D1579-R1583 IonicContact OD2-CZ 3.2Å; D1579-R1583 VanDerWaalsContact OD2-CZ 3.27Å; D1579-R1583 IonicContact OD2-NE 3.46Å; D1579-R1583 PolarHBondContact OD2-NE 3.11Å; D1579-R1583 IonicContact OD2-NH2 3.3Å; D1579-R1583 PolarHBondContact OD2-NH2 3.04Å; Y1581-R1583 VanDerWaalsContact C-N 3.26Å; Y1581-R1583 PolarHBondContact O-N 3.06Å; R1583-V1585 PolarHBondContact O-N 3.24Å
1584	S	87.7	Confident	91	Very high	65.4 Å²	65.4	35.2 Å²	35.2	46%	0.457	18%	0.178	S	C	.	.	B	Isolated β-bridge	trans	-61.4	122.4	176.2	-65.8	0	0	0	0	111.9	Y1586 N1617	S1584-Y1586 WeakPolarHBondContact O-CD2 3.36Å; S1584-Y1586 WeakPolarHBondContact O-CE2 3.38Å; S1584-N1617 WeakPolarHBondContact CB-ND2 3.42Å
1585	V	90.3	Very high	91	Very high	20.4 Å²	20.4	29.6 Å²	29.6	12%	0.124	16%	0.156	C	C	.	.	P	Polyproline II helix	trans	-92	136.3	172.6	178.6	0	0	0	0	109	A1555 W1575 K1577 D1579 R1583 A1589 G1616 N1617	A1555-V1585 HydrophobicContact CB-CG2 4.13Å; W1575-V1585 HydrophobicContact CH2-CB 3.72Å; W1575-V1585 HydrophobicContact CH2-CG1 3.81Å; W1575-V1585 HydrophobicContact CH2-CG2 4.31Å; W1575-V1585 HydrophobicContact CZ2-CB 3.86Å; W1575-V1585 HydrophobicContact CZ2-CG1 4.29Å; W1575-V1585 HydrophobicContact CZ2-CG2 3.96Å; K1577-V1585 PolarHBondContact O-N 3.22Å; D1579-V1585 HydrophobicContact CB-CG2 3.71Å; R1583-V1585 PolarHBondContact O-N 3.24Å; V1585-A1589 HydrophobicContact CG1-CB 4.23Å; V1585-G1616 WeakPolarHBondContact O-CA 3Å; V1585-N1617 WeakPolarHBondContact O-CB 3.33Å; V1585-N1617 PolarHBondContact O-N 3.01Å; V1585-N1617 PolarHBondContact O-ND2 3.1Å
1586	Y	87.8	Confident	91	Very high	47.4 Å²	47.4	29.6 Å²	29.6	19%	0.186	16%	0.156	C	C	.	.	B	Isolated β-bridge	trans	-111.2	155.4	178.9	-68.2	-91.6	0	0	0	111.2	L1289 S1584 N1617 E1618 L1619 H1639	L1289-Y1586 HydrophobicContact CB-CE2 4.48Å; L1289-Y1586 HydrophobicContact CD2-CE1 4.34Å; L1289-Y1586 HydrophobicContact CD2-CE2 3.88Å; L1289-Y1586 WeakPolarHBondContact CD2-OH 3.2Å; S1584-Y1586 WeakPolarHBondContact O-CD2 3.36Å; S1584-Y1586 WeakPolarHBondContact O-CE2 3.38Å; Y1586-N1617 WeakPolarHBondContact CA-O 3.36Å; Y1586-N1617 HydrophobicContact CD1-CB 3.7Å; Y1586-N1617 WeakPolarHBondContact CD1-O 3.34Å; Y1586-N1617 HydrophobicContact CE1-CB 3.56Å; Y1586-N1617 VanDerWaalsContact CE1-CB 3.46Å; Y1586-N1617 HydrophobicContact CG-CB 4.36Å; Y1586-E1618 WeakPolarHBondContact CE1-O 3.37Å; Y1586-L1619 HydrophobicContact CD1-CD2 3.7Å; Y1586-L1619 VanDerWaalsContact CD1-CD2 3.49Å; Y1586-L1619 HydrophobicContact CD1-CG 4.17Å; Y1586-L1619 HydrophobicContact CE1-CD2 4.05Å; Y1586-L1619 HydrophobicContact CG-CD2 4.2Å; Y1586-H1639 VanDerWaalsContact C-CE1 3.49Å; Y1586-H1639 PolarHBondContact O-CE1 3Å; Y1586-H1639 PolarHBondContact O-ND1 3.11Å; Y1586-H1639 PolarHBondContact O-NE2 3.43Å
1587	G	87.2	Confident	90.9	Very high	2.4 Å²	2.4	26.4 Å²	26.4	3%	0.025	14%	0.139	C	C	.	.	S	Bend	trans	75.1	-134.2	179.1	0	0	0	0	0	113.9	P1615 G1616 N1617 Y1643	G1587-P1615 CarbonylContact O-C 3.53Å; G1587-P1615 WeakPolarHBondContact O-CA 3.46Å; G1587-G1616 PolarHBondContact O-N 2.96Å; G1587-N1617 PolarHBondContact N-O 3.11Å; G1587-Y1643 WeakPolarHBondContact CA-OH 3.38Å; G1587-Y1643 PolarHBondContact N-OH 3.47Å
1588	L	88.8	Confident	90.7	Very high	47.6 Å²	47.6	26.2 Å²	26.2	25%	0.249	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	134.5	179.3	-65.3	176.9	0	0	0	110.3	L1482 P1615 I1641 Y1651 Q1654	L1482-L1588 HydrophobicContact CD1-CD1 4.3Å; L1482-L1588 HydrophobicContact CD1-CD2 4.02Å; L1482-L1588 HydrophobicContact CD2-CD2 4.06Å; L1588-P1615 HydrophobicContact CD2-CB 4.29Å; L1588-I1641 HydrophobicContact CG-CD1 4.26Å; L1588-Y1651 HydrophobicContact CD1-CD1 3.88Å; L1588-Y1651 HydrophobicContact CD1-CE1 4.16Å; L1588-Y1651 HydrophobicContact CD2-CD1 4.27Å; L1588-Y1651 HydrophobicContact CD2-CE1 3.76Å; L1588-Y1651 HydrophobicContact CG-CD1 4.19Å; L1588-Y1651 HydrophobicContact CG-CE1 4.04Å; L1588-Q1654 VanDerWaalsContact CD1-NE2 3.34Å
1589	A	91.5	Very high	90.5	Very high	9.2 Å²	9.2	25.6 Å²	25.6	8%	0.076	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	139.5	173.2	0	0	0	0	0	110.6	I1554 W1575 V1585 Q1613 L1614	I1554-A1589 HydrophobicContact CD1-CB 4.41Å; I1554-A1589 HydrophobicContact CG1-CB 4.32Å; W1575-A1589 HydrophobicContact CH2-CB 3.55Å; W1575-A1589 VanDerWaalsContact CH2-CB 3.48Å; W1575-A1589 HydrophobicContact CZ2-CB 4.28Å; W1575-A1589 HydrophobicContact CZ3-CB 3.94Å; V1585-A1589 HydrophobicContact CG1-CB 4.23Å; A1589-Q1613 CarbonylContact O-C 3.27Å; A1589-Q1613 WeakPolarHBondContact O-CA 3.28Å; A1589-Q1613 PolarHBondContact O-OE1 2.67Å; A1589-L1614 PolarHBondContact N-O 2.97Å; A1589-L1614 PolarHBondContact O-N 3.1Å
1590	E	91.3	Very high	90.1	Very high	53.4 Å²	53.4	28.8 Å²	28.8	25%	0.25	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	133.6	172.6	-71.5	-172.1	-179.9	0	0	111	Q1389 V1611 Q1613 Q2041	Q1389-E1590 VanDerWaalsContact NE2-CD 3.31Å; Q1389-E1590 PolarHBondContact NE2-OE2 3.15Å; E1590-V1611 HydrophobicContact CB-CG1 4.33Å; E1590-V1611 HydrophobicContact CG-CG1 4.37Å; E1590-Q1613 VanDerWaalsContact CG-CD 3.44Å; E1590-Q1613 HydrophobicContact CG-CG 3.8Å; E1590-Q1613 PolarHBondContact OE1-NE2 2.78Å; E1590-Q1613 VanDerWaalsContact OE1-NE2 3.13Å; E1590-Q2041 VanDerWaalsContact OE1-CG 3.3Å; E1590-Q2041 WeakPolarHBondContact OE1-CG 3.33Å; E1590-Q2041 PolarHBondContact OE1-NE2 3Å
1591	A	93.4	Very high	89.5	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	117.8	176.1	0	0	0	0	0	109.4	D1553 I1554 V1611 V1612 L1614	D1553-A1591 CarbonylContact O-C 3.53Å; D1553-A1591 VanDerWaalsContact O-CA 3.26Å; D1553-A1591 WeakPolarHBondContact O-CA 3.35Å; I1554-A1591 HydrophobicContact CB-CB 4.07Å; I1554-A1591 HydrophobicContact CD1-CB 4Å; I1554-A1591 HydrophobicContact CG1-CB 4.16Å; A1591-V1611 WeakPolarHBondContact O-CA 3.38Å; A1591-V1612 HydrophobicContact CB-CG1 4.01Å; A1591-V1612 HydrophobicContact CB-CG2 4.13Å; A1591-V1612 PolarHBondContact N-O 2.84Å; A1591-V1612 PolarHBondContact O-N 2.98Å; A1591-L1614 HydrophobicContact CB-CD1 4.38Å
1592	K	93.4	Very high	89	Confident	74.4 Å²	74.4	36.5 Å²	36.5	32%	0.323	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	115.1	172.1	-178.6	-177.1	176.4	-177.7	0	109	I1552 D1553 Y1609 V1611 L1980	I1552-K1592 WeakPolarHBondContact CA-O 3.23Å; D1553-K1592 HydrophobicContact CB-CB 4.42Å; D1553-K1592 PolarHBondContact N-O 3.09Å; D1553-K1592 PolarHBondContact O-N 3.17Å; K1592-Y1609 VanDerWaalsContact CE-CD1 3.42Å; K1592-V1611 HydrophobicContact CB-CG2 4.25Å; K1592-V1611 HydrophobicContact CG-CG2 4.43Å; K1592-L1980 HydrophobicContact CD-CD1 4.24Å; K1592-L1980 HydrophobicContact CG-CD1 4.44Å
1593	V	94.7	Very high	88.2	Confident	1.2 Å²	1.2	33.4 Å²	33.4	1%	0.007	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	122	173.9	179.3	0	0	0	0	108.5	I1477 I1530 I1532 L1550 I1552 V1595 Y1609 R1610	I1477-V1593 HydrophobicContact CD1-CB 3.8Å; I1477-V1593 HydrophobicContact CD1-CG1 4.21Å; I1477-V1593 HydrophobicContact CD1-CG2 3.66Å; I1530-V1593 HydrophobicContact CD1-CG2 3.76Å; I1532-V1593 HydrophobicContact CD1-CG1 3.93Å; I1532-V1593 HydrophobicContact CD1-CG2 4.24Å; I1532-V1593 HydrophobicContact CG1-CG1 4.41Å; I1532-V1593 HydrophobicContact CG2-CG1 4.11Å; L1550-V1593 HydrophobicContact CD1-CG1 3.84Å; I1552-V1593 HydrophobicContact CG1-CG1 4.46Å; I1552-V1593 HydrophobicContact CG1-CG2 4.36Å; I1552-V1593 HydrophobicContact CG2-CG2 4.37Å; V1593-V1595 HydrophobicContact CG1-CG2 4.22Å; V1593-Y1609 CarbonylContact O-C 3.53Å; V1593-Y1609 WeakPolarHBondContact O-CA 3.3Å; V1593-R1610 HydrophobicContact CB-CB 4.42Å; V1593-R1610 PolarHBondContact N-O 3.14Å; V1593-R1610 PolarHBondContact O-N 3.06Å
1594	S	94	Very high	87.8	Confident	8.4 Å²	8.4	33.4 Å²	33.4	6%	0.059	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	128	178.5	-43.7	0	0	0	0	109.4	V1551 E1608 Y1609	V1551-S1594 PolarHBondContact N-O 2.93Å; V1551-S1594 PolarHBondContact O-N 2.92Å; S1594-E1608 CarbonylContact C-O 3.58Å; S1594-E1608 WeakPolarHBondContact CA-O 3.39Å; S1594-Y1609 VanDerWaalsContact OG-CD1 3.29Å; S1594-Y1609 WeakPolarHBondContact OG-CD1 3.31Å; S1594-Y1609 WeakPolarHBondContact OG-CE1 3.01Å
1595	V	94.4	Very high	87.6	Confident	0.4 Å²	0.4	31 Å²	31	0%	0.002	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	112.3	-176.9	-176.4	0	0	0	0	109.4	P1475 L1534 I1548 H1549 L1550 V1593 Y1597 W1607 E1608	P1475-V1595 HydrophobicContact CB-CB 4.42Å; P1475-V1595 HydrophobicContact CB-CG2 3.9Å; P1475-V1595 HydrophobicContact CG-CB 4.26Å; P1475-V1595 HydrophobicContact CG-CG2 4.19Å; L1534-V1595 HydrophobicContact CD2-CB 4.26Å; L1534-V1595 HydrophobicContact CD2-CG1 3.64Å; L1534-V1595 HydrophobicContact CD2-CG2 3.54Å; L1534-V1595 VanDerWaalsContact CD2-CG2 3.48Å; I1548-V1595 HydrophobicContact CG2-CG1 3.83Å; H1549-V1595 CarbonylContact O-C 3.56Å; H1549-V1595 VanDerWaalsContact O-CA 3.29Å; H1549-V1595 WeakPolarHBondContact O-CA 3.35Å; L1550-V1595 HydrophobicContact CD1-CG2 4.05Å; V1593-V1595 HydrophobicContact CG1-CG2 4.22Å; V1595-Y1597 HydrophobicContact CB-CE2 4.28Å; V1595-Y1597 HydrophobicContact CG1-CD2 4.32Å; V1595-Y1597 HydrophobicContact CG1-CE1 4.19Å; V1595-Y1597 HydrophobicContact CG1-CE2 3.73Å; V1595-W1607 VanDerWaalsContact C-CE3 3.48Å; V1595-W1607 CarbonylContact O-C 3.47Å; V1595-W1607 WeakPolarHBondContact O-CA 3.38Å; V1595-E1608 PolarHBondContact N-O 3.11Å; V1595-E1608 PolarHBondContact O-N 3.23Å
1596	G	92.7	Very high	87.5	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	121.5	179.9	0	0	0	0	0	111.3	I1548 H1549 F1606 W1607	I1548-G1596 CarbonylContact C-O 3.54Å; I1548-G1596 WeakPolarHBondContact CA-O 3.4Å; H1549-G1596 PolarHBondContact N-O 3Å; H1549-G1596 PolarHBondContact O-N 3.28Å; G1596-F1606 CarbonylContact C-O 3.49Å; G1596-F1606 WeakPolarHBondContact CA-O 3.3Å; G1596-W1607 VanDerWaalsContact CA-CE3 3.46Å; G1596-W1607 VanDerWaalsContact N-CE3 3.26Å; G1596-W1607 VanDerWaalsContact N-CZ3 3.32Å
1597	Y	91.2	Very high	87.6	Confident	0.2 Å²	0.2	29.7 Å²	29.7	0%	0.001	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	124.2	175.9	-59.2	-89.6	0	0	0	110	H1467 T1469 L1472 G1474 P1475 L1534 L1535 L1545 I1548 V1595 F1606 E1608	H1467-Y1597 AromaticContact CE1-CD2 3.29Å; H1467-Y1597 VanDerWaalsContact CE1-CD2 3.44Å; H1467-Y1597 WeakPolarHBondContact CE1-CD2 3.27Å; H1467-Y1597 AromaticContact CE1-CE2 3.8Å; H1467-Y1597 AromaticContact CE1-CG 3.68Å; H1467-Y1597 AromaticContact ND1-CD2 3.95Å; H1467-Y1597 AromaticContact ND1-CG 3.96Å; H1467-Y1597 AromaticContact NE2-CD2 3.85Å; T1469-Y1597 HydrophobicContact CG2-CD2 4.16Å; L1472-Y1597 HydrophobicContact CD1-CD1 3.93Å; L1472-Y1597 VanDerWaalsContact CD1-CD1 3.42Å; L1472-Y1597 HydrophobicContact CD1-CD2 3.78Å; L1472-Y1597 HydrophobicContact CD1-CE1 3.86Å; L1472-Y1597 VanDerWaalsContact CD1-CE1 3.47Å; L1472-Y1597 HydrophobicContact CD1-CE2 4.15Å; L1472-Y1597 HydrophobicContact CD1-CG 4.24Å; G1474-Y1597 PolarHBondContact O-OH 3.3Å; P1475-Y1597 WeakPolarHBondContact CD-OH 3.37Å; L1534-Y1597 PolarHBondContact O-OH 3.13Å; L1534-Y1597 VanDerWaalsContact O-OH 3.12Å; L1535-Y1597 HydrophobicContact CD2-CE1 4.21Å; L1545-Y1597 HydrophobicContact CD1-CD1 4.15Å; L1545-Y1597 HydrophobicContact CD1-CG 4.49Å; L1545-Y1597 HydrophobicContact CD2-CD1 4.26Å; I1548-Y1597 HydrophobicContact CD1-CD1 4.28Å; I1548-Y1597 HydrophobicContact CD1-CE1 4.2Å; I1548-Y1597 HydrophobicContact CG1-CD1 4.01Å; I1548-Y1597 HydrophobicContact CG1-CE1 4.34Å; I1548-Y1597 HydrophobicContact CG2-CE1 4.38Å; V1595-Y1597 HydrophobicContact CB-CE2 4.28Å; V1595-Y1597 HydrophobicContact CG1-CD2 4.32Å; V1595-Y1597 HydrophobicContact CG1-CE1 4.19Å; V1595-Y1597 HydrophobicContact CG1-CE2 3.73Å; Y1597-F1606 WeakPolarHBondContact CD2-O 3.33Å; Y1597-F1606 PolarHBondContact N-O 3.07Å; Y1597-F1606 PolarHBondContact O-N 3.15Å; Y1597-F1606 VanDerWaalsContact O-N 3.09Å; Y1597-E1608 HydrophobicContact CE2-CB 4.43Å; Y1597-E1608 HydrophobicContact CE2-CG 4.24Å
1598	V	88.5	Confident	87.7	Confident	7.8 Å²	7.8	29.8 Å²	29.8	5%	0.047	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	126.1	-177.2	-175.4	0	0	0	0	109.9	W1441 K1546 E1547 I1605	W1441-V1598 HydrophobicContact CH2-CG1 4.34Å; K1546-V1598 WeakPolarHBondContact CB-O 3.45Å; K1546-V1598 PolarHBondContact N-O 3.31Å; E1547-V1598 HydrophobicContact CB-CB 4.04Å; E1547-V1598 HydrophobicContact CB-CG2 4.26Å; E1547-V1598 HydrophobicContact CG-CB 3.65Å; E1547-V1598 HydrophobicContact CG-CG1 4.05Å; E1547-V1598 HydrophobicContact CG-CG2 4.07Å; E1547-V1598 PolarHBondContact N-O 3.08Å; E1547-V1598 PolarHBondContact O-N 3.17Å; E1547-V1598 VanDerWaalsContact O-N 3.08Å; V1598-I1605 HydrophobicContact CG2-CB 4.41Å; V1598-I1605 HydrophobicContact CG2-CD1 4.24Å; V1598-I1605 HydrophobicContact CG2-CG1 4.03Å; V1598-I1605 HydrophobicContact CG2-CG2 4.08Å
1599	Y	87.9	Confident	87.7	Confident	5 Å²	5	28.7 Å²	28.7	2%	0.02	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	143.3	-175	-66.3	-93.1	0	0	0	112	I1466 H1467 P1542 N1544 L1545 K1601 C1602 F1606	I1466-Y1599 HydrophobicContact CG2-CD1 3.89Å; I1466-Y1599 HydrophobicContact CG2-CD2 3.88Å; I1466-Y1599 HydrophobicContact CG2-CE1 4.2Å; I1466-Y1599 HydrophobicContact CG2-CE2 4.2Å; I1466-Y1599 HydrophobicContact CG2-CG 3.7Å; I1466-Y1599 VanDerWaalsContact O-CE1 3.29Å; I1466-Y1599 WeakPolarHBondContact O-CE1 3.32Å; I1466-Y1599 VanDerWaalsContact O-CZ 3.27Å; I1466-Y1599 PolarHBondContact O-OH 3.11Å; H1467-Y1599 WeakPolarHBondContact CA-OH 3.4Å; H1467-Y1599 HydrophobicContact CB-CD2 4.11Å; H1467-Y1599 HydrophobicContact CB-CE2 3.79Å; H1467-Y1599 WeakPolarHBondContact CE1-CB 3.46Å; H1467-Y1599 AromaticContact CE1-CD1 3.56Å; H1467-Y1599 AromaticContact CE1-CD2 3.71Å; H1467-Y1599 AromaticContact CE1-CG 3.25Å; H1467-Y1599 AromaticContact CG-CD2 3.6Å; H1467-Y1599 AromaticContact CG-CE2 3.64Å; H1467-Y1599 AromaticContact CG-CG 3.92Å; H1467-Y1599 AromaticContact CG-CZ 3.98Å; H1467-Y1599 AromaticContact ND1-CD1 3.24Å; H1467-Y1599 WeakPolarHBondContact ND1-CD1 3.44Å; H1467-Y1599 AromaticContact ND1-CD2 3.34Å; H1467-Y1599 VanDerWaalsContact ND1-CD2 3.34Å; H1467-Y1599 WeakPolarHBondContact ND1-CD2 3.43Å; H1467-Y1599 AromaticContact ND1-CE1 3.44Å; H1467-Y1599 WeakPolarHBondContact ND1-CE1 3.15Å; H1467-Y1599 AromaticContact ND1-CE2 3.67Å; H1467-Y1599 AromaticContact ND1-CG 3.17Å; H1467-Y1599 AromaticContact ND1-CZ 3.78Å; H1467-Y1599 PolarHBondContact ND1-OH 3.19Å; H1467-Y1599 AromaticContact NE2-CG 4Å; P1542-Y1599 HydrophobicContact CB-CE1 4.39Å; P1542-Y1599 HydrophobicContact CG-CE1 4.48Å; N1544-Y1599 HydrophobicContact CB-CD1 4.46Å; N1544-Y1599 VanDerWaalsContact ND2-CD1 3.35Å; N1544-Y1599 WeakPolarHBondContact ND2-CD1 3.36Å; N1544-Y1599 CarbonylContact O-C 3.51Å; N1544-Y1599 VanDerWaalsContact O-CA 3.25Å; N1544-Y1599 WeakPolarHBondContact O-CA 3.4Å; L1545-Y1599 HydrophobicContact CB-CD1 4.12Å; L1545-Y1599 HydrophobicContact CB-CE1 3.96Å; L1545-Y1599 HydrophobicContact CD1-CD1 4.11Å; L1545-Y1599 HydrophobicContact CD1-CD2 4.4Å; L1545-Y1599 HydrophobicContact CD1-CE1 3.83Å; L1545-Y1599 HydrophobicContact CD1-CE2 4.13Å; L1545-Y1599 HydrophobicContact CD1-CG 4.4Å; L1545-Y1599 HydrophobicContact CG-CE1 4.42Å; Y1599-K1601 PolarHBondContact O-N 3.27Å; Y1599-C1602 PolarHBondContact O-N 3.26Å; Y1599-C1602 VanDerWaalsContact O-N 3.12Å; Y1599-C1602 VanDerWaalsContact O-O 3.05Å; Y1599-F1606 AromaticContact CD2-CD2 3.74Å; Y1599-F1606 HydrophobicContact CD2-CD2 3.74Å; Y1599-F1606 AromaticContact CD2-CE2 3.88Å; Y1599-F1606 HydrophobicContact CD2-CE2 3.91Å; Y1599-F1606 AromaticContact CE2-CD2 3.77Å; Y1599-F1606 HydrophobicContact CE2-CD2 3.77Å; Y1599-F1606 HydrophobicContact CE2-CE2 4.21Å; Y1599-F1606 HydrophobicContact CE2-CG 4.33Å
1600	T	83.6	Confident	87.7	Confident	70.6 Å²	70.6	29.1 Å²	29.1	43%	0.433	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	131.8	175.4	59.6	0	0	0	0	110.7	N1544 K1546 C1602	N1544-T1600 WeakPolarHBondContact CA-OG1 3.42Å; N1544-T1600 WeakPolarHBondContact CB-OG1 3.28Å; N1544-T1600 PolarHBondContact O-N 2.86Å; N1544-T1600 PolarHBondContact O-OG1 3.11Å; K1546-T1600 HydrophobicContact CB-CG2 4.02Å; K1546-T1600 HydrophobicContact CG-CG2 4.31Å; T1600-C1602 PolarHBondContact O-N 3.13Å; T1600-C1602 VanDerWaalsContact O-N 3.08Å
1601	K	77.6	Confident	87.6	Confident	178.8 Å²	178.8	27.6 Å²	27.6	78%	0.777	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.4	5.6	-177	-51.9	179	-179.9	-179.7	0	115.7	V1460 Y1599	V1460-K1601 WeakPolarHBondContact CG1-O 3.36Å; Y1599-K1601 PolarHBondContact O-N 3.27Å
1602	C	77.9	Confident	87.4	Confident	6.6 Å²	6.6	28.1 Å²	28.1	5%	0.045	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	110.7	172	177.3	0	0	0	0	109.3	C1461 Y1599 T1600 R1604	C1461-C1602 HydrophobicContact CB-CB 4.25Å; C1461-C1602 WeakPolarHBondContact CB-SG 3.35Å; C1461-C1602 VanDerWaalsContact SG-CA 3.54Å; C1461-C1602 WeakPolarHBondContact SG-CA 3.38Å; C1461-C1602 WeakPolarHBondContact SG-CB 3.36Å; C1461-C1602 CovalentContact SG-SG 2.05Å; C1461-C1602 PolarHBondContact SG-SG 3.02Å; Y1599-C1602 PolarHBondContact O-N 3.26Å; Y1599-C1602 VanDerWaalsContact O-N 3.12Å; Y1599-C1602 VanDerWaalsContact O-O 3.05Å; T1600-C1602 PolarHBondContact O-N 3.13Å; T1600-C1602 VanDerWaalsContact O-N 3.08Å; C1602-R1604 PolarHBondContact O-N 2.99Å; C1602-R1604 VanDerWaalsContact O-N 3.15Å
1603	P	72.3	Confident	87.2	Confident	42.2 Å²	42.2	27.7 Å²	27.7	27%	0.274	13%	0.134	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	-4.8	-178.2	28.2	-35.4	0	0	0	114.3	F1446 M1447 V1457 C1461	F1446-P1603 HydrophobicContact CD1-CB 4.28Å; F1446-P1603 HydrophobicContact CE1-CB 4.25Å; M1447-P1603 HydrophobicContact CE-CB 3.75Å; M1447-P1603 HydrophobicContact CE-CG 4.15Å; M1447-P1603 HydrophobicContact SD-CB 3.31Å; M1447-P1603 WeakPolarHBondContact SD-CB 3.37Å; M1447-P1603 HydrophobicContact SD-CG 4.04Å; V1457-P1603 HydrophobicContact CG1-CG 3.84Å; C1461-P1603 VanDerWaalsContact SG-CD 3.57Å
1604	R	77.6	Confident	87	Confident	60.4 Å²	60.4	27.8 Å²	27.8	23%	0.228	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	134.2	-179.3	-169.9	179	-166.3	162.3	5	110.9	T1418 T1419 C1602 F1606 V1998	T1418-R1604 VanDerWaalsContact CB-CZ 3.42Å; T1418-R1604 HydrophobicContact CG2-CB 3.91Å; T1418-R1604 HydrophobicContact CG2-CG 3.63Å; T1418-R1604 VanDerWaalsContact CG2-CZ 3.44Å; T1418-R1604 PolarHBondContact O-NH1 2.54Å; T1418-R1604 VanDerWaalsContact O-NH1 3.13Å; T1419-R1604 HydrophobicContact CG2-CG 4.25Å; T1419-R1604 VanDerWaalsContact CG2-NE 3.31Å; T1419-R1604 VanDerWaalsContact OG1-CZ 3.28Å; T1419-R1604 PolarHBondContact OG1-NH1 2.84Å; T1419-R1604 PolarHBondContact OG1-NH2 3.05Å; C1602-R1604 PolarHBondContact O-N 2.99Å; C1602-R1604 VanDerWaalsContact O-N 3.15Å; R1604-F1606 HydrophobicContact CB-CD2 4.43Å; R1604-F1606 HydrophobicContact CB-CE2 4.01Å; R1604-F1606 HydrophobicContact CB-CZ 4.34Å; R1604-F1606 HydrophobicContact CG-CD2 4.23Å; R1604-F1606 HydrophobicContact CG-CE1 4.45Å; R1604-F1606 HydrophobicContact CG-CE2 4.11Å; R1604-F1606 HydrophobicContact CG-CG 4.47Å; R1604-F1606 HydrophobicContact CG-CZ 4.23Å; R1604-V1998 VanDerWaalsContact NE-CG1 3.33Å; R1604-V1998 PolarHBondContact NH1-O 3.3Å; R1604-V1998 VanDerWaalsContact NH1-O 3.16Å; R1604-V1998 VanDerWaalsContact NH2-CG1 3.26Å; R1604-V1998 PolarHBondContact NH2-O 3.26Å
1605	I	84.2	Confident	86.8	Confident	14.8 Å²	14.8	29.2 Å²	29.2	8%	0.076	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	126.5	169.4	-48.7	-175.6	0	0	0	108.8	P1433 W1441 V1598 W1607	P1433-I1605 HydrophobicContact CB-CD1 4.25Å; W1441-I1605 HydrophobicContact CD2-CD1 4.4Å; W1441-I1605 HydrophobicContact CH2-CD1 4.08Å; W1441-I1605 HydrophobicContact CH2-CG1 4.12Å; W1441-I1605 HydrophobicContact CZ2-CD1 3.86Å; W1441-I1605 HydrophobicContact CZ2-CG1 4.3Å; W1441-I1605 HydrophobicContact CZ3-CD1 4.43Å; W1441-I1605 HydrophobicContact CZ3-CG1 4.37Å; V1598-I1605 HydrophobicContact CG2-CB 4.41Å; V1598-I1605 HydrophobicContact CG2-CD1 4.24Å; V1598-I1605 HydrophobicContact CG2-CG1 4.03Å; V1598-I1605 HydrophobicContact CG2-CG2 4.08Å; I1605-W1607 HydrophobicContact CB-CZ2 4.47Å; I1605-W1607 HydrophobicContact CD1-CZ2 4.21Å; I1605-W1607 HydrophobicContact CG2-CD2 4.14Å; I1605-W1607 HydrophobicContact CG2-CG 4.35Å; I1605-W1607 HydrophobicContact CG2-CH2 4.43Å; I1605-W1607 HydrophobicContact CG2-CZ2 4Å; I1605-W1607 PolarHBondContact O-N 2.88Å
1606	F	87.6	Confident	86.6	Confident	10 Å²	10	29.5 Å²	29.5	4%	0.044	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	102.7	176.3	-64.4	-88.1	0	0	0	109.7	I1466 H1467 T1469 G1596 Y1597 Y1599 R1604 V1998 N1999	I1466-F1606 HydrophobicContact CG2-CE2 4.2Å; I1466-F1606 HydrophobicContact CG2-CZ 4.06Å; H1467-F1606 HydrophobicContact CB-CB 4.22Å; H1467-F1606 HydrophobicContact CB-CD1 3.66Å; H1467-F1606 VanDerWaalsContact CB-CD1 3.45Å; H1467-F1606 HydrophobicContact CB-CD2 3.99Å; H1467-F1606 HydrophobicContact CB-CE1 4.02Å; H1467-F1606 HydrophobicContact CB-CE2 4.09Å; H1467-F1606 HydrophobicContact CB-CG 3.67Å; H1467-F1606 HydrophobicContact CB-CZ 4.1Å; H1467-F1606 VanDerWaalsContact CD2-CB 3.43Å; H1467-F1606 WeakPolarHBondContact CD2-CB 3.36Å; H1467-F1606 AromaticContact CD2-CD1 3.85Å; H1467-F1606 AromaticContact CD2-CE2 3.32Å; H1467-F1606 WeakPolarHBondContact CD2-CE2 3.42Å; H1467-F1606 AromaticContact CD2-CG 3.75Å; H1467-F1606 AromaticContact CD2-CZ 3.41Å; H1467-F1606 VanDerWaalsContact CD2-CZ 3.41Å; H1467-F1606 WeakPolarHBondContact CD2-CZ 3.43Å; H1467-F1606 AromaticContact CG-CD1 3.87Å; H1467-F1606 AromaticContact CG-CE2 3.72Å; H1467-F1606 AromaticContact CG-CG 3.66Å; H1467-F1606 AromaticContact CG-CZ 4Å; H1467-F1606 WeakPolarHBondContact ND1-CB 3.32Å; H1467-F1606 AromaticContact ND1-CG 3.88Å; T1469-F1606 HydrophobicContact CG2-CB 4.15Å; G1596-F1606 CarbonylContact C-O 3.49Å; G1596-F1606 WeakPolarHBondContact CA-O 3.3Å; Y1597-F1606 WeakPolarHBondContact CD2-O 3.33Å; Y1597-F1606 PolarHBondContact N-O 3.07Å; Y1597-F1606 PolarHBondContact O-N 3.15Å; Y1597-F1606 VanDerWaalsContact O-N 3.09Å; Y1599-F1606 AromaticContact CD2-CD2 3.74Å; Y1599-F1606 HydrophobicContact CD2-CD2 3.74Å; Y1599-F1606 AromaticContact CD2-CE2 3.88Å; Y1599-F1606 HydrophobicContact CD2-CE2 3.91Å; Y1599-F1606 AromaticContact CE2-CD2 3.77Å; Y1599-F1606 HydrophobicContact CE2-CD2 3.77Å; Y1599-F1606 HydrophobicContact CE2-CE2 4.21Å; Y1599-F1606 HydrophobicContact CE2-CG 4.33Å; R1604-F1606 HydrophobicContact CB-CD2 4.43Å; R1604-F1606 HydrophobicContact CB-CE2 4.01Å; R1604-F1606 HydrophobicContact CB-CZ 4.34Å; R1604-F1606 HydrophobicContact CG-CD2 4.23Å; R1604-F1606 HydrophobicContact CG-CE1 4.45Å; R1604-F1606 HydrophobicContact CG-CE2 4.11Å; R1604-F1606 HydrophobicContact CG-CG 4.47Å; R1604-F1606 HydrophobicContact CG-CZ 4.23Å; F1606-V1998 HydrophobicContact CD1-CG1 4.24Å; F1606-V1998 HydrophobicContact CE1-CG1 4.49Å; F1606-N1999 HydrophobicContact CD1-CB 3.84Å; F1606-N1999 HydrophobicContact CE1-CB 3.82Å
1607	W	88.8	Confident	86.4	Confident	31 Å²	31	30.7 Å²	30.7	12%	0.117	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	129.5	-177	-70.4	103.8	0	0	0	112.8	P1433 H1549 V1551 V1595 G1596 I1605 Y1609 H1996	P1433-W1607 WeakPolarHBondContact O-CZ2 3.22Å; P1433-W1607 PolarHBondContact O-NE1 2.7Å; H1549-W1607 HydrophobicContact CB-CH2 3.84Å; H1549-W1607 HydrophobicContact CB-CZ2 4.45Å; H1549-W1607 HydrophobicContact CB-CZ3 4.36Å; V1551-W1607 HydrophobicContact CG2-CH2 3.77Å; V1551-W1607 HydrophobicContact CG2-CZ3 4.03Å; V1595-W1607 VanDerWaalsContact C-CE3 3.48Å; V1595-W1607 CarbonylContact O-C 3.47Å; V1595-W1607 WeakPolarHBondContact O-CA 3.38Å; G1596-W1607 VanDerWaalsContact CA-CE3 3.46Å; G1596-W1607 VanDerWaalsContact N-CE3 3.26Å; G1596-W1607 VanDerWaalsContact N-CZ3 3.32Å; I1605-W1607 HydrophobicContact CB-CZ2 4.47Å; I1605-W1607 HydrophobicContact CD1-CZ2 4.21Å; I1605-W1607 HydrophobicContact CG2-CD2 4.14Å; I1605-W1607 HydrophobicContact CG2-CG 4.35Å; I1605-W1607 HydrophobicContact CG2-CH2 4.43Å; I1605-W1607 HydrophobicContact CG2-CZ2 4Å; I1605-W1607 PolarHBondContact O-N 2.88Å; W1607-Y1609 HydrophobicContact CB-CD2 4.43Å; W1607-Y1609 HydrophobicContact CB-CE1 4.24Å; W1607-Y1609 HydrophobicContact CB-CE2 3.87Å; W1607-Y1609 VanDerWaalsContact CB-CZ 3.47Å; W1607-Y1609 WeakPolarHBondContact CB-OH 3.31Å; W1607-H1996 PolarHBondContact O-NE2 3.19Å; W1607-H1996 VanDerWaalsContact O-NE2 3.09Å
1608	E	89.7	Confident	86.1	Confident	3 Å²	3	31.7 Å²	31.7	1%	0.014	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	134.9	166.9	-80.8	-80.1	158.6	0	0	110.1	T1469 P1475 S1594 V1595 Y1597 R1610 R1994 H1996	T1469-E1608 WeakPolarHBondContact CB-OE1 3.44Å; T1469-E1608 VanDerWaalsContact CG2-CD 3.48Å; T1469-E1608 HydrophobicContact CG2-CG 3.8Å; T1469-E1608 WeakPolarHBondContact CG2-OE1 3.34Å; T1469-E1608 PolarHBondContact OG1-OE1 3.24Å; P1475-E1608 VanDerWaalsContact CD-CB 3.49Å; P1475-E1608 HydrophobicContact CG-CB 3.73Å; P1475-E1608 HydrophobicContact CG-CG 4.38Å; S1594-E1608 CarbonylContact C-O 3.58Å; S1594-E1608 WeakPolarHBondContact CA-O 3.39Å; V1595-E1608 PolarHBondContact N-O 3.11Å; V1595-E1608 PolarHBondContact O-N 3.23Å; Y1597-E1608 HydrophobicContact CE2-CB 4.43Å; Y1597-E1608 HydrophobicContact CE2-CG 4.24Å; E1608-R1610 IonicContact OE2-CZ 3.26Å; E1608-R1610 VanDerWaalsContact OE2-CZ 3.24Å; E1608-R1610 IonicContact OE2-NH1 3.58Å; E1608-R1610 PolarHBondContact OE2-NH1 3.06Å; E1608-R1610 VanDerWaalsContact OE2-NH1 3.11Å; E1608-R1610 IonicContact OE2-NH2 3.23Å; E1608-R1610 PolarHBondContact OE2-NH2 2.9Å; E1608-R1994 VanDerWaalsContact CD-NH1 3.35Å; E1608-R1994 IonicContact OE1-CZ 3.33Å; E1608-R1994 IonicContact OE1-NH1 3.06Å; E1608-R1994 PolarHBondContact OE1-NH1 2.91Å; E1608-R1994 IonicContact OE1-NH2 3.08Å; E1608-R1994 PolarHBondContact OE1-NH2 2.84Å; E1608-R1994 VanDerWaalsContact OE1-NH2 3.15Å; E1608-R1994 IonicContact OE2-CZ 3.25Å; E1608-R1994 IonicContact OE2-NH1 3.54Å; E1608-R1994 PolarHBondContact OE2-NH1 2.81Å; E1608-R1994 VanDerWaalsContact OE2-NH1 3.12Å; E1608-R1994 IonicContact OE2-NH2 3.36Å; E1608-R1994 PolarHBondContact OE2-NH2 3.23Å; E1608-H1996 IonicContact OE1-CD2 3.17Å; E1608-H1996 PolarHBondContact OE1-CD2 2.91Å; E1608-H1996 IonicContact OE1-NE2 3.06Å
1609	Y	90	Very high	85.8	Confident	26.2 Å²	26.2	32.2 Å²	32.2	10%	0.103	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	141.2	-174.9	-56.9	-76.1	0	0	0	111.8	K1592 V1593 S1594 W1607 L1980 Q1982	K1592-Y1609 VanDerWaalsContact CE-CD1 3.42Å; V1593-Y1609 CarbonylContact O-C 3.53Å; V1593-Y1609 WeakPolarHBondContact O-CA 3.3Å; S1594-Y1609 VanDerWaalsContact OG-CD1 3.29Å; S1594-Y1609 WeakPolarHBondContact OG-CD1 3.31Å; S1594-Y1609 WeakPolarHBondContact OG-CE1 3.01Å; W1607-Y1609 HydrophobicContact CB-CD2 4.43Å; W1607-Y1609 HydrophobicContact CB-CE1 4.24Å; W1607-Y1609 HydrophobicContact CB-CE2 3.87Å; W1607-Y1609 VanDerWaalsContact CB-CZ 3.47Å; W1607-Y1609 WeakPolarHBondContact CB-OH 3.31Å; Y1609-L1980 WeakPolarHBondContact CB-O 3.29Å; Y1609-L1980 VanDerWaalsContact CD2-O 3.24Å; Y1609-L1980 WeakPolarHBondContact CD2-O 3.22Å; Y1609-Q1982 HydrophobicContact CE2-CG 4.4Å
1610	R	89.7	Confident	85	Confident	17.6 Å²	17.6	34.7 Å²	34.7	7%	0.066	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	147.8	173.7	-60.9	-67.7	179.7	-86	-6.6	109.4	P1475 I1477 V1593 E1608 S2057	P1475-R1610 HydrophobicContact CG-CG 4.31Å; P1475-R1610 PolarHBondContact O-NE 3.04Å; P1475-R1610 PolarHBondContact O-NH2 3.03Å; P1475-R1610 VanDerWaalsContact O-NH2 3.09Å; I1477-R1610 HydrophobicContact CD1-CB 3.57Å; I1477-R1610 VanDerWaalsContact CD1-CB 3.48Å; I1477-R1610 HydrophobicContact CD1-CG 4.34Å; I1477-R1610 HydrophobicContact CG1-CB 4.23Å; V1593-R1610 HydrophobicContact CB-CB 4.42Å; V1593-R1610 PolarHBondContact N-O 3.14Å; V1593-R1610 PolarHBondContact O-N 3.06Å; E1608-R1610 IonicContact OE2-CZ 3.26Å; E1608-R1610 VanDerWaalsContact OE2-CZ 3.24Å; E1608-R1610 IonicContact OE2-NH1 3.58Å; E1608-R1610 PolarHBondContact OE2-NH1 3.06Å; E1608-R1610 VanDerWaalsContact OE2-NH1 3.11Å; E1608-R1610 IonicContact OE2-NH2 3.23Å; E1608-R1610 PolarHBondContact OE2-NH2 2.9Å; R1610-S2057 WeakPolarHBondContact CD-O 3.36Å
1611	V	89.9	Confident	84.2	Confident	21.2 Å²	21.2	32.1 Å²	32.1	13%	0.128	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	138.8	172.3	172.8	0	0	0	0	109.7	E1590 A1591 K1592 L1980 Q2041 N2058	E1590-V1611 HydrophobicContact CB-CG1 4.33Å; E1590-V1611 HydrophobicContact CG-CG1 4.37Å; A1591-V1611 WeakPolarHBondContact O-CA 3.38Å; K1592-V1611 HydrophobicContact CB-CG2 4.25Å; K1592-V1611 HydrophobicContact CG-CG2 4.43Å; V1611-L1980 HydrophobicContact CB-CD2 4.15Å; V1611-L1980 HydrophobicContact CG2-CD1 3.93Å; V1611-L1980 HydrophobicContact CG2-CD2 3.53Å; V1611-L1980 VanDerWaalsContact CG2-CD2 3.48Å; V1611-L1980 HydrophobicContact CG2-CG 4.3Å; V1611-Q2041 HydrophobicContact CG1-CB 4.34Å; V1611-Q2041 HydrophobicContact CG1-CG 4.41Å; V1611-N2058 WeakPolarHBondContact O-CB 3.43Å
1612	V	90.2	Very high	83.4	Confident	10.6 Å²	10.6	24.9 Å²	24.9	6%	0.064	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	148.2	176.5	51.8	0	0	0	0	109.8	I1477 I1530 A1591 N2058	I1477-V1612 HydrophobicContact CB-CG1 4.09Å; I1477-V1612 HydrophobicContact CD1-CB 4.2Å; I1477-V1612 HydrophobicContact CD1-CG1 4Å; I1477-V1612 HydrophobicContact CD1-CG2 4.48Å; I1477-V1612 HydrophobicContact CG2-CB 4.35Å; I1477-V1612 HydrophobicContact CG2-CG1 4.19Å; I1477-V1612 HydrophobicContact CG2-CG2 4.31Å; I1530-V1612 HydrophobicContact CD1-CG1 3.95Å; I1530-V1612 HydrophobicContact CD1-CG2 4.05Å; I1530-V1612 HydrophobicContact CG2-CG1 4.11Å; I1530-V1612 HydrophobicContact CG2-CG2 4.32Å; A1591-V1612 HydrophobicContact CB-CG1 4.01Å; A1591-V1612 HydrophobicContact CB-CG2 4.13Å; A1591-V1612 PolarHBondContact N-O 2.84Å; A1591-V1612 PolarHBondContact O-N 2.98Å; V1612-N2058 HydrophobicContact CB-CB 4.33Å; V1612-N2058 HydrophobicContact CG2-CB 4.45Å
1613	Q	89.2	Confident	83.2	Confident	66.2 Å²	66.2	27.9 Å²	27.9	31%	0.309	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	134.7	175.4	-69.8	-166.3	-8.8	0	0	110.6	L1482 A1589 E1590	L1482-Q1613 HydrophobicContact CD1-CB 4.16Å; L1482-Q1613 WeakPolarHBondContact CD1-O 3.39Å; A1589-Q1613 CarbonylContact O-C 3.27Å; A1589-Q1613 WeakPolarHBondContact O-CA 3.28Å; A1589-Q1613 PolarHBondContact O-OE1 2.67Å; E1590-Q1613 VanDerWaalsContact CG-CD 3.44Å; E1590-Q1613 HydrophobicContact CG-CG 3.8Å; E1590-Q1613 PolarHBondContact OE1-NE2 2.78Å; E1590-Q1613 VanDerWaalsContact OE1-NE2 3.13Å
1614	L	90.3	Very high	83.7	Confident	2.6 Å²	2.6	27.3 Å²	27.3	1%	0.014	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	139	175.1	-79	-179.6	0	0	0	111	P1528 I1530 I1554 F1573 W1575 A1589 A1591 G1616	P1528-L1614 HydrophobicContact CB-CD2 4.32Å; I1530-L1614 HydrophobicContact CG2-CD1 4.28Å; I1530-L1614 HydrophobicContact CG2-CD2 3.73Å; I1530-L1614 HydrophobicContact CG2-CG 4.25Å; I1554-L1614 HydrophobicContact CD1-CB 4.3Å; I1554-L1614 HydrophobicContact CD1-CD1 3.93Å; F1573-L1614 HydrophobicContact CE1-CD1 4.41Å; W1575-L1614 HydrophobicContact CB-CD1 4.4Å; W1575-L1614 HydrophobicContact CE3-CB 4.25Å; W1575-L1614 HydrophobicContact CZ3-CB 4.44Å; A1589-L1614 PolarHBondContact N-O 2.97Å; A1589-L1614 PolarHBondContact O-N 3.1Å; A1591-L1614 HydrophobicContact CB-CD1 4.38Å; L1614-G1616 PolarHBondContact O-N 3.48Å
1615	P	89	Confident	83.9	Confident	38.6 Å²	38.6	26.1 Å²	26.1	25%	0.251	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	128.4	177.4	30.4	-32.9	0	0	0	111.3	L1482 P1528 G1587 L1588	L1482-P1615 HydrophobicContact CD2-CB 4.27Å; L1482-P1615 HydrophobicContact CD2-CG 4.16Å; P1528-P1615 HydrophobicContact CB-CG 4.16Å; P1528-P1615 VanDerWaalsContact CG-O 3.3Å; P1528-P1615 WeakPolarHBondContact CG-O 3.36Å; G1587-P1615 CarbonylContact O-C 3.53Å; G1587-P1615 WeakPolarHBondContact O-CA 3.46Å; L1588-P1615 HydrophobicContact CD2-CB 4.29Å
1616	G	90.2	Very high	83.9	Confident	5.8 Å²	5.8	28.4 Å²	28.4	6%	0.06	16%	0.155	C	C	.	.			trans	-81.1	-146.9	172.6	0	0	0	0	0	112.6	K1577 V1585 G1587 L1614	K1577-G1616 VanDerWaalsContact CD-O 3.27Å; K1577-G1616 WeakPolarHBondContact CD-O 3.37Å; K1577-G1616 WeakPolarHBondContact CE-O 3.45Å; K1577-G1616 PolarHBondContact NZ-O 3.03Å; V1585-G1616 WeakPolarHBondContact O-CA 3Å; G1587-G1616 PolarHBondContact O-N 2.96Å; L1614-G1616 PolarHBondContact O-N 3.48Å
1617	N	88.6	Confident	83.9	Confident	26 Å²	26	29.2 Å²	29.2	14%	0.139	16%	0.158	C	C	.	.	B	Isolated β-bridge	trans	-75.8	147	173.6	-64.5	-63.9	0	0	0	111	K1577 S1584 V1585 Y1586 G1587	K1577-N1617 WeakPolarHBondContact CB-ND2 3.37Å; K1577-N1617 VanDerWaalsContact CD-OD1 3.23Å; K1577-N1617 WeakPolarHBondContact CD-OD1 3.34Å; K1577-N1617 PolarHBondContact O-ND2 3.13Å; K1577-N1617 VanDerWaalsContact O-ND2 3.13Å; S1584-N1617 WeakPolarHBondContact CB-ND2 3.42Å; V1585-N1617 WeakPolarHBondContact O-CB 3.33Å; V1585-N1617 PolarHBondContact O-N 3.01Å; V1585-N1617 PolarHBondContact O-ND2 3.1Å; Y1586-N1617 WeakPolarHBondContact CA-O 3.36Å; Y1586-N1617 HydrophobicContact CD1-CB 3.7Å; Y1586-N1617 WeakPolarHBondContact CD1-O 3.34Å; Y1586-N1617 HydrophobicContact CE1-CB 3.56Å; Y1586-N1617 VanDerWaalsContact CE1-CB 3.46Å; Y1586-N1617 HydrophobicContact CG-CB 4.36Å; G1587-N1617 PolarHBondContact N-O 3.11Å
1618	E	85.3	Confident	84	Confident	21.4 Å²	21.4	27.9 Å²	27.9	10%	0.1	15%	0.153	C	C	.	.	P	Polyproline II helix	trans	-85	150.2	174.5	-74.7	177.9	-161.4	0	0	110	R1519 R1522 Y1586 I1620 Y1643 H1649	R1519-E1618 IonicContact CZ-OE1 3Å; R1519-E1618 IonicContact NH1-OE1 2.96Å; R1519-E1618 PolarHBondContact NH1-OE1 2.97Å; R1519-E1618 VanDerWaalsContact NH1-OE1 3.08Å; R1519-E1618 IonicContact NH1-OE2 2.77Å; R1519-E1618 PolarHBondContact NH1-OE2 2.81Å; R1519-E1618 VanDerWaalsContact NH1-OE2 3.13Å; R1519-E1618 IonicContact NH2-OE1 3.51Å; R1519-E1618 PolarHBondContact NH2-OE1 2.5Å; R1519-E1618 IonicContact NH2-OE2 3.36Å; R1522-E1618 IonicContact CZ-OE2 3.28Å; R1522-E1618 IonicContact NE-OE1 3.73Å; R1522-E1618 IonicContact NE-OE2 3.19Å; R1522-E1618 PolarHBondContact NE-OE2 3.09Å; R1522-E1618 IonicContact NH2-OE2 3.44Å; R1522-E1618 PolarHBondContact NH2-OE2 3.12Å; R1522-E1618 VanDerWaalsContact NH2-OE2 3.14Å; Y1586-E1618 WeakPolarHBondContact CE1-O 3.37Å; E1618-I1620 HydrophobicContact CB-CD1 4.46Å; E1618-I1620 HydrophobicContact CB-CG1 4.12Å; E1618-I1620 HydrophobicContact CG-CG1 4.12Å; E1618-I1620 PolarHBondContact O-N 3.2Å; E1618-Y1643 HydrophobicContact CB-CD1 3.9Å; E1618-Y1643 HydrophobicContact CB-CE1 3.88Å; E1618-Y1643 HydrophobicContact CB-CG 4.33Å; E1618-Y1643 HydrophobicContact CG-CD1 3.7Å; E1618-Y1643 VanDerWaalsContact CG-CD1 3.48Å; E1618-Y1643 HydrophobicContact CG-CD2 3.97Å; E1618-Y1643 HydrophobicContact CG-CE1 3.69Å; E1618-Y1643 HydrophobicContact CG-CE2 4.33Å; E1618-Y1643 HydrophobicContact CG-CG 4.15Å; E1618-Y1643 WeakPolarHBondContact OE1-CB 3.42Å; E1618-H1649 VanDerWaalsContact CD-CE1 3.46Å; E1618-H1649 IonicContact OE1-CE1 3.02Å; E1618-H1649 PolarHBondContact OE1-CE1 3.03Å; E1618-H1649 VanDerWaalsContact OE1-CE1 3.26Å; E1618-H1649 IonicContact OE1-NE2 3.55Å; E1618-H1649 PolarHBondContact OE1-NE2 3.17Å; E1618-H1649 IonicContact OE2-CE1 3.54Å; E1618-H1649 IonicContact OE2-NE2 3.11Å; E1618-H1649 PolarHBondContact OE2-NE2 2.96Å
1619	L	81.3	Confident	84	Confident	17.8 Å²	17.8	28.3 Å²	28.3	9%	0.093	16%	0.155	C	C	.	.	P	Polyproline II helix	trans	-81.2	118.7	164.4	-63.6	179.4	0	0	0	108.2	L1289 D1290 Y1586 T1634 A1636 Y1643	L1289-L1619 HydrophobicContact CB-CD2 3.44Å; L1289-L1619 VanDerWaalsContact CB-CD2 3.46Å; L1289-L1619 HydrophobicContact CD1-CD2 4.34Å; L1289-L1619 HydrophobicContact CG-CD2 4.48Å; D1290-L1619 HydrophobicContact CB-CD1 3.97Å; Y1586-L1619 HydrophobicContact CD1-CD2 3.7Å; Y1586-L1619 VanDerWaalsContact CD1-CD2 3.49Å; Y1586-L1619 HydrophobicContact CD1-CG 4.17Å; Y1586-L1619 HydrophobicContact CE1-CD2 4.05Å; Y1586-L1619 HydrophobicContact CG-CD2 4.2Å; L1619-T1634 HydrophobicContact CB-CG2 4.01Å; L1619-T1634 HydrophobicContact CD1-CG2 4.08Å; L1619-A1636 HydrophobicContact CD1-CB 3.58Å; L1619-A1636 HydrophobicContact CG-CB 4.38Å; L1619-Y1643 HydrophobicContact CB-CD2 3.97Å; L1619-Y1643 HydrophobicContact CB-CE2 3.93Å; L1619-Y1643 HydrophobicContact CD1-CE2 4.48Å; L1619-Y1643 HydrophobicContact CG-CD2 4.29Å; L1619-Y1643 HydrophobicContact CG-CE2 4.1Å; L1619-Y1643 VanDerWaalsContact N-CE2 3.32Å
1620	I	72.7	Confident	83.9	Confident	57.4 Å²	57.4	28.9 Å²	28.9	29%	0.294	16%	0.16	S	C	.	.			trans	-109.4	130.4	-179.3	-49.7	172.1	0	0	0	108	R1522 E1618 S1622 N1626 T1634	R1522-I1620 HydrophobicContact CB-CD1 4.18Å; R1522-I1620 HydrophobicContact CG-CD1 4.22Å; E1618-I1620 HydrophobicContact CB-CD1 4.46Å; E1618-I1620 HydrophobicContact CB-CG1 4.12Å; E1618-I1620 HydrophobicContact CG-CG1 4.12Å; E1618-I1620 PolarHBondContact O-N 3.2Å; I1620-S1622 VanDerWaalsContact C-N 3.32Å; I1620-S1622 VanDerWaalsContact CG2-O 3.25Å; I1620-S1622 WeakPolarHBondContact CG2-O 3.29Å; I1620-S1622 WeakPolarHBondContact CG2-OG 3.24Å; I1620-S1622 PolarHBondContact O-N 2.99Å; I1620-N1626 VanDerWaalsContact CD1-OD1 3.24Å; I1620-N1626 WeakPolarHBondContact CD1-OD1 2.97Å; I1620-T1634 PolarHBondContact O-OG1 3.38Å
1621	S	66.4	Low	83.8	Confident	15 Å²	15	30.3 Å²	30.3	11%	0.105	17%	0.168	C	C	.	.			trans	-81.3	27.6	173.1	103.9	0	0	0	0	111.6	D1623 N1628 L1632 T1634 Y2182	S1621-D1623 VanDerWaalsContact C-N 3.32Å; S1621-D1623 VanDerWaalsContact CB-OD1 3.26Å; S1621-D1623 WeakPolarHBondContact CB-OD1 3.45Å; S1621-D1623 PolarHBondContact O-N 3.22Å; S1621-D1623 VanDerWaalsContact O-N 3.15Å; S1621-D1623 PolarHBondContact OG-OD1 2.89Å; S1621-D1623 PolarHBondContact OG-OD2 2.99Å; S1621-N1628 WeakPolarHBondContact CB-ND2 3.37Å; S1621-N1628 WeakPolarHBondContact CB-OD1 3.38Å; S1621-N1628 PolarHBondContact N-OD1 2.92Å; S1621-N1628 VanDerWaalsContact N-OD1 3.07Å; S1621-N1628 PolarHBondContact OG-ND2 2.85Å; S1621-L1632 WeakPolarHBondContact O-CD2 3.34Å; S1621-L1632 WeakPolarHBondContact OG-CD2 3.15Å; S1621-T1634 WeakPolarHBondContact CA-OG1 3.29Å; S1621-T1634 VanDerWaalsContact CB-OG1 3.23Å; S1621-T1634 WeakPolarHBondContact CB-OG1 3.28Å; S1621-T1634 PolarHBondContact N-OG1 3.11Å; S1621-T1634 PolarHBondContact OG-OG1 3.45Å; S1621-Y2182 WeakPolarHBondContact OG-CE1 3.48Å
1622	S	61.4	Low	83.8	Confident	27.8 Å²	27.8	30 Å²	30	19%	0.194	17%	0.166	C	C	.	.			trans	-78.2	-15.4	-177.6	54.1	0	0	0	0	113.3	I1620 L1624 A1625 W1627 N1628 L1632 R2207	I1620-S1622 VanDerWaalsContact C-N 3.32Å; I1620-S1622 VanDerWaalsContact CG2-O 3.25Å; I1620-S1622 WeakPolarHBondContact CG2-O 3.29Å; I1620-S1622 WeakPolarHBondContact CG2-OG 3.24Å; I1620-S1622 PolarHBondContact O-N 2.99Å; S1622-L1624 PolarHBondContact O-N 3.15Å; S1622-L1624 VanDerWaalsContact O-N 3.09Å; S1622-L1624 PolarHBondContact OG-N 2.79Å; S1622-A1625 PolarHBondContact O-N 2.88Å; S1622-W1627 PolarHBondContact OG-O 3.11Å; S1622-N1628 WeakPolarHBondContact CB-OD1 3.36Å; S1622-N1628 PolarHBondContact N-OD1 3.4Å; S1622-N1628 WeakPolarHBondContact OG-CA 3.36Å; S1622-L1632 VanDerWaalsContact CA-CD2 3.48Å; S1622-L1632 VanDerWaalsContact CB-CD2 3.4Å; S1622-R2207 PolarHBondContact O-NH2 3.03Å
1623	D	72.1	Confident	83.8	Confident	70.8 Å²	70.8	30.6 Å²	30.6	38%	0.379	17%	0.168	S	C	.	.			trans	-37.3	19.1	-165	-98.4	-16.2	0	0	0	112.2	S1621 A1625 W2190 L2191 R2207	S1621-D1623 VanDerWaalsContact C-N 3.32Å; S1621-D1623 VanDerWaalsContact CB-OD1 3.26Å; S1621-D1623 WeakPolarHBondContact CB-OD1 3.45Å; S1621-D1623 PolarHBondContact O-N 3.22Å; S1621-D1623 VanDerWaalsContact O-N 3.15Å; S1621-D1623 PolarHBondContact OG-OD1 2.89Å; S1621-D1623 PolarHBondContact OG-OD2 2.99Å; D1623-A1625 VanDerWaalsContact C-N 3.31Å; D1623-A1625 PolarHBondContact O-N 2.89Å; D1623-W2190 HydrophobicContact CB-CB 4.34Å; D1623-W2190 HydrophobicContact CB-CG 4.42Å; D1623-W2190 PolarHBondContact OD2-NE1 3.18Å; D1623-L2191 WeakPolarHBondContact OD2-CB 3.48Å; D1623-L2191 PolarHBondContact OD2-N 3.39Å; D1623-R2207 PolarHBondContact O-NH2 3.09Å
1624	L	84	Confident	83.8	Confident	29 Å²	29	28.1 Å²	28.1	15%	0.152	16%	0.158	C	C	.	.	B	Isolated β-bridge	trans	-106.1	38.2	-179.4	-63.2	175.3	0	0	0	111.6	L1516 S1622 N1626 W1627 L1629 I2205 L2213 L2216	L1516-L1624 HydrophobicContact CD1-CD1 4.23Å; S1622-L1624 PolarHBondContact O-N 3.15Å; S1622-L1624 VanDerWaalsContact O-N 3.09Å; S1622-L1624 PolarHBondContact OG-N 2.79Å; L1624-N1626 PolarHBondContact O-N 3.01Å; L1624-W1627 HydrophobicContact CB-CB 4.36Å; L1624-W1627 WeakPolarHBondContact CB-O 3.45Å; L1624-W1627 VanDerWaalsContact O-CB 3.32Å; L1624-W1627 WeakPolarHBondContact O-CB 3.39Å; L1624-W1627 VanDerWaalsContact O-CD1 3.3Å; L1624-W1627 PolarHBondContact O-N 2.95Å; L1624-L1629 HydrophobicContact CD1-CD1 4.03Å; L1624-L1629 HydrophobicContact CD1-CD2 4.42Å; L1624-L1629 HydrophobicContact CD1-CG 3.98Å; L1624-I2205 HydrophobicContact CD2-CG1 4.4Å; L1624-I2205 HydrophobicContact CD2-CG2 3.84Å; L1624-L2213 HydrophobicContact CB-CD2 4.4Å; L1624-L2213 HydrophobicContact CD2-CD1 3.98Å; L1624-L2213 HydrophobicContact CD2-CD2 4Å; L1624-L2216 HydrophobicContact CD2-CD2 4.25Å
1625	A	82	Confident	83.7	Confident	34.4 Å²	34.4	29.2 Å²	29.2	28%	0.284	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.9	53.7	174.4	0	0	0	0	0	113.9	S1622 D1623 W1627 L2228 Q2234 I2236	S1622-A1625 PolarHBondContact O-N 2.88Å; D1623-A1625 VanDerWaalsContact C-N 3.31Å; D1623-A1625 PolarHBondContact O-N 2.89Å; A1625-W1627 VanDerWaalsContact C-N 3.26Å; A1625-W1627 PolarHBondContact O-N 3.12Å; A1625-W1627 VanDerWaalsContact O-N 3.15Å; A1625-L2228 HydrophobicContact CB-CD2 3.65Å; A1625-Q2234 CarbonylContact C-O 3.57Å; A1625-Q2234 WeakPolarHBondContact CA-O 3.37Å; A1625-Q2234 HydrophobicContact CB-CB 4.07Å; A1625-Q2234 WeakPolarHBondContact CB-O 3.36Å; A1625-I2236 HydrophobicContact CB-CD1 4.46Å; A1625-I2236 HydrophobicContact CB-CG1 3.71Å
1626	N	82.7	Confident	83.6	Confident	64 Å²	64	27.4 Å²	27.4	34%	0.342	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	67	4	-174.5	-59.5	-44.8	0	0	0	116.5	Y1518 I1620 L1624 G2233	Y1518-N1626 HydrophobicContact CD2-CB 4.47Å; Y1518-N1626 HydrophobicContact CE2-CB 4.45Å; I1620-N1626 VanDerWaalsContact CD1-OD1 3.24Å; I1620-N1626 WeakPolarHBondContact CD1-OD1 2.97Å; L1624-N1626 PolarHBondContact O-N 3.01Å; N1626-G2233 PolarHBondContact ND2-O 2.8Å
1627	W	88.8	Confident	83.2	Confident	27.8 Å²	27.8	29.1 Å²	29.1	11%	0.105	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	157.9	163.2	-63.4	71.8	0	0	0	110.3	Y1505 I1507 L1516 I1517 Y1518 S1622 L1624 A1625 I2236 F2250 Y2252	Y1505-W1627 AromaticContact CD1-CH2 3.83Å; Y1505-W1627 HydrophobicContact CD1-CH2 3.83Å; Y1505-W1627 HydrophobicContact CD1-CZ3 4.15Å; Y1505-W1627 HydrophobicContact CE1-CH2 4.31Å; Y1505-W1627 HydrophobicContact CG-CH2 4.28Å; I1507-W1627 HydrophobicContact CD1-CH2 3.73Å; I1507-W1627 HydrophobicContact CD1-CZ3 3.86Å; I1507-W1627 HydrophobicContact CG1-CH2 4.41Å; I1507-W1627 HydrophobicContact CG1-CZ3 4.18Å; L1516-W1627 HydrophobicContact CB-CE3 4.24Å; L1516-W1627 HydrophobicContact CB-CZ3 4.28Å; L1516-W1627 HydrophobicContact CD1-CB 3.94Å; L1516-W1627 HydrophobicContact CD2-CB 4.29Å; L1516-W1627 HydrophobicContact CD2-CD2 4.03Å; L1516-W1627 HydrophobicContact CD2-CE3 3.82Å; L1516-W1627 HydrophobicContact CD2-CG 4.23Å; L1516-W1627 HydrophobicContact CD2-CZ3 4.36Å; L1516-W1627 HydrophobicContact CG-CB 4.05Å; L1516-W1627 HydrophobicContact CG-CD2 4.14Å; L1516-W1627 HydrophobicContact CG-CE3 3.66Å; L1516-W1627 HydrophobicContact CG-CG 4.34Å; L1516-W1627 HydrophobicContact CG-CZ3 4.43Å; I1517-W1627 CarbonylContact O-C 3.34Å; I1517-W1627 WeakPolarHBondContact O-CA 3.41Å; Y1518-W1627 VanDerWaalsContact CB-CE3 3.47Å; Y1518-W1627 VanDerWaalsContact CB-CH2 3.5Å; Y1518-W1627 VanDerWaalsContact CB-CZ3 3.42Å; Y1518-W1627 HydrophobicContact CD2-CZ2 4.45Å; Y1518-W1627 HydrophobicContact CG-CD2 4.48Å; Y1518-W1627 HydrophobicContact CG-CH2 4.45Å; Y1518-W1627 HydrophobicContact CG-CZ2 4.34Å; S1622-W1627 PolarHBondContact OG-O 3.11Å; L1624-W1627 HydrophobicContact CB-CB 4.36Å; L1624-W1627 WeakPolarHBondContact CB-O 3.45Å; L1624-W1627 VanDerWaalsContact O-CB 3.32Å; L1624-W1627 WeakPolarHBondContact O-CB 3.39Å; L1624-W1627 VanDerWaalsContact O-CD1 3.3Å; L1624-W1627 PolarHBondContact O-N 2.95Å; A1625-W1627 VanDerWaalsContact C-N 3.26Å; A1625-W1627 PolarHBondContact O-N 3.12Å; A1625-W1627 VanDerWaalsContact O-N 3.15Å; W1627-I2236 HydrophobicContact CD2-CD1 4.42Å; W1627-I2236 HydrophobicContact CG-CD1 3.95Å; W1627-F2250 HydrophobicContact CH2-CD1 4.23Å; W1627-F2250 AromaticContact CH2-CE1 3.55Å; W1627-F2250 HydrophobicContact CH2-CE1 3.55Å; W1627-F2250 AromaticContact CH2-CZ 3.94Å; W1627-F2250 HydrophobicContact CH2-CZ 3.94Å; W1627-F2250 AromaticContact CZ2-CD1 3.8Å; W1627-F2250 HydrophobicContact CZ2-CD1 3.8Å; W1627-F2250 AromaticContact CZ2-CE1 3.51Å; W1627-F2250 HydrophobicContact CZ2-CE1 3.51Å; W1627-F2250 VanDerWaalsContact CZ2-CE1 3.49Å; W1627-F2250 HydrophobicContact CZ2-CE2 4.41Å; W1627-F2250 HydrophobicContact CZ2-CG 4.38Å; W1627-F2250 AromaticContact CZ2-CZ 3.85Å; W1627-F2250 HydrophobicContact CZ2-CZ 3.85Å; W1627-Y2252 PolarHBondContact NE1-OH 3.04Å; W1627-Y2252 VanDerWaalsContact NE1-OH 3.15Å
1628	N	89.9	Confident	82.7	Confident	3.6 Å²	3.6	29.7 Å²	29.7	2%	0.019	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	162.8	172.2	-149.6	3.8	0	0	0	110.2	I1517 R1522 S1621 S1622 L1632	I1517-N1628 PolarHBondContact N-O 3.08Å; I1517-N1628 PolarHBondContact O-N 2.89Å; R1522-N1628 PolarHBondContact NH1-ND2 3.16Å; S1621-N1628 WeakPolarHBondContact CB-ND2 3.37Å; S1621-N1628 WeakPolarHBondContact CB-OD1 3.38Å; S1621-N1628 PolarHBondContact N-OD1 2.92Å; S1621-N1628 VanDerWaalsContact N-OD1 3.07Å; S1621-N1628 PolarHBondContact OG-ND2 2.85Å; S1622-N1628 WeakPolarHBondContact CB-OD1 3.36Å; S1622-N1628 PolarHBondContact N-OD1 3.4Å; S1622-N1628 WeakPolarHBondContact OG-CA 3.36Å; N1628-L1632 PolarHBondContact ND2-O 3.04Å; N1628-L1632 VanDerWaalsContact ND2-O 3.12Å; N1628-L1632 WeakPolarHBondContact OD1-CB 3.45Å; N1628-L1632 VanDerWaalsContact OD1-CD2 3.23Å; N1628-L1632 WeakPolarHBondContact OD1-CD2 3.4Å; N1628-L1632 WeakPolarHBondContact OD1-CG 3.22Å
1629	L	90.7	Very high	82.6	Confident	11.2 Å²	11.2	30.5 Å²	30.5	6%	0.059	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	141.9	168.6	-67.5	170.1	0	0	0	109.6	I1509 L1514 R1515 L1516 L1624 I1631 L1632 G1645 L2191 I2194 L2203	I1509-L1629 HydrophobicContact CD1-CD2 3.7Å; L1514-L1629 HydrophobicContact CB-CD2 4.32Å; L1514-L1629 HydrophobicContact CD1-CD2 4.42Å; R1515-L1629 WeakPolarHBondContact O-CA 3.37Å; L1516-L1629 HydrophobicContact CB-CD2 4.47Å; L1516-L1629 HydrophobicContact CD1-CD2 4.02Å; L1624-L1629 HydrophobicContact CD1-CD1 4.03Å; L1624-L1629 HydrophobicContact CD1-CD2 4.42Å; L1624-L1629 HydrophobicContact CD1-CG 3.98Å; L1629-I1631 HydrophobicContact CB-CG1 4.41Å; L1629-I1631 PolarHBondContact O-N 2.95Å; L1629-I1631 VanDerWaalsContact O-N 3.12Å; L1629-L1632 HydrophobicContact CB-CB 4.07Å; L1629-L1632 PolarHBondContact O-N 3.06Å; L1629-G1645 VanDerWaalsContact O-CA 3.28Å; L1629-G1645 WeakPolarHBondContact O-CA 3.41Å; L1629-L2191 HydrophobicContact CD1-CD2 4.34Å; L1629-I2194 HydrophobicContact CD1-CD1 3.51Å; L1629-I2194 VanDerWaalsContact CD1-CD1 3.47Å; L1629-L2203 HydrophobicContact CD1-CD2 3.82Å; L1629-L2203 HydrophobicContact CD2-CD2 4.41Å
1630	N	88	Confident	82.8	Confident	38 Å²	38	29.7 Å²	29.7	20%	0.203	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-32.1	-179	62	-46	0	0	0	114.5	Q1513 L1514 R1515 I1517 H1633 G1645 D1646	Q1513-N1630 PolarHBondContact O-ND2 3.14Å; L1514-N1630 WeakPolarHBondContact CA-OD1 3.4Å; R1515-N1630 HydrophobicContact CB-CB 4.24Å; R1515-N1630 VanDerWaalsContact N-CG 3.31Å; R1515-N1630 PolarHBondContact N-OD1 2.93Å; R1515-N1630 PolarHBondContact O-N 2.96Å; R1515-N1630 VanDerWaalsContact O-N 3.14Å; R1515-N1630 PolarHBondContact O-OD1 2.91Å; I1517-N1630 HydrophobicContact CD1-CB 3.7Å; I1517-N1630 HydrophobicContact CG1-CB 4.34Å; N1630-H1633 PolarHBondContact O-CE1 3Å; N1630-H1633 VanDerWaalsContact O-CE1 3.29Å; N1630-G1645 CarbonylContact O-C 3.57Å; N1630-G1645 WeakPolarHBondContact O-CA 3.18Å; N1630-D1646 PolarHBondContact O-N 3.12Å
1631	I	88.3	Confident	83.5	Confident	47 Å²	47	27.1 Å²	27.1	24%	0.241	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-13	178.8	61.4	163.7	0	0	0	114.3	L1514 L1629 H1633 L2165 H2178 I2194	L1514-I1631 HydrophobicContact CD2-CD1 3.38Å; L1514-I1631 VanDerWaalsContact CD2-CD1 3.43Å; L1514-I1631 HydrophobicContact CD2-CG1 3.68Å; L1514-I1631 HydrophobicContact CD2-CG2 4.24Å; L1629-I1631 HydrophobicContact CB-CG1 4.41Å; L1629-I1631 PolarHBondContact O-N 2.95Å; L1629-I1631 VanDerWaalsContact O-N 3.12Å; I1631-H1633 VanDerWaalsContact C-ND1 3.31Å; I1631-H1633 PolarHBondContact O-CE1 2.95Å; I1631-H1633 PolarHBondContact O-N 3.07Å; I1631-H1633 PolarHBondContact O-ND1 2.74Å; I1631-L2165 WeakPolarHBondContact O-CD2 3.3Å; I1631-H2178 WeakPolarHBondContact CD1-NE2 3.19Å; I1631-I2194 HydrophobicContact CD1-CD1 4.07Å; I1631-I2194 HydrophobicContact CD1-CG2 4.01Å; I1631-I2194 HydrophobicContact CG1-CD1 4.49Å
1632	L	88.9	Confident	84.6	Confident	15.6 Å²	15.6	26.8 Å²	26.8	8%	0.082	15%	0.149	C	C	.	.			trans	-86.1	114.6	-173.8	-179.7	62.3	0	0	0	109.9	S1621 S1622 N1628 L1629 G1645 L2165 L2180 Y2182 L2191	S1621-L1632 WeakPolarHBondContact O-CD2 3.34Å; S1621-L1632 WeakPolarHBondContact OG-CD2 3.15Å; S1622-L1632 VanDerWaalsContact CA-CD2 3.48Å; S1622-L1632 VanDerWaalsContact CB-CD2 3.4Å; N1628-L1632 PolarHBondContact ND2-O 3.04Å; N1628-L1632 VanDerWaalsContact ND2-O 3.12Å; N1628-L1632 WeakPolarHBondContact OD1-CB 3.45Å; N1628-L1632 VanDerWaalsContact OD1-CD2 3.23Å; N1628-L1632 WeakPolarHBondContact OD1-CD2 3.4Å; N1628-L1632 WeakPolarHBondContact OD1-CG 3.22Å; L1629-L1632 HydrophobicContact CB-CB 4.07Å; L1629-L1632 PolarHBondContact O-N 3.06Å; L1632-G1645 VanDerWaalsContact O-CA 3.3Å; L1632-G1645 WeakPolarHBondContact O-CA 3.38Å; L1632-G1645 PolarHBondContact O-N 3.04Å; L1632-G1645 VanDerWaalsContact O-N 3.16Å; L1632-L2165 HydrophobicContact CD1-CB 4.44Å; L1632-L2180 HydrophobicContact CD1-CD2 3.4Å; L1632-L2180 VanDerWaalsContact CD1-CD2 3.49Å; L1632-Y2182 VanDerWaalsContact CD1-OH 3.31Å; L1632-Y2182 WeakPolarHBondContact CD1-OH 3.21Å; L1632-L2191 HydrophobicContact CD1-CD2 4.41Å; L1632-L2191 HydrophobicContact CD2-CD2 4.1Å
1633	H	89.7	Confident	85.9	Confident	21.8 Å²	21.8	25.9 Å²	25.9	10%	0.101	14%	0.141	C	C	.	.			trans	-113.7	151.9	-175.9	-57.4	-3.5	0	0	0	110.4	N1630 I1631 I1642 Y1643 R1644 G1645 D2157 F2159 L2165	N1630-H1633 PolarHBondContact O-CE1 3Å; N1630-H1633 VanDerWaalsContact O-CE1 3.29Å; I1631-H1633 VanDerWaalsContact C-ND1 3.31Å; I1631-H1633 PolarHBondContact O-CE1 2.95Å; I1631-H1633 PolarHBondContact O-N 3.07Å; I1631-H1633 PolarHBondContact O-ND1 2.74Å; H1633-I1642 HydrophobicContact CB-CG2 4.41Å; H1633-Y1643 CarbonylContact C-O 3.53Å; H1633-Y1643 WeakPolarHBondContact CA-O 3.33Å; H1633-R1644 PolarHBondContact CD2-NE 2.91Å; H1633-R1644 VanDerWaalsContact NE2-CZ 3.32Å; H1633-R1644 PolarHBondContact NE2-NE 2.97Å; H1633-R1644 VanDerWaalsContact NE2-NE 3.11Å; H1633-R1644 PolarHBondContact NE2-NH2 3.02Å; H1633-R1644 VanDerWaalsContact NE2-NH2 3.16Å; H1633-G1645 PolarHBondContact CE1-N 2.98Å; H1633-G1645 PolarHBondContact ND1-N 3.19Å; H1633-G1645 VanDerWaalsContact ND1-N 3.15Å; H1633-D2157 IonicContact CD2-OD2 3.76Å; H1633-D2157 PolarHBondContact CD2-OD2 3.04Å; H1633-D2157 VanDerWaalsContact CD2-OD2 3.29Å; H1633-F2159 HydrophobicContact CB-CE1 4Å; H1633-F2159 HydrophobicContact CB-CZ 4.07Å; H1633-L2165 HydrophobicContact CB-CD2 4.2Å; H1633-L2165 WeakPolarHBondContact O-CB 3.32Å
1634	T	88.6	Confident	86.6	Confident	14.8 Å²	14.8	24.5 Å²	24.5	9%	0.091	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	128.6	177.6	-53.3	0	0	0	0	109.9	L1619 I1620 S1621 I1642 Y1643	L1619-T1634 HydrophobicContact CB-CG2 4.01Å; L1619-T1634 HydrophobicContact CD1-CG2 4.08Å; I1620-T1634 PolarHBondContact O-OG1 3.38Å; S1621-T1634 WeakPolarHBondContact CA-OG1 3.29Å; S1621-T1634 VanDerWaalsContact CB-OG1 3.23Å; S1621-T1634 WeakPolarHBondContact CB-OG1 3.28Å; S1621-T1634 PolarHBondContact N-OG1 3.11Å; S1621-T1634 PolarHBondContact OG-OG1 3.45Å; T1634-I1642 CarbonylContact O-C 3.58Å; T1634-I1642 WeakPolarHBondContact O-CA 3.45Å; T1634-Y1643 PolarHBondContact N-O 2.96Å; T1634-Y1643 PolarHBondContact O-N 3.06Å
1635	Y	89.2	Confident	86.6	Confident	25.8 Å²	25.8	23.1 Å²	23.1	10%	0.101	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	113.1	177.4	175	-138.7	0	0	0	110.8	V1637 I1642 L1652 Y2146 I2148 G2163	Y1635-V1637 HydrophobicContact CD1-CG2 3.83Å; Y1635-V1637 HydrophobicContact CE1-CB 4.25Å; Y1635-V1637 HydrophobicContact CE1-CG1 4.32Å; Y1635-V1637 HydrophobicContact CE1-CG2 3.81Å; Y1635-V1637 HydrophobicContact CG-CG2 4.45Å; Y1635-V1637 PolarHBondContact O-N 3.05Å; Y1635-I1642 HydrophobicContact CD2-CG1 3.84Å; Y1635-I1642 HydrophobicContact CE2-CG1 4.47Å; Y1635-I1642 HydrophobicContact CG-CG1 4.46Å; Y1635-L1652 HydrophobicContact CD2-CD1 4.26Å; Y1635-L1652 HydrophobicContact CE2-CD1 3.56Å; Y1635-L1652 VanDerWaalsContact CE2-CD1 3.49Å; Y1635-Y2146 AromaticContact CD1-CD2 3.98Å; Y1635-Y2146 HydrophobicContact CD1-CD2 4.03Å; Y1635-Y2146 HydrophobicContact CD1-CG 4.09Å; Y1635-Y2146 HydrophobicContact CE1-CD1 4.08Å; Y1635-Y2146 AromaticContact CE1-CD2 3.99Å; Y1635-Y2146 HydrophobicContact CE1-CD2 4.03Å; Y1635-Y2146 HydrophobicContact CE1-CE1 4.42Å; Y1635-Y2146 HydrophobicContact CE1-CE2 4.42Å; Y1635-Y2146 AromaticContact CE1-CG 3.83Å; Y1635-Y2146 HydrophobicContact CE1-CG 3.83Å; Y1635-I2148 HydrophobicContact CD1-CD1 4.16Å; Y1635-I2148 HydrophobicContact CD2-CD1 4.22Å; Y1635-I2148 HydrophobicContact CE1-CD1 4.34Å; Y1635-I2148 HydrophobicContact CE2-CD1 4.39Å; Y1635-I2148 HydrophobicContact CG-CD1 4.08Å; Y1635-G2163 PolarHBondContact N-O 3.02Å; Y1635-G2163 VanDerWaalsContact O-CA 3.25Å; Y1635-G2163 WeakPolarHBondContact O-CA 3.3Å
1636	A	87.5	Confident	86.4	Confident	0.4 Å²	0.4	24 Å²	24	0%	0.003	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	94.9	170.7	0	0	0	0	0	109.8	L1619 S1638 H1639 G1640 I1641 Y1643	L1619-A1636 HydrophobicContact CD1-CB 3.58Å; L1619-A1636 HydrophobicContact CG-CB 4.38Å; A1636-S1638 VanDerWaalsContact C-N 3.32Å; A1636-S1638 PolarHBondContact O-N 3.16Å; A1636-H1639 HydrophobicContact CB-CB 4.04Å; A1636-H1639 PolarHBondContact O-N 2.91Å; A1636-H1639 VanDerWaalsContact O-N 3.07Å; A1636-G1640 WeakPolarHBondContact O-CA 3.39Å; A1636-G1640 PolarHBondContact O-N 2.87Å; A1636-I1641 HydrophobicContact CB-CB 4.25Å; A1636-I1641 WeakPolarHBondContact CB-O 3.38Å; A1636-I1641 PolarHBondContact N-O 3.14Å; A1636-I1641 PolarHBondContact O-N 3.06Å; A1636-I1641 VanDerWaalsContact O-N 3.17Å; A1636-Y1643 HydrophobicContact CB-CD2 4.42Å; A1636-Y1643 HydrophobicContact CB-CE2 3.86Å
1637	V	81.4	Confident	86.3	Confident	40.8 Å²	40.8	21 Å²	21	25%	0.247	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-45.5	-172.6	-174	0	0	0	0	111.7	D1290 Y1635 H1639 Y2146	D1290-V1637 PolarHBondContact OD1-N 3.04Å; D1290-V1637 WeakPolarHBondContact OD2-CA 3.3Å; D1290-V1637 VanDerWaalsContact OD2-CB 3.28Å; D1290-V1637 WeakPolarHBondContact OD2-CB 3.41Å; D1290-V1637 PolarHBondContact OD2-N 3.19Å; Y1635-V1637 HydrophobicContact CD1-CG2 3.83Å; Y1635-V1637 HydrophobicContact CE1-CB 4.25Å; Y1635-V1637 HydrophobicContact CE1-CG1 4.32Å; Y1635-V1637 HydrophobicContact CE1-CG2 3.81Å; Y1635-V1637 HydrophobicContact CG-CG2 4.45Å; Y1635-V1637 PolarHBondContact O-N 3.05Å; V1637-H1639 VanDerWaalsContact C-N 3.32Å; V1637-H1639 PolarHBondContact O-N 2.86Å; V1637-Y2146 HydrophobicContact CG1-CE1 4.4Å; V1637-Y2146 HydrophobicContact CG1-CE2 4.1Å; V1637-Y2146 WeakPolarHBondContact CG1-OH 3.45Å; V1637-Y2146 HydrophobicContact CG2-CD2 4.29Å; V1637-Y2146 HydrophobicContact CG2-CE2 3.74Å
1638	S	78.4	Confident	85.9	Confident	38.8 Å²	38.8	20.8 Å²	20.8	27%	0.271	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-36.5	-179.5	64.2	0	0	0	0	112.7	D1290 A1636 K1653	D1290-S1638 VanDerWaalsContact O-CB 3.3Å; D1290-S1638 WeakPolarHBondContact O-CB 3.24Å; D1290-S1638 PolarHBondContact O-OG 3.05Å; D1290-S1638 WeakPolarHBondContact OD1-CB 3.38Å; D1290-S1638 PolarHBondContact OD1-N 3.18Å; D1290-S1638 VanDerWaalsContact OD1-N 3.1Å; D1290-S1638 PolarHBondContact OD1-OG 2.8Å; D1290-S1638 PolarHBondContact OD2-N 2.99Å; A1636-S1638 VanDerWaalsContact C-N 3.32Å; A1636-S1638 PolarHBondContact O-N 3.16Å; S1638-K1653 PolarHBondContact O-NZ 3.13Å; S1638-K1653 VanDerWaalsContact O-NZ 3.15Å
1639	H	82.1	Confident	85.7	Confident	37.8 Å²	37.8	22.5 Å²	22.5	18%	0.175	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-24.9	-178	-61.5	-71.7	0	0	0	112.7	D1290 Y1586 A1636 V1637 I1641 K1653	D1290-H1639 IonicContact OD1-CD2 3.2Å; D1290-H1639 PolarHBondContact OD1-CD2 3.19Å; Y1586-H1639 VanDerWaalsContact C-CE1 3.49Å; Y1586-H1639 PolarHBondContact O-CE1 3Å; Y1586-H1639 PolarHBondContact O-ND1 3.11Å; Y1586-H1639 PolarHBondContact O-NE2 3.43Å; A1636-H1639 HydrophobicContact CB-CB 4.04Å; A1636-H1639 PolarHBondContact O-N 2.91Å; A1636-H1639 VanDerWaalsContact O-N 3.07Å; V1637-H1639 VanDerWaalsContact C-N 3.32Å; V1637-H1639 PolarHBondContact O-N 2.86Å; H1639-I1641 HydrophobicContact CB-CD1 3.89Å; H1639-I1641 HydrophobicContact CB-CG1 4.03Å; H1639-K1653 VanDerWaalsContact C-NZ 3.27Å; H1639-K1653 WeakPolarHBondContact O-CD 3.27Å; H1639-K1653 VanDerWaalsContact O-CE 3.24Å; H1639-K1653 WeakPolarHBondContact O-CE 3.35Å; H1639-K1653 PolarHBondContact O-NZ 3.4Å
1640	G	85	Confident	85.3	Confident	1.4 Å²	1.4	24.9 Å²	24.9	1%	0.014	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.8	41.9	-174.4	0	0	0	0	0	112.3	A1636 L1652	A1636-G1640 WeakPolarHBondContact O-CA 3.39Å; A1636-G1640 PolarHBondContact O-N 2.87Å; G1640-L1652 VanDerWaalsContact O-CB 3.32Å; G1640-L1652 WeakPolarHBondContact O-CB 3.35Å; G1640-L1652 PolarHBondContact O-N 3.29Å
1641	I	88.5	Confident	85.2	Confident	4 Å²	4	24.4 Å²	24.4	2%	0.021	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	131.3	-174.8	-54	173	0	0	0	109.6	L1588 A1636 H1639 Y1643 F1650 Y1651	L1588-I1641 HydrophobicContact CG-CD1 4.26Å; A1636-I1641 HydrophobicContact CB-CB 4.25Å; A1636-I1641 WeakPolarHBondContact CB-O 3.38Å; A1636-I1641 PolarHBondContact N-O 3.14Å; A1636-I1641 PolarHBondContact O-N 3.06Å; A1636-I1641 VanDerWaalsContact O-N 3.17Å; H1639-I1641 HydrophobicContact CB-CD1 3.89Å; H1639-I1641 HydrophobicContact CB-CG1 4.03Å; I1641-Y1643 HydrophobicContact CB-CE2 4.4Å; I1641-Y1643 HydrophobicContact CG2-CD1 4.16Å; I1641-Y1643 HydrophobicContact CG2-CE1 3.73Å; I1641-Y1643 HydrophobicContact CG2-CE2 4.22Å; I1641-F1650 CarbonylContact C-O 3.49Å; I1641-F1650 WeakPolarHBondContact CA-O 3.32Å; I1641-Y1651 HydrophobicContact CB-CD1 4.49Å; I1641-Y1651 HydrophobicContact CD1-CD1 3.87Å; I1641-Y1651 HydrophobicContact CD1-CE1 3.94Å; I1641-Y1651 HydrophobicContact CG1-CD1 3.82Å; I1641-Y1651 HydrophobicContact CG1-CE1 4.3Å; I1641-Y1651 HydrophobicContact CG2-CD1 4.06Å; I1641-Y1651 HydrophobicContact CG2-CE1 4.1Å
1642	I	89.3	Confident	84.9	Confident	9 Å²	9	23.6 Å²	23.6	5%	0.046	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	118.7	171	-51.1	168.9	0	0	0	108.2	H1633 T1634 Y1635 R1644 H1649 F1650 L1652 I2148 F2159	H1633-I1642 HydrophobicContact CB-CG2 4.41Å; T1634-I1642 CarbonylContact O-C 3.58Å; T1634-I1642 WeakPolarHBondContact O-CA 3.45Å; Y1635-I1642 HydrophobicContact CD2-CG1 3.84Å; Y1635-I1642 HydrophobicContact CE2-CG1 4.47Å; Y1635-I1642 HydrophobicContact CG-CG1 4.46Å; I1642-R1644 HydrophobicContact CG2-CG 4.14Å; I1642-H1649 CarbonylContact O-C 3.57Å; I1642-H1649 WeakPolarHBondContact O-CA 3.33Å; I1642-F1650 HydrophobicContact CB-CB 4.12Å; I1642-F1650 HydrophobicContact CB-CD2 4.37Å; I1642-F1650 HydrophobicContact CD1-CB 4.35Å; I1642-F1650 HydrophobicContact CD1-CD1 4.12Å; I1642-F1650 HydrophobicContact CD1-CD2 4.47Å; I1642-F1650 HydrophobicContact CG1-CB 4.49Å; I1642-F1650 PolarHBondContact N-O 2.99Å; I1642-F1650 PolarHBondContact O-N 3.19Å; I1642-L1652 HydrophobicContact CD1-CD1 4.28Å; I1642-L1652 HydrophobicContact CD1-CD2 4.35Å; I1642-L1652 HydrophobicContact CD1-CG 4.44Å; I1642-L1652 HydrophobicContact CG1-CD1 4.23Å; I1642-L1652 HydrophobicContact CG1-CG 4.4Å; I1642-I2148 HydrophobicContact CD1-CB 4.39Å; I1642-I2148 HydrophobicContact CD1-CD1 3.52Å; I1642-I2148 VanDerWaalsContact CD1-CD1 3.46Å; I1642-I2148 HydrophobicContact CD1-CG1 4.48Å; I1642-I2148 HydrophobicContact CD1-CG2 3.72Å; I1642-I2148 HydrophobicContact CG1-CD1 4.05Å; I1642-F2159 HydrophobicContact CG2-CZ 4.13Å
1643	Y	88.6	Confident	84.4	Confident	7.4 Å²	7.4	26.8 Å²	26.8	3%	0.029	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	106.6	172.1	-58.7	-71.4	0	0	0	108.5	G1587 E1618 L1619 H1633 T1634 A1636 I1641 H1649	G1587-Y1643 WeakPolarHBondContact CA-OH 3.38Å; G1587-Y1643 PolarHBondContact N-OH 3.47Å; E1618-Y1643 HydrophobicContact CB-CD1 3.9Å; E1618-Y1643 HydrophobicContact CB-CE1 3.88Å; E1618-Y1643 HydrophobicContact CB-CG 4.33Å; E1618-Y1643 HydrophobicContact CG-CD1 3.7Å; E1618-Y1643 VanDerWaalsContact CG-CD1 3.48Å; E1618-Y1643 HydrophobicContact CG-CD2 3.97Å; E1618-Y1643 HydrophobicContact CG-CE1 3.69Å; E1618-Y1643 HydrophobicContact CG-CE2 4.33Å; E1618-Y1643 HydrophobicContact CG-CG 4.15Å; E1618-Y1643 WeakPolarHBondContact OE1-CB 3.42Å; L1619-Y1643 HydrophobicContact CB-CD2 3.97Å; L1619-Y1643 HydrophobicContact CB-CE2 3.93Å; L1619-Y1643 HydrophobicContact CD1-CE2 4.48Å; L1619-Y1643 HydrophobicContact CG-CD2 4.29Å; L1619-Y1643 HydrophobicContact CG-CE2 4.1Å; L1619-Y1643 VanDerWaalsContact N-CE2 3.32Å; H1633-Y1643 CarbonylContact C-O 3.53Å; H1633-Y1643 WeakPolarHBondContact CA-O 3.33Å; T1634-Y1643 PolarHBondContact N-O 2.96Å; T1634-Y1643 PolarHBondContact O-N 3.06Å; A1636-Y1643 HydrophobicContact CB-CD2 4.42Å; A1636-Y1643 HydrophobicContact CB-CE2 3.86Å; I1641-Y1643 HydrophobicContact CB-CE2 4.4Å; I1641-Y1643 HydrophobicContact CG2-CD1 4.16Å; I1641-Y1643 HydrophobicContact CG2-CE1 3.73Å; I1641-Y1643 HydrophobicContact CG2-CE2 4.22Å; Y1643-H1649 AromaticContact CD1-CD2 3.66Å; Y1643-H1649 AromaticContact CD1-NE2 3.74Å
1644	R	86.8	Confident	83.8	Confident	42.2 Å²	42.2	29.7 Å²	29.7	16%	0.159	15%	0.147	C	C	.	.			trans	-82.2	158.1	-179.8	-63.7	-168.5	74.7	-170.4	2.4	111.7	R1522 H1633 I1642 D1646 G1647 S1648 F1650 E2155	R1522-R1644 PolarHBondContact NH1-O 3.32Å; R1522-R1644 PolarHBondContact NH2-O 3.19Å; R1522-R1644 VanDerWaalsContact NH2-O 3.12Å; H1633-R1644 PolarHBondContact CD2-NE 2.91Å; H1633-R1644 VanDerWaalsContact NE2-CZ 3.32Å; H1633-R1644 PolarHBondContact NE2-NE 2.97Å; H1633-R1644 VanDerWaalsContact NE2-NE 3.11Å; H1633-R1644 PolarHBondContact NE2-NH2 3.02Å; H1633-R1644 VanDerWaalsContact NE2-NH2 3.16Å; I1642-R1644 HydrophobicContact CG2-CG 4.14Å; R1644-D1646 VanDerWaalsContact C-N 3.29Å; R1644-D1646 VanDerWaalsContact CB-OD1 3.3Å; R1644-D1646 WeakPolarHBondContact CB-OD1 3.38Å; R1644-D1646 IonicContact CZ-OD1 3.79Å; R1644-D1646 IonicContact CZ-OD2 2.8Å; R1644-D1646 IonicContact NH1-OD1 2.93Å; R1644-D1646 PolarHBondContact NH1-OD1 3.37Å; R1644-D1646 IonicContact NH1-OD2 2.71Å; R1644-D1646 PolarHBondContact NH1-OD2 3.32Å; R1644-D1646 IonicContact NH2-OD2 2.58Å; R1644-D1646 PolarHBondContact NH2-OD2 3.39Å; R1644-D1646 PolarHBondContact O-N 3.09Å; R1644-G1647 WeakPolarHBondContact O-CA 3.33Å; R1644-G1647 PolarHBondContact O-N 2.91Å; R1644-G1647 VanDerWaalsContact O-N 3.1Å; R1644-S1648 WeakPolarHBondContact CB-O 3.29Å; R1644-S1648 WeakPolarHBondContact CD-OG 3.31Å; R1644-S1648 PolarHBondContact N-O 3.14Å; R1644-S1648 PolarHBondContact NH1-OG 3.12Å; R1644-F1650 HydrophobicContact CG-CD2 4.27Å; R1644-F1650 HydrophobicContact CG-CE2 4.08Å; R1644-E2155 IonicContact CZ-OE2 2.77Å; R1644-E2155 IonicContact NH2-OE2 3.19Å; R1644-E2155 PolarHBondContact NH2-OE2 3.12Å
1645	G	83.1	Confident	82.9	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-32.8	-178.4	0	0	0	0	0	113.1	I1517 L1629 N1630 L1632 H1633 G1647	I1517-G1645 WeakPolarHBondContact CD1-O 3.48Å; L1629-G1645 VanDerWaalsContact O-CA 3.28Å; L1629-G1645 WeakPolarHBondContact O-CA 3.41Å; N1630-G1645 CarbonylContact O-C 3.57Å; N1630-G1645 WeakPolarHBondContact O-CA 3.18Å; L1632-G1645 VanDerWaalsContact O-CA 3.3Å; L1632-G1645 WeakPolarHBondContact O-CA 3.38Å; L1632-G1645 PolarHBondContact O-N 3.04Å; L1632-G1645 VanDerWaalsContact O-N 3.16Å; H1633-G1645 PolarHBondContact CE1-N 2.98Å; H1633-G1645 PolarHBondContact ND1-N 3.19Å; H1633-G1645 VanDerWaalsContact ND1-N 3.15Å; G1645-G1647 PolarHBondContact O-N 3.17Å
1646	D	79.4	Confident	82	Confident	52 Å²	52	34 Å²	34	28%	0.278	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-6.6	173.1	72.7	-13	0	0	0	114	R1499 M1504 I1517 R1519 N1630 R1644 S1648	R1499-D1646 IonicContact NH1-OD2 3.25Å; R1499-D1646 PolarHBondContact NH1-OD2 2.84Å; M1504-D1646 WeakPolarHBondContact CE-O 3.47Å; I1517-D1646 HydrophobicContact CD1-CB 4.23Å; R1519-D1646 WeakPolarHBondContact CD-O 3.49Å; R1519-D1646 PolarHBondContact NH1-O 3.11Å; N1630-D1646 PolarHBondContact O-N 3.12Å; R1644-D1646 VanDerWaalsContact C-N 3.29Å; R1644-D1646 VanDerWaalsContact CB-OD1 3.3Å; R1644-D1646 WeakPolarHBondContact CB-OD1 3.38Å; R1644-D1646 IonicContact CZ-OD1 3.79Å; R1644-D1646 IonicContact CZ-OD2 2.8Å; R1644-D1646 IonicContact NH1-OD1 2.93Å; R1644-D1646 PolarHBondContact NH1-OD1 3.37Å; R1644-D1646 IonicContact NH1-OD2 2.71Å; R1644-D1646 PolarHBondContact NH1-OD2 3.32Å; R1644-D1646 IonicContact NH2-OD2 2.58Å; R1644-D1646 PolarHBondContact NH2-OD2 3.39Å; R1644-D1646 PolarHBondContact O-N 3.09Å; D1646-S1648 VanDerWaalsContact C-N 3.31Å; D1646-S1648 VanDerWaalsContact OD1-CB 3.26Å; D1646-S1648 WeakPolarHBondContact OD1-CB 3.28Å; D1646-S1648 PolarHBondContact OD1-N 3.08Å; D1646-S1648 PolarHBondContact OD1-OG 3.01Å; D1646-S1648 WeakPolarHBondContact OD2-CB 3.47Å; D1646-S1648 PolarHBondContact OD2-OG 3.23Å
1647	G	79.1	Confident	81.7	Confident	1.2 Å²	1.2	38.1 Å²	38.1	1%	0.012	19%	0.188	C	C	.	.	S	Bend	trans	84.5	7.8	-179.3	0	0	0	0	0	115.6	R1499 R1519 R1644 G1645 H1649	R1499-G1647 PolarHBondContact NH1-O 3.03Å; R1499-G1647 PolarHBondContact NH2-O 2.77Å; R1519-G1647 PolarHBondContact NH1-O 3.02Å; R1519-G1647 PolarHBondContact NH2-O 3.3Å; R1644-G1647 WeakPolarHBondContact O-CA 3.33Å; R1644-G1647 PolarHBondContact O-N 2.91Å; R1644-G1647 VanDerWaalsContact O-N 3.1Å; G1645-G1647 PolarHBondContact O-N 3.17Å; G1647-H1649 PolarHBondContact O-CD2 3.3Å; G1647-H1649 PolarHBondContact O-NE2 3.32Å
1648	S	81.6	Confident	81.8	Confident	24 Å²	24	39.3 Å²	39.3	17%	0.168	19%	0.191	C	C	.	.			trans	-76.1	152.5	165.2	64.5	0	0	0	0	111.3	R1644 D1646	R1644-S1648 WeakPolarHBondContact CB-O 3.29Å; R1644-S1648 WeakPolarHBondContact CD-OG 3.31Å; R1644-S1648 PolarHBondContact N-O 3.14Å; R1644-S1648 PolarHBondContact NH1-OG 3.12Å; D1646-S1648 VanDerWaalsContact C-N 3.31Å; D1646-S1648 VanDerWaalsContact OD1-CB 3.26Å; D1646-S1648 WeakPolarHBondContact OD1-CB 3.28Å; D1646-S1648 PolarHBondContact OD1-N 3.08Å; D1646-S1648 PolarHBondContact OD1-OG 3.01Å; D1646-S1648 WeakPolarHBondContact OD2-CB 3.47Å; D1646-S1648 PolarHBondContact OD2-OG 3.23Å
1649	H	84.2	Confident	82.2	Confident	40 Å²	40	39 Å²	39	19%	0.185	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	137.1	178.4	-58.1	161.2	0	0	0	109.9	R1519 E1618 I1642 Y1643 G1647 Y1651	R1519-H1649 PolarHBondContact NH1-NE2 2.83Å; E1618-H1649 VanDerWaalsContact CD-CE1 3.46Å; E1618-H1649 IonicContact OE1-CE1 3.02Å; E1618-H1649 PolarHBondContact OE1-CE1 3.03Å; E1618-H1649 VanDerWaalsContact OE1-CE1 3.26Å; E1618-H1649 IonicContact OE1-NE2 3.55Å; E1618-H1649 PolarHBondContact OE1-NE2 3.17Å; E1618-H1649 IonicContact OE2-CE1 3.54Å; E1618-H1649 IonicContact OE2-NE2 3.11Å; E1618-H1649 PolarHBondContact OE2-NE2 2.96Å; I1642-H1649 CarbonylContact O-C 3.57Å; I1642-H1649 WeakPolarHBondContact O-CA 3.33Å; Y1643-H1649 AromaticContact CD1-CD2 3.66Å; Y1643-H1649 AromaticContact CD1-NE2 3.74Å; G1647-H1649 PolarHBondContact O-CD2 3.3Å; G1647-H1649 PolarHBondContact O-NE2 3.32Å; H1649-Y1651 HydrophobicContact CB-CD2 4.32Å; H1649-Y1651 HydrophobicContact CB-CE1 4.42Å; H1649-Y1651 HydrophobicContact CB-CE2 3.64Å; H1649-Y1651 AromaticContact ND1-CZ 3.89Å; H1649-Y1651 PolarHBondContact ND1-OH 3.09Å; H1649-Y1651 VanDerWaalsContact ND1-OH 3.15Å
1650	F	84.2	Confident	82.3	Confident	61.4 Å²	61.4	37.8 Å²	37.8	27%	0.269	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	110.7	171.8	-145.6	-105.3	0	0	0	109.7	I1641 I1642 R1644 L1652 T1655 H2150	I1641-F1650 CarbonylContact C-O 3.49Å; I1641-F1650 WeakPolarHBondContact CA-O 3.32Å; I1642-F1650 HydrophobicContact CB-CB 4.12Å; I1642-F1650 HydrophobicContact CB-CD2 4.37Å; I1642-F1650 HydrophobicContact CD1-CB 4.35Å; I1642-F1650 HydrophobicContact CD1-CD1 4.12Å; I1642-F1650 HydrophobicContact CD1-CD2 4.47Å; I1642-F1650 HydrophobicContact CG1-CB 4.49Å; I1642-F1650 PolarHBondContact N-O 2.99Å; I1642-F1650 PolarHBondContact O-N 3.19Å; R1644-F1650 HydrophobicContact CG-CD2 4.27Å; R1644-F1650 HydrophobicContact CG-CE2 4.08Å; F1650-L1652 HydrophobicContact CB-CD2 4.5Å; F1650-L1652 HydrophobicContact CD1-CD2 3.54Å; F1650-L1652 VanDerWaalsContact CD1-CD2 3.45Å; F1650-L1652 HydrophobicContact CD1-CG 4.11Å; F1650-L1652 HydrophobicContact CE1-CD2 3.52Å; F1650-L1652 HydrophobicContact CE1-CG 4.32Å; F1650-L1652 HydrophobicContact CZ-CD2 4.45Å; F1650-L1652 PolarHBondContact O-N 3.2Å; F1650-T1655 HydrophobicContact CD1-CG2 4.09Å; F1650-T1655 HydrophobicContact CD2-CG2 4.3Å; F1650-T1655 HydrophobicContact CE1-CG2 3.83Å; F1650-T1655 HydrophobicContact CE2-CG2 3.94Å; F1650-T1655 HydrophobicContact CG-CG2 4.29Å; F1650-T1655 HydrophobicContact CZ-CG2 3.89Å; F1650-T1655 VanDerWaalsContact CZ-CG2 3.49Å; F1650-T1655 WeakPolarHBondContact CZ-OG1 3.41Å; F1650-H2150 AromaticContact CD2-CE1 3.7Å; F1650-H2150 AromaticContact CD2-ND1 3.9Å; F1650-H2150 AromaticContact CE2-CE1 3.55Å; F1650-H2150 AromaticContact CE2-ND1 3.33Å; F1650-H2150 VanDerWaalsContact CE2-ND1 3.33Å; F1650-H2150 WeakPolarHBondContact CE2-ND1 3.25Å; F1650-H2150 AromaticContact CZ-ND1 3.91Å
1651	Y	84.8	Confident	82.3	Confident	27.8 Å²	27.8	38.6 Å²	38.6	11%	0.109	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	89.4	-178.7	-58.9	-87.7	0	0	0	109.9	L1482 M1483 L1588 I1641 H1649 K1653 Q1654 T1655	L1482-Y1651 HydrophobicContact CB-CD2 4.35Å; L1482-Y1651 HydrophobicContact CB-CE2 3.9Å; L1482-Y1651 HydrophobicContact CD1-CD2 4.37Å; L1482-Y1651 HydrophobicContact CD1-CE2 3.68Å; L1482-Y1651 HydrophobicContact CD2-CE2 4.27Å; L1482-Y1651 HydrophobicContact CG-CE2 4.49Å; L1482-Y1651 WeakPolarHBondContact O-CE2 3.4Å; M1483-Y1651 HydrophobicContact CE-CD2 3.73Å; M1483-Y1651 HydrophobicContact CE-CG 4.14Å; M1483-Y1651 HydrophobicContact SD-CD2 3.95Å; L1588-Y1651 HydrophobicContact CD1-CD1 3.88Å; L1588-Y1651 HydrophobicContact CD1-CE1 4.16Å; L1588-Y1651 HydrophobicContact CD2-CD1 4.27Å; L1588-Y1651 HydrophobicContact CD2-CE1 3.76Å; L1588-Y1651 HydrophobicContact CG-CD1 4.19Å; L1588-Y1651 HydrophobicContact CG-CE1 4.04Å; I1641-Y1651 HydrophobicContact CB-CD1 4.49Å; I1641-Y1651 HydrophobicContact CD1-CD1 3.87Å; I1641-Y1651 HydrophobicContact CD1-CE1 3.94Å; I1641-Y1651 HydrophobicContact CG1-CD1 3.82Å; I1641-Y1651 HydrophobicContact CG1-CE1 4.3Å; I1641-Y1651 HydrophobicContact CG2-CD1 4.06Å; I1641-Y1651 HydrophobicContact CG2-CE1 4.1Å; H1649-Y1651 HydrophobicContact CB-CD2 4.32Å; H1649-Y1651 HydrophobicContact CB-CE1 4.42Å; H1649-Y1651 HydrophobicContact CB-CE2 3.64Å; H1649-Y1651 AromaticContact ND1-CZ 3.89Å; H1649-Y1651 PolarHBondContact ND1-OH 3.09Å; H1649-Y1651 VanDerWaalsContact ND1-OH 3.15Å; Y1651-K1653 PolarHBondContact O-N 3.03Å; Y1651-K1653 VanDerWaalsContact O-N 3.09Å; Y1651-Q1654 CarbonylContact O-C 3.55Å; Y1651-Q1654 PolarHBondContact O-N 3.07Å; Y1651-T1655 WeakPolarHBondContact O-CG2 3.47Å; Y1651-T1655 PolarHBondContact O-N 3.02Å; Y1651-T1655 VanDerWaalsContact O-N 3.15Å; Y1651-T1655 PolarHBondContact O-OG1 3.29Å
1652	L	82.3	Confident	82.2	Confident	28.4 Å²	28.4	38.9 Å²	38.9	15%	0.149	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-22	-173.8	-63.6	166.8	0	0	0	113.9	Y1635 G1640 I1642 F1650 Q1654 T1655 L2136 P2137 I2148	Y1635-L1652 HydrophobicContact CD2-CD1 4.26Å; Y1635-L1652 HydrophobicContact CE2-CD1 3.56Å; Y1635-L1652 VanDerWaalsContact CE2-CD1 3.49Å; G1640-L1652 VanDerWaalsContact O-CB 3.32Å; G1640-L1652 WeakPolarHBondContact O-CB 3.35Å; G1640-L1652 PolarHBondContact O-N 3.29Å; I1642-L1652 HydrophobicContact CD1-CD1 4.28Å; I1642-L1652 HydrophobicContact CD1-CD2 4.35Å; I1642-L1652 HydrophobicContact CD1-CG 4.44Å; I1642-L1652 HydrophobicContact CG1-CD1 4.23Å; I1642-L1652 HydrophobicContact CG1-CG 4.4Å; F1650-L1652 HydrophobicContact CB-CD2 4.5Å; F1650-L1652 HydrophobicContact CD1-CD2 3.54Å; F1650-L1652 VanDerWaalsContact CD1-CD2 3.45Å; F1650-L1652 HydrophobicContact CD1-CG 4.11Å; F1650-L1652 HydrophobicContact CE1-CD2 3.52Å; F1650-L1652 HydrophobicContact CE1-CG 4.32Å; F1650-L1652 HydrophobicContact CZ-CD2 4.45Å; F1650-L1652 PolarHBondContact O-N 3.2Å; L1652-Q1654 VanDerWaalsContact C-N 3.34Å; L1652-T1655 WeakPolarHBondContact CA-OG1 3.37Å; L1652-T1655 PolarHBondContact O-OG1 2.86Å; L1652-L2136 HydrophobicContact CB-CD2 3.83Å; L1652-L2136 HydrophobicContact CD1-CD2 4.42Å; L1652-P2137 HydrophobicContact CD1-CG 3.94Å; L1652-I2148 HydrophobicContact CD1-CD1 4.27Å
1653	K	78.5	Confident	82.1	Confident	83.2 Å²	83.2	38.7 Å²	38.7	36%	0.362	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-14.7	175.8	-60.6	-176.2	177.7	165.2	0	113.9	S1638 H1639 Y1651 W1657 Y2134 L2136	S1638-K1653 PolarHBondContact O-NZ 3.13Å; S1638-K1653 VanDerWaalsContact O-NZ 3.15Å; H1639-K1653 VanDerWaalsContact C-NZ 3.27Å; H1639-K1653 WeakPolarHBondContact O-CD 3.27Å; H1639-K1653 VanDerWaalsContact O-CE 3.24Å; H1639-K1653 WeakPolarHBondContact O-CE 3.35Å; H1639-K1653 PolarHBondContact O-NZ 3.4Å; Y1651-K1653 PolarHBondContact O-N 3.03Å; Y1651-K1653 VanDerWaalsContact O-N 3.09Å; K1653-W1657 PolarHBondContact O-NE1 3.08Å; K1653-Y2134 HydrophobicContact CB-CD1 4.3Å; K1653-Y2134 HydrophobicContact CB-CD2 4.11Å; K1653-Y2134 HydrophobicContact CB-CE1 4.46Å; K1653-Y2134 HydrophobicContact CB-CE2 4.22Å; K1653-Y2134 HydrophobicContact CB-CG 4.1Å; K1653-Y2134 HydrophobicContact CD-CD2 4.41Å; K1653-Y2134 HydrophobicContact CD-CE2 3.91Å; K1653-Y2134 HydrophobicContact CG-CD1 4.48Å; K1653-Y2134 HydrophobicContact CG-CD2 3.74Å; K1653-Y2134 HydrophobicContact CG-CE2 3.68Å; K1653-Y2134 HydrophobicContact CG-CG 4.25Å; K1653-L2136 HydrophobicContact CG-CD2 4.09Å
1654	Q	76.3	Confident	81.9	Confident	84 Å²	84	38.5 Å²	38.5	39%	0.393	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.2	-12.8	-176.2	-64.5	-179	-10.4	0	0	113.2	L1482 M1483 L1588 Y1651 L1652	L1482-Q1654 VanDerWaalsContact CD1-NE2 3.35Å; M1483-Q1654 HydrophobicContact CE-CB 3.68Å; L1588-Q1654 VanDerWaalsContact CD1-NE2 3.34Å; Y1651-Q1654 CarbonylContact O-C 3.55Å; Y1651-Q1654 PolarHBondContact O-N 3.07Å; L1652-Q1654 VanDerWaalsContact C-N 3.34Å
1655	T	69.9	Low	81.6	Confident	44.8 Å²	44.8	38.4 Å²	38.4	28%	0.275	19%	0.192	S	C	.	.	S	Bend	trans	-84.7	-177.7	176.3	54.2	0	0	0	0	111.9	M1483 F1650 Y1651 L1652 W1657	M1483-T1655 HydrophobicContact CE-CG2 3.63Å; M1483-T1655 HydrophobicContact SD-CG2 4.34Å; F1650-T1655 HydrophobicContact CD1-CG2 4.09Å; F1650-T1655 HydrophobicContact CD2-CG2 4.3Å; F1650-T1655 HydrophobicContact CE1-CG2 3.83Å; F1650-T1655 HydrophobicContact CE2-CG2 3.94Å; F1650-T1655 HydrophobicContact CG-CG2 4.29Å; F1650-T1655 HydrophobicContact CZ-CG2 3.89Å; F1650-T1655 VanDerWaalsContact CZ-CG2 3.49Å; F1650-T1655 WeakPolarHBondContact CZ-OG1 3.41Å; Y1651-T1655 WeakPolarHBondContact O-CG2 3.47Å; Y1651-T1655 PolarHBondContact O-N 3.02Å; Y1651-T1655 VanDerWaalsContact O-N 3.15Å; Y1651-T1655 PolarHBondContact O-OG1 3.29Å; L1652-T1655 WeakPolarHBondContact CA-OG1 3.37Å; L1652-T1655 PolarHBondContact O-OG1 2.86Å; T1655-W1657 PolarHBondContact O-N 2.98Å
1656	D	71.7	Confident	81.1	Confident	86.4 Å²	86.4	41.8 Å²	41.8	46%	0.462	21%	0.213	S	C	.	.			trans	-23.7	98.9	174.4	-64.6	-37.4	0	0	0	113.8	H1658 L2099	D1656-H1658 PolarHBondContact O-CD2 3.12Å; D1656-H1658 VanDerWaalsContact O-CD2 3.26Å; D1656-H1658 PolarHBondContact O-N 3.34Å; D1656-H1658 VanDerWaalsContact O-N 3.13Å; D1656-L2099 HydrophobicContact CB-CD2 3.72Å
1657	W	80.5	Confident	80.9	Confident	85.4 Å²	85.4	46.6 Å²	46.6	32%	0.323	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	129.8	177.8	-67.5	3.7	0	0	0	111	K1653 T1655 I1659 F2045 I2054 V2065 V2100 I2132 H2133	K1653-W1657 PolarHBondContact O-NE1 3.08Å; T1655-W1657 PolarHBondContact O-N 2.98Å; W1657-I1659 VanDerWaalsContact C-N 3.34Å; W1657-I1659 PolarHBondContact O-N 2.74Å; W1657-F2045 AromaticContact CH2-CE1 3.83Å; W1657-F2045 HydrophobicContact CH2-CE1 3.89Å; W1657-F2045 AromaticContact CH2-CZ 3.78Å; W1657-F2045 HydrophobicContact CH2-CZ 3.97Å; W1657-F2045 AromaticContact CZ3-CE1 3.87Å; W1657-F2045 HydrophobicContact CZ3-CE1 3.94Å; W1657-F2045 HydrophobicContact CZ3-CZ 4.4Å; W1657-I2054 HydrophobicContact CH2-CD1 4.29Å; W1657-V2065 HydrophobicContact CE3-CG1 3.62Å; W1657-V2065 HydrophobicContact CH2-CG2 4.4Å; W1657-V2065 HydrophobicContact CZ3-CB 4.28Å; W1657-V2065 HydrophobicContact CZ3-CG1 3.53Å; W1657-V2065 VanDerWaalsContact CZ3-CG1 3.48Å; W1657-V2065 HydrophobicContact CZ3-CG2 3.79Å; W1657-V2100 HydrophobicContact CB-CB 4.43Å; W1657-V2100 HydrophobicContact CB-CG1 3.8Å; W1657-V2100 WeakPolarHBondContact O-CB 3.15Å; W1657-V2100 WeakPolarHBondContact O-CG1 3.41Å; W1657-V2100 PolarHBondContact O-N 3.02Å; W1657-I2132 HydrophobicContact CB-CG2 3.76Å; W1657-I2132 HydrophobicContact CD2-CG2 4.14Å; W1657-I2132 HydrophobicContact CE3-CG2 3.61Å; W1657-I2132 VanDerWaalsContact CE3-CG2 3.48Å; W1657-I2132 HydrophobicContact CG-CG2 4.25Å; W1657-I2132 HydrophobicContact CZ3-CG2 4.36Å; W1657-H2133 CarbonylContact C-O 3.49Å; W1657-H2133 WeakPolarHBondContact CA-O 3.5Å
1658	H	82.5	Confident	80.8	Confident	66 Å²	66	51.7 Å²	51.7	31%	0.306	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	136.6	175.7	-91.8	-107.3	0	0	0	111	D1656 S1660 D2096 G2098 I2132 H2133 Q2135	D1656-H1658 PolarHBondContact O-CD2 3.12Å; D1656-H1658 VanDerWaalsContact O-CD2 3.26Å; D1656-H1658 PolarHBondContact O-N 3.34Å; D1656-H1658 VanDerWaalsContact O-N 3.13Å; H1658-S1660 PolarHBondContact O-N 2.68Å; H1658-D2096 IonicContact CE1-OD2 3.46Å; H1658-D2096 IonicContact CG-OD2 3.34Å; H1658-D2096 IonicContact ND1-OD1 3.03Å; H1658-D2096 PolarHBondContact ND1-OD1 3.02Å; H1658-D2096 IonicContact ND1-OD2 3.47Å; H1658-D2096 PolarHBondContact ND1-OD2 3.29Å; H1658-G2098 CarbonylContact C-O 3.55Å; H1658-G2098 VanDerWaalsContact CA-O 3.29Å; H1658-G2098 WeakPolarHBondContact CA-O 3.28Å; H1658-I2132 CarbonylContact O-C 3.58Å; H1658-I2132 VanDerWaalsContact O-CA 3.28Å; H1658-I2132 WeakPolarHBondContact O-CA 3.34Å; H1658-H2133 PolarHBondContact N-O 3.32Å; H1658-H2133 PolarHBondContact O-N 3.31Å; H1658-H2133 PolarHBondContact O-ND1 3.1Å; H1658-Q2135 HydrophobicContact CB-CB 4.47Å; H1658-Q2135 PolarHBondContact CE1-OE1 2.84Å; H1658-Q2135 VanDerWaalsContact CE1-OE1 3.22Å; H1658-Q2135 PolarHBondContact ND1-OE1 2.79Å
1659	I	86.8	Confident	80.9	Confident	31.6 Å²	31.6	53.9 Å²	53.9	16%	0.162	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	126.2	174.9	-156.7	176.7	0	0	0	110.7	W1657 D2096 L2097 G2098 V2100 F2103 F2105 Y2130 R2131 I2132	W1657-I1659 VanDerWaalsContact C-N 3.34Å; W1657-I1659 PolarHBondContact O-N 2.74Å; I1659-D2096 VanDerWaalsContact O-OD1 3.09Å; I1659-L2097 HydrophobicContact CG2-CB 3.88Å; I1659-L2097 WeakPolarHBondContact O-CA 3.34Å; I1659-L2097 VanDerWaalsContact O-CB 3.32Å; I1659-L2097 WeakPolarHBondContact O-CB 3.41Å; I1659-L2097 PolarHBondContact O-N 2.83Å; I1659-G2098 PolarHBondContact N-O 3.15Å; I1659-V2100 HydrophobicContact CB-CB 4.41Å; I1659-V2100 HydrophobicContact CB-CG2 4.33Å; I1659-F2103 HydrophobicContact CD1-CB 4.26Å; I1659-F2103 HydrophobicContact CD1-CD1 3.42Å; I1659-F2103 VanDerWaalsContact CD1-CD1 3.44Å; I1659-F2103 HydrophobicContact CD1-CD2 4.03Å; I1659-F2103 HydrophobicContact CD1-CE1 3.66Å; I1659-F2103 HydrophobicContact CD1-CE2 4.24Å; I1659-F2103 HydrophobicContact CD1-CG 3.62Å; I1659-F2103 HydrophobicContact CD1-CZ 4.07Å; I1659-F2103 HydrophobicContact CG2-CB 3.92Å; I1659-F2103 HydrophobicContact CG2-CD2 3.97Å; I1659-F2103 HydrophobicContact CG2-CG 3.99Å; I1659-F2105 HydrophobicContact CD1-CE1 4.02Å; I1659-F2105 HydrophobicContact CD1-CE2 4.23Å; I1659-F2105 HydrophobicContact CD1-CZ 3.45Å; I1659-F2105 VanDerWaalsContact CD1-CZ 3.45Å; I1659-Y2130 HydrophobicContact CD1-CD1 4.05Å; I1659-Y2130 HydrophobicContact CD1-CG 3.99Å; I1659-Y2130 HydrophobicContact CG1-CD1 4.18Å; I1659-Y2130 HydrophobicContact CG1-CG 4.31Å; I1659-R2131 WeakPolarHBondContact CA-O 3.33Å; I1659-I2132 HydrophobicContact CB-CG1 4.41Å; I1659-I2132 HydrophobicContact CD1-CG1 4.37Å; I1659-I2132 HydrophobicContact CG1-CG1 4.12Å
1660	S	85.6	Confident	80.8	Confident	14.6 Å²	14.6	56.9 Å²	56.9	10%	0.102	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	146.5	177.4	60.4	0	0	0	0	111	H1658 V1662 R1686 V2095 Y2130 R2131 H2133	H1658-S1660 PolarHBondContact O-N 2.68Å; S1660-V1662 PolarHBondContact O-N 3.07Å; S1660-R1686 PolarHBondContact OG-NH2 2.78Å; S1660-V2095 WeakPolarHBondContact CA-O 3.36Å; S1660-V2095 WeakPolarHBondContact CB-O 3.32Å; S1660-Y2130 CarbonylContact O-C 3.49Å; S1660-Y2130 VanDerWaalsContact O-CA 3.27Å; S1660-Y2130 WeakPolarHBondContact O-CA 3.17Å; S1660-R2131 PolarHBondContact N-O 2.99Å; S1660-R2131 PolarHBondContact O-N 2.93Å; S1660-R2131 PolarHBondContact OG-O 2.9Å; S1660-R2131 VanDerWaalsContact OG-O 3.11Å; S1660-H2133 PolarHBondContact OG-CE1 3Å
1661	A	85.2	Confident	80.7	Confident	17.8 Å²	17.8	56.3 Å²	56.3	15%	0.147	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	132.8	173.3	0	0	0	0	0	110.3	R1686 V2095 L2097 Y2130	A1661-R1686 VanDerWaalsContact O-CD 3.24Å; A1661-R1686 WeakPolarHBondContact O-CD 3.33Å; A1661-R1686 WeakPolarHBondContact O-CG 3.41Å; A1661-R1686 VanDerWaalsContact O-CZ 3.31Å; A1661-R1686 PolarHBondContact O-NE 3.22Å; A1661-R1686 VanDerWaalsContact O-NE 3.1Å; A1661-R1686 PolarHBondContact O-NH2 3.1Å; A1661-R1686 VanDerWaalsContact O-NH2 3.15Å; A1661-V2095 PolarHBondContact N-O 3.17Å; A1661-V2095 VanDerWaalsContact N-O 3.15Å; A1661-L2097 HydrophobicContact CB-CD1 4.47Å; A1661-Y2130 HydrophobicContact CB-CD1 4.47Å; A1661-Y2130 HydrophobicContact CB-CE1 4.47Å
1662	V	86.4	Confident	80.3	Confident	9.2 Å²	9.2	55.1 Å²	55.1	6%	0.056	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	-51.2	176.7	176.6	0	0	0	0	110.4	S1660 T1685 R1686 L1704 L1715 W1766 F2120 V2129 R2131	S1660-V1662 PolarHBondContact O-N 3.07Å; V1662-T1685 CarbonylContact O-C 3.56Å; V1662-R1686 VanDerWaalsContact O-CG 3.31Å; V1662-R1686 WeakPolarHBondContact O-CG 3.41Å; V1662-R1686 PolarHBondContact O-N 2.97Å; V1662-L1704 HydrophobicContact CG1-CD2 4.07Å; V1662-L1715 HydrophobicContact CG1-CD2 3.86Å; V1662-W1766 HydrophobicContact CG1-CB 3.92Å; V1662-W1766 HydrophobicContact CG1-CD2 3.99Å; V1662-W1766 HydrophobicContact CG1-CE3 4.49Å; V1662-W1766 HydrophobicContact CG1-CG 3.65Å; V1662-F2120 HydrophobicContact CG2-CD1 4.1Å; V1662-F2120 HydrophobicContact CG2-CE1 3.99Å; V1662-V2129 WeakPolarHBondContact CB-O 3.23Å; V1662-V2129 PolarHBondContact N-O 2.97Å; V1662-R2131 HydrophobicContact CG2-CB 3.46Å; V1662-R2131 VanDerWaalsContact CG2-CB 3.46Å
1663	I	87.2	Confident	80.1	Confident	4.4 Å²	4.4	55.6 Å²	55.6	2%	0.023	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	153.2	-177.5	-178.2	161.2	0	0	0	109.6	T1685 L1688 L1690 I1706 L1715 R2128 V2129	I1663-T1685 HydrophobicContact CB-CG2 4.14Å; I1663-T1685 HydrophobicContact CD1-CG2 4.01Å; I1663-T1685 HydrophobicContact CG1-CG2 4.29Å; I1663-T1685 WeakPolarHBondContact CG1-O 3.4Å; I1663-L1688 HydrophobicContact CD1-CB 4.02Å; I1663-L1688 HydrophobicContact CD1-CD1 4.18Å; I1663-L1688 HydrophobicContact CG1-CB 4.1Å; I1663-L1690 HydrophobicContact CD1-CD2 4.1Å; I1663-L1690 HydrophobicContact CG1-CD1 4.32Å; I1663-L1690 HydrophobicContact CG1-CD2 4.09Å; I1663-L1690 HydrophobicContact CG1-CG 4.3Å; I1663-L1690 HydrophobicContact CG2-CD1 4.2Å; I1663-I1706 HydrophobicContact CG2-CD1 3.45Å; I1663-I1706 VanDerWaalsContact CG2-CD1 3.43Å; I1663-L1715 HydrophobicContact CB-CD1 4.38Å; I1663-L1715 HydrophobicContact CB-CD2 4.2Å; I1663-L1715 HydrophobicContact CD1-CD1 4.06Å; I1663-L1715 HydrophobicContact CD1-CD2 4.23Å; I1663-L1715 HydrophobicContact CG2-CD1 4.09Å; I1663-L1715 HydrophobicContact CG2-CD2 4.15Å; I1663-R2128 WeakPolarHBondContact O-CA 3.25Å; I1663-V2129 HydrophobicContact CG2-CB 3.79Å; I1663-V2129 HydrophobicContact CG2-CG2 4.06Å; I1663-V2129 PolarHBondContact N-O 2.85Å; I1663-V2129 PolarHBondContact O-N 3.21Å
1664	G	84.4	Confident	80.1	Confident	4.8 Å²	4.8	55.6 Å²	55.6	5%	0.049	28%	0.278	C	S	.	.			trans	111.7	143	175.2	0	0	0	0	0	114.4	R1686 L1688 N2127 R2128	G1664-R1686 CarbonylContact C-O 3.55Å; G1664-R1686 PolarHBondContact N-O 3.33Å; G1664-R1686 VanDerWaalsContact O-O 3.1Å; G1664-L1688 VanDerWaalsContact CA-O 3.23Å; G1664-L1688 WeakPolarHBondContact CA-O 3.42Å; G1664-L1688 PolarHBondContact N-O 2.83Å; G1664-L1688 VanDerWaalsContact N-O 3.12Å; G1664-N2127 VanDerWaalsContact CA-O 3.25Å; G1664-N2127 WeakPolarHBondContact CA-O 3.32Å; G1664-R2128 VanDerWaalsContact C-CG 3.47Å; G1664-R2128 WeakPolarHBondContact O-CG 3.23Å; G1664-R2128 PolarHBondContact O-NE 3.02Å; G1664-R2128 PolarHBondContact O-NH2 2.88Å
1665	L	79.6	Confident	80.2	Confident	38.8 Å²	38.8	52.6 Å²	52.6	20%	0.203	27%	0.266	C	S	.	.			trans	-108	139	172.2	-71.4	176.4	0	0	0	110.2	E1667 Q1668 Q1687 L1688 E2092 N2127	L1665-E1667 VanDerWaalsContact C-N 3.32Å; L1665-E1667 PolarHBondContact O-N 3.29Å; L1665-Q1668 HydrophobicContact CB-CB 4.12Å; L1665-Q1668 HydrophobicContact CD1-CB 4.34Å; L1665-Q1668 PolarHBondContact O-N 3.2Å; L1665-Q1668 VanDerWaalsContact O-O 3.08Å; L1665-Q1687 VanDerWaalsContact CD1-O 3.27Å; L1665-Q1687 WeakPolarHBondContact CD1-O 3.36Å; L1665-Q1687 HydrophobicContact CD2-CB 4.35Å; L1665-Q1687 HydrophobicContact CD2-CG 4.39Å; L1665-Q1687 WeakPolarHBondContact CG-O 3.4Å; L1665-L1688 PolarHBondContact N-O 3.02Å; L1665-E2092 WeakPolarHBondContact CD2-OE1 3.24Å; L1665-E2092 WeakPolarHBondContact CD2-OE2 3.07Å; L1665-N2127 PolarHBondContact N-O 3.17Å; L1665-N2127 VanDerWaalsContact O-CB 3.31Å; L1665-N2127 WeakPolarHBondContact O-CB 3.39Å
1666	T	73.9	Confident	80.2	Confident	71 Å²	71	54.5 Å²	54.5	44%	0.436	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-28.2	178.4	-11.4	0	0	0	0	112.8	Q1668 H2126 N2127 R2128	T1666-Q1668 PolarHBondContact O-N 3.34Å; T1666-H2126 VanDerWaalsContact CA-O 3.23Å; T1666-H2126 WeakPolarHBondContact CA-O 3.33Å; T1666-H2126 HydrophobicContact CG2-CB 4.33Å; T1666-H2126 PolarHBondContact OG1-O 3.49Å; T1666-N2127 PolarHBondContact O-ND2 3.26Å; T1666-R2128 PolarHBondContact OG1-NE 2.84Å; T1666-R2128 PolarHBondContact OG1-NH1 2.87Å; T1666-R2128 VanDerWaalsContact OG1-NH1 3.14Å; T1666-R2128 PolarHBondContact OG1-NH2 3.45Å
1667	E	73.9	Confident	80	Confident	154.2 Å²	154.2	58.8 Å²	58.8	72%	0.721	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	36.6	178.3	-61.4	-172.6	179.4	0	0	113.1	L1665 S1689 R2086	L1665-E1667 VanDerWaalsContact C-N 3.32Å; L1665-E1667 PolarHBondContact O-N 3.29Å; E1667-S1689 WeakPolarHBondContact O-CB 3.45Å; E1667-R2086 IonicContact OE1-NH1 3.58Å
1668	Q	78.4	Confident	79.5	Confident	107.2 Å²	107.2	54.9 Å²	54.9	50%	0.501	28%	0.276	S	S	.	.			trans	-99.3	124.7	179.9	-168.3	177.8	4.3	0	0	111.3	L1665 T1666 R1670 S1689 Y1691	L1665-Q1668 HydrophobicContact CB-CB 4.12Å; L1665-Q1668 HydrophobicContact CD1-CB 4.34Å; L1665-Q1668 PolarHBondContact O-N 3.2Å; L1665-Q1668 VanDerWaalsContact O-O 3.08Å; T1666-Q1668 PolarHBondContact O-N 3.34Å; Q1668-R1670 PolarHBondContact O-N 3.48Å; Q1668-S1689 PolarHBondContact O-OG 2.88Å; Q1668-Y1691 VanDerWaalsContact CG-O 3.31Å; Q1668-Y1691 WeakPolarHBondContact CG-O 3.45Å; Q1668-Y1691 PolarHBondContact NE2-O 3.07Å
1669	R	83.6	Confident	78.6	Confident	71.2 Å²	71.2	55.1 Å²	55.1	27%	0.269	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-77.9	139.9	167.8	-106.5	176.9	146	-124	-5.4	109.9	S1671 P1672 D1674 C1675 S1689 L1690 Y1691 N1692 D1708 N2124 N2127	R1669-S1671 VanDerWaalsContact C-N 3.33Å; R1669-S1671 PolarHBondContact NH1-O 3.13Å; R1669-S1671 PolarHBondContact O-N 3Å; R1669-P1672 PolarHBondContact NH1-O 2.91Å; R1669-P1672 PolarHBondContact NH2-O 3.34Å; R1669-D1674 WeakPolarHBondContact CD-O 3.45Å; R1669-D1674 PolarHBondContact NH1-O 2.92Å; R1669-C1675 WeakPolarHBondContact CD-SG 3.32Å; R1669-S1689 WeakPolarHBondContact CA-OG 3.47Å; R1669-L1690 CarbonylContact C-O 3.59Å; R1669-L1690 VanDerWaalsContact CA-O 3.27Å; R1669-L1690 WeakPolarHBondContact CA-O 3.29Å; R1669-L1690 WeakPolarHBondContact CB-O 3.22Å; R1669-L1690 PolarHBondContact N-O 2.95Å; R1669-Y1691 PolarHBondContact NH1-O 3.02Å; R1669-Y1691 WeakPolarHBondContact O-CD2 3.26Å; R1669-N1692 PolarHBondContact NH1-OD1 2.96Å; R1669-D1708 IonicContact CZ-OD2 3.68Å; R1669-D1708 IonicContact NE-OD2 3.13Å; R1669-D1708 PolarHBondContact NE-OD2 3.22Å; R1669-D1708 PolarHBondContact NH2-O 3.31Å; R1669-D1708 IonicContact NH2-OD1 3.58Å; R1669-D1708 IonicContact NH2-OD2 3.4Å; R1669-D1708 PolarHBondContact NH2-OD2 2.88Å; R1669-N2124 PolarHBondContact NH1-OD1 3.14Å; R1669-N2124 PolarHBondContact NH2-O 3.02Å; R1669-N2124 PolarHBondContact NH2-OD1 3.19Å; R1669-N2127 HydrophobicContact CG-CB 4.49Å; R1669-N2127 VanDerWaalsContact CG-ND2 3.31Å; R1669-N2127 WeakPolarHBondContact CG-ND2 3.29Å; R1669-N2127 WeakPolarHBondContact CG-OD1 3.37Å; R1669-N2127 PolarHBondContact NE-OD1 2.97Å; R1669-N2127 VanDerWaalsContact NE-OD1 3.14Å; R1669-N2127 PolarHBondContact NH1-OD1 3.16Å; R1669-N2127 PolarHBondContact NH2-OD1 3.24Å
1670	R	81.7	Confident	77.2	Confident	102.6 Å²	102.6	56.4 Å²	56.4	39%	0.387	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-73	167.1	175.6	-134.4	-177.8	98.5	115.9	0.3	111.2	Q1668 P1672 D1674 C1678 S1689 L1690 Y1691 D1708 F1711 R1713	Q1668-R1670 PolarHBondContact O-N 3.48Å; R1670-P1672 PolarHBondContact NH1-O 2.85Å; R1670-D1674 VanDerWaalsContact CD-O 3.25Å; R1670-D1674 WeakPolarHBondContact CD-O 3.39Å; R1670-D1674 WeakPolarHBondContact CG-O 3.24Å; R1670-D1674 PolarHBondContact NH1-O 3.41Å; R1670-C1678 WeakPolarHBondContact CD-SG 3.46Å; R1670-S1689 PolarHBondContact N-OG 3.43Å; R1670-L1690 PolarHBondContact N-O 2.88Å; R1670-L1690 VanDerWaalsContact N-O 3.11Å; R1670-Y1691 VanDerWaalsContact O-CD2 3.25Å; R1670-Y1691 WeakPolarHBondContact O-CD2 3.22Å; R1670-Y1691 WeakPolarHBondContact O-CE2 3.29Å; R1670-D1708 IonicContact CZ-OD2 2.84Å; R1670-D1708 IonicContact NE-OD2 3.56Å; R1670-D1708 PolarHBondContact NE-OD2 3.11Å; R1670-D1708 PolarHBondContact NH2-O 2.82Å; R1670-D1708 IonicContact NH2-OD1 3.01Å; R1670-D1708 IonicContact NH2-OD2 3.34Å; R1670-D1708 PolarHBondContact NH2-OD2 3.11Å; R1670-F1711 VanDerWaalsContact NH2-CD2 3.29Å; R1670-R1713 VanDerWaalsContact NE-NH2 3.17Å
1671	S	80.7	Confident	75.8	Confident	48 Å²	48	63.4 Å²	63.4	34%	0.336	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-83.9	143.9	171.4	91	0	0	0	0	110.6	R1669 N1673 D1674 Y1691	R1669-S1671 VanDerWaalsContact C-N 3.33Å; R1669-S1671 PolarHBondContact NH1-O 3.13Å; R1669-S1671 PolarHBondContact O-N 3Å; S1671-N1673 VanDerWaalsContact C-N 3.27Å; S1671-N1673 PolarHBondContact O-N 3.26Å; S1671-N1673 PolarHBondContact OG-N 3.04Å; S1671-N1673 VanDerWaalsContact OG-N 3.08Å; S1671-D1674 WeakPolarHBondContact OG-CB 3.28Å; S1671-D1674 PolarHBondContact OG-N 2.68Å; S1671-D1674 VanDerWaalsContact OG-N 3.11Å; S1671-D1674 PolarHBondContact OG-O 3.15Å; S1671-Y1691 VanDerWaalsContact C-CD2 3.46Å; S1671-Y1691 WeakPolarHBondContact O-CD2 3.29Å
1672	P	77.5	Confident	74.4	Confident	4.2 Å²	4.2	69.8 Å²	69.8	3%	0.027	36%	0.36	C	S	.	.	S	Bend	trans	-62.4	-37	-178.8	12.8	-19.6	0	0	0	113.3	R1669 R1670 Y1691 G1710 F1711 F1781 E1783 L1786	R1669-P1672 PolarHBondContact NH1-O 2.91Å; R1669-P1672 PolarHBondContact NH2-O 3.34Å; R1670-P1672 PolarHBondContact NH1-O 2.85Å; P1672-Y1691 HydrophobicContact CB-CD1 4.19Å; P1672-Y1691 HydrophobicContact CB-CD2 4.23Å; P1672-Y1691 HydrophobicContact CB-CE1 4Å; P1672-Y1691 HydrophobicContact CB-CE2 4.04Å; P1672-Y1691 HydrophobicContact CB-CG 4.26Å; P1672-Y1691 VanDerWaalsContact CD-CE2 3.46Å; P1672-Y1691 HydrophobicContact CG-CD2 4.12Å; P1672-Y1691 HydrophobicContact CG-CE1 4.41Å; P1672-Y1691 HydrophobicContact CG-CE2 3.82Å; P1672-Y1691 VanDerWaalsContact N-CE2 3.33Å; P1672-G1710 PolarHBondContact O-N 3.11Å; P1672-G1710 VanDerWaalsContact O-N 3.12Å; P1672-F1711 WeakPolarHBondContact O-CD2 3.36Å; P1672-F1711 VanDerWaalsContact O-CE2 3.32Å; P1672-F1711 WeakPolarHBondContact O-CE2 3.23Å; P1672-F1781 HydrophobicContact CB-CB 4.29Å; P1672-F1781 HydrophobicContact CG-CB 4.04Å; P1672-F1781 VanDerWaalsContact CG-O 3.25Å; P1672-F1781 WeakPolarHBondContact CG-O 3.44Å; P1672-E1783 WeakPolarHBondContact CD-OE1 3.45Å; P1672-E1783 HydrophobicContact CG-CB 4.41Å; P1672-E1783 HydrophobicContact CG-CG 3.81Å; P1672-L1786 HydrophobicContact CB-CD1 3.9Å; P1672-L1786 HydrophobicContact CB-CD2 3.75Å; P1672-L1786 VanDerWaalsContact CB-CD2 3.42Å; P1672-L1786 HydrophobicContact CB-CG 4.16Å; P1672-L1786 HydrophobicContact CG-CD1 3.84Å; P1672-L1786 HydrophobicContact CG-CD2 4.22Å; P1672-L1786 HydrophobicContact CG-CG 4.27Å
1673	N	78	Confident	73.2	Confident	38.2 Å²	38.2	73.8 Å²	73.8	20%	0.204	38%	0.376	C	S	.	.	S	Bend	trans	-101.4	-17.5	-169.1	-68.2	-42.9	0	0	0	115.2	S1671 F1711 K1773 N1780 F1781	S1671-N1673 VanDerWaalsContact C-N 3.27Å; S1671-N1673 PolarHBondContact O-N 3.26Å; S1671-N1673 PolarHBondContact OG-N 3.04Å; S1671-N1673 VanDerWaalsContact OG-N 3.08Å; N1673-F1711 WeakPolarHBondContact O-CE2 3.39Å; N1673-F1711 WeakPolarHBondContact O-CZ 3.35Å; N1673-K1773 WeakPolarHBondContact O-CE 3.35Å; N1673-N1780 WeakPolarHBondContact OD1-CA 3.34Å; N1673-F1781 PolarHBondContact ND2-N 3.01Å; N1673-F1781 VanDerWaalsContact ND2-N 3.18Å; N1673-F1781 PolarHBondContact ND2-O 3.31Å; N1673-F1781 WeakPolarHBondContact OD1-CD2 3.21Å; N1673-F1781 PolarHBondContact OD1-N 3Å
1674	D	78.5	Confident	72.2	Confident	84 Å²	84	76.7 Å²	76.7	45%	0.449	40%	0.396	S	S	.	.			trans	-100	127.5	175.8	178	29.7	0	0	0	111	R1669 R1670 S1671 S1676	R1669-D1674 WeakPolarHBondContact CD-O 3.45Å; R1669-D1674 PolarHBondContact NH1-O 2.92Å; R1670-D1674 VanDerWaalsContact CD-O 3.25Å; R1670-D1674 WeakPolarHBondContact CD-O 3.39Å; R1670-D1674 WeakPolarHBondContact CG-O 3.24Å; R1670-D1674 PolarHBondContact NH1-O 3.41Å; S1671-D1674 WeakPolarHBondContact OG-CB 3.28Å; S1671-D1674 PolarHBondContact OG-N 2.68Å; S1671-D1674 VanDerWaalsContact OG-N 3.11Å; S1671-D1674 PolarHBondContact OG-O 3.15Å; D1674-S1676 VanDerWaalsContact CG-OG 3.3Å; D1674-S1676 WeakPolarHBondContact OD1-CB 3.35Å; D1674-S1676 PolarHBondContact OD1-N 3.07Å; D1674-S1676 PolarHBondContact OD1-OG 2.99Å; D1674-S1676 VanDerWaalsContact OD1-OG 3.08Å; D1674-S1676 PolarHBondContact OD2-OG 3.1Å
1675	C	77.4	Confident	71.6	Confident	20.6 Å²	20.6	77.1 Å²	77.1	14%	0.139	40%	0.397	C	S	.	.			trans	-127.3	30.7	172.8	-134.7	0	0	0	0	112.2	R1669 R1677 C1678 F1711 R1713	R1669-C1675 WeakPolarHBondContact CD-SG 3.32Å; C1675-R1677 PolarHBondContact O-N 3.24Å; C1675-C1678 WeakPolarHBondContact CA-SG 3.35Å; C1675-C1678 HydrophobicContact CB-CB 3.79Å; C1675-C1678 WeakPolarHBondContact CB-SG 3.3Å; C1675-C1678 VanDerWaalsContact O-CB 3.27Å; C1675-C1678 WeakPolarHBondContact O-CB 3.28Å; C1675-C1678 PolarHBondContact O-N 3.04Å; C1675-C1678 PolarHBondContact O-SG 2.84Å; C1675-C1678 VanDerWaalsContact O-SG 3.38Å; C1675-C1678 VanDerWaalsContact SG-CA 3.51Å; C1675-C1678 WeakPolarHBondContact SG-CB 3.37Å; C1675-C1678 PolarHBondContact SG-N 2.79Å; C1675-C1678 VanDerWaalsContact SG-N 3.45Å; C1675-C1678 CovalentContact SG-SG 2.02Å; C1675-C1678 PolarHBondContact SG-SG 3.15Å; C1675-F1711 HydrophobicContact CB-CD1 3.98Å; C1675-F1711 HydrophobicContact CB-CD2 4.38Å; C1675-F1711 HydrophobicContact CB-CE1 3.64Å; C1675-F1711 VanDerWaalsContact CB-CE1 3.44Å; C1675-F1711 HydrophobicContact CB-CE2 4.08Å; C1675-F1711 HydrophobicContact CB-CG 4.35Å; C1675-F1711 HydrophobicContact CB-CZ 3.61Å; C1675-R1713 PolarHBondContact SG-NH2 2.66Å
1676	S	70.8	Confident	71.2	Confident	84.4 Å²	84.4	78.2 Å²	78.2	59%	0.59	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-17.8	176.3	56.8	0	0	0	0	115	D1674	D1674-S1676 VanDerWaalsContact CG-OG 3.3Å; D1674-S1676 WeakPolarHBondContact OD1-CB 3.35Å; D1674-S1676 PolarHBondContact OD1-N 3.07Å; D1674-S1676 PolarHBondContact OD1-OG 2.99Å; D1674-S1676 VanDerWaalsContact OD1-OG 3.08Å; D1674-S1676 PolarHBondContact OD2-OG 3.1Å
1677	R	68	Low	71.2	Confident	176 Å²	176	77.5 Å²	77.5	66%	0.664	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.5	13	177.5	-60.2	-173.4	177	177.1	-1.3	114.8	C1675 I1680 L1688	C1675-R1677 PolarHBondContact O-N 3.24Å; R1677-I1680 HydrophobicContact CB-CD1 3.91Å; R1677-I1680 HydrophobicContact CG-CD1 3.93Å; R1677-L1688 VanDerWaalsContact O-CD2 3.28Å; R1677-L1688 WeakPolarHBondContact O-CD2 3.44Å
1678	C	69.5	Low	71.4	Confident	3.4 Å²	3.4	70.4 Å²	70.4	2%	0.023	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-32.2	-174.6	-72.2	0	0	0	0	114	R1670 C1675 L1688 R1713 D1771	R1670-C1678 WeakPolarHBondContact CD-SG 3.46Å; C1675-C1678 WeakPolarHBondContact CA-SG 3.35Å; C1675-C1678 HydrophobicContact CB-CB 3.79Å; C1675-C1678 WeakPolarHBondContact CB-SG 3.3Å; C1675-C1678 VanDerWaalsContact O-CB 3.27Å; C1675-C1678 WeakPolarHBondContact O-CB 3.28Å; C1675-C1678 PolarHBondContact O-N 3.04Å; C1675-C1678 PolarHBondContact O-SG 2.84Å; C1675-C1678 VanDerWaalsContact O-SG 3.38Å; C1675-C1678 VanDerWaalsContact SG-CA 3.51Å; C1675-C1678 WeakPolarHBondContact SG-CB 3.37Å; C1675-C1678 PolarHBondContact SG-N 2.79Å; C1675-C1678 VanDerWaalsContact SG-N 3.45Å; C1675-C1678 CovalentContact SG-SG 2.02Å; C1675-C1678 PolarHBondContact SG-SG 3.15Å; C1678-L1688 VanDerWaalsContact O-CD1 3.26Å; C1678-L1688 WeakPolarHBondContact O-CD1 3.35Å; C1678-L1688 VanDerWaalsContact O-CD2 3.28Å; C1678-L1688 WeakPolarHBondContact O-CD2 3.17Å; C1678-R1713 PolarHBondContact O-NH2 3.01Å; C1678-R1713 PolarHBondContact SG-NH1 2.94Å; C1678-R1713 PolarHBondContact SG-NH2 3.24Å; C1678-D1771 VanDerWaalsContact C-OD2 3.28Å; C1678-D1771 HydrophobicContact CB-CB 4.45Å; C1678-D1771 WeakPolarHBondContact CB-OD2 3.2Å
1679	S	62.8	Low	71.7	Confident	70.4 Å²	70.4	66.4 Å²	66.4	49%	0.492	34%	0.341	S	S	.	.	S	Bend	trans	-117.3	46.5	-175.4	-59.3	0	0	0	0	112.2	N1681 D1771	S1679-N1681 PolarHBondContact O-N 2.8Å; S1679-D1771 WeakPolarHBondContact CB-OD2 3.22Å; S1679-D1771 PolarHBondContact N-OD2 2.97Å; S1679-D1771 PolarHBondContact OG-OD2 3.24Å
1680	I	57.4	Low	71.8	Confident	59.2 Å²	59.2	63.3 Å²	63.3	30%	0.304	33%	0.33	S	S	.	.			trans	-90.2	111.4	-179.9	-63.4	174.5	0	0	0	109.7	R1677 D1682 K1683	R1677-I1680 HydrophobicContact CB-CD1 3.91Å; R1677-I1680 HydrophobicContact CG-CD1 3.93Å; I1680-D1682 HydrophobicContact CG2-CB 3.85Å; I1680-D1682 VanDerWaalsContact CG2-N 3.29Å; I1680-D1682 PolarHBondContact O-N 3.21Å; I1680-D1682 VanDerWaalsContact O-N 3.08Å; I1680-K1683 HydrophobicContact CG2-CG 4.34Å; I1680-K1683 PolarHBondContact O-N 3.22Å; I1680-K1683 VanDerWaalsContact O-N 3.11Å
1681	N	57.3	Low	72	Confident	161.2 Å²	161.2	59.4 Å²	59.4	86%	0.862	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-19.5	177.9	-69	-7.2	0	0	0	114.4	S1679 K1683	S1679-N1681 PolarHBondContact O-N 2.8Å; N1681-K1683 VanDerWaalsContact C-N 3.34Å
1682	D	55.8	Low	72.3	Confident	152.8 Å²	152.8	58.2 Å²	58.2	82%	0.817	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-8.8	-178.7	-63.6	-38.5	0	0	0	114.6	I1680	I1680-D1682 HydrophobicContact CG2-CB 3.85Å; I1680-D1682 VanDerWaalsContact CG2-N 3.29Å; I1680-D1682 PolarHBondContact O-N 3.21Å; I1680-D1682 VanDerWaalsContact O-N 3.08Å
1683	K	61.3	Low	72.8	Confident	92.6 Å²	92.6	58.7 Å²	58.7	40%	0.403	31%	0.308	S	S	.	.	S	Bend	trans	-110.3	134.4	179.6	-74.5	-167.7	172.8	-152.4	0	111.6	I1680 N1681 T1685 Q1687 L1688	I1680-K1683 HydrophobicContact CG2-CG 4.34Å; I1680-K1683 PolarHBondContact O-N 3.22Å; I1680-K1683 VanDerWaalsContact O-N 3.11Å; N1681-K1683 VanDerWaalsContact C-N 3.34Å; K1683-T1685 PolarHBondContact O-N 3.09Å; K1683-Q1687 HydrophobicContact CB-CB 4.36Å; K1683-Q1687 HydrophobicContact CD-CB 4.47Å; K1683-L1688 HydrophobicContact CB-CD2 4.48Å
1684	P	65.8	Low	73.2	Confident	66.8 Å²	66.8	59.4 Å²	59.4	43%	0.434	31%	0.308	S	S	.	.			trans	-61.7	138.6	170.8	27.6	-33.3	0	0	0	109.3	R1686 Q1687	P1684-R1686 PolarHBondContact O-N 3.13Å; P1684-Q1687 HydrophobicContact CG-CB 4.26Å; P1684-Q1687 VanDerWaalsContact CG-CD 3.49Å; P1684-Q1687 HydrophobicContact CG-CG 3.86Å; P1684-Q1687 WeakPolarHBondContact O-CA 3.39Å; P1684-Q1687 VanDerWaalsContact O-CB 3.31Å; P1684-Q1687 WeakPolarHBondContact O-CB 3.34Å; P1684-Q1687 PolarHBondContact O-N 2.87Å
1685	T	71.4	Confident	73.8	Confident	11.6 Å²	11.6	56 Å²	56	7%	0.071	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-51.7	-30.3	-175.9	-50.8	0	0	0	0	114.2	V1662 I1663 K1683 Q1687 L1688 L1715 W1766 E1767 T1768	V1662-T1685 CarbonylContact O-C 3.56Å; I1663-T1685 HydrophobicContact CB-CG2 4.14Å; I1663-T1685 HydrophobicContact CD1-CG2 4.01Å; I1663-T1685 HydrophobicContact CG1-CG2 4.29Å; I1663-T1685 WeakPolarHBondContact CG1-O 3.4Å; K1683-T1685 PolarHBondContact O-N 3.09Å; T1685-Q1687 PolarHBondContact O-N 3.05Å; T1685-L1688 HydrophobicContact CG2-CD1 4.07Å; T1685-L1688 WeakPolarHBondContact O-CB 3.37Å; T1685-L1688 WeakPolarHBondContact O-CG 3.36Å; T1685-L1688 PolarHBondContact O-N 3.02Å; T1685-L1688 VanDerWaalsContact O-N 3.12Å; T1685-L1715 HydrophobicContact CG2-CD2 3.62Å; T1685-L1715 HydrophobicContact CG2-CG 4.32Å; T1685-W1766 WeakPolarHBondContact CB-O 3.38Å; T1685-W1766 HydrophobicContact CG2-CB 4.31Å; T1685-W1766 WeakPolarHBondContact CG2-O 3.22Å; T1685-W1766 PolarHBondContact OG1-O 3.03Å; T1685-E1767 WeakPolarHBondContact OG1-CA 3.38Å; T1685-T1768 HydrophobicContact CG2-CG2 4.18Å; T1685-T1768 WeakPolarHBondContact CG2-OG1 3.2Å; T1685-T1768 PolarHBondContact OG1-N 3.13Å; T1685-T1768 VanDerWaalsContact OG1-N 3.12Å; T1685-T1768 PolarHBondContact OG1-OG1 2.84Å
1686	R	72.2	Confident	74.6	Confident	63.4 Å²	63.4	56.4 Å²	56.4	24%	0.239	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-59.9	-20.5	172.5	-68.5	-179.9	-138.3	169.9	0.1	114.7	S1660 A1661 V1662 G1664 P1684 R1764 S2093 V2095	S1660-R1686 PolarHBondContact OG-NH2 2.78Å; A1661-R1686 VanDerWaalsContact O-CD 3.24Å; A1661-R1686 WeakPolarHBondContact O-CD 3.33Å; A1661-R1686 WeakPolarHBondContact O-CG 3.41Å; A1661-R1686 VanDerWaalsContact O-CZ 3.31Å; A1661-R1686 PolarHBondContact O-NE 3.22Å; A1661-R1686 VanDerWaalsContact O-NE 3.1Å; A1661-R1686 PolarHBondContact O-NH2 3.1Å; A1661-R1686 VanDerWaalsContact O-NH2 3.15Å; V1662-R1686 VanDerWaalsContact O-CG 3.31Å; V1662-R1686 WeakPolarHBondContact O-CG 3.41Å; V1662-R1686 PolarHBondContact O-N 2.97Å; G1664-R1686 CarbonylContact C-O 3.55Å; G1664-R1686 PolarHBondContact N-O 3.33Å; G1664-R1686 VanDerWaalsContact O-O 3.1Å; P1684-R1686 PolarHBondContact O-N 3.13Å; R1686-R1764 PolarHBondContact NH1-O 3.12Å; R1686-R1764 PolarHBondContact NH2-O 3.28Å; R1686-S2093 PolarHBondContact NH1-O 3.08Å; R1686-V2095 VanDerWaalsContact CZ-CG2 3.41Å; R1686-V2095 VanDerWaalsContact NH1-CA 3.28Å
1687	Q	72.3	Confident	75.7	Confident	54.6 Å²	54.6	53.4 Å²	53.4	26%	0.255	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-97	5.3	177.3	-68.4	-178	0.8	0	0	113.6	L1665 K1683 P1684 T1685 S1689 E2092	L1665-Q1687 VanDerWaalsContact CD1-O 3.27Å; L1665-Q1687 WeakPolarHBondContact CD1-O 3.36Å; L1665-Q1687 HydrophobicContact CD2-CB 4.35Å; L1665-Q1687 HydrophobicContact CD2-CG 4.39Å; L1665-Q1687 WeakPolarHBondContact CG-O 3.4Å; K1683-Q1687 HydrophobicContact CB-CB 4.36Å; K1683-Q1687 HydrophobicContact CD-CB 4.47Å; P1684-Q1687 HydrophobicContact CG-CB 4.26Å; P1684-Q1687 VanDerWaalsContact CG-CD 3.49Å; P1684-Q1687 HydrophobicContact CG-CG 3.86Å; P1684-Q1687 WeakPolarHBondContact O-CA 3.39Å; P1684-Q1687 VanDerWaalsContact O-CB 3.31Å; P1684-Q1687 WeakPolarHBondContact O-CB 3.34Å; P1684-Q1687 PolarHBondContact O-N 2.87Å; T1685-Q1687 PolarHBondContact O-N 3.05Å; Q1687-S1689 PolarHBondContact O-N 2.81Å; Q1687-E2092 VanDerWaalsContact CD-CD 3.49Å; Q1687-E2092 HydrophobicContact CG-CB 4.37Å; Q1687-E2092 VanDerWaalsContact CG-CD 3.42Å; Q1687-E2092 WeakPolarHBondContact CG-OE2 3.44Å; Q1687-E2092 VanDerWaalsContact NE2-CD 3.34Å; Q1687-E2092 PolarHBondContact NE2-OE2 3.14Å
1688	L	79.7	Confident	76.9	Confident	5 Å²	5	46.6 Å²	46.6	3%	0.026	25%	0.247	C	C	.	.	S	Bend	trans	-81.9	121.8	174	-57.6	174.1	0	0	0	108.6	I1663 G1664 L1665 R1677 C1678 K1683 T1685 T1768	I1663-L1688 HydrophobicContact CD1-CB 4.02Å; I1663-L1688 HydrophobicContact CD1-CD1 4.18Å; I1663-L1688 HydrophobicContact CG1-CB 4.1Å; G1664-L1688 VanDerWaalsContact CA-O 3.23Å; G1664-L1688 WeakPolarHBondContact CA-O 3.42Å; G1664-L1688 PolarHBondContact N-O 2.83Å; G1664-L1688 VanDerWaalsContact N-O 3.12Å; L1665-L1688 PolarHBondContact N-O 3.02Å; R1677-L1688 VanDerWaalsContact O-CD2 3.28Å; R1677-L1688 WeakPolarHBondContact O-CD2 3.44Å; C1678-L1688 VanDerWaalsContact O-CD1 3.26Å; C1678-L1688 WeakPolarHBondContact O-CD1 3.35Å; C1678-L1688 VanDerWaalsContact O-CD2 3.28Å; C1678-L1688 WeakPolarHBondContact O-CD2 3.17Å; K1683-L1688 HydrophobicContact CB-CD2 4.48Å; T1685-L1688 HydrophobicContact CG2-CD1 4.07Å; T1685-L1688 WeakPolarHBondContact O-CB 3.37Å; T1685-L1688 WeakPolarHBondContact O-CG 3.36Å; T1685-L1688 PolarHBondContact O-N 3.02Å; T1685-L1688 VanDerWaalsContact O-N 3.12Å; L1688-T1768 HydrophobicContact CD1-CG2 3.84Å; L1688-T1768 VanDerWaalsContact CD1-OG1 3.26Å; L1688-T1768 WeakPolarHBondContact CD1-OG1 3.48Å
1689	S	83.3	Confident	77.8	Confident	23.8 Å²	23.8	46.8 Å²	46.8	17%	0.166	25%	0.248	C	C	.	.			trans	-70.2	141	176.2	65.5	0	0	0	0	110.9	E1667 Q1668 R1669 R1670 Q1687 R1713	E1667-S1689 WeakPolarHBondContact O-CB 3.45Å; Q1668-S1689 PolarHBondContact O-OG 2.88Å; R1669-S1689 WeakPolarHBondContact CA-OG 3.47Å; R1670-S1689 PolarHBondContact N-OG 3.43Å; Q1687-S1689 PolarHBondContact O-N 2.81Å; S1689-R1713 PolarHBondContact O-NH1 2.74Å; S1689-R1713 PolarHBondContact O-NH2 2.81Å
1690	L	87.5	Confident	78.8	Confident	5.8 Å²	5.8	44.3 Å²	44.3	3%	0.03	23%	0.23	C	C	.	.			trans	-103.3	153.2	171.6	-64	173.7	0	0	0	109.1	I1663 R1669 R1670 P1693 D1708 V2129	I1663-L1690 HydrophobicContact CD1-CD2 4.1Å; I1663-L1690 HydrophobicContact CG1-CD1 4.32Å; I1663-L1690 HydrophobicContact CG1-CD2 4.09Å; I1663-L1690 HydrophobicContact CG1-CG 4.3Å; I1663-L1690 HydrophobicContact CG2-CD1 4.2Å; R1669-L1690 CarbonylContact C-O 3.59Å; R1669-L1690 VanDerWaalsContact CA-O 3.27Å; R1669-L1690 WeakPolarHBondContact CA-O 3.29Å; R1669-L1690 WeakPolarHBondContact CB-O 3.22Å; R1669-L1690 PolarHBondContact N-O 2.95Å; R1670-L1690 PolarHBondContact N-O 2.88Å; R1670-L1690 VanDerWaalsContact N-O 3.11Å; L1690-P1693 HydrophobicContact CD1-CB 4.27Å; L1690-P1693 HydrophobicContact CD1-CG 4.16Å; L1690-D1708 HydrophobicContact CD2-CB 4.1Å; L1690-V2129 HydrophobicContact CD1-CG2 4.09Å
1691	Y	85.6	Confident	80	Confident	22.2 Å²	22.2	42.2 Å²	42.2	9%	0.087	22%	0.221	C	C	.	.	S	Bend	trans	-89.7	-58.1	170.3	176.7	-101.7	0	0	0	110.9	Q1668 R1669 R1670 S1671 P1672 D1708 E1783 L1786	Q1668-Y1691 VanDerWaalsContact CG-O 3.31Å; Q1668-Y1691 WeakPolarHBondContact CG-O 3.45Å; Q1668-Y1691 PolarHBondContact NE2-O 3.07Å; R1669-Y1691 PolarHBondContact NH1-O 3.02Å; R1669-Y1691 WeakPolarHBondContact O-CD2 3.26Å; R1670-Y1691 VanDerWaalsContact O-CD2 3.25Å; R1670-Y1691 WeakPolarHBondContact O-CD2 3.22Å; R1670-Y1691 WeakPolarHBondContact O-CE2 3.29Å; S1671-Y1691 VanDerWaalsContact C-CD2 3.46Å; S1671-Y1691 WeakPolarHBondContact O-CD2 3.29Å; P1672-Y1691 HydrophobicContact CB-CD1 4.19Å; P1672-Y1691 HydrophobicContact CB-CD2 4.23Å; P1672-Y1691 HydrophobicContact CB-CE1 4Å; P1672-Y1691 HydrophobicContact CB-CE2 4.04Å; P1672-Y1691 HydrophobicContact CB-CG 4.26Å; P1672-Y1691 VanDerWaalsContact CD-CE2 3.46Å; P1672-Y1691 HydrophobicContact CG-CD2 4.12Å; P1672-Y1691 HydrophobicContact CG-CE1 4.41Å; P1672-Y1691 HydrophobicContact CG-CE2 3.82Å; P1672-Y1691 VanDerWaalsContact N-CE2 3.33Å; Y1691-D1708 WeakPolarHBondContact CA-OD1 3.44Å; Y1691-D1708 VanDerWaalsContact N-CG 3.34Å; Y1691-D1708 PolarHBondContact N-OD1 3Å; Y1691-D1708 PolarHBondContact N-OD2 3.13Å; Y1691-E1783 WeakPolarHBondContact OH-CA 3.33Å; Y1691-E1783 PolarHBondContact OH-O 2.92Å; Y1691-E1783 VanDerWaalsContact OH-O 3.14Å; Y1691-L1786 HydrophobicContact CD1-CD2 4.39Å; Y1691-L1786 HydrophobicContact CE1-CD1 3.54Å; Y1691-L1786 VanDerWaalsContact CE1-CD1 3.5Å; Y1691-L1786 HydrophobicContact CE1-CD2 3.96Å; Y1691-L1786 VanDerWaalsContact CE1-CD2 3.49Å; Y1691-L1786 HydrophobicContact CE1-CG 4.28Å; Y1691-L1786 WeakPolarHBondContact OH-CD1 3.35Å
1692	N	85.4	Confident	81.3	Confident	22.8 Å²	22.8	34.9 Å²	34.9	12%	0.122	19%	0.185	C	C	.	.			trans	-161	99.9	177.9	-142.5	-9.2	0	0	0	109.3	R1669 Y1694 D1708 G1709 L1786 N2124	R1669-N1692 PolarHBondContact NH1-OD1 2.96Å; N1692-Y1694 HydrophobicContact CB-CD1 4.34Å; N1692-Y1694 HydrophobicContact CB-CD2 4.36Å; N1692-Y1694 HydrophobicContact CB-CE1 4.03Å; N1692-Y1694 HydrophobicContact CB-CE2 4.01Å; N1692-Y1694 WeakPolarHBondContact ND2-CE1 3.32Å; N1692-Y1694 VanDerWaalsContact ND2-CZ 3.27Å; N1692-Y1694 PolarHBondContact ND2-OH 3.26Å; N1692-Y1694 WeakPolarHBondContact O-CD2 3.06Å; N1692-Y1694 PolarHBondContact O-N 3.05Å; N1692-D1708 PolarHBondContact N-OD1 3.07Å; N1692-D1708 CarbonylContact O-C 3.56Å; N1692-D1708 WeakPolarHBondContact O-CA 3.38Å; N1692-G1709 PolarHBondContact O-N 3.27Å; N1692-G1709 VanDerWaalsContact O-N 3.13Å; N1692-L1786 HydrophobicContact CB-CD2 4.42Å; N1692-L1786 WeakPolarHBondContact ND2-CD2 3.39Å; N1692-N2124 VanDerWaalsContact OD1-CG 3.28Å; N1692-N2124 PolarHBondContact OD1-ND2 3.08Å; N1692-N2124 PolarHBondContact OD1-OD1 3.23Å
1693	P	89.5	Confident	82.8	Confident	14.2 Å²	14.2	28.4 Å²	28.4	9%	0.092	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	96.3	176.5	29.6	-32.8	0	0	0	110.2	L1690 I1706 G1707 S2109 A2122 V2129	L1690-P1693 HydrophobicContact CD1-CB 4.27Å; L1690-P1693 HydrophobicContact CD1-CG 4.16Å; P1693-I1706 HydrophobicContact CB-CG2 4.17Å; P1693-G1707 CarbonylContact C-O 3.53Å; P1693-G1707 VanDerWaalsContact CA-O 3.29Å; P1693-G1707 WeakPolarHBondContact CA-O 3.39Å; P1693-S2109 WeakPolarHBondContact O-CB 3.42Å; P1693-S2109 PolarHBondContact O-OG 3.19Å; P1693-A2122 HydrophobicContact CB-CB 3.95Å; P1693-A2122 HydrophobicContact CG-CB 4.25Å; P1693-V2129 HydrophobicContact CB-CG2 3.97Å
1694	Y	86.5	Confident	84.2	Confident	52.4 Å²	52.4	24.1 Å²	24.1	21%	0.205	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	-31.2	-175.7	-107.1	-76.6	0	0	0	113.3	N1692 G1707 L1786 T1788 Y1789 S2110	N1692-Y1694 HydrophobicContact CB-CD1 4.34Å; N1692-Y1694 HydrophobicContact CB-CD2 4.36Å; N1692-Y1694 HydrophobicContact CB-CE1 4.03Å; N1692-Y1694 HydrophobicContact CB-CE2 4.01Å; N1692-Y1694 WeakPolarHBondContact ND2-CE1 3.32Å; N1692-Y1694 VanDerWaalsContact ND2-CZ 3.27Å; N1692-Y1694 PolarHBondContact ND2-OH 3.26Å; N1692-Y1694 WeakPolarHBondContact O-CD2 3.06Å; N1692-Y1694 PolarHBondContact O-N 3.05Å; Y1694-G1707 PolarHBondContact N-O 3Å; Y1694-L1786 HydrophobicContact CE1-CD2 4.13Å; Y1694-L1786 VanDerWaalsContact OH-CB 3.25Å; Y1694-L1786 WeakPolarHBondContact OH-CB 3.35Å; Y1694-L1786 WeakPolarHBondContact OH-CD2 3.08Å; Y1694-T1788 HydrophobicContact CE1-CG2 4.38Å; Y1694-T1788 HydrophobicContact CE2-CG2 4.4Å; Y1694-T1788 WeakPolarHBondContact OH-CG2 3.48Å; Y1694-Y1789 HydrophobicContact CD2-CD1 4.43Å; Y1694-Y1789 AromaticContact CD2-CE1 3.82Å; Y1694-Y1789 HydrophobicContact CD2-CE1 4Å; Y1694-Y1789 WeakPolarHBondContact CE1-O 3.48Å; Y1694-Y1789 HydrophobicContact CE2-CE1 4.45Å; Y1694-S2110 WeakPolarHBondContact O-CB 3.26Å
1695	C	90.4	Very high	85.5	Confident	12 Å²	12	21.1 Å²	21.1	8%	0.081	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	145	-173.5	88.5	0	0	0	0	111.3	I1706 G1707 Y1789 I1791 S2110	C1695-I1706 WeakPolarHBondContact O-CA 3.41Å; C1695-G1707 PolarHBondContact O-N 2.9Å; C1695-Y1789 VanDerWaalsContact SG-CE2 3.58Å; C1695-Y1789 WeakPolarHBondContact SG-CE2 3.4Å; C1695-Y1789 PolarHBondContact SG-O 3.3Å; C1695-Y1789 VanDerWaalsContact SG-O 3.41Å; C1695-I1791 HydrophobicContact CB-CD1 4.25Å; C1695-I1791 HydrophobicContact CB-CG1 3.9Å; C1695-I1791 VanDerWaalsContact SG-CD1 3.54Å; C1695-I1791 VanDerWaalsContact SG-CG1 3.53Å; C1695-I1791 WeakPolarHBondContact SG-CG1 3.28Å; C1695-S2110 WeakPolarHBondContact CA-OG 3.36Å
1696	L	94.7	Very high	86.5	Confident	29 Å²	29	20.6 Å²	20.6	15%	0.152	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	140	178	-73.5	172	0	0	0	110.1	L1704 L1705 I1706 S2110 T2112 F2120 A2122 V2129	L1696-L1704 HydrophobicContact CD1-CD1 4.13Å; L1696-L1704 HydrophobicContact CD2-CD1 3.75Å; L1696-L1704 HydrophobicContact CG-CD1 3.83Å; L1696-L1705 CarbonylContact C-O 3.58Å; L1696-L1705 WeakPolarHBondContact CA-O 3.32Å; L1696-I1706 HydrophobicContact CD1-CG1 4.34Å; L1696-I1706 HydrophobicContact CD2-CB 4.2Å; L1696-I1706 HydrophobicContact CD2-CG1 3.82Å; L1696-I1706 HydrophobicContact CD2-CG2 3.97Å; L1696-S2110 PolarHBondContact N-OG 3.02Å; L1696-S2110 VanDerWaalsContact N-OG 3.13Å; L1696-T2112 HydrophobicContact CB-CG2 3.59Å; L1696-F2120 HydrophobicContact CD1-CB 4.03Å; L1696-A2122 HydrophobicContact CD1-CB 3.75Å; L1696-A2122 VanDerWaalsContact CD1-N 3.34Å; L1696-A2122 HydrophobicContact CD2-CB 4.28Å; L1696-A2122 HydrophobicContact CG-CB 3.95Å; L1696-V2129 HydrophobicContact CD1-CG1 3.98Å; L1696-V2129 HydrophobicContact CD2-CG1 3.98Å; L1696-V2129 HydrophobicContact CD2-CG2 3.94Å
1697	L	94.4	Very high	87.4	Confident	22.4 Å²	22.4	17.6 Å²	17.6	12%	0.117	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	160.2	171.9	-75.5	152.1	0	0	0	110.8	L1704 L1705 I1791 T1792 V1793 L1825	L1697-L1704 WeakPolarHBondContact O-CD1 3.39Å; L1697-L1705 HydrophobicContact CB-CB 4.36Å; L1697-L1705 HydrophobicContact CD1-CB 3.71Å; L1697-L1705 HydrophobicContact CD1-CD2 4.16Å; L1697-L1705 HydrophobicContact CD1-CG 4.34Å; L1697-L1705 HydrophobicContact CD2-CB 4.41Å; L1697-L1705 HydrophobicContact CD2-CD2 4.04Å; L1697-L1705 HydrophobicContact CG-CB 3.99Å; L1697-L1705 HydrophobicContact CG-CD2 3.94Å; L1697-L1705 HydrophobicContact CG-CG 4.27Å; L1697-L1705 PolarHBondContact N-O 3.24Å; L1697-L1705 PolarHBondContact O-N 3.17Å; L1697-I1791 HydrophobicContact CB-CD1 4.37Å; L1697-I1791 HydrophobicContact CD1-CB 3.86Å; L1697-I1791 HydrophobicContact CD1-CD1 3.65Å; L1697-I1791 HydrophobicContact CD1-CG1 3.52Å; L1697-I1791 VanDerWaalsContact CD1-CG1 3.4Å; L1697-I1791 HydrophobicContact CD2-CB 3.94Å; L1697-I1791 HydrophobicContact CD2-CD1 3.97Å; L1697-I1791 HydrophobicContact CD2-CG1 3.87Å; L1697-I1791 HydrophobicContact CG-CD1 4.05Å; L1697-I1791 HydrophobicContact CG-CG1 3.92Å; L1697-T1792 VanDerWaalsContact CD1-CA 3.43Å; L1697-V1793 HydrophobicContact CD1-CB 4.46Å; L1697-V1793 HydrophobicContact CD1-CG1 4.01Å; L1697-V1793 HydrophobicContact CD1-CG2 4.22Å; L1697-V1793 HydrophobicContact CD2-CB 4.11Å; L1697-V1793 HydrophobicContact CD2-CG1 3.7Å; L1697-V1793 HydrophobicContact CD2-CG2 3.68Å; L1697-V1793 HydrophobicContact CG-CG1 4.41Å; L1697-V1793 HydrophobicContact CG-CG2 4.35Å; L1697-L1825 HydrophobicContact CD1-CD1 4.2Å; L1697-L1825 HydrophobicContact CD2-CD1 4.01Å
1698	T	92.2	Very high	88.2	Confident	33.8 Å²	33.8	15 Å²	15	21%	0.207	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	147.8	164.8	58.6	0	0	0	0	111	N1703 L1704 T2112 V2113 S2114 F2120	T1698-N1703 CarbonylContact C-O 3.56Å; T1698-N1703 VanDerWaalsContact CA-O 3.25Å; T1698-N1703 WeakPolarHBondContact CA-O 3.3Å; T1698-N1703 WeakPolarHBondContact CB-O 3.35Å; T1698-L1704 HydrophobicContact CG2-CD1 4.24Å; T1698-T2112 HydrophobicContact CG2-CG2 3.94Å; T1698-V2113 PolarHBondContact OG1-O 2.95Å; T1698-V2113 VanDerWaalsContact OG1-O 3.13Å; T1698-S2114 WeakPolarHBondContact OG1-CA 3.17Å; T1698-F2120 HydrophobicContact CG2-CD2 4.03Å; T1698-F2120 HydrophobicContact CG2-CE2 4.08Å
1699	D	88.3	Confident	88.5	Confident	7.6 Å²	7.6	14.9 Å²	14.9	4%	0.041	9%	0.085	C	C	.	.			trans	-87.5	176.2	170.9	77.9	2.1	0	0	0	111.9	A1701 G1702 N1703 W1714 Y1797 Y1799	D1699-A1701 PolarHBondContact O-N 3.08Å; D1699-A1701 VanDerWaalsContact O-N 3.11Å; D1699-A1701 WeakPolarHBondContact OD1-CA 3.26Å; D1699-A1701 WeakPolarHBondContact OD1-CB 3.37Å; D1699-A1701 PolarHBondContact OD1-N 3.2Å; D1699-G1702 PolarHBondContact O-N 3.08Å; D1699-G1702 PolarHBondContact OD1-N 3.09Å; D1699-N1703 PolarHBondContact N-O 3.25Å; D1699-N1703 VanDerWaalsContact N-O 3.12Å; D1699-N1703 WeakPolarHBondContact OD1-CB 3.32Å; D1699-N1703 PolarHBondContact OD1-N 2.9Å; D1699-N1703 PolarHBondContact OD1-ND2 3.12Å; D1699-N1703 WeakPolarHBondContact OD2-CB 3.28Å; D1699-N1703 PolarHBondContact OD2-ND2 3.05Å; D1699-W1714 HydrophobicContact CB-CH2 3.87Å; D1699-W1714 HydrophobicContact CB-CZ2 4.35Å; D1699-W1714 HydrophobicContact CB-CZ3 3.92Å; D1699-Y1797 HydrophobicContact CB-CD1 3.91Å; D1699-Y1797 HydrophobicContact CB-CE1 4.16Å; D1699-Y1799 WeakPolarHBondContact OD2-CB 3.13Å; D1699-Y1799 PolarHBondContact OD2-N 2.99Å
1700	S	84.8	Confident	88.6	Confident	16.2 Å²	16.2	13.8 Å²	13.8	11%	0.113	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	0.9	-177.5	-3.5	0	0	0	0	114.3	R1315 G1362 P1795 Y1797 I1798 L2115	R1315-S1700 PolarHBondContact NE-O 3.12Å; R1315-S1700 PolarHBondContact NH2-O 3.11Å; R1315-S1700 VanDerWaalsContact NH2-O 3.15Å; G1362-S1700 VanDerWaalsContact O-CB 3.32Å; G1362-S1700 WeakPolarHBondContact O-CB 3.43Å; S1700-P1795 WeakPolarHBondContact CB-O 3.3Å; S1700-P1795 PolarHBondContact OG-O 3.3Å; S1700-P1795 VanDerWaalsContact OG-O 3.09Å; S1700-Y1797 WeakPolarHBondContact CB-O 3.21Å; S1700-Y1797 PolarHBondContact N-O 3.01Å; S1700-Y1797 PolarHBondContact OG-N 2.94Å; S1700-Y1797 PolarHBondContact OG-O 3.01Å; S1700-I1798 WeakPolarHBondContact OG-CG1 3.42Å; S1700-L2115 WeakPolarHBondContact O-CD2 3.42Å
1701	A	81.1	Confident	88.6	Confident	15.2 Å²	15.2	14.2 Å²	14.2	13%	0.126	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-7.3	167.4	0	0	0	0	0	112.8	D1699 F1754 I1798 L2115	D1699-A1701 PolarHBondContact O-N 3.08Å; D1699-A1701 VanDerWaalsContact O-N 3.11Å; D1699-A1701 WeakPolarHBondContact OD1-CA 3.26Å; D1699-A1701 WeakPolarHBondContact OD1-CB 3.37Å; D1699-A1701 PolarHBondContact OD1-N 3.2Å; A1701-F1754 HydrophobicContact CB-CE2 4.36Å; A1701-I1798 HydrophobicContact CB-CG1 4.47Å; A1701-I1798 HydrophobicContact CB-CG2 3.8Å; A1701-L2115 VanDerWaalsContact C-CD2 3.46Å
1702	G	84.2	Confident	88.8	Confident	9.6 Å²	9.6	13.1 Å²	13.1	10%	0.099	8%	0.075	C	C	.	.			trans	85	19.5	-178.6	0	0	0	0	0	114	D1699 R1763	D1699-G1702 PolarHBondContact O-N 3.08Å; D1699-G1702 PolarHBondContact OD1-N 3.09Å; G1702-R1763 PolarHBondContact O-NH1 2.91Å; G1702-R1763 PolarHBondContact O-NH2 3.27Å
1703	N	87.5	Confident	88.9	Confident	14.4 Å²	14.4	12 Å²	12	8%	0.077	7%	0.069	C	C	.	.			trans	-71.4	148.6	166.8	-57.7	-53.2	0	0	0	109.6	T1698 D1699 W1714 L1715 N1716	T1698-N1703 CarbonylContact C-O 3.56Å; T1698-N1703 VanDerWaalsContact CA-O 3.25Å; T1698-N1703 WeakPolarHBondContact CA-O 3.3Å; T1698-N1703 WeakPolarHBondContact CB-O 3.35Å; D1699-N1703 PolarHBondContact N-O 3.25Å; D1699-N1703 VanDerWaalsContact N-O 3.12Å; D1699-N1703 WeakPolarHBondContact OD1-CB 3.32Å; D1699-N1703 PolarHBondContact OD1-N 2.9Å; D1699-N1703 PolarHBondContact OD1-ND2 3.12Å; D1699-N1703 WeakPolarHBondContact OD2-CB 3.28Å; D1699-N1703 PolarHBondContact OD2-ND2 3.05Å; N1703-W1714 HydrophobicContact CB-CE3 3.92Å; N1703-W1714 HydrophobicContact CB-CZ3 3.85Å; N1703-L1715 CarbonylContact C-O 3.57Å; N1703-L1715 WeakPolarHBondContact CA-O 3.45Å; N1703-L1715 WeakPolarHBondContact CB-O 3.43Å; N1703-N1716 VanDerWaalsContact OD1-CB 3.26Å; N1703-N1716 WeakPolarHBondContact OD1-CB 3.4Å; N1703-N1716 PolarHBondContact OD1-ND2 2.82Å; N1703-N1716 PolarHBondContact OD1-OD1 3.01Å; N1703-N1716 VanDerWaalsContact OD1-OD1 3.09Å
1704	L	91.8	Very high	88.8	Confident	3.8 Å²	3.8	11.4 Å²	11.4	2%	0.02	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	126.4	-179.1	179.5	68.9	0	0	0	110.1	V1662 L1696 L1697 T1698 I1706 W1714 L1715 W1766 T2112 F2120 V2129	V1662-L1704 HydrophobicContact CG1-CD2 4.07Å; L1696-L1704 HydrophobicContact CD1-CD1 4.13Å; L1696-L1704 HydrophobicContact CD2-CD1 3.75Å; L1696-L1704 HydrophobicContact CG-CD1 3.83Å; L1697-L1704 WeakPolarHBondContact O-CD1 3.39Å; T1698-L1704 HydrophobicContact CG2-CD1 4.24Å; L1704-I1706 HydrophobicContact CD2-CD1 3.98Å; L1704-I1706 HydrophobicContact CD2-CG1 4.14Å; L1704-I1706 HydrophobicContact CG-CD1 4.36Å; L1704-I1706 HydrophobicContact CG-CG1 4.03Å; L1704-W1714 CarbonylContact O-C 3.54Å; L1704-W1714 WeakPolarHBondContact O-CA 3.15Å; L1704-L1715 HydrophobicContact CB-CB 4.38Å; L1704-L1715 HydrophobicContact CD2-CD1 4.12Å; L1704-L1715 PolarHBondContact N-O 3.26Å; L1704-L1715 PolarHBondContact O-N 3.1Å; L1704-W1766 HydrophobicContact CB-CE3 4.27Å; L1704-W1766 HydrophobicContact CB-CH2 4.28Å; L1704-W1766 HydrophobicContact CB-CZ3 3.67Å; L1704-T2112 HydrophobicContact CD1-CG2 4.12Å; L1704-F2120 HydrophobicContact CD1-CB 4.05Å; L1704-F2120 HydrophobicContact CD1-CD1 4.1Å; L1704-F2120 HydrophobicContact CD1-CD2 4.04Å; L1704-F2120 HydrophobicContact CD1-CE2 4.5Å; L1704-F2120 HydrophobicContact CD1-CG 3.79Å; L1704-F2120 HydrophobicContact CD2-CD1 3.7Å; L1704-F2120 HydrophobicContact CD2-CE1 3.94Å; L1704-F2120 HydrophobicContact CD2-CG 4.25Å; L1704-F2120 HydrophobicContact CG-CD1 4.46Å; L1704-V2129 HydrophobicContact CD2-CG1 4.23Å
1705	L	93.1	Very high	88.8	Confident	2.6 Å²	2.6	8.9 Å²	8.9	1%	0.014	6%	0.055	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	131.5	171.4	175.3	58.5	0	0	0	109.9	L1696 L1697 L1712 R1713 W1714 I1791 L1825	L1696-L1705 CarbonylContact C-O 3.58Å; L1696-L1705 WeakPolarHBondContact CA-O 3.32Å; L1697-L1705 HydrophobicContact CB-CB 4.36Å; L1697-L1705 HydrophobicContact CD1-CB 3.71Å; L1697-L1705 HydrophobicContact CD1-CD2 4.16Å; L1697-L1705 HydrophobicContact CD1-CG 4.34Å; L1697-L1705 HydrophobicContact CD2-CB 4.41Å; L1697-L1705 HydrophobicContact CD2-CD2 4.04Å; L1697-L1705 HydrophobicContact CG-CB 3.99Å; L1697-L1705 HydrophobicContact CG-CD2 3.94Å; L1697-L1705 HydrophobicContact CG-CG 4.27Å; L1697-L1705 PolarHBondContact N-O 3.24Å; L1697-L1705 PolarHBondContact O-N 3.17Å; L1705-L1712 HydrophobicContact CD1-CB 4.05Å; L1705-L1712 HydrophobicContact CD1-CD2 4.33Å; L1705-R1713 CarbonylContact C-O 3.51Å; L1705-R1713 WeakPolarHBondContact CA-O 3.37Å; L1705-R1713 WeakPolarHBondContact CD1-O 3.42Å; L1705-W1714 HydrophobicContact CB-CD2 4.17Å; L1705-W1714 HydrophobicContact CB-CE3 4.31Å; L1705-W1714 HydrophobicContact CB-CH2 4.07Å; L1705-W1714 HydrophobicContact CB-CZ2 3.92Å; L1705-W1714 HydrophobicContact CB-CZ3 4.27Å; L1705-W1714 HydrophobicContact CD1-CD2 3.74Å; L1705-W1714 VanDerWaalsContact CD1-CD2 3.5Å; L1705-W1714 VanDerWaalsContact CD1-CE2 3.46Å; L1705-W1714 HydrophobicContact CD1-CE3 3.8Å; L1705-W1714 HydrophobicContact CD1-CG 3.97Å; L1705-W1714 HydrophobicContact CD1-CH2 4.16Å; L1705-W1714 HydrophobicContact CD1-CZ2 3.91Å; L1705-W1714 HydrophobicContact CD1-CZ3 4.03Å; L1705-W1714 HydrophobicContact CD2-CE3 4.42Å; L1705-W1714 HydrophobicContact CD2-CH2 4.13Å; L1705-W1714 HydrophobicContact CD2-CZ2 3.98Å; L1705-W1714 HydrophobicContact CD2-CZ3 3.76Å; L1705-W1714 HydrophobicContact CG-CD2 4.49Å; L1705-W1714 HydrophobicContact CG-CE3 4.44Å; L1705-W1714 HydrophobicContact CG-CH2 4.29Å; L1705-W1714 HydrophobicContact CG-CZ2 4.24Å; L1705-W1714 HydrophobicContact CG-CZ3 4.26Å; L1705-I1791 HydrophobicContact CD2-CD1 3.97Å; L1705-I1791 HydrophobicContact CG-CD1 4.1Å; L1705-L1825 HydrophobicContact CD2-CD1 3.56Å; L1705-L1825 HydrophobicContact CD2-CD2 4.16Å; L1705-L1825 HydrophobicContact CD2-CG 4.44Å
1706	I	92.9	Very high	88.5	Confident	1.2 Å²	1.2	9.9 Å²	9.9	1%	0.006	6%	0.06	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	125.3	-178.8	-52.6	176	0	0	0	109.2	I1663 P1693 C1695 L1696 L1704 D1708 L1712 R1713 L1715 V2129	I1663-I1706 HydrophobicContact CG2-CD1 3.45Å; I1663-I1706 VanDerWaalsContact CG2-CD1 3.43Å; P1693-I1706 HydrophobicContact CB-CG2 4.17Å; C1695-I1706 WeakPolarHBondContact O-CA 3.41Å; L1696-I1706 HydrophobicContact CD1-CG1 4.34Å; L1696-I1706 HydrophobicContact CD2-CB 4.2Å; L1696-I1706 HydrophobicContact CD2-CG1 3.82Å; L1696-I1706 HydrophobicContact CD2-CG2 3.97Å; L1704-I1706 HydrophobicContact CD2-CD1 3.98Å; L1704-I1706 HydrophobicContact CD2-CG1 4.14Å; L1704-I1706 HydrophobicContact CG-CD1 4.36Å; L1704-I1706 HydrophobicContact CG-CG1 4.03Å; I1706-D1708 HydrophobicContact CG2-CB 4.44Å; I1706-D1708 PolarHBondContact O-N 3.19Å; I1706-L1712 CarbonylContact O-C 3.54Å; I1706-L1712 WeakPolarHBondContact O-CA 3.37Å; I1706-R1713 HydrophobicContact CB-CB 4.39Å; I1706-R1713 PolarHBondContact N-O 3.13Å; I1706-R1713 PolarHBondContact O-N 3.15Å; I1706-L1715 HydrophobicContact CD1-CD1 3.75Å; I1706-L1715 HydrophobicContact CD1-CD2 4.11Å; I1706-L1715 HydrophobicContact CG1-CD1 4.32Å; I1706-V2129 HydrophobicContact CD1-CB 4.42Å; I1706-V2129 HydrophobicContact CD1-CG2 4.09Å; I1706-V2129 HydrophobicContact CG2-CG2 4.31Å
1707	G	91.2	Very high	87.5	Confident	0 Å²	0	9.2 Å²	9.2	0%	0	6%	0.057	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	103	164.4	0	0	0	0	0	110.5	P1693 Y1694 C1695 F1711 Y1789	P1693-G1707 CarbonylContact C-O 3.53Å; P1693-G1707 VanDerWaalsContact CA-O 3.29Å; P1693-G1707 WeakPolarHBondContact CA-O 3.39Å; Y1694-G1707 PolarHBondContact N-O 3Å; C1695-G1707 PolarHBondContact O-N 2.9Å; G1707-F1711 CarbonylContact C-O 3.56Å; G1707-F1711 WeakPolarHBondContact CA-O 3.26Å; G1707-Y1789 VanDerWaalsContact C-OH 3.29Å; G1707-Y1789 VanDerWaalsContact CA-OH 3.28Å; G1707-Y1789 WeakPolarHBondContact CA-OH 3.44Å
1708	D	88.8	Confident	86	Confident	0 Å²	0	10.3 Å²	10.3	0%	0	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	88.4	-178.2	178	39.3	0	0	0	111.3	R1669 R1670 L1690 Y1691 N1692 I1706 G1710 F1711 R1713 Y1789	R1669-D1708 IonicContact CZ-OD2 3.68Å; R1669-D1708 IonicContact NE-OD2 3.13Å; R1669-D1708 PolarHBondContact NE-OD2 3.22Å; R1669-D1708 PolarHBondContact NH2-O 3.31Å; R1669-D1708 IonicContact NH2-OD1 3.58Å; R1669-D1708 IonicContact NH2-OD2 3.4Å; R1669-D1708 PolarHBondContact NH2-OD2 2.88Å; R1670-D1708 IonicContact CZ-OD2 2.84Å; R1670-D1708 IonicContact NE-OD2 3.56Å; R1670-D1708 PolarHBondContact NE-OD2 3.11Å; R1670-D1708 PolarHBondContact NH2-O 2.82Å; R1670-D1708 IonicContact NH2-OD1 3.01Å; R1670-D1708 IonicContact NH2-OD2 3.34Å; R1670-D1708 PolarHBondContact NH2-OD2 3.11Å; L1690-D1708 HydrophobicContact CD2-CB 4.1Å; Y1691-D1708 WeakPolarHBondContact CA-OD1 3.44Å; Y1691-D1708 VanDerWaalsContact N-CG 3.34Å; Y1691-D1708 PolarHBondContact N-OD1 3Å; Y1691-D1708 PolarHBondContact N-OD2 3.13Å; N1692-D1708 PolarHBondContact N-OD1 3.07Å; N1692-D1708 CarbonylContact O-C 3.56Å; N1692-D1708 WeakPolarHBondContact O-CA 3.38Å; I1706-D1708 HydrophobicContact CG2-CB 4.44Å; I1706-D1708 PolarHBondContact O-N 3.19Å; D1708-G1710 PolarHBondContact O-N 2.94Å; D1708-F1711 PolarHBondContact N-O 3.01Å; D1708-F1711 PolarHBondContact O-N 3.06Å; D1708-F1711 VanDerWaalsContact O-N 3.13Å; D1708-R1713 HydrophobicContact CB-CG 4.37Å; D1708-R1713 IonicContact OD2-CZ 2.78Å; D1708-R1713 IonicContact OD2-NE 3.38Å; D1708-R1713 PolarHBondContact OD2-NE 2.85Å; D1708-R1713 IonicContact OD2-NH2 3.5Å; D1708-R1713 PolarHBondContact OD2-NH2 3.09Å; D1708-Y1789 PolarHBondContact N-OH 3.4Å
1709	G	85.2	Confident	84	Confident	3 Å²	3	13.6 Å²	13.6	3%	0.031	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	-124.2	-173.1	0	0	0	0	0	111.1	N1692 F1711 Y1789	N1692-G1709 PolarHBondContact O-N 3.27Å; N1692-G1709 VanDerWaalsContact O-N 3.13Å; G1709-F1711 VanDerWaalsContact C-N 3.26Å; G1709-F1711 PolarHBondContact O-N 3.15Å; G1709-F1711 VanDerWaalsContact O-N 3.11Å; G1709-Y1789 VanDerWaalsContact O-CE1 3.26Å; G1709-Y1789 WeakPolarHBondContact O-CE1 3.42Å; G1709-Y1789 VanDerWaalsContact O-CZ 3.31Å; G1709-Y1789 PolarHBondContact O-OH 3.12Å
1710	G	85.1	Confident	81.9	Confident	0.8 Å²	0.8	16.5 Å²	16.5	1%	0.008	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	12.7	177.3	0	0	0	0	0	116.2	P1672 D1708 L1774 F1781	P1672-G1710 PolarHBondContact O-N 3.11Å; P1672-G1710 VanDerWaalsContact O-N 3.12Å; D1708-G1710 PolarHBondContact O-N 2.94Å; G1710-L1774 WeakPolarHBondContact O-CB 3.22Å; G1710-L1774 PolarHBondContact O-N 3.03Å; G1710-F1781 VanDerWaalsContact CA-CE2 3.46Å; G1710-F1781 VanDerWaalsContact CA-CZ 3.42Å
1711	F	87.4	Confident	79.8	Confident	14 Å²	14	19.3 Å²	19.3	6%	0.061	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	142.3	-176.1	-70.3	-97.5	0	0	0	113	R1670 P1672 N1673 C1675 G1707 D1708 G1709 R1713 D1771 Y1772 K1773 Y1789	R1670-F1711 VanDerWaalsContact NH2-CD2 3.29Å; P1672-F1711 WeakPolarHBondContact O-CD2 3.36Å; P1672-F1711 VanDerWaalsContact O-CE2 3.32Å; P1672-F1711 WeakPolarHBondContact O-CE2 3.23Å; N1673-F1711 WeakPolarHBondContact O-CE2 3.39Å; N1673-F1711 WeakPolarHBondContact O-CZ 3.35Å; C1675-F1711 HydrophobicContact CB-CD1 3.98Å; C1675-F1711 HydrophobicContact CB-CD2 4.38Å; C1675-F1711 HydrophobicContact CB-CE1 3.64Å; C1675-F1711 VanDerWaalsContact CB-CE1 3.44Å; C1675-F1711 HydrophobicContact CB-CE2 4.08Å; C1675-F1711 HydrophobicContact CB-CG 4.35Å; C1675-F1711 HydrophobicContact CB-CZ 3.61Å; G1707-F1711 CarbonylContact C-O 3.56Å; G1707-F1711 WeakPolarHBondContact CA-O 3.26Å; D1708-F1711 PolarHBondContact N-O 3.01Å; D1708-F1711 PolarHBondContact O-N 3.06Å; D1708-F1711 VanDerWaalsContact O-N 3.13Å; G1709-F1711 VanDerWaalsContact C-N 3.26Å; G1709-F1711 PolarHBondContact O-N 3.15Å; G1709-F1711 VanDerWaalsContact O-N 3.11Å; F1711-R1713 HydrophobicContact CB-CG 4.38Å; F1711-D1771 HydrophobicContact CD1-CB 4.32Å; F1711-Y1772 CarbonylContact C-O 3.53Å; F1711-Y1772 VanDerWaalsContact CA-O 3.29Å; F1711-Y1772 WeakPolarHBondContact CA-O 3.39Å; F1711-K1773 HydrophobicContact CD1-CB 4Å; F1711-K1773 HydrophobicContact CD1-CG 4.25Å; F1711-K1773 HydrophobicContact CE1-CB 3.61Å; F1711-K1773 HydrophobicContact CE1-CD 4.01Å; F1711-K1773 HydrophobicContact CE1-CG 3.75Å; F1711-K1773 VanDerWaalsContact CE1-CG 3.49Å; F1711-K1773 HydrophobicContact CE2-CD 4.35Å; F1711-K1773 HydrophobicContact CE2-CG 4.2Å; F1711-K1773 HydrophobicContact CZ-CB 4.1Å; F1711-K1773 HydrophobicContact CZ-CD 3.66Å; F1711-K1773 HydrophobicContact CZ-CG 3.69Å; F1711-Y1789 PolarHBondContact O-OH 2.97Å
1712	L	89.5	Confident	77.8	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	128.6	163.4	-67.3	-179.7	0	0	0	109.2	L1705 I1706 W1714 D1771 Y1772 L1774 Y1789 I1791 L1825 L1838	L1705-L1712 HydrophobicContact CD1-CB 4.05Å; L1705-L1712 HydrophobicContact CD1-CD2 4.33Å; I1706-L1712 CarbonylContact O-C 3.54Å; I1706-L1712 WeakPolarHBondContact O-CA 3.37Å; L1712-W1714 HydrophobicContact CB-CE3 4.36Å; L1712-W1714 HydrophobicContact CB-CH2 3.69Å; L1712-W1714 HydrophobicContact CB-CZ3 3.48Å; L1712-W1714 VanDerWaalsContact CB-CZ3 3.45Å; L1712-W1714 HydrophobicContact CD1-CH2 3.91Å; L1712-W1714 HydrophobicContact CD1-CZ3 4.33Å; L1712-W1714 HydrophobicContact CG-CH2 4.43Å; L1712-W1714 WeakPolarHBondContact O-CZ3 3.36Å; L1712-D1771 CarbonylContact O-C 3.56Å; L1712-D1771 WeakPolarHBondContact O-CA 3.41Å; L1712-Y1772 PolarHBondContact N-O 2.96Å; L1712-Y1772 PolarHBondContact O-N 3.11Å; L1712-L1774 HydrophobicContact CD1-CD2 3.84Å; L1712-L1774 HydrophobicContact CD2-CD1 4.44Å; L1712-L1774 HydrophobicContact CG-CD1 4.22Å; L1712-L1774 HydrophobicContact CG-CD2 3.89Å; L1712-L1774 HydrophobicContact CG-CG 4.23Å; L1712-Y1789 HydrophobicContact CD2-CE2 4.26Å; L1712-I1791 HydrophobicContact CD2-CD1 4.18Å; L1712-I1791 HydrophobicContact CD2-CG2 4.41Å; L1712-L1825 HydrophobicContact CD1-CD1 4.3Å; L1712-L1825 HydrophobicContact CD1-CD2 3.9Å; L1712-L1838 HydrophobicContact CD1-CD1 3.94Å; L1712-L1838 HydrophobicContact CD1-CD2 3.94Å
1713	R	87.9	Confident	75.5	Confident	0.2 Å²	0.2	30.3 Å²	30.3	0%	0.001	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	122	-175.9	-49.1	-170.9	105.8	-157.4	0.2	110.7	R1670 C1675 C1678 S1689 L1705 I1706 D1708 F1711 L1715 D1771	R1670-R1713 VanDerWaalsContact NE-NH2 3.17Å; C1675-R1713 PolarHBondContact SG-NH2 2.66Å; C1678-R1713 PolarHBondContact O-NH2 3.01Å; C1678-R1713 PolarHBondContact SG-NH1 2.94Å; C1678-R1713 PolarHBondContact SG-NH2 3.24Å; S1689-R1713 PolarHBondContact O-NH1 2.74Å; S1689-R1713 PolarHBondContact O-NH2 2.81Å; L1705-R1713 CarbonylContact C-O 3.51Å; L1705-R1713 WeakPolarHBondContact CA-O 3.37Å; L1705-R1713 WeakPolarHBondContact CD1-O 3.42Å; I1706-R1713 HydrophobicContact CB-CB 4.39Å; I1706-R1713 PolarHBondContact N-O 3.13Å; I1706-R1713 PolarHBondContact O-N 3.15Å; D1708-R1713 HydrophobicContact CB-CG 4.37Å; D1708-R1713 IonicContact OD2-CZ 2.78Å; D1708-R1713 IonicContact OD2-NE 3.38Å; D1708-R1713 PolarHBondContact OD2-NE 2.85Å; D1708-R1713 IonicContact OD2-NH2 3.5Å; D1708-R1713 PolarHBondContact OD2-NH2 3.09Å; F1711-R1713 HydrophobicContact CB-CG 4.38Å; R1713-L1715 HydrophobicContact CB-CD1 4.04Å; R1713-D1771 WeakPolarHBondContact CB-OD1 3.33Å; R1713-D1771 VanDerWaalsContact CD-OD1 3.23Å; R1713-D1771 WeakPolarHBondContact CD-OD1 3.28Å; R1713-D1771 HydrophobicContact CG-CB 4.48Å; R1713-D1771 VanDerWaalsContact CG-OD1 3.24Å; R1713-D1771 WeakPolarHBondContact CG-OD1 3.35Å; R1713-D1771 IonicContact CZ-OD1 3.68Å; R1713-D1771 VanDerWaalsContact CZ-OD1 3.22Å; R1713-D1771 IonicContact NE-OD1 3.25Å; R1713-D1771 PolarHBondContact NE-OD1 3.04Å; R1713-D1771 VanDerWaalsContact NH1-CG 3.35Å; R1713-D1771 IonicContact NH1-OD1 3.38Å; R1713-D1771 PolarHBondContact NH1-OD1 2.93Å; R1713-D1771 IonicContact NH1-OD2 3.76Å; R1713-D1771 PolarHBondContact NH1-OD2 2.81Å; R1713-D1771 IonicContact NH2-OD1 3.32Å; R1713-D1771 PolarHBondContact NH2-OD1 3.05Å; R1713-D1771 IonicContact NH2-OD2 3.66Å
1714	W	87.6	Confident	73.2	Confident	1.4 Å²	1.4	35.9 Å²	35.9	1%	0.005	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	129.5	176	-85.3	-98.6	0	0	0	110.3	D1699 N1703 L1704 L1705 L1712 I1769 I1770 Y1772 Y1797 Y1799 L1825 T1840 L1844	D1699-W1714 HydrophobicContact CB-CH2 3.87Å; D1699-W1714 HydrophobicContact CB-CZ2 4.35Å; D1699-W1714 HydrophobicContact CB-CZ3 3.92Å; N1703-W1714 HydrophobicContact CB-CE3 3.92Å; N1703-W1714 HydrophobicContact CB-CZ3 3.85Å; L1704-W1714 CarbonylContact O-C 3.54Å; L1704-W1714 WeakPolarHBondContact O-CA 3.15Å; L1705-W1714 HydrophobicContact CB-CD2 4.17Å; L1705-W1714 HydrophobicContact CB-CE3 4.31Å; L1705-W1714 HydrophobicContact CB-CH2 4.07Å; L1705-W1714 HydrophobicContact CB-CZ2 3.92Å; L1705-W1714 HydrophobicContact CB-CZ3 4.27Å; L1705-W1714 HydrophobicContact CD1-CD2 3.74Å; L1705-W1714 VanDerWaalsContact CD1-CD2 3.5Å; L1705-W1714 VanDerWaalsContact CD1-CE2 3.46Å; L1705-W1714 HydrophobicContact CD1-CE3 3.8Å; L1705-W1714 HydrophobicContact CD1-CG 3.97Å; L1705-W1714 HydrophobicContact CD1-CH2 4.16Å; L1705-W1714 HydrophobicContact CD1-CZ2 3.91Å; L1705-W1714 HydrophobicContact CD1-CZ3 4.03Å; L1705-W1714 HydrophobicContact CD2-CE3 4.42Å; L1705-W1714 HydrophobicContact CD2-CH2 4.13Å; L1705-W1714 HydrophobicContact CD2-CZ2 3.98Å; L1705-W1714 HydrophobicContact CD2-CZ3 3.76Å; L1705-W1714 HydrophobicContact CG-CD2 4.49Å; L1705-W1714 HydrophobicContact CG-CE3 4.44Å; L1705-W1714 HydrophobicContact CG-CH2 4.29Å; L1705-W1714 HydrophobicContact CG-CZ2 4.24Å; L1705-W1714 HydrophobicContact CG-CZ3 4.26Å; L1712-W1714 HydrophobicContact CB-CE3 4.36Å; L1712-W1714 HydrophobicContact CB-CH2 3.69Å; L1712-W1714 HydrophobicContact CB-CZ3 3.48Å; L1712-W1714 VanDerWaalsContact CB-CZ3 3.45Å; L1712-W1714 HydrophobicContact CD1-CH2 3.91Å; L1712-W1714 HydrophobicContact CD1-CZ3 4.33Å; L1712-W1714 HydrophobicContact CG-CH2 4.43Å; L1712-W1714 WeakPolarHBondContact O-CZ3 3.36Å; W1714-I1769 HydrophobicContact CB-CB 4.4Å; W1714-I1769 HydrophobicContact CB-CD1 4.18Å; W1714-I1769 HydrophobicContact CB-CG1 4.32Å; W1714-I1769 HydrophobicContact CG-CD1 4.16Å; W1714-I1769 PolarHBondContact O-N 2.97Å; W1714-I1770 HydrophobicContact CB-CG2 4.05Å; W1714-I1770 HydrophobicContact CD2-CG2 4.03Å; W1714-I1770 HydrophobicContact CE3-CG2 3.58Å; W1714-I1770 HydrophobicContact CG-CG2 4.34Å; W1714-I1770 HydrophobicContact CZ3-CG2 4.07Å; W1714-I1770 PolarHBondContact N-O 3.08Å; W1714-I1770 VanDerWaalsContact N-O 3.09Å; W1714-Y1772 HydrophobicContact CE3-CD2 4Å; W1714-Y1772 HydrophobicContact CE3-CE2 4.44Å; W1714-Y1772 HydrophobicContact CH2-CD2 4.27Å; W1714-Y1772 AromaticContact CZ3-CD2 3.5Å; W1714-Y1772 HydrophobicContact CZ3-CD2 3.5Å; W1714-Y1772 HydrophobicContact CZ3-CE2 4.31Å; W1714-Y1772 HydrophobicContact CZ3-CG 4.37Å; W1714-Y1797 HydrophobicContact CH2-CD1 4.42Å; W1714-Y1797 AromaticContact CH2-CE1 3.56Å; W1714-Y1797 HydrophobicContact CH2-CE1 3.56Å; W1714-Y1797 AromaticContact CH2-CZ 3.62Å; W1714-Y1797 VanDerWaalsContact CH2-OH 3.26Å; W1714-Y1797 WeakPolarHBondContact CH2-OH 3.39Å; W1714-Y1797 HydrophobicContact CZ2-CD1 4.33Å; W1714-Y1797 AromaticContact CZ2-CE1 3.54Å; W1714-Y1797 HydrophobicContact CZ2-CE1 3.54Å; W1714-Y1797 HydrophobicContact CZ3-CE1 4.45Å; W1714-Y1797 PolarHBondContact NE1-OH 3.1Å; W1714-Y1797 VanDerWaalsContact NE1-OH 3.08Å; W1714-Y1799 HydrophobicContact CB-CD1 4.35Å; W1714-Y1799 HydrophobicContact CB-CE1 4.46Å; W1714-Y1799 AromaticContact CD1-CD1 3.95Å; W1714-Y1799 AromaticContact CD1-CD2 3.7Å; W1714-Y1799 AromaticContact CD1-CG 3.68Å; W1714-Y1799 HydrophobicContact CD2-CD1 4.29Å; W1714-Y1799 AromaticContact CD2-CD2 3.75Å; W1714-Y1799 HydrophobicContact CD2-CD2 3.98Å; W1714-Y1799 HydrophobicContact CD2-CE2 4.26Å; W1714-Y1799 AromaticContact CD2-CG 3.86Å; W1714-Y1799 HydrophobicContact CD2-CG 4.01Å; W1714-Y1799 AromaticContact CE2-CD2 3.71Å; W1714-Y1799 HydrophobicContact CE3-CD1 4.36Å; W1714-Y1799 AromaticContact CE3-CD2 3.87Å; W1714-Y1799 HydrophobicContact CE3-CD2 3.87Å; W1714-Y1799 HydrophobicContact CE3-CE2 4.34Å; W1714-Y1799 HydrophobicContact CE3-CG 4.05Å; W1714-Y1799 HydrophobicContact CG-CD1 4.28Å; W1714-Y1799 AromaticContact CG-CD2 3.92Å; W1714-Y1799 HydrophobicContact CG-CD2 4.18Å; W1714-Y1799 HydrophobicContact CG-CE1 4.46Å; W1714-Y1799 HydrophobicContact CG-CE2 4.35Å; W1714-Y1799 HydrophobicContact CG-CG 4.24Å; W1714-Y1799 HydrophobicContact CZ2-CD2 4.39Å; W1714-Y1799 HydrophobicContact CZ3-CD2 4.36Å; W1714-Y1799 HydrophobicContact CZ3-CG 4.5Å; W1714-Y1799 AromaticContact NE1-CD2 3.57Å; W1714-Y1799 AromaticContact NE1-CG 3.87Å; W1714-L1825 HydrophobicContact CH2-CD2 4.03Å; W1714-L1825 HydrophobicContact CZ2-CD2 4.02Å; W1714-L1825 HydrophobicContact CZ3-CD2 4.18Å; W1714-T1840 HydrophobicContact CH2-CG2 4.4Å; W1714-T1840 HydrophobicContact CZ2-CG2 4.08Å; W1714-T1840 HydrophobicContact CZ3-CG2 4.03Å; W1714-L1844 HydrophobicContact CH2-CD1 3.83Å; W1714-L1844 HydrophobicContact CH2-CD2 4Å; W1714-L1844 HydrophobicContact CZ2-CD1 3.99Å
1715	L	87.6	Confident	70.5	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	134.3	177.2	-69.5	83.8	0	0	0	109.1	V1662 I1663 T1685 N1703 L1704 I1706 R1713 W1766 E1767 T1768	V1662-L1715 HydrophobicContact CG1-CD2 3.86Å; I1663-L1715 HydrophobicContact CB-CD1 4.38Å; I1663-L1715 HydrophobicContact CB-CD2 4.2Å; I1663-L1715 HydrophobicContact CD1-CD1 4.06Å; I1663-L1715 HydrophobicContact CD1-CD2 4.23Å; I1663-L1715 HydrophobicContact CG2-CD1 4.09Å; I1663-L1715 HydrophobicContact CG2-CD2 4.15Å; T1685-L1715 HydrophobicContact CG2-CD2 3.62Å; T1685-L1715 HydrophobicContact CG2-CG 4.32Å; N1703-L1715 CarbonylContact C-O 3.57Å; N1703-L1715 WeakPolarHBondContact CA-O 3.45Å; N1703-L1715 WeakPolarHBondContact CB-O 3.43Å; L1704-L1715 HydrophobicContact CB-CB 4.38Å; L1704-L1715 HydrophobicContact CD2-CD1 4.12Å; L1704-L1715 PolarHBondContact N-O 3.26Å; L1704-L1715 PolarHBondContact O-N 3.1Å; I1706-L1715 HydrophobicContact CD1-CD1 3.75Å; I1706-L1715 HydrophobicContact CD1-CD2 4.11Å; I1706-L1715 HydrophobicContact CG1-CD1 4.32Å; R1713-L1715 HydrophobicContact CB-CD1 4.04Å; L1715-W1766 HydrophobicContact CB-CE3 3.93Å; L1715-W1766 HydrophobicContact CD2-CB 4.35Å; L1715-W1766 WeakPolarHBondContact O-CZ3 3.3Å; L1715-E1767 CarbonylContact C-O 3.58Å; L1715-E1767 VanDerWaalsContact CA-O 3.24Å; L1715-E1767 WeakPolarHBondContact CA-O 3.31Å; L1715-T1768 HydrophobicContact CD1-CG2 4.4Å; L1715-T1768 HydrophobicContact CG-CG2 4.17Å
1716	N	82.5	Confident	67.7	Low	33.4 Å²	33.4	46.7 Å²	46.7	18%	0.179	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	159.6	168.3	149.2	3.2	0	0	0	109.2	N1703 T1718 W1766 E1767 I1769	N1703-N1716 VanDerWaalsContact OD1-CB 3.26Å; N1703-N1716 WeakPolarHBondContact OD1-CB 3.4Å; N1703-N1716 PolarHBondContact OD1-ND2 2.82Å; N1703-N1716 PolarHBondContact OD1-OD1 3.01Å; N1703-N1716 VanDerWaalsContact OD1-OD1 3.09Å; N1716-T1718 HydrophobicContact CB-CG2 4.49Å; N1716-T1718 VanDerWaalsContact ND2-CG2 3.33Å; N1716-T1718 WeakPolarHBondContact ND2-CG2 3.49Å; N1716-T1718 PolarHBondContact ND2-O 3.19Å; N1716-T1718 PolarHBondContact ND2-OG1 3.14Å; N1716-T1718 WeakPolarHBondContact OD1-CG2 3.39Å; N1716-T1718 PolarHBondContact OD1-N 3.11Å; N1716-T1718 PolarHBondContact OD1-O 2.89Å; N1716-T1718 PolarHBondContact OD1-OG1 3.03Å; N1716-W1766 CarbonylContact O-C 3.49Å; N1716-W1766 VanDerWaalsContact O-CA 3.26Å; N1716-W1766 WeakPolarHBondContact O-CA 3.3Å; N1716-E1767 PolarHBondContact N-O 3.12Å; N1716-E1767 VanDerWaalsContact N-O 3.08Å; N1716-E1767 PolarHBondContact O-N 2.92Å; N1716-E1767 PolarHBondContact OD1-O 3.36Å; N1716-I1769 HydrophobicContact CB-CD1 3.6Å; N1716-I1769 HydrophobicContact CB-CG1 3.86Å; N1716-I1769 VanDerWaalsContact CG-CD1 3.48Å; N1716-I1769 VanDerWaalsContact CG-CG1 3.42Å
1717	S	75	Confident	64.8	Low	14.2 Å²	14.2	50.5 Å²	50.5	10%	0.099	27%	0.27	C	S	.	.			trans	-104.3	45.3	171	161.2	0	0	0	0	111.3	K1719 N1761 R1763 R1764 K1765	S1717-K1719 PolarHBondContact O-N 2.84Å; S1717-N1761 WeakPolarHBondContact O-CA 3.46Å; S1717-N1761 WeakPolarHBondContact O-CB 3.47Å; S1717-N1761 PolarHBondContact O-OD1 2.86Å; S1717-R1763 WeakPolarHBondContact OG-CA 3.33Å; S1717-R1763 VanDerWaalsContact OG-CB 3.3Å; S1717-R1763 WeakPolarHBondContact OG-CB 3.43Å; S1717-R1763 WeakPolarHBondContact OG-CD 3.43Å; S1717-R1763 WeakPolarHBondContact OG-CG 3.23Å; S1717-R1763 PolarHBondContact OG-N 2.7Å; S1717-R1764 WeakPolarHBondContact OG-CB 3.37Å; S1717-R1764 WeakPolarHBondContact OG-CG 3.41Å; S1717-K1765 CarbonylContact C-O 3.46Å; S1717-K1765 VanDerWaalsContact CA-O 3.29Å; S1717-K1765 WeakPolarHBondContact CA-O 3.32Å; S1717-K1765 WeakPolarHBondContact CB-O 3.39Å; S1717-K1765 PolarHBondContact OG-O 2.88Å
1718	T	61.5	Low	62.1	Low	45 Å²	45	53.7 Å²	53.7	28%	0.276	30%	0.296	S	S	.	.			trans	-101.4	136	178.1	56.1	0	0	0	0	111.3	R1314 N1716 N1761 E1767	R1314-T1718 PolarHBondContact NH1-OG1 3.33Å; R1314-T1718 VanDerWaalsContact NH1-OG1 3.1Å; N1716-T1718 HydrophobicContact CB-CG2 4.49Å; N1716-T1718 VanDerWaalsContact ND2-CG2 3.33Å; N1716-T1718 WeakPolarHBondContact ND2-CG2 3.49Å; N1716-T1718 PolarHBondContact ND2-O 3.19Å; N1716-T1718 PolarHBondContact ND2-OG1 3.14Å; N1716-T1718 WeakPolarHBondContact OD1-CG2 3.39Å; N1716-T1718 PolarHBondContact OD1-N 3.11Å; N1716-T1718 PolarHBondContact OD1-O 2.89Å; N1716-T1718 PolarHBondContact OD1-OG1 3.03Å; T1718-N1761 HydrophobicContact CG2-CB 4.4Å; T1718-E1767 WeakPolarHBondContact CB-OE2 3.34Å; T1718-E1767 HydrophobicContact CG2-CB 4.35Å; T1718-E1767 WeakPolarHBondContact CG2-OE2 3.41Å; T1718-E1767 PolarHBondContact OG1-OE2 2.88Å
1719	K	51.5	Low	59.3	Low	102 Å²	102	57.1 Å²	57.1	44%	0.443	33%	0.325	S	S	.	.			trans	-69.6	139.8	159.9	-83.3	-175.9	169.5	-129	0	109.1	S1717 A1721 E1723 F1754 R1760 D1762 K1765 E1767	S1717-K1719 PolarHBondContact O-N 2.84Å; K1719-A1721 PolarHBondContact O-N 2.85Å; K1719-E1723 WeakPolarHBondContact CD-OE2 3.41Å; K1719-E1723 WeakPolarHBondContact CE-OE2 3.3Å; K1719-E1723 IonicContact NZ-OE1 3.41Å; K1719-E1723 PolarHBondContact NZ-OE1 3Å; K1719-E1723 IonicContact NZ-OE2 2.87Å; K1719-E1723 PolarHBondContact NZ-OE2 3.08Å; K1719-F1754 HydrophobicContact CD-CE2 4.45Å; K1719-R1760 WeakPolarHBondContact CB-O 3.34Å; K1719-R1760 WeakPolarHBondContact CG-O 3.35Å; K1719-R1760 PolarHBondContact N-O 3.32Å; K1719-D1762 HydrophobicContact CG-CB 4.03Å; K1719-K1765 HydrophobicContact CD-CD 4.33Å; K1719-E1767 VanDerWaalsContact CE-OE1 3.25Å; K1719-E1767 WeakPolarHBondContact CE-OE1 3.24Å; K1719-E1767 IonicContact NZ-OE1 2.79Å; K1719-E1767 IonicContact NZ-OE2 3.19Å
1720	P	44.8	Very low	56.7	Low	69.6 Å²	69.6	64.8 Å²	64.8	45%	0.452	36%	0.364	S	S	.	.			trans	-71.6	131.6	-173.8	27.7	-32.2	0	0	0	111	E1722 E1723	P1720-E1722 HydrophobicContact CB-CB 4.14Å; P1720-E1722 HydrophobicContact CB-CG 4.39Å; P1720-E1722 PolarHBondContact O-N 3.18Å; P1720-E1723 HydrophobicContact CG-CB 4.26Å; P1720-E1723 PolarHBondContact O-N 3.02Å
1721	A	39.7	Very low	54.1	Low	75.2 Å²	75.2	69.3 Å²	69.3	62%	0.621	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-13.2	177.4	0	0	0	0	0	113.6	K1719 E1723 Y1724	K1719-A1721 PolarHBondContact O-N 2.85Å; A1721-E1723 VanDerWaalsContact C-N 3.34Å; A1721-E1723 PolarHBondContact O-N 2.93Å; A1721-Y1724 WeakPolarHBondContact O-CB 3.43Å; A1721-Y1724 PolarHBondContact O-N 2.99Å; A1721-Y1724 VanDerWaalsContact O-N 3.11Å
1722	E	38.2	Very low	51.3	Low	141.4 Å²	141.4	74.2 Å²	74.2	66%	0.661	43%	0.432	S	S	*	.	H	α-helix	trans	-70.1	-24.9	-178.8	-60.2	-154.1	142.3	0	0	113.6	P1720 Y1724 K1725 S1726	P1720-E1722 HydrophobicContact CB-CB 4.14Å; P1720-E1722 HydrophobicContact CB-CG 4.39Å; P1720-E1722 PolarHBondContact O-N 3.18Å; E1722-Y1724 PolarHBondContact O-N 2.99Å; E1722-K1725 WeakPolarHBondContact O-CA 3.27Å; E1722-K1725 WeakPolarHBondContact O-CB 3.28Å; E1722-K1725 PolarHBondContact O-N 3.08Å; E1722-S1726 PolarHBondContact O-N 2.96Å; E1722-S1726 PolarHBondContact O-OG 2.8Å
1723	E	37.8	Very low	48.5	Very low	115 Å²	115	79.4 Å²	79.4	54%	0.537	47%	0.468	S	S	.	.	H	α-helix	trans	-69.6	-20.8	177	-148.4	174.5	-156.7	0	0	112.4	K1719 P1720 A1721 K1725 S1726 S1727 Q1757	K1719-E1723 WeakPolarHBondContact CD-OE2 3.41Å; K1719-E1723 WeakPolarHBondContact CE-OE2 3.3Å; K1719-E1723 IonicContact NZ-OE1 3.41Å; K1719-E1723 PolarHBondContact NZ-OE1 3Å; K1719-E1723 IonicContact NZ-OE2 2.87Å; K1719-E1723 PolarHBondContact NZ-OE2 3.08Å; P1720-E1723 HydrophobicContact CG-CB 4.26Å; P1720-E1723 PolarHBondContact O-N 3.02Å; A1721-E1723 VanDerWaalsContact C-N 3.34Å; A1721-E1723 PolarHBondContact O-N 2.93Å; E1723-K1725 VanDerWaalsContact C-N 3.29Å; E1723-K1725 PolarHBondContact O-N 2.68Å; E1723-S1726 PolarHBondContact O-OG 2.99Å; E1723-S1727 WeakPolarHBondContact O-CB 3.4Å; E1723-S1727 PolarHBondContact O-N 2.82Å; E1723-S1727 VanDerWaalsContact O-N 3.14Å; E1723-S1727 PolarHBondContact O-OG 3.14Å; E1723-S1727 VanDerWaalsContact O-OG 3.11Å; E1723-Q1757 PolarHBondContact OE2-NE2 3.42Å
1724	Y	39.1	Very low	45.9	Very low	131.2 Å²	131.2	84.4 Å²	84.4	52%	0.515	50%	0.503	S	S	.	.	H	α-helix	trans	-89.2	-16	174.6	-88.3	-91.1	0	0	0	114.3	A1721 E1722 S1726 S1727 M1742 F1754 E1756 R1760	A1721-Y1724 WeakPolarHBondContact O-CB 3.43Å; A1721-Y1724 PolarHBondContact O-N 2.99Å; A1721-Y1724 VanDerWaalsContact O-N 3.11Å; E1722-Y1724 PolarHBondContact O-N 2.99Å; Y1724-S1726 PolarHBondContact O-N 3.16Å; Y1724-S1727 WeakPolarHBondContact CA-OG 3.46Å; Y1724-S1727 WeakPolarHBondContact CD1-OG 3.38Å; Y1724-S1727 PolarHBondContact O-N 3.11Å; Y1724-S1727 VanDerWaalsContact O-N 3.12Å; Y1724-S1727 PolarHBondContact O-OG 2.96Å; Y1724-M1742 VanDerWaalsContact O-CE 3.28Å; Y1724-M1742 WeakPolarHBondContact O-CE 3.47Å; Y1724-F1754 HydrophobicContact CD1-CE2 4.32Å; Y1724-F1754 HydrophobicContact CG-CE2 4.27Å; Y1724-E1756 PolarHBondContact OH-OE2 2.88Å; Y1724-R1760 VanDerWaalsContact OH-CZ 3.3Å; Y1724-R1760 PolarHBondContact OH-NH1 3.47Å; Y1724-R1760 PolarHBondContact OH-NH2 2.97Å
1725	K	35.2	Very low	43.2	Very low	155 Å²	155	93.3 Å²	93.3	67%	0.674	55%	0.545	S	S	*	.	H	α-helix	trans	-75.8	-28.9	172.7	-74.6	-177.1	179.2	173.5	0	112.2	E1722 E1723 S1727 A1728 A1729 M1742	E1722-K1725 WeakPolarHBondContact O-CA 3.27Å; E1722-K1725 WeakPolarHBondContact O-CB 3.28Å; E1722-K1725 PolarHBondContact O-N 3.08Å; E1723-K1725 VanDerWaalsContact C-N 3.29Å; E1723-K1725 PolarHBondContact O-N 2.68Å; K1725-S1727 PolarHBondContact O-N 2.6Å; K1725-A1728 PolarHBondContact O-N 3.29Å; K1725-A1729 WeakPolarHBondContact O-CB 3.42Å; K1725-A1729 PolarHBondContact O-N 3.46Å; K1725-A1729 VanDerWaalsContact O-N 3.15Å; K1725-M1742 HydrophobicContact CD-SD 4.31Å; K1725-M1742 VanDerWaalsContact CE-SD 3.59Å; K1725-M1742 HydrophobicContact CG-CE 4.13Å; K1725-M1742 HydrophobicContact CG-SD 4.13Å
1726	S	32.8	Very low	40.4	Very low	78.4 Å²	78.4	98.6 Å²	98.6	55%	0.548	58%	0.582	S	S	.	*	H	α-helix	trans	-74.4	-33.2	-179.2	113.7	0	0	0	0	113.7	E1722 E1723 Y1724 A1728 A1729 L1730	E1722-S1726 PolarHBondContact O-N 2.96Å; E1722-S1726 PolarHBondContact O-OG 2.8Å; E1723-S1726 PolarHBondContact O-OG 2.99Å; Y1724-S1726 PolarHBondContact O-N 3.16Å; S1726-A1728 PolarHBondContact O-N 2.95Å; S1726-A1728 VanDerWaalsContact O-N 3.12Å; S1726-A1729 WeakPolarHBondContact O-CB 3.28Å; S1726-A1729 PolarHBondContact O-N 2.88Å; S1726-A1729 VanDerWaalsContact O-N 3.08Å; S1726-L1730 WeakPolarHBondContact O-CD1 3.18Å
1727	S	33	Very low	37.9	Very low	81 Å²	81	102.8 Å²	102.8	57%	0.566	61%	0.614	S	S	*	*	H	α-helix	trans	-78	-19.5	-178.4	48.5	0	0	0	0	114.2	E1723 Y1724 K1725 A1729 L1730	E1723-S1727 WeakPolarHBondContact O-CB 3.4Å; E1723-S1727 PolarHBondContact O-N 2.82Å; E1723-S1727 VanDerWaalsContact O-N 3.14Å; E1723-S1727 PolarHBondContact O-OG 3.14Å; E1723-S1727 VanDerWaalsContact O-OG 3.11Å; Y1724-S1727 WeakPolarHBondContact CA-OG 3.46Å; Y1724-S1727 WeakPolarHBondContact CD1-OG 3.38Å; Y1724-S1727 PolarHBondContact O-N 3.11Å; Y1724-S1727 VanDerWaalsContact O-N 3.12Å; Y1724-S1727 PolarHBondContact O-OG 2.96Å; K1725-S1727 PolarHBondContact O-N 2.6Å; S1727-A1729 VanDerWaalsContact C-N 3.32Å; S1727-A1729 PolarHBondContact O-N 3.44Å; S1727-L1730 PolarHBondContact O-N 3.28Å
1728	A	33.1	Very low	35.7	Very low	66.2 Å²	66.2	106.4 Å²	106.4	55%	0.547	64%	0.639	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.5	-13.8	171.6	0	0	0	0	0	113.6	K1725 S1726 L1730 S1731 M1742	K1725-A1728 PolarHBondContact O-N 3.29Å; S1726-A1728 PolarHBondContact O-N 2.95Å; S1726-A1728 VanDerWaalsContact O-N 3.12Å; A1728-L1730 PolarHBondContact O-N 3.33Å; A1728-L1730 VanDerWaalsContact O-N 3.17Å; A1728-S1731 PolarHBondContact O-N 2.91Å; A1728-S1731 PolarHBondContact O-OG 2.96Å; A1728-M1742 HydrophobicContact CB-CE 4.36Å
1729	A	31.8	Very low	34.2	Very low	72.4 Å²	72.4	109.8 Å²	109.8	60%	0.598	67%	0.665	S	S	*	*	S	Bend	trans	-87.6	-5	-175.1	0	0	0	0	0	114.6	K1725 S1726 S1727 S1731	K1725-A1729 WeakPolarHBondContact O-CB 3.42Å; K1725-A1729 PolarHBondContact O-N 3.46Å; K1725-A1729 VanDerWaalsContact O-N 3.15Å; S1726-A1729 WeakPolarHBondContact O-CB 3.28Å; S1726-A1729 PolarHBondContact O-N 2.88Å; S1726-A1729 VanDerWaalsContact O-N 3.08Å; S1727-A1729 VanDerWaalsContact C-N 3.32Å; S1727-A1729 PolarHBondContact O-N 3.44Å; A1729-S1731 PolarHBondContact O-N 3.09Å
1730	L	30.8	Very low	33	Very low	163.8 Å²	163.8	114.2 Å²	114.2	86%	0.858	68%	0.684	S	S	*	*			trans	-91.8	24.6	-179.1	-109.7	93.3	0	0	0	114.9	S1726 S1727 A1728	S1726-L1730 WeakPolarHBondContact O-CD1 3.18Å; S1727-L1730 PolarHBondContact O-N 3.28Å; A1728-L1730 PolarHBondContact O-N 3.33Å; A1728-L1730 VanDerWaalsContact O-N 3.17Å
1731	S	29.8	Very low	32.2	Very low	96.6 Å²	96.6	121.2 Å²	121.2	68%	0.676	70%	0.701	S	S	*	*	S	Bend	trans	-135.1	87.1	170.9	64.5	0	0	0	0	113.1	A1728 A1729 S1733	A1728-S1731 PolarHBondContact O-N 2.91Å; A1728-S1731 PolarHBondContact O-OG 2.96Å; A1729-S1731 PolarHBondContact O-N 3.09Å; S1731-S1733 PolarHBondContact O-N 2.89Å
1732	S	29.3	Very low	31.5	Very low	115.8 Å²	115.8	124.1 Å²	124.1	81%	0.81	70%	0.704	S	S	*	*			trans	-105.8	94.5	169	61.9	0	0	0	0	113.5	S1734	S1732-S1734 VanDerWaalsContact C-N 3.33Å; S1732-S1734 PolarHBondContact O-N 3.46Å; S1732-S1734 VanDerWaalsContact O-N 3.11Å
1733	S	30	Very low	31	Very low	108.6 Å²	108.6	122.2 Å²	122.2	76%	0.759	70%	0.704	S	S	*	*			trans	-104.4	121.3	166.7	55.7	0	0	0	0	110.5	S1731	S1731-S1733 PolarHBondContact O-N 2.89Å
1734	S	32.6	Very low	30.7	Very low	105.2 Å²	105.2	122.5 Å²	122.5	74%	0.736	71%	0.709	S	S	*	*			trans	70.2	119.7	154.5	63.2	0	0	0	0	117.4	S1732	S1732-S1734 VanDerWaalsContact C-N 3.33Å; S1732-S1734 PolarHBondContact O-N 3.46Å; S1732-S1734 VanDerWaalsContact O-N 3.11Å
1735	Q	30.3	Very low	30.4	Very low	188.6 Å²	188.6	122.8 Å²	122.8	88%	0.881	72%	0.718	S	S	*	*			trans	33.9	104.1	145.9	-60.4	177.1	-3.5	0	0	117
1736	S	30.7	Very low	30.4	Very low	111 Å²	111	125.2 Å²	125.2	78%	0.776	72%	0.723	S	S	*	*				176.4	144.1	116.5	51.2	0	0	0	0	111.7	S1738	S1736-S1738 PolarHBondContact O-N 3.05Å; S1736-S1738 VanDerWaalsContact O-N 3.16Å
1737	S	29.7	Very low	30.7	Very low	122.2 Å²	122.2	124.4 Å²	124.4	86%	0.855	72%	0.716	S	S	*	*			trans	-53.6	114.2	172.1	-11.5	0	0	0	0	114.3
1738	S	28.4	Very low	31.3	Very low	90.6 Å²	90.6	127 Å²	127	63%	0.634	72%	0.724	S	S	*	*			trans	173.1	127.6	154.1	63.6	0	0	0	0	112.9	S1736 F1740	S1736-S1738 PolarHBondContact O-N 3.05Å; S1736-S1738 VanDerWaalsContact O-N 3.16Å; S1738-F1740 WeakPolarHBondContact O-CD2 3.43Å; S1738-F1740 PolarHBondContact O-N 3.11Å; S1738-F1740 VanDerWaalsContact OG-CD2 3.32Å; S1738-F1740 WeakPolarHBondContact OG-CD2 3.37Å; S1738-F1740 WeakPolarHBondContact OG-CE2 3.42Å
1739	S	30	Very low	32.3	Very low	115.8 Å²	115.8	125.9 Å²	125.9	81%	0.81	71%	0.712	S	S	*	*			trans	-65.5	88.7	171.2	38.9	0	0	0	0	112.4	R1741	S1739-R1741 VanDerWaalsContact C-N 3.29Å; S1739-R1741 PolarHBondContact O-N 3.15Å; S1739-R1741 VanDerWaalsContact O-N 3.12Å
1740	F	26.5	Very low	33.3	Very low	195.4 Å²	195.4	124.5 Å²	124.5	86%	0.857	70%	0.695	S	S	*	*			trans	-73.3	85.4	166.2	-94	-87.9	0	0	0	109.2	S1738 M1742	S1738-F1740 WeakPolarHBondContact O-CD2 3.43Å; S1738-F1740 PolarHBondContact O-N 3.11Å; S1738-F1740 VanDerWaalsContact OG-CD2 3.32Å; S1738-F1740 WeakPolarHBondContact OG-CD2 3.37Å; S1738-F1740 WeakPolarHBondContact OG-CE2 3.42Å; F1740-M1742 VanDerWaalsContact C-N 3.29Å; F1740-M1742 PolarHBondContact O-N 2.95Å
1741	R	27.1	Very low	34.5	Very low	215.2 Å²	215.2	118.2 Å²	118.2	81%	0.812	66%	0.662	S	S	*	*			trans	-69.1	117.3	157.8	-119.8	-178.8	-173.2	-168.9	0.4	106.5	S1739 P1743	S1739-R1741 VanDerWaalsContact C-N 3.29Å; S1739-R1741 PolarHBondContact O-N 3.15Å; S1739-R1741 VanDerWaalsContact O-N 3.12Å; R1741-P1743 WeakPolarHBondContact O-CD 3.36Å; R1741-P1743 VanDerWaalsContact O-N 3.11Å
1742	M	25.9	Very low	35.7	Very low	136 Å²	136	115.4 Å²	115.4	67%	0.67	64%	0.642	S	S	*	*			trans	-53.9	133.3	166.9	-86.3	-70.9	-146.2	0	0	108.2	Y1724 K1725 A1728 F1740 L1744	Y1724-M1742 VanDerWaalsContact O-CE 3.28Å; Y1724-M1742 WeakPolarHBondContact O-CE 3.47Å; K1725-M1742 HydrophobicContact CD-SD 4.31Å; K1725-M1742 VanDerWaalsContact CE-SD 3.59Å; K1725-M1742 HydrophobicContact CG-CE 4.13Å; K1725-M1742 HydrophobicContact CG-SD 4.13Å; A1728-M1742 HydrophobicContact CB-CE 4.36Å; F1740-M1742 VanDerWaalsContact C-N 3.29Å; F1740-M1742 PolarHBondContact O-N 2.95Å; M1742-L1744 PolarHBondContact O-N 3.11Å; M1742-L1744 VanDerWaalsContact O-N 3.11Å
1743	P	27.7	Very low	36.7	Very low	102.4 Å²	102.4	113.9 Å²	113.9	67%	0.665	63%	0.63	S	S	*	*			trans	-61.5	121.8	171.1	17.9	-19	0	0	0	107.2	R1741 I1745	R1741-P1743 WeakPolarHBondContact O-CD 3.36Å; R1741-P1743 VanDerWaalsContact O-N 3.11Å; P1743-I1745 PolarHBondContact O-N 3.09Å
1744	L	31.2	Very low	37.7	Very low	121.8 Å²	121.8	111.3 Å²	111.3	64%	0.638	61%	0.605	S	S	*	*			trans	-57.2	99	166.1	-82.5	155.1	0	0	0	107.3	D931 E1309 M1742 R1746	D931-L1744 WeakPolarHBondContact OD2-CD1 3.44Å; E1309-L1744 VanDerWaalsContact OE1-CD2 3.3Å; E1309-L1744 WeakPolarHBondContact OE1-CD2 3.34Å; M1742-L1744 PolarHBondContact O-N 3.11Å; M1742-L1744 VanDerWaalsContact O-N 3.11Å; L1744-R1746 VanDerWaalsContact C-N 3.29Å; L1744-R1746 HydrophobicContact CB-CG 4.28Å; L1744-R1746 PolarHBondContact O-N 2.98Å
1745	I	32.4	Very low	38.7	Very low	136.6 Å²	136.6	108.2 Å²	108.2	70%	0.701	58%	0.579	S	S	*	*			trans	-62.8	97.2	166	-60.1	174	0	0	0	105	P1743 S1747	P1743-I1745 PolarHBondContact O-N 3.09Å; I1745-S1747 PolarHBondContact O-N 3.08Å; I1745-S1747 PolarHBondContact O-OG 2.92Å
1746	R	35.9	Very low	39.8	Very low	206.6 Å²	206.6	103.1 Å²	103.1	78%	0.78	56%	0.555	S	S	*	*			trans	-58.8	98.5	166.4	-70.1	-174.9	-172.4	-161.6	0.4	106.3	D931 L1744 D1748 S1749	D931-R1746 IonicContact OD1-CZ 3.43Å; D931-R1746 IonicContact OD1-NE 3.34Å; D931-R1746 IonicContact OD1-NH2 3.21Å; D931-R1746 PolarHBondContact OD1-NH2 2.86Å; L1744-R1746 VanDerWaalsContact C-N 3.29Å; L1744-R1746 HydrophobicContact CB-CG 4.28Å; L1744-R1746 PolarHBondContact O-N 2.98Å; R1746-D1748 PolarHBondContact O-N 3.33Å; R1746-S1749 PolarHBondContact O-N 2.99Å
1747	S	39	Very low	40.9	Very low	59.8 Å²	59.8	101.5 Å²	101.5	42%	0.418	54%	0.535	S	S	.	.			trans	-71.3	116.6	167.6	50.6	0	0	0	0	107.7	I1745 S1749 S1752	I1745-S1747 PolarHBondContact O-N 3.08Å; I1745-S1747 PolarHBondContact O-OG 2.92Å; S1747-S1749 VanDerWaalsContact C-N 3.33Å; S1747-S1749 PolarHBondContact O-N 3.05Å; S1747-S1749 PolarHBondContact OG-O 3.09Å; S1747-S1752 VanDerWaalsContact OG-CB 3.28Å; S1747-S1752 WeakPolarHBondContact OG-CB 3.47Å
1748	D	46	Very low	42	Very low	136.4 Å²	136.4	98 Å²	98	73%	0.729	51%	0.507	S	S	*	.	S	Bend	trans	-71.7	2.4	-174.5	-63.5	-44.7	0	0	0	113.2	R1302 R1746 L1750	R1302-D1748 PolarHBondContact NH2-O 3.43Å; R1746-D1748 PolarHBondContact O-N 3.33Å; D1748-L1750 PolarHBondContact O-N 3.49Å
1749	S	53	Low	43.2	Very low	42.6 Å²	42.6	98.3 Å²	98.3	30%	0.298	50%	0.497	S	S	.	.	S	Bend	trans	-132	134.5	169.1	169.6	0	0	0	0	111.1	E1298 R1746 S1747 N1751 S1752	E1298-S1749 WeakPolarHBondContact OE1-CA 3.31Å; E1298-S1749 VanDerWaalsContact OE2-CA 3.32Å; E1298-S1749 WeakPolarHBondContact OE2-CA 3.44Å; E1298-S1749 WeakPolarHBondContact OE2-CB 3.28Å; E1298-S1749 PolarHBondContact OE2-OG 3.22Å; R1746-S1749 PolarHBondContact O-N 2.99Å; S1747-S1749 VanDerWaalsContact C-N 3.33Å; S1747-S1749 PolarHBondContact O-N 3.05Å; S1747-S1749 PolarHBondContact OG-O 3.09Å; S1749-N1751 PolarHBondContact O-N 2.99Å; S1749-N1751 VanDerWaalsContact O-N 3.13Å; S1749-N1751 WeakPolarHBondContact OG-CB 3.28Å; S1749-N1751 PolarHBondContact OG-N 3.08Å; S1749-N1751 VanDerWaalsContact OG-N 3.17Å; S1749-N1751 PolarHBondContact OG-ND2 2.81Å; S1749-S1752 PolarHBondContact O-N 3.11Å
1750	L	53.8	Low	44.2	Very low	43.2 Å²	43.2	98.8 Å²	98.8	23%	0.226	48%	0.481	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	6.7	170.1	-69.1	171.3	0	0	0	113	Y1294 E1298 L1301 V1308 D1748 S1752 P1753 Q1755	Y1294-L1750 HydrophobicContact CD1-CB 4.23Å; Y1294-L1750 WeakPolarHBondContact CD1-O 3.18Å; Y1294-L1750 HydrophobicContact CE1-CB 3.97Å; Y1294-L1750 HydrophobicContact CE1-CD2 4.13Å; Y1294-L1750 WeakPolarHBondContact CE1-O 3.46Å; E1298-L1750 HydrophobicContact CB-CD1 3.88Å; E1298-L1750 HydrophobicContact CB-CG 4.36Å; E1298-L1750 HydrophobicContact CG-CD1 3.84Å; E1298-L1750 HydrophobicContact CG-CG 4.11Å; E1298-L1750 PolarHBondContact OE1-N 3.36Å; E1298-L1750 PolarHBondContact OE2-N 3.11Å; L1301-L1750 HydrophobicContact CB-CD1 4.01Å; L1301-L1750 HydrophobicContact CD1-CD1 3.71Å; L1301-L1750 HydrophobicContact CG-CD1 4.46Å; V1308-L1750 HydrophobicContact CG1-CD1 4.38Å; V1308-L1750 HydrophobicContact CG1-CD2 4.12Å; D1748-L1750 PolarHBondContact O-N 3.49Å; L1750-S1752 VanDerWaalsContact C-N 3.34Å; L1750-S1752 PolarHBondContact O-N 2.78Å; L1750-P1753 WeakPolarHBondContact O-CD 3.17Å; L1750-Q1755 VanDerWaalsContact CA-OE1 3.32Å; L1750-Q1755 WeakPolarHBondContact O-CG 3.33Å; L1750-Q1755 PolarHBondContact O-NE2 3.15Å; L1750-Q1755 PolarHBondContact O-OE1 2.96Å
1751	N	54	Low	45.4	Very low	32.6 Å²	32.6	90.9 Å²	90.9	17%	0.174	45%	0.447	C	S	.	.			trans	-91.8	16.6	177.8	-91.8	-24.9	0	0	0	112.3	S1291 A1292 S1749 F1754 Q1755 K1759	S1291-N1751 WeakPolarHBondContact CA-OD1 3.38Å; S1291-N1751 WeakPolarHBondContact CB-ND2 3.3Å; S1291-N1751 WeakPolarHBondContact CB-OD1 3.47Å; S1291-N1751 PolarHBondContact OG-ND2 2.83Å; A1292-N1751 PolarHBondContact N-OD1 3.23Å; A1292-N1751 VanDerWaalsContact N-OD1 3.16Å; S1749-N1751 PolarHBondContact O-N 2.99Å; S1749-N1751 VanDerWaalsContact O-N 3.13Å; S1749-N1751 WeakPolarHBondContact OG-CB 3.28Å; S1749-N1751 PolarHBondContact OG-N 3.08Å; S1749-N1751 VanDerWaalsContact OG-N 3.17Å; S1749-N1751 PolarHBondContact OG-ND2 2.81Å; N1751-F1754 PolarHBondContact O-N 3.14Å; N1751-Q1755 WeakPolarHBondContact O-CB 3.09Å; N1751-Q1755 WeakPolarHBondContact O-CG 3.42Å; N1751-Q1755 PolarHBondContact O-N 3.19Å; N1751-Q1755 VanDerWaalsContact O-N 3.08Å; N1751-Q1755 PolarHBondContact OD1-NE2 2.9Å; N1751-Q1755 PolarHBondContact OD1-OE1 3.23Å; N1751-K1759 PolarHBondContact OD1-NZ 3.29Å
1752	S	55	Low	46.7	Very low	36.8 Å²	36.8	83.1 Å²	83.1	26%	0.257	42%	0.422	S	S	.	.			trans	-65.1	-167.8	-179.6	91.6	0	0	0	0	112.7	S1747 S1749 L1750 F1754 Q1755 E1756	S1747-S1752 VanDerWaalsContact OG-CB 3.28Å; S1747-S1752 WeakPolarHBondContact OG-CB 3.47Å; S1749-S1752 PolarHBondContact O-N 3.11Å; L1750-S1752 VanDerWaalsContact C-N 3.34Å; L1750-S1752 PolarHBondContact O-N 2.78Å; S1752-F1754 VanDerWaalsContact C-N 3.28Å; S1752-F1754 PolarHBondContact O-N 2.94Å; S1752-F1754 VanDerWaalsContact O-N 3.12Å; S1752-F1754 PolarHBondContact OG-N 3.49Å; S1752-Q1755 WeakPolarHBondContact O-CA 3.26Å; S1752-Q1755 WeakPolarHBondContact O-CB 3.45Å; S1752-Q1755 PolarHBondContact O-N 2.99Å; S1752-Q1755 WeakPolarHBondContact OG-CG 3.27Å; S1752-Q1755 PolarHBondContact OG-N 2.82Å; S1752-Q1755 PolarHBondContact OG-OE1 3.18Å; S1752-E1756 PolarHBondContact O-N 3.14Å; S1752-E1756 VanDerWaalsContact O-N 3.09Å
1753	P	50.9	Low	48.5	Very low	85.4 Å²	85.4	80.2 Å²	80.2	56%	0.555	40%	0.403	S	S	*	.	H	α-helix	trans	-58	-33.3	176.3	-23.7	33.6	0	0	0	112.7	L1750 Q1755 E1756 Q1757	L1750-P1753 WeakPolarHBondContact O-CD 3.17Å; P1753-Q1755 PolarHBondContact O-N 2.69Å; P1753-E1756 WeakPolarHBondContact O-CB 3.39Å; P1753-E1756 PolarHBondContact O-N 2.88Å; P1753-Q1757 WeakPolarHBondContact O-CB 3.34Å; P1753-Q1757 PolarHBondContact O-N 3.2Å; P1753-Q1757 VanDerWaalsContact O-N 3.11Å
1754	F	50.4	Low	50.2	Low	53.8 Å²	53.8	79 Å²	79	24%	0.236	39%	0.386	C	S	.	.	H	α-helix	trans	-65.6	-40.9	175.2	-178.8	-104	0	0	0	112.3	A1292 Y1294 P1313 R1314 A1701 K1719 Y1724 N1751 S1752 E1756 Q1757 L1758	A1292-F1754 HydrophobicContact CB-CD1 3.61Å; A1292-F1754 HydrophobicContact CB-CE1 3.24Å; A1292-F1754 HydrophobicContact CB-CG 4.23Å; A1292-F1754 HydrophobicContact CB-CZ 4.09Å; Y1294-F1754 HydrophobicContact CD1-CB 4.39Å; P1313-F1754 HydrophobicContact CB-CB 4.29Å; P1313-F1754 HydrophobicContact CB-CD2 3.53Å; P1313-F1754 HydrophobicContact CB-CE2 3.59Å; P1313-F1754 HydrophobicContact CB-CG 4.38Å; P1313-F1754 HydrophobicContact CG-CD2 4.25Å; P1313-F1754 WeakPolarHBondContact O-CE2 3.47Å; R1314-F1754 HydrophobicContact CB-CE2 4.17Å; R1314-F1754 HydrophobicContact CG-CD2 4.41Å; R1314-F1754 HydrophobicContact CG-CE2 3.81Å; A1701-F1754 HydrophobicContact CB-CE2 4.36Å; K1719-F1754 HydrophobicContact CD-CE2 4.45Å; Y1724-F1754 HydrophobicContact CD1-CE2 4.32Å; Y1724-F1754 HydrophobicContact CG-CE2 4.27Å; N1751-F1754 PolarHBondContact O-N 3.14Å; S1752-F1754 VanDerWaalsContact C-N 3.28Å; S1752-F1754 PolarHBondContact O-N 2.94Å; S1752-F1754 VanDerWaalsContact O-N 3.12Å; S1752-F1754 PolarHBondContact OG-N 3.49Å; F1754-E1756 VanDerWaalsContact C-N 3.3Å; F1754-E1756 PolarHBondContact O-N 3.07Å; F1754-Q1757 WeakPolarHBondContact O-CB 3.42Å; F1754-Q1757 PolarHBondContact O-N 2.95Å; F1754-Q1757 VanDerWaalsContact O-N 3.15Å; F1754-L1758 HydrophobicContact CD1-CD1 3.89Å; F1754-L1758 VanDerWaalsContact CD1-CD1 3.4Å; F1754-L1758 HydrophobicContact CD1-CG 4.17Å; F1754-L1758 HydrophobicContact CE1-CD1 3.57Å; F1754-L1758 VanDerWaalsContact CE1-CD1 3.45Å; F1754-L1758 HydrophobicContact CE1-CD2 3.91Å; F1754-L1758 HydrophobicContact CE1-CG 3.94Å; F1754-L1758 VanDerWaalsContact CE1-CG 3.46Å; F1754-L1758 HydrophobicContact CE2-CD1 4.13Å; F1754-L1758 HydrophobicContact CE2-CG 4.06Å; F1754-L1758 HydrophobicContact CG-CD1 4.31Å; F1754-L1758 HydrophobicContact CZ-CD1 4.05Å; F1754-L1758 HydrophobicContact CZ-CD2 4.26Å; F1754-L1758 HydrophobicContact CZ-CG 4.09Å; F1754-L1758 WeakPolarHBondContact O-CB 3.21Å; F1754-L1758 WeakPolarHBondContact O-CD1 3.41Å; F1754-L1758 WeakPolarHBondContact O-CG 3.33Å; F1754-L1758 PolarHBondContact O-N 3.04Å; F1754-L1758 VanDerWaalsContact O-N 3.13Å
1755	Q	53.8	Low	52	Low	38.8 Å²	38.8	78.9 Å²	78.9	18%	0.181	38%	0.38	C	S	.	.	H	α-helix	trans	-65.4	-35.1	173.2	-87	-172.3	-2.3	0	0	112.1	Y1294 L1750 N1751 S1752 P1753 Q1757 L1758 K1759	Y1294-Q1755 PolarHBondContact OH-NE2 2.95Å; L1750-Q1755 VanDerWaalsContact CA-OE1 3.32Å; L1750-Q1755 WeakPolarHBondContact O-CG 3.33Å; L1750-Q1755 PolarHBondContact O-NE2 3.15Å; L1750-Q1755 PolarHBondContact O-OE1 2.96Å; N1751-Q1755 WeakPolarHBondContact O-CB 3.09Å; N1751-Q1755 WeakPolarHBondContact O-CG 3.42Å; N1751-Q1755 PolarHBondContact O-N 3.19Å; N1751-Q1755 VanDerWaalsContact O-N 3.08Å; N1751-Q1755 PolarHBondContact OD1-NE2 2.9Å; N1751-Q1755 PolarHBondContact OD1-OE1 3.23Å; S1752-Q1755 WeakPolarHBondContact O-CA 3.26Å; S1752-Q1755 WeakPolarHBondContact O-CB 3.45Å; S1752-Q1755 PolarHBondContact O-N 2.99Å; S1752-Q1755 WeakPolarHBondContact OG-CG 3.27Å; S1752-Q1755 PolarHBondContact OG-N 2.82Å; S1752-Q1755 PolarHBondContact OG-OE1 3.18Å; P1753-Q1755 PolarHBondContact O-N 2.69Å; Q1755-Q1757 VanDerWaalsContact C-N 3.33Å; Q1755-Q1757 PolarHBondContact O-N 2.78Å; Q1755-L1758 CarbonylContact O-C 3.59Å; Q1755-L1758 WeakPolarHBondContact O-CB 3.43Å; Q1755-L1758 PolarHBondContact O-N 3Å; Q1755-L1758 VanDerWaalsContact O-N 3.12Å; Q1755-K1759 WeakPolarHBondContact O-CB 3.43Å; Q1755-K1759 WeakPolarHBondContact O-CD 3.24Å; Q1755-K1759 VanDerWaalsContact O-CG 3.28Å; Q1755-K1759 WeakPolarHBondContact O-CG 3.38Å; Q1755-K1759 PolarHBondContact O-N 3.04Å
1756	E	54.9	Low	54.2	Low	82.6 Å²	82.6	73.3 Å²	73.3	39%	0.386	35%	0.35	S	S	.	.	H	α-helix	trans	-65.5	-38.9	172	-73.3	-159.7	173.8	0	0	112.7	Y1724 S1752 P1753 F1754 L1758 K1759 R1760	Y1724-E1756 PolarHBondContact OH-OE2 2.88Å; S1752-E1756 PolarHBondContact O-N 3.14Å; S1752-E1756 VanDerWaalsContact O-N 3.09Å; P1753-E1756 WeakPolarHBondContact O-CB 3.39Å; P1753-E1756 PolarHBondContact O-N 2.88Å; F1754-E1756 VanDerWaalsContact C-N 3.3Å; F1754-E1756 PolarHBondContact O-N 3.07Å; E1756-L1758 VanDerWaalsContact C-N 3.29Å; E1756-L1758 PolarHBondContact O-N 3.21Å; E1756-K1759 CarbonylContact O-C 3.53Å; E1756-K1759 WeakPolarHBondContact O-CB 3.45Å; E1756-K1759 PolarHBondContact O-N 3.13Å; E1756-R1760 VanDerWaalsContact O-CB 3.31Å; E1756-R1760 WeakPolarHBondContact O-CB 3.34Å; E1756-R1760 VanDerWaalsContact O-CG 3.23Å; E1756-R1760 WeakPolarHBondContact O-CG 3.42Å; E1756-R1760 PolarHBondContact O-N 3.09Å; E1756-R1760 IonicContact OE2-CZ 3.36Å; E1756-R1760 IonicContact OE2-NE 3.56Å; E1756-R1760 IonicContact OE2-NH1 3.52Å; E1756-R1760 IonicContact OE2-NH2 2.85Å; E1756-R1760 PolarHBondContact OE2-NH2 2.87Å
1757	Q	54	Low	56.1	Low	77.8 Å²	77.8	67.2 Å²	67.2	36%	0.364	33%	0.331	S	S	.	.	H	α-helix	trans	-64.9	-39.9	174.8	-107.3	178.6	-4.3	0	0	112	E1723 P1753 F1754 Q1755 K1759 R1760 N1761	E1723-Q1757 PolarHBondContact OE2-NE2 3.42Å; P1753-Q1757 WeakPolarHBondContact O-CB 3.34Å; P1753-Q1757 PolarHBondContact O-N 3.2Å; P1753-Q1757 VanDerWaalsContact O-N 3.11Å; F1754-Q1757 WeakPolarHBondContact O-CB 3.42Å; F1754-Q1757 PolarHBondContact O-N 2.95Å; F1754-Q1757 VanDerWaalsContact O-N 3.15Å; Q1755-Q1757 VanDerWaalsContact C-N 3.33Å; Q1755-Q1757 PolarHBondContact O-N 2.78Å; Q1757-K1759 VanDerWaalsContact C-N 3.33Å; Q1757-K1759 PolarHBondContact O-N 3.13Å; Q1757-R1760 PolarHBondContact O-N 2.99Å; Q1757-R1760 VanDerWaalsContact O-N 3.08Å; Q1757-N1761 PolarHBondContact O-N 3.13Å; Q1757-N1761 VanDerWaalsContact O-N 3.12Å; Q1757-N1761 PolarHBondContact O-ND2 2.77Å; Q1757-N1761 PolarHBondContact O-OD1 3.24Å
1758	L	52.5	Low	58	Low	48.4 Å²	48.4	65.8 Å²	65.8	25%	0.253	32%	0.319	S	S	.	.	H	α-helix	trans	-62	-42.3	171.6	-81.5	164.8	0	0	0	112.4	F1754 Q1755 E1756 R1760 N1761 F2116	F1754-L1758 HydrophobicContact CD1-CD1 3.89Å; F1754-L1758 VanDerWaalsContact CD1-CD1 3.4Å; F1754-L1758 HydrophobicContact CD1-CG 4.17Å; F1754-L1758 HydrophobicContact CE1-CD1 3.57Å; F1754-L1758 VanDerWaalsContact CE1-CD1 3.45Å; F1754-L1758 HydrophobicContact CE1-CD2 3.91Å; F1754-L1758 HydrophobicContact CE1-CG 3.94Å; F1754-L1758 VanDerWaalsContact CE1-CG 3.46Å; F1754-L1758 HydrophobicContact CE2-CD1 4.13Å; F1754-L1758 HydrophobicContact CE2-CG 4.06Å; F1754-L1758 HydrophobicContact CG-CD1 4.31Å; F1754-L1758 HydrophobicContact CZ-CD1 4.05Å; F1754-L1758 HydrophobicContact CZ-CD2 4.26Å; F1754-L1758 HydrophobicContact CZ-CG 4.09Å; F1754-L1758 WeakPolarHBondContact O-CB 3.21Å; F1754-L1758 WeakPolarHBondContact O-CD1 3.41Å; F1754-L1758 WeakPolarHBondContact O-CG 3.33Å; F1754-L1758 PolarHBondContact O-N 3.04Å; F1754-L1758 VanDerWaalsContact O-N 3.13Å; Q1755-L1758 CarbonylContact O-C 3.59Å; Q1755-L1758 WeakPolarHBondContact O-CB 3.43Å; Q1755-L1758 PolarHBondContact O-N 3Å; Q1755-L1758 VanDerWaalsContact O-N 3.12Å; E1756-L1758 VanDerWaalsContact C-N 3.29Å; E1756-L1758 PolarHBondContact O-N 3.21Å; L1758-R1760 VanDerWaalsContact C-N 3.31Å; L1758-R1760 PolarHBondContact O-N 2.95Å; L1758-N1761 PolarHBondContact O-N 3.07Å; L1758-F2116 HydrophobicContact CD2-CE1 3.17Å; L1758-F2116 HydrophobicContact CD2-CZ 3.25Å
1759	K	52.5	Low	59.5	Low	97 Å²	97	62.3 Å²	62.3	42%	0.422	30%	0.3	S	S	.	.	H	α-helix	trans	-64.2	-26.8	176.7	-74	171.5	-174.3	174.6	0	112.8	A1292 N1751 Q1755 E1756 Q1757 N1761	A1292-K1759 HydrophobicContact CB-CD 4.05Å; N1751-K1759 PolarHBondContact OD1-NZ 3.29Å; Q1755-K1759 WeakPolarHBondContact O-CB 3.43Å; Q1755-K1759 WeakPolarHBondContact O-CD 3.24Å; Q1755-K1759 VanDerWaalsContact O-CG 3.28Å; Q1755-K1759 WeakPolarHBondContact O-CG 3.38Å; Q1755-K1759 PolarHBondContact O-N 3.04Å; E1756-K1759 CarbonylContact O-C 3.53Å; E1756-K1759 WeakPolarHBondContact O-CB 3.45Å; E1756-K1759 PolarHBondContact O-N 3.13Å; Q1757-K1759 VanDerWaalsContact C-N 3.33Å; Q1757-K1759 PolarHBondContact O-N 3.13Å; K1759-N1761 PolarHBondContact O-N 3.14Å
1760	R	51.5	Low	60.8	Low	125 Å²	125	62.5 Å²	62.5	47%	0.472	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-11.8	179.6	-72.4	-177.8	-163.9	150.7	4.8	114.1	K1719 Y1724 E1756 Q1757 L1758 D1762 Y2146	K1719-R1760 WeakPolarHBondContact CB-O 3.34Å; K1719-R1760 WeakPolarHBondContact CG-O 3.35Å; K1719-R1760 PolarHBondContact N-O 3.32Å; Y1724-R1760 VanDerWaalsContact OH-CZ 3.3Å; Y1724-R1760 PolarHBondContact OH-NH1 3.47Å; Y1724-R1760 PolarHBondContact OH-NH2 2.97Å; E1756-R1760 VanDerWaalsContact O-CB 3.31Å; E1756-R1760 WeakPolarHBondContact O-CB 3.34Å; E1756-R1760 VanDerWaalsContact O-CG 3.23Å; E1756-R1760 WeakPolarHBondContact O-CG 3.42Å; E1756-R1760 PolarHBondContact O-N 3.09Å; E1756-R1760 IonicContact OE2-CZ 3.36Å; E1756-R1760 IonicContact OE2-NE 3.56Å; E1756-R1760 IonicContact OE2-NH1 3.52Å; E1756-R1760 IonicContact OE2-NH2 2.85Å; E1756-R1760 PolarHBondContact OE2-NH2 2.87Å; Q1757-R1760 PolarHBondContact O-N 2.99Å; Q1757-R1760 VanDerWaalsContact O-N 3.08Å; L1758-R1760 VanDerWaalsContact C-N 3.31Å; L1758-R1760 PolarHBondContact O-N 2.95Å; R1760-D1762 VanDerWaalsContact C-N 3.31Å; R1760-D1762 HydrophobicContact CB-CB 3.79Å; R1760-D1762 VanDerWaalsContact O-CA 3.3Å; R1760-D1762 WeakPolarHBondContact O-CA 3.45Å; R1760-D1762 PolarHBondContact O-N 3.09Å; R1760-Y2146 PolarHBondContact NH2-OH 3.27Å
1761	N	51.5	Low	62.2	Low	29.8 Å²	29.8	61.9 Å²	61.9	16%	0.159	29%	0.294	C	S	.	.			trans	-51.5	66.2	-175.8	-109.9	-15.5	0	0	0	112	R1314 S1717 T1718 Q1757 L1758 K1759 R1763 R1764 Y2134	R1314-N1761 PolarHBondContact NH1-ND2 3.2Å; S1717-N1761 WeakPolarHBondContact O-CA 3.46Å; S1717-N1761 WeakPolarHBondContact O-CB 3.47Å; S1717-N1761 PolarHBondContact O-OD1 2.86Å; T1718-N1761 HydrophobicContact CG2-CB 4.4Å; Q1757-N1761 PolarHBondContact O-N 3.13Å; Q1757-N1761 VanDerWaalsContact O-N 3.12Å; Q1757-N1761 PolarHBondContact O-ND2 2.77Å; Q1757-N1761 PolarHBondContact O-OD1 3.24Å; L1758-N1761 PolarHBondContact O-N 3.07Å; K1759-N1761 PolarHBondContact O-N 3.14Å; N1761-R1763 VanDerWaalsContact C-N 3.3Å; N1761-R1763 HydrophobicContact CB-CG 4.11Å; N1761-R1763 PolarHBondContact ND2-NH1 3.1Å; N1761-R1763 WeakPolarHBondContact O-CG 3.42Å; N1761-R1763 PolarHBondContact O-N 2.81Å; N1761-R1764 VanDerWaalsContact O-CD 3.25Å; N1761-R1764 WeakPolarHBondContact O-CD 3.41Å; N1761-R1764 WeakPolarHBondContact O-CG 3.13Å; N1761-R1764 PolarHBondContact O-NE 2.73Å; N1761-R1764 VanDerWaalsContact OD1-CZ 3.3Å; N1761-R1764 PolarHBondContact OD1-NE 2.98Å; N1761-R1764 PolarHBondContact OD1-NH2 2.91Å; N1761-Y2134 HydrophobicContact CB-CE2 4.46Å; N1761-Y2134 PolarHBondContact ND2-OH 2.92Å
1762	D	55.3	Low	63.7	Low	51.2 Å²	51.2	61.9 Å²	61.9	27%	0.274	29%	0.292	S	S	.	.			trans	-74.2	43.6	-177.6	-162.3	0.5	0	0	0	110.6	K1719 R1760 R1764 K1765	K1719-D1762 HydrophobicContact CG-CB 4.03Å; R1760-D1762 VanDerWaalsContact C-N 3.31Å; R1760-D1762 HydrophobicContact CB-CB 3.79Å; R1760-D1762 VanDerWaalsContact O-CA 3.3Å; R1760-D1762 WeakPolarHBondContact O-CA 3.45Å; R1760-D1762 PolarHBondContact O-N 3.09Å; D1762-R1764 WeakPolarHBondContact O-CG 3.3Å; D1762-R1764 PolarHBondContact O-N 3.02Å; D1762-R1764 WeakPolarHBondContact OD1-CB 3.3Å; D1762-R1764 WeakPolarHBondContact OD1-CD 3.32Å; D1762-R1764 WeakPolarHBondContact OD1-CG 3.45Å; D1762-R1764 IonicContact OD1-CZ 2.92Å; D1762-R1764 PolarHBondContact OD1-N 2.84Å; D1762-R1764 IonicContact OD1-NE 3.27Å; D1762-R1764 PolarHBondContact OD1-NE 3.17Å; D1762-R1764 IonicContact OD1-NH2 3.38Å; D1762-K1765 HydrophobicContact CB-CD 4.37Å; D1762-K1765 HydrophobicContact CB-CG 4.47Å; D1762-K1765 PolarHBondContact O-N 3Å; D1762-K1765 VanDerWaalsContact O-N 3.1Å; D1762-K1765 WeakPolarHBondContact OD2-CE 3.22Å
1763	R	62.3	Low	65.1	Low	75 Å²	75	63.1 Å²	63.1	28%	0.283	29%	0.293	S	S	.	.	S	Bend	trans	-58.8	11.6	177.5	-59.5	-155.6	-164.4	-159.1	-3.1	114	G1702 S1717 N1761 K1765 W1766 F2116 E2118 R2131	G1702-R1763 PolarHBondContact O-NH1 2.91Å; G1702-R1763 PolarHBondContact O-NH2 3.27Å; S1717-R1763 WeakPolarHBondContact OG-CA 3.33Å; S1717-R1763 VanDerWaalsContact OG-CB 3.3Å; S1717-R1763 WeakPolarHBondContact OG-CB 3.43Å; S1717-R1763 WeakPolarHBondContact OG-CD 3.43Å; S1717-R1763 WeakPolarHBondContact OG-CG 3.23Å; S1717-R1763 PolarHBondContact OG-N 2.7Å; N1761-R1763 VanDerWaalsContact C-N 3.3Å; N1761-R1763 HydrophobicContact CB-CG 4.11Å; N1761-R1763 PolarHBondContact ND2-NH1 3.1Å; N1761-R1763 WeakPolarHBondContact O-CG 3.42Å; N1761-R1763 PolarHBondContact O-N 2.81Å; R1763-K1765 VanDerWaalsContact C-N 3.29Å; R1763-K1765 PolarHBondContact O-N 3.3Å; R1763-W1766 HydrophobicContact CB-CZ2 4.42Å; R1763-W1766 PolarHBondContact O-NE1 2.96Å; R1763-F2116 VanDerWaalsContact CZ-CD2 3.47Å; R1763-F2116 VanDerWaalsContact CZ-CE2 3.47Å; R1763-F2116 VanDerWaalsContact NH1-CE2 3.33Å; R1763-F2116 VanDerWaalsContact NH2-CD2 3.34Å; R1763-E2118 WeakPolarHBondContact CD-OE1 3.44Å; R1763-E2118 IonicContact CZ-OE2 3.12Å; R1763-E2118 IonicContact NE-OE1 3.62Å; R1763-E2118 IonicContact NE-OE2 2.87Å; R1763-E2118 PolarHBondContact NE-OE2 3.35Å; R1763-E2118 IonicContact NH1-OE2 3.14Å; R1763-E2118 PolarHBondContact NH1-OE2 3Å; R1763-E2118 IonicContact NH2-OE2 3.23Å; R1763-E2118 PolarHBondContact NH2-OE2 3.33Å; R1763-R2131 PolarHBondContact O-NE 2.89Å; R1763-R2131 PolarHBondContact O-NH1 2.77Å; R1763-R2131 VanDerWaalsContact O-NH1 3.13Å
1764	R	64.2	Low	66.8	Low	78.8 Å²	78.8	59.1 Å²	59.1	30%	0.297	27%	0.267	S	S	.	.			trans	-70	-14.1	172.7	-75.6	174.9	-157.7	-168.3	1.7	111.9	R1686 S1717 N1761 D1762 V2095 Q2135 E2138	R1686-R1764 PolarHBondContact NH1-O 3.12Å; R1686-R1764 PolarHBondContact NH2-O 3.28Å; S1717-R1764 WeakPolarHBondContact OG-CB 3.37Å; S1717-R1764 WeakPolarHBondContact OG-CG 3.41Å; N1761-R1764 VanDerWaalsContact O-CD 3.25Å; N1761-R1764 WeakPolarHBondContact O-CD 3.41Å; N1761-R1764 WeakPolarHBondContact O-CG 3.13Å; N1761-R1764 PolarHBondContact O-NE 2.73Å; N1761-R1764 VanDerWaalsContact OD1-CZ 3.3Å; N1761-R1764 PolarHBondContact OD1-NE 2.98Å; N1761-R1764 PolarHBondContact OD1-NH2 2.91Å; D1762-R1764 WeakPolarHBondContact O-CG 3.3Å; D1762-R1764 PolarHBondContact O-N 3.02Å; D1762-R1764 WeakPolarHBondContact OD1-CB 3.3Å; D1762-R1764 WeakPolarHBondContact OD1-CD 3.32Å; D1762-R1764 WeakPolarHBondContact OD1-CG 3.45Å; D1762-R1764 IonicContact OD1-CZ 2.92Å; D1762-R1764 PolarHBondContact OD1-N 2.84Å; D1762-R1764 IonicContact OD1-NE 3.27Å; D1762-R1764 PolarHBondContact OD1-NE 3.17Å; D1762-R1764 IonicContact OD1-NH2 3.38Å; R1764-V2095 HydrophobicContact CB-CG1 4.08Å; R1764-V2095 HydrophobicContact CG-CG1 4.24Å; R1764-Q2135 VanDerWaalsContact NH1-NE2 3.19Å; R1764-E2138 IonicContact CZ-OE1 3.08Å; R1764-E2138 IonicContact CZ-OE2 3.43Å; R1764-E2138 IonicContact NE-OE1 2.66Å; R1764-E2138 PolarHBondContact NE-OE1 2.87Å; R1764-E2138 VanDerWaalsContact NH1-CD 3.31Å; R1764-E2138 IonicContact NH1-OE1 3.31Å; R1764-E2138 PolarHBondContact NH1-OE1 2.96Å; R1764-E2138 IonicContact NH1-OE2 3.24Å; R1764-E2138 PolarHBondContact NH1-OE2 2.87Å; R1764-E2138 IonicContact NH2-OE1 3.12Å; R1764-E2138 PolarHBondContact NH2-OE1 2.99Å; R1764-E2138 VanDerWaalsContact NH2-OE1 3.07Å; R1764-E2138 IonicContact NH2-OE2 2.94Å; R1764-E2138 PolarHBondContact NH2-OE2 2.87Å
1765	K	69.7	Low	68.3	Low	118.4 Å²	118.4	60.2 Å²	60.2	52%	0.515	28%	0.275	S	S	.	.			trans	-93.6	126.5	175	-81.7	-177.4	-176.6	-178.7	0	108.9	S1717 K1719 D1762 R1763 E1767	S1717-K1765 CarbonylContact C-O 3.46Å; S1717-K1765 VanDerWaalsContact CA-O 3.29Å; S1717-K1765 WeakPolarHBondContact CA-O 3.32Å; S1717-K1765 WeakPolarHBondContact CB-O 3.39Å; S1717-K1765 PolarHBondContact OG-O 2.88Å; K1719-K1765 HydrophobicContact CD-CD 4.33Å; D1762-K1765 HydrophobicContact CB-CD 4.37Å; D1762-K1765 HydrophobicContact CB-CG 4.47Å; D1762-K1765 PolarHBondContact O-N 3Å; D1762-K1765 VanDerWaalsContact O-N 3.1Å; D1762-K1765 WeakPolarHBondContact OD2-CE 3.22Å; R1763-K1765 VanDerWaalsContact C-N 3.29Å; R1763-K1765 PolarHBondContact O-N 3.3Å; K1765-E1767 HydrophobicContact CD-CG 4.41Å; K1765-E1767 WeakPolarHBondContact CE-OE1 3.07Å; K1765-E1767 HydrophobicContact CG-CG 4.39Å; K1765-E1767 IonicContact NZ-OE1 3.94Å; K1765-E1767 PolarHBondContact NZ-OE1 2.67Å
1766	W	77.4	Confident	69.7	Low	19.2 Å²	19.2	60.6 Å²	60.6	7%	0.073	28%	0.276	C	S	.	.			trans	-109.5	139.3	171.5	-69.4	77.7	0	0	0	107.7	V1662 T1685 L1704 L1715 N1716 R1763 F2120	V1662-W1766 HydrophobicContact CG1-CB 3.92Å; V1662-W1766 HydrophobicContact CG1-CD2 3.99Å; V1662-W1766 HydrophobicContact CG1-CE3 4.49Å; V1662-W1766 HydrophobicContact CG1-CG 3.65Å; T1685-W1766 WeakPolarHBondContact CB-O 3.38Å; T1685-W1766 HydrophobicContact CG2-CB 4.31Å; T1685-W1766 WeakPolarHBondContact CG2-O 3.22Å; T1685-W1766 PolarHBondContact OG1-O 3.03Å; L1704-W1766 HydrophobicContact CB-CE3 4.27Å; L1704-W1766 HydrophobicContact CB-CH2 4.28Å; L1704-W1766 HydrophobicContact CB-CZ3 3.67Å; L1715-W1766 HydrophobicContact CB-CE3 3.93Å; L1715-W1766 HydrophobicContact CD2-CB 4.35Å; L1715-W1766 WeakPolarHBondContact O-CZ3 3.3Å; N1716-W1766 CarbonylContact O-C 3.49Å; N1716-W1766 VanDerWaalsContact O-CA 3.26Å; N1716-W1766 WeakPolarHBondContact O-CA 3.3Å; R1763-W1766 HydrophobicContact CB-CZ2 4.42Å; R1763-W1766 PolarHBondContact O-NE1 2.96Å; W1766-F2120 AromaticContact CH2-CE1 3.93Å; W1766-F2120 HydrophobicContact CH2-CE1 4Å; W1766-F2120 HydrophobicContact CH2-CE2 4.42Å; W1766-F2120 AromaticContact CH2-CZ 3.49Å; W1766-F2120 HydrophobicContact CH2-CZ 3.49Å; W1766-F2120 VanDerWaalsContact CH2-CZ 3.47Å; W1766-F2120 AromaticContact CZ2-CE1 3.71Å; W1766-F2120 HydrophobicContact CZ2-CE1 3.71Å; W1766-F2120 AromaticContact CZ2-CZ 3.39Å; W1766-F2120 HydrophobicContact CZ2-CZ 3.39Å; W1766-F2120 VanDerWaalsContact CZ2-CZ 3.44Å; W1766-F2120 HydrophobicContact CZ3-CZ 4.44Å
1767	E	77.1	Confident	70.9	Confident	79.6 Å²	79.6	57.6 Å²	57.6	37%	0.372	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	137.7	-179.7	-67.9	179.3	178.1	0	0	108.5	T1685 L1715 N1716 T1718 K1719 K1765 I1769	T1685-E1767 WeakPolarHBondContact OG1-CA 3.38Å; L1715-E1767 CarbonylContact C-O 3.58Å; L1715-E1767 VanDerWaalsContact CA-O 3.24Å; L1715-E1767 WeakPolarHBondContact CA-O 3.31Å; N1716-E1767 PolarHBondContact N-O 3.12Å; N1716-E1767 VanDerWaalsContact N-O 3.08Å; N1716-E1767 PolarHBondContact O-N 2.92Å; N1716-E1767 PolarHBondContact OD1-O 3.36Å; T1718-E1767 WeakPolarHBondContact CB-OE2 3.34Å; T1718-E1767 HydrophobicContact CG2-CB 4.35Å; T1718-E1767 WeakPolarHBondContact CG2-OE2 3.41Å; T1718-E1767 PolarHBondContact OG1-OE2 2.88Å; K1719-E1767 VanDerWaalsContact CE-OE1 3.25Å; K1719-E1767 WeakPolarHBondContact CE-OE1 3.24Å; K1719-E1767 IonicContact NZ-OE1 2.79Å; K1719-E1767 IonicContact NZ-OE2 3.19Å; K1765-E1767 HydrophobicContact CD-CG 4.41Å; K1765-E1767 WeakPolarHBondContact CE-OE1 3.07Å; K1765-E1767 HydrophobicContact CG-CG 4.39Å; K1765-E1767 IonicContact NZ-OE1 3.94Å; K1765-E1767 PolarHBondContact NZ-OE1 2.67Å; E1767-I1769 PolarHBondContact O-N 2.75Å
1768	T	78.7	Confident	71.8	Confident	29.8 Å²	29.8	56.7 Å²	56.7	18%	0.183	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	122.5	178	-43.2	0	0	0	0	108.9	T1685 L1688 L1715 D1771	T1685-T1768 HydrophobicContact CG2-CG2 4.18Å; T1685-T1768 WeakPolarHBondContact CG2-OG1 3.2Å; T1685-T1768 PolarHBondContact OG1-N 3.13Å; T1685-T1768 VanDerWaalsContact OG1-N 3.12Å; T1685-T1768 PolarHBondContact OG1-OG1 2.84Å; L1688-T1768 HydrophobicContact CD1-CG2 3.84Å; L1688-T1768 VanDerWaalsContact CD1-OG1 3.26Å; L1688-T1768 WeakPolarHBondContact CD1-OG1 3.48Å; L1715-T1768 HydrophobicContact CD1-CG2 4.4Å; L1715-T1768 HydrophobicContact CG-CG2 4.17Å; T1768-D1771 WeakPolarHBondContact CG2-OD1 3.29Å
1769	I	77.3	Confident	72.3	Confident	61.6 Å²	61.6	58.7 Å²	58.7	32%	0.316	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	-49.4	179.9	-40	170.7	0	0	0	110.2	W1714 N1716 E1767 Y1799 A1801	W1714-I1769 HydrophobicContact CB-CB 4.4Å; W1714-I1769 HydrophobicContact CB-CD1 4.18Å; W1714-I1769 HydrophobicContact CB-CG1 4.32Å; W1714-I1769 HydrophobicContact CG-CD1 4.16Å; W1714-I1769 PolarHBondContact O-N 2.97Å; N1716-I1769 HydrophobicContact CB-CD1 3.6Å; N1716-I1769 HydrophobicContact CB-CG1 3.86Å; N1716-I1769 VanDerWaalsContact CG-CD1 3.48Å; N1716-I1769 VanDerWaalsContact CG-CG1 3.42Å; E1767-I1769 PolarHBondContact O-N 2.75Å; I1769-Y1799 HydrophobicContact CB-CE1 4.31Å; I1769-Y1799 HydrophobicContact CD1-CD1 3.96Å; I1769-Y1799 HydrophobicContact CD1-CE1 4.17Å; I1769-Y1799 HydrophobicContact CG2-CD1 4.36Å; I1769-Y1799 HydrophobicContact CG2-CE1 3.74Å; I1769-A1801 HydrophobicContact CG2-CB 4.22Å
1770	I	80.5	Confident	72.9	Confident	48.4 Å²	48.4	58.9 Å²	58.9	25%	0.248	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	149.2	-177.8	-164.8	159.9	0	0	0	110.5	W1714 Y1772 Y1799	W1714-I1770 HydrophobicContact CB-CG2 4.05Å; W1714-I1770 HydrophobicContact CD2-CG2 4.03Å; W1714-I1770 HydrophobicContact CE3-CG2 3.58Å; W1714-I1770 HydrophobicContact CG-CG2 4.34Å; W1714-I1770 HydrophobicContact CZ3-CG2 4.07Å; W1714-I1770 PolarHBondContact N-O 3.08Å; W1714-I1770 VanDerWaalsContact N-O 3.09Å; I1770-Y1772 HydrophobicContact CB-CE2 4.36Å; I1770-Y1772 HydrophobicContact CD1-CD1 4.18Å; I1770-Y1772 HydrophobicContact CD1-CD2 4.36Å; I1770-Y1772 HydrophobicContact CD1-CE1 3.82Å; I1770-Y1772 HydrophobicContact CD1-CE2 4.1Å; I1770-Y1772 VanDerWaalsContact CD1-CE2 3.5Å; I1770-Y1772 VanDerWaalsContact CD1-CZ 3.4Å; I1770-Y1772 VanDerWaalsContact CD1-OH 3.31Å; I1770-Y1772 WeakPolarHBondContact CD1-OH 3.25Å; I1770-Y1772 HydrophobicContact CG1-CD1 4.28Å; I1770-Y1772 HydrophobicContact CG1-CD2 4.06Å; I1770-Y1772 HydrophobicContact CG1-CE1 4.06Å; I1770-Y1772 HydrophobicContact CG1-CE2 4.16Å; I1770-Y1772 HydrophobicContact CG2-CD2 4.19Å; I1770-Y1772 HydrophobicContact CG2-CE2 3.74Å; I1770-Y1799 HydrophobicContact CG2-CE1 4.2Å; I1770-Y1799 HydrophobicContact CG2-CE2 4.1Å; I1770-Y1799 VanDerWaalsContact CG2-OH 3.28Å; I1770-Y1799 WeakPolarHBondContact CG2-OH 3.26Å
1771	D	82.9	Confident	73.7	Confident	30 Å²	30	53.3 Å²	53.3	16%	0.16	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	129.5	169.4	-55.8	-61.5	0	0	0	108.8	C1678 S1679 F1711 L1712 R1713 T1768	C1678-D1771 VanDerWaalsContact C-OD2 3.28Å; C1678-D1771 HydrophobicContact CB-CB 4.45Å; C1678-D1771 WeakPolarHBondContact CB-OD2 3.2Å; S1679-D1771 WeakPolarHBondContact CB-OD2 3.22Å; S1679-D1771 PolarHBondContact N-OD2 2.97Å; S1679-D1771 PolarHBondContact OG-OD2 3.24Å; F1711-D1771 HydrophobicContact CD1-CB 4.32Å; L1712-D1771 CarbonylContact O-C 3.56Å; L1712-D1771 WeakPolarHBondContact O-CA 3.41Å; R1713-D1771 WeakPolarHBondContact CB-OD1 3.33Å; R1713-D1771 VanDerWaalsContact CD-OD1 3.23Å; R1713-D1771 WeakPolarHBondContact CD-OD1 3.28Å; R1713-D1771 HydrophobicContact CG-CB 4.48Å; R1713-D1771 VanDerWaalsContact CG-OD1 3.24Å; R1713-D1771 WeakPolarHBondContact CG-OD1 3.35Å; R1713-D1771 IonicContact CZ-OD1 3.68Å; R1713-D1771 VanDerWaalsContact CZ-OD1 3.22Å; R1713-D1771 IonicContact NE-OD1 3.25Å; R1713-D1771 PolarHBondContact NE-OD1 3.04Å; R1713-D1771 VanDerWaalsContact NH1-CG 3.35Å; R1713-D1771 IonicContact NH1-OD1 3.38Å; R1713-D1771 PolarHBondContact NH1-OD1 2.93Å; R1713-D1771 IonicContact NH1-OD2 3.76Å; R1713-D1771 PolarHBondContact NH1-OD2 2.81Å; R1713-D1771 IonicContact NH2-OD1 3.32Å; R1713-D1771 PolarHBondContact NH2-OD1 3.05Å; R1713-D1771 IonicContact NH2-OD2 3.66Å; T1768-D1771 WeakPolarHBondContact CG2-OD1 3.29Å
1772	Y	84.4	Confident	74.3	Confident	32.8 Å²	32.8	56.5 Å²	56.5	13%	0.129	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	128.2	177.8	-107.7	-81.3	0	0	0	111.3	F1711 L1712 W1714 I1770 L1774 F1776 Y1799 L1838 T1840 T1841 L1844 I1863	F1711-Y1772 CarbonylContact C-O 3.53Å; F1711-Y1772 VanDerWaalsContact CA-O 3.29Å; F1711-Y1772 WeakPolarHBondContact CA-O 3.39Å; L1712-Y1772 PolarHBondContact N-O 2.96Å; L1712-Y1772 PolarHBondContact O-N 3.11Å; W1714-Y1772 HydrophobicContact CE3-CD2 4Å; W1714-Y1772 HydrophobicContact CE3-CE2 4.44Å; W1714-Y1772 HydrophobicContact CH2-CD2 4.27Å; W1714-Y1772 AromaticContact CZ3-CD2 3.5Å; W1714-Y1772 HydrophobicContact CZ3-CD2 3.5Å; W1714-Y1772 HydrophobicContact CZ3-CE2 4.31Å; W1714-Y1772 HydrophobicContact CZ3-CG 4.37Å; I1770-Y1772 HydrophobicContact CB-CE2 4.36Å; I1770-Y1772 HydrophobicContact CD1-CD1 4.18Å; I1770-Y1772 HydrophobicContact CD1-CD2 4.36Å; I1770-Y1772 HydrophobicContact CD1-CE1 3.82Å; I1770-Y1772 HydrophobicContact CD1-CE2 4.1Å; I1770-Y1772 VanDerWaalsContact CD1-CE2 3.5Å; I1770-Y1772 VanDerWaalsContact CD1-CZ 3.4Å; I1770-Y1772 VanDerWaalsContact CD1-OH 3.31Å; I1770-Y1772 WeakPolarHBondContact CD1-OH 3.25Å; I1770-Y1772 HydrophobicContact CG1-CD1 4.28Å; I1770-Y1772 HydrophobicContact CG1-CD2 4.06Å; I1770-Y1772 HydrophobicContact CG1-CE1 4.06Å; I1770-Y1772 HydrophobicContact CG1-CE2 4.16Å; I1770-Y1772 HydrophobicContact CG2-CD2 4.19Å; I1770-Y1772 HydrophobicContact CG2-CE2 3.74Å; Y1772-L1774 HydrophobicContact CD1-CD2 4.34Å; Y1772-L1774 HydrophobicContact CE1-CD2 4.37Å; Y1772-F1776 HydrophobicContact CE1-CD1 4.38Å; Y1772-F1776 AromaticContact CE1-CE1 3.99Å; Y1772-F1776 HydrophobicContact CE1-CE1 4.06Å; Y1772-Y1799 HydrophobicContact CE2-CE2 4.11Å; Y1772-L1838 HydrophobicContact CD1-CD2 4.32Å; Y1772-L1838 HydrophobicContact CE1-CD2 4.07Å; Y1772-T1840 HydrophobicContact CE2-CG2 3.85Å; Y1772-T1840 PolarHBondContact OH-O 2.84Å; Y1772-T1841 PolarHBondContact OH-O 2.63Å; Y1772-L1844 HydrophobicContact CD1-CB 3.65Å; Y1772-L1844 HydrophobicContact CD1-CD2 3.78Å; Y1772-L1844 HydrophobicContact CD1-CG 4.37Å; Y1772-L1844 HydrophobicContact CD2-CB 4.29Å; Y1772-L1844 HydrophobicContact CD2-CD1 4.36Å; Y1772-L1844 HydrophobicContact CD2-CD2 3.79Å; Y1772-L1844 HydrophobicContact CD2-CG 4.34Å; Y1772-L1844 HydrophobicContact CE1-CB 3.79Å; Y1772-L1844 VanDerWaalsContact CE1-CB 3.47Å; Y1772-L1844 HydrophobicContact CE1-CD2 3.92Å; Y1772-L1844 HydrophobicContact CE1-CG 4.46Å; Y1772-L1844 HydrophobicContact CE2-CB 4.34Å; Y1772-L1844 HydrophobicContact CE2-CD2 3.52Å; Y1772-L1844 HydrophobicContact CE2-CG 4.45Å; Y1772-L1844 HydrophobicContact CG-CB 4.04Å; Y1772-L1844 HydrophobicContact CG-CD1 4.46Å; Y1772-L1844 HydrophobicContact CG-CD2 3.62Å; Y1772-L1844 HydrophobicContact CG-CG 4.39Å; Y1772-I1863 HydrophobicContact CE2-CD1 4.23Å
1773	K	85.6	Confident	74.7	Confident	62.6 Å²	62.6	60.2 Å²	60.2	27%	0.272	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	132.5	177.2	-163.6	171.3	178.9	-113.7	0	110.9	N1673 F1711 D1775 S1779	N1673-K1773 WeakPolarHBondContact O-CE 3.35Å; F1711-K1773 HydrophobicContact CD1-CB 4Å; F1711-K1773 HydrophobicContact CD1-CG 4.25Å; F1711-K1773 HydrophobicContact CE1-CB 3.61Å; F1711-K1773 HydrophobicContact CE1-CD 4.01Å; F1711-K1773 HydrophobicContact CE1-CG 3.75Å; F1711-K1773 VanDerWaalsContact CE1-CG 3.49Å; F1711-K1773 HydrophobicContact CE2-CD 4.35Å; F1711-K1773 HydrophobicContact CE2-CG 4.2Å; F1711-K1773 HydrophobicContact CZ-CB 4.1Å; F1711-K1773 HydrophobicContact CZ-CD 3.66Å; F1711-K1773 HydrophobicContact CZ-CG 3.69Å; K1773-D1775 VanDerWaalsContact CD-OD1 3.27Å; K1773-D1775 WeakPolarHBondContact CD-OD1 3.36Å; K1773-D1775 WeakPolarHBondContact CD-OD2 3.17Å; K1773-D1775 WeakPolarHBondContact CE-OD1 3.27Å; K1773-D1775 VanDerWaalsContact CG-OD1 3.28Å; K1773-D1775 WeakPolarHBondContact CG-OD1 3.3Å; K1773-D1775 WeakPolarHBondContact CG-OD2 3.49Å; K1773-D1775 IonicContact NZ-OD1 3Å; K1773-D1775 PolarHBondContact NZ-OD1 3.01Å; K1773-D1775 IonicContact NZ-OD2 3.38Å; K1773-D1775 PolarHBondContact NZ-OD2 2.99Å; K1773-D1775 PolarHBondContact O-N 3.08Å; K1773-D1775 VanDerWaalsContact O-N 3.1Å; K1773-S1779 PolarHBondContact NZ-O 3.01Å
1774	L	86.1	Confident	74.5	Confident	0.6 Å²	0.6	64.2 Å²	64.2	0%	0.003	32%	0.321	C	S	.	.			trans	-83.8	45.7	-177.9	-64.9	175	0	0	0	112.7	G1710 L1712 Y1772 F1776 L1777 F1781 Y1789 L1827 L1838 L1844	G1710-L1774 WeakPolarHBondContact O-CB 3.22Å; G1710-L1774 PolarHBondContact O-N 3.03Å; L1712-L1774 HydrophobicContact CD1-CD2 3.84Å; L1712-L1774 HydrophobicContact CD2-CD1 4.44Å; L1712-L1774 HydrophobicContact CG-CD1 4.22Å; L1712-L1774 HydrophobicContact CG-CD2 3.89Å; L1712-L1774 HydrophobicContact CG-CG 4.23Å; Y1772-L1774 HydrophobicContact CD1-CD2 4.34Å; Y1772-L1774 HydrophobicContact CE1-CD2 4.37Å; L1774-F1776 HydrophobicContact CB-CE1 4.34Å; L1774-F1776 HydrophobicContact CD2-CE1 3.5Å; L1774-F1776 VanDerWaalsContact CD2-CE1 3.47Å; L1774-F1776 HydrophobicContact CD2-CZ 3.77Å; L1774-F1776 HydrophobicContact CG-CE1 4.48Å; L1774-F1776 PolarHBondContact O-N 3.14Å; L1774-F1776 VanDerWaalsContact O-N 3.07Å; L1774-L1777 HydrophobicContact CB-CD1 4.11Å; L1774-L1777 HydrophobicContact CB-CG 4.4Å; L1774-L1777 HydrophobicContact CD1-CD1 4.06Å; L1774-L1777 HydrophobicContact CG-CD1 4.48Å; L1774-L1777 PolarHBondContact O-N 2.96Å; L1774-F1781 HydrophobicContact CB-CE2 4.28Å; L1774-F1781 HydrophobicContact CB-CZ 4.13Å; L1774-Y1789 HydrophobicContact CD1-CD1 4.49Å; L1774-Y1789 HydrophobicContact CD1-CE1 4Å; L1774-Y1789 HydrophobicContact CD1-CE2 4.19Å; L1774-L1827 HydrophobicContact CD1-CD1 4.17Å; L1774-L1827 HydrophobicContact CD2-CD1 4.16Å; L1774-L1838 HydrophobicContact CD2-CD1 4.19Å; L1774-L1838 HydrophobicContact CD2-CD2 4.22Å; L1774-L1844 HydrophobicContact CD2-CD2 4.28Å
1775	D	82.2	Confident	74.3	Confident	77.2 Å²	77.2	66.4 Å²	66.4	41%	0.413	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-20.4	-174.1	-76.1	-33.6	0	0	0	114.4	K1773 L1777 Q1778	K1773-D1775 VanDerWaalsContact CD-OD1 3.27Å; K1773-D1775 WeakPolarHBondContact CD-OD1 3.36Å; K1773-D1775 WeakPolarHBondContact CD-OD2 3.17Å; K1773-D1775 WeakPolarHBondContact CE-OD1 3.27Å; K1773-D1775 VanDerWaalsContact CG-OD1 3.28Å; K1773-D1775 WeakPolarHBondContact CG-OD1 3.3Å; K1773-D1775 WeakPolarHBondContact CG-OD2 3.49Å; K1773-D1775 IonicContact NZ-OD1 3Å; K1773-D1775 PolarHBondContact NZ-OD1 3.01Å; K1773-D1775 IonicContact NZ-OD2 3.38Å; K1773-D1775 PolarHBondContact NZ-OD2 2.99Å; K1773-D1775 PolarHBondContact O-N 3.08Å; K1773-D1775 VanDerWaalsContact O-N 3.1Å; D1775-L1777 VanDerWaalsContact C-N 3.3Å; D1775-L1777 PolarHBondContact O-N 3.1Å; D1775-Q1778 CarbonylContact O-C 3.46Å
1776	F	82.2	Confident	73.8	Confident	47 Å²	47	64.6 Å²	64.6	21%	0.206	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-19.7	177.4	68.3	-89.3	0	0	0	113.5	Y1772 L1774 L1827 W1836 L1838 L1844 A1846	Y1772-F1776 HydrophobicContact CE1-CD1 4.38Å; Y1772-F1776 AromaticContact CE1-CE1 3.99Å; Y1772-F1776 HydrophobicContact CE1-CE1 4.06Å; L1774-F1776 HydrophobicContact CB-CE1 4.34Å; L1774-F1776 HydrophobicContact CD2-CE1 3.5Å; L1774-F1776 VanDerWaalsContact CD2-CE1 3.47Å; L1774-F1776 HydrophobicContact CD2-CZ 3.77Å; L1774-F1776 HydrophobicContact CG-CE1 4.48Å; L1774-F1776 PolarHBondContact O-N 3.14Å; L1774-F1776 VanDerWaalsContact O-N 3.07Å; F1776-L1827 HydrophobicContact CZ-CD1 4.46Å; F1776-W1836 AromaticContact CD2-CD2 3.69Å; F1776-W1836 HydrophobicContact CD2-CD2 3.69Å; F1776-W1836 AromaticContact CD2-CE2 3.83Å; F1776-W1836 AromaticContact CD2-CE3 3.69Å; F1776-W1836 HydrophobicContact CD2-CE3 3.69Å; F1776-W1836 HydrophobicContact CD2-CG 4.33Å; F1776-W1836 AromaticContact CD2-CH2 3.92Å; F1776-W1836 HydrophobicContact CD2-CH2 4.03Å; F1776-W1836 AromaticContact CD2-CZ2 3.89Å; F1776-W1836 HydrophobicContact CD2-CZ2 4.01Å; F1776-W1836 AromaticContact CD2-CZ3 3.87Å; F1776-W1836 HydrophobicContact CD2-CZ3 3.87Å; F1776-W1836 HydrophobicContact CE2-CB 4.21Å; F1776-W1836 AromaticContact CE2-CD1 3.93Å; F1776-W1836 AromaticContact CE2-CD2 3.54Å; F1776-W1836 HydrophobicContact CE2-CD2 3.54Å; F1776-W1836 VanDerWaalsContact CE2-CD2 3.41Å; F1776-W1836 AromaticContact CE2-CE2 3.88Å; F1776-W1836 AromaticContact CE2-CE3 3.86Å; F1776-W1836 HydrophobicContact CE2-CE3 3.86Å; F1776-W1836 AromaticContact CE2-CG 3.69Å; F1776-W1836 HydrophobicContact CE2-CG 3.69Å; F1776-W1836 HydrophobicContact CE2-CZ2 4.43Å; F1776-W1836 HydrophobicContact CE2-CZ3 4.45Å; F1776-W1836 HydrophobicContact CG-CZ3 4.49Å; F1776-L1838 HydrophobicContact CE1-CD1 4.09Å; F1776-L1838 HydrophobicContact CE1-CD2 3.99Å; F1776-L1838 HydrophobicContact CE1-CG 4.25Å; F1776-L1838 HydrophobicContact CE2-CD2 4.12Å; F1776-L1838 HydrophobicContact CZ-CD1 3.97Å; F1776-L1838 HydrophobicContact CZ-CD2 3.79Å; F1776-L1838 HydrophobicContact CZ-CG 4.12Å; F1776-L1844 HydrophobicContact CE1-CD2 4.27Å; F1776-A1846 HydrophobicContact CB-CB 4.26Å; F1776-A1846 HydrophobicContact CD1-CB 3.55Å; F1776-A1846 VanDerWaalsContact CD1-CB 3.48Å; F1776-A1846 HydrophobicContact CD2-CB 3.83Å; F1776-A1846 HydrophobicContact CE1-CB 3.68Å; F1776-A1846 HydrophobicContact CE2-CB 3.96Å; F1776-A1846 HydrophobicContact CG-CB 3.63Å; F1776-A1846 VanDerWaalsContact CG-CB 3.44Å; F1776-A1846 HydrophobicContact CZ-CB 3.9Å
1777	L	81	Confident	73.2	Confident	18.8 Å²	18.8	64.6 Å²	64.6	10%	0.098	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-44.3	176.1	-65.4	-178.1	0	0	0	111.4	L1774 D1775 F1781 L1827 H1829	L1774-L1777 HydrophobicContact CB-CD1 4.11Å; L1774-L1777 HydrophobicContact CB-CG 4.4Å; L1774-L1777 HydrophobicContact CD1-CD1 4.06Å; L1774-L1777 HydrophobicContact CG-CD1 4.48Å; L1774-L1777 PolarHBondContact O-N 2.96Å; D1775-L1777 VanDerWaalsContact C-N 3.3Å; D1775-L1777 PolarHBondContact O-N 3.1Å; L1777-F1781 HydrophobicContact CB-CE2 4.15Å; L1777-F1781 HydrophobicContact CB-CZ 4.11Å; L1777-F1781 HydrophobicContact CD1-CZ 4.36Å; L1777-L1827 HydrophobicContact CD1-CD1 4.24Å; L1777-L1827 HydrophobicContact CD1-CD2 3.91Å; L1777-L1827 HydrophobicContact CD2-CD2 4.08Å; L1777-H1829 HydrophobicContact CD1-CB 4.35Å; L1777-H1829 HydrophobicContact CD2-CB 3.94Å
1778	Q	73.2	Confident	73.4	Confident	58.8 Å²	58.8	63.5 Å²	63.5	28%	0.275	33%	0.331	S	S	.	.			trans	-160.5	139.1	178	-156.2	168	-10.8	0	0	109.3	D1775 N1780 F1781	D1775-Q1778 CarbonylContact O-C 3.46Å; Q1778-N1780 VanDerWaalsContact C-N 3.28Å; Q1778-N1780 VanDerWaalsContact CD-O 3.31Å; Q1778-N1780 WeakPolarHBondContact CG-O 3.28Å; Q1778-N1780 PolarHBondContact NE2-O 3.19Å; Q1778-N1780 PolarHBondContact O-N 2.86Å; Q1778-F1781 HydrophobicContact CB-CE1 4.37Å; Q1778-F1781 HydrophobicContact CB-CE2 4.47Å; Q1778-F1781 HydrophobicContact CB-CZ 4.35Å; Q1778-F1781 WeakPolarHBondContact O-CE2 3.12Å
1779	S	62.9	Low	74	Confident	91.8 Å²	91.8	62.2 Å²	62.2	64%	0.642	32%	0.323	S	S	*	.	S	Bend	trans	-70.6	-33.1	-175.8	52.9	0	0	0	0	113.7	K1773	K1773-S1779 PolarHBondContact NZ-O 3.01Å
1780	N	65.5	Low	74.8	Confident	101.2 Å²	101.2	60.7 Å²	60.7	54%	0.541	31%	0.314	S	S	.	.	S	Bend	trans	-138.1	122	169.8	-74.1	-40.4	0	0	0	108.8	N1673 Q1778 D1782	N1673-N1780 WeakPolarHBondContact OD1-CA 3.34Å; Q1778-N1780 VanDerWaalsContact C-N 3.28Å; Q1778-N1780 VanDerWaalsContact CD-O 3.31Å; Q1778-N1780 WeakPolarHBondContact CG-O 3.28Å; Q1778-N1780 PolarHBondContact NE2-O 3.19Å; Q1778-N1780 PolarHBondContact O-N 2.86Å; N1780-D1782 PolarHBondContact O-N 3.01Å
1781	F	67.7	Low	75.5	Confident	5.8 Å²	5.8	58.9 Å²	58.9	3%	0.025	31%	0.305	C	S	.	.			trans	-78.5	116	168.6	-69.1	-93.1	0	0	0	108.3	P1672 N1673 G1710 L1774 L1777 Q1778 L1786 T1787 H1829	P1672-F1781 HydrophobicContact CB-CB 4.29Å; P1672-F1781 HydrophobicContact CG-CB 4.04Å; P1672-F1781 VanDerWaalsContact CG-O 3.25Å; P1672-F1781 WeakPolarHBondContact CG-O 3.44Å; N1673-F1781 PolarHBondContact ND2-N 3.01Å; N1673-F1781 VanDerWaalsContact ND2-N 3.18Å; N1673-F1781 PolarHBondContact ND2-O 3.31Å; N1673-F1781 WeakPolarHBondContact OD1-CD2 3.21Å; N1673-F1781 PolarHBondContact OD1-N 3Å; G1710-F1781 VanDerWaalsContact CA-CE2 3.46Å; G1710-F1781 VanDerWaalsContact CA-CZ 3.42Å; L1774-F1781 HydrophobicContact CB-CE2 4.28Å; L1774-F1781 HydrophobicContact CB-CZ 4.13Å; L1777-F1781 HydrophobicContact CB-CE2 4.15Å; L1777-F1781 HydrophobicContact CB-CZ 4.11Å; L1777-F1781 HydrophobicContact CD1-CZ 4.36Å; Q1778-F1781 HydrophobicContact CB-CE1 4.37Å; Q1778-F1781 HydrophobicContact CB-CE2 4.47Å; Q1778-F1781 HydrophobicContact CB-CZ 4.35Å; Q1778-F1781 WeakPolarHBondContact O-CE2 3.12Å; F1781-L1786 HydrophobicContact CB-CD2 3.93Å; F1781-L1786 HydrophobicContact CB-CG 4.14Å; F1781-L1786 HydrophobicContact CD1-CD2 3.9Å; F1781-L1786 HydrophobicContact CD1-CG 4.21Å; F1781-L1786 HydrophobicContact CG-CD2 4.03Å; F1781-T1787 HydrophobicContact CD1-CG2 3.59Å; F1781-T1787 VanDerWaalsContact CD1-OG1 3.25Å; F1781-T1787 WeakPolarHBondContact CD1-OG1 3.35Å; F1781-T1787 HydrophobicContact CE1-CG2 3.65Å; F1781-T1787 WeakPolarHBondContact CE1-OG1 3.22Å; F1781-H1829 AromaticContact CE1-NE2 3.95Å
1782	D	65	Low	76.1	Confident	97.6 Å²	97.6	58.1 Å²	58.1	52%	0.522	30%	0.301	S	S	.	.			trans	-72.3	148.4	174.4	-91.7	-30.4	0	0	0	110.6	N1780 D1784 Q1785	N1780-D1782 PolarHBondContact O-N 3.01Å; D1782-D1784 VanDerWaalsContact C-N 3.29Å; D1782-D1784 PolarHBondContact O-N 2.91Å; D1782-D1784 VanDerWaalsContact O-N 3.14Å; D1782-Q1785 HydrophobicContact CB-CB 4.34Å; D1782-Q1785 HydrophobicContact CB-CG 4.4Å; D1782-Q1785 CarbonylContact O-C 3.55Å; D1782-Q1785 PolarHBondContact O-N 3.22Å; D1782-Q1785 VanDerWaalsContact O-N 3.1Å
1783	E	61.8	Low	76.4	Confident	128.4 Å²	128.4	57.4 Å²	57.4	60%	0.6	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-31.7	-178.8	-68.6	-160.1	161.8	0	0	112.7	P1672 Y1691 L1786	P1672-E1783 WeakPolarHBondContact CD-OE1 3.45Å; P1672-E1783 HydrophobicContact CG-CB 4.41Å; P1672-E1783 HydrophobicContact CG-CG 3.81Å; Y1691-E1783 WeakPolarHBondContact OH-CA 3.33Å; Y1691-E1783 PolarHBondContact OH-O 2.92Å; Y1691-E1783 VanDerWaalsContact OH-O 3.14Å; E1783-L1786 WeakPolarHBondContact O-CD1 3.49Å
1784	D	60	Low	76.6	Confident	160 Å²	160	54.8 Å²	54.8	86%	0.856	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-12.2	-176.6	-67.4	-35.8	0	0	0	114.1	D1782	D1782-D1784 VanDerWaalsContact C-N 3.29Å; D1782-D1784 PolarHBondContact O-N 2.91Å; D1782-D1784 VanDerWaalsContact O-N 3.14Å
1785	Q	59.8	Low	76.6	Confident	125.6 Å²	125.6	56 Å²	56	59%	0.587	30%	0.297	S	S	*	.			trans	-114.2	75.3	-178.2	-67.9	-163.4	11	0	0	112.2	D1782 T1787	D1782-Q1785 HydrophobicContact CB-CB 4.34Å; D1782-Q1785 HydrophobicContact CB-CG 4.4Å; D1782-Q1785 CarbonylContact O-C 3.55Å; D1782-Q1785 PolarHBondContact O-N 3.22Å; D1782-Q1785 VanDerWaalsContact O-N 3.1Å; Q1785-T1787 WeakPolarHBondContact O-CG2 3.42Å; Q1785-T1787 PolarHBondContact O-N 3.09Å; Q1785-T1787 PolarHBondContact O-OG1 2.79Å
1786	L	58.7	Low	76.6	Confident	79.8 Å²	79.8	53.9 Å²	53.9	42%	0.418	29%	0.286	S	S	.	.			trans	-68.2	111.3	171.9	-68.5	157.3	0	0	0	110	P1672 Y1691 N1692 Y1694 F1781 E1783 T1788	P1672-L1786 HydrophobicContact CB-CD1 3.9Å; P1672-L1786 HydrophobicContact CB-CD2 3.75Å; P1672-L1786 VanDerWaalsContact CB-CD2 3.42Å; P1672-L1786 HydrophobicContact CB-CG 4.16Å; P1672-L1786 HydrophobicContact CG-CD1 3.84Å; P1672-L1786 HydrophobicContact CG-CD2 4.22Å; P1672-L1786 HydrophobicContact CG-CG 4.27Å; Y1691-L1786 HydrophobicContact CD1-CD2 4.39Å; Y1691-L1786 HydrophobicContact CE1-CD1 3.54Å; Y1691-L1786 VanDerWaalsContact CE1-CD1 3.5Å; Y1691-L1786 HydrophobicContact CE1-CD2 3.96Å; Y1691-L1786 VanDerWaalsContact CE1-CD2 3.49Å; Y1691-L1786 HydrophobicContact CE1-CG 4.28Å; Y1691-L1786 WeakPolarHBondContact OH-CD1 3.35Å; N1692-L1786 HydrophobicContact CB-CD2 4.42Å; N1692-L1786 WeakPolarHBondContact ND2-CD2 3.39Å; Y1694-L1786 HydrophobicContact CE1-CD2 4.13Å; Y1694-L1786 VanDerWaalsContact OH-CB 3.25Å; Y1694-L1786 WeakPolarHBondContact OH-CB 3.35Å; Y1694-L1786 WeakPolarHBondContact OH-CD2 3.08Å; F1781-L1786 HydrophobicContact CB-CD2 3.93Å; F1781-L1786 HydrophobicContact CB-CG 4.14Å; F1781-L1786 HydrophobicContact CD1-CD2 3.9Å; F1781-L1786 HydrophobicContact CD1-CG 4.21Å; F1781-L1786 HydrophobicContact CG-CD2 4.03Å; E1783-L1786 WeakPolarHBondContact O-CD1 3.49Å; L1786-T1788 PolarHBondContact O-N 3.1Å; L1786-T1788 VanDerWaalsContact O-N 3.11Å
1787	T	64.4	Low	76.7	Confident	18.8 Å²	18.8	51.8 Å²	51.8	12%	0.115	28%	0.277	C	S	.	.			trans	-86.3	120.1	-180	46.1	0	0	0	0	109.9	F1781 Q1785 Y1789 H1829 S1831	F1781-T1787 HydrophobicContact CD1-CG2 3.59Å; F1781-T1787 VanDerWaalsContact CD1-OG1 3.25Å; F1781-T1787 WeakPolarHBondContact CD1-OG1 3.35Å; F1781-T1787 HydrophobicContact CE1-CG2 3.65Å; F1781-T1787 WeakPolarHBondContact CE1-OG1 3.22Å; Q1785-T1787 WeakPolarHBondContact O-CG2 3.42Å; Q1785-T1787 PolarHBondContact O-N 3.09Å; Q1785-T1787 PolarHBondContact O-OG1 2.79Å; T1787-Y1789 PolarHBondContact O-N 2.92Å; T1787-H1829 PolarHBondContact OG1-NE2 2.8Å; T1787-S1831 WeakPolarHBondContact CB-OG 3.42Å; T1787-S1831 VanDerWaalsContact OG1-CB 3.3Å; T1787-S1831 WeakPolarHBondContact OG1-CB 3.49Å; T1787-S1831 PolarHBondContact OG1-OG 2.87Å
1788	T	81	Confident	76.6	Confident	57 Å²	57	52.5 Å²	52.5	35%	0.35	28%	0.28	S	S	.	.			trans	-79.7	120.4	-179.9	50.9	0	0	0	0	110.3	Y1694 L1786 H1829 T1830	Y1694-T1788 HydrophobicContact CE1-CG2 4.38Å; Y1694-T1788 HydrophobicContact CE2-CG2 4.4Å; Y1694-T1788 WeakPolarHBondContact OH-CG2 3.48Å; L1786-T1788 PolarHBondContact O-N 3.1Å; L1786-T1788 VanDerWaalsContact O-N 3.11Å; T1788-H1829 PolarHBondContact O-CD2 3.03Å; T1788-T1830 WeakPolarHBondContact O-CB 3.35Å; T1788-T1830 PolarHBondContact O-N 3.08Å; T1788-T1830 VanDerWaalsContact O-N 3.1Å; T1788-T1830 PolarHBondContact O-OG1 3.01Å; T1788-T1830 VanDerWaalsContact OG1-CB 3.28Å; T1788-T1830 WeakPolarHBondContact OG1-CB 3.44Å; T1788-T1830 PolarHBondContact OG1-OG1 3.03Å; T1788-T1830 VanDerWaalsContact OG1-OG1 3.13Å
1789	Y	91.6	Very high	76.7	Confident	2.4 Å²	2.4	50.7 Å²	50.7	1%	0.009	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	151.1	168.7	60.2	-92.7	0	0	0	110.7	Y1694 C1695 G1707 D1708 G1709 F1711 L1712 L1774 T1787 I1791 L1827 S1828	Y1694-Y1789 HydrophobicContact CD2-CD1 4.43Å; Y1694-Y1789 AromaticContact CD2-CE1 3.82Å; Y1694-Y1789 HydrophobicContact CD2-CE1 4Å; Y1694-Y1789 WeakPolarHBondContact CE1-O 3.48Å; Y1694-Y1789 HydrophobicContact CE2-CE1 4.45Å; C1695-Y1789 VanDerWaalsContact SG-CE2 3.58Å; C1695-Y1789 WeakPolarHBondContact SG-CE2 3.4Å; C1695-Y1789 PolarHBondContact SG-O 3.3Å; C1695-Y1789 VanDerWaalsContact SG-O 3.41Å; G1707-Y1789 VanDerWaalsContact C-OH 3.29Å; G1707-Y1789 VanDerWaalsContact CA-OH 3.28Å; G1707-Y1789 WeakPolarHBondContact CA-OH 3.44Å; D1708-Y1789 PolarHBondContact N-OH 3.4Å; G1709-Y1789 VanDerWaalsContact O-CE1 3.26Å; G1709-Y1789 WeakPolarHBondContact O-CE1 3.42Å; G1709-Y1789 VanDerWaalsContact O-CZ 3.31Å; G1709-Y1789 PolarHBondContact O-OH 3.12Å; F1711-Y1789 PolarHBondContact O-OH 2.97Å; L1712-Y1789 HydrophobicContact CD2-CE2 4.26Å; L1774-Y1789 HydrophobicContact CD1-CD1 4.49Å; L1774-Y1789 HydrophobicContact CD1-CE1 4Å; L1774-Y1789 HydrophobicContact CD1-CE2 4.19Å; T1787-Y1789 PolarHBondContact O-N 2.92Å; Y1789-I1791 HydrophobicContact CD2-CG2 4.09Å; Y1789-I1791 HydrophobicContact CE2-CG2 4.29Å; Y1789-L1827 HydrophobicContact CD2-CD1 3.97Å; Y1789-L1827 HydrophobicContact CD2-CG 4.28Å; Y1789-L1827 HydrophobicContact CE2-CD1 4.36Å; Y1789-L1827 HydrophobicContact CG-CD1 4.36Å; Y1789-L1827 HydrophobicContact CG-CG 4.5Å; Y1789-S1828 CarbonylContact C-O 3.41Å; Y1789-S1828 WeakPolarHBondContact CA-O 3.25Å; Y1789-S1828 VanDerWaalsContact CB-O 3.3Å; Y1789-S1828 WeakPolarHBondContact CB-O 3.42Å
1790	F	94.9	Very high	77	Confident	29.6 Å²	29.6	50.6 Å²	50.6	13%	0.13	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	143.9	174.6	-58	-102.3	0	0	0	108.2	L1827 S1828 K1887 I1889 E1973 H1974	F1790-L1827 CarbonylContact O-C 3.53Å; F1790-L1827 WeakPolarHBondContact O-CA 3.25Å; F1790-S1828 WeakPolarHBondContact CB-OG 3.36Å; F1790-S1828 PolarHBondContact N-O 3.26Å; F1790-S1828 PolarHBondContact O-N 2.92Å; F1790-S1828 PolarHBondContact O-OG 3.12Å; F1790-K1887 VanDerWaalsContact CD2-CA 3.44Å; F1790-K1887 HydrophobicContact CD2-CB 4.28Å; F1790-K1887 WeakPolarHBondContact CD2-O 3.41Å; F1790-K1887 VanDerWaalsContact CE2-CA 3.43Å; F1790-K1887 HydrophobicContact CE2-CB 3.77Å; F1790-K1887 HydrophobicContact CE2-CG 4.34Å; F1790-K1887 VanDerWaalsContact CG-C 3.47Å; F1790-K1887 HydrophobicContact CZ-CB 4.13Å; F1790-I1889 HydrophobicContact CB-CG2 3.95Å; F1790-E1973 HydrophobicContact CE1-CG 4.37Å; F1790-E1973 HydrophobicContact CZ-CG 4.07Å; F1790-H1974 AromaticContact CE1-ND1 3.9Å
1791	I	94.6	Very high	76.6	Confident	11.8 Å²	11.8	48.4 Å²	48.4	6%	0.061	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	149.5	179.7	50.4	171	0	0	0	110.4	C1695 L1697 L1705 L1712 Y1789 L1825 F1826 L1827	C1695-I1791 HydrophobicContact CB-CD1 4.25Å; C1695-I1791 HydrophobicContact CB-CG1 3.9Å; C1695-I1791 VanDerWaalsContact SG-CD1 3.54Å; C1695-I1791 VanDerWaalsContact SG-CG1 3.53Å; C1695-I1791 WeakPolarHBondContact SG-CG1 3.28Å; L1697-I1791 HydrophobicContact CB-CD1 4.37Å; L1697-I1791 HydrophobicContact CD1-CB 3.86Å; L1697-I1791 HydrophobicContact CD1-CD1 3.65Å; L1697-I1791 HydrophobicContact CD1-CG1 3.52Å; L1697-I1791 VanDerWaalsContact CD1-CG1 3.4Å; L1697-I1791 HydrophobicContact CD2-CB 3.94Å; L1697-I1791 HydrophobicContact CD2-CD1 3.97Å; L1697-I1791 HydrophobicContact CD2-CG1 3.87Å; L1697-I1791 HydrophobicContact CG-CD1 4.05Å; L1697-I1791 HydrophobicContact CG-CG1 3.92Å; L1705-I1791 HydrophobicContact CD2-CD1 3.97Å; L1705-I1791 HydrophobicContact CG-CD1 4.1Å; L1712-I1791 HydrophobicContact CD2-CD1 4.18Å; L1712-I1791 HydrophobicContact CD2-CG2 4.41Å; Y1789-I1791 HydrophobicContact CD2-CG2 4.09Å; Y1789-I1791 HydrophobicContact CE2-CG2 4.29Å; I1791-L1825 HydrophobicContact CB-CD1 4.43Å; I1791-L1825 HydrophobicContact CG2-CD1 4.31Å; I1791-F1826 CarbonylContact C-O 3.51Å; I1791-F1826 VanDerWaalsContact CA-O 3.29Å; I1791-F1826 WeakPolarHBondContact CA-O 3.4Å; I1791-L1827 HydrophobicContact CG2-CB 4.1Å; I1791-L1827 HydrophobicContact CG2-CD1 3.9Å; I1791-L1827 HydrophobicContact CG2-CG 3.95Å
1792	T	94.9	Very high	75.8	Confident	12.4 Å²	12.4	54.4 Å²	54.4	8%	0.076	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	157.7	167.8	-169.3	0	0	0	0	109.5	L1697 L1825 F1826 I1889 V1890 A1891 L1896	L1697-T1792 VanDerWaalsContact CD1-CA 3.43Å; T1792-L1825 CarbonylContact O-C 3.5Å; T1792-L1825 WeakPolarHBondContact O-CA 3.38Å; T1792-F1826 HydrophobicContact CG2-CB 3.92Å; T1792-F1826 HydrophobicContact CG2-CD2 4.1Å; T1792-F1826 HydrophobicContact CG2-CG 4.45Å; T1792-F1826 PolarHBondContact N-O 3.11Å; T1792-F1826 PolarHBondContact O-N 3.09Å; T1792-I1889 WeakPolarHBondContact CB-O 3.35Å; T1792-I1889 HydrophobicContact CG2-CB 4.42Å; T1792-I1889 HydrophobicContact CG2-CD1 4.49Å; T1792-I1889 HydrophobicContact CG2-CG1 3.95Å; T1792-I1889 HydrophobicContact CG2-CG2 3.99Å; T1792-V1890 WeakPolarHBondContact OG1-CA 3.49Å; T1792-A1891 HydrophobicContact CG2-CB 4.24Å; T1792-A1891 PolarHBondContact OG1-N 3.22Å; T1792-A1891 VanDerWaalsContact OG1-N 3.15Å; T1792-L1896 HydrophobicContact CG2-CD1 4.11Å
1793	V	91.9	Very high	75	Confident	18.6 Å²	18.6	53.8 Å²	53.8	11%	0.113	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	152.7	171.6	-68.2	0	0	0	0	109.5	L1697 Y1797 L1825	L1697-V1793 HydrophobicContact CD1-CB 4.46Å; L1697-V1793 HydrophobicContact CD1-CG1 4.01Å; L1697-V1793 HydrophobicContact CD1-CG2 4.22Å; L1697-V1793 HydrophobicContact CD2-CB 4.11Å; L1697-V1793 HydrophobicContact CD2-CG1 3.7Å; L1697-V1793 HydrophobicContact CD2-CG2 3.68Å; L1697-V1793 HydrophobicContact CG-CG1 4.41Å; L1697-V1793 HydrophobicContact CG-CG2 4.35Å; V1793-Y1797 HydrophobicContact CB-CD1 3.82Å; V1793-Y1797 HydrophobicContact CB-CG 4.02Å; V1793-Y1797 HydrophobicContact CG1-CD1 3.49Å; V1793-Y1797 HydrophobicContact CG1-CE1 3.93Å; V1793-Y1797 HydrophobicContact CG1-CG 4.06Å; V1793-Y1797 HydrophobicContact CG2-CD1 4.38Å; V1793-L1825 HydrophobicContact CG1-CB 3.99Å; V1793-L1825 HydrophobicContact CG1-CD1 3.53Å; V1793-L1825 VanDerWaalsContact CG1-CD1 3.47Å
1794	H	88.4	Confident	74.2	Confident	7.6 Å²	7.6	55.8 Å²	55.8	4%	0.035	29%	0.288	C	S	.	.			trans	-63.9	144.9	166.5	-175.4	-96.1	0	0	0	109.9	N1796 Y1797 S1822 G1824 F1826 T1892 Q1893	H1794-N1796 PolarHBondContact ND1-N 3.25Å; H1794-N1796 VanDerWaalsContact ND1-N 3.19Å; H1794-N1796 PolarHBondContact O-N 3.07Å; H1794-Y1797 VanDerWaalsContact O-CB 3.24Å; H1794-Y1797 WeakPolarHBondContact O-CB 3.36Å; H1794-Y1797 PolarHBondContact O-N 3.06Å; H1794-S1822 PolarHBondContact CE1-O 2.94Å; H1794-S1822 WeakPolarHBondContact ND1-CB 3.35Å; H1794-S1822 PolarHBondContact ND1-O 3.09Å; H1794-G1824 PolarHBondContact N-O 2.92Å; H1794-G1824 VanDerWaalsContact N-O 3.16Å; H1794-F1826 HydrophobicContact CB-CE2 4.35Å; H1794-T1892 PolarHBondContact CD2-O 3.11Å; H1794-T1892 VanDerWaalsContact CD2-O 3.22Å; H1794-T1892 PolarHBondContact NE2-O 2.86Å; H1794-Q1893 WeakPolarHBondContact NE2-CA 3.31Å; H1794-Q1893 PolarHBondContact NE2-O 3.15Å
1795	P	86.1	Confident	73.3	Confident	26 Å²	26	51.2 Å²	51.2	17%	0.169	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-13.8	-179	-28.3	36.2	0	0	0	116.6	T1363 I1364 S1700 A1891 F1977 I1979	T1363-P1795 PolarHBondContact OG1-O 3.21Å; I1364-P1795 HydrophobicContact CD1-CB 3.87Å; I1364-P1795 HydrophobicContact CD1-CG 4.28Å; I1364-P1795 HydrophobicContact CG1-CB 4.14Å; S1700-P1795 WeakPolarHBondContact CB-O 3.3Å; S1700-P1795 PolarHBondContact OG-O 3.3Å; S1700-P1795 VanDerWaalsContact OG-O 3.09Å; P1795-A1891 WeakPolarHBondContact CG-O 3.4Å; P1795-F1977 HydrophobicContact CG-CE1 4.45Å; P1795-I1979 HydrophobicContact CB-CD1 4.36Å
1796	N	82	Confident	72.5	Confident	33.6 Å²	33.6	48.7 Å²	48.7	18%	0.18	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-0.9	175.3	-68	5.3	0	0	0	113.9	T1363 I1364 H1794 I1798	T1363-N1796 WeakPolarHBondContact OG1-CA 3.28Å; T1363-N1796 PolarHBondContact OG1-OD1 2.57Å; I1364-N1796 VanDerWaalsContact CA-OD1 3.3Å; I1364-N1796 WeakPolarHBondContact CA-OD1 3.31Å; I1364-N1796 WeakPolarHBondContact CB-OD1 3.22Å; I1364-N1796 VanDerWaalsContact CG1-OD1 3.27Å; I1364-N1796 WeakPolarHBondContact CG1-OD1 3.32Å; I1364-N1796 PolarHBondContact N-OD1 2.96Å; I1364-N1796 PolarHBondContact O-ND2 3.33Å; I1364-N1796 PolarHBondContact O-OD1 2.96Å; H1794-N1796 PolarHBondContact ND1-N 3.25Å; H1794-N1796 VanDerWaalsContact ND1-N 3.19Å; H1794-N1796 PolarHBondContact O-N 3.07Å; N1796-I1798 PolarHBondContact O-N 2.86Å
1797	Y	84.9	Confident	71.6	Confident	2.4 Å²	2.4	49.1 Å²	49.1	1%	0.009	26%	0.261	C	S	.	.			trans	-68.1	128.2	-176.8	179.6	-98.5	0	0	0	110.5	D1699 S1700 W1714 V1793 H1794 Y1799 S1822 N1823 L1825 T1840	D1699-Y1797 HydrophobicContact CB-CD1 3.91Å; D1699-Y1797 HydrophobicContact CB-CE1 4.16Å; S1700-Y1797 WeakPolarHBondContact CB-O 3.21Å; S1700-Y1797 PolarHBondContact N-O 3.01Å; S1700-Y1797 PolarHBondContact OG-N 2.94Å; S1700-Y1797 PolarHBondContact OG-O 3.01Å; W1714-Y1797 HydrophobicContact CH2-CD1 4.42Å; W1714-Y1797 AromaticContact CH2-CE1 3.56Å; W1714-Y1797 HydrophobicContact CH2-CE1 3.56Å; W1714-Y1797 AromaticContact CH2-CZ 3.62Å; W1714-Y1797 VanDerWaalsContact CH2-OH 3.26Å; W1714-Y1797 WeakPolarHBondContact CH2-OH 3.39Å; W1714-Y1797 HydrophobicContact CZ2-CD1 4.33Å; W1714-Y1797 AromaticContact CZ2-CE1 3.54Å; W1714-Y1797 HydrophobicContact CZ2-CE1 3.54Å; W1714-Y1797 HydrophobicContact CZ3-CE1 4.45Å; W1714-Y1797 PolarHBondContact NE1-OH 3.1Å; W1714-Y1797 VanDerWaalsContact NE1-OH 3.08Å; V1793-Y1797 HydrophobicContact CB-CD1 3.82Å; V1793-Y1797 HydrophobicContact CB-CG 4.02Å; V1793-Y1797 HydrophobicContact CG1-CD1 3.49Å; V1793-Y1797 HydrophobicContact CG1-CE1 3.93Å; V1793-Y1797 HydrophobicContact CG1-CG 4.06Å; V1793-Y1797 HydrophobicContact CG2-CD1 4.38Å; H1794-Y1797 VanDerWaalsContact O-CB 3.24Å; H1794-Y1797 WeakPolarHBondContact O-CB 3.36Å; H1794-Y1797 PolarHBondContact O-N 3.06Å; Y1797-Y1799 WeakPolarHBondContact OH-CD2 3.4Å; Y1797-S1822 WeakPolarHBondContact CA-O 3.15Å; Y1797-N1823 WeakPolarHBondContact CA-OD1 3.33Å; Y1797-N1823 WeakPolarHBondContact CD2-OD1 3.33Å; Y1797-L1825 HydrophobicContact CE2-CB 4.41Å; Y1797-T1840 HydrophobicContact CE2-CG2 4.12Å; Y1797-T1840 WeakPolarHBondContact CE2-OG1 3.47Å; Y1797-T1840 WeakPolarHBondContact OH-CB 3.37Å; Y1797-T1840 VanDerWaalsContact OH-CG2 3.29Å; Y1797-T1840 WeakPolarHBondContact OH-CG2 3.35Å; Y1797-T1840 PolarHBondContact OH-OG1 3.01Å
1798	I	78.4	Confident	70.3	Confident	33.2 Å²	33.2	53.1 Å²	53.1	17%	0.17	29%	0.286	C	S	.	.			trans	-131.9	127.8	170.1	-60.8	174.4	0	0	0	106.8	S1700 A1701 N1796 H1800 A1801	S1700-I1798 WeakPolarHBondContact OG-CG1 3.42Å; A1701-I1798 HydrophobicContact CB-CG1 4.47Å; A1701-I1798 HydrophobicContact CB-CG2 3.8Å; N1796-I1798 PolarHBondContact O-N 2.86Å; I1798-H1800 VanDerWaalsContact CG2-NE2 3.26Å; I1798-H1800 WeakPolarHBondContact CG2-NE2 3.35Å; I1798-H1800 PolarHBondContact O-CD2 3.06Å; I1798-H1800 PolarHBondContact O-N 2.86Å; I1798-A1801 HydrophobicContact CB-CB 3.91Å; I1798-A1801 HydrophobicContact CG2-CB 3.9Å
1799	Y	77	Confident	68.1	Low	21.2 Å²	21.2	56.1 Å²	56.1	8%	0.083	30%	0.298	C	S	.	.			trans	-71.9	123.8	173.6	-178.9	-96.9	0	0	0	110.5	D1699 W1714 I1769 I1770 Y1772 Y1797 A1801 T1841	D1699-Y1799 WeakPolarHBondContact OD2-CB 3.13Å; D1699-Y1799 PolarHBondContact OD2-N 2.99Å; W1714-Y1799 HydrophobicContact CB-CD1 4.35Å; W1714-Y1799 HydrophobicContact CB-CE1 4.46Å; W1714-Y1799 AromaticContact CD1-CD1 3.95Å; W1714-Y1799 AromaticContact CD1-CD2 3.7Å; W1714-Y1799 AromaticContact CD1-CG 3.68Å; W1714-Y1799 HydrophobicContact CD2-CD1 4.29Å; W1714-Y1799 AromaticContact CD2-CD2 3.75Å; W1714-Y1799 HydrophobicContact CD2-CD2 3.98Å; W1714-Y1799 HydrophobicContact CD2-CE2 4.26Å; W1714-Y1799 AromaticContact CD2-CG 3.86Å; W1714-Y1799 HydrophobicContact CD2-CG 4.01Å; W1714-Y1799 AromaticContact CE2-CD2 3.71Å; W1714-Y1799 HydrophobicContact CE3-CD1 4.36Å; W1714-Y1799 AromaticContact CE3-CD2 3.87Å; W1714-Y1799 HydrophobicContact CE3-CD2 3.87Å; W1714-Y1799 HydrophobicContact CE3-CE2 4.34Å; W1714-Y1799 HydrophobicContact CE3-CG 4.05Å; W1714-Y1799 HydrophobicContact CG-CD1 4.28Å; W1714-Y1799 AromaticContact CG-CD2 3.92Å; W1714-Y1799 HydrophobicContact CG-CD2 4.18Å; W1714-Y1799 HydrophobicContact CG-CE1 4.46Å; W1714-Y1799 HydrophobicContact CG-CE2 4.35Å; W1714-Y1799 HydrophobicContact CG-CG 4.24Å; W1714-Y1799 HydrophobicContact CZ2-CD2 4.39Å; W1714-Y1799 HydrophobicContact CZ3-CD2 4.36Å; W1714-Y1799 HydrophobicContact CZ3-CG 4.5Å; W1714-Y1799 AromaticContact NE1-CD2 3.57Å; W1714-Y1799 AromaticContact NE1-CG 3.87Å; I1769-Y1799 HydrophobicContact CB-CE1 4.31Å; I1769-Y1799 HydrophobicContact CD1-CD1 3.96Å; I1769-Y1799 HydrophobicContact CD1-CE1 4.17Å; I1769-Y1799 HydrophobicContact CG2-CD1 4.36Å; I1769-Y1799 HydrophobicContact CG2-CE1 3.74Å; I1770-Y1799 HydrophobicContact CG2-CE1 4.2Å; I1770-Y1799 HydrophobicContact CG2-CE2 4.1Å; I1770-Y1799 VanDerWaalsContact CG2-OH 3.28Å; I1770-Y1799 WeakPolarHBondContact CG2-OH 3.26Å; Y1772-Y1799 HydrophobicContact CE2-CE2 4.11Å; Y1797-Y1799 WeakPolarHBondContact OH-CD2 3.4Å; Y1799-A1801 HydrophobicContact CE1-CB 4.28Å; Y1799-A1801 PolarHBondContact O-N 2.87Å; Y1799-A1801 VanDerWaalsContact O-N 3.11Å; Y1799-T1841 HydrophobicContact CE2-CG2 4.36Å
1800	H	67.9	Low	65.5	Low	88.6 Å²	88.6	60.6 Å²	60.6	41%	0.41	32%	0.322	S	S	.	.			trans	-117.4	83.7	174.2	-91.8	-85.5	0	0	0	113.1	I1798 N1802 D1803 T1841	I1798-H1800 VanDerWaalsContact CG2-NE2 3.26Å; I1798-H1800 WeakPolarHBondContact CG2-NE2 3.35Å; I1798-H1800 PolarHBondContact O-CD2 3.06Å; I1798-H1800 PolarHBondContact O-N 2.86Å; H1800-N1802 PolarHBondContact O-N 3.2Å; H1800-N1802 VanDerWaalsContact O-N 3.14Å; H1800-D1803 HydrophobicContact CB-CB 3.91Å; H1800-D1803 IonicContact CE1-OD2 3.5Å; H1800-D1803 PolarHBondContact CE1-OD2 2.84Å; H1800-D1803 VanDerWaalsContact CE1-OD2 3.25Å; H1800-D1803 IonicContact ND1-OD2 2.95Å; H1800-T1841 VanDerWaalsContact O-CG2 3.31Å; H1800-T1841 WeakPolarHBondContact O-CG2 3.32Å
1801	A	58.3	Low	62.5	Low	55 Å²	55	61.6 Å²	61.6	46%	0.455	34%	0.341	S	S	.	.	S	Bend	trans	-71.6	72.8	173.8	0	0	0	0	0	111.1	I1769 I1798 Y1799 D1803	I1769-A1801 HydrophobicContact CG2-CB 4.22Å; I1798-A1801 HydrophobicContact CB-CB 3.91Å; I1798-A1801 HydrophobicContact CG2-CB 3.9Å; Y1799-A1801 HydrophobicContact CE1-CB 4.28Å; Y1799-A1801 PolarHBondContact O-N 2.87Å; Y1799-A1801 VanDerWaalsContact O-N 3.11Å; A1801-D1803 PolarHBondContact O-N 2.89Å
1802	N	51.4	Low	59.4	Low	133.4 Å²	133.4	68.1 Å²	68.1	71%	0.713	38%	0.376	S	S	*	.	S	Bend	trans	68.4	13.6	179.5	-62.2	-26.5	0	0	0	117.5	H1800 Y1804 N1823	H1800-N1802 PolarHBondContact O-N 3.2Å; H1800-N1802 VanDerWaalsContact O-N 3.14Å; N1802-Y1804 WeakPolarHBondContact O-CD2 3.36Å; N1802-Y1804 WeakPolarHBondContact O-CE2 3.49Å; N1802-Y1804 PolarHBondContact O-N 3.18Å; N1802-N1823 PolarHBondContact ND2-ND2 2.97Å; N1802-N1823 VanDerWaalsContact ND2-ND2 3.14Å; N1802-N1823 PolarHBondContact OD1-ND2 3.25Å
1803	D	47.6	Very low	56.4	Low	83.6 Å²	83.6	71.5 Å²	71.5	45%	0.447	40%	0.4	S	S	.	.			trans	-86	89.9	177.5	-113.3	-15.8	0	0	0	112.8	H1800 A1801 S1805	H1800-D1803 HydrophobicContact CB-CB 3.91Å; H1800-D1803 IonicContact CE1-OD2 3.5Å; H1800-D1803 PolarHBondContact CE1-OD2 2.84Å; H1800-D1803 VanDerWaalsContact CE1-OD2 3.25Å; H1800-D1803 IonicContact ND1-OD2 2.95Å; A1801-D1803 PolarHBondContact O-N 2.89Å; D1803-S1805 VanDerWaalsContact C-N 3.33Å; D1803-S1805 PolarHBondContact O-N 2.86Å; D1803-S1805 WeakPolarHBondContact OD1-CA 3.49Å; D1803-S1805 VanDerWaalsContact OD1-CB 3.31Å; D1803-S1805 WeakPolarHBondContact OD1-CB 3.28Å; D1803-S1805 PolarHBondContact OD1-N 2.81Å; D1803-S1805 PolarHBondContact OD1-OG 2.9Å
1804	Y	44.5	Very low	53.5	Low	170.8 Å²	170.8	73.4 Å²	73.4	67%	0.67	42%	0.424	S	S	*	.			trans	-91.6	-5.7	173.9	-83	-86.4	0	0	0	113.9	N1802 I1806 L1807 P1842	N1802-Y1804 WeakPolarHBondContact O-CD2 3.36Å; N1802-Y1804 WeakPolarHBondContact O-CE2 3.49Å; N1802-Y1804 PolarHBondContact O-N 3.18Å; Y1804-I1806 VanDerWaalsContact C-N 3.29Å; Y1804-I1806 PolarHBondContact O-N 3.16Å; Y1804-L1807 WeakPolarHBondContact O-CB 3.25Å; Y1804-L1807 PolarHBondContact O-N 3.44Å; Y1804-L1807 VanDerWaalsContact O-N 3.13Å; Y1804-P1842 HydrophobicContact CD1-CB 4.17Å; Y1804-P1842 HydrophobicContact CD1-CG 4.42Å; Y1804-P1842 HydrophobicContact CE1-CB 3.8Å; Y1804-P1842 HydrophobicContact CE1-CG 3.89Å; Y1804-P1842 HydrophobicContact CE2-CB 3.95Å; Y1804-P1842 VanDerWaalsContact OH-CB 3.27Å; Y1804-P1842 WeakPolarHBondContact OH-CB 3.31Å; Y1804-P1842 WeakPolarHBondContact OH-CG 2.96Å
1805	S	41.1	Very low	50.7	Low	63.4 Å²	63.4	80 Å²	80	44%	0.443	46%	0.46	S	S	.	.	S	Bend	trans	-104.8	-2.2	-166.6	-173.6	0	0	0	0	114.5	A1340 D1803 L1807 T1808 L1809	A1340-S1805 PolarHBondContact O-OG 3.48Å; D1803-S1805 VanDerWaalsContact C-N 3.33Å; D1803-S1805 PolarHBondContact O-N 2.86Å; D1803-S1805 WeakPolarHBondContact OD1-CA 3.49Å; D1803-S1805 VanDerWaalsContact OD1-CB 3.31Å; D1803-S1805 WeakPolarHBondContact OD1-CB 3.28Å; D1803-S1805 PolarHBondContact OD1-N 2.81Å; D1803-S1805 PolarHBondContact OD1-OG 2.9Å; S1805-L1807 VanDerWaalsContact C-N 3.28Å; S1805-L1807 PolarHBondContact O-N 2.93Å; S1805-T1808 WeakPolarHBondContact O-CA 3.14Å; S1805-T1808 WeakPolarHBondContact O-CB 3.35Å; S1805-T1808 PolarHBondContact O-N 2.77Å; S1805-T1808 PolarHBondContact O-OG1 2.94Å; S1805-L1809 PolarHBondContact O-N 2.98Å
1806	I	43.2	Very low	48.1	Very low	72.6 Å²	72.6	84.5 Å²	84.5	37%	0.372	49%	0.486	S	S	.	.	S	Bend	trans	-88.4	-34.9	171.5	-81.4	170	0	0	0	113.5	A1340 Y1804 T1808 L1809 L1810 N1823	A1340-I1806 HydrophobicContact CB-CD1 3.75Å; Y1804-I1806 VanDerWaalsContact C-N 3.29Å; Y1804-I1806 PolarHBondContact O-N 3.16Å; I1806-T1808 VanDerWaalsContact C-N 3.33Å; I1806-T1808 PolarHBondContact O-N 3.06Å; I1806-T1808 VanDerWaalsContact O-N 3.11Å; I1806-L1809 PolarHBondContact O-N 2.98Å; I1806-L1809 VanDerWaalsContact O-N 3.16Å; I1806-L1810 HydrophobicContact CG2-CD1 4.03Å; I1806-L1810 PolarHBondContact O-N 2.84Å; I1806-N1823 VanDerWaalsContact CD1-OD1 3.25Å; I1806-N1823 WeakPolarHBondContact CD1-OD1 3.44Å
1807	L	38.7	Very low	45.7	Very low	89.2 Å²	89.2	84.9 Å²	84.9	47%	0.467	50%	0.498	S	S	.	.	H	α-helix	trans	-71.1	-20.6	-178.2	-81.1	171.1	0	0	0	113.8	Y1804 S1805 L1809 L1810 G1811 N1823 T1841	Y1804-L1807 WeakPolarHBondContact O-CB 3.25Å; Y1804-L1807 PolarHBondContact O-N 3.44Å; Y1804-L1807 VanDerWaalsContact O-N 3.13Å; S1805-L1807 VanDerWaalsContact C-N 3.28Å; S1805-L1807 PolarHBondContact O-N 2.93Å; L1807-L1809 VanDerWaalsContact C-N 3.29Å; L1807-L1809 PolarHBondContact O-N 3.18Å; L1807-L1810 PolarHBondContact O-N 2.6Å; L1807-L1810 VanDerWaalsContact O-O 3.04Å; L1807-G1811 PolarHBondContact O-N 3.13Å; L1807-N1823 WeakPolarHBondContact CD2-ND2 3.43Å; L1807-T1841 HydrophobicContact CD1-CG2 4.2Å
1808	T	37.2	Very low	43.7	Very low	103.2 Å²	103.2	86.3 Å²	86.3	63%	0.633	51%	0.513	S	S	*	.	H	α-helix	trans	-82.3	-21.4	176.8	49.2	0	0	0	0	113.8	S1805 I1806 L1810 G1811	S1805-T1808 WeakPolarHBondContact O-CA 3.14Å; S1805-T1808 WeakPolarHBondContact O-CB 3.35Å; S1805-T1808 PolarHBondContact O-N 2.77Å; S1805-T1808 PolarHBondContact O-OG1 2.94Å; I1806-T1808 VanDerWaalsContact C-N 3.33Å; I1806-T1808 PolarHBondContact O-N 3.06Å; I1806-T1808 VanDerWaalsContact O-N 3.11Å; T1808-L1810 PolarHBondContact O-N 3.16Å; T1808-G1811 PolarHBondContact O-N 3.34Å
1809	L	35.5	Very low	42.4	Very low	118.8 Å²	118.8	85.3 Å²	85.3	62%	0.622	51%	0.51	S	S	*	.	H	α-helix	trans	-84.4	-25.5	179.5	-78	164.5	0	0	0	113.3	S1805 I1806 L1807 G1811	S1805-L1809 PolarHBondContact O-N 2.98Å; I1806-L1809 PolarHBondContact O-N 2.98Å; I1806-L1809 VanDerWaalsContact O-N 3.16Å; L1807-L1809 VanDerWaalsContact C-N 3.29Å; L1807-L1809 PolarHBondContact O-N 3.18Å; L1809-G1811 VanDerWaalsContact C-N 3.26Å; L1809-G1811 PolarHBondContact O-N 2.86Å
1810	L	36.9	Very low	41.8	Very low	97.8 Å²	97.8	88 Å²	88	51%	0.512	53%	0.526	S	S	.	.	H	α-helix	trans	-83.1	2.2	171.5	-70.5	164.6	0	0	0	112	I1806 L1807 T1808 N1812 V1816	I1806-L1810 HydrophobicContact CG2-CD1 4.03Å; I1806-L1810 PolarHBondContact O-N 2.84Å; L1807-L1810 PolarHBondContact O-N 2.6Å; L1807-L1810 VanDerWaalsContact O-O 3.04Å; T1808-L1810 PolarHBondContact O-N 3.16Å; L1810-N1812 VanDerWaalsContact C-N 3.31Å; L1810-N1812 PolarHBondContact O-N 2.83Å; L1810-V1816 HydrophobicContact CD2-CB 4.39Å
1811	G	32.1	Very low	42	Very low	51.2 Å²	51.2	84.2 Å²	84.2	53%	0.528	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-5.2	-178.5	0	0	0	0	0	115.5	L1807 T1808 L1809 S1813	L1807-G1811 PolarHBondContact O-N 3.13Å; T1808-G1811 PolarHBondContact O-N 3.34Å; L1809-G1811 VanDerWaalsContact C-N 3.26Å; L1809-G1811 PolarHBondContact O-N 2.86Å; G1811-S1813 VanDerWaalsContact C-N 3.32Å; G1811-S1813 CarbonylContact O-C 3.53Å; G1811-S1813 WeakPolarHBondContact O-CA 3.3Å; G1811-S1813 PolarHBondContact O-N 2.76Å
1812	N	29.9	Very low	42.6	Very low	147.6 Å²	147.6	82.6 Å²	82.6	79%	0.789	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	5.5	-174.7	-86.1	-0.7	0	0	0	115.3	L1810 G1814 L2663	L1810-N1812 VanDerWaalsContact C-N 3.31Å; L1810-N1812 PolarHBondContact O-N 2.83Å; N1812-G1814 VanDerWaalsContact C-N 3.33Å; N1812-G1814 PolarHBondContact O-N 3.16Å; N1812-L2663 WeakPolarHBondContact O-CD2 3.17Å
1813	S	32.5	Very low	43.5	Very low	83.2 Å²	83.2	78.3 Å²	78.3	58%	0.582	47%	0.47	S	S	*	.	S	Bend	trans	-85.5	93.5	162.9	131.5	0	0	0	0	110.1	R1339 G1811 N1815	R1339-S1813 PolarHBondContact NH2-OG 3.41Å; G1811-S1813 VanDerWaalsContact C-N 3.32Å; G1811-S1813 CarbonylContact O-C 3.53Å; G1811-S1813 WeakPolarHBondContact O-CA 3.3Å; G1811-S1813 PolarHBondContact O-N 2.76Å; S1813-N1815 PolarHBondContact O-N 2.9Å
1814	G	30.2	Very low	45.1	Very low	59.6 Å²	59.6	74.3 Å²	74.3	61%	0.614	45%	0.449	S	S	*	.	S	Bend	trans	-19.4	49.8	165.9	0	0	0	0	0	116.7	N1812 V1816 T1870	N1812-G1814 VanDerWaalsContact C-N 3.33Å; N1812-G1814 PolarHBondContact O-N 3.16Å; G1814-V1816 PolarHBondContact O-N 2.97Å; G1814-T1870 PolarHBondContact O-OG1 3.23Å
1815	N	29.2	Very low	47.3	Very low	146 Å²	146	66.2 Å²	66.2	78%	0.781	42%	0.417	S	S	*	.			trans	-106.4	57.7	167	-79.3	-12.5	0	0	0	112	S1813 G1817	S1813-N1815 PolarHBondContact O-N 2.9Å; N1815-G1817 PolarHBondContact O-N 3.18Å; N1815-G1817 VanDerWaalsContact O-N 3.15Å
1816	V	31.4	Very low	49.8	Very low	120.8 Å²	120.8	63.2 Å²	63.2	73%	0.732	40%	0.396	S	S	*	.			trans	-70.3	81.6	161.7	-171.7	0	0	0	0	111.2	L1810 G1814 G1818	L1810-V1816 HydrophobicContact CD2-CB 4.39Å; G1814-V1816 PolarHBondContact O-N 2.97Å; V1816-G1818 VanDerWaalsContact C-N 3.31Å; V1816-G1818 PolarHBondContact O-N 3.1Å
1817	G	32.4	Very low	52.3	Low	41 Å²	41	59.7 Å²	59.7	42%	0.423	38%	0.378	S	S	.	.			trans	-75.2	54	175.6	0	0	0	0	0	115.6	N1815 F1872 Q1911	N1815-G1817 PolarHBondContact O-N 3.18Å; N1815-G1817 VanDerWaalsContact O-N 3.15Å; G1817-F1872 VanDerWaalsContact CA-CZ 3.47Å; G1817-F1872 WeakPolarHBondContact O-CD1 3.38Å; G1817-F1872 WeakPolarHBondContact O-CD2 3.02Å; G1817-F1872 VanDerWaalsContact O-CE1 3.27Å; G1817-F1872 WeakPolarHBondContact O-CE1 3.24Å; G1817-F1872 WeakPolarHBondContact O-CE2 3.37Å; G1817-F1872 VanDerWaalsContact O-CG 3.22Å; G1817-F1872 WeakPolarHBondContact O-CG 3.25Å; G1817-F1872 WeakPolarHBondContact O-CZ 3.4Å; G1817-Q1911 PolarHBondContact O-NE2 3.44Å; G1817-Q1911 PolarHBondContact O-OE1 3.01Å; G1817-Q1911 VanDerWaalsContact O-OE1 3.08Å
1818	G	42.9	Very low	55	Low	31.2 Å²	31.2	55.4 Å²	55.4	32%	0.322	36%	0.356	S	S	.	.			trans	-112	138.5	174.3	0	0	0	0	0	112	V1816 D1820 Q1911	V1816-G1818 VanDerWaalsContact C-N 3.31Å; V1816-G1818 PolarHBondContact O-N 3.1Å; G1818-D1820 PolarHBondContact O-N 2.95Å; G1818-D1820 VanDerWaalsContact O-N 3.08Å; G1818-Q1911 VanDerWaalsContact CA-CD 3.49Å; G1818-Q1911 VanDerWaalsContact CA-OE1 3.29Å
1819	A	51.3	Low	57.7	Low	12.8 Å²	12.8	50.6 Å²	50.6	11%	0.106	33%	0.326	C	S	.	.			trans	-66.5	114.6	166.6	0	0	0	0	0	109.4	F1821 F1872 Y1874 F1877	A1819-F1821 VanDerWaalsContact C-N 3.3Å; A1819-F1821 HydrophobicContact CB-CD2 4.13Å; A1819-F1821 HydrophobicContact CB-CE1 4.12Å; A1819-F1821 HydrophobicContact CB-CE2 3.95Å; A1819-F1821 HydrophobicContact CB-CZ 3.9Å; A1819-F1821 WeakPolarHBondContact O-CD2 3.41Å; A1819-F1821 PolarHBondContact O-N 3.13Å; A1819-F1872 HydrophobicContact CB-CD1 4.22Å; A1819-F1872 HydrophobicContact CB-CE1 4.18Å; A1819-Y1874 HydrophobicContact CB-CD1 4.18Å; A1819-Y1874 HydrophobicContact CB-CE1 4.06Å; A1819-F1877 HydrophobicContact CB-CD1 3.92Å; A1819-F1877 HydrophobicContact CB-CD2 4.11Å; A1819-F1877 HydrophobicContact CB-CE1 3.54Å; A1819-F1877 HydrophobicContact CB-CE2 4.14Å; A1819-F1877 HydrophobicContact CB-CG 4.06Å; A1819-F1877 HydrophobicContact CB-CZ 3.66Å; A1819-F1877 VanDerWaalsContact N-CZ 3.35Å
1820	D	63.9	Low	60.4	Low	79 Å²	79	46.2 Å²	46.2	42%	0.422	30%	0.304	S	S	.	.			trans	-84.5	100.4	172.7	-175	10.4	0	0	0	109.9	G1818 S1822 N1823 W1837 R1910	G1818-D1820 PolarHBondContact O-N 2.95Å; G1818-D1820 VanDerWaalsContact O-N 3.08Å; D1820-S1822 VanDerWaalsContact C-N 3.29Å; D1820-S1822 VanDerWaalsContact CG-OG 3.28Å; D1820-S1822 PolarHBondContact O-N 3.01Å; D1820-S1822 VanDerWaalsContact O-N 3.09Å; D1820-S1822 WeakPolarHBondContact OD1-CB 3.37Å; D1820-S1822 PolarHBondContact OD1-N 2.95Å; D1820-S1822 VanDerWaalsContact OD1-N 3.14Å; D1820-S1822 PolarHBondContact OD1-OG 3.04Å; D1820-S1822 PolarHBondContact OD2-OG 3.1Å; D1820-S1822 VanDerWaalsContact OD2-OG 3.08Å; D1820-N1823 PolarHBondContact O-N 2.87Å; D1820-N1823 PolarHBondContact OD2-ND2 3.33Å; D1820-W1837 WeakPolarHBondContact O-CZ2 3.39Å; D1820-R1910 WeakPolarHBondContact OD1-CG 3.28Å; D1820-R1910 IonicContact OD1-CZ 2.77Å; D1820-R1910 IonicContact OD1-NE 2.77Å; D1820-R1910 PolarHBondContact OD1-NE 3.41Å; D1820-R1910 VanDerWaalsContact OD1-NE 3.11Å; D1820-R1910 IonicContact OD1-NH2 3.88Å; D1820-R1910 IonicContact OD2-CZ 3.58Å; D1820-R1910 IonicContact OD2-NE 3.55Å; D1820-R1910 PolarHBondContact OD2-NE 3.03Å; D1820-R1910 IonicContact OD2-NH2 3.21Å; D1820-R1910 PolarHBondContact OD2-NH2 3.01Å
1821	F	72.4	Confident	62.8	Low	8.4 Å²	8.4	44.7 Å²	44.7	4%	0.037	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-76.9	-3.8	178.2	-65.5	-73.4	0	0	0	113.4	A1819 N1823 G1824 F1826 W1837 L1849 Y1874 F1877 L1909	A1819-F1821 VanDerWaalsContact C-N 3.3Å; A1819-F1821 HydrophobicContact CB-CD2 4.13Å; A1819-F1821 HydrophobicContact CB-CE1 4.12Å; A1819-F1821 HydrophobicContact CB-CE2 3.95Å; A1819-F1821 HydrophobicContact CB-CZ 3.9Å; A1819-F1821 WeakPolarHBondContact O-CD2 3.41Å; A1819-F1821 PolarHBondContact O-N 3.13Å; F1821-N1823 VanDerWaalsContact C-N 3.26Å; F1821-N1823 PolarHBondContact O-N 3.06Å; F1821-N1823 VanDerWaalsContact O-N 3.11Å; F1821-G1824 PolarHBondContact O-N 3.29Å; F1821-F1826 HydrophobicContact CB-CE1 4.35Å; F1821-F1826 HydrophobicContact CB-CZ 3.91Å; F1821-F1826 AromaticContact CD1-CE1 3.95Å; F1821-F1826 HydrophobicContact CD1-CE1 4.03Å; F1821-F1826 HydrophobicContact CD1-CZ 4.26Å; F1821-F1826 HydrophobicContact CG-CE1 4.35Å; F1821-F1826 HydrophobicContact CG-CZ 4.24Å; F1821-W1837 HydrophobicContact CD1-CB 4.41Å; F1821-W1837 AromaticContact CD1-CD1 3.83Å; F1821-W1837 AromaticContact CD1-CD2 3.75Å; F1821-W1837 HydrophobicContact CD1-CD2 3.75Å; F1821-W1837 AromaticContact CD1-CE2 3.8Å; F1821-W1837 HydrophobicContact CD1-CE3 4.27Å; F1821-W1837 AromaticContact CD1-CG 3.81Å; F1821-W1837 HydrophobicContact CD1-CG 3.81Å; F1821-W1837 HydrophobicContact CD1-CZ2 4.34Å; F1821-W1837 AromaticContact CD1-NE1 3.8Å; F1821-W1837 HydrophobicContact CE1-CB 4.36Å; F1821-W1837 AromaticContact CE1-CD2 3.89Å; F1821-W1837 HydrophobicContact CE1-CD2 3.97Å; F1821-W1837 AromaticContact CE1-CE3 3.94Å; F1821-W1837 HydrophobicContact CE1-CE3 4.06Å; F1821-W1837 HydrophobicContact CE1-CG 4.11Å; F1821-W1837 HydrophobicContact CE1-CZ3 4.42Å; F1821-W1837 PolarHBondContact O-NE1 3.4Å; F1821-L1849 HydrophobicContact CE1-CD1 4.01Å; F1821-L1849 HydrophobicContact CE1-CD2 3.74Å; F1821-L1849 HydrophobicContact CE2-CD1 4.33Å; F1821-L1849 HydrophobicContact CZ-CD1 3.99Å; F1821-L1849 HydrophobicContact CZ-CD2 4.16Å; F1821-Y1874 HydrophobicContact CE1-CD1 4.47Å; F1821-F1877 HydrophobicContact CE1-CD1 4.32Å; F1821-F1877 HydrophobicContact CE1-CE1 4.4Å; F1821-F1877 HydrophobicContact CE2-CD1 4.22Å; F1821-F1877 AromaticContact CE2-CE1 3.7Å; F1821-F1877 HydrophobicContact CE2-CE1 3.7Å; F1821-F1877 HydrophobicContact CE2-CE2 4.22Å; F1821-F1877 AromaticContact CE2-CZ 3.75Å; F1821-F1877 HydrophobicContact CE2-CZ 3.75Å; F1821-F1877 HydrophobicContact CZ-CB 4.12Å; F1821-F1877 AromaticContact CZ-CD1 3.47Å; F1821-F1877 HydrophobicContact CZ-CD1 3.61Å; F1821-F1877 VanDerWaalsContact CZ-CD1 3.42Å; F1821-F1877 HydrophobicContact CZ-CD2 4.36Å; F1821-F1877 AromaticContact CZ-CE1 3.48Å; F1821-F1877 HydrophobicContact CZ-CE1 3.48Å; F1821-F1877 HydrophobicContact CZ-CE2 4.28Å; F1821-F1877 AromaticContact CZ-CG 3.94Å; F1821-F1877 HydrophobicContact CZ-CG 4.05Å; F1821-F1877 AromaticContact CZ-CZ 3.82Å; F1821-F1877 HydrophobicContact CZ-CZ 3.95Å; F1821-L1909 HydrophobicContact CB-CB 4.31Å; F1821-L1909 HydrophobicContact CB-CD2 4.16Å; F1821-L1909 HydrophobicContact CD2-CB 4.24Å; F1821-L1909 HydrophobicContact CD2-CD2 4.11Å; F1821-L1909 WeakPolarHBondContact CD2-O 3.25Å; F1821-L1909 HydrophobicContact CE2-CD2 4.38Å; F1821-L1909 HydrophobicContact CG-CD2 4.1Å; F1821-L1909 PolarHBondContact N-O 3.19Å
1822	S	70	Confident	65.5	Low	20 Å²	20	44.3 Å²	44.3	14%	0.14	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-65.7	-15	-175.4	71.7	0	0	0	0	114.7	H1794 Y1797 D1820 G1824	H1794-S1822 PolarHBondContact CE1-O 2.94Å; H1794-S1822 WeakPolarHBondContact ND1-CB 3.35Å; H1794-S1822 PolarHBondContact ND1-O 3.09Å; Y1797-S1822 WeakPolarHBondContact CA-O 3.15Å; D1820-S1822 VanDerWaalsContact C-N 3.29Å; D1820-S1822 VanDerWaalsContact CG-OG 3.28Å; D1820-S1822 PolarHBondContact O-N 3.01Å; D1820-S1822 VanDerWaalsContact O-N 3.09Å; D1820-S1822 WeakPolarHBondContact OD1-CB 3.37Å; D1820-S1822 PolarHBondContact OD1-N 2.95Å; D1820-S1822 VanDerWaalsContact OD1-N 3.14Å; D1820-S1822 PolarHBondContact OD1-OG 3.04Å; D1820-S1822 PolarHBondContact OD2-OG 3.1Å; D1820-S1822 VanDerWaalsContact OD2-OG 3.08Å; S1822-G1824 VanDerWaalsContact C-N 3.34Å; S1822-G1824 PolarHBondContact O-N 2.82Å
1823	N	71.3	Confident	68.5	Low	43.8 Å²	43.8	41.9 Å²	41.9	23%	0.234	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-111.5	38.5	177.8	-127.8	-8.6	0	0	0	112.8	Y1797 N1802 I1806 L1807 D1820 F1821 T1840	Y1797-N1823 WeakPolarHBondContact CA-OD1 3.33Å; Y1797-N1823 WeakPolarHBondContact CD2-OD1 3.33Å; N1802-N1823 PolarHBondContact ND2-ND2 2.97Å; N1802-N1823 VanDerWaalsContact ND2-ND2 3.14Å; N1802-N1823 PolarHBondContact OD1-ND2 3.25Å; I1806-N1823 VanDerWaalsContact CD1-OD1 3.25Å; I1806-N1823 WeakPolarHBondContact CD1-OD1 3.44Å; L1807-N1823 WeakPolarHBondContact CD2-ND2 3.43Å; D1820-N1823 PolarHBondContact O-N 2.87Å; D1820-N1823 PolarHBondContact OD2-ND2 3.33Å; F1821-N1823 VanDerWaalsContact C-N 3.26Å; F1821-N1823 PolarHBondContact O-N 3.06Å; F1821-N1823 VanDerWaalsContact O-N 3.11Å; N1823-T1840 PolarHBondContact O-N 3.01Å; N1823-T1840 PolarHBondContact O-OG1 3.28Å
1824	G	80.1	Confident	71.4	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	165.9	-179.7	0	0	0	0	0	114.2	H1794 F1821 S1822 F1826 W1837 L1838	H1794-G1824 PolarHBondContact N-O 2.92Å; H1794-G1824 VanDerWaalsContact N-O 3.16Å; F1821-G1824 PolarHBondContact O-N 3.29Å; S1822-G1824 VanDerWaalsContact C-N 3.34Å; S1822-G1824 PolarHBondContact O-N 2.82Å; G1824-F1826 WeakPolarHBondContact O-CE2 3.25Å; G1824-W1837 VanDerWaalsContact CA-NE1 3.27Å; G1824-L1838 CarbonylContact C-O 3.58Å; G1824-L1838 VanDerWaalsContact CA-O 3.32Å; G1824-L1838 WeakPolarHBondContact CA-O 3.37Å
1825	L	90.8	Very high	74.4	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	148.4	167.7	108.8	84.6	0	0	0	109	L1697 L1705 L1712 W1714 I1791 T1792 V1793 Y1797 L1827 W1837 L1838 T1840	L1697-L1825 HydrophobicContact CD1-CD1 4.2Å; L1697-L1825 HydrophobicContact CD2-CD1 4.01Å; L1705-L1825 HydrophobicContact CD2-CD1 3.56Å; L1705-L1825 HydrophobicContact CD2-CD2 4.16Å; L1705-L1825 HydrophobicContact CD2-CG 4.44Å; L1712-L1825 HydrophobicContact CD1-CD1 4.3Å; L1712-L1825 HydrophobicContact CD1-CD2 3.9Å; W1714-L1825 HydrophobicContact CH2-CD2 4.03Å; W1714-L1825 HydrophobicContact CZ2-CD2 4.02Å; W1714-L1825 HydrophobicContact CZ3-CD2 4.18Å; I1791-L1825 HydrophobicContact CB-CD1 4.43Å; I1791-L1825 HydrophobicContact CG2-CD1 4.31Å; T1792-L1825 CarbonylContact O-C 3.5Å; T1792-L1825 WeakPolarHBondContact O-CA 3.38Å; V1793-L1825 HydrophobicContact CG1-CB 3.99Å; V1793-L1825 HydrophobicContact CG1-CD1 3.53Å; V1793-L1825 VanDerWaalsContact CG1-CD1 3.47Å; Y1797-L1825 HydrophobicContact CE2-CB 4.41Å; L1825-L1827 HydrophobicContact CD1-CB 4.34Å; L1825-W1837 CarbonylContact O-C 3.48Å; L1825-W1837 WeakPolarHBondContact O-CA 3.42Å; L1825-L1838 HydrophobicContact CB-CB 4.08Å; L1825-L1838 HydrophobicContact CD1-CB 3.94Å; L1825-L1838 HydrophobicContact CD1-CD1 3.73Å; L1825-L1838 VanDerWaalsContact CD1-CD1 3.45Å; L1825-L1838 HydrophobicContact CD1-CD2 4.07Å; L1825-L1838 HydrophobicContact CD1-CG 3.99Å; L1825-L1838 HydrophobicContact CD2-CB 4.1Å; L1825-L1838 HydrophobicContact CD2-CD1 4.1Å; L1825-L1838 HydrophobicContact CD2-CD2 4.22Å; L1825-L1838 HydrophobicContact CD2-CG 4.47Å; L1825-L1838 HydrophobicContact CG-CB 3.91Å; L1825-L1838 HydrophobicContact CG-CD1 4.22Å; L1825-L1838 HydrophobicContact CG-CD2 4.47Å; L1825-L1838 HydrophobicContact CG-CG 4.35Å; L1825-L1838 PolarHBondContact N-O 3.29Å; L1825-L1838 VanDerWaalsContact N-O 3.16Å; L1825-L1838 PolarHBondContact O-N 2.99Å; L1825-T1840 HydrophobicContact CD2-CG2 3.96Å; L1825-T1840 HydrophobicContact CG-CG2 4.26Å
1826	F	94.2	Very high	77.4	Confident	0 Å²	0	30 Å²	30	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	143.4	176	-54	-90	0	0	0	109.8	I1791 T1792 H1794 F1821 G1824 W1836 W1837 L1849 I1889 A1891 L1896 L1909	I1791-F1826 CarbonylContact C-O 3.51Å; I1791-F1826 VanDerWaalsContact CA-O 3.29Å; I1791-F1826 WeakPolarHBondContact CA-O 3.4Å; T1792-F1826 HydrophobicContact CG2-CB 3.92Å; T1792-F1826 HydrophobicContact CG2-CD2 4.1Å; T1792-F1826 HydrophobicContact CG2-CG 4.45Å; T1792-F1826 PolarHBondContact N-O 3.11Å; T1792-F1826 PolarHBondContact O-N 3.09Å; H1794-F1826 HydrophobicContact CB-CE2 4.35Å; F1821-F1826 HydrophobicContact CB-CE1 4.35Å; F1821-F1826 HydrophobicContact CB-CZ 3.91Å; F1821-F1826 AromaticContact CD1-CE1 3.95Å; F1821-F1826 HydrophobicContact CD1-CE1 4.03Å; F1821-F1826 HydrophobicContact CD1-CZ 4.26Å; F1821-F1826 HydrophobicContact CG-CE1 4.35Å; F1821-F1826 HydrophobicContact CG-CZ 4.24Å; G1824-F1826 WeakPolarHBondContact O-CE2 3.25Å; F1826-W1836 CarbonylContact C-O 3.53Å; F1826-W1836 VanDerWaalsContact CA-O 3.31Å; F1826-W1836 WeakPolarHBondContact CA-O 3.35Å; F1826-W1837 HydrophobicContact CD1-CB 4.18Å; F1826-W1837 AromaticContact CD1-CD1 3.9Å; F1826-W1837 HydrophobicContact CD1-CG 4.39Å; F1826-W1837 HydrophobicContact CE1-CB 4.32Å; F1826-W1837 AromaticContact CE1-CD1 3.67Å; F1826-W1837 HydrophobicContact CE1-CG 4.25Å; F1826-W1837 AromaticContact CZ-CD1 4Å; F1826-L1849 HydrophobicContact CD1-CD1 3.57Å; F1826-L1849 HydrophobicContact CD1-CD2 4.03Å; F1826-L1849 HydrophobicContact CE1-CD1 3.8Å; F1826-L1849 HydrophobicContact CE1-CD2 4.16Å; F1826-I1889 HydrophobicContact CB-CD1 3.97Å; F1826-A1891 HydrophobicContact CD2-CB 4.14Å; F1826-A1891 HydrophobicContact CE2-CB 3.96Å; F1826-L1896 HydrophobicContact CB-CD1 4.04Å; F1826-L1896 HydrophobicContact CB-CD2 4.48Å; F1826-L1896 HydrophobicContact CD1-CD1 4.1Å; F1826-L1896 HydrophobicContact CD1-CD2 3.78Å; F1826-L1896 HydrophobicContact CD1-CG 4.49Å; F1826-L1896 HydrophobicContact CD2-CD1 3.85Å; F1826-L1896 HydrophobicContact CE1-CD1 4.41Å; F1826-L1896 HydrophobicContact CE1-CD2 4.15Å; F1826-L1896 HydrophobicContact CE2-CD1 4.28Å; F1826-L1896 HydrophobicContact CG-CD1 3.73Å; F1826-L1896 HydrophobicContact CG-CD2 4.2Å; F1826-L1896 HydrophobicContact CZ-CD1 4.43Å; F1826-L1909 HydrophobicContact CE1-CD2 3.72Å; F1826-L1909 HydrophobicContact CE2-CD1 4.25Å; F1826-L1909 HydrophobicContact CE2-CD2 4.38Å; F1826-L1909 HydrophobicContact CZ-CD1 3.96Å; F1826-L1909 HydrophobicContact CZ-CD2 3.53Å; F1826-L1909 VanDerWaalsContact CZ-CD2 3.47Å; F1826-L1909 HydrophobicContact CZ-CG 4.31Å
1827	L	95.1	Very high	80.2	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	125.2	-178.7	-175.6	154.7	0	0	0	109.8	L1774 F1776 L1777 Y1789 F1790 I1791 L1825 H1829 I1835 W1836 L1838	L1774-L1827 HydrophobicContact CD1-CD1 4.17Å; L1774-L1827 HydrophobicContact CD2-CD1 4.16Å; F1776-L1827 HydrophobicContact CZ-CD1 4.46Å; L1777-L1827 HydrophobicContact CD1-CD1 4.24Å; L1777-L1827 HydrophobicContact CD1-CD2 3.91Å; L1777-L1827 HydrophobicContact CD2-CD2 4.08Å; Y1789-L1827 HydrophobicContact CD2-CD1 3.97Å; Y1789-L1827 HydrophobicContact CD2-CG 4.28Å; Y1789-L1827 HydrophobicContact CE2-CD1 4.36Å; Y1789-L1827 HydrophobicContact CG-CD1 4.36Å; Y1789-L1827 HydrophobicContact CG-CG 4.5Å; F1790-L1827 CarbonylContact O-C 3.53Å; F1790-L1827 WeakPolarHBondContact O-CA 3.25Å; I1791-L1827 HydrophobicContact CG2-CB 4.1Å; I1791-L1827 HydrophobicContact CG2-CD1 3.9Å; I1791-L1827 HydrophobicContact CG2-CG 3.95Å; L1825-L1827 HydrophobicContact CD1-CB 4.34Å; L1827-H1829 HydrophobicContact CD2-CB 3.86Å; L1827-I1835 CarbonylContact O-C 3.56Å; L1827-I1835 VanDerWaalsContact O-CA 3.3Å; L1827-I1835 WeakPolarHBondContact O-CA 3.41Å; L1827-W1836 HydrophobicContact CB-CB 4.45Å; L1827-W1836 PolarHBondContact N-O 3.14Å; L1827-W1836 PolarHBondContact O-N 3.05Å; L1827-L1838 HydrophobicContact CB-CD1 4.05Å; L1827-L1838 HydrophobicContact CD1-CD1 4.29Å
1828	S	95.5	Very high	82.9	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	127.5	170.4	94.8	0	0	0	0	109.3	Y1789 F1790 P1886 K1887 I1889	Y1789-S1828 CarbonylContact C-O 3.41Å; Y1789-S1828 WeakPolarHBondContact CA-O 3.25Å; Y1789-S1828 VanDerWaalsContact CB-O 3.3Å; Y1789-S1828 WeakPolarHBondContact CB-O 3.42Å; F1790-S1828 WeakPolarHBondContact CB-OG 3.36Å; F1790-S1828 PolarHBondContact N-O 3.26Å; F1790-S1828 PolarHBondContact O-N 2.92Å; F1790-S1828 PolarHBondContact O-OG 3.12Å; S1828-P1886 WeakPolarHBondContact OG-CB 3.35Å; S1828-K1887 WeakPolarHBondContact CB-O 3.31Å; S1828-K1887 PolarHBondContact OG-N 2.78Å; S1828-K1887 PolarHBondContact OG-O 2.92Å; S1828-I1889 WeakPolarHBondContact OG-CG2 3.42Å
1829	H	93.6	Very high	84.7	Confident	1.2 Å²	1.2	24 Å²	24	1%	0.006	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	117.1	-178.2	-174.6	-140.7	0	0	0	111.5	L1777 F1781 T1787 T1788 L1827 S1831 S1832 K1833 T1834 P1886	L1777-H1829 HydrophobicContact CD1-CB 4.35Å; L1777-H1829 HydrophobicContact CD2-CB 3.94Å; F1781-H1829 AromaticContact CE1-NE2 3.95Å; T1787-H1829 PolarHBondContact OG1-NE2 2.8Å; T1788-H1829 PolarHBondContact O-CD2 3.03Å; L1827-H1829 HydrophobicContact CD2-CB 3.86Å; H1829-S1831 PolarHBondContact CE1-OG 2.98Å; H1829-S1831 PolarHBondContact NE2-OG 2.87Å; H1829-S1831 PolarHBondContact O-N 3.34Å; H1829-S1832 WeakPolarHBondContact CB-OG 3.37Å; H1829-S1832 VanDerWaalsContact ND1-CB 3.31Å; H1829-S1832 WeakPolarHBondContact ND1-CB 3.3Å; H1829-S1832 PolarHBondContact ND1-N 3.43Å; H1829-S1832 PolarHBondContact ND1-OG 3.16Å; H1829-S1832 PolarHBondContact O-OG 3.07Å; H1829-K1833 PolarHBondContact O-N 2.8Å; H1829-K1833 VanDerWaalsContact O-N 3.13Å; H1829-T1834 PolarHBondContact N-O 3.17Å; H1829-T1834 PolarHBondContact O-N 3.07Å; H1829-P1886 WeakPolarHBondContact O-CG 3.37Å
1830	T	91.6	Very high	85.8	Confident	25.8 Å²	25.8	23.8 Å²	23.8	16%	0.158	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-44.2	-169.3	-48.7	0	0	0	0	112.8	T1788 K1833 S1885 P1886	T1788-T1830 WeakPolarHBondContact O-CB 3.35Å; T1788-T1830 PolarHBondContact O-N 3.08Å; T1788-T1830 VanDerWaalsContact O-N 3.1Å; T1788-T1830 PolarHBondContact O-OG1 3.01Å; T1788-T1830 VanDerWaalsContact OG1-CB 3.28Å; T1788-T1830 WeakPolarHBondContact OG1-CB 3.44Å; T1788-T1830 PolarHBondContact OG1-OG1 3.03Å; T1788-T1830 VanDerWaalsContact OG1-OG1 3.13Å; T1830-K1833 PolarHBondContact O-N 2.87Å; T1830-S1885 WeakPolarHBondContact CG2-OG 3.42Å; T1830-P1886 WeakPolarHBondContact CA-O 3.32Å; T1830-P1886 WeakPolarHBondContact CB-O 3.35Å; T1830-P1886 PolarHBondContact OG1-O 3.11Å; T1830-P1886 VanDerWaalsContact OG1-O 3.11Å
1831	S	88.5	Confident	86	Confident	66.4 Å²	66.4	21.3 Å²	21.3	46%	0.464	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-43	-173.7	46.7	0	0	0	0	112.9	T1787 H1829 K1833	T1787-S1831 WeakPolarHBondContact CB-OG 3.42Å; T1787-S1831 VanDerWaalsContact OG1-CB 3.3Å; T1787-S1831 WeakPolarHBondContact OG1-CB 3.49Å; T1787-S1831 PolarHBondContact OG1-OG 2.87Å; H1829-S1831 PolarHBondContact CE1-OG 2.98Å; H1829-S1831 PolarHBondContact NE2-OG 2.87Å; H1829-S1831 PolarHBondContact O-N 3.34Å; S1831-K1833 VanDerWaalsContact C-N 3.28Å; S1831-K1833 PolarHBondContact O-N 3.03Å
1832	S	88.5	Confident	85.5	Confident	43.6 Å²	43.6	24 Å²	24	31%	0.305	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-7.3	174.8	67.3	0	0	0	0	113.3	H1829 T1834	H1829-S1832 WeakPolarHBondContact CB-OG 3.37Å; H1829-S1832 VanDerWaalsContact ND1-CB 3.31Å; H1829-S1832 WeakPolarHBondContact ND1-CB 3.3Å; H1829-S1832 PolarHBondContact ND1-N 3.43Å; H1829-S1832 PolarHBondContact ND1-OG 3.16Å; H1829-S1832 PolarHBondContact O-OG 3.07Å; S1832-T1834 VanDerWaalsContact C-N 3.29Å; S1832-T1834 WeakPolarHBondContact CB-OG1 3.48Å; S1832-T1834 WeakPolarHBondContact O-CG2 3.39Å; S1832-T1834 PolarHBondContact O-N 3.14Å; S1832-T1834 PolarHBondContact O-OG1 3.04Å; S1832-T1834 VanDerWaalsContact O-OG1 3.14Å; S1832-T1834 PolarHBondContact OG-OG1 3.07Å
1833	K	92.5	Very high	85.5	Confident	96.4 Å²	96.4	28.3 Å²	28.3	42%	0.419	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	54	43.7	-180	-61.4	168.1	173.8	-176.6	0	112.8	H1829 T1830 S1831 L1883 K1884	H1829-K1833 PolarHBondContact O-N 2.8Å; H1829-K1833 VanDerWaalsContact O-N 3.13Å; T1830-K1833 PolarHBondContact O-N 2.87Å; S1831-K1833 VanDerWaalsContact C-N 3.28Å; S1831-K1833 PolarHBondContact O-N 3.03Å; K1833-L1883 HydrophobicContact CB-CB 4.32Å; K1833-L1883 WeakPolarHBondContact CB-O 3.35Å; K1833-L1883 VanDerWaalsContact CD-O 3.28Å; K1833-L1883 WeakPolarHBondContact CD-O 3.36Å; K1833-L1883 WeakPolarHBondContact CG-O 3.33Å; K1833-K1884 WeakPolarHBondContact CE-O 3.26Å
1834	T	93.3	Very high	85.9	Confident	10.8 Å²	10.8	27.9 Å²	27.9	7%	0.066	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	154.8	-175	49	0	0	0	0	112.2	H1829 S1832 W1836 L1848 I1850	H1829-T1834 PolarHBondContact N-O 3.17Å; H1829-T1834 PolarHBondContact O-N 3.07Å; S1832-T1834 VanDerWaalsContact C-N 3.29Å; S1832-T1834 WeakPolarHBondContact CB-OG1 3.48Å; S1832-T1834 WeakPolarHBondContact O-CG2 3.39Å; S1832-T1834 PolarHBondContact O-N 3.14Å; S1832-T1834 PolarHBondContact O-OG1 3.04Å; S1832-T1834 VanDerWaalsContact O-OG1 3.14Å; S1832-T1834 PolarHBondContact OG-OG1 3.07Å; T1834-W1836 PolarHBondContact OG1-NE1 2.98Å; T1834-W1836 VanDerWaalsContact OG1-NE1 3.14Å; T1834-L1848 HydrophobicContact CG2-CD1 3.61Å; T1834-L1848 VanDerWaalsContact CG2-CD1 3.44Å; T1834-I1850 CarbonylContact C-O 3.5Å; T1834-I1850 VanDerWaalsContact CA-O 3.27Å; T1834-I1850 WeakPolarHBondContact CA-O 3.32Å
1835	I	94.2	Very high	85.9	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	133.3	170.9	-63.3	169.7	0	0	0	108.1	L1827 L1849 I1850 L1883 P1886 I1889 L1896 F1898	L1827-I1835 CarbonylContact O-C 3.56Å; L1827-I1835 VanDerWaalsContact O-CA 3.3Å; L1827-I1835 WeakPolarHBondContact O-CA 3.41Å; I1835-L1849 HydrophobicContact CG2-CB 4.46Å; I1835-L1849 HydrophobicContact CG2-CD1 4.37Å; I1835-L1849 HydrophobicContact CG2-CD2 4.36Å; I1835-L1849 WeakPolarHBondContact O-CA 3.3Å; I1835-L1849 VanDerWaalsContact O-CB 3.31Å; I1835-L1849 WeakPolarHBondContact O-CB 3.37Å; I1835-L1849 PolarHBondContact O-N 2.96Å; I1835-I1850 HydrophobicContact CB-CB 4.12Å; I1835-I1850 HydrophobicContact CB-CG1 4.34Å; I1835-I1850 HydrophobicContact CD1-CD1 4.09Å; I1835-I1850 PolarHBondContact N-O 3.11Å; I1835-I1850 PolarHBondContact O-N 3.25Å; I1835-L1883 HydrophobicContact CD1-CD1 3.96Å; I1835-L1883 HydrophobicContact CG1-CD1 3.92Å; I1835-P1886 HydrophobicContact CD1-CB 4.49Å; I1835-P1886 HydrophobicContact CG1-CB 4.44Å; I1835-I1889 HydrophobicContact CG2-CD1 3.79Å; I1835-L1896 HydrophobicContact CG2-CD2 4.42Å; I1835-F1898 HydrophobicContact CD1-CB 4Å; I1835-F1898 HydrophobicContact CD1-CD1 3.9Å; I1835-F1898 HydrophobicContact CD1-CD2 3.43Å; I1835-F1898 VanDerWaalsContact CD1-CD2 3.44Å; I1835-F1898 HydrophobicContact CD1-CE1 4.19Å; I1835-F1898 HydrophobicContact CD1-CE2 3.74Å; I1835-F1898 HydrophobicContact CD1-CG 3.5Å; I1835-F1898 VanDerWaalsContact CD1-CG 3.47Å; I1835-F1898 HydrophobicContact CD1-CZ 4.1Å
1836	W	92.4	Very high	85.7	Confident	29 Å²	29	31 Å²	31	11%	0.11	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	149.9	-173.9	-62.4	80.2	0	0	0	110.8	F1776 F1826 L1827 T1834 L1838 A1846 H1847 L1848 P1857	F1776-W1836 AromaticContact CD2-CD2 3.69Å; F1776-W1836 HydrophobicContact CD2-CD2 3.69Å; F1776-W1836 AromaticContact CD2-CE2 3.83Å; F1776-W1836 AromaticContact CD2-CE3 3.69Å; F1776-W1836 HydrophobicContact CD2-CE3 3.69Å; F1776-W1836 HydrophobicContact CD2-CG 4.33Å; F1776-W1836 AromaticContact CD2-CH2 3.92Å; F1776-W1836 HydrophobicContact CD2-CH2 4.03Å; F1776-W1836 AromaticContact CD2-CZ2 3.89Å; F1776-W1836 HydrophobicContact CD2-CZ2 4.01Å; F1776-W1836 AromaticContact CD2-CZ3 3.87Å; F1776-W1836 HydrophobicContact CD2-CZ3 3.87Å; F1776-W1836 HydrophobicContact CE2-CB 4.21Å; F1776-W1836 AromaticContact CE2-CD1 3.93Å; F1776-W1836 AromaticContact CE2-CD2 3.54Å; F1776-W1836 HydrophobicContact CE2-CD2 3.54Å; F1776-W1836 VanDerWaalsContact CE2-CD2 3.41Å; F1776-W1836 AromaticContact CE2-CE2 3.88Å; F1776-W1836 AromaticContact CE2-CE3 3.86Å; F1776-W1836 HydrophobicContact CE2-CE3 3.86Å; F1776-W1836 AromaticContact CE2-CG 3.69Å; F1776-W1836 HydrophobicContact CE2-CG 3.69Å; F1776-W1836 HydrophobicContact CE2-CZ2 4.43Å; F1776-W1836 HydrophobicContact CE2-CZ3 4.45Å; F1776-W1836 HydrophobicContact CG-CZ3 4.49Å; F1826-W1836 CarbonylContact C-O 3.53Å; F1826-W1836 VanDerWaalsContact CA-O 3.31Å; F1826-W1836 WeakPolarHBondContact CA-O 3.35Å; L1827-W1836 HydrophobicContact CB-CB 4.45Å; L1827-W1836 PolarHBondContact N-O 3.14Å; L1827-W1836 PolarHBondContact O-N 3.05Å; T1834-W1836 PolarHBondContact OG1-NE1 2.98Å; T1834-W1836 VanDerWaalsContact OG1-NE1 3.14Å; W1836-L1838 HydrophobicContact CB-CD1 3.98Å; W1836-L1838 HydrophobicContact CB-CD2 4.21Å; W1836-A1846 HydrophobicContact CE3-CB 4.1Å; W1836-A1846 HydrophobicContact CZ3-CB 4.42Å; W1836-H1847 CarbonylContact C-O 3.53Å; W1836-H1847 WeakPolarHBondContact CA-O 3.25Å; W1836-H1847 VanDerWaalsContact CE3-C 3.47Å; W1836-L1848 HydrophobicContact CD2-CB 4.46Å; W1836-L1848 HydrophobicContact CD2-CD1 4.16Å; W1836-L1848 HydrophobicContact CE3-CB 4.08Å; W1836-L1848 HydrophobicContact CE3-CD1 4.47Å; W1836-L1848 VanDerWaalsContact CE3-N 3.34Å; W1836-L1848 HydrophobicContact CH2-CB 4.08Å; W1836-L1848 HydrophobicContact CH2-CD1 4.37Å; W1836-L1848 HydrophobicContact CZ2-CB 4.38Å; W1836-L1848 HydrophobicContact CZ2-CD1 3.93Å; W1836-L1848 HydrophobicContact CZ3-CB 3.87Å; W1836-P1857 HydrophobicContact CH2-CG 3.97Å; W1836-P1857 HydrophobicContact CZ3-CG 4.36Å
1837	W	90	Very high	85.3	Confident	8.6 Å²	8.6	33.4 Å²	33.4	3%	0.033	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	126.5	164.2	172.7	65.1	0	0	0	108.7	D1820 F1821 G1824 L1825 F1826 K1839 H1847 L1849 Y1874	D1820-W1837 WeakPolarHBondContact O-CZ2 3.39Å; F1821-W1837 HydrophobicContact CD1-CB 4.41Å; F1821-W1837 AromaticContact CD1-CD1 3.83Å; F1821-W1837 AromaticContact CD1-CD2 3.75Å; F1821-W1837 HydrophobicContact CD1-CD2 3.75Å; F1821-W1837 AromaticContact CD1-CE2 3.8Å; F1821-W1837 HydrophobicContact CD1-CE3 4.27Å; F1821-W1837 AromaticContact CD1-CG 3.81Å; F1821-W1837 HydrophobicContact CD1-CG 3.81Å; F1821-W1837 HydrophobicContact CD1-CZ2 4.34Å; F1821-W1837 AromaticContact CD1-NE1 3.8Å; F1821-W1837 HydrophobicContact CE1-CB 4.36Å; F1821-W1837 AromaticContact CE1-CD2 3.89Å; F1821-W1837 HydrophobicContact CE1-CD2 3.97Å; F1821-W1837 AromaticContact CE1-CE3 3.94Å; F1821-W1837 HydrophobicContact CE1-CE3 4.06Å; F1821-W1837 HydrophobicContact CE1-CG 4.11Å; F1821-W1837 HydrophobicContact CE1-CZ3 4.42Å; F1821-W1837 PolarHBondContact O-NE1 3.4Å; G1824-W1837 VanDerWaalsContact CA-NE1 3.27Å; L1825-W1837 CarbonylContact O-C 3.48Å; L1825-W1837 WeakPolarHBondContact O-CA 3.42Å; F1826-W1837 HydrophobicContact CD1-CB 4.18Å; F1826-W1837 AromaticContact CD1-CD1 3.9Å; F1826-W1837 HydrophobicContact CD1-CG 4.39Å; F1826-W1837 HydrophobicContact CE1-CB 4.32Å; F1826-W1837 AromaticContact CE1-CD1 3.67Å; F1826-W1837 HydrophobicContact CE1-CG 4.25Å; F1826-W1837 AromaticContact CZ-CD1 4Å; W1837-K1839 HydrophobicContact CH2-CB 3.97Å; W1837-K1839 HydrophobicContact CH2-CD 4.24Å; W1837-K1839 HydrophobicContact CH2-CG 4.35Å; W1837-K1839 HydrophobicContact CZ2-CB 4.15Å; W1837-K1839 HydrophobicContact CZ2-CD 4.47Å; W1837-K1839 HydrophobicContact CZ2-CG 4.37Å; W1837-K1839 HydrophobicContact CZ3-CB 4.21Å; W1837-K1839 HydrophobicContact CZ3-CD 4.46Å; W1837-H1847 HydrophobicContact CE3-CB 4.09Å; W1837-H1847 AromaticContact CE3-CD2 3.76Å; W1837-H1847 VanDerWaalsContact CE3-CD2 3.49Å; W1837-H1847 AromaticContact CE3-CG 3.94Å; W1837-H1847 AromaticContact CZ3-CD2 3.73Å; W1837-H1847 PolarHBondContact N-O 3.11Å; W1837-H1847 PolarHBondContact O-N 2.91Å; W1837-L1849 HydrophobicContact CB-CD1 3.64Å; W1837-L1849 HydrophobicContact CB-CD2 3.99Å; W1837-L1849 HydrophobicContact CB-CG 3.72Å; W1837-Y1874 HydrophobicContact CE3-CD1 4.25Å; W1837-Y1874 HydrophobicContact CE3-CE1 4.27Å; W1837-Y1874 HydrophobicContact CH2-CD1 4.2Å; W1837-Y1874 AromaticContact CH2-CE1 3.52Å; W1837-Y1874 HydrophobicContact CH2-CE1 3.52Å; W1837-Y1874 VanDerWaalsContact CH2-CE1 3.42Å; W1837-Y1874 AromaticContact CH2-CZ 3.74Å; W1837-Y1874 WeakPolarHBondContact CH2-OH 3.34Å; W1837-Y1874 AromaticContact CZ3-CD1 3.55Å; W1837-Y1874 HydrophobicContact CZ3-CD1 3.55Å; W1837-Y1874 VanDerWaalsContact CZ3-CD1 3.44Å; W1837-Y1874 HydrophobicContact CZ3-CD2 4.36Å; W1837-Y1874 AromaticContact CZ3-CE1 3.23Å; W1837-Y1874 HydrophobicContact CZ3-CE1 3.23Å; W1837-Y1874 HydrophobicContact CZ3-CE2 4.3Å; W1837-Y1874 AromaticContact CZ3-CG 3.98Å; W1837-Y1874 HydrophobicContact CZ3-CG 4.1Å; W1837-Y1874 AromaticContact CZ3-CZ 3.65Å
1838	L	88.3	Confident	85	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	113.6	179.5	-62.7	110.7	0	0	0	108.5	L1712 Y1772 L1774 F1776 G1824 L1825 L1827 W1836 L1844 S1845 A1846	L1712-L1838 HydrophobicContact CD1-CD1 3.94Å; L1712-L1838 HydrophobicContact CD1-CD2 3.94Å; Y1772-L1838 HydrophobicContact CD1-CD2 4.32Å; Y1772-L1838 HydrophobicContact CE1-CD2 4.07Å; L1774-L1838 HydrophobicContact CD2-CD1 4.19Å; L1774-L1838 HydrophobicContact CD2-CD2 4.22Å; F1776-L1838 HydrophobicContact CE1-CD1 4.09Å; F1776-L1838 HydrophobicContact CE1-CD2 3.99Å; F1776-L1838 HydrophobicContact CE1-CG 4.25Å; F1776-L1838 HydrophobicContact CE2-CD2 4.12Å; F1776-L1838 HydrophobicContact CZ-CD1 3.97Å; F1776-L1838 HydrophobicContact CZ-CD2 3.79Å; F1776-L1838 HydrophobicContact CZ-CG 4.12Å; G1824-L1838 CarbonylContact C-O 3.58Å; G1824-L1838 VanDerWaalsContact CA-O 3.32Å; G1824-L1838 WeakPolarHBondContact CA-O 3.37Å; L1825-L1838 HydrophobicContact CB-CB 4.08Å; L1825-L1838 HydrophobicContact CD1-CB 3.94Å; L1825-L1838 HydrophobicContact CD1-CD1 3.73Å; L1825-L1838 VanDerWaalsContact CD1-CD1 3.45Å; L1825-L1838 HydrophobicContact CD1-CD2 4.07Å; L1825-L1838 HydrophobicContact CD1-CG 3.99Å; L1825-L1838 HydrophobicContact CD2-CB 4.1Å; L1825-L1838 HydrophobicContact CD2-CD1 4.1Å; L1825-L1838 HydrophobicContact CD2-CD2 4.22Å; L1825-L1838 HydrophobicContact CD2-CG 4.47Å; L1825-L1838 HydrophobicContact CG-CB 3.91Å; L1825-L1838 HydrophobicContact CG-CD1 4.22Å; L1825-L1838 HydrophobicContact CG-CD2 4.47Å; L1825-L1838 HydrophobicContact CG-CG 4.35Å; L1825-L1838 PolarHBondContact N-O 3.29Å; L1825-L1838 VanDerWaalsContact N-O 3.16Å; L1825-L1838 PolarHBondContact O-N 2.99Å; L1827-L1838 HydrophobicContact CB-CD1 4.05Å; L1827-L1838 HydrophobicContact CD1-CD1 4.29Å; W1836-L1838 HydrophobicContact CB-CD1 3.98Å; W1836-L1838 HydrophobicContact CB-CD2 4.21Å; L1838-L1844 HydrophobicContact CB-CD1 3.97Å; L1838-L1844 HydrophobicContact CD1-CD1 4.17Å; L1838-L1844 HydrophobicContact CD2-CD1 4.29Å; L1838-L1844 HydrophobicContact CD2-CD2 4.37Å; L1838-S1845 CarbonylContact C-O 3.32Å; L1838-S1845 WeakPolarHBondContact CA-O 3.41Å; L1838-A1846 HydrophobicContact CD1-CB 4.41Å; L1838-A1846 HydrophobicContact CD2-CB 3.47Å; L1838-A1846 VanDerWaalsContact CD2-CB 3.47Å; L1838-A1846 HydrophobicContact CG-CB 4.13Å
1839	K	81.5	Confident	84.6	Confident	58.6 Å²	58.6	35 Å²	35	26%	0.255	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	124	169.6	178.2	177.7	178.2	173.9	0	108	W1837 T1841 L1844 S1845 Y1874	W1837-K1839 HydrophobicContact CH2-CB 3.97Å; W1837-K1839 HydrophobicContact CH2-CD 4.24Å; W1837-K1839 HydrophobicContact CH2-CG 4.35Å; W1837-K1839 HydrophobicContact CZ2-CB 4.15Å; W1837-K1839 HydrophobicContact CZ2-CD 4.47Å; W1837-K1839 HydrophobicContact CZ2-CG 4.37Å; W1837-K1839 HydrophobicContact CZ3-CB 4.21Å; W1837-K1839 HydrophobicContact CZ3-CD 4.46Å; K1839-T1841 HydrophobicContact CD-CG2 4.2Å; K1839-T1841 WeakPolarHBondContact CE-O 3.4Å; K1839-T1841 HydrophobicContact CG-CG2 4.01Å; K1839-T1841 WeakPolarHBondContact CG-O 3.47Å; K1839-T1841 PolarHBondContact O-N 2.87Å; K1839-L1844 CarbonylContact O-C 3.53Å; K1839-L1844 VanDerWaalsContact O-CA 3.25Å; K1839-L1844 WeakPolarHBondContact O-CA 3.37Å; K1839-S1845 WeakPolarHBondContact CB-OG 3.3Å; K1839-S1845 PolarHBondContact N-O 3Å; K1839-S1845 PolarHBondContact O-N 3.09Å; K1839-S1845 PolarHBondContact O-OG 2.9Å; K1839-Y1874 HydrophobicContact CD-CE2 4.4Å; K1839-Y1874 PolarHBondContact NZ-OH 2.98Å
1840	T	74.7	Confident	84.5	Confident	7.8 Å²	7.8	35 Å²	35	5%	0.048	20%	0.197	C	C	.	.			trans	-98.4	-0.8	-174.9	56.1	0	0	0	0	113.5	W1714 Y1772 Y1797 N1823 L1825 L1844	W1714-T1840 HydrophobicContact CH2-CG2 4.4Å; W1714-T1840 HydrophobicContact CZ2-CG2 4.08Å; W1714-T1840 HydrophobicContact CZ3-CG2 4.03Å; Y1772-T1840 HydrophobicContact CE2-CG2 3.85Å; Y1772-T1840 PolarHBondContact OH-O 2.84Å; Y1797-T1840 HydrophobicContact CE2-CG2 4.12Å; Y1797-T1840 WeakPolarHBondContact CE2-OG1 3.47Å; Y1797-T1840 WeakPolarHBondContact OH-CB 3.37Å; Y1797-T1840 VanDerWaalsContact OH-CG2 3.29Å; Y1797-T1840 WeakPolarHBondContact OH-CG2 3.35Å; Y1797-T1840 PolarHBondContact OH-OG1 3.01Å; N1823-T1840 PolarHBondContact O-N 3.01Å; N1823-T1840 PolarHBondContact O-OG1 3.28Å; L1825-T1840 HydrophobicContact CD2-CG2 3.96Å; L1825-T1840 HydrophobicContact CG-CG2 4.26Å; T1840-L1844 HydrophobicContact CG2-CD1 3.89Å; T1840-L1844 VanDerWaalsContact CG2-CD1 3.47Å; T1840-L1844 HydrophobicContact CG2-CG 4.34Å
1841	T	68.1	Low	84.4	Confident	26.8 Å²	26.8	33.8 Å²	33.8	16%	0.164	19%	0.189	C	C	.	.	S	Bend	trans	-123.1	148.2	178.7	60.5	0	0	0	0	110.7	Y1772 Y1799 H1800 L1807 K1839 N1843	Y1772-T1841 PolarHBondContact OH-O 2.63Å; Y1799-T1841 HydrophobicContact CE2-CG2 4.36Å; H1800-T1841 VanDerWaalsContact O-CG2 3.31Å; H1800-T1841 WeakPolarHBondContact O-CG2 3.32Å; L1807-T1841 HydrophobicContact CD1-CG2 4.2Å; K1839-T1841 HydrophobicContact CD-CG2 4.2Å; K1839-T1841 WeakPolarHBondContact CE-O 3.4Å; K1839-T1841 HydrophobicContact CG-CG2 4.01Å; K1839-T1841 WeakPolarHBondContact CG-O 3.47Å; K1839-T1841 PolarHBondContact O-N 2.87Å; T1841-N1843 CarbonylContact C-O 3.59Å; T1841-N1843 PolarHBondContact N-O 2.8Å; T1841-N1843 CarbonylContact O-C 3.59Å; T1841-N1843 PolarHBondContact O-N 3.45Å; T1841-N1843 VanDerWaalsContact O-O 3.11Å; T1841-N1843 PolarHBondContact OG1-N 3.2Å; T1841-N1843 PolarHBondContact OG1-O 2.87Å
1842	P	60.7	Low	84.3	Confident	64.6 Å²	64.6	36.2 Å²	36.2	42%	0.419	19%	0.193	S	C	.	.	S	Bend	cis	-71.4	-24.4	-3.9	29.4	-34.9	0	0	0	113.3	Y1804	Y1804-P1842 HydrophobicContact CD1-CB 4.17Å; Y1804-P1842 HydrophobicContact CD1-CG 4.42Å; Y1804-P1842 HydrophobicContact CE1-CB 3.8Å; Y1804-P1842 HydrophobicContact CE1-CG 3.89Å; Y1804-P1842 HydrophobicContact CE2-CB 3.95Å; Y1804-P1842 VanDerWaalsContact OH-CB 3.27Å; Y1804-P1842 WeakPolarHBondContact OH-CB 3.31Å; Y1804-P1842 WeakPolarHBondContact OH-CG 2.96Å
1843	N	71	Confident	84	Confident	110.8 Å²	110.8	40 Å²	40	59%	0.593	21%	0.21	S	C	*	.	S	Bend	trans	-120.2	147.2	172.3	-69.1	-35.9	0	0	0	109.8	T1841 S1845	T1841-N1843 CarbonylContact C-O 3.59Å; T1841-N1843 PolarHBondContact N-O 2.8Å; T1841-N1843 CarbonylContact O-C 3.59Å; T1841-N1843 PolarHBondContact O-N 3.45Å; T1841-N1843 VanDerWaalsContact O-O 3.11Å; T1841-N1843 PolarHBondContact OG1-N 3.2Å; T1841-N1843 PolarHBondContact OG1-O 2.87Å; N1843-S1845 PolarHBondContact O-N 3.01Å
1844	L	78.6	Confident	83.3	Confident	34.6 Å²	34.6	36 Å²	36	18%	0.181	19%	0.194	C	C	.	.			trans	-67	120.7	175.1	-156.5	83	0	0	0	110.6	W1714 Y1772 L1774 F1776 L1838 K1839 T1840	W1714-L1844 HydrophobicContact CH2-CD1 3.83Å; W1714-L1844 HydrophobicContact CH2-CD2 4Å; W1714-L1844 HydrophobicContact CZ2-CD1 3.99Å; Y1772-L1844 HydrophobicContact CD1-CB 3.65Å; Y1772-L1844 HydrophobicContact CD1-CD2 3.78Å; Y1772-L1844 HydrophobicContact CD1-CG 4.37Å; Y1772-L1844 HydrophobicContact CD2-CB 4.29Å; Y1772-L1844 HydrophobicContact CD2-CD1 4.36Å; Y1772-L1844 HydrophobicContact CD2-CD2 3.79Å; Y1772-L1844 HydrophobicContact CD2-CG 4.34Å; Y1772-L1844 HydrophobicContact CE1-CB 3.79Å; Y1772-L1844 VanDerWaalsContact CE1-CB 3.47Å; Y1772-L1844 HydrophobicContact CE1-CD2 3.92Å; Y1772-L1844 HydrophobicContact CE1-CG 4.46Å; Y1772-L1844 HydrophobicContact CE2-CB 4.34Å; Y1772-L1844 HydrophobicContact CE2-CD2 3.52Å; Y1772-L1844 HydrophobicContact CE2-CG 4.45Å; Y1772-L1844 HydrophobicContact CG-CB 4.04Å; Y1772-L1844 HydrophobicContact CG-CD1 4.46Å; Y1772-L1844 HydrophobicContact CG-CD2 3.62Å; Y1772-L1844 HydrophobicContact CG-CG 4.39Å; L1774-L1844 HydrophobicContact CD2-CD2 4.28Å; F1776-L1844 HydrophobicContact CE1-CD2 4.27Å; L1838-L1844 HydrophobicContact CB-CD1 3.97Å; L1838-L1844 HydrophobicContact CD1-CD1 4.17Å; L1838-L1844 HydrophobicContact CD2-CD1 4.29Å; L1838-L1844 HydrophobicContact CD2-CD2 4.37Å; K1839-L1844 CarbonylContact O-C 3.53Å; K1839-L1844 VanDerWaalsContact O-CA 3.25Å; K1839-L1844 WeakPolarHBondContact O-CA 3.37Å; T1840-L1844 HydrophobicContact CG2-CD1 3.89Å; T1840-L1844 VanDerWaalsContact CG2-CD1 3.47Å; T1840-L1844 HydrophobicContact CG2-CG 4.34Å
1845	S	81.7	Confident	82.1	Confident	40.2 Å²	40.2	42.9 Å²	42.9	28%	0.281	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	131.9	171.4	59.9	0	0	0	0	110.7	L1838 K1839 N1843 H1847	L1838-S1845 CarbonylContact C-O 3.32Å; L1838-S1845 WeakPolarHBondContact CA-O 3.41Å; K1839-S1845 WeakPolarHBondContact CB-OG 3.3Å; K1839-S1845 PolarHBondContact N-O 3Å; K1839-S1845 PolarHBondContact O-N 3.09Å; K1839-S1845 PolarHBondContact O-OG 2.9Å; N1843-S1845 PolarHBondContact O-N 3.01Å; S1845-H1847 PolarHBondContact OG-NE2 3.06Å
1846	A	86.1	Confident	80.3	Confident	26.8 Å²	26.8	46.9 Å²	46.9	22%	0.221	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	131.3	179.8	0	0	0	0	0	110.8	F1776 W1836 L1838	F1776-A1846 HydrophobicContact CB-CB 4.26Å; F1776-A1846 HydrophobicContact CD1-CB 3.55Å; F1776-A1846 VanDerWaalsContact CD1-CB 3.48Å; F1776-A1846 HydrophobicContact CD2-CB 3.83Å; F1776-A1846 HydrophobicContact CE1-CB 3.68Å; F1776-A1846 HydrophobicContact CE2-CB 3.96Å; F1776-A1846 HydrophobicContact CG-CB 3.63Å; F1776-A1846 VanDerWaalsContact CG-CB 3.44Å; F1776-A1846 HydrophobicContact CZ-CB 3.9Å; W1836-A1846 HydrophobicContact CE3-CB 4.1Å; W1836-A1846 HydrophobicContact CZ3-CB 4.42Å; L1838-A1846 HydrophobicContact CD1-CB 4.41Å; L1838-A1846 HydrophobicContact CD2-CB 3.47Å; L1838-A1846 VanDerWaalsContact CD2-CB 3.47Å; L1838-A1846 HydrophobicContact CG-CB 4.13Å
1847	H	86	Confident	78.4	Confident	49.8 Å²	49.8	49.2 Å²	49.2	23%	0.231	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	129.5	179.3	-60.3	-82	0	0	0	109.7	W1836 W1837 S1845 L1849 Y1874	W1836-H1847 CarbonylContact C-O 3.53Å; W1836-H1847 WeakPolarHBondContact CA-O 3.25Å; W1836-H1847 VanDerWaalsContact CE3-C 3.47Å; W1837-H1847 HydrophobicContact CE3-CB 4.09Å; W1837-H1847 AromaticContact CE3-CD2 3.76Å; W1837-H1847 VanDerWaalsContact CE3-CD2 3.49Å; W1837-H1847 AromaticContact CE3-CG 3.94Å; W1837-H1847 AromaticContact CZ3-CD2 3.73Å; W1837-H1847 PolarHBondContact N-O 3.11Å; W1837-H1847 PolarHBondContact O-N 2.91Å; S1845-H1847 PolarHBondContact OG-NE2 3.06Å; H1847-L1849 PolarHBondContact O-N 3.01Å; H1847-Y1874 AromaticContact CE1-CD2 3.78Å; H1847-Y1874 AromaticContact CE1-CG 3.87Å; H1847-Y1874 VanDerWaalsContact ND1-CB 3.34Å; H1847-Y1874 WeakPolarHBondContact ND1-CB 3.28Å; H1847-Y1874 AromaticContact ND1-CG 3.85Å; H1847-Y1874 AromaticContact NE2-CD2 3.93Å
1848	L	88.1	Confident	76.1	Confident	29.4 Å²	29.4	53.5 Å²	53.5	15%	0.154	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	122.2	177.1	-179	63.9	0	0	0	109.4	T1834 W1836 I1850 D1853 C1878	T1834-L1848 HydrophobicContact CG2-CD1 3.61Å; T1834-L1848 VanDerWaalsContact CG2-CD1 3.44Å; W1836-L1848 HydrophobicContact CD2-CB 4.46Å; W1836-L1848 HydrophobicContact CD2-CD1 4.16Å; W1836-L1848 HydrophobicContact CE3-CB 4.08Å; W1836-L1848 HydrophobicContact CE3-CD1 4.47Å; W1836-L1848 VanDerWaalsContact CE3-N 3.34Å; W1836-L1848 HydrophobicContact CH2-CB 4.08Å; W1836-L1848 HydrophobicContact CH2-CD1 4.37Å; W1836-L1848 HydrophobicContact CZ2-CB 4.38Å; W1836-L1848 HydrophobicContact CZ2-CD1 3.93Å; W1836-L1848 HydrophobicContact CZ3-CB 3.87Å; L1848-I1850 WeakPolarHBondContact CD1-O 3.41Å; L1848-D1853 HydrophobicContact CD2-CB 4.39Å; L1848-D1853 WeakPolarHBondContact CD2-O 3.1Å; L1848-C1878 VanDerWaalsContact CG-SG 3.59Å; L1848-C1878 WeakPolarHBondContact O-CB 3.45Å; L1848-C1878 PolarHBondContact O-SG 2.92Å; L1848-C1878 VanDerWaalsContact O-SG 3.4Å
1849	L	88.1	Confident	73.8	Confident	4.6 Å²	4.6	58.2 Å²	58.2	2%	0.024	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	-43.7	-179.5	-157.9	80.1	0	0	0	111.7	F1821 F1826 I1835 W1837 H1847 F1877 C1878 I1879 L1896 L1907	F1821-L1849 HydrophobicContact CE1-CD1 4.01Å; F1821-L1849 HydrophobicContact CE1-CD2 3.74Å; F1821-L1849 HydrophobicContact CE2-CD1 4.33Å; F1821-L1849 HydrophobicContact CZ-CD1 3.99Å; F1821-L1849 HydrophobicContact CZ-CD2 4.16Å; F1826-L1849 HydrophobicContact CD1-CD1 3.57Å; F1826-L1849 HydrophobicContact CD1-CD2 4.03Å; F1826-L1849 HydrophobicContact CE1-CD1 3.8Å; F1826-L1849 HydrophobicContact CE1-CD2 4.16Å; I1835-L1849 HydrophobicContact CG2-CB 4.46Å; I1835-L1849 HydrophobicContact CG2-CD1 4.37Å; I1835-L1849 HydrophobicContact CG2-CD2 4.36Å; I1835-L1849 WeakPolarHBondContact O-CA 3.3Å; I1835-L1849 VanDerWaalsContact O-CB 3.31Å; I1835-L1849 WeakPolarHBondContact O-CB 3.37Å; I1835-L1849 PolarHBondContact O-N 2.96Å; W1837-L1849 HydrophobicContact CB-CD1 3.64Å; W1837-L1849 HydrophobicContact CB-CD2 3.99Å; W1837-L1849 HydrophobicContact CB-CG 3.72Å; H1847-L1849 PolarHBondContact O-N 3.01Å; L1849-F1877 HydrophobicContact CD1-CD1 3.81Å; L1849-F1877 VanDerWaalsContact CD1-CD1 3.49Å; L1849-F1877 HydrophobicContact CD1-CE1 3.55Å; L1849-F1877 HydrophobicContact CD2-CD1 3.73Å; L1849-F1877 HydrophobicContact CD2-CE1 4.12Å; L1849-C1878 WeakPolarHBondContact O-CA 3.28Å; L1849-I1879 PolarHBondContact O-N 3.13Å; L1849-L1896 HydrophobicContact CD1-CD2 4.25Å; L1849-L1896 HydrophobicContact CD2-CD2 3.69Å; L1849-L1907 HydrophobicContact CD1-CD2 4.32Å; L1849-L1907 HydrophobicContact CD2-CD2 3.83Å; L1849-L1907 HydrophobicContact CG-CD2 3.96Å
1850	I	91.2	Very high	71.7	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	127.9	178.5	-48.7	-175	0	0	0	109.2	T1834 I1835 L1848 I1879 Q1881 L1883 F1898 L1907	T1834-I1850 CarbonylContact C-O 3.5Å; T1834-I1850 VanDerWaalsContact CA-O 3.27Å; T1834-I1850 WeakPolarHBondContact CA-O 3.32Å; I1835-I1850 HydrophobicContact CB-CB 4.12Å; I1835-I1850 HydrophobicContact CB-CG1 4.34Å; I1835-I1850 HydrophobicContact CD1-CD1 4.09Å; I1835-I1850 PolarHBondContact N-O 3.11Å; I1835-I1850 PolarHBondContact O-N 3.25Å; L1848-I1850 WeakPolarHBondContact CD1-O 3.41Å; I1850-I1879 WeakPolarHBondContact CA-O 3.32Å; I1850-I1879 HydrophobicContact CG1-CB 4.31Å; I1850-I1879 HydrophobicContact CG1-CD1 4.44Å; I1850-I1879 HydrophobicContact CG2-CB 4.38Å; I1850-I1879 HydrophobicContact CG2-CG2 4.45Å; I1850-Q1881 HydrophobicContact CG2-CB 3.68Å; I1850-Q1881 HydrophobicContact CG2-CG 4.43Å; I1850-L1883 HydrophobicContact CB-CD1 4.26Å; I1850-L1883 HydrophobicContact CG2-CD1 3.89Å; I1850-L1883 HydrophobicContact CG2-CD2 4.21Å; I1850-L1883 HydrophobicContact CG2-CG 4.11Å; I1850-F1898 HydrophobicContact CD1-CD1 4.43Å; I1850-F1898 HydrophobicContact CD1-CE1 3.56Å; I1850-F1898 VanDerWaalsContact CD1-CE1 3.45Å; I1850-F1898 HydrophobicContact CD1-CE2 4.43Å; I1850-F1898 HydrophobicContact CD1-CZ 3.54Å; I1850-F1898 VanDerWaalsContact CD1-CZ 3.49Å; I1850-L1907 HydrophobicContact CD1-CD2 4.06Å; I1850-L1907 HydrophobicContact CG1-CD2 4.35Å
1851	G	89	Confident	69.9	Low	0 Å²	0	68 Å²	68	0%	0	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.9	166.4	176.7	0	0	0	0	0	113.6	D1853 C1854 I1879 K1880 Q1881	G1851-D1853 VanDerWaalsContact C-N 3.32Å; G1851-C1854 WeakPolarHBondContact O-CB 3.26Å; G1851-C1854 PolarHBondContact O-N 2.85Å; G1851-C1854 PolarHBondContact O-SG 2.96Å; G1851-I1879 PolarHBondContact N-O 2.85Å; G1851-I1879 VanDerWaalsContact N-O 3.15Å; G1851-K1880 VanDerWaalsContact O-CA 3.31Å; G1851-K1880 WeakPolarHBondContact O-CA 3.27Å; G1851-Q1881 CarbonylContact C-O 3.43Å; G1851-Q1881 VanDerWaalsContact C-O 3.27Å; G1851-Q1881 PolarHBondContact O-N 3.15Å; G1851-Q1881 VanDerWaalsContact O-N 3.1Å
1852	E	86.3	Confident	68.1	Low	117 Å²	117	74.6 Å²	74.6	55%	0.547	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-36.3	177.1	-174.4	165	-154.9	0	0	112	C1854 K1880 Q1881 N1882	E1852-C1854 PolarHBondContact O-N 3.09Å; E1852-K1880 VanDerWaalsContact O-CE 3.32Å; E1852-K1880 WeakPolarHBondContact O-CE 3.36Å; E1852-K1880 PolarHBondContact O-NZ 2.87Å; E1852-Q1881 PolarHBondContact N-O 3.08Å; E1852-N1882 PolarHBondContact OE1-ND2 3Å; E1852-N1882 PolarHBondContact OE2-ND2 2.89Å
1853	D	81.6	Confident	67	Low	123.6 Å²	123.6	77.3 Å²	77.3	66%	0.661	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	35.1	177.7	-80.9	-34.3	0	0	0	112.8	L1848 G1851 Q1855	L1848-D1853 HydrophobicContact CD2-CB 4.39Å; L1848-D1853 WeakPolarHBondContact CD2-O 3.1Å; G1851-D1853 VanDerWaalsContact C-N 3.32Å; D1853-Q1855 PolarHBondContact O-N 2.95Å; D1853-Q1855 VanDerWaalsContact O-N 3.13Å; D1853-Q1855 WeakPolarHBondContact OD1-CB 3.05Å; D1853-Q1855 VanDerWaalsContact OD1-CG 3.24Å; D1853-Q1855 WeakPolarHBondContact OD1-CG 3.48Å; D1853-Q1855 PolarHBondContact OD1-N 3.26Å; D1853-Q1855 VanDerWaalsContact OD1-N 3.11Å
1854	C	79.4	Confident	65.1	Low	12 Å²	12	79.5 Å²	79.5	8%	0.081	45%	0.45	C	S	.	.			trans	-64.2	84.2	173.9	-72.5	0	0	0	0	111.7	G1851 E1852 S1856 C1878 I1879 K1880	G1851-C1854 WeakPolarHBondContact O-CB 3.26Å; G1851-C1854 PolarHBondContact O-N 2.85Å; G1851-C1854 PolarHBondContact O-SG 2.96Å; E1852-C1854 PolarHBondContact O-N 3.09Å; C1854-S1856 PolarHBondContact O-N 3.18Å; C1854-C1878 VanDerWaalsContact CA-SG 3.53Å; C1854-C1878 WeakPolarHBondContact CA-SG 3.3Å; C1854-C1878 HydrophobicContact CB-CB 3.68Å; C1854-C1878 WeakPolarHBondContact CB-SG 3.41Å; C1854-C1878 VanDerWaalsContact SG-C 3.52Å; C1854-C1878 VanDerWaalsContact SG-CA 3.57Å; C1854-C1878 WeakPolarHBondContact SG-CB 3.41Å; C1854-C1878 PolarHBondContact SG-O 3.4Å; C1854-C1878 VanDerWaalsContact SG-O 3.37Å; C1854-C1878 CovalentContact SG-SG 2.03Å; C1854-C1878 PolarHBondContact SG-SG 2.91Å; C1854-I1879 VanDerWaalsContact SG-C 3.53Å; C1854-I1879 PolarHBondContact SG-N 3.37Å; C1854-I1879 PolarHBondContact SG-O 2.92Å; C1854-I1879 VanDerWaalsContact SG-O 3.34Å; C1854-K1880 HydrophobicContact CB-CB 3.98Å; C1854-K1880 HydrophobicContact CB-CG 4.25Å; C1854-K1880 PolarHBondContact O-NZ 3.11Å; C1854-K1880 VanDerWaalsContact SG-CG 3.53Å
1855	Q	67.6	Low	62.9	Low	157.2 Å²	157.2	82.5 Å²	82.5	74%	0.735	47%	0.474	S	S	*	.	P	Polyproline II helix	trans	-73.7	121.3	171.1	-67.2	-176.3	1.7	0	0	108.6	D1853	D1853-Q1855 PolarHBondContact O-N 2.95Å; D1853-Q1855 VanDerWaalsContact O-N 3.13Å; D1853-Q1855 WeakPolarHBondContact OD1-CB 3.05Å; D1853-Q1855 VanDerWaalsContact OD1-CG 3.24Å; D1853-Q1855 WeakPolarHBondContact OD1-CG 3.48Å; D1853-Q1855 PolarHBondContact OD1-N 3.26Å; D1853-Q1855 VanDerWaalsContact OD1-N 3.11Å
1856	S	55.6	Low	60.4	Low	83.8 Å²	83.8	89.5 Å²	89.5	59%	0.586	50%	0.503	S	S	*	.	P	Polyproline II helix	trans	-57.8	134.5	173.7	-134.8	0	0	0	0	109.1	C1854 S1858	C1854-S1856 PolarHBondContact O-N 3.18Å; S1856-S1858 PolarHBondContact O-N 3.01Å
1857	P	52	Low	57.8	Low	76.8 Å²	76.8	93.1 Å²	93.1	50%	0.499	53%	0.526	S	S	.	.			trans	-55.4	118	175.4	20.9	-30.8	0	0	0	108.4	W1836 A1859	W1836-P1857 HydrophobicContact CH2-CG 3.97Å; W1836-P1857 HydrophobicContact CZ3-CG 4.36Å; P1857-A1859 PolarHBondContact O-N 3.04Å; P1857-A1859 VanDerWaalsContact O-N 3.11Å
1858	S	42.4	Very low	55.1	Low	99.8 Å²	99.8	95.7 Å²	95.7	70%	0.698	55%	0.55	S	S	*	.			trans	-58.8	117.2	178.9	43.6	0	0	0	0	108	S1856 K1860	S1856-S1858 PolarHBondContact O-N 3.01Å; S1858-K1860 VanDerWaalsContact C-N 3.34Å; S1858-K1860 PolarHBondContact O-N 2.92Å
1859	A	40.6	Very low	52.5	Low	97.8 Å²	97.8	99.5 Å²	99.5	81%	0.808	58%	0.579	S	S	*	*			trans	-53.8	101.1	178.9	0	0	0	0	0	109.7	P1857 S1861	P1857-A1859 PolarHBondContact O-N 3.04Å; P1857-A1859 VanDerWaalsContact O-N 3.11Å; A1859-S1861 PolarHBondContact O-N 2.81Å
1860	K	37.9	Very low	50	Low	190.4 Å²	190.4	105.4 Å²	105.4	83%	0.828	62%	0.615	S	S	*	*			trans	-53.8	78.1	173.4	-71.2	179.6	178.6	177.1	0	110.5	S1858 N1862 E1876	S1858-K1860 VanDerWaalsContact C-N 3.34Å; S1858-K1860 PolarHBondContact O-N 2.92Å; K1860-N1862 PolarHBondContact O-N 3.19Å; K1860-E1876 IonicContact NZ-OE1 2.69Å; K1860-E1876 PolarHBondContact NZ-OE1 3.07Å
1861	S	35.3	Very low	47.4	Very low	81.4 Å²	81.4	109.7 Å²	109.7	57%	0.569	65%	0.651	S	S	*	*			trans	-103.9	124.6	156.8	54.9	0	0	0	0	108.6	A1859 I1863	A1859-S1861 PolarHBondContact O-N 2.81Å; S1861-I1863 VanDerWaalsContact C-N 3.35Å; S1861-I1863 PolarHBondContact O-N 2.94Å; S1861-I1863 VanDerWaalsContact O-N 3.15Å
1862	N	31	Very low	45.3	Very low	165.2 Å²	165.2	114.3 Å²	114.3	88%	0.883	67%	0.671	S	S	*	*			trans	-63.5	94.2	178.9	-70.2	-37.6	0	0	0	110.8	K1860 N1864	K1860-N1862 PolarHBondContact O-N 3.19Å; N1862-N1864 VanDerWaalsContact C-N 3.32Å; N1862-N1864 PolarHBondContact O-N 2.8Å
1863	I	37.2	Very low	43.3	Very low	121.8 Å²	121.8	113 Å²	113	63%	0.625	67%	0.667	S	S	*	*			trans	-117.6	105.1	171.5	-59.2	177.5	0	0	0	107.7	Y1772 S1861 S1865	Y1772-I1863 HydrophobicContact CE2-CD1 4.23Å; S1861-I1863 VanDerWaalsContact C-N 3.35Å; S1861-I1863 PolarHBondContact O-N 2.94Å; S1861-I1863 VanDerWaalsContact O-N 3.15Å; I1863-S1865 WeakPolarHBondContact CG2-OG 3.29Å; I1863-S1865 PolarHBondContact O-N 3.1Å; I1863-S1865 VanDerWaalsContact O-N 3.11Å
1864	N	31.4	Very low	41.9	Very low	157.4 Å²	157.4	110.1 Å²	110.1	84%	0.842	65%	0.648	S	S	*	*			trans	-66.2	91.9	171.9	-66.4	-22	0	0	0	111	N1862 E1866	N1862-N1864 VanDerWaalsContact C-N 3.32Å; N1862-N1864 PolarHBondContact O-N 2.8Å; N1864-E1866 VanDerWaalsContact C-N 3.33Å; N1864-E1866 PolarHBondContact O-N 2.89Å
1865	S	32	Very low	40.5	Very low	97.8 Å²	97.8	116.1 Å²	116.1	68%	0.684	67%	0.674	S	S	*	*			trans	-102.6	96.7	163.6	74.5	0	0	0	0	110.3	I1863 S1867	I1863-S1865 WeakPolarHBondContact CG2-OG 3.29Å; I1863-S1865 PolarHBondContact O-N 3.1Å; I1863-S1865 VanDerWaalsContact O-N 3.11Å; S1865-S1867 VanDerWaalsContact C-N 3.29Å; S1865-S1867 PolarHBondContact O-N 3.2Å; S1865-S1867 VanDerWaalsContact O-N 3.16Å
1866	E	30.2	Very low	39.9	Very low	187.8 Å²	187.8	114.9 Å²	114.9	88%	0.878	67%	0.669	S	S	*	*			trans	-67.7	92.8	161.8	-71.5	-179.3	156.6	0	0	108.8	N1864 S1868	N1864-E1866 VanDerWaalsContact C-N 3.33Å; N1864-E1866 PolarHBondContact O-N 2.89Å; E1866-S1868 PolarHBondContact O-N 3.1Å
1867	S	29.9	Very low	40.5	Very low	102.4 Å²	102.4	111.8 Å²	111.8	72%	0.716	65%	0.645	S	S	*	*			trans	-126.2	102.3	163.2	52.4	0	0	0	0	110.4	S1865 S1869	S1865-S1867 VanDerWaalsContact C-N 3.29Å; S1865-S1867 PolarHBondContact O-N 3.2Å; S1865-S1867 VanDerWaalsContact O-N 3.16Å; S1867-S1869 PolarHBondContact O-N 3.15Å
1868	S	31	Very low	41.8	Very low	104.2 Å²	104.2	109.3 Å²	109.3	73%	0.729	63%	0.629	S	S	*	*			trans	-24.8	118	163.4	22.6	0	0	0	0	115.4	E1866 T1870	E1866-S1868 PolarHBondContact O-N 3.1Å; S1868-T1870 VanDerWaalsContact C-N 3.27Å; S1868-T1870 PolarHBondContact O-N 2.82Å; S1868-T1870 VanDerWaalsContact O-N 3.1Å
1869	S	32	Very low	43.8	Very low	108.8 Å²	108.8	105.2 Å²	105.2	76%	0.761	60%	0.599	S	S	*	*			trans	-46.6	91.5	164	57.7	0	0	0	0	115.4	S1867 A1871	S1867-S1869 PolarHBondContact O-N 3.15Å; S1869-A1871 PolarHBondContact O-N 3.38Å; S1869-A1871 VanDerWaalsContact O-N 3.11Å
1870	T	35.5	Very low	46	Very low	128.8 Å²	128.8	107.3 Å²	107.3	79%	0.79	59%	0.59	S	S	*	*			trans	-98.4	42.1	160.2	52.3	0	0	0	0	113.7	G1814 S1868 F1872	G1814-T1870 PolarHBondContact O-OG1 3.23Å; S1868-T1870 VanDerWaalsContact C-N 3.27Å; S1868-T1870 PolarHBondContact O-N 2.82Å; S1868-T1870 VanDerWaalsContact O-N 3.1Å; T1870-F1872 VanDerWaalsContact C-N 3.29Å; T1870-F1872 PolarHBondContact O-N 3.18Å
1871	A	38.4	Very low	48.3	Very low	90.2 Å²	90.2	99.5 Å²	99.5	75%	0.745	56%	0.556	S	S	*	*			trans	-72.2	100.6	174.5	0	0	0	0	0	109.2	S1869 N1873	S1869-A1871 PolarHBondContact O-N 3.38Å; S1869-A1871 VanDerWaalsContact O-N 3.11Å; A1871-N1873 PolarHBondContact O-N 3.14Å; A1871-N1873 VanDerWaalsContact O-N 3.17Å
1872	F	43.5	Very low	50.9	Low	95.2 Å²	95.2	99.8 Å²	99.8	42%	0.418	55%	0.552	S	S	.	*			trans	-54.6	119.8	171.5	-119.4	-96.6	0	0	0	109.2	G1817 A1819 T1870 Y1874 F1877	G1817-F1872 VanDerWaalsContact CA-CZ 3.47Å; G1817-F1872 WeakPolarHBondContact O-CD1 3.38Å; G1817-F1872 WeakPolarHBondContact O-CD2 3.02Å; G1817-F1872 VanDerWaalsContact O-CE1 3.27Å; G1817-F1872 WeakPolarHBondContact O-CE1 3.24Å; G1817-F1872 WeakPolarHBondContact O-CE2 3.37Å; G1817-F1872 VanDerWaalsContact O-CG 3.22Å; G1817-F1872 WeakPolarHBondContact O-CG 3.25Å; G1817-F1872 WeakPolarHBondContact O-CZ 3.4Å; A1819-F1872 HydrophobicContact CB-CD1 4.22Å; A1819-F1872 HydrophobicContact CB-CE1 4.18Å; T1870-F1872 VanDerWaalsContact C-N 3.29Å; T1870-F1872 PolarHBondContact O-N 3.18Å; F1872-Y1874 VanDerWaalsContact C-N 3.29Å; F1872-Y1874 HydrophobicContact CB-CD2 3.75Å; F1872-Y1874 HydrophobicContact CB-CE1 4.03Å; F1872-Y1874 HydrophobicContact CB-CE2 3.18Å; F1872-Y1874 HydrophobicContact CB-CG 4.39Å; F1872-Y1874 AromaticContact CD1-CE1 3.96Å; F1872-Y1874 HydrophobicContact CD1-CE1 3.96Å; F1872-Y1874 AromaticContact CD1-CZ 3.92Å; F1872-Y1874 HydrophobicContact CG-CE1 4.28Å; F1872-Y1874 HydrophobicContact CG-CE2 4.12Å; F1872-Y1874 AromaticContact CG-CZ 3.76Å; F1872-Y1874 VanDerWaalsContact O-CD2 3.28Å; F1872-Y1874 WeakPolarHBondContact O-CD2 3.28Å; F1872-Y1874 WeakPolarHBondContact O-CE2 3.46Å; F1872-Y1874 PolarHBondContact O-N 3.18Å; F1872-Y1874 VanDerWaalsContact O-N 3.14Å; F1872-F1877 HydrophobicContact CD1-CE2 4.25Å; F1872-F1877 AromaticContact CE1-CE2 3.77Å; F1872-F1877 HydrophobicContact CE1-CE2 3.77Å; F1872-F1877 AromaticContact CE1-CZ 3.99Å; F1872-F1877 HydrophobicContact CE1-CZ 3.99Å
1873	N	45.8	Very low	53.9	Low	89.6 Å²	89.6	92 Å²	92	48%	0.479	51%	0.51	S	S	.	.			trans	-81.7	89.5	-179.5	-161.9	6.5	0	0	0	109.2	A1871 Q1875 E1876	A1871-N1873 PolarHBondContact O-N 3.14Å; A1871-N1873 VanDerWaalsContact O-N 3.17Å; N1873-Q1875 PolarHBondContact ND2-OE1 3.05Å; N1873-Q1875 VanDerWaalsContact ND2-OE1 3.1Å; N1873-Q1875 PolarHBondContact O-N 3.12Å; N1873-Q1875 WeakPolarHBondContact OD1-CB 3.36Å; N1873-Q1875 WeakPolarHBondContact OD1-CG 3.44Å; N1873-Q1875 PolarHBondContact OD1-N 3.01Å; N1873-Q1875 PolarHBondContact OD1-OE1 3.4Å; N1873-Q1875 VanDerWaalsContact OD1-OE1 3.14Å; N1873-E1876 PolarHBondContact O-N 3.18Å; N1873-E1876 VanDerWaalsContact O-N 3.08Å
1874	Y	50.4	Low	56.5	Low	62.8 Å²	62.8	91.2 Å²	91.2	25%	0.246	50%	0.502	C	S	.	.	G	3₁₀ helix	trans	-56.2	-16	-179.2	-67	-80	0	0	0	114.2	A1819 F1821 W1837 K1839 H1847 F1872 E1876 F1877	A1819-Y1874 HydrophobicContact CB-CD1 4.18Å; A1819-Y1874 HydrophobicContact CB-CE1 4.06Å; F1821-Y1874 HydrophobicContact CE1-CD1 4.47Å; W1837-Y1874 HydrophobicContact CE3-CD1 4.25Å; W1837-Y1874 HydrophobicContact CE3-CE1 4.27Å; W1837-Y1874 HydrophobicContact CH2-CD1 4.2Å; W1837-Y1874 AromaticContact CH2-CE1 3.52Å; W1837-Y1874 HydrophobicContact CH2-CE1 3.52Å; W1837-Y1874 VanDerWaalsContact CH2-CE1 3.42Å; W1837-Y1874 AromaticContact CH2-CZ 3.74Å; W1837-Y1874 WeakPolarHBondContact CH2-OH 3.34Å; W1837-Y1874 AromaticContact CZ3-CD1 3.55Å; W1837-Y1874 HydrophobicContact CZ3-CD1 3.55Å; W1837-Y1874 VanDerWaalsContact CZ3-CD1 3.44Å; W1837-Y1874 HydrophobicContact CZ3-CD2 4.36Å; W1837-Y1874 AromaticContact CZ3-CE1 3.23Å; W1837-Y1874 HydrophobicContact CZ3-CE1 3.23Å; W1837-Y1874 HydrophobicContact CZ3-CE2 4.3Å; W1837-Y1874 AromaticContact CZ3-CG 3.98Å; W1837-Y1874 HydrophobicContact CZ3-CG 4.1Å; W1837-Y1874 AromaticContact CZ3-CZ 3.65Å; K1839-Y1874 HydrophobicContact CD-CE2 4.4Å; K1839-Y1874 PolarHBondContact NZ-OH 2.98Å; H1847-Y1874 AromaticContact CE1-CD2 3.78Å; H1847-Y1874 AromaticContact CE1-CG 3.87Å; H1847-Y1874 VanDerWaalsContact ND1-CB 3.34Å; H1847-Y1874 WeakPolarHBondContact ND1-CB 3.28Å; H1847-Y1874 AromaticContact ND1-CG 3.85Å; H1847-Y1874 AromaticContact NE2-CD2 3.93Å; F1872-Y1874 VanDerWaalsContact C-N 3.29Å; F1872-Y1874 HydrophobicContact CB-CD2 3.75Å; F1872-Y1874 HydrophobicContact CB-CE1 4.03Å; F1872-Y1874 HydrophobicContact CB-CE2 3.18Å; F1872-Y1874 HydrophobicContact CB-CG 4.39Å; F1872-Y1874 AromaticContact CD1-CE1 3.96Å; F1872-Y1874 HydrophobicContact CD1-CE1 3.96Å; F1872-Y1874 AromaticContact CD1-CZ 3.92Å; F1872-Y1874 HydrophobicContact CG-CE1 4.28Å; F1872-Y1874 HydrophobicContact CG-CE2 4.12Å; F1872-Y1874 AromaticContact CG-CZ 3.76Å; F1872-Y1874 VanDerWaalsContact O-CD2 3.28Å; F1872-Y1874 WeakPolarHBondContact O-CD2 3.28Å; F1872-Y1874 WeakPolarHBondContact O-CE2 3.46Å; F1872-Y1874 PolarHBondContact O-N 3.18Å; F1872-Y1874 VanDerWaalsContact O-N 3.14Å; Y1874-E1876 PolarHBondContact O-N 2.97Å; Y1874-E1876 VanDerWaalsContact O-N 3.13Å; Y1874-F1877 HydrophobicContact CD1-CD2 4.15Å; Y1874-F1877 HydrophobicContact CD1-CE2 4.25Å; Y1874-F1877 PolarHBondContact O-N 3.14Å; Y1874-F1877 VanDerWaalsContact O-N 3.12Å
1875	Q	50.3	Low	59.4	Low	138.2 Å²	138.2	85.3 Å²	85.3	65%	0.646	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-56.1	-23.4	171.8	-74.9	-177.2	-37.6	0	0	113.4	N1873 F1877 C1878	N1873-Q1875 PolarHBondContact ND2-OE1 3.05Å; N1873-Q1875 VanDerWaalsContact ND2-OE1 3.1Å; N1873-Q1875 PolarHBondContact O-N 3.12Å; N1873-Q1875 WeakPolarHBondContact OD1-CB 3.36Å; N1873-Q1875 WeakPolarHBondContact OD1-CG 3.44Å; N1873-Q1875 PolarHBondContact OD1-N 3.01Å; N1873-Q1875 PolarHBondContact OD1-OE1 3.4Å; N1873-Q1875 VanDerWaalsContact OD1-OE1 3.14Å; Q1875-F1877 VanDerWaalsContact C-N 3.26Å; Q1875-F1877 PolarHBondContact O-N 3.18Å; Q1875-C1878 VanDerWaalsContact O-CB 3.26Å; Q1875-C1878 WeakPolarHBondContact O-CB 3.45Å; Q1875-C1878 PolarHBondContact O-N 3.09Å
1876	E	56	Low	62.4	Low	132 Å²	132	80.7 Å²	80.7	62%	0.617	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-73.8	-14.2	177.1	-66.8	-175.5	169.2	0	0	113.8	K1860 N1873 Y1874	K1860-E1876 IonicContact NZ-OE1 2.69Å; K1860-E1876 PolarHBondContact NZ-OE1 3.07Å; N1873-E1876 PolarHBondContact O-N 3.18Å; N1873-E1876 VanDerWaalsContact O-N 3.08Å; Y1874-E1876 PolarHBondContact O-N 2.97Å; Y1874-E1876 VanDerWaalsContact O-N 3.13Å
1877	F	68.7	Low	65.5	Low	20.2 Å²	20.2	73.1 Å²	73.1	9%	0.089	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-100.6	17.8	-179.1	-113.7	-88.9	0	0	0	113.2	A1819 F1821 L1849 F1872 Y1874 Q1875 I1879 L1907 Q1911 P1918	A1819-F1877 HydrophobicContact CB-CD1 3.92Å; A1819-F1877 HydrophobicContact CB-CD2 4.11Å; A1819-F1877 HydrophobicContact CB-CE1 3.54Å; A1819-F1877 HydrophobicContact CB-CE2 4.14Å; A1819-F1877 HydrophobicContact CB-CG 4.06Å; A1819-F1877 HydrophobicContact CB-CZ 3.66Å; A1819-F1877 VanDerWaalsContact N-CZ 3.35Å; F1821-F1877 HydrophobicContact CE1-CD1 4.32Å; F1821-F1877 HydrophobicContact CE1-CE1 4.4Å; F1821-F1877 HydrophobicContact CE2-CD1 4.22Å; F1821-F1877 AromaticContact CE2-CE1 3.7Å; F1821-F1877 HydrophobicContact CE2-CE1 3.7Å; F1821-F1877 HydrophobicContact CE2-CE2 4.22Å; F1821-F1877 AromaticContact CE2-CZ 3.75Å; F1821-F1877 HydrophobicContact CE2-CZ 3.75Å; F1821-F1877 HydrophobicContact CZ-CB 4.12Å; F1821-F1877 AromaticContact CZ-CD1 3.47Å; F1821-F1877 HydrophobicContact CZ-CD1 3.61Å; F1821-F1877 VanDerWaalsContact CZ-CD1 3.42Å; F1821-F1877 HydrophobicContact CZ-CD2 4.36Å; F1821-F1877 AromaticContact CZ-CE1 3.48Å; F1821-F1877 HydrophobicContact CZ-CE1 3.48Å; F1821-F1877 HydrophobicContact CZ-CE2 4.28Å; F1821-F1877 AromaticContact CZ-CG 3.94Å; F1821-F1877 HydrophobicContact CZ-CG 4.05Å; F1821-F1877 AromaticContact CZ-CZ 3.82Å; F1821-F1877 HydrophobicContact CZ-CZ 3.95Å; L1849-F1877 HydrophobicContact CD1-CD1 3.81Å; L1849-F1877 VanDerWaalsContact CD1-CD1 3.49Å; L1849-F1877 HydrophobicContact CD1-CE1 3.55Å; L1849-F1877 HydrophobicContact CD2-CD1 3.73Å; L1849-F1877 HydrophobicContact CD2-CE1 4.12Å; F1872-F1877 HydrophobicContact CD1-CE2 4.25Å; F1872-F1877 AromaticContact CE1-CE2 3.77Å; F1872-F1877 HydrophobicContact CE1-CE2 3.77Å; F1872-F1877 AromaticContact CE1-CZ 3.99Å; F1872-F1877 HydrophobicContact CE1-CZ 3.99Å; Y1874-F1877 HydrophobicContact CD1-CD2 4.15Å; Y1874-F1877 HydrophobicContact CD1-CE2 4.25Å; Y1874-F1877 PolarHBondContact O-N 3.14Å; Y1874-F1877 VanDerWaalsContact O-N 3.12Å; Q1875-F1877 VanDerWaalsContact C-N 3.26Å; Q1875-F1877 PolarHBondContact O-N 3.18Å; F1877-I1879 PolarHBondContact O-N 3.08Å; F1877-L1907 HydrophobicContact CE1-CD2 4.32Å; F1877-Q1911 VanDerWaalsContact CD1-OE1 3.22Å; F1877-Q1911 HydrophobicContact CE1-CB 4.39Å; F1877-Q1911 HydrophobicContact CE1-CG 4.5Å; F1877-Q1911 VanDerWaalsContact CE1-OE1 3.25Å; F1877-Q1911 HydrophobicContact CE2-CG 4.33Å; F1877-P1918 HydrophobicContact CD1-CG 4.15Å; F1877-P1918 HydrophobicContact CD2-CB 4.14Å; F1877-P1918 HydrophobicContact CD2-CG 4.01Å; F1877-P1918 HydrophobicContact CE1-CB 4.33Å; F1877-P1918 HydrophobicContact CE1-CG 4.27Å; F1877-P1918 HydrophobicContact CE2-CB 3.88Å; F1877-P1918 HydrophobicContact CE2-CG 3.85Å; F1877-P1918 HydrophobicContact CG-CG 4.25Å; F1877-P1918 HydrophobicContact CZ-CB 3.84Å; F1877-P1918 HydrophobicContact CZ-CG 4.1Å
1878	C	78.8	Confident	68.7	Low	22.6 Å²	22.6	68.3 Å²	68.3	15%	0.153	37%	0.371	C	S	.	.			trans	-92.1	119.1	177.8	-168.1	0	0	0	0	110.6	L1848 L1849 C1854 Q1875 K1880	L1848-C1878 VanDerWaalsContact CG-SG 3.59Å; L1848-C1878 WeakPolarHBondContact O-CB 3.45Å; L1848-C1878 PolarHBondContact O-SG 2.92Å; L1848-C1878 VanDerWaalsContact O-SG 3.4Å; L1849-C1878 WeakPolarHBondContact O-CA 3.28Å; C1854-C1878 VanDerWaalsContact CA-SG 3.53Å; C1854-C1878 WeakPolarHBondContact CA-SG 3.3Å; C1854-C1878 HydrophobicContact CB-CB 3.68Å; C1854-C1878 WeakPolarHBondContact CB-SG 3.41Å; C1854-C1878 VanDerWaalsContact SG-C 3.52Å; C1854-C1878 VanDerWaalsContact SG-CA 3.57Å; C1854-C1878 WeakPolarHBondContact SG-CB 3.41Å; C1854-C1878 PolarHBondContact SG-O 3.4Å; C1854-C1878 VanDerWaalsContact SG-O 3.37Å; C1854-C1878 CovalentContact SG-SG 2.03Å; C1854-C1878 PolarHBondContact SG-SG 2.91Å; Q1875-C1878 VanDerWaalsContact O-CB 3.26Å; Q1875-C1878 WeakPolarHBondContact O-CB 3.45Å; Q1875-C1878 PolarHBondContact O-N 3.09Å; C1878-K1880 PolarHBondContact O-N 3.45Å
1879	I	84.5	Confident	71.8	Confident	14.2 Å²	14.2	63.7 Å²	63.7	7%	0.073	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	116.7	179.1	-57	177.5	0	0	0	109.2	L1849 I1850 G1851 C1854 F1877 Q1881 L1907 P1918	L1849-I1879 PolarHBondContact O-N 3.13Å; I1850-I1879 WeakPolarHBondContact CA-O 3.32Å; I1850-I1879 HydrophobicContact CG1-CB 4.31Å; I1850-I1879 HydrophobicContact CG1-CD1 4.44Å; I1850-I1879 HydrophobicContact CG2-CB 4.38Å; I1850-I1879 HydrophobicContact CG2-CG2 4.45Å; G1851-I1879 PolarHBondContact N-O 2.85Å; G1851-I1879 VanDerWaalsContact N-O 3.15Å; C1854-I1879 VanDerWaalsContact SG-C 3.53Å; C1854-I1879 PolarHBondContact SG-N 3.37Å; C1854-I1879 PolarHBondContact SG-O 2.92Å; C1854-I1879 VanDerWaalsContact SG-O 3.34Å; F1877-I1879 PolarHBondContact O-N 3.08Å; I1879-Q1881 HydrophobicContact CG2-CB 4.37Å; I1879-Q1881 PolarHBondContact O-N 3.09Å; I1879-Q1881 VanDerWaalsContact O-N 3.11Å; I1879-L1907 HydrophobicContact CD1-CD1 3.31Å; I1879-L1907 VanDerWaalsContact CD1-CD1 3.46Å; I1879-L1907 HydrophobicContact CD1-CD2 3.92Å; I1879-L1907 HydrophobicContact CD1-CG 4.23Å; I1879-P1918 HydrophobicContact CD1-CB 3.94Å; I1879-P1918 HydrophobicContact CD1-CG 4.28Å; I1879-P1918 WeakPolarHBondContact CD1-O 3.24Å; I1879-P1918 HydrophobicContact CG1-CB 4.14Å; I1879-P1918 HydrophobicContact CG1-CG 4.04Å; I1879-P1918 WeakPolarHBondContact CG1-O 3.25Å
1880	K	86	Confident	74.9	Confident	141.6 Å²	141.6	59 Å²	59	62%	0.616	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.6	98.6	173.1	-130.8	179.6	-175.9	153.3	0	110.6	G1851 E1852 C1854 C1878	G1851-K1880 VanDerWaalsContact O-CA 3.31Å; G1851-K1880 WeakPolarHBondContact O-CA 3.27Å; E1852-K1880 VanDerWaalsContact O-CE 3.32Å; E1852-K1880 WeakPolarHBondContact O-CE 3.36Å; E1852-K1880 PolarHBondContact O-NZ 2.87Å; C1854-K1880 HydrophobicContact CB-CB 3.98Å; C1854-K1880 HydrophobicContact CB-CG 4.25Å; C1854-K1880 PolarHBondContact O-NZ 3.11Å; C1854-K1880 VanDerWaalsContact SG-CG 3.53Å; C1878-K1880 PolarHBondContact O-N 3.45Å
1881	Q	87.7	Confident	77.6	Confident	27.6 Å²	27.6	53 Å²	53	13%	0.129	27%	0.269	C	S	.	.			trans	-139.6	133.2	176.3	-179.2	177.2	-5.5	0	0	109.7	I1850 G1851 E1852 I1879 L1883 S1920	I1850-Q1881 HydrophobicContact CG2-CB 3.68Å; I1850-Q1881 HydrophobicContact CG2-CG 4.43Å; G1851-Q1881 CarbonylContact C-O 3.43Å; G1851-Q1881 VanDerWaalsContact C-O 3.27Å; G1851-Q1881 PolarHBondContact O-N 3.15Å; G1851-Q1881 VanDerWaalsContact O-N 3.1Å; E1852-Q1881 PolarHBondContact N-O 3.08Å; I1879-Q1881 HydrophobicContact CG2-CB 4.37Å; I1879-Q1881 PolarHBondContact O-N 3.09Å; I1879-Q1881 VanDerWaalsContact O-N 3.11Å; Q1881-L1883 HydrophobicContact CG-CD2 4.08Å; Q1881-L1883 PolarHBondContact O-N 3.2Å; Q1881-L1883 VanDerWaalsContact O-N 3.16Å; Q1881-S1920 VanDerWaalsContact CD-OG 3.29Å; Q1881-S1920 PolarHBondContact NE2-OG 2.94Å; Q1881-S1920 PolarHBondContact OE1-OG 3.05Å
1882	N	89.5	Confident	80.1	Confident	87.2 Å²	87.2	49.1 Å²	49.1	47%	0.466	24%	0.236	S	C	.	.			trans	-84.3	93.5	175.6	-171.8	-29.2	0	0	0	109.4	E1852 K1884	E1852-N1882 PolarHBondContact OE1-ND2 3Å; E1852-N1882 PolarHBondContact OE2-ND2 2.89Å; N1882-K1884 PolarHBondContact OD1-NZ 3Å
1883	L	92.4	Very high	81.9	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.005	23%	0.229	C	C	.	.			trans	-74.4	139.7	176.2	-59.6	174.1	0	0	0	110	K1833 I1835 I1850 Q1881 P1886 F1898 D1900	K1833-L1883 HydrophobicContact CB-CB 4.32Å; K1833-L1883 WeakPolarHBondContact CB-O 3.35Å; K1833-L1883 VanDerWaalsContact CD-O 3.28Å; K1833-L1883 WeakPolarHBondContact CD-O 3.36Å; K1833-L1883 WeakPolarHBondContact CG-O 3.33Å; I1835-L1883 HydrophobicContact CD1-CD1 3.96Å; I1835-L1883 HydrophobicContact CG1-CD1 3.92Å; I1850-L1883 HydrophobicContact CB-CD1 4.26Å; I1850-L1883 HydrophobicContact CG2-CD1 3.89Å; I1850-L1883 HydrophobicContact CG2-CD2 4.21Å; I1850-L1883 HydrophobicContact CG2-CG 4.11Å; Q1881-L1883 HydrophobicContact CG-CD2 4.08Å; Q1881-L1883 PolarHBondContact O-N 3.2Å; Q1881-L1883 VanDerWaalsContact O-N 3.16Å; L1883-P1886 HydrophobicContact CB-CB 4.49Å; L1883-P1886 HydrophobicContact CB-CG 4.28Å; L1883-P1886 HydrophobicContact CD1-CB 4.15Å; L1883-P1886 HydrophobicContact CD1-CG 4.21Å; L1883-F1898 HydrophobicContact CD2-CE2 3.87Å; L1883-F1898 HydrophobicContact CD2-CZ 4.5Å; L1883-D1900 HydrophobicContact CD2-CB 4.25Å
1884	K	92.3	Very high	83.5	Confident	106 Å²	106	44.2 Å²	44.2	46%	0.461	21%	0.213	S	C	.	.	S	Bend	trans	-90.9	-48.7	-177.8	-67.2	-166.5	-177.9	-178	0	112.2	K1833 N1882 D1900 D1927 P1928	K1833-K1884 WeakPolarHBondContact CE-O 3.26Å; N1882-K1884 PolarHBondContact OD1-NZ 3Å; K1884-D1900 WeakPolarHBondContact CA-OD1 3.45Å; K1884-D1900 PolarHBondContact N-OD1 3.12Å; K1884-D1900 PolarHBondContact N-OD2 3.13Å; K1884-D1900 VanDerWaalsContact N-OD2 3.1Å; K1884-D1927 IonicContact NZ-OD1 3.99Å; K1884-D1927 PolarHBondContact NZ-OD1 3.05Å; K1884-P1928 VanDerWaalsContact NZ-CB 3.29Å
1885	S	92.8	Very high	85.4	Confident	34 Å²	34	42.9 Å²	42.9	24%	0.238	21%	0.21	C	C	.	.	S	Bend	trans	-159.8	79.8	-178.4	-177.3	0	0	0	0	108.2	T1830 K1887 D1900 S1901	T1830-S1885 WeakPolarHBondContact CG2-OG 3.42Å; S1885-K1887 PolarHBondContact O-N 2.81Å; S1885-D1900 VanDerWaalsContact C-OD1 3.23Å; S1885-D1900 PolarHBondContact N-OD1 3.07Å; S1885-D1900 WeakPolarHBondContact O-CA 3.35Å; S1885-S1901 PolarHBondContact O-N 3.14Å
1886	P	95.3	Very high	87.5	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	132.9	178.5	29.5	-34.2	0	0	0	110.4	S1828 H1829 T1830 I1835 L1883 I1899	S1828-P1886 WeakPolarHBondContact OG-CB 3.35Å; H1829-P1886 WeakPolarHBondContact O-CG 3.37Å; T1830-P1886 WeakPolarHBondContact CA-O 3.32Å; T1830-P1886 WeakPolarHBondContact CB-O 3.35Å; T1830-P1886 PolarHBondContact OG1-O 3.11Å; T1830-P1886 VanDerWaalsContact OG1-O 3.11Å; I1835-P1886 HydrophobicContact CD1-CB 4.49Å; I1835-P1886 HydrophobicContact CG1-CB 4.44Å; L1883-P1886 HydrophobicContact CB-CB 4.49Å; L1883-P1886 HydrophobicContact CB-CG 4.28Å; L1883-P1886 HydrophobicContact CD1-CB 4.15Å; L1883-P1886 HydrophobicContact CD1-CG 4.21Å; P1886-I1899 CarbonylContact C-O 3.44Å; P1886-I1899 VanDerWaalsContact CA-O 3.26Å; P1886-I1899 WeakPolarHBondContact CA-O 3.4Å
1887	K	95.6	Very high	89.4	Confident	27.6 Å²	27.6	30.5 Å²	30.5	12%	0.12	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	-134.8	-175.6	-59.9	-179.9	-175.6	-179	0	111.2	F1790 S1828 S1885 I1889 I1899 N1971 P1972 E1973	F1790-K1887 VanDerWaalsContact CD2-CA 3.44Å; F1790-K1887 HydrophobicContact CD2-CB 4.28Å; F1790-K1887 WeakPolarHBondContact CD2-O 3.41Å; F1790-K1887 VanDerWaalsContact CE2-CA 3.43Å; F1790-K1887 HydrophobicContact CE2-CB 3.77Å; F1790-K1887 HydrophobicContact CE2-CG 4.34Å; F1790-K1887 VanDerWaalsContact CG-C 3.47Å; F1790-K1887 HydrophobicContact CZ-CB 4.13Å; S1828-K1887 WeakPolarHBondContact CB-O 3.31Å; S1828-K1887 PolarHBondContact OG-N 2.78Å; S1828-K1887 PolarHBondContact OG-O 2.92Å; S1885-K1887 PolarHBondContact O-N 2.81Å; K1887-I1889 PolarHBondContact O-N 3.42Å; K1887-I1899 HydrophobicContact CB-CB 4.12Å; K1887-I1899 HydrophobicContact CB-CG2 4.02Å; K1887-I1899 HydrophobicContact CD-CG2 4.28Å; K1887-I1899 HydrophobicContact CG-CG2 4.43Å; K1887-I1899 PolarHBondContact N-O 3.04Å; K1887-N1971 PolarHBondContact NZ-OD1 2.95Å; K1887-P1972 VanDerWaalsContact CD-O 3.26Å; K1887-P1972 WeakPolarHBondContact CD-O 3.18Å; K1887-P1972 WeakPolarHBondContact CE-O 3.34Å; K1887-P1972 PolarHBondContact NZ-O 2.95Å; K1887-E1973 HydrophobicContact CD-CB 4.34Å; K1887-E1973 HydrophobicContact CD-CG 4.38Å; K1887-E1973 IonicContact NZ-OE2 2.69Å
1888	G	95.6	Very high	90.7	Very high	1.8 Å²	1.8	29.5 Å²	29.5	2%	0.019	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-45	139.6	-179.2	0	0	0	0	0	113.1	F1898 I1899 E1973 L1975	G1888-F1898 CarbonylContact O-C 3.45Å; G1888-F1898 WeakPolarHBondContact O-CA 3.4Å; G1888-I1899 PolarHBondContact O-N 3.23Å; G1888-E1973 VanDerWaalsContact CA-O 3.27Å; G1888-E1973 WeakPolarHBondContact CA-O 3.31Å; G1888-E1973 PolarHBondContact N-O 3.05Å; G1888-L1975 VanDerWaalsContact O-CD1 3.29Å; G1888-L1975 WeakPolarHBondContact O-CD1 3.39Å
1889	I	97.3	Very high	91.6	Very high	7.4 Å²	7.4	28.4 Å²	28.4	4%	0.038	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	140.1	-173.4	-171.6	166.2	0	0	0	108.8	F1790 T1792 F1826 S1828 I1835 K1887 L1896 Y1897 F1898	F1790-I1889 HydrophobicContact CB-CG2 3.95Å; T1792-I1889 WeakPolarHBondContact CB-O 3.35Å; T1792-I1889 HydrophobicContact CG2-CB 4.42Å; T1792-I1889 HydrophobicContact CG2-CD1 4.49Å; T1792-I1889 HydrophobicContact CG2-CG1 3.95Å; T1792-I1889 HydrophobicContact CG2-CG2 3.99Å; F1826-I1889 HydrophobicContact CB-CD1 3.97Å; S1828-I1889 WeakPolarHBondContact OG-CG2 3.42Å; I1835-I1889 HydrophobicContact CG2-CD1 3.79Å; K1887-I1889 PolarHBondContact O-N 3.42Å; I1889-L1896 HydrophobicContact CD1-CD1 3.95Å; I1889-L1896 HydrophobicContact CD1-CD2 4.14Å; I1889-L1896 HydrophobicContact CD1-CG 4.21Å; I1889-L1896 HydrophobicContact CG1-CD1 3.76Å; I1889-L1896 HydrophobicContact CG1-CG 4.23Å; I1889-Y1897 CarbonylContact C-O 3.52Å; I1889-Y1897 VanDerWaalsContact CA-O 3.31Å; I1889-Y1897 WeakPolarHBondContact CA-O 3.38Å; I1889-F1898 HydrophobicContact CB-CB 4.37Å; I1889-F1898 HydrophobicContact CD1-CB 4.42Å; I1889-F1898 HydrophobicContact CG1-CB 4.1Å
1890	V	96.3	Very high	92.1	Very high	11.2 Å²	11.2	28.2 Å²	28.2	7%	0.068	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	138.4	176.6	59.5	0	0	0	0	111.3	T1792 Y1897 L1975 F1977 L1984	T1792-V1890 WeakPolarHBondContact OG1-CA 3.49Å; V1890-Y1897 PolarHBondContact N-O 3.06Å; V1890-Y1897 PolarHBondContact O-N 3.11Å; V1890-L1975 HydrophobicContact CB-CB 4.21Å; V1890-L1975 HydrophobicContact CG1-CB 3.89Å; V1890-L1975 HydrophobicContact CG1-CD1 4.13Å; V1890-L1975 HydrophobicContact CG1-CG 4.48Å; V1890-L1975 WeakPolarHBondContact CG1-O 3.02Å; V1890-L1975 HydrophobicContact CG2-CB 3.94Å; V1890-L1975 HydrophobicContact CG2-CD1 4.26Å; V1890-L1975 HydrophobicContact CG2-CD2 4.49Å; V1890-L1975 HydrophobicContact CG2-CG 4.48Å; V1890-F1977 HydrophobicContact CB-CB 4.39Å; V1890-F1977 HydrophobicContact CG1-CB 4.36Å; V1890-F1977 HydrophobicContact CG2-CB 3.67Å; V1890-F1977 VanDerWaalsContact CG2-CB 3.48Å; V1890-L1984 HydrophobicContact CG1-CD2 3.67Å; V1890-L1984 HydrophobicContact CG2-CD2 3.79Å
1891	A	92.8	Very high	92.4	Very high	3.2 Å²	3.2	23.5 Å²	23.5	3%	0.026	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	132.6	175.3	0	0	0	0	0	110.9	T1792 P1795 F1826 L1896 L1909	T1792-A1891 HydrophobicContact CG2-CB 4.24Å; T1792-A1891 PolarHBondContact OG1-N 3.22Å; T1792-A1891 VanDerWaalsContact OG1-N 3.15Å; P1795-A1891 WeakPolarHBondContact CG-O 3.4Å; F1826-A1891 HydrophobicContact CD2-CB 4.14Å; F1826-A1891 HydrophobicContact CE2-CB 3.96Å; A1891-L1896 HydrophobicContact CB-CD1 4.05Å; A1891-L1909 HydrophobicContact CB-CD1 4.33Å
1892	T	90.4	Very high	92.6	Very high	7.2 Å²	7.2	26.9 Å²	26.9	4%	0.044	14%	0.139	C	C	.	.			trans	-93.2	-175.2	161.4	68.7	0	0	0	0	108.9	H1794 T1894 E1895 Y1897 F1977 L1984 L1997	H1794-T1892 PolarHBondContact CD2-O 3.11Å; H1794-T1892 VanDerWaalsContact CD2-O 3.22Å; H1794-T1892 PolarHBondContact NE2-O 2.86Å; T1892-T1894 VanDerWaalsContact C-N 3.25Å; T1892-T1894 PolarHBondContact O-N 3.35Å; T1892-T1894 VanDerWaalsContact O-N 3.08Å; T1892-T1894 PolarHBondContact OG1-N 3.11Å; T1892-E1895 WeakPolarHBondContact CB-O 3.45Å; T1892-E1895 PolarHBondContact N-O 3.13Å; T1892-E1895 WeakPolarHBondContact OG1-CA 3.37Å; T1892-E1895 PolarHBondContact OG1-N 3.21Å; T1892-E1895 PolarHBondContact OG1-O 3.16Å; T1892-Y1897 HydrophobicContact CG2-CD2 3.95Å; T1892-Y1897 HydrophobicContact CG2-CE2 3.79Å; T1892-F1977 HydrophobicContact CG2-CD1 4.3Å; T1892-F1977 HydrophobicContact CG2-CD2 3.93Å; T1892-F1977 HydrophobicContact CG2-CE1 4.22Å; T1892-F1977 HydrophobicContact CG2-CE2 3.84Å; T1892-F1977 HydrophobicContact CG2-CG 4.16Å; T1892-F1977 HydrophobicContact CG2-CZ 3.99Å; T1892-L1984 HydrophobicContact CG2-CD2 4.42Å; T1892-L1997 HydrophobicContact CG2-CD1 4.34Å
1893	Q	81.6	Confident	92.9	Very high	57.2 Å²	57.2	23 Å²	23	27%	0.267	12%	0.119	S	C	.	.	S	Bend	trans	-63.7	-23.9	175.7	-100.9	-175.8	-12.6	0	0	113.7	I1364 N1382 S1424 H1794 M2721	I1364-Q1893 HydrophobicContact CD1-CB 3.69Å; I1364-Q1893 HydrophobicContact CD1-CG 3.58Å; N1382-Q1893 PolarHBondContact ND2-NE2 3.4Å; S1424-Q1893 PolarHBondContact O-NE2 3.14Å; H1794-Q1893 WeakPolarHBondContact NE2-CA 3.31Å; H1794-Q1893 PolarHBondContact NE2-O 3.15Å; Q1893-M2721 HydrophobicContact CB-SD 4.21Å; Q1893-M2721 HydrophobicContact CG-SD 4.28Å; Q1893-M2721 PolarHBondContact OE1-SD 3.03Å
1894	T	80.4	Confident	93	Very high	26 Å²	26	23.1 Å²	23.1	16%	0.16	12%	0.119	C	C	.	.	S	Bend	trans	-132.1	-18.6	-168.8	57.1	0	0	0	0	113.9	N1421 L1423 T1892 L1909 R1910 S2720 M2721	N1421-T1894 PolarHBondContact OD1-OG1 2.74Å; L1423-T1894 WeakPolarHBondContact O-CG2 3.33Å; T1892-T1894 VanDerWaalsContact C-N 3.25Å; T1892-T1894 PolarHBondContact O-N 3.35Å; T1892-T1894 VanDerWaalsContact O-N 3.08Å; T1892-T1894 PolarHBondContact OG1-N 3.11Å; T1894-L1909 WeakPolarHBondContact O-CB 3.38Å; T1894-L1909 PolarHBondContact O-N 3.04Å; T1894-R1910 HydrophobicContact CG2-CG 4.28Å; T1894-S2720 VanDerWaalsContact CB-OG 3.26Å; T1894-S2720 WeakPolarHBondContact CB-OG 3.3Å; T1894-S2720 PolarHBondContact OG1-OG 2.68Å; T1894-S2720 VanDerWaalsContact OG1-OG 3.12Å; T1894-M2721 HydrophobicContact CG2-CB 3.62Å; T1894-M2721 VanDerWaalsContact CG2-N 3.26Å; T1894-M2721 PolarHBondContact OG1-N 3.49Å
1895	E	89.4	Confident	93.2	Very high	35.6 Å²	35.6	19.3 Å²	19.3	17%	0.166	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	145.8	-176.6	-66	-171.3	134.9	0	0	111.9	S1420 T1892 Y1897 S1906 L1907 R1921 K2722	S1420-E1895 VanDerWaalsContact CB-CD 3.44Å; S1420-E1895 WeakPolarHBondContact CB-OE2 3.4Å; S1420-E1895 VanDerWaalsContact OG-CD 3.23Å; S1420-E1895 PolarHBondContact OG-OE2 3.04Å; T1892-E1895 WeakPolarHBondContact CB-O 3.45Å; T1892-E1895 PolarHBondContact N-O 3.13Å; T1892-E1895 WeakPolarHBondContact OG1-CA 3.37Å; T1892-E1895 PolarHBondContact OG1-N 3.21Å; T1892-E1895 PolarHBondContact OG1-O 3.16Å; E1895-Y1897 HydrophobicContact CB-CD2 4.25Å; E1895-Y1897 HydrophobicContact CB-CE2 3.65Å; E1895-Y1897 VanDerWaalsContact OE2-CZ 3.27Å; E1895-Y1897 PolarHBondContact OE2-OH 3.22Å; E1895-S1906 WeakPolarHBondContact OE1-CB 3.36Å; E1895-S1906 PolarHBondContact OE1-OG 3.14Å; E1895-L1907 CarbonylContact C-O 3.49Å; E1895-L1907 VanDerWaalsContact CA-O 3.24Å; E1895-L1907 WeakPolarHBondContact CA-O 3.4Å; E1895-R1921 IonicContact OE1-CZ 2.75Å; E1895-R1921 IonicContact OE1-NE 3.08Å; E1895-R1921 PolarHBondContact OE1-NE 2.86Å; E1895-R1921 IonicContact OE1-NH2 3.66Å; E1895-R1921 PolarHBondContact OE1-NH2 2.9Å; E1895-R1921 IonicContact OE2-NH2 3.44Å; E1895-R1921 PolarHBondContact OE2-NH2 2.87Å; E1895-K2722 WeakPolarHBondContact OE1-CD 3.36Å; E1895-K2722 WeakPolarHBondContact OE1-CE 2.89Å; E1895-K2722 IonicContact OE1-NZ 3.27Å; E1895-K2722 PolarHBondContact OE1-NZ 3.22Å; E1895-K2722 WeakPolarHBondContact OE2-CE 3.28Å; E1895-K2722 IonicContact OE2-NZ 3.9Å; E1895-K2722 PolarHBondContact OE2-NZ 2.81Å
1896	L	93.3	Very high	93.2	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	124.6	170.9	-176.2	69	0	0	0	108.9	T1792 F1826 I1835 L1849 I1889 A1891 S1906 L1907 L1909	T1792-L1896 HydrophobicContact CG2-CD1 4.11Å; F1826-L1896 HydrophobicContact CB-CD1 4.04Å; F1826-L1896 HydrophobicContact CB-CD2 4.48Å; F1826-L1896 HydrophobicContact CD1-CD1 4.1Å; F1826-L1896 HydrophobicContact CD1-CD2 3.78Å; F1826-L1896 HydrophobicContact CD1-CG 4.49Å; F1826-L1896 HydrophobicContact CD2-CD1 3.85Å; F1826-L1896 HydrophobicContact CE1-CD1 4.41Å; F1826-L1896 HydrophobicContact CE1-CD2 4.15Å; F1826-L1896 HydrophobicContact CE2-CD1 4.28Å; F1826-L1896 HydrophobicContact CG-CD1 3.73Å; F1826-L1896 HydrophobicContact CG-CD2 4.2Å; F1826-L1896 HydrophobicContact CZ-CD1 4.43Å; I1835-L1896 HydrophobicContact CG2-CD2 4.42Å; L1849-L1896 HydrophobicContact CD1-CD2 4.25Å; L1849-L1896 HydrophobicContact CD2-CD2 3.69Å; I1889-L1896 HydrophobicContact CD1-CD1 3.95Å; I1889-L1896 HydrophobicContact CD1-CD2 4.14Å; I1889-L1896 HydrophobicContact CD1-CG 4.21Å; I1889-L1896 HydrophobicContact CG1-CD1 3.76Å; I1889-L1896 HydrophobicContact CG1-CG 4.23Å; A1891-L1896 HydrophobicContact CB-CD1 4.05Å; L1896-S1906 CarbonylContact O-C 3.51Å; L1896-S1906 VanDerWaalsContact O-CA 3.29Å; L1896-S1906 WeakPolarHBondContact O-CA 3.32Å; L1896-L1907 HydrophobicContact CB-CB 4.38Å; L1896-L1907 HydrophobicContact CD2-CD2 4.41Å; L1896-L1907 PolarHBondContact N-O 2.85Å; L1896-L1907 PolarHBondContact O-N 3.05Å; L1896-L1909 HydrophobicContact CB-CD1 4.29Å; L1896-L1909 HydrophobicContact CB-CD2 3.88Å; L1896-L1909 HydrophobicContact CB-CG 4.07Å
1897	Y	96.7	Very high	92.9	Very high	8 Å²	8	18 Å²	18	3%	0.031	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	136.9	176.6	-70.6	-97.9	0	0	0	110	I1889 V1890 T1892 E1895 I1904 W1905 V1923 L1984 L1997 K2722	I1889-Y1897 CarbonylContact C-O 3.52Å; I1889-Y1897 VanDerWaalsContact CA-O 3.31Å; I1889-Y1897 WeakPolarHBondContact CA-O 3.38Å; V1890-Y1897 PolarHBondContact N-O 3.06Å; V1890-Y1897 PolarHBondContact O-N 3.11Å; T1892-Y1897 HydrophobicContact CG2-CD2 3.95Å; T1892-Y1897 HydrophobicContact CG2-CE2 3.79Å; E1895-Y1897 HydrophobicContact CB-CD2 4.25Å; E1895-Y1897 HydrophobicContact CB-CE2 3.65Å; E1895-Y1897 VanDerWaalsContact OE2-CZ 3.27Å; E1895-Y1897 PolarHBondContact OE2-OH 3.22Å; Y1897-I1904 HydrophobicContact CD1-CG2 4.41Å; Y1897-W1905 CarbonylContact C-O 3.54Å; Y1897-W1905 VanDerWaalsContact CA-O 3.28Å; Y1897-W1905 WeakPolarHBondContact CA-O 3.31Å; Y1897-V1923 HydrophobicContact CD1-CG2 4.33Å; Y1897-V1923 HydrophobicContact CE1-CG1 4.25Å; Y1897-V1923 HydrophobicContact CE1-CG2 4Å; Y1897-L1984 HydrophobicContact CD1-CD1 3.37Å; Y1897-L1984 VanDerWaalsContact CD1-CD1 3.45Å; Y1897-L1984 HydrophobicContact CD2-CD1 3.88Å; Y1897-L1984 HydrophobicContact CD2-CD2 4.41Å; Y1897-L1984 HydrophobicContact CE1-CD1 3.64Å; Y1897-L1984 HydrophobicContact CE2-CD1 4.16Å; Y1897-L1984 HydrophobicContact CG-CD1 3.48Å; Y1897-L1984 VanDerWaalsContact CG-CD1 3.47Å; Y1897-L1984 HydrophobicContact CG-CD2 4.5Å; Y1897-L1997 HydrophobicContact CE1-CD2 4.29Å; Y1897-L1997 HydrophobicContact CE2-CD2 4.27Å; Y1897-L1997 VanDerWaalsContact OH-CD2 3.23Å; Y1897-L1997 WeakPolarHBondContact OH-CD2 3.41Å; Y1897-K2722 WeakPolarHBondContact OH-CE 3.45Å; Y1897-K2722 PolarHBondContact OH-NZ 2.87Å
1898	F	97.1	Very high	92.3	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	147.6	179.4	61.4	-87.4	0	0	0	112.1	I1835 I1850 L1883 G1888 I1889 D1900 I1904 W1905 L1907	I1835-F1898 HydrophobicContact CD1-CB 4Å; I1835-F1898 HydrophobicContact CD1-CD1 3.9Å; I1835-F1898 HydrophobicContact CD1-CD2 3.43Å; I1835-F1898 VanDerWaalsContact CD1-CD2 3.44Å; I1835-F1898 HydrophobicContact CD1-CE1 4.19Å; I1835-F1898 HydrophobicContact CD1-CE2 3.74Å; I1835-F1898 HydrophobicContact CD1-CG 3.5Å; I1835-F1898 VanDerWaalsContact CD1-CG 3.47Å; I1835-F1898 HydrophobicContact CD1-CZ 4.1Å; I1850-F1898 HydrophobicContact CD1-CD1 4.43Å; I1850-F1898 HydrophobicContact CD1-CE1 3.56Å; I1850-F1898 VanDerWaalsContact CD1-CE1 3.45Å; I1850-F1898 HydrophobicContact CD1-CE2 4.43Å; I1850-F1898 HydrophobicContact CD1-CZ 3.54Å; I1850-F1898 VanDerWaalsContact CD1-CZ 3.49Å; L1883-F1898 HydrophobicContact CD2-CE2 3.87Å; L1883-F1898 HydrophobicContact CD2-CZ 4.5Å; G1888-F1898 CarbonylContact O-C 3.45Å; G1888-F1898 WeakPolarHBondContact O-CA 3.4Å; I1889-F1898 HydrophobicContact CB-CB 4.37Å; I1889-F1898 HydrophobicContact CD1-CB 4.42Å; I1889-F1898 HydrophobicContact CG1-CB 4.1Å; F1898-D1900 HydrophobicContact CD2-CB 4.45Å; F1898-D1900 HydrophobicContact CE2-CB 4.44Å; F1898-I1904 CarbonylContact O-C 3.54Å; F1898-I1904 WeakPolarHBondContact O-CA 3.17Å; F1898-W1905 HydrophobicContact CD1-CB 4.25Å; F1898-W1905 HydrophobicContact CD2-CB 4.1Å; F1898-W1905 HydrophobicContact CD2-CG 4.46Å; F1898-W1905 HydrophobicContact CE1-CB 3.76Å; F1898-W1905 HydrophobicContact CE2-CB 3.6Å; F1898-W1905 AromaticContact CE2-CD1 3.79Å; F1898-W1905 AromaticContact CE2-CG 3.91Å; F1898-W1905 HydrophobicContact CE2-CG 3.91Å; F1898-W1905 HydrophobicContact CG-CB 4.41Å; F1898-W1905 HydrophobicContact CZ-CB 3.42Å; F1898-W1905 VanDerWaalsContact CZ-CB 3.42Å; F1898-W1905 AromaticContact CZ-CG 3.93Å; F1898-W1905 HydrophobicContact CZ-CG 4.05Å; F1898-W1905 PolarHBondContact N-O 3.02Å; F1898-W1905 PolarHBondContact O-N 3.05Å; F1898-L1907 HydrophobicContact CE1-CB 4.43Å
1899	I	97	Very high	91.5	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	133.1	170.9	-68.2	159.2	0	0	0	108.7	P1886 K1887 G1888 S1903 I1904 P1972 E1973 L1975	P1886-I1899 CarbonylContact C-O 3.44Å; P1886-I1899 VanDerWaalsContact CA-O 3.26Å; P1886-I1899 WeakPolarHBondContact CA-O 3.4Å; K1887-I1899 HydrophobicContact CB-CB 4.12Å; K1887-I1899 HydrophobicContact CB-CG2 4.02Å; K1887-I1899 HydrophobicContact CD-CG2 4.28Å; K1887-I1899 HydrophobicContact CG-CG2 4.43Å; K1887-I1899 PolarHBondContact N-O 3.04Å; G1888-I1899 PolarHBondContact O-N 3.23Å; I1899-S1903 CarbonylContact C-O 3.55Å; I1899-S1903 WeakPolarHBondContact CA-O 3.36Å; I1899-I1904 HydrophobicContact CG1-CD1 4.38Å; I1899-I1904 HydrophobicContact CG1-CG1 3.73Å; I1899-P1972 HydrophobicContact CD1-CB 4.07Å; I1899-P1972 HydrophobicContact CG1-CB 4.32Å; I1899-P1972 HydrophobicContact CG2-CB 4.13Å; I1899-P1972 HydrophobicContact CG2-CG 3.81Å; I1899-E1973 VanDerWaalsContact CD1-C 3.47Å; I1899-E1973 WeakPolarHBondContact CD1-O 3.43Å; I1899-L1975 HydrophobicContact CD1-CD1 4.27Å; I1899-L1975 HydrophobicContact CD1-CD2 4.08Å; I1899-L1975 HydrophobicContact CD1-CG 3.78Å; I1899-L1975 HydrophobicContact CG1-CD1 4.08Å; I1899-L1975 HydrophobicContact CG1-CD2 4.16Å; I1899-L1975 HydrophobicContact CG1-CG 4.06Å
1900	D	94.9	Very high	90.1	Very high	9.6 Å²	9.6	23.2 Å²	23.2	5%	0.051	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	113.6	163.7	-178.7	36.2	0	0	0	109.6	L1883 K1884 S1885 F1898 Q1902 S1903	L1883-D1900 HydrophobicContact CD2-CB 4.25Å; K1884-D1900 WeakPolarHBondContact CA-OD1 3.45Å; K1884-D1900 PolarHBondContact N-OD1 3.12Å; K1884-D1900 PolarHBondContact N-OD2 3.13Å; K1884-D1900 VanDerWaalsContact N-OD2 3.1Å; S1885-D1900 VanDerWaalsContact C-OD1 3.23Å; S1885-D1900 PolarHBondContact N-OD1 3.07Å; S1885-D1900 WeakPolarHBondContact O-CA 3.35Å; F1898-D1900 HydrophobicContact CD2-CB 4.45Å; F1898-D1900 HydrophobicContact CE2-CB 4.44Å; D1900-Q1902 PolarHBondContact O-N 3.11Å; D1900-Q1902 VanDerWaalsContact O-N 3.16Å; D1900-S1903 PolarHBondContact N-O 3.01Å; D1900-S1903 PolarHBondContact O-N 2.82Å; D1900-S1903 VanDerWaalsContact O-N 3.1Å
1901	S	92.5	Very high	88.2	Confident	43.4 Å²	43.4	25.9 Å²	25.9	30%	0.303	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	56	-101.5	-176.5	-175.8	0	0	0	0	113.3	S1885 P1972	S1885-S1901 PolarHBondContact O-N 3.14Å; S1901-P1972 WeakPolarHBondContact O-CD 3.49Å; S1901-P1972 WeakPolarHBondContact O-CG 3.28Å
1902	Q	92.4	Very high	86.1	Confident	98.2 Å²	98.2	29.3 Å²	29.3	46%	0.459	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116	26	-177.3	-70	-177.2	-31.8	0	0	111.8	D1900 L1969 N1970	D1900-Q1902 PolarHBondContact O-N 3.11Å; D1900-Q1902 VanDerWaalsContact O-N 3.16Å; Q1902-L1969 WeakPolarHBondContact CB-O 3.37Å; Q1902-L1969 WeakPolarHBondContact CG-O 3.46Å; Q1902-L1969 WeakPolarHBondContact O-CB 3.36Å; Q1902-N1970 WeakPolarHBondContact CG-O 3.39Å; Q1902-N1970 PolarHBondContact NE2-O 3.2Å
1903	S	93.9	Very high	84.1	Confident	6 Å²	6	31.1 Å²	31.1	4%	0.042	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	148.7	-174.8	-63.2	0	0	0	0	111.1	I1899 D1900 I1924 S1926	I1899-S1903 CarbonylContact C-O 3.55Å; I1899-S1903 WeakPolarHBondContact CA-O 3.36Å; D1900-S1903 PolarHBondContact N-O 3.01Å; D1900-S1903 PolarHBondContact O-N 2.82Å; D1900-S1903 VanDerWaalsContact O-N 3.1Å; S1903-I1924 CarbonylContact C-O 3.52Å; S1903-I1924 VanDerWaalsContact CA-O 3.3Å; S1903-I1924 WeakPolarHBondContact CA-O 3.34Å; S1903-S1926 PolarHBondContact OG-N 3.16Å; S1903-S1926 PolarHBondContact OG-O 3.05Å; S1903-S1926 VanDerWaalsContact OG-O 3.13Å
1904	I	96	Very high	82.5	Confident	1.8 Å²	1.8	33.5 Å²	33.5	1%	0.009	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	127.8	171	-64.3	163.8	0	0	0	108	Y1897 F1898 I1899 V1923 I1924 L1969 L1975 F1986	Y1897-I1904 HydrophobicContact CD1-CG2 4.41Å; F1898-I1904 CarbonylContact O-C 3.54Å; F1898-I1904 WeakPolarHBondContact O-CA 3.17Å; I1899-I1904 HydrophobicContact CG1-CD1 4.38Å; I1899-I1904 HydrophobicContact CG1-CG1 3.73Å; I1904-V1923 WeakPolarHBondContact O-CA 3.4Å; I1904-V1923 WeakPolarHBondContact O-CB 3.34Å; I1904-V1923 PolarHBondContact O-N 3.04Å; I1904-I1924 HydrophobicContact CB-CB 4.07Å; I1904-I1924 HydrophobicContact CB-CG1 4.39Å; I1904-I1924 HydrophobicContact CD1-CB 4.28Å; I1904-I1924 HydrophobicContact CD1-CD1 3.89Å; I1904-I1924 HydrophobicContact CD1-CG1 4.46Å; I1904-I1924 HydrophobicContact CG1-CB 4.49Å; I1904-I1924 PolarHBondContact N-O 3.04Å; I1904-I1924 PolarHBondContact O-N 2.95Å; I1904-I1924 VanDerWaalsContact O-N 3.14Å; I1904-L1969 HydrophobicContact CD1-CD1 3.95Å; I1904-L1969 HydrophobicContact CG1-CD1 3.96Å; I1904-L1975 HydrophobicContact CD1-CD2 4.31Å; I1904-F1986 HydrophobicContact CD1-CB 4.24Å; I1904-F1986 HydrophobicContact CD1-CD1 4.11Å; I1904-F1986 HydrophobicContact CD1-CD2 4.05Å; I1904-F1986 HydrophobicContact CD1-CE1 4.39Å; I1904-F1986 HydrophobicContact CD1-CE2 4.37Å; I1904-F1986 HydrophobicContact CD1-CG 3.89Å; I1904-F1986 HydrophobicContact CD1-CZ 4.46Å
1905	W	95	Very high	80.9	Confident	26.8 Å²	26.8	39.3 Å²	39.3	10%	0.102	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	155.5	-178.5	-62.9	83	0	0	0	110.2	Y1897 F1898 R1921 L1922 D1927 Y1930	Y1897-W1905 CarbonylContact C-O 3.54Å; Y1897-W1905 VanDerWaalsContact CA-O 3.28Å; Y1897-W1905 WeakPolarHBondContact CA-O 3.31Å; F1898-W1905 HydrophobicContact CD1-CB 4.25Å; F1898-W1905 HydrophobicContact CD2-CB 4.1Å; F1898-W1905 HydrophobicContact CD2-CG 4.46Å; F1898-W1905 HydrophobicContact CE1-CB 3.76Å; F1898-W1905 HydrophobicContact CE2-CB 3.6Å; F1898-W1905 AromaticContact CE2-CD1 3.79Å; F1898-W1905 AromaticContact CE2-CG 3.91Å; F1898-W1905 HydrophobicContact CE2-CG 3.91Å; F1898-W1905 HydrophobicContact CG-CB 4.41Å; F1898-W1905 HydrophobicContact CZ-CB 3.42Å; F1898-W1905 VanDerWaalsContact CZ-CB 3.42Å; F1898-W1905 AromaticContact CZ-CG 3.93Å; F1898-W1905 HydrophobicContact CZ-CG 4.05Å; F1898-W1905 PolarHBondContact N-O 3.02Å; F1898-W1905 PolarHBondContact O-N 3.05Å; W1905-R1921 CarbonylContact C-O 3.53Å; W1905-R1921 VanDerWaalsContact CA-O 3.27Å; W1905-R1921 WeakPolarHBondContact CA-O 3.32Å; W1905-R1921 VanDerWaalsContact CE3-C 3.46Å; W1905-L1922 HydrophobicContact CD2-CB 4.47Å; W1905-L1922 HydrophobicContact CD2-CD1 4.3Å; W1905-L1922 HydrophobicContact CE3-CB 4.15Å; W1905-L1922 HydrophobicContact CH2-CB 4.17Å; W1905-L1922 HydrophobicContact CH2-CD1 4.43Å; W1905-L1922 HydrophobicContact CZ2-CB 4.45Å; W1905-L1922 HydrophobicContact CZ2-CD1 4.1Å; W1905-L1922 HydrophobicContact CZ3-CB 3.96Å; W1905-D1927 HydrophobicContact CZ2-CB 4.43Å; W1905-Y1930 AromaticContact CH2-CD2 3.68Å; W1905-Y1930 HydrophobicContact CH2-CD2 3.68Å; W1905-Y1930 AromaticContact CH2-CE2 3.91Å; W1905-Y1930 HydrophobicContact CH2-CE2 3.91Å; W1905-Y1930 HydrophobicContact CH2-CG 4.26Å; W1905-Y1930 AromaticContact CZ3-CD2 3.84Å; W1905-Y1930 HydrophobicContact CZ3-CD2 3.84Å; W1905-Y1930 AromaticContact CZ3-CE2 3.55Å; W1905-Y1930 HydrophobicContact CZ3-CE2 3.55Å
1906	S	93.3	Very high	79.1	Confident	3.8 Å²	3.8	43.1 Å²	43.1	3%	0.027	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	149.3	169.1	63	0	0	0	0	111	E1895 L1896 S1920 R1921 V1923	E1895-S1906 WeakPolarHBondContact OE1-CB 3.36Å; E1895-S1906 PolarHBondContact OE1-OG 3.14Å; L1896-S1906 CarbonylContact O-C 3.51Å; L1896-S1906 VanDerWaalsContact O-CA 3.29Å; L1896-S1906 WeakPolarHBondContact O-CA 3.32Å; S1906-S1920 CarbonylContact O-C 3.51Å; S1906-S1920 VanDerWaalsContact O-CA 3.27Å; S1906-S1920 WeakPolarHBondContact O-CA 3.21Å; S1906-R1921 PolarHBondContact N-O 2.98Å; S1906-R1921 PolarHBondContact O-N 2.97Å; S1906-R1921 WeakPolarHBondContact OG-CG 3.49Å; S1906-R1921 PolarHBondContact OG-NE 2.81Å; S1906-R1921 PolarHBondContact OG-O 3.15Å; S1906-V1923 WeakPolarHBondContact OG-CG2 3.32Å
1907	L	89.5	Confident	77.4	Confident	3.6 Å²	3.6	49.5 Å²	49.5	2%	0.019	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	128.8	172.9	168.4	59.7	0	0	0	108.5	L1849 I1850 F1877 I1879 E1895 L1896 F1898 L1909 P1918	L1849-L1907 HydrophobicContact CD1-CD2 4.32Å; L1849-L1907 HydrophobicContact CD2-CD2 3.83Å; L1849-L1907 HydrophobicContact CG-CD2 3.96Å; I1850-L1907 HydrophobicContact CD1-CD2 4.06Å; I1850-L1907 HydrophobicContact CG1-CD2 4.35Å; F1877-L1907 HydrophobicContact CE1-CD2 4.32Å; I1879-L1907 HydrophobicContact CD1-CD1 3.31Å; I1879-L1907 VanDerWaalsContact CD1-CD1 3.46Å; I1879-L1907 HydrophobicContact CD1-CD2 3.92Å; I1879-L1907 HydrophobicContact CD1-CG 4.23Å; E1895-L1907 CarbonylContact C-O 3.49Å; E1895-L1907 VanDerWaalsContact CA-O 3.24Å; E1895-L1907 WeakPolarHBondContact CA-O 3.4Å; L1896-L1907 HydrophobicContact CB-CB 4.38Å; L1896-L1907 HydrophobicContact CD2-CD2 4.41Å; L1896-L1907 PolarHBondContact N-O 2.85Å; L1896-L1907 PolarHBondContact O-N 3.05Å; F1898-L1907 HydrophobicContact CE1-CB 4.43Å; L1907-L1909 PolarHBondContact O-N 3.01Å; L1907-P1918 HydrophobicContact CD1-CB 4.34Å
1908	S	83.9	Confident	75.9	Confident	46.4 Å²	46.4	50.5 Å²	50.5	32%	0.324	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	128.7	172.3	-173.4	0	0	0	0	111.1	R1910	S1908-R1910 VanDerWaalsContact C-N 3.3Å; S1908-R1910 PolarHBondContact OG-N 2.86Å; S1908-R1910 VanDerWaalsContact OG-N 3.14Å; S1908-R1910 PolarHBondContact OG-O 3.07Å
1909	L	78.1	Confident	74.9	Confident	11 Å²	11	56.7 Å²	56.7	6%	0.058	31%	0.311	C	S	.	.	S	Bend	trans	-87.2	-3	172	-65.2	177.7	0	0	0	112.4	F1821 F1826 A1891 T1894 L1896 L1907	F1821-L1909 HydrophobicContact CB-CB 4.31Å; F1821-L1909 HydrophobicContact CB-CD2 4.16Å; F1821-L1909 HydrophobicContact CD2-CB 4.24Å; F1821-L1909 HydrophobicContact CD2-CD2 4.11Å; F1821-L1909 WeakPolarHBondContact CD2-O 3.25Å; F1821-L1909 HydrophobicContact CE2-CD2 4.38Å; F1821-L1909 HydrophobicContact CG-CD2 4.1Å; F1821-L1909 PolarHBondContact N-O 3.19Å; F1826-L1909 HydrophobicContact CE1-CD2 3.72Å; F1826-L1909 HydrophobicContact CE2-CD1 4.25Å; F1826-L1909 HydrophobicContact CE2-CD2 4.38Å; F1826-L1909 HydrophobicContact CZ-CD1 3.96Å; F1826-L1909 HydrophobicContact CZ-CD2 3.53Å; F1826-L1909 VanDerWaalsContact CZ-CD2 3.47Å; F1826-L1909 HydrophobicContact CZ-CG 4.31Å; A1891-L1909 HydrophobicContact CB-CD1 4.33Å; T1894-L1909 WeakPolarHBondContact O-CB 3.38Å; T1894-L1909 PolarHBondContact O-N 3.04Å; L1896-L1909 HydrophobicContact CB-CD1 4.29Å; L1896-L1909 HydrophobicContact CB-CD2 3.88Å; L1896-L1909 HydrophobicContact CB-CG 4.07Å; L1907-L1909 PolarHBondContact O-N 3.01Å
1910	R	68.5	Low	74.3	Confident	87.8 Å²	87.8	57.6 Å²	57.6	33%	0.331	32%	0.317	S	S	.	.	S	Bend	trans	-107.3	129.8	174.7	-72.3	-175	173.3	-139.6	-1.3	110.5	N1382 D1820 T1894 S1908 S2719	N1382-R1910 PolarHBondContact ND2-NH2 3.13Å; D1820-R1910 WeakPolarHBondContact OD1-CG 3.28Å; D1820-R1910 IonicContact OD1-CZ 2.77Å; D1820-R1910 IonicContact OD1-NE 2.77Å; D1820-R1910 PolarHBondContact OD1-NE 3.41Å; D1820-R1910 VanDerWaalsContact OD1-NE 3.11Å; D1820-R1910 IonicContact OD1-NH2 3.88Å; D1820-R1910 IonicContact OD2-CZ 3.58Å; D1820-R1910 IonicContact OD2-NE 3.55Å; D1820-R1910 PolarHBondContact OD2-NE 3.03Å; D1820-R1910 IonicContact OD2-NH2 3.21Å; D1820-R1910 PolarHBondContact OD2-NH2 3.01Å; T1894-R1910 HydrophobicContact CG2-CG 4.28Å; S1908-R1910 VanDerWaalsContact C-N 3.3Å; S1908-R1910 PolarHBondContact OG-N 2.86Å; S1908-R1910 VanDerWaalsContact OG-N 3.14Å; S1908-R1910 PolarHBondContact OG-O 3.07Å; R1910-S2719 WeakPolarHBondContact CD-O 3.34Å; R1910-S2719 VanDerWaalsContact CZ-O 3.29Å; R1910-S2719 PolarHBondContact NE-O 3.07Å; R1910-S2719 PolarHBondContact NH1-O 3.1Å
1911	Q	56.2	Low	73.9	Confident	68 Å²	68	62.6 Å²	62.6	32%	0.318	34%	0.335	S	S	.	.			trans	-91	119.4	170.4	-108.4	-174.9	-12.1	0	0	110.3	G1817 G1818 F1877 G1913 M1916	G1817-Q1911 PolarHBondContact O-NE2 3.44Å; G1817-Q1911 PolarHBondContact O-OE1 3.01Å; G1817-Q1911 VanDerWaalsContact O-OE1 3.08Å; G1818-Q1911 VanDerWaalsContact CA-CD 3.49Å; G1818-Q1911 VanDerWaalsContact CA-OE1 3.29Å; F1877-Q1911 VanDerWaalsContact CD1-OE1 3.22Å; F1877-Q1911 HydrophobicContact CE1-CB 4.39Å; F1877-Q1911 HydrophobicContact CE1-CG 4.5Å; F1877-Q1911 VanDerWaalsContact CE1-OE1 3.25Å; F1877-Q1911 HydrophobicContact CE2-CG 4.33Å; Q1911-G1913 PolarHBondContact O-N 3.16Å; Q1911-M1916 PolarHBondContact NE2-O 2.97Å
1912	T	48.3	Very low	73.8	Confident	75.8 Å²	75.8	62.8 Å²	62.8	47%	0.465	33%	0.332	S	S	.	.			trans	-105.8	90.2	175.4	49.5	0	0	0	0	109.9	I1422 L1423 M1916	I1422-T1912 HydrophobicContact CD1-CG2 3.76Å; L1423-T1912 HydrophobicContact CD1-CG2 4.4Å; L1423-T1912 HydrophobicContact CD2-CG2 3.76Å; T1912-M1916 HydrophobicContact CG2-CE 4.02Å; T1912-M1916 HydrophobicContact CG2-SD 4.32Å; T1912-M1916 WeakPolarHBondContact O-CB 3.5Å; T1912-M1916 VanDerWaalsContact OG1-CB 3.3Å; T1912-M1916 WeakPolarHBondContact OG1-CB 3.28Å; T1912-M1916 WeakPolarHBondContact OG1-CE 3.46Å; T1912-M1916 PolarHBondContact OG1-SD 3.06Å
1913	G	47.6	Very low	73.7	Confident	44 Å²	44	58.6 Å²	58.6	45%	0.454	31%	0.313	S	S	.	.	S	Bend	trans	86.2	147.2	174.6	0	0	0	0	0	114.8	Q1911 N1915 M1916	Q1911-G1913 PolarHBondContact O-N 3.16Å; G1913-N1915 PolarHBondContact O-N 2.91Å; G1913-M1916 PolarHBondContact O-N 2.79Å
1914	S	48.6	Very low	73.6	Confident	108.6 Å²	108.6	58.4 Å²	58.4	76%	0.759	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-1.6	-171.8	65.2	0	0	0	0	115.9
1915	N	47.7	Very low	73.1	Confident	147.4 Å²	147.4	58.5 Å²	58.5	79%	0.788	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.9	-0	-171.5	-78.2	0.6	0	0	0	114.7	G1913	G1913-N1915 PolarHBondContact O-N 2.91Å
1916	M	50.4	Low	72.1	Confident	115.2 Å²	115.2	60.4 Å²	60.4	57%	0.567	33%	0.331	S	S	*	.			trans	-94.4	113	174.2	-103.7	-160.5	38.6	0	0	110.1	Q1911 T1912 G1913 P1918 F1919	Q1911-M1916 PolarHBondContact NE2-O 2.97Å; T1912-M1916 HydrophobicContact CG2-CE 4.02Å; T1912-M1916 HydrophobicContact CG2-SD 4.32Å; T1912-M1916 WeakPolarHBondContact O-CB 3.5Å; T1912-M1916 VanDerWaalsContact OG1-CB 3.3Å; T1912-M1916 WeakPolarHBondContact OG1-CB 3.28Å; T1912-M1916 WeakPolarHBondContact OG1-CE 3.46Å; T1912-M1916 PolarHBondContact OG1-SD 3.06Å; G1913-M1916 PolarHBondContact O-N 2.79Å; M1916-P1918 WeakPolarHBondContact O-CD 3.39Å; M1916-F1919 HydrophobicContact CE-CE1 4.09Å
1917	I	58.4	Low	70.8	Confident	133.6 Å²	133.6	62.6 Å²	62.6	69%	0.685	34%	0.342	S	S	*	.			trans	-65.1	124.8	171.1	-57.8	170	0	0	0	107.3	F1919	I1917-F1919 PolarHBondContact O-N 3.13Å
1918	P	65.1	Low	69.3	Low	28.8 Å²	28.8	66.5 Å²	66.5	19%	0.187	37%	0.368	C	S	.	.			trans	-61.6	134	176.8	25.2	-32.3	0	0	0	109.7	F1877 I1879 L1907 M1916	F1877-P1918 HydrophobicContact CD1-CG 4.15Å; F1877-P1918 HydrophobicContact CD2-CB 4.14Å; F1877-P1918 HydrophobicContact CD2-CG 4.01Å; F1877-P1918 HydrophobicContact CE1-CB 4.33Å; F1877-P1918 HydrophobicContact CE1-CG 4.27Å; F1877-P1918 HydrophobicContact CE2-CB 3.88Å; F1877-P1918 HydrophobicContact CE2-CG 3.85Å; F1877-P1918 HydrophobicContact CG-CG 4.25Å; F1877-P1918 HydrophobicContact CZ-CB 3.84Å; F1877-P1918 HydrophobicContact CZ-CG 4.1Å; I1879-P1918 HydrophobicContact CD1-CB 3.94Å; I1879-P1918 HydrophobicContact CD1-CG 4.28Å; I1879-P1918 WeakPolarHBondContact CD1-O 3.24Å; I1879-P1918 HydrophobicContact CG1-CB 4.14Å; I1879-P1918 HydrophobicContact CG1-CG 4.04Å; I1879-P1918 WeakPolarHBondContact CG1-O 3.25Å; L1907-P1918 HydrophobicContact CD1-CB 4.34Å; M1916-P1918 WeakPolarHBondContact O-CD 3.39Å
1919	F	74.8	Confident	67.9	Low	130.8 Å²	130.8	71.1 Å²	71.1	57%	0.574	39%	0.389	S	S	*	.			trans	-131.5	146.7	177	68.3	-87.3	0	0	0	110.1	M1916 I1917 R1921	M1916-F1919 HydrophobicContact CE-CE1 4.09Å; I1917-F1919 PolarHBondContact O-N 3.13Å; F1919-R1921 HydrophobicContact CE2-CB 4.19Å
1920	S	84.4	Confident	66.5	Low	18.8 Å²	18.8	78.5 Å²	78.5	13%	0.131	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	143.5	171.5	59.2	0	0	0	0	110.4	Q1881 S1906 Y1930	Q1881-S1920 VanDerWaalsContact CD-OG 3.29Å; Q1881-S1920 PolarHBondContact NE2-OG 2.94Å; Q1881-S1920 PolarHBondContact OE1-OG 3.05Å; S1906-S1920 CarbonylContact O-C 3.51Å; S1906-S1920 VanDerWaalsContact O-CA 3.27Å; S1906-S1920 WeakPolarHBondContact O-CA 3.21Å; S1920-Y1930 PolarHBondContact O-OH 3.42Å
1921	R	88	Confident	65.2	Low	115.4 Å²	115.4	79.4 Å²	79.4	44%	0.435	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	134.2	176.7	158.3	179.3	172.5	139.4	-1.7	110.3	T1418 E1895 W1905 S1906 F1919 V1923	T1418-R1921 PolarHBondContact OG1-NH1 2.85Å; E1895-R1921 IonicContact OE1-CZ 2.75Å; E1895-R1921 IonicContact OE1-NE 3.08Å; E1895-R1921 PolarHBondContact OE1-NE 2.86Å; E1895-R1921 IonicContact OE1-NH2 3.66Å; E1895-R1921 PolarHBondContact OE1-NH2 2.9Å; E1895-R1921 IonicContact OE2-NH2 3.44Å; E1895-R1921 PolarHBondContact OE2-NH2 2.87Å; W1905-R1921 CarbonylContact C-O 3.53Å; W1905-R1921 VanDerWaalsContact CA-O 3.27Å; W1905-R1921 WeakPolarHBondContact CA-O 3.32Å; W1905-R1921 VanDerWaalsContact CE3-C 3.46Å; S1906-R1921 PolarHBondContact N-O 2.98Å; S1906-R1921 PolarHBondContact O-N 2.97Å; S1906-R1921 WeakPolarHBondContact OG-CG 3.49Å; S1906-R1921 PolarHBondContact OG-NE 2.81Å; S1906-R1921 PolarHBondContact OG-O 3.15Å; F1919-R1921 HydrophobicContact CE2-CB 4.19Å; R1921-V1923 HydrophobicContact CG-CG2 4.37Å; R1921-V1923 WeakPolarHBondContact O-CG2 3.44Å; R1921-V1923 PolarHBondContact O-N 2.84Å
1922	L	89.6	Confident	64.3	Low	46.2 Å²	46.2	80.8 Å²	80.8	24%	0.242	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	128.7	170	-178.2	65.5	0	0	0	110.1	W1905 I1924 D1927 Y1930	W1905-L1922 HydrophobicContact CD2-CB 4.47Å; W1905-L1922 HydrophobicContact CD2-CD1 4.3Å; W1905-L1922 HydrophobicContact CE3-CB 4.15Å; W1905-L1922 HydrophobicContact CH2-CB 4.17Å; W1905-L1922 HydrophobicContact CH2-CD1 4.43Å; W1905-L1922 HydrophobicContact CZ2-CB 4.45Å; W1905-L1922 HydrophobicContact CZ2-CD1 4.1Å; W1905-L1922 HydrophobicContact CZ3-CB 3.96Å; L1922-I1924 WeakPolarHBondContact CD1-O 3.29Å; L1922-D1927 HydrophobicContact CD2-CB 4.07Å; L1922-Y1930 HydrophobicContact CB-CD1 3.97Å; L1922-Y1930 HydrophobicContact CB-CE1 3.73Å; L1922-Y1930 HydrophobicContact CD2-CD1 4.09Å
1923	V	90.7	Very high	63.4	Low	10.8 Å²	10.8	83 Å²	83	7%	0.065	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	-47.4	-176.9	-173.1	0	0	0	0	111.3	Y1897 I1904 S1906 R1921 G1964 N1965 Y1995	Y1897-V1923 HydrophobicContact CD1-CG2 4.33Å; Y1897-V1923 HydrophobicContact CE1-CG1 4.25Å; Y1897-V1923 HydrophobicContact CE1-CG2 4Å; I1904-V1923 WeakPolarHBondContact O-CA 3.4Å; I1904-V1923 WeakPolarHBondContact O-CB 3.34Å; I1904-V1923 PolarHBondContact O-N 3.04Å; S1906-V1923 WeakPolarHBondContact OG-CG2 3.32Å; R1921-V1923 HydrophobicContact CG-CG2 4.37Å; R1921-V1923 WeakPolarHBondContact O-CG2 3.44Å; R1921-V1923 PolarHBondContact O-N 2.84Å; V1923-G1964 CarbonylContact O-C 3.56Å; V1923-G1964 VanDerWaalsContact O-C 3.27Å; V1923-N1965 PolarHBondContact O-N 2.73Å; V1923-Y1995 HydrophobicContact CG1-CD1 4.4Å; V1923-Y1995 HydrophobicContact CG1-CE1 3.56Å; V1923-Y1995 VanDerWaalsContact CG1-CE1 3.47Å; V1923-Y1995 HydrophobicContact CG1-CE2 4.14Å; V1923-Y1995 VanDerWaalsContact CG1-CZ 3.43Å; V1923-Y1995 VanDerWaalsContact CG1-OH 3.26Å; V1923-Y1995 WeakPolarHBondContact CG1-OH 3.37Å
1924	I	91.4	Very high	62.8	Low	1.6 Å²	1.6	86.6 Å²	86.6	1%	0.008	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	141.4	180	-49	179.1	0	0	0	109	S1903 I1904 L1922 G1964 M1967 L1969 F1986 Y1995 V2002	S1903-I1924 CarbonylContact C-O 3.52Å; S1903-I1924 VanDerWaalsContact CA-O 3.3Å; S1903-I1924 WeakPolarHBondContact CA-O 3.34Å; I1904-I1924 HydrophobicContact CB-CB 4.07Å; I1904-I1924 HydrophobicContact CB-CG1 4.39Å; I1904-I1924 HydrophobicContact CD1-CB 4.28Å; I1904-I1924 HydrophobicContact CD1-CD1 3.89Å; I1904-I1924 HydrophobicContact CD1-CG1 4.46Å; I1904-I1924 HydrophobicContact CG1-CB 4.49Å; I1904-I1924 PolarHBondContact N-O 3.04Å; I1904-I1924 PolarHBondContact O-N 2.95Å; I1904-I1924 VanDerWaalsContact O-N 3.14Å; L1922-I1924 WeakPolarHBondContact CD1-O 3.29Å; I1924-G1964 WeakPolarHBondContact CA-O 3.33Å; I1924-G1964 WeakPolarHBondContact CG2-O 3.36Å; I1924-M1967 HydrophobicContact CG2-CB 4.01Å; I1924-M1967 HydrophobicContact CG2-CG 4.29Å; I1924-M1967 HydrophobicContact CG2-SD 4.31Å; I1924-L1969 HydrophobicContact CB-CD1 4.4Å; I1924-L1969 HydrophobicContact CG2-CD1 3.97Å; I1924-L1969 HydrophobicContact CG2-CD2 3.98Å; I1924-L1969 HydrophobicContact CG2-CG 4.07Å; I1924-F1986 HydrophobicContact CD1-CD1 4.35Å; I1924-F1986 HydrophobicContact CD1-CE1 3.65Å; I1924-F1986 HydrophobicContact CD1-CZ 4.03Å; I1924-Y1995 HydrophobicContact CD1-CD1 4.4Å; I1924-Y1995 HydrophobicContact CD1-CD2 3.75Å; I1924-Y1995 HydrophobicContact CD1-CE2 4.35Å; I1924-Y1995 HydrophobicContact CD1-CG 3.76Å; I1924-Y1995 HydrophobicContact CG1-CD2 4.21Å; I1924-Y1995 HydrophobicContact CG1-CE2 4.35Å; I1924-V2002 HydrophobicContact CD1-CG2 3.9Å; I1924-V2002 HydrophobicContact CG1-CG2 4.38Å; I1924-V2002 HydrophobicContact CG2-CG2 4.45Å
1925	G	85.2	Confident	61.8	Low	4 Å²	4	90.4 Å²	90.4	4%	0.041	48%	0.481	C	S	.	.	S	Bend	trans	99.3	-172.8	-176.6	0	0	0	0	0	113.1	G1964 M1967	G1925-G1964 PolarHBondContact N-O 3.12Å; G1925-M1967 VanDerWaalsContact CA-O 3.28Å; G1925-M1967 WeakPolarHBondContact CA-O 3.34Å; G1925-M1967 PolarHBondContact N-O 2.9Å; G1925-M1967 VanDerWaalsContact N-O 3.1Å
1926	S	74.2	Confident	60.9	Low	66 Å²	66	88.2 Å²	88.2	46%	0.462	48%	0.478	S	S	.	.			trans	-120.5	135.9	178.7	55.3	0	0	0	0	111	S1903 P1928 L1968	S1903-S1926 PolarHBondContact OG-N 3.16Å; S1903-S1926 PolarHBondContact OG-O 3.05Å; S1903-S1926 VanDerWaalsContact OG-O 3.13Å; S1926-P1928 VanDerWaalsContact O-CD 3.26Å; S1926-P1928 WeakPolarHBondContact O-CD 3.21Å; S1926-L1968 WeakPolarHBondContact OG-CD2 3.44Å
1927	D	66.3	Low	59.9	Low	50.2 Å²	50.2	90 Å²	90	27%	0.268	49%	0.489	S	S	.	.			trans	-76.3	118.4	173.7	-177.1	2.3	0	0	0	110	K1884 W1905 L1922 N1929 Y1930	K1884-D1927 IonicContact NZ-OD1 3.99Å; K1884-D1927 PolarHBondContact NZ-OD1 3.05Å; W1905-D1927 HydrophobicContact CZ2-CB 4.43Å; L1922-D1927 HydrophobicContact CD2-CB 4.07Å; D1927-N1929 PolarHBondContact O-N 2.96Å; D1927-N1929 VanDerWaalsContact O-N 3.1Å; D1927-N1929 WeakPolarHBondContact OD1-CB 3.33Å; D1927-N1929 PolarHBondContact OD1-N 2.98Å; D1927-Y1930 CarbonylContact O-C 3.6Å; D1927-Y1930 WeakPolarHBondContact O-CB 3.13Å; D1927-Y1930 PolarHBondContact O-N 2.92Å; D1927-Y1930 VanDerWaalsContact O-N 3.13Å
1928	P	57.2	Low	58.3	Low	86.6 Å²	86.6	91 Å²	91	56%	0.562	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-22.2	178.8	15.7	-21.5	0	0	0	113.8	K1884 S1926 Y1930	K1884-P1928 VanDerWaalsContact NZ-CB 3.29Å; S1926-P1928 VanDerWaalsContact O-CD 3.26Å; S1926-P1928 WeakPolarHBondContact O-CD 3.21Å; P1928-Y1930 VanDerWaalsContact C-N 3.33Å
1929	N	54.3	Low	56.5	Low	143 Å²	143	94.8 Å²	94.8	77%	0.765	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-13.9	178.3	-69	-25.5	0	0	0	113	D1927 S1931	D1927-N1929 PolarHBondContact O-N 2.96Å; D1927-N1929 VanDerWaalsContact O-N 3.1Å; D1927-N1929 WeakPolarHBondContact OD1-CB 3.33Å; D1927-N1929 PolarHBondContact OD1-N 2.98Å; N1929-S1931 PolarHBondContact O-N 2.78Å
1930	Y	50	Low	54.1	Low	165.4 Å²	165.4	95.2 Å²	95.2	65%	0.649	53%	0.531	S	S	*	.			trans	-103.5	64.4	-179.3	-132.8	-93.6	0	0	0	111.2	W1905 S1920 L1922 D1927 P1928 S1932	W1905-Y1930 AromaticContact CH2-CD2 3.68Å; W1905-Y1930 HydrophobicContact CH2-CD2 3.68Å; W1905-Y1930 AromaticContact CH2-CE2 3.91Å; W1905-Y1930 HydrophobicContact CH2-CE2 3.91Å; W1905-Y1930 HydrophobicContact CH2-CG 4.26Å; W1905-Y1930 AromaticContact CZ3-CD2 3.84Å; W1905-Y1930 HydrophobicContact CZ3-CD2 3.84Å; W1905-Y1930 AromaticContact CZ3-CE2 3.55Å; W1905-Y1930 HydrophobicContact CZ3-CE2 3.55Å; S1920-Y1930 PolarHBondContact O-OH 3.42Å; L1922-Y1930 HydrophobicContact CB-CD1 3.97Å; L1922-Y1930 HydrophobicContact CB-CE1 3.73Å; L1922-Y1930 HydrophobicContact CD2-CD1 4.09Å; D1927-Y1930 CarbonylContact O-C 3.6Å; D1927-Y1930 WeakPolarHBondContact O-CB 3.13Å; D1927-Y1930 PolarHBondContact O-N 2.92Å; D1927-Y1930 VanDerWaalsContact O-N 3.13Å; P1928-Y1930 VanDerWaalsContact C-N 3.33Å; Y1930-S1932 VanDerWaalsContact C-N 3.31Å; Y1930-S1932 PolarHBondContact O-N 3.03Å
1931	S	40.4	Very low	51.5	Low	106.6 Å²	106.6	100.5 Å²	100.5	75%	0.745	56%	0.564	S	S	*	*			trans	-70.2	100.7	163.4	-179.7	0	0	0	0	108.6	N1929 N1933	N1929-S1931 PolarHBondContact O-N 2.78Å; S1931-N1933 VanDerWaalsContact C-N 3.34Å; S1931-N1933 PolarHBondContact O-N 3.12Å; S1931-N1933 VanDerWaalsContact O-N 3.12Å
1932	S	38.2	Very low	48.6	Very low	97.2 Å²	97.2	101.1 Å²	101.1	68%	0.68	59%	0.585	S	S	*	*			trans	-58.4	90.7	174.5	62.7	0	0	0	0	111.7	Y1930 P1934	Y1930-S1932 VanDerWaalsContact C-N 3.31Å; Y1930-S1932 PolarHBondContact O-N 3.03Å; S1932-P1934 VanDerWaalsContact O-CD 3.23Å; S1932-P1934 WeakPolarHBondContact O-CD 3.28Å
1933	N	28.9	Very low	45.6	Very low	123.4 Å²	123.4	102 Å²	102	66%	0.66	61%	0.606	S	S	*	*			trans	-98.6	105.2	160	-124.4	-30.4	0	0	0	109.2	S1931 K1935	S1931-N1933 VanDerWaalsContact C-N 3.34Å; S1931-N1933 PolarHBondContact O-N 3.12Å; S1931-N1933 VanDerWaalsContact O-N 3.12Å; N1933-K1935 PolarHBondContact O-N 2.91Å
1934	P	34.4	Very low	42.6	Very low	119.8 Å²	119.8	107.8 Å²	107.8	78%	0.778	64%	0.642	S	S	*	*	S	Bend	trans	-73.3	64.6	174.8	22.4	-18.8	0	0	0	110.6	S1932 S1936	S1932-P1934 VanDerWaalsContact O-CD 3.23Å; S1932-P1934 WeakPolarHBondContact O-CD 3.28Å; P1934-S1936 PolarHBondContact O-N 3.31Å
1935	K	27.9	Very low	39.5	Very low	187.2 Å²	187.2	113.5 Å²	113.5	81%	0.814	68%	0.682	S	S	*	*			trans	-108.9	47.7	-175.5	-79.6	-173.1	177.9	177.5	0	113.5	N1933 L1937	N1933-K1935 PolarHBondContact O-N 2.91Å; K1935-L1937 PolarHBondContact O-N 3.07Å; K1935-L1937 VanDerWaalsContact O-N 3.14Å
1936	S	29	Very low	36.8	Very low	101.4 Å²	101.4	120.2 Å²	120.2	71%	0.709	72%	0.715	S	S	*	*			trans	-132.3	75	167	69.5	0	0	0	0	112.4	P1934 N1938	P1934-S1936 PolarHBondContact O-N 3.31Å; S1936-N1938 PolarHBondContact O-N 3.12Å
1937	L	29.3	Very low	34.6	Very low	152.4 Å²	152.4	121.9 Å²	121.9	80%	0.798	72%	0.724	S	S	*	*			trans	-138	72	154.4	-149.1	78	0	0	0	109.3	K1935 T1939	K1935-L1937 PolarHBondContact O-N 3.07Å; K1935-L1937 VanDerWaalsContact O-N 3.14Å; L1937-T1939 VanDerWaalsContact C-N 3.27Å; L1937-T1939 PolarHBondContact O-N 3.25Å
1938	N	24.9	Very low	32.8	Very low	155.8 Å²	155.8	129.4 Å²	129.4	83%	0.833	75%	0.754	S	S	*	*			trans	-64.8	76.8	163.7	-75.7	-10.8	0	0	0	110.1	S1936	S1936-N1938 PolarHBondContact O-N 3.12Å
1939	T	26.7	Very low	31.5	Very low	107.2 Å²	107.2	130.8 Å²	130.8	66%	0.658	76%	0.761	S	S	*	*			trans	-107.9	102.9	156	33.3	0	0	0	0	108.3	L1937 T1941	L1937-T1939 VanDerWaalsContact C-N 3.27Å; L1937-T1939 PolarHBondContact O-N 3.25Å; T1939-T1941 PolarHBondContact O-N 3.08Å; T1939-T1941 VanDerWaalsContact O-N 3.09Å
1940	T	25	Very low	30.5	Very low	139.4 Å²	139.4	129.2 Å²	129.2	86%	0.855	76%	0.757	S	S	*	*			trans	-63.6	96.9	174	46.8	0	0	0	0	110.8
1941	T	29.4	Very low	29.9	Very low	131.8 Å²	131.8	127.2 Å²	127.2	81%	0.809	77%	0.765	S	S	*	*			trans	-125.7	110.6	155.2	44.5	0	0	0	0	108.9	T1939 G1943	T1939-T1941 PolarHBondContact O-N 3.08Å; T1939-T1941 VanDerWaalsContact O-N 3.09Å; T1941-G1943 PolarHBondContact O-N 3.3Å
1942	S	26.8	Very low	29.9	Very low	126.4 Å²	126.4	126.9 Å²	126.9	88%	0.884	76%	0.762	S	S	*	*			trans	-62.9	126.9	173.4	46.5	0	0	0	0	111.8
1943	G	26.9	Very low	30.4	Very low	66 Å²	66	126.7 Å²	126.7	68%	0.68	76%	0.761	S	S	*	*			trans	123.7	93.8	156.9	0	0	0	0	0	115.4	T1941	T1941-G1943 PolarHBondContact O-N 3.3Å
1944	T	27.6	Very low	31.8	Very low	133.4 Å²	133.4	122.4 Å²	122.4	82%	0.818	74%	0.741	S	S	*	*			trans	146.4	114.6	146	39	0	0	0	0	111.8	I1946	T1944-I1946 PolarHBondContact O-N 2.97Å
1945	S	26.8	Very low	33.2	Very low	121.2 Å²	121.2	119.3 Å²	119.3	85%	0.848	72%	0.72	S	S	*	*			trans	-67.5	95.3	172.8	51.5	0	0	0	0	110.8	P1947	S1945-P1947 WeakPolarHBondContact O-CD 3.5Å
1946	I	29.1	Very low	35	Very low	144.6 Å²	144.6	110.5 Å²	110.5	74%	0.742	68%	0.681	S	S	*	*			trans	-75.1	124.3	163	-58.5	174.1	0	0	0	106.4	T1944 K1948	T1944-I1946 PolarHBondContact O-N 2.97Å; I1946-K1948 PolarHBondContact O-N 2.92Å; I1946-K1948 VanDerWaalsContact O-N 3.09Å
1947	P	28.2	Very low	37	Very low	100.6 Å²	100.6	108.7 Å²	108.7	65%	0.653	67%	0.667	S	S	*	*			trans	-58.8	129.3	178.7	-2.3	6.4	0	0	0	109.3	S1945 T1949	S1945-P1947 WeakPolarHBondContact O-CD 3.5Å; P1947-T1949 VanDerWaalsContact C-N 3.31Å; P1947-T1949 HydrophobicContact CB-CG2 4.36Å; P1947-T1949 PolarHBondContact O-N 3.02Å
1948	K	28.2	Very low	39.1	Very low	208 Å²	208	103.7 Å²	103.7	90%	0.904	65%	0.645	S	S	*	*			trans	-62.1	85.3	166	-76	-179.7	175.3	179.4	0	108	I1946 T1950	I1946-K1948 PolarHBondContact O-N 2.92Å; I1946-K1948 VanDerWaalsContact O-N 3.09Å; K1948-T1950 VanDerWaalsContact C-N 3.26Å; K1948-T1950 PolarHBondContact O-N 3.19Å; K1948-T1950 VanDerWaalsContact O-N 3.11Å
1949	T	30.1	Very low	41.5	Very low	115.6 Å²	115.6	99.9 Å²	99.9	71%	0.709	62%	0.624	S	S	*	*			trans	-66.1	111.7	162.4	47.7	0	0	0	0	106.2	P1947	P1947-T1949 VanDerWaalsContact C-N 3.31Å; P1947-T1949 HydrophobicContact CB-CG2 4.36Å; P1947-T1949 PolarHBondContact O-N 3.02Å
1950	T	33.2	Very low	44	Very low	110.2 Å²	110.2	102.1 Å²	102.1	68%	0.676	62%	0.621	S	S	*	*			trans	-45.9	133.8	164.3	40.7	0	0	0	0	108.7	K1948 S1952	K1948-T1950 VanDerWaalsContact C-N 3.26Å; K1948-T1950 PolarHBondContact O-N 3.19Å; K1948-T1950 VanDerWaalsContact O-N 3.11Å; T1950-S1952 WeakPolarHBondContact CB-OG 3.48Å; T1950-S1952 PolarHBondContact O-N 3.1Å; T1950-S1952 PolarHBondContact O-OG 3.03Å; T1950-S1952 PolarHBondContact OG1-OG 2.8Å
1951	P	36.3	Very low	47	Very low	123.8 Å²	123.8	96.5 Å²	96.5	80%	0.804	59%	0.587	S	S	*	*			trans	-66.7	80.7	179.8	26.6	-32.2	0	0	0	109.6	S1953 L1968	P1951-S1953 PolarHBondContact O-N 3Å; P1951-L1968 HydrophobicContact CB-CD1 4.39Å
1952	S	40.5	Very low	49.7	Very low	99.4 Å²	99.4	91.3 Å²	91.3	70%	0.695	56%	0.555	S	S	*	*			trans	-87.1	88.3	-177.8	48.2	0	0	0	0	109.4	T1950	T1950-S1952 WeakPolarHBondContact CB-OG 3.48Å; T1950-S1952 PolarHBondContact O-N 3.1Å; T1950-S1952 PolarHBondContact O-OG 3.03Å; T1950-S1952 PolarHBondContact OG1-OG 2.8Å
1953	S	48.4	Very low	52.6	Low	92.2 Å²	92.2	86.1 Å²	86.1	65%	0.645	52%	0.518	S	S	*	.			trans	47	91.3	167.6	166.1	0	0	0	0	114.3	P1951 T1955	P1951-S1953 PolarHBondContact O-N 3Å; S1953-T1955 VanDerWaalsContact C-N 3.3Å; S1953-T1955 PolarHBondContact O-N 2.94Å; S1953-T1955 VanDerWaalsContact O-N 3.12Å; S1953-T1955 PolarHBondContact OG-O 2.77Å; S1953-T1955 PolarHBondContact OG-OG1 2.81Å
1954	S	59.3	Low	55.3	Low	35 Å²	35	83.1 Å²	83.1	25%	0.245	49%	0.487	C	S	.	.			trans	-83.2	24.4	179.4	54.8	0	0	0	0	114.8	Q1966 M1967 L1968	S1954-Q1966 WeakPolarHBondContact CB-O 3.32Å; S1954-Q1966 PolarHBondContact OG-O 3.41Å; S1954-M1967 WeakPolarHBondContact O-CA 3.28Å; S1954-L1968 VanDerWaalsContact OG-CB 3.28Å; S1954-L1968 WeakPolarHBondContact OG-CB 3.09Å; S1954-L1968 VanDerWaalsContact OG-CD1 3.24Å; S1954-L1968 WeakPolarHBondContact OG-CD1 3.35Å; S1954-L1968 WeakPolarHBondContact OG-CG 3.32Å; S1954-L1968 PolarHBondContact OG-N 3.1Å; S1954-L1968 VanDerWaalsContact OG-N 3.12Å
1955	T	63.2	Low	57.9	Low	54.4 Å²	54.4	82.4 Å²	82.4	33%	0.334	48%	0.478	S	S	.	.	S	Bend	trans	-91.7	138.7	169.2	13	0	0	0	0	109.2	S1953 Y1993 L2009	S1953-T1955 VanDerWaalsContact C-N 3.3Å; S1953-T1955 PolarHBondContact O-N 2.94Å; S1953-T1955 VanDerWaalsContact O-N 3.12Å; S1953-T1955 PolarHBondContact OG-O 2.77Å; S1953-T1955 PolarHBondContact OG-OG1 2.81Å; T1955-Y1993 WeakPolarHBondContact CG2-OH 3.11Å; T1955-L2009 HydrophobicContact CG2-CD1 4.26Å; T1955-L2009 HydrophobicContact CG2-CD2 3.79Å
1956	P	65.6	Low	60.6	Low	1.4 Å²	1.4	82.2 Å²	82.2	1%	0.009	46%	0.464	C	S	.	.	P	Polyproline II helix	trans	-60.6	134.2	177.7	21.9	-30.6	0	0	0	110.7	R1960 V1962 M1967 Y1993 L2009	P1956-R1960 WeakPolarHBondContact CB-O 3.34Å; P1956-V1962 HydrophobicContact CB-CB 4.39Å; P1956-V1962 HydrophobicContact CB-CG1 4.18Å; P1956-V1962 HydrophobicContact CB-CG2 3.96Å; P1956-V1962 HydrophobicContact CG-CG2 4.28Å; P1956-M1967 WeakPolarHBondContact CD-SD 3.43Å; P1956-M1967 HydrophobicContact CG-CE 4.43Å; P1956-M1967 HydrophobicContact CG-SD 4.21Å; P1956-Y1993 HydrophobicContact CG-CD1 3.97Å; P1956-Y1993 HydrophobicContact CG-CE1 3.59Å; P1956-Y1993 VanDerWaalsContact CG-CE1 3.46Å; P1956-L2009 VanDerWaalsContact O-CD1 3.26Å; P1956-L2009 WeakPolarHBondContact O-CD1 3.27Å
1957	P	70.6	Confident	63.4	Low	63.8 Å²	63.8	75.4 Å²	75.4	41%	0.414	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-58.8	154.3	169.8	-17.6	28.3	0	0	0	111	D1959 R1960	P1957-D1959 PolarHBondContact O-N 3.03Å; P1957-R1960 HydrophobicContact CB-CB 4.1Å; P1957-R1960 HydrophobicContact CB-CG 4.32Å; P1957-R1960 HydrophobicContact CG-CB 3.98Å; P1957-R1960 HydrophobicContact CG-CG 4.36Å; P1957-R1960 PolarHBondContact O-N 3.06Å; P1957-R1960 VanDerWaalsContact O-N 3.1Å; P1957-R1960 VanDerWaalsContact O-O 3.08Å
1958	C	75.1	Confident	66.2	Low	48.4 Å²	48.4	74.2 Å²	74.2	33%	0.327	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.4	-36	-176.2	-42.4	0	0	0	0	115	C2012	C1958-C2012 HydrophobicContact CB-CB 3.91Å; C1958-C2012 WeakPolarHBondContact CB-SG 3.44Å; C1958-C2012 WeakPolarHBondContact SG-CA 3.2Å; C1958-C2012 WeakPolarHBondContact SG-CB 3.39Å; C1958-C2012 CovalentContact SG-SG 2.01Å; C1958-C2012 PolarHBondContact SG-SG 3.23Å
1959	D	74.5	Confident	69.2	Low	75.4 Å²	75.4	64.6 Å²	64.6	40%	0.403	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.7	19.5	-171.6	-26.8	-3.6	0	0	0	112.8	V1470 R1539 P1957	V1470-D1959 WeakPolarHBondContact CG1-O 3.23Å; R1539-D1959 IonicContact CZ-OD2 2.75Å; R1539-D1959 IonicContact NH1-OD2 3.41Å; R1539-D1959 PolarHBondContact NH1-OD2 2.7Å; R1539-D1959 IonicContact NH2-OD2 3.1Å; R1539-D1959 PolarHBondContact NH2-OD2 3.09Å; P1957-D1959 PolarHBondContact O-N 3.03Å
1960	R	79.8	Confident	72.1	Confident	153.8 Å²	153.8	63.8 Å²	63.8	58%	0.58	37%	0.367	S	S	*	.			trans	-139.4	155.1	179.2	-65.2	-170.4	178.1	-178.6	-0.9	111.9	D1468 T1471 P1956 P1957	D1468-R1960 WeakPolarHBondContact OD2-CA 2.99Å; T1471-R1960 HydrophobicContact CG2-CG 4.04Å; P1956-R1960 WeakPolarHBondContact CB-O 3.34Å; P1957-R1960 HydrophobicContact CB-CB 4.1Å; P1957-R1960 HydrophobicContact CB-CG 4.32Å; P1957-R1960 HydrophobicContact CG-CB 3.98Å; P1957-R1960 HydrophobicContact CG-CG 4.36Å; P1957-R1960 PolarHBondContact O-N 3.06Å; P1957-R1960 VanDerWaalsContact O-N 3.1Å; P1957-R1960 VanDerWaalsContact O-O 3.08Å
1961	S	86.9	Confident	75	Confident	21.2 Å²	21.2	61.9 Å²	61.9	15%	0.148	35%	0.352	C	S	.	.			trans	-97.1	157.9	170.9	-53.2	0	0	0	0	111.6	D1468 V1470 M2001 V2002 S2003	D1468-S1961 VanDerWaalsContact OD1-CB 3.23Å; D1468-S1961 WeakPolarHBondContact OD1-CB 3.25Å; D1468-S1961 PolarHBondContact OD1-N 2.73Å; D1468-S1961 PolarHBondContact OD1-OG 3.05Å; D1468-S1961 PolarHBondContact OD2-N 2.84Å; V1470-S1961 WeakPolarHBondContact CG2-OG 3.38Å; S1961-M2001 WeakPolarHBondContact O-CE 3.29Å; S1961-V2002 CarbonylContact C-O 3.5Å; S1961-V2002 WeakPolarHBondContact CA-O 3.34Å; S1961-V2002 VanDerWaalsContact CB-O 3.24Å; S1961-V2002 WeakPolarHBondContact CB-O 3.3Å; S1961-V2002 PolarHBondContact OG-O 2.7Å; S1961-S2003 WeakPolarHBondContact OG-CB 3.37Å
1962	V	87.2	Confident	77.8	Confident	21.6 Å²	21.6	56 Å²	56	13%	0.131	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	144.5	172.6	-107.2	0	0	0	0	109.8	P1956 G1964 Q1966 M1967 V2002	P1956-V1962 HydrophobicContact CB-CB 4.39Å; P1956-V1962 HydrophobicContact CB-CG1 4.18Å; P1956-V1962 HydrophobicContact CB-CG2 3.96Å; P1956-V1962 HydrophobicContact CG-CG2 4.28Å; V1962-G1964 PolarHBondContact O-N 2.82Å; V1962-Q1966 HydrophobicContact CG1-CB 3.84Å; V1962-M1967 HydrophobicContact CG1-CB 4.33Å; V1962-M1967 HydrophobicContact CG2-CB 4.06Å; V1962-M1967 HydrophobicContact CG2-CG 4.45Å; V1962-M1967 HydrophobicContact CG2-SD 4.46Å; V1962-V2002 HydrophobicContact CG2-CB 4.25Å; V1962-V2002 PolarHBondContact N-O 3.2Å; V1962-V2002 PolarHBondContact O-N 3.14Å
1963	P	86.2	Confident	80.4	Confident	18.6 Å²	18.6	54.1 Å²	54.1	12%	0.121	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	139.2	172.9	-25.5	35.9	0	0	0	111.5	N1465 I1466 N1965 Q1966 M1967 M2001	N1465-P1963 WeakPolarHBondContact OD1-CG 3.47Å; I1466-P1963 HydrophobicContact CD1-CB 4.06Å; I1466-P1963 HydrophobicContact CD1-CG 3.44Å; I1466-P1963 VanDerWaalsContact CD1-CG 3.44Å; P1963-N1965 VanDerWaalsContact C-N 3.27Å; P1963-N1965 VanDerWaalsContact CB-OD1 3.3Å; P1963-N1965 WeakPolarHBondContact CB-OD1 3.38Å; P1963-N1965 PolarHBondContact O-N 2.9Å; P1963-Q1966 HydrophobicContact CB-CB 4.37Å; P1963-Q1966 HydrophobicContact CB-CG 4.19Å; P1963-Q1966 HydrophobicContact CG-CG 4.42Å; P1963-Q1966 WeakPolarHBondContact O-CA 3.34Å; P1963-Q1966 WeakPolarHBondContact O-CB 3.3Å; P1963-Q1966 PolarHBondContact O-N 3.12Å; P1963-M1967 PolarHBondContact O-N 3.11Å; P1963-M2001 VanDerWaalsContact CA-SD 3.57Å; P1963-M2001 HydrophobicContact CB-SD 4.19Å; P1963-M2001 HydrophobicContact CG-CE 4.31Å; P1963-M2001 HydrophobicContact CG-SD 3.85Å; P1963-M2001 VanDerWaalsContact N-SD 3.43Å
1964	G	85.3	Confident	82.7	Confident	2 Å²	2	50.6 Å²	50.6	2%	0.021	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-53.7	-42.5	-177.5	0	0	0	0	0	113.5	V1923 I1924 G1925 V1962 Q1966 M1967 Q2000	V1923-G1964 CarbonylContact O-C 3.56Å; V1923-G1964 VanDerWaalsContact O-C 3.27Å; I1924-G1964 WeakPolarHBondContact CA-O 3.33Å; I1924-G1964 WeakPolarHBondContact CG2-O 3.36Å; G1925-G1964 PolarHBondContact N-O 3.12Å; V1962-G1964 PolarHBondContact O-N 2.82Å; G1964-Q1966 PolarHBondContact O-N 3.14Å; G1964-Q1966 VanDerWaalsContact O-N 3.14Å; G1964-M1967 PolarHBondContact O-N 3.01Å; G1964-M1967 VanDerWaalsContact O-N 3.14Å; G1964-Q2000 PolarHBondContact N-O 3.07Å
1965	N	81.2	Confident	84.5	Confident	119.4 Å²	119.4	49.9 Å²	49.9	64%	0.639	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-70.4	-4.6	178	68.8	-16.6	0	0	0	115.1	V1923 P1963	V1923-N1965 PolarHBondContact O-N 2.73Å; P1963-N1965 VanDerWaalsContact C-N 3.27Å; P1963-N1965 VanDerWaalsContact CB-OD1 3.3Å; P1963-N1965 WeakPolarHBondContact CB-OD1 3.38Å; P1963-N1965 PolarHBondContact O-N 2.9Å
1966	Q	83.4	Confident	86.1	Confident	116.6 Å²	116.6	47.7 Å²	47.7	55%	0.545	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-106.8	-15.3	174.5	-66	179.2	10.4	0	0	112.2	S1954 V1962 P1963 G1964	S1954-Q1966 WeakPolarHBondContact CB-O 3.32Å; S1954-Q1966 PolarHBondContact OG-O 3.41Å; V1962-Q1966 HydrophobicContact CG1-CB 3.84Å; P1963-Q1966 HydrophobicContact CB-CB 4.37Å; P1963-Q1966 HydrophobicContact CB-CG 4.19Å; P1963-Q1966 HydrophobicContact CG-CG 4.42Å; P1963-Q1966 WeakPolarHBondContact O-CA 3.34Å; P1963-Q1966 WeakPolarHBondContact O-CB 3.3Å; P1963-Q1966 PolarHBondContact O-N 3.12Å; G1964-Q1966 PolarHBondContact O-N 3.14Å; G1964-Q1966 VanDerWaalsContact O-N 3.14Å
1967	M	87.7	Confident	87.5	Confident	1.2 Å²	1.2	49.6 Å²	49.6	1%	0.006	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-78.4	129.1	179.4	-176.9	158.6	-178.9	0	0	110.8	I1924 G1925 S1954 P1956 V1962 P1963 G1964 L1969 F1986 Y1993 V2002	I1924-M1967 HydrophobicContact CG2-CB 4.01Å; I1924-M1967 HydrophobicContact CG2-CG 4.29Å; I1924-M1967 HydrophobicContact CG2-SD 4.31Å; G1925-M1967 VanDerWaalsContact CA-O 3.28Å; G1925-M1967 WeakPolarHBondContact CA-O 3.34Å; G1925-M1967 PolarHBondContact N-O 2.9Å; G1925-M1967 VanDerWaalsContact N-O 3.1Å; S1954-M1967 WeakPolarHBondContact O-CA 3.28Å; P1956-M1967 WeakPolarHBondContact CD-SD 3.43Å; P1956-M1967 HydrophobicContact CG-CE 4.43Å; P1956-M1967 HydrophobicContact CG-SD 4.21Å; V1962-M1967 HydrophobicContact CG1-CB 4.33Å; V1962-M1967 HydrophobicContact CG2-CB 4.06Å; V1962-M1967 HydrophobicContact CG2-CG 4.45Å; V1962-M1967 HydrophobicContact CG2-SD 4.46Å; P1963-M1967 PolarHBondContact O-N 3.11Å; G1964-M1967 PolarHBondContact O-N 3.01Å; G1964-M1967 VanDerWaalsContact O-N 3.14Å; M1967-L1969 HydrophobicContact CE-CD2 3.93Å; M1967-L1969 HydrophobicContact CG-CD2 4.11Å; M1967-L1969 HydrophobicContact SD-CD2 4.12Å; M1967-F1986 HydrophobicContact CE-CE2 4.14Å; M1967-F1986 HydrophobicContact CE-CZ 4.05Å; M1967-F1986 HydrophobicContact SD-CE2 4.44Å; M1967-F1986 HydrophobicContact SD-CZ 3.88Å; M1967-Y1993 HydrophobicContact CE-CD1 3.88Å; M1967-Y1993 HydrophobicContact CE-CD2 3.89Å; M1967-Y1993 HydrophobicContact CE-CE1 3.81Å; M1967-Y1993 HydrophobicContact CE-CE2 3.81Å; M1967-Y1993 HydrophobicContact CE-CG 3.91Å; M1967-V2002 HydrophobicContact CE-CG1 4.22Å; M1967-V2002 HydrophobicContact SD-CB 3.85Å; M1967-V2002 HydrophobicContact SD-CG1 3.46Å; M1967-V2002 VanDerWaalsContact SD-CG1 3.55Å; M1967-V2002 WeakPolarHBondContact SD-CG1 3.23Å; M1967-V2002 HydrophobicContact SD-CG2 3.98Å
1968	L	88.6	Confident	88.5	Confident	77 Å²	77	46.6 Å²	46.6	40%	0.403	24%	0.238	S	C	.	.	P	Polyproline II helix	trans	-96	132.7	170.5	-61.6	170.6	0	0	0	109	S1926 P1951 S1954	S1926-L1968 WeakPolarHBondContact OG-CD2 3.44Å; P1951-L1968 HydrophobicContact CB-CD1 4.39Å; S1954-L1968 VanDerWaalsContact OG-CB 3.28Å; S1954-L1968 WeakPolarHBondContact OG-CB 3.09Å; S1954-L1968 VanDerWaalsContact OG-CD1 3.24Å; S1954-L1968 WeakPolarHBondContact OG-CD1 3.35Å; S1954-L1968 WeakPolarHBondContact OG-CG 3.32Å; S1954-L1968 PolarHBondContact OG-N 3.1Å; S1954-L1968 VanDerWaalsContact OG-N 3.12Å
1969	L	91.1	Very high	89.1	Confident	5.6 Å²	5.6	47.2 Å²	47.2	3%	0.029	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-102.5	143.9	178.5	-53.6	176.6	0	0	0	109.8	Q1902 I1904 I1924 M1967 P1972 F1986 D1988	Q1902-L1969 WeakPolarHBondContact CB-O 3.37Å; Q1902-L1969 WeakPolarHBondContact CG-O 3.46Å; Q1902-L1969 WeakPolarHBondContact O-CB 3.36Å; I1904-L1969 HydrophobicContact CD1-CD1 3.95Å; I1904-L1969 HydrophobicContact CG1-CD1 3.96Å; I1924-L1969 HydrophobicContact CB-CD1 4.4Å; I1924-L1969 HydrophobicContact CG2-CD1 3.97Å; I1924-L1969 HydrophobicContact CG2-CD2 3.98Å; I1924-L1969 HydrophobicContact CG2-CG 4.07Å; M1967-L1969 HydrophobicContact CE-CD2 3.93Å; M1967-L1969 HydrophobicContact CG-CD2 4.11Å; M1967-L1969 HydrophobicContact SD-CD2 4.12Å; L1969-P1972 HydrophobicContact CB-CB 4.41Å; L1969-P1972 HydrophobicContact CB-CG 3.9Å; L1969-P1972 HydrophobicContact CD1-CB 4.13Å; L1969-P1972 HydrophobicContact CD1-CG 3.93Å; L1969-P1972 HydrophobicContact CG-CG 4.47Å; L1969-F1986 HydrophobicContact CD2-CD2 4.43Å; L1969-F1986 HydrophobicContact CD2-CE2 3.6Å; L1969-F1986 HydrophobicContact CD2-CZ 4.14Å; L1969-D1988 WeakPolarHBondContact CA-OD2 3.33Å
1970	N	90.8	Very high	89.6	Confident	98.8 Å²	98.8	45.2 Å²	45.2	53%	0.528	23%	0.226	S	C	.	.	S	Bend	trans	-99.2	-58.9	-178.7	-85.9	-32.9	0	0	0	112.3	Q1902 D1988 N1989	Q1902-N1970 WeakPolarHBondContact CG-O 3.39Å; Q1902-N1970 PolarHBondContact NE2-O 3.2Å; N1970-D1988 PolarHBondContact N-OD1 3.01Å; N1970-D1988 PolarHBondContact N-OD2 2.79Å; N1970-D1988 VanDerWaalsContact N-OD2 3.12Å; N1970-N1989 WeakPolarHBondContact CB-ND2 3.27Å; N1970-N1989 PolarHBondContact ND2-ND2 3.11Å; N1970-N1989 PolarHBondContact ND2-OD1 2.74Å
1971	N	92.4	Very high	89.9	Confident	70 Å²	70	38 Å²	38	37%	0.374	20%	0.199	S	C	.	.	S	Bend	trans	-143.2	70.6	176.3	-175.8	40.8	0	0	0	110.3	K1887 D1988 N1989	K1887-N1971 PolarHBondContact NZ-OD1 2.95Å; N1971-D1988 VanDerWaalsContact C-OD1 3.26Å; N1971-D1988 WeakPolarHBondContact CA-OD1 3.34Å; N1971-D1988 PolarHBondContact N-OD1 3.15Å; N1971-N1989 WeakPolarHBondContact CB-OD1 3.34Å; N1971-N1989 PolarHBondContact O-N 3.22Å
1972	P	95.5	Very high	89.9	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	144.9	173.7	31	-34.7	0	0	0	110.7	K1887 I1899 S1901 L1969 S1987	K1887-P1972 VanDerWaalsContact CD-O 3.26Å; K1887-P1972 WeakPolarHBondContact CD-O 3.18Å; K1887-P1972 WeakPolarHBondContact CE-O 3.34Å; K1887-P1972 PolarHBondContact NZ-O 2.95Å; I1899-P1972 HydrophobicContact CD1-CB 4.07Å; I1899-P1972 HydrophobicContact CG1-CB 4.32Å; I1899-P1972 HydrophobicContact CG2-CB 4.13Å; I1899-P1972 HydrophobicContact CG2-CG 3.81Å; S1901-P1972 WeakPolarHBondContact O-CD 3.49Å; S1901-P1972 WeakPolarHBondContact O-CG 3.28Å; L1969-P1972 HydrophobicContact CB-CB 4.41Å; L1969-P1972 HydrophobicContact CB-CG 3.9Å; L1969-P1972 HydrophobicContact CD1-CB 4.13Å; L1969-P1972 HydrophobicContact CD1-CG 3.93Å; L1969-P1972 HydrophobicContact CG-CG 4.47Å; P1972-S1987 WeakPolarHBondContact CA-O 3.3Å
1973	E	94.9	Very high	90.2	Very high	59.2 Å²	59.2	39.3 Å²	39.3	28%	0.277	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	-53.7	-176.6	-168.2	169.9	171.7	0	0	114.6	F1790 K1887 G1888 I1899 S1987	F1790-E1973 HydrophobicContact CE1-CG 4.37Å; F1790-E1973 HydrophobicContact CZ-CG 4.07Å; K1887-E1973 HydrophobicContact CD-CB 4.34Å; K1887-E1973 HydrophobicContact CD-CG 4.38Å; K1887-E1973 IonicContact NZ-OE2 2.69Å; G1888-E1973 VanDerWaalsContact CA-O 3.27Å; G1888-E1973 WeakPolarHBondContact CA-O 3.31Å; G1888-E1973 PolarHBondContact N-O 3.05Å; I1899-E1973 VanDerWaalsContact CD1-C 3.47Å; I1899-E1973 WeakPolarHBondContact CD1-O 3.43Å; E1973-S1987 PolarHBondContact N-O 2.99Å
1974	H	96.8	Very high	90.6	Very high	20.2 Å²	20.2	38.5 Å²	38.5	9%	0.094	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	145.5	-173.3	-55.9	-68.7	0	0	0	111.7	F1790 F1986 S1987 I2033 R2034 L2036	F1790-H1974 AromaticContact CE1-ND1 3.9Å; H1974-F1986 VanDerWaalsContact O-CA 3.24Å; H1974-F1986 WeakPolarHBondContact O-CA 3.32Å; H1974-F1986 WeakPolarHBondContact O-CB 3.29Å; H1974-S1987 WeakPolarHBondContact CB-OG 3.38Å; H1974-S1987 PolarHBondContact CD2-OG 2.92Å; H1974-S1987 VanDerWaalsContact CD2-OG 3.27Å; H1974-S1987 PolarHBondContact N-OG 3Å; H1974-S1987 PolarHBondContact O-N 3.08Å; H1974-S1987 VanDerWaalsContact O-N 3.12Å; H1974-I2033 PolarHBondContact CD2-O 3.38Å; H1974-I2033 PolarHBondContact NE2-O 2.95Å; H1974-I2033 VanDerWaalsContact NE2-O 3.14Å; H1974-R2034 PolarHBondContact CE1-O 3.1Å; H1974-R2034 VanDerWaalsContact NE2-C 3.3Å; H1974-R2034 PolarHBondContact NE2-O 3.08Å; H1974-L2036 HydrophobicContact CB-CB 4.45Å; H1974-L2036 HydrophobicContact CB-CD1 4.11Å; H1974-L2036 HydrophobicContact CB-CG 4.07Å
1975	L	97.3	Very high	91.2	Very high	18.8 Å²	18.8	38.4 Å²	38.4	10%	0.098	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	141.4	171.6	-74.6	178.6	0	0	0	110.2	G1888 V1890 I1899 I1904 Y1985 F1986	G1888-L1975 VanDerWaalsContact O-CD1 3.29Å; G1888-L1975 WeakPolarHBondContact O-CD1 3.39Å; V1890-L1975 HydrophobicContact CB-CB 4.21Å; V1890-L1975 HydrophobicContact CG1-CB 3.89Å; V1890-L1975 HydrophobicContact CG1-CD1 4.13Å; V1890-L1975 HydrophobicContact CG1-CG 4.48Å; V1890-L1975 WeakPolarHBondContact CG1-O 3.02Å; V1890-L1975 HydrophobicContact CG2-CB 3.94Å; V1890-L1975 HydrophobicContact CG2-CD1 4.26Å; V1890-L1975 HydrophobicContact CG2-CD2 4.49Å; V1890-L1975 HydrophobicContact CG2-CG 4.48Å; I1899-L1975 HydrophobicContact CD1-CD1 4.27Å; I1899-L1975 HydrophobicContact CD1-CD2 4.08Å; I1899-L1975 HydrophobicContact CD1-CG 3.78Å; I1899-L1975 HydrophobicContact CG1-CD1 4.08Å; I1899-L1975 HydrophobicContact CG1-CD2 4.16Å; I1899-L1975 HydrophobicContact CG1-CG 4.06Å; I1904-L1975 HydrophobicContact CD1-CD2 4.31Å; L1975-Y1985 CarbonylContact C-O 3.53Å; L1975-Y1985 WeakPolarHBondContact CA-O 3.41Å; L1975-F1986 HydrophobicContact CD2-CB 3.56Å; L1975-F1986 VanDerWaalsContact CD2-CB 3.42Å; L1975-F1986 HydrophobicContact CG-CB 4.39Å
1976	A	96.8	Very high	92	Very high	8.2 Å²	8.2	32.8 Å²	32.8	7%	0.068	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	146.3	169	0	0	0	0	0	110.2	L1984 Y1985 L2036 V2038	A1976-L1984 CarbonylContact O-C 3.52Å; A1976-L1984 WeakPolarHBondContact O-CA 3.25Å; A1976-Y1985 PolarHBondContact N-O 3.12Å; A1976-Y1985 PolarHBondContact O-N 2.97Å; A1976-L2036 HydrophobicContact CB-CB 3.94Å; A1976-V2038 HydrophobicContact CB-CG2 4.07Å
1977	F	94.9	Very high	92.6	Very high	41.4 Å²	41.4	27.4 Å²	27.4	18%	0.182	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	129.7	-179.2	171.1	-125	0	0	0	110.7	P1795 V1890 T1892 I1979 A1983 L1984 L1997	P1795-F1977 HydrophobicContact CG-CE1 4.45Å; V1890-F1977 HydrophobicContact CB-CB 4.39Å; V1890-F1977 HydrophobicContact CG1-CB 4.36Å; V1890-F1977 HydrophobicContact CG2-CB 3.67Å; V1890-F1977 VanDerWaalsContact CG2-CB 3.48Å; T1892-F1977 HydrophobicContact CG2-CD1 4.3Å; T1892-F1977 HydrophobicContact CG2-CD2 3.93Å; T1892-F1977 HydrophobicContact CG2-CE1 4.22Å; T1892-F1977 HydrophobicContact CG2-CE2 3.84Å; T1892-F1977 HydrophobicContact CG2-CG 4.16Å; T1892-F1977 HydrophobicContact CG2-CZ 3.99Å; F1977-I1979 HydrophobicContact CD1-CB 4.48Å; F1977-I1979 HydrophobicContact CE1-CB 3.82Å; F1977-I1979 HydrophobicContact CE1-CD1 4.35Å; F1977-I1979 HydrophobicContact CE1-CG1 4.13Å; F1977-I1979 HydrophobicContact CZ-CB 4.12Å; F1977-I1979 HydrophobicContact CZ-CG1 4.28Å; F1977-A1983 WeakPolarHBondContact CD2-O 3.2Å; F1977-L1984 HydrophobicContact CB-CD2 3.97Å; F1977-L1984 HydrophobicContact CD2-CD2 3.83Å; F1977-L1984 HydrophobicContact CG-CD2 4.28Å; F1977-L1997 HydrophobicContact CD2-CD1 4.35Å; F1977-L1997 HydrophobicContact CE2-CD1 3.87Å
1978	S	92.7	Very high	93	Very high	2 Å²	2	27.6 Å²	27.6	1%	0.014	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	107.5	168.6	-178.1	0	0	0	0	109.5	L1980 E1981 Q1982 A1983	S1978-L1980 VanDerWaalsContact C-N 3.28Å; S1978-L1980 PolarHBondContact O-N 2.96Å; S1978-E1981 WeakPolarHBondContact OG-CB 3.47Å; S1978-E1981 PolarHBondContact OG-N 3.07Å; S1978-E1981 VanDerWaalsContact OG-N 3.11Å; S1978-Q1982 WeakPolarHBondContact O-CA 3.31Å; S1978-Q1982 PolarHBondContact O-N 3.14Å; S1978-A1983 PolarHBondContact N-O 3.03Å; S1978-A1983 PolarHBondContact O-N 3.19Å
1979	I	86.7	Confident	93.2	Very high	60.8 Å²	60.8	27.1 Å²	27.1	31%	0.312	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-31.7	174.9	-166.1	156.9	0	0	0	112.1	I1364 Y1384 P1795 F1977	I1364-I1979 HydrophobicContact CD1-CD1 4.41Å; I1364-I1979 HydrophobicContact CG1-CD1 4.37Å; Y1384-I1979 HydrophobicContact CD1-CD1 4.23Å; Y1384-I1979 HydrophobicContact CD1-CG1 4.24Å; Y1384-I1979 HydrophobicContact CD1-CG2 3.89Å; Y1384-I1979 HydrophobicContact CD2-CD1 3.49Å; Y1384-I1979 VanDerWaalsContact CD2-CD1 3.41Å; Y1384-I1979 HydrophobicContact CD2-CG1 4.36Å; Y1384-I1979 HydrophobicContact CE1-CG2 3.67Å; Y1384-I1979 HydrophobicContact CE2-CD1 4.08Å; Y1384-I1979 HydrophobicContact CE2-CG2 4.38Å; Y1384-I1979 HydrophobicContact CG-CD1 3.56Å; Y1384-I1979 HydrophobicContact CG-CG1 3.99Å; Y1384-I1979 HydrophobicContact CG-CG2 4.33Å; P1795-I1979 HydrophobicContact CB-CD1 4.36Å; F1977-I1979 HydrophobicContact CD1-CB 4.48Å; F1977-I1979 HydrophobicContact CE1-CB 3.82Å; F1977-I1979 HydrophobicContact CE1-CD1 4.35Å; F1977-I1979 HydrophobicContact CE1-CG1 4.13Å; F1977-I1979 HydrophobicContact CZ-CB 4.12Å; F1977-I1979 HydrophobicContact CZ-CG1 4.28Å
1980	L	86.1	Confident	93.3	Very high	33.4 Å²	33.4	30.1 Å²	30.1	18%	0.175	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-47.5	178	178.7	67.8	0	0	0	111.7	K1592 Y1609 V1611 S1978 Q1982 Q2041	K1592-L1980 HydrophobicContact CD-CD1 4.24Å; K1592-L1980 HydrophobicContact CG-CD1 4.44Å; Y1609-L1980 WeakPolarHBondContact CB-O 3.29Å; Y1609-L1980 VanDerWaalsContact CD2-O 3.24Å; Y1609-L1980 WeakPolarHBondContact CD2-O 3.22Å; V1611-L1980 HydrophobicContact CB-CD2 4.15Å; V1611-L1980 HydrophobicContact CG2-CD1 3.93Å; V1611-L1980 HydrophobicContact CG2-CD2 3.53Å; V1611-L1980 VanDerWaalsContact CG2-CD2 3.48Å; V1611-L1980 HydrophobicContact CG2-CG 4.3Å; S1978-L1980 VanDerWaalsContact C-N 3.28Å; S1978-L1980 PolarHBondContact O-N 2.96Å; L1980-Q1982 VanDerWaalsContact C-N 3.33Å; L1980-Q2041 VanDerWaalsContact CD2-O 3.29Å; L1980-Q2041 WeakPolarHBondContact CD2-O 3.3Å
1981	E	86.3	Confident	93.4	Very high	3 Å²	3	26.9 Å²	26.9	1%	0.014	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-9.9	-178.2	-63.7	-173.9	177.9	0	0	113.4	S1978 A1983 Y1985 R1994 R2055	S1978-E1981 WeakPolarHBondContact OG-CB 3.47Å; S1978-E1981 PolarHBondContact OG-N 3.07Å; S1978-E1981 VanDerWaalsContact OG-N 3.11Å; E1981-A1983 VanDerWaalsContact C-N 3.28Å; E1981-A1983 HydrophobicContact CB-CB 4.08Å; E1981-A1983 PolarHBondContact O-N 2.96Å; E1981-Y1985 VanDerWaalsContact CD-OH 3.32Å; E1981-Y1985 PolarHBondContact OE1-OH 2.93Å; E1981-Y1985 PolarHBondContact OE2-OH 2.97Å; E1981-R1994 IonicContact OE2-CZ 3.13Å; E1981-R1994 IonicContact OE2-NE 3.79Å; E1981-R1994 PolarHBondContact OE2-NE 3.2Å; E1981-R1994 IonicContact OE2-NH1 3.79Å; E1981-R1994 PolarHBondContact OE2-NH1 3.24Å; E1981-R1994 IonicContact OE2-NH2 3.7Å; E1981-R2055 IonicContact OE1-NH2 3.28Å
1982	Q	86.6	Confident	93.6	Very high	68.8 Å²	68.8	23.6 Å²	23.6	32%	0.321	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.5	49.2	-168.8	-58.1	-176.3	18.2	0	0	111.8	Y1609 S1978 L1980 L1997 V1998	Y1609-Q1982 HydrophobicContact CE2-CG 4.4Å; S1978-Q1982 WeakPolarHBondContact O-CA 3.31Å; S1978-Q1982 PolarHBondContact O-N 3.14Å; L1980-Q1982 VanDerWaalsContact C-N 3.33Å; Q1982-L1997 HydrophobicContact CB-CD1 4.5Å; Q1982-L1997 VanDerWaalsContact O-CB 3.28Å; Q1982-L1997 WeakPolarHBondContact O-CB 3.31Å; Q1982-L1997 WeakPolarHBondContact O-CD1 3.15Å; Q1982-L1997 VanDerWaalsContact O-CG 3.27Å; Q1982-L1997 WeakPolarHBondContact O-CG 3.42Å; Q1982-L1997 PolarHBondContact O-N 3.09Å; Q1982-L1997 VanDerWaalsContact O-N 3.12Å; Q1982-V1998 HydrophobicContact CB-CG2 4.46Å
1983	A	92.3	Very high	93.7	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	147.2	-174.9	0	0	0	0	0	111.8	F1977 S1978 E1981 R1994 Y1995	F1977-A1983 WeakPolarHBondContact CD2-O 3.2Å; S1978-A1983 PolarHBondContact N-O 3.03Å; S1978-A1983 PolarHBondContact O-N 3.19Å; E1981-A1983 VanDerWaalsContact C-N 3.28Å; E1981-A1983 HydrophobicContact CB-CB 4.08Å; E1981-A1983 PolarHBondContact O-N 2.96Å; A1983-R1994 HydrophobicContact CB-CG 3.9Å; A1983-Y1995 CarbonylContact C-O 3.48Å; A1983-Y1995 VanDerWaalsContact CA-O 3.3Å; A1983-Y1995 WeakPolarHBondContact CA-O 3.29Å
1984	L	96	Very high	93.6	Very high	3 Å²	3	21.9 Å²	21.9	2%	0.016	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	131.7	170.4	-59.5	174.5	0	0	0	109.2	V1890 T1892 Y1897 A1976 F1977 R1994 Y1995 L1997	V1890-L1984 HydrophobicContact CG1-CD2 3.67Å; V1890-L1984 HydrophobicContact CG2-CD2 3.79Å; T1892-L1984 HydrophobicContact CG2-CD2 4.42Å; Y1897-L1984 HydrophobicContact CD1-CD1 3.37Å; Y1897-L1984 VanDerWaalsContact CD1-CD1 3.45Å; Y1897-L1984 HydrophobicContact CD2-CD1 3.88Å; Y1897-L1984 HydrophobicContact CD2-CD2 4.41Å; Y1897-L1984 HydrophobicContact CE1-CD1 3.64Å; Y1897-L1984 HydrophobicContact CE2-CD1 4.16Å; Y1897-L1984 HydrophobicContact CG-CD1 3.48Å; Y1897-L1984 VanDerWaalsContact CG-CD1 3.47Å; Y1897-L1984 HydrophobicContact CG-CD2 4.5Å; A1976-L1984 CarbonylContact O-C 3.52Å; A1976-L1984 WeakPolarHBondContact O-CA 3.25Å; F1977-L1984 HydrophobicContact CB-CD2 3.97Å; F1977-L1984 HydrophobicContact CD2-CD2 3.83Å; F1977-L1984 HydrophobicContact CG-CD2 4.28Å; L1984-R1994 CarbonylContact O-C 3.53Å; L1984-R1994 WeakPolarHBondContact O-CA 3.32Å; L1984-Y1995 HydrophobicContact CB-CD1 4.45Å; L1984-Y1995 HydrophobicContact CD1-CD1 4.08Å; L1984-Y1995 HydrophobicContact CG-CD1 4.45Å; L1984-Y1995 PolarHBondContact N-O 3.11Å; L1984-Y1995 PolarHBondContact O-N 3.02Å; L1984-L1997 HydrophobicContact CD1-CD2 3.87Å; L1984-L1997 HydrophobicContact CG-CD2 3.9Å; L1984-L1997 HydrophobicContact CG-CG 4.29Å
1985	Y	97.5	Very high	93.5	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	134.3	168.4	-71.4	-83.4	0	0	0	109	L1975 A1976 E1981 V1992 Y1993 R1994 A2005 V2038 L2044 R2055	L1975-Y1985 CarbonylContact C-O 3.53Å; L1975-Y1985 WeakPolarHBondContact CA-O 3.41Å; A1976-Y1985 PolarHBondContact N-O 3.12Å; A1976-Y1985 PolarHBondContact O-N 2.97Å; E1981-Y1985 VanDerWaalsContact CD-OH 3.32Å; E1981-Y1985 PolarHBondContact OE1-OH 2.93Å; E1981-Y1985 PolarHBondContact OE2-OH 2.97Å; Y1985-V1992 HydrophobicContact CD1-CG1 4.25Å; Y1985-Y1993 CarbonylContact C-O 3.59Å; Y1985-Y1993 VanDerWaalsContact CA-O 3.29Å; Y1985-Y1993 WeakPolarHBondContact CA-O 3.21Å; Y1985-R1994 HydrophobicContact CD1-CB 4.04Å; Y1985-R1994 HydrophobicContact CD1-CG 4.37Å; Y1985-R1994 HydrophobicContact CE1-CB 3.72Å; Y1985-R1994 HydrophobicContact CE1-CG 3.85Å; Y1985-R1994 HydrophobicContact CE2-CG 4.42Å; Y1985-R1994 VanDerWaalsContact OH-CD 3.27Å; Y1985-R1994 WeakPolarHBondContact OH-CD 3.32Å; Y1985-A2005 HydrophobicContact CD1-CB 3.88Å; Y1985-A2005 HydrophobicContact CE1-CB 3.66Å; Y1985-V2038 HydrophobicContact CD2-CG2 3.9Å; Y1985-V2038 HydrophobicContact CE2-CG2 4.39Å; Y1985-L2044 HydrophobicContact CD1-CD1 4.28Å; Y1985-L2044 HydrophobicContact CD1-CD2 3.72Å; Y1985-L2044 HydrophobicContact CD2-CD1 4.4Å; Y1985-L2044 HydrophobicContact CE1-CD2 3.92Å; Y1985-L2044 HydrophobicContact CG-CD1 4.03Å; Y1985-L2044 HydrophobicContact CG-CD2 4.26Å; Y1985-R2055 VanDerWaalsContact CZ-NH1 3.28Å; Y1985-R2055 PolarHBondContact OH-NH1 2.96Å; Y1985-R2055 PolarHBondContact OH-NH2 2.78Å
1986	F	97.5	Very high	93.1	Very high	0.8 Å²	0.8	20.6 Å²	20.6	0%	0.004	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	145.4	178	67.4	-91	0	0	0	111.8	I1904 I1924 M1967 L1969 H1974 L1975 V1992 Y1993 V2002	I1904-F1986 HydrophobicContact CD1-CB 4.24Å; I1904-F1986 HydrophobicContact CD1-CD1 4.11Å; I1904-F1986 HydrophobicContact CD1-CD2 4.05Å; I1904-F1986 HydrophobicContact CD1-CE1 4.39Å; I1904-F1986 HydrophobicContact CD1-CE2 4.37Å; I1904-F1986 HydrophobicContact CD1-CG 3.89Å; I1904-F1986 HydrophobicContact CD1-CZ 4.46Å; I1924-F1986 HydrophobicContact CD1-CD1 4.35Å; I1924-F1986 HydrophobicContact CD1-CE1 3.65Å; I1924-F1986 HydrophobicContact CD1-CZ 4.03Å; M1967-F1986 HydrophobicContact CE-CE2 4.14Å; M1967-F1986 HydrophobicContact CE-CZ 4.05Å; M1967-F1986 HydrophobicContact SD-CE2 4.44Å; M1967-F1986 HydrophobicContact SD-CZ 3.88Å; L1969-F1986 HydrophobicContact CD2-CD2 4.43Å; L1969-F1986 HydrophobicContact CD2-CE2 3.6Å; L1969-F1986 HydrophobicContact CD2-CZ 4.14Å; H1974-F1986 VanDerWaalsContact O-CA 3.24Å; H1974-F1986 WeakPolarHBondContact O-CA 3.32Å; H1974-F1986 WeakPolarHBondContact O-CB 3.29Å; L1975-F1986 HydrophobicContact CD2-CB 3.56Å; L1975-F1986 VanDerWaalsContact CD2-CB 3.42Å; L1975-F1986 HydrophobicContact CG-CB 4.39Å; F1986-V1992 WeakPolarHBondContact O-CA 3.21Å; F1986-Y1993 HydrophobicContact CD2-CD2 4.29Å; F1986-Y1993 AromaticContact CE2-CD2 3.73Å; F1986-Y1993 HydrophobicContact CE2-CD2 3.73Å; F1986-Y1993 AromaticContact CE2-CG 3.97Å; F1986-Y1993 HydrophobicContact CE2-CG 3.99Å; F1986-Y1993 VanDerWaalsContact CZ-CB 3.43Å; F1986-Y1993 HydrophobicContact CZ-CD2 4.22Å; F1986-Y1993 AromaticContact CZ-CG 3.97Å; F1986-Y1993 HydrophobicContact CZ-CG 4Å; F1986-Y1993 PolarHBondContact N-O 3.05Å; F1986-Y1993 PolarHBondContact O-N 3.17Å; F1986-V2002 HydrophobicContact CE1-CG1 3.95Å; F1986-V2002 HydrophobicContact CE1-CG2 4.39Å; F1986-V2002 HydrophobicContact CZ-CG1 3.76Å; F1986-V2002 HydrophobicContact CZ-CG2 4.38Å
1987	S	96.8	Very high	92.7	Very high	3 Å²	3	21.6 Å²	21.6	2%	0.021	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	143.2	173.1	65.8	0	0	0	0	110.5	P1972 E1973 H1974 H1991	P1972-S1987 WeakPolarHBondContact CA-O 3.3Å; E1973-S1987 PolarHBondContact N-O 2.99Å; H1974-S1987 WeakPolarHBondContact CB-OG 3.38Å; H1974-S1987 PolarHBondContact CD2-OG 2.92Å; H1974-S1987 VanDerWaalsContact CD2-OG 3.27Å; H1974-S1987 PolarHBondContact N-OG 3Å; H1974-S1987 PolarHBondContact O-N 3.08Å; H1974-S1987 VanDerWaalsContact O-N 3.12Å; S1987-H1991 CarbonylContact C-O 3.49Å; S1987-H1991 WeakPolarHBondContact CA-O 3.32Å
1988	D	94.7	Very high	92	Very high	4.6 Å²	4.6	20.7 Å²	20.7	3%	0.025	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	108.7	165.6	179.3	18	0	0	0	108.3	L1969 N1970 N1971 D1990 H1991 Y1993	L1969-D1988 WeakPolarHBondContact CA-OD2 3.33Å; N1970-D1988 PolarHBondContact N-OD1 3.01Å; N1970-D1988 PolarHBondContact N-OD2 2.79Å; N1970-D1988 VanDerWaalsContact N-OD2 3.12Å; N1971-D1988 VanDerWaalsContact C-OD1 3.26Å; N1971-D1988 WeakPolarHBondContact CA-OD1 3.34Å; N1971-D1988 PolarHBondContact N-OD1 3.15Å; D1988-D1990 PolarHBondContact O-N 2.95Å; D1988-H1991 PolarHBondContact N-O 2.94Å; D1988-H1991 PolarHBondContact O-N 3.22Å; D1988-Y1993 HydrophobicContact CB-CD2 4.23Å; D1988-Y1993 HydrophobicContact CB-CE2 4Å
1989	N	93.1	Very high	91.4	Very high	68.2 Å²	68.2	21.6 Å²	21.6	37%	0.365	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	-125.2	-165	-48.2	-66.9	0	0	0	112	N1970 N1971 H1991	N1970-N1989 WeakPolarHBondContact CB-ND2 3.27Å; N1970-N1989 PolarHBondContact ND2-ND2 3.11Å; N1970-N1989 PolarHBondContact ND2-OD1 2.74Å; N1971-N1989 WeakPolarHBondContact CB-OD1 3.34Å; N1971-N1989 PolarHBondContact O-N 3.22Å; N1989-H1991 VanDerWaalsContact C-N 3.29Å; N1989-H1991 PolarHBondContact O-N 2.85Å; N1989-H1991 VanDerWaalsContact O-N 3.16Å
1990	D	92.6	Very high	91.4	Very high	68.8 Å²	68.8	21.9 Å²	21.9	37%	0.368	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	15.4	-176.8	-36.2	-42.1	0	0	0	113.2	D1988 L2030 G2031 D2032	D1988-D1990 PolarHBondContact O-N 2.95Å; D1990-L2030 WeakPolarHBondContact CB-O 3.17Å; D1990-L2030 WeakPolarHBondContact O-CB 3.41Å; D1990-G2031 WeakPolarHBondContact CA-O 3.42Å; D1990-G2031 WeakPolarHBondContact CB-O 3.15Å; D1990-G2031 VanDerWaalsContact OD1-C 3.28Å; D1990-D2032 PolarHBondContact OD1-N 2.88Å
1991	H	94.6	Very high	91.5	Very high	30.8 Å²	30.8	21.2 Å²	21.2	14%	0.143	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	144	-176.9	-59.1	96.7	0	0	0	111.3	S1987 D1988 N1989 Y1993 L2004 R2008	S1987-H1991 CarbonylContact C-O 3.49Å; S1987-H1991 WeakPolarHBondContact CA-O 3.32Å; D1988-H1991 PolarHBondContact N-O 2.94Å; D1988-H1991 PolarHBondContact O-N 3.22Å; N1989-H1991 VanDerWaalsContact C-N 3.29Å; N1989-H1991 PolarHBondContact O-N 2.85Å; N1989-H1991 VanDerWaalsContact O-N 3.16Å; H1991-Y1993 HydrophobicContact CB-CD2 4.32Å; H1991-Y1993 HydrophobicContact CB-CE2 3.57Å; H1991-L2004 HydrophobicContact CB-CD1 4.19Å; H1991-R2008 VanDerWaalsContact NE2-C 3.33Å; H1991-R2008 PolarHBondContact NE2-O 3.16Å
1992	V	96.6	Very high	91.8	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	127.1	168.4	-172.5	0	0	0	0	108.9	Y1985 F1986 A2005 A2006 L2030 I2033 L2036 L2044 I2046	Y1985-V1992 HydrophobicContact CD1-CG1 4.25Å; F1986-V1992 WeakPolarHBondContact O-CA 3.21Å; V1992-A2005 HydrophobicContact CB-CB 4.46Å; V1992-A2005 HydrophobicContact CG1-CB 4.29Å; V1992-A2005 WeakPolarHBondContact O-CA 3.26Å; V1992-A2005 WeakPolarHBondContact O-CB 3.31Å; V1992-A2005 PolarHBondContact O-N 3.15Å; V1992-A2006 HydrophobicContact CB-CB 4.15Å; V1992-A2006 HydrophobicContact CG2-CB 4.42Å; V1992-A2006 PolarHBondContact N-O 3.04Å; V1992-A2006 PolarHBondContact O-N 2.9Å; V1992-A2006 VanDerWaalsContact O-N 3.09Å; V1992-L2030 HydrophobicContact CG2-CD1 4.16Å; V1992-I2033 HydrophobicContact CG2-CD1 3.61Å; V1992-L2036 HydrophobicContact CG1-CD1 3.98Å; V1992-L2036 HydrophobicContact CG1-CD2 4.21Å; V1992-L2036 HydrophobicContact CG2-CD1 4.5Å; V1992-L2036 HydrophobicContact CG2-CD2 3.77Å; V1992-L2044 HydrophobicContact CG1-CD2 4.09Å; V1992-I2046 HydrophobicContact CG2-CD1 4.01Å; V1992-I2046 HydrophobicContact CG2-CG1 4.37Å; V1992-I2046 HydrophobicContact CG2-CG2 4.26Å
1993	Y	96	Very high	92	Very high	5 Å²	5	18.2 Å²	18.2	2%	0.02	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	154.1	177.1	-63.8	-80.4	0	0	0	110.7	T1955 P1956 M1967 Y1985 F1986 D1988 H1991 V2002 S2003 L2004	T1955-Y1993 WeakPolarHBondContact CG2-OH 3.11Å; P1956-Y1993 HydrophobicContact CG-CD1 3.97Å; P1956-Y1993 HydrophobicContact CG-CE1 3.59Å; P1956-Y1993 VanDerWaalsContact CG-CE1 3.46Å; M1967-Y1993 HydrophobicContact CE-CD1 3.88Å; M1967-Y1993 HydrophobicContact CE-CD2 3.89Å; M1967-Y1993 HydrophobicContact CE-CE1 3.81Å; M1967-Y1993 HydrophobicContact CE-CE2 3.81Å; M1967-Y1993 HydrophobicContact CE-CG 3.91Å; Y1985-Y1993 CarbonylContact C-O 3.59Å; Y1985-Y1993 VanDerWaalsContact CA-O 3.29Å; Y1985-Y1993 WeakPolarHBondContact CA-O 3.21Å; F1986-Y1993 HydrophobicContact CD2-CD2 4.29Å; F1986-Y1993 AromaticContact CE2-CD2 3.73Å; F1986-Y1993 HydrophobicContact CE2-CD2 3.73Å; F1986-Y1993 AromaticContact CE2-CG 3.97Å; F1986-Y1993 HydrophobicContact CE2-CG 3.99Å; F1986-Y1993 VanDerWaalsContact CZ-CB 3.43Å; F1986-Y1993 HydrophobicContact CZ-CD2 4.22Å; F1986-Y1993 AromaticContact CZ-CG 3.97Å; F1986-Y1993 HydrophobicContact CZ-CG 4Å; F1986-Y1993 PolarHBondContact N-O 3.05Å; F1986-Y1993 PolarHBondContact O-N 3.17Å; D1988-Y1993 HydrophobicContact CB-CD2 4.23Å; D1988-Y1993 HydrophobicContact CB-CE2 4Å; H1991-Y1993 HydrophobicContact CB-CD2 4.32Å; H1991-Y1993 HydrophobicContact CB-CE2 3.57Å; Y1993-V2002 HydrophobicContact CD1-CG1 4.13Å; Y1993-V2002 HydrophobicContact CG-CG1 4.24Å; Y1993-S2003 CarbonylContact C-O 3.56Å; Y1993-S2003 VanDerWaalsContact CA-O 3.28Å; Y1993-S2003 WeakPolarHBondContact CA-O 3.26Å; Y1993-L2004 HydrophobicContact CD1-CB 4.48Å; Y1993-L2004 HydrophobicContact CD1-CD1 4.2Å; Y1993-L2004 HydrophobicContact CE1-CB 4.46Å; Y1993-L2004 HydrophobicContact CE1-CD1 3.81Å
1994	R	94.3	Very high	92	Very high	18.2 Å²	18.2	19.2 Å²	19.2	7%	0.069	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	118	174.5	179.9	-176.4	111.3	-175.1	5.3	108.7	T1469 E1608 E1981 A1983 L1984 Y1985 H1996 V2002 S2003 A2005	T1469-R1994 PolarHBondContact OG1-NH2 3.21Å; E1608-R1994 VanDerWaalsContact CD-NH1 3.35Å; E1608-R1994 IonicContact OE1-CZ 3.33Å; E1608-R1994 IonicContact OE1-NH1 3.06Å; E1608-R1994 PolarHBondContact OE1-NH1 2.91Å; E1608-R1994 IonicContact OE1-NH2 3.08Å; E1608-R1994 PolarHBondContact OE1-NH2 2.84Å; E1608-R1994 VanDerWaalsContact OE1-NH2 3.15Å; E1608-R1994 IonicContact OE2-CZ 3.25Å; E1608-R1994 IonicContact OE2-NH1 3.54Å; E1608-R1994 PolarHBondContact OE2-NH1 2.81Å; E1608-R1994 VanDerWaalsContact OE2-NH1 3.12Å; E1608-R1994 IonicContact OE2-NH2 3.36Å; E1608-R1994 PolarHBondContact OE2-NH2 3.23Å; E1981-R1994 IonicContact OE2-CZ 3.13Å; E1981-R1994 IonicContact OE2-NE 3.79Å; E1981-R1994 PolarHBondContact OE2-NE 3.2Å; E1981-R1994 IonicContact OE2-NH1 3.79Å; E1981-R1994 PolarHBondContact OE2-NH1 3.24Å; E1981-R1994 IonicContact OE2-NH2 3.7Å; A1983-R1994 HydrophobicContact CB-CG 3.9Å; L1984-R1994 CarbonylContact O-C 3.53Å; L1984-R1994 WeakPolarHBondContact O-CA 3.32Å; Y1985-R1994 HydrophobicContact CD1-CB 4.04Å; Y1985-R1994 HydrophobicContact CD1-CG 4.37Å; Y1985-R1994 HydrophobicContact CE1-CB 3.72Å; Y1985-R1994 HydrophobicContact CE1-CG 3.85Å; Y1985-R1994 HydrophobicContact CE2-CG 4.42Å; Y1985-R1994 VanDerWaalsContact OH-CD 3.27Å; Y1985-R1994 WeakPolarHBondContact OH-CD 3.32Å; R1994-H1996 PolarHBondContact NE-CE1 2.84Å; R1994-H1996 VanDerWaalsContact NE-CE1 3.26Å; R1994-H1996 PolarHBondContact NE-NE2 2.87Å; R1994-H1996 VanDerWaalsContact NE-NE2 3.16Å; R1994-H1996 PolarHBondContact NH2-CD2 2.93Å; R1994-H1996 VanDerWaalsContact NH2-CD2 3.34Å; R1994-H1996 PolarHBondContact NH2-NE2 2.91Å; R1994-V2002 CarbonylContact O-C 3.46Å; R1994-V2002 VanDerWaalsContact O-CA 3.31Å; R1994-V2002 WeakPolarHBondContact O-CA 3.42Å; R1994-S2003 PolarHBondContact N-O 3.12Å; R1994-S2003 PolarHBondContact NE-OG 3.14Å; R1994-S2003 VanDerWaalsContact NE-OG 3.13Å; R1994-S2003 PolarHBondContact NH2-OG 2.75Å; R1994-S2003 VanDerWaalsContact NH2-OG 3.09Å; R1994-S2003 PolarHBondContact O-N 2.78Å; R1994-S2003 PolarHBondContact O-OG 2.95Å; R1994-A2005 HydrophobicContact CB-CB 4.06Å
1995	Y	93.9	Very high	91.8	Very high	6.8 Å²	6.8	19.3 Å²	19.3	3%	0.027	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	116	168.3	176.4	-109.3	0	0	0	109.8	V1923 I1924 A1983 L1984 L1997 Q2000 M2001 V2002	V1923-Y1995 HydrophobicContact CG1-CD1 4.4Å; V1923-Y1995 HydrophobicContact CG1-CE1 3.56Å; V1923-Y1995 VanDerWaalsContact CG1-CE1 3.47Å; V1923-Y1995 HydrophobicContact CG1-CE2 4.14Å; V1923-Y1995 VanDerWaalsContact CG1-CZ 3.43Å; V1923-Y1995 VanDerWaalsContact CG1-OH 3.26Å; V1923-Y1995 WeakPolarHBondContact CG1-OH 3.37Å; I1924-Y1995 HydrophobicContact CD1-CD1 4.4Å; I1924-Y1995 HydrophobicContact CD1-CD2 3.75Å; I1924-Y1995 HydrophobicContact CD1-CE2 4.35Å; I1924-Y1995 HydrophobicContact CD1-CG 3.76Å; I1924-Y1995 HydrophobicContact CG1-CD2 4.21Å; I1924-Y1995 HydrophobicContact CG1-CE2 4.35Å; A1983-Y1995 CarbonylContact C-O 3.48Å; A1983-Y1995 VanDerWaalsContact CA-O 3.3Å; A1983-Y1995 WeakPolarHBondContact CA-O 3.29Å; L1984-Y1995 HydrophobicContact CB-CD1 4.45Å; L1984-Y1995 HydrophobicContact CD1-CD1 4.08Å; L1984-Y1995 HydrophobicContact CG-CD1 4.45Å; L1984-Y1995 PolarHBondContact N-O 3.11Å; L1984-Y1995 PolarHBondContact O-N 3.02Å; Y1995-L1997 HydrophobicContact CD1-CD2 3.89Å; Y1995-L1997 HydrophobicContact CE1-CD2 3.77Å; Y1995-L1997 PolarHBondContact O-N 2.78Å; Y1995-Q2000 VanDerWaalsContact CE2-C 3.44Å; Y1995-Q2000 VanDerWaalsContact CE2-CA 3.48Å; Y1995-Q2000 HydrophobicContact CE2-CB 4.05Å; Y1995-Q2000 WeakPolarHBondContact CE2-O 3.41Å; Y1995-Q2000 WeakPolarHBondContact OH-CA 3.46Å; Y1995-Q2000 VanDerWaalsContact OH-CB 3.25Å; Y1995-Q2000 WeakPolarHBondContact OH-CB 3.36Å; Y1995-Q2000 VanDerWaalsContact OH-CG 3.26Å; Y1995-Q2000 WeakPolarHBondContact OH-CG 3.43Å; Y1995-M2001 WeakPolarHBondContact CA-O 3.31Å; Y1995-V2002 HydrophobicContact CD2-CG2 3.71Å; Y1995-V2002 HydrophobicContact CG-CG2 4.5Å
1996	H	89.5	Confident	91.6	Very high	6.6 Å²	6.6	19.3 Å²	19.3	3%	0.031	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	115.4	-179	-159.9	-46.1	0	0	0	109.5	W1607 E1608 R1994 V1998 N1999 Q2000 M2001 S2003	W1607-H1996 PolarHBondContact O-NE2 3.19Å; W1607-H1996 VanDerWaalsContact O-NE2 3.09Å; E1608-H1996 IonicContact OE1-CD2 3.17Å; E1608-H1996 PolarHBondContact OE1-CD2 2.91Å; E1608-H1996 IonicContact OE1-NE2 3.06Å; R1994-H1996 PolarHBondContact NE-CE1 2.84Å; R1994-H1996 VanDerWaalsContact NE-CE1 3.26Å; R1994-H1996 PolarHBondContact NE-NE2 2.87Å; R1994-H1996 VanDerWaalsContact NE-NE2 3.16Å; R1994-H1996 PolarHBondContact NH2-CD2 2.93Å; R1994-H1996 VanDerWaalsContact NH2-CD2 3.34Å; R1994-H1996 PolarHBondContact NH2-NE2 2.91Å; H1996-V1998 VanDerWaalsContact C-N 3.28Å; H1996-V1998 PolarHBondContact ND1-N 3.01Å; H1996-V1998 PolarHBondContact O-N 2.99Å; H1996-N1999 WeakPolarHBondContact CB-OD1 3.36Å; H1996-N1999 PolarHBondContact O-N 3.3Å; H1996-N1999 PolarHBondContact O-OD1 3.08Å; H1996-N1999 VanDerWaalsContact O-OD1 3.11Å; H1996-Q2000 VanDerWaalsContact O-CA 3.32Å; H1996-Q2000 WeakPolarHBondContact O-CA 3.25Å; H1996-Q2000 PolarHBondContact O-N 2.86Å; H1996-M2001 PolarHBondContact N-O 3.07Å; H1996-S2003 PolarHBondContact NE2-OG 3.34Å
1997	L	87.4	Confident	91.3	Very high	28.2 Å²	28.2	19.3 Å²	19.3	15%	0.148	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-36.6	-169.1	-65.4	175.6	0	0	0	112.8	T1892 Y1897 F1977 Q1982 L1984 Y1995	T1892-L1997 HydrophobicContact CG2-CD1 4.34Å; Y1897-L1997 HydrophobicContact CE1-CD2 4.29Å; Y1897-L1997 HydrophobicContact CE2-CD2 4.27Å; Y1897-L1997 VanDerWaalsContact OH-CD2 3.23Å; Y1897-L1997 WeakPolarHBondContact OH-CD2 3.41Å; F1977-L1997 HydrophobicContact CD2-CD1 4.35Å; F1977-L1997 HydrophobicContact CE2-CD1 3.87Å; Q1982-L1997 HydrophobicContact CB-CD1 4.5Å; Q1982-L1997 VanDerWaalsContact O-CB 3.28Å; Q1982-L1997 WeakPolarHBondContact O-CB 3.31Å; Q1982-L1997 WeakPolarHBondContact O-CD1 3.15Å; Q1982-L1997 VanDerWaalsContact O-CG 3.27Å; Q1982-L1997 WeakPolarHBondContact O-CG 3.42Å; Q1982-L1997 PolarHBondContact O-N 3.09Å; Q1982-L1997 VanDerWaalsContact O-N 3.12Å; L1984-L1997 HydrophobicContact CD1-CD2 3.87Å; L1984-L1997 HydrophobicContact CG-CD2 3.9Å; L1984-L1997 HydrophobicContact CG-CG 4.29Å; Y1995-L1997 HydrophobicContact CD1-CD2 3.89Å; Y1995-L1997 HydrophobicContact CE1-CD2 3.77Å; Y1995-L1997 PolarHBondContact O-N 2.78Å
1998	V	80.5	Confident	90.8	Very high	22.8 Å²	22.8	22.6 Å²	22.6	14%	0.138	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-48.5	-176.3	-178.5	0	0	0	0	112.6	R1604 F1606 Q1982 H1996 L2723	R1604-V1998 VanDerWaalsContact NE-CG1 3.33Å; R1604-V1998 PolarHBondContact NH1-O 3.3Å; R1604-V1998 VanDerWaalsContact NH1-O 3.16Å; R1604-V1998 VanDerWaalsContact NH2-CG1 3.26Å; R1604-V1998 PolarHBondContact NH2-O 3.26Å; F1606-V1998 HydrophobicContact CD1-CG1 4.24Å; F1606-V1998 HydrophobicContact CE1-CG1 4.49Å; Q1982-V1998 HydrophobicContact CB-CG2 4.46Å; H1996-V1998 VanDerWaalsContact C-N 3.28Å; H1996-V1998 PolarHBondContact ND1-N 3.01Å; H1996-V1998 PolarHBondContact O-N 2.99Å; V1998-L2723 HydrophobicContact CG1-CB 4.4Å
1999	N	81.2	Confident	90.4	Very high	20 Å²	20	23.3 Å²	23.3	11%	0.107	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99	-6.8	-176.7	66.8	10	0	0	0	113.6	H1467 F1606 H1996 M2001	H1467-N1999 PolarHBondContact O-ND2 2.85Å; F1606-N1999 HydrophobicContact CD1-CB 3.84Å; F1606-N1999 HydrophobicContact CE1-CB 3.82Å; H1996-N1999 WeakPolarHBondContact CB-OD1 3.36Å; H1996-N1999 PolarHBondContact O-N 3.3Å; H1996-N1999 PolarHBondContact O-OD1 3.08Å; H1996-N1999 VanDerWaalsContact O-OD1 3.11Å; N1999-M2001 HydrophobicContact CB-CG 4.35Å; N1999-M2001 PolarHBondContact O-N 3.24Å; N1999-M2001 VanDerWaalsContact OD1-CB 3.23Å; N1999-M2001 WeakPolarHBondContact OD1-CB 3.28Å; N1999-M2001 WeakPolarHBondContact OD1-CG 3.43Å; N1999-M2001 PolarHBondContact OD1-N 3.17Å; N1999-M2001 VanDerWaalsContact OD1-N 3.15Å
2000	Q	86.2	Confident	89.9	Confident	68.2 Å²	68.2	30.4 Å²	30.4	32%	0.319	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.8	28.5	180	-52.7	-175.8	-4.9	0	0	114	T1419 G1964 Y1995 H1996	T1419-Q2000 HydrophobicContact CG2-CG 3.98Å; G1964-Q2000 PolarHBondContact N-O 3.07Å; Y1995-Q2000 VanDerWaalsContact CE2-C 3.44Å; Y1995-Q2000 VanDerWaalsContact CE2-CA 3.48Å; Y1995-Q2000 HydrophobicContact CE2-CB 4.05Å; Y1995-Q2000 WeakPolarHBondContact CE2-O 3.41Å; Y1995-Q2000 WeakPolarHBondContact OH-CA 3.46Å; Y1995-Q2000 VanDerWaalsContact OH-CB 3.25Å; Y1995-Q2000 WeakPolarHBondContact OH-CB 3.36Å; Y1995-Q2000 VanDerWaalsContact OH-CG 3.26Å; Y1995-Q2000 WeakPolarHBondContact OH-CG 3.43Å; H1996-Q2000 VanDerWaalsContact O-CA 3.32Å; H1996-Q2000 WeakPolarHBondContact O-CA 3.25Å; H1996-Q2000 PolarHBondContact O-N 2.86Å
2001	M	88.3	Confident	89.1	Confident	19.2 Å²	19.2	30.9 Å²	30.9	10%	0.095	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	143.6	179.2	-64.5	-62.9	-86.1	0	0	111.6	G1464 I1466 D1468 S1961 P1963 Y1995 H1996 N1999	G1464-M2001 WeakPolarHBondContact O-CE 3.19Å; I1466-M2001 HydrophobicContact CB-CE 4.42Å; I1466-M2001 HydrophobicContact CB-SD 4.28Å; I1466-M2001 HydrophobicContact CG2-CE 3.79Å; I1466-M2001 HydrophobicContact CG2-CG 3.57Å; I1466-M2001 HydrophobicContact CG2-SD 3.23Å; I1466-M2001 WeakPolarHBondContact CG2-SD 3.27Å; D1468-M2001 HydrophobicContact CB-CE 4.11Å; S1961-M2001 WeakPolarHBondContact O-CE 3.29Å; P1963-M2001 VanDerWaalsContact CA-SD 3.57Å; P1963-M2001 HydrophobicContact CB-SD 4.19Å; P1963-M2001 HydrophobicContact CG-CE 4.31Å; P1963-M2001 HydrophobicContact CG-SD 3.85Å; P1963-M2001 VanDerWaalsContact N-SD 3.43Å; Y1995-M2001 WeakPolarHBondContact CA-O 3.31Å; H1996-M2001 PolarHBondContact N-O 3.07Å; N1999-M2001 HydrophobicContact CB-CG 4.35Å; N1999-M2001 PolarHBondContact O-N 3.24Å; N1999-M2001 VanDerWaalsContact OD1-CB 3.23Å; N1999-M2001 WeakPolarHBondContact OD1-CB 3.28Å; N1999-M2001 WeakPolarHBondContact OD1-CG 3.43Å; N1999-M2001 PolarHBondContact OD1-N 3.17Å; N1999-M2001 VanDerWaalsContact OD1-N 3.15Å
2002	V	91.6	Very high	88.4	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	131.7	173.7	-174.3	0	0	0	0	110.4	I1924 S1961 V1962 M1967 F1986 Y1993 R1994 Y1995	I1924-V2002 HydrophobicContact CD1-CG2 3.9Å; I1924-V2002 HydrophobicContact CG1-CG2 4.38Å; I1924-V2002 HydrophobicContact CG2-CG2 4.45Å; S1961-V2002 CarbonylContact C-O 3.5Å; S1961-V2002 WeakPolarHBondContact CA-O 3.34Å; S1961-V2002 VanDerWaalsContact CB-O 3.24Å; S1961-V2002 WeakPolarHBondContact CB-O 3.3Å; S1961-V2002 PolarHBondContact OG-O 2.7Å; V1962-V2002 HydrophobicContact CG2-CB 4.25Å; V1962-V2002 PolarHBondContact N-O 3.2Å; V1962-V2002 PolarHBondContact O-N 3.14Å; M1967-V2002 HydrophobicContact CE-CG1 4.22Å; M1967-V2002 HydrophobicContact SD-CB 3.85Å; M1967-V2002 HydrophobicContact SD-CG1 3.46Å; M1967-V2002 VanDerWaalsContact SD-CG1 3.55Å; M1967-V2002 WeakPolarHBondContact SD-CG1 3.23Å; M1967-V2002 HydrophobicContact SD-CG2 3.98Å; F1986-V2002 HydrophobicContact CE1-CG1 3.95Å; F1986-V2002 HydrophobicContact CE1-CG2 4.39Å; F1986-V2002 HydrophobicContact CZ-CG1 3.76Å; F1986-V2002 HydrophobicContact CZ-CG2 4.38Å; Y1993-V2002 HydrophobicContact CD1-CG1 4.13Å; Y1993-V2002 HydrophobicContact CG-CG1 4.24Å; R1994-V2002 CarbonylContact O-C 3.46Å; R1994-V2002 VanDerWaalsContact O-CA 3.31Å; R1994-V2002 WeakPolarHBondContact O-CA 3.42Å; Y1995-V2002 HydrophobicContact CD2-CG2 3.71Å; Y1995-V2002 HydrophobicContact CG-CG2 4.5Å
2003	S	91.4	Very high	87.1	Confident	9 Å²	9	34.7 Å²	34.7	6%	0.063	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	157	174.4	57.2	0	0	0	0	111.4	S1961 Y1993 R1994 H1996 A2005	S1961-S2003 WeakPolarHBondContact OG-CB 3.37Å; Y1993-S2003 CarbonylContact C-O 3.56Å; Y1993-S2003 VanDerWaalsContact CA-O 3.28Å; Y1993-S2003 WeakPolarHBondContact CA-O 3.26Å; R1994-S2003 PolarHBondContact N-O 3.12Å; R1994-S2003 PolarHBondContact NE-OG 3.14Å; R1994-S2003 VanDerWaalsContact NE-OG 3.13Å; R1994-S2003 PolarHBondContact NH2-OG 2.75Å; R1994-S2003 VanDerWaalsContact NH2-OG 3.09Å; R1994-S2003 PolarHBondContact O-N 2.78Å; R1994-S2003 PolarHBondContact O-OG 2.95Å; H1996-S2003 PolarHBondContact NE2-OG 3.34Å; S2003-A2005 PolarHBondContact O-N 3.02Å
2004	L	92.3	Very high	85.8	Confident	19.6 Å²	19.6	39 Å²	39	10%	0.103	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	125.7	172.5	-174.5	68.7	0	0	0	110.1	H1991 Y1993 G2007 L2009 T2026	H1991-L2004 HydrophobicContact CB-CD1 4.19Å; Y1993-L2004 HydrophobicContact CD1-CB 4.48Å; Y1993-L2004 HydrophobicContact CD1-CD1 4.2Å; Y1993-L2004 HydrophobicContact CE1-CB 4.46Å; Y1993-L2004 HydrophobicContact CE1-CD1 3.81Å; L2004-G2007 VanDerWaalsContact CD2-O 3.28Å; L2004-G2007 WeakPolarHBondContact CD2-O 3.38Å; L2004-L2009 HydrophobicContact CD1-CD1 4.45Å; L2004-L2009 HydrophobicContact CD1-CG 4.35Å; L2004-L2009 HydrophobicContact CD2-CD1 3.87Å; L2004-L2009 HydrophobicContact CD2-CG 3.94Å; L2004-T2026 HydrophobicContact CB-CG2 4.42Å; L2004-T2026 HydrophobicContact CD2-CG2 3.98Å; L2004-T2026 HydrophobicContact CG-CG2 3.97Å
2005	A	92.5	Very high	84.2	Confident	6 Å²	6	43.6 Å²	43.6	5%	0.05	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	-39.6	179.3	0	0	0	0	0	112.6	Y1985 V1992 R1994 S2003 A2025 R2055	Y1985-A2005 HydrophobicContact CD1-CB 3.88Å; Y1985-A2005 HydrophobicContact CE1-CB 3.66Å; V1992-A2005 HydrophobicContact CB-CB 4.46Å; V1992-A2005 HydrophobicContact CG1-CB 4.29Å; V1992-A2005 WeakPolarHBondContact O-CA 3.26Å; V1992-A2005 WeakPolarHBondContact O-CB 3.31Å; V1992-A2005 PolarHBondContact O-N 3.15Å; R1994-A2005 HydrophobicContact CB-CB 4.06Å; S2003-A2005 PolarHBondContact O-N 3.02Å; A2005-A2025 WeakPolarHBondContact O-CB 3.42Å; A2005-R2055 WeakPolarHBondContact O-CD 3.31Å; A2005-R2055 PolarHBondContact O-NH1 3.48Å
2006	A	92.9	Very high	82.2	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	157.3	176.3	0	0	0	0	0	110.8	V1992 A2025 L2030 I2046	V1992-A2006 HydrophobicContact CB-CB 4.15Å; V1992-A2006 HydrophobicContact CG2-CB 4.42Å; V1992-A2006 PolarHBondContact N-O 3.04Å; V1992-A2006 PolarHBondContact O-N 2.9Å; V1992-A2006 VanDerWaalsContact O-N 3.09Å; A2006-A2025 WeakPolarHBondContact CA-O 3.3Å; A2006-A2025 HydrophobicContact CB-CB 3.93Å; A2006-L2030 HydrophobicContact CB-CD1 3.89Å; A2006-I2046 HydrophobicContact CB-CD1 3.47Å; A2006-I2046 VanDerWaalsContact CB-CD1 3.46Å
2007	G	90.4	Very high	80.2	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.283	C	S	.	.	S	Bend	trans	95.7	145.2	-174.6	0	0	0	0	0	111.7	L2004 A2025 T2026 V2028	L2004-G2007 VanDerWaalsContact CD2-O 3.28Å; L2004-G2007 WeakPolarHBondContact CD2-O 3.38Å; G2007-A2025 PolarHBondContact N-O 3.06Å; G2007-T2026 CarbonylContact O-C 3.53Å; G2007-T2026 WeakPolarHBondContact O-CA 3.34Å; G2007-V2028 CarbonylContact C-O 3.55Å; G2007-V2028 VanDerWaalsContact C-O 3.28Å; G2007-V2028 VanDerWaalsContact CA-O 3.27Å; G2007-V2028 WeakPolarHBondContact CA-O 3.4Å
2008	R	87.5	Confident	78.2	Confident	72 Å²	72	53.5 Å²	53.5	27%	0.272	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-96.5	122.8	-176.7	-173.9	-178.6	159.1	-170	-0.3	111.4	H1991 I2014 T2026 V2028 E2029	H1991-R2008 VanDerWaalsContact NE2-C 3.33Å; H1991-R2008 PolarHBondContact NE2-O 3.16Å; R2008-I2014 VanDerWaalsContact CZ-CG1 3.45Å; R2008-I2014 VanDerWaalsContact NH2-CD1 3.3Å; R2008-I2014 VanDerWaalsContact NH2-CG1 3.35Å; R2008-T2026 WeakPolarHBondContact CA-O 3.38Å; R2008-V2028 PolarHBondContact N-O 3.2Å; R2008-E2029 HydrophobicContact CB-CG 3.93Å; R2008-E2029 HydrophobicContact CG-CG 4.42Å; R2008-E2029 IonicContact CZ-OE1 3.46Å; R2008-E2029 VanDerWaalsContact CZ-OE1 3.26Å; R2008-E2029 IonicContact NE-OE1 2.77Å; R2008-E2029 PolarHBondContact NE-OE1 3.45Å; R2008-E2029 IonicContact NH1-OE1 3.42Å; R2008-E2029 PolarHBondContact NH1-OE1 3.18Å; R2008-E2029 IonicContact NH2-OE1 2.82Å; R2008-E2029 PolarHBondContact NH2-OE1 2.92Å
2009	L	86.1	Confident	76.5	Confident	20.4 Å²	20.4	62.8 Å²	62.8	11%	0.107	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-80.4	141.1	171.2	-67.7	170.2	0	0	0	110.8	T1955 P1956 L2004 G2011 C2012	T1955-L2009 HydrophobicContact CG2-CD1 4.26Å; T1955-L2009 HydrophobicContact CG2-CD2 3.79Å; P1956-L2009 VanDerWaalsContact O-CD1 3.26Å; P1956-L2009 WeakPolarHBondContact O-CD1 3.27Å; L2004-L2009 HydrophobicContact CD1-CD1 4.45Å; L2004-L2009 HydrophobicContact CD1-CG 4.35Å; L2004-L2009 HydrophobicContact CD2-CD1 3.87Å; L2004-L2009 HydrophobicContact CD2-CG 3.94Å; L2009-G2011 PolarHBondContact O-N 3.05Å; L2009-C2012 VanDerWaalsContact CB-SG 3.57Å; L2009-C2012 WeakPolarHBondContact O-CB 3.32Å; L2009-C2012 PolarHBondContact O-N 2.72Å; L2009-C2012 VanDerWaalsContact O-N 3.1Å; L2009-C2012 PolarHBondContact O-SG 2.93Å; L2009-C2012 VanDerWaalsContact O-SG 3.39Å
2010	K	81.1	Confident	74.9	Confident	215.8 Å²	215.8	64.4 Å²	64.4	94%	0.938	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	129.3	178	-68.6	-178.7	179.9	175.7	0	110.2	C2012	K2010-C2012 VanDerWaalsContact C-N 3.35Å
2011	G	77.7	Confident	73.6	Confident	79.8 Å²	79.8	67 Å²	67	82%	0.823	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.8	-5.9	-179.3	0	0	0	0	0	115.3	L2009	L2009-G2011 PolarHBondContact O-N 3.05Å
2012	C	78.6	Confident	72.8	Confident	16.4 Å²	16.4	66.8 Å²	66.8	11%	0.111	35%	0.35	C	S	.	.			trans	-70.4	133.1	172.5	-63.7	0	0	0	0	111.4	C1958 L2009 K2010 I2014	C1958-C2012 HydrophobicContact CB-CB 3.91Å; C1958-C2012 WeakPolarHBondContact CB-SG 3.44Å; C1958-C2012 WeakPolarHBondContact SG-CA 3.2Å; C1958-C2012 WeakPolarHBondContact SG-CB 3.39Å; C1958-C2012 CovalentContact SG-SG 2.01Å; C1958-C2012 PolarHBondContact SG-SG 3.23Å; L2009-C2012 VanDerWaalsContact CB-SG 3.57Å; L2009-C2012 WeakPolarHBondContact O-CB 3.32Å; L2009-C2012 PolarHBondContact O-N 2.72Å; L2009-C2012 VanDerWaalsContact O-N 3.1Å; L2009-C2012 PolarHBondContact O-SG 2.93Å; L2009-C2012 VanDerWaalsContact O-SG 3.39Å; K2010-C2012 VanDerWaalsContact C-N 3.35Å; C2012-I2014 PolarHBondContact O-N 3.24Å
2013	P	70.2	Confident	72.2	Confident	95 Å²	95	69.2 Å²	69.2	62%	0.617	37%	0.365	S	S	*	.			trans	-65.2	132	177.5	25.9	-32.1	0	0	0	110.5	K2015	P2013-K2015 PolarHBondContact O-N 2.89Å
2014	I	67.4	Low	71.9	Confident	95.8 Å²	95.8	71.4 Å²	71.4	49%	0.491	38%	0.376	S	S	.	.			trans	-77.9	113	169.4	-51.6	169.5	0	0	0	106.3	R2008 C2012 T2016	R2008-I2014 VanDerWaalsContact CZ-CG1 3.45Å; R2008-I2014 VanDerWaalsContact NH2-CD1 3.3Å; R2008-I2014 VanDerWaalsContact NH2-CG1 3.35Å; C2012-I2014 PolarHBondContact O-N 3.24Å; I2014-T2016 HydrophobicContact CB-CG2 4.2Å; I2014-T2016 HydrophobicContact CG2-CG2 3.89Å; I2014-T2016 VanDerWaalsContact CG2-CG2 3.45Å; I2014-T2016 PolarHBondContact O-N 3.14Å
2015	K	61	Low	71.8	Confident	114.8 Å²	114.8	70.5 Å²	70.5	50%	0.499	37%	0.372	S	S	.	.			trans	-80.3	105.9	164.8	-64.4	-177.7	180	177.3	0	106.4	P2013 D2017 Q2027	P2013-K2015 PolarHBondContact O-N 2.89Å; K2015-D2017 VanDerWaalsContact C-N 3.29Å; K2015-D2017 PolarHBondContact O-N 3.03Å; K2015-Q2027 PolarHBondContact O-NE2 2.91Å; K2015-Q2027 VanDerWaalsContact O-NE2 3.13Å; K2015-Q2027 PolarHBondContact O-OE1 2.89Å
2016	T	52.8	Low	71.5	Confident	105.6 Å²	105.6	72.4 Å²	72.4	65%	0.648	38%	0.383	S	S	*	.			trans	-78.9	69.8	174.8	51.7	0	0	0	0	109.3	I2014 D2018	I2014-T2016 HydrophobicContact CB-CG2 4.2Å; I2014-T2016 HydrophobicContact CG2-CG2 3.89Å; I2014-T2016 VanDerWaalsContact CG2-CG2 3.45Å; I2014-T2016 PolarHBondContact O-N 3.14Å; T2016-D2018 PolarHBondContact O-N 3.32Å
2017	D	47.8	Very low	71.1	Confident	79 Å²	79	74.4 Å²	74.4	42%	0.422	39%	0.392	S	S	.	.			trans	-93.4	86.4	176.8	-74.6	-31.4	0	0	0	111.2	K2015 W2019 S2020 Q2027 R2061 W2518	K2015-D2017 VanDerWaalsContact C-N 3.29Å; K2015-D2017 PolarHBondContact O-N 3.03Å; D2017-W2019 PolarHBondContact O-N 2.95Å; D2017-S2020 PolarHBondContact O-OG 3.28Å; D2017-Q2027 PolarHBondContact OD2-NE2 3.19Å; D2017-R2061 IonicContact OD2-NH2 2.79Å; D2017-W2518 VanDerWaalsContact C-CZ3 3.47Å; D2017-W2518 HydrophobicContact CB-CB 4.18Å; D2017-W2518 HydrophobicContact CB-CD2 2.96Å; D2017-W2518 HydrophobicContact CB-CE3 3.24Å; D2017-W2518 HydrophobicContact CB-CG 3.38Å; D2017-W2518 HydrophobicContact CB-CH2 3.58Å; D2017-W2518 HydrophobicContact CB-CZ2 3.36Å; D2017-W2518 HydrophobicContact CB-CZ3 3.53Å; D2017-W2518 VanDerWaalsContact CG-CD2 3.48Å; D2017-W2518 WeakPolarHBondContact O-CZ3 3.5Å; D2017-W2518 VanDerWaalsContact OD1-CD1 3.24Å; D2017-W2518 PolarHBondContact OD2-NE1 2.91Å
2018	D	45.6	Very low	70.9	Confident	64.4 Å²	64.4	75 Å²	75	34%	0.344	40%	0.396	S	S	.	.			trans	-66.4	94.6	178.2	-78.7	-34.6	0	0	0	113	T2016 S2020 F2021 R2061 N2305 M2306 W2518	T2016-D2018 PolarHBondContact O-N 3.32Å; D2018-S2020 WeakPolarHBondContact CB-OG 3.16Å; D2018-S2020 PolarHBondContact O-N 3.31Å; D2018-S2020 PolarHBondContact O-OG 3.08Å; D2018-F2021 HydrophobicContact CB-CD2 4.14Å; D2018-F2021 PolarHBondContact O-N 3.23Å; D2018-F2021 VanDerWaalsContact O-N 3.1Å; D2018-R2061 VanDerWaalsContact CG-NH2 3.32Å; D2018-R2061 IonicContact OD1-NH2 3.29Å; D2018-R2061 IonicContact OD2-CZ 3.27Å; D2018-R2061 IonicContact OD2-NE 3.01Å; D2018-R2061 IonicContact OD2-NH2 3.36Å; D2018-R2061 PolarHBondContact OD2-NH2 3.19Å; D2018-N2305 PolarHBondContact OD1-ND2 2.93Å; D2018-M2306 WeakPolarHBondContact OD1-CG 3.2Å; D2018-M2306 VanDerWaalsContact OD2-CE 3.25Å; D2018-M2306 WeakPolarHBondContact OD2-CE 3.44Å; D2018-M2306 WeakPolarHBondContact OD2-CG 3.45Å; D2018-W2518 WeakPolarHBondContact OD1-CZ3 3.41Å
2019	W	43.2	Very low	70.9	Confident	217.6 Å²	217.6	77.5 Å²	77.5	82%	0.824	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	6.5	179	-67.5	71.1	0	0	0	113.8	D2017 F2021 R2299 P2303	D2017-W2019 PolarHBondContact O-N 2.95Å; W2019-F2021 VanDerWaalsContact C-N 3.34Å; W2019-R2299 WeakPolarHBondContact CZ3-O 3.48Å; W2019-P2303 HydrophobicContact CZ3-CG 4.26Å
2020	S	48.9	Very low	71	Confident	53.8 Å²	53.8	77.1 Å²	77.1	38%	0.376	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	23	179.4	55.1	0	0	0	0	112.7	D2017 D2018 A2022 R2061	D2017-S2020 PolarHBondContact O-OG 3.28Å; D2018-S2020 WeakPolarHBondContact CB-OG 3.16Å; D2018-S2020 PolarHBondContact O-N 3.31Å; D2018-S2020 PolarHBondContact O-OG 3.08Å; S2020-A2022 PolarHBondContact O-N 2.97Å; S2020-A2022 PolarHBondContact OG-O 2.81Å; S2020-R2061 VanDerWaalsContact CB-CZ 3.47Å; S2020-R2061 VanDerWaalsContact OG-CZ 3.26Å; S2020-R2061 PolarHBondContact OG-NE 3.1Å; S2020-R2061 PolarHBondContact OG-NH1 2.92Å; S2020-R2061 PolarHBondContact OG-NH2 2.85Å
2021	F	57.9	Low	71.2	Confident	123.4 Å²	123.4	68.3 Å²	68.3	54%	0.541	38%	0.379	S	S	.	.	S	Bend	trans	-100.7	142.2	-177.6	-66.7	-82.7	0	0	0	113	M1483 D2018 W2019 V2304 M2306	M1483-F2021 HydrophobicContact CE-CD1 4.43Å; M1483-F2021 HydrophobicContact CE-CE1 4.01Å; D2018-F2021 HydrophobicContact CB-CD2 4.14Å; D2018-F2021 PolarHBondContact O-N 3.23Å; D2018-F2021 VanDerWaalsContact O-N 3.1Å; W2019-F2021 VanDerWaalsContact C-N 3.34Å; F2021-V2304 HydrophobicContact CD1-CG1 3.97Å; F2021-V2304 HydrophobicContact CD2-CB 4.44Å; F2021-V2304 HydrophobicContact CE1-CB 3.9Å; F2021-V2304 HydrophobicContact CE1-CG1 3.09Å; F2021-V2304 HydrophobicContact CE1-CG2 4.4Å; F2021-V2304 HydrophobicContact CE2-CB 3.55Å; F2021-V2304 HydrophobicContact CE2-CG1 3.76Å; F2021-V2304 HydrophobicContact CE2-CG2 3.74Å; F2021-V2304 HydrophobicContact CZ-CB 3.29Å; F2021-V2304 HydrophobicContact CZ-CG1 3.01Å; F2021-V2304 HydrophobicContact CZ-CG2 3.43Å; F2021-V2304 VanDerWaalsContact CZ-CG2 3.43Å; F2021-M2306 HydrophobicContact CD1-CE 3.37Å; F2021-M2306 HydrophobicContact CE1-CE 3.63Å
2022	A	71.4	Confident	71.8	Confident	14.2 Å²	14.2	68.6 Å²	68.6	12%	0.117	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-83.1	135.2	176.7	0	0	0	0	0	111.1	S2020 R2061 L2062 Y2063	S2020-A2022 PolarHBondContact O-N 2.97Å; S2020-A2022 PolarHBondContact OG-O 2.81Å; A2022-R2061 HydrophobicContact CB-CB 4.31Å; A2022-R2061 VanDerWaalsContact O-CD 3.24Å; A2022-R2061 WeakPolarHBondContact O-CD 3.32Å; A2022-R2061 VanDerWaalsContact O-CG 3.3Å; A2022-R2061 WeakPolarHBondContact O-CG 3.31Å; A2022-R2061 PolarHBondContact O-NE 3.39Å; A2022-R2061 PolarHBondContact O-NH1 2.86Å; A2022-L2062 WeakPolarHBondContact CB-O 3.4Å; A2022-Y2063 HydrophobicContact CB-CD1 3.62Å; A2022-Y2063 HydrophobicContact CB-CD2 4.35Å; A2022-Y2063 HydrophobicContact CB-CE1 3.38Å; A2022-Y2063 HydrophobicContact CB-CE2 4.14Å; A2022-Y2063 HydrophobicContact CB-CG 4.1Å
2023	P	80.2	Confident	72.6	Confident	50.4 Å²	50.4	68.2 Å²	68.2	33%	0.327	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-66	159.1	-177.1	28.3	-35.8	0	0	0	112.7	A2025 V2028 R2061 L2062	P2023-A2025 PolarHBondContact O-N 3.26Å; P2023-V2028 HydrophobicContact CB-CG2 4.02Å; P2023-V2028 HydrophobicContact CG-CG2 3.46Å; P2023-V2028 VanDerWaalsContact CG-CG2 3.43Å; P2023-R2061 WeakPolarHBondContact O-CA 3.24Å; P2023-R2061 WeakPolarHBondContact O-CB 3.43Å; P2023-L2062 PolarHBondContact O-N 3.08Å
2024	L	84.8	Confident	73.7	Confident	54.8 Å²	54.8	67.9 Å²	67.9	29%	0.287	35%	0.345	S	S	.	.	B	Isolated β-bridge	trans	-59.1	138.3	168.4	-79.5	146.4	0	0	0	109.5	T2026 Q2027 R2061	L2024-T2026 PolarHBondContact O-N 3.09Å; L2024-T2026 VanDerWaalsContact O-N 3.07Å; L2024-Q2027 HydrophobicContact CB-CB 4.48Å; L2024-Q2027 HydrophobicContact CB-CG 4.03Å; L2024-Q2027 WeakPolarHBondContact O-CB 3.38Å; L2024-Q2027 PolarHBondContact O-N 3.14Å; L2024-R2061 HydrophobicContact CD2-CG 4.41Å
2025	A	88.9	Confident	75	Confident	1.4 Å²	1.4	63.5 Å²	63.5	1%	0.012	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-59.7	-26.2	-176	0	0	0	0	0	114.1	A2005 A2006 G2007 P2023 Q2027 R2055 N2060 L2062	A2005-A2025 WeakPolarHBondContact O-CB 3.42Å; A2006-A2025 WeakPolarHBondContact CA-O 3.3Å; A2006-A2025 HydrophobicContact CB-CB 3.93Å; G2007-A2025 PolarHBondContact N-O 3.06Å; P2023-A2025 PolarHBondContact O-N 3.26Å; A2025-Q2027 VanDerWaalsContact C-N 3.29Å; A2025-Q2027 PolarHBondContact O-N 3.19Å; A2025-R2055 HydrophobicContact CB-CB 4.4Å; A2025-R2055 HydrophobicContact CB-CG 3.9Å; A2025-N2060 WeakPolarHBondContact CB-O 3.3Å; A2025-N2060 PolarHBondContact N-O 2.92Å; A2025-N2060 VanDerWaalsContact N-O 3.1Å; A2025-L2062 HydrophobicContact CB-CB 4.01Å; A2025-L2062 HydrophobicContact CB-CD1 4.07Å
2026	T	87.9	Confident	76.7	Confident	45 Å²	45	58.8 Å²	58.8	28%	0.276	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-79.6	-5.2	176.8	57.4	0	0	0	0	114.1	L2004 G2007 R2008 L2024	L2004-T2026 HydrophobicContact CB-CG2 4.42Å; L2004-T2026 HydrophobicContact CD2-CG2 3.98Å; L2004-T2026 HydrophobicContact CG-CG2 3.97Å; G2007-T2026 CarbonylContact O-C 3.53Å; G2007-T2026 WeakPolarHBondContact O-CA 3.34Å; R2008-T2026 WeakPolarHBondContact CA-O 3.38Å; L2024-T2026 PolarHBondContact O-N 3.09Å; L2024-T2026 VanDerWaalsContact O-N 3.07Å
2027	Q	84.4	Confident	78.7	Confident	42.8 Å²	42.8	54.3 Å²	54.3	20%	0.2	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-102.7	-7.6	178	-64.2	177.4	-19	0	0	112.9	K2015 D2017 L2024 A2025	K2015-Q2027 PolarHBondContact O-NE2 2.91Å; K2015-Q2027 VanDerWaalsContact O-NE2 3.13Å; K2015-Q2027 PolarHBondContact O-OE1 2.89Å; D2017-Q2027 PolarHBondContact OD2-NE2 3.19Å; L2024-Q2027 HydrophobicContact CB-CB 4.48Å; L2024-Q2027 HydrophobicContact CB-CG 4.03Å; L2024-Q2027 WeakPolarHBondContact O-CB 3.38Å; L2024-Q2027 PolarHBondContact O-N 3.14Å; A2025-Q2027 VanDerWaalsContact C-N 3.29Å; A2025-Q2027 PolarHBondContact O-N 3.19Å
2028	V	85.5	Confident	81	Confident	12 Å²	12	51.6 Å²	51.6	7%	0.073	26%	0.263	C	S	.	.	S	Bend	trans	-93.1	134	-179.1	-176.9	0	0	0	0	110	G2007 R2008 P2023 L2030 L2062	G2007-V2028 CarbonylContact C-O 3.55Å; G2007-V2028 VanDerWaalsContact C-O 3.28Å; G2007-V2028 VanDerWaalsContact CA-O 3.27Å; G2007-V2028 WeakPolarHBondContact CA-O 3.4Å; R2008-V2028 PolarHBondContact N-O 3.2Å; P2023-V2028 HydrophobicContact CB-CG2 4.02Å; P2023-V2028 HydrophobicContact CG-CG2 3.46Å; P2023-V2028 VanDerWaalsContact CG-CG2 3.43Å; V2028-L2030 HydrophobicContact CG1-CD2 4.38Å; V2028-L2030 PolarHBondContact O-N 3.03Å; V2028-L2062 HydrophobicContact CB-CD2 3.82Å; V2028-L2062 HydrophobicContact CG1-CD2 3.81Å; V2028-L2062 HydrophobicContact CG2-CB 4.32Å; V2028-L2062 HydrophobicContact CG2-CD2 3.86Å
2029	E	86.6	Confident	83.2	Confident	125 Å²	125	48.9 Å²	48.9	58%	0.584	25%	0.249	S	C	*	.			trans	-79.4	111.6	168.7	-72	172.8	-164.2	0	0	108.5	R2008	R2008-E2029 HydrophobicContact CB-CG 3.93Å; R2008-E2029 HydrophobicContact CG-CG 4.42Å; R2008-E2029 IonicContact CZ-OE1 3.46Å; R2008-E2029 VanDerWaalsContact CZ-OE1 3.26Å; R2008-E2029 IonicContact NE-OE1 2.77Å; R2008-E2029 PolarHBondContact NE-OE1 3.45Å; R2008-E2029 IonicContact NH1-OE1 3.42Å; R2008-E2029 PolarHBondContact NH1-OE1 3.18Å; R2008-E2029 IonicContact NH2-OE1 2.82Å; R2008-E2029 PolarHBondContact NH2-OE1 2.92Å
2030	L	88.4	Confident	85.2	Confident	11.2 Å²	11.2	40.8 Å²	40.8	6%	0.059	22%	0.224	C	C	.	.			trans	-83.6	175.3	177.9	-61	173.1	0	0	0	110.4	D1990 V1992 A2006 V2028 I2033 I2046 H2051 W2053 L2062	D1990-L2030 WeakPolarHBondContact CB-O 3.17Å; D1990-L2030 WeakPolarHBondContact O-CB 3.41Å; V1992-L2030 HydrophobicContact CG2-CD1 4.16Å; A2006-L2030 HydrophobicContact CB-CD1 3.89Å; V2028-L2030 HydrophobicContact CG1-CD2 4.38Å; V2028-L2030 PolarHBondContact O-N 3.03Å; L2030-I2033 HydrophobicContact CD1-CD1 4.32Å; L2030-I2046 HydrophobicContact CD1-CD1 4.28Å; L2030-I2046 HydrophobicContact CD1-CG2 4.35Å; L2030-H2051 PolarHBondContact O-NE2 2.55Å; L2030-W2053 HydrophobicContact CD2-CG 4.38Å; L2030-L2062 HydrophobicContact CD2-CD2 3.9Å
2031	G	86.3	Confident	86.9	Confident	31.4 Å²	31.4	41.4 Å²	41.4	32%	0.324	22%	0.221	S	C	.	.			trans	-117.1	-169.8	177.9	0	0	0	0	0	111.4	D1990 I2033	D1990-G2031 WeakPolarHBondContact CA-O 3.42Å; D1990-G2031 WeakPolarHBondContact CB-O 3.15Å; D1990-G2031 VanDerWaalsContact OD1-C 3.28Å; G2031-I2033 WeakPolarHBondContact O-CG1 3.41Å; G2031-I2033 PolarHBondContact O-N 3.06Å
2032	D	90.2	Very high	88.4	Confident	86.2 Å²	86.2	35.5 Å²	35.5	46%	0.461	20%	0.195	S	C	.	.			trans	-37.9	112.9	175.7	-127.9	17.5	0	0	0	112.5	D1990 R2034 G2048 P2049	D1990-D2032 PolarHBondContact OD1-N 2.88Å; D2032-R2034 PolarHBondContact O-N 3.44Å; D2032-R2034 IonicContact OD2-CZ 3.5Å; D2032-R2034 IonicContact OD2-NE 3.29Å; D2032-R2034 PolarHBondContact OD2-NE 2.86Å; D2032-R2034 IonicContact OD2-NH2 3.32Å; D2032-R2034 PolarHBondContact OD2-NH2 2.98Å; D2032-G2048 VanDerWaalsContact O-CA 3.27Å; D2032-G2048 WeakPolarHBondContact O-CA 3.36Å; D2032-P2049 HydrophobicContact CB-CG 4.07Å; D2032-P2049 WeakPolarHBondContact O-CD 3.28Å
2033	I	94.9	Very high	89.4	Confident	8.6 Å²	8.6	35.8 Å²	35.8	4%	0.044	20%	0.195	C	C	.	.			trans	-89.8	125.2	-178.7	-58.7	171.8	0	0	0	109.6	H1974 V1992 L2030 G2031 L2036 I2046 A2047	H1974-I2033 PolarHBondContact CD2-O 3.38Å; H1974-I2033 PolarHBondContact NE2-O 2.95Å; H1974-I2033 VanDerWaalsContact NE2-O 3.14Å; V1992-I2033 HydrophobicContact CG2-CD1 3.61Å; L2030-I2033 HydrophobicContact CD1-CD1 4.32Å; G2031-I2033 WeakPolarHBondContact O-CG1 3.41Å; G2031-I2033 PolarHBondContact O-N 3.06Å; I2033-L2036 HydrophobicContact CG2-CD2 4.07Å; I2033-L2036 HydrophobicContact CG2-CG 4.39Å; I2033-I2046 HydrophobicContact CD1-CG2 4.46Å; I2033-I2046 HydrophobicContact CG1-CG2 4.41Å; I2033-I2046 HydrophobicContact CG2-CG2 4.25Å; I2033-A2047 CarbonylContact C-O 3.52Å
2034	R	93.5	Very high	90.1	Very high	88.6 Å²	88.6	33.4 Å²	33.4	33%	0.334	18%	0.18	S	C	.	.			trans	-103.7	-18.2	-178.4	-62.5	-61.3	-178.9	131.8	-5.4	114.3	H1974 D2032 A2047 P2049 S2107 I2108	H1974-R2034 PolarHBondContact CE1-O 3.1Å; H1974-R2034 VanDerWaalsContact NE2-C 3.3Å; H1974-R2034 PolarHBondContact NE2-O 3.08Å; D2032-R2034 PolarHBondContact O-N 3.44Å; D2032-R2034 IonicContact OD2-CZ 3.5Å; D2032-R2034 IonicContact OD2-NE 3.29Å; D2032-R2034 PolarHBondContact OD2-NE 2.86Å; D2032-R2034 IonicContact OD2-NH2 3.32Å; D2032-R2034 PolarHBondContact OD2-NH2 2.98Å; R2034-A2047 HydrophobicContact CB-CB 4.42Å; R2034-A2047 PolarHBondContact N-O 2.89Å; R2034-P2049 HydrophobicContact CG-CG 4.41Å; R2034-S2107 PolarHBondContact NH1-OG 2.65Å; R2034-I2108 WeakPolarHBondContact CB-O 3.34Å; R2034-I2108 WeakPolarHBondContact CG-O 3.32Å; R2034-I2108 PolarHBondContact NH1-O 3.18Å
2035	G	94.1	Very high	90.7	Very high	3.8 Å²	3.8	31.2 Å²	31.2	4%	0.039	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-178.1	154.3	177.5	0	0	0	0	0	112.9	A2047	G2035-A2047 PolarHBondContact O-N 3.05Å
2036	L	97	Very high	91	Very high	14.6 Å²	14.6	31.3 Å²	31.3	8%	0.076	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	138.1	176.4	-61.5	178.1	0	0	0	109.1	H1974 A1976 V1992 I2033 L2044 F2045 I2046	H1974-L2036 HydrophobicContact CB-CB 4.45Å; H1974-L2036 HydrophobicContact CB-CD1 4.11Å; H1974-L2036 HydrophobicContact CB-CG 4.07Å; A1976-L2036 HydrophobicContact CB-CB 3.94Å; V1992-L2036 HydrophobicContact CG1-CD1 3.98Å; V1992-L2036 HydrophobicContact CG1-CD2 4.21Å; V1992-L2036 HydrophobicContact CG2-CD1 4.5Å; V1992-L2036 HydrophobicContact CG2-CD2 3.77Å; I2033-L2036 HydrophobicContact CG2-CD2 4.07Å; I2033-L2036 HydrophobicContact CG2-CG 4.39Å; L2036-L2044 HydrophobicContact CD2-CD1 4.48Å; L2036-F2045 WeakPolarHBondContact CA-O 3.36Å; L2036-I2046 HydrophobicContact CD2-CB 4.27Å; L2036-I2046 HydrophobicContact CD2-CG1 3.97Å; L2036-I2046 HydrophobicContact CD2-CG2 4.03Å
2037	S	96.1	Very high	91.3	Very high	12.4 Å²	12.4	29.2 Å²	29.2	9%	0.087	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	149.2	171.4	-166.6	0	0	0	0	110.3	F2045 T2112 V2113	S2037-F2045 PolarHBondContact N-O 3.06Å; S2037-F2045 VanDerWaalsContact N-O 3.12Å; S2037-F2045 PolarHBondContact O-N 3.05Å; S2037-T2112 WeakPolarHBondContact OG-CA 3.43Å; S2037-V2113 PolarHBondContact OG-N 2.89Å
2038	V	94.7	Very high	91.7	Very high	21.6 Å²	21.6	27.2 Å²	27.2	13%	0.131	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	132.2	-178.3	-177.5	0	0	0	0	109.1	A1976 Y1985 D2043 L2044	A1976-V2038 HydrophobicContact CB-CG2 4.07Å; Y1985-V2038 HydrophobicContact CD2-CG2 3.9Å; Y1985-V2038 HydrophobicContact CE2-CG2 4.39Å; V2038-D2043 CarbonylContact C-O 3.55Å; V2038-D2043 WeakPolarHBondContact CA-O 3.33Å; V2038-L2044 HydrophobicContact CG2-CD1 3.82Å
2039	S	91.6	Very high	91.9	Very high	8.6 Å²	8.6	28.3 Å²	28.3	6%	0.06	15%	0.153	C	C	.	.			trans	-75.6	161.7	174.5	74.3	0	0	0	0	111.9	Q2041 G2042 D2043	S2039-Q2041 PolarHBondContact O-N 2.98Å; S2039-Q2041 VanDerWaalsContact O-N 3.12Å; S2039-Q2041 PolarHBondContact OG-N 3.17Å; S2039-Q2041 PolarHBondContact OG-OE1 3.02Å; S2039-G2042 PolarHBondContact O-N 2.92Å; S2039-G2042 PolarHBondContact OG-N 3.03Å; S2039-D2043 PolarHBondContact N-O 3.1Å; S2039-D2043 WeakPolarHBondContact OG-CA 3.36Å; S2039-D2043 WeakPolarHBondContact OG-CB 3.31Å; S2039-D2043 PolarHBondContact OG-N 3.01Å; S2039-D2043 VanDerWaalsContact OG-N 3.08Å; S2039-D2043 PolarHBondContact OG-O 2.8Å
2040	P	85.1	Confident	92	Very high	46.4 Å²	46.4	26.8 Å²	26.8	30%	0.301	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-26.6	172.1	-25.5	34.9	0	0	0	114.1	G2042 L2115	P2040-G2042 VanDerWaalsContact C-N 3.28Å; P2040-G2042 PolarHBondContact O-N 3.1Å; P2040-L2115 HydrophobicContact CB-CD1 4.41Å; P2040-L2115 HydrophobicContact CG-CB 4.49Å; P2040-L2115 HydrophobicContact CG-CD1 4.07Å; P2040-L2115 WeakPolarHBondContact CG-O 3.46Å
2041	Q	85	Confident	92	Very high	66 Å²	66	27.9 Å²	27.9	31%	0.308	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-4	176.5	-62.1	77	16.7	0	0	113.4	E1590 V1611 L1980 S2039 S2057	E1590-Q2041 VanDerWaalsContact OE1-CG 3.3Å; E1590-Q2041 WeakPolarHBondContact OE1-CG 3.33Å; E1590-Q2041 PolarHBondContact OE1-NE2 3Å; V1611-Q2041 HydrophobicContact CG1-CB 4.34Å; V1611-Q2041 HydrophobicContact CG1-CG 4.41Å; L1980-Q2041 VanDerWaalsContact CD2-O 3.29Å; L1980-Q2041 WeakPolarHBondContact CD2-O 3.3Å; S2039-Q2041 PolarHBondContact O-N 2.98Å; S2039-Q2041 VanDerWaalsContact O-N 3.12Å; S2039-Q2041 PolarHBondContact OG-N 3.17Å; S2039-Q2041 PolarHBondContact OG-OE1 3.02Å; Q2041-S2057 PolarHBondContact O-OG 3.1Å; Q2041-S2057 VanDerWaalsContact O-OG 3.09Å
2042	G	88.9	Confident	92.2	Very high	0.2 Å²	0.2	26.4 Å²	26.4	0%	0.002	14%	0.136	C	C	.	.			trans	87.3	7.4	-179.2	0	0	0	0	0	114.8	S2039 P2040 L2044	S2039-G2042 PolarHBondContact O-N 2.92Å; S2039-G2042 PolarHBondContact OG-N 3.03Å; P2040-G2042 VanDerWaalsContact C-N 3.28Å; P2040-G2042 PolarHBondContact O-N 3.1Å; G2042-L2044 PolarHBondContact O-N 2.79Å
2043	D	92.4	Very high	92.3	Very high	21 Å²	21	23.1 Å²	23.1	11%	0.112	12%	0.117	C	C	.	.	P	Polyproline II helix	trans	-72	131	174.8	-64.4	-25.7	0	0	0	109.7	V2038 S2039 F2045 I2054 R2055 R2056 S2057	V2038-D2043 CarbonylContact C-O 3.55Å; V2038-D2043 WeakPolarHBondContact CA-O 3.33Å; S2039-D2043 PolarHBondContact N-O 3.1Å; S2039-D2043 WeakPolarHBondContact OG-CA 3.36Å; S2039-D2043 WeakPolarHBondContact OG-CB 3.31Å; S2039-D2043 PolarHBondContact OG-N 3.01Å; S2039-D2043 VanDerWaalsContact OG-N 3.08Å; S2039-D2043 PolarHBondContact OG-O 2.8Å; D2043-F2045 HydrophobicContact CB-CE2 4.32Å; D2043-I2054 HydrophobicContact CB-CD1 3.83Å; D2043-I2054 HydrophobicContact CB-CG1 3.94Å; D2043-R2055 WeakPolarHBondContact CA-O 3.35Å; D2043-R2056 VanDerWaalsContact OD1-CA 3.29Å; D2043-R2056 WeakPolarHBondContact OD1-CA 3.38Å; D2043-R2056 WeakPolarHBondContact OD2-CD 3.31Å; D2043-R2056 IonicContact OD2-CZ 3.26Å; D2043-R2056 IonicContact OD2-NE 2.77Å; D2043-R2056 IonicContact OD2-NH1 3.33Å; D2043-R2056 PolarHBondContact OD2-NH1 3.02Å; D2043-S2057 PolarHBondContact OD1-N 3.01Å
2044	L	95.9	Very high	92.2	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	119.5	-178.9	170.7	72	0	0	0	110	Y1985 V1992 L2036 V2038 G2042 I2046 I2054 R2055	Y1985-L2044 HydrophobicContact CD1-CD1 4.28Å; Y1985-L2044 HydrophobicContact CD1-CD2 3.72Å; Y1985-L2044 HydrophobicContact CD2-CD1 4.4Å; Y1985-L2044 HydrophobicContact CE1-CD2 3.92Å; Y1985-L2044 HydrophobicContact CG-CD1 4.03Å; Y1985-L2044 HydrophobicContact CG-CD2 4.26Å; V1992-L2044 HydrophobicContact CG1-CD2 4.09Å; L2036-L2044 HydrophobicContact CD2-CD1 4.48Å; V2038-L2044 HydrophobicContact CG2-CD1 3.82Å; G2042-L2044 PolarHBondContact O-N 2.79Å; L2044-I2046 HydrophobicContact CD2-CD1 4.1Å; L2044-I2046 HydrophobicContact CD2-CG1 4.16Å; L2044-I2046 HydrophobicContact CG-CD1 4.43Å; L2044-I2046 HydrophobicContact CG-CG1 4.02Å; L2044-I2054 CarbonylContact O-C 3.55Å; L2044-I2054 WeakPolarHBondContact O-CA 3.36Å; L2044-R2055 HydrophobicContact CB-CB 4.24Å; L2044-R2055 PolarHBondContact N-O 3.12Å; L2044-R2055 PolarHBondContact O-N 3.15Å
2045	F	96.3	Very high	92.2	Very high	8.8 Å²	8.8	19.2 Å²	19.2	4%	0.039	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	132.8	172.9	-68.2	-99	0	0	0	110.5	W1657 L2036 S2037 D2043 I2052 W2053 I2054 V2065 I2111 V2113 L2119	W1657-F2045 AromaticContact CH2-CE1 3.83Å; W1657-F2045 HydrophobicContact CH2-CE1 3.89Å; W1657-F2045 AromaticContact CH2-CZ 3.78Å; W1657-F2045 HydrophobicContact CH2-CZ 3.97Å; W1657-F2045 AromaticContact CZ3-CE1 3.87Å; W1657-F2045 HydrophobicContact CZ3-CE1 3.94Å; W1657-F2045 HydrophobicContact CZ3-CZ 4.4Å; L2036-F2045 WeakPolarHBondContact CA-O 3.36Å; S2037-F2045 PolarHBondContact N-O 3.06Å; S2037-F2045 VanDerWaalsContact N-O 3.12Å; S2037-F2045 PolarHBondContact O-N 3.05Å; D2043-F2045 HydrophobicContact CB-CE2 4.32Å; F2045-I2052 HydrophobicContact CD1-CG2 4.32Å; F2045-W2053 CarbonylContact C-O 3.55Å; F2045-W2053 VanDerWaalsContact CA-O 3.3Å; F2045-W2053 WeakPolarHBondContact CA-O 3.29Å; F2045-I2054 HydrophobicContact CD1-CB 4.2Å; F2045-I2054 HydrophobicContact CD1-CD1 4.43Å; F2045-I2054 HydrophobicContact CD1-CG1 4.32Å; F2045-I2054 HydrophobicContact CD2-CG1 4.4Å; F2045-I2054 HydrophobicContact CE1-CB 4.12Å; F2045-I2054 HydrophobicContact CE1-CD1 3.76Å; F2045-I2054 HydrophobicContact CE1-CG1 4.05Å; F2045-I2054 HydrophobicContact CE2-CD1 3.9Å; F2045-I2054 HydrophobicContact CE2-CG1 4.22Å; F2045-I2054 HydrophobicContact CG-CG1 4.5Å; F2045-I2054 HydrophobicContact CZ-CB 4.46Å; F2045-I2054 HydrophobicContact CZ-CD1 3.43Å; F2045-I2054 VanDerWaalsContact CZ-CD1 3.45Å; F2045-I2054 HydrophobicContact CZ-CG1 4.02Å; F2045-V2065 HydrophobicContact CD1-CG2 4.32Å; F2045-V2065 HydrophobicContact CE1-CG2 4.19Å; F2045-I2111 HydrophobicContact CB-CD1 3.84Å; F2045-V2113 HydrophobicContact CB-CG2 4.48Å; F2045-V2113 HydrophobicContact CD2-CG2 3.53Å; F2045-V2113 VanDerWaalsContact CD2-CG2 3.5Å; F2045-V2113 HydrophobicContact CE2-CG2 3.74Å; F2045-V2113 HydrophobicContact CG-CG2 4.05Å; F2045-V2113 HydrophobicContact CZ-CG2 4.34Å; F2045-L2119 HydrophobicContact CB-CD1 4.46Å; F2045-L2119 HydrophobicContact CD1-CD1 4.18Å; F2045-L2119 HydrophobicContact CD1-CD2 3.78Å; F2045-L2119 HydrophobicContact CD1-CG 4.36Å; F2045-L2119 HydrophobicContact CE1-CB 4.28Å; F2045-L2119 HydrophobicContact CE1-CD1 4.36Å; F2045-L2119 HydrophobicContact CE1-CD2 3.94Å; F2045-L2119 HydrophobicContact CE1-CG 4.4Å; F2045-L2119 HydrophobicContact CG-CD1 4.36Å; F2045-L2119 HydrophobicContact CG-CD2 4.45Å
2046	I	96.6	Very high	91.9	Very high	2.8 Å²	2.8	23.2 Å²	23.2	1%	0.014	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	111.5	-178.2	-51.2	171.6	0	0	0	107.8	V1992 A2006 L2030 I2033 L2036 L2044 I2052 W2053 L2062	V1992-I2046 HydrophobicContact CG2-CD1 4.01Å; V1992-I2046 HydrophobicContact CG2-CG1 4.37Å; V1992-I2046 HydrophobicContact CG2-CG2 4.26Å; A2006-I2046 HydrophobicContact CB-CD1 3.47Å; A2006-I2046 VanDerWaalsContact CB-CD1 3.46Å; L2030-I2046 HydrophobicContact CD1-CD1 4.28Å; L2030-I2046 HydrophobicContact CD1-CG2 4.35Å; I2033-I2046 HydrophobicContact CD1-CG2 4.46Å; I2033-I2046 HydrophobicContact CG1-CG2 4.41Å; I2033-I2046 HydrophobicContact CG2-CG2 4.25Å; L2036-I2046 HydrophobicContact CD2-CB 4.27Å; L2036-I2046 HydrophobicContact CD2-CG1 3.97Å; L2036-I2046 HydrophobicContact CD2-CG2 4.03Å; L2044-I2046 HydrophobicContact CD2-CD1 4.1Å; L2044-I2046 HydrophobicContact CD2-CG1 4.16Å; L2044-I2046 HydrophobicContact CG-CD1 4.43Å; L2044-I2046 HydrophobicContact CG-CG1 4.02Å; I2046-I2052 WeakPolarHBondContact O-CA 3.41Å; I2046-W2053 HydrophobicContact CB-CB 4.37Å; I2046-W2053 PolarHBondContact N-O 3.18Å; I2046-W2053 PolarHBondContact O-N 3.07Å; I2046-L2062 HydrophobicContact CD1-CD1 4.22Å
2047	A	94.8	Very high	91.4	Very high	0.4 Å²	0.4	23 Å²	23	0%	0.003	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	130	175.8	0	0	0	0	0	110.8	I2033 R2034 G2035 I2052 I2108 I2111	I2033-A2047 CarbonylContact C-O 3.52Å; R2034-A2047 HydrophobicContact CB-CB 4.42Å; R2034-A2047 PolarHBondContact N-O 2.89Å; G2035-A2047 PolarHBondContact O-N 3.05Å; A2047-I2052 HydrophobicContact CB-CG1 4.34Å; A2047-I2108 HydrophobicContact CB-CG2 4Å; A2047-I2111 HydrophobicContact CB-CB 4.44Å; A2047-I2111 HydrophobicContact CB-CD1 3.82Å; A2047-I2111 HydrophobicContact CB-CG1 3.97Å; A2047-I2111 HydrophobicContact CB-CG2 3.7Å
2048	G	92.6	Very high	90.7	Very high	1.4 Å²	1.4	25.4 Å²	25.4	1%	0.014	13%	0.128	C	C	.	.			trans	-97	-169	158.2	0	0	0	0	0	111.1	D2032 Q2050 H2051 I2108	D2032-G2048 VanDerWaalsContact O-CA 3.27Å; D2032-G2048 WeakPolarHBondContact O-CA 3.36Å; G2048-Q2050 VanDerWaalsContact C-N 3.31Å; G2048-Q2050 PolarHBondContact O-N 3.31Å; G2048-H2051 PolarHBondContact N-O 3.27Å; G2048-I2108 WeakPolarHBondContact O-CB 3.42Å
2049	P	89.7	Confident	90	Very high	35.2 Å²	35.2	26.1 Å²	26.1	23%	0.229	13%	0.131	C	C	.	.	S	Bend	trans	-66.3	-29.9	-176.4	-13.8	22.7	0	0	0	114.2	D2032 R2034 N2106 S2107 I2108	D2032-P2049 HydrophobicContact CB-CG 4.07Å; D2032-P2049 WeakPolarHBondContact O-CD 3.28Å; R2034-P2049 HydrophobicContact CG-CG 4.41Å; P2049-N2106 CarbonylContact O-C 3.53Å; P2049-S2107 WeakPolarHBondContact O-CA 3.38Å; P2049-I2108 PolarHBondContact O-N 3.01Å
2050	Q	88.2	Confident	89.8	Confident	93.4 Å²	93.4	27.9 Å²	27.9	44%	0.436	14%	0.14	S	C	.	.	S	Bend	trans	-136.9	0.6	-174.3	-63.5	-174	-18.4	0	0	113.7	G2048 F2105 N2106	G2048-Q2050 VanDerWaalsContact C-N 3.31Å; G2048-Q2050 PolarHBondContact O-N 3.31Å; Q2050-F2105 WeakPolarHBondContact CB-O 3.37Å; Q2050-F2105 WeakPolarHBondContact CG-O 3.42Å; Q2050-N2106 WeakPolarHBondContact CG-O 3.33Å; Q2050-N2106 PolarHBondContact NE2-O 3.08Å; Q2050-N2106 PolarHBondContact NE2-OD1 2.8Å
2051	H	87.2	Confident	89.8	Confident	34.6 Å²	34.6	27.9 Å²	27.9	16%	0.16	13%	0.134	C	C	.	.			trans	-139.3	154.4	-173.7	60.3	-100.9	0	0	0	110.3	L2030 G2048 W2053 T2066	L2030-H2051 PolarHBondContact O-NE2 2.55Å; G2048-H2051 PolarHBondContact N-O 3.27Å; H2051-W2053 AromaticContact CD2-CD1 3.46Å; H2051-W2053 VanDerWaalsContact CD2-CD1 3.46Å; H2051-W2053 AromaticContact CD2-CE2 3.86Å; H2051-W2053 AromaticContact CD2-NE1 2.99Å; H2051-W2053 PolarHBondContact CD2-NE1 3.12Å; H2051-W2053 AromaticContact CG-NE1 3.82Å; H2051-W2053 AromaticContact NE2-CD1 3.84Å; H2051-W2053 AromaticContact NE2-NE1 3.27Å; H2051-W2053 PolarHBondContact NE2-NE1 2.92Å; H2051-T2066 VanDerWaalsContact CA-O 3.27Å; H2051-T2066 WeakPolarHBondContact CA-O 3.41Å; H2051-T2066 WeakPolarHBondContact CB-O 3.31Å
2052	I	92.3	Very high	89.9	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	131.4	176.3	-55	173.3	0	0	0	107.8	F2045 I2046 A2047 V2065 T2066 F2105 I2108 I2111 L2119 V2121 I2132	F2045-I2052 HydrophobicContact CD1-CG2 4.32Å; I2046-I2052 WeakPolarHBondContact O-CA 3.41Å; A2047-I2052 HydrophobicContact CB-CG1 4.34Å; I2052-V2065 HydrophobicContact CB-CB 4.18Å; I2052-V2065 HydrophobicContact CG2-CB 4.23Å; I2052-V2065 HydrophobicContact CG2-CG2 4.35Å; I2052-V2065 WeakPolarHBondContact O-CB 3.31Å; I2052-V2065 PolarHBondContact O-N 3.03Å; I2052-T2066 HydrophobicContact CB-CG2 3.77Å; I2052-T2066 HydrophobicContact CD1-CG2 4.01Å; I2052-T2066 HydrophobicContact CG1-CG2 3.75Å; I2052-T2066 PolarHBondContact N-O 3.25Å; I2052-T2066 VanDerWaalsContact N-O 3.1Å; I2052-T2066 PolarHBondContact O-N 3.14Å; I2052-F2105 HydrophobicContact CD1-CE2 4.33Å; I2052-I2108 HydrophobicContact CD1-CD1 3.99Å; I2052-I2108 HydrophobicContact CG1-CD1 3.7Å; I2052-I2111 HydrophobicContact CD1-CG2 4.31Å; I2052-L2119 HydrophobicContact CD1-CD2 4.08Å; I2052-L2119 HydrophobicContact CG2-CD2 4.08Å; I2052-V2121 HydrophobicContact CD1-CB 4.44Å; I2052-V2121 HydrophobicContact CD1-CG1 4.06Å; I2052-V2121 HydrophobicContact CD1-CG2 3.54Å; I2052-V2121 VanDerWaalsContact CD1-CG2 3.46Å; I2052-I2132 HydrophobicContact CD1-CD1 4.27Å
2053	W	91.8	Very high	89.8	Confident	16.8 Å²	16.8	28.1 Å²	28.1	6%	0.064	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	150.4	174.1	-58.2	100.1	0	0	0	110.5	L2030 F2045 I2046 H2051 L2062 Y2063 P2064 H2069	L2030-W2053 HydrophobicContact CD2-CG 4.38Å; F2045-W2053 CarbonylContact C-O 3.55Å; F2045-W2053 VanDerWaalsContact CA-O 3.3Å; F2045-W2053 WeakPolarHBondContact CA-O 3.29Å; I2046-W2053 HydrophobicContact CB-CB 4.37Å; I2046-W2053 PolarHBondContact N-O 3.18Å; I2046-W2053 PolarHBondContact O-N 3.07Å; H2051-W2053 AromaticContact CD2-CD1 3.46Å; H2051-W2053 VanDerWaalsContact CD2-CD1 3.46Å; H2051-W2053 AromaticContact CD2-CE2 3.86Å; H2051-W2053 AromaticContact CD2-NE1 2.99Å; H2051-W2053 PolarHBondContact CD2-NE1 3.12Å; H2051-W2053 AromaticContact CG-NE1 3.82Å; H2051-W2053 AromaticContact NE2-CD1 3.84Å; H2051-W2053 AromaticContact NE2-NE1 3.27Å; H2051-W2053 PolarHBondContact NE2-NE1 2.92Å; W2053-L2062 HydrophobicContact CB-CD1 3.64Å; W2053-L2062 HydrophobicContact CB-CD2 4.04Å; W2053-L2062 HydrophobicContact CB-CG 3.8Å; W2053-L2062 HydrophobicContact CD2-CD2 3.65Å; W2053-L2062 HydrophobicContact CD2-CG 4.03Å; W2053-L2062 HydrophobicContact CE3-CD2 3.73Å; W2053-L2062 HydrophobicContact CE3-CG 3.8Å; W2053-L2062 HydrophobicContact CG-CD1 4.31Å; W2053-L2062 HydrophobicContact CG-CD2 3.78Å; W2053-L2062 HydrophobicContact CG-CG 4.05Å; W2053-L2062 HydrophobicContact CZ3-CD2 4.29Å; W2053-Y2063 CarbonylContact C-O 3.56Å; W2053-Y2063 WeakPolarHBondContact CA-O 3.41Å; W2053-P2064 HydrophobicContact CE3-CB 4.08Å; W2053-P2064 HydrophobicContact CH2-CB 4.33Å; W2053-P2064 HydrophobicContact CZ3-CB 3.69Å; W2053-P2064 HydrophobicContact CZ3-CG 4.24Å; W2053-H2069 HydrophobicContact CH2-CB 4.11Å; W2053-H2069 AromaticContact CH2-CD2 3.5Å; W2053-H2069 WeakPolarHBondContact CH2-CD2 3.29Å; W2053-H2069 AromaticContact CH2-CG 3.94Å; W2053-H2069 HydrophobicContact CZ2-CB 4.43Å; W2053-H2069 AromaticContact CZ2-CD2 3.75Å
2054	I	92.2	Very high	89.4	Confident	8.2 Å²	8.2	30.3 Å²	30.3	4%	0.042	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	122.3	166.4	-172.8	176.6	0	0	0	109.3	W1657 D2043 L2044 F2045 R2056 Y2063 V2065	W1657-I2054 HydrophobicContact CH2-CD1 4.29Å; D2043-I2054 HydrophobicContact CB-CD1 3.83Å; D2043-I2054 HydrophobicContact CB-CG1 3.94Å; L2044-I2054 CarbonylContact O-C 3.55Å; L2044-I2054 WeakPolarHBondContact O-CA 3.36Å; F2045-I2054 HydrophobicContact CD1-CB 4.2Å; F2045-I2054 HydrophobicContact CD1-CD1 4.43Å; F2045-I2054 HydrophobicContact CD1-CG1 4.32Å; F2045-I2054 HydrophobicContact CD2-CG1 4.4Å; F2045-I2054 HydrophobicContact CE1-CB 4.12Å; F2045-I2054 HydrophobicContact CE1-CD1 3.76Å; F2045-I2054 HydrophobicContact CE1-CG1 4.05Å; F2045-I2054 HydrophobicContact CE2-CD1 3.9Å; F2045-I2054 HydrophobicContact CE2-CG1 4.22Å; F2045-I2054 HydrophobicContact CG-CG1 4.5Å; F2045-I2054 HydrophobicContact CZ-CB 4.46Å; F2045-I2054 HydrophobicContact CZ-CD1 3.43Å; F2045-I2054 VanDerWaalsContact CZ-CD1 3.45Å; F2045-I2054 HydrophobicContact CZ-CG1 4.02Å; I2054-R2056 VanDerWaalsContact CD1-NH1 3.27Å; I2054-Y2063 PolarHBondContact N-O 3.09Å; I2054-Y2063 PolarHBondContact O-N 3.14Å; I2054-V2065 HydrophobicContact CB-CG2 3.77Å; I2054-V2065 HydrophobicContact CG2-CG2 3.69Å
2055	R	92.8	Very high	88.9	Confident	8 Å²	8	30.7 Å²	30.7	3%	0.03	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	112.9	166.8	-179	-169.8	114.4	178.5	2.3	108	E1981 Y1985 A2005 A2025 D2043 L2044 N2060 R2061 L2062	E1981-R2055 IonicContact OE1-NH2 3.28Å; Y1985-R2055 VanDerWaalsContact CZ-NH1 3.28Å; Y1985-R2055 PolarHBondContact OH-NH1 2.96Å; Y1985-R2055 PolarHBondContact OH-NH2 2.78Å; A2005-R2055 WeakPolarHBondContact O-CD 3.31Å; A2005-R2055 PolarHBondContact O-NH1 3.48Å; A2025-R2055 HydrophobicContact CB-CB 4.4Å; A2025-R2055 HydrophobicContact CB-CG 3.9Å; D2043-R2055 WeakPolarHBondContact CA-O 3.35Å; L2044-R2055 HydrophobicContact CB-CB 4.24Å; L2044-R2055 PolarHBondContact N-O 3.12Å; L2044-R2055 PolarHBondContact O-N 3.15Å; R2055-N2060 VanDerWaalsContact CZ-OD1 3.28Å; R2055-N2060 PolarHBondContact NE-OD1 3.42Å; R2055-N2060 PolarHBondContact NH1-OD1 3.27Å; R2055-N2060 PolarHBondContact NH2-OD1 3.07Å; R2055-R2061 VanDerWaalsContact CA-O 3.29Å; R2055-R2061 WeakPolarHBondContact CA-O 3.42Å; R2055-L2062 HydrophobicContact CB-CD1 4.03Å
2056	R	88.7	Confident	88	Confident	86.4 Å²	86.4	30.4 Å²	30.4	33%	0.326	15%	0.149	S	C	.	.			trans	-74.5	140.1	179.6	-64.7	-106.7	-175.1	-178.2	1	111.2	D2043 I2054 N2058 D2059 N2060 R2061 Y2063	D2043-R2056 VanDerWaalsContact OD1-CA 3.29Å; D2043-R2056 WeakPolarHBondContact OD1-CA 3.38Å; D2043-R2056 WeakPolarHBondContact OD2-CD 3.31Å; D2043-R2056 IonicContact OD2-CZ 3.26Å; D2043-R2056 IonicContact OD2-NE 2.77Å; D2043-R2056 IonicContact OD2-NH1 3.33Å; D2043-R2056 PolarHBondContact OD2-NH1 3.02Å; I2054-R2056 VanDerWaalsContact CD1-NH1 3.27Å; R2056-N2058 VanDerWaalsContact C-N 3.32Å; R2056-N2058 VanDerWaalsContact CB-OD1 3.29Å; R2056-N2058 WeakPolarHBondContact CB-OD1 3.31Å; R2056-N2058 PolarHBondContact O-N 2.95Å; R2056-D2059 WeakPolarHBondContact CB-OD1 3.37Å; R2056-N2060 WeakPolarHBondContact O-CA 3.38Å; R2056-N2060 PolarHBondContact O-N 2.96Å; R2056-R2061 PolarHBondContact N-O 3.04Å; R2056-R2061 VanDerWaalsContact N-O 3.16Å; R2056-Y2063 HydrophobicContact CB-CE2 4.35Å; R2056-Y2063 HydrophobicContact CG-CD2 3.78Å; R2056-Y2063 HydrophobicContact CG-CE2 3.84Å
2057	S	85.6	Confident	86.3	Confident	11 Å²	11	31.8 Å²	31.8	8%	0.077	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-32.1	-177	107	0	0	0	0	113	R1610 Q2041 D2043 D2059	R1610-S2057 WeakPolarHBondContact CD-O 3.36Å; Q2041-S2057 PolarHBondContact O-OG 3.1Å; Q2041-S2057 VanDerWaalsContact O-OG 3.09Å; D2043-S2057 PolarHBondContact OD1-N 3.01Å; S2057-D2059 PolarHBondContact O-N 3.3Å
2058	N	81.4	Confident	84.3	Confident	63.4 Å²	63.4	37.1 Å²	37.1	34%	0.339	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-35.7	-174.8	63.5	-19.9	0	0	0	114.3	I1477 V1611 V1612 R2056	I1477-N2058 HydrophobicContact CB-CB 4.41Å; I1477-N2058 PolarHBondContact N-O 3.19Å; V1611-N2058 WeakPolarHBondContact O-CB 3.43Å; V1612-N2058 HydrophobicContact CB-CB 4.33Å; V1612-N2058 HydrophobicContact CG2-CB 4.45Å; R2056-N2058 VanDerWaalsContact C-N 3.32Å; R2056-N2058 VanDerWaalsContact CB-OD1 3.29Å; R2056-N2058 WeakPolarHBondContact CB-OD1 3.31Å; R2056-N2058 PolarHBondContact O-N 2.95Å
2059	D	81.2	Confident	82.2	Confident	36.2 Å²	36.2	39.5 Å²	39.5	19%	0.194	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124.3	-7.5	-173.3	67.9	9.3	0	0	0	114.6	R2056 S2057 R2061 Y2063	R2056-D2059 WeakPolarHBondContact CB-OD1 3.37Å; S2057-D2059 PolarHBondContact O-N 3.3Å; D2059-R2061 HydrophobicContact CB-CG 4.38Å; D2059-R2061 PolarHBondContact O-N 3.26Å; D2059-R2061 VanDerWaalsContact O-N 3.14Å; D2059-R2061 WeakPolarHBondContact OD1-CB 3.35Å; D2059-R2061 PolarHBondContact OD1-N 3.18Å; D2059-Y2063 PolarHBondContact OD2-OH 3.12Å; D2059-Y2063 VanDerWaalsContact OD2-OH 3.08Å
2060	N	86.3	Confident	79.9	Confident	46.4 Å²	46.4	42.7 Å²	42.7	25%	0.248	22%	0.222	C	C	.	.			trans	57	21.9	-176.3	-57	-60.4	0	0	0	114.4	A2025 R2055 R2056	A2025-N2060 WeakPolarHBondContact CB-O 3.3Å; A2025-N2060 PolarHBondContact N-O 2.92Å; A2025-N2060 VanDerWaalsContact N-O 3.1Å; R2055-N2060 VanDerWaalsContact CZ-OD1 3.28Å; R2055-N2060 PolarHBondContact NE-OD1 3.42Å; R2055-N2060 PolarHBondContact NH1-OD1 3.27Å; R2055-N2060 PolarHBondContact NH2-OD1 3.07Å; R2056-N2060 WeakPolarHBondContact O-CA 3.38Å; R2056-N2060 PolarHBondContact O-N 2.96Å
2061	R	86.4	Confident	77.6	Confident	46.4 Å²	46.4	41.9 Å²	41.9	18%	0.175	23%	0.227	C	C	.	.	B	Isolated β-bridge	trans	-91.8	154.2	176.9	-69.1	172.9	172.2	-105.1	5.5	111	D2017 D2018 S2020 A2022 P2023 L2024 R2055 R2056 D2059 Y2063	D2017-R2061 IonicContact OD2-NH2 2.79Å; D2018-R2061 VanDerWaalsContact CG-NH2 3.32Å; D2018-R2061 IonicContact OD1-NH2 3.29Å; D2018-R2061 IonicContact OD2-CZ 3.27Å; D2018-R2061 IonicContact OD2-NE 3.01Å; D2018-R2061 IonicContact OD2-NH2 3.36Å; D2018-R2061 PolarHBondContact OD2-NH2 3.19Å; S2020-R2061 VanDerWaalsContact CB-CZ 3.47Å; S2020-R2061 VanDerWaalsContact OG-CZ 3.26Å; S2020-R2061 PolarHBondContact OG-NE 3.1Å; S2020-R2061 PolarHBondContact OG-NH1 2.92Å; S2020-R2061 PolarHBondContact OG-NH2 2.85Å; A2022-R2061 HydrophobicContact CB-CB 4.31Å; A2022-R2061 VanDerWaalsContact O-CD 3.24Å; A2022-R2061 WeakPolarHBondContact O-CD 3.32Å; A2022-R2061 VanDerWaalsContact O-CG 3.3Å; A2022-R2061 WeakPolarHBondContact O-CG 3.31Å; A2022-R2061 PolarHBondContact O-NE 3.39Å; A2022-R2061 PolarHBondContact O-NH1 2.86Å; P2023-R2061 WeakPolarHBondContact O-CA 3.24Å; P2023-R2061 WeakPolarHBondContact O-CB 3.43Å; L2024-R2061 HydrophobicContact CD2-CG 4.41Å; R2055-R2061 VanDerWaalsContact CA-O 3.29Å; R2055-R2061 WeakPolarHBondContact CA-O 3.42Å; R2056-R2061 PolarHBondContact N-O 3.04Å; R2056-R2061 VanDerWaalsContact N-O 3.16Å; D2059-R2061 HydrophobicContact CB-CG 4.38Å; D2059-R2061 PolarHBondContact O-N 3.26Å; D2059-R2061 VanDerWaalsContact O-N 3.14Å; D2059-R2061 WeakPolarHBondContact OD1-CB 3.35Å; D2059-R2061 PolarHBondContact OD1-N 3.18Å; R2061-Y2063 HydrophobicContact CB-CD2 4.49Å; R2061-Y2063 HydrophobicContact CB-CE2 3.79Å
2062	L	87.2	Confident	75.3	Confident	1.4 Å²	1.4	46.1 Å²	46.1	1%	0.007	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	117.9	-174.6	-161.1	75.6	0	0	0	110.7	A2022 P2023 A2025 V2028 L2030 I2046 W2053 R2055	A2022-L2062 WeakPolarHBondContact CB-O 3.4Å; P2023-L2062 PolarHBondContact O-N 3.08Å; A2025-L2062 HydrophobicContact CB-CB 4.01Å; A2025-L2062 HydrophobicContact CB-CD1 4.07Å; V2028-L2062 HydrophobicContact CB-CD2 3.82Å; V2028-L2062 HydrophobicContact CG1-CD2 3.81Å; V2028-L2062 HydrophobicContact CG2-CB 4.32Å; V2028-L2062 HydrophobicContact CG2-CD2 3.86Å; L2030-L2062 HydrophobicContact CD2-CD2 3.9Å; I2046-L2062 HydrophobicContact CD1-CD1 4.22Å; W2053-L2062 HydrophobicContact CB-CD1 3.64Å; W2053-L2062 HydrophobicContact CB-CD2 4.04Å; W2053-L2062 HydrophobicContact CB-CG 3.8Å; W2053-L2062 HydrophobicContact CD2-CD2 3.65Å; W2053-L2062 HydrophobicContact CD2-CG 4.03Å; W2053-L2062 HydrophobicContact CE3-CD2 3.73Å; W2053-L2062 HydrophobicContact CE3-CG 3.8Å; W2053-L2062 HydrophobicContact CG-CD1 4.31Å; W2053-L2062 HydrophobicContact CG-CD2 3.78Å; W2053-L2062 HydrophobicContact CG-CG 4.05Å; W2053-L2062 HydrophobicContact CZ3-CD2 4.29Å; R2055-L2062 HydrophobicContact CB-CD1 4.03Å
2063	Y	86	Confident	72.4	Confident	67.4 Å²	67.4	51.1 Å²	51.1	26%	0.264	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	138.7	179	-61.8	-96.2	0	0	0	110	A2022 W2053 I2054 R2056 D2059 R2061 V2065	A2022-Y2063 HydrophobicContact CB-CD1 3.62Å; A2022-Y2063 HydrophobicContact CB-CD2 4.35Å; A2022-Y2063 HydrophobicContact CB-CE1 3.38Å; A2022-Y2063 HydrophobicContact CB-CE2 4.14Å; A2022-Y2063 HydrophobicContact CB-CG 4.1Å; W2053-Y2063 CarbonylContact C-O 3.56Å; W2053-Y2063 WeakPolarHBondContact CA-O 3.41Å; I2054-Y2063 PolarHBondContact N-O 3.09Å; I2054-Y2063 PolarHBondContact O-N 3.14Å; R2056-Y2063 HydrophobicContact CB-CE2 4.35Å; R2056-Y2063 HydrophobicContact CG-CD2 3.78Å; R2056-Y2063 HydrophobicContact CG-CE2 3.84Å; D2059-Y2063 PolarHBondContact OD2-OH 3.12Å; D2059-Y2063 VanDerWaalsContact OD2-OH 3.08Å; R2061-Y2063 HydrophobicContact CB-CD2 4.49Å; R2061-Y2063 HydrophobicContact CB-CE2 3.79Å; Y2063-V2065 PolarHBondContact O-N 3.07Å
2064	P	84.6	Confident	69.7	Low	67.8 Å²	67.8	59.6 Å²	59.6	44%	0.44	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	132	171.8	28.9	-31.2	0	0	0	109.7	W2053	W2053-P2064 HydrophobicContact CE3-CB 4.08Å; W2053-P2064 HydrophobicContact CH2-CB 4.33Å; W2053-P2064 HydrophobicContact CZ3-CB 3.69Å; W2053-P2064 HydrophobicContact CZ3-CG 4.24Å
2065	V	84.6	Confident	66.9	Low	9.4 Å²	9.4	67.2 Å²	67.2	6%	0.057	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	-39.1	166.6	175.2	0	0	0	0	109.9	W1657 F2045 I2052 I2054 Y2063 V2100 N2101 L2119 I2132	W1657-V2065 HydrophobicContact CE3-CG1 3.62Å; W1657-V2065 HydrophobicContact CH2-CG2 4.4Å; W1657-V2065 HydrophobicContact CZ3-CB 4.28Å; W1657-V2065 HydrophobicContact CZ3-CG1 3.53Å; W1657-V2065 VanDerWaalsContact CZ3-CG1 3.48Å; W1657-V2065 HydrophobicContact CZ3-CG2 3.79Å; F2045-V2065 HydrophobicContact CD1-CG2 4.32Å; F2045-V2065 HydrophobicContact CE1-CG2 4.19Å; I2052-V2065 HydrophobicContact CB-CB 4.18Å; I2052-V2065 HydrophobicContact CG2-CB 4.23Å; I2052-V2065 HydrophobicContact CG2-CG2 4.35Å; I2052-V2065 WeakPolarHBondContact O-CB 3.31Å; I2052-V2065 PolarHBondContact O-N 3.03Å; I2054-V2065 HydrophobicContact CB-CG2 3.77Å; I2054-V2065 HydrophobicContact CG2-CG2 3.69Å; Y2063-V2065 PolarHBondContact O-N 3.07Å; V2065-V2100 HydrophobicContact CG1-CG1 4.14Å; V2065-V2100 HydrophobicContact CG1-CG2 4.34Å; V2065-V2100 VanDerWaalsContact O-CG1 3.27Å; V2065-V2100 WeakPolarHBondContact O-CG1 3.36Å; V2065-N2101 PolarHBondContact O-OD1 3.03Å; V2065-N2101 VanDerWaalsContact O-OD1 3.06Å; V2065-L2119 HydrophobicContact CG1-CD2 4.32Å; V2065-I2132 HydrophobicContact CG1-CD1 4.47Å
2066	T	78.7	Confident	64	Low	2.8 Å²	2.8	75 Å²	75	2%	0.017	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	152.6	180	-177.7	0	0	0	0	109.7	H2051 I2052 V2100 F2103 F2105	H2051-T2066 VanDerWaalsContact CA-O 3.27Å; H2051-T2066 WeakPolarHBondContact CA-O 3.41Å; H2051-T2066 WeakPolarHBondContact CB-O 3.31Å; I2052-T2066 HydrophobicContact CB-CG2 3.77Å; I2052-T2066 HydrophobicContact CD1-CG2 4.01Å; I2052-T2066 HydrophobicContact CG1-CG2 3.75Å; I2052-T2066 PolarHBondContact N-O 3.25Å; I2052-T2066 VanDerWaalsContact N-O 3.1Å; I2052-T2066 PolarHBondContact O-N 3.14Å; T2066-V2100 WeakPolarHBondContact CB-O 3.48Å; T2066-V2100 HydrophobicContact CG2-CG1 4.38Å; T2066-V2100 PolarHBondContact OG1-O 3.11Å; T2066-V2100 VanDerWaalsContact OG1-O 3.09Å; T2066-F2103 PolarHBondContact OG1-O 3.05Å; T2066-F2103 VanDerWaalsContact OG1-O 3.11Å; T2066-F2105 HydrophobicContact CG2-CD2 3.74Å; T2066-F2105 HydrophobicContact CG2-CE2 3.66Å
2067	G	60.7	Low	61.2	Low	31.4 Å²	31.4	80.4 Å²	80.4	32%	0.324	41%	0.407	S	S	.	.	S	Bend	trans	90.5	145.6	-178.5	0	0	0	0	0	113.4
2068	I	52.6	Low	58.5	Low	111 Å²	111	82.5 Å²	82.5	57%	0.569	43%	0.43	S	S	*	.			trans	-82.8	133.6	178.4	-59.8	167.6	0	0	0	108.6	Q2072 R2074	I2068-Q2072 HydrophobicContact CG2-CB 3.88Å; I2068-Q2072 VanDerWaalsContact CG2-CB 3.44Å; I2068-Q2072 WeakPolarHBondContact CG2-O 3.32Å; I2068-R2074 HydrophobicContact CD1-CG 3.97Å; I2068-R2074 VanDerWaalsContact CD1-NE 3.26Å
2069	H	47.2	Very low	56.1	Low	53.2 Å²	53.2	86.9 Å²	86.9	25%	0.246	45%	0.454	C	S	.	.			trans	-51.4	135.6	179	-162.1	-83	0	0	0	111.2	W2053 S2071 Q2072 F2308	W2053-H2069 HydrophobicContact CH2-CB 4.11Å; W2053-H2069 AromaticContact CH2-CD2 3.5Å; W2053-H2069 WeakPolarHBondContact CH2-CD2 3.29Å; W2053-H2069 AromaticContact CH2-CG 3.94Å; W2053-H2069 HydrophobicContact CZ2-CB 4.43Å; W2053-H2069 AromaticContact CZ2-CD2 3.75Å; H2069-S2071 VanDerWaalsContact CE1-CB 3.49Å; H2069-S2071 WeakPolarHBondContact CE1-CB 3.43Å; H2069-S2071 PolarHBondContact CE1-OG 2.91Å; H2069-S2071 WeakPolarHBondContact ND1-CB 3.41Å; H2069-S2071 PolarHBondContact ND1-N 3.46Å; H2069-S2071 VanDerWaalsContact ND1-N 3.14Å; H2069-S2071 PolarHBondContact ND1-OG 2.98Å; H2069-S2071 PolarHBondContact O-N 2.99Å; H2069-S2071 VanDerWaalsContact O-N 3.12Å; H2069-Q2072 HydrophobicContact CB-CG 4.38Å; H2069-Q2072 WeakPolarHBondContact O-CB 3.44Å; H2069-Q2072 PolarHBondContact O-N 3.24Å; H2069-F2308 HydrophobicContact CB-CE1 4.13Å; H2069-F2308 AromaticContact CD2-CZ 3.95Å; H2069-F2308 AromaticContact CE1-CE1 3.92Å; H2069-F2308 AromaticContact CE1-CE2 3.9Å; H2069-F2308 AromaticContact CE1-CZ 3.36Å; H2069-F2308 WeakPolarHBondContact CE1-CZ 3.48Å; H2069-F2308 AromaticContact CG-CE1 3.76Å; H2069-F2308 AromaticContact CG-CZ 3.77Å; H2069-F2308 AromaticContact ND1-CE1 3.44Å; H2069-F2308 WeakPolarHBondContact ND1-CE1 3.34Å; H2069-F2308 AromaticContact ND1-CZ 3.39Å; H2069-F2308 WeakPolarHBondContact ND1-CZ 3.3Å; H2069-F2308 AromaticContact NE2-CZ 3.72Å
2070	P	41.2	Very low	53.8	Low	100.8 Å²	100.8	91 Å²	91	66%	0.655	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-19.8	-175.8	10.5	-18.3	0	0	0	114.7	Q2072	P2070-Q2072 VanDerWaalsContact C-N 3.25Å; P2070-Q2072 PolarHBondContact O-N 2.81Å
2071	S	41	Very low	51.2	Low	76.6 Å²	76.6	96 Å²	96	54%	0.536	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-2.7	178.2	66.6	0	0	0	0	115.4	H2069 P2073 F2308	H2069-S2071 VanDerWaalsContact CE1-CB 3.49Å; H2069-S2071 WeakPolarHBondContact CE1-CB 3.43Å; H2069-S2071 PolarHBondContact CE1-OG 2.91Å; H2069-S2071 WeakPolarHBondContact ND1-CB 3.41Å; H2069-S2071 PolarHBondContact ND1-N 3.46Å; H2069-S2071 VanDerWaalsContact ND1-N 3.14Å; H2069-S2071 PolarHBondContact ND1-OG 2.98Å; H2069-S2071 PolarHBondContact O-N 2.99Å; H2069-S2071 VanDerWaalsContact O-N 3.12Å; S2071-P2073 VanDerWaalsContact O-CD 3.26Å; S2071-P2073 WeakPolarHBondContact O-CD 3.36Å; S2071-F2308 WeakPolarHBondContact OG-CD1 3.04Å; S2071-F2308 WeakPolarHBondContact OG-CE1 3.43Å
2072	Q	39.1	Very low	48.6	Very low	123 Å²	123	100 Å²	100	58%	0.575	53%	0.532	S	S	*	.	S	Bend	trans	-97.2	107	170.3	-79.4	-175.4	0.6	0	0	109.5	I2068 H2069 P2070 R2074	I2068-Q2072 HydrophobicContact CG2-CB 3.88Å; I2068-Q2072 VanDerWaalsContact CG2-CB 3.44Å; I2068-Q2072 WeakPolarHBondContact CG2-O 3.32Å; H2069-Q2072 HydrophobicContact CB-CG 4.38Å; H2069-Q2072 WeakPolarHBondContact O-CB 3.44Å; H2069-Q2072 PolarHBondContact O-N 3.24Å; P2070-Q2072 VanDerWaalsContact C-N 3.25Å; P2070-Q2072 PolarHBondContact O-N 2.81Å; Q2072-R2074 PolarHBondContact O-N 3.05Å
2073	P	31.8	Very low	46.1	Very low	105.4 Å²	105.4	104.7 Å²	104.7	68%	0.684	57%	0.565	S	S	*	*			trans	-64.2	134	173.8	25.5	-30.4	0	0	0	109.1	S2071 Q2075	S2071-P2073 VanDerWaalsContact O-CD 3.26Å; S2071-P2073 WeakPolarHBondContact O-CD 3.36Å; P2073-Q2075 VanDerWaalsContact C-N 3.32Å; P2073-Q2075 PolarHBondContact O-N 3.19Å
2074	R	34.9	Very low	43.7	Very low	195.4 Å²	195.4	110.5 Å²	110.5	74%	0.737	59%	0.591	S	S	*	*			trans	-55	101.7	170	-72.5	-174.1	-176.4	-164.7	0.6	108.8	I2068 Q2072 F2076	I2068-R2074 HydrophobicContact CD1-CG 3.97Å; I2068-R2074 VanDerWaalsContact CD1-NE 3.26Å; Q2072-R2074 PolarHBondContact O-N 3.05Å; R2074-F2076 VanDerWaalsContact C-N 3.31Å; R2074-F2076 PolarHBondContact O-N 3.22Å
2075	Q	33.7	Very low	41.3	Very low	168.4 Å²	168.4	115 Å²	115	79%	0.787	60%	0.604	S	S	*	*			trans	-79.8	69.6	159.4	-81.7	-170.5	-1.7	0	0	108.6	P2073 K2077 P2410	P2073-Q2075 VanDerWaalsContact C-N 3.32Å; P2073-Q2075 PolarHBondContact O-N 3.19Å; Q2075-K2077 PolarHBondContact O-N 3.09Å; Q2075-P2410 PolarHBondContact NE2-O 2.95Å; Q2075-P2410 VanDerWaalsContact NE2-O 3.11Å
2076	F	31.9	Very low	38.9	Very low	170.8 Å²	170.8	124.6 Å²	124.6	75%	0.749	64%	0.639	S	S	*	*			trans	-102	85.9	160.1	-88	-84.3	0	0	0	107.5	R2074 G2078	R2074-F2076 VanDerWaalsContact C-N 3.31Å; R2074-F2076 PolarHBondContact O-N 3.22Å; F2076-G2078 PolarHBondContact O-N 2.85Å; F2076-G2078 VanDerWaalsContact O-N 3.12Å
2077	K	29.2	Very low	37.1	Very low	199.4 Å²	199.4	130.8 Å²	130.8	87%	0.867	67%	0.668	S	S	*	*			trans	-72.9	91.4	150.7	-83.7	-175.1	174.7	179.6	0	105.8	Q2075 D2079	Q2075-K2077 PolarHBondContact O-N 3.09Å; K2077-D2079 PolarHBondContact O-N 2.74Å
2078	G	29.5	Very low	36	Very low	55.2 Å²	55.2	133.8 Å²	133.8	57%	0.569	68%	0.684	S	S	*	*			trans	-87.6	117.3	171.1	0	0	0	0	0	109.1	F2076 V2080	F2076-G2078 PolarHBondContact O-N 2.85Å; F2076-G2078 VanDerWaalsContact O-N 3.12Å; G2078-V2080 VanDerWaalsContact C-N 3.35Å; G2078-V2080 PolarHBondContact O-N 2.99Å; G2078-V2080 VanDerWaalsContact O-N 3.16Å
2079	D	29.7	Very low	35.3	Very low	156.2 Å²	156.2	132.2 Å²	132.2	84%	0.835	68%	0.683	S	S	*	*			trans	-25.8	79.8	170.9	-68.1	-34	0	0	0	113.8	K2077 N2081	K2077-D2079 PolarHBondContact O-N 2.74Å; D2079-N2081 VanDerWaalsContact C-N 3.33Å; D2079-N2081 PolarHBondContact O-N 2.86Å; D2079-N2081 VanDerWaalsContact O-N 3.15Å
2080	V	33.9	Very low	34.9	Very low	122.4 Å²	122.4	135.1 Å²	135.1	74%	0.742	70%	0.704	S	S	*	*			trans	-80.1	96.1	156.5	-178.7	0	0	0	0	106.3	G2078 N2082	G2078-V2080 VanDerWaalsContact C-N 3.35Å; G2078-V2080 PolarHBondContact O-N 2.99Å; G2078-V2080 VanDerWaalsContact O-N 3.16Å; V2080-N2082 HydrophobicContact CG1-CB 3.87Å; V2080-N2082 WeakPolarHBondContact CG1-ND2 3.37Å; V2080-N2082 PolarHBondContact O-N 3.09Å
2081	N	31.4	Very low	34.9	Very low	151 Å²	151	135.9 Å²	135.9	81%	0.807	70%	0.703	S	S	*	*			trans	-135.4	23.9	161.1	-86.2	-21.6	0	0	0	115.1	D2079 S2083	D2079-N2081 VanDerWaalsContact C-N 3.33Å; D2079-N2081 PolarHBondContact O-N 2.86Å; D2079-N2081 VanDerWaalsContact O-N 3.15Å; N2081-S2083 VanDerWaalsContact C-N 3.33Å; N2081-S2083 PolarHBondContact O-N 3.14Å; N2081-S2083 VanDerWaalsContact O-N 3.17Å; N2081-S2083 PolarHBondContact O-OG 3.19Å; N2081-S2083 VanDerWaalsContact O-OG 3.08Å
2082	N	32.5	Very low	35.1	Very low	131.4 Å²	131.4	139 Å²	139	70%	0.703	71%	0.709	S	S	*	*			trans	-94.3	52.1	164.8	-93.5	-13.1	0	0	0	110.9	V2080 K2084 K2085	V2080-N2082 HydrophobicContact CG1-CB 3.87Å; V2080-N2082 WeakPolarHBondContact CG1-ND2 3.37Å; V2080-N2082 PolarHBondContact O-N 3.09Å; N2082-K2084 PolarHBondContact O-N 3.1Å; N2082-K2084 VanDerWaalsContact O-N 3.1Å; N2082-K2085 PolarHBondContact O-N 3.29Å; N2082-K2085 WeakPolarHBondContact OD1-CD 3.48Å; N2082-K2085 WeakPolarHBondContact OD1-CG 3.43Å
2083	S	33.7	Very low	35.6	Very low	99.6 Å²	99.6	136.5 Å²	136.5	70%	0.697	71%	0.705	S	S	*	*			trans	-57.8	59.4	151.5	52.6	0	0	0	0	111.6	N2081 K2085 R2086	N2081-S2083 VanDerWaalsContact C-N 3.33Å; N2081-S2083 PolarHBondContact O-N 3.14Å; N2081-S2083 VanDerWaalsContact O-N 3.17Å; N2081-S2083 PolarHBondContact O-OG 3.19Å; N2081-S2083 VanDerWaalsContact O-OG 3.08Å; S2083-K2085 WeakPolarHBondContact O-CA 3.48Å; S2083-K2085 PolarHBondContact O-N 3.09Å; S2083-R2086 VanDerWaalsContact O-CG 3.31Å; S2083-R2086 WeakPolarHBondContact O-CG 3.43Å
2084	K	35.1	Very low	36.7	Very low	188.4 Å²	188.4	134.7 Å²	134.7	82%	0.819	69%	0.692	S	S	*	*			trans	-88.1	53.6	161.2	-74.9	-172.1	177.7	-176.7	0	109.2	N2082 R2086	N2082-K2084 PolarHBondContact O-N 3.1Å; N2082-K2084 VanDerWaalsContact O-N 3.1Å; K2084-R2086 VanDerWaalsContact C-N 3.28Å; K2084-R2086 PolarHBondContact O-N 2.92Å
2085	K	34.6	Very low	38	Very low	163.2 Å²	163.2	128.3 Å²	128.3	71%	0.71	67%	0.674	S	S	*	*			trans	-82.8	84	174.3	-80	-175.4	179.3	176.8	0	108.6	N2082 S2083 H2087	N2082-K2085 PolarHBondContact O-N 3.29Å; N2082-K2085 WeakPolarHBondContact OD1-CD 3.48Å; N2082-K2085 WeakPolarHBondContact OD1-CG 3.43Å; S2083-K2085 WeakPolarHBondContact O-CA 3.48Å; S2083-K2085 PolarHBondContact O-N 3.09Å; K2085-H2087 VanDerWaalsContact C-N 3.35Å; K2085-H2087 PolarHBondContact O-CD2 2.83Å; K2085-H2087 PolarHBondContact O-N 3.05Å
2086	R	35.4	Very low	39.6	Very low	211.6 Å²	211.6	123.2 Å²	123.2	80%	0.798	65%	0.652	S	S	*	*			trans	-43.8	106.6	153	-75.4	-177.4	176.5	-173.1	-1	105.8	E1667 S2083 K2084 S2088	E1667-R2086 IonicContact OE1-NH1 3.58Å; S2083-R2086 VanDerWaalsContact O-CG 3.31Å; S2083-R2086 WeakPolarHBondContact O-CG 3.43Å; K2084-R2086 VanDerWaalsContact C-N 3.28Å; K2084-R2086 PolarHBondContact O-N 2.92Å; R2086-S2088 WeakPolarHBondContact O-CB 3.25Å; R2086-S2088 PolarHBondContact O-N 3.19Å
2087	H	40.7	Very low	41.8	Very low	133 Å²	133	117.4 Å²	117.4	62%	0.616	63%	0.629	S	S	*	*			trans	-81	84.4	162.4	-82.7	-80.1	0	0	0	107.7	K2085 S2089 T2090	K2085-H2087 VanDerWaalsContact C-N 3.35Å; K2085-H2087 PolarHBondContact O-CD2 2.83Å; K2085-H2087 PolarHBondContact O-N 3.05Å; H2087-S2089 PolarHBondContact O-N 2.99Å; H2087-T2090 HydrophobicContact CB-CG2 3.82Å; H2087-T2090 WeakPolarHBondContact ND1-CG2 3.47Å
2088	S	36.5	Very low	44.1	Very low	93.6 Å²	93.6	109.1 Å²	109.1	66%	0.655	60%	0.6	S	S	*	*			trans	-86.2	66.6	166.6	136.7	0	0	0	0	108.2	R2086 T2090	R2086-S2088 WeakPolarHBondContact O-CB 3.25Å; R2086-S2088 PolarHBondContact O-N 3.19Å; S2088-T2090 VanDerWaalsContact C-N 3.26Å; S2088-T2090 PolarHBondContact O-N 3.01Å; S2088-T2090 VanDerWaalsContact O-N 3.13Å
2089	S	38.8	Very low	46.5	Very low	78.4 Å²	78.4	108.8 Å²	108.8	55%	0.548	59%	0.585	S	S	.	*			trans	-120.8	91	165.3	56.9	0	0	0	0	109	H2087 D2091	H2087-S2089 PolarHBondContact O-N 2.99Å; S2089-D2091 PolarHBondContact O-N 3.02Å
2090	T	39.2	Very low	49	Very low	114 Å²	114	101.8 Å²	101.8	70%	0.699	55%	0.548	S	S	*	.			trans	-48.5	42.8	162.1	45	0	0	0	0	113.1	H2087 S2088 E2092	H2087-T2090 HydrophobicContact CB-CG2 3.82Å; H2087-T2090 WeakPolarHBondContact ND1-CG2 3.47Å; S2088-T2090 VanDerWaalsContact C-N 3.26Å; S2088-T2090 PolarHBondContact O-N 3.01Å; S2088-T2090 VanDerWaalsContact O-N 3.13Å; T2090-E2092 PolarHBondContact O-N 3.19Å
2091	D	39.7	Very low	50.9	Low	116.6 Å²	116.6	100.9 Å²	100.9	62%	0.624	54%	0.539	S	S	*	.			trans	-91.3	100.6	164.4	-141.1	-16.1	0	0	0	108.5	S2089 S2093 V2094	S2089-D2091 PolarHBondContact O-N 3.02Å; D2091-S2093 PolarHBondContact O-N 3.09Å; D2091-S2093 WeakPolarHBondContact OD1-CB 3.31Å; D2091-S2093 PolarHBondContact OD1-OG 3.05Å; D2091-S2093 VanDerWaalsContact OD1-OG 3.12Å; D2091-S2093 PolarHBondContact OD2-OG 2.92Å; D2091-V2094 HydrophobicContact CB-CG2 4.19Å; D2091-V2094 WeakPolarHBondContact O-CG2 3.42Å; D2091-V2094 PolarHBondContact O-N 3.12Å
2092	E	46.2	Very low	53.1	Low	142.6 Å²	142.6	100.6 Å²	100.6	67%	0.666	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	1.7	-177.9	-67.6	-155.5	161.1	0	0	113.4	L1665 Q1687 T2090	L1665-E2092 WeakPolarHBondContact CD2-OE1 3.24Å; L1665-E2092 WeakPolarHBondContact CD2-OE2 3.07Å; Q1687-E2092 VanDerWaalsContact CD-CD 3.49Å; Q1687-E2092 HydrophobicContact CG-CB 4.37Å; Q1687-E2092 VanDerWaalsContact CG-CD 3.42Å; Q1687-E2092 WeakPolarHBondContact CG-OE2 3.44Å; Q1687-E2092 VanDerWaalsContact NE2-CD 3.34Å; Q1687-E2092 PolarHBondContact NE2-OE2 3.14Å; T2090-E2092 PolarHBondContact O-N 3.19Å
2093	S	49.9	Very low	55.4	Low	69.4 Å²	69.4	95.9 Å²	95.9	49%	0.485	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-13.4	179.6	63.7	0	0	0	0	113.7	R1686 D2091 V2095	R1686-S2093 PolarHBondContact NH1-O 3.08Å; D2091-S2093 PolarHBondContact O-N 3.09Å; D2091-S2093 WeakPolarHBondContact OD1-CB 3.31Å; D2091-S2093 PolarHBondContact OD1-OG 3.05Å; D2091-S2093 VanDerWaalsContact OD1-OG 3.12Å; D2091-S2093 PolarHBondContact OD2-OG 2.92Å; S2093-V2095 PolarHBondContact O-N 2.8Å; S2093-V2095 VanDerWaalsContact O-N 3.09Å
2094	V	53.7	Low	57.7	Low	68 Å²	68	94.7 Å²	94.7	41%	0.412	50%	0.498	S	S	.	.			trans	-83.6	108.4	-176.9	-177.2	0	0	0	0	110.4	D2091 D2096	D2091-V2094 HydrophobicContact CB-CG2 4.19Å; D2091-V2094 WeakPolarHBondContact O-CG2 3.42Å; D2091-V2094 PolarHBondContact O-N 3.12Å; V2094-D2096 WeakPolarHBondContact CG1-O 3.36Å; V2094-D2096 PolarHBondContact O-N 3.02Å
2095	V	63	Low	60.2	Low	60.4 Å²	60.4	85.8 Å²	85.8	37%	0.366	46%	0.459	S	S	.	.			trans	-79.3	-1.4	176.8	-176.5	0	0	0	0	110.3	S1660 A1661 R1686 R1764 S2093 L2097	S1660-V2095 WeakPolarHBondContact CA-O 3.36Å; S1660-V2095 WeakPolarHBondContact CB-O 3.32Å; A1661-V2095 PolarHBondContact N-O 3.17Å; A1661-V2095 VanDerWaalsContact N-O 3.15Å; R1686-V2095 VanDerWaalsContact CZ-CG2 3.41Å; R1686-V2095 VanDerWaalsContact NH1-CA 3.28Å; R1764-V2095 HydrophobicContact CB-CG1 4.08Å; R1764-V2095 HydrophobicContact CG-CG1 4.24Å; S2093-V2095 PolarHBondContact O-N 2.8Å; S2093-V2095 VanDerWaalsContact O-N 3.09Å; V2095-L2097 HydrophobicContact CG1-CD2 3.92Å; V2095-L2097 HydrophobicContact CG1-CG 4.27Å; V2095-L2097 PolarHBondContact O-N 3.35Å
2096	D	67.9	Low	62.6	Low	61 Å²	61	81.9 Å²	81.9	33%	0.326	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	123.7	179.3	-174.3	2.6	0	0	0	109.4	H1658 I1659 V2094 G2098 Q2135	H1658-D2096 IonicContact CE1-OD2 3.46Å; H1658-D2096 IonicContact CG-OD2 3.34Å; H1658-D2096 IonicContact ND1-OD1 3.03Å; H1658-D2096 PolarHBondContact ND1-OD1 3.02Å; H1658-D2096 IonicContact ND1-OD2 3.47Å; H1658-D2096 PolarHBondContact ND1-OD2 3.29Å; I1659-D2096 VanDerWaalsContact O-OD1 3.09Å; V2094-D2096 WeakPolarHBondContact CG1-O 3.36Å; V2094-D2096 PolarHBondContact O-N 3.02Å; D2096-G2098 VanDerWaalsContact C-N 3.33Å; D2096-G2098 PolarHBondContact O-N 2.68Å; D2096-G2098 PolarHBondContact OD1-N 2.99Å; D2096-G2098 VanDerWaalsContact OD1-N 3.1Å; D2096-Q2135 PolarHBondContact OD2-OE1 3.46Å
2097	L	77.1	Confident	65.2	Low	50 Å²	50	73.7 Å²	73.7	26%	0.262	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	3.6	-177.2	-58.4	168.9	0	0	0	111.8	I1659 A1661 V2095 F2103 Y2130	I1659-L2097 HydrophobicContact CG2-CB 3.88Å; I1659-L2097 WeakPolarHBondContact O-CA 3.34Å; I1659-L2097 VanDerWaalsContact O-CB 3.32Å; I1659-L2097 WeakPolarHBondContact O-CB 3.41Å; I1659-L2097 PolarHBondContact O-N 2.83Å; A1661-L2097 HydrophobicContact CB-CD1 4.47Å; V2095-L2097 HydrophobicContact CG1-CD2 3.92Å; V2095-L2097 HydrophobicContact CG1-CG 4.27Å; V2095-L2097 PolarHBondContact O-N 3.35Å; L2097-F2103 HydrophobicContact CB-CD2 4.44Å; L2097-F2103 HydrophobicContact CD1-CD2 4.35Å; L2097-F2103 HydrophobicContact CD1-CE2 3.98Å; L2097-Y2130 HydrophobicContact CD1-CD1 3.74Å; L2097-Y2130 HydrophobicContact CD1-CE1 3.48Å; L2097-Y2130 VanDerWaalsContact CD1-CE1 3.44Å
2098	G	78	Confident	67.7	Low	25.2 Å²	25.2	67.4 Å²	67.4	26%	0.26	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	92.7	-154.8	178	0	0	0	0	0	112.9	H1658 I1659 D2096	H1658-G2098 CarbonylContact C-O 3.55Å; H1658-G2098 VanDerWaalsContact CA-O 3.29Å; H1658-G2098 WeakPolarHBondContact CA-O 3.28Å; I1659-G2098 PolarHBondContact N-O 3.15Å; D2096-G2098 VanDerWaalsContact C-N 3.33Å; D2096-G2098 PolarHBondContact O-N 2.68Å; D2096-G2098 PolarHBondContact OD1-N 2.99Å; D2096-G2098 VanDerWaalsContact OD1-N 3.1Å
2099	L	79.6	Confident	70.4	Confident	49.4 Å²	49.4	64.1 Å²	64.1	26%	0.259	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	134.5	-175.1	-65.9	175.1	0	0	0	111.8	D1656 N2101 E2102 F2103 T2341 D2342	D1656-L2099 HydrophobicContact CB-CD2 3.72Å; L2099-N2101 VanDerWaalsContact C-N 3.27Å; L2099-N2101 PolarHBondContact O-N 3.04Å; L2099-N2101 VanDerWaalsContact O-N 3.16Å; L2099-E2102 HydrophobicContact CB-CG 4.38Å; L2099-E2102 PolarHBondContact O-N 3.11Å; L2099-E2102 VanDerWaalsContact O-N 3.07Å; L2099-F2103 PolarHBondContact O-N 2.98Å; L2099-T2341 WeakPolarHBondContact CD1-O 3.45Å; L2099-D2342 HydrophobicContact CD1-CB 4.38Å; L2099-D2342 WeakPolarHBondContact CD1-OD1 3.46Å
2100	V	82.1	Confident	73	Confident	8.4 Å²	8.4	61.5 Å²	61.5	5%	0.051	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-29.2	-177.7	87.8	0	0	0	0	113.1	W1657 I1659 V2065 T2066 E2102 F2103 I2132	W1657-V2100 HydrophobicContact CB-CB 4.43Å; W1657-V2100 HydrophobicContact CB-CG1 3.8Å; W1657-V2100 WeakPolarHBondContact O-CB 3.15Å; W1657-V2100 WeakPolarHBondContact O-CG1 3.41Å; W1657-V2100 PolarHBondContact O-N 3.02Å; I1659-V2100 HydrophobicContact CB-CB 4.41Å; I1659-V2100 HydrophobicContact CB-CG2 4.33Å; V2065-V2100 HydrophobicContact CG1-CG1 4.14Å; V2065-V2100 HydrophobicContact CG1-CG2 4.34Å; V2065-V2100 VanDerWaalsContact O-CG1 3.27Å; V2065-V2100 WeakPolarHBondContact O-CG1 3.36Å; T2066-V2100 WeakPolarHBondContact CB-O 3.48Å; T2066-V2100 HydrophobicContact CG2-CG1 4.38Å; T2066-V2100 PolarHBondContact OG1-O 3.11Å; T2066-V2100 VanDerWaalsContact OG1-O 3.09Å; V2100-E2102 PolarHBondContact O-N 3.13Å; V2100-F2103 WeakPolarHBondContact O-CB 3.38Å; V2100-F2103 PolarHBondContact O-N 3.09Å; V2100-F2103 VanDerWaalsContact O-N 3.16Å; V2100-I2132 HydrophobicContact CB-CG2 4.34Å; V2100-I2132 HydrophobicContact CG1-CD1 3.94Å; V2100-I2132 HydrophobicContact CG1-CG2 4.44Å; V2100-I2132 HydrophobicContact CG2-CB 4.22Å; V2100-I2132 HydrophobicContact CG2-CD1 3.72Å; V2100-I2132 HydrophobicContact CG2-CG1 3.77Å; V2100-I2132 HydrophobicContact CG2-CG2 3.97Å
2101	N	75	Confident	75.7	Confident	103.2 Å²	103.2	56.5 Å²	56.5	55%	0.552	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-24.2	177.9	-73.9	-9.4	0	0	0	112.7	V2065 L2099	V2065-N2101 PolarHBondContact O-OD1 3.03Å; V2065-N2101 VanDerWaalsContact O-OD1 3.06Å; L2099-N2101 VanDerWaalsContact C-N 3.27Å; L2099-N2101 PolarHBondContact O-N 3.04Å; L2099-N2101 VanDerWaalsContact O-N 3.16Å
2102	E	76.2	Confident	78.4	Confident	145.8 Å²	145.8	52.1 Å²	52.1	68%	0.681	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-14.3	177.4	-57.7	-170.5	165.8	0	0	112.4	L2099 V2100	L2099-E2102 HydrophobicContact CB-CG 4.38Å; L2099-E2102 PolarHBondContact O-N 3.11Å; L2099-E2102 VanDerWaalsContact O-N 3.07Å; V2100-E2102 PolarHBondContact O-N 3.13Å
2103	F	81.2	Confident	80.6	Confident	31.6 Å²	31.6	45.9 Å²	45.9	14%	0.139	27%	0.269	C	S	.	.			trans	-81	133.9	179.5	-169.9	-92.1	0	0	0	111.5	I1659 T2066 L2097 L2099 V2100 F2105 Y2130	I1659-F2103 HydrophobicContact CD1-CB 4.26Å; I1659-F2103 HydrophobicContact CD1-CD1 3.42Å; I1659-F2103 VanDerWaalsContact CD1-CD1 3.44Å; I1659-F2103 HydrophobicContact CD1-CD2 4.03Å; I1659-F2103 HydrophobicContact CD1-CE1 3.66Å; I1659-F2103 HydrophobicContact CD1-CE2 4.24Å; I1659-F2103 HydrophobicContact CD1-CG 3.62Å; I1659-F2103 HydrophobicContact CD1-CZ 4.07Å; I1659-F2103 HydrophobicContact CG2-CB 3.92Å; I1659-F2103 HydrophobicContact CG2-CD2 3.97Å; I1659-F2103 HydrophobicContact CG2-CG 3.99Å; T2066-F2103 PolarHBondContact OG1-O 3.05Å; T2066-F2103 VanDerWaalsContact OG1-O 3.11Å; L2097-F2103 HydrophobicContact CB-CD2 4.44Å; L2097-F2103 HydrophobicContact CD1-CD2 4.35Å; L2097-F2103 HydrophobicContact CD1-CE2 3.98Å; L2099-F2103 PolarHBondContact O-N 2.98Å; V2100-F2103 WeakPolarHBondContact O-CB 3.38Å; V2100-F2103 PolarHBondContact O-N 3.09Å; V2100-F2103 VanDerWaalsContact O-N 3.16Å; F2103-F2105 HydrophobicContact CD1-CD1 4.17Å; F2103-F2105 AromaticContact CD1-CD2 3.88Å; F2103-F2105 HydrophobicContact CD1-CD2 3.91Å; F2103-F2105 AromaticContact CD1-CE1 3.88Å; F2103-F2105 HydrophobicContact CD1-CE1 3.98Å; F2103-F2105 AromaticContact CD1-CE2 3.7Å; F2103-F2105 HydrophobicContact CD1-CE2 3.7Å; F2103-F2105 HydrophobicContact CD1-CG 4.14Å; F2103-F2105 AromaticContact CD1-CZ 3.75Å; F2103-F2105 HydrophobicContact CD1-CZ 3.75Å; F2103-F2105 AromaticContact CE1-CD1 3.64Å; F2103-F2105 HydrophobicContact CE1-CD1 3.64Å; F2103-F2105 HydrophobicContact CE1-CD2 4.2Å; F2103-F2105 AromaticContact CE1-CE1 3.57Å; F2103-F2105 HydrophobicContact CE1-CE1 3.57Å; F2103-F2105 AromaticContact CE1-CE2 3.98Å; F2103-F2105 HydrophobicContact CE1-CE2 4.13Å; F2103-F2105 AromaticContact CE1-CG 3.94Å; F2103-F2105 HydrophobicContact CE1-CG 3.97Å; F2103-F2105 AromaticContact CE1-CZ 3.84Å; F2103-F2105 HydrophobicContact CE1-CZ 3.84Å; F2103-Y2130 HydrophobicContact CE1-CE1 4.21Å; F2103-Y2130 HydrophobicContact CE1-CE2 4.34Å; F2103-Y2130 HydrophobicContact CE2-CE1 4.21Å; F2103-Y2130 HydrophobicContact CZ-CD1 4.27Å; F2103-Y2130 AromaticContact CZ-CE1 3.74Å; F2103-Y2130 HydrophobicContact CZ-CE1 3.74Å; F2103-Y2130 HydrophobicContact CZ-CE2 4.12Å; F2103-Y2130 AromaticContact CZ-CZ 3.62Å; F2103-Y2130 VanDerWaalsContact CZ-CZ 3.47Å
2104	S	82.2	Confident	82.6	Confident	74.8 Å²	74.8	42.9 Å²	42.9	52%	0.523	25%	0.248	S	C	.	.			trans	-108	112.3	175.1	145.8	0	0	0	0	110.5	H2126	S2104-H2126 PolarHBondContact O-CE1 3.17Å
2105	F	87.5	Confident	84.1	Confident	1.6 Å²	1.6	42.7 Å²	42.7	1%	0.007	24%	0.244	C	C	.	.			trans	-71	152.9	163.6	-64	-82.1	0	0	0	110.3	I1659 Q2050 I2052 T2066 F2103 I2108 V2121 D2123 Y2130 I2132	I1659-F2105 HydrophobicContact CD1-CE1 4.02Å; I1659-F2105 HydrophobicContact CD1-CE2 4.23Å; I1659-F2105 HydrophobicContact CD1-CZ 3.45Å; I1659-F2105 VanDerWaalsContact CD1-CZ 3.45Å; Q2050-F2105 WeakPolarHBondContact CB-O 3.37Å; Q2050-F2105 WeakPolarHBondContact CG-O 3.42Å; I2052-F2105 HydrophobicContact CD1-CE2 4.33Å; T2066-F2105 HydrophobicContact CG2-CD2 3.74Å; T2066-F2105 HydrophobicContact CG2-CE2 3.66Å; F2103-F2105 HydrophobicContact CD1-CD1 4.17Å; F2103-F2105 AromaticContact CD1-CD2 3.88Å; F2103-F2105 HydrophobicContact CD1-CD2 3.91Å; F2103-F2105 AromaticContact CD1-CE1 3.88Å; F2103-F2105 HydrophobicContact CD1-CE1 3.98Å; F2103-F2105 AromaticContact CD1-CE2 3.7Å; F2103-F2105 HydrophobicContact CD1-CE2 3.7Å; F2103-F2105 HydrophobicContact CD1-CG 4.14Å; F2103-F2105 AromaticContact CD1-CZ 3.75Å; F2103-F2105 HydrophobicContact CD1-CZ 3.75Å; F2103-F2105 AromaticContact CE1-CD1 3.64Å; F2103-F2105 HydrophobicContact CE1-CD1 3.64Å; F2103-F2105 HydrophobicContact CE1-CD2 4.2Å; F2103-F2105 AromaticContact CE1-CE1 3.57Å; F2103-F2105 HydrophobicContact CE1-CE1 3.57Å; F2103-F2105 AromaticContact CE1-CE2 3.98Å; F2103-F2105 HydrophobicContact CE1-CE2 4.13Å; F2103-F2105 AromaticContact CE1-CG 3.94Å; F2103-F2105 HydrophobicContact CE1-CG 3.97Å; F2103-F2105 AromaticContact CE1-CZ 3.84Å; F2103-F2105 HydrophobicContact CE1-CZ 3.84Å; F2105-I2108 HydrophobicContact CB-CD1 3.77Å; F2105-I2108 HydrophobicContact CB-CG1 3.63Å; F2105-I2108 HydrophobicContact CD1-CD1 4.31Å; F2105-I2108 HydrophobicContact CD1-CG1 4.04Å; F2105-I2108 HydrophobicContact CD2-CD1 4.09Å; F2105-I2108 HydrophobicContact CG-CD1 3.78Å; F2105-I2108 HydrophobicContact CG-CG1 3.85Å; F2105-V2121 HydrophobicContact CD1-CG1 3.94Å; F2105-V2121 HydrophobicContact CE1-CB 3.94Å; F2105-V2121 HydrophobicContact CE1-CG1 3.56Å; F2105-V2121 HydrophobicContact CE1-CG2 4.47Å; F2105-V2121 HydrophobicContact CZ-CB 4.18Å; F2105-V2121 HydrophobicContact CZ-CG1 4.02Å; F2105-V2121 HydrophobicContact CZ-CG2 4.25Å; F2105-D2123 WeakPolarHBondContact CA-OD2 3.33Å; F2105-D2123 HydrophobicContact CD1-CB 4.31Å; F2105-Y2130 HydrophobicContact CD1-CD2 4.41Å; F2105-Y2130 AromaticContact CE1-CD2 3.75Å; F2105-Y2130 HydrophobicContact CE1-CD2 3.75Å; F2105-Y2130 HydrophobicContact CE1-CE2 4.33Å; F2105-Y2130 HydrophobicContact CE1-CG 4.21Å; F2105-I2132 HydrophobicContact CE2-CD1 4.38Å; F2105-I2132 HydrophobicContact CZ-CD1 4.09Å
2106	N	85.2	Confident	85	Confident	81.6 Å²	81.6	43 Å²	43	44%	0.436	24%	0.241	S	C	.	.	S	Bend	trans	-120.1	-36.9	-178.6	177.8	53.4	0	0	0	112.9	P2049 Q2050 D2123 S2125	P2049-N2106 CarbonylContact O-C 3.53Å; Q2050-N2106 WeakPolarHBondContact CG-O 3.33Å; Q2050-N2106 PolarHBondContact NE2-O 3.08Å; Q2050-N2106 PolarHBondContact NE2-OD1 2.8Å; N2106-D2123 PolarHBondContact N-OD2 3.02Å; N2106-S2125 VanDerWaalsContact CB-OG 3.24Å; N2106-S2125 WeakPolarHBondContact CB-OG 3.29Å; N2106-S2125 VanDerWaalsContact ND2-CB 3.31Å; N2106-S2125 WeakPolarHBondContact ND2-CB 3.35Å; N2106-S2125 PolarHBondContact ND2-OG 2.93Å
2107	S	90	Very high	85.8	Confident	39.4 Å²	39.4	41.2 Å²	41.2	28%	0.276	24%	0.237	S	C	.	.			trans	-149.6	83.2	170.7	-169.6	0	0	0	0	111.7	R2034 P2049 S2109 D2123 N2124 S2125	R2034-S2107 PolarHBondContact NH1-OG 2.65Å; P2049-S2107 WeakPolarHBondContact O-CA 3.38Å; S2107-S2109 PolarHBondContact O-N 2.96Å; S2107-D2123 PolarHBondContact N-OD1 3.1Å; S2107-D2123 VanDerWaalsContact N-OD1 3.11Å; S2107-D2123 PolarHBondContact N-OD2 3.11Å; S2107-D2123 CarbonylContact O-C 3.57Å; S2107-D2123 WeakPolarHBondContact O-CA 3.31Å; S2107-N2124 PolarHBondContact O-N 2.86Å; S2107-S2125 PolarHBondContact N-OG 3.35Å
2108	I	93.4	Very high	86.4	Confident	0.4 Å²	0.4	39.5 Å²	39.5	0%	0.002	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	126.8	174.9	-57.6	173.1	0	0	0	109.2	R2034 A2047 G2048 P2049 I2052 F2105 I2111 V2121 A2122	R2034-I2108 WeakPolarHBondContact CB-O 3.34Å; R2034-I2108 WeakPolarHBondContact CG-O 3.32Å; R2034-I2108 PolarHBondContact NH1-O 3.18Å; A2047-I2108 HydrophobicContact CB-CG2 4Å; G2048-I2108 WeakPolarHBondContact O-CB 3.42Å; P2049-I2108 PolarHBondContact O-N 3.01Å; I2052-I2108 HydrophobicContact CD1-CD1 3.99Å; I2052-I2108 HydrophobicContact CG1-CD1 3.7Å; F2105-I2108 HydrophobicContact CB-CD1 3.77Å; F2105-I2108 HydrophobicContact CB-CG1 3.63Å; F2105-I2108 HydrophobicContact CD1-CD1 4.31Å; F2105-I2108 HydrophobicContact CD1-CG1 4.04Å; F2105-I2108 HydrophobicContact CD2-CD1 4.09Å; F2105-I2108 HydrophobicContact CG-CD1 3.78Å; F2105-I2108 HydrophobicContact CG-CG1 3.85Å; I2108-I2111 HydrophobicContact CG2-CG2 4.05Å; I2108-V2121 HydrophobicContact CB-CG1 4.47Å; I2108-V2121 HydrophobicContact CD1-CG1 4.15Å; I2108-V2121 HydrophobicContact CG1-CG1 3.98Å; I2108-V2121 HydrophobicContact CG2-CG1 3.81Å; I2108-A2122 WeakPolarHBondContact CA-O 3.34Å
2109	S	92.1	Very high	87.1	Confident	23.8 Å²	23.8	38.4 Å²	38.4	17%	0.166	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	-33.9	178.3	51.1	0	0	0	0	113	P1693 S2107 A2122 N2124	P1693-S2109 WeakPolarHBondContact O-CB 3.42Å; P1693-S2109 PolarHBondContact O-OG 3.19Å; S2107-S2109 PolarHBondContact O-N 2.96Å; S2109-A2122 PolarHBondContact N-O 3.2Å; S2109-A2122 VanDerWaalsContact OG-CB 3.28Å; S2109-A2122 WeakPolarHBondContact OG-CB 3.18Å; S2109-A2122 PolarHBondContact OG-O 2.96Å; S2109-N2124 VanDerWaalsContact CB-CG 3.41Å; S2109-N2124 WeakPolarHBondContact CB-ND2 3.35Å; S2109-N2124 WeakPolarHBondContact CB-OD1 3.34Å; S2109-N2124 PolarHBondContact OG-OD1 3.26Å
2110	S	93.8	Very high	87.9	Confident	25.2 Å²	25.2	36.7 Å²	36.7	18%	0.176	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	155.3	-179.2	-172.6	0	0	0	0	111.6	Y1694 C1695 L1696 A2122	Y1694-S2110 WeakPolarHBondContact O-CB 3.26Å; C1695-S2110 WeakPolarHBondContact CA-OG 3.36Å; L1696-S2110 PolarHBondContact N-OG 3.02Å; L1696-S2110 VanDerWaalsContact N-OG 3.13Å; S2110-A2122 PolarHBondContact O-N 2.9Å
2111	I	95.9	Very high	88.5	Confident	7.4 Å²	7.4	36.3 Å²	36.3	4%	0.038	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	151.1	174.4	57.5	160.1	0	0	0	111	F2045 A2047 I2052 I2108 L2119 F2120 V2121	F2045-I2111 HydrophobicContact CB-CD1 3.84Å; A2047-I2111 HydrophobicContact CB-CB 4.44Å; A2047-I2111 HydrophobicContact CB-CD1 3.82Å; A2047-I2111 HydrophobicContact CB-CG1 3.97Å; A2047-I2111 HydrophobicContact CB-CG2 3.7Å; I2052-I2111 HydrophobicContact CD1-CG2 4.31Å; I2108-I2111 HydrophobicContact CG2-CG2 4.05Å; I2111-L2119 HydrophobicContact CB-CD1 4.08Å; I2111-L2119 HydrophobicContact CD1-CD1 4.44Å; I2111-L2119 HydrophobicContact CG2-CD1 4.47Å; I2111-F2120 CarbonylContact C-O 3.29Å; I2111-F2120 VanDerWaalsContact CA-O 3.25Å; I2111-F2120 WeakPolarHBondContact CA-O 3.34Å; I2111-V2121 HydrophobicContact CG2-CB 4.38Å; I2111-V2121 HydrophobicContact CG2-CG1 4.09Å; I2111-V2121 HydrophobicContact CG2-CG2 4.09Å
2112	T	95.6	Very high	89.4	Confident	24.6 Å²	24.6	31.6 Å²	31.6	15%	0.151	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	148.9	170.3	-168.2	0	0	0	0	110.8	L1696 T1698 L1704 S2037 F2120	L1696-T2112 HydrophobicContact CB-CG2 3.59Å; T1698-T2112 HydrophobicContact CG2-CG2 3.94Å; L1704-T2112 HydrophobicContact CD1-CG2 4.12Å; S2037-T2112 WeakPolarHBondContact OG-CA 3.43Å; T2112-F2120 HydrophobicContact CG2-CB 3.9Å; T2112-F2120 HydrophobicContact CG2-CD2 4.29Å; T2112-F2120 HydrophobicContact CG2-CG 4.48Å; T2112-F2120 PolarHBondContact N-O 3.05Å; T2112-F2120 PolarHBondContact O-N 3.17Å
2113	V	94.1	Very high	90.1	Very high	12.2 Å²	12.2	24.7 Å²	24.7	7%	0.074	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	134.1	178.8	178.4	0	0	0	0	109.4	T1698 S2037 F2045 E2118 L2119	T1698-V2113 PolarHBondContact OG1-O 2.95Å; T1698-V2113 VanDerWaalsContact OG1-O 3.13Å; S2037-V2113 PolarHBondContact OG-N 2.89Å; F2045-V2113 HydrophobicContact CB-CG2 4.48Å; F2045-V2113 HydrophobicContact CD2-CG2 3.53Å; F2045-V2113 VanDerWaalsContact CD2-CG2 3.5Å; F2045-V2113 HydrophobicContact CE2-CG2 3.74Å; F2045-V2113 HydrophobicContact CG-CG2 4.05Å; F2045-V2113 HydrophobicContact CZ-CG2 4.34Å; V2113-E2118 CarbonylContact C-O 3.52Å; V2113-E2118 VanDerWaalsContact CA-O 3.3Å; V2113-E2118 WeakPolarHBondContact CA-O 3.3Å; V2113-L2119 HydrophobicContact CG2-CB 4.47Å; V2113-L2119 HydrophobicContact CG2-CD1 3.76Å
2114	S	90.1	Very high	90.5	Very high	6.4 Å²	6.4	25.1 Å²	25.1	5%	0.045	15%	0.15	C	C	.	.			trans	-80.5	164.2	175.2	81	0	0	0	0	112.2	T1698 F2116 G2117 E2118	T1698-S2114 WeakPolarHBondContact OG1-CA 3.17Å; S2114-F2116 PolarHBondContact O-N 3.19Å; S2114-F2116 VanDerWaalsContact O-N 3.12Å; S2114-F2116 PolarHBondContact OG-N 3.24Å; S2114-G2117 PolarHBondContact O-N 3.09Å; S2114-E2118 PolarHBondContact N-O 3.03Å; S2114-E2118 WeakPolarHBondContact OG-CB 3.29Å; S2114-E2118 PolarHBondContact OG-N 2.92Å; S2114-E2118 PolarHBondContact OG-OE2 3.02Å; S2114-E2118 VanDerWaalsContact OG-OE2 3.04Å
2115	L	85.5	Confident	90.6	Very high	64.4 Å²	64.4	23.4 Å²	23.4	34%	0.337	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-16.1	172.8	83.1	101	0	0	0	113.7	V1387 S1700 A1701 P2040	V1387-L2115 HydrophobicContact CB-CD1 4.39Å; V1387-L2115 HydrophobicContact CG1-CD1 3.49Å; V1387-L2115 VanDerWaalsContact CG1-CD1 3.49Å; V1387-L2115 HydrophobicContact CG2-CD1 4.05Å; S1700-L2115 WeakPolarHBondContact O-CD2 3.42Å; A1701-L2115 VanDerWaalsContact C-CD2 3.46Å; P2040-L2115 HydrophobicContact CB-CD1 4.41Å; P2040-L2115 HydrophobicContact CG-CB 4.49Å; P2040-L2115 HydrophobicContact CG-CD1 4.07Å; P2040-L2115 WeakPolarHBondContact CG-O 3.46Å
2116	F	82.6	Confident	90.6	Very high	66.4 Å²	66.4	25.6 Å²	25.6	29%	0.291	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93	0.8	177.1	-55.5	-73.5	0	0	0	113.3	R1314 R1315 L1758 R1763 S2114 E2118	R1314-F2116 HydrophobicContact CB-CE1 3.99Å; R1314-F2116 HydrophobicContact CB-CZ 4.43Å; R1315-F2116 HydrophobicContact CG-CE1 4.29Å; R1315-F2116 HydrophobicContact CG-CZ 3.9Å; L1758-F2116 HydrophobicContact CD2-CE1 3.17Å; L1758-F2116 HydrophobicContact CD2-CZ 3.25Å; R1763-F2116 VanDerWaalsContact CZ-CD2 3.47Å; R1763-F2116 VanDerWaalsContact CZ-CE2 3.47Å; R1763-F2116 VanDerWaalsContact NH1-CE2 3.33Å; R1763-F2116 VanDerWaalsContact NH2-CD2 3.34Å; S2114-F2116 PolarHBondContact O-N 3.19Å; S2114-F2116 VanDerWaalsContact O-N 3.12Å; S2114-F2116 PolarHBondContact OG-N 3.24Å; F2116-E2118 HydrophobicContact CB-CG 4.32Å
2117	G	84.6	Confident	90.7	Very high	23.4 Å²	23.4	23.2 Å²	23.2	24%	0.241	14%	0.136	C	C	.	.	S	Bend	trans	81	18.2	-178.2	0	0	0	0	0	114.2	S2114	S2114-G2117 PolarHBondContact O-N 3.09Å
2118	E	89	Confident	90.6	Very high	13.6 Å²	13.6	24.1 Å²	24.1	6%	0.064	13%	0.133	C	C	.	.	P	Polyproline II helix	trans	-87.3	136.4	175	-53.9	165	120	0	0	109.7	R1763 V2113 S2114 F2116 F2120 R2131 I2132 H2133	R1763-E2118 WeakPolarHBondContact CD-OE1 3.44Å; R1763-E2118 IonicContact CZ-OE2 3.12Å; R1763-E2118 IonicContact NE-OE1 3.62Å; R1763-E2118 IonicContact NE-OE2 2.87Å; R1763-E2118 PolarHBondContact NE-OE2 3.35Å; R1763-E2118 IonicContact NH1-OE2 3.14Å; R1763-E2118 PolarHBondContact NH1-OE2 3Å; R1763-E2118 IonicContact NH2-OE2 3.23Å; R1763-E2118 PolarHBondContact NH2-OE2 3.33Å; V2113-E2118 CarbonylContact C-O 3.52Å; V2113-E2118 VanDerWaalsContact CA-O 3.3Å; V2113-E2118 WeakPolarHBondContact CA-O 3.3Å; S2114-E2118 PolarHBondContact N-O 3.03Å; S2114-E2118 WeakPolarHBondContact OG-CB 3.29Å; S2114-E2118 PolarHBondContact OG-N 2.92Å; S2114-E2118 PolarHBondContact OG-OE2 3.02Å; S2114-E2118 VanDerWaalsContact OG-OE2 3.04Å; F2116-E2118 HydrophobicContact CB-CG 4.32Å; E2118-F2120 HydrophobicContact CB-CE2 4.17Å; E2118-F2120 HydrophobicContact CB-CZ 4.49Å; E2118-R2131 IonicContact OE1-CZ 3.25Å; E2118-R2131 IonicContact OE1-NE 2.96Å; E2118-R2131 PolarHBondContact OE1-NE 3.1Å; E2118-R2131 IonicContact OE1-NH2 3.26Å; E2118-R2131 PolarHBondContact OE1-NH2 2.93Å; E2118-R2131 IonicContact OE2-NE 3.95Å; E2118-I2132 CarbonylContact C-O 3.48Å; E2118-I2132 WeakPolarHBondContact CA-O 3.27Å; E2118-H2133 HydrophobicContact CB-CB 4.45Å; E2118-H2133 HydrophobicContact CG-CB 4.25Å
2119	L	93.7	Very high	90.6	Very high	2.4 Å²	2.4	25.1 Å²	25.1	1%	0.013	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	119.8	-179.9	171.6	69.7	0	0	0	109.8	F2045 I2052 V2065 I2111 V2113 V2121 I2132	F2045-L2119 HydrophobicContact CB-CD1 4.46Å; F2045-L2119 HydrophobicContact CD1-CD1 4.18Å; F2045-L2119 HydrophobicContact CD1-CD2 3.78Å; F2045-L2119 HydrophobicContact CD1-CG 4.36Å; F2045-L2119 HydrophobicContact CE1-CB 4.28Å; F2045-L2119 HydrophobicContact CE1-CD1 4.36Å; F2045-L2119 HydrophobicContact CE1-CD2 3.94Å; F2045-L2119 HydrophobicContact CE1-CG 4.4Å; F2045-L2119 HydrophobicContact CG-CD1 4.36Å; F2045-L2119 HydrophobicContact CG-CD2 4.45Å; I2052-L2119 HydrophobicContact CD1-CD2 4.08Å; I2052-L2119 HydrophobicContact CG2-CD2 4.08Å; V2065-L2119 HydrophobicContact CG1-CD2 4.32Å; I2111-L2119 HydrophobicContact CB-CD1 4.08Å; I2111-L2119 HydrophobicContact CD1-CD1 4.44Å; I2111-L2119 HydrophobicContact CG2-CD1 4.47Å; V2113-L2119 HydrophobicContact CG2-CB 4.47Å; V2113-L2119 HydrophobicContact CG2-CD1 3.76Å; L2119-V2121 HydrophobicContact CD2-CG2 4.23Å; L2119-V2121 HydrophobicContact CG-CG2 3.99Å; L2119-I2132 HydrophobicContact CB-CB 4.15Å; L2119-I2132 HydrophobicContact CD2-CB 4.49Å; L2119-I2132 HydrophobicContact CD2-CD1 3.81Å; L2119-I2132 HydrophobicContact CG-CD1 4.32Å; L2119-I2132 PolarHBondContact N-O 3Å; L2119-I2132 WeakPolarHBondContact O-CB 3.44Å; L2119-I2132 PolarHBondContact O-N 3Å
2120	F	95.3	Very high	90.6	Very high	13.2 Å²	13.2	24.4 Å²	24.4	6%	0.058	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	136.3	172.4	-63.7	-90.1	0	0	0	110.4	V1662 L1696 T1698 L1704 W1766 I2111 T2112 E2118 V2129 Y2130 R2131	V1662-F2120 HydrophobicContact CG2-CD1 4.1Å; V1662-F2120 HydrophobicContact CG2-CE1 3.99Å; L1696-F2120 HydrophobicContact CD1-CB 4.03Å; T1698-F2120 HydrophobicContact CG2-CD2 4.03Å; T1698-F2120 HydrophobicContact CG2-CE2 4.08Å; L1704-F2120 HydrophobicContact CD1-CB 4.05Å; L1704-F2120 HydrophobicContact CD1-CD1 4.1Å; L1704-F2120 HydrophobicContact CD1-CD2 4.04Å; L1704-F2120 HydrophobicContact CD1-CE2 4.5Å; L1704-F2120 HydrophobicContact CD1-CG 3.79Å; L1704-F2120 HydrophobicContact CD2-CD1 3.7Å; L1704-F2120 HydrophobicContact CD2-CE1 3.94Å; L1704-F2120 HydrophobicContact CD2-CG 4.25Å; L1704-F2120 HydrophobicContact CG-CD1 4.46Å; W1766-F2120 AromaticContact CH2-CE1 3.93Å; W1766-F2120 HydrophobicContact CH2-CE1 4Å; W1766-F2120 HydrophobicContact CH2-CE2 4.42Å; W1766-F2120 AromaticContact CH2-CZ 3.49Å; W1766-F2120 HydrophobicContact CH2-CZ 3.49Å; W1766-F2120 VanDerWaalsContact CH2-CZ 3.47Å; W1766-F2120 AromaticContact CZ2-CE1 3.71Å; W1766-F2120 HydrophobicContact CZ2-CE1 3.71Å; W1766-F2120 AromaticContact CZ2-CZ 3.39Å; W1766-F2120 HydrophobicContact CZ2-CZ 3.39Å; W1766-F2120 VanDerWaalsContact CZ2-CZ 3.44Å; W1766-F2120 HydrophobicContact CZ3-CZ 4.44Å; I2111-F2120 CarbonylContact C-O 3.29Å; I2111-F2120 VanDerWaalsContact CA-O 3.25Å; I2111-F2120 WeakPolarHBondContact CA-O 3.34Å; T2112-F2120 HydrophobicContact CG2-CB 3.9Å; T2112-F2120 HydrophobicContact CG2-CD2 4.29Å; T2112-F2120 HydrophobicContact CG2-CG 4.48Å; T2112-F2120 PolarHBondContact N-O 3.05Å; T2112-F2120 PolarHBondContact O-N 3.17Å; E2118-F2120 HydrophobicContact CB-CE2 4.17Å; E2118-F2120 HydrophobicContact CB-CZ 4.49Å; F2120-V2129 HydrophobicContact CB-CG1 4.32Å; F2120-V2129 HydrophobicContact CD1-CG1 4.28Å; F2120-Y2130 CarbonylContact C-O 3.53Å; F2120-Y2130 VanDerWaalsContact CA-O 3.24Å; F2120-Y2130 WeakPolarHBondContact CA-O 3.28Å; F2120-R2131 HydrophobicContact CD1-CB 3.93Å; F2120-R2131 HydrophobicContact CD1-CG 4.34Å; F2120-R2131 HydrophobicContact CE1-CB 3.72Å; F2120-R2131 HydrophobicContact CE1-CG 3.8Å; F2120-R2131 HydrophobicContact CE2-CG 4.5Å; F2120-R2131 HydrophobicContact CZ-CB 4.46Å; F2120-R2131 HydrophobicContact CZ-CG 4.08Å
2121	V	95.1	Very high	90.5	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	121.4	-175.3	-173.1	0	0	0	0	109.5	I2052 F2105 I2108 I2111 L2119 V2129 Y2130 I2132	I2052-V2121 HydrophobicContact CD1-CB 4.44Å; I2052-V2121 HydrophobicContact CD1-CG1 4.06Å; I2052-V2121 HydrophobicContact CD1-CG2 3.54Å; I2052-V2121 VanDerWaalsContact CD1-CG2 3.46Å; F2105-V2121 HydrophobicContact CD1-CG1 3.94Å; F2105-V2121 HydrophobicContact CE1-CB 3.94Å; F2105-V2121 HydrophobicContact CE1-CG1 3.56Å; F2105-V2121 HydrophobicContact CE1-CG2 4.47Å; F2105-V2121 HydrophobicContact CZ-CB 4.18Å; F2105-V2121 HydrophobicContact CZ-CG1 4.02Å; F2105-V2121 HydrophobicContact CZ-CG2 4.25Å; I2108-V2121 HydrophobicContact CB-CG1 4.47Å; I2108-V2121 HydrophobicContact CD1-CG1 4.15Å; I2108-V2121 HydrophobicContact CG1-CG1 3.98Å; I2108-V2121 HydrophobicContact CG2-CG1 3.81Å; I2111-V2121 HydrophobicContact CG2-CB 4.38Å; I2111-V2121 HydrophobicContact CG2-CG1 4.09Å; I2111-V2121 HydrophobicContact CG2-CG2 4.09Å; L2119-V2121 HydrophobicContact CD2-CG2 4.23Å; L2119-V2121 HydrophobicContact CG-CG2 3.99Å; V2121-V2129 CarbonylContact O-C 3.51Å; V2121-V2129 WeakPolarHBondContact O-CA 3.31Å; V2121-Y2130 PolarHBondContact N-O 2.93Å; V2121-Y2130 PolarHBondContact O-N 2.95Å; V2121-I2132 HydrophobicContact CG2-CD1 3.63Å; V2121-I2132 HydrophobicContact CG2-CG1 4.39Å
2122	A	94.2	Very high	90.2	Very high	5 Å²	5	24.5 Å²	24.5	4%	0.041	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	123.8	171.5	0	0	0	0	0	109.4	P1693 L1696 I2108 S2109 S2110 V2129	P1693-A2122 HydrophobicContact CB-CB 3.95Å; P1693-A2122 HydrophobicContact CG-CB 4.25Å; L1696-A2122 HydrophobicContact CD1-CB 3.75Å; L1696-A2122 VanDerWaalsContact CD1-N 3.34Å; L1696-A2122 HydrophobicContact CD2-CB 4.28Å; L1696-A2122 HydrophobicContact CG-CB 3.95Å; I2108-A2122 WeakPolarHBondContact CA-O 3.34Å; S2109-A2122 PolarHBondContact N-O 3.2Å; S2109-A2122 VanDerWaalsContact OG-CB 3.28Å; S2109-A2122 WeakPolarHBondContact OG-CB 3.18Å; S2109-A2122 PolarHBondContact OG-O 2.96Å; S2110-A2122 PolarHBondContact O-N 2.9Å; A2122-V2129 HydrophobicContact CB-CG2 4.26Å
2123	D	91.5	Very high	89.8	Confident	0.4 Å²	0.4	24.6 Å²	24.6	0%	0.002	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	109.6	171.7	-170	-37	0	0	0	109.2	F2105 N2106 S2107 S2125 H2126 N2127 R2128 Y2130	F2105-D2123 WeakPolarHBondContact CA-OD2 3.33Å; F2105-D2123 HydrophobicContact CD1-CB 4.31Å; N2106-D2123 PolarHBondContact N-OD2 3.02Å; S2107-D2123 PolarHBondContact N-OD1 3.1Å; S2107-D2123 VanDerWaalsContact N-OD1 3.11Å; S2107-D2123 PolarHBondContact N-OD2 3.11Å; S2107-D2123 CarbonylContact O-C 3.57Å; S2107-D2123 WeakPolarHBondContact O-CA 3.31Å; D2123-S2125 VanDerWaalsContact C-N 3.28Å; D2123-S2125 PolarHBondContact O-N 3.19Å; D2123-S2125 WeakPolarHBondContact OD1-CA 3.41Å; D2123-S2125 WeakPolarHBondContact OD1-CB 3.41Å; D2123-S2125 PolarHBondContact OD1-N 3.09Å; D2123-S2125 PolarHBondContact OD1-OG 3.16Å; D2123-H2126 HydrophobicContact CB-CB 4.16Å; D2123-H2126 VanDerWaalsContact CG-ND1 3.27Å; D2123-H2126 CarbonylContact O-C 3.53Å; D2123-H2126 PolarHBondContact O-N 3.05Å; D2123-H2126 IonicContact OD1-CG 3Å; D2123-H2126 PolarHBondContact OD1-N 3.08Å; D2123-H2126 VanDerWaalsContact OD1-N 3.1Å; D2123-H2126 IonicContact OD1-ND1 3.27Å; D2123-H2126 IonicContact OD2-CE1 3.06Å; D2123-H2126 PolarHBondContact OD2-CE1 2.88Å; D2123-H2126 IonicContact OD2-CG 3.49Å; D2123-H2126 IonicContact OD2-ND1 3.14Å; D2123-H2126 PolarHBondContact OD2-ND1 3.16Å; D2123-N2127 WeakPolarHBondContact O-CA 3.05Å; D2123-N2127 PolarHBondContact O-N 2.95Å; D2123-N2127 VanDerWaalsContact O-N 3.09Å; D2123-R2128 PolarHBondContact N-O 3Å; D2123-R2128 PolarHBondContact O-N 3.16Å; D2123-R2128 VanDerWaalsContact O-N 3.17Å; D2123-Y2130 HydrophobicContact CB-CD2 4.33Å; D2123-Y2130 HydrophobicContact CB-CE2 3.88Å
2124	N	88.7	Confident	89.1	Confident	40.2 Å²	40.2	27.6 Å²	27.6	22%	0.215	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-27.3	-177.6	-140.4	15.6	0	0	0	112.4	R1669 N1692 S2107 S2109 N2127	R1669-N2124 PolarHBondContact NH1-OD1 3.14Å; R1669-N2124 PolarHBondContact NH2-O 3.02Å; R1669-N2124 PolarHBondContact NH2-OD1 3.19Å; N1692-N2124 VanDerWaalsContact OD1-CG 3.28Å; N1692-N2124 PolarHBondContact OD1-ND2 3.08Å; N1692-N2124 PolarHBondContact OD1-OD1 3.23Å; S2107-N2124 PolarHBondContact O-N 2.86Å; S2109-N2124 VanDerWaalsContact CB-CG 3.41Å; S2109-N2124 WeakPolarHBondContact CB-ND2 3.35Å; S2109-N2124 WeakPolarHBondContact CB-OD1 3.34Å; S2109-N2124 PolarHBondContact OG-OD1 3.26Å; N2124-N2127 PolarHBondContact O-N 3.22Å; N2124-N2127 PolarHBondContact O-OD1 3.05Å; N2124-N2127 VanDerWaalsContact O-OD1 3.06Å
2125	S	85.7	Confident	88.4	Confident	39.4 Å²	39.4	30.6 Å²	30.6	28%	0.276	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-34.4	179.1	73.1	0	0	0	0	111.9	N2106 S2107 D2123 N2127	N2106-S2125 VanDerWaalsContact CB-OG 3.24Å; N2106-S2125 WeakPolarHBondContact CB-OG 3.29Å; N2106-S2125 VanDerWaalsContact ND2-CB 3.31Å; N2106-S2125 WeakPolarHBondContact ND2-CB 3.35Å; N2106-S2125 PolarHBondContact ND2-OG 2.93Å; S2107-S2125 PolarHBondContact N-OG 3.35Å; D2123-S2125 VanDerWaalsContact C-N 3.28Å; D2123-S2125 PolarHBondContact O-N 3.19Å; D2123-S2125 WeakPolarHBondContact OD1-CA 3.41Å; D2123-S2125 WeakPolarHBondContact OD1-CB 3.41Å; D2123-S2125 PolarHBondContact OD1-N 3.09Å; D2123-S2125 PolarHBondContact OD1-OG 3.16Å; S2125-N2127 VanDerWaalsContact C-N 3.31Å
2126	H	85.5	Confident	88.1	Confident	47.2 Å²	47.2	30.2 Å²	30.2	22%	0.219	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86	-4.2	174.4	-64.1	127.3	0	0	0	113.1	T1666 S2104 D2123 R2128 Y2130	T1666-H2126 VanDerWaalsContact CA-O 3.23Å; T1666-H2126 WeakPolarHBondContact CA-O 3.33Å; T1666-H2126 HydrophobicContact CG2-CB 4.33Å; T1666-H2126 PolarHBondContact OG1-O 3.49Å; S2104-H2126 PolarHBondContact O-CE1 3.17Å; D2123-H2126 HydrophobicContact CB-CB 4.16Å; D2123-H2126 VanDerWaalsContact CG-ND1 3.27Å; D2123-H2126 CarbonylContact O-C 3.53Å; D2123-H2126 PolarHBondContact O-N 3.05Å; D2123-H2126 IonicContact OD1-CG 3Å; D2123-H2126 PolarHBondContact OD1-N 3.08Å; D2123-H2126 VanDerWaalsContact OD1-N 3.1Å; D2123-H2126 IonicContact OD1-ND1 3.27Å; D2123-H2126 IonicContact OD2-CE1 3.06Å; D2123-H2126 PolarHBondContact OD2-CE1 2.88Å; D2123-H2126 IonicContact OD2-CG 3.49Å; D2123-H2126 IonicContact OD2-ND1 3.14Å; D2123-H2126 PolarHBondContact OD2-ND1 3.16Å; H2126-R2128 VanDerWaalsContact C-N 3.25Å; H2126-R2128 HydrophobicContact CB-CB 4.28Å; H2126-R2128 WeakPolarHBondContact O-CB 3.45Å; H2126-R2128 VanDerWaalsContact O-CG 3.3Å; H2126-R2128 WeakPolarHBondContact O-CG 3.33Å; H2126-R2128 PolarHBondContact O-N 3.03Å; H2126-R2128 VanDerWaalsContact O-N 3.09Å; H2126-Y2130 HydrophobicContact CB-CE2 4.23Å; H2126-Y2130 VanDerWaalsContact CB-OH 3.29Å; H2126-Y2130 WeakPolarHBondContact CB-OH 3.34Å; H2126-Y2130 PolarHBondContact ND1-OH 2.87Å
2127	N	87.3	Confident	87.9	Confident	33.2 Å²	33.2	28.9 Å²	28.9	18%	0.178	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.6	39.2	-174.7	-58	-41.3	0	0	0	112.8	G1664 L1665 T1666 R1669 D2123 N2124 S2125	G1664-N2127 VanDerWaalsContact CA-O 3.25Å; G1664-N2127 WeakPolarHBondContact CA-O 3.32Å; L1665-N2127 PolarHBondContact N-O 3.17Å; L1665-N2127 VanDerWaalsContact O-CB 3.31Å; L1665-N2127 WeakPolarHBondContact O-CB 3.39Å; T1666-N2127 PolarHBondContact O-ND2 3.26Å; R1669-N2127 HydrophobicContact CG-CB 4.49Å; R1669-N2127 VanDerWaalsContact CG-ND2 3.31Å; R1669-N2127 WeakPolarHBondContact CG-ND2 3.29Å; R1669-N2127 WeakPolarHBondContact CG-OD1 3.37Å; R1669-N2127 PolarHBondContact NE-OD1 2.97Å; R1669-N2127 VanDerWaalsContact NE-OD1 3.14Å; R1669-N2127 PolarHBondContact NH1-OD1 3.16Å; R1669-N2127 PolarHBondContact NH2-OD1 3.24Å; D2123-N2127 WeakPolarHBondContact O-CA 3.05Å; D2123-N2127 PolarHBondContact O-N 2.95Å; D2123-N2127 VanDerWaalsContact O-N 3.09Å; N2124-N2127 PolarHBondContact O-N 3.22Å; N2124-N2127 PolarHBondContact O-OD1 3.05Å; N2124-N2127 VanDerWaalsContact O-OD1 3.06Å; S2125-N2127 VanDerWaalsContact C-N 3.31Å
2128	R	89.3	Confident	87.4	Confident	57.6 Å²	57.6	33.1 Å²	33.1	22%	0.217	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	151.2	-171	-84	-178.1	174	-178.4	2.4	112	I1663 G1664 T1666 D2123 H2126 Y2130	I1663-R2128 WeakPolarHBondContact O-CA 3.25Å; G1664-R2128 VanDerWaalsContact C-CG 3.47Å; G1664-R2128 WeakPolarHBondContact O-CG 3.23Å; G1664-R2128 PolarHBondContact O-NE 3.02Å; G1664-R2128 PolarHBondContact O-NH2 2.88Å; T1666-R2128 PolarHBondContact OG1-NE 2.84Å; T1666-R2128 PolarHBondContact OG1-NH1 2.87Å; T1666-R2128 VanDerWaalsContact OG1-NH1 3.14Å; T1666-R2128 PolarHBondContact OG1-NH2 3.45Å; D2123-R2128 PolarHBondContact N-O 3Å; D2123-R2128 PolarHBondContact O-N 3.16Å; D2123-R2128 VanDerWaalsContact O-N 3.17Å; H2126-R2128 VanDerWaalsContact C-N 3.25Å; H2126-R2128 HydrophobicContact CB-CB 4.28Å; H2126-R2128 WeakPolarHBondContact O-CB 3.45Å; H2126-R2128 VanDerWaalsContact O-CG 3.3Å; H2126-R2128 WeakPolarHBondContact O-CG 3.33Å; H2126-R2128 PolarHBondContact O-N 3.03Å; H2126-R2128 VanDerWaalsContact O-N 3.09Å; R2128-Y2130 HydrophobicContact CB-CD2 4.4Å; R2128-Y2130 HydrophobicContact CB-CE1 4.37Å; R2128-Y2130 HydrophobicContact CB-CE2 3.76Å
2129	V	92.4	Very high	86.9	Confident	20.2 Å²	20.2	35.1 Å²	35.1	12%	0.122	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	126.8	165.7	-178.1	0	0	0	0	108.2	V1662 I1663 L1690 P1693 L1696 L1704 I1706 F2120 V2121 A2122	V1662-V2129 WeakPolarHBondContact CB-O 3.23Å; V1662-V2129 PolarHBondContact N-O 2.97Å; I1663-V2129 HydrophobicContact CG2-CB 3.79Å; I1663-V2129 HydrophobicContact CG2-CG2 4.06Å; I1663-V2129 PolarHBondContact N-O 2.85Å; I1663-V2129 PolarHBondContact O-N 3.21Å; L1690-V2129 HydrophobicContact CD1-CG2 4.09Å; P1693-V2129 HydrophobicContact CB-CG2 3.97Å; L1696-V2129 HydrophobicContact CD1-CG1 3.98Å; L1696-V2129 HydrophobicContact CD2-CG1 3.98Å; L1696-V2129 HydrophobicContact CD2-CG2 3.94Å; L1704-V2129 HydrophobicContact CD2-CG1 4.23Å; I1706-V2129 HydrophobicContact CD1-CB 4.42Å; I1706-V2129 HydrophobicContact CD1-CG2 4.09Å; I1706-V2129 HydrophobicContact CG2-CG2 4.31Å; F2120-V2129 HydrophobicContact CB-CG1 4.32Å; F2120-V2129 HydrophobicContact CD1-CG1 4.28Å; V2121-V2129 CarbonylContact O-C 3.51Å; V2121-V2129 WeakPolarHBondContact O-CA 3.31Å; A2122-V2129 HydrophobicContact CB-CG2 4.26Å
2130	Y	92	Very high	86	Confident	9.6 Å²	9.6	36.6 Å²	36.6	4%	0.038	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	151.2	179.6	-60.7	-83	0	0	0	110.3	I1659 S1660 A1661 L2097 F2103 F2105 F2120 V2121 D2123 H2126 R2128	I1659-Y2130 HydrophobicContact CD1-CD1 4.05Å; I1659-Y2130 HydrophobicContact CD1-CG 3.99Å; I1659-Y2130 HydrophobicContact CG1-CD1 4.18Å; I1659-Y2130 HydrophobicContact CG1-CG 4.31Å; S1660-Y2130 CarbonylContact O-C 3.49Å; S1660-Y2130 VanDerWaalsContact O-CA 3.27Å; S1660-Y2130 WeakPolarHBondContact O-CA 3.17Å; A1661-Y2130 HydrophobicContact CB-CD1 4.47Å; A1661-Y2130 HydrophobicContact CB-CE1 4.47Å; L2097-Y2130 HydrophobicContact CD1-CD1 3.74Å; L2097-Y2130 HydrophobicContact CD1-CE1 3.48Å; L2097-Y2130 VanDerWaalsContact CD1-CE1 3.44Å; F2103-Y2130 HydrophobicContact CE1-CE1 4.21Å; F2103-Y2130 HydrophobicContact CE1-CE2 4.34Å; F2103-Y2130 HydrophobicContact CE2-CE1 4.21Å; F2103-Y2130 HydrophobicContact CZ-CD1 4.27Å; F2103-Y2130 AromaticContact CZ-CE1 3.74Å; F2103-Y2130 HydrophobicContact CZ-CE1 3.74Å; F2103-Y2130 HydrophobicContact CZ-CE2 4.12Å; F2103-Y2130 AromaticContact CZ-CZ 3.62Å; F2103-Y2130 VanDerWaalsContact CZ-CZ 3.47Å; F2105-Y2130 HydrophobicContact CD1-CD2 4.41Å; F2105-Y2130 AromaticContact CE1-CD2 3.75Å; F2105-Y2130 HydrophobicContact CE1-CD2 3.75Å; F2105-Y2130 HydrophobicContact CE1-CE2 4.33Å; F2105-Y2130 HydrophobicContact CE1-CG 4.21Å; F2120-Y2130 CarbonylContact C-O 3.53Å; F2120-Y2130 VanDerWaalsContact CA-O 3.24Å; F2120-Y2130 WeakPolarHBondContact CA-O 3.28Å; V2121-Y2130 PolarHBondContact N-O 2.93Å; V2121-Y2130 PolarHBondContact O-N 2.95Å; D2123-Y2130 HydrophobicContact CB-CD2 4.33Å; D2123-Y2130 HydrophobicContact CB-CE2 3.88Å; H2126-Y2130 HydrophobicContact CB-CE2 4.23Å; H2126-Y2130 VanDerWaalsContact CB-OH 3.29Å; H2126-Y2130 WeakPolarHBondContact CB-OH 3.34Å; H2126-Y2130 PolarHBondContact ND1-OH 2.87Å; R2128-Y2130 HydrophobicContact CB-CD2 4.4Å; R2128-Y2130 HydrophobicContact CB-CE1 4.37Å; R2128-Y2130 HydrophobicContact CB-CE2 3.76Å
2131	R	91.6	Very high	84.7	Confident	29 Å²	29	44.9 Å²	44.9	11%	0.109	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	118	171.6	172.9	179.6	161.3	-114.6	-1.8	108.5	I1659 S1660 V1662 R1763 E2118 F2120 H2133	I1659-R2131 WeakPolarHBondContact CA-O 3.33Å; S1660-R2131 PolarHBondContact N-O 2.99Å; S1660-R2131 PolarHBondContact O-N 2.93Å; S1660-R2131 PolarHBondContact OG-O 2.9Å; S1660-R2131 VanDerWaalsContact OG-O 3.11Å; V1662-R2131 HydrophobicContact CG2-CB 3.46Å; V1662-R2131 VanDerWaalsContact CG2-CB 3.46Å; R1763-R2131 PolarHBondContact O-NE 2.89Å; R1763-R2131 PolarHBondContact O-NH1 2.77Å; R1763-R2131 VanDerWaalsContact O-NH1 3.13Å; E2118-R2131 IonicContact OE1-CZ 3.25Å; E2118-R2131 IonicContact OE1-NE 2.96Å; E2118-R2131 PolarHBondContact OE1-NE 3.1Å; E2118-R2131 IonicContact OE1-NH2 3.26Å; E2118-R2131 PolarHBondContact OE1-NH2 2.93Å; E2118-R2131 IonicContact OE2-NE 3.95Å; F2120-R2131 HydrophobicContact CD1-CB 3.93Å; F2120-R2131 HydrophobicContact CD1-CG 4.34Å; F2120-R2131 HydrophobicContact CE1-CB 3.72Å; F2120-R2131 HydrophobicContact CE1-CG 3.8Å; F2120-R2131 HydrophobicContact CE2-CG 4.5Å; F2120-R2131 HydrophobicContact CZ-CB 4.46Å; F2120-R2131 HydrophobicContact CZ-CG 4.08Å; R2131-H2133 HydrophobicContact CG-CB 4.29Å; R2131-H2133 VanDerWaalsContact CZ-CD2 3.43Å; R2131-H2133 PolarHBondContact NH1-CD2 3.12Å; R2131-H2133 PolarHBondContact NH1-CE1 2.7Å; R2131-H2133 PolarHBondContact NH1-NE2 2.99Å; R2131-H2133 VanDerWaalsContact NH1-NE2 3.14Å; R2131-H2133 PolarHBondContact NH2-CD2 2.99Å; R2131-H2133 VanDerWaalsContact NH2-CD2 3.31Å; R2131-H2133 PolarHBondContact O-ND1 3.12Å
2132	I	91	Very high	83.5	Confident	6 Å²	6	51.1 Å²	51.1	3%	0.031	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	124.5	172.1	-59.8	168.2	0	0	0	107.6	W1657 H1658 I1659 I2052 V2065 V2100 F2105 E2118 L2119 V2121	W1657-I2132 HydrophobicContact CB-CG2 3.76Å; W1657-I2132 HydrophobicContact CD2-CG2 4.14Å; W1657-I2132 HydrophobicContact CE3-CG2 3.61Å; W1657-I2132 VanDerWaalsContact CE3-CG2 3.48Å; W1657-I2132 HydrophobicContact CG-CG2 4.25Å; W1657-I2132 HydrophobicContact CZ3-CG2 4.36Å; H1658-I2132 CarbonylContact O-C 3.58Å; H1658-I2132 VanDerWaalsContact O-CA 3.28Å; H1658-I2132 WeakPolarHBondContact O-CA 3.34Å; I1659-I2132 HydrophobicContact CB-CG1 4.41Å; I1659-I2132 HydrophobicContact CD1-CG1 4.37Å; I1659-I2132 HydrophobicContact CG1-CG1 4.12Å; I2052-I2132 HydrophobicContact CD1-CD1 4.27Å; V2065-I2132 HydrophobicContact CG1-CD1 4.47Å; V2100-I2132 HydrophobicContact CB-CG2 4.34Å; V2100-I2132 HydrophobicContact CG1-CD1 3.94Å; V2100-I2132 HydrophobicContact CG1-CG2 4.44Å; V2100-I2132 HydrophobicContact CG2-CB 4.22Å; V2100-I2132 HydrophobicContact CG2-CD1 3.72Å; V2100-I2132 HydrophobicContact CG2-CG1 3.77Å; V2100-I2132 HydrophobicContact CG2-CG2 3.97Å; F2105-I2132 HydrophobicContact CE2-CD1 4.38Å; F2105-I2132 HydrophobicContact CZ-CD1 4.09Å; E2118-I2132 CarbonylContact C-O 3.48Å; E2118-I2132 WeakPolarHBondContact CA-O 3.27Å; L2119-I2132 HydrophobicContact CB-CB 4.15Å; L2119-I2132 HydrophobicContact CD2-CB 4.49Å; L2119-I2132 HydrophobicContact CD2-CD1 3.81Å; L2119-I2132 HydrophobicContact CG-CD1 4.32Å; L2119-I2132 PolarHBondContact N-O 3Å; L2119-I2132 WeakPolarHBondContact O-CB 3.44Å; L2119-I2132 PolarHBondContact O-N 3Å; V2121-I2132 HydrophobicContact CG2-CD1 3.63Å; V2121-I2132 HydrophobicContact CG2-CG1 4.39Å
2133	H	86.4	Confident	82.3	Confident	27.6 Å²	27.6	52.5 Å²	52.5	13%	0.128	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	160.7	-173.7	64.7	-40.4	0	0	0	110.9	W1657 H1658 S1660 E2118 R2131	W1657-H2133 CarbonylContact C-O 3.49Å; W1657-H2133 WeakPolarHBondContact CA-O 3.5Å; H1658-H2133 PolarHBondContact N-O 3.32Å; H1658-H2133 PolarHBondContact O-N 3.31Å; H1658-H2133 PolarHBondContact O-ND1 3.1Å; S1660-H2133 PolarHBondContact OG-CE1 3Å; E2118-H2133 HydrophobicContact CB-CB 4.45Å; E2118-H2133 HydrophobicContact CG-CB 4.25Å; R2131-H2133 HydrophobicContact CG-CB 4.29Å; R2131-H2133 VanDerWaalsContact CZ-CD2 3.43Å; R2131-H2133 PolarHBondContact NH1-CD2 3.12Å; R2131-H2133 PolarHBondContact NH1-CE1 2.7Å; R2131-H2133 PolarHBondContact NH1-NE2 2.99Å; R2131-H2133 VanDerWaalsContact NH1-NE2 3.14Å; R2131-H2133 PolarHBondContact NH2-CD2 2.99Å; R2131-H2133 VanDerWaalsContact NH2-CD2 3.31Å; R2131-H2133 PolarHBondContact O-ND1 3.12Å
2134	Y	79.9	Confident	81.8	Confident	74.4 Å²	74.4	57.3 Å²	57.3	29%	0.292	30%	0.301	S	S	.	.			trans	-78.5	146.1	167.2	46.2	-88.7	0	0	0	110.1	K1653 N1761 L2136	K1653-Y2134 HydrophobicContact CB-CD1 4.3Å; K1653-Y2134 HydrophobicContact CB-CD2 4.11Å; K1653-Y2134 HydrophobicContact CB-CE1 4.46Å; K1653-Y2134 HydrophobicContact CB-CE2 4.22Å; K1653-Y2134 HydrophobicContact CB-CG 4.1Å; K1653-Y2134 HydrophobicContact CD-CD2 4.41Å; K1653-Y2134 HydrophobicContact CD-CE2 3.91Å; K1653-Y2134 HydrophobicContact CG-CD1 4.48Å; K1653-Y2134 HydrophobicContact CG-CD2 3.74Å; K1653-Y2134 HydrophobicContact CG-CE2 3.68Å; K1653-Y2134 HydrophobicContact CG-CG 4.25Å; N1761-Y2134 HydrophobicContact CB-CE2 4.46Å; N1761-Y2134 PolarHBondContact ND2-OH 2.92Å; Y2134-L2136 HydrophobicContact CD2-CD2 4.39Å; Y2134-L2136 HydrophobicContact CD2-CG 4.29Å; Y2134-L2136 HydrophobicContact CE2-CD1 4.44Å; Y2134-L2136 HydrophobicContact CE2-CG 4.23Å; Y2134-L2136 PolarHBondContact O-N 2.89Å; Y2134-L2136 VanDerWaalsContact O-N 3.1Å
2135	Q	74.9	Confident	81.7	Confident	69.8 Å²	69.8	56.5 Å²	56.5	33%	0.326	30%	0.297	S	S	.	.			trans	-106.2	121.7	174.8	-173.7	154	-0.9	0	0	109.3	H1658 R1764 D2096	H1658-Q2135 HydrophobicContact CB-CB 4.47Å; H1658-Q2135 PolarHBondContact CE1-OE1 2.84Å; H1658-Q2135 VanDerWaalsContact CE1-OE1 3.22Å; H1658-Q2135 PolarHBondContact ND1-OE1 2.79Å; R1764-Q2135 VanDerWaalsContact NH1-NE2 3.19Å; D2096-Q2135 PolarHBondContact OD2-OE1 3.46Å
2136	L	78.8	Confident	81.8	Confident	56.4 Å²	56.4	56 Å²	56	30%	0.295	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-90.7	146.6	172	-65.8	177	0	0	0	109.5	L1652 K1653 Y2134 E2138	L1652-L2136 HydrophobicContact CB-CD2 3.83Å; L1652-L2136 HydrophobicContact CD1-CD2 4.42Å; K1653-L2136 HydrophobicContact CG-CD2 4.09Å; Y2134-L2136 HydrophobicContact CD2-CD2 4.39Å; Y2134-L2136 HydrophobicContact CD2-CG 4.29Å; Y2134-L2136 HydrophobicContact CE2-CD1 4.44Å; Y2134-L2136 HydrophobicContact CE2-CG 4.23Å; Y2134-L2136 PolarHBondContact O-N 2.89Å; Y2134-L2136 VanDerWaalsContact O-N 3.1Å; L2136-E2138 PolarHBondContact O-N 3.12Å
2137	P	78.9	Confident	81.8	Confident	38.4 Å²	38.4	59 Å²	59	25%	0.249	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-54.7	132	174	-16.7	21.1	0	0	0	111.6	L1652 Y2146 I2148	L1652-P2137 HydrophobicContact CD1-CG 3.94Å; P2137-Y2146 HydrophobicContact CB-CD1 4.12Å; P2137-Y2146 HydrophobicContact CG-CD1 4.25Å; P2137-Y2146 VanDerWaalsContact O-CD1 3.3Å; P2137-Y2146 WeakPolarHBondContact O-CD1 3.28Å; P2137-Y2146 WeakPolarHBondContact O-CE1 3.31Å; P2137-I2148 HydrophobicContact CB-CD1 4.42Å; P2137-I2148 HydrophobicContact CB-CG1 4.25Å; P2137-I2148 HydrophobicContact CG-CD1 3.91Å; P2137-I2148 HydrophobicContact CG-CG1 3.81Å
2138	E	74.9	Confident	81.8	Confident	111.4 Å²	111.4	58.3 Å²	58.3	52%	0.521	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-87.5	153.2	173.6	-71.5	-177.6	158.4	0	0	111	R1764 L2136 S2140 Y2146	R1764-E2138 IonicContact CZ-OE1 3.08Å; R1764-E2138 IonicContact CZ-OE2 3.43Å; R1764-E2138 IonicContact NE-OE1 2.66Å; R1764-E2138 PolarHBondContact NE-OE1 2.87Å; R1764-E2138 VanDerWaalsContact NH1-CD 3.31Å; R1764-E2138 IonicContact NH1-OE1 3.31Å; R1764-E2138 PolarHBondContact NH1-OE1 2.96Å; R1764-E2138 IonicContact NH1-OE2 3.24Å; R1764-E2138 PolarHBondContact NH1-OE2 2.87Å; R1764-E2138 IonicContact NH2-OE1 3.12Å; R1764-E2138 PolarHBondContact NH2-OE1 2.99Å; R1764-E2138 VanDerWaalsContact NH2-OE1 3.07Å; R1764-E2138 IonicContact NH2-OE2 2.94Å; R1764-E2138 PolarHBondContact NH2-OE2 2.87Å; L2136-E2138 PolarHBondContact O-N 3.12Å; E2138-S2140 PolarHBondContact O-N 2.83Å; E2138-Y2146 VanDerWaalsContact C-CD1 3.49Å; E2138-Y2146 WeakPolarHBondContact O-CD1 3.39Å
2139	I	78	Confident	81.5	Confident	55.4 Å²	55.4	59.7 Å²	59.7	28%	0.284	31%	0.307	S	S	.	.	B	Isolated β-bridge	trans	-75.1	128.9	174.9	-142.6	167	0	0	0	108.5	E2141 N2144 Y2146	I2139-E2141 PolarHBondContact O-N 3.08Å; I2139-N2144 HydrophobicContact CD1-CB 4.2Å; I2139-N2144 WeakPolarHBondContact CD1-OD1 3.26Å; I2139-N2144 VanDerWaalsContact CG1-C 3.44Å; I2139-N2144 HydrophobicContact CG1-CB 4.5Å; I2139-N2144 WeakPolarHBondContact CG2-OD1 3.5Å; I2139-Y2146 HydrophobicContact CB-CD1 4.39Å; I2139-Y2146 HydrophobicContact CB-CE1 4.01Å; I2139-Y2146 HydrophobicContact CD1-CE1 4.34Å; I2139-Y2146 HydrophobicContact CD1-CE2 4.19Å; I2139-Y2146 HydrophobicContact CG1-CD1 4.1Å; I2139-Y2146 HydrophobicContact CG1-CE1 4.16Å; I2139-Y2146 HydrophobicContact CG1-CE2 4.46Å
2140	S	74.8	Confident	80.9	Confident	33.4 Å²	33.4	59.8 Å²	59.8	23%	0.234	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-64.2	129	176.5	177.6	0	0	0	0	110.7	E2138 T2142 G2143 N2144 T2145	E2138-S2140 PolarHBondContact O-N 2.83Å; S2140-T2142 PolarHBondContact O-N 2.94Å; S2140-T2142 VanDerWaalsContact O-N 3.13Å; S2140-T2142 PolarHBondContact OG-OG1 3.23Å; S2140-T2142 VanDerWaalsContact OG-OG1 3.11Å; S2140-G2143 WeakPolarHBondContact CB-O 3.45Å; S2140-G2143 CarbonylContact O-C 3.55Å; S2140-G2143 PolarHBondContact O-N 3.12Å; S2140-N2144 WeakPolarHBondContact O-CA 3.38Å; S2140-N2144 PolarHBondContact O-N 3.16Å; S2140-T2145 WeakPolarHBondContact CB-O 3.28Å; S2140-T2145 PolarHBondContact N-O 3.11Å
2141	E	68.3	Low	79.8	Confident	187.6 Å²	187.6	62.7 Å²	62.7	88%	0.877	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-31.5	178.4	-65.7	-175	171.7	0	0	113.1	I2139	I2139-E2141 PolarHBondContact O-N 3.08Å
2142	T	70.4	Confident	78.6	Confident	130 Å²	130	68.2 Å²	68.2	80%	0.798	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-24.5	-174.1	56.8	0	0	0	0	113.7	S2140	S2140-T2142 PolarHBondContact O-N 2.94Å; S2140-T2142 VanDerWaalsContact O-N 3.13Å; S2140-T2142 PolarHBondContact OG-OG1 3.23Å; S2140-T2142 VanDerWaalsContact OG-OG1 3.11Å
2143	G	67.7	Low	77.8	Confident	36.2 Å²	36.2	71 Å²	71	37%	0.373	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.8	-2	-171.5	0	0	0	0	0	114	S2140 T2145	S2140-G2143 WeakPolarHBondContact CB-O 3.45Å; S2140-G2143 CarbonylContact O-C 3.55Å; S2140-G2143 PolarHBondContact O-N 3.12Å; G2143-T2145 WeakPolarHBondContact O-CG2 3.31Å; G2143-T2145 PolarHBondContact O-N 3Å; G2143-T2145 PolarHBondContact O-OG1 3.46Å
2144	N	80.9	Confident	77.5	Confident	99.4 Å²	99.4	72.6 Å²	72.6	53%	0.532	38%	0.381	S	S	.	.	S	Bend	trans	38.6	41.4	-170	-124.1	18.9	0	0	0	112.7	I2139 S2140 S2161	I2139-N2144 HydrophobicContact CD1-CB 4.2Å; I2139-N2144 WeakPolarHBondContact CD1-OD1 3.26Å; I2139-N2144 VanDerWaalsContact CG1-C 3.44Å; I2139-N2144 HydrophobicContact CG1-CB 4.5Å; I2139-N2144 WeakPolarHBondContact CG2-OD1 3.5Å; S2140-N2144 WeakPolarHBondContact O-CA 3.38Å; S2140-N2144 PolarHBondContact O-N 3.16Å; N2144-S2161 PolarHBondContact O-N 2.99Å; N2144-S2161 VanDerWaalsContact O-N 3.16Å
2145	T	86.5	Confident	77.7	Confident	24.2 Å²	24.2	71.8 Å²	71.8	15%	0.148	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	147.4	-175.8	57.1	0	0	0	0	111.6	S2140 G2143 F2159 I2166	S2140-T2145 WeakPolarHBondContact CB-O 3.28Å; S2140-T2145 PolarHBondContact N-O 3.11Å; G2143-T2145 WeakPolarHBondContact O-CG2 3.31Å; G2143-T2145 PolarHBondContact O-N 3Å; G2143-T2145 PolarHBondContact O-OG1 3.46Å; T2145-F2159 CarbonylContact C-O 3.49Å; T2145-F2159 WeakPolarHBondContact CA-O 3.31Å; T2145-F2159 WeakPolarHBondContact CB-O 3.38Å; T2145-I2166 HydrophobicContact CG2-CD1 3.7Å; T2145-I2166 VanDerWaalsContact CG2-CD1 3.5Å
2146	Y	88	Confident	78.3	Confident	30 Å²	30	69.7 Å²	69.7	12%	0.118	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	125.5	168.2	-58.6	-80.5	0	0	0	109.4	Y1635 V1637 R1760 P2137 E2138 I2139 S2158 F2159 G2160	Y1635-Y2146 AromaticContact CD1-CD2 3.98Å; Y1635-Y2146 HydrophobicContact CD1-CD2 4.03Å; Y1635-Y2146 HydrophobicContact CD1-CG 4.09Å; Y1635-Y2146 HydrophobicContact CE1-CD1 4.08Å; Y1635-Y2146 AromaticContact CE1-CD2 3.99Å; Y1635-Y2146 HydrophobicContact CE1-CD2 4.03Å; Y1635-Y2146 HydrophobicContact CE1-CE1 4.42Å; Y1635-Y2146 HydrophobicContact CE1-CE2 4.42Å; Y1635-Y2146 AromaticContact CE1-CG 3.83Å; Y1635-Y2146 HydrophobicContact CE1-CG 3.83Å; V1637-Y2146 HydrophobicContact CG1-CE1 4.4Å; V1637-Y2146 HydrophobicContact CG1-CE2 4.1Å; V1637-Y2146 WeakPolarHBondContact CG1-OH 3.45Å; V1637-Y2146 HydrophobicContact CG2-CD2 4.29Å; V1637-Y2146 HydrophobicContact CG2-CE2 3.74Å; R1760-Y2146 PolarHBondContact NH2-OH 3.27Å; P2137-Y2146 HydrophobicContact CB-CD1 4.12Å; P2137-Y2146 HydrophobicContact CG-CD1 4.25Å; P2137-Y2146 VanDerWaalsContact O-CD1 3.3Å; P2137-Y2146 WeakPolarHBondContact O-CD1 3.28Å; P2137-Y2146 WeakPolarHBondContact O-CE1 3.31Å; E2138-Y2146 VanDerWaalsContact C-CD1 3.49Å; E2138-Y2146 WeakPolarHBondContact O-CD1 3.39Å; I2139-Y2146 HydrophobicContact CB-CD1 4.39Å; I2139-Y2146 HydrophobicContact CB-CE1 4.01Å; I2139-Y2146 HydrophobicContact CD1-CE1 4.34Å; I2139-Y2146 HydrophobicContact CD1-CE2 4.19Å; I2139-Y2146 HydrophobicContact CG1-CD1 4.1Å; I2139-Y2146 HydrophobicContact CG1-CE1 4.16Å; I2139-Y2146 HydrophobicContact CG1-CE2 4.46Å; Y2146-S2158 CarbonylContact O-C 3.54Å; Y2146-S2158 WeakPolarHBondContact O-CA 3.36Å; Y2146-F2159 PolarHBondContact N-O 3.05Å; Y2146-F2159 PolarHBondContact O-N 3.18Å; Y2146-G2160 WeakPolarHBondContact CD2-O 3.35Å
2147	R	86.6	Confident	78.9	Confident	108.8 Å²	108.8	67.2 Å²	67.2	41%	0.411	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	125.8	173.2	-69.9	-177.3	95.7	148	0.9	109.4	I2156 D2157 S2158 E2169 D2372	R2147-I2156 HydrophobicContact CB-CG2 4.35Å; R2147-I2156 HydrophobicContact CG-CG2 4.32Å; R2147-D2157 CarbonylContact C-O 3.54Å; R2147-D2157 WeakPolarHBondContact CA-O 3.38Å; R2147-S2158 WeakPolarHBondContact CG-OG 3.32Å; R2147-E2169 IonicContact CZ-OE1 3.52Å; R2147-E2169 IonicContact CZ-OE2 2.83Å; R2147-E2169 IonicContact NE-OE1 3.28Å; R2147-E2169 PolarHBondContact NE-OE1 3Å; R2147-E2169 IonicContact NH2-OE1 3.24Å; R2147-E2169 PolarHBondContact NH2-OE1 2.98Å; R2147-E2169 IonicContact NH2-OE2 3.27Å; R2147-E2169 PolarHBondContact NH2-OE2 2.97Å; R2147-D2372 PolarHBondContact NH1-O 3.1Å
2148	I	86.2	Confident	79.5	Confident	19.2 Å²	19.2	65.7 Å²	65.7	10%	0.098	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	127.2	-177.2	-54.1	-177.2	0	0	0	109.3	Y1635 I1642 L1652 P2137 I2156 D2157 F2159	Y1635-I2148 HydrophobicContact CD1-CD1 4.16Å; Y1635-I2148 HydrophobicContact CD2-CD1 4.22Å; Y1635-I2148 HydrophobicContact CE1-CD1 4.34Å; Y1635-I2148 HydrophobicContact CE2-CD1 4.39Å; Y1635-I2148 HydrophobicContact CG-CD1 4.08Å; I1642-I2148 HydrophobicContact CD1-CB 4.39Å; I1642-I2148 HydrophobicContact CD1-CD1 3.52Å; I1642-I2148 VanDerWaalsContact CD1-CD1 3.46Å; I1642-I2148 HydrophobicContact CD1-CG1 4.48Å; I1642-I2148 HydrophobicContact CD1-CG2 3.72Å; I1642-I2148 HydrophobicContact CG1-CD1 4.05Å; L1652-I2148 HydrophobicContact CD1-CD1 4.27Å; P2137-I2148 HydrophobicContact CB-CD1 4.42Å; P2137-I2148 HydrophobicContact CB-CG1 4.25Å; P2137-I2148 HydrophobicContact CG-CD1 3.91Å; P2137-I2148 HydrophobicContact CG-CG1 3.81Å; I2148-I2156 CarbonylContact O-C 3.49Å; I2148-I2156 WeakPolarHBondContact O-CA 3.36Å; I2148-D2157 PolarHBondContact N-O 3.03Å; I2148-D2157 PolarHBondContact O-N 2.99Å; I2148-F2159 HydrophobicContact CB-CE2 4.26Å; I2148-F2159 HydrophobicContact CD1-CD2 3.86Å; I2148-F2159 HydrophobicContact CD1-CE2 3.71Å; I2148-F2159 HydrophobicContact CG1-CD2 4.13Å; I2148-F2159 HydrophobicContact CG1-CE2 4.09Å
2149	L	82.3	Confident	80.3	Confident	86.8 Å²	86.8	60.8 Å²	60.8	45%	0.454	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	127.7	179	175.5	66.5	0	0	0	110.9	I2156 T2171 Y2367 Y2374	L2149-I2156 HydrophobicContact CB-CG1 4.4Å; L2149-I2156 HydrophobicContact CD1-CD1 4.31Å; L2149-I2156 HydrophobicContact CD1-CG1 3.83Å; L2149-T2171 HydrophobicContact CD1-CG2 3.16Å; L2149-Y2367 HydrophobicContact CD1-CD1 4.1Å; L2149-Y2367 HydrophobicContact CD1-CE1 3.74Å; L2149-Y2367 HydrophobicContact CD2-CD1 3.66Å; L2149-Y2367 HydrophobicContact CD2-CD2 3.67Å; L2149-Y2367 HydrophobicContact CD2-CE1 3.95Å; L2149-Y2367 HydrophobicContact CD2-CE2 3.95Å; L2149-Y2367 HydrophobicContact CD2-CG 3.52Å; L2149-Y2367 HydrophobicContact CG-CE1 4.47Å; L2149-Y2374 HydrophobicContact CB-CD1 3.76Å; L2149-Y2374 HydrophobicContact CB-CD2 4.17Å; L2149-Y2374 HydrophobicContact CB-CE1 4.01Å; L2149-Y2374 HydrophobicContact CB-CE2 4.4Å; L2149-Y2374 HydrophobicContact CB-CG 3.87Å; L2149-Y2374 HydrophobicContact CD2-CD1 3.53Å; L2149-Y2374 HydrophobicContact CD2-CE1 4.21Å; L2149-Y2374 HydrophobicContact CD2-CG 4.07Å; L2149-Y2374 HydrophobicContact CG-CD1 4.19Å; L2149-Y2374 HydrophobicContact CG-CG 4.39Å
2150	H	80.4	Confident	80.6	Confident	23 Å²	23	58.4 Å²	58.4	11%	0.106	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	88.3	171.6	-66.7	-73.3	0	0	0	110.1	F1650 Q2152 T2153 D2154 E2155 D2157	F1650-H2150 AromaticContact CD2-CE1 3.7Å; F1650-H2150 AromaticContact CD2-ND1 3.9Å; F1650-H2150 AromaticContact CE2-CE1 3.55Å; F1650-H2150 AromaticContact CE2-ND1 3.33Å; F1650-H2150 VanDerWaalsContact CE2-ND1 3.33Å; F1650-H2150 WeakPolarHBondContact CE2-ND1 3.25Å; F1650-H2150 AromaticContact CZ-ND1 3.91Å; H2150-Q2152 VanDerWaalsContact C-N 3.3Å; H2150-Q2152 PolarHBondContact O-N 3.14Å; H2150-Q2152 VanDerWaalsContact O-N 3.11Å; H2150-T2153 WeakPolarHBondContact CB-OG1 3.28Å; H2150-T2153 PolarHBondContact O-N 3.03Å; H2150-T2153 VanDerWaalsContact O-N 3.15Å; H2150-T2153 PolarHBondContact O-OG1 3.26Å; H2150-D2154 PolarHBondContact O-N 2.95Å; H2150-E2155 WeakPolarHBondContact CA-O 3.16Å; H2150-E2155 HydrophobicContact CB-CB 4.38Å; H2150-E2155 WeakPolarHBondContact CB-O 3.33Å; H2150-E2155 PolarHBondContact N-O 3.13Å; H2150-E2155 PolarHBondContact O-N 3.19Å; H2150-D2157 IonicContact CD2-OD2 3.44Å; H2150-D2157 PolarHBondContact CD2-OD2 3.02Å; H2150-D2157 VanDerWaalsContact CD2-OD2 3.23Å; H2150-D2157 IonicContact NE2-OD2 3.47Å; H2150-D2157 PolarHBondContact NE2-OD2 3Å; H2150-D2157 VanDerWaalsContact NE2-OD2 3.15Å
2151	S	68.6	Low	81	Confident	69.6 Å²	69.6	58.7 Å²	58.7	49%	0.487	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-27.7	-175.7	57.5	0	0	0	0	114.2	T2153 D2154 H2346 Q2365 Y2367	S2151-T2153 VanDerWaalsContact C-N 3.31Å; S2151-T2153 PolarHBondContact O-N 3.36Å; S2151-D2154 PolarHBondContact O-N 3.43Å; S2151-H2346 PolarHBondContact OG-CD2 2.76Å; S2151-H2346 VanDerWaalsContact OG-CD2 3.26Å; S2151-H2346 PolarHBondContact OG-NE2 2.92Å; S2151-Q2365 VanDerWaalsContact O-CD 3.27Å; S2151-Q2365 PolarHBondContact O-NE2 3.31Å; S2151-Q2365 PolarHBondContact O-OE1 3Å; S2151-Y2367 PolarHBondContact O-OH 2.71Å
2152	Q	67.7	Low	81.6	Confident	145.4 Å²	145.4	55.8 Å²	55.8	68%	0.679	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-32	179.2	-64.5	161.9	-9.5	0	0	113.2	H2150	H2150-Q2152 VanDerWaalsContact C-N 3.3Å; H2150-Q2152 PolarHBondContact O-N 3.14Å; H2150-Q2152 VanDerWaalsContact O-N 3.11Å
2153	T	74.7	Confident	82.3	Confident	64.6 Å²	64.6	50 Å²	50	40%	0.396	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106	-2.6	-178	56.4	0	0	0	0	113.6	H2150 S2151 E2155	H2150-T2153 WeakPolarHBondContact CB-OG1 3.28Å; H2150-T2153 PolarHBondContact O-N 3.03Å; H2150-T2153 VanDerWaalsContact O-N 3.15Å; H2150-T2153 PolarHBondContact O-OG1 3.26Å; S2151-T2153 VanDerWaalsContact C-N 3.31Å; S2151-T2153 PolarHBondContact O-N 3.36Å; T2153-E2155 VanDerWaalsContact C-N 3.28Å; T2153-E2155 VanDerWaalsContact CB-OE2 3.28Å; T2153-E2155 WeakPolarHBondContact CB-OE2 3.41Å; T2153-E2155 PolarHBondContact O-N 3.14Å; T2153-E2155 PolarHBondContact OG1-OE2 3.19Å
2154	D	79.2	Confident	83.2	Confident	61.2 Å²	61.2	49.4 Å²	49.4	33%	0.327	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.8	39.1	-176.3	-154.5	51.6	0	0	0	112	H2150 S2151 S2170 T2171 S2172 Y2367	H2150-D2154 PolarHBondContact O-N 2.95Å; S2151-D2154 PolarHBondContact O-N 3.43Å; D2154-S2170 VanDerWaalsContact O-CA 3.29Å; D2154-S2170 WeakPolarHBondContact O-CA 3.43Å; D2154-S2170 PolarHBondContact OD2-OG 2.77Å; D2154-T2171 VanDerWaalsContact C-CG2 3.46Å; D2154-T2171 VanDerWaalsContact C-OG1 3.26Å; D2154-T2171 WeakPolarHBondContact CA-OG1 3.35Å; D2154-T2171 PolarHBondContact O-N 3.02Å; D2154-T2171 PolarHBondContact O-OG1 3.11Å; D2154-T2171 PolarHBondContact OD1-OG1 2.97Å; D2154-T2171 PolarHBondContact OD2-OG1 3.18Å; D2154-T2171 VanDerWaalsContact OD2-OG1 3.07Å; D2154-S2172 WeakPolarHBondContact OD1-CB 3.14Å; D2154-S2172 PolarHBondContact OD1-N 3.47Å; D2154-S2172 PolarHBondContact OD1-OG 3.42Å; D2154-S2172 VanDerWaalsContact OD2-CB 3.26Å; D2154-S2172 WeakPolarHBondContact OD2-CB 3.26Å; D2154-S2172 PolarHBondContact OD2-OG 2.99Å; D2154-Y2367 PolarHBondContact OD1-OH 3.49Å
2155	E	84.6	Confident	83.7	Confident	57 Å²	57	45 Å²	45	27%	0.266	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	147.1	-175.9	-69.3	169.5	150.9	0	0	111.7	R1644 H2150 T2153 T2168 E2169	R1644-E2155 IonicContact CZ-OE2 2.77Å; R1644-E2155 IonicContact NH2-OE2 3.19Å; R1644-E2155 PolarHBondContact NH2-OE2 3.12Å; H2150-E2155 WeakPolarHBondContact CA-O 3.16Å; H2150-E2155 HydrophobicContact CB-CB 4.38Å; H2150-E2155 WeakPolarHBondContact CB-O 3.33Å; H2150-E2155 PolarHBondContact N-O 3.13Å; H2150-E2155 PolarHBondContact O-N 3.19Å; T2153-E2155 VanDerWaalsContact C-N 3.28Å; T2153-E2155 VanDerWaalsContact CB-OE2 3.28Å; T2153-E2155 WeakPolarHBondContact CB-OE2 3.41Å; T2153-E2155 PolarHBondContact O-N 3.14Å; T2153-E2155 PolarHBondContact OG1-OE2 3.19Å; E2155-T2168 HydrophobicContact CB-CG2 4.02Å; E2155-T2168 HydrophobicContact CG-CG2 4.1Å; E2155-E2169 CarbonylContact C-O 3.55Å; E2155-E2169 VanDerWaalsContact CA-O 3.28Å; E2155-E2169 WeakPolarHBondContact CA-O 3.42Å
2156	I	87.5	Confident	83.9	Confident	25.4 Å²	25.4	46.7 Å²	46.7	13%	0.13	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	122.6	167.8	-59.4	170.5	0	0	0	108.1	R2147 I2148 L2149 T2168 E2169 T2171	R2147-I2156 HydrophobicContact CB-CG2 4.35Å; R2147-I2156 HydrophobicContact CG-CG2 4.32Å; I2148-I2156 CarbonylContact O-C 3.49Å; I2148-I2156 WeakPolarHBondContact O-CA 3.36Å; L2149-I2156 HydrophobicContact CB-CG1 4.4Å; L2149-I2156 HydrophobicContact CD1-CD1 4.31Å; L2149-I2156 HydrophobicContact CD1-CG1 3.83Å; I2156-T2168 CarbonylContact O-C 3.53Å; I2156-T2168 VanDerWaalsContact O-CA 3.31Å; I2156-T2168 WeakPolarHBondContact O-CA 3.36Å; I2156-E2169 HydrophobicContact CB-CB 4.38Å; I2156-E2169 HydrophobicContact CB-CG 3.63Å; I2156-E2169 HydrophobicContact CD1-CG 4.37Å; I2156-E2169 WeakPolarHBondContact CD1-OE1 3.49Å; I2156-E2169 HydrophobicContact CG1-CG 4.33Å; I2156-E2169 HydrophobicContact CG2-CG 4.19Å; I2156-E2169 WeakPolarHBondContact CG2-OE1 3.24Å; I2156-E2169 PolarHBondContact N-O 3.17Å; I2156-E2169 PolarHBondContact O-N 3.04Å; I2156-T2171 HydrophobicContact CD1-CG2 3.86Å; I2156-T2171 HydrophobicContact CG1-CG2 3.47Å; I2156-T2171 VanDerWaalsContact CG1-CG2 3.42Å
2157	D	91.2	Very high	84	Confident	4.8 Å²	4.8	45.9 Å²	45.9	3%	0.026	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	130	174.3	-74.7	-27.6	0	0	0	110.6	H1633 R2147 I2148 H2150 F2159 L2165 T2168	H1633-D2157 IonicContact CD2-OD2 3.76Å; H1633-D2157 PolarHBondContact CD2-OD2 3.04Å; H1633-D2157 VanDerWaalsContact CD2-OD2 3.29Å; R2147-D2157 CarbonylContact C-O 3.54Å; R2147-D2157 WeakPolarHBondContact CA-O 3.38Å; I2148-D2157 PolarHBondContact N-O 3.03Å; I2148-D2157 PolarHBondContact O-N 2.99Å; H2150-D2157 IonicContact CD2-OD2 3.44Å; H2150-D2157 PolarHBondContact CD2-OD2 3.02Å; H2150-D2157 VanDerWaalsContact CD2-OD2 3.23Å; H2150-D2157 IonicContact NE2-OD2 3.47Å; H2150-D2157 PolarHBondContact NE2-OD2 3Å; H2150-D2157 VanDerWaalsContact NE2-OD2 3.15Å; D2157-F2159 HydrophobicContact CB-CD2 4.22Å; D2157-F2159 HydrophobicContact CB-CE2 3.41Å; D2157-F2159 VanDerWaalsContact CB-CE2 3.43Å; D2157-F2159 HydrophobicContact CB-CZ 3.76Å; D2157-L2165 HydrophobicContact CB-CD1 3.64Å; D2157-T2168 VanDerWaalsContact OD1-CB 3.31Å; D2157-T2168 WeakPolarHBondContact OD1-CB 3.3Å; D2157-T2168 VanDerWaalsContact OD1-CG2 3.23Å; D2157-T2168 WeakPolarHBondContact OD1-CG2 3.32Å; D2157-T2168 PolarHBondContact OD1-OG1 3.17Å
2158	S	91.2	Very high	84.2	Confident	6.6 Å²	6.6	40.9 Å²	40.9	5%	0.046	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	115.4	174.1	-63.1	0	0	0	0	109.5	Y2146 R2147 I2166 S2167	Y2146-S2158 CarbonylContact O-C 3.54Å; Y2146-S2158 WeakPolarHBondContact O-CA 3.36Å; R2147-S2158 WeakPolarHBondContact CG-OG 3.32Å; S2158-I2166 WeakPolarHBondContact O-CA 3.37Å; S2158-I2166 WeakPolarHBondContact O-CB 3.29Å; S2158-I2166 PolarHBondContact O-N 3.01Å; S2158-S2167 WeakPolarHBondContact CB-OG 3.17Å; S2158-S2167 PolarHBondContact N-O 3.01Å; S2158-S2167 PolarHBondContact O-N 2.99Å
2159	F	90.5	Very high	84.3	Confident	8 Å²	8	41.2 Å²	41.2	4%	0.035	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	145.6	178.3	-59.1	-91.4	0	0	0	111.2	H1633 I1642 T2145 Y2146 I2148 D2157 G2163 Q2164 L2165	H1633-F2159 HydrophobicContact CB-CE1 4Å; H1633-F2159 HydrophobicContact CB-CZ 4.07Å; I1642-F2159 HydrophobicContact CG2-CZ 4.13Å; T2145-F2159 CarbonylContact C-O 3.49Å; T2145-F2159 WeakPolarHBondContact CA-O 3.31Å; T2145-F2159 WeakPolarHBondContact CB-O 3.38Å; Y2146-F2159 PolarHBondContact N-O 3.05Å; Y2146-F2159 PolarHBondContact O-N 3.18Å; I2148-F2159 HydrophobicContact CB-CE2 4.26Å; I2148-F2159 HydrophobicContact CD1-CD2 3.86Å; I2148-F2159 HydrophobicContact CD1-CE2 3.71Å; I2148-F2159 HydrophobicContact CG1-CD2 4.13Å; I2148-F2159 HydrophobicContact CG1-CE2 4.09Å; D2157-F2159 HydrophobicContact CB-CD2 4.22Å; D2157-F2159 HydrophobicContact CB-CE2 3.41Å; D2157-F2159 VanDerWaalsContact CB-CE2 3.43Å; D2157-F2159 HydrophobicContact CB-CZ 3.76Å; F2159-G2163 VanDerWaalsContact CD1-O 3.31Å; F2159-G2163 WeakPolarHBondContact CD1-O 3.31Å; F2159-Q2164 CarbonylContact C-O 3.56Å; F2159-Q2164 VanDerWaalsContact CA-O 3.23Å; F2159-Q2164 WeakPolarHBondContact CA-O 3.29Å; F2159-L2165 HydrophobicContact CD1-CB 4.02Å; F2159-L2165 HydrophobicContact CD1-CD1 4.19Å; F2159-L2165 HydrophobicContact CE1-CB 3.87Å; F2159-L2165 HydrophobicContact CE1-CD1 3.84Å; F2159-L2165 HydrophobicContact CE1-CG 4.44Å; F2159-L2165 HydrophobicContact CE2-CD1 4.41Å; F2159-L2165 HydrophobicContact CZ-CD1 3.96Å
2160	G	86.3	Confident	84.2	Confident	4.2 Å²	4.2	38.3 Å²	38.3	4%	0.043	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	173.2	171	0	0	0	0	0	112.8	Y2146 Y2162 G2163 Q2164 I2166	Y2146-G2160 WeakPolarHBondContact CD2-O 3.35Å; G2160-Y2162 PolarHBondContact O-N 2.88Å; G2160-Y2162 VanDerWaalsContact O-N 3.09Å; G2160-G2163 PolarHBondContact O-N 3.05Å; G2160-Q2164 PolarHBondContact N-O 2.93Å; G2160-I2166 VanDerWaalsContact CA-CD1 3.48Å
2161	S	82	Confident	84	Confident	40 Å²	40	38.3 Å²	38.3	28%	0.28	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-22.5	178.6	57.3	0	0	0	0	114.5	N2144	N2144-S2161 PolarHBondContact O-N 2.99Å; N2144-S2161 VanDerWaalsContact O-N 3.16Å
2162	Y	80.2	Confident	84.3	Confident	126.8 Å²	126.8	38 Å²	38	50%	0.497	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.3	5.4	178	-54.3	-75.8	0	0	0	113.6	G2160 Q2164 N2185 E2186 V2187	G2160-Y2162 PolarHBondContact O-N 2.88Å; G2160-Y2162 VanDerWaalsContact O-N 3.09Å; Y2162-Q2164 VanDerWaalsContact C-OE1 3.27Å; Y2162-Q2164 VanDerWaalsContact CB-OE1 3.29Å; Y2162-Q2164 PolarHBondContact O-N 3.22Å; Y2162-N2185 VanDerWaalsContact CD2-O 3.26Å; Y2162-N2185 WeakPolarHBondContact CD2-O 3.38Å; Y2162-N2185 VanDerWaalsContact CE2-O 3.29Å; Y2162-N2185 WeakPolarHBondContact CE2-O 3.36Å; Y2162-E2186 HydrophobicContact CE2-CG 4.46Å; Y2162-V2187 HydrophobicContact CD1-CG1 3.72Å; Y2162-V2187 HydrophobicContact CD1-CG2 3.82Å; Y2162-V2187 VanDerWaalsContact CD1-CG2 3.41Å; Y2162-V2187 HydrophobicContact CD2-CB 4.19Å; Y2162-V2187 HydrophobicContact CD2-CG1 3.52Å; Y2162-V2187 HydrophobicContact CD2-CG2 3.59Å; Y2162-V2187 HydrophobicContact CE1-CG1 4.13Å; Y2162-V2187 HydrophobicContact CE1-CG2 4.11Å; Y2162-V2187 HydrophobicContact CE2-CB 4.32Å; Y2162-V2187 HydrophobicContact CE2-CG1 3.97Å; Y2162-V2187 HydrophobicContact CE2-CG2 3.33Å; Y2162-V2187 HydrophobicContact CG-CB 4.49Å; Y2162-V2187 HydrophobicContact CG-CG1 3.38Å; Y2162-V2187 HydrophobicContact CG-CG2 4.1Å; Y2162-V2187 WeakPolarHBondContact O-CG2 3.27Å
2163	G	85.9	Confident	84.7	Confident	9.6 Å²	9.6	33.8 Å²	33.8	10%	0.099	19%	0.188	C	C	.	.	S	Bend	trans	89	7	174.6	0	0	0	0	0	116.3	Y1635 F2159 G2160	Y1635-G2163 PolarHBondContact N-O 3.02Å; Y1635-G2163 VanDerWaalsContact O-CA 3.25Å; Y1635-G2163 WeakPolarHBondContact O-CA 3.3Å; F2159-G2163 VanDerWaalsContact CD1-O 3.31Å; F2159-G2163 WeakPolarHBondContact CD1-O 3.31Å; G2160-G2163 PolarHBondContact O-N 3.05Å
2164	Q	87.3	Confident	84.8	Confident	21.8 Å²	21.8	37 Å²	37	10%	0.102	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	-77.5	138.2	171.9	58	-78.2	16.2	0	0	111.4	F2159 G2160 Y2162 I2166 Y2182 N2185 E2186	F2159-Q2164 CarbonylContact C-O 3.56Å; F2159-Q2164 VanDerWaalsContact CA-O 3.23Å; F2159-Q2164 WeakPolarHBondContact CA-O 3.29Å; G2160-Q2164 PolarHBondContact N-O 2.93Å; Y2162-Q2164 VanDerWaalsContact C-OE1 3.27Å; Y2162-Q2164 VanDerWaalsContact CB-OE1 3.29Å; Y2162-Q2164 PolarHBondContact O-N 3.22Å; Q2164-I2166 PolarHBondContact O-N 3.07Å; Q2164-Y2182 HydrophobicContact CB-CE1 4.19Å; Q2164-Y2182 HydrophobicContact CB-CE2 4.16Å; Q2164-Y2182 HydrophobicContact CG-CD2 4.15Å; Q2164-Y2182 HydrophobicContact CG-CE1 4.44Å; Q2164-Y2182 HydrophobicContact CG-CE2 4.03Å; Q2164-Y2182 HydrophobicContact CG-CG 4.5Å; Q2164-N2185 PolarHBondContact NE2-OD1 3.02Å; Q2164-E2186 PolarHBondContact NE2-O 2.98Å
2165	L	90.9	Very high	84.8	Confident	7.4 Å²	7.4	38.8 Å²	38.8	4%	0.039	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	122.7	179	-179.3	67.7	0	0	0	110.8	I1631 L1632 H1633 D2157 F2159 L2180 Y2182	I1631-L2165 WeakPolarHBondContact O-CD2 3.3Å; L1632-L2165 HydrophobicContact CD1-CB 4.44Å; H1633-L2165 HydrophobicContact CB-CD2 4.2Å; H1633-L2165 WeakPolarHBondContact O-CB 3.32Å; D2157-L2165 HydrophobicContact CB-CD1 3.64Å; F2159-L2165 HydrophobicContact CD1-CB 4.02Å; F2159-L2165 HydrophobicContact CD1-CD1 4.19Å; F2159-L2165 HydrophobicContact CE1-CB 3.87Å; F2159-L2165 HydrophobicContact CE1-CD1 3.84Å; F2159-L2165 HydrophobicContact CE1-CG 4.44Å; F2159-L2165 HydrophobicContact CE2-CD1 4.41Å; F2159-L2165 HydrophobicContact CZ-CD1 3.96Å; L2165-L2180 HydrophobicContact CB-CD1 4.48Å; L2165-L2180 HydrophobicContact CB-CD2 4.23Å; L2165-L2180 HydrophobicContact CD2-CD1 3.87Å; L2165-L2180 HydrophobicContact CD2-CD2 4.27Å; L2165-L2180 HydrophobicContact CG-CD1 3.87Å; L2165-L2180 HydrophobicContact CG-CD2 4.06Å; L2165-L2180 WeakPolarHBondContact O-CB 3.44Å; L2165-Y2182 PolarHBondContact N-OH 3.11Å; L2165-Y2182 VanDerWaalsContact O-CE2 3.22Å; L2165-Y2182 WeakPolarHBondContact O-CE2 3.33Å; L2165-Y2182 PolarHBondContact O-OH 3.19Å; L2165-Y2182 VanDerWaalsContact O-OH 3.13Å
2166	I	89.9	Confident	84.7	Confident	61.2 Å²	61.2	37.8 Å²	37.8	31%	0.314	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	-44.6	179.6	-63.4	169.9	0	0	0	110.9	T2145 S2158 G2160 Q2164 R2179 L2180	T2145-I2166 HydrophobicContact CG2-CD1 3.7Å; T2145-I2166 VanDerWaalsContact CG2-CD1 3.5Å; S2158-I2166 WeakPolarHBondContact O-CA 3.37Å; S2158-I2166 WeakPolarHBondContact O-CB 3.29Å; S2158-I2166 PolarHBondContact O-N 3.01Å; G2160-I2166 VanDerWaalsContact CA-CD1 3.48Å; Q2164-I2166 PolarHBondContact O-N 3.07Å; I2166-R2179 CarbonylContact O-C 3.5Å; I2166-R2179 WeakPolarHBondContact O-CA 3.31Å; I2166-L2180 PolarHBondContact O-N 3.07Å
2167	S	90.9	Very high	84.4	Confident	12.2 Å²	12.2	39 Å²	39	9%	0.085	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	151.6	-179.1	58.3	0	0	0	0	112.2	S2158 E2169 H2178	S2158-S2167 WeakPolarHBondContact CB-OG 3.17Å; S2158-S2167 PolarHBondContact N-O 3.01Å; S2158-S2167 PolarHBondContact O-N 2.99Å; S2167-E2169 PolarHBondContact OG-OE1 2.98Å; S2167-H2178 VanDerWaalsContact CA-O 3.29Å; S2167-H2178 WeakPolarHBondContact CA-O 3.34Å
2168	T	91.4	Very high	84.2	Confident	3.8 Å²	3.8	40.1 Å²	40.1	2%	0.023	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	131.5	168.8	-56.7	0	0	0	0	108.8	E2155 I2156 D2157 I2176 S2177 H2178	E2155-T2168 HydrophobicContact CB-CG2 4.02Å; E2155-T2168 HydrophobicContact CG-CG2 4.1Å; I2156-T2168 CarbonylContact O-C 3.53Å; I2156-T2168 VanDerWaalsContact O-CA 3.31Å; I2156-T2168 WeakPolarHBondContact O-CA 3.36Å; D2157-T2168 VanDerWaalsContact OD1-CB 3.31Å; D2157-T2168 WeakPolarHBondContact OD1-CB 3.3Å; D2157-T2168 VanDerWaalsContact OD1-CG2 3.23Å; D2157-T2168 WeakPolarHBondContact OD1-CG2 3.32Å; D2157-T2168 PolarHBondContact OD1-OG1 3.17Å; T2168-I2176 CarbonylContact O-C 3.48Å; T2168-I2176 WeakPolarHBondContact O-CA 3.45Å; T2168-I2176 WeakPolarHBondContact O-CG2 3.37Å; T2168-S2177 PolarHBondContact O-N 3.19Å; T2168-S2177 PolarHBondContact O-OG 3.04Å; T2168-S2177 VanDerWaalsContact O-OG 3.11Å; T2168-H2178 WeakPolarHBondContact CB-CE1 3.38Å; T2168-H2178 PolarHBondContact N-O 3.08Å; T2168-H2178 VanDerWaalsContact N-O 3.1Å; T2168-H2178 PolarHBondContact O-N 3.11Å; T2168-H2178 PolarHBondContact OG1-CE1 3.05Å; T2168-H2178 VanDerWaalsContact OG1-CE1 3.27Å; T2168-H2178 PolarHBondContact OG1-NE2 2.97Å
2169	E	87.1	Confident	84.2	Confident	25.2 Å²	25.2	42.9 Å²	42.9	12%	0.118	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	147.4	-179.8	24.9	-178.6	-173.8	0	0	110	R2147 E2155 I2156 S2167 T2171 M2175 I2176	R2147-E2169 IonicContact CZ-OE1 3.52Å; R2147-E2169 IonicContact CZ-OE2 2.83Å; R2147-E2169 IonicContact NE-OE1 3.28Å; R2147-E2169 PolarHBondContact NE-OE1 3Å; R2147-E2169 IonicContact NH2-OE1 3.24Å; R2147-E2169 PolarHBondContact NH2-OE1 2.98Å; R2147-E2169 IonicContact NH2-OE2 3.27Å; R2147-E2169 PolarHBondContact NH2-OE2 2.97Å; E2155-E2169 CarbonylContact C-O 3.55Å; E2155-E2169 VanDerWaalsContact CA-O 3.28Å; E2155-E2169 WeakPolarHBondContact CA-O 3.42Å; I2156-E2169 HydrophobicContact CB-CB 4.38Å; I2156-E2169 HydrophobicContact CB-CG 3.63Å; I2156-E2169 HydrophobicContact CD1-CG 4.37Å; I2156-E2169 WeakPolarHBondContact CD1-OE1 3.49Å; I2156-E2169 HydrophobicContact CG1-CG 4.33Å; I2156-E2169 HydrophobicContact CG2-CG 4.19Å; I2156-E2169 WeakPolarHBondContact CG2-OE1 3.24Å; I2156-E2169 PolarHBondContact N-O 3.17Å; I2156-E2169 PolarHBondContact O-N 3.04Å; S2167-E2169 PolarHBondContact OG-OE1 2.98Å; E2169-T2171 PolarHBondContact O-N 2.81Å; E2169-M2175 WeakPolarHBondContact CA-O 3.32Å; E2169-I2176 HydrophobicContact CB-CG1 3.99Å; E2169-I2176 HydrophobicContact CG-CB 4.35Å; E2169-I2176 HydrophobicContact CG-CG1 3.74Å
2170	S	81.1	Confident	84.2	Confident	27 Å²	27	42.9 Å²	42.9	19%	0.189	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	130.5	170.6	157.2	0	0	0	0	109.3	D2154 S2172 T2173 Q2174 M2175	D2154-S2170 VanDerWaalsContact O-CA 3.29Å; D2154-S2170 WeakPolarHBondContact O-CA 3.43Å; D2154-S2170 PolarHBondContact OD2-OG 2.77Å; S2170-S2172 VanDerWaalsContact C-N 3.35Å; S2170-S2172 PolarHBondContact O-N 3.01Å; S2170-S2172 PolarHBondContact OG-N 3.05Å; S2170-S2172 PolarHBondContact OG-OG 2.84Å; S2170-S2172 VanDerWaalsContact OG-OG 3.12Å; S2170-T2173 WeakPolarHBondContact CB-OG1 3.27Å; S2170-T2173 PolarHBondContact OG-N 2.91Å; S2170-T2173 VanDerWaalsContact OG-N 3.11Å; S2170-T2173 PolarHBondContact OG-OG1 2.95Å; S2170-T2173 VanDerWaalsContact OG-OG1 3.05Å; S2170-Q2174 WeakPolarHBondContact O-CA 3.42Å; S2170-Q2174 PolarHBondContact O-N 2.98Å; S2170-M2175 PolarHBondContact N-O 3.21Å
2171	T	75.7	Confident	84.3	Confident	23.2 Å²	23.2	45 Å²	45	14%	0.142	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-41.1	177.2	46.7	0	0	0	0	111.9	L2149 D2154 I2156 E2169 T2173 Y2367 P2376	L2149-T2171 HydrophobicContact CD1-CG2 3.16Å; D2154-T2171 VanDerWaalsContact C-CG2 3.46Å; D2154-T2171 VanDerWaalsContact C-OG1 3.26Å; D2154-T2171 WeakPolarHBondContact CA-OG1 3.35Å; D2154-T2171 PolarHBondContact O-N 3.02Å; D2154-T2171 PolarHBondContact O-OG1 3.11Å; D2154-T2171 PolarHBondContact OD1-OG1 2.97Å; D2154-T2171 PolarHBondContact OD2-OG1 3.18Å; D2154-T2171 VanDerWaalsContact OD2-OG1 3.07Å; I2156-T2171 HydrophobicContact CD1-CG2 3.86Å; I2156-T2171 HydrophobicContact CG1-CG2 3.47Å; I2156-T2171 VanDerWaalsContact CG1-CG2 3.42Å; E2169-T2171 PolarHBondContact O-N 2.81Å; T2171-T2173 PolarHBondContact O-N 2.88Å; T2171-Y2367 HydrophobicContact CG2-CE1 4.13Å; T2171-P2376 VanDerWaalsContact O-CD 3.29Å; T2171-P2376 WeakPolarHBondContact O-CD 3.44Å
2172	S	75.1	Confident	84.5	Confident	63 Å²	63	44.8 Å²	44.8	44%	0.441	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-38.9	-175.3	37	0	0	0	0	113.2	D2154 S2170 Y2500	D2154-S2172 WeakPolarHBondContact OD1-CB 3.14Å; D2154-S2172 PolarHBondContact OD1-N 3.47Å; D2154-S2172 PolarHBondContact OD1-OG 3.42Å; D2154-S2172 VanDerWaalsContact OD2-CB 3.26Å; D2154-S2172 WeakPolarHBondContact OD2-CB 3.26Å; D2154-S2172 PolarHBondContact OD2-OG 2.99Å; S2170-S2172 VanDerWaalsContact C-N 3.35Å; S2170-S2172 PolarHBondContact O-N 3.01Å; S2170-S2172 PolarHBondContact OG-N 3.05Å; S2170-S2172 PolarHBondContact OG-OG 2.84Å; S2170-S2172 VanDerWaalsContact OG-OG 3.12Å; S2172-Y2500 WeakPolarHBondContact O-CD2 3.39Å; S2172-Y2500 VanDerWaalsContact O-CE2 3.22Å; S2172-Y2500 WeakPolarHBondContact O-CE2 3.26Å
2173	T	76.6	Confident	84.5	Confident	57.4 Å²	57.4	44.9 Å²	44.9	35%	0.352	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-14.3	-177.3	64	0	0	0	0	113.9	S2170 T2171 M2175 W2518	S2170-T2173 WeakPolarHBondContact CB-OG1 3.27Å; S2170-T2173 PolarHBondContact OG-N 2.91Å; S2170-T2173 VanDerWaalsContact OG-N 3.11Å; S2170-T2173 PolarHBondContact OG-OG1 2.95Å; S2170-T2173 VanDerWaalsContact OG-OG1 3.05Å; T2171-T2173 PolarHBondContact O-N 2.88Å; T2173-M2175 HydrophobicContact CG2-CE 4.18Å; T2173-M2175 PolarHBondContact O-N 2.96Å; T2173-M2175 PolarHBondContact OG1-N 3.05Å; T2173-W2518 HydrophobicContact CG2-CH2 3.45Å; T2173-W2518 VanDerWaalsContact CG2-CH2 3.45Å; T2173-W2518 HydrophobicContact CG2-CZ2 3.72Å; T2173-W2518 WeakPolarHBondContact O-CZ2 3.3Å; T2173-W2518 PolarHBondContact O-NE1 2.92Å
2174	Q	75.9	Confident	83.7	Confident	132 Å²	132	49.4 Å²	49.4	62%	0.617	25%	0.253	S	S	*	.			trans	53.6	15	-170	-57.4	-177.2	-11.9	0	0	114.1	S2170 L2404 W2518	S2170-Q2174 WeakPolarHBondContact O-CA 3.42Å; S2170-Q2174 PolarHBondContact O-N 2.98Å; Q2174-L2404 HydrophobicContact CG-CD2 4.4Å; Q2174-W2518 HydrophobicContact CB-CH2 3.89Å; Q2174-W2518 HydrophobicContact CB-CZ2 3.7Å; Q2174-W2518 HydrophobicContact CG-CH2 4.42Å; Q2174-W2518 HydrophobicContact CG-CZ2 4.27Å
2175	M	79.4	Confident	82.6	Confident	98.4 Å²	98.4	54.3 Å²	54.3	49%	0.485	28%	0.279	S	S	.	.			trans	-85.1	139.8	175.7	-71.9	-167.4	-80.7	0	0	110.2	E2169 S2170 T2173 S2177 F2516 W2518 F2543	E2169-M2175 WeakPolarHBondContact CA-O 3.32Å; S2170-M2175 PolarHBondContact N-O 3.21Å; T2173-M2175 HydrophobicContact CG2-CE 4.18Å; T2173-M2175 PolarHBondContact O-N 2.96Å; T2173-M2175 PolarHBondContact OG1-N 3.05Å; M2175-S2177 PolarHBondContact O-N 3.12Å; M2175-F2516 HydrophobicContact CE-CD1 3.77Å; M2175-F2516 HydrophobicContact CE-CE1 3.2Å; M2175-F2516 HydrophobicContact CE-CE2 4.15Å; M2175-F2516 HydrophobicContact CE-CG 4.48Å; M2175-F2516 HydrophobicContact CE-CZ 3.44Å; M2175-F2516 VanDerWaalsContact CE-CZ 3.44Å; M2175-F2516 HydrophobicContact SD-CE1 3.98Å; M2175-F2516 HydrophobicContact SD-CZ 4.3Å; M2175-W2518 HydrophobicContact CE-CH2 3.93Å; M2175-W2518 HydrophobicContact CE-CZ3 3.63Å; M2175-F2543 HydrophobicContact CE-CD2 4.13Å; M2175-F2543 HydrophobicContact CE-CE2 3.73Å; M2175-F2543 VanDerWaalsContact CE-CE2 3.47Å; M2175-F2543 HydrophobicContact CE-CZ 4.19Å; M2175-F2543 HydrophobicContact SD-CD2 4.29Å; M2175-F2543 HydrophobicContact SD-CE2 4.27Å
2176	I	83.2	Confident	81.4	Confident	35 Å²	35	59 Å²	59	18%	0.179	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	115.8	178.8	-64.9	175.6	0	0	0	108.3	T2168 E2169 H2178 R2179 D2197	T2168-I2176 CarbonylContact O-C 3.48Å; T2168-I2176 WeakPolarHBondContact O-CA 3.45Å; T2168-I2176 WeakPolarHBondContact O-CG2 3.37Å; E2169-I2176 HydrophobicContact CB-CG1 3.99Å; E2169-I2176 HydrophobicContact CG-CB 4.35Å; E2169-I2176 HydrophobicContact CG-CG1 3.74Å; I2176-H2178 WeakPolarHBondContact CG2-O 3.42Å; I2176-R2179 VanDerWaalsContact CG1-NH2 3.3Å; I2176-R2179 HydrophobicContact CG2-CG 3.65Å; I2176-D2197 HydrophobicContact CB-CB 4.18Å; I2176-D2197 WeakPolarHBondContact CB-OD2 3.22Å; I2176-D2197 WeakPolarHBondContact O-CB 3.34Å
2177	S	81.4	Confident	80	Confident	50.8 Å²	50.8	59.7 Å²	59.7	36%	0.355	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	-41.6	177.8	65.6	0	0	0	0	110.6	T2168 M2175 G2196	T2168-S2177 PolarHBondContact O-N 3.19Å; T2168-S2177 PolarHBondContact O-OG 3.04Å; T2168-S2177 VanDerWaalsContact O-OG 3.11Å; M2175-S2177 PolarHBondContact O-N 3.12Å; S2177-G2196 WeakPolarHBondContact O-CA 3.3Å
2178	H	86.2	Confident	78.8	Confident	29.4 Å²	29.4	63 Å²	63	14%	0.136	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	150.3	177.3	41.8	-70.5	0	0	0	112.5	I1631 S2167 T2168 I2176 I2194 R2195	I1631-H2178 WeakPolarHBondContact CD1-NE2 3.19Å; S2167-H2178 VanDerWaalsContact CA-O 3.29Å; S2167-H2178 WeakPolarHBondContact CA-O 3.34Å; T2168-H2178 WeakPolarHBondContact CB-CE1 3.38Å; T2168-H2178 PolarHBondContact N-O 3.08Å; T2168-H2178 VanDerWaalsContact N-O 3.1Å; T2168-H2178 PolarHBondContact O-N 3.11Å; T2168-H2178 PolarHBondContact OG1-CE1 3.05Å; T2168-H2178 VanDerWaalsContact OG1-CE1 3.27Å; T2168-H2178 PolarHBondContact OG1-NE2 2.97Å; I2176-H2178 WeakPolarHBondContact CG2-O 3.42Å; H2178-I2194 HydrophobicContact CB-CG2 4.23Å; H2178-R2195 CarbonylContact C-O 3.48Å; H2178-R2195 WeakPolarHBondContact CA-O 3.28Å; H2178-R2195 WeakPolarHBondContact CB-O 3.42Å
2179	R	90.5	Very high	78	Confident	64 Å²	64	63.2 Å²	63.2	24%	0.242	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	145.9	169.8	-62.3	-168	-175.1	95.6	-2.1	110.4	I2166 I2176 I2194 R2195 D2197 F2440	I2166-R2179 CarbonylContact O-C 3.5Å; I2166-R2179 WeakPolarHBondContact O-CA 3.31Å; I2176-R2179 VanDerWaalsContact CG1-NH2 3.3Å; I2176-R2179 HydrophobicContact CG2-CG 3.65Å; R2179-I2194 CarbonylContact O-C 3.3Å; R2179-I2194 WeakPolarHBondContact O-CA 3.35Å; R2179-R2195 HydrophobicContact CB-CG 4.18Å; R2179-R2195 PolarHBondContact N-O 3.15Å; R2179-R2195 PolarHBondContact O-N 3.23Å; R2179-D2197 IonicContact CZ-OD1 3.4Å; R2179-D2197 VanDerWaalsContact CZ-OD1 3.29Å; R2179-D2197 IonicContact CZ-OD2 3.26Å; R2179-D2197 IonicContact NE-OD1 3.26Å; R2179-D2197 PolarHBondContact NE-OD1 2.56Å; R2179-D2197 VanDerWaalsContact NH1-CG 3.28Å; R2179-D2197 PolarHBondContact NH1-O 2.93Å; R2179-D2197 IonicContact NH1-OD1 3.36Å; R2179-D2197 PolarHBondContact NH1-OD1 2.91Å; R2179-D2197 IonicContact NH1-OD2 3.24Å; R2179-D2197 PolarHBondContact NH1-OD2 3.21Å; R2179-D2197 IonicContact NH2-OD1 3.21Å; R2179-D2197 PolarHBondContact NH2-OD1 3.06Å; R2179-D2197 VanDerWaalsContact NH2-OD1 3.09Å; R2179-D2197 IonicContact NH2-OD2 3.79Å; R2179-F2440 VanDerWaalsContact NH2-CZ 3.35Å
2180	L	90.3	Very high	77.7	Confident	8.8 Å²	8.8	65.3 Å²	65.3	5%	0.046	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	126	-179.4	-60.9	90	0	0	0	109.7	L1632 L2165 I2166 Y2182 L2191 Q2193 I2194	L1632-L2180 HydrophobicContact CD1-CD2 3.4Å; L1632-L2180 VanDerWaalsContact CD1-CD2 3.49Å; L2165-L2180 HydrophobicContact CB-CD1 4.48Å; L2165-L2180 HydrophobicContact CB-CD2 4.23Å; L2165-L2180 HydrophobicContact CD2-CD1 3.87Å; L2165-L2180 HydrophobicContact CD2-CD2 4.27Å; L2165-L2180 HydrophobicContact CG-CD1 3.87Å; L2165-L2180 HydrophobicContact CG-CD2 4.06Å; L2165-L2180 WeakPolarHBondContact O-CB 3.44Å; I2166-L2180 PolarHBondContact O-N 3.07Å; L2180-Y2182 HydrophobicContact CB-CE2 3.93Å; L2180-L2191 HydrophobicContact CB-CD1 3.78Å; L2180-L2191 HydrophobicContact CD2-CD1 3.9Å; L2180-L2191 HydrophobicContact CD2-CD2 4.42Å; L2180-L2191 HydrophobicContact CG-CD1 4.28Å; L2180-Q2193 WeakPolarHBondContact CA-O 3.26Å; L2180-I2194 HydrophobicContact CD2-CD1 4.45Å; L2180-I2194 HydrophobicContact CD2-CG1 4.29Å; L2180-I2194 HydrophobicContact CG-CG1 4.39Å
2181	D	88.8	Confident	78.1	Confident	49 Å²	49	64.4 Å²	64.4	26%	0.262	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	130.6	178.8	-58	-57.5	0	0	0	109.6	S2192 Q2193 R2195	D2181-S2192 VanDerWaalsContact C-OG 3.3Å; D2181-S2192 WeakPolarHBondContact O-CA 3.39Å; D2181-S2192 WeakPolarHBondContact O-CB 3.38Å; D2181-S2192 PolarHBondContact O-N 2.99Å; D2181-S2192 PolarHBondContact O-OG 3.04Å; D2181-S2192 VanDerWaalsContact O-OG 3.08Å; D2181-Q2193 HydrophobicContact CB-CB 4.34Å; D2181-Q2193 PolarHBondContact N-O 3.07Å; D2181-Q2193 PolarHBondContact O-N 3.08Å; D2181-Q2193 VanDerWaalsContact O-N 3.16Å; D2181-R2195 IonicContact OD1-CZ 3.62Å; D2181-R2195 IonicContact OD1-NE 3.12Å; D2181-R2195 PolarHBondContact OD1-NE 2.82Å; D2181-R2195 IonicContact OD1-NH2 3.37Å; D2181-R2195 PolarHBondContact OD1-NH2 3.29Å; D2181-R2195 VanDerWaalsContact OD1-NH2 3.08Å; D2181-R2195 WeakPolarHBondContact OD2-CD 3.27Å; D2181-R2195 IonicContact OD2-CZ 3.47Å; D2181-R2195 IonicContact OD2-NE 3.16Å; D2181-R2195 PolarHBondContact OD2-NE 3.06Å; D2181-R2195 IonicContact OD2-NH2 3.25Å; D2181-R2195 PolarHBondContact OD2-NH2 3.12Å
2182	Y	86.8	Confident	78.7	Confident	34.8 Å²	34.8	65.3 Å²	65.3	14%	0.136	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	149.2	-179.3	-62.9	-98.2	0	0	0	111.4	S1621 L1632 Q2164 L2165 L2180 N2184 N2185 G2189 W2190 L2191	S1621-Y2182 WeakPolarHBondContact OG-CE1 3.48Å; L1632-Y2182 VanDerWaalsContact CD1-OH 3.31Å; L1632-Y2182 WeakPolarHBondContact CD1-OH 3.21Å; Q2164-Y2182 HydrophobicContact CB-CE1 4.19Å; Q2164-Y2182 HydrophobicContact CB-CE2 4.16Å; Q2164-Y2182 HydrophobicContact CG-CD2 4.15Å; Q2164-Y2182 HydrophobicContact CG-CE1 4.44Å; Q2164-Y2182 HydrophobicContact CG-CE2 4.03Å; Q2164-Y2182 HydrophobicContact CG-CG 4.5Å; L2165-Y2182 PolarHBondContact N-OH 3.11Å; L2165-Y2182 VanDerWaalsContact O-CE2 3.22Å; L2165-Y2182 WeakPolarHBondContact O-CE2 3.33Å; L2165-Y2182 PolarHBondContact O-OH 3.19Å; L2165-Y2182 VanDerWaalsContact O-OH 3.13Å; L2180-Y2182 HydrophobicContact CB-CE2 3.93Å; Y2182-N2184 PolarHBondContact O-N 2.85Å; Y2182-N2185 PolarHBondContact O-N 3.1Å; Y2182-N2185 VanDerWaalsContact O-N 3.13Å; Y2182-N2185 PolarHBondContact O-OD1 3.03Å; Y2182-G2189 WeakPolarHBondContact CD1-O 3.3Å; Y2182-W2190 CarbonylContact C-O 3.54Å; Y2182-W2190 WeakPolarHBondContact CA-O 3.32Å; Y2182-L2191 HydrophobicContact CD1-CB 4.24Å; Y2182-L2191 HydrophobicContact CD1-CD1 4.38Å; Y2182-L2191 HydrophobicContact CE1-CB 4.05Å; Y2182-L2191 HydrophobicContact CE1-CD1 4.11Å; Y2182-L2191 HydrophobicContact CE2-CD1 4.36Å
2183	R	79.8	Confident	79.4	Confident	129.8 Å²	129.8	64.4 Å²	64.4	49%	0.49	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	114.9	171.3	-171.4	177.9	-177.6	-179.9	0.2	109.7	N2185 E2186 G2189 W2190 D2208	R2183-N2185 PolarHBondContact O-N 2.93Å; R2183-E2186 PolarHBondContact O-N 2.88Å; R2183-G2189 CarbonylContact O-C 3.53Å; R2183-G2189 VanDerWaalsContact O-CA 3.26Å; R2183-G2189 WeakPolarHBondContact O-CA 3.32Å; R2183-W2190 PolarHBondContact N-O 3.37Å; R2183-W2190 PolarHBondContact O-N 2.99Å; R2183-W2190 VanDerWaalsContact O-N 3.1Å; R2183-D2208 PolarHBondContact NH1-O 2.82Å
2184	N	69.6	Low	80.1	Confident	103.8 Å²	103.8	62.3 Å²	62.3	56%	0.555	32%	0.316	S	S	*	.	S	Bend	trans	69.1	108.5	-174	-57.3	-8.9	0	0	0	112.3	Y2182 E2186 G2189	Y2182-N2184 PolarHBondContact O-N 2.85Å; N2184-E2186 VanDerWaalsContact C-N 3.34Å; N2184-E2186 HydrophobicContact CB-CB 4.33Å; N2184-E2186 HydrophobicContact CB-CG 3.71Å; N2184-E2186 WeakPolarHBondContact CB-OE1 3.06Å; N2184-E2186 PolarHBondContact ND2-OE1 2.91Å; N2184-E2186 PolarHBondContact O-N 3.1Å; N2184-E2186 VanDerWaalsContact O-N 3.15Å; N2184-G2189 WeakPolarHBondContact O-CA 3.39Å
2185	N	64.5	Low	80.6	Confident	123.8 Å²	123.8	59 Å²	59	66%	0.662	30%	0.298	S	S	*	.	S	Bend	trans	-69	54.2	-177.4	-89.4	-1.8	0	0	0	112.3	Y2162 Q2164 Y2182 R2183	Y2162-N2185 VanDerWaalsContact CD2-O 3.26Å; Y2162-N2185 WeakPolarHBondContact CD2-O 3.38Å; Y2162-N2185 VanDerWaalsContact CE2-O 3.29Å; Y2162-N2185 WeakPolarHBondContact CE2-O 3.36Å; Q2164-N2185 PolarHBondContact NE2-OD1 3.02Å; Y2182-N2185 PolarHBondContact O-N 3.1Å; Y2182-N2185 VanDerWaalsContact O-N 3.13Å; Y2182-N2185 PolarHBondContact O-OD1 3.03Å; R2183-N2185 PolarHBondContact O-N 2.93Å
2186	E	64.4	Low	80.6	Confident	106 Å²	106	54.8 Å²	54.8	50%	0.495	28%	0.28	S	S	.	.	S	Bend	trans	-122	162.8	178.1	-67.7	178	-175	0	0	109.9	Y2162 Q2164 R2183 N2184 S2188 G2189	Y2162-E2186 HydrophobicContact CE2-CG 4.46Å; Q2164-E2186 PolarHBondContact NE2-O 2.98Å; R2183-E2186 PolarHBondContact O-N 2.88Å; N2184-E2186 VanDerWaalsContact C-N 3.34Å; N2184-E2186 HydrophobicContact CB-CB 4.33Å; N2184-E2186 HydrophobicContact CB-CG 3.71Å; N2184-E2186 WeakPolarHBondContact CB-OE1 3.06Å; N2184-E2186 PolarHBondContact ND2-OE1 2.91Å; N2184-E2186 PolarHBondContact O-N 3.1Å; N2184-E2186 VanDerWaalsContact O-N 3.15Å; E2186-S2188 VanDerWaalsContact CB-OG 3.25Å; E2186-S2188 WeakPolarHBondContact CB-OG 3.18Å; E2186-S2188 PolarHBondContact O-N 3.08Å; E2186-S2188 VanDerWaalsContact O-N 3.15Å; E2186-S2188 PolarHBondContact OE2-OG 3.32Å; E2186-G2189 WeakPolarHBondContact O-CA 3.33Å; E2186-G2189 PolarHBondContact O-N 3.2Å
2187	V	61.8	Low	80.1	Confident	77.2 Å²	77.2	56.8 Å²	56.8	47%	0.468	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-32.8	176.3	-173.4	0	0	0	0	111.7	Y2162 G2189	Y2162-V2187 HydrophobicContact CD1-CG1 3.72Å; Y2162-V2187 HydrophobicContact CD1-CG2 3.82Å; Y2162-V2187 VanDerWaalsContact CD1-CG2 3.41Å; Y2162-V2187 HydrophobicContact CD2-CB 4.19Å; Y2162-V2187 HydrophobicContact CD2-CG1 3.52Å; Y2162-V2187 HydrophobicContact CD2-CG2 3.59Å; Y2162-V2187 HydrophobicContact CE1-CG1 4.13Å; Y2162-V2187 HydrophobicContact CE1-CG2 4.11Å; Y2162-V2187 HydrophobicContact CE2-CB 4.32Å; Y2162-V2187 HydrophobicContact CE2-CG1 3.97Å; Y2162-V2187 HydrophobicContact CE2-CG2 3.33Å; Y2162-V2187 HydrophobicContact CG-CB 4.49Å; Y2162-V2187 HydrophobicContact CG-CG1 3.38Å; Y2162-V2187 HydrophobicContact CG-CG2 4.1Å; Y2162-V2187 WeakPolarHBondContact O-CG2 3.27Å; V2187-G2189 VanDerWaalsContact C-N 3.32Å; V2187-G2189 PolarHBondContact O-N 3.34Å
2188	S	65.8	Low	79.6	Confident	79.6 Å²	79.6	59 Å²	59	56%	0.557	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	6.4	177	50.1	0	0	0	0	113.9	E2186 W2190	E2186-S2188 VanDerWaalsContact CB-OG 3.25Å; E2186-S2188 WeakPolarHBondContact CB-OG 3.18Å; E2186-S2188 PolarHBondContact O-N 3.08Å; E2186-S2188 VanDerWaalsContact O-N 3.15Å; E2186-S2188 PolarHBondContact OE2-OG 3.32Å; S2188-W2190 PolarHBondContact O-N 2.94Å; S2188-W2190 PolarHBondContact O-NE1 2.83Å
2189	G	74.2	Confident	78.6	Confident	8.8 Å²	8.8	63.9 Å²	63.9	9%	0.091	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-67.2	140.2	179	0	0	0	0	0	112.4	Y2182 R2183 N2184 E2186 V2187	Y2182-G2189 WeakPolarHBondContact CD1-O 3.3Å; R2183-G2189 CarbonylContact O-C 3.53Å; R2183-G2189 VanDerWaalsContact O-CA 3.26Å; R2183-G2189 WeakPolarHBondContact O-CA 3.32Å; N2184-G2189 WeakPolarHBondContact O-CA 3.39Å; E2186-G2189 WeakPolarHBondContact O-CA 3.33Å; E2186-G2189 PolarHBondContact O-N 3.2Å; V2187-G2189 VanDerWaalsContact C-N 3.32Å; V2187-G2189 PolarHBondContact O-N 3.34Å
2190	W	81.4	Confident	77.5	Confident	70 Å²	70	63.8 Å²	63.8	27%	0.265	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	136.1	-178.4	-51.3	-26.6	0	0	0	111.7	D1623 Y2182 R2183 S2188 S2192 R2207 G2211	D1623-W2190 HydrophobicContact CB-CB 4.34Å; D1623-W2190 HydrophobicContact CB-CG 4.42Å; D1623-W2190 PolarHBondContact OD2-NE1 3.18Å; Y2182-W2190 CarbonylContact C-O 3.54Å; Y2182-W2190 WeakPolarHBondContact CA-O 3.32Å; R2183-W2190 PolarHBondContact N-O 3.37Å; R2183-W2190 PolarHBondContact O-N 2.99Å; R2183-W2190 VanDerWaalsContact O-N 3.1Å; S2188-W2190 PolarHBondContact O-N 2.94Å; S2188-W2190 PolarHBondContact O-NE1 2.83Å; W2190-S2192 PolarHBondContact O-N 3.14Å; W2190-S2192 VanDerWaalsContact O-N 3.13Å; W2190-R2207 VanDerWaalsContact CB-CZ 3.49Å; W2190-G2211 VanDerWaalsContact CZ2-CA 3.48Å; W2190-G2211 VanDerWaalsContact CZ3-CA 3.41Å
2191	L	87.9	Confident	76.7	Confident	8.2 Å²	8.2	65.6 Å²	65.6	4%	0.043	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	122.6	173.9	-178.3	67.1	0	0	0	110.5	D1623 L1629 L1632 L2180 Y2182 I2194 I2205 R2207	D1623-L2191 WeakPolarHBondContact OD2-CB 3.48Å; D1623-L2191 PolarHBondContact OD2-N 3.39Å; L1629-L2191 HydrophobicContact CD1-CD2 4.34Å; L1632-L2191 HydrophobicContact CD1-CD2 4.41Å; L1632-L2191 HydrophobicContact CD2-CD2 4.1Å; L2180-L2191 HydrophobicContact CB-CD1 3.78Å; L2180-L2191 HydrophobicContact CD2-CD1 3.9Å; L2180-L2191 HydrophobicContact CD2-CD2 4.42Å; L2180-L2191 HydrophobicContact CG-CD1 4.28Å; Y2182-L2191 HydrophobicContact CD1-CB 4.24Å; Y2182-L2191 HydrophobicContact CD1-CD1 4.38Å; Y2182-L2191 HydrophobicContact CE1-CB 4.05Å; Y2182-L2191 HydrophobicContact CE1-CD1 4.11Å; Y2182-L2191 HydrophobicContact CE2-CD1 4.36Å; L2191-I2194 HydrophobicContact CD1-CG1 4.23Å; L2191-I2194 HydrophobicContact CD2-CD1 4.04Å; L2191-I2194 HydrophobicContact CD2-CG1 4.04Å; L2191-I2194 HydrophobicContact CG-CG1 4.48Å; L2191-I2205 HydrophobicContact CB-CD1 4.4Å; L2191-I2205 HydrophobicContact CD2-CD1 3.88Å; L2191-I2205 HydrophobicContact CG-CD1 3.91Å; L2191-I2205 WeakPolarHBondContact O-CB 3.43Å; L2191-R2207 PolarHBondContact O-NH1 3.06Å; L2191-R2207 PolarHBondContact O-NH2 3.12Å
2192	S	88.6	Confident	76.5	Confident	41.2 Å²	41.2	67.5 Å²	67.5	29%	0.288	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	-35.8	-176.9	69.9	0	0	0	0	113.1	D2181 W2190 I2205	D2181-S2192 VanDerWaalsContact C-OG 3.3Å; D2181-S2192 WeakPolarHBondContact O-CA 3.39Å; D2181-S2192 WeakPolarHBondContact O-CB 3.38Å; D2181-S2192 PolarHBondContact O-N 2.99Å; D2181-S2192 PolarHBondContact O-OG 3.04Å; D2181-S2192 VanDerWaalsContact O-OG 3.08Å; W2190-S2192 PolarHBondContact O-N 3.14Å; W2190-S2192 VanDerWaalsContact O-N 3.13Å; S2192-I2205 PolarHBondContact O-N 3.04Å
2193	Q	90	Very high	76.6	Confident	44 Å²	44	67.4 Å²	67.4	21%	0.206	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	145.6	-176.9	-171	171.7	-0.4	0	0	111.6	L2180 D2181 R2195 K2202 L2203 S2204	L2180-Q2193 WeakPolarHBondContact CA-O 3.26Å; D2181-Q2193 HydrophobicContact CB-CB 4.34Å; D2181-Q2193 PolarHBondContact N-O 3.07Å; D2181-Q2193 PolarHBondContact O-N 3.08Å; D2181-Q2193 VanDerWaalsContact O-N 3.16Å; Q2193-R2195 HydrophobicContact CG-CB 4.4Å; Q2193-R2195 HydrophobicContact CG-CG 4.11Å; Q2193-K2202 HydrophobicContact CG-CB 4.01Å; Q2193-K2202 HydrophobicContact CG-CD 4.33Å; Q2193-K2202 VanDerWaalsContact NE2-CB 3.29Å; Q2193-L2203 CarbonylContact C-O 3.54Å; Q2193-L2203 VanDerWaalsContact CA-O 3.31Å; Q2193-L2203 WeakPolarHBondContact CA-O 3.29Å; Q2193-L2203 WeakPolarHBondContact CG-O 3.39Å; Q2193-S2204 PolarHBondContact NE2-OG 3.11Å; Q2193-S2204 VanDerWaalsContact NE2-OG 3.08Å
2194	I	90.7	Very high	77.2	Confident	13.2 Å²	13.2	61.7 Å²	61.7	7%	0.068	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	129.4	165.8	-54.1	176.2	0	0	0	107.3	L1514 L1629 I1631 H2178 R2179 L2180 L2191 I2201 K2202 L2203	L1514-I2194 HydrophobicContact CD1-CD1 4.24Å; L1629-I2194 HydrophobicContact CD1-CD1 3.51Å; L1629-I2194 VanDerWaalsContact CD1-CD1 3.47Å; I1631-I2194 HydrophobicContact CD1-CD1 4.07Å; I1631-I2194 HydrophobicContact CD1-CG2 4.01Å; I1631-I2194 HydrophobicContact CG1-CD1 4.49Å; H2178-I2194 HydrophobicContact CB-CG2 4.23Å; R2179-I2194 CarbonylContact O-C 3.3Å; R2179-I2194 WeakPolarHBondContact O-CA 3.35Å; L2180-I2194 HydrophobicContact CD2-CD1 4.45Å; L2180-I2194 HydrophobicContact CD2-CG1 4.29Å; L2180-I2194 HydrophobicContact CG-CG1 4.39Å; L2191-I2194 HydrophobicContact CD1-CG1 4.23Å; L2191-I2194 HydrophobicContact CD2-CD1 4.04Å; L2191-I2194 HydrophobicContact CD2-CG1 4.04Å; L2191-I2194 HydrophobicContact CG-CG1 4.48Å; I2194-I2201 HydrophobicContact CG2-CG2 3.93Å; I2194-K2202 CarbonylContact O-C 3.58Å; I2194-K2202 VanDerWaalsContact O-CA 3.26Å; I2194-K2202 WeakPolarHBondContact O-CA 3.24Å; I2194-L2203 HydrophobicContact CB-CB 4.35Å; I2194-L2203 HydrophobicContact CD1-CD2 4.26Å; I2194-L2203 PolarHBondContact N-O 3.21Å; I2194-L2203 PolarHBondContact O-N 3.13Å
2195	R	87.8	Confident	78.2	Confident	62.8 Å²	62.8	57.5 Å²	57.5	24%	0.237	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	145.1	-178.7	46.1	-176.5	-172.8	109.7	-0.6	112.3	H2178 R2179 D2181 Q2193 H2199 S2200 I2201 K2202	H2178-R2195 CarbonylContact C-O 3.48Å; H2178-R2195 WeakPolarHBondContact CA-O 3.28Å; H2178-R2195 WeakPolarHBondContact CB-O 3.42Å; R2179-R2195 HydrophobicContact CB-CG 4.18Å; R2179-R2195 PolarHBondContact N-O 3.15Å; R2179-R2195 PolarHBondContact O-N 3.23Å; D2181-R2195 IonicContact OD1-CZ 3.62Å; D2181-R2195 IonicContact OD1-NE 3.12Å; D2181-R2195 PolarHBondContact OD1-NE 2.82Å; D2181-R2195 IonicContact OD1-NH2 3.37Å; D2181-R2195 PolarHBondContact OD1-NH2 3.29Å; D2181-R2195 VanDerWaalsContact OD1-NH2 3.08Å; D2181-R2195 WeakPolarHBondContact OD2-CD 3.27Å; D2181-R2195 IonicContact OD2-CZ 3.47Å; D2181-R2195 IonicContact OD2-NE 3.16Å; D2181-R2195 PolarHBondContact OD2-NE 3.06Å; D2181-R2195 IonicContact OD2-NH2 3.25Å; D2181-R2195 PolarHBondContact OD2-NH2 3.12Å; Q2193-R2195 HydrophobicContact CG-CB 4.4Å; Q2193-R2195 HydrophobicContact CG-CG 4.11Å; R2195-H2199 PolarHBondContact NH1-CD2 3.12Å; R2195-H2199 PolarHBondContact NH1-CE1 3.09Å; R2195-H2199 PolarHBondContact NH1-ND1 2.97Å; R2195-H2199 PolarHBondContact NH1-NE2 3.3Å; R2195-H2199 VanDerWaalsContact NH1-NE2 3.18Å; R2195-S2200 CarbonylContact C-O 3.56Å; R2195-S2200 WeakPolarHBondContact CA-O 3.19Å; R2195-I2201 CarbonylContact C-O 3.54Å; R2195-I2201 VanDerWaalsContact CA-O 3.25Å; R2195-I2201 WeakPolarHBondContact CA-O 3.13Å; R2195-K2202 HydrophobicContact CB-CB 4.1Å
2196	G	79.7	Confident	79.5	Confident	9.6 Å²	9.6	55.3 Å²	55.3	10%	0.099	29%	0.291	C	S	.	.			trans	-81.2	173.2	165.9	0	0	0	0	0	111.9	S2177 D2198 H2199 S2200 I2201	S2177-G2196 WeakPolarHBondContact O-CA 3.3Å; G2196-D2198 VanDerWaalsContact C-N 3.31Å; G2196-D2198 PolarHBondContact O-N 2.86Å; G2196-H2199 WeakPolarHBondContact O-CA 3.49Å; G2196-H2199 PolarHBondContact O-N 3.1Å; G2196-S2200 PolarHBondContact N-O 3.42Å; G2196-I2201 PolarHBondContact N-O 2.69Å
2197	D	71.7	Confident	80.7	Confident	77.4 Å²	77.4	52.6 Å²	52.6	41%	0.414	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-33.1	176.5	-113.1	-0.5	0	0	0	112.6	I2176 R2179 H2199	I2176-D2197 HydrophobicContact CB-CB 4.18Å; I2176-D2197 WeakPolarHBondContact CB-OD2 3.22Å; I2176-D2197 WeakPolarHBondContact O-CB 3.34Å; R2179-D2197 IonicContact CZ-OD1 3.4Å; R2179-D2197 VanDerWaalsContact CZ-OD1 3.29Å; R2179-D2197 IonicContact CZ-OD2 3.26Å; R2179-D2197 IonicContact NE-OD1 3.26Å; R2179-D2197 PolarHBondContact NE-OD1 2.56Å; R2179-D2197 VanDerWaalsContact NH1-CG 3.28Å; R2179-D2197 PolarHBondContact NH1-O 2.93Å; R2179-D2197 IonicContact NH1-OD1 3.36Å; R2179-D2197 PolarHBondContact NH1-OD1 2.91Å; R2179-D2197 IonicContact NH1-OD2 3.24Å; R2179-D2197 PolarHBondContact NH1-OD2 3.21Å; R2179-D2197 IonicContact NH2-OD1 3.21Å; R2179-D2197 PolarHBondContact NH2-OD1 3.06Å; R2179-D2197 VanDerWaalsContact NH2-OD1 3.09Å; R2179-D2197 IonicContact NH2-OD2 3.79Å; D2197-H2199 VanDerWaalsContact C-N 3.32Å; D2197-H2199 PolarHBondContact O-N 3.03Å; D2197-H2199 PolarHBondContact O-ND1 3.32Å; D2197-H2199 VanDerWaalsContact O-ND1 3.11Å
2198	D	70.4	Confident	81.8	Confident	97.2 Å²	97.2	50.9 Å²	50.9	52%	0.52	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	19.4	177.1	86.1	-9.3	0	0	0	113.6	G2196 S2200 I2201 A2541 N2542	G2196-D2198 VanDerWaalsContact C-N 3.31Å; G2196-D2198 PolarHBondContact O-N 2.86Å; D2198-S2200 VanDerWaalsContact CG-CB 3.42Å; D2198-S2200 VanDerWaalsContact CG-OG 3.26Å; D2198-S2200 PolarHBondContact O-N 3.1Å; D2198-S2200 VanDerWaalsContact O-N 3.14Å; D2198-S2200 VanDerWaalsContact OD1-CB 3.29Å; D2198-S2200 WeakPolarHBondContact OD1-CB 3.34Å; D2198-S2200 PolarHBondContact OD1-N 3.07Å; D2198-S2200 PolarHBondContact OD1-OG 2.99Å; D2198-S2200 WeakPolarHBondContact OD2-CB 3.42Å; D2198-S2200 PolarHBondContact OD2-OG 3.05Å; D2198-I2201 PolarHBondContact O-N 2.78Å; D2198-A2541 HydrophobicContact CB-CB 3.78Å; D2198-N2542 VanDerWaalsContact CG-CG 3.45Å; D2198-N2542 PolarHBondContact OD1-ND2 3.34Å; D2198-N2542 PolarHBondContact OD1-OD1 2.92Å; D2198-N2542 PolarHBondContact OD2-ND2 2.72Å; D2198-N2542 PolarHBondContact OD2-OD1 3.19Å
2199	H	65.4	Low	82.5	Confident	133.2 Å²	133.2	52.7 Å²	52.7	62%	0.617	27%	0.272	S	S	*	.	S	Bend	trans	46.3	0.8	-175.2	-62.9	-21.8	0	0	0	115.2	R2195 G2196 D2197 I2201	R2195-H2199 PolarHBondContact NH1-CD2 3.12Å; R2195-H2199 PolarHBondContact NH1-CE1 3.09Å; R2195-H2199 PolarHBondContact NH1-ND1 2.97Å; R2195-H2199 PolarHBondContact NH1-NE2 3.3Å; R2195-H2199 VanDerWaalsContact NH1-NE2 3.18Å; G2196-H2199 WeakPolarHBondContact O-CA 3.49Å; G2196-H2199 PolarHBondContact O-N 3.1Å; D2197-H2199 VanDerWaalsContact C-N 3.32Å; D2197-H2199 PolarHBondContact O-N 3.03Å; D2197-H2199 PolarHBondContact O-ND1 3.32Å; D2197-H2199 VanDerWaalsContact O-ND1 3.11Å; H2199-I2201 VanDerWaalsContact C-N 3.26Å; H2199-I2201 PolarHBondContact O-N 3.1Å
2200	S	67.8	Low	82.8	Confident	61.6 Å²	61.6	59.1 Å²	59.1	43%	0.431	30%	0.299	S	S	.	.	S	Bend	trans	-71.5	-23.2	178.3	70.6	0	0	0	0	111.9	R2195 G2196 D2198 N2542	R2195-S2200 CarbonylContact C-O 3.56Å; R2195-S2200 WeakPolarHBondContact CA-O 3.19Å; G2196-S2200 PolarHBondContact N-O 3.42Å; D2198-S2200 VanDerWaalsContact CG-CB 3.42Å; D2198-S2200 VanDerWaalsContact CG-OG 3.26Å; D2198-S2200 PolarHBondContact O-N 3.1Å; D2198-S2200 VanDerWaalsContact O-N 3.14Å; D2198-S2200 VanDerWaalsContact OD1-CB 3.29Å; D2198-S2200 WeakPolarHBondContact OD1-CB 3.34Å; D2198-S2200 PolarHBondContact OD1-N 3.07Å; D2198-S2200 PolarHBondContact OD1-OG 2.99Å; D2198-S2200 WeakPolarHBondContact OD2-CB 3.42Å; D2198-S2200 PolarHBondContact OD2-OG 3.05Å; S2200-N2542 PolarHBondContact OG-ND2 2.94Å; S2200-N2542 PolarHBondContact OG-OD1 3.26Å
2201	I	73.1	Confident	82.8	Confident	45.4 Å²	45.4	55.9 Å²	55.9	23%	0.233	29%	0.287	C	S	.	.	S	Bend	trans	-107.4	111.4	176.7	-57.1	178	0	0	0	108.5	L1514 I2194 R2195 G2196 D2198 H2199 P2219 N2542	L1514-I2201 HydrophobicContact CD1-CG2 3.99Å; L1514-I2201 HydrophobicContact CD2-CG2 4.39Å; L1514-I2201 HydrophobicContact CG-CG2 4.3Å; I2194-I2201 HydrophobicContact CG2-CG2 3.93Å; R2195-I2201 CarbonylContact C-O 3.54Å; R2195-I2201 VanDerWaalsContact CA-O 3.25Å; R2195-I2201 WeakPolarHBondContact CA-O 3.13Å; G2196-I2201 PolarHBondContact N-O 2.69Å; D2198-I2201 PolarHBondContact O-N 2.78Å; H2199-I2201 VanDerWaalsContact C-N 3.26Å; H2199-I2201 PolarHBondContact O-N 3.1Å; I2201-P2219 HydrophobicContact CG2-CB 3.63Å; I2201-P2219 HydrophobicContact CG2-CG 4.08Å; I2201-N2542 HydrophobicContact CD1-CB 3.83Å; I2201-N2542 HydrophobicContact CG1-CB 4.5Å
2202	K	84.7	Confident	82.7	Confident	90.2 Å²	90.2	57.6 Å²	57.6	39%	0.392	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	121.5	175.9	103.8	178.3	-178.5	177.8	0	111.9	Q2193 I2194 R2195 S2204 T2218 P2219	Q2193-K2202 HydrophobicContact CG-CB 4.01Å; Q2193-K2202 HydrophobicContact CG-CD 4.33Å; Q2193-K2202 VanDerWaalsContact NE2-CB 3.29Å; I2194-K2202 CarbonylContact O-C 3.58Å; I2194-K2202 VanDerWaalsContact O-CA 3.26Å; I2194-K2202 WeakPolarHBondContact O-CA 3.24Å; R2195-K2202 HydrophobicContact CB-CB 4.1Å; K2202-S2204 WeakPolarHBondContact CD-OG 3.42Å; K2202-T2218 CarbonylContact O-C 3.41Å; K2202-P2219 HydrophobicContact CB-CB 4.08Å; K2202-P2219 HydrophobicContact CB-CG 3.98Å; K2202-P2219 VanDerWaalsContact O-CA 3.28Å; K2202-P2219 WeakPolarHBondContact O-CA 3.32Å; K2202-P2219 VanDerWaalsContact O-CD 3.32Å; K2202-P2219 WeakPolarHBondContact O-CD 3.39Å; K2202-P2219 WeakPolarHBondContact O-CG 3.23Å; K2202-P2219 VanDerWaalsContact O-N 3.12Å
2203	L	89.9	Confident	82.8	Confident	31.8 Å²	31.8	56.1 Å²	56.1	17%	0.166	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	117.9	166.9	-178	74.6	0	0	0	107.9	I1509 L1514 L1629 Q2193 I2194 I2205 L2216 Q2217	I1509-L2203 HydrophobicContact CD1-CD1 4.42Å; I1509-L2203 HydrophobicContact CD1-CD2 3.9Å; I1509-L2203 HydrophobicContact CG2-CD1 4.09Å; L1514-L2203 HydrophobicContact CD1-CB 3.83Å; L1514-L2203 HydrophobicContact CD1-CD2 3.7Å; L1514-L2203 HydrophobicContact CD1-CG 4.33Å; L1629-L2203 HydrophobicContact CD1-CD2 3.82Å; L1629-L2203 HydrophobicContact CD2-CD2 4.41Å; Q2193-L2203 CarbonylContact C-O 3.54Å; Q2193-L2203 VanDerWaalsContact CA-O 3.31Å; Q2193-L2203 WeakPolarHBondContact CA-O 3.29Å; Q2193-L2203 WeakPolarHBondContact CG-O 3.39Å; I2194-L2203 HydrophobicContact CB-CB 4.35Å; I2194-L2203 HydrophobicContact CD1-CD2 4.26Å; I2194-L2203 PolarHBondContact N-O 3.21Å; I2194-L2203 PolarHBondContact O-N 3.13Å; L2203-I2205 HydrophobicContact CD2-CD1 4.45Å; L2203-I2205 HydrophobicContact CG-CD1 4.35Å; L2203-L2216 HydrophobicContact CD1-CB 4.15Å; L2203-Q2217 CarbonylContact C-O 3.51Å; L2203-Q2217 WeakPolarHBondContact CA-O 3.37Å; L2203-Q2217 WeakPolarHBondContact CD1-O 3.27Å
2204	S	91	Very high	82.8	Confident	11 Å²	11	57.9 Å²	57.9	8%	0.077	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	134.3	177.1	-50.7	0	0	0	0	110.6	Q2193 K2202 Q2217	Q2193-S2204 PolarHBondContact NE2-OG 3.11Å; Q2193-S2204 VanDerWaalsContact NE2-OG 3.08Å; K2202-S2204 WeakPolarHBondContact CD-OG 3.42Å; S2204-Q2217 PolarHBondContact N-O 3.12Å; S2204-Q2217 PolarHBondContact O-N 3Å
2205	I	92.3	Very high	82.8	Confident	15.6 Å²	15.6	62.7 Å²	62.7	8%	0.08	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	112.5	-176.6	-55.4	143.6	0	0	0	108	L1624 L2191 S2192 L2203 R2207 L2213 L2216	L1624-I2205 HydrophobicContact CD2-CG1 4.4Å; L1624-I2205 HydrophobicContact CD2-CG2 3.84Å; L2191-I2205 HydrophobicContact CB-CD1 4.4Å; L2191-I2205 HydrophobicContact CD2-CD1 3.88Å; L2191-I2205 HydrophobicContact CG-CD1 3.91Å; L2191-I2205 WeakPolarHBondContact O-CB 3.43Å; S2192-I2205 PolarHBondContact O-N 3.04Å; L2203-I2205 HydrophobicContact CD2-CD1 4.45Å; L2203-I2205 HydrophobicContact CG-CD1 4.35Å; I2205-R2207 HydrophobicContact CG2-CG 4.41Å; I2205-L2213 HydrophobicContact CG2-CD1 3.56Å; I2205-L2216 HydrophobicContact CB-CD2 4.28Å; I2205-L2216 HydrophobicContact CG1-CD2 3.91Å; I2205-L2216 HydrophobicContact CG2-CD2 3.97Å
2206	H	91.2	Very high	83	Confident	78.2 Å²	78.2	61 Å²	61	36%	0.362	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	126.6	-177.8	-62.4	-83.5	0	0	0	110.4	L2214 R2215 Q2217	H2206-L2214 WeakPolarHBondContact O-CA 3.44Å; H2206-L2214 WeakPolarHBondContact O-CB 3.32Å; H2206-L2214 PolarHBondContact O-N 2.99Å; H2206-R2215 HydrophobicContact CB-CB 4.18Å; H2206-R2215 HydrophobicContact CB-CG 3.6Å; H2206-R2215 PolarHBondContact N-O 3.13Å; H2206-R2215 PolarHBondContact O-N 2.98Å; H2206-R2215 VanDerWaalsContact O-N 3.09Å; H2206-Q2217 PolarHBondContact NE2-OE1 3.13Å; H2206-Q2217 VanDerWaalsContact NE2-OE1 3.11Å
2207	R	88.7	Confident	83.6	Confident	49.2 Å²	49.2	63.5 Å²	63.5	19%	0.186	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	157.7	-179.7	-67.2	175.3	-179.2	-80.4	-0.9	111.2	S1622 D1623 W2190 L2191 I2205 G2211 N2212 L2213	S1622-R2207 PolarHBondContact O-NH2 3.03Å; D1623-R2207 PolarHBondContact O-NH2 3.09Å; W2190-R2207 VanDerWaalsContact CB-CZ 3.49Å; L2191-R2207 PolarHBondContact O-NH1 3.06Å; L2191-R2207 PolarHBondContact O-NH2 3.12Å; I2205-R2207 HydrophobicContact CG2-CG 4.41Å; R2207-G2211 VanDerWaalsContact CD-O 3.23Å; R2207-G2211 WeakPolarHBondContact CD-O 3.4Å; R2207-G2211 PolarHBondContact NH1-O 3.22Å; R2207-N2212 CarbonylContact C-O 3.44Å; R2207-N2212 WeakPolarHBondContact CA-O 3.38Å; R2207-N2212 WeakPolarHBondContact CB-O 3.36Å; R2207-L2213 HydrophobicContact CG-CD1 4.44Å
2208	D	85.6	Confident	84.4	Confident	41.2 Å²	41.2	60.7 Å²	60.7	22%	0.22	30%	0.303	C	S	.	.			trans	-74.9	-175	170.7	75.2	4.2	0	0	0	112	R2183 H2210 G2211 N2212 L2214	R2183-D2208 PolarHBondContact NH1-O 2.82Å; D2208-H2210 VanDerWaalsContact C-N 3.27Å; D2208-H2210 PolarHBondContact O-N 3.15Å; D2208-H2210 WeakPolarHBondContact OD1-CA 3.38Å; D2208-H2210 WeakPolarHBondContact OD1-CB 3.33Å; D2208-H2210 PolarHBondContact OD1-N 3.09Å; D2208-H2210 IonicContact OD2-ND1 3.3Å; D2208-G2211 PolarHBondContact O-N 3.25Å; D2208-G2211 PolarHBondContact OD1-N 3.11Å; D2208-N2212 PolarHBondContact N-O 2.93Å; D2208-N2212 WeakPolarHBondContact OD1-CB 3.4Å; D2208-N2212 PolarHBondContact OD1-N 3.17Å; D2208-N2212 PolarHBondContact OD1-ND2 3.18Å; D2208-N2212 WeakPolarHBondContact OD2-CB 3.33Å; D2208-N2212 PolarHBondContact OD2-ND2 2.99Å; D2208-L2214 HydrophobicContact CB-CD1 3.93Å; D2208-L2214 HydrophobicContact CB-CD2 4.37Å; D2208-L2214 HydrophobicContact CB-CG 4.21Å
2209	T	81	Confident	84.8	Confident	116.2 Å²	116.2	58.7 Å²	58.7	71%	0.713	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-17.7	177.8	50.2	0	0	0	0	114
2210	H	80.8	Confident	85.5	Confident	144.6 Å²	144.6	55.8 Å²	55.8	67%	0.669	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-3.8	178.7	-56.3	100.5	0	0	0	112.7	D2208	D2208-H2210 VanDerWaalsContact C-N 3.27Å; D2208-H2210 PolarHBondContact O-N 3.15Å; D2208-H2210 WeakPolarHBondContact OD1-CA 3.38Å; D2208-H2210 WeakPolarHBondContact OD1-CB 3.33Å; D2208-H2210 PolarHBondContact OD1-N 3.09Å; D2208-H2210 IonicContact OD2-ND1 3.3Å
2211	G	80.7	Confident	86.1	Confident	1.2 Å²	1.2	54.5 Å²	54.5	1%	0.012	28%	0.284	C	S	.	.			trans	93.7	2.2	-179.4	0	0	0	0	0	114.9	W2190 R2207 D2208 L2213	W2190-G2211 VanDerWaalsContact CZ2-CA 3.48Å; W2190-G2211 VanDerWaalsContact CZ3-CA 3.41Å; R2207-G2211 VanDerWaalsContact CD-O 3.23Å; R2207-G2211 WeakPolarHBondContact CD-O 3.4Å; R2207-G2211 PolarHBondContact NH1-O 3.22Å; D2208-G2211 PolarHBondContact O-N 3.25Å; D2208-G2211 PolarHBondContact OD1-N 3.11Å; G2211-L2213 PolarHBondContact O-N 2.94Å
2212	N	86.1	Confident	86.7	Confident	44.2 Å²	44.2	54.9 Å²	54.9	24%	0.236	29%	0.285	C	S	.	.			trans	-70.1	135.1	179.1	-58.4	-52.9	0	0	0	110.7	R2207 D2208 L2214 L2228 G2233 Q2234	R2207-N2212 CarbonylContact C-O 3.44Å; R2207-N2212 WeakPolarHBondContact CA-O 3.38Å; R2207-N2212 WeakPolarHBondContact CB-O 3.36Å; D2208-N2212 PolarHBondContact N-O 2.93Å; D2208-N2212 WeakPolarHBondContact OD1-CB 3.4Å; D2208-N2212 PolarHBondContact OD1-N 3.17Å; D2208-N2212 PolarHBondContact OD1-ND2 3.18Å; D2208-N2212 WeakPolarHBondContact OD2-CB 3.33Å; D2208-N2212 PolarHBondContact OD2-ND2 2.99Å; N2212-L2214 PolarHBondContact O-N 3.25Å; N2212-L2228 HydrophobicContact CB-CD1 3.75Å; N2212-G2233 WeakPolarHBondContact OD1-CA 3.21Å; N2212-G2233 PolarHBondContact OD1-O 3.37Å; N2212-Q2234 VanDerWaalsContact OD1-CD 3.25Å; N2212-Q2234 VanDerWaalsContact OD1-CG 3.32Å; N2212-Q2234 WeakPolarHBondContact OD1-CG 3.33Å; N2212-Q2234 PolarHBondContact OD1-NE2 3.28Å; N2212-Q2234 VanDerWaalsContact OD1-NE2 3.08Å; N2212-Q2234 PolarHBondContact OD1-OE1 3.4Å
2213	L	89.5	Confident	86.9	Confident	11.2 Å²	11.2	53.6 Å²	53.6	6%	0.059	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	124.3	176.8	-178.7	62.7	0	0	0	111.3	L1624 I2205 R2207 G2211 L2216 V2226 L2228 I2236	L1624-L2213 HydrophobicContact CB-CD2 4.4Å; L1624-L2213 HydrophobicContact CD2-CD1 3.98Å; L1624-L2213 HydrophobicContact CD2-CD2 4Å; I2205-L2213 HydrophobicContact CG2-CD1 3.56Å; R2207-L2213 HydrophobicContact CG-CD1 4.44Å; G2211-L2213 PolarHBondContact O-N 2.94Å; L2213-L2216 HydrophobicContact CD1-CD2 3.92Å; L2213-L2216 HydrophobicContact CD1-CG 4.39Å; L2213-V2226 HydrophobicContact CD2-CB 4.45Å; L2213-V2226 HydrophobicContact CD2-CG1 4.1Å; L2213-V2226 HydrophobicContact CD2-CG2 4.01Å; L2213-V2226 HydrophobicContact CG-CB 4.25Å; L2213-V2226 HydrophobicContact CG-CG1 4.18Å; L2213-V2226 HydrophobicContact CG-CG2 4.07Å; L2213-L2228 HydrophobicContact CB-CD2 4.48Å; L2213-I2236 HydrophobicContact CD2-CD1 4.25Å; L2213-I2236 HydrophobicContact CD2-CG1 4.37Å
2214	L	90.1	Very high	87	Confident	80.4 Å²	80.4	53.7 Å²	53.7	42%	0.421	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	-48.7	177.9	-65.2	177.3	0	0	0	112.3	H2206 D2208 N2212 V2226	H2206-L2214 WeakPolarHBondContact O-CA 3.44Å; H2206-L2214 WeakPolarHBondContact O-CB 3.32Å; H2206-L2214 PolarHBondContact O-N 2.99Å; D2208-L2214 HydrophobicContact CB-CD1 3.93Å; D2208-L2214 HydrophobicContact CB-CD2 4.37Å; D2208-L2214 HydrophobicContact CB-CG 4.21Å; N2212-L2214 PolarHBondContact O-N 3.25Å; L2214-V2226 WeakPolarHBondContact O-CB 3.17Å; L2214-V2226 PolarHBondContact O-N 2.98Å
2215	R	91.7	Very high	87	Confident	114 Å²	114	56.3 Å²	56.3	43%	0.43	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	152.9	-175.6	-12.5	-179.9	148.4	170.6	1.2	112.6	H2206 Y2224 N2225	H2206-R2215 HydrophobicContact CB-CB 4.18Å; H2206-R2215 HydrophobicContact CB-CG 3.6Å; H2206-R2215 PolarHBondContact N-O 3.13Å; H2206-R2215 PolarHBondContact O-N 2.98Å; H2206-R2215 VanDerWaalsContact O-N 3.09Å; R2215-Y2224 CarbonylContact C-O 3.52Å; R2215-Y2224 VanDerWaalsContact CA-O 3.24Å; R2215-Y2224 WeakPolarHBondContact CA-O 3.26Å; R2215-Y2224 WeakPolarHBondContact CB-O 3.36Å; R2215-N2225 VanDerWaalsContact CD-OD1 3.29Å; R2215-N2225 WeakPolarHBondContact CD-OD1 3.22Å; R2215-N2225 WeakPolarHBondContact CG-OD1 3.34Å; R2215-N2225 PolarHBondContact NE-OD1 3.15Å; R2215-N2225 VanDerWaalsContact NE-OD1 3.1Å; R2215-N2225 PolarHBondContact NH2-OD1 3.01Å
2216	L	92.5	Very high	87	Confident	28 Å²	28	56.2 Å²	56.2	15%	0.147	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	132.7	168.9	-55.5	171.1	0	0	0	109.3	I1509 L1624 L2203 I2205 L2213 L2223 Y2224 V2226 L2239	I1509-L2216 HydrophobicContact CD1-CD1 4.36Å; L1624-L2216 HydrophobicContact CD2-CD2 4.25Å; L2203-L2216 HydrophobicContact CD1-CB 4.15Å; I2205-L2216 HydrophobicContact CB-CD2 4.28Å; I2205-L2216 HydrophobicContact CG1-CD2 3.91Å; I2205-L2216 HydrophobicContact CG2-CD2 3.97Å; L2213-L2216 HydrophobicContact CD1-CD2 3.92Å; L2213-L2216 HydrophobicContact CD1-CG 4.39Å; L2216-L2223 CarbonylContact O-C 3.54Å; L2216-L2223 WeakPolarHBondContact O-CA 3.28Å; L2216-Y2224 PolarHBondContact N-O 3.09Å; L2216-Y2224 PolarHBondContact O-N 3.02Å; L2216-V2226 HydrophobicContact CD1-CG2 4.44Å; L2216-V2226 HydrophobicContact CG-CG2 4.3Å; L2216-L2239 HydrophobicContact CD1-CD1 4.34Å
2217	Q	91.1	Very high	87.1	Confident	61 Å²	61	55.6 Å²	55.6	29%	0.285	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	117.9	178	-175.6	177	9.1	0	0	110.1	L2203 S2204 H2206 H2222 L2223	L2203-Q2217 CarbonylContact C-O 3.51Å; L2203-Q2217 WeakPolarHBondContact CA-O 3.37Å; L2203-Q2217 WeakPolarHBondContact CD1-O 3.27Å; S2204-Q2217 PolarHBondContact N-O 3.12Å; S2204-Q2217 PolarHBondContact O-N 3Å; H2206-Q2217 PolarHBondContact NE2-OE1 3.13Å; H2206-Q2217 VanDerWaalsContact NE2-OE1 3.11Å; Q2217-H2222 CarbonylContact C-O 3.58Å; Q2217-H2222 VanDerWaalsContact CA-O 3.3Å; Q2217-H2222 WeakPolarHBondContact CA-O 3.41Å; Q2217-L2223 HydrophobicContact CB-CD2 3.67Å; Q2217-L2223 HydrophobicContact CG-CD2 3.72Å; Q2217-L2223 HydrophobicContact CG-CG 4.36Å
2218	T	87.9	Confident	87.2	Confident	18.8 Å²	18.8	55.2 Å²	55.2	12%	0.115	30%	0.297	C	S	.	.			trans	-74.2	166	177.5	67	0	0	0	0	111.6	I1509 K1510 K2202 T2220 G2221 H2222 Y2224	I1509-T2218 HydrophobicContact CG2-CG2 3.93Å; K1510-T2218 WeakPolarHBondContact O-CG2 3.4Å; K2202-T2218 CarbonylContact O-C 3.41Å; T2218-T2220 VanDerWaalsContact C-N 3.26Å; T2218-T2220 PolarHBondContact O-N 3.12Å; T2218-T2220 VanDerWaalsContact O-N 3.15Å; T2218-T2220 PolarHBondContact OG1-OG1 3.08Å; T2218-G2221 WeakPolarHBondContact O-CA 3.42Å; T2218-G2221 PolarHBondContact O-N 3.01Å; T2218-G2221 VanDerWaalsContact O-N 3.09Å; T2218-G2221 PolarHBondContact OG1-N 3.37Å; T2218-H2222 HydrophobicContact CG2-CB 4.16Å; T2218-H2222 PolarHBondContact N-O 2.97Å; T2218-H2222 VanDerWaalsContact OG1-CB 3.31Å; T2218-H2222 WeakPolarHBondContact OG1-CB 3.24Å; T2218-H2222 PolarHBondContact OG1-N 3.05Å; T2218-H2222 PolarHBondContact OG1-O 3.32Å; T2218-Y2224 HydrophobicContact CG2-CD2 4.09Å; T2218-Y2224 HydrophobicContact CG2-CE2 3.69Å
2219	P	79.6	Confident	87.2	Confident	55.8 Å²	55.8	56 Å²	56	36%	0.362	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-29.2	175.9	-21.6	31.2	0	0	0	113.9	T1512 I2201 K2202 G2221	T1512-P2219 HydrophobicContact CG2-CG 4.39Å; I2201-P2219 HydrophobicContact CG2-CB 3.63Å; I2201-P2219 HydrophobicContact CG2-CG 4.08Å; K2202-P2219 HydrophobicContact CB-CB 4.08Å; K2202-P2219 HydrophobicContact CB-CG 3.98Å; K2202-P2219 VanDerWaalsContact O-CA 3.28Å; K2202-P2219 WeakPolarHBondContact O-CA 3.32Å; K2202-P2219 VanDerWaalsContact O-CD 3.32Å; K2202-P2219 WeakPolarHBondContact O-CD 3.39Å; K2202-P2219 WeakPolarHBondContact O-CG 3.23Å; K2202-P2219 VanDerWaalsContact O-N 3.12Å; P2219-G2221 PolarHBondContact O-N 3.23Å
2220	T	79.9	Confident	87.1	Confident	71.6 Å²	71.6	56.5 Å²	56.5	44%	0.439	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-4.2	176.3	57.6	0	0	0	0	113.4	D1511 T2218 H2222 H2586 N2605	D1511-T2220 HydrophobicContact CB-CG2 3.77Å; D1511-T2220 WeakPolarHBondContact OD2-CB 3.4Å; D1511-T2220 VanDerWaalsContact OD2-CG2 3.32Å; D1511-T2220 WeakPolarHBondContact OD2-CG2 3.3Å; D1511-T2220 PolarHBondContact OD2-OG1 2.83Å; T2218-T2220 VanDerWaalsContact C-N 3.26Å; T2218-T2220 PolarHBondContact O-N 3.12Å; T2218-T2220 VanDerWaalsContact O-N 3.15Å; T2218-T2220 PolarHBondContact OG1-OG1 3.08Å; T2220-H2222 PolarHBondContact OG1-CD2 2.93Å; T2220-H2222 VanDerWaalsContact OG1-CD2 3.26Å; T2220-H2222 PolarHBondContact OG1-CE1 3.02Å; T2220-H2222 PolarHBondContact OG1-ND1 3.42Å; T2220-H2222 VanDerWaalsContact OG1-ND1 3.16Å; T2220-H2586 WeakPolarHBondContact CG2-CE1 3.28Å; T2220-H2586 WeakPolarHBondContact CG2-NE2 3.36Å; T2220-N2605 PolarHBondContact O-ND2 2.99Å; T2220-N2605 VanDerWaalsContact O-ND2 3.1Å
2221	G	81	Confident	86.7	Confident	35.2 Å²	35.2	53.6 Å²	53.6	36%	0.363	31%	0.314	S	S	.	.			trans	89.1	4.1	179.3	0	0	0	0	0	115.1	T2218 P2219	T2218-G2221 WeakPolarHBondContact O-CA 3.42Å; T2218-G2221 PolarHBondContact O-N 3.01Å; T2218-G2221 VanDerWaalsContact O-N 3.09Å; T2218-G2221 PolarHBondContact OG1-N 3.37Å; P2219-G2221 PolarHBondContact O-N 3.23Å
2222	H	86	Confident	85.9	Confident	53 Å²	53	56.7 Å²	56.7	25%	0.245	34%	0.335	C	S	.	.			trans	-67.9	135.1	175	-65	-66.2	0	0	0	111.1	D1511 Q2217 T2218 T2220 Y2224 P2242 F2630	D1511-H2222 IonicContact OD2-CD2 2.99Å; D1511-H2222 PolarHBondContact OD2-CD2 3.35Å; D1511-H2222 IonicContact OD2-NE2 3.61Å; Q2217-H2222 CarbonylContact C-O 3.58Å; Q2217-H2222 VanDerWaalsContact CA-O 3.3Å; Q2217-H2222 WeakPolarHBondContact CA-O 3.41Å; T2218-H2222 HydrophobicContact CG2-CB 4.16Å; T2218-H2222 PolarHBondContact N-O 2.97Å; T2218-H2222 VanDerWaalsContact OG1-CB 3.31Å; T2218-H2222 WeakPolarHBondContact OG1-CB 3.24Å; T2218-H2222 PolarHBondContact OG1-N 3.05Å; T2218-H2222 PolarHBondContact OG1-O 3.32Å; T2220-H2222 PolarHBondContact OG1-CD2 2.93Å; T2220-H2222 VanDerWaalsContact OG1-CD2 3.26Å; T2220-H2222 PolarHBondContact OG1-CE1 3.02Å; T2220-H2222 PolarHBondContact OG1-ND1 3.42Å; T2220-H2222 VanDerWaalsContact OG1-ND1 3.16Å; H2222-Y2224 HydrophobicContact CB-CD2 4.41Å; H2222-Y2224 HydrophobicContact CB-CE2 4.14Å; H2222-P2242 HydrophobicContact CB-CB 3.65Å; H2222-P2242 HydrophobicContact CB-CG 3.83Å; H2222-F2630 AromaticContact CD2-CD1 3.81Å; H2222-F2630 AromaticContact CD2-CE1 3.41Å; H2222-F2630 VanDerWaalsContact CD2-CE1 3.41Å; H2222-F2630 WeakPolarHBondContact CD2-CE1 3.31Å; H2222-F2630 AromaticContact CD2-CZ 3.77Å; H2222-F2630 AromaticContact NE2-CD1 3.64Å; H2222-F2630 AromaticContact NE2-CE1 3.43Å; H2222-F2630 WeakPolarHBondContact NE2-CE1 2.81Å
2223	L	89.1	Confident	84.9	Confident	63.8 Å²	63.8	56.6 Å²	56.6	33%	0.334	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	108.6	-176.6	-68.5	171.8	0	0	0	110.9	L2216 Q2217 N2225 P2242	L2216-L2223 CarbonylContact O-C 3.54Å; L2216-L2223 WeakPolarHBondContact O-CA 3.28Å; Q2217-L2223 HydrophobicContact CB-CD2 3.67Å; Q2217-L2223 HydrophobicContact CG-CD2 3.72Å; Q2217-L2223 HydrophobicContact CG-CG 4.36Å; L2223-N2225 PolarHBondContact O-N 2.89Å; L2223-P2242 WeakPolarHBondContact O-CB 3.3Å; L2223-P2242 WeakPolarHBondContact O-CG 3.28Å
2224	Y	90.9	Very high	84.3	Confident	34.2 Å²	34.2	59.9 Å²	59.9	13%	0.134	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	108.9	170.6	-70.2	-98.2	0	0	0	109.1	I1509 K1510 R2215 L2216 T2218 H2222 L2239 V2240 D2241 P2242 W2248	I1509-Y2224 HydrophobicContact CG2-CE2 3.93Å; K1510-Y2224 WeakPolarHBondContact CB-OH 3.24Å; K1510-Y2224 WeakPolarHBondContact CG-OH 3.35Å; K1510-Y2224 PolarHBondContact N-OH 3.11Å; R2215-Y2224 CarbonylContact C-O 3.52Å; R2215-Y2224 VanDerWaalsContact CA-O 3.24Å; R2215-Y2224 WeakPolarHBondContact CA-O 3.26Å; R2215-Y2224 WeakPolarHBondContact CB-O 3.36Å; L2216-Y2224 PolarHBondContact N-O 3.09Å; L2216-Y2224 PolarHBondContact O-N 3.02Å; T2218-Y2224 HydrophobicContact CG2-CD2 4.09Å; T2218-Y2224 HydrophobicContact CG2-CE2 3.69Å; H2222-Y2224 HydrophobicContact CB-CD2 4.41Å; H2222-Y2224 HydrophobicContact CB-CE2 4.14Å; Y2224-L2239 HydrophobicContact CD1-CD1 4.38Å; Y2224-L2239 HydrophobicContact CD1-CD2 4.03Å; Y2224-L2239 HydrophobicContact CD1-CG 4.25Å; Y2224-L2239 HydrophobicContact CE1-CD2 4.1Å; Y2224-L2239 HydrophobicContact CG-CD2 3.91Å; Y2224-V2240 WeakPolarHBondContact CD1-O 3.22Å; Y2224-D2241 HydrophobicContact CE1-CB 4.22Å; Y2224-P2242 VanDerWaalsContact CD1-CD 3.44Å; Y2224-P2242 HydrophobicContact CD1-CG 4.42Å; Y2224-P2242 HydrophobicContact CD2-CG 4.09Å; Y2224-P2242 VanDerWaalsContact CE1-CD 3.44Å; Y2224-P2242 HydrophobicContact CE1-CG 4.19Å; Y2224-P2242 HydrophobicContact CE2-CG 3.96Å; Y2224-P2242 HydrophobicContact CG-CG 4.41Å; Y2224-W2248 HydrophobicContact CD1-CZ3 4.31Å; Y2224-W2248 AromaticContact CE1-CH2 3.97Å; Y2224-W2248 HydrophobicContact CE1-CH2 4.22Å; Y2224-W2248 AromaticContact CE1-CZ3 3.85Å; Y2224-W2248 HydrophobicContact CE1-CZ3 4.01Å
2225	N	91.4	Very high	84.2	Confident	65 Å²	65	58.4 Å²	58.4	35%	0.348	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	133.2	175.7	-69.4	-37.6	0	0	0	110	R2215 L2223 L2239 V2240	R2215-N2225 VanDerWaalsContact CD-OD1 3.29Å; R2215-N2225 WeakPolarHBondContact CD-OD1 3.22Å; R2215-N2225 WeakPolarHBondContact CG-OD1 3.34Å; R2215-N2225 PolarHBondContact NE-OD1 3.15Å; R2215-N2225 VanDerWaalsContact NE-OD1 3.1Å; R2215-N2225 PolarHBondContact NH2-OD1 3.01Å; L2223-N2225 PolarHBondContact O-N 2.89Å; N2225-L2239 WeakPolarHBondContact O-CA 3.28Å; N2225-V2240 HydrophobicContact CB-CB 4.3Å; N2225-V2240 HydrophobicContact CB-CG2 3.74Å; N2225-V2240 PolarHBondContact O-N 3.06Å
2226	V	92.5	Very high	84.2	Confident	13.2 Å²	13.2	54 Å²	54	8%	0.08	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	134.7	-177.9	-178.8	0	0	0	0	108.7	L2213 L2214 L2216 L2228 I2236 T2238 L2239	L2213-V2226 HydrophobicContact CD2-CB 4.45Å; L2213-V2226 HydrophobicContact CD2-CG1 4.1Å; L2213-V2226 HydrophobicContact CD2-CG2 4.01Å; L2213-V2226 HydrophobicContact CG-CB 4.25Å; L2213-V2226 HydrophobicContact CG-CG1 4.18Å; L2213-V2226 HydrophobicContact CG-CG2 4.07Å; L2214-V2226 WeakPolarHBondContact O-CB 3.17Å; L2214-V2226 PolarHBondContact O-N 2.98Å; L2216-V2226 HydrophobicContact CD1-CG2 4.44Å; L2216-V2226 HydrophobicContact CG-CG2 4.3Å; V2226-L2228 HydrophobicContact CG1-CD2 3.84Å; V2226-L2228 HydrophobicContact CG1-CG 4.43Å; V2226-I2236 HydrophobicContact CG1-CB 4.42Å; V2226-I2236 HydrophobicContact CG1-CD1 4.39Å; V2226-I2236 HydrophobicContact CG1-CG1 3.96Å; V2226-I2236 HydrophobicContact CG1-CG2 4.02Å; V2226-T2238 WeakPolarHBondContact CA-O 3.44Å; V2226-L2239 HydrophobicContact CG2-CD1 3.72Å
2227	T	92	Very high	84.2	Confident	66.6 Å²	66.6	54 Å²	54	41%	0.409	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	138.3	164.2	55.9	0	0	0	0	108.7	I2236 S2237 T2238	T2227-I2236 CarbonylContact O-C 3.58Å; T2227-S2237 VanDerWaalsContact C-OG 3.29Å; T2227-S2237 WeakPolarHBondContact O-CA 3.41Å; T2227-S2237 WeakPolarHBondContact O-CB 3.24Å; T2227-S2237 PolarHBondContact O-N 2.92Å; T2227-S2237 PolarHBondContact O-OG 2.99Å; T2227-S2237 VanDerWaalsContact O-OG 3.07Å; T2227-S2237 PolarHBondContact OG1-OG 2.79Å; T2227-T2238 WeakPolarHBondContact CB-OG1 3.07Å; T2227-T2238 WeakPolarHBondContact CG2-OG1 3.39Å; T2227-T2238 PolarHBondContact N-O 3.12Å; T2227-T2238 PolarHBondContact O-N 3.32Å; T2227-T2238 VanDerWaalsContact O-N 3.1Å; T2227-T2238 WeakPolarHBondContact OG1-CB 3.24Å; T2227-T2238 PolarHBondContact OG1-N 2.75Å; T2227-T2238 PolarHBondContact OG1-OG1 2.86Å; T2227-T2238 VanDerWaalsContact OG1-OG1 3.07Å
2228	L	90.9	Very high	84.3	Confident	39.4 Å²	39.4	52.4 Å²	52.4	21%	0.206	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	154.2	-179.7	-56.5	-179.6	0	0	0	111	A1625 N2212 L2213 V2226 Q2234 R2235 I2236 S2237	A1625-L2228 HydrophobicContact CB-CD2 3.65Å; N2212-L2228 HydrophobicContact CB-CD1 3.75Å; L2213-L2228 HydrophobicContact CB-CD2 4.48Å; V2226-L2228 HydrophobicContact CG1-CD2 3.84Å; V2226-L2228 HydrophobicContact CG1-CG 4.43Å; L2228-Q2234 HydrophobicContact CD1-CB 4.15Å; L2228-Q2234 HydrophobicContact CD1-CG 4.14Å; L2228-R2235 CarbonylContact C-O 3.53Å; L2228-R2235 VanDerWaalsContact CA-O 3.24Å; L2228-R2235 WeakPolarHBondContact CA-O 3.42Å; L2228-I2236 HydrophobicContact CD2-CG1 4.24Å; L2228-S2237 VanDerWaalsContact C-OG 3.22Å; L2228-S2237 PolarHBondContact O-OG 3.1Å; L2228-S2237 VanDerWaalsContact O-OG 3.1Å
2229	E	86.7	Confident	84.5	Confident	58 Å²	58	52.4 Å²	52.4	27%	0.271	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-66.4	131.9	172.5	-163.6	-178.9	-154.2	0	0	110.2	G2231 S2232 R2235 Y2252	E2229-G2231 PolarHBondContact O-N 2.81Å; E2229-S2232 VanDerWaalsContact CB-OG 3.31Å; E2229-S2232 WeakPolarHBondContact CB-OG 3.44Å; E2229-S2232 VanDerWaalsContact CD-OG 3.27Å; E2229-S2232 WeakPolarHBondContact CG-OG 3.41Å; E2229-S2232 PolarHBondContact O-N 3.05Å; E2229-S2232 PolarHBondContact O-OG 3.14Å; E2229-S2232 WeakPolarHBondContact OE2-CB 3.32Å; E2229-S2232 PolarHBondContact OE2-OG 3.05Å; E2229-R2235 HydrophobicContact CB-CB 4.45Å; E2229-R2235 HydrophobicContact CG-CB 4.45Å; E2229-R2235 PolarHBondContact N-O 3.17Å; E2229-R2235 WeakPolarHBondContact OE2-CD 3.32Å; E2229-R2235 IonicContact OE2-CZ 3.73Å; E2229-R2235 IonicContact OE2-NE 2.71Å; E2229-R2235 IonicContact OE2-NH1 3.28Å; E2229-R2235 PolarHBondContact OE2-NH1 2.87Å; E2229-R2235 VanDerWaalsContact OE2-NH1 3.11Å; E2229-Y2252 WeakPolarHBondContact OE1-CD2 3.49Å
2230	P	78.4	Confident	85	Confident	127.6 Å²	127.6	51.6 Å²	51.6	83%	0.829	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	130.4	177.9	-4.1	7.7	0	0	0	111.9	S2232	P2230-S2232 VanDerWaalsContact C-N 3.3Å; P2230-S2232 PolarHBondContact O-N 2.91Å
2231	G	72.2	Confident	85.2	Confident	83.4 Å²	83.4	49 Å²	49	86%	0.86	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.2	-36.7	176.1	0	0	0	0	0	115	E2229 G2233	E2229-G2231 PolarHBondContact O-N 2.81Å; G2231-G2233 VanDerWaalsContact C-N 3.32Å
2232	S	64.4	Low	85.1	Confident	67 Å²	67	48.9 Å²	48.9	47%	0.469	30%	0.299	S	S	.	.	S	Bend	trans	-96.3	15.7	-176.8	69.1	0	0	0	0	114.2	E2229 P2230 Q2234 R2235	E2229-S2232 VanDerWaalsContact CB-OG 3.31Å; E2229-S2232 WeakPolarHBondContact CB-OG 3.44Å; E2229-S2232 VanDerWaalsContact CD-OG 3.27Å; E2229-S2232 WeakPolarHBondContact CG-OG 3.41Å; E2229-S2232 PolarHBondContact O-N 3.05Å; E2229-S2232 PolarHBondContact O-OG 3.14Å; E2229-S2232 WeakPolarHBondContact OE2-CB 3.32Å; E2229-S2232 PolarHBondContact OE2-OG 3.05Å; P2230-S2232 VanDerWaalsContact C-N 3.3Å; P2230-S2232 PolarHBondContact O-N 2.91Å; S2232-Q2234 VanDerWaalsContact C-N 3.27Å; S2232-Q2234 PolarHBondContact O-N 3.28Å; S2232-R2235 VanDerWaalsContact CB-NH2 3.34Å; S2232-R2235 PolarHBondContact O-NE 3.35Å; S2232-R2235 PolarHBondContact O-NH2 3.16Å; S2232-R2235 VanDerWaalsContact OG-CB 3.32Å; S2232-R2235 WeakPolarHBondContact OG-CB 3.32Å; S2232-R2235 PolarHBondContact OG-N 3.01Å; S2232-R2235 PolarHBondContact OG-NE 3.37Å
2233	G	64.5	Low	84.7	Confident	41 Å²	41	49.4 Å²	49.4	42%	0.423	31%	0.306	S	S	.	.	S	Bend	trans	-45.6	36.8	-179.6	0	0	0	0	0	114.1	N1626 N2212 G2231 R2235	N1626-G2233 PolarHBondContact ND2-O 2.8Å; N2212-G2233 WeakPolarHBondContact OD1-CA 3.21Å; N2212-G2233 PolarHBondContact OD1-O 3.37Å; G2231-G2233 VanDerWaalsContact C-N 3.32Å; G2233-R2235 WeakPolarHBondContact O-CG 2.91Å; G2233-R2235 PolarHBondContact O-N 2.88Å
2234	Q	76.7	Confident	84	Confident	80.6 Å²	80.6	50 Å²	50	38%	0.377	31%	0.309	S	S	.	.	S	Bend	trans	33.9	37.3	-179.5	-58.3	-171.4	12.7	0	0	114.1	A1625 N2212 L2228 S2232	A1625-Q2234 CarbonylContact C-O 3.57Å; A1625-Q2234 WeakPolarHBondContact CA-O 3.37Å; A1625-Q2234 HydrophobicContact CB-CB 4.07Å; A1625-Q2234 WeakPolarHBondContact CB-O 3.36Å; N2212-Q2234 VanDerWaalsContact OD1-CD 3.25Å; N2212-Q2234 VanDerWaalsContact OD1-CG 3.32Å; N2212-Q2234 WeakPolarHBondContact OD1-CG 3.33Å; N2212-Q2234 PolarHBondContact OD1-NE2 3.28Å; N2212-Q2234 VanDerWaalsContact OD1-NE2 3.08Å; N2212-Q2234 PolarHBondContact OD1-OE1 3.4Å; L2228-Q2234 HydrophobicContact CD1-CB 4.15Å; L2228-Q2234 HydrophobicContact CD1-CG 4.14Å; S2232-Q2234 VanDerWaalsContact C-N 3.27Å; S2232-Q2234 PolarHBondContact O-N 3.28Å
2235	R	88.5	Confident	83.3	Confident	48.4 Å²	48.4	50.4 Å²	50.4	18%	0.183	32%	0.324	C	S	.	.			trans	-94.6	137	178.4	-59.4	176.1	-156.4	166.3	-6.5	110.4	L2228 E2229 S2232 G2233 S2237 Y2252 S2253 F2254 G2256	L2228-R2235 CarbonylContact C-O 3.53Å; L2228-R2235 VanDerWaalsContact CA-O 3.24Å; L2228-R2235 WeakPolarHBondContact CA-O 3.42Å; E2229-R2235 HydrophobicContact CB-CB 4.45Å; E2229-R2235 HydrophobicContact CG-CB 4.45Å; E2229-R2235 PolarHBondContact N-O 3.17Å; E2229-R2235 WeakPolarHBondContact OE2-CD 3.32Å; E2229-R2235 IonicContact OE2-CZ 3.73Å; E2229-R2235 IonicContact OE2-NE 2.71Å; E2229-R2235 IonicContact OE2-NH1 3.28Å; E2229-R2235 PolarHBondContact OE2-NH1 2.87Å; E2229-R2235 VanDerWaalsContact OE2-NH1 3.11Å; S2232-R2235 VanDerWaalsContact CB-NH2 3.34Å; S2232-R2235 PolarHBondContact O-NE 3.35Å; S2232-R2235 PolarHBondContact O-NH2 3.16Å; S2232-R2235 VanDerWaalsContact OG-CB 3.32Å; S2232-R2235 WeakPolarHBondContact OG-CB 3.32Å; S2232-R2235 PolarHBondContact OG-N 3.01Å; S2232-R2235 PolarHBondContact OG-NE 3.37Å; G2233-R2235 WeakPolarHBondContact O-CG 2.91Å; G2233-R2235 PolarHBondContact O-N 2.88Å; R2235-S2237 PolarHBondContact O-N 2.93Å; R2235-Y2252 HydrophobicContact CB-CD2 4.04Å; R2235-Y2252 HydrophobicContact CB-CE2 3.82Å; R2235-S2253 PolarHBondContact NH1-O 2.9Å; R2235-F2254 PolarHBondContact NH1-O 3.23Å; R2235-F2254 PolarHBondContact NH2-O 3.02Å; R2235-G2256 VanDerWaalsContact CZ-CA 3.41Å
2236	I	92.3	Very high	82.8	Confident	23 Å²	23	47.9 Å²	47.9	12%	0.118	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	116.1	178.9	-60.2	178.7	0	0	0	109.3	L1516 A1625 W1627 L2213 V2226 T2227 L2228 T2238 L2239 F2250 Y2252	L1516-I2236 HydrophobicContact CD2-CD1 4.22Å; A1625-I2236 HydrophobicContact CB-CD1 4.46Å; A1625-I2236 HydrophobicContact CB-CG1 3.71Å; W1627-I2236 HydrophobicContact CD2-CD1 4.42Å; W1627-I2236 HydrophobicContact CG-CD1 3.95Å; L2213-I2236 HydrophobicContact CD2-CD1 4.25Å; L2213-I2236 HydrophobicContact CD2-CG1 4.37Å; V2226-I2236 HydrophobicContact CG1-CB 4.42Å; V2226-I2236 HydrophobicContact CG1-CD1 4.39Å; V2226-I2236 HydrophobicContact CG1-CG1 3.96Å; V2226-I2236 HydrophobicContact CG1-CG2 4.02Å; T2227-I2236 CarbonylContact O-C 3.58Å; L2228-I2236 HydrophobicContact CD2-CG1 4.24Å; I2236-T2238 WeakPolarHBondContact CG2-O 3.42Å; I2236-L2239 HydrophobicContact CG2-CB 4.45Å; I2236-F2250 HydrophobicContact CB-CD2 4.47Å; I2236-F2250 HydrophobicContact CG2-CD2 3.87Å; I2236-F2250 HydrophobicContact CG2-CE2 3.89Å; I2236-F2250 HydrophobicContact CG2-CG 4.44Å; I2236-F2250 VanDerWaalsContact O-CB 3.22Å; I2236-F2250 WeakPolarHBondContact O-CB 3.41Å; I2236-F2250 WeakPolarHBondContact O-CD2 3.25Å; I2236-Y2252 VanDerWaalsContact O-CE2 3.29Å; I2236-Y2252 WeakPolarHBondContact O-CE2 3.23Å; I2236-Y2252 PolarHBondContact O-OH 3.13Å
2237	S	91.8	Very high	82.6	Confident	28 Å²	28	50.2 Å²	50.2	20%	0.196	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	-42.9	174.4	87.4	0	0	0	0	111.9	T2227 L2228 R2235 K2249 F2250	T2227-S2237 VanDerWaalsContact C-OG 3.29Å; T2227-S2237 WeakPolarHBondContact O-CA 3.41Å; T2227-S2237 WeakPolarHBondContact O-CB 3.24Å; T2227-S2237 PolarHBondContact O-N 2.92Å; T2227-S2237 PolarHBondContact O-OG 2.99Å; T2227-S2237 VanDerWaalsContact O-OG 3.07Å; T2227-S2237 PolarHBondContact OG1-OG 2.79Å; L2228-S2237 VanDerWaalsContact C-OG 3.22Å; L2228-S2237 PolarHBondContact O-OG 3.1Å; L2228-S2237 VanDerWaalsContact O-OG 3.1Å; R2235-S2237 PolarHBondContact O-N 2.93Å; S2237-K2249 WeakPolarHBondContact O-CA 3.27Å; S2237-F2250 PolarHBondContact O-N 2.89Å
2238	T	92.8	Very high	82.6	Confident	26.6 Å²	26.6	49.6 Å²	49.6	16%	0.163	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	149.3	174.7	75.8	0	0	0	0	112.6	V2226 T2227 I2236 L2247 W2248 K2249	V2226-T2238 WeakPolarHBondContact CA-O 3.44Å; T2227-T2238 WeakPolarHBondContact CB-OG1 3.07Å; T2227-T2238 WeakPolarHBondContact CG2-OG1 3.39Å; T2227-T2238 PolarHBondContact N-O 3.12Å; T2227-T2238 PolarHBondContact O-N 3.32Å; T2227-T2238 VanDerWaalsContact O-N 3.1Å; T2227-T2238 WeakPolarHBondContact OG1-CB 3.24Å; T2227-T2238 PolarHBondContact OG1-N 2.75Å; T2227-T2238 PolarHBondContact OG1-OG1 2.86Å; T2227-T2238 VanDerWaalsContact OG1-OG1 3.07Å; I2236-T2238 WeakPolarHBondContact CG2-O 3.42Å; T2238-L2247 HydrophobicContact CG2-CD1 4.29Å; T2238-W2248 CarbonylContact C-O 3.54Å; T2238-W2248 WeakPolarHBondContact CA-O 3.33Å; T2238-W2248 VanDerWaalsContact CB-O 3.31Å; T2238-W2248 WeakPolarHBondContact CB-O 3.27Å; T2238-K2249 HydrophobicContact CG2-CG 4.15Å
2239	L	92.5	Very high	82.7	Confident	18.6 Å²	18.6	51.1 Å²	51.1	10%	0.097	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	128.2	172.7	-175.6	88.7	0	0	0	108.5	I1507 L1516 L2216 Y2224 N2225 V2226 I2236 L2247 W2248 F2250	I1507-L2239 HydrophobicContact CD1-CD2 3.93Å; I1507-L2239 HydrophobicContact CG2-CD2 4.43Å; L1516-L2239 HydrophobicContact CD2-CD2 4.37Å; L2216-L2239 HydrophobicContact CD1-CD1 4.34Å; Y2224-L2239 HydrophobicContact CD1-CD1 4.38Å; Y2224-L2239 HydrophobicContact CD1-CD2 4.03Å; Y2224-L2239 HydrophobicContact CD1-CG 4.25Å; Y2224-L2239 HydrophobicContact CE1-CD2 4.1Å; Y2224-L2239 HydrophobicContact CG-CD2 3.91Å; N2225-L2239 WeakPolarHBondContact O-CA 3.28Å; V2226-L2239 HydrophobicContact CG2-CD1 3.72Å; I2236-L2239 HydrophobicContact CG2-CB 4.45Å; L2239-L2247 WeakPolarHBondContact O-CA 3.35Å; L2239-W2248 HydrophobicContact CB-CB 4.15Å; L2239-W2248 HydrophobicContact CB-CE3 4.15Å; L2239-W2248 HydrophobicContact CB-CG 4.48Å; L2239-W2248 HydrophobicContact CD2-CD2 4.32Å; L2239-W2248 HydrophobicContact CD2-CE3 3.68Å; L2239-W2248 HydrophobicContact CD2-CZ3 4.02Å; L2239-W2248 HydrophobicContact CG-CE3 4.15Å; L2239-W2248 HydrophobicContact CG-CZ3 4.45Å; L2239-W2248 PolarHBondContact N-O 2.96Å; L2239-W2248 VanDerWaalsContact N-O 3.08Å; L2239-W2248 PolarHBondContact O-N 3.23Å; L2239-F2250 HydrophobicContact CB-CE2 4.15Å
2240	V	90.3	Very high	83.1	Confident	40.4 Å²	40.4	49.4 Å²	49.4	25%	0.245	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	124.8	179	-174.7	0	0	0	0	109.7	Y2224 N2225 P2242 G2246 L2247	Y2224-V2240 WeakPolarHBondContact CD1-O 3.22Å; N2225-V2240 HydrophobicContact CB-CB 4.3Å; N2225-V2240 HydrophobicContact CB-CG2 3.74Å; N2225-V2240 PolarHBondContact O-N 3.06Å; V2240-P2242 WeakPolarHBondContact O-CD 3.36Å; V2240-G2246 WeakPolarHBondContact CA-O 3.36Å; V2240-L2247 HydrophobicContact CB-CD2 4.23Å; V2240-L2247 HydrophobicContact CG1-CD2 4.27Å; V2240-L2247 HydrophobicContact CG2-CD1 3.75Å; V2240-L2247 HydrophobicContact CG2-CD2 3.64Å
2241	D	83.4	Confident	83.8	Confident	15.6 Å²	15.6	47 Å²	47	8%	0.083	29%	0.292	C	S	.	.			trans	-72.1	117.2	169.1	-177.1	-18	0	0	0	109.3	K1510 Y2224 V2243 N2244 G2245 G2246 W2248 P2264	K1510-D2241 IonicContact NZ-OD1 3.34Å; K1510-D2241 PolarHBondContact NZ-OD1 2.76Å; K1510-D2241 IonicContact NZ-OD2 3.06Å; Y2224-D2241 HydrophobicContact CE1-CB 4.22Å; D2241-V2243 PolarHBondContact O-N 2.88Å; D2241-V2243 VanDerWaalsContact O-N 3.14Å; D2241-V2243 WeakPolarHBondContact OD1-CB 3.43Å; D2241-V2243 PolarHBondContact OD1-N 3.03Å; D2241-V2243 VanDerWaalsContact OD1-N 3.08Å; D2241-N2244 VanDerWaalsContact CB-OD1 3.27Å; D2241-N2244 WeakPolarHBondContact CB-OD1 3.37Å; D2241-N2244 PolarHBondContact OD1-N 3.05Å; D2241-N2244 VanDerWaalsContact OD2-CG 3.22Å; D2241-N2244 PolarHBondContact OD2-ND2 2.93Å; D2241-N2244 PolarHBondContact OD2-OD1 3.06Å; D2241-N2244 VanDerWaalsContact OD2-OD1 3.07Å; D2241-G2245 CarbonylContact O-C 3.49Å; D2241-G2245 VanDerWaalsContact O-CA 3.25Å; D2241-G2245 WeakPolarHBondContact O-CA 3.42Å; D2241-G2245 PolarHBondContact O-N 3Å; D2241-G2246 WeakPolarHBondContact CB-O 3.19Å; D2241-G2246 PolarHBondContact N-O 2.96Å; D2241-G2246 PolarHBondContact O-N 3.31Å; D2241-W2248 HydrophobicContact CB-CE3 4.42Å; D2241-W2248 HydrophobicContact CB-CH2 3.88Å; D2241-W2248 HydrophobicContact CB-CZ3 3.59Å; D2241-W2248 VanDerWaalsContact CB-CZ3 3.45Å; D2241-P2264 HydrophobicContact CB-CB 4.15Å; D2241-P2264 HydrophobicContact CB-CG 4.16Å
2242	P	80.5	Confident	84.7	Confident	33.8 Å²	33.8	44.7 Å²	44.7	22%	0.219	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-19.5	-177	27.5	-34.8	0	0	0	113.7	K1510 H2222 L2223 Y2224 V2240 F2630	K1510-P2242 HydrophobicContact CD-CG 4.35Å; H2222-P2242 HydrophobicContact CB-CB 3.65Å; H2222-P2242 HydrophobicContact CB-CG 3.83Å; L2223-P2242 WeakPolarHBondContact O-CB 3.3Å; L2223-P2242 WeakPolarHBondContact O-CG 3.28Å; Y2224-P2242 VanDerWaalsContact CD1-CD 3.44Å; Y2224-P2242 HydrophobicContact CD1-CG 4.42Å; Y2224-P2242 HydrophobicContact CD2-CG 4.09Å; Y2224-P2242 VanDerWaalsContact CE1-CD 3.44Å; Y2224-P2242 HydrophobicContact CE1-CG 4.19Å; Y2224-P2242 HydrophobicContact CE2-CG 3.96Å; Y2224-P2242 HydrophobicContact CG-CG 4.41Å; V2240-P2242 WeakPolarHBondContact O-CD 3.36Å; P2242-F2630 HydrophobicContact CB-CE2 4.32Å; P2242-F2630 WeakPolarHBondContact O-CD2 3.34Å; P2242-F2630 WeakPolarHBondContact O-CE2 3.36Å
2243	V	76.6	Confident	86	Confident	62.8 Å²	62.8	42.9 Å²	42.9	38%	0.381	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-46.9	-174.4	-178.7	0	0	0	0	111.2	K1510 D2241 F2630 Q2631	K1510-V2243 HydrophobicContact CD-CG2 3.46Å; K1510-V2243 VanDerWaalsContact CD-CG2 3.46Å; K1510-V2243 VanDerWaalsContact NZ-CB 3.26Å; D2241-V2243 PolarHBondContact O-N 2.88Å; D2241-V2243 VanDerWaalsContact O-N 3.14Å; D2241-V2243 WeakPolarHBondContact OD1-CB 3.43Å; D2241-V2243 PolarHBondContact OD1-N 3.03Å; D2241-V2243 VanDerWaalsContact OD1-N 3.08Å; V2243-F2630 HydrophobicContact CB-CB 4.27Å; V2243-F2630 HydrophobicContact CB-CG 4.39Å; V2243-F2630 HydrophobicContact CG1-CB 3.84Å; V2243-F2630 HydrophobicContact CG1-CG 4.29Å; V2243-F2630 HydrophobicContact CG2-CG 4.45Å; V2243-F2630 WeakPolarHBondContact O-CB 3.2Å; V2243-Q2631 WeakPolarHBondContact O-CG 3.34Å; V2243-Q2631 PolarHBondContact O-NE2 2.9Å
2244	N	75.1	Confident	86.9	Confident	76.2 Å²	76.2	49.9 Å²	49.9	41%	0.407	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.4	-3.8	-174.7	-20.5	-2.5	0	0	0	113.4	D2241 G2246 Q2265 I2628 Q2631 Y2670	D2241-N2244 VanDerWaalsContact CB-OD1 3.27Å; D2241-N2244 WeakPolarHBondContact CB-OD1 3.37Å; D2241-N2244 PolarHBondContact OD1-N 3.05Å; D2241-N2244 VanDerWaalsContact OD2-CG 3.22Å; D2241-N2244 PolarHBondContact OD2-ND2 2.93Å; D2241-N2244 PolarHBondContact OD2-OD1 3.06Å; D2241-N2244 VanDerWaalsContact OD2-OD1 3.07Å; N2244-G2246 PolarHBondContact O-N 2.91Å; N2244-G2246 WeakPolarHBondContact OD1-CA 3.34Å; N2244-G2246 PolarHBondContact OD1-N 2.74Å; N2244-Q2265 PolarHBondContact ND2-NE2 3.38Å; N2244-I2628 WeakPolarHBondContact O-CG2 3.44Å; N2244-Q2631 PolarHBondContact OD1-NE2 3.49Å; N2244-Y2670 HydrophobicContact CB-CE2 4.01Å
2245	G	76	Confident	87.3	Confident	43.2 Å²	43.2	50 Å²	50	45%	0.445	27%	0.267	S	S	.	.			trans	70.6	4.1	-175	0	0	0	0	0	114.3	D2241 L2247	D2241-G2245 CarbonylContact O-C 3.49Å; D2241-G2245 VanDerWaalsContact O-CA 3.25Å; D2241-G2245 WeakPolarHBondContact O-CA 3.42Å; D2241-G2245 PolarHBondContact O-N 3Å; G2245-L2247 PolarHBondContact O-N 3.06Å
2246	G	81.5	Confident	87.2	Confident	12.2 Å²	12.2	48.5 Å²	48.5	13%	0.126	27%	0.266	C	S	.	.			trans	-66.6	144	-177.8	0	0	0	0	0	112.7	V2240 D2241 N2244 P2264	V2240-G2246 WeakPolarHBondContact CA-O 3.36Å; D2241-G2246 WeakPolarHBondContact CB-O 3.19Å; D2241-G2246 PolarHBondContact N-O 2.96Å; D2241-G2246 PolarHBondContact O-N 3.31Å; N2244-G2246 PolarHBondContact O-N 2.91Å; N2244-G2246 WeakPolarHBondContact OD1-CA 3.34Å; N2244-G2246 PolarHBondContact OD1-N 2.74Å; G2246-P2264 VanDerWaalsContact CA-CB 3.45Å
2247	L	88	Confident	87.2	Confident	62.2 Å²	62.2	49.2 Å²	49.2	33%	0.326	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	116.4	-175.8	-106.9	128.8	0	0	0	111.2	T2238 L2239 V2240 G2245 K2249 P2264	T2238-L2247 HydrophobicContact CG2-CD1 4.29Å; L2239-L2247 WeakPolarHBondContact O-CA 3.35Å; V2240-L2247 HydrophobicContact CB-CD2 4.23Å; V2240-L2247 HydrophobicContact CG1-CD2 4.27Å; V2240-L2247 HydrophobicContact CG2-CD1 3.75Å; V2240-L2247 HydrophobicContact CG2-CD2 3.64Å; G2245-L2247 PolarHBondContact O-N 3.06Å; L2247-K2249 HydrophobicContact CB-CG 4.36Å; L2247-K2249 HydrophobicContact CD2-CD 4.44Å; L2247-K2249 HydrophobicContact CD2-CG 4.35Å; L2247-K2249 HydrophobicContact CG-CG 4.16Å; L2247-P2264 WeakPolarHBondContact O-CA 3.45Å
2248	W	91.3	Very high	87.3	Confident	53.2 Å²	53.2	48.7 Å²	48.7	20%	0.202	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	135.5	159.5	-66.8	-74.4	0	0	0	108.9	I1507 Y2224 T2238 L2239 D2241 F2250 L2261 K2262 N2263 P2264	I1507-W2248 HydrophobicContact CD1-CD2 4.46Å; I1507-W2248 HydrophobicContact CD1-CG 4.39Å; I1507-W2248 HydrophobicContact CG2-CH2 4.16Å; I1507-W2248 HydrophobicContact CG2-CZ2 3.93Å; Y2224-W2248 HydrophobicContact CD1-CZ3 4.31Å; Y2224-W2248 AromaticContact CE1-CH2 3.97Å; Y2224-W2248 HydrophobicContact CE1-CH2 4.22Å; Y2224-W2248 AromaticContact CE1-CZ3 3.85Å; Y2224-W2248 HydrophobicContact CE1-CZ3 4.01Å; T2238-W2248 CarbonylContact C-O 3.54Å; T2238-W2248 WeakPolarHBondContact CA-O 3.33Å; T2238-W2248 VanDerWaalsContact CB-O 3.31Å; T2238-W2248 WeakPolarHBondContact CB-O 3.27Å; L2239-W2248 HydrophobicContact CB-CB 4.15Å; L2239-W2248 HydrophobicContact CB-CE3 4.15Å; L2239-W2248 HydrophobicContact CB-CG 4.48Å; L2239-W2248 HydrophobicContact CD2-CD2 4.32Å; L2239-W2248 HydrophobicContact CD2-CE3 3.68Å; L2239-W2248 HydrophobicContact CD2-CZ3 4.02Å; L2239-W2248 HydrophobicContact CG-CE3 4.15Å; L2239-W2248 HydrophobicContact CG-CZ3 4.45Å; L2239-W2248 PolarHBondContact N-O 2.96Å; L2239-W2248 VanDerWaalsContact N-O 3.08Å; L2239-W2248 PolarHBondContact O-N 3.23Å; D2241-W2248 HydrophobicContact CB-CE3 4.42Å; D2241-W2248 HydrophobicContact CB-CH2 3.88Å; D2241-W2248 HydrophobicContact CB-CZ3 3.59Å; D2241-W2248 VanDerWaalsContact CB-CZ3 3.45Å; W2248-F2250 HydrophobicContact CB-CE1 4.36Å; W2248-F2250 HydrophobicContact CB-CE2 3.7Å; W2248-F2250 HydrophobicContact CB-CZ 3.9Å; W2248-F2250 VanDerWaalsContact CB-CZ 3.48Å; W2248-F2250 HydrophobicContact CE3-CZ 4.5Å; W2248-F2250 HydrophobicContact CG-CZ 4.04Å; W2248-L2261 HydrophobicContact CE3-CD1 4.12Å; W2248-K2262 CarbonylContact C-O 3.57Å; W2248-K2262 VanDerWaalsContact CA-O 3.26Å; W2248-K2262 WeakPolarHBondContact CA-O 3.26Å; W2248-N2263 HydrophobicContact CE3-CB 4.4Å; W2248-N2263 HydrophobicContact CH2-CB 4.16Å; W2248-N2263 WeakPolarHBondContact CH2-OD1 3.49Å; W2248-N2263 HydrophobicContact CZ3-CB 4.01Å; W2248-N2263 VanDerWaalsContact CZ3-CG 3.49Å; W2248-N2263 WeakPolarHBondContact CZ3-OD1 3.47Å; W2248-N2263 PolarHBondContact NE1-OD1 3.47Å; W2248-P2264 VanDerWaalsContact CD1-CD 3.43Å; W2248-P2264 VanDerWaalsContact CD2-CD 3.46Å; W2248-P2264 HydrophobicContact CD2-CG 3.72Å; W2248-P2264 VanDerWaalsContact CD2-CG 3.45Å; W2248-P2264 VanDerWaalsContact CE2-CG 3.5Å; W2248-P2264 HydrophobicContact CE3-CG 3.75Å; W2248-P2264 HydrophobicContact CG-CG 3.96Å; W2248-P2264 HydrophobicContact CH2-CG 4.03Å; W2248-P2264 HydrophobicContact CZ2-CG 4.02Å; W2248-P2264 HydrophobicContact CZ3-CG 4.03Å; W2248-P2264 VanDerWaalsContact NE1-CD 3.3Å; W2248-P2264 VanDerWaalsContact NE1-CG 3.26Å
2249	K	93.2	Very high	87.4	Confident	71.4 Å²	71.4	48.9 Å²	48.9	31%	0.31	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	132.3	173.1	-58	-173.9	175.8	-178.9	0	110.2	S2237 T2238 L2247 L2261 K2262 Y2269 D2669	S2237-K2249 WeakPolarHBondContact O-CA 3.27Å; T2238-K2249 HydrophobicContact CG2-CG 4.15Å; L2247-K2249 HydrophobicContact CB-CG 4.36Å; L2247-K2249 HydrophobicContact CD2-CD 4.44Å; L2247-K2249 HydrophobicContact CD2-CG 4.35Å; L2247-K2249 HydrophobicContact CG-CG 4.16Å; K2249-L2261 CarbonylContact O-C 3.45Å; K2249-L2261 WeakPolarHBondContact O-CA 3.22Å; K2249-K2262 HydrophobicContact CB-CB 4.21Å; K2249-K2262 HydrophobicContact CD-CD 4.42Å; K2249-K2262 PolarHBondContact N-O 2.95Å; K2249-K2262 PolarHBondContact O-N 2.82Å; K2249-Y2269 HydrophobicContact CB-CE1 4.09Å; K2249-Y2269 WeakPolarHBondContact CD-OH 3.35Å; K2249-D2669 IonicContact NZ-OD2 2.8Å; K2249-D2669 PolarHBondContact NZ-OD2 3.3Å
2250	F	94.4	Very high	87.5	Confident	22.8 Å²	22.8	52.4 Å²	52.4	10%	0.1	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	132.4	-179.8	-52.7	-95.5	0	0	0	108.6	Y1505 I1507 W1627 I2236 S2237 L2239 W2248 Y2252 L2258 Y2260 L2261	Y1505-F2250 HydrophobicContact CE1-CE1 4.27Å; I1507-F2250 HydrophobicContact CD1-CE1 4.2Å; I1507-F2250 HydrophobicContact CD1-CZ 3.68Å; W1627-F2250 HydrophobicContact CH2-CD1 4.23Å; W1627-F2250 AromaticContact CH2-CE1 3.55Å; W1627-F2250 HydrophobicContact CH2-CE1 3.55Å; W1627-F2250 AromaticContact CH2-CZ 3.94Å; W1627-F2250 HydrophobicContact CH2-CZ 3.94Å; W1627-F2250 AromaticContact CZ2-CD1 3.8Å; W1627-F2250 HydrophobicContact CZ2-CD1 3.8Å; W1627-F2250 AromaticContact CZ2-CE1 3.51Å; W1627-F2250 HydrophobicContact CZ2-CE1 3.51Å; W1627-F2250 VanDerWaalsContact CZ2-CE1 3.49Å; W1627-F2250 HydrophobicContact CZ2-CE2 4.41Å; W1627-F2250 HydrophobicContact CZ2-CG 4.38Å; W1627-F2250 AromaticContact CZ2-CZ 3.85Å; W1627-F2250 HydrophobicContact CZ2-CZ 3.85Å; I2236-F2250 HydrophobicContact CB-CD2 4.47Å; I2236-F2250 HydrophobicContact CG2-CD2 3.87Å; I2236-F2250 HydrophobicContact CG2-CE2 3.89Å; I2236-F2250 HydrophobicContact CG2-CG 4.44Å; I2236-F2250 VanDerWaalsContact O-CB 3.22Å; I2236-F2250 WeakPolarHBondContact O-CB 3.41Å; I2236-F2250 WeakPolarHBondContact O-CD2 3.25Å; S2237-F2250 PolarHBondContact O-N 2.89Å; L2239-F2250 HydrophobicContact CB-CE2 4.15Å; W2248-F2250 HydrophobicContact CB-CE1 4.36Å; W2248-F2250 HydrophobicContact CB-CE2 3.7Å; W2248-F2250 HydrophobicContact CB-CZ 3.9Å; W2248-F2250 VanDerWaalsContact CB-CZ 3.48Å; W2248-F2250 HydrophobicContact CE3-CZ 4.5Å; W2248-F2250 HydrophobicContact CG-CZ 4.04Å; F2250-Y2252 HydrophobicContact CB-CE2 3.8Å; F2250-L2258 HydrophobicContact CB-CD1 3.79Å; F2250-L2258 HydrophobicContact CD1-CD1 3.93Å; F2250-L2258 HydrophobicContact CD1-CD2 4.34Å; F2250-L2258 HydrophobicContact CG-CD1 4.37Å; F2250-Y2260 WeakPolarHBondContact CA-O 3.13Å; F2250-L2261 HydrophobicContact CD1-CD1 3.53Å; F2250-L2261 VanDerWaalsContact CD1-CD1 3.46Å; F2250-L2261 HydrophobicContact CD1-CG 4.31Å; F2250-L2261 HydrophobicContact CD2-CD1 4.39Å; F2250-L2261 HydrophobicContact CE1-CD1 3.38Å; F2250-L2261 VanDerWaalsContact CE1-CD1 3.47Å; F2250-L2261 HydrophobicContact CE1-CG 4.29Å; F2250-L2261 HydrophobicContact CE2-CD1 4.23Å; F2250-L2261 HydrophobicContact CG-CD1 4.21Å; F2250-L2261 HydrophobicContact CZ-CD1 3.97Å
2251	L	93.7	Very high	87.7	Confident	76.4 Å²	76.4	51.2 Å²	51.2	40%	0.4	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	134.6	172.3	-56.9	175	0	0	0	108.7	L2258 T2259 Y2260 Y2269	L2251-L2258 CarbonylContact O-C 3.56Å; L2251-T2259 PolarHBondContact O-N 3.08Å; L2251-T2259 PolarHBondContact O-OG1 3.01Å; L2251-T2259 VanDerWaalsContact O-OG1 3.11Å; L2251-Y2260 HydrophobicContact CB-CD2 4.19Å; L2251-Y2260 HydrophobicContact CD1-CD2 4.13Å; L2251-Y2260 HydrophobicContact CD1-CG 4.28Å; L2251-Y2260 PolarHBondContact N-O 3.09Å; L2251-Y2260 PolarHBondContact O-N 2.91Å; L2251-Y2260 VanDerWaalsContact O-N 3.13Å; L2251-Y2269 HydrophobicContact CD1-CD1 4.49Å; L2251-Y2269 HydrophobicContact CD1-CE1 4.15Å; L2251-Y2269 HydrophobicContact CG-CE1 4.39Å
2252	Y	92.2	Very high	88	Confident	35.6 Å²	35.6	52.4 Å²	52.4	14%	0.14	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	157.2	-177.9	-56.7	-88.7	0	0	0	110.9	Y1518 W1627 E2229 R2235 I2236 F2250 G2256 L2257 L2258	Y1518-Y2252 HydrophobicContact CD2-CE1 4.07Å; Y1518-Y2252 HydrophobicContact CE2-CD1 4.23Å; Y1518-Y2252 AromaticContact CE2-CE1 3.65Å; Y1518-Y2252 HydrophobicContact CE2-CE1 3.65Å; W1627-Y2252 PolarHBondContact NE1-OH 3.04Å; W1627-Y2252 VanDerWaalsContact NE1-OH 3.15Å; E2229-Y2252 WeakPolarHBondContact OE1-CD2 3.49Å; R2235-Y2252 HydrophobicContact CB-CD2 4.04Å; R2235-Y2252 HydrophobicContact CB-CE2 3.82Å; I2236-Y2252 VanDerWaalsContact O-CE2 3.29Å; I2236-Y2252 WeakPolarHBondContact O-CE2 3.23Å; I2236-Y2252 PolarHBondContact O-OH 3.13Å; F2250-Y2252 HydrophobicContact CB-CE2 3.8Å; Y2252-G2256 WeakPolarHBondContact CD1-O 3.34Å; Y2252-L2257 CarbonylContact C-O 3.52Å; Y2252-L2257 VanDerWaalsContact CA-O 3.26Å; Y2252-L2257 WeakPolarHBondContact CA-O 3.33Å; Y2252-L2258 HydrophobicContact CD1-CB 4.03Å; Y2252-L2258 HydrophobicContact CD1-CD1 4.17Å; Y2252-L2258 HydrophobicContact CE1-CB 3.93Å; Y2252-L2258 HydrophobicContact CE1-CD1 3.76Å; Y2252-L2258 HydrophobicContact CE1-CG 4.44Å; Y2252-L2258 HydrophobicContact CE2-CD1 4.44Å
2253	S	90.1	Very high	88.2	Confident	29 Å²	29	52.5 Å²	52.5	20%	0.203	28%	0.275	C	S	.	.			trans	-71.3	167.1	161.2	59.9	0	0	0	0	110.5	R2235 D2255 G2256 L2257	R2235-S2253 PolarHBondContact NH1-O 2.9Å; S2253-D2255 WeakPolarHBondContact CB-OD1 3.36Å; S2253-D2255 PolarHBondContact O-N 3.13Å; S2253-D2255 VanDerWaalsContact O-N 3.17Å; S2253-D2255 PolarHBondContact OG-N 3.31Å; S2253-D2255 PolarHBondContact OG-OD1 3.09Å; S2253-G2256 PolarHBondContact O-N 3.13Å; S2253-G2256 PolarHBondContact OG-N 3.19Å; S2253-L2257 PolarHBondContact N-O 3.07Å; S2253-L2257 WeakPolarHBondContact OG-CA 3.24Å; S2253-L2257 VanDerWaalsContact OG-CB 3.3Å; S2253-L2257 WeakPolarHBondContact OG-CB 3.22Å; S2253-L2257 PolarHBondContact OG-N 2.97Å; S2253-L2257 VanDerWaalsContact OG-N 3.16Å; S2253-L2257 PolarHBondContact OG-O 3.15Å
2254	F	84.5	Confident	88.3	Confident	188.2 Å²	188.2	50.7 Å²	50.7	83%	0.825	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-36.9	176.4	113.6	-92.8	0	0	0	112.2	R2235 G2256	R2235-F2254 PolarHBondContact NH1-O 3.23Å; R2235-F2254 PolarHBondContact NH2-O 3.02Å; F2254-G2256 VanDerWaalsContact C-N 3.32Å; F2254-G2256 PolarHBondContact O-N 3.04Å
2255	D	84.8	Confident	88.2	Confident	83.2 Å²	83.2	52.9 Å²	52.9	45%	0.445	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-1.4	178.7	-16.8	-30.2	0	0	0	114.1	T1523 S1524 G1525 S2253	T1523-D2255 WeakPolarHBondContact CB-O 3.43Å; S1524-D2255 PolarHBondContact N-O 3.33Å; S1524-D2255 WeakPolarHBondContact OG-CA 3.01Å; S1524-D2255 PolarHBondContact OG-O 2.77Å; G1525-D2255 WeakPolarHBondContact CA-OD2 3.35Å; G1525-D2255 PolarHBondContact N-O 3.06Å; G1525-D2255 VanDerWaalsContact N-O 3.09Å; S2253-D2255 WeakPolarHBondContact CB-OD1 3.36Å; S2253-D2255 PolarHBondContact O-N 3.13Å; S2253-D2255 VanDerWaalsContact O-N 3.17Å; S2253-D2255 PolarHBondContact OG-N 3.31Å; S2253-D2255 PolarHBondContact OG-OD1 3.09Å
2256	G	86.8	Confident	88.1	Confident	15.6 Å²	15.6	52.3 Å²	52.3	16%	0.161	26%	0.259	C	S	.	.	S	Bend	trans	96.5	5	171.4	0	0	0	0	0	116.3	Y1518 T1523 R2235 Y2252 S2253 F2254	Y1518-G2256 PolarHBondContact OH-O 3.45Å; T1523-G2256 WeakPolarHBondContact CG2-O 3.22Å; R2235-G2256 VanDerWaalsContact CZ-CA 3.41Å; Y2252-G2256 WeakPolarHBondContact CD1-O 3.34Å; S2253-G2256 PolarHBondContact O-N 3.13Å; S2253-G2256 PolarHBondContact OG-N 3.19Å; F2254-G2256 VanDerWaalsContact C-N 3.32Å; F2254-G2256 PolarHBondContact O-N 3.04Å
2257	L	92.2	Very high	87.7	Confident	37.2 Å²	37.2	55.2 Å²	55.2	20%	0.195	28%	0.277	C	S	.	.			trans	-76.1	131.6	175.4	-55.7	171.8	0	0	0	110.4	Y1518 T1523 Y2252 S2253 T2259 Y2274	Y1518-L2257 WeakPolarHBondContact OH-CA 3.45Å; T1523-L2257 WeakPolarHBondContact OG1-CD2 3.26Å; Y2252-L2257 CarbonylContact C-O 3.52Å; Y2252-L2257 VanDerWaalsContact CA-O 3.26Å; Y2252-L2257 WeakPolarHBondContact CA-O 3.33Å; S2253-L2257 PolarHBondContact N-O 3.07Å; S2253-L2257 WeakPolarHBondContact OG-CA 3.24Å; S2253-L2257 VanDerWaalsContact OG-CB 3.3Å; S2253-L2257 WeakPolarHBondContact OG-CB 3.22Å; S2253-L2257 PolarHBondContact OG-N 2.97Å; S2253-L2257 VanDerWaalsContact OG-N 3.16Å; S2253-L2257 PolarHBondContact OG-O 3.15Å; L2257-T2259 PolarHBondContact O-N 3.19Å; L2257-T2259 VanDerWaalsContact O-N 3.14Å; L2257-Y2274 HydrophobicContact CB-CD2 4.03Å; L2257-Y2274 HydrophobicContact CB-CE1 4.4Å; L2257-Y2274 HydrophobicContact CB-CE2 3.82Å; L2257-Y2274 HydrophobicContact CB-CG 4.42Å; L2257-Y2274 HydrophobicContact CD1-CD1 4.14Å; L2257-Y2274 HydrophobicContact CD1-CD2 4.23Å; L2257-Y2274 HydrophobicContact CD1-CE1 4.5Å; L2257-Y2274 HydrophobicContact CD1-CG 3.89Å; L2257-Y2274 HydrophobicContact CD2-CD1 4.45Å; L2257-Y2274 HydrophobicContact CD2-CE1 4.41Å
2258	L	94	Very high	87.4	Confident	17.6 Å²	17.6	54.3 Å²	54.3	9%	0.092	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	106.1	178.1	178.9	69.3	0	0	0	110.5	L1503 Y1518 F2250 L2251 Y2252 Y2260 L2261 F2272 Y2274	L1503-L2258 HydrophobicContact CD2-CB 4.39Å; L1503-L2258 HydrophobicContact CD2-CD2 4.19Å; Y1518-L2258 HydrophobicContact CD1-CB 4.18Å; Y1518-L2258 HydrophobicContact CD1-CD2 4.16Å; Y1518-L2258 HydrophobicContact CE1-CB 3.53Å; Y1518-L2258 HydrophobicContact CE1-CD2 4.31Å; Y1518-L2258 HydrophobicContact CE2-CB 4.42Å; Y1518-L2258 PolarHBondContact OH-N 2.77Å; F2250-L2258 HydrophobicContact CB-CD1 3.79Å; F2250-L2258 HydrophobicContact CD1-CD1 3.93Å; F2250-L2258 HydrophobicContact CD1-CD2 4.34Å; F2250-L2258 HydrophobicContact CG-CD1 4.37Å; L2251-L2258 CarbonylContact O-C 3.56Å; Y2252-L2258 HydrophobicContact CD1-CB 4.03Å; Y2252-L2258 HydrophobicContact CD1-CD1 4.17Å; Y2252-L2258 HydrophobicContact CE1-CB 3.93Å; Y2252-L2258 HydrophobicContact CE1-CD1 3.76Å; Y2252-L2258 HydrophobicContact CE1-CG 4.44Å; Y2252-L2258 HydrophobicContact CE2-CD1 4.44Å; L2258-Y2260 WeakPolarHBondContact CD1-O 3.31Å; L2258-L2261 HydrophobicContact CD2-CB 4.43Å; L2258-L2261 HydrophobicContact CD2-CD1 3.98Å; L2258-F2272 HydrophobicContact CD2-CD2 4.32Å; L2258-F2272 HydrophobicContact CD2-CE2 3.86Å; L2258-F2272 HydrophobicContact CD2-CZ 4.19Å; L2258-F2272 HydrophobicContact CG-CD2 4.18Å; L2258-F2272 HydrophobicContact CG-CE2 4.17Å; L2258-F2272 WeakPolarHBondContact O-CB 3.39Å; L2258-F2272 WeakPolarHBondContact O-CD2 3.36Å; L2258-F2272 WeakPolarHBondContact O-CG 3.37Å; L2258-Y2274 VanDerWaalsContact O-CE2 3.25Å; L2258-Y2274 WeakPolarHBondContact O-CE2 3.31Å; L2258-Y2274 PolarHBondContact O-OH 3.26Å; L2258-Y2274 VanDerWaalsContact O-OH 3.09Å
2259	T	94.2	Very high	87.2	Confident	32.4 Å²	32.4	55.3 Å²	55.3	20%	0.199	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	-33.7	-177.1	51.1	0	0	0	0	113	L2251 L2257 Q2271 F2272	L2251-T2259 PolarHBondContact O-N 3.08Å; L2251-T2259 PolarHBondContact O-OG1 3.01Å; L2251-T2259 VanDerWaalsContact O-OG1 3.11Å; L2257-T2259 PolarHBondContact O-N 3.19Å; L2257-T2259 VanDerWaalsContact O-N 3.14Å; T2259-Q2271 CarbonylContact O-C 3.6Å; T2259-Q2271 WeakPolarHBondContact O-CA 3.33Å; T2259-F2272 PolarHBondContact O-N 2.99Å
2260	Y	95.1	Very high	87.1	Confident	90.4 Å²	90.4	52.3 Å²	52.3	36%	0.355	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	139.4	177.1	-57.6	-93	0	0	0	112.2	F2250 L2251 L2258 Y2269 I2270 Q2271	F2250-Y2260 WeakPolarHBondContact CA-O 3.13Å; L2251-Y2260 HydrophobicContact CB-CD2 4.19Å; L2251-Y2260 HydrophobicContact CD1-CD2 4.13Å; L2251-Y2260 HydrophobicContact CD1-CG 4.28Å; L2251-Y2260 PolarHBondContact N-O 3.09Å; L2251-Y2260 PolarHBondContact O-N 2.91Å; L2251-Y2260 VanDerWaalsContact O-N 3.13Å; L2258-Y2260 WeakPolarHBondContact CD1-O 3.31Å; Y2260-Y2269 HydrophobicContact CD1-CG 4.4Å; Y2260-Y2269 HydrophobicContact CG-CD1 4.48Å; Y2260-I2270 CarbonylContact C-O 3.53Å; Y2260-I2270 VanDerWaalsContact CA-O 3.27Å; Y2260-I2270 WeakPolarHBondContact CA-O 3.31Å; Y2260-Q2271 HydrophobicContact CD1-CB 4.15Å; Y2260-Q2271 HydrophobicContact CD1-CG 3.78Å; Y2260-Q2271 HydrophobicContact CE1-CB 4.05Å; Y2260-Q2271 VanDerWaalsContact CE1-CD 3.48Å; Y2260-Q2271 HydrophobicContact CE1-CG 3.58Å; Y2260-Q2271 VanDerWaalsContact CE1-CG 3.48Å; Y2260-Q2271 PolarHBondContact OH-NE2 3.26Å; Y2260-Q2271 VanDerWaalsContact OH-NE2 3.09Å
2261	L	94	Very high	87	Confident	15.4 Å²	15.4	54.4 Å²	54.4	8%	0.081	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	126.5	173.2	174.7	78.9	0	0	0	109.7	Y1505 W2248 K2249 F2250 L2258 N2263 Y2269 I2270 F2272	Y1505-L2261 HydrophobicContact CD1-CD2 4.46Å; Y1505-L2261 HydrophobicContact CD2-CD2 3.79Å; Y1505-L2261 HydrophobicContact CE1-CD1 4.15Å; Y1505-L2261 HydrophobicContact CE1-CD2 3.93Å; Y1505-L2261 HydrophobicContact CE2-CD2 3.21Å; Y1505-L2261 HydrophobicContact CG-CD2 4.39Å; W2248-L2261 HydrophobicContact CE3-CD1 4.12Å; K2249-L2261 CarbonylContact O-C 3.45Å; K2249-L2261 WeakPolarHBondContact O-CA 3.22Å; F2250-L2261 HydrophobicContact CD1-CD1 3.53Å; F2250-L2261 VanDerWaalsContact CD1-CD1 3.46Å; F2250-L2261 HydrophobicContact CD1-CG 4.31Å; F2250-L2261 HydrophobicContact CD2-CD1 4.39Å; F2250-L2261 HydrophobicContact CE1-CD1 3.38Å; F2250-L2261 VanDerWaalsContact CE1-CD1 3.47Å; F2250-L2261 HydrophobicContact CE1-CG 4.29Å; F2250-L2261 HydrophobicContact CE2-CD1 4.23Å; F2250-L2261 HydrophobicContact CG-CD1 4.21Å; F2250-L2261 HydrophobicContact CZ-CD1 3.97Å; L2258-L2261 HydrophobicContact CD2-CB 4.43Å; L2258-L2261 HydrophobicContact CD2-CD1 3.98Å; L2261-N2263 WeakPolarHBondContact CD2-OD1 3.39Å; L2261-Y2269 CarbonylContact O-C 3.55Å; L2261-Y2269 VanDerWaalsContact O-CA 3.3Å; L2261-Y2269 WeakPolarHBondContact O-CA 3.39Å; L2261-I2270 HydrophobicContact CB-CB 4.4Å; L2261-I2270 HydrophobicContact CD2-CD1 4.21Å; L2261-I2270 PolarHBondContact N-O 3.02Å; L2261-I2270 PolarHBondContact O-N 3.06Å; L2261-F2272 HydrophobicContact CB-CE2 3.78Å; L2261-F2272 HydrophobicContact CB-CZ 4.44Å; L2261-F2272 HydrophobicContact CD2-CE2 4.28Å; L2261-F2272 HydrophobicContact CD2-CZ 4.27Å
2262	K	89.6	Confident	87	Confident	41.2 Å²	41.2	51.9 Å²	51.9	18%	0.179	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	119.2	170.1	-178.3	175.5	-179	175.6	0	108.9	W2248 K2249 D2266 S2267 Y2269 D2669	W2248-K2262 CarbonylContact C-O 3.57Å; W2248-K2262 VanDerWaalsContact CA-O 3.26Å; W2248-K2262 WeakPolarHBondContact CA-O 3.26Å; K2249-K2262 HydrophobicContact CB-CB 4.21Å; K2249-K2262 HydrophobicContact CD-CD 4.42Å; K2249-K2262 PolarHBondContact N-O 2.95Å; K2249-K2262 PolarHBondContact O-N 2.82Å; K2262-D2266 WeakPolarHBondContact CE-O 3.38Å; K2262-D2266 PolarHBondContact NZ-O 3Å; K2262-S2267 VanDerWaalsContact CE-O 3.26Å; K2262-S2267 WeakPolarHBondContact CE-O 3.07Å; K2262-S2267 PolarHBondContact NZ-O 3.06Å; K2262-Y2269 HydrophobicContact CB-CD1 3.49Å; K2262-Y2269 VanDerWaalsContact CB-CD1 3.48Å; K2262-Y2269 HydrophobicContact CB-CD2 4.49Å; K2262-Y2269 HydrophobicContact CB-CE1 3.51Å; K2262-Y2269 HydrophobicContact CB-CE2 4.48Å; K2262-Y2269 HydrophobicContact CB-CG 4.02Å; K2262-Y2269 HydrophobicContact CD-CE1 4.26Å; K2262-Y2269 HydrophobicContact CD-CE2 4.28Å; K2262-Y2269 HydrophobicContact CG-CE1 4.45Å; K2262-D2669 IonicContact NZ-OD2 3.97Å
2263	N	84.1	Confident	87	Confident	37 Å²	37	53.5 Å²	53.5	20%	0.198	27%	0.272	C	S	.	.			trans	-74.7	154	169.9	-58.8	-41.1	0	0	0	109.8	Y1505 W2248 L2261 Q2265 D2266	Y1505-N2263 PolarHBondContact OH-OD1 3.34Å; W2248-N2263 HydrophobicContact CE3-CB 4.4Å; W2248-N2263 HydrophobicContact CH2-CB 4.16Å; W2248-N2263 WeakPolarHBondContact CH2-OD1 3.49Å; W2248-N2263 HydrophobicContact CZ3-CB 4.01Å; W2248-N2263 VanDerWaalsContact CZ3-CG 3.49Å; W2248-N2263 WeakPolarHBondContact CZ3-OD1 3.47Å; W2248-N2263 PolarHBondContact NE1-OD1 3.47Å; L2261-N2263 WeakPolarHBondContact CD2-OD1 3.39Å; N2263-Q2265 PolarHBondContact O-N 3.06Å; N2263-Q2265 VanDerWaalsContact O-N 3.14Å; N2263-D2266 HydrophobicContact CB-CB 4.29Å; N2263-D2266 VanDerWaalsContact CB-OD2 3.32Å; N2263-D2266 WeakPolarHBondContact CB-OD2 3.34Å; N2263-D2266 VanDerWaalsContact CG-OD2 3.3Å; N2263-D2266 PolarHBondContact ND2-OD2 3.21Å; N2263-D2266 PolarHBondContact O-N 3.08Å; N2263-D2266 VanDerWaalsContact O-N 3.11Å
2264	P	78.6	Confident	87	Confident	24.2 Å²	24.2	54.4 Å²	54.4	16%	0.157	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-30.6	178.4	-28.1	33.2	0	0	0	114.5	D2241 G2246 L2247 W2248 D2266 Y2670	D2241-P2264 HydrophobicContact CB-CB 4.15Å; D2241-P2264 HydrophobicContact CB-CG 4.16Å; G2246-P2264 VanDerWaalsContact CA-CB 3.45Å; L2247-P2264 WeakPolarHBondContact O-CA 3.45Å; W2248-P2264 VanDerWaalsContact CD1-CD 3.43Å; W2248-P2264 VanDerWaalsContact CD2-CD 3.46Å; W2248-P2264 HydrophobicContact CD2-CG 3.72Å; W2248-P2264 VanDerWaalsContact CD2-CG 3.45Å; W2248-P2264 VanDerWaalsContact CE2-CG 3.5Å; W2248-P2264 HydrophobicContact CE3-CG 3.75Å; W2248-P2264 HydrophobicContact CG-CG 3.96Å; W2248-P2264 HydrophobicContact CH2-CG 4.03Å; W2248-P2264 HydrophobicContact CZ2-CG 4.02Å; W2248-P2264 HydrophobicContact CZ3-CG 4.03Å; W2248-P2264 VanDerWaalsContact NE1-CD 3.3Å; W2248-P2264 VanDerWaalsContact NE1-CG 3.26Å; P2264-D2266 VanDerWaalsContact C-N 3.32Å; P2264-D2266 PolarHBondContact O-N 3.35Å; P2264-Y2670 HydrophobicContact CB-CD2 3.69Å; P2264-Y2670 HydrophobicContact CB-CE2 4.27Å; P2264-Y2670 HydrophobicContact CB-CG 4.45Å; P2264-Y2670 WeakPolarHBondContact O-CB 3.14Å; P2264-Y2670 WeakPolarHBondContact O-CD1 3.47Å; P2264-Y2670 WeakPolarHBondContact O-CE1 3.22Å
2265	Q	72.8	Confident	87.1	Confident	121.6 Å²	121.6	46.1 Å²	46.1	57%	0.568	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-11.4	-176.6	-56.9	-95.3	-26.2	0	0	113.6	N2244 N2263 Y2670	N2244-Q2265 PolarHBondContact ND2-NE2 3.38Å; N2263-Q2265 PolarHBondContact O-N 3.06Å; N2263-Q2265 VanDerWaalsContact O-N 3.14Å; Q2265-Y2670 HydrophobicContact CG-CD1 4.07Å; Q2265-Y2670 HydrophobicContact CG-CD2 4.28Å; Q2265-Y2670 HydrophobicContact CG-CE1 3.7Å; Q2265-Y2670 HydrophobicContact CG-CE2 3.93Å; Q2265-Y2670 HydrophobicContact CG-CG 4.35Å; Q2265-Y2670 PolarHBondContact NE2-OH 3.39Å; Q2265-Y2670 WeakPolarHBondContact O-CE1 3.03Å
2266	D	73.9	Confident	87	Confident	31.6 Å²	31.6	47.8 Å²	47.8	17%	0.169	25%	0.253	C	S	.	.			trans	-93.1	139.7	-173.8	-67.6	-22	0	0	0	111	K2262 N2263 P2264 S2268 P2287 Y2670 N2690	K2262-D2266 WeakPolarHBondContact CE-O 3.38Å; K2262-D2266 PolarHBondContact NZ-O 3Å; N2263-D2266 HydrophobicContact CB-CB 4.29Å; N2263-D2266 VanDerWaalsContact CB-OD2 3.32Å; N2263-D2266 WeakPolarHBondContact CB-OD2 3.34Å; N2263-D2266 VanDerWaalsContact CG-OD2 3.3Å; N2263-D2266 PolarHBondContact ND2-OD2 3.21Å; N2263-D2266 PolarHBondContact O-N 3.08Å; N2263-D2266 VanDerWaalsContact O-N 3.11Å; P2264-D2266 VanDerWaalsContact C-N 3.32Å; P2264-D2266 PolarHBondContact O-N 3.35Å; D2266-S2268 VanDerWaalsContact C-N 3.34Å; D2266-S2268 PolarHBondContact O-N 2.76Å; D2266-P2287 HydrophobicContact CB-CG 4.03Å; D2266-Y2670 PolarHBondContact O-OH 2.81Å; D2266-N2690 PolarHBondContact OD1-ND2 2.76Å; D2266-N2690 VanDerWaalsContact OD1-ND2 3.13Å
2267	S	74.2	Confident	86.7	Confident	72.4 Å²	72.4	53.6 Å²	53.6	51%	0.506	28%	0.276	S	S	.	.	S	Bend	trans	-74.5	-30.5	177.5	56.2	0	0	0	0	112.9	K2262 Y2670	K2262-S2267 VanDerWaalsContact CE-O 3.26Å; K2262-S2267 WeakPolarHBondContact CE-O 3.07Å; K2262-S2267 PolarHBondContact NZ-O 3.06Å; S2267-Y2670 WeakPolarHBondContact CA-OH 3.23Å; S2267-Y2670 PolarHBondContact N-OH 3.07Å; S2267-Y2670 VanDerWaalsContact N-OH 3.09Å
2268	S	80.9	Confident	86.2	Confident	44.6 Å²	44.6	53.5 Å²	53.5	31%	0.312	28%	0.279	S	S	.	.	S	Bend	trans	-128.4	175.8	-179.6	65.4	0	0	0	0	112	D2266 P2287	D2266-S2268 VanDerWaalsContact C-N 3.34Å; D2266-S2268 PolarHBondContact O-N 2.76Å; S2268-P2287 VanDerWaalsContact O-CG 3.31Å; S2268-P2287 WeakPolarHBondContact O-CG 3.26Å; S2268-P2287 VanDerWaalsContact OG-CA 3.29Å; S2268-P2287 WeakPolarHBondContact OG-CA 3.33Å; S2268-P2287 WeakPolarHBondContact OG-CB 3.32Å; S2268-P2287 WeakPolarHBondContact OG-CG 3.09Å; S2268-P2287 PolarHBondContact OG-O 3.32Å
2269	Y	88.8	Confident	85.8	Confident	73.6 Å²	73.6	53.5 Å²	53.5	29%	0.289	28%	0.283	S	S	.	.			trans	-86.1	144.2	-178.1	-67.7	-98.7	0	0	0	111.7	K2249 L2251 Y2260 L2261 K2262	K2249-Y2269 HydrophobicContact CB-CE1 4.09Å; K2249-Y2269 WeakPolarHBondContact CD-OH 3.35Å; L2251-Y2269 HydrophobicContact CD1-CD1 4.49Å; L2251-Y2269 HydrophobicContact CD1-CE1 4.15Å; L2251-Y2269 HydrophobicContact CG-CE1 4.39Å; Y2260-Y2269 HydrophobicContact CD1-CG 4.4Å; Y2260-Y2269 HydrophobicContact CG-CD1 4.48Å; L2261-Y2269 CarbonylContact O-C 3.55Å; L2261-Y2269 VanDerWaalsContact O-CA 3.3Å; L2261-Y2269 WeakPolarHBondContact O-CA 3.39Å; K2262-Y2269 HydrophobicContact CB-CD1 3.49Å; K2262-Y2269 VanDerWaalsContact CB-CD1 3.48Å; K2262-Y2269 HydrophobicContact CB-CD2 4.49Å; K2262-Y2269 HydrophobicContact CB-CE1 3.51Å; K2262-Y2269 HydrophobicContact CB-CE2 4.48Å; K2262-Y2269 HydrophobicContact CB-CG 4.02Å; K2262-Y2269 HydrophobicContact CD-CE1 4.26Å; K2262-Y2269 HydrophobicContact CD-CE2 4.28Å; K2262-Y2269 HydrophobicContact CG-CE1 4.45Å
2270	I	89.6	Confident	85.3	Confident	9 Å²	9	57.3 Å²	57.3	5%	0.046	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	133	153.5	-57.5	166.9	0	0	0	107.4	Y2260 L2261 F2272 I2284 T2285 Y2286 P2287	Y2260-I2270 CarbonylContact C-O 3.53Å; Y2260-I2270 VanDerWaalsContact CA-O 3.27Å; Y2260-I2270 WeakPolarHBondContact CA-O 3.31Å; L2261-I2270 HydrophobicContact CB-CB 4.4Å; L2261-I2270 HydrophobicContact CD2-CD1 4.21Å; L2261-I2270 PolarHBondContact N-O 3.02Å; L2261-I2270 PolarHBondContact O-N 3.06Å; I2270-F2272 HydrophobicContact CB-CE2 4.39Å; I2270-F2272 HydrophobicContact CG2-CD2 4.46Å; I2270-F2272 HydrophobicContact CG2-CE1 4.32Å; I2270-F2272 HydrophobicContact CG2-CE2 3.99Å; I2270-F2272 HydrophobicContact CG2-CZ 3.86Å; I2270-I2284 HydrophobicContact CG2-CG2 3.62Å; I2270-T2285 CarbonylContact C-O 3.54Å; I2270-T2285 WeakPolarHBondContact CA-O 3.39Å; I2270-Y2286 HydrophobicContact CD1-CD1 4.11Å; I2270-Y2286 HydrophobicContact CD1-CE1 4.17Å; I2270-Y2286 HydrophobicContact CG1-CD1 3.99Å; I2270-Y2286 HydrophobicContact CG1-CE1 4.43Å; I2270-Y2286 HydrophobicContact CG2-CD1 4.37Å; I2270-Y2286 HydrophobicContact CG2-CE1 4.43Å; I2270-P2287 HydrophobicContact CG1-CG 4.32Å
2271	Q	93.3	Very high	84.9	Confident	66.8 Å²	66.8	54.5 Å²	54.5	31%	0.312	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	134.3	180	-57.6	-175.6	-15.1	0	0	110.1	T2259 Y2260 H2273 I2284 T2285	T2259-Q2271 CarbonylContact O-C 3.6Å; T2259-Q2271 WeakPolarHBondContact O-CA 3.33Å; Y2260-Q2271 HydrophobicContact CD1-CB 4.15Å; Y2260-Q2271 HydrophobicContact CD1-CG 3.78Å; Y2260-Q2271 HydrophobicContact CE1-CB 4.05Å; Y2260-Q2271 VanDerWaalsContact CE1-CD 3.48Å; Y2260-Q2271 HydrophobicContact CE1-CG 3.58Å; Y2260-Q2271 VanDerWaalsContact CE1-CG 3.48Å; Y2260-Q2271 PolarHBondContact OH-NE2 3.26Å; Y2260-Q2271 VanDerWaalsContact OH-NE2 3.09Å; Q2271-H2273 PolarHBondContact NE2-CE1 3.14Å; Q2271-I2284 CarbonylContact O-C 3.57Å; Q2271-I2284 WeakPolarHBondContact O-CA 3.33Å; Q2271-T2285 PolarHBondContact N-O 3.03Å; Q2271-T2285 PolarHBondContact O-N 3Å
2272	F	93.8	Very high	84.5	Confident	23.8 Å²	23.8	57.1 Å²	57.1	10%	0.104	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	122.9	176.9	-59.4	-88.6	0	0	0	109.4	L1503 L2258 T2259 L2261 I2270 Y2274 L2281 I2284	L1503-F2272 HydrophobicContact CD1-CD1 4.14Å; L1503-F2272 HydrophobicContact CD1-CE1 3.73Å; L1503-F2272 HydrophobicContact CD1-CZ 4.4Å; L1503-F2272 HydrophobicContact CD2-CD1 3.66Å; L1503-F2272 HydrophobicContact CD2-CD2 4.12Å; L1503-F2272 HydrophobicContact CD2-CE1 3.65Å; L1503-F2272 HydrophobicContact CD2-CE2 4.09Å; L1503-F2272 HydrophobicContact CD2-CG 3.91Å; L1503-F2272 HydrophobicContact CD2-CZ 3.87Å; L1503-F2272 HydrophobicContact CG-CE1 4.37Å; L2258-F2272 HydrophobicContact CD2-CD2 4.32Å; L2258-F2272 HydrophobicContact CD2-CE2 3.86Å; L2258-F2272 HydrophobicContact CD2-CZ 4.19Å; L2258-F2272 HydrophobicContact CG-CD2 4.18Å; L2258-F2272 HydrophobicContact CG-CE2 4.17Å; L2258-F2272 WeakPolarHBondContact O-CB 3.39Å; L2258-F2272 WeakPolarHBondContact O-CD2 3.36Å; L2258-F2272 WeakPolarHBondContact O-CG 3.37Å; T2259-F2272 PolarHBondContact O-N 2.99Å; L2261-F2272 HydrophobicContact CB-CE2 3.78Å; L2261-F2272 HydrophobicContact CB-CZ 4.44Å; L2261-F2272 HydrophobicContact CD2-CE2 4.28Å; L2261-F2272 HydrophobicContact CD2-CZ 4.27Å; I2270-F2272 HydrophobicContact CB-CE2 4.39Å; I2270-F2272 HydrophobicContact CG2-CD2 4.46Å; I2270-F2272 HydrophobicContact CG2-CE1 4.32Å; I2270-F2272 HydrophobicContact CG2-CE2 3.99Å; I2270-F2272 HydrophobicContact CG2-CZ 3.86Å; F2272-Y2274 HydrophobicContact CB-CD2 4.47Å; F2272-Y2274 HydrophobicContact CB-CE2 3.65Å; F2272-L2281 HydrophobicContact CB-CD1 3.82Å; F2272-L2281 HydrophobicContact CD1-CD1 4.01Å; F2272-L2281 HydrophobicContact CD1-CD2 4.38Å; F2272-L2281 HydrophobicContact CG-CD1 4.41Å; F2272-I2284 HydrophobicContact CD1-CB 4.48Å; F2272-I2284 HydrophobicContact CD1-CD1 4.34Å; F2272-I2284 HydrophobicContact CD1-CG1 3.96Å; F2272-I2284 HydrophobicContact CD1-CG2 4.15Å; F2272-I2284 HydrophobicContact CE1-CD1 4.16Å; F2272-I2284 HydrophobicContact CE1-CG1 4.21Å; F2272-I2284 HydrophobicContact CE1-CG2 3.99Å
2273	H	91.6	Very high	84.3	Confident	67.8 Å²	67.8	58.3 Å²	58.3	31%	0.314	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	121.9	-178.5	-57.5	-54.8	0	0	0	109.4	Q2271 L2282 Q2283 T2285	Q2271-H2273 PolarHBondContact NE2-CE1 3.14Å; H2273-L2282 WeakPolarHBondContact O-CB 3.37Å; H2273-L2282 PolarHBondContact O-N 2.95Å; H2273-Q2283 HydrophobicContact CB-CB 4.17Å; H2273-Q2283 PolarHBondContact CD2-O 2.87Å; H2273-Q2283 PolarHBondContact N-O 3.04Å; H2273-Q2283 PolarHBondContact ND1-O 2.81Å; H2273-Q2283 PolarHBondContact O-N 3.23Å; H2273-T2285 PolarHBondContact CD2-OG1 3.45Å; H2273-T2285 PolarHBondContact CE1-OG1 2.84Å; H2273-T2285 PolarHBondContact NE2-OG1 2.85Å; H2273-T2285 VanDerWaalsContact NE2-OG1 3.13Å
2274	Y	90.7	Very high	84.4	Confident	49 Å²	49	57.2 Å²	57.2	19%	0.192	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	152.1	-178	-60.7	-88.8	0	0	0	111.5	L1503 L2257 L2258 F2272 P2276 G2279 R2280 L2281	L1503-Y2274 WeakPolarHBondContact CD2-OH 3.39Å; L2257-Y2274 HydrophobicContact CB-CD2 4.03Å; L2257-Y2274 HydrophobicContact CB-CE1 4.4Å; L2257-Y2274 HydrophobicContact CB-CE2 3.82Å; L2257-Y2274 HydrophobicContact CB-CG 4.42Å; L2257-Y2274 HydrophobicContact CD1-CD1 4.14Å; L2257-Y2274 HydrophobicContact CD1-CD2 4.23Å; L2257-Y2274 HydrophobicContact CD1-CE1 4.5Å; L2257-Y2274 HydrophobicContact CD1-CG 3.89Å; L2257-Y2274 HydrophobicContact CD2-CD1 4.45Å; L2257-Y2274 HydrophobicContact CD2-CE1 4.41Å; L2258-Y2274 VanDerWaalsContact O-CE2 3.25Å; L2258-Y2274 WeakPolarHBondContact O-CE2 3.31Å; L2258-Y2274 PolarHBondContact O-OH 3.26Å; L2258-Y2274 VanDerWaalsContact O-OH 3.09Å; F2272-Y2274 HydrophobicContact CB-CD2 4.47Å; F2272-Y2274 HydrophobicContact CB-CE2 3.65Å; Y2274-P2276 WeakPolarHBondContact O-CD 3.36Å; Y2274-G2279 VanDerWaalsContact CD1-O 3.29Å; Y2274-G2279 WeakPolarHBondContact CD1-O 3.37Å; Y2274-R2280 CarbonylContact C-O 3.49Å; Y2274-R2280 VanDerWaalsContact CA-O 3.28Å; Y2274-R2280 WeakPolarHBondContact CA-O 3.4Å; Y2274-L2281 HydrophobicContact CD1-CB 4.1Å; Y2274-L2281 HydrophobicContact CD1-CD1 4.13Å; Y2274-L2281 HydrophobicContact CE1-CB 3.98Å; Y2274-L2281 HydrophobicContact CE1-CD1 3.78Å; Y2274-L2281 HydrophobicContact CE1-CG 4.43Å; Y2274-L2281 HydrophobicContact CE2-CD1 4.42Å
2275	A	85.6	Confident	84.7	Confident	14.6 Å²	14.6	57.4 Å²	57.4	12%	0.121	30%	0.299	C	S	.	.			trans	-68.9	122.2	167.7	0	0	0	0	0	109.1	E2277 S2278 G2279 R2280 L2282	A2275-E2277 VanDerWaalsContact C-N 3.28Å; A2275-E2277 PolarHBondContact O-N 3.14Å; A2275-S2278 WeakPolarHBondContact CB-OG 3.41Å; A2275-S2278 PolarHBondContact O-N 3.08Å; A2275-G2279 WeakPolarHBondContact O-CA 3.31Å; A2275-G2279 PolarHBondContact O-N 3.12Å; A2275-R2280 HydrophobicContact CB-CB 4.43Å; A2275-R2280 PolarHBondContact N-O 2.98Å; A2275-L2282 HydrophobicContact CB-CD1 3.94Å; A2275-L2282 HydrophobicContact CB-CD2 4.1Å; A2275-L2282 HydrophobicContact CB-CG 4Å
2276	P	83.1	Confident	85.2	Confident	118.8 Å²	118.8	54.6 Å²	54.6	77%	0.771	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-26	-172.6	22.4	-32.2	0	0	0	113.5	Y2274	Y2274-P2276 WeakPolarHBondContact O-CD 3.36Å
2277	E	79.8	Confident	85.3	Confident	137.6 Å²	137.6	54.9 Å²	54.9	64%	0.643	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-29.4	-175.6	-58.5	-168.6	-173.9	0	0	113.5	Y1574 A2275 T2582 S2588 H2598 F2599	Y1574-E2277 HydrophobicContact CD2-CB 4.22Å; Y1574-E2277 HydrophobicContact CE2-CB 4.09Å; A2275-E2277 VanDerWaalsContact C-N 3.28Å; A2275-E2277 PolarHBondContact O-N 3.14Å; E2277-T2582 HydrophobicContact CB-CG2 4.14Å; E2277-S2588 WeakPolarHBondContact OE1-CA 3.06Å; E2277-S2588 VanDerWaalsContact OE2-C 3.27Å; E2277-S2588 WeakPolarHBondContact OE2-CA 3.5Å; E2277-S2588 WeakPolarHBondContact OE2-CB 3.48Å; E2277-H2598 VanDerWaalsContact OE1-C 3.28Å; E2277-H2598 WeakPolarHBondContact OE1-CA 3.47Å; E2277-H2598 WeakPolarHBondContact OE1-CB 3.29Å; E2277-H2598 IonicContact OE1-ND1 2.82Å; E2277-F2599 PolarHBondContact OE1-N 3.13Å; E2277-F2599 WeakPolarHBondContact OE2-CA 3.45Å; E2277-F2599 WeakPolarHBondContact OE2-CB 3.43Å; E2277-F2599 PolarHBondContact OE2-N 2.89Å
2278	S	82.7	Confident	85.3	Confident	34.8 Å²	34.8	54.1 Å²	54.1	24%	0.243	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.5	-11.2	-170.9	66.8	0	0	0	0	114.9	K1527 Y1574 A2275 R2280	K1527-S2278 PolarHBondContact N-O 2.97Å; Y1574-S2278 VanDerWaalsContact CZ-CB 3.44Å; A2275-S2278 WeakPolarHBondContact CB-OG 3.41Å; A2275-S2278 PolarHBondContact O-N 3.08Å; S2278-R2280 VanDerWaalsContact CB-NH1 3.29Å; S2278-R2280 PolarHBondContact O-N 3.05Å; S2278-R2280 VanDerWaalsContact O-N 3.14Å; S2278-R2280 WeakPolarHBondContact OG-CB 3.42Å; S2278-R2280 WeakPolarHBondContact OG-CG 3.45Å; S2278-R2280 PolarHBondContact OG-N 3.05Å; S2278-R2280 PolarHBondContact OG-NH1 2.9Å
2279	G	84.8	Confident	85	Confident	17.6 Å²	17.6	55.3 Å²	55.3	18%	0.181	29%	0.29	C	S	.	.			trans	65.8	13.6	-173.3	0	0	0	0	0	114.2	G1525 Y2274 A2275	G1525-G2279 VanDerWaalsContact O-CA 3.25Å; G1525-G2279 WeakPolarHBondContact O-CA 2.95Å; Y2274-G2279 VanDerWaalsContact CD1-O 3.29Å; Y2274-G2279 WeakPolarHBondContact CD1-O 3.37Å; A2275-G2279 WeakPolarHBondContact O-CA 3.31Å; A2275-G2279 PolarHBondContact O-N 3.12Å
2280	R	84.5	Confident	84.2	Confident	111.8 Å²	111.8	55.3 Å²	55.3	42%	0.422	29%	0.292	S	S	.	.			trans	-76.3	137.2	176.4	-72.5	-177.7	177.5	171.7	0.3	111	G1501 Y1526 K1527 Y2274 A2275 S2278 L2282 K2583	G1501-R2280 CarbonylContact O-C 3.53Å; G1501-R2280 VanDerWaalsContact O-CA 3.31Å; G1501-R2280 WeakPolarHBondContact O-CA 3.39Å; Y1526-R2280 HydrophobicContact CD2-CG 4.45Å; Y1526-R2280 HydrophobicContact CE2-CG 3.77Å; K1527-R2280 PolarHBondContact O-NH1 3.39Å; K1527-R2280 VanDerWaalsContact O-NH1 3.11Å; Y2274-R2280 CarbonylContact C-O 3.49Å; Y2274-R2280 VanDerWaalsContact CA-O 3.28Å; Y2274-R2280 WeakPolarHBondContact CA-O 3.4Å; A2275-R2280 HydrophobicContact CB-CB 4.43Å; A2275-R2280 PolarHBondContact N-O 2.98Å; S2278-R2280 VanDerWaalsContact CB-NH1 3.29Å; S2278-R2280 PolarHBondContact O-N 3.05Å; S2278-R2280 VanDerWaalsContact O-N 3.14Å; S2278-R2280 WeakPolarHBondContact OG-CB 3.42Å; S2278-R2280 WeakPolarHBondContact OG-CG 3.45Å; S2278-R2280 PolarHBondContact OG-N 3.05Å; S2278-R2280 PolarHBondContact OG-NH1 2.9Å; R2280-L2282 PolarHBondContact O-N 3.03Å; R2280-K2583 HydrophobicContact CG-CD 3.88Å; R2280-K2583 HydrophobicContact CG-CG 3.68Å; R2280-K2583 VanDerWaalsContact CZ-CG 3.48Å; R2280-K2583 VanDerWaalsContact NH2-CA 3.27Å
2281	L	86.3	Confident	83.5	Confident	32.2 Å²	32.2	57.8 Å²	57.8	17%	0.169	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	120.7	176.5	-174.2	67.3	0	0	0	110.3	V1498 G1501 L1503 F2272 Y2274 I2284 V2294	V1498-L2281 HydrophobicContact CG2-CD2 3.95Å; G1501-L2281 PolarHBondContact O-N 3.44Å; L1503-L2281 HydrophobicContact CB-CD2 4.19Å; L1503-L2281 HydrophobicContact CD1-CD2 4.16Å; F2272-L2281 HydrophobicContact CB-CD1 3.82Å; F2272-L2281 HydrophobicContact CD1-CD1 4.01Å; F2272-L2281 HydrophobicContact CD1-CD2 4.38Å; F2272-L2281 HydrophobicContact CG-CD1 4.41Å; Y2274-L2281 HydrophobicContact CD1-CB 4.1Å; Y2274-L2281 HydrophobicContact CD1-CD1 4.13Å; Y2274-L2281 HydrophobicContact CE1-CB 3.98Å; Y2274-L2281 HydrophobicContact CE1-CD1 3.78Å; Y2274-L2281 HydrophobicContact CE1-CG 4.43Å; Y2274-L2281 HydrophobicContact CE2-CD1 4.42Å; L2281-I2284 HydrophobicContact CD1-CG1 4.36Å; L2281-I2284 HydrophobicContact CD2-CD1 3.9Å; L2281-I2284 HydrophobicContact CD2-CG1 3.83Å; L2281-I2284 HydrophobicContact CG-CG1 4.32Å; L2281-V2294 HydrophobicContact CD2-CG1 4.39Å; L2281-V2294 HydrophobicContact CD2-CG2 4.01Å; L2281-V2294 HydrophobicContact CG-CB 4.47Å; L2281-V2294 HydrophobicContact CG-CG1 4.46Å; L2281-V2294 HydrophobicContact CG-CG2 4.09Å
2282	L	85	Confident	82.6	Confident	68.4 Å²	68.4	56 Å²	56	36%	0.358	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	-46.5	178.1	-64.6	176.6	0	0	0	111.1	H2273 A2275 R2280 V2294 T2295	H2273-L2282 WeakPolarHBondContact O-CB 3.37Å; H2273-L2282 PolarHBondContact O-N 2.95Å; A2275-L2282 HydrophobicContact CB-CD1 3.94Å; A2275-L2282 HydrophobicContact CB-CD2 4.1Å; A2275-L2282 HydrophobicContact CB-CG 4Å; R2280-L2282 PolarHBondContact O-N 3.03Å; L2282-V2294 WeakPolarHBondContact O-CB 3.24Å; L2282-V2294 PolarHBondContact O-N 3.11Å; L2282-T2295 HydrophobicContact CB-CG2 4.46Å; L2282-T2295 HydrophobicContact CD2-CG2 3.59Å
2283	Q	85.2	Confident	81.8	Confident	67 Å²	67	58.1 Å²	58.1	31%	0.313	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	145.3	-170.8	-171.7	-179.7	22.7	0	0	111.5	H2273 S2291 I2292	H2273-Q2283 HydrophobicContact CB-CB 4.17Å; H2273-Q2283 PolarHBondContact CD2-O 2.87Å; H2273-Q2283 PolarHBondContact N-O 3.04Å; H2273-Q2283 PolarHBondContact ND1-O 2.81Å; H2273-Q2283 PolarHBondContact O-N 3.23Å; Q2283-S2291 PolarHBondContact NE2-OG 3.27Å; Q2283-S2291 VanDerWaalsContact NE2-OG 3.11Å; Q2283-I2292 CarbonylContact C-O 3.56Å; Q2283-I2292 VanDerWaalsContact CA-O 3.25Å; Q2283-I2292 WeakPolarHBondContact CA-O 3.3Å; Q2283-I2292 WeakPolarHBondContact CG-O 3.24Å
2284	I	86.8	Confident	80.8	Confident	14.6 Å²	14.6	56 Å²	56	8%	0.075	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	125.7	170.3	-51.9	176.6	0	0	0	108	L1490 I1496 I2270 Q2271 F2272 L2281 Y2286 S2291 I2292 V2294	L1490-I2284 HydrophobicContact CD1-CD1 3.4Å; L1490-I2284 VanDerWaalsContact CD1-CD1 3.4Å; I1496-I2284 HydrophobicContact CG2-CD1 3.89Å; I2270-I2284 HydrophobicContact CG2-CG2 3.62Å; Q2271-I2284 CarbonylContact O-C 3.57Å; Q2271-I2284 WeakPolarHBondContact O-CA 3.33Å; F2272-I2284 HydrophobicContact CD1-CB 4.48Å; F2272-I2284 HydrophobicContact CD1-CD1 4.34Å; F2272-I2284 HydrophobicContact CD1-CG1 3.96Å; F2272-I2284 HydrophobicContact CD1-CG2 4.15Å; F2272-I2284 HydrophobicContact CE1-CD1 4.16Å; F2272-I2284 HydrophobicContact CE1-CG1 4.21Å; F2272-I2284 HydrophobicContact CE1-CG2 3.99Å; L2281-I2284 HydrophobicContact CD1-CG1 4.36Å; L2281-I2284 HydrophobicContact CD2-CD1 3.9Å; L2281-I2284 HydrophobicContact CD2-CG1 3.83Å; L2281-I2284 HydrophobicContact CG-CG1 4.32Å; I2284-Y2286 HydrophobicContact CB-CE2 4.34Å; I2284-Y2286 HydrophobicContact CG2-CD2 4.32Å; I2284-Y2286 HydrophobicContact CG2-CE1 4.33Å; I2284-Y2286 HydrophobicContact CG2-CE2 3.8Å; I2284-S2291 CarbonylContact O-C 3.51Å; I2284-S2291 WeakPolarHBondContact O-CA 3.25Å; I2284-S2291 WeakPolarHBondContact O-CB 3.29Å; I2284-I2292 HydrophobicContact CB-CB 4.47Å; I2284-I2292 PolarHBondContact N-O 3.24Å; I2284-I2292 PolarHBondContact O-N 2.91Å; I2284-V2294 HydrophobicContact CD1-CG2 4.21Å; I2284-V2294 HydrophobicContact CG1-CG2 4.09Å
2285	T	86.1	Confident	79.7	Confident	28.4 Å²	28.4	55.9 Å²	55.9	17%	0.174	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	119.5	177	-55.1	0	0	0	0	109.7	I2270 Q2271 H2273 K2290	I2270-T2285 CarbonylContact C-O 3.54Å; I2270-T2285 WeakPolarHBondContact CA-O 3.39Å; Q2271-T2285 PolarHBondContact N-O 3.03Å; Q2271-T2285 PolarHBondContact O-N 3Å; H2273-T2285 PolarHBondContact CD2-OG1 3.45Å; H2273-T2285 PolarHBondContact CE1-OG1 2.84Å; H2273-T2285 PolarHBondContact NE2-OG1 2.85Å; H2273-T2285 VanDerWaalsContact NE2-OG1 3.13Å; T2285-K2290 CarbonylContact C-O 3.58Å; T2285-K2290 WeakPolarHBondContact CA-O 3.44Å
2286	Y	81.8	Confident	78.4	Confident	62 Å²	62	62.9 Å²	62.9	24%	0.243	33%	0.334	C	S	.	.			trans	-87.6	162.2	-179.4	-69.4	-89.9	0	0	0	111.9	I1496 I2270 I2284 N2288 A2289 K2290 I2292	I1496-Y2286 HydrophobicContact CD1-CE1 4.11Å; I1496-Y2286 WeakPolarHBondContact CD1-OH 2.99Å; I2270-Y2286 HydrophobicContact CD1-CD1 4.11Å; I2270-Y2286 HydrophobicContact CD1-CE1 4.17Å; I2270-Y2286 HydrophobicContact CG1-CD1 3.99Å; I2270-Y2286 HydrophobicContact CG1-CE1 4.43Å; I2270-Y2286 HydrophobicContact CG2-CD1 4.37Å; I2270-Y2286 HydrophobicContact CG2-CE1 4.43Å; I2284-Y2286 HydrophobicContact CB-CE2 4.34Å; I2284-Y2286 HydrophobicContact CG2-CD2 4.32Å; I2284-Y2286 HydrophobicContact CG2-CE1 4.33Å; I2284-Y2286 HydrophobicContact CG2-CE2 3.8Å; Y2286-N2288 VanDerWaalsContact CB-OD1 3.29Å; Y2286-N2288 WeakPolarHBondContact CB-OD1 3.37Å; Y2286-N2288 PolarHBondContact O-N 2.99Å; Y2286-A2289 WeakPolarHBondContact O-CA 3.38Å; Y2286-A2289 PolarHBondContact O-N 2.81Å; Y2286-K2290 HydrophobicContact CD2-CB 4.34Å; Y2286-K2290 HydrophobicContact CD2-CD 4.12Å; Y2286-K2290 WeakPolarHBondContact CD2-O 3.31Å; Y2286-K2290 HydrophobicContact CE2-CD 4.48Å; Y2286-K2290 PolarHBondContact N-O 2.96Å; Y2286-I2292 HydrophobicContact CE2-CB 4.44Å; Y2286-I2292 HydrophobicContact CE2-CD1 3.61Å; Y2286-I2292 HydrophobicContact CE2-CG1 3.96Å; Y2286-I2292 WeakPolarHBondContact OH-CD1 3.43Å
2287	P	77.4	Confident	77	Confident	38.4 Å²	38.4	59 Å²	59	25%	0.249	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.3	-32.6	175.5	-37.4	40.4	0	0	0	116.2	D2266 S2268 I2270 A2289	D2266-P2287 HydrophobicContact CB-CG 4.03Å; S2268-P2287 VanDerWaalsContact O-CG 3.31Å; S2268-P2287 WeakPolarHBondContact O-CG 3.26Å; S2268-P2287 VanDerWaalsContact OG-CA 3.29Å; S2268-P2287 WeakPolarHBondContact OG-CA 3.33Å; S2268-P2287 WeakPolarHBondContact OG-CB 3.32Å; S2268-P2287 WeakPolarHBondContact OG-CG 3.09Å; S2268-P2287 PolarHBondContact OG-O 3.32Å; I2270-P2287 HydrophobicContact CG1-CG 4.32Å; P2287-A2289 PolarHBondContact O-N 3.04Å
2288	N	73.5	Confident	75.8	Confident	55.4 Å²	55.4	55.4 Å²	55.4	30%	0.296	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	15	178.1	60.5	12	0	0	0	113.6	Y2286 K2290 G2691 I2692 K2693 N2695 S2715	Y2286-N2288 VanDerWaalsContact CB-OD1 3.29Å; Y2286-N2288 WeakPolarHBondContact CB-OD1 3.37Å; Y2286-N2288 PolarHBondContact O-N 2.99Å; N2288-K2290 PolarHBondContact O-N 3.35Å; N2288-K2290 VanDerWaalsContact O-N 3.1Å; N2288-K2290 VanDerWaalsContact OD1-CB 3.26Å; N2288-K2290 WeakPolarHBondContact OD1-CB 3.29Å; N2288-K2290 WeakPolarHBondContact OD1-CG 3.38Å; N2288-K2290 PolarHBondContact OD1-N 3.07Å; N2288-K2290 VanDerWaalsContact OD1-N 3.13Å; N2288-G2691 WeakPolarHBondContact CA-O 3.18Å; N2288-G2691 WeakPolarHBondContact CB-O 3.18Å; N2288-I2692 CarbonylContact O-C 3.59Å; N2288-I2692 WeakPolarHBondContact O-CA 3.44Å; N2288-K2693 WeakPolarHBondContact O-CA 2.97Å; N2288-K2693 PolarHBondContact O-N 3.27Å; N2288-N2695 PolarHBondContact ND2-OD1 2.96Å; N2288-S2715 WeakPolarHBondContact CB-OG 3.34Å; N2288-S2715 VanDerWaalsContact CG-OG 3.24Å; N2288-S2715 WeakPolarHBondContact ND2-CB 3.32Å; N2288-S2715 PolarHBondContact ND2-OG 3.1Å; N2288-S2715 VanDerWaalsContact ND2-OG 3.11Å
2289	A	74.4	Confident	74.2	Confident	70.6 Å²	70.6	61.9 Å²	61.9	58%	0.583	31%	0.313	S	S	*	.	S	Bend	trans	59.8	8.4	-174.2	0	0	0	0	0	115.4	Y2286 P2287 S2291 I2692	Y2286-A2289 WeakPolarHBondContact O-CA 3.38Å; Y2286-A2289 PolarHBondContact O-N 2.81Å; P2287-A2289 PolarHBondContact O-N 3.04Å; A2289-S2291 PolarHBondContact O-N 2.86Å; A2289-I2692 HydrophobicContact CB-CG1 4.43Å; A2289-I2692 HydrophobicContact CB-CG2 4.14Å
2290	K	72.5	Confident	72.2	Confident	72.8 Å²	72.8	63.6 Å²	63.6	32%	0.317	32%	0.322	S	S	.	.			trans	-67.5	131.8	167.9	-137	-169.8	180	-179.7	0	108.4	T2285 Y2286 N2288 I2292 D2351 S2715 D2716 V2717	T2285-K2290 CarbonylContact C-O 3.58Å; T2285-K2290 WeakPolarHBondContact CA-O 3.44Å; Y2286-K2290 HydrophobicContact CD2-CB 4.34Å; Y2286-K2290 HydrophobicContact CD2-CD 4.12Å; Y2286-K2290 WeakPolarHBondContact CD2-O 3.31Å; Y2286-K2290 HydrophobicContact CE2-CD 4.48Å; Y2286-K2290 PolarHBondContact N-O 2.96Å; N2288-K2290 PolarHBondContact O-N 3.35Å; N2288-K2290 VanDerWaalsContact O-N 3.1Å; N2288-K2290 VanDerWaalsContact OD1-CB 3.26Å; N2288-K2290 WeakPolarHBondContact OD1-CB 3.29Å; N2288-K2290 WeakPolarHBondContact OD1-CG 3.38Å; N2288-K2290 PolarHBondContact OD1-N 3.07Å; N2288-K2290 VanDerWaalsContact OD1-N 3.13Å; K2290-I2292 HydrophobicContact CD-CG1 4.37Å; K2290-D2351 IonicContact NZ-OD2 3.91Å; K2290-D2351 PolarHBondContact NZ-OD2 3.26Å; K2290-S2715 WeakPolarHBondContact CD-O 3.41Å; K2290-S2715 WeakPolarHBondContact CE-O 3.44Å; K2290-S2715 PolarHBondContact NZ-O 2.86Å; K2290-D2716 VanDerWaalsContact CE-O 3.26Å; K2290-D2716 WeakPolarHBondContact CE-O 3.37Å; K2290-D2716 PolarHBondContact NZ-O 2.65Å; K2290-V2717 PolarHBondContact NZ-O 2.71Å
2291	S	75	Confident	70.1	Confident	61.6 Å²	61.6	63.4 Å²	63.4	43%	0.431	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	139.3	173.3	67	0	0	0	0	111.9	Q2283 I2284 A2289	Q2283-S2291 PolarHBondContact NE2-OG 3.27Å; Q2283-S2291 VanDerWaalsContact NE2-OG 3.11Å; I2284-S2291 CarbonylContact O-C 3.51Å; I2284-S2291 WeakPolarHBondContact O-CA 3.25Å; I2284-S2291 WeakPolarHBondContact O-CB 3.29Å; A2289-S2291 PolarHBondContact O-N 2.86Å
2292	I	73.3	Confident	67.8	Low	28.6 Å²	28.6	65.7 Å²	65.7	15%	0.147	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	114.2	173.7	-63.5	-178.8	0	0	0	107.3	L1490 Q2283 I2284 Y2286 K2290 V2294 I2297	L1490-I2292 HydrophobicContact CD1-CD1 4.17Å; L1490-I2292 HydrophobicContact CD1-CG2 4.47Å; L1490-I2292 HydrophobicContact CD2-CG2 4.47Å; Q2283-I2292 CarbonylContact C-O 3.56Å; Q2283-I2292 VanDerWaalsContact CA-O 3.25Å; Q2283-I2292 WeakPolarHBondContact CA-O 3.3Å; Q2283-I2292 WeakPolarHBondContact CG-O 3.24Å; I2284-I2292 HydrophobicContact CB-CB 4.47Å; I2284-I2292 PolarHBondContact N-O 3.24Å; I2284-I2292 PolarHBondContact O-N 2.91Å; Y2286-I2292 HydrophobicContact CE2-CB 4.44Å; Y2286-I2292 HydrophobicContact CE2-CD1 3.61Å; Y2286-I2292 HydrophobicContact CE2-CG1 3.96Å; Y2286-I2292 WeakPolarHBondContact OH-CD1 3.43Å; K2290-I2292 HydrophobicContact CD-CG1 4.37Å; I2292-V2294 HydrophobicContact CG2-CG2 4.18Å; I2292-V2294 PolarHBondContact O-N 3.1Å; I2292-I2297 HydrophobicContact CG2-CD1 3.36Å; I2292-I2297 VanDerWaalsContact CG2-CD1 3.42Å; I2292-I2297 HydrophobicContact CG2-CG1 4.3Å
2293	D	76.9	Confident	65.4	Low	68.6 Å²	68.6	65.5 Å²	65.5	37%	0.367	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	104.1	169.5	-173.5	-13.8	0	0	0	109.1	T2295 R2296 I2297	D2293-T2295 VanDerWaalsContact C-N 3.3Å; D2293-T2295 PolarHBondContact O-N 3.13Å; D2293-T2295 WeakPolarHBondContact OD1-CA 3.42Å; D2293-T2295 WeakPolarHBondContact OD1-CB 3.37Å; D2293-T2295 PolarHBondContact OD1-N 3.03Å; D2293-T2295 VanDerWaalsContact OD1-N 3.07Å; D2293-T2295 PolarHBondContact OD1-OG1 2.96Å; D2293-R2296 HydrophobicContact CB-CB 4.25Å; D2293-R2296 WeakPolarHBondContact O-CB 3.36Å; D2293-R2296 PolarHBondContact O-N 3.19Å; D2293-R2296 PolarHBondContact OD1-N 3.06Å; D2293-R2296 VanDerWaalsContact OD1-N 3.1Å; D2293-I2297 PolarHBondContact O-N 3.21Å
2294	V	71.9	Confident	62.7	Low	22.8 Å²	22.8	66 Å²	66	14%	0.138	35%	0.348	C	S	.	.	H	α-helix	trans	-68.5	-33.5	-176	179.1	0	0	0	0	110.5	V1498 L2281 L2282 I2284 I2292 R2296 I2297 V2298	V1498-V2294 HydrophobicContact CB-CG1 4.26Å; V1498-V2294 HydrophobicContact CG1-CG1 3.67Å; V1498-V2294 HydrophobicContact CG2-CG1 3.9Å; L2281-V2294 HydrophobicContact CD2-CG1 4.39Å; L2281-V2294 HydrophobicContact CD2-CG2 4.01Å; L2281-V2294 HydrophobicContact CG-CB 4.47Å; L2281-V2294 HydrophobicContact CG-CG1 4.46Å; L2281-V2294 HydrophobicContact CG-CG2 4.09Å; L2282-V2294 WeakPolarHBondContact O-CB 3.24Å; L2282-V2294 PolarHBondContact O-N 3.11Å; I2284-V2294 HydrophobicContact CD1-CG2 4.21Å; I2284-V2294 HydrophobicContact CG1-CG2 4.09Å; I2292-V2294 HydrophobicContact CG2-CG2 4.18Å; I2292-V2294 PolarHBondContact O-N 3.1Å; V2294-R2296 VanDerWaalsContact C-N 3.28Å; V2294-R2296 PolarHBondContact O-N 2.91Å; V2294-I2297 WeakPolarHBondContact O-CB 2.97Å; V2294-I2297 PolarHBondContact O-N 2.98Å; V2294-I2297 VanDerWaalsContact O-N 3.12Å; V2294-V2298 HydrophobicContact CG1-CG2 4.14Å; V2294-V2298 WeakPolarHBondContact O-CG2 3.41Å; V2294-V2298 PolarHBondContact O-N 2.98Å; V2294-V2298 VanDerWaalsContact O-N 3.15Å
2295	T	66.7	Low	60	Low	47.4 Å²	47.4	69.6 Å²	69.6	29%	0.291	37%	0.367	S	S	.	.	H	α-helix	trans	-63.4	-36.3	179.6	69.5	0	0	0	0	111.9	L2282 D2293 R2299	L2282-T2295 HydrophobicContact CB-CG2 4.46Å; L2282-T2295 HydrophobicContact CD2-CG2 3.59Å; D2293-T2295 VanDerWaalsContact C-N 3.3Å; D2293-T2295 PolarHBondContact O-N 3.13Å; D2293-T2295 WeakPolarHBondContact OD1-CA 3.42Å; D2293-T2295 WeakPolarHBondContact OD1-CB 3.37Å; D2293-T2295 PolarHBondContact OD1-N 3.03Å; D2293-T2295 VanDerWaalsContact OD1-N 3.07Å; D2293-T2295 PolarHBondContact OD1-OG1 2.96Å; T2295-R2299 VanDerWaalsContact O-CB 3.31Å; T2295-R2299 WeakPolarHBondContact O-CB 3.41Å; T2295-R2299 VanDerWaalsContact O-CD 3.29Å; T2295-R2299 WeakPolarHBondContact O-CD 3.16Å; T2295-R2299 VanDerWaalsContact O-CG 3.27Å; T2295-R2299 WeakPolarHBondContact O-CG 3.32Å; T2295-R2299 PolarHBondContact O-N 2.99Å; T2295-R2299 VanDerWaalsContact O-N 3.1Å
2296	R	58.5	Low	57.2	Low	161.8 Å²	161.8	73.2 Å²	73.2	61%	0.611	38%	0.383	S	S	*	.	H	α-helix	trans	-69.8	-39.6	175.9	-165.3	-179.2	90.2	118.4	3.1	112.1	D2293 V2294 R2299 S2300	D2293-R2296 HydrophobicContact CB-CB 4.25Å; D2293-R2296 WeakPolarHBondContact O-CB 3.36Å; D2293-R2296 PolarHBondContact O-N 3.19Å; D2293-R2296 PolarHBondContact OD1-N 3.06Å; D2293-R2296 VanDerWaalsContact OD1-N 3.1Å; V2294-R2296 VanDerWaalsContact C-N 3.28Å; V2294-R2296 PolarHBondContact O-N 2.91Å; R2296-R2299 PolarHBondContact O-N 3Å; R2296-S2300 WeakPolarHBondContact O-CB 3.28Å; R2296-S2300 PolarHBondContact O-N 3.23Å; R2296-S2300 VanDerWaalsContact O-N 3.1Å; R2296-S2300 PolarHBondContact O-OG 3.06Å
2297	I	54.3	Low	54.5	Low	36.6 Å²	36.6	80 Å²	80	19%	0.188	41%	0.408	C	S	.	.	H	α-helix	trans	-66.8	-48.9	179.8	-66	179.3	0	0	0	110.9	V1488 L1490 I2292 D2293 V2294 R2299 S2300 Q2301 I2336	V1488-I2297 HydrophobicContact CB-CG2 4.3Å; V1488-I2297 HydrophobicContact CG1-CG2 3.63Å; V1488-I2297 HydrophobicContact CG2-CG2 4.49Å; L1490-I2297 HydrophobicContact CD2-CD1 3.55Å; I2292-I2297 HydrophobicContact CG2-CD1 3.36Å; I2292-I2297 VanDerWaalsContact CG2-CD1 3.42Å; I2292-I2297 HydrophobicContact CG2-CG1 4.3Å; D2293-I2297 PolarHBondContact O-N 3.21Å; V2294-I2297 WeakPolarHBondContact O-CB 2.97Å; V2294-I2297 PolarHBondContact O-N 2.98Å; V2294-I2297 VanDerWaalsContact O-N 3.12Å; I2297-R2299 VanDerWaalsContact C-N 3.29Å; I2297-R2299 PolarHBondContact O-N 2.91Å; I2297-S2300 WeakPolarHBondContact CA-OG 3.43Å; I2297-S2300 CarbonylContact O-C 3.42Å; I2297-S2300 WeakPolarHBondContact O-CA 3.44Å; I2297-S2300 PolarHBondContact O-N 3.07Å; I2297-S2300 VanDerWaalsContact O-N 3.1Å; I2297-S2300 PolarHBondContact O-OG 2.82Å; I2297-Q2301 HydrophobicContact CG2-CG 4.19Å; I2297-Q2301 WeakPolarHBondContact O-CB 3.45Å; I2297-Q2301 PolarHBondContact O-N 2.88Å; I2297-I2336 HydrophobicContact CG2-CD1 3.8Å
2298	V	53.6	Low	52.1	Low	62.4 Å²	62.4	84.5 Å²	84.5	38%	0.378	42%	0.424	S	S	.	.	H	α-helix	trans	-61.2	-39.2	179.2	176.7	0	0	0	0	110.8	V1498 V2294 S2300 Q2301 I2302	V1498-V2298 HydrophobicContact CG1-CG2 4.03Å; V2294-V2298 HydrophobicContact CG1-CG2 4.14Å; V2294-V2298 WeakPolarHBondContact O-CG2 3.41Å; V2294-V2298 PolarHBondContact O-N 2.98Å; V2294-V2298 VanDerWaalsContact O-N 3.15Å; V2298-S2300 VanDerWaalsContact C-N 3.31Å; V2298-S2300 PolarHBondContact O-N 3Å; V2298-Q2301 PolarHBondContact O-N 3.05Å; V2298-I2302 HydrophobicContact CG1-CD1 3.95Å; V2298-I2302 HydrophobicContact CG1-CG1 4.48Å; V2298-I2302 WeakPolarHBondContact O-CD1 3.39Å; V2298-I2302 VanDerWaalsContact O-CG1 3.31Å; V2298-I2302 WeakPolarHBondContact O-CG1 3.42Å; V2298-I2302 PolarHBondContact O-N 3.16Å
2299	R	49.9	Very low	49.7	Very low	171.6 Å²	171.6	89.8 Å²	89.8	65%	0.648	45%	0.447	S	S	*	.	H	α-helix	trans	-64.9	-30.5	173.6	-75.2	176.9	-177	162.2	3.4	113.7	W2019 T2295 R2296 I2297 Q2301 I2302 M2546	W2019-R2299 WeakPolarHBondContact CZ3-O 3.48Å; T2295-R2299 VanDerWaalsContact O-CB 3.31Å; T2295-R2299 WeakPolarHBondContact O-CB 3.41Å; T2295-R2299 VanDerWaalsContact O-CD 3.29Å; T2295-R2299 WeakPolarHBondContact O-CD 3.16Å; T2295-R2299 VanDerWaalsContact O-CG 3.27Å; T2295-R2299 WeakPolarHBondContact O-CG 3.32Å; T2295-R2299 PolarHBondContact O-N 2.99Å; T2295-R2299 VanDerWaalsContact O-N 3.1Å; R2296-R2299 PolarHBondContact O-N 3Å; I2297-R2299 VanDerWaalsContact C-N 3.29Å; I2297-R2299 PolarHBondContact O-N 2.91Å; R2299-Q2301 VanDerWaalsContact C-N 3.27Å; R2299-Q2301 PolarHBondContact O-N 2.67Å; R2299-I2302 WeakPolarHBondContact O-CB 3.36Å; R2299-I2302 PolarHBondContact O-N 2.94Å; R2299-M2546 PolarHBondContact NH2-SD 2.98Å
2300	S	43.6	Very low	47.4	Very low	52.6 Å²	52.6	91.6 Å²	91.6	37%	0.368	45%	0.451	S	S	.	.	H	α-helix	trans	-85.2	-21.2	179.4	66.5	0	0	0	0	114.6	R2296 I2297 V2298 I2302 V2304 L2332	R2296-S2300 WeakPolarHBondContact O-CB 3.28Å; R2296-S2300 PolarHBondContact O-N 3.23Å; R2296-S2300 VanDerWaalsContact O-N 3.1Å; R2296-S2300 PolarHBondContact O-OG 3.06Å; I2297-S2300 WeakPolarHBondContact CA-OG 3.43Å; I2297-S2300 CarbonylContact O-C 3.42Å; I2297-S2300 WeakPolarHBondContact O-CA 3.44Å; I2297-S2300 PolarHBondContact O-N 3.07Å; I2297-S2300 VanDerWaalsContact O-N 3.1Å; I2297-S2300 PolarHBondContact O-OG 2.82Å; V2298-S2300 VanDerWaalsContact C-N 3.31Å; V2298-S2300 PolarHBondContact O-N 3Å; S2300-I2302 CarbonylContact C-O 3.57Å; S2300-I2302 WeakPolarHBondContact CA-O 3.14Å; S2300-V2304 WeakPolarHBondContact O-CG2 3.41Å; S2300-L2332 WeakPolarHBondContact O-CD1 3.35Å
2301	Q	40.1	Very low	45.2	Very low	107.6 Å²	107.6	95.3 Å²	95.3	50%	0.503	47%	0.473	S	S	.	.	H	α-helix	trans	-91.2	-10.8	178.4	-76.2	-161.7	-22.2	0	0	113.9	S1486 V1488 I2297 V2298 R2299 P2303 T2334 I2336 S2720	S1486-Q2301 PolarHBondContact OG-NE2 3.27Å; V1488-Q2301 HydrophobicContact CG2-CG 3.8Å; V1488-Q2301 VanDerWaalsContact CG2-NE2 3.25Å; I2297-Q2301 HydrophobicContact CG2-CG 4.19Å; I2297-Q2301 WeakPolarHBondContact O-CB 3.45Å; I2297-Q2301 PolarHBondContact O-N 2.88Å; V2298-Q2301 PolarHBondContact O-N 3.05Å; R2299-Q2301 VanDerWaalsContact C-N 3.27Å; R2299-Q2301 PolarHBondContact O-N 2.67Å; Q2301-P2303 WeakPolarHBondContact O-CD 3.34Å; Q2301-T2334 PolarHBondContact NE2-OG1 3.3Å; Q2301-I2336 HydrophobicContact CG-CD1 4.35Å; Q2301-S2720 PolarHBondContact NE2-OG 2.97Å
2302	I	37.6	Very low	42.9	Very low	79.6 Å²	79.6	99.1 Å²	99.1	41%	0.408	49%	0.489	S	S	.	.	S	Bend	trans	-76.1	98.6	159.6	-56.9	166	0	0	0	106.2	V2298 R2299 S2300 V2304 M2306 A2541	V2298-I2302 HydrophobicContact CG1-CD1 3.95Å; V2298-I2302 HydrophobicContact CG1-CG1 4.48Å; V2298-I2302 WeakPolarHBondContact O-CD1 3.39Å; V2298-I2302 VanDerWaalsContact O-CG1 3.31Å; V2298-I2302 WeakPolarHBondContact O-CG1 3.42Å; V2298-I2302 PolarHBondContact O-N 3.16Å; R2299-I2302 WeakPolarHBondContact O-CB 3.36Å; R2299-I2302 PolarHBondContact O-N 2.94Å; S2300-I2302 CarbonylContact C-O 3.57Å; S2300-I2302 WeakPolarHBondContact CA-O 3.14Å; I2302-V2304 VanDerWaalsContact C-N 3.28Å; I2302-V2304 HydrophobicContact CG2-CG2 4.25Å; I2302-V2304 WeakPolarHBondContact O-CG2 3.46Å; I2302-V2304 PolarHBondContact O-N 3.08Å; I2302-V2304 VanDerWaalsContact O-N 3.13Å; I2302-M2306 HydrophobicContact CB-CE 4.47Å; I2302-M2306 HydrophobicContact CG2-CE 3.17Å; I2302-M2306 HydrophobicContact CG2-SD 3.36Å; I2302-M2306 WeakPolarHBondContact CG2-SD 3.14Å; I2302-A2541 HydrophobicContact CD1-CB 3.31Å
2303	P	33.3	Very low	40.7	Very low	64.6 Å²	64.6	106.6 Å²	106.6	42%	0.419	52%	0.524	S	S	.	.			trans	-70.2	95.7	173.3	18.6	-18.3	0	0	0	107.9	W2019 Q2301 N2305 M2306 L2332 T2334	W2019-P2303 HydrophobicContact CZ3-CG 4.26Å; Q2301-P2303 WeakPolarHBondContact O-CD 3.34Å; P2303-N2305 PolarHBondContact O-N 3.12Å; P2303-M2306 HydrophobicContact CG-CE 3.76Å; P2303-M2306 WeakPolarHBondContact O-CB 3.34Å; P2303-M2306 PolarHBondContact O-N 2.85Å; P2303-L2332 HydrophobicContact CB-CB 4.19Å; P2303-L2332 HydrophobicContact CB-CD1 4.43Å; P2303-T2334 HydrophobicContact CB-CG2 4.37Å
2304	V	30.1	Very low	38.4	Very low	78.4 Å²	78.4	109.4 Å²	109.4	48%	0.475	54%	0.543	S	S	.	.			trans	-84.9	76.9	171.4	-175.8	0	0	0	0	107.9	F2021 S2300 I2302 M2306 R2307	F2021-V2304 HydrophobicContact CD1-CG1 3.97Å; F2021-V2304 HydrophobicContact CD2-CB 4.44Å; F2021-V2304 HydrophobicContact CE1-CB 3.9Å; F2021-V2304 HydrophobicContact CE1-CG1 3.09Å; F2021-V2304 HydrophobicContact CE1-CG2 4.4Å; F2021-V2304 HydrophobicContact CE2-CB 3.55Å; F2021-V2304 HydrophobicContact CE2-CG1 3.76Å; F2021-V2304 HydrophobicContact CE2-CG2 3.74Å; F2021-V2304 HydrophobicContact CZ-CB 3.29Å; F2021-V2304 HydrophobicContact CZ-CG1 3.01Å; F2021-V2304 HydrophobicContact CZ-CG2 3.43Å; F2021-V2304 VanDerWaalsContact CZ-CG2 3.43Å; S2300-V2304 WeakPolarHBondContact O-CG2 3.41Å; I2302-V2304 VanDerWaalsContact C-N 3.28Å; I2302-V2304 HydrophobicContact CG2-CG2 4.25Å; I2302-V2304 WeakPolarHBondContact O-CG2 3.46Å; I2302-V2304 PolarHBondContact O-N 3.08Å; I2302-V2304 VanDerWaalsContact O-N 3.13Å; V2304-M2306 VanDerWaalsContact C-N 3.32Å; V2304-M2306 HydrophobicContact CG1-CG 4.09Å; V2304-M2306 PolarHBondContact O-N 2.86Å; V2304-M2306 VanDerWaalsContact O-N 3.1Å; V2304-R2307 PolarHBondContact O-N 3.49Å
2305	N	30	Very low	36.3	Very low	90 Å²	90	113.1 Å²	113.1	48%	0.481	57%	0.57	S	S	.	*			trans	-62.8	96.6	169.9	-79.7	-23.8	0	0	0	110.3	D2018 P2303 R2307 T2334 I2336 I2338	D2018-N2305 PolarHBondContact OD1-ND2 2.93Å; P2303-N2305 PolarHBondContact O-N 3.12Å; N2305-R2307 HydrophobicContact CB-CG 4.46Å; N2305-R2307 PolarHBondContact O-N 3.09Å; N2305-T2334 HydrophobicContact CB-CG2 4.07Å; N2305-T2334 WeakPolarHBondContact ND2-CG2 3.43Å; N2305-I2336 HydrophobicContact CB-CG1 3.96Å; N2305-I2336 WeakPolarHBondContact O-CD1 3.36Å; N2305-I2336 WeakPolarHBondContact O-CG2 3.39Å; N2305-I2338 HydrophobicContact CB-CD1 3.73Å; N2305-I2338 WeakPolarHBondContact ND2-CD1 3.25Å
2306	M	27.2	Very low	34.4	Very low	103 Å²	103	121.2 Å²	121.2	51%	0.507	60%	0.596	S	S	.	*			trans	-67.2	91.5	169.2	-76.9	-178.9	-85.4	0	0	111	D2018 F2021 I2302 P2303 V2304 F2308 I2336 H2346	D2018-M2306 WeakPolarHBondContact OD1-CG 3.2Å; D2018-M2306 VanDerWaalsContact OD2-CE 3.25Å; D2018-M2306 WeakPolarHBondContact OD2-CE 3.44Å; D2018-M2306 WeakPolarHBondContact OD2-CG 3.45Å; F2021-M2306 HydrophobicContact CD1-CE 3.37Å; F2021-M2306 HydrophobicContact CE1-CE 3.63Å; I2302-M2306 HydrophobicContact CB-CE 4.47Å; I2302-M2306 HydrophobicContact CG2-CE 3.17Å; I2302-M2306 HydrophobicContact CG2-SD 3.36Å; I2302-M2306 WeakPolarHBondContact CG2-SD 3.14Å; P2303-M2306 HydrophobicContact CG-CE 3.76Å; P2303-M2306 WeakPolarHBondContact O-CB 3.34Å; P2303-M2306 PolarHBondContact O-N 2.85Å; V2304-M2306 VanDerWaalsContact C-N 3.32Å; V2304-M2306 HydrophobicContact CG1-CG 4.09Å; V2304-M2306 PolarHBondContact O-N 2.86Å; V2304-M2306 VanDerWaalsContact O-N 3.1Å; M2306-F2308 HydrophobicContact CB-CD2 4.22Å; M2306-F2308 HydrophobicContact CB-CE2 4.1Å; M2306-F2308 HydrophobicContact CB-CZ 4.38Å; M2306-F2308 HydrophobicContact CG-CE2 4.49Å; M2306-F2308 PolarHBondContact O-N 3.18Å; M2306-F2308 VanDerWaalsContact O-N 3.08Å; M2306-F2308 HydrophobicContact SD-CE2 4.25Å; M2306-F2308 HydrophobicContact SD-CZ 4.33Å; M2306-I2336 HydrophobicContact CG-CG2 4.21Å; M2306-H2346 WeakPolarHBondContact CE-CD2 3.28Å; M2306-H2346 WeakPolarHBondContact CE-NE2 3.32Å; M2306-H2346 HydrophobicContact SD-CB 4.07Å; M2306-H2346 PolarHBondContact SD-CD2 2.54Å; M2306-H2346 VanDerWaalsContact SD-CG 3.58Å
2307	R	25	Very low	33	Very low	204.8 Å²	204.8	122 Å²	122	77%	0.773	61%	0.607	S	S	*	*			trans	-82.4	113.2	172.1	-94.5	-178.4	176	172.3	-1.9	109.3	V2304 N2305 H2309	V2304-R2307 PolarHBondContact O-N 3.49Å; N2305-R2307 HydrophobicContact CB-CG 4.46Å; N2305-R2307 PolarHBondContact O-N 3.09Å; R2307-H2309 PolarHBondContact O-N 2.86Å; R2307-H2309 VanDerWaalsContact O-N 3.1Å
2308	F	25.8	Very low	31.9	Very low	132.8 Å²	132.8	127.7 Å²	127.7	58%	0.582	64%	0.638	S	S	*	*			trans	-67.5	119.2	166.4	-65.2	-85.2	0	0	0	109.8	H2069 S2071 M2306 T2310 I2336 M2337	H2069-F2308 HydrophobicContact CB-CE1 4.13Å; H2069-F2308 AromaticContact CD2-CZ 3.95Å; H2069-F2308 AromaticContact CE1-CE1 3.92Å; H2069-F2308 AromaticContact CE1-CE2 3.9Å; H2069-F2308 AromaticContact CE1-CZ 3.36Å; H2069-F2308 WeakPolarHBondContact CE1-CZ 3.48Å; H2069-F2308 AromaticContact CG-CE1 3.76Å; H2069-F2308 AromaticContact CG-CZ 3.77Å; H2069-F2308 AromaticContact ND1-CE1 3.44Å; H2069-F2308 WeakPolarHBondContact ND1-CE1 3.34Å; H2069-F2308 AromaticContact ND1-CZ 3.39Å; H2069-F2308 WeakPolarHBondContact ND1-CZ 3.3Å; H2069-F2308 AromaticContact NE2-CZ 3.72Å; S2071-F2308 WeakPolarHBondContact OG-CD1 3.04Å; S2071-F2308 WeakPolarHBondContact OG-CE1 3.43Å; M2306-F2308 HydrophobicContact CB-CD2 4.22Å; M2306-F2308 HydrophobicContact CB-CE2 4.1Å; M2306-F2308 HydrophobicContact CB-CZ 4.38Å; M2306-F2308 HydrophobicContact CG-CE2 4.49Å; M2306-F2308 PolarHBondContact O-N 3.18Å; M2306-F2308 VanDerWaalsContact O-N 3.08Å; M2306-F2308 HydrophobicContact SD-CE2 4.25Å; M2306-F2308 HydrophobicContact SD-CZ 4.33Å; F2308-T2310 PolarHBondContact O-N 3.27Å; F2308-I2336 HydrophobicContact CE2-CB 3.87Å; F2308-I2336 HydrophobicContact CE2-CD1 4.49Å; F2308-I2336 HydrophobicContact CE2-CG1 3.85Å; F2308-I2336 HydrophobicContact CE2-CG2 3.59Å; F2308-I2336 HydrophobicContact CZ-CB 4.13Å; F2308-I2336 HydrophobicContact CZ-CG2 3.66Å; F2308-M2337 WeakPolarHBondContact CE1-O 3.15Å; F2308-M2337 WeakPolarHBondContact CZ-O 3.16Å
2309	H	24.4	Very low	30.7	Very low	168.2 Å²	168.2	132.4 Å²	132.4	78%	0.779	66%	0.661	S	S	*	*			trans	-77.7	107.8	154.8	-92.2	-80	0	0	0	107.1	R2307 L2311	R2307-H2309 PolarHBondContact O-N 2.86Å; R2307-H2309 VanDerWaalsContact O-N 3.1Å; H2309-L2311 HydrophobicContact CB-CG 4.48Å; H2309-L2311 PolarHBondContact O-N 3.11Å; H2309-L2311 VanDerWaalsContact O-N 3.16Å
2310	T	25.4	Very low	29.8	Very low	107.2 Å²	107.2	129.5 Å²	129.5	66%	0.658	66%	0.662	S	S	*	*			trans	-69.3	104.9	161.3	47.8	0	0	0	0	107.1	F2308 D2312	F2308-T2310 PolarHBondContact O-N 3.27Å; T2310-D2312 VanDerWaalsContact C-N 3.32Å; T2310-D2312 PolarHBondContact O-N 3.16Å
2311	L	25.9	Very low	29.2	Very low	150.4 Å²	150.4	133.5 Å²	133.5	79%	0.787	69%	0.687	S	S	*	*			trans	-76.3	94.7	161.6	-82.4	148.1	0	0	0	106.3	H2309 E2313	H2309-L2311 HydrophobicContact CB-CG 4.48Å; H2309-L2311 PolarHBondContact O-N 3.11Å; H2309-L2311 VanDerWaalsContact O-N 3.16Å; L2311-E2313 PolarHBondContact O-N 3.06Å; L2311-E2313 VanDerWaalsContact O-N 3.11Å
2312	D	28.2	Very low	28.7	Very low	141.4 Å²	141.4	137.3 Å²	137.3	76%	0.756	70%	0.702	S	S	*	*			trans	-81.5	105.4	156	-77.2	-24.2	0	0	0	108.2	T2310 V2314	T2310-D2312 VanDerWaalsContact C-N 3.32Å; T2310-D2312 PolarHBondContact O-N 3.16Å; D2312-V2314 PolarHBondContact O-N 2.94Å; D2312-V2314 VanDerWaalsContact O-N 3.11Å
2313	E	26.5	Very low	28.3	Very low	187.8 Å²	187.8	138.7 Å²	138.7	88%	0.878	72%	0.719	S	S	*	*			trans	-71.4	103.7	159.4	-75	-175.3	154.2	0	0	109.5	L2311 S2315	L2311-E2313 PolarHBondContact O-N 3.06Å; L2311-E2313 VanDerWaalsContact O-N 3.11Å; E2313-S2315 PolarHBondContact O-N 3.01Å; E2313-S2315 VanDerWaalsContact O-N 3.13Å
2314	V	28.6	Very low	28	Very low	127.2 Å²	127.2	142.2 Å²	142.2	77%	0.771	74%	0.739	S	S	*	*			trans	-98.1	105.3	161.2	-178.5	0	0	0	0	108.7	D2312 Y2316	D2312-V2314 PolarHBondContact O-N 2.94Å; D2312-V2314 VanDerWaalsContact O-N 3.11Å; V2314-Y2316 HydrophobicContact CG1-CD2 3.9Å; V2314-Y2316 PolarHBondContact O-N 3.07Å; V2314-Y2316 VanDerWaalsContact O-N 3.1Å
2315	S	26.8	Very low	27.8	Very low	100.2 Å²	100.2	143.1 Å²	143.1	70%	0.701	75%	0.748	S	S	*	*			trans	-46.6	119	160.1	56.8	0	0	0	0	113.7	E2313 Q2317	E2313-S2315 PolarHBondContact O-N 3.01Å; E2313-S2315 VanDerWaalsContact O-N 3.13Å; S2315-Q2317 PolarHBondContact O-N 2.92Å
2316	Y	27.7	Very low	27.6	Very low	216.8 Å²	216.8	144.6 Å²	144.6	85%	0.85	76%	0.761	S	S	*	*			trans	-77.2	124.8	149.1	-87.2	-83.2	0	0	0	113.2	V2314 D2318	V2314-Y2316 HydrophobicContact CG1-CD2 3.9Å; V2314-Y2316 PolarHBondContact O-N 3.07Å; V2314-Y2316 VanDerWaalsContact O-N 3.1Å; Y2316-D2318 PolarHBondContact O-N 2.97Å
2317	Q	29	Very low	27.6	Very low	179.4 Å²	179.4	146.8 Å²	146.8	84%	0.838	78%	0.775	S	S	*	*			trans	-98.1	113.7	159	-84.6	170.6	-18.9	0	0	113	S2315	S2315-Q2317 PolarHBondContact O-N 2.92Å
2318	D	31.6	Very low	27.6	Very low	155 Å²	155	142.1 Å²	142.1	83%	0.829	77%	0.769	S	S	*	*				-175	121.8	129.9	-103.7	-22.6	0	0	0	115	Y2316 T2320	Y2316-D2318 PolarHBondContact O-N 2.97Å; D2318-T2320 PolarHBondContact O-N 3.08Å
2319	N	28.2	Very low	27.7	Very low	162.2 Å²	162.2	141.3 Å²	141.3	87%	0.867	78%	0.777	S	S	*	*			trans	-63.5	99.6	165.3	-79.1	-29.2	0	0	0	111.7
2320	T	31.2	Very low	27.8	Very low	110.6 Å²	110.6	139.3 Å²	139.3	68%	0.679	77%	0.772	S	S	*	*			trans	-146.3	128.9	149	50.5	0	0	0	0	111.1	D2318 K2322	D2318-T2320 PolarHBondContact O-N 3.08Å; T2320-K2322 PolarHBondContact O-N 2.89Å; T2320-K2322 VanDerWaalsContact O-N 3.13Å
2321	P	30.1	Very low	28	Very low	136.4 Å²	136.4	141.6 Å²	141.6	89%	0.886	78%	0.775	S	S	*	*			trans	-80.4	104.5	-179.4	31	-29.9	0	0	0	109.5
2322	K	29.9	Very low	28.2	Very low	187 Å²	187	139.5 Å²	139.5	81%	0.813	76%	0.764	S	S	*	*			trans	-92.5	122.4	169.8	-81.5	-177	178.3	174.6	0	110.8	T2320 V2324	T2320-K2322 PolarHBondContact O-N 2.89Å; T2320-K2322 VanDerWaalsContact O-N 3.13Å; K2322-V2324 PolarHBondContact O-N 3.06Å
2323	S	28.4	Very low	28.2	Very low	108.8 Å²	108.8	135.7 Å²	135.7	76%	0.761	75%	0.749	S	S	*	*			trans	-13.3	118.5	166.3	57.7	0	0	0	0	115.8	S2325	S2323-S2325 VanDerWaalsContact C-N 3.33Å; S2323-S2325 PolarHBondContact O-N 2.94Å; S2323-S2325 VanDerWaalsContact O-N 3.1Å
2324	V	27.4	Very low	28.4	Very low	138.4 Å²	138.4	130 Å²	130	84%	0.839	73%	0.727	S	S	*	*			trans	-60.9	99	167.3	-179.6	0	0	0	0	109.1	K2322 T2326	K2322-V2324 PolarHBondContact O-N 3.06Å; V2324-T2326 HydrophobicContact CG1-CG2 4.1Å; V2324-T2326 PolarHBondContact O-N 2.8Å
2325	S	27.3	Very low	28.5	Very low	97.2 Å²	97.2	127.8 Å²	127.8	68%	0.68	71%	0.714	S	S	*	*			trans	-83	117.4	161	52.8	0	0	0	0	108.1	S2323 N2327	S2323-S2325 VanDerWaalsContact C-N 3.33Å; S2323-S2325 PolarHBondContact O-N 2.94Å; S2323-S2325 VanDerWaalsContact O-N 3.1Å; S2325-N2327 PolarHBondContact O-N 3.04Å
2326	T	25.7	Very low	28.9	Very low	122 Å²	122	125.8 Å²	125.8	75%	0.748	70%	0.695	S	S	*	*			trans	-65.9	84.5	175	49	0	0	0	0	110.3	V2324 T2328	V2324-T2326 HydrophobicContact CG1-CG2 4.1Å; V2324-T2326 PolarHBondContact O-N 2.8Å; T2326-T2328 VanDerWaalsContact C-N 3.3Å; T2326-T2328 PolarHBondContact O-N 3.31Å
2327	N	26.2	Very low	29	Very low	149.8 Å²	149.8	120.3 Å²	120.3	80%	0.801	68%	0.678	S	S	*	*			trans	-110.1	83.5	161.3	-80.9	-13.3	0	0	0	107.4	S2325 P2329	S2325-N2327 PolarHBondContact O-N 3.04Å; N2327-P2329 WeakPolarHBondContact O-CD 3.31Å; N2327-P2329 VanDerWaalsContact O-N 3.14Å
2328	T	24.8	Very low	29.2	Very low	104.6 Å²	104.6	115.7 Å²	115.7	64%	0.642	66%	0.658	S	S	*	*			trans	-66.4	121.2	162.9	47.3	0	0	0	0	107.6	T2326 D2330	T2326-T2328 VanDerWaalsContact C-N 3.3Å; T2326-T2328 PolarHBondContact O-N 3.31Å; T2328-D2330 VanDerWaalsContact C-N 3.3Å; T2328-D2330 PolarHBondContact O-N 3.17Å; T2328-D2330 VanDerWaalsContact O-N 3.09Å
2329	P	27.4	Very low	29.2	Very low	116.6 Å²	116.6	114.8 Å²	114.8	76%	0.757	65%	0.649	S	S	*	*			trans	-68.1	100.8	175.2	24.9	-23.2	0	0	0	108.2	N2327 Q2331	N2327-P2329 WeakPolarHBondContact O-CD 3.31Å; N2327-P2329 VanDerWaalsContact O-N 3.14Å; P2329-Q2331 VanDerWaalsContact C-N 3.31Å; P2329-Q2331 PolarHBondContact O-N 2.9Å; P2329-Q2331 VanDerWaalsContact O-N 3.08Å
2330	D	28.1	Very low	29.6	Very low	126.6 Å²	126.6	111 Å²	111	68%	0.677	63%	0.632	S	S	*	*			trans	-60.8	116.3	174.3	-94.8	-27.2	0	0	0	109.2	T2328 L2332 K2766	T2328-D2330 VanDerWaalsContact C-N 3.3Å; T2328-D2330 PolarHBondContact O-N 3.17Å; T2328-D2330 VanDerWaalsContact O-N 3.09Å; D2330-L2332 HydrophobicContact CB-CD1 4.47Å; D2330-L2332 PolarHBondContact O-N 3.06Å; D2330-K2766 VanDerWaalsContact CA-NZ 3.31Å; D2330-K2766 IonicContact OD1-NZ 3.11Å; D2330-K2766 PolarHBondContact OD1-NZ 3.23Å
2331	Q	29.6	Very low	30	Very low	154.4 Å²	154.4	110.5 Å²	110.5	72%	0.721	63%	0.629	S	S	*	*			trans	-25.8	74.3	170.2	-66.6	-170.5	-6.8	0	0	111.7	P2329 S2333 Q2767	P2329-Q2331 VanDerWaalsContact C-N 3.31Å; P2329-Q2331 PolarHBondContact O-N 2.9Å; P2329-Q2331 VanDerWaalsContact O-N 3.08Å; Q2331-S2333 PolarHBondContact O-N 2.9Å; Q2331-Q2767 PolarHBondContact O-NE2 3.14Å
2332	L	29.1	Very low	30.6	Very low	106.4 Å²	106.4	108.7 Å²	108.7	56%	0.557	61%	0.612	S	S	*	*			trans	-77	87.9	160.2	-85.3	154.7	0	0	0	108.5	S1486 S2300 P2303 D2330 T2334	S1486-L2332 WeakPolarHBondContact CB-O 3.23Å; S1486-L2332 PolarHBondContact OG-O 2.82Å; S2300-L2332 WeakPolarHBondContact O-CD1 3.35Å; P2303-L2332 HydrophobicContact CB-CB 4.19Å; P2303-L2332 HydrophobicContact CB-CD1 4.43Å; D2330-L2332 HydrophobicContact CB-CD1 4.47Å; D2330-L2332 PolarHBondContact O-N 3.06Å; L2332-T2334 VanDerWaalsContact C-N 3.26Å; L2332-T2334 PolarHBondContact O-N 3.06Å; L2332-T2334 VanDerWaalsContact O-N 3.15Å; L2332-T2334 PolarHBondContact O-OG1 2.75Å
2333	S	29.6	Very low	31.4	Very low	62.6 Å²	62.6	102.6 Å²	102.6	44%	0.438	59%	0.593	S	S	.	*			trans	-59.3	100.3	155.3	25.1	0	0	0	0	106.8	Q2331 V2335 Q2767	Q2331-S2333 PolarHBondContact O-N 2.9Å; S2333-V2335 VanDerWaalsContact C-N 3.26Å; S2333-V2335 PolarHBondContact O-N 2.99Å; S2333-Q2767 PolarHBondContact OG-NE2 3.31Å; S2333-Q2767 PolarHBondContact OG-OE1 2.73Å
2334	T	30	Very low	32.6	Very low	67.2 Å²	67.2	100.8 Å²	100.8	41%	0.412	57%	0.574	S	S	.	*			trans	-67.1	97.6	170.9	-25.8	0	0	0	0	107.1	Q2301 P2303 N2305 L2332 I2336	Q2301-T2334 PolarHBondContact NE2-OG1 3.3Å; P2303-T2334 HydrophobicContact CB-CG2 4.37Å; N2305-T2334 HydrophobicContact CB-CG2 4.07Å; N2305-T2334 WeakPolarHBondContact ND2-CG2 3.43Å; L2332-T2334 VanDerWaalsContact C-N 3.26Å; L2332-T2334 PolarHBondContact O-N 3.06Å; L2332-T2334 VanDerWaalsContact O-N 3.15Å; L2332-T2334 PolarHBondContact O-OG1 2.75Å; T2334-I2336 HydrophobicContact CG2-CD1 4.32Å; T2334-I2336 HydrophobicContact CG2-CG1 4.09Å; T2334-I2336 PolarHBondContact O-N 2.81Å
2335	V	30.7	Very low	33.8	Very low	81.8 Å²	81.8	97.7 Å²	97.7	50%	0.496	55%	0.55	S	S	.	.			trans	-69	94.2	167.2	178.8	0	0	0	0	106.6	S2333 M2337 I2350	S2333-V2335 VanDerWaalsContact C-N 3.26Å; S2333-V2335 PolarHBondContact O-N 2.99Å; V2335-M2337 VanDerWaalsContact C-N 3.34Å; V2335-M2337 HydrophobicContact CG1-CG 3.85Å; V2335-M2337 HydrophobicContact CG1-SD 4.03Å; V2335-M2337 PolarHBondContact O-N 3.3Å; V2335-M2337 VanDerWaalsContact O-N 3.09Å; V2335-I2350 HydrophobicContact CB-CG2 4.27Å; V2335-I2350 HydrophobicContact CG1-CG1 4.45Å; V2335-I2350 HydrophobicContact CG1-CG2 3.7Å; V2335-I2350 HydrophobicContact CG2-CG2 4.14Å
2336	I	34	Very low	35.2	Very low	57.4 Å²	57.4	95.9 Å²	95.9	29%	0.294	53%	0.53	S	S	.	.			trans	-83.6	99.3	171.3	-61.9	175.2	0	0	0	105	V1488 I2297 Q2301 N2305 M2306 F2308 T2334 I2338	V1488-I2336 HydrophobicContact CG1-CD1 4.03Å; V1488-I2336 HydrophobicContact CG1-CG1 4.29Å; I2297-I2336 HydrophobicContact CG2-CD1 3.8Å; Q2301-I2336 HydrophobicContact CG-CD1 4.35Å; N2305-I2336 HydrophobicContact CB-CG1 3.96Å; N2305-I2336 WeakPolarHBondContact O-CD1 3.36Å; N2305-I2336 WeakPolarHBondContact O-CG2 3.39Å; M2306-I2336 HydrophobicContact CG-CG2 4.21Å; F2308-I2336 HydrophobicContact CE2-CB 3.87Å; F2308-I2336 HydrophobicContact CE2-CD1 4.49Å; F2308-I2336 HydrophobicContact CE2-CG1 3.85Å; F2308-I2336 HydrophobicContact CE2-CG2 3.59Å; F2308-I2336 HydrophobicContact CZ-CB 4.13Å; F2308-I2336 HydrophobicContact CZ-CG2 3.66Å; T2334-I2336 HydrophobicContact CG2-CD1 4.32Å; T2334-I2336 HydrophobicContact CG2-CG1 4.09Å; T2334-I2336 PolarHBondContact O-N 2.81Å; I2336-I2338 VanDerWaalsContact C-N 3.26Å; I2336-I2338 HydrophobicContact CG2-CD1 4.13Å; I2336-I2338 HydrophobicContact CG2-CG1 3.81Å; I2336-I2338 PolarHBondContact O-N 2.96Å
2337	M	30.7	Very low	36.8	Very low	101.4 Å²	101.4	93.1 Å²	93.1	50%	0.5	51%	0.509	S	S	.	.			trans	-71.8	105.2	166.5	-69.7	-97.8	-81	0	0	107.2	F2308 V2335 Q2339 M2348 I2350 Y2367 E2495	F2308-M2337 WeakPolarHBondContact CE1-O 3.15Å; F2308-M2337 WeakPolarHBondContact CZ-O 3.16Å; V2335-M2337 VanDerWaalsContact C-N 3.34Å; V2335-M2337 HydrophobicContact CG1-CG 3.85Å; V2335-M2337 HydrophobicContact CG1-SD 4.03Å; V2335-M2337 PolarHBondContact O-N 3.3Å; V2335-M2337 VanDerWaalsContact O-N 3.09Å; M2337-Q2339 PolarHBondContact O-N 3Å; M2337-M2348 HydrophobicContact CE-CE 3.27Å; M2337-M2348 HydrophobicContact CE-CG 3.89Å; M2337-M2348 HydrophobicContact CE-SD 3.44Å; M2337-M2348 VanDerWaalsContact CE-SD 3.51Å; M2337-M2348 WeakPolarHBondContact CE-SD 3.33Å; M2337-M2348 HydrophobicContact SD-CE 4.11Å; M2337-M2348 HydrophobicContact SD-CG 3.55Å; M2337-M2348 WeakPolarHBondContact SD-CG 3.22Å; M2337-M2348 HydrophobicContact SD-SD 3.4Å; M2337-I2350 HydrophobicContact SD-CD1 4.32Å; M2337-I2350 HydrophobicContact SD-CG1 4.03Å; M2337-Y2367 WeakPolarHBondContact CE-OH 3.46Å; M2337-E2495 HydrophobicContact CE-CG 4.48Å; M2337-E2495 WeakPolarHBondContact CE-OE1 3.39Å; M2337-E2495 VanDerWaalsContact CE-OE2 3.23Å; M2337-E2495 WeakPolarHBondContact CE-OE2 3.36Å
2338	I	33.2	Very low	38.3	Very low	82.6 Å²	82.6	89.4 Å²	89.4	42%	0.424	49%	0.488	S	S	.	.			trans	-82.5	103.1	174.3	-60.5	169.9	0	0	0	106	N2305 I2336 T2340 M2348 E2349	N2305-I2338 HydrophobicContact CB-CD1 3.73Å; N2305-I2338 WeakPolarHBondContact ND2-CD1 3.25Å; I2336-I2338 VanDerWaalsContact C-N 3.26Å; I2336-I2338 HydrophobicContact CG2-CD1 4.13Å; I2336-I2338 HydrophobicContact CG2-CG1 3.81Å; I2336-I2338 PolarHBondContact O-N 2.96Å; I2338-T2340 HydrophobicContact CG2-CG2 4.02Å; I2338-T2340 PolarHBondContact O-N 3.21Å; I2338-T2340 VanDerWaalsContact O-N 3.1Å; I2338-T2340 PolarHBondContact O-OG1 3.01Å; I2338-T2340 VanDerWaalsContact O-OG1 3.12Å; I2338-M2348 WeakPolarHBondContact O-CA 3.24Å; I2338-E2349 PolarHBondContact O-N 2.87Å
2339	Q	32.3	Very low	40.1	Very low	135.8 Å²	135.8	87.9 Å²	87.9	64%	0.635	47%	0.474	S	S	*	.			trans	-75.7	102.4	160.8	-135.8	177.9	-4.3	0	0	108.2	M2337 T2341 E2347	M2337-Q2339 PolarHBondContact O-N 3Å; Q2339-T2341 HydrophobicContact CG-CG2 4.28Å; Q2339-T2341 PolarHBondContact O-N 3.03Å; Q2339-T2341 VanDerWaalsContact O-N 3.13Å; Q2339-E2347 VanDerWaalsContact CA-O 3.29Å; Q2339-E2347 WeakPolarHBondContact CA-O 3.23Å
2340	T	36	Very low	41.6	Very low	82.4 Å²	82.4	83.8 Å²	83.8	51%	0.506	45%	0.445	S	S	.	.			trans	-78.1	111.8	156.7	54.9	0	0	0	0	106.4	I2338 D2342 S2343 K2345 E2347	I2338-T2340 HydrophobicContact CG2-CG2 4.02Å; I2338-T2340 PolarHBondContact O-N 3.21Å; I2338-T2340 VanDerWaalsContact O-N 3.1Å; I2338-T2340 PolarHBondContact O-OG1 3.01Å; I2338-T2340 VanDerWaalsContact O-OG1 3.12Å; T2340-D2342 CarbonylContact O-C 3.6Å; T2340-D2342 WeakPolarHBondContact O-CA 3.41Å; T2340-D2342 PolarHBondContact O-N 2.94Å; T2340-D2342 VanDerWaalsContact O-N 3.14Å; T2340-S2343 PolarHBondContact O-N 3.03Å; T2340-S2343 VanDerWaalsContact OG1-CA 3.27Å; T2340-S2343 WeakPolarHBondContact OG1-CA 3.43Å; T2340-S2343 PolarHBondContact OG1-N 3.43Å; T2340-K2345 VanDerWaalsContact O-O 3.09Å; T2340-E2347 PolarHBondContact N-O 2.83Å; T2340-E2347 PolarHBondContact O-N 3.36Å; T2340-E2347 WeakPolarHBondContact OG1-CB 3.38Å
2341	T	39.4	Very low	43.1	Very low	100.2 Å²	100.2	80 Å²	80	62%	0.615	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.1	55.4	178.3	47.8	0	0	0	0	110.6	L2099 Q2339 S2343	L2099-T2341 WeakPolarHBondContact CD1-O 3.45Å; Q2339-T2341 HydrophobicContact CG-CG2 4.28Å; Q2339-T2341 PolarHBondContact O-N 3.03Å; Q2339-T2341 VanDerWaalsContact O-N 3.13Å; T2341-S2343 VanDerWaalsContact C-N 3.33Å; T2341-S2343 PolarHBondContact O-N 3.48Å
2342	D	43.2	Very low	44.4	Very low	99.8 Å²	99.8	75.6 Å²	75.6	53%	0.534	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	76.1	161.3	-76	-36.2	0	0	0	112.5	L2099 T2340 N2344 K2345	L2099-D2342 HydrophobicContact CD1-CB 4.38Å; L2099-D2342 WeakPolarHBondContact CD1-OD1 3.46Å; T2340-D2342 CarbonylContact O-C 3.6Å; T2340-D2342 WeakPolarHBondContact O-CA 3.41Å; T2340-D2342 PolarHBondContact O-N 2.94Å; T2340-D2342 VanDerWaalsContact O-N 3.14Å; D2342-N2344 PolarHBondContact O-N 2.91Å; D2342-K2345 HydrophobicContact CB-CB 3.84Å; D2342-K2345 VanDerWaalsContact CB-CB 3.48Å; D2342-K2345 HydrophobicContact CB-CD 4.15Å; D2342-K2345 HydrophobicContact CB-CG 4.49Å; D2342-K2345 WeakPolarHBondContact CB-O 3.47Å; D2342-K2345 PolarHBondContact N-O 3.07Å; D2342-K2345 VanDerWaalsContact N-O 3.07Å; D2342-K2345 CarbonylContact O-C 3.54Å; D2342-K2345 WeakPolarHBondContact O-CB 3.48Å; D2342-K2345 PolarHBondContact O-N 3.02Å; D2342-K2345 VanDerWaalsContact O-O 3.11Å
2343	S	46.9	Very low	45.7	Very low	59.4 Å²	59.4	72 Å²	72	42%	0.415	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	17.3	177.6	58.1	0	0	0	0	112.5	T2340 T2341 K2345	T2340-S2343 PolarHBondContact O-N 3.03Å; T2340-S2343 VanDerWaalsContact OG1-CA 3.27Å; T2340-S2343 WeakPolarHBondContact OG1-CA 3.43Å; T2340-S2343 PolarHBondContact OG1-N 3.43Å; T2341-S2343 VanDerWaalsContact C-N 3.33Å; T2341-S2343 PolarHBondContact O-N 3.48Å; S2343-K2345 PolarHBondContact O-N 3.26Å
2344	N	52.7	Low	46.9	Very low	69.8 Å²	69.8	72 Å²	72	37%	0.373	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	3.9	176.6	-71.3	-8.4	0	0	0	113.6	D2342 V2366 Y2367 V2369	D2342-N2344 PolarHBondContact O-N 2.91Å; N2344-V2366 HydrophobicContact CB-CG1 4.22Å; N2344-V2366 CarbonylContact O-C 3.48Å; N2344-V2366 VanDerWaalsContact O-CA 3.28Å; N2344-V2366 WeakPolarHBondContact O-CA 3.3Å; N2344-Y2367 WeakPolarHBondContact CA-O 3.37Å; N2344-Y2367 VanDerWaalsContact CB-O 3.27Å; N2344-Y2367 WeakPolarHBondContact CB-O 3.37Å; N2344-Y2367 PolarHBondContact ND2-O 2.73Å; N2344-Y2367 VanDerWaalsContact O-CD2 3.25Å; N2344-Y2367 WeakPolarHBondContact O-CD2 3.33Å; N2344-Y2367 PolarHBondContact O-N 3.12Å; N2344-Y2367 VanDerWaalsContact O-O 3.14Å; N2344-V2369 VanDerWaalsContact OD1-CG2 3.26Å; N2344-V2369 WeakPolarHBondContact OD1-CG2 3.24Å
2345	K	54.1	Low	48.1	Very low	74.4 Å²	74.4	73.4 Å²	73.4	32%	0.323	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	114.5	-176.6	-173.3	179.2	-169.3	-154.5	0	110.6	T2340 D2342 S2343 E2347 Q2365 V2366	T2340-K2345 VanDerWaalsContact O-O 3.09Å; D2342-K2345 HydrophobicContact CB-CB 3.84Å; D2342-K2345 VanDerWaalsContact CB-CB 3.48Å; D2342-K2345 HydrophobicContact CB-CD 4.15Å; D2342-K2345 HydrophobicContact CB-CG 4.49Å; D2342-K2345 WeakPolarHBondContact CB-O 3.47Å; D2342-K2345 PolarHBondContact N-O 3.07Å; D2342-K2345 VanDerWaalsContact N-O 3.07Å; D2342-K2345 CarbonylContact O-C 3.54Å; D2342-K2345 WeakPolarHBondContact O-CB 3.48Å; D2342-K2345 PolarHBondContact O-N 3.02Å; D2342-K2345 VanDerWaalsContact O-O 3.11Å; S2343-K2345 PolarHBondContact O-N 3.26Å; K2345-E2347 HydrophobicContact CD-CG 4.31Å; K2345-E2347 WeakPolarHBondContact CE-OE1 3.44Å; K2345-E2347 VanDerWaalsContact CE-OE2 3.3Å; K2345-E2347 WeakPolarHBondContact CE-OE2 3.3Å; K2345-E2347 HydrophobicContact CG-CG 4.14Å; K2345-E2347 IonicContact NZ-OE1 3.3Å; K2345-E2347 PolarHBondContact NZ-OE1 2.99Å; K2345-E2347 IonicContact NZ-OE2 3.13Å; K2345-E2347 PolarHBondContact NZ-OE2 2.8Å; K2345-Q2365 CarbonylContact C-O 3.55Å; K2345-Q2365 WeakPolarHBondContact CA-O 3.35Å; K2345-V2366 HydrophobicContact CB-CG2 4.35Å; K2345-V2366 HydrophobicContact CD-CG2 4.29Å; K2345-V2366 HydrophobicContact CG-CG2 4.08Å
2346	H	56.4	Low	49.3	Very low	57.8 Å²	57.8	76.3 Å²	76.3	27%	0.268	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	113.7	172.3	-69.2	80.6	0	0	0	108.9	S2151 M2306 A2364 Q2365 Y2367	S2151-H2346 PolarHBondContact OG-CD2 2.76Å; S2151-H2346 VanDerWaalsContact OG-CD2 3.26Å; S2151-H2346 PolarHBondContact OG-NE2 2.92Å; M2306-H2346 WeakPolarHBondContact CE-CD2 3.28Å; M2306-H2346 WeakPolarHBondContact CE-NE2 3.32Å; M2306-H2346 HydrophobicContact SD-CB 4.07Å; M2306-H2346 PolarHBondContact SD-CD2 2.54Å; M2306-H2346 VanDerWaalsContact SD-CG 3.58Å; H2346-A2364 CarbonylContact O-C 3.53Å; H2346-A2364 VanDerWaalsContact O-CA 3.27Å; H2346-A2364 WeakPolarHBondContact O-CA 3.39Å; H2346-Q2365 HydrophobicContact CB-CB 4.4Å; H2346-Q2365 PolarHBondContact N-O 3.13Å; H2346-Q2365 PolarHBondContact O-N 2.96Å; H2346-Y2367 HydrophobicContact CB-CE2 4.04Å; H2346-Y2367 AromaticContact CG-CE2 3.94Å; H2346-Y2367 AromaticContact ND1-CD2 3.78Å; H2346-Y2367 AromaticContact ND1-CE2 3.7Å
2347	E	58.7	Low	50.4	Low	63.6 Å²	63.6	76.7 Å²	76.7	30%	0.297	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	142	176	-100.6	-174.9	160.8	0	0	110.7	Q2339 T2340 K2345 R2362 L2363 A2364	Q2339-E2347 VanDerWaalsContact CA-O 3.29Å; Q2339-E2347 WeakPolarHBondContact CA-O 3.23Å; T2340-E2347 PolarHBondContact N-O 2.83Å; T2340-E2347 PolarHBondContact O-N 3.36Å; T2340-E2347 WeakPolarHBondContact OG1-CB 3.38Å; K2345-E2347 HydrophobicContact CD-CG 4.31Å; K2345-E2347 WeakPolarHBondContact CE-OE1 3.44Å; K2345-E2347 VanDerWaalsContact CE-OE2 3.3Å; K2345-E2347 WeakPolarHBondContact CE-OE2 3.3Å; K2345-E2347 HydrophobicContact CG-CG 4.14Å; K2345-E2347 IonicContact NZ-OE1 3.3Å; K2345-E2347 PolarHBondContact NZ-OE1 2.99Å; K2345-E2347 IonicContact NZ-OE2 3.13Å; K2345-E2347 PolarHBondContact NZ-OE2 2.8Å; E2347-R2362 VanDerWaalsContact CD-NE 3.3Å; E2347-R2362 HydrophobicContact CG-CG 4.25Å; E2347-R2362 IonicContact OE1-CZ 3.54Å; E2347-R2362 IonicContact OE1-NE 2.78Å; E2347-R2362 PolarHBondContact OE1-NE 3Å; E2347-R2362 IonicContact OE1-NH1 2.58Å; E2347-R2362 IonicContact OE1-NH2 3.6Å; E2347-R2362 PolarHBondContact OE1-NH2 3.06Å; E2347-R2362 WeakPolarHBondContact OE2-CD 3.27Å; E2347-R2362 IonicContact OE2-CZ 3.54Å; E2347-R2362 IonicContact OE2-NE 3.24Å; E2347-R2362 PolarHBondContact OE2-NE 2.78Å; E2347-R2362 IonicContact OE2-NH1 3.18Å; E2347-R2362 PolarHBondContact OE2-NH1 3.36Å; E2347-R2362 IonicContact OE2-NH2 3.56Å; E2347-R2362 PolarHBondContact OE2-NH2 3.06Å; E2347-L2363 CarbonylContact C-O 3.54Å; E2347-L2363 VanDerWaalsContact CA-O 3.28Å; E2347-L2363 WeakPolarHBondContact CA-O 3.28Å; E2347-A2364 HydrophobicContact CB-CB 4.24Å; E2347-A2364 HydrophobicContact CG-CB 3.9Å
2348	M	57.7	Low	51.6	Low	72 Å²	72	75.1 Å²	75.1	36%	0.355	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	120.6	172.9	177.8	-172.9	-65.2	0	0	107.7	M2337 I2338 I2350 R2362 L2363	M2337-M2348 HydrophobicContact CE-CE 3.27Å; M2337-M2348 HydrophobicContact CE-CG 3.89Å; M2337-M2348 HydrophobicContact CE-SD 3.44Å; M2337-M2348 VanDerWaalsContact CE-SD 3.51Å; M2337-M2348 WeakPolarHBondContact CE-SD 3.33Å; M2337-M2348 HydrophobicContact SD-CE 4.11Å; M2337-M2348 HydrophobicContact SD-CG 3.55Å; M2337-M2348 WeakPolarHBondContact SD-CG 3.22Å; M2337-M2348 HydrophobicContact SD-SD 3.4Å; I2338-M2348 WeakPolarHBondContact O-CA 3.24Å; M2348-I2350 HydrophobicContact CG-CD1 4.36Å; M2348-I2350 HydrophobicContact CG-CG1 4.01Å; M2348-I2350 HydrophobicContact SD-CD1 3.86Å; M2348-I2350 HydrophobicContact SD-CG1 4.08Å; M2348-R2362 CarbonylContact O-C 3.59Å; M2348-R2362 WeakPolarHBondContact O-CA 3.29Å; M2348-L2363 HydrophobicContact CB-CB 4.37Å; M2348-L2363 PolarHBondContact N-O 3.06Å; M2348-L2363 PolarHBondContact O-N 3.11Å; M2348-L2363 HydrophobicContact SD-CD1 4.33Å
2349	E	61.8	Low	53	Low	74.4 Å²	74.4	74.4 Å²	74.4	35%	0.348	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	133.6	168.9	-154	171.8	142.7	0	0	108.9	I2338 K2360 V2361 R2362	I2338-E2349 PolarHBondContact O-N 2.87Å; E2349-K2360 WeakPolarHBondContact OE1-CD 3.44Å; E2349-K2360 IonicContact OE1-NZ 3.36Å; E2349-K2360 PolarHBondContact OE1-NZ 2.92Å; E2349-V2361 CarbonylContact C-O 3.53Å; E2349-V2361 WeakPolarHBondContact CA-O 3.25Å; E2349-R2362 HydrophobicContact CB-CG 4.35Å; E2349-R2362 HydrophobicContact CG-CB 4.28Å; E2349-R2362 HydrophobicContact CG-CG 4.07Å; E2349-R2362 IonicContact OE1-CZ 3.73Å; E2349-R2362 IonicContact OE1-NE 2.83Å; E2349-R2362 PolarHBondContact OE1-NE 3.05Å; E2349-R2362 IonicContact OE1-NH2 2.76Å; E2349-R2362 PolarHBondContact OE1-NH2 2.99Å; E2349-R2362 IonicContact OE2-CZ 3.4Å; E2349-R2362 IonicContact OE2-NE 3.52Å; E2349-R2362 PolarHBondContact OE2-NE 3.45Å; E2349-R2362 IonicContact OE2-NH2 3.22Å; E2349-R2362 PolarHBondContact OE2-NH2 3.16Å
2350	I	60	Low	54.6	Low	30 Å²	30	71.7 Å²	71.7	15%	0.154	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	117.3	176.7	-53.3	172.8	0	0	0	107.9	V2335 M2337 M2348 Y2352 K2360 V2361 L2363	V2335-I2350 HydrophobicContact CB-CG2 4.27Å; V2335-I2350 HydrophobicContact CG1-CG1 4.45Å; V2335-I2350 HydrophobicContact CG1-CG2 3.7Å; V2335-I2350 HydrophobicContact CG2-CG2 4.14Å; M2337-I2350 HydrophobicContact SD-CD1 4.32Å; M2337-I2350 HydrophobicContact SD-CG1 4.03Å; M2348-I2350 HydrophobicContact CG-CD1 4.36Å; M2348-I2350 HydrophobicContact CG-CG1 4.01Å; M2348-I2350 HydrophobicContact SD-CD1 3.86Å; M2348-I2350 HydrophobicContact SD-CG1 4.08Å; I2350-Y2352 HydrophobicContact CB-CD2 4.45Å; I2350-Y2352 HydrophobicContact CB-CE2 3.73Å; I2350-Y2352 HydrophobicContact CG2-CD2 4.01Å; I2350-Y2352 HydrophobicContact CG2-CE1 4.16Å; I2350-Y2352 HydrophobicContact CG2-CE2 3.6Å; I2350-Y2352 VanDerWaalsContact CG2-CZ 3.44Å; I2350-Y2352 WeakPolarHBondContact O-CD2 3.43Å; I2350-K2360 CarbonylContact O-C 3.55Å; I2350-K2360 WeakPolarHBondContact O-CA 3.32Å; I2350-V2361 HydrophobicContact CB-CB 4.46Å; I2350-V2361 PolarHBondContact N-O 3.05Å; I2350-V2361 PolarHBondContact O-N 3.06Å; I2350-L2363 HydrophobicContact CD1-CD1 4.2Å
2351	D	59.9	Low	55.9	Low	47.2 Å²	47.2	68.3 Å²	68.3	25%	0.252	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	127.9	172.7	-70.1	-20.8	0	0	0	110	K2290 L2358 W2359 K2360	K2290-D2351 IonicContact NZ-OD2 3.91Å; K2290-D2351 PolarHBondContact NZ-OD2 3.26Å; D2351-L2358 HydrophobicContact CB-CD1 4.4Å; D2351-L2358 HydrophobicContact CB-CD2 3.82Å; D2351-W2359 CarbonylContact C-O 3.51Å; D2351-W2359 WeakPolarHBondContact CA-O 3.2Å; D2351-K2360 WeakPolarHBondContact OD1-CD 3.35Å; D2351-K2360 WeakPolarHBondContact OD1-CE 3.38Å; D2351-K2360 VanDerWaalsContact OD1-CG 3.27Å; D2351-K2360 WeakPolarHBondContact OD1-CG 3.35Å; D2351-K2360 IonicContact OD1-NZ 3.17Å; D2351-K2360 PolarHBondContact OD1-NZ 3.48Å; D2351-K2360 IonicContact OD2-NZ 3.62Å; D2351-K2360 PolarHBondContact OD2-NZ 2.96Å
2352	Y	56.9	Low	57.2	Low	61.8 Å²	61.8	67.6 Å²	67.6	24%	0.242	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	145.9	179.3	-93.1	-95.3	0	0	0	111.1	I2350 L2358 W2359 V2361	I2350-Y2352 HydrophobicContact CB-CD2 4.45Å; I2350-Y2352 HydrophobicContact CB-CE2 3.73Å; I2350-Y2352 HydrophobicContact CG2-CD2 4.01Å; I2350-Y2352 HydrophobicContact CG2-CE1 4.16Å; I2350-Y2352 HydrophobicContact CG2-CE2 3.6Å; I2350-Y2352 VanDerWaalsContact CG2-CZ 3.44Å; I2350-Y2352 WeakPolarHBondContact O-CD2 3.43Å; Y2352-L2358 CarbonylContact O-C 3.55Å; Y2352-L2358 WeakPolarHBondContact O-CA 3.35Å; Y2352-W2359 WeakPolarHBondContact CA-O 3.11Å; Y2352-W2359 VanDerWaalsContact CB-CE2 3.43Å; Y2352-W2359 VanDerWaalsContact CB-CZ2 3.45Å; Y2352-W2359 AromaticContact CD1-CH2 3.81Å; Y2352-W2359 HydrophobicContact CD1-CH2 4.06Å; Y2352-W2359 AromaticContact CD1-CZ2 3.84Å; Y2352-W2359 HydrophobicContact CD1-CZ2 4.06Å; Y2352-W2359 HydrophobicContact CD2-CD2 4.35Å; Y2352-W2359 AromaticContact CD2-CE3 3.94Å; Y2352-W2359 HydrophobicContact CD2-CE3 4.12Å; Y2352-W2359 AromaticContact CD2-CH2 3.25Å; Y2352-W2359 HydrophobicContact CD2-CH2 3.52Å; Y2352-W2359 AromaticContact CD2-CZ2 3.7Å; Y2352-W2359 HydrophobicContact CD2-CZ2 3.7Å; Y2352-W2359 VanDerWaalsContact CD2-CZ2 3.5Å; Y2352-W2359 AromaticContact CD2-CZ3 3.64Å; Y2352-W2359 HydrophobicContact CD2-CZ3 3.64Å; Y2352-W2359 HydrophobicContact CE1-CH2 4.31Å; Y2352-W2359 HydrophobicContact CE1-CZ2 4.45Å; Y2352-W2359 AromaticContact CE2-CH2 3.69Å; Y2352-W2359 HydrophobicContact CE2-CH2 3.69Å; Y2352-W2359 VanDerWaalsContact CE2-CH2 3.41Å; Y2352-W2359 HydrophobicContact CE2-CZ2 4.25Å; Y2352-W2359 AromaticContact CE2-CZ3 3.92Å; Y2352-W2359 HydrophobicContact CE2-CZ3 3.98Å; Y2352-W2359 HydrophobicContact CG-CD2 4.29Å; Y2352-W2359 AromaticContact CG-CE2 3.85Å; Y2352-W2359 HydrophobicContact CG-CE3 4.36Å; Y2352-W2359 AromaticContact CG-CH2 3.51Å; Y2352-W2359 HydrophobicContact CG-CH2 3.51Å; Y2352-W2359 AromaticContact CG-CZ2 3.54Å; Y2352-W2359 HydrophobicContact CG-CZ2 3.54Å; Y2352-W2359 VanDerWaalsContact CG-CZ2 3.47Å; Y2352-W2359 AromaticContact CG-CZ3 3.97Å; Y2352-W2359 HydrophobicContact CG-CZ3 4.05Å; Y2352-W2359 AromaticContact CZ-CH2 3.94Å; Y2352-W2359 PolarHBondContact N-O 3.22Å; Y2352-W2359 WeakPolarHBondContact O-CA 3.33Å; Y2352-W2359 WeakPolarHBondContact O-CB 3.34Å; Y2352-W2359 PolarHBondContact O-N 3.03Å; Y2352-W2359 VanDerWaalsContact O-O 3.13Å; Y2352-V2361 HydrophobicContact CD2-CB 4.33Å; Y2352-V2361 HydrophobicContact CD2-CG2 3.99Å; Y2352-V2361 HydrophobicContact CE2-CB 4.05Å; Y2352-V2361 HydrophobicContact CE2-CG2 3.65Å; Y2352-V2361 VanDerWaalsContact CE2-CG2 3.49Å
2353	G	54.9	Low	58.2	Low	30.6 Å²	30.6	65.1 Å²	65.1	32%	0.315	34%	0.336	S	S	.	.	S	Bend	trans	101.1	-175.7	179.2	0	0	0	0	0	113.7
2354	D	55.8	Low	59	Low	62.6 Å²	62.6	62.5 Å²	62.5	34%	0.335	32%	0.318	S	S	.	.			trans	-84.7	168.7	175.6	67.6	2.5	0	0	0	110.7	N2356 N2357 L2358 L2765	D2354-N2356 PolarHBondContact O-N 3.11Å; D2354-N2356 VanDerWaalsContact O-N 3.12Å; D2354-N2356 WeakPolarHBondContact OD1-CA 3.27Å; D2354-N2356 WeakPolarHBondContact OD1-CB 3.46Å; D2354-N2356 PolarHBondContact OD1-N 3.18Å; D2354-N2356 VanDerWaalsContact OD1-N 3.1Å; D2354-N2357 CarbonylContact O-C 3.4Å; D2354-N2357 VanDerWaalsContact O-C 3.29Å; D2354-N2357 PolarHBondContact O-N 3.2Å; D2354-N2357 WeakPolarHBondContact OD1-CB 3.19Å; D2354-N2357 PolarHBondContact OD1-N 3Å; D2354-L2358 WeakPolarHBondContact O-CA 3.33Å; D2354-L2358 WeakPolarHBondContact O-CB 3.4Å; D2354-L2358 VanDerWaalsContact O-CD2 3.28Å; D2354-L2358 WeakPolarHBondContact O-CD2 3.42Å; D2354-L2358 VanDerWaalsContact O-CG 3.31Å; D2354-L2358 WeakPolarHBondContact O-CG 3.44Å; D2354-L2358 PolarHBondContact O-N 3.18Å; D2354-L2358 VanDerWaalsContact O-N 3.1Å; D2354-L2765 WeakPolarHBondContact OD1-CD2 3.45Å; D2354-L2765 WeakPolarHBondContact OD2-CD2 3.48Å
2355	S	55.7	Low	59.4	Low	96.8 Å²	96.8	61.1 Å²	61.1	68%	0.677	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-23.3	179.4	57.1	0	0	0	0	114.3
2356	N	54.7	Low	59.8	Low	141.4 Å²	141.4	59 Å²	59	76%	0.756	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	-16.1	-177.5	-65.7	-15.2	0	0	0	113.1	D2354	D2354-N2356 PolarHBondContact O-N 3.11Å; D2354-N2356 VanDerWaalsContact O-N 3.12Å; D2354-N2356 WeakPolarHBondContact OD1-CA 3.27Å; D2354-N2356 WeakPolarHBondContact OD1-CB 3.46Å; D2354-N2356 PolarHBondContact OD1-N 3.18Å; D2354-N2356 VanDerWaalsContact OD1-N 3.1Å
2357	N	57	Low	59.9	Low	66.8 Å²	66.8	57.7 Å²	57.7	36%	0.357	30%	0.296	S	S	.	.	S	Bend	trans	-143.7	55.3	-178.2	-149.2	9.9	0	0	0	111.1	D2354 W2359 P2386 G2387 F2794 G2796	D2354-N2357 CarbonylContact O-C 3.4Å; D2354-N2357 VanDerWaalsContact O-C 3.29Å; D2354-N2357 PolarHBondContact O-N 3.2Å; D2354-N2357 WeakPolarHBondContact OD1-CB 3.19Å; D2354-N2357 PolarHBondContact OD1-N 3Å; N2357-W2359 PolarHBondContact O-N 2.91Å; N2357-W2359 PolarHBondContact O-NE1 2.81Å; N2357-P2386 HydrophobicContact CB-CB 4.22Å; N2357-P2386 VanDerWaalsContact OD1-C 3.3Å; N2357-P2386 WeakPolarHBondContact OD1-CA 3.44Å; N2357-P2386 WeakPolarHBondContact OD1-CB 3.19Å; N2357-G2387 PolarHBondContact OD1-N 2.94Å; N2357-F2794 PolarHBondContact ND2-O 3.38Å; N2357-F2794 VanDerWaalsContact ND2-O 3.12Å; N2357-G2796 PolarHBondContact ND2-N 3.39Å; N2357-G2796 PolarHBondContact OD1-N 2.99Å
2358	L	57.2	Low	59.8	Low	67.4 Å²	67.4	59.6 Å²	59.6	35%	0.353	30%	0.304	S	S	.	.			trans	-79.9	118.9	-175.8	-117.8	151.4	0	0	0	110.2	D2351 Y2352 D2354 P2386	D2351-L2358 HydrophobicContact CB-CD1 4.4Å; D2351-L2358 HydrophobicContact CB-CD2 3.82Å; Y2352-L2358 CarbonylContact O-C 3.55Å; Y2352-L2358 WeakPolarHBondContact O-CA 3.35Å; D2354-L2358 WeakPolarHBondContact O-CA 3.33Å; D2354-L2358 WeakPolarHBondContact O-CB 3.4Å; D2354-L2358 VanDerWaalsContact O-CD2 3.28Å; D2354-L2358 WeakPolarHBondContact O-CD2 3.42Å; D2354-L2358 VanDerWaalsContact O-CG 3.31Å; D2354-L2358 WeakPolarHBondContact O-CG 3.44Å; D2354-L2358 PolarHBondContact O-N 3.18Å; D2354-L2358 VanDerWaalsContact O-N 3.1Å; L2358-P2386 VanDerWaalsContact O-CD 3.32Å; L2358-P2386 WeakPolarHBondContact O-CD 3.41Å; L2358-P2386 WeakPolarHBondContact O-CG 3.37Å
2359	W	62.6	Low	59.6	Low	67.2 Å²	67.2	59.3 Å²	59.3	26%	0.255	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	141.5	172.8	19.2	-49.6	0	0	0	109.3	D2351 Y2352 N2357 V2361 I2383 T2384 I2385 P2386 G2796	D2351-W2359 CarbonylContact C-O 3.51Å; D2351-W2359 WeakPolarHBondContact CA-O 3.2Å; Y2352-W2359 WeakPolarHBondContact CA-O 3.11Å; Y2352-W2359 VanDerWaalsContact CB-CE2 3.43Å; Y2352-W2359 VanDerWaalsContact CB-CZ2 3.45Å; Y2352-W2359 AromaticContact CD1-CH2 3.81Å; Y2352-W2359 HydrophobicContact CD1-CH2 4.06Å; Y2352-W2359 AromaticContact CD1-CZ2 3.84Å; Y2352-W2359 HydrophobicContact CD1-CZ2 4.06Å; Y2352-W2359 HydrophobicContact CD2-CD2 4.35Å; Y2352-W2359 AromaticContact CD2-CE3 3.94Å; Y2352-W2359 HydrophobicContact CD2-CE3 4.12Å; Y2352-W2359 AromaticContact CD2-CH2 3.25Å; Y2352-W2359 HydrophobicContact CD2-CH2 3.52Å; Y2352-W2359 AromaticContact CD2-CZ2 3.7Å; Y2352-W2359 HydrophobicContact CD2-CZ2 3.7Å; Y2352-W2359 VanDerWaalsContact CD2-CZ2 3.5Å; Y2352-W2359 AromaticContact CD2-CZ3 3.64Å; Y2352-W2359 HydrophobicContact CD2-CZ3 3.64Å; Y2352-W2359 HydrophobicContact CE1-CH2 4.31Å; Y2352-W2359 HydrophobicContact CE1-CZ2 4.45Å; Y2352-W2359 AromaticContact CE2-CH2 3.69Å; Y2352-W2359 HydrophobicContact CE2-CH2 3.69Å; Y2352-W2359 VanDerWaalsContact CE2-CH2 3.41Å; Y2352-W2359 HydrophobicContact CE2-CZ2 4.25Å; Y2352-W2359 AromaticContact CE2-CZ3 3.92Å; Y2352-W2359 HydrophobicContact CE2-CZ3 3.98Å; Y2352-W2359 HydrophobicContact CG-CD2 4.29Å; Y2352-W2359 AromaticContact CG-CE2 3.85Å; Y2352-W2359 HydrophobicContact CG-CE3 4.36Å; Y2352-W2359 AromaticContact CG-CH2 3.51Å; Y2352-W2359 HydrophobicContact CG-CH2 3.51Å; Y2352-W2359 AromaticContact CG-CZ2 3.54Å; Y2352-W2359 HydrophobicContact CG-CZ2 3.54Å; Y2352-W2359 VanDerWaalsContact CG-CZ2 3.47Å; Y2352-W2359 AromaticContact CG-CZ3 3.97Å; Y2352-W2359 HydrophobicContact CG-CZ3 4.05Å; Y2352-W2359 AromaticContact CZ-CH2 3.94Å; Y2352-W2359 PolarHBondContact N-O 3.22Å; Y2352-W2359 WeakPolarHBondContact O-CA 3.33Å; Y2352-W2359 WeakPolarHBondContact O-CB 3.34Å; Y2352-W2359 PolarHBondContact O-N 3.03Å; Y2352-W2359 VanDerWaalsContact O-O 3.13Å; N2357-W2359 PolarHBondContact O-N 2.91Å; N2357-W2359 PolarHBondContact O-NE1 2.81Å; W2359-V2361 HydrophobicContact CE3-CG2 4.06Å; W2359-V2361 HydrophobicContact CH2-CG2 4.22Å; W2359-V2361 HydrophobicContact CZ3-CG2 3.44Å; W2359-V2361 VanDerWaalsContact CZ3-CG2 3.44Å; W2359-I2383 HydrophobicContact CE3-CG2 4.35Å; W2359-I2383 HydrophobicContact CZ3-CG2 4.43Å; W2359-T2384 WeakPolarHBondContact CA-O 3.47Å; W2359-T2384 WeakPolarHBondContact CB-O 3.44Å; W2359-I2385 HydrophobicContact CB-CG1 4.31Å; W2359-I2385 HydrophobicContact CH2-CG2 3.87Å; W2359-I2385 HydrophobicContact CZ3-CB 4.33Å; W2359-I2385 HydrophobicContact CZ3-CG1 4.2Å; W2359-I2385 HydrophobicContact CZ3-CG2 3.98Å; W2359-P2386 HydrophobicContact CB-CG 3.98Å; W2359-P2386 HydrophobicContact CD2-CG 3.58Å; W2359-P2386 HydrophobicContact CE3-CG 4.32Å; W2359-P2386 HydrophobicContact CG-CG 3.66Å; W2359-P2386 HydrophobicContact CZ2-CG 3.79Å; W2359-P2386 VanDerWaalsContact NE1-CG 3.3Å; W2359-G2796 VanDerWaalsContact CD1-CA 3.47Å
2360	K	65.2	Low	59.1	Low	80.4 Å²	80.4	62.2 Å²	62.2	35%	0.35	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	129	-174.8	-52.8	-168.5	157.5	-143	0	111.1	E2349 I2350 D2351 I2383 T2384 P2386	E2349-K2360 WeakPolarHBondContact OE1-CD 3.44Å; E2349-K2360 IonicContact OE1-NZ 3.36Å; E2349-K2360 PolarHBondContact OE1-NZ 2.92Å; I2350-K2360 CarbonylContact O-C 3.55Å; I2350-K2360 WeakPolarHBondContact O-CA 3.32Å; D2351-K2360 WeakPolarHBondContact OD1-CD 3.35Å; D2351-K2360 WeakPolarHBondContact OD1-CE 3.38Å; D2351-K2360 VanDerWaalsContact OD1-CG 3.27Å; D2351-K2360 WeakPolarHBondContact OD1-CG 3.35Å; D2351-K2360 IonicContact OD1-NZ 3.17Å; D2351-K2360 PolarHBondContact OD1-NZ 3.48Å; D2351-K2360 IonicContact OD2-NZ 3.62Å; D2351-K2360 PolarHBondContact OD2-NZ 2.96Å; K2360-I2383 CarbonylContact O-C 3.56Å; K2360-I2383 WeakPolarHBondContact O-CA 3.27Å; K2360-T2384 WeakPolarHBondContact CB-OG1 3.38Å; K2360-T2384 PolarHBondContact N-O 3.15Å; K2360-T2384 CarbonylContact O-C 3.59Å; K2360-T2384 PolarHBondContact O-N 3.1Å; K2360-T2384 PolarHBondContact O-OG1 3.19Å; K2360-P2386 WeakPolarHBondContact O-CD 3.1Å; K2360-P2386 VanDerWaalsContact O-CG 3.25Å; K2360-P2386 WeakPolarHBondContact O-CG 3.35Å
2361	V	64.1	Low	58.6	Low	11.4 Å²	11.4	69.5 Å²	69.5	7%	0.069	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	118.4	171.6	-177.2	0	0	0	0	108.5	E2349 I2350 Y2352 W2359 L2363 Q2382 I2383	E2349-V2361 CarbonylContact C-O 3.53Å; E2349-V2361 WeakPolarHBondContact CA-O 3.25Å; I2350-V2361 HydrophobicContact CB-CB 4.46Å; I2350-V2361 PolarHBondContact N-O 3.05Å; I2350-V2361 PolarHBondContact O-N 3.06Å; Y2352-V2361 HydrophobicContact CD2-CB 4.33Å; Y2352-V2361 HydrophobicContact CD2-CG2 3.99Å; Y2352-V2361 HydrophobicContact CE2-CB 4.05Å; Y2352-V2361 HydrophobicContact CE2-CG2 3.65Å; Y2352-V2361 VanDerWaalsContact CE2-CG2 3.49Å; W2359-V2361 HydrophobicContact CE3-CG2 4.06Å; W2359-V2361 HydrophobicContact CH2-CG2 4.22Å; W2359-V2361 HydrophobicContact CZ3-CG2 3.44Å; W2359-V2361 VanDerWaalsContact CZ3-CG2 3.44Å; V2361-L2363 HydrophobicContact CG1-CD1 3.96Å; V2361-L2363 HydrophobicContact CG1-CD2 4.11Å; V2361-L2363 HydrophobicContact CG1-CG 4.09Å; V2361-Q2382 WeakPolarHBondContact CA-O 3.39Å; V2361-I2383 HydrophobicContact CB-CG1 4.15Å; V2361-I2383 HydrophobicContact CG1-CD1 3.98Å; V2361-I2383 HydrophobicContact CG1-CG1 3.92Å; V2361-I2383 HydrophobicContact CG1-CG2 3.93Å; V2361-I2383 HydrophobicContact CG2-CD1 4.32Å; V2361-I2383 HydrophobicContact CG2-CG1 4.25Å; V2361-I2383 HydrophobicContact CG2-CG2 4.38Å
2362	R	66.7	Low	58	Low	85.8 Å²	85.8	72.2 Å²	72.2	32%	0.324	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	120	172.7	-165	-174.8	-156.2	-178.1	7.1	109.6	E2347 M2348 E2349 R2381 Q2382 I2383 T2384	E2347-R2362 VanDerWaalsContact CD-NE 3.3Å; E2347-R2362 HydrophobicContact CG-CG 4.25Å; E2347-R2362 IonicContact OE1-CZ 3.54Å; E2347-R2362 IonicContact OE1-NE 2.78Å; E2347-R2362 PolarHBondContact OE1-NE 3Å; E2347-R2362 IonicContact OE1-NH1 2.58Å; E2347-R2362 IonicContact OE1-NH2 3.6Å; E2347-R2362 PolarHBondContact OE1-NH2 3.06Å; E2347-R2362 WeakPolarHBondContact OE2-CD 3.27Å; E2347-R2362 IonicContact OE2-CZ 3.54Å; E2347-R2362 IonicContact OE2-NE 3.24Å; E2347-R2362 PolarHBondContact OE2-NE 2.78Å; E2347-R2362 IonicContact OE2-NH1 3.18Å; E2347-R2362 PolarHBondContact OE2-NH1 3.36Å; E2347-R2362 IonicContact OE2-NH2 3.56Å; E2347-R2362 PolarHBondContact OE2-NH2 3.06Å; M2348-R2362 CarbonylContact O-C 3.59Å; M2348-R2362 WeakPolarHBondContact O-CA 3.29Å; E2349-R2362 HydrophobicContact CB-CG 4.35Å; E2349-R2362 HydrophobicContact CG-CB 4.28Å; E2349-R2362 HydrophobicContact CG-CG 4.07Å; E2349-R2362 IonicContact OE1-CZ 3.73Å; E2349-R2362 IonicContact OE1-NE 2.83Å; E2349-R2362 PolarHBondContact OE1-NE 3.05Å; E2349-R2362 IonicContact OE1-NH2 2.76Å; E2349-R2362 PolarHBondContact OE1-NH2 2.99Å; E2349-R2362 IonicContact OE2-CZ 3.4Å; E2349-R2362 IonicContact OE2-NE 3.52Å; E2349-R2362 PolarHBondContact OE2-NE 3.45Å; E2349-R2362 IonicContact OE2-NH2 3.22Å; E2349-R2362 PolarHBondContact OE2-NH2 3.16Å; R2362-R2381 CarbonylContact O-C 3.5Å; R2362-R2381 WeakPolarHBondContact O-CA 3.5Å; R2362-Q2382 CarbonylContact C-O 3.45Å; R2362-Q2382 WeakPolarHBondContact CA-O 3.32Å; R2362-Q2382 HydrophobicContact CB-CB 4.25Å; R2362-Q2382 VanDerWaalsContact CD-OE1 3.29Å; R2362-Q2382 PolarHBondContact N-O 3.14Å; R2362-Q2382 CarbonylContact O-C 3.57Å; R2362-Q2382 PolarHBondContact O-N 3.2Å; R2362-I2383 CarbonylContact O-C 3.58Å; R2362-I2383 WeakPolarHBondContact O-CA 3.5Å; R2362-T2384 PolarHBondContact N-O 2.8Å; R2362-T2384 PolarHBondContact O-N 3.42Å
2363	L	62.8	Low	57.5	Low	45.6 Å²	45.6	74.3 Å²	74.3	24%	0.239	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	129	170.2	-71.3	134.7	0	0	0	108.5	E2347 M2348 I2350 V2361 L2379 I2380 R2381 Q2382 I2383	E2347-L2363 CarbonylContact C-O 3.54Å; E2347-L2363 VanDerWaalsContact CA-O 3.28Å; E2347-L2363 WeakPolarHBondContact CA-O 3.28Å; M2348-L2363 HydrophobicContact CB-CB 4.37Å; M2348-L2363 PolarHBondContact N-O 3.06Å; M2348-L2363 PolarHBondContact O-N 3.11Å; M2348-L2363 HydrophobicContact SD-CD1 4.33Å; I2350-L2363 HydrophobicContact CD1-CD1 4.2Å; V2361-L2363 HydrophobicContact CG1-CD1 3.96Å; V2361-L2363 HydrophobicContact CG1-CD2 4.11Å; V2361-L2363 HydrophobicContact CG1-CG 4.09Å; L2363-L2379 HydrophobicContact CD2-CD1 4.37Å; L2363-I2380 CarbonylContact C-O 3.5Å; L2363-I2380 WeakPolarHBondContact CA-O 3.09Å; L2363-R2381 HydrophobicContact CD2-CB 3.94Å; L2363-R2381 HydrophobicContact CD2-CG 3.98Å; L2363-R2381 HydrophobicContact CG-CG 4.11Å; L2363-Q2382 CarbonylContact C-O 3.48Å; L2363-Q2382 WeakPolarHBondContact CA-O 3.49Å; L2363-I2383 HydrophobicContact CD2-CD1 4.23Å; L2363-I2383 HydrophobicContact CD2-CG1 4.23Å; L2363-I2383 HydrophobicContact CG-CD1 4.46Å; L2363-I2383 HydrophobicContact CG-CG1 4.08Å; L2363-I2383 HydrophobicContact CG-CG2 4.43Å
2364	A	64.7	Low	57.2	Low	4.8 Å²	4.8	79 Å²	79	4%	0.04	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	129.2	172.9	0	0	0	0	0	110.3	H2346 E2347 V2366 L2379 I2380 R2381 Q2382	H2346-A2364 CarbonylContact O-C 3.53Å; H2346-A2364 VanDerWaalsContact O-CA 3.27Å; H2346-A2364 WeakPolarHBondContact O-CA 3.39Å; E2347-A2364 HydrophobicContact CB-CB 4.24Å; E2347-A2364 HydrophobicContact CG-CB 3.9Å; A2364-V2366 HydrophobicContact CB-CG2 4.37Å; A2364-L2379 CarbonylContact O-C 3.57Å; A2364-L2379 WeakPolarHBondContact O-CA 3.14Å; A2364-I2380 HydrophobicContact CB-CB 4.13Å; A2364-I2380 HydrophobicContact CB-CD1 4.36Å; A2364-I2380 PolarHBondContact N-O 2.95Å; A2364-I2380 PolarHBondContact O-N 3.02Å; A2364-R2381 CarbonylContact O-C 3.55Å; A2364-R2381 WeakPolarHBondContact O-CA 3.47Å; A2364-Q2382 HydrophobicContact CB-CB 4.25Å; A2364-Q2382 PolarHBondContact N-O 2.88Å; A2364-Q2382 PolarHBondContact O-N 3.28Å
2365	Q	60.7	Low	57.1	Low	41.4 Å²	41.4	77.4 Å²	77.4	19%	0.193	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	116.7	172.8	-109.8	176.1	-9.9	0	0	108.7	S2151 K2345 H2346 Y2367 P2376 Q2378 L2379 I2380 R2381	S2151-Q2365 VanDerWaalsContact O-CD 3.27Å; S2151-Q2365 PolarHBondContact O-NE2 3.31Å; S2151-Q2365 PolarHBondContact O-OE1 3Å; K2345-Q2365 CarbonylContact C-O 3.55Å; K2345-Q2365 WeakPolarHBondContact CA-O 3.35Å; H2346-Q2365 HydrophobicContact CB-CB 4.4Å; H2346-Q2365 PolarHBondContact N-O 3.13Å; H2346-Q2365 PolarHBondContact O-N 2.96Å; Q2365-Y2367 HydrophobicContact CB-CE2 4.2Å; Q2365-Y2367 VanDerWaalsContact CD-OH 3.32Å; Q2365-Y2367 HydrophobicContact CG-CD2 4.36Å; Q2365-Y2367 HydrophobicContact CG-CE2 3.67Å; Q2365-Y2367 PolarHBondContact NE2-OH 2.79Å; Q2365-Y2367 PolarHBondContact OE1-OH 2.55Å; Q2365-Y2367 VanDerWaalsContact OE1-OH 3.1Å; Q2365-P2376 HydrophobicContact CG-CB 4.18Å; Q2365-Q2378 CarbonylContact C-O 3.55Å; Q2365-Q2378 WeakPolarHBondContact CA-O 3.39Å; Q2365-L2379 HydrophobicContact CB-CD1 3.99Å; Q2365-L2379 HydrophobicContact CB-CD2 3.89Å; Q2365-L2379 HydrophobicContact CG-CD1 3.71Å; Q2365-L2379 VanDerWaalsContact CG-CD1 3.44Å; Q2365-L2379 HydrophobicContact CG-CD2 3.7Å; Q2365-L2379 HydrophobicContact CG-CG 4.22Å; Q2365-I2380 CarbonylContact C-O 3.54Å; Q2365-I2380 WeakPolarHBondContact CA-O 3.4Å; Q2365-R2381 HydrophobicContact CG-CG 3.83Å
2366	V	62.1	Low	57	Low	29 Å²	29	73.8 Å²	73.8	18%	0.176	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	124.9	-179.2	-169.7	0	0	0	0	108.5	N2344 K2345 A2364 Q2368 V2377 Q2378 I2380 Q2382	N2344-V2366 HydrophobicContact CB-CG1 4.22Å; N2344-V2366 CarbonylContact O-C 3.48Å; N2344-V2366 VanDerWaalsContact O-CA 3.28Å; N2344-V2366 WeakPolarHBondContact O-CA 3.3Å; K2345-V2366 HydrophobicContact CB-CG2 4.35Å; K2345-V2366 HydrophobicContact CD-CG2 4.29Å; K2345-V2366 HydrophobicContact CG-CG2 4.08Å; A2364-V2366 HydrophobicContact CB-CG2 4.37Å; V2366-Q2368 HydrophobicContact CG1-CG 4.14Å; V2366-V2377 HydrophobicContact CG1-CB 4.48Å; V2366-V2377 PolarHBondContact O-N 3.04Å; V2366-Q2378 HydrophobicContact CB-CB 4Å; V2366-Q2378 HydrophobicContact CG2-CB 4.12Å; V2366-Q2378 PolarHBondContact N-O 3.15Å; V2366-Q2378 PolarHBondContact O-N 3.16Å; V2366-Q2378 VanDerWaalsContact O-N 3.12Å; V2366-I2380 HydrophobicContact CG2-CD1 4.47Å; V2366-I2380 PolarHBondContact N-O 3.1Å; V2366-I2380 PolarHBondContact O-N 3.01Å; V2366-Q2382 HydrophobicContact CG2-CG 4.32Å
2367	Y	57.7	Low	57.4	Low	31 Å²	31	69.1 Å²	69.1	12%	0.122	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	135.7	173	-66.8	-90.6	0	0	0	109.1	L2149 S2151 D2154 T2171 M2337 N2344 H2346 Q2365 A2375 P2376 V2377 Q2378 L2379	L2149-Y2367 HydrophobicContact CD1-CD1 4.1Å; L2149-Y2367 HydrophobicContact CD1-CE1 3.74Å; L2149-Y2367 HydrophobicContact CD2-CD1 3.66Å; L2149-Y2367 HydrophobicContact CD2-CD2 3.67Å; L2149-Y2367 HydrophobicContact CD2-CE1 3.95Å; L2149-Y2367 HydrophobicContact CD2-CE2 3.95Å; L2149-Y2367 HydrophobicContact CD2-CG 3.52Å; L2149-Y2367 HydrophobicContact CG-CE1 4.47Å; S2151-Y2367 PolarHBondContact O-OH 2.71Å; D2154-Y2367 PolarHBondContact OD1-OH 3.49Å; T2171-Y2367 HydrophobicContact CG2-CE1 4.13Å; M2337-Y2367 WeakPolarHBondContact CE-OH 3.46Å; N2344-Y2367 WeakPolarHBondContact CA-O 3.37Å; N2344-Y2367 VanDerWaalsContact CB-O 3.27Å; N2344-Y2367 WeakPolarHBondContact CB-O 3.37Å; N2344-Y2367 PolarHBondContact ND2-O 2.73Å; N2344-Y2367 VanDerWaalsContact O-CD2 3.25Å; N2344-Y2367 WeakPolarHBondContact O-CD2 3.33Å; N2344-Y2367 PolarHBondContact O-N 3.12Å; N2344-Y2367 VanDerWaalsContact O-O 3.14Å; H2346-Y2367 HydrophobicContact CB-CE2 4.04Å; H2346-Y2367 AromaticContact CG-CE2 3.94Å; H2346-Y2367 AromaticContact ND1-CD2 3.78Å; H2346-Y2367 AromaticContact ND1-CE2 3.7Å; Q2365-Y2367 HydrophobicContact CB-CE2 4.2Å; Q2365-Y2367 VanDerWaalsContact CD-OH 3.32Å; Q2365-Y2367 HydrophobicContact CG-CD2 4.36Å; Q2365-Y2367 HydrophobicContact CG-CE2 3.67Å; Q2365-Y2367 PolarHBondContact NE2-OH 2.79Å; Q2365-Y2367 PolarHBondContact OE1-OH 2.55Å; Q2365-Y2367 VanDerWaalsContact OE1-OH 3.1Å; Y2367-A2375 CarbonylContact C-O 3.55Å; Y2367-A2375 WeakPolarHBondContact CA-O 3.4Å; Y2367-P2376 HydrophobicContact CD1-CB 4.11Å; Y2367-P2376 HydrophobicContact CD1-CG 4.5Å; Y2367-P2376 HydrophobicContact CE1-CB 3.9Å; Y2367-P2376 HydrophobicContact CE1-CG 4.29Å; Y2367-V2377 HydrophobicContact CD1-CG1 4.48Å; Y2367-Q2378 WeakPolarHBondContact CA-O 3.45Å; Y2367-L2379 HydrophobicContact CD1-CD1 4.05Å; Y2367-L2379 HydrophobicContact CD2-CD1 4.38Å; Y2367-L2379 HydrophobicContact CE1-CB 4.42Å; Y2367-L2379 HydrophobicContact CE1-CD1 3.7Å; Y2367-L2379 HydrophobicContact CE1-CG 4.46Å; Y2367-L2379 HydrophobicContact CE2-CD1 4.05Å; Y2367-L2379 HydrophobicContact CG-CD1 4.38Å
2368	Q	57.9	Low	57.7	Low	103.4 Å²	103.4	68.7 Å²	68.7	48%	0.483	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	122	167.2	-157.3	174.9	-11.9	0	0	107.7	V2366 Q2370 A2375 V2377 Q2378 I2380	V2366-Q2368 HydrophobicContact CG1-CG 4.14Å; Q2368-Q2370 PolarHBondContact O-N 3.12Å; Q2368-A2375 PolarHBondContact N-O 3.25Å; Q2368-A2375 PolarHBondContact O-N 3.09Å; Q2368-V2377 HydrophobicContact CB-CB 4.1Å; Q2368-V2377 HydrophobicContact CB-CG2 3.43Å; Q2368-V2377 VanDerWaalsContact CB-CG2 3.45Å; Q2368-V2377 HydrophobicContact CG-CG2 4.33Å; Q2368-Q2378 HydrophobicContact CB-CB 4.49Å; Q2368-Q2378 PolarHBondContact N-O 3.25Å; Q2368-Q2378 PolarHBondContact O-N 2.69Å; Q2368-I2380 HydrophobicContact CB-CD1 4.36Å; Q2368-I2380 HydrophobicContact CG-CD1 4Å
2369	V	52.3	Low	58	Low	65.8 Å²	65.8	66.9 Å²	66.9	40%	0.399	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	112.4	175.9	-177.1	0	0	0	0	107.5	N2344 K2371 L2373 Y2374 V2377	N2344-V2369 VanDerWaalsContact OD1-CG2 3.26Å; N2344-V2369 WeakPolarHBondContact OD1-CG2 3.24Å; V2369-K2371 PolarHBondContact O-N 3.15Å; V2369-L2373 WeakPolarHBondContact CA-O 3.27Å; V2369-Y2374 HydrophobicContact CB-CD1 4.5Å; V2369-Y2374 HydrophobicContact CB-CE1 4.43Å; V2369-Y2374 HydrophobicContact CG1-CD1 4.46Å; V2369-Y2374 HydrophobicContact CG1-CE1 4.11Å; V2369-Y2374 HydrophobicContact CG2-CD1 3.72Å; V2369-Y2374 VanDerWaalsContact CG2-CD1 3.43Å; V2369-Y2374 HydrophobicContact CG2-CE1 3.8Å; V2369-Y2374 VanDerWaalsContact CG2-CE1 3.48Å; V2369-Y2374 HydrophobicContact CG2-CG 4.45Å; V2369-V2377 HydrophobicContact CG2-CG1 4.5Å; V2369-V2377 HydrophobicContact CG2-CG2 4.43Å
2370	Q	51.2	Low	58.1	Low	135 Å²	135	65.1 Å²	65.1	63%	0.631	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.7	121.8	169	-129.4	178.8	-16	0	0	108.5	Q2368 D2372 L2373	Q2368-Q2370 PolarHBondContact O-N 3.12Å; Q2370-D2372 VanDerWaalsContact C-N 3.26Å; Q2370-D2372 PolarHBondContact O-N 3.12Å; Q2370-D2372 VanDerWaalsContact O-N 3.08Å; Q2370-L2373 PolarHBondContact N-O 2.94Å; Q2370-L2373 VanDerWaalsContact N-O 3.11Å; Q2370-L2373 WeakPolarHBondContact O-CB 3.35Å; Q2370-L2373 PolarHBondContact O-N 3.15Å; Q2370-L2373 VanDerWaalsContact O-N 3.09Å
2371	K	49.8	Very low	58.1	Low	183.2 Å²	183.2	65 Å²	65	80%	0.797	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	7.8	58	-178.5	-88.2	-176.7	173.8	-170.9	0	112.8	V2369 L2373	V2369-K2371 PolarHBondContact O-N 3.15Å; K2371-L2373 PolarHBondContact O-N 2.86Å; K2371-L2373 VanDerWaalsContact O-N 3.11Å
2372	D	48	Very low	58.3	Low	105.2 Å²	105.2	66.7 Å²	66.7	56%	0.563	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.5	6.2	-178.6	-52.1	-38.6	0	0	0	117.2	R2147 Q2370	R2147-D2372 PolarHBondContact NH1-O 3.1Å; Q2370-D2372 VanDerWaalsContact C-N 3.26Å; Q2370-D2372 PolarHBondContact O-N 3.12Å; Q2370-D2372 VanDerWaalsContact O-N 3.08Å
2373	L	45.8	Very low	58.2	Low	106 Å²	106	63.8 Å²	63.8	56%	0.555	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.4	121.1	165.4	-101.9	92.6	0	0	0	110.1	V2369 Q2370 K2371 A2375 I2412	V2369-L2373 WeakPolarHBondContact CA-O 3.27Å; Q2370-L2373 PolarHBondContact N-O 2.94Å; Q2370-L2373 VanDerWaalsContact N-O 3.11Å; Q2370-L2373 WeakPolarHBondContact O-CB 3.35Å; Q2370-L2373 PolarHBondContact O-N 3.15Å; Q2370-L2373 VanDerWaalsContact O-N 3.09Å; K2371-L2373 PolarHBondContact O-N 2.86Å; K2371-L2373 VanDerWaalsContact O-N 3.11Å; L2373-A2375 HydrophobicContact CB-CB 4.43Å; L2373-A2375 HydrophobicContact CD2-CB 4.34Å; L2373-A2375 WeakPolarHBondContact O-CB 3.12Å; L2373-A2375 PolarHBondContact O-N 3.08Å; L2373-I2412 HydrophobicContact CD2-CD1 4.41Å
2374	Y	50.2	Low	58.4	Low	129.4 Å²	129.4	63.4 Å²	63.4	51%	0.507	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	88.9	167.3	-69.7	-90.8	0	0	0	109.2	L2149 V2369	L2149-Y2374 HydrophobicContact CB-CD1 3.76Å; L2149-Y2374 HydrophobicContact CB-CD2 4.17Å; L2149-Y2374 HydrophobicContact CB-CE1 4.01Å; L2149-Y2374 HydrophobicContact CB-CE2 4.4Å; L2149-Y2374 HydrophobicContact CB-CG 3.87Å; L2149-Y2374 HydrophobicContact CD2-CD1 3.53Å; L2149-Y2374 HydrophobicContact CD2-CE1 4.21Å; L2149-Y2374 HydrophobicContact CD2-CG 4.07Å; L2149-Y2374 HydrophobicContact CG-CD1 4.19Å; L2149-Y2374 HydrophobicContact CG-CG 4.39Å; V2369-Y2374 HydrophobicContact CB-CD1 4.5Å; V2369-Y2374 HydrophobicContact CB-CE1 4.43Å; V2369-Y2374 HydrophobicContact CG1-CD1 4.46Å; V2369-Y2374 HydrophobicContact CG1-CE1 4.11Å; V2369-Y2374 HydrophobicContact CG2-CD1 3.72Å; V2369-Y2374 VanDerWaalsContact CG2-CD1 3.43Å; V2369-Y2374 HydrophobicContact CG2-CE1 3.8Å; V2369-Y2374 VanDerWaalsContact CG2-CE1 3.48Å; V2369-Y2374 HydrophobicContact CG2-CG 4.45Å
2375	A	52.9	Low	58.4	Low	27.6 Å²	27.6	65 Å²	65	23%	0.228	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	129.1	175.5	0	0	0	0	0	109	Y2367 Q2368 L2373 V2377 L2404	Y2367-A2375 CarbonylContact C-O 3.55Å; Y2367-A2375 WeakPolarHBondContact CA-O 3.4Å; Q2368-A2375 PolarHBondContact N-O 3.25Å; Q2368-A2375 PolarHBondContact O-N 3.09Å; L2373-A2375 HydrophobicContact CB-CB 4.43Å; L2373-A2375 HydrophobicContact CD2-CB 4.34Å; L2373-A2375 WeakPolarHBondContact O-CB 3.12Å; L2373-A2375 PolarHBondContact O-N 3.08Å; A2375-V2377 WeakPolarHBondContact O-CG2 3.33Å; A2375-V2377 PolarHBondContact O-N 2.98Å; A2375-L2404 HydrophobicContact CB-CD1 3.99Å
2376	P	53.8	Low	58.3	Low	23 Å²	23	65.3 Å²	65.3	15%	0.149	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	134.9	173.9	24.2	-30.3	0	0	0	109.3	T2171 Q2365 Y2367 Q2378 T2401 Y2402 L2404 N2405	T2171-P2376 VanDerWaalsContact O-CD 3.29Å; T2171-P2376 WeakPolarHBondContact O-CD 3.44Å; Q2365-P2376 HydrophobicContact CG-CB 4.18Å; Y2367-P2376 HydrophobicContact CD1-CB 4.11Å; Y2367-P2376 HydrophobicContact CD1-CG 4.5Å; Y2367-P2376 HydrophobicContact CE1-CB 3.9Å; Y2367-P2376 HydrophobicContact CE1-CG 4.29Å; P2376-Q2378 PolarHBondContact O-N 2.93Å; P2376-T2401 HydrophobicContact CB-CG2 4.02Å; P2376-T2401 HydrophobicContact CG-CG2 4.31Å; P2376-Y2402 WeakPolarHBondContact CA-O 3.32Å; P2376-Y2402 HydrophobicContact CB-CD1 3.76Å; P2376-Y2402 HydrophobicContact CB-CD2 4.38Å; P2376-Y2402 HydrophobicContact CB-CE1 4.28Å; P2376-Y2402 HydrophobicContact CB-CG 4.1Å; P2376-Y2402 WeakPolarHBondContact CB-O 3.18Å; P2376-Y2402 HydrophobicContact CG-CD1 3.95Å; P2376-Y2402 VanDerWaalsContact CG-CD1 3.48Å; P2376-Y2402 HydrophobicContact CG-CE1 4.15Å; P2376-Y2402 HydrophobicContact CG-CG 4.17Å; P2376-Y2402 WeakPolarHBondContact O-CB 3.33Å; P2376-L2404 HydrophobicContact CB-CD1 3.94Å; P2376-L2404 HydrophobicContact CG-CD1 4.21Å; P2376-L2404 WeakPolarHBondContact O-CB 3.4Å; P2376-N2405 PolarHBondContact O-ND2 3.31Å; P2376-N2405 VanDerWaalsContact O-ND2 3.16Å
2377	V	62.5	Low	58	Low	40.8 Å²	40.8	65.2 Å²	65.2	25%	0.247	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	-27.3	177.5	-177.2	0	0	0	0	109.9	V2366 Y2367 Q2368 V2369 A2375 T2401 Y2402 L2404	V2366-V2377 HydrophobicContact CG1-CB 4.48Å; V2366-V2377 PolarHBondContact O-N 3.04Å; Y2367-V2377 HydrophobicContact CD1-CG1 4.48Å; Q2368-V2377 HydrophobicContact CB-CB 4.1Å; Q2368-V2377 HydrophobicContact CB-CG2 3.43Å; Q2368-V2377 VanDerWaalsContact CB-CG2 3.45Å; Q2368-V2377 HydrophobicContact CG-CG2 4.33Å; V2369-V2377 HydrophobicContact CG2-CG1 4.5Å; V2369-V2377 HydrophobicContact CG2-CG2 4.43Å; A2375-V2377 WeakPolarHBondContact O-CG2 3.33Å; A2375-V2377 PolarHBondContact O-N 2.98Å; V2377-T2401 CarbonylContact O-C 3.52Å; V2377-T2401 VanDerWaalsContact O-CA 3.24Å; V2377-T2401 WeakPolarHBondContact O-CA 3.41Å; V2377-Y2402 PolarHBondContact O-N 3.09Å; V2377-Y2402 VanDerWaalsContact O-N 3.12Å; V2377-L2404 CarbonylContact C-O 3.58Å; V2377-L2404 WeakPolarHBondContact CA-O 3.21Å; V2377-L2404 CarbonylContact O-C 3.56Å; V2377-L2404 PolarHBondContact O-N 3.18Å
2378	Q	63.3	Low	57.8	Low	58.8 Å²	58.8	69.1 Å²	69.1	28%	0.275	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	133.3	179.7	-99.4	-179.5	-14.3	0	0	111.9	Q2365 V2366 Y2367 Q2368 P2376 I2380 V2399 W2400 T2401 H2403	Q2365-Q2378 CarbonylContact C-O 3.55Å; Q2365-Q2378 WeakPolarHBondContact CA-O 3.39Å; V2366-Q2378 HydrophobicContact CB-CB 4Å; V2366-Q2378 HydrophobicContact CG2-CB 4.12Å; V2366-Q2378 PolarHBondContact N-O 3.15Å; V2366-Q2378 PolarHBondContact O-N 3.16Å; V2366-Q2378 VanDerWaalsContact O-N 3.12Å; Y2367-Q2378 WeakPolarHBondContact CA-O 3.45Å; Q2368-Q2378 HydrophobicContact CB-CB 4.49Å; Q2368-Q2378 PolarHBondContact N-O 3.25Å; Q2368-Q2378 PolarHBondContact O-N 2.69Å; P2376-Q2378 PolarHBondContact O-N 2.93Å; Q2378-I2380 HydrophobicContact CB-CD1 4.5Å; Q2378-I2380 HydrophobicContact CB-CG1 4.24Å; Q2378-I2380 HydrophobicContact CG-CG1 4.27Å; Q2378-V2399 HydrophobicContact CB-CG1 4.21Å; Q2378-V2399 HydrophobicContact CG-CG1 4.14Å; Q2378-W2400 CarbonylContact C-O 3.56Å; Q2378-W2400 WeakPolarHBondContact CA-O 3.24Å; Q2378-T2401 HydrophobicContact CG-CG2 3.93Å; Q2378-H2403 HydrophobicContact CG-CB 4.18Å; Q2378-H2403 WeakPolarHBondContact CG-ND1 3.18Å; Q2378-H2403 PolarHBondContact NE2-CE1 2.85Å; Q2378-H2403 PolarHBondContact NE2-ND1 3.35Å; Q2378-H2403 PolarHBondContact NE2-NE2 3.05Å; Q2378-H2403 VanDerWaalsContact NE2-NE2 3.15Å
2379	L	62.9	Low	57.3	Low	30.4 Å²	30.4	71.9 Å²	71.9	16%	0.159	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	112	163.9	-140.5	110.8	0	0	0	108.7	L2363 A2364 Q2365 Y2367 R2381 V2399 W2400 Y2402 L2404	L2363-L2379 HydrophobicContact CD2-CD1 4.37Å; A2364-L2379 CarbonylContact O-C 3.57Å; A2364-L2379 WeakPolarHBondContact O-CA 3.14Å; Q2365-L2379 HydrophobicContact CB-CD1 3.99Å; Q2365-L2379 HydrophobicContact CB-CD2 3.89Å; Q2365-L2379 HydrophobicContact CG-CD1 3.71Å; Q2365-L2379 VanDerWaalsContact CG-CD1 3.44Å; Q2365-L2379 HydrophobicContact CG-CD2 3.7Å; Q2365-L2379 HydrophobicContact CG-CG 4.22Å; Y2367-L2379 HydrophobicContact CD1-CD1 4.05Å; Y2367-L2379 HydrophobicContact CD2-CD1 4.38Å; Y2367-L2379 HydrophobicContact CE1-CB 4.42Å; Y2367-L2379 HydrophobicContact CE1-CD1 3.7Å; Y2367-L2379 HydrophobicContact CE1-CG 4.46Å; Y2367-L2379 HydrophobicContact CE2-CD1 4.05Å; Y2367-L2379 HydrophobicContact CG-CD1 4.38Å; L2379-R2381 HydrophobicContact CD2-CG 4.46Å; L2379-R2381 HydrophobicContact CG-CG 4.35Å; L2379-V2399 HydrophobicContact CD2-CB 4.16Å; L2379-V2399 HydrophobicContact CD2-CG1 4.22Å; L2379-V2399 HydrophobicContact CG-CB 4.22Å; L2379-V2399 HydrophobicContact CG-CG2 4.48Å; L2379-V2399 CarbonylContact O-C 3.46Å; L2379-V2399 VanDerWaalsContact O-CA 3.3Å; L2379-V2399 WeakPolarHBondContact O-CA 3.38Å; L2379-V2399 PolarHBondContact O-N 2.99Å; L2379-W2400 HydrophobicContact CB-CB 4.19Å; L2379-W2400 HydrophobicContact CD2-CZ3 3.94Å; L2379-W2400 PolarHBondContact N-O 3Å; L2379-W2400 PolarHBondContact O-N 2.97Å; L2379-Y2402 CarbonylContact C-O 3.54Å; L2379-Y2402 VanDerWaalsContact C-O 3.22Å; L2379-Y2402 VanDerWaalsContact CA-O 3.24Å; L2379-Y2402 WeakPolarHBondContact CA-O 3.17Å; L2379-Y2402 HydrophobicContact CB-CD1 4.16Å; L2379-Y2402 HydrophobicContact CB-CE2 4.21Å; L2379-Y2402 WeakPolarHBondContact CB-O 3.48Å; L2379-Y2402 HydrophobicContact CD1-CE2 3.83Å; L2379-Y2402 WeakPolarHBondContact CD1-OH 3.47Å; L2379-Y2402 HydrophobicContact CD2-CD1 4.49Å; L2379-Y2402 HydrophobicContact CG-CE2 4.04Å; L2379-Y2402 PolarHBondContact N-O 3.32Å; L2379-Y2402 CarbonylContact O-C 3.09Å; L2379-Y2402 VanDerWaalsContact O-C 3.32Å; L2379-Y2402 WeakPolarHBondContact O-CA 3.3Å; L2379-Y2402 WeakPolarHBondContact O-CB 3.42Å; L2379-Y2402 PolarHBondContact O-N 3.13Å; L2379-L2404 HydrophobicContact CB-CD1 3.85Å; L2379-L2404 HydrophobicContact CB-CG 4.39Å; L2379-L2404 HydrophobicContact CD1-CD1 4.4Å
2380	I	65.2	Low	57	Low	30 Å²	30	76 Å²	76	15%	0.154	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	129.9	-179.7	-57.5	172.1	0	0	0	108.4	L2363 A2364 Q2365 V2366 Q2368 Q2378 Q2382 N2398 V2399 T2401	L2363-I2380 CarbonylContact C-O 3.5Å; L2363-I2380 WeakPolarHBondContact CA-O 3.09Å; A2364-I2380 HydrophobicContact CB-CB 4.13Å; A2364-I2380 HydrophobicContact CB-CD1 4.36Å; A2364-I2380 PolarHBondContact N-O 2.95Å; A2364-I2380 PolarHBondContact O-N 3.02Å; Q2365-I2380 CarbonylContact C-O 3.54Å; Q2365-I2380 WeakPolarHBondContact CA-O 3.4Å; V2366-I2380 HydrophobicContact CG2-CD1 4.47Å; V2366-I2380 PolarHBondContact N-O 3.1Å; V2366-I2380 PolarHBondContact O-N 3.01Å; Q2368-I2380 HydrophobicContact CB-CD1 4.36Å; Q2368-I2380 HydrophobicContact CG-CD1 4Å; Q2378-I2380 HydrophobicContact CB-CD1 4.5Å; Q2378-I2380 HydrophobicContact CB-CG1 4.24Å; Q2378-I2380 HydrophobicContact CG-CG1 4.27Å; I2380-Q2382 HydrophobicContact CG2-CB 4.3Å; I2380-Q2382 HydrophobicContact CG2-CG 4Å; I2380-N2398 CarbonylContact C-O 3.51Å; I2380-N2398 WeakPolarHBondContact CA-O 3.1Å; I2380-V2399 HydrophobicContact CB-CG2 4.43Å; I2380-V2399 HydrophobicContact CG1-CG1 3.96Å; I2380-V2399 HydrophobicContact CG1-CG2 4.04Å; I2380-V2399 HydrophobicContact CG2-CG2 4.16Å; I2380-T2401 HydrophobicContact CB-CG2 4.5Å; I2380-T2401 HydrophobicContact CG1-CG2 4.27Å; I2380-T2401 HydrophobicContact CG2-CG2 3.96Å
2381	R	65.9	Low	56.8	Low	77.6 Å²	77.6	79.1 Å²	79.1	29%	0.293	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	112.9	170.7	-139.1	177.7	-159.8	-148.9	4.1	109.4	R2362 L2363 A2364 Q2365 L2379 N2396 T2397 N2398 V2399 W2400	R2362-R2381 CarbonylContact O-C 3.5Å; R2362-R2381 WeakPolarHBondContact O-CA 3.5Å; L2363-R2381 HydrophobicContact CD2-CB 3.94Å; L2363-R2381 HydrophobicContact CD2-CG 3.98Å; L2363-R2381 HydrophobicContact CG-CG 4.11Å; A2364-R2381 CarbonylContact O-C 3.55Å; A2364-R2381 WeakPolarHBondContact O-CA 3.47Å; Q2365-R2381 HydrophobicContact CG-CG 3.83Å; L2379-R2381 HydrophobicContact CD2-CG 4.46Å; L2379-R2381 HydrophobicContact CG-CG 4.35Å; R2381-N2396 WeakPolarHBondContact O-CA 3.4Å; R2381-T2397 PolarHBondContact N-O 3.47Å; R2381-T2397 CarbonylContact O-C 3.52Å; R2381-T2397 WeakPolarHBondContact O-CA 3.43Å; R2381-T2397 PolarHBondContact O-N 3.18Å; R2381-N2398 HydrophobicContact CB-CB 4.45Å; R2381-N2398 PolarHBondContact N-O 2.85Å; R2381-N2398 PolarHBondContact NH1-ND2 2.74Å; R2381-N2398 PolarHBondContact O-N 2.87Å; R2381-V2399 HydrophobicContact CB-CG2 3.74Å; R2381-V2399 VanDerWaalsContact CD-CG2 3.4Å; R2381-V2399 HydrophobicContact CG-CG2 3.43Å; R2381-V2399 VanDerWaalsContact CG-CG2 3.43Å; R2381-V2399 PolarHBondContact O-N 3.12Å; R2381-W2400 CarbonylContact C-O 3.58Å; R2381-W2400 VanDerWaalsContact C-O 3.22Å; R2381-W2400 WeakPolarHBondContact CA-O 3.41Å; R2381-W2400 HydrophobicContact CB-CB 4.5Å; R2381-W2400 HydrophobicContact CB-CE3 3.79Å; R2381-W2400 PolarHBondContact N-O 3.05Å; R2381-W2400 VanDerWaalsContact N-O 3.13Å
2382	Q	67	Low	56.8	Low	47.6 Å²	47.6	74.6 Å²	74.6	22%	0.222	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	122.5	176.5	-136.8	178.4	-6.4	0	0	109	V2361 R2362 L2363 A2364 V2366 I2380 T2384 E2395 N2396 T2397 N2398	V2361-Q2382 WeakPolarHBondContact CA-O 3.39Å; R2362-Q2382 CarbonylContact C-O 3.45Å; R2362-Q2382 WeakPolarHBondContact CA-O 3.32Å; R2362-Q2382 HydrophobicContact CB-CB 4.25Å; R2362-Q2382 VanDerWaalsContact CD-OE1 3.29Å; R2362-Q2382 PolarHBondContact N-O 3.14Å; R2362-Q2382 CarbonylContact O-C 3.57Å; R2362-Q2382 PolarHBondContact O-N 3.2Å; L2363-Q2382 CarbonylContact C-O 3.48Å; L2363-Q2382 WeakPolarHBondContact CA-O 3.49Å; A2364-Q2382 HydrophobicContact CB-CB 4.25Å; A2364-Q2382 PolarHBondContact N-O 2.88Å; A2364-Q2382 PolarHBondContact O-N 3.28Å; V2366-Q2382 HydrophobicContact CG2-CG 4.32Å; I2380-Q2382 HydrophobicContact CG2-CB 4.3Å; I2380-Q2382 HydrophobicContact CG2-CG 4Å; Q2382-T2384 HydrophobicContact CG-CG2 4.48Å; Q2382-E2395 HydrophobicContact CG-CG 4.42Å; Q2382-E2395 PolarHBondContact NE2-OE1 3.16Å; Q2382-E2395 PolarHBondContact NE2-OE2 2.63Å; Q2382-N2396 CarbonylContact C-O 3.56Å; Q2382-N2396 WeakPolarHBondContact CA-O 3.27Å; Q2382-N2396 WeakPolarHBondContact CB-OD1 3.1Å; Q2382-N2396 VanDerWaalsContact CG-OD1 3.3Å; Q2382-N2396 WeakPolarHBondContact CG-OD1 3.09Å; Q2382-T2397 HydrophobicContact CB-CG2 3.99Å; Q2382-T2397 HydrophobicContact CG-CG2 3.68Å; Q2382-N2398 VanDerWaalsContact CG-OD1 3.24Å; Q2382-N2398 WeakPolarHBondContact CG-OD1 3.45Å; Q2382-N2398 PolarHBondContact NE2-OD1 3.29Å
2383	I	65.1	Low	57.2	Low	24.8 Å²	24.8	72.1 Å²	72.1	13%	0.127	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	122.6	173.1	-60.4	176.2	0	0	0	107.9	W2359 K2360 V2361 R2362 L2363 I2385 E2395 N2396 V2399 M2834	W2359-I2383 HydrophobicContact CE3-CG2 4.35Å; W2359-I2383 HydrophobicContact CZ3-CG2 4.43Å; K2360-I2383 CarbonylContact O-C 3.56Å; K2360-I2383 WeakPolarHBondContact O-CA 3.27Å; V2361-I2383 HydrophobicContact CB-CG1 4.15Å; V2361-I2383 HydrophobicContact CG1-CD1 3.98Å; V2361-I2383 HydrophobicContact CG1-CG1 3.92Å; V2361-I2383 HydrophobicContact CG1-CG2 3.93Å; V2361-I2383 HydrophobicContact CG2-CD1 4.32Å; V2361-I2383 HydrophobicContact CG2-CG1 4.25Å; V2361-I2383 HydrophobicContact CG2-CG2 4.38Å; R2362-I2383 CarbonylContact O-C 3.58Å; R2362-I2383 WeakPolarHBondContact O-CA 3.5Å; L2363-I2383 HydrophobicContact CD2-CD1 4.23Å; L2363-I2383 HydrophobicContact CD2-CG1 4.23Å; L2363-I2383 HydrophobicContact CG-CD1 4.46Å; L2363-I2383 HydrophobicContact CG-CG1 4.08Å; L2363-I2383 HydrophobicContact CG-CG2 4.43Å; I2383-I2385 HydrophobicContact CG2-CG1 4.23Å; I2383-E2395 PolarHBondContact N-O 3.2Å; I2383-E2395 WeakPolarHBondContact O-CA 3.47Å; I2383-E2395 PolarHBondContact O-N 3.48Å; I2383-N2396 PolarHBondContact N-O 2.95Å; I2383-N2396 PolarHBondContact O-N 2.99Å; I2383-V2399 HydrophobicContact CB-CB 4.15Å; I2383-V2399 HydrophobicContact CB-CG2 3.8Å; I2383-V2399 HydrophobicContact CD1-CB 4.06Å; I2383-V2399 HydrophobicContact CD1-CG1 4.04Å; I2383-V2399 HydrophobicContact CD1-CG2 4.26Å; I2383-V2399 HydrophobicContact CG1-CB 4.36Å; I2383-V2399 HydrophobicContact CG1-CG2 4.35Å; I2383-V2399 HydrophobicContact CG2-CG2 4.4Å; I2383-M2834 HydrophobicContact CB-CE 3.85Å; I2383-M2834 HydrophobicContact CD1-CE 3.94Å; I2383-M2834 HydrophobicContact CG1-CE 4.44Å; I2383-M2834 HydrophobicContact CG2-CE 3.91Å; I2383-M2834 HydrophobicContact CG2-SD 4.42Å
2384	T	66.9	Low	57.7	Low	37.6 Å²	37.6	69.5 Å²	69.5	23%	0.231	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	116.2	176	-32.1	0	0	0	0	108.8	W2359 K2360 R2362 Q2382 P2386 I2394 E2395	W2359-T2384 WeakPolarHBondContact CA-O 3.47Å; W2359-T2384 WeakPolarHBondContact CB-O 3.44Å; K2360-T2384 WeakPolarHBondContact CB-OG1 3.38Å; K2360-T2384 PolarHBondContact N-O 3.15Å; K2360-T2384 CarbonylContact O-C 3.59Å; K2360-T2384 PolarHBondContact O-N 3.1Å; K2360-T2384 PolarHBondContact O-OG1 3.19Å; R2362-T2384 PolarHBondContact N-O 2.8Å; R2362-T2384 PolarHBondContact O-N 3.42Å; Q2382-T2384 HydrophobicContact CG-CG2 4.48Å; T2384-P2386 VanDerWaalsContact O-CD 3.31Å; T2384-P2386 WeakPolarHBondContact O-CD 3.49Å; T2384-I2394 HydrophobicContact CG2-CG1 4.38Å; T2384-E2395 HydrophobicContact CG2-CB 4.46Å; T2384-E2395 HydrophobicContact CG2-CG 3.62Å; T2384-E2395 WeakPolarHBondContact CG2-OE1 3.25Å
2385	I	64.9	Low	58.1	Low	37.4 Å²	37.4	68.6 Å²	68.6	19%	0.192	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	122.5	175.4	-55.9	173	0	0	0	107.7	W2359 I2383 G2387 S2392 A2393 I2394 Q2795 L2798 M2834	W2359-I2385 HydrophobicContact CB-CG1 4.31Å; W2359-I2385 HydrophobicContact CH2-CG2 3.87Å; W2359-I2385 HydrophobicContact CZ3-CB 4.33Å; W2359-I2385 HydrophobicContact CZ3-CG1 4.2Å; W2359-I2385 HydrophobicContact CZ3-CG2 3.98Å; I2383-I2385 HydrophobicContact CG2-CG1 4.23Å; I2385-G2387 PolarHBondContact O-N 2.89Å; I2385-S2392 WeakPolarHBondContact O-CA 3.3Å; I2385-A2393 PolarHBondContact N-O 3.2Å; I2385-A2393 WeakPolarHBondContact O-CA 3.29Å; I2385-A2393 PolarHBondContact O-N 2.91Å; I2385-I2394 HydrophobicContact CB-CB 4.44Å; I2385-I2394 HydrophobicContact CD1-CD1 4.16Å; I2385-I2394 HydrophobicContact CD1-CG2 3.94Å; I2385-I2394 PolarHBondContact N-O 3.05Å; I2385-I2394 PolarHBondContact O-N 2.93Å; I2385-Q2795 HydrophobicContact CG2-CG 3.87Å; I2385-L2798 HydrophobicContact CD1-CD1 3.66Å; I2385-L2798 HydrophobicContact CD1-CG 3.85Å; I2385-M2834 HydrophobicContact CD1-SD 3.71Å
2386	P	59.7	Low	58.5	Low	47.2 Å²	47.2	70.6 Å²	70.6	31%	0.306	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-65.5	132.3	178.3	21.5	-25.6	0	0	0	110.4	N2357 L2358 W2359 K2360 T2384 N2388 Q2795	N2357-P2386 HydrophobicContact CB-CB 4.22Å; N2357-P2386 VanDerWaalsContact OD1-C 3.3Å; N2357-P2386 WeakPolarHBondContact OD1-CA 3.44Å; N2357-P2386 WeakPolarHBondContact OD1-CB 3.19Å; L2358-P2386 VanDerWaalsContact O-CD 3.32Å; L2358-P2386 WeakPolarHBondContact O-CD 3.41Å; L2358-P2386 WeakPolarHBondContact O-CG 3.37Å; W2359-P2386 HydrophobicContact CB-CG 3.98Å; W2359-P2386 HydrophobicContact CD2-CG 3.58Å; W2359-P2386 HydrophobicContact CE3-CG 4.32Å; W2359-P2386 HydrophobicContact CG-CG 3.66Å; W2359-P2386 HydrophobicContact CZ2-CG 3.79Å; W2359-P2386 VanDerWaalsContact NE1-CG 3.3Å; K2360-P2386 WeakPolarHBondContact O-CD 3.1Å; K2360-P2386 VanDerWaalsContact O-CG 3.25Å; K2360-P2386 WeakPolarHBondContact O-CG 3.35Å; T2384-P2386 VanDerWaalsContact O-CD 3.31Å; T2384-P2386 WeakPolarHBondContact O-CD 3.49Å; P2386-N2388 PolarHBondContact O-N 2.96Å; P2386-Q2795 PolarHBondContact O-NE2 2.98Å
2387	G	55	Low	58.8	Low	26.6 Å²	26.6	71.7 Å²	71.7	27%	0.274	38%	0.381	S	S	.	.			trans	-92.7	139.3	169.2	0	0	0	0	0	111.1	N2357 I2385 N2389 L2390 R2391	N2357-G2387 PolarHBondContact OD1-N 2.94Å; I2385-G2387 PolarHBondContact O-N 2.89Å; G2387-N2389 PolarHBondContact O-N 2.95Å; G2387-L2390 PolarHBondContact O-N 3.09Å; G2387-R2391 CarbonylContact C-O 3.53Å; G2387-R2391 WeakPolarHBondContact CA-O 3.24Å
2388	N	53.2	Low	58.7	Low	113.4 Å²	113.4	72.1 Å²	72.1	61%	0.606	38%	0.381	S	S	*	.	S	Bend	trans	-67	124.6	168	-71.9	-9.3	0	0	0	109.8	P2386 L2390 R2391	P2386-N2388 PolarHBondContact O-N 2.96Å; N2388-L2390 PolarHBondContact O-N 3.09Å; N2388-L2390 VanDerWaalsContact O-N 3.14Å; N2388-R2391 PolarHBondContact O-N 2.86Å; N2388-R2391 WeakPolarHBondContact OD1-CB 3.38Å; N2388-R2391 PolarHBondContact OD1-N 3.42Å
2389	N	48.2	Very low	58.7	Low	162.4 Å²	162.4	70.8 Å²	70.8	87%	0.868	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-26.8	24	177.4	-68.4	-16.6	0	0	0	116.3	G2387	G2387-N2389 PolarHBondContact O-N 2.95Å
2390	L	46.3	Very low	58.6	Low	151.2 Å²	151.2	72.8 Å²	72.8	79%	0.792	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-150.4	13.8	172.6	-71.5	159.8	0	0	0	113.9	G2387 N2388 S2392 A2393	G2387-L2390 PolarHBondContact O-N 3.09Å; N2388-L2390 PolarHBondContact O-N 3.09Å; N2388-L2390 VanDerWaalsContact O-N 3.14Å; L2390-S2392 PolarHBondContact O-N 3.27Å; L2390-A2393 PolarHBondContact O-N 3.34Å; L2390-A2393 VanDerWaalsContact O-N 3.09Å
2391	R	45.6	Very low	58.6	Low	201.4 Å²	201.4	73 Å²	73	76%	0.76	39%	0.386	S	S	*	.	S	Bend	trans	-100.4	89.2	171.7	-69.9	-173.7	179.5	-150.7	-0.2	114	G2387 N2388	G2387-R2391 CarbonylContact C-O 3.53Å; G2387-R2391 WeakPolarHBondContact CA-O 3.24Å; N2388-R2391 PolarHBondContact O-N 2.86Å; N2388-R2391 WeakPolarHBondContact OD1-CB 3.38Å; N2388-R2391 PolarHBondContact OD1-N 3.42Å
2392	S	50.9	Low	58.6	Low	87.2 Å²	87.2	72 Å²	72	61%	0.61	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-83.1	122.2	169.6	36.1	0	0	0	0	111.5	I2385 L2390 I2394	I2385-S2392 WeakPolarHBondContact O-CA 3.3Å; L2390-S2392 PolarHBondContact O-N 3.27Å; S2392-I2394 PolarHBondContact O-N 3.11Å
2393	A	54.9	Low	58.3	Low	53.6 Å²	53.6	74 Å²	74	44%	0.443	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-71	96	176.9	0	0	0	0	0	111.9	I2385 L2390 E2395	I2385-A2393 PolarHBondContact N-O 3.2Å; I2385-A2393 WeakPolarHBondContact O-CA 3.29Å; I2385-A2393 PolarHBondContact O-N 2.91Å; L2390-A2393 PolarHBondContact O-N 3.34Å; L2390-A2393 VanDerWaalsContact O-N 3.09Å; A2393-E2395 HydrophobicContact CB-CG 4.28Å; A2393-E2395 PolarHBondContact O-N 3.5Å
2394	I	57.3	Low	57.8	Low	51.2 Å²	51.2	76 Å²	76	26%	0.263	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	82.1	178.8	-49.4	174.7	0	0	0	108.5	T2384 I2385 S2392 N2396 T2397 L2798 M2834	T2384-I2394 HydrophobicContact CG2-CG1 4.38Å; I2385-I2394 HydrophobicContact CB-CB 4.44Å; I2385-I2394 HydrophobicContact CD1-CD1 4.16Å; I2385-I2394 HydrophobicContact CD1-CG2 3.94Å; I2385-I2394 PolarHBondContact N-O 3.05Å; I2385-I2394 PolarHBondContact O-N 2.93Å; S2392-I2394 PolarHBondContact O-N 3.11Å; I2394-N2396 VanDerWaalsContact C-N 3.33Å; I2394-N2396 WeakPolarHBondContact CG2-OD1 3.42Å; I2394-N2396 PolarHBondContact O-N 2.69Å; I2394-T2397 HydrophobicContact CG2-CG2 3.96Å; I2394-T2397 WeakPolarHBondContact CG2-OG1 3.38Å; I2394-L2798 HydrophobicContact CD1-CD1 4.3Å; I2394-M2834 HydrophobicContact CG2-CG 3.82Å
2395	E	58.8	Low	57.1	Low	110.2 Å²	110.2	77.8 Å²	77.8	52%	0.515	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	116.6	175.9	-87.4	-170.1	168.1	0	0	110.9	Q2382 I2383 T2384 A2393 T2397 N2507	Q2382-E2395 HydrophobicContact CG-CG 4.42Å; Q2382-E2395 PolarHBondContact NE2-OE1 3.16Å; Q2382-E2395 PolarHBondContact NE2-OE2 2.63Å; I2383-E2395 PolarHBondContact N-O 3.2Å; I2383-E2395 WeakPolarHBondContact O-CA 3.47Å; I2383-E2395 PolarHBondContact O-N 3.48Å; T2384-E2395 HydrophobicContact CG2-CB 4.46Å; T2384-E2395 HydrophobicContact CG2-CG 3.62Å; T2384-E2395 WeakPolarHBondContact CG2-OE1 3.25Å; A2393-E2395 HydrophobicContact CB-CG 4.28Å; A2393-E2395 PolarHBondContact O-N 3.5Å; E2395-T2397 HydrophobicContact CG-CG2 4.4Å; E2395-T2397 PolarHBondContact O-N 2.89Å; E2395-N2507 PolarHBondContact O-ND2 2.83Å
2396	N	60.6	Low	56	Low	70.2 Å²	70.2	81.2 Å²	81.2	38%	0.375	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	89.7	174.9	-109.9	-40	0	0	0	111.6	R2381 Q2382 I2383 I2394 N2398 N2507 N2833 M2834	R2381-N2396 WeakPolarHBondContact O-CA 3.4Å; Q2382-N2396 CarbonylContact C-O 3.56Å; Q2382-N2396 WeakPolarHBondContact CA-O 3.27Å; Q2382-N2396 WeakPolarHBondContact CB-OD1 3.1Å; Q2382-N2396 VanDerWaalsContact CG-OD1 3.3Å; Q2382-N2396 WeakPolarHBondContact CG-OD1 3.09Å; I2383-N2396 PolarHBondContact N-O 2.95Å; I2383-N2396 PolarHBondContact O-N 2.99Å; I2394-N2396 VanDerWaalsContact C-N 3.33Å; I2394-N2396 WeakPolarHBondContact CG2-OD1 3.42Å; I2394-N2396 PolarHBondContact O-N 2.69Å; N2396-N2398 PolarHBondContact O-N 3.1Å; N2396-N2398 PolarHBondContact OD1-ND2 2.94Å; N2396-N2398 PolarHBondContact OD1-OD1 2.75Å; N2396-N2398 VanDerWaalsContact OD1-OD1 3.06Å; N2396-N2507 WeakPolarHBondContact CA-OD1 3.45Å; N2396-N2833 WeakPolarHBondContact ND2-CA 3.12Å; N2396-N2833 PolarHBondContact ND2-O 2.89Å; N2396-M2834 HydrophobicContact CB-CE 3.29Å; N2396-M2834 VanDerWaalsContact CB-CE 3.41Å
2397	T	61.3	Low	55	Low	45.4 Å²	45.4	86.8 Å²	86.8	28%	0.279	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	119.5	175.5	54.2	0	0	0	0	110.3	R2381 Q2382 I2394 E2395 V2399 V2506 N2507	R2381-T2397 PolarHBondContact N-O 3.47Å; R2381-T2397 CarbonylContact O-C 3.52Å; R2381-T2397 WeakPolarHBondContact O-CA 3.43Å; R2381-T2397 PolarHBondContact O-N 3.18Å; Q2382-T2397 HydrophobicContact CB-CG2 3.99Å; Q2382-T2397 HydrophobicContact CG-CG2 3.68Å; I2394-T2397 HydrophobicContact CG2-CG2 3.96Å; I2394-T2397 WeakPolarHBondContact CG2-OG1 3.38Å; E2395-T2397 HydrophobicContact CG-CG2 4.4Å; E2395-T2397 PolarHBondContact O-N 2.89Å; T2397-V2399 PolarHBondContact O-N 3.05Å; T2397-V2506 CarbonylContact O-C 3.59Å; T2397-V2506 VanDerWaalsContact O-CA 3.29Å; T2397-V2506 WeakPolarHBondContact O-CA 3.36Å; T2397-N2507 PolarHBondContact N-OD1 3.14Å; T2397-N2507 PolarHBondContact O-N 3.06Å; T2397-N2507 WeakPolarHBondContact OG1-CA 3.5Å; T2397-N2507 PolarHBondContact OG1-OD1 3.1Å; T2397-N2507 VanDerWaalsContact OG1-OD1 3.1Å
2398	N	60.1	Low	54.2	Low	49.6 Å²	49.6	89.2 Å²	89.2	27%	0.265	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	114.8	168.1	-65.1	-27.9	0	0	0	107.9	I2380 R2381 Q2382 N2396 W2400 L2504 T2505 V2506	I2380-N2398 CarbonylContact C-O 3.51Å; I2380-N2398 WeakPolarHBondContact CA-O 3.1Å; R2381-N2398 HydrophobicContact CB-CB 4.45Å; R2381-N2398 PolarHBondContact N-O 2.85Å; R2381-N2398 PolarHBondContact NH1-ND2 2.74Å; R2381-N2398 PolarHBondContact O-N 2.87Å; Q2382-N2398 VanDerWaalsContact CG-OD1 3.24Å; Q2382-N2398 WeakPolarHBondContact CG-OD1 3.45Å; Q2382-N2398 PolarHBondContact NE2-OD1 3.29Å; N2396-N2398 PolarHBondContact O-N 3.1Å; N2396-N2398 PolarHBondContact OD1-ND2 2.94Å; N2396-N2398 PolarHBondContact OD1-OD1 2.75Å; N2396-N2398 VanDerWaalsContact OD1-OD1 3.06Å; N2398-W2400 PolarHBondContact O-N 3.29Å; N2398-L2504 HydrophobicContact CB-CD1 4.48Å; N2398-T2505 CarbonylContact C-O 3.44Å; N2398-T2505 WeakPolarHBondContact CA-O 3.39Å; N2398-V2506 WeakPolarHBondContact OD1-CG1 3.4Å; N2398-V2506 WeakPolarHBondContact OD1-CG2 3.4Å
2399	V	62.9	Low	53.2	Low	31.2 Å²	31.2	87.7 Å²	87.7	19%	0.189	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	-7.5	179.4	-174.9	0	0	0	0	109.7	Q2378 L2379 I2380 R2381 I2383 T2397 T2401 F2440 T2505	Q2378-V2399 HydrophobicContact CB-CG1 4.21Å; Q2378-V2399 HydrophobicContact CG-CG1 4.14Å; L2379-V2399 HydrophobicContact CD2-CB 4.16Å; L2379-V2399 HydrophobicContact CD2-CG1 4.22Å; L2379-V2399 HydrophobicContact CG-CB 4.22Å; L2379-V2399 HydrophobicContact CG-CG2 4.48Å; L2379-V2399 CarbonylContact O-C 3.46Å; L2379-V2399 VanDerWaalsContact O-CA 3.3Å; L2379-V2399 WeakPolarHBondContact O-CA 3.38Å; L2379-V2399 PolarHBondContact O-N 2.99Å; I2380-V2399 HydrophobicContact CB-CG2 4.43Å; I2380-V2399 HydrophobicContact CG1-CG1 3.96Å; I2380-V2399 HydrophobicContact CG1-CG2 4.04Å; I2380-V2399 HydrophobicContact CG2-CG2 4.16Å; R2381-V2399 HydrophobicContact CB-CG2 3.74Å; R2381-V2399 VanDerWaalsContact CD-CG2 3.4Å; R2381-V2399 HydrophobicContact CG-CG2 3.43Å; R2381-V2399 VanDerWaalsContact CG-CG2 3.43Å; R2381-V2399 PolarHBondContact O-N 3.12Å; I2383-V2399 HydrophobicContact CB-CB 4.15Å; I2383-V2399 HydrophobicContact CB-CG2 3.8Å; I2383-V2399 HydrophobicContact CD1-CB 4.06Å; I2383-V2399 HydrophobicContact CD1-CG1 4.04Å; I2383-V2399 HydrophobicContact CD1-CG2 4.26Å; I2383-V2399 HydrophobicContact CG1-CB 4.36Å; I2383-V2399 HydrophobicContact CG1-CG2 4.35Å; I2383-V2399 HydrophobicContact CG2-CG2 4.4Å; T2397-V2399 PolarHBondContact O-N 3.05Å; V2399-T2401 HydrophobicContact CG1-CG2 4.05Å; V2399-F2440 HydrophobicContact CG1-CE1 4.26Å; V2399-F2440 HydrophobicContact CG1-CZ 4.47Å; V2399-T2505 WeakPolarHBondContact CB-OG1 3.44Å; V2399-T2505 PolarHBondContact N-O 3.1Å; V2399-T2505 PolarHBondContact O-N 3.07Å; V2399-T2505 PolarHBondContact O-OG1 3.26Å; V2399-T2505 VanDerWaalsContact O-OG1 3.13Å
2400	W	59.9	Low	52.4	Low	73.4 Å²	73.4	85 Å²	85	28%	0.278	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	133.2	172	-107.3	88	0	0	0	110.9	Q2378 L2379 R2381 N2398 Y2402 K2502 T2503 L2504 L2512 V2514	Q2378-W2400 CarbonylContact C-O 3.56Å; Q2378-W2400 WeakPolarHBondContact CA-O 3.24Å; L2379-W2400 HydrophobicContact CB-CB 4.19Å; L2379-W2400 HydrophobicContact CD2-CZ3 3.94Å; L2379-W2400 PolarHBondContact N-O 3Å; L2379-W2400 PolarHBondContact O-N 2.97Å; R2381-W2400 CarbonylContact C-O 3.58Å; R2381-W2400 VanDerWaalsContact C-O 3.22Å; R2381-W2400 WeakPolarHBondContact CA-O 3.41Å; R2381-W2400 HydrophobicContact CB-CB 4.5Å; R2381-W2400 HydrophobicContact CB-CE3 3.79Å; R2381-W2400 PolarHBondContact N-O 3.05Å; R2381-W2400 VanDerWaalsContact N-O 3.13Å; N2398-W2400 PolarHBondContact O-N 3.29Å; W2400-Y2402 HydrophobicContact CB-CD2 4.41Å; W2400-Y2402 HydrophobicContact CB-CE2 3.59Å; W2400-Y2402 VanDerWaalsContact CH2-CB 3.4Å; W2400-Y2402 HydrophobicContact CH2-CD1 4.44Å; W2400-Y2402 AromaticContact CH2-CD2 3.36Å; W2400-Y2402 HydrophobicContact CH2-CD2 3.36Å; W2400-Y2402 HydrophobicContact CH2-CE2 4.31Å; W2400-Y2402 AromaticContact CH2-CG 3.52Å; W2400-Y2402 HydrophobicContact CH2-CG 3.52Å; W2400-Y2402 AromaticContact CZ2-CD2 3.4Å; W2400-Y2402 HydrophobicContact CZ2-CD2 3.4Å; W2400-Y2402 VanDerWaalsContact CZ2-CD2 3.48Å; W2400-Y2402 HydrophobicContact CZ2-CE2 4.34Å; W2400-Y2402 AromaticContact CZ2-CG 3.78Å; W2400-Y2402 HydrophobicContact CZ2-CG 3.95Å; W2400-Y2402 VanDerWaalsContact CZ3-CB 3.46Å; W2400-Y2402 HydrophobicContact CZ3-CD2 4.25Å; W2400-Y2402 HydrophobicContact CZ3-CG 4.15Å; W2400-Y2402 WeakPolarHBondContact O-CD2 3.34Å; W2400-Y2402 WeakPolarHBondContact O-CE2 3.42Å; W2400-K2502 HydrophobicContact CD2-CD 4.47Å; W2400-K2502 HydrophobicContact CE3-CB 3.93Å; W2400-K2502 HydrophobicContact CE3-CD 3.72Å; W2400-K2502 HydrophobicContact CE3-CG 3.86Å; W2400-K2502 HydrophobicContact CH2-CD 4.3Å; W2400-K2502 HydrophobicContact CZ3-CB 4.22Å; W2400-K2502 HydrophobicContact CZ3-CD 3.63Å; W2400-K2502 HydrophobicContact CZ3-CG 3.69Å; W2400-T2503 CarbonylContact C-O 3.48Å; W2400-T2503 VanDerWaalsContact CA-O 3.31Å; W2400-T2503 WeakPolarHBondContact CA-O 3.42Å; W2400-L2504 HydrophobicContact CD2-CB 3.97Å; W2400-L2504 HydrophobicContact CD2-CD1 4.12Å; W2400-L2504 HydrophobicContact CE3-CB 3.81Å; W2400-L2504 HydrophobicContact CG-CD1 4.32Å; W2400-L2504 HydrophobicContact CH2-CB 3.72Å; W2400-L2504 HydrophobicContact CH2-CD2 4.47Å; W2400-L2504 HydrophobicContact CZ2-CB 3.85Å; W2400-L2504 HydrophobicContact CZ2-CD1 4.26Å; W2400-L2504 HydrophobicContact CZ2-CD2 4.07Å; W2400-L2504 HydrophobicContact CZ2-CG 4.27Å; W2400-L2504 HydrophobicContact CZ3-CB 3.69Å; W2400-L2512 HydrophobicContact CH2-CD2 3.89Å; W2400-L2512 HydrophobicContact CH2-CG 4.45Å; W2400-V2514 HydrophobicContact CH2-CG2 4.16Å; W2400-V2514 HydrophobicContact CZ3-CG2 4.14Å
2401	T	66.7	Low	51.6	Low	34.4 Å²	34.4	87.5 Å²	87.5	21%	0.211	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	128.2	172.9	23.4	0	0	0	0	109.2	P2376 V2377 Q2378 I2380 V2399 H2403 K2502 T2503	P2376-T2401 HydrophobicContact CB-CG2 4.02Å; P2376-T2401 HydrophobicContact CG-CG2 4.31Å; V2377-T2401 CarbonylContact O-C 3.52Å; V2377-T2401 VanDerWaalsContact O-CA 3.24Å; V2377-T2401 WeakPolarHBondContact O-CA 3.41Å; Q2378-T2401 HydrophobicContact CG-CG2 3.93Å; I2380-T2401 HydrophobicContact CB-CG2 4.5Å; I2380-T2401 HydrophobicContact CG1-CG2 4.27Å; I2380-T2401 HydrophobicContact CG2-CG2 3.96Å; V2399-T2401 HydrophobicContact CG1-CG2 4.05Å; T2401-H2403 VanDerWaalsContact CG2-NE2 3.32Å; T2401-H2403 WeakPolarHBondContact CG2-NE2 3.48Å; T2401-H2403 PolarHBondContact O-N 2.67Å; T2401-H2403 PolarHBondContact OG1-NE2 3.39Å; T2401-K2502 CarbonylContact O-C 3.54Å; T2401-K2502 VanDerWaalsContact O-CA 3.22Å; T2401-K2502 WeakPolarHBondContact O-CA 3.3Å; T2401-K2502 WeakPolarHBondContact O-CB 3.37Å; T2401-T2503 PolarHBondContact N-O 3.16Å; T2401-T2503 PolarHBondContact O-N 3.08Å; T2401-T2503 WeakPolarHBondContact OG1-CB 3.37Å
2402	Y	64.8	Low	50.9	Low	56.2 Å²	56.2	84 Å²	84	22%	0.22	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	120	-179	-104.9	-109	0	0	0	109.7	P2376 V2377 L2379 W2400 L2404 Y2500 Q2501 K2502	P2376-Y2402 WeakPolarHBondContact CA-O 3.32Å; P2376-Y2402 HydrophobicContact CB-CD1 3.76Å; P2376-Y2402 HydrophobicContact CB-CD2 4.38Å; P2376-Y2402 HydrophobicContact CB-CE1 4.28Å; P2376-Y2402 HydrophobicContact CB-CG 4.1Å; P2376-Y2402 WeakPolarHBondContact CB-O 3.18Å; P2376-Y2402 HydrophobicContact CG-CD1 3.95Å; P2376-Y2402 VanDerWaalsContact CG-CD1 3.48Å; P2376-Y2402 HydrophobicContact CG-CE1 4.15Å; P2376-Y2402 HydrophobicContact CG-CG 4.17Å; P2376-Y2402 WeakPolarHBondContact O-CB 3.33Å; V2377-Y2402 PolarHBondContact O-N 3.09Å; V2377-Y2402 VanDerWaalsContact O-N 3.12Å; L2379-Y2402 CarbonylContact C-O 3.54Å; L2379-Y2402 VanDerWaalsContact C-O 3.22Å; L2379-Y2402 VanDerWaalsContact CA-O 3.24Å; L2379-Y2402 WeakPolarHBondContact CA-O 3.17Å; L2379-Y2402 HydrophobicContact CB-CD1 4.16Å; L2379-Y2402 HydrophobicContact CB-CE2 4.21Å; L2379-Y2402 WeakPolarHBondContact CB-O 3.48Å; L2379-Y2402 HydrophobicContact CD1-CE2 3.83Å; L2379-Y2402 WeakPolarHBondContact CD1-OH 3.47Å; L2379-Y2402 HydrophobicContact CD2-CD1 4.49Å; L2379-Y2402 HydrophobicContact CG-CE2 4.04Å; L2379-Y2402 PolarHBondContact N-O 3.32Å; L2379-Y2402 CarbonylContact O-C 3.09Å; L2379-Y2402 VanDerWaalsContact O-C 3.32Å; L2379-Y2402 WeakPolarHBondContact O-CA 3.3Å; L2379-Y2402 WeakPolarHBondContact O-CB 3.42Å; L2379-Y2402 PolarHBondContact O-N 3.13Å; W2400-Y2402 HydrophobicContact CB-CD2 4.41Å; W2400-Y2402 HydrophobicContact CB-CE2 3.59Å; W2400-Y2402 VanDerWaalsContact CH2-CB 3.4Å; W2400-Y2402 HydrophobicContact CH2-CD1 4.44Å; W2400-Y2402 AromaticContact CH2-CD2 3.36Å; W2400-Y2402 HydrophobicContact CH2-CD2 3.36Å; W2400-Y2402 HydrophobicContact CH2-CE2 4.31Å; W2400-Y2402 AromaticContact CH2-CG 3.52Å; W2400-Y2402 HydrophobicContact CH2-CG 3.52Å; W2400-Y2402 AromaticContact CZ2-CD2 3.4Å; W2400-Y2402 HydrophobicContact CZ2-CD2 3.4Å; W2400-Y2402 VanDerWaalsContact CZ2-CD2 3.48Å; W2400-Y2402 HydrophobicContact CZ2-CE2 4.34Å; W2400-Y2402 AromaticContact CZ2-CG 3.78Å; W2400-Y2402 HydrophobicContact CZ2-CG 3.95Å; W2400-Y2402 VanDerWaalsContact CZ3-CB 3.46Å; W2400-Y2402 HydrophobicContact CZ3-CD2 4.25Å; W2400-Y2402 HydrophobicContact CZ3-CG 4.15Å; W2400-Y2402 WeakPolarHBondContact O-CD2 3.34Å; W2400-Y2402 WeakPolarHBondContact O-CE2 3.42Å; Y2402-L2404 HydrophobicContact CD1-CD2 4.38Å; Y2402-L2404 HydrophobicContact CD1-CG 4.08Å; Y2402-L2404 HydrophobicContact CE1-CD1 4.36Å; Y2402-L2404 HydrophobicContact CE1-CD2 3.74Å; Y2402-L2404 HydrophobicContact CE1-CG 3.68Å; Y2402-L2404 PolarHBondContact O-N 2.78Å; Y2402-Y2500 AromaticContact CD1-CE2 3.6Å; Y2402-Y2500 HydrophobicContact CD1-CE2 3.6Å; Y2402-Y2500 AromaticContact CD1-CZ 3.72Å; Y2402-Y2500 WeakPolarHBondContact CD1-OH 3.29Å; Y2402-Y2500 HydrophobicContact CE1-CE2 4.31Å; Y2402-Y2500 AromaticContact CE1-CZ 3.92Å; Y2402-Y2500 WeakPolarHBondContact CE1-OH 3.38Å; Y2402-Y2500 HydrophobicContact CG-CE2 4.28Å; Y2402-Q2501 CarbonylContact C-O 3.53Å; Y2402-Q2501 WeakPolarHBondContact CA-O 3.49Å; Y2402-K2502 HydrophobicContact CD1-CB 4.01Å; Y2402-K2502 HydrophobicContact CD1-CD 4.46Å; Y2402-K2502 HydrophobicContact CE1-CB 4.11Å; Y2402-K2502 HydrophobicContact CE1-CD 4.17Å; Y2402-K2502 HydrophobicContact CE1-CG 4.34Å; Y2402-K2502 HydrophobicContact CG-CB 4.32Å
2403	H	61.2	Low	49.8	Very low	89 Å²	89	86.7 Å²	86.7	41%	0.412	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	123.1	175.8	-64.3	-90.6	0	0	0	109.1	Q2378 T2401 N2405 D2406 W2498 Q2501	Q2378-H2403 HydrophobicContact CG-CB 4.18Å; Q2378-H2403 WeakPolarHBondContact CG-ND1 3.18Å; Q2378-H2403 PolarHBondContact NE2-CE1 2.85Å; Q2378-H2403 PolarHBondContact NE2-ND1 3.35Å; Q2378-H2403 PolarHBondContact NE2-NE2 3.05Å; Q2378-H2403 VanDerWaalsContact NE2-NE2 3.15Å; T2401-H2403 VanDerWaalsContact CG2-NE2 3.32Å; T2401-H2403 WeakPolarHBondContact CG2-NE2 3.48Å; T2401-H2403 PolarHBondContact O-N 2.67Å; T2401-H2403 PolarHBondContact OG1-NE2 3.39Å; H2403-N2405 PolarHBondContact O-N 2.98Å; H2403-N2405 VanDerWaalsContact O-N 3.13Å; H2403-D2406 HydrophobicContact CB-CB 3.53Å; H2403-D2406 IonicContact CG-OD2 3.15Å; H2403-D2406 IonicContact ND1-OD2 3.83Å; H2403-W2498 HydrophobicContact CB-CH2 4.42Å; H2403-W2498 HydrophobicContact CB-CZ3 4.28Å; H2403-Q2501 HydrophobicContact CB-CB 4.46Å; H2403-Q2501 PolarHBondContact N-O 3.15Å; H2403-Q2501 PolarHBondContact O-N 3.23Å
2404	L	54.6	Low	48.5	Very low	67.2 Å²	67.2	90.9 Å²	90.9	35%	0.352	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	126.7	168.6	-98.2	133	0	0	0	107.7	Q2174 A2375 P2376 V2377 L2379 Y2402 D2406 W2498 H2499 Y2500 W2518	Q2174-L2404 HydrophobicContact CG-CD2 4.4Å; A2375-L2404 HydrophobicContact CB-CD1 3.99Å; P2376-L2404 HydrophobicContact CB-CD1 3.94Å; P2376-L2404 HydrophobicContact CG-CD1 4.21Å; P2376-L2404 WeakPolarHBondContact O-CB 3.4Å; V2377-L2404 CarbonylContact C-O 3.58Å; V2377-L2404 WeakPolarHBondContact CA-O 3.21Å; V2377-L2404 CarbonylContact O-C 3.56Å; V2377-L2404 PolarHBondContact O-N 3.18Å; L2379-L2404 HydrophobicContact CB-CD1 3.85Å; L2379-L2404 HydrophobicContact CB-CG 4.39Å; L2379-L2404 HydrophobicContact CD1-CD1 4.4Å; Y2402-L2404 HydrophobicContact CD1-CD2 4.38Å; Y2402-L2404 HydrophobicContact CD1-CG 4.08Å; Y2402-L2404 HydrophobicContact CE1-CD1 4.36Å; Y2402-L2404 HydrophobicContact CE1-CD2 3.74Å; Y2402-L2404 HydrophobicContact CE1-CG 3.68Å; Y2402-L2404 PolarHBondContact O-N 2.78Å; L2404-D2406 VanDerWaalsContact C-N 3.34Å; L2404-D2406 PolarHBondContact O-N 3.36Å; L2404-W2498 HydrophobicContact CD1-CE3 4.09Å; L2404-W2498 HydrophobicContact CD1-CZ3 4.26Å; L2404-W2498 HydrophobicContact CD2-CZ3 4.23Å; L2404-H2499 WeakPolarHBondContact CA-O 3.42Å; L2404-Y2500 HydrophobicContact CD1-CD1 3.86Å; L2404-Y2500 HydrophobicContact CD1-CD2 4.3Å; L2404-Y2500 HydrophobicContact CD1-CE1 3.43Å; L2404-Y2500 VanDerWaalsContact CD1-CE1 3.43Å; L2404-Y2500 HydrophobicContact CD1-CE2 3.88Å; L2404-Y2500 HydrophobicContact CD1-CG 4.29Å; L2404-Y2500 VanDerWaalsContact CD1-CZ 3.44Å; L2404-W2518 HydrophobicContact CD2-CH2 4.32Å; L2404-W2518 HydrophobicContact CD2-CZ2 4.3Å
2405	N	51.4	Low	47.1	Very low	76.4 Å²	76.4	93.6 Å²	93.6	41%	0.409	48%	0.481	S	S	.	.			trans	-33.2	82.6	179.1	-94.9	-10.2	0	0	0	111.2	P2376 H2403 Q2407 S2408 W2498 H2499	P2376-N2405 PolarHBondContact O-ND2 3.31Å; P2376-N2405 VanDerWaalsContact O-ND2 3.16Å; H2403-N2405 PolarHBondContact O-N 2.98Å; H2403-N2405 VanDerWaalsContact O-N 3.13Å; N2405-Q2407 VanDerWaalsContact C-N 3.32Å; N2405-Q2407 PolarHBondContact O-N 2.98Å; N2405-Q2407 VanDerWaalsContact O-N 3.08Å; N2405-S2408 PolarHBondContact ND2-OG 3.44Å; N2405-S2408 PolarHBondContact O-N 2.99Å; N2405-S2408 PolarHBondContact O-OG 2.97Å; N2405-W2498 HydrophobicContact CB-CD2 4.35Å; N2405-W2498 HydrophobicContact CB-CE3 3.74Å; N2405-W2498 HydrophobicContact CB-CH2 4.07Å; N2405-W2498 HydrophobicContact CB-CZ2 4.46Å; N2405-W2498 HydrophobicContact CB-CZ3 3.6Å; N2405-W2498 WeakPolarHBondContact CB-O 3.3Å; N2405-W2498 VanDerWaalsContact ND2-CE3 3.28Å; N2405-W2498 WeakPolarHBondContact ND2-CH2 3.35Å; N2405-W2498 VanDerWaalsContact ND2-CZ2 3.3Å; N2405-W2498 WeakPolarHBondContact ND2-CZ2 3.15Å; N2405-W2498 WeakPolarHBondContact ND2-CZ3 3.39Å; N2405-W2498 PolarHBondContact ND2-O 3.03Å; N2405-W2498 VanDerWaalsContact ND2-O 3.14Å; N2405-W2498 WeakPolarHBondContact OD1-CH2 3.1Å; N2405-W2498 WeakPolarHBondContact OD1-CZ2 3.34Å; N2405-W2498 WeakPolarHBondContact OD1-CZ3 3.09Å; N2405-H2499 PolarHBondContact N-O 3.07Å; N2405-H2499 PolarHBondContact OD1-N 2.67Å
2406	D	42.6	Very low	45.6	Very low	108.6 Å²	108.6	96.5 Å²	96.5	58%	0.581	50%	0.495	S	S	*	.			trans	-64.8	86.9	175	-144.5	-9.8	0	0	0	110.3	H2403 L2404 S2408 N2409	H2403-D2406 HydrophobicContact CB-CB 3.53Å; H2403-D2406 IonicContact CG-OD2 3.15Å; H2403-D2406 IonicContact ND1-OD2 3.83Å; L2404-D2406 VanDerWaalsContact C-N 3.34Å; L2404-D2406 PolarHBondContact O-N 3.36Å; D2406-S2408 VanDerWaalsContact C-N 3.35Å; D2406-S2408 PolarHBondContact O-N 2.92Å; D2406-S2408 VanDerWaalsContact O-N 3.12Å; D2406-S2408 WeakPolarHBondContact OD1-CB 3.48Å; D2406-S2408 PolarHBondContact OD1-N 2.81Å; D2406-S2408 VanDerWaalsContact OD1-N 3.12Å; D2406-S2408 PolarHBondContact OD1-OG 3.24Å; D2406-S2408 PolarHBondContact OD2-OG 2.93Å; D2406-N2409 HydrophobicContact CB-CB 4.33Å; D2406-N2409 WeakPolarHBondContact O-CA 3.42Å; D2406-N2409 VanDerWaalsContact O-CB 3.23Å; D2406-N2409 WeakPolarHBondContact O-CB 3.23Å; D2406-N2409 PolarHBondContact O-N 2.93Å
2407	Q	39.3	Very low	44	Very low	164.8 Å²	164.8	99.2 Å²	99.2	77%	0.77	51%	0.514	S	S	*	.			trans	-76	25.4	178.1	-70.7	-168	-13.2	0	0	112.4	N2405 N2409	N2405-Q2407 VanDerWaalsContact C-N 3.32Å; N2405-Q2407 PolarHBondContact O-N 2.98Å; N2405-Q2407 VanDerWaalsContact O-N 3.08Å; Q2407-N2409 VanDerWaalsContact C-N 3.33Å; Q2407-N2409 PolarHBondContact O-N 3.21Å
2408	S	36.6	Very low	42.4	Very low	77 Å²	77	102.3 Å²	102.3	54%	0.538	54%	0.537	S	S	.	.			trans	-82.1	25.6	168.8	68.6	0	0	0	0	114.6	N2405 D2406 P2410 W2498 H2499	N2405-S2408 PolarHBondContact ND2-OG 3.44Å; N2405-S2408 PolarHBondContact O-N 2.99Å; N2405-S2408 PolarHBondContact O-OG 2.97Å; D2406-S2408 VanDerWaalsContact C-N 3.35Å; D2406-S2408 PolarHBondContact O-N 2.92Å; D2406-S2408 VanDerWaalsContact O-N 3.12Å; D2406-S2408 WeakPolarHBondContact OD1-CB 3.48Å; D2406-S2408 PolarHBondContact OD1-N 2.81Å; D2406-S2408 VanDerWaalsContact OD1-N 3.12Å; D2406-S2408 PolarHBondContact OD1-OG 3.24Å; D2406-S2408 PolarHBondContact OD2-OG 2.93Å; S2408-P2410 VanDerWaalsContact O-CD 3.24Å; S2408-P2410 WeakPolarHBondContact O-CD 3.48Å; S2408-W2498 PolarHBondContact OG-O 2.84Å; S2408-H2499 PolarHBondContact O-CD2 2.84Å; S2408-H2499 PolarHBondContact O-NE2 2.83Å; S2408-H2499 VanDerWaalsContact O-NE2 3.12Å
2409	N	33	Very low	40.8	Very low	81.6 Å²	81.6	107 Å²	107	44%	0.436	56%	0.561	S	S	.	*			trans	-112.1	91.5	166.8	-125.8	-25.2	0	0	0	110.2	D2406 Q2407 R2411 I2412 E2494 W2518	D2406-N2409 HydrophobicContact CB-CB 4.33Å; D2406-N2409 WeakPolarHBondContact O-CA 3.42Å; D2406-N2409 VanDerWaalsContact O-CB 3.23Å; D2406-N2409 WeakPolarHBondContact O-CB 3.23Å; D2406-N2409 PolarHBondContact O-N 2.93Å; Q2407-N2409 VanDerWaalsContact C-N 3.33Å; Q2407-N2409 PolarHBondContact O-N 3.21Å; N2409-R2411 PolarHBondContact O-N 3.03Å; N2409-R2411 VanDerWaalsContact O-N 3.09Å; N2409-I2412 HydrophobicContact CB-CD1 4.36Å; N2409-I2412 WeakPolarHBondContact ND2-CD1 3.46Å; N2409-I2412 PolarHBondContact O-N 3.05Å; N2409-E2494 PolarHBondContact ND2-OE2 2.97Å; N2409-W2518 WeakPolarHBondContact OD1-CZ3 3.3Å
2410	P	32	Very low	39.1	Very low	105 Å²	105	113 Å²	113	68%	0.682	59%	0.592	S	S	*	*			trans	-74.3	41.4	-178.2	33	-34.5	0	0	0	111.2	Q2075 S2408 I2412	Q2075-P2410 PolarHBondContact NE2-O 2.95Å; Q2075-P2410 VanDerWaalsContact NE2-O 3.11Å; S2408-P2410 VanDerWaalsContact O-CD 3.24Å; S2408-P2410 WeakPolarHBondContact O-CD 3.48Å; P2410-I2412 PolarHBondContact O-N 3.21Å
2411	R	29.5	Very low	37.6	Very low	204 Å²	204	113 Å²	113	77%	0.77	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	58.6	174.5	-75.5	-172.4	177.1	-176.6	-0.6	111.5	N2409 L2413	N2409-R2411 PolarHBondContact O-N 3.03Å; N2409-R2411 VanDerWaalsContact O-N 3.09Å; R2411-L2413 PolarHBondContact O-N 2.76Å
2412	I	30.3	Very low	35.6	Very low	128.4 Å²	128.4	123.4 Å²	123.4	66%	0.658	65%	0.651	S	S	*	*	S	Bend	trans	-133.4	70.6	167.3	-57.2	163.5	0	0	0	108.3	L2373 N2409 P2410 D2414	L2373-I2412 HydrophobicContact CD2-CD1 4.41Å; N2409-I2412 HydrophobicContact CB-CD1 4.36Å; N2409-I2412 WeakPolarHBondContact ND2-CD1 3.46Å; N2409-I2412 PolarHBondContact O-N 3.05Å; P2410-I2412 PolarHBondContact O-N 3.21Å; I2412-D2414 PolarHBondContact O-N 3.39Å
2413	L	27.6	Very low	33.9	Very low	143.2 Å²	143.2	124.3 Å²	124.3	75%	0.75	68%	0.677	S	S	*	*			trans	-123.2	58.9	163	-133.3	93.5	0	0	0	112.8	R2411 T2415	R2411-L2413 PolarHBondContact O-N 2.76Å; L2413-T2415 HydrophobicContact CD2-CG2 3.9Å; L2413-T2415 HydrophobicContact CG-CG2 4.23Å; L2413-T2415 PolarHBondContact O-N 3.26Å
2414	D	27.2	Very low	32.3	Very low	142.6 Å²	142.6	131.3 Å²	131.3	76%	0.763	70%	0.701	S	S	*	*			trans	-115.2	71.9	161.8	-87	-30.5	0	0	0	109.4	I2412 H2416 K2433	I2412-D2414 PolarHBondContact O-N 3.39Å; D2414-H2416 PolarHBondContact O-N 2.82Å; D2414-K2433 IonicContact OD1-NZ 2.7Å; D2414-K2433 PolarHBondContact OD1-NZ 3.36Å
2415	T	28.4	Very low	31	Very low	107.2 Å²	107.2	133.3 Å²	133.3	66%	0.658	72%	0.721	S	S	*	*			trans	-126.5	77.2	145.6	49.5	0	0	0	0	110.9	L2413	L2413-T2415 HydrophobicContact CD2-CG2 3.9Å; L2413-T2415 HydrophobicContact CG-CG2 4.23Å; L2413-T2415 PolarHBondContact O-N 3.26Å
2416	H	27.3	Very low	29.8	Very low	171.4 Å²	171.4	136.6 Å²	136.6	79%	0.794	74%	0.738	S	S	*	*			trans	-52.4	118.7	158.4	-78.1	-79.8	0	0	0	113.1	D2414	D2414-H2416 PolarHBondContact O-N 2.82Å
2417	T	26.7	Very low	29.2	Very low	126.6 Å²	126.6	140.9 Å²	140.9	78%	0.777	75%	0.752	S	S	*	*			trans	-57.1	109.9	143.5	48.3	0	0	0	0	113.9	I2419	T2417-I2419 PolarHBondContact O-N 2.76Å
2418	S	27.6	Very low	28.5	Very low	110.2 Å²	110.2	136.9 Å²	136.9	77%	0.771	76%	0.755	S	S	*	*			trans	-76	119.9	146	58.4	0	0	0	0	110.9
2419	I	28	Very low	28	Very low	148.4 Å²	148.4	138.3 Å²	138.3	76%	0.761	76%	0.76	S	S	*	*			trans	-126.4	127.6	139.2	-76.5	158.9	0	0	0	109.5	T2417	T2417-I2419 PolarHBondContact O-N 2.76Å
2420	D	27.4	Very low	27.6	Very low	156.6 Å²	156.6	141.7 Å²	141.7	84%	0.837	78%	0.778	S	S	*	*			trans	53.5	119.1	158.9	-60.2	-31	0	0	0	120	R2422	D2420-R2422 PolarHBondContact O-N 3.4Å
2421	G	26.7	Very low	27.4	Very low	74.8 Å²	74.8	145.6 Å²	145.6	77%	0.771	79%	0.785	S	S	*	*			trans	101.7	110.9	145.4	0	0	0	0	0	116.9
2422	R	26.1	Very low	27.4	Very low	253.2 Å²	253.2	142.8 Å²	142.8	96%	0.955	79%	0.785	S	S	*	*			trans	-54.9	125.3	144.2	-76.5	-175.4	-146.2	-156.7	0.3	113.5	D2420	D2420-R2422 PolarHBondContact O-N 3.4Å
2423	G	27.9	Very low	27.2	Very low	74.6 Å²	74.6	145.8 Å²	145.8	77%	0.769	79%	0.794	S	S	*	*			trans	-134.5	125.4	171.7	0	0	0	0	0	113.6
2424	Y	27.3	Very low	27.1	Very low	235 Å²	235	146.8 Å²	146.8	92%	0.922	79%	0.794	S	S	*	*			trans	-84.8	125.8	159.3	-88.7	-97.4	0	0	0	110.4	D2426	Y2424-D2426 PolarHBondContact O-N 3.1Å
2425	S	27.8	Very low	27.2	Very low	108.8 Å²	108.8	145 Å²	145	76%	0.761	79%	0.793	S	S	*	*			trans	-141.3	130.6	136.4	46.1	0	0	0	0	108.8
2426	D	26.9	Very low	27.1	Very low	146.2 Å²	146.2	147.5 Å²	147.5	78%	0.782	80%	0.797	S	S	*	*			trans	78.5	104.2	148.7	-94.7	-17.5	0	0	0	115.4	Y2424	Y2424-D2426 PolarHBondContact O-N 3.1Å
2427	F	28.5	Very low	27.2	Very low	200.2 Å²	200.2	144.2 Å²	144.2	88%	0.878	79%	0.791	S	S	*	*			trans	166.4	79.4	153.5	-80.3	-80.1	0	0	0	112	V2429	F2427-V2429 VanDerWaalsContact C-N 3.26Å; F2427-V2429 PolarHBondContact O-N 2.86Å; F2427-V2429 VanDerWaalsContact O-N 3.15Å
2428	G	24.7	Very low	27.3	Very low	79 Å²	79	146.4 Å²	146.4	81%	0.814	79%	0.786	S	S	*	*			trans	-80.6	99.1	161.7	0	0	0	0	0	110.5	N2430	G2428-N2430 VanDerWaalsContact C-N 3.31Å; G2428-N2430 PolarHBondContact O-N 3.01Å
2429	V	27.6	Very low	27.3	Very low	107.4 Å²	107.4	147.8 Å²	147.8	65%	0.651	78%	0.78	S	S	*	*			trans	-99.9	105.2	160.6	-178.1	0	0	0	0	106.5	F2427 F2431	F2427-V2429 VanDerWaalsContact C-N 3.26Å; F2427-V2429 PolarHBondContact O-N 2.86Å; F2427-V2429 VanDerWaalsContact O-N 3.15Å; V2429-F2431 VanDerWaalsContact C-N 3.34Å; V2429-F2431 HydrophobicContact CB-CE2 4.01Å; V2429-F2431 HydrophobicContact CB-CZ 4.43Å; V2429-F2431 HydrophobicContact CG1-CD2 4.2Å; V2429-F2431 HydrophobicContact CG1-CE1 4.42Å; V2429-F2431 HydrophobicContact CG1-CE2 4.07Å; V2429-F2431 HydrophobicContact CG1-CZ 4.2Å; V2429-F2431 VanDerWaalsContact O-CD2 3.27Å; V2429-F2431 WeakPolarHBondContact O-CD2 3.18Å; V2429-F2431 PolarHBondContact O-N 2.85Å; V2429-F2431 VanDerWaalsContact O-N 3.17Å
2430	N	24.4	Very low	27.4	Very low	152.8 Å²	152.8	147.5 Å²	147.5	82%	0.817	77%	0.774	S	S	*	*			trans	-63.8	106.4	172.9	-102.5	-14.3	0	0	0	108.7	G2428 D2432	G2428-N2430 VanDerWaalsContact C-N 3.31Å; G2428-N2430 PolarHBondContact O-N 3.01Å; N2430-D2432 PolarHBondContact O-N 3Å; N2430-D2432 VanDerWaalsContact O-N 3.12Å
2431	F	28.2	Very low	27.6	Very low	186.6 Å²	186.6	147.3 Å²	147.3	82%	0.818	77%	0.766	S	S	*	*			trans	-84.6	104.7	158.9	-81	-82	0	0	0	107.8	V2429 K2433	V2429-F2431 VanDerWaalsContact C-N 3.34Å; V2429-F2431 HydrophobicContact CB-CE2 4.01Å; V2429-F2431 HydrophobicContact CB-CZ 4.43Å; V2429-F2431 HydrophobicContact CG1-CD2 4.2Å; V2429-F2431 HydrophobicContact CG1-CE1 4.42Å; V2429-F2431 HydrophobicContact CG1-CE2 4.07Å; V2429-F2431 HydrophobicContact CG1-CZ 4.2Å; V2429-F2431 VanDerWaalsContact O-CD2 3.27Å; V2429-F2431 WeakPolarHBondContact O-CD2 3.18Å; V2429-F2431 PolarHBondContact O-N 2.85Å; V2429-F2431 VanDerWaalsContact O-N 3.17Å; F2431-K2433 PolarHBondContact O-N 3.04Å; F2431-K2433 VanDerWaalsContact O-N 3.12Å
2432	D	27.9	Very low	27.8	Very low	146 Å²	146	150.4 Å²	150.4	78%	0.781	76%	0.758	S	S	*	*			trans	-58.2	118.5	174.4	-102.6	-31	0	0	0	110	N2430 Q2434	N2430-D2432 PolarHBondContact O-N 3Å; N2430-D2432 VanDerWaalsContact O-N 3.12Å; D2432-Q2434 VanDerWaalsContact C-N 3.25Å; D2432-Q2434 PolarHBondContact O-N 3.03Å; D2432-Q2434 VanDerWaalsContact O-N 3.16Å
2433	K	26.9	Very low	27.9	Very low	192 Å²	192	144.7 Å²	144.7	84%	0.835	75%	0.747	S	S	*	*			trans	-69.4	85.6	170.9	-74.7	177.7	173.8	177.9	0	109.7	D2414 F2431	D2414-K2433 IonicContact OD1-NZ 2.7Å; D2414-K2433 PolarHBondContact OD1-NZ 3.36Å; F2431-K2433 PolarHBondContact O-N 3.04Å; F2431-K2433 VanDerWaalsContact O-N 3.12Å
2434	Q	26.5	Very low	28.2	Very low	162.6 Å²	162.6	148.6 Å²	148.6	76%	0.76	75%	0.745	S	S	*	*			trans	-139.5	93.5	159.9	-82.5	-177.4	18.5	0	0	111	D2432 Q2436	D2432-Q2434 VanDerWaalsContact C-N 3.25Å; D2432-Q2434 PolarHBondContact O-N 3.03Å; D2432-Q2434 VanDerWaalsContact O-N 3.16Å; Q2434-Q2436 PolarHBondContact O-N 2.87Å
2435	S	27.8	Very low	28.3	Very low	105.6 Å²	105.6	145.5 Å²	145.5	74%	0.738	74%	0.736	S	S	*	*			trans	-171.3	83.7	153.2	55.6	0	0	0	0	113.7	P2437	S2435-P2437 WeakPolarHBondContact O-CD 3.31Å
2436	Q	27.2	Very low	28.3	Very low	158.6 Å²	158.6	150.3 Å²	150.3	74%	0.741	74%	0.738	S	S	*	*			trans	-79.2	119.1	154	-70.2	-109.6	-11.1	0	0	113.5	Q2434 Y2438 Q2439	Q2434-Q2436 PolarHBondContact O-N 2.87Å; Q2436-Y2438 PolarHBondContact O-N 2.84Å; Q2436-Y2438 VanDerWaalsContact O-N 3.09Å; Q2436-Q2439 PolarHBondContact O-N 3.19Å
2437	P	28.3	Very low	28.4	Very low	102.4 Å²	102.4	153.6 Å²	153.6	67%	0.665	74%	0.739	S	S	*	*			trans	-67.8	115.8	170.4	28.2	-30.4	0	0	0	110.5	S2435 Q2439 F2440	S2435-P2437 WeakPolarHBondContact O-CD 3.31Å; P2437-Q2439 VanDerWaalsContact C-N 3.33Å; P2437-Q2439 PolarHBondContact O-N 3.06Å; P2437-Q2439 VanDerWaalsContact O-N 3.14Å; P2437-F2440 PolarHBondContact O-N 3.18Å
2438	Y	29.2	Very low	28.3	Very low	172.4 Å²	172.4	148.7 Å²	148.7	68%	0.676	73%	0.73	S	S	*	*			trans	-27.8	74.2	169.9	-76.5	-82.5	0	0	0	113.5	Q2436 F2440 F2441 G2508	Q2436-Y2438 PolarHBondContact O-N 2.84Å; Q2436-Y2438 VanDerWaalsContact O-N 3.09Å; Y2438-F2440 AromaticContact CD1-CD2 3.59Å; Y2438-F2440 HydrophobicContact CD1-CD2 3.59Å; Y2438-F2440 AromaticContact CD1-CE2 3.06Å; Y2438-F2440 HydrophobicContact CD1-CE2 3.06Å; Y2438-F2440 AromaticContact CD1-CZ 3.83Å; Y2438-F2440 HydrophobicContact CD1-CZ 3.83Å; Y2438-F2440 HydrophobicContact CE1-CD2 4.46Å; Y2438-F2440 AromaticContact CE1-CE2 3.52Å; Y2438-F2440 HydrophobicContact CE1-CE2 3.52Å; Y2438-F2440 AromaticContact CE1-CZ 3.94Å; Y2438-F2440 HydrophobicContact CE1-CZ 3.94Å; Y2438-F2440 HydrophobicContact CG-CD2 4.03Å; Y2438-F2440 AromaticContact CG-CE2 3.81Å; Y2438-F2440 HydrophobicContact CG-CE2 3.81Å; Y2438-F2440 PolarHBondContact O-N 3.17Å; Y2438-F2441 HydrophobicContact CD1-CD2 4.17Å; Y2438-F2441 AromaticContact CD1-CE2 3.96Å; Y2438-F2441 HydrophobicContact CD1-CE2 3.96Å; Y2438-F2441 HydrophobicContact CE1-CE2 4.47Å; Y2438-G2508 VanDerWaalsContact CD1-N 3.35Å
2439	Q	27.9	Very low	28.5	Very low	140.4 Å²	140.4	151.2 Å²	151.2	66%	0.656	72%	0.723	S	S	*	*			trans	-92.3	78.1	159.6	-83.9	-169.4	-3.9	0	0	111	Q2436 P2437 F2441 K2442 N2443 T2505	Q2436-Q2439 PolarHBondContact O-N 3.19Å; P2437-Q2439 VanDerWaalsContact C-N 3.33Å; P2437-Q2439 PolarHBondContact O-N 3.06Å; P2437-Q2439 VanDerWaalsContact O-N 3.14Å; Q2439-F2441 VanDerWaalsContact C-N 3.34Å; Q2439-K2442 PolarHBondContact O-N 2.58Å; Q2439-N2443 PolarHBondContact O-N 3.04Å; Q2439-T2505 PolarHBondContact O-OG1 2.95Å
2440	F	30.5	Very low	28.5	Very low	141.4 Å²	141.4	151.1 Å²	151.1	62%	0.62	73%	0.727	S	S	*	*	S	Bend	trans	-82.4	9.5	166.4	-99.3	-87.8	0	0	0	111.6	R2179 V2399 P2437 Y2438 K2442 H2444 L2504 T2505	R2179-F2440 VanDerWaalsContact NH2-CZ 3.35Å; V2399-F2440 HydrophobicContact CG1-CE1 4.26Å; V2399-F2440 HydrophobicContact CG1-CZ 4.47Å; P2437-F2440 PolarHBondContact O-N 3.18Å; Y2438-F2440 AromaticContact CD1-CD2 3.59Å; Y2438-F2440 HydrophobicContact CD1-CD2 3.59Å; Y2438-F2440 AromaticContact CD1-CE2 3.06Å; Y2438-F2440 HydrophobicContact CD1-CE2 3.06Å; Y2438-F2440 AromaticContact CD1-CZ 3.83Å; Y2438-F2440 HydrophobicContact CD1-CZ 3.83Å; Y2438-F2440 HydrophobicContact CE1-CD2 4.46Å; Y2438-F2440 AromaticContact CE1-CE2 3.52Å; Y2438-F2440 HydrophobicContact CE1-CE2 3.52Å; Y2438-F2440 AromaticContact CE1-CZ 3.94Å; Y2438-F2440 HydrophobicContact CE1-CZ 3.94Å; Y2438-F2440 HydrophobicContact CG-CD2 4.03Å; Y2438-F2440 AromaticContact CG-CE2 3.81Å; Y2438-F2440 HydrophobicContact CG-CE2 3.81Å; Y2438-F2440 PolarHBondContact O-N 3.17Å; F2440-K2442 PolarHBondContact O-N 3.4Å; F2440-H2444 AromaticContact CE2-NE2 3.84Å; F2440-H2444 AromaticContact CZ-CD2 3.87Å; F2440-H2444 AromaticContact CZ-NE2 3.81Å; F2440-L2504 CarbonylContact O-C 3.57Å; F2440-L2504 VanDerWaalsContact O-CA 3.26Å; F2440-L2504 WeakPolarHBondContact O-CA 3.07Å; F2440-T2505 WeakPolarHBondContact CD1-O 2.98Å; F2440-T2505 PolarHBondContact O-N 3.31Å; F2440-T2505 PolarHBondContact O-OG1 2.68Å
2441	F	30.7	Very low	28.6	Very low	154 Å²	154	147.9 Å²	147.9	68%	0.675	72%	0.722	S	S	*	*			trans	-67.4	82	176.6	-72.3	-85	0	0	0	114.5	Y2438 Q2439 T2503 L2504	Y2438-F2441 HydrophobicContact CD1-CD2 4.17Å; Y2438-F2441 AromaticContact CD1-CE2 3.96Å; Y2438-F2441 HydrophobicContact CD1-CE2 3.96Å; Y2438-F2441 HydrophobicContact CE1-CE2 4.47Å; Q2439-F2441 VanDerWaalsContact C-N 3.34Å; F2441-T2503 WeakPolarHBondContact CA-O 3.26Å; F2441-L2504 HydrophobicContact CE1-CB 4.45Å; F2441-L2504 HydrophobicContact CE1-CD1 4.04Å; F2441-L2504 HydrophobicContact CZ-CD1 4.12Å
2442	K	30.6	Very low	28.6	Very low	140.2 Å²	140.2	147 Å²	147	61%	0.61	72%	0.72	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-88.7	77.9	164.7	-93.4	177.2	-179.7	173.2	0	113.7	Q2439 F2440 T2503	Q2439-K2442 PolarHBondContact O-N 2.58Å; F2440-K2442 PolarHBondContact O-N 3.4Å; K2442-T2503 PolarHBondContact N-O 2.79Å; K2442-T2503 VanDerWaalsContact N-O 3.09Å; K2442-T2503 PolarHBondContact O-N 3.48Å
2443	N	29.8	Very low	28.5	Very low	132.4 Å²	132.4	147.1 Å²	147.1	71%	0.708	72%	0.721	S	S	*	*			trans	-51.8	65.6	166.5	-70.5	-15	0	0	0	115.5	Q2439 K2502	Q2439-N2443 PolarHBondContact O-N 3.04Å; N2443-K2502 WeakPolarHBondContact OD1-CG 3.45Å
2444	H	32.4	Very low	28.5	Very low	157 Å²	157	148.6 Å²	148.6	73%	0.727	72%	0.722	S	S	*	*			trans	-117.4	49.3	164.1	-81.2	-52.1	0	0	0	113	F2440 Q2501	F2440-H2444 AromaticContact CE2-NE2 3.84Å; F2440-H2444 AromaticContact CZ-CD2 3.87Å; F2440-H2444 AromaticContact CZ-NE2 3.81Å; H2444-Q2501 PolarHBondContact N-O 2.86Å; H2444-Q2501 PolarHBondContact O-N 2.89Å
2445	F	29.8	Very low	28.5	Very low	168.8 Å²	168.8	152.1 Å²	152.1	74%	0.74	73%	0.729	S	S	*	*			trans	-118	66.8	162.7	-100.1	-82.4	0	0	0	110.7	R2447 V2496 W2498	F2445-R2447 PolarHBondContact O-N 2.79Å; F2445-V2496 HydrophobicContact CE1-CG1 4.35Å; F2445-V2496 HydrophobicContact CZ-CG1 4.23Å; F2445-W2498 AromaticContact CE1-CE3 3.84Å; F2445-W2498 HydrophobicContact CE1-CE3 3.84Å; F2445-W2498 AromaticContact CE1-CZ3 3.77Å; F2445-W2498 HydrophobicContact CE1-CZ3 3.77Å; F2445-W2498 AromaticContact CZ-CE3 3.56Å; F2445-W2498 HydrophobicContact CZ-CE3 3.56Å; F2445-W2498 AromaticContact CZ-CZ3 3.81Å; F2445-W2498 HydrophobicContact CZ-CZ3 3.81Å
2446	R	29.2	Very low	28.5	Very low	211.2 Å²	211.2	153 Å²	153	80%	0.797	74%	0.735	S	S	*	*			trans	-107.2	78.3	170.3	-132.5	-174.7	-169.9	-164.1	2.8	111.4	S2448 H2499	R2446-S2448 PolarHBondContact O-N 3.08Å; R2446-H2499 PolarHBondContact N-O 2.77Å
2447	R	27.8	Very low	28.5	Very low	214.4 Å²	214.4	148.6 Å²	148.6	81%	0.809	73%	0.733	S	S	*	*			trans	-92.8	95.2	163.2	-143.8	-179.7	-177.1	-170.2	1.4	108.7	F2445 I2449 V2496	F2445-R2447 PolarHBondContact O-N 2.79Å; R2447-I2449 HydrophobicContact CG-CG1 4.39Å; R2447-I2449 PolarHBondContact O-N 3.11Å; R2447-I2449 VanDerWaalsContact O-N 3.1Å; R2447-V2496 HydrophobicContact CG-CG1 4.48Å
2448	S	27.9	Very low	28.5	Very low	97.8 Å²	97.8	148.7 Å²	148.7	68%	0.684	74%	0.736	S	S	*	*			trans	-99	96.6	158.5	54.6	0	0	0	0	110.4	R2446 S2450	R2446-S2448 PolarHBondContact O-N 3.08Å; S2448-S2450 PolarHBondContact O-N 2.96Å; S2448-S2450 VanDerWaalsContact O-N 3.11Å
2449	I	27.1	Very low	28.5	Very low	131.4 Å²	131.4	147.8 Å²	147.8	67%	0.674	74%	0.743	S	S	*	*			trans	-107.6	103.7	155.9	-67.2	162	0	0	0	105.1	R2447 A2451	R2447-I2449 HydrophobicContact CG-CG1 4.39Å; R2447-I2449 PolarHBondContact O-N 3.11Å; R2447-I2449 VanDerWaalsContact O-N 3.1Å; I2449-A2451 PolarHBondContact O-N 2.85Å; I2449-A2451 VanDerWaalsContact O-N 3.1Å
2450	S	27.6	Very low	28.5	Very low	105 Å²	105	146.6 Å²	146.6	73%	0.734	75%	0.745	S	S	*	*			trans	-68.7	99.5	165.9	65.9	0	0	0	0	108.2	S2448 Q2452	S2448-S2450 PolarHBondContact O-N 2.96Å; S2448-S2450 VanDerWaalsContact O-N 3.11Å; S2450-Q2452 PolarHBondContact O-N 3.01Å
2451	A	27.3	Very low	28.5	Very low	85.4 Å²	85.4	148.3 Å²	148.3	71%	0.706	75%	0.754	S	S	*	*			trans	-82	102.1	160.1	0	0	0	0	0	106.6	I2449 N2453	I2449-A2451 PolarHBondContact O-N 2.85Å; I2449-A2451 VanDerWaalsContact O-N 3.1Å; A2451-N2453 PolarHBondContact O-N 2.88Å
2452	Q	27.7	Very low	28.3	Very low	167.2 Å²	167.2	146.1 Å²	146.1	78%	0.781	76%	0.758	S	S	*	*			trans	-58.9	117	170.4	-81.7	169.7	-27.9	0	0	108.6	S2450 Y2454	S2450-Q2452 PolarHBondContact O-N 3.01Å; Q2452-Y2454 VanDerWaalsContact C-N 3.31Å; Q2452-Y2454 HydrophobicContact CB-CD2 4.31Å; Q2452-Y2454 PolarHBondContact O-N 2.97Å; Q2452-Y2454 VanDerWaalsContact O-N 3.11Å
2453	N	26.3	Very low	28.2	Very low	149.4 Å²	149.4	144.9 Å²	144.9	80%	0.799	77%	0.768	S	S	*	*			trans	-47.5	103	163.1	-73.8	-37.1	0	0	0	110.5	A2451 R2455	A2451-N2453 PolarHBondContact O-N 2.88Å; N2453-R2455 PolarHBondContact O-N 2.87Å
2454	Y	27.6	Very low	28	Very low	222 Å²	222	148.5 Å²	148.5	87%	0.871	78%	0.777	S	S	*	*			trans	-87.3	103	151.6	-97.4	-87.7	0	0	0	107.9	Q2452 S2456	Q2452-Y2454 VanDerWaalsContact C-N 3.31Å; Q2452-Y2454 HydrophobicContact CB-CD2 4.31Å; Q2452-Y2454 PolarHBondContact O-N 2.97Å; Q2452-Y2454 VanDerWaalsContact O-N 3.11Å; Y2454-S2456 VanDerWaalsContact C-N 3.33Å; Y2454-S2456 PolarHBondContact O-N 2.84Å
2455	R	25.7	Very low	27.8	Very low	236.6 Å²	236.6	152.2 Å²	152.2	89%	0.893	78%	0.784	S	S	*	*			trans	-66.2	126.4	163.5	-78.8	-178.1	173	-169	-1.8	108.5	N2453 G2457	N2453-R2455 PolarHBondContact O-N 2.87Å; R2455-G2457 PolarHBondContact O-N 2.71Å
2456	S	28.2	Very low	27.6	Very low	124.6 Å²	124.6	152.5 Å²	152.5	87%	0.871	79%	0.788	S	S	*	*			trans	-11.2	117	152.3	-172.1	0	0	0	0	112.4	Y2454	Y2454-S2456 VanDerWaalsContact C-N 3.33Å; Y2454-S2456 PolarHBondContact O-N 2.84Å
2457	G	27.6	Very low	27.4	Very low	67.4 Å²	67.4	151.2 Å²	151.2	70%	0.695	79%	0.793	S	S	*	*			trans	-162.5	121.7	151.4	0	0	0	0	0	113	R2455	R2455-G2457 PolarHBondContact O-N 2.71Å
2458	S	27.8	Very low	27.4	Very low	104 Å²	104	146.1 Å²	146.1	73%	0.727	79%	0.79	S	S	*	*			trans	23	122.6	152.2	57.5	0	0	0	0	116.3
2459	D	28.7	Very low	27.4	Very low	153.4 Å²	153.4	148.3 Å²	148.3	82%	0.82	80%	0.795	S	S	*	*			trans	125.3	121.4	135.7	-74.6	-24.8	0	0	0	117.2
2460	V	28.9	Very low	27.6	Very low	116 Å²	116	147.4 Å²	147.4	70%	0.703	80%	0.797	S	S	*	*			trans	73	118.2	139.4	-179.6	0	0	0	0	116.6
2461	H	29.1	Very low	27.6	Very low	176.2 Å²	176.2	151.9 Å²	151.9	82%	0.816	80%	0.804	S	S	*	*			trans	78.2	114.5	145.9	-75.5	-28.1	0	0	0	119.6
2462	S	27.2	Very low	27.6	Very low	108.6 Å²	108.6	153 Å²	153	76%	0.759	81%	0.806	S	S	*	*			trans	-55.3	133.6	134.4	61.2	0	0	0	0	116.6
2463	S	27.8	Very low	27.5	Very low	114.8 Å²	114.8	154.6 Å²	154.6	80%	0.803	81%	0.811	S	S	*	*			trans	-176.9	130.5	133.6	42.1	0	0	0	0	115.3	R2465	S2463-R2465 PolarHBondContact O-N 3.11Å
2464	K	26.3	Very low	27.6	Very low	206.6 Å²	206.6	158.1 Å²	158.1	90%	0.898	81%	0.813	S	S	*	*			trans	-51.3	124.9	153	-74.6	172	174.5	176.1	0	113.2
2465	R	27.5	Very low	27.6	Very low	236.4 Å²	236.4	156 Å²	156	89%	0.892	81%	0.808	S	S	*	*			trans	-146.9	127.9	147.2	-90.4	177.7	-177.5	-173.4	0.8	110.6	S2463 M2467	S2463-R2465 PolarHBondContact O-N 3.11Å; R2465-M2467 PolarHBondContact O-N 3.43Å
2466	Q	27.3	Very low	27.6	Very low	174.2 Å²	174.2	150.6 Å²	150.6	81%	0.814	80%	0.802	S	S	*	*				76.1	130.6	129.5	-113.3	170.2	-25.3	0	0	115	S2468	Q2466-S2468 VanDerWaalsContact C-N 3.35Å; Q2466-S2468 PolarHBondContact O-N 2.98Å
2467	M	25	Very low	27.5	Very low	183.8 Å²	183.8	151.7 Å²	151.7	91%	0.905	80%	0.797	S	S	*	*			trans	-20.6	104.8	161.3	-81.6	176.8	87.3	0	0	114	R2465	R2465-M2467 PolarHBondContact O-N 3.43Å
2468	S	26.4	Very low	27.4	Very low	107.6 Å²	107.6	158.9 Å²	158.9	75%	0.752	80%	0.803	S	S	*	*			trans	-87.9	128.9	146.2	54.8	0	0	0	0	113.1	Q2466	Q2466-S2468 VanDerWaalsContact C-N 3.35Å; Q2466-S2468 PolarHBondContact O-N 2.98Å
2469	D	28.7	Very low	27.4	Very low	144.2 Å²	144.2	158 Å²	158	77%	0.771	80%	0.802	S	S	*	*			trans	-68.4	133.9	163.6	-102.1	-33	0	0	0	114.9	F2471	D2469-F2471 VanDerWaalsContact C-N 3.26Å; D2469-F2471 PolarHBondContact O-N 3.33Å; D2469-F2471 VanDerWaalsContact O-N 3.14Å
2470	P	30.5	Very low	27.3	Very low	113 Å²	113	156.8 Å²	156.8	73%	0.734	80%	0.796	S	S	*	*			trans	-108	64.9	177.4	27.5	-14.5	0	0	0	113.4
2471	F	27.5	Very low	27.2	Very low	197.8 Å²	197.8	161.5 Å²	161.5	87%	0.868	80%	0.802	S	S	*	*			trans	-124.8	46.9	169.1	-90	-82.6	0	0	0	112.9	D2469	D2469-F2471 VanDerWaalsContact C-N 3.26Å; D2469-F2471 PolarHBondContact O-N 3.33Å; D2469-F2471 VanDerWaalsContact O-N 3.14Å
2472	S	27.9	Very low	27.2	Very low	108.4 Å²	108.4	160.1 Å²	160.1	76%	0.758	80%	0.801	S	S	*	*			trans	-141.1	50.9	168.4	46	0	0	0	0	112.8	R2474	S2472-R2474 PolarHBondContact O-N 3.21Å
2473	K	26.5	Very low	27.2	Very low	200.6 Å²	200.6	161.5 Å²	161.5	87%	0.872	80%	0.8	S	S	*	*			trans	-108	69.5	166	-90.2	-178	179.6	178.4	0	111.8	F2475	K2473-F2475 PolarHBondContact O-N 3.39Å
2474	R	27.4	Very low	27.2	Very low	223.6 Å²	223.6	163 Å²	163	84%	0.844	80%	0.799	S	S	*	*			trans	-61.9	84.6	172.9	-76.9	-177.2	-177	177.1	1.1	114.3	S2472 T2476	S2472-R2474 PolarHBondContact O-N 3.21Å; R2474-T2476 VanDerWaalsContact C-N 3.33Å; R2474-T2476 PolarHBondContact O-N 3.01Å
2475	F	28.2	Very low	27.5	Very low	177.2 Å²	177.2	160.7 Å²	160.7	78%	0.777	80%	0.796	S	S	*	*			trans	-113.7	91.3	151.6	-77.9	-87.6	0	0	0	110.4	K2473	K2473-F2475 PolarHBondContact O-N 3.39Å
2476	T	24.9	Very low	27.5	Very low	125 Å²	125	158.3 Å²	158.3	77%	0.767	80%	0.795	S	S	*	*			trans	-102.3	97.5	156	40.6	0	0	0	0	107.9	R2474 R2478	R2474-T2476 VanDerWaalsContact C-N 3.33Å; R2474-T2476 PolarHBondContact O-N 3.01Å; T2476-R2478 PolarHBondContact O-N 2.97Å
2477	I	27.1	Very low	27.6	Very low	147.4 Å²	147.4	160.5 Å²	160.5	76%	0.756	80%	0.796	S	S	*	*			trans	-74.7	86.2	160.4	-59.4	175.1	0	0	0	105.8	A2479	I2477-A2479 VanDerWaalsContact C-N 3.34Å; I2477-A2479 PolarHBondContact O-N 3.27Å
2478	R	25.6	Very low	27.7	Very low	217.2 Å²	217.2	159 Å²	159	82%	0.82	79%	0.792	S	S	*	*			trans	-84	97.4	170	-146.5	-178.8	-160.7	-177.2	4.5	106.6	T2476 N2480	T2476-R2478 PolarHBondContact O-N 2.97Å; R2478-N2480 HydrophobicContact CG-CB 4.4Å; R2478-N2480 PolarHBondContact O-N 3.18Å
2479	A	26.3	Very low	27.8	Very low	86.6 Å²	86.6	163.1 Å²	163.1	72%	0.716	79%	0.792	S	S	*	*			trans	-74.8	93.7	164.7	0	0	0	0	0	108.6	I2477 Y2481	I2477-A2479 VanDerWaalsContact C-N 3.34Å; I2477-A2479 PolarHBondContact O-N 3.27Å; A2479-Y2481 PolarHBondContact O-N 3.04Å; A2479-Y2481 VanDerWaalsContact O-N 3.14Å
2480	N	27	Very low	27.8	Very low	128 Å²	128	163 Å²	163	68%	0.684	79%	0.791	S	S	*	*			trans	-101	104.2	170.8	-112.9	6	0	0	0	107.8	R2478 N2482	R2478-N2480 HydrophobicContact CG-CB 4.4Å; R2478-N2480 PolarHBondContact O-N 3.18Å; N2480-N2482 VanDerWaalsContact C-N 3.26Å; N2480-N2482 PolarHBondContact O-N 2.92Å
2481	Y	26.2	Very low	27.7	Very low	213.8 Å²	213.8	164.7 Å²	164.7	84%	0.838	79%	0.794	S	S	*	*			trans	-53.1	107.5	158.9	-96.7	-92.1	0	0	0	109.8	A2479	A2479-Y2481 PolarHBondContact O-N 3.04Å; A2479-Y2481 VanDerWaalsContact O-N 3.14Å
2482	N	29.3	Very low	27.8	Very low	147.6 Å²	147.6	162.4 Å²	162.4	79%	0.789	79%	0.79	S	S	*	*			trans	-133.9	130.3	140.3	-102.4	-13	0	0	0	110.1	N2480 N2484	N2480-N2482 VanDerWaalsContact C-N 3.26Å; N2480-N2482 PolarHBondContact O-N 2.92Å; N2482-N2484 PolarHBondContact O-N 3.2Å
2483	N	28.5	Very low	27.8	Very low	137.2 Å²	137.2	160.8 Å²	160.8	73%	0.734	79%	0.792	S	S	*	*			trans	-34.9	118.1	166.9	-77.8	-25.5	0	0	0	112.4	N2485	N2483-N2485 PolarHBondContact O-N 3.37Å
2484	N	27.8	Very low	28.1	Very low	145.8 Å²	145.8	158.8 Å²	158.8	78%	0.78	79%	0.785	S	S	*	*			trans	154.9	103.6	130.4	-77	-13.9	0	0	0	109.9	N2482 E2486	N2482-N2484 PolarHBondContact O-N 3.2Å; N2484-E2486 VanDerWaalsContact C-N 3.32Å; N2484-E2486 PolarHBondContact O-N 3.27Å
2485	N	31.9	Very low	28.5	Very low	159 Å²	159	155.8 Å²	155.8	85%	0.85	78%	0.78	S	S	*	*			trans	-165.9	97.2	149.2	-78.3	-23.3	0	0	0	111.4	N2483 R2487	N2483-N2485 PolarHBondContact O-N 3.37Å; N2485-R2487 PolarHBondContact O-N 2.93Å
2486	E	28.5	Very low	29.1	Very low	186 Å²	186	150.6 Å²	150.6	87%	0.869	76%	0.763	S	S	*	*			trans	-92.3	121.7	159.7	-71.1	-179.8	162.3	0	0	110	N2484 N2488	N2484-E2486 VanDerWaalsContact C-N 3.32Å; N2484-E2486 PolarHBondContact O-N 3.27Å; E2486-N2488 PolarHBondContact O-N 3Å; E2486-N2488 VanDerWaalsContact O-N 3.08Å
2487	R	28.7	Very low	30.2	Very low	221.6 Å²	221.6	148.8 Å²	148.8	84%	0.836	75%	0.749	S	S	*	*			trans	-108	104.3	170.1	-70.3	176.2	-178.8	-175.1	-0	110.7	N2485 Y2489	N2485-R2487 PolarHBondContact O-N 2.93Å; R2487-Y2489 HydrophobicContact CB-CD2 4.32Å; R2487-Y2489 HydrophobicContact CB-CE2 4.14Å; R2487-Y2489 PolarHBondContact O-N 3.03Å; R2487-Y2489 VanDerWaalsContact O-N 3.07Å
2488	N	27.4	Very low	31.4	Very low	151.2 Å²	151.2	146.1 Å²	146.1	81%	0.809	73%	0.729	S	S	*	*			trans	-77.1	90.9	161.3	-78	-27.2	0	0	0	112.2	E2486 N2490	E2486-N2488 PolarHBondContact O-N 3Å; E2486-N2488 VanDerWaalsContact O-N 3.08Å; N2488-N2490 PolarHBondContact O-N 3.1Å; N2488-N2490 VanDerWaalsContact O-N 3.08Å
2489	Y	27.8	Very low	33.3	Very low	194.6 Å²	194.6	138.8 Å²	138.8	76%	0.763	70%	0.704	S	S	*	*			trans	-90.9	81.7	162.5	-83.4	-90.1	0	0	0	109.1	R2487 N2491 L2492	R2487-Y2489 HydrophobicContact CB-CD2 4.32Å; R2487-Y2489 HydrophobicContact CB-CE2 4.14Å; R2487-Y2489 PolarHBondContact O-N 3.03Å; R2487-Y2489 VanDerWaalsContact O-N 3.07Å; Y2489-N2491 VanDerWaalsContact C-N 3.27Å; Y2489-N2491 PolarHBondContact O-N 3.25Å; Y2489-L2492 HydrophobicContact CD1-CD1 3.46Å; Y2489-L2492 VanDerWaalsContact CD1-CD1 3.46Å; Y2489-L2492 HydrophobicContact CE1-CD1 3.12Å
2490	N	28.3	Very low	35.5	Very low	140.4 Å²	140.4	136.8 Å²	136.8	75%	0.751	68%	0.679	S	S	*	*			trans	-116.4	83.6	161.6	-75.7	-13.7	0	0	0	107.8	N2488 L2492	N2488-N2490 PolarHBondContact O-N 3.1Å; N2488-N2490 VanDerWaalsContact O-N 3.08Å; N2490-L2492 PolarHBondContact O-N 3.34Å
2491	N	29	Very low	38	Very low	149.4 Å²	149.4	132.8 Å²	132.8	80%	0.799	66%	0.656	S	S	*	*			trans	-113.9	78.5	169.5	-77.3	-14.1	0	0	0	110.6	Y2489 G2493	Y2489-N2491 VanDerWaalsContact C-N 3.27Å; Y2489-N2491 PolarHBondContact O-N 3.25Å; N2491-G2493 PolarHBondContact O-N 3.11Å
2492	L	28.7	Very low	40.7	Very low	149.2 Å²	149.2	125.4 Å²	125.4	78%	0.781	63%	0.628	S	S	*	*			trans	-87	102	159.6	-81.9	141.7	0	0	0	108.1	Y2489 N2490 E2494	Y2489-L2492 HydrophobicContact CD1-CD1 3.46Å; Y2489-L2492 VanDerWaalsContact CD1-CD1 3.46Å; Y2489-L2492 HydrophobicContact CE1-CD1 3.12Å; N2490-L2492 PolarHBondContact O-N 3.34Å; L2492-E2494 HydrophobicContact CD2-CG 3.62Å; L2492-E2494 PolarHBondContact O-N 2.88Å
2493	G	29.3	Very low	43.3	Very low	76.4 Å²	76.4	119.1 Å²	119.1	79%	0.788	60%	0.595	S	S	*	*			trans	-68.3	107.9	170.8	0	0	0	0	0	110.6	N2491 E2495	N2491-G2493 PolarHBondContact O-N 3.11Å; G2493-E2495 PolarHBondContact O-N 2.94Å
2494	E	31.6	Very low	45.9	Very low	157.8 Å²	157.8	114.2 Å²	114.2	74%	0.737	57%	0.569	S	S	*	*			trans	-67.6	115.6	165.1	-74.4	-178.1	157.8	0	0	107.7	N2409 L2492 V2496	N2409-E2494 PolarHBondContact ND2-OE2 2.97Å; L2492-E2494 HydrophobicContact CD2-CG 3.62Å; L2492-E2494 PolarHBondContact O-N 2.88Å; E2494-V2496 PolarHBondContact O-N 3.03Å
2495	E	36.3	Very low	48.3	Very low	159.6 Å²	159.6	108.7 Å²	108.7	75%	0.746	54%	0.54	S	S	*	.			trans	-67.5	110	173.3	-140.8	171.7	-175.7	0	0	108.1	M2337 G2493 D2497	M2337-E2495 HydrophobicContact CE-CG 4.48Å; M2337-E2495 WeakPolarHBondContact CE-OE1 3.39Å; M2337-E2495 VanDerWaalsContact CE-OE2 3.23Å; M2337-E2495 WeakPolarHBondContact CE-OE2 3.36Å; G2493-E2495 PolarHBondContact O-N 2.94Å; E2495-D2497 VanDerWaalsContact C-N 3.3Å; E2495-D2497 PolarHBondContact O-N 2.93Å
2496	V	40.8	Very low	50.4	Low	69 Å²	69	102.3 Å²	102.3	42%	0.418	51%	0.507	S	S	.	.			trans	-79	104.6	177	179.4	0	0	0	0	107.5	F2445 R2447 E2494 W2498 N2517	F2445-V2496 HydrophobicContact CE1-CG1 4.35Å; F2445-V2496 HydrophobicContact CZ-CG1 4.23Å; R2447-V2496 HydrophobicContact CG-CG1 4.48Å; E2494-V2496 PolarHBondContact O-N 3.03Å; V2496-W2498 VanDerWaalsContact C-N 3.26Å; V2496-W2498 HydrophobicContact CG1-CZ2 4.46Å; V2496-W2498 VanDerWaalsContact O-CD1 3.31Å; V2496-W2498 PolarHBondContact O-N 2.8Å; V2496-N2517 HydrophobicContact CG1-CB 4.4Å; V2496-N2517 WeakPolarHBondContact CG1-ND2 3.35Å
2497	D	48	Very low	52.6	Low	86 Å²	86	97 Å²	97	46%	0.46	48%	0.484	S	S	.	.			trans	-75.7	103.5	177.1	-87.7	-28.4	0	0	0	110.5	E2495 H2499 N2517	E2495-D2497 VanDerWaalsContact C-N 3.3Å; E2495-D2497 PolarHBondContact O-N 2.93Å; D2497-H2499 VanDerWaalsContact C-N 3.3Å; D2497-H2499 WeakPolarHBondContact CB-CE1 3.22Å; D2497-H2499 WeakPolarHBondContact CB-ND1 3.31Å; D2497-H2499 PolarHBondContact O-N 3.01Å; D2497-H2499 VanDerWaalsContact O-N 3.13Å; D2497-H2499 PolarHBondContact O-ND1 2.87Å; D2497-H2499 VanDerWaalsContact O-ND1 3.11Å; D2497-H2499 IonicContact OD1-CE1 3.22Å; D2497-H2499 IonicContact OD1-ND1 3.45Å; D2497-H2499 PolarHBondContact OD1-ND1 3.43Å; D2497-H2499 IonicContact OD2-CE1 3.93Å; D2497-N2517 PolarHBondContact O-ND2 3.36Å
2498	W	52.6	Low	54.7	Low	92.6 Å²	92.6	89.6 Å²	89.6	35%	0.351	48%	0.477	S	S	.	.			trans	-79.2	110.2	176.7	-23.6	80.6	0	0	0	109.9	H2403 L2404 N2405 S2408 F2445 V2496 Q2501 K2515 W2518	H2403-W2498 HydrophobicContact CB-CH2 4.42Å; H2403-W2498 HydrophobicContact CB-CZ3 4.28Å; L2404-W2498 HydrophobicContact CD1-CE3 4.09Å; L2404-W2498 HydrophobicContact CD1-CZ3 4.26Å; L2404-W2498 HydrophobicContact CD2-CZ3 4.23Å; N2405-W2498 HydrophobicContact CB-CD2 4.35Å; N2405-W2498 HydrophobicContact CB-CE3 3.74Å; N2405-W2498 HydrophobicContact CB-CH2 4.07Å; N2405-W2498 HydrophobicContact CB-CZ2 4.46Å; N2405-W2498 HydrophobicContact CB-CZ3 3.6Å; N2405-W2498 WeakPolarHBondContact CB-O 3.3Å; N2405-W2498 VanDerWaalsContact ND2-CE3 3.28Å; N2405-W2498 WeakPolarHBondContact ND2-CH2 3.35Å; N2405-W2498 VanDerWaalsContact ND2-CZ2 3.3Å; N2405-W2498 WeakPolarHBondContact ND2-CZ2 3.15Å; N2405-W2498 WeakPolarHBondContact ND2-CZ3 3.39Å; N2405-W2498 PolarHBondContact ND2-O 3.03Å; N2405-W2498 VanDerWaalsContact ND2-O 3.14Å; N2405-W2498 WeakPolarHBondContact OD1-CH2 3.1Å; N2405-W2498 WeakPolarHBondContact OD1-CZ2 3.34Å; N2405-W2498 WeakPolarHBondContact OD1-CZ3 3.09Å; S2408-W2498 PolarHBondContact OG-O 2.84Å; F2445-W2498 AromaticContact CE1-CE3 3.84Å; F2445-W2498 HydrophobicContact CE1-CE3 3.84Å; F2445-W2498 AromaticContact CE1-CZ3 3.77Å; F2445-W2498 HydrophobicContact CE1-CZ3 3.77Å; F2445-W2498 AromaticContact CZ-CE3 3.56Å; F2445-W2498 HydrophobicContact CZ-CE3 3.56Å; F2445-W2498 AromaticContact CZ-CZ3 3.81Å; F2445-W2498 HydrophobicContact CZ-CZ3 3.81Å; V2496-W2498 VanDerWaalsContact C-N 3.26Å; V2496-W2498 HydrophobicContact CG1-CZ2 4.46Å; V2496-W2498 VanDerWaalsContact O-CD1 3.31Å; V2496-W2498 PolarHBondContact O-N 2.8Å; W2498-Q2501 HydrophobicContact CD2-CB 4.25Å; W2498-Q2501 HydrophobicContact CE3-CB 3.75Å; W2498-Q2501 HydrophobicContact CZ3-CB 3.89Å; W2498-K2515 HydrophobicContact CB-CB 4.13Å; W2498-K2515 HydrophobicContact CB-CD 4.21Å; W2498-K2515 HydrophobicContact CB-CG 4.48Å; W2498-K2515 HydrophobicContact CG-CD 3.99Å; W2498-W2518 HydrophobicContact CB-CB 4.41Å; W2498-W2518 PolarHBondContact O-N 3.03Å
2499	H	64.5	Low	57	Low	62.4 Å²	62.4	87.1 Å²	87.1	29%	0.289	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	84.1	179.9	-66.8	80.9	0	0	0	110.6	L2404 N2405 S2408 R2446 D2497 F2516 N2517 W2518	L2404-H2499 WeakPolarHBondContact CA-O 3.42Å; N2405-H2499 PolarHBondContact N-O 3.07Å; N2405-H2499 PolarHBondContact OD1-N 2.67Å; S2408-H2499 PolarHBondContact O-CD2 2.84Å; S2408-H2499 PolarHBondContact O-NE2 2.83Å; S2408-H2499 VanDerWaalsContact O-NE2 3.12Å; R2446-H2499 PolarHBondContact N-O 2.77Å; D2497-H2499 VanDerWaalsContact C-N 3.3Å; D2497-H2499 WeakPolarHBondContact CB-CE1 3.22Å; D2497-H2499 WeakPolarHBondContact CB-ND1 3.31Å; D2497-H2499 PolarHBondContact O-N 3.01Å; D2497-H2499 VanDerWaalsContact O-N 3.13Å; D2497-H2499 PolarHBondContact O-ND1 2.87Å; D2497-H2499 VanDerWaalsContact O-ND1 3.11Å; D2497-H2499 IonicContact OD1-CE1 3.22Å; D2497-H2499 IonicContact OD1-ND1 3.45Å; D2497-H2499 PolarHBondContact OD1-ND1 3.43Å; D2497-H2499 IonicContact OD2-CE1 3.93Å; H2499-F2516 PolarHBondContact N-O 2.97Å; H2499-N2517 PolarHBondContact CD2-ND2 2.79Å; H2499-N2517 PolarHBondContact CE1-ND2 3.06Å; H2499-N2517 PolarHBondContact NE2-ND2 3.06Å; H2499-W2518 HydrophobicContact CB-CD2 3.68Å; H2499-W2518 HydrophobicContact CB-CE3 3.95Å; H2499-W2518 HydrophobicContact CB-CG 4.03Å; H2499-W2518 HydrophobicContact CB-CH2 4.48Å; H2499-W2518 HydrophobicContact CB-CZ2 4.3Å; H2499-W2518 HydrophobicContact CB-CZ3 4.4Å; H2499-W2518 AromaticContact CD2-CD2 3.72Å; H2499-W2518 AromaticContact CD2-CE3 3.24Å; H2499-W2518 AromaticContact CD2-CZ3 3.89Å; H2499-W2518 AromaticContact CG-CD2 3.83Å; H2499-W2518 AromaticContact CG-CE3 3.82Å; H2499-W2518 AromaticContact CG-CG 3.97Å; H2499-W2518 PolarHBondContact ND1-N 3.13Å
2500	Y	72.6	Confident	59.6	Low	45.2 Å²	45.2	81.7 Å²	81.7	18%	0.177	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	138.2	173.7	-173.3	-99.4	0	0	0	110.1	S2172 Y2402 L2404 K2502 K2515 F2516 W2518	S2172-Y2500 WeakPolarHBondContact O-CD2 3.39Å; S2172-Y2500 VanDerWaalsContact O-CE2 3.22Å; S2172-Y2500 WeakPolarHBondContact O-CE2 3.26Å; Y2402-Y2500 AromaticContact CD1-CE2 3.6Å; Y2402-Y2500 HydrophobicContact CD1-CE2 3.6Å; Y2402-Y2500 AromaticContact CD1-CZ 3.72Å; Y2402-Y2500 WeakPolarHBondContact CD1-OH 3.29Å; Y2402-Y2500 HydrophobicContact CE1-CE2 4.31Å; Y2402-Y2500 AromaticContact CE1-CZ 3.92Å; Y2402-Y2500 WeakPolarHBondContact CE1-OH 3.38Å; Y2402-Y2500 HydrophobicContact CG-CE2 4.28Å; L2404-Y2500 HydrophobicContact CD1-CD1 3.86Å; L2404-Y2500 HydrophobicContact CD1-CD2 4.3Å; L2404-Y2500 HydrophobicContact CD1-CE1 3.43Å; L2404-Y2500 VanDerWaalsContact CD1-CE1 3.43Å; L2404-Y2500 HydrophobicContact CD1-CE2 3.88Å; L2404-Y2500 HydrophobicContact CD1-CG 4.29Å; L2404-Y2500 VanDerWaalsContact CD1-CZ 3.44Å; Y2500-K2502 HydrophobicContact CE1-CB 4.25Å; Y2500-K2502 HydrophobicContact CE1-CD 4.27Å; Y2500-K2502 HydrophobicContact CE1-CG 3.92Å; Y2500-K2502 VanDerWaalsContact OH-CB 3.3Å; Y2500-K2502 WeakPolarHBondContact OH-CB 3.43Å; Y2500-K2502 VanDerWaalsContact OH-CD 3.3Å; Y2500-K2502 WeakPolarHBondContact OH-CD 3.36Å; Y2500-K2502 WeakPolarHBondContact OH-CE 3.24Å; Y2500-K2502 WeakPolarHBondContact OH-CG 3.36Å; Y2500-K2515 CarbonylContact O-C 3.55Å; Y2500-K2515 VanDerWaalsContact O-CA 3.24Å; Y2500-K2515 WeakPolarHBondContact O-CA 3.31Å; Y2500-F2516 HydrophobicContact CD1-CB 3.93Å; Y2500-F2516 HydrophobicContact CG-CB 4.4Å; Y2500-F2516 PolarHBondContact N-O 2.97Å; Y2500-F2516 VanDerWaalsContact N-O 3.15Å; Y2500-F2516 PolarHBondContact O-N 3.02Å; Y2500-W2518 AromaticContact CD2-CD1 3.42Å; Y2500-W2518 VanDerWaalsContact CD2-CD1 3.42Å; Y2500-W2518 AromaticContact CD2-NE1 3.13Å; Y2500-W2518 AromaticContact CE2-CD1 3.48Å; Y2500-W2518 VanDerWaalsContact CE2-CD1 3.48Å; Y2500-W2518 AromaticContact CE2-NE1 3.02Å
2501	Q	80.1	Confident	62	Low	43.8 Å²	43.8	76.4 Å²	76.4	21%	0.205	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	134.9	173	177.9	177.4	-33.9	0	0	110.5	Y2402 H2403 H2444 W2498 T2503 N2513 V2514 K2515	Y2402-Q2501 CarbonylContact C-O 3.53Å; Y2402-Q2501 WeakPolarHBondContact CA-O 3.49Å; H2403-Q2501 HydrophobicContact CB-CB 4.46Å; H2403-Q2501 PolarHBondContact N-O 3.15Å; H2403-Q2501 PolarHBondContact O-N 3.23Å; H2444-Q2501 PolarHBondContact N-O 2.86Å; H2444-Q2501 PolarHBondContact O-N 2.89Å; W2498-Q2501 HydrophobicContact CD2-CB 4.25Å; W2498-Q2501 HydrophobicContact CE3-CB 3.75Å; W2498-Q2501 HydrophobicContact CZ3-CB 3.89Å; Q2501-T2503 PolarHBondContact NE2-OG1 2.8Å; Q2501-N2513 PolarHBondContact NE2-ND2 3.17Å; Q2501-V2514 CarbonylContact C-O 3.53Å; Q2501-V2514 VanDerWaalsContact CA-O 3.29Å; Q2501-V2514 WeakPolarHBondContact CA-O 3.37Å; Q2501-K2515 HydrophobicContact CB-CG 4.13Å; Q2501-K2515 HydrophobicContact CG-CG 3.94Å; Q2501-K2515 VanDerWaalsContact OE1-CE 3.29Å
2502	K	81.9	Confident	64.7	Low	57.8 Å²	57.8	70.4 Å²	70.4	25%	0.251	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	139	164.9	67.3	176	-179.3	-172.9	0	110.9	W2400 T2401 Y2402 N2443 Y2500 N2513 V2514	W2400-K2502 HydrophobicContact CD2-CD 4.47Å; W2400-K2502 HydrophobicContact CE3-CB 3.93Å; W2400-K2502 HydrophobicContact CE3-CD 3.72Å; W2400-K2502 HydrophobicContact CE3-CG 3.86Å; W2400-K2502 HydrophobicContact CH2-CD 4.3Å; W2400-K2502 HydrophobicContact CZ3-CB 4.22Å; W2400-K2502 HydrophobicContact CZ3-CD 3.63Å; W2400-K2502 HydrophobicContact CZ3-CG 3.69Å; T2401-K2502 CarbonylContact O-C 3.54Å; T2401-K2502 VanDerWaalsContact O-CA 3.22Å; T2401-K2502 WeakPolarHBondContact O-CA 3.3Å; T2401-K2502 WeakPolarHBondContact O-CB 3.37Å; Y2402-K2502 HydrophobicContact CD1-CB 4.01Å; Y2402-K2502 HydrophobicContact CD1-CD 4.46Å; Y2402-K2502 HydrophobicContact CE1-CB 4.11Å; Y2402-K2502 HydrophobicContact CE1-CD 4.17Å; Y2402-K2502 HydrophobicContact CE1-CG 4.34Å; Y2402-K2502 HydrophobicContact CG-CB 4.32Å; N2443-K2502 WeakPolarHBondContact OD1-CG 3.45Å; Y2500-K2502 HydrophobicContact CE1-CB 4.25Å; Y2500-K2502 HydrophobicContact CE1-CD 4.27Å; Y2500-K2502 HydrophobicContact CE1-CG 3.92Å; Y2500-K2502 VanDerWaalsContact OH-CB 3.3Å; Y2500-K2502 WeakPolarHBondContact OH-CB 3.43Å; Y2500-K2502 VanDerWaalsContact OH-CD 3.3Å; Y2500-K2502 WeakPolarHBondContact OH-CD 3.36Å; Y2500-K2502 WeakPolarHBondContact OH-CE 3.24Å; Y2500-K2502 WeakPolarHBondContact OH-CG 3.36Å; K2502-N2513 CarbonylContact O-C 3.57Å; K2502-N2513 VanDerWaalsContact O-CA 3.31Å; K2502-N2513 WeakPolarHBondContact O-CA 3.34Å; K2502-V2514 HydrophobicContact CB-CB 4.5Å; K2502-V2514 HydrophobicContact CD-CB 4.31Å; K2502-V2514 HydrophobicContact CG-CB 3.75Å; K2502-V2514 HydrophobicContact CG-CG2 4.26Å; K2502-V2514 PolarHBondContact N-O 3.1Å; K2502-V2514 PolarHBondContact O-N 3Å
2503	T	84.4	Confident	67.5	Low	17 Å²	17	64.1 Å²	64.1	10%	0.104	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	122.2	178.7	-55	0	0	0	0	109.5	W2400 T2401 F2441 K2442 Q2501 T2505 N2510 L2512 N2513 A2528	W2400-T2503 CarbonylContact C-O 3.48Å; W2400-T2503 VanDerWaalsContact CA-O 3.31Å; W2400-T2503 WeakPolarHBondContact CA-O 3.42Å; T2401-T2503 PolarHBondContact N-O 3.16Å; T2401-T2503 PolarHBondContact O-N 3.08Å; T2401-T2503 WeakPolarHBondContact OG1-CB 3.37Å; F2441-T2503 WeakPolarHBondContact CA-O 3.26Å; K2442-T2503 PolarHBondContact N-O 2.79Å; K2442-T2503 VanDerWaalsContact N-O 3.09Å; K2442-T2503 PolarHBondContact O-N 3.48Å; Q2501-T2503 PolarHBondContact NE2-OG1 2.8Å; T2503-T2505 HydrophobicContact CG2-CG2 4.09Å; T2503-T2505 PolarHBondContact O-N 2.9Å; T2503-N2510 HydrophobicContact CG2-CB 4.12Å; T2503-L2512 CarbonylContact C-O 3.48Å; T2503-L2512 VanDerWaalsContact CA-O 3.3Å; T2503-L2512 WeakPolarHBondContact CA-O 3.38Å; T2503-N2513 VanDerWaalsContact CB-OD1 3.32Å; T2503-N2513 WeakPolarHBondContact CB-OD1 3.37Å; T2503-N2513 WeakPolarHBondContact CG2-OD1 3.22Å; T2503-N2513 PolarHBondContact OG1-OD1 3.02Å; T2503-N2513 VanDerWaalsContact OG1-OD1 3.06Å; T2503-A2528 HydrophobicContact CG2-CB 4.32Å
2504	L	83.1	Confident	70.3	Confident	33.6 Å²	33.6	61 Å²	61	18%	0.176	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	121.7	169.9	177.7	63.5	0	0	0	109.4	N2398 W2400 F2440 F2441 V2506 L2511 L2512 L3377 L3381	N2398-L2504 HydrophobicContact CB-CD1 4.48Å; W2400-L2504 HydrophobicContact CD2-CB 3.97Å; W2400-L2504 HydrophobicContact CD2-CD1 4.12Å; W2400-L2504 HydrophobicContact CE3-CB 3.81Å; W2400-L2504 HydrophobicContact CG-CD1 4.32Å; W2400-L2504 HydrophobicContact CH2-CB 3.72Å; W2400-L2504 HydrophobicContact CH2-CD2 4.47Å; W2400-L2504 HydrophobicContact CZ2-CB 3.85Å; W2400-L2504 HydrophobicContact CZ2-CD1 4.26Å; W2400-L2504 HydrophobicContact CZ2-CD2 4.07Å; W2400-L2504 HydrophobicContact CZ2-CG 4.27Å; W2400-L2504 HydrophobicContact CZ3-CB 3.69Å; F2440-L2504 CarbonylContact O-C 3.57Å; F2440-L2504 VanDerWaalsContact O-CA 3.26Å; F2440-L2504 WeakPolarHBondContact O-CA 3.07Å; F2441-L2504 HydrophobicContact CE1-CB 4.45Å; F2441-L2504 HydrophobicContact CE1-CD1 4.04Å; F2441-L2504 HydrophobicContact CZ-CD1 4.12Å; L2504-V2506 HydrophobicContact CD1-CG2 4.15Å; L2504-V2506 HydrophobicContact CD2-CG2 4.25Å; L2504-V2506 HydrophobicContact CG-CG2 4.15Å; L2504-L2511 PolarHBondContact O-N 2.97Å; L2504-L2512 HydrophobicContact CB-CB 4.11Å; L2504-L2512 HydrophobicContact CD2-CB 4.43Å; L2504-L2512 PolarHBondContact N-O 3.02Å; L2504-L2512 PolarHBondContact O-N 2.83Å; L2504-L3377 HydrophobicContact CD2-CD1 3.62Å; L2504-L3381 HydrophobicContact CD1-CD1 4.5Å; L2504-L3381 HydrophobicContact CD1-CD2 3.88Å; L2504-L3381 HydrophobicContact CD1-CG 4.42Å; L2504-L3381 HydrophobicContact CD2-CD1 3.95Å; L2504-L3381 HydrophobicContact CD2-CD2 4.32Å; L2504-L3381 HydrophobicContact CD2-CG 3.97Å
2505	T	79.1	Confident	72.8	Confident	29.6 Å²	29.6	56.3 Å²	56.3	18%	0.182	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	129.9	172.6	47.3	0	0	0	0	109.5	N2398 V2399 Q2439 F2440 T2503 G2508 Q2509 N2510	N2398-T2505 CarbonylContact C-O 3.44Å; N2398-T2505 WeakPolarHBondContact CA-O 3.39Å; V2399-T2505 WeakPolarHBondContact CB-OG1 3.44Å; V2399-T2505 PolarHBondContact N-O 3.1Å; V2399-T2505 PolarHBondContact O-N 3.07Å; V2399-T2505 PolarHBondContact O-OG1 3.26Å; V2399-T2505 VanDerWaalsContact O-OG1 3.13Å; Q2439-T2505 PolarHBondContact O-OG1 2.95Å; F2440-T2505 WeakPolarHBondContact CD1-O 2.98Å; F2440-T2505 PolarHBondContact O-N 3.31Å; F2440-T2505 PolarHBondContact O-OG1 2.68Å; T2503-T2505 HydrophobicContact CG2-CG2 4.09Å; T2503-T2505 PolarHBondContact O-N 2.9Å; T2505-G2508 VanDerWaalsContact CG2-C 3.47Å; T2505-Q2509 CarbonylContact C-O 3.55Å; T2505-Q2509 VanDerWaalsContact CA-O 3.25Å; T2505-Q2509 WeakPolarHBondContact CA-O 3.33Å; T2505-N2510 HydrophobicContact CG2-CB 4.4Å; T2505-N2510 WeakPolarHBondContact CG2-OD1 3.27Å; T2505-N2510 PolarHBondContact OG1-OD1 2.93Å
2506	V	75.3	Confident	75	Confident	26 Å²	26	49.3 Å²	49.3	16%	0.158	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	124.8	176.6	179	0	0	0	0	107.8	T2397 N2398 L2504 G2508 Q2509 L2511 F3380	T2397-V2506 CarbonylContact O-C 3.59Å; T2397-V2506 VanDerWaalsContact O-CA 3.29Å; T2397-V2506 WeakPolarHBondContact O-CA 3.36Å; N2398-V2506 WeakPolarHBondContact OD1-CG1 3.4Å; N2398-V2506 WeakPolarHBondContact OD1-CG2 3.4Å; L2504-V2506 HydrophobicContact CD1-CG2 4.15Å; L2504-V2506 HydrophobicContact CD2-CG2 4.25Å; L2504-V2506 HydrophobicContact CG-CG2 4.15Å; V2506-G2508 PolarHBondContact O-N 3.07Å; V2506-G2508 VanDerWaalsContact O-N 3.13Å; V2506-Q2509 PolarHBondContact N-O 3.07Å; V2506-Q2509 WeakPolarHBondContact O-CB 3.27Å; V2506-Q2509 PolarHBondContact O-N 3Å; V2506-L2511 HydrophobicContact CB-CD1 3.7Å; V2506-L2511 HydrophobicContact CB-CG 4.32Å; V2506-L2511 HydrophobicContact CG2-CD1 3.54Å; V2506-L2511 HydrophobicContact CG2-CG 4.1Å; V2506-F3380 HydrophobicContact CG2-CB 4.28Å
2507	N	74.7	Confident	76.8	Confident	73.6 Å²	73.6	46.8 Å²	46.8	39%	0.394	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.7	38.3	-177.4	-66	-19.2	0	0	0	113.2	E2395 N2396 T2397 Q2509 L2832 N2833	E2395-N2507 PolarHBondContact O-ND2 2.83Å; N2396-N2507 WeakPolarHBondContact CA-OD1 3.45Å; T2397-N2507 PolarHBondContact N-OD1 3.14Å; T2397-N2507 PolarHBondContact O-N 3.06Å; T2397-N2507 WeakPolarHBondContact OG1-CA 3.5Å; T2397-N2507 PolarHBondContact OG1-OD1 3.1Å; T2397-N2507 VanDerWaalsContact OG1-OD1 3.1Å; N2507-Q2509 VanDerWaalsContact C-N 3.32Å; N2507-Q2509 PolarHBondContact O-N 3.23Å; N2507-L2832 PolarHBondContact ND2-O 2.97Å; N2507-N2833 PolarHBondContact ND2-OD1 3.08Å
2508	G	72.5	Confident	77.8	Confident	65.8 Å²	65.8	45.7 Å²	45.7	68%	0.678	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.2	-4.1	-180	0	0	0	0	0	115.5	Y2438 T2505 V2506	Y2438-G2508 VanDerWaalsContact CD1-N 3.35Å; T2505-G2508 VanDerWaalsContact CG2-C 3.47Å; V2506-G2508 PolarHBondContact O-N 3.07Å; V2506-G2508 VanDerWaalsContact O-N 3.13Å
2509	Q	76.1	Confident	78.7	Confident	99.6 Å²	99.6	44.5 Å²	44.5	47%	0.465	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	128.6	176.2	-79.4	-174.5	-5.1	0	0	111.2	T2505 V2506 N2507 L2511 L2875	T2505-Q2509 CarbonylContact C-O 3.55Å; T2505-Q2509 VanDerWaalsContact CA-O 3.25Å; T2505-Q2509 WeakPolarHBondContact CA-O 3.33Å; V2506-Q2509 PolarHBondContact N-O 3.07Å; V2506-Q2509 WeakPolarHBondContact O-CB 3.27Å; V2506-Q2509 PolarHBondContact O-N 3Å; N2507-Q2509 VanDerWaalsContact C-N 3.32Å; N2507-Q2509 PolarHBondContact O-N 3.23Å; Q2509-L2511 HydrophobicContact CB-CD2 4.45Å; Q2509-L2511 HydrophobicContact CG-CD2 3.9Å; Q2509-L2511 PolarHBondContact O-N 3.07Å; Q2509-L2875 VanDerWaalsContact NE2-CD1 3.29Å
2510	N	82	Confident	79.1	Confident	81.2 Å²	81.2	46.2 Å²	46.2	43%	0.434	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	118.7	174	-62.5	-11.8	0	0	0	109.6	T2503 T2505 A2528	T2503-N2510 HydrophobicContact CG2-CB 4.12Å; T2505-N2510 HydrophobicContact CG2-CB 4.4Å; T2505-N2510 WeakPolarHBondContact CG2-OD1 3.27Å; T2505-N2510 PolarHBondContact OG1-OD1 2.93Å; N2510-A2528 HydrophobicContact CB-CB 3.68Å; N2510-A2528 VanDerWaalsContact CB-CB 3.45Å
2511	L	80.1	Confident	79.5	Confident	28 Å²	28	45.8 Å²	45.8	15%	0.147	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	-50.6	-176.5	-64.4	-174.3	0	0	0	112.6	L2504 V2506 Q2509 H2527 A2528 L2875 F3375 F3380	L2504-L2511 PolarHBondContact O-N 2.97Å; V2506-L2511 HydrophobicContact CB-CD1 3.7Å; V2506-L2511 HydrophobicContact CB-CG 4.32Å; V2506-L2511 HydrophobicContact CG2-CD1 3.54Å; V2506-L2511 HydrophobicContact CG2-CG 4.1Å; Q2509-L2511 HydrophobicContact CB-CD2 4.45Å; Q2509-L2511 HydrophobicContact CG-CD2 3.9Å; Q2509-L2511 PolarHBondContact O-N 3.07Å; L2511-H2527 PolarHBondContact O-CD2 2.72Å; L2511-A2528 VanDerWaalsContact C-CB 3.48Å; L2511-A2528 PolarHBondContact O-N 2.96Å; L2511-L2875 HydrophobicContact CD2-CB 4.33Å; L2511-L2875 HydrophobicContact CD2-CD1 3.34Å; L2511-L2875 HydrophobicContact CD2-CG 3.81Å; L2511-L2875 WeakPolarHBondContact CD2-O 3.36Å; L2511-F3375 HydrophobicContact CB-CE2 4.45Å; L2511-F3375 HydrophobicContact CB-CZ 4.01Å; L2511-F3380 HydrophobicContact CD1-CB 4.08Å; L2511-F3380 HydrophobicContact CD1-CD1 3.38Å; L2511-F3380 HydrophobicContact CD1-CD2 3.94Å; L2511-F3380 HydrophobicContact CD1-CE1 3.63Å; L2511-F3380 HydrophobicContact CD1-CE2 4.16Å; L2511-F3380 HydrophobicContact CD1-CG 3.54Å; L2511-F3380 HydrophobicContact CD1-CZ 4.01Å
2512	L	85.5	Confident	79.8	Confident	25.2 Å²	25.2	45 Å²	45	13%	0.132	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	129.2	-169.6	-179.2	72.5	0	0	0	110.8	W2400 T2503 L2504 V2514 Y2525 Q2526 L2534 L3370 F3375	W2400-L2512 HydrophobicContact CH2-CD2 3.89Å; W2400-L2512 HydrophobicContact CH2-CG 4.45Å; T2503-L2512 CarbonylContact C-O 3.48Å; T2503-L2512 VanDerWaalsContact CA-O 3.3Å; T2503-L2512 WeakPolarHBondContact CA-O 3.38Å; L2504-L2512 HydrophobicContact CB-CB 4.11Å; L2504-L2512 HydrophobicContact CD2-CB 4.43Å; L2504-L2512 PolarHBondContact N-O 3.02Å; L2504-L2512 PolarHBondContact O-N 2.83Å; L2512-V2514 HydrophobicContact CD2-CG2 4.09Å; L2512-V2514 HydrophobicContact CG-CG2 4.19Å; L2512-Y2525 HydrophobicContact CD1-CD1 4.35Å; L2512-Y2525 HydrophobicContact CD2-CD1 4.13Å; L2512-Y2525 HydrophobicContact CD2-CE1 4.37Å; L2512-Y2525 HydrophobicContact CG-CD1 4.48Å; L2512-Q2526 CarbonylContact C-O 3.51Å; L2512-Q2526 WeakPolarHBondContact CA-O 3.36Å; L2512-Q2526 WeakPolarHBondContact CD1-O 3.23Å; L2512-L2534 HydrophobicContact CD1-CD1 3.85Å; L2512-L3370 HydrophobicContact CD2-CD1 3.98Å; L2512-F3375 HydrophobicContact CB-CE1 4.33Å; L2512-F3375 HydrophobicContact CB-CZ 4.15Å; L2512-F3375 HydrophobicContact CD2-CE1 4.4Å
2513	N	86.9	Confident	80.1	Confident	16 Å²	16	43.1 Å²	43.1	9%	0.086	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	133.2	167	-69.8	-16.2	0	0	0	108.7	Q2501 K2502 T2503 Y2525 Q2526 A2528	Q2501-N2513 PolarHBondContact NE2-ND2 3.17Å; K2502-N2513 CarbonylContact O-C 3.57Å; K2502-N2513 VanDerWaalsContact O-CA 3.31Å; K2502-N2513 WeakPolarHBondContact O-CA 3.34Å; T2503-N2513 VanDerWaalsContact CB-OD1 3.32Å; T2503-N2513 WeakPolarHBondContact CB-OD1 3.37Å; T2503-N2513 WeakPolarHBondContact CG2-OD1 3.22Å; T2503-N2513 PolarHBondContact OG1-OD1 3.02Å; T2503-N2513 VanDerWaalsContact OG1-OD1 3.06Å; N2513-Y2525 CarbonylContact O-C 3.44Å; N2513-Y2525 WeakPolarHBondContact O-CA 3.33Å; N2513-Q2526 HydrophobicContact CB-CB 4.29Å; N2513-Q2526 HydrophobicContact CB-CG 3.52Å; N2513-Q2526 VanDerWaalsContact CB-CG 3.48Å; N2513-Q2526 VanDerWaalsContact CB-NE2 3.31Å; N2513-Q2526 PolarHBondContact N-O 2.97Å; N2513-Q2526 PolarHBondContact ND2-NE2 2.98Å; N2513-Q2526 VanDerWaalsContact ND2-NE2 3.2Å; N2513-Q2526 WeakPolarHBondContact O-CG 3.47Å; N2513-Q2526 PolarHBondContact O-N 3.15Å; N2513-Q2526 VanDerWaalsContact O-O 3.07Å; N2513-A2528 HydrophobicContact CB-CB 4.41Å; N2513-A2528 WeakPolarHBondContact ND2-CA 3.45Å; N2513-A2528 VanDerWaalsContact OD1-CB 3.29Å; N2513-A2528 WeakPolarHBondContact OD1-CB 3.41Å
2514	V	87.3	Confident	80.3	Confident	11.8 Å²	11.8	43 Å²	43	7%	0.072	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	117.8	171.3	-173.1	0	0	0	0	107.3	W2400 Q2501 K2502 L2512 E2523 T2524 Y2525	W2400-V2514 HydrophobicContact CH2-CG2 4.16Å; W2400-V2514 HydrophobicContact CZ3-CG2 4.14Å; Q2501-V2514 CarbonylContact C-O 3.53Å; Q2501-V2514 VanDerWaalsContact CA-O 3.29Å; Q2501-V2514 WeakPolarHBondContact CA-O 3.37Å; K2502-V2514 HydrophobicContact CB-CB 4.5Å; K2502-V2514 HydrophobicContact CD-CB 4.31Å; K2502-V2514 HydrophobicContact CG-CB 3.75Å; K2502-V2514 HydrophobicContact CG-CG2 4.26Å; K2502-V2514 PolarHBondContact N-O 3.1Å; K2502-V2514 PolarHBondContact O-N 3Å; L2512-V2514 HydrophobicContact CD2-CG2 4.09Å; L2512-V2514 HydrophobicContact CG-CG2 4.19Å; V2514-E2523 HydrophobicContact CG1-CG 3.76Å; V2514-E2523 VanDerWaalsContact CG1-OE1 3.29Å; V2514-E2523 WeakPolarHBondContact CG1-OE1 3.34Å; V2514-T2524 CarbonylContact C-O 3.41Å; V2514-T2524 WeakPolarHBondContact CA-O 3.31Å; V2514-Y2525 HydrophobicContact CB-CD1 4.41Å; V2514-Y2525 HydrophobicContact CB-CE1 4.3Å; V2514-Y2525 HydrophobicContact CG1-CD1 4.28Å; V2514-Y2525 HydrophobicContact CG1-CD2 4.3Å; V2514-Y2525 HydrophobicContact CG1-CE1 4.05Å; V2514-Y2525 HydrophobicContact CG1-CE2 4.17Å; V2514-Y2525 HydrophobicContact CG1-CG 4.38Å; V2514-Y2525 HydrophobicContact CG2-CD1 3.66Å; V2514-Y2525 HydrophobicContact CG2-CE1 3.64Å; V2514-Y2525 HydrophobicContact CG2-CG 4.31Å
2515	K	85.3	Confident	80.6	Confident	58 Å²	58	43.4 Å²	43.4	25%	0.252	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	139.3	178.6	-67.1	-178.8	172.9	179	0	109.6	W2498 Y2500 Q2501 E2523 T2524	W2498-K2515 HydrophobicContact CB-CB 4.13Å; W2498-K2515 HydrophobicContact CB-CD 4.21Å; W2498-K2515 HydrophobicContact CB-CG 4.48Å; W2498-K2515 HydrophobicContact CG-CD 3.99Å; Y2500-K2515 CarbonylContact O-C 3.55Å; Y2500-K2515 VanDerWaalsContact O-CA 3.24Å; Y2500-K2515 WeakPolarHBondContact O-CA 3.31Å; Q2501-K2515 HydrophobicContact CB-CG 4.13Å; Q2501-K2515 HydrophobicContact CG-CG 3.94Å; Q2501-K2515 VanDerWaalsContact OE1-CE 3.29Å; K2515-E2523 CarbonylContact O-C 3.56Å; K2515-E2523 VanDerWaalsContact O-CA 3.29Å; K2515-E2523 WeakPolarHBondContact O-CA 3.29Å; K2515-T2524 PolarHBondContact N-O 3.01Å; K2515-T2524 PolarHBondContact O-N 3.07Å
2516	F	82	Confident	81	Confident	14 Å²	14	43 Å²	43	6%	0.061	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	123.1	170.9	-167.4	-93.5	0	0	0	109.7	M2175 H2499 Y2500 W2518 L2522 E2523 Y2539 F2543	M2175-F2516 HydrophobicContact CE-CD1 3.77Å; M2175-F2516 HydrophobicContact CE-CE1 3.2Å; M2175-F2516 HydrophobicContact CE-CE2 4.15Å; M2175-F2516 HydrophobicContact CE-CG 4.48Å; M2175-F2516 HydrophobicContact CE-CZ 3.44Å; M2175-F2516 VanDerWaalsContact CE-CZ 3.44Å; M2175-F2516 HydrophobicContact SD-CE1 3.98Å; M2175-F2516 HydrophobicContact SD-CZ 4.3Å; H2499-F2516 PolarHBondContact N-O 2.97Å; Y2500-F2516 HydrophobicContact CD1-CB 3.93Å; Y2500-F2516 HydrophobicContact CG-CB 4.4Å; Y2500-F2516 PolarHBondContact N-O 2.97Å; Y2500-F2516 VanDerWaalsContact N-O 3.15Å; Y2500-F2516 PolarHBondContact O-N 3.02Å; F2516-W2518 HydrophobicContact CD1-CB 4.35Å; F2516-W2518 AromaticContact CD1-CD1 3.53Å; F2516-W2518 AromaticContact CD1-CD2 3.63Å; F2516-W2518 HydrophobicContact CD1-CD2 3.88Å; F2516-W2518 VanDerWaalsContact CD1-CD2 3.43Å; F2516-W2518 AromaticContact CD1-CE2 3.57Å; F2516-W2518 VanDerWaalsContact CD1-CE2 3.42Å; F2516-W2518 HydrophobicContact CD1-CE3 4.35Å; F2516-W2518 AromaticContact CD1-CG 3.72Å; F2516-W2518 HydrophobicContact CD1-CG 4.02Å; F2516-W2518 VanDerWaalsContact CD1-CG 3.5Å; F2516-W2518 HydrophobicContact CD1-CZ2 4.23Å; F2516-W2518 AromaticContact CD1-NE1 3.73Å; F2516-W2518 HydrophobicContact CE1-CB 4.3Å; F2516-W2518 AromaticContact CE1-CD1 3.56Å; F2516-W2518 VanDerWaalsContact CE1-CD1 3.45Å; F2516-W2518 AromaticContact CE1-CD2 3.55Å; F2516-W2518 HydrophobicContact CE1-CD2 3.55Å; F2516-W2518 AromaticContact CE1-CE2 3.78Å; F2516-W2518 AromaticContact CE1-CE3 3.69Å; F2516-W2518 HydrophobicContact CE1-CE3 3.94Å; F2516-W2518 AromaticContact CE1-CG 3.76Å; F2516-W2518 HydrophobicContact CE1-CG 4Å; F2516-W2518 HydrophobicContact CE1-CH2 4.39Å; F2516-W2518 HydrophobicContact CE1-CZ2 4.28Å; F2516-W2518 HydrophobicContact CE1-CZ3 4.22Å; F2516-W2518 AromaticContact CE1-NE1 3.77Å; F2516-W2518 HydrophobicContact CZ-CD2 4.48Å; F2516-L2522 WeakPolarHBondContact CA-O 3.31Å; F2516-E2523 HydrophobicContact CD2-CB 3.8Å; F2516-E2523 HydrophobicContact CD2-CG 4.16Å; F2516-E2523 HydrophobicContact CE2-CB 4.17Å; F2516-Y2539 AromaticContact CE2-CD2 3.89Å; F2516-Y2539 HydrophobicContact CE2-CD2 3.95Å; F2516-Y2539 AromaticContact CE2-CE2 3.86Å; F2516-Y2539 HydrophobicContact CE2-CE2 4.02Å; F2516-Y2539 HydrophobicContact CZ-CD2 4.4Å; F2516-F2543 HydrophobicContact CE1-CE1 4.28Å; F2516-F2543 AromaticContact CE2-CE2 3.69Å; F2516-F2543 HydrophobicContact CE2-CE2 3.69Å; F2516-F2543 AromaticContact CE2-CZ 3.91Å; F2516-F2543 HydrophobicContact CE2-CZ 3.91Å; F2516-F2543 HydrophobicContact CZ-CD1 4.23Å; F2516-F2543 AromaticContact CZ-CE1 3.86Å; F2516-F2543 HydrophobicContact CZ-CE1 3.86Å; F2516-F2543 AromaticContact CZ-CE2 3.57Å; F2516-F2543 HydrophobicContact CZ-CE2 3.57Å; F2516-F2543 HydrophobicContact CZ-CZ 4.23Å
2517	N	79.2	Confident	81.2	Confident	15.6 Å²	15.6	42.3 Å²	42.3	8%	0.083	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	114	170.9	180	-40.6	0	0	0	108.2	V2496 D2497 H2499 A2519 L2520 Q2521 L2522	V2496-N2517 HydrophobicContact CG1-CB 4.4Å; V2496-N2517 WeakPolarHBondContact CG1-ND2 3.35Å; D2497-N2517 PolarHBondContact O-ND2 3.36Å; H2499-N2517 PolarHBondContact CD2-ND2 2.79Å; H2499-N2517 PolarHBondContact CE1-ND2 3.06Å; H2499-N2517 PolarHBondContact NE2-ND2 3.06Å; N2517-A2519 WeakPolarHBondContact OD1-CB 3.31Å; N2517-A2519 PolarHBondContact OD1-N 2.99Å; N2517-L2520 HydrophobicContact CB-CB 4.28Å; N2517-L2520 HydrophobicContact CB-CD1 4.25Å; N2517-L2520 HydrophobicContact CB-CG 4.34Å; N2517-L2520 WeakPolarHBondContact ND2-CD1 3.24Å; N2517-L2520 PolarHBondContact O-N 2.78Å; N2517-L2520 WeakPolarHBondContact OD1-CG 3.38Å; N2517-L2520 PolarHBondContact OD1-N 2.96Å; N2517-Q2521 WeakPolarHBondContact O-CA 3.35Å; N2517-Q2521 PolarHBondContact O-N 3.17Å; N2517-L2522 PolarHBondContact N-O 3.12Å; N2517-L2522 PolarHBondContact O-N 3.05Å; N2517-L2522 VanDerWaalsContact O-N 3.11Å
2518	W	69.4	Low	81.5	Confident	63 Å²	63	39.7 Å²	39.7	24%	0.239	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-40	-177.8	-72.9	46.9	0	0	0	113.2	D2017 D2018 T2173 Q2174 M2175 L2404 N2409 W2498 H2499 Y2500 F2516 L2520 Q2521 F2543	D2017-W2518 VanDerWaalsContact C-CZ3 3.47Å; D2017-W2518 HydrophobicContact CB-CB 4.18Å; D2017-W2518 HydrophobicContact CB-CD2 2.96Å; D2017-W2518 HydrophobicContact CB-CE3 3.24Å; D2017-W2518 HydrophobicContact CB-CG 3.38Å; D2017-W2518 HydrophobicContact CB-CH2 3.58Å; D2017-W2518 HydrophobicContact CB-CZ2 3.36Å; D2017-W2518 HydrophobicContact CB-CZ3 3.53Å; D2017-W2518 VanDerWaalsContact CG-CD2 3.48Å; D2017-W2518 WeakPolarHBondContact O-CZ3 3.5Å; D2017-W2518 VanDerWaalsContact OD1-CD1 3.24Å; D2017-W2518 PolarHBondContact OD2-NE1 2.91Å; D2018-W2518 WeakPolarHBondContact OD1-CZ3 3.41Å; T2173-W2518 HydrophobicContact CG2-CH2 3.45Å; T2173-W2518 VanDerWaalsContact CG2-CH2 3.45Å; T2173-W2518 HydrophobicContact CG2-CZ2 3.72Å; T2173-W2518 WeakPolarHBondContact O-CZ2 3.3Å; T2173-W2518 PolarHBondContact O-NE1 2.92Å; Q2174-W2518 HydrophobicContact CB-CH2 3.89Å; Q2174-W2518 HydrophobicContact CB-CZ2 3.7Å; Q2174-W2518 HydrophobicContact CG-CH2 4.42Å; Q2174-W2518 HydrophobicContact CG-CZ2 4.27Å; M2175-W2518 HydrophobicContact CE-CH2 3.93Å; M2175-W2518 HydrophobicContact CE-CZ3 3.63Å; L2404-W2518 HydrophobicContact CD2-CH2 4.32Å; L2404-W2518 HydrophobicContact CD2-CZ2 4.3Å; N2409-W2518 WeakPolarHBondContact OD1-CZ3 3.3Å; W2498-W2518 HydrophobicContact CB-CB 4.41Å; W2498-W2518 PolarHBondContact O-N 3.03Å; H2499-W2518 HydrophobicContact CB-CD2 3.68Å; H2499-W2518 HydrophobicContact CB-CE3 3.95Å; H2499-W2518 HydrophobicContact CB-CG 4.03Å; H2499-W2518 HydrophobicContact CB-CH2 4.48Å; H2499-W2518 HydrophobicContact CB-CZ2 4.3Å; H2499-W2518 HydrophobicContact CB-CZ3 4.4Å; H2499-W2518 AromaticContact CD2-CD2 3.72Å; H2499-W2518 AromaticContact CD2-CE3 3.24Å; H2499-W2518 AromaticContact CD2-CZ3 3.89Å; H2499-W2518 AromaticContact CG-CD2 3.83Å; H2499-W2518 AromaticContact CG-CE3 3.82Å; H2499-W2518 AromaticContact CG-CG 3.97Å; H2499-W2518 PolarHBondContact ND1-N 3.13Å; Y2500-W2518 AromaticContact CD2-CD1 3.42Å; Y2500-W2518 VanDerWaalsContact CD2-CD1 3.42Å; Y2500-W2518 AromaticContact CD2-NE1 3.13Å; Y2500-W2518 AromaticContact CE2-CD1 3.48Å; Y2500-W2518 VanDerWaalsContact CE2-CD1 3.48Å; Y2500-W2518 AromaticContact CE2-NE1 3.02Å; F2516-W2518 HydrophobicContact CD1-CB 4.35Å; F2516-W2518 AromaticContact CD1-CD1 3.53Å; F2516-W2518 AromaticContact CD1-CD2 3.63Å; F2516-W2518 HydrophobicContact CD1-CD2 3.88Å; F2516-W2518 VanDerWaalsContact CD1-CD2 3.43Å; F2516-W2518 AromaticContact CD1-CE2 3.57Å; F2516-W2518 VanDerWaalsContact CD1-CE2 3.42Å; F2516-W2518 HydrophobicContact CD1-CE3 4.35Å; F2516-W2518 AromaticContact CD1-CG 3.72Å; F2516-W2518 HydrophobicContact CD1-CG 4.02Å; F2516-W2518 VanDerWaalsContact CD1-CG 3.5Å; F2516-W2518 HydrophobicContact CD1-CZ2 4.23Å; F2516-W2518 AromaticContact CD1-NE1 3.73Å; F2516-W2518 HydrophobicContact CE1-CB 4.3Å; F2516-W2518 AromaticContact CE1-CD1 3.56Å; F2516-W2518 VanDerWaalsContact CE1-CD1 3.45Å; F2516-W2518 AromaticContact CE1-CD2 3.55Å; F2516-W2518 HydrophobicContact CE1-CD2 3.55Å; F2516-W2518 AromaticContact CE1-CE2 3.78Å; F2516-W2518 AromaticContact CE1-CE3 3.69Å; F2516-W2518 HydrophobicContact CE1-CE3 3.94Å; F2516-W2518 AromaticContact CE1-CG 3.76Å; F2516-W2518 HydrophobicContact CE1-CG 4Å; F2516-W2518 HydrophobicContact CE1-CH2 4.39Å; F2516-W2518 HydrophobicContact CE1-CZ2 4.28Å; F2516-W2518 HydrophobicContact CE1-CZ3 4.22Å; F2516-W2518 AromaticContact CE1-NE1 3.77Å; F2516-W2518 HydrophobicContact CZ-CD2 4.48Å; W2518-L2520 VanDerWaalsContact C-N 3.27Å; W2518-L2520 PolarHBondContact O-N 2.87Å; W2518-Q2521 WeakPolarHBondContact O-CG 3.28Å; W2518-Q2521 PolarHBondContact O-N 3.08Å; W2518-Q2521 VanDerWaalsContact O-N 3.15Å; W2518-F2543 HydrophobicContact CE3-CE1 4.24Å; W2518-F2543 HydrophobicContact CE3-CZ 4.12Å; W2518-F2543 HydrophobicContact CH2-CZ 4.2Å; W2518-F2543 AromaticContact CZ3-CE1 3.96Å; W2518-F2543 HydrophobicContact CZ3-CE1 4.14Å; W2518-F2543 AromaticContact CZ3-CZ 3.73Å; W2518-F2543 HydrophobicContact CZ3-CZ 3.73Å
2519	A	70.2	Confident	81.6	Confident	67.2 Å²	67.2	40.4 Å²	40.4	56%	0.555	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64	-36.4	-179.3	0	0	0	0	0	111.9	N2517	N2517-A2519 WeakPolarHBondContact OD1-CB 3.31Å; N2517-A2519 PolarHBondContact OD1-N 2.99Å
2520	L	74.1	Confident	81.6	Confident	97.8 Å²	97.8	39 Å²	39	51%	0.512	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-6.7	178.4	-61.2	179.7	0	0	0	113.6	N2517 W2518 L2522	N2517-L2520 HydrophobicContact CB-CB 4.28Å; N2517-L2520 HydrophobicContact CB-CD1 4.25Å; N2517-L2520 HydrophobicContact CB-CG 4.34Å; N2517-L2520 WeakPolarHBondContact ND2-CD1 3.24Å; N2517-L2520 PolarHBondContact O-N 2.78Å; N2517-L2520 WeakPolarHBondContact OD1-CG 3.38Å; N2517-L2520 PolarHBondContact OD1-N 2.96Å; W2518-L2520 VanDerWaalsContact C-N 3.27Å; W2518-L2520 PolarHBondContact O-N 2.87Å; L2520-L2522 HydrophobicContact CB-CB 3.79Å; L2520-L2522 HydrophobicContact CD1-CD2 4.33Å; L2520-L2522 PolarHBondContact O-N 2.97Å; L2520-L2522 VanDerWaalsContact O-N 3.14Å
2521	Q	80.1	Confident	81.4	Confident	36.8 Å²	36.8	36.8 Å²	36.8	17%	0.172	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	46	45.4	-169.7	-63.2	-178	-24	0	0	111.5	N2517 W2518 Y2539 N2540 F2543	N2517-Q2521 WeakPolarHBondContact O-CA 3.35Å; N2517-Q2521 PolarHBondContact O-N 3.17Å; W2518-Q2521 WeakPolarHBondContact O-CG 3.28Å; W2518-Q2521 PolarHBondContact O-N 3.08Å; W2518-Q2521 VanDerWaalsContact O-N 3.15Å; Q2521-Y2539 WeakPolarHBondContact O-CD2 3.41Å; Q2521-Y2539 PolarHBondContact O-N 2.95Å; Q2521-Y2539 PolarHBondContact OE1-O 3.07Å; Q2521-N2540 PolarHBondContact NE2-O 2.99Å; Q2521-N2540 PolarHBondContact OE1-O 3.26Å; Q2521-N2540 VanDerWaalsContact OE1-O 3.08Å; Q2521-F2543 HydrophobicContact CG-CE1 4.38Å
2522	L	86.2	Confident	81.2	Confident	27.2 Å²	27.2	38.7 Å²	38.7	14%	0.142	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	118.8	-169.9	174.5	67.9	0	0	0	109.9	F2516 N2517 L2520 Q2536 I2537 V2538	F2516-L2522 WeakPolarHBondContact CA-O 3.31Å; N2517-L2522 PolarHBondContact N-O 3.12Å; N2517-L2522 PolarHBondContact O-N 3.05Å; N2517-L2522 VanDerWaalsContact O-N 3.11Å; L2520-L2522 HydrophobicContact CB-CB 3.79Å; L2520-L2522 HydrophobicContact CD1-CD2 4.33Å; L2520-L2522 PolarHBondContact O-N 2.97Å; L2520-L2522 VanDerWaalsContact O-N 3.14Å; L2522-Q2536 HydrophobicContact CD1-CB 3.99Å; L2522-Q2536 HydrophobicContact CD1-CG 4.23Å; L2522-I2537 WeakPolarHBondContact CA-O 3.3Å; L2522-V2538 HydrophobicContact CD1-CG2 3.9Å
2523	E	87.8	Confident	81.1	Confident	18.8 Å²	18.8	39.7 Å²	39.7	9%	0.088	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	130.8	168.2	-166.9	175.2	-169.1	0	0	109.9	V2514 K2515 F2516 Y2525 Q2536 I2537 Y2539	V2514-E2523 HydrophobicContact CG1-CG 3.76Å; V2514-E2523 VanDerWaalsContact CG1-OE1 3.29Å; V2514-E2523 WeakPolarHBondContact CG1-OE1 3.34Å; K2515-E2523 CarbonylContact O-C 3.56Å; K2515-E2523 VanDerWaalsContact O-CA 3.29Å; K2515-E2523 WeakPolarHBondContact O-CA 3.29Å; F2516-E2523 HydrophobicContact CD2-CB 3.8Å; F2516-E2523 HydrophobicContact CD2-CG 4.16Å; F2516-E2523 HydrophobicContact CE2-CB 4.17Å; E2523-Y2525 VanDerWaalsContact CD-CE2 3.46Å; E2523-Y2525 HydrophobicContact CG-CD2 4.36Å; E2523-Y2525 HydrophobicContact CG-CE2 3.73Å; E2523-Y2525 WeakPolarHBondContact OE1-CE2 3.33Å; E2523-Y2525 PolarHBondContact OE1-OH 3Å; E2523-Y2525 WeakPolarHBondContact OE2-CE2 3.3Å; E2523-Y2525 PolarHBondContact OE2-OH 3.08Å; E2523-Y2525 VanDerWaalsContact OE2-OH 3.1Å; E2523-Q2536 CarbonylContact O-C 3.52Å; E2523-Q2536 VanDerWaalsContact O-CA 3.28Å; E2523-Q2536 WeakPolarHBondContact O-CA 3.45Å; E2523-I2537 HydrophobicContact CB-CB 4.3Å; E2523-I2537 PolarHBondContact N-O 2.92Å; E2523-I2537 PolarHBondContact O-N 2.87Å; E2523-Y2539 HydrophobicContact CB-CE2 3.77Å; E2523-Y2539 WeakPolarHBondContact OE2-CE2 3.34Å; E2523-Y2539 PolarHBondContact OE2-OH 3.13Å
2524	T	88.6	Confident	80.9	Confident	14.8 Å²	14.8	40.7 Å²	40.7	9%	0.091	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	114.8	-178.5	-59.2	0	0	0	0	109.5	V2514 K2515 Q2526 V2533 L2535 Q2536	V2514-T2524 CarbonylContact C-O 3.41Å; V2514-T2524 WeakPolarHBondContact CA-O 3.31Å; K2515-T2524 PolarHBondContact N-O 3.01Å; K2515-T2524 PolarHBondContact O-N 3.07Å; T2524-Q2526 HydrophobicContact CG2-CG 3.8Å; T2524-V2533 HydrophobicContact CG2-CB 4.37Å; T2524-V2533 HydrophobicContact CG2-CG1 3.84Å; T2524-V2533 HydrophobicContact CG2-CG2 3.79Å; T2524-L2535 CarbonylContact C-O 3.55Å; T2524-L2535 WeakPolarHBondContact CA-O 3.33Å; T2524-Q2536 HydrophobicContact CG2-CG 4.03Å; T2524-Q2536 PolarHBondContact OG1-NE2 3.27Å
2525	Y	89.5	Confident	81	Confident	42.4 Å²	42.4	41.5 Å²	41.5	17%	0.166	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	125.8	169.1	-66.8	-103	0	0	0	108	L2512 N2513 V2514 E2523 V2533 L2534 L2535 I2537 P3366 L3370	L2512-Y2525 HydrophobicContact CD1-CD1 4.35Å; L2512-Y2525 HydrophobicContact CD2-CD1 4.13Å; L2512-Y2525 HydrophobicContact CD2-CE1 4.37Å; L2512-Y2525 HydrophobicContact CG-CD1 4.48Å; N2513-Y2525 CarbonylContact O-C 3.44Å; N2513-Y2525 WeakPolarHBondContact O-CA 3.33Å; V2514-Y2525 HydrophobicContact CB-CD1 4.41Å; V2514-Y2525 HydrophobicContact CB-CE1 4.3Å; V2514-Y2525 HydrophobicContact CG1-CD1 4.28Å; V2514-Y2525 HydrophobicContact CG1-CD2 4.3Å; V2514-Y2525 HydrophobicContact CG1-CE1 4.05Å; V2514-Y2525 HydrophobicContact CG1-CE2 4.17Å; V2514-Y2525 HydrophobicContact CG1-CG 4.38Å; V2514-Y2525 HydrophobicContact CG2-CD1 3.66Å; V2514-Y2525 HydrophobicContact CG2-CE1 3.64Å; V2514-Y2525 HydrophobicContact CG2-CG 4.31Å; E2523-Y2525 VanDerWaalsContact CD-CE2 3.46Å; E2523-Y2525 HydrophobicContact CG-CD2 4.36Å; E2523-Y2525 HydrophobicContact CG-CE2 3.73Å; E2523-Y2525 WeakPolarHBondContact OE1-CE2 3.33Å; E2523-Y2525 PolarHBondContact OE1-OH 3Å; E2523-Y2525 WeakPolarHBondContact OE2-CE2 3.3Å; E2523-Y2525 PolarHBondContact OE2-OH 3.08Å; E2523-Y2525 VanDerWaalsContact OE2-OH 3.1Å; Y2525-V2533 CarbonylContact O-C 3.5Å; Y2525-V2533 WeakPolarHBondContact O-CA 3.2Å; Y2525-L2534 PolarHBondContact O-N 3Å; Y2525-L2535 HydrophobicContact CD2-CB 4.21Å; Y2525-L2535 HydrophobicContact CD2-CD2 4.08Å; Y2525-L2535 HydrophobicContact CD2-CG 4.24Å; Y2525-L2535 HydrophobicContact CE2-CD2 4.25Å; Y2525-L2535 HydrophobicContact CE2-CG 4.48Å; Y2525-L2535 HydrophobicContact CG-CB 4.36Å; Y2525-L2535 HydrophobicContact CG-CD2 4.45Å; Y2525-L2535 PolarHBondContact N-O 2.98Å; Y2525-L2535 PolarHBondContact O-N 2.89Å; Y2525-I2537 HydrophobicContact CD2-CD1 4.49Å; Y2525-I2537 HydrophobicContact CE2-CD1 3.86Å; Y2525-I2537 HydrophobicContact CE2-CG1 4.3Å; Y2525-P3366 HydrophobicContact CE1-CB 4.33Å; Y2525-P3366 HydrophobicContact CE2-CB 4.2Å; Y2525-L3370 HydrophobicContact CD1-CD1 4.35Å; Y2525-L3370 HydrophobicContact CG-CD2 4.45Å
2526	Q	87.4	Confident	81.2	Confident	20 Å²	20	41.4 Å²	41.4	9%	0.093	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	146.3	-179.2	53.8	179.6	15.1	0	0	110	L2512 N2513 T2524 A2528 G2531 H2532 V2533	L2512-Q2526 CarbonylContact C-O 3.51Å; L2512-Q2526 WeakPolarHBondContact CA-O 3.36Å; L2512-Q2526 WeakPolarHBondContact CD1-O 3.23Å; N2513-Q2526 HydrophobicContact CB-CB 4.29Å; N2513-Q2526 HydrophobicContact CB-CG 3.52Å; N2513-Q2526 VanDerWaalsContact CB-CG 3.48Å; N2513-Q2526 VanDerWaalsContact CB-NE2 3.31Å; N2513-Q2526 PolarHBondContact N-O 2.97Å; N2513-Q2526 PolarHBondContact ND2-NE2 2.98Å; N2513-Q2526 VanDerWaalsContact ND2-NE2 3.2Å; N2513-Q2526 WeakPolarHBondContact O-CG 3.47Å; N2513-Q2526 PolarHBondContact O-N 3.15Å; N2513-Q2526 VanDerWaalsContact O-O 3.07Å; T2524-Q2526 HydrophobicContact CG2-CG 3.8Å; Q2526-A2528 PolarHBondContact O-N 3.05Å; Q2526-G2531 PolarHBondContact OE1-O 2.82Å; Q2526-H2532 CarbonylContact C-O 3.51Å; Q2526-H2532 WeakPolarHBondContact CA-O 3.33Å; Q2526-H2532 VanDerWaalsContact CB-O 3.3Å; Q2526-H2532 WeakPolarHBondContact CB-O 3.28Å; Q2526-V2533 HydrophobicContact CB-CG2 4.45Å; Q2526-V2533 HydrophobicContact CG-CG2 4.44Å
2527	H	80.9	Confident	81.6	Confident	12 Å²	12	41.1 Å²	41.1	6%	0.056	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	129.2	172.4	-169.2	-86.5	0	0	0	109.9	L2511 S2529 T2530 G2531 H2532 L2534 Y2554 L2875	L2511-H2527 PolarHBondContact O-CD2 2.72Å; H2527-S2529 PolarHBondContact CE1-OG 3.08Å; H2527-S2529 PolarHBondContact ND1-N 2.78Å; H2527-S2529 PolarHBondContact ND1-OG 2.96Å; H2527-S2529 VanDerWaalsContact ND1-OG 3.11Å; H2527-S2529 PolarHBondContact O-N 2.98Å; H2527-T2530 VanDerWaalsContact CB-OG1 3.32Å; H2527-T2530 WeakPolarHBondContact CB-OG1 3.25Å; H2527-T2530 PolarHBondContact ND1-N 3.38Å; H2527-T2530 PolarHBondContact ND1-OG1 2.95Å; H2527-T2530 PolarHBondContact O-N 3.16Å; H2527-G2531 VanDerWaalsContact O-CA 3.27Å; H2527-G2531 WeakPolarHBondContact O-CA 3.38Å; H2527-G2531 PolarHBondContact O-N 2.97Å; H2527-H2532 HydrophobicContact CB-CB 4.49Å; H2527-H2532 PolarHBondContact N-O 2.89Å; H2527-L2534 HydrophobicContact CB-CD1 4.43Å; H2527-L2534 HydrophobicContact CB-CD2 4.42Å; H2527-Y2554 HydrophobicContact CB-CD2 4.06Å; H2527-Y2554 HydrophobicContact CB-CE2 3.8Å; H2527-Y2554 AromaticContact CD2-CD2 3.82Å; H2527-Y2554 AromaticContact CD2-CE1 3.44Å; H2527-Y2554 VanDerWaalsContact CD2-CE1 3.44Å; H2527-Y2554 WeakPolarHBondContact CD2-CE1 3.07Å; H2527-Y2554 AromaticContact CD2-CE2 3.34Å; H2527-Y2554 WeakPolarHBondContact CD2-CE2 3.35Å; H2527-Y2554 AromaticContact CD2-CZ 3.47Å; H2527-Y2554 VanDerWaalsContact CD2-CZ 3.47Å; H2527-Y2554 PolarHBondContact CD2-OH 3.06Å; H2527-Y2554 AromaticContact CE1-CE2 3.92Å; H2527-Y2554 AromaticContact CE1-CZ 3.84Å; H2527-Y2554 PolarHBondContact CE1-OH 2.88Å; H2527-Y2554 VanDerWaalsContact CE1-OH 3.27Å; H2527-Y2554 AromaticContact CG-CD2 3.73Å; H2527-Y2554 AromaticContact CG-CE2 3.49Å; H2527-Y2554 VanDerWaalsContact CG-CE2 3.44Å; H2527-Y2554 AromaticContact CG-CZ 3.64Å; H2527-Y2554 VanDerWaalsContact CG-OH 3.32Å; H2527-Y2554 AromaticContact ND1-CE2 3.73Å; H2527-Y2554 AromaticContact ND1-CZ 3.91Å; H2527-Y2554 PolarHBondContact ND1-OH 3.34Å; H2527-Y2554 AromaticContact NE2-CE1 3.6Å; H2527-Y2554 AromaticContact NE2-CE2 3.78Å; H2527-Y2554 AromaticContact NE2-CZ 3.65Å; H2527-Y2554 PolarHBondContact NE2-OH 3.05Å; H2527-L2875 WeakPolarHBondContact CE1-CD2 3.36Å; H2527-L2875 WeakPolarHBondContact NE2-CD2 3.36Å
2528	A	79.9	Confident	82	Confident	17.6 Å²	17.6	42.1 Å²	42.1	15%	0.145	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-34	-167.7	0	0	0	0	0	113.8	T2503 N2510 L2511 N2513 Q2526	T2503-A2528 HydrophobicContact CG2-CB 4.32Å; N2510-A2528 HydrophobicContact CB-CB 3.68Å; N2510-A2528 VanDerWaalsContact CB-CB 3.45Å; L2511-A2528 VanDerWaalsContact C-CB 3.48Å; L2511-A2528 PolarHBondContact O-N 2.96Å; N2513-A2528 HydrophobicContact CB-CB 4.41Å; N2513-A2528 WeakPolarHBondContact ND2-CA 3.45Å; N2513-A2528 VanDerWaalsContact OD1-CB 3.29Å; N2513-A2528 WeakPolarHBondContact OD1-CB 3.41Å; Q2526-A2528 PolarHBondContact O-N 3.05Å
2529	S	76.1	Confident	82.7	Confident	81 Å²	81	40.7 Å²	40.7	57%	0.566	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-29.1	-179.8	65.3	0	0	0	0	114.3	H2527	H2527-S2529 PolarHBondContact CE1-OG 3.08Å; H2527-S2529 PolarHBondContact ND1-N 2.78Å; H2527-S2529 PolarHBondContact ND1-OG 2.96Å; H2527-S2529 VanDerWaalsContact ND1-OG 3.11Å; H2527-S2529 PolarHBondContact O-N 2.98Å
2530	T	75.4	Confident	83.1	Confident	69.6 Å²	69.6	38.5 Å²	38.5	43%	0.427	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.3	-14.6	-175.7	59.8	0	0	0	0	113.1	H2527 H2532 Y2554 S2557	H2527-T2530 VanDerWaalsContact CB-OG1 3.32Å; H2527-T2530 WeakPolarHBondContact CB-OG1 3.25Å; H2527-T2530 PolarHBondContact ND1-N 3.38Å; H2527-T2530 PolarHBondContact ND1-OG1 2.95Å; H2527-T2530 PolarHBondContact O-N 3.16Å; T2530-H2532 VanDerWaalsContact CB-CD2 3.41Å; T2530-H2532 WeakPolarHBondContact CB-CD2 3.08Å; T2530-H2532 PolarHBondContact O-N 3.23Å; T2530-H2532 VanDerWaalsContact O-N 3.16Å; T2530-H2532 WeakPolarHBondContact OG1-CB 3.4Å; T2530-H2532 PolarHBondContact OG1-CD2 2.82Å; T2530-H2532 PolarHBondContact OG1-N 3.16Å; T2530-Y2554 HydrophobicContact CG2-CE2 3.95Å; T2530-Y2554 WeakPolarHBondContact CG2-OH 3.33Å; T2530-Y2554 WeakPolarHBondContact OG1-CE2 3.33Å; T2530-Y2554 PolarHBondContact OG1-OH 2.81Å; T2530-S2557 WeakPolarHBondContact CG2-OG 3.1Å
2531	G	77.5	Confident	83.1	Confident	37 Å²	37	36 Å²	36	38%	0.381	21%	0.209	S	C	.	.			trans	70.8	3.1	-174.7	0	0	0	0	0	114.3	Q2526 H2527 V2533	Q2526-G2531 PolarHBondContact OE1-O 2.82Å; H2527-G2531 VanDerWaalsContact O-CA 3.27Å; H2527-G2531 WeakPolarHBondContact O-CA 3.38Å; H2527-G2531 PolarHBondContact O-N 2.97Å; G2531-V2533 PolarHBondContact O-N 2.92Å
2532	H	76.5	Confident	82.7	Confident	66.4 Å²	66.4	37.7 Å²	37.7	31%	0.307	22%	0.22	S	C	.	.			trans	-67	124.7	-177.7	-141.1	-73.9	0	0	0	111.4	Q2526 H2527 T2530 L2534 S2551 N2553 Y2554	Q2526-H2532 CarbonylContact C-O 3.51Å; Q2526-H2532 WeakPolarHBondContact CA-O 3.33Å; Q2526-H2532 VanDerWaalsContact CB-O 3.3Å; Q2526-H2532 WeakPolarHBondContact CB-O 3.28Å; H2527-H2532 HydrophobicContact CB-CB 4.49Å; H2527-H2532 PolarHBondContact N-O 2.89Å; T2530-H2532 VanDerWaalsContact CB-CD2 3.41Å; T2530-H2532 WeakPolarHBondContact CB-CD2 3.08Å; T2530-H2532 PolarHBondContact O-N 3.23Å; T2530-H2532 VanDerWaalsContact O-N 3.16Å; T2530-H2532 WeakPolarHBondContact OG1-CB 3.4Å; T2530-H2532 PolarHBondContact OG1-CD2 2.82Å; T2530-H2532 PolarHBondContact OG1-N 3.16Å; H2532-L2534 PolarHBondContact O-N 2.99Å; H2532-S2551 PolarHBondContact CE1-OG 3.2Å; H2532-S2551 PolarHBondContact NE2-OG 2.76Å; H2532-S2551 VanDerWaalsContact NE2-OG 3.13Å; H2532-N2553 PolarHBondContact CD2-O 3Å; H2532-N2553 PolarHBondContact CE1-N 2.95Å; H2532-N2553 PolarHBondContact CE1-O 3.34Å; H2532-N2553 VanDerWaalsContact CG-O 3.29Å; H2532-N2553 PolarHBondContact ND1-O 3.11Å; H2532-N2553 VanDerWaalsContact NE2-C 3.29Å; H2532-N2553 PolarHBondContact NE2-O 3.16Å; H2532-Y2554 HydrophobicContact CB-CD2 4.09Å; H2532-Y2554 HydrophobicContact CB-CE2 3.76Å; H2532-Y2554 AromaticContact CG-CD2 3.78Å; H2532-Y2554 AromaticContact ND1-CD2 3.84Å
2533	V	82.9	Confident	82.2	Confident	46 Å²	46	39.8 Å²	39.8	28%	0.279	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	125.3	175.4	177.2	0	0	0	0	109.7	T2524 Y2525 Q2526 G2531 Q2536 S2551	T2524-V2533 HydrophobicContact CG2-CB 4.37Å; T2524-V2533 HydrophobicContact CG2-CG1 3.84Å; T2524-V2533 HydrophobicContact CG2-CG2 3.79Å; Y2525-V2533 CarbonylContact O-C 3.5Å; Y2525-V2533 WeakPolarHBondContact O-CA 3.2Å; Q2526-V2533 HydrophobicContact CB-CG2 4.45Å; Q2526-V2533 HydrophobicContact CG-CG2 4.44Å; G2531-V2533 PolarHBondContact O-N 2.92Å; V2533-Q2536 HydrophobicContact CG1-CG 3.73Å; V2533-S2551 WeakPolarHBondContact O-CB 3.24Å; V2533-S2551 PolarHBondContact O-OG 2.98Å
2534	L	83	Confident	81.9	Confident	37.4 Å²	37.4	40.3 Å²	40.3	20%	0.196	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	-44.1	178.6	-59.7	176.1	0	0	0	111.2	L2512 Y2525 H2527 H2532 A2550 S2551 Y2554 L3370 V3373 F3375	L2512-L2534 HydrophobicContact CD1-CD1 3.85Å; Y2525-L2534 PolarHBondContact O-N 3Å; H2527-L2534 HydrophobicContact CB-CD1 4.43Å; H2527-L2534 HydrophobicContact CB-CD2 4.42Å; H2532-L2534 PolarHBondContact O-N 2.99Å; L2534-A2550 WeakPolarHBondContact O-CA 3.22Å; L2534-S2551 WeakPolarHBondContact CA-OG 3.28Å; L2534-S2551 PolarHBondContact O-N 2.99Å; L2534-S2551 PolarHBondContact O-OG 2.85Å; L2534-Y2554 HydrophobicContact CD2-CD1 4.21Å; L2534-Y2554 HydrophobicContact CD2-CD2 3.38Å; L2534-Y2554 HydrophobicContact CD2-CE2 3.99Å; L2534-Y2554 HydrophobicContact CD2-CG 3.51Å; L2534-L3370 HydrophobicContact CB-CD2 3.9Å; L2534-L3370 HydrophobicContact CD1-CD2 4.03Å; L2534-V3373 HydrophobicContact CB-CG2 4.09Å; L2534-V3373 HydrophobicContact CD2-CG2 4.24Å; L2534-F3375 HydrophobicContact CD1-CB 4.22Å; L2534-F3375 HydrophobicContact CD1-CD2 4.32Å; L2534-F3375 HydrophobicContact CD1-CG 4.19Å
2535	L	88.2	Confident	81.9	Confident	28.8 Å²	28.8	40.9 Å²	40.9	15%	0.151	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	139.9	-178.1	172.5	67.9	0	0	0	109.8	T2524 Y2525 I2537 F2548 N2549 A2550 P3366 W3369	T2524-L2535 CarbonylContact C-O 3.55Å; T2524-L2535 WeakPolarHBondContact CA-O 3.33Å; Y2525-L2535 HydrophobicContact CD2-CB 4.21Å; Y2525-L2535 HydrophobicContact CD2-CD2 4.08Å; Y2525-L2535 HydrophobicContact CD2-CG 4.24Å; Y2525-L2535 HydrophobicContact CE2-CD2 4.25Å; Y2525-L2535 HydrophobicContact CE2-CG 4.48Å; Y2525-L2535 HydrophobicContact CG-CB 4.36Å; Y2525-L2535 HydrophobicContact CG-CD2 4.45Å; Y2525-L2535 PolarHBondContact N-O 2.98Å; Y2525-L2535 PolarHBondContact O-N 2.89Å; L2535-I2537 HydrophobicContact CD1-CG1 4.45Å; L2535-I2537 HydrophobicContact CD2-CD1 4.01Å; L2535-I2537 HydrophobicContact CD2-CG1 4Å; L2535-I2537 HydrophobicContact CG-CG1 4.03Å; L2535-F2548 HydrophobicContact CD1-CB 4.25Å; L2535-F2548 HydrophobicContact CD1-CD1 4.47Å; L2535-N2549 CarbonylContact C-O 3.48Å; L2535-N2549 WeakPolarHBondContact CA-O 3.37Å; L2535-A2550 HydrophobicContact CD1-CB 4.22Å; L2535-P3366 HydrophobicContact CD2-CB 4Å; L2535-W3369 HydrophobicContact CD1-CB 3.96Å; L2535-W3369 HydrophobicContact CD1-CD2 4.18Å; L2535-W3369 HydrophobicContact CD1-CG 3.95Å; L2535-W3369 HydrophobicContact CD2-CB 3.7Å; L2535-W3369 HydrophobicContact CD2-CG 4.13Å; L2535-W3369 HydrophobicContact CG-CB 4.34Å
2536	Q	90.2	Very high	81.8	Confident	56.2 Å²	56.2	41.3 Å²	41.3	26%	0.263	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	133.3	168.1	-77.9	178.8	-35.6	0	0	110	L2522 E2523 T2524 V2533 F2548 N2549	L2522-Q2536 HydrophobicContact CD1-CB 3.99Å; L2522-Q2536 HydrophobicContact CD1-CG 4.23Å; E2523-Q2536 CarbonylContact O-C 3.52Å; E2523-Q2536 VanDerWaalsContact O-CA 3.28Å; E2523-Q2536 WeakPolarHBondContact O-CA 3.45Å; T2524-Q2536 HydrophobicContact CG2-CG 4.03Å; T2524-Q2536 PolarHBondContact OG1-NE2 3.27Å; V2533-Q2536 HydrophobicContact CG1-CG 3.73Å; Q2536-F2548 WeakPolarHBondContact O-CA 3.31Å; Q2536-N2549 HydrophobicContact CB-CB 4.38Å; Q2536-N2549 PolarHBondContact N-O 3.2Å; Q2536-N2549 PolarHBondContact O-N 3.13Å
2537	I	90	Very high	81.9	Confident	6.8 Å²	6.8	42.4 Å²	42.4	4%	0.035	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	117.7	175.2	-49.4	177.4	0	0	0	108	L2522 E2523 Y2525 L2535 Y2539 P2545 I2547 F2548 P3366	L2522-I2537 WeakPolarHBondContact CA-O 3.3Å; E2523-I2537 HydrophobicContact CB-CB 4.3Å; E2523-I2537 PolarHBondContact N-O 2.92Å; E2523-I2537 PolarHBondContact O-N 2.87Å; Y2525-I2537 HydrophobicContact CD2-CD1 4.49Å; Y2525-I2537 HydrophobicContact CE2-CD1 3.86Å; Y2525-I2537 HydrophobicContact CE2-CG1 4.3Å; L2535-I2537 HydrophobicContact CD1-CG1 4.45Å; L2535-I2537 HydrophobicContact CD2-CD1 4.01Å; L2535-I2537 HydrophobicContact CD2-CG1 4Å; L2535-I2537 HydrophobicContact CG-CG1 4.03Å; I2537-Y2539 HydrophobicContact CB-CE2 3.91Å; I2537-Y2539 HydrophobicContact CG2-CD2 4.24Å; I2537-Y2539 HydrophobicContact CG2-CE1 4.14Å; I2537-Y2539 HydrophobicContact CG2-CE2 3.64Å; I2537-P2545 HydrophobicContact CG2-CB 3.89Å; I2537-I2547 CarbonylContact C-O 3.46Å; I2537-I2547 VanDerWaalsContact CA-O 3.25Å; I2537-I2547 WeakPolarHBondContact CA-O 3.28Å; I2537-F2548 HydrophobicContact CD1-CD1 3.94Å; I2537-F2548 HydrophobicContact CD1-CE1 3.7Å; I2537-F2548 HydrophobicContact CG1-CD1 3.8Å; I2537-F2548 HydrophobicContact CG1-CE1 4.01Å; I2537-F2548 HydrophobicContact CG2-CD1 4.31Å; I2537-F2548 HydrophobicContact CG2-CE1 4.09Å; I2537-F2548 HydrophobicContact CG2-CZ 4.29Å; I2537-P3366 HydrophobicContact CD1-CB 4.26Å; I2537-P3366 HydrophobicContact CD1-CG 3.96Å
2538	V	88.7	Confident	82.4	Confident	38.2 Å²	38.2	43.5 Å²	43.5	23%	0.232	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	131.9	173.1	-175.2	0	0	0	0	108.2	L2522 M2546 I2547	L2522-V2538 HydrophobicContact CD1-CG2 3.9Å; V2538-M2546 HydrophobicContact CB-CE 4.44Å; V2538-M2546 HydrophobicContact CG1-CE 3.84Å; V2538-M2546 WeakPolarHBondContact O-CA 3.22Å; V2538-M2546 WeakPolarHBondContact O-CB 3.38Å; V2538-M2546 PolarHBondContact O-N 3.05Å; V2538-I2547 HydrophobicContact CB-CB 4.03Å; V2538-I2547 HydrophobicContact CB-CD1 4.48Å; V2538-I2547 HydrophobicContact CB-CG1 4.4Å; V2538-I2547 HydrophobicContact CG2-CB 4.15Å; V2538-I2547 HydrophobicContact CG2-CD1 4.47Å; V2538-I2547 PolarHBondContact N-O 2.8Å; V2538-I2547 PolarHBondContact O-N 2.97Å; V2538-I2547 VanDerWaalsContact O-N 3.15Å
2539	Y	83.5	Confident	82.8	Confident	32.4 Å²	32.4	44.6 Å²	44.6	13%	0.127	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	156.5	177.7	-62.7	-94.2	0	0	0	111.2	F2516 Q2521 E2523 I2537 F2543 Q2544 P2545	F2516-Y2539 AromaticContact CE2-CD2 3.89Å; F2516-Y2539 HydrophobicContact CE2-CD2 3.95Å; F2516-Y2539 AromaticContact CE2-CE2 3.86Å; F2516-Y2539 HydrophobicContact CE2-CE2 4.02Å; F2516-Y2539 HydrophobicContact CZ-CD2 4.4Å; Q2521-Y2539 WeakPolarHBondContact O-CD2 3.41Å; Q2521-Y2539 PolarHBondContact O-N 2.95Å; Q2521-Y2539 PolarHBondContact OE1-O 3.07Å; E2523-Y2539 HydrophobicContact CB-CE2 3.77Å; E2523-Y2539 WeakPolarHBondContact OE2-CE2 3.34Å; E2523-Y2539 PolarHBondContact OE2-OH 3.13Å; I2537-Y2539 HydrophobicContact CB-CE2 3.91Å; I2537-Y2539 HydrophobicContact CG2-CD2 4.24Å; I2537-Y2539 HydrophobicContact CG2-CE1 4.14Å; I2537-Y2539 HydrophobicContact CG2-CE2 3.64Å; Y2539-F2543 HydrophobicContact CD1-CD1 4.24Å; Y2539-F2543 HydrophobicContact CD1-CD2 4.26Å; Y2539-F2543 HydrophobicContact CD1-CE1 4.29Å; Y2539-F2543 HydrophobicContact CD1-CE2 4.26Å; Y2539-F2543 HydrophobicContact CD1-CG 4.23Å; Y2539-F2543 HydrophobicContact CD1-CZ 4.3Å; Y2539-F2543 VanDerWaalsContact CD1-O 3.29Å; Y2539-F2543 WeakPolarHBondContact CD1-O 3.25Å; Y2539-F2543 AromaticContact CD2-CE2 3.98Å; Y2539-F2543 HydrophobicContact CD2-CE2 3.98Å; Y2539-F2543 HydrophobicContact CD2-CZ 4.21Å; Y2539-F2543 HydrophobicContact CE1-CD1 4.36Å; Y2539-F2543 HydrophobicContact CE1-CE1 4.08Å; Y2539-F2543 HydrophobicContact CE1-CZ 4.22Å; Y2539-F2543 HydrophobicContact CE2-CE2 4.36Å; Y2539-F2543 HydrophobicContact CE2-CZ 4.14Å; Y2539-F2543 HydrophobicContact CG-CD2 4.04Å; Y2539-F2543 AromaticContact CG-CE2 3.92Å; Y2539-F2543 HydrophobicContact CG-CE2 3.92Å; Y2539-F2543 HydrophobicContact CG-CG 4.46Å; Y2539-F2543 HydrophobicContact CG-CZ 4.29Å; Y2539-Q2544 CarbonylContact C-O 3.47Å; Y2539-Q2544 VanDerWaalsContact CA-O 3.3Å; Y2539-Q2544 WeakPolarHBondContact CA-O 3.31Å; Y2539-P2545 HydrophobicContact CD1-CB 4.17Å; Y2539-P2545 HydrophobicContact CE1-CB 4.01Å
2540	N	79.5	Confident	83.1	Confident	21.4 Å²	21.4	41.5 Å²	41.5	11%	0.114	23%	0.232	C	C	.	.			trans	-84.7	178.8	167.4	72.4	9.1	0	0	0	111.4	Q2521 N2542 F2543 Q2544 M2546	Q2521-N2540 PolarHBondContact NE2-O 2.99Å; Q2521-N2540 PolarHBondContact OE1-O 3.26Å; Q2521-N2540 VanDerWaalsContact OE1-O 3.08Å; N2540-N2542 PolarHBondContact O-N 3.04Å; N2540-N2542 VanDerWaalsContact O-N 3.12Å; N2540-N2542 VanDerWaalsContact OD1-C 3.32Å; N2540-N2542 VanDerWaalsContact OD1-CA 3.31Å; N2540-N2542 WeakPolarHBondContact OD1-CA 3.32Å; N2540-N2542 VanDerWaalsContact OD1-CB 3.27Å; N2540-N2542 WeakPolarHBondContact OD1-CB 3.29Å; N2540-N2542 PolarHBondContact OD1-N 3.06Å; N2540-F2543 WeakPolarHBondContact O-CA 3.22Å; N2540-F2543 PolarHBondContact O-N 3.27Å; N2540-F2543 PolarHBondContact OD1-N 3.18Å; N2540-F2543 VanDerWaalsContact OD1-N 3.15Å; N2540-Q2544 PolarHBondContact N-O 2.87Å; N2540-Q2544 PolarHBondContact ND2-OE1 3.03Å; N2540-Q2544 WeakPolarHBondContact OD1-CB 3.31Å; N2540-Q2544 PolarHBondContact OD1-N 3.02Å; N2540-Q2544 PolarHBondContact OD1-O 3.05Å; N2540-M2546 HydrophobicContact CB-CE 3.52Å; N2540-M2546 HydrophobicContact CB-CG 3.86Å; N2540-M2546 HydrophobicContact CB-SD 3.52Å; N2540-M2546 VanDerWaalsContact CB-SD 3.52Å
2541	A	72.9	Confident	82.9	Confident	44.4 Å²	44.4	39.7 Å²	39.7	37%	0.367	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-20.6	178.9	0	0	0	0	0	114.8	D2198 I2302 F2543	D2198-A2541 HydrophobicContact CB-CB 3.78Å; I2302-A2541 HydrophobicContact CD1-CB 3.31Å; A2541-F2543 VanDerWaalsContact C-N 3.3Å
2542	N	71.6	Confident	82	Confident	73.4 Å²	73.4	39 Å²	39	39%	0.393	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	9.7	174.4	-67.9	-34	0	0	0	113.1	D2198 S2200 I2201 N2540 Q2544	D2198-N2542 VanDerWaalsContact CG-CG 3.45Å; D2198-N2542 PolarHBondContact OD1-ND2 3.34Å; D2198-N2542 PolarHBondContact OD1-OD1 2.92Å; D2198-N2542 PolarHBondContact OD2-ND2 2.72Å; D2198-N2542 PolarHBondContact OD2-OD1 3.19Å; S2200-N2542 PolarHBondContact OG-ND2 2.94Å; S2200-N2542 PolarHBondContact OG-OD1 3.26Å; I2201-N2542 HydrophobicContact CD1-CB 3.83Å; I2201-N2542 HydrophobicContact CG1-CB 4.5Å; N2540-N2542 PolarHBondContact O-N 3.04Å; N2540-N2542 VanDerWaalsContact O-N 3.12Å; N2540-N2542 VanDerWaalsContact OD1-C 3.32Å; N2540-N2542 VanDerWaalsContact OD1-CA 3.31Å; N2540-N2542 WeakPolarHBondContact OD1-CA 3.32Å; N2540-N2542 VanDerWaalsContact OD1-CB 3.27Å; N2540-N2542 WeakPolarHBondContact OD1-CB 3.29Å; N2540-N2542 PolarHBondContact OD1-N 3.06Å; N2542-Q2544 HydrophobicContact CB-CG 4.07Å; N2542-Q2544 PolarHBondContact O-N 3.21Å
2543	F	76.8	Confident	80.8	Confident	71 Å²	71	39.7 Å²	39.7	31%	0.311	22%	0.219	S	C	.	.	S	Bend	trans	56.4	29.3	-173.1	-77.6	-84.4	0	0	0	114.3	M2175 F2516 W2518 Q2521 Y2539 N2540 A2541	M2175-F2543 HydrophobicContact CE-CD2 4.13Å; M2175-F2543 HydrophobicContact CE-CE2 3.73Å; M2175-F2543 VanDerWaalsContact CE-CE2 3.47Å; M2175-F2543 HydrophobicContact CE-CZ 4.19Å; M2175-F2543 HydrophobicContact SD-CD2 4.29Å; M2175-F2543 HydrophobicContact SD-CE2 4.27Å; F2516-F2543 HydrophobicContact CE1-CE1 4.28Å; F2516-F2543 AromaticContact CE2-CE2 3.69Å; F2516-F2543 HydrophobicContact CE2-CE2 3.69Å; F2516-F2543 AromaticContact CE2-CZ 3.91Å; F2516-F2543 HydrophobicContact CE2-CZ 3.91Å; F2516-F2543 HydrophobicContact CZ-CD1 4.23Å; F2516-F2543 AromaticContact CZ-CE1 3.86Å; F2516-F2543 HydrophobicContact CZ-CE1 3.86Å; F2516-F2543 AromaticContact CZ-CE2 3.57Å; F2516-F2543 HydrophobicContact CZ-CE2 3.57Å; F2516-F2543 HydrophobicContact CZ-CZ 4.23Å; W2518-F2543 HydrophobicContact CE3-CE1 4.24Å; W2518-F2543 HydrophobicContact CE3-CZ 4.12Å; W2518-F2543 HydrophobicContact CH2-CZ 4.2Å; W2518-F2543 AromaticContact CZ3-CE1 3.96Å; W2518-F2543 HydrophobicContact CZ3-CE1 4.14Å; W2518-F2543 AromaticContact CZ3-CZ 3.73Å; W2518-F2543 HydrophobicContact CZ3-CZ 3.73Å; Q2521-F2543 HydrophobicContact CG-CE1 4.38Å; Y2539-F2543 HydrophobicContact CD1-CD1 4.24Å; Y2539-F2543 HydrophobicContact CD1-CD2 4.26Å; Y2539-F2543 HydrophobicContact CD1-CE1 4.29Å; Y2539-F2543 HydrophobicContact CD1-CE2 4.26Å; Y2539-F2543 HydrophobicContact CD1-CG 4.23Å; Y2539-F2543 HydrophobicContact CD1-CZ 4.3Å; Y2539-F2543 VanDerWaalsContact CD1-O 3.29Å; Y2539-F2543 WeakPolarHBondContact CD1-O 3.25Å; Y2539-F2543 AromaticContact CD2-CE2 3.98Å; Y2539-F2543 HydrophobicContact CD2-CE2 3.98Å; Y2539-F2543 HydrophobicContact CD2-CZ 4.21Å; Y2539-F2543 HydrophobicContact CE1-CD1 4.36Å; Y2539-F2543 HydrophobicContact CE1-CE1 4.08Å; Y2539-F2543 HydrophobicContact CE1-CZ 4.22Å; Y2539-F2543 HydrophobicContact CE2-CE2 4.36Å; Y2539-F2543 HydrophobicContact CE2-CZ 4.14Å; Y2539-F2543 HydrophobicContact CG-CD2 4.04Å; Y2539-F2543 AromaticContact CG-CE2 3.92Å; Y2539-F2543 HydrophobicContact CG-CE2 3.92Å; Y2539-F2543 HydrophobicContact CG-CG 4.46Å; Y2539-F2543 HydrophobicContact CG-CZ 4.29Å; N2540-F2543 WeakPolarHBondContact O-CA 3.22Å; N2540-F2543 PolarHBondContact O-N 3.27Å; N2540-F2543 PolarHBondContact OD1-N 3.18Å; N2540-F2543 VanDerWaalsContact OD1-N 3.15Å; A2541-F2543 VanDerWaalsContact C-N 3.3Å
2544	Q	81.8	Confident	79	Confident	30.2 Å²	30.2	40.7 Å²	40.7	14%	0.141	22%	0.218	C	C	.	.			trans	-88.5	134.4	168.9	-52.8	174.1	-58.1	0	0	109	Y2539 N2540 N2542 M2546 Y2581 G2585	Y2539-Q2544 CarbonylContact C-O 3.47Å; Y2539-Q2544 VanDerWaalsContact CA-O 3.3Å; Y2539-Q2544 WeakPolarHBondContact CA-O 3.31Å; N2540-Q2544 PolarHBondContact N-O 2.87Å; N2540-Q2544 PolarHBondContact ND2-OE1 3.03Å; N2540-Q2544 WeakPolarHBondContact OD1-CB 3.31Å; N2540-Q2544 PolarHBondContact OD1-N 3.02Å; N2540-Q2544 PolarHBondContact OD1-O 3.05Å; N2542-Q2544 HydrophobicContact CB-CG 4.07Å; N2542-Q2544 PolarHBondContact O-N 3.21Å; Q2544-M2546 PolarHBondContact O-N 3.19Å; Q2544-Y2581 HydrophobicContact CB-CD2 4.07Å; Q2544-Y2581 HydrophobicContact CB-CE1 4.31Å; Q2544-Y2581 HydrophobicContact CB-CE2 3.73Å; Q2544-Y2581 HydrophobicContact CB-CG 4.46Å; Q2544-G2585 PolarHBondContact NE2-O 2.89Å
2545	P	87.2	Confident	77.1	Confident	26.6 Å²	26.6	42.9 Å²	42.9	17%	0.173	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	127.7	-177.4	27.7	-34.1	0	0	0	110.2	I2537 Y2539 F2548 L2579 Y2581	I2537-P2545 HydrophobicContact CG2-CB 3.89Å; Y2539-P2545 HydrophobicContact CD1-CB 4.17Å; Y2539-P2545 HydrophobicContact CE1-CB 4.01Å; P2545-F2548 HydrophobicContact CB-CE2 3.69Å; P2545-F2548 HydrophobicContact CB-CZ 3.63Å; P2545-F2548 HydrophobicContact CG-CE2 4.2Å; P2545-F2548 HydrophobicContact CG-CZ 4.03Å; P2545-L2579 HydrophobicContact CB-CD1 4.34Å; P2545-L2579 HydrophobicContact CG-CD1 4.32Å; P2545-L2579 WeakPolarHBondContact O-CB 3.43Å; P2545-L2579 WeakPolarHBondContact O-CD1 3.31Å; P2545-Y2581 WeakPolarHBondContact CD-OH 3.43Å; P2545-Y2581 VanDerWaalsContact O-CE2 3.25Å; P2545-Y2581 WeakPolarHBondContact O-CE2 3.36Å; P2545-Y2581 VanDerWaalsContact O-CZ 3.3Å; P2545-Y2581 PolarHBondContact O-OH 2.95Å
2546	M	87.3	Confident	74.7	Confident	50.4 Å²	50.4	49.3 Å²	49.3	25%	0.248	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	-36.9	-179	-109.7	-173.4	53.5	0	0	112.6	R2299 V2538 N2540 Q2544 I2578 L2579 Y2581	R2299-M2546 PolarHBondContact NH2-SD 2.98Å; V2538-M2546 HydrophobicContact CB-CE 4.44Å; V2538-M2546 HydrophobicContact CG1-CE 3.84Å; V2538-M2546 WeakPolarHBondContact O-CA 3.22Å; V2538-M2546 WeakPolarHBondContact O-CB 3.38Å; V2538-M2546 PolarHBondContact O-N 3.05Å; N2540-M2546 HydrophobicContact CB-CE 3.52Å; N2540-M2546 HydrophobicContact CB-CG 3.86Å; N2540-M2546 HydrophobicContact CB-SD 3.52Å; N2540-M2546 VanDerWaalsContact CB-SD 3.52Å; Q2544-M2546 PolarHBondContact O-N 3.19Å; M2546-I2578 CarbonylContact O-C 3.58Å; M2546-I2578 VanDerWaalsContact O-CA 3.27Å; M2546-I2578 WeakPolarHBondContact O-CA 3.34Å; M2546-L2579 WeakPolarHBondContact CG-O 3.46Å; M2546-L2579 PolarHBondContact O-N 3.2Å; M2546-Y2581 HydrophobicContact CG-CE2 4.33Å
2547	I	89.8	Confident	72	Confident	42.8 Å²	42.8	51.1 Å²	51.1	22%	0.219	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	126.1	-175.2	-54.2	177.2	0	0	0	108.9	I2537 V2538 N2549 T2576 L2577 I2578	I2537-I2547 CarbonylContact C-O 3.46Å; I2537-I2547 VanDerWaalsContact CA-O 3.25Å; I2537-I2547 WeakPolarHBondContact CA-O 3.28Å; V2538-I2547 HydrophobicContact CB-CB 4.03Å; V2538-I2547 HydrophobicContact CB-CD1 4.48Å; V2538-I2547 HydrophobicContact CB-CG1 4.4Å; V2538-I2547 HydrophobicContact CG2-CB 4.15Å; V2538-I2547 HydrophobicContact CG2-CD1 4.47Å; V2538-I2547 PolarHBondContact N-O 2.8Å; V2538-I2547 PolarHBondContact O-N 2.97Å; V2538-I2547 VanDerWaalsContact O-N 3.15Å; I2547-N2549 HydrophobicContact CG2-CB 4.39Å; I2547-T2576 HydrophobicContact CG2-CG2 3.51Å; I2547-T2576 VanDerWaalsContact CG2-CG2 3.48Å; I2547-L2577 CarbonylContact C-O 3.52Å; I2547-L2577 VanDerWaalsContact CA-O 3.32Å; I2547-L2577 WeakPolarHBondContact CA-O 3.29Å; I2547-I2578 HydrophobicContact CG1-CG1 4.47Å; I2547-I2578 HydrophobicContact CG1-CG2 4.46Å; I2547-I2578 HydrophobicContact CG2-CG1 4.47Å
2548	F	91.4	Very high	69.3	Low	36 Å²	36	56.6 Å²	56.6	16%	0.158	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	116.2	165.8	-61.3	-105	0	0	0	108.5	L2535 Q2536 I2537 P2545 T2576 L2577 L2579 M3363 W3369	L2535-F2548 HydrophobicContact CD1-CB 4.25Å; L2535-F2548 HydrophobicContact CD1-CD1 4.47Å; Q2536-F2548 WeakPolarHBondContact O-CA 3.31Å; I2537-F2548 HydrophobicContact CD1-CD1 3.94Å; I2537-F2548 HydrophobicContact CD1-CE1 3.7Å; I2537-F2548 HydrophobicContact CG1-CD1 3.8Å; I2537-F2548 HydrophobicContact CG1-CE1 4.01Å; I2537-F2548 HydrophobicContact CG2-CD1 4.31Å; I2537-F2548 HydrophobicContact CG2-CE1 4.09Å; I2537-F2548 HydrophobicContact CG2-CZ 4.29Å; P2545-F2548 HydrophobicContact CB-CE2 3.69Å; P2545-F2548 HydrophobicContact CB-CZ 3.63Å; P2545-F2548 HydrophobicContact CG-CE2 4.2Å; P2545-F2548 HydrophobicContact CG-CZ 4.03Å; F2548-T2576 WeakPolarHBondContact O-CA 3.43Å; F2548-T2576 VanDerWaalsContact O-CG2 3.3Å; F2548-T2576 WeakPolarHBondContact O-CG2 3.25Å; F2548-L2577 HydrophobicContact CB-CB 4.18Å; F2548-L2577 HydrophobicContact CD2-CB 4.44Å; F2548-L2577 HydrophobicContact CD2-CD2 3.86Å; F2548-L2577 HydrophobicContact CD2-CG 4.29Å; F2548-L2577 HydrophobicContact CE2-CD2 4.34Å; F2548-L2577 HydrophobicContact CG-CD2 4.4Å; F2548-L2577 PolarHBondContact N-O 2.87Å; F2548-L2577 PolarHBondContact O-N 3.06Å; F2548-L2577 VanDerWaalsContact O-N 3.1Å; F2548-L2579 HydrophobicContact CD2-CD1 4.45Å; F2548-L2579 HydrophobicContact CE2-CD1 3.77Å; F2548-L2579 HydrophobicContact CE2-CG 4.41Å; F2548-M3363 WeakPolarHBondContact CZ-O 3.41Å; F2548-W3369 HydrophobicContact CB-CD2 4.31Å; F2548-W3369 HydrophobicContact CB-CH2 4.23Å; F2548-W3369 HydrophobicContact CB-CZ2 3.56Å; F2548-W3369 AromaticContact CD1-CD1 3.75Å; F2548-W3369 AromaticContact CD1-NE1 3.36Å; F2548-W3369 HydrophobicContact CG-CZ2 4.2Å; F2548-W3369 AromaticContact CG-NE1 3.67Å
2549	N	87.7	Confident	66.6	Low	40.2 Å²	40.2	58.3 Å²	58.3	22%	0.215	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	103.6	-177.8	-175.3	19.8	0	0	0	109.8	L2535 Q2536 I2547 R2573 T2576	L2535-N2549 CarbonylContact C-O 3.48Å; L2535-N2549 WeakPolarHBondContact CA-O 3.37Å; Q2536-N2549 HydrophobicContact CB-CB 4.38Å; Q2536-N2549 PolarHBondContact N-O 3.2Å; Q2536-N2549 PolarHBondContact O-N 3.13Å; I2547-N2549 HydrophobicContact CG2-CB 4.39Å; N2549-R2573 PolarHBondContact ND2-NH2 2.91Å; N2549-R2573 PolarHBondContact OD1-NE 3.25Å; N2549-R2573 PolarHBondContact OD1-NH2 3.14Å; N2549-T2576 HydrophobicContact CB-CG2 4.36Å; N2549-T2576 PolarHBondContact OD1-OG1 2.9Å
2550	A	82.4	Confident	64	Low	15.6 Å²	15.6	61.1 Å²	61.1	13%	0.129	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	143.5	177.9	0	0	0	0	0	111.3	L2534 L2535 R2573 P2574 W3369 V3373	L2534-A2550 WeakPolarHBondContact O-CA 3.22Å; L2535-A2550 HydrophobicContact CD1-CB 4.22Å; A2550-R2573 PolarHBondContact O-NE 3.24Å; A2550-P2574 HydrophobicContact CB-CB 4.09Å; A2550-P2574 HydrophobicContact CB-CG 4.01Å; A2550-W3369 HydrophobicContact CB-CE3 3.56Å; A2550-W3369 HydrophobicContact CB-CZ3 4.01Å; A2550-V3373 HydrophobicContact CB-CG1 3.65Å
2551	S	71.3	Confident	61.6	Low	33 Å²	33	68.8 Å²	68.8	23%	0.231	40%	0.401	C	S	.	.			trans	-97.2	149.2	178.4	108.9	0	0	0	0	111	H2532 V2533 L2534 N2553 P2574 V3373	H2532-S2551 PolarHBondContact CE1-OG 3.2Å; H2532-S2551 PolarHBondContact NE2-OG 2.76Å; H2532-S2551 VanDerWaalsContact NE2-OG 3.13Å; V2533-S2551 WeakPolarHBondContact O-CB 3.24Å; V2533-S2551 PolarHBondContact O-OG 2.98Å; L2534-S2551 WeakPolarHBondContact CA-OG 3.28Å; L2534-S2551 PolarHBondContact O-N 2.99Å; L2534-S2551 PolarHBondContact O-OG 2.85Å; S2551-N2553 PolarHBondContact OG-N 3.3Å; S2551-P2574 WeakPolarHBondContact O-CD 3.29Å; S2551-V3373 VanDerWaalsContact O-CG1 3.22Å; S2551-V3373 WeakPolarHBondContact O-CG1 3.36Å
2552	A	59.2	Low	59.4	Low	21.6 Å²	21.6	75.8 Å²	75.8	18%	0.179	43%	0.426	C	S	.	.			trans	-91.7	9.3	179.5	0	0	0	0	0	113.5	Y2554 R2573 S2891	A2552-Y2554 PolarHBondContact O-N 2.79Å; A2552-Y2554 VanDerWaalsContact O-N 3.1Å; A2552-R2573 HydrophobicContact CB-CB 4.24Å; A2552-R2573 HydrophobicContact CB-CG 3.9Å; A2552-S2891 WeakPolarHBondContact O-CA 3.37Å; A2552-S2891 WeakPolarHBondContact O-CB 3.32Å; A2552-S2891 PolarHBondContact O-OG 2.94Å
2553	N	52.2	Low	57.3	Low	81.2 Å²	81.2	80.1 Å²	80.1	43%	0.434	45%	0.446	S	S	.	.			trans	-95.8	72.7	-168	-75.6	-2.7	0	0	0	113.9	H2532 S2551 L2555 Y2571 R2878 Q2890 S2891 Q3372 V3373	H2532-N2553 PolarHBondContact CD2-O 3Å; H2532-N2553 PolarHBondContact CE1-N 2.95Å; H2532-N2553 PolarHBondContact CE1-O 3.34Å; H2532-N2553 VanDerWaalsContact CG-O 3.29Å; H2532-N2553 PolarHBondContact ND1-O 3.11Å; H2532-N2553 VanDerWaalsContact NE2-C 3.29Å; H2532-N2553 PolarHBondContact NE2-O 3.16Å; S2551-N2553 PolarHBondContact OG-N 3.3Å; N2553-L2555 PolarHBondContact O-N 3.43Å; N2553-Y2571 WeakPolarHBondContact OD1-CD1 3.34Å; N2553-R2878 PolarHBondContact ND2-NH2 3.35Å; N2553-R2878 VanDerWaalsContact ND2-NH2 3.13Å; N2553-Q2890 PolarHBondContact ND2-O 2.72Å; N2553-S2891 WeakPolarHBondContact ND2-CA 3.46Å; N2553-S2891 PolarHBondContact ND2-O 3.12Å; N2553-S2891 PolarHBondContact OD1-OG 3.39Å; N2553-Q3372 PolarHBondContact OD1-O 2.9Å; N2553-V3373 VanDerWaalsContact OD1-CA 3.23Å; N2553-V3373 WeakPolarHBondContact OD1-CA 3.48Å; N2553-V3373 PolarHBondContact OD1-O 2.79Å
2554	Y	44.9	Very low	55.1	Low	66.4 Å²	66.4	85.9 Å²	85.9	26%	0.26	47%	0.471	S	S	.	.			trans	-93.7	17.9	174.3	-174	-106	0	0	0	112.3	H2527 T2530 H2532 L2534 A2552 Q2556 L2875 T2876	H2527-Y2554 HydrophobicContact CB-CD2 4.06Å; H2527-Y2554 HydrophobicContact CB-CE2 3.8Å; H2527-Y2554 AromaticContact CD2-CD2 3.82Å; H2527-Y2554 AromaticContact CD2-CE1 3.44Å; H2527-Y2554 VanDerWaalsContact CD2-CE1 3.44Å; H2527-Y2554 WeakPolarHBondContact CD2-CE1 3.07Å; H2527-Y2554 AromaticContact CD2-CE2 3.34Å; H2527-Y2554 WeakPolarHBondContact CD2-CE2 3.35Å; H2527-Y2554 AromaticContact CD2-CZ 3.47Å; H2527-Y2554 VanDerWaalsContact CD2-CZ 3.47Å; H2527-Y2554 PolarHBondContact CD2-OH 3.06Å; H2527-Y2554 AromaticContact CE1-CE2 3.92Å; H2527-Y2554 AromaticContact CE1-CZ 3.84Å; H2527-Y2554 PolarHBondContact CE1-OH 2.88Å; H2527-Y2554 VanDerWaalsContact CE1-OH 3.27Å; H2527-Y2554 AromaticContact CG-CD2 3.73Å; H2527-Y2554 AromaticContact CG-CE2 3.49Å; H2527-Y2554 VanDerWaalsContact CG-CE2 3.44Å; H2527-Y2554 AromaticContact CG-CZ 3.64Å; H2527-Y2554 VanDerWaalsContact CG-OH 3.32Å; H2527-Y2554 AromaticContact ND1-CE2 3.73Å; H2527-Y2554 AromaticContact ND1-CZ 3.91Å; H2527-Y2554 PolarHBondContact ND1-OH 3.34Å; H2527-Y2554 AromaticContact NE2-CE1 3.6Å; H2527-Y2554 AromaticContact NE2-CE2 3.78Å; H2527-Y2554 AromaticContact NE2-CZ 3.65Å; H2527-Y2554 PolarHBondContact NE2-OH 3.05Å; T2530-Y2554 HydrophobicContact CG2-CE2 3.95Å; T2530-Y2554 WeakPolarHBondContact CG2-OH 3.33Å; T2530-Y2554 WeakPolarHBondContact OG1-CE2 3.33Å; T2530-Y2554 PolarHBondContact OG1-OH 2.81Å; H2532-Y2554 HydrophobicContact CB-CD2 4.09Å; H2532-Y2554 HydrophobicContact CB-CE2 3.76Å; H2532-Y2554 AromaticContact CG-CD2 3.78Å; H2532-Y2554 AromaticContact ND1-CD2 3.84Å; L2534-Y2554 HydrophobicContact CD2-CD1 4.21Å; L2534-Y2554 HydrophobicContact CD2-CD2 3.38Å; L2534-Y2554 HydrophobicContact CD2-CE2 3.99Å; L2534-Y2554 HydrophobicContact CD2-CG 3.51Å; A2552-Y2554 PolarHBondContact O-N 2.79Å; A2552-Y2554 VanDerWaalsContact O-N 3.1Å; Y2554-Q2556 PolarHBondContact O-N 3.15Å; Y2554-L2875 VanDerWaalsContact OH-CD2 3.25Å; Y2554-L2875 WeakPolarHBondContact OH-CD2 3.12Å; Y2554-T2876 HydrophobicContact CD1-CG2 4.08Å; Y2554-T2876 HydrophobicContact CE1-CG2 3.91Å
2555	L	42.5	Very low	52.6	Low	83.8 Å²	83.8	94.6 Å²	94.6	44%	0.439	51%	0.505	S	S	.	.	G	3₁₀ helix	trans	-137.4	52.6	-178.7	-83	156.4	0	0	0	114.3	N2553 Y2571 T2876 Y2889	N2553-L2555 PolarHBondContact O-N 3.43Å; L2555-Y2571 VanDerWaalsContact CD1-OH 3.27Å; L2555-Y2571 WeakPolarHBondContact CD1-OH 3.14Å; L2555-T2876 HydrophobicContact CD1-CG2 4.2Å; L2555-T2876 HydrophobicContact CG-CG2 4.38Å; L2555-Y2889 VanDerWaalsContact CD1-C 3.44Å; L2555-Y2889 WeakPolarHBondContact CD1-O 3.38Å; L2555-Y2889 WeakPolarHBondContact CD2-O 3.35Å; L2555-Y2889 WeakPolarHBondContact CG-O 3.42Å
2556	Q	38.3	Very low	50	Low	164.2 Å²	164.2	98.5 Å²	98.5	77%	0.767	53%	0.53	S	S	*	.	G	3₁₀ helix	trans	-134.4	51.4	160	-85	-169	-4.2	0	0	112.1	Y2554	Y2554-Q2556 PolarHBondContact O-N 3.15Å
2557	S	34	Very low	47.4	Very low	93.4 Å²	93.4	102.1 Å²	102.1	65%	0.653	56%	0.555	S	S	*	*			trans	-133	44.3	170	109.5	0	0	0	0	115.1	T2530 G2559	T2530-S2557 WeakPolarHBondContact CG2-OG 3.1Å; S2557-G2559 PolarHBondContact O-N 3.1Å
2558	T	33	Very low	44.8	Very low	123 Å²	123	109.4 Å²	109.4	76%	0.755	59%	0.585	S	S	*	*	S	Bend	trans	-110.1	83.2	158.9	50.9	0	0	0	0	109.4	A2560	T2558-A2560 PolarHBondContact O-N 2.89Å; T2558-A2560 VanDerWaalsContact O-N 3.13Å
2559	G	30.5	Very low	42.3	Very low	73.2 Å²	73.2	110.9 Å²	110.9	76%	0.755	60%	0.604	S	S	*	*			trans	-81.8	107.5	-177.9	0	0	0	0	0	112.4	S2557 H2561	S2557-G2559 PolarHBondContact O-N 3.1Å; G2559-H2561 PolarHBondContact O-N 2.87Å
2560	A	29.7	Very low	40.1	Very low	90.6 Å²	90.6	115.7 Å²	115.7	75%	0.749	63%	0.63	S	S	*	*			trans	-129.1	113	153.9	0	0	0	0	0	108.3	T2558 E2562	T2558-A2560 PolarHBondContact O-N 2.89Å; T2558-A2560 VanDerWaalsContact O-N 3.13Å; A2560-E2562 PolarHBondContact O-N 2.78Å
2561	H	29.3	Very low	38.3	Very low	183.8 Å²	183.8	121.6 Å²	121.6	85%	0.851	65%	0.65	S	S	*	*			trans	34.1	110.2	165.9	-77.8	-79.8	0	0	0	114.5	G2559 M2563	G2559-H2561 PolarHBondContact O-N 2.87Å; H2561-M2563 PolarHBondContact O-N 3.02Å
2562	E	27.6	Very low	37.5	Very low	190.8 Å²	190.8	123.7 Å²	123.7	89%	0.892	66%	0.657	S	S	*	*			trans	-136.8	124.6	138.7	-83.5	174.1	176.2	0	0	112.1	A2560 F2564	A2560-E2562 PolarHBondContact O-N 2.78Å; E2562-F2564 PolarHBondContact O-N 3.37Å
2563	M	27.6	Very low	37.9	Very low	164.4 Å²	164.4	128.5 Å²	128.5	81%	0.81	67%	0.671	S	S	*	*			trans	-93.4	120.5	170.2	-75.2	-153.7	-149.3	0	0	113.6	H2561 Y2565	H2561-M2563 PolarHBondContact O-N 3.02Å; M2563-Y2565 PolarHBondContact O-N 3.06Å
2564	F	29.4	Very low	39	Very low	192.2 Å²	192.2	126 Å²	126	84%	0.843	66%	0.659	S	S	*	*			trans	-9.9	114.4	156.6	-82.7	-94.3	0	0	0	114.7	E2562 P2566	E2562-F2564 PolarHBondContact O-N 3.37Å; F2564-P2566 WeakPolarHBondContact O-CD 3.36Å
2565	Y	30.3	Very low	40.7	Very low	213.4 Å²	213.4	123.6 Å²	123.6	84%	0.837	65%	0.653	S	S	*	*			trans	-77.7	126.8	159.3	-73	-81.3	0	0	0	112.2	M2563 T2567	M2563-Y2565 PolarHBondContact O-N 3.06Å; Y2565-T2567 PolarHBondContact O-N 2.92Å; Y2565-T2567 VanDerWaalsContact O-N 3.16Å
2566	P	31.8	Very low	42.8	Very low	109.4 Å²	109.4	121.6 Å²	121.6	71%	0.71	64%	0.644	S	S	*	*			trans	-93.2	130	165.6	23.6	-11	0	0	0	110.1	F2564 K2568	F2564-P2566 WeakPolarHBondContact O-CD 3.36Å; P2566-K2568 PolarHBondContact O-N 2.89Å
2567	T	32.8	Very low	45.3	Very low	124.8 Å²	124.8	115.1 Å²	115.1	77%	0.766	62%	0.615	S	S	*	*			trans	-41.9	121.1	159.3	42.8	0	0	0	0	113	Y2565 A2569	Y2565-T2567 PolarHBondContact O-N 2.92Å; Y2565-T2567 VanDerWaalsContact O-N 3.16Å; T2567-A2569 WeakPolarHBondContact O-CA 3.42Å; T2567-A2569 PolarHBondContact O-N 2.9Å
2568	K	35	Very low	48	Very low	195.6 Å²	195.6	113.3 Å²	113.3	85%	0.85	60%	0.597	S	S	*	*			trans	4.7	66.5	156.7	-105.6	179.2	-179.6	-179.3	0	114.9	P2566 D2570	P2566-K2568 PolarHBondContact O-N 2.89Å; K2568-D2570 PolarHBondContact O-N 3Å
2569	A	38	Very low	50.8	Low	68 Å²	68	108.1 Å²	108.1	56%	0.562	57%	0.565	S	S	*	*			trans	-99.2	98.2	165.7	0	0	0	0	0	108.5	T2567 Y2571	T2567-A2569 WeakPolarHBondContact O-CA 3.42Å; T2567-A2569 PolarHBondContact O-N 2.9Å; A2569-Y2571 VanDerWaalsContact C-N 3.31Å; A2569-Y2571 WeakPolarHBondContact O-CD2 3.29Å; A2569-Y2571 WeakPolarHBondContact O-CE2 3.35Å; A2569-Y2571 PolarHBondContact O-N 3.3Å
2570	D	41.5	Very low	53.6	Low	140.8 Å²	140.8	106.2 Å²	106.2	75%	0.753	54%	0.542	S	S	*	.			trans	-49.9	79.8	172.4	-71.7	-32.2	0	0	0	112.2	K2568 I2572	K2568-D2570 PolarHBondContact O-N 3Å; D2570-I2572 VanDerWaalsContact C-N 3.27Å; D2570-I2572 HydrophobicContact CB-CG1 4.36Å; D2570-I2572 WeakPolarHBondContact O-CG1 3.15Å; D2570-I2572 PolarHBondContact O-N 2.94Å
2571	Y	45.3	Very low	56.3	Low	140.6 Å²	140.6	103.9 Å²	103.9	55%	0.551	51%	0.514	S	S	*	.			trans	-68.8	97.8	168.6	-69.7	-81.1	0	0	0	108	N2553 L2555 A2569 R2573	N2553-Y2571 WeakPolarHBondContact OD1-CD1 3.34Å; L2555-Y2571 VanDerWaalsContact CD1-OH 3.27Å; L2555-Y2571 WeakPolarHBondContact CD1-OH 3.14Å; A2569-Y2571 VanDerWaalsContact C-N 3.31Å; A2569-Y2571 WeakPolarHBondContact O-CD2 3.29Å; A2569-Y2571 WeakPolarHBondContact O-CE2 3.35Å; A2569-Y2571 PolarHBondContact O-N 3.3Å; Y2571-R2573 PolarHBondContact O-N 3.07Å; Y2571-R2573 VanDerWaalsContact O-N 3.11Å
2572	I	55.2	Low	58.9	Low	76.2 Å²	76.2	96.6 Å²	96.6	39%	0.391	48%	0.483	S	S	.	.			trans	-69.1	105.6	175.6	-57.1	173.2	0	0	0	107.1	D2570 P2574 D2911	D2570-I2572 VanDerWaalsContact C-N 3.27Å; D2570-I2572 HydrophobicContact CB-CG1 4.36Å; D2570-I2572 WeakPolarHBondContact O-CG1 3.15Å; D2570-I2572 PolarHBondContact O-N 2.94Å; I2572-P2574 WeakPolarHBondContact O-CD 3.44Å; I2572-D2911 HydrophobicContact CG2-CB 3.78Å
2573	R	67.7	Low	61.1	Low	122.4 Å²	122.4	96 Å²	96	46%	0.462	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-69.4	143.3	171.1	-123.1	-178.2	-177.5	-178.4	1.9	108.9	N2549 A2550 A2552 Y2571 A2575 D2911	N2549-R2573 PolarHBondContact ND2-NH2 2.91Å; N2549-R2573 PolarHBondContact OD1-NE 3.25Å; N2549-R2573 PolarHBondContact OD1-NH2 3.14Å; A2550-R2573 PolarHBondContact O-NE 3.24Å; A2552-R2573 HydrophobicContact CB-CB 4.24Å; A2552-R2573 HydrophobicContact CB-CG 3.9Å; Y2571-R2573 PolarHBondContact O-N 3.07Å; Y2571-R2573 VanDerWaalsContact O-N 3.11Å; R2573-A2575 PolarHBondContact O-N 3.05Å; R2573-D2911 WeakPolarHBondContact O-CA 3.18Å; R2573-D2911 WeakPolarHBondContact O-CB 3.4Å
2574	P	75.1	Confident	63.4	Low	29.4 Å²	29.4	91.1 Å²	91.1	19%	0.191	46%	0.456	C	S	.	.	P	Polyproline II helix	trans	-54.3	135.6	167.1	-20.4	31.3	0	0	0	109.7	A2550 S2551 I2572 T2576 D2911 W3369 Q3372 V3373	A2550-P2574 HydrophobicContact CB-CB 4.09Å; A2550-P2574 HydrophobicContact CB-CG 4.01Å; S2551-P2574 WeakPolarHBondContact O-CD 3.29Å; I2572-P2574 WeakPolarHBondContact O-CD 3.44Å; P2574-T2576 PolarHBondContact O-N 3.15Å; P2574-D2911 CarbonylContact C-O 3.51Å; P2574-D2911 VanDerWaalsContact CA-O 3.27Å; P2574-D2911 WeakPolarHBondContact CA-O 3.38Å; P2574-W3369 HydrophobicContact CB-CE3 4.24Å; P2574-W3369 HydrophobicContact CB-CZ3 3.81Å; P2574-Q3372 HydrophobicContact CG-CB 4.33Å; P2574-V3373 HydrophobicContact CG-CG1 4.11Å
2575	A	81	Confident	65.7	Low	16.6 Å²	16.6	82.9 Å²	82.9	14%	0.137	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-60.5	135.2	-178.8	0	0	0	0	0	110	R2573 L2577 W2592 D2911 R2912 W3369	R2573-A2575 PolarHBondContact O-N 3.05Å; A2575-L2577 PolarHBondContact O-N 3.04Å; A2575-W2592 VanDerWaalsContact O-CD1 3.29Å; A2575-W2592 PolarHBondContact O-NE1 3.13Å; A2575-W2592 VanDerWaalsContact O-NE1 3.14Å; A2575-D2911 HydrophobicContact CB-CB 3.88Å; A2575-D2911 PolarHBondContact N-O 3.05Å; A2575-R2912 HydrophobicContact CB-CG 4.17Å; A2575-W3369 WeakPolarHBondContact O-CH2 3.25Å; A2575-W3369 WeakPolarHBondContact O-CZ3 3.38Å
2576	T	86.2	Confident	68.3	Low	40.4 Å²	40.4	74.8 Å²	74.8	25%	0.248	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-59.8	134	173.6	-53.6	0	0	0	0	109.5	I2547 F2548 N2549 P2574 I2578 G2593	I2547-T2576 HydrophobicContact CG2-CG2 3.51Å; I2547-T2576 VanDerWaalsContact CG2-CG2 3.48Å; F2548-T2576 WeakPolarHBondContact O-CA 3.43Å; F2548-T2576 VanDerWaalsContact O-CG2 3.3Å; F2548-T2576 WeakPolarHBondContact O-CG2 3.25Å; N2549-T2576 HydrophobicContact CB-CG2 4.36Å; N2549-T2576 PolarHBondContact OD1-OG1 2.9Å; P2574-T2576 PolarHBondContact O-N 3.15Å; T2576-I2578 HydrophobicContact CG2-CG1 4.07Å; T2576-G2593 PolarHBondContact O-N 3.07Å
2577	L	89.6	Confident	71	Confident	27.6 Å²	27.6	71.6 Å²	71.6	15%	0.145	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	122.2	172.4	174.3	72	0	0	0	108.5	I2547 F2548 A2575 L2579 V2590 E2591 W2592 L3359 A3362 M3363 W3369	I2547-L2577 CarbonylContact C-O 3.52Å; I2547-L2577 VanDerWaalsContact CA-O 3.32Å; I2547-L2577 WeakPolarHBondContact CA-O 3.29Å; F2548-L2577 HydrophobicContact CB-CB 4.18Å; F2548-L2577 HydrophobicContact CD2-CB 4.44Å; F2548-L2577 HydrophobicContact CD2-CD2 3.86Å; F2548-L2577 HydrophobicContact CD2-CG 4.29Å; F2548-L2577 HydrophobicContact CE2-CD2 4.34Å; F2548-L2577 HydrophobicContact CG-CD2 4.4Å; F2548-L2577 PolarHBondContact N-O 2.87Å; F2548-L2577 PolarHBondContact O-N 3.06Å; F2548-L2577 VanDerWaalsContact O-N 3.1Å; A2575-L2577 PolarHBondContact O-N 3.04Å; L2577-L2579 HydrophobicContact CD1-CD2 4.21Å; L2577-L2579 HydrophobicContact CD2-CD2 4.33Å; L2577-L2579 HydrophobicContact CG-CD2 4.14Å; L2577-L2579 HydrophobicContact CG-CG 4.45Å; L2577-V2590 HydrophobicContact CD1-CG1 3.46Å; L2577-V2590 VanDerWaalsContact CD1-CG1 3.46Å; L2577-E2591 CarbonylContact C-O 3.51Å; L2577-E2591 WeakPolarHBondContact CA-O 3.39Å; L2577-W2592 HydrophobicContact CB-CG 4.41Å; L2577-W2592 HydrophobicContact CD1-CB 3.77Å; L2577-W2592 HydrophobicContact CD1-CD2 4.25Å; L2577-W2592 HydrophobicContact CD1-CG 3.96Å; L2577-L3359 HydrophobicContact CD1-CD1 3.7Å; L2577-A3362 HydrophobicContact CD2-CB 4.23Å; L2577-M3363 HydrophobicContact CD2-CG 3.88Å; L2577-W3369 HydrophobicContact CB-CH2 3.84Å; L2577-W3369 HydrophobicContact CB-CZ2 3.56Å; L2577-W3369 HydrophobicContact CD2-CZ2 3.86Å; L2577-W3369 HydrophobicContact CG-CZ2 4.37Å
2578	I	91.4	Very high	73.8	Confident	56.6 Å²	56.6	66.9 Å²	66.9	29%	0.29	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	130.3	178.9	-54.8	173.4	0	0	0	108.2	M2546 I2547 T2576 V2590 E2591	M2546-I2578 CarbonylContact O-C 3.58Å; M2546-I2578 VanDerWaalsContact O-CA 3.27Å; M2546-I2578 WeakPolarHBondContact O-CA 3.34Å; I2547-I2578 HydrophobicContact CG1-CG1 4.47Å; I2547-I2578 HydrophobicContact CG1-CG2 4.46Å; I2547-I2578 HydrophobicContact CG2-CG1 4.47Å; T2576-I2578 HydrophobicContact CG2-CG1 4.07Å; I2578-V2590 CarbonylContact O-C 3.56Å; I2578-V2590 WeakPolarHBondContact O-CA 3.36Å; I2578-E2591 HydrophobicContact CB-CB 4.24Å; I2578-E2591 PolarHBondContact N-O 2.92Å; I2578-E2591 PolarHBondContact O-N 3.14Å
2579	L	92.2	Very high	76.4	Confident	13.6 Å²	13.6	58.2 Å²	58.2	7%	0.071	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	130.7	178.9	-54.6	179.9	0	0	0	108.8	P2545 M2546 F2548 L2577 Y2581 L2587 A2589 V2590 M3363	P2545-L2579 HydrophobicContact CB-CD1 4.34Å; P2545-L2579 HydrophobicContact CG-CD1 4.32Å; P2545-L2579 WeakPolarHBondContact O-CB 3.43Å; P2545-L2579 WeakPolarHBondContact O-CD1 3.31Å; M2546-L2579 WeakPolarHBondContact CG-O 3.46Å; M2546-L2579 PolarHBondContact O-N 3.2Å; F2548-L2579 HydrophobicContact CD2-CD1 4.45Å; F2548-L2579 HydrophobicContact CE2-CD1 3.77Å; F2548-L2579 HydrophobicContact CE2-CG 4.41Å; L2577-L2579 HydrophobicContact CD1-CD2 4.21Å; L2577-L2579 HydrophobicContact CD2-CD2 4.33Å; L2577-L2579 HydrophobicContact CG-CD2 4.14Å; L2577-L2579 HydrophobicContact CG-CG 4.45Å; L2579-Y2581 HydrophobicContact CB-CE2 4.07Å; L2579-Y2581 WeakPolarHBondContact CD1-OH 3.42Å; L2579-L2587 HydrophobicContact CB-CD1 3.99Å; L2579-L2587 HydrophobicContact CB-CD2 4.14Å; L2579-L2587 HydrophobicContact CD2-CD1 4.09Å; L2579-L2587 HydrophobicContact CD2-CD2 4.19Å; L2579-L2587 HydrophobicContact CG-CD1 4.46Å; L2579-A2589 WeakPolarHBondContact CA-O 3.41Å; L2579-V2590 HydrophobicContact CD2-CB 4.19Å; L2579-V2590 HydrophobicContact CD2-CG1 3.8Å; L2579-V2590 HydrophobicContact CD2-CG2 3.68Å; L2579-M3363 HydrophobicContact CD2-CG 4.06Å; L2579-M3363 HydrophobicContact CD2-SD 4.04Å
2580	A	90.1	Very high	78.9	Confident	32.4 Å²	32.4	55.5 Å²	55.5	27%	0.268	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	147.1	171	0	0	0	0	0	109.9	L2587 S2588 A2589	A2580-L2587 CarbonylContact O-C 3.5Å; A2580-L2587 WeakPolarHBondContact O-CD1 3.39Å; A2580-S2588 VanDerWaalsContact C-OG 3.3Å; A2580-S2588 PolarHBondContact O-N 3.07Å; A2580-S2588 PolarHBondContact O-OG 2.94Å; A2580-A2589 HydrophobicContact CB-CB 4.1Å; A2580-A2589 PolarHBondContact N-O 3.18Å; A2580-A2589 PolarHBondContact O-N 3.1Å
2581	Y	86.4	Confident	81.2	Confident	42.6 Å²	42.6	52.6 Å²	52.6	17%	0.167	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	151.1	-179	-57.8	-89.9	0	0	0	111	Q2544 P2545 M2546 L2579 G2585 H2586 L2587 S2588	Q2544-Y2581 HydrophobicContact CB-CD2 4.07Å; Q2544-Y2581 HydrophobicContact CB-CE1 4.31Å; Q2544-Y2581 HydrophobicContact CB-CE2 3.73Å; Q2544-Y2581 HydrophobicContact CB-CG 4.46Å; P2545-Y2581 WeakPolarHBondContact CD-OH 3.43Å; P2545-Y2581 VanDerWaalsContact O-CE2 3.25Å; P2545-Y2581 WeakPolarHBondContact O-CE2 3.36Å; P2545-Y2581 VanDerWaalsContact O-CZ 3.3Å; P2545-Y2581 PolarHBondContact O-OH 2.95Å; M2546-Y2581 HydrophobicContact CG-CE2 4.33Å; L2579-Y2581 HydrophobicContact CB-CE2 4.07Å; L2579-Y2581 WeakPolarHBondContact CD1-OH 3.42Å; Y2581-G2585 WeakPolarHBondContact CD1-O 3.47Å; Y2581-H2586 CarbonylContact C-O 3.57Å; Y2581-H2586 VanDerWaalsContact CA-O 3.27Å; Y2581-H2586 WeakPolarHBondContact CA-O 3.37Å; Y2581-L2587 HydrophobicContact CD1-CB 4.39Å; Y2581-L2587 HydrophobicContact CD1-CD1 4.27Å; Y2581-L2587 HydrophobicContact CD1-CD2 4.17Å; Y2581-L2587 HydrophobicContact CD1-CG 4.26Å; Y2581-L2587 HydrophobicContact CE1-CB 4.37Å; Y2581-L2587 HydrophobicContact CE1-CD1 3.86Å; Y2581-L2587 HydrophobicContact CE1-CD2 3.7Å; Y2581-L2587 HydrophobicContact CE1-CG 3.93Å; Y2581-S2588 WeakPolarHBondContact CA-OG 3.35Å; Y2581-S2588 PolarHBondContact N-OG 2.95Å; Y2581-S2588 PolarHBondContact O-OG 3.08Å
2582	T	83.3	Confident	83.1	Confident	31.4 Å²	31.4	49 Å²	49	19%	0.193	25%	0.253	C	S	.	.			trans	-69.6	167.4	167.4	63.9	0	0	0	0	110.4	E2277 T2584 G2585 H2586 S2588 Y2601	E2277-T2582 HydrophobicContact CB-CG2 4.14Å; T2582-T2584 PolarHBondContact O-N 3.05Å; T2582-T2584 VanDerWaalsContact O-N 3.1Å; T2582-T2584 PolarHBondContact OG1-N 3.46Å; T2582-T2584 PolarHBondContact OG1-OG1 3.05Å; T2582-G2585 WeakPolarHBondContact O-CA 3.48Å; T2582-G2585 PolarHBondContact O-N 3.01Å; T2582-G2585 PolarHBondContact OG1-N 2.99Å; T2582-H2586 HydrophobicContact CG2-CB 4.33Å; T2582-H2586 PolarHBondContact N-O 3.05Å; T2582-H2586 WeakPolarHBondContact OG1-CB 3.26Å; T2582-H2586 PolarHBondContact OG1-N 2.98Å; T2582-H2586 VanDerWaalsContact OG1-N 3.08Å; T2582-H2586 PolarHBondContact OG1-O 3.22Å; T2582-H2586 VanDerWaalsContact OG1-O 3.09Å; T2582-S2588 VanDerWaalsContact CG2-CB 3.48Å; T2582-S2588 PolarHBondContact N-OG 2.95Å; T2582-Y2601 HydrophobicContact CG2-CD2 3.9Å; T2582-Y2601 HydrophobicContact CG2-CE2 4.05Å
2583	K	73.7	Confident	84.2	Confident	178.4 Å²	178.4	47 Å²	47	78%	0.776	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-23.1	174	-51.3	-171.4	-179.3	174	0	113.6	R2280 G2585	R2280-K2583 HydrophobicContact CG-CD 3.88Å; R2280-K2583 HydrophobicContact CG-CG 3.68Å; R2280-K2583 VanDerWaalsContact CZ-CG 3.48Å; R2280-K2583 VanDerWaalsContact NH2-CA 3.27Å; K2583-G2585 VanDerWaalsContact C-N 3.31Å
2584	T	75.2	Confident	84.7	Confident	60.8 Å²	60.8	47.4 Å²	47.4	37%	0.373	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	1.8	178.3	49.8	0	0	0	0	112.8	T2582 H2586 N2605	T2582-T2584 PolarHBondContact O-N 3.05Å; T2582-T2584 VanDerWaalsContact O-N 3.1Å; T2582-T2584 PolarHBondContact OG1-N 3.46Å; T2582-T2584 PolarHBondContact OG1-OG1 3.05Å; T2584-H2586 PolarHBondContact OG1-CD2 2.94Å; T2584-H2586 VanDerWaalsContact OG1-CD2 3.29Å; T2584-N2605 WeakPolarHBondContact CB-OD1 3.48Å; T2584-N2605 WeakPolarHBondContact CG2-OD1 3.42Å; T2584-N2605 PolarHBondContact OG1-OD1 3.03Å
2585	G	78.8	Confident	84.9	Confident	19 Å²	19	46.5 Å²	46.5	20%	0.196	26%	0.257	C	S	.	.	S	Bend	trans	89.4	3.4	174.9	0	0	0	0	0	115.4	Q2544 Y2581 T2582 K2583	Q2544-G2585 PolarHBondContact NE2-O 2.89Å; Y2581-G2585 WeakPolarHBondContact CD1-O 3.47Å; T2582-G2585 WeakPolarHBondContact O-CA 3.48Å; T2582-G2585 PolarHBondContact O-N 3.01Å; T2582-G2585 PolarHBondContact OG1-N 2.99Å; K2583-G2585 VanDerWaalsContact C-N 3.31Å
2586	H	84.9	Confident	85.1	Confident	43.8 Å²	43.8	47.5 Å²	47.5	20%	0.203	26%	0.262	C	S	.	.			trans	-77.9	147.4	173.8	-60.7	-63.9	0	0	0	111.7	T2220 Y2581 T2582 T2584 S2588 Y2601 N2605	T2220-H2586 WeakPolarHBondContact CG2-CE1 3.28Å; T2220-H2586 WeakPolarHBondContact CG2-NE2 3.36Å; Y2581-H2586 CarbonylContact C-O 3.57Å; Y2581-H2586 VanDerWaalsContact CA-O 3.27Å; Y2581-H2586 WeakPolarHBondContact CA-O 3.37Å; T2582-H2586 HydrophobicContact CG2-CB 4.33Å; T2582-H2586 PolarHBondContact N-O 3.05Å; T2582-H2586 WeakPolarHBondContact OG1-CB 3.26Å; T2582-H2586 PolarHBondContact OG1-N 2.98Å; T2582-H2586 VanDerWaalsContact OG1-N 3.08Å; T2582-H2586 PolarHBondContact OG1-O 3.22Å; T2582-H2586 VanDerWaalsContact OG1-O 3.09Å; T2584-H2586 PolarHBondContact OG1-CD2 2.94Å; T2584-H2586 VanDerWaalsContact OG1-CD2 3.29Å; H2586-S2588 PolarHBondContact O-N 3.04Å; H2586-S2588 VanDerWaalsContact O-N 3.15Å; H2586-Y2601 HydrophobicContact CB-CD1 4.48Å; H2586-Y2601 HydrophobicContact CB-CD2 4.32Å; H2586-Y2601 HydrophobicContact CB-CE1 4.08Å; H2586-Y2601 HydrophobicContact CB-CE2 3.79Å; H2586-Y2601 VanDerWaalsContact CB-CZ 3.47Å; H2586-N2605 WeakPolarHBondContact NE2-CB 3.43Å
2587	L	88.6	Confident	85.2	Confident	42.4 Å²	42.4	47 Å²	47	22%	0.222	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	123	177.3	-137.1	104.7	0	0	0	110.4	L2579 A2580 Y2581 V2590 F2599 Y2601 M3363	L2579-L2587 HydrophobicContact CB-CD1 3.99Å; L2579-L2587 HydrophobicContact CB-CD2 4.14Å; L2579-L2587 HydrophobicContact CD2-CD1 4.09Å; L2579-L2587 HydrophobicContact CD2-CD2 4.19Å; L2579-L2587 HydrophobicContact CG-CD1 4.46Å; A2580-L2587 CarbonylContact O-C 3.5Å; A2580-L2587 WeakPolarHBondContact O-CD1 3.39Å; Y2581-L2587 HydrophobicContact CD1-CB 4.39Å; Y2581-L2587 HydrophobicContact CD1-CD1 4.27Å; Y2581-L2587 HydrophobicContact CD1-CD2 4.17Å; Y2581-L2587 HydrophobicContact CD1-CG 4.26Å; Y2581-L2587 HydrophobicContact CE1-CB 4.37Å; Y2581-L2587 HydrophobicContact CE1-CD1 3.86Å; Y2581-L2587 HydrophobicContact CE1-CD2 3.7Å; Y2581-L2587 HydrophobicContact CE1-CG 3.93Å; L2587-V2590 HydrophobicContact CD1-CG2 4.12Å; L2587-V2590 HydrophobicContact CD2-CG2 3.74Å; L2587-V2590 VanDerWaalsContact CD2-CG2 3.45Å; L2587-V2590 HydrophobicContact CG-CG2 3.95Å; L2587-F2599 HydrophobicContact CB-CD2 4.45Å; L2587-F2599 HydrophobicContact CD2-CD2 4.31Å; L2587-F2599 HydrophobicContact CD2-CE2 3.96Å; L2587-F2599 HydrophobicContact CD2-CZ 4.4Å; L2587-F2599 HydrophobicContact CG-CD2 4.37Å; L2587-F2599 HydrophobicContact CG-CE2 4.41Å; L2587-F2599 VanDerWaalsContact O-CB 3.31Å; L2587-F2599 WeakPolarHBondContact O-CB 3.22Å; L2587-Y2601 VanDerWaalsContact O-CE2 3.3Å; L2587-Y2601 WeakPolarHBondContact O-CE2 3.28Å; L2587-Y2601 PolarHBondContact O-OH 3.38Å; L2587-M3363 HydrophobicContact CD2-SD 4.47Å
2588	S	89.7	Confident	85.3	Confident	25.8 Å²	25.8	49 Å²	49	18%	0.18	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	-26.4	-179	68.6	0	0	0	0	115.1	E2277 A2580 Y2581 T2582 H2586 F2599	E2277-S2588 WeakPolarHBondContact OE1-CA 3.06Å; E2277-S2588 VanDerWaalsContact OE2-C 3.27Å; E2277-S2588 WeakPolarHBondContact OE2-CA 3.5Å; E2277-S2588 WeakPolarHBondContact OE2-CB 3.48Å; A2580-S2588 VanDerWaalsContact C-OG 3.3Å; A2580-S2588 PolarHBondContact O-N 3.07Å; A2580-S2588 PolarHBondContact O-OG 2.94Å; Y2581-S2588 WeakPolarHBondContact CA-OG 3.35Å; Y2581-S2588 PolarHBondContact N-OG 2.95Å; Y2581-S2588 PolarHBondContact O-OG 3.08Å; T2582-S2588 VanDerWaalsContact CG2-CB 3.48Å; T2582-S2588 PolarHBondContact N-OG 2.95Å; H2586-S2588 PolarHBondContact O-N 3.04Å; H2586-S2588 VanDerWaalsContact O-N 3.15Å; S2588-F2599 PolarHBondContact O-N 2.91Å
2589	A	90.8	Very high	85.3	Confident	13 Å²	13	48.1 Å²	48.1	11%	0.107	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	150.4	173	0	0	0	0	0	109.7	L2579 A2580 Y2597	L2579-A2589 WeakPolarHBondContact CA-O 3.41Å; A2580-A2589 HydrophobicContact CB-CB 4.1Å; A2580-A2589 PolarHBondContact N-O 3.18Å; A2580-A2589 PolarHBondContact O-N 3.1Å; A2589-Y2597 CarbonylContact C-O 3.55Å; A2589-Y2597 VanDerWaalsContact CA-O 3.24Å; A2589-Y2597 WeakPolarHBondContact CA-O 3.27Å
2590	V	91	Very high	85.3	Confident	11.6 Å²	11.6	49.7 Å²	49.7	7%	0.07	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	122	170.7	179	0	0	0	0	107.3	L2577 I2578 L2579 L2587 S2596 Y2597 F2599 L3359 M3363	L2577-V2590 HydrophobicContact CD1-CG1 3.46Å; L2577-V2590 VanDerWaalsContact CD1-CG1 3.46Å; I2578-V2590 CarbonylContact O-C 3.56Å; I2578-V2590 WeakPolarHBondContact O-CA 3.36Å; L2579-V2590 HydrophobicContact CD2-CB 4.19Å; L2579-V2590 HydrophobicContact CD2-CG1 3.8Å; L2579-V2590 HydrophobicContact CD2-CG2 3.68Å; L2587-V2590 HydrophobicContact CD1-CG2 4.12Å; L2587-V2590 HydrophobicContact CD2-CG2 3.74Å; L2587-V2590 VanDerWaalsContact CD2-CG2 3.45Å; L2587-V2590 HydrophobicContact CG-CG2 3.95Å; V2590-S2596 CarbonylContact O-C 3.54Å; V2590-S2596 VanDerWaalsContact O-CA 3.3Å; V2590-S2596 WeakPolarHBondContact O-CA 3.37Å; V2590-Y2597 HydrophobicContact CB-CD2 3.93Å; V2590-Y2597 HydrophobicContact CB-CG 4.41Å; V2590-Y2597 HydrophobicContact CG1-CD2 4.02Å; V2590-Y2597 HydrophobicContact CG1-CE2 4.46Å; V2590-Y2597 PolarHBondContact N-O 3.02Å; V2590-Y2597 WeakPolarHBondContact O-CD2 3.33Å; V2590-Y2597 PolarHBondContact O-N 3.04Å; V2590-F2599 HydrophobicContact CG2-CE2 3.98Å; V2590-L3359 HydrophobicContact CG1-CD1 4.05Å; V2590-L3359 HydrophobicContact CG1-CD2 4.4Å; V2590-M3363 HydrophobicContact CG1-SD 4.17Å; V2590-M3363 HydrophobicContact CG2-SD 3.88Å
2591	E	88.6	Confident	85.3	Confident	79 Å²	79	50.5 Å²	50.5	37%	0.369	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	122.1	171.7	-58.7	-177.3	163	0	0	108.4	L2577 I2578 T2595	L2577-E2591 CarbonylContact C-O 3.51Å; L2577-E2591 WeakPolarHBondContact CA-O 3.39Å; I2578-E2591 HydrophobicContact CB-CB 4.24Å; I2578-E2591 PolarHBondContact N-O 2.92Å; I2578-E2591 PolarHBondContact O-N 3.14Å; E2591-T2595 CarbonylContact C-O 3.56Å; E2591-T2595 VanDerWaalsContact CA-O 3.25Å; E2591-T2595 WeakPolarHBondContact CA-O 3.3Å
2592	W	85.5	Confident	85.4	Confident	65.2 Å²	65.2	50.1 Å²	50.1	25%	0.247	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	99.8	177	-168.6	20.3	0	0	0	109.6	A2575 L2577 N2594 T2595 R2912 L3359 W3368	A2575-W2592 VanDerWaalsContact O-CD1 3.29Å; A2575-W2592 PolarHBondContact O-NE1 3.13Å; A2575-W2592 VanDerWaalsContact O-NE1 3.14Å; L2577-W2592 HydrophobicContact CB-CG 4.41Å; L2577-W2592 HydrophobicContact CD1-CB 3.77Å; L2577-W2592 HydrophobicContact CD1-CD2 4.25Å; L2577-W2592 HydrophobicContact CD1-CG 3.96Å; W2592-N2594 PolarHBondContact O-N 2.9Å; W2592-N2594 VanDerWaalsContact O-N 3.13Å; W2592-T2595 PolarHBondContact N-O 2.94Å; W2592-T2595 PolarHBondContact O-N 3.15Å; W2592-T2595 VanDerWaalsContact O-N 3.11Å; W2592-T2595 PolarHBondContact O-OG1 2.82Å; W2592-R2912 HydrophobicContact CD2-CG 4.23Å; W2592-R2912 HydrophobicContact CH2-CB 4.38Å; W2592-R2912 HydrophobicContact CZ2-CB 4.19Å; W2592-R2912 HydrophobicContact CZ2-CG 4.27Å; W2592-L3359 HydrophobicContact CB-CD1 4.21Å; W2592-L3359 HydrophobicContact CD2-CD1 4.04Å; W2592-L3359 HydrophobicContact CE3-CB 4.1Å; W2592-L3359 HydrophobicContact CE3-CD1 3.66Å; W2592-L3359 HydrophobicContact CE3-CG 4.37Å; W2592-L3359 HydrophobicContact CG-CD1 4.3Å; W2592-L3359 HydrophobicContact CZ3-CB 4.03Å; W2592-L3359 HydrophobicContact CZ3-CD1 4.35Å; W2592-W3368 HydrophobicContact CH2-CH2 4.21Å; W2592-W3368 HydrophobicContact CH2-CZ2 4.3Å; W2592-W3368 AromaticContact CZ2-CH2 3.66Å; W2592-W3368 HydrophobicContact CZ2-CH2 3.66Å; W2592-W3368 HydrophobicContact CZ2-CZ2 4.2Å
2593	G	79.2	Confident	85.5	Confident	34.2 Å²	34.2	55.5 Å²	55.5	35%	0.353	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.5	-119.6	-168.2	0	0	0	0	0	110.8	T2576 T2595	T2576-G2593 PolarHBondContact O-N 3.07Å; G2593-T2595 VanDerWaalsContact C-N 3.28Å; G2593-T2595 PolarHBondContact O-N 3.14Å
2594	N	78.1	Confident	86	Confident	131.6 Å²	131.6	51.3 Å²	51.3	70%	0.704	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-2.2	178.9	-66.3	-12	0	0	0	113.9	W2592 P2939 N2940	W2592-N2594 PolarHBondContact O-N 2.9Å; W2592-N2594 VanDerWaalsContact O-N 3.13Å; N2594-P2939 HydrophobicContact CB-CB 3.57Å; N2594-P2939 VanDerWaalsContact CB-CB 3.42Å; N2594-P2939 WeakPolarHBondContact CB-O 3.05Å; N2594-N2940 PolarHBondContact O-OD1 3.13Å; N2594-N2940 VanDerWaalsContact O-OD1 3.06Å
2595	T	79.3	Confident	86.5	Confident	11.4 Å²	11.4	50.7 Å²	50.7	7%	0.07	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	136.5	178	28.1	0	0	0	0	111.3	E2591 W2592 G2593 Y2597 R2912 P2939 N2940	E2591-T2595 CarbonylContact C-O 3.56Å; E2591-T2595 VanDerWaalsContact CA-O 3.25Å; E2591-T2595 WeakPolarHBondContact CA-O 3.3Å; W2592-T2595 PolarHBondContact N-O 2.94Å; W2592-T2595 PolarHBondContact O-N 3.15Å; W2592-T2595 VanDerWaalsContact O-N 3.11Å; W2592-T2595 PolarHBondContact O-OG1 2.82Å; G2593-T2595 VanDerWaalsContact C-N 3.28Å; G2593-T2595 PolarHBondContact O-N 3.14Å; T2595-Y2597 HydrophobicContact CG2-CD2 4.29Å; T2595-Y2597 HydrophobicContact CG2-CE1 4.44Å; T2595-Y2597 HydrophobicContact CG2-CE2 4Å; T2595-Y2597 WeakPolarHBondContact OG1-CE2 3.26Å; T2595-Y2597 PolarHBondContact OG1-OH 2.93Å; T2595-R2912 PolarHBondContact OG1-NE 3.01Å; T2595-R2912 PolarHBondContact OG1-NH1 3.04Å; T2595-P2939 PolarHBondContact OG1-O 2.7Å; T2595-N2940 WeakPolarHBondContact CA-OD1 3.46Å; T2595-N2940 VanDerWaalsContact CG2-CA 3.44Å; T2595-N2940 HydrophobicContact CG2-CB 4.11Å; T2595-N2940 WeakPolarHBondContact CG2-O 3.21Å
2596	S	84.9	Confident	86.8	Confident	36 Å²	36	51.8 Å²	51.8	25%	0.252	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	134.1	173.5	59	0	0	0	0	111.2	V2590 H2598 G2613	V2590-S2596 CarbonylContact O-C 3.54Å; V2590-S2596 VanDerWaalsContact O-CA 3.3Å; V2590-S2596 WeakPolarHBondContact O-CA 3.37Å; S2596-H2598 PolarHBondContact OG-CE1 2.6Å; S2596-H2598 PolarHBondContact OG-NE2 2.88Å; S2596-G2613 VanDerWaalsContact O-CA 3.28Å; S2596-G2613 WeakPolarHBondContact O-CA 3.33Å; S2596-G2613 PolarHBondContact O-N 3.04Å
2597	Y	88.3	Confident	87	Confident	30.2 Å²	30.2	51.3 Å²	51.3	12%	0.118	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	135.9	173.6	-50.1	-98.4	0	0	0	107.8	A2589 V2590 T2595 D2611 L2612 R2912 L2942 F3356 L3359	A2589-Y2597 CarbonylContact C-O 3.55Å; A2589-Y2597 VanDerWaalsContact CA-O 3.24Å; A2589-Y2597 WeakPolarHBondContact CA-O 3.27Å; V2590-Y2597 HydrophobicContact CB-CD2 3.93Å; V2590-Y2597 HydrophobicContact CB-CG 4.41Å; V2590-Y2597 HydrophobicContact CG1-CD2 4.02Å; V2590-Y2597 HydrophobicContact CG1-CE2 4.46Å; V2590-Y2597 PolarHBondContact N-O 3.02Å; V2590-Y2597 WeakPolarHBondContact O-CD2 3.33Å; V2590-Y2597 PolarHBondContact O-N 3.04Å; T2595-Y2597 HydrophobicContact CG2-CD2 4.29Å; T2595-Y2597 HydrophobicContact CG2-CE1 4.44Å; T2595-Y2597 HydrophobicContact CG2-CE2 4Å; T2595-Y2597 WeakPolarHBondContact OG1-CE2 3.26Å; T2595-Y2597 PolarHBondContact OG1-OH 2.93Å; Y2597-D2611 VanDerWaalsContact CA-O 3.23Å; Y2597-D2611 WeakPolarHBondContact CA-O 3.25Å; Y2597-L2612 HydrophobicContact CD1-CB 4.4Å; Y2597-L2612 HydrophobicContact CD1-CD2 4.26Å; Y2597-R2912 PolarHBondContact OH-NH2 2.66Å; Y2597-L2942 WeakPolarHBondContact OH-CD1 3.41Å; Y2597-F3356 HydrophobicContact CD1-CD2 4.23Å; Y2597-F3356 AromaticContact CD1-CE2 3.8Å; Y2597-F3356 HydrophobicContact CD1-CE2 3.8Å; Y2597-F3356 AromaticContact CE1-CD2 3.76Å; Y2597-F3356 HydrophobicContact CE1-CD2 3.76Å; Y2597-F3356 AromaticContact CE1-CE2 3.82Å; Y2597-F3356 HydrophobicContact CE1-CE2 3.82Å; Y2597-L3359 HydrophobicContact CD1-CD2 4.25Å; Y2597-L3359 HydrophobicContact CD2-CD2 3.82Å; Y2597-L3359 HydrophobicContact CE1-CD2 3.93Å; Y2597-L3359 HydrophobicContact CE2-CD2 3.43Å; Y2597-L3359 VanDerWaalsContact CE2-CD2 3.43Å; Y2597-L3359 HydrophobicContact CG-CD2 4.25Å
2598	H	91.1	Very high	87.1	Confident	70.6 Å²	70.6	54.8 Å²	54.8	33%	0.327	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	137.6	-179.5	-62.6	-59.1	0	0	0	110.7	E2277 S2596 A2610 D2611	E2277-H2598 VanDerWaalsContact OE1-C 3.28Å; E2277-H2598 WeakPolarHBondContact OE1-CA 3.47Å; E2277-H2598 WeakPolarHBondContact OE1-CB 3.29Å; E2277-H2598 IonicContact OE1-ND1 2.82Å; S2596-H2598 PolarHBondContact OG-CE1 2.6Å; S2596-H2598 PolarHBondContact OG-NE2 2.88Å; H2598-A2610 CarbonylContact O-C 3.54Å; H2598-A2610 VanDerWaalsContact O-CA 3.29Å; H2598-A2610 WeakPolarHBondContact O-CA 3.28Å; H2598-D2611 HydrophobicContact CB-CB 4.27Å; H2598-D2611 PolarHBondContact N-O 3.06Å; H2598-D2611 VanDerWaalsContact N-O 3.14Å; H2598-D2611 PolarHBondContact O-N 3.04Å
2599	F	92.1	Very high	87.2	Confident	37.6 Å²	37.6	54.6 Å²	54.6	17%	0.165	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	117.9	-178.1	-56.1	-86.2	0	0	0	109.8	E2277 L2587 S2588 V2590 Y2601 L2607 A2609 A2610 L2612	E2277-F2599 PolarHBondContact OE1-N 3.13Å; E2277-F2599 WeakPolarHBondContact OE2-CA 3.45Å; E2277-F2599 WeakPolarHBondContact OE2-CB 3.43Å; E2277-F2599 PolarHBondContact OE2-N 2.89Å; L2587-F2599 HydrophobicContact CB-CD2 4.45Å; L2587-F2599 HydrophobicContact CD2-CD2 4.31Å; L2587-F2599 HydrophobicContact CD2-CE2 3.96Å; L2587-F2599 HydrophobicContact CD2-CZ 4.4Å; L2587-F2599 HydrophobicContact CG-CD2 4.37Å; L2587-F2599 HydrophobicContact CG-CE2 4.41Å; L2587-F2599 VanDerWaalsContact O-CB 3.31Å; L2587-F2599 WeakPolarHBondContact O-CB 3.22Å; S2588-F2599 PolarHBondContact O-N 2.91Å; V2590-F2599 HydrophobicContact CG2-CE2 3.98Å; F2599-Y2601 HydrophobicContact CB-CE2 3.97Å; F2599-Y2601 WeakPolarHBondContact CB-OH 3.46Å; F2599-Y2601 WeakPolarHBondContact O-CD2 3.24Å; F2599-Y2601 WeakPolarHBondContact O-CE2 3.44Å; F2599-Y2601 PolarHBondContact O-N 2.97Å; F2599-L2607 HydrophobicContact CB-CD1 4.12Å; F2599-L2607 HydrophobicContact CD1-CD1 4.15Å; F2599-A2609 CarbonylContact C-O 3.48Å; F2599-A2609 VanDerWaalsContact CA-O 3.32Å; F2599-A2609 WeakPolarHBondContact CA-O 2.97Å; F2599-A2610 HydrophobicContact CD1-CB 3.77Å; F2599-A2610 HydrophobicContact CE1-CB 3.95Å; F2599-L2612 HydrophobicContact CE1-CD2 4.32Å
2600	S	92.3	Very high	87.1	Confident	47 Å²	47	54.1 Å²	54.1	33%	0.329	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	140.3	176.1	64.9	0	0	0	0	110.8	K2608 A2609	S2600-K2608 WeakPolarHBondContact O-CB 3.37Å; S2600-K2608 PolarHBondContact O-N 3.27Å; S2600-A2609 PolarHBondContact N-O 2.87Å; S2600-A2609 PolarHBondContact O-N 2.93Å; S2600-A2609 VanDerWaalsContact O-N 3.09Å; S2600-A2609 VanDerWaalsContact OG-CB 3.31Å; S2600-A2609 WeakPolarHBondContact OG-CB 3.39Å; S2600-A2609 PolarHBondContact OG-N 2.86Å; S2600-A2609 VanDerWaalsContact OG-N 3.16Å; S2600-A2609 PolarHBondContact OG-O 3.1Å
2601	Y	89.7	Confident	87	Confident	48.8 Å²	48.8	56.3 Å²	56.3	19%	0.191	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	151.7	178.6	-57.4	-89.4	0	0	0	110.1	T2582 H2586 L2587 F2599 N2605 R2606 L2607 S3452	T2582-Y2601 HydrophobicContact CG2-CD2 3.9Å; T2582-Y2601 HydrophobicContact CG2-CE2 4.05Å; H2586-Y2601 HydrophobicContact CB-CD1 4.48Å; H2586-Y2601 HydrophobicContact CB-CD2 4.32Å; H2586-Y2601 HydrophobicContact CB-CE1 4.08Å; H2586-Y2601 HydrophobicContact CB-CE2 3.79Å; H2586-Y2601 VanDerWaalsContact CB-CZ 3.47Å; L2587-Y2601 VanDerWaalsContact O-CE2 3.3Å; L2587-Y2601 WeakPolarHBondContact O-CE2 3.28Å; L2587-Y2601 PolarHBondContact O-OH 3.38Å; F2599-Y2601 HydrophobicContact CB-CE2 3.97Å; F2599-Y2601 WeakPolarHBondContact CB-OH 3.46Å; F2599-Y2601 WeakPolarHBondContact O-CD2 3.24Å; F2599-Y2601 WeakPolarHBondContact O-CE2 3.44Å; F2599-Y2601 PolarHBondContact O-N 2.97Å; Y2601-N2605 WeakPolarHBondContact CD1-O 3.5Å; Y2601-R2606 CarbonylContact C-O 3.57Å; Y2601-R2606 WeakPolarHBondContact CA-O 3.3Å; Y2601-L2607 HydrophobicContact CD1-CB 4.43Å; Y2601-L2607 HydrophobicContact CD1-CD1 4.46Å; Y2601-L2607 HydrophobicContact CE1-CB 4.24Å; Y2601-L2607 HydrophobicContact CE1-CD1 3.97Å; Y2601-S3452 WeakPolarHBondContact CE1-OG 3.17Å; Y2601-S3452 PolarHBondContact OH-OG 2.95Å
2602	D	89	Confident	86.7	Confident	34.4 Å²	34.4	55.1 Å²	55.1	18%	0.184	29%	0.294	C	S	.	.			trans	-85	-176.7	171	68.7	21.3	0	0	0	112.6	L2604 N2605 R2606 K2608	D2602-L2604 PolarHBondContact O-N 3.02Å; D2602-L2604 VanDerWaalsContact O-N 3.15Å; D2602-L2604 WeakPolarHBondContact OD1-CA 3.27Å; D2602-L2604 PolarHBondContact OD1-N 3Å; D2602-N2605 WeakPolarHBondContact O-CA 3.4Å; D2602-N2605 PolarHBondContact O-N 3.11Å; D2602-N2605 PolarHBondContact OD1-N 2.86Å; D2602-R2606 PolarHBondContact N-O 3.02Å; D2602-R2606 WeakPolarHBondContact OD1-CB 3.41Å; D2602-R2606 PolarHBondContact OD1-N 2.97Å; D2602-R2606 IonicContact OD1-NE 2.98Å; D2602-R2606 PolarHBondContact OD1-NE 3.04Å; D2602-R2606 IonicContact OD2-CZ 2.76Å; D2602-R2606 IonicContact OD2-NE 3.17Å; D2602-R2606 PolarHBondContact OD2-NE 3.02Å; D2602-R2606 IonicContact OD2-NH2 3Å; D2602-R2606 PolarHBondContact OD2-NH2 3Å; D2602-K2608 HydrophobicContact CB-CB 4.36Å
2603	V	85	Confident	86.2	Confident	144.4 Å²	144.4	52.4 Å²	52.4	88%	0.875	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-22.7	-177.4	-175.7	0	0	0	0	112.6	N2605	V2603-N2605 VanDerWaalsContact C-N 3.29Å; V2603-N2605 PolarHBondContact O-N 2.81Å
2604	L	84.7	Confident	85.9	Confident	89.8 Å²	89.8	52.3 Å²	52.3	47%	0.47	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	12.9	175.9	-62.9	177.6	0	0	0	112.3	D2602 R2606 F2630	D2602-L2604 PolarHBondContact O-N 3.02Å; D2602-L2604 VanDerWaalsContact O-N 3.15Å; D2602-L2604 WeakPolarHBondContact OD1-CA 3.27Å; D2602-L2604 PolarHBondContact OD1-N 3Å; L2604-R2606 HydrophobicContact CB-CG 4.09Å; L2604-R2606 PolarHBondContact O-N 3.13Å; L2604-F2630 HydrophobicContact CB-CE1 4.36Å; L2604-F2630 WeakPolarHBondContact O-CE1 3.48Å
2605	N	83.9	Confident	85.3	Confident	48.2 Å²	48.2	51.7 Å²	51.7	26%	0.258	28%	0.278	S	S	.	.	S	Bend	trans	59.4	24.1	-174.6	-64.5	-53.3	0	0	0	114.6	T2220 T2584 H2586 Y2601 D2602 V2603	T2220-N2605 PolarHBondContact O-ND2 2.99Å; T2220-N2605 VanDerWaalsContact O-ND2 3.1Å; T2584-N2605 WeakPolarHBondContact CB-OD1 3.48Å; T2584-N2605 WeakPolarHBondContact CG2-OD1 3.42Å; T2584-N2605 PolarHBondContact OG1-OD1 3.03Å; H2586-N2605 WeakPolarHBondContact NE2-CB 3.43Å; Y2601-N2605 WeakPolarHBondContact CD1-O 3.5Å; D2602-N2605 WeakPolarHBondContact O-CA 3.4Å; D2602-N2605 PolarHBondContact O-N 3.11Å; D2602-N2605 PolarHBondContact OD1-N 2.86Å; V2603-N2605 VanDerWaalsContact C-N 3.29Å; V2603-N2605 PolarHBondContact O-N 2.81Å
2606	R	85.9	Confident	85	Confident	41.8 Å²	41.8	53.3 Å²	53.3	16%	0.158	29%	0.293	C	S	.	.			trans	-84.8	144.5	174.9	-52	175	-61.5	-170.1	4	109.9	Y2601 D2602 L2604 K2608 Y2623 P2629 F2630	Y2601-R2606 CarbonylContact C-O 3.57Å; Y2601-R2606 WeakPolarHBondContact CA-O 3.3Å; D2602-R2606 PolarHBondContact N-O 3.02Å; D2602-R2606 WeakPolarHBondContact OD1-CB 3.41Å; D2602-R2606 PolarHBondContact OD1-N 2.97Å; D2602-R2606 IonicContact OD1-NE 2.98Å; D2602-R2606 PolarHBondContact OD1-NE 3.04Å; D2602-R2606 IonicContact OD2-CZ 2.76Å; D2602-R2606 IonicContact OD2-NE 3.17Å; D2602-R2606 PolarHBondContact OD2-NE 3.02Å; D2602-R2606 IonicContact OD2-NH2 3Å; D2602-R2606 PolarHBondContact OD2-NH2 3Å; L2604-R2606 HydrophobicContact CB-CG 4.09Å; L2604-R2606 PolarHBondContact O-N 3.13Å; R2606-K2608 PolarHBondContact O-N 3.07Å; R2606-K2608 VanDerWaalsContact O-N 3.15Å; R2606-Y2623 HydrophobicContact CB-CD2 4.42Å; R2606-Y2623 HydrophobicContact CB-CE1 4.26Å; R2606-Y2623 HydrophobicContact CB-CE2 3.78Å; R2606-Y2623 VanDerWaalsContact CZ-CB 3.44Å; R2606-Y2623 VanDerWaalsContact CZ-CG 3.42Å; R2606-Y2623 VanDerWaalsContact NH1-CB 3.27Å; R2606-P2629 WeakPolarHBondContact CD-O 3.38Å; R2606-P2629 PolarHBondContact NH1-O 3.25Å; R2606-F2630 HydrophobicContact CG-CD1 3.7Å; R2606-F2630 HydrophobicContact CG-CE1 4.06Å; R2606-F2630 HydrophobicContact CG-CG 4.39Å
2607	L	89	Confident	84.8	Confident	33.6 Å²	33.6	52.4 Å²	52.4	18%	0.176	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	116.1	177.5	-177.3	65.8	0	0	0	109.5	F2599 Y2601 A2610 F2621 Y2623 F3454	F2599-L2607 HydrophobicContact CB-CD1 4.12Å; F2599-L2607 HydrophobicContact CD1-CD1 4.15Å; Y2601-L2607 HydrophobicContact CD1-CB 4.43Å; Y2601-L2607 HydrophobicContact CD1-CD1 4.46Å; Y2601-L2607 HydrophobicContact CE1-CB 4.24Å; Y2601-L2607 HydrophobicContact CE1-CD1 3.97Å; L2607-A2610 HydrophobicContact CD2-CB 4.43Å; L2607-F2621 HydrophobicContact CB-CD2 4.49Å; L2607-F2621 HydrophobicContact CD2-CD2 4.11Å; L2607-F2621 HydrophobicContact CD2-CE2 3.51Å; L2607-F2621 VanDerWaalsContact CD2-CE2 3.48Å; L2607-F2621 HydrophobicContact CD2-CZ 4.12Å; L2607-F2621 HydrophobicContact CG-CD2 3.99Å; L2607-F2621 HydrophobicContact CG-CE2 3.89Å; L2607-F2621 VanDerWaalsContact O-CB 3.32Å; L2607-F2621 WeakPolarHBondContact O-CB 3.39Å; L2607-F2621 VanDerWaalsContact O-CD2 3.31Å; L2607-F2621 WeakPolarHBondContact O-CD2 3.35Å; L2607-Y2623 VanDerWaalsContact O-CE2 3.31Å; L2607-Y2623 WeakPolarHBondContact O-CE2 3.32Å; L2607-Y2623 PolarHBondContact O-OH 2.92Å; L2607-Y2623 VanDerWaalsContact O-OH 3.07Å; L2607-F3454 HydrophobicContact CD2-CB 3.83Å; L2607-F3454 HydrophobicContact CD2-CD1 4.38Å; L2607-F3454 HydrophobicContact CD2-CD2 4.49Å; L2607-F3454 HydrophobicContact CD2-CG 3.97Å
2608	K	91.4	Very high	84.6	Confident	116.6 Å²	116.6	52.8 Å²	52.8	51%	0.507	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	-45.4	-179.1	-179.9	-176	175.6	-174.7	0	111.5	S2600 D2602 R2606 S2620 F2621	S2600-K2608 WeakPolarHBondContact O-CB 3.37Å; S2600-K2608 PolarHBondContact O-N 3.27Å; D2602-K2608 HydrophobicContact CB-CB 4.36Å; R2606-K2608 PolarHBondContact O-N 3.07Å; R2606-K2608 VanDerWaalsContact O-N 3.15Å; K2608-S2620 CarbonylContact O-C 3.55Å; K2608-S2620 VanDerWaalsContact O-CA 3.31Å; K2608-S2620 WeakPolarHBondContact O-CA 3.3Å; K2608-F2621 PolarHBondContact O-N 2.97Å
2609	A	91.4	Very high	84.5	Confident	21.2 Å²	21.2	50.7 Å²	50.7	18%	0.175	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	148.7	175.3	0	0	0	0	0	111.7	F2599 S2600 T2618 L2619	F2599-A2609 CarbonylContact C-O 3.48Å; F2599-A2609 VanDerWaalsContact CA-O 3.32Å; F2599-A2609 WeakPolarHBondContact CA-O 2.97Å; S2600-A2609 PolarHBondContact N-O 2.87Å; S2600-A2609 PolarHBondContact O-N 2.93Å; S2600-A2609 VanDerWaalsContact O-N 3.09Å; S2600-A2609 VanDerWaalsContact OG-CB 3.31Å; S2600-A2609 WeakPolarHBondContact OG-CB 3.39Å; S2600-A2609 PolarHBondContact OG-N 2.86Å; S2600-A2609 VanDerWaalsContact OG-N 3.16Å; S2600-A2609 PolarHBondContact OG-O 3.1Å; A2609-T2618 HydrophobicContact CB-CG2 4.44Å; A2609-L2619 CarbonylContact C-O 3.52Å; A2609-L2619 WeakPolarHBondContact CA-O 3.46Å; A2609-L2619 WeakPolarHBondContact CB-O 3.26Å
2610	A	89.5	Confident	84.5	Confident	2.6 Å²	2.6	50.7 Å²	50.7	2%	0.021	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	118.9	172.8	0	0	0	0	0	109.6	H2598 F2599 L2607 L2612 T2618 L2619 F3454	H2598-A2610 CarbonylContact O-C 3.54Å; H2598-A2610 VanDerWaalsContact O-CA 3.29Å; H2598-A2610 WeakPolarHBondContact O-CA 3.28Å; F2599-A2610 HydrophobicContact CD1-CB 3.77Å; F2599-A2610 HydrophobicContact CE1-CB 3.95Å; L2607-A2610 HydrophobicContact CD2-CB 4.43Å; A2610-L2612 HydrophobicContact CB-CD2 4.16Å; A2610-T2618 CarbonylContact O-C 3.52Å; A2610-T2618 WeakPolarHBondContact O-CA 3.31Å; A2610-L2619 HydrophobicContact CB-CB 4.44Å; A2610-L2619 PolarHBondContact N-O 3.01Å; A2610-L2619 PolarHBondContact O-N 3.01Å; A2610-F3454 HydrophobicContact CB-CE1 4.27Å; A2610-F3454 HydrophobicContact CB-CZ 4.48Å
2611	D	88.1	Confident	84.5	Confident	57.8 Å²	57.8	49.8 Å²	49.8	31%	0.309	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	118.8	173	-73.2	-23.4	0	0	0	108.6	Y2597 H2598 G2613 T2618	Y2597-D2611 VanDerWaalsContact CA-O 3.23Å; Y2597-D2611 WeakPolarHBondContact CA-O 3.25Å; H2598-D2611 HydrophobicContact CB-CB 4.27Å; H2598-D2611 PolarHBondContact N-O 3.06Å; H2598-D2611 VanDerWaalsContact N-O 3.14Å; H2598-D2611 PolarHBondContact O-N 3.04Å; D2611-G2613 VanDerWaalsContact C-N 3.27Å; D2611-G2613 PolarHBondContact O-N 2.99Å; D2611-G2613 PolarHBondContact OD1-N 2.82Å; D2611-G2613 VanDerWaalsContact OD1-N 3.13Å; D2611-T2618 VanDerWaalsContact OD1-CG2 3.23Å; D2611-T2618 WeakPolarHBondContact OD1-CG2 3.43Å
2612	L	81.9	Confident	84.7	Confident	54 Å²	54	52.5 Å²	52.5	28%	0.283	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	46.5	-167.2	-56.2	-179.8	0	0	0	113	Y2597 F2599 A2610 R2614 D2617 L2619 F3356 F3454	Y2597-L2612 HydrophobicContact CD1-CB 4.4Å; Y2597-L2612 HydrophobicContact CD1-CD2 4.26Å; F2599-L2612 HydrophobicContact CE1-CD2 4.32Å; A2610-L2612 HydrophobicContact CB-CD2 4.16Å; L2612-R2614 VanDerWaalsContact C-N 3.33Å; L2612-R2614 PolarHBondContact O-N 3.26Å; L2612-D2617 HydrophobicContact CB-CB 4.37Å; L2612-D2617 WeakPolarHBondContact CB-O 3.35Å; L2612-D2617 PolarHBondContact N-O 2.78Å; L2612-L2619 HydrophobicContact CD1-CD1 3.95Å; L2612-L2619 HydrophobicContact CD1-CG 4Å; L2612-F3356 HydrophobicContact CD2-CE2 3.98Å; L2612-F3356 HydrophobicContact CD2-CZ 4.09Å; L2612-F3454 HydrophobicContact CD1-CZ 4.24Å; L2612-F3454 HydrophobicContact CD2-CE1 3.99Å; L2612-F3454 HydrophobicContact CD2-CZ 4.08Å
2613	G	74.6	Confident	84.8	Confident	7.6 Å²	7.6	53 Å²	53	8%	0.078	29%	0.291	C	S	.	.	S	Bend	trans	102.3	-61.1	178.2	0	0	0	0	0	113.1	S2596 D2611 N2940	S2596-G2613 VanDerWaalsContact O-CA 3.28Å; S2596-G2613 WeakPolarHBondContact O-CA 3.33Å; S2596-G2613 PolarHBondContact O-N 3.04Å; D2611-G2613 VanDerWaalsContact C-N 3.27Å; D2611-G2613 PolarHBondContact O-N 2.99Å; D2611-G2613 PolarHBondContact OD1-N 2.82Å; D2611-G2613 VanDerWaalsContact OD1-N 3.13Å; G2613-N2940 VanDerWaalsContact O-CB 3.3Å; G2613-N2940 WeakPolarHBondContact O-CB 3.23Å; G2613-N2940 PolarHBondContact O-ND2 2.81Å
2614	R	73.2	Confident	84.8	Confident	33.2 Å²	33.2	49 Å²	49	13%	0.125	28%	0.279	C	S	.	.	S	Bend	trans	-92.7	143.8	174.1	-64.3	-176.3	-105.1	166	5.7	109.9	L2612 A2616 D2617 T2618 N2940 A2941 Q2943 H2963 G2964	L2612-R2614 VanDerWaalsContact C-N 3.33Å; L2612-R2614 PolarHBondContact O-N 3.26Å; R2614-A2616 PolarHBondContact O-N 2.83Å; R2614-D2617 HydrophobicContact CB-CB 4.31Å; R2614-D2617 WeakPolarHBondContact CB-OD2 3.41Å; R2614-D2617 WeakPolarHBondContact CD-OD2 3.18Å; R2614-D2617 IonicContact CZ-OD1 3.3Å; R2614-D2617 IonicContact CZ-OD2 3.55Å; R2614-D2617 IonicContact NE-OD1 2.9Å; R2614-D2617 IonicContact NE-OD2 3.17Å; R2614-D2617 PolarHBondContact NE-OD2 2.84Å; R2614-D2617 VanDerWaalsContact NH2-CG 3.34Å; R2614-D2617 IonicContact NH2-OD1 3.2Å; R2614-D2617 PolarHBondContact NH2-OD1 3.03Å; R2614-D2617 IonicContact NH2-OD2 3.1Å; R2614-D2617 PolarHBondContact NH2-OD2 2.84Å; R2614-D2617 WeakPolarHBondContact O-CA 3.4Å; R2614-D2617 PolarHBondContact O-N 3.03Å; R2614-T2618 PolarHBondContact O-N 2.88Å; R2614-N2940 HydrophobicContact CG-CB 4.31Å; R2614-A2941 HydrophobicContact CG-CB 3.85Å; R2614-Q2943 VanDerWaalsContact NH2-OE1 3.14Å; R2614-H2963 PolarHBondContact NH1-O 3.21Å; R2614-G2964 PolarHBondContact NH2-O 3.07Å
2615	P	65.9	Low	84.6	Confident	118.6 Å²	118.6	47.4 Å²	47.4	77%	0.77	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-22.5	174.2	-23.9	32.7	0	0	0	114.2	D2617 T2618 S2638	P2615-D2617 VanDerWaalsContact C-N 3.26Å; P2615-D2617 PolarHBondContact O-N 2.76Å; P2615-T2618 WeakPolarHBondContact CA-OG1 3.09Å; P2615-T2618 VanDerWaalsContact O-CG2 3.26Å; P2615-T2618 WeakPolarHBondContact O-CG2 3.25Å; P2615-T2618 PolarHBondContact O-OG1 3.2Å; P2615-T2618 VanDerWaalsContact O-OG1 3.07Å; P2615-S2638 WeakPolarHBondContact O-CB 3.34Å; P2615-S2638 PolarHBondContact O-OG 2.69Å
2616	A	73.6	Confident	84.3	Confident	45.4 Å²	45.4	53.6 Å²	53.6	38%	0.375	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-13.1	176.1	0	0	0	0	0	113.6	R2614 T2618 S2638 P2965	R2614-A2616 PolarHBondContact O-N 2.83Å; A2616-T2618 PolarHBondContact O-N 3.06Å; A2616-S2638 WeakPolarHBondContact CA-OG 3.22Å; A2616-S2638 VanDerWaalsContact O-CB 3.28Å; A2616-S2638 WeakPolarHBondContact O-CB 3.31Å; A2616-S2638 PolarHBondContact O-OG 3.01Å; A2616-P2965 HydrophobicContact CB-CB 4.37Å; A2616-P2965 HydrophobicContact CB-CG 4.38Å; A2616-P2965 WeakPolarHBondContact O-CB 3.35Å
2617	D	79.6	Confident	83.8	Confident	17.2 Å²	17.2	56.4 Å²	56.4	9%	0.092	32%	0.315	C	S	.	.	S	Bend	trans	-101.5	69.4	-177.8	-62.9	-20.9	0	0	0	108.9	L2612 R2614 P2615 G2966 G2967	L2612-D2617 HydrophobicContact CB-CB 4.37Å; L2612-D2617 WeakPolarHBondContact CB-O 3.35Å; L2612-D2617 PolarHBondContact N-O 2.78Å; R2614-D2617 HydrophobicContact CB-CB 4.31Å; R2614-D2617 WeakPolarHBondContact CB-OD2 3.41Å; R2614-D2617 WeakPolarHBondContact CD-OD2 3.18Å; R2614-D2617 IonicContact CZ-OD1 3.3Å; R2614-D2617 IonicContact CZ-OD2 3.55Å; R2614-D2617 IonicContact NE-OD1 2.9Å; R2614-D2617 IonicContact NE-OD2 3.17Å; R2614-D2617 PolarHBondContact NE-OD2 2.84Å; R2614-D2617 VanDerWaalsContact NH2-CG 3.34Å; R2614-D2617 IonicContact NH2-OD1 3.2Å; R2614-D2617 PolarHBondContact NH2-OD1 3.03Å; R2614-D2617 IonicContact NH2-OD2 3.1Å; R2614-D2617 PolarHBondContact NH2-OD2 2.84Å; R2614-D2617 WeakPolarHBondContact O-CA 3.4Å; R2614-D2617 PolarHBondContact O-N 3.03Å; P2615-D2617 VanDerWaalsContact C-N 3.26Å; P2615-D2617 PolarHBondContact O-N 2.76Å; D2617-G2966 WeakPolarHBondContact OD1-CA 3.4Å; D2617-G2966 PolarHBondContact OD1-N 3.12Å; D2617-G2967 PolarHBondContact OD1-N 3.19Å; D2617-G2967 VanDerWaalsContact OD1-N 3.11Å
2618	T	85.4	Confident	83.3	Confident	39.2 Å²	39.2	55.4 Å²	55.4	24%	0.24	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	142.6	-176.4	53.2	0	0	0	0	111.5	A2609 A2610 D2611 R2614 P2615 A2616 S2638	A2609-T2618 HydrophobicContact CB-CG2 4.44Å; A2610-T2618 CarbonylContact O-C 3.52Å; A2610-T2618 WeakPolarHBondContact O-CA 3.31Å; D2611-T2618 VanDerWaalsContact OD1-CG2 3.23Å; D2611-T2618 WeakPolarHBondContact OD1-CG2 3.43Å; R2614-T2618 PolarHBondContact O-N 2.88Å; P2615-T2618 WeakPolarHBondContact CA-OG1 3.09Å; P2615-T2618 VanDerWaalsContact O-CG2 3.26Å; P2615-T2618 WeakPolarHBondContact O-CG2 3.25Å; P2615-T2618 PolarHBondContact O-OG1 3.2Å; P2615-T2618 VanDerWaalsContact O-OG1 3.07Å; A2616-T2618 PolarHBondContact O-N 3.06Å; T2618-S2638 WeakPolarHBondContact CA-OG 3.45Å; T2618-S2638 PolarHBondContact N-OG 3.05Å; T2618-S2638 VanDerWaalsContact O-CB 3.24Å; T2618-S2638 WeakPolarHBondContact O-CB 3.18Å; T2618-S2638 PolarHBondContact O-N 3.1Å; T2618-S2638 VanDerWaalsContact O-N 3.09Å; T2618-S2638 PolarHBondContact O-OG 3.01Å; T2618-S2638 VanDerWaalsContact O-OG 3.12Å; T2618-S2638 PolarHBondContact OG1-OG 3.11Å; T2618-S2638 VanDerWaalsContact OG1-OG 3.1Å
2619	L	88.5	Confident	82.7	Confident	25.2 Å²	25.2	51.9 Å²	51.9	13%	0.132	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	130.9	167.2	-104.1	136.3	0	0	0	107.6	A2609 A2610 L2612 F2621 V2635 S2636 V2637 R3330 F3454	A2609-L2619 CarbonylContact C-O 3.52Å; A2609-L2619 WeakPolarHBondContact CA-O 3.46Å; A2609-L2619 WeakPolarHBondContact CB-O 3.26Å; A2610-L2619 HydrophobicContact CB-CB 4.44Å; A2610-L2619 PolarHBondContact N-O 3.01Å; A2610-L2619 PolarHBondContact O-N 3.01Å; L2612-L2619 HydrophobicContact CD1-CD1 3.95Å; L2612-L2619 HydrophobicContact CD1-CG 4Å; L2619-F2621 HydrophobicContact CB-CE2 4.07Å; L2619-F2621 HydrophobicContact CB-CZ 4.23Å; L2619-F2621 HydrophobicContact CD1-CZ 4.49Å; L2619-F2621 HydrophobicContact CD2-CE1 4.26Å; L2619-F2621 HydrophobicContact CD2-CE2 3.75Å; L2619-F2621 HydrophobicContact CD2-CZ 3.32Å; L2619-F2621 HydrophobicContact CG-CE1 4.42Å; L2619-F2621 HydrophobicContact CG-CE2 3.8Å; L2619-F2621 HydrophobicContact CG-CZ 3.68Å; L2619-V2635 HydrophobicContact CD1-CG1 3.64Å; L2619-V2635 HydrophobicContact CG-CG1 4.5Å; L2619-S2636 CarbonylContact C-O 3.56Å; L2619-S2636 WeakPolarHBondContact CA-O 3.34Å; L2619-S2636 WeakPolarHBondContact CD1-O 3.42Å; L2619-V2637 HydrophobicContact CD1-CB 4.23Å; L2619-V2637 HydrophobicContact CD1-CG2 3.67Å; L2619-V2637 HydrophobicContact CD2-CB 4.13Å; L2619-V2637 HydrophobicContact CD2-CG1 3.92Å; L2619-V2637 HydrophobicContact CD2-CG2 3.82Å; L2619-R3330 VanDerWaalsContact CD2-O 3.31Å; L2619-R3330 WeakPolarHBondContact CD2-O 3.27Å; L2619-F3454 HydrophobicContact CD2-CD2 3.91Å; L2619-F3454 HydrophobicContact CD2-CE2 3.18Å; L2619-F3454 HydrophobicContact CD2-CZ 3.87Å
2620	S	91.7	Very high	82.3	Confident	38.8 Å²	38.8	54.7 Å²	54.7	27%	0.271	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	146.8	174.4	60.1	0	0	0	0	112.2	K2608 V2635 S2636	K2608-S2620 CarbonylContact O-C 3.55Å; K2608-S2620 VanDerWaalsContact O-CA 3.31Å; K2608-S2620 WeakPolarHBondContact O-CA 3.3Å; S2620-V2635 CarbonylContact O-C 3.49Å; S2620-V2635 WeakPolarHBondContact O-CA 3.33Å; S2620-S2636 PolarHBondContact N-O 2.99Å; S2620-S2636 VanDerWaalsContact N-O 3.08Å; S2620-S2636 PolarHBondContact O-N 2.94Å; S2620-S2636 VanDerWaalsContact OG-CB 3.27Å; S2620-S2636 WeakPolarHBondContact OG-CB 3.34Å; S2620-S2636 PolarHBondContact OG-O 2.87Å
2621	F	93.2	Very high	82.1	Confident	26.6 Å²	26.6	56.7 Å²	56.7	12%	0.117	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	136.2	-172.4	-57	-89.4	0	0	0	109.4	L2607 K2608 L2619 Y2623 P2632 M2634 V2635 K3329 F3454	L2607-F2621 HydrophobicContact CB-CD2 4.49Å; L2607-F2621 HydrophobicContact CD2-CD2 4.11Å; L2607-F2621 HydrophobicContact CD2-CE2 3.51Å; L2607-F2621 VanDerWaalsContact CD2-CE2 3.48Å; L2607-F2621 HydrophobicContact CD2-CZ 4.12Å; L2607-F2621 HydrophobicContact CG-CD2 3.99Å; L2607-F2621 HydrophobicContact CG-CE2 3.89Å; L2607-F2621 VanDerWaalsContact O-CB 3.32Å; L2607-F2621 WeakPolarHBondContact O-CB 3.39Å; L2607-F2621 VanDerWaalsContact O-CD2 3.31Å; L2607-F2621 WeakPolarHBondContact O-CD2 3.35Å; K2608-F2621 PolarHBondContact O-N 2.97Å; L2619-F2621 HydrophobicContact CB-CE2 4.07Å; L2619-F2621 HydrophobicContact CB-CZ 4.23Å; L2619-F2621 HydrophobicContact CD1-CZ 4.49Å; L2619-F2621 HydrophobicContact CD2-CE1 4.26Å; L2619-F2621 HydrophobicContact CD2-CE2 3.75Å; L2619-F2621 HydrophobicContact CD2-CZ 3.32Å; L2619-F2621 HydrophobicContact CG-CE1 4.42Å; L2619-F2621 HydrophobicContact CG-CE2 3.8Å; L2619-F2621 HydrophobicContact CG-CZ 3.68Å; F2621-Y2623 HydrophobicContact CB-CE2 3.97Å; F2621-P2632 HydrophobicContact CB-CB 4.47Å; F2621-P2632 HydrophobicContact CD1-CB 4.11Å; F2621-P2632 HydrophobicContact CD1-CG 4.4Å; F2621-M2634 WeakPolarHBondContact CA-O 3.42Å; F2621-V2635 HydrophobicContact CD1-CG1 4.24Å; F2621-V2635 HydrophobicContact CD1-CG2 3.93Å; F2621-V2635 HydrophobicContact CE1-CG1 3.99Å; F2621-V2635 HydrophobicContact CE1-CG2 4.17Å; F2621-K3329 VanDerWaalsContact CE1-O 3.26Å; F2621-K3329 WeakPolarHBondContact CE1-O 3.43Å; F2621-F3454 HydrophobicContact CZ-CD2 4.31Å
2622	Q	93.3	Very high	82.1	Confident	105.4 Å²	105.4	54.6 Å²	54.6	49%	0.493	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	146.7	170.9	-55.3	-176.7	9.2	0	0	109.8	P2632 T2633 M2634	Q2622-P2632 CarbonylContact O-C 3.54Å; Q2622-P2632 WeakPolarHBondContact O-CA 3.4Å; Q2622-T2633 PolarHBondContact O-N 3.14Å; Q2622-T2633 PolarHBondContact O-OG1 3.16Å; Q2622-T2633 VanDerWaalsContact O-OG1 3.13Å; Q2622-M2634 HydrophobicContact CB-CB 4.15Å; Q2622-M2634 HydrophobicContact CG-CB 4.44Å; Q2622-M2634 PolarHBondContact N-O 3.24Å; Q2622-M2634 PolarHBondContact O-N 3.2Å; Q2622-M2634 VanDerWaalsContact O-N 3.17Å; Q2622-M2634 PolarHBondContact OE1-SD 3.21Å
2623	Y	90.9	Very high	82.6	Confident	46.2 Å²	46.2	52.8 Å²	52.8	18%	0.181	30%	0.297	C	S	.	.			trans	-127.1	106.6	-176.4	-56.2	-92.3	0	0	0	108.4	R2606 L2607 F2621 P2629 Q2631 P2632	R2606-Y2623 HydrophobicContact CB-CD2 4.42Å; R2606-Y2623 HydrophobicContact CB-CE1 4.26Å; R2606-Y2623 HydrophobicContact CB-CE2 3.78Å; R2606-Y2623 VanDerWaalsContact CZ-CB 3.44Å; R2606-Y2623 VanDerWaalsContact CZ-CG 3.42Å; R2606-Y2623 VanDerWaalsContact NH1-CB 3.27Å; L2607-Y2623 VanDerWaalsContact O-CE2 3.31Å; L2607-Y2623 WeakPolarHBondContact O-CE2 3.32Å; L2607-Y2623 PolarHBondContact O-OH 2.92Å; L2607-Y2623 VanDerWaalsContact O-OH 3.07Å; F2621-Y2623 HydrophobicContact CB-CE2 3.97Å; Y2623-P2629 WeakPolarHBondContact CD1-O 3.41Å; Y2623-Q2631 WeakPolarHBondContact CD1-O 3.31Å; Y2623-P2632 HydrophobicContact CD1-CB 4.46Å; Y2623-P2632 HydrophobicContact CE1-CB 4.09Å
2624	G	84.4	Confident	83.5	Confident	59.8 Å²	59.8	55 Å²	55	62%	0.616	31%	0.306	S	S	*	.			trans	-110.1	-17.7	-173.1	0	0	0	0	0	116	T2633	G2624-T2633 VanDerWaalsContact N-CG2 3.33Å; G2624-T2633 PolarHBondContact N-OG1 3.03Å
2625	I	80.9	Confident	84.5	Confident	55.4 Å²	55.4	53.9 Å²	53.9	28%	0.284	30%	0.303	S	S	.	.			trans	-101	118.8	-173.1	-62.7	163.7	0	0	0	110	N2627 I2628 T2633 Y2647 M2671	I2625-N2627 VanDerWaalsContact C-N 3.32Å; I2625-N2627 HydrophobicContact CG2-CB 4.36Å; I2625-N2627 PolarHBondContact O-N 3.09Å; I2625-I2628 HydrophobicContact CB-CD1 4.27Å; I2625-I2628 HydrophobicContact CB-CG1 3.73Å; I2625-I2628 HydrophobicContact CD1-CD1 3.98Å; I2625-I2628 HydrophobicContact CD1-CG1 4.39Å; I2625-I2628 HydrophobicContact CG2-CD1 4.19Å; I2625-I2628 HydrophobicContact CG2-CG1 3.5Å; I2625-I2628 VanDerWaalsContact CG2-CG1 3.49Å; I2625-I2628 CarbonylContact O-C 3.53Å; I2625-I2628 PolarHBondContact O-N 3.02Å; I2625-T2633 HydrophobicContact CB-CG2 4.21Å; I2625-T2633 HydrophobicContact CD1-CG2 3.68Å; I2625-T2633 HydrophobicContact CG1-CG2 3.69Å; I2625-Y2647 HydrophobicContact CD1-CD2 3.73Å; I2625-Y2647 HydrophobicContact CD1-CE2 4.46Å; I2625-Y2647 HydrophobicContact CD1-CG 4.26Å; I2625-M2671 HydrophobicContact CD1-CE 4.49Å; I2625-M2671 HydrophobicContact CG2-CE 4.26Å; I2625-M2671 HydrophobicContact CG2-SD 3.86Å
2626	Q	78.4	Confident	85.7	Confident	179.4 Å²	179.4	50 Å²	50	84%	0.838	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-33.6	-177	-70	-177	-9.1	0	0	113.5	I2628 P2629	Q2626-I2628 VanDerWaalsContact C-N 3.33Å; Q2626-I2628 PolarHBondContact O-N 3.2Å; Q2626-P2629 WeakPolarHBondContact O-CD 3.37Å
2627	N	75.4	Confident	86.4	Confident	100.6 Å²	100.6	49 Å²	49	54%	0.538	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-20.5	-177.7	-67.8	-6.3	0	0	0	113.8	I2625 P2629 D2669 M2671	I2625-N2627 VanDerWaalsContact C-N 3.32Å; I2625-N2627 HydrophobicContact CG2-CB 4.36Å; I2625-N2627 PolarHBondContact O-N 3.09Å; N2627-P2629 VanDerWaalsContact C-CD 3.44Å; N2627-P2629 WeakPolarHBondContact O-CD 3.48Å; N2627-D2669 HydrophobicContact CB-CB 4.3Å; N2627-D2669 PolarHBondContact ND2-OD2 3.03Å; N2627-M2671 HydrophobicContact CB-CE 4.36Å; N2627-M2671 HydrophobicContact CB-SD 3.98Å
2628	I	78.2	Confident	86.6	Confident	13.4 Å²	13.4	49.3 Å²	49.3	7%	0.069	27%	0.272	C	S	.	.	S	Bend	trans	-129.7	62.4	176.8	47.6	168.5	0	0	0	110	N2244 I2625 Q2626 F2630 Q2631 Y2647 M2671	N2244-I2628 WeakPolarHBondContact O-CG2 3.44Å; I2625-I2628 HydrophobicContact CB-CD1 4.27Å; I2625-I2628 HydrophobicContact CB-CG1 3.73Å; I2625-I2628 HydrophobicContact CD1-CD1 3.98Å; I2625-I2628 HydrophobicContact CD1-CG1 4.39Å; I2625-I2628 HydrophobicContact CG2-CD1 4.19Å; I2625-I2628 HydrophobicContact CG2-CG1 3.5Å; I2625-I2628 VanDerWaalsContact CG2-CG1 3.49Å; I2625-I2628 CarbonylContact O-C 3.53Å; I2625-I2628 PolarHBondContact O-N 3.02Å; Q2626-I2628 VanDerWaalsContact C-N 3.33Å; Q2626-I2628 PolarHBondContact O-N 3.2Å; I2628-F2630 PolarHBondContact O-N 3.06Å; I2628-F2630 VanDerWaalsContact O-N 3.09Å; I2628-Q2631 HydrophobicContact CB-CB 4.16Å; I2628-Q2631 HydrophobicContact CB-CG 4.1Å; I2628-Q2631 HydrophobicContact CD1-CB 4.1Å; I2628-Q2631 HydrophobicContact CD1-CG 4.35Å; I2628-Q2631 HydrophobicContact CG1-CB 4.41Å; I2628-Q2631 HydrophobicContact CG1-CG 4.48Å; I2628-Q2631 PolarHBondContact O-N 2.96Å; I2628-Q2631 VanDerWaalsContact O-N 3.13Å; I2628-Y2647 HydrophobicContact CD1-CD1 3.56Å; I2628-Y2647 HydrophobicContact CD1-CD2 3.58Å; I2628-Y2647 HydrophobicContact CD1-CE1 3.82Å; I2628-Y2647 HydrophobicContact CD1-CE2 4.03Å; I2628-Y2647 HydrophobicContact CD1-CG 3.33Å; I2628-Y2647 VanDerWaalsContact CD1-CG 3.48Å; I2628-M2671 HydrophobicContact CB-CE 4.07Å; I2628-M2671 HydrophobicContact CD1-CB 4.21Å; I2628-M2671 HydrophobicContact CD1-CE 4.04Å; I2628-M2671 HydrophobicContact CD1-SD 4.5Å; I2628-M2671 HydrophobicContact CG1-CE 3.63Å; I2628-M2671 HydrophobicContact CG1-SD 4.41Å; I2628-M2671 HydrophobicContact CG2-CB 3.95Å; I2628-M2671 HydrophobicContact CG2-CE 3.4Å; I2628-M2671 HydrophobicContact CG2-CG 4.31Å; I2628-M2671 HydrophobicContact CG2-SD 3.96Å; I2628-M2671 WeakPolarHBondContact CG2-SD 3.24Å
2629	P	79.1	Confident	86.4	Confident	41.4 Å²	41.4	48.9 Å²	48.9	27%	0.269	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-22.3	-165.7	25.4	-31.7	0	0	0	112.8	R2606 Y2623 Q2626 N2627	R2606-P2629 WeakPolarHBondContact CD-O 3.38Å; R2606-P2629 PolarHBondContact NH1-O 3.25Å; Y2623-P2629 WeakPolarHBondContact CD1-O 3.41Å; Q2626-P2629 WeakPolarHBondContact O-CD 3.37Å; N2627-P2629 VanDerWaalsContact C-CD 3.44Å; N2627-P2629 WeakPolarHBondContact O-CD 3.48Å
2630	F	82.3	Confident	86	Confident	80.8 Å²	80.8	48.8 Å²	48.8	35%	0.354	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	1.5	-179.9	-60	-86.8	0	0	0	114	H2222 P2242 V2243 L2604 R2606 I2628	H2222-F2630 AromaticContact CD2-CD1 3.81Å; H2222-F2630 AromaticContact CD2-CE1 3.41Å; H2222-F2630 VanDerWaalsContact CD2-CE1 3.41Å; H2222-F2630 WeakPolarHBondContact CD2-CE1 3.31Å; H2222-F2630 AromaticContact CD2-CZ 3.77Å; H2222-F2630 AromaticContact NE2-CD1 3.64Å; H2222-F2630 AromaticContact NE2-CE1 3.43Å; H2222-F2630 WeakPolarHBondContact NE2-CE1 2.81Å; P2242-F2630 HydrophobicContact CB-CE2 4.32Å; P2242-F2630 WeakPolarHBondContact O-CD2 3.34Å; P2242-F2630 WeakPolarHBondContact O-CE2 3.36Å; V2243-F2630 HydrophobicContact CB-CB 4.27Å; V2243-F2630 HydrophobicContact CB-CG 4.39Å; V2243-F2630 HydrophobicContact CG1-CB 3.84Å; V2243-F2630 HydrophobicContact CG1-CG 4.29Å; V2243-F2630 HydrophobicContact CG2-CG 4.45Å; V2243-F2630 WeakPolarHBondContact O-CB 3.2Å; L2604-F2630 HydrophobicContact CB-CE1 4.36Å; L2604-F2630 WeakPolarHBondContact O-CE1 3.48Å; R2606-F2630 HydrophobicContact CG-CD1 3.7Å; R2606-F2630 HydrophobicContact CG-CE1 4.06Å; R2606-F2630 HydrophobicContact CG-CG 4.39Å; I2628-F2630 PolarHBondContact O-N 3.06Å; I2628-F2630 VanDerWaalsContact O-N 3.09Å
2631	Q	84.5	Confident	85.8	Confident	44 Å²	44	48.2 Å²	48.2	21%	0.206	28%	0.276	C	S	.	.	S	Bend	trans	-100.5	126.5	178.4	-63.1	-62.3	-19	0	0	110.8	V2243 N2244 Y2623 I2628 T2633 Y2647	V2243-Q2631 WeakPolarHBondContact O-CG 3.34Å; V2243-Q2631 PolarHBondContact O-NE2 2.9Å; N2244-Q2631 PolarHBondContact OD1-NE2 3.49Å; Y2623-Q2631 WeakPolarHBondContact CD1-O 3.31Å; I2628-Q2631 HydrophobicContact CB-CB 4.16Å; I2628-Q2631 HydrophobicContact CB-CG 4.1Å; I2628-Q2631 HydrophobicContact CD1-CB 4.1Å; I2628-Q2631 HydrophobicContact CD1-CG 4.35Å; I2628-Q2631 HydrophobicContact CG1-CB 4.41Å; I2628-Q2631 HydrophobicContact CG1-CG 4.48Å; I2628-Q2631 PolarHBondContact O-N 2.96Å; I2628-Q2631 VanDerWaalsContact O-N 3.13Å; Q2631-T2633 PolarHBondContact O-N 3.08Å; Q2631-Y2647 HydrophobicContact CB-CE1 4.02Å; Q2631-Y2647 HydrophobicContact CB-CE2 4.3Å; Q2631-Y2647 WeakPolarHBondContact CB-OH 3.33Å; Q2631-Y2647 HydrophobicContact CG-CE1 4.3Å
2632	P	90.1	Very high	85.7	Confident	13.6 Å²	13.6	50.3 Å²	50.3	9%	0.088	29%	0.288	C	S	.	.			trans	-68.3	134	-179.7	27.2	-32.4	0	0	0	110.4	F2621 Q2622 Y2623 V2635 L2645 Y2647	F2621-P2632 HydrophobicContact CB-CB 4.47Å; F2621-P2632 HydrophobicContact CD1-CB 4.11Å; F2621-P2632 HydrophobicContact CD1-CG 4.4Å; Q2622-P2632 CarbonylContact O-C 3.54Å; Q2622-P2632 WeakPolarHBondContact O-CA 3.4Å; Y2623-P2632 HydrophobicContact CD1-CB 4.46Å; Y2623-P2632 HydrophobicContact CE1-CB 4.09Å; P2632-V2635 HydrophobicContact CB-CG2 4.21Å; P2632-V2635 HydrophobicContact CG-CG2 4.31Å; P2632-L2645 HydrophobicContact CB-CD1 4.2Å; P2632-L2645 HydrophobicContact CG-CD1 3.86Å; P2632-L2645 HydrophobicContact CG-CD2 4.28Å; P2632-L2645 WeakPolarHBondContact O-CB 3.12Å; P2632-L2645 VanDerWaalsContact O-CD1 3.25Å; P2632-L2645 WeakPolarHBondContact O-CD1 3.24Å; P2632-L2645 WeakPolarHBondContact O-CD2 3.27Å; P2632-Y2647 VanDerWaalsContact O-CE2 3.26Å; P2632-Y2647 WeakPolarHBondContact O-CE2 3.18Å; P2632-Y2647 PolarHBondContact O-OH 2.97Å
2633	T	91.8	Very high	85.7	Confident	16.6 Å²	16.6	46.8 Å²	46.8	10%	0.102	27%	0.271	C	S	.	.	S	Bend	trans	-94.2	-25.1	174.2	53.2	0	0	0	0	112	Q2622 G2624 I2625 Q2631 L2645 Y2647	Q2622-T2633 PolarHBondContact O-N 3.14Å; Q2622-T2633 PolarHBondContact O-OG1 3.16Å; Q2622-T2633 VanDerWaalsContact O-OG1 3.13Å; G2624-T2633 VanDerWaalsContact N-CG2 3.33Å; G2624-T2633 PolarHBondContact N-OG1 3.03Å; I2625-T2633 HydrophobicContact CB-CG2 4.21Å; I2625-T2633 HydrophobicContact CD1-CG2 3.68Å; I2625-T2633 HydrophobicContact CG1-CG2 3.69Å; Q2631-T2633 PolarHBondContact O-N 3.08Å; T2633-L2645 PolarHBondContact O-N 3.02Å; T2633-Y2647 HydrophobicContact CG2-CE2 4.44Å
2634	M	93.9	Very high	85.9	Confident	53.4 Å²	53.4	46.5 Å²	46.5	26%	0.263	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	141.9	173.3	-55.6	176.5	135.7	0	0	110.3	F2621 Q2622 L2642 Y2643 T2644	F2621-M2634 WeakPolarHBondContact CA-O 3.42Å; Q2622-M2634 HydrophobicContact CB-CB 4.15Å; Q2622-M2634 HydrophobicContact CG-CB 4.44Å; Q2622-M2634 PolarHBondContact N-O 3.24Å; Q2622-M2634 PolarHBondContact O-N 3.2Å; Q2622-M2634 VanDerWaalsContact O-N 3.17Å; Q2622-M2634 PolarHBondContact OE1-SD 3.21Å; M2634-L2642 HydrophobicContact CB-CD1 4.03Å; M2634-L2642 HydrophobicContact CB-CG 4.47Å; M2634-L2642 HydrophobicContact CE-CD1 4.04Å; M2634-L2642 HydrophobicContact CE-CD2 3.58Å; M2634-L2642 HydrophobicContact CE-CG 3.82Å; M2634-L2642 HydrophobicContact CG-CD1 4.42Å; M2634-L2642 HydrophobicContact SD-CD1 4.24Å; M2634-L2642 HydrophobicContact SD-CD2 3.99Å; M2634-L2642 HydrophobicContact SD-CG 4.45Å; M2634-Y2643 CarbonylContact C-O 3.53Å; M2634-Y2643 VanDerWaalsContact CA-O 3.25Å; M2634-Y2643 WeakPolarHBondContact CA-O 3.44Å; M2634-T2644 HydrophobicContact CE-CG2 4.31Å; M2634-T2644 HydrophobicContact CG-CG2 4.36Å
2635	V	93.5	Very high	86.3	Confident	10 Å²	10	44.4 Å²	44.4	6%	0.061	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	117.3	175.3	-175.7	0	0	0	0	107.8	L2619 S2620 F2621 P2632 V2637 Y2643 L2645 P3332	L2619-V2635 HydrophobicContact CD1-CG1 3.64Å; L2619-V2635 HydrophobicContact CG-CG1 4.5Å; S2620-V2635 CarbonylContact O-C 3.49Å; S2620-V2635 WeakPolarHBondContact O-CA 3.33Å; F2621-V2635 HydrophobicContact CD1-CG1 4.24Å; F2621-V2635 HydrophobicContact CD1-CG2 3.93Å; F2621-V2635 HydrophobicContact CE1-CG1 3.99Å; F2621-V2635 HydrophobicContact CE1-CG2 4.17Å; P2632-V2635 HydrophobicContact CB-CG2 4.21Å; P2632-V2635 HydrophobicContact CG-CG2 4.31Å; V2635-V2637 HydrophobicContact CG1-CG2 4.14Å; V2635-Y2643 PolarHBondContact N-O 3.08Å; V2635-Y2643 WeakPolarHBondContact O-CB 3.37Å; V2635-Y2643 PolarHBondContact O-N 2.92Å; V2635-L2645 HydrophobicContact CB-CD1 4.38Å; V2635-L2645 HydrophobicContact CG2-CD1 3.78Å; V2635-L2645 HydrophobicContact CG2-CG 4.41Å; V2635-P3332 HydrophobicContact CB-CG 3.87Å; V2635-P3332 HydrophobicContact CG1-CG 4.08Å; V2635-P3332 HydrophobicContact CG2-CG 4.22Å
2636	S	91.7	Very high	86.8	Confident	37.8 Å²	37.8	43.6 Å²	43.6	26%	0.264	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	119.1	173.1	-179.4	0	0	0	0	109	L2619 S2620	L2619-S2636 CarbonylContact C-O 3.56Å; L2619-S2636 WeakPolarHBondContact CA-O 3.34Å; L2619-S2636 WeakPolarHBondContact CD1-O 3.42Å; S2620-S2636 PolarHBondContact N-O 2.99Å; S2620-S2636 VanDerWaalsContact N-O 3.08Å; S2620-S2636 PolarHBondContact O-N 2.94Å; S2620-S2636 VanDerWaalsContact OG-CB 3.27Å; S2620-S2636 WeakPolarHBondContact OG-CB 3.34Å; S2620-S2636 PolarHBondContact OG-O 2.87Å
2637	V	88.4	Confident	87.2	Confident	24 Å²	24	36.2 Å²	36.2	15%	0.145	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	119.5	178.4	-178.6	0	0	0	0	108.1	L2619 V2635 G2639 S2640 G2641 Y2643	L2619-V2637 HydrophobicContact CD1-CB 4.23Å; L2619-V2637 HydrophobicContact CD1-CG2 3.67Å; L2619-V2637 HydrophobicContact CD2-CB 4.13Å; L2619-V2637 HydrophobicContact CD2-CG1 3.92Å; L2619-V2637 HydrophobicContact CD2-CG2 3.82Å; V2635-V2637 HydrophobicContact CG1-CG2 4.14Å; V2637-G2639 PolarHBondContact O-N 2.91Å; V2637-G2639 VanDerWaalsContact O-N 3.13Å; V2637-S2640 CarbonylContact O-C 3.58Å; V2637-S2640 PolarHBondContact O-N 3.2Å; V2637-G2641 PolarHBondContact N-O 3.12Å; V2637-G2641 PolarHBondContact O-N 2.84Å; V2637-G2641 VanDerWaalsContact O-N 3.12Å; V2637-Y2643 HydrophobicContact CB-CE2 4.47Å; V2637-Y2643 HydrophobicContact CG2-CD2 4.23Å; V2637-Y2643 HydrophobicContact CG2-CE2 4.25Å
2638	S	83.6	Confident	87.3	Confident	24.6 Å²	24.6	33.3 Å²	33.3	17%	0.172	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	125.5	176.4	-98.6	0	0	0	0	111.3	P2615 A2616 T2618 S2640 G2966	P2615-S2638 WeakPolarHBondContact O-CB 3.34Å; P2615-S2638 PolarHBondContact O-OG 2.69Å; A2616-S2638 WeakPolarHBondContact CA-OG 3.22Å; A2616-S2638 VanDerWaalsContact O-CB 3.28Å; A2616-S2638 WeakPolarHBondContact O-CB 3.31Å; A2616-S2638 PolarHBondContact O-OG 3.01Å; T2618-S2638 WeakPolarHBondContact CA-OG 3.45Å; T2618-S2638 PolarHBondContact N-OG 3.05Å; T2618-S2638 VanDerWaalsContact O-CB 3.24Å; T2618-S2638 WeakPolarHBondContact O-CB 3.18Å; T2618-S2638 PolarHBondContact O-N 3.1Å; T2618-S2638 VanDerWaalsContact O-N 3.09Å; T2618-S2638 PolarHBondContact O-OG 3.01Å; T2618-S2638 VanDerWaalsContact O-OG 3.12Å; T2618-S2638 PolarHBondContact OG1-OG 3.11Å; T2618-S2638 VanDerWaalsContact OG1-OG 3.1Å; S2638-S2640 VanDerWaalsContact C-N 3.34Å; S2638-S2640 PolarHBondContact O-N 2.96Å; S2638-S2640 VanDerWaalsContact O-N 3.17Å; S2638-G2966 WeakPolarHBondContact O-CA 3.39Å
2639	G	80.4	Confident	86.6	Confident	30.4 Å²	30.4	38 Å²	38	31%	0.313	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.9	-12.3	-175.9	0	0	0	0	0	116.7	V2637 P2965 R2968 G2993	V2637-G2639 PolarHBondContact O-N 2.91Å; V2637-G2639 VanDerWaalsContact O-N 3.13Å; G2639-P2965 WeakPolarHBondContact CA-O 3.48Å; G2639-R2968 VanDerWaalsContact C-CZ 3.46Å; G2639-R2968 VanDerWaalsContact CA-CZ 3.41Å; G2639-R2968 PolarHBondContact O-NE 2.95Å; G2639-R2968 PolarHBondContact O-NH1 2.71Å; G2639-R2968 PolarHBondContact O-NH2 2.8Å; G2639-G2993 VanDerWaalsContact O-CA 3.28Å; G2639-G2993 WeakPolarHBondContact O-CA 3.26Å
2640	S	81.2	Confident	85.3	Confident	22.2 Å²	22.2	38 Å²	38	16%	0.155	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.5	-5.1	176.5	-61	0	0	0	0	113.6	V2637 S2638 Y2643 P2679 R2968 A2991 K3339	V2637-S2640 CarbonylContact O-C 3.58Å; V2637-S2640 PolarHBondContact O-N 3.2Å; S2638-S2640 VanDerWaalsContact C-N 3.34Å; S2638-S2640 PolarHBondContact O-N 2.96Å; S2638-S2640 VanDerWaalsContact O-N 3.17Å; S2640-Y2643 WeakPolarHBondContact O-CE2 3.23Å; S2640-Y2643 PolarHBondContact O-OH 3.22Å; S2640-P2679 WeakPolarHBondContact O-CB 3.48Å; S2640-P2679 VanDerWaalsContact O-CG 3.24Å; S2640-P2679 WeakPolarHBondContact O-CG 3.29Å; S2640-R2968 PolarHBondContact OG-NH2 2.93Å; S2640-A2991 CarbonylContact C-O 3.53Å; S2640-A2991 VanDerWaalsContact C-O 3.32Å; S2640-A2991 VanDerWaalsContact O-O 3.11Å; S2640-K3339 PolarHBondContact OG-NZ 3.15Å
2641	G	86.3	Confident	83.2	Confident	26 Å²	26	41.4 Å²	41.4	27%	0.268	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	88.7	-167.6	173.6	0	0	0	0	0	114.6	V2637 P2679 A2991	V2637-G2641 PolarHBondContact N-O 3.12Å; V2637-G2641 PolarHBondContact O-N 2.84Å; V2637-G2641 VanDerWaalsContact O-N 3.12Å; G2641-P2679 VanDerWaalsContact C-CG 3.5Å; G2641-A2991 PolarHBondContact N-O 2.97Å
2642	L	91.9	Very high	80.9	Confident	72 Å²	72	46 Å²	46	38%	0.377	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	122.1	-177.5	-174	71.7	0	0	0	111.3	M2634 P2679	M2634-L2642 HydrophobicContact CB-CD1 4.03Å; M2634-L2642 HydrophobicContact CB-CG 4.47Å; M2634-L2642 HydrophobicContact CE-CD1 4.04Å; M2634-L2642 HydrophobicContact CE-CD2 3.58Å; M2634-L2642 HydrophobicContact CE-CG 3.82Å; M2634-L2642 HydrophobicContact CG-CD1 4.42Å; M2634-L2642 HydrophobicContact SD-CD1 4.24Å; M2634-L2642 HydrophobicContact SD-CD2 3.99Å; M2634-L2642 HydrophobicContact SD-CG 4.45Å; L2642-P2679 VanDerWaalsContact O-CA 3.29Å; L2642-P2679 WeakPolarHBondContact O-CA 3.28Å; L2642-P2679 WeakPolarHBondContact O-CG 3.25Å
2643	Y	93.7	Very high	78	Confident	30.2 Å²	30.2	53.3 Å²	53.3	12%	0.118	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	136.9	172.7	-66.3	-98.8	0	0	0	109.9	M2634 V2635 V2637 S2640 V2676 I2677 T2678 P2679 P3332 S3333	M2634-Y2643 CarbonylContact C-O 3.53Å; M2634-Y2643 VanDerWaalsContact CA-O 3.25Å; M2634-Y2643 WeakPolarHBondContact CA-O 3.44Å; V2635-Y2643 PolarHBondContact N-O 3.08Å; V2635-Y2643 WeakPolarHBondContact O-CB 3.37Å; V2635-Y2643 PolarHBondContact O-N 2.92Å; V2637-Y2643 HydrophobicContact CB-CE2 4.47Å; V2637-Y2643 HydrophobicContact CG2-CD2 4.23Å; V2637-Y2643 HydrophobicContact CG2-CE2 4.25Å; S2640-Y2643 WeakPolarHBondContact O-CE2 3.23Å; S2640-Y2643 PolarHBondContact O-OH 3.22Å; Y2643-V2676 HydrophobicContact CD1-CG1 4.01Å; Y2643-I2677 CarbonylContact C-O 3.53Å; Y2643-I2677 WeakPolarHBondContact CA-O 3.38Å; Y2643-T2678 HydrophobicContact CD1-CG2 4.48Å; Y2643-T2678 HydrophobicContact CE1-CG2 4.2Å; Y2643-P2679 HydrophobicContact CD2-CG 4.28Å; Y2643-P2679 HydrophobicContact CE1-CG 4.35Å; Y2643-P2679 HydrophobicContact CE2-CG 4.09Å; Y2643-P2679 HydrophobicContact CG-CG 4.39Å; Y2643-P3332 HydrophobicContact CD1-CB 3.75Å; Y2643-P3332 HydrophobicContact CD2-CB 4.25Å; Y2643-P3332 HydrophobicContact CD2-CG 4.33Å; Y2643-P3332 HydrophobicContact CE1-CB 4.37Å; Y2643-P3332 HydrophobicContact CG-CB 3.69Å; Y2643-P3332 HydrophobicContact CG-CG 4.02Å; Y2643-S3333 VanDerWaalsContact OH-CB 3.27Å; Y2643-S3333 WeakPolarHBondContact OH-CB 3.34Å
2644	T	94.9	Very high	75.2	Confident	41.4 Å²	41.4	57.2 Å²	57.2	25%	0.254	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	126.1	173.2	-55.8	0	0	0	0	109.8	M2634 L2646 V2676 I2677	M2634-T2644 HydrophobicContact CE-CG2 4.31Å; M2634-T2644 HydrophobicContact CG-CG2 4.36Å; T2644-L2646 HydrophobicContact CG2-CD2 4.28Å; T2644-V2676 CarbonylContact O-C 3.51Å; T2644-V2676 WeakPolarHBondContact O-CA 3.31Å; T2644-I2677 PolarHBondContact N-O 2.95Å; T2644-I2677 PolarHBondContact O-N 3.12Å
2645	L	93.2	Very high	72	Confident	14.4 Å²	14.4	59.5 Å²	59.5	8%	0.075	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	122.3	178.3	-67.5	137.1	0	0	0	108.7	P2632 T2633 V2635 Y2647 L2673 V2676 I3328 P3332 L3467	P2632-L2645 HydrophobicContact CB-CD1 4.2Å; P2632-L2645 HydrophobicContact CG-CD1 3.86Å; P2632-L2645 HydrophobicContact CG-CD2 4.28Å; P2632-L2645 WeakPolarHBondContact O-CB 3.12Å; P2632-L2645 VanDerWaalsContact O-CD1 3.25Å; P2632-L2645 WeakPolarHBondContact O-CD1 3.24Å; P2632-L2645 WeakPolarHBondContact O-CD2 3.27Å; T2633-L2645 PolarHBondContact O-N 3.02Å; V2635-L2645 HydrophobicContact CB-CD1 4.38Å; V2635-L2645 HydrophobicContact CG2-CD1 3.78Å; V2635-L2645 HydrophobicContact CG2-CG 4.41Å; L2645-Y2647 HydrophobicContact CB-CE2 3.88Å; L2645-L2673 HydrophobicContact CB-CD1 3.81Å; L2645-L2673 HydrophobicContact CD2-CD1 4.09Å; L2645-L2673 HydrophobicContact CG-CD1 4.26Å; L2645-V2676 HydrophobicContact CD2-CB 4.39Å; L2645-V2676 HydrophobicContact CD2-CG1 4.29Å; L2645-V2676 HydrophobicContact CD2-CG2 3.69Å; L2645-V2676 HydrophobicContact CG-CG2 4.46Å; L2645-I3328 HydrophobicContact CD2-CG2 4.44Å; L2645-P3332 HydrophobicContact CD1-CG 4.29Å; L2645-L3467 HydrophobicContact CD2-CD1 4.45Å; L2645-L3467 HydrophobicContact CD2-CD2 4.33Å
2646	L	90.8	Very high	68.9	Low	39 Å²	39	67.4 Å²	67.4	20%	0.204	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	130.7	-179.8	-56.4	177.7	0	0	0	109.4	T2644 L2673 S2674 G2675 I2677 R2683	T2644-L2646 HydrophobicContact CG2-CD2 4.28Å; L2646-L2673 CarbonylContact O-C 3.56Å; L2646-L2673 WeakPolarHBondContact O-CA 3.24Å; L2646-L2673 WeakPolarHBondContact O-CD1 3.39Å; L2646-S2674 VanDerWaalsContact C-OG 3.31Å; L2646-S2674 WeakPolarHBondContact CB-OG 3.47Å; L2646-S2674 PolarHBondContact O-N 2.99Å; L2646-S2674 PolarHBondContact O-OG 3.04Å; L2646-S2674 VanDerWaalsContact O-OG 3.12Å; L2646-G2675 WeakPolarHBondContact CB-O 3.43Å; L2646-G2675 PolarHBondContact N-O 3.12Å; L2646-G2675 PolarHBondContact O-N 2.97Å; L2646-G2675 VanDerWaalsContact O-N 3.16Å; L2646-I2677 HydrophobicContact CD1-CD1 4.01Å; L2646-I2677 HydrophobicContact CD1-CG1 3.87Å; L2646-I2677 HydrophobicContact CD2-CD1 3.97Å; L2646-I2677 HydrophobicContact CD2-CG1 4.36Å; L2646-I2677 HydrophobicContact CG-CD1 4.27Å; L2646-I2677 HydrophobicContact CG-CG1 4.18Å; L2646-R2683 HydrophobicContact CD1-CG 4.33Å
2647	Y	86.7	Confident	66	Low	25 Å²	25	76.2 Å²	76.2	10%	0.098	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	147.5	175.4	-63.1	-92.5	0	0	0	109.6	I2625 I2628 Q2631 P2632 T2633 L2645 D2649 G2672 L2673 S2674 L3467	I2625-Y2647 HydrophobicContact CD1-CD2 3.73Å; I2625-Y2647 HydrophobicContact CD1-CE2 4.46Å; I2625-Y2647 HydrophobicContact CD1-CG 4.26Å; I2628-Y2647 HydrophobicContact CD1-CD1 3.56Å; I2628-Y2647 HydrophobicContact CD1-CD2 3.58Å; I2628-Y2647 HydrophobicContact CD1-CE1 3.82Å; I2628-Y2647 HydrophobicContact CD1-CE2 4.03Å; I2628-Y2647 HydrophobicContact CD1-CG 3.33Å; I2628-Y2647 VanDerWaalsContact CD1-CG 3.48Å; Q2631-Y2647 HydrophobicContact CB-CE1 4.02Å; Q2631-Y2647 HydrophobicContact CB-CE2 4.3Å; Q2631-Y2647 WeakPolarHBondContact CB-OH 3.33Å; Q2631-Y2647 HydrophobicContact CG-CE1 4.3Å; P2632-Y2647 VanDerWaalsContact O-CE2 3.26Å; P2632-Y2647 WeakPolarHBondContact O-CE2 3.18Å; P2632-Y2647 PolarHBondContact O-OH 2.97Å; T2633-Y2647 HydrophobicContact CG2-CE2 4.44Å; L2645-Y2647 HydrophobicContact CB-CE2 3.88Å; Y2647-D2649 PolarHBondContact O-N 3.19Å; Y2647-G2672 CarbonylContact C-O 3.56Å; Y2647-G2672 VanDerWaalsContact CA-O 3.27Å; Y2647-G2672 WeakPolarHBondContact CA-O 3.39Å; Y2647-L2673 HydrophobicContact CD1-CB 4.44Å; Y2647-L2673 HydrophobicContact CD1-CD1 4.49Å; Y2647-L2673 HydrophobicContact CE1-CB 4.27Å; Y2647-L2673 HydrophobicContact CE1-CD1 4.25Å; Y2647-L2673 HydrophobicContact CE2-CD1 4.4Å; Y2647-S2674 VanDerWaalsContact C-OG 3.31Å; Y2647-S2674 PolarHBondContact O-OG 2.86Å; Y2647-L3467 HydrophobicContact CE1-CD1 4.48Å
2648	S	76.8	Confident	63.1	Low	39.4 Å²	39.4	83.7 Å²	83.7	28%	0.276	44%	0.444	S	S	.	.			trans	-77.9	129.7	174.8	56.6	0	0	0	0	109.7	Y2670 M2671 G2672 S2674 P3471	S2648-Y2670 PolarHBondContact OG-O 3.02Å; S2648-M2671 WeakPolarHBondContact O-CA 3.44Å; S2648-M2671 WeakPolarHBondContact O-CE 3.26Å; S2648-M2671 WeakPolarHBondContact O-CG 3.4Å; S2648-G2672 PolarHBondContact N-O 3.13Å; S2648-G2672 PolarHBondContact O-N 3.47Å; S2648-G2672 PolarHBondContact OG-N 3.38Å; S2648-G2672 VanDerWaalsContact OG-N 3.12Å; S2648-G2672 PolarHBondContact OG-O 3.23Å; S2648-S2674 PolarHBondContact N-OG 3.39Å; S2648-S2674 VanDerWaalsContact OG-CB 3.28Å; S2648-S2674 WeakPolarHBondContact OG-CB 3.46Å; S2648-P3471 VanDerWaalsContact OG-CD 3.31Å; S2648-P3471 WeakPolarHBondContact OG-CD 3.21Å
2649	D	64.5	Low	60.5	Low	111.2 Å²	111.2	91.3 Å²	91.3	60%	0.595	48%	0.476	S	S	*	.			trans	-79.2	134.2	172.4	-133.1	-15.6	0	0	0	109.6	Y2647 F2651	Y2647-D2649 PolarHBondContact O-N 3.19Å; D2649-F2651 VanDerWaalsContact C-N 3.32Å; D2649-F2651 PolarHBondContact O-N 3.09Å; D2649-F2651 PolarHBondContact OD1-N 2.96Å
2650	S	51.2	Low	58.1	Low	42.2 Å²	42.2	94.9 Å²	94.9	30%	0.295	50%	0.503	S	S	.	.			trans	-81.2	74.1	169.1	60.2	0	0	0	0	110.3	I2652 S2668 D2669	S2650-I2652 PolarHBondContact O-N 2.98Å; S2650-S2668 VanDerWaalsContact CB-O 3.3Å; S2650-S2668 WeakPolarHBondContact CB-O 3.08Å; S2650-D2669 PolarHBondContact OG-OD2 3.45Å
2651	F	38.2	Very low	55.6	Low	151.6 Å²	151.6	99 Å²	99	67%	0.665	53%	0.531	S	S	*	.			trans	-99	96	173.8	-98.2	-89.6	0	0	0	109.7	D2649 E2653	D2649-F2651 VanDerWaalsContact C-N 3.32Å; D2649-F2651 PolarHBondContact O-N 3.09Å; D2649-F2651 PolarHBondContact OD1-N 2.96Å; F2651-E2653 VanDerWaalsContact C-N 3.29Å; F2651-E2653 HydrophobicContact CD1-CG 4.35Å; F2651-E2653 HydrophobicContact CE1-CG 4.35Å; F2651-E2653 PolarHBondContact O-N 3.12Å; F2651-E2653 VanDerWaalsContact O-N 3.09Å
2652	I	35.5	Very low	53	Low	141 Å²	141	103.1 Å²	103.1	72%	0.723	56%	0.557	S	S	*	*			trans	-86.6	97.4	159.5	-60.2	174.7	0	0	0	106.1	S2650 S2654	S2650-I2652 PolarHBondContact O-N 2.98Å; I2652-S2654 PolarHBondContact O-N 3.07Å; I2652-S2654 VanDerWaalsContact O-N 3.14Å
2653	E	29.4	Very low	50	Low	167.4 Å²	167.4	107 Å²	107	78%	0.782	58%	0.577	S	S	*	*			trans	-67.1	102.4	157.5	-80.2	-174.6	160.5	0	0	107.5	F2651 S2655 K2667	F2651-E2653 VanDerWaalsContact C-N 3.29Å; F2651-E2653 HydrophobicContact CD1-CG 4.35Å; F2651-E2653 HydrophobicContact CE1-CG 4.35Å; F2651-E2653 PolarHBondContact O-N 3.12Å; F2651-E2653 VanDerWaalsContact O-N 3.09Å; E2653-S2655 PolarHBondContact O-N 3.07Å; E2653-S2655 VanDerWaalsContact O-N 3.1Å; E2653-K2667 IonicContact OE1-NZ 3.13Å; E2653-K2667 PolarHBondContact OE1-NZ 3.15Å
2654	S	32.5	Very low	46.9	Very low	97.2 Å²	97.2	111.6 Å²	111.6	68%	0.68	61%	0.613	S	S	*	*			trans	-77	104.8	161.7	54.7	0	0	0	0	108	I2652 E2656	I2652-S2654 PolarHBondContact O-N 3.07Å; I2652-S2654 VanDerWaalsContact O-N 3.14Å; S2654-E2656 PolarHBondContact O-N 2.81Å
2655	S	27.7	Very low	43.9	Very low	103.4 Å²	103.4	114.1 Å²	114.1	72%	0.723	63%	0.632	S	S	*	*			trans	-56.8	123.8	162.5	52.7	0	0	0	0	110.9	E2653 Y2657	E2653-S2655 PolarHBondContact O-N 3.07Å; E2653-S2655 VanDerWaalsContact O-N 3.1Å; S2655-Y2657 PolarHBondContact O-N 2.81Å
2656	E	28.7	Very low	41.1	Very low	174.4 Å²	174.4	118.4 Å²	118.4	82%	0.815	66%	0.663	S	S	*	*			trans	52.3	79.5	167.1	-76	179.3	161.9	0	0	115.7	S2654	S2654-E2656 PolarHBondContact O-N 2.81Å
2657	Y	31.2	Very low	38.7	Very low	224 Å²	224	124 Å²	124	88%	0.878	69%	0.686	S	S	*	*			trans	-161.2	112.4	130.8	-97.3	-82.5	0	0	0	109.6	S2655 E2659	S2655-Y2657 PolarHBondContact O-N 2.81Å; Y2657-E2659 PolarHBondContact O-N 3.22Å
2658	Q	27.2	Very low	36.6	Very low	181.2 Å²	181.2	126.1 Å²	126.1	85%	0.847	70%	0.704	S	S	*	*			trans	-55.4	131.2	165.7	-73.3	-177.6	-13.7	0	0	112.6
2659	E	28.9	Very low	35.2	Very low	183.6 Å²	183.6	127.8 Å²	127.8	86%	0.858	71%	0.711	S	S	*	*			trans	113.9	104.6	147.3	-78.2	-174.8	178.5	0	0	115.9	Y2657 S2661	Y2657-E2659 PolarHBondContact O-N 3.22Å; E2659-S2661 PolarHBondContact O-N 2.85Å; E2659-S2661 VanDerWaalsContact O-N 3.13Å
2660	A	29.8	Very low	34.7	Very low	105.2 Å²	105.2	128.7 Å²	128.7	87%	0.869	71%	0.706	S	S	*	*			trans	-121.6	98.7	154.3	0	0	0	0	0	112.7
2661	S	29.2	Very low	35.3	Very low	108.6 Å²	108.6	128.1 Å²	128.1	76%	0.759	70%	0.699	S	S	*	*			trans	-107.1	120.2	162.4	61.6	0	0	0	0	113	E2659 L2663	E2659-S2661 PolarHBondContact O-N 2.85Å; E2659-S2661 VanDerWaalsContact O-N 3.13Å; S2661-L2663 VanDerWaalsContact C-N 3.29Å; S2661-L2663 PolarHBondContact O-N 3.2Å
2662	S	30	Very low	37.1	Very low	113.6 Å²	113.6	121.6 Å²	121.6	79%	0.794	68%	0.676	S	S	*	*			trans	150.9	97.1	162.7	65.2	0	0	0	0	114.5
2663	L	30.2	Very low	39.4	Very low	153.6 Å²	153.6	116.7 Å²	116.7	80%	0.804	65%	0.651	S	S	*	*			trans	168.7	92.5	166.5	-85.8	103.6	0	0	0	112.4	N1812 S2661 S2665	N1812-L2663 WeakPolarHBondContact O-CD2 3.17Å; S2661-L2663 VanDerWaalsContact C-N 3.29Å; S2661-L2663 PolarHBondContact O-N 3.2Å; L2663-S2665 VanDerWaalsContact C-N 3.28Å; L2663-S2665 PolarHBondContact O-N 3.15Å
2664	S	28	Very low	42.2	Very low	125.2 Å²	125.2	110 Å²	110	88%	0.876	62%	0.622	S	S	*	*			trans	-66.9	78.9	161.5	79.2	0	0	0	0	111.2	S2666	S2664-S2666 PolarHBondContact O-N 2.94Å
2665	S	32.8	Very low	45	Very low	94.4 Å²	94.4	105.4 Å²	105.4	66%	0.66	59%	0.59	S	S	*	*			trans	-68.4	118.9	159.9	57	0	0	0	0	108.2	L2663 K2667	L2663-S2665 VanDerWaalsContact C-N 3.28Å; L2663-S2665 PolarHBondContact O-N 3.15Å; S2665-K2667 VanDerWaalsContact C-N 3.27Å; S2665-K2667 PolarHBondContact O-N 2.99Å
2666	S	34.3	Very low	48.1	Very low	104.2 Å²	104.2	100.9 Å²	100.9	73%	0.729	56%	0.558	S	S	*	*			trans	-46.1	90	172.8	61.6	0	0	0	0	111.8	S2664 S2668	S2664-S2666 PolarHBondContact O-N 2.94Å; S2666-S2668 VanDerWaalsContact C-N 3.28Å; S2666-S2668 PolarHBondContact O-N 3.08Å; S2666-S2668 VanDerWaalsContact O-N 3.14Å
2667	K	39.2	Very low	51.1	Low	158.4 Å²	158.4	95 Å²	95	69%	0.689	53%	0.531	S	S	*	.			trans	-61.2	107.8	152.1	-85.1	-178.5	174.9	-179.7	0	105.7	E2653 S2665 D2669	E2653-K2667 IonicContact OE1-NZ 3.13Å; E2653-K2667 PolarHBondContact OE1-NZ 3.15Å; S2665-K2667 VanDerWaalsContact C-N 3.27Å; S2665-K2667 PolarHBondContact O-N 2.99Å; K2667-D2669 VanDerWaalsContact C-N 3.27Å; K2667-D2669 VanDerWaalsContact CB-OD1 3.3Å; K2667-D2669 WeakPolarHBondContact CB-OD1 3.5Å; K2667-D2669 PolarHBondContact O-N 3.04Å
2668	S	43.1	Very low	54	Low	68 Å²	68	84.9 Å²	84.9	48%	0.476	49%	0.493	S	S	.	.			trans	-70.4	96.6	167.7	87.8	0	0	0	0	106.7	S2650 S2666 Y2670	S2650-S2668 VanDerWaalsContact CB-O 3.3Å; S2650-S2668 WeakPolarHBondContact CB-O 3.08Å; S2666-S2668 VanDerWaalsContact C-N 3.28Å; S2666-S2668 PolarHBondContact O-N 3.08Å; S2666-S2668 VanDerWaalsContact O-N 3.14Å; S2668-Y2670 VanDerWaalsContact CB-CD2 3.45Å; S2668-Y2670 VanDerWaalsContact CB-CE2 3.46Å; S2668-Y2670 VanDerWaalsContact O-CD2 3.23Å; S2668-Y2670 WeakPolarHBondContact O-CD2 3.23Å; S2668-Y2670 PolarHBondContact O-N 3.09Å; S2668-Y2670 WeakPolarHBondContact OG-CD2 3.37Å; S2668-Y2670 VanDerWaalsContact OG-CE2 3.25Å; S2668-Y2670 WeakPolarHBondContact OG-CE2 3.31Å; S2668-Y2670 PolarHBondContact OG-N 3.28Å; S2668-Y2670 PolarHBondContact OG-O 2.82Å; S2668-Y2670 VanDerWaalsContact OG-O 3.12Å
2669	D	48	Very low	57	Low	75.6 Å²	75.6	78.2 Å²	78.2	40%	0.404	47%	0.465	S	S	.	.			trans	-66.6	57.6	172.6	-71.5	-24.3	0	0	0	109.1	K2249 K2262 N2627 S2650 K2667 M2671	K2249-D2669 IonicContact NZ-OD2 2.8Å; K2249-D2669 PolarHBondContact NZ-OD2 3.3Å; K2262-D2669 IonicContact NZ-OD2 3.97Å; N2627-D2669 HydrophobicContact CB-CB 4.3Å; N2627-D2669 PolarHBondContact ND2-OD2 3.03Å; S2650-D2669 PolarHBondContact OG-OD2 3.45Å; K2667-D2669 VanDerWaalsContact C-N 3.27Å; K2667-D2669 VanDerWaalsContact CB-OD1 3.3Å; K2667-D2669 WeakPolarHBondContact CB-OD1 3.5Å; K2667-D2669 PolarHBondContact O-N 3.04Å; D2669-M2671 VanDerWaalsContact C-N 3.33Å; D2669-M2671 PolarHBondContact O-N 3.1Å
2670	Y	54.2	Low	59.7	Low	129 Å²	129	72.7 Å²	72.7	51%	0.506	45%	0.445	S	S	.	.			trans	-81.1	105.7	-179.6	-83.9	-78.7	0	0	0	109.9	N2244 P2264 Q2265 D2266 S2267 S2648 S2668 G2672	N2244-Y2670 HydrophobicContact CB-CE2 4.01Å; P2264-Y2670 HydrophobicContact CB-CD2 3.69Å; P2264-Y2670 HydrophobicContact CB-CE2 4.27Å; P2264-Y2670 HydrophobicContact CB-CG 4.45Å; P2264-Y2670 WeakPolarHBondContact O-CB 3.14Å; P2264-Y2670 WeakPolarHBondContact O-CD1 3.47Å; P2264-Y2670 WeakPolarHBondContact O-CE1 3.22Å; Q2265-Y2670 HydrophobicContact CG-CD1 4.07Å; Q2265-Y2670 HydrophobicContact CG-CD2 4.28Å; Q2265-Y2670 HydrophobicContact CG-CE1 3.7Å; Q2265-Y2670 HydrophobicContact CG-CE2 3.93Å; Q2265-Y2670 HydrophobicContact CG-CG 4.35Å; Q2265-Y2670 PolarHBondContact NE2-OH 3.39Å; Q2265-Y2670 WeakPolarHBondContact O-CE1 3.03Å; D2266-Y2670 PolarHBondContact O-OH 2.81Å; S2267-Y2670 WeakPolarHBondContact CA-OH 3.23Å; S2267-Y2670 PolarHBondContact N-OH 3.07Å; S2267-Y2670 VanDerWaalsContact N-OH 3.09Å; S2648-Y2670 PolarHBondContact OG-O 3.02Å; S2668-Y2670 VanDerWaalsContact CB-CD2 3.45Å; S2668-Y2670 VanDerWaalsContact CB-CE2 3.46Å; S2668-Y2670 VanDerWaalsContact O-CD2 3.23Å; S2668-Y2670 WeakPolarHBondContact O-CD2 3.23Å; S2668-Y2670 PolarHBondContact O-N 3.09Å; S2668-Y2670 WeakPolarHBondContact OG-CD2 3.37Å; S2668-Y2670 VanDerWaalsContact OG-CE2 3.25Å; S2668-Y2670 WeakPolarHBondContact OG-CE2 3.31Å; S2668-Y2670 PolarHBondContact OG-N 3.28Å; S2668-Y2670 PolarHBondContact OG-O 2.82Å; S2668-Y2670 VanDerWaalsContact OG-O 3.12Å; Y2670-G2672 PolarHBondContact O-N 3.11Å
2671	M	63.8	Low	62.5	Low	30.2 Å²	30.2	72.4 Å²	72.4	15%	0.149	44%	0.436	C	S	.	.			trans	-83.2	105.4	169.4	-62.3	-177.9	74.3	0	0	109.1	I2625 N2627 I2628 S2648 D2669	I2625-M2671 HydrophobicContact CD1-CE 4.49Å; I2625-M2671 HydrophobicContact CG2-CE 4.26Å; I2625-M2671 HydrophobicContact CG2-SD 3.86Å; N2627-M2671 HydrophobicContact CB-CE 4.36Å; N2627-M2671 HydrophobicContact CB-SD 3.98Å; I2628-M2671 HydrophobicContact CB-CE 4.07Å; I2628-M2671 HydrophobicContact CD1-CB 4.21Å; I2628-M2671 HydrophobicContact CD1-CE 4.04Å; I2628-M2671 HydrophobicContact CD1-SD 4.5Å; I2628-M2671 HydrophobicContact CG1-CE 3.63Å; I2628-M2671 HydrophobicContact CG1-SD 4.41Å; I2628-M2671 HydrophobicContact CG2-CB 3.95Å; I2628-M2671 HydrophobicContact CG2-CE 3.4Å; I2628-M2671 HydrophobicContact CG2-CG 4.31Å; I2628-M2671 HydrophobicContact CG2-SD 3.96Å; I2628-M2671 WeakPolarHBondContact CG2-SD 3.24Å; S2648-M2671 WeakPolarHBondContact O-CA 3.44Å; S2648-M2671 WeakPolarHBondContact O-CE 3.26Å; S2648-M2671 WeakPolarHBondContact O-CG 3.4Å; D2669-M2671 VanDerWaalsContact C-N 3.33Å; D2669-M2671 PolarHBondContact O-N 3.1Å
2672	G	75.5	Confident	65.3	Low	16.4 Å²	16.4	68.4 Å²	68.4	17%	0.169	41%	0.406	C	S	.	.			trans	-105.5	161.2	175.6	0	0	0	0	0	111.7	Y2647 S2648 Y2670 S2674 P3468	Y2647-G2672 CarbonylContact C-O 3.56Å; Y2647-G2672 VanDerWaalsContact CA-O 3.27Å; Y2647-G2672 WeakPolarHBondContact CA-O 3.39Å; S2648-G2672 PolarHBondContact N-O 3.13Å; S2648-G2672 PolarHBondContact O-N 3.47Å; S2648-G2672 PolarHBondContact OG-N 3.38Å; S2648-G2672 VanDerWaalsContact OG-N 3.12Å; S2648-G2672 PolarHBondContact OG-O 3.23Å; Y2670-G2672 PolarHBondContact O-N 3.11Å; G2672-S2674 PolarHBondContact O-N 2.96Å; G2672-S2674 VanDerWaalsContact O-N 3.13Å; G2672-P3468 CarbonylContact C-O 3.55Å; G2672-P3468 WeakPolarHBondContact CA-O 3.5Å
2673	L	84.4	Confident	68.1	Low	38 Å²	38	68.7 Å²	68.7	20%	0.199	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	115.8	172.9	-175.1	76.4	0	0	0	109.2	L2645 L2646 Y2647 G2675 V2676 F2686 I3328 L3467 P3468 L3469 S3470	L2645-L2673 HydrophobicContact CB-CD1 3.81Å; L2645-L2673 HydrophobicContact CD2-CD1 4.09Å; L2645-L2673 HydrophobicContact CG-CD1 4.26Å; L2646-L2673 CarbonylContact O-C 3.56Å; L2646-L2673 WeakPolarHBondContact O-CA 3.24Å; L2646-L2673 WeakPolarHBondContact O-CD1 3.39Å; Y2647-L2673 HydrophobicContact CD1-CB 4.44Å; Y2647-L2673 HydrophobicContact CD1-CD1 4.49Å; Y2647-L2673 HydrophobicContact CE1-CB 4.27Å; Y2647-L2673 HydrophobicContact CE1-CD1 4.25Å; Y2647-L2673 HydrophobicContact CE2-CD1 4.4Å; L2673-G2675 VanDerWaalsContact CD1-O 3.28Å; L2673-G2675 WeakPolarHBondContact CD1-O 3.47Å; L2673-V2676 HydrophobicContact CD1-CG2 4.46Å; L2673-V2676 HydrophobicContact CD2-CG2 4.21Å; L2673-F2686 HydrophobicContact CD2-CD2 4.15Å; L2673-F2686 HydrophobicContact CD2-CE2 3.93Å; L2673-F2686 HydrophobicContact CD2-CZ 4.23Å; L2673-F2686 HydrophobicContact CG-CD2 4.33Å; L2673-F2686 HydrophobicContact CG-CE2 4.17Å; L2673-I3328 HydrophobicContact CD2-CD1 3.97Å; L2673-I3328 HydrophobicContact CD2-CG2 4.41Å; L2673-L3467 HydrophobicContact CB-CD2 3.42Å; L2673-L3467 VanDerWaalsContact CB-CD2 3.42Å; L2673-L3467 HydrophobicContact CB-CG 4.06Å; L2673-L3467 HydrophobicContact CD1-CD2 3.78Å; L2673-L3467 HydrophobicContact CD2-CD2 3.3Å; L2673-L3467 HydrophobicContact CG-CD2 3.63Å; L2673-P3468 PolarHBondContact N-O 3.36Å; L2673-L3469 HydrophobicContact CB-CD2 4.4Å; L2673-L3469 HydrophobicContact CD2-CD2 4.39Å; L2673-S3470 PolarHBondContact O-N 3.31Å
2674	S	87.3	Confident	70.9	Confident	25.8 Å²	25.8	62.4 Å²	62.4	18%	0.18	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	-18.4	179.3	67.4	0	0	0	0	112.5	L2646 Y2647 S2648 G2672 Q2685 F2686	L2646-S2674 VanDerWaalsContact C-OG 3.31Å; L2646-S2674 WeakPolarHBondContact CB-OG 3.47Å; L2646-S2674 PolarHBondContact O-N 2.99Å; L2646-S2674 PolarHBondContact O-OG 3.04Å; L2646-S2674 VanDerWaalsContact O-OG 3.12Å; Y2647-S2674 VanDerWaalsContact C-OG 3.31Å; Y2647-S2674 PolarHBondContact O-OG 2.86Å; S2648-S2674 PolarHBondContact N-OG 3.39Å; S2648-S2674 VanDerWaalsContact OG-CB 3.28Å; S2648-S2674 WeakPolarHBondContact OG-CB 3.46Å; G2672-S2674 PolarHBondContact O-N 2.96Å; G2672-S2674 VanDerWaalsContact O-N 3.13Å; S2674-Q2685 CarbonylContact O-C 3.48Å; S2674-Q2685 VanDerWaalsContact O-CA 3.28Å; S2674-Q2685 WeakPolarHBondContact O-CA 3.33Å; S2674-Q2685 VanDerWaalsContact O-CG 3.32Å; S2674-Q2685 WeakPolarHBondContact O-CG 3.32Å; S2674-F2686 PolarHBondContact O-N 3.1Å
2675	G	90.5	Very high	73.9	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.3	174.4	177	0	0	0	0	0	114.8	L2646 L2673 R2684	L2646-G2675 WeakPolarHBondContact CB-O 3.43Å; L2646-G2675 PolarHBondContact N-O 3.12Å; L2646-G2675 PolarHBondContact O-N 2.97Å; L2646-G2675 VanDerWaalsContact O-N 3.16Å; L2673-G2675 VanDerWaalsContact CD1-O 3.28Å; L2673-G2675 WeakPolarHBondContact CD1-O 3.47Å; G2675-R2684 CarbonylContact C-O 3.55Å; G2675-R2684 WeakPolarHBondContact CA-O 3.34Å
2676	V	93.1	Very high	76.4	Confident	10 Å²	10	56.5 Å²	56.5	6%	0.061	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	133.6	174.7	-179.6	0	0	0	0	108.6	Y2643 T2644 L2645 L2673 R2684 F2686 I3328 P3332 L3335	Y2643-V2676 HydrophobicContact CD1-CG1 4.01Å; T2644-V2676 CarbonylContact O-C 3.51Å; T2644-V2676 WeakPolarHBondContact O-CA 3.31Å; L2645-V2676 HydrophobicContact CD2-CB 4.39Å; L2645-V2676 HydrophobicContact CD2-CG1 4.29Å; L2645-V2676 HydrophobicContact CD2-CG2 3.69Å; L2645-V2676 HydrophobicContact CG-CG2 4.46Å; L2673-V2676 HydrophobicContact CD1-CG2 4.46Å; L2673-V2676 HydrophobicContact CD2-CG2 4.21Å; V2676-R2684 PolarHBondContact N-O 3.08Å; V2676-R2684 PolarHBondContact O-N 3.15Å; V2676-F2686 HydrophobicContact CG2-CE2 3.99Å; V2676-F2686 HydrophobicContact CG2-CZ 4.08Å; V2676-I3328 HydrophobicContact CG2-CG2 4.36Å; V2676-P3332 HydrophobicContact CG1-CB 4.17Å; V2676-L3335 HydrophobicContact CB-CD1 3.97Å; V2676-L3335 HydrophobicContact CG2-CD1 3.67Å
2677	I	93.1	Very high	78.9	Confident	49.6 Å²	49.6	54.4 Å²	54.4	25%	0.254	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	123.6	168.1	-54.7	175.4	0	0	0	107.4	Y2643 T2644 L2646 L2682 R2683	Y2643-I2677 CarbonylContact C-O 3.53Å; Y2643-I2677 WeakPolarHBondContact CA-O 3.38Å; T2644-I2677 PolarHBondContact N-O 2.95Å; T2644-I2677 PolarHBondContact O-N 3.12Å; L2646-I2677 HydrophobicContact CD1-CD1 4.01Å; L2646-I2677 HydrophobicContact CD1-CG1 3.87Å; L2646-I2677 HydrophobicContact CD2-CD1 3.97Å; L2646-I2677 HydrophobicContact CD2-CG1 4.36Å; L2646-I2677 HydrophobicContact CG-CD1 4.27Å; L2646-I2677 HydrophobicContact CG-CG1 4.18Å; I2677-L2682 WeakPolarHBondContact CA-O 3.31Å; I2677-R2683 HydrophobicContact CG1-CB 4.45Å; I2677-R2683 HydrophobicContact CG1-CG 4.36Å
2678	T	91.3	Very high	80.8	Confident	11.6 Å²	11.6	50.9 Å²	50.9	7%	0.071	27%	0.268	C	S	.	.			trans	-77.2	166.3	176.5	69.5	0	0	0	0	111.3	Y2643 T2680 S2681 L2682 E2992	Y2643-T2678 HydrophobicContact CD1-CG2 4.48Å; Y2643-T2678 HydrophobicContact CE1-CG2 4.2Å; T2678-T2680 PolarHBondContact O-N 3.02Å; T2678-T2680 VanDerWaalsContact O-N 3.12Å; T2678-T2680 PolarHBondContact OG1-N 3.18Å; T2678-T2680 PolarHBondContact OG1-OG1 3.05Å; T2678-T2680 VanDerWaalsContact OG1-OG1 3.07Å; T2678-S2681 WeakPolarHBondContact O-CA 3.35Å; T2678-S2681 PolarHBondContact O-N 3.12Å; T2678-L2682 HydrophobicContact CG2-CB 4.18Å; T2678-L2682 HydrophobicContact CG2-CD2 4.47Å; T2678-L2682 HydrophobicContact CG2-CG 4.45Å; T2678-L2682 WeakPolarHBondContact CG2-O 3.31Å; T2678-L2682 PolarHBondContact N-O 3.14Å; T2678-L2682 WeakPolarHBondContact OG1-CA 3.31Å; T2678-L2682 VanDerWaalsContact OG1-CB 3.27Å; T2678-L2682 WeakPolarHBondContact OG1-CB 3.36Å; T2678-L2682 PolarHBondContact OG1-N 3Å; T2678-L2682 VanDerWaalsContact OG1-N 3.15Å; T2678-L2682 PolarHBondContact OG1-O 2.94Å; T2678-E2992 VanDerWaalsContact CB-OE1 3.25Å; T2678-E2992 WeakPolarHBondContact CB-OE1 3.37Å; T2678-E2992 PolarHBondContact OG1-OE1 3.05Å; T2678-E2992 VanDerWaalsContact OG1-OE1 3.07Å
2679	P	89.5	Confident	82.6	Confident	40.4 Å²	40.4	50.2 Å²	50.2	26%	0.262	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-24.5	175	-23.6	29	0	0	0	115	S2640 G2641 L2642 Y2643 S2681 A2991 E2992	S2640-P2679 WeakPolarHBondContact O-CB 3.48Å; S2640-P2679 VanDerWaalsContact O-CG 3.24Å; S2640-P2679 WeakPolarHBondContact O-CG 3.29Å; G2641-P2679 VanDerWaalsContact C-CG 3.5Å; L2642-P2679 VanDerWaalsContact O-CA 3.29Å; L2642-P2679 WeakPolarHBondContact O-CA 3.28Å; L2642-P2679 WeakPolarHBondContact O-CG 3.25Å; Y2643-P2679 HydrophobicContact CD2-CG 4.28Å; Y2643-P2679 HydrophobicContact CE1-CG 4.35Å; Y2643-P2679 HydrophobicContact CE2-CG 4.09Å; Y2643-P2679 HydrophobicContact CG-CG 4.39Å; P2679-S2681 VanDerWaalsContact C-N 3.26Å; P2679-S2681 PolarHBondContact O-N 2.91Å; P2679-A2991 HydrophobicContact CB-CB 4.05Å; P2679-E2992 HydrophobicContact CB-CG 4.48Å; P2679-E2992 HydrophobicContact CG-CG 4.41Å
2680	T	86.6	Confident	83.9	Confident	69.6 Å²	69.6	49.3 Å²	49.3	43%	0.427	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	10.9	175.8	62.7	0	0	0	0	113.1	T2678 L2682 A2991 E2992	T2678-T2680 PolarHBondContact O-N 3.02Å; T2678-T2680 VanDerWaalsContact O-N 3.12Å; T2678-T2680 PolarHBondContact OG1-N 3.18Å; T2678-T2680 PolarHBondContact OG1-OG1 3.05Å; T2678-T2680 VanDerWaalsContact OG1-OG1 3.07Å; T2680-L2682 VanDerWaalsContact C-N 3.3Å; T2680-L2682 PolarHBondContact O-N 3.05Å; T2680-A2991 HydrophobicContact CG2-CB 4.46Å; T2680-E2992 WeakPolarHBondContact CB-OE1 3.38Å; T2680-E2992 HydrophobicContact CG2-CB 3.68Å; T2680-E2992 VanDerWaalsContact CG2-CD 3.47Å; T2680-E2992 HydrophobicContact CG2-CG 3.61Å; T2680-E2992 WeakPolarHBondContact CG2-OE1 3.42Å; T2680-E2992 VanDerWaalsContact OG1-CD 3.31Å; T2680-E2992 PolarHBondContact OG1-OE1 3.11Å
2681	S	87.7	Confident	84.9	Confident	98.2 Å²	98.2	44.4 Å²	44.4	69%	0.687	24%	0.242	S	C	*	.			trans	68	12.9	-175.9	-50.8	0	0	0	0	115.2	T2678 P2679 R2683	T2678-S2681 WeakPolarHBondContact O-CA 3.35Å; T2678-S2681 PolarHBondContact O-N 3.12Å; P2679-S2681 VanDerWaalsContact C-N 3.26Å; P2679-S2681 PolarHBondContact O-N 2.91Å; S2681-R2683 PolarHBondContact O-N 3.08Å
2682	L	87.9	Confident	85.5	Confident	23.6 Å²	23.6	47.2 Å²	47.2	12%	0.124	26%	0.257	C	S	.	.			trans	-67.7	124.4	170.4	-168.9	79.7	0	0	0	109.7	I2677 T2678 T2680 W2702 S3030	I2677-L2682 WeakPolarHBondContact CA-O 3.31Å; T2678-L2682 HydrophobicContact CG2-CB 4.18Å; T2678-L2682 HydrophobicContact CG2-CD2 4.47Å; T2678-L2682 HydrophobicContact CG2-CG 4.45Å; T2678-L2682 WeakPolarHBondContact CG2-O 3.31Å; T2678-L2682 PolarHBondContact N-O 3.14Å; T2678-L2682 WeakPolarHBondContact OG1-CA 3.31Å; T2678-L2682 VanDerWaalsContact OG1-CB 3.27Å; T2678-L2682 WeakPolarHBondContact OG1-CB 3.36Å; T2678-L2682 PolarHBondContact OG1-N 3Å; T2678-L2682 VanDerWaalsContact OG1-N 3.15Å; T2678-L2682 PolarHBondContact OG1-O 2.94Å; T2680-L2682 VanDerWaalsContact C-N 3.3Å; T2680-L2682 PolarHBondContact O-N 3.05Å; L2682-W2702 HydrophobicContact CD1-CB 3.87Å; L2682-S3030 WeakPolarHBondContact CD1-O 3.5Å
2683	R	90	Very high	85.4	Confident	120 Å²	120	50.6 Å²	50.6	45%	0.453	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	123.4	179.4	-170.3	179	-174.4	-172.4	1.3	110.9	L2646 I2677 S2681 Q2685	L2646-R2683 HydrophobicContact CD1-CG 4.33Å; I2677-R2683 HydrophobicContact CG1-CB 4.45Å; I2677-R2683 HydrophobicContact CG1-CG 4.36Å; S2681-R2683 PolarHBondContact O-N 3.08Å; R2683-Q2685 HydrophobicContact CG-CG 4.05Å
2684	R	89.2	Confident	85.2	Confident	22.8 Å²	22.8	50 Å²	50	9%	0.086	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	129.6	172.2	-60.9	-137.2	179.4	176.9	-0.3	109	G2675 V2676 F2699 T2700 P2701 L3335 D3336	G2675-R2684 CarbonylContact C-O 3.55Å; G2675-R2684 WeakPolarHBondContact CA-O 3.34Å; V2676-R2684 PolarHBondContact N-O 3.08Å; V2676-R2684 PolarHBondContact O-N 3.15Å; R2684-F2699 HydrophobicContact CB-CE2 4.01Å; R2684-F2699 HydrophobicContact CB-CZ 4.28Å; R2684-F2699 HydrophobicContact CG-CE2 4.41Å; R2684-F2699 HydrophobicContact CG-CZ 4.37Å; R2684-T2700 WeakPolarHBondContact CA-O 3.36Å; R2684-P2701 WeakPolarHBondContact CD-O 3.38Å; R2684-P2701 WeakPolarHBondContact CG-O 3.31Å; R2684-P2701 PolarHBondContact NE-O 3.06Å; R2684-P2701 VanDerWaalsContact NE-O 3.1Å; R2684-P2701 VanDerWaalsContact NH1-C 3.3Å; R2684-P2701 VanDerWaalsContact NH1-CB 3.35Å; R2684-P2701 PolarHBondContact NH1-O 2.84Å; R2684-L3335 VanDerWaalsContact CZ-C 3.44Å; R2684-L3335 VanDerWaalsContact CZ-O 3.26Å; R2684-L3335 PolarHBondContact NE-O 2.85Å; R2684-L3335 VanDerWaalsContact NH1-CB 3.26Å; R2684-L3335 PolarHBondContact NH1-O 2.97Å; R2684-D3336 VanDerWaalsContact NH2-CA 3.29Å
2685	Q	89.5	Confident	84.9	Confident	67.6 Å²	67.6	49.8 Å²	49.8	32%	0.316	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	144.1	-176.1	-81	179.7	-54.9	0	0	111.9	S2674 R2683 F2699 T2700	S2674-Q2685 CarbonylContact O-C 3.48Å; S2674-Q2685 VanDerWaalsContact O-CA 3.28Å; S2674-Q2685 WeakPolarHBondContact O-CA 3.33Å; S2674-Q2685 VanDerWaalsContact O-CG 3.32Å; S2674-Q2685 WeakPolarHBondContact O-CG 3.32Å; R2683-Q2685 HydrophobicContact CG-CG 4.05Å; Q2685-F2699 CarbonylContact O-C 3.52Å; Q2685-F2699 WeakPolarHBondContact O-CA 3.28Å; Q2685-F2699 WeakPolarHBondContact O-CD2 3.06Å; Q2685-T2700 PolarHBondContact N-O 3.17Å; Q2685-T2700 VanDerWaalsContact N-O 3.1Å; Q2685-T2700 PolarHBondContact O-N 3.17Å
2686	F	87	Confident	84.7	Confident	28.4 Å²	28.4	52.5 Å²	52.5	13%	0.125	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	133	173.8	-48.9	-80	0	0	0	108.8	L2673 S2674 V2676 L2697 M2698 F2699 L3325 I3328 L3335 L3469	L2673-F2686 HydrophobicContact CD2-CD2 4.15Å; L2673-F2686 HydrophobicContact CD2-CE2 3.93Å; L2673-F2686 HydrophobicContact CD2-CZ 4.23Å; L2673-F2686 HydrophobicContact CG-CD2 4.33Å; L2673-F2686 HydrophobicContact CG-CE2 4.17Å; S2674-F2686 PolarHBondContact O-N 3.1Å; V2676-F2686 HydrophobicContact CG2-CE2 3.99Å; V2676-F2686 HydrophobicContact CG2-CZ 4.08Å; F2686-L2697 HydrophobicContact CB-CD1 4.34Å; F2686-L2697 HydrophobicContact CD1-CD1 4.48Å; F2686-M2698 CarbonylContact C-O 3.56Å; F2686-M2698 WeakPolarHBondContact CA-O 3.41Å; F2686-F2699 HydrophobicContact CD1-CB 4.36Å; F2686-F2699 AromaticContact CD1-CD2 3.57Å; F2686-F2699 HydrophobicContact CD1-CD2 3.57Å; F2686-F2699 VanDerWaalsContact CD1-CD2 3.47Å; F2686-F2699 HydrophobicContact CD1-CE2 4.3Å; F2686-F2699 HydrophobicContact CD1-CG 4.26Å; F2686-F2699 AromaticContact CE1-CD2 3.25Å; F2686-F2699 HydrophobicContact CE1-CD2 3.25Å; F2686-F2699 AromaticContact CE1-CE2 3.57Å; F2686-F2699 HydrophobicContact CE1-CE2 3.57Å; F2686-F2699 VanDerWaalsContact CE1-CE2 3.4Å; F2686-F2699 HydrophobicContact CE1-CG 4.22Å; F2686-F2699 AromaticContact CZ-CD2 3.86Å; F2686-F2699 HydrophobicContact CZ-CD2 4.07Å; F2686-F2699 AromaticContact CZ-CE2 3.85Å; F2686-F2699 HydrophobicContact CZ-CE2 3.98Å; F2686-L3325 HydrophobicContact CD1-CD2 4.33Å; F2686-L3325 HydrophobicContact CE1-CD2 3.5Å; F2686-L3325 VanDerWaalsContact CE1-CD2 3.47Å; F2686-L3325 HydrophobicContact CZ-CD2 3.75Å; F2686-I3328 HydrophobicContact CE2-CD1 4.45Å; F2686-I3328 HydrophobicContact CZ-CD1 4.2Å; F2686-L3335 HydrophobicContact CE2-CD1 4.35Å; F2686-L3335 HydrophobicContact CZ-CD1 4Å; F2686-L3335 HydrophobicContact CZ-CD2 3.95Å; F2686-L3469 HydrophobicContact CB-CD2 4.15Å; F2686-L3469 HydrophobicContact CD1-CD2 4.23Å; F2686-L3469 HydrophobicContact CD2-CD2 4.02Å; F2686-L3469 HydrophobicContact CG-CD2 3.85Å
2687	T	85	Confident	84.4	Confident	58.4 Å²	58.4	53.4 Å²	53.4	36%	0.358	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	129.9	172.7	-55.2	0	0	0	0	108.5	I2689 L2697 M2698	T2687-I2689 HydrophobicContact CG2-CG1 4.19Å; T2687-L2697 CarbonylContact O-C 3.54Å; T2687-M2698 PolarHBondContact N-O 2.94Å; T2687-M2698 WeakPolarHBondContact O-CB 3.22Å; T2687-M2698 PolarHBondContact O-N 3.06Å
2688	R	81.1	Confident	84.3	Confident	85.6 Å²	85.6	52.6 Å²	52.6	32%	0.323	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	133.4	175.9	-138.5	177.9	131.1	-164.1	2.7	109.5	N2690 N2695 R2696 L2697 M3409 S3470 P3472 N3473	R2688-N2690 WeakPolarHBondContact CG-OD1 3.38Å; R2688-N2690 VanDerWaalsContact CZ-OD1 3.29Å; R2688-N2690 PolarHBondContact NE-OD1 3.12Å; R2688-N2690 PolarHBondContact NH2-OD1 3.18Å; R2688-N2695 PolarHBondContact NH2-OD1 2.88Å; R2688-R2696 CarbonylContact C-O 3.52Å; R2688-R2696 VanDerWaalsContact CA-O 3.29Å; R2688-R2696 WeakPolarHBondContact CA-O 3.31Å; R2688-L2697 HydrophobicContact CB-CD1 4.43Å; R2688-L2697 HydrophobicContact CG-CD1 3.63Å; R2688-M3409 PolarHBondContact NH2-O 3.36Å; R2688-S3470 WeakPolarHBondContact CD-O 3.44Å; R2688-S3470 PolarHBondContact NH1-O 3.46Å; R2688-P3472 HydrophobicContact CB-CB 3.83Å; R2688-P3472 WeakPolarHBondContact O-CA 3.34Å; R2688-N3473 PolarHBondContact O-N 2.94Å
2689	I	80.8	Confident	84.3	Confident	54.4 Å²	54.4	53 Å²	53	28%	0.279	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	123	174.9	-55.2	175.6	0	0	0	107.3	T2687 R2696 M2698 N3473 F3561 N3615 L3616	T2687-I2689 HydrophobicContact CG2-CG1 4.19Å; I2689-R2696 HydrophobicContact CB-CB 4.36Å; I2689-R2696 PolarHBondContact N-O 3.09Å; I2689-R2696 PolarHBondContact O-N 3.11Å; I2689-M2698 HydrophobicContact CD1-SD 3.78Å; I2689-M2698 HydrophobicContact CG1-SD 4.41Å; I2689-N3473 WeakPolarHBondContact CA-O 3.26Å; I2689-N3473 HydrophobicContact CG1-CB 4.4Å; I2689-F3561 HydrophobicContact CD1-CB 4.12Å; I2689-F3561 HydrophobicContact CG2-CD1 3.92Å; I2689-N3615 HydrophobicContact CD1-CB 3.8Å; I2689-L3616 HydrophobicContact CG2-CB 4.07Å; I2689-L3616 HydrophobicContact CG2-CD1 4.02Å; I2689-L3616 HydrophobicContact CG2-CD2 4.35Å; I2689-L3616 HydrophobicContact CG2-CG 4.38Å
2690	N	75.2	Confident	84.3	Confident	55.2 Å²	55.2	52.9 Å²	52.9	30%	0.295	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	110.9	172.2	-70.9	-9.5	0	0	0	108.4	D2266 R2688 N2695 P3472 N3473 T3474	D2266-N2690 PolarHBondContact OD1-ND2 2.76Å; D2266-N2690 VanDerWaalsContact OD1-ND2 3.13Å; R2688-N2690 WeakPolarHBondContact CG-OD1 3.38Å; R2688-N2690 VanDerWaalsContact CZ-OD1 3.29Å; R2688-N2690 PolarHBondContact NE-OD1 3.12Å; R2688-N2690 PolarHBondContact NH2-OD1 3.18Å; N2690-N2695 WeakPolarHBondContact CA-OD1 3.15Å; N2690-N2695 VanDerWaalsContact CG-OD1 3.25Å; N2690-N2695 PolarHBondContact OD1-OD1 2.92Å; N2690-P3472 HydrophobicContact CB-CB 3.96Å; N2690-P3472 HydrophobicContact CB-CG 4.19Å; N2690-P3472 WeakPolarHBondContact ND2-CG 3.44Å; N2690-P3472 WeakPolarHBondContact OD1-CB 3.19Å; N2690-P3472 WeakPolarHBondContact OD1-CG 3.49Å; N2690-N3473 PolarHBondContact N-O 2.79Å; N2690-T3474 HydrophobicContact CB-CG2 4.06Å
2691	G	73.9	Confident	84.4	Confident	26 Å²	26	49.8 Å²	49.8	27%	0.268	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	177.1	170.8	0	0	0	0	0	111.9	N2288 K2693 V2694 Q3563	N2288-G2691 WeakPolarHBondContact CA-O 3.18Å; N2288-G2691 WeakPolarHBondContact CB-O 3.18Å; G2691-K2693 PolarHBondContact O-N 3.09Å; G2691-K2693 VanDerWaalsContact O-N 3.12Å; G2691-V2694 CarbonylContact C-O 3.54Å; G2691-V2694 VanDerWaalsContact CA-O 3.29Å; G2691-V2694 WeakPolarHBondContact CA-O 3.34Å; G2691-V2694 PolarHBondContact N-O 2.89Å; G2691-V2694 PolarHBondContact O-N 3Å; G2691-V2694 VanDerWaalsContact O-O 3.1Å; G2691-Q3563 VanDerWaalsContact CA-OE1 3.32Å
2692	I	76.7	Confident	84.3	Confident	88.6 Å²	88.6	46.5 Å²	46.5	45%	0.454	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	122.7	172.7	-63.3	168.5	0	0	0	108.5	N2288 A2289 V2694 Y3482 V3484 V3491 V3524 L3529 Q3563 F3565 W3618	N2288-I2692 CarbonylContact O-C 3.59Å; N2288-I2692 WeakPolarHBondContact O-CA 3.44Å; A2289-I2692 HydrophobicContact CB-CG1 4.43Å; A2289-I2692 HydrophobicContact CB-CG2 4.14Å; I2692-V2694 PolarHBondContact O-N 3.08Å; I2692-V2694 VanDerWaalsContact O-N 3.11Å; I2692-Y3482 HydrophobicContact CD1-CD1 3.84Å; I2692-Y3482 HydrophobicContact CD1-CD2 4.39Å; I2692-Y3482 HydrophobicContact CD1-CE1 4.32Å; I2692-Y3482 HydrophobicContact CD1-CG 3.9Å; I2692-Y3482 HydrophobicContact CG1-CD1 4.28Å; I2692-Y3482 HydrophobicContact CG1-CD2 3.93Å; I2692-Y3482 HydrophobicContact CG1-CG 3.83Å; I2692-V3484 HydrophobicContact CG2-CG2 3.67Å; I2692-V3491 HydrophobicContact CD1-CG1 4.08Å; I2692-V3491 HydrophobicContact CD1-CG2 4.46Å; I2692-V3491 HydrophobicContact CG2-CG2 4.29Å; I2692-V3524 HydrophobicContact CD1-CG1 3.77Å; I2692-L3529 HydrophobicContact CG2-CD2 4.49Å; I2692-L3529 WeakPolarHBondContact O-CD2 3.35Å; I2692-Q3563 VanDerWaalsContact N-OE1 3.08Å; I2692-Q3563 PolarHBondContact O-NE2 2.97Å; I2692-F3565 HydrophobicContact CB-CE1 4.41Å; I2692-F3565 HydrophobicContact CB-CZ 4.36Å; I2692-F3565 HydrophobicContact CD1-CE1 3.68Å; I2692-F3565 HydrophobicContact CD1-CZ 3.71Å; I2692-F3565 HydrophobicContact CG1-CZ 4.45Å; I2692-W3618 HydrophobicContact CD1-CH2 3.61Å; I2692-W3618 HydrophobicContact CD1-CZ2 3.81Å; I2692-W3618 HydrophobicContact CD1-CZ3 4.21Å; I2692-W3618 HydrophobicContact CG1-CH2 4.02Å; I2692-W3618 HydrophobicContact CG1-CZ2 3.87Å
2693	K	74.2	Confident	83.9	Confident	88.6 Å²	88.6	51.6 Å²	51.6	39%	0.385	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.6	-3.9	-177.6	-67.7	-175.9	168.5	-174.3	0	117	N2288 G2691 G2714 S2715 D2716 V2717 V3484 L3529	N2288-K2693 WeakPolarHBondContact O-CA 2.97Å; N2288-K2693 PolarHBondContact O-N 3.27Å; G2691-K2693 PolarHBondContact O-N 3.09Å; G2691-K2693 VanDerWaalsContact O-N 3.12Å; K2693-G2714 CarbonylContact O-C 3.45Å; K2693-G2714 WeakPolarHBondContact O-CA 3.36Å; K2693-S2715 CarbonylContact C-O 3.6Å; K2693-S2715 WeakPolarHBondContact CA-O 3.21Å; K2693-S2715 WeakPolarHBondContact CA-OG 3.41Å; K2693-S2715 WeakPolarHBondContact CB-O 3.29Å; K2693-S2715 PolarHBondContact O-N 2.97Å; K2693-S2715 VanDerWaalsContact O-N 3.1Å; K2693-S2715 VanDerWaalsContact O-O 3.11Å; K2693-S2715 PolarHBondContact O-OG 3.2Å; K2693-D2716 VanDerWaalsContact CD-OD2 3.24Å; K2693-D2716 WeakPolarHBondContact CD-OD2 3.16Å; K2693-D2716 WeakPolarHBondContact CE-OD2 2.87Å; K2693-D2716 IonicContact NZ-OD2 2.87Å; K2693-D2716 PolarHBondContact NZ-OD2 3.35Å; K2693-D2716 VanDerWaalsContact NZ-OD2 3.15Å; K2693-V2717 HydrophobicContact CB-CG2 4.31Å; K2693-V2717 HydrophobicContact CD-CG2 4.38Å; K2693-V2717 HydrophobicContact CG-CB 3.84Å; K2693-V2717 HydrophobicContact CG-CG2 3.69Å; K2693-V3484 HydrophobicContact CD-CB 4.35Å; K2693-V3484 HydrophobicContact CD-CG1 4.22Å; K2693-V3484 HydrophobicContact CD-CG2 4.22Å; K2693-V3484 VanDerWaalsContact CE-CB 3.47Å; K2693-V3484 VanDerWaalsContact CE-CG1 3.45Å; K2693-V3484 HydrophobicContact CG-CG2 3.96Å; K2693-L3529 HydrophobicContact CB-CD2 4.3Å
2694	V	80.1	Confident	83.5	Confident	26.4 Å²	26.4	51.7 Å²	51.7	16%	0.16	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	126.4	-176.3	-178.3	0	0	0	0	109.2	G2691 I2692 E2712 W2713 L2731 W3532 F3561	G2691-V2694 CarbonylContact C-O 3.54Å; G2691-V2694 VanDerWaalsContact CA-O 3.29Å; G2691-V2694 WeakPolarHBondContact CA-O 3.34Å; G2691-V2694 PolarHBondContact N-O 2.89Å; G2691-V2694 PolarHBondContact O-N 3Å; G2691-V2694 VanDerWaalsContact O-O 3.1Å; I2692-V2694 PolarHBondContact O-N 3.08Å; I2692-V2694 VanDerWaalsContact O-N 3.11Å; V2694-E2712 HydrophobicContact CG1-CB 4.02Å; V2694-E2712 HydrophobicContact CG1-CG 4.09Å; V2694-W2713 CarbonylContact C-O 3.58Å; V2694-W2713 VanDerWaalsContact CA-O 3.3Å; V2694-W2713 WeakPolarHBondContact CA-O 3.28Å; V2694-L2731 HydrophobicContact CG1-CD1 4.38Å; V2694-L2731 HydrophobicContact CG2-CD1 4.07Å; V2694-W3532 HydrophobicContact CG2-CD2 4.04Å; V2694-W3532 HydrophobicContact CG2-CE3 4.23Å; V2694-W3532 HydrophobicContact CG2-CH2 3.96Å; V2694-W3532 HydrophobicContact CG2-CZ2 3.71Å; V2694-W3532 HydrophobicContact CG2-CZ3 4.2Å; V2694-F3561 HydrophobicContact CB-CZ 4.32Å; V2694-F3561 HydrophobicContact CG1-CZ 4.06Å
2695	N	81.1	Confident	83.3	Confident	20.8 Å²	20.8	51.3 Å²	51.3	11%	0.111	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	142.6	170	-63.2	-46.3	0	0	0	109.1	N2288 R2688 N2690 E2712 W2713 S2715	N2288-N2695 PolarHBondContact ND2-OD1 2.96Å; R2688-N2695 PolarHBondContact NH2-OD1 2.88Å; N2690-N2695 WeakPolarHBondContact CA-OD1 3.15Å; N2690-N2695 VanDerWaalsContact CG-OD1 3.25Å; N2690-N2695 PolarHBondContact OD1-OD1 2.92Å; N2695-E2712 CarbonylContact O-C 3.54Å; N2695-E2712 VanDerWaalsContact O-CA 3.28Å; N2695-E2712 WeakPolarHBondContact O-CA 3.29Å; N2695-W2713 HydrophobicContact CB-CD2 3.72Å; N2695-W2713 HydrophobicContact CB-CE3 4.12Å; N2695-W2713 HydrophobicContact CB-CG 4.34Å; N2695-W2713 HydrophobicContact CB-CH2 3.84Å; N2695-W2713 HydrophobicContact CB-CZ2 3.39Å; N2695-W2713 HydrophobicContact CB-CZ3 4.18Å; N2695-W2713 PolarHBondContact N-O 3.22Å; N2695-W2713 PolarHBondContact ND2-NE1 3.22Å; N2695-W2713 VanDerWaalsContact ND2-NE1 3.13Å; N2695-W2713 PolarHBondContact O-N 3.03Å; N2695-S2715 WeakPolarHBondContact ND2-CB 3.42Å; N2695-S2715 PolarHBondContact ND2-OG 3.18Å
2696	R	85.4	Confident	83.2	Confident	56.2 Å²	56.2	51.2 Å²	51.2	21%	0.212	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	132.5	-179	-176.9	-178.8	-85	178.2	-1.8	110.8	R2688 I2689 M2698 I2710 Y2711 E2712 S3534	R2688-R2696 CarbonylContact C-O 3.52Å; R2688-R2696 VanDerWaalsContact CA-O 3.29Å; R2688-R2696 WeakPolarHBondContact CA-O 3.31Å; I2689-R2696 HydrophobicContact CB-CB 4.36Å; I2689-R2696 PolarHBondContact N-O 3.09Å; I2689-R2696 PolarHBondContact O-N 3.11Å; R2696-M2698 HydrophobicContact CG-CG 4.02Å; R2696-M2698 HydrophobicContact CG-SD 4.47Å; R2696-I2710 HydrophobicContact CG-CG2 3.69Å; R2696-Y2711 CarbonylContact C-O 3.53Å; R2696-Y2711 VanDerWaalsContact CA-O 3.25Å; R2696-Y2711 WeakPolarHBondContact CA-O 3.35Å; R2696-E2712 HydrophobicContact CB-CG 4.34Å; R2696-E2712 HydrophobicContact CG-CG 4.14Å; R2696-E2712 IonicContact CZ-OE1 3.02Å; R2696-E2712 IonicContact NE-OE1 2.99Å; R2696-E2712 PolarHBondContact NE-OE1 2.83Å; R2696-E2712 IonicContact NH2-OE1 3.47Å; R2696-E2712 PolarHBondContact NH2-OE1 2.9Å; R2696-S3534 PolarHBondContact NH1-OG 2.82Å; R2696-S3534 PolarHBondContact NH2-OG 3.4Å
2697	L	87.7	Confident	83.3	Confident	28.8 Å²	28.8	50.3 Å²	50.3	15%	0.151	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	129	167.3	177	68.7	0	0	0	108.5	F2686 T2687 R2688 I2710 Y2711 W2713 I3321 L3325 M3409 L3469	F2686-L2697 HydrophobicContact CB-CD1 4.34Å; F2686-L2697 HydrophobicContact CD1-CD1 4.48Å; T2687-L2697 CarbonylContact O-C 3.54Å; R2688-L2697 HydrophobicContact CB-CD1 4.43Å; R2688-L2697 HydrophobicContact CG-CD1 3.63Å; L2697-I2710 WeakPolarHBondContact O-CA 3.33Å; L2697-Y2711 HydrophobicContact CD2-CD2 4.42Å; L2697-Y2711 PolarHBondContact N-O 3.05Å; L2697-Y2711 PolarHBondContact O-N 3.12Å; L2697-W2713 HydrophobicContact CB-CH2 3.98Å; L2697-W2713 HydrophobicContact CB-CZ3 3.6Å; L2697-W2713 VanDerWaalsContact CB-CZ3 3.45Å; L2697-W2713 HydrophobicContact CD2-CH2 4.09Å; L2697-W2713 HydrophobicContact CG-CH2 4.45Å; L2697-I3321 HydrophobicContact CD2-CD1 3.38Å; L2697-I3321 VanDerWaalsContact CD2-CD1 3.4Å; L2697-I3321 HydrophobicContact CD2-CG1 4.46Å; L2697-L3325 HydrophobicContact CD2-CD1 4.24Å; L2697-M3409 HydrophobicContact CD2-CE 4.08Å; L2697-L3469 HydrophobicContact CD1-CD1 3.81Å; L2697-L3469 HydrophobicContact CD2-CD1 4.2Å
2698	M	90.5	Very high	83.6	Confident	33.4 Å²	33.4	48.4 Å²	48.4	17%	0.165	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	122.9	177.9	-65	167.9	64.9	0	0	108.3	F2686 T2687 I2689 R2696 P2708 W2709 I2710 T3559	F2686-M2698 CarbonylContact C-O 3.56Å; F2686-M2698 WeakPolarHBondContact CA-O 3.41Å; T2687-M2698 PolarHBondContact N-O 2.94Å; T2687-M2698 WeakPolarHBondContact O-CB 3.22Å; T2687-M2698 PolarHBondContact O-N 3.06Å; I2689-M2698 HydrophobicContact CD1-SD 3.78Å; I2689-M2698 HydrophobicContact CG1-SD 4.41Å; R2696-M2698 HydrophobicContact CG-CG 4.02Å; R2696-M2698 HydrophobicContact CG-SD 4.47Å; M2698-P2708 HydrophobicContact CB-CB 4.01Å; M2698-P2708 HydrophobicContact CB-CG 4.04Å; M2698-P2708 HydrophobicContact CE-CB 4.44Å; M2698-P2708 HydrophobicContact CE-CG 3.44Å; M2698-P2708 VanDerWaalsContact CE-CG 3.47Å; M2698-P2708 HydrophobicContact CG-CB 4.4Å; M2698-P2708 HydrophobicContact CG-CG 4.21Å; M2698-W2709 CarbonylContact C-O 3.52Å; M2698-W2709 VanDerWaalsContact CA-O 3.29Å; M2698-W2709 WeakPolarHBondContact CA-O 3.37Å; M2698-I2710 HydrophobicContact CG-CG1 4.33Å; M2698-I2710 HydrophobicContact CG-CG2 4.48Å; M2698-T3559 WeakPolarHBondContact CE-OG1 3.47Å
2699	F	91.1	Very high	84.2	Confident	20.8 Å²	20.8	45.6 Å²	45.6	9%	0.091	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	117.3	175.5	169	-113.2	0	0	0	109.9	R2684 Q2685 F2686 P2701 P2708 W2709 L3320	R2684-F2699 HydrophobicContact CB-CE2 4.01Å; R2684-F2699 HydrophobicContact CB-CZ 4.28Å; R2684-F2699 HydrophobicContact CG-CE2 4.41Å; R2684-F2699 HydrophobicContact CG-CZ 4.37Å; Q2685-F2699 CarbonylContact O-C 3.52Å; Q2685-F2699 WeakPolarHBondContact O-CA 3.28Å; Q2685-F2699 WeakPolarHBondContact O-CD2 3.06Å; F2686-F2699 HydrophobicContact CD1-CB 4.36Å; F2686-F2699 AromaticContact CD1-CD2 3.57Å; F2686-F2699 HydrophobicContact CD1-CD2 3.57Å; F2686-F2699 VanDerWaalsContact CD1-CD2 3.47Å; F2686-F2699 HydrophobicContact CD1-CE2 4.3Å; F2686-F2699 HydrophobicContact CD1-CG 4.26Å; F2686-F2699 AromaticContact CE1-CD2 3.25Å; F2686-F2699 HydrophobicContact CE1-CD2 3.25Å; F2686-F2699 AromaticContact CE1-CE2 3.57Å; F2686-F2699 HydrophobicContact CE1-CE2 3.57Å; F2686-F2699 VanDerWaalsContact CE1-CE2 3.4Å; F2686-F2699 HydrophobicContact CE1-CG 4.22Å; F2686-F2699 AromaticContact CZ-CD2 3.86Å; F2686-F2699 HydrophobicContact CZ-CD2 4.07Å; F2686-F2699 AromaticContact CZ-CE2 3.85Å; F2686-F2699 HydrophobicContact CZ-CE2 3.98Å; F2699-P2701 HydrophobicContact CD1-CB 4.36Å; F2699-P2701 HydrophobicContact CE1-CB 3.76Å; F2699-P2701 HydrophobicContact CZ-CB 4.18Å; F2699-P2701 VanDerWaalsContact O-CD 3.31Å; F2699-P2701 WeakPolarHBondContact O-CD 3.38Å; F2699-P2708 CarbonylContact O-C 3.51Å; F2699-P2708 VanDerWaalsContact O-CA 3.27Å; F2699-P2708 WeakPolarHBondContact O-CA 3.37Å; F2699-P2708 WeakPolarHBondContact O-CB 3.4Å; F2699-W2709 HydrophobicContact CB-CB 4.19Å; F2699-W2709 HydrophobicContact CD1-CB 4.29Å; F2699-W2709 AromaticContact CD1-CD1 3.96Å; F2699-W2709 AromaticContact CD1-CD2 3.92Å; F2699-W2709 HydrophobicContact CD1-CD2 3.98Å; F2699-W2709 AromaticContact CD1-CE3 3.91Å; F2699-W2709 HydrophobicContact CD1-CE3 4.09Å; F2699-W2709 AromaticContact CD1-CG 3.93Å; F2699-W2709 HydrophobicContact CD1-CG 4.06Å; F2699-W2709 HydrophobicContact CD1-CZ3 4.42Å; F2699-W2709 HydrophobicContact CE1-CD2 4.33Å; F2699-W2709 HydrophobicContact CE1-CE3 4.37Å; F2699-W2709 HydrophobicContact CE1-CZ3 4.41Å; F2699-W2709 PolarHBondContact N-O 2.97Å; F2699-W2709 PolarHBondContact O-N 2.97Å; F2699-L3320 HydrophobicContact CB-CD2 4.03Å; F2699-L3320 HydrophobicContact CD1-CD2 3.41Å; F2699-L3320 VanDerWaalsContact CD1-CD2 3.41Å; F2699-L3320 HydrophobicContact CD2-CD2 4.45Å; F2699-L3320 HydrophobicContact CE1-CD1 4.28Å; F2699-L3320 HydrophobicContact CE1-CD2 3.87Å; F2699-L3320 HydrophobicContact CG-CD2 3.72Å; F2699-L3320 HydrophobicContact CZ-CD1 4.34Å
2700	T	90.1	Very high	84.8	Confident	38.2 Å²	38.2	43.6 Å²	43.6	23%	0.234	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	109.3	176	-52.5	0	0	0	0	108.6	R2684 Q2685 W2702	R2684-T2700 WeakPolarHBondContact CA-O 3.36Å; Q2685-T2700 PolarHBondContact N-O 3.17Å; Q2685-T2700 VanDerWaalsContact N-O 3.1Å; Q2685-T2700 PolarHBondContact O-N 3.17Å; T2700-W2702 VanDerWaalsContact CG2-O 3.3Å; T2700-W2702 WeakPolarHBondContact CG2-O 3.4Å
2701	P	87.5	Confident	85.5	Confident	3 Å²	3	42.5 Å²	42.5	2%	0.019	23%	0.226	C	C	.	.			trans	-77.2	-27.1	-170.7	32.6	-38.4	0	0	0	113.5	R2684 F2699 S2705 P2736	R2684-P2701 WeakPolarHBondContact CD-O 3.38Å; R2684-P2701 WeakPolarHBondContact CG-O 3.31Å; R2684-P2701 PolarHBondContact NE-O 3.06Å; R2684-P2701 VanDerWaalsContact NE-O 3.1Å; R2684-P2701 VanDerWaalsContact NH1-C 3.3Å; R2684-P2701 VanDerWaalsContact NH1-CB 3.35Å; R2684-P2701 PolarHBondContact NH1-O 2.84Å; F2699-P2701 HydrophobicContact CD1-CB 4.36Å; F2699-P2701 HydrophobicContact CE1-CB 3.76Å; F2699-P2701 HydrophobicContact CZ-CB 4.18Å; F2699-P2701 VanDerWaalsContact O-CD 3.31Å; F2699-P2701 WeakPolarHBondContact O-CD 3.38Å; P2701-S2705 WeakPolarHBondContact CD-OG 3.48Å; P2701-S2705 WeakPolarHBondContact CG-OG 3.23Å; P2701-P2736 HydrophobicContact CG-CG 4.07Å
2702	W	86.5	Confident	86.2	Confident	29 Å²	29	41.6 Å²	41.6	11%	0.11	22%	0.215	C	C	.	.	S	Bend	trans	-154.2	162.1	176.2	50.6	84.7	0	0	0	110.3	L2682 T2700 D2704 S2705 R3031 L3033 E3046	L2682-W2702 HydrophobicContact CD1-CB 3.87Å; T2700-W2702 VanDerWaalsContact CG2-O 3.3Å; T2700-W2702 WeakPolarHBondContact CG2-O 3.4Å; W2702-D2704 VanDerWaalsContact C-N 3.33Å; W2702-D2704 VanDerWaalsContact CD1-C 3.45Å; W2702-D2704 PolarHBondContact NE1-O 3.12Å; W2702-D2704 PolarHBondContact O-N 3.03Å; W2702-S2705 VanDerWaalsContact CD1-N 3.27Å; W2702-S2705 VanDerWaalsContact NE1-CA 3.25Å; W2702-S2705 VanDerWaalsContact O-CB 3.26Å; W2702-S2705 WeakPolarHBondContact O-CB 3.35Å; W2702-S2705 PolarHBondContact O-N 3.04Å; W2702-S2705 VanDerWaalsContact O-N 3.16Å; W2702-R3031 HydrophobicContact CB-CB 4.32Å; W2702-R3031 HydrophobicContact CB-CG 4.37Å; W2702-R3031 HydrophobicContact CD2-CB 3.75Å; W2702-R3031 HydrophobicContact CD2-CG 3.87Å; W2702-R3031 HydrophobicContact CE3-CB 3.95Å; W2702-R3031 HydrophobicContact CE3-CG 4.47Å; W2702-R3031 HydrophobicContact CG-CB 3.9Å; W2702-R3031 HydrophobicContact CG-CG 3.73Å; W2702-L3033 HydrophobicContact CH2-CD1 4.46Å; W2702-E3046 WeakPolarHBondContact CZ2-O 3.45Å
2703	L	80	Confident	86.6	Confident	131.8 Å²	131.8	39 Å²	39	69%	0.69	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-41.1	-171.4	-164.1	74.1	0	0	0	113	S2705	L2703-S2705 VanDerWaalsContact C-N 3.29Å; L2703-S2705 PolarHBondContact O-N 2.94Å
2704	D	80.8	Confident	86.7	Confident	121.6 Å²	121.6	35.2 Å²	35.2	65%	0.65	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.8	20.7	-178.9	-53.9	-39.5	0	0	0	113.1	W2702 S3030	W2702-D2704 VanDerWaalsContact C-N 3.33Å; W2702-D2704 VanDerWaalsContact CD1-C 3.45Å; W2702-D2704 PolarHBondContact NE1-O 3.12Å; W2702-D2704 PolarHBondContact O-N 3.03Å; D2704-S3030 PolarHBondContact OD2-OG 3.44Å
2705	S	85.5	Confident	86	Confident	15 Å²	15	35.4 Å²	35.4	11%	0.105	19%	0.188	C	C	.	.			trans	-69.5	132.9	179.4	-167.5	0	0	0	0	109.9	P2701 W2702 L2703 G2707 P2736	P2701-S2705 WeakPolarHBondContact CD-OG 3.48Å; P2701-S2705 WeakPolarHBondContact CG-OG 3.23Å; W2702-S2705 VanDerWaalsContact CD1-N 3.27Å; W2702-S2705 VanDerWaalsContact NE1-CA 3.25Å; W2702-S2705 VanDerWaalsContact O-CB 3.26Å; W2702-S2705 WeakPolarHBondContact O-CB 3.35Å; W2702-S2705 PolarHBondContact O-N 3.04Å; W2702-S2705 VanDerWaalsContact O-N 3.16Å; L2703-S2705 VanDerWaalsContact C-N 3.29Å; L2703-S2705 PolarHBondContact O-N 2.94Å; S2705-G2707 WeakPolarHBondContact CB-O 3.47Å; S2705-G2707 PolarHBondContact O-N 2.95Å; S2705-G2707 VanDerWaalsContact O-N 3.1Å; S2705-G2707 PolarHBondContact OG-O 2.91Å; S2705-P2736 WeakPolarHBondContact OG-CB 3.43Å
2706	P	87.8	Confident	84.9	Confident	65 Å²	65	37.4 Å²	37.4	42%	0.422	20%	0.198	S	C	.	.	S	Bend	trans	-62.7	-19.9	180	25	-33.6	0	0	0	112.8	P2736 E3046 L3536 S3557	P2706-P2736 CarbonylContact C-O 3.55Å; P2706-P2736 HydrophobicContact CG-CB 4.01Å; P2706-E3046 HydrophobicContact CG-CB 3.87Å; P2706-E3046 HydrophobicContact CG-CG 4.02Å; P2706-L3536 WeakPolarHBondContact O-CD2 3.11Å; P2706-S3557 VanDerWaalsContact O-CB 3.25Å; P2706-S3557 WeakPolarHBondContact O-CB 3.22Å; P2706-S3557 PolarHBondContact O-OG 2.95Å
2707	G	88.8	Confident	83.2	Confident	9.4 Å²	9.4	37 Å²	37	10%	0.097	20%	0.202	C	C	.	.	S	Bend	trans	-168.5	176.2	172.4	0	0	0	0	0	111.4	S2705 P2736	S2705-G2707 WeakPolarHBondContact CB-O 3.47Å; S2705-G2707 PolarHBondContact O-N 2.95Å; S2705-G2707 VanDerWaalsContact O-N 3.1Å; S2705-G2707 PolarHBondContact OG-O 2.91Å; G2707-P2736 WeakPolarHBondContact CA-O 3.28Å; G2707-P2736 PolarHBondContact N-O 3.04Å; G2707-P2736 WeakPolarHBondContact O-CA 3.25Å; G2707-P2736 VanDerWaalsContact O-CB 3.28Å; G2707-P2736 WeakPolarHBondContact O-CB 3.18Å; G2707-P2736 WeakPolarHBondContact O-CG 3.29Å
2708	P	91.5	Very high	81.2	Confident	18.2 Å²	18.2	38 Å²	38	12%	0.118	22%	0.219	C	C	.	.			trans	-83.5	161.2	173	29.9	-26	0	0	0	111.6	M2698 F2699 I2710 T3559	M2698-P2708 HydrophobicContact CB-CB 4.01Å; M2698-P2708 HydrophobicContact CB-CG 4.04Å; M2698-P2708 HydrophobicContact CE-CB 4.44Å; M2698-P2708 HydrophobicContact CE-CG 3.44Å; M2698-P2708 VanDerWaalsContact CE-CG 3.47Å; M2698-P2708 HydrophobicContact CG-CB 4.4Å; M2698-P2708 HydrophobicContact CG-CG 4.21Å; F2699-P2708 CarbonylContact O-C 3.51Å; F2699-P2708 VanDerWaalsContact O-CA 3.27Å; F2699-P2708 WeakPolarHBondContact O-CA 3.37Å; F2699-P2708 WeakPolarHBondContact O-CB 3.4Å; P2708-I2710 HydrophobicContact CG-CD1 4.43Å; P2708-I2710 HydrophobicContact CG-CG1 4.1Å; P2708-I2710 WeakPolarHBondContact O-CG1 3.47Å; P2708-I2710 PolarHBondContact O-N 2.79Å; P2708-T3559 HydrophobicContact CG-CG2 4.07Å
2709	W	92.5	Very high	78.8	Confident	26.4 Å²	26.4	39.5 Å²	39.5	10%	0.1	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	124.5	160.3	-66.2	40	0	0	0	107.8	M2698 F2699 Y2711 F2733 I2734 W2735 P2736 P3315 W3317 L3320 T3337	M2698-W2709 CarbonylContact C-O 3.52Å; M2698-W2709 VanDerWaalsContact CA-O 3.29Å; M2698-W2709 WeakPolarHBondContact CA-O 3.37Å; F2699-W2709 HydrophobicContact CB-CB 4.19Å; F2699-W2709 HydrophobicContact CD1-CB 4.29Å; F2699-W2709 AromaticContact CD1-CD1 3.96Å; F2699-W2709 AromaticContact CD1-CD2 3.92Å; F2699-W2709 HydrophobicContact CD1-CD2 3.98Å; F2699-W2709 AromaticContact CD1-CE3 3.91Å; F2699-W2709 HydrophobicContact CD1-CE3 4.09Å; F2699-W2709 AromaticContact CD1-CG 3.93Å; F2699-W2709 HydrophobicContact CD1-CG 4.06Å; F2699-W2709 HydrophobicContact CD1-CZ3 4.42Å; F2699-W2709 HydrophobicContact CE1-CD2 4.33Å; F2699-W2709 HydrophobicContact CE1-CE3 4.37Å; F2699-W2709 HydrophobicContact CE1-CZ3 4.41Å; F2699-W2709 PolarHBondContact N-O 2.97Å; F2699-W2709 PolarHBondContact O-N 2.97Å; W2709-Y2711 HydrophobicContact CB-CE2 4.08Å; W2709-Y2711 HydrophobicContact CE3-CE2 4.44Å; W2709-F2733 HydrophobicContact CB-CE2 4.01Å; W2709-F2733 HydrophobicContact CB-CZ 4.42Å; W2709-F2733 HydrophobicContact CD2-CE2 4.29Å; W2709-F2733 HydrophobicContact CD2-CZ 4.33Å; W2709-F2733 HydrophobicContact CE3-CD2 4.43Å; W2709-F2733 HydrophobicContact CE3-CE1 4.01Å; W2709-F2733 AromaticContact CE3-CE2 3.3Å; W2709-F2733 HydrophobicContact CE3-CE2 4.07Å; W2709-F2733 AromaticContact CE3-CZ 3.31Å; W2709-F2733 HydrophobicContact CE3-CZ 3.9Å; W2709-F2733 HydrophobicContact CG-CE2 4.42Å; W2709-F2733 HydrophobicContact CG-CZ 4.46Å; W2709-F2733 HydrophobicContact CH2-CZ 4.08Å; W2709-F2733 AromaticContact CZ3-CE1 3.55Å; W2709-F2733 HydrophobicContact CZ3-CE1 3.55Å; W2709-F2733 AromaticContact CZ3-CE2 3.75Å; W2709-F2733 HydrophobicContact CZ3-CE2 3.75Å; W2709-F2733 AromaticContact CZ3-CZ 3.48Å; W2709-F2733 HydrophobicContact CZ3-CZ 3.48Å; W2709-I2734 CarbonylContact C-O 3.58Å; W2709-I2734 WeakPolarHBondContact CA-O 3.35Å; W2709-W2735 HydrophobicContact CD2-CE3 4.45Å; W2709-W2735 HydrophobicContact CD2-CZ3 4.18Å; W2709-W2735 AromaticContact CE2-CZ3 3.71Å; W2709-W2735 HydrophobicContact CE3-CB 4.48Å; W2709-W2735 HydrophobicContact CE3-CG 4.23Å; W2709-W2735 HydrophobicContact CE3-CZ3 4.45Å; W2709-W2735 AromaticContact CH2-CD1 3.11Å; W2709-W2735 HydrophobicContact CH2-CD2 4.43Å; W2709-W2735 HydrophobicContact CH2-CE3 4.15Å; W2709-W2735 AromaticContact CH2-CG 3.84Å; W2709-W2735 HydrophobicContact CH2-CG 3.84Å; W2709-W2735 AromaticContact CH2-CH2 3.97Å; W2709-W2735 HydrophobicContact CH2-CH2 3.97Å; W2709-W2735 AromaticContact CH2-CZ3 3.35Å; W2709-W2735 HydrophobicContact CH2-CZ3 3.91Å; W2709-W2735 AromaticContact CH2-NE1 3.32Å; W2709-W2735 VanDerWaalsContact CH2-NE1 3.32Å; W2709-W2735 AromaticContact CZ2-CE3 3.85Å; W2709-W2735 HydrophobicContact CZ2-CE3 4.24Å; W2709-W2735 HydrophobicContact CZ2-CH2 4.46Å; W2709-W2735 AromaticContact CZ2-CZ3 3.6Å; W2709-W2735 HydrophobicContact CZ2-CZ3 3.6Å; W2709-W2735 VanDerWaalsContact CZ2-CZ3 3.41Å; W2709-W2735 HydrophobicContact CZ3-CB 4.04Å; W2709-W2735 AromaticContact CZ3-CD1 3.15Å; W2709-W2735 AromaticContact CZ3-CD2 3.76Å; W2709-W2735 HydrophobicContact CZ3-CD2 3.76Å; W2709-W2735 AromaticContact CZ3-CE2 3.8Å; W2709-W2735 AromaticContact CZ3-CG 3.38Å; W2709-W2735 HydrophobicContact CZ3-CG 3.38Å; W2709-W2735 HydrophobicContact CZ3-CH2 4.33Å; W2709-W2735 AromaticContact CZ3-CZ3 3.96Å; W2709-W2735 HydrophobicContact CZ3-CZ3 4.28Å; W2709-W2735 AromaticContact CZ3-NE1 3.38Å; W2709-P2736 VanDerWaalsContact CD2-CD 3.41Å; W2709-P2736 HydrophobicContact CD2-CG 3.84Å; W2709-P2736 VanDerWaalsContact CE2-CD 3.45Å; W2709-P2736 HydrophobicContact CG-CG 4.11Å; W2709-P2736 HydrophobicContact CZ2-CG 4.21Å; W2709-P2736 VanDerWaalsContact NE1-CD 3.32Å; W2709-P3315 HydrophobicContact CH2-CB 3.23Å; W2709-P3315 HydrophobicContact CH2-CG 4.24Å; W2709-P3315 HydrophobicContact CZ2-CB 3.43Å; W2709-P3315 VanDerWaalsContact CZ2-CB 3.43Å; W2709-P3315 HydrophobicContact CZ2-CG 3.96Å; W2709-P3315 HydrophobicContact CZ3-CB 4.33Å; W2709-W3317 HydrophobicContact CE3-CB 4.26Å; W2709-W3317 HydrophobicContact CZ3-CB 4.16Å; W2709-L3320 HydrophobicContact CE3-CD2 3.76Å; W2709-L3320 HydrophobicContact CZ3-CB 4.46Å; W2709-L3320 HydrophobicContact CZ3-CD2 3.94Å; W2709-T3337 HydrophobicContact CH2-CG2 3.78Å; W2709-T3337 HydrophobicContact CZ3-CG2 4.09Å
2710	I	92.9	Very high	76.2	Confident	13.6 Å²	13.6	41.8 Å²	41.8	7%	0.07	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	117.4	-175.8	-54.7	173.9	0	0	0	109	R2696 L2697 M2698 P2708 E2712 F2733 I2734 T3559	R2696-I2710 HydrophobicContact CG-CG2 3.69Å; L2697-I2710 WeakPolarHBondContact O-CA 3.33Å; M2698-I2710 HydrophobicContact CG-CG1 4.33Å; M2698-I2710 HydrophobicContact CG-CG2 4.48Å; P2708-I2710 HydrophobicContact CG-CD1 4.43Å; P2708-I2710 HydrophobicContact CG-CG1 4.1Å; P2708-I2710 WeakPolarHBondContact O-CG1 3.47Å; P2708-I2710 PolarHBondContact O-N 2.79Å; I2710-E2712 HydrophobicContact CG2-CG 3.96Å; I2710-F2733 CarbonylContact O-C 3.51Å; I2710-F2733 VanDerWaalsContact O-CA 3.28Å; I2710-F2733 WeakPolarHBondContact O-CA 3.38Å; I2710-F2733 WeakPolarHBondContact O-CD2 3.38Å; I2710-I2734 HydrophobicContact CB-CB 4.07Å; I2710-I2734 HydrophobicContact CB-CD1 4.34Å; I2710-I2734 HydrophobicContact CB-CG1 4.39Å; I2710-I2734 HydrophobicContact CD1-CB 4.26Å; I2710-I2734 HydrophobicContact CD1-CD1 4.3Å; I2710-I2734 HydrophobicContact CG1-CB 4.44Å; I2710-I2734 HydrophobicContact CG2-CD1 4.23Å; I2710-I2734 HydrophobicContact CG2-CG1 4.49Å; I2710-I2734 PolarHBondContact N-O 3.06Å; I2710-I2734 PolarHBondContact O-N 3.05Å; I2710-T3559 HydrophobicContact CD1-CG2 4.37Å
2711	Y	91.2	Very high	73.6	Confident	32.4 Å²	32.4	46.4 Å²	46.4	13%	0.127	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	123.1	171	-74.2	-96.1	0	0	0	108.8	R2696 L2697 W2709 W2713 L2730 F2733 W3317 L3320 I3321 L3404	R2696-Y2711 CarbonylContact C-O 3.53Å; R2696-Y2711 VanDerWaalsContact CA-O 3.25Å; R2696-Y2711 WeakPolarHBondContact CA-O 3.35Å; L2697-Y2711 HydrophobicContact CD2-CD2 4.42Å; L2697-Y2711 PolarHBondContact N-O 3.05Å; L2697-Y2711 PolarHBondContact O-N 3.12Å; W2709-Y2711 HydrophobicContact CB-CE2 4.08Å; W2709-Y2711 HydrophobicContact CE3-CE2 4.44Å; Y2711-W2713 HydrophobicContact CD1-CD2 4.44Å; Y2711-W2713 AromaticContact CD1-CE3 3.5Å; Y2711-W2713 HydrophobicContact CD1-CE3 3.5Å; Y2711-W2713 HydrophobicContact CD1-CH2 4.26Å; Y2711-W2713 HydrophobicContact CD1-CZ2 4.37Å; Y2711-W2713 AromaticContact CD1-CZ3 3.91Å; Y2711-W2713 HydrophobicContact CD1-CZ3 3.91Å; Y2711-W2713 HydrophobicContact CE1-CB 4.18Å; Y2711-W2713 HydrophobicContact CE1-CD2 4.18Å; Y2711-W2713 AromaticContact CE1-CE3 3.68Å; Y2711-W2713 HydrophobicContact CE1-CE3 3.68Å; Y2711-W2713 HydrophobicContact CE1-CG 4.45Å; Y2711-W2713 HydrophobicContact CE1-CZ3 4.37Å; Y2711-W2713 AromaticContact CG-CH2 3.84Å; Y2711-W2713 HydrophobicContact CG-CH2 3.99Å; Y2711-W2713 HydrophobicContact CG-CZ2 4.41Å; Y2711-W2713 HydrophobicContact CG-CZ3 4.41Å; Y2711-L2730 HydrophobicContact CD1-CD1 4.25Å; Y2711-L2730 HydrophobicContact CD2-CD1 3.65Å; Y2711-L2730 HydrophobicContact CE1-CD1 4.33Å; Y2711-L2730 HydrophobicContact CE2-CD1 3.38Å; Y2711-L2730 HydrophobicContact CE2-CD2 4.13Å; Y2711-L2730 HydrophobicContact CE2-CG 4.2Å; Y2711-L2730 HydrophobicContact CG-CD1 4.25Å; Y2711-F2733 AromaticContact CD1-CD2 3.68Å; Y2711-F2733 HydrophobicContact CD1-CD2 3.68Å; Y2711-F2733 AromaticContact CD1-CE2 3.81Å; Y2711-F2733 HydrophobicContact CD1-CE2 4.19Å; Y2711-F2733 HydrophobicContact CD2-CD2 4.25Å; Y2711-F2733 HydrophobicContact CD2-CE2 4.3Å; Y2711-F2733 AromaticContact CE1-CD2 3.51Å; Y2711-F2733 HydrophobicContact CE1-CD2 3.51Å; Y2711-F2733 AromaticContact CE1-CE2 3.63Å; Y2711-F2733 HydrophobicContact CE1-CE2 3.63Å; Y2711-F2733 HydrophobicContact CE1-CG 4.43Å; Y2711-F2733 HydrophobicContact CE1-CZ 4.04Å; Y2711-F2733 HydrophobicContact CE2-CD2 4.13Å; Y2711-F2733 AromaticContact CE2-CE2 3.74Å; Y2711-F2733 HydrophobicContact CE2-CE2 3.74Å; Y2711-F2733 HydrophobicContact CG-CD2 4.08Å; Y2711-F2733 HydrophobicContact CG-CE2 4.28Å; Y2711-F2733 AromaticContact CZ-CD2 3.75Å; Y2711-F2733 AromaticContact CZ-CE2 3.37Å; Y2711-F2733 VanDerWaalsContact CZ-CE2 3.45Å; Y2711-F2733 AromaticContact CZ-CZ 3.93Å; Y2711-F2733 WeakPolarHBondContact OH-CE2 3.44Å; Y2711-W3317 AromaticContact CE1-CE3 3.9Å; Y2711-W3317 HydrophobicContact CE1-CE3 3.9Å; Y2711-W3317 HydrophobicContact CE1-CZ3 4.37Å; Y2711-W3317 WeakPolarHBondContact CE1-O 3.48Å; Y2711-W3317 PolarHBondContact OH-O 3.03Å; Y2711-L3320 HydrophobicContact CE2-CD2 4.1Å; Y2711-L3320 WeakPolarHBondContact OH-CD2 3.41Å; Y2711-I3321 HydrophobicContact CD1-CG1 3.72Å; Y2711-I3321 HydrophobicContact CD2-CD1 4.17Å; Y2711-I3321 HydrophobicContact CD2-CG1 4.2Å; Y2711-I3321 HydrophobicContact CE1-CD1 4.35Å; Y2711-I3321 HydrophobicContact CE1-CG1 3.46Å; Y2711-I3321 VanDerWaalsContact CE1-CG1 3.46Å; Y2711-I3321 HydrophobicContact CE2-CD1 3.98Å; Y2711-I3321 HydrophobicContact CE2-CG1 4Å; Y2711-I3321 HydrophobicContact CG-CD1 4.46Å; Y2711-I3321 HydrophobicContact CG-CG1 4.08Å; Y2711-L3404 HydrophobicContact CD1-CD2 3.57Å; Y2711-L3404 HydrophobicContact CE1-CD2 4.04Å
2712	E	89.1	Confident	71.1	Confident	7.2 Å²	7.2	53.9 Å²	53.9	3%	0.034	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	124.6	177.7	-62.1	-178.5	154.1	0	0	109.7	V2694 N2695 R2696 I2710 L2730 L2731 R2732 W3532	V2694-E2712 HydrophobicContact CG1-CB 4.02Å; V2694-E2712 HydrophobicContact CG1-CG 4.09Å; N2695-E2712 CarbonylContact O-C 3.54Å; N2695-E2712 VanDerWaalsContact O-CA 3.28Å; N2695-E2712 WeakPolarHBondContact O-CA 3.29Å; R2696-E2712 HydrophobicContact CB-CG 4.34Å; R2696-E2712 HydrophobicContact CG-CG 4.14Å; R2696-E2712 IonicContact CZ-OE1 3.02Å; R2696-E2712 IonicContact NE-OE1 2.99Å; R2696-E2712 PolarHBondContact NE-OE1 2.83Å; R2696-E2712 IonicContact NH2-OE1 3.47Å; R2696-E2712 PolarHBondContact NH2-OE1 2.9Å; I2710-E2712 HydrophobicContact CG2-CG 3.96Å; E2712-L2730 WeakPolarHBondContact O-CD1 3.43Å; E2712-L2731 PolarHBondContact O-N 3.23Å; E2712-R2732 HydrophobicContact CB-CB 4.06Å; E2712-R2732 HydrophobicContact CG-CB 4.23Å; E2712-R2732 PolarHBondContact N-O 2.86Å; E2712-R2732 PolarHBondContact O-N 3.11Å; E2712-R2732 IonicContact OE1-CZ 2.63Å; E2712-R2732 IonicContact OE1-NH1 3.59Å; E2712-R2732 PolarHBondContact OE1-NH1 3.47Å; E2712-R2732 IonicContact OE1-NH2 3.39Å; E2712-R2732 PolarHBondContact OE1-NH2 3.14Å; E2712-R2732 VanDerWaalsContact OE2-CB 3.29Å; E2712-R2732 WeakPolarHBondContact OE2-CB 3.32Å; E2712-R2732 VanDerWaalsContact OE2-CD 3.28Å; E2712-R2732 WeakPolarHBondContact OE2-CD 3.33Å; E2712-R2732 IonicContact OE2-CZ 3.15Å; E2712-R2732 VanDerWaalsContact OE2-CZ 3.27Å; E2712-R2732 IonicContact OE2-NE 3.34Å; E2712-R2732 PolarHBondContact OE2-NE 2.84Å; E2712-R2732 IonicContact OE2-NH1 2.93Å; E2712-R2732 PolarHBondContact OE2-NH1 3.12Å; E2712-R2732 VanDerWaalsContact OE2-NH1 3.12Å; E2712-R2732 IonicContact OE2-NH2 3.39Å; E2712-R2732 PolarHBondContact OE2-NH2 3.36Å; E2712-W3532 PolarHBondContact OE2-NE1 3.24Å; E2712-W3532 VanDerWaalsContact OE2-NE1 3.1Å
2713	W	84	Confident	68.5	Low	32.2 Å²	32.2	58 Å²	58	12%	0.122	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	149.1	174.8	28.2	130	0	0	0	111.2	V2694 N2695 L2697 Y2711 S2715 S2728 H2729 L2730 I3321 F3405	V2694-W2713 CarbonylContact C-O 3.58Å; V2694-W2713 VanDerWaalsContact CA-O 3.3Å; V2694-W2713 WeakPolarHBondContact CA-O 3.28Å; N2695-W2713 HydrophobicContact CB-CD2 3.72Å; N2695-W2713 HydrophobicContact CB-CE3 4.12Å; N2695-W2713 HydrophobicContact CB-CG 4.34Å; N2695-W2713 HydrophobicContact CB-CH2 3.84Å; N2695-W2713 HydrophobicContact CB-CZ2 3.39Å; N2695-W2713 HydrophobicContact CB-CZ3 4.18Å; N2695-W2713 PolarHBondContact N-O 3.22Å; N2695-W2713 PolarHBondContact ND2-NE1 3.22Å; N2695-W2713 VanDerWaalsContact ND2-NE1 3.13Å; N2695-W2713 PolarHBondContact O-N 3.03Å; L2697-W2713 HydrophobicContact CB-CH2 3.98Å; L2697-W2713 HydrophobicContact CB-CZ3 3.6Å; L2697-W2713 VanDerWaalsContact CB-CZ3 3.45Å; L2697-W2713 HydrophobicContact CD2-CH2 4.09Å; L2697-W2713 HydrophobicContact CG-CH2 4.45Å; Y2711-W2713 HydrophobicContact CD1-CD2 4.44Å; Y2711-W2713 AromaticContact CD1-CE3 3.5Å; Y2711-W2713 HydrophobicContact CD1-CE3 3.5Å; Y2711-W2713 HydrophobicContact CD1-CH2 4.26Å; Y2711-W2713 HydrophobicContact CD1-CZ2 4.37Å; Y2711-W2713 AromaticContact CD1-CZ3 3.91Å; Y2711-W2713 HydrophobicContact CD1-CZ3 3.91Å; Y2711-W2713 HydrophobicContact CE1-CB 4.18Å; Y2711-W2713 HydrophobicContact CE1-CD2 4.18Å; Y2711-W2713 AromaticContact CE1-CE3 3.68Å; Y2711-W2713 HydrophobicContact CE1-CE3 3.68Å; Y2711-W2713 HydrophobicContact CE1-CG 4.45Å; Y2711-W2713 HydrophobicContact CE1-CZ3 4.37Å; Y2711-W2713 AromaticContact CG-CH2 3.84Å; Y2711-W2713 HydrophobicContact CG-CH2 3.99Å; Y2711-W2713 HydrophobicContact CG-CZ2 4.41Å; Y2711-W2713 HydrophobicContact CG-CZ3 4.41Å; W2713-S2715 PolarHBondContact O-N 2.8Å; W2713-S2728 WeakPolarHBondContact CB-O 3.19Å; W2713-H2729 CarbonylContact C-O 3.49Å; W2713-H2729 VanDerWaalsContact CA-O 3.25Å; W2713-H2729 WeakPolarHBondContact CA-O 3.41Å; W2713-H2729 HydrophobicContact CB-CB 4.43Å; W2713-H2729 VanDerWaalsContact CB-O 3.3Å; W2713-H2729 WeakPolarHBondContact CB-O 3.43Å; W2713-L2730 VanDerWaalsContact CD1-CA 3.44Å; W2713-L2730 HydrophobicContact CD2-CD1 4.16Å; W2713-L2730 HydrophobicContact CG-CD1 4.25Å; W2713-L2730 HydrophobicContact CZ2-CD1 4.16Å; W2713-I3321 HydrophobicContact CH2-CG1 4.45Å; W2713-I3321 HydrophobicContact CH2-CG2 4.46Å; W2713-I3321 HydrophobicContact CZ2-CG2 4.06Å; W2713-F3405 HydrophobicContact CB-CD2 4.37Å; W2713-F3405 HydrophobicContact CB-CE2 3.41Å; W2713-F3405 VanDerWaalsContact CB-CE2 3.41Å; W2713-F3405 HydrophobicContact CB-CZ 3.8Å; W2713-F3405 AromaticContact CD1-CE2 3.97Å; W2713-F3405 AromaticContact CD2-CE1 3.8Å; W2713-F3405 HydrophobicContact CD2-CE1 3.8Å; W2713-F3405 AromaticContact CD2-CE2 3.77Å; W2713-F3405 HydrophobicContact CD2-CE2 3.77Å; W2713-F3405 AromaticContact CD2-CZ 3.27Å; W2713-F3405 HydrophobicContact CD2-CZ 3.27Å; W2713-F3405 AromaticContact CE2-CE1 3.97Å; W2713-F3405 AromaticContact CE2-CZ 3.92Å; W2713-F3405 AromaticContact CE3-CE1 3.78Å; W2713-F3405 HydrophobicContact CE3-CE1 3.78Å; W2713-F3405 HydrophobicContact CE3-CE2 4.12Å; W2713-F3405 AromaticContact CE3-CZ 3.25Å; W2713-F3405 HydrophobicContact CE3-CZ 3.25Å; W2713-F3405 HydrophobicContact CG-CD2 4.25Å; W2713-F3405 HydrophobicContact CG-CE1 4.34Å; W2713-F3405 AromaticContact CG-CE2 3.46Å; W2713-F3405 HydrophobicContact CG-CE2 3.46Å; W2713-F3405 VanDerWaalsContact CG-CE2 3.46Å; W2713-F3405 AromaticContact CG-CZ 3.53Å; W2713-F3405 HydrophobicContact CG-CZ 3.53Å; W2713-F3405 HydrophobicContact CH2-CE1 4.14Å; W2713-F3405 HydrophobicContact CH2-CZ 4.44Å; W2713-F3405 HydrophobicContact CZ2-CE1 4.19Å; W2713-F3405 HydrophobicContact CZ2-CZ 4.49Å; W2713-F3405 AromaticContact CZ3-CE1 3.9Å; W2713-F3405 HydrophobicContact CZ3-CE1 3.9Å; W2713-F3405 AromaticContact CZ3-CZ 3.82Å; W2713-F3405 HydrophobicContact CZ3-CZ 3.82Å
2714	G	75.7	Confident	66.5	Low	9.6 Å²	9.6	54.8 Å²	54.8	10%	0.099	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	159.2	178.2	0	0	0	0	0	111.7	K2693 D2716 S2728 H2729	K2693-G2714 CarbonylContact O-C 3.45Å; K2693-G2714 WeakPolarHBondContact O-CA 3.36Å; G2714-D2716 VanDerWaalsContact C-N 3.34Å; G2714-D2716 PolarHBondContact O-N 2.49Å; G2714-S2728 WeakPolarHBondContact O-CA 3.38Å; G2714-H2729 PolarHBondContact N-O 2.98Å; G2714-H2729 VanDerWaalsContact N-O 3.07Å; G2714-H2729 PolarHBondContact O-N 3.1Å; G2714-H2729 VanDerWaalsContact O-N 3.17Å
2715	S	66.8	Low	64.5	Low	30.8 Å²	30.8	52.8 Å²	52.8	22%	0.215	31%	0.312	C	S	.	.			trans	-98.7	94.9	170	151	0	0	0	0	110	N2288 K2290 K2693 N2695 W2713 V2717	N2288-S2715 WeakPolarHBondContact CB-OG 3.34Å; N2288-S2715 VanDerWaalsContact CG-OG 3.24Å; N2288-S2715 WeakPolarHBondContact ND2-CB 3.32Å; N2288-S2715 PolarHBondContact ND2-OG 3.1Å; N2288-S2715 VanDerWaalsContact ND2-OG 3.11Å; K2290-S2715 WeakPolarHBondContact CD-O 3.41Å; K2290-S2715 WeakPolarHBondContact CE-O 3.44Å; K2290-S2715 PolarHBondContact NZ-O 2.86Å; K2693-S2715 CarbonylContact C-O 3.6Å; K2693-S2715 WeakPolarHBondContact CA-O 3.21Å; K2693-S2715 WeakPolarHBondContact CA-OG 3.41Å; K2693-S2715 WeakPolarHBondContact CB-O 3.29Å; K2693-S2715 PolarHBondContact O-N 2.97Å; K2693-S2715 VanDerWaalsContact O-N 3.1Å; K2693-S2715 VanDerWaalsContact O-O 3.11Å; K2693-S2715 PolarHBondContact O-OG 3.2Å; N2695-S2715 WeakPolarHBondContact ND2-CB 3.42Å; N2695-S2715 PolarHBondContact ND2-OG 3.18Å; W2713-S2715 PolarHBondContact O-N 2.8Å; S2715-V2717 VanDerWaalsContact C-N 3.32Å; S2715-V2717 PolarHBondContact O-N 2.95Å; S2715-V2717 VanDerWaalsContact O-N 3.16Å
2716	D	57.2	Low	62.4	Low	62.4 Å²	62.4	57.3 Å²	57.3	33%	0.334	34%	0.335	S	S	.	.			trans	-71.4	85.4	-179.6	-93.7	-13	0	0	0	112.2	K2290 K2693 G2714 G2718 K2747 R3747	K2290-D2716 VanDerWaalsContact CE-O 3.26Å; K2290-D2716 WeakPolarHBondContact CE-O 3.37Å; K2290-D2716 PolarHBondContact NZ-O 2.65Å; K2693-D2716 VanDerWaalsContact CD-OD2 3.24Å; K2693-D2716 WeakPolarHBondContact CD-OD2 3.16Å; K2693-D2716 WeakPolarHBondContact CE-OD2 2.87Å; K2693-D2716 IonicContact NZ-OD2 2.87Å; K2693-D2716 PolarHBondContact NZ-OD2 3.35Å; K2693-D2716 VanDerWaalsContact NZ-OD2 3.15Å; G2714-D2716 VanDerWaalsContact C-N 3.34Å; G2714-D2716 PolarHBondContact O-N 2.49Å; D2716-G2718 PolarHBondContact O-N 3.24Å; D2716-K2747 HydrophobicContact CB-CD 3.92Å; D2716-K2747 HydrophobicContact CB-CG 4.28Å; D2716-K2747 WeakPolarHBondContact O-CE 3.26Å; D2716-K2747 PolarHBondContact O-NZ 3.3Å; D2716-R3747 IonicContact OD1-CZ 3.55Å; D2716-R3747 IonicContact OD1-NE 3.69Å; D2716-R3747 IonicContact OD1-NH2 3.63Å; D2716-R3747 PolarHBondContact OD1-NH2 2.81Å; D2716-R3747 IonicContact OD2-NH2 3.35Å; D2716-R3747 PolarHBondContact OD2-NH2 2.99Å
2717	V	49.5	Very low	60.5	Low	49.2 Å²	49.2	58.9 Å²	58.9	30%	0.298	34%	0.336	S	S	.	.			trans	-89.7	89.8	178.6	-166.8	0	0	0	0	109.3	K2290 K2693 S2715 S2719 L3529 W3532 S3743	K2290-V2717 PolarHBondContact NZ-O 2.71Å; K2693-V2717 HydrophobicContact CB-CG2 4.31Å; K2693-V2717 HydrophobicContact CD-CG2 4.38Å; K2693-V2717 HydrophobicContact CG-CB 3.84Å; K2693-V2717 HydrophobicContact CG-CG2 3.69Å; S2715-V2717 VanDerWaalsContact C-N 3.32Å; S2715-V2717 PolarHBondContact O-N 2.95Å; S2715-V2717 VanDerWaalsContact O-N 3.16Å; V2717-S2719 PolarHBondContact O-N 3.14Å; V2717-L3529 HydrophobicContact CG1-CB 4.5Å; V2717-L3529 WeakPolarHBondContact CG1-O 3.39Å; V2717-L3529 HydrophobicContact CG2-CB 4.38Å; V2717-L3529 HydrophobicContact CG2-CD2 3.88Å; V2717-L3529 HydrophobicContact CG2-CG 4.04Å; V2717-W3532 HydrophobicContact CG2-CZ3 3.97Å; V2717-S3743 PolarHBondContact N-OG 3.49Å; V2717-S3743 PolarHBondContact O-OG 3.06Å; V2717-S3743 VanDerWaalsContact O-OG 3.05Å
2718	G	46.8	Very low	58.9	Low	48.4 Å²	48.4	60.8 Å²	60.8	50%	0.499	35%	0.348	S	S	.	.			trans	-114.8	114.1	175.2	0	0	0	0	0	113.1	D2716 S2720 K2747 S3740	D2716-G2718 PolarHBondContact O-N 3.24Å; G2718-S2720 PolarHBondContact O-N 2.97Å; G2718-K2747 PolarHBondContact O-NZ 2.96Å; G2718-K2747 VanDerWaalsContact O-NZ 3.14Å; G2718-S3740 VanDerWaalsContact CA-O 3.27Å; G2718-S3740 WeakPolarHBondContact CA-O 3.43Å
2719	S	39.4	Very low	57.7	Low	65.4 Å²	65.4	63.4 Å²	63.4	46%	0.457	36%	0.359	S	S	.	.			trans	-72.3	100.4	168.2	37.8	0	0	0	0	113.8	R1910 V2717 M2721 K2747 D3487	R1910-S2719 WeakPolarHBondContact CD-O 3.34Å; R1910-S2719 VanDerWaalsContact CZ-O 3.29Å; R1910-S2719 PolarHBondContact NE-O 3.07Å; R1910-S2719 PolarHBondContact NH1-O 3.1Å; V2717-S2719 PolarHBondContact O-N 3.14Å; S2719-M2721 PolarHBondContact O-N 2.83Å; S2719-K2747 PolarHBondContact OG-NZ 2.82Å; S2719-D3487 WeakPolarHBondContact CB-O 3.34Å
2720	S	36	Very low	57.1	Low	68 Å²	68	63.2 Å²	63.2	48%	0.476	36%	0.359	S	S	.	.	S	Bend	trans	-117.1	81.7	169.9	-174.6	0	0	0	0	113.7	T1894 Q2301 G2718 K2722 D3486	T1894-S2720 VanDerWaalsContact CB-OG 3.26Å; T1894-S2720 WeakPolarHBondContact CB-OG 3.3Å; T1894-S2720 PolarHBondContact OG1-OG 2.68Å; T1894-S2720 VanDerWaalsContact OG1-OG 3.12Å; Q2301-S2720 PolarHBondContact NE2-OG 2.97Å; G2718-S2720 PolarHBondContact O-N 2.97Å; S2720-K2722 PolarHBondContact O-N 2.85Å; S2720-D3486 PolarHBondContact N-O 3.01Å
2721	M	36.5	Very low	56.8	Low	136 Å²	136	64.2 Å²	64.2	67%	0.67	37%	0.365	S	S	*	.			trans	-126.3	92.7	161.2	-125.9	174.7	164.7	0	0	110.9	Q1893 T1894 S2719 L2723	Q1893-M2721 HydrophobicContact CB-SD 4.21Å; Q1893-M2721 HydrophobicContact CG-SD 4.28Å; Q1893-M2721 PolarHBondContact OE1-SD 3.03Å; T1894-M2721 HydrophobicContact CG2-CB 3.62Å; T1894-M2721 VanDerWaalsContact CG2-N 3.26Å; T1894-M2721 PolarHBondContact OG1-N 3.49Å; S2719-M2721 PolarHBondContact O-N 2.83Å; M2721-L2723 HydrophobicContact CB-CB 4.32Å; M2721-L2723 HydrophobicContact CB-CD1 4Å; M2721-L2723 HydrophobicContact CE-CD1 3.61Å; M2721-L2723 HydrophobicContact CG-CD1 3.66Å; M2721-L2723 PolarHBondContact O-N 3.24Å; M2721-L2723 HydrophobicContact SD-CD1 3.42Å; M2721-L2723 WeakPolarHBondContact SD-CD1 3.36Å
2722	K	35	Very low	56.7	Low	160.8 Å²	160.8	65.7 Å²	65.7	70%	0.699	37%	0.37	S	S	*	.			trans	-86.4	81.2	162.9	-85.1	-178.1	174.6	174.7	0	109	E1895 Y1897 S2720 S2724	E1895-K2722 WeakPolarHBondContact OE1-CD 3.36Å; E1895-K2722 WeakPolarHBondContact OE1-CE 2.89Å; E1895-K2722 IonicContact OE1-NZ 3.27Å; E1895-K2722 PolarHBondContact OE1-NZ 3.22Å; E1895-K2722 WeakPolarHBondContact OE2-CE 3.28Å; E1895-K2722 IonicContact OE2-NZ 3.9Å; E1895-K2722 PolarHBondContact OE2-NZ 2.81Å; Y1897-K2722 WeakPolarHBondContact OH-CE 3.45Å; Y1897-K2722 PolarHBondContact OH-NZ 2.87Å; S2720-K2722 PolarHBondContact O-N 2.85Å; K2722-S2724 PolarHBondContact O-N 2.97Å; K2722-S2724 VanDerWaalsContact O-N 3.16Å
2723	L	32.2	Very low	56.9	Low	114.6 Å²	114.6	65.9 Å²	65.9	60%	0.6	37%	0.371	S	S	*	.			trans	-82.5	92	161.3	-106.1	100.4	0	0	0	108.4	V1998 M2721 S2725	V1998-L2723 HydrophobicContact CG1-CB 4.4Å; M2721-L2723 HydrophobicContact CB-CB 4.32Å; M2721-L2723 HydrophobicContact CB-CD1 4Å; M2721-L2723 HydrophobicContact CE-CD1 3.61Å; M2721-L2723 HydrophobicContact CG-CD1 3.66Å; M2721-L2723 PolarHBondContact O-N 3.24Å; M2721-L2723 HydrophobicContact SD-CD1 3.42Å; M2721-L2723 WeakPolarHBondContact SD-CD1 3.36Å; L2723-S2725 PolarHBondContact O-N 2.76Å
2724	S	37.6	Very low	57.4	Low	64.4 Å²	64.4	65.1 Å²	65.1	45%	0.45	37%	0.369	S	S	.	.	S	Bend	trans	-22.1	109.6	152.8	55.3	0	0	0	0	111.5	K2722 D2726	K2722-S2724 PolarHBondContact O-N 2.97Å; K2722-S2724 VanDerWaalsContact O-N 3.16Å; S2724-D2726 WeakPolarHBondContact O-CA 3.09Å; S2724-D2726 WeakPolarHBondContact O-CB 3.47Å; S2724-D2726 PolarHBondContact O-N 3.24Å
2725	S	37.5	Very low	58.2	Low	79.6 Å²	79.6	65.4 Å²	65.4	56%	0.557	37%	0.367	S	S	*	.	S	Bend	trans	6.7	55.9	167.3	60.1	0	0	0	0	115.9	L2723 H2727	L2723-S2725 PolarHBondContact O-N 2.76Å; S2725-H2727 VanDerWaalsContact C-N 3.32Å; S2725-H2727 PolarHBondContact O-CE1 3.47Å; S2725-H2727 VanDerWaalsContact O-CG 3.29Å; S2725-H2727 PolarHBondContact O-N 2.89Å; S2725-H2727 PolarHBondContact O-ND1 3.09Å; S2725-H2727 VanDerWaalsContact O-ND1 3.12Å; S2725-H2727 PolarHBondContact OG-CE1 2.71Å
2726	D	42.4	Very low	59.4	Low	109 Å²	109	64 Å²	64	58%	0.583	36%	0.357	S	S	*	.			trans	-54	75.6	171.5	-102.2	-7.9	0	0	0	114.1	S2724 S2728	S2724-D2726 WeakPolarHBondContact O-CA 3.09Å; S2724-D2726 WeakPolarHBondContact O-CB 3.47Å; S2724-D2726 PolarHBondContact O-N 3.24Å; D2726-S2728 PolarHBondContact O-N 2.92Å
2727	H	47.5	Very low	60.9	Low	99.6 Å²	99.6	62.1 Å²	62.1	46%	0.461	35%	0.349	S	S	.	.			trans	-53.5	105.1	175.1	-56	58.3	0	0	0	112	S2725 H2729 L2730	S2725-H2727 VanDerWaalsContact C-N 3.32Å; S2725-H2727 PolarHBondContact O-CE1 3.47Å; S2725-H2727 VanDerWaalsContact O-CG 3.29Å; S2725-H2727 PolarHBondContact O-N 2.89Å; S2725-H2727 PolarHBondContact O-ND1 3.09Å; S2725-H2727 VanDerWaalsContact O-ND1 3.12Å; S2725-H2727 PolarHBondContact OG-CE1 2.71Å; H2727-H2729 AromaticContact ND1-CE1 3.98Å; H2727-H2729 WeakPolarHBondContact O-CA 3.36Å; H2727-H2729 PolarHBondContact O-CD2 3.12Å; H2727-H2729 PolarHBondContact O-N 3.04Å; H2727-H2729 VanDerWaalsContact O-N 3.09Å; H2727-H2729 PolarHBondContact O-NE2 3.47Å; H2727-L2730 PolarHBondContact O-N 3Å
2728	S	55	Low	62.6	Low	50 Å²	50	63.7 Å²	63.7	35%	0.35	36%	0.356	S	S	.	.			trans	-59.3	90.4	166.1	55.6	0	0	0	0	109.8	W2713 G2714 D2726 L2730 T3410	W2713-S2728 WeakPolarHBondContact CB-O 3.19Å; G2714-S2728 WeakPolarHBondContact O-CA 3.38Å; D2726-S2728 PolarHBondContact O-N 2.92Å; S2728-L2730 PolarHBondContact O-N 2.86Å; S2728-T3410 WeakPolarHBondContact OG-CG2 3.44Å
2729	H	67.5	Low	64.5	Low	71.4 Å²	71.4	68.2 Å²	68.2	33%	0.331	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	124.3	-173.1	-62.9	-73.6	0	0	0	111.2	W2713 G2714 H2727 L2731 P2746	W2713-H2729 CarbonylContact C-O 3.49Å; W2713-H2729 VanDerWaalsContact CA-O 3.25Å; W2713-H2729 WeakPolarHBondContact CA-O 3.41Å; W2713-H2729 HydrophobicContact CB-CB 4.43Å; W2713-H2729 VanDerWaalsContact CB-O 3.3Å; W2713-H2729 WeakPolarHBondContact CB-O 3.43Å; G2714-H2729 PolarHBondContact N-O 2.98Å; G2714-H2729 VanDerWaalsContact N-O 3.07Å; G2714-H2729 PolarHBondContact O-N 3.1Å; G2714-H2729 VanDerWaalsContact O-N 3.17Å; H2727-H2729 AromaticContact ND1-CE1 3.98Å; H2727-H2729 WeakPolarHBondContact O-CA 3.36Å; H2727-H2729 PolarHBondContact O-CD2 3.12Å; H2727-H2729 PolarHBondContact O-N 3.04Å; H2727-H2729 VanDerWaalsContact O-N 3.09Å; H2727-H2729 PolarHBondContact O-NE2 3.47Å; H2729-L2731 PolarHBondContact O-N 3.02Å; H2729-P2746 HydrophobicContact CB-CB 4.14Å; H2729-P2746 HydrophobicContact CB-CG 3.49Å; H2729-P2746 VanDerWaalsContact CB-CG 3.45Å
2730	L	79.7	Confident	67	Low	22 Å²	22	67.6 Å²	67.6	12%	0.115	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57	123.3	166.1	-178	69.2	0	0	0	107.5	Y2711 E2712 W2713 H2727 S2728 R2732 F2733 I2744 W3317 L3402 L3404	Y2711-L2730 HydrophobicContact CD1-CD1 4.25Å; Y2711-L2730 HydrophobicContact CD2-CD1 3.65Å; Y2711-L2730 HydrophobicContact CE1-CD1 4.33Å; Y2711-L2730 HydrophobicContact CE2-CD1 3.38Å; Y2711-L2730 HydrophobicContact CE2-CD2 4.13Å; Y2711-L2730 HydrophobicContact CE2-CG 4.2Å; Y2711-L2730 HydrophobicContact CG-CD1 4.25Å; E2712-L2730 WeakPolarHBondContact O-CD1 3.43Å; W2713-L2730 VanDerWaalsContact CD1-CA 3.44Å; W2713-L2730 HydrophobicContact CD2-CD1 4.16Å; W2713-L2730 HydrophobicContact CG-CD1 4.25Å; W2713-L2730 HydrophobicContact CZ2-CD1 4.16Å; H2727-L2730 PolarHBondContact O-N 3Å; S2728-L2730 PolarHBondContact O-N 2.86Å; L2730-R2732 VanDerWaalsContact CD1-O 3.3Å; L2730-R2732 WeakPolarHBondContact CD1-O 3.38Å; L2730-F2733 HydrophobicContact CD2-CB 4.35Å; L2730-I2744 HydrophobicContact CB-CD1 4.04Å; L2730-I2744 HydrophobicContact CD2-CD1 3.74Å; L2730-I2744 HydrophobicContact CG-CD1 3.91Å; L2730-I2744 HydrophobicContact CG-CG1 4.41Å; L2730-I2744 VanDerWaalsContact O-CB 3.28Å; L2730-I2744 WeakPolarHBondContact O-CB 3.34Å; L2730-I2744 VanDerWaalsContact O-CG2 3.31Å; L2730-I2744 WeakPolarHBondContact O-CG2 3.39Å; L2730-W3317 HydrophobicContact CD2-CH2 4.23Å; L2730-W3317 HydrophobicContact CD2-CZ3 4.03Å; L2730-L3402 HydrophobicContact CB-CD2 4.42Å; L2730-L3402 HydrophobicContact CD2-CD2 3.79Å; L2730-L3404 HydrophobicContact CD1-CD2 3.94Å; L2730-L3404 HydrophobicContact CD2-CD1 4.3Å; L2730-L3404 HydrophobicContact CD2-CD2 4.18Å
2731	L	86.5	Confident	69.7	Low	34.4 Å²	34.4	70 Å²	70	18%	0.18	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	-37.5	178.2	-63.8	179	0	0	0	110.7	V2694 E2712 H2729 S2743 I2744 P2746 W3532 R3747	V2694-L2731 HydrophobicContact CG1-CD1 4.38Å; V2694-L2731 HydrophobicContact CG2-CD1 4.07Å; E2712-L2731 PolarHBondContact O-N 3.23Å; H2729-L2731 PolarHBondContact O-N 3.02Å; L2731-S2743 CarbonylContact O-C 3.56Å; L2731-S2743 WeakPolarHBondContact O-CA 3.36Å; L2731-I2744 PolarHBondContact O-N 3.08Å; L2731-P2746 HydrophobicContact CD2-CG 4.16Å; L2731-W3532 HydrophobicContact CD1-CH2 4.37Å; L2731-W3532 HydrophobicContact CD1-CZ2 3.83Å; L2731-R3747 PolarHBondContact O-NH1 3.31Å
2732	R	89.7	Confident	72.4	Confident	65 Å²	65	64.1 Å²	64.1	25%	0.245	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	144.1	-177.3	-161.7	178.2	-58.1	152.4	-8.1	111.9	E2712 L2730 I2734 R2741 I2742 R3747 D3750	E2712-R2732 HydrophobicContact CB-CB 4.06Å; E2712-R2732 HydrophobicContact CG-CB 4.23Å; E2712-R2732 PolarHBondContact N-O 2.86Å; E2712-R2732 PolarHBondContact O-N 3.11Å; E2712-R2732 IonicContact OE1-CZ 2.63Å; E2712-R2732 IonicContact OE1-NH1 3.59Å; E2712-R2732 PolarHBondContact OE1-NH1 3.47Å; E2712-R2732 IonicContact OE1-NH2 3.39Å; E2712-R2732 PolarHBondContact OE1-NH2 3.14Å; E2712-R2732 VanDerWaalsContact OE2-CB 3.29Å; E2712-R2732 WeakPolarHBondContact OE2-CB 3.32Å; E2712-R2732 VanDerWaalsContact OE2-CD 3.28Å; E2712-R2732 WeakPolarHBondContact OE2-CD 3.33Å; E2712-R2732 IonicContact OE2-CZ 3.15Å; E2712-R2732 VanDerWaalsContact OE2-CZ 3.27Å; E2712-R2732 IonicContact OE2-NE 3.34Å; E2712-R2732 PolarHBondContact OE2-NE 2.84Å; E2712-R2732 IonicContact OE2-NH1 2.93Å; E2712-R2732 PolarHBondContact OE2-NH1 3.12Å; E2712-R2732 VanDerWaalsContact OE2-NH1 3.12Å; E2712-R2732 IonicContact OE2-NH2 3.39Å; E2712-R2732 PolarHBondContact OE2-NH2 3.36Å; L2730-R2732 VanDerWaalsContact CD1-O 3.3Å; L2730-R2732 WeakPolarHBondContact CD1-O 3.38Å; R2732-I2734 HydrophobicContact CG-CD1 4.34Å; R2732-I2734 HydrophobicContact CG-CG1 3.89Å; R2732-R2741 HydrophobicContact CG-CG 3.8Å; R2732-I2742 CarbonylContact C-O 3.52Å; R2732-I2742 VanDerWaalsContact CA-O 3.24Å; R2732-I2742 WeakPolarHBondContact CA-O 3.29Å; R2732-I2742 VanDerWaalsContact CG-O 3.3Å; R2732-I2742 WeakPolarHBondContact CG-O 3.29Å; R2732-R3747 PolarHBondContact NH2-O 2.88Å; R2732-D3750 IonicContact CZ-OD2 3.17Å; R2732-D3750 IonicContact NH2-OD1 2.74Å; R2732-D3750 PolarHBondContact NH2-OD1 2.85Å; R2732-D3750 IonicContact NH2-OD2 3.27Å; R2732-D3750 PolarHBondContact NH2-OD2 2.9Å; R2732-D3750 VanDerWaalsContact NH2-OD2 3.14Å
2733	F	92.9	Very high	75.1	Confident	11.4 Å²	11.4	57.2 Å²	57.2	5%	0.05	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	131.6	164.2	177.4	-112	0	0	0	109.4	W2709 I2710 Y2711 L2730 W2735 R2741 I2742 W3317	W2709-F2733 HydrophobicContact CB-CE2 4.01Å; W2709-F2733 HydrophobicContact CB-CZ 4.42Å; W2709-F2733 HydrophobicContact CD2-CE2 4.29Å; W2709-F2733 HydrophobicContact CD2-CZ 4.33Å; W2709-F2733 HydrophobicContact CE3-CD2 4.43Å; W2709-F2733 HydrophobicContact CE3-CE1 4.01Å; W2709-F2733 AromaticContact CE3-CE2 3.3Å; W2709-F2733 HydrophobicContact CE3-CE2 4.07Å; W2709-F2733 AromaticContact CE3-CZ 3.31Å; W2709-F2733 HydrophobicContact CE3-CZ 3.9Å; W2709-F2733 HydrophobicContact CG-CE2 4.42Å; W2709-F2733 HydrophobicContact CG-CZ 4.46Å; W2709-F2733 HydrophobicContact CH2-CZ 4.08Å; W2709-F2733 AromaticContact CZ3-CE1 3.55Å; W2709-F2733 HydrophobicContact CZ3-CE1 3.55Å; W2709-F2733 AromaticContact CZ3-CE2 3.75Å; W2709-F2733 HydrophobicContact CZ3-CE2 3.75Å; W2709-F2733 AromaticContact CZ3-CZ 3.48Å; W2709-F2733 HydrophobicContact CZ3-CZ 3.48Å; I2710-F2733 CarbonylContact O-C 3.51Å; I2710-F2733 VanDerWaalsContact O-CA 3.28Å; I2710-F2733 WeakPolarHBondContact O-CA 3.38Å; I2710-F2733 WeakPolarHBondContact O-CD2 3.38Å; Y2711-F2733 AromaticContact CD1-CD2 3.68Å; Y2711-F2733 HydrophobicContact CD1-CD2 3.68Å; Y2711-F2733 AromaticContact CD1-CE2 3.81Å; Y2711-F2733 HydrophobicContact CD1-CE2 4.19Å; Y2711-F2733 HydrophobicContact CD2-CD2 4.25Å; Y2711-F2733 HydrophobicContact CD2-CE2 4.3Å; Y2711-F2733 AromaticContact CE1-CD2 3.51Å; Y2711-F2733 HydrophobicContact CE1-CD2 3.51Å; Y2711-F2733 AromaticContact CE1-CE2 3.63Å; Y2711-F2733 HydrophobicContact CE1-CE2 3.63Å; Y2711-F2733 HydrophobicContact CE1-CG 4.43Å; Y2711-F2733 HydrophobicContact CE1-CZ 4.04Å; Y2711-F2733 HydrophobicContact CE2-CD2 4.13Å; Y2711-F2733 AromaticContact CE2-CE2 3.74Å; Y2711-F2733 HydrophobicContact CE2-CE2 3.74Å; Y2711-F2733 HydrophobicContact CG-CD2 4.08Å; Y2711-F2733 HydrophobicContact CG-CE2 4.28Å; Y2711-F2733 AromaticContact CZ-CD2 3.75Å; Y2711-F2733 AromaticContact CZ-CE2 3.37Å; Y2711-F2733 VanDerWaalsContact CZ-CE2 3.45Å; Y2711-F2733 AromaticContact CZ-CZ 3.93Å; Y2711-F2733 WeakPolarHBondContact OH-CE2 3.44Å; L2730-F2733 HydrophobicContact CD2-CB 4.35Å; F2733-W2735 HydrophobicContact CD1-CD2 4.24Å; F2733-W2735 AromaticContact CD1-CE3 3.71Å; F2733-W2735 HydrophobicContact CD1-CE3 3.71Å; F2733-W2735 AromaticContact CD1-CH2 3.46Å; F2733-W2735 HydrophobicContact CD1-CH2 3.46Å; F2733-W2735 VanDerWaalsContact CD1-CH2 3.46Å; F2733-W2735 AromaticContact CD1-CZ2 3.97Å; F2733-W2735 HydrophobicContact CD1-CZ2 3.97Å; F2733-W2735 AromaticContact CD1-CZ3 3.32Å; F2733-W2735 HydrophobicContact CD1-CZ3 3.32Å; F2733-W2735 AromaticContact CD1-NE1 3.82Å; F2733-W2735 AromaticContact CE1-CD1 3.73Å; F2733-W2735 AromaticContact CE1-CD2 3.75Å; F2733-W2735 HydrophobicContact CE1-CD2 3.75Å; F2733-W2735 AromaticContact CE1-CE2 3.46Å; F2733-W2735 VanDerWaalsContact CE1-CE2 3.45Å; F2733-W2735 AromaticContact CE1-CE3 3.82Å; F2733-W2735 HydrophobicContact CE1-CE3 4.2Å; F2733-W2735 AromaticContact CE1-CG 3.94Å; F2733-W2735 HydrophobicContact CE1-CG 4.04Å; F2733-W2735 AromaticContact CE1-CH2 3.54Å; F2733-W2735 HydrophobicContact CE1-CH2 4.14Å; F2733-W2735 AromaticContact CE1-CZ2 3.69Å; F2733-W2735 HydrophobicContact CE1-CZ2 3.69Å; F2733-W2735 AromaticContact CE1-CZ3 3.69Å; F2733-W2735 HydrophobicContact CE1-CZ3 4.08Å; F2733-W2735 AromaticContact CE1-NE1 3.49Å; F2733-W2735 HydrophobicContact CG-CZ3 4.36Å; F2733-W2735 AromaticContact CZ-CD2 3.93Å; F2733-W2735 HydrophobicContact CZ-CD2 3.93Å; F2733-W2735 AromaticContact CZ-CE2 3.99Å; F2733-W2735 HydrophobicContact CZ-CE3 4.06Å; F2733-W2735 HydrophobicContact CZ-CG 4.38Å; F2733-W2735 HydrophobicContact CZ-CH2 4.37Å; F2733-W2735 HydrophobicContact CZ-CZ2 4.25Å; F2733-W2735 HydrophobicContact CZ-CZ3 4.26Å; F2733-R2741 CarbonylContact O-C 3.53Å; F2733-R2741 VanDerWaalsContact O-CA 3.27Å; F2733-R2741 WeakPolarHBondContact O-CA 3.27Å; F2733-R2741 WeakPolarHBondContact O-CB 3.23Å; F2733-R2741 WeakPolarHBondContact O-CG 3.34Å; F2733-I2742 HydrophobicContact CB-CB 4.29Å; F2733-I2742 HydrophobicContact CB-CD1 4.41Å; F2733-I2742 HydrophobicContact CD1-CD1 4.07Å; F2733-I2742 HydrophobicContact CD1-CG1 4.37Å; F2733-I2742 PolarHBondContact N-O 3.13Å; F2733-I2742 PolarHBondContact O-N 3.15Å; F2733-W3317 HydrophobicContact CB-CE3 3.9Å; F2733-W3317 HydrophobicContact CB-CH2 4.47Å; F2733-W3317 HydrophobicContact CB-CZ3 3.71Å; F2733-W3317 HydrophobicContact CD1-CB 4.39Å; F2733-W3317 AromaticContact CD1-CD2 3.68Å; F2733-W3317 HydrophobicContact CD1-CD2 3.68Å; F2733-W3317 AromaticContact CD1-CE3 3.46Å; F2733-W3317 HydrophobicContact CD1-CE3 3.46Å; F2733-W3317 VanDerWaalsContact CD1-CE3 3.46Å; F2733-W3317 HydrophobicContact CD1-CG 4.08Å; F2733-W3317 HydrophobicContact CD1-CZ3 4.06Å; F2733-W3317 AromaticContact CD2-CE3 3.7Å; F2733-W3317 HydrophobicContact CD2-CE3 3.7Å; F2733-W3317 HydrophobicContact CD2-CZ3 4.3Å; F2733-W3317 HydrophobicContact CE1-CB 3.56Å; F2733-W3317 AromaticContact CE1-CD2 3.72Å; F2733-W3317 HydrophobicContact CE1-CD2 3.72Å; F2733-W3317 AromaticContact CE1-CE3 3.83Å; F2733-W3317 HydrophobicContact CE1-CE3 3.83Å; F2733-W3317 AromaticContact CE1-CG 3.6Å; F2733-W3317 HydrophobicContact CE1-CG 3.6Å; F2733-W3317 HydrophobicContact CE2-CB 4.01Å; F2733-W3317 HydrophobicContact CE2-CE3 4.07Å; F2733-W3317 HydrophobicContact CG-CD2 4.1Å; F2733-W3317 AromaticContact CG-CE3 3.38Å; F2733-W3317 HydrophobicContact CG-CE3 3.38Å; F2733-W3317 AromaticContact CG-CZ3 3.76Å; F2733-W3317 HydrophobicContact CG-CZ3 3.76Å; F2733-W3317 HydrophobicContact CZ-CB 3.36Å; F2733-W3317 HydrophobicContact CZ-CD2 4.23Å; F2733-W3317 HydrophobicContact CZ-CE3 4.15Å; F2733-W3317 AromaticContact CZ-CG 3.93Å; F2733-W3317 HydrophobicContact CZ-CG 3.93Å
2734	I	93.7	Very high	77.7	Confident	14.6 Å²	14.6	52.9 Å²	52.9	8%	0.075	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	131.4	-179.8	-45.8	173.3	0	0	0	108.8	W2709 I2710 R2732 N2738 R2741	W2709-I2734 CarbonylContact C-O 3.58Å; W2709-I2734 WeakPolarHBondContact CA-O 3.35Å; I2710-I2734 HydrophobicContact CB-CB 4.07Å; I2710-I2734 HydrophobicContact CB-CD1 4.34Å; I2710-I2734 HydrophobicContact CB-CG1 4.39Å; I2710-I2734 HydrophobicContact CD1-CB 4.26Å; I2710-I2734 HydrophobicContact CD1-CD1 4.3Å; I2710-I2734 HydrophobicContact CG1-CB 4.44Å; I2710-I2734 HydrophobicContact CG2-CD1 4.23Å; I2710-I2734 HydrophobicContact CG2-CG1 4.49Å; I2710-I2734 PolarHBondContact N-O 3.06Å; I2710-I2734 PolarHBondContact O-N 3.05Å; R2732-I2734 HydrophobicContact CG-CD1 4.34Å; R2732-I2734 HydrophobicContact CG-CG1 3.89Å; I2734-N2738 WeakPolarHBondContact CG2-OD1 3.39Å; I2734-R2741 HydrophobicContact CG1-CB 4.43Å; I2734-R2741 HydrophobicContact CG1-CG 4.22Å
2735	W	93.8	Very high	79.9	Confident	15.4 Å²	15.4	52.9 Å²	52.9	6%	0.058	26%	0.257	C	S	.	.			trans	-79.9	159.6	175.4	-71.6	100.2	0	0	0	112.1	W2709 F2733 S2737 N2738 R2740 I2742 Y2753 D3047 F3049 S3068 P3315 W3317	W2709-W2735 HydrophobicContact CD2-CE3 4.45Å; W2709-W2735 HydrophobicContact CD2-CZ3 4.18Å; W2709-W2735 AromaticContact CE2-CZ3 3.71Å; W2709-W2735 HydrophobicContact CE3-CB 4.48Å; W2709-W2735 HydrophobicContact CE3-CG 4.23Å; W2709-W2735 HydrophobicContact CE3-CZ3 4.45Å; W2709-W2735 AromaticContact CH2-CD1 3.11Å; W2709-W2735 HydrophobicContact CH2-CD2 4.43Å; W2709-W2735 HydrophobicContact CH2-CE3 4.15Å; W2709-W2735 AromaticContact CH2-CG 3.84Å; W2709-W2735 HydrophobicContact CH2-CG 3.84Å; W2709-W2735 AromaticContact CH2-CH2 3.97Å; W2709-W2735 HydrophobicContact CH2-CH2 3.97Å; W2709-W2735 AromaticContact CH2-CZ3 3.35Å; W2709-W2735 HydrophobicContact CH2-CZ3 3.91Å; W2709-W2735 AromaticContact CH2-NE1 3.32Å; W2709-W2735 VanDerWaalsContact CH2-NE1 3.32Å; W2709-W2735 AromaticContact CZ2-CE3 3.85Å; W2709-W2735 HydrophobicContact CZ2-CE3 4.24Å; W2709-W2735 HydrophobicContact CZ2-CH2 4.46Å; W2709-W2735 AromaticContact CZ2-CZ3 3.6Å; W2709-W2735 HydrophobicContact CZ2-CZ3 3.6Å; W2709-W2735 VanDerWaalsContact CZ2-CZ3 3.41Å; W2709-W2735 HydrophobicContact CZ3-CB 4.04Å; W2709-W2735 AromaticContact CZ3-CD1 3.15Å; W2709-W2735 AromaticContact CZ3-CD2 3.76Å; W2709-W2735 HydrophobicContact CZ3-CD2 3.76Å; W2709-W2735 AromaticContact CZ3-CE2 3.8Å; W2709-W2735 AromaticContact CZ3-CG 3.38Å; W2709-W2735 HydrophobicContact CZ3-CG 3.38Å; W2709-W2735 HydrophobicContact CZ3-CH2 4.33Å; W2709-W2735 AromaticContact CZ3-CZ3 3.96Å; W2709-W2735 HydrophobicContact CZ3-CZ3 4.28Å; W2709-W2735 AromaticContact CZ3-NE1 3.38Å; F2733-W2735 HydrophobicContact CD1-CD2 4.24Å; F2733-W2735 AromaticContact CD1-CE3 3.71Å; F2733-W2735 HydrophobicContact CD1-CE3 3.71Å; F2733-W2735 AromaticContact CD1-CH2 3.46Å; F2733-W2735 HydrophobicContact CD1-CH2 3.46Å; F2733-W2735 VanDerWaalsContact CD1-CH2 3.46Å; F2733-W2735 AromaticContact CD1-CZ2 3.97Å; F2733-W2735 HydrophobicContact CD1-CZ2 3.97Å; F2733-W2735 AromaticContact CD1-CZ3 3.32Å; F2733-W2735 HydrophobicContact CD1-CZ3 3.32Å; F2733-W2735 AromaticContact CD1-NE1 3.82Å; F2733-W2735 AromaticContact CE1-CD1 3.73Å; F2733-W2735 AromaticContact CE1-CD2 3.75Å; F2733-W2735 HydrophobicContact CE1-CD2 3.75Å; F2733-W2735 AromaticContact CE1-CE2 3.46Å; F2733-W2735 VanDerWaalsContact CE1-CE2 3.45Å; F2733-W2735 AromaticContact CE1-CE3 3.82Å; F2733-W2735 HydrophobicContact CE1-CE3 4.2Å; F2733-W2735 AromaticContact CE1-CG 3.94Å; F2733-W2735 HydrophobicContact CE1-CG 4.04Å; F2733-W2735 AromaticContact CE1-CH2 3.54Å; F2733-W2735 HydrophobicContact CE1-CH2 4.14Å; F2733-W2735 AromaticContact CE1-CZ2 3.69Å; F2733-W2735 HydrophobicContact CE1-CZ2 3.69Å; F2733-W2735 AromaticContact CE1-CZ3 3.69Å; F2733-W2735 HydrophobicContact CE1-CZ3 4.08Å; F2733-W2735 AromaticContact CE1-NE1 3.49Å; F2733-W2735 HydrophobicContact CG-CZ3 4.36Å; F2733-W2735 AromaticContact CZ-CD2 3.93Å; F2733-W2735 HydrophobicContact CZ-CD2 3.93Å; F2733-W2735 AromaticContact CZ-CE2 3.99Å; F2733-W2735 HydrophobicContact CZ-CE3 4.06Å; F2733-W2735 HydrophobicContact CZ-CG 4.38Å; F2733-W2735 HydrophobicContact CZ-CH2 4.37Å; F2733-W2735 HydrophobicContact CZ-CZ2 4.25Å; F2733-W2735 HydrophobicContact CZ-CZ3 4.26Å; W2735-S2737 VanDerWaalsContact C-N 3.26Å; W2735-S2737 PolarHBondContact O-N 3.16Å; W2735-S2737 VanDerWaalsContact O-N 3.13Å; W2735-N2738 WeakPolarHBondContact O-CA 3.43Å; W2735-N2738 PolarHBondContact O-N 3.09Å; W2735-R2740 HydrophobicContact CB-CB 4Å; W2735-R2740 HydrophobicContact CD2-CB 3.66Å; W2735-R2740 VanDerWaalsContact CE3-C 3.48Å; W2735-R2740 HydrophobicContact CE3-CB 3.58Å; W2735-R2740 VanDerWaalsContact CE3-O 3.25Å; W2735-R2740 HydrophobicContact CG-CB 3.79Å; W2735-R2740 HydrophobicContact CZ3-CB 4.21Å; W2735-R2740 PolarHBondContact N-O 3.21Å; W2735-R2740 VanDerWaalsContact N-O 3.13Å; W2735-I2742 HydrophobicContact CH2-CD1 3.62Å; W2735-I2742 HydrophobicContact CH2-CG1 3.87Å; W2735-I2742 HydrophobicContact CZ3-CD1 4.1Å; W2735-I2742 HydrophobicContact CZ3-CG1 3.87Å; W2735-Y2753 AromaticContact CH2-CE2 3.74Å; W2735-Y2753 HydrophobicContact CH2-CE2 3.74Å; W2735-Y2753 HydrophobicContact CZ2-CE2 4.4Å; W2735-Y2753 HydrophobicContact CZ3-CE2 4.4Å; W2735-D3047 HydrophobicContact CB-CB 4.39Å; W2735-D3047 WeakPolarHBondContact CB-OD1 3.33Å; W2735-D3047 HydrophobicContact CD2-CB 4.37Å; W2735-D3047 HydrophobicContact CE3-CB 4.09Å; W2735-F3049 AromaticContact CD2-CE2 3.94Å; W2735-F3049 HydrophobicContact CD2-CE2 3.94Å; W2735-F3049 HydrophobicContact CD2-CZ 4.34Å; W2735-F3049 AromaticContact CE2-CE2 3.75Å; W2735-F3049 AromaticContact CE2-CZ 3.68Å; W2735-F3049 AromaticContact CE3-CE2 3.98Å; W2735-F3049 HydrophobicContact CE3-CE2 4Å; W2735-F3049 AromaticContact CH2-CE2 3.76Å; W2735-F3049 HydrophobicContact CH2-CE2 3.76Å; W2735-F3049 AromaticContact CH2-CZ 3.88Å; W2735-F3049 HydrophobicContact CH2-CZ 3.88Å; W2735-F3049 AromaticContact CZ2-CE2 3.67Å; W2735-F3049 HydrophobicContact CZ2-CE2 3.67Å; W2735-F3049 AromaticContact CZ2-CZ 3.43Å; W2735-F3049 HydrophobicContact CZ2-CZ 3.43Å; W2735-F3049 VanDerWaalsContact CZ2-CZ 3.43Å; W2735-F3049 AromaticContact CZ3-CE2 3.94Å; W2735-F3049 HydrophobicContact CZ3-CE2 3.94Å; W2735-F3049 HydrophobicContact CZ3-CZ 4.47Å; W2735-S3068 PolarHBondContact NE1-O 2.99Å; W2735-P3315 HydrophobicContact CH2-CB 3.82Å; W2735-P3315 HydrophobicContact CH2-CG 3.65Å; W2735-P3315 HydrophobicContact CZ3-CB 3.85Å; W2735-P3315 HydrophobicContact CZ3-CG 3.52Å; W2735-W3317 HydrophobicContact CH2-CB 3.72Å; W2735-W3317 HydrophobicContact CH2-CG 4.26Å; W2735-W3317 HydrophobicContact CZ2-CB 3.92Å; W2735-W3317 AromaticContact CZ2-CD1 3.77Å; W2735-W3317 AromaticContact CZ2-CG 3.99Å; W2735-W3317 HydrophobicContact CZ2-CG 3.99Å; W2735-W3317 HydrophobicContact CZ3-CB 4.4Å
2736	P	90.9	Very high	81.6	Confident	2.8 Å²	2.8	50.5 Å²	50.5	2%	0.018	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.1	-40.1	178.4	-34.4	38.7	0	0	0	115.5	P2701 S2705 P2706 G2707 W2709 N2738 D3047	P2701-P2736 HydrophobicContact CG-CG 4.07Å; S2705-P2736 WeakPolarHBondContact OG-CB 3.43Å; P2706-P2736 CarbonylContact C-O 3.55Å; P2706-P2736 HydrophobicContact CG-CB 4.01Å; G2707-P2736 WeakPolarHBondContact CA-O 3.28Å; G2707-P2736 PolarHBondContact N-O 3.04Å; G2707-P2736 WeakPolarHBondContact O-CA 3.25Å; G2707-P2736 VanDerWaalsContact O-CB 3.28Å; G2707-P2736 WeakPolarHBondContact O-CB 3.18Å; G2707-P2736 WeakPolarHBondContact O-CG 3.29Å; W2709-P2736 VanDerWaalsContact CD2-CD 3.41Å; W2709-P2736 HydrophobicContact CD2-CG 3.84Å; W2709-P2736 VanDerWaalsContact CE2-CD 3.45Å; W2709-P2736 HydrophobicContact CG-CG 4.11Å; W2709-P2736 HydrophobicContact CZ2-CG 4.21Å; W2709-P2736 VanDerWaalsContact NE1-CD 3.32Å; P2736-N2738 PolarHBondContact O-N 3.05Å; P2736-N2738 VanDerWaalsContact O-N 3.15Å; P2736-D3047 WeakPolarHBondContact CB-OD1 3.28Å; P2736-D3047 VanDerWaalsContact CD-OD1 3.27Å; P2736-D3047 WeakPolarHBondContact CD-OD1 3.25Å
2737	S	88.8	Confident	83.1	Confident	23 Å²	23	52.4 Å²	52.4	16%	0.161	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-13.4	-178.9	68.5	0	0	0	0	114.1	W2735 Y2739 E3046 D3047	W2735-S2737 VanDerWaalsContact C-N 3.26Å; W2735-S2737 PolarHBondContact O-N 3.16Å; W2735-S2737 VanDerWaalsContact O-N 3.13Å; S2737-Y2739 VanDerWaalsContact CB-CD1 3.47Å; S2737-Y2739 WeakPolarHBondContact O-CD2 3.37Å; S2737-Y2739 PolarHBondContact O-N 2.99Å; S2737-Y2739 WeakPolarHBondContact OG-CD1 3.37Å; S2737-Y2739 WeakPolarHBondContact OG-CE1 3.38Å; S2737-Y2739 PolarHBondContact OG-N 3.05Å; S2737-E3046 WeakPolarHBondContact CB-OE1 3.4Å; S2737-D3047 WeakPolarHBondContact CB-OD1 3.3Å; S2737-D3047 VanDerWaalsContact CB-OD2 3.31Å; S2737-D3047 WeakPolarHBondContact CB-OD2 3.34Å; S2737-D3047 PolarHBondContact N-OD1 3.01Å; S2737-D3047 VanDerWaalsContact OG-CG 3.24Å; S2737-D3047 PolarHBondContact OG-OD1 3.35Å; S2737-D3047 VanDerWaalsContact OG-OD1 3.11Å; S2737-D3047 PolarHBondContact OG-OD2 3.09Å
2738	N	85.6	Confident	84.6	Confident	81.4 Å²	81.4	52 Å²	52	44%	0.435	24%	0.242	S	C	.	.	S	Bend	trans	60.1	-4.4	-172	-103.5	-18.1	0	0	0	115.9	I2734 W2735 P2736 L3536	I2734-N2738 WeakPolarHBondContact CG2-OD1 3.39Å; W2735-N2738 WeakPolarHBondContact O-CA 3.43Å; W2735-N2738 PolarHBondContact O-N 3.09Å; P2736-N2738 PolarHBondContact O-N 3.05Å; P2736-N2738 VanDerWaalsContact O-N 3.15Å; N2738-L3536 HydrophobicContact CB-CD1 3.98Å
2739	Y	85.6	Confident	85.8	Confident	142.4 Å²	142.4	51.7 Å²	51.7	56%	0.558	24%	0.236	S	C	*	.	S	Bend	trans	-83.4	-31.8	177	10	-89.1	0	0	0	112.8	S2737 E3046 N3657 H3751	S2737-Y2739 VanDerWaalsContact CB-CD1 3.47Å; S2737-Y2739 WeakPolarHBondContact O-CD2 3.37Å; S2737-Y2739 PolarHBondContact O-N 2.99Å; S2737-Y2739 WeakPolarHBondContact OG-CD1 3.37Å; S2737-Y2739 WeakPolarHBondContact OG-CE1 3.38Å; S2737-Y2739 PolarHBondContact OG-N 3.05Å; Y2739-E3046 WeakPolarHBondContact CE1-OE1 3.45Å; Y2739-N3657 HydrophobicContact CD2-CB 4.12Å; Y2739-N3657 WeakPolarHBondContact CD2-OD1 3.11Å; Y2739-N3657 HydrophobicContact CE2-CB 4.24Å; Y2739-N3657 WeakPolarHBondContact CE2-ND2 3.44Å; Y2739-N3657 VanDerWaalsContact CE2-OD1 3.25Å; Y2739-N3657 WeakPolarHBondContact CE2-OD1 3.49Å; Y2739-H3751 PolarHBondContact O-CE1 2.83Å; Y2739-H3751 PolarHBondContact O-NE2 2.87Å
2740	R	91.8	Very high	86.7	Confident	53.4 Å²	53.4	49.8 Å²	49.8	20%	0.202	23%	0.227	C	C	.	.			trans	-94.8	131	176.4	-64.5	-174.1	-176.7	118	-4.9	110.5	W2735 D2754 D3045 D3047 S3068	W2735-R2740 HydrophobicContact CB-CB 4Å; W2735-R2740 HydrophobicContact CD2-CB 3.66Å; W2735-R2740 VanDerWaalsContact CE3-C 3.48Å; W2735-R2740 HydrophobicContact CE3-CB 3.58Å; W2735-R2740 VanDerWaalsContact CE3-O 3.25Å; W2735-R2740 HydrophobicContact CG-CB 3.79Å; W2735-R2740 HydrophobicContact CZ3-CB 4.21Å; W2735-R2740 PolarHBondContact N-O 3.21Å; W2735-R2740 VanDerWaalsContact N-O 3.13Å; R2740-D2754 VanDerWaalsContact CA-OD1 3.28Å; R2740-D2754 WeakPolarHBondContact CA-OD1 3.46Å; R2740-D3045 IonicContact CZ-OD2 3.58Å; R2740-D3045 IonicContact NH1-OD1 3.5Å; R2740-D3045 IonicContact NH1-OD2 3.41Å; R2740-D3045 PolarHBondContact NH1-OD2 2.96Å; R2740-D3045 IonicContact NH2-OD2 2.94Å; R2740-D3045 PolarHBondContact NH2-OD2 3.06Å; R2740-D3047 IonicContact CZ-OD2 3.18Å; R2740-D3047 IonicContact NH1-OD2 3.38Å; R2740-D3047 PolarHBondContact NH1-OD2 3.07Å; R2740-S3068 VanDerWaalsContact CA-OG 3.29Å; R2740-S3068 WeakPolarHBondContact CA-OG 3.25Å; R2740-S3068 WeakPolarHBondContact CB-OG 3.39Å
2741	R	92.7	Very high	87.2	Confident	118.4 Å²	118.4	49.5 Å²	49.5	45%	0.447	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	148.1	179.5	81.3	-176.2	-161.3	-172.6	0.8	112.2	R2732 F2733 I2734 D2754 S3068 D3750 H3751	R2732-R2741 HydrophobicContact CG-CG 3.8Å; F2733-R2741 CarbonylContact O-C 3.53Å; F2733-R2741 VanDerWaalsContact O-CA 3.27Å; F2733-R2741 WeakPolarHBondContact O-CA 3.27Å; F2733-R2741 WeakPolarHBondContact O-CB 3.23Å; F2733-R2741 WeakPolarHBondContact O-CG 3.34Å; I2734-R2741 HydrophobicContact CG1-CB 4.43Å; I2734-R2741 HydrophobicContact CG1-CG 4.22Å; R2741-D2754 PolarHBondContact N-OD1 2.84Å; R2741-D2754 PolarHBondContact O-N 2.79Å; R2741-S3068 PolarHBondContact N-OG 3.05Å; R2741-S3068 VanDerWaalsContact N-OG 3.1Å; R2741-S3068 WeakPolarHBondContact O-CB 3.41Å; R2741-S3068 PolarHBondContact O-OG 3.11Å; R2741-D3750 IonicContact CZ-OD1 3.75Å; R2741-D3750 IonicContact NH1-OD1 3.14Å; R2741-D3750 PolarHBondContact NH1-OD1 3.28Å; R2741-D3750 IonicContact NH1-OD2 3.64Å; R2741-H3751 VanDerWaalsContact CB-CE1 3.48Å; R2741-H3751 WeakPolarHBondContact CB-CE1 3.37Å; R2741-H3751 WeakPolarHBondContact CB-NE2 3.26Å; R2741-H3751 PolarHBondContact NE-CD2 3.05Å; R2741-H3751 PolarHBondContact NH2-CD2 2.95Å
2742	I	93.3	Very high	87.5	Confident	12.8 Å²	12.8	50.2 Å²	50.2	7%	0.066	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	128.7	169.2	-54.8	168.2	0	0	0	107	R2732 F2733 W2735 I2744 V2751 I2752 Y2753 S3068 K3069 W3317	R2732-I2742 CarbonylContact C-O 3.52Å; R2732-I2742 VanDerWaalsContact CA-O 3.24Å; R2732-I2742 WeakPolarHBondContact CA-O 3.29Å; R2732-I2742 VanDerWaalsContact CG-O 3.3Å; R2732-I2742 WeakPolarHBondContact CG-O 3.29Å; F2733-I2742 HydrophobicContact CB-CB 4.29Å; F2733-I2742 HydrophobicContact CB-CD1 4.41Å; F2733-I2742 HydrophobicContact CD1-CD1 4.07Å; F2733-I2742 HydrophobicContact CD1-CG1 4.37Å; F2733-I2742 PolarHBondContact N-O 3.13Å; F2733-I2742 PolarHBondContact O-N 3.15Å; W2735-I2742 HydrophobicContact CH2-CD1 3.62Å; W2735-I2742 HydrophobicContact CH2-CG1 3.87Å; W2735-I2742 HydrophobicContact CZ3-CD1 4.1Å; W2735-I2742 HydrophobicContact CZ3-CG1 3.87Å; I2742-I2744 HydrophobicContact CG2-CD1 4.16Å; I2742-I2744 HydrophobicContact CG2-CG1 4.15Å; I2742-V2751 HydrophobicContact CG2-CG1 4.03Å; I2742-I2752 CarbonylContact C-O 3.47Å; I2742-I2752 VanDerWaalsContact CA-O 3.3Å; I2742-I2752 WeakPolarHBondContact CA-O 3.33Å; I2742-Y2753 HydrophobicContact CD1-CD2 3.7Å; I2742-Y2753 HydrophobicContact CD1-CE2 4.01Å; I2742-Y2753 HydrophobicContact CG1-CD2 3.38Å; I2742-Y2753 HydrophobicContact CG1-CE2 3.93Å; I2742-Y2753 HydrophobicContact CG1-CG 4.31Å; I2742-S3068 WeakPolarHBondContact CD1-O 3.17Å; I2742-K3069 HydrophobicContact CD1-CB 4.49Å; I2742-K3069 HydrophobicContact CD1-CG 3.85Å; I2742-K3069 HydrophobicContact CG1-CG 4.36Å; I2742-W3317 HydrophobicContact CD1-CD2 4.11Å; I2742-W3317 VanDerWaalsContact CD1-CE2 3.41Å; I2742-W3317 HydrophobicContact CD1-CE3 4.4Å; I2742-W3317 HydrophobicContact CD1-CH2 3.53Å; I2742-W3317 HydrophobicContact CD1-CZ2 3.16Å; I2742-W3317 HydrophobicContact CD1-CZ3 4.14Å
2743	S	91.8	Very high	87.6	Confident	15.8 Å²	15.8	48.1 Å²	48.1	11%	0.11	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	129.8	174.1	-61.2	0	0	0	0	109.4	L2731 V2751 I2752	L2731-S2743 CarbonylContact O-C 3.56Å; L2731-S2743 WeakPolarHBondContact O-CA 3.36Å; S2743-V2751 CarbonylContact O-C 3.54Å; S2743-V2751 WeakPolarHBondContact O-CA 3.31Å; S2743-I2752 PolarHBondContact N-O 3.05Å; S2743-I2752 PolarHBondContact O-N 3.12Å
2744	I	87.5	Confident	87.6	Confident	25 Å²	25	50.6 Å²	50.6	13%	0.128	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	133	-176.1	-55.3	173.8	0	0	0	107.7	L2730 L2731 I2742 P2746 V2751 L3402 R3747	L2730-I2744 HydrophobicContact CB-CD1 4.04Å; L2730-I2744 HydrophobicContact CD2-CD1 3.74Å; L2730-I2744 HydrophobicContact CG-CD1 3.91Å; L2730-I2744 HydrophobicContact CG-CG1 4.41Å; L2730-I2744 VanDerWaalsContact O-CB 3.28Å; L2730-I2744 WeakPolarHBondContact O-CB 3.34Å; L2730-I2744 VanDerWaalsContact O-CG2 3.31Å; L2730-I2744 WeakPolarHBondContact O-CG2 3.39Å; L2731-I2744 PolarHBondContact O-N 3.08Å; I2742-I2744 HydrophobicContact CG2-CD1 4.16Å; I2742-I2744 HydrophobicContact CG2-CG1 4.15Å; I2744-P2746 HydrophobicContact CG2-CG 4.22Å; I2744-P2746 WeakPolarHBondContact O-CD 3.38Å; I2744-V2751 HydrophobicContact CB-CG2 4.23Å; I2744-V2751 HydrophobicContact CD1-CG2 4.13Å; I2744-V2751 HydrophobicContact CG1-CG1 4.24Å; I2744-V2751 HydrophobicContact CG1-CG2 3.96Å; I2744-V2751 HydrophobicContact CG2-CG2 3.94Å; I2744-L3402 HydrophobicContact CD1-CD1 3.81Å; I2744-L3402 HydrophobicContact CD1-CD2 3.79Å; I2744-L3402 HydrophobicContact CD1-CG 4.41Å; I2744-R3747 PolarHBondContact O-NH1 3Å; I2744-R3747 PolarHBondContact O-NH2 3.2Å
2745	F	84.6	Confident	87.4	Confident	63 Å²	63	55.4 Å²	55.4	28%	0.276	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	81.5	-177.9	-60.1	-85.5	0	0	0	108.3	K2747 Q2748 N2749 F2750 I2752 F3729 A3744 R3747 L3748	F2745-K2747 VanDerWaalsContact C-N 3.32Å; F2745-K2747 PolarHBondContact O-N 3.05Å; F2745-Q2748 HydrophobicContact CB-CB 4.25Å; F2745-Q2748 HydrophobicContact CB-CG 4.5Å; F2745-Q2748 CarbonylContact O-C 3.48Å; F2745-Q2748 PolarHBondContact O-N 3.2Å; F2745-Q2748 VanDerWaalsContact O-N 3.13Å; F2745-N2749 PolarHBondContact O-N 3.15Å; F2745-N2749 VanDerWaalsContact O-N 3.08Å; F2745-F2750 CarbonylContact C-O 3.5Å; F2745-F2750 WeakPolarHBondContact CA-O 3.4Å; F2745-F2750 HydrophobicContact CB-CB 4.24Å; F2745-F2750 HydrophobicContact CB-CD1 4.13Å; F2745-F2750 HydrophobicContact CB-CD2 4.38Å; F2745-F2750 HydrophobicContact CB-CE1 3.43Å; F2745-F2750 VanDerWaalsContact CB-CE1 3.43Å; F2745-F2750 HydrophobicContact CB-CE2 4.1Å; F2745-F2750 HydrophobicContact CB-CG 4.22Å; F2745-F2750 HydrophobicContact CB-CZ 3.62Å; F2745-F2750 WeakPolarHBondContact CB-O 3.34Å; F2745-F2750 HydrophobicContact CD1-CE1 4.35Å; F2745-F2750 AromaticContact CD1-CZ 3.91Å; F2745-F2750 HydrophobicContact CD1-CZ 3.91Å; F2745-F2750 AromaticContact CD2-CD1 3.58Å; F2745-F2750 HydrophobicContact CD2-CD1 3.76Å; F2745-F2750 VanDerWaalsContact CD2-CD1 3.44Å; F2745-F2750 AromaticContact CD2-CD2 3.73Å; F2745-F2750 HydrophobicContact CD2-CD2 3.73Å; F2745-F2750 AromaticContact CD2-CE1 3.95Å; F2745-F2750 HydrophobicContact CD2-CE1 4.02Å; F2745-F2750 AromaticContact CD2-CE2 3.03Å; F2745-F2750 HydrophobicContact CD2-CE2 3.03Å; F2745-F2750 HydrophobicContact CD2-CG 4.36Å; F2745-F2750 AromaticContact CD2-CZ 3.15Å; F2745-F2750 HydrophobicContact CD2-CZ 3.15Å; F2745-F2750 HydrophobicContact CE1-CZ 4.34Å; F2745-F2750 HydrophobicContact CE2-CD1 4.23Å; F2745-F2750 HydrophobicContact CE2-CD2 4.41Å; F2745-F2750 HydrophobicContact CE2-CE1 4.26Å; F2745-F2750 AromaticContact CE2-CE2 3.44Å; F2745-F2750 HydrophobicContact CE2-CE2 3.44Å; F2745-F2750 VanDerWaalsContact CE2-CE2 3.44Å; F2745-F2750 AromaticContact CE2-CZ 3.65Å; F2745-F2750 HydrophobicContact CE2-CZ 3.65Å; F2745-F2750 HydrophobicContact CG-CD1 4.25Å; F2745-F2750 HydrophobicContact CG-CD2 4.38Å; F2745-F2750 AromaticContact CG-CE1 3.66Å; F2745-F2750 HydrophobicContact CG-CE1 3.66Å; F2745-F2750 AromaticContact CG-CE2 3.69Å; F2745-F2750 HydrophobicContact CG-CE2 3.69Å; F2745-F2750 AromaticContact CG-CZ 3.27Å; F2745-F2750 HydrophobicContact CG-CZ 3.27Å; F2745-F2750 HydrophobicContact CZ-CE2 4.37Å; F2745-F2750 HydrophobicContact CZ-CZ 4.21Å; F2745-F2750 PolarHBondContact N-O 3.14Å; F2745-F2750 PolarHBondContact O-N 2.94Å; F2745-F2750 VanDerWaalsContact O-N 3.11Å; F2745-I2752 HydrophobicContact CE2-CD1 4.12Å; F2745-I2752 HydrophobicContact CE2-CG1 4.26Å; F2745-I2752 HydrophobicContact CE2-CG2 3.8Å; F2745-F3729 HydrophobicContact CD1-CE2 4.19Å; F2745-F3729 HydrophobicContact CD1-CZ 4.41Å; F2745-F3729 HydrophobicContact CE1-CE2 4.42Å; F2745-F3729 HydrophobicContact CG-CE2 4.29Å; F2745-A3744 HydrophobicContact CD1-CB 3.72Å; F2745-A3744 HydrophobicContact CE1-CB 3.88Å; F2745-A3744 WeakPolarHBondContact CE1-O 3.43Å; F2745-R3747 HydrophobicContact CE1-CB 4.29Å; F2745-L3748 HydrophobicContact CE2-CD1 4.17Å; F2745-L3748 HydrophobicContact CZ-CB 4.16Å; F2745-L3748 HydrophobicContact CZ-CD1 4.04Å
2746	P	73.2	Confident	87.4	Confident	30 Å²	30	55.5 Å²	55.5	20%	0.195	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-60.7	-39.3	-171.2	-13	19.8	0	0	0	112.6	H2729 L2731 I2744 Q2748 N2749	H2729-P2746 HydrophobicContact CB-CB 4.14Å; H2729-P2746 HydrophobicContact CB-CG 3.49Å; H2729-P2746 VanDerWaalsContact CB-CG 3.45Å; L2731-P2746 HydrophobicContact CD2-CG 4.16Å; I2744-P2746 HydrophobicContact CG2-CG 4.22Å; I2744-P2746 WeakPolarHBondContact O-CD 3.38Å; P2746-Q2748 VanDerWaalsContact C-N 3.3Å; P2746-Q2748 PolarHBondContact O-N 3.09Å; P2746-N2749 PolarHBondContact O-N 3.03Å; P2746-N2749 VanDerWaalsContact O-N 3.12Å; P2746-N2749 PolarHBondContact O-OD1 3.16Å
2747	K	73.6	Confident	87.5	Confident	148.6 Å²	148.6	56.5 Å²	56.5	65%	0.646	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-63.8	-32.7	179.1	-69.6	-173.8	177.4	179.8	0	113	D2716 G2718 S2719 F2745 N2749	D2716-K2747 HydrophobicContact CB-CD 3.92Å; D2716-K2747 HydrophobicContact CB-CG 4.28Å; D2716-K2747 WeakPolarHBondContact O-CE 3.26Å; D2716-K2747 PolarHBondContact O-NZ 3.3Å; G2718-K2747 PolarHBondContact O-NZ 2.96Å; G2718-K2747 VanDerWaalsContact O-NZ 3.14Å; S2719-K2747 PolarHBondContact OG-NZ 2.82Å; F2745-K2747 VanDerWaalsContact C-N 3.32Å; F2745-K2747 PolarHBondContact O-N 3.05Å; K2747-N2749 VanDerWaalsContact C-N 3.31Å
2748	Q	78.2	Confident	87.7	Confident	91.6 Å²	91.6	55.6 Å²	55.6	43%	0.428	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-94	2.2	179.3	-63.9	96.8	2.2	0	0	112.3	F2745 P2746 F2750 F3729 D3741	F2745-Q2748 HydrophobicContact CB-CB 4.25Å; F2745-Q2748 HydrophobicContact CB-CG 4.5Å; F2745-Q2748 CarbonylContact O-C 3.48Å; F2745-Q2748 PolarHBondContact O-N 3.2Å; F2745-Q2748 VanDerWaalsContact O-N 3.13Å; P2746-Q2748 VanDerWaalsContact C-N 3.3Å; P2746-Q2748 PolarHBondContact O-N 3.09Å; Q2748-F2750 VanDerWaalsContact C-N 3.32Å; Q2748-F2750 HydrophobicContact CB-CB 4.11Å; Q2748-F2750 HydrophobicContact CB-CD1 3.34Å; Q2748-F2750 HydrophobicContact CB-CE1 3.43Å; Q2748-F2750 VanDerWaalsContact CB-CE1 3.43Å; Q2748-F2750 HydrophobicContact CG-CD1 4.38Å; Q2748-F2750 HydrophobicContact CG-CE1 4Å; Q2748-F2750 PolarHBondContact O-N 3.03Å; Q2748-F3729 HydrophobicContact CB-CZ 4.48Å; Q2748-F3729 HydrophobicContact CG-CE1 4.33Å; Q2748-F3729 HydrophobicContact CG-CE2 4.49Å; Q2748-F3729 HydrophobicContact CG-CZ 3.71Å; Q2748-D3741 PolarHBondContact NE2-OD1 2.77Å
2749	N	80.9	Confident	87.9	Confident	43.8 Å²	43.8	57.4 Å²	57.4	23%	0.234	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.2	53.1	-174.7	-68.3	-35	0	0	0	111.9	F2745 P2746 K2747 R2759 W2760 I2769	F2745-N2749 PolarHBondContact O-N 3.15Å; F2745-N2749 VanDerWaalsContact O-N 3.08Å; P2746-N2749 PolarHBondContact O-N 3.03Å; P2746-N2749 VanDerWaalsContact O-N 3.12Å; P2746-N2749 PolarHBondContact O-OD1 3.16Å; K2747-N2749 VanDerWaalsContact C-N 3.31Å; N2749-R2759 CarbonylContact O-C 3.43Å; N2749-R2759 WeakPolarHBondContact O-CA 3.29Å; N2749-W2760 VanDerWaalsContact C-CE3 3.49Å; N2749-W2760 VanDerWaalsContact C-CH2 3.45Å; N2749-W2760 VanDerWaalsContact C-CZ3 3.47Å; N2749-W2760 VanDerWaalsContact CA-CZ2 3.46Å; N2749-W2760 HydrophobicContact CB-CB 4.19Å; N2749-W2760 HydrophobicContact CB-CD2 3.76Å; N2749-W2760 VanDerWaalsContact CB-CE2 3.45Å; N2749-W2760 HydrophobicContact CB-CE3 4.37Å; N2749-W2760 HydrophobicContact CB-CG 3.91Å; N2749-W2760 HydrophobicContact CB-CH2 4.44Å; N2749-W2760 HydrophobicContact CB-CZ2 3.91Å; N2749-W2760 WeakPolarHBondContact CB-O 3.31Å; N2749-W2760 VanDerWaalsContact CG-NE1 3.31Å; N2749-W2760 WeakPolarHBondContact O-CZ3 3.35Å; N2749-W2760 PolarHBondContact O-N 3.06Å; N2749-W2760 PolarHBondContact OD1-NE1 3.26Å; N2749-I2769 VanDerWaalsContact ND2-CD1 3.32Å; N2749-I2769 WeakPolarHBondContact ND2-CD1 3.4Å
2750	F	85.4	Confident	88.1	Confident	32 Å²	32	51.9 Å²	51.9	14%	0.14	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	141.9	-170.6	165.3	-112.4	0	0	0	112.6	F2745 Q2748 I2752 S2757 V2758 R2759 I3727 F3729	F2745-F2750 CarbonylContact C-O 3.5Å; F2745-F2750 WeakPolarHBondContact CA-O 3.4Å; F2745-F2750 HydrophobicContact CB-CB 4.24Å; F2745-F2750 HydrophobicContact CB-CD1 4.13Å; F2745-F2750 HydrophobicContact CB-CD2 4.38Å; F2745-F2750 HydrophobicContact CB-CE1 3.43Å; F2745-F2750 VanDerWaalsContact CB-CE1 3.43Å; F2745-F2750 HydrophobicContact CB-CE2 4.1Å; F2745-F2750 HydrophobicContact CB-CG 4.22Å; F2745-F2750 HydrophobicContact CB-CZ 3.62Å; F2745-F2750 WeakPolarHBondContact CB-O 3.34Å; F2745-F2750 HydrophobicContact CD1-CE1 4.35Å; F2745-F2750 AromaticContact CD1-CZ 3.91Å; F2745-F2750 HydrophobicContact CD1-CZ 3.91Å; F2745-F2750 AromaticContact CD2-CD1 3.58Å; F2745-F2750 HydrophobicContact CD2-CD1 3.76Å; F2745-F2750 VanDerWaalsContact CD2-CD1 3.44Å; F2745-F2750 AromaticContact CD2-CD2 3.73Å; F2745-F2750 HydrophobicContact CD2-CD2 3.73Å; F2745-F2750 AromaticContact CD2-CE1 3.95Å; F2745-F2750 HydrophobicContact CD2-CE1 4.02Å; F2745-F2750 AromaticContact CD2-CE2 3.03Å; F2745-F2750 HydrophobicContact CD2-CE2 3.03Å; F2745-F2750 HydrophobicContact CD2-CG 4.36Å; F2745-F2750 AromaticContact CD2-CZ 3.15Å; F2745-F2750 HydrophobicContact CD2-CZ 3.15Å; F2745-F2750 HydrophobicContact CE1-CZ 4.34Å; F2745-F2750 HydrophobicContact CE2-CD1 4.23Å; F2745-F2750 HydrophobicContact CE2-CD2 4.41Å; F2745-F2750 HydrophobicContact CE2-CE1 4.26Å; F2745-F2750 AromaticContact CE2-CE2 3.44Å; F2745-F2750 HydrophobicContact CE2-CE2 3.44Å; F2745-F2750 VanDerWaalsContact CE2-CE2 3.44Å; F2745-F2750 AromaticContact CE2-CZ 3.65Å; F2745-F2750 HydrophobicContact CE2-CZ 3.65Å; F2745-F2750 HydrophobicContact CG-CD1 4.25Å; F2745-F2750 HydrophobicContact CG-CD2 4.38Å; F2745-F2750 AromaticContact CG-CE1 3.66Å; F2745-F2750 HydrophobicContact CG-CE1 3.66Å; F2745-F2750 AromaticContact CG-CE2 3.69Å; F2745-F2750 HydrophobicContact CG-CE2 3.69Å; F2745-F2750 AromaticContact CG-CZ 3.27Å; F2745-F2750 HydrophobicContact CG-CZ 3.27Å; F2745-F2750 HydrophobicContact CZ-CE2 4.37Å; F2745-F2750 HydrophobicContact CZ-CZ 4.21Å; F2745-F2750 PolarHBondContact N-O 3.14Å; F2745-F2750 PolarHBondContact O-N 2.94Å; F2745-F2750 VanDerWaalsContact O-N 3.11Å; Q2748-F2750 VanDerWaalsContact C-N 3.32Å; Q2748-F2750 HydrophobicContact CB-CB 4.11Å; Q2748-F2750 HydrophobicContact CB-CD1 3.34Å; Q2748-F2750 HydrophobicContact CB-CE1 3.43Å; Q2748-F2750 VanDerWaalsContact CB-CE1 3.43Å; Q2748-F2750 HydrophobicContact CG-CD1 4.38Å; Q2748-F2750 HydrophobicContact CG-CE1 4Å; Q2748-F2750 PolarHBondContact O-N 3.03Å; F2750-I2752 HydrophobicContact CD1-CD1 3.98Å; F2750-I2752 HydrophobicContact CD1-CG1 4.23Å; F2750-I2752 HydrophobicContact CD2-CD1 4.03Å; F2750-I2752 HydrophobicContact CD2-CG1 3.75Å; F2750-I2752 HydrophobicContact CE1-CB 4.05Å; F2750-I2752 HydrophobicContact CE1-CD1 3.35Å; F2750-I2752 HydrophobicContact CE1-CG1 3.42Å; F2750-I2752 VanDerWaalsContact CE1-CG1 3.47Å; F2750-I2752 HydrophobicContact CE1-CG2 4.33Å; F2750-I2752 HydrophobicContact CE2-CD1 3.44Å; F2750-I2752 VanDerWaalsContact CE2-CD1 3.44Å; F2750-I2752 HydrophobicContact CE2-CG1 4.13Å; F2750-I2752 HydrophobicContact CZ-CB 4.17Å; F2750-I2752 HydrophobicContact CZ-CD1 3.95Å; F2750-I2752 VanDerWaalsContact CZ-CD1 3.41Å; F2750-I2752 HydrophobicContact CZ-CG1 3.45Å; F2750-S2757 VanDerWaalsContact CE2-CB 3.42Å; F2750-V2758 CarbonylContact C-O 3.54Å; F2750-V2758 VanDerWaalsContact CA-O 3.24Å; F2750-V2758 WeakPolarHBondContact CA-O 3.32Å; F2750-V2758 VanDerWaalsContact CB-O 3.27Å; F2750-V2758 WeakPolarHBondContact CB-O 3.36Å; F2750-V2758 WeakPolarHBondContact CD2-O 3.26Å; F2750-R2759 HydrophobicContact CB-CB 4.29Å; F2750-R2759 HydrophobicContact CB-CG 4.41Å; F2750-R2759 HydrophobicContact CD2-CB 4.09Å; F2750-R2759 HydrophobicContact CD2-CG 4.14Å; F2750-R2759 HydrophobicContact CE2-CB 4.36Å; F2750-R2759 HydrophobicContact CE2-CG 3.73Å; F2750-R2759 HydrophobicContact CG-CG 4.22Å; F2750-I3727 HydrophobicContact CE1-CG2 4.48Å; F2750-I3727 HydrophobicContact CZ-CD1 4.43Å; F2750-I3727 HydrophobicContact CZ-CG2 4.1Å; F2750-F3729 HydrophobicContact CD1-CE2 4.43Å
2751	V	90	Very high	87.6	Confident	14 Å²	14	52 Å²	52	9%	0.085	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	139	176.8	174.9	0	0	0	0	109	I2742 S2743 I2744 Y2753 S2757 V2758 W2760	I2742-V2751 HydrophobicContact CG2-CG1 4.03Å; S2743-V2751 CarbonylContact O-C 3.54Å; S2743-V2751 WeakPolarHBondContact O-CA 3.31Å; I2744-V2751 HydrophobicContact CB-CG2 4.23Å; I2744-V2751 HydrophobicContact CD1-CG2 4.13Å; I2744-V2751 HydrophobicContact CG1-CG1 4.24Å; I2744-V2751 HydrophobicContact CG1-CG2 3.96Å; I2744-V2751 HydrophobicContact CG2-CG2 3.94Å; V2751-Y2753 HydrophobicContact CG1-CD1 4.18Å; V2751-S2757 CarbonylContact O-C 3.53Å; V2751-S2757 VanDerWaalsContact O-CA 3.27Å; V2751-S2757 WeakPolarHBondContact O-CA 3.35Å; V2751-V2758 HydrophobicContact CB-CB 4.48Å; V2751-V2758 PolarHBondContact N-O 2.87Å; V2751-V2758 PolarHBondContact O-N 3.08Å; V2751-W2760 HydrophobicContact CB-CH2 3.93Å; V2751-W2760 HydrophobicContact CB-CZ3 3.96Å; V2751-W2760 HydrophobicContact CG2-CH2 3.86Å; V2751-W2760 HydrophobicContact CG2-CZ3 3.76Å
2752	I	92.5	Very high	86.5	Confident	49 Å²	49	48 Å²	48	25%	0.251	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	132.9	172.7	-74.3	175	0	0	0	109.5	I2742 S2743 F2745 F2750 T2756 I3727 L3748 M3754	I2742-I2752 CarbonylContact C-O 3.47Å; I2742-I2752 VanDerWaalsContact CA-O 3.3Å; I2742-I2752 WeakPolarHBondContact CA-O 3.33Å; S2743-I2752 PolarHBondContact N-O 3.05Å; S2743-I2752 PolarHBondContact O-N 3.12Å; F2745-I2752 HydrophobicContact CE2-CD1 4.12Å; F2745-I2752 HydrophobicContact CE2-CG1 4.26Å; F2745-I2752 HydrophobicContact CE2-CG2 3.8Å; F2750-I2752 HydrophobicContact CD1-CD1 3.98Å; F2750-I2752 HydrophobicContact CD1-CG1 4.23Å; F2750-I2752 HydrophobicContact CD2-CD1 4.03Å; F2750-I2752 HydrophobicContact CD2-CG1 3.75Å; F2750-I2752 HydrophobicContact CE1-CB 4.05Å; F2750-I2752 HydrophobicContact CE1-CD1 3.35Å; F2750-I2752 HydrophobicContact CE1-CG1 3.42Å; F2750-I2752 VanDerWaalsContact CE1-CG1 3.47Å; F2750-I2752 HydrophobicContact CE1-CG2 4.33Å; F2750-I2752 HydrophobicContact CE2-CD1 3.44Å; F2750-I2752 VanDerWaalsContact CE2-CD1 3.44Å; F2750-I2752 HydrophobicContact CE2-CG1 4.13Å; F2750-I2752 HydrophobicContact CZ-CB 4.17Å; F2750-I2752 HydrophobicContact CZ-CD1 3.95Å; F2750-I2752 VanDerWaalsContact CZ-CD1 3.41Å; F2750-I2752 HydrophobicContact CZ-CG1 3.45Å; I2752-T2756 CarbonylContact C-O 3.54Å; I2752-T2756 WeakPolarHBondContact CA-O 3.28Å; I2752-T2756 WeakPolarHBondContact CG1-O 3.19Å; I2752-I3727 HydrophobicContact CD1-CD1 3.69Å; I2752-I3727 HydrophobicContact CG1-CD1 3.95Å; I2752-I3727 HydrophobicContact CG2-CD1 4.32Å; I2752-L3748 HydrophobicContact CD1-CD1 3.25Å; I2752-M3754 HydrophobicContact CD1-CE 4.16Å; I2752-M3754 HydrophobicContact CD1-SD 4.24Å; I2752-M3754 HydrophobicContact CG2-SD 3.71Å
2753	Y	93.4	Very high	85.3	Confident	22.4 Å²	22.4	52.4 Å²	52.4	9%	0.088	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	131.6	167.8	71.6	-85.7	0	0	0	108.3	W2735 I2742 V2751 K2755 T2756 V2758 N3067 K3069	W2735-Y2753 AromaticContact CH2-CE2 3.74Å; W2735-Y2753 HydrophobicContact CH2-CE2 3.74Å; W2735-Y2753 HydrophobicContact CZ2-CE2 4.4Å; W2735-Y2753 HydrophobicContact CZ3-CE2 4.4Å; I2742-Y2753 HydrophobicContact CD1-CD2 3.7Å; I2742-Y2753 HydrophobicContact CD1-CE2 4.01Å; I2742-Y2753 HydrophobicContact CG1-CD2 3.38Å; I2742-Y2753 HydrophobicContact CG1-CE2 3.93Å; I2742-Y2753 HydrophobicContact CG1-CG 4.31Å; V2751-Y2753 HydrophobicContact CG1-CD1 4.18Å; Y2753-K2755 PolarHBondContact O-N 3.06Å; Y2753-K2755 VanDerWaalsContact O-N 3.07Å; Y2753-T2756 HydrophobicContact CE1-CG2 4.04Å; Y2753-T2756 HydrophobicContact CE2-CG2 4.01Å; Y2753-T2756 PolarHBondContact N-O 3.02Å; Y2753-T2756 WeakPolarHBondContact O-CA 3.42Å; Y2753-T2756 PolarHBondContact O-N 3.08Å; Y2753-T2756 VanDerWaalsContact O-O 3.06Å; Y2753-T2756 WeakPolarHBondContact OH-CG2 3.36Å; Y2753-V2758 HydrophobicContact CE1-CG2 4.22Å; Y2753-N3067 HydrophobicContact CD2-CB 4.33Å; Y2753-N3067 HydrophobicContact CE2-CB 4.26Å; Y2753-K3069 HydrophobicContact CD1-CD 4.23Å; Y2753-K3069 HydrophobicContact CD1-CG 4.26Å; Y2753-K3069 HydrophobicContact CD2-CG 4.23Å; Y2753-K3069 HydrophobicContact CE1-CD 3.91Å; Y2753-K3069 VanDerWaalsContact CE1-CE 3.47Å; Y2753-K3069 HydrophobicContact CE1-CG 4.39Å; Y2753-K3069 HydrophobicContact CE2-CD 4.3Å; Y2753-K3069 HydrophobicContact CE2-CG 4.34Å; Y2753-K3069 HydrophobicContact CG-CD 4.42Å; Y2753-K3069 HydrophobicContact CG-CG 4.18Å
2754	D	91.4	Very high	83.6	Confident	62.6 Å²	62.6	54.7 Å²	54.7	34%	0.335	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.2	-109.1	-172.9	-50.7	-46.2	0	0	0	112.7	R2740 R2741 N3067 S3068 S3753	R2740-D2754 VanDerWaalsContact CA-OD1 3.28Å; R2740-D2754 WeakPolarHBondContact CA-OD1 3.46Å; R2741-D2754 PolarHBondContact N-OD1 2.84Å; R2741-D2754 PolarHBondContact O-N 2.79Å; D2754-N3067 VanDerWaalsContact OD2-CA 3.28Å; D2754-N3067 WeakPolarHBondContact OD2-CA 3.29Å; D2754-N3067 VanDerWaalsContact OD2-CB 3.29Å; D2754-N3067 WeakPolarHBondContact OD2-CB 3.45Å; D2754-S3068 WeakPolarHBondContact OD1-CB 3.33Å; D2754-S3068 PolarHBondContact OD1-OG 2.73Å; D2754-S3068 WeakPolarHBondContact OD2-CB 3.27Å; D2754-S3068 PolarHBondContact OD2-N 3.13Å; D2754-S3753 VanDerWaalsContact O-CB 3.31Å; D2754-S3753 WeakPolarHBondContact O-CB 3.26Å; D2754-S3753 PolarHBondContact O-OG 2.76Å
2755	K	90.7	Very high	82.1	Confident	115.4 Å²	115.4	56.6 Å²	56.6	50%	0.502	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.3	8	177.7	-72.3	-174.1	-178.4	178	0	112.8	Y2753 T2782 A2783 N3701	Y2753-K2755 PolarHBondContact O-N 3.06Å; Y2753-K2755 VanDerWaalsContact O-N 3.07Å; K2755-T2782 WeakPolarHBondContact CB-OG1 3.38Å; K2755-T2782 WeakPolarHBondContact O-CB 3.05Å; K2755-T2782 PolarHBondContact O-N 3.3Å; K2755-T2782 PolarHBondContact O-OG1 3.12Å; K2755-A2783 HydrophobicContact CB-CB 4.12Å; K2755-A2783 HydrophobicContact CD-CB 3.81Å; K2755-A2783 HydrophobicContact CG-CB 4.49Å; K2755-N3701 VanDerWaalsContact CE-OD1 3.27Å; K2755-N3701 WeakPolarHBondContact CE-OD1 3.5Å; K2755-N3701 PolarHBondContact NZ-OD1 2.9Å
2756	T	93.5	Very high	80.5	Confident	18 Å²	18	62.1 Å²	62.1	11%	0.11	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	130.9	-178.9	-54.8	0	0	0	0	110.3	I2752 Y2753 L2779 T2780 D2781	I2752-T2756 CarbonylContact C-O 3.54Å; I2752-T2756 WeakPolarHBondContact CA-O 3.28Å; I2752-T2756 WeakPolarHBondContact CG1-O 3.19Å; Y2753-T2756 HydrophobicContact CE1-CG2 4.04Å; Y2753-T2756 HydrophobicContact CE2-CG2 4.01Å; Y2753-T2756 PolarHBondContact N-O 3.02Å; Y2753-T2756 WeakPolarHBondContact O-CA 3.42Å; Y2753-T2756 PolarHBondContact O-N 3.08Å; Y2753-T2756 VanDerWaalsContact O-O 3.06Å; Y2753-T2756 WeakPolarHBondContact OH-CG2 3.36Å; T2756-L2779 HydrophobicContact CG2-CD1 4.23Å; T2756-L2779 HydrophobicContact CG2-CD2 4.11Å; T2756-L2779 HydrophobicContact CG2-CG 3.94Å; T2756-T2780 CarbonylContact C-O 3.55Å; T2756-T2780 VanDerWaalsContact CA-O 3.29Å; T2756-T2780 WeakPolarHBondContact CA-O 3.36Å; T2756-D2781 HydrophobicContact CG2-CB 4.3Å
2757	S	93.7	Very high	79.5	Confident	23.2 Å²	23.2	65 Å²	65	16%	0.162	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	138.9	175.8	73.8	0	0	0	0	110.6	F2750 V2751 L2779 T2780	F2750-S2757 VanDerWaalsContact CE2-CB 3.42Å; V2751-S2757 CarbonylContact O-C 3.53Å; V2751-S2757 VanDerWaalsContact O-CA 3.27Å; V2751-S2757 WeakPolarHBondContact O-CA 3.35Å; S2757-L2779 CarbonylContact O-C 3.55Å; S2757-L2779 VanDerWaalsContact O-CA 3.32Å; S2757-L2779 WeakPolarHBondContact O-CA 3.27Å; S2757-T2780 PolarHBondContact N-O 3.17Å; S2757-T2780 PolarHBondContact O-N 3.05Å; S2757-T2780 PolarHBondContact OG-O 2.91Å; S2757-T2780 PolarHBondContact OG-OG1 3.02Å
2758	V	92.6	Very high	78.3	Confident	5 Å²	5	62.3 Å²	62.3	3%	0.03	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	123.2	177.6	-170	0	0	0	0	108.6	F2750 V2751 Y2753 W2760 I2771 V2777 Q2778 L2779	F2750-V2758 CarbonylContact C-O 3.54Å; F2750-V2758 VanDerWaalsContact CA-O 3.24Å; F2750-V2758 WeakPolarHBondContact CA-O 3.32Å; F2750-V2758 VanDerWaalsContact CB-O 3.27Å; F2750-V2758 WeakPolarHBondContact CB-O 3.36Å; F2750-V2758 WeakPolarHBondContact CD2-O 3.26Å; V2751-V2758 HydrophobicContact CB-CB 4.48Å; V2751-V2758 PolarHBondContact N-O 2.87Å; V2751-V2758 PolarHBondContact O-N 3.08Å; Y2753-V2758 HydrophobicContact CE1-CG2 4.22Å; V2758-W2760 HydrophobicContact CB-CH2 3.73Å; V2758-W2760 HydrophobicContact CB-CZ2 4.13Å; V2758-W2760 HydrophobicContact CB-CZ3 4.1Å; V2758-W2760 HydrophobicContact CG1-CD2 4.26Å; V2758-W2760 HydrophobicContact CG1-CE3 4.35Å; V2758-W2760 HydrophobicContact CG1-CH2 3.49Å; V2758-W2760 VanDerWaalsContact CG1-CH2 3.44Å; V2758-W2760 HydrophobicContact CG1-CZ2 3.36Å; V2758-W2760 HydrophobicContact CG1-CZ3 3.99Å; V2758-W2760 VanDerWaalsContact O-CZ3 3.29Å; V2758-W2760 WeakPolarHBondContact O-CZ3 3.42Å; V2758-I2771 HydrophobicContact CB-CD1 4.2Å; V2758-I2771 HydrophobicContact CG1-CD1 3.53Å; V2758-I2771 HydrophobicContact CG1-CG1 4.37Å; V2758-V2777 HydrophobicContact CG1-CG1 3.99Å; V2758-Q2778 CarbonylContact C-O 3.56Å; V2758-Q2778 VanDerWaalsContact CA-O 3.32Å; V2758-Q2778 WeakPolarHBondContact CA-O 3.28Å; V2758-L2779 HydrophobicContact CG1-CB 4.45Å; V2758-L2779 HydrophobicContact CG2-CB 4.2Å; V2758-L2779 HydrophobicContact CG2-CD1 3.87Å; V2758-L2779 HydrophobicContact CG2-CG 3.98Å
2759	R	90	Very high	77.3	Confident	118.2 Å²	118.2	59.7 Å²	59.7	45%	0.446	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	141.4	179.2	-159.4	179.2	175.8	117.3	0.5	109.6	N2749 F2750 D2761 V2777 Q2778	N2749-R2759 CarbonylContact O-C 3.43Å; N2749-R2759 WeakPolarHBondContact O-CA 3.29Å; F2750-R2759 HydrophobicContact CB-CB 4.29Å; F2750-R2759 HydrophobicContact CB-CG 4.41Å; F2750-R2759 HydrophobicContact CD2-CB 4.09Å; F2750-R2759 HydrophobicContact CD2-CG 4.14Å; F2750-R2759 HydrophobicContact CE2-CB 4.36Å; F2750-R2759 HydrophobicContact CE2-CG 3.73Å; F2750-R2759 HydrophobicContact CG-CG 4.22Å; R2759-D2761 IonicContact NH2-OD2 3.48Å; R2759-D2761 PolarHBondContact NH2-OD2 2.86Å; R2759-D2761 VanDerWaalsContact NH2-OD2 3.15Å; R2759-V2777 CarbonylContact O-C 3.52Å; R2759-V2777 VanDerWaalsContact O-CA 3.31Å; R2759-V2777 WeakPolarHBondContact O-CA 3.36Å; R2759-Q2778 PolarHBondContact N-O 3.22Å; R2759-Q2778 PolarHBondContact O-N 2.94Å
2760	W	88.1	Confident	76.5	Confident	27.6 Å²	27.6	60.3 Å²	60.3	11%	0.105	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	137.8	169.1	22	125.4	0	0	0	110.2	N2749 V2751 V2758 I2769 I2771 A2774 L2776 V2777	N2749-W2760 VanDerWaalsContact C-CE3 3.49Å; N2749-W2760 VanDerWaalsContact C-CH2 3.45Å; N2749-W2760 VanDerWaalsContact C-CZ3 3.47Å; N2749-W2760 VanDerWaalsContact CA-CZ2 3.46Å; N2749-W2760 HydrophobicContact CB-CB 4.19Å; N2749-W2760 HydrophobicContact CB-CD2 3.76Å; N2749-W2760 VanDerWaalsContact CB-CE2 3.45Å; N2749-W2760 HydrophobicContact CB-CE3 4.37Å; N2749-W2760 HydrophobicContact CB-CG 3.91Å; N2749-W2760 HydrophobicContact CB-CH2 4.44Å; N2749-W2760 HydrophobicContact CB-CZ2 3.91Å; N2749-W2760 WeakPolarHBondContact CB-O 3.31Å; N2749-W2760 VanDerWaalsContact CG-NE1 3.31Å; N2749-W2760 WeakPolarHBondContact O-CZ3 3.35Å; N2749-W2760 PolarHBondContact O-N 3.06Å; N2749-W2760 PolarHBondContact OD1-NE1 3.26Å; V2751-W2760 HydrophobicContact CB-CH2 3.93Å; V2751-W2760 HydrophobicContact CB-CZ3 3.96Å; V2751-W2760 HydrophobicContact CG2-CH2 3.86Å; V2751-W2760 HydrophobicContact CG2-CZ3 3.76Å; V2758-W2760 HydrophobicContact CB-CH2 3.73Å; V2758-W2760 HydrophobicContact CB-CZ2 4.13Å; V2758-W2760 HydrophobicContact CB-CZ3 4.1Å; V2758-W2760 HydrophobicContact CG1-CD2 4.26Å; V2758-W2760 HydrophobicContact CG1-CE3 4.35Å; V2758-W2760 HydrophobicContact CG1-CH2 3.49Å; V2758-W2760 VanDerWaalsContact CG1-CH2 3.44Å; V2758-W2760 HydrophobicContact CG1-CZ2 3.36Å; V2758-W2760 HydrophobicContact CG1-CZ3 3.99Å; V2758-W2760 VanDerWaalsContact O-CZ3 3.29Å; V2758-W2760 WeakPolarHBondContact O-CZ3 3.42Å; W2760-I2769 PolarHBondContact NE1-O 2.91Å; W2760-I2769 VanDerWaalsContact NE1-O 3.11Å; W2760-I2771 HydrophobicContact CB-CG2 4.46Å; W2760-I2771 VanDerWaalsContact CD1-CG2 3.41Å; W2760-I2771 VanDerWaalsContact CD1-O 3.23Å; W2760-I2771 HydrophobicContact CD2-CB 4.36Å; W2760-I2771 HydrophobicContact CD2-CG2 3.72Å; W2760-I2771 VanDerWaalsContact CD2-CG2 3.44Å; W2760-I2771 VanDerWaalsContact CE2-CG2 3.42Å; W2760-I2771 HydrophobicContact CE3-CB 4.31Å; W2760-I2771 HydrophobicContact CE3-CD1 4.26Å; W2760-I2771 HydrophobicContact CE3-CG1 4.28Å; W2760-I2771 HydrophobicContact CE3-CG2 4.09Å; W2760-I2771 HydrophobicContact CG-CG2 3.95Å; W2760-I2771 HydrophobicContact CH2-CG2 4.45Å; W2760-I2771 HydrophobicContact CZ2-CG2 3.76Å; W2760-I2771 HydrophobicContact CZ3-CD1 4.32Å; W2760-I2771 VanDerWaalsContact NE1-CG2 3.3Å; W2760-I2771 PolarHBondContact NE1-O 3.09Å; W2760-A2774 HydrophobicContact CB-CB 3.7Å; W2760-A2774 HydrophobicContact CG-CB 4.15Å; W2760-L2776 CarbonylContact C-O 3.47Å; W2760-L2776 WeakPolarHBondContact CA-O 3.11Å; W2760-L2776 WeakPolarHBondContact CB-O 3.39Å; W2760-V2777 HydrophobicContact CB-CB 4.47Å; W2760-V2777 HydrophobicContact CB-CG1 4.48Å; W2760-V2777 HydrophobicContact CB-CG2 4.01Å; W2760-V2777 HydrophobicContact CG-CG1 4.3Å; W2760-V2777 HydrophobicContact CG-CG2 4.17Å
2761	D	81.4	Confident	75.7	Confident	56.2 Å²	56.2	61.3 Å²	61.3	30%	0.301	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	139.7	179.5	-163	-27.5	0	0	0	109.7	R2759 N2763 I2769 P2775 L2776	R2759-D2761 IonicContact NH2-OD2 3.48Å; R2759-D2761 PolarHBondContact NH2-OD2 2.86Å; R2759-D2761 VanDerWaalsContact NH2-OD2 3.15Å; D2761-N2763 VanDerWaalsContact C-N 3.32Å; D2761-N2763 WeakPolarHBondContact OD1-CB 3.49Å; D2761-N2763 PolarHBondContact OD1-N 3.05Å; D2761-N2763 PolarHBondContact OD1-ND2 2.84Å; D2761-N2763 PolarHBondContact OD2-ND2 2.88Å; D2761-I2769 VanDerWaalsContact C-CD1 3.42Å; D2761-P2775 WeakPolarHBondContact O-CD 3.33Å; D2761-P2775 WeakPolarHBondContact O-CG 3.08Å; D2761-L2776 HydrophobicContact CB-CB 4.2Å; D2761-L2776 HydrophobicContact CB-CD2 4.24Å; D2761-L2776 HydrophobicContact CB-CG 4.35Å; D2761-L2776 PolarHBondContact N-O 2.97Å; D2761-L2776 PolarHBondContact O-N 2.82Å
2762	S	70.9	Confident	74.7	Confident	33.4 Å²	33.4	64.7 Å²	64.7	23%	0.234	34%	0.34	C	S	.	.			trans	-83.3	-10.2	176.3	54.9	0	0	0	0	112.9	G2764 L2765 P2775	S2762-G2764 PolarHBondContact O-N 3.13Å; S2762-G2764 VanDerWaalsContact O-N 3.12Å; S2762-G2764 PolarHBondContact OG-N 2.84Å; S2762-L2765 WeakPolarHBondContact CB-O 3.42Å; S2762-L2765 WeakPolarHBondContact O-CB 3.25Å; S2762-L2765 WeakPolarHBondContact O-CG 3.25Å; S2762-L2765 PolarHBondContact O-N 3.04Å; S2762-L2765 PolarHBondContact OG-O 3.47Å; S2762-P2775 WeakPolarHBondContact O-CG 3.16Å
2763	N	67.5	Low	73.7	Confident	105.8 Å²	105.8	64.6 Å²	64.6	57%	0.566	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	34.8	50.2	-174.6	-94.1	-1.1	0	0	0	112.4	D2761 L2765 P2775	D2761-N2763 VanDerWaalsContact C-N 3.32Å; D2761-N2763 WeakPolarHBondContact OD1-CB 3.49Å; D2761-N2763 PolarHBondContact OD1-N 3.05Å; D2761-N2763 PolarHBondContact OD1-ND2 2.84Å; D2761-N2763 PolarHBondContact OD2-ND2 2.88Å; N2763-L2765 PolarHBondContact O-N 3.11Å; N2763-P2775 HydrophobicContact CB-CB 4.3Å; N2763-P2775 HydrophobicContact CB-CG 4.21Å
2764	G	56.8	Low	73.1	Confident	63.4 Å²	63.4	63.7 Å²	63.7	65%	0.654	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.4	-7.9	179.3	0	0	0	0	0	116.1	S2762 K2766	S2762-G2764 PolarHBondContact O-N 3.13Å; S2762-G2764 VanDerWaalsContact O-N 3.12Å; S2762-G2764 PolarHBondContact OG-N 2.84Å; G2764-K2766 PolarHBondContact O-N 3.13Å
2765	L	55.7	Low	72.9	Confident	65.8 Å²	65.8	61.6 Å²	61.6	35%	0.345	33%	0.328	S	S	.	.			trans	-74.9	122.4	174.1	-68.1	167.3	0	0	0	110.5	D2354 S2762 N2763 Q2767 I2769 P2775	D2354-L2765 WeakPolarHBondContact OD1-CD2 3.45Å; D2354-L2765 WeakPolarHBondContact OD2-CD2 3.48Å; S2762-L2765 WeakPolarHBondContact CB-O 3.42Å; S2762-L2765 WeakPolarHBondContact O-CB 3.25Å; S2762-L2765 WeakPolarHBondContact O-CG 3.25Å; S2762-L2765 PolarHBondContact O-N 3.04Å; S2762-L2765 PolarHBondContact OG-O 3.47Å; N2763-L2765 PolarHBondContact O-N 3.11Å; L2765-Q2767 VanDerWaalsContact C-N 3.32Å; L2765-Q2767 PolarHBondContact O-N 3.02Å; L2765-Q2767 VanDerWaalsContact O-N 3.16Å; L2765-I2769 HydrophobicContact CB-CD1 3.72Å; L2765-I2769 HydrophobicContact CD1-CD1 3.97Å; L2765-I2769 HydrophobicContact CD2-CD1 3.75Å; L2765-I2769 HydrophobicContact CG-CD1 4.35Å; L2765-P2775 HydrophobicContact CD1-CG 3.51Å; L2765-P2775 VanDerWaalsContact CD1-CG 3.43Å; L2765-P2775 HydrophobicContact CG-CG 4.34Å
2766	K	51.5	Low	72.8	Confident	179 Å²	179	57.4 Å²	57.4	78%	0.778	31%	0.311	S	S	*	.			trans	-77.4	-5.6	-177.7	-72.2	-173.6	177.4	-178.8	0	115	D2330 G2764	D2330-K2766 VanDerWaalsContact CA-NZ 3.31Å; D2330-K2766 IonicContact OD1-NZ 3.11Å; D2330-K2766 PolarHBondContact OD1-NZ 3.23Å; G2764-K2766 PolarHBondContact O-N 3.13Å
2767	Q	50.7	Low	72.7	Confident	90.4 Å²	90.4	56.7 Å²	56.7	42%	0.422	31%	0.307	S	S	.	.	S	Bend	trans	-87.7	152.9	-178.1	-68.5	-174.6	8.4	0	0	111.6	Q2331 S2333 L2765 I2769 F3387 E3388	Q2331-Q2767 PolarHBondContact O-NE2 3.14Å; S2333-Q2767 PolarHBondContact OG-NE2 3.31Å; S2333-Q2767 PolarHBondContact OG-OE1 2.73Å; L2765-Q2767 VanDerWaalsContact C-N 3.32Å; L2765-Q2767 PolarHBondContact O-N 3.02Å; L2765-Q2767 VanDerWaalsContact O-N 3.16Å; Q2767-I2769 WeakPolarHBondContact O-CD1 3.46Å; Q2767-I2769 VanDerWaalsContact O-CG1 3.31Å; Q2767-I2769 WeakPolarHBondContact O-CG1 3.41Å; Q2767-I2769 PolarHBondContact O-N 3.05Å; Q2767-I2769 VanDerWaalsContact O-N 3.13Å; Q2767-F3387 WeakPolarHBondContact CG-O 3.39Å; Q2767-F3387 PolarHBondContact NE2-O 3.09Å; Q2767-F3387 PolarHBondContact OE1-O 3.34Å; Q2767-E3388 PolarHBondContact NE2-O 2.65Å; Q2767-E3388 VanDerWaalsContact OE1-C 3.24Å; Q2767-E3388 PolarHBondContact OE1-O 2.93Å; Q2767-E3388 VanDerWaalsContact OE1-O 3.11Å
2768	P	49.7	Very low	72.6	Confident	92 Å²	92	59 Å²	59	60%	0.597	32%	0.315	S	S	*	.			trans	-62.7	114.9	167.6	27.1	-32.2	0	0	0	108.8	N2770 E3388	P2768-N2770 PolarHBondContact O-N 2.56Å; P2768-E3388 HydrophobicContact CG-CG 4.2Å
2769	I	56.9	Low	72.7	Confident	37.2 Å²	37.2	59.3 Å²	59.3	19%	0.191	32%	0.316	C	S	.	.			trans	-101.9	131.5	-178.9	-61.7	164.9	0	0	0	107.6	N2749 W2760 D2761 L2765 Q2767 I2771 T2773 A2774	N2749-I2769 VanDerWaalsContact ND2-CD1 3.32Å; N2749-I2769 WeakPolarHBondContact ND2-CD1 3.4Å; W2760-I2769 PolarHBondContact NE1-O 2.91Å; W2760-I2769 VanDerWaalsContact NE1-O 3.11Å; D2761-I2769 VanDerWaalsContact C-CD1 3.42Å; L2765-I2769 HydrophobicContact CB-CD1 3.72Å; L2765-I2769 HydrophobicContact CD1-CD1 3.97Å; L2765-I2769 HydrophobicContact CD2-CD1 3.75Å; L2765-I2769 HydrophobicContact CG-CD1 4.35Å; Q2767-I2769 WeakPolarHBondContact O-CD1 3.46Å; Q2767-I2769 VanDerWaalsContact O-CG1 3.31Å; Q2767-I2769 WeakPolarHBondContact O-CG1 3.41Å; Q2767-I2769 PolarHBondContact O-N 3.05Å; Q2767-I2769 VanDerWaalsContact O-N 3.13Å; I2769-I2771 PolarHBondContact O-N 2.96Å; I2769-T2773 WeakPolarHBondContact CG2-OG1 3.25Å; I2769-A2774 HydrophobicContact CG2-CB 3.49Å; I2769-A2774 VanDerWaalsContact CG2-CB 3.46Å
2770	N	64.5	Low	72.9	Confident	55.6 Å²	55.6	55.5 Å²	55.5	30%	0.297	31%	0.306	S	S	.	.			trans	-82	152.8	170.7	113.4	0.3	0	0	0	110	P2768 L2772 T2773 A2774	P2768-N2770 PolarHBondContact O-N 2.56Å; N2770-L2772 PolarHBondContact O-N 3.06Å; N2770-L2772 VanDerWaalsContact O-N 3.11Å; N2770-L2772 WeakPolarHBondContact OD1-CA 3.32Å; N2770-L2772 WeakPolarHBondContact OD1-CB 3.26Å; N2770-L2772 PolarHBondContact OD1-N 3.19Å; N2770-L2772 VanDerWaalsContact OD1-N 3.12Å; N2770-T2773 HydrophobicContact CB-CG2 4.49Å; N2770-T2773 PolarHBondContact N-OG1 2.86Å; N2770-T2773 WeakPolarHBondContact O-CA 3.35Å; N2770-T2773 PolarHBondContact O-N 3.03Å; N2770-T2773 VanDerWaalsContact O-N 3.09Å; N2770-T2773 PolarHBondContact O-OG1 2.91Å; N2770-T2773 PolarHBondContact OD1-N 3.05Å; N2770-T2773 PolarHBondContact OD1-OG1 2.98Å; N2770-T2773 VanDerWaalsContact OD1-OG1 3.11Å; N2770-A2774 WeakPolarHBondContact O-CB 3.47Å; N2770-A2774 PolarHBondContact O-N 2.98Å
2771	I	69	Low	73.1	Confident	53.6 Å²	53.6	55.7 Å²	55.7	28%	0.275	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.9	-31.2	-179.4	-126.7	166.3	0	0	0	113.3	V2758 W2760 I2769 T2773 A2774 V2777 R2792 S3123	V2758-I2771 HydrophobicContact CB-CD1 4.2Å; V2758-I2771 HydrophobicContact CG1-CD1 3.53Å; V2758-I2771 HydrophobicContact CG1-CG1 4.37Å; W2760-I2771 HydrophobicContact CB-CG2 4.46Å; W2760-I2771 VanDerWaalsContact CD1-CG2 3.41Å; W2760-I2771 VanDerWaalsContact CD1-O 3.23Å; W2760-I2771 HydrophobicContact CD2-CB 4.36Å; W2760-I2771 HydrophobicContact CD2-CG2 3.72Å; W2760-I2771 VanDerWaalsContact CD2-CG2 3.44Å; W2760-I2771 VanDerWaalsContact CE2-CG2 3.42Å; W2760-I2771 HydrophobicContact CE3-CB 4.31Å; W2760-I2771 HydrophobicContact CE3-CD1 4.26Å; W2760-I2771 HydrophobicContact CE3-CG1 4.28Å; W2760-I2771 HydrophobicContact CE3-CG2 4.09Å; W2760-I2771 HydrophobicContact CG-CG2 3.95Å; W2760-I2771 HydrophobicContact CH2-CG2 4.45Å; W2760-I2771 HydrophobicContact CZ2-CG2 3.76Å; W2760-I2771 HydrophobicContact CZ3-CD1 4.32Å; W2760-I2771 VanDerWaalsContact NE1-CG2 3.3Å; W2760-I2771 PolarHBondContact NE1-O 3.09Å; I2769-I2771 PolarHBondContact O-N 2.96Å; I2771-T2773 PolarHBondContact O-N 2.91Å; I2771-A2774 PolarHBondContact O-N 3.17Å; I2771-V2777 HydrophobicContact CD1-CG1 4.36Å; I2771-V2777 HydrophobicContact CG1-CG1 3.89Å; I2771-V2777 HydrophobicContact CG1-CG2 4.37Å; I2771-V2777 VanDerWaalsContact O-CG2 3.28Å; I2771-V2777 WeakPolarHBondContact O-CG2 3.35Å; I2771-R2792 PolarHBondContact O-NH1 2.87Å; I2771-R2792 PolarHBondContact O-NH2 3.45Å; I2771-S3123 VanDerWaalsContact CD1-O 3.28Å; I2771-S3123 WeakPolarHBondContact CD1-O 3.21Å
2772	L	67.7	Low	73.4	Confident	85.6 Å²	85.6	57.6 Å²	57.6	45%	0.448	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-26.4	-179.7	-61.8	171.9	0	0	0	113.2	N2770 R2792 E3124 L3398	N2770-L2772 PolarHBondContact O-N 3.06Å; N2770-L2772 VanDerWaalsContact O-N 3.11Å; N2770-L2772 WeakPolarHBondContact OD1-CA 3.32Å; N2770-L2772 WeakPolarHBondContact OD1-CB 3.26Å; N2770-L2772 PolarHBondContact OD1-N 3.19Å; N2770-L2772 VanDerWaalsContact OD1-N 3.12Å; L2772-R2792 VanDerWaalsContact O-CZ 3.25Å; L2772-R2792 PolarHBondContact O-NE 3.15Å; L2772-R2792 PolarHBondContact O-NH2 3.13Å; L2772-E3124 HydrophobicContact CD2-CB 4.38Å; L2772-E3124 HydrophobicContact CD2-CG 3.62Å; L2772-E3124 WeakPolarHBondContact CD2-OE1 3.43Å; L2772-E3124 WeakPolarHBondContact CD2-OE2 3.05Å; L2772-L3398 HydrophobicContact CD1-CB 4.01Å; L2772-L3398 HydrophobicContact CD1-CD1 4.01Å; L2772-L3398 HydrophobicContact CD2-CD1 3.94Å; L2772-L3398 HydrophobicContact CG-CD1 4.46Å
2773	T	72.4	Confident	74.1	Confident	47 Å²	47	59.1 Å²	59.1	29%	0.288	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.1	3.1	-175.5	62.7	0	0	0	0	113.8	I2769 N2770 I2771 F2794 K3390	I2769-T2773 WeakPolarHBondContact CG2-OG1 3.25Å; N2770-T2773 HydrophobicContact CB-CG2 4.49Å; N2770-T2773 PolarHBondContact N-OG1 2.86Å; N2770-T2773 WeakPolarHBondContact O-CA 3.35Å; N2770-T2773 PolarHBondContact O-N 3.03Å; N2770-T2773 VanDerWaalsContact O-N 3.09Å; N2770-T2773 PolarHBondContact O-OG1 2.91Å; N2770-T2773 PolarHBondContact OD1-N 3.05Å; N2770-T2773 PolarHBondContact OD1-OG1 2.98Å; N2770-T2773 VanDerWaalsContact OD1-OG1 3.11Å; I2771-T2773 PolarHBondContact O-N 2.91Å; T2773-F2794 VanDerWaalsContact O-CE2 3.3Å; T2773-F2794 WeakPolarHBondContact O-CE2 3.37Å; T2773-F2794 WeakPolarHBondContact O-CZ 3.32Å; T2773-K3390 HydrophobicContact CG2-CD 4.12Å
2774	A	81.1	Confident	74.9	Confident	1.8 Å²	1.8	55.7 Å²	55.7	2%	0.015	32%	0.322	C	S	.	.			trans	-63.5	133.9	179.4	0	0	0	0	0	112.1	W2760 I2769 N2770 I2771 L2776 V2777 R2792	W2760-A2774 HydrophobicContact CB-CB 3.7Å; W2760-A2774 HydrophobicContact CG-CB 4.15Å; I2769-A2774 HydrophobicContact CG2-CB 3.49Å; I2769-A2774 VanDerWaalsContact CG2-CB 3.46Å; N2770-A2774 WeakPolarHBondContact O-CB 3.47Å; N2770-A2774 PolarHBondContact O-N 2.98Å; I2771-A2774 PolarHBondContact O-N 3.17Å; A2774-L2776 VanDerWaalsContact C-N 3.25Å; A2774-L2776 PolarHBondContact O-N 3.13Å; A2774-V2777 HydrophobicContact CB-CG2 3.92Å; A2774-R2792 WeakPolarHBondContact O-CD 3.36Å; A2774-R2792 PolarHBondContact O-NH1 2.9Å
2775	P	86.2	Confident	76.3	Confident	18.8 Å²	18.8	53.9 Å²	53.9	12%	0.122	30%	0.304	C	S	.	.	S	Bend	trans	-59.3	-32.6	173.8	-17.1	22.9	0	0	0	113	D2761 S2762 N2763 L2765 Q2791 R2792 F2794	D2761-P2775 WeakPolarHBondContact O-CD 3.33Å; D2761-P2775 WeakPolarHBondContact O-CG 3.08Å; S2762-P2775 WeakPolarHBondContact O-CG 3.16Å; N2763-P2775 HydrophobicContact CB-CB 4.3Å; N2763-P2775 HydrophobicContact CB-CG 4.21Å; L2765-P2775 HydrophobicContact CD1-CG 3.51Å; L2765-P2775 VanDerWaalsContact CD1-CG 3.43Å; L2765-P2775 HydrophobicContact CG-CG 4.34Å; P2775-Q2791 CarbonylContact O-C 3.55Å; P2775-Q2791 VanDerWaalsContact O-CA 3.27Å; P2775-Q2791 WeakPolarHBondContact O-CA 3.36Å; P2775-R2792 WeakPolarHBondContact CA-O 3.23Å; P2775-R2792 PolarHBondContact O-N 3.09Å; P2775-F2794 HydrophobicContact CG-CD2 4.44Å; P2775-F2794 HydrophobicContact CG-CE2 4.31Å
2776	L	89	Confident	77.9	Confident	28.6 Å²	28.6	51.4 Å²	51.4	15%	0.15	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	128.3	177.6	-177.5	67	0	0	0	110	W2760 D2761 A2774 Q2778 Q2789 Y2790 Q2791	W2760-L2776 CarbonylContact C-O 3.47Å; W2760-L2776 WeakPolarHBondContact CA-O 3.11Å; W2760-L2776 WeakPolarHBondContact CB-O 3.39Å; D2761-L2776 HydrophobicContact CB-CB 4.2Å; D2761-L2776 HydrophobicContact CB-CD2 4.24Å; D2761-L2776 HydrophobicContact CB-CG 4.35Å; D2761-L2776 PolarHBondContact N-O 2.97Å; D2761-L2776 PolarHBondContact O-N 2.82Å; A2774-L2776 VanDerWaalsContact C-N 3.25Å; A2774-L2776 PolarHBondContact O-N 3.13Å; L2776-Q2778 HydrophobicContact CD1-CG 4.37Å; L2776-Q2778 HydrophobicContact CG-CG 4.39Å; L2776-Q2789 HydrophobicContact CD1-CG 3.61Å; L2776-Y2790 CarbonylContact C-O 3.53Å; L2776-Y2790 WeakPolarHBondContact CA-O 3.23Å; L2776-Q2791 HydrophobicContact CD1-CB 4.2Å; L2776-Q2791 HydrophobicContact CD1-CG 4.01Å
2777	V	91	Very high	79.8	Confident	2.8 Å²	2.8	48.5 Å²	48.5	2%	0.017	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	133.2	171.4	-174.3	0	0	0	0	108.4	V2758 R2759 W2760 I2771 A2774 Q2789 Y2790 R2792	V2758-V2777 HydrophobicContact CG1-CG1 3.99Å; R2759-V2777 CarbonylContact O-C 3.52Å; R2759-V2777 VanDerWaalsContact O-CA 3.31Å; R2759-V2777 WeakPolarHBondContact O-CA 3.36Å; W2760-V2777 HydrophobicContact CB-CB 4.47Å; W2760-V2777 HydrophobicContact CB-CG1 4.48Å; W2760-V2777 HydrophobicContact CB-CG2 4.01Å; W2760-V2777 HydrophobicContact CG-CG1 4.3Å; W2760-V2777 HydrophobicContact CG-CG2 4.17Å; I2771-V2777 HydrophobicContact CD1-CG1 4.36Å; I2771-V2777 HydrophobicContact CG1-CG1 3.89Å; I2771-V2777 HydrophobicContact CG1-CG2 4.37Å; I2771-V2777 VanDerWaalsContact O-CG2 3.28Å; I2771-V2777 WeakPolarHBondContact O-CG2 3.35Å; A2774-V2777 HydrophobicContact CB-CG2 3.92Å; V2777-Q2789 CarbonylContact O-C 3.49Å; V2777-Q2789 VanDerWaalsContact O-CA 3.27Å; V2777-Q2789 WeakPolarHBondContact O-CA 3.36Å; V2777-Y2790 HydrophobicContact CB-CD2 4.43Å; V2777-Y2790 PolarHBondContact N-O 2.8Å; V2777-Y2790 PolarHBondContact O-N 3.16Å; V2777-R2792 VanDerWaalsContact CG2-NH1 3.34Å
2778	Q	92.2	Very high	81.8	Confident	70.6 Å²	70.6	44.5 Å²	44.5	33%	0.33	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	125.9	178.3	-83.2	178.6	-31.2	0	0	109.4	V2758 R2759 L2776 T2780 L2788 Q2789	V2758-Q2778 CarbonylContact C-O 3.56Å; V2758-Q2778 VanDerWaalsContact CA-O 3.32Å; V2758-Q2778 WeakPolarHBondContact CA-O 3.28Å; R2759-Q2778 PolarHBondContact N-O 3.22Å; R2759-Q2778 PolarHBondContact O-N 2.94Å; L2776-Q2778 HydrophobicContact CD1-CG 4.37Å; L2776-Q2778 HydrophobicContact CG-CG 4.39Å; Q2778-T2780 PolarHBondContact NE2-OG1 3Å; Q2778-L2788 CarbonylContact C-O 3.52Å; Q2778-L2788 WeakPolarHBondContact CA-O 3.39Å; Q2778-Q2789 HydrophobicContact CG-CB 4.45Å; Q2778-Q2789 HydrophobicContact CG-CG 4.13Å; Q2778-Q2789 VanDerWaalsContact NE2-OE1 3.13Å
2779	L	94.2	Very high	83.9	Confident	12.6 Å²	12.6	41 Å²	41	7%	0.066	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	135	169.7	175.4	158.1	0	0	0	108.7	T2756 S2757 V2758 F2786 R2787 L2788	T2756-L2779 HydrophobicContact CG2-CD1 4.23Å; T2756-L2779 HydrophobicContact CG2-CD2 4.11Å; T2756-L2779 HydrophobicContact CG2-CG 3.94Å; S2757-L2779 CarbonylContact O-C 3.55Å; S2757-L2779 VanDerWaalsContact O-CA 3.32Å; S2757-L2779 WeakPolarHBondContact O-CA 3.27Å; V2758-L2779 HydrophobicContact CG1-CB 4.45Å; V2758-L2779 HydrophobicContact CG2-CB 4.2Å; V2758-L2779 HydrophobicContact CG2-CD1 3.87Å; V2758-L2779 HydrophobicContact CG2-CG 3.98Å; L2779-F2786 HydrophobicContact CD2-CD1 3.75Å; L2779-F2786 HydrophobicContact CD2-CE1 3.82Å; L2779-R2787 CarbonylContact O-C 3.53Å; L2779-R2787 VanDerWaalsContact O-CA 3.3Å; L2779-R2787 WeakPolarHBondContact O-CA 3.41Å; L2779-L2788 HydrophobicContact CB-CB 4.17Å; L2779-L2788 HydrophobicContact CB-CD2 4.32Å; L2779-L2788 HydrophobicContact CD2-CB 4.43Å; L2779-L2788 PolarHBondContact N-O 2.94Å; L2779-L2788 PolarHBondContact O-N 3.1Å
2780	T	93.9	Very high	85.6	Confident	38.4 Å²	38.4	40.1 Å²	40.1	24%	0.236	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	119	177.1	15.3	0	0	0	0	109.4	T2756 S2757 Q2778 T2782 F2786 R2787	T2756-T2780 CarbonylContact C-O 3.55Å; T2756-T2780 VanDerWaalsContact CA-O 3.29Å; T2756-T2780 WeakPolarHBondContact CA-O 3.36Å; S2757-T2780 PolarHBondContact N-O 3.17Å; S2757-T2780 PolarHBondContact O-N 3.05Å; S2757-T2780 PolarHBondContact OG-O 2.91Å; S2757-T2780 PolarHBondContact OG-OG1 3.02Å; Q2778-T2780 PolarHBondContact NE2-OG1 3Å; T2780-T2782 HydrophobicContact CG2-CG2 4.19Å; T2780-F2786 CarbonylContact C-O 3.53Å; T2780-F2786 VanDerWaalsContact CA-O 3.28Å; T2780-F2786 WeakPolarHBondContact CA-O 3.43Å; T2780-R2787 HydrophobicContact CG2-CG 4.11Å
2781	D	92.4	Very high	86.8	Confident	31.4 Å²	31.4	38.6 Å²	38.6	17%	0.168	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	112.6	168	173.9	15.5	0	0	0	108.8	T2756 A2783 S2784 G2785 F2786	T2756-D2781 HydrophobicContact CG2-CB 4.3Å; D2781-A2783 VanDerWaalsContact C-N 3.3Å; D2781-A2783 PolarHBondContact O-N 3.12Å; D2781-A2783 WeakPolarHBondContact OD1-CA 3.08Å; D2781-A2783 VanDerWaalsContact OD1-CB 3.29Å; D2781-A2783 WeakPolarHBondContact OD1-CB 3.22Å; D2781-A2783 PolarHBondContact OD1-N 2.96Å; D2781-S2784 VanDerWaalsContact CG-OG 3.23Å; D2781-S2784 PolarHBondContact OD1-N 3.45Å; D2781-S2784 VanDerWaalsContact OD2-CB 3.27Å; D2781-S2784 WeakPolarHBondContact OD2-CB 3.34Å; D2781-S2784 PolarHBondContact OD2-N 3.11Å; D2781-S2784 PolarHBondContact OD2-OG 3.07Å; D2781-G2785 CarbonylContact O-C 3.55Å; D2781-G2785 WeakPolarHBondContact O-CA 3.32Å; D2781-G2785 PolarHBondContact O-N 3.13Å; D2781-F2786 HydrophobicContact CB-CB 4.28Å; D2781-F2786 PolarHBondContact N-O 3.1Å; D2781-F2786 PolarHBondContact O-N 3.05Å
2782	T	88.7	Confident	87.8	Confident	95.8 Å²	95.8	37.1 Å²	37.1	59%	0.588	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-18.9	-178.5	57.6	0	0	0	0	113.2	K2755 T2780	K2755-T2782 WeakPolarHBondContact CB-OG1 3.38Å; K2755-T2782 WeakPolarHBondContact O-CB 3.05Å; K2755-T2782 PolarHBondContact O-N 3.3Å; K2755-T2782 PolarHBondContact O-OG1 3.12Å; T2780-T2782 HydrophobicContact CG2-CG2 4.19Å
2783	A	85.3	Confident	88.7	Confident	65.4 Å²	65.4	36.4 Å²	36.4	54%	0.54	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-48.3	178.9	0	0	0	0	0	111.9	K2755 D2781	K2755-A2783 HydrophobicContact CB-CB 4.12Å; K2755-A2783 HydrophobicContact CD-CB 3.81Å; K2755-A2783 HydrophobicContact CG-CB 4.49Å; D2781-A2783 VanDerWaalsContact C-N 3.3Å; D2781-A2783 PolarHBondContact O-N 3.12Å; D2781-A2783 WeakPolarHBondContact OD1-CA 3.08Å; D2781-A2783 VanDerWaalsContact OD1-CB 3.29Å; D2781-A2783 WeakPolarHBondContact OD1-CB 3.22Å; D2781-A2783 PolarHBondContact OD1-N 2.96Å
2784	S	84.7	Confident	89.3	Confident	34.2 Å²	34.2	36.7 Å²	36.7	24%	0.239	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-16.1	177.4	64.2	0	0	0	0	113.4	D2781 F2786 Y3696	D2781-S2784 VanDerWaalsContact CG-OG 3.23Å; D2781-S2784 PolarHBondContact OD1-N 3.45Å; D2781-S2784 VanDerWaalsContact OD2-CB 3.27Å; D2781-S2784 WeakPolarHBondContact OD2-CB 3.34Å; D2781-S2784 PolarHBondContact OD2-N 3.11Å; D2781-S2784 PolarHBondContact OD2-OG 3.07Å; S2784-F2786 PolarHBondContact O-N 2.91Å; S2784-F2786 VanDerWaalsContact OG-CB 3.22Å; S2784-F2786 WeakPolarHBondContact OG-CB 3.38Å; S2784-F2786 PolarHBondContact OG-N 2.98Å; S2784-F2786 VanDerWaalsContact OG-N 3.16Å; S2784-Y3696 WeakPolarHBondContact CA-OH 3.43Å
2785	G	84.9	Confident	89.3	Confident	26 Å²	26	39.8 Å²	39.8	27%	0.268	22%	0.215	S	C	.	.			trans	72.4	8.7	-168.7	0	0	0	0	0	113.6	D2781 R2787 P2809	D2781-G2785 CarbonylContact O-C 3.55Å; D2781-G2785 WeakPolarHBondContact O-CA 3.32Å; D2781-G2785 PolarHBondContact O-N 3.13Å; G2785-R2787 PolarHBondContact O-N 3.45Å; G2785-P2809 WeakPolarHBondContact O-CD 3.3Å
2786	F	90.3	Very high	88.8	Confident	11.8 Å²	11.8	40.6 Å²	40.6	5%	0.052	23%	0.227	C	C	.	.			trans	-63.5	134.1	176.7	178.8	-114.9	0	0	0	111.2	L2779 T2780 D2781 S2784 L2788 R2807 L2808 I3120 I3128 I3129	L2779-F2786 HydrophobicContact CD2-CD1 3.75Å; L2779-F2786 HydrophobicContact CD2-CE1 3.82Å; T2780-F2786 CarbonylContact C-O 3.53Å; T2780-F2786 VanDerWaalsContact CA-O 3.28Å; T2780-F2786 WeakPolarHBondContact CA-O 3.43Å; D2781-F2786 HydrophobicContact CB-CB 4.28Å; D2781-F2786 PolarHBondContact N-O 3.1Å; D2781-F2786 PolarHBondContact O-N 3.05Å; S2784-F2786 PolarHBondContact O-N 2.91Å; S2784-F2786 VanDerWaalsContact OG-CB 3.22Å; S2784-F2786 WeakPolarHBondContact OG-CB 3.38Å; S2784-F2786 PolarHBondContact OG-N 2.98Å; S2784-F2786 VanDerWaalsContact OG-N 3.16Å; F2786-L2788 HydrophobicContact CE1-CB 3.94Å; F2786-L2788 HydrophobicContact CZ-CB 3.91Å; F2786-L2788 HydrophobicContact CZ-CD1 4.43Å; F2786-R2807 CarbonylContact C-O 3.55Å; F2786-R2807 VanDerWaalsContact CA-O 3.31Å; F2786-R2807 WeakPolarHBondContact CA-O 3.22Å; F2786-R2807 VanDerWaalsContact CD2-O 3.25Å; F2786-R2807 WeakPolarHBondContact CD2-O 3.37Å; F2786-L2808 HydrophobicContact CB-CD1 3.77Å; F2786-L2808 HydrophobicContact CD2-CB 4.14Å; F2786-L2808 HydrophobicContact CD2-CD1 3.91Å; F2786-L2808 HydrophobicContact CG-CD1 4.24Å; F2786-I3120 HydrophobicContact CD1-CG2 3.66Å; F2786-I3120 HydrophobicContact CD2-CD1 4.48Å; F2786-I3120 HydrophobicContact CD2-CG2 4.11Å; F2786-I3120 HydrophobicContact CE1-CG2 3.48Å; F2786-I3120 VanDerWaalsContact CE1-CG2 3.48Å; F2786-I3120 HydrophobicContact CE2-CG2 3.97Å; F2786-I3120 HydrophobicContact CG-CG2 3.98Å; F2786-I3120 HydrophobicContact CZ-CG2 3.67Å; F2786-I3128 HydrophobicContact CE1-CD1 4.2Å; F2786-I3128 HydrophobicContact CZ-CD1 3.61Å; F2786-I3129 HydrophobicContact CE2-CD1 4.47Å
2787	R	91.7	Very high	88.3	Confident	118.6 Å²	118.6	41.8 Å²	41.8	45%	0.448	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	139.6	172.7	-58	-175.5	-178.6	173.3	0.6	110.1	L2779 T2780 G2785 H2806 R2807 F2852	L2779-R2787 CarbonylContact O-C 3.53Å; L2779-R2787 VanDerWaalsContact O-CA 3.3Å; L2779-R2787 WeakPolarHBondContact O-CA 3.41Å; T2780-R2787 HydrophobicContact CG2-CG 4.11Å; G2785-R2787 PolarHBondContact O-N 3.45Å; R2787-H2806 CarbonylContact O-C 3.54Å; R2787-R2807 HydrophobicContact CB-CB 4.29Å; R2787-R2807 PolarHBondContact N-O 2.94Å; R2787-R2807 PolarHBondContact O-N 3.08Å; R2787-F2852 HydrophobicContact CB-CZ 4.27Å
2788	L	92.7	Very high	87.9	Confident	6.8 Å²	6.8	42.7 Å²	42.7	4%	0.036	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	136.6	177.1	165	70.2	0	0	0	108.7	Q2778 L2779 F2786 Y2790 I2804 N2805 H2806 D3122	Q2778-L2788 CarbonylContact C-O 3.52Å; Q2778-L2788 WeakPolarHBondContact CA-O 3.39Å; L2779-L2788 HydrophobicContact CB-CB 4.17Å; L2779-L2788 HydrophobicContact CB-CD2 4.32Å; L2779-L2788 HydrophobicContact CD2-CB 4.43Å; L2779-L2788 PolarHBondContact N-O 2.94Å; L2779-L2788 PolarHBondContact O-N 3.1Å; F2786-L2788 HydrophobicContact CE1-CB 3.94Å; F2786-L2788 HydrophobicContact CZ-CB 3.91Å; F2786-L2788 HydrophobicContact CZ-CD1 4.43Å; L2788-Y2790 HydrophobicContact CD1-CD1 3.96Å; L2788-Y2790 HydrophobicContact CD1-CE1 3.6Å; L2788-Y2790 HydrophobicContact CD1-CE2 4.07Å; L2788-Y2790 HydrophobicContact CD2-CD1 4.35Å; L2788-Y2790 HydrophobicContact CD2-CE1 4.16Å; L2788-Y2790 HydrophobicContact CD2-CE2 4.23Å; L2788-Y2790 HydrophobicContact CG-CD1 4.39Å; L2788-Y2790 HydrophobicContact CG-CD2 4.27Å; L2788-Y2790 HydrophobicContact CG-CE1 4.25Å; L2788-Y2790 HydrophobicContact CG-CE2 3.65Å; L2788-I2804 HydrophobicContact CD1-CG2 3.95Å; L2788-N2805 CarbonylContact C-O 3.54Å; L2788-N2805 WeakPolarHBondContact CA-O 3.32Å; L2788-H2806 WeakPolarHBondContact CD1-CD2 3.38Å; L2788-H2806 WeakPolarHBondContact CD1-NE2 3.34Å; L2788-D3122 HydrophobicContact CD2-CB 3.58Å
2789	Q	92.5	Very high	87.7	Confident	18 Å²	18	40.5 Å²	40.5	8%	0.084	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	124	173.2	-177.4	172.3	-37.6	0	0	110.5	L2776 V2777 Q2778 Q2791 I2804 N2805 F2852	L2776-Q2789 HydrophobicContact CD1-CG 3.61Å; V2777-Q2789 CarbonylContact O-C 3.49Å; V2777-Q2789 VanDerWaalsContact O-CA 3.27Å; V2777-Q2789 WeakPolarHBondContact O-CA 3.36Å; Q2778-Q2789 HydrophobicContact CG-CB 4.45Å; Q2778-Q2789 HydrophobicContact CG-CG 4.13Å; Q2778-Q2789 VanDerWaalsContact NE2-OE1 3.13Å; Q2789-Q2791 HydrophobicContact CG-CG 4.23Å; Q2789-I2804 WeakPolarHBondContact O-CA 3.39Å; Q2789-N2805 HydrophobicContact CB-CB 4.39Å; Q2789-N2805 PolarHBondContact N-O 3.16Å; Q2789-N2805 PolarHBondContact O-N 3.08Å; Q2789-F2852 HydrophobicContact CB-CD1 3.73Å; Q2789-F2852 HydrophobicContact CB-CE1 3.9Å; Q2789-F2852 HydrophobicContact CG-CD1 4.42Å; Q2789-F2852 PolarHBondContact NE2-O 2.89Å
2790	Y	92.2	Very high	87.5	Confident	18 Å²	18	42.9 Å²	42.9	7%	0.071	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	131.5	166.1	-65.4	-37.3	0	0	0	109.7	L2776 V2777 L2788 L2802 H2803 I2804 D3122 S3123 R3126	L2776-Y2790 CarbonylContact C-O 3.53Å; L2776-Y2790 WeakPolarHBondContact CA-O 3.23Å; V2777-Y2790 HydrophobicContact CB-CD2 4.43Å; V2777-Y2790 PolarHBondContact N-O 2.8Å; V2777-Y2790 PolarHBondContact O-N 3.16Å; L2788-Y2790 HydrophobicContact CD1-CD1 3.96Å; L2788-Y2790 HydrophobicContact CD1-CE1 3.6Å; L2788-Y2790 HydrophobicContact CD1-CE2 4.07Å; L2788-Y2790 HydrophobicContact CD2-CD1 4.35Å; L2788-Y2790 HydrophobicContact CD2-CE1 4.16Å; L2788-Y2790 HydrophobicContact CD2-CE2 4.23Å; L2788-Y2790 HydrophobicContact CG-CD1 4.39Å; L2788-Y2790 HydrophobicContact CG-CD2 4.27Å; L2788-Y2790 HydrophobicContact CG-CE1 4.25Å; L2788-Y2790 HydrophobicContact CG-CE2 3.65Å; Y2790-L2802 HydrophobicContact CD1-CD1 4.34Å; Y2790-L2802 HydrophobicContact CG-CD1 4.32Å; Y2790-H2803 CarbonylContact C-O 3.5Å; Y2790-H2803 WeakPolarHBondContact CA-O 3.18Å; Y2790-I2804 HydrophobicContact CD1-CB 4.09Å; Y2790-I2804 HydrophobicContact CD1-CD1 4.2Å; Y2790-I2804 HydrophobicContact CD1-CG1 3.65Å; Y2790-I2804 HydrophobicContact CD1-CG2 3.88Å; Y2790-I2804 HydrophobicContact CE1-CB 4.08Å; Y2790-I2804 HydrophobicContact CE1-CD1 3.68Å; Y2790-I2804 HydrophobicContact CE1-CG1 3.63Å; Y2790-I2804 HydrophobicContact CE1-CG2 3.53Å; Y2790-I2804 VanDerWaalsContact CE1-CG2 3.49Å; Y2790-D3122 HydrophobicContact CE2-CB 4.4Å; Y2790-D3122 VanDerWaalsContact OH-CB 3.22Å; Y2790-D3122 WeakPolarHBondContact OH-CB 3.25Å; Y2790-D3122 VanDerWaalsContact OH-CG 3.3Å; Y2790-D3122 PolarHBondContact OH-OD2 2.83Å; Y2790-S3123 WeakPolarHBondContact CE2-OG 3.17Å; Y2790-R3126 PolarHBondContact OH-NH2 2.79Å
2791	Q	90.8	Very high	87.4	Confident	24 Å²	24	41.7 Å²	41.7	11%	0.112	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	115.2	173.3	-155	173.2	9.4	0	0	109.9	P2775 L2776 Q2789 L2802 H2803 F2852 N2854	P2775-Q2791 CarbonylContact O-C 3.55Å; P2775-Q2791 VanDerWaalsContact O-CA 3.27Å; P2775-Q2791 WeakPolarHBondContact O-CA 3.36Å; L2776-Q2791 HydrophobicContact CD1-CB 4.2Å; L2776-Q2791 HydrophobicContact CD1-CG 4.01Å; Q2789-Q2791 HydrophobicContact CG-CG 4.23Å; Q2791-L2802 CarbonylContact O-C 3.56Å; Q2791-L2802 WeakPolarHBondContact O-CA 3.29Å; Q2791-H2803 HydrophobicContact CB-CB 4.22Å; Q2791-H2803 PolarHBondContact N-O 3.15Å; Q2791-H2803 PolarHBondContact O-N 2.82Å; Q2791-F2852 PolarHBondContact NE2-O 2.93Å; Q2791-N2854 VanDerWaalsContact CD-ND2 3.3Å; Q2791-N2854 PolarHBondContact NE2-ND2 3.01Å; Q2791-N2854 PolarHBondContact NE2-OD1 3.06Å; Q2791-N2854 PolarHBondContact OE1-ND2 3.07Å; Q2791-N2854 PolarHBondContact OE1-OD1 2.98Å
2792	R	89	Confident	87.5	Confident	22.6 Å²	22.6	40.7 Å²	40.7	9%	0.085	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	129.3	-178.5	-62.7	-178.5	-172.4	96.9	-4.6	109.2	I2771 L2772 A2774 P2775 V2777 F2794 L2799 S2801 L2802 E3124	I2771-R2792 PolarHBondContact O-NH1 2.87Å; I2771-R2792 PolarHBondContact O-NH2 3.45Å; L2772-R2792 VanDerWaalsContact O-CZ 3.25Å; L2772-R2792 PolarHBondContact O-NE 3.15Å; L2772-R2792 PolarHBondContact O-NH2 3.13Å; A2774-R2792 WeakPolarHBondContact O-CD 3.36Å; A2774-R2792 PolarHBondContact O-NH1 2.9Å; P2775-R2792 WeakPolarHBondContact CA-O 3.23Å; P2775-R2792 PolarHBondContact O-N 3.09Å; V2777-R2792 VanDerWaalsContact CG2-NH1 3.34Å; R2792-F2794 HydrophobicContact CB-CD2 4.26Å; R2792-F2794 HydrophobicContact CB-CE2 3.5Å; R2792-F2794 VanDerWaalsContact CB-CE2 3.48Å; R2792-F2794 HydrophobicContact CB-CZ 3.82Å; R2792-F2794 HydrophobicContact CG-CZ 4.45Å; R2792-L2799 HydrophobicContact CB-CD1 3.71Å; R2792-L2799 HydrophobicContact CG-CD1 3.96Å; R2792-S2801 WeakPolarHBondContact CA-O 3.22Å; R2792-L2802 HydrophobicContact CG-CD1 3.78Å; R2792-E3124 IonicContact NH2-OE1 3.05Å; R2792-E3124 PolarHBondContact NH2-OE1 2.92Å
2793	I	87.8	Confident	87.7	Confident	70.8 Å²	70.8	36.5 Å²	36.5	36%	0.363	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	126.8	171.9	-56.5	178.8	0	0	0	106.7	Q2800 S2801	I2793-Q2800 HydrophobicContact CG2-CB 4.5Å; I2793-Q2800 WeakPolarHBondContact O-CA 3.38Å; I2793-Q2800 VanDerWaalsContact O-CB 3.32Å; I2793-Q2800 WeakPolarHBondContact O-CB 3.33Å; I2793-Q2800 PolarHBondContact O-N 3.11Å; I2793-S2801 WeakPolarHBondContact CB-OG 3.34Å; I2793-S2801 WeakPolarHBondContact CD1-OG 3.27Å; I2793-S2801 PolarHBondContact N-O 3.09Å; I2793-S2801 PolarHBondContact O-N 3.02Å; I2793-S2801 VanDerWaalsContact O-N 3.14Å
2794	F	83.7	Confident	88.1	Confident	54.6 Å²	54.6	33.7 Å²	33.7	24%	0.239	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	144.4	-178.7	-63.3	-89	0	0	0	110.8	N2357 T2773 P2775 R2792 L2798 L2799	N2357-F2794 PolarHBondContact ND2-O 3.38Å; N2357-F2794 VanDerWaalsContact ND2-O 3.12Å; T2773-F2794 VanDerWaalsContact O-CE2 3.3Å; T2773-F2794 WeakPolarHBondContact O-CE2 3.37Å; T2773-F2794 WeakPolarHBondContact O-CZ 3.32Å; P2775-F2794 HydrophobicContact CG-CD2 4.44Å; P2775-F2794 HydrophobicContact CG-CE2 4.31Å; R2792-F2794 HydrophobicContact CB-CD2 4.26Å; R2792-F2794 HydrophobicContact CB-CE2 3.5Å; R2792-F2794 VanDerWaalsContact CB-CE2 3.48Å; R2792-F2794 HydrophobicContact CB-CZ 3.82Å; R2792-F2794 HydrophobicContact CG-CZ 4.45Å; F2794-L2798 CarbonylContact C-O 3.55Å; F2794-L2798 VanDerWaalsContact CA-O 3.23Å; F2794-L2798 WeakPolarHBondContact CA-O 3.38Å; F2794-L2799 HydrophobicContact CD1-CB 4.25Å; F2794-L2799 HydrophobicContact CD1-CD1 4.2Å; F2794-L2799 HydrophobicContact CE1-CB 4.1Å; F2794-L2799 HydrophobicContact CE1-CD1 3.83Å; F2794-L2799 HydrophobicContact CE1-CG 4.5Å; F2794-L2799 HydrophobicContact CE2-CD1 4.48Å; F2794-L2799 HydrophobicContact CZ-CD1 4.05Å
2795	Q	81.4	Confident	88.4	Confident	65.6 Å²	65.6	32.2 Å²	32.2	31%	0.307	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	105.4	164.1	-173.8	-176.6	-14.9	0	0	107.4	I2385 P2386 S2797 L2798 Q2800	I2385-Q2795 HydrophobicContact CG2-CG 3.87Å; P2386-Q2795 PolarHBondContact O-NE2 2.98Å; Q2795-S2797 PolarHBondContact O-N 3.34Å; Q2795-S2797 VanDerWaalsContact O-N 3.11Å; Q2795-L2798 PolarHBondContact N-O 3.27Å; Q2795-L2798 WeakPolarHBondContact O-CB 3.5Å; Q2795-L2798 PolarHBondContact O-N 3.04Å; Q2795-L2798 VanDerWaalsContact O-N 3.15Å; Q2795-Q2800 HydrophobicContact CB-CB 4.43Å
2796	G	77.3	Confident	88.6	Confident	35.4 Å²	35.4	31.8 Å²	31.8	37%	0.365	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	-119.2	-162.7	0	0	0	0	0	110.8	N2357 W2359	N2357-G2796 PolarHBondContact ND2-N 3.39Å; N2357-G2796 PolarHBondContact OD1-N 2.99Å; W2359-G2796 VanDerWaalsContact CD1-CA 3.47Å
2797	S	77.1	Confident	88.5	Confident	55 Å²	55	34 Å²	34	39%	0.385	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-5.9	175.5	59	0	0	0	0	114.5	Q2795 G3389 V3391	Q2795-S2797 PolarHBondContact O-N 3.34Å; Q2795-S2797 VanDerWaalsContact O-N 3.11Å; S2797-G3389 WeakPolarHBondContact CB-O 3.32Å; S2797-G3389 PolarHBondContact OG-O 3.31Å; S2797-V3391 WeakPolarHBondContact OG-CG2 3.47Å
2798	L	83.5	Confident	88.2	Confident	21.6 Å²	21.6	28.9 Å²	28.9	11%	0.113	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	134.8	-179.8	-65.4	-179.5	0	0	0	110.7	I2385 I2394 F2794 Q2795 Q2800 Y2830 M2834 V3391	I2385-L2798 HydrophobicContact CD1-CD1 3.66Å; I2385-L2798 HydrophobicContact CD1-CG 3.85Å; I2394-L2798 HydrophobicContact CD1-CD1 4.3Å; F2794-L2798 CarbonylContact C-O 3.55Å; F2794-L2798 VanDerWaalsContact CA-O 3.23Å; F2794-L2798 WeakPolarHBondContact CA-O 3.38Å; Q2795-L2798 PolarHBondContact N-O 3.27Å; Q2795-L2798 WeakPolarHBondContact O-CB 3.5Å; Q2795-L2798 PolarHBondContact O-N 3.04Å; Q2795-L2798 VanDerWaalsContact O-N 3.15Å; L2798-Q2800 PolarHBondContact O-N 3.13Å; L2798-Y2830 HydrophobicContact CB-CD2 4.33Å; L2798-Y2830 HydrophobicContact CB-CE2 3.9Å; L2798-Y2830 HydrophobicContact CD1-CD1 4.22Å; L2798-Y2830 HydrophobicContact CD1-CD2 4.02Å; L2798-Y2830 HydrophobicContact CD1-CE1 4.41Å; L2798-Y2830 HydrophobicContact CD1-CE2 4.16Å; L2798-Y2830 HydrophobicContact CD1-CG 3.94Å; L2798-Y2830 HydrophobicContact CD2-CD1 4.27Å; L2798-Y2830 HydrophobicContact CD2-CE1 3.98Å; L2798-Y2830 HydrophobicContact CG-CE1 4.49Å; L2798-Y2830 HydrophobicContact CG-CE2 4.46Å; L2798-M2834 HydrophobicContact CD1-CB 4.1Å; L2798-M2834 HydrophobicContact CD1-CE 3.23Å; L2798-M2834 HydrophobicContact CD1-CG 3.99Å; L2798-M2834 HydrophobicContact CD1-SD 3.92Å; L2798-M2834 WeakPolarHBondContact CD1-SD 3.21Å; L2798-M2834 HydrophobicContact CD2-CB 4.29Å; L2798-M2834 HydrophobicContact CD2-CE 3.9Å; L2798-M2834 HydrophobicContact CG-CE 3.52Å; L2798-M2834 VanDerWaalsContact CG-CE 3.44Å; L2798-M2834 HydrophobicContact CG-SD 4.29Å; L2798-V3391 HydrophobicContact CD2-CG2 3.75Å
2799	L	87.5	Confident	87.6	Confident	23.8 Å²	23.8	31.7 Å²	31.7	13%	0.125	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	111.5	175.3	-178.8	64.9	0	0	0	109.1	R2792 F2794 S2801 L2802 Y2828 Y2830 P3147	R2792-L2799 HydrophobicContact CB-CD1 3.71Å; R2792-L2799 HydrophobicContact CG-CD1 3.96Å; F2794-L2799 HydrophobicContact CD1-CB 4.25Å; F2794-L2799 HydrophobicContact CD1-CD1 4.2Å; F2794-L2799 HydrophobicContact CE1-CB 4.1Å; F2794-L2799 HydrophobicContact CE1-CD1 3.83Å; F2794-L2799 HydrophobicContact CE1-CG 4.5Å; F2794-L2799 HydrophobicContact CE2-CD1 4.48Å; F2794-L2799 HydrophobicContact CZ-CD1 4.05Å; L2799-S2801 WeakPolarHBondContact CD1-O 3.17Å; L2799-L2802 HydrophobicContact CD2-CB 4.41Å; L2799-Y2828 HydrophobicContact CB-CD2 4.37Å; L2799-Y2828 HydrophobicContact CD2-CD2 4Å; L2799-Y2828 HydrophobicContact CD2-CE2 3.39Å; L2799-Y2828 VanDerWaalsContact CD2-CE2 3.41Å; L2799-Y2828 HydrophobicContact CG-CD2 3.77Å; L2799-Y2828 HydrophobicContact CG-CE2 3.64Å; L2799-Y2828 VanDerWaalsContact O-CB 3.28Å; L2799-Y2828 WeakPolarHBondContact O-CB 3.26Å; L2799-Y2828 VanDerWaalsContact O-CD2 3.26Å; L2799-Y2828 WeakPolarHBondContact O-CD2 3.39Å; L2799-Y2830 PolarHBondContact N-OH 3.09Å; L2799-Y2830 VanDerWaalsContact O-CE2 3.3Å; L2799-Y2830 WeakPolarHBondContact O-CE2 3.41Å; L2799-Y2830 PolarHBondContact O-OH 3.04Å; L2799-Y2830 VanDerWaalsContact O-OH 3.05Å; L2799-P3147 HydrophobicContact CD2-CB 4.42Å
2800	Q	89.5	Confident	86.6	Confident	62.8 Å²	62.8	33.3 Å²	33.3	29%	0.293	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	-43	-179.9	-172.8	-174.9	10.9	0	0	111.4	I2793 Q2795 L2798 T2827 Y2828	I2793-Q2800 HydrophobicContact CG2-CB 4.5Å; I2793-Q2800 WeakPolarHBondContact O-CA 3.38Å; I2793-Q2800 VanDerWaalsContact O-CB 3.32Å; I2793-Q2800 WeakPolarHBondContact O-CB 3.33Å; I2793-Q2800 PolarHBondContact O-N 3.11Å; Q2795-Q2800 HydrophobicContact CB-CB 4.43Å; L2798-Q2800 PolarHBondContact O-N 3.13Å; Q2800-T2827 WeakPolarHBondContact O-CA 3.24Å; Q2800-Y2828 PolarHBondContact O-N 3.01Å
2801	S	92.5	Very high	85.6	Confident	13.5 Å²	13.5	33.1 Å²	33.1	9%	0.094	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	148.9	175.6	67.5	0	0	0	0	112.6	R2792 I2793 L2799 F2826	R2792-S2801 WeakPolarHBondContact CA-O 3.22Å; I2793-S2801 WeakPolarHBondContact CB-OG 3.34Å; I2793-S2801 WeakPolarHBondContact CD1-OG 3.27Å; I2793-S2801 PolarHBondContact N-O 3.09Å; I2793-S2801 PolarHBondContact O-N 3.02Å; I2793-S2801 VanDerWaalsContact O-N 3.14Å; L2799-S2801 WeakPolarHBondContact CD1-O 3.17Å; S2801-F2826 CarbonylContact C-O 3.54Å; S2801-F2826 WeakPolarHBondContact CA-O 3.27Å; S2801-F2826 VanDerWaalsContact CB-O 3.27Å; S2801-F2826 WeakPolarHBondContact CB-O 3.16Å
2802	L	93.7	Very high	84.3	Confident	10.75 Å²	10.75	36.5 Å²	36.5	6%	0.056	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	118	172.6	169.7	62.1	0	0	0	108.6	Y2790 Q2791 R2792 L2799 I2804 K2825 F2826 Y2828	Y2790-L2802 HydrophobicContact CD1-CD1 4.34Å; Y2790-L2802 HydrophobicContact CG-CD1 4.32Å; Q2791-L2802 CarbonylContact O-C 3.56Å; Q2791-L2802 WeakPolarHBondContact O-CA 3.29Å; R2792-L2802 HydrophobicContact CG-CD1 3.78Å; L2799-L2802 HydrophobicContact CD2-CB 4.41Å; L2802-I2804 HydrophobicContact CD1-CD1 4.49Å; L2802-I2804 HydrophobicContact CD1-CG1 4.14Å; L2802-I2804 HydrophobicContact CD2-CD1 4.04Å; L2802-I2804 HydrophobicContact CD2-CG1 4.27Å; L2802-I2804 HydrophobicContact CG-CD1 4.21Å; L2802-I2804 HydrophobicContact CG-CG1 3.89Å; L2802-K2825 CarbonylContact O-C 3.54Å; L2802-K2825 WeakPolarHBondContact O-CA 3.37Å; L2802-F2826 HydrophobicContact CB-CB 4.47Å; L2802-F2826 HydrophobicContact CB-CD2 4.42Å; L2802-F2826 HydrophobicContact CD2-CD2 4.11Å; L2802-F2826 HydrophobicContact CG-CD2 4.33Å; L2802-F2826 PolarHBondContact N-O 3.3Å; L2802-F2826 PolarHBondContact O-N 2.9Å; L2802-Y2828 HydrophobicContact CB-CE2 4.11Å
2803	H	93.7	Very high	82.7	Confident	7.75 Å²	7.75	41 Å²	41	4%	0.036	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	129.5	173.6	-161.3	136.5	0	0	0	109.1	Y2790 Q2791 N2805 F2844 R2846 G2853 N2854	Y2790-H2803 CarbonylContact C-O 3.5Å; Y2790-H2803 WeakPolarHBondContact CA-O 3.18Å; Q2791-H2803 HydrophobicContact CB-CB 4.22Å; Q2791-H2803 PolarHBondContact N-O 3.15Å; Q2791-H2803 PolarHBondContact O-N 2.82Å; H2803-N2805 PolarHBondContact CD2-ND2 2.97Å; H2803-N2805 PolarHBondContact CD2-OD1 3.42Å; H2803-N2805 VanDerWaalsContact CD2-OD1 3.3Å; H2803-N2805 PolarHBondContact NE2-OD1 3.37Å; H2803-N2805 VanDerWaalsContact NE2-OD1 3.12Å; H2803-F2844 AromaticContact CE1-CE1 3.93Å; H2803-F2844 AromaticContact CE1-CZ 3.43Å; H2803-F2844 VanDerWaalsContact CE1-CZ 3.43Å; H2803-F2844 WeakPolarHBondContact CE1-CZ 3.43Å; H2803-F2844 AromaticContact NE2-CZ 3.45Å; H2803-F2844 VanDerWaalsContact NE2-CZ 3.35Å; H2803-F2844 WeakPolarHBondContact NE2-CZ 3.37Å; H2803-R2846 PolarHBondContact CE1-NH2 3.32Å; H2803-R2846 VanDerWaalsContact CE1-NH2 3.3Å; H2803-R2846 PolarHBondContact NE2-NH2 3.02Å; H2803-R2846 VanDerWaalsContact NE2-NH2 3.12Å; H2803-G2853 PolarHBondContact CE1-O 2.85Å; H2803-N2854 VanDerWaalsContact CE1-C 3.45Å; H2803-N2854 PolarHBondContact CE1-O 2.79Å; H2803-N2854 VanDerWaalsContact CE1-O 3.24Å; H2803-N2854 PolarHBondContact ND1-O 3.22Å
2804	I	94	Very high	81	Confident	5.75 Å²	5.75	38.6 Å²	38.6	3%	0.029	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	116.1	-176	-55.9	-176	0	0	0	108.7	L2788 Q2789 Y2790 L2802 H2806 N2823 A2824 F2826	L2788-I2804 HydrophobicContact CD1-CG2 3.95Å; Q2789-I2804 WeakPolarHBondContact O-CA 3.39Å; Y2790-I2804 HydrophobicContact CD1-CB 4.09Å; Y2790-I2804 HydrophobicContact CD1-CD1 4.2Å; Y2790-I2804 HydrophobicContact CD1-CG1 3.65Å; Y2790-I2804 HydrophobicContact CD1-CG2 3.88Å; Y2790-I2804 HydrophobicContact CE1-CB 4.08Å; Y2790-I2804 HydrophobicContact CE1-CD1 3.68Å; Y2790-I2804 HydrophobicContact CE1-CG1 3.63Å; Y2790-I2804 HydrophobicContact CE1-CG2 3.53Å; Y2790-I2804 VanDerWaalsContact CE1-CG2 3.49Å; L2802-I2804 HydrophobicContact CD1-CD1 4.49Å; L2802-I2804 HydrophobicContact CD1-CG1 4.14Å; L2802-I2804 HydrophobicContact CD2-CD1 4.04Å; L2802-I2804 HydrophobicContact CD2-CG1 4.27Å; L2802-I2804 HydrophobicContact CG-CD1 4.21Å; L2802-I2804 HydrophobicContact CG-CG1 3.89Å; I2804-H2806 WeakPolarHBondContact CG2-CD2 3.32Å; I2804-H2806 VanDerWaalsContact CG2-CE1 3.45Å; I2804-H2806 WeakPolarHBondContact CG2-CE1 3.23Å; I2804-H2806 WeakPolarHBondContact CG2-NE2 3.38Å; I2804-N2823 WeakPolarHBondContact O-CA 3.44Å; I2804-N2823 WeakPolarHBondContact O-CB 3.41Å; I2804-A2824 HydrophobicContact CB-CB 4.21Å; I2804-A2824 HydrophobicContact CD1-CB 4.38Å; I2804-A2824 HydrophobicContact CG1-CB 4.5Å; I2804-A2824 PolarHBondContact N-O 2.99Å; I2804-A2824 PolarHBondContact O-N 3.02Å; I2804-F2826 HydrophobicContact CD1-CD2 4.28Å; I2804-F2826 HydrophobicContact CD1-CE2 3.74Å
2805	N	91.5	Very high	79.7	Confident	2.75 Å²	2.75	37.4 Å²	37.4	2%	0.015	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	128.4	176.1	-68.3	-42.3	0	0	0	110.2	L2788 Q2789 H2803 N2823 R2846 F2852	L2788-N2805 CarbonylContact C-O 3.54Å; L2788-N2805 WeakPolarHBondContact CA-O 3.32Å; Q2789-N2805 HydrophobicContact CB-CB 4.39Å; Q2789-N2805 PolarHBondContact N-O 3.16Å; Q2789-N2805 PolarHBondContact O-N 3.08Å; H2803-N2805 PolarHBondContact CD2-ND2 2.97Å; H2803-N2805 PolarHBondContact CD2-OD1 3.42Å; H2803-N2805 VanDerWaalsContact CD2-OD1 3.3Å; H2803-N2805 PolarHBondContact NE2-OD1 3.37Å; H2803-N2805 VanDerWaalsContact NE2-OD1 3.12Å; N2805-N2823 VanDerWaalsContact CA-OD1 3.29Å; N2805-N2823 WeakPolarHBondContact CA-OD1 3.19Å; N2805-R2846 PolarHBondContact ND2-NH1 3.05Å; N2805-R2846 PolarHBondContact ND2-NH2 2.98Å; N2805-R2846 VanDerWaalsContact OD1-CZ 3.32Å; N2805-R2846 PolarHBondContact OD1-NE 2.9Å; N2805-R2846 VanDerWaalsContact OD1-NE 3.12Å; N2805-R2846 PolarHBondContact OD1-NH2 2.86Å; N2805-R2846 VanDerWaalsContact OD1-NH2 3.08Å; N2805-F2852 HydrophobicContact CB-CD1 3.55Å; N2805-F2852 HydrophobicContact CB-CE1 3.71Å; N2805-F2852 PolarHBondContact ND2-O 2.77Å
2806	H	89	Confident	78.4	Confident	18.25 Å²	18.25	39.3 Å²	39.3	8%	0.084	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	143.1	-178.6	-61.1	162.2	0	0	0	110.4	R2787 L2788 I2804 I2821 L2822 N2823	R2787-H2806 CarbonylContact O-C 3.54Å; L2788-H2806 WeakPolarHBondContact CD1-CD2 3.38Å; L2788-H2806 WeakPolarHBondContact CD1-NE2 3.34Å; I2804-H2806 WeakPolarHBondContact CG2-CD2 3.32Å; I2804-H2806 VanDerWaalsContact CG2-CE1 3.45Å; I2804-H2806 WeakPolarHBondContact CG2-CE1 3.23Å; I2804-H2806 WeakPolarHBondContact CG2-NE2 3.38Å; H2806-I2821 HydrophobicContact CB-CD1 3.31Å; H2806-I2821 HydrophobicContact CB-CG1 4.08Å; H2806-I2821 HydrophobicContact CB-CG2 3.32Å; H2806-L2822 PolarHBondContact ND1-O 2.95Å; H2806-N2823 PolarHBondContact N-OD1 2.98Å; H2806-N2823 PolarHBondContact O-OD1 3.17Å
2807	R	86.6	Confident	77.4	Confident	58.5 Å²	58.5	41 Å²	41	22%	0.221	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	125.4	167.5	-174.2	178	-175.2	169	1.2	109.5	F2786 R2787 E2849 D2850 F2852	F2786-R2807 CarbonylContact C-O 3.55Å; F2786-R2807 VanDerWaalsContact CA-O 3.31Å; F2786-R2807 WeakPolarHBondContact CA-O 3.22Å; F2786-R2807 VanDerWaalsContact CD2-O 3.25Å; F2786-R2807 WeakPolarHBondContact CD2-O 3.37Å; R2787-R2807 HydrophobicContact CB-CB 4.29Å; R2787-R2807 PolarHBondContact N-O 2.94Å; R2787-R2807 PolarHBondContact O-N 3.08Å; R2807-E2849 IonicContact CZ-OE2 3.39Å; R2807-E2849 VanDerWaalsContact CZ-OE2 3.28Å; R2807-E2849 IonicContact NE-OE2 2.92Å; R2807-E2849 PolarHBondContact NE-OE2 3.09Å; R2807-E2849 PolarHBondContact NH1-O 2.89Å; R2807-E2849 IonicContact NH2-OE2 3.43Å; R2807-E2849 PolarHBondContact NH2-OE2 3.06Å; R2807-E2849 VanDerWaalsContact NH2-OE2 3.08Å; R2807-D2850 IonicContact CZ-OD1 3.07Å; R2807-D2850 IonicContact NH1-OD1 3.36Å; R2807-D2850 PolarHBondContact NH1-OD1 3.1Å; R2807-D2850 IonicContact NH2-OD1 3.18Å; R2807-F2852 HydrophobicContact CB-CZ 4.37Å
2808	L	85.7	Confident	76.6	Confident	11 Å²	11	38.9 Å²	38.9	6%	0.058	23%	0.225	C	C	.	.			trans	-134	119.6	171.6	-172.9	64.6	0	0	0	109.1	F2786 V2811 I2821 I3120 I3129	F2786-L2808 HydrophobicContact CB-CD1 3.77Å; F2786-L2808 HydrophobicContact CD2-CB 4.14Å; F2786-L2808 HydrophobicContact CD2-CD1 3.91Å; F2786-L2808 HydrophobicContact CG-CD1 4.24Å; L2808-V2811 HydrophobicContact CB-CG2 3.86Å; L2808-V2811 HydrophobicContact CD2-CG2 3.67Å; L2808-V2811 HydrophobicContact CG-CG2 3.86Å; L2808-V2811 WeakPolarHBondContact O-CG2 3.35Å; L2808-I2821 HydrophobicContact CB-CD1 3.34Å; L2808-I2821 HydrophobicContact CB-CG1 4.41Å; L2808-I2821 HydrophobicContact CB-CG2 4.46Å; L2808-I2821 HydrophobicContact CD2-CD1 3.81Å; L2808-I2821 HydrophobicContact CG-CD1 4.15Å; L2808-I3120 HydrophobicContact CD1-CD1 3.82Å; L2808-I3120 HydrophobicContact CD2-CD1 3.35Å; L2808-I3120 HydrophobicContact CG-CD1 4.23Å; L2808-I3129 HydrophobicContact CD2-CD1 4.4Å
2809	P	79.9	Confident	75.4	Confident	64.5 Å²	64.5	39.1 Å²	39.1	42%	0.419	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	146.4	175.9	-25.8	35.1	0	0	0	112.8	G2785 V2811	G2785-P2809 WeakPolarHBondContact O-CD 3.3Å; P2809-V2811 VanDerWaalsContact C-N 3.31Å; P2809-V2811 PolarHBondContact O-N 3.05Å
2810	G	73.1	Confident	74.8	Confident	52.5 Å²	52.5	38.4 Å²	38.4	54%	0.541	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.6	1.9	174.7	0	0	0	0	0	116.1	T2813	G2810-T2813 PolarHBondContact O-OG1 3.11Å
2811	V	71.2	Confident	74.6	Confident	14 Å²	14	36.1 Å²	36.1	9%	0.085	22%	0.22	C	C	.	.	S	Bend	trans	-85.6	-23.6	179.4	-171	0	0	0	0	113.2	L2808 P2809 T2813 A2814 I2821 R3131	L2808-V2811 HydrophobicContact CB-CG2 3.86Å; L2808-V2811 HydrophobicContact CD2-CG2 3.67Å; L2808-V2811 HydrophobicContact CG-CG2 3.86Å; L2808-V2811 WeakPolarHBondContact O-CG2 3.35Å; P2809-V2811 VanDerWaalsContact C-N 3.31Å; P2809-V2811 PolarHBondContact O-N 3.05Å; V2811-T2813 VanDerWaalsContact C-N 3.33Å; V2811-T2813 PolarHBondContact O-N 3Å; V2811-T2813 VanDerWaalsContact O-N 3.15Å; V2811-A2814 HydrophobicContact CG1-CB 4.16Å; V2811-A2814 VanDerWaalsContact O-CB 3.27Å; V2811-A2814 WeakPolarHBondContact O-CB 3.28Å; V2811-A2814 PolarHBondContact O-N 3.07Å; V2811-A2814 VanDerWaalsContact O-N 3.13Å; V2811-I2821 HydrophobicContact CB-CD1 4.5Å; V2811-I2821 HydrophobicContact CB-CG1 4.13Å; V2811-I2821 HydrophobicContact CB-CG2 4.03Å; V2811-I2821 HydrophobicContact CG1-CG1 3.82Å; V2811-I2821 HydrophobicContact CG1-CG2 3.66Å; V2811-I2821 HydrophobicContact CG2-CD1 4.02Å; V2811-I2821 HydrophobicContact CG2-CG1 4.02Å; V2811-I2821 HydrophobicContact CG2-CG2 3.88Å; V2811-R3131 VanDerWaalsContact CG2-NH1 3.34Å
2812	K	63.3	Low	74.4	Confident	94.25 Å²	94.25	35.5 Å²	35.5	41%	0.41	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-31.8	177.4	-72.5	-166.9	163.2	172.1	0	113.1	A2814 G2819 R2846 N2847 E2849	K2812-A2814 VanDerWaalsContact C-N 3.33Å; K2812-A2814 PolarHBondContact O-N 2.97Å; K2812-G2819 WeakPolarHBondContact CD-O 3.5Å; K2812-G2819 WeakPolarHBondContact CE-O 3.32Å; K2812-G2819 VanDerWaalsContact CG-O 3.25Å; K2812-G2819 WeakPolarHBondContact CG-O 3.4Å; K2812-R2846 PolarHBondContact NZ-O 3.4Å; K2812-N2847 PolarHBondContact NZ-O 3.31Å; K2812-E2849 HydrophobicContact CD-CG 4.19Å; K2812-E2849 VanDerWaalsContact CD-OE1 3.28Å; K2812-E2849 WeakPolarHBondContact CD-OE1 3.29Å; K2812-E2849 WeakPolarHBondContact CE-OE1 3.33Å; K2812-E2849 VanDerWaalsContact CG-OE1 3.25Å; K2812-E2849 WeakPolarHBondContact CG-OE1 3.47Å; K2812-E2849 IonicContact NZ-OE1 3.16Å; K2812-E2849 PolarHBondContact NZ-OE1 3.24Å
2813	T	54.6	Low	74.4	Confident	118.5 Å²	118.5	35.4 Å²	35.4	73%	0.727	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-10.5	177.9	49.4	0	0	0	0	113.5	G2810 V2811 H2815	G2810-T2813 PolarHBondContact O-OG1 3.11Å; V2811-T2813 VanDerWaalsContact C-N 3.33Å; V2811-T2813 PolarHBondContact O-N 3Å; V2811-T2813 VanDerWaalsContact O-N 3.15Å; T2813-H2815 VanDerWaalsContact C-N 3.35Å; T2813-H2815 PolarHBondContact O-N 3.14Å
2814	A	53	Low	74.4	Confident	19.75 Å²	19.75	35 Å²	35	16%	0.163	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-38.9	-174.4	0	0	0	0	0	113.2	V2811 K2812 V3136	V2811-A2814 HydrophobicContact CG1-CB 4.16Å; V2811-A2814 VanDerWaalsContact O-CB 3.27Å; V2811-A2814 WeakPolarHBondContact O-CB 3.28Å; V2811-A2814 PolarHBondContact O-N 3.07Å; V2811-A2814 VanDerWaalsContact O-N 3.13Å; K2812-A2814 VanDerWaalsContact C-N 3.33Å; K2812-A2814 PolarHBondContact O-N 2.97Å; A2814-V3136 HydrophobicContact CB-CB 4.42Å; A2814-V3136 HydrophobicContact CB-CG1 3.22Å; A2814-V3136 VanDerWaalsContact CB-CG1 3.42Å; A2814-V3136 VanDerWaalsContact O-CG1 3.28Å; A2814-V3136 WeakPolarHBondContact O-CG1 3.3Å
2815	H	55.7	Low	74.5	Confident	29.5 Å²	29.5	37.9 Å²	37.9	14%	0.137	23%	0.226	C	C	.	.			trans	-141.6	109.9	177.6	-155.3	-78.3	0	0	0	110.7	T2813 N2817 L2818 G2819	T2813-H2815 VanDerWaalsContact C-N 3.35Å; T2813-H2815 PolarHBondContact O-N 3.14Å; H2815-N2817 PolarHBondContact ND1-N 3.02Å; H2815-N2817 PolarHBondContact O-N 3.12Å; H2815-N2817 VanDerWaalsContact O-N 3.09Å; H2815-L2818 HydrophobicContact CB-CB 4.29Å; H2815-L2818 PolarHBondContact ND1-N 3.04Å; H2815-L2818 PolarHBondContact O-N 3.22Å; H2815-L2818 VanDerWaalsContact O-N 3.1Å; H2815-G2819 PolarHBondContact O-N 3.04Å
2816	P	53.5	Low	74.7	Confident	104.75 Å²	104.75	37.7 Å²	37.7	68%	0.68	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-25.5	-171.1	21.2	-31.8	0	0	0	114
2817	N	56.2	Low	75	Confident	71.5 Å²	71.5	38.8 Å²	38.8	38%	0.382	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-15.6	-175.2	-58.5	-12.7	0	0	0	114.5	H2815 K2861 N3188	H2815-N2817 PolarHBondContact ND1-N 3.02Å; H2815-N2817 PolarHBondContact O-N 3.12Å; H2815-N2817 VanDerWaalsContact O-N 3.09Å; N2817-K2861 PolarHBondContact O-NZ 3Å; N2817-K2861 VanDerWaalsContact O-NZ 3.15Å; N2817-N3188 PolarHBondContact ND2-OD1 3.31Å; N2817-N3188 VanDerWaalsContact ND2-OD1 3.15Å
2818	L	60.6	Low	75.4	Confident	11.75 Å²	11.75	36.5 Å²	36.5	6%	0.062	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.3	-25.1	-179.9	-79.9	154	0	0	0	111.9	H2815 G2820 I2845 K2861 V2863 F3157 H3159 L3162 L3187	H2815-L2818 HydrophobicContact CB-CB 4.29Å; H2815-L2818 PolarHBondContact ND1-N 3.04Å; H2815-L2818 PolarHBondContact O-N 3.22Å; H2815-L2818 VanDerWaalsContact O-N 3.1Å; L2818-G2820 PolarHBondContact O-N 3.08Å; L2818-I2845 HydrophobicContact CB-CD1 3.95Å; L2818-I2845 HydrophobicContact CD2-CD1 3.77Å; L2818-I2845 VanDerWaalsContact CD2-CD1 3.47Å; L2818-I2845 HydrophobicContact CG-CD1 4.24Å; L2818-I2845 WeakPolarHBondContact O-CD1 3.41Å; L2818-K2861 HydrophobicContact CD2-CD 4.47Å; L2818-V2863 HydrophobicContact CD2-CG2 4.06Å; L2818-F3157 HydrophobicContact CD1-CE1 3.96Å; L2818-F3157 HydrophobicContact CD1-CZ 4Å; L2818-F3157 HydrophobicContact CD2-CE1 4.36Å; L2818-F3157 HydrophobicContact CD2-CZ 3.98Å; L2818-H3159 HydrophobicContact CD1-CB 4.2Å; L2818-L3162 HydrophobicContact CB-CD2 4.07Å; L2818-L3162 HydrophobicContact CD1-CD1 3.19Å; L2818-L3162 HydrophobicContact CD1-CD2 3.31Å; L2818-L3162 HydrophobicContact CD1-CG 4Å; L2818-L3162 HydrophobicContact CD2-CD1 3.84Å; L2818-L3162 HydrophobicContact CD2-CD2 3.87Å; L2818-L3162 HydrophobicContact CD2-CG 4.35Å; L2818-L3162 HydrophobicContact CG-CD1 4.05Å; L2818-L3162 HydrophobicContact CG-CD2 3.59Å; L2818-L3162 VanDerWaalsContact CG-CD2 3.48Å; L2818-L3187 HydrophobicContact CD2-CB 4.05Å; L2818-L3187 HydrophobicContact CD2-CD1 4.12Å
2819	G	59.2	Low	75.8	Confident	25.75 Å²	25.75	36.6 Å²	36.6	27%	0.265	23%	0.228	S	C	.	.			trans	72.1	14.7	159.8	0	0	0	0	0	116.4	K2812 H2815	K2812-G2819 WeakPolarHBondContact CD-O 3.5Å; K2812-G2819 WeakPolarHBondContact CE-O 3.32Å; K2812-G2819 VanDerWaalsContact CG-O 3.25Å; K2812-G2819 WeakPolarHBondContact CG-O 3.4Å; H2815-G2819 PolarHBondContact O-N 3.04Å
2820	G	74.1	Confident	76.3	Confident	8 Å²	8	36 Å²	36	8%	0.082	22%	0.218	C	C	.	.	S	Bend	trans	155.1	-168.4	172.5	0	0	0	0	0	116.1	L2818 H3159	L2818-G2820 PolarHBondContact O-N 3.08Å; G2820-H3159 PolarHBondContact O-CE1 3.13Å
2821	I	85.2	Confident	77	Confident	16 Å²	16	35.6 Å²	35.6	8%	0.082	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-77.4	147.2	169.7	-63	-176.7	0	0	0	110.1	H2806 L2808 V2811 I3129 Q3141	H2806-I2821 HydrophobicContact CB-CD1 3.31Å; H2806-I2821 HydrophobicContact CB-CG1 4.08Å; H2806-I2821 HydrophobicContact CB-CG2 3.32Å; L2808-I2821 HydrophobicContact CB-CD1 3.34Å; L2808-I2821 HydrophobicContact CB-CG1 4.41Å; L2808-I2821 HydrophobicContact CB-CG2 4.46Å; L2808-I2821 HydrophobicContact CD2-CD1 3.81Å; L2808-I2821 HydrophobicContact CG-CD1 4.15Å; V2811-I2821 HydrophobicContact CB-CD1 4.5Å; V2811-I2821 HydrophobicContact CB-CG1 4.13Å; V2811-I2821 HydrophobicContact CB-CG2 4.03Å; V2811-I2821 HydrophobicContact CG1-CG1 3.82Å; V2811-I2821 HydrophobicContact CG1-CG2 3.66Å; V2811-I2821 HydrophobicContact CG2-CD1 4.02Å; V2811-I2821 HydrophobicContact CG2-CG1 4.02Å; V2811-I2821 HydrophobicContact CG2-CG2 3.88Å; I2821-I3129 HydrophobicContact CD1-CD1 3.5Å; I2821-I3129 VanDerWaalsContact CD1-CD1 3.44Å; I2821-I3129 HydrophobicContact CG1-CD1 4.32Å; I2821-I3129 HydrophobicContact CG2-CD1 4.38Å; I2821-Q3141 VanDerWaalsContact CG2-NE2 3.29Å
2822	L	89.5	Confident	77.6	Confident	0.75 Å²	0.75	40.8 Å²	40.8	0%	0.004	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-81.3	139.4	174.7	-52.6	-173.7	0	0	0	111.6	H2806 L2843 I2845 V2863 Q3141 F3143 F3157	H2806-L2822 PolarHBondContact ND1-O 2.95Å; L2822-L2843 HydrophobicContact CD1-CB 4.16Å; L2822-L2843 HydrophobicContact CD1-CD1 4.2Å; L2822-I2845 HydrophobicContact CD2-CD1 3.82Å; L2822-I2845 HydrophobicContact CD2-CG1 3.44Å; L2822-I2845 VanDerWaalsContact CD2-CG1 3.45Å; L2822-V2863 HydrophobicContact CD1-CB 4.44Å; L2822-V2863 HydrophobicContact CD1-CG1 4.23Å; L2822-V2863 HydrophobicContact CD2-CB 4.27Å; L2822-V2863 HydrophobicContact CD2-CG1 4.41Å; L2822-V2863 HydrophobicContact CD2-CG2 3.73Å; L2822-Q3141 VanDerWaalsContact CB-OE1 3.3Å; L2822-Q3141 VanDerWaalsContact N-OE1 3.15Å; L2822-F3143 HydrophobicContact CB-CZ 4.1Å; L2822-F3157 HydrophobicContact CD1-CB 3.93Å; L2822-F3157 HydrophobicContact CD1-CD1 3.42Å; L2822-F3157 VanDerWaalsContact CD1-CD1 3.43Å; L2822-F3157 HydrophobicContact CD1-CD2 3.59Å; L2822-F3157 HydrophobicContact CD1-CE1 3.71Å; L2822-F3157 HydrophobicContact CD1-CE2 3.88Å; L2822-F3157 HydrophobicContact CD1-CG 3.34Å; L2822-F3157 HydrophobicContact CD1-CZ 3.94Å; L2822-F3157 HydrophobicContact CD2-CE1 4.25Å; L2822-F3157 HydrophobicContact CG-CD1 3.9Å; L2822-F3157 HydrophobicContact CG-CE1 4.02Å; L2822-F3157 HydrophobicContact CG-CG 4.3Å; L2822-F3157 HydrophobicContact CG-CZ 4.46Å
2823	N	92.4	Very high	78.5	Confident	7 Å²	7	37.6 Å²	37.6	4%	0.037	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	162.6	161.9	-61.3	-49.4	0	0	0	109.1	I2804 N2805 H2806 L2843 F2844 R2846	I2804-N2823 WeakPolarHBondContact O-CA 3.44Å; I2804-N2823 WeakPolarHBondContact O-CB 3.41Å; N2805-N2823 VanDerWaalsContact CA-OD1 3.29Å; N2805-N2823 WeakPolarHBondContact CA-OD1 3.19Å; H2806-N2823 PolarHBondContact N-OD1 2.98Å; H2806-N2823 PolarHBondContact O-OD1 3.17Å; N2823-L2843 WeakPolarHBondContact O-CA 3.31Å; N2823-F2844 HydrophobicContact CB-CD1 4.41Å; N2823-F2844 HydrophobicContact CB-CD2 4.12Å; N2823-F2844 HydrophobicContact CB-CE1 3.92Å; N2823-F2844 HydrophobicContact CB-CE2 3.61Å; N2823-F2844 HydrophobicContact CB-CG 4.48Å; N2823-F2844 HydrophobicContact CB-CZ 3.46Å; N2823-F2844 VanDerWaalsContact CB-CZ 3.46Å; N2823-F2844 PolarHBondContact N-O 3.32Å; N2823-F2844 PolarHBondContact O-N 2.93Å; N2823-F2844 VanDerWaalsContact O-N 3.08Å; N2823-R2846 WeakPolarHBondContact ND2-CB 3.34Å
2824	A	94.6	Very high	80	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	145.2	-179.5	0	0	0	0	0	112.1	I2804 F2826 S2842 L2843 F3143	I2804-A2824 HydrophobicContact CB-CB 4.21Å; I2804-A2824 HydrophobicContact CD1-CB 4.38Å; I2804-A2824 HydrophobicContact CG1-CB 4.5Å; I2804-A2824 PolarHBondContact N-O 2.99Å; I2804-A2824 PolarHBondContact O-N 3.02Å; A2824-F2826 HydrophobicContact CB-CE2 3.92Å; A2824-F2826 HydrophobicContact CB-CZ 3.93Å; A2824-S2842 CarbonylContact C-O 3.57Å; A2824-S2842 WeakPolarHBondContact CA-O 3.36Å; A2824-L2843 HydrophobicContact CB-CD2 3.6Å; A2824-F3143 HydrophobicContact CB-CD1 3.8Å; A2824-F3143 HydrophobicContact CB-CE1 3.81Å
2825	K	95.3	Very high	81.7	Confident	66 Å²	66	33.2 Å²	33.2	29%	0.287	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	123.7	167.7	-178.6	-177.8	177.2	-177.5	0	108.7	L2802 T2827 S2842 F2844 I2856	L2802-K2825 CarbonylContact O-C 3.54Å; L2802-K2825 WeakPolarHBondContact O-CA 3.37Å; K2825-T2827 HydrophobicContact CG-CG2 4.48Å; K2825-S2842 PolarHBondContact N-O 3.19Å; K2825-S2842 PolarHBondContact O-N 2.93Å; K2825-F2844 HydrophobicContact CB-CE1 4.21Å; K2825-I2856 HydrophobicContact CB-CD1 4.23Å; K2825-I2856 HydrophobicContact CD-CD1 3.81Å; K2825-I2856 HydrophobicContact CD-CG1 4.31Å
2826	F	96.3	Very high	83.4	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	132.4	172.5	-55.3	-68.8	0	0	0	109.3	S2801 L2802 I2804 A2824 Y2828 I2839 H2840 T2841 F3143 A3145	S2801-F2826 CarbonylContact C-O 3.54Å; S2801-F2826 WeakPolarHBondContact CA-O 3.27Å; S2801-F2826 VanDerWaalsContact CB-O 3.27Å; S2801-F2826 WeakPolarHBondContact CB-O 3.16Å; L2802-F2826 HydrophobicContact CB-CB 4.47Å; L2802-F2826 HydrophobicContact CB-CD2 4.42Å; L2802-F2826 HydrophobicContact CD2-CD2 4.11Å; L2802-F2826 HydrophobicContact CG-CD2 4.33Å; L2802-F2826 PolarHBondContact N-O 3.3Å; L2802-F2826 PolarHBondContact O-N 2.9Å; I2804-F2826 HydrophobicContact CD1-CD2 4.28Å; I2804-F2826 HydrophobicContact CD1-CE2 3.74Å; A2824-F2826 HydrophobicContact CB-CE2 3.92Å; A2824-F2826 HydrophobicContact CB-CZ 3.93Å; F2826-Y2828 HydrophobicContact CB-CE1 4.35Å; F2826-Y2828 HydrophobicContact CB-CE2 4.04Å; F2826-I2839 HydrophobicContact CB-CG2 4.26Å; F2826-I2839 HydrophobicContact CD1-CG2 4.26Å; F2826-H2840 CarbonylContact C-O 3.51Å; F2826-H2840 VanDerWaalsContact CA-O 3.32Å; F2826-H2840 WeakPolarHBondContact CA-O 3.18Å; F2826-T2841 HydrophobicContact CD1-CG2 3.97Å; F2826-T2841 HydrophobicContact CE1-CG2 3.5Å; F2826-T2841 VanDerWaalsContact CE1-CG2 3.47Å; F2826-T2841 HydrophobicContact CZ-CG2 4.46Å; F2826-F3143 HydrophobicContact CZ-CB 4.01Å; F2826-F3143 HydrophobicContact CZ-CD1 4.49Å; F2826-F3143 HydrophobicContact CZ-CG 4.48Å; F2826-A3145 HydrophobicContact CD1-CB 3.53Å; F2826-A3145 HydrophobicContact CD2-CB 4.37Å; F2826-A3145 HydrophobicContact CE1-CB 3.42Å; F2826-A3145 VanDerWaalsContact CE1-CB 3.42Å; F2826-A3145 HydrophobicContact CE2-CB 4.28Å; F2826-A3145 HydrophobicContact CG-CB 4.02Å; F2826-A3145 HydrophobicContact CZ-CB 3.84Å
2827	T	96	Very high	85.3	Confident	40.5 Å²	40.5	29.1 Å²	29.1	25%	0.248	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	131.8	172.8	1	0	0	0	0	109.3	Q2800 K2825 I2839 H2840	Q2800-T2827 WeakPolarHBondContact O-CA 3.24Å; K2825-T2827 HydrophobicContact CG-CG2 4.48Å; T2827-I2839 CarbonylContact O-C 3.52Å; T2827-I2839 WeakPolarHBondContact O-CA 3.43Å; T2827-H2840 PolarHBondContact N-O 2.85Å; T2827-H2840 PolarHBondContact O-N 3.16Å; T2827-H2840 WeakPolarHBondContact OG1-CB 3.38Å; T2827-H2840 PolarHBondContact OG1-O 2.94Å
2828	Y	94.8	Very high	87.1	Confident	9.75 Å²	9.75	26.8 Å²	26.8	4%	0.038	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	129.8	-168.4	-58.8	-76.8	0	0	0	111.3	L2799 Q2800 L2802 F2826 L2836 S2838 I2839 A3145 P3147	L2799-Y2828 HydrophobicContact CB-CD2 4.37Å; L2799-Y2828 HydrophobicContact CD2-CD2 4Å; L2799-Y2828 HydrophobicContact CD2-CE2 3.39Å; L2799-Y2828 VanDerWaalsContact CD2-CE2 3.41Å; L2799-Y2828 HydrophobicContact CG-CD2 3.77Å; L2799-Y2828 HydrophobicContact CG-CE2 3.64Å; L2799-Y2828 VanDerWaalsContact O-CB 3.28Å; L2799-Y2828 WeakPolarHBondContact O-CB 3.26Å; L2799-Y2828 VanDerWaalsContact O-CD2 3.26Å; L2799-Y2828 WeakPolarHBondContact O-CD2 3.39Å; Q2800-Y2828 PolarHBondContact O-N 3.01Å; L2802-Y2828 HydrophobicContact CB-CE2 4.11Å; F2826-Y2828 HydrophobicContact CB-CE1 4.35Å; F2826-Y2828 HydrophobicContact CB-CE2 4.04Å; Y2828-L2836 HydrophobicContact CD1-CD1 3.72Å; Y2828-L2836 HydrophobicContact CD1-CD2 4.38Å; Y2828-L2836 HydrophobicContact CG-CD1 4.23Å; Y2828-S2838 CarbonylContact C-O 3.53Å; Y2828-S2838 WeakPolarHBondContact CA-O 3.17Å; Y2828-I2839 HydrophobicContact CD1-CB 4.43Å; Y2828-I2839 HydrophobicContact CD1-CD1 4.47Å; Y2828-I2839 HydrophobicContact CD1-CG1 4.06Å; Y2828-I2839 HydrophobicContact CD1-CG2 4.17Å; Y2828-I2839 HydrophobicContact CE1-CD1 4.34Å; Y2828-I2839 HydrophobicContact CE1-CG1 4.24Å; Y2828-I2839 HydrophobicContact CE1-CG2 3.93Å; Y2828-A3145 WeakPolarHBondContact CE1-O 3.3Å; Y2828-A3145 VanDerWaalsContact CZ-O 3.32Å; Y2828-A3145 PolarHBondContact OH-O 2.87Å; Y2828-P3147 HydrophobicContact CD1-CG 4.38Å; Y2828-P3147 HydrophobicContact CE1-CG 4.11Å
2829	G	92.9	Very high	88.8	Confident	13.5 Å²	13.5	27.2 Å²	27.2	14%	0.139	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	135.6	172.9	0	0	0	0	0	111.6	V2837 S2838	G2829-V2837 WeakPolarHBondContact O-CG2 3.35Å; G2829-V2837 PolarHBondContact O-N 3.12Å; G2829-S2838 WeakPolarHBondContact CA-OG 3.41Å; G2829-S2838 PolarHBondContact N-O 3.08Å; G2829-S2838 PolarHBondContact N-OG 3.16Å; G2829-S2838 PolarHBondContact O-N 2.96Å
2830	Y	90.5	Very high	90.6	Very high	52.5 Å²	52.5	28.9 Å²	28.9	21%	0.206	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	147.3	179.1	-62	-88	0	0	0	111.4	L2798 L2799 M2834 N2835 L2836	L2798-Y2830 HydrophobicContact CB-CD2 4.33Å; L2798-Y2830 HydrophobicContact CB-CE2 3.9Å; L2798-Y2830 HydrophobicContact CD1-CD1 4.22Å; L2798-Y2830 HydrophobicContact CD1-CD2 4.02Å; L2798-Y2830 HydrophobicContact CD1-CE1 4.41Å; L2798-Y2830 HydrophobicContact CD1-CE2 4.16Å; L2798-Y2830 HydrophobicContact CD1-CG 3.94Å; L2798-Y2830 HydrophobicContact CD2-CD1 4.27Å; L2798-Y2830 HydrophobicContact CD2-CE1 3.98Å; L2798-Y2830 HydrophobicContact CG-CE1 4.49Å; L2798-Y2830 HydrophobicContact CG-CE2 4.46Å; L2799-Y2830 PolarHBondContact N-OH 3.09Å; L2799-Y2830 VanDerWaalsContact O-CE2 3.3Å; L2799-Y2830 WeakPolarHBondContact O-CE2 3.41Å; L2799-Y2830 PolarHBondContact O-OH 3.04Å; L2799-Y2830 VanDerWaalsContact O-OH 3.05Å; Y2830-M2834 WeakPolarHBondContact CD1-O 3.32Å; Y2830-N2835 CarbonylContact C-O 3.48Å; Y2830-N2835 WeakPolarHBondContact CA-O 3.38Å; Y2830-L2836 HydrophobicContact CD1-CB 4.41Å; Y2830-L2836 HydrophobicContact CE1-CB 4.13Å; Y2830-L2836 HydrophobicContact CE1-CD1 4.2Å
2831	D	88.2	Confident	91.7	Very high	43.75 Å²	43.75	28.5 Å²	28.5	23%	0.234	15%	0.149	C	C	.	.			trans	-83.5	179.9	169.3	71.1	9.8	0	0	0	112.1	N2833 M2834 N2835 V2837	D2831-N2833 PolarHBondContact O-N 3.34Å; D2831-N2833 VanDerWaalsContact OD1-C 3.28Å; D2831-N2833 VanDerWaalsContact OD1-CA 3.28Å; D2831-N2833 WeakPolarHBondContact OD1-CA 3.29Å; D2831-N2833 WeakPolarHBondContact OD1-CB 3.39Å; D2831-N2833 PolarHBondContact OD1-N 2.87Å; D2831-M2834 WeakPolarHBondContact O-CA 3.35Å; D2831-M2834 PolarHBondContact O-N 3.13Å; D2831-M2834 PolarHBondContact OD1-N 2.94Å; D2831-N2835 PolarHBondContact N-O 3.16Å; D2831-N2835 VanDerWaalsContact N-O 3.1Å; D2831-N2835 WeakPolarHBondContact OD1-CB 3.37Å; D2831-N2835 PolarHBondContact OD1-N 3.01Å; D2831-N2835 PolarHBondContact OD1-ND2 2.91Å; D2831-N2835 WeakPolarHBondContact OD2-CB 3.34Å; D2831-N2835 PolarHBondContact OD2-ND2 3.03Å; D2831-N2835 VanDerWaalsContact OD2-ND2 3.12Å; D2831-V2837 HydrophobicContact CB-CG1 3.94Å; D2831-V2837 HydrophobicContact CB-CG2 4.39Å
2832	L	83.3	Confident	92.1	Very high	122.25 Å²	122.25	28.1 Å²	28.1	64%	0.64	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65	-17.7	177.5	-67.3	171.9	0	0	0	113.7	N2507 M2834	N2507-L2832 PolarHBondContact ND2-O 2.97Å; L2832-M2834 VanDerWaalsContact C-N 3.29Å
2833	N	83.7	Confident	92.3	Very high	29 Å²	29	28.1 Å²	28.1	16%	0.155	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	6.7	175.2	-65.6	-13.6	0	0	0	111.7	N2396 N2507 D2831 N2835 T3382	N2396-N2833 WeakPolarHBondContact ND2-CA 3.12Å; N2396-N2833 PolarHBondContact ND2-O 2.89Å; N2507-N2833 PolarHBondContact ND2-OD1 3.08Å; D2831-N2833 PolarHBondContact O-N 3.34Å; D2831-N2833 VanDerWaalsContact OD1-C 3.28Å; D2831-N2833 VanDerWaalsContact OD1-CA 3.28Å; D2831-N2833 WeakPolarHBondContact OD1-CA 3.29Å; D2831-N2833 WeakPolarHBondContact OD1-CB 3.39Å; D2831-N2833 PolarHBondContact OD1-N 2.87Å; N2833-N2835 VanDerWaalsContact C-N 3.3Å; N2833-N2835 WeakPolarHBondContact CB-ND2 3.45Å; N2833-N2835 PolarHBondContact O-N 3.09Å; N2833-T3382 WeakPolarHBondContact O-CG2 3.34Å
2834	M	85.7	Confident	92.1	Very high	30 Å²	30	27.8 Å²	27.8	15%	0.148	15%	0.146	C	C	.	.			trans	63.7	23.5	-176.3	-52	-128	-94.5	0	0	113.7	I2383 I2385 I2394 N2396 L2798 Y2830 D2831 L2832 T3382 F3384	I2383-M2834 HydrophobicContact CB-CE 3.85Å; I2383-M2834 HydrophobicContact CD1-CE 3.94Å; I2383-M2834 HydrophobicContact CG1-CE 4.44Å; I2383-M2834 HydrophobicContact CG2-CE 3.91Å; I2383-M2834 HydrophobicContact CG2-SD 4.42Å; I2385-M2834 HydrophobicContact CD1-SD 3.71Å; I2394-M2834 HydrophobicContact CG2-CG 3.82Å; N2396-M2834 HydrophobicContact CB-CE 3.29Å; N2396-M2834 VanDerWaalsContact CB-CE 3.41Å; L2798-M2834 HydrophobicContact CD1-CB 4.1Å; L2798-M2834 HydrophobicContact CD1-CE 3.23Å; L2798-M2834 HydrophobicContact CD1-CG 3.99Å; L2798-M2834 HydrophobicContact CD1-SD 3.92Å; L2798-M2834 WeakPolarHBondContact CD1-SD 3.21Å; L2798-M2834 HydrophobicContact CD2-CB 4.29Å; L2798-M2834 HydrophobicContact CD2-CE 3.9Å; L2798-M2834 HydrophobicContact CG-CE 3.52Å; L2798-M2834 VanDerWaalsContact CG-CE 3.44Å; L2798-M2834 HydrophobicContact CG-SD 4.29Å; Y2830-M2834 WeakPolarHBondContact CD1-O 3.32Å; D2831-M2834 WeakPolarHBondContact O-CA 3.35Å; D2831-M2834 PolarHBondContact O-N 3.13Å; D2831-M2834 PolarHBondContact OD1-N 2.94Å; L2832-M2834 VanDerWaalsContact C-N 3.29Å; M2834-T3382 HydrophobicContact CB-CG2 4.19Å; M2834-F3384 HydrophobicContact CE-CZ 4.36Å
2835	N	88.2	Confident	91.6	Very high	14.75 Å²	14.75	28.2 Å²	28.2	8%	0.079	15%	0.148	C	C	.	.			trans	-81.2	139.2	171.9	-60.5	-58.7	0	0	0	110.7	Y2830 D2831 N2833 V2837 L2872 N3379	Y2830-N2835 CarbonylContact C-O 3.48Å; Y2830-N2835 WeakPolarHBondContact CA-O 3.38Å; D2831-N2835 PolarHBondContact N-O 3.16Å; D2831-N2835 VanDerWaalsContact N-O 3.1Å; D2831-N2835 WeakPolarHBondContact OD1-CB 3.37Å; D2831-N2835 PolarHBondContact OD1-N 3.01Å; D2831-N2835 PolarHBondContact OD1-ND2 2.91Å; D2831-N2835 WeakPolarHBondContact OD2-CB 3.34Å; D2831-N2835 PolarHBondContact OD2-ND2 3.03Å; D2831-N2835 VanDerWaalsContact OD2-ND2 3.12Å; N2833-N2835 VanDerWaalsContact C-N 3.3Å; N2833-N2835 WeakPolarHBondContact CB-ND2 3.45Å; N2833-N2835 PolarHBondContact O-N 3.09Å; N2835-V2837 HydrophobicContact CB-CG1 4.46Å; N2835-V2837 PolarHBondContact O-N 3.24Å; N2835-L2872 HydrophobicContact CB-CD1 3.5Å; N2835-L2872 WeakPolarHBondContact ND2-CD1 3.28Å; N2835-N3379 PolarHBondContact ND2-O 2.93Å; N2835-N3379 VanDerWaalsContact OD1-CA 3.26Å; N2835-N3379 WeakPolarHBondContact OD1-CA 3.45Å; N2835-N3379 WeakPolarHBondContact OD1-CB 3.44Å; N2835-N3379 PolarHBondContact OD1-O 3.25Å; N2835-N3379 PolarHBondContact OD1-OD1 2.89Å
2836	L	90.3	Very high	90.9	Very high	12.75 Å²	12.75	26.1 Å²	26.1	7%	0.067	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	115.2	169.7	-178.8	66.9	0	0	0	110	Y2828 Y2830 S2838 I2839 I2870 P3147	Y2828-L2836 HydrophobicContact CD1-CD1 3.72Å; Y2828-L2836 HydrophobicContact CD1-CD2 4.38Å; Y2828-L2836 HydrophobicContact CG-CD1 4.23Å; Y2830-L2836 HydrophobicContact CD1-CB 4.41Å; Y2830-L2836 HydrophobicContact CE1-CB 4.13Å; Y2830-L2836 HydrophobicContact CE1-CD1 4.2Å; L2836-S2838 WeakPolarHBondContact CD1-O 3.39Å; L2836-I2839 HydrophobicContact CD1-CG1 4.23Å; L2836-I2839 HydrophobicContact CD2-CD1 3.94Å; L2836-I2839 HydrophobicContact CD2-CG1 4.05Å; L2836-I2839 HydrophobicContact CG-CG1 4.33Å; L2836-I2870 VanDerWaalsContact O-CD1 3.3Å; L2836-I2870 WeakPolarHBondContact O-CD1 3.32Å; L2836-P3147 HydrophobicContact CD2-CG 3.88Å
2837	V	93.8	Very high	89.6	Confident	34.75 Å²	34.75	30.9 Å²	30.9	21%	0.211	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	-19.3	-177.7	-68.2	0	0	0	0	113.6	G2829 D2831 N2835 S2869 I2870 L2872	G2829-V2837 WeakPolarHBondContact O-CG2 3.35Å; G2829-V2837 PolarHBondContact O-N 3.12Å; D2831-V2837 HydrophobicContact CB-CG1 3.94Å; D2831-V2837 HydrophobicContact CB-CG2 4.39Å; N2835-V2837 HydrophobicContact CB-CG1 4.46Å; N2835-V2837 PolarHBondContact O-N 3.24Å; V2837-S2869 CarbonylContact O-C 3.48Å; V2837-S2869 VanDerWaalsContact O-CA 3.29Å; V2837-S2869 WeakPolarHBondContact O-CA 3.36Å; V2837-I2870 HydrophobicContact CB-CG1 4.41Å; V2837-I2870 HydrophobicContact CG1-CG1 4.46Å; V2837-I2870 PolarHBondContact O-N 2.9Å; V2837-L2872 HydrophobicContact CG1-CD1 4.31Å
2838	S	95	Very high	88.3	Confident	23.25 Å²	23.25	34.1 Å²	34.1	16%	0.163	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	148.3	170.8	70.5	0	0	0	0	113.4	Y2828 G2829 L2836 E2867 S2868	Y2828-S2838 CarbonylContact C-O 3.53Å; Y2828-S2838 WeakPolarHBondContact CA-O 3.17Å; G2829-S2838 WeakPolarHBondContact CA-OG 3.41Å; G2829-S2838 PolarHBondContact N-O 3.08Å; G2829-S2838 PolarHBondContact N-OG 3.16Å; G2829-S2838 PolarHBondContact O-N 2.96Å; L2836-S2838 WeakPolarHBondContact CD1-O 3.39Å; S2838-E2867 WeakPolarHBondContact CB-OE1 3.38Å; S2838-S2868 CarbonylContact C-O 3.56Å; S2838-S2868 WeakPolarHBondContact CA-O 3.32Å; S2838-S2868 VanDerWaalsContact CB-O 3.22Å; S2838-S2868 WeakPolarHBondContact CB-O 3.42Å
2839	I	96.5	Very high	86.8	Confident	20.5 Å²	20.5	36.9 Å²	36.9	11%	0.105	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	114	170.2	-48.3	175.9	0	0	0	106.6	F2826 T2827 Y2828 L2836 S2868 A3145	F2826-I2839 HydrophobicContact CB-CG2 4.26Å; F2826-I2839 HydrophobicContact CD1-CG2 4.26Å; T2827-I2839 CarbonylContact O-C 3.52Å; T2827-I2839 WeakPolarHBondContact O-CA 3.43Å; Y2828-I2839 HydrophobicContact CD1-CB 4.43Å; Y2828-I2839 HydrophobicContact CD1-CD1 4.47Å; Y2828-I2839 HydrophobicContact CD1-CG1 4.06Å; Y2828-I2839 HydrophobicContact CD1-CG2 4.17Å; Y2828-I2839 HydrophobicContact CE1-CD1 4.34Å; Y2828-I2839 HydrophobicContact CE1-CG1 4.24Å; Y2828-I2839 HydrophobicContact CE1-CG2 3.93Å; L2836-I2839 HydrophobicContact CD1-CG1 4.23Å; L2836-I2839 HydrophobicContact CD2-CD1 3.94Å; L2836-I2839 HydrophobicContact CD2-CG1 4.05Å; L2836-I2839 HydrophobicContact CG-CG1 4.33Å; I2839-S2868 VanDerWaalsContact CA-OG 3.31Å; I2839-S2868 WeakPolarHBondContact CA-OG 3.3Å; I2839-S2868 WeakPolarHBondContact CB-OG 3.32Å; I2839-S2868 PolarHBondContact N-O 3.09Å; I2839-S2868 PolarHBondContact N-OG 2.79Å; I2839-S2868 PolarHBondContact O-N 3.05Å; I2839-S2868 PolarHBondContact O-OG 3.17Å; I2839-A3145 HydrophobicContact CG2-CB 4.31Å
2840	H	96.7	Very high	85.4	Confident	61.5 Å²	61.5	42.1 Å²	42.1	29%	0.285	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	121.1	171.4	177.8	72.6	0	0	0	109.3	F2826 T2827 N2865 E2866 E2867	F2826-H2840 CarbonylContact C-O 3.51Å; F2826-H2840 VanDerWaalsContact CA-O 3.32Å; F2826-H2840 WeakPolarHBondContact CA-O 3.18Å; T2827-H2840 PolarHBondContact N-O 2.85Å; T2827-H2840 PolarHBondContact O-N 3.16Å; T2827-H2840 WeakPolarHBondContact OG1-CB 3.38Å; T2827-H2840 PolarHBondContact OG1-O 2.94Å; H2840-N2865 PolarHBondContact CE1-OD1 2.9Å; H2840-N2865 PolarHBondContact NE2-OD1 3.02Å; H2840-N2865 VanDerWaalsContact NE2-OD1 3.11Å; H2840-E2866 CarbonylContact C-O 3.55Å; H2840-E2866 WeakPolarHBondContact CA-O 3.36Å; H2840-E2866 PolarHBondContact ND1-O 2.99Å; H2840-E2866 VanDerWaalsContact ND1-O 3.12Å; H2840-E2867 HydrophobicContact CB-CG 4.42Å
2841	T	96.2	Very high	84.1	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	124.3	-174.8	-55.3	0	0	0	0	109.9	F2826 L2843 L2864 N2865 E2866 H3155	F2826-T2841 HydrophobicContact CD1-CG2 3.97Å; F2826-T2841 HydrophobicContact CE1-CG2 3.5Å; F2826-T2841 VanDerWaalsContact CE1-CG2 3.47Å; F2826-T2841 HydrophobicContact CZ-CG2 4.46Å; T2841-L2843 HydrophobicContact CG2-CD2 4.16Å; T2841-L2843 HydrophobicContact CG2-CG 4.21Å; T2841-L2864 HydrophobicContact CG2-CD2 4.42Å; T2841-N2865 WeakPolarHBondContact O-CA 3.24Å; T2841-E2866 WeakPolarHBondContact CB-OE1 3.39Å; T2841-E2866 PolarHBondContact N-O 3.04Å; T2841-E2866 PolarHBondContact O-N 2.95Å; T2841-E2866 PolarHBondContact OG1-OE1 3.09Å; T2841-H3155 PolarHBondContact OG1-CE1 3.06Å
2842	S	94.2	Very high	83.2	Confident	8.25 Å²	8.25	42.7 Å²	42.7	6%	0.058	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	120.6	169	-156.4	0	0	0	0	110	A2824 K2825 L2864 N2865	A2824-S2842 CarbonylContact C-O 3.57Å; A2824-S2842 WeakPolarHBondContact CA-O 3.36Å; K2825-S2842 PolarHBondContact N-O 3.19Å; K2825-S2842 PolarHBondContact O-N 2.93Å; S2842-L2864 CarbonylContact C-O 3.52Å; S2842-L2864 WeakPolarHBondContact CA-O 3.23Å; S2842-N2865 PolarHBondContact OG-OD1 2.84Å
2843	L	92.9	Very high	82.3	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	131.8	171.3	-53.9	-179.5	0	0	0	108.9	L2822 N2823 A2824 T2841 V2863 L2864 F3143 T3164	L2822-L2843 HydrophobicContact CD1-CB 4.16Å; L2822-L2843 HydrophobicContact CD1-CD1 4.2Å; N2823-L2843 WeakPolarHBondContact O-CA 3.31Å; A2824-L2843 HydrophobicContact CB-CD2 3.6Å; T2841-L2843 HydrophobicContact CG2-CD2 4.16Å; T2841-L2843 HydrophobicContact CG2-CG 4.21Å; L2843-V2863 PolarHBondContact O-N 2.83Å; L2843-L2864 HydrophobicContact CB-CB 4Å; L2843-L2864 HydrophobicContact CD1-CB 4.08Å; L2843-L2864 HydrophobicContact CD1-CD2 3.97Å; L2843-L2864 HydrophobicContact CG-CB 4.06Å; L2843-L2864 HydrophobicContact CG-CD2 4.27Å; L2843-L2864 PolarHBondContact N-O 3.05Å; L2843-L2864 PolarHBondContact O-N 2.96Å; L2843-L2864 VanDerWaalsContact O-N 3.12Å; L2843-F3143 HydrophobicContact CD1-CD2 4.49Å; L2843-F3143 HydrophobicContact CD1-CE2 4.21Å; L2843-F3143 HydrophobicContact CD2-CD1 4.31Å; L2843-F3143 HydrophobicContact CD2-CD2 4.4Å; L2843-F3143 HydrophobicContact CD2-CE1 4.15Å; L2843-F3143 HydrophobicContact CD2-CE2 4.24Å; L2843-F3143 HydrophobicContact CD2-CG 4.45Å; L2843-F3143 HydrophobicContact CD2-CZ 4.12Å; L2843-T3164 HydrophobicContact CD1-CG2 3.82Å
2844	F	88.8	Confident	81.3	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	161	-172.2	63	-83.3	0	0	0	112.5	H2803 N2823 K2825 R2846 I2856 D2860 K2861 T2862	H2803-F2844 AromaticContact CE1-CE1 3.93Å; H2803-F2844 AromaticContact CE1-CZ 3.43Å; H2803-F2844 VanDerWaalsContact CE1-CZ 3.43Å; H2803-F2844 WeakPolarHBondContact CE1-CZ 3.43Å; H2803-F2844 AromaticContact NE2-CZ 3.45Å; H2803-F2844 VanDerWaalsContact NE2-CZ 3.35Å; H2803-F2844 WeakPolarHBondContact NE2-CZ 3.37Å; N2823-F2844 HydrophobicContact CB-CD1 4.41Å; N2823-F2844 HydrophobicContact CB-CD2 4.12Å; N2823-F2844 HydrophobicContact CB-CE1 3.92Å; N2823-F2844 HydrophobicContact CB-CE2 3.61Å; N2823-F2844 HydrophobicContact CB-CG 4.48Å; N2823-F2844 HydrophobicContact CB-CZ 3.46Å; N2823-F2844 VanDerWaalsContact CB-CZ 3.46Å; N2823-F2844 PolarHBondContact N-O 3.32Å; N2823-F2844 PolarHBondContact O-N 2.93Å; N2823-F2844 VanDerWaalsContact O-N 3.08Å; K2825-F2844 HydrophobicContact CB-CE1 4.21Å; F2844-R2846 HydrophobicContact CD2-CG 4.37Å; F2844-R2846 HydrophobicContact CE2-CG 3.95Å; F2844-I2856 HydrophobicContact CD1-CD1 3.87Å; F2844-I2856 HydrophobicContact CD1-CG1 4.18Å; F2844-I2856 HydrophobicContact CD2-CG1 4.5Å; F2844-I2856 HydrophobicContact CD2-CG2 4.29Å; F2844-I2856 HydrophobicContact CE1-CD1 3.88Å; F2844-I2856 HydrophobicContact CE1-CG1 3.91Å; F2844-I2856 HydrophobicContact CE2-CG1 4.35Å; F2844-I2856 HydrophobicContact CG-CD1 4.38Å; F2844-I2856 HydrophobicContact CG-CG1 4.47Å; F2844-I2856 HydrophobicContact CG-CG2 4.35Å; F2844-I2856 HydrophobicContact CZ-CD1 4.34Å; F2844-I2856 HydrophobicContact CZ-CG1 4.03Å; F2844-D2860 HydrophobicContact CD2-CB 4.1Å; F2844-K2861 CarbonylContact C-O 3.55Å; F2844-K2861 VanDerWaalsContact CA-O 3.25Å; F2844-K2861 WeakPolarHBondContact CA-O 3.37Å; F2844-K2861 WeakPolarHBondContact CB-O 3.42Å; F2844-T2862 HydrophobicContact CB-CG2 4.39Å
2845	I	85.1	Confident	80.4	Confident	9.5 Å²	9.5	43.3 Å²	43.3	5%	0.049	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	130	176.6	-59.3	166.2	0	0	0	108.3	L2818 L2822 D2860 K2861 V2863	L2818-I2845 HydrophobicContact CB-CD1 3.95Å; L2818-I2845 HydrophobicContact CD2-CD1 3.77Å; L2818-I2845 VanDerWaalsContact CD2-CD1 3.47Å; L2818-I2845 HydrophobicContact CG-CD1 4.24Å; L2818-I2845 WeakPolarHBondContact O-CD1 3.41Å; L2822-I2845 HydrophobicContact CD2-CD1 3.82Å; L2822-I2845 HydrophobicContact CD2-CG1 3.44Å; L2822-I2845 VanDerWaalsContact CD2-CG1 3.45Å; I2845-D2860 CarbonylContact O-C 3.45Å; I2845-D2860 WeakPolarHBondContact O-CA 3.12Å; I2845-K2861 HydrophobicContact CB-CB 4.43Å; I2845-K2861 HydrophobicContact CD1-CD 4.47Å; I2845-K2861 PolarHBondContact N-O 3.03Å; I2845-K2861 PolarHBondContact O-N 3.18Å; I2845-V2863 HydrophobicContact CD1-CG2 3.9Å; I2845-V2863 HydrophobicContact CG1-CG2 4.08Å
2846	R	79.2	Confident	79.4	Confident	21.75 Å²	21.75	45.1 Å²	45.1	8%	0.082	24%	0.244	C	C	.	.			trans	-89.5	133.2	178.1	-122.8	177.2	-123.3	-142.1	-7.2	111.2	H2803 N2805 K2812 N2823 F2844 D2851 G2853 D2860	H2803-R2846 PolarHBondContact CE1-NH2 3.32Å; H2803-R2846 VanDerWaalsContact CE1-NH2 3.3Å; H2803-R2846 PolarHBondContact NE2-NH2 3.02Å; H2803-R2846 VanDerWaalsContact NE2-NH2 3.12Å; N2805-R2846 PolarHBondContact ND2-NH1 3.05Å; N2805-R2846 PolarHBondContact ND2-NH2 2.98Å; N2805-R2846 VanDerWaalsContact OD1-CZ 3.32Å; N2805-R2846 PolarHBondContact OD1-NE 2.9Å; N2805-R2846 VanDerWaalsContact OD1-NE 3.12Å; N2805-R2846 PolarHBondContact OD1-NH2 2.86Å; N2805-R2846 VanDerWaalsContact OD1-NH2 3.08Å; K2812-R2846 PolarHBondContact NZ-O 3.4Å; N2823-R2846 WeakPolarHBondContact ND2-CB 3.34Å; F2844-R2846 HydrophobicContact CD2-CG 4.37Å; F2844-R2846 HydrophobicContact CE2-CG 3.95Å; R2846-D2851 VanDerWaalsContact CD-O 3.29Å; R2846-D2851 WeakPolarHBondContact CD-O 3.41Å; R2846-D2851 VanDerWaalsContact NH1-CG 3.29Å; R2846-D2851 PolarHBondContact NH1-O 3.02Å; R2846-D2851 IonicContact NH1-OD1 3.29Å; R2846-D2851 IonicContact NH1-OD2 2.93Å; R2846-D2851 PolarHBondContact NH1-OD2 3.43Å; R2846-D2851 VanDerWaalsContact NH1-OD2 3.13Å; R2846-G2853 PolarHBondContact NH1-O 3.03Å; R2846-G2853 VanDerWaalsContact NH1-O 3.13Å; R2846-G2853 PolarHBondContact NH2-O 2.93Å; R2846-D2860 WeakPolarHBondContact CA-OD1 3.35Å
2847	N	70.3	Confident	78.5	Confident	101.5 Å²	101.5	47.3 Å²	47.3	54%	0.543	26%	0.256	S	S	.	.	S	Bend	trans	-73.7	-41.9	177.2	-73.8	-15.7	0	0	0	112	K2812 D2859	K2812-N2847 PolarHBondContact NZ-O 3.31Å; N2847-D2859 PolarHBondContact ND2-O 3.04Å
2848	N	68.4	Low	77.3	Confident	106 Å²	106	51.3 Å²	51.3	57%	0.567	29%	0.285	S	S	*	.			trans	-93.6	115	179	-128.4	-5.9	0	0	0	111	D2850 D2851	N2848-D2850 VanDerWaalsContact C-N 3.3Å; N2848-D2850 PolarHBondContact O-N 3.17Å; N2848-D2850 PolarHBondContact OD1-N 2.81Å; N2848-D2850 VanDerWaalsContact OD1-N 3.17Å; N2848-D2851 HydrophobicContact CB-CB 4.13Å; N2848-D2851 PolarHBondContact O-N 3.37Å
2849	E	62.8	Low	76.1	Confident	69.5 Å²	69.5	55.6 Å²	55.6	33%	0.325	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-23.3	-177	-77.6	-162.9	-173.2	0	0	114.5	R2807 K2812 D2851	R2807-E2849 IonicContact CZ-OE2 3.39Å; R2807-E2849 VanDerWaalsContact CZ-OE2 3.28Å; R2807-E2849 IonicContact NE-OE2 2.92Å; R2807-E2849 PolarHBondContact NE-OE2 3.09Å; R2807-E2849 PolarHBondContact NH1-O 2.89Å; R2807-E2849 IonicContact NH2-OE2 3.43Å; R2807-E2849 PolarHBondContact NH2-OE2 3.06Å; R2807-E2849 VanDerWaalsContact NH2-OE2 3.08Å; K2812-E2849 HydrophobicContact CD-CG 4.19Å; K2812-E2849 VanDerWaalsContact CD-OE1 3.28Å; K2812-E2849 WeakPolarHBondContact CD-OE1 3.29Å; K2812-E2849 WeakPolarHBondContact CE-OE1 3.33Å; K2812-E2849 VanDerWaalsContact CG-OE1 3.25Å; K2812-E2849 WeakPolarHBondContact CG-OE1 3.47Å; K2812-E2849 IonicContact NZ-OE1 3.16Å; K2812-E2849 PolarHBondContact NZ-OE1 3.24Å; E2849-D2851 VanDerWaalsContact C-N 3.32Å
2850	D	63.6	Low	75.3	Confident	123 Å²	123	55.3 Å²	55.3	66%	0.658	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-7.4	-175.9	-66.1	-34.4	0	0	0	112.7	R2807 N2848 F2852	R2807-D2850 IonicContact CZ-OD1 3.07Å; R2807-D2850 IonicContact NH1-OD1 3.36Å; R2807-D2850 PolarHBondContact NH1-OD1 3.1Å; R2807-D2850 IonicContact NH2-OD1 3.18Å; N2848-D2850 VanDerWaalsContact C-N 3.3Å; N2848-D2850 PolarHBondContact O-N 3.17Å; N2848-D2850 PolarHBondContact OD1-N 2.81Å; N2848-D2850 VanDerWaalsContact OD1-N 3.17Å; D2850-F2852 PolarHBondContact O-N 3.33Å
2851	D	63	Low	74.5	Confident	60.75 Å²	60.75	55.6 Å²	55.6	33%	0.325	31%	0.306	S	S	.	.			trans	-91.7	109.8	178.9	-169.4	7.9	0	0	0	110.8	R2846 N2848 E2849 G2853 N2857	R2846-D2851 VanDerWaalsContact CD-O 3.29Å; R2846-D2851 WeakPolarHBondContact CD-O 3.41Å; R2846-D2851 VanDerWaalsContact NH1-CG 3.29Å; R2846-D2851 PolarHBondContact NH1-O 3.02Å; R2846-D2851 IonicContact NH1-OD1 3.29Å; R2846-D2851 IonicContact NH1-OD2 2.93Å; R2846-D2851 PolarHBondContact NH1-OD2 3.43Å; R2846-D2851 VanDerWaalsContact NH1-OD2 3.13Å; N2848-D2851 HydrophobicContact CB-CB 4.13Å; N2848-D2851 PolarHBondContact O-N 3.37Å; E2849-D2851 VanDerWaalsContact C-N 3.32Å; D2851-G2853 VanDerWaalsContact C-N 3.25Å; D2851-G2853 WeakPolarHBondContact OD1-CA 3.48Å; D2851-G2853 PolarHBondContact OD1-N 3.17Å; D2851-N2857 PolarHBondContact OD2-ND2 2.98Å; D2851-N2857 VanDerWaalsContact OD2-ND2 3.08Å
2852	F	68.5	Low	74	Confident	48 Å²	48	58.9 Å²	58.9	21%	0.211	33%	0.326	C	S	.	.			trans	-96.9	21.8	171.1	-82.1	-85.5	0	0	0	112.4	R2787 Q2789 Q2791 N2805 R2807 D2850	R2787-F2852 HydrophobicContact CB-CZ 4.27Å; Q2789-F2852 HydrophobicContact CB-CD1 3.73Å; Q2789-F2852 HydrophobicContact CB-CE1 3.9Å; Q2789-F2852 HydrophobicContact CG-CD1 4.42Å; Q2789-F2852 PolarHBondContact NE2-O 2.89Å; Q2791-F2852 PolarHBondContact NE2-O 2.93Å; N2805-F2852 HydrophobicContact CB-CD1 3.55Å; N2805-F2852 HydrophobicContact CB-CE1 3.71Å; N2805-F2852 PolarHBondContact ND2-O 2.77Å; R2807-F2852 HydrophobicContact CB-CZ 4.37Å; D2850-F2852 PolarHBondContact O-N 3.33Å
2853	G	64.8	Low	73.6	Confident	21 Å²	21	59.1 Å²	59.1	22%	0.216	33%	0.327	C	S	.	.			trans	-59.4	160	178.9	0	0	0	0	0	115.1	H2803 R2846 D2851 T2855	H2803-G2853 PolarHBondContact CE1-O 2.85Å; R2846-G2853 PolarHBondContact NH1-O 3.03Å; R2846-G2853 VanDerWaalsContact NH1-O 3.13Å; R2846-G2853 PolarHBondContact NH2-O 2.93Å; D2851-G2853 VanDerWaalsContact C-N 3.25Å; D2851-G2853 WeakPolarHBondContact OD1-CA 3.48Å; D2851-G2853 PolarHBondContact OD1-N 3.17Å; G2853-T2855 PolarHBondContact O-N 2.9Å
2854	N	62.8	Low	73.4	Confident	80.25 Å²	80.25	59.5 Å²	59.5	43%	0.429	33%	0.329	S	S	.	.	S	Bend	trans	-84.9	-17.1	-171.6	-56.1	14.8	0	0	0	113.8	Q2791 H2803	Q2791-N2854 VanDerWaalsContact CD-ND2 3.3Å; Q2791-N2854 PolarHBondContact NE2-ND2 3.01Å; Q2791-N2854 PolarHBondContact NE2-OD1 3.06Å; Q2791-N2854 PolarHBondContact OE1-ND2 3.07Å; Q2791-N2854 PolarHBondContact OE1-OD1 2.98Å; H2803-N2854 VanDerWaalsContact CE1-C 3.45Å; H2803-N2854 PolarHBondContact CE1-O 2.79Å; H2803-N2854 VanDerWaalsContact CE1-O 3.24Å; H2803-N2854 PolarHBondContact ND1-O 3.22Å
2855	T	66.2	Low	73.6	Confident	92.75 Å²	92.75	64.3 Å²	64.3	57%	0.569	35%	0.354	S	S	*	.	S	Bend	trans	-90.6	135.9	-177.9	42.4	0	0	0	0	109.8	G2853 N2857	G2853-T2855 PolarHBondContact O-N 2.9Å; T2855-N2857 PolarHBondContact O-N 2.92Å; T2855-N2857 PolarHBondContact O-OD1 2.92Å; T2855-N2857 PolarHBondContact OG1-OD1 3.01Å
2856	I	67.2	Low	73.9	Confident	52 Å²	52	64.6 Å²	64.6	27%	0.267	36%	0.356	S	S	.	.			trans	-72.3	114.5	162.1	-59.4	175.2	0	0	0	104.6	K2825 F2844 D2860	K2825-I2856 HydrophobicContact CB-CD1 4.23Å; K2825-I2856 HydrophobicContact CD-CD1 3.81Å; K2825-I2856 HydrophobicContact CD-CG1 4.31Å; F2844-I2856 HydrophobicContact CD1-CD1 3.87Å; F2844-I2856 HydrophobicContact CD1-CG1 4.18Å; F2844-I2856 HydrophobicContact CD2-CG1 4.5Å; F2844-I2856 HydrophobicContact CD2-CG2 4.29Å; F2844-I2856 HydrophobicContact CE1-CD1 3.88Å; F2844-I2856 HydrophobicContact CE1-CG1 3.91Å; F2844-I2856 HydrophobicContact CE2-CG1 4.35Å; F2844-I2856 HydrophobicContact CG-CD1 4.38Å; F2844-I2856 HydrophobicContact CG-CG1 4.47Å; F2844-I2856 HydrophobicContact CG-CG2 4.35Å; F2844-I2856 HydrophobicContact CZ-CD1 4.34Å; F2844-I2856 HydrophobicContact CZ-CG1 4.03Å; I2856-D2860 HydrophobicContact CG2-CB 3.83Å
2857	N	72.8	Confident	74.6	Confident	58.5 Å²	58.5	69 Å²	69	31%	0.313	38%	0.377	S	S	.	.			trans	-74.3	155.9	-178.6	-66.1	-27.4	0	0	0	109.2	D2851 T2855 D2859 D2860	D2851-N2857 PolarHBondContact OD2-ND2 2.98Å; D2851-N2857 VanDerWaalsContact OD2-ND2 3.08Å; T2855-N2857 PolarHBondContact O-N 2.92Å; T2855-N2857 PolarHBondContact O-OD1 2.92Å; T2855-N2857 PolarHBondContact OG1-OD1 3.01Å; N2857-D2859 PolarHBondContact O-N 3.27Å; N2857-D2859 VanDerWaalsContact O-N 3.08Å; N2857-D2860 PolarHBondContact N-OD2 2.97Å; N2857-D2860 WeakPolarHBondContact O-CB 3.29Å; N2857-D2860 PolarHBondContact O-N 3.15Å
2858	S	68.5	Low	75.7	Confident	118.5 Å²	118.5	65 Å²	65	83%	0.829	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-26.4	176.5	52.1	0	0	0	0	113.3
2859	D	70.4	Confident	77	Confident	113.75 Å²	113.75	62.6 Å²	62.6	61%	0.608	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-10.8	-175.5	-56.7	-6.6	0	0	0	112	N2847 N2857 K2861	N2847-D2859 PolarHBondContact ND2-O 3.04Å; N2857-D2859 PolarHBondContact O-N 3.27Å; N2857-D2859 VanDerWaalsContact O-N 3.08Å; D2859-K2861 PolarHBondContact O-N 3.32Å
2860	D	78.5	Confident	78.5	Confident	14 Å²	14	61.4 Å²	61.4	8%	0.075	34%	0.344	C	S	.	.	S	Bend	trans	-71.3	132.4	178.5	-69	-22.3	0	0	0	110.4	F2844 I2845 R2846 I2856 N2857 T2862	F2844-D2860 HydrophobicContact CD2-CB 4.1Å; I2845-D2860 CarbonylContact O-C 3.45Å; I2845-D2860 WeakPolarHBondContact O-CA 3.12Å; R2846-D2860 WeakPolarHBondContact CA-OD1 3.35Å; I2856-D2860 HydrophobicContact CG2-CB 3.83Å; N2857-D2860 PolarHBondContact N-OD2 2.97Å; N2857-D2860 WeakPolarHBondContact O-CB 3.29Å; N2857-D2860 PolarHBondContact O-N 3.15Å; D2860-T2862 PolarHBondContact O-N 3.14Å
2861	K	81.1	Confident	80	Confident	68 Å²	68	63.5 Å²	63.5	30%	0.296	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	105.6	-177.6	-174.1	176.8	-179.3	175.6	0	109.8	N2817 L2818 F2844 I2845 D2859 V2863 L3187	N2817-K2861 PolarHBondContact O-NZ 3Å; N2817-K2861 VanDerWaalsContact O-NZ 3.15Å; L2818-K2861 HydrophobicContact CD2-CD 4.47Å; F2844-K2861 CarbonylContact C-O 3.55Å; F2844-K2861 VanDerWaalsContact CA-O 3.25Å; F2844-K2861 WeakPolarHBondContact CA-O 3.37Å; F2844-K2861 WeakPolarHBondContact CB-O 3.42Å; I2845-K2861 HydrophobicContact CB-CB 4.43Å; I2845-K2861 HydrophobicContact CD1-CD 4.47Å; I2845-K2861 PolarHBondContact N-O 3.03Å; I2845-K2861 PolarHBondContact O-N 3.18Å; D2859-K2861 PolarHBondContact O-N 3.32Å; K2861-V2863 PolarHBondContact O-N 3.11Å; K2861-L3187 PolarHBondContact NZ-O 3.11Å
2862	T	84.1	Confident	81.3	Confident	70.25 Å²	70.25	62 Å²	62	43%	0.431	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	130.2	173.4	35.4	0	0	0	0	110.8	F2844 D2860 L2864 N2865	F2844-T2862 HydrophobicContact CB-CG2 4.39Å; D2860-T2862 PolarHBondContact O-N 3.14Å; T2862-L2864 WeakPolarHBondContact CG2-O 3.37Å; T2862-N2865 HydrophobicContact CG2-CB 4.03Å
2863	V	85.7	Confident	82.3	Confident	12 Å²	12	61.2 Å²	61.2	7%	0.073	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	-38.7	179.8	176.8	0	0	0	0	111.1	L2818 L2822 L2843 I2845 K2861 F3157 N3184 L3187	L2818-V2863 HydrophobicContact CD2-CG2 4.06Å; L2822-V2863 HydrophobicContact CD1-CB 4.44Å; L2822-V2863 HydrophobicContact CD1-CG1 4.23Å; L2822-V2863 HydrophobicContact CD2-CB 4.27Å; L2822-V2863 HydrophobicContact CD2-CG1 4.41Å; L2822-V2863 HydrophobicContact CD2-CG2 3.73Å; L2843-V2863 PolarHBondContact O-N 2.83Å; I2845-V2863 HydrophobicContact CD1-CG2 3.9Å; I2845-V2863 HydrophobicContact CG1-CG2 4.08Å; K2861-V2863 PolarHBondContact O-N 3.11Å; V2863-F3157 HydrophobicContact CG1-CD2 4.48Å; V2863-F3157 HydrophobicContact CG1-CE2 3.74Å; V2863-F3157 HydrophobicContact CG1-CZ 4.15Å; V2863-N3184 HydrophobicContact CG1-CB 4.32Å; V2863-N3184 VanDerWaalsContact CG1-ND2 3.27Å; V2863-N3184 WeakPolarHBondContact CG1-ND2 3.32Å; V2863-N3184 PolarHBondContact O-ND2 2.58Å; V2863-N3184 PolarHBondContact O-OD1 3Å; V2863-L3187 HydrophobicContact CB-CD1 4.32Å; V2863-L3187 HydrophobicContact CG1-CD1 4.29Å; V2863-L3187 HydrophobicContact CG2-CD1 4.18Å
2864	L	90.1	Very high	83.1	Confident	8.75 Å²	8.75	63.5 Å²	63.5	5%	0.046	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	139.1	173.5	-178.6	70	0	0	0	108.7	T2841 S2842 L2843 T2862 E2866 T3164 Y3182	T2841-L2864 HydrophobicContact CG2-CD2 4.42Å; S2842-L2864 CarbonylContact C-O 3.52Å; S2842-L2864 WeakPolarHBondContact CA-O 3.23Å; L2843-L2864 HydrophobicContact CB-CB 4Å; L2843-L2864 HydrophobicContact CD1-CB 4.08Å; L2843-L2864 HydrophobicContact CD1-CD2 3.97Å; L2843-L2864 HydrophobicContact CG-CB 4.06Å; L2843-L2864 HydrophobicContact CG-CD2 4.27Å; L2843-L2864 PolarHBondContact N-O 3.05Å; L2843-L2864 PolarHBondContact O-N 2.96Å; L2843-L2864 VanDerWaalsContact O-N 3.12Å; T2862-L2864 WeakPolarHBondContact CG2-O 3.37Å; L2864-E2866 HydrophobicContact CD1-CB 4.32Å; L2864-E2866 HydrophobicContact CD1-CG 4.27Å; L2864-E2866 HydrophobicContact CD2-CG 3.88Å; L2864-E2866 HydrophobicContact CG-CB 4.45Å; L2864-E2866 HydrophobicContact CG-CG 4.03Å; L2864-T3164 HydrophobicContact CD2-CG2 3.68Å; L2864-Y3182 HydrophobicContact CD1-CD1 3.98Å; L2864-Y3182 HydrophobicContact CD1-CD2 4.08Å; L2864-Y3182 HydrophobicContact CD1-CE1 4.43Å; L2864-Y3182 HydrophobicContact CD1-CE2 4.38Å; L2864-Y3182 HydrophobicContact CD1-CG 3.79Å
2865	N	91.5	Very high	84	Confident	100 Å²	100	61.8 Å²	61.8	54%	0.535	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	106.3	168.4	-164.4	28.1	0	0	0	108.5	H2840 T2841 S2842 T2862	H2840-N2865 PolarHBondContact CE1-OD1 2.9Å; H2840-N2865 PolarHBondContact NE2-OD1 3.02Å; H2840-N2865 VanDerWaalsContact NE2-OD1 3.11Å; T2841-N2865 WeakPolarHBondContact O-CA 3.24Å; S2842-N2865 PolarHBondContact OG-OD1 2.84Å; T2862-N2865 HydrophobicContact CG2-CB 4.03Å
2866	E	92.8	Very high	84.8	Confident	15.5 Å²	15.5	58 Å²	58	7%	0.072	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	161.7	-173.7	68	81.2	-154.2	0	0	111.9	H2840 T2841 L2864 S2868 H3155 R3166	H2840-E2866 CarbonylContact C-O 3.55Å; H2840-E2866 WeakPolarHBondContact CA-O 3.36Å; H2840-E2866 PolarHBondContact ND1-O 2.99Å; H2840-E2866 VanDerWaalsContact ND1-O 3.12Å; T2841-E2866 WeakPolarHBondContact CB-OE1 3.39Å; T2841-E2866 PolarHBondContact N-O 3.04Å; T2841-E2866 PolarHBondContact O-N 2.95Å; T2841-E2866 PolarHBondContact OG1-OE1 3.09Å; L2864-E2866 HydrophobicContact CD1-CB 4.32Å; L2864-E2866 HydrophobicContact CD1-CG 4.27Å; L2864-E2866 HydrophobicContact CD2-CG 3.88Å; L2864-E2866 HydrophobicContact CG-CB 4.45Å; L2864-E2866 HydrophobicContact CG-CG 4.03Å; E2866-S2868 PolarHBondContact OE2-N 3.19Å; E2866-S2868 PolarHBondContact OE2-OG 3.39Å; E2866-H3155 IonicContact OE1-CE1 2.83Å; E2866-H3155 IonicContact OE1-NE2 2.96Å; E2866-H3155 PolarHBondContact OE1-NE2 3.17Å; E2866-R3166 IonicContact OE2-CZ 3.07Å; E2866-R3166 IonicContact OE2-NE 2.79Å; E2866-R3166 IonicContact OE2-NH1 2.89Å; E2866-R3166 PolarHBondContact OE2-NH1 2.93Å
2867	E	93.3	Very high	85.6	Confident	115.5 Å²	115.5	56.1 Å²	56.1	54%	0.54	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	126.3	173	-173.4	173.5	-168.8	0	0	110.2	S2838 H2840 R3166	S2838-E2867 WeakPolarHBondContact CB-OE1 3.38Å; H2840-E2867 HydrophobicContact CB-CG 4.42Å; E2867-R3166 PolarHBondContact O-NH1 2.8Å; E2867-R3166 VanDerWaalsContact O-NH1 3.13Å
2868	S	94	Very high	86.3	Confident	17.25 Å²	17.25	55.4 Å²	55.4	12%	0.121	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	132	166.6	72.6	0	0	0	0	109.4	S2838 I2839 E2866 N2883 R3166	S2838-S2868 CarbonylContact C-O 3.56Å; S2838-S2868 WeakPolarHBondContact CA-O 3.32Å; S2838-S2868 VanDerWaalsContact CB-O 3.22Å; S2838-S2868 WeakPolarHBondContact CB-O 3.42Å; I2839-S2868 VanDerWaalsContact CA-OG 3.31Å; I2839-S2868 WeakPolarHBondContact CA-OG 3.3Å; I2839-S2868 WeakPolarHBondContact CB-OG 3.32Å; I2839-S2868 PolarHBondContact N-O 3.09Å; I2839-S2868 PolarHBondContact N-OG 2.79Å; I2839-S2868 PolarHBondContact O-N 3.05Å; I2839-S2868 PolarHBondContact O-OG 3.17Å; E2866-S2868 PolarHBondContact OE2-N 3.19Å; E2866-S2868 PolarHBondContact OE2-OG 3.39Å; S2868-N2883 VanDerWaalsContact CA-OD1 3.27Å; S2868-N2883 WeakPolarHBondContact CA-OD1 3.3Å; S2868-N2883 PolarHBondContact OG-ND2 3.32Å; S2868-N2883 PolarHBondContact OG-OD1 3.3Å; S2868-R3166 VanDerWaalsContact CA-NH1 3.32Å; S2868-R3166 VanDerWaalsContact CB-NH1 3.33Å
2869	S	94.9	Very high	87.4	Confident	55.5 Å²	55.5	50.5 Å²	50.5	39%	0.388	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	144.2	177	60.3	0	0	0	0	111.6	V2837 N2883	V2837-S2869 CarbonylContact O-C 3.48Å; V2837-S2869 VanDerWaalsContact O-CA 3.29Å; V2837-S2869 WeakPolarHBondContact O-CA 3.36Å; S2869-N2883 PolarHBondContact N-OD1 2.93Å; S2869-N2883 PolarHBondContact O-N 2.78Å; S2869-N2883 PolarHBondContact O-OD1 3.02Å
2870	I	94.3	Very high	88.5	Confident	44.75 Å²	44.75	47.9 Å²	47.9	23%	0.229	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	138.3	175.5	3.3	170.9	0	0	0	108.6	L2836 V2837 L2872 V2879 T2881 M2882	L2836-I2870 VanDerWaalsContact O-CD1 3.3Å; L2836-I2870 WeakPolarHBondContact O-CD1 3.32Å; V2837-I2870 HydrophobicContact CB-CG1 4.41Å; V2837-I2870 HydrophobicContact CG1-CG1 4.46Å; V2837-I2870 PolarHBondContact O-N 2.9Å; I2870-L2872 HydrophobicContact CD1-CD2 4.15Å; I2870-L2872 HydrophobicContact CG2-CD2 4.3Å; I2870-L2872 HydrophobicContact CG2-CG 4.31Å; I2870-V2879 HydrophobicContact CB-CG1 4.23Å; I2870-V2879 HydrophobicContact CD1-CG2 4.5Å; I2870-V2879 HydrophobicContact CG2-CB 4.37Å; I2870-V2879 HydrophobicContact CG2-CG1 4.03Å; I2870-V2879 HydrophobicContact CG2-CG2 3.97Å; I2870-T2881 VanDerWaalsContact CA-O 3.26Å; I2870-T2881 WeakPolarHBondContact CA-O 3.37Å; I2870-M2882 HydrophobicContact CD1-CE 3.86Å; I2870-M2882 HydrophobicContact CG1-CE 4.19Å; I2870-M2882 HydrophobicContact CG1-CG 4.32Å; I2870-M2882 HydrophobicContact CG2-CB 4.22Å; I2870-M2882 HydrophobicContact CG2-CE 4.2Å; I2870-M2882 HydrophobicContact CG2-CG 4.03Å
2871	R	94.8	Very high	89.3	Confident	166.5 Å²	166.5	48.9 Å²	48.9	63%	0.628	26%	0.256	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.1	128.5	171	-145.6	179.3	154.5	121.5	-1.3	109.4	V2879 L2880 T2881	R2871-V2879 CarbonylContact O-C 3.5Å; R2871-L2880 VanDerWaalsContact NH1-CD1 3.3Å; R2871-L2880 PolarHBondContact O-N 3.14Å; R2871-T2881 VanDerWaalsContact CB-OG1 3.28Å; R2871-T2881 WeakPolarHBondContact CB-OG1 3.21Å; R2871-T2881 WeakPolarHBondContact CG-OG1 3.29Å; R2871-T2881 PolarHBondContact N-O 3.09Å; R2871-T2881 PolarHBondContact O-N 3.1Å
2872	L	91.9	Very high	89.9	Confident	29.5 Å²	29.5	46.9 Å²	46.9	15%	0.154	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	149.1	178.1	-61	169.3	0	0	0	110.5	N2835 V2837 I2870 S2874 G2877 R2878 V2879 N3379	N2835-L2872 HydrophobicContact CB-CD1 3.5Å; N2835-L2872 WeakPolarHBondContact ND2-CD1 3.28Å; V2837-L2872 HydrophobicContact CG1-CD1 4.31Å; I2870-L2872 HydrophobicContact CD1-CD2 4.15Å; I2870-L2872 HydrophobicContact CG2-CD2 4.3Å; I2870-L2872 HydrophobicContact CG2-CG 4.31Å; L2872-S2874 PolarHBondContact O-N 2.83Å; L2872-G2877 WeakPolarHBondContact CD2-O 3.37Å; L2872-R2878 CarbonylContact C-O 3.56Å; L2872-R2878 VanDerWaalsContact CA-O 3.25Å; L2872-R2878 WeakPolarHBondContact CA-O 3.33Å; L2872-V2879 HydrophobicContact CD2-CB 4.41Å; L2872-V2879 HydrophobicContact CD2-CG2 3.72Å; L2872-N3379 HydrophobicContact CD1-CB 4.44Å
2873	D	88.2	Confident	90.3	Very high	30.5 Å²	30.5	45 Å²	45	16%	0.163	24%	0.235	C	C	.	.			trans	-71.5	122.7	165.2	179.3	-2.9	0	0	0	109.2	L2875 T2876 G2877 R2878 L2880	D2873-L2875 PolarHBondContact O-N 2.78Å; D2873-L2875 VanDerWaalsContact OD1-CB 3.29Å; D2873-L2875 WeakPolarHBondContact OD1-CB 3.45Å; D2873-L2875 PolarHBondContact OD1-N 3.07Å; D2873-T2876 WeakPolarHBondContact CB-OG1 3.24Å; D2873-T2876 VanDerWaalsContact CG-OG1 3.28Å; D2873-T2876 PolarHBondContact OD1-N 3.25Å; D2873-T2876 WeakPolarHBondContact OD2-CB 3.33Å; D2873-T2876 VanDerWaalsContact OD2-CG2 3.3Å; D2873-T2876 WeakPolarHBondContact OD2-CG2 3.23Å; D2873-T2876 PolarHBondContact OD2-N 3.09Å; D2873-T2876 PolarHBondContact OD2-OG1 2.86Å; D2873-G2877 VanDerWaalsContact O-CA 3.27Å; D2873-G2877 WeakPolarHBondContact O-CA 3.42Å; D2873-G2877 PolarHBondContact O-N 3.08Å; D2873-R2878 HydrophobicContact CB-CB 4.5Å; D2873-R2878 PolarHBondContact N-O 3.25Å; D2873-L2880 HydrophobicContact CB-CD1 3.93Å; D2873-L2880 HydrophobicContact CB-CD2 4.16Å; D2873-L2880 HydrophobicContact CB-CG 3.98Å
2874	S	81.5	Confident	90.6	Very high	69 Å²	69	48 Å²	48	48%	0.483	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-21.3	-179.8	56.7	0	0	0	0	113.6	L2872 F3380	L2872-S2874 PolarHBondContact O-N 2.83Å; S2874-F3380 VanDerWaalsContact O-CE1 3.28Å; S2874-F3380 WeakPolarHBondContact O-CE1 3.3Å; S2874-F3380 WeakPolarHBondContact O-CZ 3.06Å
2875	L	81.5	Confident	90.9	Very high	44.75 Å²	44.75	47.8 Å²	47.8	23%	0.234	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-42.3	-177.5	-122.2	88	0	0	0	112.2	Q2509 L2511 H2527 Y2554 D2873 F3375 F3380	Q2509-L2875 VanDerWaalsContact NE2-CD1 3.29Å; L2511-L2875 HydrophobicContact CD2-CB 4.33Å; L2511-L2875 HydrophobicContact CD2-CD1 3.34Å; L2511-L2875 HydrophobicContact CD2-CG 3.81Å; L2511-L2875 WeakPolarHBondContact CD2-O 3.36Å; H2527-L2875 WeakPolarHBondContact CE1-CD2 3.36Å; H2527-L2875 WeakPolarHBondContact NE2-CD2 3.36Å; Y2554-L2875 VanDerWaalsContact OH-CD2 3.25Å; Y2554-L2875 WeakPolarHBondContact OH-CD2 3.12Å; D2873-L2875 PolarHBondContact O-N 2.78Å; D2873-L2875 VanDerWaalsContact OD1-CB 3.29Å; D2873-L2875 WeakPolarHBondContact OD1-CB 3.45Å; D2873-L2875 PolarHBondContact OD1-N 3.07Å; L2875-F3375 VanDerWaalsContact O-CE2 3.27Å; L2875-F3375 WeakPolarHBondContact O-CE2 3.39Å; L2875-F3380 WeakPolarHBondContact O-CZ 3.32Å
2876	T	82.9	Confident	91.1	Very high	14 Å²	14	44.7 Å²	44.7	9%	0.086	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.6	-15.3	-174.1	67.5	0	0	0	0	114.6	Y2554 L2555 D2873 R2878 G3374 N3376 F3380	Y2554-T2876 HydrophobicContact CD1-CG2 4.08Å; Y2554-T2876 HydrophobicContact CE1-CG2 3.91Å; L2555-T2876 HydrophobicContact CD1-CG2 4.2Å; L2555-T2876 HydrophobicContact CG-CG2 4.38Å; D2873-T2876 WeakPolarHBondContact CB-OG1 3.24Å; D2873-T2876 VanDerWaalsContact CG-OG1 3.28Å; D2873-T2876 PolarHBondContact OD1-N 3.25Å; D2873-T2876 WeakPolarHBondContact OD2-CB 3.33Å; D2873-T2876 VanDerWaalsContact OD2-CG2 3.3Å; D2873-T2876 WeakPolarHBondContact OD2-CG2 3.23Å; D2873-T2876 PolarHBondContact OD2-N 3.09Å; D2873-T2876 PolarHBondContact OD2-OG1 2.86Å; T2876-R2878 PolarHBondContact O-N 3.13Å; T2876-R2878 WeakPolarHBondContact OG1-CB 3.49Å; T2876-R2878 WeakPolarHBondContact OG1-CG 3.45Å; T2876-R2878 PolarHBondContact OG1-N 3.11Å; T2876-G3374 WeakPolarHBondContact CB-O 3.38Å; T2876-N3376 PolarHBondContact O-N 2.87Å; T2876-F3380 VanDerWaalsContact C-CE2 3.41Å
2877	G	85	Confident	91.2	Very high	11 Å²	11	44 Å²	44	11%	0.113	23%	0.229	C	C	.	.			trans	73.4	10.5	-176.3	0	0	0	0	0	113.6	L2872 D2873 N3379 F3380	L2872-G2877 WeakPolarHBondContact CD2-O 3.37Å; D2873-G2877 VanDerWaalsContact O-CA 3.27Å; D2873-G2877 WeakPolarHBondContact O-CA 3.42Å; D2873-G2877 PolarHBondContact O-N 3.08Å; G2877-N3379 PolarHBondContact O-ND2 3.26Å; G2877-F3380 VanDerWaalsContact N-CZ 3.27Å
2878	R	88	Confident	91.1	Very high	43.5 Å²	43.5	42.3 Å²	42.3	16%	0.164	22%	0.224	C	C	.	.			trans	-77.2	152.6	178.6	-73.8	179.2	167.7	-179.7	-1.8	112.1	N2553 L2872 D2873 T2876 L2880 Y2889 G3374	N2553-R2878 PolarHBondContact ND2-NH2 3.35Å; N2553-R2878 VanDerWaalsContact ND2-NH2 3.13Å; L2872-R2878 CarbonylContact C-O 3.56Å; L2872-R2878 VanDerWaalsContact CA-O 3.25Å; L2872-R2878 WeakPolarHBondContact CA-O 3.33Å; D2873-R2878 HydrophobicContact CB-CB 4.5Å; D2873-R2878 PolarHBondContact N-O 3.25Å; T2876-R2878 PolarHBondContact O-N 3.13Å; T2876-R2878 WeakPolarHBondContact OG1-CB 3.49Å; T2876-R2878 WeakPolarHBondContact OG1-CG 3.45Å; T2876-R2878 PolarHBondContact OG1-N 3.11Å; R2878-L2880 PolarHBondContact O-N 3.23Å; R2878-Y2889 HydrophobicContact CB-CD2 4.22Å; R2878-Y2889 HydrophobicContact CB-CE2 3.69Å; R2878-Y2889 HydrophobicContact CG-CD2 4.47Å; R2878-Y2889 HydrophobicContact CG-CE1 4.47Å; R2878-Y2889 HydrophobicContact CG-CE2 4.25Å; R2878-Y2889 VanDerWaalsContact NH1-CB 3.3Å; R2878-G3374 VanDerWaalsContact CD-O 3.26Å; R2878-G3374 WeakPolarHBondContact CD-O 3.32Å; R2878-G3374 VanDerWaalsContact CG-O 3.31Å; R2878-G3374 WeakPolarHBondContact CG-O 3.34Å; R2878-G3374 PolarHBondContact NE-O 3.19Å; R2878-G3374 VanDerWaalsContact NE-O 3.12Å
2879	V	91.7	Very high	90.7	Very high	16 Å²	16	42.6 Å²	42.6	10%	0.097	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	111	176	-179.2	0	0	0	0	109.7	I2870 R2871 L2872 T2881 M2882 I2887 Y2889 P3171	I2870-V2879 HydrophobicContact CB-CG1 4.23Å; I2870-V2879 HydrophobicContact CD1-CG2 4.5Å; I2870-V2879 HydrophobicContact CG2-CB 4.37Å; I2870-V2879 HydrophobicContact CG2-CG1 4.03Å; I2870-V2879 HydrophobicContact CG2-CG2 3.97Å; R2871-V2879 CarbonylContact O-C 3.5Å; L2872-V2879 HydrophobicContact CD2-CB 4.41Å; L2872-V2879 HydrophobicContact CD2-CG2 3.72Å; V2879-T2881 WeakPolarHBondContact CG1-O 3.37Å; V2879-M2882 HydrophobicContact CG1-CB 4.37Å; V2879-I2887 HydrophobicContact CB-CD1 4.47Å; V2879-I2887 HydrophobicContact CG1-CD1 3.97Å; V2879-I2887 WeakPolarHBondContact O-CB 3.33Å; V2879-Y2889 PolarHBondContact N-OH 3.04Å; V2879-Y2889 WeakPolarHBondContact O-CE2 3.33Å; V2879-Y2889 PolarHBondContact O-OH 3.05Å; V2879-P3171 HydrophobicContact CB-CB 4.32Å; V2879-P3171 HydrophobicContact CB-CG 4.34Å; V2879-P3171 HydrophobicContact CG2-CB 3.98Å
2880	L	93.2	Very high	90.1	Very high	60.25 Å²	60.25	44.5 Å²	44.5	32%	0.315	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	-39.9	178.8	-65	175.4	0	0	0	112.5	R2871 D2873 R2878 I2887	R2871-L2880 VanDerWaalsContact NH1-CD1 3.3Å; R2871-L2880 PolarHBondContact O-N 3.14Å; D2873-L2880 HydrophobicContact CB-CD1 3.93Å; D2873-L2880 HydrophobicContact CB-CD2 4.16Å; D2873-L2880 HydrophobicContact CB-CG 3.98Å; R2878-L2880 PolarHBondContact O-N 3.23Å; L2880-I2887 PolarHBondContact O-N 3.21Å
2881	T	94.7	Very high	89.1	Confident	35.25 Å²	35.25	43.3 Å²	43.3	22%	0.216	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	145.5	177	65	0	0	0	0	110.3	I2870 R2871 V2879 F2885 T2886	I2870-T2881 VanDerWaalsContact CA-O 3.26Å; I2870-T2881 WeakPolarHBondContact CA-O 3.37Å; R2871-T2881 VanDerWaalsContact CB-OG1 3.28Å; R2871-T2881 WeakPolarHBondContact CB-OG1 3.21Å; R2871-T2881 WeakPolarHBondContact CG-OG1 3.29Å; R2871-T2881 PolarHBondContact N-O 3.09Å; R2871-T2881 PolarHBondContact O-N 3.1Å; V2879-T2881 WeakPolarHBondContact CG1-O 3.37Å; T2881-F2885 CarbonylContact C-O 3.5Å; T2881-F2885 VanDerWaalsContact CA-O 3.25Å; T2881-F2885 WeakPolarHBondContact CA-O 3.36Å; T2881-T2886 HydrophobicContact CG2-CG2 4.22Å
2882	M	93.7	Very high	88.4	Confident	25.5 Å²	25.5	36.1 Å²	36.1	13%	0.126	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	109.1	170.3	179.8	178.1	-72.3	0	0	107	I2870 V2879 E2884 F2885 I2887 L3168 F3177	I2870-M2882 HydrophobicContact CD1-CE 3.86Å; I2870-M2882 HydrophobicContact CG1-CE 4.19Å; I2870-M2882 HydrophobicContact CG1-CG 4.32Å; I2870-M2882 HydrophobicContact CG2-CB 4.22Å; I2870-M2882 HydrophobicContact CG2-CE 4.2Å; I2870-M2882 HydrophobicContact CG2-CG 4.03Å; V2879-M2882 HydrophobicContact CG1-CB 4.37Å; M2882-E2884 PolarHBondContact O-N 3.08Å; M2882-F2885 PolarHBondContact N-O 3Å; M2882-F2885 WeakPolarHBondContact O-CB 3.35Å; M2882-F2885 WeakPolarHBondContact O-CD2 3.36Å; M2882-F2885 PolarHBondContact O-N 3.01Å; M2882-I2887 HydrophobicContact CB-CD1 4.25Å; M2882-L3168 HydrophobicContact CG-CD2 4.44Å; M2882-L3168 HydrophobicContact SD-CB 4.21Å; M2882-L3168 HydrophobicContact SD-CD2 4.05Å; M2882-F3177 HydrophobicContact SD-CE1 3.99Å; M2882-F3177 HydrophobicContact SD-CZ 4.22Å
2883	N	92.5	Very high	88.3	Confident	29.75 Å²	29.75	34.8 Å²	34.8	16%	0.159	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.8	-121.8	-171	-54.7	-30.5	0	0	0	111.2	S2868 S2869 F2885 R3166 E3180	S2868-N2883 VanDerWaalsContact CA-OD1 3.27Å; S2868-N2883 WeakPolarHBondContact CA-OD1 3.3Å; S2868-N2883 PolarHBondContact OG-ND2 3.32Å; S2868-N2883 PolarHBondContact OG-OD1 3.3Å; S2869-N2883 PolarHBondContact N-OD1 2.93Å; S2869-N2883 PolarHBondContact O-N 2.78Å; S2869-N2883 PolarHBondContact O-OD1 3.02Å; N2883-F2885 VanDerWaalsContact C-N 3.31Å; N2883-F2885 PolarHBondContact O-N 2.88Å; N2883-R3166 VanDerWaalsContact ND2-CZ 3.33Å; N2883-R3166 PolarHBondContact ND2-NH1 3.07Å; N2883-R3166 PolarHBondContact ND2-NH2 3.15Å; N2883-R3166 PolarHBondContact OD1-NH1 2.97Å; N2883-R3166 PolarHBondContact OD1-NH2 3.33Å; N2883-E3180 PolarHBondContact ND2-OE1 3.09Å; N2883-E3180 PolarHBondContact ND2-OE2 3.38Å
2884	E	92.4	Very high	88.4	Confident	75.5 Å²	75.5	33.3 Å²	33.3	35%	0.353	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	2.5	179.6	-65.7	175	-174.5	0	0	113.5	M2882 Y2898 L2900 K3224	M2882-E2884 PolarHBondContact O-N 3.08Å; E2884-Y2898 HydrophobicContact CB-CD2 4.17Å; E2884-Y2898 HydrophobicContact CB-CE2 3.76Å; E2884-Y2898 HydrophobicContact CG-CE2 4.49Å; E2884-Y2898 VanDerWaalsContact OE2-CE2 3.23Å; E2884-Y2898 WeakPolarHBondContact OE2-CE2 3.39Å; E2884-Y2898 PolarHBondContact OE2-OH 3.06Å; E2884-L2900 HydrophobicContact CB-CD1 4.36Å; E2884-L2900 VanDerWaalsContact CD-CD1 3.5Å; E2884-L2900 HydrophobicContact CG-CD1 4.03Å; E2884-L2900 WeakPolarHBondContact OE2-CD1 3.28Å; E2884-K3224 IonicContact OE1-NZ 3.25Å; E2884-K3224 PolarHBondContact OE1-NZ 2.8Å; E2884-K3224 IonicContact OE2-NZ 2.93Å; E2884-K3224 PolarHBondContact OE2-NZ 3.14Å
2885	F	95.8	Very high	89	Confident	4.5 Å²	4.5	31.3 Å²	31.3	2%	0.02	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	131.8	179.7	-59.9	-91.4	0	0	0	111.2	T2881 M2882 N2883 I2896 T2897 Y2898 L3168 F3177 A3178 V3226 F3228	T2881-F2885 CarbonylContact C-O 3.5Å; T2881-F2885 VanDerWaalsContact CA-O 3.25Å; T2881-F2885 WeakPolarHBondContact CA-O 3.36Å; M2882-F2885 PolarHBondContact N-O 3Å; M2882-F2885 WeakPolarHBondContact O-CB 3.35Å; M2882-F2885 WeakPolarHBondContact O-CD2 3.36Å; M2882-F2885 PolarHBondContact O-N 3.01Å; N2883-F2885 VanDerWaalsContact C-N 3.31Å; N2883-F2885 PolarHBondContact O-N 2.88Å; F2885-I2896 HydrophobicContact CB-CG2 4.06Å; F2885-I2896 HydrophobicContact CD1-CG2 3.97Å; F2885-I2896 HydrophobicContact CG-CG2 4.36Å; F2885-T2897 CarbonylContact C-O 3.52Å; F2885-T2897 VanDerWaalsContact CA-O 3.31Å; F2885-T2897 WeakPolarHBondContact CA-O 3.35Å; F2885-Y2898 AromaticContact CD1-CD2 3.95Å; F2885-Y2898 HydrophobicContact CD1-CD2 4.03Å; F2885-Y2898 HydrophobicContact CD1-CG 4.34Å; F2885-Y2898 AromaticContact CE1-CD2 3.73Å; F2885-Y2898 HydrophobicContact CE1-CD2 3.73Å; F2885-Y2898 HydrophobicContact CE1-CE2 4.44Å; F2885-Y2898 AromaticContact CE1-CG 3.87Å; F2885-Y2898 HydrophobicContact CE1-CG 3.92Å; F2885-Y2898 HydrophobicContact CE2-CD2 4.26Å; F2885-Y2898 HydrophobicContact CG-CD2 4.44Å; F2885-Y2898 AromaticContact CZ-CD2 3.81Å; F2885-Y2898 HydrophobicContact CZ-CD2 3.89Å; F2885-Y2898 HydrophobicContact CZ-CE2 4.32Å; F2885-Y2898 HydrophobicContact CZ-CG 4.34Å; F2885-L3168 HydrophobicContact CD2-CD1 3.81Å; F2885-L3168 HydrophobicContact CE2-CD1 3.31Å; F2885-L3168 HydrophobicContact CZ-CD1 4.11Å; F2885-F3177 AromaticContact CD1-CE2 3.86Å; F2885-F3177 HydrophobicContact CD1-CE2 3.86Å; F2885-F3177 HydrophobicContact CD1-CZ 4.47Å; F2885-F3177 HydrophobicContact CD2-CE2 4.37Å; F2885-F3177 HydrophobicContact CD2-CZ 4.4Å; F2885-F3177 AromaticContact CE1-CE2 3.94Å; F2885-F3177 HydrophobicContact CE1-CE2 3.99Å; F2885-F3177 HydrophobicContact CE2-CE2 4.49Å; F2885-F3177 HydrophobicContact CG-CE2 4.03Å; F2885-F3177 HydrophobicContact CG-CZ 4.28Å; F2885-F3177 HydrophobicContact CZ-CE2 4.31Å; F2885-A3178 HydrophobicContact CE1-CB 4.17Å; F2885-A3178 HydrophobicContact CE2-CB 4.41Å; F2885-A3178 HydrophobicContact CZ-CB 3.74Å; F2885-V3226 HydrophobicContact CE1-CG1 4.4Å; F2885-V3226 HydrophobicContact CZ-CG1 3.64Å; F2885-F3228 AromaticContact CE1-CE1 3.8Å; F2885-F3228 HydrophobicContact CE1-CE1 3.8Å; F2885-F3228 HydrophobicContact CE1-CZ 4.14Å
2886	T	96.1	Very high	89.6	Confident	34.5 Å²	34.5	29.3 Å²	29.3	21%	0.212	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	134.7	169.3	35.3	0	0	0	0	109.4	T2881 I2896 T2897 N2899	T2881-T2886 HydrophobicContact CG2-CG2 4.22Å; T2886-I2896 CarbonylContact O-C 3.59Å; T2886-I2896 WeakPolarHBondContact O-CA 3.29Å; T2886-T2897 PolarHBondContact N-O 2.91Å; T2886-T2897 PolarHBondContact O-N 2.9Å; T2886-T2897 WeakPolarHBondContact OG1-CB 3.42Å; T2886-T2897 PolarHBondContact OG1-O 2.89Å; T2886-N2899 WeakPolarHBondContact CG2-ND2 3.3Å; T2886-N2899 PolarHBondContact OG1-ND2 2.82Å; T2886-N2899 PolarHBondContact OG1-OD1 3.09Å
2887	I	94.1	Very high	90.2	Very high	0.75 Å²	0.75	29.2 Å²	29.2	0%	0.004	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	112	-175.9	-56.6	-175.7	0	0	0	108.5	V2879 L2880 M2882 Y2889 L2894 H2895 I2896 P3171	V2879-I2887 HydrophobicContact CB-CD1 4.47Å; V2879-I2887 HydrophobicContact CG1-CD1 3.97Å; V2879-I2887 WeakPolarHBondContact O-CB 3.33Å; L2880-I2887 PolarHBondContact O-N 3.21Å; M2882-I2887 HydrophobicContact CB-CD1 4.25Å; I2887-Y2889 HydrophobicContact CB-CE2 4.49Å; I2887-Y2889 HydrophobicContact CG2-CD2 4.37Å; I2887-Y2889 HydrophobicContact CG2-CE1 4.39Å; I2887-Y2889 HydrophobicContact CG2-CE2 3.75Å; I2887-L2894 HydrophobicContact CG2-CD1 3.4Å; I2887-L2894 HydrophobicContact CG2-CG 4.29Å; I2887-H2895 WeakPolarHBondContact CA-O 3.17Å; I2887-I2896 HydrophobicContact CG1-CG1 4.44Å; I2887-I2896 HydrophobicContact CG1-CG2 4.41Å; I2887-P3171 HydrophobicContact CD1-CG 4.24Å
2888	N	91.7	Very high	90.7	Very high	81 Å²	81	29.6 Å²	29.6	43%	0.433	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	123.7	177.8	-67	-26.3	0	0	0	109.6	H2895	N2888-H2895 HydrophobicContact CB-CB 4.29Å; N2888-H2895 PolarHBondContact N-O 3.04Å; N2888-H2895 PolarHBondContact O-N 3.07Å
2889	Y	86	Confident	90.6	Very high	23 Å²	23	31.4 Å²	31.4	9%	0.09	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	141	177.1	-58.4	-97.2	0	0	0	110	L2555 R2878 V2879 I2887 L2894 P3171 I3172	L2555-Y2889 VanDerWaalsContact CD1-C 3.44Å; L2555-Y2889 WeakPolarHBondContact CD1-O 3.38Å; L2555-Y2889 WeakPolarHBondContact CD2-O 3.35Å; L2555-Y2889 WeakPolarHBondContact CG-O 3.42Å; R2878-Y2889 HydrophobicContact CB-CD2 4.22Å; R2878-Y2889 HydrophobicContact CB-CE2 3.69Å; R2878-Y2889 HydrophobicContact CG-CD2 4.47Å; R2878-Y2889 HydrophobicContact CG-CE1 4.47Å; R2878-Y2889 HydrophobicContact CG-CE2 4.25Å; R2878-Y2889 VanDerWaalsContact NH1-CB 3.3Å; V2879-Y2889 PolarHBondContact N-OH 3.04Å; V2879-Y2889 WeakPolarHBondContact O-CE2 3.33Å; V2879-Y2889 PolarHBondContact O-OH 3.05Å; I2887-Y2889 HydrophobicContact CB-CE2 4.49Å; I2887-Y2889 HydrophobicContact CG2-CD2 4.37Å; I2887-Y2889 HydrophobicContact CG2-CE1 4.39Å; I2887-Y2889 HydrophobicContact CG2-CE2 3.75Å; Y2889-L2894 HydrophobicContact CD1-CD1 3.58Å; Y2889-L2894 HydrophobicContact CE1-CD1 3.59Å; Y2889-L2894 VanDerWaalsContact CE1-CD1 3.5Å; Y2889-L2894 HydrophobicContact CG-CD1 4.13Å; Y2889-P3171 VanDerWaalsContact OH-CG 3.23Å; Y2889-P3171 WeakPolarHBondContact OH-CG 3.39Å; Y2889-I3172 HydrophobicContact CD1-CD1 4Å; Y2889-I3172 HydrophobicContact CE1-CD1 3.89Å; Y2889-I3172 HydrophobicContact CE1-CG1 4.05Å
2890	Q	82.3	Confident	90.4	Very high	94.5 Å²	94.5	36.1 Å²	36.1	44%	0.442	19%	0.188	S	C	.	.			trans	-123.3	176.4	165.6	-62.4	-175.3	-25.9	0	0	108.6	N2553 S2892 S2893 H2895	N2553-Q2890 PolarHBondContact ND2-O 2.72Å; Q2890-S2892 VanDerWaalsContact C-N 3.31Å; Q2890-S2892 PolarHBondContact O-N 2.82Å; Q2890-S2893 CarbonylContact C-O 3.56Å; Q2890-S2893 WeakPolarHBondContact CB-OG 3.33Å; Q2890-S2893 PolarHBondContact N-O 3.05Å; Q2890-S2893 PolarHBondContact OE1-OG 2.98Å; Q2890-H2895 PolarHBondContact NE2-NE2 3.27Å; Q2890-H2895 PolarHBondContact OE1-NE2 3.07Å; Q2890-H2895 VanDerWaalsContact OE1-NE2 3.08Å
2891	S	72.4	Confident	90.1	Very high	19.75 Å²	19.75	37.8 Å²	37.8	14%	0.138	19%	0.193	C	C	.	.	S	Bend	trans	-56.5	-42.2	-176.3	-32.1	0	0	0	0	113.8	A2552 N2553	A2552-S2891 WeakPolarHBondContact O-CA 3.37Å; A2552-S2891 WeakPolarHBondContact O-CB 3.32Å; A2552-S2891 PolarHBondContact O-OG 2.94Å; N2553-S2891 WeakPolarHBondContact ND2-CA 3.46Å; N2553-S2891 PolarHBondContact ND2-O 3.12Å; N2553-S2891 PolarHBondContact OD1-OG 3.39Å
2892	S	81	Confident	89.9	Confident	15 Å²	15	39.8 Å²	39.8	11%	0.105	20%	0.202	C	C	.	.	S	Bend	trans	-128.9	15.3	-175	54.5	0	0	0	0	112.8	Q2890 Q2908 W2909	Q2890-S2892 VanDerWaalsContact C-N 3.31Å; Q2890-S2892 PolarHBondContact O-N 2.82Å; S2892-Q2908 CarbonylContact O-C 3.54Å; S2892-Q2908 VanDerWaalsContact O-CA 3.31Å; S2892-Q2908 WeakPolarHBondContact O-CA 3.32Å; S2892-Q2908 VanDerWaalsContact O-CG 3.26Å; S2892-Q2908 WeakPolarHBondContact O-CG 3.27Å; S2892-W2909 VanDerWaalsContact C-CE2 3.41Å; S2892-W2909 VanDerWaalsContact CA-CD1 3.46Å; S2892-W2909 VanDerWaalsContact O-CD1 3.26Å; S2892-W2909 PolarHBondContact O-N 3.23Å; S2892-W2909 PolarHBondContact O-NE1 2.76Å
2893	S	88.5	Confident	89.8	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.014	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	161.3	-179.5	70.1	0	0	0	0	114.1	Q2890 H2895 Y2906 R2907 W2909	Q2890-S2893 CarbonylContact C-O 3.56Å; Q2890-S2893 WeakPolarHBondContact CB-OG 3.33Å; Q2890-S2893 PolarHBondContact N-O 3.05Å; Q2890-S2893 PolarHBondContact OE1-OG 2.98Å; S2893-H2895 PolarHBondContact OG-NE2 2.85Å; S2893-Y2906 VanDerWaalsContact CB-CE2 3.45Å; S2893-Y2906 WeakPolarHBondContact OG-CE2 3.41Å; S2893-R2907 CarbonylContact C-O 3.55Å; S2893-R2907 WeakPolarHBondContact CA-O 3.37Å; S2893-R2907 WeakPolarHBondContact CB-O 3.34Å; S2893-W2909 VanDerWaalsContact C-CZ3 3.47Å; S2893-W2909 VanDerWaalsContact CA-CH2 3.46Å; S2893-W2909 VanDerWaalsContact O-CH2 3.32Å; S2893-W2909 WeakPolarHBondContact O-CH2 3.36Å
2894	L	91	Very high	89.9	Confident	0.25 Å²	0.25	39 Å²	39	0%	0.001	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	129.9	178.2	-176.5	73	0	0	0	108.4	I2887 Y2889 I2896 Y2906 R2907 W2909 D3170 I3172	I2887-L2894 HydrophobicContact CG2-CD1 3.4Å; I2887-L2894 HydrophobicContact CG2-CG 4.29Å; Y2889-L2894 HydrophobicContact CD1-CD1 3.58Å; Y2889-L2894 HydrophobicContact CE1-CD1 3.59Å; Y2889-L2894 VanDerWaalsContact CE1-CD1 3.5Å; Y2889-L2894 HydrophobicContact CG-CD1 4.13Å; L2894-I2896 HydrophobicContact CD2-CD1 3.84Å; L2894-I2896 HydrophobicContact CD2-CG1 3.95Å; L2894-I2896 HydrophobicContact CG-CD1 4.45Å; L2894-I2896 HydrophobicContact CG-CG1 4.02Å; L2894-Y2906 CarbonylContact O-C 3.51Å; L2894-Y2906 WeakPolarHBondContact O-CA 3.29Å; L2894-R2907 HydrophobicContact CB-CB 4.5Å; L2894-R2907 PolarHBondContact N-O 3.06Å; L2894-R2907 PolarHBondContact O-N 2.89Å; L2894-W2909 HydrophobicContact CB-CH2 3.74Å; L2894-W2909 VanDerWaalsContact CB-CH2 3.43Å; L2894-W2909 HydrophobicContact CB-CZ2 3.55Å; L2894-W2909 HydrophobicContact CB-CZ3 3.64Å; L2894-W2909 HydrophobicContact CD2-CH2 4.2Å; L2894-W2909 HydrophobicContact CG-CH2 4.46Å; L2894-D3170 VanDerWaalsContact CD2-OD1 3.25Å; L2894-D3170 WeakPolarHBondContact CD2-OD1 3.28Å; L2894-I3172 HydrophobicContact CB-CD1 4.36Å; L2894-I3172 HydrophobicContact CD1-CD1 4.08Å; L2894-I3172 HydrophobicContact CD2-CD1 4.33Å; L2894-I3172 HydrophobicContact CG-CD1 4.47Å
2895	H	93.6	Very high	90	Very high	26.75 Å²	26.75	35.6 Å²	35.6	12%	0.124	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	115.2	174.7	-61.6	-105.8	0	0	0	108.7	I2887 N2888 Q2890 S2893 Q2904 L2905 Y2906	I2887-H2895 WeakPolarHBondContact CA-O 3.17Å; N2888-H2895 HydrophobicContact CB-CB 4.29Å; N2888-H2895 PolarHBondContact N-O 3.04Å; N2888-H2895 PolarHBondContact O-N 3.07Å; Q2890-H2895 PolarHBondContact NE2-NE2 3.27Å; Q2890-H2895 PolarHBondContact OE1-NE2 3.07Å; Q2890-H2895 VanDerWaalsContact OE1-NE2 3.08Å; S2893-H2895 PolarHBondContact OG-NE2 2.85Å; H2895-Q2904 HydrophobicContact CB-CG 4.44Å; H2895-L2905 CarbonylContact C-O 3.58Å; H2895-L2905 WeakPolarHBondContact CA-O 3.47Å; H2895-Y2906 AromaticContact CD2-CD2 3.91Å; H2895-Y2906 AromaticContact CE1-CD2 3.17Å; H2895-Y2906 WeakPolarHBondContact CE1-CD2 3.29Å; H2895-Y2906 AromaticContact CE1-CE2 3.5Å; H2895-Y2906 VanDerWaalsContact CE1-CE2 3.44Å; H2895-Y2906 WeakPolarHBondContact CE1-CE2 3.36Å; H2895-Y2906 AromaticContact CG-CD2 3.99Å; H2895-Y2906 AromaticContact ND1-CD2 3.56Å; H2895-Y2906 AromaticContact NE2-CD2 3.49Å; H2895-Y2906 WeakPolarHBondContact NE2-CD2 3.33Å; H2895-Y2906 AromaticContact NE2-CE2 3.52Å; H2895-Y2906 WeakPolarHBondContact NE2-CE2 3.46Å
2896	I	95.3	Very high	89.9	Confident	1.75 Å²	1.75	37.2 Å²	37.2	1%	0.009	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	111.4	176.4	-53.5	175.9	0	0	0	107.7	F2885 T2886 I2887 L2894 Q2904 L2905 F3177	F2885-I2896 HydrophobicContact CB-CG2 4.06Å; F2885-I2896 HydrophobicContact CD1-CG2 3.97Å; F2885-I2896 HydrophobicContact CG-CG2 4.36Å; T2886-I2896 CarbonylContact O-C 3.59Å; T2886-I2896 WeakPolarHBondContact O-CA 3.29Å; I2887-I2896 HydrophobicContact CG1-CG1 4.44Å; I2887-I2896 HydrophobicContact CG1-CG2 4.41Å; L2894-I2896 HydrophobicContact CD2-CD1 3.84Å; L2894-I2896 HydrophobicContact CD2-CG1 3.95Å; L2894-I2896 HydrophobicContact CG-CD1 4.45Å; L2894-I2896 HydrophobicContact CG-CG1 4.02Å; I2896-Q2904 CarbonylContact O-C 3.6Å; I2896-Q2904 WeakPolarHBondContact O-CA 3.34Å; I2896-L2905 HydrophobicContact CB-CB 4.4Å; I2896-L2905 HydrophobicContact CD1-CD2 4.35Å; I2896-L2905 PolarHBondContact N-O 3.08Å; I2896-L2905 PolarHBondContact O-N 3.03Å; I2896-F3177 HydrophobicContact CD1-CB 4.21Å; I2896-F3177 HydrophobicContact CD1-CD1 4.09Å; I2896-F3177 HydrophobicContact CD1-CD2 3.84Å; I2896-F3177 HydrophobicContact CD1-CE1 4.35Å; I2896-F3177 HydrophobicContact CD1-CE2 4.26Å; I2896-F3177 HydrophobicContact CD1-CG 3.77Å; I2896-F3177 HydrophobicContact CD1-CZ 4.46Å; I2896-F3177 HydrophobicContact CG2-CD2 3.9Å; I2896-F3177 HydrophobicContact CG2-CE2 3.53Å; I2896-F3177 HydrophobicContact CG2-CZ 4.11Å
2897	T	95.4	Very high	89.7	Confident	12 Å²	12	35.9 Å²	35.9	7%	0.074	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	127.5	-176.3	-48.3	0	0	0	0	110.4	F2885 T2886 N2899 M2903 Q2904 L2923	F2885-T2897 CarbonylContact C-O 3.52Å; F2885-T2897 VanDerWaalsContact CA-O 3.31Å; F2885-T2897 WeakPolarHBondContact CA-O 3.35Å; T2886-T2897 PolarHBondContact N-O 2.91Å; T2886-T2897 PolarHBondContact O-N 2.9Å; T2886-T2897 WeakPolarHBondContact OG1-CB 3.42Å; T2886-T2897 PolarHBondContact OG1-O 2.89Å; T2897-N2899 WeakPolarHBondContact CG2-OD1 3.34Å; T2897-M2903 CarbonylContact C-O 3.54Å; T2897-M2903 WeakPolarHBondContact CA-O 3.4Å; T2897-Q2904 HydrophobicContact CG2-CB 4.34Å; T2897-Q2904 PolarHBondContact OG1-NE2 3.09Å; T2897-L2923 HydrophobicContact CG2-CD1 3.72Å
2898	Y	94.7	Very high	89.7	Confident	20.75 Å²	20.75	37.7 Å²	37.7	8%	0.081	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	101.9	168.4	-175.9	-128.4	0	0	0	109.5	E2884 F2885 L2900 K2901 N2902 M2903 V3226 F3228 E3243	E2884-Y2898 HydrophobicContact CB-CD2 4.17Å; E2884-Y2898 HydrophobicContact CB-CE2 3.76Å; E2884-Y2898 HydrophobicContact CG-CE2 4.49Å; E2884-Y2898 VanDerWaalsContact OE2-CE2 3.23Å; E2884-Y2898 WeakPolarHBondContact OE2-CE2 3.39Å; E2884-Y2898 PolarHBondContact OE2-OH 3.06Å; F2885-Y2898 AromaticContact CD1-CD2 3.95Å; F2885-Y2898 HydrophobicContact CD1-CD2 4.03Å; F2885-Y2898 HydrophobicContact CD1-CG 4.34Å; F2885-Y2898 AromaticContact CE1-CD2 3.73Å; F2885-Y2898 HydrophobicContact CE1-CD2 3.73Å; F2885-Y2898 HydrophobicContact CE1-CE2 4.44Å; F2885-Y2898 AromaticContact CE1-CG 3.87Å; F2885-Y2898 HydrophobicContact CE1-CG 3.92Å; F2885-Y2898 HydrophobicContact CE2-CD2 4.26Å; F2885-Y2898 HydrophobicContact CG-CD2 4.44Å; F2885-Y2898 AromaticContact CZ-CD2 3.81Å; F2885-Y2898 HydrophobicContact CZ-CD2 3.89Å; F2885-Y2898 HydrophobicContact CZ-CE2 4.32Å; F2885-Y2898 HydrophobicContact CZ-CG 4.34Å; Y2898-L2900 VanDerWaalsContact C-N 3.31Å; Y2898-L2900 HydrophobicContact CE1-CB 4.05Å; Y2898-L2900 HydrophobicContact CE2-CB 4.19Å; Y2898-L2900 HydrophobicContact CE2-CD1 4.08Å; Y2898-L2900 HydrophobicContact CE2-CG 4.32Å; Y2898-L2900 PolarHBondContact O-N 3.17Å; Y2898-L2900 WeakPolarHBondContact OH-CD1 3.39Å; Y2898-K2901 HydrophobicContact CD1-CB 3.85Å; Y2898-K2901 HydrophobicContact CD1-CD 4.43Å; Y2898-K2901 HydrophobicContact CD1-CG 4.14Å; Y2898-K2901 HydrophobicContact CE1-CB 3.94Å; Y2898-K2901 HydrophobicContact CE1-CD 3.92Å; Y2898-K2901 HydrophobicContact CE1-CG 3.69Å; Y2898-K2901 PolarHBondContact O-N 2.93Å; Y2898-N2902 PolarHBondContact O-N 3.08Å; Y2898-N2902 VanDerWaalsContact O-N 3.13Å; Y2898-M2903 HydrophobicContact CD1-CE 3.92Å; Y2898-M2903 PolarHBondContact N-O 3.16Å; Y2898-M2903 PolarHBondContact O-N 3.09Å; Y2898-V3226 HydrophobicContact CE1-CB 4.33Å; Y2898-V3226 HydrophobicContact CE1-CG2 4.32Å; Y2898-V3226 HydrophobicContact CE2-CG2 4.17Å; Y2898-V3226 WeakPolarHBondContact OH-CG2 3.42Å; Y2898-F3228 HydrophobicContact CD1-CE2 4.41Å; Y2898-F3228 HydrophobicContact CD1-CZ 4.09Å; Y2898-F3228 HydrophobicContact CG-CZ 4.06Å; Y2898-E3243 HydrophobicContact CE1-CB 4.15Å; Y2898-E3243 PolarHBondContact OH-OE2 2.79Å
2899	N	86.1	Confident	89.5	Confident	81.25 Å²	81.25	34.1 Å²	34.1	43%	0.434	17%	0.168	S	C	.	.	G	3₁₀ helix	trans	-66.2	-33.3	-168.2	-62.2	-23.1	0	0	0	112.8	T2886 T2897 K2901 N2902	T2886-N2899 WeakPolarHBondContact CG2-ND2 3.3Å; T2886-N2899 PolarHBondContact OG1-ND2 2.82Å; T2886-N2899 PolarHBondContact OG1-OD1 3.09Å; T2897-N2899 WeakPolarHBondContact CG2-OD1 3.34Å; N2899-K2901 VanDerWaalsContact C-N 3.28Å; N2899-K2901 PolarHBondContact O-N 3.07Å; N2899-N2902 PolarHBondContact O-N 3.21Å; N2899-N2902 PolarHBondContact O-OD1 3.08Å
2900	L	87.3	Confident	89.5	Confident	113.5 Å²	113.5	33.9 Å²	33.9	59%	0.594	17%	0.168	S	C	*	.	G	3₁₀ helix	trans	-65.8	-28.1	-174.4	-67.4	175.8	0	0	0	113.9	E2884 Y2898	E2884-L2900 HydrophobicContact CB-CD1 4.36Å; E2884-L2900 VanDerWaalsContact CD-CD1 3.5Å; E2884-L2900 HydrophobicContact CG-CD1 4.03Å; E2884-L2900 WeakPolarHBondContact OE2-CD1 3.28Å; Y2898-L2900 VanDerWaalsContact C-N 3.31Å; Y2898-L2900 HydrophobicContact CE1-CB 4.05Å; Y2898-L2900 HydrophobicContact CE2-CB 4.19Å; Y2898-L2900 HydrophobicContact CE2-CD1 4.08Å; Y2898-L2900 HydrophobicContact CE2-CG 4.32Å; Y2898-L2900 PolarHBondContact O-N 3.17Å; Y2898-L2900 WeakPolarHBondContact OH-CD1 3.39Å
2901	K	87.6	Confident	89.5	Confident	97.25 Å²	97.25	31.7 Å²	31.7	42%	0.423	16%	0.159	S	C	.	.	G	3₁₀ helix	trans	-121.2	9.4	179.8	-65.3	-89.6	-175.7	169.4	0	113.5	Y2898 N2899 M2903 N2924 E3243	Y2898-K2901 HydrophobicContact CD1-CB 3.85Å; Y2898-K2901 HydrophobicContact CD1-CD 4.43Å; Y2898-K2901 HydrophobicContact CD1-CG 4.14Å; Y2898-K2901 HydrophobicContact CE1-CB 3.94Å; Y2898-K2901 HydrophobicContact CE1-CD 3.92Å; Y2898-K2901 HydrophobicContact CE1-CG 3.69Å; Y2898-K2901 PolarHBondContact O-N 2.93Å; N2899-K2901 VanDerWaalsContact C-N 3.28Å; N2899-K2901 PolarHBondContact O-N 3.07Å; K2901-M2903 VanDerWaalsContact C-N 3.26Å; K2901-M2903 HydrophobicContact CB-CE 4.08Å; K2901-M2903 HydrophobicContact CB-CG 4.27Å; K2901-M2903 HydrophobicContact CD-CE 4.1Å; K2901-M2903 PolarHBondContact O-N 3.04Å; K2901-N2924 PolarHBondContact O-ND2 2.86Å; K2901-E3243 HydrophobicContact CB-CB 4.41Å; K2901-E3243 VanDerWaalsContact CB-O 3.32Å; K2901-E3243 WeakPolarHBondContact CB-O 3.43Å; K2901-E3243 VanDerWaalsContact CE-OE1 3.28Å; K2901-E3243 WeakPolarHBondContact CE-OE1 3.43Å; K2901-E3243 HydrophobicContact CG-CB 4.06Å; K2901-E3243 HydrophobicContact CG-CG 4.21Å; K2901-E3243 IonicContact NZ-OE1 3.89Å
2902	N	89.3	Confident	89.9	Confident	76.25 Å²	76.25	31.4 Å²	31.4	41%	0.408	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.1	44.7	-178.7	-68.3	-26.8	0	0	0	112.2	Y2898 N2899 L2923 N2924	Y2898-N2902 PolarHBondContact O-N 3.08Å; Y2898-N2902 VanDerWaalsContact O-N 3.13Å; N2899-N2902 PolarHBondContact O-N 3.21Å; N2899-N2902 PolarHBondContact O-OD1 3.08Å; N2902-L2923 HydrophobicContact CB-CB 4.08Å; N2902-L2923 WeakPolarHBondContact O-CA 3.33Å; N2902-L2923 VanDerWaalsContact O-CB 3.24Å; N2902-L2923 WeakPolarHBondContact O-CB 3.35Å; N2902-L2923 PolarHBondContact O-N 3.07Å; N2902-N2924 WeakPolarHBondContact CB-OD1 3.27Å; N2902-N2924 PolarHBondContact ND2-OD1 2.76Å
2903	M	92.4	Very high	89.8	Confident	15 Å²	15	32.7 Å²	32.7	7%	0.074	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	142.1	176.6	-70.2	-91.8	-62.8	0	0	109.5	T2897 Y2898 K2901 L2920 L2930 F3228 E3243	T2897-M2903 CarbonylContact C-O 3.54Å; T2897-M2903 WeakPolarHBondContact CA-O 3.4Å; Y2898-M2903 HydrophobicContact CD1-CE 3.92Å; Y2898-M2903 PolarHBondContact N-O 3.16Å; Y2898-M2903 PolarHBondContact O-N 3.09Å; K2901-M2903 VanDerWaalsContact C-N 3.26Å; K2901-M2903 HydrophobicContact CB-CE 4.08Å; K2901-M2903 HydrophobicContact CB-CG 4.27Å; K2901-M2903 HydrophobicContact CD-CE 4.1Å; K2901-M2903 PolarHBondContact O-N 3.04Å; M2903-L2920 HydrophobicContact CE-CD1 3.96Å; M2903-L2920 HydrophobicContact CE-CD2 3.92Å; M2903-L2920 HydrophobicContact CE-CG 3.9Å; M2903-L2930 HydrophobicContact CE-CD1 3.35Å; M2903-L2930 HydrophobicContact SD-CD1 3.93Å; M2903-F3228 HydrophobicContact CB-CD2 4.45Å; M2903-F3228 HydrophobicContact CB-CE1 4.2Å; M2903-F3228 HydrophobicContact CB-CE2 3.51Å; M2903-F3228 VanDerWaalsContact CB-CE2 3.5Å; M2903-F3228 HydrophobicContact CB-CZ 3.37Å; M2903-F3228 HydrophobicContact CE-CD2 4.12Å; M2903-F3228 HydrophobicContact CE-CE2 4.15Å; M2903-F3228 HydrophobicContact CG-CE2 3.91Å; M2903-F3228 HydrophobicContact CG-CZ 4.26Å; M2903-E3243 WeakPolarHBondContact CG-O 3.41Å
2904	Q	94.2	Very high	89.6	Confident	23.25 Å²	23.25	33.7 Å²	33.7	11%	0.109	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	126.3	-179.9	-178.5	175.3	70.9	0	0	111.6	H2895 I2896 T2897 H2921 L2923	H2895-Q2904 HydrophobicContact CB-CG 4.44Å; I2896-Q2904 CarbonylContact O-C 3.6Å; I2896-Q2904 WeakPolarHBondContact O-CA 3.34Å; T2897-Q2904 HydrophobicContact CG2-CB 4.34Å; T2897-Q2904 PolarHBondContact OG1-NE2 3.09Å; Q2904-H2921 WeakPolarHBondContact CB-NE2 3.5Å; Q2904-H2921 WeakPolarHBondContact CG-NE2 3.49Å; Q2904-H2921 PolarHBondContact N-O 3.02Å; Q2904-H2921 PolarHBondContact O-N 2.96Å; Q2904-H2921 PolarHBondContact O-ND1 3.2Å; Q2904-H2921 PolarHBondContact OE1-CE1 2.98Å; Q2904-H2921 PolarHBondContact OE1-NE2 2.94Å; Q2904-L2923 HydrophobicContact CB-CD1 3.99Å; Q2904-L2923 HydrophobicContact CB-CD2 4.07Å; Q2904-L2923 HydrophobicContact CB-CG 4Å
2905	L	94.9	Very high	89.6	Confident	5.5 Å²	5.5	34.3 Å²	34.3	3%	0.029	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	123.6	167.8	-179	71	0	0	0	109	H2895 I2896 R2907 V2919 L2920 F3177 F3228 I3230	H2895-L2905 CarbonylContact C-O 3.58Å; H2895-L2905 WeakPolarHBondContact CA-O 3.47Å; I2896-L2905 HydrophobicContact CB-CB 4.4Å; I2896-L2905 HydrophobicContact CD1-CD2 4.35Å; I2896-L2905 PolarHBondContact N-O 3.08Å; I2896-L2905 PolarHBondContact O-N 3.03Å; L2905-R2907 HydrophobicContact CG-CG 4.46Å; L2905-V2919 CarbonylContact C-O 3.56Å; L2905-V2919 WeakPolarHBondContact CA-O 3.35Å; L2905-L2920 HydrophobicContact CB-CD1 4.24Å; L2905-L2920 HydrophobicContact CD1-CB 4.44Å; L2905-L2920 HydrophobicContact CD1-CD1 4.3Å; L2905-F3177 HydrophobicContact CD2-CB 3.71Å; L2905-F3177 HydrophobicContact CD2-CD2 4.36Å; L2905-F3177 HydrophobicContact CD2-CG 4.49Å; L2905-F3228 HydrophobicContact CB-CD1 4.46Å; L2905-I3230 HydrophobicContact CD1-CD1 3.39Å
2906	Y	93.1	Very high	89.5	Confident	38 Å²	38	34.9 Å²	34.9	15%	0.149	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	131.4	176.9	167.1	-105.8	0	0	0	109.5	S2893 L2894 H2895 Q2908 C2918 V2919	S2893-Y2906 VanDerWaalsContact CB-CE2 3.45Å; S2893-Y2906 WeakPolarHBondContact OG-CE2 3.41Å; L2894-Y2906 CarbonylContact O-C 3.51Å; L2894-Y2906 WeakPolarHBondContact O-CA 3.29Å; H2895-Y2906 AromaticContact CD2-CD2 3.91Å; H2895-Y2906 AromaticContact CE1-CD2 3.17Å; H2895-Y2906 WeakPolarHBondContact CE1-CD2 3.29Å; H2895-Y2906 AromaticContact CE1-CE2 3.5Å; H2895-Y2906 VanDerWaalsContact CE1-CE2 3.44Å; H2895-Y2906 WeakPolarHBondContact CE1-CE2 3.36Å; H2895-Y2906 AromaticContact CG-CD2 3.99Å; H2895-Y2906 AromaticContact ND1-CD2 3.56Å; H2895-Y2906 AromaticContact NE2-CD2 3.49Å; H2895-Y2906 WeakPolarHBondContact NE2-CD2 3.33Å; H2895-Y2906 AromaticContact NE2-CE2 3.52Å; H2895-Y2906 WeakPolarHBondContact NE2-CE2 3.46Å; Y2906-Q2908 HydrophobicContact CE1-CB 3.88Å; Y2906-Q2908 WeakPolarHBondContact OH-CB 3.26Å; Y2906-Q2908 VanDerWaalsContact OH-CD 3.25Å; Y2906-Q2908 WeakPolarHBondContact OH-CG 3.32Å; Y2906-Q2908 PolarHBondContact OH-OE1 2.97Å; Y2906-C2918 CarbonylContact O-C 3.57Å; Y2906-C2918 VanDerWaalsContact O-CA 3.28Å; Y2906-C2918 WeakPolarHBondContact O-CA 3.38Å; Y2906-V2919 HydrophobicContact CD1-CB 3.99Å; Y2906-V2919 HydrophobicContact CD1-CG2 3.85Å; Y2906-V2919 HydrophobicContact CE1-CG2 4.37Å; Y2906-V2919 PolarHBondContact N-O 3.05Å; Y2906-V2919 PolarHBondContact O-N 3.13Å
2907	R	93.5	Very high	89.5	Confident	5.5 Å²	5.5	37.1 Å²	37.1	2%	0.021	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	134.9	171.1	-65.8	-173.1	-178.2	-179.8	1.4	110	S2893 L2894 L2905 W2909 Q2917 C2918 D3170 V3176 T3231	S2893-R2907 CarbonylContact C-O 3.55Å; S2893-R2907 WeakPolarHBondContact CA-O 3.37Å; S2893-R2907 WeakPolarHBondContact CB-O 3.34Å; L2894-R2907 HydrophobicContact CB-CB 4.5Å; L2894-R2907 PolarHBondContact N-O 3.06Å; L2894-R2907 PolarHBondContact O-N 2.89Å; L2905-R2907 HydrophobicContact CG-CG 4.46Å; R2907-W2909 HydrophobicContact CB-CE3 4.24Å; R2907-W2909 HydrophobicContact CB-CH2 3.74Å; R2907-W2909 HydrophobicContact CB-CZ3 3.38Å; R2907-W2909 HydrophobicContact CG-CZ3 4.44Å; R2907-Q2917 CarbonylContact C-O 3.54Å; R2907-Q2917 WeakPolarHBondContact CA-O 3.39Å; R2907-C2918 HydrophobicContact CG-CB 4.42Å; R2907-D3170 IonicContact CZ-OD2 3.28Å; R2907-D3170 IonicContact NE-OD2 3.86Å; R2907-D3170 VanDerWaalsContact NH1-CB 3.32Å; R2907-D3170 IonicContact NH1-OD2 3.22Å; R2907-D3170 PolarHBondContact NH1-OD2 2.92Å; R2907-V3176 PolarHBondContact NH2-O 3.08Å; R2907-T3231 PolarHBondContact NH2-OG1 2.74Å
2908	Q	92.4	Very high	89.5	Confident	38.75 Å²	38.75	36.8 Å²	36.8	18%	0.181	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	143.8	178.2	-165.8	179.2	-6.7	0	0	110.3	S2892 Y2906 I2915 I2916 Q2917	S2892-Q2908 CarbonylContact O-C 3.54Å; S2892-Q2908 VanDerWaalsContact O-CA 3.31Å; S2892-Q2908 WeakPolarHBondContact O-CA 3.32Å; S2892-Q2908 VanDerWaalsContact O-CG 3.26Å; S2892-Q2908 WeakPolarHBondContact O-CG 3.27Å; Y2906-Q2908 HydrophobicContact CE1-CB 3.88Å; Y2906-Q2908 WeakPolarHBondContact OH-CB 3.26Å; Y2906-Q2908 VanDerWaalsContact OH-CD 3.25Å; Y2906-Q2908 WeakPolarHBondContact OH-CG 3.32Å; Y2906-Q2908 PolarHBondContact OH-OE1 2.97Å; Q2908-I2915 CarbonylContact O-C 3.53Å; Q2908-I2915 WeakPolarHBondContact O-CA 3.36Å; Q2908-I2916 HydrophobicContact CB-CG1 4.06Å; Q2908-I2916 HydrophobicContact CG-CD1 3.94Å; Q2908-I2916 HydrophobicContact CG-CG1 3.95Å; Q2908-I2916 WeakPolarHBondContact O-CG1 3.36Å; Q2908-I2916 PolarHBondContact O-N 2.9Å; Q2908-Q2917 HydrophobicContact CB-CB 3.95Å; Q2908-Q2917 PolarHBondContact N-O 3.22Å; Q2908-Q2917 PolarHBondContact O-N 3.12Å
2909	W	88.3	Confident	89.5	Confident	7 Å²	7	36.1 Å²	36.1	3%	0.027	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	161.3	174.3	42.6	91	0	0	0	111.7	S2892 S2893 L2894 R2907 Q2913 R2914 I2915 I3172 H3173	S2892-W2909 VanDerWaalsContact C-CE2 3.41Å; S2892-W2909 VanDerWaalsContact CA-CD1 3.46Å; S2892-W2909 VanDerWaalsContact O-CD1 3.26Å; S2892-W2909 PolarHBondContact O-N 3.23Å; S2892-W2909 PolarHBondContact O-NE1 2.76Å; S2893-W2909 VanDerWaalsContact C-CZ3 3.47Å; S2893-W2909 VanDerWaalsContact CA-CH2 3.46Å; S2893-W2909 VanDerWaalsContact O-CH2 3.32Å; S2893-W2909 WeakPolarHBondContact O-CH2 3.36Å; L2894-W2909 HydrophobicContact CB-CH2 3.74Å; L2894-W2909 VanDerWaalsContact CB-CH2 3.43Å; L2894-W2909 HydrophobicContact CB-CZ2 3.55Å; L2894-W2909 HydrophobicContact CB-CZ3 3.64Å; L2894-W2909 HydrophobicContact CD2-CH2 4.2Å; L2894-W2909 HydrophobicContact CG-CH2 4.46Å; R2907-W2909 HydrophobicContact CB-CE3 4.24Å; R2907-W2909 HydrophobicContact CB-CH2 3.74Å; R2907-W2909 HydrophobicContact CB-CZ3 3.38Å; R2907-W2909 HydrophobicContact CG-CZ3 4.44Å; W2909-Q2913 VanDerWaalsContact NE1-OE1 3.12Å; W2909-R2914 CarbonylContact C-O 3.54Å; W2909-R2914 WeakPolarHBondContact CA-O 3.31Å; W2909-R2914 VanDerWaalsContact CB-O 3.27Å; W2909-R2914 WeakPolarHBondContact CB-O 3.39Å; W2909-I2915 HydrophobicContact CE3-CG1 4.07Å; W2909-I2915 HydrophobicContact CZ3-CG1 4.42Å; W2909-I3172 HydrophobicContact CH2-CD1 3.37Å; W2909-I3172 HydrophobicContact CZ2-CD1 4.04Å; W2909-I3172 HydrophobicContact CZ3-CD1 3.86Å; W2909-H3173 AromaticContact CE3-CE1 3.78Å
2910	D	86.5	Confident	89.9	Confident	17 Å²	17	32.9 Å²	32.9	9%	0.091	16%	0.159	C	C	.	.			trans	-84.6	-175.5	172.9	67.1	11.8	0	0	0	112.8	R2912 Q2913 R2914 I2916	D2910-R2912 PolarHBondContact O-N 3.24Å; D2910-R2912 VanDerWaalsContact O-N 3.12Å; D2910-R2912 VanDerWaalsContact OD1-C 3.31Å; D2910-R2912 WeakPolarHBondContact OD1-CA 3.24Å; D2910-R2912 PolarHBondContact OD1-N 3.16Å; D2910-Q2913 PolarHBondContact O-N 3.18Å; D2910-Q2913 VanDerWaalsContact O-N 3.08Å; D2910-Q2913 PolarHBondContact OD1-N 3.18Å; D2910-Q2913 VanDerWaalsContact OD1-N 3.13Å; D2910-R2914 PolarHBondContact N-O 3.24Å; D2910-R2914 WeakPolarHBondContact OD1-CB 3.33Å; D2910-R2914 PolarHBondContact OD1-N 3.11Å; D2910-R2914 IonicContact OD1-NE 3.23Å; D2910-R2914 IonicContact OD2-CZ 3.5Å; D2910-R2914 IonicContact OD2-NE 3.15Å; D2910-R2914 PolarHBondContact OD2-NE 3.23Å; D2910-R2914 IonicContact OD2-NH2 3.06Å; D2910-R2914 PolarHBondContact OD2-NH2 2.85Å; D2910-I2916 HydrophobicContact CB-CG2 3.89Å
2911	D	81.6	Confident	90.2	Very high	48.25 Å²	48.25	29.1 Å²	29.1	26%	0.258	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-16.7	178.3	61.9	-11.4	0	0	0	113.7	I2572 R2573 P2574 A2575	I2572-D2911 HydrophobicContact CG2-CB 3.78Å; R2573-D2911 WeakPolarHBondContact O-CA 3.18Å; R2573-D2911 WeakPolarHBondContact O-CB 3.4Å; P2574-D2911 CarbonylContact C-O 3.51Å; P2574-D2911 VanDerWaalsContact CA-O 3.27Å; P2574-D2911 WeakPolarHBondContact CA-O 3.38Å; A2575-D2911 HydrophobicContact CB-CB 3.88Å; A2575-D2911 PolarHBondContact N-O 3.05Å
2912	R	80.3	Confident	90.3	Very high	13.5 Å²	13.5	25 Å²	25	5%	0.051	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.3	13.6	175.8	-68.6	179.2	-11.8	-173.8	-10.6	113.1	A2575 W2592 T2595 Y2597 D2910 R2914 P2939 A2941	A2575-R2912 HydrophobicContact CB-CG 4.17Å; W2592-R2912 HydrophobicContact CD2-CG 4.23Å; W2592-R2912 HydrophobicContact CH2-CB 4.38Å; W2592-R2912 HydrophobicContact CZ2-CB 4.19Å; W2592-R2912 HydrophobicContact CZ2-CG 4.27Å; T2595-R2912 PolarHBondContact OG1-NE 3.01Å; T2595-R2912 PolarHBondContact OG1-NH1 3.04Å; Y2597-R2912 PolarHBondContact OH-NH2 2.66Å; D2910-R2912 PolarHBondContact O-N 3.24Å; D2910-R2912 VanDerWaalsContact O-N 3.12Å; D2910-R2912 VanDerWaalsContact OD1-C 3.31Å; D2910-R2912 WeakPolarHBondContact OD1-CA 3.24Å; D2910-R2912 PolarHBondContact OD1-N 3.16Å; R2912-R2914 VanDerWaalsContact C-N 3.26Å; R2912-R2914 HydrophobicContact CB-CG 4.34Å; R2912-R2914 VanDerWaalsContact CZ-CZ 3.46Å; R2912-R2914 VanDerWaalsContact CZ-NH2 3.26Å; R2912-R2914 PolarHBondContact O-N 2.99Å; R2912-P2939 PolarHBondContact NH1-O 2.84Å; R2912-P2939 PolarHBondContact NH2-O 2.86Å; R2912-A2941 PolarHBondContact NH1-O 3.41Å; R2912-A2941 PolarHBondContact NH2-O 3.15Å
2913	Q	80.1	Confident	90.2	Very high	44 Å²	44	24 Å²	24	21%	0.206	12%	0.116	C	C	.	.	S	Bend	trans	63.4	27	178.8	-59.4	-73.7	-20.5	0	0	113.7	W2909 D2910 Q3372	W2909-Q2913 VanDerWaalsContact NE1-OE1 3.12Å; D2910-Q2913 PolarHBondContact O-N 3.18Å; D2910-Q2913 VanDerWaalsContact O-N 3.08Å; D2910-Q2913 PolarHBondContact OD1-N 3.18Å; D2910-Q2913 VanDerWaalsContact OD1-N 3.13Å; Q2913-Q3372 HydrophobicContact CG-CG 4.2Å
2914	R	84.7	Confident	89.6	Confident	21.5 Å²	21.5	28.1 Å²	28.1	8%	0.081	14%	0.138	C	C	.	.			trans	-92.5	134.8	172.9	-54.2	176.6	-62.1	179.8	4.7	109.1	W2909 D2910 R2912 I2916 Y2937 Q2938 A2941 L2942 L3355	W2909-R2914 CarbonylContact C-O 3.54Å; W2909-R2914 WeakPolarHBondContact CA-O 3.31Å; W2909-R2914 VanDerWaalsContact CB-O 3.27Å; W2909-R2914 WeakPolarHBondContact CB-O 3.39Å; D2910-R2914 PolarHBondContact N-O 3.24Å; D2910-R2914 WeakPolarHBondContact OD1-CB 3.33Å; D2910-R2914 PolarHBondContact OD1-N 3.11Å; D2910-R2914 IonicContact OD1-NE 3.23Å; D2910-R2914 IonicContact OD2-CZ 3.5Å; D2910-R2914 IonicContact OD2-NE 3.15Å; D2910-R2914 PolarHBondContact OD2-NE 3.23Å; D2910-R2914 IonicContact OD2-NH2 3.06Å; D2910-R2914 PolarHBondContact OD2-NH2 2.85Å; R2912-R2914 VanDerWaalsContact C-N 3.26Å; R2912-R2914 HydrophobicContact CB-CG 4.34Å; R2912-R2914 VanDerWaalsContact CZ-CZ 3.46Å; R2912-R2914 VanDerWaalsContact CZ-NH2 3.26Å; R2912-R2914 PolarHBondContact O-N 2.99Å; R2914-I2916 PolarHBondContact O-N 3Å; R2914-Y2937 HydrophobicContact CB-CD2 4.4Å; R2914-Y2937 HydrophobicContact CB-CE1 4.2Å; R2914-Y2937 HydrophobicContact CB-CE2 4Å; R2914-Y2937 VanDerWaalsContact CZ-CB 3.49Å; R2914-Y2937 VanDerWaalsContact CZ-CG 3.45Å; R2914-Y2937 VanDerWaalsContact NH1-CB 3.26Å; R2914-Y2937 VanDerWaalsContact NH2-CB 3.26Å; R2914-Q2938 PolarHBondContact NH1-O 2.86Å; R2914-Q2938 VanDerWaalsContact NH1-O 3.1Å; R2914-A2941 PolarHBondContact NH1-O 2.87Å; R2914-L2942 HydrophobicContact CG-CD2 4.25Å; R2914-L2942 PolarHBondContact NH1-O 3.08Å; R2914-L3355 HydrophobicContact CG-CD2 4.36Å
2915	I	89.4	Confident	88.3	Confident	13.25 Å²	13.25	31.2 Å²	31.2	7%	0.068	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	119.7	178.4	-61.5	174	0	0	0	109.4	Q2908 W2909 C2918 L2935 Y2937 H3173	Q2908-I2915 CarbonylContact O-C 3.53Å; Q2908-I2915 WeakPolarHBondContact O-CA 3.36Å; W2909-I2915 HydrophobicContact CE3-CG1 4.07Å; W2909-I2915 HydrophobicContact CZ3-CG1 4.42Å; I2915-C2918 VanDerWaalsContact CG2-SG 3.55Å; I2915-L2935 HydrophobicContact CB-CD1 4.48Å; I2915-L2935 HydrophobicContact CG2-CD1 4.26Å; I2915-L2935 WeakPolarHBondContact O-CD1 3.35Å; I2915-Y2937 VanDerWaalsContact O-CE2 3.28Å; I2915-Y2937 WeakPolarHBondContact O-CE2 3.41Å; I2915-Y2937 PolarHBondContact O-OH 3.21Å; I2915-H3173 HydrophobicContact CD1-CB 4.48Å
2916	I	92.9	Very high	87.1	Confident	39.75 Å²	39.75	42.2 Å²	42.2	20%	0.204	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	-20.9	175.2	58.5	173.9	0	0	0	112.6	Q2908 D2910 R2914 S2934 L2935 Y2937	Q2908-I2916 HydrophobicContact CB-CG1 4.06Å; Q2908-I2916 HydrophobicContact CG-CD1 3.94Å; Q2908-I2916 HydrophobicContact CG-CG1 3.95Å; Q2908-I2916 WeakPolarHBondContact O-CG1 3.36Å; Q2908-I2916 PolarHBondContact O-N 2.9Å; D2910-I2916 HydrophobicContact CB-CG2 3.89Å; R2914-I2916 PolarHBondContact O-N 3Å; I2916-S2934 CarbonylContact O-C 3.54Å; I2916-S2934 VanDerWaalsContact O-CA 3.3Å; I2916-S2934 WeakPolarHBondContact O-CA 3.38Å; I2916-L2935 PolarHBondContact O-N 3.21Å; I2916-Y2937 HydrophobicContact CG2-CD2 4.1Å; I2916-Y2937 HydrophobicContact CG2-CE2 3.91Å
2917	Q	94.1	Very high	86.4	Confident	48.75 Å²	48.75	48.9 Å²	48.9	23%	0.228	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	142.3	178.5	-149.8	-178.4	4.4	0	0	112.3	R2907 Q2908 V2919 N2932 L2933	R2907-Q2917 CarbonylContact C-O 3.54Å; R2907-Q2917 WeakPolarHBondContact CA-O 3.39Å; Q2908-Q2917 HydrophobicContact CB-CB 3.95Å; Q2908-Q2917 PolarHBondContact N-O 3.22Å; Q2908-Q2917 PolarHBondContact O-N 3.12Å; Q2917-V2919 VanDerWaalsContact CD-CG2 3.47Å; Q2917-V2919 HydrophobicContact CG-CG2 3.71Å; Q2917-N2932 WeakPolarHBondContact CG-OD1 2.97Å; Q2917-N2932 PolarHBondContact NE2-ND2 2.79Å; Q2917-N2932 PolarHBondContact NE2-OD1 2.93Å; Q2917-L2933 CarbonylContact C-O 3.51Å; Q2917-L2933 VanDerWaalsContact CA-O 3.23Å; Q2917-L2933 WeakPolarHBondContact CA-O 3.12Å; Q2917-L2933 VanDerWaalsContact CG-O 3.27Å; Q2917-L2933 WeakPolarHBondContact CG-O 3.34Å
2918	C	95.4	Very high	85.9	Confident	4 Å²	4	53.1 Å²	53.1	3%	0.027	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	116.6	169.3	-153.9	0	0	0	0	108.5	Y2906 R2907 I2915 L2933 I3230	Y2906-C2918 CarbonylContact O-C 3.57Å; Y2906-C2918 VanDerWaalsContact O-CA 3.28Å; Y2906-C2918 WeakPolarHBondContact O-CA 3.38Å; R2907-C2918 HydrophobicContact CG-CB 4.42Å; I2915-C2918 VanDerWaalsContact CG2-SG 3.55Å; C2918-L2933 HydrophobicContact CB-CB 4.15Å; C2918-L2933 HydrophobicContact CB-CD2 4.5Å; C2918-L2933 PolarHBondContact N-O 2.96Å; C2918-L2933 WeakPolarHBondContact O-CB 3.26Å; C2918-L2933 PolarHBondContact O-N 3.18Å; C2918-I3230 HydrophobicContact CB-CG2 4.45Å
2919	V	95.1	Very high	85.6	Confident	7.5 Å²	7.5	54.5 Å²	54.5	5%	0.045	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	133.5	-172.4	-172.1	0	0	0	0	110.3	L2905 Y2906 Q2917 H2921 L2929 Y2931 N2932	L2905-V2919 CarbonylContact C-O 3.56Å; L2905-V2919 WeakPolarHBondContact CA-O 3.35Å; Y2906-V2919 HydrophobicContact CD1-CB 3.99Å; Y2906-V2919 HydrophobicContact CD1-CG2 3.85Å; Y2906-V2919 HydrophobicContact CE1-CG2 4.37Å; Y2906-V2919 PolarHBondContact N-O 3.05Å; Y2906-V2919 PolarHBondContact O-N 3.13Å; Q2917-V2919 VanDerWaalsContact CD-CG2 3.47Å; Q2917-V2919 HydrophobicContact CG-CG2 3.71Å; V2919-H2921 HydrophobicContact CG1-CB 4.4Å; V2919-H2921 WeakPolarHBondContact CG1-CE1 3.42Å; V2919-H2921 VanDerWaalsContact CG1-NE2 3.3Å; V2919-H2921 WeakPolarHBondContact CG1-NE2 3.45Å; V2919-L2929 HydrophobicContact CG1-CD1 3.28Å; V2919-L2929 VanDerWaalsContact CG1-CD1 3.41Å; V2919-L2929 HydrophobicContact CG1-CD2 3.36Å; V2919-Y2931 CarbonylContact C-O 3.53Å; V2919-Y2931 VanDerWaalsContact CA-O 3.31Å; V2919-Y2931 WeakPolarHBondContact CA-O 3.45Å; V2919-Y2931 VanDerWaalsContact CG1-O 3.31Å; V2919-Y2931 WeakPolarHBondContact CG1-O 3.36Å; V2919-N2932 WeakPolarHBondContact CG2-OD1 3.38Å
2920	L	95	Very high	85.8	Confident	13.75 Å²	13.75	55 Å²	55	7%	0.072	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	125.8	170.3	-173.8	68.7	0	0	0	109.5	M2903 L2905 L2930 Y2931 F3228 I3230 F3241	M2903-L2920 HydrophobicContact CE-CD1 3.96Å; M2903-L2920 HydrophobicContact CE-CD2 3.92Å; M2903-L2920 HydrophobicContact CE-CG 3.9Å; L2905-L2920 HydrophobicContact CB-CD1 4.24Å; L2905-L2920 HydrophobicContact CD1-CB 4.44Å; L2905-L2920 HydrophobicContact CD1-CD1 4.3Å; L2920-L2930 HydrophobicContact CB-CB 4.44Å; L2920-L2930 HydrophobicContact CD2-CB 4.31Å; L2920-L2930 HydrophobicContact CD2-CD1 4.16Å; L2920-L2930 HydrophobicContact CG-CB 4.36Å; L2920-L2930 HydrophobicContact CG-CD1 4.2Å; L2920-L2930 WeakPolarHBondContact O-CB 3.31Å; L2920-L2930 PolarHBondContact O-N 3Å; L2920-Y2931 PolarHBondContact N-O 3.11Å; L2920-Y2931 PolarHBondContact O-N 3.14Å; L2920-Y2931 VanDerWaalsContact O-N 3.09Å; L2920-F3228 HydrophobicContact CD1-CB 3.94Å; L2920-F3228 HydrophobicContact CD1-CD1 3.95Å; L2920-F3228 HydrophobicContact CD1-CD2 4.42Å; L2920-F3228 HydrophobicContact CD1-CG 3.83Å; L2920-F3228 HydrophobicContact CD2-CB 4.14Å; L2920-I3230 HydrophobicContact CB-CD1 3.95Å; L2920-I3230 HydrophobicContact CD2-CD1 4.43Å; L2920-F3241 HydrophobicContact CD2-CB 3.53Å; L2920-F3241 HydrophobicContact CD2-CD1 4.13Å; L2920-F3241 HydrophobicContact CD2-CD2 3.6Å; L2920-F3241 HydrophobicContact CD2-CE2 4.31Å; L2920-F3241 HydrophobicContact CD2-CG 3.48Å; L2920-F3241 VanDerWaalsContact CD2-CG 3.48Å
2921	H	92.6	Very high	86.2	Confident	33.5 Å²	33.5	54.9 Å²	54.9	16%	0.155	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	150.6	177.9	-0.2	176.7	0	0	0	112.1	Q2904 V2919 E2928 L2929	Q2904-H2921 WeakPolarHBondContact CB-NE2 3.5Å; Q2904-H2921 WeakPolarHBondContact CG-NE2 3.49Å; Q2904-H2921 PolarHBondContact N-O 3.02Å; Q2904-H2921 PolarHBondContact O-N 2.96Å; Q2904-H2921 PolarHBondContact O-ND1 3.2Å; Q2904-H2921 PolarHBondContact OE1-CE1 2.98Å; Q2904-H2921 PolarHBondContact OE1-NE2 2.94Å; V2919-H2921 HydrophobicContact CG1-CB 4.4Å; V2919-H2921 WeakPolarHBondContact CG1-CE1 3.42Å; V2919-H2921 VanDerWaalsContact CG1-NE2 3.3Å; V2919-H2921 WeakPolarHBondContact CG1-NE2 3.45Å; H2921-E2928 CarbonylContact C-O 3.53Å; H2921-E2928 VanDerWaalsContact CA-O 3.26Å; H2921-E2928 WeakPolarHBondContact CA-O 3.31Å; H2921-E2928 VanDerWaalsContact CB-O 3.24Å; H2921-E2928 WeakPolarHBondContact CB-O 3.37Å; H2921-L2929 HydrophobicContact CB-CD2 4.48Å
2922	S	90.7	Very high	86.8	Confident	11.5 Å²	11.5	53.3 Å²	53.3	8%	0.08	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	122.7	164.3	178.5	0	0	0	0	109.6	N2924 S2925 R2927 E2928	S2922-N2924 VanDerWaalsContact C-N 3.35Å; S2922-N2924 PolarHBondContact O-N 2.87Å; S2922-N2924 VanDerWaalsContact O-N 3.15Å; S2922-N2924 PolarHBondContact OG-N 3.4Å; S2922-N2924 PolarHBondContact OG-ND2 3.07Å; S2922-S2925 CarbonylContact O-C 3.33Å; S2922-S2925 PolarHBondContact O-N 2.81Å; S2922-R2927 CarbonylContact O-C 3.49Å; S2922-R2927 VanDerWaalsContact O-CA 3.23Å; S2922-R2927 WeakPolarHBondContact O-CA 3.32Å; S2922-E2928 PolarHBondContact N-O 3.09Å; S2922-E2928 PolarHBondContact O-N 3.08Å
2923	L	86.1	Confident	87.5	Confident	54 Å²	54	53 Å²	53	28%	0.283	25%	0.249	S	C	.	.			trans	-78.2	2.1	176.1	-60.9	172.1	0	0	0	112.8	T2897 N2902 Q2904 S2925 R2927	T2897-L2923 HydrophobicContact CG2-CD1 3.72Å; N2902-L2923 HydrophobicContact CB-CB 4.08Å; N2902-L2923 WeakPolarHBondContact O-CA 3.33Å; N2902-L2923 VanDerWaalsContact O-CB 3.24Å; N2902-L2923 WeakPolarHBondContact O-CB 3.35Å; N2902-L2923 PolarHBondContact O-N 3.07Å; Q2904-L2923 HydrophobicContact CB-CD1 3.99Å; Q2904-L2923 HydrophobicContact CB-CD2 4.07Å; Q2904-L2923 HydrophobicContact CB-CG 4Å; L2923-S2925 VanDerWaalsContact C-N 3.3Å; L2923-S2925 PolarHBondContact O-N 3.22Å; L2923-R2927 HydrophobicContact CD2-CG 3.98Å
2924	N	79.8	Confident	88.3	Confident	101.5 Å²	101.5	52.4 Å²	52.4	54%	0.543	25%	0.25	S	S	.	.	S	Bend	trans	-64.5	-109.4	170.2	-65.6	-26.6	0	0	0	111.1	K2901 N2902 S2922 R2926 R2927	K2901-N2924 PolarHBondContact O-ND2 2.86Å; N2902-N2924 WeakPolarHBondContact CB-OD1 3.27Å; N2902-N2924 PolarHBondContact ND2-OD1 2.76Å; S2922-N2924 VanDerWaalsContact C-N 3.35Å; S2922-N2924 PolarHBondContact O-N 2.87Å; S2922-N2924 VanDerWaalsContact O-N 3.15Å; S2922-N2924 PolarHBondContact OG-N 3.4Å; S2922-N2924 PolarHBondContact OG-ND2 3.07Å; N2924-R2926 PolarHBondContact O-N 3.15Å; N2924-R2927 PolarHBondContact O-N 2.85Å
2925	S	67.6	Low	88.8	Confident	88 Å²	88	52.2 Å²	52.2	62%	0.615	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	43	-170.3	71.2	0	0	0	0	114.7	S2922 L2923 R2927 E2928	S2922-S2925 CarbonylContact O-C 3.33Å; S2922-S2925 PolarHBondContact O-N 2.81Å; L2923-S2925 VanDerWaalsContact C-N 3.3Å; L2923-S2925 PolarHBondContact O-N 3.22Å; S2925-R2927 PolarHBondContact O-N 2.88Å; S2925-E2928 WeakPolarHBondContact O-CB 3.38Å; S2925-E2928 PolarHBondContact O-N 3.15Å; S2925-E2928 PolarHBondContact OG-OE2 3.48Å
2926	R	70.8	Confident	88.9	Confident	236.25 Å²	236.25	53.7 Å²	53.7	89%	0.892	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	10.1	176.1	-62.5	-171.1	-172.6	-174.6	1.7	115.9	N2924	N2924-R2926 PolarHBondContact O-N 3.15Å
2927	R	76.6	Confident	88.7	Confident	180.25 Å²	180.25	53.5 Å²	53.5	68%	0.68	26%	0.259	S	S	*	.			trans	33	43.2	-177	-68.7	-170.9	178.9	-179.6	0.4	112.7	S2922 L2923 N2924 S2925 L2929	S2922-R2927 CarbonylContact O-C 3.49Å; S2922-R2927 VanDerWaalsContact O-CA 3.23Å; S2922-R2927 WeakPolarHBondContact O-CA 3.32Å; L2923-R2927 HydrophobicContact CD2-CG 3.98Å; N2924-R2927 PolarHBondContact O-N 2.85Å; S2925-R2927 PolarHBondContact O-N 2.88Å; R2927-L2929 PolarHBondContact O-N 2.99Å
2928	E	83	Confident	88	Confident	93.25 Å²	93.25	54 Å²	54	44%	0.436	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	118.8	-179.8	-157.7	168.3	-153.2	0	0	111.1	H2921 S2922 S2925 L2930	H2921-E2928 CarbonylContact C-O 3.53Å; H2921-E2928 VanDerWaalsContact CA-O 3.26Å; H2921-E2928 WeakPolarHBondContact CA-O 3.31Å; H2921-E2928 VanDerWaalsContact CB-O 3.24Å; H2921-E2928 WeakPolarHBondContact CB-O 3.37Å; S2922-E2928 PolarHBondContact N-O 3.09Å; S2922-E2928 PolarHBondContact O-N 3.08Å; S2925-E2928 WeakPolarHBondContact O-CB 3.38Å; S2925-E2928 PolarHBondContact O-N 3.15Å; S2925-E2928 PolarHBondContact OG-OE2 3.48Å; E2928-L2930 HydrophobicContact CG-CD2 4.45Å; E2928-L2930 PolarHBondContact O-N 2.88Å
2929	L	87.9	Confident	86.9	Confident	68 Å²	68	57.6 Å²	57.6	36%	0.356	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	117.1	177.2	-163	90.1	0	0	0	109.8	V2919 H2921 R2927 N2932	V2919-L2929 HydrophobicContact CG1-CD1 3.28Å; V2919-L2929 VanDerWaalsContact CG1-CD1 3.41Å; V2919-L2929 HydrophobicContact CG1-CD2 3.36Å; H2921-L2929 HydrophobicContact CB-CD2 4.48Å; R2927-L2929 PolarHBondContact O-N 2.99Å; L2929-N2932 HydrophobicContact CD1-CB 4.08Å; L2929-N2932 HydrophobicContact CD2-CB 4.2Å
2930	L	91.8	Very high	85.8	Confident	16.5 Å²	16.5	60.2 Å²	60.2	9%	0.086	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	-40.5	177.1	-60.5	174.6	0	0	0	111.6	M2903 L2920 E2928 E2952 F3241	M2903-L2930 HydrophobicContact CE-CD1 3.35Å; M2903-L2930 HydrophobicContact SD-CD1 3.93Å; L2920-L2930 HydrophobicContact CB-CB 4.44Å; L2920-L2930 HydrophobicContact CD2-CB 4.31Å; L2920-L2930 HydrophobicContact CD2-CD1 4.16Å; L2920-L2930 HydrophobicContact CG-CB 4.36Å; L2920-L2930 HydrophobicContact CG-CD1 4.2Å; L2920-L2930 WeakPolarHBondContact O-CB 3.31Å; L2920-L2930 PolarHBondContact O-N 3Å; E2928-L2930 HydrophobicContact CG-CD2 4.45Å; E2928-L2930 PolarHBondContact O-N 2.88Å; L2930-E2952 VanDerWaalsContact CD2-OE2 3.28Å; L2930-E2952 WeakPolarHBondContact CD2-OE2 3.16Å; L2930-E2952 PolarHBondContact O-N 3.34Å; L2930-E2952 VanDerWaalsContact O-N 3.12Å; L2930-F3241 HydrophobicContact CB-CD1 4.48Å; L2930-F3241 HydrophobicContact CB-CE1 4.2Å
2931	Y	94	Very high	84.7	Confident	15.5 Å²	15.5	59.7 Å²	59.7	6%	0.061	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	136.9	179.3	-165.4	-89	0	0	0	110.7	V2919 L2920 L2933 E2949 E2950 R2951 I3230 T3238 A3239 F3241	V2919-Y2931 CarbonylContact C-O 3.53Å; V2919-Y2931 VanDerWaalsContact CA-O 3.31Å; V2919-Y2931 WeakPolarHBondContact CA-O 3.45Å; V2919-Y2931 VanDerWaalsContact CG1-O 3.31Å; V2919-Y2931 WeakPolarHBondContact CG1-O 3.36Å; L2920-Y2931 PolarHBondContact N-O 3.11Å; L2920-Y2931 PolarHBondContact O-N 3.14Å; L2920-Y2931 VanDerWaalsContact O-N 3.09Å; Y2931-L2933 HydrophobicContact CD1-CB 4.44Å; Y2931-L2933 HydrophobicContact CE1-CB 3.88Å; Y2931-L2933 HydrophobicContact CE1-CD1 4.3Å; Y2931-E2949 HydrophobicContact CE2-CG 3.85Å; Y2931-E2949 VanDerWaalsContact CE2-OE1 3.28Å; Y2931-E2949 WeakPolarHBondContact CE2-OE1 3.25Å; Y2931-E2949 WeakPolarHBondContact OH-CG 3.35Å; Y2931-E2949 PolarHBondContact OH-OE1 2.88Å; Y2931-E2949 PolarHBondContact OH-OE2 3.02Å; Y2931-E2950 CarbonylContact C-O 3.52Å; Y2931-E2950 WeakPolarHBondContact CA-O 3.37Å; Y2931-R2951 HydrophobicContact CD2-CG 3.62Å; Y2931-R2951 VanDerWaalsContact CD2-CG 3.49Å; Y2931-R2951 HydrophobicContact CE2-CG 3.71Å; Y2931-R2951 PolarHBondContact OH-NH2 2.83Å; Y2931-I3230 HydrophobicContact CD1-CB 4.4Å; Y2931-I3230 HydrophobicContact CD1-CG1 4.18Å; Y2931-I3230 HydrophobicContact CD1-CG2 3.83Å; Y2931-I3230 HydrophobicContact CE1-CB 4.4Å; Y2931-I3230 HydrophobicContact CE1-CG2 3.77Å; Y2931-I3230 HydrophobicContact CG-CG1 4.28Å; Y2931-T3238 PolarHBondContact OH-OG1 2.76Å; Y2931-A3239 HydrophobicContact CD2-CB 4.04Å; Y2931-A3239 HydrophobicContact CE2-CB 3.73Å; Y2931-F3241 AromaticContact CD2-CE2 3.63Å; Y2931-F3241 HydrophobicContact CD2-CE2 3.63Å; Y2931-F3241 AromaticContact CD2-CZ 3.74Å; Y2931-F3241 HydrophobicContact CD2-CZ 3.74Å; Y2931-F3241 AromaticContact CG-CE2 3.94Å; Y2931-F3241 HydrophobicContact CG-CE2 3.94Å; Y2931-F3241 HydrophobicContact CG-CZ 4.2Å
2932	N	94.9	Very high	83.7	Confident	15.25 Å²	15.25	60.5 Å²	60.5	8%	0.082	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	114.4	172.3	-173.4	9.5	0	0	0	109.7	Q2917 V2919 L2929 E2949 E2950	Q2917-N2932 WeakPolarHBondContact CG-OD1 2.97Å; Q2917-N2932 PolarHBondContact NE2-ND2 2.79Å; Q2917-N2932 PolarHBondContact NE2-OD1 2.93Å; V2919-N2932 WeakPolarHBondContact CG2-OD1 3.38Å; L2929-N2932 HydrophobicContact CD1-CB 4.08Å; L2929-N2932 HydrophobicContact CD2-CB 4.2Å; N2932-E2949 CarbonylContact O-C 3.52Å; N2932-E2949 WeakPolarHBondContact O-CA 3.42Å; N2932-E2950 HydrophobicContact CB-CB 4.08Å; N2932-E2950 HydrophobicContact CB-CG 4.45Å; N2932-E2950 PolarHBondContact N-O 3.03Å; N2932-E2950 PolarHBondContact ND2-OE2 2.92Å; N2932-E2950 PolarHBondContact O-N 3Å
2933	L	95.7	Very high	83.3	Confident	7.5 Å²	7.5	61.5 Å²	61.5	4%	0.039	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	122.2	167.1	-170.6	109.7	0	0	0	107.9	Q2917 C2918 Y2931 L2935 Q2947 R2948 E2949 I3230 N3232 T3238	Q2917-L2933 CarbonylContact C-O 3.51Å; Q2917-L2933 VanDerWaalsContact CA-O 3.23Å; Q2917-L2933 WeakPolarHBondContact CA-O 3.12Å; Q2917-L2933 VanDerWaalsContact CG-O 3.27Å; Q2917-L2933 WeakPolarHBondContact CG-O 3.34Å; C2918-L2933 HydrophobicContact CB-CB 4.15Å; C2918-L2933 HydrophobicContact CB-CD2 4.5Å; C2918-L2933 PolarHBondContact N-O 2.96Å; C2918-L2933 WeakPolarHBondContact O-CB 3.26Å; C2918-L2933 PolarHBondContact O-N 3.18Å; Y2931-L2933 HydrophobicContact CD1-CB 4.44Å; Y2931-L2933 HydrophobicContact CE1-CB 3.88Å; Y2931-L2933 HydrophobicContact CE1-CD1 4.3Å; L2933-L2935 HydrophobicContact CD1-CD2 4.31Å; L2933-L2935 HydrophobicContact CD2-CD1 3.74Å; L2933-L2935 VanDerWaalsContact CD2-CD1 3.49Å; L2933-L2935 HydrophobicContact CD2-CD2 4.34Å; L2933-L2935 HydrophobicContact CD2-CG 3.9Å; L2933-L2935 HydrophobicContact CG-CG 4.41Å; L2933-Q2947 HydrophobicContact CD1-CG 4.09Å; L2933-Q2947 HydrophobicContact CD2-CG 4.37Å; L2933-Q2947 HydrophobicContact CG-CG 4.21Å; L2933-R2948 CarbonylContact C-O 3.58Å; L2933-R2948 WeakPolarHBondContact CA-O 3.34Å; L2933-E2949 HydrophobicContact CD1-CG 4.01Å; L2933-I3230 HydrophobicContact CD1-CG2 4.48Å; L2933-N3232 HydrophobicContact CD1-CB 4.44Å; L2933-T3238 HydrophobicContact CD1-CG2 4.25Å
2934	S	96.1	Very high	83.3	Confident	31.75 Å²	31.75	59.2 Å²	59.2	22%	0.222	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	141.6	170.2	58.4	0	0	0	0	111	I2916 Q2947 R2948	I2916-S2934 CarbonylContact O-C 3.54Å; I2916-S2934 VanDerWaalsContact O-CA 3.3Å; I2916-S2934 WeakPolarHBondContact O-CA 3.38Å; S2934-Q2947 CarbonylContact O-C 3.53Å; S2934-Q2947 WeakPolarHBondContact O-CA 3.33Å; S2934-R2948 PolarHBondContact N-O 3.15Å; S2934-R2948 PolarHBondContact O-N 3.17Å; S2934-R2948 WeakPolarHBondContact OG-CB 3.33Å; S2934-R2948 PolarHBondContact OG-O 2.85Å
2935	L	94.5	Very high	83.8	Confident	17.25 Å²	17.25	57.2 Å²	57.2	9%	0.09	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	133.4	-176.7	-68.5	158.6	0	0	0	108.9	I2915 I2916 L2933 Y2937 A2944 Q2946 Q2947 H3233	I2915-L2935 HydrophobicContact CB-CD1 4.48Å; I2915-L2935 HydrophobicContact CG2-CD1 4.26Å; I2915-L2935 WeakPolarHBondContact O-CD1 3.35Å; I2916-L2935 PolarHBondContact O-N 3.21Å; L2933-L2935 HydrophobicContact CD1-CD2 4.31Å; L2933-L2935 HydrophobicContact CD2-CD1 3.74Å; L2933-L2935 VanDerWaalsContact CD2-CD1 3.49Å; L2933-L2935 HydrophobicContact CD2-CD2 4.34Å; L2933-L2935 HydrophobicContact CD2-CG 3.9Å; L2933-L2935 HydrophobicContact CG-CG 4.41Å; L2935-Y2937 HydrophobicContact CB-CE2 3.97Å; L2935-A2944 HydrophobicContact CD2-CB 4.23Å; L2935-Q2946 CarbonylContact C-O 3.55Å; L2935-Q2946 WeakPolarHBondContact CA-O 3.27Å; L2935-Q2947 HydrophobicContact CD2-CB 3.72Å; L2935-Q2947 HydrophobicContact CD2-CG 3.99Å; L2935-H3233 HydrophobicContact CD1-CB 3.8Å
2936	S	93.4	Very high	85	Confident	44.75 Å²	44.75	56.2 Å²	56.2	31%	0.313	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	146.4	168.9	74.8	0	0	0	0	109.7	A2944 L2945 Q2946	S2936-A2944 CarbonylContact O-C 3.54Å; S2936-A2944 WeakPolarHBondContact O-CA 3.24Å; S2936-L2945 PolarHBondContact O-N 3Å; S2936-Q2946 PolarHBondContact N-O 3.08Å; S2936-Q2946 PolarHBondContact O-N 3.1Å; S2936-Q2946 VanDerWaalsContact OG-CB 3.25Å; S2936-Q2946 WeakPolarHBondContact OG-CB 3.36Å; S2936-Q2946 PolarHBondContact OG-N 3.21Å
2937	Y	87.6	Confident	86.2	Confident	34.5 Å²	34.5	45.5 Å²	45.5	14%	0.135	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	153	179.8	-63.4	-94.1	0	0	0	109.5	R2914 I2915 I2916 L2935 L2942 Q2943 A2944	R2914-Y2937 HydrophobicContact CB-CD2 4.4Å; R2914-Y2937 HydrophobicContact CB-CE1 4.2Å; R2914-Y2937 HydrophobicContact CB-CE2 4Å; R2914-Y2937 VanDerWaalsContact CZ-CB 3.49Å; R2914-Y2937 VanDerWaalsContact CZ-CG 3.45Å; R2914-Y2937 VanDerWaalsContact NH1-CB 3.26Å; R2914-Y2937 VanDerWaalsContact NH2-CB 3.26Å; I2915-Y2937 VanDerWaalsContact O-CE2 3.28Å; I2915-Y2937 WeakPolarHBondContact O-CE2 3.41Å; I2915-Y2937 PolarHBondContact O-OH 3.21Å; I2916-Y2937 HydrophobicContact CG2-CD2 4.1Å; I2916-Y2937 HydrophobicContact CG2-CE2 3.91Å; L2935-Y2937 HydrophobicContact CB-CE2 3.97Å; Y2937-L2942 WeakPolarHBondContact CD1-O 3.45Å; Y2937-L2942 WeakPolarHBondContact CE1-O 3.46Å; Y2937-Q2943 WeakPolarHBondContact CD1-O 3.38Å; Y2937-A2944 HydrophobicContact CD1-CB 4.35Å; Y2937-A2944 HydrophobicContact CE1-CB 4.01Å
2938	Q	79.9	Confident	87	Confident	60.5 Å²	60.5	40.1 Å²	40.1	28%	0.283	21%	0.208	S	C	.	.			trans	-69.1	147.2	166.7	-64.1	-175.1	-19.8	0	0	110.1	R2914 N2940 A2941 L2945	R2914-Q2938 PolarHBondContact NH1-O 2.86Å; R2914-Q2938 VanDerWaalsContact NH1-O 3.1Å; Q2938-N2940 VanDerWaalsContact C-N 3.29Å; Q2938-N2940 PolarHBondContact O-N 2.88Å; Q2938-N2940 VanDerWaalsContact O-N 3.08Å; Q2938-A2941 HydrophobicContact CB-CB 3.76Å; Q2938-A2941 HydrophobicContact CG-CB 4.43Å; Q2938-A2941 PolarHBondContact O-N 3.03Å; Q2938-A2941 VanDerWaalsContact O-N 3.14Å; Q2938-L2945 HydrophobicContact CG-CB 4.19Å; Q2938-L2945 HydrophobicContact CG-CD1 4.16Å; Q2938-L2945 HydrophobicContact CG-CD2 4.22Å; Q2938-L2945 HydrophobicContact CG-CG 4.39Å
2939	P	72.1	Confident	87.5	Confident	78.5 Å²	78.5	36.3 Å²	36.3	51%	0.51	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-38.9	-178.1	-27	34.3	0	0	0	113.5	N2594 T2595 R2912	N2594-P2939 HydrophobicContact CB-CB 3.57Å; N2594-P2939 VanDerWaalsContact CB-CB 3.42Å; N2594-P2939 WeakPolarHBondContact CB-O 3.05Å; T2595-P2939 PolarHBondContact OG1-O 2.7Å; R2912-P2939 PolarHBondContact NH1-O 2.84Å; R2912-P2939 PolarHBondContact NH2-O 2.86Å
2940	N	72.5	Confident	87.7	Confident	62.5 Å²	62.5	35.1 Å²	35.1	33%	0.334	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.9	13.1	-173.6	-60.3	12.9	0	0	0	113.6	N2594 T2595 G2613 R2614 Q2938	N2594-N2940 PolarHBondContact O-OD1 3.13Å; N2594-N2940 VanDerWaalsContact O-OD1 3.06Å; T2595-N2940 WeakPolarHBondContact CA-OD1 3.46Å; T2595-N2940 VanDerWaalsContact CG2-CA 3.44Å; T2595-N2940 HydrophobicContact CG2-CB 4.11Å; T2595-N2940 WeakPolarHBondContact CG2-O 3.21Å; G2613-N2940 VanDerWaalsContact O-CB 3.3Å; G2613-N2940 WeakPolarHBondContact O-CB 3.23Å; G2613-N2940 PolarHBondContact O-ND2 2.81Å; R2614-N2940 HydrophobicContact CG-CB 4.31Å; Q2938-N2940 VanDerWaalsContact C-N 3.29Å; Q2938-N2940 PolarHBondContact O-N 2.88Å; Q2938-N2940 VanDerWaalsContact O-N 3.08Å
2941	A	71.7	Confident	87.5	Confident	3.5 Å²	3.5	36.6 Å²	36.6	3%	0.029	19%	0.187	C	C	.	.			trans	-123	147.3	-175.9	0	0	0	0	0	111.3	R2614 R2912 R2914 Q2938 Q2943	R2614-A2941 HydrophobicContact CG-CB 3.85Å; R2912-A2941 PolarHBondContact NH1-O 3.41Å; R2912-A2941 PolarHBondContact NH2-O 3.15Å; R2914-A2941 PolarHBondContact NH1-O 2.87Å; Q2938-A2941 HydrophobicContact CB-CB 3.76Å; Q2938-A2941 HydrophobicContact CG-CB 4.43Å; Q2938-A2941 PolarHBondContact O-N 3.03Å; Q2938-A2941 VanDerWaalsContact O-N 3.14Å; A2941-Q2943 VanDerWaalsContact C-N 3.32Å
2942	L	71.8	Confident	87	Confident	48.75 Å²	48.75	41.3 Å²	41.3	26%	0.255	21%	0.21	S	C	.	.	S	Bend	trans	-82.2	-20.2	173.4	-71.9	175.3	0	0	0	112.4	Y2597 R2914 Y2937 L3355	Y2597-L2942 WeakPolarHBondContact OH-CD1 3.41Å; R2914-L2942 HydrophobicContact CG-CD2 4.25Å; R2914-L2942 PolarHBondContact NH1-O 3.08Å; Y2937-L2942 WeakPolarHBondContact CD1-O 3.45Å; Y2937-L2942 WeakPolarHBondContact CE1-O 3.46Å; L2942-L3355 HydrophobicContact CB-CB 4.03Å; L2942-L3355 HydrophobicContact CB-CD1 3.7Å; L2942-L3355 HydrophobicContact CD1-CB 3.73Å; L2942-L3355 HydrophobicContact CD2-CB 4.25Å; L2942-L3355 HydrophobicContact CG-CB 4.22Å; L2942-L3355 WeakPolarHBondContact O-CD1 3.22Å
2943	Q	81.2	Confident	86.3	Confident	33.25 Å²	33.25	44.8 Å²	44.8	16%	0.155	25%	0.249	C	C	.	.	S	Bend	trans	-83.3	144.8	-175	-57.4	123	-16	0	0	112	R2614 Y2937 A2941 L2945 H2963 G2967 P3352	R2614-Q2943 VanDerWaalsContact NH2-OE1 3.14Å; Y2937-Q2943 WeakPolarHBondContact CD1-O 3.38Å; A2941-Q2943 VanDerWaalsContact C-N 3.32Å; Q2943-L2945 PolarHBondContact O-N 2.84Å; Q2943-H2963 VanDerWaalsContact CB-CE1 3.48Å; Q2943-H2963 WeakPolarHBondContact CB-CE1 3.45Å; Q2943-H2963 VanDerWaalsContact CD-CD2 3.46Å; Q2943-H2963 PolarHBondContact OE1-CD2 3.42Å; Q2943-H2963 VanDerWaalsContact OE1-CG 3.28Å; Q2943-H2963 PolarHBondContact OE1-NE2 2.96Å; Q2943-G2967 VanDerWaalsContact CD-O 3.25Å; Q2943-G2967 PolarHBondContact NE2-O 2.69Å; Q2943-G2967 VanDerWaalsContact OE1-CA 3.26Å; Q2943-G2967 PolarHBondContact OE1-O 3.27Å; Q2943-G2967 VanDerWaalsContact OE1-O 3.08Å; Q2943-P3352 HydrophobicContact CG-CB 4.42Å
2944	A	85.8	Confident	85.7	Confident	5.75 Å²	5.75	48.6 Å²	48.6	5%	0.048	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	135	172.9	0	0	0	0	0	110	L2935 S2936 Y2937 Y2961 H2963	L2935-A2944 HydrophobicContact CD2-CB 4.23Å; S2936-A2944 CarbonylContact O-C 3.54Å; S2936-A2944 WeakPolarHBondContact O-CA 3.24Å; Y2937-A2944 HydrophobicContact CD1-CB 4.35Å; Y2937-A2944 HydrophobicContact CE1-CB 4.01Å; A2944-Y2961 HydrophobicContact CB-CD2 4.27Å; A2944-Y2961 HydrophobicContact CB-CE2 4.41Å; A2944-Y2961 WeakPolarHBondContact O-CB 3.32Å; A2944-Y2961 WeakPolarHBondContact O-CD2 3.37Å; A2944-H2963 PolarHBondContact O-CE1 2.82Å; A2944-H2963 PolarHBondContact O-ND1 2.89Å
2945	L	90.9	Very high	85.2	Confident	60.5 Å²	60.5	50.5 Å²	50.5	32%	0.317	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	-43.5	174	176.7	65.6	0	0	0	110.5	S2936 Q2938 Q2943 Y2961	S2936-L2945 PolarHBondContact O-N 3Å; Q2938-L2945 HydrophobicContact CG-CB 4.19Å; Q2938-L2945 HydrophobicContact CG-CD1 4.16Å; Q2938-L2945 HydrophobicContact CG-CD2 4.22Å; Q2938-L2945 HydrophobicContact CG-CG 4.39Å; Q2943-L2945 PolarHBondContact O-N 2.84Å; L2945-Y2961 PolarHBondContact O-N 3.09Å
2946	Q	93.7	Very high	84.9	Confident	66.5 Å²	66.5	50.9 Å²	50.9	31%	0.311	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	142.8	-177	-162.7	177.8	43.1	0	0	110.2	L2935 S2936 W2958 I2959 T2960	L2935-Q2946 CarbonylContact C-O 3.55Å; L2935-Q2946 WeakPolarHBondContact CA-O 3.27Å; S2936-Q2946 PolarHBondContact N-O 3.08Å; S2936-Q2946 PolarHBondContact O-N 3.1Å; S2936-Q2946 VanDerWaalsContact OG-CB 3.25Å; S2936-Q2946 WeakPolarHBondContact OG-CB 3.36Å; S2936-Q2946 PolarHBondContact OG-N 3.21Å; Q2946-W2958 VanDerWaalsContact CD-CZ3 3.44Å; Q2946-W2958 HydrophobicContact CG-CE3 3.83Å; Q2946-W2958 HydrophobicContact CG-CZ3 4.25Å; Q2946-W2958 VanDerWaalsContact NE2-CE3 3.27Å; Q2946-I2959 CarbonylContact C-O 3.57Å; Q2946-I2959 VanDerWaalsContact CA-O 3.27Å; Q2946-I2959 WeakPolarHBondContact CA-O 3.26Å; Q2946-I2959 WeakPolarHBondContact CG-O 3.44Å; Q2946-T2960 PolarHBondContact NE2-OG1 3.23Å; Q2946-T2960 VanDerWaalsContact NE2-OG1 3.11Å
2947	Q	94.4	Very high	84.7	Confident	11.5 Å²	11.5	51.1 Å²	51.1	5%	0.054	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	136.2	170.6	172.4	175.4	-37	0	0	108.2	L2933 S2934 L2935 E2949 W2958 I2959 Y2961	L2933-Q2947 HydrophobicContact CD1-CG 4.09Å; L2933-Q2947 HydrophobicContact CD2-CG 4.37Å; L2933-Q2947 HydrophobicContact CG-CG 4.21Å; S2934-Q2947 CarbonylContact O-C 3.53Å; S2934-Q2947 WeakPolarHBondContact O-CA 3.33Å; L2935-Q2947 HydrophobicContact CD2-CB 3.72Å; L2935-Q2947 HydrophobicContact CD2-CG 3.99Å; Q2947-E2949 HydrophobicContact CG-CG 4.29Å; Q2947-E2949 PolarHBondContact NE2-OE1 2.82Å; Q2947-W2958 CarbonylContact O-C 3.42Å; Q2947-W2958 WeakPolarHBondContact O-CA 3.31Å; Q2947-I2959 HydrophobicContact CB-CB 4.23Å; Q2947-I2959 PolarHBondContact N-O 3.15Å; Q2947-I2959 PolarHBondContact O-N 2.88Å; Q2947-Y2961 HydrophobicContact CB-CE2 3.96Å; Q2947-Y2961 PolarHBondContact OE1-OH 3.06Å
2948	R	94.9	Very high	85	Confident	66.25 Å²	66.25	52.8 Å²	52.8	25%	0.25	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	129.5	174.8	175.7	-174.5	-170.3	-102.8	-1.8	108.9	L2933 S2934 E2950 P2956 R2957 W2958	L2933-R2948 CarbonylContact C-O 3.58Å; L2933-R2948 WeakPolarHBondContact CA-O 3.34Å; S2934-R2948 PolarHBondContact N-O 3.15Å; S2934-R2948 PolarHBondContact O-N 3.17Å; S2934-R2948 WeakPolarHBondContact OG-CB 3.33Å; S2934-R2948 PolarHBondContact OG-O 2.85Å; R2948-E2950 VanDerWaalsContact CZ-CD 3.46Å; R2948-E2950 IonicContact CZ-OE1 3.03Å; R2948-E2950 IonicContact CZ-OE2 3.25Å; R2948-E2950 IonicContact NE-OE1 3.28Å; R2948-E2950 VanDerWaalsContact NH1-CG 3.31Å; R2948-E2950 IonicContact NH1-OE1 3.02Å; R2948-E2950 PolarHBondContact NH1-OE1 3.12Å; R2948-E2950 IonicContact NH1-OE2 3.37Å; R2948-E2950 PolarHBondContact NH1-OE2 2.97Å; R2948-E2950 VanDerWaalsContact NH1-OE2 3.14Å; R2948-E2950 IonicContact NH2-OE1 3.04Å; R2948-E2950 PolarHBondContact NH2-OE1 3.29Å; R2948-P2956 VanDerWaalsContact NH2-CG 3.34Å; R2948-R2957 CarbonylContact C-O 3.58Å; R2948-R2957 VanDerWaalsContact CA-O 3.26Å; R2948-R2957 WeakPolarHBondContact CA-O 3.29Å; R2948-W2958 HydrophobicContact CB-CD2 4.12Å; R2948-W2958 HydrophobicContact CB-CE3 3.71Å; R2948-W2958 HydrophobicContact CB-CH2 4.31Å; R2948-W2958 HydrophobicContact CB-CZ3 3.82Å; R2948-W2958 VanDerWaalsContact CD-CH2 3.47Å; R2948-W2958 HydrophobicContact CG-CD2 4.06Å; R2948-W2958 HydrophobicContact CG-CE3 4.08Å; R2948-W2958 HydrophobicContact CG-CH2 4.13Å; R2948-W2958 HydrophobicContact CG-CZ2 4.05Å; R2948-W2958 HydrophobicContact CG-CZ3 4.12Å; R2948-W2958 VanDerWaalsContact NE-CZ2 3.34Å
2949	E	93	Very high	85.6	Confident	14 Å²	14	50.8 Å²	50.8	7%	0.065	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	127.8	-178.6	-72.8	-173.4	172	0	0	109.9	Y2931 N2932 L2933 Q2947 R2951 P2956 R2957	Y2931-E2949 HydrophobicContact CE2-CG 3.85Å; Y2931-E2949 VanDerWaalsContact CE2-OE1 3.28Å; Y2931-E2949 WeakPolarHBondContact CE2-OE1 3.25Å; Y2931-E2949 WeakPolarHBondContact OH-CG 3.35Å; Y2931-E2949 PolarHBondContact OH-OE1 2.88Å; Y2931-E2949 PolarHBondContact OH-OE2 3.02Å; N2932-E2949 CarbonylContact O-C 3.52Å; N2932-E2949 WeakPolarHBondContact O-CA 3.42Å; L2933-E2949 HydrophobicContact CD1-CG 4.01Å; Q2947-E2949 HydrophobicContact CG-CG 4.29Å; Q2947-E2949 PolarHBondContact NE2-OE1 2.82Å; E2949-R2951 IonicContact OE1-CZ 2.75Å; E2949-R2951 IonicContact OE1-NE 3.53Å; E2949-R2951 PolarHBondContact OE1-NE 3.01Å; E2949-R2951 IonicContact OE1-NH2 3.65Å; E2949-R2951 PolarHBondContact OE1-NH2 3.25Å; E2949-R2951 IonicContact OE2-CZ 2.75Å; E2949-R2951 IonicContact OE2-NH2 3.38Å; E2949-R2951 PolarHBondContact OE2-NH2 2.94Å; E2949-P2956 CarbonylContact O-C 3.56Å; E2949-P2956 VanDerWaalsContact O-CA 3.31Å; E2949-P2956 WeakPolarHBondContact O-CA 3.17Å; E2949-R2957 HydrophobicContact CB-CB 4.36Å; E2949-R2957 PolarHBondContact N-O 3.16Å; E2949-R2957 PolarHBondContact O-N 2.96Å
2950	E	91.8	Very high	86.6	Confident	42 Å²	42	48.8 Å²	48.8	20%	0.196	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	138.2	170.7	-50	178.1	124.1	0	0	109.2	Y2931 N2932 R2948 P2956	Y2931-E2950 CarbonylContact C-O 3.52Å; Y2931-E2950 WeakPolarHBondContact CA-O 3.37Å; N2932-E2950 HydrophobicContact CB-CB 4.08Å; N2932-E2950 HydrophobicContact CB-CG 4.45Å; N2932-E2950 PolarHBondContact N-O 3.03Å; N2932-E2950 PolarHBondContact ND2-OE2 2.92Å; N2932-E2950 PolarHBondContact O-N 3Å; R2948-E2950 VanDerWaalsContact CZ-CD 3.46Å; R2948-E2950 IonicContact CZ-OE1 3.03Å; R2948-E2950 IonicContact CZ-OE2 3.25Å; R2948-E2950 IonicContact NE-OE1 3.28Å; R2948-E2950 VanDerWaalsContact NH1-CG 3.31Å; R2948-E2950 IonicContact NH1-OE1 3.02Å; R2948-E2950 PolarHBondContact NH1-OE1 3.12Å; R2948-E2950 IonicContact NH1-OE2 3.37Å; R2948-E2950 PolarHBondContact NH1-OE2 2.97Å; R2948-E2950 VanDerWaalsContact NH1-OE2 3.14Å; R2948-E2950 IonicContact NH2-OE1 3.04Å; R2948-E2950 PolarHBondContact NH2-OE1 3.29Å; E2950-P2956 HydrophobicContact CG-CB 4.04Å; E2950-P2956 HydrophobicContact CG-CG 4.08Å; E2950-P2956 WeakPolarHBondContact OE1-CG 3.5Å
2951	R	87.2	Confident	87.6	Confident	48.25 Å²	48.25	47.6 Å²	47.6	18%	0.182	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	149.2	175.8	-63.1	-176.5	-122.9	-167.2	-1.5	108.9	Y2931 E2949 G2953 Q2954 R2957	Y2931-R2951 HydrophobicContact CD2-CG 3.62Å; Y2931-R2951 VanDerWaalsContact CD2-CG 3.49Å; Y2931-R2951 HydrophobicContact CE2-CG 3.71Å; Y2931-R2951 PolarHBondContact OH-NH2 2.83Å; E2949-R2951 IonicContact OE1-CZ 2.75Å; E2949-R2951 IonicContact OE1-NE 3.53Å; E2949-R2951 PolarHBondContact OE1-NE 3.01Å; E2949-R2951 IonicContact OE1-NH2 3.65Å; E2949-R2951 PolarHBondContact OE1-NH2 3.25Å; E2949-R2951 IonicContact OE2-CZ 2.75Å; E2949-R2951 IonicContact OE2-NH2 3.38Å; E2949-R2951 PolarHBondContact OE2-NH2 2.94Å; R2951-G2953 PolarHBondContact O-N 3.08Å; R2951-Q2954 HydrophobicContact CB-CB 4.2Å; R2951-Q2954 HydrophobicContact CB-CG 4.37Å; R2951-Q2954 PolarHBondContact O-N 3.07Å; R2951-Q2954 VanDerWaalsContact O-N 3.12Å; R2951-R2957 VanDerWaalsContact NH2-NH1 3.16Å
2952	E	83.4	Confident	88.5	Confident	114.5 Å²	114.5	50.4 Å²	50.4	54%	0.535	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	130.4	173.9	-165	-168.5	164.8	0	0	110.9	L2930 Q2954	L2930-E2952 VanDerWaalsContact CD2-OE2 3.28Å; L2930-E2952 WeakPolarHBondContact CD2-OE2 3.16Å; L2930-E2952 PolarHBondContact O-N 3.34Å; L2930-E2952 VanDerWaalsContact O-N 3.12Å; E2952-Q2954 PolarHBondContact O-N 3.06Å
2953	G	80.6	Confident	89.3	Confident	88 Å²	88	49.8 Å²	49.8	91%	0.907	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.8	5.7	179.8	0	0	0	0	0	115.7	R2951	R2951-G2953 PolarHBondContact O-N 3.08Å
2954	Q	82.7	Confident	89.5	Confident	88 Å²	88	48.6 Å²	48.6	41%	0.411	26%	0.258	S	S	.	.	S	Bend	trans	-122.8	153.1	178.4	-59.9	-168.6	-7.5	0	0	112.3	R2951 E2952	R2951-Q2954 HydrophobicContact CB-CB 4.2Å; R2951-Q2954 HydrophobicContact CB-CG 4.37Å; R2951-Q2954 PolarHBondContact O-N 3.07Å; R2951-Q2954 VanDerWaalsContact O-N 3.12Å; E2952-Q2954 PolarHBondContact O-N 3.06Å
2955	V	85.2	Confident	89.4	Confident	71 Å²	71	50.6 Å²	50.6	43%	0.43	27%	0.271	S	S	.	.			trans	-70.8	145.8	174	-84.3	0	0	0	0	110.6	R2957 E2976 A2977	V2955-R2957 PolarHBondContact O-N 2.97Å; V2955-E2976 HydrophobicContact CG2-CB 4.36Å; V2955-E2976 HydrophobicContact CG2-CG 3.47Å; V2955-E2976 VanDerWaalsContact CG2-CG 3.47Å; V2955-A2977 HydrophobicContact CB-CB 4.1Å; V2955-A2977 WeakPolarHBondContact CB-O 3.23Å; V2955-A2977 HydrophobicContact CG1-CB 4.35Å; V2955-A2977 WeakPolarHBondContact CG1-O 3.44Å; V2955-A2977 WeakPolarHBondContact CG2-O 3.15Å
2956	P	89.7	Confident	88.8	Confident	26.5 Å²	26.5	49.4 Å²	49.4	17%	0.172	27%	0.272	C	S	.	.			trans	-59.4	144.7	176.8	-24.9	33.4	0	0	0	112.9	R2948 E2949 E2950 W2958 A2977	R2948-P2956 VanDerWaalsContact NH2-CG 3.34Å; E2949-P2956 CarbonylContact O-C 3.56Å; E2949-P2956 VanDerWaalsContact O-CA 3.31Å; E2949-P2956 WeakPolarHBondContact O-CA 3.17Å; E2950-P2956 HydrophobicContact CG-CB 4.04Å; E2950-P2956 HydrophobicContact CG-CG 4.08Å; E2950-P2956 WeakPolarHBondContact OE1-CG 3.5Å; P2956-W2958 HydrophobicContact CB-CH2 3.8Å; P2956-W2958 HydrophobicContact CB-CZ2 4.13Å; P2956-W2958 HydrophobicContact CB-CZ3 4.14Å; P2956-W2958 HydrophobicContact CG-CH2 4.4Å; P2956-W2958 WeakPolarHBondContact O-CZ3 3.32Å; P2956-A2977 HydrophobicContact CB-CB 4.32Å; P2956-A2977 HydrophobicContact CG-CB 4.28Å; P2956-A2977 VanDerWaalsContact O-CB 3.27Å; P2956-A2977 WeakPolarHBondContact O-CB 3.4Å; P2956-A2977 PolarHBondContact O-N 3.04Å
2957	R	89.4	Confident	88.1	Confident	49.5 Å²	49.5	46.6 Å²	46.6	19%	0.187	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	141.4	173.9	-66.6	178.1	176.4	174.6	-2.5	110.3	R2948 E2949 R2951 V2955 E2975 E2976 E3252	R2948-R2957 CarbonylContact C-O 3.58Å; R2948-R2957 VanDerWaalsContact CA-O 3.26Å; R2948-R2957 WeakPolarHBondContact CA-O 3.29Å; E2949-R2957 HydrophobicContact CB-CB 4.36Å; E2949-R2957 PolarHBondContact N-O 3.16Å; E2949-R2957 PolarHBondContact O-N 2.96Å; R2951-R2957 VanDerWaalsContact NH2-NH1 3.16Å; V2955-R2957 PolarHBondContact O-N 2.97Å; R2957-E2975 CarbonylContact C-O 3.56Å; R2957-E2975 WeakPolarHBondContact CA-O 3.37Å; R2957-E2976 HydrophobicContact CG-CB 4.16Å; R2957-E2976 HydrophobicContact CG-CG 3.89Å; R2957-E2976 IonicContact CZ-OE1 3.07Å; R2957-E2976 VanDerWaalsContact CZ-OE1 3.29Å; R2957-E2976 IonicContact NE-OE1 3.47Å; R2957-E2976 PolarHBondContact NE-OE1 2.94Å; R2957-E2976 IonicContact NE-OE2 3.45Å; R2957-E2976 IonicContact NH2-OE1 3.21Å; R2957-E2976 PolarHBondContact NH2-OE1 3.13Å; R2957-E2976 IonicContact NH2-OE2 3.3Å; R2957-E3252 IonicContact NH1-OE1 3.54Å; R2957-E3252 PolarHBondContact NH1-OE1 2.93Å
2958	W	92	Very high	87.6	Confident	69.5 Å²	69.5	48.5 Å²	48.5	26%	0.263	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	138	173.2	-64.7	-101.3	0	0	0	110.1	Q2946 Q2947 R2948 P2956 R2974 E2975 A2977	Q2946-W2958 VanDerWaalsContact CD-CZ3 3.44Å; Q2946-W2958 HydrophobicContact CG-CE3 3.83Å; Q2946-W2958 HydrophobicContact CG-CZ3 4.25Å; Q2946-W2958 VanDerWaalsContact NE2-CE3 3.27Å; Q2947-W2958 CarbonylContact O-C 3.42Å; Q2947-W2958 WeakPolarHBondContact O-CA 3.31Å; R2948-W2958 HydrophobicContact CB-CD2 4.12Å; R2948-W2958 HydrophobicContact CB-CE3 3.71Å; R2948-W2958 HydrophobicContact CB-CH2 4.31Å; R2948-W2958 HydrophobicContact CB-CZ3 3.82Å; R2948-W2958 VanDerWaalsContact CD-CH2 3.47Å; R2948-W2958 HydrophobicContact CG-CD2 4.06Å; R2948-W2958 HydrophobicContact CG-CE3 4.08Å; R2948-W2958 HydrophobicContact CG-CH2 4.13Å; R2948-W2958 HydrophobicContact CG-CZ2 4.05Å; R2948-W2958 HydrophobicContact CG-CZ3 4.12Å; R2948-W2958 VanDerWaalsContact NE-CZ2 3.34Å; P2956-W2958 HydrophobicContact CB-CH2 3.8Å; P2956-W2958 HydrophobicContact CB-CZ2 4.13Å; P2956-W2958 HydrophobicContact CB-CZ3 4.14Å; P2956-W2958 HydrophobicContact CG-CH2 4.4Å; P2956-W2958 WeakPolarHBondContact O-CZ3 3.32Å; W2958-R2974 CarbonylContact O-C 3.55Å; W2958-R2974 VanDerWaalsContact O-CA 3.28Å; W2958-R2974 WeakPolarHBondContact O-CA 3.23Å; W2958-E2975 PolarHBondContact N-O 3.15Å; W2958-E2975 PolarHBondContact O-N 3.04Å; W2958-A2977 HydrophobicContact CH2-CB 3.63Å; W2958-A2977 HydrophobicContact CZ3-CB 3.41Å; W2958-A2977 VanDerWaalsContact CZ3-CB 3.46Å
2959	I	92.6	Very high	87.3	Confident	17.5 Å²	17.5	47 Å²	47	9%	0.09	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	117.1	171.1	-52.4	173.4	0	0	0	106.4	Q2946 Q2947 Y2961 V2972 D2973 R2974	Q2946-I2959 CarbonylContact C-O 3.57Å; Q2946-I2959 VanDerWaalsContact CA-O 3.27Å; Q2946-I2959 WeakPolarHBondContact CA-O 3.26Å; Q2946-I2959 WeakPolarHBondContact CG-O 3.44Å; Q2947-I2959 HydrophobicContact CB-CB 4.23Å; Q2947-I2959 PolarHBondContact N-O 3.15Å; Q2947-I2959 PolarHBondContact O-N 2.88Å; I2959-Y2961 HydrophobicContact CB-CE2 4.48Å; I2959-Y2961 HydrophobicContact CG2-CD1 4.45Å; I2959-Y2961 HydrophobicContact CG2-CE1 3.83Å; I2959-Y2961 HydrophobicContact CG2-CE2 4.13Å; I2959-V2972 HydrophobicContact CG2-CG1 3.62Å; I2959-D2973 CarbonylContact C-O 3.53Å; I2959-D2973 VanDerWaalsContact CA-O 3.23Å; I2959-D2973 WeakPolarHBondContact CA-O 3.36Å; I2959-R2974 HydrophobicContact CG1-CG 4.28Å; I2959-R2974 HydrophobicContact CG2-CG 4.39Å
2960	T	94.4	Very high	87.3	Confident	37.75 Å²	37.75	49.6 Å²	49.6	23%	0.232	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	129.4	177.6	-51.8	0	0	0	0	108.9	Q2946 V2972 D2973	Q2946-T2960 PolarHBondContact NE2-OG1 3.23Å; Q2946-T2960 VanDerWaalsContact NE2-OG1 3.11Å; T2960-V2972 CarbonylContact O-C 3.55Å; T2960-V2972 WeakPolarHBondContact O-CA 3.25Å; T2960-D2973 PolarHBondContact N-O 2.89Å; T2960-D2973 PolarHBondContact O-N 3.29Å
2961	Y	92.5	Very high	87.3	Confident	37.25 Å²	37.25	47.9 Å²	47.9	15%	0.146	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	122.6	-179.7	-54.8	-82	0	0	0	109.8	A2944 L2945 Q2947 I2959 H2963 L2969 V2972	A2944-Y2961 HydrophobicContact CB-CD2 4.27Å; A2944-Y2961 HydrophobicContact CB-CE2 4.41Å; A2944-Y2961 WeakPolarHBondContact O-CB 3.32Å; A2944-Y2961 WeakPolarHBondContact O-CD2 3.37Å; L2945-Y2961 PolarHBondContact O-N 3.09Å; Q2947-Y2961 HydrophobicContact CB-CE2 3.96Å; Q2947-Y2961 PolarHBondContact OE1-OH 3.06Å; I2959-Y2961 HydrophobicContact CB-CE2 4.48Å; I2959-Y2961 HydrophobicContact CG2-CD1 4.45Å; I2959-Y2961 HydrophobicContact CG2-CE1 3.83Å; I2959-Y2961 HydrophobicContact CG2-CE2 4.13Å; Y2961-H2963 VanDerWaalsContact CB-CE1 3.46Å; Y2961-H2963 WeakPolarHBondContact CB-CE1 3.3Å; Y2961-L2969 HydrophobicContact CD1-CD1 4.01Å; Y2961-L2969 HydrophobicContact CG-CD1 4.47Å; Y2961-V2972 HydrophobicContact CD1-CG1 4.43Å; Y2961-V2972 HydrophobicContact CD1-CG2 4.16Å; Y2961-V2972 HydrophobicContact CE1-CG1 4.4Å; Y2961-V2972 HydrophobicContact CE1-CG2 4.45Å
2962	V	91.9	Very high	87.6	Confident	61.5 Å²	61.5	45.9 Å²	45.9	37%	0.373	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	118.3	174.8	-175.8	0	0	0	0	108.3	E2970 A2971	V2962-E2970 PolarHBondContact O-N 3.16Å; V2962-A2971 HydrophobicContact CB-CB 3.91Å; V2962-A2971 HydrophobicContact CG2-CB 4.08Å; V2962-A2971 PolarHBondContact N-O 3.17Å; V2962-A2971 PolarHBondContact O-N 3.18Å; V2962-A2971 VanDerWaalsContact O-N 3.14Å
2963	H	87.5	Confident	87.9	Confident	37 Å²	37	42.6 Å²	42.6	17%	0.171	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	130.8	-179.3	-64.9	91.2	0	0	0	111.3	R2614 Q2943 A2944 Y2961 G2967 R2968	R2614-H2963 PolarHBondContact NH1-O 3.21Å; Q2943-H2963 VanDerWaalsContact CB-CE1 3.48Å; Q2943-H2963 WeakPolarHBondContact CB-CE1 3.45Å; Q2943-H2963 VanDerWaalsContact CD-CD2 3.46Å; Q2943-H2963 PolarHBondContact OE1-CD2 3.42Å; Q2943-H2963 VanDerWaalsContact OE1-CG 3.28Å; Q2943-H2963 PolarHBondContact OE1-NE2 2.96Å; A2944-H2963 PolarHBondContact O-CE1 2.82Å; A2944-H2963 PolarHBondContact O-ND1 2.89Å; Y2961-H2963 VanDerWaalsContact CB-CE1 3.46Å; Y2961-H2963 WeakPolarHBondContact CB-CE1 3.3Å; H2963-G2967 PolarHBondContact CD2-O 2.95Å; H2963-R2968 CarbonylContact C-O 3.55Å; H2963-R2968 VanDerWaalsContact CA-O 3.26Å; H2963-R2968 WeakPolarHBondContact CA-O 3.35Å
2964	G	85.6	Confident	88.4	Confident	7 Å²	7	41.7 Å²	41.7	7%	0.072	22%	0.219	C	C	.	.			trans	-91	-168.8	173.4	0	0	0	0	0	114.1	R2614 G2967 R2968 E2970	R2614-G2964 PolarHBondContact NH2-O 3.07Å; G2964-G2967 PolarHBondContact O-N 2.94Å; G2964-G2967 VanDerWaalsContact O-N 3.15Å; G2964-R2968 PolarHBondContact N-O 2.97Å; G2964-R2968 PolarHBondContact O-N 2.88Å; G2964-E2970 VanDerWaalsContact CA-CD 3.44Å; G2964-E2970 WeakPolarHBondContact CA-OE1 3.38Å; G2964-E2970 WeakPolarHBondContact CA-OE2 3.31Å
2965	P	83.1	Confident	88.6	Confident	48.75 Å²	48.75	40.8 Å²	40.8	32%	0.317	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-55.7	140.6	178.1	-23.6	33.2	0	0	0	113.1	A2616 G2639 G2967 R2968	A2616-P2965 HydrophobicContact CB-CB 4.37Å; A2616-P2965 HydrophobicContact CB-CG 4.38Å; A2616-P2965 WeakPolarHBondContact O-CB 3.35Å; G2639-P2965 WeakPolarHBondContact CA-O 3.48Å; P2965-G2967 VanDerWaalsContact C-N 3.29Å; P2965-G2967 PolarHBondContact O-N 2.82Å; P2965-R2968 WeakPolarHBondContact O-CD 3.47Å; P2965-R2968 WeakPolarHBondContact O-CG 3.23Å; P2965-R2968 PolarHBondContact O-NE 3.33Å; P2965-R2968 PolarHBondContact O-NH2 3.23Å
2966	G	78.4	Confident	88.6	Confident	34.25 Å²	34.25	39.9 Å²	39.9	35%	0.353	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	74.6	12.8	-175.5	0	0	0	0	0	113.9	D2617 S2638 R2968	D2617-G2966 WeakPolarHBondContact OD1-CA 3.4Å; D2617-G2966 PolarHBondContact OD1-N 3.12Å; S2638-G2966 WeakPolarHBondContact O-CA 3.39Å; G2966-R2968 VanDerWaalsContact C-N 3.31Å; G2966-R2968 PolarHBondContact O-N 3.1Å
2967	G	79.4	Confident	88.2	Confident	9 Å²	9	39.8 Å²	39.8	9%	0.093	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	71.4	21.7	-176.7	0	0	0	0	0	114.7	D2617 Q2943 H2963 G2964 P2965	D2617-G2967 PolarHBondContact OD1-N 3.19Å; D2617-G2967 VanDerWaalsContact OD1-N 3.11Å; Q2943-G2967 VanDerWaalsContact CD-O 3.25Å; Q2943-G2967 PolarHBondContact NE2-O 2.69Å; Q2943-G2967 VanDerWaalsContact OE1-CA 3.26Å; Q2943-G2967 PolarHBondContact OE1-O 3.27Å; Q2943-G2967 VanDerWaalsContact OE1-O 3.08Å; H2963-G2967 PolarHBondContact CD2-O 2.95Å; G2964-G2967 PolarHBondContact O-N 2.94Å; G2964-G2967 VanDerWaalsContact O-N 3.15Å; P2965-G2967 VanDerWaalsContact C-N 3.29Å; P2965-G2967 PolarHBondContact O-N 2.82Å
2968	R	84.5	Confident	87.7	Confident	50 Å²	50	41.7 Å²	41.7	19%	0.189	24%	0.243	C	C	.	.			trans	-75.4	140.1	179.2	-80	-178.1	-151.4	172.8	2.1	111.2	G2639 S2640 H2963 G2964 P2965 G2966 E2970 Y2989 G2993 R2994	G2639-R2968 VanDerWaalsContact C-CZ 3.46Å; G2639-R2968 VanDerWaalsContact CA-CZ 3.41Å; G2639-R2968 PolarHBondContact O-NE 2.95Å; G2639-R2968 PolarHBondContact O-NH1 2.71Å; G2639-R2968 PolarHBondContact O-NH2 2.8Å; S2640-R2968 PolarHBondContact OG-NH2 2.93Å; H2963-R2968 CarbonylContact C-O 3.55Å; H2963-R2968 VanDerWaalsContact CA-O 3.26Å; H2963-R2968 WeakPolarHBondContact CA-O 3.35Å; G2964-R2968 PolarHBondContact N-O 2.97Å; G2964-R2968 PolarHBondContact O-N 2.88Å; P2965-R2968 WeakPolarHBondContact O-CD 3.47Å; P2965-R2968 WeakPolarHBondContact O-CG 3.23Å; P2965-R2968 PolarHBondContact O-NE 3.33Å; P2965-R2968 PolarHBondContact O-NH2 3.23Å; G2966-R2968 VanDerWaalsContact C-N 3.31Å; G2966-R2968 PolarHBondContact O-N 3.1Å; R2968-E2970 HydrophobicContact CG-CG 4.04Å; R2968-E2970 IonicContact CZ-OE1 2.76Å; R2968-E2970 IonicContact NE-OE1 3.3Å; R2968-E2970 PolarHBondContact NE-OE1 2.94Å; R2968-E2970 IonicContact NH2-OE1 2.83Å; R2968-E2970 PolarHBondContact NH2-OE1 2.74Å; R2968-E2970 PolarHBondContact O-N 2.91Å; R2968-Y2989 HydrophobicContact CB-CE1 4.5Å; R2968-Y2989 HydrophobicContact CB-CE2 4.02Å; R2968-Y2989 VanDerWaalsContact CD-CD2 3.44Å; R2968-Y2989 VanDerWaalsContact CD-CE2 3.41Å; R2968-Y2989 HydrophobicContact CG-CD2 4.1Å; R2968-Y2989 HydrophobicContact CG-CE1 4.13Å; R2968-Y2989 HydrophobicContact CG-CE2 3.65Å; R2968-Y2989 VanDerWaalsContact CG-CE2 3.4Å; R2968-Y2989 VanDerWaalsContact CG-CZ 3.46Å; R2968-Y2989 VanDerWaalsContact CZ-CD2 3.49Å; R2968-Y2989 VanDerWaalsContact NE-CE2 3.32Å; R2968-Y2989 VanDerWaalsContact NE-CZ 3.31Å; R2968-Y2989 VanDerWaalsContact NH1-CB 3.27Å; R2968-G2993 VanDerWaalsContact CZ-CA 3.5Å; R2968-G2993 PolarHBondContact NH2-O 3.27Å; R2968-R2994 PolarHBondContact NH2-O 3.04Å
2969	L	88.9	Confident	86.9	Confident	35 Å²	35	41 Å²	41	18%	0.183	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	112.7	177.1	-176.3	64.7	0	0	0	110.4	Y2961 A2971 V2972 L2987 Y2989 A3255	Y2961-L2969 HydrophobicContact CD1-CD1 4.01Å; Y2961-L2969 HydrophobicContact CG-CD1 4.47Å; L2969-A2971 WeakPolarHBondContact CD1-O 3.46Å; L2969-V2972 HydrophobicContact CD1-CG2 4.03Å; L2969-V2972 HydrophobicContact CD2-CG2 3.69Å; L2969-V2972 HydrophobicContact CG-CG2 4.08Å; L2969-L2987 HydrophobicContact CD2-CD1 4.25Å; L2969-L2987 HydrophobicContact CG-CD1 4.27Å; L2969-L2987 WeakPolarHBondContact O-CB 3.31Å; L2969-Y2989 VanDerWaalsContact O-CE2 3.26Å; L2969-Y2989 WeakPolarHBondContact O-CE2 3.32Å; L2969-Y2989 VanDerWaalsContact O-CZ 3.3Å; L2969-Y2989 PolarHBondContact O-OH 2.91Å; L2969-A3255 HydrophobicContact CD2-CB 3.81Å
2970	E	92	Very high	85.9	Confident	69.25 Å²	69.25	41.7 Å²	41.7	32%	0.324	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	-27.2	-179.1	-70.8	-174.2	165.7	0	0	113.1	V2962 G2964 R2968 Q2986 L2987 Y2989	V2962-E2970 PolarHBondContact O-N 3.16Å; G2964-E2970 VanDerWaalsContact CA-CD 3.44Å; G2964-E2970 WeakPolarHBondContact CA-OE1 3.38Å; G2964-E2970 WeakPolarHBondContact CA-OE2 3.31Å; R2968-E2970 HydrophobicContact CG-CG 4.04Å; R2968-E2970 IonicContact CZ-OE1 2.76Å; R2968-E2970 IonicContact NE-OE1 3.3Å; R2968-E2970 PolarHBondContact NE-OE1 2.94Å; R2968-E2970 IonicContact NH2-OE1 2.83Å; R2968-E2970 PolarHBondContact NH2-OE1 2.74Å; R2968-E2970 PolarHBondContact O-N 2.91Å; E2970-Q2986 CarbonylContact O-C 3.54Å; E2970-Q2986 WeakPolarHBondContact O-CA 3.26Å; E2970-L2987 PolarHBondContact O-N 3.23Å; E2970-Y2989 HydrophobicContact CG-CE2 4.39Å
2971	A	92.9	Very high	84.8	Confident	7.25 Å²	7.25	43.1 Å²	43.1	6%	0.06	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	156.1	171.4	0	0	0	0	0	113.7	V2962 L2969 S2985	V2962-A2971 HydrophobicContact CB-CB 3.91Å; V2962-A2971 HydrophobicContact CG2-CB 4.08Å; V2962-A2971 PolarHBondContact N-O 3.17Å; V2962-A2971 PolarHBondContact O-N 3.18Å; V2962-A2971 VanDerWaalsContact O-N 3.14Å; L2969-A2971 WeakPolarHBondContact CD1-O 3.46Å; A2971-S2985 CarbonylContact C-O 3.45Å; A2971-S2985 WeakPolarHBondContact CA-O 3.18Å; A2971-S2985 WeakPolarHBondContact CB-O 3.38Å
2972	V	92.3	Very high	84.2	Confident	5.5 Å²	5.5	47.7 Å²	47.7	3%	0.033	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	116	171.6	-175.4	0	0	0	0	108.7	I2959 T2960 Y2961 L2969 R2974 S2985 A3255	I2959-V2972 HydrophobicContact CG2-CG1 3.62Å; T2960-V2972 CarbonylContact O-C 3.55Å; T2960-V2972 WeakPolarHBondContact O-CA 3.25Å; Y2961-V2972 HydrophobicContact CD1-CG1 4.43Å; Y2961-V2972 HydrophobicContact CD1-CG2 4.16Å; Y2961-V2972 HydrophobicContact CE1-CG1 4.4Å; Y2961-V2972 HydrophobicContact CE1-CG2 4.45Å; L2969-V2972 HydrophobicContact CD1-CG2 4.03Å; L2969-V2972 HydrophobicContact CD2-CG2 3.69Å; L2969-V2972 HydrophobicContact CG-CG2 4.08Å; V2972-R2974 HydrophobicContact CG1-CG 4.4Å; V2972-S2985 PolarHBondContact N-O 3.14Å; V2972-S2985 PolarHBondContact O-N 3.02Å; V2972-A3255 HydrophobicContact CG2-CB 4.1Å
2973	D	91.3	Very high	83.8	Confident	45.75 Å²	45.75	45.8 Å²	45.8	25%	0.245	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	131.5	174.8	-66.9	-54	0	0	0	110.1	I2959 T2960 S2983 H2984	I2959-D2973 CarbonylContact C-O 3.53Å; I2959-D2973 VanDerWaalsContact CA-O 3.23Å; I2959-D2973 WeakPolarHBondContact CA-O 3.36Å; T2960-D2973 PolarHBondContact N-O 2.89Å; T2960-D2973 PolarHBondContact O-N 3.29Å; D2973-S2983 CarbonylContact C-O 3.54Å; D2973-S2983 WeakPolarHBondContact CA-O 3.36Å; D2973-H2984 IonicContact OD1-CE1 3.43Å; D2973-H2984 IonicContact OD1-CG 3.25Å; D2973-H2984 IonicContact OD1-ND1 2.85Å; D2973-H2984 PolarHBondContact OD1-ND1 3.1Å; D2973-H2984 IonicContact OD2-ND1 3.33Å
2974	R	89.4	Confident	83.9	Confident	68 Å²	68	47.3 Å²	47.3	26%	0.257	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	132.3	174.5	-52.7	-178.5	-178.2	95	0.6	110.2	W2958 I2959 V2972 R2982 S2983 Y3253	W2958-R2974 CarbonylContact O-C 3.55Å; W2958-R2974 VanDerWaalsContact O-CA 3.28Å; W2958-R2974 WeakPolarHBondContact O-CA 3.23Å; I2959-R2974 HydrophobicContact CG1-CG 4.28Å; I2959-R2974 HydrophobicContact CG2-CG 4.39Å; V2972-R2974 HydrophobicContact CG1-CG 4.4Å; R2974-R2982 VanDerWaalsContact O-CA 3.29Å; R2974-R2982 WeakPolarHBondContact O-CA 3.46Å; R2974-S2983 VanDerWaalsContact CB-OG 3.29Å; R2974-S2983 WeakPolarHBondContact CB-OG 3.2Å; R2974-S2983 WeakPolarHBondContact CD-OG 3.5Å; R2974-S2983 WeakPolarHBondContact CG-OG 3.19Å; R2974-S2983 PolarHBondContact N-O 3.21Å; R2974-S2983 PolarHBondContact NH1-OG 3.24Å; R2974-S2983 VanDerWaalsContact NH1-OG 3.15Å; R2974-S2983 PolarHBondContact O-N 2.85Å; R2974-Y3253 PolarHBondContact NH2-O 3.33Å
2975	E	88	Confident	84.1	Confident	69.5 Å²	69.5	47.4 Å²	47.4	33%	0.325	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	138.3	179.9	-73.5	-175.1	168.4	0	0	109.8	R2957 W2958 R2982	R2957-E2975 CarbonylContact C-O 3.56Å; R2957-E2975 WeakPolarHBondContact CA-O 3.37Å; W2958-E2975 PolarHBondContact N-O 3.15Å; W2958-E2975 PolarHBondContact O-N 3.04Å; E2975-R2982 HydrophobicContact CB-CG 4.3Å; E2975-R2982 HydrophobicContact CG-CG 4.18Å; E2975-R2982 WeakPolarHBondContact OE1-CD 3.41Å; E2975-R2982 IonicContact OE1-CZ 3.26Å; E2975-R2982 VanDerWaalsContact OE1-CZ 3.26Å; E2975-R2982 IonicContact OE1-NE 3.71Å; E2975-R2982 PolarHBondContact OE1-NE 3.35Å; E2975-R2982 IonicContact OE1-NH1 3.31Å; E2975-R2982 PolarHBondContact OE1-NH1 3.21Å; E2975-R2982 VanDerWaalsContact OE1-NH1 3.16Å; E2975-R2982 IonicContact OE1-NH2 3.23Å; E2975-R2982 PolarHBondContact OE1-NH2 3.15Å; E2975-R2982 IonicContact OE2-NE 2.98Å; E2975-R2982 IonicContact OE2-NH2 3.26Å
2976	E	84.3	Confident	84.6	Confident	51.75 Å²	51.75	48.4 Å²	48.4	24%	0.242	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	129.8	173.7	-127.4	177.1	-168.9	0	0	110.2	V2955 R2957 G2978 T2979 L2981	V2955-E2976 HydrophobicContact CG2-CB 4.36Å; V2955-E2976 HydrophobicContact CG2-CG 3.47Å; V2955-E2976 VanDerWaalsContact CG2-CG 3.47Å; R2957-E2976 HydrophobicContact CG-CB 4.16Å; R2957-E2976 HydrophobicContact CG-CG 3.89Å; R2957-E2976 IonicContact CZ-OE1 3.07Å; R2957-E2976 VanDerWaalsContact CZ-OE1 3.29Å; R2957-E2976 IonicContact NE-OE1 3.47Å; R2957-E2976 PolarHBondContact NE-OE1 2.94Å; R2957-E2976 IonicContact NE-OE2 3.45Å; R2957-E2976 IonicContact NH2-OE1 3.21Å; R2957-E2976 PolarHBondContact NH2-OE1 3.13Å; R2957-E2976 IonicContact NH2-OE2 3.3Å; E2976-G2978 PolarHBondContact O-N 3.16Å; E2976-T2979 HydrophobicContact CB-CG2 4.04Å; E2976-T2979 WeakPolarHBondContact CB-OG1 3.33Å; E2976-T2979 HydrophobicContact CG-CG2 3.92Å; E2976-T2979 PolarHBondContact O-N 3.06Å; E2976-T2979 VanDerWaalsContact O-N 3.13Å; E2976-T2979 PolarHBondContact O-OG1 3.02Å; E2976-L2981 PolarHBondContact N-O 3.3Å
2977	A	82.3	Confident	85.3	Confident	25.25 Å²	25.25	47.3 Å²	47.3	21%	0.209	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	135.8	-174.4	0	0	0	0	0	111.5	V2955 P2956 W2958 T2979	V2955-A2977 HydrophobicContact CB-CB 4.1Å; V2955-A2977 WeakPolarHBondContact CB-O 3.23Å; V2955-A2977 HydrophobicContact CG1-CB 4.35Å; V2955-A2977 WeakPolarHBondContact CG1-O 3.44Å; V2955-A2977 WeakPolarHBondContact CG2-O 3.15Å; P2956-A2977 HydrophobicContact CB-CB 4.32Å; P2956-A2977 HydrophobicContact CG-CB 4.28Å; P2956-A2977 VanDerWaalsContact O-CB 3.27Å; P2956-A2977 WeakPolarHBondContact O-CB 3.4Å; P2956-A2977 PolarHBondContact O-N 3.04Å; W2958-A2977 HydrophobicContact CH2-CB 3.63Å; W2958-A2977 HydrophobicContact CZ3-CB 3.41Å; W2958-A2977 VanDerWaalsContact CZ3-CB 3.46Å; A2977-T2979 PolarHBondContact O-N 3.15Å; A2977-T2979 VanDerWaalsContact O-N 3.13Å
2978	G	77.9	Confident	86	Confident	89.25 Å²	89.25	49.5 Å²	49.5	92%	0.92	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.5	-0.9	-179.9	0	0	0	0	0	114.5	E2976	E2976-G2978 PolarHBondContact O-N 3.16Å
2979	T	75.2	Confident	86.4	Confident	53.5 Å²	53.5	49.6 Å²	49.6	33%	0.328	27%	0.267	S	S	.	.			trans	-104.6	150	170.5	77.3	0	0	0	0	109.8	E2976 A2977 L2981	E2976-T2979 HydrophobicContact CB-CG2 4.04Å; E2976-T2979 WeakPolarHBondContact CB-OG1 3.33Å; E2976-T2979 HydrophobicContact CG-CG2 3.92Å; E2976-T2979 PolarHBondContact O-N 3.06Å; E2976-T2979 VanDerWaalsContact O-N 3.13Å; E2976-T2979 PolarHBondContact O-OG1 3.02Å; A2977-T2979 PolarHBondContact O-N 3.15Å; A2977-T2979 VanDerWaalsContact O-N 3.13Å; T2979-L2981 VanDerWaalsContact C-N 3.32Å; T2979-L2981 PolarHBondContact OG1-N 3.41Å
2980	S	72.2	Confident	86.5	Confident	33.75 Å²	33.75	49.9 Å²	49.9	24%	0.236	27%	0.269	C	S	.	.			trans	-84	-7.4	168.1	26.9	0	0	0	0	112.2	R2982 S3003 D3004 P3005 Q3006	S2980-R2982 PolarHBondContact O-N 3.02Å; S2980-S3003 PolarHBondContact O-OG 2.85Å; S2980-D3004 VanDerWaalsContact CB-OD1 3.31Å; S2980-D3004 WeakPolarHBondContact CB-OD1 3.46Å; S2980-D3004 PolarHBondContact OG-OD1 3Å; S2980-P3005 VanDerWaalsContact O-CD 3.27Å; S2980-P3005 WeakPolarHBondContact O-CD 3.4Å; S2980-P3005 WeakPolarHBondContact OG-CG 3.46Å; S2980-Q3006 WeakPolarHBondContact OG-CB 3.16Å; S2980-Q3006 VanDerWaalsContact OG-CD 3.28Å; S2980-Q3006 VanDerWaalsContact OG-CG 3.26Å; S2980-Q3006 WeakPolarHBondContact OG-CG 3.42Å
2981	L	72.4	Confident	86.2	Confident	67 Å²	67	49.5 Å²	49.5	35%	0.351	28%	0.278	S	S	.	.			trans	-65.8	119.9	179.1	-126.7	110.1	0	0	0	110.8	E2976 T2979 S3003 D3004 L3100	E2976-L2981 PolarHBondContact N-O 3.3Å; T2979-L2981 VanDerWaalsContact C-N 3.32Å; T2979-L2981 PolarHBondContact OG1-N 3.41Å; L2981-S3003 WeakPolarHBondContact CA-O 3.22Å; L2981-D3004 HydrophobicContact CD1-CB 4.15Å; L2981-D3004 HydrophobicContact CD2-CB 4Å; L2981-L3100 HydrophobicContact CD1-CD2 4.34Å; L2981-L3100 HydrophobicContact CD2-CD1 3.9Å
2982	R	78.3	Confident	85.8	Confident	133.75 Å²	133.75	49.6 Å²	49.6	51%	0.505	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	137.8	172.4	-63.4	-174.9	177.8	-168.8	-3.8	110	R2974 E2975 S2980 T3002 S3003	R2974-R2982 VanDerWaalsContact O-CA 3.29Å; R2974-R2982 WeakPolarHBondContact O-CA 3.46Å; E2975-R2982 HydrophobicContact CB-CG 4.3Å; E2975-R2982 HydrophobicContact CG-CG 4.18Å; E2975-R2982 WeakPolarHBondContact OE1-CD 3.41Å; E2975-R2982 IonicContact OE1-CZ 3.26Å; E2975-R2982 VanDerWaalsContact OE1-CZ 3.26Å; E2975-R2982 IonicContact OE1-NE 3.71Å; E2975-R2982 PolarHBondContact OE1-NE 3.35Å; E2975-R2982 IonicContact OE1-NH1 3.31Å; E2975-R2982 PolarHBondContact OE1-NH1 3.21Å; E2975-R2982 VanDerWaalsContact OE1-NH1 3.16Å; E2975-R2982 IonicContact OE1-NH2 3.23Å; E2975-R2982 PolarHBondContact OE1-NH2 3.15Å; E2975-R2982 IonicContact OE2-NE 2.98Å; E2975-R2982 IonicContact OE2-NH2 3.26Å; S2980-R2982 PolarHBondContact O-N 3.02Å; R2982-T3002 VanDerWaalsContact O-CA 3.28Å; R2982-T3002 WeakPolarHBondContact O-CA 3.26Å; R2982-S3003 PolarHBondContact N-O 3.22Å; R2982-S3003 PolarHBondContact O-N 2.84Å
2983	S	84.2	Confident	85.5	Confident	22.25 Å²	22.25	50 Å²	50	16%	0.156	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	121.4	171.1	128.5	0	0	0	0	109.5	D2973 R2974 A3001	D2973-S2983 CarbonylContact C-O 3.54Å; D2973-S2983 WeakPolarHBondContact CA-O 3.36Å; R2974-S2983 VanDerWaalsContact CB-OG 3.29Å; R2974-S2983 WeakPolarHBondContact CB-OG 3.2Å; R2974-S2983 WeakPolarHBondContact CD-OG 3.5Å; R2974-S2983 WeakPolarHBondContact CG-OG 3.19Å; R2974-S2983 PolarHBondContact N-O 3.21Å; R2974-S2983 PolarHBondContact NH1-OG 3.24Å; R2974-S2983 VanDerWaalsContact NH1-OG 3.15Å; R2974-S2983 PolarHBondContact O-N 2.85Å; S2983-A3001 CarbonylContact C-O 3.5Å; S2983-A3001 WeakPolarHBondContact CA-O 3.28Å
2984	H	89	Confident	85.4	Confident	67 Å²	67	49.2 Å²	49.2	31%	0.31	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	123.3	175.2	177.8	71.6	0	0	0	109.2	D2973 I3000 A3001	D2973-H2984 IonicContact OD1-CE1 3.43Å; D2973-H2984 IonicContact OD1-CG 3.25Å; D2973-H2984 IonicContact OD1-ND1 2.85Å; D2973-H2984 PolarHBondContact OD1-ND1 3.1Å; D2973-H2984 IonicContact OD2-ND1 3.33Å; H2984-I3000 CarbonylContact O-C 3.55Å; H2984-I3000 VanDerWaalsContact O-CA 3.32Å; H2984-I3000 WeakPolarHBondContact O-CA 3.38Å; H2984-A3001 HydrophobicContact CB-CB 4.45Å; H2984-A3001 PolarHBondContact N-O 3.01Å; H2984-A3001 PolarHBondContact O-N 2.99Å
2985	S	90.3	Very high	85.6	Confident	9.25 Å²	9.25	47.1 Å²	47.1	7%	0.065	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	117.9	173.6	-57.4	0	0	0	0	109.5	A2971 V2972 R2999	A2971-S2985 CarbonylContact C-O 3.45Å; A2971-S2985 WeakPolarHBondContact CA-O 3.18Å; A2971-S2985 WeakPolarHBondContact CB-O 3.38Å; V2972-S2985 PolarHBondContact N-O 3.14Å; V2972-S2985 PolarHBondContact O-N 3.02Å; S2985-R2999 CarbonylContact C-O 3.52Å; S2985-R2999 VanDerWaalsContact CA-O 3.28Å; S2985-R2999 WeakPolarHBondContact CA-O 3.42Å
2986	Q	93.7	Very high	85.9	Confident	71 Å²	71	44.6 Å²	44.6	33%	0.332	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	130.7	-179.8	-170.3	-179	33.1	0	0	110.9	E2970 I2988 L2998 R2999	E2970-Q2986 CarbonylContact O-C 3.54Å; E2970-Q2986 WeakPolarHBondContact O-CA 3.26Å; Q2986-I2988 HydrophobicContact CG-CG1 4.39Å; Q2986-L2998 CarbonylContact O-C 3.52Å; Q2986-L2998 WeakPolarHBondContact O-CA 3.32Å; Q2986-R2999 HydrophobicContact CB-CB 4.27Å; Q2986-R2999 PolarHBondContact N-O 3.36Å; Q2986-R2999 PolarHBondContact O-N 2.94Å
2987	L	93.5	Very high	86.4	Confident	11.25 Å²	11.25	44.7 Å²	44.7	6%	0.059	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	119.8	175.9	-65.2	90.4	0	0	0	109.4	L2969 E2970 Y2989 I2995 L2998 A3255	L2969-L2987 HydrophobicContact CD2-CD1 4.25Å; L2969-L2987 HydrophobicContact CG-CD1 4.27Å; L2969-L2987 WeakPolarHBondContact O-CB 3.31Å; E2970-L2987 PolarHBondContact O-N 3.23Å; L2987-Y2989 HydrophobicContact CB-CE2 3.99Å; L2987-Y2989 WeakPolarHBondContact O-CD2 3.4Å; L2987-I2995 HydrophobicContact CD2-CD1 3.8Å; L2987-I2995 HydrophobicContact CD2-CG1 4.23Å; L2987-L2998 HydrophobicContact CD1-CD1 4.36Å; L2987-L2998 HydrophobicContact CG-CD1 4.07Å; L2987-A3255 HydrophobicContact CD1-CB 3.59Å; L2987-A3255 HydrophobicContact CD2-CB 3.85Å; L2987-A3255 HydrophobicContact CG-CB 4.28Å
2988	I	94.3	Very high	86.8	Confident	53.75 Å²	53.75	44.3 Å²	44.3	28%	0.276	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	133.4	175.9	-56.2	170.8	0	0	0	107.7	Q2986 A2996 H2997	Q2986-I2988 HydrophobicContact CG-CG1 4.39Å; I2988-A2996 WeakPolarHBondContact O-CA 3.4Å; I2988-A2996 PolarHBondContact O-N 3.22Å; I2988-H2997 HydrophobicContact CB-CB 4.1Å; I2988-H2997 HydrophobicContact CD1-CB 4.21Å; I2988-H2997 HydrophobicContact CG1-CB 4.49Å; I2988-H2997 PolarHBondContact N-O 3.21Å; I2988-H2997 PolarHBondContact O-N 3.03Å; I2988-H2997 VanDerWaalsContact O-N 3.12Å
2989	Y	92.3	Very high	87.5	Confident	51.75 Å²	51.75	44.8 Å²	44.8	20%	0.203	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	150.4	-170.7	-67.6	-83.2	0	0	0	112.2	R2968 L2969 E2970 L2987 G2993 R2994 I2995	R2968-Y2989 HydrophobicContact CB-CE1 4.5Å; R2968-Y2989 HydrophobicContact CB-CE2 4.02Å; R2968-Y2989 VanDerWaalsContact CD-CD2 3.44Å; R2968-Y2989 VanDerWaalsContact CD-CE2 3.41Å; R2968-Y2989 HydrophobicContact CG-CD2 4.1Å; R2968-Y2989 HydrophobicContact CG-CE1 4.13Å; R2968-Y2989 HydrophobicContact CG-CE2 3.65Å; R2968-Y2989 VanDerWaalsContact CG-CE2 3.4Å; R2968-Y2989 VanDerWaalsContact CG-CZ 3.46Å; R2968-Y2989 VanDerWaalsContact CZ-CD2 3.49Å; R2968-Y2989 VanDerWaalsContact NE-CE2 3.32Å; R2968-Y2989 VanDerWaalsContact NE-CZ 3.31Å; R2968-Y2989 VanDerWaalsContact NH1-CB 3.27Å; L2969-Y2989 VanDerWaalsContact O-CE2 3.26Å; L2969-Y2989 WeakPolarHBondContact O-CE2 3.32Å; L2969-Y2989 VanDerWaalsContact O-CZ 3.3Å; L2969-Y2989 PolarHBondContact O-OH 2.91Å; E2970-Y2989 HydrophobicContact CG-CE2 4.39Å; L2987-Y2989 HydrophobicContact CB-CE2 3.99Å; L2987-Y2989 WeakPolarHBondContact O-CD2 3.4Å; Y2989-G2993 WeakPolarHBondContact CD1-O 3.33Å; Y2989-R2994 CarbonylContact C-O 3.58Å; Y2989-R2994 WeakPolarHBondContact CA-O 3.39Å; Y2989-R2994 WeakPolarHBondContact CD1-O 3.42Å; Y2989-I2995 HydrophobicContact CD1-CB 4.35Å; Y2989-I2995 HydrophobicContact CD1-CG1 4.19Å; Y2989-I2995 HydrophobicContact CE1-CB 4.39Å; Y2989-I2995 HydrophobicContact CE1-CG1 3.76Å
2990	N	90.1	Very high	87.9	Confident	41.25 Å²	41.25	43.5 Å²	43.5	22%	0.221	22%	0.22	C	C	.	.			trans	-81.3	179.1	169.7	73.6	7.2	0	0	0	111.8	E2992 G2993 R2994 A2996	N2990-E2992 PolarHBondContact O-N 3.05Å; N2990-E2992 VanDerWaalsContact O-N 3.14Å; N2990-E2992 WeakPolarHBondContact OD1-CB 3.22Å; N2990-E2992 PolarHBondContact OD1-N 3.31Å; N2990-E2992 VanDerWaalsContact OD1-N 3.08Å; N2990-G2993 PolarHBondContact O-N 3.1Å; N2990-G2993 PolarHBondContact OD1-N 3.02Å; N2990-G2993 VanDerWaalsContact OD1-N 3.1Å; N2990-R2994 PolarHBondContact N-O 3.03Å; N2990-R2994 PolarHBondContact OD1-N 3.03Å; N2990-R2994 PolarHBondContact OD1-O 3.03Å; N2990-A2996 HydrophobicContact CB-CB 4.28Å
2991	A	86.3	Confident	88.5	Confident	61 Å²	61	43.6 Å²	43.6	50%	0.504	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-18.1	-178.6	0	0	0	0	0	114.9	S2640 G2641 P2679 T2680	S2640-A2991 CarbonylContact C-O 3.53Å; S2640-A2991 VanDerWaalsContact C-O 3.32Å; S2640-A2991 VanDerWaalsContact O-O 3.11Å; G2641-A2991 PolarHBondContact N-O 2.97Å; P2679-A2991 HydrophobicContact CB-CB 4.05Å; T2680-A2991 HydrophobicContact CG2-CB 4.46Å
2992	E	84.5	Confident	88.8	Confident	10.75 Å²	10.75	42.8 Å²	42.8	5%	0.05	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.4	0.6	-179.6	-80.9	-178.9	164.9	0	0	113.2	T2678 P2679 T2680 N2990 R2994 K3339	T2678-E2992 VanDerWaalsContact CB-OE1 3.25Å; T2678-E2992 WeakPolarHBondContact CB-OE1 3.37Å; T2678-E2992 PolarHBondContact OG1-OE1 3.05Å; T2678-E2992 VanDerWaalsContact OG1-OE1 3.07Å; P2679-E2992 HydrophobicContact CB-CG 4.48Å; P2679-E2992 HydrophobicContact CG-CG 4.41Å; T2680-E2992 WeakPolarHBondContact CB-OE1 3.38Å; T2680-E2992 HydrophobicContact CG2-CB 3.68Å; T2680-E2992 VanDerWaalsContact CG2-CD 3.47Å; T2680-E2992 HydrophobicContact CG2-CG 3.61Å; T2680-E2992 WeakPolarHBondContact CG2-OE1 3.42Å; T2680-E2992 VanDerWaalsContact OG1-CD 3.31Å; T2680-E2992 PolarHBondContact OG1-OE1 3.11Å; N2990-E2992 PolarHBondContact O-N 3.05Å; N2990-E2992 VanDerWaalsContact O-N 3.14Å; N2990-E2992 WeakPolarHBondContact OD1-CB 3.22Å; N2990-E2992 PolarHBondContact OD1-N 3.31Å; N2990-E2992 VanDerWaalsContact OD1-N 3.08Å; E2992-R2994 IonicContact OE2-CZ 3.84Å; E2992-R2994 VanDerWaalsContact OE2-CZ 3.28Å; E2992-R2994 IonicContact OE2-NE 3.76Å; E2992-R2994 IonicContact OE2-NH1 3.42Å; E2992-R2994 PolarHBondContact OE2-NH1 3.06Å; E2992-R2994 IonicContact OE2-NH2 3.75Å; E2992-R2994 PolarHBondContact OE2-NH2 2.87Å; E2992-K3339 PolarHBondContact O-NZ 3.09Å
2993	G	86.2	Confident	88.6	Confident	12.25 Å²	12.25	38.4 Å²	38.4	13%	0.126	21%	0.21	C	C	.	.	S	Bend	trans	78.6	22.1	-176.5	0	0	0	0	0	114.6	G2639 R2968 Y2989 N2990 K3339	G2639-G2993 VanDerWaalsContact O-CA 3.28Å; G2639-G2993 WeakPolarHBondContact O-CA 3.26Å; R2968-G2993 VanDerWaalsContact CZ-CA 3.5Å; R2968-G2993 PolarHBondContact NH2-O 3.27Å; Y2989-G2993 WeakPolarHBondContact CD1-O 3.33Å; N2990-G2993 PolarHBondContact O-N 3.1Å; N2990-G2993 PolarHBondContact OD1-N 3.02Å; N2990-G2993 VanDerWaalsContact OD1-N 3.1Å; G2993-K3339 WeakPolarHBondContact O-CE 3.37Å
2994	R	89.9	Confident	87.8	Confident	30.75 Å²	30.75	38.9 Å²	38.9	12%	0.116	21%	0.211	C	C	.	.			trans	-96	152.3	168.7	-58.8	-178	175.3	153.9	-2.1	110.9	R2968 Y2989 N2990 E2992 A2996 Y3028 G3032 D3336	R2968-R2994 PolarHBondContact NH2-O 3.04Å; Y2989-R2994 CarbonylContact C-O 3.58Å; Y2989-R2994 WeakPolarHBondContact CA-O 3.39Å; Y2989-R2994 WeakPolarHBondContact CD1-O 3.42Å; N2990-R2994 PolarHBondContact N-O 3.03Å; N2990-R2994 PolarHBondContact OD1-N 3.03Å; N2990-R2994 PolarHBondContact OD1-O 3.03Å; E2992-R2994 IonicContact OE2-CZ 3.84Å; E2992-R2994 VanDerWaalsContact OE2-CZ 3.28Å; E2992-R2994 IonicContact OE2-NE 3.76Å; E2992-R2994 IonicContact OE2-NH1 3.42Å; E2992-R2994 PolarHBondContact OE2-NH1 3.06Å; E2992-R2994 IonicContact OE2-NH2 3.75Å; E2992-R2994 PolarHBondContact OE2-NH2 2.87Å; R2994-A2996 PolarHBondContact O-N 3.17Å; R2994-Y3028 HydrophobicContact CB-CE1 4.35Å; R2994-Y3028 HydrophobicContact CB-CE2 4.04Å; R2994-Y3028 VanDerWaalsContact NH1-CE1 3.35Å; R2994-G3032 PolarHBondContact NE-O 3.36Å; R2994-G3032 VanDerWaalsContact NH1-C 3.33Å; R2994-G3032 PolarHBondContact NH1-O 3.14Å; R2994-G3032 VanDerWaalsContact NH1-O 3.11Å; R2994-G3032 PolarHBondContact NH2-O 3.36Å; R2994-D3336 IonicContact CZ-OD1 2.91Å; R2994-D3336 IonicContact CZ-OD2 3.16Å; R2994-D3336 IonicContact NE-OD2 3.34Å; R2994-D3336 PolarHBondContact NE-OD2 2.94Å; R2994-D3336 IonicContact NH2-OD1 3.87Å; R2994-D3336 PolarHBondContact NH2-OD1 2.99Å; R2994-D3336 IonicContact NH2-OD2 2.95Å; R2994-D3336 PolarHBondContact NH2-OD2 3.21Å
2995	I	92.8	Very high	86.4	Confident	23.25 Å²	23.25	39.9 Å²	39.9	12%	0.119	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	126.9	179	-58.8	170.9	0	0	0	108.6	L2987 Y2989 F3026 Y3028 T3256 A3310	L2987-I2995 HydrophobicContact CD2-CD1 3.8Å; L2987-I2995 HydrophobicContact CD2-CG1 4.23Å; Y2989-I2995 HydrophobicContact CD1-CB 4.35Å; Y2989-I2995 HydrophobicContact CD1-CG1 4.19Å; Y2989-I2995 HydrophobicContact CE1-CB 4.39Å; Y2989-I2995 HydrophobicContact CE1-CG1 3.76Å; I2995-F3026 HydrophobicContact CB-CD1 4.5Å; I2995-F3026 HydrophobicContact CB-CD2 4.45Å; I2995-F3026 HydrophobicContact CB-CG 4.45Å; I2995-F3026 HydrophobicContact CG2-CD2 3.71Å; I2995-F3026 HydrophobicContact CG2-CE2 3.75Å; I2995-F3026 HydrophobicContact CG2-CG 4.15Å; I2995-F3026 HydrophobicContact CG2-CZ 4.19Å; I2995-F3026 WeakPolarHBondContact O-CB 3.43Å; I2995-Y3028 WeakPolarHBondContact O-CE2 3.34Å; I2995-Y3028 PolarHBondContact O-OH 2.91Å; I2995-T3256 HydrophobicContact CD1-CG2 3.6Å; I2995-A3310 HydrophobicContact CD1-CB 3.69Å
2996	A	94.1	Very high	85	Confident	17.25 Å²	17.25	47 Å²	47	14%	0.143	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	-40.1	175	0	0	0	0	0	111.5	I2988 N2990 R2994 F3026	I2988-A2996 WeakPolarHBondContact O-CA 3.4Å; I2988-A2996 PolarHBondContact O-N 3.22Å; N2990-A2996 HydrophobicContact CB-CB 4.28Å; R2994-A2996 PolarHBondContact O-N 3.17Å; A2996-F3026 PolarHBondContact O-N 2.99Å
2997	H	94.3	Very high	83	Confident	52.5 Å²	52.5	47.4 Å²	47.4	24%	0.243	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	142.1	176.4	-59.3	-119.5	0	0	0	110.5	I2988 E3023 L3024	I2988-H2997 HydrophobicContact CB-CB 4.1Å; I2988-H2997 HydrophobicContact CD1-CB 4.21Å; I2988-H2997 HydrophobicContact CG1-CB 4.49Å; I2988-H2997 PolarHBondContact N-O 3.21Å; I2988-H2997 PolarHBondContact O-N 3.03Å; I2988-H2997 VanDerWaalsContact O-N 3.12Å; H2997-E3023 HydrophobicContact CB-CG 4.47Å; H2997-E3023 IonicContact CD2-OE1 3.15Å; H2997-E3023 PolarHBondContact CD2-OE1 2.86Å; H2997-E3023 IonicContact CE1-OE1 2.95Å; H2997-E3023 IonicContact CG-OE1 3.73Å; H2997-E3023 IonicContact ND1-OE1 2.76Å; H2997-E3023 PolarHBondContact ND1-OE1 2.85Å; H2997-L3024 CarbonylContact C-O 3.54Å; H2997-L3024 WeakPolarHBondContact CA-O 3.45Å
2998	L	92.2	Very high	80.9	Confident	17.5 Å²	17.5	50.9 Å²	50.9	9%	0.092	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	113.8	168.4	172.2	64	0	0	0	107.9	Q2986 L2987 I3000 E3023 L3024 F3026 E3106	Q2986-L2998 CarbonylContact O-C 3.52Å; Q2986-L2998 WeakPolarHBondContact O-CA 3.32Å; L2987-L2998 HydrophobicContact CD1-CD1 4.36Å; L2987-L2998 HydrophobicContact CG-CD1 4.07Å; L2998-I3000 HydrophobicContact CD1-CD1 4.46Å; L2998-I3000 HydrophobicContact CD1-CG1 4.33Å; L2998-I3000 HydrophobicContact CD2-CD1 4.23Å; L2998-I3000 HydrophobicContact CG-CD1 4.17Å; L2998-I3000 HydrophobicContact CG-CG1 4.14Å; L2998-E3023 WeakPolarHBondContact O-CA 3.39Å; L2998-L3024 HydrophobicContact CB-CB 4.34Å; L2998-L3024 HydrophobicContact CD2-CD1 4.21Å; L2998-L3024 PolarHBondContact N-O 2.96Å; L2998-L3024 PolarHBondContact O-N 3.15Å; L2998-F3026 HydrophobicContact CB-CE2 3.9Å; L2998-E3106 HydrophobicContact CD2-CB 3.98Å; L2998-E3106 HydrophobicContact CD2-CG 3.99Å
2999	R	90.7	Very high	78.6	Confident	100 Å²	100	52.7 Å²	52.7	38%	0.377	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	130.4	177.4	-63.9	173.5	178.1	178.8	-5.9	109.3	S2985 Q2986 E3022 E3023	S2985-R2999 CarbonylContact C-O 3.52Å; S2985-R2999 VanDerWaalsContact CA-O 3.28Å; S2985-R2999 WeakPolarHBondContact CA-O 3.42Å; Q2986-R2999 HydrophobicContact CB-CB 4.27Å; Q2986-R2999 PolarHBondContact N-O 3.36Å; Q2986-R2999 PolarHBondContact O-N 2.94Å; R2999-E3022 CarbonylContact C-O 3.53Å; R2999-E3022 WeakPolarHBondContact CA-O 3.45Å; R2999-E3023 HydrophobicContact CG-CB 4.09Å; R2999-E3023 HydrophobicContact CG-CG 3.75Å; R2999-E3023 IonicContact CZ-OE1 3.01Å; R2999-E3023 IonicContact CZ-OE2 3.8Å; R2999-E3023 VanDerWaalsContact NE-CD 3.28Å; R2999-E3023 IonicContact NE-OE1 3.07Å; R2999-E3023 PolarHBondContact NE-OE1 2.95Å; R2999-E3023 IonicContact NE-OE2 3.41Å; R2999-E3023 PolarHBondContact NE-OE2 3.18Å; R2999-E3023 IonicContact NH2-OE1 3.88Å; R2999-E3023 PolarHBondContact NH2-OE1 3.12Å; R2999-E3023 VanDerWaalsContact NH2-OE1 3.11Å; R2999-E3023 IonicContact NH2-OE2 2.84Å
3000	I	84.8	Confident	76.3	Confident	27.25 Å²	27.25	56.9 Å²	56.9	14%	0.14	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	117.8	179.4	-56.4	176.9	0	0	0	107.3	H2984 L2998 S3021 E3022 L3024 A3104 L3105 E3106	H2984-I3000 CarbonylContact O-C 3.55Å; H2984-I3000 VanDerWaalsContact O-CA 3.32Å; H2984-I3000 WeakPolarHBondContact O-CA 3.38Å; L2998-I3000 HydrophobicContact CD1-CD1 4.46Å; L2998-I3000 HydrophobicContact CD1-CG1 4.33Å; L2998-I3000 HydrophobicContact CD2-CD1 4.23Å; L2998-I3000 HydrophobicContact CG-CD1 4.17Å; L2998-I3000 HydrophobicContact CG-CG1 4.14Å; I3000-S3021 CarbonylContact O-C 3.53Å; I3000-S3021 VanDerWaalsContact O-CA 3.27Å; I3000-S3021 WeakPolarHBondContact O-CA 3.36Å; I3000-E3022 PolarHBondContact N-O 3.11Å; I3000-E3022 PolarHBondContact O-N 3.19Å; I3000-L3024 HydrophobicContact CD1-CD1 4.11Å; I3000-A3104 HydrophobicContact CD1-CB 3.98Å; I3000-A3104 HydrophobicContact CG2-CB 4.17Å; I3000-L3105 HydrophobicContact CD1-CD1 3.36Å; I3000-L3105 HydrophobicContact CD1-CD2 3.5Å; I3000-L3105 HydrophobicContact CD1-CG 4Å; I3000-L3105 HydrophobicContact CG2-CD1 4.49Å; I3000-E3106 HydrophobicContact CD1-CB 3.6Å; I3000-E3106 HydrophobicContact CD1-CG 3.72Å; I3000-E3106 HydrophobicContact CG1-CG 4.29Å
3001	A	83.8	Confident	74.1	Confident	34 Å²	34	62.6 Å²	62.6	28%	0.281	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	132.6	175.6	0	0	0	0	0	109.8	S2983 H2984 R3020	S2983-A3001 CarbonylContact C-O 3.5Å; S2983-A3001 WeakPolarHBondContact CA-O 3.28Å; H2984-A3001 HydrophobicContact CB-CB 4.45Å; H2984-A3001 PolarHBondContact N-O 3.01Å; H2984-A3001 PolarHBondContact O-N 2.99Å; A3001-R3020 CarbonylContact C-O 3.58Å; A3001-R3020 VanDerWaalsContact CA-O 3.31Å; A3001-R3020 WeakPolarHBondContact CA-O 3.38Å
3002	T	78.5	Confident	72.1	Confident	52 Å²	52	70.1 Å²	70.1	32%	0.319	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	128	169.5	53.1	0	0	0	0	108.6	R2982 S3019 R3020	R2982-T3002 VanDerWaalsContact O-CA 3.28Å; R2982-T3002 WeakPolarHBondContact O-CA 3.26Å; T3002-S3019 CarbonylContact O-C 3.53Å; T3002-S3019 VanDerWaalsContact O-CA 3.23Å; T3002-S3019 WeakPolarHBondContact O-CA 3.19Å; T3002-R3020 PolarHBondContact N-O 2.86Å; T3002-R3020 PolarHBondContact O-N 2.79Å; T3002-R3020 PolarHBondContact OG1-O 2.9Å
3003	S	74.2	Confident	70.2	Confident	41 Å²	41	74.1 Å²	74.1	29%	0.287	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	133.6	176.7	59.2	0	0	0	0	110.1	S2980 L2981 R2982 S3019	S2980-S3003 PolarHBondContact O-OG 2.85Å; L2981-S3003 WeakPolarHBondContact CA-O 3.22Å; R2982-S3003 PolarHBondContact N-O 3.22Å; R2982-S3003 PolarHBondContact O-N 2.84Å; S3003-S3019 VanDerWaalsContact CB-OG 3.22Å; S3003-S3019 WeakPolarHBondContact CB-OG 3.2Å
3004	D	68	Low	68.3	Low	33 Å²	33	83.7 Å²	83.7	18%	0.176	44%	0.438	C	S	.	.			trans	-135	102.1	170.2	-174.3	-8.3	0	0	0	109.5	S2980 L2981 Q3006 L3007 T3018	S2980-D3004 VanDerWaalsContact CB-OD1 3.31Å; S2980-D3004 WeakPolarHBondContact CB-OD1 3.46Å; S2980-D3004 PolarHBondContact OG-OD1 3Å; L2981-D3004 HydrophobicContact CD1-CB 4.15Å; L2981-D3004 HydrophobicContact CD2-CB 4Å; D3004-Q3006 PolarHBondContact O-N 3.07Å; D3004-Q3006 WeakPolarHBondContact OD1-CB 3.09Å; D3004-Q3006 PolarHBondContact OD1-N 2.87Å; D3004-L3007 HydrophobicContact CB-CD1 4Å; D3004-L3007 HydrophobicContact CB-CG 4.16Å; D3004-L3007 WeakPolarHBondContact O-CB 3.29Å; D3004-L3007 WeakPolarHBondContact O-CD1 3.48Å; D3004-L3007 PolarHBondContact O-N 2.84Å; D3004-L3007 VanDerWaalsContact O-N 3.08Å; D3004-T3018 PolarHBondContact N-O 2.99Å
3005	P	60	Low	66.2	Low	87.3333 Å²	87.3333	86.4 Å²	86.4	57%	0.567	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-13.3	176.6	7.4	-12.3	0	0	0	115.2	S2980 L3007	S2980-P3005 VanDerWaalsContact O-CD 3.27Å; S2980-P3005 WeakPolarHBondContact O-CD 3.4Å; S2980-P3005 WeakPolarHBondContact OG-CG 3.46Å; P3005-L3007 VanDerWaalsContact C-N 3.34Å
3006	Q	60.1	Low	63.9	Low	158.333 Å²	158.333	87.9 Å²	87.9	74%	0.74	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-2.7	179	-67.9	-174.7	-3.4	0	0	113.9	S2980 D3004 P3008	S2980-Q3006 WeakPolarHBondContact OG-CB 3.16Å; S2980-Q3006 VanDerWaalsContact OG-CD 3.28Å; S2980-Q3006 VanDerWaalsContact OG-CG 3.26Å; S2980-Q3006 WeakPolarHBondContact OG-CG 3.42Å; D3004-Q3006 PolarHBondContact O-N 3.07Å; D3004-Q3006 WeakPolarHBondContact OD1-CB 3.09Å; D3004-Q3006 PolarHBondContact OD1-N 2.87Å; Q3006-P3008 VanDerWaalsContact O-CD 3.31Å; Q3006-P3008 WeakPolarHBondContact O-CD 3.41Å; Q3006-P3008 VanDerWaalsContact O-N 3.13Å
3007	L	52.5	Low	61.7	Low	78.3333 Å²	78.3333	93.3 Å²	93.3	41%	0.41	51%	0.508	S	S	.	.	S	Bend	trans	-62.9	120.7	172.1	-79.7	164.8	0	0	0	109.8	D3004 P3005 S3009 T3018	D3004-L3007 HydrophobicContact CB-CD1 4Å; D3004-L3007 HydrophobicContact CB-CG 4.16Å; D3004-L3007 WeakPolarHBondContact O-CB 3.29Å; D3004-L3007 WeakPolarHBondContact O-CD1 3.48Å; D3004-L3007 PolarHBondContact O-N 2.84Å; D3004-L3007 VanDerWaalsContact O-N 3.08Å; P3005-L3007 VanDerWaalsContact C-N 3.34Å; L3007-S3009 PolarHBondContact O-N 2.88Å; L3007-T3018 HydrophobicContact CB-CG2 3.99Å; L3007-T3018 VanDerWaalsContact O-CG2 3.26Å; L3007-T3018 WeakPolarHBondContact O-CG2 3.24Å
3008	P	48.2	Very low	59.8	Low	85.6667 Å²	85.6667	93.7 Å²	93.7	56%	0.556	52%	0.515	S	S	*	.			trans	-62.6	135.5	-177.6	21.7	-29.7	0	0	0	110.8	Q3006 N3010 E3011	Q3006-P3008 VanDerWaalsContact O-CD 3.31Å; Q3006-P3008 WeakPolarHBondContact O-CD 3.41Å; Q3006-P3008 VanDerWaalsContact O-N 3.13Å; P3008-N3010 PolarHBondContact O-N 2.76Å; P3008-E3011 PolarHBondContact O-N 3.26Å
3009	S	46.6	Very low	58.4	Low	91 Å²	91	95.7 Å²	95.7	64%	0.636	53%	0.53	S	S	*	.			trans	-61.4	54.9	176.1	54.9	0	0	0	0	111.8	L3007 E3011	L3007-S3009 PolarHBondContact O-N 2.88Å; S3009-E3011 PolarHBondContact O-N 3.14Å
3010	N	44.8	Very low	57.3	Low	141.333 Å²	141.333	96.7 Å²	96.7	76%	0.756	53%	0.534	S	S	*	.			trans	-74	84.9	179.2	-75.6	-11.9	0	0	0	111	P3008 R3012	P3008-N3010 PolarHBondContact O-N 2.76Å; N3010-R3012 PolarHBondContact O-N 2.83Å
3011	E	43.9	Very low	57	Low	159.667 Å²	159.667	100.1 Å²	100.1	75%	0.746	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	43.3	177.1	-64.3	-174.5	157	0	0	113.6	P3008 S3009 S3013	P3008-E3011 PolarHBondContact O-N 3.26Å; S3009-E3011 PolarHBondContact O-N 3.14Å; E3011-S3013 VanDerWaalsContact C-N 3.3Å; E3011-S3013 PolarHBondContact O-N 3.43Å
3012	R	44.2	Very low	56.9	Low	219.667 Å²	219.667	101.5 Å²	101.5	83%	0.829	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.2	43.1	168	-99.6	-177.8	-177.5	-163.4	0.6	115.7	N3010	N3010-R3012 PolarHBondContact O-N 2.83Å
3013	S	43.2	Very low	57.3	Low	94.6667 Å²	94.6667	103.6 Å²	103.6	66%	0.662	57%	0.567	S	S	*	*			trans	-111.7	135.3	158.5	-97.6	0	0	0	0	109.6	E3011 S3015 G3016	E3011-S3013 VanDerWaalsContact C-N 3.3Å; E3011-S3013 PolarHBondContact O-N 3.43Å; S3013-S3015 PolarHBondContact O-N 3.27Å; S3013-G3016 PolarHBondContact O-N 2.87Å
3014	E	47.5	Very low	58.1	Low	213.333 Å²	213.333	102.3 Å²	102.3	100%	0.997	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.2	15.6	-170	-72.5	-173.8	146.7	0	0	116.4
3015	S	44.7	Very low	59.3	Low	87.3333 Å²	87.3333	104.5 Å²	104.5	61%	0.611	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.7	40.4	174.3	58.4	0	0	0	0	113.9	S3013 L3017	S3013-S3015 PolarHBondContact O-N 3.27Å; S3015-L3017 VanDerWaalsContact C-N 3.28Å; S3015-L3017 PolarHBondContact O-N 3.18Å; S3015-L3017 VanDerWaalsContact O-N 3.12Å
3016	G	45.8	Very low	61.1	Low	55.6667 Å²	55.6667	100.7 Å²	100.7	57%	0.574	54%	0.541	S	S	*	.			trans	-52.7	56	173.4	0	0	0	0	0	114.2	S3013 T3018	S3013-G3016 PolarHBondContact O-N 2.87Å; G3016-T3018 PolarHBondContact O-N 3.41Å
3017	L	48.2	Very low	62.8	Low	128.667 Å²	128.667	96.2 Å²	96.2	67%	0.674	52%	0.521	S	S	*	.			trans	-79.8	109.6	-178.8	-75.1	155.1	0	0	0	111	S3015 S3019	S3015-L3017 VanDerWaalsContact C-N 3.28Å; S3015-L3017 PolarHBondContact O-N 3.18Å; S3015-L3017 VanDerWaalsContact O-N 3.12Å; L3017-S3019 PolarHBondContact O-N 2.9Å
3018	T	54	Low	64.8	Low	62.3333 Å²	62.3333	94.8 Å²	94.8	38%	0.382	51%	0.511	S	S	.	.	S	Bend	trans	-77.4	4.7	170.1	53.6	0	0	0	0	113	D3004 L3007 G3016	D3004-T3018 PolarHBondContact N-O 2.99Å; L3007-T3018 HydrophobicContact CB-CG2 3.99Å; L3007-T3018 VanDerWaalsContact O-CG2 3.26Å; L3007-T3018 WeakPolarHBondContact O-CG2 3.24Å; G3016-T3018 PolarHBondContact O-N 3.41Å
3019	S	61.8	Low	66.9	Low	58.3333 Å²	58.3333	92.8 Å²	92.8	41%	0.408	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	135.4	-179.2	26.2	0	0	0	0	110.5	T3002 S3003 L3017	T3002-S3019 CarbonylContact O-C 3.53Å; T3002-S3019 VanDerWaalsContact O-CA 3.23Å; T3002-S3019 WeakPolarHBondContact O-CA 3.19Å; S3003-S3019 VanDerWaalsContact CB-OG 3.22Å; S3003-S3019 WeakPolarHBondContact CB-OG 3.2Å; L3017-S3019 PolarHBondContact O-N 2.9Å
3020	R	68.8	Low	69	Low	121.667 Å²	121.667	92.6 Å²	92.6	46%	0.459	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	128.9	172.7	179.4	178.4	172.7	173	-2.3	108.5	A3001 T3002 E3022	A3001-R3020 CarbonylContact C-O 3.58Å; A3001-R3020 VanDerWaalsContact CA-O 3.31Å; A3001-R3020 WeakPolarHBondContact CA-O 3.38Å; T3002-R3020 PolarHBondContact N-O 2.86Å; T3002-R3020 PolarHBondContact O-N 2.79Å; T3002-R3020 PolarHBondContact OG1-O 2.9Å; R3020-E3022 IonicContact CZ-OE1 3.91Å; R3020-E3022 IonicContact NE-OE1 3.9Å; R3020-E3022 PolarHBondContact NE-OE1 2.63Å; R3020-E3022 IonicContact NH2-OE1 2.72Å; R3020-E3022 PolarHBondContact NH2-OE1 3.36Å; R3020-E3022 IonicContact NH2-OE2 3.57Å; R3020-E3022 PolarHBondContact NH2-OE2 2.83Å
3021	S	77.5	Confident	71.2	Confident	99 Å²	99	88.1 Å²	88.1	69%	0.692	47%	0.466	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.2	135.6	173.4	63.8	0	0	0	0	110.9	I3000	I3000-S3021 CarbonylContact O-C 3.53Å; I3000-S3021 VanDerWaalsContact O-CA 3.27Å; I3000-S3021 WeakPolarHBondContact O-CA 3.36Å
3022	E	82.3	Confident	73.4	Confident	64 Å²	64	80.9 Å²	80.9	30%	0.299	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	139.9	175.5	-146.8	171.8	178.6	0	0	109.3	R2999 I3000 R3020 L3024	R2999-E3022 CarbonylContact C-O 3.53Å; R2999-E3022 WeakPolarHBondContact CA-O 3.45Å; I3000-E3022 PolarHBondContact N-O 3.11Å; I3000-E3022 PolarHBondContact O-N 3.19Å; R3020-E3022 IonicContact CZ-OE1 3.91Å; R3020-E3022 IonicContact NE-OE1 3.9Å; R3020-E3022 PolarHBondContact NE-OE1 2.63Å; R3020-E3022 IonicContact NH2-OE1 2.72Å; R3020-E3022 PolarHBondContact NH2-OE1 3.36Å; R3020-E3022 IonicContact NH2-OE2 3.57Å; R3020-E3022 PolarHBondContact NH2-OE2 2.83Å; E3022-L3024 HydrophobicContact CG-CD2 4.3Å; E3022-L3024 HydrophobicContact CG-CG 4.45Å
3023	E	88	Confident	75.8	Confident	94.6667 Å²	94.6667	70.6 Å²	70.6	44%	0.442	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	122.8	175.7	179.9	165.7	-162.1	0	0	109.7	H2997 L2998 R2999	H2997-E3023 HydrophobicContact CB-CG 4.47Å; H2997-E3023 IonicContact CD2-OE1 3.15Å; H2997-E3023 PolarHBondContact CD2-OE1 2.86Å; H2997-E3023 IonicContact CE1-OE1 2.95Å; H2997-E3023 IonicContact CG-OE1 3.73Å; H2997-E3023 IonicContact ND1-OE1 2.76Å; H2997-E3023 PolarHBondContact ND1-OE1 2.85Å; L2998-E3023 WeakPolarHBondContact O-CA 3.39Å; R2999-E3023 HydrophobicContact CG-CB 4.09Å; R2999-E3023 HydrophobicContact CG-CG 3.75Å; R2999-E3023 IonicContact CZ-OE1 3.01Å; R2999-E3023 IonicContact CZ-OE2 3.8Å; R2999-E3023 VanDerWaalsContact NE-CD 3.28Å; R2999-E3023 IonicContact NE-OE1 3.07Å; R2999-E3023 PolarHBondContact NE-OE1 2.95Å; R2999-E3023 IonicContact NE-OE2 3.41Å; R2999-E3023 PolarHBondContact NE-OE2 3.18Å; R2999-E3023 IonicContact NH2-OE1 3.88Å; R2999-E3023 PolarHBondContact NH2-OE1 3.12Å; R2999-E3023 VanDerWaalsContact NH2-OE1 3.11Å; R2999-E3023 IonicContact NH2-OE2 2.84Å
3024	L	89.9	Confident	78.3	Confident	15 Å²	15	66.1 Å²	66.1	8%	0.079	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	116.6	179	-60.1	174.4	0	0	0	109.4	H2997 L2998 I3000 E3022 F3026 R3037 L3105	H2997-L3024 CarbonylContact C-O 3.54Å; H2997-L3024 WeakPolarHBondContact CA-O 3.45Å; L2998-L3024 HydrophobicContact CB-CB 4.34Å; L2998-L3024 HydrophobicContact CD2-CD1 4.21Å; L2998-L3024 PolarHBondContact N-O 2.96Å; L2998-L3024 PolarHBondContact O-N 3.15Å; I3000-L3024 HydrophobicContact CD1-CD1 4.11Å; E3022-L3024 HydrophobicContact CG-CD2 4.3Å; E3022-L3024 HydrophobicContact CG-CG 4.45Å; L3024-F3026 HydrophobicContact CB-CE2 4.49Å; L3024-R3037 VanDerWaalsContact CD1-NH2 3.27Å; L3024-L3105 HydrophobicContact CD1-CD2 3.56Å; L3024-L3105 HydrophobicContact CD1-CG 4.28Å; L3024-L3105 HydrophobicContact CD2-CD2 4.16Å; L3024-L3105 HydrophobicContact CG-CD2 3.84Å
3025	Q	94.4	Very high	80.7	Confident	78.3333 Å²	78.3333	58.5 Å²	58.5	37%	0.366	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	136.6	176.1	-169.7	-179.7	28.9	0	0	111.1	I3027 R3037 G3038	Q3025-I3027 HydrophobicContact CG-CG1 4.14Å; Q3025-R3037 CarbonylContact O-C 3.54Å; Q3025-R3037 VanDerWaalsContact O-CA 3.28Å; Q3025-R3037 WeakPolarHBondContact O-CA 3.39Å; Q3025-G3038 PolarHBondContact O-N 3.1Å
3026	F	95.8	Very high	83.1	Confident	8.66667 Å²	8.66667	57.5 Å²	57.5	4%	0.038	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	122.8	172.4	-71.3	-112.4	0	0	0	109	I2995 A2996 L2998 L3024 Y3028 L3034 R3036 R3037	I2995-F3026 HydrophobicContact CB-CD1 4.5Å; I2995-F3026 HydrophobicContact CB-CD2 4.45Å; I2995-F3026 HydrophobicContact CB-CG 4.45Å; I2995-F3026 HydrophobicContact CG2-CD2 3.71Å; I2995-F3026 HydrophobicContact CG2-CE2 3.75Å; I2995-F3026 HydrophobicContact CG2-CG 4.15Å; I2995-F3026 HydrophobicContact CG2-CZ 4.19Å; I2995-F3026 WeakPolarHBondContact O-CB 3.43Å; A2996-F3026 PolarHBondContact O-N 2.99Å; L2998-F3026 HydrophobicContact CB-CE2 3.9Å; L3024-F3026 HydrophobicContact CB-CE2 4.49Å; F3026-Y3028 HydrophobicContact CB-CE2 4.13Å; F3026-L3034 HydrophobicContact CB-CD1 4.16Å; F3026-L3034 HydrophobicContact CD1-CD1 3.8Å; F3026-L3034 HydrophobicContact CG-CD1 4.42Å; F3026-R3036 CarbonylContact C-O 3.49Å; F3026-R3036 VanDerWaalsContact CA-O 3.3Å; F3026-R3036 WeakPolarHBondContact CA-O 3.22Å; F3026-R3037 HydrophobicContact CD1-CB 4.22Å; F3026-R3037 HydrophobicContact CD1-CG 4.03Å; F3026-R3037 HydrophobicContact CD2-CG 4.22Å; F3026-R3037 HydrophobicContact CE1-CB 4.19Å; F3026-R3037 HydrophobicContact CE1-CG 3.61Å; F3026-R3037 VanDerWaalsContact CE1-CG 3.5Å; F3026-R3037 HydrophobicContact CE2-CG 3.81Å; F3026-R3037 HydrophobicContact CG-CG 4.32Å; F3026-R3037 HydrophobicContact CZ-CB 4.41Å; F3026-R3037 HydrophobicContact CZ-CG 3.49Å; F3026-R3037 VanDerWaalsContact CZ-CG 3.43Å
3027	I	96.8	Very high	85.3	Confident	62 Å²	62	55.2 Å²	55.2	32%	0.318	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	132.3	-179.9	-58.9	-172.2	0	0	0	109	Q3025 V3035 R3036	Q3025-I3027 HydrophobicContact CG-CG1 4.14Å; I3027-V3035 PolarHBondContact O-N 2.79Å; I3027-R3036 HydrophobicContact CB-CB 4.24Å; I3027-R3036 HydrophobicContact CD1-CB 4.49Å; I3027-R3036 HydrophobicContact CG1-CB 4.47Å; I3027-R3036 PolarHBondContact N-O 3.13Å; I3027-R3036 PolarHBondContact O-N 2.84Å
3028	Y	94.9	Very high	87.3	Confident	50.3333 Å²	50.3333	49.4 Å²	49.4	20%	0.197	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	150.9	177.8	-55.7	-88.3	0	0	0	110.9	R2994 I2995 F3026 G3032 L3033 L3034	R2994-Y3028 HydrophobicContact CB-CE1 4.35Å; R2994-Y3028 HydrophobicContact CB-CE2 4.04Å; R2994-Y3028 VanDerWaalsContact NH1-CE1 3.35Å; I2995-Y3028 WeakPolarHBondContact O-CE2 3.34Å; I2995-Y3028 PolarHBondContact O-OH 2.91Å; F3026-Y3028 HydrophobicContact CB-CE2 4.13Å; Y3028-G3032 WeakPolarHBondContact CD1-O 3.39Å; Y3028-L3033 CarbonylContact C-O 3.53Å; Y3028-L3033 WeakPolarHBondContact CA-O 3.16Å; Y3028-L3034 HydrophobicContact CD1-CB 4.32Å; Y3028-L3034 HydrophobicContact CD1-CD1 4.35Å; Y3028-L3034 HydrophobicContact CE1-CB 4.19Å; Y3028-L3034 HydrophobicContact CE1-CD1 3.93Å
3029	D	93	Very high	89	Confident	42.6667 Å²	42.6667	51.3 Å²	51.3	23%	0.228	27%	0.268	C	S	.	.			trans	-83.9	-178.1	172.6	65	18.4	0	0	0	112.9	R3031 G3032 L3033 V3035	D3029-R3031 PolarHBondContact O-N 3.07Å; D3029-R3031 WeakPolarHBondContact OD1-CA 3.33Å; D3029-R3031 VanDerWaalsContact OD1-CB 3.24Å; D3029-R3031 WeakPolarHBondContact OD1-CB 3.39Å; D3029-R3031 PolarHBondContact OD1-N 3.05Å; D3029-R3031 IonicContact OD1-NE 3.07Å; D3029-R3031 IonicContact OD2-CZ 3.53Å; D3029-R3031 VanDerWaalsContact OD2-CZ 3.22Å; D3029-R3031 IonicContact OD2-NE 3.29Å; D3029-R3031 PolarHBondContact OD2-NE 3.06Å; D3029-R3031 IonicContact OD2-NH2 2.8Å; D3029-R3031 PolarHBondContact OD2-NH2 2.94Å; D3029-G3032 PolarHBondContact O-N 3.15Å; D3029-G3032 PolarHBondContact OD1-N 3.25Å; D3029-G3032 VanDerWaalsContact OD1-N 3.08Å; D3029-L3033 PolarHBondContact N-O 2.8Å; D3029-L3033 PolarHBondContact OD1-N 2.84Å; D3029-V3035 HydrophobicContact CB-CG2 3.63Å
3030	S	89	Confident	90.5	Very high	87 Å²	87	48.9 Å²	48.9	61%	0.608	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-16.7	176.9	57.7	0	0	0	0	114.1	L2682 D2704 G3032	L2682-S3030 WeakPolarHBondContact CD1-O 3.5Å; D2704-S3030 PolarHBondContact OD2-OG 3.44Å; S3030-G3032 VanDerWaalsContact C-N 3.3Å
3031	R	91.1	Very high	91.8	Very high	48 Å²	48	45.3 Å²	45.3	18%	0.181	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-11.6	174.6	-50.9	176.9	-72.1	178.3	-3.2	111.5	W2702 D3029 L3033 F3044 D3045	W2702-R3031 HydrophobicContact CB-CB 4.32Å; W2702-R3031 HydrophobicContact CB-CG 4.37Å; W2702-R3031 HydrophobicContact CD2-CB 3.75Å; W2702-R3031 HydrophobicContact CD2-CG 3.87Å; W2702-R3031 HydrophobicContact CE3-CB 3.95Å; W2702-R3031 HydrophobicContact CE3-CG 4.47Å; W2702-R3031 HydrophobicContact CG-CB 3.9Å; W2702-R3031 HydrophobicContact CG-CG 3.73Å; D3029-R3031 PolarHBondContact O-N 3.07Å; D3029-R3031 WeakPolarHBondContact OD1-CA 3.33Å; D3029-R3031 VanDerWaalsContact OD1-CB 3.24Å; D3029-R3031 WeakPolarHBondContact OD1-CB 3.39Å; D3029-R3031 PolarHBondContact OD1-N 3.05Å; D3029-R3031 IonicContact OD1-NE 3.07Å; D3029-R3031 IonicContact OD2-CZ 3.53Å; D3029-R3031 VanDerWaalsContact OD2-CZ 3.22Å; D3029-R3031 IonicContact OD2-NE 3.29Å; D3029-R3031 PolarHBondContact OD2-NE 3.06Å; D3029-R3031 IonicContact OD2-NH2 2.8Å; D3029-R3031 PolarHBondContact OD2-NH2 2.94Å; R3031-L3033 HydrophobicContact CB-CD1 4.32Å; R3031-L3033 HydrophobicContact CB-CG 4.14Å; R3031-F3044 PolarHBondContact NH1-O 3.35Å; R3031-F3044 PolarHBondContact NH2-O 2.87Å; R3031-D3045 PolarHBondContact NH1-O 3.1Å
3032	G	90.2	Very high	92.8	Very high	7 Å²	7	40.9 Å²	40.9	7%	0.072	21%	0.207	C	C	.	.	S	Bend	trans	76.4	29.4	-170	0	0	0	0	0	112.4	R2994 Y3028 D3029 S3030	R2994-G3032 PolarHBondContact NE-O 3.36Å; R2994-G3032 VanDerWaalsContact NH1-C 3.33Å; R2994-G3032 PolarHBondContact NH1-O 3.14Å; R2994-G3032 VanDerWaalsContact NH1-O 3.11Å; R2994-G3032 PolarHBondContact NH2-O 3.36Å; Y3028-G3032 WeakPolarHBondContact CD1-O 3.39Å; D3029-G3032 PolarHBondContact O-N 3.15Å; D3029-G3032 PolarHBondContact OD1-N 3.25Å; D3029-G3032 VanDerWaalsContact OD1-N 3.08Å; S3030-G3032 VanDerWaalsContact C-N 3.3Å
3033	L	94.6	Very high	93.5	Very high	3 Å²	3	41.6 Å²	41.6	2%	0.016	21%	0.213	C	C	.	.			trans	-103.5	148.2	174.7	-61.3	178.6	0	0	0	110.4	W2702 Y3028 D3029 R3031 V3035 F3044 H3338	W2702-L3033 HydrophobicContact CH2-CD1 4.46Å; Y3028-L3033 CarbonylContact C-O 3.53Å; Y3028-L3033 WeakPolarHBondContact CA-O 3.16Å; D3029-L3033 PolarHBondContact N-O 2.8Å; D3029-L3033 PolarHBondContact OD1-N 2.84Å; R3031-L3033 HydrophobicContact CB-CD1 4.32Å; R3031-L3033 HydrophobicContact CB-CG 4.14Å; L3033-V3035 PolarHBondContact O-N 2.95Å; L3033-F3044 HydrophobicContact CB-CD2 4.01Å; L3033-F3044 HydrophobicContact CB-CE2 4.4Å; L3033-F3044 HydrophobicContact CB-CG 4.2Å; L3033-F3044 HydrophobicContact CD1-CB 3.71Å; L3033-F3044 HydrophobicContact CD1-CD1 4.23Å; L3033-F3044 HydrophobicContact CD1-CG 3.95Å; L3033-H3338 HydrophobicContact CD2-CB 4.37Å
3034	L	96.3	Very high	93.9	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.005	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	130.9	-178.5	-175.1	69.6	0	0	0	110.2	F3026 Y3028 R3036 R3037 Y3042 F3044 T3311	F3026-L3034 HydrophobicContact CB-CD1 4.16Å; F3026-L3034 HydrophobicContact CD1-CD1 3.8Å; F3026-L3034 HydrophobicContact CG-CD1 4.42Å; Y3028-L3034 HydrophobicContact CD1-CB 4.32Å; Y3028-L3034 HydrophobicContact CD1-CD1 4.35Å; Y3028-L3034 HydrophobicContact CE1-CB 4.19Å; Y3028-L3034 HydrophobicContact CE1-CD1 3.93Å; L3034-R3036 WeakPolarHBondContact CD1-O 3.41Å; L3034-R3037 HydrophobicContact CD2-CB 4.4Å; L3034-Y3042 HydrophobicContact CD2-CD1 4.03Å; L3034-Y3042 HydrophobicContact CD2-CD2 3.74Å; L3034-Y3042 HydrophobicContact CD2-CE1 3.96Å; L3034-Y3042 HydrophobicContact CD2-CE2 3.69Å; L3034-Y3042 HydrophobicContact CD2-CG 3.93Å; L3034-Y3042 HydrophobicContact CG-CD2 4.07Å; L3034-Y3042 HydrophobicContact CG-CE2 4.43Å; L3034-Y3042 HydrophobicContact CG-CG 4.19Å; L3034-Y3042 VanDerWaalsContact O-CB 3.26Å; L3034-Y3042 WeakPolarHBondContact O-CB 3.3Å; L3034-F3044 HydrophobicContact CB-CE2 4.21Å; L3034-F3044 WeakPolarHBondContact O-CD2 3.26Å; L3034-F3044 WeakPolarHBondContact O-CE2 3.12Å; L3034-T3311 HydrophobicContact CD2-CG2 4.45Å
3035	V	96.7	Very high	94.1	Very high	54.3333 Å²	54.3333	38.4 Å²	38.4	33%	0.329	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	-38.7	176.8	179	0	0	0	0	110.9	I3027 D3029 L3033 H3041 Y3042	I3027-V3035 PolarHBondContact O-N 2.79Å; D3029-V3035 HydrophobicContact CB-CG2 3.63Å; L3033-V3035 PolarHBondContact O-N 2.95Å; V3035-H3041 CarbonylContact O-C 3.56Å; V3035-H3041 WeakPolarHBondContact O-CA 3.34Å; V3035-Y3042 PolarHBondContact O-N 3.11Å
3036	R	95.8	Very high	93.9	Very high	66.3333 Å²	66.3333	38.6 Å²	38.6	25%	0.25	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	138.9	-176.9	-167.1	176.2	67.4	94.1	-5.1	111.3	F3026 I3027 L3034 G3038 W3040	F3026-R3036 CarbonylContact C-O 3.49Å; F3026-R3036 VanDerWaalsContact CA-O 3.3Å; F3026-R3036 WeakPolarHBondContact CA-O 3.22Å; I3027-R3036 HydrophobicContact CB-CB 4.24Å; I3027-R3036 HydrophobicContact CD1-CB 4.49Å; I3027-R3036 HydrophobicContact CG1-CB 4.47Å; I3027-R3036 PolarHBondContact N-O 3.13Å; I3027-R3036 PolarHBondContact O-N 2.84Å; L3034-R3036 WeakPolarHBondContact CD1-O 3.41Å; R3036-G3038 WeakPolarHBondContact CG-O 3.38Å; R3036-G3038 PolarHBondContact NH1-O 3.17Å; R3036-W3040 CarbonylContact C-O 3.39Å; R3036-W3040 VanDerWaalsContact CA-O 3.26Å; R3036-W3040 WeakPolarHBondContact CA-O 3.37Å; R3036-W3040 WeakPolarHBondContact CG-O 3.36Å
3037	R	92.8	Very high	93.9	Very high	6 Å²	6	38.2 Å²	38.2	2%	0.023	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	106.7	167.3	177	-116.6	175.7	172.9	-2	108.6	L3024 Q3025 F3026 L3034 N3039 W3040 Y3042 E3106 D3107 L3308	L3024-R3037 VanDerWaalsContact CD1-NH2 3.27Å; Q3025-R3037 CarbonylContact O-C 3.54Å; Q3025-R3037 VanDerWaalsContact O-CA 3.28Å; Q3025-R3037 WeakPolarHBondContact O-CA 3.39Å; F3026-R3037 HydrophobicContact CD1-CB 4.22Å; F3026-R3037 HydrophobicContact CD1-CG 4.03Å; F3026-R3037 HydrophobicContact CD2-CG 4.22Å; F3026-R3037 HydrophobicContact CE1-CB 4.19Å; F3026-R3037 HydrophobicContact CE1-CG 3.61Å; F3026-R3037 VanDerWaalsContact CE1-CG 3.5Å; F3026-R3037 HydrophobicContact CE2-CG 3.81Å; F3026-R3037 HydrophobicContact CG-CG 4.32Å; F3026-R3037 HydrophobicContact CZ-CB 4.41Å; F3026-R3037 HydrophobicContact CZ-CG 3.49Å; F3026-R3037 VanDerWaalsContact CZ-CG 3.43Å; L3034-R3037 HydrophobicContact CD2-CB 4.4Å; R3037-N3039 PolarHBondContact O-N 2.88Å; R3037-N3039 VanDerWaalsContact O-N 3.11Å; R3037-W3040 PolarHBondContact N-O 3.38Å; R3037-W3040 WeakPolarHBondContact O-CA 3.34Å; R3037-W3040 WeakPolarHBondContact O-CB 3.28Å; R3037-W3040 PolarHBondContact O-N 3.27Å; R3037-Y3042 HydrophobicContact CB-CE2 4.01Å; R3037-E3106 PolarHBondContact NH1-O 2.87Å; R3037-E3106 VanDerWaalsContact NH1-O 3.1Å; R3037-E3106 PolarHBondContact NH2-O 3.39Å; R3037-D3107 IonicContact CZ-OD1 3.39Å; R3037-D3107 IonicContact NH2-OD1 2.79Å; R3037-D3107 PolarHBondContact NH2-OD1 3.29Å; R3037-L3308 WeakPolarHBondContact CD-O 3.44Å; R3037-L3308 PolarHBondContact NE-O 3.39Å; R3037-L3308 VanDerWaalsContact NH1-CD1 3.27Å; R3037-L3308 PolarHBondContact NH1-O 2.95Å
3038	G	89.4	Confident	93.8	Very high	8.33333 Å²	8.33333	35.3 Å²	35.3	9%	0.086	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	-117.5	-173.6	0	0	0	0	0	110.9	Q3025 R3036	Q3025-G3038 PolarHBondContact O-N 3.1Å; R3036-G3038 WeakPolarHBondContact CG-O 3.38Å; R3036-G3038 PolarHBondContact NH1-O 3.17Å
3039	N	89.5	Confident	93.9	Very high	100.667 Å²	100.667	32.9 Å²	32.9	54%	0.538	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-7.7	177.3	-64.7	-22.5	0	0	0	114.2	R3037 H3041 L3055 H3056	R3037-N3039 PolarHBondContact O-N 2.88Å; R3037-N3039 VanDerWaalsContact O-N 3.11Å; N3039-H3041 PolarHBondContact O-ND1 3.02Å; N3039-L3055 HydrophobicContact CB-CD1 4.12Å; N3039-L3055 HydrophobicContact CB-CD2 4.45Å; N3039-L3055 CarbonylContact O-C 3.44Å; N3039-H3056 HydrophobicContact CB-CB 4.4Å; N3039-H3056 WeakPolarHBondContact O-CB 3.4Å; N3039-H3056 PolarHBondContact O-N 3.04Å
3040	W	93.2	Very high	94.1	Very high	8.66667 Å²	8.66667	30.8 Å²	30.8	3%	0.033	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	132.9	178.4	-73.5	88.7	0	0	0	111.3	R3036 R3037 Y3042 R3053 H3054 L3055 I3060 A3109 L3308	R3036-W3040 CarbonylContact C-O 3.39Å; R3036-W3040 VanDerWaalsContact CA-O 3.26Å; R3036-W3040 WeakPolarHBondContact CA-O 3.37Å; R3036-W3040 WeakPolarHBondContact CG-O 3.36Å; R3037-W3040 PolarHBondContact N-O 3.38Å; R3037-W3040 WeakPolarHBondContact O-CA 3.34Å; R3037-W3040 WeakPolarHBondContact O-CB 3.28Å; R3037-W3040 PolarHBondContact O-N 3.27Å; W3040-Y3042 HydrophobicContact CB-CD2 4.48Å; W3040-Y3042 HydrophobicContact CB-CE2 3.79Å; W3040-R3053 HydrophobicContact CE3-CB 4.43Å; W3040-R3053 HydrophobicContact CE3-CG 4.17Å; W3040-R3053 HydrophobicContact CZ3-CG 4.1Å; W3040-H3054 CarbonylContact C-O 3.55Å; W3040-H3054 WeakPolarHBondContact CA-O 3.37Å; W3040-H3054 VanDerWaalsContact CE3-C 3.48Å; W3040-L3055 HydrophobicContact CD2-CD1 3.98Å; W3040-L3055 HydrophobicContact CD2-CD2 3.81Å; W3040-L3055 HydrophobicContact CD2-CG 4.21Å; W3040-L3055 HydrophobicContact CE3-CD2 4.43Å; W3040-L3055 HydrophobicContact CE3-CG 4.43Å; W3040-L3055 HydrophobicContact CG-CD1 4.17Å; W3040-L3055 HydrophobicContact CG-CD2 4.11Å; W3040-L3055 HydrophobicContact CH2-CD2 4.44Å; W3040-L3055 HydrophobicContact CH2-CG 4.03Å; W3040-L3055 HydrophobicContact CZ2-CD1 4.22Å; W3040-L3055 HydrophobicContact CZ2-CD2 3.73Å; W3040-L3055 HydrophobicContact CZ2-CG 3.76Å; W3040-L3055 HydrophobicContact CZ3-CG 4.35Å; W3040-L3055 VanDerWaalsContact NE1-CD2 3.31Å; W3040-I3060 HydrophobicContact CH2-CB 4.09Å; W3040-I3060 HydrophobicContact CH2-CG2 3.74Å; W3040-I3060 HydrophobicContact CZ3-CG2 4.27Å; W3040-A3109 HydrophobicContact CH2-CB 3.97Å; W3040-A3109 HydrophobicContact CZ2-CB 3.64Å; W3040-L3308 HydrophobicContact CD2-CD2 4.02Å; W3040-L3308 HydrophobicContact CG-CD2 4.18Å; W3040-L3308 HydrophobicContact CZ2-CD2 4.47Å
3041	H	96.5	Very high	94.5	Very high	45.6667 Å²	45.6667	29 Å²	29	21%	0.211	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	140.5	174.7	-66.2	72.3	0	0	0	109.4	V3035 N3039 R3053 H3054 H3056	V3035-H3041 CarbonylContact O-C 3.56Å; V3035-H3041 WeakPolarHBondContact O-CA 3.34Å; N3039-H3041 PolarHBondContact O-ND1 3.02Å; H3041-R3053 CarbonylContact O-C 3.56Å; H3041-R3053 WeakPolarHBondContact O-CA 3.31Å; H3041-R3053 WeakPolarHBondContact O-CB 3.22Å; H3041-H3054 VanDerWaalsContact CB-CE1 3.45Å; H3041-H3054 WeakPolarHBondContact CB-CE1 3.3Å; H3041-H3054 AromaticContact CG-NE2 3.97Å; H3041-H3054 PolarHBondContact N-O 3.25Å; H3041-H3054 PolarHBondContact O-N 3.17Å; H3041-H3056 AromaticContact CE1-CG 3.72Å; H3041-H3056 AromaticContact CE1-ND1 3.29Å; H3041-H3056 PolarHBondContact CE1-ND1 3Å; H3041-H3056 AromaticContact NE2-ND1 3.68Å
3042	Y	97.6	Very high	94.7	Very high	6.33333 Å²	6.33333	29.7 Å²	29.7	3%	0.025	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	134.9	-175.9	-72	-105	0	0	0	109.4	L3034 V3035 R3037 W3040 F3044 L3050 R3053 D3306 L3308 G3309	L3034-Y3042 HydrophobicContact CD2-CD1 4.03Å; L3034-Y3042 HydrophobicContact CD2-CD2 3.74Å; L3034-Y3042 HydrophobicContact CD2-CE1 3.96Å; L3034-Y3042 HydrophobicContact CD2-CE2 3.69Å; L3034-Y3042 HydrophobicContact CD2-CG 3.93Å; L3034-Y3042 HydrophobicContact CG-CD2 4.07Å; L3034-Y3042 HydrophobicContact CG-CE2 4.43Å; L3034-Y3042 HydrophobicContact CG-CG 4.19Å; L3034-Y3042 VanDerWaalsContact O-CB 3.26Å; L3034-Y3042 WeakPolarHBondContact O-CB 3.3Å; V3035-Y3042 PolarHBondContact O-N 3.11Å; R3037-Y3042 HydrophobicContact CB-CE2 4.01Å; W3040-Y3042 HydrophobicContact CB-CD2 4.48Å; W3040-Y3042 HydrophobicContact CB-CE2 3.79Å; Y3042-F3044 HydrophobicContact CD1-CE2 4.47Å; Y3042-L3050 HydrophobicContact CD1-CD1 3.68Å; Y3042-L3050 HydrophobicContact CD1-CD2 4.02Å; Y3042-L3050 HydrophobicContact CD1-CG 4.49Å; Y3042-L3050 HydrophobicContact CE1-CD2 4.21Å; Y3042-L3050 HydrophobicContact CG-CD1 4.38Å; Y3042-R3053 HydrophobicContact CD1-CB 4.08Å; Y3042-R3053 HydrophobicContact CE1-CB 4.2Å; Y3042-R3053 HydrophobicContact CG-CB 4.36Å; Y3042-D3306 VanDerWaalsContact CE1-OD2 3.25Å; Y3042-D3306 WeakPolarHBondContact CE1-OD2 3.28Å; Y3042-D3306 PolarHBondContact OH-OD2 3.38Å; Y3042-L3308 WeakPolarHBondContact OH-CD2 3.43Å; Y3042-G3309 WeakPolarHBondContact OH-CA 3.43Å; Y3042-G3309 PolarHBondContact OH-N 3.03Å
3043	N	97.3	Very high	95	Very high	79.6667 Å²	79.6667	29.4 Å²	29.4	43%	0.426	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	115.6	177.7	-93.8	8	0	0	0	109.2	V3051 K3052	N3043-V3051 HydrophobicContact CB-CG2 4.4Å; N3043-V3051 VanDerWaalsContact O-CG2 3.28Å; N3043-V3051 WeakPolarHBondContact O-CG2 3.27Å; N3043-V3051 PolarHBondContact O-N 2.77Å; N3043-K3052 HydrophobicContact CB-CB 4.22Å; N3043-K3052 PolarHBondContact N-O 2.87Å; N3043-K3052 PolarHBondContact O-N 3.16Å
3044	F	96.4	Very high	95	Very high	14 Å²	14	30.8 Å²	30.8	6%	0.061	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	136.8	173.9	-69.7	-97.6	0	0	0	110.2	R3031 L3033 L3034 Y3042 G3048 F3049 L3050 T3311	R3031-F3044 PolarHBondContact NH1-O 3.35Å; R3031-F3044 PolarHBondContact NH2-O 2.87Å; L3033-F3044 HydrophobicContact CB-CD2 4.01Å; L3033-F3044 HydrophobicContact CB-CE2 4.4Å; L3033-F3044 HydrophobicContact CB-CG 4.2Å; L3033-F3044 HydrophobicContact CD1-CB 3.71Å; L3033-F3044 HydrophobicContact CD1-CD1 4.23Å; L3033-F3044 HydrophobicContact CD1-CG 3.95Å; L3034-F3044 HydrophobicContact CB-CE2 4.21Å; L3034-F3044 WeakPolarHBondContact O-CD2 3.26Å; L3034-F3044 WeakPolarHBondContact O-CE2 3.12Å; Y3042-F3044 HydrophobicContact CD1-CE2 4.47Å; F3044-G3048 WeakPolarHBondContact CD1-O 3.25Å; F3044-F3049 CarbonylContact C-O 3.53Å; F3044-F3049 VanDerWaalsContact CA-O 3.23Å; F3044-F3049 WeakPolarHBondContact CA-O 3.34Å; F3044-L3050 HydrophobicContact CD1-CB 4Å; F3044-L3050 HydrophobicContact CD2-CD1 4.3Å; F3044-L3050 HydrophobicContact CE1-CB 3.64Å; F3044-L3050 HydrophobicContact CE1-CD1 4.41Å; F3044-L3050 HydrophobicContact CE2-CD1 3.98Å; F3044-L3050 HydrophobicContact CZ-CB 4.02Å; F3044-L3050 HydrophobicContact CZ-CD1 4.06Å; F3044-L3050 HydrophobicContact CZ-CG 4.45Å; F3044-T3311 HydrophobicContact CZ-CG2 4.34Å
3045	D	94.2	Very high	94.7	Very high	28.3333 Å²	28.3333	31.3 Å²	31.3	15%	0.152	16%	0.158	C	C	.	.			trans	-71.7	-177.5	174.6	73.1	9.8	0	0	0	112.6	R2740 R3031 D3047 G3048 F3049 V3051	R2740-D3045 IonicContact CZ-OD2 3.58Å; R2740-D3045 IonicContact NH1-OD1 3.5Å; R2740-D3045 IonicContact NH1-OD2 3.41Å; R2740-D3045 PolarHBondContact NH1-OD2 2.96Å; R2740-D3045 IonicContact NH2-OD2 2.94Å; R2740-D3045 PolarHBondContact NH2-OD2 3.06Å; R3031-D3045 PolarHBondContact NH1-O 3.1Å; D3045-D3047 PolarHBondContact O-N 3.07Å; D3045-D3047 PolarHBondContact OD1-N 2.95Å; D3045-G3048 PolarHBondContact O-N 2.81Å; D3045-G3048 VanDerWaalsContact O-N 3.09Å; D3045-G3048 PolarHBondContact OD1-N 2.82Å; D3045-G3048 VanDerWaalsContact OD1-N 3.1Å; D3045-F3049 PolarHBondContact N-O 3.19Å; D3045-F3049 WeakPolarHBondContact OD1-CB 3.27Å; D3045-F3049 PolarHBondContact OD1-N 3.1Å; D3045-V3051 HydrophobicContact CB-CG1 4.01Å; D3045-V3051 HydrophobicContact CB-CG2 4.15Å
3046	E	91.6	Very high	94.2	Very high	83 Å²	83	35 Å²	35	39%	0.388	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-24.8	-179.3	-56.3	-178.4	-175.5	0	0	114.4	W2702 P2706 S2737 Y2739 G3048 K3660	W2702-E3046 WeakPolarHBondContact CZ2-O 3.45Å; P2706-E3046 HydrophobicContact CG-CB 3.87Å; P2706-E3046 HydrophobicContact CG-CG 4.02Å; S2737-E3046 WeakPolarHBondContact CB-OE1 3.4Å; Y2739-E3046 WeakPolarHBondContact CE1-OE1 3.45Å; E3046-G3048 VanDerWaalsContact C-N 3.32Å; E3046-K3660 VanDerWaalsContact CD-NZ 3.32Å; E3046-K3660 WeakPolarHBondContact OE1-CE 3.31Å; E3046-K3660 IonicContact OE1-NZ 3.54Å; E3046-K3660 PolarHBondContact OE1-NZ 3.18Å; E3046-K3660 VanDerWaalsContact OE1-NZ 3.16Å; E3046-K3660 IonicContact OE2-NZ 3.21Å; E3046-K3660 PolarHBondContact OE2-NZ 2.8Å
3047	D	94.3	Very high	93.7	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-7.1	177.6	-67	-27.8	0	0	0	111.7	W2735 P2736 S2737 R2740 D3045 F3049 P3315	W2735-D3047 HydrophobicContact CB-CB 4.39Å; W2735-D3047 WeakPolarHBondContact CB-OD1 3.33Å; W2735-D3047 HydrophobicContact CD2-CB 4.37Å; W2735-D3047 HydrophobicContact CE3-CB 4.09Å; P2736-D3047 WeakPolarHBondContact CB-OD1 3.28Å; P2736-D3047 VanDerWaalsContact CD-OD1 3.27Å; P2736-D3047 WeakPolarHBondContact CD-OD1 3.25Å; S2737-D3047 WeakPolarHBondContact CB-OD1 3.3Å; S2737-D3047 VanDerWaalsContact CB-OD2 3.31Å; S2737-D3047 WeakPolarHBondContact CB-OD2 3.34Å; S2737-D3047 PolarHBondContact N-OD1 3.01Å; S2737-D3047 VanDerWaalsContact OG-CG 3.24Å; S2737-D3047 PolarHBondContact OG-OD1 3.35Å; S2737-D3047 VanDerWaalsContact OG-OD1 3.11Å; S2737-D3047 PolarHBondContact OG-OD2 3.09Å; R2740-D3047 IonicContact CZ-OD2 3.18Å; R2740-D3047 IonicContact NH1-OD2 3.38Å; R2740-D3047 PolarHBondContact NH1-OD2 3.07Å; D3045-D3047 PolarHBondContact O-N 3.07Å; D3045-D3047 PolarHBondContact OD1-N 2.95Å; D3047-F3049 HydrophobicContact CB-CD2 3.52Å; D3047-F3049 VanDerWaalsContact CB-CD2 3.48Å; D3047-F3049 HydrophobicContact CB-CE2 3.67Å; D3047-P3315 WeakPolarHBondContact O-CG 3.31Å
3048	G	94.8	Very high	93.5	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.201	C	C	.	.	S	Bend	trans	86.3	26.3	-177.6	0	0	0	0	0	113.5	F3044 D3045 E3046 H3338	F3044-G3048 WeakPolarHBondContact CD1-O 3.25Å; D3045-G3048 PolarHBondContact O-N 2.81Å; D3045-G3048 VanDerWaalsContact O-N 3.09Å; D3045-G3048 PolarHBondContact OD1-N 2.82Å; D3045-G3048 VanDerWaalsContact OD1-N 3.1Å; E3046-G3048 VanDerWaalsContact C-N 3.32Å; G3048-H3338 PolarHBondContact O-NE2 3.13Å
3049	F	96.8	Very high	93.3	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.206	C	C	.	.			trans	-94	134.7	174	-69.6	-114.2	0	0	0	110.6	W2735 F3044 D3045 D3047 V3051 Y3066 P3315	W2735-F3049 AromaticContact CD2-CE2 3.94Å; W2735-F3049 HydrophobicContact CD2-CE2 3.94Å; W2735-F3049 HydrophobicContact CD2-CZ 4.34Å; W2735-F3049 AromaticContact CE2-CE2 3.75Å; W2735-F3049 AromaticContact CE2-CZ 3.68Å; W2735-F3049 AromaticContact CE3-CE2 3.98Å; W2735-F3049 HydrophobicContact CE3-CE2 4Å; W2735-F3049 AromaticContact CH2-CE2 3.76Å; W2735-F3049 HydrophobicContact CH2-CE2 3.76Å; W2735-F3049 AromaticContact CH2-CZ 3.88Å; W2735-F3049 HydrophobicContact CH2-CZ 3.88Å; W2735-F3049 AromaticContact CZ2-CE2 3.67Å; W2735-F3049 HydrophobicContact CZ2-CE2 3.67Å; W2735-F3049 AromaticContact CZ2-CZ 3.43Å; W2735-F3049 HydrophobicContact CZ2-CZ 3.43Å; W2735-F3049 VanDerWaalsContact CZ2-CZ 3.43Å; W2735-F3049 AromaticContact CZ3-CE2 3.94Å; W2735-F3049 HydrophobicContact CZ3-CE2 3.94Å; W2735-F3049 HydrophobicContact CZ3-CZ 4.47Å; F3044-F3049 CarbonylContact C-O 3.53Å; F3044-F3049 VanDerWaalsContact CA-O 3.23Å; F3044-F3049 WeakPolarHBondContact CA-O 3.34Å; D3045-F3049 PolarHBondContact N-O 3.19Å; D3045-F3049 WeakPolarHBondContact OD1-CB 3.27Å; D3045-F3049 PolarHBondContact OD1-N 3.1Å; D3047-F3049 HydrophobicContact CB-CD2 3.52Å; D3047-F3049 VanDerWaalsContact CB-CD2 3.48Å; D3047-F3049 HydrophobicContact CB-CE2 3.67Å; F3049-V3051 PolarHBondContact O-N 3.05Å; F3049-V3051 VanDerWaalsContact O-N 3.11Å; F3049-Y3066 HydrophobicContact CB-CD2 4.13Å; F3049-Y3066 HydrophobicContact CB-CE2 4.33Å; F3049-Y3066 VanDerWaalsContact CD1-CB 3.46Å; F3049-Y3066 AromaticContact CD1-CD1 3.84Å; F3049-Y3066 HydrophobicContact CD1-CD1 3.84Å; F3049-Y3066 AromaticContact CD1-CD2 3.72Å; F3049-Y3066 HydrophobicContact CD1-CD2 3.72Å; F3049-Y3066 HydrophobicContact CD1-CE1 4.44Å; F3049-Y3066 HydrophobicContact CD1-CE2 4.44Å; F3049-Y3066 AromaticContact CD1-CG 3.41Å; F3049-Y3066 HydrophobicContact CD1-CG 3.41Å; F3049-Y3066 VanDerWaalsContact CD1-CG 3.42Å; F3049-Y3066 HydrophobicContact CE1-CD1 4.25Å; F3049-Y3066 AromaticContact CE1-CG 3.94Å; F3049-Y3066 HydrophobicContact CE1-CG 3.94Å; F3049-Y3066 HydrophobicContact CG-CD2 4.43Å; F3049-Y3066 HydrophobicContact CG-CG 4.42Å; F3049-P3315 HydrophobicContact CD2-CG 4.36Å; F3049-P3315 HydrophobicContact CE2-CG 4.22Å
3050	L	97.7	Very high	93.4	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	101.4	176.9	177.6	59.9	0	0	0	109.8	Y3042 F3044 K3052 F3064 Y3066 F3295 T3313	Y3042-L3050 HydrophobicContact CD1-CD1 3.68Å; Y3042-L3050 HydrophobicContact CD1-CD2 4.02Å; Y3042-L3050 HydrophobicContact CD1-CG 4.49Å; Y3042-L3050 HydrophobicContact CE1-CD2 4.21Å; Y3042-L3050 HydrophobicContact CG-CD1 4.38Å; F3044-L3050 HydrophobicContact CD1-CB 4Å; F3044-L3050 HydrophobicContact CD2-CD1 4.3Å; F3044-L3050 HydrophobicContact CE1-CB 3.64Å; F3044-L3050 HydrophobicContact CE1-CD1 4.41Å; F3044-L3050 HydrophobicContact CE2-CD1 3.98Å; F3044-L3050 HydrophobicContact CZ-CB 4.02Å; F3044-L3050 HydrophobicContact CZ-CD1 4.06Å; F3044-L3050 HydrophobicContact CZ-CG 4.45Å; L3050-K3052 WeakPolarHBondContact CD1-O 3.31Å; L3050-F3064 HydrophobicContact CD2-CD2 4.2Å; L3050-F3064 HydrophobicContact CD2-CE2 3.89Å; L3050-F3064 HydrophobicContact CG-CD2 3.93Å; L3050-F3064 HydrophobicContact CG-CE2 4.04Å; L3050-F3064 WeakPolarHBondContact O-CB 3.31Å; L3050-F3064 WeakPolarHBondContact O-CD2 3.33Å; L3050-Y3066 VanDerWaalsContact O-CE2 3.25Å; L3050-Y3066 WeakPolarHBondContact O-CE2 3.44Å; L3050-Y3066 PolarHBondContact O-OH 3.13Å; L3050-F3295 HydrophobicContact CD2-CZ 4.41Å; L3050-T3313 HydrophobicContact CD2-CG2 3.9Å; L3050-T3313 PolarHBondContact N-O 2.98Å
3051	V	96.9	Very high	93.4	Very high	48.6667 Å²	48.6667	37.3 Å²	37.3	30%	0.295	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	-25.8	-177.6	-74.9	0	0	0	0	113.3	N3043 D3045 F3049 Q3063 F3064	N3043-V3051 HydrophobicContact CB-CG2 4.4Å; N3043-V3051 VanDerWaalsContact O-CG2 3.28Å; N3043-V3051 WeakPolarHBondContact O-CG2 3.27Å; N3043-V3051 PolarHBondContact O-N 2.77Å; D3045-V3051 HydrophobicContact CB-CG1 4.01Å; D3045-V3051 HydrophobicContact CB-CG2 4.15Å; F3049-V3051 PolarHBondContact O-N 3.05Å; F3049-V3051 VanDerWaalsContact O-N 3.11Å; V3051-Q3063 WeakPolarHBondContact O-CA 3.31Å; V3051-F3064 PolarHBondContact O-N 3.17Å
3052	K	97	Very high	93.4	Very high	63.6667 Å²	63.6667	35.1 Å²	35.1	28%	0.277	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	139.7	-179.3	-175	-178	-177.6	-179	0	111	N3043 L3050 T3061 D3062 Q3063	N3043-K3052 HydrophobicContact CB-CB 4.22Å; N3043-K3052 PolarHBondContact N-O 2.87Å; N3043-K3052 PolarHBondContact O-N 3.16Å; L3050-K3052 WeakPolarHBondContact CD1-O 3.31Å; K3052-T3061 HydrophobicContact CD-CG2 4.39Å; K3052-T3061 VanDerWaalsContact CE-CG2 3.41Å; K3052-T3061 HydrophobicContact CG-CG2 4.3Å; K3052-D3062 CarbonylContact C-O 3.51Å; K3052-D3062 VanDerWaalsContact CA-O 3.26Å; K3052-D3062 WeakPolarHBondContact CA-O 3.26Å; K3052-D3062 WeakPolarHBondContact CG-O 3.35Å; K3052-Q3063 HydrophobicContact CG-CG 4.36Å
3053	R	95.7	Very high	93.4	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	146.8	159.4	72.3	178	-179.7	-172.3	-2.8	110.7	W3040 H3041 Y3042 D3062 F3064 A3109 T3293 D3306	W3040-R3053 HydrophobicContact CE3-CB 4.43Å; W3040-R3053 HydrophobicContact CE3-CG 4.17Å; W3040-R3053 HydrophobicContact CZ3-CG 4.1Å; H3041-R3053 CarbonylContact O-C 3.56Å; H3041-R3053 WeakPolarHBondContact O-CA 3.31Å; H3041-R3053 WeakPolarHBondContact O-CB 3.22Å; Y3042-R3053 HydrophobicContact CD1-CB 4.08Å; Y3042-R3053 HydrophobicContact CE1-CB 4.2Å; Y3042-R3053 HydrophobicContact CG-CB 4.36Å; R3053-D3062 HydrophobicContact CG-CB 3.84Å; R3053-D3062 IonicContact CZ-OD2 3.44Å; R3053-D3062 PolarHBondContact N-O 2.98Å; R3053-D3062 IonicContact NE-OD2 3.11Å; R3053-D3062 PolarHBondContact NE-OD2 3.07Å; R3053-D3062 IonicContact NH2-OD2 3.15Å; R3053-D3062 PolarHBondContact NH2-OD2 2.79Å; R3053-D3062 VanDerWaalsContact NH2-OD2 3.1Å; R3053-D3062 PolarHBondContact O-N 3Å; R3053-F3064 HydrophobicContact CB-CE2 4.47Å; R3053-F3064 HydrophobicContact CG-CE2 3.93Å; R3053-F3064 HydrophobicContact CG-CZ 4.2Å; R3053-A3109 PolarHBondContact NH2-O 2.67Å; R3053-T3293 PolarHBondContact NH2-O 2.79Å; R3053-D3306 IonicContact CZ-OD2 3.33Å; R3053-D3306 IonicContact NH1-OD1 3.81Å; R3053-D3306 PolarHBondContact NH1-OD1 2.75Å; R3053-D3306 IonicContact NH1-OD2 3.11Å; R3053-D3306 PolarHBondContact NH1-OD2 3.06Å
3054	H	94	Very high	93.4	Very high	31.3333 Å²	31.3333	35.2 Å²	35.2	15%	0.145	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	152.8	-178.3	58.1	-76.1	0	0	0	112	W3040 H3041 L3058 I3060 T3061	W3040-H3054 CarbonylContact C-O 3.55Å; W3040-H3054 WeakPolarHBondContact CA-O 3.37Å; W3040-H3054 VanDerWaalsContact CE3-C 3.48Å; H3041-H3054 VanDerWaalsContact CB-CE1 3.45Å; H3041-H3054 WeakPolarHBondContact CB-CE1 3.3Å; H3041-H3054 AromaticContact CG-NE2 3.97Å; H3041-H3054 PolarHBondContact N-O 3.25Å; H3041-H3054 PolarHBondContact O-N 3.17Å; H3054-L3058 HydrophobicContact CB-CD2 4.24Å; H3054-L3058 WeakPolarHBondContact CD2-CD2 3.33Å; H3054-I3060 CarbonylContact C-O 3.52Å; H3054-I3060 VanDerWaalsContact CA-O 3.27Å; H3054-I3060 WeakPolarHBondContact CA-O 3.26Å; H3054-I3060 WeakPolarHBondContact CB-O 3.3Å; H3054-T3061 HydrophobicContact CB-CG2 4.3Å
3055	L	91	Very high	93.4	Very high	13.3333 Å²	13.3333	35.9 Å²	35.9	7%	0.07	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	147.9	167.1	-98.9	144.4	0	0	0	109.7	N3039 W3040 N3057 L3058 Y3059 I3060	N3039-L3055 HydrophobicContact CB-CD1 4.12Å; N3039-L3055 HydrophobicContact CB-CD2 4.45Å; N3039-L3055 CarbonylContact O-C 3.44Å; W3040-L3055 HydrophobicContact CD2-CD1 3.98Å; W3040-L3055 HydrophobicContact CD2-CD2 3.81Å; W3040-L3055 HydrophobicContact CD2-CG 4.21Å; W3040-L3055 HydrophobicContact CE3-CD2 4.43Å; W3040-L3055 HydrophobicContact CE3-CG 4.43Å; W3040-L3055 HydrophobicContact CG-CD1 4.17Å; W3040-L3055 HydrophobicContact CG-CD2 4.11Å; W3040-L3055 HydrophobicContact CH2-CD2 4.44Å; W3040-L3055 HydrophobicContact CH2-CG 4.03Å; W3040-L3055 HydrophobicContact CZ2-CD1 4.22Å; W3040-L3055 HydrophobicContact CZ2-CD2 3.73Å; W3040-L3055 HydrophobicContact CZ2-CG 3.76Å; W3040-L3055 HydrophobicContact CZ3-CG 4.35Å; W3040-L3055 VanDerWaalsContact NE1-CD2 3.31Å; L3055-N3057 VanDerWaalsContact CB-OD1 3.28Å; L3055-N3057 WeakPolarHBondContact CB-OD1 3.41Å; L3055-N3057 WeakPolarHBondContact CD2-OD1 3.41Å; L3055-N3057 PolarHBondContact O-N 2.77Å; L3055-N3057 VanDerWaalsContact O-N 3.09Å; L3055-L3058 WeakPolarHBondContact O-CA 3.42Å; L3055-L3058 PolarHBondContact O-N 2.89Å; L3055-Y3059 HydrophobicContact CD1-CD1 4.09Å; L3055-I3060 HydrophobicContact CD1-CB 3.92Å; L3055-I3060 HydrophobicContact CD1-CD1 4Å; L3055-I3060 HydrophobicContact CD1-CG1 4.01Å; L3055-I3060 HydrophobicContact CG-CB 4.28Å; L3055-I3060 PolarHBondContact N-O 3.03Å
3056	H	86.1	Confident	93.5	Very high	130.333 Å²	130.333	35.3 Å²	35.3	60%	0.603	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-36.2	-177.2	-177.8	63.4	0	0	0	113.4	N3039 H3041 L3058	N3039-H3056 HydrophobicContact CB-CB 4.4Å; N3039-H3056 WeakPolarHBondContact O-CB 3.4Å; N3039-H3056 PolarHBondContact O-N 3.04Å; H3041-H3056 AromaticContact CE1-CG 3.72Å; H3041-H3056 AromaticContact CE1-ND1 3.29Å; H3041-H3056 PolarHBondContact CE1-ND1 3Å; H3041-H3056 AromaticContact NE2-ND1 3.68Å; H3056-L3058 VanDerWaalsContact C-N 3.28Å; H3056-L3058 PolarHBondContact O-N 3.38Å
3057	N	86	Confident	93.6	Very high	80.3333 Å²	80.3333	31.8 Å²	31.8	43%	0.43	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82	4.3	176.3	66.8	-6.8	0	0	0	113.8	L3055 Y3059 V3083	L3055-N3057 VanDerWaalsContact CB-OD1 3.28Å; L3055-N3057 WeakPolarHBondContact CB-OD1 3.41Å; L3055-N3057 WeakPolarHBondContact CD2-OD1 3.41Å; L3055-N3057 PolarHBondContact O-N 2.77Å; L3055-N3057 VanDerWaalsContact O-N 3.09Å; N3057-Y3059 PolarHBondContact O-N 3.1Å; N3057-Y3059 VanDerWaalsContact O-N 3.07Å; N3057-Y3059 VanDerWaalsContact OD1-CB 3.26Å; N3057-Y3059 WeakPolarHBondContact OD1-CB 3.39Å; N3057-Y3059 PolarHBondContact OD1-N 3.09Å; N3057-Y3059 VanDerWaalsContact OD1-N 3.09Å; N3057-V3083 HydrophobicContact CB-CG1 4.23Å
3058	L	86.8	Confident	93.6	Very high	90.3333 Å²	90.3333	31.8 Å²	31.8	47%	0.473	16%	0.16	S	C	.	.	S	Bend	trans	59.8	10	-176.6	-61.3	166.4	0	0	0	115.4	H3054 L3055 H3056 I3060	H3054-L3058 HydrophobicContact CB-CD2 4.24Å; H3054-L3058 WeakPolarHBondContact CD2-CD2 3.33Å; L3055-L3058 WeakPolarHBondContact O-CA 3.42Å; L3055-L3058 PolarHBondContact O-N 2.89Å; H3056-L3058 VanDerWaalsContact C-N 3.28Å; H3056-L3058 PolarHBondContact O-N 3.38Å; L3058-I3060 VanDerWaalsContact C-N 3.25Å; L3058-I3060 PolarHBondContact O-N 3.1Å
3059	Y	87	Confident	93.5	Very high	49.6667 Å²	49.6667	33.1 Å²	33.1	20%	0.195	17%	0.166	C	C	.	.	S	Bend	trans	-55.6	-41.7	178.4	174.5	-115.4	0	0	0	112	L3055 N3057 V3079 D3080 D3084	L3055-Y3059 HydrophobicContact CD1-CD1 4.09Å; N3057-Y3059 PolarHBondContact O-N 3.1Å; N3057-Y3059 VanDerWaalsContact O-N 3.07Å; N3057-Y3059 VanDerWaalsContact OD1-CB 3.26Å; N3057-Y3059 WeakPolarHBondContact OD1-CB 3.39Å; N3057-Y3059 PolarHBondContact OD1-N 3.09Å; N3057-Y3059 VanDerWaalsContact OD1-N 3.09Å; Y3059-V3079 HydrophobicContact CD2-CG1 4.41Å; Y3059-V3079 HydrophobicContact CE1-CG1 4.25Å; Y3059-V3079 HydrophobicContact CE2-CG1 3.74Å; Y3059-V3079 CarbonylContact O-C 3.48Å; Y3059-V3079 VanDerWaalsContact O-CA 3.31Å; Y3059-V3079 WeakPolarHBondContact O-CA 3.4Å; Y3059-D3080 VanDerWaalsContact CD2-O 3.23Å; Y3059-D3080 WeakPolarHBondContact CD2-O 3.37Å; Y3059-D3080 WeakPolarHBondContact CE2-O 3.01Å; Y3059-D3080 PolarHBondContact O-N 2.93Å; Y3059-D3084 HydrophobicContact CE2-CB 4.19Å; Y3059-D3084 PolarHBondContact OH-OD2 3.05Å
3060	I	90.6	Very high	93.4	Very high	5.33333 Å²	5.33333	33.1 Å²	33.1	3%	0.027	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	128.9	171.7	-62.7	171.8	0	0	0	108.4	W3040 H3054 L3055 L3058 R3077 V3079	W3040-I3060 HydrophobicContact CH2-CB 4.09Å; W3040-I3060 HydrophobicContact CH2-CG2 3.74Å; W3040-I3060 HydrophobicContact CZ3-CG2 4.27Å; H3054-I3060 CarbonylContact C-O 3.52Å; H3054-I3060 VanDerWaalsContact CA-O 3.27Å; H3054-I3060 WeakPolarHBondContact CA-O 3.26Å; H3054-I3060 WeakPolarHBondContact CB-O 3.3Å; L3055-I3060 HydrophobicContact CD1-CB 3.92Å; L3055-I3060 HydrophobicContact CD1-CD1 4Å; L3055-I3060 HydrophobicContact CD1-CG1 4.01Å; L3055-I3060 HydrophobicContact CG-CB 4.28Å; L3055-I3060 PolarHBondContact N-O 3.03Å; L3058-I3060 VanDerWaalsContact C-N 3.25Å; L3058-I3060 PolarHBondContact O-N 3.1Å; I3060-R3077 HydrophobicContact CG2-CG 4.04Å; I3060-R3077 VanDerWaalsContact CG2-NE 3.28Å; I3060-V3079 HydrophobicContact CG1-CG2 4.4Å
3061	T	94.2	Very high	93.3	Very high	12.3333 Å²	12.3333	33.3 Å²	33.3	8%	0.076	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	125.2	170.9	-66.6	0	0	0	0	109.4	K3052 H3054 Q3063 R3077 T3078	K3052-T3061 HydrophobicContact CD-CG2 4.39Å; K3052-T3061 VanDerWaalsContact CE-CG2 3.41Å; K3052-T3061 HydrophobicContact CG-CG2 4.3Å; H3054-T3061 HydrophobicContact CB-CG2 4.3Å; T3061-Q3063 HydrophobicContact CG2-CG 4.43Å; T3061-R3077 CarbonylContact O-C 3.31Å; T3061-R3077 WeakPolarHBondContact O-CA 3.41Å; T3061-T3078 WeakPolarHBondContact CB-OG1 3.3Å; T3061-T3078 PolarHBondContact N-O 3Å; T3061-T3078 VanDerWaalsContact N-O 3.07Å; T3061-T3078 PolarHBondContact O-N 3.04Å; T3061-T3078 PolarHBondContact O-OG1 3.01Å
3062	D	95.3	Very high	93.3	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	138.7	172.5	-60.9	-17.1	0	0	0	110	K3052 R3053 F3064 E3076 R3077	K3052-D3062 CarbonylContact C-O 3.51Å; K3052-D3062 VanDerWaalsContact CA-O 3.26Å; K3052-D3062 WeakPolarHBondContact CA-O 3.26Å; K3052-D3062 WeakPolarHBondContact CG-O 3.35Å; R3053-D3062 HydrophobicContact CG-CB 3.84Å; R3053-D3062 IonicContact CZ-OD2 3.44Å; R3053-D3062 PolarHBondContact N-O 2.98Å; R3053-D3062 IonicContact NE-OD2 3.11Å; R3053-D3062 PolarHBondContact NE-OD2 3.07Å; R3053-D3062 IonicContact NH2-OD2 3.15Å; R3053-D3062 PolarHBondContact NH2-OD2 2.79Å; R3053-D3062 VanDerWaalsContact NH2-OD2 3.1Å; R3053-D3062 PolarHBondContact O-N 3Å; D3062-F3064 HydrophobicContact CB-CE1 4.14Å; D3062-F3064 HydrophobicContact CB-CE2 3.86Å; D3062-F3064 HydrophobicContact CB-CZ 3.47Å; D3062-F3064 VanDerWaalsContact CB-CZ 3.47Å; D3062-E3076 CarbonylContact C-O 3.55Å; D3062-E3076 VanDerWaalsContact CA-O 3.25Å; D3062-E3076 WeakPolarHBondContact CA-O 3.4Å; D3062-R3077 VanDerWaalsContact CG-NH2 3.3Å; D3062-R3077 WeakPolarHBondContact OD1-CB 3.37Å; D3062-R3077 WeakPolarHBondContact OD1-CG 3.43Å; D3062-R3077 IonicContact OD1-CZ 3.3Å; D3062-R3077 VanDerWaalsContact OD1-CZ 3.26Å; D3062-R3077 IonicContact OD1-NE 3.31Å; D3062-R3077 PolarHBondContact OD1-NE 3.12Å; D3062-R3077 IonicContact OD1-NH2 3.48Å; D3062-R3077 PolarHBondContact OD1-NH2 3.24Å; D3062-R3077 VanDerWaalsContact OD1-NH2 3.16Å; D3062-R3077 IonicContact OD2-CZ 3.01Å; D3062-R3077 IonicContact OD2-NE 3.04Å; D3062-R3077 IonicContact OD2-NH2 2.98Å; D3062-R3077 PolarHBondContact OD2-NH2 3.04Å
3063	Q	97	Very high	93.2	Very high	78.6667 Å²	78.6667	30.7 Å²	30.7	37%	0.368	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	143.6	171.4	-62.7	-176.4	10.8	0	0	109.8	V3051 K3052 T3061 A3075 E3076 T3693 I3697	V3051-Q3063 WeakPolarHBondContact O-CA 3.31Å; K3052-Q3063 HydrophobicContact CG-CG 4.36Å; T3061-Q3063 HydrophobicContact CG2-CG 4.43Å; Q3063-A3075 CarbonylContact O-C 3.54Å; Q3063-A3075 WeakPolarHBondContact O-CA 3.33Å; Q3063-E3076 PolarHBondContact N-O 3.2Å; Q3063-E3076 PolarHBondContact O-N 2.97Å; Q3063-T3693 VanDerWaalsContact OE1-CG2 3.3Å; Q3063-I3697 HydrophobicContact CB-CD1 3.93Å; Q3063-I3697 HydrophobicContact CB-CG1 4.5Å; Q3063-I3697 HydrophobicContact CB-CG2 4.27Å
3064	F	97.5	Very high	93.3	Very high	9 Å²	9	33.4 Å²	33.4	4%	0.039	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	145.5	-174.5	-51.1	-73.5	0	0	0	111.1	L3050 V3051 R3053 D3062 Y3066 L3072 W3074 A3075 T3293 F3295	L3050-F3064 HydrophobicContact CD2-CD2 4.2Å; L3050-F3064 HydrophobicContact CD2-CE2 3.89Å; L3050-F3064 HydrophobicContact CG-CD2 3.93Å; L3050-F3064 HydrophobicContact CG-CE2 4.04Å; L3050-F3064 WeakPolarHBondContact O-CB 3.31Å; L3050-F3064 WeakPolarHBondContact O-CD2 3.33Å; V3051-F3064 PolarHBondContact O-N 3.17Å; R3053-F3064 HydrophobicContact CB-CE2 4.47Å; R3053-F3064 HydrophobicContact CG-CE2 3.93Å; R3053-F3064 HydrophobicContact CG-CZ 4.2Å; D3062-F3064 HydrophobicContact CB-CE1 4.14Å; D3062-F3064 HydrophobicContact CB-CE2 3.86Å; D3062-F3064 HydrophobicContact CB-CZ 3.47Å; D3062-F3064 VanDerWaalsContact CB-CZ 3.47Å; F3064-Y3066 HydrophobicContact CB-CE2 3.71Å; F3064-L3072 HydrophobicContact CB-CD1 3.77Å; F3064-L3072 HydrophobicContact CD1-CD1 4.04Å; F3064-L3072 HydrophobicContact CG-CD1 4.28Å; F3064-W3074 WeakPolarHBondContact CA-O 3.43Å; F3064-A3075 HydrophobicContact CD1-CB 3.69Å; F3064-A3075 HydrophobicContact CE1-CB 3.96Å; F3064-T3293 HydrophobicContact CE1-CG2 4.09Å; F3064-F3295 AromaticContact CD1-CE2 3.92Å; F3064-F3295 HydrophobicContact CD1-CE2 3.92Å; F3064-F3295 HydrophobicContact CD1-CZ 4.34Å; F3064-F3295 AromaticContact CE1-CE2 3.5Å; F3064-F3295 HydrophobicContact CE1-CE2 3.5Å; F3064-F3295 VanDerWaalsContact CE1-CE2 3.49Å; F3064-F3295 AromaticContact CE1-CZ 3.62Å; F3064-F3295 HydrophobicContact CE1-CZ 3.62Å; F3064-F3295 HydrophobicContact CE2-CZ 4.03Å; F3064-F3295 HydrophobicContact CZ-CE1 4.47Å; F3064-F3295 AromaticContact CZ-CE2 3.85Å; F3064-F3295 HydrophobicContact CZ-CE2 3.85Å; F3064-F3295 AromaticContact CZ-CZ 3.44Å; F3064-F3295 HydrophobicContact CZ-CZ 3.44Å; F3064-F3295 VanDerWaalsContact CZ-CZ 3.44Å
3065	A	96.2	Very high	93.4	Very high	30.3333 Å²	30.3333	32 Å²	32	25%	0.251	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	145.6	171.7	0	0	0	0	0	110.9	I3073 W3074 Y3696	A3065-I3073 HydrophobicContact CB-CG1 4.29Å; A3065-I3073 VanDerWaalsContact O-CG1 3.28Å; A3065-I3073 WeakPolarHBondContact O-CG1 3.37Å; A3065-I3073 PolarHBondContact O-N 2.9Å; A3065-W3074 HydrophobicContact CB-CB 3.97Å; A3065-W3074 PolarHBondContact N-O 2.97Å; A3065-W3074 PolarHBondContact O-N 2.99Å; A3065-Y3696 VanDerWaalsContact CB-O 3.27Å; A3065-Y3696 WeakPolarHBondContact CB-O 3.41Å
3066	Y	96.2	Very high	93.7	Very high	16 Å²	16	33.7 Å²	33.7	6%	0.063	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	151.9	-176.1	-59	-104.3	0	0	0	110.5	F3049 L3050 F3064 L3071 L3072 T3313	F3049-Y3066 HydrophobicContact CB-CD2 4.13Å; F3049-Y3066 HydrophobicContact CB-CE2 4.33Å; F3049-Y3066 VanDerWaalsContact CD1-CB 3.46Å; F3049-Y3066 AromaticContact CD1-CD1 3.84Å; F3049-Y3066 HydrophobicContact CD1-CD1 3.84Å; F3049-Y3066 AromaticContact CD1-CD2 3.72Å; F3049-Y3066 HydrophobicContact CD1-CD2 3.72Å; F3049-Y3066 HydrophobicContact CD1-CE1 4.44Å; F3049-Y3066 HydrophobicContact CD1-CE2 4.44Å; F3049-Y3066 AromaticContact CD1-CG 3.41Å; F3049-Y3066 HydrophobicContact CD1-CG 3.41Å; F3049-Y3066 VanDerWaalsContact CD1-CG 3.42Å; F3049-Y3066 HydrophobicContact CE1-CD1 4.25Å; F3049-Y3066 AromaticContact CE1-CG 3.94Å; F3049-Y3066 HydrophobicContact CE1-CG 3.94Å; F3049-Y3066 HydrophobicContact CG-CD2 4.43Å; F3049-Y3066 HydrophobicContact CG-CG 4.42Å; L3050-Y3066 VanDerWaalsContact O-CE2 3.25Å; L3050-Y3066 WeakPolarHBondContact O-CE2 3.44Å; L3050-Y3066 PolarHBondContact O-OH 3.13Å; F3064-Y3066 HydrophobicContact CB-CE2 3.71Å; Y3066-L3071 VanDerWaalsContact CA-O 3.25Å; Y3066-L3071 WeakPolarHBondContact CA-O 3.38Å; Y3066-L3071 WeakPolarHBondContact CB-O 3.37Å; Y3066-L3072 VanDerWaalsContact CD1-CA 3.49Å; Y3066-L3072 HydrophobicContact CD1-CB 4.02Å; Y3066-L3072 HydrophobicContact CD1-CD1 4.29Å; Y3066-L3072 HydrophobicContact CD2-CD1 4.36Å; Y3066-L3072 HydrophobicContact CE1-CB 3.75Å; Y3066-L3072 HydrophobicContact CE1-CD1 3.79Å; Y3066-L3072 HydrophobicContact CE1-CG 4.39Å; Y3066-L3072 HydrophobicContact CE2-CD1 4Å; Y3066-T3313 WeakPolarHBondContact CE1-OG1 3.16Å; Y3066-T3313 WeakPolarHBondContact OH-CB 3.32Å; Y3066-T3313 PolarHBondContact OH-OG1 3.23Å
3067	N	94.5	Very high	94.1	Very high	9.33333 Å²	9.33333	27.6 Å²	27.6	5%	0.05	14%	0.136	C	C	.	.			trans	-80.2	169.2	165.9	68.5	20.1	0	0	0	111.2	Y2753 D2754 K3069 G3070 L3071 I3073	Y2753-N3067 HydrophobicContact CD2-CB 4.33Å; Y2753-N3067 HydrophobicContact CE2-CB 4.26Å; D2754-N3067 VanDerWaalsContact OD2-CA 3.28Å; D2754-N3067 WeakPolarHBondContact OD2-CA 3.29Å; D2754-N3067 VanDerWaalsContact OD2-CB 3.29Å; D2754-N3067 WeakPolarHBondContact OD2-CB 3.45Å; N3067-K3069 PolarHBondContact O-N 3.01Å; N3067-K3069 VanDerWaalsContact O-N 3.07Å; N3067-K3069 WeakPolarHBondContact OD1-CA 3.32Å; N3067-K3069 WeakPolarHBondContact OD1-CB 3.26Å; N3067-K3069 PolarHBondContact OD1-N 3.17Å; N3067-K3069 VanDerWaalsContact OD1-N 3.08Å; N3067-G3070 PolarHBondContact O-N 2.99Å; N3067-G3070 VanDerWaalsContact O-N 3.09Å; N3067-G3070 PolarHBondContact OD1-N 2.89Å; N3067-L3071 PolarHBondContact N-O 3Å; N3067-L3071 WeakPolarHBondContact OD1-CB 3.37Å; N3067-L3071 PolarHBondContact OD1-N 3.39Å; N3067-L3071 PolarHBondContact OD1-O 2.84Å; N3067-I3073 HydrophobicContact CB-CG2 4.03Å
3068	S	94.5	Very high	94.4	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-13.1	178.1	-80.9	0	0	0	0	113.9	W2735 R2740 R2741 I2742 D2754	W2735-S3068 PolarHBondContact NE1-O 2.99Å; R2740-S3068 VanDerWaalsContact CA-OG 3.29Å; R2740-S3068 WeakPolarHBondContact CA-OG 3.25Å; R2740-S3068 WeakPolarHBondContact CB-OG 3.39Å; R2741-S3068 PolarHBondContact N-OG 3.05Å; R2741-S3068 VanDerWaalsContact N-OG 3.1Å; R2741-S3068 WeakPolarHBondContact O-CB 3.41Å; R2741-S3068 PolarHBondContact O-OG 3.11Å; I2742-S3068 WeakPolarHBondContact CD1-O 3.17Å; D2754-S3068 WeakPolarHBondContact OD1-CB 3.33Å; D2754-S3068 PolarHBondContact OD1-OG 2.73Å; D2754-S3068 WeakPolarHBondContact OD2-CB 3.27Å; D2754-S3068 PolarHBondContact OD2-N 3.13Å
3069	K	92.9	Very high	94.5	Very high	26.6667 Å²	26.6667	23.3 Å²	23.3	12%	0.116	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-5.8	174.1	-78	-170.1	170	-165.6	0	114.3	I2742 Y2753 N3067 L3071 D3125 W3317	I2742-K3069 HydrophobicContact CD1-CB 4.49Å; I2742-K3069 HydrophobicContact CD1-CG 3.85Å; I2742-K3069 HydrophobicContact CG1-CG 4.36Å; Y2753-K3069 HydrophobicContact CD1-CD 4.23Å; Y2753-K3069 HydrophobicContact CD1-CG 4.26Å; Y2753-K3069 HydrophobicContact CD2-CG 4.23Å; Y2753-K3069 HydrophobicContact CE1-CD 3.91Å; Y2753-K3069 VanDerWaalsContact CE1-CE 3.47Å; Y2753-K3069 HydrophobicContact CE1-CG 4.39Å; Y2753-K3069 HydrophobicContact CE2-CD 4.3Å; Y2753-K3069 HydrophobicContact CE2-CG 4.34Å; Y2753-K3069 HydrophobicContact CG-CD 4.42Å; Y2753-K3069 HydrophobicContact CG-CG 4.18Å; N3067-K3069 PolarHBondContact O-N 3.01Å; N3067-K3069 VanDerWaalsContact O-N 3.07Å; N3067-K3069 WeakPolarHBondContact OD1-CA 3.32Å; N3067-K3069 WeakPolarHBondContact OD1-CB 3.26Å; N3067-K3069 PolarHBondContact OD1-N 3.17Å; N3067-K3069 VanDerWaalsContact OD1-N 3.08Å; K3069-L3071 HydrophobicContact CB-CD1 4.34Å; K3069-L3071 HydrophobicContact CB-CG 4.22Å; K3069-D3125 WeakPolarHBondContact CD-OD1 3.38Å; K3069-D3125 IonicContact NZ-OD1 3.01Å; K3069-D3125 PolarHBondContact NZ-OD1 2.89Å; K3069-D3125 IonicContact NZ-OD2 3.13Å; K3069-D3125 PolarHBondContact NZ-OD2 3.03Å; K3069-W3317 PolarHBondContact O-NE1 3.1Å
3070	G	94	Very high	94.4	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.127	C	C	.	.	S	Bend	trans	93.5	3.1	-174.7	0	0	0	0	0	114.6	N3067 S3314	N3067-G3070 PolarHBondContact O-N 2.99Å; N3067-G3070 VanDerWaalsContact O-N 3.09Å; N3067-G3070 PolarHBondContact OD1-N 2.89Å; G3070-S3314 WeakPolarHBondContact O-CB 3.27Å; G3070-S3314 PolarHBondContact O-OG 3.3Å
3071	L	95.6	Very high	93.7	Very high	4.33333 Å²	4.33333	32.2 Å²	32.2	2%	0.023	16%	0.16	C	C	.	.			trans	-92.8	133.1	-174.7	-52.8	173.4	0	0	0	110.4	Y3066 N3067 K3069 I3073 Y3121 D3125 T3301	Y3066-L3071 VanDerWaalsContact CA-O 3.25Å; Y3066-L3071 WeakPolarHBondContact CA-O 3.38Å; Y3066-L3071 WeakPolarHBondContact CB-O 3.37Å; N3067-L3071 PolarHBondContact N-O 3Å; N3067-L3071 WeakPolarHBondContact OD1-CB 3.37Å; N3067-L3071 PolarHBondContact OD1-N 3.39Å; N3067-L3071 PolarHBondContact OD1-O 2.84Å; K3069-L3071 HydrophobicContact CB-CD1 4.34Å; K3069-L3071 HydrophobicContact CB-CG 4.22Å; L3071-I3073 PolarHBondContact O-N 3.18Å; L3071-Y3121 HydrophobicContact CB-CD1 4.48Å; L3071-Y3121 HydrophobicContact CB-CD2 4.03Å; L3071-Y3121 HydrophobicContact CB-CE1 4.17Å; L3071-Y3121 HydrophobicContact CB-CE2 3.68Å; L3071-Y3121 HydrophobicContact CB-CG 4.43Å; L3071-Y3121 HydrophobicContact CD1-CD1 3.89Å; L3071-Y3121 HydrophobicContact CD1-CD2 4.11Å; L3071-Y3121 HydrophobicContact CD1-CE1 4.32Å; L3071-Y3121 HydrophobicContact CD1-CG 3.78Å; L3071-Y3121 HydrophobicContact CD2-CD1 4.39Å; L3071-Y3121 HydrophobicContact CD2-CE1 4.16Å; L3071-Y3121 HydrophobicContact CG-CD1 4.47Å; L3071-Y3121 HydrophobicContact CG-CE1 4.45Å; L3071-D3125 HydrophobicContact CD1-CB 3.88Å; L3071-T3301 WeakPolarHBondContact CD2-O 3.4Å
3072	L	97.3	Very high	92.6	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	117	179	177.7	71.5	0	0	0	108.9	F3064 Y3066 W3074 F3119 Y3121 F3295 F3297 A3304	F3064-L3072 HydrophobicContact CB-CD1 3.77Å; F3064-L3072 HydrophobicContact CD1-CD1 4.04Å; F3064-L3072 HydrophobicContact CG-CD1 4.28Å; Y3066-L3072 VanDerWaalsContact CD1-CA 3.49Å; Y3066-L3072 HydrophobicContact CD1-CB 4.02Å; Y3066-L3072 HydrophobicContact CD1-CD1 4.29Å; Y3066-L3072 HydrophobicContact CD2-CD1 4.36Å; Y3066-L3072 HydrophobicContact CE1-CB 3.75Å; Y3066-L3072 HydrophobicContact CE1-CD1 3.79Å; Y3066-L3072 HydrophobicContact CE1-CG 4.39Å; Y3066-L3072 HydrophobicContact CE2-CD1 4Å; L3072-W3074 WeakPolarHBondContact CD1-O 3.35Å; L3072-F3119 HydrophobicContact CD2-CD2 4.02Å; L3072-F3119 HydrophobicContact CD2-CE1 4.4Å; L3072-F3119 HydrophobicContact CD2-CE2 3.68Å; L3072-F3119 HydrophobicContact CD2-CZ 3.92Å; L3072-F3119 HydrophobicContact CG-CD2 4Å; L3072-F3119 HydrophobicContact CG-CE2 4.11Å; L3072-F3119 WeakPolarHBondContact O-CB 3.34Å; L3072-Y3121 PolarHBondContact N-OH 3.24Å; L3072-Y3121 WeakPolarHBondContact O-CE2 3.29Å; L3072-Y3121 PolarHBondContact O-OH 3.19Å; L3072-F3295 HydrophobicContact CD2-CD2 3.73Å; L3072-F3295 HydrophobicContact CD2-CE2 3.96Å; L3072-F3297 HydrophobicContact CB-CE1 4.46Å; L3072-F3297 HydrophobicContact CD2-CE1 4.48Å; L3072-F3297 HydrophobicContact CD2-CZ 4.09Å; L3072-A3304 HydrophobicContact CB-CB 4.13Å; L3072-A3304 HydrophobicContact CD2-CB 4.14Å
3073	I	96	Very high	91.1	Very high	57 Å²	57	37.2 Å²	37.2	29%	0.292	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	-19.9	-178.3	57	172	0	0	0	113.1	A3065 N3067 L3071 F3119 Y3121	A3065-I3073 HydrophobicContact CB-CG1 4.29Å; A3065-I3073 VanDerWaalsContact O-CG1 3.28Å; A3065-I3073 WeakPolarHBondContact O-CG1 3.37Å; A3065-I3073 PolarHBondContact O-N 2.9Å; N3067-I3073 HydrophobicContact CB-CG2 4.03Å; L3071-I3073 PolarHBondContact O-N 3.18Å; I3073-F3119 PolarHBondContact O-N 3.23Å; I3073-Y3121 HydrophobicContact CG2-CE2 4.48Å
3074	W	96.7	Very high	89	Confident	58 Å²	58	36 Å²	36	22%	0.22	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	139.5	-178.5	-168.5	-98.9	0	0	0	111.6	F3064 A3065 L3072 S3116 V3117 Q3118 T3133 S3694 Y3696	F3064-W3074 WeakPolarHBondContact CA-O 3.43Å; A3065-W3074 HydrophobicContact CB-CB 3.97Å; A3065-W3074 PolarHBondContact N-O 2.97Å; A3065-W3074 PolarHBondContact O-N 2.99Å; L3072-W3074 WeakPolarHBondContact CD1-O 3.35Å; W3074-S3116 WeakPolarHBondContact CH2-OG 3.47Å; W3074-S3116 WeakPolarHBondContact CZ2-OG 3.37Å; W3074-S3116 PolarHBondContact NE1-OG 3.23Å; W3074-V3117 CarbonylContact C-O 3.55Å; W3074-V3117 WeakPolarHBondContact CA-O 3.16Å; W3074-Q3118 HydrophobicContact CE3-CB 3.86Å; W3074-Q3118 HydrophobicContact CE3-CG 4.17Å; W3074-Q3118 HydrophobicContact CZ3-CB 3.8Å; W3074-Q3118 HydrophobicContact CZ3-CG 4.14Å; W3074-T3133 HydrophobicContact CH2-CG2 3.79Å; W3074-T3133 WeakPolarHBondContact CH2-OG1 3.3Å; W3074-T3133 HydrophobicContact CZ3-CG2 3.89Å; W3074-S3694 VanDerWaalsContact CE2-CB 3.49Å; W3074-S3694 VanDerWaalsContact CZ2-CB 3.46Å; W3074-S3694 PolarHBondContact NE1-OG 3.26Å; W3074-Y3696 AromaticContact CD2-CD2 3.94Å; W3074-Y3696 HydrophobicContact CD2-CD2 3.94Å; W3074-Y3696 HydrophobicContact CD2-CG 4.36Å; W3074-Y3696 AromaticContact CE3-CD2 3.51Å; W3074-Y3696 HydrophobicContact CE3-CD2 3.51Å; W3074-Y3696 HydrophobicContact CE3-CE2 4.02Å; W3074-Y3696 HydrophobicContact CE3-CG 4.14Å; W3074-Y3696 HydrophobicContact CH2-CD2 4.3Å; W3074-Y3696 AromaticContact CZ3-CD2 3.72Å; W3074-Y3696 HydrophobicContact CZ3-CD2 3.72Å; W3074-Y3696 AromaticContact CZ3-CE2 3.86Å; W3074-Y3696 HydrophobicContact CZ3-CE2 3.86Å
3075	A	97.1	Very high	86.4	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	130.2	169	0	0	0	0	0	110.4	Q3063 F3064 Y3115 S3116 V3117 F3119 T3293	Q3063-A3075 CarbonylContact O-C 3.54Å; Q3063-A3075 WeakPolarHBondContact O-CA 3.33Å; F3064-A3075 HydrophobicContact CD1-CB 3.69Å; F3064-A3075 HydrophobicContact CE1-CB 3.96Å; A3075-Y3115 HydrophobicContact CB-CE2 4.2Å; A3075-S3116 CarbonylContact O-C 3.46Å; A3075-S3116 WeakPolarHBondContact O-CA 3.3Å; A3075-V3117 PolarHBondContact N-O 3.28Å; A3075-V3117 PolarHBondContact O-N 3.28Å; A3075-F3119 HydrophobicContact CB-CE2 3.82Å; A3075-F3119 HydrophobicContact CB-CZ 4.48Å; A3075-T3293 HydrophobicContact CB-CG2 3.54Å
3076	E	96.3	Very high	83.8	Confident	50 Å²	50	43.8 Å²	43.8	23%	0.234	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	131.5	178.8	-176	176.8	176.8	0	0	110.3	D3062 Q3063 Y3115 L3692 S3694 I3697	D3062-E3076 CarbonylContact C-O 3.55Å; D3062-E3076 VanDerWaalsContact CA-O 3.25Å; D3062-E3076 WeakPolarHBondContact CA-O 3.4Å; Q3063-E3076 PolarHBondContact N-O 3.2Å; Q3063-E3076 PolarHBondContact O-N 2.97Å; E3076-Y3115 WeakPolarHBondContact CA-O 3.35Å; E3076-L3692 VanDerWaalsContact CD-O 3.26Å; E3076-L3692 WeakPolarHBondContact OE1-CB 3.39Å; E3076-L3692 VanDerWaalsContact OE2-O 3.11Å; E3076-S3694 PolarHBondContact OE2-N 3.07Å; E3076-I3697 HydrophobicContact CB-CD1 3.68Å; E3076-I3697 HydrophobicContact CG-CD1 4.44Å; E3076-I3697 WeakPolarHBondContact OE2-CD1 3.27Å
3077	R	94.5	Very high	81.3	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.008	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	128	172.5	172.2	167.2	-72.6	174.9	-1	110.1	I3060 T3061 D3062 V3079 A3109 L3111 R3113 S3114 Y3115	I3060-R3077 HydrophobicContact CG2-CG 4.04Å; I3060-R3077 VanDerWaalsContact CG2-NE 3.28Å; T3061-R3077 CarbonylContact O-C 3.31Å; T3061-R3077 WeakPolarHBondContact O-CA 3.41Å; D3062-R3077 VanDerWaalsContact CG-NH2 3.3Å; D3062-R3077 WeakPolarHBondContact OD1-CB 3.37Å; D3062-R3077 WeakPolarHBondContact OD1-CG 3.43Å; D3062-R3077 IonicContact OD1-CZ 3.3Å; D3062-R3077 VanDerWaalsContact OD1-CZ 3.26Å; D3062-R3077 IonicContact OD1-NE 3.31Å; D3062-R3077 PolarHBondContact OD1-NE 3.12Å; D3062-R3077 IonicContact OD1-NH2 3.48Å; D3062-R3077 PolarHBondContact OD1-NH2 3.24Å; D3062-R3077 VanDerWaalsContact OD1-NH2 3.16Å; D3062-R3077 IonicContact OD2-CZ 3.01Å; D3062-R3077 IonicContact OD2-NE 3.04Å; D3062-R3077 IonicContact OD2-NH2 2.98Å; D3062-R3077 PolarHBondContact OD2-NH2 3.04Å; R3077-V3079 HydrophobicContact CG-CG2 3.98Å; R3077-A3109 VanDerWaalsContact CZ-O 3.28Å; R3077-A3109 PolarHBondContact NH1-O 3.02Å; R3077-A3109 PolarHBondContact NH2-O 3.26Å; R3077-L3111 WeakPolarHBondContact CD-O 3.42Å; R3077-L3111 PolarHBondContact NH1-O 3.2Å; R3077-R3113 VanDerWaalsContact CD-O 3.28Å; R3077-R3113 WeakPolarHBondContact CD-O 3.33Å; R3077-R3113 WeakPolarHBondContact CG-O 3.45Å; R3077-S3114 VanDerWaalsContact O-CA 3.24Å; R3077-S3114 WeakPolarHBondContact O-CA 3.41Å; R3077-S3114 WeakPolarHBondContact O-CB 3.34Å; R3077-S3114 PolarHBondContact O-OG 3.25Å; R3077-Y3115 HydrophobicContact CB-CD1 3.66Å; R3077-Y3115 HydrophobicContact CB-CD2 4.01Å; R3077-Y3115 HydrophobicContact CB-CE1 3.36Å; R3077-Y3115 HydrophobicContact CB-CE2 3.73Å; R3077-Y3115 HydrophobicContact CB-CG 3.98Å; R3077-Y3115 VanDerWaalsContact CB-CZ 3.43Å; R3077-Y3115 HydrophobicContact CG-CD1 4.36Å; R3077-Y3115 HydrophobicContact CG-CE1 4.03Å; R3077-Y3115 PolarHBondContact N-O 2.98Å; R3077-Y3115 PolarHBondContact O-N 3.13Å
3078	T	92.5	Very high	78.5	Confident	55.6667 Å²	55.6667	49.6 Å²	49.6	34%	0.342	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	129.1	168.3	60.5	0	0	0	0	109.5	T3061 L3692	T3061-T3078 WeakPolarHBondContact CB-OG1 3.3Å; T3061-T3078 PolarHBondContact N-O 3Å; T3061-T3078 VanDerWaalsContact N-O 3.07Å; T3061-T3078 PolarHBondContact O-N 3.04Å; T3061-T3078 PolarHBondContact O-OG1 3.01Å; T3078-L3692 HydrophobicContact CG2-CB 4.25Å; T3078-L3692 HydrophobicContact CG2-CD1 3.88Å
3079	V	88.5	Confident	75.6	Confident	25.3333 Å²	25.3333	56.7 Å²	56.7	15%	0.154	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	115.6	175.6	-176.3	0	0	0	0	109.2	Y3059 I3060 R3077 K3081 S3114	Y3059-V3079 HydrophobicContact CD2-CG1 4.41Å; Y3059-V3079 HydrophobicContact CE1-CG1 4.25Å; Y3059-V3079 HydrophobicContact CE2-CG1 3.74Å; Y3059-V3079 CarbonylContact O-C 3.48Å; Y3059-V3079 VanDerWaalsContact O-CA 3.31Å; Y3059-V3079 WeakPolarHBondContact O-CA 3.4Å; I3060-V3079 HydrophobicContact CG1-CG2 4.4Å; R3077-V3079 HydrophobicContact CG-CG2 3.98Å; V3079-K3081 PolarHBondContact O-N 2.62Å; V3079-S3114 PolarHBondContact N-OG 3.17Å
3080	D	85.1	Confident	72.7	Confident	76 Å²	76	62.5 Å²	62.5	41%	0.406	35%	0.349	S	S	.	.			trans	-93.4	97.8	179.3	-170.9	-6.8	0	0	0	111.1	Y3059 S3082 V3083	Y3059-D3080 VanDerWaalsContact CD2-O 3.23Å; Y3059-D3080 WeakPolarHBondContact CD2-O 3.37Å; Y3059-D3080 WeakPolarHBondContact CE2-O 3.01Å; Y3059-D3080 PolarHBondContact O-N 2.93Å; D3080-S3082 VanDerWaalsContact CG-OG 3.23Å; D3080-S3082 PolarHBondContact O-N 2.83Å; D3080-S3082 VanDerWaalsContact O-N 3.15Å; D3080-S3082 VanDerWaalsContact OD1-CB 3.26Å; D3080-S3082 WeakPolarHBondContact OD1-CB 3.42Å; D3080-S3082 PolarHBondContact OD1-N 3.31Å; D3080-S3082 PolarHBondContact OD1-OG 3.03Å; D3080-S3082 PolarHBondContact OD2-OG 2.89Å; D3080-V3083 HydrophobicContact CB-CG2 4.27Å; D3080-V3083 PolarHBondContact O-N 3.1Å
3081	K	75.9	Confident	69.8	Low	164.667 Å²	164.667	68.7 Å²	68.7	72%	0.716	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-13.2	179.2	-62.8	-175.6	179.9	-178.1	0	113.8	V3079 V3083 D3084	V3079-K3081 PolarHBondContact O-N 2.62Å; K3081-V3083 VanDerWaalsContact C-N 3.28Å; K3081-V3083 PolarHBondContact O-N 3.08Å; K3081-D3084 WeakPolarHBondContact O-CB 3.2Å; K3081-D3084 PolarHBondContact O-N 3Å
3082	S	71.6	Confident	66.6	Low	74 Å²	74	76.5 Å²	76.5	52%	0.517	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-30.3	-179.6	71.1	0	0	0	0	112.3	D3080 D3084 S3085	D3080-S3082 VanDerWaalsContact CG-OG 3.23Å; D3080-S3082 PolarHBondContact O-N 2.83Å; D3080-S3082 VanDerWaalsContact O-N 3.15Å; D3080-S3082 VanDerWaalsContact OD1-CB 3.26Å; D3080-S3082 WeakPolarHBondContact OD1-CB 3.42Å; D3080-S3082 PolarHBondContact OD1-N 3.31Å; D3080-S3082 PolarHBondContact OD1-OG 3.03Å; D3080-S3082 PolarHBondContact OD2-OG 2.89Å; S3082-D3084 VanDerWaalsContact C-N 3.3Å; S3082-D3084 PolarHBondContact O-N 3.15Å; S3082-S3085 PolarHBondContact O-N 3.19Å; S3082-S3085 PolarHBondContact O-OG 3.04Å
3083	V	63.1	Low	63.2	Low	44.6667 Å²	44.6667	80.8 Å²	80.8	27%	0.271	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-66.2	-26.9	178.5	-175.1	0	0	0	0	112	N3057 D3080 K3081 S3085 S3086	N3057-V3083 HydrophobicContact CB-CG1 4.23Å; D3080-V3083 HydrophobicContact CB-CG2 4.27Å; D3080-V3083 PolarHBondContact O-N 3.1Å; K3081-V3083 VanDerWaalsContact C-N 3.28Å; K3081-V3083 PolarHBondContact O-N 3.08Å; V3083-S3085 VanDerWaalsContact C-N 3.3Å; V3083-S3085 PolarHBondContact O-N 2.97Å; V3083-S3086 PolarHBondContact O-N 2.87Å; V3083-S3086 PolarHBondContact O-OG 3.02Å
3084	D	53.9	Low	59.9	Low	52 Å²	52	83.4 Å²	83.4	28%	0.278	46%	0.461	S	S	.	.	G	3₁₀ helix	trans	-73.1	-18.9	-179.6	-114.8	-6.8	0	0	0	113.3	Y3059 K3081 S3082 S3086 S3087 M3088	Y3059-D3084 HydrophobicContact CE2-CB 4.19Å; Y3059-D3084 PolarHBondContact OH-OD2 3.05Å; K3081-D3084 WeakPolarHBondContact O-CB 3.2Å; K3081-D3084 PolarHBondContact O-N 3Å; S3082-D3084 VanDerWaalsContact C-N 3.3Å; S3082-D3084 PolarHBondContact O-N 3.15Å; D3084-S3086 VanDerWaalsContact C-N 3.28Å; D3084-S3086 PolarHBondContact O-N 2.97Å; D3084-S3087 PolarHBondContact O-N 3.35Å; D3084-S3087 PolarHBondContact O-OG 2.99Å; D3084-M3088 HydrophobicContact CB-CG 3.79Å; D3084-M3088 HydrophobicContact CB-SD 4.03Å; D3084-M3088 VanDerWaalsContact O-CB 3.29Å; D3084-M3088 WeakPolarHBondContact O-CB 3.32Å; D3084-M3088 WeakPolarHBondContact O-CG 2.96Å; D3084-M3088 PolarHBondContact O-N 3.26Å; D3084-M3088 VanDerWaalsContact O-N 3.16Å; D3084-M3088 WeakPolarHBondContact OD1-CG 3.11Å
3085	S	42.4	Very low	56.8	Low	95 Å²	95	87.3 Å²	87.3	66%	0.664	49%	0.494	S	S	*	.	G	3₁₀ helix	trans	-69.6	-18.6	-174.7	65.1	0	0	0	0	114.5	S3082 V3083	S3082-S3085 PolarHBondContact O-N 3.19Å; S3082-S3085 PolarHBondContact O-OG 3.04Å; V3083-S3085 VanDerWaalsContact C-N 3.3Å; V3083-S3085 PolarHBondContact O-N 2.97Å
3086	S	42.4	Very low	53.5	Low	108.667 Å²	108.667	91 Å²	91	76%	0.76	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	-12.2	177.8	60.9	0	0	0	0	114.8	V3083 D3084	V3083-S3086 PolarHBondContact O-N 2.87Å; V3083-S3086 PolarHBondContact O-OG 3.02Å; D3084-S3086 VanDerWaalsContact C-N 3.28Å; D3084-S3086 PolarHBondContact O-N 2.97Å
3087	S	43.3	Very low	50.3	Low	61.3333 Å²	61.3333	94.2 Å²	94.2	43%	0.429	55%	0.548	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110	-14.9	178.5	61.1	0	0	0	0	114.5	D3084 N3089 N3090	D3084-S3087 PolarHBondContact O-N 3.35Å; D3084-S3087 PolarHBondContact O-OG 2.99Å; S3087-N3089 VanDerWaalsContact C-N 3.32Å; S3087-N3089 PolarHBondContact O-N 3.03Å; S3087-N3090 PolarHBondContact O-N 3.18Å
3088	M	35.7	Very low	47.2	Very low	86 Å²	86	97.4 Å²	97.4	42%	0.424	57%	0.57	S	S	.	*	G	3₁₀ helix	trans	-77.4	-15.6	-180	-79.7	-94.5	128.3	0	0	115.1	D3084 N3090 F3091 H3092	D3084-M3088 HydrophobicContact CB-CG 3.79Å; D3084-M3088 HydrophobicContact CB-SD 4.03Å; D3084-M3088 VanDerWaalsContact O-CB 3.29Å; D3084-M3088 WeakPolarHBondContact O-CB 3.32Å; D3084-M3088 WeakPolarHBondContact O-CG 2.96Å; D3084-M3088 PolarHBondContact O-N 3.26Å; D3084-M3088 VanDerWaalsContact O-N 3.16Å; D3084-M3088 WeakPolarHBondContact OD1-CG 3.11Å; M3088-N3090 PolarHBondContact O-N 2.9Å; M3088-F3091 PolarHBondContact O-N 2.86Å; M3088-F3091 VanDerWaalsContact O-N 3.08Å; M3088-H3092 PolarHBondContact O-N 2.99Å
3089	N	33.2	Very low	44.5	Very low	149 Å²	149	100.7 Å²	100.7	80%	0.797	59%	0.593	S	S	*	*	G	3₁₀ helix	trans	-72	-8.5	175.5	-85.1	-5.5	0	0	0	114.2	S3087	S3087-N3089 VanDerWaalsContact C-N 3.32Å; S3087-N3089 PolarHBondContact O-N 3.03Å
3090	N	31.9	Very low	42	Very low	149 Å²	149	104.9 Å²	104.9	80%	0.797	61%	0.613	S	S	*	*	G	3₁₀ helix	trans	-111.9	8.9	171.2	-81.3	-8.3	0	0	0	114	S3087 M3088	S3087-N3090 PolarHBondContact O-N 3.18Å; M3088-N3090 PolarHBondContact O-N 2.9Å
3091	F	32.1	Very low	39.5	Very low	130 Å²	130	105.5 Å²	105.5	57%	0.57	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.3	13.6	174.9	-113.4	-82.9	0	0	0	114.1	M3088 W3103	M3088-F3091 PolarHBondContact O-N 2.86Å; M3088-F3091 VanDerWaalsContact O-N 3.08Å; F3091-W3103 HydrophobicContact CD1-CH2 4.12Å; F3091-W3103 AromaticContact CD1-CZ2 3.93Å; F3091-W3103 HydrophobicContact CD1-CZ2 3.93Å; F3091-W3103 AromaticContact CE1-CE2 3.84Å; F3091-W3103 AromaticContact CE1-CH2 3.76Å; F3091-W3103 HydrophobicContact CE1-CH2 3.76Å; F3091-W3103 AromaticContact CE1-CZ2 3.12Å; F3091-W3103 HydrophobicContact CE1-CZ2 3.12Å; F3091-W3103 HydrophobicContact CE2-CZ2 4.15Å; F3091-W3103 HydrophobicContact CZ-CH2 4.12Å; F3091-W3103 AromaticContact CZ-CZ2 3.28Å; F3091-W3103 HydrophobicContact CZ-CZ2 3.28Å
3092	H	28.9	Very low	37.7	Very low	167.667 Å²	167.667	104 Å²	104	78%	0.776	61%	0.612	S	S	*	*			trans	-109.7	37.7	172.5	-91.6	-50.3	0	0	0	113.3	M3088 T3094	M3088-H3092 PolarHBondContact O-N 2.99Å; H3092-T3094 PolarHBondContact O-N 3.29Å
3093	S	26.3	Very low	36.3	Very low	90 Å²	90	106.9 Å²	106.9	63%	0.629	61%	0.612	S	S	*	*	S	Bend	trans	-101.3	102.9	163.4	60	0	0	0	0	110.3
3094	T	26.1	Very low	35.5	Very low	111.667 Å²	111.667	106.7 Å²	106.7	69%	0.685	62%	0.615	S	S	*	*			trans	70.2	122.7	161.7	66.4	0	0	0	0	118	H3092 S3096	H3092-T3094 PolarHBondContact O-N 3.29Å; T3094-S3096 PolarHBondContact O-N 3.12Å
3095	P	33	Very low	35.3	Very low	140 Å²	140	105.2 Å²	105.2	91%	0.909	61%	0.607	S	S	*	*			trans	-73.5	78.1	163.2	31.5	-29.7	0	0	0	108.5	S3097	P3095-S3097 PolarHBondContact O-N 3Å
3096	S	26.3	Very low	35.9	Very low	78.3333 Å²	78.3333	102 Å²	102	55%	0.548	58%	0.582	S	S	.	*			trans	-83	113	166.5	65.5	0	0	0	0	108.5	T3094 S3098	T3094-S3096 PolarHBondContact O-N 3.12Å; S3096-S3098 PolarHBondContact O-N 3.13Å
3097	S	28.8	Very low	36.7	Very low	118 Å²	118	98.8 Å²	98.8	83%	0.825	56%	0.556	S	S	*	*	S	Bend	trans	-28	79.3	164.7	54.5	0	0	0	0	115.1	P3095	P3095-S3097 PolarHBondContact O-N 3Å
3098	S	30.1	Very low	38	Very low	68.3333 Å²	68.3333	97.3 Å²	97.3	48%	0.478	54%	0.543	S	S	.	.			trans	-151.3	115.6	159.6	-100.4	0	0	0	0	110	S3096 L3100	S3096-S3098 PolarHBondContact O-N 3.13Å; S3098-L3100 PolarHBondContact O-N 3.15Å
3099	P	36.7	Very low	40.1	Very low	125 Å²	125	93.3 Å²	93.3	81%	0.812	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	27.3	-174	1.6	9	0	0	0	114.5
3100	L	34.3	Very low	42.5	Very low	112.667 Å²	112.667	86.9 Å²	86.9	59%	0.59	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.8	24.6	-174.8	-137.5	85.8	0	0	0	113.1	L2981 S3098 Q3102	L2981-L3100 HydrophobicContact CD1-CD2 4.34Å; L2981-L3100 HydrophobicContact CD2-CD1 3.9Å; S3098-L3100 PolarHBondContact O-N 3.15Å; L3100-Q3102 PolarHBondContact O-N 3.18Å
3101	D	34	Very low	44.9	Very low	89.6667 Å²	89.6667	81.3 Å²	81.3	48%	0.48	46%	0.463	S	S	.	.			trans	-77.3	48.4	-168.9	-74.5	-35.7	0	0	0	116.3	W3103 R3260	D3101-W3103 PolarHBondContact O-N 2.95Å; D3101-R3260 VanDerWaalsContact CB-NH2 3.28Å; D3101-R3260 IonicContact OD1-NH2 3.4Å; D3101-R3260 IonicContact OD2-CZ 3.08Å; D3101-R3260 IonicContact OD2-NH2 3.18Å; D3101-R3260 PolarHBondContact OD2-NH2 2.75Å
3102	Q	37.6	Very low	47.2	Very low	132 Å²	132	78.6 Å²	78.6	62%	0.617	45%	0.451	S	S	*	.	S	Bend	trans	-109.7	86.5	-179.4	-116.1	169.3	13.5	0	0	113.8	L3100 A3104	L3100-Q3102 PolarHBondContact O-N 3.18Å; Q3102-A3104 PolarHBondContact O-N 3Å
3103	W	41.1	Very low	49.9	Very low	135.333 Å²	135.333	73.5 Å²	73.5	51%	0.513	43%	0.425	S	S	.	.			trans	-46	95	179.2	-54.3	-2.4	0	0	0	115	F3091 D3101 L3105 E3106 K3112	F3091-W3103 HydrophobicContact CD1-CH2 4.12Å; F3091-W3103 AromaticContact CD1-CZ2 3.93Å; F3091-W3103 HydrophobicContact CD1-CZ2 3.93Å; F3091-W3103 AromaticContact CE1-CE2 3.84Å; F3091-W3103 AromaticContact CE1-CH2 3.76Å; F3091-W3103 HydrophobicContact CE1-CH2 3.76Å; F3091-W3103 AromaticContact CE1-CZ2 3.12Å; F3091-W3103 HydrophobicContact CE1-CZ2 3.12Å; F3091-W3103 HydrophobicContact CE2-CZ2 4.15Å; F3091-W3103 HydrophobicContact CZ-CH2 4.12Å; F3091-W3103 AromaticContact CZ-CZ2 3.28Å; F3091-W3103 HydrophobicContact CZ-CZ2 3.28Å; D3101-W3103 PolarHBondContact O-N 2.95Å; W3103-L3105 PolarHBondContact O-N 3.27Å; W3103-E3106 HydrophobicContact CE3-CG 4.19Å; W3103-E3106 WeakPolarHBondContact CZ3-OE1 3.47Å; W3103-E3106 PolarHBondContact O-N 3.01Å; W3103-K3112 VanDerWaalsContact CE2-NZ 3.25Å
3104	A	46.7	Very low	52.9	Low	40.6667 Å²	40.6667	71.7 Å²	71.7	34%	0.336	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	25.5	-178.8	0	0	0	0	0	114.5	I3000 Q3102 E3106 D3107 R3260	I3000-A3104 HydrophobicContact CD1-CB 3.98Å; I3000-A3104 HydrophobicContact CG2-CB 4.17Å; Q3102-A3104 PolarHBondContact O-N 3Å; A3104-E3106 PolarHBondContact O-N 3.15Å; A3104-E3106 VanDerWaalsContact O-N 3.11Å; A3104-D3107 PolarHBondContact O-N 3.28Å; A3104-R3260 PolarHBondContact O-NH1 3.35Å; A3104-R3260 PolarHBondContact O-NH2 3.39Å
3105	L	51.4	Low	56.1	Low	21.6667 Å²	21.6667	66.4 Å²	66.4	11%	0.113	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	-21.5	-175.7	-138.8	88.4	0	0	0	114.4	I3000 L3024 W3103 D3107 E3252 Y3253 R3260	I3000-L3105 HydrophobicContact CD1-CD1 3.36Å; I3000-L3105 HydrophobicContact CD1-CD2 3.5Å; I3000-L3105 HydrophobicContact CD1-CG 4Å; I3000-L3105 HydrophobicContact CG2-CD1 4.49Å; L3024-L3105 HydrophobicContact CD1-CD2 3.56Å; L3024-L3105 HydrophobicContact CD1-CG 4.28Å; L3024-L3105 HydrophobicContact CD2-CD2 4.16Å; L3024-L3105 HydrophobicContact CG-CD2 3.84Å; W3103-L3105 PolarHBondContact O-N 3.27Å; L3105-D3107 VanDerWaalsContact C-N 3.35Å; L3105-D3107 PolarHBondContact O-N 2.95Å; L3105-E3252 HydrophobicContact CD2-CB 3.98Å; L3105-Y3253 VanDerWaalsContact CD2-C 3.49Å; L3105-Y3253 WeakPolarHBondContact CD2-O 3.28Å; L3105-R3260 HydrophobicContact CD1-CB 3.11Å; L3105-R3260 HydrophobicContact CD1-CG 4.06Å
3106	E	54.8	Low	59	Low	28 Å²	28	60.1 Å²	60.1	13%	0.131	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-78.2	-12.2	172.6	-67.8	-140.8	163.2	0	0	112.7	L2998 I3000 R3037 W3103 A3104 D3108 A3109 S3254 A3255	L2998-E3106 HydrophobicContact CD2-CB 3.98Å; L2998-E3106 HydrophobicContact CD2-CG 3.99Å; I3000-E3106 HydrophobicContact CD1-CB 3.6Å; I3000-E3106 HydrophobicContact CD1-CG 3.72Å; I3000-E3106 HydrophobicContact CG1-CG 4.29Å; R3037-E3106 PolarHBondContact NH1-O 2.87Å; R3037-E3106 VanDerWaalsContact NH1-O 3.1Å; R3037-E3106 PolarHBondContact NH2-O 3.39Å; W3103-E3106 HydrophobicContact CE3-CG 4.19Å; W3103-E3106 WeakPolarHBondContact CZ3-OE1 3.47Å; W3103-E3106 PolarHBondContact O-N 3.01Å; A3104-E3106 PolarHBondContact O-N 3.15Å; A3104-E3106 VanDerWaalsContact O-N 3.11Å; E3106-D3108 VanDerWaalsContact C-N 3.26Å; E3106-D3108 PolarHBondContact O-N 3.22Å; E3106-A3109 PolarHBondContact O-N 3.07Å; E3106-S3254 VanDerWaalsContact OE1-CA 3.25Å; E3106-S3254 WeakPolarHBondContact OE1-CA 3.32Å; E3106-S3254 WeakPolarHBondContact OE1-CB 3Å; E3106-S3254 WeakPolarHBondContact OE2-CB 3.5Å; E3106-A3255 PolarHBondContact OE1-N 3.14Å
3107	D	58.4	Low	62.2	Low	40.6667 Å²	40.6667	56.4 Å²	56.4	22%	0.217	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-80.1	-4.5	-179.4	-70.6	-22.9	0	0	0	113.9	R3037 A3104 L3105 A3109 G3110 K3112	R3037-D3107 IonicContact CZ-OD1 3.39Å; R3037-D3107 IonicContact NH2-OD1 2.79Å; R3037-D3107 PolarHBondContact NH2-OD1 3.29Å; A3104-D3107 PolarHBondContact O-N 3.28Å; L3105-D3107 VanDerWaalsContact C-N 3.35Å; L3105-D3107 PolarHBondContact O-N 2.95Å; D3107-A3109 VanDerWaalsContact C-N 3.29Å; D3107-A3109 PolarHBondContact O-N 3.17Å; D3107-A3109 VanDerWaalsContact O-N 3.11Å; D3107-G3110 PolarHBondContact O-N 2.85Å; D3107-K3112 WeakPolarHBondContact OD1-CE 3.36Å; D3107-K3112 IonicContact OD1-NZ 2.84Å; D3107-K3112 PolarHBondContact OD1-NZ 3.32Å
3108	D	71.2	Confident	65.3	Low	29.3333 Å²	29.3333	51.9 Å²	51.9	16%	0.157	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-74.4	21.8	176.9	-99.8	-7.2	0	0	0	112.5	E3106 G3110 S3258 R3260 L3308	E3106-D3108 VanDerWaalsContact C-N 3.26Å; E3106-D3108 PolarHBondContact O-N 3.22Å; D3108-G3110 VanDerWaalsContact C-N 3.28Å; D3108-G3110 PolarHBondContact O-N 2.97Å; D3108-G3110 PolarHBondContact OD1-N 3.41Å; D3108-S3258 VanDerWaalsContact CG-CB 3.5Å; D3108-S3258 WeakPolarHBondContact OD1-CB 3Å; D3108-R3260 VanDerWaalsContact CG-NH2 3.33Å; D3108-R3260 IonicContact OD1-CZ 3.82Å; D3108-R3260 IonicContact OD1-NE 3.14Å; D3108-R3260 PolarHBondContact OD1-NE 3.27Å; D3108-R3260 IonicContact OD1-NH2 2.66Å; D3108-R3260 PolarHBondContact OD1-NH2 3.09Å; D3108-R3260 IonicContact OD2-CZ 2.68Å; D3108-R3260 IonicContact OD2-NE 3.18Å; D3108-R3260 IonicContact OD2-NH2 2.68Å; D3108-R3260 PolarHBondContact OD2-NH2 3.44Å; D3108-L3308 HydrophobicContact CB-CD1 3.85Å
3109	A	78.7	Confident	68.4	Low	2.66667 Å²	2.66667	48.8 Å²	48.8	2%	0.022	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-91.3	16.1	179.5	0	0	0	0	0	113.2	W3040 R3053 R3077 E3106 D3107 T3293 L3308	W3040-A3109 HydrophobicContact CH2-CB 3.97Å; W3040-A3109 HydrophobicContact CZ2-CB 3.64Å; R3053-A3109 PolarHBondContact NH2-O 2.67Å; R3077-A3109 VanDerWaalsContact CZ-O 3.28Å; R3077-A3109 PolarHBondContact NH1-O 3.02Å; R3077-A3109 PolarHBondContact NH2-O 3.26Å; E3106-A3109 PolarHBondContact O-N 3.07Å; D3107-A3109 VanDerWaalsContact C-N 3.29Å; D3107-A3109 PolarHBondContact O-N 3.17Å; D3107-A3109 VanDerWaalsContact O-N 3.11Å; A3109-T3293 CarbonylContact C-O 3.51Å; A3109-L3308 HydrophobicContact CB-CD2 3.96Å
3110	G	83.3	Confident	71.2	Confident	15 Å²	15	43.4 Å²	43.4	16%	0.155	22%	0.221	C	C	.	.	S	Bend	trans	77.3	-155.5	-175.9	0	0	0	0	0	113.6	D3107 D3108 K3112 F3291 H3292	D3107-G3110 PolarHBondContact O-N 2.85Å; D3108-G3110 VanDerWaalsContact C-N 3.28Å; D3108-G3110 PolarHBondContact O-N 2.97Å; D3108-G3110 PolarHBondContact OD1-N 3.41Å; G3110-K3112 PolarHBondContact O-N 2.97Å; G3110-F3291 CarbonylContact C-O 3.55Å; G3110-F3291 VanDerWaalsContact CA-O 3.28Å; G3110-F3291 WeakPolarHBondContact CA-O 3.23Å; G3110-H3292 CarbonylContact C-O 3.58Å; G3110-H3292 WeakPolarHBondContact CA-O 3.31Å
3111	L	82.9	Confident	74.1	Confident	29.6667 Å²	29.6667	38.6 Å²	38.6	16%	0.155	20%	0.195	C	C	.	.			trans	-63	123	-174.6	-77.4	174.8	0	0	0	113.3	R3077 R3113 Y3115 L3274 F3291 H3292	R3077-L3111 WeakPolarHBondContact CD-O 3.42Å; R3077-L3111 PolarHBondContact NH1-O 3.2Å; L3111-R3113 HydrophobicContact CB-CG 4.21Å; L3111-R3113 HydrophobicContact CD2-CG 4.31Å; L3111-R3113 PolarHBondContact O-N 3.17Å; L3111-Y3115 HydrophobicContact CB-CD1 4.3Å; L3111-L3274 HydrophobicContact CD2-CD1 3.77Å; L3111-F3291 HydrophobicContact CD1-CD2 3.73Å; L3111-F3291 HydrophobicContact CD1-CE2 3.97Å; L3111-F3291 HydrophobicContact CG-CD2 4.05Å; L3111-F3291 WeakPolarHBondContact CG-O 3.21Å; L3111-F3291 PolarHBondContact N-O 3.1Å; L3111-F3291 VanDerWaalsContact N-O 3.08Å; L3111-H3292 PolarHBondContact N-O 3.22Å
3112	K	80.5	Confident	76.9	Confident	73.3333 Å²	73.3333	34.3 Å²	34.3	32%	0.319	17%	0.172	S	C	.	.	S	Bend	trans	-80.3	46.9	175.4	-61.7	-177.6	-179.5	175.1	0	113.2	W3103 D3107 G3110	W3103-K3112 VanDerWaalsContact CE2-NZ 3.25Å; D3107-K3112 WeakPolarHBondContact OD1-CE 3.36Å; D3107-K3112 IonicContact OD1-NZ 2.84Å; D3107-K3112 PolarHBondContact OD1-NZ 3.32Å; G3110-K3112 PolarHBondContact O-N 2.97Å
3113	R	85.5	Confident	79.4	Confident	61.6667 Å²	61.6667	28.2 Å²	28.2	23%	0.233	14%	0.144	C	C	.	.	S	Bend	trans	-135.9	162.1	172.9	66	171.6	-178.3	87.4	-3.9	109.6	R3077 L3111 Y3115 D3132 I3135 D3138	R3077-R3113 VanDerWaalsContact CD-O 3.28Å; R3077-R3113 WeakPolarHBondContact CD-O 3.33Å; R3077-R3113 WeakPolarHBondContact CG-O 3.45Å; L3111-R3113 HydrophobicContact CB-CG 4.21Å; L3111-R3113 HydrophobicContact CD2-CG 4.31Å; L3111-R3113 PolarHBondContact O-N 3.17Å; R3113-Y3115 WeakPolarHBondContact O-CD1 3.3Å; R3113-Y3115 PolarHBondContact O-N 3.28Å; R3113-D3132 IonicContact CZ-OD2 3.04Å; R3113-D3132 VanDerWaalsContact CZ-OD2 3.28Å; R3113-D3132 IonicContact NH1-OD2 3.4Å; R3113-D3132 PolarHBondContact NH1-OD2 3.11Å; R3113-D3132 IonicContact NH2-OD2 3.1Å; R3113-D3132 PolarHBondContact NH2-OD2 3.1Å; R3113-I3135 VanDerWaalsContact NH1-CD1 3.3Å; R3113-D3138 IonicContact NH2-OD2 3.21Å; R3113-D3138 PolarHBondContact NH2-OD2 3.14Å
3114	S	89.8	Confident	81.7	Confident	52.6667 Å²	52.6667	23.1 Å²	23.1	37%	0.368	13%	0.126	S	C	.	.			trans	-63.1	137.6	167.1	-57.1	0	0	0	0	110.3	R3077 V3079	R3077-S3114 VanDerWaalsContact O-CA 3.24Å; R3077-S3114 WeakPolarHBondContact O-CA 3.41Å; R3077-S3114 WeakPolarHBondContact O-CB 3.34Å; R3077-S3114 PolarHBondContact O-OG 3.25Å; V3079-S3114 PolarHBondContact N-OG 3.17Å
3115	Y	92.3	Very high	83.8	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	159.6	176	60.2	-110	0	0	0	109.5	A3075 E3076 R3077 L3111 R3113 V3117 H3292 T3293	A3075-Y3115 HydrophobicContact CB-CE2 4.2Å; E3076-Y3115 WeakPolarHBondContact CA-O 3.35Å; R3077-Y3115 HydrophobicContact CB-CD1 3.66Å; R3077-Y3115 HydrophobicContact CB-CD2 4.01Å; R3077-Y3115 HydrophobicContact CB-CE1 3.36Å; R3077-Y3115 HydrophobicContact CB-CE2 3.73Å; R3077-Y3115 HydrophobicContact CB-CG 3.98Å; R3077-Y3115 VanDerWaalsContact CB-CZ 3.43Å; R3077-Y3115 HydrophobicContact CG-CD1 4.36Å; R3077-Y3115 HydrophobicContact CG-CE1 4.03Å; R3077-Y3115 PolarHBondContact N-O 2.98Å; R3077-Y3115 PolarHBondContact O-N 3.13Å; L3111-Y3115 HydrophobicContact CB-CD1 4.3Å; R3113-Y3115 WeakPolarHBondContact O-CD1 3.3Å; R3113-Y3115 PolarHBondContact O-N 3.28Å; Y3115-V3117 HydrophobicContact CD2-CB 4.43Å; Y3115-V3117 HydrophobicContact CD2-CG2 3.69Å; Y3115-V3117 HydrophobicContact CE2-CG2 4.35Å; Y3115-V3117 HydrophobicContact CG-CG2 4.18Å; Y3115-H3292 HydrophobicContact CD1-CB 4.12Å; Y3115-H3292 HydrophobicContact CD2-CB 4.29Å; Y3115-H3292 HydrophobicContact CE1-CB 4.08Å; Y3115-H3292 WeakPolarHBondContact CE1-O 3.42Å; Y3115-H3292 HydrophobicContact CE2-CB 4.27Å; Y3115-H3292 HydrophobicContact CG-CB 4.23Å; Y3115-H3292 PolarHBondContact OH-O 2.76Å; Y3115-T3293 HydrophobicContact CE2-CG2 4.13Å; Y3115-T3293 WeakPolarHBondContact OH-CA 3.32Å; Y3115-T3293 WeakPolarHBondContact OH-CG2 3.3Å
3116	S	94.5	Very high	85.8	Confident	7.66667 Å²	7.66667	22.4 Å²	22.4	5%	0.054	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	92	173.9	-132.6	0	0	0	0	108.8	W3074 A3075 D3132 T3133	W3074-S3116 WeakPolarHBondContact CH2-OG 3.47Å; W3074-S3116 WeakPolarHBondContact CZ2-OG 3.37Å; W3074-S3116 PolarHBondContact NE1-OG 3.23Å; A3075-S3116 CarbonylContact O-C 3.46Å; A3075-S3116 WeakPolarHBondContact O-CA 3.3Å; S3116-D3132 PolarHBondContact N-OD1 2.97Å; S3116-D3132 VanDerWaalsContact N-OD1 3.09Å; S3116-T3133 VanDerWaalsContact CB-OG1 3.26Å; S3116-T3133 WeakPolarHBondContact CB-OG1 3.34Å; S3116-T3133 WeakPolarHBondContact O-CB 3.37Å; S3116-T3133 PolarHBondContact O-N 2.99Å; S3116-T3133 PolarHBondContact O-OG1 3.16Å; S3116-T3133 PolarHBondContact OG-OG1 2.79Å
3117	V	93.8	Very high	87.7	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	130.6	-165.5	-178.8	0	0	0	0	110.7	W3074 A3075 Y3115 F3119 V3130 R3131 D3132 H3292	W3074-V3117 CarbonylContact C-O 3.55Å; W3074-V3117 WeakPolarHBondContact CA-O 3.16Å; A3075-V3117 PolarHBondContact N-O 3.28Å; A3075-V3117 PolarHBondContact O-N 3.28Å; Y3115-V3117 HydrophobicContact CD2-CB 4.43Å; Y3115-V3117 HydrophobicContact CD2-CG2 3.69Å; Y3115-V3117 HydrophobicContact CE2-CG2 4.35Å; Y3115-V3117 HydrophobicContact CG-CG2 4.18Å; V3117-F3119 HydrophobicContact CB-CE2 4.06Å; V3117-F3119 HydrophobicContact CB-CZ 4.35Å; V3117-F3119 HydrophobicContact CG1-CD2 4.2Å; V3117-F3119 HydrophobicContact CG1-CE1 4.26Å; V3117-F3119 HydrophobicContact CG1-CE2 3.63Å; V3117-F3119 HydrophobicContact CG1-CZ 3.66Å; V3117-V3130 HydrophobicContact CG1-CG1 3.59Å; V3117-R3131 CarbonylContact C-O 3.53Å; V3117-R3131 VanDerWaalsContact CA-O 3.29Å; V3117-R3131 WeakPolarHBondContact CA-O 3.41Å; V3117-D3132 HydrophobicContact CG2-CB 4.36Å; V3117-H3292 HydrophobicContact CG2-CB 3.79Å; V3117-H3292 VanDerWaalsContact CG2-CD2 3.49Å; V3117-H3292 WeakPolarHBondContact CG2-CD2 3.26Å; V3117-H3292 VanDerWaalsContact CG2-CG 3.49Å
3118	Q	94.2	Very high	89.5	Confident	24 Å²	24	19.3 Å²	19.3	11%	0.112	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	135.7	171.7	-169.3	178.7	23.4	0	0	110.5	W3074 I3120 V3130 R3131 T3133	W3074-Q3118 HydrophobicContact CE3-CB 3.86Å; W3074-Q3118 HydrophobicContact CE3-CG 4.17Å; W3074-Q3118 HydrophobicContact CZ3-CB 3.8Å; W3074-Q3118 HydrophobicContact CZ3-CG 4.14Å; Q3118-I3120 HydrophobicContact CG-CG1 4.22Å; Q3118-V3130 WeakPolarHBondContact O-CA 3.35Å; Q3118-R3131 HydrophobicContact CB-CG 3.91Å; Q3118-R3131 PolarHBondContact N-O 3.12Å; Q3118-R3131 PolarHBondContact O-N 3Å; Q3118-R3131 VanDerWaalsContact OE1-NH2 3.14Å; Q3118-T3133 HydrophobicContact CB-CG2 4.47Å
3119	F	95.7	Very high	90.6	Very high	4 Å²	4	18 Å²	18	2%	0.018	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	131.7	176.5	-60.6	-96.3	0	0	0	109	L3072 I3073 A3075 V3117 Y3121 L3127 I3129 V3130 D3290 T3293 F3297	L3072-F3119 HydrophobicContact CD2-CD2 4.02Å; L3072-F3119 HydrophobicContact CD2-CE1 4.4Å; L3072-F3119 HydrophobicContact CD2-CE2 3.68Å; L3072-F3119 HydrophobicContact CD2-CZ 3.92Å; L3072-F3119 HydrophobicContact CG-CD2 4Å; L3072-F3119 HydrophobicContact CG-CE2 4.11Å; L3072-F3119 WeakPolarHBondContact O-CB 3.34Å; I3073-F3119 PolarHBondContact O-N 3.23Å; A3075-F3119 HydrophobicContact CB-CE2 3.82Å; A3075-F3119 HydrophobicContact CB-CZ 4.48Å; V3117-F3119 HydrophobicContact CB-CE2 4.06Å; V3117-F3119 HydrophobicContact CB-CZ 4.35Å; V3117-F3119 HydrophobicContact CG1-CD2 4.2Å; V3117-F3119 HydrophobicContact CG1-CE1 4.26Å; V3117-F3119 HydrophobicContact CG1-CE2 3.63Å; V3117-F3119 HydrophobicContact CG1-CZ 3.66Å; F3119-Y3121 HydrophobicContact CB-CE2 4.07Å; F3119-L3127 HydrophobicContact CB-CD1 4.03Å; F3119-L3127 HydrophobicContact CD1-CD1 4.05Å; F3119-I3129 WeakPolarHBondContact CA-O 3.46Å; F3119-V3130 HydrophobicContact CD1-CG1 4.36Å; F3119-V3130 HydrophobicContact CD1-CG2 3.76Å; F3119-V3130 HydrophobicContact CE1-CG1 4.04Å; F3119-V3130 HydrophobicContact CE1-CG2 4Å; F3119-D3290 HydrophobicContact CE1-CB 4.18Å; F3119-T3293 HydrophobicContact CZ-CG2 4.4Å; F3119-F3297 HydrophobicContact CD1-CE1 4.32Å; F3119-F3297 HydrophobicContact CD1-CE2 4.42Å; F3119-F3297 AromaticContact CD1-CZ 3.79Å; F3119-F3297 HydrophobicContact CD1-CZ 3.79Å; F3119-F3297 HydrophobicContact CE1-CE1 4.48Å; F3119-F3297 AromaticContact CE1-CE2 3.93Å; F3119-F3297 HydrophobicContact CE1-CE2 3.98Å; F3119-F3297 AromaticContact CE1-CZ 3.54Å; F3119-F3297 HydrophobicContact CE1-CZ 3.54Å; F3119-F3297 HydrophobicContact CZ-CZ 4.31Å
3120	I	94.9	Very high	91.3	Very high	10.6667 Å²	10.6667	18.1 Å²	18.1	6%	0.055	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	136.7	-176.3	-53.8	176.7	0	0	0	109.3	F2786 L2808 Q3118 I3128 I3129	F2786-I3120 HydrophobicContact CD1-CG2 3.66Å; F2786-I3120 HydrophobicContact CD2-CD1 4.48Å; F2786-I3120 HydrophobicContact CD2-CG2 4.11Å; F2786-I3120 HydrophobicContact CE1-CG2 3.48Å; F2786-I3120 VanDerWaalsContact CE1-CG2 3.48Å; F2786-I3120 HydrophobicContact CE2-CG2 3.97Å; F2786-I3120 HydrophobicContact CG-CG2 3.98Å; F2786-I3120 HydrophobicContact CZ-CG2 3.67Å; L2808-I3120 HydrophobicContact CD1-CD1 3.82Å; L2808-I3120 HydrophobicContact CD2-CD1 3.35Å; L2808-I3120 HydrophobicContact CG-CD1 4.23Å; Q3118-I3120 HydrophobicContact CG-CG1 4.22Å; I3120-I3128 HydrophobicContact CB-CG1 4.49Å; I3120-I3128 HydrophobicContact CG2-CD1 4.19Å; I3120-I3128 HydrophobicContact CG2-CG1 4.23Å; I3120-I3128 VanDerWaalsContact O-CG1 3.23Å; I3120-I3128 WeakPolarHBondContact O-CG1 3.26Å; I3120-I3128 PolarHBondContact O-N 2.8Å; I3120-I3129 HydrophobicContact CB-CB 3.99Å; I3120-I3129 HydrophobicContact CB-CG1 4.42Å; I3120-I3129 HydrophobicContact CD1-CB 4.19Å; I3120-I3129 HydrophobicContact CD1-CD1 4.13Å; I3120-I3129 HydrophobicContact CD1-CG2 4.43Å; I3120-I3129 HydrophobicContact CG1-CB 4.31Å; I3120-I3129 PolarHBondContact N-O 3.01Å; I3120-I3129 PolarHBondContact O-N 3.02Å
3121	Y	95.1	Very high	91.5	Very high	11.6667 Å²	11.6667	19.6 Å²	19.6	5%	0.046	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	155.4	-177	-57.9	-96.7	0	0	0	111	L3071 L3072 I3073 F3119 R3126 L3127 F3297	L3071-Y3121 HydrophobicContact CB-CD1 4.48Å; L3071-Y3121 HydrophobicContact CB-CD2 4.03Å; L3071-Y3121 HydrophobicContact CB-CE1 4.17Å; L3071-Y3121 HydrophobicContact CB-CE2 3.68Å; L3071-Y3121 HydrophobicContact CB-CG 4.43Å; L3071-Y3121 HydrophobicContact CD1-CD1 3.89Å; L3071-Y3121 HydrophobicContact CD1-CD2 4.11Å; L3071-Y3121 HydrophobicContact CD1-CE1 4.32Å; L3071-Y3121 HydrophobicContact CD1-CG 3.78Å; L3071-Y3121 HydrophobicContact CD2-CD1 4.39Å; L3071-Y3121 HydrophobicContact CD2-CE1 4.16Å; L3071-Y3121 HydrophobicContact CG-CD1 4.47Å; L3071-Y3121 HydrophobicContact CG-CE1 4.45Å; L3072-Y3121 PolarHBondContact N-OH 3.24Å; L3072-Y3121 WeakPolarHBondContact O-CE2 3.29Å; L3072-Y3121 PolarHBondContact O-OH 3.19Å; I3073-Y3121 HydrophobicContact CG2-CE2 4.48Å; F3119-Y3121 HydrophobicContact CB-CE2 4.07Å; Y3121-R3126 CarbonylContact C-O 3.58Å; Y3121-R3126 WeakPolarHBondContact CA-O 3.38Å; Y3121-L3127 HydrophobicContact CD1-CB 4.17Å; Y3121-L3127 HydrophobicContact CD1-CD1 4.41Å; Y3121-L3127 HydrophobicContact CE1-CB 3.92Å; Y3121-L3127 HydrophobicContact CE1-CD1 3.96Å; Y3121-L3127 HydrophobicContact CE2-CD1 4.39Å; Y3121-F3297 WeakPolarHBondContact OH-CE1 3.38Å
3122	D	93.5	Very high	91.8	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.088	C	C	.	.			trans	-87.8	-174.7	172.7	69.5	12.5	0	0	0	113.2	L2788 Y2790 E3124 D3125 R3126 I3128	L2788-D3122 HydrophobicContact CD2-CB 3.58Å; Y2790-D3122 HydrophobicContact CE2-CB 4.4Å; Y2790-D3122 VanDerWaalsContact OH-CB 3.22Å; Y2790-D3122 WeakPolarHBondContact OH-CB 3.25Å; Y2790-D3122 VanDerWaalsContact OH-CG 3.3Å; Y2790-D3122 PolarHBondContact OH-OD2 2.83Å; D3122-E3124 PolarHBondContact O-N 3.1Å; D3122-E3124 VanDerWaalsContact O-N 3.15Å; D3122-E3124 VanDerWaalsContact OD1-C 3.32Å; D3122-E3124 WeakPolarHBondContact OD1-CA 3.31Å; D3122-E3124 PolarHBondContact OD1-N 2.92Å; D3122-D3125 PolarHBondContact O-N 2.99Å; D3122-D3125 PolarHBondContact OD1-N 2.84Å; D3122-D3125 VanDerWaalsContact OD1-N 3.15Å; D3122-R3126 PolarHBondContact N-O 3.19Å; D3122-R3126 WeakPolarHBondContact OD1-CB 3.49Å; D3122-R3126 PolarHBondContact OD1-N 3.08Å; D3122-R3126 IonicContact OD1-NE 3.16Å; D3122-R3126 IonicContact OD2-CZ 2.91Å; D3122-R3126 IonicContact OD2-NE 3.38Å; D3122-R3126 PolarHBondContact OD2-NE 3.27Å; D3122-R3126 IonicContact OD2-NH2 3.79Å; D3122-R3126 PolarHBondContact OD2-NH2 2.83Å; D3122-I3128 HydrophobicContact CB-CD1 4.19Å; D3122-I3128 HydrophobicContact CB-CG2 3.93Å
3123	S	90.1	Very high	92.2	Very high	4.33333 Å²	4.33333	17.1 Å²	17.1	3%	0.03	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-14.9	178.8	60.4	0	0	0	0	114.4	I2771 Y2790	I2771-S3123 VanDerWaalsContact CD1-O 3.28Å; I2771-S3123 WeakPolarHBondContact CD1-O 3.21Å; Y2790-S3123 WeakPolarHBondContact CE2-OG 3.17Å
3124	E	87.8	Confident	92.2	Very high	27.6667 Å²	27.6667	19 Å²	19	13%	0.129	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	11.9	-178.6	-60.6	178.2	-168.3	0	0	111.9	L2772 R2792 D3122 R3126 N3400	L2772-E3124 HydrophobicContact CD2-CB 4.38Å; L2772-E3124 HydrophobicContact CD2-CG 3.62Å; L2772-E3124 WeakPolarHBondContact CD2-OE1 3.43Å; L2772-E3124 WeakPolarHBondContact CD2-OE2 3.05Å; R2792-E3124 IonicContact NH2-OE1 3.05Å; R2792-E3124 PolarHBondContact NH2-OE1 2.92Å; D3122-E3124 PolarHBondContact O-N 3.1Å; D3122-E3124 VanDerWaalsContact O-N 3.15Å; D3122-E3124 VanDerWaalsContact OD1-C 3.32Å; D3122-E3124 WeakPolarHBondContact OD1-CA 3.31Å; D3122-E3124 PolarHBondContact OD1-N 2.92Å; E3124-R3126 VanDerWaalsContact C-N 3.28Å; E3124-R3126 HydrophobicContact CB-CG 4.24Å; E3124-R3126 PolarHBondContact O-N 3.04Å; E3124-R3126 IonicContact OE1-NH2 3.72Å; E3124-R3126 IonicContact OE2-CZ 3.63Å; E3124-R3126 VanDerWaalsContact OE2-CZ 3.27Å; E3124-R3126 IonicContact OE2-NE 3.53Å; E3124-R3126 PolarHBondContact OE2-NE 2.92Å; E3124-R3126 IonicContact OE2-NH1 3.05Å; E3124-R3126 PolarHBondContact OE2-NH1 3.04Å; E3124-R3126 IonicContact OE2-NH2 3.74Å; E3124-R3126 PolarHBondContact OE2-NH2 2.96Å; E3124-N3400 PolarHBondContact O-ND2 2.99Å
3125	D	91.8	Very high	91.8	Very high	33.3333 Å²	33.3333	19.9 Å²	19.9	18%	0.178	10%	0.101	C	C	.	.	S	Bend	trans	64.9	25.8	-179.8	-57.9	-34.8	0	0	0	114.1	K3069 L3071 D3122 S3302	K3069-D3125 WeakPolarHBondContact CD-OD1 3.38Å; K3069-D3125 IonicContact NZ-OD1 3.01Å; K3069-D3125 PolarHBondContact NZ-OD1 2.89Å; K3069-D3125 IonicContact NZ-OD2 3.13Å; K3069-D3125 PolarHBondContact NZ-OD2 3.03Å; L3071-D3125 HydrophobicContact CD1-CB 3.88Å; D3122-D3125 PolarHBondContact O-N 2.99Å; D3122-D3125 PolarHBondContact OD1-N 2.84Å; D3122-D3125 VanDerWaalsContact OD1-N 3.15Å; D3125-S3302 VanDerWaalsContact O-CB 3.28Å; D3125-S3302 WeakPolarHBondContact O-CB 3.45Å; D3125-S3302 PolarHBondContact O-OG 2.9Å
3126	R	93	Very high	90.9	Very high	13.6667 Å²	13.6667	23.4 Å²	23.4	5%	0.052	12%	0.122	C	C	.	.			trans	-92.8	138.6	175.5	-51.5	178.1	-61.4	-156.6	-8.2	110.7	Y2790 Y3121 D3122 E3124 I3128 Y3144 P3150	Y2790-R3126 PolarHBondContact OH-NH2 2.79Å; Y3121-R3126 CarbonylContact C-O 3.58Å; Y3121-R3126 WeakPolarHBondContact CA-O 3.38Å; D3122-R3126 PolarHBondContact N-O 3.19Å; D3122-R3126 WeakPolarHBondContact OD1-CB 3.49Å; D3122-R3126 PolarHBondContact OD1-N 3.08Å; D3122-R3126 IonicContact OD1-NE 3.16Å; D3122-R3126 IonicContact OD2-CZ 2.91Å; D3122-R3126 IonicContact OD2-NE 3.38Å; D3122-R3126 PolarHBondContact OD2-NE 3.27Å; D3122-R3126 IonicContact OD2-NH2 3.79Å; D3122-R3126 PolarHBondContact OD2-NH2 2.83Å; E3124-R3126 VanDerWaalsContact C-N 3.28Å; E3124-R3126 HydrophobicContact CB-CG 4.24Å; E3124-R3126 PolarHBondContact O-N 3.04Å; E3124-R3126 IonicContact OE1-NH2 3.72Å; E3124-R3126 IonicContact OE2-CZ 3.63Å; E3124-R3126 VanDerWaalsContact OE2-CZ 3.27Å; E3124-R3126 IonicContact OE2-NE 3.53Å; E3124-R3126 PolarHBondContact OE2-NE 2.92Å; E3124-R3126 IonicContact OE2-NH1 3.05Å; E3124-R3126 PolarHBondContact OE2-NH1 3.04Å; E3124-R3126 IonicContact OE2-NH2 3.74Å; E3124-R3126 PolarHBondContact OE2-NH2 2.96Å; R3126-I3128 PolarHBondContact O-N 2.93Å; R3126-Y3144 HydrophobicContact CB-CD2 4.17Å; R3126-Y3144 HydrophobicContact CB-CE1 4.35Å; R3126-Y3144 HydrophobicContact CB-CE2 3.63Å; R3126-Y3144 HydrophobicContact CG-CE2 4.44Å; R3126-Y3144 VanDerWaalsContact NH1-CB 3.32Å; R3126-P3150 WeakPolarHBondContact CD-O 3.33Å; R3126-P3150 PolarHBondContact NH1-O 2.96Å
3127	L	95.6	Very high	89.9	Confident	0.333333 Å²	0.333333	30.5 Å²	30.5	0%	0.002	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	115.7	178.2	-179.3	65.8	0	0	0	110.1	F3119 Y3121 V3130 Y3142 Y3144 I3288 F3297	F3119-L3127 HydrophobicContact CB-CD1 4.03Å; F3119-L3127 HydrophobicContact CD1-CD1 4.05Å; Y3121-L3127 HydrophobicContact CD1-CB 4.17Å; Y3121-L3127 HydrophobicContact CD1-CD1 4.41Å; Y3121-L3127 HydrophobicContact CE1-CB 3.92Å; Y3121-L3127 HydrophobicContact CE1-CD1 3.96Å; Y3121-L3127 HydrophobicContact CE2-CD1 4.39Å; L3127-V3130 HydrophobicContact CD1-CG2 4.01Å; L3127-V3130 HydrophobicContact CD2-CG2 3.75Å; L3127-V3130 HydrophobicContact CG-CG2 4.11Å; L3127-Y3142 HydrophobicContact CD2-CE2 4.29Å; L3127-Y3142 HydrophobicContact CG-CD2 4.37Å; L3127-Y3142 HydrophobicContact CG-CE2 4.38Å; L3127-Y3142 WeakPolarHBondContact O-CB 3.25Å; L3127-Y3144 PolarHBondContact O-OH 2.97Å; L3127-I3288 HydrophobicContact CD2-CD1 4.47Å; L3127-I3288 HydrophobicContact CD2-CG2 4.32Å; L3127-F3297 HydrophobicContact CD2-CB 4.38Å; L3127-F3297 HydrophobicContact CD2-CD1 4.19Å; L3127-F3297 HydrophobicContact CD2-CD2 4.08Å; L3127-F3297 HydrophobicContact CD2-CE1 4.47Å; L3127-F3297 HydrophobicContact CD2-CE2 4.4Å; L3127-F3297 HydrophobicContact CD2-CG 3.98Å
3128	I	95.4	Very high	89.4	Confident	4 Å²	4	32.4 Å²	32.4	2%	0.021	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	-24	-176.5	53.4	164.5	0	0	0	113.7	F2786 I3120 D3122 R3126 Q3141 Y3142 Y3144	F2786-I3128 HydrophobicContact CE1-CD1 4.2Å; F2786-I3128 HydrophobicContact CZ-CD1 3.61Å; I3120-I3128 HydrophobicContact CB-CG1 4.49Å; I3120-I3128 HydrophobicContact CG2-CD1 4.19Å; I3120-I3128 HydrophobicContact CG2-CG1 4.23Å; I3120-I3128 VanDerWaalsContact O-CG1 3.23Å; I3120-I3128 WeakPolarHBondContact O-CG1 3.26Å; I3120-I3128 PolarHBondContact O-N 2.8Å; D3122-I3128 HydrophobicContact CB-CD1 4.19Å; D3122-I3128 HydrophobicContact CB-CG2 3.93Å; R3126-I3128 PolarHBondContact O-N 2.93Å; I3128-Q3141 CarbonylContact O-C 3.52Å; I3128-Q3141 VanDerWaalsContact O-CA 3.28Å; I3128-Q3141 WeakPolarHBondContact O-CA 3.41Å; I3128-Y3142 PolarHBondContact O-N 2.89Å; I3128-Y3144 HydrophobicContact CG2-CD2 4.48Å; I3128-Y3144 HydrophobicContact CG2-CE2 4.1Å
3129	I	93.5	Very high	89	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.005	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	134.4	177.7	-48.7	178.3	0	0	0	110.2	F2786 L2808 I2821 F3119 I3120 R3131 V3140 Q3141	F2786-I3129 HydrophobicContact CE2-CD1 4.47Å; L2808-I3129 HydrophobicContact CD2-CD1 4.4Å; I2821-I3129 HydrophobicContact CD1-CD1 3.5Å; I2821-I3129 VanDerWaalsContact CD1-CD1 3.44Å; I2821-I3129 HydrophobicContact CG1-CD1 4.32Å; I2821-I3129 HydrophobicContact CG2-CD1 4.38Å; F3119-I3129 WeakPolarHBondContact CA-O 3.46Å; I3120-I3129 HydrophobicContact CB-CB 3.99Å; I3120-I3129 HydrophobicContact CB-CG1 4.42Å; I3120-I3129 HydrophobicContact CD1-CB 4.19Å; I3120-I3129 HydrophobicContact CD1-CD1 4.13Å; I3120-I3129 HydrophobicContact CD1-CG2 4.43Å; I3120-I3129 HydrophobicContact CG1-CB 4.31Å; I3120-I3129 PolarHBondContact N-O 3.01Å; I3120-I3129 PolarHBondContact O-N 3.02Å; I3129-R3131 HydrophobicContact CG2-CB 4.44Å; I3129-R3131 HydrophobicContact CG2-CG 4.42Å; I3129-V3140 WeakPolarHBondContact CA-O 3.37Å; I3129-Q3141 HydrophobicContact CD1-CG 4.36Å; I3129-Q3141 HydrophobicContact CG1-CG 4.02Å
3130	V	93.3	Very high	88.8	Confident	6 Å²	6	32.5 Å²	32.5	4%	0.036	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	125.2	164.1	178.7	0	0	0	0	107.2	V3117 Q3118 F3119 L3127 S3139 V3140 Y3142	V3117-V3130 HydrophobicContact CG1-CG1 3.59Å; Q3118-V3130 WeakPolarHBondContact O-CA 3.35Å; F3119-V3130 HydrophobicContact CD1-CG1 4.36Å; F3119-V3130 HydrophobicContact CD1-CG2 3.76Å; F3119-V3130 HydrophobicContact CE1-CG1 4.04Å; F3119-V3130 HydrophobicContact CE1-CG2 4Å; L3127-V3130 HydrophobicContact CD1-CG2 4.01Å; L3127-V3130 HydrophobicContact CD2-CG2 3.75Å; L3127-V3130 HydrophobicContact CG-CG2 4.11Å; V3130-S3139 CarbonylContact O-C 3.49Å; V3130-S3139 VanDerWaalsContact O-CA 3.32Å; V3130-S3139 WeakPolarHBondContact O-CA 3.31Å; V3130-V3140 PolarHBondContact N-O 2.93Å; V3130-V3140 PolarHBondContact O-N 2.99Å; V3130-Y3142 HydrophobicContact CG2-CE2 3.95Å
3131	R	89.2	Confident	88.7	Confident	45.3333 Å²	45.3333	32 Å²	32	17%	0.171	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	132.6	179.5	65.9	174.9	-133.7	177	3.1	112.6	V2811 V3117 Q3118 I3129 D3138 S3139	V2811-R3131 VanDerWaalsContact CG2-NH1 3.34Å; V3117-R3131 CarbonylContact C-O 3.53Å; V3117-R3131 VanDerWaalsContact CA-O 3.29Å; V3117-R3131 WeakPolarHBondContact CA-O 3.41Å; Q3118-R3131 HydrophobicContact CB-CG 3.91Å; Q3118-R3131 PolarHBondContact N-O 3.12Å; Q3118-R3131 PolarHBondContact O-N 3Å; Q3118-R3131 VanDerWaalsContact OE1-NH2 3.14Å; I3129-R3131 HydrophobicContact CG2-CB 4.44Å; I3129-R3131 HydrophobicContact CG2-CG 4.42Å; R3131-D3138 CarbonylContact C-O 3.57Å; R3131-D3138 WeakPolarHBondContact CA-O 3.41Å; R3131-S3139 WeakPolarHBondContact CB-OG 3.2Å
3132	D	89.2	Confident	88.7	Confident	2 Å²	2	31.8 Å²	31.8	1%	0.011	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	121.5	167.4	-167.7	-10.1	0	0	0	109.2	R3113 S3116 V3117 L3134 I3135 D3138	R3113-D3132 IonicContact CZ-OD2 3.04Å; R3113-D3132 VanDerWaalsContact CZ-OD2 3.28Å; R3113-D3132 IonicContact NH1-OD2 3.4Å; R3113-D3132 PolarHBondContact NH1-OD2 3.11Å; R3113-D3132 IonicContact NH2-OD2 3.1Å; R3113-D3132 PolarHBondContact NH2-OD2 3.1Å; S3116-D3132 PolarHBondContact N-OD1 2.97Å; S3116-D3132 VanDerWaalsContact N-OD1 3.09Å; V3117-D3132 HydrophobicContact CG2-CB 4.36Å; D3132-L3134 VanDerWaalsContact C-N 3.33Å; D3132-L3134 WeakPolarHBondContact OD1-CB 3.26Å; D3132-L3134 PolarHBondContact OD1-N 3.01Å; D3132-I3135 HydrophobicContact CB-CB 4.43Å; D3132-I3135 CarbonylContact O-C 3.49Å; D3132-I3135 VanDerWaalsContact O-C 3.3Å; D3132-I3135 VanDerWaalsContact O-O 3.09Å; D3132-I3135 PolarHBondContact OD1-N 2.85Å; D3132-D3138 HydrophobicContact CB-CB 3.96Å; D3132-D3138 PolarHBondContact N-O 2.9Å
3133	T	87.3	Confident	88.9	Confident	50 Å²	50	32.1 Å²	32.1	31%	0.307	16%	0.159	S	C	.	.	S	Bend	trans	-80.4	-16.1	178.1	62.7	0	0	0	0	112.6	W3074 S3116 Q3118	W3074-T3133 HydrophobicContact CH2-CG2 3.79Å; W3074-T3133 WeakPolarHBondContact CH2-OG1 3.3Å; W3074-T3133 HydrophobicContact CZ3-CG2 3.89Å; S3116-T3133 VanDerWaalsContact CB-OG1 3.26Å; S3116-T3133 WeakPolarHBondContact CB-OG1 3.34Å; S3116-T3133 WeakPolarHBondContact O-CB 3.37Å; S3116-T3133 PolarHBondContact O-N 2.99Å; S3116-T3133 PolarHBondContact O-OG1 3.16Å; S3116-T3133 PolarHBondContact OG-OG1 2.79Å; Q3118-T3133 HydrophobicContact CB-CG2 4.47Å
3134	L	86.2	Confident	89.1	Confident	100.333 Å²	100.333	32.5 Å²	32.5	53%	0.525	16%	0.16	S	C	.	.	S	Bend	trans	-83.6	-35.7	171.9	-57.7	-174.5	0	0	0	111.9	D3132	D3132-L3134 VanDerWaalsContact C-N 3.33Å; D3132-L3134 WeakPolarHBondContact OD1-CB 3.26Å; D3132-L3134 PolarHBondContact OD1-N 3.01Å
3135	I	82.2	Confident	89.5	Confident	71.6667 Å²	71.6667	31.2 Å²	31.2	37%	0.368	15%	0.154	S	C	.	.	S	Bend	trans	-116.5	89.7	176.9	-53.5	-169	0	0	0	108.7	R3113 D3132 R3137 D3138	R3113-I3135 VanDerWaalsContact NH1-CD1 3.3Å; D3132-I3135 HydrophobicContact CB-CB 4.43Å; D3132-I3135 CarbonylContact O-C 3.49Å; D3132-I3135 VanDerWaalsContact O-C 3.3Å; D3132-I3135 VanDerWaalsContact O-O 3.09Å; D3132-I3135 PolarHBondContact OD1-N 2.85Å; I3135-R3137 PolarHBondContact O-N 2.81Å; I3135-D3138 HydrophobicContact CB-CB 4.16Å; I3135-D3138 HydrophobicContact CG2-CB 4.08Å; I3135-D3138 WeakPolarHBondContact O-CA 3.27Å; I3135-D3138 VanDerWaalsContact O-CB 3.26Å; I3135-D3138 WeakPolarHBondContact O-CB 3.36Å; I3135-D3138 PolarHBondContact O-N 3.03Å
3136	V	71.8	Confident	89.5	Confident	73.6667 Å²	73.6667	30.9 Å²	30.9	45%	0.446	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-26.2	-171.2	-171.1	0	0	0	0	114.4	A2814 D3138	A2814-V3136 HydrophobicContact CB-CB 4.42Å; A2814-V3136 HydrophobicContact CB-CG1 3.22Å; A2814-V3136 VanDerWaalsContact CB-CG1 3.42Å; A2814-V3136 VanDerWaalsContact O-CG1 3.28Å; A2814-V3136 WeakPolarHBondContact O-CG1 3.3Å; V3136-D3138 VanDerWaalsContact C-N 3.33Å
3137	R	74.5	Confident	89.2	Confident	157.667 Å²	157.667	32.6 Å²	32.6	60%	0.595	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-17.2	175.8	-66.6	-172.6	179.6	-175.5	-0.3	113.3	I3135 S3139 G3160	I3135-R3137 PolarHBondContact O-N 2.81Å; R3137-S3139 PolarHBondContact O-N 3.08Å; R3137-S3139 VanDerWaalsContact O-N 3.12Å; R3137-G3160 WeakPolarHBondContact O-CA 3.35Å; R3137-G3160 PolarHBondContact O-N 2.81Å; R3137-G3160 VanDerWaalsContact O-N 3.09Å
3138	D	82.8	Confident	88.6	Confident	39 Å²	39	35.9 Å²	35.9	21%	0.209	18%	0.179	C	C	.	.			trans	-86.6	81.3	-178.5	-161.1	-8.8	0	0	0	109.4	R3113 R3131 D3132 I3135 V3136 F3291 H3292	R3113-D3138 IonicContact NH2-OD2 3.21Å; R3113-D3138 PolarHBondContact NH2-OD2 3.14Å; R3131-D3138 CarbonylContact C-O 3.57Å; R3131-D3138 WeakPolarHBondContact CA-O 3.41Å; D3132-D3138 HydrophobicContact CB-CB 3.96Å; D3132-D3138 PolarHBondContact N-O 2.9Å; I3135-D3138 HydrophobicContact CB-CB 4.16Å; I3135-D3138 HydrophobicContact CG2-CB 4.08Å; I3135-D3138 WeakPolarHBondContact O-CA 3.27Å; I3135-D3138 VanDerWaalsContact O-CB 3.26Å; I3135-D3138 WeakPolarHBondContact O-CB 3.36Å; I3135-D3138 PolarHBondContact O-N 3.03Å; V3136-D3138 VanDerWaalsContact C-N 3.33Å; D3138-F3291 VanDerWaalsContact OD1-CZ 3.31Å; D3138-F3291 WeakPolarHBondContact OD1-CZ 3.32Å; D3138-H3292 IonicContact OD1-CE1 3.2Å; D3138-H3292 IonicContact OD1-NE2 2.72Å; D3138-H3292 IonicContact OD2-CE1 2.95Å; D3138-H3292 IonicContact OD2-NE2 2.96Å; D3138-H3292 PolarHBondContact OD2-NE2 2.91Å; D3138-H3292 VanDerWaalsContact OD2-NE2 3.12Å
3139	S	86.7	Confident	88.2	Confident	10.3333 Å²	10.3333	39.2 Å²	39.2	7%	0.072	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	134.4	-179.8	179.8	0	0	0	0	110.9	V3130 R3131 R3137 H3159	V3130-S3139 CarbonylContact O-C 3.49Å; V3130-S3139 VanDerWaalsContact O-CA 3.32Å; V3130-S3139 WeakPolarHBondContact O-CA 3.31Å; R3131-S3139 WeakPolarHBondContact CB-OG 3.2Å; R3137-S3139 PolarHBondContact O-N 3.08Å; R3137-S3139 VanDerWaalsContact O-N 3.12Å; S3139-H3159 WeakPolarHBondContact O-CB 3.4Å; S3139-H3159 PolarHBondContact O-CD2 3.19Å; S3139-H3159 PolarHBondContact O-N 2.99Å
3140	V	90.6	Very high	87.8	Confident	19 Å²	19	41 Å²	41	12%	0.115	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	136.7	-178.4	-177.9	0	0	0	0	109.7	I3129 V3130 Y3142 I3156 F3157	I3129-V3140 WeakPolarHBondContact CA-O 3.37Å; V3130-V3140 PolarHBondContact N-O 2.93Å; V3130-V3140 PolarHBondContact O-N 2.99Å; V3140-Y3142 HydrophobicContact CB-CE2 4.48Å; V3140-Y3142 HydrophobicContact CG1-CE1 4.12Å; V3140-Y3142 HydrophobicContact CG1-CE2 4.06Å; V3140-I3156 HydrophobicContact CG1-CG2 3.48Å; V3140-I3156 VanDerWaalsContact CG1-CG2 3.47Å; V3140-F3157 CarbonylContact C-O 3.54Å; V3140-F3157 VanDerWaalsContact CA-O 3.32Å; V3140-F3157 WeakPolarHBondContact CA-O 3.33Å
3141	Q	93.4	Very high	87.5	Confident	1.66667 Å²	1.66667	42.9 Å²	42.9	1%	0.008	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	141.8	172.9	-71.6	-174	-29	0	0	111.5	I2821 L2822 I3128 I3129 F3143 I3156 F3157 H3159	I2821-Q3141 VanDerWaalsContact CG2-NE2 3.29Å; L2822-Q3141 VanDerWaalsContact CB-OE1 3.3Å; L2822-Q3141 VanDerWaalsContact N-OE1 3.15Å; I3128-Q3141 CarbonylContact O-C 3.52Å; I3128-Q3141 VanDerWaalsContact O-CA 3.28Å; I3128-Q3141 WeakPolarHBondContact O-CA 3.41Å; I3129-Q3141 HydrophobicContact CD1-CG 4.36Å; I3129-Q3141 HydrophobicContact CG1-CG 4.02Å; Q3141-F3143 HydrophobicContact CB-CE2 3.92Å; Q3141-F3143 HydrophobicContact CB-CZ 4.11Å; Q3141-I3156 CarbonylContact O-C 3.51Å; Q3141-I3156 VanDerWaalsContact O-CA 3.27Å; Q3141-I3156 WeakPolarHBondContact O-CA 3.44Å; Q3141-F3157 HydrophobicContact CB-CB 4.31Å; Q3141-F3157 PolarHBondContact N-O 3.17Å; Q3141-F3157 PolarHBondContact O-N 3.32Å; Q3141-H3159 VanDerWaalsContact CD-NE2 3.32Å; Q3141-H3159 VanDerWaalsContact CG-NE2 3.29Å; Q3141-H3159 WeakPolarHBondContact CG-NE2 3.45Å; Q3141-H3159 PolarHBondContact NE2-NE2 2.7Å; Q3141-H3159 VanDerWaalsContact NE2-NE2 3.19Å; Q3141-H3159 PolarHBondContact OE1-NE2 2.87Å
3142	Y	95.8	Very high	87.6	Confident	7.33333 Å²	7.33333	43.3 Å²	43.3	3%	0.029	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	138.7	177.7	-54.4	-87.8	0	0	0	110.2	L3127 I3128 V3130 V3140 V3153 I3156 P3281 I3288	L3127-Y3142 HydrophobicContact CD2-CE2 4.29Å; L3127-Y3142 HydrophobicContact CG-CD2 4.37Å; L3127-Y3142 HydrophobicContact CG-CE2 4.38Å; L3127-Y3142 WeakPolarHBondContact O-CB 3.25Å; I3128-Y3142 PolarHBondContact O-N 2.89Å; V3130-Y3142 HydrophobicContact CG2-CE2 3.95Å; V3140-Y3142 HydrophobicContact CB-CE2 4.48Å; V3140-Y3142 HydrophobicContact CG1-CE1 4.12Å; V3140-Y3142 HydrophobicContact CG1-CE2 4.06Å; Y3142-V3153 HydrophobicContact CD1-CG1 4.11Å; Y3142-V3153 HydrophobicContact CD1-CG2 4.31Å; Y3142-I3156 HydrophobicContact CD1-CG1 3.91Å; Y3142-I3156 HydrophobicContact CD1-CG2 4.44Å; Y3142-I3156 HydrophobicContact CE1-CG1 4.26Å; Y3142-I3156 HydrophobicContact CE1-CG2 4.36Å; Y3142-P3281 HydrophobicContact CE1-CB 4.32Å; Y3142-P3281 HydrophobicContact CE1-CG 3.88Å; Y3142-I3288 HydrophobicContact CD1-CD1 4.07Å; Y3142-I3288 HydrophobicContact CE1-CD1 4.19Å; Y3142-I3288 HydrophobicContact CE1-CG1 4.39Å; Y3142-I3288 HydrophobicContact CE1-CG2 3.87Å; Y3142-I3288 HydrophobicContact CE2-CG2 4.42Å; Y3142-I3288 HydrophobicContact CG-CD1 4.31Å; Y3142-I3288 WeakPolarHBondContact OH-CG2 3.29Å
3143	F	96.8	Very high	87.8	Confident	5 Å²	5	43.6 Å²	43.6	2%	0.022	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	143.8	177.8	-55.4	-90.3	0	0	0	111.9	L2822 A2824 F2826 L2843 Q3141 T3154 H3155 F3157	L2822-F3143 HydrophobicContact CB-CZ 4.1Å; A2824-F3143 HydrophobicContact CB-CD1 3.8Å; A2824-F3143 HydrophobicContact CB-CE1 3.81Å; F2826-F3143 HydrophobicContact CZ-CB 4.01Å; F2826-F3143 HydrophobicContact CZ-CD1 4.49Å; F2826-F3143 HydrophobicContact CZ-CG 4.48Å; L2843-F3143 HydrophobicContact CD1-CD2 4.49Å; L2843-F3143 HydrophobicContact CD1-CE2 4.21Å; L2843-F3143 HydrophobicContact CD2-CD1 4.31Å; L2843-F3143 HydrophobicContact CD2-CD2 4.4Å; L2843-F3143 HydrophobicContact CD2-CE1 4.15Å; L2843-F3143 HydrophobicContact CD2-CE2 4.24Å; L2843-F3143 HydrophobicContact CD2-CG 4.45Å; L2843-F3143 HydrophobicContact CD2-CZ 4.12Å; Q3141-F3143 HydrophobicContact CB-CE2 3.92Å; Q3141-F3143 HydrophobicContact CB-CZ 4.11Å; F3143-T3154 PolarHBondContact O-N 2.99Å; F3143-T3154 PolarHBondContact O-OG1 2.95Å; F3143-H3155 HydrophobicContact CB-CB 4.13Å; F3143-H3155 HydrophobicContact CD2-CB 4.16Å; F3143-H3155 PolarHBondContact N-O 3.03Å; F3143-H3155 PolarHBondContact O-N 3.23Å; F3143-F3157 HydrophobicContact CE2-CB 4.18Å
3144	Y	95	Very high	88.2	Confident	13.6667 Å²	13.6667	41.8 Å²	41.8	5%	0.054	21%	0.21	C	C	.	.			trans	-121	86.6	-173.6	-58.1	-91.3	0	0	0	109.4	R3126 L3127 I3128 T3151 R3152 V3153	R3126-Y3144 HydrophobicContact CB-CD2 4.17Å; R3126-Y3144 HydrophobicContact CB-CE1 4.35Å; R3126-Y3144 HydrophobicContact CB-CE2 3.63Å; R3126-Y3144 HydrophobicContact CG-CE2 4.44Å; R3126-Y3144 VanDerWaalsContact NH1-CB 3.32Å; L3127-Y3144 PolarHBondContact O-OH 2.97Å; I3128-Y3144 HydrophobicContact CG2-CD2 4.48Å; I3128-Y3144 HydrophobicContact CG2-CE2 4.1Å; Y3144-T3151 WeakPolarHBondContact CE1-O 3.34Å; Y3144-R3152 VanDerWaalsContact CD1-C 3.47Å; Y3144-R3152 VanDerWaalsContact CD1-O 3.3Å; Y3144-R3152 WeakPolarHBondContact CD1-O 3.38Å; Y3144-V3153 HydrophobicContact CD1-CG2 4.42Å; Y3144-V3153 HydrophobicContact CE1-CB 4.39Å; Y3144-V3153 HydrophobicContact CE1-CG2 3.6Å
3145	A	95.1	Very high	88.7	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.008	19%	0.186	C	C	.	.			trans	-87.8	-26.3	-172.7	0	0	0	0	0	113.4	F2826 Y2828 I2839 P3147 T3154	F2826-A3145 HydrophobicContact CD1-CB 3.53Å; F2826-A3145 HydrophobicContact CD2-CB 4.37Å; F2826-A3145 HydrophobicContact CE1-CB 3.42Å; F2826-A3145 VanDerWaalsContact CE1-CB 3.42Å; F2826-A3145 HydrophobicContact CE2-CB 4.28Å; F2826-A3145 HydrophobicContact CG-CB 4.02Å; F2826-A3145 HydrophobicContact CZ-CB 3.84Å; Y2828-A3145 WeakPolarHBondContact CE1-O 3.3Å; Y2828-A3145 VanDerWaalsContact CZ-O 3.32Å; Y2828-A3145 PolarHBondContact OH-O 2.87Å; I2839-A3145 HydrophobicContact CG2-CB 4.31Å; A3145-P3147 WeakPolarHBondContact O-CD 3.26Å; A3145-T3154 HydrophobicContact CB-CG2 4.04Å; A3145-T3154 VanDerWaalsContact CB-OG1 3.23Å; A3145-T3154 WeakPolarHBondContact CB-OG1 3.43Å; A3145-T3154 PolarHBondContact N-OG1 3.01Å
3146	D	91.7	Very high	89.3	Confident	26.3333 Å²	26.3333	34.1 Å²	34.1	14%	0.141	17%	0.17	C	C	.	.			trans	-82.3	108.7	-172.8	-178	1.1	0	0	0	111.8	K3148 H3149 T3154	D3146-K3148 VanDerWaalsContact C-N 3.26Å; D3146-K3148 PolarHBondContact O-N 3.11Å; D3146-K3148 WeakPolarHBondContact OD1-CB 3.4Å; D3146-K3148 PolarHBondContact OD1-N 3.04Å; D3146-H3149 CarbonylContact O-C 3.53Å; D3146-H3149 PolarHBondContact O-N 3Å; D3146-H3149 IonicContact OD2-CE1 3.01Å; D3146-H3149 IonicContact OD2-CG 3.04Å; D3146-H3149 IonicContact OD2-ND1 3.47Å; D3146-H3149 PolarHBondContact OD2-ND1 3.04Å; D3146-T3154 HydrophobicContact CB-CG2 3.99Å
3147	P	87.1	Confident	90.3	Very high	49 Å²	49	30.7 Å²	30.7	32%	0.318	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-20.2	179.3	30.3	-36.3	0	0	0	113.3	L2799 Y2828 L2836 A3145 H3149	L2799-P3147 HydrophobicContact CD2-CB 4.42Å; Y2828-P3147 HydrophobicContact CD1-CG 4.38Å; Y2828-P3147 HydrophobicContact CE1-CG 4.11Å; L2836-P3147 HydrophobicContact CD2-CG 3.88Å; A3145-P3147 WeakPolarHBondContact O-CD 3.26Å; P3147-H3149 VanDerWaalsContact C-N 3.33Å
3148	K	82.7	Confident	90.9	Very high	70.6667 Å²	70.6667	23.9 Å²	23.9	31%	0.307	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-25.1	175.3	-64.9	-170.6	173.3	-175.4	0	111.8	D3146 N3379 S3393	D3146-K3148 VanDerWaalsContact C-N 3.26Å; D3146-K3148 PolarHBondContact O-N 3.11Å; D3146-K3148 WeakPolarHBondContact OD1-CB 3.4Å; D3146-K3148 PolarHBondContact OD1-N 3.04Å; K3148-N3379 PolarHBondContact NZ-OD1 3.04Å; K3148-S3393 WeakPolarHBondContact CG-OG 3.46Å
3149	H	86.6	Confident	91	Very high	73.3333 Å²	73.3333	22.7 Å²	22.7	34%	0.34	12%	0.118	S	C	.	.	S	Bend	trans	-132.5	72.5	179.2	-54.4	96.4	0	0	0	110.4	D3146 P3147 T3151 R3152	D3146-H3149 CarbonylContact O-C 3.53Å; D3146-H3149 PolarHBondContact O-N 3Å; D3146-H3149 IonicContact OD2-CE1 3.01Å; D3146-H3149 IonicContact OD2-CG 3.04Å; D3146-H3149 IonicContact OD2-ND1 3.47Å; D3146-H3149 PolarHBondContact OD2-ND1 3.04Å; P3147-H3149 VanDerWaalsContact C-N 3.33Å; H3149-T3151 PolarHBondContact O-N 2.75Å; H3149-R3152 HydrophobicContact CB-CB 3.78Å; H3149-R3152 PolarHBondContact CD2-NH2 2.98Å; H3149-R3152 PolarHBondContact CE1-NH1 2.87Å; H3149-R3152 PolarHBondContact ND1-NH1 3.07Å; H3149-R3152 VanDerWaalsContact O-CB 3.28Å; H3149-R3152 WeakPolarHBondContact O-CB 3.37Å; H3149-R3152 PolarHBondContact O-N 3.12Å
3150	P	86	Confident	90.6	Very high	38 Å²	38	23.7 Å²	23.7	25%	0.247	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-16.9	-166.9	26.1	-36.9	0	0	0	115	R3126 L3398	R3126-P3150 WeakPolarHBondContact CD-O 3.33Å; R3126-P3150 PolarHBondContact NH1-O 2.96Å; P3150-L3398 HydrophobicContact CB-CD1 3.78Å; P3150-L3398 HydrophobicContact CB-CG 4.26Å; P3150-L3398 HydrophobicContact CG-CD1 3.63Å; P3150-L3398 HydrophobicContact CG-CD2 4.29Å; P3150-L3398 HydrophobicContact CG-CG 3.7Å
3151	T	87.7	Confident	90.1	Very high	46.3333 Å²	46.3333	25.8 Å²	25.8	28%	0.284	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-0.4	176.8	57.9	0	0	0	0	113.8	Y3144 H3149 P3299 L3398	Y3144-T3151 WeakPolarHBondContact CE1-O 3.34Å; H3149-T3151 PolarHBondContact O-N 2.75Å; T3151-P3299 HydrophobicContact CG2-CB 4.31Å; T3151-L3398 HydrophobicContact CG2-CD1 3.98Å; T3151-L3398 HydrophobicContact CG2-CD2 3.28Å; T3151-L3398 HydrophobicContact CG2-CG 3.89Å
3152	R	90	Very high	89.6	Confident	53 Å²	53	26.6 Å²	26.6	20%	0.2	14%	0.14	C	C	.	.	S	Bend	trans	-88.2	122.2	-178.3	-177.9	-176.9	-75	178	0.5	110.2	Y3144 H3149 T3154 Y3169	Y3144-R3152 VanDerWaalsContact CD1-C 3.47Å; Y3144-R3152 VanDerWaalsContact CD1-O 3.3Å; Y3144-R3152 WeakPolarHBondContact CD1-O 3.38Å; H3149-R3152 HydrophobicContact CB-CB 3.78Å; H3149-R3152 PolarHBondContact CD2-NH2 2.98Å; H3149-R3152 PolarHBondContact CE1-NH1 2.87Å; H3149-R3152 PolarHBondContact ND1-NH1 3.07Å; H3149-R3152 VanDerWaalsContact O-CB 3.28Å; H3149-R3152 WeakPolarHBondContact O-CB 3.37Å; H3149-R3152 PolarHBondContact O-N 3.12Å; R3152-T3154 PolarHBondContact O-N 3.15Å; R3152-Y3169 VanDerWaalsContact CD-CE2 3.47Å; R3152-Y3169 HydrophobicContact CG-CD1 4.42Å; R3152-Y3169 HydrophobicContact CG-CD2 4.14Å; R3152-Y3169 HydrophobicContact CG-CE1 3.89Å; R3152-Y3169 HydrophobicContact CG-CE2 3.56Å; R3152-Y3169 VanDerWaalsContact CG-CE2 3.49Å; R3152-Y3169 HydrophobicContact CG-CG 4.48Å; R3152-Y3169 WeakPolarHBondContact CG-OH 3.41Å
3153	V	94.6	Very high	89.1	Confident	7.66667 Å²	7.66667	27.6 Å²	27.6	5%	0.046	14%	0.144	C	C	.	.			trans	-64	129.1	174.1	-179.4	0	0	0	0	109	Y3142 Y3144 H3155 I3156 L3167 Y3169 I3288	Y3142-V3153 HydrophobicContact CD1-CG1 4.11Å; Y3142-V3153 HydrophobicContact CD1-CG2 4.31Å; Y3144-V3153 HydrophobicContact CD1-CG2 4.42Å; Y3144-V3153 HydrophobicContact CE1-CB 4.39Å; Y3144-V3153 HydrophobicContact CE1-CG2 3.6Å; V3153-H3155 WeakPolarHBondContact CG1-O 3.44Å; V3153-I3156 HydrophobicContact CG1-CD1 4.22Å; V3153-I3156 HydrophobicContact CG1-CG1 3.69Å; V3153-L3167 HydrophobicContact CB-CD1 4.21Å; V3153-L3167 HydrophobicContact CG1-CD1 4.02Å; V3153-Y3169 VanDerWaalsContact O-CE2 3.27Å; V3153-Y3169 WeakPolarHBondContact O-CE2 3.38Å; V3153-Y3169 PolarHBondContact O-OH 3.36Å; V3153-I3288 HydrophobicContact CG2-CD1 3.69Å; V3153-I3288 HydrophobicContact CG2-CG1 4.09Å
3154	T	95.8	Very high	88.9	Confident	13.6667 Å²	13.6667	27.4 Å²	27.4	8%	0.084	14%	0.143	C	C	.	.			trans	-109.4	-36.7	177.6	57.6	0	0	0	0	111.9	F3143 A3145 D3146 R3152 R3166 L3167	F3143-T3154 PolarHBondContact O-N 2.99Å; F3143-T3154 PolarHBondContact O-OG1 2.95Å; A3145-T3154 HydrophobicContact CB-CG2 4.04Å; A3145-T3154 VanDerWaalsContact CB-OG1 3.23Å; A3145-T3154 WeakPolarHBondContact CB-OG1 3.43Å; A3145-T3154 PolarHBondContact N-OG1 3.01Å; D3146-T3154 HydrophobicContact CB-CG2 3.99Å; R3152-T3154 PolarHBondContact O-N 3.15Å; T3154-R3166 WeakPolarHBondContact O-CA 3.4Å; T3154-L3167 PolarHBondContact O-N 3.22Å
3155	H	96.3	Very high	88.8	Confident	5 Å²	5	26.8 Å²	26.8	2%	0.023	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	147.1	179.1	-54.9	78.2	0	0	0	111.3	T2841 E2866 F3143 V3153 I3165	T2841-H3155 PolarHBondContact OG1-CE1 3.06Å; E2866-H3155 IonicContact OE1-CE1 2.83Å; E2866-H3155 IonicContact OE1-NE2 2.96Å; E2866-H3155 PolarHBondContact OE1-NE2 3.17Å; F3143-H3155 HydrophobicContact CB-CB 4.13Å; F3143-H3155 HydrophobicContact CD2-CB 4.16Å; F3143-H3155 PolarHBondContact N-O 3.03Å; F3143-H3155 PolarHBondContact O-N 3.23Å; V3153-H3155 WeakPolarHBondContact CG1-O 3.44Å; H3155-I3165 CarbonylContact C-O 3.57Å; H3155-I3165 WeakPolarHBondContact CA-O 3.44Å
3156	I	94.7	Very high	88.8	Confident	4 Å²	4	27.3 Å²	27.3	2%	0.021	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	133.1	176.4	-58.5	155.8	0	0	0	107.6	V3140 Q3141 Y3142 V3153 T3164 I3165 L3167 P3281	V3140-I3156 HydrophobicContact CG1-CG2 3.48Å; V3140-I3156 VanDerWaalsContact CG1-CG2 3.47Å; Q3141-I3156 CarbonylContact O-C 3.51Å; Q3141-I3156 VanDerWaalsContact O-CA 3.27Å; Q3141-I3156 WeakPolarHBondContact O-CA 3.44Å; Y3142-I3156 HydrophobicContact CD1-CG1 3.91Å; Y3142-I3156 HydrophobicContact CD1-CG2 4.44Å; Y3142-I3156 HydrophobicContact CE1-CG1 4.26Å; Y3142-I3156 HydrophobicContact CE1-CG2 4.36Å; V3153-I3156 HydrophobicContact CG1-CD1 4.22Å; V3153-I3156 HydrophobicContact CG1-CG1 3.69Å; I3156-T3164 CarbonylContact O-C 3.52Å; I3156-T3164 WeakPolarHBondContact O-CA 3.33Å; I3156-I3165 HydrophobicContact CB-CB 4.25Å; I3156-I3165 HydrophobicContact CB-CG2 4.36Å; I3156-I3165 HydrophobicContact CD1-CG2 3.97Å; I3156-I3165 PolarHBondContact N-O 3.2Å; I3156-I3165 PolarHBondContact O-N 3.21Å; I3156-L3167 HydrophobicContact CD1-CD1 3.87Å; I3156-L3167 HydrophobicContact CD1-CD2 4.44Å; I3156-L3167 HydrophobicContact CD1-CG 4.27Å; I3156-P3281 HydrophobicContact CD1-CG 3.54Å; I3156-P3281 HydrophobicContact CG1-CG 4.27Å; I3156-P3281 HydrophobicContact CG2-CG 4.49Å
3157	F	91.6	Very high	89	Confident	2 Å²	2	26.4 Å²	26.4	1%	0.009	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	121.9	173.2	-175.8	-104.8	0	0	0	110.7	L2818 L2822 V2863 V3140 Q3141 F3143 H3159 L3162 K3163 T3164	L2818-F3157 HydrophobicContact CD1-CE1 3.96Å; L2818-F3157 HydrophobicContact CD1-CZ 4Å; L2818-F3157 HydrophobicContact CD2-CE1 4.36Å; L2818-F3157 HydrophobicContact CD2-CZ 3.98Å; L2822-F3157 HydrophobicContact CD1-CB 3.93Å; L2822-F3157 HydrophobicContact CD1-CD1 3.42Å; L2822-F3157 VanDerWaalsContact CD1-CD1 3.43Å; L2822-F3157 HydrophobicContact CD1-CD2 3.59Å; L2822-F3157 HydrophobicContact CD1-CE1 3.71Å; L2822-F3157 HydrophobicContact CD1-CE2 3.88Å; L2822-F3157 HydrophobicContact CD1-CG 3.34Å; L2822-F3157 HydrophobicContact CD1-CZ 3.94Å; L2822-F3157 HydrophobicContact CD2-CE1 4.25Å; L2822-F3157 HydrophobicContact CG-CD1 3.9Å; L2822-F3157 HydrophobicContact CG-CE1 4.02Å; L2822-F3157 HydrophobicContact CG-CG 4.3Å; L2822-F3157 HydrophobicContact CG-CZ 4.46Å; V2863-F3157 HydrophobicContact CG1-CD2 4.48Å; V2863-F3157 HydrophobicContact CG1-CE2 3.74Å; V2863-F3157 HydrophobicContact CG1-CZ 4.15Å; V3140-F3157 CarbonylContact C-O 3.54Å; V3140-F3157 VanDerWaalsContact CA-O 3.32Å; V3140-F3157 WeakPolarHBondContact CA-O 3.33Å; Q3141-F3157 HydrophobicContact CB-CB 4.31Å; Q3141-F3157 PolarHBondContact N-O 3.17Å; Q3141-F3157 PolarHBondContact O-N 3.32Å; F3143-F3157 HydrophobicContact CE2-CB 4.18Å; F3157-H3159 AromaticContact CD1-CD2 3.69Å; F3157-H3159 AromaticContact CD1-CE1 3.79Å; F3157-H3159 AromaticContact CD1-CG 3.94Å; F3157-H3159 AromaticContact CD1-ND1 3.92Å; F3157-H3159 AromaticContact CD1-NE2 3.61Å; F3157-H3159 HydrophobicContact CE1-CB 4.4Å; F3157-H3159 AromaticContact CE1-CD2 3.94Å; F3157-H3159 AromaticContact CE1-CE1 3.71Å; F3157-H3159 AromaticContact CE1-CG 3.77Å; F3157-H3159 AromaticContact CE1-ND1 3.59Å; F3157-H3159 AromaticContact CE1-NE2 3.91Å; F3157-L3162 HydrophobicContact CZ-CD2 4.34Å; F3157-K3163 WeakPolarHBondContact CD2-O 3.37Å; F3157-T3164 VanDerWaalsContact CD2-OG1 3.31Å; F3157-T3164 WeakPolarHBondContact CD2-OG1 3.44Å
3158	N	88.4	Confident	89.4	Confident	15.6667 Å²	15.6667	24.4 Å²	24.4	8%	0.084	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	111.4	173.8	-175.3	-31.4	0	0	0	109.6	G3160 R3161 L3162 K3163 D3279	N3158-G3160 PolarHBondContact O-N 3.09Å; N3158-G3160 WeakPolarHBondContact OD1-CA 3.37Å; N3158-G3160 PolarHBondContact OD1-N 3.1Å; N3158-R3161 HydrophobicContact CB-CB 4.46Å; N3158-R3161 PolarHBondContact O-N 3.24Å; N3158-R3161 PolarHBondContact OD1-N 3.2Å; N3158-R3161 VanDerWaalsContact OD1-N 3.14Å; N3158-L3162 WeakPolarHBondContact O-CA 3.42Å; N3158-L3162 PolarHBondContact O-N 3.03Å; N3158-K3163 PolarHBondContact N-O 2.82Å; N3158-K3163 PolarHBondContact O-N 2.95Å; N3158-D3279 PolarHBondContact ND2-OD1 3.23Å; N3158-D3279 PolarHBondContact ND2-OD2 2.86Å
3159	H	83.9	Confident	90	Very high	14 Å²	14	22.3 Å²	22.3	7%	0.065	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-33.2	-178.9	-74.1	-94.6	0	0	0	113.2	L2818 G2820 S3139 Q3141 F3157 R3161 L3162	L2818-H3159 HydrophobicContact CD1-CB 4.2Å; G2820-H3159 PolarHBondContact O-CE1 3.13Å; S3139-H3159 WeakPolarHBondContact O-CB 3.4Å; S3139-H3159 PolarHBondContact O-CD2 3.19Å; S3139-H3159 PolarHBondContact O-N 2.99Å; Q3141-H3159 VanDerWaalsContact CD-NE2 3.32Å; Q3141-H3159 VanDerWaalsContact CG-NE2 3.29Å; Q3141-H3159 WeakPolarHBondContact CG-NE2 3.45Å; Q3141-H3159 PolarHBondContact NE2-NE2 2.7Å; Q3141-H3159 VanDerWaalsContact NE2-NE2 3.19Å; Q3141-H3159 PolarHBondContact OE1-NE2 2.87Å; F3157-H3159 AromaticContact CD1-CD2 3.69Å; F3157-H3159 AromaticContact CD1-CE1 3.79Å; F3157-H3159 AromaticContact CD1-CG 3.94Å; F3157-H3159 AromaticContact CD1-ND1 3.92Å; F3157-H3159 AromaticContact CD1-NE2 3.61Å; F3157-H3159 HydrophobicContact CE1-CB 4.4Å; F3157-H3159 AromaticContact CE1-CD2 3.94Å; F3157-H3159 AromaticContact CE1-CE1 3.71Å; F3157-H3159 AromaticContact CE1-CG 3.77Å; F3157-H3159 AromaticContact CE1-ND1 3.59Å; F3157-H3159 AromaticContact CE1-NE2 3.91Å; H3159-R3161 VanDerWaalsContact C-N 3.31Å; H3159-R3161 PolarHBondContact O-N 3.05Å; H3159-L3162 WeakPolarHBondContact O-CD2 3.26Å
3160	G	79.3	Confident	90.2	Very high	30.3333 Å²	30.3333	18.9 Å²	18.9	31%	0.313	10%	0.099	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-25.8	-178.6	0	0	0	0	0	113.4	R3137 N3158	R3137-G3160 WeakPolarHBondContact O-CA 3.35Å; R3137-G3160 PolarHBondContact O-N 2.81Å; R3137-G3160 VanDerWaalsContact O-N 3.09Å; N3158-G3160 PolarHBondContact O-N 3.09Å; N3158-G3160 WeakPolarHBondContact OD1-CA 3.37Å; N3158-G3160 PolarHBondContact OD1-N 3.1Å
3161	R	78.6	Confident	90.3	Very high	64.6667 Å²	64.6667	19.2 Å²	19.2	24%	0.244	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112	-9.1	-177.7	-62.1	-173.3	-176.3	170.4	12.2	114.4	N3158 H3159 K3163 L3274 I3275 E3276 D3279	N3158-R3161 HydrophobicContact CB-CB 4.46Å; N3158-R3161 PolarHBondContact O-N 3.24Å; N3158-R3161 PolarHBondContact OD1-N 3.2Å; N3158-R3161 VanDerWaalsContact OD1-N 3.14Å; H3159-R3161 VanDerWaalsContact C-N 3.31Å; H3159-R3161 PolarHBondContact O-N 3.05Å; R3161-K3163 VanDerWaalsContact C-N 3.27Å; R3161-K3163 HydrophobicContact CB-CB 4.45Å; R3161-K3163 HydrophobicContact CB-CD 4.18Å; R3161-K3163 HydrophobicContact CB-CG 4.16Å; R3161-K3163 PolarHBondContact O-N 3.24Å; R3161-L3274 VanDerWaalsContact NH2-C 3.31Å; R3161-L3274 PolarHBondContact NH2-O 3.11Å; R3161-I3275 PolarHBondContact NH1-O 2.6Å; R3161-I3275 PolarHBondContact NH2-O 3.46Å; R3161-E3276 PolarHBondContact NH1-O 2.96Å; R3161-E3276 VanDerWaalsContact NH2-N 3.13Å; R3161-E3276 PolarHBondContact NH2-O 3.5Å; R3161-E3276 VanDerWaalsContact NH2-O 3.16Å; R3161-D3279 WeakPolarHBondContact CD-OD1 3.46Å; R3161-D3279 WeakPolarHBondContact CD-OD2 3.36Å; R3161-D3279 IonicContact CZ-OD1 3.37Å; R3161-D3279 IonicContact CZ-OD2 2.9Å; R3161-D3279 IonicContact NE-OD1 3.69Å; R3161-D3279 PolarHBondContact NE-OD1 3.05Å; R3161-D3279 IonicContact NE-OD2 2.73Å; R3161-D3279 IonicContact NH1-OD1 3.23Å; R3161-D3279 PolarHBondContact NH1-OD1 2.92Å; R3161-D3279 IonicContact NH1-OD2 2.98Å; R3161-D3279 PolarHBondContact NH1-OD2 2.93Å; R3161-D3279 IonicContact NH2-OD1 2.62Å
3162	L	83.5	Confident	90.2	Very high	18.3333 Å²	18.3333	19.4 Å²	19.4	10%	0.096	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	57	40.1	-175.8	-49	179.7	0	0	0	112.4	L2818 F3157 N3158 H3159 N3184	L2818-L3162 HydrophobicContact CB-CD2 4.07Å; L2818-L3162 HydrophobicContact CD1-CD1 3.19Å; L2818-L3162 HydrophobicContact CD1-CD2 3.31Å; L2818-L3162 HydrophobicContact CD1-CG 4Å; L2818-L3162 HydrophobicContact CD2-CD1 3.84Å; L2818-L3162 HydrophobicContact CD2-CD2 3.87Å; L2818-L3162 HydrophobicContact CD2-CG 4.35Å; L2818-L3162 HydrophobicContact CG-CD1 4.05Å; L2818-L3162 HydrophobicContact CG-CD2 3.59Å; L2818-L3162 VanDerWaalsContact CG-CD2 3.48Å; F3157-L3162 HydrophobicContact CZ-CD2 4.34Å; N3158-L3162 WeakPolarHBondContact O-CA 3.42Å; N3158-L3162 PolarHBondContact O-N 3.03Å; H3159-L3162 WeakPolarHBondContact O-CD2 3.26Å; L3162-N3184 WeakPolarHBondContact O-CA 3.37Å; L3162-N3184 VanDerWaalsContact O-CB 3.24Å; L3162-N3184 WeakPolarHBondContact O-CB 3.29Å; L3162-N3184 PolarHBondContact O-N 3.22Å; L3162-N3184 PolarHBondContact O-ND2 2.91Å
3163	K	86.2	Confident	90	Very high	28.6667 Å²	28.6667	19.2 Å²	19.2	13%	0.125	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	135.2	-179	-70.6	179.7	177.5	-168.4	0	110.5	F3157 N3158 R3161 Q3181 Y3182 D3183	F3157-K3163 WeakPolarHBondContact CD2-O 3.37Å; N3158-K3163 PolarHBondContact N-O 2.82Å; N3158-K3163 PolarHBondContact O-N 2.95Å; R3161-K3163 VanDerWaalsContact C-N 3.27Å; R3161-K3163 HydrophobicContact CB-CB 4.45Å; R3161-K3163 HydrophobicContact CB-CD 4.18Å; R3161-K3163 HydrophobicContact CB-CG 4.16Å; R3161-K3163 PolarHBondContact O-N 3.24Å; K3163-Q3181 HydrophobicContact CB-CG 4.42Å; K3163-Q3181 HydrophobicContact CD-CG 4.21Å; K3163-Q3181 HydrophobicContact CG-CG 4.47Å; K3163-Y3182 WeakPolarHBondContact CA-O 3.21Å; K3163-D3183 WeakPolarHBondContact CD-OD1 3.43Å; K3163-D3183 WeakPolarHBondContact CE-OD1 3.11Å; K3163-D3183 IonicContact NZ-OD1 3.26Å; K3163-D3183 PolarHBondContact NZ-OD1 2.76Å
3164	T	91	Very high	89.7	Confident	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	137.5	167.9	-44	0	0	0	0	109.6	L2843 L2864 I3156 F3157 Q3181 Y3182 N3184	L2843-T3164 HydrophobicContact CD1-CG2 3.82Å; L2864-T3164 HydrophobicContact CD2-CG2 3.68Å; I3156-T3164 CarbonylContact O-C 3.52Å; I3156-T3164 WeakPolarHBondContact O-CA 3.33Å; F3157-T3164 VanDerWaalsContact CD2-OG1 3.31Å; F3157-T3164 WeakPolarHBondContact CD2-OG1 3.44Å; T3164-Q3181 CarbonylContact O-C 3.56Å; T3164-Q3181 WeakPolarHBondContact O-CA 3.38Å; T3164-Y3182 PolarHBondContact N-O 3.15Å; T3164-Y3182 PolarHBondContact O-N 3.25Å; T3164-N3184 PolarHBondContact N-ND2 3.37Å; T3164-N3184 PolarHBondContact OG1-ND2 3.02Å
3165	I	93.1	Very high	89.5	Confident	2 Å²	2	20.3 Å²	20.3	1%	0.01	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	128.8	177.6	-70.6	167.5	0	0	0	108.1	H3155 I3156 L3167 L3179 E3180 Q3181 D3279	H3155-I3165 CarbonylContact C-O 3.57Å; H3155-I3165 WeakPolarHBondContact CA-O 3.44Å; I3156-I3165 HydrophobicContact CB-CB 4.25Å; I3156-I3165 HydrophobicContact CB-CG2 4.36Å; I3156-I3165 HydrophobicContact CD1-CG2 3.97Å; I3156-I3165 PolarHBondContact N-O 3.2Å; I3156-I3165 PolarHBondContact O-N 3.21Å; I3165-L3167 HydrophobicContact CG2-CD2 3.92Å; I3165-L3167 HydrophobicContact CG2-CG 4.22Å; I3165-L3179 HydrophobicContact CB-CD1 4.26Å; I3165-L3179 HydrophobicContact CD1-CD1 4.11Å; I3165-L3179 HydrophobicContact CG1-CD1 3.99Å; I3165-L3179 HydrophobicContact CG1-CD2 4.46Å; I3165-L3179 HydrophobicContact CG1-CG 4.34Å; I3165-L3179 HydrophobicContact CG2-CB 3.91Å; I3165-L3179 HydrophobicContact CG2-CD1 3.77Å; I3165-L3179 HydrophobicContact CG2-CD2 4.37Å; I3165-L3179 HydrophobicContact CG2-CG 4.13Å; I3165-E3180 CarbonylContact C-O 3.51Å; I3165-E3180 VanDerWaalsContact CA-O 3.32Å; I3165-E3180 WeakPolarHBondContact CA-O 3.33Å; I3165-Q3181 HydrophobicContact CG1-CB 4.36Å; I3165-Q3181 HydrophobicContact CG1-CG 4.18Å; I3165-D3279 HydrophobicContact CD1-CB 3.6Å; I3165-D3279 WeakPolarHBondContact CD1-O 3.33Å
3166	R	95.2	Very high	89.5	Confident	11.3333 Å²	11.3333	20.1 Å²	20.1	4%	0.043	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	131	168.5	-179.2	173.3	101.6	-177.6	-3.7	109.1	E2866 E2867 S2868 N2883 T3154 L3168 L3179 E3180 Y3182	E2866-R3166 IonicContact OE2-CZ 3.07Å; E2866-R3166 IonicContact OE2-NE 2.79Å; E2866-R3166 IonicContact OE2-NH1 2.89Å; E2866-R3166 PolarHBondContact OE2-NH1 2.93Å; E2867-R3166 PolarHBondContact O-NH1 2.8Å; E2867-R3166 VanDerWaalsContact O-NH1 3.13Å; S2868-R3166 VanDerWaalsContact CA-NH1 3.32Å; S2868-R3166 VanDerWaalsContact CB-NH1 3.33Å; N2883-R3166 VanDerWaalsContact ND2-CZ 3.33Å; N2883-R3166 PolarHBondContact ND2-NH1 3.07Å; N2883-R3166 PolarHBondContact ND2-NH2 3.15Å; N2883-R3166 PolarHBondContact OD1-NH1 2.97Å; N2883-R3166 PolarHBondContact OD1-NH2 3.33Å; T3154-R3166 WeakPolarHBondContact O-CA 3.4Å; R3166-L3168 HydrophobicContact CG-CD2 4.46Å; R3166-L3179 CarbonylContact O-C 3.56Å; R3166-L3179 WeakPolarHBondContact O-CA 3.41Å; R3166-L3179 WeakPolarHBondContact O-CB 3.34Å; R3166-E3180 HydrophobicContact CB-CB 4.37Å; R3166-E3180 IonicContact CZ-OE1 2.64Å; R3166-E3180 IonicContact CZ-OE2 2.94Å; R3166-E3180 PolarHBondContact N-O 3.05Å; R3166-E3180 IonicContact NE-OE2 3.38Å; R3166-E3180 PolarHBondContact NE-OE2 2.93Å; R3166-E3180 IonicContact NH1-OE2 3.34Å; R3166-E3180 IonicContact NH2-OE1 3.35Å; R3166-E3180 PolarHBondContact NH2-OE1 3.21Å; R3166-E3180 IonicContact NH2-OE2 3.69Å; R3166-E3180 PolarHBondContact NH2-OE2 2.81Å; R3166-E3180 PolarHBondContact O-N 2.96Å; R3166-Y3182 HydrophobicContact CB-CE2 4.2Å; R3166-Y3182 PolarHBondContact NH2-OH 2.68Å
3167	L	96.1	Very high	89.5	Confident	7.33333 Å²	7.33333	19.9 Å²	19.9	4%	0.038	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	135.2	-179.9	-61.4	176.2	0	0	0	110.9	V3153 T3154 I3156 I3165 Y3169 V3176 L3179 L3280 L3282	V3153-L3167 HydrophobicContact CB-CD1 4.21Å; V3153-L3167 HydrophobicContact CG1-CD1 4.02Å; T3154-L3167 PolarHBondContact O-N 3.22Å; I3156-L3167 HydrophobicContact CD1-CD1 3.87Å; I3156-L3167 HydrophobicContact CD1-CD2 4.44Å; I3156-L3167 HydrophobicContact CD1-CG 4.27Å; I3165-L3167 HydrophobicContact CG2-CD2 3.92Å; I3165-L3167 HydrophobicContact CG2-CG 4.22Å; L3167-Y3169 HydrophobicContact CB-CE2 3.73Å; L3167-Y3169 WeakPolarHBondContact CD1-OH 3.21Å; L3167-V3176 HydrophobicContact CD2-CG2 4.33Å; L3167-L3179 HydrophobicContact CD2-CB 4.06Å; L3167-L3179 HydrophobicContact CD2-CD1 4.01Å; L3167-L3179 HydrophobicContact CD2-CD2 4.43Å; L3167-L3280 HydrophobicContact CD2-CD1 3.6Å; L3167-L3282 HydrophobicContact CD1-CD1 3.98Å; L3167-L3282 HydrophobicContact CD1-CG 4.48Å
3168	L	96.2	Very high	89.7	Confident	7 Å²	7	19.8 Å²	19.8	4%	0.037	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	133.3	178.8	-57.2	176.3	0	0	0	110.5	M2882 F2885 R3166 V3176 F3177 A3178 E3180	M2882-L3168 HydrophobicContact CG-CD2 4.44Å; M2882-L3168 HydrophobicContact SD-CB 4.21Å; M2882-L3168 HydrophobicContact SD-CD2 4.05Å; F2885-L3168 HydrophobicContact CD2-CD1 3.81Å; F2885-L3168 HydrophobicContact CE2-CD1 3.31Å; F2885-L3168 HydrophobicContact CZ-CD1 4.11Å; R3166-L3168 HydrophobicContact CG-CD2 4.46Å; L3168-V3176 WeakPolarHBondContact O-CA 3.31Å; L3168-V3176 WeakPolarHBondContact O-CG2 3.33Å; L3168-F3177 HydrophobicContact CB-CD1 4.26Å; L3168-F3177 HydrophobicContact CB-CE1 3.63Å; L3168-F3177 HydrophobicContact CB-CE2 4.39Å; L3168-F3177 HydrophobicContact CB-CZ 3.73Å; L3168-F3177 HydrophobicContact CD1-CZ 4.24Å; L3168-F3177 WeakPolarHBondContact O-CD1 3.37Å; L3168-F3177 PolarHBondContact O-N 3.09Å; L3168-A3178 HydrophobicContact CB-CB 4.3Å; L3168-A3178 HydrophobicContact CD1-CB 4.13Å; L3168-A3178 PolarHBondContact N-O 3.29Å; L3168-E3180 HydrophobicContact CD1-CG 4.31Å
3169	Y	94.9	Very high	90	Very high	25.3333 Å²	25.3333	19.1 Å²	19.1	10%	0.099	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	141.5	-170.4	-64.7	-91.1	0	0	0	111.7	R3152 V3153 L3167 G3174 H3175 V3176 F3177	R3152-Y3169 VanDerWaalsContact CD-CE2 3.47Å; R3152-Y3169 HydrophobicContact CG-CD1 4.42Å; R3152-Y3169 HydrophobicContact CG-CD2 4.14Å; R3152-Y3169 HydrophobicContact CG-CE1 3.89Å; R3152-Y3169 HydrophobicContact CG-CE2 3.56Å; R3152-Y3169 VanDerWaalsContact CG-CE2 3.49Å; R3152-Y3169 HydrophobicContact CG-CG 4.48Å; R3152-Y3169 WeakPolarHBondContact CG-OH 3.41Å; V3153-Y3169 VanDerWaalsContact O-CE2 3.27Å; V3153-Y3169 WeakPolarHBondContact O-CE2 3.38Å; V3153-Y3169 PolarHBondContact O-OH 3.36Å; L3167-Y3169 HydrophobicContact CB-CE2 3.73Å; L3167-Y3169 WeakPolarHBondContact CD1-OH 3.21Å; Y3169-G3174 VanDerWaalsContact CD1-O 3.3Å; Y3169-G3174 WeakPolarHBondContact CD1-O 3.47Å; Y3169-H3175 CarbonylContact C-O 3.54Å; Y3169-H3175 WeakPolarHBondContact CA-O 3.34Å; Y3169-V3176 HydrophobicContact CD1-CB 4.37Å; Y3169-V3176 HydrophobicContact CE1-CB 4.24Å; Y3169-F3177 VanDerWaalsContact C-CD1 3.45Å; Y3169-F3177 WeakPolarHBondContact O-CE1 3.4Å
3170	D	91.4	Very high	90.5	Very high	1.66667 Å²	1.66667	18.4 Å²	18.4	1%	0.009	10%	0.101	C	C	.	.			trans	-66.3	131.8	176.1	146.9	19.3	0	0	0	109.7	L2894 R2907 I3172 H3173 G3174 H3175 F3177	L2894-D3170 VanDerWaalsContact CD2-OD1 3.25Å; L2894-D3170 WeakPolarHBondContact CD2-OD1 3.28Å; R2907-D3170 IonicContact CZ-OD2 3.28Å; R2907-D3170 IonicContact NE-OD2 3.86Å; R2907-D3170 VanDerWaalsContact NH1-CB 3.32Å; R2907-D3170 IonicContact NH1-OD2 3.22Å; R2907-D3170 PolarHBondContact NH1-OD2 2.92Å; D3170-I3172 VanDerWaalsContact C-N 3.31Å; D3170-I3172 PolarHBondContact O-N 3.15Å; D3170-I3172 WeakPolarHBondContact OD1-CA 3.33Å; D3170-I3172 PolarHBondContact OD1-N 2.85Å; D3170-H3173 PolarHBondContact OD1-N 3.32Å; D3170-H3173 IonicContact OD1-ND1 2.75Å; D3170-H3173 IonicContact OD2-CG 3.08Å; D3170-H3173 IonicContact OD2-ND1 3.79Å; D3170-H3173 PolarHBondContact OD2-ND1 3.43Å; D3170-G3174 VanDerWaalsContact O-CA 3.23Å; D3170-G3174 WeakPolarHBondContact O-CA 3.46Å; D3170-G3174 PolarHBondContact O-N 3.1Å; D3170-G3174 VanDerWaalsContact O-N 3.17Å; D3170-G3174 PolarHBondContact OD1-N 3.45Å; D3170-G3174 VanDerWaalsContact OD1-N 3.14Å; D3170-G3174 PolarHBondContact OD2-N 3.27Å; D3170-H3175 WeakPolarHBondContact CB-O 3.31Å; D3170-H3175 PolarHBondContact N-O 3.1Å; D3170-H3175 WeakPolarHBondContact OD2-CB 3.18Å; D3170-H3175 IonicContact OD2-CG 3.12Å; D3170-H3175 PolarHBondContact OD2-N 2.76Å; D3170-F3177 HydrophobicContact CB-CD1 4.38Å
3171	P	87.3	Confident	91.2	Very high	44.3333 Å²	44.3333	17.1 Å²	17.1	29%	0.288	9%	0.086	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-13.3	-177.7	28.1	-35.2	0	0	0	114.7	V2879 I2887 Y2889	V2879-P3171 HydrophobicContact CB-CB 4.32Å; V2879-P3171 HydrophobicContact CB-CG 4.34Å; V2879-P3171 HydrophobicContact CG2-CB 3.98Å; I2887-P3171 HydrophobicContact CD1-CG 4.24Å; Y2889-P3171 VanDerWaalsContact OH-CG 3.23Å; Y2889-P3171 WeakPolarHBondContact OH-CG 3.39Å
3172	I	85.3	Confident	91.7	Very high	51.6667 Å²	51.6667	15 Å²	15	27%	0.265	8%	0.079	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-62.4	-178.7	-59.5	179.9	0	0	0	110.7	Y2889 L2894 W2909 D3170	Y2889-I3172 HydrophobicContact CD1-CD1 4Å; Y2889-I3172 HydrophobicContact CE1-CD1 3.89Å; Y2889-I3172 HydrophobicContact CE1-CG1 4.05Å; L2894-I3172 HydrophobicContact CB-CD1 4.36Å; L2894-I3172 HydrophobicContact CD1-CD1 4.08Å; L2894-I3172 HydrophobicContact CD2-CD1 4.33Å; L2894-I3172 HydrophobicContact CG-CD1 4.47Å; W2909-I3172 HydrophobicContact CH2-CD1 3.37Å; W2909-I3172 HydrophobicContact CZ2-CD1 4.04Å; W2909-I3172 HydrophobicContact CZ3-CD1 3.86Å; D3170-I3172 VanDerWaalsContact C-N 3.31Å; D3170-I3172 PolarHBondContact O-N 3.15Å; D3170-I3172 WeakPolarHBondContact OD1-CA 3.33Å; D3170-I3172 PolarHBondContact OD1-N 2.85Å
3173	H	86	Confident	91.8	Very high	48.6667 Å²	48.6667	16.3 Å²	16.3	23%	0.225	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-17.6	-174.4	-52.4	90.2	0	0	0	112.9	W2909 I2915 D3170 H3175	W2909-H3173 AromaticContact CE3-CE1 3.78Å; I2915-H3173 HydrophobicContact CD1-CB 4.48Å; D3170-H3173 PolarHBondContact OD1-N 3.32Å; D3170-H3173 IonicContact OD1-ND1 2.75Å; D3170-H3173 IonicContact OD2-CG 3.08Å; D3170-H3173 IonicContact OD2-ND1 3.79Å; D3170-H3173 PolarHBondContact OD2-ND1 3.43Å; H3173-H3175 VanDerWaalsContact C-N 3.25Å; H3173-H3175 PolarHBondContact O-CD2 3.09Å; H3173-H3175 PolarHBondContact O-N 3.02Å
3174	G	89	Confident	91.3	Very high	20 Å²	20	15.3 Å²	15.3	21%	0.206	8%	0.082	C	C	.	.			trans	74.6	13.3	-177.6	0	0	0	0	0	114.6	Y3169 D3170	Y3169-G3174 VanDerWaalsContact CD1-O 3.3Å; Y3169-G3174 WeakPolarHBondContact CD1-O 3.47Å; D3170-G3174 VanDerWaalsContact O-CA 3.23Å; D3170-G3174 WeakPolarHBondContact O-CA 3.46Å; D3170-G3174 PolarHBondContact O-N 3.1Å; D3170-G3174 VanDerWaalsContact O-N 3.17Å; D3170-G3174 PolarHBondContact OD1-N 3.45Å; D3170-G3174 VanDerWaalsContact OD1-N 3.14Å; D3170-G3174 PolarHBondContact OD2-N 3.27Å
3175	H	92.3	Very high	89.8	Confident	25.3333 Å²	25.3333	17 Å²	17	12%	0.117	10%	0.099	C	C	.	.			trans	-81.2	148.6	174.7	-55.2	172.7	0	0	0	110.9	Y3169 D3170 H3173 F3177 T3231 H3233 G3235	Y3169-H3175 CarbonylContact C-O 3.54Å; Y3169-H3175 WeakPolarHBondContact CA-O 3.34Å; D3170-H3175 WeakPolarHBondContact CB-O 3.31Å; D3170-H3175 PolarHBondContact N-O 3.1Å; D3170-H3175 WeakPolarHBondContact OD2-CB 3.18Å; D3170-H3175 IonicContact OD2-CG 3.12Å; D3170-H3175 PolarHBondContact OD2-N 2.76Å; H3173-H3175 VanDerWaalsContact C-N 3.25Å; H3173-H3175 PolarHBondContact O-CD2 3.09Å; H3173-H3175 PolarHBondContact O-N 3.02Å; H3175-F3177 PolarHBondContact O-N 3.25Å; H3175-T3231 HydrophobicContact CB-CG2 4.32Å; H3175-H3233 PolarHBondContact CE1-O 3.22Å; H3175-G3235 VanDerWaalsContact CE1-CA 3.5Å; H3175-G3235 WeakPolarHBondContact CE1-CA 3.36Å; H3175-G3235 PolarHBondContact CE1-N 3.11Å; H3175-G3235 VanDerWaalsContact CE1-N 3.31Å; H3175-G3235 VanDerWaalsContact CG-CA 3.49Å; H3175-G3235 WeakPolarHBondContact ND1-CA 3.28Å
3176	V	94.7	Very high	87.9	Confident	0 Å²	0	20 Å²	20	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60	136.8	170.4	65.8	0	0	0	0	110	R2907 L3167 L3168 Y3169 I3229 T3231 P3237 L3282	R2907-V3176 PolarHBondContact NH2-O 3.08Å; L3167-V3176 HydrophobicContact CD2-CG2 4.33Å; L3168-V3176 WeakPolarHBondContact O-CA 3.31Å; L3168-V3176 WeakPolarHBondContact O-CG2 3.33Å; Y3169-V3176 HydrophobicContact CD1-CB 4.37Å; Y3169-V3176 HydrophobicContact CE1-CB 4.24Å; V3176-I3229 HydrophobicContact CG1-CB 4.25Å; V3176-I3229 HydrophobicContact CG1-CG2 3.75Å; V3176-I3229 HydrophobicContact CG2-CB 4.37Å; V3176-I3229 HydrophobicContact CG2-CG1 4.2Å; V3176-T3231 HydrophobicContact CG1-CG2 3.88Å; V3176-T3231 WeakPolarHBondContact O-CG2 3.38Å; V3176-P3237 HydrophobicContact CG1-CG 4.22Å; V3176-L3282 HydrophobicContact CB-CD1 4.37Å; V3176-L3282 HydrophobicContact CG1-CD1 4.28Å
3177	F	95.7	Very high	85.8	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	-22.3	176.7	79.7	-94.6	0	0	0	112.9	M2882 F2885 I2896 L2905 L3168 Y3169 D3170 H3175 I3229	M2882-F3177 HydrophobicContact SD-CE1 3.99Å; M2882-F3177 HydrophobicContact SD-CZ 4.22Å; F2885-F3177 AromaticContact CD1-CE2 3.86Å; F2885-F3177 HydrophobicContact CD1-CE2 3.86Å; F2885-F3177 HydrophobicContact CD1-CZ 4.47Å; F2885-F3177 HydrophobicContact CD2-CE2 4.37Å; F2885-F3177 HydrophobicContact CD2-CZ 4.4Å; F2885-F3177 AromaticContact CE1-CE2 3.94Å; F2885-F3177 HydrophobicContact CE1-CE2 3.99Å; F2885-F3177 HydrophobicContact CE2-CE2 4.49Å; F2885-F3177 HydrophobicContact CG-CE2 4.03Å; F2885-F3177 HydrophobicContact CG-CZ 4.28Å; F2885-F3177 HydrophobicContact CZ-CE2 4.31Å; I2896-F3177 HydrophobicContact CD1-CB 4.21Å; I2896-F3177 HydrophobicContact CD1-CD1 4.09Å; I2896-F3177 HydrophobicContact CD1-CD2 3.84Å; I2896-F3177 HydrophobicContact CD1-CE1 4.35Å; I2896-F3177 HydrophobicContact CD1-CE2 4.26Å; I2896-F3177 HydrophobicContact CD1-CG 3.77Å; I2896-F3177 HydrophobicContact CD1-CZ 4.46Å; I2896-F3177 HydrophobicContact CG2-CD2 3.9Å; I2896-F3177 HydrophobicContact CG2-CE2 3.53Å; I2896-F3177 HydrophobicContact CG2-CZ 4.11Å; L2905-F3177 HydrophobicContact CD2-CB 3.71Å; L2905-F3177 HydrophobicContact CD2-CD2 4.36Å; L2905-F3177 HydrophobicContact CD2-CG 4.49Å; L3168-F3177 HydrophobicContact CB-CD1 4.26Å; L3168-F3177 HydrophobicContact CB-CE1 3.63Å; L3168-F3177 HydrophobicContact CB-CE2 4.39Å; L3168-F3177 HydrophobicContact CB-CZ 3.73Å; L3168-F3177 HydrophobicContact CD1-CZ 4.24Å; L3168-F3177 WeakPolarHBondContact O-CD1 3.37Å; L3168-F3177 PolarHBondContact O-N 3.09Å; Y3169-F3177 VanDerWaalsContact C-CD1 3.45Å; Y3169-F3177 WeakPolarHBondContact O-CE1 3.4Å; D3170-F3177 HydrophobicContact CB-CD1 4.38Å; H3175-F3177 PolarHBondContact O-N 3.25Å; F3177-I3229 PolarHBondContact O-N 3.3Å
3178	A	96	Very high	83.2	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	159.3	176.6	0	0	0	0	0	110.9	F2885 L3168 F3227	F2885-A3178 HydrophobicContact CE1-CB 4.17Å; F2885-A3178 HydrophobicContact CE2-CB 4.41Å; F2885-A3178 HydrophobicContact CZ-CB 3.74Å; L3168-A3178 HydrophobicContact CB-CB 4.3Å; L3168-A3178 HydrophobicContact CD1-CB 4.13Å; L3168-A3178 PolarHBondContact N-O 3.29Å; A3178-F3227 CarbonylContact C-O 3.54Å; A3178-F3227 WeakPolarHBondContact CA-O 3.17Å; A3178-F3227 WeakPolarHBondContact CB-O 3.17Å
3179	L	95	Very high	80.4	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	143.1	169.8	96	105.8	0	0	0	109.5	I3165 R3166 L3167 Q3181 F3227 I3229 V3278 L3280	I3165-L3179 HydrophobicContact CB-CD1 4.26Å; I3165-L3179 HydrophobicContact CD1-CD1 4.11Å; I3165-L3179 HydrophobicContact CG1-CD1 3.99Å; I3165-L3179 HydrophobicContact CG1-CD2 4.46Å; I3165-L3179 HydrophobicContact CG1-CG 4.34Å; I3165-L3179 HydrophobicContact CG2-CB 3.91Å; I3165-L3179 HydrophobicContact CG2-CD1 3.77Å; I3165-L3179 HydrophobicContact CG2-CD2 4.37Å; I3165-L3179 HydrophobicContact CG2-CG 4.13Å; R3166-L3179 CarbonylContact O-C 3.56Å; R3166-L3179 WeakPolarHBondContact O-CA 3.41Å; R3166-L3179 WeakPolarHBondContact O-CB 3.34Å; L3167-L3179 HydrophobicContact CD2-CB 4.06Å; L3167-L3179 HydrophobicContact CD2-CD1 4.01Å; L3167-L3179 HydrophobicContact CD2-CD2 4.43Å; L3179-Q3181 HydrophobicContact CD1-CB 4.33Å; L3179-Q3181 HydrophobicContact CD2-CB 4.09Å; L3179-F3227 HydrophobicContact CB-CB 4.48Å; L3179-F3227 HydrophobicContact CD1-CB 3.87Å; L3179-F3227 HydrophobicContact CD1-CD2 3.7Å; L3179-F3227 HydrophobicContact CD1-CG 4.18Å; L3179-F3227 HydrophobicContact CD2-CB 3.96Å; L3179-F3227 HydrophobicContact CD2-CD2 3.47Å; L3179-F3227 VanDerWaalsContact CD2-CD2 3.47Å; L3179-F3227 HydrophobicContact CD2-CE2 4.33Å; L3179-F3227 HydrophobicContact CD2-CG 4.06Å; L3179-F3227 HydrophobicContact CG-CB 3.97Å; L3179-F3227 PolarHBondContact N-O 3.12Å; L3179-F3227 PolarHBondContact O-N 3.02Å; L3179-I3229 HydrophobicContact CB-CD1 4.22Å; L3179-I3229 HydrophobicContact CB-CG1 4.27Å; L3179-I3229 HydrophobicContact CD2-CD1 3.71Å; L3179-I3229 HydrophobicContact CD2-CG1 4.09Å; L3179-I3229 HydrophobicContact CG-CD1 4.26Å; L3179-I3229 HydrophobicContact CG-CG1 4.42Å; L3179-V3278 HydrophobicContact CD1-CG1 3.99Å; L3179-V3278 HydrophobicContact CD2-CG1 3.76Å; L3179-V3278 HydrophobicContact CG-CG1 4.25Å; L3179-L3280 HydrophobicContact CD1-CD1 4.42Å; L3179-L3280 HydrophobicContact CD2-CB 4.21Å; L3179-L3280 HydrophobicContact CD2-CD1 4.15Å
3180	E	94.3	Very high	77.6	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	120.4	173.3	-61.8	172.2	145.5	0	0	108.7	N2883 I3165 R3166 L3168 Y3182 K3224 R3225 V3226	N2883-E3180 PolarHBondContact ND2-OE1 3.09Å; N2883-E3180 PolarHBondContact ND2-OE2 3.38Å; I3165-E3180 CarbonylContact C-O 3.51Å; I3165-E3180 VanDerWaalsContact CA-O 3.32Å; I3165-E3180 WeakPolarHBondContact CA-O 3.33Å; R3166-E3180 HydrophobicContact CB-CB 4.37Å; R3166-E3180 IonicContact CZ-OE1 2.64Å; R3166-E3180 IonicContact CZ-OE2 2.94Å; R3166-E3180 PolarHBondContact N-O 3.05Å; R3166-E3180 IonicContact NE-OE2 3.38Å; R3166-E3180 PolarHBondContact NE-OE2 2.93Å; R3166-E3180 IonicContact NH1-OE2 3.34Å; R3166-E3180 IonicContact NH2-OE1 3.35Å; R3166-E3180 PolarHBondContact NH2-OE1 3.21Å; R3166-E3180 IonicContact NH2-OE2 3.69Å; R3166-E3180 PolarHBondContact NH2-OE2 2.81Å; R3166-E3180 PolarHBondContact O-N 2.96Å; L3168-E3180 HydrophobicContact CD1-CG 4.31Å; E3180-Y3182 HydrophobicContact CB-CE2 3.98Å; E3180-Y3182 PolarHBondContact OE2-OH 3.04Å; E3180-K3224 HydrophobicContact CB-CD 4.44Å; E3180-K3224 HydrophobicContact CB-CG 4.46Å; E3180-K3224 VanDerWaalsContact CD-CE 3.47Å; E3180-K3224 WeakPolarHBondContact OE1-CE 3.18Å; E3180-K3224 IonicContact OE1-NZ 2.78Å; E3180-K3224 PolarHBondContact OE1-NZ 3.18Å; E3180-R3225 WeakPolarHBondContact CA-O 3.28Å; E3180-V3226 HydrophobicContact CG-CG1 4.48Å; E3180-V3226 HydrophobicContact CG-CG2 4.17Å
3181	Q	92.5	Very high	74.9	Confident	2 Å²	2	41.9 Å²	41.9	1%	0.009	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	127	-180	-174.9	175.4	-82.8	0	0	109.8	K3163 T3164 I3165 L3179 K3224 R3225 F3227 E3277	K3163-Q3181 HydrophobicContact CB-CG 4.42Å; K3163-Q3181 HydrophobicContact CD-CG 4.21Å; K3163-Q3181 HydrophobicContact CG-CG 4.47Å; T3164-Q3181 CarbonylContact O-C 3.56Å; T3164-Q3181 WeakPolarHBondContact O-CA 3.38Å; I3165-Q3181 HydrophobicContact CG1-CB 4.36Å; I3165-Q3181 HydrophobicContact CG1-CG 4.18Å; L3179-Q3181 HydrophobicContact CD1-CB 4.33Å; L3179-Q3181 HydrophobicContact CD2-CB 4.09Å; Q3181-K3224 CarbonylContact O-C 3.57Å; Q3181-K3224 WeakPolarHBondContact O-CA 3.23Å; Q3181-R3225 PolarHBondContact N-O 3.24Å; Q3181-R3225 PolarHBondContact O-N 3.08Å; Q3181-F3227 HydrophobicContact CB-CE2 4.28Å; Q3181-E3277 PolarHBondContact NE2-O 3.49Å; Q3181-E3277 PolarHBondContact OE1-O 2.94Å
3182	Y	90.7	Very high	72.1	Confident	22.3333 Å²	22.3333	43.4 Å²	43.4	9%	0.088	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	117.4	176.6	-59.9	-91.6	0	0	0	108.6	L2864 K3163 T3164 R3166 E3180 N3184 K3224	L2864-Y3182 HydrophobicContact CD1-CD1 3.98Å; L2864-Y3182 HydrophobicContact CD1-CD2 4.08Å; L2864-Y3182 HydrophobicContact CD1-CE1 4.43Å; L2864-Y3182 HydrophobicContact CD1-CE2 4.38Å; L2864-Y3182 HydrophobicContact CD1-CG 3.79Å; K3163-Y3182 WeakPolarHBondContact CA-O 3.21Å; T3164-Y3182 PolarHBondContact N-O 3.15Å; T3164-Y3182 PolarHBondContact O-N 3.25Å; R3166-Y3182 HydrophobicContact CB-CE2 4.2Å; R3166-Y3182 PolarHBondContact NH2-OH 2.68Å; E3180-Y3182 HydrophobicContact CB-CE2 3.98Å; E3180-Y3182 PolarHBondContact OE2-OH 3.04Å; Y3182-N3184 PolarHBondContact O-N 2.77Å; Y3182-N3184 PolarHBondContact O-OD1 2.78Å; Y3182-K3224 HydrophobicContact CD1-CB 4.2Å; Y3182-K3224 HydrophobicContact CD1-CG 4.25Å; Y3182-K3224 HydrophobicContact CE1-CB 4.06Å; Y3182-K3224 HydrophobicContact CE1-CD 3.91Å; Y3182-K3224 HydrophobicContact CE1-CG 3.78Å; Y3182-K3224 WeakPolarHBondContact OH-CD 3.43Å
3183	D	83.9	Confident	69.6	Low	45.3333 Å²	45.3333	49.9 Å²	49.9	24%	0.242	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	108.8	174.9	-130.4	-29.2	0	0	0	109.7	K3163 G3185 A3222 Q3223 R3225	K3163-D3183 WeakPolarHBondContact CD-OD1 3.43Å; K3163-D3183 WeakPolarHBondContact CE-OD1 3.11Å; K3163-D3183 IonicContact NZ-OD1 3.26Å; K3163-D3183 PolarHBondContact NZ-OD1 2.76Å; D3183-G3185 VanDerWaalsContact C-N 3.32Å; D3183-G3185 PolarHBondContact O-N 3.28Å; D3183-G3185 PolarHBondContact OD1-N 2.96Å; D3183-G3185 VanDerWaalsContact OD1-N 3.09Å; D3183-A3222 VanDerWaalsContact O-CB 3.29Å; D3183-A3222 WeakPolarHBondContact O-CB 3.37Å; D3183-Q3223 PolarHBondContact N-O 3.08Å; D3183-R3225 IonicContact OD2-CZ 3.58Å; D3183-R3225 IonicContact OD2-NE 3.34Å; D3183-R3225 PolarHBondContact OD2-NE 3.43Å; D3183-R3225 IonicContact OD2-NH2 3.41Å; D3183-R3225 PolarHBondContact OD2-NH2 3.43Å
3184	N	75.6	Confident	66.8	Low	8 Å²	8	58.7 Å²	58.7	4%	0.043	34%	0.342	C	S	.	.			trans	-96	18.7	-177.5	-50.3	-38.6	0	0	0	112.1	V2863 L3162 T3164 Y3182 G3186 L3187	V2863-N3184 HydrophobicContact CG1-CB 4.32Å; V2863-N3184 VanDerWaalsContact CG1-ND2 3.27Å; V2863-N3184 WeakPolarHBondContact CG1-ND2 3.32Å; V2863-N3184 PolarHBondContact O-ND2 2.58Å; V2863-N3184 PolarHBondContact O-OD1 3Å; L3162-N3184 WeakPolarHBondContact O-CA 3.37Å; L3162-N3184 VanDerWaalsContact O-CB 3.24Å; L3162-N3184 WeakPolarHBondContact O-CB 3.29Å; L3162-N3184 PolarHBondContact O-N 3.22Å; L3162-N3184 PolarHBondContact O-ND2 2.91Å; T3164-N3184 PolarHBondContact N-ND2 3.37Å; T3164-N3184 PolarHBondContact OG1-ND2 3.02Å; Y3182-N3184 PolarHBondContact O-N 2.77Å; Y3182-N3184 PolarHBondContact O-OD1 2.78Å; N3184-G3186 PolarHBondContact O-N 2.8Å; N3184-G3186 VanDerWaalsContact O-N 3.11Å; N3184-L3187 HydrophobicContact CB-CD1 4.24Å; N3184-L3187 WeakPolarHBondContact O-CB 3.29Å; N3184-L3187 VanDerWaalsContact O-CG 3.25Å; N3184-L3187 WeakPolarHBondContact O-CG 3.31Å; N3184-L3187 PolarHBondContact O-N 2.84Å
3185	G	60.9	Low	64	Low	34.3333 Å²	34.3333	64.3 Å²	64.3	35%	0.354	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-60.1	-20.6	-179.2	0	0	0	0	0	115	D3183 L3187 N3188	D3183-G3185 VanDerWaalsContact C-N 3.32Å; D3183-G3185 PolarHBondContact O-N 3.28Å; D3183-G3185 PolarHBondContact OD1-N 2.96Å; D3183-G3185 VanDerWaalsContact OD1-N 3.09Å; G3185-L3187 PolarHBondContact O-N 3.2Å; G3185-N3188 PolarHBondContact O-N 2.75Å
3186	G	52.1	Low	60.9	Low	66 Å²	66	71.6 Å²	71.6	68%	0.68	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-63.4	-10	175.7	0	0	0	0	0	115.1	N3184 N3188 A3189	N3184-G3186 PolarHBondContact O-N 2.8Å; N3184-G3186 VanDerWaalsContact O-N 3.11Å; G3186-N3188 PolarHBondContact O-N 3.11Å; G3186-N3188 VanDerWaalsContact O-N 3.09Å; G3186-A3189 PolarHBondContact O-N 2.97Å
3187	L	51	Low	57.8	Low	46 Å²	46	78.8 Å²	78.8	24%	0.241	44%	0.439	C	S	.	.	G	3₁₀ helix	trans	-67.2	-1.6	176.4	-68.9	176.7	0	0	0	114.6	L2818 K2861 V2863 N3184 G3185	L2818-L3187 HydrophobicContact CD2-CB 4.05Å; L2818-L3187 HydrophobicContact CD2-CD1 4.12Å; K2861-L3187 PolarHBondContact NZ-O 3.11Å; V2863-L3187 HydrophobicContact CB-CD1 4.32Å; V2863-L3187 HydrophobicContact CG1-CD1 4.29Å; V2863-L3187 HydrophobicContact CG2-CD1 4.18Å; N3184-L3187 HydrophobicContact CB-CD1 4.24Å; N3184-L3187 WeakPolarHBondContact O-CB 3.29Å; N3184-L3187 VanDerWaalsContact O-CG 3.25Å; N3184-L3187 WeakPolarHBondContact O-CG 3.31Å; N3184-L3187 PolarHBondContact O-N 2.84Å; G3185-L3187 PolarHBondContact O-N 3.2Å
3188	N	43	Very low	54.6	Low	87.6667 Å²	87.6667	86.3 Å²	86.3	47%	0.469	48%	0.479	S	S	.	.	G	3₁₀ helix	trans	-85.5	-9.3	177.3	-80.6	-11.7	0	0	0	114.8	N2817 G3185 G3186 N3190	N2817-N3188 PolarHBondContact ND2-OD1 3.31Å; N2817-N3188 VanDerWaalsContact ND2-OD1 3.15Å; G3185-N3188 PolarHBondContact O-N 2.75Å; G3186-N3188 PolarHBondContact O-N 3.11Å; G3186-N3188 VanDerWaalsContact O-N 3.09Å; N3188-N3190 VanDerWaalsContact C-N 3.34Å; N3188-N3190 PolarHBondContact O-N 3.27Å; N3188-N3190 VanDerWaalsContact O-N 3.16Å
3189	A	38	Very low	51.4	Low	79 Å²	79	91.5 Å²	91.5	65%	0.653	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-9.6	-166.7	0	0	0	0	0	116.8	G3186	G3186-A3189 PolarHBondContact O-N 2.97Å
3190	N	34.9	Very low	48.3	Very low	149.333 Å²	149.333	99.4 Å²	99.4	80%	0.799	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.4	33.5	-170.9	-80.4	-6.1	0	0	0	115.9	N3188 G3192	N3188-N3190 VanDerWaalsContact C-N 3.34Å; N3188-N3190 PolarHBondContact O-N 3.27Å; N3188-N3190 VanDerWaalsContact O-N 3.16Å; N3190-G3192 VanDerWaalsContact C-N 3.33Å; N3190-G3192 PolarHBondContact O-N 3.15Å
3191	N	34.2	Very low	45.3	Very low	150 Å²	150	104.7 Å²	104.7	80%	0.802	60%	0.595	S	S	*	*			trans	-111.3	66.4	158.8	-91.1	-14.7	0	0	0	110.8	K3193	N3191-K3193 PolarHBondContact O-N 3.23Å; N3191-K3193 VanDerWaalsContact O-N 3.11Å
3192	G	29.8	Very low	42.4	Very low	76.3333 Å²	76.3333	112.2 Å²	112.2	79%	0.787	63%	0.633	S	S	*	*			trans	-68.8	79	161.3	0	0	0	0	0	110.8	N3190	N3190-G3192 VanDerWaalsContact C-N 3.33Å; N3190-G3192 PolarHBondContact O-N 3.15Å
3193	K	31.1	Very low	39.4	Very low	186.667 Å²	186.667	116.2 Å²	116.2	81%	0.812	66%	0.662	S	S	*	*			trans	-141	92.9	155.1	-87.3	-177.1	-176	179	0	108.4	N3191 N3195	N3191-K3193 PolarHBondContact O-N 3.23Å; N3191-K3193 VanDerWaalsContact O-N 3.11Å; K3193-N3195 VanDerWaalsContact C-N 3.26Å; K3193-N3195 PolarHBondContact O-N 3.31Å; K3193-N3195 VanDerWaalsContact O-N 3.08Å
3194	R	28.7	Very low	36.7	Very low	235 Å²	235	118.4 Å²	118.4	89%	0.887	68%	0.681	S	S	*	*			trans	-54.5	98.9	164.7	-77	177.6	170.9	170.7	-3	108.9	H3196	R3194-H3196 PolarHBondContact O-N 2.93Å
3195	N	28.9	Very low	34.7	Very low	137 Å²	137	124.1 Å²	124.1	73%	0.733	72%	0.718	S	S	*	*			trans	-95.1	100.5	158.5	-83.2	-7.1	0	0	0	107.5	K3193 L3197	K3193-N3195 VanDerWaalsContact C-N 3.26Å; K3193-N3195 PolarHBondContact O-N 3.31Å; K3193-N3195 VanDerWaalsContact O-N 3.08Å; N3195-L3197 PolarHBondContact O-N 2.97Å; N3195-L3197 VanDerWaalsContact O-N 3.16Å
3196	H	27.8	Very low	33.1	Very low	179.333 Å²	179.333	130.5 Å²	130.5	83%	0.83	74%	0.741	S	S	*	*			trans	-60.2	98.3	161.3	-91.9	-74.9	0	0	0	108.5	R3194	R3194-H3196 PolarHBondContact O-N 2.93Å
3197	L	30.4	Very low	32	Very low	151 Å²	151	134.7 Å²	134.7	79%	0.791	75%	0.748	S	S	*	*			trans	-128.6	106.2	164.2	-81.2	165.6	0	0	0	108.8	N3195 S3199	N3195-L3197 PolarHBondContact O-N 2.97Å; N3195-L3197 VanDerWaalsContact O-N 3.16Å; L3197-S3199 PolarHBondContact O-N 3.37Å
3198	N	27.9	Very low	30.9	Very low	156 Å²	156	136.7 Å²	136.7	83%	0.834	77%	0.766	S	S	*	*			trans	-0.6	111.2	166.6	-66.6	-21.4	0	0	0	116.4	N3200	N3198-N3200 PolarHBondContact O-N 3.07Å; N3198-N3200 VanDerWaalsContact O-N 3.08Å
3199	S	29.2	Very low	30.4	Very low	110.667 Å²	110.667	141.8 Å²	141.8	77%	0.774	78%	0.784	S	S	*	*			trans	-69.1	109.1	159.3	56.9	0	0	0	0	110.2	L3197	L3197-S3199 PolarHBondContact O-N 3.37Å
3200	N	29.7	Very low	30	Very low	165.667 Å²	165.667	144.7 Å²	144.7	89%	0.886	79%	0.789	S	S	*	*			trans	-162.6	67.2	154.9	-94.3	-11.4	0	0	0	109.4	N3198	N3198-N3200 PolarHBondContact O-N 3.07Å; N3198-N3200 VanDerWaalsContact O-N 3.08Å
3201	S	31.2	Very low	30.1	Very low	111 Å²	111	144.3 Å²	144.3	78%	0.776	79%	0.786	S	S	*	*	S	Bend	trans	-140.6	112.3	163.4	62.6	0	0	0	0	110
3202	I	31	Very low	29.9	Very low	160 Å²	160	143.5 Å²	143.5	82%	0.821	78%	0.782	S	S	*	*			trans	-28.8	120.5	170.8	-60	163	0	0	0	111.9	S3204	I3202-S3204 PolarHBondContact O-N 3.29Å; I3202-S3204 VanDerWaalsContact O-N 3.12Å
3203	P	28.6	Very low	29.9	Very low	106.5 Å²	106.5	148.5 Å²	148.5	69%	0.692	79%	0.785	S	S	*	*			trans	-69.8	112.9	-179.2	-8.4	21.6	0	0	0	110.5
3204	S	26.5	Very low	29.9	Very low	90.5 Å²	90.5	149.4 Å²	149.4	63%	0.633	79%	0.789	S	S	*	*			trans	-69.1	139	159.2	-62.8	0	0	0	0	108.3	I3202 M3206 N3207	I3202-S3204 PolarHBondContact O-N 3.29Å; I3202-S3204 VanDerWaalsContact O-N 3.12Å; S3204-M3206 PolarHBondContact O-N 2.86Å; S3204-N3207 PolarHBondContact O-N 3.19Å
3205	P	33.3	Very low	29.8	Very low	128 Å²	128	146.4 Å²	146.4	83%	0.831	79%	0.785	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	35	-170.4	29.3	-32.8	0	0	0	114.4
3206	M	28.2	Very low	29.9	Very low	169.5 Å²	169.5	147.9 Å²	147.9	84%	0.835	79%	0.787	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.6	-2.6	171.6	-88.6	-179.4	69.4	0	0	114.3	S3204	S3204-M3206 PolarHBondContact O-N 2.86Å
3207	N	28.9	Very low	30	Very low	154 Å²	154	145.3 Å²	145.3	82%	0.824	78%	0.78	S	S	*	*	S	Bend	trans	-123.5	26.3	179.1	-77.2	-8.9	0	0	0	114.6	S3204 F3209	S3204-N3207 PolarHBondContact O-N 3.19Å; N3207-F3209 VanDerWaalsContact C-N 3.31Å; N3207-F3209 PolarHBondContact O-N 2.94Å
3208	S	27.3	Very low	30.2	Very low	88.5 Å²	88.5	143 Å²	143	62%	0.619	78%	0.776	S	S	*	*			trans	-96	68	174.4	68.6	0	0	0	0	112
3209	F	33.5	Very low	30.6	Very low	193.5 Å²	193.5	143.6 Å²	143.6	85%	0.849	78%	0.779	S	S	*	*			trans	-127.9	95.5	147.9	-101.1	-87.2	0	0	0	105.2	N3207 D3211	N3207-F3209 VanDerWaalsContact C-N 3.31Å; N3207-F3209 PolarHBondContact O-N 2.94Å; F3209-D3211 PolarHBondContact O-N 2.9Å; F3209-D3211 VanDerWaalsContact O-N 3.08Å
3210	D	29.4	Very low	31	Very low	140.5 Å²	140.5	143.9 Å²	143.9	75%	0.751	78%	0.777	S	S	*	*			trans	-57.1	113.9	173.5	-86.5	-42.2	0	0	0	109.1	N3212	D3210-N3212 PolarHBondContact O-N 3.32Å
3211	D	37.3	Very low	31.9	Very low	140 Å²	140	141.3 Å²	141.3	75%	0.749	77%	0.771	S	S	*	*			trans	-72.3	20.5	179.2	-135.9	0.2	0	0	0	112.8	F3209	F3209-D3211 PolarHBondContact O-N 2.9Å; F3209-D3211 VanDerWaalsContact O-N 3.08Å
3212	N	29.1	Very low	33.1	Very low	134 Å²	134	138 Å²	138	72%	0.717	75%	0.751	S	S	*	*			trans	-109.8	19	-166.2	-79	-17.6	0	0	0	115.3	D3210	D3210-N3212 PolarHBondContact O-N 3.32Å
3213	Q	29.4	Very low	35.1	Very low	181.5 Å²	181.5	136.3 Å²	136.3	85%	0.848	74%	0.739	S	S	*	*	S	Bend	trans	-119.7	25.4	174.3	-107.8	-175.9	16.1	0	0	115.4
3214	F	32.8	Very low	37.9	Very low	205 Å²	205	133.8 Å²	133.8	90%	0.899	72%	0.718	S	S	*	*			trans	-125.9	71.5	166.6	-83.9	-81.5	0	0	0	111.7
3215	H	26.3	Very low	41	Very low	171.5 Å²	171.5	133.9 Å²	133.9	79%	0.794	70%	0.704	S	S	*	*			trans	-93.9	104.2	156.6	-85.5	-74.2	0	0	0	108
3216	H	29.5	Very low	43.9	Very low	169.5 Å²	169.5	127.8 Å²	127.8	79%	0.785	67%	0.665	S	S	*	*			trans	-160.5	122.3	150.9	-100.3	-66.9	0	0	0	111.8
3217	D	30.5	Very low	47.1	Very low	125.5 Å²	125.5	120 Å²	120	67%	0.671	63%	0.626	S	S	*	*			trans	29	112.8	159.3	-56.4	-38.3	0	0	0	120.9	N3219 T3220	D3217-N3219 PolarHBondContact O-N 3.15Å; D3217-N3219 VanDerWaalsContact O-N 3.08Å; D3217-T3220 PolarHBondContact O-OG1 3.38Å
3218	S	34.5	Very low	50.3	Low	102 Å²	102	112.6 Å²	112.6	71%	0.713	59%	0.587	S	S	*	*	S	Bend	trans	-69.8	88.5	168.9	55.3	0	0	0	0	112.3
3219	N	35.9	Very low	53.5	Low	169 Å²	169	108.4 Å²	108.4	90%	0.904	56%	0.557	S	S	*	*			trans	-174.2	16.3	150.6	-104.1	-5.8	0	0	0	113.8	D3217	D3217-N3219 PolarHBondContact O-N 3.15Å; D3217-N3219 VanDerWaalsContact O-N 3.08Å
3220	T	38.9	Very low	56.5	Low	117 Å²	117	99.2 Å²	99.2	72%	0.718	52%	0.517	S	S	*	.			trans	-92.5	123.3	-166	33.2	0	0	0	0	112.3	D3217 A3222	D3217-T3220 PolarHBondContact O-OG1 3.38Å; T3220-A3222 PolarHBondContact O-N 3.18Å
3221	S	48.8	Very low	59.7	Low	110.5 Å²	110.5	92.6 Å²	92.6	77%	0.773	48%	0.481	S	S	*	.			trans	-43	138	159.7	39.4	0	0	0	0	110.4	Q3223	S3221-Q3223 PolarHBondContact O-N 2.95Å; S3221-Q3223 VanDerWaalsContact O-N 3.09Å
3222	A	55.4	Low	62.4	Low	41.5 Å²	41.5	86.2 Å²	86.2	34%	0.343	45%	0.448	S	S	.	.			trans	-45.5	124.3	174	0	0	0	0	0	109.5	D3183 T3220 K3224	D3183-A3222 VanDerWaalsContact O-CB 3.29Å; D3183-A3222 WeakPolarHBondContact O-CB 3.37Å; T3220-A3222 PolarHBondContact O-N 3.18Å; A3222-K3224 PolarHBondContact O-N 3.09Å
3223	Q	72.7	Confident	65.3	Low	124.5 Å²	124.5	82.2 Å²	82.2	58%	0.582	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.2	108.3	-178.8	-170.3	-178.2	13.4	0	0	108.2	D3183 S3221	D3183-Q3223 PolarHBondContact N-O 3.08Å; S3221-Q3223 PolarHBondContact O-N 2.95Å; S3221-Q3223 VanDerWaalsContact O-N 3.09Å
3224	K	87.9	Confident	68.2	Low	54 Å²	54	75.8 Å²	75.8	24%	0.235	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	130.3	175.9	-174.6	-174	124.4	-176.7	0	109.2	E2884 E3180 Q3181 Y3182 A3222	E2884-K3224 IonicContact OE1-NZ 3.25Å; E2884-K3224 PolarHBondContact OE1-NZ 2.8Å; E2884-K3224 IonicContact OE2-NZ 2.93Å; E2884-K3224 PolarHBondContact OE2-NZ 3.14Å; E3180-K3224 HydrophobicContact CB-CD 4.44Å; E3180-K3224 HydrophobicContact CB-CG 4.46Å; E3180-K3224 VanDerWaalsContact CD-CE 3.47Å; E3180-K3224 WeakPolarHBondContact OE1-CE 3.18Å; E3180-K3224 IonicContact OE1-NZ 2.78Å; E3180-K3224 PolarHBondContact OE1-NZ 3.18Å; Q3181-K3224 CarbonylContact O-C 3.57Å; Q3181-K3224 WeakPolarHBondContact O-CA 3.23Å; Y3182-K3224 HydrophobicContact CD1-CB 4.2Å; Y3182-K3224 HydrophobicContact CD1-CG 4.25Å; Y3182-K3224 HydrophobicContact CE1-CB 4.06Å; Y3182-K3224 HydrophobicContact CE1-CD 3.91Å; Y3182-K3224 HydrophobicContact CE1-CG 3.78Å; Y3182-K3224 WeakPolarHBondContact OH-CD 3.43Å; A3222-K3224 PolarHBondContact O-N 3.09Å
3225	R	91	Very high	71.1	Confident	91.5 Å²	91.5	66.1 Å²	66.1	35%	0.345	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	136.3	171.3	-61.1	-176.4	-170.2	-174.3	1.9	109.6	E3180 Q3181 D3183 F3227	E3180-R3225 WeakPolarHBondContact CA-O 3.28Å; Q3181-R3225 PolarHBondContact N-O 3.24Å; Q3181-R3225 PolarHBondContact O-N 3.08Å; D3183-R3225 IonicContact OD2-CZ 3.58Å; D3183-R3225 IonicContact OD2-NE 3.34Å; D3183-R3225 PolarHBondContact OD2-NE 3.43Å; D3183-R3225 IonicContact OD2-NH2 3.41Å; D3183-R3225 PolarHBondContact OD2-NH2 3.43Å; R3225-F3227 HydrophobicContact CB-CE2 3.87Å; R3225-F3227 HydrophobicContact CB-CZ 4.47Å
3226	V	94	Very high	74.4	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.006	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	137.9	178.2	-177.5	0	0	0	0	110.3	F2885 Y2898 E3180 E3243	F2885-V3226 HydrophobicContact CE1-CG1 4.4Å; F2885-V3226 HydrophobicContact CZ-CG1 3.64Å; Y2898-V3226 HydrophobicContact CE1-CB 4.33Å; Y2898-V3226 HydrophobicContact CE1-CG2 4.32Å; Y2898-V3226 HydrophobicContact CE2-CG2 4.17Å; Y2898-V3226 WeakPolarHBondContact OH-CG2 3.42Å; E3180-V3226 HydrophobicContact CG-CG1 4.48Å; E3180-V3226 HydrophobicContact CG-CG2 4.17Å; V3226-E3243 HydrophobicContact CB-CB 4.15Å; V3226-E3243 PolarHBondContact N-OE2 3.23Å; V3226-E3243 WeakPolarHBondContact O-CB 3.45Å; V3226-E3243 PolarHBondContact O-N 3.29Å
3227	F	95.2	Very high	77.5	Confident	4.5 Å²	4.5	49.8 Å²	49.8	2%	0.02	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	135.9	172.2	-63.1	-92.3	0	0	0	110.6	A3178 L3179 Q3181 R3225 F3241 S3242 A3248 E3277 V3278	A3178-F3227 CarbonylContact C-O 3.54Å; A3178-F3227 WeakPolarHBondContact CA-O 3.17Å; A3178-F3227 WeakPolarHBondContact CB-O 3.17Å; L3179-F3227 HydrophobicContact CB-CB 4.48Å; L3179-F3227 HydrophobicContact CD1-CB 3.87Å; L3179-F3227 HydrophobicContact CD1-CD2 3.7Å; L3179-F3227 HydrophobicContact CD1-CG 4.18Å; L3179-F3227 HydrophobicContact CD2-CB 3.96Å; L3179-F3227 HydrophobicContact CD2-CD2 3.47Å; L3179-F3227 VanDerWaalsContact CD2-CD2 3.47Å; L3179-F3227 HydrophobicContact CD2-CE2 4.33Å; L3179-F3227 HydrophobicContact CD2-CG 4.06Å; L3179-F3227 HydrophobicContact CG-CB 3.97Å; L3179-F3227 PolarHBondContact N-O 3.12Å; L3179-F3227 PolarHBondContact O-N 3.02Å; Q3181-F3227 HydrophobicContact CB-CE2 4.28Å; R3225-F3227 HydrophobicContact CB-CE2 3.87Å; R3225-F3227 HydrophobicContact CB-CZ 4.47Å; F3227-F3241 CarbonylContact C-O 3.56Å; F3227-F3241 WeakPolarHBondContact CA-O 3.26Å; F3227-F3241 WeakPolarHBondContact CB-O 3.31Å; F3227-S3242 VanDerWaalsContact CD1-CA 3.42Å; F3227-A3248 HydrophobicContact CD1-CB 3.95Å; F3227-A3248 HydrophobicContact CE1-CB 3.72Å; F3227-E3277 HydrophobicContact CE1-CG 4.28Å; F3227-E3277 HydrophobicContact CZ-CG 4.22Å; F3227-V3278 HydrophobicContact CB-CG1 4.28Å; F3227-V3278 HydrophobicContact CB-CG2 4.4Å; F3227-V3278 HydrophobicContact CD1-CB 4.4Å; F3227-V3278 HydrophobicContact CD1-CG1 4.45Å; F3227-V3278 HydrophobicContact CD1-CG2 3.15Å; F3227-V3278 HydrophobicContact CD2-CG1 4.26Å; F3227-V3278 HydrophobicContact CD2-CG2 3.81Å; F3227-V3278 HydrophobicContact CE1-CG2 3.09Å; F3227-V3278 HydrophobicContact CE2-CG2 3.74Å; F3227-V3278 HydrophobicContact CG-CB 4.45Å; F3227-V3278 HydrophobicContact CG-CG1 4.08Å; F3227-V3278 HydrophobicContact CG-CG2 3.52Å; F3227-V3278 VanDerWaalsContact CG-CG2 3.47Å; F3227-V3278 HydrophobicContact CZ-CG2 3.4Å; F3227-V3278 VanDerWaalsContact CZ-CG2 3.48Å
3228	F	96.3	Very high	80.5	Confident	0 Å²	0	44 Å²	44	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	131.6	173.9	-65.4	-89.3	0	0	0	109.9	F2885 Y2898 M2903 L2905 L2920 A3240 F3241	F2885-F3228 AromaticContact CE1-CE1 3.8Å; F2885-F3228 HydrophobicContact CE1-CE1 3.8Å; F2885-F3228 HydrophobicContact CE1-CZ 4.14Å; Y2898-F3228 HydrophobicContact CD1-CE2 4.41Å; Y2898-F3228 HydrophobicContact CD1-CZ 4.09Å; Y2898-F3228 HydrophobicContact CG-CZ 4.06Å; M2903-F3228 HydrophobicContact CB-CD2 4.45Å; M2903-F3228 HydrophobicContact CB-CE1 4.2Å; M2903-F3228 HydrophobicContact CB-CE2 3.51Å; M2903-F3228 VanDerWaalsContact CB-CE2 3.5Å; M2903-F3228 HydrophobicContact CB-CZ 3.37Å; M2903-F3228 HydrophobicContact CE-CD2 4.12Å; M2903-F3228 HydrophobicContact CE-CE2 4.15Å; M2903-F3228 HydrophobicContact CG-CE2 3.91Å; M2903-F3228 HydrophobicContact CG-CZ 4.26Å; L2905-F3228 HydrophobicContact CB-CD1 4.46Å; L2920-F3228 HydrophobicContact CD1-CB 3.94Å; L2920-F3228 HydrophobicContact CD1-CD1 3.95Å; L2920-F3228 HydrophobicContact CD1-CD2 4.42Å; L2920-F3228 HydrophobicContact CD1-CG 3.83Å; L2920-F3228 HydrophobicContact CD2-CB 4.14Å; F3228-A3240 CarbonylContact O-C 3.57Å; F3228-A3240 VanDerWaalsContact O-CA 3.3Å; F3228-A3240 WeakPolarHBondContact O-CA 3.35Å; F3228-F3241 HydrophobicContact CB-CB 4.42Å; F3228-F3241 PolarHBondContact N-O 3.25Å; F3228-F3241 PolarHBondContact O-N 3.09Å
3229	I	96.1	Very high	83.3	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	119.9	-179.2	-50.2	-56.8	0	0	0	109.3	V3176 F3177 L3179 T3231 P3237 A3239 A3240 L3280	V3176-I3229 HydrophobicContact CG1-CB 4.25Å; V3176-I3229 HydrophobicContact CG1-CG2 3.75Å; V3176-I3229 HydrophobicContact CG2-CB 4.37Å; V3176-I3229 HydrophobicContact CG2-CG1 4.2Å; F3177-I3229 PolarHBondContact O-N 3.3Å; L3179-I3229 HydrophobicContact CB-CD1 4.22Å; L3179-I3229 HydrophobicContact CB-CG1 4.27Å; L3179-I3229 HydrophobicContact CD2-CD1 3.71Å; L3179-I3229 HydrophobicContact CD2-CG1 4.09Å; L3179-I3229 HydrophobicContact CG-CD1 4.26Å; L3179-I3229 HydrophobicContact CG-CG1 4.42Å; I3229-T3231 HydrophobicContact CG2-CG2 4.28Å; I3229-P3237 HydrophobicContact CG2-CB 3.82Å; I3229-P3237 HydrophobicContact CG2-CG 4.27Å; I3229-A3239 WeakPolarHBondContact CA-O 3.22Å; I3229-A3240 HydrophobicContact CD1-CB 3.58Å; I3229-L3280 HydrophobicContact CD1-CD2 4.09Å; I3229-L3280 HydrophobicContact CG1-CD2 4.16Å; I3229-L3280 HydrophobicContact CG2-CD2 4.07Å
3230	I	96	Very high	86	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	132.4	172.1	-47.1	-54.8	0	0	0	107.8	L2905 C2918 L2920 Y2931 L2933 P3237 T3238 A3239 F3241	L2905-I3230 HydrophobicContact CD1-CD1 3.39Å; C2918-I3230 HydrophobicContact CB-CG2 4.45Å; L2920-I3230 HydrophobicContact CB-CD1 3.95Å; L2920-I3230 HydrophobicContact CD2-CD1 4.43Å; Y2931-I3230 HydrophobicContact CD1-CB 4.4Å; Y2931-I3230 HydrophobicContact CD1-CG1 4.18Å; Y2931-I3230 HydrophobicContact CD1-CG2 3.83Å; Y2931-I3230 HydrophobicContact CE1-CB 4.4Å; Y2931-I3230 HydrophobicContact CE1-CG2 3.77Å; Y2931-I3230 HydrophobicContact CG-CG1 4.28Å; L2933-I3230 HydrophobicContact CD1-CG2 4.48Å; I3230-P3237 CarbonylContact O-C 3.51Å; I3230-P3237 WeakPolarHBondContact O-CA 3.26Å; I3230-T3238 PolarHBondContact O-N 3.18Å; I3230-T3238 PolarHBondContact O-OG1 2.93Å; I3230-A3239 HydrophobicContact CB-CB 4.25Å; I3230-A3239 HydrophobicContact CG1-CB 4.21Å; I3230-A3239 PolarHBondContact N-O 3.09Å; I3230-A3239 PolarHBondContact O-N 2.91Å; I3230-F3241 HydrophobicContact CG1-CD2 4.31Å; I3230-F3241 HydrophobicContact CG1-CE2 4.31Å
3231	T	95.8	Very high	88.6	Confident	1.5 Å²	1.5	26 Å²	26	1%	0.009	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	149.7	177.8	56.3	0	0	0	0	110.6	R2907 H3175 V3176 I3229 S3236 P3237	R2907-T3231 PolarHBondContact NH2-OG1 2.74Å; H3175-T3231 HydrophobicContact CB-CG2 4.32Å; V3176-T3231 HydrophobicContact CG1-CG2 3.88Å; V3176-T3231 WeakPolarHBondContact O-CG2 3.38Å; I3229-T3231 HydrophobicContact CG2-CG2 4.28Å; T3231-S3236 CarbonylContact C-O 3.52Å; T3231-S3236 VanDerWaalsContact CA-O 3.23Å; T3231-S3236 WeakPolarHBondContact CA-O 3.34Å; T3231-P3237 HydrophobicContact CG2-CG 4.39Å
3232	N	94	Very high	90.7	Very high	7 Å²	7	21.2 Å²	21.2	4%	0.037	10%	0.103	C	C	.	.			trans	-76.4	-174.9	169	76.7	-6.2	0	0	0	111.6	L2933 E3234 G3235 S3236 T3238	L2933-N3232 HydrophobicContact CD1-CB 4.44Å; N3232-E3234 PolarHBondContact O-N 3.11Å; N3232-E3234 PolarHBondContact OD1-N 2.8Å; N3232-E3234 VanDerWaalsContact OD1-N 3.08Å; N3232-G3235 PolarHBondContact O-N 3.09Å; N3232-G3235 VanDerWaalsContact O-N 3.08Å; N3232-G3235 PolarHBondContact OD1-N 2.82Å; N3232-S3236 PolarHBondContact N-O 3.4Å; N3232-S3236 VanDerWaalsContact OD1-CB 3.26Å; N3232-S3236 WeakPolarHBondContact OD1-CB 3.37Å; N3232-S3236 PolarHBondContact OD1-N 3.21Å; N3232-S3236 PolarHBondContact OD1-OG 2.98Å; N3232-T3238 HydrophobicContact CB-CG2 4.04Å
3233	H	90	Very high	92.3	Very high	49 Å²	49	20.7 Å²	20.7	23%	0.227	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-21.4	-179.5	62.6	-75	0	0	0	114.8	L2935 H3175	L2935-H3233 HydrophobicContact CD1-CB 3.8Å; H3175-H3233 PolarHBondContact CE1-O 3.22Å
3234	E	91.4	Very high	93.1	Very high	48 Å²	48	19.8 Å²	19.8	22%	0.224	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-0.1	176.4	-59.3	177.3	136.9	0	0	112.5	N3232 S3236 H3284 A3285 T3350	N3232-E3234 PolarHBondContact O-N 3.11Å; N3232-E3234 PolarHBondContact OD1-N 2.8Å; N3232-E3234 VanDerWaalsContact OD1-N 3.08Å; E3234-S3236 VanDerWaalsContact C-N 3.35Å; E3234-H3284 IonicContact OE1-CE1 2.83Å; E3234-H3284 IonicContact OE2-CE1 3.37Å; E3234-H3284 PolarHBondContact OE2-CE1 3.25Å; E3234-H3284 IonicContact OE2-ND1 3.49Å; E3234-H3284 PolarHBondContact OE2-ND1 3.21Å; E3234-A3285 WeakPolarHBondContact O-CA 3.37Å; E3234-T3350 HydrophobicContact CB-CG2 4.03Å; E3234-T3350 HydrophobicContact CG-CG2 4.48Å
3235	G	93.2	Very high	93.1	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.087	C	C	.	.			trans	81.7	14.7	-176.3	0	0	0	0	0	114.1	H3175 N3232 P3237 S3286	H3175-G3235 VanDerWaalsContact CE1-CA 3.5Å; H3175-G3235 WeakPolarHBondContact CE1-CA 3.36Å; H3175-G3235 PolarHBondContact CE1-N 3.11Å; H3175-G3235 VanDerWaalsContact CE1-N 3.31Å; H3175-G3235 VanDerWaalsContact CG-CA 3.49Å; H3175-G3235 WeakPolarHBondContact ND1-CA 3.28Å; N3232-G3235 PolarHBondContact O-N 3.09Å; N3232-G3235 VanDerWaalsContact O-N 3.08Å; N3232-G3235 PolarHBondContact OD1-N 2.82Å; G3235-P3237 WeakPolarHBondContact O-CD 3.34Å; G3235-S3286 PolarHBondContact O-N 2.99Å; G3235-S3286 PolarHBondContact O-OG 3Å
3236	S	95	Very high	93	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.102	C	C	.	.			trans	-79	124.3	176.1	-48.2	0	0	0	0	110.3	T3231 N3232 E3234 T3238 H3284 A3285	T3231-S3236 CarbonylContact C-O 3.52Å; T3231-S3236 VanDerWaalsContact CA-O 3.23Å; T3231-S3236 WeakPolarHBondContact CA-O 3.34Å; N3232-S3236 PolarHBondContact N-O 3.4Å; N3232-S3236 VanDerWaalsContact OD1-CB 3.26Å; N3232-S3236 WeakPolarHBondContact OD1-CB 3.37Å; N3232-S3236 PolarHBondContact OD1-N 3.21Å; N3232-S3236 PolarHBondContact OD1-OG 2.98Å; E3234-S3236 VanDerWaalsContact C-N 3.35Å; S3236-T3238 PolarHBondContact O-N 3.38Å; S3236-H3284 WeakPolarHBondContact OG-CA 3.26Å; S3236-A3285 PolarHBondContact OG-N 2.92Å
3237	P	95.1	Very high	92.7	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	118.2	178.6	-24.7	35.4	0	0	0	113.5	V3176 I3229 I3230 T3231 G3235 W3249 A3251 Y3253 L3280 L3282 G3283	V3176-P3237 HydrophobicContact CG1-CG 4.22Å; I3229-P3237 HydrophobicContact CG2-CB 3.82Å; I3229-P3237 HydrophobicContact CG2-CG 4.27Å; I3230-P3237 CarbonylContact O-C 3.51Å; I3230-P3237 WeakPolarHBondContact O-CA 3.26Å; T3231-P3237 HydrophobicContact CG2-CG 4.39Å; G3235-P3237 WeakPolarHBondContact O-CD 3.34Å; P3237-W3249 HydrophobicContact CB-CH2 3.92Å; P3237-W3249 HydrophobicContact CB-CZ3 4.16Å; P3237-W3249 WeakPolarHBondContact O-CH2 3.48Å; P3237-W3249 WeakPolarHBondContact O-CZ3 3.25Å; P3237-A3251 WeakPolarHBondContact O-CB 2.99Å; P3237-Y3253 WeakPolarHBondContact CD-OH 3.45Å; P3237-Y3253 WeakPolarHBondContact O-CE2 3.39Å; P3237-Y3253 VanDerWaalsContact O-CZ 3.29Å; P3237-Y3253 PolarHBondContact O-OH 3.11Å; P3237-L3280 HydrophobicContact CB-CD2 3.78Å; P3237-L3280 HydrophobicContact CG-CD2 3.94Å; P3237-L3282 HydrophobicContact CG-CB 4.09Å; P3237-G3283 VanDerWaalsContact CD-O 3.22Å; P3237-G3283 WeakPolarHBondContact CD-O 3.47Å
3238	T	93.4	Very high	92.4	Very high	4 Å²	4	22.8 Å²	22.8	3%	0.025	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	-28.8	179.4	57.3	0	0	0	0	113.1	Y2931 L2933 I3230 N3232 S3236 A3250 A3251	Y2931-T3238 PolarHBondContact OH-OG1 2.76Å; L2933-T3238 HydrophobicContact CD1-CG2 4.25Å; I3230-T3238 PolarHBondContact O-N 3.18Å; I3230-T3238 PolarHBondContact O-OG1 2.93Å; N3232-T3238 HydrophobicContact CB-CG2 4.04Å; S3236-T3238 PolarHBondContact O-N 3.38Å; T3238-A3250 CarbonylContact O-C 3.54Å; T3238-A3250 VanDerWaalsContact O-CA 3.28Å; T3238-A3250 WeakPolarHBondContact O-CA 3.37Å; T3238-A3251 PolarHBondContact O-N 3Å
3239	A	93	Very high	92	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	152.5	177.2	0	0	0	0	0	112.6	Y2931 I3229 I3230 F3241 L3247 W3249 A3250	Y2931-A3239 HydrophobicContact CD2-CB 4.04Å; Y2931-A3239 HydrophobicContact CE2-CB 3.73Å; I3229-A3239 WeakPolarHBondContact CA-O 3.22Å; I3230-A3239 HydrophobicContact CB-CB 4.25Å; I3230-A3239 HydrophobicContact CG1-CB 4.21Å; I3230-A3239 PolarHBondContact N-O 3.09Å; I3230-A3239 PolarHBondContact O-N 2.91Å; A3239-F3241 HydrophobicContact CB-CD2 4.32Å; A3239-F3241 HydrophobicContact CB-CE2 3.79Å; A3239-L3247 HydrophobicContact CB-CD1 4.12Å; A3239-W3249 CarbonylContact C-O 3.41Å; A3239-W3249 WeakPolarHBondContact CA-O 3.27Å; A3239-A3250 HydrophobicContact CB-CB 4.38Å
3240	A	93.6	Very high	91.7	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	131.3	169.8	0	0	0	0	0	111.1	F3228 I3229 A3248 W3249	F3228-A3240 CarbonylContact O-C 3.57Å; F3228-A3240 VanDerWaalsContact O-CA 3.3Å; F3228-A3240 WeakPolarHBondContact O-CA 3.35Å; I3229-A3240 HydrophobicContact CD1-CB 3.58Å; A3240-A3248 HydrophobicContact CB-CB 4.35Å; A3240-A3248 WeakPolarHBondContact O-CB 3.28Å; A3240-A3248 PolarHBondContact O-N 3.22Å; A3240-W3249 HydrophobicContact CB-CB 3.79Å; A3240-W3249 HydrophobicContact CB-CD2 3.91Å; A3240-W3249 HydrophobicContact CB-CE3 4.5Å; A3240-W3249 HydrophobicContact CB-CG 4.33Å; A3240-W3249 HydrophobicContact CB-CH2 4.08Å; A3240-W3249 HydrophobicContact CB-CZ2 3.49Å; A3240-W3249 VanDerWaalsContact CB-CZ2 3.49Å; A3240-W3249 PolarHBondContact N-O 3.1Å; A3240-W3249 PolarHBondContact O-N 3.1Å
3241	F	93.4	Very high	91.3	Very high	8 Å²	8	23.3 Å²	23.3	4%	0.035	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	136.6	179	-73.3	-97.2	0	0	0	110.5	L2920 L2930 Y2931 F3227 F3228 I3230 A3239 G3245 K3246 L3247	L2920-F3241 HydrophobicContact CD2-CB 3.53Å; L2920-F3241 HydrophobicContact CD2-CD1 4.13Å; L2920-F3241 HydrophobicContact CD2-CD2 3.6Å; L2920-F3241 HydrophobicContact CD2-CE2 4.31Å; L2920-F3241 HydrophobicContact CD2-CG 3.48Å; L2920-F3241 VanDerWaalsContact CD2-CG 3.48Å; L2930-F3241 HydrophobicContact CB-CD1 4.48Å; L2930-F3241 HydrophobicContact CB-CE1 4.2Å; Y2931-F3241 AromaticContact CD2-CE2 3.63Å; Y2931-F3241 HydrophobicContact CD2-CE2 3.63Å; Y2931-F3241 AromaticContact CD2-CZ 3.74Å; Y2931-F3241 HydrophobicContact CD2-CZ 3.74Å; Y2931-F3241 AromaticContact CG-CE2 3.94Å; Y2931-F3241 HydrophobicContact CG-CE2 3.94Å; Y2931-F3241 HydrophobicContact CG-CZ 4.2Å; F3227-F3241 CarbonylContact C-O 3.56Å; F3227-F3241 WeakPolarHBondContact CA-O 3.26Å; F3227-F3241 WeakPolarHBondContact CB-O 3.31Å; F3228-F3241 HydrophobicContact CB-CB 4.42Å; F3228-F3241 PolarHBondContact N-O 3.25Å; F3228-F3241 PolarHBondContact O-N 3.09Å; I3230-F3241 HydrophobicContact CG1-CD2 4.31Å; I3230-F3241 HydrophobicContact CG1-CE2 4.31Å; A3239-F3241 HydrophobicContact CB-CD2 4.32Å; A3239-F3241 HydrophobicContact CB-CE2 3.79Å; F3241-G3245 WeakPolarHBondContact CD1-O 3.38Å; F3241-K3246 CarbonylContact C-O 3.57Å; F3241-K3246 WeakPolarHBondContact CA-O 3.38Å; F3241-L3247 HydrophobicContact CD1-CB 4.16Å; F3241-L3247 HydrophobicContact CD1-CD1 4.42Å; F3241-L3247 HydrophobicContact CD2-CD1 4.25Å; F3241-L3247 HydrophobicContact CE1-CB 3.81Å; F3241-L3247 HydrophobicContact CE1-CD1 3.98Å; F3241-L3247 HydrophobicContact CE1-CG 4.46Å; F3241-L3247 HydrophobicContact CE2-CD1 3.77Å; F3241-L3247 HydrophobicContact CZ-CB 4.29Å; F3241-L3247 HydrophobicContact CZ-CD1 3.63Å; F3241-L3247 HydrophobicContact CZ-CG 4.48Å
3242	S	91.7	Very high	90.8	Very high	11 Å²	11	25.5 Å²	25.5	8%	0.077	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	161.4	169.4	65.3	0	0	0	0	111.6	F3227 N3244 G3245 K3246	F3227-S3242 VanDerWaalsContact CD1-CA 3.42Å; S3242-N3244 PolarHBondContact O-N 2.98Å; S3242-G3245 PolarHBondContact O-N 3.01Å; S3242-K3246 PolarHBondContact N-O 3.37Å; S3242-K3246 WeakPolarHBondContact OG-CB 3.42Å; S3242-K3246 PolarHBondContact OG-N 3.12Å; S3242-K3246 VanDerWaalsContact OG-N 3.14Å; S3242-K3246 PolarHBondContact OG-O 3.1Å
3243	E	90.2	Very high	90.6	Very high	31.5 Å²	31.5	26.5 Å²	26.5	15%	0.147	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-14.1	173.4	65.2	178.4	-148.9	0	0	115.2	Y2898 K2901 M2903 V3226	Y2898-E3243 HydrophobicContact CE1-CB 4.15Å; Y2898-E3243 PolarHBondContact OH-OE2 2.79Å; K2901-E3243 HydrophobicContact CB-CB 4.41Å; K2901-E3243 VanDerWaalsContact CB-O 3.32Å; K2901-E3243 WeakPolarHBondContact CB-O 3.43Å; K2901-E3243 VanDerWaalsContact CE-OE1 3.28Å; K2901-E3243 WeakPolarHBondContact CE-OE1 3.43Å; K2901-E3243 HydrophobicContact CG-CB 4.06Å; K2901-E3243 HydrophobicContact CG-CG 4.21Å; K2901-E3243 IonicContact NZ-OE1 3.89Å; M2903-E3243 WeakPolarHBondContact CG-O 3.41Å; V3226-E3243 HydrophobicContact CB-CB 4.15Å; V3226-E3243 PolarHBondContact N-OE2 3.23Å; V3226-E3243 WeakPolarHBondContact O-CB 3.45Å; V3226-E3243 PolarHBondContact O-N 3.29Å
3244	N	89	Confident	90.5	Very high	105 Å²	105	24.8 Å²	24.8	56%	0.561	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.4	10.6	175.2	-57.3	-48.3	0	0	0	112.7	S3242 K3246	S3242-N3244 PolarHBondContact O-N 2.98Å; N3244-K3246 PolarHBondContact O-N 2.87Å
3245	G	88.5	Confident	90.3	Very high	11.5 Å²	11.5	24 Å²	24	12%	0.119	13%	0.127	C	C	.	.	S	Bend	trans	81.5	4.5	177.9	0	0	0	0	0	115.7	F3241 S3242	F3241-G3245 WeakPolarHBondContact CD1-O 3.38Å; S3242-G3245 PolarHBondContact O-N 3.01Å
3246	K	88.3	Confident	90.2	Very high	149 Å²	149	24.7 Å²	24.7	65%	0.648	13%	0.132	S	C	*	.			trans	-80.4	133.4	176.3	-59.7	-174.7	177.1	-176.6	0	111.6	F3241 S3242 N3244 A3248	F3241-K3246 CarbonylContact C-O 3.57Å; F3241-K3246 WeakPolarHBondContact CA-O 3.38Å; S3242-K3246 PolarHBondContact N-O 3.37Å; S3242-K3246 WeakPolarHBondContact OG-CB 3.42Å; S3242-K3246 PolarHBondContact OG-N 3.12Å; S3242-K3246 VanDerWaalsContact OG-N 3.14Å; S3242-K3246 PolarHBondContact OG-O 3.1Å; N3244-K3246 PolarHBondContact O-N 2.87Å; K3246-A3248 PolarHBondContact O-N 2.84Å
3247	L	88.4	Confident	90	Very high	42.5 Å²	42.5	24.8 Å²	24.8	22%	0.223	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	116.8	173.3	-179.3	67.5	0	0	0	110.5	A3239 F3241 W3249 A3250 L3263 S3264	A3239-L3247 HydrophobicContact CB-CD1 4.12Å; F3241-L3247 HydrophobicContact CD1-CB 4.16Å; F3241-L3247 HydrophobicContact CD1-CD1 4.42Å; F3241-L3247 HydrophobicContact CD2-CD1 4.25Å; F3241-L3247 HydrophobicContact CE1-CB 3.81Å; F3241-L3247 HydrophobicContact CE1-CD1 3.98Å; F3241-L3247 HydrophobicContact CE1-CG 4.46Å; F3241-L3247 HydrophobicContact CE2-CD1 3.77Å; F3241-L3247 HydrophobicContact CZ-CB 4.29Å; F3241-L3247 HydrophobicContact CZ-CD1 3.63Å; F3241-L3247 HydrophobicContact CZ-CG 4.48Å; L3247-W3249 VanDerWaalsContact CD1-O 3.3Å; L3247-W3249 WeakPolarHBondContact CD1-O 3.45Å; L3247-A3250 HydrophobicContact CD1-CB 4.45Å; L3247-L3263 HydrophobicContact CD2-CD1 3.44Å; L3247-L3263 VanDerWaalsContact CD2-CD1 3.44Å; L3247-L3263 HydrophobicContact CG-CD1 3.68Å; L3247-S3264 PolarHBondContact O-OG 2.86Å; L3247-S3264 VanDerWaalsContact O-OG 3.13Å
3248	A	87.6	Confident	89.7	Confident	10 Å²	10	25 Å²	25	8%	0.083	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	-37.1	178.5	0	0	0	0	0	111.9	F3227 A3240 K3246 E3277 V3278	F3227-A3248 HydrophobicContact CD1-CB 3.95Å; F3227-A3248 HydrophobicContact CE1-CB 3.72Å; A3240-A3248 HydrophobicContact CB-CB 4.35Å; A3240-A3248 WeakPolarHBondContact O-CB 3.28Å; A3240-A3248 PolarHBondContact O-N 3.22Å; K3246-A3248 PolarHBondContact O-N 2.84Å; A3248-E3277 HydrophobicContact CB-CB 4.3Å; A3248-E3277 HydrophobicContact CB-CG 4.36Å; A3248-V3278 HydrophobicContact CB-CG2 3.76Å
3249	W	88.8	Confident	89.5	Confident	4.5 Å²	4.5	26.3 Å²	26.3	2%	0.017	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	152.3	178.7	119.4	179.1	0	0	0	110.8	P3237 A3239 A3240 L3247 A3251 R3259 L3261 L3263 V3278 L3280	P3237-W3249 HydrophobicContact CB-CH2 3.92Å; P3237-W3249 HydrophobicContact CB-CZ3 4.16Å; P3237-W3249 WeakPolarHBondContact O-CH2 3.48Å; P3237-W3249 WeakPolarHBondContact O-CZ3 3.25Å; A3239-W3249 CarbonylContact C-O 3.41Å; A3239-W3249 WeakPolarHBondContact CA-O 3.27Å; A3240-W3249 HydrophobicContact CB-CB 3.79Å; A3240-W3249 HydrophobicContact CB-CD2 3.91Å; A3240-W3249 HydrophobicContact CB-CE3 4.5Å; A3240-W3249 HydrophobicContact CB-CG 4.33Å; A3240-W3249 HydrophobicContact CB-CH2 4.08Å; A3240-W3249 HydrophobicContact CB-CZ2 3.49Å; A3240-W3249 VanDerWaalsContact CB-CZ2 3.49Å; A3240-W3249 PolarHBondContact N-O 3.1Å; A3240-W3249 PolarHBondContact O-N 3.1Å; L3247-W3249 VanDerWaalsContact CD1-O 3.3Å; L3247-W3249 WeakPolarHBondContact CD1-O 3.45Å; W3249-A3251 HydrophobicContact CE3-CB 4.16Å; W3249-A3251 HydrophobicContact CH2-CB 3.21Å; W3249-A3251 HydrophobicContact CZ2-CB 3.59Å; W3249-A3251 HydrophobicContact CZ3-CB 3.81Å; W3249-R3259 VanDerWaalsContact CZ2-NH2 3.29Å; W3249-L3261 HydrophobicContact CD2-CD2 4.29Å; W3249-L3261 HydrophobicContact CE3-CD2 3.91Å; W3249-L3261 HydrophobicContact CZ2-CD2 3.62Å; W3249-L3261 HydrophobicContact CZ3-CD2 4.42Å; W3249-L3263 HydrophobicContact CB-CD2 4.36Å; W3249-V3278 PolarHBondContact NE1-O 3.33Å; W3249-L3280 HydrophobicContact CD2-CD2 4.28Å; W3249-L3280 HydrophobicContact CE3-CD2 4.06Å; W3249-L3280 HydrophobicContact CH2-CD2 4.13Å; W3249-L3280 HydrophobicContact CZ2-CB 3.98Å; W3249-L3280 HydrophobicContact CZ2-CD2 4.17Å; W3249-L3280 HydrophobicContact CZ3-CD2 3.95Å
3250	A	88.4	Confident	88.9	Confident	3 Å²	3	29.2 Å²	29.2	3%	0.025	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	152	169.6	0	0	0	0	0	110.9	T3238 A3239 L3247 L3261 T3262 L3263	T3238-A3250 CarbonylContact O-C 3.54Å; T3238-A3250 VanDerWaalsContact O-CA 3.28Å; T3238-A3250 WeakPolarHBondContact O-CA 3.37Å; A3239-A3250 HydrophobicContact CB-CB 4.38Å; L3247-A3250 HydrophobicContact CD1-CB 4.45Å; A3250-L3261 CarbonylContact O-C 3.52Å; A3250-L3261 WeakPolarHBondContact O-CA 3.41Å; A3250-T3262 VanDerWaalsContact CB-OG1 3.29Å; A3250-T3262 WeakPolarHBondContact CB-OG1 3.34Å; A3250-T3262 PolarHBondContact N-O 2.97Å; A3250-T3262 PolarHBondContact O-N 2.72Å; A3250-T3262 PolarHBondContact O-OG1 2.84Å; A3250-L3263 HydrophobicContact CB-CD1 3.89Å
3251	A	87.5	Confident	88.2	Confident	3 Å²	3	30.9 Å²	30.9	3%	0.025	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	148.4	-176.8	0	0	0	0	0	113	P3237 T3238 W3249 Y3253 R3259 R3260 L3261	P3237-A3251 WeakPolarHBondContact O-CB 2.99Å; T3238-A3251 PolarHBondContact O-N 3Å; W3249-A3251 HydrophobicContact CE3-CB 4.16Å; W3249-A3251 HydrophobicContact CH2-CB 3.21Å; W3249-A3251 HydrophobicContact CZ2-CB 3.59Å; W3249-A3251 HydrophobicContact CZ3-CB 3.81Å; A3251-Y3253 HydrophobicContact CB-CE2 4.38Å; A3251-R3259 HydrophobicContact CB-CG 4.06Å; A3251-R3260 CarbonylContact C-O 3.59Å; A3251-R3260 WeakPolarHBondContact CA-O 3.33Å; A3251-R3260 WeakPolarHBondContact CB-O 3.31Å; A3251-L3261 HydrophobicContact CB-CD2 3.9Å
3252	E	86.8	Confident	87.3	Confident	49 Å²	49	32.4 Å²	32.4	23%	0.229	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	152.5	171.9	-69.7	175	-168.6	0	0	109.5	R2957 L3105 R3259 R3260 T3262	R2957-E3252 IonicContact NH1-OE1 3.54Å; R2957-E3252 PolarHBondContact NH1-OE1 2.93Å; L3105-E3252 HydrophobicContact CD2-CB 3.98Å; E3252-R3259 WeakPolarHBondContact O-CA 3.34Å; E3252-R3260 PolarHBondContact N-O 3.07Å; E3252-R3260 PolarHBondContact O-N 3.44Å; E3252-T3262 HydrophobicContact CB-CG2 4.12Å; E3252-T3262 HydrophobicContact CG-CG2 3.62Å; E3252-T3262 WeakPolarHBondContact OE1-CG2 3.37Å
3253	Y	89.6	Confident	86.2	Confident	27.5 Å²	27.5	35.8 Å²	35.8	11%	0.108	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	139.4	-178.8	-63.4	-87	0	0	0	111.3	R2974 L3105 P3237 A3251 S3258 R3259 H3284	R2974-Y3253 PolarHBondContact NH2-O 3.33Å; L3105-Y3253 VanDerWaalsContact CD2-C 3.49Å; L3105-Y3253 WeakPolarHBondContact CD2-O 3.28Å; P3237-Y3253 WeakPolarHBondContact CD-OH 3.45Å; P3237-Y3253 WeakPolarHBondContact O-CE2 3.39Å; P3237-Y3253 VanDerWaalsContact O-CZ 3.29Å; P3237-Y3253 PolarHBondContact O-OH 3.11Å; A3251-Y3253 HydrophobicContact CB-CE2 4.38Å; Y3253-S3258 CarbonylContact C-O 3.55Å; Y3253-S3258 VanDerWaalsContact CA-O 3.27Å; Y3253-S3258 WeakPolarHBondContact CA-O 3.34Å; Y3253-R3259 HydrophobicContact CD1-CB 4.01Å; Y3253-R3259 HydrophobicContact CD1-CG 4.28Å; Y3253-R3259 HydrophobicContact CE1-CB 3.67Å; Y3253-R3259 HydrophobicContact CE1-CG 3.63Å; Y3253-H3284 HydrophobicContact CD1-CB 3.97Å; Y3253-H3284 HydrophobicContact CE1-CB 4.15Å; Y3253-H3284 VanDerWaalsContact CE1-N 3.29Å
3254	S	87.9	Confident	84.3	Confident	14 Å²	14	38.7 Å²	38.7	10%	0.098	21%	0.208	C	C	.	.			trans	-69.2	165.4	167.5	70.1	0	0	0	0	110.8	E3106 T3256 G3257 S3258	E3106-S3254 VanDerWaalsContact OE1-CA 3.25Å; E3106-S3254 WeakPolarHBondContact OE1-CA 3.32Å; E3106-S3254 WeakPolarHBondContact OE1-CB 3Å; E3106-S3254 WeakPolarHBondContact OE2-CB 3.5Å; S3254-T3256 PolarHBondContact O-N 3.29Å; S3254-T3256 VanDerWaalsContact O-N 3.13Å; S3254-T3256 PolarHBondContact OG-N 2.79Å; S3254-T3256 PolarHBondContact OG-OG1 3.09Å; S3254-G3257 PolarHBondContact O-N 2.96Å; S3254-G3257 VanDerWaalsContact O-N 3.1Å; S3254-G3257 PolarHBondContact OG-N 2.77Å; S3254-G3257 VanDerWaalsContact OG-N 3.08Å; S3254-S3258 PolarHBondContact N-O 3.29Å; S3254-S3258 WeakPolarHBondContact OG-CA 3.31Å; S3254-S3258 VanDerWaalsContact OG-CB 3.24Å; S3254-S3258 WeakPolarHBondContact OG-CB 3.32Å; S3254-S3258 PolarHBondContact OG-N 3.25Å; S3254-S3258 PolarHBondContact OG-O 3.12Å; S3254-S3258 PolarHBondContact OG-OG 3.4Å; S3254-S3258 VanDerWaalsContact OG-OG 3.04Å
3255	A	87.6	Confident	82.3	Confident	31 Å²	31	37.7 Å²	37.7	26%	0.256	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-17.2	175.5	0	0	0	0	0	113.6	L2969 V2972 L2987 E3106	L2969-A3255 HydrophobicContact CD2-CB 3.81Å; V2972-A3255 HydrophobicContact CG2-CB 4.1Å; L2987-A3255 HydrophobicContact CD1-CB 3.59Å; L2987-A3255 HydrophobicContact CD2-CB 3.85Å; L2987-A3255 HydrophobicContact CG-CB 4.28Å; E3106-A3255 PolarHBondContact OE1-N 3.14Å
3256	T	89.9	Confident	80	Confident	14.5 Å²	14.5	45.5 Å²	45.5	9%	0.089	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.4	-1	-178.7	57.1	0	0	0	0	113.4	I2995 S3254 Y3305 P3307 A3310	I2995-T3256 HydrophobicContact CD1-CG2 3.6Å; S3254-T3256 PolarHBondContact O-N 3.29Å; S3254-T3256 VanDerWaalsContact O-N 3.13Å; S3254-T3256 PolarHBondContact OG-N 2.79Å; S3254-T3256 PolarHBondContact OG-OG1 3.09Å; T3256-Y3305 VanDerWaalsContact O-CE1 3.25Å; T3256-Y3305 WeakPolarHBondContact O-CE1 3.31Å; T3256-Y3305 PolarHBondContact O-OH 3.16Å; T3256-P3307 WeakPolarHBondContact CB-O 3.37Å; T3256-P3307 PolarHBondContact OG1-O 3.29Å; T3256-A3310 HydrophobicContact CG2-CB 3.7Å
3257	G	90.9	Very high	77.5	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.01	24%	0.243	C	C	.	.	S	Bend	trans	106.9	-1.6	173	0	0	0	0	0	116.4	S3254 R3259 H3284	S3254-G3257 PolarHBondContact O-N 2.96Å; S3254-G3257 VanDerWaalsContact O-N 3.1Å; S3254-G3257 PolarHBondContact OG-N 2.77Å; S3254-G3257 VanDerWaalsContact OG-N 3.08Å; G3257-R3259 PolarHBondContact O-N 2.69Å; G3257-H3284 WeakPolarHBondContact O-CB 3.26Å
3258	S	90.2	Very high	74.9	Confident	4.5 Å²	4.5	48.5 Å²	48.5	3%	0.031	26%	0.259	C	S	.	.			trans	-59.9	134.2	173.9	-51.4	0	0	0	0	110.2	D3108 Y3253 S3254 P3307	D3108-S3258 VanDerWaalsContact CG-CB 3.5Å; D3108-S3258 WeakPolarHBondContact OD1-CB 3Å; Y3253-S3258 CarbonylContact C-O 3.55Å; Y3253-S3258 VanDerWaalsContact CA-O 3.27Å; Y3253-S3258 WeakPolarHBondContact CA-O 3.34Å; S3254-S3258 PolarHBondContact N-O 3.29Å; S3254-S3258 WeakPolarHBondContact OG-CA 3.31Å; S3254-S3258 VanDerWaalsContact OG-CB 3.24Å; S3254-S3258 WeakPolarHBondContact OG-CB 3.32Å; S3254-S3258 PolarHBondContact OG-N 3.25Å; S3254-S3258 PolarHBondContact OG-O 3.12Å; S3254-S3258 PolarHBondContact OG-OG 3.4Å; S3254-S3258 VanDerWaalsContact OG-OG 3.04Å; S3258-P3307 VanDerWaalsContact OG-CB 3.23Å; S3258-P3307 WeakPolarHBondContact OG-CB 3.42Å
3259	R	87.5	Confident	72.4	Confident	31 Å²	31	55.4 Å²	55.4	12%	0.117	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	128.6	-179.3	-176.1	-175	127.1	-173.7	0.8	110.7	W3249 A3251 E3252 Y3253 G3257 L3261 L3280 L3282	W3249-R3259 VanDerWaalsContact CZ2-NH2 3.29Å; A3251-R3259 HydrophobicContact CB-CG 4.06Å; E3252-R3259 WeakPolarHBondContact O-CA 3.34Å; Y3253-R3259 HydrophobicContact CD1-CB 4.01Å; Y3253-R3259 HydrophobicContact CD1-CG 4.28Å; Y3253-R3259 HydrophobicContact CE1-CB 3.67Å; Y3253-R3259 HydrophobicContact CE1-CG 3.63Å; G3257-R3259 PolarHBondContact O-N 2.69Å; R3259-L3261 HydrophobicContact CG-CD2 4.49Å; R3259-L3280 PolarHBondContact NH1-O 2.97Å; R3259-L3282 PolarHBondContact NH1-O 3.04Å
3260	R	80.7	Confident	70.1	Confident	61 Å²	61	62.3 Å²	62.3	23%	0.23	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	133.9	173.8	-122.1	-179.1	178.7	-177.1	-2.8	110.8	D3101 A3104 L3105 D3108 A3251 E3252	D3101-R3260 VanDerWaalsContact CB-NH2 3.28Å; D3101-R3260 IonicContact OD1-NH2 3.4Å; D3101-R3260 IonicContact OD2-CZ 3.08Å; D3101-R3260 IonicContact OD2-NH2 3.18Å; D3101-R3260 PolarHBondContact OD2-NH2 2.75Å; A3104-R3260 PolarHBondContact O-NH1 3.35Å; A3104-R3260 PolarHBondContact O-NH2 3.39Å; L3105-R3260 HydrophobicContact CD1-CB 3.11Å; L3105-R3260 HydrophobicContact CD1-CG 4.06Å; D3108-R3260 VanDerWaalsContact CG-NH2 3.33Å; D3108-R3260 IonicContact OD1-CZ 3.82Å; D3108-R3260 IonicContact OD1-NE 3.14Å; D3108-R3260 PolarHBondContact OD1-NE 3.27Å; D3108-R3260 IonicContact OD1-NH2 2.66Å; D3108-R3260 PolarHBondContact OD1-NH2 3.09Å; D3108-R3260 IonicContact OD2-CZ 2.68Å; D3108-R3260 IonicContact OD2-NE 3.18Å; D3108-R3260 IonicContact OD2-NH2 2.68Å; D3108-R3260 PolarHBondContact OD2-NH2 3.44Å; A3251-R3260 CarbonylContact C-O 3.59Å; A3251-R3260 WeakPolarHBondContact CA-O 3.33Å; A3251-R3260 WeakPolarHBondContact CB-O 3.31Å; E3252-R3260 PolarHBondContact N-O 3.07Å; E3252-R3260 PolarHBondContact O-N 3.44Å
3261	L	80.1	Confident	67.7	Low	36.5 Å²	36.5	67.5 Å²	67.5	19%	0.191	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	139.4	177	-56.6	-177.6	0	0	0	111.4	W3249 A3250 A3251 R3259 R3266 F3269 L3274 I3275 E3276	W3249-L3261 HydrophobicContact CD2-CD2 4.29Å; W3249-L3261 HydrophobicContact CE3-CD2 3.91Å; W3249-L3261 HydrophobicContact CZ2-CD2 3.62Å; W3249-L3261 HydrophobicContact CZ3-CD2 4.42Å; A3250-L3261 CarbonylContact O-C 3.52Å; A3250-L3261 WeakPolarHBondContact O-CA 3.41Å; A3251-L3261 HydrophobicContact CB-CD2 3.9Å; R3259-L3261 HydrophobicContact CG-CD2 4.49Å; L3261-R3266 PolarHBondContact O-NH2 2.79Å; L3261-R3266 VanDerWaalsContact O-NH2 3.09Å; L3261-F3269 HydrophobicContact CD1-CZ 4.32Å; L3261-L3274 HydrophobicContact CD1-CD2 4.23Å; L3261-I3275 HydrophobicContact CD1-CG1 4.27Å; L3261-E3276 WeakPolarHBondContact CD1-OE1 3.37Å
3262	T	74.7	Confident	65.4	Low	38.5 Å²	38.5	75.5 Å²	75.5	24%	0.236	38%	0.379	C	S	.	.			trans	-112.6	61.7	177.2	58.6	0	0	0	0	111.5	A3250 E3252	A3250-T3262 VanDerWaalsContact CB-OG1 3.29Å; A3250-T3262 WeakPolarHBondContact CB-OG1 3.34Å; A3250-T3262 PolarHBondContact N-O 2.97Å; A3250-T3262 PolarHBondContact O-N 2.72Å; A3250-T3262 PolarHBondContact O-OG1 2.84Å; E3252-T3262 HydrophobicContact CB-CG2 4.12Å; E3252-T3262 HydrophobicContact CG-CG2 3.62Å; E3252-T3262 WeakPolarHBondContact OE1-CG2 3.37Å
3263	L	66.9	Low	63.1	Low	83.5 Å²	83.5	76.3 Å²	76.3	44%	0.437	39%	0.393	S	S	.	.	S	Bend	trans	-94.7	141.4	-179.2	-100	123.8	0	0	0	111.5	L3247 W3249 A3250 S3265	L3247-L3263 HydrophobicContact CD2-CD1 3.44Å; L3247-L3263 VanDerWaalsContact CD2-CD1 3.44Å; L3247-L3263 HydrophobicContact CG-CD1 3.68Å; W3249-L3263 HydrophobicContact CB-CD2 4.36Å; A3250-L3263 HydrophobicContact CB-CD1 3.89Å; L3263-S3265 VanDerWaalsContact C-N 3.31Å; L3263-S3265 PolarHBondContact O-N 2.92Å; L3263-S3265 VanDerWaalsContact O-N 3.11Å
3264	S	50.5	Low	60.9	Low	92 Å²	92	77.7 Å²	77.7	64%	0.643	40%	0.402	S	S	*	.	S	Bend	trans	-75.5	-1.2	-176.3	-57.2	0	0	0	0	115	L3247 R3266	L3247-S3264 PolarHBondContact O-OG 2.86Å; L3247-S3264 VanDerWaalsContact O-OG 3.13Å; S3264-R3266 PolarHBondContact O-N 2.84Å
3265	S	46.5	Very low	58.8	Low	83.5 Å²	83.5	79.6 Å²	79.6	58%	0.584	41%	0.411	S	S	*	.			trans	-83.6	72.9	171.9	-168.8	0	0	0	0	111.1	L3263 N3267	L3263-S3265 VanDerWaalsContact C-N 3.31Å; L3263-S3265 PolarHBondContact O-N 2.92Å; L3263-S3265 VanDerWaalsContact O-N 3.11Å; S3265-N3267 PolarHBondContact O-N 2.96Å; S3265-N3267 VanDerWaalsContact O-N 3.08Å
3266	R	40.9	Very low	57.2	Low	177 Å²	177	82.6 Å²	82.6	67%	0.668	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-74.7	-7.3	-174.4	-75.9	-169.5	178	-161.2	-0.9	114.7	L3261 S3264 N3268 F3269	L3261-R3266 PolarHBondContact O-NH2 2.79Å; L3261-R3266 VanDerWaalsContact O-NH2 3.09Å; S3264-R3266 PolarHBondContact O-N 2.84Å; R3266-N3268 PolarHBondContact O-N 3.07Å; R3266-F3269 HydrophobicContact CG-CD2 4.12Å; R3266-F3269 PolarHBondContact O-N 2.98Å
3267	N	36.2	Very low	56	Low	148.5 Å²	148.5	86.3 Å²	86.3	79%	0.794	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	3.2	-169.9	-82.7	3.6	0	0	0	116.2	S3265	S3265-N3267 PolarHBondContact O-N 2.96Å; S3265-N3267 VanDerWaalsContact O-N 3.08Å
3268	N	34.5	Very low	55.2	Low	104.5 Å²	104.5	86.3 Å²	86.3	56%	0.559	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-134.6	71.4	172.9	-76	-46.3	0	0	0	114.1	R3266 F3270 R3272	R3266-N3268 PolarHBondContact O-N 3.07Å; N3268-F3270 PolarHBondContact O-N 2.99Å; N3268-F3270 VanDerWaalsContact O-N 3.15Å; N3268-R3272 HydrophobicContact CB-CB 4.33Å; N3268-R3272 HydrophobicContact CB-CG 4.22Å; N3268-R3272 PolarHBondContact ND2-NH1 3.32Å; N3268-R3272 PolarHBondContact O-N 3Å
3269	F	35.4	Very low	54.6	Low	155.5 Å²	155.5	86.8 Å²	86.8	68%	0.682	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	62.3	-179.7	-108	-97	0	0	0	114	L3261 R3266 T3271	L3261-F3269 HydrophobicContact CD1-CZ 4.32Å; R3266-F3269 HydrophobicContact CG-CD2 4.12Å; R3266-F3269 PolarHBondContact O-N 2.98Å; F3269-T3271 PolarHBondContact O-N 2.97Å
3270	F	40.2	Very low	54.7	Low	150 Å²	150	85.4 Å²	85.4	66%	0.658	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	53.2	175.8	-68.9	-82.9	0	0	0	113.2	N3268	N3268-F3270 PolarHBondContact O-N 2.99Å; N3268-F3270 VanDerWaalsContact O-N 3.15Å
3271	T	38.2	Very low	55	Low	110.5 Å²	110.5	83.1 Å²	83.1	68%	0.678	43%	0.426	S	S	*	.	S	Bend	trans	-170.2	-9.7	163	51.8	0	0	0	0	115.9	F3269	F3269-T3271 PolarHBondContact O-N 2.97Å
3272	R	37.5	Very low	55.6	Low	173 Å²	173	81.5 Å²	81.5	65%	0.653	42%	0.417	S	S	*	.	S	Bend	trans	-125	51.3	-177.9	-77.9	-174.8	175.7	173.8	-3.5	114.9	N3268 L3274	N3268-R3272 HydrophobicContact CB-CB 4.33Å; N3268-R3272 HydrophobicContact CB-CG 4.22Å; N3268-R3272 PolarHBondContact ND2-NH1 3.32Å; N3268-R3272 PolarHBondContact O-N 3Å; R3272-L3274 VanDerWaalsContact C-N 3.31Å; R3272-L3274 PolarHBondContact O-N 3.36Å
3273	A	39.7	Very low	56.5	Low	64 Å²	64	79.7 Å²	79.7	53%	0.529	41%	0.406	S	S	.	.	S	Bend	trans	-85.1	85.1	170.8	0	0	0	0	0	108.9	I3275 E3276	A3273-I3275 VanDerWaalsContact C-N 3.32Å; A3273-I3275 PolarHBondContact O-N 3Å; A3273-E3276 HydrophobicContact CB-CG 4.17Å
3274	L	43	Very low	57.7	Low	57.5 Å²	57.5	77 Å²	77	30%	0.301	39%	0.391	S	S	.	.			trans	-8.9	103.9	163.6	-71.7	130.2	0	0	0	110.2	L3111 R3161 L3261 R3272 E3276 F3291	L3111-L3274 HydrophobicContact CD2-CD1 3.77Å; R3161-L3274 VanDerWaalsContact NH2-C 3.31Å; R3161-L3274 PolarHBondContact NH2-O 3.11Å; L3261-L3274 HydrophobicContact CD1-CD2 4.23Å; R3272-L3274 VanDerWaalsContact C-N 3.31Å; R3272-L3274 PolarHBondContact O-N 3.36Å; L3274-E3276 HydrophobicContact CD2-CG 4.33Å; L3274-E3276 PolarHBondContact O-N 3.45Å; L3274-F3291 HydrophobicContact CD1-CB 3.97Å; L3274-F3291 HydrophobicContact CD1-CE2 4.47Å; L3274-F3291 HydrophobicContact CD1-CG 4.27Å; L3274-F3291 HydrophobicContact CD1-CZ 4.49Å; L3274-F3291 HydrophobicContact CD2-CB 4.44Å; L3274-F3291 HydrophobicContact CD2-CD1 3.5Å; L3274-F3291 HydrophobicContact CD2-CE1 3.78Å; L3274-F3291 HydrophobicContact CD2-CG 3.93Å; L3274-F3291 HydrophobicContact CD2-CZ 4.42Å
3275	I	44.3	Very low	59.7	Low	53.5 Å²	53.5	72.9 Å²	72.9	27%	0.274	36%	0.363	S	S	.	.			trans	-9.1	81.2	159.1	-52.6	171.9	0	0	0	110.3	R3161 L3261 A3273 E3277 V3278 D3279 F3291	R3161-I3275 PolarHBondContact NH1-O 2.6Å; R3161-I3275 PolarHBondContact NH2-O 3.46Å; L3261-I3275 HydrophobicContact CD1-CG1 4.27Å; A3273-I3275 VanDerWaalsContact C-N 3.32Å; A3273-I3275 PolarHBondContact O-N 3Å; I3275-E3277 VanDerWaalsContact C-N 3.34Å; I3275-V3278 HydrophobicContact CG2-CB 4.45Å; I3275-V3278 WeakPolarHBondContact CG2-O 3.38Å; I3275-D3279 VanDerWaalsContact CB-OD1 3.3Å; I3275-D3279 WeakPolarHBondContact CB-OD1 3.11Å; I3275-D3279 WeakPolarHBondContact CD1-OD1 3.35Å; I3275-D3279 VanDerWaalsContact CG2-OD1 3.24Å; I3275-D3279 WeakPolarHBondContact CG2-OD1 3.12Å; I3275-F3291 HydrophobicContact CD1-CZ 4.34Å
3276	E	54.1	Low	61.8	Low	94.5 Å²	94.5	70.4 Å²	70.4	44%	0.442	35%	0.346	S	S	.	.			trans	-88.9	53.4	168.5	-69.1	-177.6	-178.6	0	0	110	R3161 L3261 A3273 L3274 V3278	R3161-E3276 PolarHBondContact NH1-O 2.96Å; R3161-E3276 VanDerWaalsContact NH2-N 3.13Å; R3161-E3276 PolarHBondContact NH2-O 3.5Å; R3161-E3276 VanDerWaalsContact NH2-O 3.16Å; L3261-E3276 WeakPolarHBondContact CD1-OE1 3.37Å; A3273-E3276 HydrophobicContact CB-CG 4.17Å; L3274-E3276 HydrophobicContact CD2-CG 4.33Å; L3274-E3276 PolarHBondContact O-N 3.45Å; E3276-V3278 WeakPolarHBondContact CB-O 3.48Å; E3276-V3278 PolarHBondContact O-N 2.88Å
3277	E	63.8	Low	64.4	Low	92.5 Å²	92.5	62 Å²	62	43%	0.432	31%	0.314	S	S	.	.	S	Bend	trans	-85.9	-33.5	-178.2	-118.6	-178.6	176.4	0	0	113.8	Q3181 F3227 A3248 I3275	Q3181-E3277 PolarHBondContact NE2-O 3.49Å; Q3181-E3277 PolarHBondContact OE1-O 2.94Å; F3227-E3277 HydrophobicContact CE1-CG 4.28Å; F3227-E3277 HydrophobicContact CZ-CG 4.22Å; A3248-E3277 HydrophobicContact CB-CB 4.3Å; A3248-E3277 HydrophobicContact CB-CG 4.36Å; I3275-E3277 VanDerWaalsContact C-N 3.34Å
3278	V	74.6	Confident	67.2	Low	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.278	C	S	.	.	S	Bend	trans	-137.1	113.8	-170.7	-175.6	0	0	0	0	113.7	L3179 F3227 A3248 W3249 I3275 E3276 L3280	L3179-V3278 HydrophobicContact CD1-CG1 3.99Å; L3179-V3278 HydrophobicContact CD2-CG1 3.76Å; L3179-V3278 HydrophobicContact CG-CG1 4.25Å; F3227-V3278 HydrophobicContact CB-CG1 4.28Å; F3227-V3278 HydrophobicContact CB-CG2 4.4Å; F3227-V3278 HydrophobicContact CD1-CB 4.4Å; F3227-V3278 HydrophobicContact CD1-CG1 4.45Å; F3227-V3278 HydrophobicContact CD1-CG2 3.15Å; F3227-V3278 HydrophobicContact CD2-CG1 4.26Å; F3227-V3278 HydrophobicContact CD2-CG2 3.81Å; F3227-V3278 HydrophobicContact CE1-CG2 3.09Å; F3227-V3278 HydrophobicContact CE2-CG2 3.74Å; F3227-V3278 HydrophobicContact CG-CB 4.45Å; F3227-V3278 HydrophobicContact CG-CG1 4.08Å; F3227-V3278 HydrophobicContact CG-CG2 3.52Å; F3227-V3278 VanDerWaalsContact CG-CG2 3.47Å; F3227-V3278 HydrophobicContact CZ-CG2 3.4Å; F3227-V3278 VanDerWaalsContact CZ-CG2 3.48Å; A3248-V3278 HydrophobicContact CB-CG2 3.76Å; W3249-V3278 PolarHBondContact NE1-O 3.33Å; I3275-V3278 HydrophobicContact CG2-CB 4.45Å; I3275-V3278 WeakPolarHBondContact CG2-O 3.38Å; E3276-V3278 WeakPolarHBondContact CB-O 3.48Å; E3276-V3278 PolarHBondContact O-N 2.88Å; V3278-L3280 HydrophobicContact CG1-CB 4.28Å; V3278-L3280 PolarHBondContact O-N 3.06Å
3279	D	77.3	Confident	70	Confident	15.5 Å²	15.5	50.8 Å²	50.8	8%	0.083	25%	0.254	C	S	.	.			trans	-83.5	85.2	178	-69.5	-51.9	0	0	0	112.4	N3158 R3161 I3165 I3275 P3281	N3158-D3279 PolarHBondContact ND2-OD1 3.23Å; N3158-D3279 PolarHBondContact ND2-OD2 2.86Å; R3161-D3279 WeakPolarHBondContact CD-OD1 3.46Å; R3161-D3279 WeakPolarHBondContact CD-OD2 3.36Å; R3161-D3279 IonicContact CZ-OD1 3.37Å; R3161-D3279 IonicContact CZ-OD2 2.9Å; R3161-D3279 IonicContact NE-OD1 3.69Å; R3161-D3279 PolarHBondContact NE-OD1 3.05Å; R3161-D3279 IonicContact NE-OD2 2.73Å; R3161-D3279 IonicContact NH1-OD1 3.23Å; R3161-D3279 PolarHBondContact NH1-OD1 2.92Å; R3161-D3279 IonicContact NH1-OD2 2.98Å; R3161-D3279 PolarHBondContact NH1-OD2 2.93Å; R3161-D3279 IonicContact NH2-OD1 2.62Å; I3165-D3279 HydrophobicContact CD1-CB 3.6Å; I3165-D3279 WeakPolarHBondContact CD1-O 3.33Å; I3275-D3279 VanDerWaalsContact CB-OD1 3.3Å; I3275-D3279 WeakPolarHBondContact CB-OD1 3.11Å; I3275-D3279 WeakPolarHBondContact CD1-OD1 3.35Å; I3275-D3279 VanDerWaalsContact CG2-OD1 3.24Å; I3275-D3279 WeakPolarHBondContact CG2-OD1 3.12Å; D3279-P3281 WeakPolarHBondContact O-CD 3.2Å
3280	L	88.7	Confident	72.7	Confident	2 Å²	2	43.6 Å²	43.6	1%	0.01	22%	0.223	C	C	.	.			trans	-102.2	98.7	175.1	-173.7	62.3	0	0	0	111.5	L3167 L3179 I3229 P3237 W3249 R3259 V3278 L3282	L3167-L3280 HydrophobicContact CD2-CD1 3.6Å; L3179-L3280 HydrophobicContact CD1-CD1 4.42Å; L3179-L3280 HydrophobicContact CD2-CB 4.21Å; L3179-L3280 HydrophobicContact CD2-CD1 4.15Å; I3229-L3280 HydrophobicContact CD1-CD2 4.09Å; I3229-L3280 HydrophobicContact CG1-CD2 4.16Å; I3229-L3280 HydrophobicContact CG2-CD2 4.07Å; P3237-L3280 HydrophobicContact CB-CD2 3.78Å; P3237-L3280 HydrophobicContact CG-CD2 3.94Å; W3249-L3280 HydrophobicContact CD2-CD2 4.28Å; W3249-L3280 HydrophobicContact CE3-CD2 4.06Å; W3249-L3280 HydrophobicContact CH2-CD2 4.13Å; W3249-L3280 HydrophobicContact CZ2-CB 3.98Å; W3249-L3280 HydrophobicContact CZ2-CD2 4.17Å; W3249-L3280 HydrophobicContact CZ3-CD2 3.95Å; R3259-L3280 PolarHBondContact NH1-O 2.97Å; V3278-L3280 HydrophobicContact CG1-CB 4.28Å; V3278-L3280 PolarHBondContact O-N 3.06Å; L3280-L3282 HydrophobicContact CD1-CB 4.15Å; L3280-L3282 HydrophobicContact CD1-CD1 4.21Å; L3280-L3282 HydrophobicContact CD1-CG 4.02Å; L3280-L3282 HydrophobicContact CG-CB 4.28Å; L3280-L3282 HydrophobicContact CG-CG 4.31Å; L3280-L3282 PolarHBondContact O-N 2.78Å; L3280-L3282 VanDerWaalsContact O-N 3.1Å
3281	P	88.7	Confident	74.9	Confident	12.5 Å²	12.5	38.8 Å²	38.8	8%	0.081	20%	0.202	C	C	.	.			trans	-81.6	16	178.4	35.7	-37.9	0	0	0	112.9	Y3142 I3156 D3279 I3288 T3289 F3291	Y3142-P3281 HydrophobicContact CE1-CB 4.32Å; Y3142-P3281 HydrophobicContact CE1-CG 3.88Å; I3156-P3281 HydrophobicContact CD1-CG 3.54Å; I3156-P3281 HydrophobicContact CG1-CG 4.27Å; I3156-P3281 HydrophobicContact CG2-CG 4.49Å; D3279-P3281 WeakPolarHBondContact O-CD 3.2Å; P3281-I3288 CarbonylContact O-C 3.48Å; P3281-I3288 VanDerWaalsContact O-CA 3.29Å; P3281-I3288 WeakPolarHBondContact O-CA 3.34Å; P3281-T3289 PolarHBondContact O-N 2.94Å; P3281-F3291 HydrophobicContact CB-CE2 4.12Å
3282	L	92.7	Very high	77.4	Confident	3 Å²	3	33.8 Å²	33.8	2%	0.016	17%	0.171	C	C	.	.	B	Isolated β-bridge	trans	-93.6	136.4	176.2	-58.3	-174.3	0	0	0	110.5	L3167 V3176 P3237 R3259 L3280 C3287 I3288	L3167-L3282 HydrophobicContact CD1-CD1 3.98Å; L3167-L3282 HydrophobicContact CD1-CG 4.48Å; V3176-L3282 HydrophobicContact CB-CD1 4.37Å; V3176-L3282 HydrophobicContact CG1-CD1 4.28Å; P3237-L3282 HydrophobicContact CG-CB 4.09Å; R3259-L3282 PolarHBondContact NH1-O 3.04Å; L3280-L3282 HydrophobicContact CD1-CB 4.15Å; L3280-L3282 HydrophobicContact CD1-CD1 4.21Å; L3280-L3282 HydrophobicContact CD1-CG 4.02Å; L3280-L3282 HydrophobicContact CG-CB 4.28Å; L3280-L3282 HydrophobicContact CG-CG 4.31Å; L3280-L3282 PolarHBondContact O-N 2.78Å; L3280-L3282 VanDerWaalsContact O-N 3.1Å; L3282-C3287 CarbonylContact C-O 3.54Å; L3282-C3287 WeakPolarHBondContact CA-O 3.2Å; L3282-I3288 HydrophobicContact CD2-CG1 4.33Å
3283	G	92	Very high	80.1	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.14	C	C	.	.			trans	-125.2	-137.2	179.9	0	0	0	0	0	112.6	P3237 A3285 S3286 C3287 T3289	P3237-G3283 VanDerWaalsContact CD-O 3.22Å; P3237-G3283 WeakPolarHBondContact CD-O 3.47Å; G3283-A3285 PolarHBondContact O-N 3.07Å; G3283-S3286 PolarHBondContact O-N 2.76Å; G3283-S3286 VanDerWaalsContact O-N 3.12Å; G3283-C3287 PolarHBondContact N-O 2.89Å; G3283-T3289 VanDerWaalsContact CA-OG1 3.27Å; G3283-T3289 WeakPolarHBondContact CA-OG1 3.24Å; G3283-T3289 PolarHBondContact N-OG1 3.3Å
3284	H	93.1	Very high	82.5	Confident	27.5 Å²	27.5	23.1 Å²	23.1	13%	0.127	12%	0.121	C	C	.	.	G	3₁₀ helix	trans	-56.8	135.8	-177.4	175.2	76.3	0	0	0	110.6	E3234 S3236 Y3253 G3257 S3286 C3287 L3296	E3234-H3284 IonicContact OE1-CE1 2.83Å; E3234-H3284 IonicContact OE2-CE1 3.37Å; E3234-H3284 PolarHBondContact OE2-CE1 3.25Å; E3234-H3284 IonicContact OE2-ND1 3.49Å; E3234-H3284 PolarHBondContact OE2-ND1 3.21Å; S3236-H3284 WeakPolarHBondContact OG-CA 3.26Å; Y3253-H3284 HydrophobicContact CD1-CB 3.97Å; Y3253-H3284 HydrophobicContact CE1-CB 4.15Å; Y3253-H3284 VanDerWaalsContact CE1-N 3.29Å; G3257-H3284 WeakPolarHBondContact O-CB 3.26Å; H3284-S3286 PolarHBondContact O-N 3Å; H3284-S3286 VanDerWaalsContact O-N 3.14Å; H3284-C3287 VanDerWaalsContact O-CB 3.31Å; H3284-C3287 WeakPolarHBondContact O-CB 3.45Å; H3284-C3287 PolarHBondContact O-N 3Å; H3284-C3287 PolarHBondContact O-SG 3.22Å; H3284-L3296 HydrophobicContact CB-CD1 3.92Å
3285	A	91.7	Very high	85	Confident	6 Å²	6	20.4 Å²	20.4	5%	0.05	11%	0.106	C	C	.	.	G	3₁₀ helix	trans	52.4	31.3	-177.8	0	0	0	0	0	115	E3234 S3236 G3283 C3287 L3348 T3350	E3234-A3285 WeakPolarHBondContact O-CA 3.37Å; S3236-A3285 PolarHBondContact OG-N 2.92Å; G3283-A3285 PolarHBondContact O-N 3.07Å; A3285-C3287 PolarHBondContact O-N 2.79Å; A3285-C3287 VanDerWaalsContact O-N 3.16Å; A3285-L3348 HydrophobicContact CB-CD1 4.02Å; A3285-T3350 HydrophobicContact CB-CG2 4.21Å
3286	S	92.2	Very high	87.5	Confident	31.5 Å²	31.5	17.9 Å²	17.9	22%	0.22	9%	0.094	C	C	.	.	G	3₁₀ helix	trans	58.9	20.5	-174.3	-74	0	0	0	0	114.5	G3235 G3283 H3284	G3235-S3286 PolarHBondContact O-N 2.99Å; G3235-S3286 PolarHBondContact O-OG 3Å; G3283-S3286 PolarHBondContact O-N 2.76Å; G3283-S3286 VanDerWaalsContact O-N 3.12Å; H3284-S3286 PolarHBondContact O-N 3Å; H3284-S3286 VanDerWaalsContact O-N 3.14Å
3287	C	94.3	Very high	89.5	Confident	0.5 Å²	0.5	13.6 Å²	13.6	0%	0.003	7%	0.073	C	C	.	.	P	Polyproline II helix	trans	-73.3	150.1	173.8	-55.8	0	0	0	0	111.5	L3282 G3283 H3284 A3285 T3289 L3296 C3298	L3282-C3287 CarbonylContact C-O 3.54Å; L3282-C3287 WeakPolarHBondContact CA-O 3.2Å; G3283-C3287 PolarHBondContact N-O 2.89Å; H3284-C3287 VanDerWaalsContact O-CB 3.31Å; H3284-C3287 WeakPolarHBondContact O-CB 3.45Å; H3284-C3287 PolarHBondContact O-N 3Å; H3284-C3287 PolarHBondContact O-SG 3.22Å; A3285-C3287 PolarHBondContact O-N 2.79Å; A3285-C3287 VanDerWaalsContact O-N 3.16Å; C3287-T3289 PolarHBondContact O-N 3.16Å; C3287-L3296 HydrophobicContact CB-CB 4.19Å; C3287-C3298 HydrophobicContact CB-CB 3.99Å; C3287-C3298 WeakPolarHBondContact CB-SG 3.47Å; C3287-C3298 WeakPolarHBondContact SG-CA 3.41Å; C3287-C3298 WeakPolarHBondContact SG-CB 3.37Å; C3287-C3298 CovalentContact SG-SG 2.02Å; C3287-C3298 PolarHBondContact SG-SG 3.04Å
3288	I	95.2	Very high	90.7	Very high	9.5 Å²	9.5	9.4 Å²	9.4	5%	0.049	5%	0.054	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	126.6	174	-58.4	170.6	0	0	0	107.9	L3127 Y3142 V3153 P3281 L3282 L3296 F3297	L3127-I3288 HydrophobicContact CD2-CD1 4.47Å; L3127-I3288 HydrophobicContact CD2-CG2 4.32Å; Y3142-I3288 HydrophobicContact CD1-CD1 4.07Å; Y3142-I3288 HydrophobicContact CE1-CD1 4.19Å; Y3142-I3288 HydrophobicContact CE1-CG1 4.39Å; Y3142-I3288 HydrophobicContact CE1-CG2 3.87Å; Y3142-I3288 HydrophobicContact CE2-CG2 4.42Å; Y3142-I3288 HydrophobicContact CG-CD1 4.31Å; Y3142-I3288 WeakPolarHBondContact OH-CG2 3.29Å; V3153-I3288 HydrophobicContact CG2-CD1 3.69Å; V3153-I3288 HydrophobicContact CG2-CG1 4.09Å; P3281-I3288 CarbonylContact O-C 3.48Å; P3281-I3288 VanDerWaalsContact O-CA 3.29Å; P3281-I3288 WeakPolarHBondContact O-CA 3.34Å; L3282-I3288 HydrophobicContact CD2-CG1 4.33Å; I3288-L3296 CarbonylContact O-C 3.54Å; I3288-L3296 WeakPolarHBondContact O-CA 3.43Å; I3288-F3297 HydrophobicContact CB-CB 4.25Å; I3288-F3297 PolarHBondContact N-O 2.92Å; I3288-F3297 VanDerWaalsContact N-O 3.13Å; I3288-F3297 PolarHBondContact O-N 3.42Å
3289	T	93	Very high	91	Very high	8.5 Å²	8.5	11.4 Å²	11.4	5%	0.052	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	119.2	176.3	-54	0	0	0	0	109.3	P3281 G3283 C3287 F3291 F3295 L3296	P3281-T3289 PolarHBondContact O-N 2.94Å; G3283-T3289 VanDerWaalsContact CA-OG1 3.27Å; G3283-T3289 WeakPolarHBondContact CA-OG1 3.24Å; G3283-T3289 PolarHBondContact N-OG1 3.3Å; C3287-T3289 PolarHBondContact O-N 3.16Å; T3289-F3291 PolarHBondContact O-N 3.08Å; T3289-F3295 WeakPolarHBondContact CA-O 3.39Å; T3289-L3296 HydrophobicContact CG2-CD2 4.01Å; T3289-L3296 VanDerWaalsContact OG1-CD2 3.23Å; T3289-L3296 WeakPolarHBondContact OG1-CD2 3.34Å
3290	D	92.8	Very high	90.7	Very high	4 Å²	4	13 Å²	13	2%	0.021	8%	0.079	C	C	.	.	P	Polyproline II helix	trans	-82.3	115.4	166.9	171.8	45.6	0	0	0	109.6	F3119 H3292 T3293 G3294 F3295 F3297	F3119-D3290 HydrophobicContact CE1-CB 4.18Å; D3290-H3292 VanDerWaalsContact C-N 3.29Å; D3290-H3292 PolarHBondContact O-N 3.35Å; D3290-H3292 IonicContact OD1-CE1 3.13Å; D3290-H3292 IonicContact OD1-CG 3.27Å; D3290-H3292 PolarHBondContact OD1-N 3.32Å; D3290-H3292 IonicContact OD1-ND1 3.21Å; D3290-H3292 PolarHBondContact OD1-ND1 2.89Å; D3290-H3292 WeakPolarHBondContact OD2-CB 3.41Å; D3290-T3293 VanDerWaalsContact OD2-CB 3.3Å; D3290-T3293 WeakPolarHBondContact OD2-CB 3.35Å; D3290-T3293 VanDerWaalsContact OD2-CG2 3.3Å; D3290-T3293 WeakPolarHBondContact OD2-CG2 3.39Å; D3290-T3293 PolarHBondContact OD2-N 3.07Å; D3290-T3293 PolarHBondContact OD2-OG1 3.01Å; D3290-G3294 CarbonylContact O-C 3.52Å; D3290-G3294 WeakPolarHBondContact O-CA 3.18Å; D3290-G3294 PolarHBondContact O-N 2.96Å; D3290-F3295 PolarHBondContact N-O 3.17Å; D3290-F3297 HydrophobicContact CB-CE2 3.76Å
3291	F	86.8	Confident	90	Very high	49.5 Å²	49.5	14.3 Å²	14.3	22%	0.217	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-21.8	-178.9	-2.3	-82.3	0	0	0	112.9	G3110 L3111 D3138 L3274 I3275 P3281 T3289	G3110-F3291 CarbonylContact C-O 3.55Å; G3110-F3291 VanDerWaalsContact CA-O 3.28Å; G3110-F3291 WeakPolarHBondContact CA-O 3.23Å; L3111-F3291 HydrophobicContact CD1-CD2 3.73Å; L3111-F3291 HydrophobicContact CD1-CE2 3.97Å; L3111-F3291 HydrophobicContact CG-CD2 4.05Å; L3111-F3291 WeakPolarHBondContact CG-O 3.21Å; L3111-F3291 PolarHBondContact N-O 3.1Å; L3111-F3291 VanDerWaalsContact N-O 3.08Å; D3138-F3291 VanDerWaalsContact OD1-CZ 3.31Å; D3138-F3291 WeakPolarHBondContact OD1-CZ 3.32Å; L3274-F3291 HydrophobicContact CD1-CB 3.97Å; L3274-F3291 HydrophobicContact CD1-CE2 4.47Å; L3274-F3291 HydrophobicContact CD1-CG 4.27Å; L3274-F3291 HydrophobicContact CD1-CZ 4.49Å; L3274-F3291 HydrophobicContact CD2-CB 4.44Å; L3274-F3291 HydrophobicContact CD2-CD1 3.5Å; L3274-F3291 HydrophobicContact CD2-CE1 3.78Å; L3274-F3291 HydrophobicContact CD2-CG 3.93Å; L3274-F3291 HydrophobicContact CD2-CZ 4.42Å; I3275-F3291 HydrophobicContact CD1-CZ 4.34Å; P3281-F3291 HydrophobicContact CB-CE2 4.12Å; T3289-F3291 PolarHBondContact O-N 3.08Å
3292	H	90.6	Very high	89.9	Confident	5 Å²	5	14.3 Å²	14.3	2%	0.023	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-56.6	178.3	-55.1	89.8	0	0	0	110.9	G3110 L3111 Y3115 V3117 D3138 D3290	G3110-H3292 CarbonylContact C-O 3.58Å; G3110-H3292 WeakPolarHBondContact CA-O 3.31Å; L3111-H3292 PolarHBondContact N-O 3.22Å; Y3115-H3292 HydrophobicContact CD1-CB 4.12Å; Y3115-H3292 HydrophobicContact CD2-CB 4.29Å; Y3115-H3292 HydrophobicContact CE1-CB 4.08Å; Y3115-H3292 WeakPolarHBondContact CE1-O 3.42Å; Y3115-H3292 HydrophobicContact CE2-CB 4.27Å; Y3115-H3292 HydrophobicContact CG-CB 4.23Å; Y3115-H3292 PolarHBondContact OH-O 2.76Å; V3117-H3292 HydrophobicContact CG2-CB 3.79Å; V3117-H3292 VanDerWaalsContact CG2-CD2 3.49Å; V3117-H3292 WeakPolarHBondContact CG2-CD2 3.26Å; V3117-H3292 VanDerWaalsContact CG2-CG 3.49Å; D3138-H3292 IonicContact OD1-CE1 3.2Å; D3138-H3292 IonicContact OD1-NE2 2.72Å; D3138-H3292 IonicContact OD2-CE1 2.95Å; D3138-H3292 IonicContact OD2-NE2 2.96Å; D3138-H3292 PolarHBondContact OD2-NE2 2.91Å; D3138-H3292 VanDerWaalsContact OD2-NE2 3.12Å; D3290-H3292 VanDerWaalsContact C-N 3.29Å; D3290-H3292 PolarHBondContact O-N 3.35Å; D3290-H3292 IonicContact OD1-CE1 3.13Å; D3290-H3292 IonicContact OD1-CG 3.27Å; D3290-H3292 PolarHBondContact OD1-N 3.32Å; D3290-H3292 IonicContact OD1-ND1 3.21Å; D3290-H3292 PolarHBondContact OD1-ND1 2.89Å; D3290-H3292 WeakPolarHBondContact OD2-CB 3.41Å
3293	T	93.1	Very high	89.9	Confident	0 Å²	0	14.5 Å²	14.5	0%	0	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-22.3	-176.6	60.5	0	0	0	0	113.7	R3053 F3064 A3075 A3109 Y3115 F3119 D3290 F3295	R3053-T3293 PolarHBondContact NH2-O 2.79Å; F3064-T3293 HydrophobicContact CE1-CG2 4.09Å; A3075-T3293 HydrophobicContact CB-CG2 3.54Å; A3109-T3293 CarbonylContact C-O 3.51Å; Y3115-T3293 HydrophobicContact CE2-CG2 4.13Å; Y3115-T3293 WeakPolarHBondContact OH-CA 3.32Å; Y3115-T3293 WeakPolarHBondContact OH-CG2 3.3Å; F3119-T3293 HydrophobicContact CZ-CG2 4.4Å; D3290-T3293 VanDerWaalsContact OD2-CB 3.3Å; D3290-T3293 WeakPolarHBondContact OD2-CB 3.35Å; D3290-T3293 VanDerWaalsContact OD2-CG2 3.3Å; D3290-T3293 WeakPolarHBondContact OD2-CG2 3.39Å; D3290-T3293 PolarHBondContact OD2-N 3.07Å; D3290-T3293 PolarHBondContact OD2-OG1 3.01Å; T3293-F3295 VanDerWaalsContact C-N 3.28Å; T3293-F3295 HydrophobicContact CG2-CD2 4.27Å; T3293-F3295 HydrophobicContact CG2-CE2 4.4Å; T3293-F3295 WeakPolarHBondContact OG1-CB 3.32Å; T3293-F3295 WeakPolarHBondContact OG1-CD2 3.43Å; T3293-F3295 VanDerWaalsContact OG1-CG 3.31Å; T3293-F3295 WeakPolarHBondContact OG1-CG 3.4Å; T3293-F3295 PolarHBondContact OG1-N 2.81Å
3294	G	91.2	Very high	90.1	Very high	13 Å²	13	14.5 Å²	14.5	13%	0.134	9%	0.087	C	C	.	.			trans	80.5	4.7	-168.7	0	0	0	0	0	113.9	D3290 P3307	D3290-G3294 CarbonylContact O-C 3.52Å; D3290-G3294 WeakPolarHBondContact O-CA 3.18Å; D3290-G3294 PolarHBondContact O-N 2.96Å; G3294-P3307 VanDerWaalsContact O-CD 3.31Å; G3294-P3307 WeakPolarHBondContact O-CD 3.19Å
3295	F	95.8	Very high	90.3	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	8%	0.084	C	C	.	.			trans	-75.2	149.9	-177.6	-65.7	-17.9	0	0	0	113.2	L3050 F3064 L3072 T3289 D3290 T3293 F3297 A3304 Y3305 D3306 T3313	L3050-F3295 HydrophobicContact CD2-CZ 4.41Å; F3064-F3295 AromaticContact CD1-CE2 3.92Å; F3064-F3295 HydrophobicContact CD1-CE2 3.92Å; F3064-F3295 HydrophobicContact CD1-CZ 4.34Å; F3064-F3295 AromaticContact CE1-CE2 3.5Å; F3064-F3295 HydrophobicContact CE1-CE2 3.5Å; F3064-F3295 VanDerWaalsContact CE1-CE2 3.49Å; F3064-F3295 AromaticContact CE1-CZ 3.62Å; F3064-F3295 HydrophobicContact CE1-CZ 3.62Å; F3064-F3295 HydrophobicContact CE2-CZ 4.03Å; F3064-F3295 HydrophobicContact CZ-CE1 4.47Å; F3064-F3295 AromaticContact CZ-CE2 3.85Å; F3064-F3295 HydrophobicContact CZ-CE2 3.85Å; F3064-F3295 AromaticContact CZ-CZ 3.44Å; F3064-F3295 HydrophobicContact CZ-CZ 3.44Å; F3064-F3295 VanDerWaalsContact CZ-CZ 3.44Å; L3072-F3295 HydrophobicContact CD2-CD2 3.73Å; L3072-F3295 HydrophobicContact CD2-CE2 3.96Å; T3289-F3295 WeakPolarHBondContact CA-O 3.39Å; D3290-F3295 PolarHBondContact N-O 3.17Å; T3293-F3295 VanDerWaalsContact C-N 3.28Å; T3293-F3295 HydrophobicContact CG2-CD2 4.27Å; T3293-F3295 HydrophobicContact CG2-CE2 4.4Å; T3293-F3295 WeakPolarHBondContact OG1-CB 3.32Å; T3293-F3295 WeakPolarHBondContact OG1-CD2 3.43Å; T3293-F3295 VanDerWaalsContact OG1-CG 3.31Å; T3293-F3295 WeakPolarHBondContact OG1-CG 3.4Å; T3293-F3295 PolarHBondContact OG1-N 2.81Å; F3295-F3297 HydrophobicContact CB-CE2 4.12Å; F3295-F3297 HydrophobicContact CB-CZ 4.42Å; F3295-A3304 HydrophobicContact CB-CB 4.32Å; F3295-A3304 HydrophobicContact CD2-CB 3.85Å; F3295-A3304 HydrophobicContact CE2-CB 4.48Å; F3295-A3304 HydrophobicContact CG-CB 4.33Å; F3295-Y3305 VanDerWaalsContact CA-O 3.31Å; F3295-Y3305 WeakPolarHBondContact CA-O 3.34Å; F3295-D3306 HydrophobicContact CD1-CB 3.84Å; F3295-D3306 HydrophobicContact CE1-CB 3.51Å; F3295-D3306 VanDerWaalsContact CE1-CG 3.5Å; F3295-D3306 HydrophobicContact CZ-CB 4.44Å; F3295-T3313 HydrophobicContact CD2-CG2 4.48Å; F3295-T3313 HydrophobicContact CE1-CG2 4.07Å; F3295-T3313 HydrophobicContact CE2-CG2 4Å; F3295-T3313 HydrophobicContact CZ-CG2 3.73Å
3296	L	95.5	Very high	90.5	Very high	1 Å²	1	13.7 Å²	13.7	1%	0.005	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	137.4	171.9	-55.8	178.3	0	0	0	110.2	H3284 C3287 I3288 T3289 Y3305 P3307	H3284-L3296 HydrophobicContact CB-CD1 3.92Å; C3287-L3296 HydrophobicContact CB-CB 4.19Å; I3288-L3296 CarbonylContact O-C 3.54Å; I3288-L3296 WeakPolarHBondContact O-CA 3.43Å; T3289-L3296 HydrophobicContact CG2-CD2 4.01Å; T3289-L3296 VanDerWaalsContact OG1-CD2 3.23Å; T3289-L3296 WeakPolarHBondContact OG1-CD2 3.34Å; L3296-Y3305 HydrophobicContact CB-CD1 4.24Å; L3296-Y3305 HydrophobicContact CD1-CD1 3.95Å; L3296-Y3305 HydrophobicContact CD1-CE1 4.3Å; L3296-Y3305 HydrophobicContact CG-CD1 4.34Å; L3296-Y3305 PolarHBondContact N-O 3.26Å; L3296-Y3305 PolarHBondContact O-N 2.99Å; L3296-P3307 HydrophobicContact CD1-CG 3.78Å; L3296-P3307 HydrophobicContact CG-CG 3.69Å
3297	F	96.2	Very high	90.6	Very high	4 Å²	4	12.2 Å²	12.2	2%	0.018	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	98.1	173.6	-58.4	-98.6	0	0	0	108.1	L3072 F3119 Y3121 L3127 I3288 D3290 F3295 S3302 A3304	L3072-F3297 HydrophobicContact CB-CE1 4.46Å; L3072-F3297 HydrophobicContact CD2-CE1 4.48Å; L3072-F3297 HydrophobicContact CD2-CZ 4.09Å; F3119-F3297 HydrophobicContact CD1-CE1 4.32Å; F3119-F3297 HydrophobicContact CD1-CE2 4.42Å; F3119-F3297 AromaticContact CD1-CZ 3.79Å; F3119-F3297 HydrophobicContact CD1-CZ 3.79Å; F3119-F3297 HydrophobicContact CE1-CE1 4.48Å; F3119-F3297 AromaticContact CE1-CE2 3.93Å; F3119-F3297 HydrophobicContact CE1-CE2 3.98Å; F3119-F3297 AromaticContact CE1-CZ 3.54Å; F3119-F3297 HydrophobicContact CE1-CZ 3.54Å; F3119-F3297 HydrophobicContact CZ-CZ 4.31Å; Y3121-F3297 WeakPolarHBondContact OH-CE1 3.38Å; L3127-F3297 HydrophobicContact CD2-CB 4.38Å; L3127-F3297 HydrophobicContact CD2-CD1 4.19Å; L3127-F3297 HydrophobicContact CD2-CD2 4.08Å; L3127-F3297 HydrophobicContact CD2-CE1 4.47Å; L3127-F3297 HydrophobicContact CD2-CE2 4.4Å; L3127-F3297 HydrophobicContact CD2-CG 3.98Å; I3288-F3297 HydrophobicContact CB-CB 4.25Å; I3288-F3297 PolarHBondContact N-O 2.92Å; I3288-F3297 VanDerWaalsContact N-O 3.13Å; I3288-F3297 PolarHBondContact O-N 3.42Å; D3290-F3297 HydrophobicContact CB-CE2 3.76Å; F3295-F3297 HydrophobicContact CB-CE2 4.12Å; F3295-F3297 HydrophobicContact CB-CZ 4.42Å; F3297-S3302 WeakPolarHBondContact CD1-O 3.34Å; F3297-A3304 HydrophobicContact CD1-CB 4.36Å; F3297-A3304 HydrophobicContact CE1-CB 3.77Å; F3297-A3304 HydrophobicContact CZ-CB 4.07Å
3298	C	88.9	Confident	90.5	Very high	5 Å²	5	12.2 Å²	12.2	3%	0.034	7%	0.072	C	C	.	.			trans	-98.2	140.8	-176.7	-60.7	0	0	0	0	111.1	C3287 S3302 W3340 L3348	C3287-C3298 HydrophobicContact CB-CB 3.99Å; C3287-C3298 WeakPolarHBondContact CB-SG 3.47Å; C3287-C3298 WeakPolarHBondContact SG-CA 3.41Å; C3287-C3298 WeakPolarHBondContact SG-CB 3.37Å; C3287-C3298 CovalentContact SG-SG 2.02Å; C3287-C3298 PolarHBondContact SG-SG 3.04Å; C3298-S3302 WeakPolarHBondContact O-CA 3.44Å; C3298-S3302 PolarHBondContact O-N 3.18Å; C3298-W3340 HydrophobicContact CB-CH2 4.33Å; C3298-W3340 HydrophobicContact CB-CZ3 4.19Å; C3298-L3348 HydrophobicContact CB-CD1 4.44Å
3299	P	80.7	Confident	90.4	Very high	40.5 Å²	40.5	11.7 Å²	11.7	26%	0.263	7%	0.069	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	156.6	165.8	29.4	-33.4	0	0	0	110.6	T3151 L3348	T3151-P3299 HydrophobicContact CG2-CB 4.31Å; P3299-L3348 HydrophobicContact CG-CD2 3.81Å
3300	P	70.9	Confident	90.4	Very high	50.5 Å²	50.5	12.4 Å²	12.4	33%	0.328	8%	0.076	S	C	.	.	T	Hydrogen-bonded Turn	cis	-89.2	-10.6	5.2	33.6	-33.4	0	0	0	114.8	L3398	P3300-L3398 HydrophobicContact CB-CD2 4.27Å
3301	T	75.7	Confident	90.5	Very high	28.5 Å²	28.5	12.6 Å²	12.6	18%	0.175	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-11.6	-168.6	58.4	0	0	0	0	115.1	L3071 R3303	L3071-T3301 WeakPolarHBondContact CD2-O 3.4Å; T3301-R3303 PolarHBondContact O-N 2.89Å; T3301-R3303 PolarHBondContact OG1-NE 3.06Å
3302	S	85.4	Confident	91	Very high	12 Å²	12	10.4 Å²	10.4	8%	0.084	7%	0.067	C	C	.	.			trans	51.3	24.3	-173.4	-58.2	0	0	0	0	113.8	D3125 F3297 C3298	D3125-S3302 VanDerWaalsContact O-CB 3.28Å; D3125-S3302 WeakPolarHBondContact O-CB 3.45Å; D3125-S3302 PolarHBondContact O-OG 2.9Å; F3297-S3302 WeakPolarHBondContact CD1-O 3.34Å; C3298-S3302 WeakPolarHBondContact O-CA 3.44Å; C3298-S3302 PolarHBondContact O-N 3.18Å
3303	R	93.3	Very high	91.3	Very high	7.5 Å²	7.5	10.2 Å²	10.2	3%	0.028	7%	0.066	C	C	.	.	P	Polyproline II helix	trans	-66.5	139.6	170.4	-70.3	-173.4	-59.6	143.6	-0.5	109.1	T3301 Y3305 F3312 S3314 D3316 T3337 E3344	T3301-R3303 PolarHBondContact O-N 2.89Å; T3301-R3303 PolarHBondContact OG1-NE 3.06Å; R3303-Y3305 PolarHBondContact O-N 2.86Å; R3303-F3312 HydrophobicContact CB-CD1 3.98Å; R3303-F3312 HydrophobicContact CB-CE1 4.25Å; R3303-S3314 PolarHBondContact NH1-O 3.1Å; R3303-D3316 VanDerWaalsContact CZ-CB 3.4Å; R3303-D3316 VanDerWaalsContact NH1-N 3.16Å; R3303-D3316 IonicContact NH2-OD2 2.73Å; R3303-T3337 PolarHBondContact NH1-O 2.69Å; R3303-E3344 IonicContact NH2-OE1 2.75Å; R3303-E3344 PolarHBondContact NH2-OE1 3.21Å
3304	A	96.9	Very high	91.5	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	118	175.6	0	0	0	0	0	109.6	L3072 F3295 F3297 T3313	L3072-A3304 HydrophobicContact CB-CB 4.13Å; L3072-A3304 HydrophobicContact CD2-CB 4.14Å; F3295-A3304 HydrophobicContact CB-CB 4.32Å; F3295-A3304 HydrophobicContact CD2-CB 3.85Å; F3295-A3304 HydrophobicContact CE2-CB 4.48Å; F3295-A3304 HydrophobicContact CG-CB 4.33Å; F3297-A3304 HydrophobicContact CD1-CB 4.36Å; F3297-A3304 HydrophobicContact CE1-CB 3.77Å; F3297-A3304 HydrophobicContact CZ-CB 4.07Å; A3304-T3313 HydrophobicContact CB-CG2 4.45Å; A3304-T3313 WeakPolarHBondContact CB-OG1 3.16Å; A3304-T3313 WeakPolarHBondContact O-CB 3.08Å; A3304-T3313 WeakPolarHBondContact O-CG2 3.2Å; A3304-T3313 PolarHBondContact O-N 3.45Å; A3304-T3313 PolarHBondContact O-OG1 2.83Å
3305	Y	96.5	Very high	91.7	Very high	15.5 Å²	15.5	9.5 Å²	9.5	6%	0.061	6%	0.06	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	132.3	169.4	173.2	-98.9	0	0	0	109.1	T3256 F3295 L3296 R3303 P3307 F3312 W3340	T3256-Y3305 VanDerWaalsContact O-CE1 3.25Å; T3256-Y3305 WeakPolarHBondContact O-CE1 3.31Å; T3256-Y3305 PolarHBondContact O-OH 3.16Å; F3295-Y3305 VanDerWaalsContact CA-O 3.31Å; F3295-Y3305 WeakPolarHBondContact CA-O 3.34Å; L3296-Y3305 HydrophobicContact CB-CD1 4.24Å; L3296-Y3305 HydrophobicContact CD1-CD1 3.95Å; L3296-Y3305 HydrophobicContact CD1-CE1 4.3Å; L3296-Y3305 HydrophobicContact CG-CD1 4.34Å; L3296-Y3305 PolarHBondContact N-O 3.26Å; L3296-Y3305 PolarHBondContact O-N 2.99Å; R3303-Y3305 PolarHBondContact O-N 2.86Å; Y3305-P3307 HydrophobicContact CD1-CB 4.48Å; Y3305-P3307 HydrophobicContact CD1-CG 3.93Å; Y3305-P3307 HydrophobicContact CE1-CB 4.05Å; Y3305-P3307 HydrophobicContact CE1-CG 3.9Å; Y3305-P3307 VanDerWaalsContact O-CD 3.3Å; Y3305-P3307 WeakPolarHBondContact O-CD 3.27Å; Y3305-F3312 HydrophobicContact CD2-CD1 4.26Å; Y3305-F3312 HydrophobicContact CD2-CD2 4.25Å; Y3305-F3312 HydrophobicContact CD2-CE1 4.33Å; Y3305-F3312 HydrophobicContact CD2-CE2 4.32Å; Y3305-F3312 HydrophobicContact CD2-CG 4.21Å; Y3305-F3312 HydrophobicContact CD2-CZ 4.35Å; Y3305-F3312 HydrophobicContact CG-CE1 4.45Å; Y3305-W3340 HydrophobicContact CD2-CE3 4.28Å; Y3305-W3340 HydrophobicContact CE2-CB 4.08Å; Y3305-W3340 HydrophobicContact CE2-CE3 4.46Å; Y3305-W3340 HydrophobicContact CG-CE3 4.49Å
3306	D	95.9	Very high	91.5	Very high	1 Å²	1	9.9 Å²	9.9	1%	0.005	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	104.5	174.4	-177.5	17.1	0	0	0	110.2	Y3042 R3053 F3295 L3308 G3309 A3310 T3311 T3313	Y3042-D3306 VanDerWaalsContact CE1-OD2 3.25Å; Y3042-D3306 WeakPolarHBondContact CE1-OD2 3.28Å; Y3042-D3306 PolarHBondContact OH-OD2 3.38Å; R3053-D3306 IonicContact CZ-OD2 3.33Å; R3053-D3306 IonicContact NH1-OD1 3.81Å; R3053-D3306 PolarHBondContact NH1-OD1 2.75Å; R3053-D3306 IonicContact NH1-OD2 3.11Å; R3053-D3306 PolarHBondContact NH1-OD2 3.06Å; F3295-D3306 HydrophobicContact CD1-CB 3.84Å; F3295-D3306 HydrophobicContact CE1-CB 3.51Å; F3295-D3306 VanDerWaalsContact CE1-CG 3.5Å; F3295-D3306 HydrophobicContact CZ-CB 4.44Å; D3306-L3308 PolarHBondContact O-N 2.97Å; D3306-L3308 WeakPolarHBondContact OD1-CB 3.22Å; D3306-L3308 PolarHBondContact OD1-N 3.14Å; D3306-G3309 VanDerWaalsContact CG-N 3.3Å; D3306-G3309 PolarHBondContact O-N 3.13Å; D3306-G3309 PolarHBondContact OD2-N 2.75Å; D3306-A3310 WeakPolarHBondContact O-CA 3.33Å; D3306-A3310 PolarHBondContact O-N 3.13Å; D3306-T3311 PolarHBondContact N-O 3.06Å; D3306-T3311 PolarHBondContact O-N 3.02Å; D3306-T3311 VanDerWaalsContact O-N 3.14Å; D3306-T3313 HydrophobicContact CB-CG2 3.93Å
3307	P	93.7	Very high	91.2	Very high	0.5 Å²	0.5	10.6 Å²	10.6	0%	0.003	6%	0.064	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-25.9	175.3	-20	34.5	0	0	0	112.7	T3256 S3258 G3294 L3296 Y3305 A3310	T3256-P3307 WeakPolarHBondContact CB-O 3.37Å; T3256-P3307 PolarHBondContact OG1-O 3.29Å; S3258-P3307 VanDerWaalsContact OG-CB 3.23Å; S3258-P3307 WeakPolarHBondContact OG-CB 3.42Å; G3294-P3307 VanDerWaalsContact O-CD 3.31Å; G3294-P3307 WeakPolarHBondContact O-CD 3.19Å; L3296-P3307 HydrophobicContact CD1-CG 3.78Å; L3296-P3307 HydrophobicContact CG-CG 3.69Å; Y3305-P3307 HydrophobicContact CD1-CB 4.48Å; Y3305-P3307 HydrophobicContact CD1-CG 3.93Å; Y3305-P3307 HydrophobicContact CE1-CB 4.05Å; Y3305-P3307 HydrophobicContact CE1-CG 3.9Å; Y3305-P3307 VanDerWaalsContact O-CD 3.3Å; Y3305-P3307 WeakPolarHBondContact O-CD 3.27Å; P3307-A3310 PolarHBondContact O-N 2.95Å
3308	L	91.7	Very high	90.6	Very high	0.5 Å²	0.5	11.6 Å²	11.6	0%	0.003	7%	0.069	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-48	177.1	-172.4	75	0	0	0	110.5	R3037 W3040 Y3042 D3108 A3109 D3306 A3310	R3037-L3308 WeakPolarHBondContact CD-O 3.44Å; R3037-L3308 PolarHBondContact NE-O 3.39Å; R3037-L3308 VanDerWaalsContact NH1-CD1 3.27Å; R3037-L3308 PolarHBondContact NH1-O 2.95Å; W3040-L3308 HydrophobicContact CD2-CD2 4.02Å; W3040-L3308 HydrophobicContact CG-CD2 4.18Å; W3040-L3308 HydrophobicContact CZ2-CD2 4.47Å; Y3042-L3308 WeakPolarHBondContact OH-CD2 3.43Å; D3108-L3308 HydrophobicContact CB-CD1 3.85Å; A3109-L3308 HydrophobicContact CB-CD2 3.96Å; D3306-L3308 PolarHBondContact O-N 2.97Å; D3306-L3308 WeakPolarHBondContact OD1-CB 3.22Å; D3306-L3308 PolarHBondContact OD1-N 3.14Å; L3308-A3310 VanDerWaalsContact C-N 3.31Å; L3308-A3310 PolarHBondContact O-N 3.14Å
3309	G	93.5	Very high	90.4	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	7%	0.069	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-7.9	176.8	0	0	0	0	0	114.8	Y3042 D3306 T3311	Y3042-G3309 WeakPolarHBondContact OH-CA 3.43Å; Y3042-G3309 PolarHBondContact OH-N 3.03Å; D3306-G3309 VanDerWaalsContact CG-N 3.3Å; D3306-G3309 PolarHBondContact O-N 3.13Å; D3306-G3309 PolarHBondContact OD2-N 2.75Å; G3309-T3311 VanDerWaalsContact C-N 3.28Å; G3309-T3311 PolarHBondContact O-N 2.83Å
3310	A	93.8	Very high	90.8	Very high	23 Å²	23	9.6 Å²	9.6	19%	0.19	6%	0.057	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.9	41.6	-170.6	0	0	0	0	0	113.1	I2995 T3256 D3306 P3307 L3308	I2995-A3310 HydrophobicContact CD1-CB 3.69Å; T3256-A3310 HydrophobicContact CG2-CB 3.7Å; D3306-A3310 WeakPolarHBondContact O-CA 3.33Å; D3306-A3310 PolarHBondContact O-N 3.13Å; P3307-A3310 PolarHBondContact O-N 2.95Å; L3308-A3310 VanDerWaalsContact C-N 3.31Å; L3308-A3310 PolarHBondContact O-N 3.14Å
3311	T	95.2	Very high	91.2	Very high	7 Å²	7	7.5 Å²	7.5	4%	0.043	4%	0.043	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	144.8	-171.9	-168.3	0	0	0	0	112.1	L3034 F3044 D3306 G3309 H3338	L3034-T3311 HydrophobicContact CD2-CG2 4.45Å; F3044-T3311 HydrophobicContact CZ-CG2 4.34Å; D3306-T3311 PolarHBondContact N-O 3.06Å; D3306-T3311 PolarHBondContact O-N 3.02Å; D3306-T3311 VanDerWaalsContact O-N 3.14Å; G3309-T3311 VanDerWaalsContact C-N 3.28Å; G3309-T3311 PolarHBondContact O-N 2.83Å; T3311-H3338 PolarHBondContact OG1-O 3.36Å
3312	F	96.9	Very high	91.1	Very high	4 Å²	4	7.5 Å²	7.5	2%	0.018	4%	0.043	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	140.6	165.2	-76.4	-77.6	0	0	0	110.1	R3303 Y3305 S3314 H3338 W3340 E3344	R3303-F3312 HydrophobicContact CB-CD1 3.98Å; R3303-F3312 HydrophobicContact CB-CE1 4.25Å; Y3305-F3312 HydrophobicContact CD2-CD1 4.26Å; Y3305-F3312 HydrophobicContact CD2-CD2 4.25Å; Y3305-F3312 HydrophobicContact CD2-CE1 4.33Å; Y3305-F3312 HydrophobicContact CD2-CE2 4.32Å; Y3305-F3312 HydrophobicContact CD2-CG 4.21Å; Y3305-F3312 HydrophobicContact CD2-CZ 4.35Å; Y3305-F3312 HydrophobicContact CG-CE1 4.45Å; F3312-S3314 VanDerWaalsContact C-N 3.29Å; F3312-S3314 PolarHBondContact O-N 2.76Å; F3312-H3338 PolarHBondContact N-O 3.2Å; F3312-H3338 PolarHBondContact O-CD2 3.17Å; F3312-H3338 VanDerWaalsContact O-CD2 3.24Å; F3312-W3340 HydrophobicContact CE2-CB 4.35Å; F3312-W3340 AromaticContact CE2-CE3 3.93Å; F3312-W3340 HydrophobicContact CE2-CE3 3.93Å; F3312-W3340 AromaticContact CZ-CE3 3.61Å; F3312-W3340 HydrophobicContact CZ-CE3 3.61Å; F3312-W3340 AromaticContact CZ-CZ3 3.99Å; F3312-W3340 HydrophobicContact CZ-CZ3 4.01Å; F3312-E3344 HydrophobicContact CE2-CG 3.71Å; F3312-E3344 HydrophobicContact CZ-CG 3.66Å
3313	T	97.4	Very high	90.7	Very high	0 Å²	0	7.5 Å²	7.5	0%	0	4%	0.043	C	C	.	.	S	Bend	trans	-82.7	-10.5	-177.3	66.5	0	0	0	0	113.2	L3050 Y3066 F3295 A3304 D3306	L3050-T3313 HydrophobicContact CD2-CG2 3.9Å; L3050-T3313 PolarHBondContact N-O 2.98Å; Y3066-T3313 WeakPolarHBondContact CE1-OG1 3.16Å; Y3066-T3313 WeakPolarHBondContact OH-CB 3.32Å; Y3066-T3313 PolarHBondContact OH-OG1 3.23Å; F3295-T3313 HydrophobicContact CD2-CG2 4.48Å; F3295-T3313 HydrophobicContact CE1-CG2 4.07Å; F3295-T3313 HydrophobicContact CE2-CG2 4Å; F3295-T3313 HydrophobicContact CZ-CG2 3.73Å; A3304-T3313 HydrophobicContact CB-CG2 4.45Å; A3304-T3313 WeakPolarHBondContact CB-OG1 3.16Å; A3304-T3313 WeakPolarHBondContact O-CB 3.08Å; A3304-T3313 WeakPolarHBondContact O-CG2 3.2Å; A3304-T3313 PolarHBondContact O-N 3.45Å; A3304-T3313 PolarHBondContact O-OG1 2.83Å; D3306-T3313 HydrophobicContact CB-CG2 3.93Å
3314	S	96.4	Very high	90.4	Very high	0 Å²	0	7.3 Å²	7.3	0%	0	4%	0.042	C	C	.	.	S	Bend	trans	-142.9	153.2	176.1	64.8	0	0	0	0	112.2	G3070 R3303 F3312	G3070-S3314 WeakPolarHBondContact O-CB 3.27Å; G3070-S3314 PolarHBondContact O-OG 3.3Å; R3303-S3314 PolarHBondContact NH1-O 3.1Å; F3312-S3314 VanDerWaalsContact C-N 3.29Å; F3312-S3314 PolarHBondContact O-N 2.76Å
3315	P	95.5	Very high	89.7	Confident	0 Å²	0	8.3 Å²	8.3	0%	0	5%	0.047	C	C	.	.			trans	-74.1	146	-179.1	-2.9	17.8	0	0	0	113.2	W2709 W2735 D3047 F3049 W3317	W2709-P3315 HydrophobicContact CH2-CB 3.23Å; W2709-P3315 HydrophobicContact CH2-CG 4.24Å; W2709-P3315 HydrophobicContact CZ2-CB 3.43Å; W2709-P3315 VanDerWaalsContact CZ2-CB 3.43Å; W2709-P3315 HydrophobicContact CZ2-CG 3.96Å; W2709-P3315 HydrophobicContact CZ3-CB 4.33Å; W2735-P3315 HydrophobicContact CH2-CB 3.82Å; W2735-P3315 HydrophobicContact CH2-CG 3.65Å; W2735-P3315 HydrophobicContact CZ3-CB 3.85Å; W2735-P3315 HydrophobicContact CZ3-CG 3.52Å; D3047-P3315 WeakPolarHBondContact O-CG 3.31Å; F3049-P3315 HydrophobicContact CD2-CG 4.36Å; F3049-P3315 HydrophobicContact CE2-CG 4.22Å; P3315-W3317 PolarHBondContact O-N 2.98Å; P3315-W3317 VanDerWaalsContact O-N 3.11Å
3316	D	92.5	Very high	88.8	Confident	6.5 Å²	6.5	9.7 Å²	9.7	4%	0.035	6%	0.06	C	C	.	.			trans	-80	71.1	175.6	-163.5	3.7	0	0	0	113.6	R3303 H3318 G3319 L3320 R3324 T3337	R3303-D3316 VanDerWaalsContact CZ-CB 3.4Å; R3303-D3316 VanDerWaalsContact NH1-N 3.16Å; R3303-D3316 IonicContact NH2-OD2 2.73Å; D3316-H3318 VanDerWaalsContact C-N 3.3Å; D3316-H3318 PolarHBondContact O-N 3.4Å; D3316-G3319 VanDerWaalsContact OD1-CA 3.31Å; D3316-G3319 WeakPolarHBondContact OD1-CA 3.17Å; D3316-G3319 PolarHBondContact OD1-N 3.35Å; D3316-G3319 WeakPolarHBondContact OD2-CA 3.3Å; D3316-L3320 WeakPolarHBondContact O-CB 3.3Å; D3316-L3320 PolarHBondContact O-N 3.3Å; D3316-R3324 IonicContact OD2-CZ 3.39Å; D3316-R3324 IonicContact OD2-NE 2.74Å; D3316-R3324 PolarHBondContact OD2-NE 3.16Å; D3316-R3324 IonicContact OD2-NH2 3.21Å; D3316-R3324 PolarHBondContact OD2-NH2 2.97Å; D3316-T3337 HydrophobicContact CB-CG2 4.32Å
3317	W	89.4	Confident	88.1	Confident	16.5 Å²	16.5	10.7 Å²	10.7	6%	0.063	7%	0.065	C	C	.	.	H	α-helix	trans	-63.3	-36.4	179.8	77.1	-82.9	0	0	0	112.9	W2709 Y2711 L2730 F2733 W2735 I2742 K3069 P3315	W2709-W3317 HydrophobicContact CE3-CB 4.26Å; W2709-W3317 HydrophobicContact CZ3-CB 4.16Å; Y2711-W3317 AromaticContact CE1-CE3 3.9Å; Y2711-W3317 HydrophobicContact CE1-CE3 3.9Å; Y2711-W3317 HydrophobicContact CE1-CZ3 4.37Å; Y2711-W3317 WeakPolarHBondContact CE1-O 3.48Å; Y2711-W3317 PolarHBondContact OH-O 3.03Å; L2730-W3317 HydrophobicContact CD2-CH2 4.23Å; L2730-W3317 HydrophobicContact CD2-CZ3 4.03Å; F2733-W3317 HydrophobicContact CB-CE3 3.9Å; F2733-W3317 HydrophobicContact CB-CH2 4.47Å; F2733-W3317 HydrophobicContact CB-CZ3 3.71Å; F2733-W3317 HydrophobicContact CD1-CB 4.39Å; F2733-W3317 AromaticContact CD1-CD2 3.68Å; F2733-W3317 HydrophobicContact CD1-CD2 3.68Å; F2733-W3317 AromaticContact CD1-CE3 3.46Å; F2733-W3317 HydrophobicContact CD1-CE3 3.46Å; F2733-W3317 VanDerWaalsContact CD1-CE3 3.46Å; F2733-W3317 HydrophobicContact CD1-CG 4.08Å; F2733-W3317 HydrophobicContact CD1-CZ3 4.06Å; F2733-W3317 AromaticContact CD2-CE3 3.7Å; F2733-W3317 HydrophobicContact CD2-CE3 3.7Å; F2733-W3317 HydrophobicContact CD2-CZ3 4.3Å; F2733-W3317 HydrophobicContact CE1-CB 3.56Å; F2733-W3317 AromaticContact CE1-CD2 3.72Å; F2733-W3317 HydrophobicContact CE1-CD2 3.72Å; F2733-W3317 AromaticContact CE1-CE3 3.83Å; F2733-W3317 HydrophobicContact CE1-CE3 3.83Å; F2733-W3317 AromaticContact CE1-CG 3.6Å; F2733-W3317 HydrophobicContact CE1-CG 3.6Å; F2733-W3317 HydrophobicContact CE2-CB 4.01Å; F2733-W3317 HydrophobicContact CE2-CE3 4.07Å; F2733-W3317 HydrophobicContact CG-CD2 4.1Å; F2733-W3317 AromaticContact CG-CE3 3.38Å; F2733-W3317 HydrophobicContact CG-CE3 3.38Å; F2733-W3317 AromaticContact CG-CZ3 3.76Å; F2733-W3317 HydrophobicContact CG-CZ3 3.76Å; F2733-W3317 HydrophobicContact CZ-CB 3.36Å; F2733-W3317 HydrophobicContact CZ-CD2 4.23Å; F2733-W3317 HydrophobicContact CZ-CE3 4.15Å; F2733-W3317 AromaticContact CZ-CG 3.93Å; F2733-W3317 HydrophobicContact CZ-CG 3.93Å; W2735-W3317 HydrophobicContact CH2-CB 3.72Å; W2735-W3317 HydrophobicContact CH2-CG 4.26Å; W2735-W3317 HydrophobicContact CZ2-CB 3.92Å; W2735-W3317 AromaticContact CZ2-CD1 3.77Å; W2735-W3317 AromaticContact CZ2-CG 3.99Å; W2735-W3317 HydrophobicContact CZ2-CG 3.99Å; W2735-W3317 HydrophobicContact CZ3-CB 4.4Å; I2742-W3317 HydrophobicContact CD1-CD2 4.11Å; I2742-W3317 VanDerWaalsContact CD1-CE2 3.41Å; I2742-W3317 HydrophobicContact CD1-CE3 4.4Å; I2742-W3317 HydrophobicContact CD1-CH2 3.53Å; I2742-W3317 HydrophobicContact CD1-CZ2 3.16Å; I2742-W3317 HydrophobicContact CD1-CZ3 4.14Å; K3069-W3317 PolarHBondContact O-NE1 3.1Å; P3315-W3317 PolarHBondContact O-N 2.98Å; P3315-W3317 VanDerWaalsContact O-N 3.11Å
3318	H	83.5	Confident	87.7	Confident	25 Å²	25	10.7 Å²	10.7	12%	0.116	7%	0.065	C	C	.	.	H	α-helix	trans	-74.4	-46.7	-178.7	-179.3	75.2	0	0	0	111.6	D3316 L3320 S3322 K3399	D3316-H3318 VanDerWaalsContact C-N 3.3Å; D3316-H3318 PolarHBondContact O-N 3.4Å; H3318-L3320 VanDerWaalsContact C-N 3.26Å; H3318-L3320 PolarHBondContact O-N 3.13Å; H3318-S3322 WeakPolarHBondContact O-CB 3.39Å; H3318-S3322 PolarHBondContact O-N 3.33Å; H3318-S3322 PolarHBondContact O-OG 2.89Å; H3318-K3399 PolarHBondContact CE1-O 2.93Å; H3318-K3399 VanDerWaalsContact CE1-O 3.32Å; H3318-K3399 PolarHBondContact NE2-O 3.09Å
3319	G	84	Confident	87	Confident	3.5 Å²	3.5	12.1 Å²	12.1	4%	0.036	7%	0.071	C	C	.	.	H	α-helix	trans	-66.3	-25.2	178.1	0	0	0	0	0	113.2	D3316 I3321 S3322 T3323 R3324	D3316-G3319 VanDerWaalsContact OD1-CA 3.31Å; D3316-G3319 WeakPolarHBondContact OD1-CA 3.17Å; D3316-G3319 PolarHBondContact OD1-N 3.35Å; D3316-G3319 WeakPolarHBondContact OD2-CA 3.3Å; G3319-I3321 VanDerWaalsContact C-N 3.35Å; G3319-I3321 PolarHBondContact O-N 2.77Å; G3319-S3322 WeakPolarHBondContact CA-OG 3.36Å; G3319-T3323 CarbonylContact O-C 3.49Å; G3319-T3323 WeakPolarHBondContact O-CA 3.19Å; G3319-T3323 PolarHBondContact O-N 2.82Å; G3319-T3323 PolarHBondContact O-OG1 2.94Å; G3319-R3324 WeakPolarHBondContact O-CG 3.18Å; G3319-R3324 PolarHBondContact O-N 3.12Å
3320	L	87.8	Confident	86.3	Confident	0 Å²	0	13.2 Å²	13.2	0%	0	8%	0.075	C	C	.	.	I	π-helix	trans	-50.5	-54.6	177.7	-175.5	66.2	0	0	0	111.8	F2699 W2709 Y2711 D3316 H3318 R3324 L3325 L3335 T3337	F2699-L3320 HydrophobicContact CB-CD2 4.03Å; F2699-L3320 HydrophobicContact CD1-CD2 3.41Å; F2699-L3320 VanDerWaalsContact CD1-CD2 3.41Å; F2699-L3320 HydrophobicContact CD2-CD2 4.45Å; F2699-L3320 HydrophobicContact CE1-CD1 4.28Å; F2699-L3320 HydrophobicContact CE1-CD2 3.87Å; F2699-L3320 HydrophobicContact CG-CD2 3.72Å; F2699-L3320 HydrophobicContact CZ-CD1 4.34Å; W2709-L3320 HydrophobicContact CE3-CD2 3.76Å; W2709-L3320 HydrophobicContact CZ3-CB 4.46Å; W2709-L3320 HydrophobicContact CZ3-CD2 3.94Å; Y2711-L3320 HydrophobicContact CE2-CD2 4.1Å; Y2711-L3320 WeakPolarHBondContact OH-CD2 3.41Å; D3316-L3320 WeakPolarHBondContact O-CB 3.3Å; D3316-L3320 PolarHBondContact O-N 3.3Å; H3318-L3320 VanDerWaalsContact C-N 3.26Å; H3318-L3320 PolarHBondContact O-N 3.13Å; L3320-R3324 HydrophobicContact CD1-CB 4.47Å; L3320-R3324 PolarHBondContact O-N 2.79Å; L3320-L3325 WeakPolarHBondContact O-CG 3.34Å; L3320-L3325 PolarHBondContact O-N 2.97Å; L3320-L3335 HydrophobicContact CD1-CD2 3.85Å; L3320-T3337 HydrophobicContact CD1-CG2 4.44Å
3321	I	80.2	Confident	85.9	Confident	7.5 Å²	7.5	12.9 Å²	12.9	4%	0.038	7%	0.071	C	C	.	.	I	π-helix	trans	-84.9	-42.3	-176.3	-51.9	-53.9	0	0	0	111.7	L2697 Y2711 W2713 G3319 T3323 L3325 L3404 F3405 M3409	L2697-I3321 HydrophobicContact CD2-CD1 3.38Å; L2697-I3321 VanDerWaalsContact CD2-CD1 3.4Å; L2697-I3321 HydrophobicContact CD2-CG1 4.46Å; Y2711-I3321 HydrophobicContact CD1-CG1 3.72Å; Y2711-I3321 HydrophobicContact CD2-CD1 4.17Å; Y2711-I3321 HydrophobicContact CD2-CG1 4.2Å; Y2711-I3321 HydrophobicContact CE1-CD1 4.35Å; Y2711-I3321 HydrophobicContact CE1-CG1 3.46Å; Y2711-I3321 VanDerWaalsContact CE1-CG1 3.46Å; Y2711-I3321 HydrophobicContact CE2-CD1 3.98Å; Y2711-I3321 HydrophobicContact CE2-CG1 4Å; Y2711-I3321 HydrophobicContact CG-CD1 4.46Å; Y2711-I3321 HydrophobicContact CG-CG1 4.08Å; W2713-I3321 HydrophobicContact CH2-CG1 4.45Å; W2713-I3321 HydrophobicContact CH2-CG2 4.46Å; W2713-I3321 HydrophobicContact CZ2-CG2 4.06Å; G3319-I3321 VanDerWaalsContact C-N 3.35Å; G3319-I3321 PolarHBondContact O-N 2.77Å; I3321-T3323 VanDerWaalsContact C-N 3.33Å; I3321-T3323 PolarHBondContact O-N 2.9Å; I3321-L3325 HydrophobicContact CD1-CD1 3.52Å; I3321-L3325 HydrophobicContact CD1-CG 4.25Å; I3321-L3325 HydrophobicContact CG2-CD1 4.34Å; I3321-L3404 HydrophobicContact CB-CD2 3.76Å; I3321-L3404 HydrophobicContact CB-CG 3.88Å; I3321-L3404 HydrophobicContact CG1-CD2 3.91Å; I3321-L3404 HydrophobicContact CG2-CD2 3.84Å; I3321-L3404 HydrophobicContact CG2-CG 3.97Å; I3321-L3404 VanDerWaalsContact CG2-O 3.29Å; I3321-L3404 WeakPolarHBondContact CG2-O 3.4Å; I3321-F3405 HydrophobicContact CG2-CD1 4.17Å; I3321-F3405 HydrophobicContact CG2-CE1 4.04Å; I3321-M3409 HydrophobicContact CG2-CE 4.06Å
3322	S	73.2	Confident	85.7	Confident	27 Å²	27	12.6 Å²	12.6	19%	0.189	7%	0.068	C	C	.	.	I	π-helix	trans	-73.9	-23.6	-172.9	60.6	0	0	0	0	114	H3318 G3319	H3318-S3322 WeakPolarHBondContact O-CB 3.39Å; H3318-S3322 PolarHBondContact O-N 3.33Å; H3318-S3322 PolarHBondContact O-OG 2.89Å; G3319-S3322 WeakPolarHBondContact CA-OG 3.36Å
3323	T	77.7	Confident	85.5	Confident	12 Å²	12	12.7 Å²	12.7	7%	0.074	7%	0.07	C	C	.	.	I	π-helix	trans	-141.6	-39.4	-173.9	62.2	0	0	0	0	115.3	G3319 I3321 S3326 N3327 K3399	G3319-T3323 CarbonylContact O-C 3.49Å; G3319-T3323 WeakPolarHBondContact O-CA 3.19Å; G3319-T3323 PolarHBondContact O-N 2.82Å; G3319-T3323 PolarHBondContact O-OG1 2.94Å; I3321-T3323 VanDerWaalsContact C-N 3.33Å; I3321-T3323 PolarHBondContact O-N 2.9Å; T3323-S3326 PolarHBondContact O-OG 3.08Å; T3323-N3327 PolarHBondContact O-ND2 3.42Å; T3323-K3399 HydrophobicContact CG2-CD 3.59Å
3324	R	86.9	Confident	85.1	Confident	3 Å²	3	13 Å²	13	1%	0.011	7%	0.072	C	C	.	.	I	π-helix	trans	-76.5	-42.5	-171.7	-64.1	169.3	-179.8	-84.9	-5.6	111.9	D3316 G3319 L3320 S3326 N3327 I3328 V3334 D3336 I3343 E3344	D3316-R3324 IonicContact OD2-CZ 3.39Å; D3316-R3324 IonicContact OD2-NE 2.74Å; D3316-R3324 PolarHBondContact OD2-NE 3.16Å; D3316-R3324 IonicContact OD2-NH2 3.21Å; D3316-R3324 PolarHBondContact OD2-NH2 2.97Å; G3319-R3324 WeakPolarHBondContact O-CG 3.18Å; G3319-R3324 PolarHBondContact O-N 3.12Å; L3320-R3324 HydrophobicContact CD1-CB 4.47Å; L3320-R3324 PolarHBondContact O-N 2.79Å; R3324-S3326 VanDerWaalsContact C-N 3.33Å; R3324-S3326 PolarHBondContact O-N 3.06Å; R3324-N3327 PolarHBondContact O-N 3.12Å; R3324-I3328 PolarHBondContact O-N 2.99Å; R3324-V3334 HydrophobicContact CB-CB 4.24Å; R3324-V3334 HydrophobicContact CB-CG2 4.07Å; R3324-V3334 WeakPolarHBondContact CD-O 3.47Å; R3324-V3334 HydrophobicContact CG-CB 4.31Å; R3324-V3334 WeakPolarHBondContact CG-O 3.08Å; R3324-V3334 PolarHBondContact NH1-O 2.9Å; R3324-V3334 VanDerWaalsContact O-CG2 3.28Å; R3324-V3334 WeakPolarHBondContact O-CG2 3.39Å; R3324-D3336 PolarHBondContact NH1-O 2.92Å; R3324-I3343 HydrophobicContact CG-CG1 4.08Å; R3324-E3344 IonicContact CZ-OE1 3.38Å; R3324-E3344 IonicContact NH2-OE1 2.99Å; R3324-E3344 PolarHBondContact NH2-OE1 3.04Å
3325	L	82.6	Confident	85	Confident	21 Å²	21	13 Å²	13	11%	0.11	7%	0.072	C	C	.	.	H	α-helix	trans	-56.8	-43	179.4	-79.8	-173.4	0	0	0	113	F2686 L2697 L3320 I3321 N3327 I3328 L3335 M3409 L3469	F2686-L3325 HydrophobicContact CD1-CD2 4.33Å; F2686-L3325 HydrophobicContact CE1-CD2 3.5Å; F2686-L3325 VanDerWaalsContact CE1-CD2 3.47Å; F2686-L3325 HydrophobicContact CZ-CD2 3.75Å; L2697-L3325 HydrophobicContact CD2-CD1 4.24Å; L3320-L3325 WeakPolarHBondContact O-CG 3.34Å; L3320-L3325 PolarHBondContact O-N 2.97Å; I3321-L3325 HydrophobicContact CD1-CD1 3.52Å; I3321-L3325 HydrophobicContact CD1-CG 4.25Å; I3321-L3325 HydrophobicContact CG2-CD1 4.34Å; L3325-N3327 PolarHBondContact O-N 3.3Å; L3325-I3328 HydrophobicContact CD2-CD1 3.69Å; L3325-I3328 WeakPolarHBondContact O-CG1 3.37Å; L3325-I3328 PolarHBondContact O-N 3.19Å; L3325-L3335 HydrophobicContact CD2-CD2 4.46Å; L3325-M3409 HydrophobicContact CD1-CE 3.93Å; L3325-L3469 HydrophobicContact CD1-CD1 4.14Å
3326	S	76.2	Confident	84.8	Confident	46 Å²	46	13.5 Å²	13.5	32%	0.322	7%	0.074	S	C	.	.	H	α-helix	trans	-68.4	-20.1	178.8	57.4	0	0	0	0	113.1	T3323 R3324 S3458	T3323-S3326 PolarHBondContact O-OG 3.08Å; R3324-S3326 VanDerWaalsContact C-N 3.33Å; R3324-S3326 PolarHBondContact O-N 3.06Å; S3326-S3458 WeakPolarHBondContact OG-CB 3.34Å
3327	N	82.9	Confident	84.9	Confident	21 Å²	21	13.4 Å²	13.4	11%	0.112	7%	0.074	C	C	.	.	H	α-helix	trans	-97.4	-0.2	-179.2	-76.9	-68.3	0	0	0	114.5	T3323 R3324 L3325 K3329 R3330 D3331 V3334 L3342 I3343	T3323-N3327 PolarHBondContact O-ND2 3.42Å; R3324-N3327 PolarHBondContact O-N 3.12Å; L3325-N3327 PolarHBondContact O-N 3.3Å; N3327-K3329 VanDerWaalsContact C-N 3.27Å; N3327-K3329 PolarHBondContact O-N 2.91Å; N3327-R3330 WeakPolarHBondContact O-CB 3.4Å; N3327-R3330 PolarHBondContact O-N 3.29Å; N3327-D3331 PolarHBondContact O-N 3.09Å; N3327-V3334 HydrophobicContact CB-CG1 4.37Å; N3327-V3334 HydrophobicContact CB-CG2 4.35Å; N3327-L3342 HydrophobicContact CB-CD2 4.01Å; N3327-I3343 HydrophobicContact CB-CD1 4.48Å
3328	I	84.9	Confident	85.1	Confident	2 Å²	2	12.8 Å²	12.8	1%	0.01	7%	0.072	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-40.5	-179.4	-66	171.7	0	0	0	112.1	L2645 L2673 V2676 F2686 R3324 L3325 R3330 D3331 P3332 V3334 L3335 L3467	L2645-I3328 HydrophobicContact CD2-CG2 4.44Å; L2673-I3328 HydrophobicContact CD2-CD1 3.97Å; L2673-I3328 HydrophobicContact CD2-CG2 4.41Å; V2676-I3328 HydrophobicContact CG2-CG2 4.36Å; F2686-I3328 HydrophobicContact CE2-CD1 4.45Å; F2686-I3328 HydrophobicContact CZ-CD1 4.2Å; R3324-I3328 PolarHBondContact O-N 2.99Å; L3325-I3328 HydrophobicContact CD2-CD1 3.69Å; L3325-I3328 WeakPolarHBondContact O-CG1 3.37Å; L3325-I3328 PolarHBondContact O-N 3.19Å; I3328-R3330 PolarHBondContact O-N 3.19Å; I3328-D3331 CarbonylContact O-C 3.49Å; I3328-P3332 HydrophobicContact CG2-CB 4.4Å; I3328-P3332 VanDerWaalsContact O-CD 3.27Å; I3328-P3332 WeakPolarHBondContact O-CD 3.45Å; I3328-P3332 VanDerWaalsContact O-CG 3.3Å; I3328-P3332 WeakPolarHBondContact O-CG 3.29Å; I3328-P3332 VanDerWaalsContact O-N 3.17Å; I3328-V3334 HydrophobicContact CG1-CG2 4.44Å; I3328-L3335 HydrophobicContact CD1-CD1 4.11Å; I3328-L3335 HydrophobicContact CD1-CD2 3.93Å; I3328-L3335 HydrophobicContact CD1-CG 4.24Å; I3328-L3335 HydrophobicContact CG1-CD1 4.3Å; I3328-L3335 HydrophobicContact CG1-CD2 4.07Å; I3328-L3335 HydrophobicContact CG1-CG 4.09Å; I3328-L3467 HydrophobicContact CG2-CD2 4.37Å
3329	K	76.5	Confident	85.5	Confident	29 Å²	29	13.1 Å²	13.1	13%	0.126	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-33.5	178.3	-71.9	-174.4	-169.4	-168.8	0	112.2	F2621 N3327 M3465 S3466 L3467	F2621-K3329 VanDerWaalsContact CE1-O 3.26Å; F2621-K3329 WeakPolarHBondContact CE1-O 3.43Å; N3327-K3329 VanDerWaalsContact C-N 3.27Å; N3327-K3329 PolarHBondContact O-N 2.91Å; K3329-M3465 WeakPolarHBondContact CE-O 3.47Å; K3329-M3465 PolarHBondContact NZ-O 3.22Å; K3329-S3466 PolarHBondContact NZ-O 3.16Å; K3329-L3467 HydrophobicContact CD-CB 4.41Å; K3329-L3467 HydrophobicContact CD-CD1 3.93Å; K3329-L3467 HydrophobicContact CG-CB 4.22Å; K3329-L3467 HydrophobicContact CG-CD1 3.65Å; K3329-L3467 HydrophobicContact CG-CG 4.43Å
3330	R	78	Confident	85.8	Confident	22.5 Å²	22.5	15.1 Å²	15.1	9%	0.085	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-44.2	-177.8	174.2	166.8	175.1	-144.4	-7.5	111.4	L2619 N3327 I3328 L3342 E3346 R3360 F3454	L2619-R3330 VanDerWaalsContact CD2-O 3.31Å; L2619-R3330 WeakPolarHBondContact CD2-O 3.27Å; N3327-R3330 WeakPolarHBondContact O-CB 3.4Å; N3327-R3330 PolarHBondContact O-N 3.29Å; I3328-R3330 PolarHBondContact O-N 3.19Å; R3330-L3342 VanDerWaalsContact NH2-CD1 3.25Å; R3330-E3346 IonicContact CZ-OE1 3.41Å; R3330-E3346 IonicContact NH1-OE1 2.78Å; R3330-E3346 PolarHBondContact NH1-OE1 2.83Å; R3330-E3346 IonicContact NH1-OE2 3.82Å; R3330-E3346 PolarHBondContact NH1-OE2 3.21Å; R3330-E3346 IonicContact NH2-OE1 3.79Å; R3330-E3346 PolarHBondContact NH2-OE1 2.93Å; R3330-R3360 VanDerWaalsContact NH1-NH1 3.12Å; R3330-F3454 HydrophobicContact CB-CD2 4.29Å; R3330-F3454 HydrophobicContact CB-CE2 4.32Å; R3330-F3454 HydrophobicContact CG-CD2 4.12Å; R3330-F3454 HydrophobicContact CG-CE2 3.7Å
3331	D	86.3	Confident	85.8	Confident	17.5 Å²	17.5	15.8 Å²	15.8	9%	0.094	9%	0.086	C	C	.	.			trans	-152.7	100.1	179.2	-179.6	2.5	0	0	0	109.4	N3327 I3328 S3333 V3334 L3342	N3327-D3331 PolarHBondContact O-N 3.09Å; I3328-D3331 CarbonylContact O-C 3.49Å; D3331-S3333 PolarHBondContact O-N 3.32Å; D3331-S3333 VanDerWaalsContact O-N 3.09Å; D3331-S3333 WeakPolarHBondContact OD1-CA 3.25Å; D3331-S3333 WeakPolarHBondContact OD1-CB 3.32Å; D3331-S3333 PolarHBondContact OD1-N 3.16Å; D3331-S3333 PolarHBondContact OD1-OG 2.9Å; D3331-S3333 PolarHBondContact OD2-OG 3.22Å; D3331-V3334 HydrophobicContact CB-CG1 4.21Å; D3331-V3334 VanDerWaalsContact O-CG1 3.32Å; D3331-V3334 WeakPolarHBondContact O-CG1 3.2Å; D3331-V3334 WeakPolarHBondContact O-CG2 3.42Å; D3331-V3334 PolarHBondContact O-N 3.09Å; D3331-V3334 VanDerWaalsContact O-N 3.16Å; D3331-L3342 HydrophobicContact CB-CD2 4.31Å
3332	P	91.4	Very high	86.1	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.086	C	C	.	.	G	3₁₀ helix	trans	-62.9	-15.6	177.5	-20.9	30.8	0	0	0	113.7	V2635 Y2643 L2645 V2676 I3328 V3334 L3335	V2635-P3332 HydrophobicContact CB-CG 3.87Å; V2635-P3332 HydrophobicContact CG1-CG 4.08Å; V2635-P3332 HydrophobicContact CG2-CG 4.22Å; Y2643-P3332 HydrophobicContact CD1-CB 3.75Å; Y2643-P3332 HydrophobicContact CD2-CB 4.25Å; Y2643-P3332 HydrophobicContact CD2-CG 4.33Å; Y2643-P3332 HydrophobicContact CE1-CB 4.37Å; Y2643-P3332 HydrophobicContact CG-CB 3.69Å; Y2643-P3332 HydrophobicContact CG-CG 4.02Å; L2645-P3332 HydrophobicContact CD1-CG 4.29Å; V2676-P3332 HydrophobicContact CG1-CB 4.17Å; I3328-P3332 HydrophobicContact CG2-CB 4.4Å; I3328-P3332 VanDerWaalsContact O-CD 3.27Å; I3328-P3332 WeakPolarHBondContact O-CD 3.45Å; I3328-P3332 VanDerWaalsContact O-CG 3.3Å; I3328-P3332 WeakPolarHBondContact O-CG 3.29Å; I3328-P3332 VanDerWaalsContact O-N 3.17Å; P3332-V3334 PolarHBondContact O-N 3.13Å; P3332-L3335 PolarHBondContact O-N 3.17Å
3333	S	91.2	Very high	86.8	Confident	7 Å²	7	15.5 Å²	15.5	5%	0.049	8%	0.083	C	C	.	.	G	3₁₀ helix	trans	-67.2	-16.4	177.3	85.3	0	0	0	0	112.7	Y2643 D3331 L3335 D3336	Y2643-S3333 VanDerWaalsContact OH-CB 3.27Å; Y2643-S3333 WeakPolarHBondContact OH-CB 3.34Å; D3331-S3333 PolarHBondContact O-N 3.32Å; D3331-S3333 VanDerWaalsContact O-N 3.09Å; D3331-S3333 WeakPolarHBondContact OD1-CA 3.25Å; D3331-S3333 WeakPolarHBondContact OD1-CB 3.32Å; D3331-S3333 PolarHBondContact OD1-N 3.16Å; D3331-S3333 PolarHBondContact OD1-OG 2.9Å; D3331-S3333 PolarHBondContact OD2-OG 3.22Å; S3333-L3335 PolarHBondContact O-N 3.22Å; S3333-L3335 VanDerWaalsContact O-N 3.11Å; S3333-D3336 VanDerWaalsContact O-CB 3.27Å; S3333-D3336 WeakPolarHBondContact O-CB 3.44Å; S3333-D3336 PolarHBondContact O-N 3.23Å
3334	V	90.7	Very high	87.3	Confident	5.5 Å²	5.5	15.7 Å²	15.7	3%	0.033	8%	0.083	C	C	.	.	G	3₁₀ helix	trans	-59.1	-20.6	173.1	-61.3	0	0	0	0	113.5	R3324 N3327 I3328 D3331 P3332 D3336 L3342 I3343	R3324-V3334 HydrophobicContact CB-CB 4.24Å; R3324-V3334 HydrophobicContact CB-CG2 4.07Å; R3324-V3334 WeakPolarHBondContact CD-O 3.47Å; R3324-V3334 HydrophobicContact CG-CB 4.31Å; R3324-V3334 WeakPolarHBondContact CG-O 3.08Å; R3324-V3334 PolarHBondContact NH1-O 2.9Å; R3324-V3334 VanDerWaalsContact O-CG2 3.28Å; R3324-V3334 WeakPolarHBondContact O-CG2 3.39Å; N3327-V3334 HydrophobicContact CB-CG1 4.37Å; N3327-V3334 HydrophobicContact CB-CG2 4.35Å; I3328-V3334 HydrophobicContact CG1-CG2 4.44Å; D3331-V3334 HydrophobicContact CB-CG1 4.21Å; D3331-V3334 VanDerWaalsContact O-CG1 3.32Å; D3331-V3334 WeakPolarHBondContact O-CG1 3.2Å; D3331-V3334 WeakPolarHBondContact O-CG2 3.42Å; D3331-V3334 PolarHBondContact O-N 3.09Å; D3331-V3334 VanDerWaalsContact O-N 3.16Å; P3332-V3334 PolarHBondContact O-N 3.13Å; V3334-D3336 PolarHBondContact O-N 3.09Å; V3334-L3342 HydrophobicContact CG1-CB 3.92Å; V3334-L3342 HydrophobicContact CG1-CD2 3.68Å; V3334-L3342 HydrophobicContact CG1-CG 4.45Å; V3334-I3343 HydrophobicContact CG1-CD1 4.48Å; V3334-I3343 HydrophobicContact CG1-CG1 4.29Å
3335	L	92.8	Very high	87.4	Confident	1 Å²	1	17.1 Å²	17.1	1%	0.005	9%	0.089	C	C	.	.	G	3₁₀ helix	trans	-69.6	-9.7	173.3	-67.8	-179.5	0	0	0	113	V2676 R2684 F2686 L3320 L3325 I3328 P3332 S3333 T3337	V2676-L3335 HydrophobicContact CB-CD1 3.97Å; V2676-L3335 HydrophobicContact CG2-CD1 3.67Å; R2684-L3335 VanDerWaalsContact CZ-C 3.44Å; R2684-L3335 VanDerWaalsContact CZ-O 3.26Å; R2684-L3335 PolarHBondContact NE-O 2.85Å; R2684-L3335 VanDerWaalsContact NH1-CB 3.26Å; R2684-L3335 PolarHBondContact NH1-O 2.97Å; F2686-L3335 HydrophobicContact CE2-CD1 4.35Å; F2686-L3335 HydrophobicContact CZ-CD1 4Å; F2686-L3335 HydrophobicContact CZ-CD2 3.95Å; L3320-L3335 HydrophobicContact CD1-CD2 3.85Å; L3325-L3335 HydrophobicContact CD2-CD2 4.46Å; I3328-L3335 HydrophobicContact CD1-CD1 4.11Å; I3328-L3335 HydrophobicContact CD1-CD2 3.93Å; I3328-L3335 HydrophobicContact CD1-CG 4.24Å; I3328-L3335 HydrophobicContact CG1-CD1 4.3Å; I3328-L3335 HydrophobicContact CG1-CD2 4.07Å; I3328-L3335 HydrophobicContact CG1-CG 4.09Å; P3332-L3335 PolarHBondContact O-N 3.17Å; S3333-L3335 PolarHBondContact O-N 3.22Å; S3333-L3335 VanDerWaalsContact O-N 3.11Å; L3335-T3337 PolarHBondContact O-N 2.76Å
3336	D	92.9	Very high	87.6	Confident	9 Å²	9	18 Å²	18	5%	0.048	9%	0.093	C	C	.	.			trans	-80.5	97.1	169.1	-172	-8.7	0	0	0	109.2	R2684 R2994 R3324 S3333 V3334 H3338 K3339	R2684-D3336 VanDerWaalsContact NH2-CA 3.29Å; R2994-D3336 IonicContact CZ-OD1 2.91Å; R2994-D3336 IonicContact CZ-OD2 3.16Å; R2994-D3336 IonicContact NE-OD2 3.34Å; R2994-D3336 PolarHBondContact NE-OD2 2.94Å; R2994-D3336 IonicContact NH2-OD1 3.87Å; R2994-D3336 PolarHBondContact NH2-OD1 2.99Å; R2994-D3336 IonicContact NH2-OD2 2.95Å; R2994-D3336 PolarHBondContact NH2-OD2 3.21Å; R3324-D3336 PolarHBondContact NH1-O 2.92Å; S3333-D3336 VanDerWaalsContact O-CB 3.27Å; S3333-D3336 WeakPolarHBondContact O-CB 3.44Å; S3333-D3336 PolarHBondContact O-N 3.23Å; V3334-D3336 PolarHBondContact O-N 3.09Å; D3336-H3338 PolarHBondContact O-N 3.28Å; D3336-H3338 PolarHBondContact OD1-N 2.93Å; D3336-H3338 VanDerWaalsContact OD1-N 3.16Å; D3336-K3339 HydrophobicContact CB-CB 3.93Å; D3336-K3339 HydrophobicContact CB-CD 4.45Å; D3336-K3339 VanDerWaalsContact CG-CB 3.47Å; D3336-K3339 PolarHBondContact O-N 2.79Å; D3336-K3339 WeakPolarHBondContact OD2-CB 3.45Å
3337	T	93.4	Very high	87.9	Confident	5.5 Å²	5.5	18.6 Å²	18.6	3%	0.034	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-7.5	-173.9	52.7	0	0	0	0	114.2	W2709 R3303 D3316 L3320 L3335	W2709-T3337 HydrophobicContact CH2-CG2 3.78Å; W2709-T3337 HydrophobicContact CZ3-CG2 4.09Å; R3303-T3337 PolarHBondContact NH1-O 2.69Å; D3316-T3337 HydrophobicContact CB-CG2 4.32Å; L3320-T3337 HydrophobicContact CD1-CG2 4.44Å; L3335-T3337 PolarHBondContact O-N 2.76Å
3338	H	94.6	Very high	88.1	Confident	4 Å²	4	19.6 Å²	19.6	2%	0.019	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.5	-9.6	179	-69.4	74.7	0	0	0	113.5	L3033 G3048 T3311 F3312 D3336	L3033-H3338 HydrophobicContact CD2-CB 4.37Å; G3048-H3338 PolarHBondContact O-NE2 3.13Å; T3311-H3338 PolarHBondContact OG1-O 3.36Å; F3312-H3338 PolarHBondContact N-O 3.2Å; F3312-H3338 PolarHBondContact O-CD2 3.17Å; F3312-H3338 VanDerWaalsContact O-CD2 3.24Å; D3336-H3338 PolarHBondContact O-N 3.28Å; D3336-H3338 PolarHBondContact OD1-N 2.93Å; D3336-H3338 VanDerWaalsContact OD1-N 3.16Å
3339	K	91.4	Very high	88	Confident	31 Å²	31	21.4 Å²	21.4	14%	0.135	13%	0.125	C	C	.	.	S	Bend	trans	-92.3	134.1	-176.7	-176.8	178.3	178.6	-172.3	0	110.8	S2640 E2992 G2993 D3336	S2640-K3339 PolarHBondContact OG-NZ 3.15Å; E2992-K3339 PolarHBondContact O-NZ 3.09Å; G2993-K3339 WeakPolarHBondContact O-CE 3.37Å; D3336-K3339 HydrophobicContact CB-CB 3.93Å; D3336-K3339 HydrophobicContact CB-CD 4.45Å; D3336-K3339 VanDerWaalsContact CG-CB 3.47Å; D3336-K3339 PolarHBondContact O-N 2.79Å; D3336-K3339 WeakPolarHBondContact OD2-CB 3.45Å
3340	W	89.6	Confident	88.3	Confident	45 Å²	45	20.5 Å²	20.5	17%	0.17	12%	0.122	C	C	.	.			trans	-73	120.1	164	-177.2	-82.1	0	0	0	109.6	C3298 Y3305 F3312 E3344 L3348	C3298-W3340 HydrophobicContact CB-CH2 4.33Å; C3298-W3340 HydrophobicContact CB-CZ3 4.19Å; Y3305-W3340 HydrophobicContact CD2-CE3 4.28Å; Y3305-W3340 HydrophobicContact CE2-CB 4.08Å; Y3305-W3340 HydrophobicContact CE2-CE3 4.46Å; Y3305-W3340 HydrophobicContact CG-CE3 4.49Å; F3312-W3340 HydrophobicContact CE2-CB 4.35Å; F3312-W3340 AromaticContact CE2-CE3 3.93Å; F3312-W3340 HydrophobicContact CE2-CE3 3.93Å; F3312-W3340 AromaticContact CZ-CE3 3.61Å; F3312-W3340 HydrophobicContact CZ-CE3 3.61Å; F3312-W3340 AromaticContact CZ-CZ3 3.99Å; F3312-W3340 HydrophobicContact CZ-CZ3 4.01Å; W3340-E3344 HydrophobicContact CD2-CB 3.76Å; W3340-E3344 HydrophobicContact CD2-CG 4.15Å; W3340-E3344 HydrophobicContact CE3-CB 3.9Å; W3340-E3344 HydrophobicContact CE3-CG 3.92Å; W3340-E3344 HydrophobicContact CG-CB 4.34Å; W3340-E3344 HydrophobicContact CH2-CB 4.24Å; W3340-E3344 HydrophobicContact CZ2-CB 4.08Å; W3340-E3344 HydrophobicContact CZ3-CB 4.13Å; W3340-E3344 HydrophobicContact CZ3-CG 4.29Å; W3340-L3348 HydrophobicContact CH2-CD1 3.29Å; W3340-L3348 HydrophobicContact CZ2-CD1 3.6Å; W3340-L3348 HydrophobicContact CZ3-CD1 4.4Å
3341	G	88.2	Confident	88.4	Confident	14.5 Å²	14.5	20.4 Å²	20.4	15%	0.149	13%	0.128	C	C	.	.			trans	-157	-139.5	-174	0	0	0	0	0	114.1	I3343 E3344 Q3345	G3341-I3343 VanDerWaalsContact C-N 3.33Å; G3341-I3343 PolarHBondContact O-N 2.96Å; G3341-E3344 PolarHBondContact N-OE2 2.98Å; G3341-E3344 PolarHBondContact O-N 3.1Å; G3341-Q3345 WeakPolarHBondContact O-CB 3.34Å; G3341-Q3345 WeakPolarHBondContact O-CG 3.44Å; G3341-Q3345 PolarHBondContact O-N 3.39Å; G3341-Q3345 VanDerWaalsContact O-N 3.08Å
3342	L	86.8	Confident	88	Confident	5 Å²	5	20.6 Å²	20.6	3%	0.026	13%	0.13	C	C	.	.	H	α-helix	trans	-49	-50.8	-176	-174.7	82.2	0	0	0	112.6	N3327 R3330 D3331 V3334 E3346 N3353	N3327-L3342 HydrophobicContact CB-CD2 4.01Å; R3330-L3342 VanDerWaalsContact NH2-CD1 3.25Å; D3331-L3342 HydrophobicContact CB-CD2 4.31Å; V3334-L3342 HydrophobicContact CG1-CB 3.92Å; V3334-L3342 HydrophobicContact CG1-CD2 3.68Å; V3334-L3342 HydrophobicContact CG1-CG 4.45Å; L3342-E3346 WeakPolarHBondContact O-CB 3.37Å; L3342-E3346 VanDerWaalsContact O-CG 3.29Å; L3342-E3346 WeakPolarHBondContact O-CG 3.35Å; L3342-E3346 PolarHBondContact O-N 3.36Å; L3342-N3353 HydrophobicContact CD1-CB 3.97Å; L3342-N3353 VanDerWaalsContact CD1-CG 3.49Å; L3342-N3353 VanDerWaalsContact CD1-OD1 3.29Å; L3342-N3353 WeakPolarHBondContact CD1-OD1 3.26Å
3343	I	87	Confident	87.6	Confident	25 Å²	25	22.4 Å²	22.4	13%	0.128	14%	0.14	C	C	.	.	H	α-helix	trans	-68.9	-45.9	-170.5	-59.3	-58.6	0	0	0	111.2	R3324 N3327 V3334 G3341 A3347	R3324-I3343 HydrophobicContact CG-CG1 4.08Å; N3327-I3343 HydrophobicContact CB-CD1 4.48Å; V3334-I3343 HydrophobicContact CG1-CD1 4.48Å; V3334-I3343 HydrophobicContact CG1-CG1 4.29Å; G3341-I3343 VanDerWaalsContact C-N 3.33Å; G3341-I3343 PolarHBondContact O-N 2.96Å; I3343-A3347 VanDerWaalsContact O-CB 3.28Å; I3343-A3347 WeakPolarHBondContact O-CB 3.3Å; I3343-A3347 PolarHBondContact O-N 3.24Å
3344	E	89.4	Confident	87.1	Confident	15 Å²	15	22.1 Å²	22.1	7%	0.07	14%	0.138	C	C	.	.	H	α-helix	trans	-66.9	-44	-179.5	-65.6	73.3	-160.6	0	0	111.5	R3303 F3312 R3324 W3340 G3341 A3347 L3348	R3303-E3344 IonicContact NH2-OE1 2.75Å; R3303-E3344 PolarHBondContact NH2-OE1 3.21Å; F3312-E3344 HydrophobicContact CE2-CG 3.71Å; F3312-E3344 HydrophobicContact CZ-CG 3.66Å; R3324-E3344 IonicContact CZ-OE1 3.38Å; R3324-E3344 IonicContact NH2-OE1 2.99Å; R3324-E3344 PolarHBondContact NH2-OE1 3.04Å; W3340-E3344 HydrophobicContact CD2-CB 3.76Å; W3340-E3344 HydrophobicContact CD2-CG 4.15Å; W3340-E3344 HydrophobicContact CE3-CB 3.9Å; W3340-E3344 HydrophobicContact CE3-CG 3.92Å; W3340-E3344 HydrophobicContact CG-CB 4.34Å; W3340-E3344 HydrophobicContact CH2-CB 4.24Å; W3340-E3344 HydrophobicContact CZ2-CB 4.08Å; W3340-E3344 HydrophobicContact CZ3-CB 4.13Å; W3340-E3344 HydrophobicContact CZ3-CG 4.29Å; G3341-E3344 PolarHBondContact N-OE2 2.98Å; G3341-E3344 PolarHBondContact O-N 3.1Å; E3344-A3347 PolarHBondContact O-N 2.93Å; E3344-L3348 WeakPolarHBondContact O-CB 3.32Å; E3344-L3348 WeakPolarHBondContact O-CG 3.46Å; E3344-L3348 PolarHBondContact O-N 2.86Å; E3344-L3348 VanDerWaalsContact O-N 3.08Å
3345	Q	88	Confident	86.4	Confident	32 Å²	32	23.8 Å²	23.8	15%	0.15	15%	0.147	C	C	.	.	H	α-helix	trans	-61.8	-44.5	176.4	-78.3	-177.5	30.8	0	0	112.3	G3341 L3348 G3349 T3350 N3353	G3341-Q3345 WeakPolarHBondContact O-CB 3.34Å; G3341-Q3345 WeakPolarHBondContact O-CG 3.44Å; G3341-Q3345 PolarHBondContact O-N 3.39Å; G3341-Q3345 VanDerWaalsContact O-N 3.08Å; Q3345-L3348 PolarHBondContact O-N 3.13Å; Q3345-G3349 CarbonylContact O-C 3.49Å; Q3345-G3349 WeakPolarHBondContact O-CA 3.08Å; Q3345-G3349 PolarHBondContact O-N 3.09Å; Q3345-T3350 VanDerWaalsContact CB-O 3.26Å; Q3345-T3350 WeakPolarHBondContact CB-O 3.26Å; Q3345-T3350 PolarHBondContact O-N 2.72Å; Q3345-N3353 HydrophobicContact CB-CB 3.91Å; Q3345-N3353 PolarHBondContact OE1-ND2 2.86Å
3346	E	86.5	Confident	85.9	Confident	41 Å²	41	24.2 Å²	24.2	19%	0.192	15%	0.148	C	C	.	.	H	α-helix	trans	-68.3	-37.2	177.6	-72.3	-166.2	162.7	0	0	112.9	R3330 L3342 L3348 G3349 N3353 A3357 R3360	R3330-E3346 IonicContact CZ-OE1 3.41Å; R3330-E3346 IonicContact NH1-OE1 2.78Å; R3330-E3346 PolarHBondContact NH1-OE1 2.83Å; R3330-E3346 IonicContact NH1-OE2 3.82Å; R3330-E3346 PolarHBondContact NH1-OE2 3.21Å; R3330-E3346 IonicContact NH2-OE1 3.79Å; R3330-E3346 PolarHBondContact NH2-OE1 2.93Å; L3342-E3346 WeakPolarHBondContact O-CB 3.37Å; L3342-E3346 VanDerWaalsContact O-CG 3.29Å; L3342-E3346 WeakPolarHBondContact O-CG 3.35Å; L3342-E3346 PolarHBondContact O-N 3.36Å; E3346-L3348 VanDerWaalsContact C-N 3.29Å; E3346-L3348 PolarHBondContact O-N 2.8Å; E3346-G3349 PolarHBondContact O-N 3.01Å; E3346-N3353 HydrophobicContact CG-CB 4.1Å; E3346-N3353 WeakPolarHBondContact CG-O 3.4Å; E3346-A3357 HydrophobicContact CG-CB 4.08Å; E3346-R3360 VanDerWaalsContact CD-NH2 3.29Å; E3346-R3360 IonicContact OE1-CZ 2.85Å; E3346-R3360 VanDerWaalsContact OE1-CZ 3.29Å; E3346-R3360 IonicContact OE1-NH1 3.39Å; E3346-R3360 PolarHBondContact OE1-NH1 2.8Å; E3346-R3360 IonicContact OE1-NH2 3.79Å; E3346-R3360 PolarHBondContact OE1-NH2 2.88Å; E3346-R3360 IonicContact OE2-NH2 3.26Å; E3346-R3360 PolarHBondContact OE2-NH2 3.09Å
3347	A	84	Confident	85.3	Confident	58.5 Å²	58.5	24.1 Å²	24.1	48%	0.483	15%	0.149	S	C	.	.	H	α-helix	trans	-65.7	-33.3	177.4	0	0	0	0	0	112.6	I3343 E3344	I3343-A3347 VanDerWaalsContact O-CB 3.28Å; I3343-A3347 WeakPolarHBondContact O-CB 3.3Å; I3343-A3347 PolarHBondContact O-N 3.24Å; E3344-A3347 PolarHBondContact O-N 2.93Å
3348	L	85.5	Confident	84.8	Confident	41.5 Å²	41.5	26.5 Å²	26.5	22%	0.217	16%	0.16	C	C	.	.	H	α-helix	trans	-93.8	-10.6	179.5	-65.9	168.9	0	0	0	113.4	A3285 C3298 P3299 W3340 E3344 Q3345 E3346 T3350	A3285-L3348 HydrophobicContact CB-CD1 4.02Å; C3298-L3348 HydrophobicContact CB-CD1 4.44Å; P3299-L3348 HydrophobicContact CG-CD2 3.81Å; W3340-L3348 HydrophobicContact CH2-CD1 3.29Å; W3340-L3348 HydrophobicContact CZ2-CD1 3.6Å; W3340-L3348 HydrophobicContact CZ3-CD1 4.4Å; E3344-L3348 WeakPolarHBondContact O-CB 3.32Å; E3344-L3348 WeakPolarHBondContact O-CG 3.46Å; E3344-L3348 PolarHBondContact O-N 2.86Å; E3344-L3348 VanDerWaalsContact O-N 3.08Å; Q3345-L3348 PolarHBondContact O-N 3.13Å; E3346-L3348 VanDerWaalsContact C-N 3.29Å; E3346-L3348 PolarHBondContact O-N 2.8Å; L3348-T3350 HydrophobicContact CB-CG2 3.96Å; L3348-T3350 PolarHBondContact O-N 3.05Å
3349	G	82.9	Confident	84.3	Confident	40 Å²	40	26.4 Å²	26.4	41%	0.412	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.4	25.3	-172.8	0	0	0	0	0	113.2	Q3345 E3346	Q3345-G3349 CarbonylContact O-C 3.49Å; Q3345-G3349 WeakPolarHBondContact O-CA 3.08Å; Q3345-G3349 PolarHBondContact O-N 3.09Å; E3346-G3349 PolarHBondContact O-N 3.01Å
3350	T	83	Confident	83.9	Confident	9 Å²	9	25.6 Å²	25.6	6%	0.055	16%	0.155	C	C	.	.			trans	-108	160.4	-175.9	59.7	0	0	0	0	112.2	E3234 A3285 Q3345 L3348 G3354	E3234-T3350 HydrophobicContact CB-CG2 4.03Å; E3234-T3350 HydrophobicContact CG-CG2 4.48Å; A3285-T3350 HydrophobicContact CB-CG2 4.21Å; Q3345-T3350 VanDerWaalsContact CB-O 3.26Å; Q3345-T3350 WeakPolarHBondContact CB-O 3.26Å; Q3345-T3350 PolarHBondContact O-N 2.72Å; L3348-T3350 HydrophobicContact CB-CG2 3.96Å; L3348-T3350 PolarHBondContact O-N 3.05Å; T3350-G3354 WeakPolarHBondContact O-CA 3.45Å; T3350-G3354 PolarHBondContact O-N 3.15Å; T3350-G3354 VanDerWaalsContact O-N 3.11Å
3351	G	80.7	Confident	83.5	Confident	20.5 Å²	20.5	28 Å²	28	21%	0.211	17%	0.167	C	C	.	.	H	α-helix	trans	64.4	-173.1	177.2	0	0	0	0	0	114.9	N3353 G3354 L3355	G3351-N3353 VanDerWaalsContact C-N 3.3Å; G3351-N3353 PolarHBondContact O-N 3.26Å; G3351-G3354 PolarHBondContact O-N 3.07Å; G3351-L3355 WeakPolarHBondContact O-CG 3.26Å; G3351-L3355 PolarHBondContact O-N 3Å
3352	P	77.5	Confident	83.4	Confident	22 Å²	22	27.3 Å²	27.3	14%	0.143	16%	0.16	C	C	.	.	H	α-helix	trans	-62.1	-35.9	-178.7	24.5	-34.7	0	0	0	113.1	Q2943 F3356	Q2943-P3352 HydrophobicContact CG-CB 4.42Å; P3352-F3356 WeakPolarHBondContact O-CB 3.41Å; P3352-F3356 PolarHBondContact O-N 3.15Å
3353	N	83	Confident	83.3	Confident	38.5 Å²	38.5	27.3 Å²	27.3	21%	0.206	16%	0.16	C	C	.	.	H	α-helix	trans	-74.2	-40.2	-177.6	-66.7	-50.2	0	0	0	112.2	L3342 Q3345 E3346 G3351 L3355 F3356 A3357	L3342-N3353 HydrophobicContact CD1-CB 3.97Å; L3342-N3353 VanDerWaalsContact CD1-CG 3.49Å; L3342-N3353 VanDerWaalsContact CD1-OD1 3.29Å; L3342-N3353 WeakPolarHBondContact CD1-OD1 3.26Å; Q3345-N3353 HydrophobicContact CB-CB 3.91Å; Q3345-N3353 PolarHBondContact OE1-ND2 2.86Å; E3346-N3353 HydrophobicContact CG-CB 4.1Å; E3346-N3353 WeakPolarHBondContact CG-O 3.4Å; G3351-N3353 VanDerWaalsContact C-N 3.3Å; G3351-N3353 PolarHBondContact O-N 3.26Å; N3353-L3355 VanDerWaalsContact C-N 3.33Å; N3353-L3355 PolarHBondContact O-N 2.78Å; N3353-F3356 PolarHBondContact O-N 3.06Å; N3353-A3357 PolarHBondContact O-N 3Å
3354	G	80.7	Confident	82.9	Confident	0.5 Å²	0.5	29 Å²	29	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-61.3	-42.7	174.1	0	0	0	0	0	112.3	T3350 G3351 A3357 E3358	T3350-G3354 WeakPolarHBondContact O-CA 3.45Å; T3350-G3354 PolarHBondContact O-N 3.15Å; T3350-G3354 VanDerWaalsContact O-N 3.11Å; G3351-G3354 PolarHBondContact O-N 3.07Å; G3354-A3357 WeakPolarHBondContact O-CB 3.17Å; G3354-A3357 PolarHBondContact O-N 3.08Å; G3354-A3357 VanDerWaalsContact O-N 3.15Å; G3354-E3358 PolarHBondContact O-N 2.92Å
3355	L	77	Confident	82.4	Confident	41.5 Å²	41.5	30 Å²	30	22%	0.217	18%	0.18	C	C	.	.	H	α-helix	trans	-68.9	-35.8	176.3	-68.1	169.6	0	0	0	112.6	R2914 L2942 G3351 N3353 A3357 E3358 L3359	R2914-L3355 HydrophobicContact CG-CD2 4.36Å; L2942-L3355 HydrophobicContact CB-CB 4.03Å; L2942-L3355 HydrophobicContact CB-CD1 3.7Å; L2942-L3355 HydrophobicContact CD1-CB 3.73Å; L2942-L3355 HydrophobicContact CD2-CB 4.25Å; L2942-L3355 HydrophobicContact CG-CB 4.22Å; L2942-L3355 WeakPolarHBondContact O-CD1 3.22Å; G3351-L3355 WeakPolarHBondContact O-CG 3.26Å; G3351-L3355 PolarHBondContact O-N 3Å; N3353-L3355 VanDerWaalsContact C-N 3.33Å; N3353-L3355 PolarHBondContact O-N 2.78Å; L3355-A3357 VanDerWaalsContact C-N 3.27Å; L3355-A3357 PolarHBondContact O-N 3.07Å; L3355-E3358 PolarHBondContact O-N 3.15Å; L3355-L3359 PolarHBondContact O-N 3.22Å; L3355-L3359 VanDerWaalsContact O-N 3.12Å
3356	F	81.5	Confident	82.4	Confident	8.5 Å²	8.5	29.3 Å²	29.3	4%	0.037	18%	0.178	C	C	.	.	H	α-helix	trans	-65.3	-30.7	171.9	-171.1	-103	0	0	0	112.1	Y2597 L2612 P3352 N3353 E3358 L3359 R3360 F3454 L3455	Y2597-F3356 HydrophobicContact CD1-CD2 4.23Å; Y2597-F3356 AromaticContact CD1-CE2 3.8Å; Y2597-F3356 HydrophobicContact CD1-CE2 3.8Å; Y2597-F3356 AromaticContact CE1-CD2 3.76Å; Y2597-F3356 HydrophobicContact CE1-CD2 3.76Å; Y2597-F3356 AromaticContact CE1-CE2 3.82Å; Y2597-F3356 HydrophobicContact CE1-CE2 3.82Å; L2612-F3356 HydrophobicContact CD2-CE2 3.98Å; L2612-F3356 HydrophobicContact CD2-CZ 4.09Å; P3352-F3356 WeakPolarHBondContact O-CB 3.41Å; P3352-F3356 PolarHBondContact O-N 3.15Å; N3353-F3356 PolarHBondContact O-N 3.06Å; F3356-E3358 VanDerWaalsContact C-N 3.35Å; F3356-L3359 HydrophobicContact CD2-CD2 4.08Å; F3356-L3359 HydrophobicContact CE2-CD2 4.07Å; F3356-L3359 WeakPolarHBondContact O-CB 3.35Å; F3356-L3359 PolarHBondContact O-N 3.16Å; F3356-R3360 HydrophobicContact CD1-CG 4.4Å; F3356-R3360 HydrophobicContact CE1-CG 4.25Å; F3356-R3360 WeakPolarHBondContact O-CG 3.13Å; F3356-R3360 PolarHBondContact O-N 2.8Å; F3356-R3360 VanDerWaalsContact O-N 3.11Å; F3356-F3454 HydrophobicContact CE1-CE1 4.34Å; F3356-F3454 HydrophobicContact CZ-CE1 4.05Å; F3356-L3455 HydrophobicContact CE1-CD2 4.18Å; F3356-L3455 HydrophobicContact CE2-CD2 4.46Å; F3356-L3455 HydrophobicContact CZ-CD2 3.53Å
3357	A	81.5	Confident	82.4	Confident	8.5 Å²	8.5	29 Å²	29	7%	0.07	18%	0.178	C	C	.	.	H	α-helix	trans	-65.9	-35.8	172.3	0	0	0	0	0	112.8	E3346 N3353 G3354 L3355 R3360 K3361	E3346-A3357 HydrophobicContact CG-CB 4.08Å; N3353-A3357 PolarHBondContact O-N 3Å; G3354-A3357 WeakPolarHBondContact O-CB 3.17Å; G3354-A3357 PolarHBondContact O-N 3.08Å; G3354-A3357 VanDerWaalsContact O-N 3.15Å; L3355-A3357 VanDerWaalsContact C-N 3.27Å; L3355-A3357 PolarHBondContact O-N 3.07Å; A3357-R3360 VanDerWaalsContact CA-CZ 3.49Å; A3357-R3360 VanDerWaalsContact CA-NH1 3.35Å; A3357-R3360 PolarHBondContact O-N 3.33Å; A3357-K3361 WeakPolarHBondContact O-CG 3.3Å; A3357-K3361 PolarHBondContact O-N 2.83Å; A3357-K3361 VanDerWaalsContact O-N 3.12Å
3358	E	82.2	Confident	82.6	Confident	55 Å²	55	27.2 Å²	27.2	26%	0.257	16%	0.158	S	C	.	.	H	α-helix	trans	-65.4	-39.2	172.1	-68.2	-56.4	125.2	0	0	112.2	G3354 L3355 F3356 R3360 K3361 A3362 W3368	G3354-E3358 PolarHBondContact O-N 2.92Å; L3355-E3358 PolarHBondContact O-N 3.15Å; F3356-E3358 VanDerWaalsContact C-N 3.35Å; E3358-R3360 VanDerWaalsContact C-N 3.33Å; E3358-R3360 PolarHBondContact O-N 3.04Å; E3358-K3361 WeakPolarHBondContact O-CB 3.24Å; E3358-K3361 PolarHBondContact O-N 3Å; E3358-K3361 VanDerWaalsContact O-N 3.17Å; E3358-K3361 IonicContact OE1-NZ 3.24Å; E3358-K3361 PolarHBondContact OE1-NZ 2.8Å; E3358-A3362 PolarHBondContact O-N 2.93Å; E3358-W3368 PolarHBondContact OE2-NE1 3.34Å
3359	L	84.6	Confident	82.8	Confident	1.5 Å²	1.5	25.2 Å²	25.2	1%	0.008	15%	0.148	C	C	.	.	H	α-helix	trans	-59.4	-41.8	172.4	175	62.3	0	0	0	112	L2577 V2590 W2592 Y2597 L3355 F3356 K3361 A3362 M3363	L2577-L3359 HydrophobicContact CD1-CD1 3.7Å; V2590-L3359 HydrophobicContact CG1-CD1 4.05Å; V2590-L3359 HydrophobicContact CG1-CD2 4.4Å; W2592-L3359 HydrophobicContact CB-CD1 4.21Å; W2592-L3359 HydrophobicContact CD2-CD1 4.04Å; W2592-L3359 HydrophobicContact CE3-CB 4.1Å; W2592-L3359 HydrophobicContact CE3-CD1 3.66Å; W2592-L3359 HydrophobicContact CE3-CG 4.37Å; W2592-L3359 HydrophobicContact CG-CD1 4.3Å; W2592-L3359 HydrophobicContact CZ3-CB 4.03Å; W2592-L3359 HydrophobicContact CZ3-CD1 4.35Å; Y2597-L3359 HydrophobicContact CD1-CD2 4.25Å; Y2597-L3359 HydrophobicContact CD2-CD2 3.82Å; Y2597-L3359 HydrophobicContact CE1-CD2 3.93Å; Y2597-L3359 HydrophobicContact CE2-CD2 3.43Å; Y2597-L3359 VanDerWaalsContact CE2-CD2 3.43Å; Y2597-L3359 HydrophobicContact CG-CD2 4.25Å; L3355-L3359 PolarHBondContact O-N 3.22Å; L3355-L3359 VanDerWaalsContact O-N 3.12Å; F3356-L3359 HydrophobicContact CD2-CD2 4.08Å; F3356-L3359 HydrophobicContact CE2-CD2 4.07Å; F3356-L3359 WeakPolarHBondContact O-CB 3.35Å; F3356-L3359 PolarHBondContact O-N 3.16Å; L3359-K3361 VanDerWaalsContact C-N 3.33Å; L3359-K3361 PolarHBondContact O-N 3.05Å; L3359-A3362 WeakPolarHBondContact O-CB 3.21Å; L3359-A3362 PolarHBondContact O-N 3.3Å; L3359-A3362 VanDerWaalsContact O-N 3.17Å; L3359-M3363 HydrophobicContact CD1-CG 4.26Å; L3359-M3363 HydrophobicContact CD1-SD 4.47Å; L3359-M3363 HydrophobicContact CG-CE 4.07Å; L3359-M3363 HydrophobicContact CG-SD 4.45Å; L3359-M3363 WeakPolarHBondContact O-CG 3.43Å; L3359-M3363 PolarHBondContact O-N 2.87Å
3360	R	82.2	Confident	83.1	Confident	15 Å²	15	23.3 Å²	23.3	6%	0.057	13%	0.128	C	C	.	.	H	α-helix	trans	-60.5	-41.9	175.5	-65.8	-169	-50.8	-93.4	16	112.2	R3330 E3346 F3356 A3357 E3358 A3362 M3363 T3364 L3455	R3330-R3360 VanDerWaalsContact NH1-NH1 3.12Å; E3346-R3360 VanDerWaalsContact CD-NH2 3.29Å; E3346-R3360 IonicContact OE1-CZ 2.85Å; E3346-R3360 VanDerWaalsContact OE1-CZ 3.29Å; E3346-R3360 IonicContact OE1-NH1 3.39Å; E3346-R3360 PolarHBondContact OE1-NH1 2.8Å; E3346-R3360 IonicContact OE1-NH2 3.79Å; E3346-R3360 PolarHBondContact OE1-NH2 2.88Å; E3346-R3360 IonicContact OE2-NH2 3.26Å; E3346-R3360 PolarHBondContact OE2-NH2 3.09Å; F3356-R3360 HydrophobicContact CD1-CG 4.4Å; F3356-R3360 HydrophobicContact CE1-CG 4.25Å; F3356-R3360 WeakPolarHBondContact O-CG 3.13Å; F3356-R3360 PolarHBondContact O-N 2.8Å; F3356-R3360 VanDerWaalsContact O-N 3.11Å; A3357-R3360 VanDerWaalsContact CA-CZ 3.49Å; A3357-R3360 VanDerWaalsContact CA-NH1 3.35Å; A3357-R3360 PolarHBondContact O-N 3.33Å; E3358-R3360 VanDerWaalsContact C-N 3.33Å; E3358-R3360 PolarHBondContact O-N 3.04Å; R3360-A3362 VanDerWaalsContact C-N 3.34Å; R3360-A3362 PolarHBondContact O-N 2.86Å; R3360-M3363 HydrophobicContact CB-CE 4.43Å; R3360-M3363 HydrophobicContact CG-CE 4.16Å; R3360-M3363 PolarHBondContact O-N 3.1Å; R3360-T3364 WeakPolarHBondContact O-CG2 3.34Å; R3360-T3364 PolarHBondContact O-N 2.75Å; R3360-T3364 PolarHBondContact O-OG1 3.15Å; R3360-L3455 WeakPolarHBondContact CD-O 3.32Å
3361	K	82.2	Confident	83.3	Confident	95.5 Å²	95.5	27.1 Å²	27.1	42%	0.415	14%	0.144	S	C	.	.	H	α-helix	trans	-63.8	-40.6	174.6	-66	173.2	-170.5	166.7	0	111.4	A3357 E3358 L3359 M3363 T3364 S3365 W3368	A3357-K3361 WeakPolarHBondContact O-CG 3.3Å; A3357-K3361 PolarHBondContact O-N 2.83Å; A3357-K3361 VanDerWaalsContact O-N 3.12Å; E3358-K3361 WeakPolarHBondContact O-CB 3.24Å; E3358-K3361 PolarHBondContact O-N 3Å; E3358-K3361 VanDerWaalsContact O-N 3.17Å; E3358-K3361 IonicContact OE1-NZ 3.24Å; E3358-K3361 PolarHBondContact OE1-NZ 2.8Å; L3359-K3361 VanDerWaalsContact C-N 3.33Å; L3359-K3361 PolarHBondContact O-N 3.05Å; K3361-M3363 VanDerWaalsContact C-N 3.35Å; K3361-M3363 PolarHBondContact O-N 2.82Å; K3361-T3364 PolarHBondContact O-N 3.01Å; K3361-T3364 PolarHBondContact O-OG1 3.27Å; K3361-S3365 WeakPolarHBondContact O-CB 3.19Å; K3361-S3365 PolarHBondContact O-N 2.98Å; K3361-W3368 HydrophobicContact CB-CB 4.43Å; K3361-W3368 HydrophobicContact CB-CG 4.08Å
3362	A	85.8	Confident	83.4	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-64.5	-36.4	177.4	0	0	0	0	0	113.1	L2577 E3358 L3359 R3360 W3368 W3369	L2577-A3362 HydrophobicContact CD2-CB 4.23Å; E3358-A3362 PolarHBondContact O-N 2.93Å; L3359-A3362 WeakPolarHBondContact O-CB 3.21Å; L3359-A3362 PolarHBondContact O-N 3.3Å; L3359-A3362 VanDerWaalsContact O-N 3.17Å; R3360-A3362 VanDerWaalsContact C-N 3.34Å; R3360-A3362 PolarHBondContact O-N 2.86Å; A3362-W3368 HydrophobicContact CB-CD2 3.84Å; A3362-W3368 HydrophobicContact CB-CE3 3.48Å; A3362-W3368 VanDerWaalsContact CB-CE3 3.43Å; A3362-W3368 HydrophobicContact CB-CH2 3.98Å; A3362-W3368 HydrophobicContact CB-CZ2 4.25Å; A3362-W3368 HydrophobicContact CB-CZ3 3.56Å; A3362-W3369 HydrophobicContact CB-CZ2 4.16Å; A3362-W3369 PolarHBondContact O-NE1 3.21Å
3363	M	84.4	Confident	83.7	Confident	3.5 Å²	3.5	26.4 Å²	26.4	2%	0.017	13%	0.133	C	C	.	.	H	α-helix	trans	-72	-29.7	177.5	-71.7	-175	-64.6	0	0	113.5	F2548 L2577 L2579 L2587 V2590 L3359 R3360 K3361 L3455	F2548-M3363 WeakPolarHBondContact CZ-O 3.41Å; L2577-M3363 HydrophobicContact CD2-CG 3.88Å; L2579-M3363 HydrophobicContact CD2-CG 4.06Å; L2579-M3363 HydrophobicContact CD2-SD 4.04Å; L2587-M3363 HydrophobicContact CD2-SD 4.47Å; V2590-M3363 HydrophobicContact CG1-SD 4.17Å; V2590-M3363 HydrophobicContact CG2-SD 3.88Å; L3359-M3363 HydrophobicContact CD1-CG 4.26Å; L3359-M3363 HydrophobicContact CD1-SD 4.47Å; L3359-M3363 HydrophobicContact CG-CE 4.07Å; L3359-M3363 HydrophobicContact CG-SD 4.45Å; L3359-M3363 WeakPolarHBondContact O-CG 3.43Å; L3359-M3363 PolarHBondContact O-N 2.87Å; R3360-M3363 HydrophobicContact CB-CE 4.43Å; R3360-M3363 HydrophobicContact CG-CE 4.16Å; R3360-M3363 PolarHBondContact O-N 3.1Å; K3361-M3363 VanDerWaalsContact C-N 3.35Å; K3361-M3363 PolarHBondContact O-N 2.82Å; M3363-L3455 HydrophobicContact CE-CD1 4.26Å; M3363-L3455 HydrophobicContact CE-CD2 4.19Å
3364	T	77.4	Confident	83.6	Confident	61.5 Å²	61.5	24.8 Å²	24.8	38%	0.377	13%	0.125	S	C	.	.	H	α-helix	trans	-105.3	-24	-169.6	55.1	0	0	0	0	114	R3360 K3361 L3451 L3456	R3360-T3364 WeakPolarHBondContact O-CG2 3.34Å; R3360-T3364 PolarHBondContact O-N 2.75Å; R3360-T3364 PolarHBondContact O-OG1 3.15Å; K3361-T3364 PolarHBondContact O-N 3.01Å; K3361-T3364 PolarHBondContact O-OG1 3.27Å; T3364-L3451 HydrophobicContact CG2-CD1 3.67Å; T3364-L3456 HydrophobicContact CG2-CD2 4.42Å
3365	S	80.2	Confident	83.9	Confident	36 Å²	36	24.9 Å²	24.9	25%	0.252	13%	0.126	S	C	.	.			trans	-129.8	114.1	-168	-172.2	0	0	0	0	113.6	K3361 I3367 W3368	K3361-S3365 WeakPolarHBondContact O-CB 3.19Å; K3361-S3365 PolarHBondContact O-N 2.98Å; S3365-I3367 PolarHBondContact O-N 3.15Å; S3365-I3367 WeakPolarHBondContact OG-CB 3.26Å; S3365-I3367 PolarHBondContact OG-N 3.25Å; S3365-W3368 WeakPolarHBondContact O-CB 3.38Å; S3365-W3368 PolarHBondContact O-N 3.03Å; S3365-W3368 VanDerWaalsContact O-N 3.16Å
3366	P	88	Confident	84.4	Confident	16.5 Å²	16.5	24.3 Å²	24.3	11%	0.107	12%	0.123	C	C	.	.	H	α-helix	trans	-60.1	-26.6	168.9	-21.8	32.5	0	0	0	113	Y2525 L2535 I2537 W3368 W3369 L3370	Y2525-P3366 HydrophobicContact CE1-CB 4.33Å; Y2525-P3366 HydrophobicContact CE2-CB 4.2Å; L2535-P3366 HydrophobicContact CD2-CB 4Å; I2537-P3366 HydrophobicContact CD1-CB 4.26Å; I2537-P3366 HydrophobicContact CD1-CG 3.96Å; P3366-W3368 VanDerWaalsContact C-N 3.25Å; P3366-W3368 PolarHBondContact O-N 3.02Å; P3366-W3369 PolarHBondContact O-N 3.33Å; P3366-L3370 WeakPolarHBondContact O-CG 3.29Å; P3366-L3370 PolarHBondContact O-N 2.91Å
3367	I	87.1	Confident	84.6	Confident	35 Å²	35	24 Å²	24	18%	0.179	12%	0.122	C	C	.	.	H	α-helix	trans	-60.7	-38.1	177.9	-58.7	174.6	0	0	0	110.5	S3365 W3369 L3370 K3371 L3377 L3433	S3365-I3367 PolarHBondContact O-N 3.15Å; S3365-I3367 WeakPolarHBondContact OG-CB 3.26Å; S3365-I3367 PolarHBondContact OG-N 3.25Å; I3367-W3369 PolarHBondContact O-N 3.08Å; I3367-L3370 PolarHBondContact O-N 2.96Å; I3367-K3371 WeakPolarHBondContact O-CB 3.45Å; I3367-K3371 PolarHBondContact O-N 2.86Å; I3367-L3377 HydrophobicContact CB-CD1 4.43Å; I3367-L3377 HydrophobicContact CG1-CD1 4.1Å; I3367-L3377 HydrophobicContact CG1-CD2 4.15Å; I3367-L3377 HydrophobicContact CG2-CB 4.33Å; I3367-L3377 HydrophobicContact CG2-CD1 4.18Å; I3367-L3433 HydrophobicContact CG1-CD1 3.94Å
3368	W	87.2	Confident	84.7	Confident	20.5 Å²	20.5	26.8 Å²	26.8	8%	0.078	14%	0.135	C	C	.	.	H	α-helix	trans	-58.3	-50	176.4	-178.1	92.1	0	0	0	110.7	W2592 E3358 K3361 A3362 S3365 P3366 L3370 K3371 Q3372	W2592-W3368 HydrophobicContact CH2-CH2 4.21Å; W2592-W3368 HydrophobicContact CH2-CZ2 4.3Å; W2592-W3368 AromaticContact CZ2-CH2 3.66Å; W2592-W3368 HydrophobicContact CZ2-CH2 3.66Å; W2592-W3368 HydrophobicContact CZ2-CZ2 4.2Å; E3358-W3368 PolarHBondContact OE2-NE1 3.34Å; K3361-W3368 HydrophobicContact CB-CB 4.43Å; K3361-W3368 HydrophobicContact CB-CG 4.08Å; A3362-W3368 HydrophobicContact CB-CD2 3.84Å; A3362-W3368 HydrophobicContact CB-CE3 3.48Å; A3362-W3368 VanDerWaalsContact CB-CE3 3.43Å; A3362-W3368 HydrophobicContact CB-CH2 3.98Å; A3362-W3368 HydrophobicContact CB-CZ2 4.25Å; A3362-W3368 HydrophobicContact CB-CZ3 3.56Å; S3365-W3368 WeakPolarHBondContact O-CB 3.38Å; S3365-W3368 PolarHBondContact O-N 3.03Å; S3365-W3368 VanDerWaalsContact O-N 3.16Å; P3366-W3368 VanDerWaalsContact C-N 3.25Å; P3366-W3368 PolarHBondContact O-N 3.02Å; W3368-L3370 PolarHBondContact O-N 3.02Å; W3368-K3371 WeakPolarHBondContact O-CB 3.49Å; W3368-K3371 PolarHBondContact O-N 2.94Å; W3368-Q3372 HydrophobicContact CD2-CG 4.04Å; W3368-Q3372 VanDerWaalsContact CE2-NE2 3.32Å; W3368-Q3372 HydrophobicContact CE3-CG 3.87Å; W3368-Q3372 HydrophobicContact CH2-CG 3.6Å; W3368-Q3372 HydrophobicContact CZ2-CG 3.82Å; W3368-Q3372 HydrophobicContact CZ3-CG 3.64Å; W3368-Q3372 WeakPolarHBondContact O-CG 3.32Å; W3368-Q3372 PolarHBondContact O-N 3.25Å; W3368-Q3372 VanDerWaalsContact O-N 3.08Å
3369	W	89.1	Confident	84.9	Confident	0.5 Å²	0.5	24.9 Å²	24.9	0%	0.002	13%	0.127	C	C	.	.	H	α-helix	trans	-63	-42.5	178	-70.9	97.2	0	0	0	113	L2535 F2548 A2550 P2574 A2575 L2577 A3362 P3366 I3367 K3371 Q3372 V3373	L2535-W3369 HydrophobicContact CD1-CB 3.96Å; L2535-W3369 HydrophobicContact CD1-CD2 4.18Å; L2535-W3369 HydrophobicContact CD1-CG 3.95Å; L2535-W3369 HydrophobicContact CD2-CB 3.7Å; L2535-W3369 HydrophobicContact CD2-CG 4.13Å; L2535-W3369 HydrophobicContact CG-CB 4.34Å; F2548-W3369 HydrophobicContact CB-CD2 4.31Å; F2548-W3369 HydrophobicContact CB-CH2 4.23Å; F2548-W3369 HydrophobicContact CB-CZ2 3.56Å; F2548-W3369 AromaticContact CD1-CD1 3.75Å; F2548-W3369 AromaticContact CD1-NE1 3.36Å; F2548-W3369 HydrophobicContact CG-CZ2 4.2Å; F2548-W3369 AromaticContact CG-NE1 3.67Å; A2550-W3369 HydrophobicContact CB-CE3 3.56Å; A2550-W3369 HydrophobicContact CB-CZ3 4.01Å; P2574-W3369 HydrophobicContact CB-CE3 4.24Å; P2574-W3369 HydrophobicContact CB-CZ3 3.81Å; A2575-W3369 WeakPolarHBondContact O-CH2 3.25Å; A2575-W3369 WeakPolarHBondContact O-CZ3 3.38Å; L2577-W3369 HydrophobicContact CB-CH2 3.84Å; L2577-W3369 HydrophobicContact CB-CZ2 3.56Å; L2577-W3369 HydrophobicContact CD2-CZ2 3.86Å; L2577-W3369 HydrophobicContact CG-CZ2 4.37Å; A3362-W3369 HydrophobicContact CB-CZ2 4.16Å; A3362-W3369 PolarHBondContact O-NE1 3.21Å; P3366-W3369 PolarHBondContact O-N 3.33Å; I3367-W3369 PolarHBondContact O-N 3.08Å; W3369-K3371 VanDerWaalsContact C-N 3.28Å; W3369-K3371 PolarHBondContact O-N 3.05Å; W3369-Q3372 WeakPolarHBondContact O-CB 3.23Å; W3369-Q3372 PolarHBondContact O-N 2.97Å; W3369-Q3372 VanDerWaalsContact O-N 3.07Å; W3369-V3373 PolarHBondContact O-N 2.73Å
3370	L	89.7	Confident	84.9	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-58.8	-43	176.6	-70.4	176.9	0	0	0	110.8	L2512 Y2525 L2534 P3366 I3367 W3368 Q3372 V3373 G3374 F3375 L3377 L3433	L2512-L3370 HydrophobicContact CD2-CD1 3.98Å; Y2525-L3370 HydrophobicContact CD1-CD1 4.35Å; Y2525-L3370 HydrophobicContact CG-CD2 4.45Å; L2534-L3370 HydrophobicContact CB-CD2 3.9Å; L2534-L3370 HydrophobicContact CD1-CD2 4.03Å; P3366-L3370 WeakPolarHBondContact O-CG 3.29Å; P3366-L3370 PolarHBondContact O-N 2.91Å; I3367-L3370 PolarHBondContact O-N 2.96Å; W3368-L3370 PolarHBondContact O-N 3.02Å; L3370-Q3372 VanDerWaalsContact C-N 3.32Å; L3370-Q3372 PolarHBondContact O-N 3.18Å; L3370-V3373 VanDerWaalsContact O-CG2 3.26Å; L3370-V3373 WeakPolarHBondContact O-CG2 3.4Å; L3370-V3373 PolarHBondContact O-N 3.41Å; L3370-G3374 PolarHBondContact O-N 3.22Å; L3370-G3374 VanDerWaalsContact O-N 3.13Å; L3370-F3375 CarbonylContact C-O 3.51Å; L3370-F3375 HydrophobicContact CB-CB 4.35Å; L3370-F3375 HydrophobicContact CB-CD1 4.39Å; L3370-F3375 WeakPolarHBondContact CB-O 3.32Å; L3370-F3375 HydrophobicContact CD1-CD1 4.3Å; L3370-F3375 CarbonylContact O-C 3.55Å; L3370-F3375 WeakPolarHBondContact O-CA 3.37Å; L3370-F3375 WeakPolarHBondContact O-CB 3.44Å; L3370-F3375 PolarHBondContact O-N 3.32Å; L3370-F3375 VanDerWaalsContact O-O 3.1Å; L3370-L3377 HydrophobicContact CB-CD1 4.12Å; L3370-L3377 HydrophobicContact CD1-CD1 3.38Å; L3370-L3377 HydrophobicContact CD1-CD2 4.43Å; L3370-L3377 HydrophobicContact CG-CD1 4.4Å; L3370-L3433 HydrophobicContact CD1-CD1 4.02Å
3371	K	86.5	Confident	84.7	Confident	89.5 Å²	89.5	25.3 Å²	25.3	39%	0.389	13%	0.13	S	C	.	.	H	α-helix	trans	-60.2	-41.9	173.7	-171.2	175.6	-179.1	173.8	0	111.8	I3367 W3368 W3369 V3373 G3374 F3375 D3378	I3367-K3371 WeakPolarHBondContact O-CB 3.45Å; I3367-K3371 PolarHBondContact O-N 2.86Å; W3368-K3371 WeakPolarHBondContact O-CB 3.49Å; W3368-K3371 PolarHBondContact O-N 2.94Å; W3369-K3371 VanDerWaalsContact C-N 3.28Å; W3369-K3371 PolarHBondContact O-N 3.05Å; K3371-V3373 PolarHBondContact O-N 3.14Å; K3371-G3374 WeakPolarHBondContact O-CA 3.38Å; K3371-G3374 PolarHBondContact O-N 3.15Å; K3371-G3374 VanDerWaalsContact O-N 3.08Å; K3371-F3375 PolarHBondContact N-O 2.74Å; K3371-D3378 IonicContact NZ-OD2 3.41Å
3372	Q	83	Confident	84	Confident	27.5 Å²	27.5	21.6 Å²	21.6	13%	0.129	12%	0.115	C	C	.	.	H	α-helix	trans	-63.2	-40	178.3	-59.4	-42.1	-31.4	0	0	113.5	N2553 P2574 Q2913 W3368 W3369 L3370 G3374	N2553-Q3372 PolarHBondContact OD1-O 2.9Å; P2574-Q3372 HydrophobicContact CG-CB 4.33Å; Q2913-Q3372 HydrophobicContact CG-CG 4.2Å; W3368-Q3372 HydrophobicContact CD2-CG 4.04Å; W3368-Q3372 VanDerWaalsContact CE2-NE2 3.32Å; W3368-Q3372 HydrophobicContact CE3-CG 3.87Å; W3368-Q3372 HydrophobicContact CH2-CG 3.6Å; W3368-Q3372 HydrophobicContact CZ2-CG 3.82Å; W3368-Q3372 HydrophobicContact CZ3-CG 3.64Å; W3368-Q3372 WeakPolarHBondContact O-CG 3.32Å; W3368-Q3372 PolarHBondContact O-N 3.25Å; W3368-Q3372 VanDerWaalsContact O-N 3.08Å; W3369-Q3372 WeakPolarHBondContact O-CB 3.23Å; W3369-Q3372 PolarHBondContact O-N 2.97Å; W3369-Q3372 VanDerWaalsContact O-N 3.07Å; L3370-Q3372 VanDerWaalsContact C-N 3.32Å; L3370-Q3372 PolarHBondContact O-N 3.18Å; Q3372-G3374 PolarHBondContact O-N 3.12Å
3373	V	84.1	Confident	83.1	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-1.7	176	-57.8	0	0	0	0	113.6	L2534 A2550 S2551 N2553 P2574 W3369 L3370 K3371	L2534-V3373 HydrophobicContact CB-CG2 4.09Å; L2534-V3373 HydrophobicContact CD2-CG2 4.24Å; A2550-V3373 HydrophobicContact CB-CG1 3.65Å; S2551-V3373 VanDerWaalsContact O-CG1 3.22Å; S2551-V3373 WeakPolarHBondContact O-CG1 3.36Å; N2553-V3373 VanDerWaalsContact OD1-CA 3.23Å; N2553-V3373 WeakPolarHBondContact OD1-CA 3.48Å; N2553-V3373 PolarHBondContact OD1-O 2.79Å; P2574-V3373 HydrophobicContact CG-CG1 4.11Å; W3369-V3373 PolarHBondContact O-N 2.73Å; L3370-V3373 VanDerWaalsContact O-CG2 3.26Å; L3370-V3373 WeakPolarHBondContact O-CG2 3.4Å; L3370-V3373 PolarHBondContact O-N 3.41Å; K3371-V3373 PolarHBondContact O-N 3.14Å
3374	G	80.3	Confident	82	Confident	3.5 Å²	3.5	26.2 Å²	26.2	4%	0.036	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	104.3	8.9	172.5	0	0	0	0	0	118.2	T2876 R2878 L3370 K3371 Q3372	T2876-G3374 WeakPolarHBondContact CB-O 3.38Å; R2878-G3374 VanDerWaalsContact CD-O 3.26Å; R2878-G3374 WeakPolarHBondContact CD-O 3.32Å; R2878-G3374 VanDerWaalsContact CG-O 3.31Å; R2878-G3374 WeakPolarHBondContact CG-O 3.34Å; R2878-G3374 PolarHBondContact NE-O 3.19Å; R2878-G3374 VanDerWaalsContact NE-O 3.12Å; L3370-G3374 PolarHBondContact O-N 3.22Å; L3370-G3374 VanDerWaalsContact O-N 3.13Å; K3371-G3374 WeakPolarHBondContact O-CA 3.38Å; K3371-G3374 PolarHBondContact O-N 3.15Å; K3371-G3374 VanDerWaalsContact O-N 3.08Å; Q3372-G3374 PolarHBondContact O-N 3.12Å
3375	F	87.6	Confident	81.1	Confident	2.5 Å²	2.5	24.8 Å²	24.8	1%	0.011	13%	0.125	C	C	.	.			trans	-104.3	94.7	179.1	-167.5	-90	0	0	0	109.2	L2511 L2512 L2534 L2875 L3370 K3371 L3377 F3380	L2511-F3375 HydrophobicContact CB-CE2 4.45Å; L2511-F3375 HydrophobicContact CB-CZ 4.01Å; L2512-F3375 HydrophobicContact CB-CE1 4.33Å; L2512-F3375 HydrophobicContact CB-CZ 4.15Å; L2512-F3375 HydrophobicContact CD2-CE1 4.4Å; L2534-F3375 HydrophobicContact CD1-CB 4.22Å; L2534-F3375 HydrophobicContact CD1-CD2 4.32Å; L2534-F3375 HydrophobicContact CD1-CG 4.19Å; L2875-F3375 VanDerWaalsContact O-CE2 3.27Å; L2875-F3375 WeakPolarHBondContact O-CE2 3.39Å; L3370-F3375 CarbonylContact C-O 3.51Å; L3370-F3375 HydrophobicContact CB-CB 4.35Å; L3370-F3375 HydrophobicContact CB-CD1 4.39Å; L3370-F3375 WeakPolarHBondContact CB-O 3.32Å; L3370-F3375 HydrophobicContact CD1-CD1 4.3Å; L3370-F3375 CarbonylContact O-C 3.55Å; L3370-F3375 WeakPolarHBondContact O-CA 3.37Å; L3370-F3375 WeakPolarHBondContact O-CB 3.44Å; L3370-F3375 PolarHBondContact O-N 3.32Å; L3370-F3375 VanDerWaalsContact O-O 3.1Å; K3371-F3375 PolarHBondContact N-O 2.74Å; F3375-L3377 HydrophobicContact CD1-CB 4.32Å; F3375-L3377 HydrophobicContact CD1-CD1 4.31Å; F3375-L3377 HydrophobicContact CD1-CD2 4.21Å; F3375-L3377 HydrophobicContact CD1-CG 3.76Å; F3375-L3377 HydrophobicContact CE1-CB 4.19Å; F3375-L3377 HydrophobicContact CE1-CD1 4.11Å; F3375-L3377 HydrophobicContact CE1-CD2 3.58Å; F3375-L3377 HydrophobicContact CE1-CG 3.67Å; F3375-L3377 PolarHBondContact O-N 2.98Å; F3375-L3377 VanDerWaalsContact O-N 3.13Å; F3375-F3380 HydrophobicContact CE1-CD2 4.38Å; F3375-F3380 HydrophobicContact CE1-CE2 4.43Å; F3375-F3380 HydrophobicContact CE2-CE2 4.38Å; F3375-F3380 HydrophobicContact CZ-CD2 4.32Å; F3375-F3380 HydrophobicContact CZ-CE2 4.16Å
3376	N	88.1	Confident	79.9	Confident	29 Å²	29	25.1 Å²	25.1	16%	0.155	13%	0.126	C	C	.	.			trans	-86.2	86.8	-176.2	-170.8	7.8	0	0	0	111.2	T2876 D3378 N3379	T2876-N3376 PolarHBondContact O-N 2.87Å; N3376-D3378 PolarHBondContact O-N 2.86Å; N3376-D3378 WeakPolarHBondContact OD1-CB 3.39Å; N3376-D3378 PolarHBondContact OD1-N 2.9Å; N3376-D3378 PolarHBondContact OD1-OD2 3.46Å; N3376-N3379 PolarHBondContact ND2-ND2 3Å; N3376-N3379 VanDerWaalsContact ND2-ND2 3.16Å; N3376-N3379 PolarHBondContact O-N 3.11Å
3377	L	86.4	Confident	78.1	Confident	2.5 Å²	2.5	28.2 Å²	28.2	1%	0.013	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-61.3	-25	179.9	-126.1	112	0	0	0	113.9	L2504 I3367 L3370 F3375 N3379 F3380 L3381 L3433	L2504-L3377 HydrophobicContact CD2-CD1 3.62Å; I3367-L3377 HydrophobicContact CB-CD1 4.43Å; I3367-L3377 HydrophobicContact CG1-CD1 4.1Å; I3367-L3377 HydrophobicContact CG1-CD2 4.15Å; I3367-L3377 HydrophobicContact CG2-CB 4.33Å; I3367-L3377 HydrophobicContact CG2-CD1 4.18Å; L3370-L3377 HydrophobicContact CB-CD1 4.12Å; L3370-L3377 HydrophobicContact CD1-CD1 3.38Å; L3370-L3377 HydrophobicContact CD1-CD2 4.43Å; L3370-L3377 HydrophobicContact CG-CD1 4.4Å; F3375-L3377 HydrophobicContact CD1-CB 4.32Å; F3375-L3377 HydrophobicContact CD1-CD1 4.31Å; F3375-L3377 HydrophobicContact CD1-CD2 4.21Å; F3375-L3377 HydrophobicContact CD1-CG 3.76Å; F3375-L3377 HydrophobicContact CE1-CB 4.19Å; F3375-L3377 HydrophobicContact CE1-CD1 4.11Å; F3375-L3377 HydrophobicContact CE1-CD2 3.58Å; F3375-L3377 HydrophobicContact CE1-CG 3.67Å; F3375-L3377 PolarHBondContact O-N 2.98Å; F3375-L3377 VanDerWaalsContact O-N 3.13Å; L3377-N3379 PolarHBondContact O-N 2.83Å; L3377-N3379 VanDerWaalsContact O-N 3.14Å; L3377-F3380 PolarHBondContact O-N 3.16Å; L3377-L3381 HydrophobicContact CB-CD1 4.43Å; L3377-L3381 HydrophobicContact CD1-CD1 3.84Å; L3377-L3381 HydrophobicContact CD1-CG 4.01Å; L3377-L3381 HydrophobicContact CD2-CD1 3.95Å; L3377-L3381 HydrophobicContact CD2-CG 4.32Å; L3377-L3381 HydrophobicContact CG-CB 4.31Å; L3377-L3381 HydrophobicContact CG-CD1 3.95Å; L3377-L3381 HydrophobicContact CG-CG 4.26Å; L3377-L3381 PolarHBondContact O-N 3.06Å; L3377-L3433 HydrophobicContact CD1-CD1 3.33Å; L3377-L3433 HydrophobicContact CD2-CD1 4.36Å; L3377-L3433 HydrophobicContact CG-CD1 4.47Å
3378	D	82.7	Confident	76.5	Confident	67 Å²	67	29.4 Å²	29.4	36%	0.358	14%	0.143	S	C	.	.	G	3₁₀ helix	trans	-60.7	-24.2	178.6	-62.2	-32	0	0	0	112	K3371 N3376 F3380	K3371-D3378 IonicContact NZ-OD2 3.41Å; N3376-D3378 PolarHBondContact O-N 2.86Å; N3376-D3378 WeakPolarHBondContact OD1-CB 3.39Å; N3376-D3378 PolarHBondContact OD1-N 2.9Å; N3376-D3378 PolarHBondContact OD1-OD2 3.46Å; D3378-F3380 VanDerWaalsContact C-N 3.31Å
3379	N	87.1	Confident	74.8	Confident	15.5 Å²	15.5	28.9 Å²	28.9	8%	0.083	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-90.3	4.4	177.3	-70.9	-19.1	0	0	0	113.7	N2835 L2872 G2877 K3148 N3376 L3377	N2835-N3379 PolarHBondContact ND2-O 2.93Å; N2835-N3379 VanDerWaalsContact OD1-CA 3.26Å; N2835-N3379 WeakPolarHBondContact OD1-CA 3.45Å; N2835-N3379 WeakPolarHBondContact OD1-CB 3.44Å; N2835-N3379 PolarHBondContact OD1-O 3.25Å; N2835-N3379 PolarHBondContact OD1-OD1 2.89Å; L2872-N3379 HydrophobicContact CD1-CB 4.44Å; G2877-N3379 PolarHBondContact O-ND2 3.26Å; K3148-N3379 PolarHBondContact NZ-OD1 3.04Å; N3376-N3379 PolarHBondContact ND2-ND2 3Å; N3376-N3379 VanDerWaalsContact ND2-ND2 3.16Å; N3376-N3379 PolarHBondContact O-N 3.11Å; L3377-N3379 PolarHBondContact O-N 2.83Å; L3377-N3379 VanDerWaalsContact O-N 3.14Å
3380	F	84.8	Confident	73.3	Confident	8 Å²	8	30.7 Å²	30.7	4%	0.035	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.3	-41.1	176.9	-63.5	-60.7	0	0	0	112.2	V2506 L2511 S2874 L2875 T2876 G2877 F3375 L3377 D3378	V2506-F3380 HydrophobicContact CG2-CB 4.28Å; L2511-F3380 HydrophobicContact CD1-CB 4.08Å; L2511-F3380 HydrophobicContact CD1-CD1 3.38Å; L2511-F3380 HydrophobicContact CD1-CD2 3.94Å; L2511-F3380 HydrophobicContact CD1-CE1 3.63Å; L2511-F3380 HydrophobicContact CD1-CE2 4.16Å; L2511-F3380 HydrophobicContact CD1-CG 3.54Å; L2511-F3380 HydrophobicContact CD1-CZ 4.01Å; S2874-F3380 VanDerWaalsContact O-CE1 3.28Å; S2874-F3380 WeakPolarHBondContact O-CE1 3.3Å; S2874-F3380 WeakPolarHBondContact O-CZ 3.06Å; L2875-F3380 WeakPolarHBondContact O-CZ 3.32Å; T2876-F3380 VanDerWaalsContact C-CE2 3.41Å; G2877-F3380 VanDerWaalsContact N-CZ 3.27Å; F3375-F3380 HydrophobicContact CE1-CD2 4.38Å; F3375-F3380 HydrophobicContact CE1-CE2 4.43Å; F3375-F3380 HydrophobicContact CE2-CE2 4.38Å; F3375-F3380 HydrophobicContact CZ-CD2 4.32Å; F3375-F3380 HydrophobicContact CZ-CE2 4.16Å; L3377-F3380 PolarHBondContact O-N 3.16Å; D3378-F3380 VanDerWaalsContact C-N 3.31Å
3381	L	77.3	Confident	71.6	Confident	16.5 Å²	16.5	32.3 Å²	32.3	9%	0.086	16%	0.161	C	C	.	.	S	Bend	trans	-100.6	78.9	177	-64.9	178.5	0	0	0	109.5	L2504 L3377 K3383 F3430	L2504-L3381 HydrophobicContact CD1-CD1 4.5Å; L2504-L3381 HydrophobicContact CD1-CD2 3.88Å; L2504-L3381 HydrophobicContact CD1-CG 4.42Å; L2504-L3381 HydrophobicContact CD2-CD1 3.95Å; L2504-L3381 HydrophobicContact CD2-CD2 4.32Å; L2504-L3381 HydrophobicContact CD2-CG 3.97Å; L3377-L3381 HydrophobicContact CB-CD1 4.43Å; L3377-L3381 HydrophobicContact CD1-CD1 3.84Å; L3377-L3381 HydrophobicContact CD1-CG 4.01Å; L3377-L3381 HydrophobicContact CD2-CD1 3.95Å; L3377-L3381 HydrophobicContact CD2-CG 4.32Å; L3377-L3381 HydrophobicContact CG-CB 4.31Å; L3377-L3381 HydrophobicContact CG-CD1 3.95Å; L3377-L3381 HydrophobicContact CG-CG 4.26Å; L3377-L3381 PolarHBondContact O-N 3.06Å; L3381-K3383 PolarHBondContact O-N 3.15Å; L3381-K3383 VanDerWaalsContact O-N 3.1Å; L3381-F3430 HydrophobicContact CD2-CD1 4.04Å; L3381-F3430 HydrophobicContact CD2-CE1 3.3Å; L3381-F3430 HydrophobicContact CD2-CZ 3.86Å
3382	T	67.2	Low	69.8	Low	18.5 Å²	18.5	31.9 Å²	31.9	11%	0.113	16%	0.161	C	C	.	.			trans	-61.2	124.4	170.7	47.3	0	0	0	0	109.6	N2833 M2834 F3384 V3391	N2833-T3382 WeakPolarHBondContact O-CG2 3.34Å; M2834-T3382 HydrophobicContact CB-CG2 4.19Å; T3382-F3384 WeakPolarHBondContact O-CD2 3.36Å; T3382-F3384 PolarHBondContact O-N 3.29Å; T3382-V3391 HydrophobicContact CG2-CG1 4.06Å
3383	K	66.8	Low	67.8	Low	54.5 Å²	54.5	33 Å²	33	24%	0.237	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	127.4	179.4	-59.6	-169.9	178.2	-152.8	0	109.9	L3381 K3390 V3391 E3392 E3431	L3381-K3383 PolarHBondContact O-N 3.15Å; L3381-K3383 VanDerWaalsContact O-N 3.1Å; K3383-K3390 VanDerWaalsContact O-O 3.12Å; K3383-V3391 CarbonylContact O-C 3.55Å; K3383-V3391 VanDerWaalsContact O-C 3.32Å; K3383-V3391 WeakPolarHBondContact O-CA 3.21Å; K3383-E3392 HydrophobicContact CB-CB 3.92Å; K3383-E3392 VanDerWaalsContact CB-O 3.29Å; K3383-E3392 WeakPolarHBondContact CB-O 3.44Å; K3383-E3392 HydrophobicContact CD-CB 3.95Å; K3383-E3392 VanDerWaalsContact CD-O 3.29Å; K3383-E3392 WeakPolarHBondContact CD-O 3.41Å; K3383-E3392 HydrophobicContact CG-CB 4.36Å; K3383-E3392 VanDerWaalsContact CG-O 3.29Å; K3383-E3392 WeakPolarHBondContact CG-O 3.08Å; K3383-E3392 PolarHBondContact N-O 3.4Å; K3383-E3392 PolarHBondContact O-N 3.37Å; K3383-E3431 WeakPolarHBondContact CD-OE1 3.27Å; K3383-E3431 VanDerWaalsContact CG-OE1 3.32Å; K3383-E3431 WeakPolarHBondContact CG-OE1 3.3Å; K3383-E3431 IonicContact NZ-OE1 2.67Å; K3383-E3431 PolarHBondContact NZ-OE1 2.84Å; K3383-E3431 IonicContact NZ-OE2 2.83Å; K3383-E3431 PolarHBondContact NZ-OE2 3.43Å
3384	F	60.5	Low	65.6	Low	45.5 Å²	45.5	35.2 Å²	35.2	20%	0.2	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	118.6	-176.4	-129.3	-96.7	0	0	0	111.7	M2834 T3382 T3386 K3390 V3391 N3427	M2834-F3384 HydrophobicContact CE-CZ 4.36Å; T3382-F3384 WeakPolarHBondContact O-CD2 3.36Å; T3382-F3384 PolarHBondContact O-N 3.29Å; F3384-T3386 HydrophobicContact CD1-CG2 4.15Å; F3384-T3386 HydrophobicContact CE1-CG2 4.34Å; F3384-T3386 PolarHBondContact O-N 2.86Å; F3384-K3390 CarbonylContact C-O 3.42Å; F3384-K3390 WeakPolarHBondContact CA-O 3.34Å; F3384-V3391 HydrophobicContact CD2-CG2 4.07Å; F3384-V3391 HydrophobicContact CE2-CG2 4.44Å; F3384-N3427 PolarHBondContact O-ND2 3.02Å
3385	D	59.4	Low	63.6	Low	31.5 Å²	31.5	41.4 Å²	41.4	17%	0.168	21%	0.213	C	C	.	.			trans	-79.5	114.9	162.5	-171.7	-23.7	0	0	0	109	F3387 E3388 G3389 K3390	D3385-F3387 VanDerWaalsContact C-N 3.3Å; D3385-F3387 PolarHBondContact O-N 3.16Å; D3385-F3387 WeakPolarHBondContact OD1-CA 3.24Å; D3385-F3387 WeakPolarHBondContact OD1-CB 3.04Å; D3385-F3387 PolarHBondContact OD1-N 3.11Å; D3385-E3388 HydrophobicContact CB-CB 4.27Å; D3385-E3388 PolarHBondContact OD1-N 2.82Å; D3385-E3388 WeakPolarHBondContact OD2-CB 3.34Å; D3385-E3388 VanDerWaalsContact OD2-CG 3.29Å; D3385-E3388 WeakPolarHBondContact OD2-CG 3.15Å; D3385-G3389 CarbonylContact O-C 3.6Å; D3385-G3389 WeakPolarHBondContact O-CA 3.33Å; D3385-G3389 PolarHBondContact O-N 3.16Å; D3385-K3390 HydrophobicContact CB-CB 4.3Å; D3385-K3390 PolarHBondContact N-O 2.87Å; D3385-K3390 PolarHBondContact O-N 2.87Å
3386	T	54.4	Low	61.1	Low	42.5 Å²	42.5	46.9 Å²	46.9	26%	0.261	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-18.4	179.8	54.4	0	0	0	0	113.9	F3384 Y3423	F3384-T3386 HydrophobicContact CD1-CG2 4.15Å; F3384-T3386 HydrophobicContact CE1-CG2 4.34Å; F3384-T3386 PolarHBondContact O-N 2.86Å; T3386-Y3423 HydrophobicContact CG2-CD1 4.11Å; T3386-Y3423 HydrophobicContact CG2-CG 4.43Å; T3386-Y3423 WeakPolarHBondContact OG1-CB 3.26Å
3387	F	50.5	Low	58.6	Low	83 Å²	83	48.5 Å²	48.5	36%	0.364	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-45.2	-179.9	-91.9	-84.6	0	0	0	112.2	Q2767 D3385 G3389	Q2767-F3387 WeakPolarHBondContact CG-O 3.39Å; Q2767-F3387 PolarHBondContact NE2-O 3.09Å; Q2767-F3387 PolarHBondContact OE1-O 3.34Å; D3385-F3387 VanDerWaalsContact C-N 3.3Å; D3385-F3387 PolarHBondContact O-N 3.16Å; D3385-F3387 WeakPolarHBondContact OD1-CA 3.24Å; D3385-F3387 WeakPolarHBondContact OD1-CB 3.04Å; D3385-F3387 PolarHBondContact OD1-N 3.11Å; F3387-G3389 VanDerWaalsContact C-N 3.31Å
3388	E	53.1	Low	56.1	Low	60 Å²	60	48.9 Å²	48.9	28%	0.28	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-10.6	176.9	-59	-173.8	144.6	0	0	112.5	Q2767 P2768 D3385 K3390	Q2767-E3388 PolarHBondContact NE2-O 2.65Å; Q2767-E3388 VanDerWaalsContact OE1-C 3.24Å; Q2767-E3388 PolarHBondContact OE1-O 2.93Å; Q2767-E3388 VanDerWaalsContact OE1-O 3.11Å; P2768-E3388 HydrophobicContact CG-CG 4.2Å; D3385-E3388 HydrophobicContact CB-CB 4.27Å; D3385-E3388 PolarHBondContact OD1-N 2.82Å; D3385-E3388 WeakPolarHBondContact OD2-CB 3.34Å; D3385-E3388 VanDerWaalsContact OD2-CG 3.29Å; D3385-E3388 WeakPolarHBondContact OD2-CG 3.15Å; E3388-K3390 HydrophobicContact CB-CB 4.46Å; E3388-K3390 HydrophobicContact CB-CD 4.05Å; E3388-K3390 HydrophobicContact CB-CG 3.81Å; E3388-K3390 PolarHBondContact O-N 3.07Å; E3388-K3390 IonicContact OE1-NZ 3.16Å; E3388-K3390 PolarHBondContact OE1-NZ 2.84Å; E3388-K3390 WeakPolarHBondContact OE2-CD 3.27Å; E3388-K3390 WeakPolarHBondContact OE2-CE 3.3Å; E3388-K3390 IonicContact OE2-NZ 3.22Å; E3388-K3390 PolarHBondContact OE2-NZ 2.79Å
3389	G	52	Low	54.1	Low	9 Å²	9	50.9 Å²	50.9	9%	0.093	27%	0.267	C	S	.	.			trans	68.9	2.9	-172	0	0	0	0	0	113.3	S2797 D3385 F3387	S2797-G3389 WeakPolarHBondContact CB-O 3.32Å; S2797-G3389 PolarHBondContact OG-O 3.31Å; D3385-G3389 CarbonylContact O-C 3.6Å; D3385-G3389 WeakPolarHBondContact O-CA 3.33Å; D3385-G3389 PolarHBondContact O-N 3.16Å; F3387-G3389 VanDerWaalsContact C-N 3.31Å
3390	K	57.5	Low	51.6	Low	39 Å²	39	51.5 Å²	51.5	17%	0.17	27%	0.271	C	S	.	.			trans	-71.3	140.7	-171.1	-66.6	-177.8	-166.4	163.1	0	112.3	T2773 K3383 F3384 D3385 E3388 E3392	T2773-K3390 HydrophobicContact CG2-CD 4.12Å; K3383-K3390 VanDerWaalsContact O-O 3.12Å; F3384-K3390 CarbonylContact C-O 3.42Å; F3384-K3390 WeakPolarHBondContact CA-O 3.34Å; D3385-K3390 HydrophobicContact CB-CB 4.3Å; D3385-K3390 PolarHBondContact N-O 2.87Å; D3385-K3390 PolarHBondContact O-N 2.87Å; E3388-K3390 HydrophobicContact CB-CB 4.46Å; E3388-K3390 HydrophobicContact CB-CD 4.05Å; E3388-K3390 HydrophobicContact CB-CG 3.81Å; E3388-K3390 PolarHBondContact O-N 3.07Å; E3388-K3390 IonicContact OE1-NZ 3.16Å; E3388-K3390 PolarHBondContact OE1-NZ 2.84Å; E3388-K3390 WeakPolarHBondContact OE2-CD 3.27Å; E3388-K3390 WeakPolarHBondContact OE2-CE 3.3Å; E3388-K3390 IonicContact OE2-NZ 3.22Å; E3388-K3390 PolarHBondContact OE2-NZ 2.79Å; K3390-E3392 PolarHBondContact O-N 2.82Å
3391	V	53.5	Low	49.2	Very low	33 Å²	33	52.5 Å²	52.5	20%	0.2	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	99.5	159.5	178.4	0	0	0	0	107.2	S2797 L2798 T3382 K3383 F3384 S3393	S2797-V3391 WeakPolarHBondContact OG-CG2 3.47Å; L2798-V3391 HydrophobicContact CD2-CG2 3.75Å; T3382-V3391 HydrophobicContact CG2-CG1 4.06Å; K3383-V3391 CarbonylContact O-C 3.55Å; K3383-V3391 VanDerWaalsContact O-C 3.32Å; K3383-V3391 WeakPolarHBondContact O-CA 3.21Å; F3384-V3391 HydrophobicContact CD2-CG2 4.07Å; F3384-V3391 HydrophobicContact CE2-CG2 4.44Å; V3391-S3393 VanDerWaalsContact C-N 3.33Å; V3391-S3393 PolarHBondContact O-N 2.98Å
3392	E	49.3	Very low	47.3	Very low	81.5 Å²	81.5	54.5 Å²	54.5	38%	0.381	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	102.2	174.3	-80.9	-170	169.3	0	0	109.3	K3383 K3390 S3394	K3383-E3392 HydrophobicContact CB-CB 3.92Å; K3383-E3392 VanDerWaalsContact CB-O 3.29Å; K3383-E3392 WeakPolarHBondContact CB-O 3.44Å; K3383-E3392 HydrophobicContact CD-CB 3.95Å; K3383-E3392 VanDerWaalsContact CD-O 3.29Å; K3383-E3392 WeakPolarHBondContact CD-O 3.41Å; K3383-E3392 HydrophobicContact CG-CB 4.36Å; K3383-E3392 VanDerWaalsContact CG-O 3.29Å; K3383-E3392 WeakPolarHBondContact CG-O 3.08Å; K3383-E3392 PolarHBondContact N-O 3.4Å; K3383-E3392 PolarHBondContact O-N 3.37Å; K3390-E3392 PolarHBondContact O-N 2.82Å; E3392-S3394 VanDerWaalsContact C-N 3.34Å; E3392-S3394 PolarHBondContact O-N 2.95Å; E3392-S3394 VanDerWaalsContact O-N 3.09Å
3393	S	41.5	Very low	45.9	Very low	51 Å²	51	58.3 Å²	58.3	36%	0.357	31%	0.314	S	S	.	.	S	Bend	trans	-83.3	42.9	172.4	56.4	0	0	0	0	111.6	K3148 V3391	K3148-S3393 WeakPolarHBondContact CG-OG 3.46Å; V3391-S3393 VanDerWaalsContact C-N 3.33Å; V3391-S3393 PolarHBondContact O-N 2.98Å
3394	S	37.1	Very low	44.6	Very low	46 Å²	46	55.8 Å²	55.8	32%	0.322	30%	0.303	S	S	.	.			trans	130.6	153.9	169.1	81.5	0	0	0	0	114.2	E3392 N3396 A3397	E3392-S3394 VanDerWaalsContact C-N 3.34Å; E3392-S3394 PolarHBondContact O-N 2.95Å; E3392-S3394 VanDerWaalsContact O-N 3.09Å; S3394-N3396 PolarHBondContact O-N 3.05Å; S3394-N3396 WeakPolarHBondContact OG-CB 3.24Å; S3394-N3396 PolarHBondContact OG-N 3.07Å; S3394-A3397 PolarHBondContact O-N 2.83Å
3395	K	39.6	Very low	43.7	Very low	132.5 Å²	132.5	54.9 Å²	54.9	58%	0.576	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-1.4	170.1	-73.5	-174.4	171.2	-169.6	0	113.7	A3397 D3460	K3395-A3397 VanDerWaalsContact C-N 3.25Å; K3395-A3397 PolarHBondContact O-N 3.17Å; K3395-D3460 IonicContact NZ-OD1 2.74Å; K3395-D3460 PolarHBondContact NZ-OD1 2.75Å; K3395-D3460 IonicContact NZ-OD2 3.36Å; K3395-D3460 PolarHBondContact NZ-OD2 2.79Å
3396	N	35.1	Very low	42.5	Very low	118 Å²	118	55.6 Å²	55.6	63%	0.631	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	14.7	177.9	-64.5	-10.6	0	0	0	113	S3394 L3398	S3394-N3396 PolarHBondContact O-N 3.05Å; S3394-N3396 WeakPolarHBondContact OG-CB 3.24Å; S3394-N3396 PolarHBondContact OG-N 3.07Å; N3396-L3398 PolarHBondContact O-N 2.85Å
3397	A	34.4	Very low	41.6	Very low	62.5 Å²	62.5	58.4 Å²	58.4	52%	0.517	32%	0.317	S	S	.	.	S	Bend	trans	-45.6	118.3	163.1	0	0	0	0	0	107.3	S3394 K3395 K3399	S3394-A3397 PolarHBondContact O-N 2.83Å; K3395-A3397 VanDerWaalsContact C-N 3.25Å; K3395-A3397 PolarHBondContact O-N 3.17Å; A3397-K3399 PolarHBondContact O-N 3.2Å
3398	L	35.2	Very low	40.9	Very low	11 Å²	11	57.1 Å²	57.1	6%	0.058	31%	0.314	C	S	.	.			trans	-37.2	116.5	-176.9	-86	163	0	0	0	109.4	L2772 P3150 T3151 P3300 N3396 N3400 S3401	L2772-L3398 HydrophobicContact CD1-CB 4.01Å; L2772-L3398 HydrophobicContact CD1-CD1 4.01Å; L2772-L3398 HydrophobicContact CD2-CD1 3.94Å; L2772-L3398 HydrophobicContact CG-CD1 4.46Å; P3150-L3398 HydrophobicContact CB-CD1 3.78Å; P3150-L3398 HydrophobicContact CB-CG 4.26Å; P3150-L3398 HydrophobicContact CG-CD1 3.63Å; P3150-L3398 HydrophobicContact CG-CD2 4.29Å; P3150-L3398 HydrophobicContact CG-CG 3.7Å; T3151-L3398 HydrophobicContact CG2-CD1 3.98Å; T3151-L3398 HydrophobicContact CG2-CD2 3.28Å; T3151-L3398 HydrophobicContact CG2-CG 3.89Å; P3300-L3398 HydrophobicContact CB-CD2 4.27Å; N3396-L3398 PolarHBondContact O-N 2.85Å; L3398-N3400 HydrophobicContact CB-CB 3.98Å; L3398-N3400 HydrophobicContact CD2-CB 4.23Å; L3398-N3400 WeakPolarHBondContact CD2-ND2 3.38Å; L3398-N3400 PolarHBondContact O-N 2.78Å; L3398-S3401 PolarHBondContact O-N 3.35Å; L3398-S3401 PolarHBondContact O-OG 3.2Å
3399	K	39	Very low	39.9	Very low	109 Å²	109	55.5 Å²	55.5	47%	0.474	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	7.8	165	-69.7	-175.6	179.4	178.2	0	111.7	H3318 T3323 A3397 S3401	H3318-K3399 PolarHBondContact CE1-O 2.93Å; H3318-K3399 VanDerWaalsContact CE1-O 3.32Å; H3318-K3399 PolarHBondContact NE2-O 3.09Å; T3323-K3399 HydrophobicContact CG2-CD 3.59Å; A3397-K3399 PolarHBondContact O-N 3.2Å; K3399-S3401 VanDerWaalsContact C-N 3.33Å; K3399-S3401 CarbonylContact C-O 3.53Å
3400	N	34.7	Very low	39	Very low	30 Å²	30	57.2 Å²	57.2	16%	0.16	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-11.5	173.4	-60.3	8.4	0	0	0	112.4	E3124 L3398	E3124-N3400 PolarHBondContact O-ND2 2.99Å; L3398-N3400 HydrophobicContact CB-CB 3.98Å; L3398-N3400 HydrophobicContact CD2-CB 4.23Å; L3398-N3400 WeakPolarHBondContact CD2-ND2 3.38Å; L3398-N3400 PolarHBondContact O-N 2.78Å
3401	S	35.6	Very low	37.5	Very low	27 Å²	27	60.3 Å²	60.3	19%	0.189	34%	0.342	C	S	.	.	S	Bend	trans	-62.5	143.4	156.7	65.6	0	0	0	0	107.6	L3398 K3399 P3403	L3398-S3401 PolarHBondContact O-N 3.35Å; L3398-S3401 PolarHBondContact O-OG 3.2Å; K3399-S3401 VanDerWaalsContact C-N 3.33Å; K3399-S3401 CarbonylContact C-O 3.53Å; S3401-P3403 WeakPolarHBondContact O-CD 3.28Å; S3401-P3403 WeakPolarHBondContact OG-CD 3.45Å
3402	L	37.5	Very low	36.3	Very low	60 Å²	60	63.9 Å²	63.9	31%	0.314	36%	0.359	S	S	.	.	S	Bend	trans	-90.7	41.4	-171.2	-80.7	145.1	0	0	0	115.1	L2730 I2744 L3404	L2730-L3402 HydrophobicContact CB-CD2 4.42Å; L2730-L3402 HydrophobicContact CD2-CD2 3.79Å; I2744-L3402 HydrophobicContact CD1-CD1 3.81Å; I2744-L3402 HydrophobicContact CD1-CD2 3.79Å; I2744-L3402 HydrophobicContact CD1-CG 4.41Å; L3402-L3404 HydrophobicContact CD2-CD1 4.46Å; L3402-L3404 PolarHBondContact O-N 3.14Å
3403	P	36.6	Very low	35.2	Very low	98 Å²	98	67.9 Å²	67.9	64%	0.636	38%	0.378	S	S	*	.			trans	-77	83.2	156	27.8	-14.4	0	0	0	106.7	S3401 F3405	S3401-P3403 WeakPolarHBondContact O-CD 3.28Å; S3401-P3403 WeakPolarHBondContact OG-CD 3.45Å; P3403-F3405 PolarHBondContact O-N 2.81Å
3404	L	39.5	Very low	34.6	Very low	2 Å²	2	68 Å²	68	1%	0.01	38%	0.378	C	S	.	.			trans	-65.5	-23.8	-176.9	-155.1	86	0	0	0	112.1	Y2711 L2730 I3321 L3402	Y2711-L3404 HydrophobicContact CD1-CD2 3.57Å; Y2711-L3404 HydrophobicContact CE1-CD2 4.04Å; L2730-L3404 HydrophobicContact CD1-CD2 3.94Å; L2730-L3404 HydrophobicContact CD2-CD1 4.3Å; L2730-L3404 HydrophobicContact CD2-CD2 4.18Å; I3321-L3404 HydrophobicContact CB-CD2 3.76Å; I3321-L3404 HydrophobicContact CB-CG 3.88Å; I3321-L3404 HydrophobicContact CG1-CD2 3.91Å; I3321-L3404 HydrophobicContact CG2-CD2 3.84Å; I3321-L3404 HydrophobicContact CG2-CG 3.97Å; I3321-L3404 VanDerWaalsContact CG2-O 3.29Å; I3321-L3404 WeakPolarHBondContact CG2-O 3.4Å; L3402-L3404 HydrophobicContact CD2-CD1 4.46Å; L3402-L3404 PolarHBondContact O-N 3.14Å
3405	F	42.4	Very low	34.2	Very low	27 Å²	27	74.3 Å²	74.3	12%	0.118	40%	0.4	C	S	.	.	S	Bend	trans	-103	133.1	-167.6	-67.3	-80.6	0	0	0	112.8	W2713 I3321 P3403 I3407 M3409	W2713-F3405 HydrophobicContact CB-CD2 4.37Å; W2713-F3405 HydrophobicContact CB-CE2 3.41Å; W2713-F3405 VanDerWaalsContact CB-CE2 3.41Å; W2713-F3405 HydrophobicContact CB-CZ 3.8Å; W2713-F3405 AromaticContact CD1-CE2 3.97Å; W2713-F3405 AromaticContact CD2-CE1 3.8Å; W2713-F3405 HydrophobicContact CD2-CE1 3.8Å; W2713-F3405 AromaticContact CD2-CE2 3.77Å; W2713-F3405 HydrophobicContact CD2-CE2 3.77Å; W2713-F3405 AromaticContact CD2-CZ 3.27Å; W2713-F3405 HydrophobicContact CD2-CZ 3.27Å; W2713-F3405 AromaticContact CE2-CE1 3.97Å; W2713-F3405 AromaticContact CE2-CZ 3.92Å; W2713-F3405 AromaticContact CE3-CE1 3.78Å; W2713-F3405 HydrophobicContact CE3-CE1 3.78Å; W2713-F3405 HydrophobicContact CE3-CE2 4.12Å; W2713-F3405 AromaticContact CE3-CZ 3.25Å; W2713-F3405 HydrophobicContact CE3-CZ 3.25Å; W2713-F3405 HydrophobicContact CG-CD2 4.25Å; W2713-F3405 HydrophobicContact CG-CE1 4.34Å; W2713-F3405 AromaticContact CG-CE2 3.46Å; W2713-F3405 HydrophobicContact CG-CE2 3.46Å; W2713-F3405 VanDerWaalsContact CG-CE2 3.46Å; W2713-F3405 AromaticContact CG-CZ 3.53Å; W2713-F3405 HydrophobicContact CG-CZ 3.53Å; W2713-F3405 HydrophobicContact CH2-CE1 4.14Å; W2713-F3405 HydrophobicContact CH2-CZ 4.44Å; W2713-F3405 HydrophobicContact CZ2-CE1 4.19Å; W2713-F3405 HydrophobicContact CZ2-CZ 4.49Å; W2713-F3405 AromaticContact CZ3-CE1 3.9Å; W2713-F3405 HydrophobicContact CZ3-CE1 3.9Å; W2713-F3405 AromaticContact CZ3-CZ 3.82Å; W2713-F3405 HydrophobicContact CZ3-CZ 3.82Å; I3321-F3405 HydrophobicContact CG2-CD1 4.17Å; I3321-F3405 HydrophobicContact CG2-CE1 4.04Å; P3403-F3405 PolarHBondContact O-N 2.81Å; F3405-I3407 PolarHBondContact O-N 2.89Å; F3405-M3409 HydrophobicContact CD1-CB 4.06Å; F3405-M3409 HydrophobicContact CD1-CE 3.67Å; F3405-M3409 HydrophobicContact CD1-SD 4.34Å; F3405-M3409 HydrophobicContact CE1-CE 3.75Å; F3405-M3409 HydrophobicContact CE1-SD 4.44Å
3406	P	34.3	Very low	33.9	Very low	46 Å²	46	72.6 Å²	72.6	30%	0.299	40%	0.398	S	S	.	.			trans	-54.3	134.6	150.9	-16.1	29	0	0	0	108.4	D3408 M3409	P3406-D3408 PolarHBondContact O-N 3.49Å; P3406-M3409 PolarHBondContact O-N 3.09Å; P3406-M3409 VanDerWaalsContact O-N 3.08Å
3407	I	35.9	Very low	33.9	Very low	100 Å²	100	72.3 Å²	72.3	51%	0.513	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-50.5	-24.1	-178.3	-66.1	164	0	0	0	112.3	F3405 T3410	F3405-I3407 PolarHBondContact O-N 2.89Å; I3407-T3410 PolarHBondContact O-OG1 2.94Å
3408	D	34.6	Very low	33.9	Very low	57 Å²	57	74.1 Å²	74.1	31%	0.305	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-77	-16.9	-177.9	-65.2	-24.7	0	0	0	115.7	P3406 T3410 S3466	P3406-D3408 PolarHBondContact O-N 3.49Å; D3408-T3410 PolarHBondContact O-N 2.78Å; D3408-S3466 WeakPolarHBondContact CB-OG 3.4Å; D3408-S3466 WeakPolarHBondContact OD2-CB 3.31Å; D3408-S3466 PolarHBondContact OD2-OG 3.32Å
3409	M	32.5	Very low	34.2	Very low	26 Å²	26	80.3 Å²	80.3	13%	0.128	42%	0.421	C	S	.	.	G	3₁₀ helix	trans	-73.9	-18.7	176.3	-87.2	-133.7	-104.3	0	0	113	R2688 L2697 I3321 L3325 F3405 P3406 L3469	R2688-M3409 PolarHBondContact NH2-O 3.36Å; L2697-M3409 HydrophobicContact CD2-CE 4.08Å; I3321-M3409 HydrophobicContact CG2-CE 4.06Å; L3325-M3409 HydrophobicContact CD1-CE 3.93Å; F3405-M3409 HydrophobicContact CD1-CB 4.06Å; F3405-M3409 HydrophobicContact CD1-CE 3.67Å; F3405-M3409 HydrophobicContact CD1-SD 4.34Å; F3405-M3409 HydrophobicContact CE1-CE 3.75Å; F3405-M3409 HydrophobicContact CE1-SD 4.44Å; P3406-M3409 PolarHBondContact O-N 3.09Å; P3406-M3409 VanDerWaalsContact O-N 3.08Å; M3409-L3469 HydrophobicContact CE-CD1 4.08Å; M3409-L3469 HydrophobicContact SD-CD1 3.83Å
3410	T	32.6	Very low	34.5	Very low	45 Å²	45	78.1 Å²	78.1	28%	0.276	41%	0.414	S	S	.	.			trans	-98.7	82.2	173.1	53.3	0	0	0	0	109.5	S2728 I3407 D3408 I3412	S2728-T3410 WeakPolarHBondContact OG-CG2 3.44Å; I3407-T3410 PolarHBondContact O-OG1 2.94Å; D3408-T3410 PolarHBondContact O-N 2.78Å; T3410-I3412 PolarHBondContact O-N 3.13Å
3411	S	27	Very low	35.2	Very low	104 Å²	104	80.6 Å²	80.6	73%	0.727	43%	0.425	S	S	*	.			trans	-66	19.8	166.2	-29	0	0	0	0	113
3412	I	27.5	Very low	36.1	Very low	108 Å²	108	81 Å²	81	55%	0.554	43%	0.433	S	S	*	.	S	Bend	trans	-90.6	112.7	174	-57.7	176	0	0	0	105.5	T3410 S3414	T3410-I3412 PolarHBondContact O-N 3.13Å; I3412-S3414 PolarHBondContact O-N 3.05Å
3413	H	26.2	Very low	36.9	Very low	166 Å²	166	83.3 Å²	83.3	77%	0.769	44%	0.438	S	S	*	.			trans	-53.8	85.2	170.5	-74.1	-82.1	0	0	0	110.6	F3415	H3413-F3415 HydrophobicContact CB-CD2 4.33Å; H3413-F3415 HydrophobicContact CB-CE2 4.04Å; H3413-F3415 WeakPolarHBondContact O-CD2 3.17Å; H3413-F3415 PolarHBondContact O-N 2.95Å; H3413-F3415 VanDerWaalsContact O-N 3.15Å
3414	S	29.9	Very low	37.8	Very low	53 Å²	53	84.8 Å²	84.8	37%	0.371	44%	0.435	S	S	.	.			trans	-70.7	106.4	169.3	63.7	0	0	0	0	107.5	I3412 D3416	I3412-S3414 PolarHBondContact O-N 3.05Å; S3414-D3416 PolarHBondContact O-N 3.11Å
3415	F	28.5	Very low	38.9	Very low	178 Å²	178	89.5 Å²	89.5	78%	0.781	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-1.3	-174.9	-91	-87.2	0	0	0	115	H3413 R3417	H3413-F3415 HydrophobicContact CB-CD2 4.33Å; H3413-F3415 HydrophobicContact CB-CE2 4.04Å; H3413-F3415 WeakPolarHBondContact O-CD2 3.17Å; H3413-F3415 PolarHBondContact O-N 2.95Å; H3413-F3415 VanDerWaalsContact O-N 3.15Å; F3415-R3417 PolarHBondContact O-N 2.77Å
3416	D	33	Very low	39.9	Very low	98 Å²	98	93 Å²	93	52%	0.524	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	20.1	-176.6	-85.1	-14.1	0	0	0	115.6	S3414 T3418	S3414-D3416 PolarHBondContact O-N 3.11Å; D3416-T3418 PolarHBondContact O-N 3.25Å; D3416-T3418 VanDerWaalsContact O-N 3.12Å
3417	R	34.7	Very low	41.3	Very low	110 Å²	110	92.7 Å²	92.7	42%	0.415	47%	0.472	S	S	.	.	H	α-helix	trans	-62.8	-13.6	170.4	-79.1	-176.4	-179.3	-158.3	-0.8	113.2	F3415 Q3421	F3415-R3417 PolarHBondContact O-N 2.77Å; R3417-Q3421 HydrophobicContact CB-CG 4.18Å; R3417-Q3421 WeakPolarHBondContact O-CB 3.49Å; R3417-Q3421 WeakPolarHBondContact O-CG 3.39Å; R3417-Q3421 PolarHBondContact O-N 3.08Å
3418	T	35.6	Very low	42.7	Very low	101 Å²	101	91.4 Å²	91.4	62%	0.62	47%	0.472	S	S	*	.	H	α-helix	trans	-71.2	-37.5	-167.6	57.3	0	0	0	0	114.8	D3416	D3416-T3418 PolarHBondContact O-N 3.25Å; D3416-T3418 VanDerWaalsContact O-N 3.12Å
3419	H	40	Very low	44.4	Very low	142 Å²	142	94.4 Å²	94.4	66%	0.657	48%	0.482	S	S	*	.	H	α-helix	trans	-86.7	-35.5	-178.6	-78.2	-17.6	0	0	0	114.1
3420	N	46.1	Very low	46.1	Very low	62 Å²	62	96 Å²	96	33%	0.332	49%	0.488	S	S	.	.	H	α-helix	trans	-77.4	-27.6	178.5	-75.9	-16.3	0	0	0	113.4	G3422 K3424	N3420-G3422 PolarHBondContact O-N 3.48Å; N3420-K3424 WeakPolarHBondContact O-CG 3.46Å; N3420-K3424 PolarHBondContact O-N 3.49Å
3421	Q	49.3	Very low	47.8	Very low	83 Å²	83	96 Å²	96	39%	0.388	49%	0.485	S	S	.	.	H	α-helix	trans	-68.6	-34.3	-177.2	-82.1	-176.4	-14.7	0	0	113.2	R3417 Y3423 Q3425	R3417-Q3421 HydrophobicContact CB-CG 4.18Å; R3417-Q3421 WeakPolarHBondContact O-CB 3.49Å; R3417-Q3421 WeakPolarHBondContact O-CG 3.39Å; R3417-Q3421 PolarHBondContact O-N 3.08Å; Q3421-Y3423 PolarHBondContact O-N 3.21Å; Q3421-Q3425 WeakPolarHBondContact O-CB 3.41Å; Q3421-Q3425 WeakPolarHBondContact O-CG 3.47Å; Q3421-Q3425 PolarHBondContact O-N 3.37Å
3422	G	53.8	Low	50.2	Low	34 Å²	34	94.3 Å²	94.3	35%	0.351	47%	0.466	S	S	.	.	H	α-helix	trans	-59.5	-47	-177.2	0	0	0	0	0	113.1	N3420 L3426	N3420-G3422 PolarHBondContact O-N 3.48Å; G3422-L3426 WeakPolarHBondContact O-CG 3.29Å; G3422-L3426 PolarHBondContact O-N 3.37Å
3423	Y	54.9	Low	52.7	Low	110 Å²	110	89.4 Å²	89.4	43%	0.431	44%	0.441	S	S	.	.	H	α-helix	trans	-79.3	-40.5	-178.7	-53.6	-77.2	0	0	0	113	T3386 Q3421 Q3425 L3426 N3427	T3386-Y3423 HydrophobicContact CG2-CD1 4.11Å; T3386-Y3423 HydrophobicContact CG2-CG 4.43Å; T3386-Y3423 WeakPolarHBondContact OG1-CB 3.26Å; Q3421-Y3423 PolarHBondContact O-N 3.21Å; Y3423-Q3425 PolarHBondContact O-N 3.2Å; Y3423-L3426 HydrophobicContact CD1-CD1 4.17Å; Y3423-L3426 CarbonylContact O-C 3.51Å; Y3423-L3426 WeakPolarHBondContact O-CA 3.38Å; Y3423-L3426 WeakPolarHBondContact O-CB 3.41Å; Y3423-L3426 PolarHBondContact O-N 2.95Å; Y3423-N3427 PolarHBondContact O-N 3.34Å
3424	K	56.1	Low	55.4	Low	129 Å²	129	82.3 Å²	82.3	56%	0.561	41%	0.409	S	S	*	.	H	α-helix	trans	-58.6	-37.3	171.1	-71.9	-173.4	177.2	-171.6	0	111	N3420 S3428	N3420-K3424 WeakPolarHBondContact O-CG 3.46Å; N3420-K3424 PolarHBondContact O-N 3.49Å; K3424-S3428 WeakPolarHBondContact O-CB 3.4Å; K3424-S3428 PolarHBondContact O-N 3.24Å
3425	Q	61.5	Low	57.8	Low	101 Å²	101	82.5 Å²	82.5	47%	0.472	41%	0.405	S	S	.	.	H	α-helix	trans	-68.4	-35.5	170.7	-76.7	176.6	9.2	0	0	112.8	Q3421 Y3423 K3429	Q3421-Q3425 WeakPolarHBondContact O-CB 3.41Å; Q3421-Q3425 WeakPolarHBondContact O-CG 3.47Å; Q3421-Q3425 PolarHBondContact O-N 3.37Å; Y3423-Q3425 PolarHBondContact O-N 3.2Å; Q3425-K3429 VanDerWaalsContact O-CB 3.25Å; Q3425-K3429 WeakPolarHBondContact O-CB 3.36Å; Q3425-K3429 WeakPolarHBondContact O-CG 3.41Å; Q3425-K3429 PolarHBondContact O-N 3.07Å
3426	L	63.2	Low	60.1	Low	100 Å²	100	74.7 Å²	74.7	52%	0.524	37%	0.372	S	S	.	.	H	α-helix	trans	-67	-49.6	174.7	-78.6	166.2	0	0	0	111.9	G3422 Y3423 S3428 K3429 F3430	G3422-L3426 WeakPolarHBondContact O-CG 3.29Å; G3422-L3426 PolarHBondContact O-N 3.37Å; Y3423-L3426 HydrophobicContact CD1-CD1 4.17Å; Y3423-L3426 CarbonylContact O-C 3.51Å; Y3423-L3426 WeakPolarHBondContact O-CA 3.38Å; Y3423-L3426 WeakPolarHBondContact O-CB 3.41Å; Y3423-L3426 PolarHBondContact O-N 2.95Å; L3426-S3428 VanDerWaalsContact C-N 3.34Å; L3426-S3428 PolarHBondContact O-N 3.5Å; L3426-K3429 CarbonylContact O-C 3.51Å; L3426-K3429 WeakPolarHBondContact O-CB 3.46Å; L3426-K3429 PolarHBondContact O-N 2.71Å; L3426-K3429 VanDerWaalsContact O-N 3.14Å; L3426-F3430 WeakPolarHBondContact O-CB 3.35Å; L3426-F3430 PolarHBondContact O-N 2.97Å
3427	N	64.2	Low	61.7	Low	40 Å²	40	74.3 Å²	74.3	21%	0.214	37%	0.365	C	S	.	.	H	α-helix	trans	-58.8	-47	173.4	-74.5	-7.9	0	0	0	110.4	F3384 Y3423 K3429 F3430 E3431	F3384-N3427 PolarHBondContact O-ND2 3.02Å; Y3423-N3427 PolarHBondContact O-N 3.34Å; N3427-K3429 VanDerWaalsContact C-N 3.31Å; N3427-K3429 PolarHBondContact O-N 2.85Å; N3427-F3430 PolarHBondContact O-N 2.86Å; N3427-F3430 VanDerWaalsContact O-N 3.09Å; N3427-E3431 VanDerWaalsContact O-CB 3.29Å; N3427-E3431 WeakPolarHBondContact O-CB 3.35Å; N3427-E3431 VanDerWaalsContact O-CG 3.32Å; N3427-E3431 WeakPolarHBondContact O-CG 3.35Å; N3427-E3431 PolarHBondContact O-N 2.84Å
3428	S	66.5	Low	62.8	Low	73 Å²	73	71.2 Å²	71.2	51%	0.51	36%	0.36	S	S	.	.	H	α-helix	trans	-56.8	-43.7	173.9	173	0	0	0	0	111.7	K3424 L3426 H3432	K3424-S3428 WeakPolarHBondContact O-CB 3.4Å; K3424-S3428 PolarHBondContact O-N 3.24Å; L3426-S3428 VanDerWaalsContact C-N 3.34Å; L3426-S3428 PolarHBondContact O-N 3.5Å; S3428-H3432 WeakPolarHBondContact O-CB 3.24Å; S3428-H3432 PolarHBondContact O-N 3.43Å
3429	K	69.6	Low	63.7	Low	120 Å²	120	70.4 Å²	70.4	52%	0.522	35%	0.352	S	S	.	.	H	α-helix	trans	-66.9	-34.5	175.5	-79.7	173.8	-179.2	178.9	0	113.1	Q3425 L3426 N3427	Q3425-K3429 VanDerWaalsContact O-CB 3.25Å; Q3425-K3429 WeakPolarHBondContact O-CB 3.36Å; Q3425-K3429 WeakPolarHBondContact O-CG 3.41Å; Q3425-K3429 PolarHBondContact O-N 3.07Å; L3426-K3429 CarbonylContact O-C 3.51Å; L3426-K3429 WeakPolarHBondContact O-CB 3.46Å; L3426-K3429 PolarHBondContact O-N 2.71Å; L3426-K3429 VanDerWaalsContact O-N 3.14Å; N3427-K3429 VanDerWaalsContact C-N 3.31Å; N3427-K3429 PolarHBondContact O-N 2.85Å
3430	F	67.9	Low	64.2	Low	58 Å²	58	70.8 Å²	70.8	25%	0.254	36%	0.355	S	S	.	.	H	α-helix	trans	-73.3	-46.3	179.9	-175.6	-106.9	0	0	0	111.1	L3381 L3426 N3427 H3432	L3381-F3430 HydrophobicContact CD2-CD1 4.04Å; L3381-F3430 HydrophobicContact CD2-CE1 3.3Å; L3381-F3430 HydrophobicContact CD2-CZ 3.86Å; L3426-F3430 WeakPolarHBondContact O-CB 3.35Å; L3426-F3430 PolarHBondContact O-N 2.97Å; N3427-F3430 PolarHBondContact O-N 2.86Å; N3427-F3430 VanDerWaalsContact O-N 3.09Å; F3430-H3432 VanDerWaalsContact C-N 3.31Å; F3430-H3432 PolarHBondContact O-N 2.78Å
3431	E	68.7	Low	64.4	Low	46 Å²	46	71.6 Å²	71.6	22%	0.215	36%	0.358	C	S	.	.	H	α-helix	trans	-70.4	-24	175.6	-69.1	-178.8	-162.2	0	0	112.8	K3383 N3427 L3433	K3383-E3431 WeakPolarHBondContact CD-OE1 3.27Å; K3383-E3431 VanDerWaalsContact CG-OE1 3.32Å; K3383-E3431 WeakPolarHBondContact CG-OE1 3.3Å; K3383-E3431 IonicContact NZ-OE1 2.67Å; K3383-E3431 PolarHBondContact NZ-OE1 2.84Å; K3383-E3431 IonicContact NZ-OE2 2.83Å; K3383-E3431 PolarHBondContact NZ-OE2 3.43Å; N3427-E3431 VanDerWaalsContact O-CB 3.29Å; N3427-E3431 WeakPolarHBondContact O-CB 3.35Å; N3427-E3431 VanDerWaalsContact O-CG 3.32Å; N3427-E3431 WeakPolarHBondContact O-CG 3.35Å; N3427-E3431 PolarHBondContact O-N 2.84Å; E3431-L3433 VanDerWaalsContact C-N 3.34Å; E3431-L3433 PolarHBondContact O-N 3.19Å
3432	H	77	Confident	64.7	Low	68 Å²	68	68.3 Å²	68.3	32%	0.315	34%	0.344	S	S	.	.			trans	-69.5	92.4	175	-165.2	72.4	0	0	0	110.2	S3428 F3430 S3434 L3436	S3428-H3432 WeakPolarHBondContact O-CB 3.24Å; S3428-H3432 PolarHBondContact O-N 3.43Å; F3430-H3432 VanDerWaalsContact C-N 3.31Å; F3430-H3432 PolarHBondContact O-N 2.78Å; H3432-S3434 PolarHBondContact CD2-O 2.92Å; H3432-S3434 PolarHBondContact NE2-O 2.93Å; H3432-S3434 VanDerWaalsContact NE2-O 3.14Å; H3432-L3436 PolarHBondContact CE1-O 2.86Å; H3432-L3436 PolarHBondContact NE2-O 3.06Å
3433	L	80.2	Confident	64.4	Low	6 Å²	6	70.8 Å²	70.8	3%	0.031	35%	0.354	C	S	.	.			trans	-74.6	-31.4	179.6	-65.1	177.4	0	0	0	112.4	I3367 L3370 L3377 E3431	I3367-L3433 HydrophobicContact CG1-CD1 3.94Å; L3370-L3433 HydrophobicContact CD1-CD1 4.02Å; L3377-L3433 HydrophobicContact CD1-CD1 3.33Å; L3377-L3433 HydrophobicContact CD2-CD1 4.36Å; L3377-L3433 HydrophobicContact CG-CD1 4.47Å; E3431-L3433 VanDerWaalsContact C-N 3.34Å; E3431-L3433 PolarHBondContact O-N 3.19Å
3434	S	82.6	Confident	64.2	Low	16 Å²	16	66.4 Å²	66.4	11%	0.112	34%	0.342	C	S	.	.			trans	-65.7	142.7	-179.7	-176.4	0	0	0	0	111.4	H3432 L3436	H3432-S3434 PolarHBondContact CD2-O 2.92Å; H3432-S3434 PolarHBondContact NE2-O 2.93Å; H3432-S3434 VanDerWaalsContact NE2-O 3.14Å; S3434-L3436 VanDerWaalsContact C-N 3.25Å; S3434-L3436 PolarHBondContact OG-N 3.38Å; S3434-L3436 PolarHBondContact OG-O 2.86Å
3435	M	81.2	Confident	64.1	Low	58 Å²	58	61.9 Å²	61.9	29%	0.286	33%	0.332	S	S	.	.	S	Bend	trans	-71.3	-24.3	172	-67.6	-67.4	-167.6	0	0	112
3436	L	75.7	Confident	63.5	Low	14 Å²	14	58.1 Å²	58.1	7%	0.073	32%	0.316	C	S	.	.			trans	-99.5	143.2	-177.4	-64.9	177.8	0	0	0	111.1	H3432 S3434 L3441	H3432-L3436 PolarHBondContact CE1-O 2.86Å; H3432-L3436 PolarHBondContact NE2-O 3.06Å; S3434-L3436 VanDerWaalsContact C-N 3.25Å; S3434-L3436 PolarHBondContact OG-N 3.38Å; S3434-L3436 PolarHBondContact OG-O 2.86Å; L3436-L3441 HydrophobicContact CD2-CD1 4.05Å
3437	K	67.3	Low	62.9	Low	90 Å²	90	57.6 Å²	57.6	39%	0.391	31%	0.311	S	S	.	.			trans	-108.5	93.9	167.6	-78.3	-171.9	179.5	-178	0	108.3	N3439 Q3440	K3437-N3439 WeakPolarHBondContact CB-OD1 3.48Å; K3437-N3439 PolarHBondContact O-N 2.85Å; K3437-Q3440 PolarHBondContact O-N 2.8Å; K3437-Q3440 VanDerWaalsContact O-N 3.09Å
3438	S	56.5	Low	62.2	Low	44 Å²	44	56.1 Å²	56.1	31%	0.308	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-53.6	-38.6	-177.6	61.1	0	0	0	0	111.9	Q3440 L3441 T3442 G3448	S3438-Q3440 PolarHBondContact O-N 2.81Å; S3438-L3441 PolarHBondContact O-N 2.85Å; S3438-T3442 WeakPolarHBondContact O-CG2 3.47Å; S3438-T3442 PolarHBondContact O-N 3.13Å; S3438-G3448 CarbonylContact C-O 3.59Å; S3438-G3448 VanDerWaalsContact CB-O 3.27Å; S3438-G3448 WeakPolarHBondContact CB-O 3.32Å; S3438-G3448 PolarHBondContact OG-O 2.86Å
3439	N	54.7	Low	61.6	Low	85 Å²	85	53.5 Å²	53.5	46%	0.455	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-57.5	-20.9	179.7	66.6	-10.7	0	0	0	116.1	K3437 H3447	K3437-N3439 WeakPolarHBondContact CB-OD1 3.48Å; K3437-N3439 PolarHBondContact O-N 2.85Å; N3439-H3447 VanDerWaalsContact CA-C 3.41Å; N3439-H3447 WeakPolarHBondContact CA-O 3.29Å; N3439-H3447 HydrophobicContact CB-CB 3.97Å; N3439-H3447 WeakPolarHBondContact CB-O 3.11Å; N3439-H3447 PolarHBondContact N-O 2.98Å
3440	Q	51.9	Low	60.8	Low	150 Å²	150	47.8 Å²	47.8	70%	0.701	26%	0.262	S	S	*	.	G	3₁₀ helix	trans	-101.2	-8.2	178.3	-66	-171.2	-27	0	0	113.4	K3437 S3438	K3437-Q3440 PolarHBondContact O-N 2.8Å; K3437-Q3440 VanDerWaalsContact O-N 3.09Å; S3438-Q3440 PolarHBondContact O-N 2.81Å
3441	L	50	Low	60.4	Low	79 Å²	79	45.4 Å²	45.4	41%	0.414	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.8	-21.1	-168.2	-63.6	173.6	0	0	0	113.8	L3436 S3438	L3436-L3441 HydrophobicContact CD2-CD1 4.05Å; S3438-L3441 PolarHBondContact O-N 2.85Å
3442	T	54.5	Low	60.1	Low	14 Å²	14	43.9 Å²	43.9	9%	0.086	25%	0.246	C	C	.	.			trans	-114.3	133.1	-173.4	94.3	0	0	0	0	112.7	S3438 G3444 G3448	S3438-T3442 WeakPolarHBondContact O-CG2 3.47Å; S3438-T3442 PolarHBondContact O-N 3.13Å; T3442-G3444 PolarHBondContact O-N 2.87Å; T3442-G3448 WeakPolarHBondContact CG2-O 3.36Å; T3442-G3448 WeakPolarHBondContact OG1-CA 3.4Å; T3442-G3448 PolarHBondContact OG1-O 3.32Å
3443	P	47.6	Very low	59.1	Low	85 Å²	85	42.4 Å²	42.4	55%	0.552	24%	0.244	S	C	*	.	S	Bend	trans	-84.2	107.6	168.6	30.8	-28.1	0	0	0	109.1
3444	G	50.6	Low	58.3	Low	19 Å²	19	43 Å²	43	20%	0.196	25%	0.246	C	C	.	.	S	Bend	trans	141.9	134.4	170.7	0	0	0	0	0	113.5	T3442 S3449 G3450	T3442-G3444 PolarHBondContact O-N 2.87Å; G3444-S3449 PolarHBondContact O-N 3.11Å; G3444-G3450 WeakPolarHBondContact O-CA 3.29Å; G3444-G3450 PolarHBondContact O-N 2.89Å
3445	G	55	Low	57.3	Low	33 Å²	33	42.3 Å²	42.3	34%	0.34	24%	0.241	S	C	.	.	S	Bend	trans	76.1	161.2	178.4	0	0	0	0	0	114.7	G3448 L3451	G3445-G3448 PolarHBondContact O-N 2.86Å; G3445-L3451 WeakPolarHBondContact CA-O 3.23Å
3446	P	48.9	Very low	56.2	Low	22 Å²	22	40.8 Å²	40.8	14%	0.143	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-57.4	141.6	172.6	-21.1	33.5	0	0	0	110.5	G3448 S3449 L3451 L3456 V3461 D3463	P3446-G3448 PolarHBondContact O-N 2.81Å; P3446-S3449 PolarHBondContact O-N 2.89Å; P3446-S3449 PolarHBondContact O-OG 2.9Å; P3446-L3451 WeakPolarHBondContact CD-O 3.5Å; P3446-L3456 HydrophobicContact CB-CD1 3.61Å; P3446-L3456 HydrophobicContact CG-CD1 3.56Å; P3446-V3461 HydrophobicContact CB-CG1 3.88Å; P3446-D3463 VanDerWaalsContact CB-OD1 3.23Å; P3446-D3463 WeakPolarHBondContact CB-OD1 3.38Å; P3446-D3463 WeakPolarHBondContact CG-OD1 3.29Å
3447	H	49.6	Very low	55.2	Low	90 Å²	90	42.5 Å²	42.5	42%	0.417	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	52.4	37.1	-177.5	-50.1	-67.1	0	0	0	113.9	N3439 S3449 D3460	N3439-H3447 VanDerWaalsContact CA-C 3.41Å; N3439-H3447 WeakPolarHBondContact CA-O 3.29Å; N3439-H3447 HydrophobicContact CB-CB 3.97Å; N3439-H3447 WeakPolarHBondContact CB-O 3.11Å; N3439-H3447 PolarHBondContact N-O 2.98Å; H3447-S3449 PolarHBondContact O-N 3.46Å; H3447-D3460 PolarHBondContact NE2-O 2.81Å
3448	G	50	Low	54.4	Low	9 Å²	9	40.3 Å²	40.3	9%	0.093	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	43.9	46	177.3	0	0	0	0	0	112.8	S3438 T3442 G3445 P3446	S3438-G3448 CarbonylContact C-O 3.59Å; S3438-G3448 VanDerWaalsContact CB-O 3.27Å; S3438-G3448 WeakPolarHBondContact CB-O 3.32Å; S3438-G3448 PolarHBondContact OG-O 2.86Å; T3442-G3448 WeakPolarHBondContact CG2-O 3.36Å; T3442-G3448 WeakPolarHBondContact OG1-CA 3.4Å; T3442-G3448 PolarHBondContact OG1-O 3.32Å; G3445-G3448 PolarHBondContact O-N 2.86Å; P3446-G3448 PolarHBondContact O-N 2.81Å
3449	S	53.5	Low	53.9	Low	18 Å²	18	41.4 Å²	41.4	13%	0.126	24%	0.244	C	C	.	.			trans	-90.2	-13.8	178.3	54.8	0	0	0	0	112.3	G3444 P3446 H3447 L3451	G3444-S3449 PolarHBondContact O-N 3.11Å; P3446-S3449 PolarHBondContact O-N 2.89Å; P3446-S3449 PolarHBondContact O-OG 2.9Å; H3447-S3449 PolarHBondContact O-N 3.46Å; S3449-L3451 PolarHBondContact O-N 3.1Å; S3449-L3451 VanDerWaalsContact O-N 3.17Å; S3449-L3451 WeakPolarHBondContact OG-CB 3.31Å; S3449-L3451 PolarHBondContact OG-N 2.84Å
3450	G	53.5	Low	53.3	Low	0 Å²	0	40.7 Å²	40.7	0%	0	24%	0.24	C	C	.	.	S	Bend	trans	69.3	-8.3	-163.3	0	0	0	0	0	113.5	G3444	G3444-G3450 WeakPolarHBondContact O-CA 3.29Å; G3444-G3450 PolarHBondContact O-N 2.89Å
3451	L	59.5	Low	52.8	Low	7 Å²	7	34.8 Å²	34.8	4%	0.037	21%	0.214	C	C	.	.			trans	-82.9	131.3	-175.8	-57.9	175.2	0	0	0	109.8	T3364 G3445 P3446 S3449 L3455 L3456	T3364-L3451 HydrophobicContact CG2-CD1 3.67Å; G3445-L3451 WeakPolarHBondContact CA-O 3.23Å; P3446-L3451 WeakPolarHBondContact CD-O 3.5Å; S3449-L3451 PolarHBondContact O-N 3.1Å; S3449-L3451 VanDerWaalsContact O-N 3.17Å; S3449-L3451 WeakPolarHBondContact OG-CB 3.31Å; S3449-L3451 PolarHBondContact OG-N 2.84Å; L3451-L3455 HydrophobicContact CB-CB 4.41Å; L3451-L3455 HydrophobicContact CD2-CD1 4.05Å; L3451-L3456 HydrophobicContact CB-CD2 4.29Å; L3451-L3456 HydrophobicContact CD1-CD2 4.01Å
3452	S	61.3	Low	52.1	Low	14 Å²	14	35.1 Å²	35.1	10%	0.098	22%	0.217	C	C	.	.			trans	-57	144.9	168	-76.9	0	0	0	0	109.7	Y2601 F3454 L3455	Y2601-S3452 WeakPolarHBondContact CE1-OG 3.17Å; Y2601-S3452 PolarHBondContact OH-OG 2.95Å; S3452-F3454 PolarHBondContact O-N 3Å; S3452-L3455 PolarHBondContact O-N 3.42Å
3453	S	57.7	Low	51.3	Low	38 Å²	38	35.8 Å²	35.8	27%	0.266	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-54.1	-25.4	174.8	55	0	0	0	0	112.7	L3455 L3456	S3453-L3455 PolarHBondContact O-N 3.27Å; S3453-L3456 PolarHBondContact O-N 3.5Å; S3453-L3456 VanDerWaalsContact O-N 3.17Å
3454	F	63.2	Low	50.7	Low	18 Å²	18	41.3 Å²	41.3	8%	0.079	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-50.9	-34.9	168.4	174.8	-99.3	0	0	0	114.7	L2607 A2610 L2612 L2619 F2621 R3330 F3356 S3452	L2607-F3454 HydrophobicContact CD2-CB 3.83Å; L2607-F3454 HydrophobicContact CD2-CD1 4.38Å; L2607-F3454 HydrophobicContact CD2-CD2 4.49Å; L2607-F3454 HydrophobicContact CD2-CG 3.97Å; A2610-F3454 HydrophobicContact CB-CE1 4.27Å; A2610-F3454 HydrophobicContact CB-CZ 4.48Å; L2612-F3454 HydrophobicContact CD1-CZ 4.24Å; L2612-F3454 HydrophobicContact CD2-CE1 3.99Å; L2612-F3454 HydrophobicContact CD2-CZ 4.08Å; L2619-F3454 HydrophobicContact CD2-CD2 3.91Å; L2619-F3454 HydrophobicContact CD2-CE2 3.18Å; L2619-F3454 HydrophobicContact CD2-CZ 3.87Å; F2621-F3454 HydrophobicContact CZ-CD2 4.31Å; R3330-F3454 HydrophobicContact CB-CD2 4.29Å; R3330-F3454 HydrophobicContact CB-CE2 4.32Å; R3330-F3454 HydrophobicContact CG-CD2 4.12Å; R3330-F3454 HydrophobicContact CG-CE2 3.7Å; F3356-F3454 HydrophobicContact CE1-CE1 4.34Å; F3356-F3454 HydrophobicContact CZ-CE1 4.05Å; S3452-F3454 PolarHBondContact O-N 3Å
3455	L	60.8	Low	50.1	Low	2 Å²	2	43.9 Å²	43.9	1%	0.01	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-95	-2.4	-178	-66.3	178.2	0	0	0	113.8	F3356 R3360 M3363 L3451 S3452 S3453	F3356-L3455 HydrophobicContact CE1-CD2 4.18Å; F3356-L3455 HydrophobicContact CE2-CD2 4.46Å; F3356-L3455 HydrophobicContact CZ-CD2 3.53Å; R3360-L3455 WeakPolarHBondContact CD-O 3.32Å; M3363-L3455 HydrophobicContact CE-CD1 4.26Å; M3363-L3455 HydrophobicContact CE-CD2 4.19Å; L3451-L3455 HydrophobicContact CB-CB 4.41Å; L3451-L3455 HydrophobicContact CD2-CD1 4.05Å; S3452-L3455 PolarHBondContact O-N 3.42Å; S3453-L3455 PolarHBondContact O-N 3.27Å
3456	L	58.4	Low	49.8	Very low	25 Å²	25	44.5 Å²	44.5	13%	0.131	25%	0.245	C	C	.	.	S	Bend	trans	-95.4	137.9	179.5	-63.4	175.8	0	0	0	109.2	T3364 P3446 L3451 S3453 V3461	T3364-L3456 HydrophobicContact CG2-CD2 4.42Å; P3446-L3456 HydrophobicContact CB-CD1 3.61Å; P3446-L3456 HydrophobicContact CG-CD1 3.56Å; L3451-L3456 HydrophobicContact CB-CD2 4.29Å; L3451-L3456 HydrophobicContact CD1-CD2 4.01Å; S3453-L3456 PolarHBondContact O-N 3.5Å; S3453-L3456 VanDerWaalsContact O-N 3.17Å; L3456-V3461 HydrophobicContact CB-CG2 4.27Å
3457	D	53.8	Low	50.3	Low	51 Å²	51	44.5 Å²	44.5	27%	0.273	24%	0.244	S	C	.	.			trans	-68	136.5	170.2	-177.2	9.7	0	0	0	108.5	T3459 D3460	D3457-T3459 VanDerWaalsContact CG-OG1 3.28Å; D3457-T3459 PolarHBondContact O-N 3.47Å; D3457-T3459 PolarHBondContact OD2-OG1 2.96Å; D3457-D3460 PolarHBondContact O-N 3.21Å
3458	S	50.6	Low	51	Low	44 Å²	44	42.9 Å²	42.9	31%	0.308	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-51.8	-21.5	176.4	61.5	0	0	0	0	114	S3326	S3326-S3458 WeakPolarHBondContact OG-CB 3.34Å
3459	T	45.8	Very low	52.3	Low	66 Å²	66	43.2 Å²	43.2	41%	0.405	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-74.6	-19.9	177.2	65.2	0	0	0	0	114.1	D3457	D3457-T3459 VanDerWaalsContact CG-OG1 3.28Å; D3457-T3459 PolarHBondContact O-N 3.47Å; D3457-T3459 PolarHBondContact OD2-OG1 2.96Å
3460	D	42.7	Very low	53.3	Low	70 Å²	70	42.9 Å²	42.9	37%	0.374	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-89.8	4.1	-172.9	-88.4	-32.8	0	0	0	114.8	K3395 H3447 D3457	K3395-D3460 IonicContact NZ-OD1 2.74Å; K3395-D3460 PolarHBondContact NZ-OD1 2.75Å; K3395-D3460 IonicContact NZ-OD2 3.36Å; K3395-D3460 PolarHBondContact NZ-OD2 2.79Å; H3447-D3460 PolarHBondContact NE2-O 2.81Å; D3457-D3460 PolarHBondContact O-N 3.21Å
3461	V	41.4	Very low	54.3	Low	26 Å²	26	45.8 Å²	45.8	16%	0.158	26%	0.257	C	S	.	.			trans	-138.7	126.9	-163	-136	0	0	0	0	116.4	P3446 L3456 D3463	P3446-V3461 HydrophobicContact CB-CG1 3.88Å; L3456-V3461 HydrophobicContact CB-CG2 4.27Å; V3461-D3463 HydrophobicContact CB-CB 3.59Å; V3461-D3463 VanDerWaalsContact CB-CG 3.47Å; V3461-D3463 HydrophobicContact CG1-CB 3.5Å; V3461-D3463 WeakPolarHBondContact CG1-OD1 3.38Å; V3461-D3463 WeakPolarHBondContact CG1-OD2 3.42Å; V3461-D3463 HydrophobicContact CG2-CB 4.44Å; V3461-D3463 WeakPolarHBondContact CG2-OD2 3.35Å; V3461-D3463 PolarHBondContact O-N 2.59Å; V3461-D3463 VanDerWaalsContact O-N 3.16Å
3462	N	36.4	Very low	55.2	Low	87 Å²	87	47 Å²	47	47%	0.465	27%	0.266	S	S	.	.			trans	-73.9	53.7	146.3	-68.1	-66.9	0	0	0	108.1	E3464	N3462-E3464 PolarHBondContact O-N 3.34Å; N3462-E3464 VanDerWaalsContact O-N 3.12Å
3463	D	38.1	Very low	56.3	Low	27 Å²	27	48.5 Å²	48.5	14%	0.144	27%	0.273	C	S	.	.			trans	-70.6	111.7	-170.5	-114.8	-22	0	0	0	109.4	P3446 V3461 M3465 S3466	P3446-D3463 VanDerWaalsContact CB-OD1 3.23Å; P3446-D3463 WeakPolarHBondContact CB-OD1 3.38Å; P3446-D3463 WeakPolarHBondContact CG-OD1 3.29Å; V3461-D3463 HydrophobicContact CB-CB 3.59Å; V3461-D3463 VanDerWaalsContact CB-CG 3.47Å; V3461-D3463 HydrophobicContact CG1-CB 3.5Å; V3461-D3463 WeakPolarHBondContact CG1-OD1 3.38Å; V3461-D3463 WeakPolarHBondContact CG1-OD2 3.42Å; V3461-D3463 HydrophobicContact CG2-CB 4.44Å; V3461-D3463 WeakPolarHBondContact CG2-OD2 3.35Å; V3461-D3463 PolarHBondContact O-N 2.59Å; V3461-D3463 VanDerWaalsContact O-N 3.16Å; D3463-M3465 PolarHBondContact O-N 2.96Å; D3463-S3466 PolarHBondContact O-N 3.33Å; D3463-S3466 PolarHBondContact O-OG 3.14Å
3464	E	33.7	Very low	57.6	Low	201 Å²	201	48.9 Å²	48.9	94%	0.939	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	0	161.5	-68.7	-172.3	157.2	0	0	112.6	N3462	N3462-E3464 PolarHBondContact O-N 3.34Å; N3462-E3464 VanDerWaalsContact O-N 3.12Å
3465	M	37.6	Very low	58.7	Low	74 Å²	74	48.1 Å²	48.1	37%	0.365	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.8	32.5	172.2	-148.2	139.9	68.2	0	0	113.6	K3329 D3463	K3329-M3465 WeakPolarHBondContact CE-O 3.47Å; K3329-M3465 PolarHBondContact NZ-O 3.22Å; D3463-M3465 PolarHBondContact O-N 2.96Å
3466	S	50	Low	59.9	Low	45 Å²	45	48.1 Å²	48.1	32%	0.315	27%	0.27	S	S	.	.	S	Bend	trans	-51.8	146.5	145.8	49.6	0	0	0	0	108.1	K3329 D3408 D3463 P3468	K3329-S3466 PolarHBondContact NZ-O 3.16Å; D3408-S3466 WeakPolarHBondContact CB-OG 3.4Å; D3408-S3466 WeakPolarHBondContact OD2-CB 3.31Å; D3408-S3466 PolarHBondContact OD2-OG 3.32Å; D3463-S3466 PolarHBondContact O-N 3.33Å; D3463-S3466 PolarHBondContact O-OG 3.14Å; S3466-P3468 WeakPolarHBondContact O-CD 3.41Å; S3466-P3468 VanDerWaalsContact O-N 3.11Å
3467	L	57.7	Low	60.7	Low	22 Å²	22	47.3 Å²	47.3	12%	0.115	27%	0.267	C	S	.	.			trans	-72.5	105.4	173.5	-157.1	87.1	0	0	0	104.7	L2645 Y2647 L2673 I3328 K3329 L3469	L2645-L3467 HydrophobicContact CD2-CD1 4.45Å; L2645-L3467 HydrophobicContact CD2-CD2 4.33Å; Y2647-L3467 HydrophobicContact CE1-CD1 4.48Å; L2673-L3467 HydrophobicContact CB-CD2 3.42Å; L2673-L3467 VanDerWaalsContact CB-CD2 3.42Å; L2673-L3467 HydrophobicContact CB-CG 4.06Å; L2673-L3467 HydrophobicContact CD1-CD2 3.78Å; L2673-L3467 HydrophobicContact CD2-CD2 3.3Å; L2673-L3467 HydrophobicContact CG-CD2 3.63Å; I3328-L3467 HydrophobicContact CG2-CD2 4.37Å; K3329-L3467 HydrophobicContact CD-CB 4.41Å; K3329-L3467 HydrophobicContact CD-CD1 3.93Å; K3329-L3467 HydrophobicContact CG-CB 4.22Å; K3329-L3467 HydrophobicContact CG-CD1 3.65Å; K3329-L3467 HydrophobicContact CG-CG 4.43Å; L3467-L3469 PolarHBondContact O-N 2.74Å; L3467-L3469 VanDerWaalsContact O-N 3.09Å
3468	P	65.3	Low	61.6	Low	56 Å²	56	50.2 Å²	50.2	36%	0.364	29%	0.289	S	S	.	.			trans	-61.6	125.4	179.8	27.1	-33.3	0	0	0	106.8	G2672 L2673 S3466	G2672-P3468 CarbonylContact C-O 3.55Å; G2672-P3468 WeakPolarHBondContact CA-O 3.5Å; L2673-P3468 PolarHBondContact N-O 3.36Å; S3466-P3468 WeakPolarHBondContact O-CD 3.41Å; S3466-P3468 VanDerWaalsContact O-N 3.11Å
3469	L	76.4	Confident	62.7	Low	17 Å²	17	52.5 Å²	52.5	9%	0.089	30%	0.295	C	S	.	.	B	Isolated β-bridge	trans	-65.2	161	168.8	-71.5	179	0	0	0	109.2	L2673 F2686 L2697 L3325 M3409 L3467	L2673-L3469 HydrophobicContact CB-CD2 4.4Å; L2673-L3469 HydrophobicContact CD2-CD2 4.39Å; F2686-L3469 HydrophobicContact CB-CD2 4.15Å; F2686-L3469 HydrophobicContact CD1-CD2 4.23Å; F2686-L3469 HydrophobicContact CD2-CD2 4.02Å; F2686-L3469 HydrophobicContact CG-CD2 3.85Å; L2697-L3469 HydrophobicContact CD1-CD1 3.81Å; L2697-L3469 HydrophobicContact CD2-CD1 4.2Å; L3325-L3469 HydrophobicContact CD1-CD1 4.14Å; M3409-L3469 HydrophobicContact CE-CD1 4.08Å; M3409-L3469 HydrophobicContact SD-CD1 3.83Å; L3467-L3469 PolarHBondContact O-N 2.74Å; L3467-L3469 VanDerWaalsContact O-N 3.09Å
3470	S	75.2	Confident	64.5	Low	11 Å²	11	50 Å²	50	8%	0.077	28%	0.279	C	S	.	.			trans	-44.1	144.8	177	69.2	0	0	0	0	112	L2673 R2688	L2673-S3470 PolarHBondContact O-N 3.31Å; R2688-S3470 WeakPolarHBondContact CD-O 3.44Å; R2688-S3470 PolarHBondContact NH1-O 3.46Å
3471	P	74	Confident	66.4	Low	60 Å²	60	48.7 Å²	48.7	39%	0.39	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-56.7	145.4	174.5	24.6	-32.4	0	0	0	110.1	S2648	S2648-P3471 VanDerWaalsContact OG-CD 3.31Å; S2648-P3471 WeakPolarHBondContact OG-CD 3.21Å
3472	P	79.3	Confident	68.5	Low	33 Å²	33	50.5 Å²	50.5	21%	0.214	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-74.8	142.7	-178.3	28.7	-32	0	0	0	111.7	R2688 N2690 T3474	R2688-P3472 HydrophobicContact CB-CB 3.83Å; R2688-P3472 WeakPolarHBondContact O-CA 3.34Å; N2690-P3472 HydrophobicContact CB-CB 3.96Å; N2690-P3472 HydrophobicContact CB-CG 4.19Å; N2690-P3472 WeakPolarHBondContact ND2-CG 3.44Å; N2690-P3472 WeakPolarHBondContact OD1-CB 3.19Å; N2690-P3472 WeakPolarHBondContact OD1-CG 3.49Å; P3472-T3474 PolarHBondContact O-N 3.31Å
3473	N	83.6	Confident	70.7	Confident	46 Å²	46	49.8 Å²	49.8	25%	0.246	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-66.3	126.5	167.5	-66.3	-20.2	0	0	0	109.5	R2688 I2689 N2690 Y3614	R2688-N3473 PolarHBondContact O-N 2.94Å; I2689-N3473 WeakPolarHBondContact CA-O 3.26Å; I2689-N3473 HydrophobicContact CG1-CB 4.4Å; N2690-N3473 PolarHBondContact N-O 2.79Å; N3473-Y3614 HydrophobicContact CB-CD2 4.08Å
3474	T	85	Confident	72.7	Confident	46 Å²	46	49.5 Å²	49.5	28%	0.282	28%	0.278	S	S	.	.			trans	-118	155.5	177.8	56.4	0	0	0	0	110.9	N2690 P3472 F3476 R3613	N2690-T3474 HydrophobicContact CB-CG2 4.06Å; P3472-T3474 PolarHBondContact O-N 3.31Å; T3474-F3476 VanDerWaalsContact CB-O 3.32Å; T3474-F3476 WeakPolarHBondContact CB-O 3.46Å; T3474-F3476 PolarHBondContact OG1-O 2.79Å; T3474-R3613 PolarHBondContact O-NH1 3.31Å
3475	M	87.9	Confident	74.7	Confident	2 Å²	2	41.7 Å²	41.7	1%	0.01	24%	0.242	C	C	.	.	S	Bend	trans	-65.3	-42.9	177.2	-174.7	59.7	78.4	0	0	112.1	I3611 R3613 L3616 W3618	M3475-I3611 HydrophobicContact CE-CB 4.27Å; M3475-I3611 HydrophobicContact CE-CG2 4.2Å; M3475-I3611 WeakPolarHBondContact CE-O 3.47Å; M3475-I3611 HydrophobicContact CG-CG2 4.49Å; M3475-I3611 HydrophobicContact SD-CB 4.38Å; M3475-I3611 HydrophobicContact SD-CG2 3.66Å; M3475-R3613 WeakPolarHBondContact O-CD 3.38Å; M3475-R3613 HydrophobicContact SD-CB 3.83Å; M3475-L3616 HydrophobicContact CB-CD2 3.78Å; M3475-L3616 HydrophobicContact CE-CD2 4.07Å; M3475-L3616 HydrophobicContact CE-CG 3.85Å; M3475-W3618 HydrophobicContact CB-CD2 4.09Å; M3475-W3618 HydrophobicContact CB-CE3 4.07Å; M3475-W3618 HydrophobicContact CB-CH2 3.72Å; M3475-W3618 HydrophobicContact CB-CZ2 3.73Å; M3475-W3618 HydrophobicContact CB-CZ3 3.89Å; M3475-W3618 HydrophobicContact CE-CB 3.76Å; M3475-W3618 HydrophobicContact CE-CD2 3.68Å; M3475-W3618 HydrophobicContact CE-CE3 4.26Å; M3475-W3618 HydrophobicContact CE-CG 3.4Å; M3475-W3618 HydrophobicContact CG-CD2 3.93Å; M3475-W3618 HydrophobicContact CG-CE3 3.69Å; M3475-W3618 HydrophobicContact CG-CH2 4.23Å; M3475-W3618 HydrophobicContact CG-CZ2 4.43Å; M3475-W3618 HydrophobicContact CG-CZ3 3.85Å
3476	F	86.3	Confident	76.1	Confident	2 Å²	2	43.5 Å²	43.5	1%	0.009	25%	0.254	C	S	.	.	S	Bend	trans	-123.2	165.4	179.2	-61.7	-75.8	0	0	0	109.7	T3474 V3480 Y3482 E3516 L3519 A3520 L3523 I3595 W3618	T3474-F3476 VanDerWaalsContact CB-O 3.32Å; T3474-F3476 WeakPolarHBondContact CB-O 3.46Å; T3474-F3476 PolarHBondContact OG1-O 2.79Å; F3476-V3480 HydrophobicContact CB-CB 4Å; F3476-V3480 HydrophobicContact CB-CG1 4.37Å; F3476-V3480 HydrophobicContact CB-CG2 3.78Å; F3476-Y3482 VanDerWaalsContact CD2-OH 3.26Å; F3476-Y3482 WeakPolarHBondContact CD2-OH 3.39Å; F3476-E3516 HydrophobicContact CD1-CB 4.37Å; F3476-L3519 HydrophobicContact CE1-CB 4Å; F3476-L3519 HydrophobicContact CZ-CB 4.46Å; F3476-A3520 HydrophobicContact CD2-CB 3.78Å; F3476-A3520 HydrophobicContact CE2-CB 3.77Å; F3476-A3520 HydrophobicContact CG-CB 4.23Å; F3476-A3520 HydrophobicContact CZ-CB 4.23Å; F3476-L3523 HydrophobicContact CZ-CD1 4.1Å; F3476-I3595 HydrophobicContact CD1-CD1 4.16Å; F3476-I3595 HydrophobicContact CE1-CD1 4.04Å; F3476-W3618 HydrophobicContact CD2-CH2 4.46Å; F3476-W3618 AromaticContact CD2-CZ3 4Å; F3476-W3618 HydrophobicContact CD2-CZ3 4Å; F3476-W3618 HydrophobicContact CE2-CE3 4.2Å; F3476-W3618 AromaticContact CE2-CZ3 3.7Å; F3476-W3618 HydrophobicContact CE2-CZ3 3.7Å
3477	G	75.2	Confident	76.9	Confident	7 Å²	7	46.9 Å²	46.9	7%	0.072	27%	0.268	C	S	.	.			trans	-65	174.2	-176.8	0	0	0	0	0	114.5	Q3479 V3480 E3516	G3477-Q3479 PolarHBondContact O-N 2.89Å; G3477-V3480 PolarHBondContact O-N 3.44Å; G3477-V3480 VanDerWaalsContact O-N 3.08Å; G3477-E3516 WeakPolarHBondContact CA-OE2 2.95Å; G3477-E3516 PolarHBondContact N-OE2 2.86Å
3478	P	71.7	Confident	77.5	Confident	112 Å²	112	49.3 Å²	49.3	73%	0.727	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-10.6	-172.5	27.4	-36	0	0	0	114.4	V3480	P3478-V3480 VanDerWaalsContact C-N 3.29Å
3479	Q	74.5	Confident	78.1	Confident	93 Å²	93	47.1 Å²	47.1	44%	0.435	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-15.6	177	-61	170.9	8.8	0	0	112.6	G3477 S3495 I3496 S3514	G3477-Q3479 PolarHBondContact O-N 2.89Å; Q3479-S3495 WeakPolarHBondContact O-CA 3.48Å; Q3479-I3496 PolarHBondContact O-N 3.01Å; Q3479-S3514 PolarHBondContact OE1-OG 2.74Å
3480	V	81.7	Confident	78.5	Confident	12 Å²	12	48.1 Å²	48.1	7%	0.073	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	122.3	-176.5	-171.1	0	0	0	0	110.3	F3476 G3477 P3478 Y3482 V3493 E3516 T3517 A3520	F3476-V3480 HydrophobicContact CB-CB 4Å; F3476-V3480 HydrophobicContact CB-CG1 4.37Å; F3476-V3480 HydrophobicContact CB-CG2 3.78Å; G3477-V3480 PolarHBondContact O-N 3.44Å; G3477-V3480 VanDerWaalsContact O-N 3.08Å; P3478-V3480 VanDerWaalsContact C-N 3.29Å; V3480-Y3482 HydrophobicContact CG1-CE1 3.84Å; V3480-Y3482 WeakPolarHBondContact CG1-OH 3.23Å; V3480-V3493 HydrophobicContact CG1-CG1 3.79Å; V3480-E3516 HydrophobicContact CG2-CB 3.93Å; V3480-T3517 HydrophobicContact CG2-CG2 3.81Å; V3480-A3520 HydrophobicContact CG1-CB 3.67Å
3481	S	83.3	Confident	79.1	Confident	43 Å²	43	47.7 Å²	47.7	30%	0.301	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	157	171.7	-86.8	0	0	0	0	111.8	V3493 I3494 I3496	S3481-V3493 WeakPolarHBondContact O-CA 3.19Å; S3481-I3494 PolarHBondContact N-O 3.45Å; S3481-I3494 PolarHBondContact O-N 2.78Å; S3481-I3496 WeakPolarHBondContact OG-CD1 3.31Å; S3481-I3496 WeakPolarHBondContact OG-CG1 3.4Å
3482	Y	85	Confident	79.7	Confident	65 Å²	65	49.7 Å²	49.7	26%	0.255	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	133	179.1	-43.9	-83.3	0	0	0	109	I2692 F3476 V3480 V3491 K3492 V3493 A3520 W3618	I2692-Y3482 HydrophobicContact CD1-CD1 3.84Å; I2692-Y3482 HydrophobicContact CD1-CD2 4.39Å; I2692-Y3482 HydrophobicContact CD1-CE1 4.32Å; I2692-Y3482 HydrophobicContact CD1-CG 3.9Å; I2692-Y3482 HydrophobicContact CG1-CD1 4.28Å; I2692-Y3482 HydrophobicContact CG1-CD2 3.93Å; I2692-Y3482 HydrophobicContact CG1-CG 3.83Å; F3476-Y3482 VanDerWaalsContact CD2-OH 3.26Å; F3476-Y3482 WeakPolarHBondContact CD2-OH 3.39Å; V3480-Y3482 HydrophobicContact CG1-CE1 3.84Å; V3480-Y3482 WeakPolarHBondContact CG1-OH 3.23Å; Y3482-V3491 HydrophobicContact CD1-CG1 4.23Å; Y3482-K3492 CarbonylContact C-O 3.17Å; Y3482-K3492 WeakPolarHBondContact CA-O 3.04Å; Y3482-V3493 HydrophobicContact CD1-CG2 4.15Å; Y3482-V3493 HydrophobicContact CE1-CG2 4.38Å; Y3482-A3520 HydrophobicContact CE1-CB 4.46Å; Y3482-W3618 AromaticContact CE1-CH2 3.8Å; Y3482-W3618 HydrophobicContact CE1-CH2 3.8Å; Y3482-W3618 HydrophobicContact CE1-CZ3 4.15Å; Y3482-W3618 HydrophobicContact CE2-CH2 4.11Å; Y3482-W3618 AromaticContact CZ-CH2 3.58Å
3483	V	83.5	Confident	80.1	Confident	71 Å²	71	48.9 Å²	48.9	43%	0.43	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	126.2	167.9	170.6	0	0	0	0	107.1	K3492 I3494	V3483-K3492 PolarHBondContact N-O 2.74Å; V3483-K3492 PolarHBondContact O-N 2.85Å; V3483-I3494 HydrophobicContact CB-CD1 4Å; V3483-I3494 HydrophobicContact CG2-CD1 3.29Å; V3483-I3494 HydrophobicContact CG2-CG1 4.2Å
3484	V	80.2	Confident	80.1	Confident	21 Å²	21	48.1 Å²	48.1	13%	0.127	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	125.6	173.2	-175.1	0	0	0	0	107.4	I2692 K2693 D3486 G3489 V3491	I2692-V3484 HydrophobicContact CG2-CG2 3.67Å; K2693-V3484 HydrophobicContact CD-CB 4.35Å; K2693-V3484 HydrophobicContact CD-CG1 4.22Å; K2693-V3484 HydrophobicContact CD-CG2 4.22Å; K2693-V3484 VanDerWaalsContact CE-CB 3.47Å; K2693-V3484 VanDerWaalsContact CE-CG1 3.45Å; K2693-V3484 HydrophobicContact CG-CG2 3.96Å; V3484-D3486 PolarHBondContact O-N 2.88Å; V3484-G3489 VanDerWaalsContact CG1-O 3.29Å; V3484-G3489 WeakPolarHBondContact CG1-O 3.48Å; V3484-V3491 HydrophobicContact CG2-CG2 4.24Å
3485	D	76.3	Confident	79.8	Confident	37 Å²	37	47.4 Å²	47.4	20%	0.198	26%	0.261	C	S	.	.			trans	-68.1	121.2	176.3	-170.6	-66.8	0	0	0	109.4	D3487 T3488 G3489 Y3490 K3492	D3485-D3487 VanDerWaalsContact C-N 3.33Å; D3485-D3487 PolarHBondContact O-N 3.01Å; D3485-D3487 PolarHBondContact OD1-N 3.47Å; D3485-T3488 VanDerWaalsContact CB-OG1 3.29Å; D3485-T3488 WeakPolarHBondContact CB-OG1 3.41Å; D3485-T3488 PolarHBondContact OD1-N 2.84Å; D3485-T3488 PolarHBondContact OD1-OG1 2.79Å; D3485-G3489 WeakPolarHBondContact O-CA 3.14Å; D3485-G3489 PolarHBondContact O-N 2.87Å; D3485-Y3490 WeakPolarHBondContact CB-O 3.49Å; D3485-Y3490 PolarHBondContact N-O 3.41Å; D3485-K3492 IonicContact OD2-NZ 4Å; D3485-K3492 PolarHBondContact OD2-NZ 3.41Å
3486	D	66.9	Low	78.8	Confident	113 Å²	113	50.8 Å²	50.8	60%	0.604	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-25.1	-172.8	-70.6	-36.4	0	0	0	113.8	S2720 V3484	S2720-D3486 PolarHBondContact N-O 3.01Å; V3484-D3486 PolarHBondContact O-N 2.88Å
3487	D	65.4	Low	77.5	Confident	115 Å²	115	55.8 Å²	55.8	62%	0.615	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-42.4	178.9	-68.6	-33.1	0	0	0	110.5	S2719 D3485	S2719-D3487 WeakPolarHBondContact CB-O 3.34Å; D3485-D3487 VanDerWaalsContact C-N 3.33Å; D3485-D3487 PolarHBondContact O-N 3.01Å; D3485-D3487 PolarHBondContact OD1-N 3.47Å
3488	T	72	Confident	76.2	Confident	73 Å²	73	62.4 Å²	62.4	45%	0.448	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-16.9	-171.2	62	0	0	0	0	115	D3485 Y3490 N3528	D3485-T3488 VanDerWaalsContact CB-OG1 3.29Å; D3485-T3488 WeakPolarHBondContact CB-OG1 3.41Å; D3485-T3488 PolarHBondContact OD1-N 2.84Å; D3485-T3488 PolarHBondContact OD1-OG1 2.79Å; T3488-Y3490 HydrophobicContact CG2-CD2 4.46Å; T3488-Y3490 PolarHBondContact O-N 3.26Å; T3488-Y3490 WeakPolarHBondContact OG1-CD2 3.49Å; T3488-N3528 PolarHBondContact O-OD1 2.84Å
3489	G	77.1	Confident	74.9	Confident	10 Å²	10	62 Å²	62	10%	0.103	33%	0.334	C	S	.	.			trans	79	-6.8	-175.4	0	0	0	0	0	115	V3484 D3485 N3528	V3484-G3489 VanDerWaalsContact CG1-O 3.29Å; V3484-G3489 WeakPolarHBondContact CG1-O 3.48Å; D3485-G3489 WeakPolarHBondContact O-CA 3.14Å; D3485-G3489 PolarHBondContact O-N 2.87Å; G3489-N3528 WeakPolarHBondContact CA-OD1 3.47Å; G3489-N3528 PolarHBondContact O-OD1 2.82Å
3490	Y	84.9	Confident	73.2	Confident	39 Å²	39	65.3 Å²	65.3	15%	0.153	35%	0.35	C	S	.	.	B	Isolated β-bridge	trans	-71.9	138.9	-173.7	-73.3	-67.5	0	0	0	112	D3485 T3488 D3526 T3527 N3528 T3568 K3569	D3485-Y3490 WeakPolarHBondContact CB-O 3.49Å; D3485-Y3490 PolarHBondContact N-O 3.41Å; T3488-Y3490 HydrophobicContact CG2-CD2 4.46Å; T3488-Y3490 PolarHBondContact O-N 3.26Å; T3488-Y3490 WeakPolarHBondContact OG1-CD2 3.49Å; Y3490-D3526 VanDerWaalsContact CD1-C 3.44Å; Y3490-D3526 WeakPolarHBondContact CD1-O 3.27Å; Y3490-D3526 WeakPolarHBondContact CE1-O 3.41Å; Y3490-T3527 WeakPolarHBondContact CA-O 2.85Å; Y3490-N3528 WeakPolarHBondContact CA-OD1 3.39Å; Y3490-N3528 WeakPolarHBondContact CD1-ND2 3.18Å; Y3490-N3528 WeakPolarHBondContact CE1-ND2 3.43Å; Y3490-N3528 PolarHBondContact N-OD1 2.88Å; Y3490-N3528 VanDerWaalsContact N-OD1 3.15Å; Y3490-T3568 PolarHBondContact OH-OG1 3.48Å; Y3490-K3569 HydrophobicContact CE1-CG 4.46Å
3491	V	86.9	Confident	70.9	Confident	1 Å²	1	71 Å²	71	1%	0.006	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	131.3	174	-173.1	0	0	0	0	110.2	I2692 Y3482 V3484 V3524 S3525 D3526 T3527 F3565	I2692-V3491 HydrophobicContact CD1-CG1 4.08Å; I2692-V3491 HydrophobicContact CD1-CG2 4.46Å; I2692-V3491 HydrophobicContact CG2-CG2 4.29Å; Y3482-V3491 HydrophobicContact CD1-CG1 4.23Å; V3484-V3491 HydrophobicContact CG2-CG2 4.24Å; V3491-V3524 HydrophobicContact CB-CG1 4.06Å; V3491-V3524 HydrophobicContact CG1-CG1 3.81Å; V3491-V3524 HydrophobicContact CG2-CG1 4.31Å; V3491-S3525 CarbonylContact O-C 3.52Å; V3491-S3525 WeakPolarHBondContact O-CA 3.24Å; V3491-D3526 PolarHBondContact O-N 2.64Å; V3491-T3527 PolarHBondContact N-O 3.23Å; V3491-F3565 HydrophobicContact CG2-CD1 4.5Å; V3491-F3565 HydrophobicContact CG2-CE1 4.31Å
3492	K	88	Confident	68.6	Low	103 Å²	103	75 Å²	75	45%	0.448	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	136.9	168.2	-69.4	173.9	-177.3	153.2	0	108.7	Y3482 V3483 D3485	Y3482-K3492 CarbonylContact C-O 3.17Å; Y3482-K3492 WeakPolarHBondContact CA-O 3.04Å; V3483-K3492 PolarHBondContact N-O 2.74Å; V3483-K3492 PolarHBondContact O-N 2.85Å; D3485-K3492 IonicContact OD2-NZ 4Å; D3485-K3492 PolarHBondContact OD2-NZ 3.41Å
3493	V	87.5	Confident	66.2	Low	16 Å²	16	81.2 Å²	81.2	10%	0.097	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	134.5	178.7	-179.6	0	0	0	0	109.1	V3480 S3481 Y3482 A3520	V3480-V3493 HydrophobicContact CG1-CG1 3.79Å; S3481-V3493 WeakPolarHBondContact O-CA 3.19Å; Y3482-V3493 HydrophobicContact CD1-CG2 4.15Å; Y3482-V3493 HydrophobicContact CE1-CG2 4.38Å; V3493-A3520 HydrophobicContact CG1-CB 3.91Å; V3493-A3520 HydrophobicContact CG2-CB 4.33Å
3494	I	81.9	Confident	64.2	Low	30 Å²	30	83.8 Å²	83.8	15%	0.154	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	136.8	-179.3	-53.2	-173.2	0	0	0	108.7	S3481 V3483 F3506	S3481-I3494 PolarHBondContact N-O 3.45Å; S3481-I3494 PolarHBondContact O-N 2.78Å; V3483-I3494 HydrophobicContact CB-CD1 4Å; V3483-I3494 HydrophobicContact CG2-CD1 3.29Å; V3483-I3494 HydrophobicContact CG2-CG1 4.2Å; I3494-F3506 HydrophobicContact CD1-CB 4.48Å; I3494-F3506 HydrophobicContact CG2-CD1 4.19Å
3495	S	78.8	Confident	62.2	Low	31 Å²	31	91.2 Å²	91.2	22%	0.217	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	129	171	-172.9	0	0	0	0	109.9	Q3479	Q3479-S3495 WeakPolarHBondContact O-CA 3.48Å
3496	I	67.7	Low	60.5	Low	72 Å²	72	98.1 Å²	98.1	37%	0.369	51%	0.513	S	S	.	.			trans	-93.4	102.6	171.2	-46.2	174.2	0	0	0	108.1	Q3479 S3481	Q3479-I3496 PolarHBondContact O-N 3.01Å; S3481-I3496 WeakPolarHBondContact OG-CD1 3.31Å; S3481-I3496 WeakPolarHBondContact OG-CG1 3.4Å
3497	N	58.9	Low	59.2	Low	108 Å²	108	101.8 Å²	101.8	58%	0.578	52%	0.524	S	S	*	.			trans	-84.3	112.4	165.6	-73.1	-1.6	0	0	0	107.9	S3499 Q3500	N3497-S3499 PolarHBondContact O-N 3.44Å; N3497-Q3500 PolarHBondContact O-N 2.84Å
3498	Q	48.7	Very low	58.1	Low	146 Å²	146	100.7 Å²	100.7	68%	0.682	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-9	-178.4	-73.2	-179.1	-14.8	0	0	114.3
3499	S	44.4	Very low	56.8	Low	104 Å²	104	99.9 Å²	99.9	73%	0.727	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-3.7	-178.2	57.5	0	0	0	0	116.1	N3497	N3497-S3499 PolarHBondContact O-N 3.44Å
3500	Q	37.4	Very low	55.2	Low	162 Å²	162	103.8 Å²	103.8	76%	0.757	56%	0.557	S	S	*	*			trans	-115.8	77.7	-180	-72.1	-175	-7	0	0	112.7	N3497 T3502	N3497-Q3500 PolarHBondContact O-N 2.84Å; Q3500-T3502 VanDerWaalsContact C-N 3.33Å; Q3500-T3502 PolarHBondContact O-N 2.82Å
3501	T	34	Very low	53.2	Low	130 Å²	130	108.6 Å²	108.6	80%	0.798	58%	0.584	S	S	*	*			trans	-86.2	62.1	168	54.5	0	0	0	0	111.3
3502	T	34.1	Very low	51.5	Low	128 Å²	128	115.8 Å²	115.8	79%	0.785	62%	0.623	S	S	*	*	S	Bend	trans	-150.8	126.3	168.4	51.1	0	0	0	0	112.6	Q3500	Q3500-T3502 VanDerWaalsContact C-N 3.33Å; Q3500-T3502 PolarHBondContact O-N 2.82Å
3503	K	34.7	Very low	50.1	Low	195 Å²	195	111.6 Å²	111.6	85%	0.848	61%	0.609	S	S	*	*	S	Bend	trans	-1.9	131.1	166	-66.1	175.5	178.4	177.4	0	118.5
3504	T	42	Very low	49.4	Very low	126 Å²	126	112.7 Å²	112.7	77%	0.773	62%	0.617	S	S	*	*	S	Bend	trans	62.7	102.5	153.2	56	0	0	0	0	117.1
3505	H	38.1	Very low	49.3	Very low	177 Å²	177	115.3 Å²	115.3	82%	0.819	63%	0.631	S	S	*	*			trans	122.3	84.4	160.2	-67.8	-69.2	0	0	0	113.4	K3507	H3505-K3507 PolarHBondContact O-N 2.82Å; H3505-K3507 VanDerWaalsContact O-N 3.09Å
3506	F	41.2	Very low	49.5	Very low	181 Å²	181	115.4 Å²	115.4	79%	0.794	63%	0.628	S	S	*	*			trans	-62.9	105.8	160.8	-68.6	-80.8	0	0	0	108.5	I3494	I3494-F3506 HydrophobicContact CD1-CB 4.48Å; I3494-F3506 HydrophobicContact CG2-CD1 4.19Å
3507	K	40.3	Very low	50.3	Low	190 Å²	190	112.3 Å²	112.3	83%	0.826	61%	0.612	S	S	*	*			trans	-73.6	139.8	171.4	-76.3	-178.4	176.9	177.9	0	109.5	H3505	H3505-K3507 PolarHBondContact O-N 2.82Å; H3505-K3507 VanDerWaalsContact O-N 3.09Å
3508	A	40.6	Very low	51.5	Low	93 Å²	93	110.4 Å²	110.4	77%	0.769	60%	0.599	S	S	*	*			trans	-55.2	141.9	168.2	0	0	0	0	0	109.7	S3510	A3508-S3510 PolarHBondContact O-N 2.91Å
3509	A	46.5	Very low	53.4	Low	56 Å²	56	103.6 Å²	103.6	46%	0.463	57%	0.567	S	S	.	*			trans	-51.9	110.2	-173.8	0	0	0	0	0	111.3
3510	S	42.2	Very low	55.5	Low	91 Å²	91	98.6 Å²	98.6	64%	0.636	53%	0.532	S	S	*	.			trans	-60.5	146.1	154.6	178.8	0	0	0	0	107.8	A3508 D3512	A3508-S3510 PolarHBondContact O-N 2.91Å; S3510-D3512 PolarHBondContact O-N 2.81Å
3511	I	44.1	Very low	58	Low	141 Å²	141	92.8 Å²	92.8	72%	0.723	51%	0.509	S	S	*	.	S	Bend	trans	-63.3	-4.2	-171	-67	168.1	0	0	0	113.4	G3513 K3518	I3511-G3513 PolarHBondContact O-N 3.49Å; I3511-G3513 VanDerWaalsContact O-N 3.17Å; I3511-K3518 WeakPolarHBondContact O-CE 3.23Å; I3511-K3518 PolarHBondContact O-NZ 2.92Å
3512	D	49.9	Very low	60.6	Low	152 Å²	152	87.7 Å²	87.7	81%	0.813	48%	0.477	S	S	*	.			trans	-83.8	27.3	177.5	-63.5	-29.8	0	0	0	114.8	S3510	S3510-D3512 PolarHBondContact O-N 2.81Å
3513	G	58.5	Low	63.2	Low	15 Å²	15	81.6 Å²	81.6	16%	0.155	44%	0.439	C	S	.	.	S	Bend	trans	-80.7	161.5	173.8	0	0	0	0	0	114	I3511 T3517 K3518	I3511-G3513 PolarHBondContact O-N 3.49Å; I3511-G3513 VanDerWaalsContact O-N 3.17Å; G3513-T3517 VanDerWaalsContact C-OG1 3.25Å; G3513-T3517 WeakPolarHBondContact CA-OG1 3.42Å; G3513-K3518 WeakPolarHBondContact O-CE 3.25Å
3514	S	73.5	Confident	65.9	Low	38 Å²	38	72.3 Å²	72.3	27%	0.266	40%	0.399	S	S	.	.			trans	-56.5	156.6	174.8	63.8	0	0	0	0	112.3	Q3479 E3516 T3517 K3518	Q3479-S3514 PolarHBondContact OE1-OG 2.74Å; S3514-E3516 PolarHBondContact O-N 2.8Å; S3514-E3516 VanDerWaalsContact O-N 3.11Å; S3514-T3517 PolarHBondContact N-OG1 3.1Å; S3514-T3517 PolarHBondContact O-N 3.22Å; S3514-T3517 PolarHBondContact O-OG1 2.6Å; S3514-T3517 WeakPolarHBondContact OG-CG2 3.23Å; S3514-K3518 PolarHBondContact O-N 3.19Å; S3514-K3518 VanDerWaalsContact O-N 3.17Å
3515	L	80.4	Confident	68.2	Low	85 Å²	85	67.3 Å²	67.3	45%	0.445	37%	0.37	S	S	.	.	H	α-helix	trans	-51.6	-38.1	-179.1	-179.5	64.8	0	0	0	112.6	K3518 L3519 F3584	L3515-K3518 PolarHBondContact O-N 3.17Å; L3515-L3519 HydrophobicContact CG-CD1 4.31Å; L3515-L3519 WeakPolarHBondContact O-CB 3.12Å; L3515-L3519 WeakPolarHBondContact O-CG 3.14Å; L3515-L3519 PolarHBondContact O-N 3.19Å; L3515-F3584 HydrophobicContact CD1-CE2 4.15Å; L3515-F3584 HydrophobicContact CD1-CZ 4.26Å; L3515-F3584 HydrophobicContact CD2-CZ 4.28Å; L3515-F3584 HydrophobicContact CG-CZ 4.47Å
3516	E	82.8	Confident	70.5	Confident	33 Å²	33	61.3 Å²	61.3	15%	0.154	34%	0.343	C	S	.	.	H	α-helix	trans	-63.2	-40.7	176.9	-61	-172.2	150.9	0	0	112.9	F3476 G3477 V3480 S3514 L3519 A3520	F3476-E3516 HydrophobicContact CD1-CB 4.37Å; G3477-E3516 WeakPolarHBondContact CA-OE2 2.95Å; G3477-E3516 PolarHBondContact N-OE2 2.86Å; V3480-E3516 HydrophobicContact CG2-CB 3.93Å; S3514-E3516 PolarHBondContact O-N 2.8Å; S3514-E3516 VanDerWaalsContact O-N 3.11Å; E3516-L3519 PolarHBondContact O-N 3.32Å; E3516-A3520 VanDerWaalsContact O-CB 3.3Å; E3516-A3520 WeakPolarHBondContact O-CB 2.96Å; E3516-A3520 PolarHBondContact O-N 3.22Å
3517	T	83.8	Confident	72.9	Confident	7 Å²	7	52.7 Å²	52.7	4%	0.043	31%	0.306	C	S	.	.	H	α-helix	trans	-66.9	-39.4	176.7	64.1	0	0	0	0	111.7	V3480 G3513 S3514 A3520 S3521	V3480-T3517 HydrophobicContact CG2-CG2 3.81Å; G3513-T3517 VanDerWaalsContact C-OG1 3.25Å; G3513-T3517 WeakPolarHBondContact CA-OG1 3.42Å; S3514-T3517 PolarHBondContact N-OG1 3.1Å; S3514-T3517 PolarHBondContact O-N 3.22Å; S3514-T3517 PolarHBondContact O-OG1 2.6Å; S3514-T3517 WeakPolarHBondContact OG-CG2 3.23Å; T3517-A3520 PolarHBondContact O-N 3.32Å; T3517-S3521 WeakPolarHBondContact O-CB 3.12Å; T3517-S3521 PolarHBondContact O-N 3.24Å; T3517-S3521 PolarHBondContact O-OG 2.84Å; T3517-S3521 VanDerWaalsContact O-OG 3.04Å
3518	K	85.1	Confident	75.1	Confident	69 Å²	69	44 Å²	44	30%	0.3	27%	0.268	S	S	.	.	H	α-helix	trans	-62.8	-45.8	173.7	-70.7	179.3	178.4	174.9	0	111.3	I3511 G3513 S3514 L3515 S3521 I3522 L3582	I3511-K3518 WeakPolarHBondContact O-CE 3.23Å; I3511-K3518 PolarHBondContact O-NZ 2.92Å; G3513-K3518 WeakPolarHBondContact O-CE 3.25Å; S3514-K3518 PolarHBondContact O-N 3.19Å; S3514-K3518 VanDerWaalsContact O-N 3.17Å; L3515-K3518 PolarHBondContact O-N 3.17Å; K3518-S3521 WeakPolarHBondContact CA-OG 3.4Å; K3518-S3521 PolarHBondContact O-N 3.48Å; K3518-S3521 PolarHBondContact O-OG 3.35Å; K3518-I3522 WeakPolarHBondContact O-CG1 3.27Å; K3518-I3522 PolarHBondContact O-N 2.99Å; K3518-L3582 HydrophobicContact CB-CD1 4.25Å
3519	L	87.6	Confident	77.3	Confident	2 Å²	2	39.8 Å²	39.8	1%	0.01	23%	0.233	C	C	.	.	H	α-helix	trans	-59.2	-52.7	174.4	-81	173.6	0	0	0	111.9	F3476 L3515 E3516 S3521 I3522 L3523 L3579 L3582 F3584 F3597	F3476-L3519 HydrophobicContact CE1-CB 4Å; F3476-L3519 HydrophobicContact CZ-CB 4.46Å; L3515-L3519 HydrophobicContact CG-CD1 4.31Å; L3515-L3519 WeakPolarHBondContact O-CB 3.12Å; L3515-L3519 WeakPolarHBondContact O-CG 3.14Å; L3515-L3519 PolarHBondContact O-N 3.19Å; E3516-L3519 PolarHBondContact O-N 3.32Å; L3519-S3521 VanDerWaalsContact C-N 3.31Å; L3519-S3521 PolarHBondContact O-N 3.24Å; L3519-I3522 PolarHBondContact O-N 3.23Å; L3519-L3523 HydrophobicContact CB-CD1 4.49Å; L3519-L3523 WeakPolarHBondContact O-CB 3.29Å; L3519-L3523 VanDerWaalsContact O-CD1 3.29Å; L3519-L3523 WeakPolarHBondContact O-CD1 3.44Å; L3519-L3523 WeakPolarHBondContact O-CG 3.33Å; L3519-L3523 PolarHBondContact O-N 3.06Å; L3519-L3523 VanDerWaalsContact O-N 3.07Å; L3519-L3579 HydrophobicContact CD2-CD2 3.88Å; L3519-L3582 HydrophobicContact CD2-CD1 4.46Å; L3519-F3584 HydrophobicContact CD1-CE1 4.25Å; L3519-F3584 HydrophobicContact CD1-CE2 4.16Å; L3519-F3584 HydrophobicContact CD1-CZ 3.65Å; L3519-F3584 HydrophobicContact CD2-CD2 3.79Å; L3519-F3584 HydrophobicContact CD2-CE1 4.3Å; L3519-F3584 HydrophobicContact CD2-CE2 3.4Å; L3519-F3584 VanDerWaalsContact CD2-CE2 3.4Å; L3519-F3584 HydrophobicContact CD2-CG 4.41Å; L3519-F3584 HydrophobicContact CD2-CZ 3.7Å; L3519-F3584 HydrophobicContact CG-CE2 3.96Å; L3519-F3584 HydrophobicContact CG-CZ 4Å; L3519-F3597 HydrophobicContact CD2-CZ 4.45Å
3520	A	89.1	Confident	79.2	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-59.3	-41.9	-179.7	0	0	0	0	0	112	F3476 V3480 Y3482 V3493 E3516 T3517 L3523 V3524	F3476-A3520 HydrophobicContact CD2-CB 3.78Å; F3476-A3520 HydrophobicContact CE2-CB 3.77Å; F3476-A3520 HydrophobicContact CG-CB 4.23Å; F3476-A3520 HydrophobicContact CZ-CB 4.23Å; V3480-A3520 HydrophobicContact CG1-CB 3.67Å; Y3482-A3520 HydrophobicContact CE1-CB 4.46Å; V3493-A3520 HydrophobicContact CG1-CB 3.91Å; V3493-A3520 HydrophobicContact CG2-CB 4.33Å; E3516-A3520 VanDerWaalsContact O-CB 3.3Å; E3516-A3520 WeakPolarHBondContact O-CB 2.96Å; E3516-A3520 PolarHBondContact O-N 3.22Å; T3517-A3520 PolarHBondContact O-N 3.32Å; A3520-L3523 PolarHBondContact O-N 3.07Å; A3520-V3524 PolarHBondContact O-N 3.16Å
3521	S	88.8	Confident	81.5	Confident	40 Å²	40	32.8 Å²	32.8	28%	0.28	18%	0.181	S	C	.	.	H	α-helix	trans	-65	-45.1	177.9	62.2	0	0	0	0	112.8	T3517 K3518 L3519 L3523 S3525 K3570	T3517-S3521 WeakPolarHBondContact O-CB 3.12Å; T3517-S3521 PolarHBondContact O-N 3.24Å; T3517-S3521 PolarHBondContact O-OG 2.84Å; T3517-S3521 VanDerWaalsContact O-OG 3.04Å; K3518-S3521 WeakPolarHBondContact CA-OG 3.4Å; K3518-S3521 PolarHBondContact O-N 3.48Å; K3518-S3521 PolarHBondContact O-OG 3.35Å; L3519-S3521 VanDerWaalsContact C-N 3.31Å; L3519-S3521 PolarHBondContact O-N 3.24Å; S3521-L3523 VanDerWaalsContact C-N 3.3Å; S3521-L3523 PolarHBondContact O-N 2.75Å; S3521-S3525 WeakPolarHBondContact O-CB 3.3Å; S3521-S3525 PolarHBondContact O-N 2.95Å; S3521-S3525 PolarHBondContact O-OG 2.98Å; S3521-K3570 PolarHBondContact O-NZ 3.19Å
3522	I	89	Confident	83.8	Confident	22 Å²	22	26.1 Å²	26.1	11%	0.113	15%	0.146	C	C	.	.	H	α-helix	trans	-58.9	-46.2	177	-72.6	166.4	0	0	0	110.6	K3518 L3519 K3570 T3575 Q3578 L3579 L3582	K3518-I3522 WeakPolarHBondContact O-CG1 3.27Å; K3518-I3522 PolarHBondContact O-N 2.99Å; L3519-I3522 PolarHBondContact O-N 3.23Å; I3522-K3570 PolarHBondContact O-NZ 3.45Å; I3522-T3575 HydrophobicContact CG2-CG2 3.89Å; I3522-Q3578 HydrophobicContact CD1-CB 4.25Å; I3522-Q3578 HydrophobicContact CG1-CB 4.46Å; I3522-Q3578 HydrophobicContact CG2-CB 4.08Å; I3522-L3579 HydrophobicContact CG2-CD2 3.95Å; I3522-L3579 HydrophobicContact CG2-CG 4.03Å; I3522-L3582 HydrophobicContact CD1-CD1 3.25Å; I3522-L3582 HydrophobicContact CD1-CG 4.03Å
3523	L	89.8	Confident	85.7	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-77.9	-52.2	-170.8	-66.4	164.6	0	0	0	112.6	F3476 L3519 A3520 S3521 L3579 F3597 L3609 I3611 I3620	F3476-L3523 HydrophobicContact CZ-CD1 4.1Å; L3519-L3523 HydrophobicContact CB-CD1 4.49Å; L3519-L3523 WeakPolarHBondContact O-CB 3.29Å; L3519-L3523 VanDerWaalsContact O-CD1 3.29Å; L3519-L3523 WeakPolarHBondContact O-CD1 3.44Å; L3519-L3523 WeakPolarHBondContact O-CG 3.33Å; L3519-L3523 PolarHBondContact O-N 3.06Å; L3519-L3523 VanDerWaalsContact O-N 3.07Å; A3520-L3523 PolarHBondContact O-N 3.07Å; S3521-L3523 VanDerWaalsContact C-N 3.3Å; S3521-L3523 PolarHBondContact O-N 2.75Å; L3523-L3579 HydrophobicContact CD2-CD1 3.81Å; L3523-L3579 HydrophobicContact CD2-CD2 4.13Å; L3523-L3579 HydrophobicContact CD2-CG 4.48Å; L3523-L3579 HydrophobicContact CG-CD2 4.34Å; L3523-F3597 HydrophobicContact CD1-CE1 3.66Å; L3523-F3597 HydrophobicContact CD1-CZ 4.09Å; L3523-F3597 HydrophobicContact CD2-CE1 4.36Å; L3523-L3609 HydrophobicContact CD2-CD2 3.38Å; L3523-I3611 HydrophobicContact CB-CD1 4.17Å; L3523-I3611 HydrophobicContact CD1-CD1 3.7Å; L3523-I3611 HydrophobicContact CD2-CD1 4.19Å; L3523-I3611 HydrophobicContact CG-CD1 4.23Å; L3523-I3620 HydrophobicContact CB-CD1 3.8Å; L3523-I3620 HydrophobicContact CD2-CD1 4.18Å; L3523-I3620 WeakPolarHBondContact O-CD1 2.95Å
3524	V	90.3	Very high	86.9	Confident	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-109.6	-20.5	-163.7	-176.1	0	0	0	0	113.3	I2692 V3491 A3520 D3526 T3527 F3565 W3618 I3620	I2692-V3524 HydrophobicContact CD1-CG1 3.77Å; V3491-V3524 HydrophobicContact CB-CG1 4.06Å; V3491-V3524 HydrophobicContact CG1-CG1 3.81Å; V3491-V3524 HydrophobicContact CG2-CG1 4.31Å; A3520-V3524 PolarHBondContact O-N 3.16Å; V3524-D3526 PolarHBondContact O-N 3.4Å; V3524-T3527 WeakPolarHBondContact O-CB 3.23Å; V3524-T3527 WeakPolarHBondContact O-CG2 3Å; V3524-T3527 PolarHBondContact O-N 3.28Å; V3524-T3527 PolarHBondContact O-OG1 2.81Å; V3524-F3565 HydrophobicContact CG1-CD1 4.2Å; V3524-F3565 HydrophobicContact CG1-CE1 4.08Å; V3524-W3618 HydrophobicContact CB-CZ3 4.5Å; V3524-W3618 HydrophobicContact CG2-CE3 3.61Å; V3524-W3618 HydrophobicContact CG2-CZ3 3.64Å; V3524-I3620 HydrophobicContact CG2-CD1 4.36Å
3525	S	89.8	Confident	86.9	Confident	22 Å²	22	23.8 Å²	23.8	15%	0.154	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	143.4	175.4	91.8	0	0	0	0	110.5	V3491 S3521 T3527 K3570	V3491-S3525 CarbonylContact O-C 3.52Å; V3491-S3525 WeakPolarHBondContact O-CA 3.24Å; S3521-S3525 WeakPolarHBondContact O-CB 3.3Å; S3521-S3525 PolarHBondContact O-N 2.95Å; S3521-S3525 PolarHBondContact O-OG 2.98Å; S3525-T3527 PolarHBondContact O-N 3.26Å; S3525-K3570 VanDerWaalsContact O-CE 3.3Å; S3525-K3570 WeakPolarHBondContact O-CE 3.22Å; S3525-K3570 PolarHBondContact O-NZ 2.91Å; S3525-K3570 PolarHBondContact OG-NZ 2.78Å
3526	D	87.6	Confident	86.2	Confident	50 Å²	50	21.1 Å²	21.1	27%	0.267	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.6	20.6	-179.9	-62.6	-74.3	0	0	0	114.9	Y3490 V3491 V3524 K3569	Y3490-D3526 VanDerWaalsContact CD1-C 3.44Å; Y3490-D3526 WeakPolarHBondContact CD1-O 3.27Å; Y3490-D3526 WeakPolarHBondContact CE1-O 3.41Å; V3491-D3526 PolarHBondContact O-N 2.64Å; V3524-D3526 PolarHBondContact O-N 3.4Å; D3526-K3569 HydrophobicContact CB-CB 4.47Å; D3526-K3569 HydrophobicContact CB-CD 4.08Å; D3526-K3569 IonicContact OD1-NZ 3.55Å; D3526-K3569 PolarHBondContact OD1-NZ 2.79Å
3527	T	90.4	Very high	84.9	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	159.6	169.7	70.5	0	0	0	0	111	Y3490 V3491 V3524 S3525 F3565 L3566 I3620	Y3490-T3527 WeakPolarHBondContact CA-O 2.85Å; V3491-T3527 PolarHBondContact N-O 3.23Å; V3524-T3527 WeakPolarHBondContact O-CB 3.23Å; V3524-T3527 WeakPolarHBondContact O-CG2 3Å; V3524-T3527 PolarHBondContact O-N 3.28Å; V3524-T3527 PolarHBondContact O-OG1 2.81Å; S3525-T3527 PolarHBondContact O-N 3.26Å; T3527-F3565 WeakPolarHBondContact OG1-CD1 3.31Å; T3527-L3566 WeakPolarHBondContact CA-O 3.36Å; T3527-I3620 HydrophobicContact CG2-CG2 4.19Å
3528	N	87.4	Confident	83	Confident	7 Å²	7	29.1 Å²	29.1	4%	0.037	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	127.9	173.8	-75.3	-59.3	0	0	0	110	T3488 G3489 Y3490 V3530 F3565 L3566 W3635	T3488-N3528 PolarHBondContact O-OD1 2.84Å; G3489-N3528 WeakPolarHBondContact CA-OD1 3.47Å; G3489-N3528 PolarHBondContact O-OD1 2.82Å; Y3490-N3528 WeakPolarHBondContact CA-OD1 3.39Å; Y3490-N3528 WeakPolarHBondContact CD1-ND2 3.18Å; Y3490-N3528 WeakPolarHBondContact CE1-ND2 3.43Å; Y3490-N3528 PolarHBondContact N-OD1 2.88Å; Y3490-N3528 VanDerWaalsContact N-OD1 3.15Å; N3528-V3530 HydrophobicContact CB-CG2 4.24Å; N3528-V3530 PolarHBondContact O-N 2.77Å; N3528-F3565 CarbonylContact O-C 3.56Å; N3528-F3565 WeakPolarHBondContact O-CA 3.31Å; N3528-L3566 PolarHBondContact N-O 3.39Å; N3528-L3566 PolarHBondContact O-N 3.46Å; N3528-W3635 HydrophobicContact CB-CH2 3.65Å; N3528-W3635 HydrophobicContact CB-CZ3 3.6Å; N3528-W3635 WeakPolarHBondContact ND2-CZ3 3.42Å
3529	L	87.1	Confident	80.5	Confident	5 Å²	5	31.3 Å²	31.3	3%	0.026	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	126	167.7	177.6	65	0	0	0	108.9	I2692 K2693 V2717 Q3563 F3565	I2692-L3529 HydrophobicContact CG2-CD2 4.49Å; I2692-L3529 WeakPolarHBondContact O-CD2 3.35Å; K2693-L3529 HydrophobicContact CB-CD2 4.3Å; V2717-L3529 HydrophobicContact CG1-CB 4.5Å; V2717-L3529 WeakPolarHBondContact CG1-O 3.39Å; V2717-L3529 HydrophobicContact CG2-CB 4.38Å; V2717-L3529 HydrophobicContact CG2-CD2 3.88Å; V2717-L3529 HydrophobicContact CG2-CG 4.04Å; L3529-Q3563 HydrophobicContact CD1-CB 3.81Å; L3529-Q3563 HydrophobicContact CD1-CG 4.36Å; L3529-F3565 HydrophobicContact CB-CD1 4.11Å; L3529-F3565 HydrophobicContact CB-CE1 3.9Å; L3529-F3565 HydrophobicContact CD1-CD1 4.4Å; L3529-F3565 HydrophobicContact CD1-CE1 3.98Å; L3529-F3565 HydrophobicContact CD1-CE2 4.37Å; L3529-F3565 HydrophobicContact CD1-CZ 3.95Å; L3529-F3565 HydrophobicContact CG-CE1 4.47Å
3530	V	86.8	Confident	77.8	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.006	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	-29	-176.1	175.2	0	0	0	0	113.2	N3528 L3564 L3566 W3635 T3642 S3743	N3528-V3530 HydrophobicContact CB-CG2 4.24Å; N3528-V3530 PolarHBondContact O-N 2.77Å; V3530-L3564 PolarHBondContact N-O 2.91Å; V3530-L3566 HydrophobicContact CB-CD1 4.1Å; V3530-L3566 HydrophobicContact CB-CG 4.03Å; V3530-L3566 HydrophobicContact CG1-CD1 4.19Å; V3530-L3566 HydrophobicContact CG2-CB 4.32Å; V3530-L3566 HydrophobicContact CG2-CD1 3.58Å; V3530-L3566 HydrophobicContact CG2-CG 3.62Å; V3530-W3635 HydrophobicContact CG2-CH2 3.85Å; V3530-W3635 HydrophobicContact CG2-CZ3 4.37Å; V3530-T3642 HydrophobicContact CG1-CG2 4.13Å; V3530-S3743 WeakPolarHBondContact O-CA 3.47Å; V3530-S3743 WeakPolarHBondContact O-CB 3.42Å
3531	D	89.8	Confident	75	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	155.2	-177.5	-173.1	18.4	0	0	0	110.6	W3533 L3564 T3642 R3649 C3746	D3531-W3533 HydrophobicContact CB-CZ3 4.36Å; D3531-L3564 HydrophobicContact CB-CB 4.19Å; D3531-L3564 HydrophobicContact CB-CD2 4.24Å; D3531-L3564 PolarHBondContact O-N 3.49Å; D3531-T3642 HydrophobicContact CB-CG2 3.7Å; D3531-R3649 IonicContact OD1-NH2 2.71Å; D3531-R3649 IonicContact OD2-CZ 2.7Å; D3531-R3649 IonicContact OD2-NH1 3.28Å; D3531-R3649 PolarHBondContact OD2-NH1 3.12Å; D3531-R3649 IonicContact OD2-NH2 2.79Å; D3531-R3649 PolarHBondContact OD2-NH2 3.43Å; D3531-C3746 HydrophobicContact CB-CB 4.03Å; D3531-C3746 VanDerWaalsContact CG-CB 3.47Å; D3531-C3746 VanDerWaalsContact OD1-CB 3.25Å; D3531-C3746 WeakPolarHBondContact OD1-CB 3.23Å
3532	W	91.6	Very high	72	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	143.5	170.2	67.7	90.2	0	0	0	111.3	V2694 E2712 V2717 L2731 F3561 T3562 Q3563 R3747	V2694-W3532 HydrophobicContact CG2-CD2 4.04Å; V2694-W3532 HydrophobicContact CG2-CE3 4.23Å; V2694-W3532 HydrophobicContact CG2-CH2 3.96Å; V2694-W3532 HydrophobicContact CG2-CZ2 3.71Å; V2694-W3532 HydrophobicContact CG2-CZ3 4.2Å; E2712-W3532 PolarHBondContact OE2-NE1 3.24Å; E2712-W3532 VanDerWaalsContact OE2-NE1 3.1Å; V2717-W3532 HydrophobicContact CG2-CZ3 3.97Å; L2731-W3532 HydrophobicContact CD1-CH2 4.37Å; L2731-W3532 HydrophobicContact CD1-CZ2 3.83Å; W3532-F3561 HydrophobicContact CB-CE2 3.85Å; W3532-F3561 HydrophobicContact CB-CZ 4.29Å; W3532-F3561 AromaticContact CD1-CE2 3.72Å; W3532-F3561 HydrophobicContact CG-CE2 4.05Å; W3532-F3561 HydrophobicContact CG-CZ 4.43Å; W3532-T3562 CarbonylContact C-O 3.59Å; W3532-T3562 WeakPolarHBondContact CA-O 2.71Å; W3532-T3562 VanDerWaalsContact CB-O 3.31Å; W3532-T3562 WeakPolarHBondContact CB-O 3.38Å; W3532-Q3563 HydrophobicContact CB-CG 4.16Å; W3532-R3747 HydrophobicContact CD2-CG 4.46Å; W3532-R3747 HydrophobicContact CH2-CG 4.2Å; W3532-R3747 HydrophobicContact CZ2-CG 3.87Å; W3532-R3747 VanDerWaalsContact CZ2-NE 3.31Å
3533	W	90.1	Very high	68.9	Low	17 Å²	17	48.8 Å²	48.8	6%	0.064	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	-178.7	-178.9	67.5	94.9	0	0	0	111	D3531 T3562 L3564	D3531-W3533 HydrophobicContact CB-CZ3 4.36Å; W3533-T3562 HydrophobicContact CD2-CG2 4.41Å; W3533-T3562 HydrophobicContact CH2-CG2 3.66Å; W3533-T3562 HydrophobicContact CZ2-CG2 3.44Å; W3533-T3562 VanDerWaalsContact CZ2-CG2 3.44Å; W3533-T3562 HydrophobicContact CZ3-CG2 4.23Å; W3533-T3562 PolarHBondContact N-O 3.09Å; W3533-T3562 PolarHBondContact O-N 3.41Å; W3533-L3564 HydrophobicContact CH2-CB 4.24Å; W3533-L3564 HydrophobicContact CZ3-CB 3.84Å
3534	S	84.3	Confident	66	Low	18 Å²	18	55.1 Å²	55.1	13%	0.126	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	146.5	175.7	-62.8	0	0	0	0	112.5	R2696 L3560	R2696-S3534 PolarHBondContact NH1-OG 2.82Å; R2696-S3534 PolarHBondContact NH2-OG 3.4Å; S3534-L3560 WeakPolarHBondContact CA-O 3.38Å
3535	Y	72.8	Confident	62.9	Low	121 Å²	121	60 Å²	60	48%	0.475	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	123.7	171.2	-168.3	-98.4	0	0	0	108.4	T3559 L3560	Y3535-T3559 CarbonylContact O-C 3.59Å; Y3535-T3559 WeakPolarHBondContact O-CA 3.45Å; Y3535-L3560 PolarHBondContact N-O 3.48Å; Y3535-L3560 PolarHBondContact O-N 3.17Å
3536	L	66.4	Low	60	Low	29 Å²	29	64.5 Å²	64.5	15%	0.152	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	123.8	161.8	-93.3	89.6	0	0	0	107.4	P2706 N2738 S3538 T3559	P2706-L3536 WeakPolarHBondContact O-CD2 3.11Å; N2738-L3536 HydrophobicContact CB-CD1 3.98Å; L3536-S3538 PolarHBondContact O-N 3.47Å; L3536-T3559 HydrophobicContact CD1-CG2 3.92Å; L3536-T3559 HydrophobicContact CG-CG2 3.84Å
3537	K	54.5	Low	57.1	Low	153 Å²	153	67.4 Å²	67.4	67%	0.665	41%	0.405	S	S	*	.			trans	-75.4	64.3	167.4	-152.3	179.8	-173.6	-173.7	0	108.6	T3558	K3537-T3558 WeakPolarHBondContact CB-O 3.3Å; K3537-T3558 PolarHBondContact N-O 2.62Å
3538	S	45.3	Very low	54.3	Low	55 Å²	55	73 Å²	73	39%	0.385	44%	0.44	S	S	.	.			trans	-75.7	130.8	169.8	59.9	0	0	0	0	108	L3536 F3540	L3536-S3538 PolarHBondContact O-N 3.47Å; S3538-F3540 PolarHBondContact O-N 3.37Å; S3538-F3540 WeakPolarHBondContact OG-CE2 3.21Å
3539	S	32	Very low	51.4	Low	115 Å²	115	79.7 Å²	79.7	80%	0.804	48%	0.481	S	S	*	.			trans	-55.5	88.3	159.1	35	0	0	0	0	108.1
3540	F	31.1	Very low	48.6	Very low	115 Å²	115	86.8 Å²	86.8	50%	0.504	51%	0.514	S	S	.	.			trans	-59.8	129.9	164.4	-83	-84	0	0	0	106.4	S3538 S3542 L3656	S3538-F3540 PolarHBondContact O-N 3.37Å; S3538-F3540 WeakPolarHBondContact OG-CE2 3.21Å; F3540-S3542 PolarHBondContact O-N 3.01Å; F3540-L3656 HydrophobicContact CE1-CD1 4.35Å; F3540-L3656 HydrophobicContact CE1-CD2 4.33Å; F3540-L3656 HydrophobicContact CZ-CD1 4.16Å
3541	P	29.2	Very low	45.8	Very low	120 Å²	120	93.6 Å²	93.6	78%	0.779	56%	0.556	S	S	*	*			trans	-66	94.7	172.8	26.8	-30	0	0	0	106.7	S3543	P3541-S3543 PolarHBondContact O-N 3.34Å
3542	S	27.3	Very low	42.8	Very low	103 Å²	103	102.1 Å²	102.1	72%	0.72	60%	0.596	S	S	*	*			trans	-49.7	125.3	152.5	50.6	0	0	0	0	105.9	F3540	F3540-S3542 PolarHBondContact O-N 3.01Å
3543	S	24.2	Very low	39.8	Very low	94 Å²	94	107.9 Å²	107.9	66%	0.657	63%	0.63	S	S	*	*	S	Bend	trans	-9.2	133.2	177	59.3	0	0	0	0	115.7	P3541 S3545	P3541-S3543 PolarHBondContact O-N 3.34Å; S3543-S3545 PolarHBondContact O-N 3.01Å
3544	P	27.8	Very low	37	Very low	133 Å²	133	111.6 Å²	111.6	86%	0.864	66%	0.657	S	S	*	*			trans	-57.5	102.2	-174.4	26.3	-33.5	0	0	0	110.1
3545	S	24.4	Very low	34.6	Very low	102 Å²	102	119.5 Å²	119.5	71%	0.713	69%	0.692	S	S	*	*			trans	-82.9	123.7	162.4	48.2	0	0	0	0	106.2	S3543	S3543-S3545 PolarHBondContact O-N 3.01Å
3546	P	29.7	Very low	33.2	Very low	116 Å²	116	118.9 Å²	118.9	75%	0.753	70%	0.696	S	S	*	*			trans	-73	145.2	-179.4	29.1	-30.5	0	0	0	109.2
3547	S	26.7	Very low	32.4	Very low	112 Å²	112	119.4 Å²	119.4	78%	0.783	70%	0.702	S	S	*	*			trans	72.3	102.5	172.3	73.1	0	0	0	0	116.2
3548	T	30.9	Very low	32.9	Very low	117 Å²	117	115 Å²	115	72%	0.718	69%	0.688	S	S	*	*				-166.6	121.4	115.9	-51.9	0	0	0	0	108.2	Q3550	T3548-Q3550 HydrophobicContact CG2-CG 4.06Å; T3548-Q3550 PolarHBondContact O-N 2.95Å
3549	T	27.7	Very low	34.5	Very low	147 Å²	147	112.4 Å²	112.4	90%	0.902	67%	0.67	S	S	*	*			trans	-71	90.4	169.3	46.7	0	0	0	0	109.2
3550	Q	28.4	Very low	37.2	Very low	154 Å²	154	108.8 Å²	108.8	72%	0.72	64%	0.641	S	S	*	*			trans	-116.6	126.1	162.8	-74.4	-175	4.1	0	0	108.1	T3548 E3552	T3548-Q3550 HydrophobicContact CG2-CG 4.06Å; T3548-Q3550 PolarHBondContact O-N 2.95Å; Q3550-E3552 VanDerWaalsContact C-N 3.34Å; Q3550-E3552 PolarHBondContact O-N 3.28Å
3551	T	27.4	Very low	40	Very low	145 Å²	145	103.3 Å²	103.3	89%	0.89	62%	0.617	S	S	*	*			trans	-52.5	95.2	168.3	37.9	0	0	0	0	109.2	V3553	T3551-V3553 PolarHBondContact O-N 2.75Å
3552	E	27.6	Very low	43.1	Very low	179 Å²	179	97.6 Å²	97.6	84%	0.836	58%	0.58	S	S	*	*			trans	-64.7	106	170.7	-70	-169.6	166.8	0	0	107.9	Q3550 P3554	Q3550-E3552 VanDerWaalsContact C-N 3.34Å; Q3550-E3552 PolarHBondContact O-N 3.28Å; E3552-P3554 WeakPolarHBondContact O-CD 3.17Å
3553	V	27.8	Very low	46.2	Very low	120 Å²	120	92.7 Å²	92.7	73%	0.727	55%	0.546	S	S	*	.			trans	-58.4	124.2	158.7	177.8	0	0	0	0	105.7	T3551 Q3555	T3551-V3553 PolarHBondContact O-N 2.75Å; V3553-Q3555 VanDerWaalsContact C-N 3.35Å; V3553-Q3555 PolarHBondContact O-N 2.93Å
3554	P	31.6	Very low	49.5	Very low	95 Å²	95	88.3 Å²	88.3	62%	0.617	52%	0.515	S	S	*	.			trans	-61.6	99.3	178.8	22.8	-30.4	0	0	0	108.3	E3552 L3556	E3552-P3554 WeakPolarHBondContact O-CD 3.17Å; P3554-L3556 PolarHBondContact O-N 3.43Å
3555	Q	34.4	Very low	52.6	Low	184 Å²	184	82 Å²	82	86%	0.86	47%	0.474	S	S	*	.			trans	-65.7	117.9	172.2	-74.2	-175.1	-11.8	0	0	106.5	V3553 S3557	V3553-Q3555 VanDerWaalsContact C-N 3.35Å; V3553-Q3555 PolarHBondContact O-N 2.93Å; Q3555-S3557 PolarHBondContact O-N 3.26Å; Q3555-S3557 VanDerWaalsContact O-N 3.14Å
3556	L	42	Very low	55.8	Low	108 Å²	108	77.1 Å²	77.1	57%	0.565	44%	0.44	S	S	*	.			trans	-47.6	125.6	173	-83.9	106.1	0	0	0	109	P3554 T3558	P3554-L3556 PolarHBondContact O-N 3.43Å; L3556-T3558 PolarHBondContact O-N 3.01Å
3557	S	51.4	Low	58.7	Low	40 Å²	40	71.7 Å²	71.7	28%	0.28	41%	0.405	S	S	.	.			trans	-60.3	101.2	172.4	39.2	0	0	0	0	108.8	P2706 Q3555 T3559	P2706-S3557 VanDerWaalsContact O-CB 3.25Å; P2706-S3557 WeakPolarHBondContact O-CB 3.22Å; P2706-S3557 PolarHBondContact O-OG 2.95Å; Q3555-S3557 PolarHBondContact O-N 3.26Å; Q3555-S3557 VanDerWaalsContact O-N 3.14Å; S3557-T3559 PolarHBondContact O-N 3.08Å
3558	T	64.7	Low	61.4	Low	61 Å²	61	67.3 Å²	67.3	37%	0.374	37%	0.374	S	S	.	.			trans	-78.6	113.2	178.1	44.8	0	0	0	0	108.8	K3537 L3556	K3537-T3558 WeakPolarHBondContact CB-O 3.3Å; K3537-T3558 PolarHBondContact N-O 2.62Å; L3556-T3558 PolarHBondContact O-N 3.01Å
3559	T	78.4	Confident	63.9	Low	1 Å²	1	67.3 Å²	67.3	1%	0.006	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	119.3	169.8	56.1	0	0	0	0	109.6	M2698 P2708 I2710 Y3535 L3536 S3557	M2698-T3559 WeakPolarHBondContact CE-OG1 3.47Å; P2708-T3559 HydrophobicContact CG-CG2 4.07Å; I2710-T3559 HydrophobicContact CD1-CG2 4.37Å; Y3535-T3559 CarbonylContact O-C 3.59Å; Y3535-T3559 WeakPolarHBondContact O-CA 3.45Å; L3536-T3559 HydrophobicContact CD1-CG2 3.92Å; L3536-T3559 HydrophobicContact CG-CG2 3.84Å; S3557-T3559 PolarHBondContact O-N 3.08Å
3560	L	87.6	Confident	66.6	Low	38 Å²	38	62.2 Å²	62.2	20%	0.199	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	122.9	174.3	-172.9	72.1	0	0	0	110.2	S3534 Y3535 T3612 Q3617	S3534-L3560 WeakPolarHBondContact CA-O 3.38Å; Y3535-L3560 PolarHBondContact N-O 3.48Å; Y3535-L3560 PolarHBondContact O-N 3.17Å; L3560-T3612 HydrophobicContact CD1-CG2 3.95Å; L3560-Q3617 HydrophobicContact CD1-CB 4.06Å; L3560-Q3617 HydrophobicContact CD2-CB 3.89Å; L3560-Q3617 HydrophobicContact CG-CB 4.04Å
3561	F	91.5	Very high	69.3	Low	0 Å²	0	58.7 Å²	58.7	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	117.6	170.1	179.3	-141.8	0	0	0	109.9	I2689 V2694 W3532 Q3563 N3615 L3616 Q3617	I2689-F3561 HydrophobicContact CD1-CB 4.12Å; I2689-F3561 HydrophobicContact CG2-CD1 3.92Å; V2694-F3561 HydrophobicContact CB-CZ 4.32Å; V2694-F3561 HydrophobicContact CG1-CZ 4.06Å; W3532-F3561 HydrophobicContact CB-CE2 3.85Å; W3532-F3561 HydrophobicContact CB-CZ 4.29Å; W3532-F3561 AromaticContact CD1-CE2 3.72Å; W3532-F3561 HydrophobicContact CG-CE2 4.05Å; W3532-F3561 HydrophobicContact CG-CZ 4.43Å; F3561-Q3563 HydrophobicContact CE1-CG 3.84Å; F3561-Q3563 HydrophobicContact CE2-CG 4.21Å; F3561-Q3563 HydrophobicContact CZ-CG 3.65Å; F3561-N3615 PolarHBondContact N-O 3.39Å; F3561-L3616 HydrophobicContact CB-CD1 4.43Å; F3561-L3616 HydrophobicContact CD1-CD1 3.43Å; F3561-L3616 VanDerWaalsContact CD1-CD1 3.43Å; F3561-L3616 HydrophobicContact CE1-CD1 3.99Å; F3561-L3616 HydrophobicContact CG-CD1 4.21Å; F3561-L3616 CarbonylContact O-C 3.45Å; F3561-L3616 WeakPolarHBondContact O-CA 3.23Å; F3561-Q3617 PolarHBondContact O-N 2.88Å
3562	T	92.8	Very high	72.2	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	129.9	-178.3	-54.8	0	0	0	0	110.8	W3532 W3533 Q3617 R3619	W3532-T3562 CarbonylContact C-O 3.59Å; W3532-T3562 WeakPolarHBondContact CA-O 2.71Å; W3532-T3562 VanDerWaalsContact CB-O 3.31Å; W3532-T3562 WeakPolarHBondContact CB-O 3.38Å; W3533-T3562 HydrophobicContact CD2-CG2 4.41Å; W3533-T3562 HydrophobicContact CH2-CG2 3.66Å; W3533-T3562 HydrophobicContact CZ2-CG2 3.44Å; W3533-T3562 VanDerWaalsContact CZ2-CG2 3.44Å; W3533-T3562 HydrophobicContact CZ3-CG2 4.23Å; W3533-T3562 PolarHBondContact N-O 3.09Å; W3533-T3562 PolarHBondContact O-N 3.41Å; T3562-Q3617 CarbonylContact C-O 3.56Å; T3562-Q3617 VanDerWaalsContact CA-O 3.26Å; T3562-Q3617 WeakPolarHBondContact CA-O 3.39Å; T3562-Q3617 HydrophobicContact CG2-CB 4.44Å; T3562-Q3617 HydrophobicContact CG2-CG 4.35Å; T3562-R3619 HydrophobicContact CG2-CG 3.78Å
3563	Q	93.2	Very high	75.1	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	133.3	170.2	-62.2	-167.5	-68.8	0	0	110.1	G2691 I2692 L3529 W3532 F3561 F3565 Q3617 W3618 R3619	G2691-Q3563 VanDerWaalsContact CA-OE1 3.32Å; I2692-Q3563 VanDerWaalsContact N-OE1 3.08Å; I2692-Q3563 PolarHBondContact O-NE2 2.97Å; L3529-Q3563 HydrophobicContact CD1-CB 3.81Å; L3529-Q3563 HydrophobicContact CD1-CG 4.36Å; W3532-Q3563 HydrophobicContact CB-CG 4.16Å; F3561-Q3563 HydrophobicContact CE1-CG 3.84Å; F3561-Q3563 HydrophobicContact CE2-CG 4.21Å; F3561-Q3563 HydrophobicContact CZ-CG 3.65Å; Q3563-F3565 HydrophobicContact CB-CE2 3.71Å; Q3563-F3565 HydrophobicContact CB-CZ 4.11Å; Q3563-Q3617 PolarHBondContact N-O 2.82Å; Q3563-W3618 CarbonylContact O-C 3.51Å; Q3563-W3618 WeakPolarHBondContact O-CA 3.15Å; Q3563-R3619 PolarHBondContact O-N 3.42Å
3564	L	93.5	Very high	78	Confident	2 Å²	2	46.2 Å²	46.2	1%	0.01	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	123.4	179.8	178.8	70.5	0	0	0	110.9	V3530 D3531 W3533 L3566 R3619 R3621 T3642	V3530-L3564 PolarHBondContact N-O 2.91Å; D3531-L3564 HydrophobicContact CB-CB 4.19Å; D3531-L3564 HydrophobicContact CB-CD2 4.24Å; D3531-L3564 PolarHBondContact O-N 3.49Å; W3533-L3564 HydrophobicContact CH2-CB 4.24Å; W3533-L3564 HydrophobicContact CZ3-CB 3.84Å; L3564-L3566 HydrophobicContact CG-CD2 4.47Å; L3564-R3619 CarbonylContact C-O 3.54Å; L3564-R3619 WeakPolarHBondContact CA-O 3.44Å; L3564-R3619 HydrophobicContact CD1-CB 3.72Å; L3564-R3621 HydrophobicContact CD1-CB 4Å; L3564-T3642 HydrophobicContact CD2-CG2 3.51Å
3565	F	93.1	Very high	80.7	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	135.4	177.6	-60.1	-92.9	0	0	0	110.1	I2692 V3491 V3524 T3527 N3528 L3529 Q3563 W3618 R3619 I3620 R3621	I2692-F3565 HydrophobicContact CB-CE1 4.41Å; I2692-F3565 HydrophobicContact CB-CZ 4.36Å; I2692-F3565 HydrophobicContact CD1-CE1 3.68Å; I2692-F3565 HydrophobicContact CD1-CZ 3.71Å; I2692-F3565 HydrophobicContact CG1-CZ 4.45Å; V3491-F3565 HydrophobicContact CG2-CD1 4.5Å; V3491-F3565 HydrophobicContact CG2-CE1 4.31Å; V3524-F3565 HydrophobicContact CG1-CD1 4.2Å; V3524-F3565 HydrophobicContact CG1-CE1 4.08Å; T3527-F3565 WeakPolarHBondContact OG1-CD1 3.31Å; N3528-F3565 CarbonylContact O-C 3.56Å; N3528-F3565 WeakPolarHBondContact O-CA 3.31Å; L3529-F3565 HydrophobicContact CB-CD1 4.11Å; L3529-F3565 HydrophobicContact CB-CE1 3.9Å; L3529-F3565 HydrophobicContact CD1-CD1 4.4Å; L3529-F3565 HydrophobicContact CD1-CE1 3.98Å; L3529-F3565 HydrophobicContact CD1-CE2 4.37Å; L3529-F3565 HydrophobicContact CD1-CZ 3.95Å; L3529-F3565 HydrophobicContact CG-CE1 4.47Å; Q3563-F3565 HydrophobicContact CB-CE2 3.71Å; Q3563-F3565 HydrophobicContact CB-CZ 4.11Å; F3565-W3618 HydrophobicContact CD2-CB 4.24Å; F3565-W3618 HydrophobicContact CD2-CG 4.43Å; F3565-W3618 HydrophobicContact CE2-CB 3.86Å; F3565-W3618 AromaticContact CE2-CD1 3.8Å; F3565-W3618 AromaticContact CE2-CD2 3.87Å; F3565-W3618 HydrophobicContact CE2-CD2 3.87Å; F3565-W3618 HydrophobicContact CE2-CE3 4.48Å; F3565-W3618 AromaticContact CE2-CG 3.59Å; F3565-W3618 HydrophobicContact CE2-CG 3.59Å; F3565-W3618 HydrophobicContact CZ-CD2 4.21Å; F3565-W3618 HydrophobicContact CZ-CG 4.34Å; F3565-R3619 PolarHBondContact N-O 2.93Å; F3565-I3620 HydrophobicContact CB-CG1 4.38Å; F3565-I3620 CarbonylContact O-C 3.54Å; F3565-I3620 WeakPolarHBondContact O-CA 3.49Å; F3565-R3621 PolarHBondContact O-N 2.9Å
3566	L	91.3	Very high	83.3	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	129.1	172.5	-56.7	-170.9	0	0	0	109.7	T3527 N3528 V3530 L3564 R3621 W3635 L3638 V3639	T3527-L3566 WeakPolarHBondContact CA-O 3.36Å; N3528-L3566 PolarHBondContact N-O 3.39Å; N3528-L3566 PolarHBondContact O-N 3.46Å; V3530-L3566 HydrophobicContact CB-CD1 4.1Å; V3530-L3566 HydrophobicContact CB-CG 4.03Å; V3530-L3566 HydrophobicContact CG1-CD1 4.19Å; V3530-L3566 HydrophobicContact CG2-CB 4.32Å; V3530-L3566 HydrophobicContact CG2-CD1 3.58Å; V3530-L3566 HydrophobicContact CG2-CG 3.62Å; L3564-L3566 HydrophobicContact CG-CD2 4.47Å; L3566-R3621 HydrophobicContact CD2-CB 3.88Å; L3566-R3621 HydrophobicContact CD2-CG 4.3Å; L3566-W3635 HydrophobicContact CB-CZ3 4.23Å; L3566-W3635 HydrophobicContact CD1-CE3 4.36Å; L3566-W3635 HydrophobicContact CD1-CZ3 4.13Å; L3566-L3638 HydrophobicContact CB-CD1 4.41Å; L3566-L3638 HydrophobicContact CD1-CB 3.85Å; L3566-L3638 HydrophobicContact CD2-CB 4.18Å; L3566-V3639 HydrophobicContact CD1-CG2 3.84Å
3567	S	90.8	Very high	85.5	Confident	2 Å²	2	37 Å²	37	1%	0.014	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	112.2	173.7	-163	0	0	0	0	110.3	R3621	S3567-R3621 PolarHBondContact N-O 2.92Å
3568	T	83.3	Confident	87.3	Confident	21 Å²	21	39.3 Å²	39.3	13%	0.129	20%	0.196	C	C	.	.	S	Bend	trans	-107.6	-20.8	178.1	52.2	0	0	0	0	113.1	Y3490 W3635 L3638	Y3490-T3568 PolarHBondContact OH-OG1 3.48Å; T3568-W3635 HydrophobicContact CG2-CB 4.21Å; T3568-W3635 HydrophobicContact CG2-CE3 3.88Å; T3568-L3638 HydrophobicContact CG2-CD1 4.43Å
3569	K	83	Confident	88.5	Confident	116 Å²	116	36.4 Å²	36.4	50%	0.504	18%	0.179	S	C	.	.	S	Bend	trans	-93.1	-25.6	179.3	-64.1	-167.6	-162.5	163.5	0	113.7	Y3490 D3526	Y3490-K3569 HydrophobicContact CE1-CG 4.46Å; D3526-K3569 HydrophobicContact CB-CB 4.47Å; D3526-K3569 HydrophobicContact CB-CD 4.08Å; D3526-K3569 IonicContact OD1-NZ 3.55Å; D3526-K3569 PolarHBondContact OD1-NZ 2.79Å
3570	K	84.5	Confident	88.9	Confident	40 Å²	40	39.2 Å²	39.2	17%	0.174	20%	0.202	C	C	.	.	S	Bend	trans	-109.1	140.7	-178.6	-59.4	172.9	175.6	171.5	0	109.4	S3521 I3522 S3525 Y3622	S3521-K3570 PolarHBondContact O-NZ 3.19Å; I3522-K3570 PolarHBondContact O-NZ 3.45Å; S3525-K3570 VanDerWaalsContact O-CE 3.3Å; S3525-K3570 WeakPolarHBondContact O-CE 3.22Å; S3525-K3570 PolarHBondContact O-NZ 2.91Å; S3525-K3570 PolarHBondContact OG-NZ 2.78Å; K3570-Y3622 HydrophobicContact CB-CE1 4.4Å; K3570-Y3622 WeakPolarHBondContact O-CD1 3.46Å
3571	D	86	Confident	88.8	Confident	80 Å²	80	42.9 Å²	42.9	43%	0.428	23%	0.226	S	C	.	.			trans	-86.5	152.2	170.3	178.9	33.8	0	0	0	110.6	H3573 S3574 T3575	D3571-H3573 VanDerWaalsContact C-N 3.34Å; D3571-H3573 PolarHBondContact O-N 2.71Å; D3571-H3573 PolarHBondContact OD2-N 2.83Å; D3571-S3574 PolarHBondContact N-OG 2.67Å; D3571-S3574 PolarHBondContact O-N 2.79Å; D3571-S3574 PolarHBondContact O-OG 3.47Å; D3571-T3575 PolarHBondContact O-N 2.89Å; D3571-T3575 VanDerWaalsContact O-N 3.16Å; D3571-T3575 PolarHBondContact O-OG1 3.4Å; D3571-T3575 VanDerWaalsContact O-OG1 3.09Å
3572	F	88.3	Confident	88.5	Confident	18 Å²	18	45.8 Å²	45.8	8%	0.079	24%	0.241	C	C	.	.	H	α-helix	trans	-59.2	-45.9	177	179	-99.9	0	0	0	111.1	S3574 T3575 V3576 I3599 K3607 Y3622	F3572-S3574 VanDerWaalsContact C-N 3.34Å; F3572-S3574 PolarHBondContact O-N 2.84Å; F3572-T3575 PolarHBondContact O-N 2.61Å; F3572-V3576 HydrophobicContact CD1-CG2 4.23Å; F3572-V3576 HydrophobicContact CD2-CG2 4.44Å; F3572-V3576 HydrophobicContact CE1-CG2 3.81Å; F3572-V3576 HydrophobicContact CE2-CG2 4.05Å; F3572-V3576 HydrophobicContact CZ-CG2 3.71Å; F3572-V3576 WeakPolarHBondContact O-CG2 3.18Å; F3572-V3576 PolarHBondContact O-N 2.92Å; F3572-I3599 HydrophobicContact CE2-CG2 4.4Å; F3572-I3599 HydrophobicContact CZ-CD1 4.26Å; F3572-I3599 HydrophobicContact CZ-CG1 4.39Å; F3572-I3599 HydrophobicContact CZ-CG2 3.8Å; F3572-K3607 HydrophobicContact CB-CD 4.42Å; F3572-K3607 HydrophobicContact CD1-CD 3.59Å; F3572-K3607 HydrophobicContact CD2-CB 3.95Å; F3572-K3607 HydrophobicContact CD2-CD 4.5Å; F3572-K3607 HydrophobicContact CE1-CD 3.92Å; F3572-K3607 HydrophobicContact CE2-CB 4.23Å; F3572-K3607 HydrophobicContact CG-CB 4.1Å; F3572-K3607 HydrophobicContact CG-CD 3.92Å; F3572-K3607 HydrophobicContact CZ-CD 4.49Å; F3572-Y3622 HydrophobicContact CB-CD1 4.27Å; F3572-Y3622 HydrophobicContact CB-CD2 4.32Å; F3572-Y3622 HydrophobicContact CB-CG 3.89Å; F3572-Y3622 AromaticContact CD2-CD2 3.68Å; F3572-Y3622 HydrophobicContact CD2-CD2 3.68Å; F3572-Y3622 HydrophobicContact CD2-CE2 4.1Å; F3572-Y3622 HydrophobicContact CD2-CG 4.14Å; F3572-Y3622 HydrophobicContact CG-CD2 4.5Å
3573	H	87.8	Confident	88	Confident	114 Å²	114	48.9 Å²	48.9	53%	0.528	27%	0.273	S	S	.	.	H	α-helix	trans	-67.3	-34.9	-177.2	-67.5	-40.5	0	0	0	112.7	D3571 K3577	D3571-H3573 VanDerWaalsContact C-N 3.34Å; D3571-H3573 PolarHBondContact O-N 2.71Å; D3571-H3573 PolarHBondContact OD2-N 2.83Å; H3573-K3577 VanDerWaalsContact O-CB 3.32Å; H3573-K3577 WeakPolarHBondContact O-CB 3.48Å; H3573-K3577 PolarHBondContact O-N 2.84Å
3574	S	88.5	Confident	87.5	Confident	50 Å²	50	49.9 Å²	49.9	35%	0.35	28%	0.277	S	S	.	.	H	α-helix	trans	-69.2	-38.3	176.2	69.5	0	0	0	0	112	D3571 F3572 K3577 Q3578	D3571-S3574 PolarHBondContact N-OG 2.67Å; D3571-S3574 PolarHBondContact O-N 2.79Å; D3571-S3574 PolarHBondContact O-OG 3.47Å; F3572-S3574 VanDerWaalsContact C-N 3.34Å; F3572-S3574 PolarHBondContact O-N 2.84Å; S3574-K3577 PolarHBondContact O-N 2.99Å; S3574-Q3578 WeakPolarHBondContact O-CG 3.43Å; S3574-Q3578 PolarHBondContact O-N 2.8Å
3575	T	88.8	Confident	86.9	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.006	31%	0.314	C	S	.	.	H	α-helix	trans	-67.6	-46	177.3	-55	0	0	0	0	111.2	I3522 D3571 F3572 K3577 Q3578 L3579 Y3622	I3522-T3575 HydrophobicContact CG2-CG2 3.89Å; D3571-T3575 PolarHBondContact O-N 2.89Å; D3571-T3575 VanDerWaalsContact O-N 3.16Å; D3571-T3575 PolarHBondContact O-OG1 3.4Å; D3571-T3575 VanDerWaalsContact O-OG1 3.09Å; F3572-T3575 PolarHBondContact O-N 2.61Å; T3575-K3577 VanDerWaalsContact C-N 3.29Å; T3575-K3577 PolarHBondContact O-N 2.74Å; T3575-Q3578 PolarHBondContact O-N 2.82Å; T3575-L3579 HydrophobicContact CG2-CD1 4.22Å; T3575-L3579 WeakPolarHBondContact O-CG 3.36Å; T3575-L3579 PolarHBondContact O-N 2.81Å; T3575-Y3622 WeakPolarHBondContact CG2-OH 3.39Å
3576	V	88.7	Confident	86.3	Confident	41 Å²	41	59.3 Å²	59.3	25%	0.248	32%	0.322	C	S	.	.	H	α-helix	trans	-60.8	-40.1	176.2	173.1	0	0	0	0	111.1	F3572 L3579 A3580 L3586	F3572-V3576 HydrophobicContact CD1-CG2 4.23Å; F3572-V3576 HydrophobicContact CD2-CG2 4.44Å; F3572-V3576 HydrophobicContact CE1-CG2 3.81Å; F3572-V3576 HydrophobicContact CE2-CG2 4.05Å; F3572-V3576 HydrophobicContact CZ-CG2 3.71Å; F3572-V3576 WeakPolarHBondContact O-CG2 3.18Å; F3572-V3576 PolarHBondContact O-N 2.92Å; V3576-L3579 PolarHBondContact O-N 2.75Å; V3576-A3580 WeakPolarHBondContact O-CB 3.27Å; V3576-A3580 PolarHBondContact O-N 3.08Å; V3576-L3586 HydrophobicContact CG2-CD1 4.29Å
3577	K	89.1	Confident	85.9	Confident	153 Å²	153	63.9 Å²	63.9	67%	0.665	35%	0.351	S	S	*	.	H	α-helix	trans	-62.5	-43.7	175.1	-173	178.6	-179.3	-179.7	0	112	H3573 S3574 T3575 L3579 A3580 T3581	H3573-K3577 VanDerWaalsContact O-CB 3.32Å; H3573-K3577 WeakPolarHBondContact O-CB 3.48Å; H3573-K3577 PolarHBondContact O-N 2.84Å; S3574-K3577 PolarHBondContact O-N 2.99Å; T3575-K3577 VanDerWaalsContact C-N 3.29Å; T3575-K3577 PolarHBondContact O-N 2.74Å; K3577-L3579 VanDerWaalsContact C-N 3.35Å; K3577-A3580 PolarHBondContact O-N 3.05Å; K3577-T3581 PolarHBondContact O-N 2.78Å; K3577-T3581 PolarHBondContact O-OG1 3.27Å
3578	Q	89.3	Confident	85.5	Confident	88 Å²	88	66 Å²	66	41%	0.411	36%	0.362	S	S	.	.	H	α-helix	trans	-63.6	-39.4	177	-74.3	177	-1.6	0	0	112.5	I3522 S3574 T3575 T3581 L3582	I3522-Q3578 HydrophobicContact CD1-CB 4.25Å; I3522-Q3578 HydrophobicContact CG1-CB 4.46Å; I3522-Q3578 HydrophobicContact CG2-CB 4.08Å; S3574-Q3578 WeakPolarHBondContact O-CG 3.43Å; S3574-Q3578 PolarHBondContact O-N 2.8Å; T3575-Q3578 PolarHBondContact O-N 2.82Å; Q3578-T3581 WeakPolarHBondContact O-CB 3.39Å; Q3578-T3581 PolarHBondContact O-N 2.84Å; Q3578-L3582 PolarHBondContact O-N 2.85Å
3579	L	88.2	Confident	85.4	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-64.5	-42.8	174.3	-69.8	170.3	0	0	0	111.5	L3519 I3522 L3523 T3575 V3576 K3577 T3581 L3582 G3583 F3584 L3586 L3609	L3519-L3579 HydrophobicContact CD2-CD2 3.88Å; I3522-L3579 HydrophobicContact CG2-CD2 3.95Å; I3522-L3579 HydrophobicContact CG2-CG 4.03Å; L3523-L3579 HydrophobicContact CD2-CD1 3.81Å; L3523-L3579 HydrophobicContact CD2-CD2 4.13Å; L3523-L3579 HydrophobicContact CD2-CG 4.48Å; L3523-L3579 HydrophobicContact CG-CD2 4.34Å; T3575-L3579 HydrophobicContact CG2-CD1 4.22Å; T3575-L3579 WeakPolarHBondContact O-CG 3.36Å; T3575-L3579 PolarHBondContact O-N 2.81Å; V3576-L3579 PolarHBondContact O-N 2.75Å; K3577-L3579 VanDerWaalsContact C-N 3.35Å; L3579-T3581 VanDerWaalsContact C-N 3.31Å; L3579-T3581 PolarHBondContact O-N 3.23Å; L3579-L3582 CarbonylContact O-C 3.58Å; L3579-L3582 PolarHBondContact O-N 2.9Å; L3579-L3582 VanDerWaalsContact O-N 3.09Å; L3579-G3583 PolarHBondContact O-N 3.13Å; L3579-F3584 HydrophobicContact CB-CB 4.23Å; L3579-F3584 WeakPolarHBondContact O-CB 3.44Å; L3579-F3584 PolarHBondContact O-N 2.83Å; L3579-L3586 HydrophobicContact CD1-CD1 3.84Å; L3579-L3609 HydrophobicContact CD1-CD2 3.99Å
3580	A	86.8	Confident	85.2	Confident	59 Å²	59	67.4 Å²	67.4	49%	0.488	36%	0.364	S	S	.	.	H	α-helix	trans	-61.2	-38.3	174.4	0	0	0	0	0	112.1	V3576 K3577 L3582 G3583	V3576-A3580 WeakPolarHBondContact O-CB 3.27Å; V3576-A3580 PolarHBondContact O-N 3.08Å; K3577-A3580 PolarHBondContact O-N 3.05Å; A3580-L3582 VanDerWaalsContact C-N 3.26Å; A3580-L3582 PolarHBondContact O-N 3.41Å; A3580-G3583 WeakPolarHBondContact O-CA 3.37Å; A3580-G3583 PolarHBondContact O-N 2.84Å
3581	T	86.9	Confident	84.6	Confident	116 Å²	116	76 Å²	76	71%	0.712	40%	0.396	S	S	*	.	H	α-helix	trans	-62.8	-31	174.2	-53.6	0	0	0	0	112.8	K3577 Q3578 L3579 G3583	K3577-T3581 PolarHBondContact O-N 2.78Å; K3577-T3581 PolarHBondContact O-OG1 3.27Å; Q3578-T3581 WeakPolarHBondContact O-CB 3.39Å; Q3578-T3581 PolarHBondContact O-N 2.84Å; L3579-T3581 VanDerWaalsContact C-N 3.31Å; L3579-T3581 PolarHBondContact O-N 3.23Å; T3581-G3583 PolarHBondContact O-N 3.41Å
3582	L	83.8	Confident	83.8	Confident	61 Å²	61	78.5 Å²	78.5	32%	0.319	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	0.3	172.5	-72.8	-175.5	0	0	0	113.6	K3518 L3519 I3522 Q3578 L3579 A3580 F3584	K3518-L3582 HydrophobicContact CB-CD1 4.25Å; L3519-L3582 HydrophobicContact CD2-CD1 4.46Å; I3522-L3582 HydrophobicContact CD1-CD1 3.25Å; I3522-L3582 HydrophobicContact CD1-CG 4.03Å; Q3578-L3582 PolarHBondContact O-N 2.85Å; L3579-L3582 CarbonylContact O-C 3.58Å; L3579-L3582 PolarHBondContact O-N 2.9Å; L3579-L3582 VanDerWaalsContact O-N 3.09Å; A3580-L3582 VanDerWaalsContact C-N 3.26Å; A3580-L3582 PolarHBondContact O-N 3.41Å; L3582-F3584 HydrophobicContact CB-CD2 3.66Å; L3582-F3584 HydrophobicContact CB-CE2 3.78Å; L3582-F3584 HydrophobicContact CD1-CE2 4.38Å
3583	G	83.4	Confident	83.1	Confident	64 Å²	64	79.6 Å²	79.6	66%	0.66	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.4	7.2	-179.7	0	0	0	0	0	115.2	L3579 A3580 T3581	L3579-G3583 PolarHBondContact O-N 3.13Å; A3580-G3583 WeakPolarHBondContact O-CA 3.37Å; A3580-G3583 PolarHBondContact O-N 2.84Å; T3581-G3583 PolarHBondContact O-N 3.41Å
3584	F	82.8	Confident	82.7	Confident	22 Å²	22	75.3 Å²	75.3	10%	0.096	41%	0.407	C	S	.	.			trans	-90.6	106.7	179.2	-62.2	-83.7	0	0	0	111.4	L3515 L3519 L3579 L3582 M3588	L3515-F3584 HydrophobicContact CD1-CE2 4.15Å; L3515-F3584 HydrophobicContact CD1-CZ 4.26Å; L3515-F3584 HydrophobicContact CD2-CZ 4.28Å; L3515-F3584 HydrophobicContact CG-CZ 4.47Å; L3519-F3584 HydrophobicContact CD1-CE1 4.25Å; L3519-F3584 HydrophobicContact CD1-CE2 4.16Å; L3519-F3584 HydrophobicContact CD1-CZ 3.65Å; L3519-F3584 HydrophobicContact CD2-CD2 3.79Å; L3519-F3584 HydrophobicContact CD2-CE1 4.3Å; L3519-F3584 HydrophobicContact CD2-CE2 3.4Å; L3519-F3584 VanDerWaalsContact CD2-CE2 3.4Å; L3519-F3584 HydrophobicContact CD2-CG 4.41Å; L3519-F3584 HydrophobicContact CD2-CZ 3.7Å; L3519-F3584 HydrophobicContact CG-CE2 3.96Å; L3519-F3584 HydrophobicContact CG-CZ 4Å; L3579-F3584 HydrophobicContact CB-CB 4.23Å; L3579-F3584 WeakPolarHBondContact O-CB 3.44Å; L3579-F3584 PolarHBondContact O-N 2.83Å; L3582-F3584 HydrophobicContact CB-CD2 3.66Å; L3582-F3584 HydrophobicContact CB-CE2 3.78Å; L3582-F3584 HydrophobicContact CD1-CE2 4.38Å; F3584-M3588 HydrophobicContact CD1-CE 3.49Å; F3584-M3588 VanDerWaalsContact CD1-CE 3.49Å; F3584-M3588 HydrophobicContact CD1-SD 3.66Å; F3584-M3588 HydrophobicContact CE1-CE 3.81Å; F3584-M3588 HydrophobicContact CE1-SD 4.34Å
3585	Q	80.3	Confident	82.6	Confident	169 Å²	169	73 Å²	73	79%	0.79	39%	0.391	S	S	*	.			trans	-94.2	111.6	171.9	-171.2	173	0.1	0	0	110.2	M3588	Q3585-M3588 WeakPolarHBondContact O-CB 3.18Å
3586	L	81.4	Confident	82.6	Confident	31 Å²	31	75.7 Å²	75.7	16%	0.162	41%	0.405	C	S	.	.	S	Bend	trans	-88	146.8	-173.1	-63.5	173.3	0	0	0	113	V3576 L3579 F3597 I3599 L3609	V3576-L3586 HydrophobicContact CG2-CD1 4.29Å; L3579-L3586 HydrophobicContact CD1-CD1 3.84Å; L3586-F3597 HydrophobicContact CD2-CB 3.29Å; L3586-F3597 HydrophobicContact CD2-CD1 4.14Å; L3586-F3597 HydrophobicContact CD2-CG 3.78Å; L3586-I3599 HydrophobicContact CB-CD1 3.5Å; L3586-I3599 HydrophobicContact CB-CG1 4.1Å; L3586-I3599 HydrophobicContact CD1-CD1 3.91Å; L3586-I3599 HydrophobicContact CD1-CG1 4.22Å; L3586-I3599 HydrophobicContact CG-CD1 4.37Å; L3586-L3609 HydrophobicContact CD1-CD1 3.85Å; L3586-L3609 HydrophobicContact CD2-CD1 4.45Å
3587	P	81.6	Confident	82.7	Confident	95 Å²	95	73.8 Å²	73.8	62%	0.617	39%	0.393	S	S	*	.	S	Bend	cis	-71.4	152.3	-7	31.9	-35.7	0	0	0	112	F3597	P3587-F3597 WeakPolarHBondContact CA-O 3.46Å; P3587-F3597 VanDerWaalsContact CB-O 3.28Å; P3587-F3597 WeakPolarHBondContact CB-O 3.42Å
3588	M	83.4	Confident	82.7	Confident	46 Å²	46	68.5 Å²	68.5	23%	0.227	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	145.1	-173	-163.5	-160.2	69.7	0	0	111.7	F3584 Q3585 D3590 N3596 F3597	F3584-M3588 HydrophobicContact CD1-CE 3.49Å; F3584-M3588 VanDerWaalsContact CD1-CE 3.49Å; F3584-M3588 HydrophobicContact CD1-SD 3.66Å; F3584-M3588 HydrophobicContact CE1-CE 3.81Å; F3584-M3588 HydrophobicContact CE1-SD 4.34Å; Q3585-M3588 WeakPolarHBondContact O-CB 3.18Å; M3588-D3590 HydrophobicContact CE-CB 3.75Å; M3588-N3596 PolarHBondContact O-OD1 2.88Å; M3588-F3597 HydrophobicContact CE-CD2 4.04Å; M3588-F3597 HydrophobicContact CE-CE2 4.26Å; M3588-F3597 PolarHBondContact N-O 2.89Å; M3588-F3597 PolarHBondContact O-N 2.91Å
3589	Y	81.4	Confident	82.6	Confident	139 Å²	139	67 Å²	67	55%	0.545	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	114.3	167.5	-178.8	-108.1	0	0	0	110.3	R3591 N3596	Y3589-R3591 HydrophobicContact CD1-CG 3.86Å; Y3589-R3591 HydrophobicContact CE1-CB 4.48Å; Y3589-R3591 HydrophobicContact CE1-CG 3.82Å; Y3589-R3591 PolarHBondContact O-N 2.78Å; Y3589-N3596 HydrophobicContact CD2-CB 3.82Å; Y3589-N3596 HydrophobicContact CE2-CB 4.37Å
3590	D	78.2	Confident	82.3	Confident	28 Å²	28	70 Å²	70	15%	0.15	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	108.5	172.8	-176.2	-4.4	0	0	0	109.6	M3588 V3592 N3593 G3594 I3595	M3588-D3590 HydrophobicContact CE-CB 3.75Å; D3590-V3592 VanDerWaalsContact C-N 3.28Å; D3590-V3592 PolarHBondContact O-N 3.24Å; D3590-V3592 WeakPolarHBondContact OD1-CB 3.07Å; D3590-V3592 PolarHBondContact OD1-N 2.86Å; D3590-N3593 PolarHBondContact OD1-N 2.85Å; D3590-N3593 WeakPolarHBondContact OD2-CB 3.12Å; D3590-N3593 PolarHBondContact OD2-ND2 2.9Å; D3590-G3594 VanDerWaalsContact O-CA 3.23Å; D3590-G3594 WeakPolarHBondContact O-CA 3.37Å; D3590-G3594 PolarHBondContact O-N 2.87Å; D3590-I3595 PolarHBondContact N-O 2.92Å; D3590-I3595 PolarHBondContact O-N 2.89Å
3591	R	71.7	Confident	81.7	Confident	221 Å²	221	73.4 Å²	73.4	83%	0.834	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-27.2	178.5	-68.7	-173.4	179.6	-171.5	1.1	113.1	Y3589	Y3589-R3591 HydrophobicContact CD1-CG 3.86Å; Y3589-R3591 HydrophobicContact CE1-CB 4.48Å; Y3589-R3591 HydrophobicContact CE1-CG 3.82Å; Y3589-R3591 PolarHBondContact O-N 2.78Å
3592	V	70.4	Confident	80.5	Confident	132 Å²	132	70.5 Å²	70.5	80%	0.8	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-48.7	-174.2	-177.8	0	0	0	0	110.1	D3590	D3590-V3592 VanDerWaalsContact C-N 3.28Å; D3590-V3592 PolarHBondContact O-N 3.24Å; D3590-V3592 WeakPolarHBondContact OD1-CB 3.07Å; D3590-V3592 PolarHBondContact OD1-N 2.86Å
3593	N	72.5	Confident	79.6	Confident	42 Å²	42	71.7 Å²	71.7	23%	0.225	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-11.8	-179.6	-62.5	-42.5	0	0	0	113.9	D3590 I3595 R3613	D3590-N3593 PolarHBondContact OD1-N 2.85Å; D3590-N3593 WeakPolarHBondContact OD2-CB 3.12Å; D3590-N3593 PolarHBondContact OD2-ND2 2.9Å; N3593-I3595 VanDerWaalsContact C-N 3.31Å; N3593-I3595 HydrophobicContact CB-CD1 3.97Å; N3593-I3595 HydrophobicContact CB-CG1 3.99Å; N3593-R3613 PolarHBondContact O-NE 3.23Å
3594	G	80.4	Confident	79.3	Confident	23 Å²	23	77.3 Å²	77.3	24%	0.237	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.5	22.1	-176.1	0	0	0	0	0	113.8	D3590	D3590-G3594 VanDerWaalsContact O-CA 3.23Å; D3590-G3594 WeakPolarHBondContact O-CA 3.37Å; D3590-G3594 PolarHBondContact O-N 2.87Å
3595	I	85.4	Confident	79.4	Confident	2 Å²	2	82 Å²	82	1%	0.01	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	124.5	-176.6	-59.5	174.9	0	0	0	109.7	F3476 D3590 N3593 F3597 I3611 R3613	F3476-I3595 HydrophobicContact CD1-CD1 4.16Å; F3476-I3595 HydrophobicContact CE1-CD1 4.04Å; D3590-I3595 PolarHBondContact N-O 2.92Å; D3590-I3595 PolarHBondContact O-N 2.89Å; N3593-I3595 VanDerWaalsContact C-N 3.31Å; N3593-I3595 HydrophobicContact CB-CD1 3.97Å; N3593-I3595 HydrophobicContact CB-CG1 3.99Å; I3595-F3597 HydrophobicContact CB-CE2 4.35Å; I3595-F3597 HydrophobicContact CG2-CD2 3.94Å; I3595-F3597 HydrophobicContact CG2-CE2 3.45Å; I3595-F3597 VanDerWaalsContact CG2-CE2 3.45Å; I3595-F3597 HydrophobicContact CG2-CZ 3.81Å; I3595-I3611 HydrophobicContact CG2-CG2 3.6Å; I3595-R3613 HydrophobicContact CG1-CB 4.34Å; I3595-R3613 HydrophobicContact CG1-CG 4.15Å
3596	N	89.3	Confident	79.8	Confident	58 Å²	58	74.5 Å²	74.5	31%	0.31	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	124.2	174.2	-171.7	7.1	0	0	0	110.8	M3588 Y3589 I3611 T3612	M3588-N3596 PolarHBondContact O-OD1 2.88Å; Y3589-N3596 HydrophobicContact CD2-CB 3.82Å; Y3589-N3596 HydrophobicContact CE2-CB 4.37Å; N3596-I3611 CarbonylContact O-C 3.59Å; N3596-I3611 WeakPolarHBondContact O-CA 3.27Å; N3596-T3612 PolarHBondContact N-O 2.73Å; N3596-T3612 PolarHBondContact O-N 3.46Å
3597	F	89.9	Confident	80.2	Confident	1 Å²	1	74.6 Å²	74.6	0%	0.004	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	125.9	172.3	-66.3	-91	0	0	0	111.4	L3519 L3523 L3586 P3587 M3588 I3595 W3610 I3611	L3519-F3597 HydrophobicContact CD2-CZ 4.45Å; L3523-F3597 HydrophobicContact CD1-CE1 3.66Å; L3523-F3597 HydrophobicContact CD1-CZ 4.09Å; L3523-F3597 HydrophobicContact CD2-CE1 4.36Å; L3586-F3597 HydrophobicContact CD2-CB 3.29Å; L3586-F3597 HydrophobicContact CD2-CD1 4.14Å; L3586-F3597 HydrophobicContact CD2-CG 3.78Å; P3587-F3597 WeakPolarHBondContact CA-O 3.46Å; P3587-F3597 VanDerWaalsContact CB-O 3.28Å; P3587-F3597 WeakPolarHBondContact CB-O 3.42Å; M3588-F3597 HydrophobicContact CE-CD2 4.04Å; M3588-F3597 HydrophobicContact CE-CE2 4.26Å; M3588-F3597 PolarHBondContact N-O 2.89Å; M3588-F3597 PolarHBondContact O-N 2.91Å; I3595-F3597 HydrophobicContact CB-CE2 4.35Å; I3595-F3597 HydrophobicContact CG2-CD2 3.94Å; I3595-F3597 HydrophobicContact CG2-CE2 3.45Å; I3595-F3597 VanDerWaalsContact CG2-CE2 3.45Å; I3595-F3597 HydrophobicContact CG2-CZ 3.81Å; F3597-W3610 CarbonylContact C-O 3.53Å; F3597-W3610 VanDerWaalsContact CA-O 3.31Å; F3597-W3610 WeakPolarHBondContact CA-O 3.31Å; F3597-I3611 HydrophobicContact CD1-CG1 3.88Å; F3597-I3611 HydrophobicContact CD1-CG2 4.35Å; F3597-I3611 HydrophobicContact CE1-CB 4.43Å; F3597-I3611 HydrophobicContact CE1-CD1 4.32Å; F3597-I3611 HydrophobicContact CE1-CG1 3.76Å; F3597-I3611 HydrophobicContact CE1-CG2 3.99Å; F3597-I3611 HydrophobicContact CZ-CG2 4.3Å
3598	T	90.1	Very high	80.7	Confident	41 Å²	41	70.3 Å²	70.3	25%	0.252	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	133.3	178.1	-50.2	0	0	0	0	109.9	M3600 W3610	T3598-M3600 HydrophobicContact CG2-CG 4.4Å; T3598-M3600 HydrophobicContact CG2-SD 4.33Å; T3598-W3610 PolarHBondContact N-O 3.14Å; T3598-W3610 PolarHBondContact O-N 2.63Å
3599	I	87.1	Confident	81.1	Confident	57 Å²	57	68.1 Å²	68.1	29%	0.292	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	129.3	172	-64.9	170.3	0	0	0	108.1	F3572 L3586 L3609	F3572-I3599 HydrophobicContact CE2-CG2 4.4Å; F3572-I3599 HydrophobicContact CZ-CD1 4.26Å; F3572-I3599 HydrophobicContact CZ-CG1 4.39Å; F3572-I3599 HydrophobicContact CZ-CG2 3.8Å; L3586-I3599 HydrophobicContact CB-CD1 3.5Å; L3586-I3599 HydrophobicContact CB-CG1 4.1Å; L3586-I3599 HydrophobicContact CD1-CD1 3.91Å; L3586-I3599 HydrophobicContact CD1-CG1 4.22Å; L3586-I3599 HydrophobicContact CG-CD1 4.37Å; I3599-L3609 HydrophobicContact CG1-CD1 3.98Å
3600	M	82	Confident	81.7	Confident	63 Å²	63	63.5 Å²	63.5	31%	0.31	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	115.5	177.7	-72.3	-64.8	-64.9	0	0	109.5	T3598 T3602 E3608 W3610	T3598-M3600 HydrophobicContact CG2-CG 4.4Å; T3598-M3600 HydrophobicContact CG2-SD 4.33Å; M3600-T3602 HydrophobicContact CB-CG2 3.92Å; M3600-T3602 HydrophobicContact CE-CG2 3.96Å; M3600-T3602 PolarHBondContact O-N 3.2Å; M3600-E3608 HydrophobicContact CB-CB 4.31Å; M3600-E3608 PolarHBondContact N-O 3.11Å; M3600-E3608 PolarHBondContact O-N 3.27Å; M3600-E3608 VanDerWaalsContact O-N 3.13Å; M3600-W3610 HydrophobicContact CB-CD2 4.49Å; M3600-W3610 HydrophobicContact CB-CZ2 4.14Å; M3600-W3610 HydrophobicContact CE-CH2 3.94Å; M3600-W3610 HydrophobicContact CE-CZ2 4.17Å; M3600-W3610 HydrophobicContact CG-CD2 3.62Å; M3600-W3610 VanDerWaalsContact CG-CE2 3.44Å; M3600-W3610 HydrophobicContact CG-CE3 3.93Å; M3600-W3610 HydrophobicContact CG-CG 4.19Å; M3600-W3610 HydrophobicContact CG-CH2 3.9Å; M3600-W3610 HydrophobicContact CG-CZ2 3.6Å; M3600-W3610 HydrophobicContact CG-CZ3 4.05Å; M3600-W3610 HydrophobicContact SD-CH2 4.3Å; M3600-W3610 HydrophobicContact SD-CZ3 4.38Å
3601	N	73.4	Confident	82.4	Confident	130 Å²	130	62.2 Å²	62.2	70%	0.695	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.9	76.3	-179.6	-148.5	20.9	0	0	0	108.3
3602	T	62.4	Low	83.4	Confident	56 Å²	56	52.9 Å²	52.9	34%	0.344	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	-27.6	-161.3	48.9	0	0	0	0	115.1	M3600 Y3606	M3600-T3602 HydrophobicContact CB-CG2 3.92Å; M3600-T3602 HydrophobicContact CE-CG2 3.96Å; M3600-T3602 PolarHBondContact O-N 3.2Å; T3602-Y3606 WeakPolarHBondContact OG1-CE2 3.47Å
3603	N	64.9	Low	84.3	Confident	86 Å²	86	47.3 Å²	47.3	46%	0.46	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	156.8	-171.1	-89.1	-43.4	0	0	0	113	K3605 Y3606	N3603-K3605 PolarHBondContact O-N 3.12Å; N3603-Y3606 HydrophobicContact CB-CD1 4.41Å; N3603-Y3606 HydrophobicContact CB-CE1 4.17Å; N3603-Y3606 PolarHBondContact ND2-OH 3.34Å; N3603-Y3606 VanDerWaalsContact ND2-OH 3.16Å; N3603-Y3606 VanDerWaalsContact O-O 3.06Å
3604	E	77.7	Confident	84.9	Confident	181 Å²	181	50.3 Å²	50.3	85%	0.846	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-31.8	171.8	-66.1	-169.8	162.7	0	0	112.3	N3624	E3604-N3624 PolarHBondContact O-ND2 3.21Å
3605	K	83.7	Confident	85.2	Confident	122 Å²	122	51.2 Å²	51.2	53%	0.53	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-27	-172.9	-62.3	-179.1	-179.4	178.4	0	115.2	N3603 N3624 V3637	N3603-K3605 PolarHBondContact O-N 3.12Å; K3605-N3624 PolarHBondContact O-N 3.2Å; K3605-V3637 HydrophobicContact CD-CG1 4.47Å
3606	Y	88.7	Confident	85.5	Confident	11 Å²	11	51.1 Å²	51.1	4%	0.043	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	158.2	-173.6	61.9	-100	0	0	0	113.1	T3602 N3603 E3608 R3621 Y3622 L3638 D3645	T3602-Y3606 WeakPolarHBondContact OG1-CE2 3.47Å; N3603-Y3606 HydrophobicContact CB-CD1 4.41Å; N3603-Y3606 HydrophobicContact CB-CE1 4.17Å; N3603-Y3606 PolarHBondContact ND2-OH 3.34Å; N3603-Y3606 VanDerWaalsContact ND2-OH 3.16Å; N3603-Y3606 VanDerWaalsContact O-O 3.06Å; Y3606-E3608 HydrophobicContact CD2-CG 3.91Å; Y3606-E3608 HydrophobicContact CE2-CG 3.95Å; Y3606-E3608 WeakPolarHBondContact CE2-OE1 3.24Å; Y3606-R3621 HydrophobicContact CD2-CG 3.63Å; Y3606-R3621 HydrophobicContact CE2-CG 4.32Å; Y3606-R3621 HydrophobicContact CG-CG 3.81Å; Y3606-R3621 PolarHBondContact OH-NH2 2.88Å; Y3606-Y3622 CarbonylContact C-O 3.45Å; Y3606-Y3622 WeakPolarHBondContact CA-O 3.45Å; Y3606-Y3622 WeakPolarHBondContact CB-O 3.29Å; Y3606-L3638 HydrophobicContact CG-CD2 4.45Å; Y3606-D3645 PolarHBondContact OH-OD2 3.43Å
3607	K	89.8	Confident	85.7	Confident	32 Å²	32	48.9 Å²	48.9	14%	0.139	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	148.4	171.6	-71.3	175.4	178.8	158.8	0	110.2	F3572 R3621 Y3622 N3624	F3572-K3607 HydrophobicContact CB-CD 4.42Å; F3572-K3607 HydrophobicContact CD1-CD 3.59Å; F3572-K3607 HydrophobicContact CD2-CB 3.95Å; F3572-K3607 HydrophobicContact CD2-CD 4.5Å; F3572-K3607 HydrophobicContact CE1-CD 3.92Å; F3572-K3607 HydrophobicContact CE2-CB 4.23Å; F3572-K3607 HydrophobicContact CG-CB 4.1Å; F3572-K3607 HydrophobicContact CG-CD 3.92Å; F3572-K3607 HydrophobicContact CZ-CD 4.49Å; K3607-R3621 WeakPolarHBondContact O-CA 3.39Å; K3607-Y3622 PolarHBondContact N-O 2.75Å; K3607-Y3622 PolarHBondContact O-N 3.49Å; K3607-N3624 WeakPolarHBondContact CE-OD1 3.45Å; K3607-N3624 HydrophobicContact CG-CB 4.22Å; K3607-N3624 PolarHBondContact NZ-OD1 3.04Å
3608	E	92	Very high	85.9	Confident	5 Å²	5	49 Å²	49	2%	0.023	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	138.9	178.3	-63.7	-171.5	165.9	0	0	113.1	M3600 Y3606 W3610 I3620 R3621	M3600-E3608 HydrophobicContact CB-CB 4.31Å; M3600-E3608 PolarHBondContact N-O 3.11Å; M3600-E3608 PolarHBondContact O-N 3.27Å; M3600-E3608 VanDerWaalsContact O-N 3.13Å; Y3606-E3608 HydrophobicContact CD2-CG 3.91Å; Y3606-E3608 HydrophobicContact CE2-CG 3.95Å; Y3606-E3608 WeakPolarHBondContact CE2-OE1 3.24Å; E3608-W3610 PolarHBondContact OE2-NE1 3.26Å; E3608-I3620 CarbonylContact C-O 3.55Å; E3608-I3620 VanDerWaalsContact CA-O 3.31Å; E3608-I3620 WeakPolarHBondContact CA-O 3.45Å; E3608-R3621 HydrophobicContact CG-CB 4.14Å; E3608-R3621 HydrophobicContact CG-CG 4.14Å; E3608-R3621 IonicContact OE1-CZ 2.66Å; E3608-R3621 IonicContact OE1-NE 3.3Å; E3608-R3621 PolarHBondContact OE1-NE 2.88Å; E3608-R3621 IonicContact OE1-NH2 2.77Å; E3608-R3621 PolarHBondContact OE1-NH2 2.78Å
3609	L	92.9	Very high	86.1	Confident	1 Å²	1	49.2 Å²	49.2	1%	0.005	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	123.5	167.2	179.3	64.7	0	0	0	108.9	L3523 L3579 L3586 I3599 R3619 I3620 Y3622	L3523-L3609 HydrophobicContact CD2-CD2 3.38Å; L3579-L3609 HydrophobicContact CD1-CD2 3.99Å; L3586-L3609 HydrophobicContact CD1-CD1 3.85Å; L3586-L3609 HydrophobicContact CD2-CD1 4.45Å; I3599-L3609 HydrophobicContact CG1-CD1 3.98Å; L3609-R3619 CarbonylContact O-C 3.6Å; L3609-R3619 WeakPolarHBondContact O-CA 3.36Å; L3609-I3620 PolarHBondContact N-O 2.79Å; L3609-I3620 PolarHBondContact O-N 3.19Å; L3609-Y3622 HydrophobicContact CB-CE2 4.21Å
3610	W	93	Very high	86.5	Confident	42 Å²	42	46.5 Å²	46.5	16%	0.159	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	134	-179.7	-63.3	7.4	0	0	0	109.8	F3597 T3598 M3600 E3608 W3618 R3619	F3597-W3610 CarbonylContact C-O 3.53Å; F3597-W3610 VanDerWaalsContact CA-O 3.31Å; F3597-W3610 WeakPolarHBondContact CA-O 3.31Å; T3598-W3610 PolarHBondContact N-O 3.14Å; T3598-W3610 PolarHBondContact O-N 2.63Å; M3600-W3610 HydrophobicContact CB-CD2 4.49Å; M3600-W3610 HydrophobicContact CB-CZ2 4.14Å; M3600-W3610 HydrophobicContact CE-CH2 3.94Å; M3600-W3610 HydrophobicContact CE-CZ2 4.17Å; M3600-W3610 HydrophobicContact CG-CD2 3.62Å; M3600-W3610 VanDerWaalsContact CG-CE2 3.44Å; M3600-W3610 HydrophobicContact CG-CE3 3.93Å; M3600-W3610 HydrophobicContact CG-CG 4.19Å; M3600-W3610 HydrophobicContact CG-CH2 3.9Å; M3600-W3610 HydrophobicContact CG-CZ2 3.6Å; M3600-W3610 HydrophobicContact CG-CZ3 4.05Å; M3600-W3610 HydrophobicContact SD-CH2 4.3Å; M3600-W3610 HydrophobicContact SD-CZ3 4.38Å; E3608-W3610 PolarHBondContact OE2-NE1 3.26Å; W3610-W3618 CarbonylContact C-O 3.57Å; W3610-W3618 WeakPolarHBondContact CA-O 3.39Å; W3610-R3619 HydrophobicContact CD2-CG 4.29Å; W3610-R3619 HydrophobicContact CG-CG 3.97Å; W3610-R3619 VanDerWaalsContact CZ2-NH1 3.26Å
3611	I	93.4	Very high	87	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	121	177.4	-47.7	160.5	0	0	0	106.1	M3475 L3523 I3595 N3596 F3597 Q3617 W3618 I3620	M3475-I3611 HydrophobicContact CE-CB 4.27Å; M3475-I3611 HydrophobicContact CE-CG2 4.2Å; M3475-I3611 WeakPolarHBondContact CE-O 3.47Å; M3475-I3611 HydrophobicContact CG-CG2 4.49Å; M3475-I3611 HydrophobicContact SD-CB 4.38Å; M3475-I3611 HydrophobicContact SD-CG2 3.66Å; L3523-I3611 HydrophobicContact CB-CD1 4.17Å; L3523-I3611 HydrophobicContact CD1-CD1 3.7Å; L3523-I3611 HydrophobicContact CD2-CD1 4.19Å; L3523-I3611 HydrophobicContact CG-CD1 4.23Å; I3595-I3611 HydrophobicContact CG2-CG2 3.6Å; N3596-I3611 CarbonylContact O-C 3.59Å; N3596-I3611 WeakPolarHBondContact O-CA 3.27Å; F3597-I3611 HydrophobicContact CD1-CG1 3.88Å; F3597-I3611 HydrophobicContact CD1-CG2 4.35Å; F3597-I3611 HydrophobicContact CE1-CB 4.43Å; F3597-I3611 HydrophobicContact CE1-CD1 4.32Å; F3597-I3611 HydrophobicContact CE1-CG1 3.76Å; F3597-I3611 HydrophobicContact CE1-CG2 3.99Å; F3597-I3611 HydrophobicContact CZ-CG2 4.3Å; I3611-Q3617 CarbonylContact O-C 3.51Å; I3611-Q3617 WeakPolarHBondContact O-CA 3.34Å; I3611-W3618 HydrophobicContact CB-CB 4.46Å; I3611-W3618 HydrophobicContact CD1-CB 4.42Å; I3611-W3618 PolarHBondContact N-O 2.84Å; I3611-W3618 PolarHBondContact O-N 3.26Å; I3611-I3620 HydrophobicContact CD1-CD1 3.72Å
3612	T	91.4	Very high	87.8	Confident	25 Å²	25	37.7 Å²	37.7	15%	0.153	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	129.7	-177.9	-48	0	0	0	0	109.9	L3560 N3596 L3616 Q3617	L3560-T3612 HydrophobicContact CD1-CG2 3.95Å; N3596-T3612 PolarHBondContact N-O 2.73Å; N3596-T3612 PolarHBondContact O-N 3.46Å; T3612-L3616 WeakPolarHBondContact CA-O 3.31Å; T3612-Q3617 HydrophobicContact CG2-CB 4.3Å; T3612-Q3617 PolarHBondContact OG1-NE2 2.83Å
3613	R	89.8	Confident	89	Confident	15 Å²	15	37 Å²	37	6%	0.057	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	130.7	174	-168.1	-172.9	-176.9	-143.1	6.3	108.9	T3474 M3475 N3593 I3595 N3615 L3616	T3474-R3613 PolarHBondContact O-NH1 3.31Å; M3475-R3613 WeakPolarHBondContact O-CD 3.38Å; M3475-R3613 HydrophobicContact SD-CB 3.83Å; N3593-R3613 PolarHBondContact O-NE 3.23Å; I3595-R3613 HydrophobicContact CG1-CB 4.34Å; I3595-R3613 HydrophobicContact CG1-CG 4.15Å; R3613-N3615 PolarHBondContact O-N 2.84Å; R3613-L3616 PolarHBondContact N-O 3.24Å; R3613-L3616 PolarHBondContact O-N 3.12Å; R3613-L3616 VanDerWaalsContact O-O 3.04Å
3614	Y	85.5	Confident	90	Very high	106 Å²	106	35.3 Å²	35.3	42%	0.416	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.5	-125.3	-172.5	-49.3	-65.2	0	0	0	111.4	N3473	N3473-Y3614 HydrophobicContact CB-CD2 4.08Å
3615	N	86.7	Confident	90	Very high	41 Å²	41	28.8 Å²	28.8	22%	0.219	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	17	176.5	-64.2	-5.3	0	0	0	112.6	I2689 F3561 R3613	I2689-N3615 HydrophobicContact CD1-CB 3.8Å; F3561-N3615 PolarHBondContact N-O 3.39Å; R3613-N3615 PolarHBondContact O-N 2.84Å
3616	L	91.1	Very high	89.4	Confident	1 Å²	1	28.8 Å²	28.8	1%	0.005	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	132.2	179.7	179.1	66.6	0	0	0	110.6	I2689 M3475 F3561 T3612 R3613	I2689-L3616 HydrophobicContact CG2-CB 4.07Å; I2689-L3616 HydrophobicContact CG2-CD1 4.02Å; I2689-L3616 HydrophobicContact CG2-CD2 4.35Å; I2689-L3616 HydrophobicContact CG2-CG 4.38Å; M3475-L3616 HydrophobicContact CB-CD2 3.78Å; M3475-L3616 HydrophobicContact CE-CD2 4.07Å; M3475-L3616 HydrophobicContact CE-CG 3.85Å; F3561-L3616 HydrophobicContact CB-CD1 4.43Å; F3561-L3616 HydrophobicContact CD1-CD1 3.43Å; F3561-L3616 VanDerWaalsContact CD1-CD1 3.43Å; F3561-L3616 HydrophobicContact CE1-CD1 3.99Å; F3561-L3616 HydrophobicContact CG-CD1 4.21Å; F3561-L3616 CarbonylContact O-C 3.45Å; F3561-L3616 WeakPolarHBondContact O-CA 3.23Å; T3612-L3616 WeakPolarHBondContact CA-O 3.31Å; R3613-L3616 PolarHBondContact N-O 3.24Å; R3613-L3616 PolarHBondContact O-N 3.12Å; R3613-L3616 VanDerWaalsContact O-O 3.04Å
3617	Q	93.6	Very high	88.8	Confident	11 Å²	11	36.7 Å²	36.7	5%	0.051	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	128.9	173.7	178.9	174.5	87.7	0	0	110.6	L3560 F3561 T3562 Q3563 I3611 T3612 R3619	L3560-Q3617 HydrophobicContact CD1-CB 4.06Å; L3560-Q3617 HydrophobicContact CD2-CB 3.89Å; L3560-Q3617 HydrophobicContact CG-CB 4.04Å; F3561-Q3617 PolarHBondContact O-N 2.88Å; T3562-Q3617 CarbonylContact C-O 3.56Å; T3562-Q3617 VanDerWaalsContact CA-O 3.26Å; T3562-Q3617 WeakPolarHBondContact CA-O 3.39Å; T3562-Q3617 HydrophobicContact CG2-CB 4.44Å; T3562-Q3617 HydrophobicContact CG2-CG 4.35Å; Q3563-Q3617 PolarHBondContact N-O 2.82Å; I3611-Q3617 CarbonylContact O-C 3.51Å; I3611-Q3617 WeakPolarHBondContact O-CA 3.34Å; T3612-Q3617 HydrophobicContact CG2-CB 4.3Å; T3612-Q3617 PolarHBondContact OG1-NE2 2.83Å; Q3617-R3619 HydrophobicContact CG-CG 4.23Å; Q3617-R3619 VanDerWaalsContact OE1-CZ 3.28Å
3618	W	94.8	Very high	87.8	Confident	2 Å²	2	41.5 Å²	41.5	1%	0.008	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	127.6	168.7	-68.3	-7.1	0	0	0	109.4	I2692 M3475 F3476 Y3482 V3524 Q3563 F3565 W3610 I3611	I2692-W3618 HydrophobicContact CD1-CH2 3.61Å; I2692-W3618 HydrophobicContact CD1-CZ2 3.81Å; I2692-W3618 HydrophobicContact CD1-CZ3 4.21Å; I2692-W3618 HydrophobicContact CG1-CH2 4.02Å; I2692-W3618 HydrophobicContact CG1-CZ2 3.87Å; M3475-W3618 HydrophobicContact CB-CD2 4.09Å; M3475-W3618 HydrophobicContact CB-CE3 4.07Å; M3475-W3618 HydrophobicContact CB-CH2 3.72Å; M3475-W3618 HydrophobicContact CB-CZ2 3.73Å; M3475-W3618 HydrophobicContact CB-CZ3 3.89Å; M3475-W3618 HydrophobicContact CE-CB 3.76Å; M3475-W3618 HydrophobicContact CE-CD2 3.68Å; M3475-W3618 HydrophobicContact CE-CE3 4.26Å; M3475-W3618 HydrophobicContact CE-CG 3.4Å; M3475-W3618 HydrophobicContact CG-CD2 3.93Å; M3475-W3618 HydrophobicContact CG-CE3 3.69Å; M3475-W3618 HydrophobicContact CG-CH2 4.23Å; M3475-W3618 HydrophobicContact CG-CZ2 4.43Å; M3475-W3618 HydrophobicContact CG-CZ3 3.85Å; F3476-W3618 HydrophobicContact CD2-CH2 4.46Å; F3476-W3618 AromaticContact CD2-CZ3 4Å; F3476-W3618 HydrophobicContact CD2-CZ3 4Å; F3476-W3618 HydrophobicContact CE2-CE3 4.2Å; F3476-W3618 AromaticContact CE2-CZ3 3.7Å; F3476-W3618 HydrophobicContact CE2-CZ3 3.7Å; Y3482-W3618 AromaticContact CE1-CH2 3.8Å; Y3482-W3618 HydrophobicContact CE1-CH2 3.8Å; Y3482-W3618 HydrophobicContact CE1-CZ3 4.15Å; Y3482-W3618 HydrophobicContact CE2-CH2 4.11Å; Y3482-W3618 AromaticContact CZ-CH2 3.58Å; V3524-W3618 HydrophobicContact CB-CZ3 4.5Å; V3524-W3618 HydrophobicContact CG2-CE3 3.61Å; V3524-W3618 HydrophobicContact CG2-CZ3 3.64Å; Q3563-W3618 CarbonylContact O-C 3.51Å; Q3563-W3618 WeakPolarHBondContact O-CA 3.15Å; F3565-W3618 HydrophobicContact CD2-CB 4.24Å; F3565-W3618 HydrophobicContact CD2-CG 4.43Å; F3565-W3618 HydrophobicContact CE2-CB 3.86Å; F3565-W3618 AromaticContact CE2-CD1 3.8Å; F3565-W3618 AromaticContact CE2-CD2 3.87Å; F3565-W3618 HydrophobicContact CE2-CD2 3.87Å; F3565-W3618 HydrophobicContact CE2-CE3 4.48Å; F3565-W3618 AromaticContact CE2-CG 3.59Å; F3565-W3618 HydrophobicContact CE2-CG 3.59Å; F3565-W3618 HydrophobicContact CZ-CD2 4.21Å; F3565-W3618 HydrophobicContact CZ-CG 4.34Å; W3610-W3618 CarbonylContact C-O 3.57Å; W3610-W3618 WeakPolarHBondContact CA-O 3.39Å; I3611-W3618 HydrophobicContact CB-CB 4.46Å; I3611-W3618 HydrophobicContact CD1-CB 4.42Å; I3611-W3618 PolarHBondContact N-O 2.84Å; I3611-W3618 PolarHBondContact O-N 3.26Å
3619	R	94.2	Very high	86.9	Confident	46 Å²	46	45.3 Å²	45.3	17%	0.174	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	125.4	174.3	-60.6	-172.4	-178.1	-170	2.8	108	T3562 Q3563 L3564 F3565 L3609 W3610 Q3617	T3562-R3619 HydrophobicContact CG2-CG 3.78Å; Q3563-R3619 PolarHBondContact O-N 3.42Å; L3564-R3619 CarbonylContact C-O 3.54Å; L3564-R3619 WeakPolarHBondContact CA-O 3.44Å; L3564-R3619 HydrophobicContact CD1-CB 3.72Å; F3565-R3619 PolarHBondContact N-O 2.93Å; L3609-R3619 CarbonylContact O-C 3.6Å; L3609-R3619 WeakPolarHBondContact O-CA 3.36Å; W3610-R3619 HydrophobicContact CD2-CG 4.29Å; W3610-R3619 HydrophobicContact CG-CG 3.97Å; W3610-R3619 VanDerWaalsContact CZ2-NH1 3.26Å; Q3617-R3619 HydrophobicContact CG-CG 4.23Å; Q3617-R3619 VanDerWaalsContact OE1-CZ 3.28Å
3620	I	94.4	Very high	86.4	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	115.2	179.4	-50.7	166.7	0	0	0	107.1	L3523 V3524 T3527 F3565 E3608 L3609 I3611 Y3622	L3523-I3620 HydrophobicContact CB-CD1 3.8Å; L3523-I3620 HydrophobicContact CD2-CD1 4.18Å; L3523-I3620 WeakPolarHBondContact O-CD1 2.95Å; V3524-I3620 HydrophobicContact CG2-CD1 4.36Å; T3527-I3620 HydrophobicContact CG2-CG2 4.19Å; F3565-I3620 HydrophobicContact CB-CG1 4.38Å; F3565-I3620 CarbonylContact O-C 3.54Å; F3565-I3620 WeakPolarHBondContact O-CA 3.49Å; E3608-I3620 CarbonylContact C-O 3.55Å; E3608-I3620 VanDerWaalsContact CA-O 3.31Å; E3608-I3620 WeakPolarHBondContact CA-O 3.45Å; L3609-I3620 PolarHBondContact N-O 2.79Å; L3609-I3620 PolarHBondContact O-N 3.19Å; I3611-I3620 HydrophobicContact CD1-CD1 3.72Å; I3620-Y3622 HydrophobicContact CB-CE2 3.93Å; I3620-Y3622 HydrophobicContact CG2-CD2 4.35Å; I3620-Y3622 HydrophobicContact CG2-CE1 4.38Å; I3620-Y3622 HydrophobicContact CG2-CE2 3.53Å; I3620-Y3622 WeakPolarHBondContact CG2-OH 3.34Å; I3620-Y3622 WeakPolarHBondContact O-CD2 3.49Å; I3620-Y3622 WeakPolarHBondContact O-CE2 3.48Å
3621	R	93.1	Very high	85.7	Confident	7 Å²	7	49.9 Å²	49.9	3%	0.026	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	125.3	-175.6	-174.8	-179.9	-69.3	-168.1	-12.9	110.1	L3564 F3565 L3566 S3567 Y3606 K3607 E3608 L3638 T3642 D3645	L3564-R3621 HydrophobicContact CD1-CB 4Å; F3565-R3621 PolarHBondContact O-N 2.9Å; L3566-R3621 HydrophobicContact CD2-CB 3.88Å; L3566-R3621 HydrophobicContact CD2-CG 4.3Å; S3567-R3621 PolarHBondContact N-O 2.92Å; Y3606-R3621 HydrophobicContact CD2-CG 3.63Å; Y3606-R3621 HydrophobicContact CE2-CG 4.32Å; Y3606-R3621 HydrophobicContact CG-CG 3.81Å; Y3606-R3621 PolarHBondContact OH-NH2 2.88Å; K3607-R3621 WeakPolarHBondContact O-CA 3.39Å; E3608-R3621 HydrophobicContact CG-CB 4.14Å; E3608-R3621 HydrophobicContact CG-CG 4.14Å; E3608-R3621 IonicContact OE1-CZ 2.66Å; E3608-R3621 IonicContact OE1-NE 3.3Å; E3608-R3621 PolarHBondContact OE1-NE 2.88Å; E3608-R3621 IonicContact OE1-NH2 2.77Å; E3608-R3621 PolarHBondContact OE1-NH2 2.78Å; R3621-L3638 HydrophobicContact CG-CD2 3.86Å; R3621-T3642 PolarHBondContact NH1-OG1 3.43Å; R3621-T3642 VanDerWaalsContact NH1-OG1 3.07Å; R3621-D3645 IonicContact CZ-OD2 3.07Å; R3621-D3645 VanDerWaalsContact CZ-OD2 3.28Å; R3621-D3645 IonicContact NH1-OD2 3.07Å; R3621-D3645 PolarHBondContact NH1-OD2 3.13Å; R3621-D3645 IonicContact NH2-OD2 2.86Å; R3621-D3645 PolarHBondContact NH2-OD2 3.07Å
3622	Y	91.3	Very high	85	Confident	1 Å²	1	57.1 Å²	57.1	0%	0.004	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	138.1	179.6	-60.4	-95.3	0	0	0	109.3	K3570 F3572 T3575 Y3606 K3607 L3609 I3620 N3624	K3570-Y3622 HydrophobicContact CB-CE1 4.4Å; K3570-Y3622 WeakPolarHBondContact O-CD1 3.46Å; F3572-Y3622 HydrophobicContact CB-CD1 4.27Å; F3572-Y3622 HydrophobicContact CB-CD2 4.32Å; F3572-Y3622 HydrophobicContact CB-CG 3.89Å; F3572-Y3622 AromaticContact CD2-CD2 3.68Å; F3572-Y3622 HydrophobicContact CD2-CD2 3.68Å; F3572-Y3622 HydrophobicContact CD2-CE2 4.1Å; F3572-Y3622 HydrophobicContact CD2-CG 4.14Å; F3572-Y3622 HydrophobicContact CG-CD2 4.5Å; T3575-Y3622 WeakPolarHBondContact CG2-OH 3.39Å; Y3606-Y3622 CarbonylContact C-O 3.45Å; Y3606-Y3622 WeakPolarHBondContact CA-O 3.45Å; Y3606-Y3622 WeakPolarHBondContact CB-O 3.29Å; K3607-Y3622 PolarHBondContact N-O 2.75Å; K3607-Y3622 PolarHBondContact O-N 3.49Å; L3609-Y3622 HydrophobicContact CB-CE2 4.21Å; I3620-Y3622 HydrophobicContact CB-CE2 3.93Å; I3620-Y3622 HydrophobicContact CG2-CD2 4.35Å; I3620-Y3622 HydrophobicContact CG2-CE1 4.38Å; I3620-Y3622 HydrophobicContact CG2-CE2 3.53Å; I3620-Y3622 WeakPolarHBondContact CG2-OH 3.34Å; I3620-Y3622 WeakPolarHBondContact O-CD2 3.49Å; I3620-Y3622 WeakPolarHBondContact O-CE2 3.48Å; Y3622-N3624 PolarHBondContact O-N 3.14Å
3623	F	87.6	Confident	84.6	Confident	41 Å²	41	58.7 Å²	58.7	18%	0.18	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	131.8	174.4	-175.6	-112.4	0	0	0	110.6	L3629 A3634 V3637 L3638	F3623-L3629 HydrophobicContact CE1-CB 4.05Å; F3623-L3629 HydrophobicContact CE1-CD1 3.36Å; F3623-L3629 HydrophobicContact CE1-CG 4.25Å; F3623-L3629 HydrophobicContact CZ-CD1 3.33Å; F3623-A3634 HydrophobicContact CB-CB 4.13Å; F3623-A3634 HydrophobicContact CD1-CB 4Å; F3623-A3634 HydrophobicContact CD2-CB 4.38Å; F3623-A3634 HydrophobicContact CG-CB 3.91Å; F3623-V3637 HydrophobicContact CD2-CG1 4.44Å; F3623-V3637 HydrophobicContact CE2-CB 4.04Å; F3623-V3637 HydrophobicContact CE2-CG1 3.9Å; F3623-V3637 HydrophobicContact CE2-CG2 4.4Å; F3623-L3638 HydrophobicContact CB-CD1 4.14Å; F3623-L3638 HydrophobicContact CB-CD2 4.37Å; F3623-L3638 HydrophobicContact CB-CG 4.32Å; F3623-L3638 HydrophobicContact CD2-CD2 4.35Å; F3623-L3638 HydrophobicContact CD2-CG 4.36Å
3624	N	85.3	Confident	84.4	Confident	52 Å²	52	58.2 Å²	58.2	28%	0.278	31%	0.312	S	S	.	.			trans	-114	99	-177.8	-174.9	59.9	0	0	0	108.7	E3604 K3605 K3607 Y3622	E3604-N3624 PolarHBondContact O-ND2 3.21Å; K3605-N3624 PolarHBondContact O-N 3.2Å; K3607-N3624 WeakPolarHBondContact CE-OD1 3.45Å; K3607-N3624 HydrophobicContact CG-CB 4.22Å; K3607-N3624 PolarHBondContact NZ-OD1 3.04Å; Y3622-N3624 PolarHBondContact O-N 3.14Å
3625	S	78.5	Confident	84.4	Confident	43 Å²	43	55.5 Å²	55.5	30%	0.301	30%	0.3	S	S	.	.			trans	-141.2	139.3	176.2	169	0	0	0	0	109.8	Y3627	S3625-Y3627 WeakPolarHBondContact CB-O 3.36Å; S3625-Y3627 PolarHBondContact O-N 3.19Å; S3625-Y3627 PolarHBondContact OG-N 3.32Å; S3625-Y3627 VanDerWaalsContact OG-N 3.09Å; S3625-Y3627 PolarHBondContact OG-O 2.86Å
3626	P	71.3	Confident	84.3	Confident	122 Å²	122	56.4 Å²	56.4	79%	0.792	31%	0.31	S	S	*	.	S	Bend	trans	-66.6	-20.4	172.4	26.1	-31.5	0	0	0	112.7
3627	Y	75.2	Confident	84	Confident	177 Å²	177	58.6 Å²	58.6	69%	0.694	32%	0.324	S	S	*	.	S	Bend	trans	-109.5	135.3	179.1	-56.4	-74.8	0	0	0	111.7	S3625 L3629	S3625-Y3627 WeakPolarHBondContact CB-O 3.36Å; S3625-Y3627 PolarHBondContact O-N 3.19Å; S3625-Y3627 PolarHBondContact OG-N 3.32Å; S3625-Y3627 VanDerWaalsContact OG-N 3.09Å; S3625-Y3627 PolarHBondContact OG-O 2.86Å; Y3627-L3629 PolarHBondContact O-N 3.29Å; Y3627-L3629 VanDerWaalsContact O-N 3.16Å
3628	P	69	Low	83.8	Confident	134 Å²	134	58.1 Å²	58.1	87%	0.87	32%	0.321	S	S	*	.			trans	-66.1	113	174.8	25.4	-30.9	0	0	0	110
3629	L	73.2	Confident	83.5	Confident	85 Å²	85	58.1 Å²	58.1	45%	0.445	32%	0.322	S	S	.	.			trans	-96.4	157	175	-84.5	158.4	0	0	0	110.4	F3623 Y3627 T3633	F3623-L3629 HydrophobicContact CE1-CB 4.05Å; F3623-L3629 HydrophobicContact CE1-CD1 3.36Å; F3623-L3629 HydrophobicContact CE1-CG 4.25Å; F3623-L3629 HydrophobicContact CZ-CD1 3.33Å; Y3627-L3629 PolarHBondContact O-N 3.29Å; Y3627-L3629 VanDerWaalsContact O-N 3.16Å; L3629-T3633 HydrophobicContact CD2-CG2 4.04Å
3630	S	81.5	Confident	83.2	Confident	60 Å²	60	59.7 Å²	59.7	42%	0.42	33%	0.333	S	S	.	.			trans	-61.6	145.6	174	71.2	0	0	0	0	110.7	M3632 T3633 A3634	S3630-M3632 PolarHBondContact O-N 3.44Å; S3630-M3632 VanDerWaalsContact O-N 3.08Å; S3630-T3633 PolarHBondContact O-N 2.83Å; S3630-T3633 PolarHBondContact OG-N 2.93Å; S3630-T3633 PolarHBondContact OG-OG1 2.78Å; S3630-A3634 PolarHBondContact O-N 2.92Å; S3630-A3634 VanDerWaalsContact O-N 3.08Å
3631	P	78	Confident	83	Confident	78 Å²	78	60.2 Å²	60.2	51%	0.506	34%	0.337	S	S	.	.	H	α-helix	trans	-53.5	-32.5	179.2	-28.9	35.1	0	0	0	113.9	W3635	P3631-W3635 VanDerWaalsContact O-CB 3.26Å; P3631-W3635 WeakPolarHBondContact O-CB 3.41Å; P3631-W3635 PolarHBondContact O-N 3.4Å
3632	M	80.5	Confident	82.9	Confident	152 Å²	152	59.9 Å²	59.9	75%	0.749	34%	0.336	S	S	*	.	H	α-helix	trans	-69.6	-37.1	177.3	-65	-176	78	0	0	113.1	S3630 W3635 S3636	S3630-M3632 PolarHBondContact O-N 3.44Å; S3630-M3632 VanDerWaalsContact O-N 3.08Å; M3632-W3635 WeakPolarHBondContact O-CB 3.43Å; M3632-S3636 PolarHBondContact O-N 2.68Å; M3632-S3636 VanDerWaalsContact O-N 3.09Å; M3632-S3636 PolarHBondContact O-OG 2.8Å
3633	T	82.9	Confident	82.8	Confident	58 Å²	58	60.2 Å²	60.2	36%	0.356	34%	0.337	S	S	.	.	H	α-helix	trans	-72.7	-44	178.1	-46.8	0	0	0	0	110.2	L3629 S3630 W3635 S3636 V3637	L3629-T3633 HydrophobicContact CD2-CG2 4.04Å; S3630-T3633 PolarHBondContact O-N 2.83Å; S3630-T3633 PolarHBondContact OG-N 2.93Å; S3630-T3633 PolarHBondContact OG-OG1 2.78Å; T3633-W3635 VanDerWaalsContact C-N 3.31Å; T3633-W3635 PolarHBondContact O-N 2.99Å; T3633-S3636 PolarHBondContact O-N 2.85Å; T3633-V3637 WeakPolarHBondContact O-CG2 3.36Å; T3633-V3637 PolarHBondContact O-N 3.41Å; T3633-V3637 VanDerWaalsContact O-N 3.09Å
3634	A	84.3	Confident	82.9	Confident	6 Å²	6	62 Å²	62	5%	0.05	35%	0.349	C	S	.	.	H	α-helix	trans	-57.4	-45.5	173.3	0	0	0	0	0	111.2	F3623 S3630 S3636 V3637 L3638	F3623-A3634 HydrophobicContact CB-CB 4.13Å; F3623-A3634 HydrophobicContact CD1-CB 4Å; F3623-A3634 HydrophobicContact CD2-CB 4.38Å; F3623-A3634 HydrophobicContact CG-CB 3.91Å; S3630-A3634 PolarHBondContact O-N 2.92Å; S3630-A3634 VanDerWaalsContact O-N 3.08Å; A3634-S3636 PolarHBondContact O-N 3.39Å; A3634-V3637 PolarHBondContact O-N 3.31Å; A3634-L3638 WeakPolarHBondContact O-CB 3.36Å; A3634-L3638 VanDerWaalsContact O-CG 3.26Å; A3634-L3638 WeakPolarHBondContact O-CG 3.33Å; A3634-L3638 PolarHBondContact O-N 2.59Å
3635	W	85.3	Confident	83.2	Confident	48 Å²	48	60.1 Å²	60.1	18%	0.182	34%	0.339	C	S	.	.	H	α-helix	trans	-53.6	-51.5	174.1	179.2	-98.5	0	0	0	112.2	N3528 V3530 L3566 T3568 P3631 M3632 T3633 V3637 L3638 V3639	N3528-W3635 HydrophobicContact CB-CH2 3.65Å; N3528-W3635 HydrophobicContact CB-CZ3 3.6Å; N3528-W3635 WeakPolarHBondContact ND2-CZ3 3.42Å; V3530-W3635 HydrophobicContact CG2-CH2 3.85Å; V3530-W3635 HydrophobicContact CG2-CZ3 4.37Å; L3566-W3635 HydrophobicContact CB-CZ3 4.23Å; L3566-W3635 HydrophobicContact CD1-CE3 4.36Å; L3566-W3635 HydrophobicContact CD1-CZ3 4.13Å; T3568-W3635 HydrophobicContact CG2-CB 4.21Å; T3568-W3635 HydrophobicContact CG2-CE3 3.88Å; P3631-W3635 VanDerWaalsContact O-CB 3.26Å; P3631-W3635 WeakPolarHBondContact O-CB 3.41Å; P3631-W3635 PolarHBondContact O-N 3.4Å; M3632-W3635 WeakPolarHBondContact O-CB 3.43Å; T3633-W3635 VanDerWaalsContact C-N 3.31Å; T3633-W3635 PolarHBondContact O-N 2.99Å; W3635-V3637 PolarHBondContact O-N 3.33Å; W3635-L3638 PolarHBondContact O-N 3.47Å; W3635-V3639 HydrophobicContact CD2-CG2 3.99Å; W3635-V3639 HydrophobicContact CG-CG2 4.29Å; W3635-V3639 HydrophobicContact CZ2-CG2 3.95Å; W3635-V3639 WeakPolarHBondContact O-CB 3.38Å; W3635-V3639 VanDerWaalsContact O-CG2 3.31Å; W3635-V3639 WeakPolarHBondContact O-CG2 3.15Å; W3635-V3639 PolarHBondContact O-N 2.98Å
3636	S	84.7	Confident	83.9	Confident	60 Å²	60	58 Å²	58	42%	0.42	32%	0.324	S	S	.	.	H	α-helix	trans	-61.3	-43.1	-177	-56.9	0	0	0	0	112.4	M3632 T3633 A3634 N3640	M3632-S3636 PolarHBondContact O-N 2.68Å; M3632-S3636 VanDerWaalsContact O-N 3.09Å; M3632-S3636 PolarHBondContact O-OG 2.8Å; T3633-S3636 PolarHBondContact O-N 2.85Å; A3634-S3636 PolarHBondContact O-N 3.39Å; S3636-N3640 WeakPolarHBondContact O-CB 3.02Å; S3636-N3640 VanDerWaalsContact O-CG 3.24Å; S3636-N3640 PolarHBondContact O-N 3.05Å; S3636-N3640 PolarHBondContact O-ND2 2.91Å
3637	V	86.1	Confident	84.9	Confident	48 Å²	48	55.3 Å²	55.3	29%	0.291	30%	0.3	S	S	.	.	H	α-helix	trans	-65.7	-44.5	177.6	176.2	0	0	0	0	111.4	K3605 F3623 T3633 A3634 W3635 S3641	K3605-V3637 HydrophobicContact CD-CG1 4.47Å; F3623-V3637 HydrophobicContact CD2-CG1 4.44Å; F3623-V3637 HydrophobicContact CE2-CB 4.04Å; F3623-V3637 HydrophobicContact CE2-CG1 3.9Å; F3623-V3637 HydrophobicContact CE2-CG2 4.4Å; T3633-V3637 WeakPolarHBondContact O-CG2 3.36Å; T3633-V3637 PolarHBondContact O-N 3.41Å; T3633-V3637 VanDerWaalsContact O-N 3.09Å; A3634-V3637 PolarHBondContact O-N 3.31Å; W3635-V3637 PolarHBondContact O-N 3.33Å; V3637-S3641 WeakPolarHBondContact O-CB 3.32Å; V3637-S3641 PolarHBondContact O-N 2.96Å; V3637-S3641 PolarHBondContact O-OG 2.9Å
3638	L	88.8	Confident	85.7	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-65.6	-45.6	179.8	-70.2	179.7	0	0	0	111.6	L3566 T3568 Y3606 R3621 F3623 A3634 W3635 S3641 T3642	L3566-L3638 HydrophobicContact CB-CD1 4.41Å; L3566-L3638 HydrophobicContact CD1-CB 3.85Å; L3566-L3638 HydrophobicContact CD2-CB 4.18Å; T3568-L3638 HydrophobicContact CG2-CD1 4.43Å; Y3606-L3638 HydrophobicContact CG-CD2 4.45Å; R3621-L3638 HydrophobicContact CG-CD2 3.86Å; F3623-L3638 HydrophobicContact CB-CD1 4.14Å; F3623-L3638 HydrophobicContact CB-CD2 4.37Å; F3623-L3638 HydrophobicContact CB-CG 4.32Å; F3623-L3638 HydrophobicContact CD2-CD2 4.35Å; F3623-L3638 HydrophobicContact CD2-CG 4.36Å; A3634-L3638 WeakPolarHBondContact O-CB 3.36Å; A3634-L3638 VanDerWaalsContact O-CG 3.26Å; A3634-L3638 WeakPolarHBondContact O-CG 3.33Å; A3634-L3638 PolarHBondContact O-N 2.59Å; W3635-L3638 PolarHBondContact O-N 3.47Å; L3638-S3641 PolarHBondContact O-N 3.3Å; L3638-T3642 PolarHBondContact O-N 3.16Å; L3638-T3642 PolarHBondContact O-OG1 3.49Å
3639	V	88.5	Confident	86.7	Confident	2 Å²	2	49.3 Å²	49.3	1%	0.012	26%	0.259	C	S	.	.	H	α-helix	trans	-60.6	-48.9	177.4	164.7	0	0	0	0	111.5	L3566 W3635 S3641 T3642 I3643 L3738 T3742	L3566-V3639 HydrophobicContact CD1-CG2 3.84Å; W3635-V3639 HydrophobicContact CD2-CG2 3.99Å; W3635-V3639 HydrophobicContact CG-CG2 4.29Å; W3635-V3639 HydrophobicContact CZ2-CG2 3.95Å; W3635-V3639 WeakPolarHBondContact O-CB 3.38Å; W3635-V3639 VanDerWaalsContact O-CG2 3.31Å; W3635-V3639 WeakPolarHBondContact O-CG2 3.15Å; W3635-V3639 PolarHBondContact O-N 2.98Å; V3639-S3641 VanDerWaalsContact C-N 3.29Å; V3639-S3641 PolarHBondContact O-N 3.02Å; V3639-T3642 WeakPolarHBondContact O-CB 3.39Å; V3639-T3642 PolarHBondContact O-N 2.94Å; V3639-T3642 VanDerWaalsContact O-N 3.09Å; V3639-I3643 HydrophobicContact CG1-CD1 3.91Å; V3639-I3643 WeakPolarHBondContact O-CG1 3.38Å; V3639-I3643 PolarHBondContact O-N 3.19Å; V3639-L3738 HydrophobicContact CG1-CD2 4.34Å; V3639-T3742 HydrophobicContact CB-CG2 4.35Å; V3639-T3742 HydrophobicContact CG1-CG2 3.36Å; V3639-T3742 HydrophobicContact CG2-CG2 4Å
3640	N	88.3	Confident	87.6	Confident	79 Å²	79	45.2 Å²	45.2	42%	0.422	24%	0.238	S	C	.	.	H	α-helix	trans	-60.5	-42	178.4	-74.3	-18.2	0	0	0	111.2	S3636 T3642 I3643 D3644	S3636-N3640 WeakPolarHBondContact O-CB 3.02Å; S3636-N3640 VanDerWaalsContact O-CG 3.24Å; S3636-N3640 PolarHBondContact O-N 3.05Å; S3636-N3640 PolarHBondContact O-ND2 2.91Å; N3640-T3642 VanDerWaalsContact C-N 3.31Å; N3640-T3642 PolarHBondContact O-N 3.34Å; N3640-I3643 PolarHBondContact O-N 3Å; N3640-D3644 WeakPolarHBondContact O-CB 3.13Å; N3640-D3644 PolarHBondContact O-N 3.1Å
3641	S	89.7	Confident	88.1	Confident	11 Å²	11	46.3 Å²	46.3	8%	0.077	24%	0.235	C	C	.	.	H	α-helix	trans	-62.3	-38.9	175.5	-56.7	0	0	0	0	111.9	V3637 L3638 V3639 D3644 D3645	V3637-S3641 WeakPolarHBondContact O-CB 3.32Å; V3637-S3641 PolarHBondContact O-N 2.96Å; V3637-S3641 PolarHBondContact O-OG 2.9Å; L3638-S3641 PolarHBondContact O-N 3.3Å; V3639-S3641 VanDerWaalsContact C-N 3.29Å; V3639-S3641 PolarHBondContact O-N 3.02Å; S3641-D3644 PolarHBondContact O-N 2.94Å; S3641-D3645 WeakPolarHBondContact O-CB 3.45Å; S3641-D3645 PolarHBondContact O-N 3.38Å
3642	T	90.7	Very high	88.7	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-65.7	-42.6	176	-59	0	0	0	0	112.2	V3530 D3531 L3564 R3621 L3638 V3639 N3640 D3644 D3645 A3646	V3530-T3642 HydrophobicContact CG1-CG2 4.13Å; D3531-T3642 HydrophobicContact CB-CG2 3.7Å; L3564-T3642 HydrophobicContact CD2-CG2 3.51Å; R3621-T3642 PolarHBondContact NH1-OG1 3.43Å; R3621-T3642 VanDerWaalsContact NH1-OG1 3.07Å; L3638-T3642 PolarHBondContact O-N 3.16Å; L3638-T3642 PolarHBondContact O-OG1 3.49Å; V3639-T3642 WeakPolarHBondContact O-CB 3.39Å; V3639-T3642 PolarHBondContact O-N 2.94Å; V3639-T3642 VanDerWaalsContact O-N 3.09Å; N3640-T3642 VanDerWaalsContact C-N 3.31Å; N3640-T3642 PolarHBondContact O-N 3.34Å; T3642-D3644 VanDerWaalsContact C-N 3.34Å; T3642-D3644 PolarHBondContact O-N 3.1Å; T3642-D3645 WeakPolarHBondContact O-CB 3.4Å; T3642-D3645 PolarHBondContact O-N 3.48Å; T3642-A3646 PolarHBondContact O-N 2.85Å
3643	I	89.5	Confident	89.1	Confident	7 Å²	7	41.6 Å²	41.6	4%	0.036	21%	0.211	C	C	.	.	H	α-helix	trans	-63.7	-41.2	175.1	-67.2	167.4	0	0	0	110.6	V3639 N3640 D3645 A3646 K3647 L3738 M3745 Y3749	V3639-I3643 HydrophobicContact CG1-CD1 3.91Å; V3639-I3643 WeakPolarHBondContact O-CG1 3.38Å; V3639-I3643 PolarHBondContact O-N 3.19Å; N3640-I3643 PolarHBondContact O-N 3Å; I3643-D3645 VanDerWaalsContact C-N 3.31Å; I3643-D3645 PolarHBondContact O-N 3.18Å; I3643-A3646 PolarHBondContact O-N 2.87Å; I3643-K3647 HydrophobicContact CG2-CD 4.27Å; I3643-K3647 WeakPolarHBondContact O-CG 3.27Å; I3643-K3647 PolarHBondContact O-N 3.31Å; I3643-L3738 HydrophobicContact CD1-CD2 4.28Å; I3643-M3745 HydrophobicContact CD1-CE 4.08Å; I3643-M3745 HydrophobicContact CD1-SD 4.26Å; I3643-Y3749 HydrophobicContact CG2-CD2 4.21Å; I3643-Y3749 HydrophobicContact CG2-CE2 4.5Å
3644	D	90.6	Very high	89.4	Confident	78 Å²	78	38.8 Å²	38.8	42%	0.417	19%	0.194	S	C	.	.	H	α-helix	trans	-64.5	-37	175.8	-73.8	-22.5	0	0	0	111.9	N3640 S3641 T3642 K3647 R3648	N3640-D3644 WeakPolarHBondContact O-CB 3.13Å; N3640-D3644 PolarHBondContact O-N 3.1Å; S3641-D3644 PolarHBondContact O-N 2.94Å; T3642-D3644 VanDerWaalsContact C-N 3.34Å; T3642-D3644 PolarHBondContact O-N 3.1Å; D3644-K3647 PolarHBondContact O-N 2.99Å; D3644-R3648 WeakPolarHBondContact O-CB 3.16Å; D3644-R3648 PolarHBondContact O-N 2.93Å
3645	D	91.5	Very high	89.6	Confident	13 Å²	13	40.1 Å²	40.1	7%	0.07	20%	0.197	C	C	.	.	H	α-helix	trans	-64.1	-45.2	173.4	-66.6	-27.5	0	0	0	111.9	Y3606 R3621 S3641 T3642 I3643 R3648 R3649	Y3606-D3645 PolarHBondContact OH-OD2 3.43Å; R3621-D3645 IonicContact CZ-OD2 3.07Å; R3621-D3645 VanDerWaalsContact CZ-OD2 3.28Å; R3621-D3645 IonicContact NH1-OD2 3.07Å; R3621-D3645 PolarHBondContact NH1-OD2 3.13Å; R3621-D3645 IonicContact NH2-OD2 2.86Å; R3621-D3645 PolarHBondContact NH2-OD2 3.07Å; S3641-D3645 WeakPolarHBondContact O-CB 3.45Å; S3641-D3645 PolarHBondContact O-N 3.38Å; T3642-D3645 WeakPolarHBondContact O-CB 3.4Å; T3642-D3645 PolarHBondContact O-N 3.48Å; I3643-D3645 VanDerWaalsContact C-N 3.31Å; I3643-D3645 PolarHBondContact O-N 3.18Å; D3645-R3648 PolarHBondContact O-N 3.36Å; D3645-R3648 IonicContact OD1-CZ 2.79Å; D3645-R3648 IonicContact OD1-NH1 2.68Å; D3645-R3648 PolarHBondContact OD1-NH1 3.05Å; D3645-R3648 IonicContact OD1-NH2 2.72Å; D3645-R3648 PolarHBondContact OD1-NH2 3.3Å; D3645-R3649 WeakPolarHBondContact O-CG 3.37Å; D3645-R3649 PolarHBondContact O-N 2.65Å
3646	A	91.6	Very high	89.7	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-59.1	-47.6	174	0	0	0	0	0	111.4	T3642 I3643 R3648 R3649 G3650 C3746 Y3749 D3750	T3642-A3646 PolarHBondContact O-N 2.85Å; I3643-A3646 PolarHBondContact O-N 2.87Å; A3646-R3648 VanDerWaalsContact C-N 3.3Å; A3646-R3648 PolarHBondContact O-N 2.85Å; A3646-R3649 PolarHBondContact O-N 2.95Å; A3646-G3650 PolarHBondContact O-N 2.69Å; A3646-C3746 HydrophobicContact CB-CB 3.96Å; A3646-Y3749 VanDerWaalsContact O-O 3.12Å; A3646-D3750 HydrophobicContact CB-CB 4.37Å; A3646-D3750 WeakPolarHBondContact O-CA 3.46Å
3647	K	92.4	Very high	89.7	Confident	64 Å²	64	38 Å²	38	28%	0.278	19%	0.185	S	C	.	.	H	α-helix	trans	-58.5	-41	176.4	-74.5	172.9	-178.8	170.9	0	112.5	I3643 D3644 G3650 K3651 Y3749 Y3755	I3643-K3647 HydrophobicContact CG2-CD 4.27Å; I3643-K3647 WeakPolarHBondContact O-CG 3.27Å; I3643-K3647 PolarHBondContact O-N 3.31Å; D3644-K3647 PolarHBondContact O-N 2.99Å; K3647-G3650 PolarHBondContact O-N 3.36Å; K3647-K3651 WeakPolarHBondContact O-CB 3.36Å; K3647-K3651 VanDerWaalsContact O-CG 3.22Å; K3647-K3651 WeakPolarHBondContact O-CG 3.28Å; K3647-K3651 PolarHBondContact O-N 3.42Å; K3647-Y3749 HydrophobicContact CG-CD1 4.43Å; K3647-Y3749 HydrophobicContact CG-CD2 4.26Å; K3647-Y3749 HydrophobicContact CG-CG 3.94Å; K3647-Y3755 WeakPolarHBondContact CA-OH 3.47Å
3648	R	92	Very high	89.7	Confident	133 Å²	133	35.8 Å²	35.8	50%	0.502	17%	0.171	S	C	.	.	H	α-helix	trans	-63.6	-46.8	177.2	-163.5	-176.6	-43.4	95.4	9.5	110.9	D3644 D3645 A3646 G3650 K3651 T3652	D3644-R3648 WeakPolarHBondContact O-CB 3.16Å; D3644-R3648 PolarHBondContact O-N 2.93Å; D3645-R3648 PolarHBondContact O-N 3.36Å; D3645-R3648 IonicContact OD1-CZ 2.79Å; D3645-R3648 IonicContact OD1-NH1 2.68Å; D3645-R3648 PolarHBondContact OD1-NH1 3.05Å; D3645-R3648 IonicContact OD1-NH2 2.72Å; D3645-R3648 PolarHBondContact OD1-NH2 3.3Å; A3646-R3648 VanDerWaalsContact C-N 3.3Å; A3646-R3648 PolarHBondContact O-N 2.85Å; R3648-G3650 PolarHBondContact O-N 2.83Å; R3648-K3651 PolarHBondContact O-N 3.08Å; R3648-T3652 WeakPolarHBondContact O-CB 3.47Å; R3648-T3652 PolarHBondContact O-N 3.08Å; R3648-T3652 PolarHBondContact O-OG1 2.93Å; R3648-T3652 VanDerWaalsContact O-OG1 3.04Å
3649	R	91.6	Very high	89.5	Confident	52 Å²	52	36 Å²	36	20%	0.196	17%	0.173	C	C	.	.	H	α-helix	trans	-56.9	-49.2	176	-68.7	-170.5	-53	-98.6	5.9	111.5	D3531 D3645 A3646 K3651 T3652 L3653	D3531-R3649 IonicContact OD1-NH2 2.71Å; D3531-R3649 IonicContact OD2-CZ 2.7Å; D3531-R3649 IonicContact OD2-NH1 3.28Å; D3531-R3649 PolarHBondContact OD2-NH1 3.12Å; D3531-R3649 IonicContact OD2-NH2 2.79Å; D3531-R3649 PolarHBondContact OD2-NH2 3.43Å; D3645-R3649 WeakPolarHBondContact O-CG 3.37Å; D3645-R3649 PolarHBondContact O-N 2.65Å; A3646-R3649 PolarHBondContact O-N 2.95Å; R3649-K3651 PolarHBondContact O-N 2.81Å; R3649-T3652 PolarHBondContact O-N 3.02Å; R3649-L3653 WeakPolarHBondContact O-CG 3.48Å; R3649-L3653 PolarHBondContact O-N 2.8Å
3650	G	91.1	Very high	89.1	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-62	-42.2	179.8	0	0	0	0	0	113.6	A3646 K3647 R3648 L3653 A3654 Y3749 D3750	A3646-G3650 PolarHBondContact O-N 2.69Å; K3647-G3650 PolarHBondContact O-N 3.36Å; R3648-G3650 PolarHBondContact O-N 2.83Å; G3650-L3653 PolarHBondContact O-N 3.09Å; G3650-A3654 WeakPolarHBondContact O-CB 3.34Å; G3650-A3654 PolarHBondContact O-N 2.84Å; G3650-Y3749 WeakPolarHBondContact CA-O 3.37Å; G3650-D3750 WeakPolarHBondContact CA-O 3.39Å
3651	K	92	Very high	88.6	Confident	82 Å²	82	36.1 Å²	36.1	36%	0.357	17%	0.17	S	C	.	.	H	α-helix	trans	-65.6	-41.2	175.6	-69.8	175.4	-177.6	175.9	0	112.9	K3647 R3648 R3649 A3654 W3655 W3723 Y3755	K3647-K3651 WeakPolarHBondContact O-CB 3.36Å; K3647-K3651 VanDerWaalsContact O-CG 3.22Å; K3647-K3651 WeakPolarHBondContact O-CG 3.28Å; K3647-K3651 PolarHBondContact O-N 3.42Å; R3648-K3651 PolarHBondContact O-N 3.08Å; R3649-K3651 PolarHBondContact O-N 2.81Å; K3651-A3654 PolarHBondContact O-N 3.46Å; K3651-W3655 PolarHBondContact O-N 3.27Å; K3651-W3723 HydrophobicContact CD-CB 4.36Å; K3651-W3723 HydrophobicContact CG-CB 3.85Å; K3651-W3723 HydrophobicContact CG-CG 4.32Å; K3651-Y3755 HydrophobicContact CG-CD1 4.19Å; K3651-Y3755 HydrophobicContact CG-CE1 3.91Å
3652	T	90.5	Very high	88	Confident	74 Å²	74	35.7 Å²	35.7	45%	0.454	17%	0.167	S	C	.	.	H	α-helix	trans	-63	-45.4	175.6	-61.5	0	0	0	0	110.6	R3648 R3649 A3654 W3655 L3656	R3648-T3652 WeakPolarHBondContact O-CB 3.47Å; R3648-T3652 PolarHBondContact O-N 3.08Å; R3648-T3652 PolarHBondContact O-OG1 2.93Å; R3648-T3652 VanDerWaalsContact O-OG1 3.04Å; R3649-T3652 PolarHBondContact O-N 3.02Å; T3652-A3654 VanDerWaalsContact C-N 3.31Å; T3652-A3654 PolarHBondContact O-N 2.98Å; T3652-W3655 PolarHBondContact O-N 2.99Å; T3652-L3656 HydrophobicContact CG2-CD1 4.09Å; T3652-L3656 HydrophobicContact CG2-CG 4.48Å; T3652-L3656 WeakPolarHBondContact O-CG 3.38Å; T3652-L3656 PolarHBondContact O-N 2.78Å
3653	L	89	Confident	87.1	Confident	57 Å²	57	41.4 Å²	41.4	30%	0.298	19%	0.194	S	C	.	.	H	α-helix	trans	-63.6	-36.4	175.7	-71	173.5	0	0	0	112.3	R3649 G3650 L3656 N3657 D3750	R3649-L3653 WeakPolarHBondContact O-CG 3.48Å; R3649-L3653 PolarHBondContact O-N 2.8Å; G3650-L3653 PolarHBondContact O-N 3.09Å; L3653-L3656 PolarHBondContact O-N 2.83Å; L3653-N3657 WeakPolarHBondContact O-CB 3.42Å; L3653-N3657 PolarHBondContact O-N 2.86Å; L3653-D3750 WeakPolarHBondContact CD1-O 3.33Å
3654	A	88.6	Confident	86.1	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-62.8	-44.5	175.4	0	0	0	0	0	112	G3650 K3651 T3652 N3657 E3658 W3723	G3650-A3654 WeakPolarHBondContact O-CB 3.34Å; G3650-A3654 PolarHBondContact O-N 2.84Å; K3651-A3654 PolarHBondContact O-N 3.46Å; T3652-A3654 VanDerWaalsContact C-N 3.31Å; T3652-A3654 PolarHBondContact O-N 2.98Å; A3654-N3657 PolarHBondContact O-N 3.35Å; A3654-E3658 WeakPolarHBondContact O-CG 3.17Å; A3654-E3658 PolarHBondContact O-N 2.85Å; A3654-W3723 HydrophobicContact CB-CD2 3.83Å; A3654-W3723 HydrophobicContact CB-CE3 4.06Å; A3654-W3723 HydrophobicContact CB-CG 4.49Å; A3654-W3723 HydrophobicContact CB-CH2 3.87Å; A3654-W3723 HydrophobicContact CB-CZ2 3.64Å; A3654-W3723 HydrophobicContact CB-CZ3 4.05Å
3655	W	90.2	Very high	84.8	Confident	33 Å²	33	45 Å²	45	13%	0.125	21%	0.207	C	C	.	.	H	α-helix	trans	-62.4	-48.7	173.3	-82.3	127.6	0	0	0	112.9	K3651 T3652 N3657 E3658 V3659 W3704 L3712 N3716 T3717 V3718 W3723 I3757	K3651-W3655 PolarHBondContact O-N 3.27Å; T3652-W3655 PolarHBondContact O-N 2.99Å; W3655-N3657 PolarHBondContact O-N 2.98Å; W3655-E3658 PolarHBondContact O-N 2.81Å; W3655-E3658 VanDerWaalsContact O-N 3.12Å; W3655-V3659 WeakPolarHBondContact O-CG2 3.37Å; W3655-V3659 PolarHBondContact O-N 2.87Å; W3655-V3659 VanDerWaalsContact O-N 3.08Å; W3655-W3704 HydrophobicContact CH2-CH2 4.19Å; W3655-W3704 AromaticContact CZ3-CH2 3.88Å; W3655-W3704 HydrophobicContact CZ3-CH2 3.88Å; W3655-W3704 HydrophobicContact CZ3-CZ2 4.17Å; W3655-L3712 HydrophobicContact CE3-CD1 3.61Å; W3655-L3712 HydrophobicContact CZ3-CD1 3.77Å; W3655-N3716 WeakPolarHBondContact CB-O 3.14Å; W3655-T3717 HydrophobicContact CD2-CG2 3.87Å; W3655-T3717 HydrophobicContact CG-CG2 3.85Å; W3655-T3717 HydrophobicContact CZ2-CG2 4.46Å; W3655-V3718 HydrophobicContact CH2-CB 3.98Å; W3655-V3718 HydrophobicContact CH2-CG2 4.4Å; W3655-V3718 HydrophobicContact CZ3-CB 4.24Å; W3655-V3718 HydrophobicContact CZ3-CG2 4.15Å; W3655-W3723 AromaticContact CD1-CD1 3.74Å; W3655-W3723 AromaticContact CD1-NE1 3.21Å; W3655-W3723 HydrophobicContact CD2-CZ2 4.16Å; W3655-W3723 AromaticContact CD2-NE1 3.3Å; W3655-W3723 VanDerWaalsContact CD2-NE1 3.3Å; W3655-W3723 AromaticContact CE2-CD1 3.81Å; W3655-W3723 AromaticContact CE2-NE1 3.14Å; W3655-W3723 HydrophobicContact CE3-CZ2 4.16Å; W3655-W3723 HydrophobicContact CG-CZ2 4.5Å; W3655-W3723 AromaticContact CG-NE1 3.36Å; W3655-W3723 AromaticContact CZ2-NE1 3.84Å; W3655-W3723 AromaticContact NE1-CD1 3.42Å; W3655-W3723 AromaticContact NE1-NE1 3.08Å; W3655-I3757 HydrophobicContact CH2-CD1 3.54Å; W3655-I3757 HydrophobicContact CZ2-CD1 4.13Å; W3655-I3757 HydrophobicContact CZ3-CD1 3.89Å
3656	L	86.3	Confident	83.3	Confident	52 Å²	52	47.7 Å²	47.7	27%	0.272	22%	0.221	S	C	.	.	H	α-helix	trans	-60	-34.3	178.2	-72	174.1	0	0	0	112.2	F3540 T3652 L3653 V3659 K3660	F3540-L3656 HydrophobicContact CE1-CD1 4.35Å; F3540-L3656 HydrophobicContact CE1-CD2 4.33Å; F3540-L3656 HydrophobicContact CZ-CD1 4.16Å; T3652-L3656 HydrophobicContact CG2-CD1 4.09Å; T3652-L3656 HydrophobicContact CG2-CG 4.48Å; T3652-L3656 WeakPolarHBondContact O-CG 3.38Å; T3652-L3656 PolarHBondContact O-N 2.78Å; L3653-L3656 PolarHBondContact O-N 2.83Å; L3656-V3659 PolarHBondContact O-N 2.63Å; L3656-K3660 WeakPolarHBondContact O-CB 3.48Å; L3656-K3660 PolarHBondContact O-N 2.89Å
3657	N	85.4	Confident	81.3	Confident	13 Å²	13	51.8 Å²	51.8	7%	0.07	25%	0.247	C	C	.	.	H	α-helix	trans	-65.1	-44.6	175	-177.5	63.3	0	0	0	112.3	Y2739 L3653 A3654 W3655 V3659 K3660 L3661	Y2739-N3657 HydrophobicContact CD2-CB 4.12Å; Y2739-N3657 WeakPolarHBondContact CD2-OD1 3.11Å; Y2739-N3657 HydrophobicContact CE2-CB 4.24Å; Y2739-N3657 WeakPolarHBondContact CE2-ND2 3.44Å; Y2739-N3657 VanDerWaalsContact CE2-OD1 3.25Å; Y2739-N3657 WeakPolarHBondContact CE2-OD1 3.49Å; L3653-N3657 WeakPolarHBondContact O-CB 3.42Å; L3653-N3657 PolarHBondContact O-N 2.86Å; A3654-N3657 PolarHBondContact O-N 3.35Å; W3655-N3657 PolarHBondContact O-N 2.98Å; N3657-V3659 VanDerWaalsContact C-N 3.29Å; N3657-V3659 PolarHBondContact O-N 3.04Å; N3657-K3660 PolarHBondContact O-N 2.85Å; N3657-L3661 WeakPolarHBondContact O-CG 3.41Å; N3657-L3661 PolarHBondContact O-N 3Å
3658	E	85.3	Confident	79.3	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-59.9	-41.7	175.4	-64.2	-69.6	140.1	0	0	111.2	A3654 W3655 L3661 I3662 F3700 N3701 W3704 L3712 W3723	A3654-E3658 WeakPolarHBondContact O-CG 3.17Å; A3654-E3658 PolarHBondContact O-N 2.85Å; W3655-E3658 PolarHBondContact O-N 2.81Å; W3655-E3658 VanDerWaalsContact O-N 3.12Å; E3658-L3661 PolarHBondContact O-N 2.83Å; E3658-I3662 WeakPolarHBondContact O-CG1 3.21Å; E3658-I3662 PolarHBondContact O-N 3.26Å; E3658-I3662 VanDerWaalsContact O-N 3.1Å; E3658-F3700 VanDerWaalsContact OE2-CD1 3.31Å; E3658-F3700 WeakPolarHBondContact OE2-CD1 3.28Å; E3658-N3701 WeakPolarHBondContact OE1-CB 3.4Å; E3658-N3701 PolarHBondContact OE1-N 2.61Å; E3658-N3701 PolarHBondContact OE1-ND2 2.87Å; E3658-W3704 HydrophobicContact CG-CZ2 4.43Å; E3658-W3704 PolarHBondContact OE2-NE1 2.89Å; E3658-L3712 HydrophobicContact CB-CD2 3.78Å; E3658-W3723 HydrophobicContact CG-CH2 3.9Å; E3658-W3723 HydrophobicContact CG-CZ2 4.02Å
3659	V	85	Confident	77.1	Confident	7 Å²	7	51 Å²	51	4%	0.042	26%	0.259	C	S	.	.	H	α-helix	trans	-62.6	-45.6	175.3	177.1	0	0	0	0	111.5	W3655 L3656 N3657 L3661 I3662 Q3663 L3712 N3716	W3655-V3659 WeakPolarHBondContact O-CG2 3.37Å; W3655-V3659 PolarHBondContact O-N 2.87Å; W3655-V3659 VanDerWaalsContact O-N 3.08Å; L3656-V3659 PolarHBondContact O-N 2.63Å; N3657-V3659 VanDerWaalsContact C-N 3.29Å; N3657-V3659 PolarHBondContact O-N 3.04Å; V3659-L3661 PolarHBondContact O-N 3.39Å; V3659-I3662 PolarHBondContact O-N 2.74Å; V3659-Q3663 WeakPolarHBondContact O-CG 3.26Å; V3659-Q3663 PolarHBondContact O-N 2.92Å; V3659-L3712 HydrophobicContact CG2-CD1 3.76Å; V3659-L3712 HydrophobicContact CG2-CG 3.98Å; V3659-N3716 HydrophobicContact CG2-CB 4.21Å
3660	K	80.2	Confident	74.8	Confident	62 Å²	62	57.1 Å²	57.1	27%	0.27	29%	0.286	S	S	.	.	H	α-helix	trans	-60.1	-45.2	178.7	-175.9	178.3	179.9	177.4	0	111.3	E3046 L3656 N3657 I3662 Q3663 Q3664	E3046-K3660 VanDerWaalsContact CD-NZ 3.32Å; E3046-K3660 WeakPolarHBondContact OE1-CE 3.31Å; E3046-K3660 IonicContact OE1-NZ 3.54Å; E3046-K3660 PolarHBondContact OE1-NZ 3.18Å; E3046-K3660 VanDerWaalsContact OE1-NZ 3.16Å; E3046-K3660 IonicContact OE2-NZ 3.21Å; E3046-K3660 PolarHBondContact OE2-NZ 2.8Å; L3656-K3660 WeakPolarHBondContact O-CB 3.48Å; L3656-K3660 PolarHBondContact O-N 2.89Å; N3657-K3660 PolarHBondContact O-N 2.85Å; K3660-I3662 VanDerWaalsContact C-N 3.32Å; K3660-I3662 PolarHBondContact O-N 2.81Å; K3660-Q3663 PolarHBondContact O-N 3.03Å; K3660-Q3664 WeakPolarHBondContact O-CG 3.42Å; K3660-Q3664 PolarHBondContact O-N 2.84Å; K3660-Q3664 VanDerWaalsContact O-N 3.16Å
3661	L	77.7	Confident	72.1	Confident	20 Å²	20	61.5 Å²	61.5	11%	0.105	32%	0.317	C	S	.	.	H	α-helix	trans	-58	-46	176	-70.6	172.3	0	0	0	110.6	N3657 E3658 V3659 Q3663 Q3664 F3665 F3700	N3657-L3661 WeakPolarHBondContact O-CG 3.41Å; N3657-L3661 PolarHBondContact O-N 3Å; E3658-L3661 PolarHBondContact O-N 2.83Å; V3659-L3661 PolarHBondContact O-N 3.39Å; L3661-Q3663 PolarHBondContact O-N 2.76Å; L3661-Q3664 PolarHBondContact O-N 2.86Å; L3661-F3665 WeakPolarHBondContact O-CD2 3.41Å; L3661-F3665 PolarHBondContact O-N 2.88Å; L3661-F3700 HydrophobicContact CB-CD1 4.04Å; L3661-F3700 HydrophobicContact CB-CE1 3.47Å; L3661-F3700 VanDerWaalsContact CB-CE1 3.47Å; L3661-F3700 HydrophobicContact CB-CZ 4.01Å; L3661-F3700 HydrophobicContact CD1-CD1 3.95Å; L3661-F3700 HydrophobicContact CD1-CE1 4.27Å
3662	I	76.1	Confident	69.1	Low	3 Å²	3	63 Å²	63	2%	0.015	33%	0.334	C	S	.	.	H	α-helix	trans	-59.9	-45.6	177.3	-67	169.9	0	0	0	112	E3658 V3659 K3660 Q3664 F3665 I3666 F3700 L3709 L3712 V3713	E3658-I3662 WeakPolarHBondContact O-CG1 3.21Å; E3658-I3662 PolarHBondContact O-N 3.26Å; E3658-I3662 VanDerWaalsContact O-N 3.1Å; V3659-I3662 PolarHBondContact O-N 2.74Å; K3660-I3662 VanDerWaalsContact C-N 3.32Å; K3660-I3662 PolarHBondContact O-N 2.81Å; I3662-Q3664 PolarHBondContact O-N 3.45Å; I3662-F3665 CarbonylContact O-C 3.56Å; I3662-F3665 PolarHBondContact O-N 3.13Å; I3662-I3666 HydrophobicContact CG2-CD1 3.93Å; I3662-I3666 HydrophobicContact CG2-CG1 4.02Å; I3662-I3666 WeakPolarHBondContact O-CG1 3.42Å; I3662-I3666 PolarHBondContact O-N 2.89Å; I3662-F3700 HydrophobicContact CG1-CE1 3.73Å; I3662-F3700 HydrophobicContact CG1-CZ 3.91Å; I3662-L3709 HydrophobicContact CD1-CD1 3.66Å; I3662-L3709 HydrophobicContact CD1-CG 3.96Å; I3662-L3709 HydrophobicContact CG1-CD1 3.78Å; I3662-L3709 HydrophobicContact CG1-CG 4.38Å; I3662-L3709 HydrophobicContact CG2-CD1 4.2Å; I3662-L3709 HydrophobicContact CG2-CD2 4.24Å; I3662-L3709 HydrophobicContact CG2-CG 4.11Å; I3662-L3712 HydrophobicContact CD1-CB 4.09Å; I3662-L3712 HydrophobicContact CD1-CD2 3.23Å; I3662-L3712 HydrophobicContact CD1-CG 3.75Å; I3662-V3713 HydrophobicContact CG2-CG2 3.7Å
3663	Q	73.4	Confident	66.5	Low	120 Å²	120	64.8 Å²	64.8	56%	0.561	35%	0.346	S	S	*	.	H	α-helix	trans	-59.1	-35.6	179.6	-72.4	175.7	-9.4	0	0	112.4	V3659 K3660 L3661 F3665 P3667	V3659-Q3663 WeakPolarHBondContact O-CG 3.26Å; V3659-Q3663 PolarHBondContact O-N 2.92Å; K3660-Q3663 PolarHBondContact O-N 3.03Å; L3661-Q3663 PolarHBondContact O-N 2.76Å; Q3663-F3665 VanDerWaalsContact C-N 3.32Å; Q3663-P3667 WeakPolarHBondContact O-CD 3.17Å
3664	Q	68.8	Low	63.7	Low	105 Å²	105	69 Å²	69	49%	0.491	38%	0.375	S	S	.	.	H	α-helix	trans	-69.6	-27.3	174.5	-67.9	177.7	-9.8	0	0	112.8	K3660 L3661 I3662	K3660-Q3664 WeakPolarHBondContact O-CG 3.42Å; K3660-Q3664 PolarHBondContact O-N 2.84Å; K3660-Q3664 VanDerWaalsContact O-N 3.16Å; L3661-Q3664 PolarHBondContact O-N 2.86Å; I3662-Q3664 PolarHBondContact O-N 3.45Å
3665	F	62.6	Low	60.9	Low	55 Å²	55	73.6 Å²	73.6	24%	0.241	41%	0.406	C	S	.	.	H	α-helix	trans	-90.8	-25.7	179.3	-76	-68.2	0	0	0	115	L3661 I3662 Q3663 P3667 T3668 L3698 F3700	L3661-F3665 WeakPolarHBondContact O-CD2 3.41Å; L3661-F3665 PolarHBondContact O-N 2.88Å; I3662-F3665 CarbonylContact O-C 3.56Å; I3662-F3665 PolarHBondContact O-N 3.13Å; Q3663-F3665 VanDerWaalsContact C-N 3.32Å; F3665-P3667 VanDerWaalsContact C-N 3.31Å; F3665-T3668 PolarHBondContact O-N 3.21Å; F3665-T3668 PolarHBondContact O-OG1 3.17Å; F3665-L3698 HydrophobicContact CD1-CD2 4.02Å; F3665-L3698 HydrophobicContact CD2-CD2 4.42Å; F3665-L3698 HydrophobicContact CE1-CD2 3.24Å; F3665-L3698 HydrophobicContact CE2-CB 4.33Å; F3665-L3698 HydrophobicContact CE2-CD2 3.75Å; F3665-L3698 HydrophobicContact CZ-CB 4.27Å; F3665-L3698 HydrophobicContact CZ-CD2 3.13Å; F3665-L3698 HydrophobicContact CZ-CG 4.26Å; F3665-F3700 AromaticContact CD2-CE2 4Å; F3665-F3700 HydrophobicContact CD2-CE2 4Å; F3665-F3700 AromaticContact CD2-CZ 3.86Å; F3665-F3700 HydrophobicContact CD2-CZ 3.86Å; F3665-F3700 HydrophobicContact CE2-CE2 4.19Å; F3665-F3700 HydrophobicContact CE2-CZ 4.32Å
3666	I	58.9	Low	58.2	Low	70 Å²	70	81.8 Å²	81.8	36%	0.359	44%	0.443	S	S	.	.	H	α-helix	trans	-51.4	-40.3	179.7	-72.6	166.6	0	0	0	113.8	I3662 T3668 L3669 V3713	I3662-I3666 HydrophobicContact CG2-CD1 3.93Å; I3662-I3666 HydrophobicContact CG2-CG1 4.02Å; I3662-I3666 WeakPolarHBondContact O-CG1 3.42Å; I3662-I3666 PolarHBondContact O-N 2.89Å; I3666-T3668 VanDerWaalsContact C-N 3.26Å; I3666-T3668 PolarHBondContact O-N 3.01Å; I3666-L3669 PolarHBondContact O-N 2.83Å; I3666-V3713 HydrophobicContact CD1-CG2 4.44Å
3667	P	51.4	Low	55.6	Low	85 Å²	85	86.3 Å²	86.3	55%	0.552	47%	0.466	S	S	*	.	H	α-helix	trans	-61	-31.1	177.5	-23.6	33.9	0	0	0	113.8	Q3663 F3665	Q3663-P3667 WeakPolarHBondContact O-CD 3.17Å; F3665-P3667 VanDerWaalsContact C-N 3.31Å
3668	T	49.4	Very low	52.9	Low	81 Å²	81	91.8 Å²	91.8	50%	0.497	50%	0.495	S	S	.	.	H	α-helix	trans	-79.4	-23.9	-177.5	65.2	0	0	0	0	113	F3665 I3666 K3670 S3671	F3665-T3668 PolarHBondContact O-N 3.21Å; F3665-T3668 PolarHBondContact O-OG1 3.17Å; I3666-T3668 VanDerWaalsContact C-N 3.26Å; I3666-T3668 PolarHBondContact O-N 3.01Å; T3668-K3670 VanDerWaalsContact C-N 3.27Å; T3668-K3670 PolarHBondContact O-N 3.37Å; T3668-S3671 PolarHBondContact O-OG 3.14Å
3669	L	46	Very low	50.3	Low	101 Å²	101	100.1 Å²	100.1	53%	0.529	53%	0.534	S	S	.	.	H	α-helix	trans	-68.7	-24.8	173.3	-94.2	86.8	0	0	0	113	I3666 V3688	I3666-L3669 PolarHBondContact O-N 2.83Å; L3669-V3688 HydrophobicContact CD1-CG1 4.47Å; L3669-V3688 HydrophobicContact CD2-CG1 4.2Å
3670	K	43.2	Very low	47.7	Very low	179 Å²	179	106.9 Å²	106.9	78%	0.778	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	-10.9	-177.1	-70.3	-174.2	178.7	-179.4	0	114	T3668	T3668-K3670 VanDerWaalsContact C-N 3.27Å; T3668-K3670 PolarHBondContact O-N 3.37Å
3671	S	34.5	Very low	45.3	Very low	92 Å²	92	111.8 Å²	111.8	64%	0.643	60%	0.598	S	S	*	*			trans	-99.9	24.3	-169.4	74.1	0	0	0	0	115.6	T3668 P3673	T3668-S3671 PolarHBondContact O-OG 3.14Å; S3671-P3673 WeakPolarHBondContact O-CD 3.22Å
3672	T	29.7	Very low	43.1	Very low	115 Å²	115	116.2 Å²	116.2	71%	0.706	62%	0.621	S	S	*	*			trans	-100.2	105	167.2	-8.1	0	0	0	0	109.5	T3674	T3672-T3674 PolarHBondContact O-N 2.96Å
3673	P	34.2	Very low	41	Very low	110 Å²	110	123 Å²	123	71%	0.714	66%	0.657	S	S	*	*			trans	-66.1	124	173.3	26	-30.4	0	0	0	108.3	S3671 S3675	S3671-P3673 WeakPolarHBondContact O-CD 3.22Å; P3673-S3675 VanDerWaalsContact C-N 3.28Å; P3673-S3675 PolarHBondContact O-N 2.95Å
3674	T	30	Very low	39.3	Very low	147 Å²	147	126.5 Å²	126.5	90%	0.902	67%	0.673	S	S	*	*			trans	-57.2	88.8	172	49.1	0	0	0	0	109.6	T3672	T3672-T3674 PolarHBondContact O-N 2.96Å
3675	S	31.8	Very low	37.6	Very low	95 Å²	95	128 Å²	128	66%	0.664	69%	0.685	S	S	*	*			trans	-88.6	129.2	163.9	51.4	0	0	0	0	107.8	P3673 I3677	P3673-S3675 VanDerWaalsContact C-N 3.28Å; P3673-S3675 PolarHBondContact O-N 2.95Å; S3675-I3677 PolarHBondContact O-N 2.89Å
3676	K	32.7	Very low	36.7	Very low	206 Å²	206	131 Å²	131	90%	0.896	70%	0.703	S	S	*	*			trans	-53.5	103.9	-178.8	-66	172.9	175.8	179.4	0	110.4
3677	I	32.3	Very low	35.8	Very low	146 Å²	146	133.9 Å²	133.9	75%	0.749	71%	0.714	S	S	*	*			trans	-127.5	89.5	161.8	-60	179.5	0	0	0	106.1	S3675	S3675-I3677 PolarHBondContact O-N 2.89Å
3678	D	28.3	Very low	35.5	Very low	129 Å²	129	133 Å²	133	69%	0.69	71%	0.706	S	S	*	*			trans	-64.2	147.6	161	-71	-47.4	0	0	0	109.1
3679	H	29.7	Very low	35.2	Very low	175 Å²	175	133 Å²	133	81%	0.81	70%	0.698	S	S	*	*			trans	79.6	61.7	168.7	-48.9	-62.9	0	0	0	119
3680	L	29.9	Very low	34.6	Very low	149 Å²	149	135.7 Å²	135.7	78%	0.78	71%	0.707	S	S	*	*			trans	-144.2	106.8	140.9	-87.1	176.2	0	0	0	109.5	I3682	L3680-I3682 PolarHBondContact O-N 2.88Å
3681	N	30.3	Very low	34.6	Very low	165 Å²	165	135.4 Å²	135.4	88%	0.882	71%	0.706	S	S	*	*			trans	-73.8	60.1	-179.5	-154.3	12.5	0	0	0	110.9
3682	I	32.6	Very low	35	Very low	112 Å²	112	136.7 Å²	136.7	57%	0.574	71%	0.705	S	S	*	*			trans	-96	113.1	171.6	-59.9	174.7	0	0	0	106.5	L3680 Q3684	L3680-I3682 PolarHBondContact O-N 2.88Å; I3682-Q3684 PolarHBondContact O-N 2.79Å
3683	N	31.6	Very low	36	Very low	147 Å²	147	133.4 Å²	133.4	79%	0.786	69%	0.685	S	S	*	*			trans	-39.1	103.3	174.2	-73.6	-22.8	0	0	0	111.4	N3685	N3683-N3685 PolarHBondContact O-N 2.86Å
3684	Q	36.5	Very low	37.2	Very low	192 Å²	192	129 Å²	129	90%	0.897	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	9	-178.4	-73.6	-172.8	-18.2	0	0	113.9	I3682	I3682-Q3684 PolarHBondContact O-N 2.79Å
3685	N	34.8	Very low	38.8	Very low	137 Å²	137	127.4 Å²	127.4	73%	0.733	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	-22	-163.5	-92.8	1.1	0	0	0	118.2	N3683	N3683-N3685 PolarHBondContact O-N 2.86Å
3686	D	42.8	Very low	40.4	Very low	118 Å²	118	126.3 Å²	126.3	63%	0.631	62%	0.619	S	S	*	*	S	Bend	trans	-114.1	-18	-159.7	-75.1	-27.4	0	0	0	121.2
3687	F	41.2	Very low	41.7	Very low	131 Å²	131	118 Å²	118	58%	0.575	59%	0.585	S	S	*	*			trans	-151	132.2	174.4	-73.7	-80.1	0	0	0	113.5	Y3689	F3687-Y3689 HydrophobicContact CD1-CD2 4.45Å; F3687-Y3689 PolarHBondContact O-N 2.76Å
3688	V	44.5	Very low	42.9	Very low	65 Å²	65	111.7 Å²	111.7	39%	0.394	55%	0.552	S	S	.	*	S	Bend	trans	-72.3	-1.4	177.7	177.6	0	0	0	0	112.7	L3669 H3690 R3706	L3669-V3688 HydrophobicContact CD1-CG1 4.47Å; L3669-V3688 HydrophobicContact CD2-CG1 4.2Å; V3688-H3690 PolarHBondContact O-N 3.43Å; V3688-R3706 HydrophobicContact CG2-CB 4.35Å
3689	Y	43.5	Very low	44.7	Very low	81 Å²	81	106.7 Å²	106.7	32%	0.318	53%	0.531	S	S	.	.			trans	-74.6	15.9	-176.6	-75.8	-80.9	0	0	0	116	F3687 K3691 L3698 P3703	F3687-Y3689 HydrophobicContact CD1-CD2 4.45Å; F3687-Y3689 PolarHBondContact O-N 2.76Å; Y3689-K3691 PolarHBondContact O-N 3.18Å; Y3689-K3691 VanDerWaalsContact O-N 3.07Å; Y3689-L3698 HydrophobicContact CD1-CD1 3.9Å; Y3689-L3698 HydrophobicContact CE1-CD1 3.42Å; Y3689-L3698 VanDerWaalsContact CE1-CD1 3.42Å; Y3689-P3703 HydrophobicContact CD2-CB 4.1Å; Y3689-P3703 VanDerWaalsContact CE2-CA 3.41Å; Y3689-P3703 HydrophobicContact CE2-CB 3.38Å; Y3689-P3703 WeakPolarHBondContact OH-CA 3.5Å
3690	H	33.5	Very low	46.8	Very low	158 Å²	158	99.1 Å²	99.1	73%	0.731	50%	0.496	S	S	*	.			trans	-74.6	108.7	-175	-116.4	-68.7	0	0	0	112.6	V3688	V3688-H3690 PolarHBondContact O-N 3.43Å
3691	K	43	Very low	49	Very low	173 Å²	173	92.7 Å²	92.7	75%	0.752	46%	0.462	S	S	*	.	S	Bend	trans	101.4	94.8	162.7	-62.1	-179.1	175.9	178.9	0	115.7	Y3689 T3693	Y3689-K3691 PolarHBondContact O-N 3.18Å; Y3689-K3691 VanDerWaalsContact O-N 3.07Å; K3691-T3693 PolarHBondContact O-N 3.49Å
3692	L	42.9	Very low	51.3	Low	119 Å²	119	87.8 Å²	87.8	62%	0.623	43%	0.432	S	S	*	.	S	Bend	trans	85.4	-39.5	151.6	-59	165.9	0	0	0	118.2	E3076 T3078 S3694	E3076-L3692 VanDerWaalsContact CD-O 3.26Å; E3076-L3692 WeakPolarHBondContact OE1-CB 3.39Å; E3076-L3692 VanDerWaalsContact OE2-O 3.11Å; T3078-L3692 HydrophobicContact CG2-CB 4.25Å; T3078-L3692 HydrophobicContact CG2-CD1 3.88Å; L3692-S3694 PolarHBondContact O-N 2.88Å
3693	T	49.9	Very low	53.3	Low	46 Å²	46	84.9 Å²	84.9	28%	0.282	42%	0.42	S	S	.	.			trans	-72.2	121.5	-172.2	56	0	0	0	0	114.8	Q3063 K3691	Q3063-T3693 VanDerWaalsContact OE1-CG2 3.3Å; K3691-T3693 PolarHBondContact O-N 3.49Å
3694	S	59	Low	55.6	Low	19 Å²	19	78.1 Å²	78.1	13%	0.133	38%	0.384	C	S	.	.			trans	-66.4	155.5	178.5	83.7	0	0	0	0	114	W3074 E3076 L3692 Y3696 I3697 L3698	W3074-S3694 VanDerWaalsContact CE2-CB 3.49Å; W3074-S3694 VanDerWaalsContact CZ2-CB 3.46Å; W3074-S3694 PolarHBondContact NE1-OG 3.26Å; E3076-S3694 PolarHBondContact OE2-N 3.07Å; L3692-S3694 PolarHBondContact O-N 2.88Å; S3694-Y3696 PolarHBondContact O-N 2.89Å; S3694-Y3696 VanDerWaalsContact O-N 3.08Å; S3694-Y3696 PolarHBondContact OG-N 3.38Å; S3694-I3697 PolarHBondContact O-N 2.88Å; S3694-I3697 VanDerWaalsContact O-N 3.08Å; S3694-I3697 PolarHBondContact OG-N 2.89Å; S3694-L3698 PolarHBondContact O-N 2.8Å
3695	K	64.6	Low	57.6	Low	112 Å²	112	71 Å²	71	49%	0.487	35%	0.352	S	S	.	.	H	α-helix	trans	-52.1	-30.3	171.1	-179.8	179.1	-179.8	173.9	0	112.6	G3699 F3700 N3701	K3695-G3699 PolarHBondContact O-N 2.82Å; K3695-F3700 WeakPolarHBondContact CE-O 3.33Å; K3695-N3701 PolarHBondContact NZ-O 3.26Å
3696	Y	64.6	Low	59.5	Low	72 Å²	72	73.1 Å²	73.1	28%	0.282	35%	0.35	S	S	.	.	H	α-helix	trans	-69.8	-36.3	-179.7	-62.6	-75.7	0	0	0	112.7	S2784 A3065 W3074 S3694	S2784-Y3696 WeakPolarHBondContact CA-OH 3.43Å; A3065-Y3696 VanDerWaalsContact CB-O 3.27Å; A3065-Y3696 WeakPolarHBondContact CB-O 3.41Å; W3074-Y3696 AromaticContact CD2-CD2 3.94Å; W3074-Y3696 HydrophobicContact CD2-CD2 3.94Å; W3074-Y3696 HydrophobicContact CD2-CG 4.36Å; W3074-Y3696 AromaticContact CE3-CD2 3.51Å; W3074-Y3696 HydrophobicContact CE3-CD2 3.51Å; W3074-Y3696 HydrophobicContact CE3-CE2 4.02Å; W3074-Y3696 HydrophobicContact CE3-CG 4.14Å; W3074-Y3696 HydrophobicContact CH2-CD2 4.3Å; W3074-Y3696 AromaticContact CZ3-CD2 3.72Å; W3074-Y3696 HydrophobicContact CZ3-CD2 3.72Å; W3074-Y3696 AromaticContact CZ3-CE2 3.86Å; W3074-Y3696 HydrophobicContact CZ3-CE2 3.86Å; S3694-Y3696 PolarHBondContact O-N 2.89Å; S3694-Y3696 VanDerWaalsContact O-N 3.08Å; S3694-Y3696 PolarHBondContact OG-N 3.38Å
3697	I	59.7	Low	61.3	Low	33 Å²	33	75.1 Å²	75.1	17%	0.169	36%	0.355	C	S	.	.	H	α-helix	trans	-72.7	-42.5	177	-64.4	166.7	0	0	0	110.5	Q3063 E3076 S3694 G3699	Q3063-I3697 HydrophobicContact CB-CD1 3.93Å; Q3063-I3697 HydrophobicContact CB-CG1 4.5Å; Q3063-I3697 HydrophobicContact CB-CG2 4.27Å; E3076-I3697 HydrophobicContact CB-CD1 3.68Å; E3076-I3697 HydrophobicContact CG-CD1 4.44Å; E3076-I3697 WeakPolarHBondContact OE2-CD1 3.27Å; S3694-I3697 PolarHBondContact O-N 2.88Å; S3694-I3697 VanDerWaalsContact O-N 3.08Å; S3694-I3697 PolarHBondContact OG-N 2.89Å; I3697-G3699 VanDerWaalsContact C-N 3.33Å; I3697-G3699 PolarHBondContact O-N 3.21Å
3698	L	57.2	Low	63.4	Low	12 Å²	12	70.1 Å²	70.1	6%	0.063	33%	0.333	C	S	.	.	H	α-helix	trans	-75.3	-24.1	-176.1	-58.8	173.1	0	0	0	112.8	F3665 Y3689 S3694 F3700	F3665-L3698 HydrophobicContact CD1-CD2 4.02Å; F3665-L3698 HydrophobicContact CD2-CD2 4.42Å; F3665-L3698 HydrophobicContact CE1-CD2 3.24Å; F3665-L3698 HydrophobicContact CE2-CB 4.33Å; F3665-L3698 HydrophobicContact CE2-CD2 3.75Å; F3665-L3698 HydrophobicContact CZ-CB 4.27Å; F3665-L3698 HydrophobicContact CZ-CD2 3.13Å; F3665-L3698 HydrophobicContact CZ-CG 4.26Å; Y3689-L3698 HydrophobicContact CD1-CD1 3.9Å; Y3689-L3698 HydrophobicContact CE1-CD1 3.42Å; Y3689-L3698 VanDerWaalsContact CE1-CD1 3.42Å; S3694-L3698 PolarHBondContact O-N 2.8Å; L3698-F3700 HydrophobicContact CB-CD2 3.62Å; L3698-F3700 HydrophobicContact CB-CE2 4.03Å; L3698-F3700 HydrophobicContact CD1-CD2 4.33Å; L3698-F3700 PolarHBondContact O-N 2.73Å
3699	G	67.6	Low	65.1	Low	24 Å²	24	68.9 Å²	68.9	25%	0.247	32%	0.324	C	S	.	.			trans	70.8	-4.2	177.8	0	0	0	0	0	115.6	K3695 I3697	K3695-G3699 PolarHBondContact O-N 2.82Å; I3697-G3699 VanDerWaalsContact C-N 3.33Å; I3697-G3699 PolarHBondContact O-N 3.21Å
3700	F	72.6	Confident	66.9	Low	16 Å²	16	67.7 Å²	67.7	7%	0.07	33%	0.328	C	S	.	.			trans	-59.1	138.6	-179.5	-69.8	-58.7	0	0	0	112.5	E3658 L3661 I3662 F3665 K3695 L3698 Y3702	E3658-F3700 VanDerWaalsContact OE2-CD1 3.31Å; E3658-F3700 WeakPolarHBondContact OE2-CD1 3.28Å; L3661-F3700 HydrophobicContact CB-CD1 4.04Å; L3661-F3700 HydrophobicContact CB-CE1 3.47Å; L3661-F3700 VanDerWaalsContact CB-CE1 3.47Å; L3661-F3700 HydrophobicContact CB-CZ 4.01Å; L3661-F3700 HydrophobicContact CD1-CD1 3.95Å; L3661-F3700 HydrophobicContact CD1-CE1 4.27Å; I3662-F3700 HydrophobicContact CG1-CE1 3.73Å; I3662-F3700 HydrophobicContact CG1-CZ 3.91Å; F3665-F3700 AromaticContact CD2-CE2 4Å; F3665-F3700 HydrophobicContact CD2-CE2 4Å; F3665-F3700 AromaticContact CD2-CZ 3.86Å; F3665-F3700 HydrophobicContact CD2-CZ 3.86Å; F3665-F3700 HydrophobicContact CE2-CE2 4.19Å; F3665-F3700 HydrophobicContact CE2-CZ 4.32Å; K3695-F3700 WeakPolarHBondContact CE-O 3.33Å; L3698-F3700 HydrophobicContact CB-CD2 3.62Å; L3698-F3700 HydrophobicContact CB-CE2 4.03Å; L3698-F3700 HydrophobicContact CD1-CD2 4.33Å; L3698-F3700 PolarHBondContact O-N 2.73Å; F3700-Y3702 VanDerWaalsContact C-N 3.29Å
3701	N	77.4	Confident	69.4	Low	15 Å²	15	62.1 Å²	62.1	8%	0.08	30%	0.302	C	S	.	.	S	Bend	trans	-69	-31	171.5	-78.1	-73.2	0	0	0	112.2	K2755 E3658 K3695 W3723 Y3755 I3757	K2755-N3701 VanDerWaalsContact CE-OD1 3.27Å; K2755-N3701 WeakPolarHBondContact CE-OD1 3.5Å; K2755-N3701 PolarHBondContact NZ-OD1 2.9Å; E3658-N3701 WeakPolarHBondContact OE1-CB 3.4Å; E3658-N3701 PolarHBondContact OE1-N 2.61Å; E3658-N3701 PolarHBondContact OE1-ND2 2.87Å; K3695-N3701 PolarHBondContact NZ-O 3.26Å; N3701-W3723 HydrophobicContact CB-CH2 4.02Å; N3701-W3723 HydrophobicContact CB-CZ3 3.95Å; N3701-Y3755 PolarHBondContact OD1-O 2.91Å; N3701-I3757 HydrophobicContact CB-CG2 3.98Å
3702	Y	77.7	Confident	71.4	Confident	61 Å²	61	53.9 Å²	53.9	24%	0.239	27%	0.266	C	S	.	.	S	Bend	trans	-145	148.2	-172.7	-169	-96.3	0	0	0	113	F3700 W3704 Y3721 I3757	F3700-Y3702 VanDerWaalsContact C-N 3.29Å; Y3702-W3704 HydrophobicContact CD1-CD2 4.3Å; Y3702-W3704 AromaticContact CD1-CE3 3.97Å; Y3702-W3704 HydrophobicContact CD1-CE3 3.97Å; Y3702-W3704 HydrophobicContact CD1-CZ3 4.14Å; Y3702-W3704 PolarHBondContact O-N 3.44Å; Y3702-Y3721 HydrophobicContact CD1-CE1 4.17Å; Y3702-Y3721 AromaticContact CE1-CE1 3.66Å; Y3702-Y3721 HydrophobicContact CE1-CE1 3.66Å; Y3702-Y3721 AromaticContact CE1-CZ 3.82Å; Y3702-Y3721 WeakPolarHBondContact CE1-OH 3.42Å; Y3702-Y3721 HydrophobicContact CE2-CE1 4.22Å; Y3702-Y3721 AromaticContact CZ-CE1 3.7Å; Y3702-I3757 HydrophobicContact CD2-CG2 4.11Å; Y3702-I3757 HydrophobicContact CG-CG2 3.93Å
3703	P	74.2	Confident	73.3	Confident	51 Å²	51	51.3 Å²	51.3	33%	0.331	26%	0.255	S	S	.	.			trans	-75.1	103.2	174.1	30.4	-34.3	0	0	0	112.3	Y3689	Y3689-P3703 HydrophobicContact CD2-CB 4.1Å; Y3689-P3703 VanDerWaalsContact CE2-CA 3.41Å; Y3689-P3703 HydrophobicContact CE2-CB 3.38Å; Y3689-P3703 WeakPolarHBondContact OH-CA 3.5Å
3704	W	80.6	Confident	75	Confident	5 Å²	5	56.3 Å²	56.3	2%	0.019	28%	0.275	C	S	.	.			trans	-79.9	134.8	178.7	-57.4	113.5	0	0	0	112.5	W3655 E3658 Y3702 E3708 L3709 L3712 V3718 Y3721 I3757	W3655-W3704 HydrophobicContact CH2-CH2 4.19Å; W3655-W3704 AromaticContact CZ3-CH2 3.88Å; W3655-W3704 HydrophobicContact CZ3-CH2 3.88Å; W3655-W3704 HydrophobicContact CZ3-CZ2 4.17Å; E3658-W3704 HydrophobicContact CG-CZ2 4.43Å; E3658-W3704 PolarHBondContact OE2-NE1 2.89Å; Y3702-W3704 HydrophobicContact CD1-CD2 4.3Å; Y3702-W3704 AromaticContact CD1-CE3 3.97Å; Y3702-W3704 HydrophobicContact CD1-CE3 3.97Å; Y3702-W3704 HydrophobicContact CD1-CZ3 4.14Å; Y3702-W3704 PolarHBondContact O-N 3.44Å; W3704-E3708 HydrophobicContact CE3-CB 3.87Å; W3704-E3708 HydrophobicContact CE3-CG 4.47Å; W3704-L3709 HydrophobicContact CB-CD1 4.34Å; W3704-L3712 HydrophobicContact CD2-CD2 4.41Å; W3704-L3712 HydrophobicContact CZ2-CD2 4.14Å; W3704-V3718 HydrophobicContact CE3-CG2 4.13Å; W3704-V3718 HydrophobicContact CH2-CB 4.16Å; W3704-V3718 HydrophobicContact CH2-CG2 3.88Å; W3704-V3718 HydrophobicContact CZ3-CB 3.86Å; W3704-V3718 HydrophobicContact CZ3-CG1 4.05Å; W3704-V3718 HydrophobicContact CZ3-CG2 3.61Å; W3704-Y3721 HydrophobicContact CZ3-CD2 4.08Å; W3704-Y3721 HydrophobicContact CZ3-CE2 4.04Å; W3704-Y3721 HydrophobicContact CZ3-CG 4.42Å; W3704-I3757 HydrophobicContact CH2-CD1 3.48Å; W3704-I3757 VanDerWaalsContact CH2-CD1 3.48Å; W3704-I3757 HydrophobicContact CZ2-CD1 3.92Å
3705	N	79.1	Confident	76.2	Confident	43 Å²	43	59.9 Å²	59.9	23%	0.23	29%	0.293	C	S	.	.			trans	-80.5	172.1	166.7	73.4	44.9	0	0	0	111.3	H3707 E3708 L3709	N3705-H3707 VanDerWaalsContact C-N 3.34Å; N3705-H3707 PolarHBondContact O-N 3.35Å; N3705-H3707 PolarHBondContact OD1-N 3.09Å; N3705-E3708 VanDerWaalsContact CG-CD 3.47Å; N3705-E3708 VanDerWaalsContact CG-OE2 3.31Å; N3705-E3708 PolarHBondContact N-OE2 3.2Å; N3705-E3708 WeakPolarHBondContact ND2-CG 3.18Å; N3705-E3708 PolarHBondContact ND2-OE1 2.9Å; N3705-E3708 PolarHBondContact ND2-OE2 3.38Å; N3705-E3708 PolarHBondContact O-N 3.1Å; N3705-E3708 WeakPolarHBondContact OD1-CB 3.42Å; N3705-E3708 VanDerWaalsContact OD1-CG 3.3Å; N3705-E3708 WeakPolarHBondContact OD1-CG 3.49Å; N3705-E3708 PolarHBondContact OD1-N 3.46Å; N3705-L3709 WeakPolarHBondContact O-CB 3.28Å; N3705-L3709 PolarHBondContact O-N 3.1Å
3706	R	74.2	Confident	77.3	Confident	182 Å²	182	58.1 Å²	58.1	69%	0.687	29%	0.289	S	S	*	.	H	α-helix	trans	-63.2	-36.3	-174.7	-172.2	177	-177.5	166.5	1.3	113.7	V3688 S3710	V3688-R3706 HydrophobicContact CG2-CB 4.35Å; R3706-S3710 PolarHBondContact O-N 3.01Å; R3706-S3710 PolarHBondContact O-OG 2.87Å
3707	H	80.4	Confident	78.3	Confident	159 Å²	159	57.3 Å²	57.3	74%	0.736	29%	0.292	S	S	*	.	H	α-helix	trans	-70.6	-46.4	178.6	-70.6	-66.1	0	0	0	111	N3705 L3709 S3710 E3711	N3705-H3707 VanDerWaalsContact C-N 3.34Å; N3705-H3707 PolarHBondContact O-N 3.35Å; N3705-H3707 PolarHBondContact OD1-N 3.09Å; H3707-L3709 VanDerWaalsContact C-N 3.31Å; H3707-L3709 PolarHBondContact O-N 2.7Å; H3707-S3710 WeakPolarHBondContact O-CB 3.41Å; H3707-S3710 PolarHBondContact O-N 2.92Å; H3707-S3710 VanDerWaalsContact O-N 3.15Å; H3707-E3711 PolarHBondContact O-N 3.15Å
3708	E	85.1	Confident	79.6	Confident	27 Å²	27	56 Å²	56	13%	0.126	29%	0.285	C	S	.	.	H	α-helix	trans	-61.6	-38.5	176	-67.8	169.8	159.3	0	0	111.8	W3704 N3705 S3710 E3711 L3712 V3718 Y3721	W3704-E3708 HydrophobicContact CE3-CB 3.87Å; W3704-E3708 HydrophobicContact CE3-CG 4.47Å; N3705-E3708 VanDerWaalsContact CG-CD 3.47Å; N3705-E3708 VanDerWaalsContact CG-OE2 3.31Å; N3705-E3708 PolarHBondContact N-OE2 3.2Å; N3705-E3708 WeakPolarHBondContact ND2-CG 3.18Å; N3705-E3708 PolarHBondContact ND2-OE1 2.9Å; N3705-E3708 PolarHBondContact ND2-OE2 3.38Å; N3705-E3708 PolarHBondContact O-N 3.1Å; N3705-E3708 WeakPolarHBondContact OD1-CB 3.42Å; N3705-E3708 VanDerWaalsContact OD1-CG 3.3Å; N3705-E3708 WeakPolarHBondContact OD1-CG 3.49Å; N3705-E3708 PolarHBondContact OD1-N 3.46Å; E3708-S3710 VanDerWaalsContact C-N 3.32Å; E3708-S3710 PolarHBondContact O-N 3.31Å; E3708-E3711 PolarHBondContact O-N 3.27Å; E3708-L3712 WeakPolarHBondContact O-CB 3.46Å; E3708-L3712 PolarHBondContact O-N 2.88Å; E3708-V3718 HydrophobicContact CB-CG1 4.08Å; E3708-V3718 HydrophobicContact CB-CG2 4.44Å; E3708-V3718 HydrophobicContact CG-CG1 3.92Å; E3708-Y3721 WeakPolarHBondContact OE1-CE2 3.33Å; E3708-Y3721 PolarHBondContact OE1-OH 3.04Å
3709	L	80.6	Confident	80.9	Confident	38 Å²	38	61.9 Å²	61.9	20%	0.199	31%	0.314	C	S	.	.	H	α-helix	trans	-61.8	-41.5	175.3	-163	104.3	0	0	0	111.5	I3662 W3704 N3705 H3707 L3712 V3713	I3662-L3709 HydrophobicContact CD1-CD1 3.66Å; I3662-L3709 HydrophobicContact CD1-CG 3.96Å; I3662-L3709 HydrophobicContact CG1-CD1 3.78Å; I3662-L3709 HydrophobicContact CG1-CG 4.38Å; I3662-L3709 HydrophobicContact CG2-CD1 4.2Å; I3662-L3709 HydrophobicContact CG2-CD2 4.24Å; I3662-L3709 HydrophobicContact CG2-CG 4.11Å; W3704-L3709 HydrophobicContact CB-CD1 4.34Å; N3705-L3709 WeakPolarHBondContact O-CB 3.28Å; N3705-L3709 PolarHBondContact O-N 3.1Å; H3707-L3709 VanDerWaalsContact C-N 3.31Å; H3707-L3709 PolarHBondContact O-N 2.7Å; L3709-L3712 PolarHBondContact O-N 3.25Å; L3709-V3713 WeakPolarHBondContact O-CG2 3.26Å; L3709-V3713 PolarHBondContact O-N 3.13Å; L3709-V3713 VanDerWaalsContact O-N 3.11Å
3710	S	81	Confident	81.7	Confident	56 Å²	56	65.6 Å²	65.6	39%	0.392	33%	0.328	S	S	.	.	H	α-helix	trans	-66.8	-41	177.5	-56.4	0	0	0	0	111.2	R3706 H3707 E3708 V3713 Q3714	R3706-S3710 PolarHBondContact O-N 3.01Å; R3706-S3710 PolarHBondContact O-OG 2.87Å; H3707-S3710 WeakPolarHBondContact O-CB 3.41Å; H3707-S3710 PolarHBondContact O-N 2.92Å; H3707-S3710 VanDerWaalsContact O-N 3.15Å; E3708-S3710 VanDerWaalsContact C-N 3.32Å; E3708-S3710 PolarHBondContact O-N 3.31Å; S3710-V3713 PolarHBondContact O-N 3.21Å; S3710-Q3714 WeakPolarHBondContact O-CG 3.48Å; S3710-Q3714 PolarHBondContact O-N 2.79Å; S3710-Q3714 VanDerWaalsContact O-N 3.13Å
3711	E	86.5	Confident	82.4	Confident	42 Å²	42	66.3 Å²	66.3	20%	0.196	33%	0.33	C	S	.	.	H	α-helix	trans	-62.7	-44.3	174.9	-167.8	-174.8	166.6	0	0	111.6	H3707 E3708 V3713 Q3714 N3715 V3718 M3719	H3707-E3711 PolarHBondContact O-N 3.15Å; E3708-E3711 PolarHBondContact O-N 3.27Å; E3711-V3713 VanDerWaalsContact C-N 3.33Å; E3711-V3713 PolarHBondContact O-N 3.4Å; E3711-Q3714 PolarHBondContact O-N 3Å; E3711-N3715 WeakPolarHBondContact O-CB 3.46Å; E3711-N3715 PolarHBondContact O-N 3.36Å; E3711-V3718 WeakPolarHBondContact OE2-CG1 3.16Å; E3711-M3719 WeakPolarHBondContact OE1-CB 3.48Å; E3711-M3719 VanDerWaalsContact OE1-CG 3.26Å; E3711-M3719 WeakPolarHBondContact OE1-CG 3.25Å; E3711-M3719 PolarHBondContact OE1-N 3.09Å
3712	L	84.7	Confident	83	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-62.9	-38.6	179.6	-173.5	52.7	0	0	0	112	W3655 E3658 V3659 I3662 W3704 E3708 L3709 N3716 V3718	W3655-L3712 HydrophobicContact CE3-CD1 3.61Å; W3655-L3712 HydrophobicContact CZ3-CD1 3.77Å; E3658-L3712 HydrophobicContact CB-CD2 3.78Å; V3659-L3712 HydrophobicContact CG2-CD1 3.76Å; V3659-L3712 HydrophobicContact CG2-CG 3.98Å; I3662-L3712 HydrophobicContact CD1-CB 4.09Å; I3662-L3712 HydrophobicContact CD1-CD2 3.23Å; I3662-L3712 HydrophobicContact CD1-CG 3.75Å; W3704-L3712 HydrophobicContact CD2-CD2 4.41Å; W3704-L3712 HydrophobicContact CZ2-CD2 4.14Å; E3708-L3712 WeakPolarHBondContact O-CB 3.46Å; E3708-L3712 PolarHBondContact O-N 2.88Å; L3709-L3712 PolarHBondContact O-N 3.25Å; L3712-N3716 WeakPolarHBondContact O-CA 2.98Å; L3712-N3716 PolarHBondContact O-N 2.78Å; L3712-V3718 HydrophobicContact CB-CG2 3.76Å; L3712-V3718 HydrophobicContact CD1-CG2 4.23Å; L3712-V3718 HydrophobicContact CG-CG2 4.39Å
3713	V	82.8	Confident	83.5	Confident	64 Å²	64	68.3 Å²	68.3	39%	0.388	34%	0.337	S	S	.	.	H	α-helix	trans	-68.7	-35.5	175.3	171.8	0	0	0	0	112.1	I3662 I3666 L3709 S3710 E3711	I3662-V3713 HydrophobicContact CG2-CG2 3.7Å; I3666-V3713 HydrophobicContact CD1-CG2 4.44Å; L3709-V3713 WeakPolarHBondContact O-CG2 3.26Å; L3709-V3713 PolarHBondContact O-N 3.13Å; L3709-V3713 VanDerWaalsContact O-N 3.11Å; S3710-V3713 PolarHBondContact O-N 3.21Å; E3711-V3713 VanDerWaalsContact C-N 3.33Å; E3711-V3713 PolarHBondContact O-N 3.4Å
3714	Q	84.6	Confident	84.2	Confident	152 Å²	152	67.5 Å²	67.5	71%	0.71	33%	0.329	S	S	*	.	H	α-helix	trans	-81.1	-45.2	-177.9	-72.1	177.4	-1.2	0	0	113	S3710 E3711	S3710-Q3714 WeakPolarHBondContact O-CG 3.48Å; S3710-Q3714 PolarHBondContact O-N 2.79Å; S3710-Q3714 VanDerWaalsContact O-N 3.13Å; E3711-Q3714 PolarHBondContact O-N 3Å
3715	N	86.1	Confident	84.4	Confident	93 Å²	93	69.3 Å²	69.3	50%	0.497	34%	0.341	S	S	.	.	H	α-helix	trans	-107.3	-0.6	-169	-65.9	-21.7	0	0	0	113.4	E3711 T3717	E3711-N3715 WeakPolarHBondContact O-CB 3.46Å; E3711-N3715 PolarHBondContact O-N 3.36Å; N3715-T3717 PolarHBondContact O-N 3.31Å; N3715-T3717 PolarHBondContact O-OG1 2.84Å
3716	N	85.8	Confident	84.4	Confident	76 Å²	76	68.5 Å²	68.5	41%	0.406	34%	0.338	S	S	.	.	S	Bend	trans	54.6	10.2	-168.7	-63.5	-41.5	0	0	0	114.4	W3655 V3659 L3712	W3655-N3716 WeakPolarHBondContact CB-O 3.14Å; V3659-N3716 HydrophobicContact CG2-CB 4.21Å; L3712-N3716 WeakPolarHBondContact O-CA 2.98Å; L3712-N3716 PolarHBondContact O-N 2.78Å
3717	T	87.4	Confident	84.4	Confident	55 Å²	55	60.2 Å²	60.2	34%	0.337	31%	0.307	S	S	.	.	S	Bend	trans	-153.1	156.9	-176.5	60.1	0	0	0	0	109.5	W3655 N3715	W3655-T3717 HydrophobicContact CD2-CG2 3.87Å; W3655-T3717 HydrophobicContact CG-CG2 3.85Å; W3655-T3717 HydrophobicContact CZ2-CG2 4.46Å; N3715-T3717 PolarHBondContact O-N 3.31Å; N3715-T3717 PolarHBondContact O-OG1 2.84Å
3718	V	86.2	Confident	83.8	Confident	6 Å²	6	55.8 Å²	55.8	4%	0.036	29%	0.289	C	S	.	.			trans	-116.1	128.9	172.5	-174.8	0	0	0	0	108.8	W3655 W3704 E3708 E3711 L3712 Y3721	W3655-V3718 HydrophobicContact CH2-CB 3.98Å; W3655-V3718 HydrophobicContact CH2-CG2 4.4Å; W3655-V3718 HydrophobicContact CZ3-CB 4.24Å; W3655-V3718 HydrophobicContact CZ3-CG2 4.15Å; W3704-V3718 HydrophobicContact CE3-CG2 4.13Å; W3704-V3718 HydrophobicContact CH2-CB 4.16Å; W3704-V3718 HydrophobicContact CH2-CG2 3.88Å; W3704-V3718 HydrophobicContact CZ3-CB 3.86Å; W3704-V3718 HydrophobicContact CZ3-CG1 4.05Å; W3704-V3718 HydrophobicContact CZ3-CG2 3.61Å; E3708-V3718 HydrophobicContact CB-CG1 4.08Å; E3708-V3718 HydrophobicContact CB-CG2 4.44Å; E3708-V3718 HydrophobicContact CG-CG1 3.92Å; E3711-V3718 WeakPolarHBondContact OE2-CG1 3.16Å; L3712-V3718 HydrophobicContact CB-CG2 3.76Å; L3712-V3718 HydrophobicContact CD1-CG2 4.23Å; L3712-V3718 HydrophobicContact CG-CG2 4.39Å; V3718-Y3721 HydrophobicContact CB-CD2 4.04Å; V3718-Y3721 HydrophobicContact CG1-CD2 3.63Å; V3718-Y3721 HydrophobicContact CG1-CE2 3.78Å
3719	M	84.3	Confident	82.9	Confident	134 Å²	134	54.5 Å²	54.5	66%	0.66	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	158.6	176.5	-70.7	-153.8	-60.5	0	0	111.4	E3711 Y3721	E3711-M3719 WeakPolarHBondContact OE1-CB 3.48Å; E3711-M3719 VanDerWaalsContact OE1-CG 3.26Å; E3711-M3719 WeakPolarHBondContact OE1-CG 3.25Å; E3711-M3719 PolarHBondContact OE1-N 3.09Å; M3719-Y3721 VanDerWaalsContact O-CD2 3.24Å; M3719-Y3721 WeakPolarHBondContact O-CD2 3.21Å; M3719-Y3721 PolarHBondContact O-N 3.38Å; M3719-Y3721 VanDerWaalsContact O-N 3.1Å
3720	N	85.2	Confident	82	Confident	102 Å²	102	57.3 Å²	57.3	55%	0.545	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.7	2.4	-178.6	-56.8	-31.6	0	0	0	117.8	K3760	N3720-K3760 VanDerWaalsContact O-CB 3.3Å; N3720-K3760 WeakPolarHBondContact O-CB 3.5Å; N3720-K3760 VanDerWaalsContact O-CG 3.24Å; N3720-K3760 WeakPolarHBondContact O-CG 3.24Å; N3720-K3760 PolarHBondContact O-N 3.49Å
3721	Y	87.4	Confident	81	Confident	31 Å²	31	61.4 Å²	61.4	12%	0.122	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	157.2	171.2	-68.2	-88	0	0	0	112.5	Y3702 W3704 E3708 V3718 M3719 I3757 P3759 K3760	Y3702-Y3721 HydrophobicContact CD1-CE1 4.17Å; Y3702-Y3721 AromaticContact CE1-CE1 3.66Å; Y3702-Y3721 HydrophobicContact CE1-CE1 3.66Å; Y3702-Y3721 AromaticContact CE1-CZ 3.82Å; Y3702-Y3721 WeakPolarHBondContact CE1-OH 3.42Å; Y3702-Y3721 HydrophobicContact CE2-CE1 4.22Å; Y3702-Y3721 AromaticContact CZ-CE1 3.7Å; W3704-Y3721 HydrophobicContact CZ3-CD2 4.08Å; W3704-Y3721 HydrophobicContact CZ3-CE2 4.04Å; W3704-Y3721 HydrophobicContact CZ3-CG 4.42Å; E3708-Y3721 WeakPolarHBondContact OE1-CE2 3.33Å; E3708-Y3721 PolarHBondContact OE1-OH 3.04Å; V3718-Y3721 HydrophobicContact CB-CD2 4.04Å; V3718-Y3721 HydrophobicContact CG1-CD2 3.63Å; V3718-Y3721 HydrophobicContact CG1-CE2 3.78Å; M3719-Y3721 VanDerWaalsContact O-CD2 3.24Å; M3719-Y3721 WeakPolarHBondContact O-CD2 3.21Å; M3719-Y3721 PolarHBondContact O-N 3.38Å; M3719-Y3721 VanDerWaalsContact O-N 3.1Å; Y3721-I3757 HydrophobicContact CD1-CG1 4.07Å; Y3721-I3757 HydrophobicContact CG-CD1 4.31Å; Y3721-I3757 HydrophobicContact CG-CG1 4.25Å; Y3721-P3759 HydrophobicContact CD1-CB 4.45Å; Y3721-P3759 HydrophobicContact CD1-CG 4.31Å; Y3721-P3759 HydrophobicContact CE1-CB 4.18Å; Y3721-P3759 HydrophobicContact CE1-CG 3.8Å; Y3721-K3760 VanDerWaalsContact O-CE 3.23Å; Y3721-K3760 WeakPolarHBondContact O-CE 3.47Å
3722	R	88.2	Confident	79.7	Confident	105 Å²	105	62.7 Å²	62.7	40%	0.396	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	142.6	172.6	68.8	180	-171.6	173.6	5.6	111.9	I3724 I3757 R3758 K3760 H3763	R3722-I3724 HydrophobicContact CG-CD1 4.34Å; R3722-I3724 HydrophobicContact CG-CG1 4.08Å; R3722-I3757 WeakPolarHBondContact O-CA 3.15Å; R3722-R3758 PolarHBondContact N-O 3.23Å; R3722-R3758 PolarHBondContact O-N 2.86Å; R3722-K3760 HydrophobicContact CB-CG 4.33Å; R3722-K3760 HydrophobicContact CG-CG 4.36Å; R3722-H3763 PolarHBondContact NH2-CD2 3.49Å; R3722-H3763 PolarHBondContact NH2-CE1 3.12Å; R3722-H3763 VanDerWaalsContact NH2-CE1 3.27Å; R3722-H3763 VanDerWaalsContact NH2-CG 3.3Å; R3722-H3763 PolarHBondContact NH2-NE2 2.85Å
3723	W	89.8	Confident	78.3	Confident	14 Å²	14	64.1 Å²	64.1	5%	0.053	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	127.2	169.5	-68.2	113.1	0	0	0	110.8	K3651 A3654 W3655 E3658 N3701 Y3755 I3757	K3651-W3723 HydrophobicContact CD-CB 4.36Å; K3651-W3723 HydrophobicContact CG-CB 3.85Å; K3651-W3723 HydrophobicContact CG-CG 4.32Å; A3654-W3723 HydrophobicContact CB-CD2 3.83Å; A3654-W3723 HydrophobicContact CB-CE3 4.06Å; A3654-W3723 HydrophobicContact CB-CG 4.49Å; A3654-W3723 HydrophobicContact CB-CH2 3.87Å; A3654-W3723 HydrophobicContact CB-CZ2 3.64Å; A3654-W3723 HydrophobicContact CB-CZ3 4.05Å; W3655-W3723 AromaticContact CD1-CD1 3.74Å; W3655-W3723 AromaticContact CD1-NE1 3.21Å; W3655-W3723 HydrophobicContact CD2-CZ2 4.16Å; W3655-W3723 AromaticContact CD2-NE1 3.3Å; W3655-W3723 VanDerWaalsContact CD2-NE1 3.3Å; W3655-W3723 AromaticContact CE2-CD1 3.81Å; W3655-W3723 AromaticContact CE2-NE1 3.14Å; W3655-W3723 HydrophobicContact CE3-CZ2 4.16Å; W3655-W3723 HydrophobicContact CG-CZ2 4.5Å; W3655-W3723 AromaticContact CG-NE1 3.36Å; W3655-W3723 AromaticContact CZ2-NE1 3.84Å; W3655-W3723 AromaticContact NE1-CD1 3.42Å; W3655-W3723 AromaticContact NE1-NE1 3.08Å; E3658-W3723 HydrophobicContact CG-CH2 3.9Å; E3658-W3723 HydrophobicContact CG-CZ2 4.02Å; N3701-W3723 HydrophobicContact CB-CH2 4.02Å; N3701-W3723 HydrophobicContact CB-CZ3 3.95Å; W3723-Y3755 HydrophobicContact CB-CD1 3.91Å; W3723-Y3755 HydrophobicContact CB-CG 4.24Å; W3723-I3757 HydrophobicContact CD2-CB 4.24Å; W3723-I3757 HydrophobicContact CD2-CD1 4.45Å; W3723-I3757 HydrophobicContact CE3-CB 3.73Å; W3723-I3757 HydrophobicContact CH2-CB 4.01Å; W3723-I3757 HydrophobicContact CH2-CD1 4.24Å; W3723-I3757 HydrophobicContact CH2-CG2 4.47Å; W3723-I3757 HydrophobicContact CZ2-CB 4.46Å; W3723-I3757 HydrophobicContact CZ2-CD1 3.95Å; W3723-I3757 HydrophobicContact CZ3-CB 3.64Å; W3723-I3757 HydrophobicContact CZ3-CG2 4.29Å
3724	I	87.4	Confident	76.8	Confident	34 Å²	34	67.3 Å²	67.3	17%	0.174	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	132.5	177.8	-54.6	-179.9	0	0	0	107.9	R3722 T3726 Y3755 Q3756 R3758	R3722-I3724 HydrophobicContact CG-CD1 4.34Å; R3722-I3724 HydrophobicContact CG-CG1 4.08Å; I3724-T3726 PolarHBondContact O-N 2.82Å; I3724-Y3755 WeakPolarHBondContact O-CA 3.29Å; I3724-Q3756 HydrophobicContact CB-CG 4.32Å; I3724-Q3756 PolarHBondContact N-O 2.94Å; I3724-Q3756 WeakPolarHBondContact O-CG 3.23Å; I3724-Q3756 PolarHBondContact O-N 3.09Å; I3724-R3758 HydrophobicContact CD1-CB 3.96Å; I3724-R3758 HydrophobicContact CD1-CG 3.87Å
3725	P	85.2	Confident	75	Confident	42 Å²	42	62.2 Å²	62.2	27%	0.273	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.3	135	171.4	-24.2	34	0	0	0	111.6	Y3749 M3754 Y3755	P3725-Y3749 HydrophobicContact CB-CD1 4.49Å; P3725-Y3749 HydrophobicContact CB-CE1 3.96Å; P3725-Y3749 HydrophobicContact CG-CD1 4.31Å; P3725-Y3749 HydrophobicContact CG-CE1 3.93Å; P3725-M3754 CarbonylContact C-O 3.37Å; P3725-M3754 VanDerWaalsContact CA-O 3.3Å; P3725-M3754 WeakPolarHBondContact CA-O 3.18Å; P3725-Y3755 HydrophobicContact CG-CD1 4.31Å; P3725-Y3755 HydrophobicContact CG-CE1 3.92Å
3726	T	78.6	Confident	72.8	Confident	27 Å²	27	64 Å²	64	17%	0.166	35%	0.348	C	S	.	.	S	Bend	trans	-75.2	-30.5	175.7	48.9	0	0	0	0	112.1	I3724 M3754 Q3756	I3724-T3726 PolarHBondContact O-N 2.82Å; T3726-M3754 PolarHBondContact N-O 3.06Å; T3726-M3754 PolarHBondContact OG1-O 3.07Å; T3726-M3754 VanDerWaalsContact OG1-O 3.09Å; T3726-Q3756 HydrophobicContact CG2-CB 3.79Å; T3726-Q3756 HydrophobicContact CG2-CG 3.92Å
3727	I	74.9	Confident	71	Confident	7 Å²	7	62.7 Å²	62.7	4%	0.036	34%	0.344	C	S	.	.	S	Bend	trans	-124.2	125.3	-177.6	-58.8	175.7	0	0	0	106.9	F2750 I2752 Y3732 M3754	F2750-I3727 HydrophobicContact CE1-CG2 4.48Å; F2750-I3727 HydrophobicContact CZ-CD1 4.43Å; F2750-I3727 HydrophobicContact CZ-CG2 4.1Å; I2752-I3727 HydrophobicContact CD1-CD1 3.69Å; I2752-I3727 HydrophobicContact CG1-CD1 3.95Å; I2752-I3727 HydrophobicContact CG2-CD1 4.32Å; I3727-Y3732 HydrophobicContact CG2-CD2 4.32Å; I3727-Y3732 HydrophobicContact CG2-CE2 3.49Å; I3727-Y3732 VanDerWaalsContact CG2-CE2 3.49Å; I3727-M3754 HydrophobicContact CB-CE 3.77Å; I3727-M3754 HydrophobicContact CD1-CE 3.96Å; I3727-M3754 HydrophobicContact CG1-CE 4.06Å
3728	D	68.2	Low	69.1	Low	66 Å²	66	63.7 Å²	63.7	35%	0.353	35%	0.347	S	S	.	.			trans	-93.3	105.1	171	-173.6	0.6	0	0	0	109	L3730 Q3731 Y3732	D3728-L3730 PolarHBondContact O-N 2.89Å; D3728-L3730 VanDerWaalsContact O-N 3.14Å; D3728-L3730 WeakPolarHBondContact OD1-CB 3.43Å; D3728-L3730 PolarHBondContact OD1-N 2.91Å; D3728-Q3731 HydrophobicContact CB-CG 4.1Å; D3728-Q3731 WeakPolarHBondContact O-CB 3.33Å; D3728-Q3731 PolarHBondContact O-N 2.95Å; D3728-Q3731 VanDerWaalsContact O-N 3.12Å; D3728-Y3732 VanDerWaalsContact O-CD2 3.28Å; D3728-Y3732 WeakPolarHBondContact O-CD2 3.4Å; D3728-Y3732 VanDerWaalsContact O-CE2 3.22Å; D3728-Y3732 WeakPolarHBondContact O-CE2 3.4Å
3729	F	66.2	Low	67.5	Low	1 Å²	1	66 Å²	66	0%	0.004	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-57.8	-29.7	-177.6	-162.1	-100.1	0	0	0	112.7	F2745 Q2748 F2750 Q3731 Y3732 D3741 A3744 M3745 L3748	F2745-F3729 HydrophobicContact CD1-CE2 4.19Å; F2745-F3729 HydrophobicContact CD1-CZ 4.41Å; F2745-F3729 HydrophobicContact CE1-CE2 4.42Å; F2745-F3729 HydrophobicContact CG-CE2 4.29Å; Q2748-F3729 HydrophobicContact CB-CZ 4.48Å; Q2748-F3729 HydrophobicContact CG-CE1 4.33Å; Q2748-F3729 HydrophobicContact CG-CE2 4.49Å; Q2748-F3729 HydrophobicContact CG-CZ 3.71Å; F2750-F3729 HydrophobicContact CD1-CE2 4.43Å; F3729-Q3731 PolarHBondContact O-N 2.84Å; F3729-Y3732 PolarHBondContact O-N 3.01Å; F3729-D3741 HydrophobicContact CE1-CB 4.09Å; F3729-A3744 HydrophobicContact CE1-CB 3.89Å; F3729-A3744 HydrophobicContact CE2-CB 4.32Å; F3729-A3744 HydrophobicContact CZ-CB 3.56Å; F3729-M3745 HydrophobicContact CB-CG 4.36Å; F3729-M3745 HydrophobicContact CD1-CG 3.69Å; F3729-M3745 HydrophobicContact CE1-CG 4.36Å; F3729-M3745 HydrophobicContact CG-CG 4.28Å; F3729-L3748 HydrophobicContact CB-CD2 3.67Å; F3729-L3748 HydrophobicContact CD2-CD2 3.84Å; F3729-L3748 HydrophobicContact CG-CD2 4.13Å
3730	L	60.9	Low	66.2	Low	96 Å²	96	60.5 Å²	60.5	50%	0.503	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-64.8	-21.8	-178.2	-66	174.3	0	0	0	112.7	D3728 Y3732 M3745	D3728-L3730 PolarHBondContact O-N 2.89Å; D3728-L3730 VanDerWaalsContact O-N 3.14Å; D3728-L3730 WeakPolarHBondContact OD1-CB 3.43Å; D3728-L3730 PolarHBondContact OD1-N 2.91Å; L3730-Y3732 PolarHBondContact O-N 3.34Å; L3730-M3745 HydrophobicContact CD2-CE 3.83Å; L3730-M3745 HydrophobicContact CD2-SD 4.01Å; L3730-M3745 HydrophobicContact CG-CE 4.12Å
3731	Q	60.6	Low	65.4	Low	142 Å²	142	56.3 Å²	56.3	66%	0.664	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-69.3	-16	173.3	-63.7	-177.5	-2.4	0	0	112.9	D3728 F3729	D3728-Q3731 HydrophobicContact CB-CG 4.1Å; D3728-Q3731 WeakPolarHBondContact O-CB 3.33Å; D3728-Q3731 PolarHBondContact O-N 2.95Å; D3728-Q3731 VanDerWaalsContact O-N 3.12Å; F3729-Q3731 PolarHBondContact O-N 2.84Å
3732	Y	59.8	Low	64.8	Low	69 Å²	69	55 Å²	55	27%	0.271	31%	0.311	S	S	.	.	S	Bend	trans	-112.5	-5.2	-170.6	-53.3	-75.5	0	0	0	114.5	I3727 D3728 F3729 L3730	I3727-Y3732 HydrophobicContact CG2-CD2 4.32Å; I3727-Y3732 HydrophobicContact CG2-CE2 3.49Å; I3727-Y3732 VanDerWaalsContact CG2-CE2 3.49Å; D3728-Y3732 VanDerWaalsContact O-CD2 3.28Å; D3728-Y3732 WeakPolarHBondContact O-CD2 3.4Å; D3728-Y3732 VanDerWaalsContact O-CE2 3.22Å; D3728-Y3732 WeakPolarHBondContact O-CE2 3.4Å; F3729-Y3732 PolarHBondContact O-N 3.01Å; L3730-Y3732 PolarHBondContact O-N 3.34Å
3733	S	54.5	Low	64.3	Low	31 Å²	31	50.1 Å²	50.1	22%	0.217	29%	0.292	C	S	.	.			trans	-80.5	130.5	176.5	-169.7	0	0	0	0	110.8	S3735 D3741	S3733-S3735 VanDerWaalsContact C-N 3.25Å; S3733-S3735 PolarHBondContact OG-N 2.65Å; S3733-S3735 PolarHBondContact OG-O 3.13Å; S3733-D3741 VanDerWaalsContact CB-OD2 3.23Å; S3733-D3741 WeakPolarHBondContact CB-OD2 2.99Å; S3733-D3741 PolarHBondContact OG-OD2 3.47Å
3734	S	50.6	Low	63.9	Low	131 Å²	131	49.5 Å²	49.5	92%	0.916	29%	0.29	S	S	*	.	S	Bend	trans	-75.5	-14.6	173.3	52	0	0	0	0	112.8
3735	S	47.5	Very low	63.6	Low	45 Å²	45	48.3 Å²	48.3	32%	0.315	28%	0.284	S	S	.	.			trans	-122.9	119.5	178.2	-173.6	0	0	0	0	110.8	S3733 S3737	S3733-S3735 VanDerWaalsContact C-N 3.25Å; S3733-S3735 PolarHBondContact OG-N 2.65Å; S3733-S3735 PolarHBondContact OG-O 3.13Å; S3735-S3737 PolarHBondContact O-N 2.58Å; S3735-S3737 PolarHBondContact OG-N 2.85Å; S3735-S3737 PolarHBondContact OG-OG 2.97Å
3736	P	39.5	Very low	63.7	Low	131 Å²	131	46.3 Å²	46.3	85%	0.851	27%	0.271	S	S	*	.			trans	-66.7	-1.7	175.2	25.4	-31.3	0	0	0	113.7	L3738	P3736-L3738 PolarHBondContact O-N 3.31Å; P3736-L3738 VanDerWaalsContact O-N 3.1Å
3737	S	48.7	Very low	64.1	Low	47 Å²	47	45 Å²	45	33%	0.329	26%	0.263	S	S	.	.			trans	-70.1	106	173.5	64.8	0	0	0	0	110.5	S3735 S3739 S3740	S3735-S3737 PolarHBondContact O-N 2.58Å; S3735-S3737 PolarHBondContact OG-N 2.85Å; S3735-S3737 PolarHBondContact OG-OG 2.97Å; S3737-S3739 PolarHBondContact O-N 2.76Å; S3737-S3740 PolarHBondContact O-N 3.12Å
3738	L	47.8	Very low	64.6	Low	77 Å²	77	44.8 Å²	44.8	40%	0.403	26%	0.262	S	S	.	.	H	α-helix	trans	-47.4	-27.1	172.5	-101.7	86.8	0	0	0	112.9	V3639 I3643 P3736 S3740 T3742	V3639-L3738 HydrophobicContact CG1-CD2 4.34Å; I3643-L3738 HydrophobicContact CD1-CD2 4.28Å; P3736-L3738 PolarHBondContact O-N 3.31Å; P3736-L3738 VanDerWaalsContact O-N 3.1Å; L3738-S3740 PolarHBondContact O-N 2.82Å; L3738-T3742 WeakPolarHBondContact O-CG2 3.32Å; L3738-T3742 PolarHBondContact O-N 3.32Å
3739	S	52.9	Low	65.7	Low	53 Å²	53	42 Å²	42	37%	0.371	25%	0.247	S	C	.	.	H	α-helix	trans	-60.7	-33.8	-174.9	55.2	0	0	0	0	115.2	S3737	S3737-S3739 PolarHBondContact O-N 2.76Å
3740	S	56.7	Low	66.9	Low	19 Å²	19	42.1 Å²	42.1	13%	0.133	25%	0.248	C	C	.	.	H	α-helix	trans	-82.7	-25.5	-173.7	64.9	0	0	0	0	113.9	G2718 S3737 L3738	G2718-S3740 VanDerWaalsContact CA-O 3.27Å; G2718-S3740 WeakPolarHBondContact CA-O 3.43Å; S3737-S3740 PolarHBondContact O-N 3.12Å; L3738-S3740 PolarHBondContact O-N 2.82Å
3741	D	68.3	Low	68.2	Low	15 Å²	15	37.8 Å²	37.8	8%	0.08	23%	0.225	C	C	.	.	H	α-helix	trans	-118.1	4.4	-165	-71.3	6.9	0	0	0	113.5	Q2748 F3729 S3733 S3743 A3744 M3745	Q2748-D3741 PolarHBondContact NE2-OD1 2.77Å; F3729-D3741 HydrophobicContact CE1-CB 4.09Å; S3733-D3741 VanDerWaalsContact CB-OD2 3.23Å; S3733-D3741 WeakPolarHBondContact CB-OD2 2.99Å; S3733-D3741 PolarHBondContact OG-OD2 3.47Å; D3741-S3743 VanDerWaalsContact C-N 3.29Å; D3741-S3743 PolarHBondContact O-N 2.69Å; D3741-A3744 PolarHBondContact O-N 2.89Å; D3741-A3744 VanDerWaalsContact O-N 3.15Å; D3741-M3745 WeakPolarHBondContact O-CG 3.36Å; D3741-M3745 PolarHBondContact O-N 3.23Å
3742	T	74.5	Confident	69.4	Low	4 Å²	4	31.2 Å²	31.2	3%	0.025	20%	0.195	C	C	.	.	H	α-helix	trans	-49.2	-46.6	-178.4	54.8	0	0	0	0	113.5	V3639 L3738 M3745 C3746	V3639-T3742 HydrophobicContact CB-CG2 4.35Å; V3639-T3742 HydrophobicContact CG1-CG2 3.36Å; V3639-T3742 HydrophobicContact CG2-CG2 4Å; L3738-T3742 WeakPolarHBondContact O-CG2 3.32Å; L3738-T3742 PolarHBondContact O-N 3.32Å; T3742-M3745 PolarHBondContact O-N 3.28Å; T3742-C3746 PolarHBondContact O-N 3.14Å; T3742-C3746 PolarHBondContact O-SG 3.47Å
3743	S	78.7	Confident	70.5	Confident	1 Å²	1	28.4 Å²	28.4	1%	0.007	19%	0.185	C	C	.	.	H	α-helix	trans	-67.3	-41	-177.6	63.2	0	0	0	0	112.7	V2717 V3530 D3741 C3746 R3747	V2717-S3743 PolarHBondContact N-OG 3.49Å; V2717-S3743 PolarHBondContact O-OG 3.06Å; V2717-S3743 VanDerWaalsContact O-OG 3.05Å; V3530-S3743 WeakPolarHBondContact O-CA 3.47Å; V3530-S3743 WeakPolarHBondContact O-CB 3.42Å; D3741-S3743 VanDerWaalsContact C-N 3.29Å; D3741-S3743 PolarHBondContact O-N 2.69Å; S3743-C3746 PolarHBondContact O-N 3.33Å; S3743-R3747 WeakPolarHBondContact O-CB 3.26Å; S3743-R3747 WeakPolarHBondContact O-CG 3.29Å; S3743-R3747 PolarHBondContact O-N 2.91Å
3744	A	80	Confident	72	Confident	1 Å²	1	27.1 Å²	27.1	1%	0.008	18%	0.176	C	C	.	.	H	α-helix	trans	-62.6	-43.5	174.2	0	0	0	0	0	111.2	F2745 F3729 D3741 R3747 L3748	F2745-A3744 HydrophobicContact CD1-CB 3.72Å; F2745-A3744 HydrophobicContact CE1-CB 3.88Å; F2745-A3744 WeakPolarHBondContact CE1-O 3.43Å; F3729-A3744 HydrophobicContact CE1-CB 3.89Å; F3729-A3744 HydrophobicContact CE2-CB 4.32Å; F3729-A3744 HydrophobicContact CZ-CB 3.56Å; D3741-A3744 PolarHBondContact O-N 2.89Å; D3741-A3744 VanDerWaalsContact O-N 3.15Å; A3744-R3747 PolarHBondContact O-N 3.22Å; A3744-L3748 WeakPolarHBondContact O-CB 3.43Å; A3744-L3748 PolarHBondContact O-N 2.93Å
3745	M	81.9	Confident	73.8	Confident	9 Å²	9	21 Å²	21	4%	0.044	13%	0.132	C	C	.	.	H	α-helix	trans	-61.2	-45.4	175.5	-68.8	178.8	72	0	0	112.3	I3643 F3729 L3730 D3741 T3742 L3748 Y3749	I3643-M3745 HydrophobicContact CD1-CE 4.08Å; I3643-M3745 HydrophobicContact CD1-SD 4.26Å; F3729-M3745 HydrophobicContact CB-CG 4.36Å; F3729-M3745 HydrophobicContact CD1-CG 3.69Å; F3729-M3745 HydrophobicContact CE1-CG 4.36Å; F3729-M3745 HydrophobicContact CG-CG 4.28Å; L3730-M3745 HydrophobicContact CD2-CE 3.83Å; L3730-M3745 HydrophobicContact CD2-SD 4.01Å; L3730-M3745 HydrophobicContact CG-CE 4.12Å; D3741-M3745 WeakPolarHBondContact O-CG 3.36Å; D3741-M3745 PolarHBondContact O-N 3.23Å; T3742-M3745 PolarHBondContact O-N 3.28Å; M3745-L3748 WeakPolarHBondContact O-CB 3.17Å; M3745-L3748 PolarHBondContact O-N 3.16Å; M3745-Y3749 HydrophobicContact CB-CD2 4.23Å; M3745-Y3749 HydrophobicContact CB-CE2 4.09Å; M3745-Y3749 HydrophobicContact CE-CE2 3.84Å; M3745-Y3749 WeakPolarHBondContact O-CD2 3.44Å; M3745-Y3749 PolarHBondContact O-N 2.7Å
3746	C	87.7	Confident	75.6	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-64.7	-44	179.4	-62.8	0	0	0	0	111.5	D3531 A3646 T3742 S3743 L3748 Y3749 D3750	D3531-C3746 HydrophobicContact CB-CB 4.03Å; D3531-C3746 VanDerWaalsContact CG-CB 3.47Å; D3531-C3746 VanDerWaalsContact OD1-CB 3.25Å; D3531-C3746 WeakPolarHBondContact OD1-CB 3.23Å; A3646-C3746 HydrophobicContact CB-CB 3.96Å; T3742-C3746 PolarHBondContact O-N 3.14Å; T3742-C3746 PolarHBondContact O-SG 3.47Å; S3743-C3746 PolarHBondContact O-N 3.33Å; C3746-L3748 PolarHBondContact O-N 2.8Å; C3746-Y3749 PolarHBondContact O-N 2.95Å; C3746-D3750 WeakPolarHBondContact O-CB 3.35Å; C3746-D3750 PolarHBondContact O-N 3.36Å
3747	R	86.1	Confident	77.9	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-60.4	-31.1	175.4	-83.6	-155.5	-74.2	139.5	8.7	114.4	D2716 L2731 R2732 I2744 F2745 W3532 S3743 A3744	D2716-R3747 IonicContact OD1-CZ 3.55Å; D2716-R3747 IonicContact OD1-NE 3.69Å; D2716-R3747 IonicContact OD1-NH2 3.63Å; D2716-R3747 PolarHBondContact OD1-NH2 2.81Å; D2716-R3747 IonicContact OD2-NH2 3.35Å; D2716-R3747 PolarHBondContact OD2-NH2 2.99Å; L2731-R3747 PolarHBondContact O-NH1 3.31Å; R2732-R3747 PolarHBondContact NH2-O 2.88Å; I2744-R3747 PolarHBondContact O-NH1 3Å; I2744-R3747 PolarHBondContact O-NH2 3.2Å; F2745-R3747 HydrophobicContact CE1-CB 4.29Å; W3532-R3747 HydrophobicContact CD2-CG 4.46Å; W3532-R3747 HydrophobicContact CH2-CG 4.2Å; W3532-R3747 HydrophobicContact CZ2-CG 3.87Å; W3532-R3747 VanDerWaalsContact CZ2-NE 3.31Å; S3743-R3747 WeakPolarHBondContact O-CB 3.26Å; S3743-R3747 WeakPolarHBondContact O-CG 3.29Å; S3743-R3747 PolarHBondContact O-N 2.91Å; A3744-R3747 PolarHBondContact O-N 3.22Å
3748	L	86.5	Confident	79.6	Confident	2 Å²	2	17.8 Å²	17.8	1%	0.01	9%	0.092	C	C	.	.	H	α-helix	trans	-73.3	-59	174.7	-173.8	73	0	0	0	109.5	F2745 I2752 F3729 A3744 M3745 C3746 D3750 H3751 M3754	F2745-L3748 HydrophobicContact CE2-CD1 4.17Å; F2745-L3748 HydrophobicContact CZ-CB 4.16Å; F2745-L3748 HydrophobicContact CZ-CD1 4.04Å; I2752-L3748 HydrophobicContact CD1-CD1 3.25Å; F3729-L3748 HydrophobicContact CB-CD2 3.67Å; F3729-L3748 HydrophobicContact CD2-CD2 3.84Å; F3729-L3748 HydrophobicContact CG-CD2 4.13Å; A3744-L3748 WeakPolarHBondContact O-CB 3.43Å; A3744-L3748 PolarHBondContact O-N 2.93Å; M3745-L3748 WeakPolarHBondContact O-CB 3.17Å; M3745-L3748 PolarHBondContact O-N 3.16Å; C3746-L3748 PolarHBondContact O-N 2.8Å; L3748-D3750 PolarHBondContact O-N 2.9Å; L3748-D3750 VanDerWaalsContact O-N 3.16Å; L3748-H3751 PolarHBondContact O-N 2.84Å; L3748-M3754 HydrophobicContact CD1-CE 3.35Å; L3748-M3754 HydrophobicContact CD1-CG 4.03Å; L3748-M3754 HydrophobicContact CD1-SD 3.48Å; L3748-M3754 WeakPolarHBondContact CD1-SD 3.36Å; L3748-M3754 HydrophobicContact CD2-CE 4.11Å; L3748-M3754 HydrophobicContact CG-CE 3.72Å; L3748-M3754 HydrophobicContact CG-CG 4.17Å; L3748-M3754 HydrophobicContact CG-SD 4.18Å; L3748-M3754 WeakPolarHBondContact O-CG 3.24Å
3749	Y	90.4	Very high	81.3	Confident	7 Å²	7	15.9 Å²	15.9	3%	0.027	8%	0.084	C	C	.	.	H	α-helix	trans	-70.5	-13.2	-170	-67.3	-49.3	0	0	0	115	I3643 A3646 K3647 G3650 P3725 M3745 C3746 H3751 Y3755	I3643-Y3749 HydrophobicContact CG2-CD2 4.21Å; I3643-Y3749 HydrophobicContact CG2-CE2 4.5Å; A3646-Y3749 VanDerWaalsContact O-O 3.12Å; K3647-Y3749 HydrophobicContact CG-CD1 4.43Å; K3647-Y3749 HydrophobicContact CG-CD2 4.26Å; K3647-Y3749 HydrophobicContact CG-CG 3.94Å; G3650-Y3749 WeakPolarHBondContact CA-O 3.37Å; P3725-Y3749 HydrophobicContact CB-CD1 4.49Å; P3725-Y3749 HydrophobicContact CB-CE1 3.96Å; P3725-Y3749 HydrophobicContact CG-CD1 4.31Å; P3725-Y3749 HydrophobicContact CG-CE1 3.93Å; M3745-Y3749 HydrophobicContact CB-CD2 4.23Å; M3745-Y3749 HydrophobicContact CB-CE2 4.09Å; M3745-Y3749 HydrophobicContact CE-CE2 3.84Å; M3745-Y3749 WeakPolarHBondContact O-CD2 3.44Å; M3745-Y3749 PolarHBondContact O-N 2.7Å; C3746-Y3749 PolarHBondContact O-N 2.95Å; Y3749-H3751 VanDerWaalsContact C-N 3.31Å; Y3749-H3751 PolarHBondContact O-N 2.91Å; Y3749-Y3755 VanDerWaalsContact O-CE2 3.29Å; Y3749-Y3755 WeakPolarHBondContact O-CE2 3.43Å; Y3749-Y3755 PolarHBondContact O-OH 2.91Å
3750	D	90.7	Very high	82.6	Confident	5 Å²	5	18.6 Å²	18.6	3%	0.027	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-6.8	179.3	80.4	-10.7	0	0	0	114.9	R2732 R2741 A3646 G3650 L3653 C3746 L3748	R2732-D3750 IonicContact CZ-OD2 3.17Å; R2732-D3750 IonicContact NH2-OD1 2.74Å; R2732-D3750 PolarHBondContact NH2-OD1 2.85Å; R2732-D3750 IonicContact NH2-OD2 3.27Å; R2732-D3750 PolarHBondContact NH2-OD2 2.9Å; R2732-D3750 VanDerWaalsContact NH2-OD2 3.14Å; R2741-D3750 IonicContact CZ-OD1 3.75Å; R2741-D3750 IonicContact NH1-OD1 3.14Å; R2741-D3750 PolarHBondContact NH1-OD1 3.28Å; R2741-D3750 IonicContact NH1-OD2 3.64Å; A3646-D3750 HydrophobicContact CB-CB 4.37Å; A3646-D3750 WeakPolarHBondContact O-CA 3.46Å; G3650-D3750 WeakPolarHBondContact CA-O 3.39Å; L3653-D3750 WeakPolarHBondContact CD1-O 3.33Å; C3746-D3750 WeakPolarHBondContact O-CB 3.35Å; C3746-D3750 PolarHBondContact O-N 3.36Å; L3748-D3750 PolarHBondContact O-N 2.9Å; L3748-D3750 VanDerWaalsContact O-N 3.16Å
3751	H	89.3	Confident	83.1	Confident	4 Å²	4	23.9 Å²	23.9	2%	0.019	11%	0.112	C	C	.	.	S	Bend	trans	-103.4	146.2	-176.2	-162.2	-116.1	0	0	0	113.6	Y2739 R2741 L3748 Y3749 S3753 M3754 Y3755	Y2739-H3751 PolarHBondContact O-CE1 2.83Å; Y2739-H3751 PolarHBondContact O-NE2 2.87Å; R2741-H3751 VanDerWaalsContact CB-CE1 3.48Å; R2741-H3751 WeakPolarHBondContact CB-CE1 3.37Å; R2741-H3751 WeakPolarHBondContact CB-NE2 3.26Å; R2741-H3751 PolarHBondContact NE-CD2 3.05Å; R2741-H3751 PolarHBondContact NH2-CD2 2.95Å; L3748-H3751 PolarHBondContact O-N 2.84Å; Y3749-H3751 VanDerWaalsContact C-N 3.31Å; Y3749-H3751 PolarHBondContact O-N 2.91Å; H3751-S3753 PolarHBondContact CE1-OG 3.15Å; H3751-S3753 WeakPolarHBondContact ND1-CB 3.47Å; H3751-S3753 PolarHBondContact ND1-N 3.17Å; H3751-S3753 PolarHBondContact ND1-OG 3.32Å; H3751-M3754 HydrophobicContact CB-CG 4.33Å; H3751-Y3755 VanDerWaalsContact O-CD2 3.27Å; H3751-Y3755 WeakPolarHBondContact O-CD2 3.47Å; H3751-Y3755 VanDerWaalsContact O-CE2 3.28Å; H3751-Y3755 WeakPolarHBondContact O-CE2 3.46Å
3752	S	85.7	Confident	82.5	Confident	5 Å²	5	29.1 Å²	29.1	4%	0.035	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-64.8	-40.1	179.7	53.8	0	0	0	0	113.2	M3754 Y3755	S3752-M3754 PolarHBondContact O-N 3.48Å; S3752-M3754 VanDerWaalsContact O-N 3.1Å; S3752-Y3755 PolarHBondContact O-N 3.08Å; S3752-Y3755 VanDerWaalsContact O-N 3.14Å
3753	S	83.4	Confident	81.2	Confident	9 Å²	9	31.1 Å²	31.1	6%	0.063	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-63.9	-19.2	-175.6	78.8	0	0	0	0	113.9	D2754 H3751 Y3755	D2754-S3753 VanDerWaalsContact O-CB 3.31Å; D2754-S3753 WeakPolarHBondContact O-CB 3.26Å; D2754-S3753 PolarHBondContact O-OG 2.76Å; H3751-S3753 PolarHBondContact CE1-OG 3.15Å; H3751-S3753 WeakPolarHBondContact ND1-CB 3.47Å; H3751-S3753 PolarHBondContact ND1-N 3.17Å; H3751-S3753 PolarHBondContact ND1-OG 3.32Å; S3753-Y3755 PolarHBondContact O-N 3.16Å
3754	M	85.8	Confident	79.8	Confident	5 Å²	5	37.8 Å²	37.8	3%	0.025	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-73.2	-8.7	178.3	-68.5	-48.9	-50.7	0	0	114	I2752 P3725 T3726 I3727 L3748 H3751 S3752	I2752-M3754 HydrophobicContact CD1-CE 4.16Å; I2752-M3754 HydrophobicContact CD1-SD 4.24Å; I2752-M3754 HydrophobicContact CG2-SD 3.71Å; P3725-M3754 CarbonylContact C-O 3.37Å; P3725-M3754 VanDerWaalsContact CA-O 3.3Å; P3725-M3754 WeakPolarHBondContact CA-O 3.18Å; T3726-M3754 PolarHBondContact N-O 3.06Å; T3726-M3754 PolarHBondContact OG1-O 3.07Å; T3726-M3754 VanDerWaalsContact OG1-O 3.09Å; I3727-M3754 HydrophobicContact CB-CE 3.77Å; I3727-M3754 HydrophobicContact CD1-CE 3.96Å; I3727-M3754 HydrophobicContact CG1-CE 4.06Å; L3748-M3754 HydrophobicContact CD1-CE 3.35Å; L3748-M3754 HydrophobicContact CD1-CG 4.03Å; L3748-M3754 HydrophobicContact CD1-SD 3.48Å; L3748-M3754 WeakPolarHBondContact CD1-SD 3.36Å; L3748-M3754 HydrophobicContact CD2-CE 4.11Å; L3748-M3754 HydrophobicContact CG-CE 3.72Å; L3748-M3754 HydrophobicContact CG-CG 4.17Å; L3748-M3754 HydrophobicContact CG-SD 4.18Å; L3748-M3754 WeakPolarHBondContact O-CG 3.24Å; H3751-M3754 HydrophobicContact CB-CG 4.33Å; S3752-M3754 PolarHBondContact O-N 3.48Å; S3752-M3754 VanDerWaalsContact O-N 3.1Å
3755	Y	88.2	Confident	78.2	Confident	1 Å²	1	44.4 Å²	44.4	0%	0.004	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	140.1	-175.3	-62.4	-88.1	0	0	0	111.7	K3647 K3651 N3701 W3723 I3724 P3725 Y3749 H3751 S3752 S3753	K3647-Y3755 WeakPolarHBondContact CA-OH 3.47Å; K3651-Y3755 HydrophobicContact CG-CD1 4.19Å; K3651-Y3755 HydrophobicContact CG-CE1 3.91Å; N3701-Y3755 PolarHBondContact OD1-O 2.91Å; W3723-Y3755 HydrophobicContact CB-CD1 3.91Å; W3723-Y3755 HydrophobicContact CB-CG 4.24Å; I3724-Y3755 WeakPolarHBondContact O-CA 3.29Å; P3725-Y3755 HydrophobicContact CG-CD1 4.31Å; P3725-Y3755 HydrophobicContact CG-CE1 3.92Å; Y3749-Y3755 VanDerWaalsContact O-CE2 3.29Å; Y3749-Y3755 WeakPolarHBondContact O-CE2 3.43Å; Y3749-Y3755 PolarHBondContact O-OH 2.91Å; H3751-Y3755 VanDerWaalsContact O-CD2 3.27Å; H3751-Y3755 WeakPolarHBondContact O-CD2 3.47Å; H3751-Y3755 VanDerWaalsContact O-CE2 3.28Å; H3751-Y3755 WeakPolarHBondContact O-CE2 3.46Å; S3752-Y3755 PolarHBondContact O-N 3.08Å; S3752-Y3755 VanDerWaalsContact O-N 3.14Å; S3753-Y3755 PolarHBondContact O-N 3.16Å
3756	Q	86.2	Confident	76.5	Confident	53 Å²	53	50.5 Å²	50.5	25%	0.248	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	144.4	162.6	61.2	-176.3	-44.7	0	0	108.7	I3724 T3726 R3758	I3724-Q3756 HydrophobicContact CB-CG 4.32Å; I3724-Q3756 PolarHBondContact N-O 2.94Å; I3724-Q3756 WeakPolarHBondContact O-CG 3.23Å; I3724-Q3756 PolarHBondContact O-N 3.09Å; T3726-Q3756 HydrophobicContact CG2-CB 3.79Å; T3726-Q3756 HydrophobicContact CG2-CG 3.92Å; Q3756-R3758 VanDerWaalsContact NE2-NH2 3.1Å
3757	I	87.1	Confident	74.5	Confident	10 Å²	10	56.2 Å²	56.2	5%	0.051	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	138.2	176	-167.3	157.7	0	0	0	110.1	W3655 N3701 Y3702 W3704 Y3721 R3722 W3723	W3655-I3757 HydrophobicContact CH2-CD1 3.54Å; W3655-I3757 HydrophobicContact CZ2-CD1 4.13Å; W3655-I3757 HydrophobicContact CZ3-CD1 3.89Å; N3701-I3757 HydrophobicContact CB-CG2 3.98Å; Y3702-I3757 HydrophobicContact CD2-CG2 4.11Å; Y3702-I3757 HydrophobicContact CG-CG2 3.93Å; W3704-I3757 HydrophobicContact CH2-CD1 3.48Å; W3704-I3757 VanDerWaalsContact CH2-CD1 3.48Å; W3704-I3757 HydrophobicContact CZ2-CD1 3.92Å; Y3721-I3757 HydrophobicContact CD1-CG1 4.07Å; Y3721-I3757 HydrophobicContact CG-CD1 4.31Å; Y3721-I3757 HydrophobicContact CG-CG1 4.25Å; R3722-I3757 WeakPolarHBondContact O-CA 3.15Å; W3723-I3757 HydrophobicContact CD2-CB 4.24Å; W3723-I3757 HydrophobicContact CD2-CD1 4.45Å; W3723-I3757 HydrophobicContact CE3-CB 3.73Å; W3723-I3757 HydrophobicContact CH2-CB 4.01Å; W3723-I3757 HydrophobicContact CH2-CD1 4.24Å; W3723-I3757 HydrophobicContact CH2-CG2 4.47Å; W3723-I3757 HydrophobicContact CZ2-CB 4.46Å; W3723-I3757 HydrophobicContact CZ2-CD1 3.95Å; W3723-I3757 HydrophobicContact CZ3-CB 3.64Å; W3723-I3757 HydrophobicContact CZ3-CG2 4.29Å
3758	R	83.8	Confident	72.5	Confident	94 Å²	94	62.8 Å²	62.8	36%	0.355	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	147.5	174.6	-62.3	-160.7	-173.6	162.4	-5.9	111.3	R3722 I3724 Q3756	R3722-R3758 PolarHBondContact N-O 3.23Å; R3722-R3758 PolarHBondContact O-N 2.86Å; I3724-R3758 HydrophobicContact CD1-CB 3.96Å; I3724-R3758 HydrophobicContact CD1-CG 3.87Å; Q3756-R3758 VanDerWaalsContact NE2-NH2 3.1Å
3759	P	83.3	Confident	70.6	Confident	37 Å²	37	68.1 Å²	68.1	24%	0.24	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	140.3	167.5	-18.2	28.5	0	0	0	110.9	Y3721 E3761	Y3721-P3759 HydrophobicContact CD1-CB 4.45Å; Y3721-P3759 HydrophobicContact CD1-CG 4.31Å; Y3721-P3759 HydrophobicContact CE1-CB 4.18Å; Y3721-P3759 HydrophobicContact CE1-CG 3.8Å; P3759-E3761 VanDerWaalsContact C-N 3.3Å; P3759-E3761 PolarHBondContact O-N 3.09Å
3760	K	80.9	Confident	68.5	Low	110 Å²	110	74.8 Å²	74.8	48%	0.478	35%	0.353	S	S	.	.	S	Bend	trans	-66.5	-31.3	176.1	-72.4	178.3	-168.6	175.7	0	112.1	N3720 Y3721 R3722 L3762 H3763	N3720-K3760 VanDerWaalsContact O-CB 3.3Å; N3720-K3760 WeakPolarHBondContact O-CB 3.5Å; N3720-K3760 VanDerWaalsContact O-CG 3.24Å; N3720-K3760 WeakPolarHBondContact O-CG 3.24Å; N3720-K3760 PolarHBondContact O-N 3.49Å; Y3721-K3760 VanDerWaalsContact O-CE 3.23Å; Y3721-K3760 WeakPolarHBondContact O-CE 3.47Å; R3722-K3760 HydrophobicContact CB-CG 4.33Å; R3722-K3760 HydrophobicContact CG-CG 4.36Å; K3760-L3762 PolarHBondContact O-N 3.09Å; K3760-H3763 PolarHBondContact O-N 3.04Å
3761	E	67.6	Low	66	Low	129 Å²	129	82.5 Å²	82.5	60%	0.603	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-27.8	-172.6	-62.2	-165.6	150.8	0	0	114.6	P3759 H3763 K3764	P3759-E3761 VanDerWaalsContact C-N 3.3Å; P3759-E3761 PolarHBondContact O-N 3.09Å; E3761-H3763 PolarHBondContact O-N 3.02Å; E3761-K3764 PolarHBondContact O-N 2.89Å
3762	L	54.5	Low	63.6	Low	125 Å²	125	93 Å²	93	65%	0.654	43%	0.434	S	S	*	.	H	α-helix	trans	-61.1	-19.1	179	-141.6	88.2	0	0	0	112.9	K3760	K3760-L3762 PolarHBondContact O-N 3.09Å
3763	H	48.2	Very low	62.5	Low	47 Å²	47	97.4 Å²	97.4	22%	0.218	45%	0.454	C	S	.	.	H	α-helix	trans	-85.3	-19.6	176.7	-80.8	-80.7	0	0	0	114.4	R3722 K3760 E3761 H3765 K3766 E3767	R3722-H3763 PolarHBondContact NH2-CD2 3.49Å; R3722-H3763 PolarHBondContact NH2-CE1 3.12Å; R3722-H3763 VanDerWaalsContact NH2-CE1 3.27Å; R3722-H3763 VanDerWaalsContact NH2-CG 3.3Å; R3722-H3763 PolarHBondContact NH2-NE2 2.85Å; K3760-H3763 PolarHBondContact O-N 3.04Å; E3761-H3763 PolarHBondContact O-N 3.02Å; H3763-H3765 PolarHBondContact O-N 3.42Å; H3763-K3766 PolarHBondContact O-N 3.13Å; H3763-K3766 VanDerWaalsContact O-N 3.16Å; H3763-E3767 PolarHBondContact O-N 3.01Å
3764	K	49.7	Very low	61.4	Low	141 Å²	141	102.1 Å²	102.1	61%	0.613	48%	0.475	S	S	*	.	H	α-helix	trans	-63.3	-28.6	175.1	-76.6	-176.5	176.6	174	0	112.1	E3761 K3768	E3761-K3764 PolarHBondContact O-N 2.89Å; K3764-K3768 WeakPolarHBondContact O-CG 3.28Å; K3764-K3768 PolarHBondContact O-N 3.29Å
3765	H	46.5	Very low	60	Low	139 Å²	139	107.4 Å²	107.4	64%	0.644	50%	0.5	S	S	*	.	H	α-helix	trans	-73.1	-42.2	173.3	-80.6	-74.6	0	0	0	112.4	H3763 K3768 D3769	H3763-H3765 PolarHBondContact O-N 3.42Å; H3765-K3768 PolarHBondContact O-N 2.62Å; H3765-D3769 PolarHBondContact O-N 2.89Å; H3765-D3769 VanDerWaalsContact O-N 3.14Å
3766	K	46.1	Very low	58.4	Low	137 Å²	137	113.7 Å²	113.7	60%	0.596	53%	0.529	S	S	*	.	H	α-helix	trans	-71.2	-34.3	177.3	-76.3	-168.8	174.2	-169.4	0	114	H3763 K3768 D3769 L3770	H3763-K3766 PolarHBondContact O-N 3.13Å; H3763-K3766 VanDerWaalsContact O-N 3.16Å; K3766-K3768 VanDerWaalsContact C-N 3.33Å; K3766-D3769 PolarHBondContact O-N 2.87Å; K3766-L3770 PolarHBondContact O-N 3.26Å
3767	E	44.3	Very low	56.6	Low	121 Å²	121	117.5 Å²	117.5	57%	0.565	55%	0.547	S	S	*	.	H	α-helix	trans	-68.5	-33.3	173.4	-81.7	177.8	173.6	0	0	111.7	H3763 L3770 Q3771	H3763-E3767 PolarHBondContact O-N 3.01Å; E3767-L3770 PolarHBondContact O-N 3.18Å; E3767-Q3771 WeakPolarHBondContact O-CB 3.36Å; E3767-Q3771 VanDerWaalsContact O-CG 3.3Å; E3767-Q3771 WeakPolarHBondContact O-CG 3.38Å; E3767-Q3771 PolarHBondContact O-N 2.87Å
3768	K	45.3	Very low	54.6	Low	138 Å²	138	124.7 Å²	124.7	60%	0.6	58%	0.58	S	S	*	*	H	α-helix	trans	-67.6	-33.4	171.9	-83.8	-176	174.8	-176.7	0	113.3	K3764 H3765 K3766 K3772	K3764-K3768 WeakPolarHBondContact O-CG 3.28Å; K3764-K3768 PolarHBondContact O-N 3.29Å; H3765-K3768 PolarHBondContact O-N 2.62Å; K3766-K3768 VanDerWaalsContact C-N 3.33Å; K3768-K3772 PolarHBondContact O-N 2.76Å; K3768-K3772 VanDerWaalsContact O-N 3.15Å
3769	D	46.7	Very low	52.5	Low	113 Å²	113	126.9 Å²	126.9	60%	0.604	60%	0.596	S	S	*	*	H	α-helix	trans	-79	-20.1	175.9	-71.8	-21	0	0	0	113.4	H3765 K3766	H3765-D3769 PolarHBondContact O-N 2.89Å; H3765-D3769 VanDerWaalsContact O-N 3.14Å; K3766-D3769 PolarHBondContact O-N 2.87Å
3770	L	44.5	Very low	50.1	Low	147 Å²	147	133.8 Å²	133.8	77%	0.77	62%	0.623	S	S	*	*	H	α-helix	trans	-87.8	-19.1	170.9	-87	152.3	0	0	0	113	K3766 E3767	K3766-L3770 PolarHBondContact O-N 3.26Å; E3767-L3770 PolarHBondContact O-N 3.18Å
3771	Q	38.4	Very low	47.6	Very low	168 Å²	168	135.8 Å²	135.8	79%	0.785	64%	0.635	S	S	*	*	H	α-helix	trans	-89	-16.6	173	-77.7	-178.2	-8	0	0	113.2	E3767	E3767-Q3771 WeakPolarHBondContact O-CB 3.36Å; E3767-Q3771 VanDerWaalsContact O-CG 3.3Å; E3767-Q3771 WeakPolarHBondContact O-CG 3.38Å; E3767-Q3771 PolarHBondContact O-N 2.87Å
3772	K	39.1	Very low	45.7	Very low	224 Å²	224	136.4 Å²	136.4	97%	0.974	64%	0.638	S	S	*	*			trans	-87.2	0	165.2	-80.3	-177.3	175.2	-177.9	0	109.6	K3768	K3768-K3772 PolarHBondContact O-N 2.76Å; K3768-K3772 VanDerWaalsContact O-N 3.15Å

Retrieved 3,772 of 3,772 residues in 824.9 ms (Link to these results)

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