A0A3Q0KQW3_SCHMA Loading...

TROVE domain-containing protein AlphaSync Fragmented

AlphaFold DB , UniProt , Accession A0A3Q0KQW3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 3,133 aa.

						>A0A3Q0KQW3_SCHMA|A0A3Q0KQW3
MRMDHESGHLKGPSSLLSPVYLEGKNLVKNKLLDEPFAKTSSASSTLSSLSLNNESLKSSISLSYTGSVLHCDHKETIRPNDKHHEAKQTSDASPLKSTPIDWLKDAIIKISDTSFQDILECTVGGSVESNPIHNTFGDLLTYERGDTYKQLKLGLISCISSSIVDGGPSKEKKIILGQSIHACIDKDPEFILKAALYCRRELNIRTTTNMLIAVASCNERSRSFIKKYFSSCIRTPSDWIEVAEYYATISGNLSLKGMPKVLRSSMISKFLEFDEYQLAKHSKHRARANRSTKSKALKKSRNSGVVSTDIDAILYRLAHSPRIYFTIKELIRRLHISKPKFNVMCVLGKPYPSDSTDFIRMGLEGDWDSSKAGTRMKFPVPVTWETELSVNGNNSDSWSKLITLNKVPHMALLRNLRNILLSNVQDSIHEIVLKRLTDPRIIMEGKQFPFRYFAAFDTIDRLKRDLHYHRFVMRTTVTEVLKRKKTTPRQLKKSEWLEKSMKKGIGKFLLCDFEMLDRYKNALSTALELSMKHNLPPICGSTLIICSTSKYVNSSKHKSSKSYVQILGFLLGAMCTSICETPTTYVTVDDQYNLTPIEVVLRGNQTLNNHDKDSDFCGWKQNEYRSKRKSMGILERTKQMYKRRKSLRSTSITTVVEKLYAYRKQFDKIVVFGDCHKEIVDYVINYRTYIGPLKAIWGNLSGEDVWPNSCSKDGWIEFKGCTDQILRYIAEPNEDKLLERIEEIDEIYGLNKNISYHFNLKTKTQENLDNSILPKHDYFRSGWKCCQLFISSTFRDMHAERDLLCGILVPALRRNVALGLRVHLNEIDLRWGVPEPVTYNSQALQICLEQAAASDIFVLLLGDRYGCIPDETEVMALPESLLSEVCKFYKPGMSMTEMEYHMARQAAISKVPIHERRQQNTISFHEAIRLRICVFIRDSASMENVPDELKHYFEEYDNEKRNRLNAFKELIRNDGVIVSYNYSAQFNGLINDYPVMGNLDEFGSQFLATVKSLLLRLFHNDNDNTPIYNNDHNLPVTANKSLNTIEFLREYVYSAACAIGPRHLLEVEQAFNSLTERGRRAHLTRAIQSTENKLSVQNNSSYPTNLQGCDGSILLIVGSNGSGKTTYLSALTISLIESNWYKSIPMNKTIQNKFATKLNSIGSFMNDSMDHSKLITSQRPIFVKHQILIHFCNGLSITGLPSNKKLNEILQNWLNLLIIQLDNICNCNDILKKLLSELKLSFNMNKISSNIDLKFYIQCFARFINFLGYLNDIQFAFLIDDCDRLEPMTLEWLPQILPKNVRFVLTCDSKSSVARNLCNRIDCQLLTVSGLTTHERGAAVRSLLGKYGKVLNESGFRNQLSVLIQKRDASIPLYLKLACDELRLYSNYEQLGAKLKQLPDTISSLVIDVVKRVECSCGSELTRITLGLLTCSRQPLSTEELHNLIDEWLIESWMEEQYKNGYTDSWQELKVPLDNLDNIMSNEKIIYQINDQFNNKNKPTLSKGQPHLPSLLLYILLTGLHPLLSGFNDERADIDEIDEELPFDDSMQTIKQEKLTIWNLGSRALSFSSREIHNLVYDICFNQSKYSIGHKKYEYSFKNNQTKNCNKRAKYSESIPDDKIHLKTVTLQTIHNILASKLRNMKDLIYHLHHAGRLNEVVCLLTSPAFLIHQIESGYGLTLLDDMNRYITTTTAHHQSESNNIPTSLDLMRDKIRTMQRFLASNYEFLIKHPYSFAELAINQDVDEWIHTIGYACLLSSNYQEKINGDLCKNFFRIKLNTNDNSCILPKIIQPIAIHKPVTPLTGSQDIPIAIELDRTGILLAYGTESGTVTVVEVQSLKTLCSFLGHNMPILSLCFLDEVDSSTTRSYSIPSSQLWLVSTSQDASILIWDLSNVIKSVTCGITTSTSSQLCSLGGYHNKPVTVSAWHPKRRLLATGGLDCLICLWEVGELGFGSYFTSTSSGCKKIKPSKKLNIKSSINSISFRLPNYASDSEKSIPPEYLRDVLAVGCWDGSVHFYSLISMSWIKSLAISSSAICSLAYSPNNGRLLAILDREGQSFILNADTFVYLGRLTENVSFSSINEFTSLDELHHLLPSQKGVLCFSKPTGRYLIQTGGGSSVGRINVWNAHLGAPEGPWINVIRNKKEMKQTILATTYAIDISGKHIIIGWNDGLFTIVLITNGETIFSSDKLIPLINDNSSVQAISCGISPYYDDANLVIVGWSSGAVRLYHFSFKPGTKSKRDDNSTVQSDLHSICDVSIVPLYTSWSHSIEHAENGTGEAGGTLCAAASDFIAVSGGGNCEVWVYFVGSVLENPLVKSFCFREHSSQITAVAVQMDFIATGSKDKNVAIYKYDSNSTTVTLQYIIYNASKDWIISLKWSYILYKMSDRKLTLLVGSNDQLIRLYRIKSKKYKLKQTLVSDQSGIKSLDFNFPYIFSATSNGHISVWRYGKNGNFELISEMIISSPLDNLNSSTTDENVVNLVKIQSFEYTPCYNPSTNESVINTCDELEPHQNEDSVVDTLEFSNRSSSPLSSEDDSSQHHGITDENLFGDKNSMKGTSDYDELMDEGSDETPSQCSEKDLMTVDKCNNVAFNGDLSTGFQMFDKYINRPGSSSELLNGTNVKLLIGQTISGSRNIQEFQFRVYEPSLTGYHATLSGHAGLIPCGLSCTKPLNSNNDDTLLISVAGQNCDSKTIGCDIRLWDLPLSNNSSLCKPTLQHTGPIICANYLNVTKNLQLCITGSVDGDCIIWAVYDSSTSQSIKPMATTTTTTTTTTTTTTTTTTTTYQPLIRLTHSYMKPRYSINSIVTQRGIMDNEKTKIDYFIYIAFGYEIATLHIQLNHDSLMNEIDLENIILELFSNRKQLNINFIELNTLWSIQTMDGYAEIQRFKTDHIVVEMSTLHHEPVNMNQCGVVALLSNGEVVIIPFQRTDNELVHLRVRDNCNLSSHWCSSICTYQDGILVAHDGSALFHPFDDSTHVFTPLPGSINNLENIHIDRIEPLCLPNGNSFKLLYIVTSKLESEPRIIFFNNNEHMLLNISLEGMELQVTAYCIISTHFDNKTLIAYLLLATSDSFLRLFKCSIDVSDESESSKWEQIKIYPTGEQIKKLVTFNKDPVKIMCCLQSGQIDFYTIEL
					

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

Download 10 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	25.4	Very low	29.1	Very low	246 Å²	246	174.5 Å²	174.5	100%	1.212	88%	0.879	S	S	*	*				0	95.2	0	-78.2	-174.9	157.2	0	0	108.9
2	R	27	Very low	28.9	Very low	249 Å²	249	164.8 Å²	164.8	94%	0.94	86%	0.857	S	S	*	*			trans	-151.4	119.6	159.3	-101.5	-177.7	-177.6	177.2	-0.7	104.9
3	M	24.1	Very low	29.2	Very low	158 Å²	158	162.9 Å²	162.9	78%	0.778	86%	0.861	S	S	*	*			trans	-82.9	123.9	-179.2	-67.2	-148.4	-76.9	0	0	107.8
4	D	32.8	Very low	28.9	Very low	163 Å²	163	159.3 Å²	159.3	87%	0.872	86%	0.855	S	S	*	*			trans	-112.6	120.6	157.8	-76.2	-36.9	0	0	0	106.7
5	H	33.3	Very low	28.9	Very low	159 Å²	159	155.9 Å²	155.9	74%	0.736	85%	0.849	S	S	*	*			trans	-69.6	159.3	-178.7	-78.1	-95.1	0	0	0	111.1
6	E	33.1	Very low	28.8	Very low	184 Å²	184	157.4 Å²	157.4	86%	0.86	86%	0.855	S	S	*	*			trans	90.1	72.2	168.4	-52.8	-173.6	171.2	0	0	117.4
7	S	33.4	Very low	28.8	Very low	121 Å²	121	157.6 Å²	157.6	85%	0.846	85%	0.854	S	S	*	*				176.3	109.5	119	43.6	0	0	0	0	109.4	H9	S7-H9 PolarHBondContact O-N 3.31Å
8	G	28.6	Very low	28.5	Very low	73 Å²	73	154 Å²	154	75%	0.753	84%	0.842	S	S	*	*			trans	-74.3	105.9	-178.8	0	0	0	0	0	111.4
9	H	30.2	Very low	28.2	Very low	184 Å²	184	151.5 Å²	151.5	85%	0.852	84%	0.835	S	S	*	*			trans	-145.1	102	151	-90.5	-51.4	0	0	0	110.3	S7 K11	S7-H9 PolarHBondContact O-N 3.31Å; H9-K11 PolarHBondContact O-N 3.42Å; H9-K11 VanDerWaalsContact O-N 3.16Å
10	L	24.7	Very low	28.1	Very low	184 Å²	184	149.5 Å²	149.5	96%	0.963	83%	0.827	S	S	*	*			trans	-60.2	105.7	164.2	-83.4	147.3	0	0	0	109.3
11	K	27.7	Very low	27.9	Very low	198 Å²	198	152.4 Å²	152.4	86%	0.861	83%	0.826	S	S	*	*			trans	-116.1	103.4	157.9	-81.5	-173.6	175.5	179.4	0	108.1	H9	H9-K11 PolarHBondContact O-N 3.42Å; H9-K11 VanDerWaalsContact O-N 3.16Å
12	G	26.7	Very low	27.9	Very low	59 Å²	59	148.3 Å²	148.3	61%	0.608	81%	0.809	S	S	*	*			trans	-60.1	153	175	0	0	0	0	0	112	S14	G12-S14 PolarHBondContact O-N 3.36Å
13	P	32.6	Very low	27.8	Very low	140 Å²	140	144.5 Å²	144.5	91%	0.909	80%	0.802	S	S	*	*			trans	-84	98.7	-167.7	33.3	-30.7	0	0	0	110.1
14	S	24.9	Very low	27.8	Very low	112 Å²	112	140.1 Å²	140.1	78%	0.783	80%	0.797	S	S	*	*			trans	-133.9	73.8	172.9	65.6	0	0	0	0	111	G12	G12-S14 PolarHBondContact O-N 3.36Å
15	S	28.9	Very low	27.4	Very low	109 Å²	109	141.9 Å²	141.9	76%	0.762	80%	0.796	S	S	*	*			trans	-158.6	89.4	147.5	49	0	0	0	0	108.2	L17	S15-L17 PolarHBondContact O-N 3.46Å
16	L	27.7	Very low	27.1	Very low	179 Å²	179	141.6 Å²	141.6	94%	0.937	80%	0.8	S	S	*	*			trans	-42.7	107.7	153.1	-79.4	153.2	0	0	0	107.3	S18	L16-S18 PolarHBondContact O-N 3.11Å
17	L	28	Very low	26.7	Very low	162 Å²	162	140.3 Å²	140.3	85%	0.848	80%	0.799	S	S	*	*			trans	-55.9	103.4	174.3	-80.3	154.9	0	0	0	107.4	S15	S15-L17 PolarHBondContact O-N 3.46Å
18	S	23.6	Very low	26.5	Very low	92 Å²	92	140.3 Å²	140.3	64%	0.643	79%	0.793	S	S	*	*			trans	-51.7	136.2	163.8	48.2	0	0	0	0	108.3	L16 V20	L16-S18 PolarHBondContact O-N 3.11Å; S18-V20 PolarHBondContact O-N 2.97Å
19	P	23.9	Very low	26.2	Very low	107 Å²	107	145.9 Å²	145.9	70%	0.695	80%	0.797	S	S	*	*			trans	-64.6	107.1	-173.4	24.6	-30.9	0	0	0	108.6	Y21	P19-Y21 VanDerWaalsContact C-N 3.31Å; P19-Y21 WeakPolarHBondContact O-CD2 3.39Å; P19-Y21 PolarHBondContact O-N 2.72Å
20	V	24.9	Very low	26	Very low	111 Å²	111	144.6 Å²	144.6	67%	0.673	80%	0.796	S	S	*	*			trans	-64.2	96.4	171.1	178.6	0	0	0	0	106.8	S18 L22	S18-V20 PolarHBondContact O-N 2.97Å; V20-L22 VanDerWaalsContact C-N 3.34Å; V20-L22 HydrophobicContact CG1-CD2 4.48Å; V20-L22 HydrophobicContact CG1-CG 4.48Å; V20-L22 PolarHBondContact O-N 3.27Å
21	Y	24.5	Very low	26	Very low	210 Å²	210	144.6 Å²	144.6	82%	0.824	79%	0.788	S	S	*	*			trans	-58.3	100.5	164.4	-82.2	-90.4	0	0	0	107.5	P19 E23	P19-Y21 VanDerWaalsContact C-N 3.31Å; P19-Y21 WeakPolarHBondContact O-CD2 3.39Å; P19-Y21 PolarHBondContact O-N 2.72Å; Y21-E23 VanDerWaalsContact C-N 3.28Å; Y21-E23 PolarHBondContact O-N 3.42Å
22	L	26.2	Very low	26.1	Very low	161 Å²	161	143.3 Å²	143.3	84%	0.843	79%	0.79	S	S	*	*			trans	-70.3	89.9	172.3	-78.2	165.6	0	0	0	108.1	V20 G24	V20-L22 VanDerWaalsContact C-N 3.34Å; V20-L22 HydrophobicContact CG1-CD2 4.48Å; V20-L22 HydrophobicContact CG1-CG 4.48Å; V20-L22 PolarHBondContact O-N 3.27Å; L22-G24 PolarHBondContact O-N 2.95Å; L22-G24 VanDerWaalsContact O-N 3.17Å
23	E	24	Very low	26.1	Very low	169 Å²	169	147.3 Å²	147.3	79%	0.79	80%	0.797	S	S	*	*			trans	-50	118.1	168.6	-78.1	-176.3	146.5	0	0	109.8	Y21 K25	Y21-E23 VanDerWaalsContact C-N 3.28Å; Y21-E23 PolarHBondContact O-N 3.42Å; E23-K25 PolarHBondContact O-N 3.15Å
24	G	23.8	Very low	25.8	Very low	65 Å²	65	147.4 Å²	147.4	67%	0.67	79%	0.79	S	S	*	*			trans	-56.5	113.3	172.2	0	0	0	0	0	109.6	L22 N26	L22-G24 PolarHBondContact O-N 2.95Å; L22-G24 VanDerWaalsContact O-N 3.17Å; G24-N26 PolarHBondContact O-N 3.3Å
25	K	24.3	Very low	25.9	Very low	200 Å²	200	151.2 Å²	151.2	87%	0.87	80%	0.795	S	S	*	*	S	Bend	trans	-50.9	97.2	169.2	-72.6	-179.1	175.2	179.6	0	109.3	E23	E23-K25 PolarHBondContact O-N 3.15Å
26	N	27	Very low	26	Very low	153 Å²	153	151.3 Å²	151.3	82%	0.818	79%	0.793	S	S	*	*			trans	163.1	39.8	153.9	-80.6	-24.9	0	0	0	112.6	G24	G24-N26 PolarHBondContact O-N 3.3Å
27	L	24.9	Very low	25.8	Very low	157 Å²	157	153 Å²	153	82%	0.822	79%	0.793	S	S	*	*			trans	-97.2	91.9	161.7	-76.7	167.9	0	0	0	108.4	K29	L27-K29 PolarHBondContact O-N 3.03Å; L27-K29 VanDerWaalsContact O-N 3.15Å
28	V	28.7	Very low	25.8	Very low	121 Å²	121	150.2 Å²	150.2	73%	0.733	79%	0.794	S	S	*	*			trans	-64.6	111	172.8	175.8	0	0	0	0	108.2	N30	V28-N30 PolarHBondContact O-N 2.94Å; V28-N30 VanDerWaalsContact O-N 3.15Å
29	K	23.6	Very low	25.9	Very low	191 Å²	191	155.4 Å²	155.4	83%	0.83	81%	0.805	S	S	*	*			trans	-58.8	108.6	168.2	-82.2	177	173.1	173.8	0	109.1	L27 K31	L27-K29 PolarHBondContact O-N 3.03Å; L27-K29 VanDerWaalsContact O-N 3.15Å; K29-K31 PolarHBondContact O-N 3.49Å
30	N	26.1	Very low	26	Very low	157 Å²	157	156.9 Å²	156.9	84%	0.84	81%	0.812	S	S	*	*			trans	-72.2	90.7	169.3	-75.3	-32.2	0	0	0	109.6	V28	V28-N30 PolarHBondContact O-N 2.94Å; V28-N30 VanDerWaalsContact O-N 3.15Å
31	K	25.1	Very low	26.1	Very low	183 Å²	183	157.4 Å²	157.4	80%	0.796	82%	0.82	S	S	*	*			trans	-99.5	121	157.3	-85.8	-170.4	173.4	-172.5	0	107.8	K29	K29-K31 PolarHBondContact O-N 3.49Å
32	L	29.5	Very low	26.1	Very low	172 Å²	172	152.9 Å²	152.9	90%	0.901	82%	0.82	S	S	*	*			trans	167.2	74.5	161.9	-91.7	161.4	0	0	0	104.1
33	L	25.9	Very low	26.3	Very low	142 Å²	142	150.2 Å²	150.2	74%	0.743	82%	0.821	S	S	*	*				43	104	83.6	-74.4	174.4	0	0	0	113.6
34	D	26.6	Very low	26.2	Very low	143 Å²	143	147.4 Å²	147.4	77%	0.765	82%	0.82	S	S	*	*			trans	43.1	105.8	136.3	-54.8	-28.4	0	0	0	119
35	E	27.5	Very low	26.3	Very low	192 Å²	192	149.3 Å²	149.3	90%	0.897	82%	0.823	S	S	*	*			trans	-137.8	136.2	135.3	-88.6	-154.3	159.9	0	0	110.5
36	P	30.2	Very low	26.5	Very low	111 Å²	111	146.8 Å²	146.8	72%	0.721	83%	0.825	S	S	*	*			trans	-92.3	145.7	-169.9	28.9	-16.8	0	0	0	113.3
37	F	23.2	Very low	26.3	Very low	214 Å²	214	148 Å²	148	94%	0.939	83%	0.83	S	S	*	*			trans	16.4	108.1	152.6	-68.6	-86.8	0	0	0	118.6
38	A	27.8	Very low	26.3	Very low	104 Å²	104	145.9 Å²	145.9	86%	0.86	83%	0.828	S	S	*	*			trans	-116.5	130	153.6	0	0	0	0	0	110.2
39	K	27.1	Very low	26.3	Very low	200 Å²	200	145.5 Å²	145.5	87%	0.87	83%	0.831	S	S	*	*			trans	-63.8	146.7	-162.6	-72.7	168.1	172.7	174.1	0	115.2
40	T	24.5	Very low	26.4	Very low	139 Å²	139	144.3 Å²	144.3	85%	0.853	83%	0.833	S	S	*	*			trans	-29.9	132.6	154.1	49.4	0	0	0	0	115.5
41	S	28	Very low	26.6	Very low	121 Å²	121	142.3 Å²	142.3	85%	0.846	83%	0.831	S	S	*	*			trans	-129.4	124.6	148.5	58.4	0	0	0	0	109.8
42	S	25.4	Very low	26.7	Very low	116 Å²	116	141 Å²	141	81%	0.811	83%	0.832	S	S	*	*			trans	-74	132.5	176.3	38.4	0	0	0	0	110.6
43	A	28.6	Very low	26.6	Very low	104 Å²	104	140.4 Å²	140.4	86%	0.86	83%	0.83	S	S	*	*			trans	-148.6	79.7	161.7	0	0	0	0	0	108.7
44	S	23.3	Very low	26.6	Very low	110 Å²	110	140.7 Å²	140.7	77%	0.769	83%	0.832	S	S	*	*			trans	-94.3	101.8	165.2	52.3	0	0	0	0	108.7
45	S	25.9	Very low	26.4	Very low	105 Å²	105	142.8 Å²	142.8	73%	0.734	84%	0.837	S	S	*	*			trans	174.6	101.5	153.3	46.7	0	0	0	0	109.8
46	T	28.2	Very low	26.4	Very low	148 Å²	148	139.1 Å²	139.1	91%	0.908	83%	0.833	S	S	*	*			trans	179	67.5	150.1	22.1	0	0	0	0	107.9
47	L	22.9	Very low	26.4	Very low	178 Å²	178	142.6 Å²	142.6	93%	0.932	84%	0.844	S	S	*	*			trans	-133.6	75.4	168.7	-93.2	169.3	0	0	0	107.4
48	S	25.4	Very low	26.4	Very low	112 Å²	112	142.3 Å²	142.3	78%	0.783	84%	0.843	S	S	*	*			trans	-169.6	76.7	166.7	53.6	0	0	0	0	110.6
49	S	27.1	Very low	26.4	Very low	113 Å²	113	142.8 Å²	142.8	79%	0.79	84%	0.84	S	S	*	*			trans	168.4	117.1	145.1	41.9	0	0	0	0	108.8
50	L	27.3	Very low	26.3	Very low	167 Å²	167	139.1 Å²	139.1	87%	0.874	84%	0.84	S	S	*	*			trans	168.4	77.2	144.2	-87.5	159.4	0	0	0	106.2	L52	L50-L52 PolarHBondContact O-N 3.09Å
51	S	28.4	Very low	26.4	Very low	115 Å²	115	139.9 Å²	139.9	80%	0.804	84%	0.837	S	S	*	*			trans	-61.3	118.5	167	47.5	0	0	0	0	109.5
52	L	27.2	Very low	26.2	Very low	156 Å²	156	139.2 Å²	139.2	82%	0.817	83%	0.832	S	S	*	*			trans	-76.4	117.8	173	-85.1	138	0	0	0	109.9	L50	L50-L52 PolarHBondContact O-N 3.09Å
53	N	28	Very low	26.1	Very low	159 Å²	159	141.8 Å²	141.8	85%	0.85	84%	0.836	S	S	*	*			trans	-78.4	113.5	163.5	-81.5	-10.8	0	0	0	108.7
54	N	25.6	Very low	25.8	Very low	148 Å²	148	141.7 Å²	141.7	79%	0.791	83%	0.829	S	S	*	*			trans	-88.4	95.6	173.5	-86.4	-17	0	0	0	109.7
55	E	24	Very low	25.8	Very low	186 Å²	186	147.7 Å²	147.7	87%	0.869	84%	0.836	S	S	*	*			trans	-147.2	140.2	154.2	-73.7	-163.3	156.1	0	0	109.7
56	S	27.5	Very low	25.8	Very low	115 Å²	115	148.3 Å²	148.3	80%	0.804	84%	0.836	S	S	*	*			trans	90.7	66.9	172	78	0	0	0	0	119.6
57	L	28.8	Very low	25.5	Very low	185 Å²	185	145.1 Å²	145.1	97%	0.969	83%	0.832	S	S	*	*			trans	-134.4	76.4	149.4	-81.4	171.7	0	0	0	110.5
58	K	24.6	Very low	25.5	Very low	207 Å²	207	141.1 Å²	141.1	90%	0.9	82%	0.819	S	S	*	*			trans	-116.9	111.1	158.9	-88.3	-174.6	177.1	178.7	0	108.3
59	S	27.6	Very low	25.5	Very low	114 Å²	114	142.2 Å²	142.2	80%	0.797	82%	0.821	S	S	*	*			trans	177.9	122.4	136.4	39.4	0	0	0	0	109.6
60	S	25.2	Very low	25.3	Very low	124 Å²	124	143.6 Å²	143.6	87%	0.867	82%	0.819	S	S	*	*			trans	-66.7	123.1	178.1	26.9	0	0	0	0	111	S62	S60-S62 PolarHBondContact O-N 2.63Å
61	I	26.2	Very low	25.1	Very low	155 Å²	155	143.6 Å²	143.6	80%	0.795	81%	0.814	S	S	*	*			trans	-88	106.5	174.2	-63.1	172.1	0	0	0	108.1
62	S	22.3	Very low	24.9	Very low	107 Å²	107	142.7 Å²	142.7	75%	0.748	81%	0.806	S	S	*	*			trans	-84.1	120.9	167.6	59.4	0	0	0	0	109.8	S60 S64	S60-S62 PolarHBondContact O-N 2.63Å; S62-S64 PolarHBondContact O-N 3.24Å
63	L	24	Very low	24.8	Very low	169 Å²	169	142 Å²	142	89%	0.885	80%	0.803	S	S	*	*			trans	-88.7	93.8	176.8	-81.5	158.1	0	0	0	109.3
64	S	23.5	Very low	24.8	Very low	102 Å²	102	142 Å²	142	71%	0.713	80%	0.798	S	S	*	*			trans	-85.3	130.9	169.1	54.7	0	0	0	0	111	S62 T66	S62-S64 PolarHBondContact O-N 3.24Å; S64-T66 PolarHBondContact O-N 2.9Å
65	Y	22.3	Very low	24.8	Very low	236 Å²	236	144.1 Å²	144.1	93%	0.925	80%	0.8	S	S	*	*			trans	-72	114.1	176.9	-123.3	-101.3	0	0	0	109.2
66	T	25.2	Very low	24.9	Very low	119 Å²	119	143.3 Å²	143.3	73%	0.73	80%	0.796	S	S	*	*			trans	-133.5	115.2	160.8	49.6	0	0	0	0	109.4	S64 S68	S64-T66 PolarHBondContact O-N 2.9Å; T66-S68 PolarHBondContact O-N 2.98Å
67	G	22	Very low	24.9	Very low	81 Å²	81	144 Å²	144	84%	0.835	80%	0.796	S	S	*	*			trans	-68.7	93.1	173.3	0	0	0	0	0	109.8	V69	G67-V69 PolarHBondContact O-N 3.27Å
68	S	24.5	Very low	24.7	Very low	94 Å²	94	142.4 Å²	142.4	66%	0.657	79%	0.787	S	S	*	*			trans	-85.4	105.9	166.5	42.1	0	0	0	0	108.8	T66 L70	T66-S68 PolarHBondContact O-N 2.98Å; S68-L70 PolarHBondContact O-N 3.45Å
69	V	23.8	Very low	24.9	Very low	134 Å²	134	143.8 Å²	143.8	81%	0.812	79%	0.786	S	S	*	*			trans	-62	92.1	160	176.5	0	0	0	0	106.6	G67 H71	G67-V69 PolarHBondContact O-N 3.27Å; V69-H71 PolarHBondContact O-N 2.98Å
70	L	24.2	Very low	25.2	Very low	143 Å²	143	143.3 Å²	143.3	75%	0.749	78%	0.781	S	S	*	*			trans	-70.3	96.1	171.5	-86.1	160.4	0	0	0	108.3	S68 C72	S68-L70 PolarHBondContact O-N 3.45Å; L70-C72 PolarHBondContact O-N 3.03Å
71	H	22.6	Very low	25.3	Very low	167 Å²	167	144.2 Å²	144.2	77%	0.773	78%	0.776	S	S	*	*			trans	-53.7	99.7	157.6	-104	-59.2	0	0	0	108.5	V69 D73	V69-H71 PolarHBondContact O-N 2.98Å; H71-D73 PolarHBondContact O-N 3.1Å
72	C	23.9	Very low	25.4	Very low	95 Å²	95	142.9 Å²	142.9	64%	0.642	77%	0.77	S	S	*	*			trans	-81.8	94.7	165.9	-75.5	0	0	0	0	108.5	L70 H74	L70-C72 PolarHBondContact O-N 3.03Å; C72-H74 PolarHBondContact O-N 2.69Å
73	D	24.8	Very low	25.7	Very low	141 Å²	141	147.1 Å²	147.1	75%	0.754	78%	0.775	S	S	*	*			trans	-61.3	84.1	163.4	-78.5	-26.8	0	0	0	109.9	H71 K75	H71-D73 PolarHBondContact O-N 3.1Å; D73-K75 VanDerWaalsContact C-N 3.31Å; D73-K75 PolarHBondContact O-N 2.94Å; D73-K75 VanDerWaalsContact O-N 3.12Å
74	H	28.1	Very low	25.9	Very low	160 Å²	160	146.3 Å²	146.3	74%	0.741	77%	0.767	S	S	*	*			trans	-79	87.6	162.4	-78.6	-55.3	0	0	0	108.2	C72 E76	C72-H74 PolarHBondContact O-N 2.69Å; H74-E76 PolarHBondContact O-N 2.95Å
75	K	25.8	Very low	26.2	Very low	192 Å²	192	150.8 Å²	150.8	84%	0.835	78%	0.776	S	S	*	*			trans	-60.7	88.4	157.1	-75.1	-173.7	176.6	179.4	0	108	D73 T77	D73-K75 VanDerWaalsContact C-N 3.31Å; D73-K75 PolarHBondContact O-N 2.94Å; D73-K75 VanDerWaalsContact O-N 3.12Å; K75-T77 PolarHBondContact O-N 3.26Å
76	E	26.5	Very low	26.5	Very low	170 Å²	170	147.2 Å²	147.2	79%	0.794	77%	0.768	S	S	*	*			trans	-63.6	104.5	166.8	-78.4	-171.7	155.2	0	0	108	H74 I78	H74-E76 PolarHBondContact O-N 2.95Å; E76-I78 VanDerWaalsContact C-N 3.3Å; E76-I78 PolarHBondContact O-N 3.38Å
77	T	27.5	Very low	26.7	Very low	130 Å²	130	146.1 Å²	146.1	80%	0.798	77%	0.771	S	S	*	*			trans	-71.9	90.9	169.9	28.7	0	0	0	0	107.5	K75 R79	K75-T77 PolarHBondContact O-N 3.26Å; T77-R79 PolarHBondContact O-N 3.46Å; T77-R79 VanDerWaalsContact O-N 3.07Å
78	I	25.3	Very low	27	Very low	150 Å²	150	151.2 Å²	151.2	77%	0.769	77%	0.77	S	S	*	*			trans	-61.4	106.4	171.1	-61.7	168.3	0	0	0	107.3	E76	E76-I78 VanDerWaalsContact C-N 3.3Å; E76-I78 PolarHBondContact O-N 3.38Å
79	R	26.9	Very low	27.1	Very low	236 Å²	236	156.2 Å²	156.2	89%	0.891	78%	0.783	S	S	*	*			trans	-88.6	120.3	161.9	-75.6	-173.7	176.5	-168.5	-2.4	107.6	T77	T77-R79 PolarHBondContact O-N 3.46Å; T77-R79 VanDerWaalsContact O-N 3.07Å
80	P	34.1	Very low	27.2	Very low	105 Å²	105	155.6 Å²	155.6	68%	0.682	78%	0.78	S	S	*	*			trans	-82	138.1	-177.8	34.1	-31.8	0	0	0	110
81	N	28.7	Very low	27.3	Very low	142 Å²	142	154.5 Å²	154.5	76%	0.759	78%	0.784	S	S	*	*			trans	175.6	111.4	135.3	-90	-2.3	0	0	0	110.1
82	D	26.7	Very low	27.5	Very low	127 Å²	127	153.7 Å²	153.7	68%	0.679	79%	0.785	S	S	*	*			trans	53.8	107.1	132	-59.6	-19	0	0	0	119.5
83	K	30.3	Very low	27.6	Very low	196 Å²	196	154 Å²	154	85%	0.852	79%	0.794	S	S	*	*				-177.2	124.5	83.9	-87.8	-174.4	-179.4	175.9	0	110.4
84	H	27.3	Very low	27.6	Very low	153 Å²	153	151.6 Å²	151.6	71%	0.708	79%	0.788	S	S	*	*			trans	-56.6	126.3	179.2	-71.7	-102.4	0	0	0	113.1
85	H	30.7	Very low	27.7	Very low	195 Å²	195	149.5 Å²	149.5	90%	0.903	79%	0.789	S	S	*	*			trans	-129.8	89.7	149.4	-88.8	-59.3	0	0	0	108.1	A87	H85-A87 PolarHBondContact O-N 2.9Å
86	E	27.2	Very low	27.8	Very low	162 Å²	162	148.9 Å²	148.9	76%	0.757	79%	0.794	S	S	*	*			trans	-66.7	108.5	170.7	-70.5	179.7	161.8	0	0	110
87	A	30.3	Very low	27.9	Very low	96 Å²	96	149.4 Å²	149.4	79%	0.793	79%	0.794	S	S	*	*			trans	-100.8	98.9	166.8	0	0	0	0	0	108.6	H85 Q89	H85-A87 PolarHBondContact O-N 2.9Å; A87-Q89 PolarHBondContact O-N 3.3Å
88	K	28.8	Very low	28.2	Very low	187 Å²	187	146.3 Å²	146.3	81%	0.813	78%	0.777	S	S	*	*			trans	-49.5	123.4	175	-76.8	174.4	172.4	176	0	111.8	T90	K88-T90 PolarHBondContact O-N 3.48Å
89	Q	25.1	Very low	28.3	Very low	199 Å²	199	145.2 Å²	145.2	93%	0.93	78%	0.778	S	S	*	*			trans	-63.6	115	164	-71.9	175	-3.6	0	0	108.8	A87	A87-Q89 PolarHBondContact O-N 3.3Å
90	T	27.1	Very low	28.6	Very low	122 Å²	122	136.7 Å²	136.7	75%	0.748	75%	0.753	S	S	*	*			trans	-118.8	116.1	162.7	39.1	0	0	0	0	107.6	K88 D92	K88-T90 PolarHBondContact O-N 3.48Å; T90-D92 PolarHBondContact O-N 2.82Å
91	S	26.7	Very low	29	Very low	119 Å²	119	135.9 Å²	135.9	83%	0.832	74%	0.742	S	S	*	*			trans	-74	96.5	176.7	50.2	0	0	0	0	109.5
92	D	26	Very low	30	Very low	150 Å²	150	135.3 Å²	135.3	80%	0.802	74%	0.739	S	S	*	*			trans	-107.1	121.6	165.5	-90.7	-18.5	0	0	0	109.7	T90 S94	T90-D92 PolarHBondContact O-N 2.82Å; D92-S94 PolarHBondContact O-N 3.18Å; D92-S94 VanDerWaalsContact O-N 3.14Å
93	A	25.6	Very low	30.7	Very low	101 Å²	101	133.3 Å²	133.3	84%	0.835	72%	0.722	S	S	*	*			trans	-48.9	112.1	-177.6	0	0	0	0	0	111.9	P95	A93-P95 WeakPolarHBondContact O-CD 3.5Å
94	S	25.8	Very low	31.2	Very low	91 Å²	91	126 Å²	126	64%	0.636	69%	0.692	S	S	*	*			trans	-68.1	122	177.6	58.4	0	0	0	0	110.2	D92 L96	D92-S94 PolarHBondContact O-N 3.18Å; D92-S94 VanDerWaalsContact O-N 3.14Å; S94-L96 PolarHBondContact O-N 3.06Å
95	P	29.8	Very low	31.7	Very low	116 Å²	116	121.7 Å²	121.7	75%	0.753	67%	0.671	S	S	*	*			trans	-70.2	130.3	179	28.1	-31.1	0	0	0	109.9	A93 K97	A93-P95 WeakPolarHBondContact O-CD 3.5Å; P95-K97 PolarHBondContact O-N 2.97Å
96	L	28.4	Very low	32.2	Very low	179 Å²	179	118 Å²	118	94%	0.937	66%	0.658	S	S	*	*			trans	4	93.5	163.8	-75.4	147.6	0	0	0	114.9	S94 S98	S94-L96 PolarHBondContact O-N 3.06Å; L96-S98 PolarHBondContact O-N 3.37Å
97	K	27.6	Very low	32.8	Very low	182 Å²	182	111.7 Å²	111.7	79%	0.791	63%	0.634	S	S	*	*			trans	-63	115.7	172.9	-83.3	175.4	176.2	168	0	111.2	P95	P95-K97 PolarHBondContact O-N 2.97Å
98	S	33.8	Very low	33.1	Very low	65 Å²	65	112 Å²	112	46%	0.455	62%	0.621	S	S	.	*			trans	47.2	108.3	140.4	60.1	0	0	0	0	118.8	L96 P100 K105	L96-S98 PolarHBondContact O-N 3.37Å; S98-P100 WeakPolarHBondContact O-CD 3.45Å; S98-K105 PolarHBondContact O-NZ 3.48Å
99	T	26.6	Very low	33.4	Very low	126 Å²	126	108.8 Å²	108.8	77%	0.773	61%	0.611	S	S	*	*			trans	-82.3	102.8	157.1	45	0	0	0	0	110.5
100	P	33.1	Very low	34	Very low	57 Å²	57	108.6 Å²	108.6	37%	0.37	61%	0.607	S	S	.	*			trans	-100.8	124.7	179.4	-2.1	28	0	0	0	109.9	S98 D102 K105	S98-P100 WeakPolarHBondContact O-CD 3.45Å; P100-D102 PolarHBondContact O-N 3.46Å; P100-K105 VanDerWaalsContact CD-CD 3.47Å; P100-K105 HydrophobicContact CG-CD 3.92Å; P100-K105 VanDerWaalsContact CG-CE 3.42Å; P100-K105 HydrophobicContact CG-CG 4.28Å
101	I	43.7	Very low	34.3	Very low	89 Å²	89	108.6 Å²	108.6	46%	0.456	60%	0.602	S	S	.	*			trans	4.5	105.6	172.4	-56.2	167.6	0	0	0	115.5	W103 L104 R465	I101-W103 VanDerWaalsContact C-N 3.34Å; I101-W103 PolarHBondContact O-N 3.03Å; I101-L104 PolarHBondContact O-N 2.72Å; I101-L104 VanDerWaalsContact O-N 3.08Å; I101-R465 HydrophobicContact CD1-CG 3.61Å
102	D	48.5	Very low	34.4	Very low	129 Å²	129	107.4 Å²	107.4	69%	0.69	59%	0.594	S	S	*	*	H	α-helix	trans	-47.1	-43.6	-162.4	-60.6	-34.1	0	0	0	115.5	P100 L104 K105 D106	P100-D102 PolarHBondContact O-N 3.46Å; D102-L104 PolarHBondContact O-N 2.9Å; D102-K105 PolarHBondContact O-N 3.3Å; D102-D106 PolarHBondContact O-N 3.48Å
103	W	43.1	Very low	34.5	Very low	86 Å²	86	107.3 Å²	107.3	33%	0.326	59%	0.593	S	S	.	*	H	α-helix	trans	-74.9	-22.1	-174.6	71.9	-86.3	0	0	0	115.2	I101 Y642 K643	I101-W103 VanDerWaalsContact C-N 3.34Å; I101-W103 PolarHBondContact O-N 3.03Å; W103-Y642 AromaticContact CE3-CD1 3.73Å; W103-Y642 HydrophobicContact CE3-CD1 3.73Å; W103-Y642 AromaticContact CE3-CE1 3.68Å; W103-Y642 HydrophobicContact CE3-CE1 3.68Å; W103-Y642 HydrophobicContact CH2-CD1 4.34Å; W103-Y642 AromaticContact CZ3-CD1 3.22Å; W103-Y642 HydrophobicContact CZ3-CD1 3.22Å; W103-Y642 AromaticContact CZ3-CE1 3.42Å; W103-Y642 HydrophobicContact CZ3-CE1 3.42Å; W103-Y642 VanDerWaalsContact CZ3-CE1 3.42Å; W103-Y642 HydrophobicContact CZ3-CG 4.1Å; W103-K643 HydrophobicContact CD2-CD 4.25Å; W103-K643 HydrophobicContact CD2-CG 4Å; W103-K643 HydrophobicContact CE3-CD 4.48Å; W103-K643 HydrophobicContact CE3-CG 3.74Å; W103-K643 HydrophobicContact CH2-CG 4.37Å; W103-K643 VanDerWaalsContact CZ2-CE 3.48Å; W103-K643 HydrophobicContact CZ3-CG 3.96Å
104	L	39.5	Very low	34.7	Very low	41 Å²	41	108.2 Å²	108.2	22%	0.215	59%	0.588	C	S	.	*	H	α-helix	trans	-87.6	-17.4	178.5	-139.9	111.7	0	0	0	111.6	I101 D102	I101-L104 PolarHBondContact O-N 2.72Å; I101-L104 VanDerWaalsContact O-N 3.08Å; D102-L104 PolarHBondContact O-N 2.9Å
105	K	39.2	Very low	34.8	Very low	63 Å²	63	109.6 Å²	109.6	27%	0.274	60%	0.598	S	S	.	*	H	α-helix	trans	-97.3	-19.9	178.3	-116.8	-145.8	-173.9	160.5	0	114.6	S98 P100 D102 A107 I108 I109	S98-K105 PolarHBondContact O-NZ 3.48Å; P100-K105 VanDerWaalsContact CD-CD 3.47Å; P100-K105 HydrophobicContact CG-CD 3.92Å; P100-K105 VanDerWaalsContact CG-CE 3.42Å; P100-K105 HydrophobicContact CG-CG 4.28Å; D102-K105 PolarHBondContact O-N 3.3Å; K105-A107 PolarHBondContact O-N 2.92Å; K105-I108 HydrophobicContact CG-CB 4.19Å; K105-I108 HydrophobicContact CG-CD1 3.89Å; K105-I108 HydrophobicContact CG-CG1 4.45Å; K105-I108 WeakPolarHBondContact O-CA 3.19Å; K105-I108 WeakPolarHBondContact O-CB 3.37Å; K105-I108 PolarHBondContact O-N 2.97Å; K105-I109 PolarHBondContact O-N 3.35Å
106	D	40.3	Very low	34.6	Very low	118 Å²	118	113.9 Å²	113.9	63%	0.631	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.5	-19.8	172.4	-76.4	-18.1	0	0	0	112.9	D102	D102-D106 PolarHBondContact O-N 3.48Å
107	A	39.9	Very low	34.5	Very low	30 Å²	30	113.5 Å²	113.5	25%	0.248	60%	0.598	C	S	.	*	T	Hydrogen-bonded Turn	trans	-79.4	-16.1	169.9	0	0	0	0	0	114	K105	K105-A107 PolarHBondContact O-N 2.92Å
108	I	37	Very low	34.5	Very low	103 Å²	103	112.3 Å²	112.3	53%	0.528	60%	0.601	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.9	-30.6	-171.1	-65.2	177.5	0	0	0	112.3	K105	K105-I108 HydrophobicContact CG-CB 4.19Å; K105-I108 HydrophobicContact CG-CD1 3.89Å; K105-I108 HydrophobicContact CG-CG1 4.45Å; K105-I108 WeakPolarHBondContact O-CA 3.19Å; K105-I108 WeakPolarHBondContact O-CB 3.37Å; K105-I108 PolarHBondContact O-N 2.97Å
109	I	35.2	Very low	34.2	Very low	119 Å²	119	117.4 Å²	117.4	61%	0.61	62%	0.621	S	S	*	*	S	Bend	trans	-86.2	-22	-173.2	-63.4	178.3	0	0	0	113.3	K105 I111	K105-I109 PolarHBondContact O-N 3.35Å; I109-I111 PolarHBondContact O-N 3.31Å
110	K	36.5	Very low	34	Very low	194 Å²	194	119.3 Å²	119.3	84%	0.843	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	3.7	-173.1	-89.1	-171	174.8	-174.4	0	117.1
111	I	33.2	Very low	33.6	Very low	122 Å²	122	125.6 Å²	125.6	63%	0.626	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.4	2.1	-171.3	-55	176.5	0	0	0	113.4	I109 D113	I109-I111 PolarHBondContact O-N 3.31Å; I111-D113 VanDerWaalsContact C-N 3.26Å; I111-D113 PolarHBondContact O-N 3.09Å
112	S	29.2	Very low	32.7	Very low	95 Å²	95	127.6 Å²	127.6	66%	0.664	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	-3.4	180	55	0	0	0	0	115.8
113	D	29.5	Very low	31.5	Very low	148 Å²	148	128.3 Å²	128.3	79%	0.791	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.6	30.2	-168.1	-67.6	-3.5	0	0	0	115.3	I111	I111-D113 VanDerWaalsContact C-N 3.26Å; I111-D113 PolarHBondContact O-N 3.09Å
114	T	28.3	Very low	30.7	Very low	119 Å²	119	130.9 Å²	130.9	73%	0.73	71%	0.705	S	S	*	*			trans	-121.1	104.7	168.3	47.5	0	0	0	0	111.9
115	S	28.1	Very low	30	Very low	121 Å²	121	132.6 Å²	132.6	85%	0.846	73%	0.732	S	S	*	*			trans	-63.7	149	178	50.5	0	0	0	0	112.8
116	F	26.7	Very low	29.4	Very low	205 Å²	205	133.2 Å²	133.2	90%	0.899	76%	0.756	S	S	*	*			trans	-108.8	37.6	-152.9	-150	-92	0	0	0	113.6
117	Q	25.2	Very low	28.7	Very low	171 Å²	171	133.2 Å²	133.2	80%	0.799	77%	0.766	S	S	*	*			trans	-117.3	-2.2	-160.1	-134.1	115.1	4.7	0	0	119.8
118	D	28.1	Very low	28.1	Very low	158 Å²	158	138.7 Å²	138.7	85%	0.845	80%	0.796	S	S	*	*	S	Bend	trans	-117.7	25.3	-169	-65.8	-21.7	0	0	0	117.3
119	I	27.5	Very low	27.5	Very low	172 Å²	172	143 Å²	143	88%	0.882	81%	0.814	S	S	*	*			trans	-132.9	45.5	179.4	-40.5	179.1	0	0	0	113.2
120	L	22.7	Very low	27.1	Very low	165 Å²	165	142.7 Å²	142.7	86%	0.864	82%	0.822	S	S	*	*			trans	-132.4	77.8	167.4	-94.8	164.7	0	0	0	108.8
121	E	23.6	Very low	26.5	Very low	189 Å²	189	141.5 Å²	141.5	88%	0.883	83%	0.825	S	S	*	*			trans	-176.5	106.4	156.5	-106.6	161.1	-149.8	0	0	109.5
122	C	24.7	Very low	26.5	Very low	132 Å²	132	140.9 Å²	140.9	89%	0.892	83%	0.829	S	S	*	*			trans	-177.1	82.2	152.4	-96.1	0	0	0	0	108.9
123	T	24.1	Very low	26.4	Very low	143 Å²	143	144.3 Å²	144.3	88%	0.877	84%	0.838	S	S	*	*			trans	-84.6	125.6	163.8	40.4	0	0	0	0	109.2
124	V	27.4	Very low	26.4	Very low	140 Å²	140	145.1 Å²	145.1	85%	0.848	84%	0.837	S	S	*	*			trans	-129	116.1	170.2	179.2	0	0	0	0	108.3
125	G	23.4	Very low	26.3	Very low	77 Å²	77	146.3 Å²	146.3	79%	0.794	84%	0.839	S	S	*	*			trans	-96.5	168.5	168.3	0	0	0	0	0	111.6
126	G	26	Very low	26.2	Very low	76 Å²	76	146.8 Å²	146.8	78%	0.784	84%	0.837	S	S	*	*			trans	150.9	89.5	171.2	0	0	0	0	0	113.2
127	S	26.1	Very low	26.4	Very low	119 Å²	119	147.2 Å²	147.2	83%	0.832	84%	0.839	S	S	*	*			trans	-65.9	139.8	169.3	45.5	0	0	0	0	112.5
128	V	27.5	Very low	26.8	Very low	145 Å²	145	141.8 Å²	141.8	88%	0.879	83%	0.828	S	S	*	*			trans	-134	125.8	164.1	178	0	0	0	0	108.7
129	E	24	Very low	26.9	Very low	192 Å²	192	142.3 Å²	142.3	90%	0.897	83%	0.831	S	S	*	*			trans	-78	142.4	-174.8	-68.5	174.1	151.8	0	0	112.5
130	S	26.6	Very low	27	Very low	113 Å²	113	141 Å²	141	79%	0.79	83%	0.825	S	S	*	*			trans	-95	139.4	178.1	52.8	0	0	0	0	111.4
131	N	25.5	Very low	27.3	Very low	169 Å²	169	138.1 Å²	138.1	90%	0.904	81%	0.81	S	S	*	*			trans	-118.1	144.4	164.3	-97.3	-27.6	0	0	0	111.7
132	P	33.4	Very low	27.7	Very low	109 Å²	109	135.3 Å²	135.3	71%	0.708	81%	0.806	S	S	*	*			trans	-112.7	143	-162.5	37	-23.2	0	0	0	113.4
133	I	26.8	Very low	27.8	Very low	167 Å²	167	139.4 Å²	139.4	86%	0.856	80%	0.804	S	S	*	*			trans	-144.3	117.5	160.4	-57.8	-177.7	0	0	0	111.1
134	H	27.9	Very low	28.3	Very low	166 Å²	166	139 Å²	139	77%	0.769	79%	0.792	S	S	*	*			trans	14.3	123.1	156.4	-74.2	-92.4	0	0	0	120.7
135	N	26.2	Very low	28.6	Very low	144 Å²	144	140.6 Å²	140.6	77%	0.77	78%	0.783	S	S	*	*				66.1	101.8	64.8	-79.5	-9.3	0	0	0	115.7
136	T	27.4	Very low	29.3	Very low	131 Å²	131	139.4 Å²	139.4	80%	0.804	77%	0.771	S	S	*	*				-176.4	155.4	128.8	16.8	0	0	0	0	109
137	F	30	Very low	30.7	Very low	214 Å²	214	140.9 Å²	140.9	94%	0.939	76%	0.761	S	S	*	*			trans	123	70.7	173.6	-70	-68.5	0	0	0	113.7
138	G	33.5	Very low	32.4	Very low	56 Å²	56	138.9 Å²	138.9	58%	0.577	74%	0.744	S	S	*	*			trans	-103.4	122	155.9	0	0	0	0	0	108.1
139	D	30.7	Very low	34.7	Very low	169 Å²	169	134.7 Å²	134.7	90%	0.904	71%	0.713	S	S	*	*			trans	-169.1	14.7	154.1	-91.7	-20.9	0	0	0	114.3
140	L	29.4	Very low	37.1	Very low	145 Å²	145	129.1 Å²	129.1	76%	0.759	69%	0.685	S	S	*	*			trans	-107.1	31.5	-178.6	-88.9	155.8	0	0	0	114.7	T142	L140-T142 PolarHBondContact O-N 3.1Å
141	L	29.7	Very low	39.4	Very low	105 Å²	105	129.7 Å²	129.7	55%	0.55	68%	0.675	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.8	15.4	-160.4	-87.8	169	0	0	0	118.8	R145	L141-R145 PolarHBondContact O-NE 2.62Å
142	T	31.7	Very low	42	Very low	129 Å²	129	124.7 Å²	124.7	79%	0.791	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.3	-36.3	179.6	41.5	0	0	0	0	115.1	L140	L140-T142 PolarHBondContact O-N 3.1Å
143	Y	26.9	Very low	44.4	Very low	219 Å²	219	119.9 Å²	119.9	86%	0.859	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85	-30.5	-178.1	-130.5	-92.4	0	0	0	113.9	R145 G146	Y143-R145 PolarHBondContact O-N 2.92Å; Y143-R145 VanDerWaalsContact O-N 3.17Å; Y143-G146 PolarHBondContact O-N 3Å
144	E	35.1	Very low	46.9	Very low	134 Å²	134	113.1 Å²	113.1	63%	0.626	58%	0.582	S	S	*	*	H	α-helix	trans	-66.4	-18.1	179.1	-69.4	-168.1	152.9	0	0	113.9	G146 T148	E144-G146 VanDerWaalsContact C-N 3.34Å; E144-G146 PolarHBondContact O-N 2.96Å; E144-T148 WeakPolarHBondContact O-CG2 3.41Å; E144-T148 PolarHBondContact O-N 3.25Å; E144-T148 PolarHBondContact O-OG1 3.5Å
145	R	32.9	Very low	49.1	Very low	173 Å²	173	106.7 Å²	106.7	65%	0.653	56%	0.561	S	S	*	*	H	α-helix	trans	-69.9	-27.4	-178.1	-73.2	-175.6	179.4	-177.5	1.9	113.7	L141 Y143 T148	L141-R145 PolarHBondContact O-NE 2.62Å; Y143-R145 PolarHBondContact O-N 2.92Å; Y143-R145 VanDerWaalsContact O-N 3.17Å; R145-T148 PolarHBondContact O-OG1 3.47Å; R145-T148 VanDerWaalsContact O-OG1 3.06Å
146	G	38.9	Very low	51.8	Low	52 Å²	52	99.9 Å²	99.9	54%	0.536	52%	0.524	S	S	.	.	H	α-helix	trans	-70.8	-46.8	-180	0	0	0	0	0	112.9	Y143 E144 Y149 K150	Y143-G146 PolarHBondContact O-N 3Å; E144-G146 VanDerWaalsContact C-N 3.34Å; E144-G146 PolarHBondContact O-N 2.96Å; G146-Y149 PolarHBondContact O-N 3.49Å; G146-K150 PolarHBondContact O-N 2.67Å
147	D	53.9	Low	54.3	Low	107 Å²	107	93.9 Å²	93.9	57%	0.572	49%	0.487	S	S	*	.	H	α-helix	trans	-70.3	-37.8	-176.1	-88.6	-17.2	0	0	0	112.9	Y149 K150 Q151	D147-Y149 PolarHBondContact O-N 2.8Å; D147-K150 PolarHBondContact O-N 3.37Å; D147-Q151 VanDerWaalsContact O-CG 3.26Å; D147-Q151 WeakPolarHBondContact O-CG 3.49Å; D147-Q151 PolarHBondContact O-N 3.44Å; D147-Q151 VanDerWaalsContact O-N 3.1Å
148	T	63.1	Low	56.2	Low	78 Å²	78	85.9 Å²	85.9	48%	0.479	46%	0.458	S	S	.	.	H	α-helix	trans	-59.5	-37.6	177.2	50.9	0	0	0	0	111.6	E144 R145 Q151 L152	E144-T148 WeakPolarHBondContact O-CG2 3.41Å; E144-T148 PolarHBondContact O-N 3.25Å; E144-T148 PolarHBondContact O-OG1 3.5Å; R145-T148 PolarHBondContact O-OG1 3.47Å; R145-T148 VanDerWaalsContact O-OG1 3.06Å; T148-Q151 PolarHBondContact O-N 3.02Å; T148-L152 WeakPolarHBondContact O-CG 3.38Å; T148-L152 PolarHBondContact O-N 3.09Å
149	Y	74.9	Confident	58.1	Low	57 Å²	57	83.7 Å²	83.7	22%	0.224	43%	0.434	C	S	.	.	H	α-helix	trans	-73.8	-42.3	-176.3	-173.3	-125.9	0	0	0	113.7	G146 D147 Q151 L152 K153 K187 D188	G146-Y149 PolarHBondContact O-N 3.49Å; D147-Y149 PolarHBondContact O-N 2.8Å; Y149-Q151 VanDerWaalsContact C-N 3.26Å; Y149-Q151 PolarHBondContact O-N 3.07Å; Y149-L152 HydrophobicContact CD2-CD1 4.34Å; Y149-L152 WeakPolarHBondContact O-CB 3.24Å; Y149-L152 PolarHBondContact O-N 3.24Å; Y149-L152 VanDerWaalsContact O-N 3.17Å; Y149-K153 HydrophobicContact CE1-CD 4.33Å; Y149-K153 HydrophobicContact CE2-CG 4.41Å; Y149-K153 PolarHBondContact O-N 3.09Å; Y149-K153 WeakPolarHBondContact OH-CE 3.31Å; Y149-K187 HydrophobicContact CD2-CB 3.6Å; Y149-K187 HydrophobicContact CD2-CG 3.87Å; Y149-K187 HydrophobicContact CE2-CB 3.19Å; Y149-K187 HydrophobicContact CE2-CG 3.91Å; Y149-D188 HydrophobicContact CE1-CB 4.39Å; Y149-D188 WeakPolarHBondContact OH-CB 3.26Å; Y149-D188 PolarHBondContact OH-N 2.95Å
150	K	75.4	Confident	60.1	Low	74 Å²	74	75.8 Å²	75.8	32%	0.322	39%	0.391	S	S	.	.	H	α-helix	trans	-56	-43.7	171.8	-177.2	-179.1	176.6	-175.6	0	110.9	G146 D147 L152 K153 L154 D736 L739	G146-K150 PolarHBondContact O-N 2.67Å; D147-K150 PolarHBondContact O-N 3.37Å; K150-L152 VanDerWaalsContact C-N 3.33Å; K150-L152 PolarHBondContact O-N 3.5Å; K150-K153 PolarHBondContact O-N 3.49Å; K150-L154 HydrophobicContact CG-CD1 4.11Å; K150-L154 WeakPolarHBondContact O-CG 3.4Å; K150-L154 PolarHBondContact O-N 3.16Å; K150-D736 VanDerWaalsContact CE-CG 3.43Å; K150-D736 WeakPolarHBondContact CE-OD1 3.25Å; K150-D736 IonicContact NZ-OD1 3.05Å; K150-D736 PolarHBondContact NZ-OD1 3.48Å; K150-D736 IonicContact NZ-OD2 2.7Å; K150-D736 PolarHBondContact NZ-OD2 3.5Å; K150-L739 HydrophobicContact CG-CD2 3.98Å
151	Q	74.6	Confident	61.8	Low	125 Å²	125	68.9 Å²	68.9	58%	0.584	36%	0.355	S	S	*	.	H	α-helix	trans	-61.4	-37.3	177.4	-72.6	174.3	9.7	0	0	112.9	D147 T148 Y149 L154 G155	D147-Q151 VanDerWaalsContact O-CG 3.26Å; D147-Q151 WeakPolarHBondContact O-CG 3.49Å; D147-Q151 PolarHBondContact O-N 3.44Å; D147-Q151 VanDerWaalsContact O-N 3.1Å; T148-Q151 PolarHBondContact O-N 3.02Å; Y149-Q151 VanDerWaalsContact C-N 3.26Å; Y149-Q151 PolarHBondContact O-N 3.07Å; Q151-L154 PolarHBondContact O-N 3.49Å; Q151-G155 PolarHBondContact O-N 3.37Å
152	L	80.3	Confident	63.4	Low	64 Å²	64	65.2 Å²	65.2	34%	0.335	34%	0.339	S	S	.	.	H	α-helix	trans	-63	-46.8	175.4	-67.3	178	0	0	0	111.9	T148 Y149 K150 L154 G155 L156 A183 C184	T148-L152 WeakPolarHBondContact O-CG 3.38Å; T148-L152 PolarHBondContact O-N 3.09Å; Y149-L152 HydrophobicContact CD2-CD1 4.34Å; Y149-L152 WeakPolarHBondContact O-CB 3.24Å; Y149-L152 PolarHBondContact O-N 3.24Å; Y149-L152 VanDerWaalsContact O-N 3.17Å; K150-L152 VanDerWaalsContact C-N 3.33Å; K150-L152 PolarHBondContact O-N 3.5Å; L152-L154 PolarHBondContact O-N 2.82Å; L152-G155 PolarHBondContact O-N 3.32Å; L152-L156 PolarHBondContact O-N 3.47Å; L152-A183 HydrophobicContact CD1-CB 4.18Å; L152-A183 HydrophobicContact CD2-CB 3.61Å; L152-A183 HydrophobicContact CG-CB 4.4Å; L152-C184 PolarHBondContact O-SG 3.48Å
153	K	84	Confident	64.7	Low	9 Å²	9	59.3 Å²	59.3	4%	0.039	30%	0.302	C	S	.	.	H	α-helix	trans	-61.5	-44.8	177.3	-68.5	-168.1	178.5	179.4	0	111.7	Y149 K150 G155 L156 I157 D188 F191 L739 E743	Y149-K153 HydrophobicContact CE1-CD 4.33Å; Y149-K153 HydrophobicContact CE2-CG 4.41Å; Y149-K153 PolarHBondContact O-N 3.09Å; Y149-K153 WeakPolarHBondContact OH-CE 3.31Å; K150-K153 PolarHBondContact O-N 3.49Å; K153-G155 VanDerWaalsContact C-N 3.34Å; K153-G155 PolarHBondContact O-N 2.91Å; K153-L156 PolarHBondContact O-N 3.03Å; K153-I157 VanDerWaalsContact O-CG1 3.32Å; K153-I157 WeakPolarHBondContact O-CG1 3.42Å; K153-I157 PolarHBondContact O-N 3.41Å; K153-D188 WeakPolarHBondContact CE-OD2 3.48Å; K153-D188 IonicContact NZ-OD2 3.58Å; K153-D188 PolarHBondContact NZ-OD2 3.22Å; K153-F191 HydrophobicContact CB-CD1 4.29Å; K153-F191 HydrophobicContact CB-CE1 3.65Å; K153-F191 HydrophobicContact CB-CZ 3.8Å; K153-F191 HydrophobicContact CD-CD1 4.05Å; K153-F191 HydrophobicContact CD-CD2 3.84Å; K153-F191 HydrophobicContact CD-CE1 4.02Å; K153-F191 HydrophobicContact CD-CE2 3.81Å; K153-F191 HydrophobicContact CD-CG 3.96Å; K153-F191 HydrophobicContact CD-CZ 3.91Å; K153-F191 HydrophobicContact CG-CD1 3.83Å; K153-F191 HydrophobicContact CG-CE1 3.71Å; K153-F191 HydrophobicContact CG-CE2 4.42Å; K153-F191 HydrophobicContact CG-CG 4.24Å; K153-F191 HydrophobicContact CG-CZ 4.02Å; K153-L739 HydrophobicContact CB-CD1 3.59Å; K153-L739 HydrophobicContact CB-CD2 4.38Å; K153-L739 HydrophobicContact CD-CD1 3.68Å; K153-L739 HydrophobicContact CG-CD1 4.28Å; K153-E743 IonicContact NZ-OE1 2.8Å; K153-E743 PolarHBondContact NZ-OE1 2.92Å; K153-E743 IonicContact NZ-OE2 2.72Å
154	L	78.8	Confident	65.8	Low	24 Å²	24	49.9 Å²	49.9	13%	0.126	27%	0.266	C	S	.	.	H	α-helix	trans	-62.6	-40.4	176.2	-69.6	177.8	0	0	0	111.9	K150 Q151 L152 L156 I157 S158 E735 L739	K150-L154 HydrophobicContact CG-CD1 4.11Å; K150-L154 WeakPolarHBondContact O-CG 3.4Å; K150-L154 PolarHBondContact O-N 3.16Å; Q151-L154 PolarHBondContact O-N 3.49Å; L152-L154 PolarHBondContact O-N 2.82Å; L154-L156 PolarHBondContact O-N 3.43Å; L154-I157 HydrophobicContact CD2-CD1 4.28Å; L154-I157 PolarHBondContact O-N 3Å; L154-S158 WeakPolarHBondContact O-CB 3.4Å; L154-S158 PolarHBondContact O-N 3.41Å; L154-E735 HydrophobicContact CD1-CB 4.33Å; L154-E735 HydrophobicContact CD2-CB 3.76Å; L154-E735 HydrophobicContact CD2-CG 4.47Å; L154-L739 HydrophobicContact CD2-CB 4.02Å; L154-L739 HydrophobicContact CD2-CD2 4.31Å; L154-L739 HydrophobicContact CG-CD2 4.41Å
155	G	74.3	Confident	66.3	Low	32 Å²	32	45 Å²	45	33%	0.33	25%	0.246	S	C	.	.	H	α-helix	trans	-58.1	-44.5	173.1	0	0	0	0	0	112.6	Q151 L152 K153 S158 C159	Q151-G155 PolarHBondContact O-N 3.37Å; L152-G155 PolarHBondContact O-N 3.32Å; K153-G155 VanDerWaalsContact C-N 3.34Å; K153-G155 PolarHBondContact O-N 2.91Å; G155-S158 PolarHBondContact O-N 3.27Å; G155-C159 WeakPolarHBondContact O-CB 3.48Å; G155-C159 PolarHBondContact O-N 3.06Å
156	L	82.2	Confident	66.7	Low	0 Å²	0	40.6 Å²	40.6	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-63.9	-44.7	175	179.1	61.2	0	0	0	112.2	L152 K153 L154 S158 C159 I160 L177 I181 C184 F191 I192	L152-L156 PolarHBondContact O-N 3.47Å; K153-L156 PolarHBondContact O-N 3.03Å; L154-L156 PolarHBondContact O-N 3.43Å; L156-S158 VanDerWaalsContact C-N 3.32Å; L156-S158 PolarHBondContact O-N 3.29Å; L156-C159 PolarHBondContact O-N 3.2Å; L156-I160 HydrophobicContact CD1-CD1 4.01Å; L156-I160 HydrophobicContact CD1-CG1 4.25Å; L156-I160 HydrophobicContact CG-CD1 3.91Å; L156-I160 WeakPolarHBondContact O-CB 3.33Å; L156-I160 VanDerWaalsContact O-CG1 3.31Å; L156-I160 WeakPolarHBondContact O-CG1 3.32Å; L156-I160 PolarHBondContact O-N 3.21Å; L156-L177 HydrophobicContact CD1-CD1 3.81Å; L156-I181 HydrophobicContact CD1-CG1 3.68Å; L156-C184 HydrophobicContact CD2-CB 4.23Å; L156-F191 HydrophobicContact CD2-CD1 4.15Å; L156-F191 HydrophobicContact CD2-CE1 4.12Å; L156-I192 HydrophobicContact CD2-CD1 3.47Å; L156-I192 VanDerWaalsContact CD2-CD1 3.47Å
157	I	79.3	Confident	67.1	Low	5 Å²	5	41.5 Å²	41.5	3%	0.026	25%	0.245	C	C	.	.	H	α-helix	trans	-60	-44.1	177	-67.3	164.8	0	0	0	110.7	K153 L154 I160 S161 F191 L738 L739 I742	K153-I157 VanDerWaalsContact O-CG1 3.32Å; K153-I157 WeakPolarHBondContact O-CG1 3.42Å; K153-I157 PolarHBondContact O-N 3.41Å; L154-I157 HydrophobicContact CD2-CD1 4.28Å; L154-I157 PolarHBondContact O-N 3Å; I157-I160 PolarHBondContact O-N 2.83Å; I157-S161 WeakPolarHBondContact O-CB 3.18Å; I157-S161 PolarHBondContact O-N 2.91Å; I157-S161 PolarHBondContact O-OG 3.19Å; I157-F191 HydrophobicContact CD1-CZ 3.97Å; I157-F191 HydrophobicContact CG1-CZ 4.13Å; I157-L738 HydrophobicContact CG2-CD2 3.59Å; I157-L738 HydrophobicContact CG2-CG 4.21Å; I157-L739 HydrophobicContact CD1-CB 4.19Å; I157-L739 HydrophobicContact CD1-CD1 3.69Å; I157-I742 HydrophobicContact CD1-CD1 3.67Å; I157-I742 HydrophobicContact CG1-CD1 3.63Å; I157-I742 HydrophobicContact CG2-CD1 4.12Å
158	S	71.3	Confident	66.9	Low	47 Å²	47	37.5 Å²	37.5	33%	0.329	23%	0.229	S	C	.	.	H	α-helix	trans	-61.6	-45.3	176.9	-177.1	0	0	0	0	111.4	L154 G155 L156 I160 S161 S162	L154-S158 WeakPolarHBondContact O-CB 3.4Å; L154-S158 PolarHBondContact O-N 3.41Å; G155-S158 PolarHBondContact O-N 3.27Å; L156-S158 VanDerWaalsContact C-N 3.32Å; L156-S158 PolarHBondContact O-N 3.29Å; S158-I160 PolarHBondContact O-N 3.29Å; S158-S161 PolarHBondContact O-N 3.35Å; S158-S162 PolarHBondContact O-N 3.02Å; S158-S162 PolarHBondContact O-OG 3.29Å
159	C	72.1	Confident	66.6	Low	10 Å²	10	34.2 Å²	34.2	7%	0.068	21%	0.209	C	C	.	.	H	α-helix	trans	-65.3	-37.5	177.6	-165.5	0	0	0	0	113	G155 L156 S162 S163 L177	G155-C159 WeakPolarHBondContact O-CB 3.48Å; G155-C159 PolarHBondContact O-N 3.06Å; L156-C159 PolarHBondContact O-N 3.2Å; C159-S162 PolarHBondContact O-OG 3.2Å; C159-S163 PolarHBondContact O-N 3.42Å; C159-S163 PolarHBondContact O-OG 3.2Å; C159-L177 HydrophobicContact CB-CD1 4.13Å; C159-L177 WeakPolarHBondContact SG-CA 3.4Å; C159-L177 PolarHBondContact SG-N 2.83Å
160	I	74	Confident	65.9	Low	2 Å²	2	33.2 Å²	33.2	1%	0.01	21%	0.21	C	C	.	.	H	α-helix	trans	-64.9	-45.2	174	-76.3	170.9	0	0	0	110.8	L156 I157 S158 S162 S163 L177 A195 C199 L203 T208 L212	L156-I160 HydrophobicContact CD1-CD1 4.01Å; L156-I160 HydrophobicContact CD1-CG1 4.25Å; L156-I160 HydrophobicContact CG-CD1 3.91Å; L156-I160 WeakPolarHBondContact O-CB 3.33Å; L156-I160 VanDerWaalsContact O-CG1 3.31Å; L156-I160 WeakPolarHBondContact O-CG1 3.32Å; L156-I160 PolarHBondContact O-N 3.21Å; I157-I160 PolarHBondContact O-N 2.83Å; S158-I160 PolarHBondContact O-N 3.29Å; I160-S162 PolarHBondContact O-N 2.81Å; I160-S163 VanDerWaalsContact O-CB 3.24Å; I160-S163 WeakPolarHBondContact O-CB 3.19Å; I160-S163 PolarHBondContact O-N 2.85Å; I160-L177 HydrophobicContact CG1-CD1 3.84Å; I160-A195 HydrophobicContact CD1-CB 3.73Å; I160-C199 WeakPolarHBondContact CG2-SG 3.44Å; I160-L203 HydrophobicContact CG2-CD1 4.36Å; I160-T208 HydrophobicContact CG1-CG2 4.42Å; I160-L212 HydrophobicContact CD1-CD1 3.92Å; I160-L212 HydrophobicContact CG1-CD1 4.45Å
161	S	65.3	Low	65.4	Low	0 Å²	0	35.9 Å²	35.9	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-66.7	-38.4	-176.9	-57.3	0	0	0	0	111.4	I157 S158 S163 I164 Y729	I157-S161 WeakPolarHBondContact O-CB 3.18Å; I157-S161 PolarHBondContact O-N 2.91Å; I157-S161 PolarHBondContact O-OG 3.19Å; S158-S161 PolarHBondContact O-N 3.35Å; S161-S163 PolarHBondContact O-N 3.37Å; S161-I164 WeakPolarHBondContact O-CB 3.35Å; S161-I164 VanDerWaalsContact O-CD1 3.23Å; S161-I164 WeakPolarHBondContact O-CD1 3.01Å; S161-I164 WeakPolarHBondContact O-CG1 3.43Å; S161-I164 PolarHBondContact O-N 3.11Å; S161-Y729 WeakPolarHBondContact OG-CE2 3.46Å
162	S	61.5	Low	65	Low	29 Å²	29	36.5 Å²	36.5	20%	0.203	23%	0.225	C	C	.	.	H	α-helix	trans	-68.3	-14.1	173.5	68.7	0	0	0	0	113.9	S158 C159 I160 I164 K173	S158-S162 PolarHBondContact O-N 3.02Å; S158-S162 PolarHBondContact O-OG 3.29Å; C159-S162 PolarHBondContact O-OG 3.2Å; I160-S162 PolarHBondContact O-N 2.81Å; S162-I164 VanDerWaalsContact C-N 3.35Å; S162-K173 PolarHBondContact O-NZ 3.32Å
163	S	59.2	Low	64.3	Low	4 Å²	4	34.8 Å²	34.8	3%	0.028	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-7.9	176.5	-60.5	0	0	0	0	114	C159 I160 S161 V165	C159-S163 PolarHBondContact O-N 3.42Å; C159-S163 PolarHBondContact O-OG 3.2Å; I160-S163 VanDerWaalsContact O-CB 3.24Å; I160-S163 WeakPolarHBondContact O-CB 3.19Å; I160-S163 PolarHBondContact O-N 2.85Å; S161-S163 PolarHBondContact O-N 3.37Å; S163-V165 PolarHBondContact O-N 3.07Å
164	I	51.8	Low	63.7	Low	21 Å²	21	36.3 Å²	36.3	11%	0.108	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-19.3	-178	-73.6	168.6	0	0	0	113.5	S161 S162 L203 I205 F719 T723 Q725	S161-I164 WeakPolarHBondContact O-CB 3.35Å; S161-I164 VanDerWaalsContact O-CD1 3.23Å; S161-I164 WeakPolarHBondContact O-CD1 3.01Å; S161-I164 WeakPolarHBondContact O-CG1 3.43Å; S161-I164 PolarHBondContact O-N 3.11Å; S162-I164 VanDerWaalsContact C-N 3.35Å; I164-L203 HydrophobicContact CD1-CD1 4.21Å; I164-L203 HydrophobicContact CD1-CD2 4.33Å; I164-I205 HydrophobicContact CB-CD1 4.43Å; I164-I205 HydrophobicContact CD1-CD1 4.4Å; I164-I205 HydrophobicContact CG1-CD1 3.41Å; I164-I205 VanDerWaalsContact CG1-CD1 3.41Å; I164-I205 HydrophobicContact CG1-CG1 4.19Å; I164-F719 HydrophobicContact CD1-CE1 4.15Å; I164-T723 HydrophobicContact CG2-CG2 3.69Å; I164-Q725 HydrophobicContact CG2-CB 4.46Å
165	V	44.4	Very low	63.2	Low	33 Å²	33	37.9 Å²	37.9	20%	0.2	23%	0.229	C	C	.	.	S	Bend	trans	-98	-40.5	-157.8	-178	0	0	0	0	114.4	S163 G167 K720	S163-V165 PolarHBondContact O-N 3.07Å; V165-G167 VanDerWaalsContact C-N 3.29Å; V165-G167 PolarHBondContact O-N 2.82Å; V165-K720 HydrophobicContact CB-CB 4.15Å; V165-K720 WeakPolarHBondContact CB-O 3.48Å; V165-K720 HydrophobicContact CG1-CB 3.73Å; V165-K720 WeakPolarHBondContact CG1-O 3.31Å; V165-K720 HydrophobicContact CG2-CB 4.1Å; V165-K720 WeakPolarHBondContact CG2-O 3.44Å
166	D	41.6	Very low	63	Low	80 Å²	80	40.5 Å²	40.5	43%	0.428	23%	0.234	S	C	.	.	S	Bend	trans	-87.9	7.5	-161.9	-69	-43.5	0	0	0	113.7	G168 K173	D166-G168 WeakPolarHBondContact CB-O 3.41Å; D166-G168 PolarHBondContact O-N 3.36Å; D166-K173 IonicContact OD2-NZ 3.32Å; D166-K173 PolarHBondContact OD2-NZ 3.37Å
167	G	47.4	Very low	62.7	Low	71 Å²	71	40.5 Å²	40.5	73%	0.732	23%	0.234	S	C	*	.	S	Bend	trans	65.3	-15.2	-169.4	0	0	0	0	0	114	V165	V165-G167 VanDerWaalsContact C-N 3.29Å; V165-G167 PolarHBondContact O-N 2.82Å
168	G	50.6	Low	62.6	Low	23 Å²	23	40.4 Å²	40.4	24%	0.237	24%	0.235	C	C	.	.	S	Bend	trans	-171	152.2	165.4	0	0	0	0	0	109.5	D166 S170	D166-G168 WeakPolarHBondContact CB-O 3.41Å; D166-G168 PolarHBondContact O-N 3.36Å; G168-S170 PolarHBondContact O-N 2.93Å
169	P	55.6	Low	62.9	Low	8 Å²	8	43.2 Å²	43.2	5%	0.052	24%	0.243	C	C	.	.			trans	-60.6	134	-175	23.1	-32.3	0	0	0	111.6	K173 K174 M211	P169-K173 HydrophobicContact CB-CB 4.04Å; P169-K174 HydrophobicContact CB-CG 3.87Å; P169-K174 HydrophobicContact CG-CG 3.75Å; P169-K174 WeakPolarHBondContact O-CE 3.44Å; P169-M211 HydrophobicContact CG-SD 4.14Å
170	S	60.4	Low	63.2	Low	36 Å²	36	44 Å²	44	25%	0.252	25%	0.248	S	C	.	.			trans	-57.6	167.2	172.6	76.1	0	0	0	0	111.3	G168 E172 K173 K174	G168-S170 PolarHBondContact O-N 2.93Å; S170-E172 VanDerWaalsContact C-N 3.33Å; S170-E172 PolarHBondContact O-N 3.07Å; S170-E172 PolarHBondContact OG-OE2 3.18Å; S170-K173 PolarHBondContact O-N 3.25Å; S170-K173 WeakPolarHBondContact OG-CB 3.44Å; S170-K173 WeakPolarHBondContact OG-CG 3.42Å; S170-K173 PolarHBondContact OG-N 2.8Å; S170-K173 VanDerWaalsContact OG-N 3.16Å; S170-K174 WeakPolarHBondContact O-CG 3.42Å; S170-K174 PolarHBondContact O-N 3.07Å
171	K	65.3	Low	63.6	Low	131 Å²	131	44 Å²	44	57%	0.57	25%	0.248	S	C	*	.	H	α-helix	trans	-57	-46.4	177.4	-74.9	-174.5	178.8	177.8	0	111.6	K174 I175	K171-K174 PolarHBondContact O-N 3.13Å; K171-I175 PolarHBondContact O-N 2.81Å
172	E	64.6	Low	64.2	Low	138 Å²	138	47.1 Å²	47.1	65%	0.645	26%	0.263	S	S	*	.	H	α-helix	trans	-64.1	-45	177	-55	102	-169.5	0	0	111.4	S170 K174 I175 I176	S170-E172 VanDerWaalsContact C-N 3.33Å; S170-E172 PolarHBondContact O-N 3.07Å; S170-E172 PolarHBondContact OG-OE2 3.18Å; E172-K174 VanDerWaalsContact C-N 3.27Å; E172-K174 PolarHBondContact O-N 3.36Å; E172-I175 WeakPolarHBondContact O-CB 3.21Å; E172-I175 PolarHBondContact O-N 3.02Å; E172-I176 WeakPolarHBondContact O-CG1 3.28Å; E172-I176 PolarHBondContact O-N 2.99Å
173	K	65.7	Low	65	Low	27 Å²	27	47.3 Å²	47.3	12%	0.117	27%	0.266	C	S	.	.	H	α-helix	trans	-61.8	-33.6	179.7	-76.9	-177.9	-178.1	173.1	0	112.9	S162 D166 P169 S170 I175 L177	S162-K173 PolarHBondContact O-NZ 3.32Å; D166-K173 IonicContact OD2-NZ 3.32Å; D166-K173 PolarHBondContact OD2-NZ 3.37Å; P169-K173 HydrophobicContact CB-CB 4.04Å; S170-K173 PolarHBondContact O-N 3.25Å; S170-K173 WeakPolarHBondContact OG-CB 3.44Å; S170-K173 WeakPolarHBondContact OG-CG 3.42Å; S170-K173 PolarHBondContact OG-N 2.8Å; S170-K173 VanDerWaalsContact OG-N 3.16Å; K173-I175 VanDerWaalsContact C-N 3.29Å; K173-I175 PolarHBondContact O-N 2.96Å; K173-L177 WeakPolarHBondContact O-CB 3.46Å; K173-L177 PolarHBondContact O-N 2.92Å
174	K	71.4	Confident	66.2	Low	42 Å²	42	47.1 Å²	47.1	18%	0.183	27%	0.265	C	S	.	.	H	α-helix	trans	-64.4	-35.8	174.7	-74.5	177.2	-176.7	178.7	0	112.3	P169 S170 K171 E172 G178 M211 L318	P169-K174 HydrophobicContact CB-CG 3.87Å; P169-K174 HydrophobicContact CG-CG 3.75Å; P169-K174 WeakPolarHBondContact O-CE 3.44Å; S170-K174 WeakPolarHBondContact O-CG 3.42Å; S170-K174 PolarHBondContact O-N 3.07Å; K171-K174 PolarHBondContact O-N 3.13Å; E172-K174 VanDerWaalsContact C-N 3.27Å; E172-K174 PolarHBondContact O-N 3.36Å; K174-G178 PolarHBondContact O-N 3.18Å; K174-M211 HydrophobicContact CB-CE 4.44Å; K174-M211 HydrophobicContact CG-CE 4.35Å; K174-M211 HydrophobicContact CG-SD 4.46Å; K174-L318 WeakPolarHBondContact CD-O 3.25Å; K174-L318 PolarHBondContact NZ-O 3.33Å; K174-L318 VanDerWaalsContact NZ-O 3.15Å
175	I	70.1	Confident	67.6	Low	57 Å²	57	46.3 Å²	46.3	29%	0.292	26%	0.26	S	S	.	.	H	α-helix	trans	-68.5	-52.7	177.3	-63	169	0	0	0	108.8	K171 E172 K173 L177 G178 Q179 A319	K171-I175 PolarHBondContact O-N 2.81Å; E172-I175 WeakPolarHBondContact O-CB 3.21Å; E172-I175 PolarHBondContact O-N 3.02Å; K173-I175 VanDerWaalsContact C-N 3.29Å; K173-I175 PolarHBondContact O-N 2.96Å; I175-L177 PolarHBondContact O-N 3.27Å; I175-G178 PolarHBondContact O-N 3.11Å; I175-G178 VanDerWaalsContact O-N 3.15Å; I175-Q179 WeakPolarHBondContact O-CG 3.36Å; I175-Q179 PolarHBondContact O-N 3.48Å; I175-A319 HydrophobicContact CD1-CB 4.15Å; I175-A319 HydrophobicContact CG1-CB 3.92Å
176	I	70.2	Confident	69.1	Low	86 Å²	86	47.9 Å²	47.9	44%	0.441	27%	0.268	S	S	.	.	H	α-helix	trans	-58.7	-50.5	179.2	-61.1	169.3	0	0	0	110.8	E172 G178 Q179 S180	E172-I176 WeakPolarHBondContact O-CG1 3.28Å; E172-I176 PolarHBondContact O-N 2.99Å; I176-G178 PolarHBondContact O-N 3.23Å; I176-Q179 PolarHBondContact O-N 3.34Å; I176-S180 PolarHBondContact O-N 2.91Å; I176-S180 PolarHBondContact O-OG 3.01Å; I176-S180 VanDerWaalsContact O-OG 3.13Å
177	L	76	Confident	70.9	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-57.8	-40.5	178.9	179.7	63	0	0	0	111.1	L156 C159 I160 K173 I175 S180 I181 T208 M211	L156-L177 HydrophobicContact CD1-CD1 3.81Å; C159-L177 HydrophobicContact CB-CD1 4.13Å; C159-L177 WeakPolarHBondContact SG-CA 3.4Å; C159-L177 PolarHBondContact SG-N 2.83Å; I160-L177 HydrophobicContact CG1-CD1 3.84Å; K173-L177 WeakPolarHBondContact O-CB 3.46Å; K173-L177 PolarHBondContact O-N 2.92Å; I175-L177 PolarHBondContact O-N 3.27Å; L177-S180 PolarHBondContact O-N 3.47Å; L177-I181 HydrophobicContact CD1-CD1 4.35Å; L177-I181 HydrophobicContact CG-CD1 3.91Å; L177-I181 WeakPolarHBondContact O-CD1 3.37Å; L177-I181 WeakPolarHBondContact O-CG1 3.36Å; L177-I181 PolarHBondContact O-N 3.38Å; L177-T208 HydrophobicContact CD2-CG2 4.04Å; L177-M211 HydrophobicContact CD2-CE 4.15Å; L177-M211 HydrophobicContact CD2-SD 4.26Å
178	G	76.6	Confident	72.6	Confident	4 Å²	4	49 Å²	49	4%	0.041	25%	0.25	C	S	.	.	H	α-helix	trans	-71.4	-36.5	179.5	0	0	0	0	0	114.5	K174 I175 I176 I181 H182	K174-G178 PolarHBondContact O-N 3.18Å; I175-G178 PolarHBondContact O-N 3.11Å; I175-G178 VanDerWaalsContact O-N 3.15Å; I176-G178 PolarHBondContact O-N 3.23Å; G178-I181 PolarHBondContact O-N 3.4Å; G178-H182 PolarHBondContact O-N 3.03Å
179	Q	76.6	Confident	74.3	Confident	106 Å²	106	48.8 Å²	48.8	50%	0.495	24%	0.244	S	C	.	.	H	α-helix	trans	-62.4	-44.3	170	-72.4	173.1	-25	0	0	110.8	I175 I176 H182 A183 L315	I175-Q179 WeakPolarHBondContact O-CG 3.36Å; I175-Q179 PolarHBondContact O-N 3.48Å; I176-Q179 PolarHBondContact O-N 3.34Å; Q179-H182 WeakPolarHBondContact O-CB 3.3Å; Q179-H182 PolarHBondContact O-N 3.42Å; Q179-A183 PolarHBondContact O-N 3.36Å; Q179-L315 HydrophobicContact CG-CD1 3.77Å
180	S	80.1	Confident	76	Confident	25 Å²	25	49.8 Å²	49.8	18%	0.175	25%	0.248	C	C	.	.	H	α-helix	trans	-63.9	-41.1	175.8	-54.9	0	0	0	0	112.6	I176 L177 H182 A183 C184	I176-S180 PolarHBondContact O-N 2.91Å; I176-S180 PolarHBondContact O-OG 3.01Å; I176-S180 VanDerWaalsContact O-OG 3.13Å; L177-S180 PolarHBondContact O-N 3.47Å; S180-H182 VanDerWaalsContact C-N 3.3Å; S180-H182 PolarHBondContact O-N 3.18Å; S180-A183 PolarHBondContact O-N 3.38Å; S180-C184 PolarHBondContact O-N 3.14Å; S180-C184 VanDerWaalsContact O-N 3.15Å
181	I	81.9	Confident	77.4	Confident	3 Å²	3	48 Å²	48	2%	0.015	24%	0.236	C	C	.	.	H	α-helix	trans	-60.1	-44.3	174.5	-69.8	159.6	0	0	0	110	L156 L177 G178 C184 I185 I192 L212 V215	L156-I181 HydrophobicContact CD1-CG1 3.68Å; L177-I181 HydrophobicContact CD1-CD1 4.35Å; L177-I181 HydrophobicContact CG-CD1 3.91Å; L177-I181 WeakPolarHBondContact O-CD1 3.37Å; L177-I181 WeakPolarHBondContact O-CG1 3.36Å; L177-I181 PolarHBondContact O-N 3.38Å; G178-I181 PolarHBondContact O-N 3.4Å; I181-C184 PolarHBondContact O-N 3.1Å; I181-I185 VanDerWaalsContact O-CB 3.31Å; I181-I185 WeakPolarHBondContact O-CB 3.45Å; I181-I185 PolarHBondContact O-N 2.85Å; I181-I192 HydrophobicContact CB-CD1 4.49Å; I181-I192 HydrophobicContact CG2-CD1 4.01Å; I181-I192 HydrophobicContact CG2-CG1 4.34Å; I181-I192 HydrophobicContact CG2-CG2 4.23Å; I181-L212 HydrophobicContact CD1-CD2 3.45Å; I181-L212 VanDerWaalsContact CD1-CD2 3.45Å; I181-L212 HydrophobicContact CG1-CD2 3.73Å; I181-V215 HydrophobicContact CG2-CG1 3.78Å
182	H	76.8	Confident	78.6	Confident	65 Å²	65	41.8 Å²	41.8	30%	0.301	21%	0.209	S	C	.	.	H	α-helix	trans	-61.9	-47.6	179.9	-179.1	-112	0	0	0	112.4	G178 Q179 S180 C184 I185 D186 I311	G178-H182 PolarHBondContact O-N 3.03Å; Q179-H182 WeakPolarHBondContact O-CB 3.3Å; Q179-H182 PolarHBondContact O-N 3.42Å; S180-H182 VanDerWaalsContact C-N 3.3Å; S180-H182 PolarHBondContact O-N 3.18Å; H182-C184 PolarHBondContact O-N 3.39Å; H182-I185 WeakPolarHBondContact O-CG2 3.19Å; H182-I185 PolarHBondContact O-N 2.86Å; H182-D186 IonicContact CE1-OD2 2.69Å; H182-D186 IonicContact NE2-OD2 3.07Å; H182-I311 HydrophobicContact CB-CG1 4.33Å; H182-I311 HydrophobicContact CB-CG2 3.88Å; H182-I311 WeakPolarHBondContact CD2-CD1 3.31Å; H182-I311 WeakPolarHBondContact CD2-CG1 3.35Å; H182-I311 WeakPolarHBondContact NE2-CD1 3.38Å
183	A	80	Confident	80	Confident	33 Å²	33	35.3 Å²	35.3	27%	0.273	18%	0.179	S	C	.	.	H	α-helix	trans	-60.3	-35.8	178.3	0	0	0	0	0	112.2	L152 Q179 S180	L152-A183 HydrophobicContact CD1-CB 4.18Å; L152-A183 HydrophobicContact CD2-CB 3.61Å; L152-A183 HydrophobicContact CG-CB 4.4Å; Q179-A183 PolarHBondContact O-N 3.36Å; S180-A183 PolarHBondContact O-N 3.38Å
184	C	82.7	Confident	81.2	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-75.9	-42.2	176.1	-80.2	0	0	0	0	114.2	L152 L156 S180 I181 H182 D186 K187 D188 I192	L152-C184 PolarHBondContact O-SG 3.48Å; L156-C184 HydrophobicContact CD2-CB 4.23Å; S180-C184 PolarHBondContact O-N 3.14Å; S180-C184 VanDerWaalsContact O-N 3.15Å; I181-C184 PolarHBondContact O-N 3.1Å; H182-C184 PolarHBondContact O-N 3.39Å; C184-D186 PolarHBondContact O-N 3.42Å; C184-K187 PolarHBondContact O-N 3.15Å; C184-K187 VanDerWaalsContact O-N 3.08Å; C184-D188 PolarHBondContact O-N 2.97Å; C184-I192 HydrophobicContact CB-CD1 3.71Å
185	I	82.3	Confident	82.2	Confident	4 Å²	4	32.3 Å²	32.3	2%	0.021	17%	0.166	C	C	.	.	H	α-helix	trans	-65.3	-28.7	-168.8	-155.2	163.6	0	0	0	112.5	I181 H182 K187 P189 I192 N219	I181-I185 VanDerWaalsContact O-CB 3.31Å; I181-I185 WeakPolarHBondContact O-CB 3.45Å; I181-I185 PolarHBondContact O-N 2.85Å; H182-I185 WeakPolarHBondContact O-CG2 3.19Å; H182-I185 PolarHBondContact O-N 2.86Å; I185-K187 PolarHBondContact O-N 2.89Å; I185-P189 HydrophobicContact CG1-CB 4.25Å; I185-I192 HydrophobicContact CB-CG1 4.21Å; I185-I192 HydrophobicContact CD1-CG1 4.33Å; I185-I192 HydrophobicContact CG1-CG1 4.11Å; I185-N219 HydrophobicContact CD1-CB 3.5Å; I185-N219 HydrophobicContact CG1-CB 4.35Å; I185-N219 WeakPolarHBondContact CG2-ND2 3.45Å
186	D	74.4	Confident	83.2	Confident	66 Å²	66	29.6 Å²	29.6	35%	0.353	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-23.7	178.3	-82	-24	0	0	0	113.2	H182 C184 R221	H182-D186 IonicContact CE1-OD2 2.69Å; H182-D186 IonicContact NE2-OD2 3.07Å; C184-D186 PolarHBondContact O-N 3.42Å; D186-R221 PolarHBondContact O-NH1 2.94Å; D186-R221 VanDerWaalsContact O-NH1 3.11Å; D186-R221 IonicContact OD1-NH1 3.08Å; D186-R221 PolarHBondContact OD1-NH1 3.28Å
187	K	79.8	Confident	84.2	Confident	150 Å²	150	25.5 Å²	25.5	65%	0.652	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108	-43.3	-174.4	-58.8	-62.6	-176	-178.8	0	112.7	Y149 C184 I185	Y149-K187 HydrophobicContact CD2-CB 3.6Å; Y149-K187 HydrophobicContact CD2-CG 3.87Å; Y149-K187 HydrophobicContact CE2-CB 3.19Å; Y149-K187 HydrophobicContact CE2-CG 3.91Å; C184-K187 PolarHBondContact O-N 3.15Å; C184-K187 VanDerWaalsContact O-N 3.08Å; I185-K187 PolarHBondContact O-N 2.89Å
188	D	84.2	Confident	84.8	Confident	26 Å²	26	25.8 Å²	25.8	14%	0.139	13%	0.132	C	C	.	.			trans	-139.6	91.5	173.9	-174.3	-14	0	0	0	109.8	Y149 K153 C184 E190 F191	Y149-D188 HydrophobicContact CE1-CB 4.39Å; Y149-D188 WeakPolarHBondContact OH-CB 3.26Å; Y149-D188 PolarHBondContact OH-N 2.95Å; K153-D188 WeakPolarHBondContact CE-OD2 3.48Å; K153-D188 IonicContact NZ-OD2 3.58Å; K153-D188 PolarHBondContact NZ-OD2 3.22Å; C184-D188 PolarHBondContact O-N 2.97Å; D188-E190 PolarHBondContact O-N 2.83Å; D188-E190 PolarHBondContact OD1-N 3.17Å; D188-F191 HydrophobicContact CB-CB 4.07Å; D188-F191 PolarHBondContact O-N 3.09Å; D188-F191 PolarHBondContact OD1-N 3.13Å; D188-F191 VanDerWaalsContact OD1-N 3.09Å
189	P	86.4	Confident	85.1	Confident	17 Å²	17	25.6 Å²	25.6	11%	0.11	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-21.3	-179	27	-36.5	0	0	0	113.5	I185 R221 S222 F225	I185-P189 HydrophobicContact CG1-CB 4.25Å; P189-R221 HydrophobicContact CB-CB 3.87Å; P189-R221 WeakPolarHBondContact CB-O 3.15Å; P189-R221 HydrophobicContact CG-CB 3.99Å; P189-R221 WeakPolarHBondContact CG-O 3.39Å; P189-S222 WeakPolarHBondContact O-CB 3.36Å; P189-F225 HydrophobicContact CB-CE2 4.45Å; P189-F225 HydrophobicContact CG-CE2 3.9Å
190	E	89.9	Confident	85.6	Confident	29 Å²	29	21.4 Å²	21.4	14%	0.136	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-36.1	178.4	-172.7	173.4	-168	0	0	111.6	D188 I192 L193 K194 F225 K228 Y229	D188-E190 PolarHBondContact O-N 2.83Å; D188-E190 PolarHBondContact OD1-N 3.17Å; E190-I192 PolarHBondContact O-N 3.06Å; E190-I192 VanDerWaalsContact O-N 3.1Å; E190-L193 WeakPolarHBondContact O-CB 3.48Å; E190-L193 PolarHBondContact O-N 2.97Å; E190-K194 PolarHBondContact O-N 3.13Å; E190-F225 HydrophobicContact CB-CD1 3.77Å; E190-F225 HydrophobicContact CB-CD2 3.92Å; E190-F225 HydrophobicContact CB-CE1 3.87Å; E190-F225 HydrophobicContact CB-CE2 4.05Å; E190-F225 HydrophobicContact CB-CG 3.79Å; E190-F225 HydrophobicContact CB-CZ 4.01Å; E190-F225 VanDerWaalsContact CD-CD1 3.43Å; E190-F225 HydrophobicContact CG-CB 4.2Å; E190-F225 HydrophobicContact CG-CD1 3.57Å; E190-F225 HydrophobicContact CG-CD2 4.46Å; E190-F225 HydrophobicContact CG-CE1 4.02Å; E190-F225 HydrophobicContact CG-CG 3.82Å; E190-F225 WeakPolarHBondContact OE2-CE1 3.46Å; E190-K228 IonicContact OE1-NZ 3.02Å; E190-K228 PolarHBondContact OE1-NZ 3.09Å; E190-Y229 HydrophobicContact CG-CE2 3.77Å; E190-Y229 WeakPolarHBondContact OE1-CE2 3.26Å; E190-Y229 PolarHBondContact OE1-OH 3.27Å
191	F	90.9	Very high	85.8	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-54.8	-33.7	-177.7	-173.6	-106.1	0	0	0	113.6	K153 L156 I157 D188 L193 K194 A195 L739 I742 E743	K153-F191 HydrophobicContact CB-CD1 4.29Å; K153-F191 HydrophobicContact CB-CE1 3.65Å; K153-F191 HydrophobicContact CB-CZ 3.8Å; K153-F191 HydrophobicContact CD-CD1 4.05Å; K153-F191 HydrophobicContact CD-CD2 3.84Å; K153-F191 HydrophobicContact CD-CE1 4.02Å; K153-F191 HydrophobicContact CD-CE2 3.81Å; K153-F191 HydrophobicContact CD-CG 3.96Å; K153-F191 HydrophobicContact CD-CZ 3.91Å; K153-F191 HydrophobicContact CG-CD1 3.83Å; K153-F191 HydrophobicContact CG-CE1 3.71Å; K153-F191 HydrophobicContact CG-CE2 4.42Å; K153-F191 HydrophobicContact CG-CG 4.24Å; K153-F191 HydrophobicContact CG-CZ 4.02Å; L156-F191 HydrophobicContact CD2-CD1 4.15Å; L156-F191 HydrophobicContact CD2-CE1 4.12Å; I157-F191 HydrophobicContact CD1-CZ 3.97Å; I157-F191 HydrophobicContact CG1-CZ 4.13Å; D188-F191 HydrophobicContact CB-CB 4.07Å; D188-F191 PolarHBondContact O-N 3.09Å; D188-F191 PolarHBondContact OD1-N 3.13Å; D188-F191 VanDerWaalsContact OD1-N 3.09Å; F191-L193 PolarHBondContact O-N 3Å; F191-K194 PolarHBondContact O-N 2.96Å; F191-A195 WeakPolarHBondContact O-CB 3.35Å; F191-A195 PolarHBondContact O-N 3.2Å; F191-L739 HydrophobicContact CE2-CD1 3.65Å; F191-L739 HydrophobicContact CZ-CD1 3.55Å; F191-I742 HydrophobicContact CD2-CG2 4.49Å; F191-I742 HydrophobicContact CE2-CB 4.39Å; F191-I742 HydrophobicContact CE2-CG2 3.69Å; F191-I742 HydrophobicContact CZ-CG2 4Å; F191-E743 HydrophobicContact CD2-CG 4.1Å; F191-E743 HydrophobicContact CE2-CG 3.9Å
192	I	90.8	Very high	85.5	Confident	0 Å²	0	26 Å²	26	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-58.4	-37.3	176.2	-53.4	-53.8	0	0	0	111.6	L156 I181 C184 I185 E190 A196 L212 A216	L156-I192 HydrophobicContact CD2-CD1 3.47Å; L156-I192 VanDerWaalsContact CD2-CD1 3.47Å; I181-I192 HydrophobicContact CB-CD1 4.49Å; I181-I192 HydrophobicContact CG2-CD1 4.01Å; I181-I192 HydrophobicContact CG2-CG1 4.34Å; I181-I192 HydrophobicContact CG2-CG2 4.23Å; C184-I192 HydrophobicContact CB-CD1 3.71Å; I185-I192 HydrophobicContact CB-CG1 4.21Å; I185-I192 HydrophobicContact CD1-CG1 4.33Å; I185-I192 HydrophobicContact CG1-CG1 4.11Å; E190-I192 PolarHBondContact O-N 3.06Å; E190-I192 VanDerWaalsContact O-N 3.1Å; I192-A196 WeakPolarHBondContact O-CB 3.49Å; I192-A196 PolarHBondContact O-N 3.32Å; I192-L212 HydrophobicContact CG2-CB 4.48Å; I192-L212 HydrophobicContact CG2-CD2 3.97Å; I192-A216 HydrophobicContact CG2-CB 4.16Å
193	L	92.6	Very high	85.2	Confident	2 Å²	2	23.2 Å²	23.2	1%	0.01	11%	0.112	C	C	.	.	H	α-helix	trans	-81.3	-32.2	179.2	-65.5	169.2	0	0	0	112.6	E190 F191 A196 L197 I213 A216 F225 I226 Y229	E190-L193 WeakPolarHBondContact O-CB 3.48Å; E190-L193 PolarHBondContact O-N 2.97Å; F191-L193 PolarHBondContact O-N 3Å; L193-A196 WeakPolarHBondContact O-CB 3.37Å; L193-A196 PolarHBondContact O-N 3.15Å; L193-L197 PolarHBondContact O-N 3.3Å; L193-I213 HydrophobicContact CD2-CG1 4.21Å; L193-A216 HydrophobicContact CD2-CB 3.91Å; L193-A216 HydrophobicContact CG-CB 4.23Å; L193-F225 HydrophobicContact CD1-CB 3.5Å; L193-F225 VanDerWaalsContact CD1-CB 3.5Å; L193-I226 HydrophobicContact CD1-CD1 3.89Å; L193-I226 HydrophobicContact CD1-CG1 4.39Å; L193-I226 HydrophobicContact CD2-CD1 3.69Å; L193-I226 HydrophobicContact CG-CD1 4.35Å; L193-Y229 HydrophobicContact CB-CD1 4.38Å; L193-Y229 HydrophobicContact CB-CD2 3.53Å; L193-Y229 HydrophobicContact CB-CE2 4.11Å; L193-Y229 HydrophobicContact CB-CG 3.71Å; L193-Y229 HydrophobicContact CD1-CD2 3.86Å; L193-Y229 HydrophobicContact CG-CD2 4.33Å
194	K	92.8	Very high	84.9	Confident	4 Å²	4	25.9 Å²	25.9	2%	0.017	12%	0.121	C	C	.	.	H	α-helix	trans	-60.7	-46.6	168.3	-66.6	-166.9	178.8	-155.7	0	111	E190 F191 A196 L197 Y198 Y229 I742 E743 I745 D746	E190-K194 PolarHBondContact O-N 3.13Å; F191-K194 PolarHBondContact O-N 2.96Å; K194-A196 VanDerWaalsContact C-N 3.3Å; K194-A196 PolarHBondContact O-N 3.04Å; K194-L197 WeakPolarHBondContact O-CB 3.42Å; K194-L197 PolarHBondContact O-N 3.17Å; K194-L197 VanDerWaalsContact O-N 3.15Å; K194-Y198 PolarHBondContact O-N 3.45Å; K194-Y229 WeakPolarHBondContact CE-OH 3.41Å; K194-Y229 HydrophobicContact CG-CE1 3.91Å; K194-Y229 WeakPolarHBondContact CG-OH 3.37Å; K194-I742 HydrophobicContact CB-CG2 4.22Å; K194-I742 WeakPolarHBondContact CB-O 3.47Å; K194-E743 PolarHBondContact NZ-O 3.43Å; K194-I745 HydrophobicContact CB-CG2 3.76Å; K194-I745 HydrophobicContact CD-CG2 4.46Å; K194-I745 HydrophobicContact CG-CG2 4.07Å; K194-D746 WeakPolarHBondContact CE-OD1 3.38Å; K194-D746 WeakPolarHBondContact CE-OD2 3.45Å; K194-D746 VanDerWaalsContact NZ-CG 3.25Å; K194-D746 IonicContact NZ-OD1 3.4Å; K194-D746 PolarHBondContact NZ-OD1 3.47Å; K194-D746 IonicContact NZ-OD2 3.79Å; K194-D746 PolarHBondContact NZ-OD2 2.88Å
195	A	90.4	Very high	84.6	Confident	1 Å²	1	26.8 Å²	26.8	1%	0.008	13%	0.126	C	C	.	.	H	α-helix	trans	-61.1	-37.7	173.8	0	0	0	0	0	112.2	I160 F191 Y198 C199	I160-A195 HydrophobicContact CD1-CB 3.73Å; F191-A195 WeakPolarHBondContact O-CB 3.35Å; F191-A195 PolarHBondContact O-N 3.2Å; A195-Y198 PolarHBondContact O-N 2.85Å; A195-C199 PolarHBondContact O-N 2.96Å; A195-C199 PolarHBondContact O-SG 3.2Å
196	A	91.5	Very high	84.7	Confident	0 Å²	0	30 Å²	30	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-65.1	-39.1	174.4	0	0	0	0	0	112.6	I192 L193 K194 C199 R200 T209 L212 I213	I192-A196 WeakPolarHBondContact O-CB 3.49Å; I192-A196 PolarHBondContact O-N 3.32Å; L193-A196 WeakPolarHBondContact O-CB 3.37Å; L193-A196 PolarHBondContact O-N 3.15Å; K194-A196 VanDerWaalsContact C-N 3.3Å; K194-A196 PolarHBondContact O-N 3.04Å; A196-C199 WeakPolarHBondContact O-CB 3.46Å; A196-R200 PolarHBondContact O-N 2.89Å; A196-T209 HydrophobicContact CB-CG2 4.28Å; A196-T209 WeakPolarHBondContact O-CG2 3.45Å; A196-T209 PolarHBondContact O-OG1 3.37Å; A196-L212 HydrophobicContact CB-CB 3.79Å; A196-L212 HydrophobicContact CB-CD1 3.98Å; A196-I213 HydrophobicContact CB-CG1 4.21Å
197	L	91.7	Very high	85.1	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-65.7	-43.1	174.9	-173.7	62.9	0	0	0	110.9	L193 K194 R200 R201 Y229 I745 Y749 L751	L193-L197 PolarHBondContact O-N 3.3Å; K194-L197 WeakPolarHBondContact O-CB 3.42Å; K194-L197 PolarHBondContact O-N 3.17Å; K194-L197 VanDerWaalsContact O-N 3.15Å; L197-R200 PolarHBondContact O-N 3.46Å; L197-R200 VanDerWaalsContact O-N 3.12Å; L197-R201 HydrophobicContact CD1-CG 3.52Å; L197-R201 HydrophobicContact CG-CG 4.03Å; L197-R201 VanDerWaalsContact O-CB 3.32Å; L197-R201 WeakPolarHBondContact O-CB 3.38Å; L197-R201 WeakPolarHBondContact O-CG 3.43Å; L197-R201 PolarHBondContact O-N 2.88Å; L197-Y229 HydrophobicContact CB-CD1 4.35Å; L197-Y229 HydrophobicContact CD2-CD1 4.1Å; L197-Y229 HydrophobicContact CD2-CE1 4.39Å; L197-I745 HydrophobicContact CB-CD1 4.32Å; L197-I745 HydrophobicContact CB-CG2 4.45Å; L197-I745 HydrophobicContact CD2-CG1 4.04Å; L197-I745 HydrophobicContact CD2-CG2 4.12Å; L197-I745 HydrophobicContact CG-CD1 4.17Å; L197-I745 HydrophobicContact CG-CG1 4.23Å; L197-Y749 HydrophobicContact CD2-CD2 4.16Å; L197-L751 HydrophobicContact CD2-CD1 3.53Å
198	Y	88.1	Confident	85.2	Confident	6 Å²	6	20.8 Å²	20.8	2%	0.024	10%	0.096	C	C	.	.	H	α-helix	trans	-58.7	-49.9	175.5	173.8	-109.9	0	0	0	111.7	K194 A195 R200 R201 E202 L203 L738 I742 I745	K194-Y198 PolarHBondContact O-N 3.45Å; A195-Y198 PolarHBondContact O-N 2.85Å; Y198-R200 PolarHBondContact O-N 3.26Å; Y198-R201 PolarHBondContact O-N 2.88Å; Y198-E202 HydrophobicContact CD2-CB 3.64Å; Y198-E202 HydrophobicContact CD2-CG 3.69Å; Y198-E202 HydrophobicContact CE2-CB 3.6Å; Y198-E202 HydrophobicContact CE2-CG 3.93Å; Y198-E202 PolarHBondContact O-N 2.82Å; Y198-L203 HydrophobicContact CD1-CD1 3.93Å; Y198-L203 HydrophobicContact CD1-CG 4.22Å; Y198-L203 HydrophobicContact CE1-CD1 3.39Å; Y198-L203 HydrophobicContact CE1-CD2 4.18Å; Y198-L203 HydrophobicContact CE1-CG 3.68Å; Y198-L203 PolarHBondContact O-N 3.09Å; Y198-L738 HydrophobicContact CE1-CD1 4.44Å; Y198-L738 HydrophobicContact CE2-CD1 4.04Å; Y198-L738 WeakPolarHBondContact OH-CD1 3.14Å; Y198-I742 HydrophobicContact CD1-CD1 3.61Å; Y198-I742 HydrophobicContact CD1-CG1 3.95Å; Y198-I742 HydrophobicContact CD2-CD1 4.29Å; Y198-I742 HydrophobicContact CD2-CG1 3.77Å; Y198-I742 HydrophobicContact CE1-CD1 3.82Å; Y198-I742 HydrophobicContact CE1-CG1 4.36Å; Y198-I742 HydrophobicContact CE2-CD1 4.49Å; Y198-I742 HydrophobicContact CE2-CG1 4.23Å; Y198-I742 HydrophobicContact CG-CD1 3.87Å; Y198-I742 HydrophobicContact CG-CG1 3.64Å; Y198-I745 HydrophobicContact CD2-CD1 4.19Å; Y198-I745 HydrophobicContact CG-CD1 4.38Å; Y198-I745 VanDerWaalsContact N-CD1 3.31Å
199	C	84.5	Confident	85.5	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-49.8	-44.7	173.7	-72.3	0	0	0	0	111.5	I160 A195 A196 L203 N204 I205 T209	I160-C199 WeakPolarHBondContact CG2-SG 3.44Å; A195-C199 PolarHBondContact O-N 2.96Å; A195-C199 PolarHBondContact O-SG 3.2Å; A196-C199 WeakPolarHBondContact O-CB 3.46Å; C199-L203 CarbonylContact O-C 3.26Å; C199-L203 WeakPolarHBondContact O-CB 3.31Å; C199-N204 CarbonylContact O-C 3.59Å; C199-N204 PolarHBondContact O-N 3.32Å; C199-I205 HydrophobicContact CB-CB 4.37Å; C199-I205 PolarHBondContact O-N 2.92Å; C199-T209 WeakPolarHBondContact CB-OG1 3.5Å
200	R	87	Confident	85.7	Confident	18 Å²	18	18.7 Å²	18.7	7%	0.068	9%	0.085	C	C	.	.	H	α-helix	trans	-80	-43.1	-174.5	-168.8	73.4	179.2	115.1	-10.3	113.6	A196 L197 Y198 N204 T209 C233 D239	A196-R200 PolarHBondContact O-N 2.89Å; L197-R200 PolarHBondContact O-N 3.46Å; L197-R200 VanDerWaalsContact O-N 3.12Å; Y198-R200 PolarHBondContact O-N 3.26Å; R200-N204 PolarHBondContact NH1-OD1 3.42Å; R200-N204 VanDerWaalsContact NH1-OD1 3.12Å; R200-N204 WeakPolarHBondContact O-CA 3.5Å; R200-T209 HydrophobicContact CB-CG2 4Å; R200-T209 PolarHBondContact N-OG1 3.22Å; R200-C233 WeakPolarHBondContact CD-O 3.48Å; R200-C233 WeakPolarHBondContact CG-O 3.35Å; R200-C233 PolarHBondContact NE-O 3.43Å; R200-D239 IonicContact CZ-OD2 2.91Å; R200-D239 IonicContact NE-OD2 2.79Å; R200-D239 IonicContact NH2-OD1 2.68Å; R200-D239 IonicContact NH2-OD2 2.68Å; R200-D239 PolarHBondContact NH2-OD2 3.28Å
201	R	82.6	Confident	85.5	Confident	91 Å²	91	17.3 Å²	17.3	34%	0.343	8%	0.078	S	C	.	.	H	α-helix	trans	-87.8	-42.8	-167.5	-71.2	-71.8	177.4	153.7	1.5	112.1	L197 Y198 S232 Y749	L197-R201 HydrophobicContact CD1-CG 3.52Å; L197-R201 HydrophobicContact CG-CG 4.03Å; L197-R201 VanDerWaalsContact O-CB 3.32Å; L197-R201 WeakPolarHBondContact O-CB 3.38Å; L197-R201 WeakPolarHBondContact O-CG 3.43Å; L197-R201 PolarHBondContact O-N 2.88Å; Y198-R201 PolarHBondContact O-N 2.88Å; R201-S232 PolarHBondContact NE-O 3.11Å; R201-S232 PolarHBondContact NH2-O 3.45Å; R201-Y749 HydrophobicContact CB-CE1 4.08Å; R201-Y749 HydrophobicContact CB-CE2 3.77Å; R201-Y749 WeakPolarHBondContact CB-OH 3.42Å; R201-Y749 HydrophobicContact CG-CD1 4.45Å; R201-Y749 HydrophobicContact CG-CD2 4.45Å; R201-Y749 HydrophobicContact CG-CE1 4.07Å; R201-Y749 HydrophobicContact CG-CE2 4.11Å
202	E	76.1	Confident	85.5	Confident	35 Å²	35	17.3 Å²	17.3	16%	0.164	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96	-46.1	-175.9	-62.3	-64.1	166.3	0	0	111.6	Y198 R728 R741 Y749	Y198-E202 HydrophobicContact CD2-CB 3.64Å; Y198-E202 HydrophobicContact CD2-CG 3.69Å; Y198-E202 HydrophobicContact CE2-CB 3.6Å; Y198-E202 HydrophobicContact CE2-CG 3.93Å; Y198-E202 PolarHBondContact O-N 2.82Å; E202-R728 PolarHBondContact O-NH1 3.4Å; E202-R741 IonicContact OE1-NH2 2.94Å; E202-R741 PolarHBondContact OE1-NH2 3.05Å; E202-R741 VanDerWaalsContact OE1-NH2 3.12Å; E202-R741 IonicContact OE2-NH2 3.93Å; E202-Y749 PolarHBondContact OE1-OH 2.77Å
203	L	71.5	Confident	85.5	Confident	5 Å²	5	17.4 Å²	17.4	3%	0.026	8%	0.078	C	C	.	.	S	Bend	trans	-88.8	-13.7	-179.2	-55.5	-178.5	0	0	0	113.6	I160 I164 Y198 C199 I205 Q725	I160-L203 HydrophobicContact CG2-CD1 4.36Å; I164-L203 HydrophobicContact CD1-CD1 4.21Å; I164-L203 HydrophobicContact CD1-CD2 4.33Å; Y198-L203 HydrophobicContact CD1-CD1 3.93Å; Y198-L203 HydrophobicContact CD1-CG 4.22Å; Y198-L203 HydrophobicContact CE1-CD1 3.39Å; Y198-L203 HydrophobicContact CE1-CD2 4.18Å; Y198-L203 HydrophobicContact CE1-CG 3.68Å; Y198-L203 PolarHBondContact O-N 3.09Å; C199-L203 CarbonylContact O-C 3.26Å; C199-L203 WeakPolarHBondContact O-CB 3.31Å; L203-I205 HydrophobicContact CB-CD1 3.74Å; L203-I205 HydrophobicContact CB-CG1 3.72Å; L203-I205 HydrophobicContact CD1-CD1 3.75Å; L203-I205 HydrophobicContact CG-CD1 4.42Å; L203-I205 PolarHBondContact O-N 3.39Å; L203-I205 VanDerWaalsContact O-N 3.14Å; L203-Q725 PolarHBondContact O-NE2 3.07Å; L203-Q725 PolarHBondContact O-OE1 3Å
204	N	73.5	Confident	85.4	Confident	89 Å²	89	17.3 Å²	17.3	48%	0.476	8%	0.078	S	C	.	.			trans	52.9	28.5	-175	-164.7	29.5	0	0	0	114.4	C199 R200	C199-N204 CarbonylContact O-C 3.59Å; C199-N204 PolarHBondContact O-N 3.32Å; R200-N204 PolarHBondContact NH1-OD1 3.42Å; R200-N204 VanDerWaalsContact NH1-OD1 3.12Å; R200-N204 WeakPolarHBondContact O-CA 3.5Å
205	I	76	Confident	85	Confident	19 Å²	19	18.1 Å²	18.1	10%	0.097	8%	0.083	C	C	.	.			trans	-83.1	123.1	174.2	-54	170.1	0	0	0	108.4	I164 C199 L203 T208 T209	I164-I205 HydrophobicContact CB-CD1 4.43Å; I164-I205 HydrophobicContact CD1-CD1 4.4Å; I164-I205 HydrophobicContact CG1-CD1 3.41Å; I164-I205 VanDerWaalsContact CG1-CD1 3.41Å; I164-I205 HydrophobicContact CG1-CG1 4.19Å; C199-I205 HydrophobicContact CB-CB 4.37Å; C199-I205 PolarHBondContact O-N 2.92Å; L203-I205 HydrophobicContact CB-CD1 3.74Å; L203-I205 HydrophobicContact CB-CG1 3.72Å; L203-I205 HydrophobicContact CD1-CD1 3.75Å; L203-I205 HydrophobicContact CG-CD1 4.42Å; L203-I205 PolarHBondContact O-N 3.39Å; L203-I205 VanDerWaalsContact O-N 3.14Å; I205-T208 WeakPolarHBondContact CG2-OG1 3.39Å; I205-T209 PolarHBondContact O-OG1 3.48Å
206	R	84.1	Confident	85	Confident	72 Å²	72	18 Å²	18	27%	0.272	8%	0.083	S	C	.	.			trans	-91.3	-54.2	-177.5	174.2	-171.2	148.3	165.2	0.2	112.5	T208 T209 N210 S238 D239 E242	R206-T208 PolarHBondContact O-N 3.04Å; R206-T209 WeakPolarHBondContact O-CB 3.04Å; R206-T209 PolarHBondContact O-N 2.91Å; R206-N210 WeakPolarHBondContact CG-ND2 3.28Å; R206-N210 VanDerWaalsContact O-CG 3.25Å; R206-N210 PolarHBondContact O-N 3.33Å; R206-N210 PolarHBondContact O-ND2 2.91Å; R206-S238 VanDerWaalsContact NH2-C 3.29Å; R206-S238 PolarHBondContact NH2-O 3.25Å; R206-D239 WeakPolarHBondContact CD-OD1 3.42Å; R206-D239 WeakPolarHBondContact CG-OD1 3.47Å; R206-D239 IonicContact CZ-OD1 3.88Å; R206-D239 IonicContact NE-OD1 3.63Å; R206-D239 PolarHBondContact NE-OD1 2.67Å; R206-D239 VanDerWaalsContact NE-OD1 3.13Å; R206-D239 IonicContact NH1-OD1 3.23Å; R206-E242 IonicContact CZ-OE2 3.2Å; R206-E242 VanDerWaalsContact CZ-OE2 3.27Å; R206-E242 IonicContact NE-OE2 3.38Å; R206-E242 PolarHBondContact NE-OE2 3.4Å; R206-E242 IonicContact NH2-OE2 2.81Å; R206-E242 PolarHBondContact NH2-OE2 3.24Å
207	T	82.7	Confident	84.8	Confident	21 Å²	21	18.1 Å²	18.1	13%	0.129	8%	0.083	C	C	.	.	H	α-helix	trans	-66.2	-42.4	-167.8	-62.7	0	0	0	0	111.7	N210 M211 E242 Y246	T207-N210 PolarHBondContact O-N 3.48Å; T207-M211 WeakPolarHBondContact O-CB 3.47Å; T207-M211 PolarHBondContact O-N 3.11Å; T207-E242 PolarHBondContact OG1-OE1 2.85Å; T207-Y246 HydrophobicContact CG2-CE2 4.09Å; T207-Y246 WeakPolarHBondContact CG2-OH 3.48Å
208	T	83.2	Confident	84.4	Confident	1 Å²	1	19.4 Å²	19.4	1%	0.006	9%	0.092	C	C	.	.	H	α-helix	trans	-63	-43.5	175.1	-49.5	0	0	0	0	112	I160 L177 I205 R206 N210 M211 L212	I160-T208 HydrophobicContact CG1-CG2 4.42Å; L177-T208 HydrophobicContact CD2-CG2 4.04Å; I205-T208 WeakPolarHBondContact CG2-OG1 3.39Å; R206-T208 PolarHBondContact O-N 3.04Å; T208-N210 VanDerWaalsContact C-N 3.35Å; T208-N210 PolarHBondContact O-N 2.84Å; T208-M211 PolarHBondContact O-N 3.36Å; T208-L212 HydrophobicContact CG2-CD1 4.13Å; T208-L212 HydrophobicContact CG2-CG 4.45Å; T208-L212 WeakPolarHBondContact O-CG 3.4Å; T208-L212 PolarHBondContact O-N 3.16Å
209	T	89.2	Confident	84.1	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-55.8	-49	173.2	-64.9	0	0	0	0	111.7	A196 C199 R200 I205 R206 M211 L212 I213 C233	A196-T209 HydrophobicContact CB-CG2 4.28Å; A196-T209 WeakPolarHBondContact O-CG2 3.45Å; A196-T209 PolarHBondContact O-OG1 3.37Å; C199-T209 WeakPolarHBondContact CB-OG1 3.5Å; R200-T209 HydrophobicContact CB-CG2 4Å; R200-T209 PolarHBondContact N-OG1 3.22Å; I205-T209 PolarHBondContact O-OG1 3.48Å; R206-T209 WeakPolarHBondContact O-CB 3.04Å; R206-T209 PolarHBondContact O-N 2.91Å; T209-M211 VanDerWaalsContact C-N 3.29Å; T209-M211 PolarHBondContact O-N 3.42Å; T209-L212 PolarHBondContact O-N 3.18Å; T209-I213 HydrophobicContact CG2-CD1 3.85Å; T209-I213 WeakPolarHBondContact O-CG1 3.25Å; T209-I213 PolarHBondContact O-N 2.77Å; T209-C233 HydrophobicContact CG2-CB 3.79Å
210	N	91	Very high	84	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-65.4	-35.7	-177.1	-64.3	-20.3	0	0	0	111.8	R206 T207 T208 A214 I234 D239 E242 V243 Y246	R206-N210 WeakPolarHBondContact CG-ND2 3.28Å; R206-N210 VanDerWaalsContact O-CG 3.25Å; R206-N210 PolarHBondContact O-N 3.33Å; R206-N210 PolarHBondContact O-ND2 2.91Å; T207-N210 PolarHBondContact O-N 3.48Å; T208-N210 VanDerWaalsContact C-N 3.35Å; T208-N210 PolarHBondContact O-N 2.84Å; N210-A214 WeakPolarHBondContact O-CB 3.46Å; N210-A214 PolarHBondContact O-N 2.94Å; N210-I234 WeakPolarHBondContact OD1-CD1 3.36Å; N210-D239 WeakPolarHBondContact ND2-CA 3.24Å; N210-E242 HydrophobicContact CB-CB 4.38Å; N210-E242 HydrophobicContact CB-CG 4.12Å; N210-E242 PolarHBondContact ND2-OE2 2.8Å; N210-V243 HydrophobicContact CB-CG2 3.77Å; N210-Y246 HydrophobicContact CB-CD2 4.31Å
211	M	86.5	Confident	83.7	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-66.2	-47.4	173.3	-179.9	177.5	163.3	0	0	111.8	P169 K174 L177 T207 T208 T209 I213 A214 V215 Y246 L318	P169-M211 HydrophobicContact CG-SD 4.14Å; K174-M211 HydrophobicContact CB-CE 4.44Å; K174-M211 HydrophobicContact CG-CE 4.35Å; K174-M211 HydrophobicContact CG-SD 4.46Å; L177-M211 HydrophobicContact CD2-CE 4.15Å; L177-M211 HydrophobicContact CD2-SD 4.26Å; T207-M211 WeakPolarHBondContact O-CB 3.47Å; T207-M211 PolarHBondContact O-N 3.11Å; T208-M211 PolarHBondContact O-N 3.36Å; T209-M211 VanDerWaalsContact C-N 3.29Å; T209-M211 PolarHBondContact O-N 3.42Å; M211-I213 VanDerWaalsContact C-N 3.34Å; M211-I213 PolarHBondContact O-N 3.15Å; M211-A214 PolarHBondContact O-N 3.07Å; M211-A214 VanDerWaalsContact O-N 3.15Å; M211-V215 HydrophobicContact CG-CG2 4.46Å; M211-V215 WeakPolarHBondContact O-CG2 3.38Å; M211-V215 PolarHBondContact O-N 2.94Å; M211-Y246 HydrophobicContact CB-CD1 4.26Å; M211-Y246 HydrophobicContact CB-CD2 4.22Å; M211-Y246 HydrophobicContact CB-CE1 4.15Å; M211-Y246 HydrophobicContact CB-CE2 4.13Å; M211-Y246 HydrophobicContact CB-CG 4.31Å; M211-Y246 HydrophobicContact CG-CD1 4.24Å; M211-Y246 HydrophobicContact CG-CE1 4.19Å; M211-Y246 HydrophobicContact SD-CE1 4.37Å; M211-L318 HydrophobicContact CE-CD1 4Å; M211-L318 HydrophobicContact CE-CD2 4.32Å
212	L	89.8	Confident	83.9	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-58.1	-45	178.8	-73.9	166.7	0	0	0	111.8	I160 I181 I192 A196 T208 T209 A214 V215 A216	I160-L212 HydrophobicContact CD1-CD1 3.92Å; I160-L212 HydrophobicContact CG1-CD1 4.45Å; I181-L212 HydrophobicContact CD1-CD2 3.45Å; I181-L212 VanDerWaalsContact CD1-CD2 3.45Å; I181-L212 HydrophobicContact CG1-CD2 3.73Å; I192-L212 HydrophobicContact CG2-CB 4.48Å; I192-L212 HydrophobicContact CG2-CD2 3.97Å; A196-L212 HydrophobicContact CB-CB 3.79Å; A196-L212 HydrophobicContact CB-CD1 3.98Å; T208-L212 HydrophobicContact CG2-CD1 4.13Å; T208-L212 HydrophobicContact CG2-CG 4.45Å; T208-L212 WeakPolarHBondContact O-CG 3.4Å; T208-L212 PolarHBondContact O-N 3.16Å; T209-L212 PolarHBondContact O-N 3.18Å; L212-A214 VanDerWaalsContact C-N 3.33Å; L212-A214 PolarHBondContact O-N 3.01Å; L212-V215 PolarHBondContact O-N 3.12Å; L212-A216 VanDerWaalsContact O-CB 3.28Å; L212-A216 WeakPolarHBondContact O-CB 3.4Å; L212-A216 PolarHBondContact O-N 3.13Å
213	I	91.8	Very high	84.4	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.005	14%	0.139	C	C	.	.	H	α-helix	trans	-62.7	-41.3	177.1	-66.9	167.9	0	0	0	111.2	L193 A196 T209 M211 S217 F230 C233 I234 V243	L193-I213 HydrophobicContact CD2-CG1 4.21Å; A196-I213 HydrophobicContact CB-CG1 4.21Å; T209-I213 HydrophobicContact CG2-CD1 3.85Å; T209-I213 WeakPolarHBondContact O-CG1 3.25Å; T209-I213 PolarHBondContact O-N 2.77Å; M211-I213 VanDerWaalsContact C-N 3.34Å; M211-I213 PolarHBondContact O-N 3.15Å; I213-S217 WeakPolarHBondContact O-CB 3.36Å; I213-S217 PolarHBondContact O-N 3.28Å; I213-S217 PolarHBondContact O-OG 3.3Å; I213-F230 HydrophobicContact CG2-CD2 3.77Å; I213-F230 HydrophobicContact CG2-CE2 3.93Å; I213-C233 HydrophobicContact CD1-CB 3.5Å; I213-C233 VanDerWaalsContact CD1-CB 3.5Å; I213-I234 HydrophobicContact CD1-CD1 3.94Å; I213-V243 HydrophobicContact CG2-CG1 4.05Å; I213-V243 HydrophobicContact CG2-CG2 4.5Å
214	A	89.5	Confident	84.9	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-65.8	-43.5	179	0	0	0	0	0	111.8	N210 M211 L212 S217 C218 I250	N210-A214 WeakPolarHBondContact O-CB 3.46Å; N210-A214 PolarHBondContact O-N 2.94Å; M211-A214 PolarHBondContact O-N 3.07Å; M211-A214 VanDerWaalsContact O-N 3.15Å; L212-A214 VanDerWaalsContact C-N 3.33Å; L212-A214 PolarHBondContact O-N 3.01Å; A214-S217 WeakPolarHBondContact O-CB 3.38Å; A214-S217 PolarHBondContact O-N 3.35Å; A214-C218 PolarHBondContact O-N 2.99Å; A214-C218 PolarHBondContact O-SG 3.13Å; A214-I250 HydrophobicContact CB-CD1 3.84Å
215	V	85.6	Confident	85.7	Confident	21 Å²	21	30 Å²	30	13%	0.127	14%	0.141	C	C	.	.	H	α-helix	trans	-64	-47.7	175.9	175.6	0	0	0	0	110.9	I181 M211 L212 S217 C218 N219 I250 L318	I181-V215 HydrophobicContact CG2-CG1 3.78Å; M211-V215 HydrophobicContact CG-CG2 4.46Å; M211-V215 WeakPolarHBondContact O-CG2 3.38Å; M211-V215 PolarHBondContact O-N 2.94Å; L212-V215 PolarHBondContact O-N 3.12Å; V215-S217 PolarHBondContact O-N 2.82Å; V215-C218 WeakPolarHBondContact O-CB 3.42Å; V215-C218 PolarHBondContact O-N 3.4Å; V215-N219 PolarHBondContact O-N 3.16Å; V215-I250 HydrophobicContact CG2-CD1 3.65Å; V215-L318 HydrophobicContact CG2-CD1 4.15Å
216	A	88.7	Confident	86.4	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-61.9	-25.2	176.4	0	0	0	0	0	113	I192 L193 L212 S222 I226	I192-A216 HydrophobicContact CG2-CB 4.16Å; L193-A216 HydrophobicContact CD2-CB 3.91Å; L193-A216 HydrophobicContact CG-CB 4.23Å; L212-A216 VanDerWaalsContact O-CB 3.28Å; L212-A216 WeakPolarHBondContact O-CB 3.4Å; L212-A216 PolarHBondContact O-N 3.13Å; A216-S222 WeakPolarHBondContact O-CB 3.38Å; A216-S222 PolarHBondContact O-OG 3.34Å; A216-I226 HydrophobicContact CB-CD1 3.99Å
217	S	88.3	Confident	86.6	Confident	1 Å²	1	33 Å²	33	1%	0.007	16%	0.156	C	C	.	.	H	α-helix	trans	-75.2	-26.4	175.1	-60.5	0	0	0	0	112.7	I213 A214 V215 R223 P260	I213-S217 WeakPolarHBondContact O-CB 3.36Å; I213-S217 PolarHBondContact O-N 3.28Å; I213-S217 PolarHBondContact O-OG 3.3Å; A214-S217 WeakPolarHBondContact O-CB 3.38Å; A214-S217 PolarHBondContact O-N 3.35Å; V215-S217 PolarHBondContact O-N 2.82Å; S217-R223 PolarHBondContact O-NE 3.19Å; S217-P260 WeakPolarHBondContact O-CG 3.08Å
218	C	82.7	Confident	86.9	Confident	27 Å²	27	35.2 Å²	35.2	18%	0.182	16%	0.163	C	C	.	.	H	α-helix	trans	-75.4	-37.7	179	-69.4	0	0	0	0	112.1	A214 V215 R223 I250	A214-C218 PolarHBondContact O-N 2.99Å; A214-C218 PolarHBondContact O-SG 3.13Å; V215-C218 WeakPolarHBondContact O-CB 3.42Å; V215-C218 PolarHBondContact O-N 3.4Å; C218-R223 PolarHBondContact O-NH2 2.92Å; C218-I250 HydrophobicContact CB-CG2 4.26Å; C218-I250 WeakPolarHBondContact SG-CG2 3.3Å
219	N	82.9	Confident	87.3	Confident	35 Å²	35	35.1 Å²	35.1	19%	0.187	16%	0.163	C	C	.	.	S	Bend	trans	-78.4	132.3	178	-174	-42.4	0	0	0	111.7	I185 V215 R221 S222 R223	I185-N219 HydrophobicContact CD1-CB 3.5Å; I185-N219 HydrophobicContact CG1-CB 4.35Å; I185-N219 WeakPolarHBondContact CG2-ND2 3.45Å; V215-N219 PolarHBondContact O-N 3.16Å; N219-R221 PolarHBondContact O-N 3.49Å; N219-R221 WeakPolarHBondContact OD1-CB 3.45Å; N219-R221 PolarHBondContact OD1-N 2.79Å; N219-S222 PolarHBondContact O-OG 2.8Å; N219-R223 WeakPolarHBondContact O-CG 3.5Å
220	E	81.4	Confident	87.6	Confident	141 Å²	141	35.2 Å²	35.2	66%	0.659	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-36	-176.3	-50.8	-145.4	127.2	0	0	113.5	S222 R223	E220-S222 VanDerWaalsContact C-N 3.3Å; E220-S222 PolarHBondContact O-N 3.41Å; E220-R223 PolarHBondContact O-N 3.4Å; E220-R223 IonicContact OE1-CZ 2.79Å; E220-R223 IonicContact OE1-NH1 2.91Å; E220-R223 PolarHBondContact OE1-NH1 3.45Å; E220-R223 IonicContact OE1-NH2 2.81Å
221	R	81.6	Confident	87.5	Confident	127 Å²	127	37 Å²	37	48%	0.479	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-28.7	-176.9	-61.3	-174.4	-177.9	160	9.1	112.8	D186 P189 N219	D186-R221 PolarHBondContact O-NH1 2.94Å; D186-R221 VanDerWaalsContact O-NH1 3.11Å; D186-R221 IonicContact OD1-NH1 3.08Å; D186-R221 PolarHBondContact OD1-NH1 3.28Å; P189-R221 HydrophobicContact CB-CB 3.87Å; P189-R221 WeakPolarHBondContact CB-O 3.15Å; P189-R221 HydrophobicContact CG-CB 3.99Å; P189-R221 WeakPolarHBondContact CG-O 3.39Å; N219-R221 PolarHBondContact O-N 3.49Å; N219-R221 WeakPolarHBondContact OD1-CB 3.45Å; N219-R221 PolarHBondContact OD1-N 2.79Å
222	S	86.1	Confident	87.6	Confident	0 Å²	0	38 Å²	38	0%	0	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-11.9	-179.9	45.2	0	0	0	0	114.4	P189 A216 N219 E220 S224 F225	P189-S222 WeakPolarHBondContact O-CB 3.36Å; A216-S222 WeakPolarHBondContact O-CB 3.38Å; A216-S222 PolarHBondContact O-OG 3.34Å; N219-S222 PolarHBondContact O-OG 2.8Å; E220-S222 VanDerWaalsContact C-N 3.3Å; E220-S222 PolarHBondContact O-N 3.41Å; S222-S224 VanDerWaalsContact C-N 3.3Å; S222-S224 PolarHBondContact O-N 3.47Å; S222-F225 PolarHBondContact O-N 2.99Å
223	R	86.5	Confident	87.7	Confident	72 Å²	72	38 Å²	38	27%	0.272	18%	0.183	S	C	.	.	H	α-helix	trans	-60.2	-36	-176.2	-80.2	172.8	-165.6	159.8	9.6	113.3	S217 C218 N219 E220 F225 I226	S217-R223 PolarHBondContact O-NE 3.19Å; C218-R223 PolarHBondContact O-NH2 2.92Å; N219-R223 WeakPolarHBondContact O-CG 3.5Å; E220-R223 PolarHBondContact O-N 3.4Å; E220-R223 IonicContact OE1-CZ 2.79Å; E220-R223 IonicContact OE1-NH1 2.91Å; E220-R223 PolarHBondContact OE1-NH1 3.45Å; E220-R223 IonicContact OE1-NH2 2.81Å; R223-F225 PolarHBondContact O-N 3.17Å; R223-I226 PolarHBondContact O-N 3.36Å
224	S	83	Confident	87.8	Confident	53 Å²	53	38 Å²	38	37%	0.371	18%	0.183	S	C	.	.	H	α-helix	trans	-59.2	-35.1	179.8	48.6	0	0	0	0	112.3	S222	S222-S224 VanDerWaalsContact C-N 3.3Å; S222-S224 PolarHBondContact O-N 3.47Å
225	F	89.6	Confident	87.6	Confident	40 Å²	40	44.4 Å²	44.4	18%	0.175	21%	0.207	C	C	.	.	H	α-helix	trans	-84.6	-18.8	-175.8	-55.9	-74.7	0	0	0	113.6	P189 E190 L193 S222 R223 K227 K228 Y229	P189-F225 HydrophobicContact CB-CE2 4.45Å; P189-F225 HydrophobicContact CG-CE2 3.9Å; E190-F225 HydrophobicContact CB-CD1 3.77Å; E190-F225 HydrophobicContact CB-CD2 3.92Å; E190-F225 HydrophobicContact CB-CE1 3.87Å; E190-F225 HydrophobicContact CB-CE2 4.05Å; E190-F225 HydrophobicContact CB-CG 3.79Å; E190-F225 HydrophobicContact CB-CZ 4.01Å; E190-F225 VanDerWaalsContact CD-CD1 3.43Å; E190-F225 HydrophobicContact CG-CB 4.2Å; E190-F225 HydrophobicContact CG-CD1 3.57Å; E190-F225 HydrophobicContact CG-CD2 4.46Å; E190-F225 HydrophobicContact CG-CE1 4.02Å; E190-F225 HydrophobicContact CG-CG 3.82Å; E190-F225 WeakPolarHBondContact OE2-CE1 3.46Å; L193-F225 HydrophobicContact CD1-CB 3.5Å; L193-F225 VanDerWaalsContact CD1-CB 3.5Å; S222-F225 PolarHBondContact O-N 2.99Å; R223-F225 PolarHBondContact O-N 3.17Å; F225-K227 VanDerWaalsContact C-N 3.26Å; F225-K227 PolarHBondContact O-N 3.32Å; F225-K227 VanDerWaalsContact O-N 3.16Å; F225-K228 WeakPolarHBondContact O-CB 3.39Å; F225-K228 PolarHBondContact O-N 3.29Å; F225-Y229 HydrophobicContact CB-CD2 4.42Å; F225-Y229 HydrophobicContact CB-CE2 4.32Å; F225-Y229 WeakPolarHBondContact O-CD2 3.16Å
226	I	90.6	Very high	87.8	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-52.1	-44.8	-176.3	-64.6	-68.6	0	0	0	112	L193 A216 R223 K228 Y229 F230 V262	L193-I226 HydrophobicContact CD1-CD1 3.89Å; L193-I226 HydrophobicContact CD1-CG1 4.39Å; L193-I226 HydrophobicContact CD2-CD1 3.69Å; L193-I226 HydrophobicContact CG-CD1 4.35Å; A216-I226 HydrophobicContact CB-CD1 3.99Å; R223-I226 PolarHBondContact O-N 3.36Å; I226-K228 PolarHBondContact O-N 3.23Å; I226-Y229 PolarHBondContact O-N 3.21Å; I226-F230 HydrophobicContact CG2-CB 4.32Å; I226-F230 HydrophobicContact CG2-CD2 4.26Å; I226-F230 VanDerWaalsContact O-CB 3.24Å; I226-F230 WeakPolarHBondContact O-CB 3.46Å; I226-F230 PolarHBondContact O-N 3.48Å; I226-V262 HydrophobicContact CB-CG1 3.97Å; I226-V262 HydrophobicContact CG2-CG1 4.24Å
227	K	88.7	Confident	87.8	Confident	153 Å²	153	45.2 Å²	45.2	67%	0.665	21%	0.212	S	C	*	.	H	α-helix	trans	-59.3	-33.3	-177.7	-168.1	-179.8	177.9	-171.7	0	112.4	F225 V262	F225-K227 VanDerWaalsContact C-N 3.26Å; F225-K227 PolarHBondContact O-N 3.32Å; F225-K227 VanDerWaalsContact O-N 3.16Å; K227-V262 HydrophobicContact CB-CG1 4.18Å
228	K	87.7	Confident	87.8	Confident	66 Å²	66	45.8 Å²	45.8	29%	0.287	22%	0.216	S	C	.	.	H	α-helix	trans	-69.1	-40.8	179.8	-179.5	177	169.9	-172.2	0	112.3	E190 F225 I226 D746 L751 N752	E190-K228 IonicContact OE1-NZ 3.02Å; E190-K228 PolarHBondContact OE1-NZ 3.09Å; F225-K228 WeakPolarHBondContact O-CB 3.39Å; F225-K228 PolarHBondContact O-N 3.29Å; I226-K228 PolarHBondContact O-N 3.23Å; K228-D746 IonicContact NZ-OD2 2.65Å; K228-D746 PolarHBondContact NZ-OD2 3.45Å; K228-L751 HydrophobicContact CG-CB 4.27Å; K228-N752 PolarHBondContact NZ-OD1 3.35Å
229	Y	93.3	Very high	88.1	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-101.9	-23.1	-170.3	-64	-84.5	0	0	0	115	E190 L193 K194 L197 F225 I226 S231 S232 C233 D746 L751	E190-Y229 HydrophobicContact CG-CE2 3.77Å; E190-Y229 WeakPolarHBondContact OE1-CE2 3.26Å; E190-Y229 PolarHBondContact OE1-OH 3.27Å; L193-Y229 HydrophobicContact CB-CD1 4.38Å; L193-Y229 HydrophobicContact CB-CD2 3.53Å; L193-Y229 HydrophobicContact CB-CE2 4.11Å; L193-Y229 HydrophobicContact CB-CG 3.71Å; L193-Y229 HydrophobicContact CD1-CD2 3.86Å; L193-Y229 HydrophobicContact CG-CD2 4.33Å; K194-Y229 WeakPolarHBondContact CE-OH 3.41Å; K194-Y229 HydrophobicContact CG-CE1 3.91Å; K194-Y229 WeakPolarHBondContact CG-OH 3.37Å; L197-Y229 HydrophobicContact CB-CD1 4.35Å; L197-Y229 HydrophobicContact CD2-CD1 4.1Å; L197-Y229 HydrophobicContact CD2-CE1 4.39Å; F225-Y229 HydrophobicContact CB-CD2 4.42Å; F225-Y229 HydrophobicContact CB-CE2 4.32Å; F225-Y229 WeakPolarHBondContact O-CD2 3.16Å; I226-Y229 PolarHBondContact O-N 3.21Å; Y229-S231 PolarHBondContact O-N 2.63Å; Y229-S232 PolarHBondContact O-N 3.03Å; Y229-C233 PolarHBondContact O-N 2.76Å; Y229-C233 VanDerWaalsContact O-N 3.08Å; Y229-C233 PolarHBondContact O-SG 3.05Å; Y229-D746 HydrophobicContact CE1-CB 3.95Å; Y229-D746 PolarHBondContact OH-OD2 2.87Å; Y229-L751 HydrophobicContact CD1-CD1 3.92Å; Y229-L751 HydrophobicContact CE1-CD1 4.13Å
230	F	93.7	Very high	88.7	Confident	2 Å²	2	42.9 Å²	42.9	1%	0.009	20%	0.199	C	C	.	.	H	α-helix	trans	-57.3	-54.6	-168.3	-171.4	-88.6	0	0	0	113.2	I213 I226 S232 C233 I234 V243 L263 M267 K270	I213-F230 HydrophobicContact CG2-CD2 3.77Å; I213-F230 HydrophobicContact CG2-CE2 3.93Å; I226-F230 HydrophobicContact CG2-CB 4.32Å; I226-F230 HydrophobicContact CG2-CD2 4.26Å; I226-F230 VanDerWaalsContact O-CB 3.24Å; I226-F230 WeakPolarHBondContact O-CB 3.46Å; I226-F230 PolarHBondContact O-N 3.48Å; F230-S232 PolarHBondContact O-N 3.31Å; F230-C233 PolarHBondContact O-N 2.97Å; F230-I234 HydrophobicContact CD1-CG1 4.14Å; F230-I234 HydrophobicContact CD2-CG1 4.39Å; F230-I234 HydrophobicContact CE1-CB 4.37Å; F230-I234 HydrophobicContact CE1-CG1 3.8Å; F230-I234 HydrophobicContact CE2-CG1 4.08Å; F230-I234 HydrophobicContact CG-CG1 4.41Å; F230-I234 HydrophobicContact CZ-CG1 3.75Å; F230-I234 WeakPolarHBondContact O-CG1 3.33Å; F230-I234 PolarHBondContact O-N 3.27Å; F230-V243 HydrophobicContact CE2-CG1 4.23Å; F230-L263 HydrophobicContact CD2-CD1 4.16Å; F230-L263 HydrophobicContact CE2-CD1 3.65Å; F230-L263 HydrophobicContact CZ-CD1 4.47Å; F230-M267 HydrophobicContact CE1-CG 4.24Å; F230-M267 HydrophobicContact CE2-CG 4.2Å; F230-M267 HydrophobicContact CZ-CG 3.58Å; F230-K270 HydrophobicContact CD1-CB 4.18Å; F230-K270 HydrophobicContact CE1-CB 3.82Å; F230-K270 HydrophobicContact CE1-CG 4.16Å
231	S	89.2	Confident	89.1	Confident	38 Å²	38	36.2 Å²	36.2	27%	0.266	17%	0.168	S	C	.	.	H	α-helix	trans	-63.1	-29.5	-178	-74.2	0	0	0	0	112.9	Y229 K270 E273	Y229-S231 PolarHBondContact O-N 2.63Å; S231-K270 PolarHBondContact O-NZ 2.55Å; S231-E273 PolarHBondContact OG-OE1 3.32Å
232	S	89	Confident	89.5	Confident	21 Å²	21	30.4 Å²	30.4	15%	0.147	15%	0.146	C	C	.	.	H	α-helix	trans	-77.6	-27.8	179	-64.3	0	0	0	0	113.4	R201 Y229 F230 L751	R201-S232 PolarHBondContact NE-O 3.11Å; R201-S232 PolarHBondContact NH2-O 3.45Å; Y229-S232 PolarHBondContact O-N 3.03Å; F230-S232 PolarHBondContact O-N 3.31Å; S232-L751 WeakPolarHBondContact OG-CD2 3.36Å
233	C	92.1	Very high	89.8	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-85.2	-38.5	176.9	-65.2	0	0	0	0	113.1	R200 T209 I213 Y229 F230 R235	R200-C233 WeakPolarHBondContact CD-O 3.48Å; R200-C233 WeakPolarHBondContact CG-O 3.35Å; R200-C233 PolarHBondContact NE-O 3.43Å; T209-C233 HydrophobicContact CG2-CB 3.79Å; I213-C233 HydrophobicContact CD1-CB 3.5Å; I213-C233 VanDerWaalsContact CD1-CB 3.5Å; Y229-C233 PolarHBondContact O-N 2.76Å; Y229-C233 VanDerWaalsContact O-N 3.08Å; Y229-C233 PolarHBondContact O-SG 3.05Å; F230-C233 PolarHBondContact O-N 2.97Å; C233-R235 PolarHBondContact O-N 3.33Å
234	I	93	Very high	90	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.133	C	C	.	.			trans	-85.1	116.2	-177.6	-57.1	-50.2	0	0	0	108.9	N210 I213 F230 D239 W240 V243 K270 F274	N210-I234 WeakPolarHBondContact OD1-CD1 3.36Å; I213-I234 HydrophobicContact CD1-CD1 3.94Å; F230-I234 HydrophobicContact CD1-CG1 4.14Å; F230-I234 HydrophobicContact CD2-CG1 4.39Å; F230-I234 HydrophobicContact CE1-CB 4.37Å; F230-I234 HydrophobicContact CE1-CG1 3.8Å; F230-I234 HydrophobicContact CE2-CG1 4.08Å; F230-I234 HydrophobicContact CG-CG1 4.41Å; F230-I234 HydrophobicContact CZ-CG1 3.75Å; F230-I234 WeakPolarHBondContact O-CG1 3.33Å; F230-I234 PolarHBondContact O-N 3.27Å; I234-D239 HydrophobicContact CD1-CB 4.08Å; I234-D239 HydrophobicContact CG2-CB 4Å; I234-W240 HydrophobicContact CG2-CB 3.91Å; I234-V243 HydrophobicContact CD1-CG2 3.61Å; I234-K270 HydrophobicContact CB-CG 4.28Å; I234-K270 HydrophobicContact CG2-CG 4.01Å; I234-K270 WeakPolarHBondContact O-CE 3.31Å; I234-K270 PolarHBondContact O-NZ 3.2Å; I234-F274 HydrophobicContact CG2-CZ 4.13Å
235	R	86.9	Confident	90.3	Very high	134 Å²	134	24.7 Å²	24.7	51%	0.506	12%	0.116	S	C	.	.			trans	-112.3	-28.1	-177.9	-63.6	-176.6	66.2	-177.7	1.9	113.4	C233 D239	C233-R235 PolarHBondContact O-N 3.33Å; R235-D239 PolarHBondContact N-OD2 2.78Å
236	T	88.5	Confident	90.1	Very high	38 Å²	38	23.8 Å²	23.8	23%	0.233	11%	0.112	C	C	.	.	S	Bend	trans	-124.7	153.6	-178.9	74.3	0	0	0	0	111.5	S238 D239 W240	T236-S238 PolarHBondContact O-N 3.01Å; T236-S238 VanDerWaalsContact O-N 3.08Å; T236-S238 PolarHBondContact OG1-N 3.45Å; T236-D239 PolarHBondContact N-OD2 2.88Å; T236-D239 WeakPolarHBondContact O-CA 3.36Å; T236-D239 VanDerWaalsContact O-CB 3.31Å; T236-D239 WeakPolarHBondContact O-CB 3.27Å; T236-D239 PolarHBondContact O-N 3.31Å; T236-D239 PolarHBondContact OG1-N 2.8Å; T236-D239 PolarHBondContact OG1-OD1 2.96Å; T236-D239 PolarHBondContact OG1-OD2 2.82Å; T236-W240 PolarHBondContact O-N 2.93Å
237	P	89.8	Confident	90	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.006	12%	0.115	C	C	.	.	H	α-helix	trans	-54.7	-27.3	170.6	-27.5	32.4	0	0	0	113.5	W240 I241 F274 Q278 L279 H282 I328	P237-W240 WeakPolarHBondContact O-CB 3.48Å; P237-W240 PolarHBondContact O-N 3.45Å; P237-I241 WeakPolarHBondContact O-CD1 3.22Å; P237-I241 WeakPolarHBondContact O-CG1 3.2Å; P237-I241 PolarHBondContact O-N 3.34Å; P237-F274 HydrophobicContact CB-CD2 4.39Å; P237-F274 HydrophobicContact CB-CE2 4.31Å; P237-F274 HydrophobicContact CG-CB 4.38Å; P237-F274 HydrophobicContact CG-CD1 3.97Å; P237-F274 HydrophobicContact CG-CD2 3.99Å; P237-F274 HydrophobicContact CG-CE1 4.22Å; P237-F274 HydrophobicContact CG-CE2 4.25Å; P237-F274 HydrophobicContact CG-CG 3.86Å; P237-F274 HydrophobicContact CG-CZ 4.35Å; P237-Q278 HydrophobicContact CG-CB 3.91Å; P237-L279 HydrophobicContact CG-CD2 4.2Å; P237-H282 HydrophobicContact CB-CB 3.87Å; P237-H282 HydrophobicContact CG-CB 4.31Å; P237-I328 HydrophobicContact CB-CD1 4.24Å
238	S	86.9	Confident	89.9	Confident	13 Å²	13	17.2 Å²	17.2	9%	0.091	8%	0.083	C	C	.	.	H	α-helix	trans	-69.9	-33.2	174.7	-68.7	0	0	0	0	113.1	R206 T236 E242 H282	R206-S238 VanDerWaalsContact NH2-C 3.29Å; R206-S238 PolarHBondContact NH2-O 3.25Å; T236-S238 PolarHBondContact O-N 3.01Å; T236-S238 VanDerWaalsContact O-N 3.08Å; T236-S238 PolarHBondContact OG1-N 3.45Å; S238-E242 WeakPolarHBondContact O-CB 3.25Å; S238-E242 PolarHBondContact O-N 3.01Å; S238-E242 VanDerWaalsContact O-N 3.1Å; S238-H282 PolarHBondContact OG-CE1 3.15Å; S238-H282 VanDerWaalsContact OG-CE1 3.28Å; S238-H282 PolarHBondContact OG-ND1 2.75Å
239	D	90.3	Very high	89.7	Confident	0 Å²	0	14.8 Å²	14.8	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-65.4	-46.3	174.7	-52.4	-18.3	0	0	0	109.1	R200 R206 N210 I234 R235 T236 I241 E242 V243	R200-D239 IonicContact CZ-OD2 2.91Å; R200-D239 IonicContact NE-OD2 2.79Å; R200-D239 IonicContact NH2-OD1 2.68Å; R200-D239 IonicContact NH2-OD2 2.68Å; R200-D239 PolarHBondContact NH2-OD2 3.28Å; R206-D239 WeakPolarHBondContact CD-OD1 3.42Å; R206-D239 WeakPolarHBondContact CG-OD1 3.47Å; R206-D239 IonicContact CZ-OD1 3.88Å; R206-D239 IonicContact NE-OD1 3.63Å; R206-D239 PolarHBondContact NE-OD1 2.67Å; R206-D239 VanDerWaalsContact NE-OD1 3.13Å; R206-D239 IonicContact NH1-OD1 3.23Å; N210-D239 WeakPolarHBondContact ND2-CA 3.24Å; I234-D239 HydrophobicContact CD1-CB 4.08Å; I234-D239 HydrophobicContact CG2-CB 4Å; R235-D239 PolarHBondContact N-OD2 2.78Å; T236-D239 PolarHBondContact N-OD2 2.88Å; T236-D239 WeakPolarHBondContact O-CA 3.36Å; T236-D239 VanDerWaalsContact O-CB 3.31Å; T236-D239 WeakPolarHBondContact O-CB 3.27Å; T236-D239 PolarHBondContact O-N 3.31Å; T236-D239 PolarHBondContact OG1-N 2.8Å; T236-D239 PolarHBondContact OG1-OD1 2.96Å; T236-D239 PolarHBondContact OG1-OD2 2.82Å; D239-I241 VanDerWaalsContact C-N 3.33Å; D239-I241 PolarHBondContact O-N 3.34Å; D239-E242 PolarHBondContact O-N 3.26Å; D239-E242 VanDerWaalsContact O-N 3.1Å; D239-V243 PolarHBondContact O-N 3.49Å
240	W	94	Very high	89	Confident	1 Å²	1	14.9 Å²	14.9	0%	0.004	7%	0.074	C	C	.	.	H	α-helix	trans	-57.2	-42.6	177.2	-178.4	85.5	0	0	0	112.9	I234 T236 P237 M267 F271 F274 I328 L331 L335 I337	I234-W240 HydrophobicContact CG2-CB 3.91Å; T236-W240 PolarHBondContact O-N 2.93Å; P237-W240 WeakPolarHBondContact O-CB 3.48Å; P237-W240 PolarHBondContact O-N 3.45Å; W240-M267 HydrophobicContact CD2-CE 3.79Å; W240-M267 VanDerWaalsContact CE2-CE 3.44Å; W240-M267 HydrophobicContact CG-CE 3.96Å; W240-M267 HydrophobicContact CZ2-CE 3.94Å; W240-M267 PolarHBondContact NE1-O 2.93Å; W240-M267 WeakPolarHBondContact O-CE 3.13Å; W240-F271 HydrophobicContact CH2-CD2 4.15Å; W240-F271 HydrophobicContact CZ2-CB 4.47Å; W240-F271 HydrophobicContact CZ2-CD2 4.22Å; W240-F274 HydrophobicContact CB-CE2 3.91Å; W240-F274 HydrophobicContact CB-CZ 3.86Å; W240-F274 HydrophobicContact CD2-CE2 4.39Å; W240-F274 AromaticContact CG-CE2 3.93Å; W240-F274 HydrophobicContact CG-CE2 3.93Å; W240-F274 HydrophobicContact CG-CZ 4.28Å; W240-I328 HydrophobicContact CZ3-CG2 4.3Å; W240-L331 HydrophobicContact CE3-CD1 3.73Å; W240-L331 HydrophobicContact CH2-CB 3.39Å; W240-L331 HydrophobicContact CH2-CD1 3.99Å; W240-L331 HydrophobicContact CH2-CG 4.32Å; W240-L331 HydrophobicContact CZ2-CB 4.42Å; W240-L331 HydrophobicContact CZ3-CB 3.5Å; W240-L331 HydrophobicContact CZ3-CD1 3.39Å; W240-L331 HydrophobicContact CZ3-CG 4.09Å; W240-L335 HydrophobicContact CH2-CD1 3.9Å; W240-L335 HydrophobicContact CZ2-CD1 3.42Å; W240-L335 VanDerWaalsContact CZ2-CD1 3.42Å; W240-I337 HydrophobicContact CH2-CD1 3.92Å; W240-I337 HydrophobicContact CZ2-CD1 3.65Å
241	I	91.1	Very high	88.3	Confident	1 Å²	1	16 Å²	16	1%	0.005	8%	0.082	C	C	.	.	H	α-helix	trans	-65.4	-45.5	174.7	-62.6	161.3	0	0	0	111.1	P237 D239 V243 A244 E245 R288 F326 I328 L331	P237-I241 WeakPolarHBondContact O-CD1 3.22Å; P237-I241 WeakPolarHBondContact O-CG1 3.2Å; P237-I241 PolarHBondContact O-N 3.34Å; D239-I241 VanDerWaalsContact C-N 3.33Å; D239-I241 PolarHBondContact O-N 3.34Å; I241-V243 VanDerWaalsContact C-N 3.33Å; I241-V243 PolarHBondContact O-N 2.89Å; I241-A244 PolarHBondContact O-N 3.21Å; I241-A244 VanDerWaalsContact O-N 3.12Å; I241-E245 HydrophobicContact CG2-CG 4.1Å; I241-E245 WeakPolarHBondContact CG2-OE1 3.33Å; I241-E245 WeakPolarHBondContact O-CG 3.41Å; I241-E245 PolarHBondContact O-N 2.86Å; I241-R288 VanDerWaalsContact CG2-NH1 3.28Å; I241-F326 HydrophobicContact CG2-CB 4.13Å; I241-I328 HydrophobicContact CD1-CD1 4.34Å; I241-I328 HydrophobicContact CD1-CG1 3.6Å; I241-I328 HydrophobicContact CG1-CG1 4.17Å; I241-L331 HydrophobicContact CB-CD1 4.16Å; I241-L331 HydrophobicContact CG1-CD1 3.93Å; I241-L331 HydrophobicContact CG2-CD1 4.15Å
242	E	89.8	Confident	87.5	Confident	4 Å²	4	16 Å²	16	2%	0.019	9%	0.088	C	C	.	.	H	α-helix	trans	-66.7	-33.7	-173.6	-174	169.8	-146.7	0	0	112.3	R206 T207 N210 S238 D239 A244 E245 Y246 R323	R206-E242 IonicContact CZ-OE2 3.2Å; R206-E242 VanDerWaalsContact CZ-OE2 3.27Å; R206-E242 IonicContact NE-OE2 3.38Å; R206-E242 PolarHBondContact NE-OE2 3.4Å; R206-E242 IonicContact NH2-OE2 2.81Å; R206-E242 PolarHBondContact NH2-OE2 3.24Å; T207-E242 PolarHBondContact OG1-OE1 2.85Å; N210-E242 HydrophobicContact CB-CB 4.38Å; N210-E242 HydrophobicContact CB-CG 4.12Å; N210-E242 PolarHBondContact ND2-OE2 2.8Å; S238-E242 WeakPolarHBondContact O-CB 3.25Å; S238-E242 PolarHBondContact O-N 3.01Å; S238-E242 VanDerWaalsContact O-N 3.1Å; D239-E242 PolarHBondContact O-N 3.26Å; D239-E242 VanDerWaalsContact O-N 3.1Å; E242-A244 VanDerWaalsContact C-N 3.35Å; E242-A244 PolarHBondContact O-N 3.3Å; E242-E245 PolarHBondContact O-N 3.34Å; E242-Y246 HydrophobicContact CG-CD2 3.81Å; E242-Y246 HydrophobicContact CG-CE2 3.64Å; E242-Y246 VanDerWaalsContact O-CD2 3.28Å; E242-Y246 WeakPolarHBondContact O-CD2 3.42Å; E242-Y246 PolarHBondContact O-N 3.34Å; E242-R323 IonicContact OE1-NH2 2.8Å; E242-R323 PolarHBondContact OE1-NH2 3Å
243	V	91.7	Very high	86.8	Confident	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-59.4	-45.6	170.5	174.4	0	0	0	0	111.2	N210 I213 F230 I234 D239 I241 E245 Y246 Y247 L263	N210-V243 HydrophobicContact CB-CG2 3.77Å; I213-V243 HydrophobicContact CG2-CG1 4.05Å; I213-V243 HydrophobicContact CG2-CG2 4.5Å; F230-V243 HydrophobicContact CE2-CG1 4.23Å; I234-V243 HydrophobicContact CD1-CG2 3.61Å; D239-V243 PolarHBondContact O-N 3.49Å; I241-V243 VanDerWaalsContact C-N 3.33Å; I241-V243 PolarHBondContact O-N 2.89Å; V243-E245 VanDerWaalsContact C-N 3.34Å; V243-E245 PolarHBondContact O-N 2.8Å; V243-Y246 PolarHBondContact O-N 3.27Å; V243-Y247 WeakPolarHBondContact O-CB 3.18Å; V243-Y247 PolarHBondContact O-N 3.5Å; V243-L263 HydrophobicContact CG1-CD1 4.29Å
244	A	90.7	Very high	85.9	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-65.6	-37.1	176.3	0	0	0	0	0	112.4	I241 E242 Y247 A248 L256 M267 F326 L331	I241-A244 PolarHBondContact O-N 3.21Å; I241-A244 VanDerWaalsContact O-N 3.12Å; E242-A244 VanDerWaalsContact C-N 3.35Å; E242-A244 PolarHBondContact O-N 3.3Å; A244-Y247 PolarHBondContact O-N 3.02Å; A244-A248 VanDerWaalsContact O-CB 3.31Å; A244-A248 WeakPolarHBondContact O-CB 3.34Å; A244-A248 PolarHBondContact O-N 2.94Å; A244-L256 HydrophobicContact CB-CD1 4.39Å; A244-M267 HydrophobicContact CB-CE 3.97Å; A244-M267 HydrophobicContact CB-SD 4.46Å; A244-F326 HydrophobicContact CB-CD2 4.03Å; A244-F326 HydrophobicContact CB-CE2 4.25Å; A244-F326 WeakPolarHBondContact O-CE2 3.44Å; A244-L331 HydrophobicContact CB-CD1 4.16Å; A244-L331 HydrophobicContact CB-CD2 3.77Å
245	E	89.3	Confident	84.9	Confident	6 Å²	6	22 Å²	22	3%	0.028	12%	0.122	C	C	.	.	H	α-helix	trans	-61.9	-45.4	175	-69.3	172.9	170.8	0	0	111	I241 E242 V243 T249 R288 I324 Y325 F326	I241-E245 HydrophobicContact CG2-CG 4.1Å; I241-E245 WeakPolarHBondContact CG2-OE1 3.33Å; I241-E245 WeakPolarHBondContact O-CG 3.41Å; I241-E245 PolarHBondContact O-N 2.86Å; E242-E245 PolarHBondContact O-N 3.34Å; V243-E245 VanDerWaalsContact C-N 3.34Å; V243-E245 PolarHBondContact O-N 2.8Å; E245-T249 WeakPolarHBondContact O-CB 3.36Å; E245-T249 PolarHBondContact O-N 3.38Å; E245-T249 VanDerWaalsContact O-N 3.09Å; E245-T249 PolarHBondContact O-OG1 3.28Å; E245-R288 IonicContact OE1-CZ 3.88Å; E245-R288 IonicContact OE1-NH1 2.81Å; E245-R288 PolarHBondContact OE1-NH1 3.48Å; E245-I324 VanDerWaalsContact CG-O 3.25Å; E245-I324 WeakPolarHBondContact CG-O 3.17Å; E245-Y325 WeakPolarHBondContact OE1-CA 3.28Å; E245-F326 HydrophobicContact CG-CB 4.47Å; E245-F326 HydrophobicContact CG-CD2 3.86Å; E245-F326 HydrophobicContact CG-CG 4.37Å; E245-F326 PolarHBondContact OE1-N 2.94Å
246	Y	86.7	Confident	84.5	Confident	21 Å²	21	15.9 Å²	15.9	8%	0.082	10%	0.099	C	C	.	.	H	α-helix	trans	-64.2	-46.4	174.2	-84	-64.8	0	0	0	112	T207 N210 M211 E242 V243 A248 T249 I250 L318	T207-Y246 HydrophobicContact CG2-CE2 4.09Å; T207-Y246 WeakPolarHBondContact CG2-OH 3.48Å; N210-Y246 HydrophobicContact CB-CD2 4.31Å; M211-Y246 HydrophobicContact CB-CD1 4.26Å; M211-Y246 HydrophobicContact CB-CD2 4.22Å; M211-Y246 HydrophobicContact CB-CE1 4.15Å; M211-Y246 HydrophobicContact CB-CE2 4.13Å; M211-Y246 HydrophobicContact CB-CG 4.31Å; M211-Y246 HydrophobicContact CG-CD1 4.24Å; M211-Y246 HydrophobicContact CG-CE1 4.19Å; M211-Y246 HydrophobicContact SD-CE1 4.37Å; E242-Y246 HydrophobicContact CG-CD2 3.81Å; E242-Y246 HydrophobicContact CG-CE2 3.64Å; E242-Y246 VanDerWaalsContact O-CD2 3.28Å; E242-Y246 WeakPolarHBondContact O-CD2 3.42Å; E242-Y246 PolarHBondContact O-N 3.34Å; V243-Y246 PolarHBondContact O-N 3.27Å; Y246-A248 PolarHBondContact O-N 2.9Å; Y246-T249 WeakPolarHBondContact O-CB 3.34Å; Y246-T249 PolarHBondContact O-N 2.93Å; Y246-T249 VanDerWaalsContact O-N 3.09Å; Y246-I250 WeakPolarHBondContact O-CD1 2.95Å; Y246-I250 VanDerWaalsContact O-CG1 3.28Å; Y246-I250 WeakPolarHBondContact O-CG1 3.27Å; Y246-I250 PolarHBondContact O-N 3.48Å; Y246-L318 HydrophobicContact CD1-CD2 3.91Å; Y246-L318 HydrophobicContact CE1-CD2 4.3Å
247	Y	88.1	Confident	83.7	Confident	16 Å²	16	21.8 Å²	21.8	6%	0.063	12%	0.122	C	C	.	.	H	α-helix	trans	-60.8	-42.8	178.9	-178.9	-88.9	0	0	0	112.1	V243 A244 T249 I250 S251 L256 M259 P260 L263	V243-Y247 WeakPolarHBondContact O-CB 3.18Å; V243-Y247 PolarHBondContact O-N 3.5Å; A244-Y247 PolarHBondContact O-N 3.02Å; Y247-T249 VanDerWaalsContact C-N 3.27Å; Y247-T249 PolarHBondContact O-N 2.88Å; Y247-I250 PolarHBondContact O-N 2.92Å; Y247-S251 VanDerWaalsContact O-CB 3.3Å; Y247-S251 WeakPolarHBondContact O-CB 3.38Å; Y247-S251 PolarHBondContact O-N 3.14Å; Y247-S251 PolarHBondContact O-OG 2.87Å; Y247-L256 HydrophobicContact CD1-CD2 3.8Å; Y247-L256 HydrophobicContact CE1-CD2 4.42Å; Y247-M259 HydrophobicContact CD1-CE 3.9Å; Y247-M259 HydrophobicContact CD1-CG 4.5Å; Y247-M259 HydrophobicContact CE1-CB 3.96Å; Y247-M259 HydrophobicContact CE1-CE 4.34Å; Y247-M259 HydrophobicContact CE1-CG 4.12Å; Y247-M259 HydrophobicContact CG-CE 4.45Å; Y247-P260 HydrophobicContact CE2-CG 4.33Å; Y247-P260 WeakPolarHBondContact OH-CD 3.2Å; Y247-L263 HydrophobicContact CD2-CD2 3.66Å; Y247-L263 HydrophobicContact CE2-CD2 4.14Å; Y247-L263 HydrophobicContact CG-CD2 3.94Å
248	A	86.4	Confident	82.9	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-62.8	-36.1	175.3	0	0	0	0	0	112.1	A244 Y246 G252 N253 L256 I324 F326	A244-A248 VanDerWaalsContact O-CB 3.31Å; A244-A248 WeakPolarHBondContact O-CB 3.34Å; A244-A248 PolarHBondContact O-N 2.94Å; Y246-A248 PolarHBondContact O-N 2.9Å; A248-G252 PolarHBondContact O-N 2.91Å; A248-N253 PolarHBondContact O-N 3.46Å; A248-L256 HydrophobicContact CB-CD2 3.78Å; A248-I324 HydrophobicContact CB-CD1 3.71Å; A248-I324 HydrophobicContact CB-CG2 4.41Å; A248-F326 HydrophobicContact CB-CE2 3.73Å; A248-F326 HydrophobicContact CB-CZ 3.65Å
249	T	82.9	Confident	82.9	Confident	15 Å²	15	24.5 Å²	24.5	9%	0.092	15%	0.151	C	C	.	.	H	α-helix	trans	-69.2	-46	178.7	-54.9	0	0	0	0	110.4	E245 Y246 Y247 G252	E245-T249 WeakPolarHBondContact O-CB 3.36Å; E245-T249 PolarHBondContact O-N 3.38Å; E245-T249 VanDerWaalsContact O-N 3.09Å; E245-T249 PolarHBondContact O-OG1 3.28Å; Y246-T249 WeakPolarHBondContact O-CB 3.34Å; Y246-T249 PolarHBondContact O-N 2.93Å; Y246-T249 VanDerWaalsContact O-N 3.09Å; Y247-T249 VanDerWaalsContact C-N 3.27Å; Y247-T249 PolarHBondContact O-N 2.88Å; T249-G252 PolarHBondContact O-N 3.48Å
250	I	78.5	Confident	82.8	Confident	1 Å²	1	25.2 Å²	25.2	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-67.8	-48.2	-179.8	-66.9	160.6	0	0	0	111.2	A214 V215 C218 Y246 Y247 G252 I314 R317 L318	A214-I250 HydrophobicContact CB-CD1 3.84Å; V215-I250 HydrophobicContact CG2-CD1 3.65Å; C218-I250 HydrophobicContact CB-CG2 4.26Å; C218-I250 WeakPolarHBondContact SG-CG2 3.3Å; Y246-I250 WeakPolarHBondContact O-CD1 2.95Å; Y246-I250 VanDerWaalsContact O-CG1 3.28Å; Y246-I250 WeakPolarHBondContact O-CG1 3.27Å; Y246-I250 PolarHBondContact O-N 3.48Å; Y247-I250 PolarHBondContact O-N 2.92Å; I250-G252 PolarHBondContact O-N 3.5Å; I250-I314 HydrophobicContact CG1-CG2 4.4Å; I250-I314 HydrophobicContact CG2-CB 4.35Å; I250-I314 HydrophobicContact CG2-CD1 4.3Å; I250-I314 HydrophobicContact CG2-CG1 4.04Å; I250-I314 HydrophobicContact CG2-CG2 3.58Å; I250-R317 PolarHBondContact O-NE 2.83Å; I250-R317 PolarHBondContact O-NH1 2.74Å; I250-L318 HydrophobicContact CD1-CD1 4.26Å; I250-L318 HydrophobicContact CD1-CD2 4.04Å; I250-L318 HydrophobicContact CD1-CG 4.41Å; I250-L318 HydrophobicContact CG1-CD1 3.9Å; I250-L318 HydrophobicContact CG1-CD2 3.63Å; I250-L318 HydrophobicContact CG1-CG 3.7Å
251	S	78.3	Confident	82.6	Confident	25 Å²	25	33.9 Å²	33.9	18%	0.175	19%	0.193	C	C	.	.	H	α-helix	trans	-71.3	-12.8	-179.5	60.1	0	0	0	0	113.3	Y247 N253	Y247-S251 VanDerWaalsContact O-CB 3.3Å; Y247-S251 WeakPolarHBondContact O-CB 3.38Å; Y247-S251 PolarHBondContact O-N 3.14Å; Y247-S251 PolarHBondContact O-OG 2.87Å; S251-N253 PolarHBondContact O-N 3.17Å; S251-N253 PolarHBondContact OG-N 2.77Å
252	G	72.9	Confident	82.5	Confident	39 Å²	39	36.3 Å²	36.3	40%	0.402	21%	0.208	S	C	.	.	S	Bend	trans	65.5	-3.4	-169	0	0	0	0	0	114.1	A248 T249 I250 L254	A248-G252 PolarHBondContact O-N 2.91Å; T249-G252 PolarHBondContact O-N 3.48Å; I250-G252 PolarHBondContact O-N 3.5Å; G252-L254 PolarHBondContact O-N 3.34Å
253	N	75.5	Confident	82.6	Confident	57 Å²	57	36.1 Å²	36.1	31%	0.305	21%	0.207	S	C	.	.			trans	-99.7	91.6	-175.8	-165.3	-25.3	0	0	0	111.5	A248 S251 S255 L256 K257	A248-N253 PolarHBondContact O-N 3.46Å; S251-N253 PolarHBondContact O-N 3.17Å; S251-N253 PolarHBondContact OG-N 2.77Å; N253-S255 PolarHBondContact O-N 3.18Å; N253-S255 WeakPolarHBondContact OD1-CB 3.41Å; N253-S255 PolarHBondContact OD1-N 2.93Å; N253-L256 PolarHBondContact O-N 3.24Å; N253-K257 PolarHBondContact ND2-O 2.85Å
254	L	72.4	Confident	82.6	Confident	46 Å²	46	39.5 Å²	39.5	24%	0.241	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-22.5	175.6	-77.9	136.8	0	0	0	114.5	G252 L256 K299 I324	G252-L254 PolarHBondContact O-N 3.34Å; L254-L256 VanDerWaalsContact C-N 3.31Å; L254-K299 HydrophobicContact CD1-CD 4.46Å; L254-K299 HydrophobicContact CD1-CG 4.1Å; L254-I324 HydrophobicContact CD2-CB 4.43Å; L254-I324 HydrophobicContact CD2-CD1 3.61Å; L254-I324 HydrophobicContact CD2-CG1 3.78Å; L254-I324 HydrophobicContact CD2-CG2 3.8Å; L254-I324 HydrophobicContact CG-CD1 3.91Å
255	S	72.3	Confident	82.7	Confident	43 Å²	43	42.7 Å²	42.7	30%	0.301	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-7.2	-179.7	-53.7	0	0	0	0	112.6	N253 K257 K299	N253-S255 PolarHBondContact O-N 3.18Å; N253-S255 WeakPolarHBondContact OD1-CB 3.41Å; N253-S255 PolarHBondContact OD1-N 2.93Å; S255-K257 PolarHBondContact O-N 3.44Å; S255-K299 PolarHBondContact OG-NZ 3.48Å
256	L	78.7	Confident	82.8	Confident	6 Å²	6	42.8 Å²	42.8	3%	0.031	24%	0.243	C	C	.	.			trans	56.4	15.9	-172.4	-56.6	174.3	0	0	0	113.5	A244 Y247 A248 N253 L254 G258 M259 R264 F326 L331	A244-L256 HydrophobicContact CB-CD1 4.39Å; Y247-L256 HydrophobicContact CD1-CD2 3.8Å; Y247-L256 HydrophobicContact CE1-CD2 4.42Å; A248-L256 HydrophobicContact CB-CD2 3.78Å; N253-L256 PolarHBondContact O-N 3.24Å; L254-L256 VanDerWaalsContact C-N 3.31Å; L256-G258 PolarHBondContact O-N 3.02Å; L256-M259 HydrophobicContact CB-CE 4.3Å; L256-M259 HydrophobicContact CD1-CE 4.09Å; L256-M259 HydrophobicContact CD2-CE 3.86Å; L256-M259 HydrophobicContact CG-CE 4.31Å; L256-M259 PolarHBondContact O-N 3.43Å; L256-R264 PolarHBondContact O-NH2 3.45Å; L256-F326 HydrophobicContact CD1-CE2 4.14Å; L256-F326 HydrophobicContact CD1-CZ 4.45Å; L256-F326 HydrophobicContact CD2-CE2 4.29Å; L256-F326 HydrophobicContact CG-CE2 4.39Å; L256-F326 HydrophobicContact CG-CZ 4.39Å; L256-L331 HydrophobicContact CD1-CD2 3.73Å
257	K	70.6	Confident	83.2	Confident	162 Å²	162	41.8 Å²	41.8	70%	0.704	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.4	130.2	171.4	-73.1	-172.2	175.4	-171.6	0	107.3	N253 S255	N253-K257 PolarHBondContact ND2-O 2.85Å; S255-K257 PolarHBondContact O-N 3.44Å
258	G	74.8	Confident	83.4	Confident	66 Å²	66	43.6 Å²	43.6	68%	0.68	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.5	9.2	-174.3	0	0	0	0	0	116	L256	L256-G258 PolarHBondContact O-N 3.02Å
259	M	86.6	Confident	83.7	Confident	5 Å²	5	46.4 Å²	46.4	3%	0.025	27%	0.269	C	S	.	.			trans	-54.6	133.9	168.9	179.9	-175.6	-76.3	0	0	110.7	Y247 L256 L263 R264 M267 L335	Y247-M259 HydrophobicContact CD1-CE 3.9Å; Y247-M259 HydrophobicContact CD1-CG 4.5Å; Y247-M259 HydrophobicContact CE1-CB 3.96Å; Y247-M259 HydrophobicContact CE1-CE 4.34Å; Y247-M259 HydrophobicContact CE1-CG 4.12Å; Y247-M259 HydrophobicContact CG-CE 4.45Å; L256-M259 HydrophobicContact CB-CE 4.3Å; L256-M259 HydrophobicContact CD1-CE 4.09Å; L256-M259 HydrophobicContact CD2-CE 3.86Å; L256-M259 HydrophobicContact CG-CE 4.31Å; L256-M259 PolarHBondContact O-N 3.43Å; M259-L263 HydrophobicContact CE-CD2 4.12Å; M259-L263 HydrophobicContact CG-CB 4.16Å; M259-L263 HydrophobicContact CG-CD2 3.87Å; M259-L263 HydrophobicContact CG-CG 4.1Å; M259-L263 HydrophobicContact SD-CB 4.42Å; M259-L263 HydrophobicContact SD-CD2 4Å; M259-L263 HydrophobicContact SD-CG 3.92Å; M259-R264 HydrophobicContact CG-CB 4.39Å; M259-R264 PolarHBondContact O-NH1 2.8Å; M259-R264 HydrophobicContact SD-CB 4Å; M259-M267 HydrophobicContact CE-SD 4.09Å; M259-M267 HydrophobicContact SD-SD 4.19Å; M259-L335 HydrophobicContact CE-CD2 4.4Å; M259-L335 HydrophobicContact SD-CD2 3.92Å
260	P	88.4	Confident	84.2	Confident	15 Å²	15	46.5 Å²	46.5	10%	0.097	27%	0.268	C	S	.	.			trans	-51.2	139.3	177.6	-26.9	27.3	0	0	0	112	S217 Y247 V262 L263 R264	S217-P260 WeakPolarHBondContact O-CG 3.08Å; Y247-P260 HydrophobicContact CE2-CG 4.33Å; Y247-P260 WeakPolarHBondContact OH-CD 3.2Å; P260-V262 PolarHBondContact O-N 3.02Å; P260-L263 HydrophobicContact CB-CB 4.37Å; P260-L263 PolarHBondContact O-N 3.44Å; P260-R264 PolarHBondContact O-N 3.24Å
261	K	88.7	Confident	84.9	Confident	184 Å²	184	46.5 Å²	46.5	80%	0.8	27%	0.268	S	S	*	.	H	α-helix	trans	-56	-38.3	-179.9	-168.8	177.8	-179.7	-178.8	0	111.7	S265	K261-S265 VanDerWaalsContact O-CB 3.22Å; K261-S265 WeakPolarHBondContact O-CB 3.25Å; K261-S265 PolarHBondContact O-N 3.25Å
262	V	88.8	Confident	85.4	Confident	51 Å²	51	49.5 Å²	49.5	31%	0.309	28%	0.282	S	S	.	.	H	α-helix	trans	-65.3	-46.9	178.7	-175.5	0	0	0	0	112	I226 K227 P260 S265 S266	I226-V262 HydrophobicContact CB-CG1 3.97Å; I226-V262 HydrophobicContact CG2-CG1 4.24Å; K227-V262 HydrophobicContact CB-CG1 4.18Å; P260-V262 PolarHBondContact O-N 3.02Å; V262-S265 PolarHBondContact O-N 3.38Å; V262-S266 WeakPolarHBondContact O-CB 3.36Å; V262-S266 PolarHBondContact O-N 3.16Å; V262-S266 PolarHBondContact O-OG 2.97Å
263	L	92.1	Very high	86.2	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-64.3	-46.3	177.1	178	61.2	0	0	0	110.7	F230 V243 Y247 M259 P260 S265 S266 M267	F230-L263 HydrophobicContact CD2-CD1 4.16Å; F230-L263 HydrophobicContact CE2-CD1 3.65Å; F230-L263 HydrophobicContact CZ-CD1 4.47Å; V243-L263 HydrophobicContact CG1-CD1 4.29Å; Y247-L263 HydrophobicContact CD2-CD2 3.66Å; Y247-L263 HydrophobicContact CE2-CD2 4.14Å; Y247-L263 HydrophobicContact CG-CD2 3.94Å; M259-L263 HydrophobicContact CE-CD2 4.12Å; M259-L263 HydrophobicContact CG-CB 4.16Å; M259-L263 HydrophobicContact CG-CD2 3.87Å; M259-L263 HydrophobicContact CG-CG 4.1Å; M259-L263 HydrophobicContact SD-CB 4.42Å; M259-L263 HydrophobicContact SD-CD2 4Å; M259-L263 HydrophobicContact SD-CG 3.92Å; P260-L263 HydrophobicContact CB-CB 4.37Å; P260-L263 PolarHBondContact O-N 3.44Å; L263-S265 PolarHBondContact O-N 2.8Å; L263-S266 PolarHBondContact O-N 3.07Å; L263-M267 HydrophobicContact CD1-CG 4.07Å; L263-M267 HydrophobicContact CD1-SD 4.34Å; L263-M267 HydrophobicContact CG-CG 4.42Å; L263-M267 HydrophobicContact CG-SD 4.36Å; L263-M267 WeakPolarHBondContact O-CB 3.49Å; L263-M267 VanDerWaalsContact O-CG 3.31Å; L263-M267 WeakPolarHBondContact O-CG 3.41Å; L263-M267 PolarHBondContact O-N 2.78Å
264	R	92.5	Very high	86.9	Confident	71 Å²	71	50 Å²	50	27%	0.268	27%	0.272	S	S	.	.	H	α-helix	trans	-57.3	-49.2	177.2	-178.3	179	-70	98.6	-0.6	111.1	L256 M259 P260 M267 I268 L335	L256-R264 PolarHBondContact O-NH2 3.45Å; M259-R264 HydrophobicContact CG-CB 4.39Å; M259-R264 PolarHBondContact O-NH1 2.8Å; M259-R264 HydrophobicContact SD-CB 4Å; P260-R264 PolarHBondContact O-N 3.24Å; R264-M267 PolarHBondContact O-N 3.23Å; R264-I268 HydrophobicContact CG-CD1 3.84Å; R264-I268 VanDerWaalsContact O-CG1 3.24Å; R264-I268 WeakPolarHBondContact O-CG1 3.41Å; R264-I268 PolarHBondContact O-N 3.19Å; R264-L335 HydrophobicContact CG-CD2 4.03Å
265	S	91.5	Very high	87.5	Confident	66 Å²	66	51.2 Å²	51.2	46%	0.462	28%	0.279	S	S	.	.	H	α-helix	trans	-61.2	-45.8	178.6	-176.6	0	0	0	0	112	K261 V262 L263 M267 I268 S269	K261-S265 VanDerWaalsContact O-CB 3.22Å; K261-S265 WeakPolarHBondContact O-CB 3.25Å; K261-S265 PolarHBondContact O-N 3.25Å; V262-S265 PolarHBondContact O-N 3.38Å; L263-S265 PolarHBondContact O-N 2.8Å; S265-M267 VanDerWaalsContact C-N 3.33Å; S265-M267 PolarHBondContact O-N 3.13Å; S265-I268 PolarHBondContact O-N 2.85Å; S265-S269 WeakPolarHBondContact O-CB 3.44Å; S265-S269 PolarHBondContact O-N 3.19Å
266	S	93.1	Very high	88.1	Confident	8 Å²	8	53 Å²	53	6%	0.056	28%	0.282	C	S	.	.	H	α-helix	trans	-63.2	-39.3	178.5	-54	0	0	0	0	111.9	V262 L263 K270	V262-S266 WeakPolarHBondContact O-CB 3.36Å; V262-S266 PolarHBondContact O-N 3.16Å; V262-S266 PolarHBondContact O-OG 2.97Å; L263-S266 PolarHBondContact O-N 3.07Å; S266-K270 VanDerWaalsContact O-CB 3.26Å; S266-K270 WeakPolarHBondContact O-CB 3.22Å; S266-K270 PolarHBondContact O-N 2.8Å
267	M	94.3	Very high	88.1	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-65.7	-41.8	174.8	-74.8	-166.1	75.2	0	0	112.6	F230 W240 A244 M259 L263 R264 S265 F271 L335	F230-M267 HydrophobicContact CE1-CG 4.24Å; F230-M267 HydrophobicContact CE2-CG 4.2Å; F230-M267 HydrophobicContact CZ-CG 3.58Å; W240-M267 HydrophobicContact CD2-CE 3.79Å; W240-M267 VanDerWaalsContact CE2-CE 3.44Å; W240-M267 HydrophobicContact CG-CE 3.96Å; W240-M267 HydrophobicContact CZ2-CE 3.94Å; W240-M267 PolarHBondContact NE1-O 2.93Å; W240-M267 WeakPolarHBondContact O-CE 3.13Å; A244-M267 HydrophobicContact CB-CE 3.97Å; A244-M267 HydrophobicContact CB-SD 4.46Å; M259-M267 HydrophobicContact CE-SD 4.09Å; M259-M267 HydrophobicContact SD-SD 4.19Å; L263-M267 HydrophobicContact CD1-CG 4.07Å; L263-M267 HydrophobicContact CD1-SD 4.34Å; L263-M267 HydrophobicContact CG-CG 4.42Å; L263-M267 HydrophobicContact CG-SD 4.36Å; L263-M267 WeakPolarHBondContact O-CB 3.49Å; L263-M267 VanDerWaalsContact O-CG 3.31Å; L263-M267 WeakPolarHBondContact O-CG 3.41Å; L263-M267 PolarHBondContact O-N 2.78Å; R264-M267 PolarHBondContact O-N 3.23Å; S265-M267 VanDerWaalsContact C-N 3.33Å; S265-M267 PolarHBondContact O-N 3.13Å; M267-F271 PolarHBondContact O-N 3.12Å; M267-L335 HydrophobicContact CB-CD1 4.11Å; M267-L335 HydrophobicContact CE-CD1 3.94Å; M267-L335 HydrophobicContact SD-CD1 4.27Å
268	I	93	Very high	88.7	Confident	55 Å²	55	51.7 Å²	51.7	28%	0.282	28%	0.275	S	S	.	.	H	α-helix	trans	-65.2	-49.1	177.3	-67.7	165.4	0	0	0	109.8	R264 S265 K270 F271 L335 I337	R264-I268 HydrophobicContact CG-CD1 3.84Å; R264-I268 VanDerWaalsContact O-CG1 3.24Å; R264-I268 WeakPolarHBondContact O-CG1 3.41Å; R264-I268 PolarHBondContact O-N 3.19Å; S265-I268 PolarHBondContact O-N 2.85Å; I268-K270 VanDerWaalsContact C-N 3.33Å; I268-K270 PolarHBondContact O-N 2.79Å; I268-F271 WeakPolarHBondContact O-CB 3.37Å; I268-F271 PolarHBondContact O-N 2.84Å; I268-L335 WeakPolarHBondContact CD1-O 3.35Å; I268-L335 HydrophobicContact CG1-CB 4.3Å; I268-I337 HydrophobicContact CG1-CG1 3.99Å; I268-I337 HydrophobicContact CG2-CG1 4.5Å
269	S	91.4	Very high	89.3	Confident	59 Å²	59	48.6 Å²	48.6	41%	0.413	24%	0.243	S	C	.	.	H	α-helix	trans	-59	-44.5	178.7	178.8	0	0	0	0	111.3	S265 F271 L272	S265-S269 WeakPolarHBondContact O-CB 3.44Å; S265-S269 PolarHBondContact O-N 3.19Å; S269-F271 VanDerWaalsContact C-N 3.28Å; S269-F271 PolarHBondContact O-N 3.3Å; S269-L272 VanDerWaalsContact O-CB 3.32Å; S269-L272 WeakPolarHBondContact O-CB 3.25Å; S269-L272 PolarHBondContact O-N 3.21Å; S269-L272 VanDerWaalsContact O-N 3.15Å
270	K	93.4	Very high	89	Confident	17 Å²	17	49.2 Å²	49.2	7%	0.074	25%	0.249	C	C	.	.	H	α-helix	trans	-65.9	-28.9	179.2	-173.4	57	-179.6	-166.1	0	113.7	F230 S231 I234 S266 I268 L272 E273 F274	F230-K270 HydrophobicContact CD1-CB 4.18Å; F230-K270 HydrophobicContact CE1-CB 3.82Å; F230-K270 HydrophobicContact CE1-CG 4.16Å; S231-K270 PolarHBondContact O-NZ 2.55Å; I234-K270 HydrophobicContact CB-CG 4.28Å; I234-K270 HydrophobicContact CG2-CG 4.01Å; I234-K270 WeakPolarHBondContact O-CE 3.31Å; I234-K270 PolarHBondContact O-NZ 3.2Å; S266-K270 VanDerWaalsContact O-CB 3.26Å; S266-K270 WeakPolarHBondContact O-CB 3.22Å; S266-K270 PolarHBondContact O-N 2.8Å; I268-K270 VanDerWaalsContact C-N 3.33Å; I268-K270 PolarHBondContact O-N 2.79Å; K270-L272 PolarHBondContact O-N 3.39Å; K270-E273 HydrophobicContact CD-CB 4.29Å; K270-E273 HydrophobicContact CD-CG 4.34Å; K270-E273 WeakPolarHBondContact CD-OE2 3.35Å; K270-E273 WeakPolarHBondContact CE-OE2 3.38Å; K270-E273 IonicContact NZ-OE2 2.71Å; K270-E273 PolarHBondContact NZ-OE2 3.3Å; K270-E273 PolarHBondContact O-N 2.82Å; K270-F274 HydrophobicContact CG-CE1 4.43Å; K270-F274 HydrophobicContact CG-CE2 4.5Å; K270-F274 HydrophobicContact CG-CZ 3.98Å
271	F	93.3	Very high	88.3	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-62.7	-31.9	176.2	-176.5	-89.2	0	0	0	112.1	W240 M267 I268 S269 E273 F274 L279 I328 I332 I337 V344	W240-F271 HydrophobicContact CH2-CD2 4.15Å; W240-F271 HydrophobicContact CZ2-CB 4.47Å; W240-F271 HydrophobicContact CZ2-CD2 4.22Å; M267-F271 PolarHBondContact O-N 3.12Å; I268-F271 WeakPolarHBondContact O-CB 3.37Å; I268-F271 PolarHBondContact O-N 2.84Å; S269-F271 VanDerWaalsContact C-N 3.28Å; S269-F271 PolarHBondContact O-N 3.3Å; F271-E273 PolarHBondContact O-N 3.39Å; F271-F274 HydrophobicContact CD2-CD2 4.24Å; F271-F274 PolarHBondContact O-N 2.95Å; F271-L279 HydrophobicContact CE2-CD2 3.85Å; F271-L279 HydrophobicContact CZ-CD1 4.21Å; F271-L279 HydrophobicContact CZ-CD2 4.24Å; F271-I328 HydrophobicContact CE2-CG2 4.02Å; F271-I332 HydrophobicContact CE2-CD1 4Å; F271-I332 HydrophobicContact CE2-CG1 4.04Å; F271-I332 HydrophobicContact CZ-CD1 3.74Å; F271-I332 HydrophobicContact CZ-CG1 4.08Å; F271-I337 HydrophobicContact CB-CD1 4.02Å; F271-I337 HydrophobicContact CD1-CD1 4.44Å; F271-I337 HydrophobicContact CD1-CG2 3.53Å; F271-I337 HydrophobicContact CD2-CD1 4.19Å; F271-I337 HydrophobicContact CE1-CG2 3.8Å; F271-I337 HydrophobicContact CG-CD1 3.96Å; F271-I337 HydrophobicContact CG-CG2 4.14Å; F271-V344 HydrophobicContact CE1-CG2 3.89Å; F271-V344 HydrophobicContact CZ-CG2 4.4Å
272	L	89.7	Confident	87.8	Confident	88 Å²	88	46.3 Å²	46.3	46%	0.461	24%	0.235	S	C	.	.	H	α-helix	trans	-65.5	-26.3	177.4	-54.8	176.6	0	0	0	112.5	S269 K270 F274 K339 P340	S269-L272 VanDerWaalsContact O-CB 3.32Å; S269-L272 WeakPolarHBondContact O-CB 3.25Å; S269-L272 PolarHBondContact O-N 3.21Å; S269-L272 VanDerWaalsContact O-N 3.15Å; K270-L272 PolarHBondContact O-N 3.39Å; L272-F274 VanDerWaalsContact C-N 3.34Å; L272-K339 HydrophobicContact CD2-CB 3.97Å; L272-K339 WeakPolarHBondContact CD2-O 3.32Å; L272-P340 HydrophobicContact CD2-CG 4.44Å
273	E	89.6	Confident	87	Confident	101 Å²	101	45.6 Å²	45.6	47%	0.472	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-13	180	-59.7	175.6	-142.2	0	0	113.1	S231 K270 F271 D275	S231-E273 PolarHBondContact OG-OE1 3.32Å; K270-E273 HydrophobicContact CD-CB 4.29Å; K270-E273 HydrophobicContact CD-CG 4.34Å; K270-E273 WeakPolarHBondContact CD-OE2 3.35Å; K270-E273 WeakPolarHBondContact CE-OE2 3.38Å; K270-E273 IonicContact NZ-OE2 2.71Å; K270-E273 PolarHBondContact NZ-OE2 3.3Å; K270-E273 PolarHBondContact O-N 2.82Å; F271-E273 PolarHBondContact O-N 3.39Å; E273-D275 PolarHBondContact O-N 3.43Å
274	F	90.8	Very high	85.7	Confident	5 Å²	5	53 Å²	53	2%	0.022	27%	0.265	C	S	.	.			trans	-79.3	120.3	-179.1	-63.6	-41.5	0	0	0	111.4	I234 P237 W240 K270 F271 L272 Q278 L279	I234-F274 HydrophobicContact CG2-CZ 4.13Å; P237-F274 HydrophobicContact CB-CD2 4.39Å; P237-F274 HydrophobicContact CB-CE2 4.31Å; P237-F274 HydrophobicContact CG-CB 4.38Å; P237-F274 HydrophobicContact CG-CD1 3.97Å; P237-F274 HydrophobicContact CG-CD2 3.99Å; P237-F274 HydrophobicContact CG-CE1 4.22Å; P237-F274 HydrophobicContact CG-CE2 4.25Å; P237-F274 HydrophobicContact CG-CG 3.86Å; P237-F274 HydrophobicContact CG-CZ 4.35Å; W240-F274 HydrophobicContact CB-CE2 3.91Å; W240-F274 HydrophobicContact CB-CZ 3.86Å; W240-F274 HydrophobicContact CD2-CE2 4.39Å; W240-F274 AromaticContact CG-CE2 3.93Å; W240-F274 HydrophobicContact CG-CE2 3.93Å; W240-F274 HydrophobicContact CG-CZ 4.28Å; K270-F274 HydrophobicContact CG-CE1 4.43Å; K270-F274 HydrophobicContact CG-CE2 4.5Å; K270-F274 HydrophobicContact CG-CZ 3.98Å; F271-F274 HydrophobicContact CD2-CD2 4.24Å; F271-F274 PolarHBondContact O-N 2.95Å; L272-F274 VanDerWaalsContact C-N 3.34Å; F274-Q278 VanDerWaalsContact CD1-OE1 3.26Å; F274-L279 HydrophobicContact CB-CD1 4.39Å; F274-L279 HydrophobicContact CB-CD2 4Å; F274-L279 HydrophobicContact CB-CG 3.98Å; F274-L279 HydrophobicContact CD2-CD2 4.28Å
275	D	84.4	Confident	84.1	Confident	73 Å²	73	54 Å²	54	39%	0.39	27%	0.272	S	S	.	.			trans	-68.1	163	173.6	66.2	47.9	0	0	0	112.6	E273 Y277 Q278 L279	E273-D275 PolarHBondContact O-N 3.43Å; D275-Y277 PolarHBondContact O-N 3.44Å; D275-Y277 WeakPolarHBondContact OD1-CA 3.29Å; D275-Y277 WeakPolarHBondContact OD1-CB 3.49Å; D275-Y277 PolarHBondContact OD1-N 3.04Å; D275-Y277 VanDerWaalsContact OD1-N 3.09Å; D275-Q278 PolarHBondContact O-N 3.34Å; D275-Q278 WeakPolarHBondContact OD1-CB 3.39Å; D275-Q278 WeakPolarHBondContact OD1-CG 3.41Å; D275-Q278 PolarHBondContact OD1-N 3.14Å; D275-Q278 PolarHBondContact OD2-NE2 2.96Å; D275-L279 WeakPolarHBondContact O-CG 3.2Å; D275-L279 PolarHBondContact O-N 2.84Å; D275-L279 VanDerWaalsContact O-N 3.14Å
276	E	84.6	Confident	82.5	Confident	80 Å²	80	61.4 Å²	61.4	37%	0.374	29%	0.29	S	S	.	.	H	α-helix	trans	-58.9	-35.8	179.9	-64.1	-178.3	-169.6	0	0	112.5	L279 A280 F379 P380	E276-L279 PolarHBondContact O-N 3.49Å; E276-A280 WeakPolarHBondContact O-CB 3.35Å; E276-A280 PolarHBondContact O-N 3.26Å; E276-F379 HydrophobicContact CB-CD1 3.89Å; E276-F379 HydrophobicContact CB-CE1 4.2Å; E276-F379 HydrophobicContact CG-CD1 4.11Å; E276-F379 HydrophobicContact CG-CE1 4.16Å; E276-P380 WeakPolarHBondContact OE2-CG 3.46Å
277	Y	79.2	Confident	81.1	Confident	94 Å²	94	64.2 Å²	64.2	37%	0.369	31%	0.314	S	S	.	.	H	α-helix	trans	-63.4	-47.6	179.4	169.6	-98	0	0	0	111.7	D275 A280 K281 P382 T384	D275-Y277 PolarHBondContact O-N 3.44Å; D275-Y277 WeakPolarHBondContact OD1-CA 3.29Å; D275-Y277 WeakPolarHBondContact OD1-CB 3.49Å; D275-Y277 PolarHBondContact OD1-N 3.04Å; D275-Y277 VanDerWaalsContact OD1-N 3.09Å; Y277-A280 PolarHBondContact O-N 3.47Å; Y277-K281 HydrophobicContact CE1-CD 4.11Å; Y277-K281 VanDerWaalsContact O-CB 3.29Å; Y277-K281 WeakPolarHBondContact O-CB 3.32Å; Y277-K281 PolarHBondContact O-N 3.09Å; Y277-K281 PolarHBondContact OH-NZ 3.24Å; Y277-P382 HydrophobicContact CD2-CB 3.48Å; Y277-P382 VanDerWaalsContact CD2-CB 3.48Å; Y277-P382 HydrophobicContact CD2-CG 3.9Å; Y277-P382 HydrophobicContact CE2-CB 3.82Å; Y277-P382 HydrophobicContact CE2-CG 4.04Å; Y277-T384 HydrophobicContact CE2-CG2 3.54Å
278	Q	83.5	Confident	79.9	Confident	47 Å²	47	67 Å²	67	22%	0.22	32%	0.324	C	S	.	.	H	α-helix	trans	-62.5	-46.5	178.8	-72.2	174.7	29.5	0	0	110.3	P237 F274 D275 K281 H282	P237-Q278 HydrophobicContact CG-CB 3.91Å; F274-Q278 VanDerWaalsContact CD1-OE1 3.26Å; D275-Q278 PolarHBondContact O-N 3.34Å; D275-Q278 WeakPolarHBondContact OD1-CB 3.39Å; D275-Q278 WeakPolarHBondContact OD1-CG 3.41Å; D275-Q278 PolarHBondContact OD1-N 3.14Å; D275-Q278 PolarHBondContact OD2-NE2 2.96Å; Q278-K281 PolarHBondContact O-N 2.91Å; Q278-H282 WeakPolarHBondContact O-CB 3.24Å; Q278-H282 PolarHBondContact O-CD2 2.84Å; Q278-H282 PolarHBondContact O-N 2.71Å
279	L	86.5	Confident	78.4	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-64.3	-43.3	178	-67.6	175.5	0	0	0	111.7	P237 F271 F274 D275 E276 H282 S283 N343 F379	P237-L279 HydrophobicContact CG-CD2 4.2Å; F271-L279 HydrophobicContact CE2-CD2 3.85Å; F271-L279 HydrophobicContact CZ-CD1 4.21Å; F271-L279 HydrophobicContact CZ-CD2 4.24Å; F274-L279 HydrophobicContact CB-CD1 4.39Å; F274-L279 HydrophobicContact CB-CD2 4Å; F274-L279 HydrophobicContact CB-CG 3.98Å; F274-L279 HydrophobicContact CD2-CD2 4.28Å; D275-L279 WeakPolarHBondContact O-CG 3.2Å; D275-L279 PolarHBondContact O-N 2.84Å; D275-L279 VanDerWaalsContact O-N 3.14Å; E276-L279 PolarHBondContact O-N 3.49Å; L279-H282 PolarHBondContact O-N 3.48Å; L279-S283 WeakPolarHBondContact O-CB 3.49Å; L279-S283 PolarHBondContact O-N 3.09Å; L279-S283 PolarHBondContact O-OG 2.63Å; L279-N343 HydrophobicContact CD1-CB 3.81Å; L279-F379 HydrophobicContact CB-CE1 4.36Å; L279-F379 HydrophobicContact CB-CE2 3.84Å; L279-F379 HydrophobicContact CB-CZ 3.67Å; L279-F379 HydrophobicContact CD1-CE1 4.45Å; L279-F379 HydrophobicContact CD1-CZ 3.95Å; L279-F379 HydrophobicContact CG-CZ 4.48Å
280	A	80	Confident	77.3	Confident	18 Å²	18	67.6 Å²	67.6	15%	0.149	33%	0.327	C	S	.	.	H	α-helix	trans	-60.6	-47.5	175.4	0	0	0	0	0	111.7	E276 Y277 H282 S283 F379	E276-A280 WeakPolarHBondContact O-CB 3.35Å; E276-A280 PolarHBondContact O-N 3.26Å; Y277-A280 PolarHBondContact O-N 3.47Å; A280-H282 PolarHBondContact O-N 3.49Å; A280-S283 PolarHBondContact O-OG 3.33Å; A280-F379 HydrophobicContact CB-CB 3.79Å; A280-F379 HydrophobicContact CB-CD2 4.07Å; A280-F379 HydrophobicContact CB-CG 4.07Å
281	K	74.5	Confident	76.2	Confident	92 Å²	92	73.1 Å²	73.1	40%	0.4	35%	0.347	S	S	.	.	H	α-helix	trans	-61.7	-41	179.8	-175.3	174.1	-171.9	168.4	0	112.8	Y277 Q278	Y277-K281 HydrophobicContact CE1-CD 4.11Å; Y277-K281 VanDerWaalsContact O-CB 3.29Å; Y277-K281 WeakPolarHBondContact O-CB 3.32Å; Y277-K281 PolarHBondContact O-N 3.09Å; Y277-K281 PolarHBondContact OH-NZ 3.24Å; Q278-K281 PolarHBondContact O-N 2.91Å
282	H	76.8	Confident	74.8	Confident	46 Å²	46	73.5 Å²	73.5	21%	0.213	35%	0.35	C	S	.	.	H	α-helix	trans	-93.2	-7.2	-174	-68.6	-66.4	0	0	0	114.6	P237 S238 Q278 L279 A280 K284 I328	P237-H282 HydrophobicContact CB-CB 3.87Å; P237-H282 HydrophobicContact CG-CB 4.31Å; S238-H282 PolarHBondContact OG-CE1 3.15Å; S238-H282 VanDerWaalsContact OG-CE1 3.28Å; S238-H282 PolarHBondContact OG-ND1 2.75Å; Q278-H282 WeakPolarHBondContact O-CB 3.24Å; Q278-H282 PolarHBondContact O-CD2 2.84Å; Q278-H282 PolarHBondContact O-N 2.71Å; L279-H282 PolarHBondContact O-N 3.48Å; A280-H282 PolarHBondContact O-N 3.49Å; H282-K284 VanDerWaalsContact C-N 3.35Å; H282-K284 PolarHBondContact O-N 3.28Å; H282-I328 HydrophobicContact CB-CD1 4.21Å
283	S	73.5	Confident	73.8	Confident	37 Å²	37	73.4 Å²	73.4	26%	0.259	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-1.7	177.8	61.6	0	0	0	0	115.1	L279 A280 H285	L279-S283 WeakPolarHBondContact O-CB 3.49Å; L279-S283 PolarHBondContact O-N 3.09Å; L279-S283 PolarHBondContact O-OG 2.63Å; A280-S283 PolarHBondContact O-OG 3.33Å; S283-H285 WeakPolarHBondContact O-CA 3.26Å; S283-H285 PolarHBondContact O-N 3.39Å
284	K	65.1	Low	72.7	Confident	156 Å²	156	76 Å²	76	68%	0.678	36%	0.363	S	S	*	.			trans	-51.2	104.3	-178.4	-72.8	-173.3	179.3	180	0	111.9	H282	H282-K284 VanDerWaalsContact C-N 3.35Å; H282-K284 PolarHBondContact O-N 3.28Å
285	H	57.6	Low	71.3	Confident	92 Å²	92	76.7 Å²	76.7	43%	0.426	37%	0.368	S	S	.	.	H	α-helix	trans	-81.6	-38.8	-153.6	-142.3	-75.6	0	0	0	114.3	S283 A289	S283-H285 WeakPolarHBondContact O-CA 3.26Å; S283-H285 PolarHBondContact O-N 3.39Å; H285-A289 WeakPolarHBondContact O-CB 3.26Å; H285-A289 PolarHBondContact O-N 2.84Å
286	R	59.1	Low	70.5	Confident	222 Å²	222	77.7 Å²	77.7	84%	0.838	37%	0.369	S	S	*	.	H	α-helix	trans	-61.4	-52.8	-164.5	-79.3	-174.8	-179.4	174.2	0.4	114.2	A289 N290	R286-A289 PolarHBondContact O-N 2.88Å; R286-N290 VanDerWaalsContact O-CG 3.28Å; R286-N290 PolarHBondContact O-N 3.27Å; R286-N290 VanDerWaalsContact O-N 3.1Å; R286-N290 PolarHBondContact O-OD1 3.34Å
287	A	63.5	Low	69.2	Low	67 Å²	67	77.2 Å²	77.2	55%	0.554	38%	0.378	S	S	*	.	H	α-helix	trans	-67.1	-42.8	-174.8	0	0	0	0	0	112.8	R291	A287-R291 WeakPolarHBondContact O-CG 3.48Å; A287-R291 PolarHBondContact O-N 3.47Å
288	R	68.5	Low	68.3	Low	57 Å²	57	77.6 Å²	77.6	22%	0.215	39%	0.386	C	S	.	.	H	α-helix	trans	-72.6	-36.6	177.3	-87.2	-176.3	171.2	-98.9	-1.1	112.3	I241 E245 R291 S292 F326 T327	I241-R288 VanDerWaalsContact CG2-NH1 3.28Å; E245-R288 IonicContact OE1-CZ 3.88Å; E245-R288 IonicContact OE1-NH1 2.81Å; E245-R288 PolarHBondContact OE1-NH1 3.48Å; R288-R291 PolarHBondContact O-N 3.37Å; R288-S292 WeakPolarHBondContact O-CB 3.44Å; R288-S292 PolarHBondContact O-N 3.21Å; R288-F326 PolarHBondContact NH1-O 3.12Å; R288-F326 VanDerWaalsContact NH1-O 3.12Å; R288-T327 HydrophobicContact CB-CG2 4.47Å
289	A	61.8	Low	66.8	Low	24 Å²	24	79.9 Å²	79.9	20%	0.198	40%	0.395	C	S	.	.	H	α-helix	trans	-61.7	-44.6	176.1	0	0	0	0	0	111.4	H285 R286 R291 S292 T293	H285-A289 WeakPolarHBondContact O-CB 3.26Å; H285-A289 PolarHBondContact O-N 2.84Å; R286-A289 PolarHBondContact O-N 2.88Å; A289-R291 VanDerWaalsContact C-N 3.3Å; A289-R291 PolarHBondContact O-N 2.63Å; A289-S292 WeakPolarHBondContact O-CB 3.44Å; A289-S292 PolarHBondContact O-N 2.99Å; A289-S292 VanDerWaalsContact O-N 3.14Å; A289-T293 PolarHBondContact O-N 3.46Å; A289-T293 PolarHBondContact O-OG1 2.82Å
290	N	69	Low	65.2	Low	103 Å²	103	89.4 Å²	89.4	55%	0.551	44%	0.437	S	S	*	.	H	α-helix	trans	-62.2	-35.9	176.4	-70.2	-2.9	0	0	0	112.7	R286 T293 K294	R286-N290 VanDerWaalsContact O-CG 3.28Å; R286-N290 PolarHBondContact O-N 3.27Å; R286-N290 VanDerWaalsContact O-N 3.1Å; R286-N290 PolarHBondContact O-OD1 3.34Å; N290-T293 WeakPolarHBondContact CA-OG1 3.29Å; N290-T293 PolarHBondContact O-OG1 2.79Å; N290-K294 WeakPolarHBondContact O-CG 3.35Å; N290-K294 PolarHBondContact O-N 2.85Å
291	R	69.1	Low	63.8	Low	134 Å²	134	93.5 Å²	93.5	51%	0.506	46%	0.464	S	S	.	.	H	α-helix	trans	-72.6	-37.3	173.9	-69	179.2	-174.4	-177.7	1.6	112	A287 R288 A289 K294 S295 Y325	A287-R291 WeakPolarHBondContact O-CG 3.48Å; A287-R291 PolarHBondContact O-N 3.47Å; R288-R291 PolarHBondContact O-N 3.37Å; A289-R291 VanDerWaalsContact C-N 3.3Å; A289-R291 PolarHBondContact O-N 2.63Å; R291-K294 PolarHBondContact O-N 3.17Å; R291-S295 PolarHBondContact O-N 3.37Å; R291-Y325 HydrophobicContact CB-CD1 4.27Å; R291-Y325 HydrophobicContact CB-CD2 3.72Å; R291-Y325 HydrophobicContact CB-CE2 4.15Å; R291-Y325 HydrophobicContact CB-CG 3.77Å
292	S	64.9	Low	62.5	Low	7 Å²	7	97.8 Å²	97.8	5%	0.049	48%	0.478	C	S	.	.	H	α-helix	trans	-66.4	-43.1	177	-166.5	0	0	0	0	111.6	R288 A289 S295 K296 Y325	R288-S292 WeakPolarHBondContact O-CB 3.44Å; R288-S292 PolarHBondContact O-N 3.21Å; A289-S292 WeakPolarHBondContact O-CB 3.44Å; A289-S292 PolarHBondContact O-N 2.99Å; A289-S292 VanDerWaalsContact O-N 3.14Å; S292-S295 WeakPolarHBondContact CA-OG 3.42Å; S292-S295 PolarHBondContact O-N 2.92Å; S292-S295 PolarHBondContact O-OG 2.76Å; S292-K296 WeakPolarHBondContact O-CG 3.42Å; S292-K296 PolarHBondContact O-N 3.26Å; S292-Y325 WeakPolarHBondContact CB-O 3.36Å; S292-Y325 PolarHBondContact OG-O 3.31Å
293	T	67.3	Low	60.9	Low	86 Å²	86	103.4 Å²	103.4	53%	0.528	51%	0.51	S	S	.	.	H	α-helix	trans	-61.7	-43.8	173.2	41.6	0	0	0	0	111.8	A289 N290 S295 K296 A297	A289-T293 PolarHBondContact O-N 3.46Å; A289-T293 PolarHBondContact O-OG1 2.82Å; N290-T293 WeakPolarHBondContact CA-OG1 3.29Å; N290-T293 PolarHBondContact O-OG1 2.79Å; T293-S295 VanDerWaalsContact C-N 3.33Å; T293-S295 PolarHBondContact O-N 3.03Å; T293-K296 PolarHBondContact O-N 2.95Å; T293-K296 VanDerWaalsContact O-N 3.15Å; T293-A297 PolarHBondContact O-N 3.39Å
294	K	66	Low	59.5	Low	157 Å²	157	107.6 Å²	107.6	68%	0.683	54%	0.539	S	S	*	.	H	α-helix	trans	-57.4	-43	171.6	-75.7	-175	178.9	-167.7	0	112.4	N290 R291 K296 A297 L298	N290-K294 WeakPolarHBondContact O-CG 3.35Å; N290-K294 PolarHBondContact O-N 2.85Å; R291-K294 PolarHBondContact O-N 3.17Å; K294-K296 VanDerWaalsContact C-N 3.34Å; K294-K296 PolarHBondContact O-N 3.16Å; K294-A297 WeakPolarHBondContact O-CB 3.46Å; K294-A297 PolarHBondContact O-N 3.19Å; K294-L298 PolarHBondContact O-N 3.37Å
295	S	62.8	Low	58.4	Low	18 Å²	18	102.8 Å²	102.8	13%	0.126	53%	0.533	C	S	.	.	H	α-helix	trans	-66	-32.6	176.4	73.3	0	0	0	0	113.5	R291 S292 T293	R291-S295 PolarHBondContact O-N 3.37Å; S292-S295 WeakPolarHBondContact CA-OG 3.42Å; S292-S295 PolarHBondContact O-N 2.92Å; S292-S295 PolarHBondContact O-OG 2.76Å; T293-S295 VanDerWaalsContact C-N 3.33Å; T293-S295 PolarHBondContact O-N 3.03Å
296	K	66.5	Low	58	Low	95 Å²	95	105.8 Å²	105.8	41%	0.413	56%	0.558	S	S	.	*	H	α-helix	trans	-71.7	-32.3	174.2	-73.1	-179.5	-177.2	-178.6	0	111.9	S292 T293 K294 K299 E330	S292-K296 WeakPolarHBondContact O-CG 3.42Å; S292-K296 PolarHBondContact O-N 3.26Å; T293-K296 PolarHBondContact O-N 2.95Å; T293-K296 VanDerWaalsContact O-N 3.15Å; K294-K296 VanDerWaalsContact C-N 3.34Å; K294-K296 PolarHBondContact O-N 3.16Å; K296-K299 WeakPolarHBondContact O-CB 3.28Å; K296-K299 PolarHBondContact O-N 3.4Å; K296-K299 VanDerWaalsContact O-N 3.11Å; K296-E330 IonicContact NZ-OE2 2.89Å; K296-E330 PolarHBondContact NZ-OE2 2.8Å
297	A	57.3	Low	57.7	Low	69 Å²	69	98.8 Å²	98.8	57%	0.57	54%	0.539	S	S	*	.	H	α-helix	trans	-63.8	-39.7	175.6	0	0	0	0	0	111.9	T293 K294 K299 K300	T293-A297 PolarHBondContact O-N 3.39Å; K294-A297 WeakPolarHBondContact O-CB 3.46Å; K294-A297 PolarHBondContact O-N 3.19Å; A297-K299 PolarHBondContact O-N 3.43Å; A297-K300 PolarHBondContact O-N 3.09Å
298	L	60.2	Low	57.1	Low	102 Å²	102	98.3 Å²	98.3	53%	0.534	53%	0.532	S	S	.	.	H	α-helix	trans	-61.7	-23.7	172.7	-94.7	86.7	0	0	0	113.5	K294 K300 S301 P322	K294-L298 PolarHBondContact O-N 3.37Å; L298-K300 PolarHBondContact O-N 3.29Å; L298-S301 PolarHBondContact O-N 3.13Å; L298-P322 HydrophobicContact CD2-CB 3.88Å; L298-P322 HydrophobicContact CD2-CG 3.57Å
299	K	52.4	Low	56.5	Low	95 Å²	95	101.3 Å²	101.3	41%	0.413	56%	0.557	S	S	.	*	G	3₁₀ helix	trans	-62.5	-28.4	-179.9	-160.6	176.1	-173.7	-174.3	0	112.8	L254 S255 K296 A297 S301	L254-K299 HydrophobicContact CD1-CD 4.46Å; L254-K299 HydrophobicContact CD1-CG 4.1Å; S255-K299 PolarHBondContact OG-NZ 3.48Å; K296-K299 WeakPolarHBondContact O-CB 3.28Å; K296-K299 PolarHBondContact O-N 3.4Å; K296-K299 VanDerWaalsContact O-N 3.11Å; A297-K299 PolarHBondContact O-N 3.43Å; K299-S301 PolarHBondContact O-N 2.96Å
300	K	53.6	Low	56.4	Low	201 Å²	201	105.5 Å²	105.5	87%	0.874	58%	0.576	S	S	*	*	G	3₁₀ helix	trans	-69.5	-14.7	-179.6	-75.9	-170.9	174.6	-173.1	0	113.5	A297 L298	A297-K300 PolarHBondContact O-N 3.09Å; L298-K300 PolarHBondContact O-N 3.29Å
301	S	50.8	Low	56.1	Low	104 Å²	104	102.9 Å²	102.9	73%	0.727	56%	0.562	S	S	*	*	G	3₁₀ helix	trans	-97.6	-14.2	-173.9	165.9	0	0	0	0	114.8	L298 K299	L298-S301 PolarHBondContact O-N 3.13Å; K299-S301 PolarHBondContact O-N 2.96Å
302	R	46.9	Very low	55.8	Low	182 Å²	182	102.2 Å²	102.2	69%	0.687	57%	0.568	S	S	*	*			trans	-119.4	102.6	-174.1	-77.2	-176.4	168.5	177.8	-4.4	111.6
303	N	43	Very low	56	Low	164 Å²	164	103.3 Å²	103.3	88%	0.877	58%	0.578	S	S	*	*			trans	-65.2	149.6	171.9	-86.9	-12	0	0	0	111.9	G305	N303-G305 PolarHBondContact O-N 2.96Å; N303-G305 VanDerWaalsContact O-N 3.07Å
304	S	43.3	Very low	56	Low	125 Å²	125	100.2 Å²	100.2	87%	0.874	56%	0.557	S	S	*	*			trans	-74.6	84.5	-175.4	52.8	0	0	0	0	112.4
305	G	43.5	Very low	56.1	Low	54 Å²	54	93.1 Å²	93.1	56%	0.557	53%	0.527	S	S	*	.			trans	-75.9	154.1	164.7	0	0	0	0	0	111.8	N303 V307	N303-G305 PolarHBondContact O-N 2.96Å; N303-G305 VanDerWaalsContact O-N 3.07Å; G305-V307 WeakPolarHBondContact O-CG2 3.39Å; G305-V307 PolarHBondContact O-N 3.44Å; G305-V307 VanDerWaalsContact O-N 3.11Å
306	V	48	Very low	56.5	Low	155 Å²	155	99.4 Å²	99.4	94%	0.939	55%	0.549	S	S	*	.			trans	-53.8	115.8	172.8	177.6	0	0	0	0	108.6	S308	V306-S308 PolarHBondContact O-N 3.13Å
307	V	52.7	Low	56.7	Low	75 Å²	75	96.6 Å²	96.6	46%	0.455	54%	0.536	S	S	.	.			trans	-81.9	102.9	-171.9	178.8	0	0	0	0	108.6	G305 T309	G305-V307 WeakPolarHBondContact O-CG2 3.39Å; G305-V307 PolarHBondContact O-N 3.44Å; G305-V307 VanDerWaalsContact O-N 3.11Å; V307-T309 PolarHBondContact O-N 3.3Å
308	S	51.1	Low	57.4	Low	57 Å²	57	93.5 Å²	93.5	40%	0.399	51%	0.51	S	S	.	.			trans	-53.5	132.1	168.5	154.7	0	0	0	0	110	V306 D310 R317	V306-S308 PolarHBondContact O-N 3.13Å; S308-D310 VanDerWaalsContact C-N 3.34Å; S308-D310 WeakPolarHBondContact OG-CB 3.37Å; S308-D310 PolarHBondContact OG-N 2.93Å; S308-D310 VanDerWaalsContact OG-N 3.15Å; S308-R317 PolarHBondContact O-NH2 3.47Å
309	T	55.8	Low	57.9	Low	121 Å²	121	88.9 Å²	88.9	74%	0.742	49%	0.487	S	S	*	.			trans	-92.3	6.1	174.4	47.2	0	0	0	0	112.6	V307	V307-T309 PolarHBondContact O-N 3.3Å
310	D	61	Low	58.7	Low	112 Å²	112	88.8 Å²	88.8	60%	0.599	49%	0.487	S	S	*	.			trans	-58.4	140.7	175.2	-90	-40.5	0	0	0	110.8	S308 D312 A313 I314	S308-D310 VanDerWaalsContact C-N 3.34Å; S308-D310 WeakPolarHBondContact OG-CB 3.37Å; S308-D310 PolarHBondContact OG-N 2.93Å; S308-D310 VanDerWaalsContact OG-N 3.15Å; D310-D312 VanDerWaalsContact C-N 3.27Å; D310-D312 PolarHBondContact O-N 3.34Å; D310-A313 HydrophobicContact CB-CB 4.46Å; D310-A313 WeakPolarHBondContact O-CB 3.36Å; D310-A313 PolarHBondContact O-N 2.65Å; D310-I314 PolarHBondContact O-N 3.06Å
311	I	61.5	Low	59.3	Low	48 Å²	48	80.9 Å²	80.9	25%	0.246	46%	0.457	C	S	.	.	H	α-helix	trans	-58.7	-42.6	-179.3	-81.6	89.8	0	0	0	110.4	H182 A313 I314 L315	H182-I311 HydrophobicContact CB-CG1 4.33Å; H182-I311 HydrophobicContact CB-CG2 3.88Å; H182-I311 WeakPolarHBondContact CD2-CD1 3.31Å; H182-I311 WeakPolarHBondContact CD2-CG1 3.35Å; H182-I311 WeakPolarHBondContact NE2-CD1 3.38Å; I311-A313 PolarHBondContact O-N 2.97Å; I311-I314 CarbonylContact O-C 3.56Å; I311-I314 WeakPolarHBondContact O-CA 3.42Å; I311-I314 VanDerWaalsContact O-CB 3.31Å; I311-I314 WeakPolarHBondContact O-CB 3.44Å; I311-I314 PolarHBondContact O-N 2.85Å; I311-L315 HydrophobicContact CG2-CD1 3.76Å; I311-L315 HydrophobicContact CG2-CD2 4.43Å; I311-L315 HydrophobicContact CG2-CG 3.79Å; I311-L315 VanDerWaalsContact O-CG 3.29Å; I311-L315 WeakPolarHBondContact O-CG 3.28Å; I311-L315 PolarHBondContact O-N 3.31Å
312	D	63.4	Low	60.1	Low	120 Å²	120	78.9 Å²	78.9	64%	0.642	44%	0.442	S	S	*	.	H	α-helix	trans	-59.3	-36.4	178.9	-68	-32.1	0	0	0	111.9	D310 L315 Y316	D310-D312 VanDerWaalsContact C-N 3.27Å; D310-D312 PolarHBondContact O-N 3.34Å; D312-L315 PolarHBondContact O-N 2.62Å; D312-Y316 WeakPolarHBondContact O-CB 3.3Å; D312-Y316 PolarHBondContact O-N 2.61Å
313	A	68.2	Low	61.2	Low	30 Å²	30	76.4 Å²	76.4	25%	0.248	43%	0.432	C	S	.	.	H	α-helix	trans	-68.8	-35.1	172.7	0	0	0	0	0	112.5	D310 I311 R317	D310-A313 HydrophobicContact CB-CB 4.46Å; D310-A313 WeakPolarHBondContact O-CB 3.36Å; D310-A313 PolarHBondContact O-N 2.65Å; I311-A313 PolarHBondContact O-N 2.97Å; A313-R317 WeakPolarHBondContact O-CB 3.46Å; A313-R317 VanDerWaalsContact O-CG 3.26Å; A313-R317 WeakPolarHBondContact O-CG 2.98Å; A313-R317 PolarHBondContact O-N 3.44Å; A313-R317 PolarHBondContact O-NE 3.24Å
314	I	68.5	Low	62.8	Low	20 Å²	20	69.3 Å²	69.3	10%	0.103	39%	0.394	C	S	.	.	H	α-helix	trans	-65.8	-46.9	173.1	-70.2	170.3	0	0	0	110.9	I250 D310 I311 R317 L318	I250-I314 HydrophobicContact CG1-CG2 4.4Å; I250-I314 HydrophobicContact CG2-CB 4.35Å; I250-I314 HydrophobicContact CG2-CD1 4.3Å; I250-I314 HydrophobicContact CG2-CG1 4.04Å; I250-I314 HydrophobicContact CG2-CG2 3.58Å; D310-I314 PolarHBondContact O-N 3.06Å; I311-I314 CarbonylContact O-C 3.56Å; I311-I314 WeakPolarHBondContact O-CA 3.42Å; I311-I314 VanDerWaalsContact O-CB 3.31Å; I311-I314 WeakPolarHBondContact O-CB 3.44Å; I311-I314 PolarHBondContact O-N 2.85Å; I314-R317 PolarHBondContact O-N 2.71Å; I314-L318 HydrophobicContact CG2-CD1 3.87Å; I314-L318 WeakPolarHBondContact O-CG 3.47Å; I314-L318 PolarHBondContact O-N 3.27Å
315	L	68.6	Low	64.7	Low	9 Å²	9	65.5 Å²	65.5	5%	0.047	36%	0.361	C	S	.	.	H	α-helix	trans	-64.9	-45.2	179.6	-63.1	-170.7	0	0	0	111.3	Q179 I311 D312 R317 L318 A319	Q179-L315 HydrophobicContact CG-CD1 3.77Å; I311-L315 HydrophobicContact CG2-CD1 3.76Å; I311-L315 HydrophobicContact CG2-CD2 4.43Å; I311-L315 HydrophobicContact CG2-CG 3.79Å; I311-L315 VanDerWaalsContact O-CG 3.29Å; I311-L315 WeakPolarHBondContact O-CG 3.28Å; I311-L315 PolarHBondContact O-N 3.31Å; D312-L315 PolarHBondContact O-N 2.62Å; L315-R317 VanDerWaalsContact C-N 3.3Å; L315-R317 PolarHBondContact O-N 3.22Å; L315-L318 HydrophobicContact CD2-CD1 4.41Å; L315-L318 PolarHBondContact O-N 2.91Å; L315-A319 WeakPolarHBondContact O-CB 3.25Å; L315-A319 PolarHBondContact O-N 3.01Å
316	Y	69.4	Low	66.7	Low	150 Å²	150	63.1 Å²	63.1	59%	0.588	34%	0.336	S	S	*	.	H	α-helix	trans	-56.9	-45.9	173.8	-175.2	-98.6	0	0	0	111	D312 A319 H320	D312-Y316 WeakPolarHBondContact O-CB 3.3Å; D312-Y316 PolarHBondContact O-N 2.61Å; Y316-A319 PolarHBondContact O-N 2.95Å; Y316-H320 AromaticContact CD2-CE1 3.7Å; Y316-H320 AromaticContact CD2-ND1 3.39Å; Y316-H320 WeakPolarHBondContact CD2-ND1 3.41Å; Y316-H320 HydrophobicContact CE1-CB 4.4Å; Y316-H320 AromaticContact CE2-CE1 3.74Å; Y316-H320 AromaticContact CE2-CG 3.91Å; Y316-H320 AromaticContact CE2-ND1 3.51Å; Y316-H320 AromaticContact CG-ND1 3.86Å; Y316-H320 WeakPolarHBondContact O-CB 3.44Å; Y316-H320 PolarHBondContact O-N 3.41Å; Y316-H320 PolarHBondContact O-ND1 3.07Å
317	R	72.4	Confident	68.5	Low	35 Å²	35	56.6 Å²	56.6	13%	0.132	30%	0.296	C	S	.	.	H	α-helix	trans	-63.8	-41.6	176	-79.2	178.8	-73.7	-175.5	-10.8	112.8	I250 S308 A313 I314 L315 A319 S321	I250-R317 PolarHBondContact O-NE 2.83Å; I250-R317 PolarHBondContact O-NH1 2.74Å; S308-R317 PolarHBondContact O-NH2 3.47Å; A313-R317 WeakPolarHBondContact O-CB 3.46Å; A313-R317 VanDerWaalsContact O-CG 3.26Å; A313-R317 WeakPolarHBondContact O-CG 2.98Å; A313-R317 PolarHBondContact O-N 3.44Å; A313-R317 PolarHBondContact O-NE 3.24Å; I314-R317 PolarHBondContact O-N 2.71Å; L315-R317 VanDerWaalsContact C-N 3.3Å; L315-R317 PolarHBondContact O-N 3.22Å; R317-A319 VanDerWaalsContact C-N 3.3Å; R317-A319 PolarHBondContact O-N 3.38Å; R317-S321 WeakPolarHBondContact CA-OG 3.42Å; R317-S321 WeakPolarHBondContact O-CA 3.44Å; R317-S321 WeakPolarHBondContact O-CB 3.32Å; R317-S321 PolarHBondContact O-N 3.42Å; R317-S321 PolarHBondContact O-OG 3.09Å
318	L	71.4	Confident	70.2	Confident	4 Å²	4	53.3 Å²	53.3	2%	0.021	28%	0.276	C	S	.	.	H	α-helix	trans	-63.1	-35.6	178.3	-84.9	162.5	0	0	0	113.1	K174 M211 V215 Y246 I250 I314 L315	K174-L318 WeakPolarHBondContact CD-O 3.25Å; K174-L318 PolarHBondContact NZ-O 3.33Å; K174-L318 VanDerWaalsContact NZ-O 3.15Å; M211-L318 HydrophobicContact CE-CD1 4Å; M211-L318 HydrophobicContact CE-CD2 4.32Å; V215-L318 HydrophobicContact CG2-CD1 4.15Å; Y246-L318 HydrophobicContact CD1-CD2 3.91Å; Y246-L318 HydrophobicContact CE1-CD2 4.3Å; I250-L318 HydrophobicContact CD1-CD1 4.26Å; I250-L318 HydrophobicContact CD1-CD2 4.04Å; I250-L318 HydrophobicContact CD1-CG 4.41Å; I250-L318 HydrophobicContact CG1-CD1 3.9Å; I250-L318 HydrophobicContact CG1-CD2 3.63Å; I250-L318 HydrophobicContact CG1-CG 3.7Å; I314-L318 HydrophobicContact CG2-CD1 3.87Å; I314-L318 WeakPolarHBondContact O-CG 3.47Å; I314-L318 PolarHBondContact O-N 3.27Å; L315-L318 HydrophobicContact CD2-CD1 4.41Å; L315-L318 PolarHBondContact O-N 2.91Å
319	A	69.6	Low	72	Confident	6 Å²	6	52.6 Å²	52.6	5%	0.05	27%	0.265	C	S	.	.	H	α-helix	trans	-82.2	-36.9	179.7	0	0	0	0	0	113.1	I175 L315 Y316 R317	I175-A319 HydrophobicContact CD1-CB 4.15Å; I175-A319 HydrophobicContact CG1-CB 3.92Å; L315-A319 WeakPolarHBondContact O-CB 3.25Å; L315-A319 PolarHBondContact O-N 3.01Å; Y316-A319 PolarHBondContact O-N 2.95Å; R317-A319 VanDerWaalsContact C-N 3.3Å; R317-A319 PolarHBondContact O-N 3.38Å
320	H	69.4	Low	73.5	Confident	93 Å²	93	48.4 Å²	48.4	43%	0.431	24%	0.237	S	C	.	.	H	α-helix	trans	-112.1	-16.1	-167.9	-57.9	89.6	0	0	0	115.1	Y316	Y316-H320 AromaticContact CD2-CE1 3.7Å; Y316-H320 AromaticContact CD2-ND1 3.39Å; Y316-H320 WeakPolarHBondContact CD2-ND1 3.41Å; Y316-H320 HydrophobicContact CE1-CB 4.4Å; Y316-H320 AromaticContact CE2-CE1 3.74Å; Y316-H320 AromaticContact CE2-CG 3.91Å; Y316-H320 AromaticContact CE2-ND1 3.51Å; Y316-H320 AromaticContact CG-ND1 3.86Å; Y316-H320 WeakPolarHBondContact O-CB 3.44Å; Y316-H320 PolarHBondContact O-N 3.41Å; Y316-H320 PolarHBondContact O-ND1 3.07Å
321	S	67.4	Low	74.9	Confident	34 Å²	34	43 Å²	43	24%	0.238	21%	0.209	C	C	.	.	S	Bend	trans	-75.1	140.4	-178.2	-61.1	0	0	0	0	111.9	R317 R323	R317-S321 WeakPolarHBondContact CA-OG 3.42Å; R317-S321 WeakPolarHBondContact O-CA 3.44Å; R317-S321 WeakPolarHBondContact O-CB 3.32Å; R317-S321 PolarHBondContact O-N 3.42Å; R317-S321 PolarHBondContact O-OG 3.09Å; S321-R323 PolarHBondContact O-N 2.64Å
322	P	66.9	Low	76.2	Confident	63 Å²	63	40.9 Å²	40.9	41%	0.409	20%	0.198	S	C	.	.	P	Polyproline II helix	trans	-61.3	138.8	173	25.5	-32.8	0	0	0	110.3	L298 I324	L298-P322 HydrophobicContact CD2-CB 3.88Å; L298-P322 HydrophobicContact CD2-CG 3.57Å; P322-I324 PolarHBondContact O-N 3.17Å
323	R	69.3	Low	77.5	Confident	129 Å²	129	41.8 Å²	41.8	49%	0.487	19%	0.192	S	C	.	.	P	Polyproline II helix	trans	-63.4	122.8	-176.3	-164.3	170.2	-175.3	170	5.9	110.7	E242 S321 Y325	E242-R323 IonicContact OE1-NH2 2.8Å; E242-R323 PolarHBondContact OE1-NH2 3Å; S321-R323 PolarHBondContact O-N 2.64Å; R323-Y325 HydrophobicContact CB-CE2 4.05Å; R323-Y325 HydrophobicContact CG-CE1 4.42Å; R323-Y325 HydrophobicContact CG-CE2 4.26Å; R323-Y325 VanDerWaalsContact O-CD2 3.29Å; R323-Y325 WeakPolarHBondContact O-CD2 3.46Å; R323-Y325 WeakPolarHBondContact O-CE2 3.47Å
324	I	77.8	Confident	78.4	Confident	15 Å²	15	42.8 Å²	42.8	8%	0.077	19%	0.19	C	C	.	.	P	Polyproline II helix	trans	-80.6	140.1	176.6	-58.8	173.7	0	0	0	108.8	E245 A248 L254 P322 F326	E245-I324 VanDerWaalsContact CG-O 3.25Å; E245-I324 WeakPolarHBondContact CG-O 3.17Å; A248-I324 HydrophobicContact CB-CD1 3.71Å; A248-I324 HydrophobicContact CB-CG2 4.41Å; L254-I324 HydrophobicContact CD2-CB 4.43Å; L254-I324 HydrophobicContact CD2-CD1 3.61Å; L254-I324 HydrophobicContact CD2-CG1 3.78Å; L254-I324 HydrophobicContact CD2-CG2 3.8Å; L254-I324 HydrophobicContact CG-CD1 3.91Å; P322-I324 PolarHBondContact O-N 3.17Å; I324-F326 HydrophobicContact CG2-CD1 4.21Å; I324-F326 HydrophobicContact CG2-CE1 3.51Å; I324-F326 HydrophobicContact CG2-CE2 4.06Å; I324-F326 HydrophobicContact CG2-CZ 3.48Å; I324-F326 VanDerWaalsContact CG2-CZ 3.48Å
325	Y	82.3	Confident	79.4	Confident	46 Å²	46	42 Å²	42	18%	0.18	19%	0.186	C	C	.	.			trans	-123.2	127	178.5	-67.6	-81.9	0	0	0	111.7	E245 R291 S292 R323	E245-Y325 WeakPolarHBondContact OE1-CA 3.28Å; R291-Y325 HydrophobicContact CB-CD1 4.27Å; R291-Y325 HydrophobicContact CB-CD2 3.72Å; R291-Y325 HydrophobicContact CB-CE2 4.15Å; R291-Y325 HydrophobicContact CB-CG 3.77Å; S292-Y325 WeakPolarHBondContact CB-O 3.36Å; S292-Y325 PolarHBondContact OG-O 3.31Å; R323-Y325 HydrophobicContact CB-CE2 4.05Å; R323-Y325 HydrophobicContact CG-CE1 4.42Å; R323-Y325 HydrophobicContact CG-CE2 4.26Å; R323-Y325 VanDerWaalsContact O-CD2 3.29Å; R323-Y325 WeakPolarHBondContact O-CD2 3.46Å; R323-Y325 WeakPolarHBondContact O-CE2 3.47Å
326	F	85.6	Confident	80.4	Confident	4 Å²	4	49.1 Å²	49.1	2%	0.018	22%	0.218	C	C	.	.			trans	-112	152.7	172.4	-58.9	-43.6	0	0	0	112.1	I241 A244 E245 A248 L256 R288 I324 L331	I241-F326 HydrophobicContact CG2-CB 4.13Å; A244-F326 HydrophobicContact CB-CD2 4.03Å; A244-F326 HydrophobicContact CB-CE2 4.25Å; A244-F326 WeakPolarHBondContact O-CE2 3.44Å; E245-F326 HydrophobicContact CG-CB 4.47Å; E245-F326 HydrophobicContact CG-CD2 3.86Å; E245-F326 HydrophobicContact CG-CG 4.37Å; E245-F326 PolarHBondContact OE1-N 2.94Å; A248-F326 HydrophobicContact CB-CE2 3.73Å; A248-F326 HydrophobicContact CB-CZ 3.65Å; L256-F326 HydrophobicContact CD1-CE2 4.14Å; L256-F326 HydrophobicContact CD1-CZ 4.45Å; L256-F326 HydrophobicContact CD2-CE2 4.29Å; L256-F326 HydrophobicContact CG-CE2 4.39Å; L256-F326 HydrophobicContact CG-CZ 4.39Å; R288-F326 PolarHBondContact NH1-O 3.12Å; R288-F326 VanDerWaalsContact NH1-O 3.12Å; I324-F326 HydrophobicContact CG2-CD1 4.21Å; I324-F326 HydrophobicContact CG2-CE1 3.51Å; I324-F326 HydrophobicContact CG2-CE2 4.06Å; I324-F326 HydrophobicContact CG2-CZ 3.48Å; I324-F326 VanDerWaalsContact CG2-CZ 3.48Å; F326-L331 HydrophobicContact CB-CD1 4.19Å; F326-L331 HydrophobicContact CB-CD2 4.12Å; F326-L331 HydrophobicContact CB-CG 3.94Å; F326-L331 HydrophobicContact CD2-CD2 3.83Å; F326-L331 HydrophobicContact CE2-CD2 4.48Å; F326-L331 HydrophobicContact CG-CD2 4.07Å; F326-L331 HydrophobicContact CG-CG 4.44Å
327	T	86.7	Confident	81.5	Confident	17 Å²	17	42.5 Å²	42.5	10%	0.104	19%	0.193	C	C	.	.			trans	-102.3	154.5	166.8	63.8	0	0	0	0	108.4	R288 K329 E330 L331	R288-T327 HydrophobicContact CB-CG2 4.47Å; T327-K329 PolarHBondContact O-N 2.89Å; T327-E330 PolarHBondContact O-N 3.08Å; T327-E330 WeakPolarHBondContact OG1-CB 3.23Å; T327-E330 PolarHBondContact OG1-N 3.46Å; T327-L331 PolarHBondContact O-N 2.94Å; T327-L331 VanDerWaalsContact O-N 3.07Å
328	I	88.3	Confident	82.2	Confident	6 Å²	6	44.4 Å²	44.4	3%	0.031	21%	0.212	C	C	.	.	H	α-helix	trans	-56.2	-42.6	175.9	-57	177.3	0	0	0	109.9	P237 W240 I241 F271 H282 E330 L331 I332 V347	P237-I328 HydrophobicContact CB-CD1 4.24Å; W240-I328 HydrophobicContact CZ3-CG2 4.3Å; I241-I328 HydrophobicContact CD1-CD1 4.34Å; I241-I328 HydrophobicContact CD1-CG1 3.6Å; I241-I328 HydrophobicContact CG1-CG1 4.17Å; F271-I328 HydrophobicContact CE2-CG2 4.02Å; H282-I328 HydrophobicContact CB-CD1 4.21Å; I328-E330 VanDerWaalsContact C-N 3.31Å; I328-E330 PolarHBondContact O-N 3.48Å; I328-L331 PolarHBondContact O-N 2.69Å; I328-L331 VanDerWaalsContact O-N 3.13Å; I328-I332 HydrophobicContact CG2-CD1 3.95Å; I328-I332 HydrophobicContact CG2-CG1 4.25Å; I328-I332 WeakPolarHBondContact O-CG1 3.41Å; I328-I332 PolarHBondContact O-N 2.79Å; I328-V347 HydrophobicContact CB-CG1 4.04Å; I328-V347 HydrophobicContact CG2-CG1 3.8Å; I328-V347 HydrophobicContact CG2-CG2 4.44Å
329	K	88.8	Confident	82.9	Confident	42 Å²	42	50.8 Å²	50.8	18%	0.183	24%	0.239	C	C	.	.	H	α-helix	trans	-55.4	-41.8	175.5	174.6	161	-176.4	168.6	0	113.4	T327 R333 V347 L348	T327-K329 PolarHBondContact O-N 2.89Å; K329-R333 VanDerWaalsContact CE-CZ 3.48Å; K329-R333 WeakPolarHBondContact O-CG 3.28Å; K329-R333 PolarHBondContact O-N 3.08Å; K329-V347 HydrophobicContact CB-CG1 4.25Å; K329-L348 HydrophobicContact CD-CD2 4.43Å; K329-L348 HydrophobicContact CG-CD2 3.82Å; K329-L348 PolarHBondContact NZ-O 3.01Å
330	E	87	Confident	83.9	Confident	33 Å²	33	52.2 Å²	52.2	15%	0.154	25%	0.248	C	C	.	.	H	α-helix	trans	-69.7	-40.4	177.3	-173.4	77.1	-143.9	0	0	111.5	K296 T327 I328 R333 R334	K296-E330 IonicContact NZ-OE2 2.89Å; K296-E330 PolarHBondContact NZ-OE2 2.8Å; T327-E330 PolarHBondContact O-N 3.08Å; T327-E330 WeakPolarHBondContact OG1-CB 3.23Å; T327-E330 PolarHBondContact OG1-N 3.46Å; I328-E330 VanDerWaalsContact C-N 3.31Å; I328-E330 PolarHBondContact O-N 3.48Å; E330-R333 PolarHBondContact O-N 2.94Å; E330-R334 VanDerWaalsContact CD-CZ 3.43Å; E330-R334 VanDerWaalsContact CG-NH1 3.32Å; E330-R334 VanDerWaalsContact CG-NH2 3.35Å; E330-R334 WeakPolarHBondContact O-CG 3.41Å; E330-R334 PolarHBondContact O-N 3.15Å; E330-R334 IonicContact OE1-CZ 3.85Å; E330-R334 IonicContact OE1-NE 3.21Å; E330-R334 PolarHBondContact OE1-NE 2.94Å; E330-R334 IonicContact OE1-NH1 3.33Å; E330-R334 IonicContact OE1-NH2 3.03Å; E330-R334 PolarHBondContact OE1-NH2 2.94Å; E330-R334 IonicContact OE2-NH2 4Å
331	L	89.9	Confident	84.7	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-68.8	-40.4	178.1	-69.2	176.9	0	0	0	112.6	W240 I241 A244 L256 F326 T327 I328 R333 R334 L335	W240-L331 HydrophobicContact CE3-CD1 3.73Å; W240-L331 HydrophobicContact CH2-CB 3.39Å; W240-L331 HydrophobicContact CH2-CD1 3.99Å; W240-L331 HydrophobicContact CH2-CG 4.32Å; W240-L331 HydrophobicContact CZ2-CB 4.42Å; W240-L331 HydrophobicContact CZ3-CB 3.5Å; W240-L331 HydrophobicContact CZ3-CD1 3.39Å; W240-L331 HydrophobicContact CZ3-CG 4.09Å; I241-L331 HydrophobicContact CB-CD1 4.16Å; I241-L331 HydrophobicContact CG1-CD1 3.93Å; I241-L331 HydrophobicContact CG2-CD1 4.15Å; A244-L331 HydrophobicContact CB-CD1 4.16Å; A244-L331 HydrophobicContact CB-CD2 3.77Å; L256-L331 HydrophobicContact CD1-CD2 3.73Å; F326-L331 HydrophobicContact CB-CD1 4.19Å; F326-L331 HydrophobicContact CB-CD2 4.12Å; F326-L331 HydrophobicContact CB-CG 3.94Å; F326-L331 HydrophobicContact CD2-CD2 3.83Å; F326-L331 HydrophobicContact CE2-CD2 4.48Å; F326-L331 HydrophobicContact CG-CD2 4.07Å; F326-L331 HydrophobicContact CG-CG 4.44Å; T327-L331 PolarHBondContact O-N 2.94Å; T327-L331 VanDerWaalsContact O-N 3.07Å; I328-L331 PolarHBondContact O-N 2.69Å; I328-L331 VanDerWaalsContact O-N 3.13Å; L331-R333 VanDerWaalsContact C-N 3.25Å; L331-R333 PolarHBondContact O-N 3.41Å; L331-R334 PolarHBondContact O-N 3.07Å; L331-L335 HydrophobicContact CB-CD1 4.39Å; L331-L335 VanDerWaalsContact O-CB 3.28Å; L331-L335 WeakPolarHBondContact O-CB 3.24Å; L331-L335 WeakPolarHBondContact O-CG 3.29Å; L331-L335 PolarHBondContact O-N 2.98Å
332	I	89.8	Confident	85.7	Confident	3 Å²	3	52.9 Å²	52.9	2%	0.015	25%	0.245	C	C	.	.	H	α-helix	trans	-53.6	-46.6	172.6	-74.3	173.7	0	0	0	110.5	F271 I328 H336 I337 V344 V347 L348	F271-I332 HydrophobicContact CE2-CD1 4Å; F271-I332 HydrophobicContact CE2-CG1 4.04Å; F271-I332 HydrophobicContact CZ-CD1 3.74Å; F271-I332 HydrophobicContact CZ-CG1 4.08Å; I328-I332 HydrophobicContact CG2-CD1 3.95Å; I328-I332 HydrophobicContact CG2-CG1 4.25Å; I328-I332 WeakPolarHBondContact O-CG1 3.41Å; I328-I332 PolarHBondContact O-N 2.79Å; I332-H336 WeakPolarHBondContact O-CA 3.49Å; I332-H336 PolarHBondContact O-N 3.35Å; I332-I337 HydrophobicContact CG2-CB 4.35Å; I332-I337 PolarHBondContact O-N 3.44Å; I332-V344 HydrophobicContact CG2-CG1 3.92Å; I332-V347 HydrophobicContact CD1-CB 3.73Å; I332-V347 HydrophobicContact CD1-CG1 3.57Å; I332-V347 HydrophobicContact CD1-CG2 4.22Å; I332-L348 HydrophobicContact CG2-CD1 4.34Å; I332-L348 HydrophobicContact CG2-CD2 4.03Å; I332-L348 HydrophobicContact CG2-CG 4.28Å
333	R	90.1	Very high	86.8	Confident	139 Å²	139	50.6 Å²	50.6	53%	0.525	23%	0.23	S	C	.	.	H	α-helix	trans	-66.2	-40.9	179.4	-71.3	172	175.8	-175.5	-8.8	112.7	K329 E330 L331 L348	K329-R333 VanDerWaalsContact CE-CZ 3.48Å; K329-R333 WeakPolarHBondContact O-CG 3.28Å; K329-R333 PolarHBondContact O-N 3.08Å; E330-R333 PolarHBondContact O-N 2.94Å; L331-R333 VanDerWaalsContact C-N 3.25Å; L331-R333 PolarHBondContact O-N 3.41Å; R333-L348 HydrophobicContact CG-CD2 4.18Å
334	R	87.2	Confident	87.8	Confident	51 Å²	51	44.9 Å²	44.9	19%	0.192	21%	0.209	C	C	.	.	H	α-helix	trans	-78.5	-29.4	-177.6	-72	-178.4	-174.2	150.5	-1.2	114.4	E330 L331	E330-R334 VanDerWaalsContact CD-CZ 3.43Å; E330-R334 VanDerWaalsContact CG-NH1 3.32Å; E330-R334 VanDerWaalsContact CG-NH2 3.35Å; E330-R334 WeakPolarHBondContact O-CG 3.41Å; E330-R334 PolarHBondContact O-N 3.15Å; E330-R334 IonicContact OE1-CZ 3.85Å; E330-R334 IonicContact OE1-NE 3.21Å; E330-R334 PolarHBondContact OE1-NE 2.94Å; E330-R334 IonicContact OE1-NH1 3.33Å; E330-R334 IonicContact OE1-NH2 3.03Å; E330-R334 PolarHBondContact OE1-NH2 2.94Å; E330-R334 IonicContact OE2-NH2 4Å; L331-R334 PolarHBondContact O-N 3.07Å
335	L	89.6	Confident	88.3	Confident	4 Å²	4	45.6 Å²	45.6	2%	0.021	21%	0.213	C	C	.	.	H	α-helix	trans	-92.5	-2.3	177.3	-61.9	172.5	0	0	0	111.9	W240 M259 R264 M267 I268 L331 I337	W240-L335 HydrophobicContact CH2-CD1 3.9Å; W240-L335 HydrophobicContact CZ2-CD1 3.42Å; W240-L335 VanDerWaalsContact CZ2-CD1 3.42Å; M259-L335 HydrophobicContact CE-CD2 4.4Å; M259-L335 HydrophobicContact SD-CD2 3.92Å; R264-L335 HydrophobicContact CG-CD2 4.03Å; M267-L335 HydrophobicContact CB-CD1 4.11Å; M267-L335 HydrophobicContact CE-CD1 3.94Å; M267-L335 HydrophobicContact SD-CD1 4.27Å; I268-L335 WeakPolarHBondContact CD1-O 3.35Å; I268-L335 HydrophobicContact CG1-CB 4.3Å; L331-L335 HydrophobicContact CB-CD1 4.39Å; L331-L335 VanDerWaalsContact O-CB 3.28Å; L331-L335 WeakPolarHBondContact O-CB 3.24Å; L331-L335 WeakPolarHBondContact O-CG 3.29Å; L331-L335 PolarHBondContact O-N 2.98Å; L335-I337 VanDerWaalsContact C-N 3.31Å; L335-I337 HydrophobicContact CB-CD1 4.02Å; L335-I337 HydrophobicContact CB-CG1 3.92Å; L335-I337 HydrophobicContact CD1-CD1 4.19Å; L335-I337 PolarHBondContact O-N 3.19Å
336	H	89.6	Confident	88.6	Confident	158 Å²	158	44 Å²	44	73%	0.731	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.2	43.4	-179.1	-59.8	-83.4	0	0	0	113.2	I332 S338	I332-H336 WeakPolarHBondContact O-CA 3.49Å; I332-H336 PolarHBondContact O-N 3.35Å; H336-S338 PolarHBondContact O-N 3.17Å
337	I	91.4	Very high	88.7	Confident	10 Å²	10	44.5 Å²	44.5	5%	0.051	21%	0.211	C	C	.	.			trans	-77.4	121.3	179.9	-61.4	170.5	0	0	0	109.2	W240 I268 F271 I332 L335 K339 V344	W240-I337 HydrophobicContact CH2-CD1 3.92Å; W240-I337 HydrophobicContact CZ2-CD1 3.65Å; I268-I337 HydrophobicContact CG1-CG1 3.99Å; I268-I337 HydrophobicContact CG2-CG1 4.5Å; F271-I337 HydrophobicContact CB-CD1 4.02Å; F271-I337 HydrophobicContact CD1-CD1 4.44Å; F271-I337 HydrophobicContact CD1-CG2 3.53Å; F271-I337 HydrophobicContact CD2-CD1 4.19Å; F271-I337 HydrophobicContact CE1-CG2 3.8Å; F271-I337 HydrophobicContact CG-CD1 3.96Å; F271-I337 HydrophobicContact CG-CG2 4.14Å; I332-I337 HydrophobicContact CG2-CB 4.35Å; I332-I337 PolarHBondContact O-N 3.44Å; L335-I337 VanDerWaalsContact C-N 3.31Å; L335-I337 HydrophobicContact CB-CD1 4.02Å; L335-I337 HydrophobicContact CB-CG1 3.92Å; L335-I337 HydrophobicContact CD1-CD1 4.19Å; L335-I337 PolarHBondContact O-N 3.19Å; I337-K339 WeakPolarHBondContact CG2-O 3.28Å; I337-V344 HydrophobicContact CG2-CG2 3.91Å
338	S	87.8	Confident	88.8	Confident	76 Å²	76	45.1 Å²	45.1	53%	0.531	21%	0.214	S	C	.	.			trans	-112.9	-15.3	179.9	58.6	0	0	0	0	114.1	H336 K341	H336-S338 PolarHBondContact O-N 3.17Å; S338-K341 VanDerWaalsContact O-CG 3.3Å; S338-K341 WeakPolarHBondContact O-CG 3.16Å
339	K	87.2	Confident	88.7	Confident	138 Å²	138	45.7 Å²	45.7	60%	0.6	22%	0.221	S	C	*	.			trans	-124.9	151	-177.7	-63.6	-176.3	-179.6	-176.4	0	111.5	L272 I337	L272-K339 HydrophobicContact CD2-CB 3.97Å; L272-K339 WeakPolarHBondContact CD2-O 3.32Å; I337-K339 WeakPolarHBondContact CG2-O 3.28Å
340	P	88.8	Confident	88.7	Confident	35 Å²	35	49 Å²	49	23%	0.227	24%	0.235	C	C	.	.	S	Bend	cis	-66.2	138.6	-13.3	-15.2	31	0	0	0	110.7	L272 F342 N343 V344	L272-P340 HydrophobicContact CD2-CG 4.44Å; P340-F342 PolarHBondContact O-N 3.3Å; P340-N343 HydrophobicContact CB-CB 4.4Å; P340-N343 PolarHBondContact O-N 3.01Å; P340-V344 WeakPolarHBondContact O-CG2 3.37Å; P340-V344 PolarHBondContact O-N 3.27Å
341	K	87.6	Confident	88.8	Confident	75 Å²	75	51 Å²	51	33%	0.326	25%	0.251	S	S	.	.	H	α-helix	trans	-63.1	-41.3	-168.6	-73.6	-163.4	-177	176.6	0	112.6	S338 V344 M345 M362 L364	S338-K341 VanDerWaalsContact O-CG 3.3Å; S338-K341 WeakPolarHBondContact O-CG 3.16Å; K341-V344 PolarHBondContact O-N 3.16Å; K341-M345 WeakPolarHBondContact O-CB 3.38Å; K341-M345 VanDerWaalsContact O-CG 3.22Å; K341-M345 WeakPolarHBondContact O-CG 3.49Å; K341-M345 PolarHBondContact O-N 3.27Å; K341-M362 WeakPolarHBondContact CD-O 3.47Å; K341-M362 WeakPolarHBondContact CE-O 3.28Å; K341-M362 PolarHBondContact NZ-O 2.87Å; K341-L364 HydrophobicContact CB-CD2 4.26Å
342	F	88.8	Confident	88.8	Confident	66 Å²	66	52 Å²	52	29%	0.289	26%	0.255	S	S	.	.	H	α-helix	trans	-57	-51.5	175.5	-179.8	-104.5	0	0	0	112	P340 V344 M345 C346 L364 M377 F379	P340-F342 PolarHBondContact O-N 3.3Å; F342-V344 PolarHBondContact O-N 3.03Å; F342-M345 PolarHBondContact O-N 3.35Å; F342-C346 WeakPolarHBondContact O-CB 3.38Å; F342-C346 PolarHBondContact O-N 2.96Å; F342-C346 PolarHBondContact O-SG 2.96Å; F342-L364 HydrophobicContact CB-CD2 4.09Å; F342-L364 HydrophobicContact CD2-CD2 4.49Å; F342-M377 HydrophobicContact CD2-CE 3.45Å; F342-M377 VanDerWaalsContact CD2-CE 3.45Å; F342-M377 HydrophobicContact CE2-CE 3.74Å; F342-M377 HydrophobicContact CG-CE 4.49Å; F342-F379 HydrophobicContact CE1-CD1 4.43Å
343	N	89.5	Confident	88.8	Confident	15 Å²	15	52 Å²	52	8%	0.08	26%	0.255	C	S	.	.	H	α-helix	trans	-61.2	-46.2	-179.6	-65.8	13.5	0	0	0	111.6	L279 P340 C346 V347 F379	L279-N343 HydrophobicContact CD1-CB 3.81Å; P340-N343 HydrophobicContact CB-CB 4.4Å; P340-N343 PolarHBondContact O-N 3.01Å; N343-C346 PolarHBondContact O-N 3Å; N343-V347 WeakPolarHBondContact O-CG2 3.33Å; N343-V347 PolarHBondContact O-N 2.95Å; N343-F379 HydrophobicContact CB-CE1 4.2Å; N343-F379 HydrophobicContact CB-CZ 4.25Å; N343-F379 WeakPolarHBondContact O-CZ 3.19Å
344	V	89.7	Confident	88.7	Confident	9 Å²	9	49.2 Å²	49.2	6%	0.055	26%	0.257	C	S	.	.	H	α-helix	trans	-60.8	-47.5	178	169.8	0	0	0	0	110.7	F271 I332 I337 P340 K341 F342 V347 L348	F271-V344 HydrophobicContact CE1-CG2 3.89Å; F271-V344 HydrophobicContact CZ-CG2 4.4Å; I332-V344 HydrophobicContact CG2-CG1 3.92Å; I337-V344 HydrophobicContact CG2-CG2 3.91Å; P340-V344 WeakPolarHBondContact O-CG2 3.37Å; P340-V344 PolarHBondContact O-N 3.27Å; K341-V344 PolarHBondContact O-N 3.16Å; F342-V344 PolarHBondContact O-N 3.03Å; V344-V347 PolarHBondContact O-N 3.05Å; V344-L348 HydrophobicContact CG1-CD1 3.86Å; V344-L348 HydrophobicContact CG1-CG 4.31Å; V344-L348 WeakPolarHBondContact O-CB 3.37Å; V344-L348 VanDerWaalsContact O-CG 3.26Å; V344-L348 WeakPolarHBondContact O-CG 3.46Å; V344-L348 PolarHBondContact O-N 3.04Å
345	M	89.1	Confident	88.8	Confident	31 Å²	31	49.7 Å²	49.7	15%	0.153	26%	0.263	C	S	.	.	H	α-helix	trans	-66	-39.9	-179.1	-73	-178.6	172.6	0	0	112.7	K341 F342 L348 G349 K350 M362 L364 M377	K341-M345 WeakPolarHBondContact O-CB 3.38Å; K341-M345 VanDerWaalsContact O-CG 3.22Å; K341-M345 WeakPolarHBondContact O-CG 3.49Å; K341-M345 PolarHBondContact O-N 3.27Å; F342-M345 PolarHBondContact O-N 3.35Å; M345-L348 PolarHBondContact O-N 3.19Å; M345-G349 WeakPolarHBondContact O-CA 3.5Å; M345-G349 PolarHBondContact O-N 3.44Å; M345-K350 HydrophobicContact CB-CB 4.22Å; M345-K350 HydrophobicContact CG-CB 4.36Å; M345-K350 HydrophobicContact CG-CG 4.45Å; M345-K350 PolarHBondContact O-N 3.28Å; M345-K350 VanDerWaalsContact O-N 3.07Å; M345-M362 HydrophobicContact CE-CB 4.16Å; M345-M362 HydrophobicContact CE-CE 3.24Å; M345-M362 HydrophobicContact CE-CG 4.26Å; M345-M362 HydrophobicContact SD-CE 3.44Å; M345-M362 WeakPolarHBondContact SD-CE 3.36Å; M345-L364 HydrophobicContact SD-CD1 4.39Å; M345-L364 HydrophobicContact SD-CD2 3.85Å; M345-L364 HydrophobicContact SD-CG 4.32Å; M345-M377 HydrophobicContact CB-CE 4.19Å; M345-M377 HydrophobicContact CB-SD 3.73Å; M345-M377 HydrophobicContact SD-SD 4.16Å
346	C	87.9	Confident	88.6	Confident	11 Å²	11	52.2 Å²	52.2	7%	0.074	28%	0.281	C	S	.	.	H	α-helix	trans	-59.6	-46.5	173.1	-74.3	0	0	0	0	111.8	F342 N343 G349 F379	F342-C346 WeakPolarHBondContact O-CB 3.38Å; F342-C346 PolarHBondContact O-N 2.96Å; F342-C346 PolarHBondContact O-SG 2.96Å; N343-C346 PolarHBondContact O-N 3Å; C346-G349 PolarHBondContact O-N 3.26Å; C346-F379 HydrophobicContact CB-CD1 3.98Å; C346-F379 HydrophobicContact CB-CD2 3.95Å; C346-F379 HydrophobicContact CB-CE1 3.78Å; C346-F379 HydrophobicContact CB-CE2 3.75Å; C346-F379 HydrophobicContact CB-CG 4.07Å; C346-F379 HydrophobicContact CB-CZ 3.66Å
347	V	88.1	Confident	88.6	Confident	15 Å²	15	49.2 Å²	49.2	9%	0.091	27%	0.274	C	S	.	.	H	α-helix	trans	-66.9	-40.7	177.7	176.9	0	0	0	0	111.9	I328 K329 I332 N343 V344 G349 F379	I328-V347 HydrophobicContact CB-CG1 4.04Å; I328-V347 HydrophobicContact CG2-CG1 3.8Å; I328-V347 HydrophobicContact CG2-CG2 4.44Å; K329-V347 HydrophobicContact CB-CG1 4.25Å; I332-V347 HydrophobicContact CD1-CB 3.73Å; I332-V347 HydrophobicContact CD1-CG1 3.57Å; I332-V347 HydrophobicContact CD1-CG2 4.22Å; N343-V347 WeakPolarHBondContact O-CG2 3.33Å; N343-V347 PolarHBondContact O-N 2.95Å; V344-V347 PolarHBondContact O-N 3.05Å; V347-G349 PolarHBondContact O-N 3.17Å; V347-F379 HydrophobicContact CG2-CE2 3.58Å; V347-F379 HydrophobicContact CG2-CZ 3.79Å
348	L	88.3	Confident	88.4	Confident	31 Å²	31	50.4 Å²	50.4	16%	0.162	28%	0.281	C	S	.	.	H	α-helix	trans	-69.5	-23.8	177	-67.5	-177.4	0	0	0	111.9	K329 I332 R333 V344 M345 K350	K329-L348 HydrophobicContact CD-CD2 4.43Å; K329-L348 HydrophobicContact CG-CD2 3.82Å; K329-L348 PolarHBondContact NZ-O 3.01Å; I332-L348 HydrophobicContact CG2-CD1 4.34Å; I332-L348 HydrophobicContact CG2-CD2 4.03Å; I332-L348 HydrophobicContact CG2-CG 4.28Å; R333-L348 HydrophobicContact CG-CD2 4.18Å; V344-L348 HydrophobicContact CG1-CD1 3.86Å; V344-L348 HydrophobicContact CG1-CG 4.31Å; V344-L348 WeakPolarHBondContact O-CB 3.37Å; V344-L348 VanDerWaalsContact O-CG 3.26Å; V344-L348 WeakPolarHBondContact O-CG 3.46Å; V344-L348 PolarHBondContact O-N 3.04Å; M345-L348 PolarHBondContact O-N 3.19Å; L348-K350 HydrophobicContact CB-CG 4.14Å
349	G	86.1	Confident	88.4	Confident	17 Å²	17	47.2 Å²	47.2	18%	0.175	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.5	45.5	-176.2	0	0	0	0	0	111.9	M345 C346 V347 R376	M345-G349 WeakPolarHBondContact O-CA 3.5Å; M345-G349 PolarHBondContact O-N 3.44Å; C346-G349 PolarHBondContact O-N 3.26Å; V347-G349 PolarHBondContact O-N 3.17Å; G349-R376 PolarHBondContact O-NE 3.49Å
350	K	88.5	Confident	88.2	Confident	112 Å²	112	46.5 Å²	46.5	49%	0.487	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-73.4	153	174.8	-71.8	-72.9	-172.2	168.4	0	110.6	M345 L348 M377	M345-K350 HydrophobicContact CB-CB 4.22Å; M345-K350 HydrophobicContact CG-CB 4.36Å; M345-K350 HydrophobicContact CG-CG 4.45Å; M345-K350 PolarHBondContact O-N 3.28Å; M345-K350 VanDerWaalsContact O-N 3.07Å; L348-K350 HydrophobicContact CB-CG 4.14Å; K350-M377 WeakPolarHBondContact O-CB 3.43Å; K350-M377 WeakPolarHBondContact O-CG 3.48Å; K350-M377 PolarHBondContact O-N 3.29Å
351	P	90	Very high	88.1	Confident	75 Å²	75	53 Å²	53	49%	0.487	28%	0.279	S	S	.	.	B	Isolated β-bridge	trans	-67.5	148.9	171.2	30.2	-33.8	0	0	0	110.2	T375	P351-T375 CarbonylContact C-O 3.45Å; P351-T375 WeakPolarHBondContact CA-O 3.45Å
352	Y	90.3	Very high	87.9	Confident	20 Å²	20	51.5 Å²	51.5	8%	0.078	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-69.3	142.6	170.1	-166	-101	0	0	0	109	S354 F359 W368 D369 K372 G374 T375 M377	Y352-S354 PolarHBondContact O-N 2.92Å; Y352-F359 HydrophobicContact CE1-CD2 4.37Å; Y352-F359 HydrophobicContact CE2-CD2 4.34Å; Y352-F359 HydrophobicContact CE2-CE2 4.09Å; Y352-F359 AromaticContact CZ-CD2 3.88Å; Y352-F359 AromaticContact CZ-CE2 3.77Å; Y352-F359 WeakPolarHBondContact OH-CE2 3.47Å; Y352-W368 AromaticContact CE1-CD1 3.72Å; Y352-W368 AromaticContact CE1-NE1 3.94Å; Y352-D369 HydrophobicContact CE1-CB 4.38Å; Y352-D369 WeakPolarHBondContact CE1-O 3.27Å; Y352-D369 PolarHBondContact OH-N 3.23Å; Y352-K372 VanDerWaalsContact CB-O 3.27Å; Y352-K372 WeakPolarHBondContact CB-O 3.29Å; Y352-K372 HydrophobicContact CD1-CB 3.52Å; Y352-K372 HydrophobicContact CD2-CB 4.41Å; Y352-K372 HydrophobicContact CE1-CB 3.75Å; Y352-K372 HydrophobicContact CE2-CD 4.5Å; Y352-K372 HydrophobicContact CG-CB 3.86Å; Y352-G374 PolarHBondContact O-N 3.32Å; Y352-G374 VanDerWaalsContact O-N 3.07Å; Y352-T375 WeakPolarHBondContact CB-O 3.47Å; Y352-T375 PolarHBondContact N-O 2.94Å; Y352-M377 HydrophobicContact CD2-CE 4.06Å; Y352-M377 HydrophobicContact CD2-CG 3.97Å; Y352-M377 HydrophobicContact CD2-SD 4.15Å; Y352-M377 HydrophobicContact CE2-CE 4.49Å; Y352-M377 HydrophobicContact CG-CG 4.47Å
353	P	88.9	Confident	87.5	Confident	4 Å²	4	49.9 Å²	49.9	3%	0.026	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-52.8	134.6	-177.6	-23.1	30	0	0	0	112.8	D355 D358 F359 M362 L364 W368	P353-D355 VanDerWaalsContact C-N 3.29Å; P353-D355 PolarHBondContact O-N 2.95Å; P353-D358 HydrophobicContact CB-CB 3.85Å; P353-F359 HydrophobicContact CB-CB 3.85Å; P353-F359 HydrophobicContact CG-CB 3.89Å; P353-F359 HydrophobicContact CG-CD2 3.92Å; P353-F359 HydrophobicContact CG-CG 4.34Å; P353-M362 HydrophobicContact CB-SD 4.21Å; P353-M362 HydrophobicContact CG-CE 4.17Å; P353-M362 HydrophobicContact CG-SD 3.73Å; P353-L364 HydrophobicContact CG-CD1 3.64Å; P353-W368 PolarHBondContact O-NE1 3.1Å
354	S	88.4	Confident	87.2	Confident	80 Å²	80	49.9 Å²	49.9	56%	0.559	28%	0.276	S	S	*	.	S	Bend	trans	-72.3	-24	-177.6	-56.8	0	0	0	0	113.2	Y352 W368	Y352-S354 PolarHBondContact O-N 2.92Å; S354-W368 VanDerWaalsContact O-CZ2 3.29Å; S354-W368 WeakPolarHBondContact O-CZ2 3.39Å
355	D	89.6	Confident	86.7	Confident	61 Å²	61	58 Å²	58	33%	0.326	31%	0.313	S	S	.	.	S	Bend	trans	-141.8	167.9	179.2	59.3	39	0	0	0	111.4	P353 T357 D358 F359 W368	P353-D355 VanDerWaalsContact C-N 3.29Å; P353-D355 PolarHBondContact O-N 2.95Å; D355-T357 VanDerWaalsContact C-N 3.32Å; D355-T357 PolarHBondContact O-N 2.98Å; D355-T357 PolarHBondContact OD1-N 2.82Å; D355-T357 PolarHBondContact OD1-OG1 3.42Å; D355-T357 PolarHBondContact OD2-OG1 2.86Å; D355-D358 PolarHBondContact O-N 2.98Å; D355-D358 WeakPolarHBondContact OD1-CA 3.18Å; D355-D358 WeakPolarHBondContact OD1-CB 3.16Å; D355-D358 PolarHBondContact OD1-N 3.12Å; D355-F359 PolarHBondContact O-N 3.29Å; D355-F359 VanDerWaalsContact O-N 3.12Å; D355-W368 PolarHBondContact O-NE1 3.48Å
356	S	85.8	Confident	86.4	Confident	57 Å²	57	59.5 Å²	59.5	40%	0.399	34%	0.336	S	S	.	.	H	α-helix	trans	-65	-35.2	-179.4	-177.2	0	0	0	0	112.4	D358 F359 I360	S356-D358 PolarHBondContact O-N 3.44Å; S356-F359 WeakPolarHBondContact O-CB 3.42Å; S356-F359 PolarHBondContact O-N 3.22Å; S356-I360 WeakPolarHBondContact O-CG1 3.45Å; S356-I360 PolarHBondContact O-N 3.26Å
357	T	88.3	Confident	86.2	Confident	95 Å²	95	66.2 Å²	66.2	58%	0.583	37%	0.371	S	S	*	.	H	α-helix	trans	-62.4	-44.1	177.4	37.1	0	0	0	0	112.3	D355 F359 I360 R361	D355-T357 VanDerWaalsContact C-N 3.32Å; D355-T357 PolarHBondContact O-N 2.98Å; D355-T357 PolarHBondContact OD1-N 2.82Å; D355-T357 PolarHBondContact OD1-OG1 3.42Å; D355-T357 PolarHBondContact OD2-OG1 2.86Å; T357-F359 VanDerWaalsContact C-N 3.32Å; T357-I360 PolarHBondContact O-N 3.07Å; T357-R361 VanDerWaalsContact O-CB 3.26Å; T357-R361 WeakPolarHBondContact O-CB 3.49Å; T357-R361 PolarHBondContact O-N 3.04Å
358	D	87	Confident	86.2	Confident	35 Å²	35	69.4 Å²	69.4	19%	0.187	38%	0.382	C	S	.	.	H	α-helix	trans	-66.6	-36.5	175.8	-79.1	2.4	0	0	0	111	P353 D355 S356 R361 M362	P353-D358 HydrophobicContact CB-CB 3.85Å; D355-D358 PolarHBondContact O-N 2.98Å; D355-D358 WeakPolarHBondContact OD1-CA 3.18Å; D355-D358 WeakPolarHBondContact OD1-CB 3.16Å; D355-D358 PolarHBondContact OD1-N 3.12Å; S356-D358 PolarHBondContact O-N 3.44Å; D358-R361 PolarHBondContact O-N 3.26Å; D358-R361 IonicContact OD1-CZ 2.89Å; D358-R361 IonicContact OD1-NE 3.95Å; D358-R361 IonicContact OD1-NH1 3.35Å; D358-R361 PolarHBondContact OD1-NH1 3.11Å; D358-R361 IonicContact OD1-NH2 3.89Å; D358-R361 PolarHBondContact OD1-NH2 2.98Å; D358-R361 IonicContact OD2-NH2 2.86Å; D358-R361 PolarHBondContact OD2-NH2 2.84Å; D358-M362 WeakPolarHBondContact O-CA 3.48Å; D358-M362 WeakPolarHBondContact O-CB 3.44Å; D358-M362 WeakPolarHBondContact O-CG 3.43Å; D358-M362 PolarHBondContact O-N 3.01Å
359	F	87.8	Confident	86.1	Confident	10 Å²	10	70.2 Å²	70.2	4%	0.044	39%	0.386	C	S	.	.	H	α-helix	trans	-62	-48.9	176.6	-178	-84.3	0	0	0	112.3	Y352 P353 D355 S356 T357 M362 G363 L364 G366 W368	Y352-F359 HydrophobicContact CE1-CD2 4.37Å; Y352-F359 HydrophobicContact CE2-CD2 4.34Å; Y352-F359 HydrophobicContact CE2-CE2 4.09Å; Y352-F359 AromaticContact CZ-CD2 3.88Å; Y352-F359 AromaticContact CZ-CE2 3.77Å; Y352-F359 WeakPolarHBondContact OH-CE2 3.47Å; P353-F359 HydrophobicContact CB-CB 3.85Å; P353-F359 HydrophobicContact CG-CB 3.89Å; P353-F359 HydrophobicContact CG-CD2 3.92Å; P353-F359 HydrophobicContact CG-CG 4.34Å; D355-F359 PolarHBondContact O-N 3.29Å; D355-F359 VanDerWaalsContact O-N 3.12Å; S356-F359 WeakPolarHBondContact O-CB 3.42Å; S356-F359 PolarHBondContact O-N 3.22Å; T357-F359 VanDerWaalsContact C-N 3.32Å; F359-M362 CarbonylContact O-C 3.56Å; F359-M362 PolarHBondContact O-N 2.92Å; F359-G363 PolarHBondContact O-N 2.69Å; F359-G363 VanDerWaalsContact O-N 3.16Å; F359-L364 HydrophobicContact CD1-CB 4.45Å; F359-L364 HydrophobicContact CD2-CB 3.97Å; F359-L364 HydrophobicContact CD2-CD1 3.75Å; F359-L364 HydrophobicContact CD2-CG 4.49Å; F359-L364 HydrophobicContact CE1-CB 4.01Å; F359-L364 WeakPolarHBondContact CE1-O 3.33Å; F359-L364 HydrophobicContact CE2-CB 3.5Å; F359-L364 VanDerWaalsContact CE2-CB 3.5Å; F359-L364 HydrophobicContact CE2-CD1 3.79Å; F359-L364 HydrophobicContact CE2-CG 4.29Å; F359-L364 HydrophobicContact CG-CB 4.41Å; F359-L364 HydrophobicContact CZ-CB 3.53Å; F359-L364 PolarHBondContact O-N 3.17Å; F359-G366 WeakPolarHBondContact CE1-O 3.37Å; F359-G366 WeakPolarHBondContact CZ-O 3.48Å; F359-W368 HydrophobicContact CB-CB 4.01Å; F359-W368 HydrophobicContact CB-CG 4.06Å; F359-W368 HydrophobicContact CD1-CB 4.1Å; F359-W368 HydrophobicContact CD2-CB 4.15Å; F359-W368 AromaticContact CD2-CD1 3.82Å; F359-W368 HydrophobicContact CD2-CG 4.41Å; F359-W368 HydrophobicContact CG-CB 3.82Å; F359-W368 AromaticContact CG-CD1 3.89Å; F359-W368 HydrophobicContact CG-CG 4.24Å
360	I	84.3	Confident	86.1	Confident	123 Å²	123	73.3 Å²	73.3	63%	0.631	41%	0.405	S	S	*	.	H	α-helix	trans	-64.5	-46.3	176.6	-63.7	168.4	0	0	0	110.3	S356 T357 M362 G363	S356-I360 WeakPolarHBondContact O-CG1 3.45Å; S356-I360 PolarHBondContact O-N 3.26Å; T357-I360 PolarHBondContact O-N 3.07Å; I360-M362 VanDerWaalsContact C-N 3.26Å; I360-M362 PolarHBondContact O-N 3.45Å; I360-G363 WeakPolarHBondContact O-CA 3.47Å; I360-G363 PolarHBondContact O-N 3.33Å
361	R	85.3	Confident	86.1	Confident	171 Å²	171	72.3 Å²	72.3	65%	0.645	41%	0.413	S	S	*	.	H	α-helix	trans	-59.5	-39.3	176.8	-173.7	177.1	71.2	-137.3	3.2	111.8	T357 D358 G363	T357-R361 VanDerWaalsContact O-CB 3.26Å; T357-R361 WeakPolarHBondContact O-CB 3.49Å; T357-R361 PolarHBondContact O-N 3.04Å; D358-R361 PolarHBondContact O-N 3.26Å; D358-R361 IonicContact OD1-CZ 2.89Å; D358-R361 IonicContact OD1-NE 3.95Å; D358-R361 IonicContact OD1-NH1 3.35Å; D358-R361 PolarHBondContact OD1-NH1 3.11Å; D358-R361 IonicContact OD1-NH2 3.89Å; D358-R361 PolarHBondContact OD1-NH2 2.98Å; D358-R361 IonicContact OD2-NH2 2.86Å; D358-R361 PolarHBondContact OD2-NH2 2.84Å; R361-G363 PolarHBondContact O-N 3.01Å
362	M	83.3	Confident	85.7	Confident	43 Å²	43	73.5 Å²	73.5	21%	0.212	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-6.3	175.2	-74.8	172.5	69	0	0	112.2	K341 M345 P353 D358 F359 I360 L364	K341-M362 WeakPolarHBondContact CD-O 3.47Å; K341-M362 WeakPolarHBondContact CE-O 3.28Å; K341-M362 PolarHBondContact NZ-O 2.87Å; M345-M362 HydrophobicContact CE-CB 4.16Å; M345-M362 HydrophobicContact CE-CE 3.24Å; M345-M362 HydrophobicContact CE-CG 4.26Å; M345-M362 HydrophobicContact SD-CE 3.44Å; M345-M362 WeakPolarHBondContact SD-CE 3.36Å; P353-M362 HydrophobicContact CB-SD 4.21Å; P353-M362 HydrophobicContact CG-CE 4.17Å; P353-M362 HydrophobicContact CG-SD 3.73Å; D358-M362 WeakPolarHBondContact O-CA 3.48Å; D358-M362 WeakPolarHBondContact O-CB 3.44Å; D358-M362 WeakPolarHBondContact O-CG 3.43Å; D358-M362 PolarHBondContact O-N 3.01Å; F359-M362 CarbonylContact O-C 3.56Å; F359-M362 PolarHBondContact O-N 2.92Å; I360-M362 VanDerWaalsContact C-N 3.26Å; I360-M362 PolarHBondContact O-N 3.45Å; M362-L364 HydrophobicContact CB-CG 4.42Å; M362-L364 PolarHBondContact O-N 2.85Å
363	G	81.6	Confident	85.5	Confident	33 Å²	33	74.4 Å²	74.4	34%	0.34	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.8	35.5	175.2	0	0	0	0	0	113.3	F359 I360 R361	F359-G363 PolarHBondContact O-N 2.69Å; F359-G363 VanDerWaalsContact O-N 3.16Å; I360-G363 WeakPolarHBondContact O-CA 3.47Å; I360-G363 PolarHBondContact O-N 3.33Å; R361-G363 PolarHBondContact O-N 3.01Å
364	L	83.7	Confident	85.4	Confident	15 Å²	15	76.3 Å²	76.3	8%	0.079	44%	0.442	C	S	.	.			trans	-74.5	142.8	169.3	-69.7	171	0	0	0	108.5	K341 F342 M345 P353 F359 M362 M377	K341-L364 HydrophobicContact CB-CD2 4.26Å; F342-L364 HydrophobicContact CB-CD2 4.09Å; F342-L364 HydrophobicContact CD2-CD2 4.49Å; M345-L364 HydrophobicContact SD-CD1 4.39Å; M345-L364 HydrophobicContact SD-CD2 3.85Å; M345-L364 HydrophobicContact SD-CG 4.32Å; P353-L364 HydrophobicContact CG-CD1 3.64Å; F359-L364 HydrophobicContact CD1-CB 4.45Å; F359-L364 HydrophobicContact CD2-CB 3.97Å; F359-L364 HydrophobicContact CD2-CD1 3.75Å; F359-L364 HydrophobicContact CD2-CG 4.49Å; F359-L364 HydrophobicContact CE1-CB 4.01Å; F359-L364 WeakPolarHBondContact CE1-O 3.33Å; F359-L364 HydrophobicContact CE2-CB 3.5Å; F359-L364 VanDerWaalsContact CE2-CB 3.5Å; F359-L364 HydrophobicContact CE2-CD1 3.79Å; F359-L364 HydrophobicContact CE2-CG 4.29Å; F359-L364 HydrophobicContact CG-CB 4.41Å; F359-L364 HydrophobicContact CZ-CB 3.53Å; F359-L364 PolarHBondContact O-N 3.17Å; M362-L364 HydrophobicContact CB-CG 4.42Å; M362-L364 PolarHBondContact O-N 2.85Å; L364-M377 HydrophobicContact CD1-CE 4.11Å; L364-M377 HydrophobicContact CD1-SD 4.46Å; L364-M377 HydrophobicContact CD2-CE 4.01Å
365	E	79.4	Confident	85.3	Confident	180 Å²	180	75.7 Å²	75.7	84%	0.841	44%	0.435	S	S	*	.	S	Bend	trans	-87.5	142	177.5	-66.7	168.4	-163.8	0	0	109.2
366	G	82.4	Confident	85.3	Confident	61 Å²	61	80.4 Å²	80.4	63%	0.629	45%	0.448	S	S	*	.	S	Bend	trans	104	-172.5	-178	0	0	0	0	0	114	F359	F359-G366 WeakPolarHBondContact CE1-O 3.37Å; F359-G366 WeakPolarHBondContact CZ-O 3.48Å
367	D	83.7	Confident	85.4	Confident	153 Å²	153	78.1 Å²	78.1	82%	0.818	43%	0.431	S	S	*	.			trans	-89.2	143.5	177.5	-60.7	-43.3	0	0	0	111.3
368	W	87.8	Confident	85.2	Confident	82 Å²	82	81 Å²	81	31%	0.311	44%	0.436	S	S	.	.			trans	-67	135.4	173.7	177.4	74.1	0	0	0	110.5	Y352 P353 S354 D355 F359 S370 A373	Y352-W368 AromaticContact CE1-CD1 3.72Å; Y352-W368 AromaticContact CE1-NE1 3.94Å; P353-W368 PolarHBondContact O-NE1 3.1Å; S354-W368 VanDerWaalsContact O-CZ2 3.29Å; S354-W368 WeakPolarHBondContact O-CZ2 3.39Å; D355-W368 PolarHBondContact O-NE1 3.48Å; F359-W368 HydrophobicContact CB-CB 4.01Å; F359-W368 HydrophobicContact CB-CG 4.06Å; F359-W368 HydrophobicContact CD1-CB 4.1Å; F359-W368 HydrophobicContact CD2-CB 4.15Å; F359-W368 AromaticContact CD2-CD1 3.82Å; F359-W368 HydrophobicContact CD2-CG 4.41Å; F359-W368 HydrophobicContact CG-CB 3.82Å; F359-W368 AromaticContact CG-CD1 3.89Å; F359-W368 HydrophobicContact CG-CG 4.24Å; W368-S370 VanDerWaalsContact CH2-CB 3.43Å; W368-A373 HydrophobicContact CZ2-CB 4.14Å
369	D	86	Confident	85	Confident	47 Å²	47	80.4 Å²	80.4	25%	0.251	43%	0.432	S	S	.	.			trans	-116.8	106.2	-176	179	-5.4	0	0	0	108.3	Y352 S371 K372	Y352-D369 HydrophobicContact CE1-CB 4.38Å; Y352-D369 WeakPolarHBondContact CE1-O 3.27Å; Y352-D369 PolarHBondContact OH-N 3.23Å; D369-S371 VanDerWaalsContact CG-OG 3.28Å; D369-S371 PolarHBondContact O-N 3.47Å; D369-S371 WeakPolarHBondContact OD1-CB 3.2Å; D369-S371 PolarHBondContact OD1-N 3.1Å; D369-S371 VanDerWaalsContact OD1-N 3.08Å; D369-S371 PolarHBondContact OD1-OG 3.3Å; D369-S371 PolarHBondContact OD2-OG 2.87Å; D369-K372 HydrophobicContact CB-CB 4.47Å; D369-K372 HydrophobicContact CB-CD 4.27Å; D369-K372 HydrophobicContact CB-CG 4.37Å; D369-K372 PolarHBondContact O-N 3.27Å; D369-K372 WeakPolarHBondContact OD2-CD 3.47Å; D369-K372 VanDerWaalsContact OD2-CE 3.3Å; D369-K372 WeakPolarHBondContact OD2-CE 3.34Å; D369-K372 IonicContact OD2-NZ 2.64Å; D369-K372 PolarHBondContact OD2-NZ 3.3Å
370	S	86.7	Confident	84.2	Confident	82 Å²	82	83.7 Å²	83.7	57%	0.573	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-59.6	-29.5	-176.9	61.4	0	0	0	0	112.8	W368 K372 A373	W368-S370 VanDerWaalsContact CH2-CB 3.43Å; S370-K372 PolarHBondContact O-N 2.96Å; S370-A373 VanDerWaalsContact O-CB 3.29Å; S370-A373 WeakPolarHBondContact O-CB 2.97Å; S370-A373 PolarHBondContact O-N 3.24Å
371	S	86.9	Confident	83.4	Confident	92 Å²	92	83.4 Å²	83.4	64%	0.643	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-67.9	-22.4	179	74.9	0	0	0	0	113	D369	D369-S371 VanDerWaalsContact CG-OG 3.28Å; D369-S371 PolarHBondContact O-N 3.47Å; D369-S371 WeakPolarHBondContact OD1-CB 3.2Å; D369-S371 PolarHBondContact OD1-N 3.1Å; D369-S371 VanDerWaalsContact OD1-N 3.08Å; D369-S371 PolarHBondContact OD1-OG 3.3Å; D369-S371 PolarHBondContact OD2-OG 2.87Å
372	K	83.4	Confident	82.4	Confident	99 Å²	99	77 Å²	77	43%	0.43	44%	0.438	S	S	.	.	G	3₁₀ helix	trans	-93.5	-7.2	178.9	-67.1	-178.1	-177	116.7	0	112.9	Y352 D369 S370 G374 T375	Y352-K372 VanDerWaalsContact CB-O 3.27Å; Y352-K372 WeakPolarHBondContact CB-O 3.29Å; Y352-K372 HydrophobicContact CD1-CB 3.52Å; Y352-K372 HydrophobicContact CD2-CB 4.41Å; Y352-K372 HydrophobicContact CE1-CB 3.75Å; Y352-K372 HydrophobicContact CE2-CD 4.5Å; Y352-K372 HydrophobicContact CG-CB 3.86Å; D369-K372 HydrophobicContact CB-CB 4.47Å; D369-K372 HydrophobicContact CB-CD 4.27Å; D369-K372 HydrophobicContact CB-CG 4.37Å; D369-K372 PolarHBondContact O-N 3.27Å; D369-K372 WeakPolarHBondContact OD2-CD 3.47Å; D369-K372 VanDerWaalsContact OD2-CE 3.3Å; D369-K372 WeakPolarHBondContact OD2-CE 3.34Å; D369-K372 IonicContact OD2-NZ 2.64Å; D369-K372 PolarHBondContact OD2-NZ 3.3Å; S370-K372 PolarHBondContact O-N 2.96Å; K372-G374 PolarHBondContact O-N 3.2Å; K372-T375 VanDerWaalsContact O-CB 3.29Å; K372-T375 WeakPolarHBondContact O-CB 3.44Å; K372-T375 WeakPolarHBondContact O-CG2 3.38Å; K372-T375 PolarHBondContact O-N 3.33Å; K372-T375 PolarHBondContact O-OG1 3.34Å
373	A	86.1	Confident	81.4	Confident	39 Å²	39	79.7 Å²	79.7	32%	0.322	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50	127.6	-176.2	0	0	0	0	0	112.4	W368 S370 T375	W368-A373 HydrophobicContact CZ2-CB 4.14Å; S370-A373 VanDerWaalsContact O-CB 3.29Å; S370-A373 WeakPolarHBondContact O-CB 2.97Å; S370-A373 PolarHBondContact O-N 3.24Å; A373-T375 PolarHBondContact O-N 3.15Å
374	G	85.8	Confident	80.8	Confident	45 Å²	45	79 Å²	79	46%	0.464	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.8	-12.2	-178.4	0	0	0	0	0	115.7	Y352 K372	Y352-G374 PolarHBondContact O-N 3.32Å; Y352-G374 VanDerWaalsContact O-N 3.07Å; K372-G374 PolarHBondContact O-N 3.2Å
375	T	87.2	Confident	80.4	Confident	67 Å²	67	80.1 Å²	80.1	41%	0.411	45%	0.449	S	S	.	.	S	Bend	trans	-70	147.3	178.3	71.7	0	0	0	0	111	P351 Y352 K372 A373 M377	P351-T375 CarbonylContact C-O 3.45Å; P351-T375 WeakPolarHBondContact CA-O 3.45Å; Y352-T375 WeakPolarHBondContact CB-O 3.47Å; Y352-T375 PolarHBondContact N-O 2.94Å; K372-T375 VanDerWaalsContact O-CB 3.29Å; K372-T375 WeakPolarHBondContact O-CB 3.44Å; K372-T375 WeakPolarHBondContact O-CG2 3.38Å; K372-T375 PolarHBondContact O-N 3.33Å; K372-T375 PolarHBondContact O-OG1 3.34Å; A373-T375 PolarHBondContact O-N 3.15Å; T375-M377 PolarHBondContact O-N 3.04Å
376	R	88	Confident	80.1	Confident	159 Å²	159	75.1 Å²	75.1	60%	0.6	43%	0.426	S	S	*	.	B	Isolated β-bridge	trans	-71.1	119.2	-178.6	-171.6	173.9	-173.7	-172.9	-3.8	110.6	G349 K378	G349-R376 PolarHBondContact O-NE 3.49Å; R376-K378 PolarHBondContact O-N 2.72Å
377	M	88	Confident	79.7	Confident	9 Å²	9	74.1 Å²	74.1	4%	0.044	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-60	131.3	177.3	-62.5	-177.7	75.5	0	0	111	F342 M345 K350 Y352 L364 T375	F342-M377 HydrophobicContact CD2-CE 3.45Å; F342-M377 VanDerWaalsContact CD2-CE 3.45Å; F342-M377 HydrophobicContact CE2-CE 3.74Å; F342-M377 HydrophobicContact CG-CE 4.49Å; M345-M377 HydrophobicContact CB-CE 4.19Å; M345-M377 HydrophobicContact CB-SD 3.73Å; M345-M377 HydrophobicContact SD-SD 4.16Å; K350-M377 WeakPolarHBondContact O-CB 3.43Å; K350-M377 WeakPolarHBondContact O-CG 3.48Å; K350-M377 PolarHBondContact O-N 3.29Å; Y352-M377 HydrophobicContact CD2-CE 4.06Å; Y352-M377 HydrophobicContact CD2-CG 3.97Å; Y352-M377 HydrophobicContact CD2-SD 4.15Å; Y352-M377 HydrophobicContact CE2-CE 4.49Å; Y352-M377 HydrophobicContact CG-CG 4.47Å; L364-M377 HydrophobicContact CD1-CE 4.11Å; L364-M377 HydrophobicContact CD1-SD 4.46Å; L364-M377 HydrophobicContact CD2-CE 4.01Å; T375-M377 PolarHBondContact O-N 3.04Å
378	K	83.9	Confident	79.4	Confident	157 Å²	157	68.8 Å²	68.8	68%	0.683	38%	0.378	S	S	*	.			trans	-140.7	149.9	176.6	-67.4	175.4	-173.8	169.9	0	107.9	R376	R376-K378 PolarHBondContact O-N 2.72Å
379	F	82.8	Confident	79	Confident	22 Å²	22	65.9 Å²	65.9	10%	0.096	37%	0.368	C	S	.	.			trans	-60.3	146.5	168	-67.2	-68.4	0	0	0	110.4	E276 L279 A280 F342 N343 C346 V347 V381	E276-F379 HydrophobicContact CB-CD1 3.89Å; E276-F379 HydrophobicContact CB-CE1 4.2Å; E276-F379 HydrophobicContact CG-CD1 4.11Å; E276-F379 HydrophobicContact CG-CE1 4.16Å; L279-F379 HydrophobicContact CB-CE1 4.36Å; L279-F379 HydrophobicContact CB-CE2 3.84Å; L279-F379 HydrophobicContact CB-CZ 3.67Å; L279-F379 HydrophobicContact CD1-CE1 4.45Å; L279-F379 HydrophobicContact CD1-CZ 3.95Å; L279-F379 HydrophobicContact CG-CZ 4.48Å; A280-F379 HydrophobicContact CB-CB 3.79Å; A280-F379 HydrophobicContact CB-CD2 4.07Å; A280-F379 HydrophobicContact CB-CG 4.07Å; F342-F379 HydrophobicContact CE1-CD1 4.43Å; N343-F379 HydrophobicContact CB-CE1 4.2Å; N343-F379 HydrophobicContact CB-CZ 4.25Å; N343-F379 WeakPolarHBondContact O-CZ 3.19Å; C346-F379 HydrophobicContact CB-CD1 3.98Å; C346-F379 HydrophobicContact CB-CD2 3.95Å; C346-F379 HydrophobicContact CB-CE1 3.78Å; C346-F379 HydrophobicContact CB-CE2 3.75Å; C346-F379 HydrophobicContact CB-CG 4.07Å; C346-F379 HydrophobicContact CB-CZ 3.66Å; V347-F379 HydrophobicContact CG2-CE2 3.58Å; V347-F379 HydrophobicContact CG2-CZ 3.79Å; F379-V381 PolarHBondContact O-N 3.25Å
380	P	72.4	Confident	78.5	Confident	78 Å²	78	68.6 Å²	68.6	51%	0.506	39%	0.391	S	S	.	.			trans	-54.1	131.9	168.6	22.3	-30.9	0	0	0	109.1	E276 P382	E276-P380 WeakPolarHBondContact OE2-CG 3.46Å; P380-P382 WeakPolarHBondContact O-CD 3.43Å; P380-P382 VanDerWaalsContact O-N 3.08Å
381	V	68	Low	78.1	Confident	117 Å²	117	70.3 Å²	70.3	71%	0.709	40%	0.398	S	S	*	.			trans	-64	115.2	178.2	178.6	0	0	0	0	106.8	F379 V383 T387	F379-V381 PolarHBondContact O-N 3.25Å; V381-V383 PolarHBondContact O-N 3.35Å; V381-T387 HydrophobicContact CG1-CG2 3.96Å
382	P	63.4	Low	77.7	Confident	36 Å²	36	69.4 Å²	69.4	23%	0.234	39%	0.386	C	S	.	.			trans	-68.5	134.6	-176.1	27.7	-33.4	0	0	0	109.4	Y277 P380 T384 T387	Y277-P382 HydrophobicContact CD2-CB 3.48Å; Y277-P382 VanDerWaalsContact CD2-CB 3.48Å; Y277-P382 HydrophobicContact CD2-CG 3.9Å; Y277-P382 HydrophobicContact CE2-CB 3.82Å; Y277-P382 HydrophobicContact CE2-CG 4.04Å; P380-P382 WeakPolarHBondContact O-CD 3.43Å; P380-P382 VanDerWaalsContact O-N 3.08Å; P382-T384 VanDerWaalsContact C-N 3.26Å; P382-T384 HydrophobicContact CB-CG2 4.06Å; P382-T384 HydrophobicContact CG-CG2 4.15Å; P382-T384 PolarHBondContact O-N 3.07Å; P382-T387 PolarHBondContact O-OG1 3.25Å
383	V	63	Low	77.4	Confident	100 Å²	100	66 Å²	66	61%	0.606	38%	0.379	S	S	*	.			trans	-69.9	89.7	170.6	-177	0	0	0	0	107.4	V381 E388	V381-V383 PolarHBondContact O-N 3.35Å; V383-E388 HydrophobicContact CG1-CG 4.03Å
384	T	68.4	Low	77.1	Confident	19 Å²	19	68.3 Å²	68.3	12%	0.117	39%	0.386	C	S	.	.			trans	-110.2	152.9	173.7	63.8	0	0	0	0	108.2	Y277 P382 E386 T387 E388	Y277-T384 HydrophobicContact CE2-CG2 3.54Å; P382-T384 VanDerWaalsContact C-N 3.26Å; P382-T384 HydrophobicContact CB-CG2 4.06Å; P382-T384 HydrophobicContact CG-CG2 4.15Å; P382-T384 PolarHBondContact O-N 3.07Å; T384-E386 PolarHBondContact O-N 2.97Å; T384-E386 VanDerWaalsContact O-N 3.15Å; T384-T387 WeakPolarHBondContact CA-OG1 3.24Å; T384-T387 PolarHBondContact N-OG1 3.01Å; T384-T387 PolarHBondContact O-N 3.03Å; T384-T387 PolarHBondContact O-OG1 3.43Å; T384-T387 PolarHBondContact OG1-N 2.85Å; T384-T387 VanDerWaalsContact OG1-N 3.11Å; T384-T387 PolarHBondContact OG1-OG1 3.48Å; T384-E388 PolarHBondContact O-N 3.25Å
385	W	74.3	Confident	77	Confident	38 Å²	38	69.2 Å²	69.2	14%	0.144	38%	0.38	C	S	.	.	H	α-helix	trans	-55	-32.4	171.6	70.2	-87.4	0	0	0	112.1	L389 W399 L402 V408 A412 N416	W385-L389 HydrophobicContact CE3-CD1 3.48Å; W385-L389 VanDerWaalsContact CE3-CD1 3.48Å; W385-L389 HydrophobicContact CE3-CG 4.5Å; W385-L389 HydrophobicContact CZ3-CD1 3.73Å; W385-L389 WeakPolarHBondContact O-CB 3.49Å; W385-L389 WeakPolarHBondContact O-CG 3.27Å; W385-L389 PolarHBondContact O-N 3.48Å; W385-W399 HydrophobicContact CE3-CH2 4.27Å; W385-W399 HydrophobicContact CZ3-CH2 4.48Å; W385-L402 HydrophobicContact CB-CD1 3.96Å; W385-L402 HydrophobicContact CB-CD2 4.03Å; W385-V408 HydrophobicContact CB-CG2 4.21Å; W385-A412 HydrophobicContact CD2-CB 4.12Å; W385-A412 VanDerWaalsContact CE2-CB 3.47Å; W385-A412 HydrophobicContact CG-CB 4.4Å; W385-A412 HydrophobicContact CZ2-CB 3.81Å; W385-A412 VanDerWaalsContact NE1-CB 3.33Å; W385-N416 WeakPolarHBondContact CH2-ND2 3.48Å; W385-N416 WeakPolarHBondContact CZ3-ND2 3.47Å
386	E	74.5	Confident	76.8	Confident	75 Å²	75	67.4 Å²	67.4	35%	0.35	37%	0.37	S	S	.	.	H	α-helix	trans	-65.4	-43.2	175.3	-62.6	175.8	166.9	0	0	112.3	T384 S390	T384-E386 PolarHBondContact O-N 2.97Å; T384-E386 VanDerWaalsContact O-N 3.15Å; E386-S390 WeakPolarHBondContact O-CB 3.03Å; E386-S390 PolarHBondContact O-N 3.05Å; E386-S390 PolarHBondContact O-OG 2.72Å
387	T	74	Confident	76.7	Confident	40 Å²	40	65.8 Å²	65.8	25%	0.245	37%	0.373	C	S	.	.	H	α-helix	trans	-71.3	-43.6	179.2	37.4	0	0	0	0	111.1	V381 P382 T384 L389 S390 V391	V381-T387 HydrophobicContact CG1-CG2 3.96Å; P382-T387 PolarHBondContact O-OG1 3.25Å; T384-T387 WeakPolarHBondContact CA-OG1 3.24Å; T384-T387 PolarHBondContact N-OG1 3.01Å; T384-T387 PolarHBondContact O-N 3.03Å; T384-T387 PolarHBondContact O-OG1 3.43Å; T384-T387 PolarHBondContact OG1-N 2.85Å; T384-T387 VanDerWaalsContact OG1-N 3.11Å; T384-T387 PolarHBondContact OG1-OG1 3.48Å; T387-L389 PolarHBondContact O-N 3.2Å; T387-S390 PolarHBondContact O-N 2.85Å; T387-S390 VanDerWaalsContact O-N 3.16Å; T387-V391 WeakPolarHBondContact O-CG2 3.36Å; T387-V391 PolarHBondContact O-N 3.3Å
388	E	77.1	Confident	76.5	Confident	41 Å²	41	65.7 Å²	65.7	19%	0.192	37%	0.373	C	S	.	.	H	α-helix	trans	-59.8	-46.4	175.1	-73.5	-71.6	151.6	0	0	111.9	V383 T384 S390 V391 N392 L402	V383-E388 HydrophobicContact CG1-CG 4.03Å; T384-E388 PolarHBondContact O-N 3.25Å; E388-S390 VanDerWaalsContact C-N 3.28Å; E388-S390 PolarHBondContact O-N 3.47Å; E388-V391 PolarHBondContact O-N 3.1Å; E388-N392 WeakPolarHBondContact O-CB 3.48Å; E388-N392 PolarHBondContact O-N 3.14Å; E388-N392 PolarHBondContact O-ND2 3.35Å; E388-N392 PolarHBondContact OE2-ND2 3.2Å; E388-L402 HydrophobicContact CB-CD1 4.13Å; E388-L402 HydrophobicContact CB-CD2 3.89Å; E388-L402 HydrophobicContact CB-CG 4.3Å; E388-L402 HydrophobicContact CG-CD2 3.95Å
389	L	78.5	Confident	76.8	Confident	22 Å²	22	58.2 Å²	58.2	12%	0.115	34%	0.341	C	S	.	.	H	α-helix	trans	-67.9	-27.8	176.4	-69.4	175.8	0	0	0	113.2	W385 T387 G393 W399 L402	W385-L389 HydrophobicContact CE3-CD1 3.48Å; W385-L389 VanDerWaalsContact CE3-CD1 3.48Å; W385-L389 HydrophobicContact CE3-CG 4.5Å; W385-L389 HydrophobicContact CZ3-CD1 3.73Å; W385-L389 WeakPolarHBondContact O-CB 3.49Å; W385-L389 WeakPolarHBondContact O-CG 3.27Å; W385-L389 PolarHBondContact O-N 3.48Å; T387-L389 PolarHBondContact O-N 3.2Å; L389-G393 CarbonylContact O-C 3.55Å; L389-G393 VanDerWaalsContact O-C 3.26Å; L389-G393 WeakPolarHBondContact O-CA 3.28Å; L389-G393 PolarHBondContact O-N 2.73Å; L389-W399 HydrophobicContact CD1-CH2 3.52Å; L389-W399 HydrophobicContact CD1-CZ2 3.49Å; L389-W399 VanDerWaalsContact CD1-CZ2 3.49Å; L389-W399 HydrophobicContact CD1-CZ3 4.28Å; L389-W399 HydrophobicContact CD2-CD2 4.27Å; L389-W399 HydrophobicContact CD2-CZ2 4.05Å; L389-W399 HydrophobicContact CG-CZ2 4.42Å; L389-L402 HydrophobicContact CD2-CD1 4.02Å; L389-L402 HydrophobicContact CG-CD1 3.94Å
390	S	77	Confident	77	Confident	103 Å²	103	58.3 Å²	58.3	72%	0.72	35%	0.345	S	S	*	.	H	α-helix	trans	-74.2	-34.9	176.7	-60.8	0	0	0	0	111.9	E386 T387 E388	E386-S390 WeakPolarHBondContact O-CB 3.03Å; E386-S390 PolarHBondContact O-N 3.05Å; E386-S390 PolarHBondContact O-OG 2.72Å; T387-S390 PolarHBondContact O-N 2.85Å; T387-S390 VanDerWaalsContact O-N 3.16Å; E388-S390 VanDerWaalsContact C-N 3.28Å; E388-S390 PolarHBondContact O-N 3.47Å
391	V	76.4	Confident	77.7	Confident	119 Å²	119	59.8 Å²	59.8	72%	0.721	34%	0.343	S	S	*	.	H	α-helix	trans	-82.2	-50.9	-179.5	175.3	0	0	0	0	111	T387 E388	T387-V391 WeakPolarHBondContact O-CG2 3.36Å; T387-V391 PolarHBondContact O-N 3.3Å; E388-V391 PolarHBondContact O-N 3.1Å
392	N	78.8	Confident	78.6	Confident	72 Å²	72	54.5 Å²	54.5	39%	0.385	31%	0.31	S	S	.	.	H	α-helix	trans	-91.5	-10.8	-173	-56	-30.2	0	0	0	113.1	E388 N395 S398	E388-N392 WeakPolarHBondContact O-CB 3.48Å; E388-N392 PolarHBondContact O-N 3.14Å; E388-N392 PolarHBondContact O-ND2 3.35Å; E388-N392 PolarHBondContact OE2-ND2 3.2Å; N392-N395 PolarHBondContact O-ND2 3.35Å; N392-S398 WeakPolarHBondContact CB-OG 3.28Å
393	G	77.2	Confident	79.8	Confident	28 Å²	28	52.9 Å²	52.9	29%	0.289	30%	0.3	S	S	.	.			trans	87.1	164	-176.1	0	0	0	0	0	113.9	L389 N395 S398	L389-G393 CarbonylContact O-C 3.55Å; L389-G393 VanDerWaalsContact O-C 3.26Å; L389-G393 WeakPolarHBondContact O-CA 3.28Å; L389-G393 PolarHBondContact O-N 2.73Å; G393-N395 VanDerWaalsContact C-N 3.28Å; G393-N395 PolarHBondContact O-N 2.94Å; G393-S398 WeakPolarHBondContact O-CB 3.39Å; G393-S398 PolarHBondContact O-OG 3.28Å; G393-S398 VanDerWaalsContact O-OG 3.14Å
394	N	80	Confident	80.9	Confident	88 Å²	88	52.5 Å²	52.5	47%	0.471	30%	0.298	S	S	.	.	S	Bend	trans	-84.9	67.4	177.9	-172.6	16.4	0	0	0	110.8	W399	N394-W399 PolarHBondContact OD1-NE1 3.23Å
395	N	83.8	Confident	81.7	Confident	63 Å²	63	56.2 Å²	56.2	34%	0.337	32%	0.316	S	S	.	.	S	Bend	trans	-120.2	173	-176.2	59.2	25.3	0	0	0	112.4	N392 G393 D397 S398 W399	N392-N395 PolarHBondContact O-ND2 3.35Å; G393-N395 VanDerWaalsContact C-N 3.28Å; G393-N395 PolarHBondContact O-N 2.94Å; N395-D397 PolarHBondContact O-N 2.9Å; N395-S398 PolarHBondContact O-N 2.63Å; N395-S398 WeakPolarHBondContact OD1-CB 3.15Å; N395-S398 PolarHBondContact OD1-N 2.69Å; N395-S398 PolarHBondContact OD1-OG 3.04Å; N395-W399 VanDerWaalsContact O-CD1 3.25Å; N395-W399 PolarHBondContact O-N 3.31Å
396	S	82.8	Confident	82.1	Confident	29 Å²	29	59.5 Å²	59.5	20%	0.203	34%	0.337	C	S	.	.	H	α-helix	trans	-57.3	-47.1	-177.2	-166.5	0	0	0	0	112.8	S398 W399 S400 S423 N424 V425	S396-S398 PolarHBondContact O-N 2.8Å; S396-W399 PolarHBondContact O-N 2.84Å; S396-S400 WeakPolarHBondContact O-CB 3.41Å; S396-S400 PolarHBondContact O-N 2.82Å; S396-S400 PolarHBondContact O-OG 3.1Å; S396-S423 WeakPolarHBondContact CB-O 3.37Å; S396-N424 PolarHBondContact OG-O 3.17Å; S396-V425 VanDerWaalsContact OG-CA 3.32Å; S396-V425 WeakPolarHBondContact OG-CA 3.47Å
397	D	85.5	Confident	82.5	Confident	126 Å²	126	61.1 Å²	61.1	67%	0.674	34%	0.343	S	S	*	.	H	α-helix	trans	-64	-41.7	-175.8	-57.5	-36.2	0	0	0	111.9	N395 S400 K401	N395-D397 PolarHBondContact O-N 2.9Å; D397-S400 PolarHBondContact O-N 3.06Å; D397-K401 WeakPolarHBondContact O-CB 3.31Å; D397-K401 PolarHBondContact O-N 3.07Å
398	S	85.7	Confident	83.1	Confident	6 Å²	6	59.2 Å²	59.2	4%	0.042	33%	0.331	C	S	.	.	H	α-helix	trans	-63.5	-44	178.2	-60.3	0	0	0	0	111.7	N392 G393 N395 S396 L402	N392-S398 WeakPolarHBondContact CB-OG 3.28Å; G393-S398 WeakPolarHBondContact O-CB 3.39Å; G393-S398 PolarHBondContact O-OG 3.28Å; G393-S398 VanDerWaalsContact O-OG 3.14Å; N395-S398 PolarHBondContact O-N 2.63Å; N395-S398 WeakPolarHBondContact OD1-CB 3.15Å; N395-S398 PolarHBondContact OD1-N 2.69Å; N395-S398 PolarHBondContact OD1-OG 3.04Å; S396-S398 PolarHBondContact O-N 2.8Å; S398-L402 VanDerWaalsContact O-CB 3.29Å; S398-L402 WeakPolarHBondContact O-CB 3.37Å; S398-L402 WeakPolarHBondContact O-CD1 3.5Å; S398-L402 WeakPolarHBondContact O-CG 3.42Å; S398-L402 PolarHBondContact O-N 3.07Å
399	W	88.6	Confident	83.4	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-65.6	-44.2	176.1	-77.7	116.8	0	0	0	112.2	W385 L389 N394 N395 S396 K401 L402 I403 V408 N416 N419 I420 V425	W385-W399 HydrophobicContact CE3-CH2 4.27Å; W385-W399 HydrophobicContact CZ3-CH2 4.48Å; L389-W399 HydrophobicContact CD1-CH2 3.52Å; L389-W399 HydrophobicContact CD1-CZ2 3.49Å; L389-W399 VanDerWaalsContact CD1-CZ2 3.49Å; L389-W399 HydrophobicContact CD1-CZ3 4.28Å; L389-W399 HydrophobicContact CD2-CD2 4.27Å; L389-W399 HydrophobicContact CD2-CZ2 4.05Å; L389-W399 HydrophobicContact CG-CZ2 4.42Å; N394-W399 PolarHBondContact OD1-NE1 3.23Å; N395-W399 VanDerWaalsContact O-CD1 3.25Å; N395-W399 PolarHBondContact O-N 3.31Å; S396-W399 PolarHBondContact O-N 2.84Å; W399-K401 PolarHBondContact O-N 2.98Å; W399-L402 PolarHBondContact O-N 3.45Å; W399-I403 HydrophobicContact CB-CD1 4.33Å; W399-I403 HydrophobicContact CE3-CD1 4.41Å; W399-I403 WeakPolarHBondContact O-CB 3.2Å; W399-I403 WeakPolarHBondContact O-CD1 3.28Å; W399-I403 VanDerWaalsContact O-CG1 3.23Å; W399-I403 WeakPolarHBondContact O-CG1 3.47Å; W399-I403 PolarHBondContact O-N 3.21Å; W399-V408 HydrophobicContact CZ3-CG2 4.24Å; W399-N416 HydrophobicContact CH2-CB 3.43Å; W399-N416 VanDerWaalsContact CH2-CB 3.43Å; W399-N416 HydrophobicContact CZ2-CB 3.98Å; W399-N416 HydrophobicContact CZ3-CB 4.21Å; W399-N419 HydrophobicContact CZ2-CB 4.04Å; W399-I420 HydrophobicContact CD2-CG1 3.67Å; W399-I420 HydrophobicContact CE3-CD1 4.05Å; W399-I420 HydrophobicContact CE3-CG1 3.69Å; W399-I420 HydrophobicContact CG-CG1 4.16Å; W399-I420 HydrophobicContact CH2-CG1 4.4Å; W399-I420 HydrophobicContact CZ2-CG1 4.37Å; W399-I420 HydrophobicContact CZ3-CD1 4.14Å; W399-I420 HydrophobicContact CZ3-CG1 4.06Å; W399-V425 HydrophobicContact CB-CG1 3.9Å
400	S	87.5	Confident	83.9	Confident	25 Å²	25	60.6 Å²	60.6	18%	0.175	34%	0.343	C	S	.	.	H	α-helix	trans	-57.8	-49.6	178.5	-59.2	0	0	0	0	110.6	S396 D397 L402 T404	S396-S400 WeakPolarHBondContact O-CB 3.41Å; S396-S400 PolarHBondContact O-N 2.82Å; S396-S400 PolarHBondContact O-OG 3.1Å; D397-S400 PolarHBondContact O-N 3.06Å; S400-L402 PolarHBondContact O-N 2.97Å; S400-T404 WeakPolarHBondContact O-CB 3.42Å; S400-T404 PolarHBondContact O-N 3.48Å; S400-T404 PolarHBondContact O-OG1 2.98Å
401	K	86.5	Confident	84.3	Confident	109.5 Å²	109.5	58 Å²	58	48%	0.476	32%	0.321	S	S	.	.	H	α-helix	trans	-59.8	-47.4	176.8	-174.2	-179.8	179.9	-170.8	0	112.4	D397 W399 I403 L405	D397-K401 WeakPolarHBondContact O-CB 3.31Å; D397-K401 PolarHBondContact O-N 3.07Å; W399-K401 PolarHBondContact O-N 2.98Å; K401-I403 PolarHBondContact O-N 3.49Å; K401-L405 HydrophobicContact CG-CD1 3.79Å; K401-L405 WeakPolarHBondContact O-CB 3.43Å; K401-L405 VanDerWaalsContact O-CG 3.24Å; K401-L405 WeakPolarHBondContact O-CG 3.42Å; K401-L405 PolarHBondContact O-N 2.88Å
402	L	87.7	Confident	84.7	Confident	4 Å²	4	52.7 Å²	52.7	2%	0.021	29%	0.289	C	S	.	.	H	α-helix	trans	-67	-38.1	-176.7	-76.8	172.2	0	0	0	113.5	W385 E388 L389 S398 W399 S400 N406 K407 V408	W385-L402 HydrophobicContact CB-CD1 3.96Å; W385-L402 HydrophobicContact CB-CD2 4.03Å; E388-L402 HydrophobicContact CB-CD1 4.13Å; E388-L402 HydrophobicContact CB-CD2 3.89Å; E388-L402 HydrophobicContact CB-CG 4.3Å; E388-L402 HydrophobicContact CG-CD2 3.95Å; L389-L402 HydrophobicContact CD2-CD1 4.02Å; L389-L402 HydrophobicContact CG-CD1 3.94Å; S398-L402 VanDerWaalsContact O-CB 3.29Å; S398-L402 WeakPolarHBondContact O-CB 3.37Å; S398-L402 WeakPolarHBondContact O-CD1 3.5Å; S398-L402 WeakPolarHBondContact O-CG 3.42Å; S398-L402 PolarHBondContact O-N 3.07Å; W399-L402 PolarHBondContact O-N 3.45Å; S400-L402 PolarHBondContact O-N 2.97Å; L402-N406 PolarHBondContact O-N 3.4Å; L402-K407 HydrophobicContact CD2-CB 4.02Å; L402-K407 PolarHBondContact O-N 3.13Å; L402-V408 HydrophobicContact CB-CG2 3.76Å
403	I	88.8	Confident	85.2	Confident	3.5 Å²	3.5	49.3 Å²	49.3	2%	0.018	27%	0.271	C	S	.	.	H	α-helix	trans	-72.9	-46.1	-180	-67.7	164.5	0	0	0	109.8	W399 K401 L405 N406 V408 I420 I429 I432 V433	W399-I403 HydrophobicContact CB-CD1 4.33Å; W399-I403 HydrophobicContact CE3-CD1 4.41Å; W399-I403 WeakPolarHBondContact O-CB 3.2Å; W399-I403 WeakPolarHBondContact O-CD1 3.28Å; W399-I403 VanDerWaalsContact O-CG1 3.23Å; W399-I403 WeakPolarHBondContact O-CG1 3.47Å; W399-I403 PolarHBondContact O-N 3.21Å; K401-I403 PolarHBondContact O-N 3.49Å; I403-L405 VanDerWaalsContact C-N 3.34Å; I403-L405 PolarHBondContact O-N 3.27Å; I403-N406 PolarHBondContact O-N 3.32Å; I403-N406 VanDerWaalsContact O-N 3.08Å; I403-V408 HydrophobicContact CG1-CG2 4.43Å; I403-I420 HydrophobicContact CD1-CD1 4.15Å; I403-I420 HydrophobicContact CD1-CG1 4.42Å; I403-I420 HydrophobicContact CD1-CG2 4.27Å; I403-I429 HydrophobicContact CB-CG2 4.04Å; I403-I429 HydrophobicContact CD1-CG2 3.53Å; I403-I429 HydrophobicContact CG1-CG2 4.39Å; I403-I429 HydrophobicContact CG2-CG2 3.9Å; I403-I432 HydrophobicContact CG2-CB 4.24Å; I403-I432 HydrophobicContact CG2-CG2 3.72Å; I403-V433 HydrophobicContact CD1-CG2 3.79Å; I403-V433 HydrophobicContact CG1-CG2 4.39Å; I403-V433 HydrophobicContact CG2-CG2 4.03Å
404	T	86.8	Confident	85.8	Confident	91.5 Å²	91.5	48.3 Å²	48.3	56%	0.561	26%	0.259	S	S	*	.	H	α-helix	trans	-63.1	-39.2	178.5	-57	0	0	0	0	112.2	S400 N406 I429	S400-T404 WeakPolarHBondContact O-CB 3.42Å; S400-T404 PolarHBondContact O-N 3.48Å; S400-T404 PolarHBondContact O-OG1 2.98Å; T404-N406 PolarHBondContact O-N 3.33Å; T404-I429 WeakPolarHBondContact OG1-CD1 2.98Å
405	L	84.7	Confident	86.1	Confident	96.5 Å²	96.5	52.8 Å²	52.8	51%	0.505	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	4.2	175.9	-65.1	175.1	0	0	0	114.1	K401 I403 K407	K401-L405 HydrophobicContact CG-CD1 3.79Å; K401-L405 WeakPolarHBondContact O-CB 3.43Å; K401-L405 VanDerWaalsContact O-CG 3.24Å; K401-L405 WeakPolarHBondContact O-CG 3.42Å; K401-L405 PolarHBondContact O-N 2.88Å; I403-L405 VanDerWaalsContact C-N 3.34Å; I403-L405 PolarHBondContact O-N 3.27Å; L405-K407 HydrophobicContact CB-CG 3.81Å; L405-K407 WeakPolarHBondContact O-CG 3.38Å; L405-K407 PolarHBondContact O-N 2.69Å; L405-K407 VanDerWaalsContact O-N 3.14Å
406	N	83.1	Confident	86.3	Confident	107.5 Å²	107.5	50.5 Å²	50.5	58%	0.575	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	34.4	-176.2	-160.9	21.4	0	0	0	113.7	L402 I403 T404 R436	L402-N406 PolarHBondContact O-N 3.4Å; I403-N406 PolarHBondContact O-N 3.32Å; I403-N406 VanDerWaalsContact O-N 3.08Å; T404-N406 PolarHBondContact O-N 3.33Å; N406-R436 PolarHBondContact OD1-NH1 3.14Å; N406-R436 PolarHBondContact OD1-NH2 2.82Å; N406-R436 VanDerWaalsContact OD1-NH2 3.11Å
407	K	82.7	Confident	86.7	Confident	109.5 Å²	109.5	49.1 Å²	49.1	48%	0.476	25%	0.248	S	C	.	.			trans	-92.8	4.8	-178.2	-62.1	-59.6	-179.2	-178.9	0	113.9	L402 L405 P409	L402-K407 HydrophobicContact CD2-CB 4.02Å; L402-K407 PolarHBondContact O-N 3.13Å; L405-K407 HydrophobicContact CB-CG 3.81Å; L405-K407 WeakPolarHBondContact O-CG 3.38Å; L405-K407 PolarHBondContact O-N 2.69Å; L405-K407 VanDerWaalsContact O-N 3.14Å; K407-P409 WeakPolarHBondContact O-CD 3.39Å
408	V	85.7	Confident	86.8	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.236	C	C	.	.	S	Bend	trans	-104.1	103.2	173	-171.7	0	0	0	0	108.8	W385 W399 L402 I403 A412 L413 R436	W385-V408 HydrophobicContact CB-CG2 4.21Å; W399-V408 HydrophobicContact CZ3-CG2 4.24Å; L402-V408 HydrophobicContact CB-CG2 3.76Å; I403-V408 HydrophobicContact CG1-CG2 4.43Å; V408-A412 HydrophobicContact CG1-CB 3.83Å; V408-L413 HydrophobicContact CG1-CB 3.97Å; V408-L413 HydrophobicContact CG1-CD1 4.35Å; V408-R436 PolarHBondContact O-NH1 3.43Å; V408-R436 PolarHBondContact O-NH2 3.05Å
409	P	84.7	Confident	86.8	Confident	76 Å²	76	50.4 Å²	50.4	49%	0.494	25%	0.245	S	C	.	.			trans	-60.4	154.3	173.6	-23.3	33.6	0	0	0	111.7	K407 M411 A412 L413	K407-P409 WeakPolarHBondContact O-CD 3.39Å; P409-M411 PolarHBondContact O-N 2.92Å; P409-M411 VanDerWaalsContact O-N 3.09Å; P409-A412 WeakPolarHBondContact O-CA 3.27Å; P409-A412 WeakPolarHBondContact O-CB 3.43Å; P409-A412 PolarHBondContact O-N 3.17Å; P409-L413 PolarHBondContact O-N 3.26Å
410	H	88.3	Confident	86.8	Confident	15 Å²	15	50.4 Å²	50.4	7%	0.069	25%	0.245	C	C	.	.	H	α-helix	trans	-50.9	-39.7	-176.1	-167.7	55.9	0	0	0	113.9	L413 L414 I442 Y453	H410-L413 WeakPolarHBondContact O-CB 3.3Å; H410-L413 PolarHBondContact O-N 3.19Å; H410-L414 WeakPolarHBondContact O-CG 3.25Å; H410-L414 PolarHBondContact O-N 3.38Å; H410-I442 HydrophobicContact CB-CG2 4.21Å; H410-Y453 AromaticContact NE2-CE1 3.65Å; H410-Y453 AromaticContact NE2-CZ 3.73Å; H410-Y453 PolarHBondContact NE2-OH 3.05Å
411	M	84.2	Confident	86.8	Confident	49 Å²	49	49.4 Å²	49.4	24%	0.241	24%	0.238	C	C	.	.	H	α-helix	trans	-65.8	-40.2	174.6	-90.7	-66.8	97.2	0	0	115.4	P409 L413 L414 R415 Q448 R452	P409-M411 PolarHBondContact O-N 2.92Å; P409-M411 VanDerWaalsContact O-N 3.09Å; M411-L413 VanDerWaalsContact C-N 3.28Å; M411-L414 HydrophobicContact CE-CB 4.15Å; M411-L414 HydrophobicContact CE-CD1 3.3Å; M411-L414 HydrophobicContact CE-CG 4.1Å; M411-R415 WeakPolarHBondContact O-CG 3.32Å; M411-R415 PolarHBondContact O-N 2.8Å; M411-Q448 HydrophobicContact CE-CB 3.82Å; M411-Q448 HydrophobicContact CE-CG 3.23Å; M411-Q448 HydrophobicContact CG-CG 4.06Å; M411-Q448 HydrophobicContact SD-CG 4.12Å; M411-Q448 PolarHBondContact SD-OE1 3.11Å; M411-R452 HydrophobicContact CE-CB 3.89Å; M411-R452 HydrophobicContact CE-CG 4.06Å; M411-R452 HydrophobicContact SD-CG 4.21Å
412	A	85.2	Confident	86.7	Confident	8 Å²	8	45.5 Å²	45.5	7%	0.066	22%	0.222	C	C	.	.	H	α-helix	trans	-67.8	-35.4	175.3	0	0	0	0	0	110.3	W385 V408 P409 R415 N416	W385-A412 HydrophobicContact CD2-CB 4.12Å; W385-A412 VanDerWaalsContact CE2-CB 3.47Å; W385-A412 HydrophobicContact CG-CB 4.4Å; W385-A412 HydrophobicContact CZ2-CB 3.81Å; W385-A412 VanDerWaalsContact NE1-CB 3.33Å; V408-A412 HydrophobicContact CG1-CB 3.83Å; P409-A412 WeakPolarHBondContact O-CA 3.27Å; P409-A412 WeakPolarHBondContact O-CB 3.43Å; P409-A412 PolarHBondContact O-N 3.17Å; A412-R415 PolarHBondContact O-N 3.11Å; A412-N416 WeakPolarHBondContact O-CB 3.35Å; A412-N416 PolarHBondContact O-N 3.05Å; A412-N416 VanDerWaalsContact O-N 3.16Å; A412-N416 PolarHBondContact O-ND2 3.4Å
413	L	90.5	Very high	86.4	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-60.9	-55.4	176.2	-173.6	64.8	0	0	0	110.7	V408 P409 H410 M411 R415 N416 L417 I420 V433 R436 L437	V408-L413 HydrophobicContact CG1-CB 3.97Å; V408-L413 HydrophobicContact CG1-CD1 4.35Å; P409-L413 PolarHBondContact O-N 3.26Å; H410-L413 WeakPolarHBondContact O-CB 3.3Å; H410-L413 PolarHBondContact O-N 3.19Å; M411-L413 VanDerWaalsContact C-N 3.28Å; L413-R415 VanDerWaalsContact C-N 3.26Å; L413-R415 PolarHBondContact O-N 3.19Å; L413-N416 PolarHBondContact O-N 3.28Å; L413-L417 HydrophobicContact CD1-CD2 4.15Å; L413-L417 HydrophobicContact CG-CD2 4.01Å; L413-L417 WeakPolarHBondContact O-CD2 3.35Å; L413-L417 VanDerWaalsContact O-CG 3.31Å; L413-L417 WeakPolarHBondContact O-CG 3.34Å; L413-L417 PolarHBondContact O-N 3.19Å; L413-L417 VanDerWaalsContact O-N 3.07Å; L413-I420 HydrophobicContact CD1-CD1 3.7Å; L413-V433 HydrophobicContact CD1-CG1 3.99Å; L413-V433 HydrophobicContact CD1-CG2 4.18Å; L413-V433 HydrophobicContact CD2-CG1 4.28Å; L413-V433 HydrophobicContact CG-CG1 4.4Å; L413-R436 HydrophobicContact CD2-CB 4.37Å; L413-L437 HydrophobicContact CD2-CD2 4.23Å; L413-L437 HydrophobicContact CD2-CG 4.28Å
414	L	89.7	Confident	85.8	Confident	7.5 Å²	7.5	50.3 Å²	50.3	4%	0.039	25%	0.249	C	C	.	.	H	α-helix	trans	-55.8	-37.9	179	-71.2	-177.5	0	0	0	113.2	H410 M411 N416 L417 L437 R452 Y453 A456 L524	H410-L414 WeakPolarHBondContact O-CG 3.25Å; H410-L414 PolarHBondContact O-N 3.38Å; M411-L414 HydrophobicContact CE-CB 4.15Å; M411-L414 HydrophobicContact CE-CD1 3.3Å; M411-L414 HydrophobicContact CE-CG 4.1Å; L414-N416 VanDerWaalsContact C-N 3.3Å; L414-N416 PolarHBondContact O-N 2.93Å; L414-L417 HydrophobicContact CD2-CD1 4.32Å; L414-L437 HydrophobicContact CD2-CD2 3.68Å; L414-L437 VanDerWaalsContact CD2-CD2 3.45Å; L414-R452 HydrophobicContact CD1-CB 4.1Å; L414-Y453 HydrophobicContact CD1-CD1 3.81Å; L414-Y453 HydrophobicContact CD1-CE1 3.65Å; L414-Y453 HydrophobicContact CD1-CG 4.17Å; L414-Y453 HydrophobicContact CD2-CD1 3.96Å; L414-Y453 HydrophobicContact CD2-CE1 4.1Å; L414-Y453 HydrophobicContact CG-CD1 4.43Å; L414-Y453 HydrophobicContact CG-CE1 4.34Å; L414-A456 HydrophobicContact CB-CB 4.41Å; L414-A456 HydrophobicContact CD2-CB 4.26Å; L414-L524 HydrophobicContact CD2-CD2 3.6Å; L414-L524 VanDerWaalsContact CD2-CD2 3.43Å
415	R	84.9	Confident	85.8	Confident	181.5 Å²	181.5	46.3 Å²	46.3	69%	0.685	23%	0.225	S	C	*	.	H	α-helix	trans	-73.7	-22.7	179.5	-123.1	175.6	63.2	-171.1	-3.2	113.8	M411 A412 L413	M411-R415 WeakPolarHBondContact O-CG 3.32Å; M411-R415 PolarHBondContact O-N 2.8Å; A412-R415 PolarHBondContact O-N 3.11Å; L413-R415 VanDerWaalsContact C-N 3.26Å; L413-R415 PolarHBondContact O-N 3.19Å
416	N	89.5	Confident	85.8	Confident	15.5 Å²	15.5	48.3 Å²	48.3	8%	0.083	23%	0.231	C	C	.	.	H	α-helix	trans	-112.7	5	-172.4	-72.2	-69.9	0	0	0	114.2	W385 W399 A412 L413 L414 R418 N419 I420	W385-N416 WeakPolarHBondContact CH2-ND2 3.48Å; W385-N416 WeakPolarHBondContact CZ3-ND2 3.47Å; W399-N416 HydrophobicContact CH2-CB 3.43Å; W399-N416 VanDerWaalsContact CH2-CB 3.43Å; W399-N416 HydrophobicContact CZ2-CB 3.98Å; W399-N416 HydrophobicContact CZ3-CB 4.21Å; A412-N416 WeakPolarHBondContact O-CB 3.35Å; A412-N416 PolarHBondContact O-N 3.05Å; A412-N416 VanDerWaalsContact O-N 3.16Å; A412-N416 PolarHBondContact O-ND2 3.4Å; L413-N416 PolarHBondContact O-N 3.28Å; L414-N416 VanDerWaalsContact C-N 3.3Å; L414-N416 PolarHBondContact O-N 2.93Å; N416-R418 PolarHBondContact O-N 2.95Å; N416-R418 VanDerWaalsContact O-N 3.15Å; N416-N419 WeakPolarHBondContact O-CA 3.29Å; N416-N419 WeakPolarHBondContact O-CB 3.44Å; N416-N419 PolarHBondContact O-N 2.99Å; N416-N419 PolarHBondContact OD1-ND2 3.09Å; N416-I420 PolarHBondContact O-N 2.89Å; N416-I420 VanDerWaalsContact O-N 3.09Å
417	L	90.8	Very high	85.9	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-51.5	-41.3	-179.8	-62.8	-176.1	0	0	0	113.2	L413 L414 N419 I420 L421 V433 L437 A456 I460 Y520 L524	L413-L417 HydrophobicContact CD1-CD2 4.15Å; L413-L417 HydrophobicContact CG-CD2 4.01Å; L413-L417 WeakPolarHBondContact O-CD2 3.35Å; L413-L417 VanDerWaalsContact O-CG 3.31Å; L413-L417 WeakPolarHBondContact O-CG 3.34Å; L413-L417 PolarHBondContact O-N 3.19Å; L413-L417 VanDerWaalsContact O-N 3.07Å; L414-L417 HydrophobicContact CD2-CD1 4.32Å; L417-N419 VanDerWaalsContact C-N 3.3Å; L417-N419 PolarHBondContact O-N 3.04Å; L417-I420 HydrophobicContact CD2-CD1 4.48Å; L417-I420 PolarHBondContact O-N 3.34Å; L417-L421 WeakPolarHBondContact O-CB 3.46Å; L417-L421 WeakPolarHBondContact O-CG 3.34Å; L417-L421 PolarHBondContact O-N 3.06Å; L417-V433 HydrophobicContact CD2-CG1 4.11Å; L417-L437 HydrophobicContact CD1-CD1 4.28Å; L417-L437 HydrophobicContact CD2-CD1 4.32Å; L417-A456 HydrophobicContact CD1-CB 4.14Å; L417-I460 HydrophobicContact CB-CD1 4.19Å; L417-I460 HydrophobicContact CD1-CD1 4.1Å; L417-Y520 HydrophobicContact CD1-CD1 4.47Å; L417-Y520 HydrophobicContact CD2-CD1 4.46Å; L417-Y520 HydrophobicContact CD2-CE1 4.09Å; L417-L524 HydrophobicContact CD1-CD1 4Å; L417-L524 HydrophobicContact CD1-CD2 3.98Å; L417-L524 HydrophobicContact CD1-CG 4.36Å
418	R	87.4	Confident	86.1	Confident	114 Å²	114	46.1 Å²	46.1	43%	0.43	23%	0.23	S	C	.	.	H	α-helix	trans	-57.1	-41.9	175	175	175	179.9	-95.6	1.7	112.7	N416 L422 L463	N416-R418 PolarHBondContact O-N 2.95Å; N416-R418 VanDerWaalsContact O-N 3.15Å; R418-L422 HydrophobicContact CG-CD1 4Å; R418-L422 WeakPolarHBondContact O-CB 3.35Å; R418-L422 VanDerWaalsContact O-CG 3.3Å; R418-L422 WeakPolarHBondContact O-CG 3.02Å; R418-L422 PolarHBondContact O-N 3.02Å; R418-L422 VanDerWaalsContact O-N 3.14Å; R418-L463 HydrophobicContact CG-CD1 4.1Å; R418-L463 HydrophobicContact CG-CD2 4.47Å
419	N	86.3	Confident	86.3	Confident	44 Å²	44	46.6 Å²	46.6	24%	0.235	23%	0.233	C	C	.	.	H	α-helix	trans	-72.1	-39.7	-178.3	-67.4	-26	0	0	0	111	W399 N416 L417 L422 S423	W399-N419 HydrophobicContact CZ2-CB 4.04Å; N416-N419 WeakPolarHBondContact O-CA 3.29Å; N416-N419 WeakPolarHBondContact O-CB 3.44Å; N416-N419 PolarHBondContact O-N 2.99Å; N416-N419 PolarHBondContact OD1-ND2 3.09Å; L417-N419 VanDerWaalsContact C-N 3.3Å; L417-N419 PolarHBondContact O-N 3.04Å; N419-L422 PolarHBondContact O-N 3.03Å; N419-S423 VanDerWaalsContact O-CB 3.27Å; N419-S423 WeakPolarHBondContact O-CB 3.36Å; N419-S423 PolarHBondContact O-N 3.24Å; N419-S423 PolarHBondContact O-OG 3.22Å
420	I	88.1	Confident	86.6	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-59.9	-50.3	176	-64.2	166	0	0	0	109.8	W399 I403 L413 N416 L417 L422 S423 V425	W399-I420 HydrophobicContact CD2-CG1 3.67Å; W399-I420 HydrophobicContact CE3-CD1 4.05Å; W399-I420 HydrophobicContact CE3-CG1 3.69Å; W399-I420 HydrophobicContact CG-CG1 4.16Å; W399-I420 HydrophobicContact CH2-CG1 4.4Å; W399-I420 HydrophobicContact CZ2-CG1 4.37Å; W399-I420 HydrophobicContact CZ3-CD1 4.14Å; W399-I420 HydrophobicContact CZ3-CG1 4.06Å; I403-I420 HydrophobicContact CD1-CD1 4.15Å; I403-I420 HydrophobicContact CD1-CG1 4.42Å; I403-I420 HydrophobicContact CD1-CG2 4.27Å; L413-I420 HydrophobicContact CD1-CD1 3.7Å; N416-I420 PolarHBondContact O-N 2.89Å; N416-I420 VanDerWaalsContact O-N 3.09Å; L417-I420 HydrophobicContact CD2-CD1 4.48Å; L417-I420 PolarHBondContact O-N 3.34Å; I420-L422 VanDerWaalsContact C-N 3.31Å; I420-L422 PolarHBondContact O-N 3.01Å; I420-S423 WeakPolarHBondContact CA-OG 3.47Å; I420-S423 PolarHBondContact O-N 2.88Å; I420-S423 VanDerWaalsContact O-N 3.12Å; I420-S423 PolarHBondContact O-OG 3.26Å; I420-V425 HydrophobicContact CG2-CG2 4.08Å; I420-V425 WeakPolarHBondContact O-CG2 3.29Å
421	L	87.2	Confident	86.8	Confident	4.5 Å²	4.5	47 Å²	47	2%	0.024	23%	0.228	C	C	.	.	H	α-helix	trans	-59.9	-37	178.1	-75	163.3	0	0	0	113.1	L417 S423 I460 L463 C512 M516 L517 Y520	L417-L421 WeakPolarHBondContact O-CB 3.46Å; L417-L421 WeakPolarHBondContact O-CG 3.34Å; L417-L421 PolarHBondContact O-N 3.06Å; L421-S423 VanDerWaalsContact C-N 3.32Å; L421-S423 PolarHBondContact O-N 3.02Å; L421-I460 HydrophobicContact CD1-CD1 3.78Å; L421-I460 HydrophobicContact CD1-CG1 4.22Å; L421-I460 HydrophobicContact CD1-CG2 4.48Å; L421-L463 HydrophobicContact CB-CD2 4.33Å; L421-L463 HydrophobicContact CD1-CD2 4.37Å; L421-C512 PolarHBondContact O-SG 3.22Å; L421-M516 HydrophobicContact CD2-CG 4.1Å; L421-M516 HydrophobicContact CD2-SD 4.36Å; L421-L517 HydrophobicContact CD1-CD2 3.84Å; L421-L517 HydrophobicContact CD2-CD2 4.16Å; L421-L517 HydrophobicContact CG-CD2 4.42Å; L421-Y520 HydrophobicContact CD1-CD1 4.5Å; L421-Y520 HydrophobicContact CD1-CG 4.39Å; L421-Y520 HydrophobicContact CD2-CD2 3.91Å; L421-Y520 HydrophobicContact CD2-CE2 3.77Å; L421-Y520 HydrophobicContact CD2-CG 4.45Å; L421-Y520 HydrophobicContact CG-CE2 4.48Å
422	L	83.9	Confident	87.1	Confident	27.5 Å²	27.5	47.7 Å²	47.7	14%	0.144	23%	0.232	C	C	.	.	H	α-helix	trans	-83.3	-7.5	178.9	-70.9	175.8	0	0	0	114.4	R418 N419 I420 L463 K508 F509	R418-L422 HydrophobicContact CG-CD1 4Å; R418-L422 WeakPolarHBondContact O-CB 3.35Å; R418-L422 VanDerWaalsContact O-CG 3.3Å; R418-L422 WeakPolarHBondContact O-CG 3.02Å; R418-L422 PolarHBondContact O-N 3.02Å; R418-L422 VanDerWaalsContact O-N 3.14Å; N419-L422 PolarHBondContact O-N 3.03Å; I420-L422 VanDerWaalsContact C-N 3.31Å; I420-L422 PolarHBondContact O-N 3.01Å; L422-L463 HydrophobicContact CD1-CD1 4.1Å; L422-L463 HydrophobicContact CD2-CD1 4.02Å; L422-L463 HydrophobicContact CG-CD1 4.12Å; L422-K508 WeakPolarHBondContact CD2-O 3.37Å; L422-F509 HydrophobicContact CD2-CD1 4.26Å; L422-F509 HydrophobicContact CD2-CE1 4.36Å
423	S	81.4	Confident	87.5	Confident	17.5 Å²	17.5	47.4 Å²	47.4	12%	0.122	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-2.8	-175.5	61.4	0	0	0	0	114.9	S396 N419 I420 L421 V425	S396-S423 WeakPolarHBondContact CB-O 3.37Å; N419-S423 VanDerWaalsContact O-CB 3.27Å; N419-S423 WeakPolarHBondContact O-CB 3.36Å; N419-S423 PolarHBondContact O-N 3.24Å; N419-S423 PolarHBondContact O-OG 3.22Å; I420-S423 WeakPolarHBondContact CA-OG 3.47Å; I420-S423 PolarHBondContact O-N 2.88Å; I420-S423 VanDerWaalsContact O-N 3.12Å; I420-S423 PolarHBondContact O-OG 3.26Å; L421-S423 VanDerWaalsContact C-N 3.32Å; L421-S423 PolarHBondContact O-N 3.02Å; S423-V425 WeakPolarHBondContact OG-CG1 3.21Å; S423-V425 WeakPolarHBondContact OG-CG2 3.39Å
424	N	77.7	Confident	87.6	Confident	90.5 Å²	90.5	48.1 Å²	48.1	48%	0.484	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	55.9	-179.6	-160.8	57.8	0	0	0	112.7	S396 L511	S396-N424 PolarHBondContact OG-O 3.17Å; N424-L511 HydrophobicContact CB-CD1 3.94Å
425	V	85	Confident	87.7	Confident	8 Å²	8	55.2 Å²	55.2	5%	0.048	26%	0.263	C	S	.	.			trans	-79.5	155.5	174.9	-106.6	0	0	0	0	109.6	S396 W399 I420 S423 I429 H430	S396-V425 VanDerWaalsContact OG-CA 3.32Å; S396-V425 WeakPolarHBondContact OG-CA 3.47Å; W399-V425 HydrophobicContact CB-CG1 3.9Å; I420-V425 HydrophobicContact CG2-CG2 4.08Å; I420-V425 WeakPolarHBondContact O-CG2 3.29Å; S423-V425 WeakPolarHBondContact OG-CG1 3.21Å; S423-V425 WeakPolarHBondContact OG-CG2 3.39Å; V425-I429 HydrophobicContact CB-CB 4.28Å; V425-I429 HydrophobicContact CB-CG2 4.37Å; V425-I429 HydrophobicContact CG1-CB 3.6Å; V425-I429 HydrophobicContact CG1-CG1 3.75Å; V425-I429 HydrophobicContact CG1-CG2 3.66Å; V425-I429 HydrophobicContact CG2-CB 4.22Å; V425-I429 HydrophobicContact CG2-CG2 4.15Å; V425-H430 WeakPolarHBondContact CG2-CE1 3.16Å; V425-H430 VanDerWaalsContact CG2-NE2 3.27Å; V425-H430 WeakPolarHBondContact CG2-NE2 3.26Å; V425-H430 PolarHBondContact O-NE2 3.24Å
426	Q	84.8	Confident	88	Confident	138 Å²	138	47.8 Å²	47.8	65%	0.645	24%	0.235	S	C	*	.			trans	-62.4	149.4	176.7	-66.2	-171.4	-24.9	0	0	111.5	S428 I429 H430	Q426-S428 PolarHBondContact O-N 3.15Å; Q426-S428 VanDerWaalsContact O-N 3.15Å; Q426-I429 HydrophobicContact CB-CG1 4.46Å; Q426-I429 WeakPolarHBondContact O-CB 3.41Å; Q426-I429 PolarHBondContact O-N 3.25Å; Q426-H430 PolarHBondContact O-N 3.15Å
427	D	85.6	Confident	88.2	Confident	109 Å²	109	47 Å²	47	58%	0.583	23%	0.231	S	C	*	.	H	α-helix	trans	-55.6	-33.6	178.8	-72.4	-27	0	0	0	113	I429 H430 E431 M516	D427-I429 VanDerWaalsContact C-N 3.25Å; D427-I429 PolarHBondContact O-N 3.44Å; D427-H430 WeakPolarHBondContact O-CA 3.29Å; D427-H430 WeakPolarHBondContact O-CB 3.44Å; D427-H430 PolarHBondContact O-N 3.11Å; D427-H430 VanDerWaalsContact O-N 3.08Å; D427-E431 PolarHBondContact O-N 3.2Å; D427-M516 VanDerWaalsContact OD1-CE 3.31Å; D427-M516 WeakPolarHBondContact OD1-CE 3.37Å
428	S	87.3	Confident	88.2	Confident	63 Å²	63	49.6 Å²	49.6	44%	0.441	25%	0.247	S	C	.	.	H	α-helix	trans	-56.2	-37.5	173.7	58.5	0	0	0	0	113	Q426 E431 I432	Q426-S428 PolarHBondContact O-N 3.15Å; Q426-S428 VanDerWaalsContact O-N 3.15Å; S428-E431 PolarHBondContact O-N 3.04Å; S428-I432 WeakPolarHBondContact O-CG1 3.32Å; S428-I432 PolarHBondContact O-N 3.31Å
429	I	89.8	Confident	88.2	Confident	10 Å²	10	46.1 Å²	46.1	5%	0.051	24%	0.237	C	C	.	.	H	α-helix	trans	-73.9	-37.3	177.4	-56.5	-59.6	0	0	0	110.6	I403 T404 V425 Q426 D427 E431 I432 V433	I403-I429 HydrophobicContact CB-CG2 4.04Å; I403-I429 HydrophobicContact CD1-CG2 3.53Å; I403-I429 HydrophobicContact CG1-CG2 4.39Å; I403-I429 HydrophobicContact CG2-CG2 3.9Å; T404-I429 WeakPolarHBondContact OG1-CD1 2.98Å; V425-I429 HydrophobicContact CB-CB 4.28Å; V425-I429 HydrophobicContact CB-CG2 4.37Å; V425-I429 HydrophobicContact CG1-CB 3.6Å; V425-I429 HydrophobicContact CG1-CG1 3.75Å; V425-I429 HydrophobicContact CG1-CG2 3.66Å; V425-I429 HydrophobicContact CG2-CB 4.22Å; V425-I429 HydrophobicContact CG2-CG2 4.15Å; Q426-I429 HydrophobicContact CB-CG1 4.46Å; Q426-I429 WeakPolarHBondContact O-CB 3.41Å; Q426-I429 PolarHBondContact O-N 3.25Å; D427-I429 VanDerWaalsContact C-N 3.25Å; D427-I429 PolarHBondContact O-N 3.44Å; I429-E431 VanDerWaalsContact C-N 3.31Å; I429-E431 PolarHBondContact O-N 3.04Å; I429-I432 HydrophobicContact CD1-CD1 4.2Å; I429-I432 PolarHBondContact O-N 3.19Å; I429-V433 WeakPolarHBondContact O-CG2 3.37Å; I429-V433 PolarHBondContact O-N 3.13Å
430	H	91.1	Very high	88.3	Confident	7.5 Å²	7.5	46.7 Å²	46.7	4%	0.035	24%	0.243	C	C	.	.	H	α-helix	trans	-59.9	-41.7	172.9	-72.1	-63.3	0	0	0	111.4	V425 Q426 D427 I432 V433 L434 M516 Y520	V425-H430 WeakPolarHBondContact CG2-CE1 3.16Å; V425-H430 VanDerWaalsContact CG2-NE2 3.27Å; V425-H430 WeakPolarHBondContact CG2-NE2 3.26Å; V425-H430 PolarHBondContact O-NE2 3.24Å; Q426-H430 PolarHBondContact O-N 3.15Å; D427-H430 WeakPolarHBondContact O-CA 3.29Å; D427-H430 WeakPolarHBondContact O-CB 3.44Å; D427-H430 PolarHBondContact O-N 3.11Å; D427-H430 VanDerWaalsContact O-N 3.08Å; H430-I432 PolarHBondContact O-N 3.44Å; H430-V433 PolarHBondContact O-N 3.25Å; H430-L434 WeakPolarHBondContact O-CB 3.32Å; H430-L434 WeakPolarHBondContact O-CG 3.42Å; H430-L434 PolarHBondContact O-N 3.25Å; H430-M516 HydrophobicContact CB-CE 3.69Å; H430-M516 HydrophobicContact CB-SD 4.12Å; H430-M516 PolarHBondContact CD2-SD 3.16Å; H430-M516 VanDerWaalsContact CD2-SD 3.6Å; H430-M516 PolarHBondContact NE2-SD 3.35Å; H430-Y520 HydrophobicContact CB-CE2 4.43Å; H430-Y520 AromaticContact ND1-CE2 3.66Å; H430-Y520 AromaticContact ND1-CZ 3.68Å; H430-Y520 PolarHBondContact ND1-OH 3.21Å
431	E	91.9	Very high	88.1	Confident	92.5 Å²	92.5	55.4 Å²	55.4	43%	0.432	28%	0.276	S	S	.	.	H	α-helix	trans	-61	-41.6	174.6	-65.5	-48.7	138.9	0	0	112.7	D427 S428 I429 V433 L434 K435 R519	D427-E431 PolarHBondContact O-N 3.2Å; S428-E431 PolarHBondContact O-N 3.04Å; I429-E431 VanDerWaalsContact C-N 3.31Å; I429-E431 PolarHBondContact O-N 3.04Å; E431-V433 VanDerWaalsContact C-N 3.31Å; E431-V433 PolarHBondContact O-N 3.09Å; E431-L434 PolarHBondContact O-N 2.95Å; E431-K435 VanDerWaalsContact O-CB 3.27Å; E431-K435 WeakPolarHBondContact O-CB 3.16Å; E431-K435 PolarHBondContact O-N 2.89Å; E431-R519 IonicContact OE1-CZ 3.17Å; E431-R519 IonicContact OE1-NH1 2.83Å; E431-R519 PolarHBondContact OE1-NH1 3Å; E431-R519 IonicContact OE1-NH2 2.84Å; E431-R519 IonicContact OE2-NH1 2.81Å
432	I	91.7	Very high	88	Confident	64 Å²	64	57.1 Å²	57.1	33%	0.328	29%	0.285	S	S	.	.	H	α-helix	trans	-60.8	-44.1	175.5	-65.4	167.6	0	0	0	110.4	I403 S428 I429 H430 R436	I403-I432 HydrophobicContact CG2-CB 4.24Å; I403-I432 HydrophobicContact CG2-CG2 3.72Å; S428-I432 WeakPolarHBondContact O-CG1 3.32Å; S428-I432 PolarHBondContact O-N 3.31Å; I429-I432 HydrophobicContact CD1-CD1 4.2Å; I429-I432 PolarHBondContact O-N 3.19Å; H430-I432 PolarHBondContact O-N 3.44Å; I432-R436 WeakPolarHBondContact O-CB 3.46Å; I432-R436 VanDerWaalsContact O-CG 3.27Å; I432-R436 WeakPolarHBondContact O-CG 3.28Å; I432-R436 PolarHBondContact O-N 3.28Å
433	V	92.9	Very high	88.1	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-65.7	-45.8	178.8	174.5	0	0	0	0	111.3	I403 L413 L417 I429 H430 E431 R436 L437 Y520	I403-V433 HydrophobicContact CD1-CG2 3.79Å; I403-V433 HydrophobicContact CG1-CG2 4.39Å; I403-V433 HydrophobicContact CG2-CG2 4.03Å; L413-V433 HydrophobicContact CD1-CG1 3.99Å; L413-V433 HydrophobicContact CD1-CG2 4.18Å; L413-V433 HydrophobicContact CD2-CG1 4.28Å; L413-V433 HydrophobicContact CG-CG1 4.4Å; L417-V433 HydrophobicContact CD2-CG1 4.11Å; I429-V433 WeakPolarHBondContact O-CG2 3.37Å; I429-V433 PolarHBondContact O-N 3.13Å; H430-V433 PolarHBondContact O-N 3.25Å; E431-V433 VanDerWaalsContact C-N 3.31Å; E431-V433 PolarHBondContact O-N 3.09Å; V433-R436 WeakPolarHBondContact O-CB 3.46Å; V433-R436 PolarHBondContact O-N 2.88Å; V433-L437 HydrophobicContact CG1-CD1 4.07Å; V433-L437 HydrophobicContact CG1-CG 4.36Å; V433-L437 WeakPolarHBondContact O-CG 3.42Å; V433-L437 PolarHBondContact O-N 3Å; V433-Y520 HydrophobicContact CB-CE1 4.44Å; V433-Y520 WeakPolarHBondContact CB-OH 3.36Å; V433-Y520 HydrophobicContact CG1-CE1 3.56Å; V433-Y520 WeakPolarHBondContact CG1-OH 3.26Å
434	L	93.4	Very high	88	Confident	16 Å²	16	58.9 Å²	58.9	8%	0.084	29%	0.292	C	S	.	.	H	α-helix	trans	-61.5	-45	178.3	-71.5	171.5	0	0	0	111.3	H430 E431 R436 L437 T438 R519 Y520 A523	H430-L434 WeakPolarHBondContact O-CB 3.32Å; H430-L434 WeakPolarHBondContact O-CG 3.42Å; H430-L434 PolarHBondContact O-N 3.25Å; E431-L434 PolarHBondContact O-N 2.95Å; L434-R436 VanDerWaalsContact C-N 3.3Å; L434-R436 PolarHBondContact O-N 3.15Å; L434-L437 PolarHBondContact O-N 3.26Å; L434-T438 PolarHBondContact O-N 3.35Å; L434-T438 PolarHBondContact O-OG1 3.14Å; L434-R519 HydrophobicContact CD1-CB 4.17Å; L434-R519 VanDerWaalsContact CD1-NH1 3.27Å; L434-R519 HydrophobicContact CD2-CB 4.38Å; L434-Y520 HydrophobicContact CD2-CD1 4.3Å; L434-Y520 HydrophobicContact CD2-CD2 3.83Å; L434-Y520 HydrophobicContact CD2-CE1 4.49Å; L434-Y520 HydrophobicContact CD2-CE2 4.05Å; L434-Y520 HydrophobicContact CD2-CG 3.97Å; L434-Y520 HydrophobicContact CG-CD2 4.44Å; L434-Y520 HydrophobicContact CG-CE2 4.2Å; L434-A523 HydrophobicContact CD2-CB 3.75Å
435	K	91.8	Very high	87.9	Confident	155.5 Å²	155.5	62 Å²	62	68%	0.676	30%	0.303	S	S	*	.	H	α-helix	trans	-58.2	-42.3	174.5	-172.2	175.7	-178.2	176.9	0	111.5	E431 L437 T438 D439	E431-K435 VanDerWaalsContact O-CB 3.27Å; E431-K435 WeakPolarHBondContact O-CB 3.16Å; E431-K435 PolarHBondContact O-N 2.89Å; K435-L437 PolarHBondContact O-N 3.42Å; K435-T438 CarbonylContact O-C 3.57Å; K435-T438 PolarHBondContact O-N 3.23Å; K435-T438 PolarHBondContact O-OG1 3.09Å; K435-D439 WeakPolarHBondContact O-CB 3.39Å; K435-D439 PolarHBondContact O-N 3Å
436	R	91.3	Very high	87.3	Confident	26 Å²	26	62.5 Å²	62.5	10%	0.098	31%	0.309	C	S	.	.	H	α-helix	trans	-67.9	-33.2	176.3	-72.8	-179	67.5	-173.1	-0.7	113.6	N406 V408 L413 I432 V433 L434 T438 I442	N406-R436 PolarHBondContact OD1-NH1 3.14Å; N406-R436 PolarHBondContact OD1-NH2 2.82Å; N406-R436 VanDerWaalsContact OD1-NH2 3.11Å; V408-R436 PolarHBondContact O-NH1 3.43Å; V408-R436 PolarHBondContact O-NH2 3.05Å; L413-R436 HydrophobicContact CD2-CB 4.37Å; I432-R436 WeakPolarHBondContact O-CB 3.46Å; I432-R436 VanDerWaalsContact O-CG 3.27Å; I432-R436 WeakPolarHBondContact O-CG 3.28Å; I432-R436 PolarHBondContact O-N 3.28Å; V433-R436 WeakPolarHBondContact O-CB 3.46Å; V433-R436 PolarHBondContact O-N 2.88Å; L434-R436 VanDerWaalsContact C-N 3.3Å; L434-R436 PolarHBondContact O-N 3.15Å; R436-T438 VanDerWaalsContact C-N 3.3Å; R436-I442 HydrophobicContact CB-CD1 4.07Å; R436-I442 HydrophobicContact CG-CD1 3.88Å
437	L	92	Very high	86.7	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-74.2	-21.3	176.3	-70.9	176.2	0	0	0	112.6	L413 L414 L417 V433 L434 K435 I443 Y520 A523 L524 A527	L413-L437 HydrophobicContact CD2-CD2 4.23Å; L413-L437 HydrophobicContact CD2-CG 4.28Å; L414-L437 HydrophobicContact CD2-CD2 3.68Å; L414-L437 VanDerWaalsContact CD2-CD2 3.45Å; L417-L437 HydrophobicContact CD1-CD1 4.28Å; L417-L437 HydrophobicContact CD2-CD1 4.32Å; V433-L437 HydrophobicContact CG1-CD1 4.07Å; V433-L437 HydrophobicContact CG1-CG 4.36Å; V433-L437 WeakPolarHBondContact O-CG 3.42Å; V433-L437 PolarHBondContact O-N 3Å; L434-L437 PolarHBondContact O-N 3.26Å; K435-L437 PolarHBondContact O-N 3.42Å; L437-I443 WeakPolarHBondContact O-CD1 3.28Å; L437-Y520 HydrophobicContact CD1-CD1 4Å; L437-Y520 HydrophobicContact CD1-CE1 4.17Å; L437-A523 HydrophobicContact CB-CB 4.15Å; L437-A523 HydrophobicContact CD1-CB 4.46Å; L437-L524 HydrophobicContact CD1-CD2 4.29Å; L437-L524 HydrophobicContact CD1-CG 4.44Å; L437-L524 HydrophobicContact CD2-CD2 4.28Å; L437-A527 VanDerWaalsContact O-CB 3.24Å; L437-A527 WeakPolarHBondContact O-CB 3.34Å
438	T	90.9	Very high	86.4	Confident	54.5 Å²	54.5	59 Å²	59	33%	0.334	29%	0.287	S	S	.	.	H	α-helix	trans	-107.8	-5.7	-179.7	55.1	0	0	0	0	114	L434 K435 R436 P440 A523 T526 L530	L434-T438 PolarHBondContact O-N 3.35Å; L434-T438 PolarHBondContact O-OG1 3.14Å; K435-T438 CarbonylContact O-C 3.57Å; K435-T438 PolarHBondContact O-N 3.23Å; K435-T438 PolarHBondContact O-OG1 3.09Å; R436-T438 VanDerWaalsContact C-N 3.3Å; T438-P440 VanDerWaalsContact O-CD 3.27Å; T438-P440 WeakPolarHBondContact O-CD 3.32Å; T438-A523 HydrophobicContact CG2-CB 3.85Å; T438-T526 HydrophobicContact CG2-CG2 4.44Å; T438-L530 VanDerWaalsContact O-CD1 3.3Å; T438-L530 WeakPolarHBondContact O-CD1 3.31Å
439	D	89.2	Confident	85.9	Confident	40 Å²	40	57.7 Å²	57.7	21%	0.214	27%	0.274	C	S	.	.			trans	-71.6	115.4	177.4	-172.2	-22.5	0	0	0	110.8	K435 R441 I442 I443	K435-D439 WeakPolarHBondContact O-CB 3.39Å; K435-D439 PolarHBondContact O-N 3Å; D439-R441 PolarHBondContact O-N 3.18Å; D439-R441 WeakPolarHBondContact OD1-CB 3.42Å; D439-R441 PolarHBondContact OD1-N 3.13Å; D439-R441 IonicContact OD1-NE 3.76Å; D439-R441 PolarHBondContact OD1-NE 3.19Å; D439-R441 IonicContact OD2-CZ 3.33Å; D439-R441 IonicContact OD2-NE 2.7Å; D439-R441 IonicContact OD2-NH2 2.64Å; D439-R441 PolarHBondContact OD2-NH2 3.35Å; D439-I442 HydrophobicContact CB-CB 4.32Å; D439-I442 HydrophobicContact CB-CD1 4.03Å; D439-I442 HydrophobicContact CB-CG1 4.13Å; D439-I442 PolarHBondContact O-N 3.18Å; D439-I443 VanDerWaalsContact O-CD1 3.32Å; D439-I443 WeakPolarHBondContact O-CD1 3.21Å; D439-I443 VanDerWaalsContact O-CG1 3.26Å; D439-I443 WeakPolarHBondContact O-CG1 3.42Å; D439-I443 PolarHBondContact O-N 3.22Å
440	P	86.4	Confident	85.5	Confident	56 Å²	56	57.4 Å²	57.4	36%	0.364	27%	0.272	S	S	.	.	H	α-helix	trans	-55.5	-36.9	178.9	-24.6	34.7	0	0	0	113.1	T438 I442 I443 M444 L530	T438-P440 VanDerWaalsContact O-CD 3.27Å; T438-P440 WeakPolarHBondContact O-CD 3.32Å; P440-I442 PolarHBondContact O-N 3.08Å; P440-I443 PolarHBondContact O-N 3.24Å; P440-M444 WeakPolarHBondContact O-CB 3.42Å; P440-M444 WeakPolarHBondContact O-CG 3.42Å; P440-M444 PolarHBondContact O-N 3.36Å; P440-L530 HydrophobicContact CB-CD1 4.42Å; P440-L530 HydrophobicContact CB-CD2 4.4Å; P440-L530 HydrophobicContact CG-CD1 4.21Å; P440-L530 HydrophobicContact CG-CD2 4.31Å
441	R	85.7	Confident	85	Confident	183 Å²	183	58.4 Å²	58.4	69%	0.691	28%	0.277	S	S	*	.	H	α-helix	trans	-64.5	-47	-176.9	-63.8	177.8	-124.8	-179.9	-0.6	111.3	D439 I443 M444 E445	D439-R441 PolarHBondContact O-N 3.18Å; D439-R441 WeakPolarHBondContact OD1-CB 3.42Å; D439-R441 PolarHBondContact OD1-N 3.13Å; D439-R441 IonicContact OD1-NE 3.76Å; D439-R441 PolarHBondContact OD1-NE 3.19Å; D439-R441 IonicContact OD2-CZ 3.33Å; D439-R441 IonicContact OD2-NE 2.7Å; D439-R441 IonicContact OD2-NH2 2.64Å; D439-R441 PolarHBondContact OD2-NH2 3.35Å; R441-I443 VanDerWaalsContact C-N 3.31Å; R441-I443 PolarHBondContact O-N 2.92Å; R441-M444 PolarHBondContact O-N 3.03Å; R441-E445 WeakPolarHBondContact O-CB 3.38Å; R441-E445 WeakPolarHBondContact O-CG 3.34Å; R441-E445 PolarHBondContact O-N 3.37Å
442	I	85.4	Confident	84.7	Confident	41 Å²	41	60.3 Å²	60.3	21%	0.21	28%	0.28	C	S	.	.	H	α-helix	trans	-65.1	-37.9	179.4	-62.1	177.2	0	0	0	110.9	H410 R436 D439 P440 G446	H410-I442 HydrophobicContact CB-CG2 4.21Å; R436-I442 HydrophobicContact CB-CD1 4.07Å; R436-I442 HydrophobicContact CG-CD1 3.88Å; D439-I442 HydrophobicContact CB-CB 4.32Å; D439-I442 HydrophobicContact CB-CD1 4.03Å; D439-I442 HydrophobicContact CB-CG1 4.13Å; D439-I442 PolarHBondContact O-N 3.18Å; P440-I442 PolarHBondContact O-N 3.08Å; I442-G446 WeakPolarHBondContact O-CA 3.21Å; I442-G446 PolarHBondContact O-N 3.01Å
443	I	84.8	Confident	84.6	Confident	0.5 Å²	0.5	57.2 Å²	57.2	0%	0.003	26%	0.264	C	S	.	.	H	α-helix	trans	-69.1	-43.2	179.4	-65.7	159.8	0	0	0	111.1	L437 D439 P440 R441 G446 K447 A527 L530 N535	L437-I443 WeakPolarHBondContact O-CD1 3.28Å; D439-I443 VanDerWaalsContact O-CD1 3.32Å; D439-I443 WeakPolarHBondContact O-CD1 3.21Å; D439-I443 VanDerWaalsContact O-CG1 3.26Å; D439-I443 WeakPolarHBondContact O-CG1 3.42Å; D439-I443 PolarHBondContact O-N 3.22Å; P440-I443 PolarHBondContact O-N 3.24Å; R441-I443 VanDerWaalsContact C-N 3.31Å; R441-I443 PolarHBondContact O-N 2.92Å; I443-G446 PolarHBondContact O-N 3.22Å; I443-K447 PolarHBondContact O-N 3.41Å; I443-A527 HydrophobicContact CD1-CB 4.13Å; I443-L530 HydrophobicContact CD1-CB 3.89Å; I443-L530 HydrophobicContact CD1-CD1 3.52Å; I443-L530 VanDerWaalsContact CD1-CD1 3.45Å; I443-L530 HydrophobicContact CD1-CG 4.36Å; I443-L530 HydrophobicContact CG2-CB 4.22Å; I443-N535 PolarHBondContact O-ND2 2.98Å
444	M	78.5	Confident	84.3	Confident	82 Å²	82	58 Å²	58	40%	0.404	27%	0.268	S	S	.	.	H	α-helix	trans	-61.7	-50.9	176.5	-73.3	173.7	69.2	0	0	111.4	P440 R441 G446 K447 H534 N535	P440-M444 WeakPolarHBondContact O-CB 3.42Å; P440-M444 WeakPolarHBondContact O-CG 3.42Å; P440-M444 PolarHBondContact O-N 3.36Å; R441-M444 PolarHBondContact O-N 3.03Å; M444-G446 VanDerWaalsContact C-N 3.27Å; M444-G446 PolarHBondContact O-N 2.91Å; M444-K447 WeakPolarHBondContact O-CG 3.32Å; M444-K447 PolarHBondContact O-N 3.05Å; M444-K447 VanDerWaalsContact O-N 3.12Å; M444-H534 HydrophobicContact CE-CB 4.38Å; M444-H534 HydrophobicContact CG-CB 3.59Å; M444-H534 HydrophobicContact SD-CB 4.07Å; M444-N535 WeakPolarHBondContact CA-OD1 3.27Å; M444-N535 PolarHBondContact O-OD1 3.42Å
445	E	75.8	Confident	83.9	Confident	156 Å²	156	58.6 Å²	58.6	73%	0.729	28%	0.276	S	S	*	.	H	α-helix	trans	-68.5	-29	177.9	-70.6	179	-178	0	0	112.8	R441 K447	R441-E445 WeakPolarHBondContact O-CB 3.38Å; R441-E445 WeakPolarHBondContact O-CG 3.34Å; R441-E445 PolarHBondContact O-N 3.37Å; E445-K447 VanDerWaalsContact C-N 3.27Å; E445-K447 PolarHBondContact O-N 3.32Å
446	G	72.5	Confident	83.8	Confident	17 Å²	17	51.4 Å²	51.4	18%	0.175	25%	0.245	C	C	.	.	H	α-helix	trans	-57.5	-33	179.3	0	0	0	0	0	112.6	I442 I443 M444 Q448	I442-G446 WeakPolarHBondContact O-CA 3.21Å; I442-G446 PolarHBondContact O-N 3.01Å; I443-G446 PolarHBondContact O-N 3.22Å; M444-G446 VanDerWaalsContact C-N 3.27Å; M444-G446 PolarHBondContact O-N 2.91Å; G446-Q448 VanDerWaalsContact C-N 3.28Å; G446-Q448 VanDerWaalsContact O-CD 3.29Å; G446-Q448 VanDerWaalsContact O-CG 3.31Å; G446-Q448 WeakPolarHBondContact O-CG 3.38Å; G446-Q448 PolarHBondContact O-N 3.08Å; G446-Q448 VanDerWaalsContact O-N 3.12Å; G446-Q448 PolarHBondContact O-NE2 3Å
447	K	72.6	Confident	83.8	Confident	138 Å²	138	51.1 Å²	51.1	60%	0.6	24%	0.244	S	C	*	.			trans	49	40.9	-177.7	-62.2	-175.8	-177.8	-171	0	113	I443 M444 E445	I443-K447 PolarHBondContact O-N 3.41Å; M444-K447 WeakPolarHBondContact O-CG 3.32Å; M444-K447 PolarHBondContact O-N 3.05Å; M444-K447 VanDerWaalsContact O-N 3.12Å; E445-K447 VanDerWaalsContact C-N 3.27Å; E445-K447 PolarHBondContact O-N 3.32Å
448	Q	79.9	Confident	83.4	Confident	36 Å²	36	53.1 Å²	53.1	17%	0.168	26%	0.255	C	S	.	.			trans	-93.4	140.1	-175.5	-62.3	-54.1	-34.1	0	0	111.6	M411 G446 Y453 S531 N535	M411-Q448 HydrophobicContact CE-CB 3.82Å; M411-Q448 HydrophobicContact CE-CG 3.23Å; M411-Q448 HydrophobicContact CG-CG 4.06Å; M411-Q448 HydrophobicContact SD-CG 4.12Å; M411-Q448 PolarHBondContact SD-OE1 3.11Å; G446-Q448 VanDerWaalsContact C-N 3.28Å; G446-Q448 VanDerWaalsContact O-CD 3.29Å; G446-Q448 VanDerWaalsContact O-CG 3.31Å; G446-Q448 WeakPolarHBondContact O-CG 3.38Å; G446-Q448 PolarHBondContact O-N 3.08Å; G446-Q448 VanDerWaalsContact O-N 3.12Å; G446-Q448 PolarHBondContact O-NE2 3Å; Q448-Y453 HydrophobicContact CB-CE2 3.88Å; Q448-S531 PolarHBondContact O-OG 3.45Å; Q448-N535 PolarHBondContact O-ND2 2.88Å; Q448-N535 VanDerWaalsContact O-ND2 3.12Å
449	F	77.3	Confident	83.2	Confident	37 Å²	37	53.1 Å²	53.1	16%	0.162	26%	0.255	C	S	.	.			trans	-73.9	143.5	177.2	-70.4	-63.3	0	0	0	110.7	F451 R452 L536 T723 D724 Q725 R728	F449-F451 PolarHBondContact O-N 3.41Å; F449-F451 VanDerWaalsContact O-N 3.1Å; F449-R452 HydrophobicContact CB-CG 4.49Å; F449-R452 VanDerWaalsContact O-CB 3.24Å; F449-R452 WeakPolarHBondContact O-CB 3.4Å; F449-R452 PolarHBondContact O-N 2.87Å; F449-L536 HydrophobicContact CD1-CD2 3.87Å; F449-L536 HydrophobicContact CE1-CD2 3.68Å; F449-T723 HydrophobicContact CE1-CG2 3.72Å; F449-T723 HydrophobicContact CZ-CG2 3.8Å; F449-D724 WeakPolarHBondContact CB-OD1 3.06Å; F449-D724 VanDerWaalsContact CB-OD2 3.3Å; F449-D724 WeakPolarHBondContact CB-OD2 3.39Å; F449-D724 WeakPolarHBondContact CD1-OD1 3.45Å; F449-Q725 HydrophobicContact CD1-CG 4.47Å; F449-Q725 HydrophobicContact CD2-CG 4.35Å; F449-Q725 HydrophobicContact CE1-CG 4.11Å; F449-Q725 HydrophobicContact CE2-CG 3.98Å; F449-Q725 HydrophobicContact CZ-CG 3.86Å; F449-R728 HydrophobicContact CE1-CG 4.25Å
450	P	80.6	Confident	83.2	Confident	2 Å²	2	51.2 Å²	51.2	1%	0.013	25%	0.245	C	C	.	.	H	α-helix	trans	-48.8	-37.2	-179.5	-30.9	35.5	0	0	0	114.7	R452 Y453 F454 L528 M532 L536 L571 M575 D724	P450-R452 PolarHBondContact O-N 3.4Å; P450-R452 VanDerWaalsContact O-N 3.14Å; P450-Y453 WeakPolarHBondContact O-CB 3.36Å; P450-Y453 PolarHBondContact O-N 3.47Å; P450-F454 PolarHBondContact O-N 2.8Å; P450-L528 HydrophobicContact CB-CD1 3.76Å; P450-L528 HydrophobicContact CB-CG 4.14Å; P450-L528 HydrophobicContact CG-CD1 4.2Å; P450-M532 HydrophobicContact CB-CG 3.92Å; P450-M532 HydrophobicContact CB-SD 4.47Å; P450-M532 HydrophobicContact CG-CB 4.45Å; P450-M532 HydrophobicContact CG-CG 3.3Å; P450-M532 HydrophobicContact CG-SD 4.36Å; P450-L536 HydrophobicContact CG-CD1 3.84Å; P450-L571 HydrophobicContact CB-CD2 4.1Å; P450-M575 HydrophobicContact CB-CE 3.67Å; P450-M575 HydrophobicContact CB-SD 3.68Å; P450-M575 WeakPolarHBondContact CB-SD 3.37Å; P450-M575 HydrophobicContact CG-CE 3.18Å; P450-M575 HydrophobicContact CG-SD 3.34Å; P450-M575 WeakPolarHBondContact CG-SD 3.29Å; P450-D724 VanDerWaalsContact CD-CB 3.47Å; P450-D724 WeakPolarHBondContact CD-OD2 3.33Å; P450-D724 HydrophobicContact CG-CB 3.6Å; P450-D724 VanDerWaalsContact N-OD2 3.08Å
451	F	80.8	Confident	83.1	Confident	28.5 Å²	28.5	49.8 Å²	49.8	13%	0.125	23%	0.234	C	C	.	.	H	α-helix	trans	-58	-29.4	177.4	-137.2	-47.4	0	0	0	113	F449 Y453 F454 A455 Y564 L568 L571 L572 M575 D724	F449-F451 PolarHBondContact O-N 3.41Å; F449-F451 VanDerWaalsContact O-N 3.1Å; F451-Y453 VanDerWaalsContact C-N 3.33Å; F451-F454 PolarHBondContact O-N 3.1Å; F451-A455 HydrophobicContact CE2-CB 4.14Å; F451-A455 HydrophobicContact CZ-CB 4.14Å; F451-A455 VanDerWaalsContact O-CB 3.32Å; F451-A455 WeakPolarHBondContact O-CB 3.33Å; F451-A455 PolarHBondContact O-N 3.21Å; F451-Y564 WeakPolarHBondContact CD2-OH 3.4Å; F451-Y564 VanDerWaalsContact CE2-CB 3.46Å; F451-Y564 HydrophobicContact CE2-CD1 4.07Å; F451-Y564 HydrophobicContact CE2-CD2 4.15Å; F451-Y564 AromaticContact CE2-CG 3.64Å; F451-Y564 HydrophobicContact CE2-CG 3.64Å; F451-Y564 HydrophobicContact CZ-CD2 4.32Å; F451-Y564 HydrophobicContact CZ-CG 4.24Å; F451-L568 HydrophobicContact CB-CD1 4.47Å; F451-L568 HydrophobicContact CE1-CD1 4.12Å; F451-L568 HydrophobicContact CE2-CD1 3.62Å; F451-L568 HydrophobicContact CZ-CD1 3.3Å; F451-L568 HydrophobicContact CZ-CG 4.32Å; F451-L571 HydrophobicContact CD1-CD2 4.2Å; F451-L571 HydrophobicContact CE1-CD2 3.79Å; F451-L571 HydrophobicContact CE1-CG 4.25Å; F451-L572 HydrophobicContact CE1-CD2 3.79Å; F451-L572 HydrophobicContact CE1-CG 4.26Å; F451-L572 HydrophobicContact CE2-CD2 4.35Å; F451-L572 HydrophobicContact CZ-CD1 4.2Å; F451-L572 HydrophobicContact CZ-CD2 3.38Å; F451-L572 HydrophobicContact CZ-CG 3.67Å; F451-M575 HydrophobicContact CD1-CE 4.02Å; F451-M575 HydrophobicContact CD1-SD 4.11Å; F451-M575 HydrophobicContact CE1-CE 4.07Å; F451-M575 HydrophobicContact CE1-SD 3.74Å; F451-D724 HydrophobicContact CB-CB 4.49Å; F451-D724 VanDerWaalsContact CB-OD2 3.22Å; F451-D724 WeakPolarHBondContact CB-OD2 3.16Å; F451-D724 HydrophobicContact CD1-CB 3.65Å; F451-D724 WeakPolarHBondContact CD1-OD2 3.07Å; F451-D724 HydrophobicContact CD2-CB 3.93Å; F451-D724 HydrophobicContact CE1-CB 3.78Å; F451-D724 HydrophobicContact CE2-CB 4.03Å; F451-D724 HydrophobicContact CG-CB 3.76Å; F451-D724 VanDerWaalsContact CG-CG 3.42Å; F451-D724 VanDerWaalsContact CG-OD2 3.3Å; F451-D724 WeakPolarHBondContact CG-OD2 3.46Å; F451-D724 HydrophobicContact CZ-CB 3.97Å; F451-D724 PolarHBondContact N-OD2 2.89Å
452	R	84.6	Confident	83.1	Confident	132.5 Å²	132.5	48.3 Å²	48.3	50%	0.5	23%	0.228	S	C	.	.	H	α-helix	trans	-66.8	-39.8	175.7	-64.6	-62.1	-174.1	-168.9	-3.5	111.8	M411 L414 F449 P450 A456	M411-R452 HydrophobicContact CE-CB 3.89Å; M411-R452 HydrophobicContact CE-CG 4.06Å; M411-R452 HydrophobicContact SD-CG 4.21Å; L414-R452 HydrophobicContact CD1-CB 4.1Å; F449-R452 HydrophobicContact CB-CG 4.49Å; F449-R452 VanDerWaalsContact O-CB 3.24Å; F449-R452 WeakPolarHBondContact O-CB 3.4Å; F449-R452 PolarHBondContact O-N 2.87Å; P450-R452 PolarHBondContact O-N 3.4Å; P450-R452 VanDerWaalsContact O-N 3.14Å; R452-A456 WeakPolarHBondContact O-CB 3.39Å; R452-A456 PolarHBondContact O-N 3.17Å; R452-A456 VanDerWaalsContact O-N 3.16Å
453	Y	89.8	Confident	83	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-69.3	-40.6	174.5	-61.2	-77.3	0	0	0	111.1	H410 L414 Q448 P450 F451 A456 F457 L524 A527 L528 S531	H410-Y453 AromaticContact NE2-CE1 3.65Å; H410-Y453 AromaticContact NE2-CZ 3.73Å; H410-Y453 PolarHBondContact NE2-OH 3.05Å; L414-Y453 HydrophobicContact CD1-CD1 3.81Å; L414-Y453 HydrophobicContact CD1-CE1 3.65Å; L414-Y453 HydrophobicContact CD1-CG 4.17Å; L414-Y453 HydrophobicContact CD2-CD1 3.96Å; L414-Y453 HydrophobicContact CD2-CE1 4.1Å; L414-Y453 HydrophobicContact CG-CD1 4.43Å; L414-Y453 HydrophobicContact CG-CE1 4.34Å; Q448-Y453 HydrophobicContact CB-CE2 3.88Å; P450-Y453 WeakPolarHBondContact O-CB 3.36Å; P450-Y453 PolarHBondContact O-N 3.47Å; F451-Y453 VanDerWaalsContact C-N 3.33Å; Y453-A456 WeakPolarHBondContact O-CB 3.45Å; Y453-A456 PolarHBondContact O-N 2.86Å; Y453-F457 VanDerWaalsContact O-CB 3.27Å; Y453-F457 WeakPolarHBondContact O-CB 3.18Å; Y453-F457 PolarHBondContact O-N 2.91Å; Y453-L524 HydrophobicContact CD1-CD2 4.25Å; Y453-A527 HydrophobicContact CD1-CB 3.66Å; Y453-A527 HydrophobicContact CE1-CB 3.59Å; Y453-A527 HydrophobicContact CG-CB 4.06Å; Y453-L528 HydrophobicContact CD2-CD1 4.18Å; Y453-L528 HydrophobicContact CG-CB 4.46Å; Y453-S531 VanDerWaalsContact CE2-CB 3.48Å
454	F	87.5	Confident	83.1	Confident	15.5 Å²	15.5	48.8 Å²	48.8	7%	0.068	23%	0.229	C	C	.	.	H	α-helix	trans	-63.6	-43.8	175.3	-178.4	-108.7	0	0	0	112.8	P450 F451 A456 F457 D458 L528 Y564 I567 L571 L635 T638	P450-F454 PolarHBondContact O-N 2.8Å; F451-F454 PolarHBondContact O-N 3.1Å; F454-A456 VanDerWaalsContact C-N 3.31Å; F454-A456 PolarHBondContact O-N 2.92Å; F454-F457 WeakPolarHBondContact O-CB 3.49Å; F454-F457 PolarHBondContact O-N 3.08Å; F454-F457 VanDerWaalsContact O-N 3.12Å; F454-D458 WeakPolarHBondContact O-CB 3.27Å; F454-D458 PolarHBondContact O-N 3.27Å; F454-L528 HydrophobicContact CB-CD1 4.01Å; F454-Y564 AromaticContact CD1-CD1 3.94Å; F454-Y564 HydrophobicContact CD1-CD1 3.94Å; F454-Y564 HydrophobicContact CD1-CD2 4.26Å; F454-Y564 HydrophobicContact CD1-CE1 4.18Å; F454-Y564 AromaticContact CD1-CE2 3.5Å; F454-Y564 HydrophobicContact CD1-CE2 3.5Å; F454-Y564 AromaticContact CE1-CD1 3.74Å; F454-Y564 HydrophobicContact CE1-CD1 3.74Å; F454-Y564 AromaticContact CE1-CD2 3.58Å; F454-Y564 HydrophobicContact CE1-CD2 3.58Å; F454-Y564 AromaticContact CE1-CE1 3.92Å; F454-Y564 HydrophobicContact CE1-CE1 3.92Å; F454-Y564 AromaticContact CE1-CE2 3.26Å; F454-Y564 HydrophobicContact CE1-CE2 3.26Å; F454-Y564 HydrophobicContact CZ-CE2 4.49Å; F454-I567 HydrophobicContact CE1-CB 4.33Å; F454-I567 HydrophobicContact CE1-CD1 4.08Å; F454-I567 HydrophobicContact CE1-CG2 3.81Å; F454-I567 HydrophobicContact CE2-CG2 4.22Å; F454-I567 HydrophobicContact CZ-CB 4.48Å; F454-I567 HydrophobicContact CZ-CD1 4.14Å; F454-I567 HydrophobicContact CZ-CG2 3.56Å; F454-L571 HydrophobicContact CB-CD1 4.43Å; F454-L571 HydrophobicContact CB-CD2 4.08Å; F454-L571 HydrophobicContact CD1-CD2 3.43Å; F454-L571 VanDerWaalsContact CD1-CD2 3.43Å; F454-L571 HydrophobicContact CD2-CD1 4.4Å; F454-L571 HydrophobicContact CD2-CD2 4.27Å; F454-L571 HydrophobicContact CE1-CD2 3.66Å; F454-L571 HydrophobicContact CE2-CD2 4.47Å; F454-L571 HydrophobicContact CG-CD2 4.01Å; F454-L571 HydrophobicContact CZ-CD2 4.2Å; F454-L635 HydrophobicContact CB-CD2 3.87Å; F454-L635 HydrophobicContact CD2-CD2 3.73Å; F454-L635 HydrophobicContact CE2-CD2 3.95Å; F454-L635 HydrophobicContact CG-CD2 4.45Å; F454-T638 HydrophobicContact CD2-CG2 4.16Å; F454-T638 HydrophobicContact CE2-CG2 3.77Å; F454-T638 HydrophobicContact CZ-CG2 4.37Å
455	A	84.9	Confident	83.2	Confident	30.5 Å²	30.5	49.9 Å²	49.9	25%	0.252	23%	0.229	S	C	.	.	H	α-helix	trans	-61.2	-43.5	176	0	0	0	0	0	111.3	F451 F457 D458 T459	F451-A455 HydrophobicContact CE2-CB 4.14Å; F451-A455 HydrophobicContact CZ-CB 4.14Å; F451-A455 VanDerWaalsContact O-CB 3.32Å; F451-A455 WeakPolarHBondContact O-CB 3.33Å; F451-A455 PolarHBondContact O-N 3.21Å; A455-F457 PolarHBondContact O-N 3.21Å; A455-D458 PolarHBondContact O-N 3.24Å; A455-T459 WeakPolarHBondContact O-CG2 3.44Å; A455-T459 PolarHBondContact O-N 3.24Å; A455-T459 VanDerWaalsContact O-N 3.09Å
456	A	89.2	Confident	83.4	Confident	4 Å²	4	45.4 Å²	45.4	3%	0.033	21%	0.21	C	C	.	.	H	α-helix	trans	-60.5	-46.1	173.5	0	0	0	0	0	111.3	L414 L417 R452 Y453 F454 D458 T459 I460 L524	L414-A456 HydrophobicContact CB-CB 4.41Å; L414-A456 HydrophobicContact CD2-CB 4.26Å; L417-A456 HydrophobicContact CD1-CB 4.14Å; R452-A456 WeakPolarHBondContact O-CB 3.39Å; R452-A456 PolarHBondContact O-N 3.17Å; R452-A456 VanDerWaalsContact O-N 3.16Å; Y453-A456 WeakPolarHBondContact O-CB 3.45Å; Y453-A456 PolarHBondContact O-N 2.86Å; F454-A456 VanDerWaalsContact C-N 3.31Å; F454-A456 PolarHBondContact O-N 2.92Å; A456-D458 PolarHBondContact O-N 2.72Å; A456-T459 PolarHBondContact O-N 2.95Å; A456-T459 VanDerWaalsContact O-N 3.17Å; A456-T459 PolarHBondContact O-OG1 2.9Å; A456-I460 WeakPolarHBondContact O-CG1 3.42Å; A456-I460 PolarHBondContact O-N 3.12Å; A456-I460 VanDerWaalsContact O-N 3.11Å; A456-L524 HydrophobicContact CB-CD1 3.96Å; A456-L524 HydrophobicContact CB-CD2 3.98Å
457	F	90.3	Very high	83.8	Confident	20 Å²	20	45 Å²	45	9%	0.088	20%	0.204	C	C	.	.	H	α-helix	trans	-59.7	-45	178.2	179.3	-85.2	0	0	0	112.1	Y453 F454 A455 T459 I460 D461 K521 L524 L635 E636 K639	Y453-F457 VanDerWaalsContact O-CB 3.27Å; Y453-F457 WeakPolarHBondContact O-CB 3.18Å; Y453-F457 PolarHBondContact O-N 2.91Å; F454-F457 WeakPolarHBondContact O-CB 3.49Å; F454-F457 PolarHBondContact O-N 3.08Å; F454-F457 VanDerWaalsContact O-N 3.12Å; A455-F457 PolarHBondContact O-N 3.21Å; F457-T459 VanDerWaalsContact C-N 3.32Å; F457-T459 PolarHBondContact O-N 2.87Å; F457-I460 PolarHBondContact O-N 3.1Å; F457-D461 HydrophobicContact CE1-CB 4.42Å; F457-D461 WeakPolarHBondContact O-CB 3.43Å; F457-D461 PolarHBondContact O-N 2.95Å; F457-K521 HydrophobicContact CD2-CB 4.06Å; F457-K521 HydrophobicContact CD2-CG 4.11Å; F457-K521 WeakPolarHBondContact CD2-O 3.43Å; F457-K521 HydrophobicContact CE2-CB 3.69Å; F457-K521 HydrophobicContact CE2-CD 4.37Å; F457-K521 HydrophobicContact CE2-CG 3.93Å; F457-K521 HydrophobicContact CZ-CB 4.42Å; F457-K521 HydrophobicContact CZ-CD 4.47Å; F457-K521 HydrophobicContact CZ-CG 4.42Å; F457-L524 HydrophobicContact CB-CB 4.3Å; F457-L524 HydrophobicContact CB-CD1 4.19Å; F457-L524 HydrophobicContact CD2-CB 4.4Å; F457-L635 HydrophobicContact CB-CD1 4.15Å; F457-L635 HydrophobicContact CD1-CB 4.08Å; F457-L635 HydrophobicContact CD1-CD1 4.1Å; F457-L635 HydrophobicContact CD2-CB 4.01Å; F457-L635 HydrophobicContact CD2-CD1 3.67Å; F457-L635 HydrophobicContact CE1-CB 4.14Å; F457-L635 HydrophobicContact CE1-CD1 4.19Å; F457-L635 HydrophobicContact CE2-CB 4.06Å; F457-L635 HydrophobicContact CE2-CD1 4.06Å; F457-L635 HydrophobicContact CG-CB 4Å; F457-L635 HydrophobicContact CG-CD1 3.85Å; F457-L635 HydrophobicContact CZ-CB 4.11Å; F457-L635 HydrophobicContact CZ-CD1 3.98Å; F457-E636 HydrophobicContact CZ-CB 4.27Å; F457-E636 VanDerWaalsContact CZ-OE2 3.28Å; F457-E636 WeakPolarHBondContact CZ-OE2 3.5Å; F457-K639 HydrophobicContact CE1-CD 4.27Å
458	D	85.4	Confident	84.1	Confident	42 Å²	42	44.2 Å²	44.2	23%	0.225	20%	0.202	C	C	.	.	H	α-helix	trans	-65.4	-36.2	177.4	-175.2	57.9	0	0	0	112	F454 A455 A456 I460 D461 R462 R465 Y564 K639	F454-D458 WeakPolarHBondContact O-CB 3.27Å; F454-D458 PolarHBondContact O-N 3.27Å; A455-D458 PolarHBondContact O-N 3.24Å; A456-D458 PolarHBondContact O-N 2.72Å; D458-I460 VanDerWaalsContact C-N 3.32Å; D458-I460 PolarHBondContact O-N 3.05Å; D458-D461 PolarHBondContact O-N 3.21Å; D458-R462 WeakPolarHBondContact O-CB 3.43Å; D458-R462 PolarHBondContact O-N 3.22Å; D458-R465 IonicContact OD1-NH2 3.33Å; D458-R465 PolarHBondContact OD1-NH2 2.75Å; D458-Y564 HydrophobicContact CB-CE1 4.04Å; D458-Y564 WeakPolarHBondContact OD2-CE1 3.32Å; D458-Y564 PolarHBondContact OD2-OH 3.5Å; D458-K639 IonicContact OD1-NZ 2.84Å; D458-K639 PolarHBondContact OD1-NZ 3.21Å
459	T	86.6	Confident	83.8	Confident	53 Å²	53	49.6 Å²	49.6	33%	0.325	22%	0.222	S	C	.	.	H	α-helix	trans	-62.6	-38.8	173.7	63.7	0	0	0	0	112.7	A455 A456 F457 L463	A455-T459 WeakPolarHBondContact O-CG2 3.44Å; A455-T459 PolarHBondContact O-N 3.24Å; A455-T459 VanDerWaalsContact O-N 3.09Å; A456-T459 PolarHBondContact O-N 2.95Å; A456-T459 VanDerWaalsContact O-N 3.17Å; A456-T459 PolarHBondContact O-OG1 2.9Å; F457-T459 VanDerWaalsContact C-N 3.32Å; F457-T459 PolarHBondContact O-N 2.87Å; T459-L463 WeakPolarHBondContact O-CB 3.39Å; T459-L463 PolarHBondContact O-N 3.11Å; T459-L463 VanDerWaalsContact O-N 3.1Å
460	I	88.9	Confident	83.6	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-72	-39.8	176.8	-60.6	-109.7	0	0	0	110.7	L417 L421 A456 F457 D458 R462 L463 K464 L517 Y520 K521 L524	L417-I460 HydrophobicContact CB-CD1 4.19Å; L417-I460 HydrophobicContact CD1-CD1 4.1Å; L421-I460 HydrophobicContact CD1-CD1 3.78Å; L421-I460 HydrophobicContact CD1-CG1 4.22Å; L421-I460 HydrophobicContact CD1-CG2 4.48Å; A456-I460 WeakPolarHBondContact O-CG1 3.42Å; A456-I460 PolarHBondContact O-N 3.12Å; A456-I460 VanDerWaalsContact O-N 3.11Å; F457-I460 PolarHBondContact O-N 3.1Å; D458-I460 VanDerWaalsContact C-N 3.32Å; D458-I460 PolarHBondContact O-N 3.05Å; I460-R462 VanDerWaalsContact C-N 3.34Å; I460-R462 PolarHBondContact O-N 3.07Å; I460-L463 VanDerWaalsContact O-CB 3.31Å; I460-L463 WeakPolarHBondContact O-CB 3.35Å; I460-L463 PolarHBondContact O-N 2.91Å; I460-K464 PolarHBondContact O-N 2.75Å; I460-L517 HydrophobicContact CG2-CB 4.27Å; I460-L517 HydrophobicContact CG2-CD2 3.98Å; I460-Y520 HydrophobicContact CD1-CD1 4.24Å; I460-Y520 HydrophobicContact CD1-CG 4.33Å; I460-K521 HydrophobicContact CB-CG 4.37Å; I460-K521 HydrophobicContact CG2-CD 4.38Å; I460-K521 HydrophobicContact CG2-CG 3.83Å; I460-L524 HydrophobicContact CD1-CD1 3.7Å; I460-L524 HydrophobicContact CG1-CD1 4.14Å
461	D	84.8	Confident	83.4	Confident	25.5 Å²	25.5	55 Å²	55	14%	0.136	24%	0.242	C	C	.	.	H	α-helix	trans	-66.1	-37.2	177	-169.7	79.2	0	0	0	112.2	F457 D458 K464 R465 K521 K639	F457-D461 HydrophobicContact CE1-CB 4.42Å; F457-D461 WeakPolarHBondContact O-CB 3.43Å; F457-D461 PolarHBondContact O-N 2.95Å; D458-D461 PolarHBondContact O-N 3.21Å; D461-K464 WeakPolarHBondContact O-CB 3.28Å; D461-K464 PolarHBondContact O-N 3.07Å; D461-R465 WeakPolarHBondContact O-CG 3.29Å; D461-R465 PolarHBondContact O-N 2.75Å; D461-R465 PolarHBondContact O-NE 3.35Å; D461-R465 IonicContact OD2-CZ 2.89Å; D461-R465 IonicContact OD2-NE 2.66Å; D461-R465 PolarHBondContact OD2-NE 3.48Å; D461-R465 IonicContact OD2-NH2 3.91Å; D461-R465 PolarHBondContact OD2-NH2 3.22Å; D461-K521 IonicContact OD1-NZ 3.79Å; D461-K521 PolarHBondContact OD1-NZ 3.02Å; D461-K639 VanDerWaalsContact CB-NZ 3.31Å; D461-K639 WeakPolarHBondContact OD2-CE 2.98Å; D461-K639 IonicContact OD2-NZ 3.23Å; D461-K639 PolarHBondContact OD2-NZ 2.93Å
462	R	84.2	Confident	82.9	Confident	151.5 Å²	151.5	59.2 Å²	59.2	57%	0.572	26%	0.261	S	S	*	.	H	α-helix	trans	-63.6	-43.3	170.6	-174.5	176	180	152.7	1.7	111.4	D458 I460 K464 R465 D466	D458-R462 WeakPolarHBondContact O-CB 3.43Å; D458-R462 PolarHBondContact O-N 3.22Å; I460-R462 VanDerWaalsContact C-N 3.34Å; I460-R462 PolarHBondContact O-N 3.07Å; R462-K464 VanDerWaalsContact C-N 3.3Å; R462-K464 PolarHBondContact O-N 2.96Å; R462-R465 WeakPolarHBondContact O-CB 3.38Å; R462-R465 PolarHBondContact O-N 3.17Å; R462-R465 VanDerWaalsContact O-N 3.15Å; R462-D466 VanDerWaalsContact O-CG 3.22Å; R462-D466 PolarHBondContact O-N 2.98Å
463	L	84.8	Confident	82.3	Confident	3 Å²	3	54.4 Å²	54.4	2%	0.016	25%	0.246	C	C	.	.	H	α-helix	trans	-57.8	-43.5	174.6	-167.8	81.2	0	0	0	111.5	R418 L421 L422 T459 I460 R465 D466 L467 F509 L517	R418-L463 HydrophobicContact CG-CD1 4.1Å; R418-L463 HydrophobicContact CG-CD2 4.47Å; L421-L463 HydrophobicContact CB-CD2 4.33Å; L421-L463 HydrophobicContact CD1-CD2 4.37Å; L422-L463 HydrophobicContact CD1-CD1 4.1Å; L422-L463 HydrophobicContact CD2-CD1 4.02Å; L422-L463 HydrophobicContact CG-CD1 4.12Å; T459-L463 WeakPolarHBondContact O-CB 3.39Å; T459-L463 PolarHBondContact O-N 3.11Å; T459-L463 VanDerWaalsContact O-N 3.1Å; I460-L463 VanDerWaalsContact O-CB 3.31Å; I460-L463 WeakPolarHBondContact O-CB 3.35Å; I460-L463 PolarHBondContact O-N 2.91Å; L463-R465 VanDerWaalsContact C-N 3.34Å; L463-R465 PolarHBondContact O-N 3.21Å; L463-D466 PolarHBondContact O-N 2.91Å; L463-L467 HydrophobicContact CD2-CD1 4.08Å; L463-L467 HydrophobicContact CG-CD1 4.29Å; L463-L467 WeakPolarHBondContact O-CB 3.39Å; L463-L467 WeakPolarHBondContact O-CD1 3.29Å; L463-L467 VanDerWaalsContact O-CG 3.23Å; L463-L467 WeakPolarHBondContact O-CG 3.41Å; L463-L467 PolarHBondContact O-N 3.19Å; L463-F509 HydrophobicContact CD1-CD1 4.43Å; L463-F509 HydrophobicContact CD1-CE1 4.02Å; L463-L517 HydrophobicContact CD2-CD1 4.11Å; L463-L517 HydrophobicContact CD2-CD2 3.67Å; L463-L517 VanDerWaalsContact CD2-CD2 3.47Å; L463-L517 HydrophobicContact CD2-CG 4.45Å; L463-L517 HydrophobicContact CG-CD2 4.4Å
464	K	85.2	Confident	81.2	Confident	50.5 Å²	50.5	57 Å²	57	22%	0.22	26%	0.259	C	S	.	.	H	α-helix	trans	-60.5	-41	175.6	-167.8	177.8	-171.8	177.5	0	112.2	I460 D461 R462 L467 H468 F514 L517 D518	I460-K464 PolarHBondContact O-N 2.75Å; D461-K464 WeakPolarHBondContact O-CB 3.28Å; D461-K464 PolarHBondContact O-N 3.07Å; R462-K464 VanDerWaalsContact C-N 3.3Å; R462-K464 PolarHBondContact O-N 2.96Å; K464-L467 PolarHBondContact O-N 3.47Å; K464-H468 WeakPolarHBondContact O-CB 3.16Å; K464-H468 PolarHBondContact O-N 2.89Å; K464-F514 HydrophobicContact CD-CD1 4.45Å; K464-F514 HydrophobicContact CG-CD1 3.95Å; K464-F514 HydrophobicContact CG-CE1 4.06Å; K464-L517 HydrophobicContact CB-CD1 4Å; K464-L517 HydrophobicContact CG-CD1 4.21Å; K464-D518 IonicContact NZ-OD1 3.61Å; K464-D518 PolarHBondContact NZ-OD1 3.24Å; K464-D518 IonicContact NZ-OD2 3.39Å; K464-D518 PolarHBondContact NZ-OD2 3.17Å
465	R	80.9	Confident	80.1	Confident	104.5 Å²	104.5	64.7 Å²	64.7	39%	0.394	29%	0.287	S	S	.	.	H	α-helix	trans	-67	-45.4	176	-73.3	-178.7	-84.1	158.3	-7.7	112.3	I101 D458 D461 R462 L463 L467 H468 Y469	I101-R465 HydrophobicContact CD1-CG 3.61Å; D458-R465 IonicContact OD1-NH2 3.33Å; D458-R465 PolarHBondContact OD1-NH2 2.75Å; D461-R465 WeakPolarHBondContact O-CG 3.29Å; D461-R465 PolarHBondContact O-N 2.75Å; D461-R465 PolarHBondContact O-NE 3.35Å; D461-R465 IonicContact OD2-CZ 2.89Å; D461-R465 IonicContact OD2-NE 2.66Å; D461-R465 PolarHBondContact OD2-NE 3.48Å; D461-R465 IonicContact OD2-NH2 3.91Å; D461-R465 PolarHBondContact OD2-NH2 3.22Å; R462-R465 WeakPolarHBondContact O-CB 3.38Å; R462-R465 PolarHBondContact O-N 3.17Å; R462-R465 VanDerWaalsContact O-N 3.15Å; L463-R465 VanDerWaalsContact C-N 3.34Å; L463-R465 PolarHBondContact O-N 3.21Å; R465-L467 PolarHBondContact O-N 3.15Å; R465-H468 PolarHBondContact O-N 2.88Å; R465-H468 VanDerWaalsContact O-N 3.14Å; R465-Y469 WeakPolarHBondContact O-CB 3.35Å; R465-Y469 PolarHBondContact O-N 3.1Å
466	D	80.3	Confident	79.1	Confident	60.5 Å²	60.5	65.6 Å²	65.6	32%	0.324	29%	0.29	S	S	.	.	H	α-helix	trans	-58.7	-41.1	176.1	-67	-15.6	0	0	0	110	R462 L463 Y469 H470 F509	R462-D466 VanDerWaalsContact O-CG 3.22Å; R462-D466 PolarHBondContact O-N 2.98Å; L463-D466 PolarHBondContact O-N 2.91Å; D466-Y469 PolarHBondContact O-N 3.28Å; D466-H470 WeakPolarHBondContact O-CB 3.29Å; D466-H470 PolarHBondContact O-N 3.06Å; D466-F509 HydrophobicContact CB-CE1 3.94Å; D466-F509 HydrophobicContact CB-CZ 4.31Å
467	L	81.2	Confident	77.8	Confident	10.5 Å²	10.5	67.2 Å²	67.2	6%	0.055	30%	0.299	C	S	.	.	H	α-helix	trans	-65.6	-41.7	175	-118.4	152.7	0	0	0	113.2	L463 K464 R465 H470 R471 F509 C512 F514 L517	L463-L467 HydrophobicContact CD2-CD1 4.08Å; L463-L467 HydrophobicContact CG-CD1 4.29Å; L463-L467 WeakPolarHBondContact O-CB 3.39Å; L463-L467 WeakPolarHBondContact O-CD1 3.29Å; L463-L467 VanDerWaalsContact O-CG 3.23Å; L463-L467 WeakPolarHBondContact O-CG 3.41Å; L463-L467 PolarHBondContact O-N 3.19Å; K464-L467 PolarHBondContact O-N 3.47Å; R465-L467 PolarHBondContact O-N 3.15Å; L467-H470 PolarHBondContact O-N 3.09Å; L467-R471 WeakPolarHBondContact O-CB 3.41Å; L467-R471 PolarHBondContact O-N 3.27Å; L467-F509 WeakPolarHBondContact CD1-O 3.25Å; L467-F509 HydrophobicContact CD2-CB 3.7Å; L467-F509 HydrophobicContact CD2-CD1 3.79Å; L467-F509 HydrophobicContact CD2-CG 4.23Å; L467-F509 WeakPolarHBondContact CD2-O 3.36Å; L467-F509 HydrophobicContact CG-CD1 4Å; L467-C512 HydrophobicContact CD1-CB 3.63Å; L467-C512 VanDerWaalsContact CD1-CB 3.49Å; L467-C512 WeakPolarHBondContact CD1-O 3.41Å; L467-C512 HydrophobicContact CD2-CB 4.29Å; L467-F514 HydrophobicContact CB-CE1 4.16Å; L467-F514 HydrophobicContact CD2-CD1 4.07Å; L467-F514 HydrophobicContact CD2-CD2 4.28Å; L467-F514 HydrophobicContact CD2-CE1 3.48Å; L467-F514 VanDerWaalsContact CD2-CE1 3.48Å; L467-F514 HydrophobicContact CD2-CE2 3.72Å; L467-F514 HydrophobicContact CD2-CG 4.44Å; L467-F514 HydrophobicContact CD2-CZ 3.29Å; L467-L517 HydrophobicContact CD1-CD1 3.26Å
468	H	78	Confident	76.2	Confident	120.5 Å²	120.5	69.9 Å²	69.9	56%	0.558	32%	0.318	S	S	*	.	H	α-helix	trans	-64.7	-45.8	176.4	-167.1	-70.9	0	0	0	111.8	K464 R465 H470 R471 F472 F514	K464-H468 WeakPolarHBondContact O-CB 3.16Å; K464-H468 PolarHBondContact O-N 2.89Å; R465-H468 PolarHBondContact O-N 2.88Å; R465-H468 VanDerWaalsContact O-N 3.14Å; H468-H470 VanDerWaalsContact C-N 3.31Å; H468-H470 PolarHBondContact O-N 3.46Å; H468-R471 PolarHBondContact O-N 3.11Å; H468-F472 WeakPolarHBondContact O-CB 3.36Å; H468-F472 PolarHBondContact O-N 3Å; H468-F514 HydrophobicContact CB-CE1 4.46Å; H468-F514 HydrophobicContact CB-CZ 4.37Å
469	Y	74.7	Confident	74.7	Confident	149 Å²	149	71.7 Å²	71.7	58%	0.584	33%	0.33	S	S	*	.	H	α-helix	trans	-58.4	-44.4	174	177.5	-100.5	0	0	0	110.6	R465 D466 R471 F472 V473	R465-Y469 WeakPolarHBondContact O-CB 3.35Å; R465-Y469 PolarHBondContact O-N 3.1Å; D466-Y469 PolarHBondContact O-N 3.28Å; Y469-R471 PolarHBondContact O-N 3.47Å; Y469-F472 WeakPolarHBondContact O-CB 3.29Å; Y469-F472 PolarHBondContact O-N 3.17Å; Y469-V473 HydrophobicContact CD1-CG2 4.2Å; Y469-V473 HydrophobicContact CD2-CG2 4.34Å; Y469-V473 HydrophobicContact CE1-CG2 3.79Å; Y469-V473 HydrophobicContact CE2-CG2 4.05Å; Y469-V473 HydrophobicContact CG-CG2 4.46Å; Y469-V473 VanDerWaalsContact O-CG2 3.29Å; Y469-V473 WeakPolarHBondContact O-CG2 3.35Å; Y469-V473 PolarHBondContact O-N 3.09Å
470	H	72.9	Confident	73.2	Confident	40.5 Å²	40.5	74.1 Å²	74.1	19%	0.188	34%	0.338	C	S	.	.	H	α-helix	trans	-65.2	-43.5	179.4	-162	-69.8	0	0	0	112.8	D466 L467 H468 F472 V473 M474 I506	D466-H470 WeakPolarHBondContact O-CB 3.29Å; D466-H470 PolarHBondContact O-N 3.06Å; L467-H470 PolarHBondContact O-N 3.09Å; H468-H470 VanDerWaalsContact C-N 3.31Å; H468-H470 PolarHBondContact O-N 3.46Å; H470-F472 VanDerWaalsContact C-N 3.32Å; H470-F472 PolarHBondContact O-N 3.08Å; H470-V473 PolarHBondContact O-N 3.4Å; H470-M474 WeakPolarHBondContact O-CB 3.39Å; H470-M474 VanDerWaalsContact O-CG 3.25Å; H470-M474 WeakPolarHBondContact O-CG 3.25Å; H470-M474 PolarHBondContact O-N 3.21Å; H470-I506 VanDerWaalsContact CE1-CA 3.48Å; H470-I506 WeakPolarHBondContact CE1-CA 3.4Å; H470-I506 WeakPolarHBondContact CE1-CD1 3.4Å; H470-I506 WeakPolarHBondContact CE1-CG1 3.4Å; H470-I506 VanDerWaalsContact NE2-CA 3.35Å; H470-I506 WeakPolarHBondContact NE2-CA 3.41Å; H470-I506 WeakPolarHBondContact NE2-CG1 3.26Å
471	R	75.9	Confident	71.6	Confident	111.5 Å²	111.5	78.3 Å²	78.3	42%	0.421	36%	0.363	S	S	.	.	H	α-helix	trans	-65.3	-36.3	175	-127.3	176.5	176.6	157.1	-2	111.9	L467 H468 Y469 M474 R475	L467-R471 WeakPolarHBondContact O-CB 3.41Å; L467-R471 PolarHBondContact O-N 3.27Å; H468-R471 PolarHBondContact O-N 3.11Å; Y469-R471 PolarHBondContact O-N 3.47Å; R471-M474 PolarHBondContact O-N 2.7Å; R471-R475 WeakPolarHBondContact O-CG 3.28Å; R471-R475 PolarHBondContact O-N 3.31Å
472	F	71.9	Confident	70.1	Confident	117 Å²	117	83.8 Å²	83.8	51%	0.513	39%	0.391	S	S	.	.	H	α-helix	trans	-64.6	-51.1	173.7	174.9	-96.6	0	0	0	111.6	H468 Y469 H470 M474 R475 T476	H468-F472 WeakPolarHBondContact O-CB 3.36Å; H468-F472 PolarHBondContact O-N 3Å; Y469-F472 WeakPolarHBondContact O-CB 3.29Å; Y469-F472 PolarHBondContact O-N 3.17Å; H470-F472 VanDerWaalsContact C-N 3.32Å; H470-F472 PolarHBondContact O-N 3.08Å; F472-M474 VanDerWaalsContact C-N 3.25Å; F472-M474 PolarHBondContact O-N 3.42Å; F472-R475 WeakPolarHBondContact O-CB 3.49Å; F472-R475 PolarHBondContact O-N 3.09Å; F472-R475 VanDerWaalsContact O-N 3.1Å; F472-T476 HydrophobicContact CD1-CG2 4.43Å; F472-T476 HydrophobicContact CE1-CG2 3.96Å; F472-T476 HydrophobicContact CE2-CG2 4.08Å; F472-T476 HydrophobicContact CZ-CG2 3.77Å; F472-T476 PolarHBondContact O-N 3.21Å; F472-T476 PolarHBondContact O-OG1 3.28Å
473	V	70.4	Confident	68.7	Low	31.5 Å²	31.5	85.2 Å²	85.2	19%	0.191	40%	0.402	C	S	.	.	H	α-helix	trans	-57.6	-40.2	176.1	171.2	0	0	0	0	110.7	Y469 H470 T476 T477 M502	Y469-V473 HydrophobicContact CD1-CG2 4.2Å; Y469-V473 HydrophobicContact CD2-CG2 4.34Å; Y469-V473 HydrophobicContact CE1-CG2 3.79Å; Y469-V473 HydrophobicContact CE2-CG2 4.05Å; Y469-V473 HydrophobicContact CG-CG2 4.46Å; Y469-V473 VanDerWaalsContact O-CG2 3.29Å; Y469-V473 WeakPolarHBondContact O-CG2 3.35Å; Y469-V473 PolarHBondContact O-N 3.09Å; H470-V473 PolarHBondContact O-N 3.4Å; V473-T476 WeakPolarHBondContact CA-OG1 3.34Å; V473-T476 PolarHBondContact O-N 3.12Å; V473-T476 PolarHBondContact O-OG1 3.31Å; V473-T477 HydrophobicContact CG1-CG2 4.06Å; V473-T477 WeakPolarHBondContact O-CB 3.31Å; V473-T477 VanDerWaalsContact O-CG2 3.25Å; V473-T477 WeakPolarHBondContact O-CG2 3.3Å; V473-T477 PolarHBondContact O-N 3.14Å; V473-T477 PolarHBondContact O-OG1 3.32Å; V473-M502 HydrophobicContact CG1-CE 4.45Å
474	M	66.6	Low	67	Low	55.5 Å²	55.5	92.9 Å²	92.9	27%	0.273	43%	0.431	S	S	.	.	H	α-helix	trans	-64.6	-40.5	175.5	-72.7	-69.3	-105	0	0	112.8	H470 R471 F472 T477 V478 I506 L510	H470-M474 WeakPolarHBondContact O-CB 3.39Å; H470-M474 VanDerWaalsContact O-CG 3.25Å; H470-M474 WeakPolarHBondContact O-CG 3.25Å; H470-M474 PolarHBondContact O-N 3.21Å; R471-M474 PolarHBondContact O-N 2.7Å; F472-M474 VanDerWaalsContact C-N 3.25Å; F472-M474 PolarHBondContact O-N 3.42Å; M474-T477 WeakPolarHBondContact CA-OG1 3.47Å; M474-T477 PolarHBondContact O-OG1 2.86Å; M474-V478 VanDerWaalsContact O-CB 3.25Å; M474-V478 WeakPolarHBondContact O-CB 3.08Å; M474-V478 WeakPolarHBondContact O-CG2 3.43Å; M474-V478 PolarHBondContact O-N 3.39Å; M474-I506 HydrophobicContact CE-CB 4.36Å; M474-I506 HydrophobicContact CE-CD1 3.75Å; M474-I506 HydrophobicContact CE-CG1 3.86Å; M474-I506 HydrophobicContact CE-CG2 3.89Å; M474-I506 VanDerWaalsContact CE-CG2 3.49Å; M474-I506 HydrophobicContact CG-CD1 4.41Å; M474-I506 HydrophobicContact SD-CD1 3.71Å; M474-I506 VanDerWaalsContact SD-CD1 3.59Å; M474-I506 HydrophobicContact SD-CG1 4.36Å; M474-L510 HydrophobicContact CE-CD1 4.14Å
475	R	64.2	Low	65.1	Low	176 Å²	176	100.1 Å²	100.1	66%	0.664	46%	0.462	S	S	*	.	H	α-helix	trans	-63.3	-44.5	175.9	-78.8	179.2	175.1	152	-2.7	111.4	R471 F472 T479	R471-R475 WeakPolarHBondContact O-CG 3.28Å; R471-R475 PolarHBondContact O-N 3.31Å; F472-R475 WeakPolarHBondContact O-CB 3.49Å; F472-R475 PolarHBondContact O-N 3.09Å; F472-R475 VanDerWaalsContact O-N 3.1Å; R475-T479 WeakPolarHBondContact O-CB 3.5Å; R475-T479 PolarHBondContact O-N 3.07Å; R475-T479 VanDerWaalsContact O-N 3.11Å; R475-T479 PolarHBondContact O-OG1 2.86Å
476	T	65.4	Low	63.6	Low	50.5 Å²	50.5	102.6 Å²	102.6	31%	0.31	48%	0.476	S	S	.	.	H	α-helix	trans	-70.5	-42.3	-179.5	57.1	0	0	0	0	112.2	F472 V473 T479 E480	F472-T476 HydrophobicContact CD1-CG2 4.43Å; F472-T476 HydrophobicContact CE1-CG2 3.96Å; F472-T476 HydrophobicContact CE2-CG2 4.08Å; F472-T476 HydrophobicContact CZ-CG2 3.77Å; F472-T476 PolarHBondContact O-N 3.21Å; F472-T476 PolarHBondContact O-OG1 3.28Å; V473-T476 WeakPolarHBondContact CA-OG1 3.34Å; V473-T476 PolarHBondContact O-N 3.12Å; V473-T476 PolarHBondContact O-OG1 3.31Å; T476-T479 WeakPolarHBondContact CA-OG1 3.33Å; T476-T479 PolarHBondContact O-N 3.26Å; T476-T479 PolarHBondContact O-OG1 2.75Å; T476-T479 VanDerWaalsContact O-OG1 3.11Å; T476-E480 WeakPolarHBondContact O-CB 3.13Å; T476-E480 WeakPolarHBondContact O-CG 3.16Å; T476-E480 PolarHBondContact O-N 3.35Å
477	T	61	Low	62.4	Low	36.5 Å²	36.5	104.8 Å²	104.8	22%	0.224	49%	0.492	C	S	.	.	H	α-helix	trans	-68.7	-40.5	177.8	57	0	0	0	0	112	V473 M474 T479 E480 V481 M502	V473-T477 HydrophobicContact CG1-CG2 4.06Å; V473-T477 WeakPolarHBondContact O-CB 3.31Å; V473-T477 VanDerWaalsContact O-CG2 3.25Å; V473-T477 WeakPolarHBondContact O-CG2 3.3Å; V473-T477 PolarHBondContact O-N 3.14Å; V473-T477 PolarHBondContact O-OG1 3.32Å; M474-T477 WeakPolarHBondContact CA-OG1 3.47Å; M474-T477 PolarHBondContact O-OG1 2.86Å; T477-T479 VanDerWaalsContact C-N 3.34Å; T477-T479 PolarHBondContact O-N 3.48Å; T477-E480 PolarHBondContact O-N 3.15Å; T477-V481 VanDerWaalsContact O-CB 3.28Å; T477-V481 WeakPolarHBondContact O-CB 3.25Å; T477-V481 WeakPolarHBondContact O-CG2 3.36Å; T477-V481 PolarHBondContact O-N 3.23Å; T477-M502 HydrophobicContact CG2-CE 4.16Å
478	V	57.6	Low	61.4	Low	78 Å²	78	107.8 Å²	107.8	47%	0.473	51%	0.51	S	S	.	.	H	α-helix	trans	-63.8	-41.5	175.2	171.7	0	0	0	0	110.9	M474 V481 L482	M474-V478 VanDerWaalsContact O-CB 3.25Å; M474-V478 WeakPolarHBondContact O-CB 3.08Å; M474-V478 WeakPolarHBondContact O-CG2 3.43Å; M474-V478 PolarHBondContact O-N 3.39Å; V478-V481 PolarHBondContact O-N 3.07Å; V478-L482 HydrophobicContact CG1-CD1 3.76Å; V478-L482 HydrophobicContact CG1-CG 4.43Å; V478-L482 WeakPolarHBondContact O-CB 3.23Å; V478-L482 WeakPolarHBondContact O-CD1 3.37Å; V478-L482 WeakPolarHBondContact O-CG 3.46Å; V478-L482 PolarHBondContact O-N 3.27Å
479	T	53.4	Low	60.8	Low	78.5 Å²	78.5	107.2 Å²	107.2	48%	0.482	52%	0.517	S	S	.	.	H	α-helix	trans	-67.3	-36.8	175.3	39.2	0	0	0	0	113.5	R475 T476 T477 L482 K483	R475-T479 WeakPolarHBondContact O-CB 3.5Å; R475-T479 PolarHBondContact O-N 3.07Å; R475-T479 VanDerWaalsContact O-N 3.11Å; R475-T479 PolarHBondContact O-OG1 2.86Å; T476-T479 WeakPolarHBondContact CA-OG1 3.33Å; T476-T479 PolarHBondContact O-N 3.26Å; T476-T479 PolarHBondContact O-OG1 2.75Å; T476-T479 VanDerWaalsContact O-OG1 3.11Å; T477-T479 VanDerWaalsContact C-N 3.34Å; T477-T479 PolarHBondContact O-N 3.48Å; T479-L482 PolarHBondContact O-N 2.96Å; T479-K483 WeakPolarHBondContact O-CB 3.21Å; T479-K483 WeakPolarHBondContact O-CG 3.42Å; T479-K483 PolarHBondContact O-N 3.19Å
480	E	55.1	Low	60.1	Low	105 Å²	105	111.1 Å²	111.1	49%	0.491	53%	0.531	S	S	.	.	H	α-helix	trans	-70.8	-38.4	174.9	-81.5	-168.9	171.9	0	0	112.6	T476 T477 L482 K483 R484	T476-E480 WeakPolarHBondContact O-CB 3.13Å; T476-E480 WeakPolarHBondContact O-CG 3.16Å; T476-E480 PolarHBondContact O-N 3.35Å; T477-E480 PolarHBondContact O-N 3.15Å; E480-L482 VanDerWaalsContact C-N 3.32Å; E480-K483 PolarHBondContact O-N 3Å; E480-R484 WeakPolarHBondContact O-CG 3.49Å; E480-R484 PolarHBondContact O-N 2.9Å; E480-R484 VanDerWaalsContact O-N 3.14Å; E480-R484 IonicContact OE2-CZ 3.47Å; E480-R484 IonicContact OE2-NH1 2.81Å; E480-R484 PolarHBondContact OE2-NH1 2.8Å; E480-R484 IonicContact OE2-NH2 3.46Å; E480-R484 PolarHBondContact OE2-NH2 2.68Å
481	V	55.7	Low	59.3	Low	87.5 Å²	87.5	114.5 Å²	114.5	53%	0.53	55%	0.547	S	S	.	.	H	α-helix	trans	-69	-37.2	178.1	171.4	0	0	0	0	111	T477 V478 K483 R484	T477-V481 VanDerWaalsContact O-CB 3.28Å; T477-V481 WeakPolarHBondContact O-CB 3.25Å; T477-V481 WeakPolarHBondContact O-CG2 3.36Å; T477-V481 PolarHBondContact O-N 3.23Å; V478-V481 PolarHBondContact O-N 3.07Å; V481-K483 PolarHBondContact O-N 2.9Å; V481-R484 PolarHBondContact O-N 2.93Å
482	L	53.8	Low	58.7	Low	141 Å²	141	113.6 Å²	113.6	74%	0.738	55%	0.55	S	S	*	.	H	α-helix	trans	-69.3	-28.7	175	-75.7	166.4	0	0	0	113.1	V478 T479 E480	V478-L482 HydrophobicContact CG1-CD1 3.76Å; V478-L482 HydrophobicContact CG1-CG 4.43Å; V478-L482 WeakPolarHBondContact O-CB 3.23Å; V478-L482 WeakPolarHBondContact O-CD1 3.37Å; V478-L482 WeakPolarHBondContact O-CG 3.46Å; V478-L482 PolarHBondContact O-N 3.27Å; T479-L482 PolarHBondContact O-N 2.96Å; E480-L482 VanDerWaalsContact C-N 3.32Å
483	K	53.3	Low	58.3	Low	182.5 Å²	182.5	115.7 Å²	115.7	79%	0.793	56%	0.559	S	S	*	*	H	α-helix	trans	-82.7	-20	178.1	-76.3	-176	177.6	-175.8	0	114.1	T479 E480 V481 K485	T479-K483 WeakPolarHBondContact O-CB 3.21Å; T479-K483 WeakPolarHBondContact O-CG 3.42Å; T479-K483 PolarHBondContact O-N 3.19Å; E480-K483 PolarHBondContact O-N 3Å; V481-K483 PolarHBondContact O-N 2.9Å; K483-K485 PolarHBondContact O-N 2.94Å
484	R	50.5	Low	57.8	Low	164.5 Å²	164.5	121.5 Å²	121.5	62%	0.621	58%	0.581	S	S	*	*	S	Bend	trans	-86.9	96	-179.3	-75.2	-179.1	176.9	142.2	4.1	110.9	E480 V481 K486	E480-R484 WeakPolarHBondContact O-CG 3.49Å; E480-R484 PolarHBondContact O-N 2.9Å; E480-R484 VanDerWaalsContact O-N 3.14Å; E480-R484 IonicContact OE2-CZ 3.47Å; E480-R484 IonicContact OE2-NH1 2.81Å; E480-R484 PolarHBondContact OE2-NH1 2.8Å; E480-R484 IonicContact OE2-NH2 3.46Å; E480-R484 PolarHBondContact OE2-NH2 2.68Å; V481-R484 PolarHBondContact O-N 2.93Å; R484-K486 WeakPolarHBondContact O-CG 3.24Å; R484-K486 PolarHBondContact O-N 2.52Å
485	K	44.6	Very low	57.3	Low	201.5 Å²	201.5	121.2 Å²	121.2	88%	0.876	59%	0.585	S	S	*	*			trans	-68.4	118.2	159.1	-79.7	-176.1	175.3	179.2	0	108.4	K483	K483-K485 PolarHBondContact O-N 2.94Å
486	K	48.5	Very low	57.2	Low	156 Å²	156	118 Å²	118	68%	0.678	58%	0.577	S	S	*	*			trans	-3.3	117	179.3	-57.5	179.9	179.6	179.3	0	113.7	R484	R484-K486 WeakPolarHBondContact O-CG 3.24Å; R484-K486 PolarHBondContact O-N 2.52Å
487	T	55.3	Low	57	Low	108 Å²	108	124 Å²	124	66%	0.663	60%	0.595	S	S	*	*			trans	-138.2	76.8	173.5	37.4	0	0	0	0	114.4	Q491	T487-Q491 VanDerWaalsContact CB-OE1 3.25Å
488	T	60.4	Low	56.7	Low	73 Å²	73	126 Å²	126	45%	0.448	60%	0.603	S	S	.	*			trans	-108.7	152.3	-169.8	58	0	0	0	0	116.1	R490 Q491 L492	T488-R490 VanDerWaalsContact C-N 3.31Å; T488-R490 PolarHBondContact O-N 3.03Å; T488-Q491 PolarHBondContact O-N 2.99Å; T488-Q491 VanDerWaalsContact O-N 3.17Å; T488-Q491 VanDerWaalsContact OG1-CD 3.3Å; T488-Q491 WeakPolarHBondContact OG1-CG 3.43Å; T488-Q491 PolarHBondContact OG1-OE1 2.97Å; T488-L492 PolarHBondContact O-N 3.08Å
489	P	65.3	Low	56.7	Low	108.5 Å²	108.5	126.6 Å²	126.6	71%	0.705	60%	0.601	S	S	*	*	H	α-helix	trans	-61.1	-32	-174.5	-24.1	32.9	0	0	0	115.7	Q491 L492 K493	P489-Q491 VanDerWaalsContact C-N 3.33Å; P489-Q491 PolarHBondContact O-N 3.25Å; P489-L492 WeakPolarHBondContact O-CB 3.24Å; P489-L492 PolarHBondContact O-N 3.21Å; P489-K493 PolarHBondContact O-N 3.29Å
490	R	59.7	Low	56.9	Low	229.5 Å²	229.5	130.6 Å²	130.6	87%	0.866	61%	0.612	S	S	*	*	H	α-helix	trans	-68.8	-32.2	177.4	-108.6	-179.7	175.7	173.1	-0.8	112.3	T488 K494	T488-R490 VanDerWaalsContact C-N 3.31Å; T488-R490 PolarHBondContact O-N 3.03Å; R490-K494 PolarHBondContact O-N 2.83Å
491	Q	57.5	Low	56.9	Low	113.5 Å²	113.5	128.7 Å²	128.7	53%	0.53	61%	0.61	S	S	.	*	H	α-helix	trans	-73.9	-30.8	174.9	-69.7	178.3	-14.3	0	0	111.5	T487 T488 P489 K494 S495	T487-Q491 VanDerWaalsContact CB-OE1 3.25Å; T488-Q491 PolarHBondContact O-N 2.99Å; T488-Q491 VanDerWaalsContact O-N 3.17Å; T488-Q491 VanDerWaalsContact OG1-CD 3.3Å; T488-Q491 WeakPolarHBondContact OG1-CG 3.43Å; T488-Q491 PolarHBondContact OG1-OE1 2.97Å; P489-Q491 VanDerWaalsContact C-N 3.33Å; P489-Q491 PolarHBondContact O-N 3.25Å; Q491-K494 PolarHBondContact O-N 3.02Å; Q491-S495 WeakPolarHBondContact O-CB 3.41Å; Q491-S495 PolarHBondContact O-N 3.37Å
492	L	62.4	Low	56.7	Low	91.5 Å²	91.5	127.7 Å²	127.7	48%	0.479	60%	0.6	S	S	.	*	H	α-helix	trans	-59.9	-49.1	173.7	-104.2	124.7	0	0	0	112.6	T488 P489 K494 S495 E496	T488-L492 PolarHBondContact O-N 3.08Å; P489-L492 WeakPolarHBondContact O-CB 3.24Å; P489-L492 PolarHBondContact O-N 3.21Å; L492-K494 PolarHBondContact O-N 2.87Å; L492-S495 CarbonylContact O-C 3.58Å; L492-S495 WeakPolarHBondContact O-CA 3.45Å; L492-S495 VanDerWaalsContact O-CB 3.3Å; L492-S495 WeakPolarHBondContact O-CB 3.3Å; L492-S495 PolarHBondContact O-N 3.46Å; L492-S495 VanDerWaalsContact O-N 3.09Å; L492-S495 PolarHBondContact O-OG 3.43Å; L492-E496 WeakPolarHBondContact O-CG 3.36Å; L492-E496 PolarHBondContact O-N 2.9Å
493	K	64	Low	56.7	Low	161.5 Å²	161.5	127.2 Å²	127.2	70%	0.702	59%	0.592	S	S	*	*	H	α-helix	trans	-63.8	-38.4	179	-92.1	-175.6	176.2	177.9	0	113.9	P489 S495 E496 W497	P489-K493 PolarHBondContact O-N 3.29Å; K493-S495 VanDerWaalsContact C-N 3.31Å; K493-E496 PolarHBondContact O-N 3.22Å; K493-W497 PolarHBondContact O-N 3.3Å; K493-W497 VanDerWaalsContact O-N 3.15Å
494	K	59.7	Low	56.7	Low	153 Å²	153	127.5 Å²	127.5	67%	0.665	59%	0.593	S	S	*	*	H	α-helix	trans	-68.8	-36.8	175.7	-165.9	173.8	-177.6	176.9	0	110.9	R490 Q491 L492 L498	R490-K494 PolarHBondContact O-N 2.83Å; Q491-K494 PolarHBondContact O-N 3.02Å; L492-K494 PolarHBondContact O-N 2.87Å; K494-L498 HydrophobicContact CG-CD1 4.23Å; K494-L498 WeakPolarHBondContact O-CB 3.38Å; K494-L498 WeakPolarHBondContact O-CG 3.42Å; K494-L498 PolarHBondContact O-N 3.35Å; K494-L498 VanDerWaalsContact O-N 3.11Å
495	S	56.5	Low	56.8	Low	48.5 Å²	48.5	121.5 Å²	121.5	34%	0.339	58%	0.583	S	S	.	*	H	α-helix	trans	-62.7	-45.2	171.4	125.1	0	0	0	0	111.9	Q491 L492 K493 W497 L498 E499	Q491-S495 WeakPolarHBondContact O-CB 3.41Å; Q491-S495 PolarHBondContact O-N 3.37Å; L492-S495 CarbonylContact O-C 3.58Å; L492-S495 WeakPolarHBondContact O-CA 3.45Å; L492-S495 VanDerWaalsContact O-CB 3.3Å; L492-S495 WeakPolarHBondContact O-CB 3.3Å; L492-S495 PolarHBondContact O-N 3.46Å; L492-S495 VanDerWaalsContact O-N 3.09Å; L492-S495 PolarHBondContact O-OG 3.43Å; K493-S495 VanDerWaalsContact C-N 3.31Å; S495-W497 PolarHBondContact O-N 2.92Å; S495-L498 CarbonylContact O-C 3.55Å; S495-L498 PolarHBondContact O-N 3.02Å; S495-E499 VanDerWaalsContact O-CB 3.28Å; S495-E499 WeakPolarHBondContact O-CB 3.26Å; S495-E499 PolarHBondContact O-N 3.15Å
496	E	61.3	Low	57.1	Low	109.5 Å²	109.5	112.5 Å²	112.5	51%	0.512	54%	0.544	S	S	.	.	H	α-helix	trans	-62.6	-41.6	177.7	-78.3	-179.2	162.5	0	0	112.9	L492 K493 E499 K500	L492-E496 WeakPolarHBondContact O-CG 3.36Å; L492-E496 PolarHBondContact O-N 2.9Å; K493-E496 PolarHBondContact O-N 3.22Å; E496-E499 PolarHBondContact O-N 3.12Å; E496-K500 WeakPolarHBondContact O-CB 3.47Å; E496-K500 PolarHBondContact O-N 2.75Å
497	W	61.9	Low	57.4	Low	177 Å²	177	106.8 Å²	106.8	67%	0.67	53%	0.53	S	S	*	.	H	α-helix	trans	-67.7	-43.8	177	-177.5	87.6	0	0	0	111.8	K493 S495 E499 K500 S501	K493-W497 PolarHBondContact O-N 3.3Å; K493-W497 VanDerWaalsContact O-N 3.15Å; S495-W497 PolarHBondContact O-N 2.92Å; W497-E499 VanDerWaalsContact C-N 3.3Å; W497-E499 PolarHBondContact O-N 3.31Å; W497-K500 PolarHBondContact O-N 3.24Å; W497-S501 VanDerWaalsContact O-CB 3.27Å; W497-S501 WeakPolarHBondContact O-CB 3.34Å; W497-S501 PolarHBondContact O-N 3.11Å
498	L	54.7	Low	57.3	Low	78 Å²	78	108.2 Å²	108.2	41%	0.408	53%	0.527	S	S	.	.	H	α-helix	trans	-59.3	-43.8	172.9	-80.3	165.4	0	0	0	110.4	K494 S495 S501 M502	K494-L498 HydrophobicContact CG-CD1 4.23Å; K494-L498 WeakPolarHBondContact O-CB 3.38Å; K494-L498 WeakPolarHBondContact O-CG 3.42Å; K494-L498 PolarHBondContact O-N 3.35Å; K494-L498 VanDerWaalsContact O-N 3.11Å; S495-L498 CarbonylContact O-C 3.55Å; S495-L498 PolarHBondContact O-N 3.02Å; L498-S501 PolarHBondContact O-N 3.34Å; L498-M502 WeakPolarHBondContact O-CA 3.2Å; L498-M502 WeakPolarHBondContact O-CB 3.41Å; L498-M502 VanDerWaalsContact O-CG 3.23Å; L498-M502 WeakPolarHBondContact O-CG 3.45Å; L498-M502 PolarHBondContact O-N 2.91Å
499	E	56.9	Low	57.1	Low	91 Å²	91	106.9 Å²	106.9	43%	0.425	52%	0.515	S	S	.	.	H	α-helix	trans	-66	-40.7	178.2	-164.5	-173.4	165.5	0	0	112.3	S495 E496 W497 K503	S495-E499 VanDerWaalsContact O-CB 3.28Å; S495-E499 WeakPolarHBondContact O-CB 3.26Å; S495-E499 PolarHBondContact O-N 3.15Å; E496-E499 PolarHBondContact O-N 3.12Å; W497-E499 VanDerWaalsContact C-N 3.3Å; W497-E499 PolarHBondContact O-N 3.31Å; E499-K503 HydrophobicContact CG-CD 4.24Å; E499-K503 HydrophobicContact CG-CG 4.45Å; E499-K503 WeakPolarHBondContact O-CB 3.32Å; E499-K503 VanDerWaalsContact O-CG 3.31Å; E499-K503 WeakPolarHBondContact O-CG 3.24Å; E499-K503 PolarHBondContact O-N 2.94Å; E499-K503 WeakPolarHBondContact OE1-CE 3.36Å; E499-K503 IonicContact OE1-NZ 3.31Å; E499-K503 PolarHBondContact OE1-NZ 3.15Å
500	K	57.8	Low	56.6	Low	161.5 Å²	161.5	107 Å²	107	70%	0.702	51%	0.509	S	S	*	.	H	α-helix	trans	-68	-41.9	176	-116.3	174.4	-179.1	169.7	0	112.1	E496 W497 K504	E496-K500 WeakPolarHBondContact O-CB 3.47Å; E496-K500 PolarHBondContact O-N 2.75Å; W497-K500 PolarHBondContact O-N 3.24Å; K500-K504 WeakPolarHBondContact O-CB 3.47Å; K500-K504 PolarHBondContact O-N 3.1Å
501	S	55.6	Low	56.6	Low	65.5 Å²	65.5	100.3 Å²	100.3	46%	0.458	49%	0.49	S	S	.	.	H	α-helix	trans	-68	-43	177.2	-167	0	0	0	0	111	W497 L498 K504 G505	W497-S501 VanDerWaalsContact O-CB 3.27Å; W497-S501 WeakPolarHBondContact O-CB 3.34Å; W497-S501 PolarHBondContact O-N 3.11Å; L498-S501 PolarHBondContact O-N 3.34Å; S501-K504 PolarHBondContact O-N 2.81Å; S501-G505 PolarHBondContact O-N 3.22Å; S501-G505 VanDerWaalsContact O-N 3.15Å
502	M	51.4	Low	56.9	Low	67 Å²	67	95.4 Å²	95.4	33%	0.33	47%	0.468	S	S	.	.	H	α-helix	trans	-58.2	-57.2	170.4	-81.5	-173.8	177.8	0	0	109.9	V473 T477 L498 K504 G505 I506	V473-M502 HydrophobicContact CG1-CE 4.45Å; T477-M502 HydrophobicContact CG2-CE 4.16Å; L498-M502 WeakPolarHBondContact O-CA 3.2Å; L498-M502 WeakPolarHBondContact O-CB 3.41Å; L498-M502 VanDerWaalsContact O-CG 3.23Å; L498-M502 WeakPolarHBondContact O-CG 3.45Å; L498-M502 PolarHBondContact O-N 2.91Å; M502-K504 VanDerWaalsContact C-N 3.3Å; M502-K504 PolarHBondContact O-N 3.11Å; M502-K504 VanDerWaalsContact O-N 3.09Å; M502-G505 PolarHBondContact O-N 3.19Å; M502-G505 VanDerWaalsContact O-N 3.11Å; M502-I506 HydrophobicContact CB-CD1 3.46Å; M502-I506 VanDerWaalsContact CB-CD1 3.46Å; M502-I506 HydrophobicContact CB-CG1 4.36Å; M502-I506 HydrophobicContact CG-CD1 4.18Å; M502-I506 WeakPolarHBondContact O-CA 3.24Å; M502-I506 WeakPolarHBondContact O-CB 3.3Å; M502-I506 WeakPolarHBondContact O-CD1 3.4Å; M502-I506 WeakPolarHBondContact O-CG1 3.39Å; M502-I506 PolarHBondContact O-N 3.1Å
503	K	53.1	Low	57.6	Low	130 Å²	130	95.6 Å²	95.6	57%	0.565	47%	0.47	S	S	*	.	H	α-helix	trans	-53.5	-39.3	179.9	-79.3	174	175.8	169.4	0	113.8	E499 G507	E499-K503 HydrophobicContact CG-CD 4.24Å; E499-K503 HydrophobicContact CG-CG 4.45Å; E499-K503 WeakPolarHBondContact O-CB 3.32Å; E499-K503 VanDerWaalsContact O-CG 3.31Å; E499-K503 WeakPolarHBondContact O-CG 3.24Å; E499-K503 PolarHBondContact O-N 2.94Å; E499-K503 WeakPolarHBondContact OE1-CE 3.36Å; E499-K503 IonicContact OE1-NZ 3.31Å; E499-K503 PolarHBondContact OE1-NZ 3.15Å; K503-G507 PolarHBondContact O-N 3.05Å; K503-G507 VanDerWaalsContact O-N 3.12Å
504	K	53.4	Low	58.5	Low	188 Å²	188	90.4 Å²	90.4	82%	0.817	45%	0.447	S	S	*	.	H	α-helix	trans	-67.4	-37.5	178.4	-95.7	-174.8	175.5	-179.7	0	114	K500 S501 M502	K500-K504 WeakPolarHBondContact O-CB 3.47Å; K500-K504 PolarHBondContact O-N 3.1Å; S501-K504 PolarHBondContact O-N 2.81Å; M502-K504 VanDerWaalsContact C-N 3.3Å; M502-K504 PolarHBondContact O-N 3.11Å; M502-K504 VanDerWaalsContact O-N 3.09Å
505	G	53.1	Low	59.6	Low	39 Å²	39	89.6 Å²	89.6	40%	0.402	45%	0.446	S	S	.	.	H	α-helix	trans	-80.8	-41	175.4	0	0	0	0	0	112.6	S501 M502 G507 K508 F509	S501-G505 PolarHBondContact O-N 3.22Å; S501-G505 VanDerWaalsContact O-N 3.15Å; M502-G505 PolarHBondContact O-N 3.19Å; M502-G505 VanDerWaalsContact O-N 3.11Å; G505-G507 PolarHBondContact O-N 2.93Å; G505-K508 PolarHBondContact O-N 3.3Å; G505-F509 WeakPolarHBondContact O-CD2 3.38Å
506	I	50.4	Low	61.1	Low	12.5 Å²	12.5	88 Å²	88	6%	0.064	43%	0.433	C	S	.	.	H	α-helix	trans	-66.3	-42.6	-174.8	-69.8	171.2	0	0	0	112.4	H470 M474 M502 K508 F509 L510	H470-I506 VanDerWaalsContact CE1-CA 3.48Å; H470-I506 WeakPolarHBondContact CE1-CA 3.4Å; H470-I506 WeakPolarHBondContact CE1-CD1 3.4Å; H470-I506 WeakPolarHBondContact CE1-CG1 3.4Å; H470-I506 VanDerWaalsContact NE2-CA 3.35Å; H470-I506 WeakPolarHBondContact NE2-CA 3.41Å; H470-I506 WeakPolarHBondContact NE2-CG1 3.26Å; M474-I506 HydrophobicContact CE-CB 4.36Å; M474-I506 HydrophobicContact CE-CD1 3.75Å; M474-I506 HydrophobicContact CE-CG1 3.86Å; M474-I506 HydrophobicContact CE-CG2 3.89Å; M474-I506 VanDerWaalsContact CE-CG2 3.49Å; M474-I506 HydrophobicContact CG-CD1 4.41Å; M474-I506 HydrophobicContact SD-CD1 3.71Å; M474-I506 VanDerWaalsContact SD-CD1 3.59Å; M474-I506 HydrophobicContact SD-CG1 4.36Å; M502-I506 HydrophobicContact CB-CD1 3.46Å; M502-I506 VanDerWaalsContact CB-CD1 3.46Å; M502-I506 HydrophobicContact CB-CG1 4.36Å; M502-I506 HydrophobicContact CG-CD1 4.18Å; M502-I506 WeakPolarHBondContact O-CA 3.24Å; M502-I506 WeakPolarHBondContact O-CB 3.3Å; M502-I506 WeakPolarHBondContact O-CD1 3.4Å; M502-I506 WeakPolarHBondContact O-CG1 3.39Å; M502-I506 PolarHBondContact O-N 3.1Å; I506-K508 PolarHBondContact O-N 3.28Å; I506-K508 VanDerWaalsContact O-N 3.14Å; I506-F509 PolarHBondContact O-N 2.92Å; I506-F509 VanDerWaalsContact O-N 3.07Å; I506-L510 HydrophobicContact CG2-CD1 3.3Å; I506-L510 HydrophobicContact CG2-CD2 4.48Å; I506-L510 HydrophobicContact CG2-CG 3.68Å; I506-L510 PolarHBondContact O-N 2.89Å
507	G	53.8	Low	62.5	Low	36.5 Å²	36.5	82.8 Å²	82.8	38%	0.376	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-30.8	-173.2	0	0	0	0	0	113.4	K503 G505 L511	K503-G507 PolarHBondContact O-N 3.05Å; K503-G507 VanDerWaalsContact O-N 3.12Å; G505-G507 PolarHBondContact O-N 2.93Å; G507-L511 WeakPolarHBondContact O-CD1 3.35Å; G507-L511 WeakPolarHBondContact O-CG 3.47Å
508	K	55.3	Low	63.7	Low	138.5 Å²	138.5	77 Å²	77	60%	0.602	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-28.4	176.5	-71.5	-173.2	176.9	-176	0	114	L422 G505 I506	L422-K508 WeakPolarHBondContact CD2-O 3.37Å; G505-K508 PolarHBondContact O-N 3.3Å; I506-K508 PolarHBondContact O-N 3.28Å; I506-K508 VanDerWaalsContact O-N 3.14Å
509	F	55.6	Low	65.5	Low	44.5 Å²	44.5	77 Å²	77	20%	0.195	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-34.3	179.9	-78.8	-80.4	0	0	0	112.3	L422 L463 D466 L467 G505 I506 L511 C512	L422-F509 HydrophobicContact CD2-CD1 4.26Å; L422-F509 HydrophobicContact CD2-CE1 4.36Å; L463-F509 HydrophobicContact CD1-CD1 4.43Å; L463-F509 HydrophobicContact CD1-CE1 4.02Å; D466-F509 HydrophobicContact CB-CE1 3.94Å; D466-F509 HydrophobicContact CB-CZ 4.31Å; L467-F509 WeakPolarHBondContact CD1-O 3.25Å; L467-F509 HydrophobicContact CD2-CB 3.7Å; L467-F509 HydrophobicContact CD2-CD1 3.79Å; L467-F509 HydrophobicContact CD2-CG 4.23Å; L467-F509 WeakPolarHBondContact CD2-O 3.36Å; L467-F509 HydrophobicContact CG-CD1 4Å; G505-F509 WeakPolarHBondContact O-CD2 3.38Å; I506-F509 PolarHBondContact O-N 2.92Å; I506-F509 VanDerWaalsContact O-N 3.07Å; F509-L511 PolarHBondContact O-N 3.14Å; F509-L511 VanDerWaalsContact O-N 3.11Å; F509-C512 PolarHBondContact O-N 3Å
510	L	54.6	Low	67.2	Low	110 Å²	110	72.7 Å²	72.7	58%	0.576	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-16.4	179.9	-80.5	170.9	0	0	0	114.4	M474 I506	M474-L510 HydrophobicContact CE-CD1 4.14Å; I506-L510 HydrophobicContact CG2-CD1 3.3Å; I506-L510 HydrophobicContact CG2-CD2 4.48Å; I506-L510 HydrophobicContact CG2-CG 3.68Å; I506-L510 PolarHBondContact O-N 2.89Å
511	L	58.4	Low	68.8	Low	90.5 Å²	90.5	66.1 Å²	66.1	47%	0.474	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-9.4	-176.4	-62.4	166	0	0	0	113.7	N424 G507 F509	N424-L511 HydrophobicContact CB-CD1 3.94Å; G507-L511 WeakPolarHBondContact O-CD1 3.35Å; G507-L511 WeakPolarHBondContact O-CG 3.47Å; F509-L511 PolarHBondContact O-N 3.14Å; F509-L511 VanDerWaalsContact O-N 3.11Å
512	C	64.6	Low	70.5	Confident	10.5 Å²	10.5	67.9 Å²	67.9	7%	0.071	34%	0.341	C	S	.	.			trans	-95.6	117.4	-178.9	-99.3	0	0	0	0	111.4	L421 L467 F509	L421-C512 PolarHBondContact O-SG 3.22Å; L467-C512 HydrophobicContact CD1-CB 3.63Å; L467-C512 VanDerWaalsContact CD1-CB 3.49Å; L467-C512 WeakPolarHBondContact CD1-O 3.41Å; L467-C512 HydrophobicContact CD2-CB 4.29Å; F509-C512 PolarHBondContact O-N 3Å
513	D	76.5	Confident	72.4	Confident	94.5 Å²	94.5	65 Å²	65	51%	0.505	33%	0.328	S	S	.	.			trans	-76.6	139.2	173.2	-122.8	-14.4	0	0	0	112.4	E515 M516 L517	D513-E515 VanDerWaalsContact C-N 3.27Å; D513-E515 PolarHBondContact O-N 2.84Å; D513-E515 PolarHBondContact OD1-N 2.88Å; D513-M516 HydrophobicContact CB-CB 4.25Å; D513-M516 PolarHBondContact O-N 3.34Å; D513-L517 WeakPolarHBondContact O-CG 3.42Å; D513-L517 PolarHBondContact O-N 3.27Å; D513-L517 VanDerWaalsContact O-N 3.13Å
514	F	83	Confident	74.3	Confident	52 Å²	52	58.9 Å²	58.9	23%	0.228	30%	0.301	C	S	.	.	H	α-helix	trans	-60.1	-38.4	176	-78.1	-56.7	0	0	0	111.8	K464 L467 H468 M516 L517 D518	K464-F514 HydrophobicContact CD-CD1 4.45Å; K464-F514 HydrophobicContact CG-CD1 3.95Å; K464-F514 HydrophobicContact CG-CE1 4.06Å; L467-F514 HydrophobicContact CB-CE1 4.16Å; L467-F514 HydrophobicContact CD2-CD1 4.07Å; L467-F514 HydrophobicContact CD2-CD2 4.28Å; L467-F514 HydrophobicContact CD2-CE1 3.48Å; L467-F514 VanDerWaalsContact CD2-CE1 3.48Å; L467-F514 HydrophobicContact CD2-CE2 3.72Å; L467-F514 HydrophobicContact CD2-CG 4.44Å; L467-F514 HydrophobicContact CD2-CZ 3.29Å; H468-F514 HydrophobicContact CB-CE1 4.46Å; H468-F514 HydrophobicContact CB-CZ 4.37Å; F514-M516 VanDerWaalsContact C-N 3.34Å; F514-L517 PolarHBondContact O-N 3.26Å; F514-D518 PolarHBondContact O-N 2.85Å
515	E	84.6	Confident	76.1	Confident	137 Å²	137	50.8 Å²	50.8	64%	0.64	27%	0.268	S	S	*	.	H	α-helix	trans	-62.8	-44.3	178.2	-172.1	174.9	175.8	0	0	111	D513 L517 D518 R519	D513-E515 VanDerWaalsContact C-N 3.27Å; D513-E515 PolarHBondContact O-N 2.84Å; D513-E515 PolarHBondContact OD1-N 2.88Å; E515-L517 VanDerWaalsContact C-N 3.34Å; E515-L517 PolarHBondContact O-N 3.02Å; E515-D518 PolarHBondContact O-N 3.11Å; E515-D518 VanDerWaalsContact O-N 3.16Å; E515-R519 WeakPolarHBondContact O-CG 3.31Å; E515-R519 PolarHBondContact O-N 3.29Å
516	M	87.8	Confident	77.9	Confident	15.5 Å²	15.5	51.7 Å²	51.7	8%	0.076	27%	0.266	C	S	.	.	H	α-helix	trans	-61.3	-43.1	176.3	-176.6	158.2	-77.4	0	0	112.3	L421 D427 H430 D513 F514 D518 R519 Y520	L421-M516 HydrophobicContact CD2-CG 4.1Å; L421-M516 HydrophobicContact CD2-SD 4.36Å; D427-M516 VanDerWaalsContact OD1-CE 3.31Å; D427-M516 WeakPolarHBondContact OD1-CE 3.37Å; H430-M516 HydrophobicContact CB-CE 3.69Å; H430-M516 HydrophobicContact CB-SD 4.12Å; H430-M516 PolarHBondContact CD2-SD 3.16Å; H430-M516 VanDerWaalsContact CD2-SD 3.6Å; H430-M516 PolarHBondContact NE2-SD 3.35Å; D513-M516 HydrophobicContact CB-CB 4.25Å; D513-M516 PolarHBondContact O-N 3.34Å; F514-M516 VanDerWaalsContact C-N 3.34Å; M516-D518 VanDerWaalsContact C-N 3.3Å; M516-D518 PolarHBondContact O-N 3.03Å; M516-R519 VanDerWaalsContact CE-NH2 3.31Å; M516-R519 WeakPolarHBondContact O-CB 3.18Å; M516-R519 PolarHBondContact O-N 3.35Å; M516-R519 VanDerWaalsContact O-N 3.17Å; M516-Y520 HydrophobicContact CG-CD2 4.04Å; M516-Y520 HydrophobicContact CG-CE2 4.01Å; M516-Y520 WeakPolarHBondContact O-CD2 3.26Å; M516-Y520 PolarHBondContact O-N 3.35Å; M516-Y520 HydrophobicContact SD-CE2 4.44Å
517	L	89.2	Confident	79.8	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-60.8	-38.6	175.7	-63.9	175.6	0	0	0	112.1	L421 I460 L463 K464 L467 D513 F514 E515 Y520 K521	L421-L517 HydrophobicContact CD1-CD2 3.84Å; L421-L517 HydrophobicContact CD2-CD2 4.16Å; L421-L517 HydrophobicContact CG-CD2 4.42Å; I460-L517 HydrophobicContact CG2-CB 4.27Å; I460-L517 HydrophobicContact CG2-CD2 3.98Å; L463-L517 HydrophobicContact CD2-CD1 4.11Å; L463-L517 HydrophobicContact CD2-CD2 3.67Å; L463-L517 VanDerWaalsContact CD2-CD2 3.47Å; L463-L517 HydrophobicContact CD2-CG 4.45Å; L463-L517 HydrophobicContact CG-CD2 4.4Å; K464-L517 HydrophobicContact CB-CD1 4Å; K464-L517 HydrophobicContact CG-CD1 4.21Å; L467-L517 HydrophobicContact CD1-CD1 3.26Å; D513-L517 WeakPolarHBondContact O-CG 3.42Å; D513-L517 PolarHBondContact O-N 3.27Å; D513-L517 VanDerWaalsContact O-N 3.13Å; F514-L517 PolarHBondContact O-N 3.26Å; E515-L517 VanDerWaalsContact C-N 3.34Å; E515-L517 PolarHBondContact O-N 3.02Å; L517-Y520 PolarHBondContact O-N 2.96Å; L517-K521 WeakPolarHBondContact O-CG 3.38Å; L517-K521 PolarHBondContact O-N 3.07Å
518	D	88.8	Confident	81.5	Confident	54 Å²	54	49.4 Å²	49.4	29%	0.289	25%	0.246	S	C	.	.	H	α-helix	trans	-68.8	-37.1	175.9	-75.3	-28.9	0	0	0	112.1	K464 F514 E515 M516 Y520 K521 N522	K464-D518 IonicContact NZ-OD1 3.61Å; K464-D518 PolarHBondContact NZ-OD1 3.24Å; K464-D518 IonicContact NZ-OD2 3.39Å; K464-D518 PolarHBondContact NZ-OD2 3.17Å; F514-D518 PolarHBondContact O-N 2.85Å; E515-D518 PolarHBondContact O-N 3.11Å; E515-D518 VanDerWaalsContact O-N 3.16Å; M516-D518 VanDerWaalsContact C-N 3.3Å; M516-D518 PolarHBondContact O-N 3.03Å; D518-Y520 PolarHBondContact O-N 3.16Å; D518-K521 PolarHBondContact O-N 3.09Å; D518-N522 WeakPolarHBondContact O-CB 3.33Å; D518-N522 VanDerWaalsContact O-CG 3.23Å; D518-N522 PolarHBondContact O-N 2.72Å; D518-N522 PolarHBondContact O-ND2 2.94Å
519	R	91.6	Very high	83.1	Confident	79.5 Å²	79.5	46.5 Å²	46.5	30%	0.3	23%	0.234	S	C	.	.	H	α-helix	trans	-59.2	-44.6	171.8	-69	-165.7	-68.3	144.1	-15.1	112.1	E431 L434 E515 M516 N522 A523	E431-R519 IonicContact OE1-CZ 3.17Å; E431-R519 IonicContact OE1-NH1 2.83Å; E431-R519 PolarHBondContact OE1-NH1 3Å; E431-R519 IonicContact OE1-NH2 2.84Å; E431-R519 IonicContact OE2-NH1 2.81Å; L434-R519 HydrophobicContact CD1-CB 4.17Å; L434-R519 VanDerWaalsContact CD1-NH1 3.27Å; L434-R519 HydrophobicContact CD2-CB 4.38Å; E515-R519 WeakPolarHBondContact O-CG 3.31Å; E515-R519 PolarHBondContact O-N 3.29Å; M516-R519 VanDerWaalsContact CE-NH2 3.31Å; M516-R519 WeakPolarHBondContact O-CB 3.18Å; M516-R519 PolarHBondContact O-N 3.35Å; M516-R519 VanDerWaalsContact O-N 3.17Å; R519-N522 PolarHBondContact O-N 3.28Å; R519-A523 WeakPolarHBondContact O-CB 3.34Å; R519-A523 PolarHBondContact O-N 3.41Å
520	Y	93.4	Very high	84.6	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-65.5	-40.9	175.2	-87.9	-98.8	0	0	0	112.8	L417 L421 H430 V433 L434 L437 I460 M516 L517 D518 N522 A523 L524	L417-Y520 HydrophobicContact CD1-CD1 4.47Å; L417-Y520 HydrophobicContact CD2-CD1 4.46Å; L417-Y520 HydrophobicContact CD2-CE1 4.09Å; L421-Y520 HydrophobicContact CD1-CD1 4.5Å; L421-Y520 HydrophobicContact CD1-CG 4.39Å; L421-Y520 HydrophobicContact CD2-CD2 3.91Å; L421-Y520 HydrophobicContact CD2-CE2 3.77Å; L421-Y520 HydrophobicContact CD2-CG 4.45Å; L421-Y520 HydrophobicContact CG-CE2 4.48Å; H430-Y520 HydrophobicContact CB-CE2 4.43Å; H430-Y520 AromaticContact ND1-CE2 3.66Å; H430-Y520 AromaticContact ND1-CZ 3.68Å; H430-Y520 PolarHBondContact ND1-OH 3.21Å; V433-Y520 HydrophobicContact CB-CE1 4.44Å; V433-Y520 WeakPolarHBondContact CB-OH 3.36Å; V433-Y520 HydrophobicContact CG1-CE1 3.56Å; V433-Y520 WeakPolarHBondContact CG1-OH 3.26Å; L434-Y520 HydrophobicContact CD2-CD1 4.3Å; L434-Y520 HydrophobicContact CD2-CD2 3.83Å; L434-Y520 HydrophobicContact CD2-CE1 4.49Å; L434-Y520 HydrophobicContact CD2-CE2 4.05Å; L434-Y520 HydrophobicContact CD2-CG 3.97Å; L434-Y520 HydrophobicContact CG-CD2 4.44Å; L434-Y520 HydrophobicContact CG-CE2 4.2Å; L437-Y520 HydrophobicContact CD1-CD1 4Å; L437-Y520 HydrophobicContact CD1-CE1 4.17Å; I460-Y520 HydrophobicContact CD1-CD1 4.24Å; I460-Y520 HydrophobicContact CD1-CG 4.33Å; M516-Y520 HydrophobicContact CG-CD2 4.04Å; M516-Y520 HydrophobicContact CG-CE2 4.01Å; M516-Y520 WeakPolarHBondContact O-CD2 3.26Å; M516-Y520 PolarHBondContact O-N 3.35Å; M516-Y520 HydrophobicContact SD-CE2 4.44Å; L517-Y520 PolarHBondContact O-N 2.96Å; D518-Y520 PolarHBondContact O-N 3.16Å; Y520-N522 VanDerWaalsContact C-N 3.31Å; Y520-N522 PolarHBondContact O-N 3.26Å; Y520-A523 PolarHBondContact O-N 3.35Å; Y520-L524 WeakPolarHBondContact O-CB 3.4Å; Y520-L524 VanDerWaalsContact O-CG 3.26Å; Y520-L524 WeakPolarHBondContact O-CG 3.42Å; Y520-L524 PolarHBondContact O-N 2.95Å
521	K	91.4	Very high	86.1	Confident	23 Å²	23	40.6 Å²	40.6	10%	0.1	21%	0.205	C	C	.	.	H	α-helix	trans	-61.2	-43	175.5	-77.9	-178.3	66.5	178.1	0	111.6	F457 I460 D461 L517 D518 L524 S525 E636	F457-K521 HydrophobicContact CD2-CB 4.06Å; F457-K521 HydrophobicContact CD2-CG 4.11Å; F457-K521 WeakPolarHBondContact CD2-O 3.43Å; F457-K521 HydrophobicContact CE2-CB 3.69Å; F457-K521 HydrophobicContact CE2-CD 4.37Å; F457-K521 HydrophobicContact CE2-CG 3.93Å; F457-K521 HydrophobicContact CZ-CB 4.42Å; F457-K521 HydrophobicContact CZ-CD 4.47Å; F457-K521 HydrophobicContact CZ-CG 4.42Å; I460-K521 HydrophobicContact CB-CG 4.37Å; I460-K521 HydrophobicContact CG2-CD 4.38Å; I460-K521 HydrophobicContact CG2-CG 3.83Å; D461-K521 IonicContact OD1-NZ 3.79Å; D461-K521 PolarHBondContact OD1-NZ 3.02Å; L517-K521 WeakPolarHBondContact O-CG 3.38Å; L517-K521 PolarHBondContact O-N 3.07Å; D518-K521 PolarHBondContact O-N 3.09Å; K521-L524 PolarHBondContact O-N 3.4Å; K521-S525 PolarHBondContact O-N 3.46Å; K521-S525 PolarHBondContact O-OG 2.9Å; K521-E636 IonicContact NZ-OE2 2.82Å; K521-E636 PolarHBondContact NZ-OE2 3.47Å
522	N	90.4	Very high	87.4	Confident	104 Å²	104	36.7 Å²	36.7	56%	0.556	19%	0.185	S	C	*	.	H	α-helix	trans	-64.6	-47.9	176.5	-69.3	-16.6	0	0	0	110.6	D518 R519 Y520 L524 S525 T526	D518-N522 WeakPolarHBondContact O-CB 3.33Å; D518-N522 VanDerWaalsContact O-CG 3.23Å; D518-N522 PolarHBondContact O-N 2.72Å; D518-N522 PolarHBondContact O-ND2 2.94Å; R519-N522 PolarHBondContact O-N 3.28Å; Y520-N522 VanDerWaalsContact C-N 3.31Å; Y520-N522 PolarHBondContact O-N 3.26Å; N522-L524 VanDerWaalsContact C-N 3.31Å; N522-L524 PolarHBondContact O-N 3.36Å; N522-S525 WeakPolarHBondContact O-CA 3.18Å; N522-S525 WeakPolarHBondContact O-CB 3.35Å; N522-S525 PolarHBondContact O-N 3.34Å; N522-S525 VanDerWaalsContact O-N 3.11Å; N522-T526 PolarHBondContact O-N 3.21Å; N522-T526 PolarHBondContact O-OG1 3.36Å; N522-T526 VanDerWaalsContact O-OG1 3.12Å
523	A	92.2	Very high	88.2	Confident	6.5 Å²	6.5	43.9 Å²	43.9	5%	0.054	22%	0.215	C	C	.	.	H	α-helix	trans	-57.5	-41.6	176.6	0	0	0	0	0	112.5	L434 L437 T438 R519 Y520 T526 A527	L434-A523 HydrophobicContact CD2-CB 3.75Å; L437-A523 HydrophobicContact CB-CB 4.15Å; L437-A523 HydrophobicContact CD1-CB 4.46Å; T438-A523 HydrophobicContact CG2-CB 3.85Å; R519-A523 WeakPolarHBondContact O-CB 3.34Å; R519-A523 PolarHBondContact O-N 3.41Å; Y520-A523 PolarHBondContact O-N 3.35Å; A523-T526 PolarHBondContact O-N 3.26Å; A523-A527 VanDerWaalsContact O-CB 3.26Å; A523-A527 WeakPolarHBondContact O-CB 3.36Å; A523-A527 PolarHBondContact O-N 3.12Å
524	L	93	Very high	88.4	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-67.7	-34.2	175.8	-73.1	171	0	0	0	113.1	L414 L417 L437 Y453 A456 F457 I460 Y520 K521 N522 A527 L528 L635	L414-L524 HydrophobicContact CD2-CD2 3.6Å; L414-L524 VanDerWaalsContact CD2-CD2 3.43Å; L417-L524 HydrophobicContact CD1-CD1 4Å; L417-L524 HydrophobicContact CD1-CD2 3.98Å; L417-L524 HydrophobicContact CD1-CG 4.36Å; L437-L524 HydrophobicContact CD1-CD2 4.29Å; L437-L524 HydrophobicContact CD1-CG 4.44Å; L437-L524 HydrophobicContact CD2-CD2 4.28Å; Y453-L524 HydrophobicContact CD1-CD2 4.25Å; A456-L524 HydrophobicContact CB-CD1 3.96Å; A456-L524 HydrophobicContact CB-CD2 3.98Å; F457-L524 HydrophobicContact CB-CB 4.3Å; F457-L524 HydrophobicContact CB-CD1 4.19Å; F457-L524 HydrophobicContact CD2-CB 4.4Å; I460-L524 HydrophobicContact CD1-CD1 3.7Å; I460-L524 HydrophobicContact CG1-CD1 4.14Å; Y520-L524 WeakPolarHBondContact O-CB 3.4Å; Y520-L524 VanDerWaalsContact O-CG 3.26Å; Y520-L524 WeakPolarHBondContact O-CG 3.42Å; Y520-L524 PolarHBondContact O-N 2.95Å; K521-L524 PolarHBondContact O-N 3.4Å; N522-L524 VanDerWaalsContact C-N 3.31Å; N522-L524 PolarHBondContact O-N 3.36Å; L524-A527 PolarHBondContact O-N 2.95Å; L524-L528 WeakPolarHBondContact O-CB 3.16Å; L524-L528 PolarHBondContact O-N 2.99Å; L524-L528 VanDerWaalsContact O-N 3.08Å; L524-L635 HydrophobicContact CB-CD1 4.21Å
525	S	90.8	Very high	88.2	Confident	18.5 Å²	18.5	41.8 Å²	41.8	13%	0.129	20%	0.203	C	C	.	.	H	α-helix	trans	-66.2	-46.6	174.1	-112.3	0	0	0	0	110.6	K521 N522 A527 L528 E529	K521-S525 PolarHBondContact O-N 3.46Å; K521-S525 PolarHBondContact O-OG 2.9Å; N522-S525 WeakPolarHBondContact O-CA 3.18Å; N522-S525 WeakPolarHBondContact O-CB 3.35Å; N522-S525 PolarHBondContact O-N 3.34Å; N522-S525 VanDerWaalsContact O-N 3.11Å; S525-A527 VanDerWaalsContact C-N 3.31Å; S525-A527 PolarHBondContact O-N 3.33Å; S525-L528 WeakPolarHBondContact O-CB 3.29Å; S525-L528 PolarHBondContact O-N 2.9Å; S525-E529 WeakPolarHBondContact O-CG 3.18Å; S525-E529 PolarHBondContact O-N 2.88Å; S525-E529 VanDerWaalsContact O-N 3.13Å
526	T	89.5	Confident	88	Confident	58.5 Å²	58.5	35.8 Å²	35.8	36%	0.359	18%	0.176	S	C	.	.	H	α-helix	trans	-61.1	-40.8	173.8	-50.9	0	0	0	0	111.4	T438 N522 A523 L528 E529 L530	T438-T526 HydrophobicContact CG2-CG2 4.44Å; N522-T526 PolarHBondContact O-N 3.21Å; N522-T526 PolarHBondContact O-OG1 3.36Å; N522-T526 VanDerWaalsContact O-OG1 3.12Å; A523-T526 PolarHBondContact O-N 3.26Å; T526-L528 VanDerWaalsContact C-N 3.3Å; T526-L528 PolarHBondContact O-N 3.09Å; T526-E529 PolarHBondContact O-N 3.1Å; T526-L530 HydrophobicContact CG2-CD1 4.06Å; T526-L530 HydrophobicContact CG2-CG 4.37Å; T526-L530 WeakPolarHBondContact O-CB 3.4Å; T526-L530 WeakPolarHBondContact O-CG 3.37Å; T526-L530 PolarHBondContact O-N 3.08Å
527	A	91.2	Very high	87.4	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-61.9	-40.9	178	0	0	0	0	0	112.3	L437 I443 Y453 A523 L524 S525 S531	L437-A527 VanDerWaalsContact O-CB 3.24Å; L437-A527 WeakPolarHBondContact O-CB 3.34Å; I443-A527 HydrophobicContact CD1-CB 4.13Å; Y453-A527 HydrophobicContact CD1-CB 3.66Å; Y453-A527 HydrophobicContact CE1-CB 3.59Å; Y453-A527 HydrophobicContact CG-CB 4.06Å; A523-A527 VanDerWaalsContact O-CB 3.26Å; A523-A527 WeakPolarHBondContact O-CB 3.36Å; A523-A527 PolarHBondContact O-N 3.12Å; L524-A527 PolarHBondContact O-N 2.95Å; S525-A527 VanDerWaalsContact C-N 3.31Å; S525-A527 PolarHBondContact O-N 3.33Å; A527-S531 VanDerWaalsContact O-CB 3.27Å; A527-S531 WeakPolarHBondContact O-CB 3.37Å; A527-S531 PolarHBondContact O-N 3.15Å
528	L	90.3	Very high	86.9	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-63.8	-45	175	-179.7	109	0	0	0	111	P450 Y453 F454 L524 S525 T526 L530 S531 M532 L571 M575 I634 L635	P450-L528 HydrophobicContact CB-CD1 3.76Å; P450-L528 HydrophobicContact CB-CG 4.14Å; P450-L528 HydrophobicContact CG-CD1 4.2Å; Y453-L528 HydrophobicContact CD2-CD1 4.18Å; Y453-L528 HydrophobicContact CG-CB 4.46Å; F454-L528 HydrophobicContact CB-CD1 4.01Å; L524-L528 WeakPolarHBondContact O-CB 3.16Å; L524-L528 PolarHBondContact O-N 2.99Å; L524-L528 VanDerWaalsContact O-N 3.08Å; S525-L528 WeakPolarHBondContact O-CB 3.29Å; S525-L528 PolarHBondContact O-N 2.9Å; T526-L528 VanDerWaalsContact C-N 3.3Å; T526-L528 PolarHBondContact O-N 3.09Å; L528-L530 PolarHBondContact O-N 3.28Å; L528-S531 WeakPolarHBondContact O-CB 3.32Å; L528-S531 PolarHBondContact O-N 3.12Å; L528-M532 HydrophobicContact CD1-CG 4.19Å; L528-M532 HydrophobicContact CD1-SD 4.02Å; L528-M532 HydrophobicContact CD2-SD 4.08Å; L528-M532 HydrophobicContact CG-CG 4.45Å; L528-M532 HydrophobicContact CG-SD 3.84Å; L528-M532 WeakPolarHBondContact O-CB 3.4Å; L528-M532 VanDerWaalsContact O-CG 3.24Å; L528-M532 WeakPolarHBondContact O-CG 3.39Å; L528-M532 PolarHBondContact O-N 3.2Å; L528-L571 HydrophobicContact CD2-CD1 4.45Å; L528-M575 HydrophobicContact CD1-CE 4.16Å; L528-M575 HydrophobicContact CD2-CE 4.02Å; L528-M575 HydrophobicContact CG-CE 4.16Å; L528-I634 HydrophobicContact CD2-CB 4.05Å; L528-I634 HydrophobicContact CD2-CD1 3.95Å; L528-I634 HydrophobicContact CD2-CG2 4.03Å; L528-L635 HydrophobicContact CD1-CD1 4.47Å; L528-L635 HydrophobicContact CD1-CD2 3.87Å; L528-L635 HydrophobicContact CD1-CG 4.24Å; L528-L635 HydrophobicContact CD2-CD2 3.46Å; L528-L635 VanDerWaalsContact CD2-CD2 3.46Å; L528-L635 HydrophobicContact CD2-CG 3.77Å
529	E	88.5	Confident	86.5	Confident	76.5 Å²	76.5	36.7 Å²	36.7	36%	0.357	19%	0.185	S	C	.	.	H	α-helix	trans	-64.9	-43.8	179.4	-72.4	174.5	-171.6	0	0	112.4	S525 T526 S531 M532 K533 G633 I634	S525-E529 WeakPolarHBondContact O-CG 3.18Å; S525-E529 PolarHBondContact O-N 2.88Å; S525-E529 VanDerWaalsContact O-N 3.13Å; T526-E529 PolarHBondContact O-N 3.1Å; E529-S531 VanDerWaalsContact C-N 3.32Å; E529-S531 PolarHBondContact O-N 2.91Å; E529-M532 PolarHBondContact O-N 2.86Å; E529-K533 VanDerWaalsContact O-CB 3.28Å; E529-K533 WeakPolarHBondContact O-CB 3.24Å; E529-K533 PolarHBondContact O-N 3.21Å; E529-G633 WeakPolarHBondContact OE1-CA 3.44Å; E529-I634 HydrophobicContact CG-CD1 4.05Å; E529-I634 HydrophobicContact CG-CG1 4.38Å; E529-I634 PolarHBondContact OE1-N 2.91Å
530	L	86.7	Confident	85.7	Confident	31 Å²	31	34.1 Å²	34.1	16%	0.162	18%	0.179	C	C	.	.	H	α-helix	trans	-63	-43.1	173.6	-72.4	173.4	0	0	0	111.5	T438 P440 I443 T526 L528 M532 K533 H534	T438-L530 VanDerWaalsContact O-CD1 3.3Å; T438-L530 WeakPolarHBondContact O-CD1 3.31Å; P440-L530 HydrophobicContact CB-CD1 4.42Å; P440-L530 HydrophobicContact CB-CD2 4.4Å; P440-L530 HydrophobicContact CG-CD1 4.21Å; P440-L530 HydrophobicContact CG-CD2 4.31Å; I443-L530 HydrophobicContact CD1-CB 3.89Å; I443-L530 HydrophobicContact CD1-CD1 3.52Å; I443-L530 VanDerWaalsContact CD1-CD1 3.45Å; I443-L530 HydrophobicContact CD1-CG 4.36Å; I443-L530 HydrophobicContact CG2-CB 4.22Å; T526-L530 HydrophobicContact CG2-CD1 4.06Å; T526-L530 HydrophobicContact CG2-CG 4.37Å; T526-L530 WeakPolarHBondContact O-CB 3.4Å; T526-L530 WeakPolarHBondContact O-CG 3.37Å; T526-L530 PolarHBondContact O-N 3.08Å; L528-L530 PolarHBondContact O-N 3.28Å; L530-M532 VanDerWaalsContact C-N 3.26Å; L530-M532 PolarHBondContact O-N 3.16Å; L530-K533 PolarHBondContact O-N 2.93Å; L530-H534 WeakPolarHBondContact O-CB 3.33Å; L530-H534 PolarHBondContact O-CD2 3.32Å; L530-H534 VanDerWaalsContact O-CD2 3.24Å; L530-H534 PolarHBondContact O-N 3.12Å
531	S	86.3	Confident	84.8	Confident	1 Å²	1	34.7 Å²	34.7	1%	0.007	19%	0.185	C	C	.	.	H	α-helix	trans	-59.7	-39.4	175.6	-178.6	0	0	0	0	111.5	Q448 Y453 A527 L528 E529 N535	Q448-S531 PolarHBondContact O-OG 3.45Å; Y453-S531 VanDerWaalsContact CE2-CB 3.48Å; A527-S531 VanDerWaalsContact O-CB 3.27Å; A527-S531 WeakPolarHBondContact O-CB 3.37Å; A527-S531 PolarHBondContact O-N 3.15Å; L528-S531 WeakPolarHBondContact O-CB 3.32Å; L528-S531 PolarHBondContact O-N 3.12Å; E529-S531 VanDerWaalsContact C-N 3.32Å; E529-S531 PolarHBondContact O-N 2.91Å; S531-N535 WeakPolarHBondContact O-CA 3.42Å; S531-N535 WeakPolarHBondContact O-CB 3.42Å; S531-N535 PolarHBondContact O-N 2.81Å; S531-N535 PolarHBondContact O-ND2 3.19Å; S531-N535 PolarHBondContact OG-ND2 3.03Å
532	M	85.4	Confident	84.4	Confident	7.5 Å²	7.5	34.5 Å²	34.5	4%	0.037	19%	0.187	C	C	.	.	H	α-helix	trans	-70.3	-48	177.1	-75.4	177.5	53.2	0	0	111.9	P450 L528 E529 L530 H534 L536 M575 S578 I579 I634	P450-M532 HydrophobicContact CB-CG 3.92Å; P450-M532 HydrophobicContact CB-SD 4.47Å; P450-M532 HydrophobicContact CG-CB 4.45Å; P450-M532 HydrophobicContact CG-CG 3.3Å; P450-M532 HydrophobicContact CG-SD 4.36Å; L528-M532 HydrophobicContact CD1-CG 4.19Å; L528-M532 HydrophobicContact CD1-SD 4.02Å; L528-M532 HydrophobicContact CD2-SD 4.08Å; L528-M532 HydrophobicContact CG-CG 4.45Å; L528-M532 HydrophobicContact CG-SD 3.84Å; L528-M532 WeakPolarHBondContact O-CB 3.4Å; L528-M532 VanDerWaalsContact O-CG 3.24Å; L528-M532 WeakPolarHBondContact O-CG 3.39Å; L528-M532 PolarHBondContact O-N 3.2Å; E529-M532 PolarHBondContact O-N 2.86Å; L530-M532 VanDerWaalsContact C-N 3.26Å; L530-M532 PolarHBondContact O-N 3.16Å; M532-H534 VanDerWaalsContact C-N 3.27Å; M532-H534 PolarHBondContact O-N 3.15Å; M532-L536 HydrophobicContact CB-CD1 4.45Å; M532-L536 HydrophobicContact CG-CD1 4.13Å; M532-L536 WeakPolarHBondContact O-CB 3.39Å; M532-L536 PolarHBondContact O-N 3.21Å; M532-M575 VanDerWaalsContact CE-CA 3.41Å; M532-M575 HydrophobicContact CE-CB 3.78Å; M532-M575 HydrophobicContact CE-CE 4.31Å; M532-M575 HydrophobicContact CE-CG 3.99Å; M532-M575 VanDerWaalsContact CE-O 3.25Å; M532-M575 WeakPolarHBondContact CE-O 3.47Å; M532-M575 HydrophobicContact CG-CE 3.64Å; M532-M575 HydrophobicContact SD-CB 4.08Å; M532-M575 HydrophobicContact SD-CE 3.94Å; M532-M575 HydrophobicContact SD-CG 3.61Å; M532-M575 VanDerWaalsContact SD-CG 3.54Å; M532-M575 HydrophobicContact SD-SD 4.32Å; M532-S578 WeakPolarHBondContact CE-OG 3.25Å; M532-I579 HydrophobicContact CB-CD1 4.22Å; M532-I579 HydrophobicContact CE-CD1 3.6Å; M532-I579 HydrophobicContact CE-CG1 3.59Å; M532-I579 HydrophobicContact CG-CD1 4.38Å; M532-I634 HydrophobicContact CE-CD1 3.44Å; M532-I634 VanDerWaalsContact CE-CD1 3.44Å; M532-I634 HydrophobicContact SD-CD1 3.23Å; M532-I634 WeakPolarHBondContact SD-CD1 3.47Å; M532-I634 HydrophobicContact SD-CG1 4.5Å
533	K	80.9	Confident	84.4	Confident	162.5 Å²	162.5	29.5 Å²	29.5	71%	0.707	16%	0.16	S	C	*	.	H	α-helix	trans	-59.6	-37.5	-178.9	-175.2	179.1	179.2	-177.5	0	112.6	E529 L530	E529-K533 VanDerWaalsContact O-CB 3.28Å; E529-K533 WeakPolarHBondContact O-CB 3.24Å; E529-K533 PolarHBondContact O-N 3.21Å; L530-K533 PolarHBondContact O-N 2.93Å
534	H	80.4	Confident	84.5	Confident	80.5 Å²	80.5	29.3 Å²	29.3	37%	0.373	16%	0.158	S	C	.	.	H	α-helix	trans	-104.5	-26.4	-173.3	-63.5	-69.3	0	0	0	114.7	M444 L530 M532	M444-H534 HydrophobicContact CE-CB 4.38Å; M444-H534 HydrophobicContact CG-CB 3.59Å; M444-H534 HydrophobicContact SD-CB 4.07Å; L530-H534 WeakPolarHBondContact O-CB 3.33Å; L530-H534 PolarHBondContact O-CD2 3.32Å; L530-H534 VanDerWaalsContact O-CD2 3.24Å; L530-H534 PolarHBondContact O-N 3.12Å; M532-H534 VanDerWaalsContact C-N 3.27Å; M532-H534 PolarHBondContact O-N 3.15Å
535	N	79.6	Confident	84.5	Confident	20.5 Å²	20.5	29.3 Å²	29.3	11%	0.11	16%	0.158	C	C	.	.	H	α-helix	trans	-103.5	-10.1	-176.7	-56.7	-32.9	0	0	0	113.8	I443 M444 Q448 S531 R728	I443-N535 PolarHBondContact O-ND2 2.98Å; M444-N535 WeakPolarHBondContact CA-OD1 3.27Å; M444-N535 PolarHBondContact O-OD1 3.42Å; Q448-N535 PolarHBondContact O-ND2 2.88Å; Q448-N535 VanDerWaalsContact O-ND2 3.12Å; S531-N535 WeakPolarHBondContact O-CA 3.42Å; S531-N535 WeakPolarHBondContact O-CB 3.42Å; S531-N535 PolarHBondContact O-N 2.81Å; S531-N535 PolarHBondContact O-ND2 3.19Å; S531-N535 PolarHBondContact OG-ND2 3.03Å; N535-R728 PolarHBondContact O-NE 3.04Å; N535-R728 PolarHBondContact O-NH2 3.4Å
536	L	80.1	Confident	84.6	Confident	12.5 Å²	12.5	28.8 Å²	28.8	7%	0.065	15%	0.154	C	C	.	.	S	Bend	trans	-118.6	136	178.1	-63.1	175.3	0	0	0	110.6	F449 P450 M532 M575 I579 D724 L727 R728	F449-L536 HydrophobicContact CD1-CD2 3.87Å; F449-L536 HydrophobicContact CE1-CD2 3.68Å; P450-L536 HydrophobicContact CG-CD1 3.84Å; M532-L536 HydrophobicContact CB-CD1 4.45Å; M532-L536 HydrophobicContact CG-CD1 4.13Å; M532-L536 WeakPolarHBondContact O-CB 3.39Å; M532-L536 PolarHBondContact O-N 3.21Å; L536-M575 HydrophobicContact CD1-CE 3.84Å; L536-I579 HydrophobicContact CB-CD1 3.92Å; L536-I579 HydrophobicContact CD1-CD1 3.51Å; L536-I579 HydrophobicContact CG-CD1 4.37Å; L536-D724 HydrophobicContact CD1-CB 4.37Å; L536-D724 HydrophobicContact CD2-CB 4.34Å; L536-D724 WeakPolarHBondContact CD2-O 3.22Å; L536-L727 HydrophobicContact CD1-CB 4.27Å; L536-L727 HydrophobicContact CD1-CD1 3.77Å; L536-L727 HydrophobicContact CD2-CB 4.44Å; L536-R728 HydrophobicContact CD2-CG 3.74Å
537	P	75.6	Confident	84.6	Confident	36.5 Å²	36.5	26 Å²	26	24%	0.237	14%	0.137	C	C	.	.			trans	-72.3	151.3	174.3	31.7	-33.6	0	0	0	110.8	I579 R728 A731	P537-I579 WeakPolarHBondContact O-CG2 3.28Å; P537-R728 HydrophobicContact CG-CB 4.3Å; P537-R728 HydrophobicContact CG-CG 4.25Å; P537-A731 HydrophobicContact CB-CB 4.24Å; P537-A731 HydrophobicContact CG-CB 3.65Å
538	P	78.4	Confident	84.4	Confident	51.5 Å²	51.5	26.1 Å²	26.1	33%	0.334	14%	0.138	S	C	.	.			trans	-61.8	145.2	172.1	27.4	-33.5	0	0	0	111.1	C540 A731	P538-C540 PolarHBondContact O-N 3.27Å; P538-A731 WeakPolarHBondContact O-CB 3.44Å
539	I	81.8	Confident	83.6	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	104.3	176.3	-62.8	164.2	0	0	0	107.5	I579 C580 E581 K669 L727 I730 A731	I539-I579 HydrophobicContact CD1-CB 4.46Å; I539-I579 HydrophobicContact CD1-CG2 4.32Å; I539-I579 HydrophobicContact CG1-CG2 4.06Å; I539-I579 PolarHBondContact N-O 2.88Å; I539-C580 HydrophobicContact CB-CB 4.48Å; I539-C580 WeakPolarHBondContact O-CA 3.35Å; I539-E581 PolarHBondContact O-N 3.11Å; I539-E581 VanDerWaalsContact O-N 3.14Å; I539-K669 HydrophobicContact CG2-CD 4.23Å; I539-L727 HydrophobicContact CD1-CD2 4.37Å; I539-I730 HydrophobicContact CD1-CB 4.27Å; I539-I730 HydrophobicContact CD1-CG2 3.81Å; I539-I730 HydrophobicContact CG1-CG2 4.24Å; I539-I730 HydrophobicContact CG2-CG2 3.97Å; I539-A731 HydrophobicContact CG1-CB 3.87Å
540	C	73	Confident	82.7	Confident	24 Å²	24	23.4 Å²	23.4	16%	0.162	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	149.6	-178	-53.3	0	0	0	0	112.3	P538 E581 K669	P538-C540 PolarHBondContact O-N 3.27Å; C540-E581 VanDerWaalsContact CA-CD 3.49Å; C540-E581 VanDerWaalsContact CA-OE2 3.27Å; C540-E581 WeakPolarHBondContact CA-OE2 3.33Å; C540-E581 PolarHBondContact SG-OE1 3.44Å; C540-K669 PolarHBondContact O-NZ 3.19Å
541	G	75.1	Confident	81.7	Confident	13.5 Å²	13.5	26.2 Å²	26.2	14%	0.139	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	85	172.5	175.5	0	0	0	0	0	115.2	T543 E581 T582 D668	G541-T543 PolarHBondContact O-N 3.2Å; G541-T543 PolarHBondContact O-OG1 2.65Å; G541-E581 PolarHBondContact N-OE2 3.23Å; G541-T582 PolarHBondContact O-OG1 3.08Å; G541-T582 VanDerWaalsContact O-OG1 3.1Å; G541-D668 VanDerWaalsContact C-OD2 3.27Å; G541-D668 WeakPolarHBondContact CA-OD2 3.27Å
542	S	82.7	Confident	80.2	Confident	17.5 Å²	17.5	31.9 Å²	31.9	12%	0.122	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	115.9	-178.2	56.8	0	0	0	0	111	T582 Q666 F667 D668 K669 H1335	S542-T582 WeakPolarHBondContact CA-OG1 3.34Å; S542-T582 PolarHBondContact N-OG1 3.37Å; S542-Q666 WeakPolarHBondContact CB-O 3.46Å; S542-Q666 PolarHBondContact OG-O 3.3Å; S542-F667 CarbonylContact O-C 3.57Å; S542-F667 WeakPolarHBondContact O-CA 3.49Å; S542-F667 VanDerWaalsContact OG-CA 3.25Å; S542-F667 WeakPolarHBondContact OG-CA 3.36Å; S542-D668 PolarHBondContact N-OD2 3.36Å; S542-D668 PolarHBondContact O-N 2.96Å; S542-D668 PolarHBondContact OG-N 3.12Å; S542-D668 VanDerWaalsContact OG-N 3.09Å; S542-D668 PolarHBondContact OG-OD2 3.01Å; S542-K669 PolarHBondContact O-N 2.89Å; S542-K669 VanDerWaalsContact O-N 3.13Å; S542-H1335 PolarHBondContact N-CE1 3.34Å
543	T	90.4	Very high	78.7	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	118	-174.3	-54.2	0	0	0	0	110.8	G541 I545 T582 T584 K669 V671	G541-T543 PolarHBondContact O-N 3.2Å; G541-T543 PolarHBondContact O-OG1 2.65Å; T543-I545 HydrophobicContact CG2-CD1 4.4Å; T543-I545 HydrophobicContact CG2-CG1 3.76Å; T543-T582 PolarHBondContact N-O 3.13Å; T543-T584 PolarHBondContact O-N 3.22Å; T543-K669 CarbonylContact C-O 3.55Å; T543-K669 VanDerWaalsContact CA-O 3.31Å; T543-K669 WeakPolarHBondContact CA-O 3.38Å; T543-K669 HydrophobicContact CG2-CB 4Å; T543-V671 HydrophobicContact CG2-CB 4.42Å; T543-V671 HydrophobicContact CG2-CG2 3.82Å
544	L	93.7	Very high	77.3	Confident	3 Å²	3	28.2 Å²	28.2	2%	0.016	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	117.2	168.3	179.9	61.6	0	0	0	109	I546 T584 Y586 L660 F667 K669 I670 V671 Y683	L544-I546 HydrophobicContact CD2-CD1 4.41Å; L544-I546 HydrophobicContact CG-CG1 4.4Å; L544-T584 WeakPolarHBondContact CA-O 3.45Å; L544-T584 HydrophobicContact CD1-CG2 4.08Å; L544-T584 WeakPolarHBondContact CD1-O 3.43Å; L544-Y586 HydrophobicContact CD1-CD2 3.88Å; L544-Y586 HydrophobicContact CD1-CE2 4.04Å; L544-L660 HydrophobicContact CD1-CD1 4.29Å; L544-L660 HydrophobicContact CD2-CD1 3.72Å; L544-F667 HydrophobicContact CB-CD1 3.74Å; L544-F667 HydrophobicContact CB-CD2 4.12Å; L544-F667 HydrophobicContact CB-CE1 3.78Å; L544-F667 HydrophobicContact CB-CE2 4.14Å; L544-F667 HydrophobicContact CB-CG 3.91Å; L544-F667 HydrophobicContact CB-CZ 3.97Å; L544-F667 HydrophobicContact CD1-CE1 4.25Å; L544-F667 HydrophobicContact CD1-CE2 4.33Å; L544-F667 HydrophobicContact CD1-CZ 4Å; L544-F667 HydrophobicContact CD2-CD2 4.35Å; L544-F667 HydrophobicContact CD2-CE2 4.09Å; L544-F667 HydrophobicContact CD2-CZ 4.44Å; L544-F667 HydrophobicContact CG-CE1 4.49Å; L544-F667 HydrophobicContact CG-CE2 4.39Å; L544-F667 HydrophobicContact CG-CZ 4.36Å; L544-K669 PolarHBondContact N-O 3Å; L544-I670 HydrophobicContact CB-CB 4.42Å; L544-I670 HydrophobicContact CB-CG1 4.09Å; L544-I670 HydrophobicContact CB-CG2 4.44Å; L544-I670 HydrophobicContact CD2-CD1 3.87Å; L544-I670 HydrophobicContact CD2-CG1 4.16Å; L544-I670 HydrophobicContact CD2-CG2 4.28Å; L544-I670 HydrophobicContact CG-CD1 4.35Å; L544-I670 HydrophobicContact CG-CG1 4.13Å; L544-I670 CarbonylContact O-C 3.59Å; L544-I670 WeakPolarHBondContact O-CA 3.4Å; L544-V671 PolarHBondContact O-N 3.31Å; L544-Y683 HydrophobicContact CD2-CE1 4.17Å
545	I	94.1	Very high	75.6	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	123.6	-177.3	-54	168	0	0	0	108.9	T543 C576 P583 T584 T585 Y586 V671 F673	T543-I545 HydrophobicContact CG2-CD1 4.4Å; T543-I545 HydrophobicContact CG2-CG1 3.76Å; I545-C576 HydrophobicContact CD1-CB 3.94Å; I545-C576 VanDerWaalsContact CD1-SG 3.57Å; I545-P583 HydrophobicContact CD1-CB 3.95Å; I545-T584 PolarHBondContact N-O 3.26Å; I545-T585 HydrophobicContact CB-CG2 4.1Å; I545-T585 HydrophobicContact CG2-CG2 4.13Å; I545-T585 CarbonylContact O-C 3.53Å; I545-T585 VanDerWaalsContact O-CA 3.29Å; I545-T585 WeakPolarHBondContact O-CA 3.37Å; I545-Y586 PolarHBondContact O-N 3.01Å; I545-V671 CarbonylContact C-O 3.55Å; I545-V671 WeakPolarHBondContact CA-O 3.38Å; I545-F673 HydrophobicContact CG2-CD2 4.11Å; I545-F673 HydrophobicContact CG2-CE2 4.04Å
546	I	92.6	Very high	74.2	Confident	6.5 Å²	6.5	30.9 Å²	30.9	3%	0.033	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	115.4	175.8	-59.7	175.7	0	0	0	108.4	L544 L595 V671 V672 F673 I680	L544-I546 HydrophobicContact CD2-CD1 4.41Å; L544-I546 HydrophobicContact CG-CG1 4.4Å; I546-L595 HydrophobicContact CG2-CD2 4.19Å; I546-V671 PolarHBondContact N-O 3.24Å; I546-V672 HydrophobicContact CB-CG1 4.47Å; I546-V672 HydrophobicContact CB-CG2 4.36Å; I546-V672 HydrophobicContact CD1-CG2 4.46Å; I546-F673 PolarHBondContact O-N 3.16Å; I546-I680 HydrophobicContact CD1-CD1 3.47Å; I546-I680 VanDerWaalsContact CD1-CD1 3.41Å; I546-I680 HydrophobicContact CD1-CG1 3.84Å; I546-I680 HydrophobicContact CD1-CG2 4.22Å; I546-I680 HydrophobicContact CG2-CD1 4.32Å
547	C	90.7	Very high	72.6	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	113.7	-178.2	-43	0	0	0	0	109.5	F570 G573 T585 Y586 T588 M641	C547-F570 HydrophobicContact CB-CD1 3.75Å; C547-F570 HydrophobicContact CB-CE1 4.25Å; C547-F570 WeakPolarHBondContact O-CE1 3.03Å; C547-G573 WeakPolarHBondContact SG-CA 3.3Å; C547-T585 VanDerWaalsContact SG-CG2 3.55Å; C547-Y586 PolarHBondContact N-O 3.11Å; C547-T588 PolarHBondContact O-N 3.2Å; C547-T588 PolarHBondContact O-OG1 2.95Å; C547-M641 HydrophobicContact CB-CE 4.04Å
548	S	85.1	Confident	71.1	Confident	3.5 Å²	3.5	39.6 Å²	39.6	2%	0.024	21%	0.213	C	C	.	.			trans	-118.2	154.4	-179.2	-172.9	0	0	0	0	112.6	T588 Y593 F673	S548-T588 WeakPolarHBondContact CA-OG1 3.26Å; S548-Y593 WeakPolarHBondContact CB-OH 3.33Å; S548-Y593 PolarHBondContact OG-OH 3.43Å; S548-F673 WeakPolarHBondContact CA-O 3.35Å; S548-F673 WeakPolarHBondContact CB-O 3.31Å; S548-F673 PolarHBondContact N-O 2.93Å
549	T	75.2	Confident	69.4	Low	14 Å²	14	46.3 Å²	46.3	9%	0.086	24%	0.237	C	C	.	.			trans	-89.8	133.9	166	58.5	0	0	0	0	109.9	K551 Q566 F570 R645	T549-K551 PolarHBondContact O-N 2.92Å; T549-Q566 VanDerWaalsContact CG2-O 3.28Å; T549-Q566 WeakPolarHBondContact CG2-O 3.29Å; T549-F570 HydrophobicContact CG2-CD2 4.27Å; T549-F570 HydrophobicContact CG2-CE1 4.08Å; T549-F570 HydrophobicContact CG2-CE2 3.31Å; T549-F570 HydrophobicContact CG2-CZ 3.35Å; T549-F570 VanDerWaalsContact CG2-CZ 3.42Å; T549-R645 PolarHBondContact OG1-NH1 2.87Å
550	S	68.3	Low	67.7	Low	5 Å²	5	51.5 Å²	51.5	4%	0.035	27%	0.273	C	S	.	.			trans	-71.5	124.3	173.8	-176.2	0	0	0	0	111.7	D675 S702 D705	S550-D675 WeakPolarHBondContact CA-OD1 3.37Å; S550-D675 PolarHBondContact OG-OD1 2.94Å; S550-S702 VanDerWaalsContact OG-CB 3.29Å; S550-S702 WeakPolarHBondContact OG-CB 3.35Å; S550-S702 PolarHBondContact OG-OG 2.81Å; S550-D705 WeakPolarHBondContact CB-OD1 3.36Å; S550-D705 PolarHBondContact OG-OD1 3.27Å
551	K	65.9	Low	66.7	Low	91.5 Å²	91.5	52.4 Å²	52.4	40%	0.398	28%	0.279	S	S	.	.	S	Bend	trans	-74.7	-35.8	177.9	-69	173.8	179.9	-179.6	0	112.7	T549 V553 D591 D675	T549-K551 PolarHBondContact O-N 2.92Å; K551-V553 PolarHBondContact O-N 3Å; K551-D591 WeakPolarHBondContact CE-O 3.48Å; K551-D591 WeakPolarHBondContact CE-OD1 3.43Å; K551-D591 PolarHBondContact NZ-O 3.2Å; K551-D675 WeakPolarHBondContact CB-OD2 3.44Å; K551-D675 WeakPolarHBondContact CG-OD2 3.24Å; K551-D675 PolarHBondContact N-OD2 2.91Å
552	Y	55.3	Low	65.5	Low	119 Å²	119	56.4 Å²	56.4	47%	0.467	29%	0.293	S	S	.	.			trans	-101.3	65.6	-167	-57.7	-84.8	0	0	0	112.1	N554 S702 E704 V706	Y552-N554 PolarHBondContact O-N 3.48Å; Y552-S702 WeakPolarHBondContact O-CB 3.43Å; Y552-E704 WeakPolarHBondContact CB-O 3.44Å; Y552-E704 VanDerWaalsContact O-OE2 3.13Å; Y552-V706 HydrophobicContact CD2-CB 4.45Å; Y552-V706 HydrophobicContact CD2-CG1 4.25Å; Y552-V706 HydrophobicContact CD2-CG2 3.66Å; Y552-V706 HydrophobicContact CE1-CG2 4.15Å; Y552-V706 HydrophobicContact CE2-CB 3.82Å; Y552-V706 HydrophobicContact CE2-CG1 4.02Å; Y552-V706 HydrophobicContact CE2-CG2 3.67Å; Y552-V706 HydrophobicContact CG-CG2 4.28Å; Y552-V706 VanDerWaalsContact CZ-CG2 3.45Å
553	V	54.7	Low	64.4	Low	28.5 Å²	28.5	58.4 Å²	58.4	17%	0.173	31%	0.307	C	S	.	.			trans	-94.2	99.5	171.4	-174.2	0	0	0	0	109.1	K551 S555 H558 K562 V565	K551-V553 PolarHBondContact O-N 3Å; V553-S555 PolarHBondContact O-N 3.41Å; V553-S555 VanDerWaalsContact O-N 3.1Å; V553-H558 HydrophobicContact CG1-CB 4.42Å; V553-K562 HydrophobicContact CG1-CG 4.28Å; V553-V565 HydrophobicContact CG1-CB 4.46Å; V553-V565 HydrophobicContact CG2-CB 4.01Å; V553-V565 HydrophobicContact CG2-CG1 3.59Å
554	N	50.2	Low	63.3	Low	65.5 Å²	65.5	60.7 Å²	60.7	35%	0.35	32%	0.316	S	S	.	.			trans	-52.7	113.9	179.3	-144.4	-30.2	0	0	0	111.9	Y552 S556 K557 E704	Y552-N554 PolarHBondContact O-N 3.48Å; N554-S556 PolarHBondContact O-N 3.02Å; N554-S556 VanDerWaalsContact O-N 3.08Å; N554-S556 PolarHBondContact OD1-OG 3.36Å; N554-K557 PolarHBondContact O-N 2.88Å; N554-E704 VanDerWaalsContact CB-OE1 3.29Å; N554-E704 WeakPolarHBondContact CB-OE1 3.38Å; N554-E704 WeakPolarHBondContact CB-OE2 3.32Å; N554-E704 PolarHBondContact ND2-OE1 3.26Å; N554-E704 PolarHBondContact ND2-OE2 3.43Å
555	S	46	Very low	62	Low	74 Å²	74	61.5 Å²	61.5	52%	0.517	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-21.1	-168.3	-12.3	0	0	0	0	114.7	V553 K562	V553-S555 PolarHBondContact O-N 3.41Å; V553-S555 VanDerWaalsContact O-N 3.1Å; S555-K562 VanDerWaalsContact CA-CE 3.46Å; S555-K562 WeakPolarHBondContact O-CE 3.44Å; S555-K562 PolarHBondContact O-NZ 2.94Å
556	S	48.5	Very low	60.9	Low	82.5 Å²	82.5	64.6 Å²	64.6	58%	0.577	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-33.9	-175.3	59.8	0	0	0	0	113.5	N554	N554-S556 PolarHBondContact O-N 3.02Å; N554-S556 VanDerWaalsContact O-N 3.08Å; N554-S556 PolarHBondContact OD1-OG 3.36Å
557	K	47.4	Very low	60.3	Low	146.5 Å²	146.5	65.2 Å²	65.2	64%	0.637	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-25.6	-172.7	-70.1	179.4	-177.9	166.6	0	114.3	N554	N554-K557 PolarHBondContact O-N 2.88Å
558	H	44.7	Very low	59.8	Low	85.5 Å²	85.5	65.6 Å²	65.6	40%	0.396	34%	0.34	S	S	.	.			trans	-129.1	55.2	-168.5	-64.2	-67.1	0	0	0	114.1	V553 S560 S561 K562	V553-H558 HydrophobicContact CG1-CB 4.42Å; H558-S560 PolarHBondContact O-N 2.97Å; H558-S560 VanDerWaalsContact O-N 3.08Å; H558-S561 PolarHBondContact O-N 3.05Å; H558-K562 WeakPolarHBondContact O-CG 3.26Å; H558-K562 PolarHBondContact O-N 3.1Å
559	K	41.8	Very low	59.8	Low	192.5 Å²	192.5	65.4 Å²	65.4	84%	0.837	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	-30.6	-176.9	-77.1	-174.6	177.7	-179	0	115.4
560	S	46.3	Very low	60.5	Low	109.5 Å²	109.5	64.8 Å²	64.8	77%	0.766	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.3	-13.9	180	56.9	0	0	0	0	115.2	H558	H558-S560 PolarHBondContact O-N 2.97Å; H558-S560 VanDerWaalsContact O-N 3.08Å
561	S	51.4	Low	61.4	Low	41.5 Å²	41.5	64.6 Å²	64.6	29%	0.29	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110	3.2	-170.2	-62.1	0	0	0	0	114.6	H558 S563 Y564 V565	H558-S561 PolarHBondContact O-N 3.05Å; S561-S563 VanDerWaalsContact C-N 3.27Å; S561-S563 PolarHBondContact O-N 3.05Å; S561-S563 VanDerWaalsContact O-N 3.12Å; S561-Y564 WeakPolarHBondContact O-CB 3.23Å; S561-Y564 PolarHBondContact O-N 3.24Å; S561-Y564 VanDerWaalsContact O-N 3.12Å; S561-V565 PolarHBondContact O-N 2.89Å; S561-V565 VanDerWaalsContact O-N 3.15Å
562	K	51.4	Low	62.5	Low	98 Å²	98	60.3 Å²	60.3	43%	0.426	32%	0.316	S	S	.	.	H	α-helix	trans	-48.8	-47.6	-178.3	-75.2	-166.2	174.2	-170.3	0	113.5	V553 S555 H558 Y564 Q566	V553-K562 HydrophobicContact CG1-CG 4.28Å; S555-K562 VanDerWaalsContact CA-CE 3.46Å; S555-K562 WeakPolarHBondContact O-CE 3.44Å; S555-K562 PolarHBondContact O-NZ 2.94Å; H558-K562 WeakPolarHBondContact O-CG 3.26Å; H558-K562 PolarHBondContact O-N 3.1Å; K562-Y564 VanDerWaalsContact C-N 3.3Å; K562-Y564 PolarHBondContact O-N 3.34Å; K562-Q566 PolarHBondContact O-N 2.73Å
563	S	58.4	Low	64.2	Low	60 Å²	60	54.6 Å²	54.6	42%	0.42	29%	0.293	S	S	.	.	H	α-helix	trans	-70.6	-27.7	-176.1	-114.7	0	0	0	0	113.8	S561 I567	S561-S563 VanDerWaalsContact C-N 3.27Å; S561-S563 PolarHBondContact O-N 3.05Å; S561-S563 VanDerWaalsContact O-N 3.12Å; S563-I567 WeakPolarHBondContact O-CD1 3.49Å
564	Y	66.5	Low	65.9	Low	49 Å²	49	53.3 Å²	53.3	19%	0.192	29%	0.286	C	S	.	.	H	α-helix	trans	-79.9	-40.2	-174.3	-125.5	-76.1	0	0	0	112.3	F451 F454 D458 S561 K562 Q566 I567 L568 C722	F451-Y564 WeakPolarHBondContact CD2-OH 3.4Å; F451-Y564 VanDerWaalsContact CE2-CB 3.46Å; F451-Y564 HydrophobicContact CE2-CD1 4.07Å; F451-Y564 HydrophobicContact CE2-CD2 4.15Å; F451-Y564 AromaticContact CE2-CG 3.64Å; F451-Y564 HydrophobicContact CE2-CG 3.64Å; F451-Y564 HydrophobicContact CZ-CD2 4.32Å; F451-Y564 HydrophobicContact CZ-CG 4.24Å; F454-Y564 AromaticContact CD1-CD1 3.94Å; F454-Y564 HydrophobicContact CD1-CD1 3.94Å; F454-Y564 HydrophobicContact CD1-CD2 4.26Å; F454-Y564 HydrophobicContact CD1-CE1 4.18Å; F454-Y564 AromaticContact CD1-CE2 3.5Å; F454-Y564 HydrophobicContact CD1-CE2 3.5Å; F454-Y564 AromaticContact CE1-CD1 3.74Å; F454-Y564 HydrophobicContact CE1-CD1 3.74Å; F454-Y564 AromaticContact CE1-CD2 3.58Å; F454-Y564 HydrophobicContact CE1-CD2 3.58Å; F454-Y564 AromaticContact CE1-CE1 3.92Å; F454-Y564 HydrophobicContact CE1-CE1 3.92Å; F454-Y564 AromaticContact CE1-CE2 3.26Å; F454-Y564 HydrophobicContact CE1-CE2 3.26Å; F454-Y564 HydrophobicContact CZ-CE2 4.49Å; D458-Y564 HydrophobicContact CB-CE1 4.04Å; D458-Y564 WeakPolarHBondContact OD2-CE1 3.32Å; D458-Y564 PolarHBondContact OD2-OH 3.5Å; S561-Y564 WeakPolarHBondContact O-CB 3.23Å; S561-Y564 PolarHBondContact O-N 3.24Å; S561-Y564 VanDerWaalsContact O-N 3.12Å; K562-Y564 VanDerWaalsContact C-N 3.3Å; K562-Y564 PolarHBondContact O-N 3.34Å; Y564-Q566 VanDerWaalsContact C-N 3.25Å; Y564-Q566 PolarHBondContact O-N 3.02Å; Y564-I567 PolarHBondContact O-N 3.17Å; Y564-L568 HydrophobicContact CE1-CD1 3.64Å; Y564-L568 HydrophobicContact CE1-CD2 3.95Å; Y564-L568 HydrophobicContact CE1-CG 4.3Å; Y564-L568 WeakPolarHBondContact O-CB 3.2Å; Y564-L568 PolarHBondContact O-N 2.92Å; Y564-L568 VanDerWaalsContact O-N 3.12Å; Y564-C722 HydrophobicContact CE1-CB 3.99Å
565	V	67.6	Low	67.8	Low	19 Å²	19	50.2 Å²	50.2	12%	0.115	27%	0.269	C	S	.	.	H	α-helix	trans	-61.1	-36.4	-179.9	179.9	0	0	0	0	111.2	V553 S561 I567 L568	V553-V565 HydrophobicContact CG1-CB 4.46Å; V553-V565 HydrophobicContact CG2-CB 4.01Å; V553-V565 HydrophobicContact CG2-CG1 3.59Å; S561-V565 PolarHBondContact O-N 2.89Å; S561-V565 VanDerWaalsContact O-N 3.15Å; V565-I567 VanDerWaalsContact C-N 3.33Å; V565-I567 PolarHBondContact O-N 3.09Å; V565-L568 WeakPolarHBondContact O-CB 3.3Å; V565-L568 PolarHBondContact O-N 3.27Å
566	Q	70.6	Confident	69.8	Low	64.5 Å²	64.5	46.7 Å²	46.7	30%	0.301	24%	0.244	S	C	.	.	H	α-helix	trans	-65	-28.7	177.6	-69.1	-177.7	-7.8	0	0	113.9	T549 K562 Y564 Y642	T549-Q566 VanDerWaalsContact CG2-O 3.28Å; T549-Q566 WeakPolarHBondContact CG2-O 3.29Å; K562-Q566 PolarHBondContact O-N 2.73Å; Y564-Q566 VanDerWaalsContact C-N 3.25Å; Y564-Q566 PolarHBondContact O-N 3.02Å; Q566-Y642 HydrophobicContact CB-CE2 4.34Å; Q566-Y642 PolarHBondContact OE1-OH 2.56Å; Q566-Y642 VanDerWaalsContact OE1-OH 3.13Å
567	I	79.7	Confident	71.8	Confident	20.5 Å²	20.5	43.8 Å²	43.8	11%	0.105	22%	0.223	C	C	.	.	H	α-helix	trans	-93.8	-17.4	-177.7	-58	169.2	0	0	0	110.9	F454 S563 Y564 V565 G569 F570 L571 T638 Y642	F454-I567 HydrophobicContact CE1-CB 4.33Å; F454-I567 HydrophobicContact CE1-CD1 4.08Å; F454-I567 HydrophobicContact CE1-CG2 3.81Å; F454-I567 HydrophobicContact CE2-CG2 4.22Å; F454-I567 HydrophobicContact CZ-CB 4.48Å; F454-I567 HydrophobicContact CZ-CD1 4.14Å; F454-I567 HydrophobicContact CZ-CG2 3.56Å; S563-I567 WeakPolarHBondContact O-CD1 3.49Å; Y564-I567 PolarHBondContact O-N 3.17Å; V565-I567 VanDerWaalsContact C-N 3.33Å; V565-I567 PolarHBondContact O-N 3.09Å; I567-G569 VanDerWaalsContact C-N 3.3Å; I567-G569 PolarHBondContact O-N 3Å; I567-F570 WeakPolarHBondContact O-CA 3.46Å; I567-F570 WeakPolarHBondContact O-CB 3.43Å; I567-F570 PolarHBondContact O-N 3.07Å; I567-L571 PolarHBondContact O-N 3.27Å; I567-T638 HydrophobicContact CG2-CG2 3.49Å; I567-Y642 HydrophobicContact CD1-CD1 4.07Å; I567-Y642 HydrophobicContact CD1-CD2 4.4Å; I567-Y642 HydrophobicContact CD1-CE1 4.26Å; I567-Y642 HydrophobicContact CD1-CE2 4.48Å; I567-Y642 HydrophobicContact CD1-CG 4.09Å; I567-Y642 HydrophobicContact CG1-CD1 4.14Å; I567-Y642 HydrophobicContact CG1-CD2 3.57Å; I567-Y642 VanDerWaalsContact CG1-CD2 3.49Å; I567-Y642 HydrophobicContact CG1-CE1 4.39Å; I567-Y642 HydrophobicContact CG1-CE2 3.82Å; I567-Y642 HydrophobicContact CG1-CG 4.02Å
568	L	80.9	Confident	73.7	Confident	7 Å²	7	39.2 Å²	39.2	4%	0.037	21%	0.209	C	C	.	.	H	α-helix	trans	-59.2	-38.2	-172.4	-172.5	67.1	0	0	0	113.3	F451 Y564 V565 F570 L571 L572 L701 C722	F451-L568 HydrophobicContact CB-CD1 4.47Å; F451-L568 HydrophobicContact CE1-CD1 4.12Å; F451-L568 HydrophobicContact CE2-CD1 3.62Å; F451-L568 HydrophobicContact CZ-CD1 3.3Å; F451-L568 HydrophobicContact CZ-CG 4.32Å; Y564-L568 HydrophobicContact CE1-CD1 3.64Å; Y564-L568 HydrophobicContact CE1-CD2 3.95Å; Y564-L568 HydrophobicContact CE1-CG 4.3Å; Y564-L568 WeakPolarHBondContact O-CB 3.2Å; Y564-L568 PolarHBondContact O-N 2.92Å; Y564-L568 VanDerWaalsContact O-N 3.12Å; V565-L568 WeakPolarHBondContact O-CB 3.3Å; V565-L568 PolarHBondContact O-N 3.27Å; L568-F570 VanDerWaalsContact C-N 3.28Å; L568-F570 PolarHBondContact O-N 2.98Å; L568-L571 HydrophobicContact CD1-CD2 4.46Å; L568-L571 PolarHBondContact O-N 3.35Å; L568-L571 VanDerWaalsContact O-N 3.11Å; L568-L572 HydrophobicContact CD1-CD1 4.43Å; L568-L572 HydrophobicContact CD1-CG 4.36Å; L568-L572 HydrophobicContact CG-CD1 4.14Å; L568-L572 HydrophobicContact CG-CG 4.43Å; L568-L572 WeakPolarHBondContact O-CB 3.37Å; L568-L572 PolarHBondContact O-N 2.84Å; L568-L701 HydrophobicContact CB-CD1 4.18Å; L568-L701 HydrophobicContact CD2-CB 4.29Å; L568-L701 HydrophobicContact CD2-CD1 4.22Å; L568-L701 HydrophobicContact CD2-CD2 4.19Å; L568-L701 HydrophobicContact CD2-CG 4.4Å; L568-L701 HydrophobicContact CG-CD1 4.13Å; L568-L701 HydrophobicContact CG-CD2 4.45Å; L568-C722 HydrophobicContact CD1-CB 4.14Å; L568-C722 HydrophobicContact CD2-CB 3.45Å; L568-C722 WeakPolarHBondContact CD2-SG 3.11Å; L568-C722 HydrophobicContact CG-CB 4.28Å
569	G	85.6	Confident	75.7	Confident	0.5 Å²	0.5	36.1 Å²	36.1	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-62.8	-35.1	176.1	0	0	0	0	0	112.8	I567 G573 L701	I567-G569 VanDerWaalsContact C-N 3.3Å; I567-G569 PolarHBondContact O-N 3Å; G569-G573 WeakPolarHBondContact O-CA 3.47Å; G569-G573 PolarHBondContact O-N 3.47Å; G569-L701 VanDerWaalsContact CA-CD1 3.43Å; G569-L701 VanDerWaalsContact N-CD1 3.28Å
570	F	88.5	Confident	77.8	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-73.6	-36.3	172.8	-57.3	-41.8	0	0	0	112.5	C547 T549 I567 L568 G573 A574 V587 T638 M641 Y642	C547-F570 HydrophobicContact CB-CD1 3.75Å; C547-F570 HydrophobicContact CB-CE1 4.25Å; C547-F570 WeakPolarHBondContact O-CE1 3.03Å; T549-F570 HydrophobicContact CG2-CD2 4.27Å; T549-F570 HydrophobicContact CG2-CE1 4.08Å; T549-F570 HydrophobicContact CG2-CE2 3.31Å; T549-F570 HydrophobicContact CG2-CZ 3.35Å; T549-F570 VanDerWaalsContact CG2-CZ 3.42Å; I567-F570 WeakPolarHBondContact O-CA 3.46Å; I567-F570 WeakPolarHBondContact O-CB 3.43Å; I567-F570 PolarHBondContact O-N 3.07Å; L568-F570 VanDerWaalsContact C-N 3.28Å; L568-F570 PolarHBondContact O-N 2.98Å; F570-G573 PolarHBondContact O-N 3.25Å; F570-A574 VanDerWaalsContact O-CB 3.26Å; F570-A574 WeakPolarHBondContact O-CB 3.32Å; F570-A574 PolarHBondContact O-N 3.18Å; F570-V587 HydrophobicContact CD1-CG1 3.9Å; F570-V587 HydrophobicContact CE1-CG1 3.42Å; F570-V587 VanDerWaalsContact CE1-CG1 3.44Å; F570-V587 HydrophobicContact CZ-CG1 4.11Å; F570-T638 HydrophobicContact CB-CG2 4.07Å; F570-M641 HydrophobicContact CB-CB 4.26Å; F570-M641 HydrophobicContact CB-CE 3.99Å; F570-M641 HydrophobicContact CB-SD 4.31Å; F570-M641 HydrophobicContact CD1-CB 4.25Å; F570-M641 HydrophobicContact CD1-CE 3.91Å; F570-M641 HydrophobicContact CD2-CB 4.27Å; F570-M641 HydrophobicContact CG-CB 4.17Å; F570-M641 HydrophobicContact CG-CE 4.3Å; F570-Y642 AromaticContact CD2-CD2 3.99Å; F570-Y642 HydrophobicContact CD2-CD2 4.1Å; F570-Y642 AromaticContact CE2-CD2 3.85Å; F570-Y642 HydrophobicContact CE2-CD2 3.85Å; F570-Y642 HydrophobicContact CE2-CG 4.42Å
571	L	88.9	Confident	79.3	Confident	1 Å²	1	26.1 Å²	26.1	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-64.8	-53.7	177.3	-177.3	62	0	0	0	110.6	P450 F451 F454 L528 I567 L568 G573 A574 M575 I634 L635 T638	P450-L571 HydrophobicContact CB-CD2 4.1Å; F451-L571 HydrophobicContact CD1-CD2 4.2Å; F451-L571 HydrophobicContact CE1-CD2 3.79Å; F451-L571 HydrophobicContact CE1-CG 4.25Å; F454-L571 HydrophobicContact CB-CD1 4.43Å; F454-L571 HydrophobicContact CB-CD2 4.08Å; F454-L571 HydrophobicContact CD1-CD2 3.43Å; F454-L571 VanDerWaalsContact CD1-CD2 3.43Å; F454-L571 HydrophobicContact CD2-CD1 4.4Å; F454-L571 HydrophobicContact CD2-CD2 4.27Å; F454-L571 HydrophobicContact CE1-CD2 3.66Å; F454-L571 HydrophobicContact CE2-CD2 4.47Å; F454-L571 HydrophobicContact CG-CD2 4.01Å; F454-L571 HydrophobicContact CZ-CD2 4.2Å; L528-L571 HydrophobicContact CD2-CD1 4.45Å; I567-L571 PolarHBondContact O-N 3.27Å; L568-L571 HydrophobicContact CD1-CD2 4.46Å; L568-L571 PolarHBondContact O-N 3.35Å; L568-L571 VanDerWaalsContact O-N 3.11Å; L571-G573 VanDerWaalsContact C-N 3.28Å; L571-G573 PolarHBondContact O-N 3.07Å; L571-A574 PolarHBondContact O-N 3.13Å; L571-M575 HydrophobicContact CD1-CE 3.76Å; L571-M575 HydrophobicContact CD2-CE 4.12Å; L571-M575 HydrophobicContact CG-CE 3.78Å; L571-M575 HydrophobicContact CG-SD 4.26Å; L571-M575 WeakPolarHBondContact O-CB 3.2Å; L571-M575 WeakPolarHBondContact O-CG 3.31Å; L571-M575 PolarHBondContact O-N 2.97Å; L571-I634 HydrophobicContact CD1-CG2 4.27Å; L571-L635 HydrophobicContact CD1-CD2 4.03Å; L571-T638 HydrophobicContact CB-CG2 3.9Å; L571-T638 HydrophobicContact CD1-CG2 4.22Å
572	L	88.9	Confident	80.6	Confident	2 Å²	2	26.8 Å²	26.8	1%	0.01	14%	0.143	C	C	.	.	H	α-helix	trans	-61.6	-39.3	176.7	-72.7	172.8	0	0	0	111.5	F451 L568 M575 C576 F673 L701 D724 I726	F451-L572 HydrophobicContact CE1-CD2 3.79Å; F451-L572 HydrophobicContact CE1-CG 4.26Å; F451-L572 HydrophobicContact CE2-CD2 4.35Å; F451-L572 HydrophobicContact CZ-CD1 4.2Å; F451-L572 HydrophobicContact CZ-CD2 3.38Å; F451-L572 HydrophobicContact CZ-CG 3.67Å; L568-L572 HydrophobicContact CD1-CD1 4.43Å; L568-L572 HydrophobicContact CD1-CG 4.36Å; L568-L572 HydrophobicContact CG-CD1 4.14Å; L568-L572 HydrophobicContact CG-CG 4.43Å; L568-L572 WeakPolarHBondContact O-CB 3.37Å; L568-L572 PolarHBondContact O-N 2.84Å; L572-M575 HydrophobicContact CD2-SD 4.43Å; L572-M575 PolarHBondContact O-N 3.26Å; L572-C576 WeakPolarHBondContact O-CB 3.31Å; L572-C576 PolarHBondContact O-N 3.21Å; L572-F673 HydrophobicContact CB-CD1 3.83Å; L572-F673 HydrophobicContact CB-CD2 4.21Å; L572-F673 HydrophobicContact CB-CE1 3.85Å; L572-F673 HydrophobicContact CB-CE2 4.23Å; L572-F673 HydrophobicContact CB-CG 4.01Å; L572-F673 HydrophobicContact CB-CZ 4.05Å; L572-F673 HydrophobicContact CD1-CD1 4Å; L572-F673 HydrophobicContact CD1-CE1 4.19Å; L572-F673 HydrophobicContact CG-CD1 4.33Å; L572-F673 HydrophobicContact CG-CE1 4.35Å; L572-L701 HydrophobicContact CD1-CD1 4.44Å; L572-L701 HydrophobicContact CD1-CD2 3.62Å; L572-D724 HydrophobicContact CD2-CB 4.37Å; L572-I726 HydrophobicContact CD2-CG2 4.24Å
573	G	89.8	Confident	82.5	Confident	0 Å²	0	24 Å²	24	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-58.2	-51.4	173	0	0	0	0	0	113.2	C547 G569 F570 L571 M575 C576 T577	C547-G573 WeakPolarHBondContact SG-CA 3.3Å; G569-G573 WeakPolarHBondContact O-CA 3.47Å; G569-G573 PolarHBondContact O-N 3.47Å; F570-G573 PolarHBondContact O-N 3.25Å; L571-G573 VanDerWaalsContact C-N 3.28Å; L571-G573 PolarHBondContact O-N 3.07Å; G573-M575 VanDerWaalsContact C-N 3.31Å; G573-M575 PolarHBondContact O-N 3.15Å; G573-C576 WeakPolarHBondContact O-CB 3.38Å; G573-C576 PolarHBondContact O-N 3.07Å; G573-T577 VanDerWaalsContact O-CB 3.32Å; G573-T577 WeakPolarHBondContact O-CB 3.46Å; G573-T577 PolarHBondContact O-N 2.92Å; G573-T577 PolarHBondContact O-OG1 2.86Å
574	A	89.9	Confident	84	Confident	1 Å²	1	22 Å²	22	1%	0.008	12%	0.12	C	C	.	.	H	α-helix	trans	-64.6	-36.1	178	0	0	0	0	0	112.2	F570 L571 S578 I634 M641	F570-A574 VanDerWaalsContact O-CB 3.26Å; F570-A574 WeakPolarHBondContact O-CB 3.32Å; F570-A574 PolarHBondContact O-N 3.18Å; L571-A574 PolarHBondContact O-N 3.13Å; A574-S578 PolarHBondContact O-N 3.26Å; A574-S578 VanDerWaalsContact O-N 3.15Å; A574-S578 PolarHBondContact O-OG 3.12Å; A574-I634 HydrophobicContact CB-CG2 4.11Å; A574-M641 HydrophobicContact CB-SD 4.15Å
575	M	90.3	Very high	85.3	Confident	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-64.8	-51	174	-71.5	179.2	120.6	0	0	111.5	P450 F451 L528 M532 L536 L571 L572 G573 T577 S578 I579 I634 D724 L727	P450-M575 HydrophobicContact CB-CE 3.67Å; P450-M575 HydrophobicContact CB-SD 3.68Å; P450-M575 WeakPolarHBondContact CB-SD 3.37Å; P450-M575 HydrophobicContact CG-CE 3.18Å; P450-M575 HydrophobicContact CG-SD 3.34Å; P450-M575 WeakPolarHBondContact CG-SD 3.29Å; F451-M575 HydrophobicContact CD1-CE 4.02Å; F451-M575 HydrophobicContact CD1-SD 4.11Å; F451-M575 HydrophobicContact CE1-CE 4.07Å; F451-M575 HydrophobicContact CE1-SD 3.74Å; L528-M575 HydrophobicContact CD1-CE 4.16Å; L528-M575 HydrophobicContact CD2-CE 4.02Å; L528-M575 HydrophobicContact CG-CE 4.16Å; M532-M575 VanDerWaalsContact CE-CA 3.41Å; M532-M575 HydrophobicContact CE-CB 3.78Å; M532-M575 HydrophobicContact CE-CE 4.31Å; M532-M575 HydrophobicContact CE-CG 3.99Å; M532-M575 VanDerWaalsContact CE-O 3.25Å; M532-M575 WeakPolarHBondContact CE-O 3.47Å; M532-M575 HydrophobicContact CG-CE 3.64Å; M532-M575 HydrophobicContact SD-CB 4.08Å; M532-M575 HydrophobicContact SD-CE 3.94Å; M532-M575 HydrophobicContact SD-CG 3.61Å; M532-M575 VanDerWaalsContact SD-CG 3.54Å; M532-M575 HydrophobicContact SD-SD 4.32Å; L536-M575 HydrophobicContact CD1-CE 3.84Å; L571-M575 HydrophobicContact CD1-CE 3.76Å; L571-M575 HydrophobicContact CD2-CE 4.12Å; L571-M575 HydrophobicContact CG-CE 3.78Å; L571-M575 HydrophobicContact CG-SD 4.26Å; L571-M575 WeakPolarHBondContact O-CB 3.2Å; L571-M575 WeakPolarHBondContact O-CG 3.31Å; L571-M575 PolarHBondContact O-N 2.97Å; L572-M575 HydrophobicContact CD2-SD 4.43Å; L572-M575 PolarHBondContact O-N 3.26Å; G573-M575 VanDerWaalsContact C-N 3.31Å; G573-M575 PolarHBondContact O-N 3.15Å; M575-T577 VanDerWaalsContact C-N 3.31Å; M575-T577 PolarHBondContact O-N 3.19Å; M575-S578 WeakPolarHBondContact O-CB 3.42Å; M575-S578 PolarHBondContact O-N 3.21Å; M575-S578 PolarHBondContact O-OG 2.92Å; M575-I579 WeakPolarHBondContact O-CG1 3.31Å; M575-I579 PolarHBondContact O-N 3.18Å; M575-I579 VanDerWaalsContact O-N 3.1Å; M575-I634 HydrophobicContact CG-CG2 4.01Å; M575-D724 HydrophobicContact CE-CB 4.39Å; M575-L727 HydrophobicContact CB-CD1 3.9Å; M575-L727 HydrophobicContact CE-CD1 3.77Å; M575-L727 HydrophobicContact SD-CD1 4.38Å
576	C	89.4	Confident	86.5	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-57	-47.5	177.6	-166.7	0	0	0	0	110.4	I545 L572 G573 S578 I579 C580 F673 L727	I545-C576 HydrophobicContact CD1-CB 3.94Å; I545-C576 VanDerWaalsContact CD1-SG 3.57Å; L572-C576 WeakPolarHBondContact O-CB 3.31Å; L572-C576 PolarHBondContact O-N 3.21Å; G573-C576 WeakPolarHBondContact O-CB 3.38Å; G573-C576 PolarHBondContact O-N 3.07Å; C576-S578 PolarHBondContact O-N 2.97Å; C576-S578 VanDerWaalsContact O-N 3.09Å; C576-I579 PolarHBondContact O-N 3.14Å; C576-C580 WeakPolarHBondContact O-CB 3.49Å; C576-C580 PolarHBondContact O-N 3.21Å; C576-C580 PolarHBondContact O-SG 3.2Å; C576-F673 HydrophobicContact CB-CE2 3.74Å; C576-F673 HydrophobicContact CB-CZ 4.07Å; C576-L727 HydrophobicContact CB-CD2 3.89Å
577	T	90.6	Very high	87.5	Confident	21 Å²	21	17.3 Å²	17.3	13%	0.129	10%	0.098	C	C	.	.	H	α-helix	trans	-56.1	-33	175.2	-54.3	0	0	0	0	113	G573 M575 P583 T585 I598	G573-T577 VanDerWaalsContact O-CB 3.32Å; G573-T577 WeakPolarHBondContact O-CB 3.46Å; G573-T577 PolarHBondContact O-N 2.92Å; G573-T577 PolarHBondContact O-OG1 2.86Å; M575-T577 VanDerWaalsContact C-N 3.31Å; M575-T577 PolarHBondContact O-N 3.19Å; T577-P583 HydrophobicContact CG2-CB 3.92Å; T577-P583 HydrophobicContact CG2-CG 3.86Å; T577-P583 WeakPolarHBondContact O-CG 3.49Å; T577-T585 WeakPolarHBondContact OG1-CG2 3.22Å; T577-T585 PolarHBondContact OG1-OG1 3.29Å; T577-I598 HydrophobicContact CG2-CD1 4.37Å
578	S	86.7	Confident	87.8	Confident	50.5 Å²	50.5	16.4 Å²	16.4	35%	0.353	9%	0.094	S	C	.	.	H	α-helix	trans	-82.9	-17.3	-179.7	2	0	0	0	0	114.5	M532 A574 M575 C576 I634 R637	M532-S578 WeakPolarHBondContact CE-OG 3.25Å; A574-S578 PolarHBondContact O-N 3.26Å; A574-S578 VanDerWaalsContact O-N 3.15Å; A574-S578 PolarHBondContact O-OG 3.12Å; M575-S578 WeakPolarHBondContact O-CB 3.42Å; M575-S578 PolarHBondContact O-N 3.21Å; M575-S578 PolarHBondContact O-OG 2.92Å; C576-S578 PolarHBondContact O-N 2.97Å; C576-S578 VanDerWaalsContact O-N 3.09Å; S578-I634 WeakPolarHBondContact OG-CD1 3.41Å; S578-R637 VanDerWaalsContact OG-CZ 3.27Å; S578-R637 PolarHBondContact OG-NH1 3.31Å; S578-R637 PolarHBondContact OG-NH2 2.94Å
579	I	86.3	Confident	88	Confident	21.5 Å²	21.5	16.5 Å²	16.5	11%	0.11	10%	0.095	C	C	.	.	H	α-helix	trans	-103.2	-24.5	-177.8	-62.1	172.7	0	0	0	111.2	M532 L536 P537 I539 M575 C576 L727	M532-I579 HydrophobicContact CB-CD1 4.22Å; M532-I579 HydrophobicContact CE-CD1 3.6Å; M532-I579 HydrophobicContact CE-CG1 3.59Å; M532-I579 HydrophobicContact CG-CD1 4.38Å; L536-I579 HydrophobicContact CB-CD1 3.92Å; L536-I579 HydrophobicContact CD1-CD1 3.51Å; L536-I579 HydrophobicContact CG-CD1 4.37Å; P537-I579 WeakPolarHBondContact O-CG2 3.28Å; I539-I579 HydrophobicContact CD1-CB 4.46Å; I539-I579 HydrophobicContact CD1-CG2 4.32Å; I539-I579 HydrophobicContact CG1-CG2 4.06Å; I539-I579 PolarHBondContact N-O 2.88Å; M575-I579 WeakPolarHBondContact O-CG1 3.31Å; M575-I579 PolarHBondContact O-N 3.18Å; M575-I579 VanDerWaalsContact O-N 3.1Å; C576-I579 PolarHBondContact O-N 3.14Å; I579-L727 HydrophobicContact CD1-CD1 4.22Å
580	C	85.1	Confident	87.7	Confident	11.5 Å²	11.5	19 Å²	19	8%	0.078	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	140.4	175.5	-69.5	0	0	0	0	112.1	I539 C576 T582 P583	I539-C580 HydrophobicContact CB-CB 4.48Å; I539-C580 WeakPolarHBondContact O-CA 3.35Å; C576-C580 WeakPolarHBondContact O-CB 3.49Å; C576-C580 PolarHBondContact O-N 3.21Å; C576-C580 PolarHBondContact O-SG 3.2Å; C580-T582 VanDerWaalsContact C-N 3.31Å; C580-T582 PolarHBondContact O-N 3.42Å; C580-P583 HydrophobicContact CB-CB 3.94Å; C580-P583 HydrophobicContact CB-CG 4.33Å
581	E	78.5	Confident	86.9	Confident	80.5 Å²	80.5	24.1 Å²	24.1	38%	0.376	14%	0.135	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	-43	174.4	-68.5	174.5	166.5	0	0	112.1	I539 C540 G541	I539-E581 PolarHBondContact O-N 3.11Å; I539-E581 VanDerWaalsContact O-N 3.14Å; C540-E581 VanDerWaalsContact CA-CD 3.49Å; C540-E581 VanDerWaalsContact CA-OE2 3.27Å; C540-E581 WeakPolarHBondContact CA-OE2 3.33Å; C540-E581 PolarHBondContact SG-OE1 3.44Å; G541-E581 PolarHBondContact N-OE2 3.23Å
582	T	79.4	Confident	86.3	Confident	55.5 Å²	55.5	31.2 Å²	31.2	34%	0.34	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	71.4	-178.1	52.2	0	0	0	0	112.1	G541 S542 T543 C580 T584 H1335	G541-T582 PolarHBondContact O-OG1 3.08Å; G541-T582 VanDerWaalsContact O-OG1 3.1Å; S542-T582 WeakPolarHBondContact CA-OG1 3.34Å; S542-T582 PolarHBondContact N-OG1 3.37Å; T543-T582 PolarHBondContact N-O 3.13Å; C580-T582 VanDerWaalsContact C-N 3.31Å; C580-T582 PolarHBondContact O-N 3.42Å; T582-T584 PolarHBondContact O-N 3.44Å; T582-H1335 WeakPolarHBondContact CB-NE2 3.3Å; T582-H1335 WeakPolarHBondContact CG2-CD2 3.35Å; T582-H1335 WeakPolarHBondContact CG2-CE1 3.44Å; T582-H1335 WeakPolarHBondContact CG2-NE2 3.47Å; T582-H1335 PolarHBondContact OG1-CE1 2.86Å; T582-H1335 PolarHBondContact OG1-NE2 3.02Å
583	P	90.4	Very high	86.1	Confident	40 Å²	40	31.6 Å²	31.6	26%	0.26	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	137.6	178.3	31.4	-36.1	0	0	0	111.1	I545 T577 C580	I545-P583 HydrophobicContact CD1-CB 3.95Å; T577-P583 HydrophobicContact CG2-CB 3.92Å; T577-P583 HydrophobicContact CG2-CG 3.86Å; T577-P583 WeakPolarHBondContact O-CG 3.49Å; C580-P583 HydrophobicContact CB-CB 3.94Å; C580-P583 HydrophobicContact CB-CG 4.33Å
584	T	91.5	Very high	86	Confident	17 Å²	17	32.8 Å²	32.8	10%	0.104	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	103.9	158.3	-56.7	0	0	0	0	107.1	T543 L544 I545 T582 Y586 K665 F667	T543-T584 PolarHBondContact O-N 3.22Å; L544-T584 WeakPolarHBondContact CA-O 3.45Å; L544-T584 HydrophobicContact CD1-CG2 4.08Å; L544-T584 WeakPolarHBondContact CD1-O 3.43Å; I545-T584 PolarHBondContact N-O 3.26Å; T582-T584 PolarHBondContact O-N 3.44Å; T584-Y586 HydrophobicContact CG2-CD2 4.4Å; T584-Y586 HydrophobicContact CG2-CE2 3.78Å; T584-K665 WeakPolarHBondContact OG1-CE 3.35Å; T584-K665 PolarHBondContact OG1-NZ 3.29Å; T584-F667 HydrophobicContact CG2-CE1 4.43Å; T584-F667 HydrophobicContact CG2-CZ 4.29Å
585	T	93	Very high	86	Confident	2.5 Å²	2.5	32.9 Å²	32.9	2%	0.015	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	124.8	-170.1	-53	0	0	0	0	112.1	I545 C547 T577 I598	I545-T585 HydrophobicContact CB-CG2 4.1Å; I545-T585 HydrophobicContact CG2-CG2 4.13Å; I545-T585 CarbonylContact O-C 3.53Å; I545-T585 VanDerWaalsContact O-CA 3.29Å; I545-T585 WeakPolarHBondContact O-CA 3.37Å; C547-T585 VanDerWaalsContact SG-CG2 3.55Å; T577-T585 WeakPolarHBondContact OG1-CG2 3.22Å; T577-T585 PolarHBondContact OG1-OG1 3.29Å; T585-I598 HydrophobicContact CG2-CB 4.16Å; T585-I598 HydrophobicContact CG2-CD1 4.03Å; T585-I598 HydrophobicContact CG2-CG2 4.43Å; T585-I598 PolarHBondContact O-N 3.06Å
586	Y	92.7	Very high	86	Confident	30.5 Å²	30.5	33 Å²	33	12%	0.12	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	146.3	171.5	-71.4	-87.6	0	0	0	111	L544 I545 C547 T584 L595 P597 V656	L544-Y586 HydrophobicContact CD1-CD2 3.88Å; L544-Y586 HydrophobicContact CD1-CE2 4.04Å; I545-Y586 PolarHBondContact O-N 3.01Å; C547-Y586 PolarHBondContact N-O 3.11Å; T584-Y586 HydrophobicContact CG2-CD2 4.4Å; T584-Y586 HydrophobicContact CG2-CE2 3.78Å; Y586-L595 HydrophobicContact CD1-CB 4.05Å; Y586-L595 HydrophobicContact CG-CB 4.49Å; Y586-L595 HydrophobicContact CG-CD1 4.46Å; Y586-P597 HydrophobicContact CD1-CG 4.27Å; Y586-P597 HydrophobicContact CE1-CB 4.38Å; Y586-P597 HydrophobicContact CE1-CG 3.79Å; Y586-V656 HydrophobicContact CD1-CG1 4.12Å; Y586-V656 HydrophobicContact CD1-CG2 4.38Å; Y586-V656 HydrophobicContact CD2-CG1 4.31Å; Y586-V656 HydrophobicContact CE1-CG1 3.66Å; Y586-V656 HydrophobicContact CE1-CG2 4.08Å; Y586-V656 HydrophobicContact CE2-CG1 3.87Å; Y586-V656 HydrophobicContact CG-CG1 4.42Å; Y586-V656 VanDerWaalsContact CZ-CG1 3.47Å
587	V	90.5	Very high	86	Confident	1 Å²	1	34.7 Å²	34.7	1%	0.006	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	130.6	179.6	-173.6	0	0	0	0	109	F570 L595 T596 I598 V601 M641	F570-V587 HydrophobicContact CD1-CG1 3.9Å; F570-V587 HydrophobicContact CE1-CG1 3.42Å; F570-V587 VanDerWaalsContact CE1-CG1 3.44Å; F570-V587 HydrophobicContact CZ-CG1 4.11Å; V587-L595 WeakPolarHBondContact O-CA 3.06Å; V587-T596 PolarHBondContact N-O 3.13Å; V587-T596 PolarHBondContact O-N 3.21Å; V587-I598 HydrophobicContact CG2-CB 4.45Å; V587-I598 HydrophobicContact CG2-CG1 4.48Å; V587-V601 HydrophobicContact CB-CG2 4.31Å; V587-V601 HydrophobicContact CG2-CG2 4.18Å; V587-M641 HydrophobicContact CG1-CB 4.38Å; V587-M641 HydrophobicContact CG1-CE 4.28Å; V587-M641 HydrophobicContact CG2-CE 3.5Å; V587-M641 VanDerWaalsContact CG2-CE 3.49Å; V587-M641 HydrophobicContact CG2-CG 4.35Å
588	T	87.8	Confident	85.8	Confident	2 Å²	2	34.1 Å²	34.1	1%	0.012	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	130.4	173.6	62.3	0	0	0	0	110.8	C547 S548 Y593 N594 L595 R645	C547-T588 PolarHBondContact O-N 3.2Å; C547-T588 PolarHBondContact O-OG1 2.95Å; S548-T588 WeakPolarHBondContact CA-OG1 3.26Å; T588-Y593 HydrophobicContact CG2-CD1 3.86Å; T588-Y593 HydrophobicContact CG2-CE1 3.94Å; T588-Y593 HydrophobicContact CG2-CG 4.47Å; T588-N594 CarbonylContact C-O 3.55Å; T588-N594 WeakPolarHBondContact CA-O 3.4Å; T588-L595 HydrophobicContact CG2-CD2 3.82Å; T588-R645 WeakPolarHBondContact O-CD 3.41Å
589	V	84.1	Confident	85.6	Confident	9 Å²	9	36.7 Å²	36.7	6%	0.055	19%	0.191	C	C	.	.			trans	-88.7	-39.6	-178.7	165.2	0	0	0	0	112.2	N594 T596 R645	V589-N594 PolarHBondContact N-O 3.26Å; V589-T596 VanDerWaalsContact CG2-OG1 3.26Å; V589-T596 WeakPolarHBondContact CG2-OG1 3.39Å; V589-R645 WeakPolarHBondContact CG1-O 3.31Å; V589-R645 HydrophobicContact CG2-CB 4.45Å; V589-R645 WeakPolarHBondContact CG2-O 3.42Å
590	D	78.9	Confident	85.4	Confident	53 Å²	53	38.5 Å²	38.5	28%	0.283	20%	0.203	S	C	.	.	S	Bend	trans	-144.9	-179.8	-170.6	56.1	32.2	0	0	0	112.9	Q592 Y593 N594	D590-Q592 PolarHBondContact O-N 3.07Å; D590-Q592 WeakPolarHBondContact OD1-CA 3.42Å; D590-Q592 PolarHBondContact OD1-N 3Å; D590-Q592 VanDerWaalsContact OD1-N 3.08Å; D590-Y593 PolarHBondContact O-N 3.4Å; D590-Y593 PolarHBondContact OD1-N 3.11Å; D590-N594 VanDerWaalsContact CG-ND2 3.34Å; D590-N594 WeakPolarHBondContact OD1-CB 3.14Å; D590-N594 PolarHBondContact OD1-N 3.07Å; D590-N594 PolarHBondContact OD1-ND2 3.22Å; D590-N594 WeakPolarHBondContact OD2-CB 3.45Å; D590-N594 PolarHBondContact OD2-ND2 3.3Å
591	D	73.2	Confident	85.1	Confident	107 Å²	107	38.1 Å²	38.1	57%	0.572	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-11.4	179.5	-62.5	-38.9	0	0	0	113.1	K551 Y593	K551-D591 WeakPolarHBondContact CE-O 3.48Å; K551-D591 WeakPolarHBondContact CE-OD1 3.43Å; K551-D591 PolarHBondContact NZ-O 3.2Å; D591-Y593 VanDerWaalsContact C-N 3.32Å; D591-Y593 PolarHBondContact O-N 2.85Å
592	Q	76.3	Confident	85	Confident	150 Å²	150	36.3 Å²	36.3	70%	0.701	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.6	8.2	174.8	-66	179.6	-9.8	0	0	112.5	D590 N594	D590-Q592 PolarHBondContact O-N 3.07Å; D590-Q592 WeakPolarHBondContact OD1-CA 3.42Å; D590-Q592 PolarHBondContact OD1-N 3Å; D590-Q592 VanDerWaalsContact OD1-N 3.08Å; Q592-N594 VanDerWaalsContact C-N 3.26Å; Q592-N594 PolarHBondContact O-N 3.34Å
593	Y	83.4	Confident	84.6	Confident	10 Å²	10	41.7 Å²	41.7	4%	0.039	21%	0.207	C	C	.	.			trans	63.3	25.2	-179.4	-98	-95.8	0	0	0	114.9	S548 T588 D590 D591 L595 I653 D675 C676 H677 I680	S548-Y593 WeakPolarHBondContact CB-OH 3.33Å; S548-Y593 PolarHBondContact OG-OH 3.43Å; T588-Y593 HydrophobicContact CG2-CD1 3.86Å; T588-Y593 HydrophobicContact CG2-CE1 3.94Å; T588-Y593 HydrophobicContact CG2-CG 4.47Å; D590-Y593 PolarHBondContact O-N 3.4Å; D590-Y593 PolarHBondContact OD1-N 3.11Å; D591-Y593 VanDerWaalsContact C-N 3.32Å; D591-Y593 PolarHBondContact O-N 2.85Å; Y593-L595 PolarHBondContact O-N 3.3Å; Y593-I653 HydrophobicContact CD1-CD1 4.1Å; Y593-D675 HydrophobicContact CE2-CB 4.31Å; Y593-D675 VanDerWaalsContact OH-CA 3.26Å; Y593-D675 WeakPolarHBondContact OH-CA 3.44Å; Y593-D675 WeakPolarHBondContact OH-CB 3.37Å; Y593-D675 PolarHBondContact OH-O 3.15Å; Y593-C676 PolarHBondContact OH-N 2.88Å; Y593-H677 HydrophobicContact CD1-CB 3.78Å; Y593-H677 HydrophobicContact CD2-CB 4.19Å; Y593-H677 AromaticContact CD2-CD2 3.43Å; Y593-H677 VanDerWaalsContact CD2-CD2 3.43Å; Y593-H677 WeakPolarHBondContact CD2-CD2 3.34Å; Y593-H677 HydrophobicContact CE1-CB 3.91Å; Y593-H677 HydrophobicContact CE2-CB 4.42Å; Y593-H677 AromaticContact CE2-CD2 3.9Å; Y593-H677 HydrophobicContact CG-CB 3.97Å; Y593-H677 AromaticContact CG-CD2 3.7Å; Y593-I680 HydrophobicContact CE1-CD1 4.24Å
594	N	87.3	Confident	82.8	Confident	25.5 Å²	25.5	41.6 Å²	41.6	14%	0.136	21%	0.212	C	C	.	.			trans	-65.7	134	172.3	-65.4	-50.7	0	0	0	110.1	T588 V589 D590 Q592 S650 T651 S652	T588-N594 CarbonylContact C-O 3.55Å; T588-N594 WeakPolarHBondContact CA-O 3.4Å; V589-N594 PolarHBondContact N-O 3.26Å; D590-N594 VanDerWaalsContact CG-ND2 3.34Å; D590-N594 WeakPolarHBondContact OD1-CB 3.14Å; D590-N594 PolarHBondContact OD1-N 3.07Å; D590-N594 PolarHBondContact OD1-ND2 3.22Å; D590-N594 WeakPolarHBondContact OD2-CB 3.45Å; D590-N594 PolarHBondContact OD2-ND2 3.3Å; Q592-N594 VanDerWaalsContact C-N 3.26Å; Q592-N594 PolarHBondContact O-N 3.34Å; N594-S650 WeakPolarHBondContact CB-OG 3.25Å; N594-T651 CarbonylContact C-O 3.5Å; N594-T651 WeakPolarHBondContact CA-O 3.49Å; N594-S652 VanDerWaalsContact OD1-CA 3.24Å; N594-S652 WeakPolarHBondContact OD1-CA 3.32Å
595	L	90.6	Very high	80.6	Confident	2.5 Å²	2.5	46.8 Å²	46.8	1%	0.013	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	145.3	-170.6	-64	-179.9	0	0	0	111.7	I546 Y586 V587 T588 Y593 T651 I653 V656	I546-L595 HydrophobicContact CG2-CD2 4.19Å; Y586-L595 HydrophobicContact CD1-CB 4.05Å; Y586-L595 HydrophobicContact CG-CB 4.49Å; Y586-L595 HydrophobicContact CG-CD1 4.46Å; V587-L595 WeakPolarHBondContact O-CA 3.06Å; T588-L595 HydrophobicContact CG2-CD2 3.82Å; Y593-L595 PolarHBondContact O-N 3.3Å; L595-T651 PolarHBondContact N-O 3.06Å; L595-T651 PolarHBondContact O-N 3.2Å; L595-I653 HydrophobicContact CD1-CB 4.33Å; L595-I653 HydrophobicContact CD1-CD1 4.38Å; L595-I653 HydrophobicContact CD1-CG1 3.92Å; L595-I653 HydrophobicContact CG-CB 4.4Å; L595-V656 HydrophobicContact CB-CG2 4.01Å; L595-V656 HydrophobicContact CD1-CB 4.15Å; L595-V656 HydrophobicContact CD1-CG1 4.09Å; L595-V656 HydrophobicContact CD1-CG2 4.28Å
596	T	89.7	Confident	78	Confident	1.5 Å²	1.5	54.9 Å²	54.9	1%	0.009	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	134.4	171.4	-60.2	0	0	0	0	109.6	V587 V589 V600 V601 L648 R649 S650	V587-T596 PolarHBondContact N-O 3.13Å; V587-T596 PolarHBondContact O-N 3.21Å; V589-T596 VanDerWaalsContact CG2-OG1 3.26Å; V589-T596 WeakPolarHBondContact CG2-OG1 3.39Å; T596-V600 HydrophobicContact CG2-CB 3.7Å; T596-V600 HydrophobicContact CG2-CG1 3.73Å; T596-V600 HydrophobicContact CG2-CG2 4.5Å; T596-V601 HydrophobicContact CG2-CG2 4.14Å; T596-L648 HydrophobicContact CG2-CB 4.44Å; T596-R649 PolarHBondContact OG1-O 3.34Å; T596-S650 WeakPolarHBondContact OG1-CA 3.28Å
597	P	89.2	Confident	75.2	Confident	36.5 Å²	36.5	58.4 Å²	58.4	24%	0.237	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	141.4	174.1	-20.1	29.6	0	0	0	111.6	Y586 E599 V600 V601	Y586-P597 HydrophobicContact CD1-CG 4.27Å; Y586-P597 HydrophobicContact CE1-CB 4.38Å; Y586-P597 HydrophobicContact CE1-CG 3.79Å; P597-E599 VanDerWaalsContact CB-OE2 3.24Å; P597-E599 WeakPolarHBondContact CB-OE2 3.08Å; P597-E599 PolarHBondContact O-N 3.04Å; P597-E599 VanDerWaalsContact O-N 3.14Å; P597-V600 HydrophobicContact CB-CG2 4.25Å; P597-V600 HydrophobicContact CG-CG2 4.24Å; P597-V600 WeakPolarHBondContact O-CB 3.25Å; P597-V600 PolarHBondContact O-N 3.29Å; P597-V601 PolarHBondContact O-N 3.41Å
598	I	87.2	Confident	72.5	Confident	9 Å²	9	65.3 Å²	65.3	5%	0.046	34%	0.338	C	S	.	.	H	α-helix	trans	-57.1	-33.4	-179	-166.5	164.9	0	0	0	111.9	T577 T585 V587 V600 V601 L602 M641	T577-I598 HydrophobicContact CG2-CD1 4.37Å; T585-I598 HydrophobicContact CG2-CB 4.16Å; T585-I598 HydrophobicContact CG2-CD1 4.03Å; T585-I598 HydrophobicContact CG2-CG2 4.43Å; T585-I598 PolarHBondContact O-N 3.06Å; V587-I598 HydrophobicContact CG2-CB 4.45Å; V587-I598 HydrophobicContact CG2-CG1 4.48Å; I598-V600 VanDerWaalsContact C-N 3.26Å; I598-V600 PolarHBondContact O-N 3.36Å; I598-V601 WeakPolarHBondContact O-CB 3.29Å; I598-V601 PolarHBondContact O-N 3.09Å; I598-V601 VanDerWaalsContact O-N 3.12Å; I598-L602 HydrophobicContact CD1-CD1 4.46Å; I598-L602 HydrophobicContact CG1-CD1 4.14Å; I598-L602 HydrophobicContact CG1-CG 4.27Å; I598-L602 WeakPolarHBondContact O-CG 3.38Å; I598-L602 PolarHBondContact O-N 3.25Å; I598-L602 VanDerWaalsContact O-N 3.08Å; I598-M641 HydrophobicContact CD1-CE 4.21Å; I598-M641 HydrophobicContact CD1-SD 4.1Å
599	E	83.2	Confident	69.9	Low	105.5 Å²	105.5	72.2 Å²	72.2	49%	0.493	38%	0.375	S	S	.	.	H	α-helix	trans	-63.9	-32.4	-179.8	-55.8	76.4	-164.8	0	0	111.9	P597 L602 R603	P597-E599 VanDerWaalsContact CB-OE2 3.24Å; P597-E599 WeakPolarHBondContact CB-OE2 3.08Å; P597-E599 PolarHBondContact O-N 3.04Å; P597-E599 VanDerWaalsContact O-N 3.14Å; E599-L602 PolarHBondContact O-N 3.25Å; E599-R603 WeakPolarHBondContact O-CG 3.35Å; E599-R603 PolarHBondContact O-N 3.11Å
600	V	82.1	Confident	67.4	Low	59 Å²	59	77.9 Å²	77.9	36%	0.358	41%	0.405	S	S	.	.	H	α-helix	trans	-72.3	-39.7	176.2	177.7	0	0	0	0	110.3	T596 P597 I598 L602 R603	T596-V600 HydrophobicContact CG2-CB 3.7Å; T596-V600 HydrophobicContact CG2-CG1 3.73Å; T596-V600 HydrophobicContact CG2-CG2 4.5Å; P597-V600 HydrophobicContact CB-CG2 4.25Å; P597-V600 HydrophobicContact CG-CG2 4.24Å; P597-V600 WeakPolarHBondContact O-CB 3.25Å; P597-V600 PolarHBondContact O-N 3.29Å; I598-V600 VanDerWaalsContact C-N 3.26Å; I598-V600 PolarHBondContact O-N 3.36Å; V600-L602 VanDerWaalsContact C-N 3.27Å; V600-L602 PolarHBondContact O-N 3.28Å; V600-R603 PolarHBondContact O-N 3.23Å
601	V	78.5	Confident	65.1	Low	2 Å²	2	84 Å²	84	1%	0.012	43%	0.431	C	S	.	.	H	α-helix	trans	-60.8	-38.7	175.8	-178	0	0	0	0	111.5	V587 T596 P597 I598 M641 R644 L648	V587-V601 HydrophobicContact CB-CG2 4.31Å; V587-V601 HydrophobicContact CG2-CG2 4.18Å; T596-V601 HydrophobicContact CG2-CG2 4.14Å; P597-V601 PolarHBondContact O-N 3.41Å; I598-V601 WeakPolarHBondContact O-CB 3.29Å; I598-V601 PolarHBondContact O-N 3.09Å; I598-V601 VanDerWaalsContact O-N 3.12Å; V601-M641 HydrophobicContact CG1-CB 4.35Å; V601-M641 HydrophobicContact CG1-CG 4.06Å; V601-R644 HydrophobicContact CG1-CB 4.41Å; V601-R644 PolarHBondContact O-NH1 3.37Å; V601-L648 HydrophobicContact CB-CD1 4.01Å; V601-L648 HydrophobicContact CG1-CD1 4.06Å; V601-L648 HydrophobicContact CG2-CD1 3.75Å
602	L	76.3	Confident	63.3	Low	42.3333 Å²	42.3333	86.2 Å²	86.2	22%	0.222	44%	0.443	C	S	.	.	H	α-helix	trans	-87.3	-12.6	-177.4	-57	179.2	0	0	0	113.6	I598 E599 V600 G604 R629 M632 R637 Q640	I598-L602 HydrophobicContact CD1-CD1 4.46Å; I598-L602 HydrophobicContact CG1-CD1 4.14Å; I598-L602 HydrophobicContact CG1-CG 4.27Å; I598-L602 WeakPolarHBondContact O-CG 3.38Å; I598-L602 PolarHBondContact O-N 3.25Å; I598-L602 VanDerWaalsContact O-N 3.08Å; E599-L602 PolarHBondContact O-N 3.25Å; V600-L602 VanDerWaalsContact C-N 3.27Å; V600-L602 PolarHBondContact O-N 3.28Å; L602-G604 VanDerWaalsContact C-N 3.31Å; L602-G604 PolarHBondContact O-N 2.94Å; L602-G604 VanDerWaalsContact O-N 3.12Å; L602-R629 PolarHBondContact O-NH1 3.39Å; L602-M632 HydrophobicContact CB-CE 4.08Å; L602-M632 HydrophobicContact CD1-CE 4.31Å; L602-M632 HydrophobicContact CD2-CE 3.54Å; L602-M632 VanDerWaalsContact CD2-CE 3.45Å; L602-M632 HydrophobicContact CG-CE 4.15Å; L602-R637 HydrophobicContact CD1-CG 4.22Å; L602-R637 HydrophobicContact CD2-CB 4.28Å; L602-R637 HydrophobicContact CD2-CG 4.06Å; L602-Q640 HydrophobicContact CD2-CB 4.29Å
603	R	70.5	Confident	61.1	Low	170.333 Å²	170.333	88.4 Å²	88.4	64%	0.643	45%	0.451	S	S	*	.	S	Bend	trans	-73.6	99.3	171.1	-105.5	-178.4	-140.2	-150.1	4.9	109.1	E599 V600 N605 R644	E599-R603 WeakPolarHBondContact O-CG 3.35Å; E599-R603 PolarHBondContact O-N 3.11Å; V600-R603 PolarHBondContact O-N 3.23Å; R603-N605 PolarHBondContact O-N 3.06Å; R603-R644 PolarHBondContact O-NH1 2.81Å; R603-R644 PolarHBondContact O-NH2 2.95Å; R603-R644 VanDerWaalsContact O-NH2 3.08Å
604	G	53.5	Low	58.7	Low	37 Å²	37	95.4 Å²	95.4	38%	0.381	49%	0.489	S	S	.	.			trans	-57.6	137.2	172.1	0	0	0	0	0	111.1	L602 Q606	L602-G604 VanDerWaalsContact C-N 3.31Å; L602-G604 PolarHBondContact O-N 2.94Å; L602-G604 VanDerWaalsContact O-N 3.12Å; G604-Q606 PolarHBondContact O-N 3.25Å
605	N	45	Very low	56	Low	126.667 Å²	126.667	99.3 Å²	99.3	68%	0.677	52%	0.518	S	S	*	.			trans	-58.2	113.5	171.6	-74.2	-2	0	0	0	108.7	R603 T607 R644	R603-N605 PolarHBondContact O-N 3.06Å; N605-T607 HydrophobicContact CB-CG2 4.1Å; N605-T607 PolarHBondContact O-N 3.12Å; N605-T607 VanDerWaalsContact O-N 3.08Å; N605-R644 PolarHBondContact OD1-NH2 3.44Å
606	Q	37.6	Very low	53.3	Low	172 Å²	172	106.7 Å²	106.7	80%	0.804	56%	0.557	S	S	*	*			trans	-81.8	75.9	156.5	-74.4	175.9	-26.8	0	0	106.3	G604 L608 R629	G604-Q606 PolarHBondContact O-N 3.25Å; Q606-L608 PolarHBondContact O-N 3.4Å; Q606-L608 VanDerWaalsContact O-N 3.12Å; Q606-R629 VanDerWaalsContact OE1-NH2 3.15Å
607	T	34.8	Very low	50.3	Low	104.667 Å²	104.667	116 Å²	116	64%	0.642	60%	0.598	S	S	*	*			trans	-97.9	98.2	169.7	41.3	0	0	0	0	107.7	N605 N609	N605-T607 HydrophobicContact CB-CG2 4.1Å; N605-T607 PolarHBondContact O-N 3.12Å; N605-T607 VanDerWaalsContact O-N 3.08Å; T607-N609 PolarHBondContact O-N 3.33Å
608	L	33.3	Very low	47.5	Very low	146.667 Å²	146.667	119.5 Å²	119.5	77%	0.768	62%	0.623	S	S	*	*			trans	-82.5	66.3	160	-114.9	116	0	0	0	109.3	Q606 N610	Q606-L608 PolarHBondContact O-N 3.4Å; Q606-L608 VanDerWaalsContact O-N 3.12Å; L608-N610 WeakPolarHBondContact CD2-ND2 3.48Å; L608-N610 PolarHBondContact O-N 3.09Å; L608-N610 VanDerWaalsContact O-N 3.14Å
609	N	32.3	Very low	44.8	Very low	145.667 Å²	145.667	122.1 Å²	122.1	78%	0.779	65%	0.651	S	S	*	*			trans	-100.4	76.9	163.2	-79.8	-1.8	0	0	0	107.1	T607 H611	T607-N609 PolarHBondContact O-N 3.33Å; N609-H611 VanDerWaalsContact C-N 3.34Å; N609-H611 PolarHBondContact O-N 3.23Å
610	N	31.9	Very low	42.1	Very low	129 Å²	129	128.2 Å²	128.2	69%	0.69	67%	0.67	S	S	*	*			trans	-93.5	96.5	158.7	-85.1	1.4	0	0	0	106.7	L608	L608-N610 WeakPolarHBondContact CD2-ND2 3.48Å; L608-N610 PolarHBondContact O-N 3.09Å; L608-N610 VanDerWaalsContact O-N 3.14Å
611	H	31.9	Very low	39.7	Very low	180.667 Å²	180.667	132.9 Å²	132.9	84%	0.836	69%	0.685	S	S	*	*			trans	-159.6	88.8	146.7	-73.6	-64.5	0	0	0	105.9	N609	N609-H611 VanDerWaalsContact C-N 3.34Å; N609-H611 PolarHBondContact O-N 3.23Å
612	D	33.7	Very low	37.6	Very low	154.333 Å²	154.333	140.7 Å²	140.7	83%	0.825	72%	0.722	S	S	*	*				-156.5	127.8	110.9	-86.3	-35.7	0	0	0	108.7	D614	D612-D614 PolarHBondContact O-N 3.16Å
613	K	31.4	Very low	35.3	Very low	195.667 Å²	195.667	145.3 Å²	145.3	85%	0.851	75%	0.746	S	S	*	*			trans	-66.9	117.8	168.7	-65	172.8	175.9	178.4	0	107
614	D	33.4	Very low	33.5	Very low	156.333 Å²	156.333	143.4 Å²	143.4	84%	0.836	75%	0.745	S	S	*	*			trans	175.3	124.6	134.5	-84.4	-20.1	0	0	0	110.1	D612 D616	D612-D614 PolarHBondContact O-N 3.16Å; D614-D616 PolarHBondContact O-N 2.85Å
615	S	30.5	Very low	32.6	Very low	108.333 Å²	108.333	150 Å²	150	76%	0.758	76%	0.759	S	S	*	*			trans	-48.5	117.3	176.5	54.7	0	0	0	0	114.4	F617	S615-F617 PolarHBondContact O-N 3.44Å; S615-F617 VanDerWaalsContact O-N 3.15Å
616	D	32.1	Very low	31.9	Very low	157 Å²	157	153.7 Å²	153.7	84%	0.84	76%	0.764	S	S	*	*			trans	22.7	81.1	144.1	-70.1	-30.9	0	0	0	115.6	D614	D614-D616 PolarHBondContact O-N 2.85Å
617	F	28.2	Very low	32	Very low	197.333 Å²	197.333	149.9 Å²	149.9	87%	0.865	76%	0.756	S	S	*	*			trans	-157.9	94.9	146.6	-130.4	-97.9	0	0	0	110.8	S615 G619	S615-F617 PolarHBondContact O-N 3.44Å; S615-F617 VanDerWaalsContact O-N 3.15Å; F617-G619 PolarHBondContact O-N 3.04Å; F617-G619 VanDerWaalsContact O-N 3.14Å
618	C	29.6	Very low	32.2	Very low	111 Å²	111	151.8 Å²	151.8	75%	0.75	76%	0.755	S	S	*	*			trans	-127.6	60.9	173.5	-157.2	0	0	0	0	113.3	W620	C618-W620 PolarHBondContact O-N 3.45Å
619	G	29.8	Very low	32.7	Very low	62 Å²	62	151.7 Å²	151.7	64%	0.639	75%	0.745	S	S	*	*			trans	-102.5	29.3	169.9	0	0	0	0	0	113.6	F617	F617-G619 PolarHBondContact O-N 3.04Å; F617-G619 VanDerWaalsContact O-N 3.14Å
620	W	28.5	Very low	33.3	Very low	234 Å²	234	154.1 Å²	154.1	89%	0.886	75%	0.749	S	S	*	*	S	Bend	trans	-99.2	16.2	-178.8	-71.6	60.3	0	0	0	116.2	C618	C618-W620 PolarHBondContact O-N 3.45Å
621	K	31.1	Very low	34.3	Very low	158.667 Å²	158.667	152.8 Å²	152.8	69%	0.69	75%	0.749	S	S	*	*	H	α-helix	trans	-118.3	11.7	174.7	-87.5	178.3	-176.2	176.9	0	116.3	Y625	K621-Y625 WeakPolarHBondContact O-CD2 3.49Å
622	Q	33.2	Very low	36.1	Very low	164.667 Å²	164.667	146.3 Å²	146.3	77%	0.769	72%	0.72	S	S	*	*	S	Bend	trans	-81.4	-22.3	176.5	-76.2	-170.1	3.8	0	0	114.2	R626	Q622-R626 PolarHBondContact O-N 3.27Å
623	N	29.9	Very low	38.2	Very low	138.667 Å²	138.667	139.5 Å²	139.5	74%	0.742	69%	0.687	S	S	*	*	H	α-helix	trans	-85.5	-23.8	-175.5	-79	-17.2	0	0	0	114.9	Y625 R626 S627	N623-Y625 VanDerWaalsContact C-N 3.34Å; N623-Y625 PolarHBondContact O-N 3.13Å; N623-R626 PolarHBondContact O-N 3.21Å; N623-S627 PolarHBondContact O-N 3.18Å
624	E	32	Very low	40.8	Very low	131.333 Å²	131.333	130.5 Å²	130.5	61%	0.614	65%	0.648	S	S	*	*	H	α-helix	trans	-78	-25.4	178.5	-80.1	-168.5	139.7	0	0	114.2	K628	E624-K628 PolarHBondContact O-N 3.17Å; E624-K628 VanDerWaalsContact O-N 3.1Å
625	Y	33.3	Very low	43.4	Very low	175 Å²	175	123.7 Å²	123.7	69%	0.686	61%	0.611	S	S	*	*	H	α-helix	trans	-83.7	-21.8	-177.7	-91.6	-88	0	0	0	114.2	K621 N623 K628 R629	K621-Y625 WeakPolarHBondContact O-CD2 3.49Å; N623-Y625 VanDerWaalsContact C-N 3.34Å; N623-Y625 PolarHBondContact O-N 3.13Å; Y625-K628 PolarHBondContact O-N 3.22Å; Y625-R629 PolarHBondContact O-N 2.91Å
626	R	31.5	Very low	45.9	Very low	205.667 Å²	205.667	121.8 Å²	121.8	78%	0.776	59%	0.59	S	S	*	*	H	α-helix	trans	-72.9	-28	175.1	-111.7	179.4	176	178.1	-0.8	112.4	Q622 N623	Q622-R626 PolarHBondContact O-N 3.27Å; N623-R626 PolarHBondContact O-N 3.21Å
627	S	38.9	Very low	48.4	Very low	91 Å²	91	117.2 Å²	117.2	64%	0.636	56%	0.561	S	S	*	*	H	α-helix	trans	-74	-36	178.3	-48	0	0	0	0	113.7	N623 R629 K630	N623-S627 PolarHBondContact O-N 3.18Å; S627-R629 VanDerWaalsContact C-N 3.26Å; S627-R629 PolarHBondContact O-N 3.36Å; S627-K630 PolarHBondContact O-N 2.88Å; S627-K630 VanDerWaalsContact O-N 3.16Å
628	K	39.6	Very low	51.2	Low	144 Å²	144	108 Å²	108	63%	0.626	52%	0.521	S	S	*	.	H	α-helix	trans	-71.3	-17.9	-179.3	-84.7	178.7	177.6	169.9	0	115.2	E624 Y625 K630 S631	E624-K628 PolarHBondContact O-N 3.17Å; E624-K628 VanDerWaalsContact O-N 3.1Å; Y625-K628 PolarHBondContact O-N 3.22Å; K628-K630 PolarHBondContact O-N 3Å; K628-S631 PolarHBondContact O-N 2.7Å
629	R	42.9	Very low	53.8	Low	145.333 Å²	145.333	105.9 Å²	105.9	55%	0.548	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-20.6	178.6	-75.8	-170.7	-177	178.7	4.4	114.1	L602 Q606 Y625 S627 S631	L602-R629 PolarHBondContact O-NH1 3.39Å; Q606-R629 VanDerWaalsContact OE1-NH2 3.15Å; Y625-R629 PolarHBondContact O-N 2.91Å; S627-R629 VanDerWaalsContact C-N 3.26Å; S627-R629 PolarHBondContact O-N 3.36Å; R629-S631 VanDerWaalsContact C-N 3.29Å; R629-S631 PolarHBondContact O-N 3.02Å
630	K	45.1	Very low	56.3	Low	197 Å²	197	105 Å²	105	86%	0.857	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-15.5	178.5	-90.8	-175.4	175.5	-178.4	0	113.8	S627 K628	S627-K630 PolarHBondContact O-N 2.88Å; S627-K630 VanDerWaalsContact O-N 3.16Å; K628-K630 PolarHBondContact O-N 3Å
631	S	52.9	Low	58.9	Low	100 Å²	100	93.9 Å²	93.9	70%	0.699	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.1	9.3	-173.9	83.3	0	0	0	0	115.4	K628 R629 G633	K628-S631 PolarHBondContact O-N 2.7Å; R629-S631 VanDerWaalsContact C-N 3.29Å; R629-S631 PolarHBondContact O-N 3.02Å; S631-G633 PolarHBondContact O-N 3.05Å; S631-G633 VanDerWaalsContact O-N 3.14Å
632	M	69.6	Low	61.4	Low	44 Å²	44	88.5 Å²	88.5	22%	0.217	41%	0.412	C	S	.	.			trans	-77.6	108.6	-178.6	-160	163.8	74.9	0	0	110.6	L602 E636 R637 Q640	L602-M632 HydrophobicContact CB-CE 4.08Å; L602-M632 HydrophobicContact CD1-CE 4.31Å; L602-M632 HydrophobicContact CD2-CE 3.54Å; L602-M632 VanDerWaalsContact CD2-CE 3.45Å; L602-M632 HydrophobicContact CG-CE 4.15Å; M632-E636 HydrophobicContact CG-CB 4.06Å; M632-E636 HydrophobicContact CG-CG 4.15Å; M632-E636 HydrophobicContact SD-CG 4.11Å; M632-R637 HydrophobicContact CB-CG 4.39Å; M632-R637 HydrophobicContact CE-CB 4.4Å; M632-R637 HydrophobicContact CE-CG 3.89Å; M632-R637 HydrophobicContact CG-CG 4.15Å; M632-R637 VanDerWaalsContact O-CZ 3.26Å; M632-R637 PolarHBondContact O-NE 3.16Å; M632-R637 PolarHBondContact O-NH2 3.25Å; M632-R637 VanDerWaalsContact O-NH2 3.09Å; M632-Q640 HydrophobicContact CE-CB 4.28Å; M632-Q640 HydrophobicContact CE-CG 3.96Å; M632-Q640 VanDerWaalsContact CE-OE1 3.29Å; M632-Q640 PolarHBondContact SD-NE2 2.94Å; M632-Q640 PolarHBondContact SD-OE1 2.62Å
633	G	79	Confident	63.6	Low	13 Å²	13	86.7 Å²	86.7	13%	0.134	40%	0.402	C	S	.	.			trans	-66	160.6	-175.3	0	0	0	0	0	114.3	E529 S631 L635 E636 R637	E529-G633 WeakPolarHBondContact OE1-CA 3.44Å; S631-G633 PolarHBondContact O-N 3.05Å; S631-G633 VanDerWaalsContact O-N 3.14Å; G633-L635 VanDerWaalsContact C-N 3.31Å; G633-L635 PolarHBondContact O-N 3Å; G633-L635 VanDerWaalsContact O-N 3.17Å; G633-E636 PolarHBondContact O-N 2.95Å; G633-E636 VanDerWaalsContact O-N 3.13Å; G633-R637 WeakPolarHBondContact O-CG 3.2Å; G633-R637 PolarHBondContact O-N 3.04Å
634	I	86.7	Confident	66	Low	7 Å²	7	83.1 Å²	83.1	4%	0.036	38%	0.378	C	S	.	.	H	α-helix	trans	-57.7	-41	-171.2	-79.3	146.9	0	0	0	112.6	L528 E529 M532 L571 A574 M575 S578 E636 R637 T638	L528-I634 HydrophobicContact CD2-CB 4.05Å; L528-I634 HydrophobicContact CD2-CD1 3.95Å; L528-I634 HydrophobicContact CD2-CG2 4.03Å; E529-I634 HydrophobicContact CG-CD1 4.05Å; E529-I634 HydrophobicContact CG-CG1 4.38Å; E529-I634 PolarHBondContact OE1-N 2.91Å; M532-I634 HydrophobicContact CE-CD1 3.44Å; M532-I634 VanDerWaalsContact CE-CD1 3.44Å; M532-I634 HydrophobicContact SD-CD1 3.23Å; M532-I634 WeakPolarHBondContact SD-CD1 3.47Å; M532-I634 HydrophobicContact SD-CG1 4.5Å; L571-I634 HydrophobicContact CD1-CG2 4.27Å; A574-I634 HydrophobicContact CB-CG2 4.11Å; M575-I634 HydrophobicContact CG-CG2 4.01Å; S578-I634 WeakPolarHBondContact OG-CD1 3.41Å; I634-E636 VanDerWaalsContact C-N 3.33Å; I634-E636 PolarHBondContact O-N 2.87Å; I634-R637 VanDerWaalsContact CG1-NH2 3.31Å; I634-R637 WeakPolarHBondContact O-CB 3.45Å; I634-R637 PolarHBondContact O-N 3.29Å; I634-T638 WeakPolarHBondContact O-CB 3.34Å; I634-T638 PolarHBondContact O-N 3.03Å; I634-T638 PolarHBondContact O-OG1 3.15Å
635	L	86.7	Confident	68.1	Low	12.3333 Å²	12.3333	78 Å²	78	7%	0.065	35%	0.353	C	S	.	.	H	α-helix	trans	-65.8	-38.8	179.4	-65.7	177.3	0	0	0	111.7	F454 F457 L524 L528 L571 G633 T638 K639	F454-L635 HydrophobicContact CB-CD2 3.87Å; F454-L635 HydrophobicContact CD2-CD2 3.73Å; F454-L635 HydrophobicContact CE2-CD2 3.95Å; F454-L635 HydrophobicContact CG-CD2 4.45Å; F457-L635 HydrophobicContact CB-CD1 4.15Å; F457-L635 HydrophobicContact CD1-CB 4.08Å; F457-L635 HydrophobicContact CD1-CD1 4.1Å; F457-L635 HydrophobicContact CD2-CB 4.01Å; F457-L635 HydrophobicContact CD2-CD1 3.67Å; F457-L635 HydrophobicContact CE1-CB 4.14Å; F457-L635 HydrophobicContact CE1-CD1 4.19Å; F457-L635 HydrophobicContact CE2-CB 4.06Å; F457-L635 HydrophobicContact CE2-CD1 4.06Å; F457-L635 HydrophobicContact CG-CB 4Å; F457-L635 HydrophobicContact CG-CD1 3.85Å; F457-L635 HydrophobicContact CZ-CB 4.11Å; F457-L635 HydrophobicContact CZ-CD1 3.98Å; L524-L635 HydrophobicContact CB-CD1 4.21Å; L528-L635 HydrophobicContact CD1-CD1 4.47Å; L528-L635 HydrophobicContact CD1-CD2 3.87Å; L528-L635 HydrophobicContact CD1-CG 4.24Å; L528-L635 HydrophobicContact CD2-CD2 3.46Å; L528-L635 VanDerWaalsContact CD2-CD2 3.46Å; L528-L635 HydrophobicContact CD2-CG 3.77Å; L571-L635 HydrophobicContact CD1-CD2 4.03Å; G633-L635 VanDerWaalsContact C-N 3.31Å; G633-L635 PolarHBondContact O-N 3Å; G633-L635 VanDerWaalsContact O-N 3.17Å; L635-T638 PolarHBondContact O-N 3.13Å; L635-K639 VanDerWaalsContact O-CB 3.24Å; L635-K639 WeakPolarHBondContact O-CB 3.27Å; L635-K639 PolarHBondContact O-N 3.41Å
636	E	83.6	Confident	70	Confident	69.3333 Å²	69.3333	77.6 Å²	77.6	32%	0.324	36%	0.355	S	S	.	.	H	α-helix	trans	-72	-38.3	177.6	-160.5	62.8	-142.2	0	0	111.1	F457 K521 M632 G633 I634 T638 K639 Q640	F457-E636 HydrophobicContact CZ-CB 4.27Å; F457-E636 VanDerWaalsContact CZ-OE2 3.28Å; F457-E636 WeakPolarHBondContact CZ-OE2 3.5Å; K521-E636 IonicContact NZ-OE2 2.82Å; K521-E636 PolarHBondContact NZ-OE2 3.47Å; M632-E636 HydrophobicContact CG-CB 4.06Å; M632-E636 HydrophobicContact CG-CG 4.15Å; M632-E636 HydrophobicContact SD-CG 4.11Å; G633-E636 PolarHBondContact O-N 2.95Å; G633-E636 VanDerWaalsContact O-N 3.13Å; I634-E636 VanDerWaalsContact C-N 3.33Å; I634-E636 PolarHBondContact O-N 2.87Å; E636-T638 PolarHBondContact O-N 3.39Å; E636-K639 PolarHBondContact O-N 3.16Å; E636-K639 IonicContact OE1-NZ 2.75Å; E636-K639 PolarHBondContact OE1-NZ 2.97Å; E636-K639 WeakPolarHBondContact OE2-CD 3.4Å; E636-K639 IonicContact OE2-NZ 3.41Å; E636-K639 PolarHBondContact OE2-NZ 2.87Å; E636-Q640 WeakPolarHBondContact O-CG 3.36Å; E636-Q640 PolarHBondContact O-N 3.13Å
637	R	84.5	Confident	72	Confident	59.6667 Å²	59.6667	72.2 Å²	72.2	23%	0.225	35%	0.348	C	S	.	.	H	α-helix	trans	-57.3	-50	170.7	-72.4	-175.5	-147.1	159.6	5.2	111.4	S578 L602 M632 G633 I634 K639 Q640 M641	S578-R637 VanDerWaalsContact OG-CZ 3.27Å; S578-R637 PolarHBondContact OG-NH1 3.31Å; S578-R637 PolarHBondContact OG-NH2 2.94Å; L602-R637 HydrophobicContact CD1-CG 4.22Å; L602-R637 HydrophobicContact CD2-CB 4.28Å; L602-R637 HydrophobicContact CD2-CG 4.06Å; M632-R637 HydrophobicContact CB-CG 4.39Å; M632-R637 HydrophobicContact CE-CB 4.4Å; M632-R637 HydrophobicContact CE-CG 3.89Å; M632-R637 HydrophobicContact CG-CG 4.15Å; M632-R637 VanDerWaalsContact O-CZ 3.26Å; M632-R637 PolarHBondContact O-NE 3.16Å; M632-R637 PolarHBondContact O-NH2 3.25Å; M632-R637 VanDerWaalsContact O-NH2 3.09Å; G633-R637 WeakPolarHBondContact O-CG 3.2Å; G633-R637 PolarHBondContact O-N 3.04Å; I634-R637 VanDerWaalsContact CG1-NH2 3.31Å; I634-R637 WeakPolarHBondContact O-CB 3.45Å; I634-R637 PolarHBondContact O-N 3.29Å; R637-K639 VanDerWaalsContact C-N 3.28Å; R637-K639 PolarHBondContact O-N 2.98Å; R637-Q640 PolarHBondContact O-N 3.29Å; R637-Q640 VanDerWaalsContact O-N 3.15Å; R637-M641 VanDerWaalsContact O-CG 3.27Å; R637-M641 WeakPolarHBondContact O-CG 3.16Å; R637-M641 PolarHBondContact O-N 3.43Å
638	T	86.6	Confident	73.7	Confident	3.33333 Å²	3.33333	69.2 Å²	69.2	2%	0.02	33%	0.325	C	S	.	.	H	α-helix	trans	-57.3	-43.8	178.7	-55.4	0	0	0	0	111.4	F454 I567 F570 L571 I634 L635 E636 M641 Y642	F454-T638 HydrophobicContact CD2-CG2 4.16Å; F454-T638 HydrophobicContact CE2-CG2 3.77Å; F454-T638 HydrophobicContact CZ-CG2 4.37Å; I567-T638 HydrophobicContact CG2-CG2 3.49Å; F570-T638 HydrophobicContact CB-CG2 4.07Å; L571-T638 HydrophobicContact CB-CG2 3.9Å; L571-T638 HydrophobicContact CD1-CG2 4.22Å; I634-T638 WeakPolarHBondContact O-CB 3.34Å; I634-T638 PolarHBondContact O-N 3.03Å; I634-T638 PolarHBondContact O-OG1 3.15Å; L635-T638 PolarHBondContact O-N 3.13Å; E636-T638 PolarHBondContact O-N 3.39Å; T638-M641 PolarHBondContact O-N 3.33Å; T638-Y642 PolarHBondContact O-N 3.04Å
639	K	83.6	Confident	75.4	Confident	67 Å²	67	73.5 Å²	73.5	29%	0.291	34%	0.337	S	S	.	.	H	α-helix	trans	-66.4	-40	178	-173.5	177.9	174.5	-176.3	0	112.3	F457 D458 D461 L635 E636 R637 Y642 K643	F457-K639 HydrophobicContact CE1-CD 4.27Å; D458-K639 IonicContact OD1-NZ 2.84Å; D458-K639 PolarHBondContact OD1-NZ 3.21Å; D461-K639 VanDerWaalsContact CB-NZ 3.31Å; D461-K639 WeakPolarHBondContact OD2-CE 2.98Å; D461-K639 IonicContact OD2-NZ 3.23Å; D461-K639 PolarHBondContact OD2-NZ 2.93Å; L635-K639 VanDerWaalsContact O-CB 3.24Å; L635-K639 WeakPolarHBondContact O-CB 3.27Å; L635-K639 PolarHBondContact O-N 3.41Å; E636-K639 PolarHBondContact O-N 3.16Å; E636-K639 IonicContact OE1-NZ 2.75Å; E636-K639 PolarHBondContact OE1-NZ 2.97Å; E636-K639 WeakPolarHBondContact OE2-CD 3.4Å; E636-K639 IonicContact OE2-NZ 3.41Å; E636-K639 PolarHBondContact OE2-NZ 2.87Å; R637-K639 VanDerWaalsContact C-N 3.28Å; R637-K639 PolarHBondContact O-N 2.98Å; K639-Y642 PolarHBondContact O-N 3.35Å; K639-K643 VanDerWaalsContact CE-CE 3.5Å; K639-K643 HydrophobicContact CG-CD 4.24Å; K639-K643 WeakPolarHBondContact O-CB 3.24Å; K639-K643 WeakPolarHBondContact O-CG 3.38Å; K639-K643 PolarHBondContact O-N 3.12Å
640	Q	82.9	Confident	77.1	Confident	44 Å²	44	69 Å²	69	21%	0.206	33%	0.328	C	S	.	.	H	α-helix	trans	-66.3	-41.5	174.8	-74.7	-163	12	0	0	112.1	L602 M632 E636 R637 Y642 K643 R644	L602-Q640 HydrophobicContact CD2-CB 4.29Å; M632-Q640 HydrophobicContact CE-CB 4.28Å; M632-Q640 HydrophobicContact CE-CG 3.96Å; M632-Q640 VanDerWaalsContact CE-OE1 3.29Å; M632-Q640 PolarHBondContact SD-NE2 2.94Å; M632-Q640 PolarHBondContact SD-OE1 2.62Å; E636-Q640 WeakPolarHBondContact O-CG 3.36Å; E636-Q640 PolarHBondContact O-N 3.13Å; R637-Q640 PolarHBondContact O-N 3.29Å; R637-Q640 VanDerWaalsContact O-N 3.15Å; Q640-Y642 VanDerWaalsContact C-N 3.32Å; Q640-Y642 PolarHBondContact O-N 3.1Å; Q640-K643 PolarHBondContact O-N 3.27Å; Q640-R644 VanDerWaalsContact O-CB 3.31Å; Q640-R644 WeakPolarHBondContact O-CB 3.48Å; Q640-R644 PolarHBondContact O-N 3.11Å
641	M	84.2	Confident	79	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-55.4	-49.6	173.1	-67.3	163.6	78.8	0	0	110.5	C547 F570 A574 V587 I598 V601 R637 T638 R645	C547-M641 HydrophobicContact CB-CE 4.04Å; F570-M641 HydrophobicContact CB-CB 4.26Å; F570-M641 HydrophobicContact CB-CE 3.99Å; F570-M641 HydrophobicContact CB-SD 4.31Å; F570-M641 HydrophobicContact CD1-CB 4.25Å; F570-M641 HydrophobicContact CD1-CE 3.91Å; F570-M641 HydrophobicContact CD2-CB 4.27Å; F570-M641 HydrophobicContact CG-CB 4.17Å; F570-M641 HydrophobicContact CG-CE 4.3Å; A574-M641 HydrophobicContact CB-SD 4.15Å; V587-M641 HydrophobicContact CG1-CB 4.38Å; V587-M641 HydrophobicContact CG1-CE 4.28Å; V587-M641 HydrophobicContact CG2-CE 3.5Å; V587-M641 VanDerWaalsContact CG2-CE 3.49Å; V587-M641 HydrophobicContact CG2-CG 4.35Å; I598-M641 HydrophobicContact CD1-CE 4.21Å; I598-M641 HydrophobicContact CD1-SD 4.1Å; V601-M641 HydrophobicContact CG1-CB 4.35Å; V601-M641 HydrophobicContact CG1-CG 4.06Å; R637-M641 VanDerWaalsContact O-CG 3.27Å; R637-M641 WeakPolarHBondContact O-CG 3.16Å; R637-M641 PolarHBondContact O-N 3.43Å; T638-M641 PolarHBondContact O-N 3.33Å; M641-R645 VanDerWaalsContact O-CB 3.26Å; M641-R645 WeakPolarHBondContact O-CB 3.39Å; M641-R645 PolarHBondContact O-N 2.92Å
642	Y	81.7	Confident	80.6	Confident	45.6667 Å²	45.6667	58.6 Å²	58.6	18%	0.179	28%	0.278	C	S	.	.	H	α-helix	trans	-64.6	-48.4	178.5	-170.6	-90.9	0	0	0	112.7	W103 Q566 I567 F570 T638 K639 Q640 R644 R645	W103-Y642 AromaticContact CE3-CD1 3.73Å; W103-Y642 HydrophobicContact CE3-CD1 3.73Å; W103-Y642 AromaticContact CE3-CE1 3.68Å; W103-Y642 HydrophobicContact CE3-CE1 3.68Å; W103-Y642 HydrophobicContact CH2-CD1 4.34Å; W103-Y642 AromaticContact CZ3-CD1 3.22Å; W103-Y642 HydrophobicContact CZ3-CD1 3.22Å; W103-Y642 AromaticContact CZ3-CE1 3.42Å; W103-Y642 HydrophobicContact CZ3-CE1 3.42Å; W103-Y642 VanDerWaalsContact CZ3-CE1 3.42Å; W103-Y642 HydrophobicContact CZ3-CG 4.1Å; Q566-Y642 HydrophobicContact CB-CE2 4.34Å; Q566-Y642 PolarHBondContact OE1-OH 2.56Å; Q566-Y642 VanDerWaalsContact OE1-OH 3.13Å; I567-Y642 HydrophobicContact CD1-CD1 4.07Å; I567-Y642 HydrophobicContact CD1-CD2 4.4Å; I567-Y642 HydrophobicContact CD1-CE1 4.26Å; I567-Y642 HydrophobicContact CD1-CE2 4.48Å; I567-Y642 HydrophobicContact CD1-CG 4.09Å; I567-Y642 HydrophobicContact CG1-CD1 4.14Å; I567-Y642 HydrophobicContact CG1-CD2 3.57Å; I567-Y642 VanDerWaalsContact CG1-CD2 3.49Å; I567-Y642 HydrophobicContact CG1-CE1 4.39Å; I567-Y642 HydrophobicContact CG1-CE2 3.82Å; I567-Y642 HydrophobicContact CG1-CG 4.02Å; F570-Y642 AromaticContact CD2-CD2 3.99Å; F570-Y642 HydrophobicContact CD2-CD2 4.1Å; F570-Y642 AromaticContact CE2-CD2 3.85Å; F570-Y642 HydrophobicContact CE2-CD2 3.85Å; F570-Y642 HydrophobicContact CE2-CG 4.42Å; T638-Y642 PolarHBondContact O-N 3.04Å; K639-Y642 PolarHBondContact O-N 3.35Å; Q640-Y642 VanDerWaalsContact C-N 3.32Å; Q640-Y642 PolarHBondContact O-N 3.1Å; Y642-R644 PolarHBondContact O-N 3.41Å; Y642-R645 VanDerWaalsContact CD1-NH1 3.3Å; Y642-R645 VanDerWaalsContact CZ-NH1 3.3Å; Y642-R645 WeakPolarHBondContact O-CG 3.35Å; Y642-R645 PolarHBondContact O-NH1 2.81Å
643	K	81.4	Confident	81.4	Confident	128.333 Å²	128.333	56.8 Å²	56.8	56%	0.558	27%	0.27	S	S	*	.	H	α-helix	trans	-69.1	-42.7	-174.7	-83	-173.1	173.9	-170.5	0	113.5	W103 K639 Q640	W103-K643 HydrophobicContact CD2-CD 4.25Å; W103-K643 HydrophobicContact CD2-CG 4Å; W103-K643 HydrophobicContact CE3-CD 4.48Å; W103-K643 HydrophobicContact CE3-CG 3.74Å; W103-K643 HydrophobicContact CH2-CG 4.37Å; W103-K643 VanDerWaalsContact CZ2-CE 3.48Å; W103-K643 HydrophobicContact CZ3-CG 3.96Å; K639-K643 VanDerWaalsContact CE-CE 3.5Å; K639-K643 HydrophobicContact CG-CD 4.24Å; K639-K643 WeakPolarHBondContact O-CB 3.24Å; K639-K643 WeakPolarHBondContact O-CG 3.38Å; K639-K643 PolarHBondContact O-N 3.12Å; Q640-K643 PolarHBondContact O-N 3.27Å
644	R	79.6	Confident	81.7	Confident	62 Å²	62	58.4 Å²	58.4	23%	0.234	28%	0.277	C	S	.	.	H	α-helix	trans	-88.4	-17.1	-170.6	-65.8	-175.1	100.9	-177.8	1.5	113.6	V601 R603 N605 Q640 Y642 K646 S647 L648	V601-R644 HydrophobicContact CG1-CB 4.41Å; V601-R644 PolarHBondContact O-NH1 3.37Å; R603-R644 PolarHBondContact O-NH1 2.81Å; R603-R644 PolarHBondContact O-NH2 2.95Å; R603-R644 VanDerWaalsContact O-NH2 3.08Å; N605-R644 PolarHBondContact OD1-NH2 3.44Å; Q640-R644 VanDerWaalsContact O-CB 3.31Å; Q640-R644 WeakPolarHBondContact O-CB 3.48Å; Q640-R644 PolarHBondContact O-N 3.11Å; Y642-R644 PolarHBondContact O-N 3.41Å; R644-K646 VanDerWaalsContact C-N 3.27Å; R644-K646 PolarHBondContact O-N 3.16Å; R644-K646 VanDerWaalsContact O-N 3.09Å; R644-S647 PolarHBondContact O-N 3.08Å; R644-S647 PolarHBondContact O-OG 3.3Å; R644-S647 VanDerWaalsContact O-OG 3.12Å; R644-L648 HydrophobicContact CB-CD1 4.01Å; R644-L648 HydrophobicContact CB-CG 4.24Å; R644-L648 WeakPolarHBondContact O-CG 3.3Å; R644-L648 PolarHBondContact O-N 3Å
645	R	75.8	Confident	81.6	Confident	25.3333 Å²	25.3333	60.2 Å²	60.2	10%	0.096	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-45.9	-48.7	-173.5	69.8	-170.2	-172.4	-129.4	7	113.2	T549 T588 V589 M641 Y642 S647 L648	T549-R645 PolarHBondContact OG1-NH1 2.87Å; T588-R645 WeakPolarHBondContact O-CD 3.41Å; V589-R645 WeakPolarHBondContact CG1-O 3.31Å; V589-R645 HydrophobicContact CG2-CB 4.45Å; V589-R645 WeakPolarHBondContact CG2-O 3.42Å; M641-R645 VanDerWaalsContact O-CB 3.26Å; M641-R645 WeakPolarHBondContact O-CB 3.39Å; M641-R645 PolarHBondContact O-N 2.92Å; Y642-R645 VanDerWaalsContact CD1-NH1 3.3Å; Y642-R645 VanDerWaalsContact CZ-NH1 3.3Å; Y642-R645 WeakPolarHBondContact O-CG 3.35Å; Y642-R645 PolarHBondContact O-NH1 2.81Å; R645-S647 VanDerWaalsContact C-N 3.25Å; R645-S647 PolarHBondContact O-N 2.96Å; R645-S647 VanDerWaalsContact O-N 3.17Å; R645-L648 PolarHBondContact O-N 3.47Å
646	K	73.5	Confident	81.6	Confident	165 Å²	165	59.9 Å²	59.9	72%	0.717	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-67.8	-14.9	-176.8	-63.9	-169.9	176	-170	0	115.2	R644	R644-K646 VanDerWaalsContact C-N 3.27Å; R644-K646 PolarHBondContact O-N 3.16Å; R644-K646 VanDerWaalsContact O-N 3.09Å
647	S	73.9	Confident	81.7	Confident	92.6667 Å²	92.6667	57.3 Å²	57.3	65%	0.648	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-107.3	0.8	-173.5	63.4	0	0	0	0	114.5	R644 R645	R644-S647 PolarHBondContact O-N 3.08Å; R644-S647 PolarHBondContact O-OG 3.3Å; R644-S647 VanDerWaalsContact O-OG 3.12Å; R645-S647 VanDerWaalsContact C-N 3.25Å; R645-S647 PolarHBondContact O-N 2.96Å; R645-S647 VanDerWaalsContact O-N 3.17Å
648	L	74.6	Confident	81.6	Confident	27.6667 Å²	27.6667	58.5 Å²	58.5	15%	0.145	28%	0.284	C	S	.	.	S	Bend	trans	-99	152.4	-173.8	-70.2	162.8	0	0	0	111.7	T596 V601 R644 R645 S650	T596-L648 HydrophobicContact CG2-CB 4.44Å; V601-L648 HydrophobicContact CB-CD1 4.01Å; V601-L648 HydrophobicContact CG1-CD1 4.06Å; V601-L648 HydrophobicContact CG2-CD1 3.75Å; R644-L648 HydrophobicContact CB-CD1 4.01Å; R644-L648 HydrophobicContact CB-CG 4.24Å; R644-L648 WeakPolarHBondContact O-CG 3.3Å; R644-L648 PolarHBondContact O-N 3Å; R645-L648 PolarHBondContact O-N 3.47Å; L648-S650 PolarHBondContact O-N 3.3Å; L648-S650 VanDerWaalsContact O-N 3.14Å
649	R	74	Confident	81.3	Confident	234.667 Å²	234.667	62.7 Å²	62.7	89%	0.886	30%	0.302	S	S	*	.			trans	-62.4	117.8	169.3	-83.1	-174.4	175.9	179.6	-1.1	109	T596	T596-R649 PolarHBondContact OG1-O 3.34Å
650	S	79.1	Confident	81.2	Confident	51.3333 Å²	51.3333	60 Å²	60	36%	0.359	29%	0.29	S	S	.	.			trans	-102.5	155.1	180	68.1	0	0	0	0	110.9	N594 T596 L648	N594-S650 WeakPolarHBondContact CB-OG 3.25Å; T596-S650 WeakPolarHBondContact OG1-CA 3.28Å; L648-S650 PolarHBondContact O-N 3.3Å; L648-S650 VanDerWaalsContact O-N 3.14Å
651	T	84.3	Confident	81	Confident	41.3333 Å²	41.3333	61.2 Å²	61.2	25%	0.254	29%	0.294	S	S	.	.	B	Isolated β-bridge	trans	-119.4	139	174.3	-33.3	0	0	0	0	107.6	N594 L595 T655 V656	N594-T651 CarbonylContact C-O 3.5Å; N594-T651 WeakPolarHBondContact CA-O 3.49Å; L595-T651 PolarHBondContact N-O 3.06Å; L595-T651 PolarHBondContact O-N 3.2Å; T651-T655 HydrophobicContact CG2-CG2 3.62Å; T651-V656 HydrophobicContact CG2-CG2 4.13Å
652	S	86.7	Confident	80.4	Confident	36 Å²	36	64.4 Å²	64.4	25%	0.252	32%	0.32	S	S	.	.			trans	-58.5	146.1	174.5	107.7	0	0	0	0	110.6	N594 T654 T655 V656 N1148	N594-S652 VanDerWaalsContact OD1-CA 3.24Å; N594-S652 WeakPolarHBondContact OD1-CA 3.32Å; S652-T654 PolarHBondContact O-N 3.25Å; S652-T654 PolarHBondContact OG-N 3.01Å; S652-T654 PolarHBondContact OG-OG1 3.02Å; S652-T655 PolarHBondContact O-N 3.22Å; S652-T655 VanDerWaalsContact O-N 3.12Å; S652-T655 PolarHBondContact OG-N 3.23Å; S652-T655 PolarHBondContact OG-OG1 3.13Å; S652-V656 PolarHBondContact O-N 3.08Å; S652-V656 VanDerWaalsContact O-N 3.09Å; S652-N1148 PolarHBondContact OG-ND2 3.2Å
653	I	86.5	Confident	79.9	Confident	6.33333 Å²	6.33333	70.3 Å²	70.3	3%	0.032	34%	0.344	C	S	.	.	H	α-helix	trans	-57.8	-38.2	178.7	-172.4	157.7	0	0	0	111.9	Y593 L595 T655 V656 V657 H677 E679 I680	Y593-I653 HydrophobicContact CD1-CD1 4.1Å; L595-I653 HydrophobicContact CD1-CB 4.33Å; L595-I653 HydrophobicContact CD1-CD1 4.38Å; L595-I653 HydrophobicContact CD1-CG1 3.92Å; L595-I653 HydrophobicContact CG-CB 4.4Å; I653-T655 VanDerWaalsContact C-N 3.33Å; I653-T655 PolarHBondContact O-N 3.24Å; I653-V656 WeakPolarHBondContact O-CB 3.32Å; I653-V656 PolarHBondContact O-N 3.17Å; I653-V656 VanDerWaalsContact O-N 3.14Å; I653-V657 HydrophobicContact CG1-CG2 4.45Å; I653-V657 WeakPolarHBondContact O-CG2 3.45Å; I653-V657 PolarHBondContact O-N 3.17Å; I653-H677 HydrophobicContact CD1-CB 3.89Å; I653-E679 HydrophobicContact CD1-CB 4.24Å; I653-E679 HydrophobicContact CG1-CB 4.35Å; I653-E679 HydrophobicContact CG2-CB 4.37Å; I653-E679 HydrophobicContact CG2-CG 4.28Å; I653-E679 WeakPolarHBondContact CG2-OE2 3.37Å; I653-I680 HydrophobicContact CD1-CD1 3.85Å; I653-I680 HydrophobicContact CD1-CG1 3.68Å
654	T	84.8	Confident	79.2	Confident	48 Å²	48	71 Å²	71	29%	0.294	34%	0.343	S	S	.	.	H	α-helix	trans	-57.1	-50.3	175.9	-36.7	0	0	0	0	110.1	S652 V656 V657 E658 E679 P1146	S652-T654 PolarHBondContact O-N 3.25Å; S652-T654 PolarHBondContact OG-N 3.01Å; S652-T654 PolarHBondContact OG-OG1 3.02Å; T654-V656 VanDerWaalsContact C-N 3.29Å; T654-V656 PolarHBondContact O-N 3.1Å; T654-V657 WeakPolarHBondContact O-CB 3.37Å; T654-V657 PolarHBondContact O-N 2.99Å; T654-E658 WeakPolarHBondContact O-CB 3.24Å; T654-E658 VanDerWaalsContact O-CG 3.26Å; T654-E658 WeakPolarHBondContact O-CG 3.48Å; T654-E658 PolarHBondContact O-N 3.14Å; T654-E679 WeakPolarHBondContact CB-OE1 3.49Å; T654-E679 WeakPolarHBondContact CG2-OE1 3.44Å; T654-E679 PolarHBondContact OG1-OE1 3.12Å; T654-P1146 HydrophobicContact CG2-CB 3.83Å; T654-P1146 HydrophobicContact CG2-CG 3.63Å; T654-P1146 WeakPolarHBondContact CG2-O 3.39Å
655	T	85.4	Confident	78.9	Confident	44 Å²	44	72.5 Å²	72.5	27%	0.27	35%	0.351	S	S	.	.	H	α-helix	trans	-65.5	-30.2	178.4	-49.2	0	0	0	0	113.2	T651 S652 I653 E658 K659 N1148	T651-T655 HydrophobicContact CG2-CG2 3.62Å; S652-T655 PolarHBondContact O-N 3.22Å; S652-T655 VanDerWaalsContact O-N 3.12Å; S652-T655 PolarHBondContact OG-N 3.23Å; S652-T655 PolarHBondContact OG-OG1 3.13Å; I653-T655 VanDerWaalsContact C-N 3.33Å; I653-T655 PolarHBondContact O-N 3.24Å; T655-E658 VanDerWaalsContact CA-OE2 3.27Å; T655-E658 WeakPolarHBondContact CA-OE2 3.48Å; T655-E658 PolarHBondContact OG1-OE2 3.43Å; T655-K659 WeakPolarHBondContact O-CB 3.3Å; T655-K659 VanDerWaalsContact O-CG 3.3Å; T655-K659 WeakPolarHBondContact O-CG 3.32Å; T655-K659 PolarHBondContact O-N 3.12Å; T655-K659 VanDerWaalsContact O-N 3.15Å; T655-N1148 PolarHBondContact OG1-ND2 3.11Å; T655-N1148 VanDerWaalsContact OG1-ND2 3.16Å
656	V	86.3	Confident	79.1	Confident	5.33333 Å²	5.33333	77.5 Å²	77.5	3%	0.032	38%	0.375	C	S	.	.	H	α-helix	trans	-68.9	-46.4	173.2	173.7	0	0	0	0	110.7	Y586 L595 T651 S652 I653 T654 E658 K659 L660	Y586-V656 HydrophobicContact CD1-CG1 4.12Å; Y586-V656 HydrophobicContact CD1-CG2 4.38Å; Y586-V656 HydrophobicContact CD2-CG1 4.31Å; Y586-V656 HydrophobicContact CE1-CG1 3.66Å; Y586-V656 HydrophobicContact CE1-CG2 4.08Å; Y586-V656 HydrophobicContact CE2-CG1 3.87Å; Y586-V656 HydrophobicContact CG-CG1 4.42Å; Y586-V656 VanDerWaalsContact CZ-CG1 3.47Å; L595-V656 HydrophobicContact CB-CG2 4.01Å; L595-V656 HydrophobicContact CD1-CB 4.15Å; L595-V656 HydrophobicContact CD1-CG1 4.09Å; L595-V656 HydrophobicContact CD1-CG2 4.28Å; T651-V656 HydrophobicContact CG2-CG2 4.13Å; S652-V656 PolarHBondContact O-N 3.08Å; S652-V656 VanDerWaalsContact O-N 3.09Å; I653-V656 WeakPolarHBondContact O-CB 3.32Å; I653-V656 PolarHBondContact O-N 3.17Å; I653-V656 VanDerWaalsContact O-N 3.14Å; T654-V656 VanDerWaalsContact C-N 3.29Å; T654-V656 PolarHBondContact O-N 3.1Å; V656-E658 VanDerWaalsContact C-N 3.31Å; V656-E658 PolarHBondContact O-N 2.95Å; V656-K659 CarbonylContact O-C 3.52Å; V656-K659 WeakPolarHBondContact O-CA 3.2Å; V656-K659 WeakPolarHBondContact O-CB 3.4Å; V656-K659 PolarHBondContact O-N 3.18Å; V656-K659 VanDerWaalsContact O-N 3.15Å; V656-L660 HydrophobicContact CG1-CD1 4.47Å; V656-L660 WeakPolarHBondContact O-CG 3.32Å; V656-L660 PolarHBondContact O-N 3.46Å
657	V	85.5	Confident	79.8	Confident	16 Å²	16	69.7 Å²	69.7	10%	0.097	34%	0.342	C	S	.	.	H	α-helix	trans	-61.4	-43.6	176.7	169.8	0	0	0	0	111.1	I653 T654 K659 L660 Y661 Y683	I653-V657 HydrophobicContact CG1-CG2 4.45Å; I653-V657 WeakPolarHBondContact O-CG2 3.45Å; I653-V657 PolarHBondContact O-N 3.17Å; T654-V657 WeakPolarHBondContact O-CB 3.37Å; T654-V657 PolarHBondContact O-N 2.99Å; V657-K659 VanDerWaalsContact C-N 3.32Å; V657-K659 PolarHBondContact O-N 3.15Å; V657-L660 WeakPolarHBondContact O-CB 3.41Å; V657-L660 PolarHBondContact O-N 2.88Å; V657-L660 VanDerWaalsContact O-N 3.13Å; V657-Y661 HydrophobicContact CG1-CD2 3.85Å; V657-Y661 HydrophobicContact CG1-CE2 3.44Å; V657-Y661 VanDerWaalsContact CG1-CE2 3.41Å; V657-Y661 VanDerWaalsContact O-CD2 3.25Å; V657-Y661 WeakPolarHBondContact O-CD2 3.47Å; V657-Y661 PolarHBondContact O-N 3.16Å; V657-Y683 HydrophobicContact CG1-CD2 3.7Å; V657-Y683 HydrophobicContact CG1-CE2 4.38Å; V657-Y683 HydrophobicContact CG1-CG 4.24Å
658	E	82.4	Confident	80.3	Confident	84.6667 Å²	84.6667	69.4 Å²	69.4	40%	0.396	33%	0.332	S	S	.	.	H	α-helix	trans	-56.8	-44	172.8	-72.7	175	162.5	0	0	112.1	T654 T655 V656 L660 Y661 A662 I1145 P1146 M1147	T654-E658 WeakPolarHBondContact O-CB 3.24Å; T654-E658 VanDerWaalsContact O-CG 3.26Å; T654-E658 WeakPolarHBondContact O-CG 3.48Å; T654-E658 PolarHBondContact O-N 3.14Å; T655-E658 VanDerWaalsContact CA-OE2 3.27Å; T655-E658 WeakPolarHBondContact CA-OE2 3.48Å; T655-E658 PolarHBondContact OG1-OE2 3.43Å; V656-E658 VanDerWaalsContact C-N 3.31Å; V656-E658 PolarHBondContact O-N 2.95Å; E658-L660 VanDerWaalsContact C-N 3.35Å; E658-L660 PolarHBondContact O-N 3.22Å; E658-Y661 PolarHBondContact O-N 3Å; E658-A662 WeakPolarHBondContact O-CB 3.43Å; E658-A662 PolarHBondContact O-N 3.12Å; E658-I1145 HydrophobicContact CB-CG2 3.37Å; E658-I1145 VanDerWaalsContact CD-CG2 3.49Å; E658-I1145 HydrophobicContact CG-CB 4.43Å; E658-I1145 HydrophobicContact CG-CG2 3.2Å; E658-I1145 WeakPolarHBondContact OE1-CG2 3.46Å; E658-P1146 HydrophobicContact CG-CG 4.38Å; E658-M1147 WeakPolarHBondContact OE1-CA 3.39Å; E658-M1147 PolarHBondContact OE1-N 3.03Å
659	K	80.5	Confident	81	Confident	92.3333 Å²	92.3333	68.5 Å²	68.5	40%	0.401	33%	0.327	S	S	.	.	H	α-helix	trans	-62.6	-40.9	173.8	-82.3	177.4	179.1	177.1	0	112	T655 V656 V657 Y661 A662 Y663	T655-K659 WeakPolarHBondContact O-CB 3.3Å; T655-K659 VanDerWaalsContact O-CG 3.3Å; T655-K659 WeakPolarHBondContact O-CG 3.32Å; T655-K659 PolarHBondContact O-N 3.12Å; T655-K659 VanDerWaalsContact O-N 3.15Å; V656-K659 CarbonylContact O-C 3.52Å; V656-K659 WeakPolarHBondContact O-CA 3.2Å; V656-K659 WeakPolarHBondContact O-CB 3.4Å; V656-K659 PolarHBondContact O-N 3.18Å; V656-K659 VanDerWaalsContact O-N 3.15Å; V657-K659 VanDerWaalsContact C-N 3.32Å; V657-K659 PolarHBondContact O-N 3.15Å; K659-Y661 VanDerWaalsContact C-N 3.31Å; K659-Y661 PolarHBondContact O-N 3.01Å; K659-A662 CarbonylContact O-C 3.6Å; K659-A662 PolarHBondContact O-N 3.12Å; K659-Y663 HydrophobicContact CB-CD2 4.15Å; K659-Y663 HydrophobicContact CB-CE2 3.94Å; K659-Y663 HydrophobicContact CD-CE2 4.33Å; K659-Y663 HydrophobicContact CG-CE2 4.21Å; K659-Y663 WeakPolarHBondContact O-CB 3.28Å; K659-Y663 WeakPolarHBondContact O-CD2 3.3Å; K659-Y663 PolarHBondContact O-N 3.27Å
660	L	83	Confident	81.9	Confident	8.33333 Å²	8.33333	57.3 Å²	57.3	4%	0.044	29%	0.285	C	S	.	.	H	α-helix	trans	-62.9	-41.2	177.8	-68.1	177.4	0	0	0	111.4	L544 V656 V657 E658 R664 K665 F667 Y683	L544-L660 HydrophobicContact CD1-CD1 4.29Å; L544-L660 HydrophobicContact CD2-CD1 3.72Å; V656-L660 HydrophobicContact CG1-CD1 4.47Å; V656-L660 WeakPolarHBondContact O-CG 3.32Å; V656-L660 PolarHBondContact O-N 3.46Å; V657-L660 WeakPolarHBondContact O-CB 3.41Å; V657-L660 PolarHBondContact O-N 2.88Å; V657-L660 VanDerWaalsContact O-N 3.13Å; E658-L660 VanDerWaalsContact C-N 3.35Å; E658-L660 PolarHBondContact O-N 3.22Å; L660-R664 PolarHBondContact O-N 3.26Å; L660-R664 VanDerWaalsContact O-N 3.07Å; L660-K665 PolarHBondContact O-N 2.85Å; L660-F667 HydrophobicContact CD1-CE2 4.27Å; L660-F667 HydrophobicContact CD2-CE2 3.88Å; L660-F667 HydrophobicContact CD2-CZ 3.9Å; L660-Y683 HydrophobicContact CB-CE2 4.17Å; L660-Y683 HydrophobicContact CD1-CE1 4.37Å
661	Y	78.4	Confident	82.5	Confident	70 Å²	70	54.9 Å²	54.9	28%	0.275	27%	0.268	S	S	.	.	H	α-helix	trans	-62.5	-47.3	170.9	-72.9	-54.8	0	0	0	112.1	V657 E658 K659 Y663 R664 Y683 N686	V657-Y661 HydrophobicContact CG1-CD2 3.85Å; V657-Y661 HydrophobicContact CG1-CE2 3.44Å; V657-Y661 VanDerWaalsContact CG1-CE2 3.41Å; V657-Y661 VanDerWaalsContact O-CD2 3.25Å; V657-Y661 WeakPolarHBondContact O-CD2 3.47Å; V657-Y661 PolarHBondContact O-N 3.16Å; E658-Y661 PolarHBondContact O-N 3Å; K659-Y661 VanDerWaalsContact C-N 3.31Å; K659-Y661 PolarHBondContact O-N 3.01Å; Y661-Y663 VanDerWaalsContact C-N 3.33Å; Y661-Y663 PolarHBondContact O-N 3.06Å; Y661-R664 WeakPolarHBondContact O-CG 3.39Å; Y661-R664 PolarHBondContact O-N 3.1Å; Y661-R664 VanDerWaalsContact O-N 3.07Å; Y661-Y683 HydrophobicContact CD1-CD2 4.35Å; Y661-Y683 AromaticContact CD1-CE2 3.92Å; Y661-Y683 HydrophobicContact CD1-CE2 4.11Å; Y661-Y683 HydrophobicContact CD2-CE2 4.5Å; Y661-Y683 AromaticContact CE1-CD2 3.66Å; Y661-Y683 HydrophobicContact CE1-CD2 3.82Å; Y661-Y683 AromaticContact CE1-CE2 3.77Å; Y661-Y683 HydrophobicContact CE1-CE2 3.77Å; Y661-Y683 AromaticContact CE2-CD2 3.92Å; Y661-Y683 HydrophobicContact CE2-CD2 3.92Å; Y661-Y683 HydrophobicContact CE2-CE2 4.32Å; Y661-Y683 HydrophobicContact CG-CE2 4.41Å; Y661-Y683 AromaticContact CZ-CD2 3.5Å; Y661-Y683 VanDerWaalsContact CZ-CD2 3.46Å; Y661-Y683 AromaticContact CZ-CE2 3.88Å; Y661-Y683 WeakPolarHBondContact OH-CA 3.48Å; Y661-Y683 WeakPolarHBondContact OH-CD2 3.32Å; Y661-N686 HydrophobicContact CE1-CB 4.41Å; Y661-N686 VanDerWaalsContact OH-CB 3.23Å; Y661-N686 WeakPolarHBondContact OH-CB 3.26Å; Y661-N686 PolarHBondContact OH-ND2 3.15Å; Y661-N686 VanDerWaalsContact OH-ND2 3.09Å
662	A	69.9	Low	82.8	Confident	68 Å²	68	52.9 Å²	52.9	56%	0.562	26%	0.256	S	S	*	.	H	α-helix	trans	-63.4	-36.3	-179	0	0	0	0	0	112.7	E658 K659 R664 Q1179	E658-A662 WeakPolarHBondContact O-CB 3.43Å; E658-A662 PolarHBondContact O-N 3.12Å; K659-A662 CarbonylContact O-C 3.6Å; K659-A662 PolarHBondContact O-N 3.12Å; A662-R664 VanDerWaalsContact C-N 3.3Å; A662-R664 PolarHBondContact O-N 3.27Å; A662-Q1179 PolarHBondContact O-NE2 3.25Å
663	Y	71.5	Confident	82.9	Confident	169.333 Å²	169.333	51.3 Å²	51.3	66%	0.664	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-6.9	175.7	-67.1	-54	0	0	0	113.5	K659 Y661 K665	K659-Y663 HydrophobicContact CB-CD2 4.15Å; K659-Y663 HydrophobicContact CB-CE2 3.94Å; K659-Y663 HydrophobicContact CD-CE2 4.33Å; K659-Y663 HydrophobicContact CG-CE2 4.21Å; K659-Y663 WeakPolarHBondContact O-CB 3.28Å; K659-Y663 WeakPolarHBondContact O-CD2 3.3Å; K659-Y663 PolarHBondContact O-N 3.27Å; Y661-Y663 VanDerWaalsContact C-N 3.33Å; Y661-Y663 PolarHBondContact O-N 3.06Å; Y663-K665 PolarHBondContact O-N 3.04Å
664	R	68.3	Low	82.8	Confident	142 Å²	142	51 Å²	51	54%	0.536	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.2	36.7	-173.7	-64.2	-171.9	174.1	162.4	7.5	112.9	L660 Y661 A662 Q666 L1175 I1176 S1178	L660-R664 PolarHBondContact O-N 3.26Å; L660-R664 VanDerWaalsContact O-N 3.07Å; Y661-R664 WeakPolarHBondContact O-CG 3.39Å; Y661-R664 PolarHBondContact O-N 3.1Å; Y661-R664 VanDerWaalsContact O-N 3.07Å; A662-R664 VanDerWaalsContact C-N 3.3Å; A662-R664 PolarHBondContact O-N 3.27Å; R664-Q666 PolarHBondContact O-N 3.25Å; R664-L1175 PolarHBondContact NH1-O 2.95Å; R664-L1175 VanDerWaalsContact NH1-O 3.11Å; R664-L1175 PolarHBondContact NH2-O 3.29Å; R664-I1176 VanDerWaalsContact NH1-C 3.32Å; R664-I1176 PolarHBondContact NH1-O 2.88Å; R664-S1178 PolarHBondContact NH2-OG 2.9Å
665	K	71.6	Confident	82.7	Confident	95 Å²	95	49.2 Å²	49.2	41%	0.413	23%	0.232	S	C	.	.			trans	-73.5	114	-176.2	-165.1	171	-173.5	-176.9	0	108.2	T584 L660 Y663 F667	T584-K665 WeakPolarHBondContact OG1-CE 3.35Å; T584-K665 PolarHBondContact OG1-NZ 3.29Å; L660-K665 PolarHBondContact O-N 2.85Å; Y663-K665 PolarHBondContact O-N 3.04Å; K665-F667 HydrophobicContact CB-CE2 4.26Å; K665-F667 HydrophobicContact CB-CZ 4.25Å; K665-F667 HydrophobicContact CD-CE1 4.11Å; K665-F667 HydrophobicContact CD-CZ 3.93Å; K665-F667 HydrophobicContact CG-CE1 4.2Å; K665-F667 HydrophobicContact CG-CE2 4.31Å; K665-F667 HydrophobicContact CG-CZ 4.05Å; K665-F667 WeakPolarHBondContact O-CD2 3.09Å
666	Q	80.3	Confident	82.8	Confident	129.667 Å²	129.667	47.4 Å²	47.4	61%	0.606	22%	0.221	S	C	*	.			trans	-77.9	137.9	177.8	-70.3	-176.6	-14	0	0	110.3	S542 R664 Y687 I691	S542-Q666 WeakPolarHBondContact CB-O 3.46Å; S542-Q666 PolarHBondContact OG-O 3.3Å; R664-Q666 PolarHBondContact O-N 3.25Å; Q666-Y687 VanDerWaalsContact CA-OH 3.25Å; Q666-Y687 WeakPolarHBondContact CA-OH 3.14Å; Q666-Y687 WeakPolarHBondContact CB-OH 3.33Å; Q666-I691 HydrophobicContact CG-CG2 4.14Å
667	F	87.7	Confident	82.8	Confident	1.66667 Å²	1.66667	49.9 Å²	49.9	1%	0.007	23%	0.232	C	C	.	.			trans	-121.4	136.8	174.4	-63.9	-70.9	0	0	0	108.9	S542 L544 T584 L660 K665 I670 Y683 Y687 L694	S542-F667 CarbonylContact O-C 3.57Å; S542-F667 WeakPolarHBondContact O-CA 3.49Å; S542-F667 VanDerWaalsContact OG-CA 3.25Å; S542-F667 WeakPolarHBondContact OG-CA 3.36Å; L544-F667 HydrophobicContact CB-CD1 3.74Å; L544-F667 HydrophobicContact CB-CD2 4.12Å; L544-F667 HydrophobicContact CB-CE1 3.78Å; L544-F667 HydrophobicContact CB-CE2 4.14Å; L544-F667 HydrophobicContact CB-CG 3.91Å; L544-F667 HydrophobicContact CB-CZ 3.97Å; L544-F667 HydrophobicContact CD1-CE1 4.25Å; L544-F667 HydrophobicContact CD1-CE2 4.33Å; L544-F667 HydrophobicContact CD1-CZ 4Å; L544-F667 HydrophobicContact CD2-CD2 4.35Å; L544-F667 HydrophobicContact CD2-CE2 4.09Å; L544-F667 HydrophobicContact CD2-CZ 4.44Å; L544-F667 HydrophobicContact CG-CE1 4.49Å; L544-F667 HydrophobicContact CG-CE2 4.39Å; L544-F667 HydrophobicContact CG-CZ 4.36Å; T584-F667 HydrophobicContact CG2-CE1 4.43Å; T584-F667 HydrophobicContact CG2-CZ 4.29Å; L660-F667 HydrophobicContact CD1-CE2 4.27Å; L660-F667 HydrophobicContact CD2-CE2 3.88Å; L660-F667 HydrophobicContact CD2-CZ 3.9Å; K665-F667 HydrophobicContact CB-CE2 4.26Å; K665-F667 HydrophobicContact CB-CZ 4.25Å; K665-F667 HydrophobicContact CD-CE1 4.11Å; K665-F667 HydrophobicContact CD-CZ 3.93Å; K665-F667 HydrophobicContact CG-CE1 4.2Å; K665-F667 HydrophobicContact CG-CE2 4.31Å; K665-F667 HydrophobicContact CG-CZ 4.05Å; K665-F667 WeakPolarHBondContact O-CD2 3.09Å; F667-I670 HydrophobicContact CB-CG1 4.38Å; F667-Y683 HydrophobicContact CD2-CE1 4.39Å; F667-Y683 WeakPolarHBondContact CD2-OH 3.45Å; F667-Y687 PolarHBondContact N-OH 3.17Å; F667-Y687 VanDerWaalsContact N-OH 3.07Å; F667-Y687 PolarHBondContact O-OH 3.18Å; F667-L694 HydrophobicContact CB-CD1 3.99Å; F667-L694 VanDerWaalsContact O-CD1 3.3Å; F667-L694 WeakPolarHBondContact O-CD1 3.17Å
668	D	85.5	Confident	82.8	Confident	85.6667 Å²	85.6667	53.8 Å²	53.8	46%	0.458	25%	0.248	S	C	.	.	S	Bend	trans	-81.3	-33.7	169.1	-56.9	-57	0	0	0	110.1	G541 S542 K695	G541-D668 VanDerWaalsContact C-OD2 3.27Å; G541-D668 WeakPolarHBondContact CA-OD2 3.27Å; S542-D668 PolarHBondContact N-OD2 3.36Å; S542-D668 PolarHBondContact O-N 2.96Å; S542-D668 PolarHBondContact OG-N 3.12Å; S542-D668 VanDerWaalsContact OG-N 3.09Å; S542-D668 PolarHBondContact OG-OD2 3.01Å; D668-K695 PolarHBondContact O-N 3.11Å; D668-K695 VanDerWaalsContact O-N 3.1Å
669	K	89.6	Confident	83	Confident	8.66667 Å²	8.66667	52.2 Å²	52.2	4%	0.038	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	142.1	-173.5	-60.4	174.4	-174	139.8	0	111.8	I539 C540 S542 T543 L544 K695 I730 A731	I539-K669 HydrophobicContact CG2-CD 4.23Å; C540-K669 PolarHBondContact O-NZ 3.19Å; S542-K669 PolarHBondContact O-N 2.89Å; S542-K669 VanDerWaalsContact O-N 3.13Å; T543-K669 CarbonylContact C-O 3.55Å; T543-K669 VanDerWaalsContact CA-O 3.31Å; T543-K669 WeakPolarHBondContact CA-O 3.38Å; T543-K669 HydrophobicContact CG2-CB 4Å; L544-K669 PolarHBondContact N-O 3Å; K669-K695 CarbonylContact C-O 3.53Å; K669-K695 VanDerWaalsContact CA-O 3.27Å; K669-K695 WeakPolarHBondContact CA-O 3.35Å; K669-K695 HydrophobicContact CG-CB 4.16Å; K669-K695 HydrophobicContact CG-CD 4.41Å; K669-I730 VanDerWaalsContact CE-O 3.31Å; K669-I730 WeakPolarHBondContact CE-O 3.48Å; K669-I730 PolarHBondContact NZ-O 3.43Å; K669-I730 VanDerWaalsContact NZ-O 3.14Å; K669-A731 PolarHBondContact NZ-O 3.48Å
670	I	92.4	Very high	83.4	Confident	0.333333 Å²	0.333333	47.9 Å²	47.9	0%	0.002	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	127.7	165.8	-88.4	-173.9	0	0	0	108.9	L544 F667 V672 I680 Y683 V684 L694 K695 A696 I697	L544-I670 HydrophobicContact CB-CB 4.42Å; L544-I670 HydrophobicContact CB-CG1 4.09Å; L544-I670 HydrophobicContact CB-CG2 4.44Å; L544-I670 HydrophobicContact CD2-CD1 3.87Å; L544-I670 HydrophobicContact CD2-CG1 4.16Å; L544-I670 HydrophobicContact CD2-CG2 4.28Å; L544-I670 HydrophobicContact CG-CD1 4.35Å; L544-I670 HydrophobicContact CG-CG1 4.13Å; L544-I670 CarbonylContact O-C 3.59Å; L544-I670 WeakPolarHBondContact O-CA 3.4Å; F667-I670 HydrophobicContact CB-CG1 4.38Å; I670-V672 HydrophobicContact CG2-CG2 4.34Å; I670-I680 HydrophobicContact CD1-CG2 3.59Å; I670-I680 HydrophobicContact CG2-CG2 4.42Å; I670-Y683 HydrophobicContact CD1-CD1 3.88Å; I670-Y683 HydrophobicContact CD1-CE1 3.88Å; I670-V684 HydrophobicContact CD1-CG2 3.83Å; I670-V684 HydrophobicContact CG2-CG2 3.64Å; I670-L694 HydrophobicContact CB-CD1 4.5Å; I670-L694 HydrophobicContact CD1-CD1 4.43Å; I670-L694 HydrophobicContact CD1-CD2 3.51Å; I670-L694 VanDerWaalsContact CD1-CD2 3.41Å; I670-L694 HydrophobicContact CD1-CG 4.42Å; I670-L694 HydrophobicContact CG1-CD1 4Å; I670-L694 HydrophobicContact CG1-CD2 3.8Å; I670-L694 HydrophobicContact CG1-CG 4.21Å; I670-L694 HydrophobicContact CG2-CD1 4.41Å; I670-L694 HydrophobicContact CG2-CD2 3.96Å; I670-L694 HydrophobicContact CG2-CG 4.12Å; I670-K695 PolarHBondContact N-O 3.03Å; I670-A696 HydrophobicContact CG2-CB 3.65Å; I670-I697 WeakPolarHBondContact O-CB 3.47Å; I670-I697 PolarHBondContact O-N 3.21Å
671	V	91.9	Very high	83.7	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	119.9	-179	-175	0	0	0	0	109.3	T543 L544 I545 I546 F673 I697 I730	T543-V671 HydrophobicContact CG2-CB 4.42Å; T543-V671 HydrophobicContact CG2-CG2 3.82Å; L544-V671 PolarHBondContact O-N 3.31Å; I545-V671 CarbonylContact C-O 3.55Å; I545-V671 WeakPolarHBondContact CA-O 3.38Å; I546-V671 PolarHBondContact N-O 3.24Å; V671-F673 HydrophobicContact CG1-CD1 4.39Å; V671-F673 HydrophobicContact CG1-CD2 4.15Å; V671-F673 HydrophobicContact CG1-CE1 3.95Å; V671-F673 HydrophobicContact CG1-CE2 3.62Å; V671-F673 HydrophobicContact CG1-CG 4.47Å; V671-F673 HydrophobicContact CG1-CZ 3.51Å; V671-F673 VanDerWaalsContact CG1-CZ 3.47Å; V671-I697 WeakPolarHBondContact CA-O 3.32Å; V671-I697 HydrophobicContact CG1-CG2 4.1Å; V671-I697 HydrophobicContact CG2-CB 4.27Å; V671-I697 HydrophobicContact CG2-CD1 4.28Å; V671-I697 HydrophobicContact CG2-CG2 4.29Å; V671-I730 HydrophobicContact CG1-CD1 3.96Å; V671-I730 HydrophobicContact CG2-CD1 4.41Å; V671-I730 HydrophobicContact CG2-CG1 4.4Å; V671-I730 HydrophobicContact CG2-CG2 3.9Å
672	V	91.2	Very high	84.1	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	119.6	175.6	-175.1	0	0	0	0	109	I546 I670 D675 C676 I680 I697 G699 W716	I546-V672 HydrophobicContact CB-CG1 4.47Å; I546-V672 HydrophobicContact CB-CG2 4.36Å; I546-V672 HydrophobicContact CD1-CG2 4.46Å; I670-V672 HydrophobicContact CG2-CG2 4.34Å; V672-D675 VanDerWaalsContact CG1-O 3.26Å; V672-D675 WeakPolarHBondContact CG1-O 3.1Å; V672-C676 HydrophobicContact CG1-CB 4.36Å; V672-I680 HydrophobicContact CG2-CD1 4.39Å; V672-I680 HydrophobicContact CG2-CG2 4.08Å; V672-I697 PolarHBondContact N-O 3.3Å; V672-G699 PolarHBondContact O-N 2.91Å; V672-W716 HydrophobicContact CG2-CH2 4.4Å; V672-W716 HydrophobicContact CG2-CZ3 4.36Å
673	F	88.9	Confident	84.9	Confident	1.66667 Å²	1.66667	43.8 Å²	43.8	1%	0.007	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	115.6	173.8	-66	-65.6	0	0	0	110.1	I545 I546 S548 L572 C576 V671 L701 I726 L727 I730	I545-F673 HydrophobicContact CG2-CD2 4.11Å; I545-F673 HydrophobicContact CG2-CE2 4.04Å; I546-F673 PolarHBondContact O-N 3.16Å; S548-F673 WeakPolarHBondContact CA-O 3.35Å; S548-F673 WeakPolarHBondContact CB-O 3.31Å; S548-F673 PolarHBondContact N-O 2.93Å; L572-F673 HydrophobicContact CB-CD1 3.83Å; L572-F673 HydrophobicContact CB-CD2 4.21Å; L572-F673 HydrophobicContact CB-CE1 3.85Å; L572-F673 HydrophobicContact CB-CE2 4.23Å; L572-F673 HydrophobicContact CB-CG 4.01Å; L572-F673 HydrophobicContact CB-CZ 4.05Å; L572-F673 HydrophobicContact CD1-CD1 4Å; L572-F673 HydrophobicContact CD1-CE1 4.19Å; L572-F673 HydrophobicContact CG-CD1 4.33Å; L572-F673 HydrophobicContact CG-CE1 4.35Å; C576-F673 HydrophobicContact CB-CE2 3.74Å; C576-F673 HydrophobicContact CB-CZ 4.07Å; V671-F673 HydrophobicContact CG1-CD1 4.39Å; V671-F673 HydrophobicContact CG1-CD2 4.15Å; V671-F673 HydrophobicContact CG1-CE1 3.95Å; V671-F673 HydrophobicContact CG1-CE2 3.62Å; V671-F673 HydrophobicContact CG1-CG 4.47Å; V671-F673 HydrophobicContact CG1-CZ 3.51Å; V671-F673 VanDerWaalsContact CG1-CZ 3.47Å; F673-L701 HydrophobicContact CB-CD1 4.38Å; F673-I726 HydrophobicContact CE1-CD1 4.21Å; F673-I726 HydrophobicContact CE1-CG2 4.35Å; F673-L727 HydrophobicContact CZ-CD2 4.11Å; F673-I730 HydrophobicContact CE1-CD1 4.25Å; F673-I730 HydrophobicContact CZ-CD1 4.03Å
674	G	84.2	Confident	85.7	Confident	0.666667 Å²	0.666667	35.7 Å²	35.7	1%	0.007	16%	0.163	C	C	.	.	S	Bend	trans	104.8	-150.8	-175.6	0	0	0	0	0	112	W698 G699	G674-W698 PolarHBondContact O-NE1 3.07Å; G674-G699 PolarHBondContact N-O 3.23Å
675	D	83	Confident	86.5	Confident	9 Å²	9	32.6 Å²	32.6	5%	0.048	16%	0.156	C	C	.	.			trans	-60.7	152.8	-179.6	-62.4	-27.8	0	0	0	110.7	S550 K551 Y593 V672 D705 V706	S550-D675 WeakPolarHBondContact CA-OD1 3.37Å; S550-D675 PolarHBondContact OG-OD1 2.94Å; K551-D675 WeakPolarHBondContact CB-OD2 3.44Å; K551-D675 WeakPolarHBondContact CG-OD2 3.24Å; K551-D675 PolarHBondContact N-OD2 2.91Å; Y593-D675 HydrophobicContact CE2-CB 4.31Å; Y593-D675 VanDerWaalsContact OH-CA 3.26Å; Y593-D675 WeakPolarHBondContact OH-CA 3.44Å; Y593-D675 WeakPolarHBondContact OH-CB 3.37Å; Y593-D675 PolarHBondContact OH-O 3.15Å; V672-D675 VanDerWaalsContact CG1-O 3.26Å; V672-D675 WeakPolarHBondContact CG1-O 3.1Å; D675-D705 VanDerWaalsContact OD1-CA 3.26Å; D675-D705 WeakPolarHBondContact OD1-CA 3.47Å; D675-D705 VanDerWaalsContact OD1-CB 3.28Å; D675-D705 WeakPolarHBondContact OD1-CB 3.15Å; D675-V706 PolarHBondContact OD1-N 2.87Å
676	C	85.9	Confident	87	Confident	7.33333 Å²	7.33333	30.4 Å²	30.4	5%	0.05	15%	0.149	C	C	.	.			trans	-116	124.5	176	-166	0	0	0	0	111	Y593 V672 W698 V706 W707 P708	Y593-C676 PolarHBondContact OH-N 2.88Å; V672-C676 HydrophobicContact CG1-CB 4.36Å; C676-W698 HydrophobicContact CB-CD2 4.25Å; C676-W698 HydrophobicContact CB-CG 4.36Å; C676-W698 HydrophobicContact CB-CZ2 4.43Å; C676-V706 PolarHBondContact N-O 3.4Å; C676-W707 HydrophobicContact CB-CE3 4.16Å; C676-W707 HydrophobicContact CB-CZ3 4.17Å; C676-P708 WeakPolarHBondContact O-CD 3.3Å; C676-P708 WeakPolarHBondContact O-CG 3.46Å
677	H	87	Confident	87.1	Confident	57.6667 Å²	57.6667	24.6 Å²	24.6	27%	0.267	12%	0.122	S	C	.	.			trans	-87.3	147.1	-177.9	-160.2	-94	0	0	0	111.8	Y593 I653 E679 I680 V681	Y593-H677 HydrophobicContact CD1-CB 3.78Å; Y593-H677 HydrophobicContact CD2-CB 4.19Å; Y593-H677 AromaticContact CD2-CD2 3.43Å; Y593-H677 VanDerWaalsContact CD2-CD2 3.43Å; Y593-H677 WeakPolarHBondContact CD2-CD2 3.34Å; Y593-H677 HydrophobicContact CE1-CB 3.91Å; Y593-H677 HydrophobicContact CE2-CB 4.42Å; Y593-H677 AromaticContact CE2-CD2 3.9Å; Y593-H677 HydrophobicContact CG-CB 3.97Å; Y593-H677 AromaticContact CG-CD2 3.7Å; I653-H677 HydrophobicContact CD1-CB 3.89Å; H677-E679 VanDerWaalsContact C-N 3.32Å; H677-E679 IonicContact CE1-OE1 2.89Å; H677-E679 PolarHBondContact CE1-OE1 3.04Å; H677-E679 IonicContact CE1-OE2 3.24Å; H677-E679 PolarHBondContact CE1-OE2 2.97Å; H677-E679 IonicContact CG-OE2 3.32Å; H677-E679 VanDerWaalsContact ND1-CD 3.33Å; H677-E679 PolarHBondContact ND1-N 2.81Å; H677-E679 IonicContact ND1-OE1 3.19Å; H677-E679 IonicContact ND1-OE2 2.99Å; H677-E679 PolarHBondContact ND1-OE2 3.02Å; H677-E679 PolarHBondContact O-N 3.03Å; H677-I680 HydrophobicContact CB-CD1 4.13Å; H677-I680 HydrophobicContact CB-CG1 4.46Å; H677-I680 WeakPolarHBondContact O-CB 3.26Å; H677-I680 PolarHBondContact O-N 3.14Å; H677-I680 VanDerWaalsContact O-N 3.15Å; H677-V681 PolarHBondContact O-N 3.13Å
678	K	86.1	Confident	86.9	Confident	98 Å²	98	28.2 Å²	28.2	43%	0.426	14%	0.135	S	C	.	.	H	α-helix	trans	-52.8	-45.5	-177.5	-179.5	178.9	174.5	-179.9	0	113.1	I680 V681 D682 P708	K678-I680 PolarHBondContact O-N 2.93Å; K678-I680 VanDerWaalsContact O-N 3.16Å; K678-V681 CarbonylContact O-C 3.49Å; K678-V681 WeakPolarHBondContact O-CA 3.42Å; K678-V681 VanDerWaalsContact O-CB 3.32Å; K678-V681 WeakPolarHBondContact O-CB 3.46Å; K678-V681 PolarHBondContact O-N 3.17Å; K678-D682 WeakPolarHBondContact CE-OD2 3.37Å; K678-D682 WeakPolarHBondContact CG-OD2 3.34Å; K678-D682 PolarHBondContact O-N 2.73Å; K678-P708 HydrophobicContact CB-CB 4.16Å; K678-P708 HydrophobicContact CB-CG 4.16Å; K678-P708 HydrophobicContact CG-CB 4.49Å
679	E	86.5	Confident	86.5	Confident	50.6667 Å²	50.6667	28.1 Å²	28.1	24%	0.237	14%	0.137	C	C	.	.	H	α-helix	trans	-60.8	-28.1	-179.2	-71.8	131.4	158.3	0	0	113.3	I653 T654 H677 Y683	I653-E679 HydrophobicContact CD1-CB 4.24Å; I653-E679 HydrophobicContact CG1-CB 4.35Å; I653-E679 HydrophobicContact CG2-CB 4.37Å; I653-E679 HydrophobicContact CG2-CG 4.28Å; I653-E679 WeakPolarHBondContact CG2-OE2 3.37Å; T654-E679 WeakPolarHBondContact CB-OE1 3.49Å; T654-E679 WeakPolarHBondContact CG2-OE1 3.44Å; T654-E679 PolarHBondContact OG1-OE1 3.12Å; H677-E679 VanDerWaalsContact C-N 3.32Å; H677-E679 IonicContact CE1-OE1 2.89Å; H677-E679 PolarHBondContact CE1-OE1 3.04Å; H677-E679 IonicContact CE1-OE2 3.24Å; H677-E679 PolarHBondContact CE1-OE2 2.97Å; H677-E679 IonicContact CG-OE2 3.32Å; H677-E679 VanDerWaalsContact ND1-CD 3.33Å; H677-E679 PolarHBondContact ND1-N 2.81Å; H677-E679 IonicContact ND1-OE1 3.19Å; H677-E679 IonicContact ND1-OE2 2.99Å; H677-E679 PolarHBondContact ND1-OE2 3.02Å; H677-E679 PolarHBondContact O-N 3.03Å; E679-Y683 VanDerWaalsContact O-CB 3.25Å; E679-Y683 WeakPolarHBondContact O-CB 3.41Å; E679-Y683 PolarHBondContact O-N 3.22Å
680	I	88.9	Confident	85.6	Confident	3 Å²	3	34.1 Å²	34.1	2%	0.015	16%	0.161	C	C	.	.	H	α-helix	trans	-73.3	-40	174.2	-57.4	173.4	0	0	0	109.9	I546 Y593 I653 I670 V672 H677 K678 D682 Y683 V684 W716	I546-I680 HydrophobicContact CD1-CD1 3.47Å; I546-I680 VanDerWaalsContact CD1-CD1 3.41Å; I546-I680 HydrophobicContact CD1-CG1 3.84Å; I546-I680 HydrophobicContact CD1-CG2 4.22Å; I546-I680 HydrophobicContact CG2-CD1 4.32Å; Y593-I680 HydrophobicContact CE1-CD1 4.24Å; I653-I680 HydrophobicContact CD1-CD1 3.85Å; I653-I680 HydrophobicContact CD1-CG1 3.68Å; I670-I680 HydrophobicContact CD1-CG2 3.59Å; I670-I680 HydrophobicContact CG2-CG2 4.42Å; V672-I680 HydrophobicContact CG2-CD1 4.39Å; V672-I680 HydrophobicContact CG2-CG2 4.08Å; H677-I680 HydrophobicContact CB-CD1 4.13Å; H677-I680 HydrophobicContact CB-CG1 4.46Å; H677-I680 WeakPolarHBondContact O-CB 3.26Å; H677-I680 PolarHBondContact O-N 3.14Å; H677-I680 VanDerWaalsContact O-N 3.15Å; K678-I680 PolarHBondContact O-N 2.93Å; K678-I680 VanDerWaalsContact O-N 3.16Å; I680-D682 VanDerWaalsContact C-N 3.35Å; I680-Y683 WeakPolarHBondContact O-CB 3.21Å; I680-Y683 PolarHBondContact O-N 3.17Å; I680-V684 VanDerWaalsContact O-CG2 3.24Å; I680-V684 WeakPolarHBondContact O-CG2 3.38Å; I680-V684 PolarHBondContact O-N 3.34Å; I680-W716 HydrophobicContact CG2-CH2 4.11Å
681	V	88.5	Confident	84.5	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-63.8	-46.6	176.9	-173.3	0	0	0	0	110.1	H677 K678 Y683 V684 I685 W707 P708 C711 W716	H677-V681 PolarHBondContact O-N 3.13Å; K678-V681 CarbonylContact O-C 3.49Å; K678-V681 WeakPolarHBondContact O-CA 3.42Å; K678-V681 VanDerWaalsContact O-CB 3.32Å; K678-V681 WeakPolarHBondContact O-CB 3.46Å; K678-V681 PolarHBondContact O-N 3.17Å; V681-Y683 VanDerWaalsContact C-N 3.32Å; V681-Y683 PolarHBondContact O-N 3.21Å; V681-V684 PolarHBondContact O-N 3.06Å; V681-V684 VanDerWaalsContact O-N 3.15Å; V681-I685 HydrophobicContact CG1-CD1 4.07Å; V681-I685 WeakPolarHBondContact O-CG1 3.44Å; V681-I685 PolarHBondContact O-N 3.23Å; V681-W707 HydrophobicContact CB-CZ2 4.35Å; V681-W707 HydrophobicContact CG1-CH2 4.34Å; V681-W707 HydrophobicContact CG1-CZ2 3.98Å; V681-W707 HydrophobicContact CG2-CH2 3.91Å; V681-W707 HydrophobicContact CG2-CZ2 3.91Å; V681-W707 HydrophobicContact CG2-CZ3 4.36Å; V681-P708 HydrophobicContact CG2-CG 4.17Å; V681-C711 HydrophobicContact CB-CB 4.31Å; V681-C711 HydrophobicContact CG1-CB 3.64Å; V681-W716 HydrophobicContact CG2-CZ2 4.31Å
682	D	86.9	Confident	83.5	Confident	54 Å²	54	38 Å²	38	29%	0.289	19%	0.186	S	C	.	.	H	α-helix	trans	-61.5	-40.7	175.2	-64.8	-18.2	0	0	0	111.1	K678 I680 V684 I685 N686	K678-D682 WeakPolarHBondContact CE-OD2 3.37Å; K678-D682 WeakPolarHBondContact CG-OD2 3.34Å; K678-D682 PolarHBondContact O-N 2.73Å; I680-D682 VanDerWaalsContact C-N 3.35Å; D682-V684 PolarHBondContact O-N 3.2Å; D682-I685 PolarHBondContact O-N 2.91Å; D682-N686 VanDerWaalsContact O-CB 3.3Å; D682-N686 WeakPolarHBondContact O-CB 3.3Å; D682-N686 VanDerWaalsContact O-CG 3.29Å; D682-N686 PolarHBondContact O-N 3.17Å; D682-N686 PolarHBondContact O-ND2 3.01Å; D682-N686 VanDerWaalsContact O-ND2 3.14Å; D682-N686 PolarHBondContact O-OD1 3.49Å
683	Y	87.6	Confident	82.9	Confident	4.66667 Å²	4.66667	44.3 Å²	44.3	2%	0.018	23%	0.226	C	C	.	.	H	α-helix	trans	-58.7	-44.9	173.8	177	-105.7	0	0	0	112.5	L544 V657 L660 Y661 F667 I670 E679 I680 V681 N686 Y687	L544-Y683 HydrophobicContact CD2-CE1 4.17Å; V657-Y683 HydrophobicContact CG1-CD2 3.7Å; V657-Y683 HydrophobicContact CG1-CE2 4.38Å; V657-Y683 HydrophobicContact CG1-CG 4.24Å; L660-Y683 HydrophobicContact CB-CE2 4.17Å; L660-Y683 HydrophobicContact CD1-CE1 4.37Å; Y661-Y683 HydrophobicContact CD1-CD2 4.35Å; Y661-Y683 AromaticContact CD1-CE2 3.92Å; Y661-Y683 HydrophobicContact CD1-CE2 4.11Å; Y661-Y683 HydrophobicContact CD2-CE2 4.5Å; Y661-Y683 AromaticContact CE1-CD2 3.66Å; Y661-Y683 HydrophobicContact CE1-CD2 3.82Å; Y661-Y683 AromaticContact CE1-CE2 3.77Å; Y661-Y683 HydrophobicContact CE1-CE2 3.77Å; Y661-Y683 AromaticContact CE2-CD2 3.92Å; Y661-Y683 HydrophobicContact CE2-CD2 3.92Å; Y661-Y683 HydrophobicContact CE2-CE2 4.32Å; Y661-Y683 HydrophobicContact CG-CE2 4.41Å; Y661-Y683 AromaticContact CZ-CD2 3.5Å; Y661-Y683 VanDerWaalsContact CZ-CD2 3.46Å; Y661-Y683 AromaticContact CZ-CE2 3.88Å; Y661-Y683 WeakPolarHBondContact OH-CA 3.48Å; Y661-Y683 WeakPolarHBondContact OH-CD2 3.32Å; F667-Y683 HydrophobicContact CD2-CE1 4.39Å; F667-Y683 WeakPolarHBondContact CD2-OH 3.45Å; I670-Y683 HydrophobicContact CD1-CD1 3.88Å; I670-Y683 HydrophobicContact CD1-CE1 3.88Å; E679-Y683 VanDerWaalsContact O-CB 3.25Å; E679-Y683 WeakPolarHBondContact O-CB 3.41Å; E679-Y683 PolarHBondContact O-N 3.22Å; I680-Y683 WeakPolarHBondContact O-CB 3.21Å; I680-Y683 PolarHBondContact O-N 3.17Å; V681-Y683 VanDerWaalsContact C-N 3.32Å; V681-Y683 PolarHBondContact O-N 3.21Å; Y683-N686 PolarHBondContact O-N 3.11Å; Y683-Y687 HydrophobicContact CE1-CD2 4.26Å; Y683-Y687 AromaticContact CZ-CD2 3.93Å; Y683-Y687 VanDerWaalsContact O-CB 3.29Å; Y683-Y687 WeakPolarHBondContact O-CB 3.44Å; Y683-Y687 PolarHBondContact O-N 2.95Å
684	V	88	Confident	82.6	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-65.9	-43.2	178.9	168.1	0	0	0	0	111.8	I670 I680 V681 D682 N686 Y687 R688 L694 A696 W716	I670-V684 HydrophobicContact CD1-CG2 3.83Å; I670-V684 HydrophobicContact CG2-CG2 3.64Å; I680-V684 VanDerWaalsContact O-CG2 3.24Å; I680-V684 WeakPolarHBondContact O-CG2 3.38Å; I680-V684 PolarHBondContact O-N 3.34Å; V681-V684 PolarHBondContact O-N 3.06Å; V681-V684 VanDerWaalsContact O-N 3.15Å; D682-V684 PolarHBondContact O-N 3.2Å; V684-N686 VanDerWaalsContact C-N 3.3Å; V684-N686 PolarHBondContact O-N 3.48Å; V684-Y687 PolarHBondContact O-N 2.95Å; V684-R688 WeakPolarHBondContact O-CB 3.34Å; V684-R688 WeakPolarHBondContact O-CG 3.32Å; V684-R688 PolarHBondContact O-N 3.35Å; V684-L694 HydrophobicContact CB-CD2 4.32Å; V684-L694 HydrophobicContact CG1-CD2 4.17Å; V684-L694 HydrophobicContact CG2-CD2 3.94Å; V684-A696 HydrophobicContact CG1-CB 3.68Å; V684-A696 HydrophobicContact CG2-CB 4.22Å; V684-W716 HydrophobicContact CB-CZ2 3.76Å; V684-W716 HydrophobicContact CG1-CZ2 4.01Å; V684-W716 HydrophobicContact CG2-CH2 3.86Å; V684-W716 HydrophobicContact CG2-CZ2 3.44Å; V684-W716 VanDerWaalsContact CG2-CZ2 3.44Å
685	I	84.3	Confident	82.6	Confident	77.3333 Å²	77.3333	46 Å²	46	40%	0.397	23%	0.234	S	C	.	.	H	α-helix	trans	-59.3	-51.1	176.8	-68.3	166.4	0	0	0	109.3	V681 D682 Y687 R688 T689	V681-I685 HydrophobicContact CG1-CD1 4.07Å; V681-I685 WeakPolarHBondContact O-CG1 3.44Å; V681-I685 PolarHBondContact O-N 3.23Å; D682-I685 PolarHBondContact O-N 2.91Å; I685-Y687 VanDerWaalsContact C-N 3.34Å; I685-Y687 PolarHBondContact O-N 3.36Å; I685-R688 PolarHBondContact O-N 2.84Å; I685-T689 WeakPolarHBondContact O-CB 3.48Å; I685-T689 PolarHBondContact O-N 3.15Å; I685-T689 PolarHBondContact O-OG1 3Å
686	N	81.9	Confident	82.9	Confident	47.6667 Å²	47.6667	45.6 Å²	45.6	26%	0.255	23%	0.232	S	C	.	.	H	α-helix	trans	-62.5	-42.1	178.4	-68.7	-16.6	0	0	0	111.9	Y661 D682 Y683 V684 R688 T689 Y690 K1143	Y661-N686 HydrophobicContact CE1-CB 4.41Å; Y661-N686 VanDerWaalsContact OH-CB 3.23Å; Y661-N686 WeakPolarHBondContact OH-CB 3.26Å; Y661-N686 PolarHBondContact OH-ND2 3.15Å; Y661-N686 VanDerWaalsContact OH-ND2 3.09Å; D682-N686 VanDerWaalsContact O-CB 3.3Å; D682-N686 WeakPolarHBondContact O-CB 3.3Å; D682-N686 VanDerWaalsContact O-CG 3.29Å; D682-N686 PolarHBondContact O-N 3.17Å; D682-N686 PolarHBondContact O-ND2 3.01Å; D682-N686 VanDerWaalsContact O-ND2 3.14Å; D682-N686 PolarHBondContact O-OD1 3.49Å; Y683-N686 PolarHBondContact O-N 3.11Å; V684-N686 VanDerWaalsContact C-N 3.3Å; V684-N686 PolarHBondContact O-N 3.48Å; N686-R688 VanDerWaalsContact C-N 3.29Å; N686-R688 PolarHBondContact O-N 2.87Å; N686-T689 VanDerWaalsContact CA-OG1 3.26Å; N686-T689 WeakPolarHBondContact CA-OG1 3.42Å; N686-T689 PolarHBondContact O-N 3.2Å; N686-T689 PolarHBondContact O-OG1 3Å; N686-Y690 HydrophobicContact CB-CD2 4.11Å; N686-Y690 HydrophobicContact CB-CE2 4.27Å; N686-Y690 WeakPolarHBondContact O-CB 3.42Å; N686-Y690 WeakPolarHBondContact O-CD2 3.34Å; N686-Y690 PolarHBondContact O-N 3.1Å; N686-K1143 HydrophobicContact CB-CD 4Å; N686-K1143 VanDerWaalsContact CG-CE 3.41Å; N686-K1143 WeakPolarHBondContact ND2-CD 3.35Å; N686-K1143 WeakPolarHBondContact OD1-CD 3.2Å; N686-K1143 WeakPolarHBondContact OD1-CE 3.46Å; N686-K1143 PolarHBondContact OD1-NZ 2.88Å
687	Y	84.1	Confident	83	Confident	8.33333 Å²	8.33333	45.3 Å²	45.3	3%	0.033	23%	0.23	C	C	.	.	H	α-helix	trans	-59.8	-46	177.9	-169.2	-72	0	0	0	111.1	Q666 F667 Y683 V684 I685 T689 Y690 I691 G692 L694	Q666-Y687 VanDerWaalsContact CA-OH 3.25Å; Q666-Y687 WeakPolarHBondContact CA-OH 3.14Å; Q666-Y687 WeakPolarHBondContact CB-OH 3.33Å; F667-Y687 PolarHBondContact N-OH 3.17Å; F667-Y687 VanDerWaalsContact N-OH 3.07Å; F667-Y687 PolarHBondContact O-OH 3.18Å; Y683-Y687 HydrophobicContact CE1-CD2 4.26Å; Y683-Y687 AromaticContact CZ-CD2 3.93Å; Y683-Y687 VanDerWaalsContact O-CB 3.29Å; Y683-Y687 WeakPolarHBondContact O-CB 3.44Å; Y683-Y687 PolarHBondContact O-N 2.95Å; V684-Y687 PolarHBondContact O-N 2.95Å; I685-Y687 VanDerWaalsContact C-N 3.34Å; I685-Y687 PolarHBondContact O-N 3.36Å; Y687-T689 VanDerWaalsContact C-N 3.32Å; Y687-T689 PolarHBondContact O-N 3.37Å; Y687-Y690 PolarHBondContact O-N 3.17Å; Y687-I691 HydrophobicContact CD1-CB 4Å; Y687-I691 HydrophobicContact CD1-CG2 4.34Å; Y687-I691 HydrophobicContact CD2-CB 4.26Å; Y687-I691 HydrophobicContact CD2-CD1 3.46Å; Y687-I691 VanDerWaalsContact CD2-CD1 3.43Å; Y687-I691 HydrophobicContact CD2-CG1 4.4Å; Y687-I691 HydrophobicContact CD2-CG2 4.4Å; Y687-I691 HydrophobicContact CE1-CB 3.94Å; Y687-I691 HydrophobicContact CE1-CG2 3.77Å; Y687-I691 HydrophobicContact CE2-CB 4.18Å; Y687-I691 HydrophobicContact CE2-CD1 3.65Å; Y687-I691 HydrophobicContact CE2-CG1 4.46Å; Y687-I691 HydrophobicContact CE2-CG2 3.88Å; Y687-I691 HydrophobicContact CG-CB 4.16Å; Y687-I691 HydrophobicContact CG-CD1 4Å; Y687-I691 VanDerWaalsContact CZ-CG2 3.47Å; Y687-I691 WeakPolarHBondContact O-CA 3.25Å; Y687-I691 VanDerWaalsContact O-CB 3.3Å; Y687-I691 WeakPolarHBondContact O-CB 3.27Å; Y687-I691 PolarHBondContact O-N 3.09Å; Y687-I691 WeakPolarHBondContact OH-CG2 3.5Å; Y687-G692 WeakPolarHBondContact CD1-O 3.29Å; Y687-G692 PolarHBondContact O-N 3.13Å; Y687-G692 VanDerWaalsContact O-N 3.09Å; Y687-L694 HydrophobicContact CD1-CB 3.6Å; Y687-L694 HydrophobicContact CD1-CD1 4.24Å; Y687-L694 HydrophobicContact CD1-CD2 3.78Å; Y687-L694 HydrophobicContact CD1-CG 4.09Å; Y687-L694 HydrophobicContact CD2-CD2 4.4Å; Y687-L694 HydrophobicContact CE1-CB 3.93Å; Y687-L694 HydrophobicContact CE1-CD1 4.07Å; Y687-L694 HydrophobicContact CE1-CD2 4.43Å; Y687-L694 HydrophobicContact CE1-CG 4.37Å; Y687-L694 HydrophobicContact CG-CB 4.31Å; Y687-L694 HydrophobicContact CG-CD2 3.81Å
688	R	83.3	Confident	83.1	Confident	78.3333 Å²	78.3333	42.8 Å²	42.8	30%	0.296	22%	0.218	S	C	.	.	H	α-helix	trans	-64.5	-35.6	177.7	-73.6	175.6	175	169.2	-3.5	113.2	V684 I685 N686 G692 L694 D714 G715	V684-R688 WeakPolarHBondContact O-CB 3.34Å; V684-R688 WeakPolarHBondContact O-CG 3.32Å; V684-R688 PolarHBondContact O-N 3.35Å; I685-R688 PolarHBondContact O-N 2.84Å; N686-R688 VanDerWaalsContact C-N 3.29Å; N686-R688 PolarHBondContact O-N 2.87Å; R688-G692 VanDerWaalsContact CA-O 3.31Å; R688-G692 WeakPolarHBondContact CA-O 3.26Å; R688-L694 HydrophobicContact CG-CB 4.03Å; R688-L694 VanDerWaalsContact CZ-O 3.27Å; R688-L694 PolarHBondContact NE-O 3.13Å; R688-L694 PolarHBondContact NH2-O 3.24Å; R688-D714 PolarHBondContact NH1-O 2.94Å; R688-G715 PolarHBondContact NH1-O 2.97Å; R688-G715 PolarHBondContact NH2-O 2.86Å
689	T	75.8	Confident	83.1	Confident	82 Å²	82	38.2 Å²	38.2	50%	0.503	20%	0.199	S	C	.	.	H	α-helix	trans	-74.1	-40.2	179.7	-31.1	0	0	0	0	112.3	I685 N686 Y687	I685-T689 WeakPolarHBondContact O-CB 3.48Å; I685-T689 PolarHBondContact O-N 3.15Å; I685-T689 PolarHBondContact O-OG1 3Å; N686-T689 VanDerWaalsContact CA-OG1 3.26Å; N686-T689 WeakPolarHBondContact CA-OG1 3.42Å; N686-T689 PolarHBondContact O-N 3.2Å; N686-T689 PolarHBondContact O-OG1 3Å; Y687-T689 VanDerWaalsContact C-N 3.32Å; Y687-T689 PolarHBondContact O-N 3.37Å
690	Y	71	Confident	82.9	Confident	134.667 Å²	134.667	36 Å²	36	53%	0.528	19%	0.188	S	C	.	.	H	α-helix	trans	-111.5	-23.1	-168.1	-60.2	-70.8	0	0	0	115.4	N686 Y687 K1143 H1172	N686-Y690 HydrophobicContact CB-CD2 4.11Å; N686-Y690 HydrophobicContact CB-CE2 4.27Å; N686-Y690 WeakPolarHBondContact O-CB 3.42Å; N686-Y690 WeakPolarHBondContact O-CD2 3.34Å; N686-Y690 PolarHBondContact O-N 3.1Å; Y687-Y690 PolarHBondContact O-N 3.17Å; Y690-K1143 HydrophobicContact CD2-CD 4.38Å; Y690-K1143 HydrophobicContact CE2-CD 3.98Å; Y690-K1143 HydrophobicContact CE2-CG 4.35Å; Y690-H1172 HydrophobicContact CD1-CB 4.15Å; Y690-H1172 HydrophobicContact CE1-CB 4.02Å; Y690-H1172 AromaticContact CZ-CD2 3.8Å
691	I	70.4	Confident	82.3	Confident	65.6667 Å²	65.6667	36.4 Å²	36.4	34%	0.337	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112	-49.9	-172.2	-58.8	171.2	0	0	0	111.3	Q666 Y687	Q666-I691 HydrophobicContact CG-CG2 4.14Å; Y687-I691 HydrophobicContact CD1-CB 4Å; Y687-I691 HydrophobicContact CD1-CG2 4.34Å; Y687-I691 HydrophobicContact CD2-CB 4.26Å; Y687-I691 HydrophobicContact CD2-CD1 3.46Å; Y687-I691 VanDerWaalsContact CD2-CD1 3.43Å; Y687-I691 HydrophobicContact CD2-CG1 4.4Å; Y687-I691 HydrophobicContact CD2-CG2 4.4Å; Y687-I691 HydrophobicContact CE1-CB 3.94Å; Y687-I691 HydrophobicContact CE1-CG2 3.77Å; Y687-I691 HydrophobicContact CE2-CB 4.18Å; Y687-I691 HydrophobicContact CE2-CD1 3.65Å; Y687-I691 HydrophobicContact CE2-CG1 4.46Å; Y687-I691 HydrophobicContact CE2-CG2 3.88Å; Y687-I691 HydrophobicContact CG-CB 4.16Å; Y687-I691 HydrophobicContact CG-CD1 4Å; Y687-I691 VanDerWaalsContact CZ-CG2 3.47Å; Y687-I691 WeakPolarHBondContact O-CA 3.25Å; Y687-I691 VanDerWaalsContact O-CB 3.3Å; Y687-I691 WeakPolarHBondContact O-CB 3.27Å; Y687-I691 PolarHBondContact O-N 3.09Å; Y687-I691 WeakPolarHBondContact OH-CG2 3.5Å
692	G	70.6	Confident	81.5	Confident	18 Å²	18	37.6 Å²	37.6	19%	0.186	20%	0.199	C	C	.	.			trans	156.4	-178.7	-179.6	0	0	0	0	0	114.1	Y687 R688 L694	Y687-G692 WeakPolarHBondContact CD1-O 3.29Å; Y687-G692 PolarHBondContact O-N 3.13Å; Y687-G692 VanDerWaalsContact O-N 3.09Å; R688-G692 VanDerWaalsContact CA-O 3.31Å; R688-G692 WeakPolarHBondContact CA-O 3.26Å; G692-L694 PolarHBondContact O-N 3.08Å
693	P	77.1	Confident	80.6	Confident	132 Å²	132	36.7 Å²	36.7	86%	0.857	20%	0.203	S	C	*	.			trans	-60.9	129.4	-179.4	26.2	-33.6	0	0	0	110.7
694	L	83.5	Confident	79.6	Confident	8 Å²	8	40 Å²	40	4%	0.042	22%	0.218	C	C	.	.			trans	-130.3	125.4	-179	179.3	69.5	0	0	0	109.6	F667 I670 V684 Y687 R688 G692 A696	F667-L694 HydrophobicContact CB-CD1 3.99Å; F667-L694 VanDerWaalsContact O-CD1 3.3Å; F667-L694 WeakPolarHBondContact O-CD1 3.17Å; I670-L694 HydrophobicContact CB-CD1 4.5Å; I670-L694 HydrophobicContact CD1-CD1 4.43Å; I670-L694 HydrophobicContact CD1-CD2 3.51Å; I670-L694 VanDerWaalsContact CD1-CD2 3.41Å; I670-L694 HydrophobicContact CD1-CG 4.42Å; I670-L694 HydrophobicContact CG1-CD1 4Å; I670-L694 HydrophobicContact CG1-CD2 3.8Å; I670-L694 HydrophobicContact CG1-CG 4.21Å; I670-L694 HydrophobicContact CG2-CD1 4.41Å; I670-L694 HydrophobicContact CG2-CD2 3.96Å; I670-L694 HydrophobicContact CG2-CG 4.12Å; V684-L694 HydrophobicContact CB-CD2 4.32Å; V684-L694 HydrophobicContact CG1-CD2 4.17Å; V684-L694 HydrophobicContact CG2-CD2 3.94Å; Y687-L694 HydrophobicContact CD1-CB 3.6Å; Y687-L694 HydrophobicContact CD1-CD1 4.24Å; Y687-L694 HydrophobicContact CD1-CD2 3.78Å; Y687-L694 HydrophobicContact CD1-CG 4.09Å; Y687-L694 HydrophobicContact CD2-CD2 4.4Å; Y687-L694 HydrophobicContact CE1-CB 3.93Å; Y687-L694 HydrophobicContact CE1-CD1 4.07Å; Y687-L694 HydrophobicContact CE1-CD2 4.43Å; Y687-L694 HydrophobicContact CE1-CG 4.37Å; Y687-L694 HydrophobicContact CG-CB 4.31Å; Y687-L694 HydrophobicContact CG-CD2 3.81Å; R688-L694 HydrophobicContact CG-CB 4.03Å; R688-L694 VanDerWaalsContact CZ-O 3.27Å; R688-L694 PolarHBondContact NE-O 3.13Å; R688-L694 PolarHBondContact NH2-O 3.24Å; G692-L694 PolarHBondContact O-N 3.08Å; L694-A696 PolarHBondContact O-N 3.26Å
695	K	84.9	Confident	78.6	Confident	29.6667 Å²	29.6667	41.8 Å²	41.8	13%	0.129	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	110.4	175.6	-162.5	174	-173.6	172.7	0	109.6	D668 K669 I670 I697 I717 E732 P733	D668-K695 PolarHBondContact O-N 3.11Å; D668-K695 VanDerWaalsContact O-N 3.1Å; K669-K695 CarbonylContact C-O 3.53Å; K669-K695 VanDerWaalsContact CA-O 3.27Å; K669-K695 WeakPolarHBondContact CA-O 3.35Å; K669-K695 HydrophobicContact CG-CB 4.16Å; K669-K695 HydrophobicContact CG-CD 4.41Å; I670-K695 PolarHBondContact N-O 3.03Å; K695-I697 HydrophobicContact CD-CD1 4.35Å; K695-I697 HydrophobicContact CG-CD1 4.23Å; K695-I697 HydrophobicContact CG-CG1 4.27Å; K695-I717 HydrophobicContact CD-CD1 4.45Å; K695-I717 VanDerWaalsContact CE-CD1 3.45Å; K695-I717 HydrophobicContact CG-CD1 4.29Å; K695-E732 PolarHBondContact NZ-O 3.13Å; K695-P733 VanDerWaalsContact NZ-C 3.35Å; K695-P733 PolarHBondContact NZ-O 3.13Å
696	A	88.7	Confident	77.9	Confident	0.666667 Å²	0.666667	40.9 Å²	40.9	1%	0.006	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	125.8	-176.2	0	0	0	0	0	110.9	I670 V684 L694 W716 I717	I670-A696 HydrophobicContact CG2-CB 3.65Å; V684-A696 HydrophobicContact CG1-CB 3.68Å; V684-A696 HydrophobicContact CG2-CB 4.22Å; L694-A696 PolarHBondContact O-N 3.26Å; A696-W716 HydrophobicContact CB-CD2 3.55Å; A696-W716 VanDerWaalsContact CB-CD2 3.49Å; A696-W716 HydrophobicContact CB-CE3 3.66Å; A696-W716 HydrophobicContact CB-CG 4.14Å; A696-W716 HydrophobicContact CB-CH2 4.12Å; A696-W716 HydrophobicContact CB-CZ2 4.02Å; A696-W716 HydrophobicContact CB-CZ3 3.95Å; A696-W716 WeakPolarHBondContact O-CA 3.24Å; A696-I717 PolarHBondContact O-N 3.18Å
697	I	88.8	Confident	77.7	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.01	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	128.4	-169	-61.5	172	0	0	0	109.4	I670 V671 V672 K695 I717 F719 I726 I730	I670-I697 WeakPolarHBondContact O-CB 3.47Å; I670-I697 PolarHBondContact O-N 3.21Å; V671-I697 WeakPolarHBondContact CA-O 3.32Å; V671-I697 HydrophobicContact CG1-CG2 4.1Å; V671-I697 HydrophobicContact CG2-CB 4.27Å; V671-I697 HydrophobicContact CG2-CD1 4.28Å; V671-I697 HydrophobicContact CG2-CG2 4.29Å; V672-I697 PolarHBondContact N-O 3.3Å; K695-I697 HydrophobicContact CD-CD1 4.35Å; K695-I697 HydrophobicContact CG-CD1 4.23Å; K695-I697 HydrophobicContact CG-CG1 4.27Å; I697-I717 WeakPolarHBondContact CA-O 3.3Å; I697-I717 HydrophobicContact CG1-CB 4.39Å; I697-I717 HydrophobicContact CG1-CD1 4.37Å; I697-F719 HydrophobicContact CB-CE2 4.4Å; I697-F719 HydrophobicContact CB-CZ 4.18Å; I697-F719 HydrophobicContact CD1-CZ 4.33Å; I697-F719 HydrophobicContact CG1-CZ 4.27Å; I697-F719 HydrophobicContact CG2-CD2 3.75Å; I697-F719 HydrophobicContact CG2-CE1 4.13Å; I697-F719 HydrophobicContact CG2-CE2 3.37Å; I697-F719 VanDerWaalsContact CG2-CE2 3.49Å; I697-F719 HydrophobicContact CG2-CZ 3.01Å; I697-I726 HydrophobicContact CG2-CD1 4.46Å; I697-I730 HydrophobicContact CD1-CB 4.34Å; I697-I730 HydrophobicContact CD1-CG1 3.92Å; I697-I730 HydrophobicContact CD1-CG2 4.19Å; I697-I730 HydrophobicContact CG2-CD1 4.46Å; I697-I730 HydrophobicContact CG2-CG1 4.34Å
698	W	88.9	Confident	77.4	Confident	3.33333 Å²	3.33333	40.2 Å²	40.2	1%	0.013	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	116.9	178.6	178.8	40.3	0	0	0	111.5	G674 C676 N700 D705 V706 W707 W716 I717 E718 F719	G674-W698 PolarHBondContact O-NE1 3.07Å; C676-W698 HydrophobicContact CB-CD2 4.25Å; C676-W698 HydrophobicContact CB-CG 4.36Å; C676-W698 HydrophobicContact CB-CZ2 4.43Å; W698-N700 HydrophobicContact CD2-CB 4.17Å; W698-N700 HydrophobicContact CE3-CB 4.37Å; W698-N700 HydrophobicContact CH2-CB 4.12Å; W698-N700 HydrophobicContact CZ2-CB 3.97Å; W698-N700 HydrophobicContact CZ3-CB 4.38Å; W698-N700 PolarHBondContact O-N 2.88Å; W698-D705 WeakPolarHBondContact CH2-O 3.35Å; W698-D705 HydrophobicContact CZ2-CB 4.08Å; W698-D705 WeakPolarHBondContact CZ2-O 3.36Å; W698-V706 WeakPolarHBondContact CZ2-O 3.36Å; W698-W707 HydrophobicContact CB-CZ3 4.27Å; W698-W707 AromaticContact CD2-CE3 3.73Å; W698-W707 HydrophobicContact CD2-CE3 3.73Å; W698-W707 AromaticContact CD2-CZ3 3.88Å; W698-W707 HydrophobicContact CD2-CZ3 3.88Å; W698-W707 HydrophobicContact CE3-CD2 4.36Å; W698-W707 AromaticContact CE3-CE3 3.37Å; W698-W707 HydrophobicContact CE3-CE3 3.37Å; W698-W707 VanDerWaalsContact CE3-CE3 3.41Å; W698-W707 AromaticContact CE3-CZ3 3.71Å; W698-W707 HydrophobicContact CE3-CZ3 3.71Å; W698-W707 HydrophobicContact CG-CE3 4.28Å; W698-W707 AromaticContact CG-CZ3 3.98Å; W698-W707 HydrophobicContact CG-CZ3 4.14Å; W698-W707 HydrophobicContact CH2-CB 3.91Å; W698-W707 HydrophobicContact CH2-CE3 4.09Å; W698-W707 HydrophobicContact CZ2-CB 4.33Å; W698-W707 HydrophobicContact CZ2-CE3 4.31Å; W698-W707 HydrophobicContact CZ3-CB 4.1Å; W698-W707 HydrophobicContact CZ3-CD2 4.28Å; W698-W707 AromaticContact CZ3-CE3 3.58Å; W698-W707 HydrophobicContact CZ3-CE3 3.58Å; W698-W707 HydrophobicContact CZ3-CG 4.44Å; W698-W707 HydrophobicContact CZ3-CZ3 4.37Å; W698-W716 HydrophobicContact CB-CE3 3.93Å; W698-W716 HydrophobicContact CB-CZ3 4.2Å; W698-I717 PolarHBondContact N-O 3.18Å; W698-E718 HydrophobicContact CD2-CG 4.5Å; W698-E718 HydrophobicContact CE3-CB 4.26Å; W698-E718 HydrophobicContact CE3-CG 3.73Å; W698-E718 VanDerWaalsContact CZ3-CD 3.47Å; W698-E718 HydrophobicContact CZ3-CG 4.01Å; W698-E718 VanDerWaalsContact CZ3-OE1 3.29Å; W698-E718 WeakPolarHBondContact CZ3-OE1 2.89Å; W698-E718 CarbonylContact O-C 3.46Å; W698-E718 WeakPolarHBondContact O-CA 3.4Å; W698-F719 PolarHBondContact O-N 3.04Å
699	G	85	Confident	76.8	Confident	2.33333 Å²	2.33333	44.6 Å²	44.6	2%	0.024	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	94	172.3	0	0	0	0	0	111.4	V672 G674 L701 F719	V672-G699 PolarHBondContact O-N 2.91Å; G674-G699 PolarHBondContact N-O 3.23Å; G699-L701 VanDerWaalsContact C-N 3.35Å; G699-L701 WeakPolarHBondContact O-CG 3.17Å; G699-L701 PolarHBondContact O-N 3.32Å; G699-L701 VanDerWaalsContact O-N 3.14Å; G699-F719 CarbonylContact C-O 3.53Å; G699-F719 WeakPolarHBondContact CA-O 3.22Å
700	N	82.2	Confident	76.5	Confident	3.66667 Å²	3.66667	44.9 Å²	44.9	2%	0.02	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	83.6	170.5	-178.6	-4.4	0	0	0	110	W698 S702 G703 E704 D705 E718 F719 K720 G721	W698-N700 HydrophobicContact CD2-CB 4.17Å; W698-N700 HydrophobicContact CE3-CB 4.37Å; W698-N700 HydrophobicContact CH2-CB 4.12Å; W698-N700 HydrophobicContact CZ2-CB 3.97Å; W698-N700 HydrophobicContact CZ3-CB 4.38Å; W698-N700 PolarHBondContact O-N 2.88Å; N700-S702 VanDerWaalsContact C-N 3.35Å; N700-S702 PolarHBondContact O-N 3.08Å; N700-S702 PolarHBondContact OD1-OG 3.25Å; N700-S702 VanDerWaalsContact OD1-OG 3.12Å; N700-G703 PolarHBondContact ND2-O 3.16Å; N700-G703 PolarHBondContact O-N 3.01Å; N700-G703 VanDerWaalsContact OD1-C 3.26Å; N700-G703 WeakPolarHBondContact OD1-CA 3.28Å; N700-G703 PolarHBondContact OD1-N 3.31Å; N700-E704 PolarHBondContact ND2-O 3.15Å; N700-E704 PolarHBondContact OD1-N 3.09Å; N700-E704 PolarHBondContact OD1-O 3.3Å; N700-D705 WeakPolarHBondContact CA-OD2 3.05Å; N700-D705 HydrophobicContact CB-CB 4.48Å; N700-D705 VanDerWaalsContact OD1-CB 3.29Å; N700-D705 WeakPolarHBondContact OD1-CB 3.29Å; N700-D705 PolarHBondContact OD1-N 3.24Å; N700-D705 VanDerWaalsContact OD1-N 3.1Å; N700-D705 PolarHBondContact OD1-OD2 2.85Å; N700-E718 HydrophobicContact CB-CG 4.25Å; N700-E718 WeakPolarHBondContact CB-OE1 2.74Å; N700-E718 PolarHBondContact ND2-OE1 3.15Å; N700-F719 WeakPolarHBondContact CA-O 3.5Å; N700-F719 PolarHBondContact N-O 3.14Å; N700-K720 HydrophobicContact CB-CG 4.2Å; N700-K720 CarbonylContact O-C 3.52Å; N700-K720 WeakPolarHBondContact O-CA 3.33Å; N700-G721 PolarHBondContact O-N 3.18Å
701	L	77.8	Confident	76.5	Confident	11.6667 Å²	11.6667	39.3 Å²	39.3	6%	0.061	24%	0.237	C	C	.	.	S	Bend	trans	-70.3	-32.7	-170.5	-60.1	178.8	0	0	0	113.1	L568 G569 L572 F673 G699 D705 G721	L568-L701 HydrophobicContact CB-CD1 4.18Å; L568-L701 HydrophobicContact CD2-CB 4.29Å; L568-L701 HydrophobicContact CD2-CD1 4.22Å; L568-L701 HydrophobicContact CD2-CD2 4.19Å; L568-L701 HydrophobicContact CD2-CG 4.4Å; L568-L701 HydrophobicContact CG-CD1 4.13Å; L568-L701 HydrophobicContact CG-CD2 4.45Å; G569-L701 VanDerWaalsContact CA-CD1 3.43Å; G569-L701 VanDerWaalsContact N-CD1 3.28Å; L572-L701 HydrophobicContact CD1-CD1 4.44Å; L572-L701 HydrophobicContact CD1-CD2 3.62Å; F673-L701 HydrophobicContact CB-CD1 4.38Å; G699-L701 VanDerWaalsContact C-N 3.35Å; G699-L701 WeakPolarHBondContact O-CG 3.17Å; G699-L701 PolarHBondContact O-N 3.32Å; G699-L701 VanDerWaalsContact O-N 3.14Å; L701-D705 PolarHBondContact N-OD2 3.09Å; L701-G721 VanDerWaalsContact CD2-O 3.24Å; L701-G721 WeakPolarHBondContact CD2-O 3.35Å
702	S	70.1	Confident	76.8	Confident	25.6667 Å²	25.6667	39.3 Å²	39.3	18%	0.179	24%	0.243	C	C	.	.	S	Bend	trans	-83.2	-22.3	178.4	67.4	0	0	0	0	113.1	S550 Y552 N700 E704 D705	S550-S702 VanDerWaalsContact OG-CB 3.29Å; S550-S702 WeakPolarHBondContact OG-CB 3.35Å; S550-S702 PolarHBondContact OG-OG 2.81Å; Y552-S702 WeakPolarHBondContact O-CB 3.43Å; N700-S702 VanDerWaalsContact C-N 3.35Å; N700-S702 PolarHBondContact O-N 3.08Å; N700-S702 PolarHBondContact OD1-OG 3.25Å; N700-S702 VanDerWaalsContact OD1-OG 3.12Å; S702-E704 PolarHBondContact O-N 3.13Å; S702-E704 PolarHBondContact OG-N 3.1Å; S702-D705 WeakPolarHBondContact CB-OD1 3.26Å; S702-D705 PolarHBondContact N-OD2 3.35Å; S702-D705 PolarHBondContact OG-N 3.16Å; S702-D705 VanDerWaalsContact OG-N 3.09Å; S702-D705 PolarHBondContact OG-OD1 3.29Å
703	G	67.7	Low	77	Confident	35.3333 Å²	35.3333	42.4 Å²	42.4	36%	0.364	25%	0.252	S	S	.	.	S	Bend	trans	78.8	-10.9	-168.7	0	0	0	0	0	113.8	N700	N700-G703 PolarHBondContact ND2-O 3.16Å; N700-G703 PolarHBondContact O-N 3.01Å; N700-G703 VanDerWaalsContact OD1-C 3.26Å; N700-G703 WeakPolarHBondContact OD1-CA 3.28Å; N700-G703 PolarHBondContact OD1-N 3.31Å
704	E	67.8	Low	76.8	Confident	74 Å²	74	42.4 Å²	42.4	35%	0.346	25%	0.245	S	C	.	.			trans	-105.2	37	176.1	-64.8	-175.7	172	0	0	110.6	Y552 N554 N700 S702 V706	Y552-E704 WeakPolarHBondContact CB-O 3.44Å; Y552-E704 VanDerWaalsContact O-OE2 3.13Å; N554-E704 VanDerWaalsContact CB-OE1 3.29Å; N554-E704 WeakPolarHBondContact CB-OE1 3.38Å; N554-E704 WeakPolarHBondContact CB-OE2 3.32Å; N554-E704 PolarHBondContact ND2-OE1 3.26Å; N554-E704 PolarHBondContact ND2-OE2 3.43Å; N700-E704 PolarHBondContact ND2-O 3.15Å; N700-E704 PolarHBondContact OD1-N 3.09Å; N700-E704 PolarHBondContact OD1-O 3.3Å; S702-E704 PolarHBondContact O-N 3.13Å; S702-E704 PolarHBondContact OG-N 3.1Å; E704-V706 VanDerWaalsContact C-N 3.32Å; E704-V706 PolarHBondContact O-N 3.46Å
705	D	66.3	Low	76.4	Confident	37 Å²	37	44.4 Å²	44.4	20%	0.198	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-67.1	123	-178.2	-66.8	-37	0	0	0	110.5	S550 D675 W698 N700 L701 S702 W707 K713 K720	S550-D705 WeakPolarHBondContact CB-OD1 3.36Å; S550-D705 PolarHBondContact OG-OD1 3.27Å; D675-D705 VanDerWaalsContact OD1-CA 3.26Å; D675-D705 WeakPolarHBondContact OD1-CA 3.47Å; D675-D705 VanDerWaalsContact OD1-CB 3.28Å; D675-D705 WeakPolarHBondContact OD1-CB 3.15Å; W698-D705 WeakPolarHBondContact CH2-O 3.35Å; W698-D705 HydrophobicContact CZ2-CB 4.08Å; W698-D705 WeakPolarHBondContact CZ2-O 3.36Å; N700-D705 WeakPolarHBondContact CA-OD2 3.05Å; N700-D705 HydrophobicContact CB-CB 4.48Å; N700-D705 VanDerWaalsContact OD1-CB 3.29Å; N700-D705 WeakPolarHBondContact OD1-CB 3.29Å; N700-D705 PolarHBondContact OD1-N 3.24Å; N700-D705 VanDerWaalsContact OD1-N 3.1Å; N700-D705 PolarHBondContact OD1-OD2 2.85Å; L701-D705 PolarHBondContact N-OD2 3.09Å; S702-D705 WeakPolarHBondContact CB-OD1 3.26Å; S702-D705 PolarHBondContact N-OD2 3.35Å; S702-D705 PolarHBondContact OG-N 3.16Å; S702-D705 VanDerWaalsContact OG-N 3.09Å; S702-D705 PolarHBondContact OG-OD1 3.29Å; D705-W707 VanDerWaalsContact C-N 3.31Å; D705-W707 PolarHBondContact O-N 3.15Å; D705-K713 IonicContact OD1-NZ 3.66Å; D705-K713 PolarHBondContact OD1-NZ 2.99Å; D705-K720 WeakPolarHBondContact OD1-CE 3.39Å; D705-K720 IonicContact OD1-NZ 3.38Å; D705-K720 PolarHBondContact OD1-NZ 3.25Å; D705-K720 IonicContact OD2-NZ 2.8Å; D705-K720 PolarHBondContact OD2-NZ 3.46Å
706	V	69.4	Low	76.4	Confident	58.3333 Å²	58.3333	44.2 Å²	44.2	35%	0.354	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-89.9	110.3	-175.3	-178.8	0	0	0	0	110.3	Y552 D675 C676 W698 E704	Y552-V706 HydrophobicContact CD2-CB 4.45Å; Y552-V706 HydrophobicContact CD2-CG1 4.25Å; Y552-V706 HydrophobicContact CD2-CG2 3.66Å; Y552-V706 HydrophobicContact CE1-CG2 4.15Å; Y552-V706 HydrophobicContact CE2-CB 3.82Å; Y552-V706 HydrophobicContact CE2-CG1 4.02Å; Y552-V706 HydrophobicContact CE2-CG2 3.67Å; Y552-V706 HydrophobicContact CG-CG2 4.28Å; Y552-V706 VanDerWaalsContact CZ-CG2 3.45Å; D675-V706 PolarHBondContact OD1-N 2.87Å; C676-V706 PolarHBondContact N-O 3.4Å; W698-V706 WeakPolarHBondContact CZ2-O 3.36Å; E704-V706 VanDerWaalsContact C-N 3.32Å; E704-V706 PolarHBondContact O-N 3.46Å
707	W	79.4	Confident	76	Confident	21.6667 Å²	21.6667	45.6 Å²	45.6	8%	0.082	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-99.7	142.5	166.8	-173.7	-95.1	0	0	0	109.3	C676 V681 W698 D705 N709 C711 S712 K713 W716	C676-W707 HydrophobicContact CB-CE3 4.16Å; C676-W707 HydrophobicContact CB-CZ3 4.17Å; V681-W707 HydrophobicContact CB-CZ2 4.35Å; V681-W707 HydrophobicContact CG1-CH2 4.34Å; V681-W707 HydrophobicContact CG1-CZ2 3.98Å; V681-W707 HydrophobicContact CG2-CH2 3.91Å; V681-W707 HydrophobicContact CG2-CZ2 3.91Å; V681-W707 HydrophobicContact CG2-CZ3 4.36Å; W698-W707 HydrophobicContact CB-CZ3 4.27Å; W698-W707 AromaticContact CD2-CE3 3.73Å; W698-W707 HydrophobicContact CD2-CE3 3.73Å; W698-W707 AromaticContact CD2-CZ3 3.88Å; W698-W707 HydrophobicContact CD2-CZ3 3.88Å; W698-W707 HydrophobicContact CE3-CD2 4.36Å; W698-W707 AromaticContact CE3-CE3 3.37Å; W698-W707 HydrophobicContact CE3-CE3 3.37Å; W698-W707 VanDerWaalsContact CE3-CE3 3.41Å; W698-W707 AromaticContact CE3-CZ3 3.71Å; W698-W707 HydrophobicContact CE3-CZ3 3.71Å; W698-W707 HydrophobicContact CG-CE3 4.28Å; W698-W707 AromaticContact CG-CZ3 3.98Å; W698-W707 HydrophobicContact CG-CZ3 4.14Å; W698-W707 HydrophobicContact CH2-CB 3.91Å; W698-W707 HydrophobicContact CH2-CE3 4.09Å; W698-W707 HydrophobicContact CZ2-CB 4.33Å; W698-W707 HydrophobicContact CZ2-CE3 4.31Å; W698-W707 HydrophobicContact CZ3-CB 4.1Å; W698-W707 HydrophobicContact CZ3-CD2 4.28Å; W698-W707 AromaticContact CZ3-CE3 3.58Å; W698-W707 HydrophobicContact CZ3-CE3 3.58Å; W698-W707 HydrophobicContact CZ3-CG 4.44Å; W698-W707 HydrophobicContact CZ3-CZ3 4.37Å; D705-W707 VanDerWaalsContact C-N 3.31Å; D705-W707 PolarHBondContact O-N 3.15Å; W707-N709 PolarHBondContact O-N 3.21Å; W707-N709 VanDerWaalsContact O-N 3.16Å; W707-N709 PolarHBondContact O-OD1 2.89Å; W707-C711 VanDerWaalsContact CD1-O 3.28Å; W707-C711 PolarHBondContact NE1-O 3.08Å; W707-S712 WeakPolarHBondContact CZ2-O 3.17Å; W707-K713 HydrophobicContact CD2-CD 4.43Å; W707-K713 HydrophobicContact CD2-CG 3.82Å; W707-K713 VanDerWaalsContact CE2-CG 3.48Å; W707-K713 HydrophobicContact CE3-CG 4.35Å; W707-K713 HydrophobicContact CG-CD 4.38Å; W707-K713 HydrophobicContact CG-CG 4.08Å; W707-K713 HydrophobicContact CH2-CG 4.32Å; W707-K713 HydrophobicContact CZ2-CB 4.37Å; W707-K713 HydrophobicContact CZ2-CG 3.91Å; W707-W716 HydrophobicContact CH2-CB 4.17Å; W707-W716 AromaticContact CH2-CD1 3.75Å; W707-W716 AromaticContact CH2-CD2 3.53Å; W707-W716 HydrophobicContact CH2-CD2 3.53Å; W707-W716 VanDerWaalsContact CH2-CD2 3.5Å; W707-W716 AromaticContact CH2-CE2 3.66Å; W707-W716 HydrophobicContact CH2-CE3 4.05Å; W707-W716 AromaticContact CH2-CG 3.58Å; W707-W716 HydrophobicContact CH2-CG 3.58Å; W707-W716 HydrophobicContact CH2-CZ2 4.26Å; W707-W716 AromaticContact CH2-NE1 3.8Å; W707-W716 AromaticContact CZ2-CD1 3.96Å; W707-W716 HydrophobicContact CZ2-CD2 4.49Å; W707-W716 HydrophobicContact CZ2-CG 4.33Å; W707-W716 HydrophobicContact CZ3-CD2 4.16Å; W707-W716 HydrophobicContact CZ3-CE3 4.23Å; W707-W716 HydrophobicContact CZ3-CG 4.41Å
708	P	76.2	Confident	75.8	Confident	20 Å²	20	48 Å²	48	13%	0.13	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-62	116.8	176.2	-18.3	30.3	0	0	0	111.1	C676 K678 V681 S710 C711	C676-P708 WeakPolarHBondContact O-CD 3.3Å; C676-P708 WeakPolarHBondContact O-CG 3.46Å; K678-P708 HydrophobicContact CB-CB 4.16Å; K678-P708 HydrophobicContact CB-CG 4.16Å; K678-P708 HydrophobicContact CG-CB 4.49Å; V681-P708 HydrophobicContact CG2-CG 4.17Å; P708-S710 PolarHBondContact O-N 3.11Å; P708-C711 HydrophobicContact CB-CB 4.35Å; P708-C711 PolarHBondContact O-N 3.2Å; P708-C711 VanDerWaalsContact O-N 3.09Å
709	N	72.1	Confident	75.2	Confident	170.333 Å²	170.333	48.9 Å²	48.9	91%	0.911	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-23.3	-177.7	-68.2	-10.7	0	0	0	114.1	W707 C711	W707-N709 PolarHBondContact O-N 3.21Å; W707-N709 VanDerWaalsContact O-N 3.16Å; W707-N709 PolarHBondContact O-OD1 2.89Å; N709-C711 VanDerWaalsContact C-N 3.32Å; N709-C711 PolarHBondContact O-N 2.87Å
710	S	69.6	Low	74.7	Confident	88 Å²	88	53.8 Å²	53.8	62%	0.615	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-5.7	-179.6	57.9	0	0	0	0	114.5	P708	P708-S710 PolarHBondContact O-N 3.11Å
711	C	70.8	Confident	74.1	Confident	17.3333 Å²	17.3333	54.7 Å²	54.7	12%	0.117	32%	0.318	C	S	.	.	S	Bend	trans	-120.7	134.3	-169.9	-58.1	0	0	0	0	111.5	V681 W707 P708 N709	V681-C711 HydrophobicContact CB-CB 4.31Å; V681-C711 HydrophobicContact CG1-CB 3.64Å; W707-C711 VanDerWaalsContact CD1-O 3.28Å; W707-C711 PolarHBondContact NE1-O 3.08Å; P708-C711 HydrophobicContact CB-CB 4.35Å; P708-C711 PolarHBondContact O-N 3.2Å; P708-C711 VanDerWaalsContact O-N 3.09Å; N709-C711 VanDerWaalsContact C-N 3.32Å; N709-C711 PolarHBondContact O-N 2.87Å
712	S	75.4	Confident	73.6	Confident	66.6667 Å²	66.6667	56.5 Å²	56.5	47%	0.466	33%	0.331	S	S	.	.			trans	-65.3	145	172.9	-179.2	0	0	0	0	111.2	W707 D714	W707-S712 WeakPolarHBondContact CZ2-O 3.17Å; S712-D714 VanDerWaalsContact C-N 3.26Å; S712-D714 WeakPolarHBondContact OG-CB 3.3Å; S712-D714 PolarHBondContact OG-N 3.1Å; S712-D714 VanDerWaalsContact OG-N 3.14Å; S712-D714 PolarHBondContact OG-OD1 3.32Å; S712-D714 PolarHBondContact OG-OD2 3.09Å; S712-D714 VanDerWaalsContact OG-OD2 3.13Å
713	K	75.4	Confident	73.8	Confident	83 Å²	83	56.7 Å²	56.7	36%	0.361	33%	0.331	S	S	.	.			trans	-82.7	0.2	170	-73.9	-175.5	175.3	-172.6	0	112.7	D705 W707 G715 W716 E718	D705-K713 IonicContact OD1-NZ 3.66Å; D705-K713 PolarHBondContact OD1-NZ 2.99Å; W707-K713 HydrophobicContact CD2-CD 4.43Å; W707-K713 HydrophobicContact CD2-CG 3.82Å; W707-K713 VanDerWaalsContact CE2-CG 3.48Å; W707-K713 HydrophobicContact CE3-CG 4.35Å; W707-K713 HydrophobicContact CG-CD 4.38Å; W707-K713 HydrophobicContact CG-CG 4.08Å; W707-K713 HydrophobicContact CH2-CG 4.32Å; W707-K713 HydrophobicContact CZ2-CB 4.37Å; W707-K713 HydrophobicContact CZ2-CG 3.91Å; K713-G715 PolarHBondContact O-N 3.19Å; K713-W716 WeakPolarHBondContact O-CB 3.44Å; K713-W716 PolarHBondContact O-N 3.09Å; K713-E718 IonicContact NZ-OE1 3.69Å; K713-E718 IonicContact NZ-OE2 3.12Å; K713-E718 PolarHBondContact NZ-OE2 3.19Å
714	D	73.1	Confident	74.1	Confident	132.667 Å²	132.667	55.5 Å²	55.5	71%	0.709	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	131	-174.3	-71.9	-35.3	0	0	0	112.6	R688 S712 W716	R688-D714 PolarHBondContact NH1-O 2.94Å; S712-D714 VanDerWaalsContact C-N 3.26Å; S712-D714 WeakPolarHBondContact OG-CB 3.3Å; S712-D714 PolarHBondContact OG-N 3.1Å; S712-D714 VanDerWaalsContact OG-N 3.14Å; S712-D714 PolarHBondContact OG-OD1 3.32Å; S712-D714 PolarHBondContact OG-OD2 3.09Å; S712-D714 VanDerWaalsContact OG-OD2 3.13Å; D714-W716 VanDerWaalsContact C-N 3.25Å; D714-W716 PolarHBondContact O-N 3.21Å
715	G	74.4	Confident	74.5	Confident	49.3333 Å²	49.3333	54.6 Å²	54.6	51%	0.509	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.4	6.3	-175.4	0	0	0	0	0	115.2	R688 K713	R688-G715 PolarHBondContact NH1-O 2.97Å; R688-G715 PolarHBondContact NH2-O 2.86Å; K713-G715 PolarHBondContact O-N 3.19Å
716	W	84.5	Confident	74.9	Confident	25 Å²	25	53.4 Å²	53.4	10%	0.095	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	137.6	169.4	-76.8	81.2	0	0	0	111.4	V672 I680 V681 V684 A696 W698 W707 K713 D714	V672-W716 HydrophobicContact CG2-CH2 4.4Å; V672-W716 HydrophobicContact CG2-CZ3 4.36Å; I680-W716 HydrophobicContact CG2-CH2 4.11Å; V681-W716 HydrophobicContact CG2-CZ2 4.31Å; V684-W716 HydrophobicContact CB-CZ2 3.76Å; V684-W716 HydrophobicContact CG1-CZ2 4.01Å; V684-W716 HydrophobicContact CG2-CH2 3.86Å; V684-W716 HydrophobicContact CG2-CZ2 3.44Å; V684-W716 VanDerWaalsContact CG2-CZ2 3.44Å; A696-W716 HydrophobicContact CB-CD2 3.55Å; A696-W716 VanDerWaalsContact CB-CD2 3.49Å; A696-W716 HydrophobicContact CB-CE3 3.66Å; A696-W716 HydrophobicContact CB-CG 4.14Å; A696-W716 HydrophobicContact CB-CH2 4.12Å; A696-W716 HydrophobicContact CB-CZ2 4.02Å; A696-W716 HydrophobicContact CB-CZ3 3.95Å; A696-W716 WeakPolarHBondContact O-CA 3.24Å; W698-W716 HydrophobicContact CB-CE3 3.93Å; W698-W716 HydrophobicContact CB-CZ3 4.2Å; W707-W716 HydrophobicContact CH2-CB 4.17Å; W707-W716 AromaticContact CH2-CD1 3.75Å; W707-W716 AromaticContact CH2-CD2 3.53Å; W707-W716 HydrophobicContact CH2-CD2 3.53Å; W707-W716 VanDerWaalsContact CH2-CD2 3.5Å; W707-W716 AromaticContact CH2-CE2 3.66Å; W707-W716 HydrophobicContact CH2-CE3 4.05Å; W707-W716 AromaticContact CH2-CG 3.58Å; W707-W716 HydrophobicContact CH2-CG 3.58Å; W707-W716 HydrophobicContact CH2-CZ2 4.26Å; W707-W716 AromaticContact CH2-NE1 3.8Å; W707-W716 AromaticContact CZ2-CD1 3.96Å; W707-W716 HydrophobicContact CZ2-CD2 4.49Å; W707-W716 HydrophobicContact CZ2-CG 4.33Å; W707-W716 HydrophobicContact CZ3-CD2 4.16Å; W707-W716 HydrophobicContact CZ3-CE3 4.23Å; W707-W716 HydrophobicContact CZ3-CG 4.41Å; K713-W716 WeakPolarHBondContact O-CB 3.44Å; K713-W716 PolarHBondContact O-N 3.09Å; D714-W716 VanDerWaalsContact C-N 3.25Å; D714-W716 PolarHBondContact O-N 3.21Å
717	I	82.3	Confident	75.5	Confident	29.3333 Å²	29.3333	50.7 Å²	50.7	15%	0.15	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	110.1	174.8	-53.5	171.4	0	0	0	108.4	K695 A696 I697 W698 F719 Y729	K695-I717 HydrophobicContact CD-CD1 4.45Å; K695-I717 VanDerWaalsContact CE-CD1 3.45Å; K695-I717 HydrophobicContact CG-CD1 4.29Å; A696-I717 PolarHBondContact O-N 3.18Å; I697-I717 WeakPolarHBondContact CA-O 3.3Å; I697-I717 HydrophobicContact CG1-CB 4.39Å; I697-I717 HydrophobicContact CG1-CD1 4.37Å; W698-I717 PolarHBondContact N-O 3.18Å; I717-F719 HydrophobicContact CB-CE1 4.22Å; I717-F719 HydrophobicContact CB-CE2 4.37Å; I717-F719 HydrophobicContact CG2-CD1 3.9Å; I717-F719 HydrophobicContact CG2-CD2 4.19Å; I717-F719 HydrophobicContact CG2-CE1 3.85Å; I717-F719 VanDerWaalsContact CG2-CE1 3.44Å; I717-F719 HydrophobicContact CG2-CE2 3.46Å; I717-F719 VanDerWaalsContact CG2-CE2 3.46Å; I717-F719 HydrophobicContact CG2-CZ 3.92Å; I717-Y729 HydrophobicContact CD1-CE1 3.87Å; I717-Y729 WeakPolarHBondContact CD1-OH 3.32Å; I717-Y729 HydrophobicContact CG2-CE1 3.89Å
718	E	82.6	Confident	75.4	Confident	54.3333 Å²	54.3333	52.7 Å²	52.7	25%	0.254	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	126.3	178	-176	177.7	178.8	0	0	111.4	W698 N700 K713 K720	W698-E718 HydrophobicContact CD2-CG 4.5Å; W698-E718 HydrophobicContact CE3-CB 4.26Å; W698-E718 HydrophobicContact CE3-CG 3.73Å; W698-E718 VanDerWaalsContact CZ3-CD 3.47Å; W698-E718 HydrophobicContact CZ3-CG 4.01Å; W698-E718 VanDerWaalsContact CZ3-OE1 3.29Å; W698-E718 WeakPolarHBondContact CZ3-OE1 2.89Å; W698-E718 CarbonylContact O-C 3.46Å; W698-E718 WeakPolarHBondContact O-CA 3.4Å; N700-E718 HydrophobicContact CB-CG 4.25Å; N700-E718 WeakPolarHBondContact CB-OE1 2.74Å; N700-E718 PolarHBondContact ND2-OE1 3.15Å; K713-E718 IonicContact NZ-OE1 3.69Å; K713-E718 IonicContact NZ-OE2 3.12Å; K713-E718 PolarHBondContact NZ-OE2 3.19Å; E718-K720 VanDerWaalsContact CD-CE 3.49Å; E718-K720 HydrophobicContact CG-CG 4.42Å; E718-K720 WeakPolarHBondContact OE1-CE 3.48Å; E718-K720 IonicContact OE1-NZ 3.01Å
719	F	78.1	Confident	75.4	Confident	20.3333 Å²	20.3333	54.4 Å²	54.4	9%	0.089	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	125.7	169	-51.4	-77.1	0	0	0	110.4	I164 I697 W698 G699 N700 I717 I726 Y729 I730	I164-F719 HydrophobicContact CD1-CE1 4.15Å; I697-F719 HydrophobicContact CB-CE2 4.4Å; I697-F719 HydrophobicContact CB-CZ 4.18Å; I697-F719 HydrophobicContact CD1-CZ 4.33Å; I697-F719 HydrophobicContact CG1-CZ 4.27Å; I697-F719 HydrophobicContact CG2-CD2 3.75Å; I697-F719 HydrophobicContact CG2-CE1 4.13Å; I697-F719 HydrophobicContact CG2-CE2 3.37Å; I697-F719 VanDerWaalsContact CG2-CE2 3.49Å; I697-F719 HydrophobicContact CG2-CZ 3.01Å; W698-F719 PolarHBondContact O-N 3.04Å; G699-F719 CarbonylContact C-O 3.53Å; G699-F719 WeakPolarHBondContact CA-O 3.22Å; N700-F719 WeakPolarHBondContact CA-O 3.5Å; N700-F719 PolarHBondContact N-O 3.14Å; I717-F719 HydrophobicContact CB-CE1 4.22Å; I717-F719 HydrophobicContact CB-CE2 4.37Å; I717-F719 HydrophobicContact CG2-CD1 3.9Å; I717-F719 HydrophobicContact CG2-CD2 4.19Å; I717-F719 HydrophobicContact CG2-CE1 3.85Å; I717-F719 VanDerWaalsContact CG2-CE1 3.44Å; I717-F719 HydrophobicContact CG2-CE2 3.46Å; I717-F719 VanDerWaalsContact CG2-CE2 3.46Å; I717-F719 HydrophobicContact CG2-CZ 3.92Å; F719-I726 HydrophobicContact CB-CD1 3.75Å; F719-I726 VanDerWaalsContact CB-CD1 3.46Å; F719-I726 HydrophobicContact CB-CG1 4.2Å; F719-I726 HydrophobicContact CB-CG2 4Å; F719-I726 HydrophobicContact CD1-CD1 4.21Å; F719-I726 HydrophobicContact CD1-CG1 4.17Å; F719-I726 HydrophobicContact CD1-CG2 4.21Å; F719-I726 HydrophobicContact CD2-CD1 3.8Å; F719-I726 HydrophobicContact CD2-CG1 4Å; F719-I726 HydrophobicContact CD2-CG2 3.74Å; F719-I726 HydrophobicContact CE1-CG1 4.31Å; F719-I726 HydrophobicContact CE2-CD1 4.18Å; F719-I726 HydrophobicContact CE2-CG1 3.94Å; F719-I726 HydrophobicContact CE2-CG2 3.91Å; F719-I726 VanDerWaalsContact CE2-CG2 3.42Å; F719-I726 HydrophobicContact CG-CD1 3.74Å; F719-I726 VanDerWaalsContact CG-CD1 3.41Å; F719-I726 HydrophobicContact CG-CG1 4.08Å; F719-I726 HydrophobicContact CG-CG2 3.96Å; F719-I726 HydrophobicContact CZ-CG1 4.3Å; F719-I726 HydrophobicContact CZ-CG2 3.89Å; F719-Y729 HydrophobicContact CE1-CD1 4.41Å; F719-Y729 HydrophobicContact CE1-CG 4.24Å; F719-Y729 AromaticContact CE2-CD1 3.68Å; F719-Y729 HydrophobicContact CE2-CD1 3.68Å; F719-Y729 AromaticContact CE2-CE1 3.94Å; F719-Y729 HydrophobicContact CE2-CE1 3.94Å; F719-Y729 HydrophobicContact CE2-CG 4.4Å; F719-Y729 AromaticContact CZ-CD1 3.28Å; F719-Y729 HydrophobicContact CZ-CD1 3.28Å; F719-Y729 HydrophobicContact CZ-CD2 4.2Å; F719-Y729 AromaticContact CZ-CE1 3.65Å; F719-Y729 HydrophobicContact CZ-CE1 3.65Å; F719-Y729 HydrophobicContact CZ-CE2 4.5Å; F719-Y729 AromaticContact CZ-CG 3.58Å; F719-Y729 HydrophobicContact CZ-CG 3.99Å; F719-I730 HydrophobicContact CE2-CD1 4.2Å; F719-I730 HydrophobicContact CE2-CG1 4.3Å; F719-I730 HydrophobicContact CZ-CD1 4.45Å; F719-I730 HydrophobicContact CZ-CG1 4.01Å
720	K	74.7	Confident	75.7	Confident	106.333 Å²	106.333	46.3 Å²	46.3	46%	0.462	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	139.3	175.8	-68.6	-176.5	176.3	-177.6	0	111.8	V165 N700 D705 E718	V165-K720 HydrophobicContact CB-CB 4.15Å; V165-K720 WeakPolarHBondContact CB-O 3.48Å; V165-K720 HydrophobicContact CG1-CB 3.73Å; V165-K720 WeakPolarHBondContact CG1-O 3.31Å; V165-K720 HydrophobicContact CG2-CB 4.1Å; V165-K720 WeakPolarHBondContact CG2-O 3.44Å; N700-K720 HydrophobicContact CB-CG 4.2Å; N700-K720 CarbonylContact O-C 3.52Å; N700-K720 WeakPolarHBondContact O-CA 3.33Å; D705-K720 WeakPolarHBondContact OD1-CE 3.39Å; D705-K720 IonicContact OD1-NZ 3.38Å; D705-K720 PolarHBondContact OD1-NZ 3.25Å; D705-K720 IonicContact OD2-NZ 2.8Å; D705-K720 PolarHBondContact OD2-NZ 3.46Å; E718-K720 VanDerWaalsContact CD-CE 3.49Å; E718-K720 HydrophobicContact CG-CG 4.42Å; E718-K720 WeakPolarHBondContact OE1-CE 3.48Å; E718-K720 IonicContact OE1-NZ 3.01Å
721	G	68.8	Low	76.1	Confident	21.3333 Å²	21.3333	42.6 Å²	42.6	22%	0.22	23%	0.232	C	C	.	.	S	Bend	trans	87.5	-168.8	170	0	0	0	0	0	116.1	N700 L701	N700-G721 PolarHBondContact O-N 3.18Å; L701-G721 VanDerWaalsContact CD2-O 3.24Å; L701-G721 WeakPolarHBondContact CD2-O 3.35Å
722	C	67.9	Low	76.1	Confident	51 Å²	51	43.2 Å²	43.2	35%	0.345	23%	0.234	S	C	.	.			trans	-113.1	57.7	-163.2	-31.5	0	0	0	0	113.6	Y564 L568	Y564-C722 HydrophobicContact CE1-CB 3.99Å; L568-C722 HydrophobicContact CD1-CB 4.14Å; L568-C722 HydrophobicContact CD2-CB 3.45Å; L568-C722 WeakPolarHBondContact CD2-SG 3.11Å; L568-C722 HydrophobicContact CG-CB 4.28Å
723	T	73.1	Confident	75.3	Confident	30 Å²	30	42.7 Å²	42.7	18%	0.184	23%	0.229	C	C	.	.			trans	-111.4	138	178.3	106.6	0	0	0	0	111.3	I164 F449 Q725 I726	I164-T723 HydrophobicContact CG2-CG2 3.69Å; F449-T723 HydrophobicContact CE1-CG2 3.72Å; F449-T723 HydrophobicContact CZ-CG2 3.8Å; T723-Q725 PolarHBondContact O-N 3.12Å; T723-Q725 WeakPolarHBondContact OG1-CB 3.37Å; T723-Q725 PolarHBondContact OG1-N 3.22Å; T723-I726 WeakPolarHBondContact O-CB 3.24Å; T723-I726 WeakPolarHBondContact O-CD1 3.09Å; T723-I726 WeakPolarHBondContact O-CG1 3.28Å; T723-I726 VanDerWaalsContact O-CG2 3.31Å; T723-I726 WeakPolarHBondContact O-CG2 3.37Å; T723-I726 PolarHBondContact O-N 3.1Å; T723-I726 VanDerWaalsContact O-N 3.15Å; T723-I726 WeakPolarHBondContact OG1-CG1 3.49Å
724	D	74.8	Confident	74.6	Confident	10 Å²	10	43 Å²	43	5%	0.053	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-12.2	172.4	53.2	-11.4	0	0	0	113.5	F449 P450 F451 L536 L572 M575 I726 L727	F449-D724 WeakPolarHBondContact CB-OD1 3.06Å; F449-D724 VanDerWaalsContact CB-OD2 3.3Å; F449-D724 WeakPolarHBondContact CB-OD2 3.39Å; F449-D724 WeakPolarHBondContact CD1-OD1 3.45Å; P450-D724 VanDerWaalsContact CD-CB 3.47Å; P450-D724 WeakPolarHBondContact CD-OD2 3.33Å; P450-D724 HydrophobicContact CG-CB 3.6Å; P450-D724 VanDerWaalsContact N-OD2 3.08Å; F451-D724 HydrophobicContact CB-CB 4.49Å; F451-D724 VanDerWaalsContact CB-OD2 3.22Å; F451-D724 WeakPolarHBondContact CB-OD2 3.16Å; F451-D724 HydrophobicContact CD1-CB 3.65Å; F451-D724 WeakPolarHBondContact CD1-OD2 3.07Å; F451-D724 HydrophobicContact CD2-CB 3.93Å; F451-D724 HydrophobicContact CE1-CB 3.78Å; F451-D724 HydrophobicContact CE2-CB 4.03Å; F451-D724 HydrophobicContact CG-CB 3.76Å; F451-D724 VanDerWaalsContact CG-CG 3.42Å; F451-D724 VanDerWaalsContact CG-OD2 3.3Å; F451-D724 WeakPolarHBondContact CG-OD2 3.46Å; F451-D724 HydrophobicContact CZ-CB 3.97Å; F451-D724 PolarHBondContact N-OD2 2.89Å; L536-D724 HydrophobicContact CD1-CB 4.37Å; L536-D724 HydrophobicContact CD2-CB 4.34Å; L536-D724 WeakPolarHBondContact CD2-O 3.22Å; L572-D724 HydrophobicContact CD2-CB 4.37Å; M575-D724 HydrophobicContact CE-CB 4.39Å; D724-I726 PolarHBondContact O-N 3.01Å; D724-I726 VanDerWaalsContact O-N 3.12Å; D724-L727 HydrophobicContact CB-CD1 4.21Å; D724-L727 VanDerWaalsContact O-CB 3.28Å; D724-L727 WeakPolarHBondContact O-CB 3.32Å; D724-L727 PolarHBondContact O-N 3.26Å
725	Q	74.8	Confident	74	Confident	55.3333 Å²	55.3333	41.9 Å²	41.9	26%	0.259	23%	0.225	S	C	.	.	H	α-helix	trans	-57.1	-25.2	169.2	-70.5	-148.3	-35.1	0	0	112.3	I164 L203 F449 T723 L727 R728 Y729	I164-Q725 HydrophobicContact CG2-CB 4.46Å; L203-Q725 PolarHBondContact O-NE2 3.07Å; L203-Q725 PolarHBondContact O-OE1 3Å; F449-Q725 HydrophobicContact CD1-CG 4.47Å; F449-Q725 HydrophobicContact CD2-CG 4.35Å; F449-Q725 HydrophobicContact CE1-CG 4.11Å; F449-Q725 HydrophobicContact CE2-CG 3.98Å; F449-Q725 HydrophobicContact CZ-CG 3.86Å; T723-Q725 PolarHBondContact O-N 3.12Å; T723-Q725 WeakPolarHBondContact OG1-CB 3.37Å; T723-Q725 PolarHBondContact OG1-N 3.22Å; Q725-L727 PolarHBondContact O-N 3.21Å; Q725-R728 WeakPolarHBondContact O-CA 3.3Å; Q725-R728 VanDerWaalsContact O-CB 3.26Å; Q725-R728 WeakPolarHBondContact O-CB 3.34Å; Q725-R728 PolarHBondContact O-N 3.26Å; Q725-R728 VanDerWaalsContact O-N 3.12Å; Q725-R728 VanDerWaalsContact OE1-CZ 3.27Å; Q725-Y729 WeakPolarHBondContact O-CD2 3.47Å; Q725-Y729 PolarHBondContact O-N 3.36Å
726	I	76.4	Confident	73.2	Confident	11.6667 Å²	11.6667	44 Å²	44	6%	0.06	22%	0.224	C	C	.	.	H	α-helix	trans	-55.9	-35.8	172.9	-98.4	166.7	0	0	0	111.6	L572 F673 I697 F719 T723 D724 R728 Y729 I730	L572-I726 HydrophobicContact CD2-CG2 4.24Å; F673-I726 HydrophobicContact CE1-CD1 4.21Å; F673-I726 HydrophobicContact CE1-CG2 4.35Å; I697-I726 HydrophobicContact CG2-CD1 4.46Å; F719-I726 HydrophobicContact CB-CD1 3.75Å; F719-I726 VanDerWaalsContact CB-CD1 3.46Å; F719-I726 HydrophobicContact CB-CG1 4.2Å; F719-I726 HydrophobicContact CB-CG2 4Å; F719-I726 HydrophobicContact CD1-CD1 4.21Å; F719-I726 HydrophobicContact CD1-CG1 4.17Å; F719-I726 HydrophobicContact CD1-CG2 4.21Å; F719-I726 HydrophobicContact CD2-CD1 3.8Å; F719-I726 HydrophobicContact CD2-CG1 4Å; F719-I726 HydrophobicContact CD2-CG2 3.74Å; F719-I726 HydrophobicContact CE1-CG1 4.31Å; F719-I726 HydrophobicContact CE2-CD1 4.18Å; F719-I726 HydrophobicContact CE2-CG1 3.94Å; F719-I726 HydrophobicContact CE2-CG2 3.91Å; F719-I726 VanDerWaalsContact CE2-CG2 3.42Å; F719-I726 HydrophobicContact CG-CD1 3.74Å; F719-I726 VanDerWaalsContact CG-CD1 3.41Å; F719-I726 HydrophobicContact CG-CG1 4.08Å; F719-I726 HydrophobicContact CG-CG2 3.96Å; F719-I726 HydrophobicContact CZ-CG1 4.3Å; F719-I726 HydrophobicContact CZ-CG2 3.89Å; T723-I726 WeakPolarHBondContact O-CB 3.24Å; T723-I726 WeakPolarHBondContact O-CD1 3.09Å; T723-I726 WeakPolarHBondContact O-CG1 3.28Å; T723-I726 VanDerWaalsContact O-CG2 3.31Å; T723-I726 WeakPolarHBondContact O-CG2 3.37Å; T723-I726 PolarHBondContact O-N 3.1Å; T723-I726 VanDerWaalsContact O-N 3.15Å; T723-I726 WeakPolarHBondContact OG1-CG1 3.49Å; D724-I726 PolarHBondContact O-N 3.01Å; D724-I726 VanDerWaalsContact O-N 3.12Å; I726-R728 VanDerWaalsContact C-N 3.31Å; I726-R728 PolarHBondContact O-N 3.03Å; I726-Y729 CarbonylContact O-C 3.58Å; I726-Y729 WeakPolarHBondContact O-CA 3.49Å; I726-Y729 WeakPolarHBondContact O-CB 3.29Å; I726-Y729 PolarHBondContact O-N 2.93Å; I726-Y729 VanDerWaalsContact O-N 3.09Å; I726-I730 HydrophobicContact CD1-CD1 4.31Å; I726-I730 HydrophobicContact CG1-CD1 3.88Å; I726-I730 HydrophobicContact CG1-CG1 4.22Å; I726-I730 HydrophobicContact CG2-CD1 3.97Å; I726-I730 HydrophobicContact CG2-CG1 4.14Å; I726-I730 VanDerWaalsContact O-CG1 3.29Å; I726-I730 WeakPolarHBondContact O-CG1 3.15Å; I726-I730 PolarHBondContact O-N 3.34Å
727	L	81	Confident	72	Confident	0.666667 Å²	0.666667	47.3 Å²	47.3	0%	0.003	24%	0.239	C	C	.	.	H	α-helix	trans	-63.9	-30.7	178.5	-61.6	172	0	0	0	111.8	L536 I539 M575 C576 I579 F673 D724 Q725 Y729 I730 A731	L536-L727 HydrophobicContact CD1-CB 4.27Å; L536-L727 HydrophobicContact CD1-CD1 3.77Å; L536-L727 HydrophobicContact CD2-CB 4.44Å; I539-L727 HydrophobicContact CD1-CD2 4.37Å; M575-L727 HydrophobicContact CB-CD1 3.9Å; M575-L727 HydrophobicContact CE-CD1 3.77Å; M575-L727 HydrophobicContact SD-CD1 4.38Å; C576-L727 HydrophobicContact CB-CD2 3.89Å; I579-L727 HydrophobicContact CD1-CD1 4.22Å; F673-L727 HydrophobicContact CZ-CD2 4.11Å; D724-L727 HydrophobicContact CB-CD1 4.21Å; D724-L727 VanDerWaalsContact O-CB 3.28Å; D724-L727 WeakPolarHBondContact O-CB 3.32Å; D724-L727 PolarHBondContact O-N 3.26Å; Q725-L727 PolarHBondContact O-N 3.21Å; L727-Y729 VanDerWaalsContact C-N 3.35Å; L727-I730 HydrophobicContact CD2-CD1 4.27Å; L727-A731 WeakPolarHBondContact O-CB 3.42Å; L727-A731 PolarHBondContact O-N 2.95Å; L727-A731 VanDerWaalsContact O-N 3.12Å
728	R	76.7	Confident	71.1	Confident	64.6667 Å²	64.6667	47 Å²	47	24%	0.244	24%	0.238	C	C	.	.	H	α-helix	trans	-65.9	-41.7	171.9	-87.2	-169.6	-178	-177.8	-8.4	111.6	E202 F449 N535 L536 P537 Q725 I726 I730 A731 E732	E202-R728 PolarHBondContact O-NH1 3.4Å; F449-R728 HydrophobicContact CE1-CG 4.25Å; N535-R728 PolarHBondContact O-NE 3.04Å; N535-R728 PolarHBondContact O-NH2 3.4Å; L536-R728 HydrophobicContact CD2-CG 3.74Å; P537-R728 HydrophobicContact CG-CB 4.3Å; P537-R728 HydrophobicContact CG-CG 4.25Å; Q725-R728 WeakPolarHBondContact O-CA 3.3Å; Q725-R728 VanDerWaalsContact O-CB 3.26Å; Q725-R728 WeakPolarHBondContact O-CB 3.34Å; Q725-R728 PolarHBondContact O-N 3.26Å; Q725-R728 VanDerWaalsContact O-N 3.12Å; Q725-R728 VanDerWaalsContact OE1-CZ 3.27Å; I726-R728 VanDerWaalsContact C-N 3.31Å; I726-R728 PolarHBondContact O-N 3.03Å; R728-I730 VanDerWaalsContact C-N 3.31Å; R728-I730 PolarHBondContact O-N 3.43Å; R728-A731 WeakPolarHBondContact O-CB 3.33Å; R728-A731 PolarHBondContact O-N 3.02Å; R728-A731 VanDerWaalsContact O-N 3.1Å; R728-E732 PolarHBondContact O-N 3Å
729	Y	76.2	Confident	70.4	Confident	55.6667 Å²	55.6667	47.7 Å²	47.7	22%	0.218	24%	0.243	C	C	.	.	H	α-helix	trans	-69.4	-37.7	178.2	-133.5	-86.4	0	0	0	112.3	S161 I717 F719 Q725 I726 L727 A731 E732 L738	S161-Y729 WeakPolarHBondContact OG-CE2 3.46Å; I717-Y729 HydrophobicContact CD1-CE1 3.87Å; I717-Y729 WeakPolarHBondContact CD1-OH 3.32Å; I717-Y729 HydrophobicContact CG2-CE1 3.89Å; F719-Y729 HydrophobicContact CE1-CD1 4.41Å; F719-Y729 HydrophobicContact CE1-CG 4.24Å; F719-Y729 AromaticContact CE2-CD1 3.68Å; F719-Y729 HydrophobicContact CE2-CD1 3.68Å; F719-Y729 AromaticContact CE2-CE1 3.94Å; F719-Y729 HydrophobicContact CE2-CE1 3.94Å; F719-Y729 HydrophobicContact CE2-CG 4.4Å; F719-Y729 AromaticContact CZ-CD1 3.28Å; F719-Y729 HydrophobicContact CZ-CD1 3.28Å; F719-Y729 HydrophobicContact CZ-CD2 4.2Å; F719-Y729 AromaticContact CZ-CE1 3.65Å; F719-Y729 HydrophobicContact CZ-CE1 3.65Å; F719-Y729 HydrophobicContact CZ-CE2 4.5Å; F719-Y729 AromaticContact CZ-CG 3.58Å; F719-Y729 HydrophobicContact CZ-CG 3.99Å; Q725-Y729 WeakPolarHBondContact O-CD2 3.47Å; Q725-Y729 PolarHBondContact O-N 3.36Å; I726-Y729 CarbonylContact O-C 3.58Å; I726-Y729 WeakPolarHBondContact O-CA 3.49Å; I726-Y729 WeakPolarHBondContact O-CB 3.29Å; I726-Y729 PolarHBondContact O-N 2.93Å; I726-Y729 VanDerWaalsContact O-N 3.09Å; L727-Y729 VanDerWaalsContact C-N 3.35Å; Y729-A731 VanDerWaalsContact C-N 3.27Å; Y729-A731 PolarHBondContact O-N 3.22Å; Y729-E732 WeakPolarHBondContact O-CB 3.49Å; Y729-E732 PolarHBondContact O-N 3.43Å; Y729-E732 VanDerWaalsContact O-N 3.14Å; Y729-L738 HydrophobicContact CD1-CD1 4.22Å; Y729-L738 HydrophobicContact CD1-CD2 3.46Å; Y729-L738 VanDerWaalsContact CD1-CD2 3.46Å; Y729-L738 HydrophobicContact CD1-CG 4.49Å; Y729-L738 HydrophobicContact CD2-CD2 4.23Å; Y729-L738 HydrophobicContact CE1-CD1 3.86Å; Y729-L738 HydrophobicContact CE1-CD2 3.79Å; Y729-L738 HydrophobicContact CE2-CD1 3.73Å; Y729-L738 HydrophobicContact CE2-CD2 3.58Å; Y729-L738 HydrophobicContact CE2-CG 4.26Å; Y729-L738 VanDerWaalsContact OH-CD1 3.25Å; Y729-L738 WeakPolarHBondContact OH-CD1 3.34Å
730	I	79.3	Confident	69.8	Low	0.666667 Å²	0.666667	49.8 Å²	49.8	0%	0.003	25%	0.253	C	S	.	.	H	α-helix	trans	-63.9	-33.8	174.6	-64.9	166	0	0	0	111	I539 K669 V671 F673 I697 F719 I726 L727 R728 E732	I539-I730 HydrophobicContact CD1-CB 4.27Å; I539-I730 HydrophobicContact CD1-CG2 3.81Å; I539-I730 HydrophobicContact CG1-CG2 4.24Å; I539-I730 HydrophobicContact CG2-CG2 3.97Å; K669-I730 VanDerWaalsContact CE-O 3.31Å; K669-I730 WeakPolarHBondContact CE-O 3.48Å; K669-I730 PolarHBondContact NZ-O 3.43Å; K669-I730 VanDerWaalsContact NZ-O 3.14Å; V671-I730 HydrophobicContact CG1-CD1 3.96Å; V671-I730 HydrophobicContact CG2-CD1 4.41Å; V671-I730 HydrophobicContact CG2-CG1 4.4Å; V671-I730 HydrophobicContact CG2-CG2 3.9Å; F673-I730 HydrophobicContact CE1-CD1 4.25Å; F673-I730 HydrophobicContact CZ-CD1 4.03Å; I697-I730 HydrophobicContact CD1-CB 4.34Å; I697-I730 HydrophobicContact CD1-CG1 3.92Å; I697-I730 HydrophobicContact CD1-CG2 4.19Å; I697-I730 HydrophobicContact CG2-CD1 4.46Å; I697-I730 HydrophobicContact CG2-CG1 4.34Å; F719-I730 HydrophobicContact CE2-CD1 4.2Å; F719-I730 HydrophobicContact CE2-CG1 4.3Å; F719-I730 HydrophobicContact CZ-CD1 4.45Å; F719-I730 HydrophobicContact CZ-CG1 4.01Å; I726-I730 HydrophobicContact CD1-CD1 4.31Å; I726-I730 HydrophobicContact CG1-CD1 3.88Å; I726-I730 HydrophobicContact CG1-CG1 4.22Å; I726-I730 HydrophobicContact CG2-CD1 3.97Å; I726-I730 HydrophobicContact CG2-CG1 4.14Å; I726-I730 VanDerWaalsContact O-CG1 3.29Å; I726-I730 WeakPolarHBondContact O-CG1 3.15Å; I726-I730 PolarHBondContact O-N 3.34Å; L727-I730 HydrophobicContact CD2-CD1 4.27Å; R728-I730 VanDerWaalsContact C-N 3.31Å; R728-I730 PolarHBondContact O-N 3.43Å; I730-E732 PolarHBondContact O-N 3.32Å
731	A	77	Confident	69.3	Low	9.33333 Å²	9.33333	48.1 Å²	48.1	8%	0.077	24%	0.244	C	C	.	.	H	α-helix	trans	-67.1	-26.6	177.7	0	0	0	0	0	113	P537 P538 I539 K669 L727 R728 Y729 P733	P537-A731 HydrophobicContact CB-CB 4.24Å; P537-A731 HydrophobicContact CG-CB 3.65Å; P538-A731 WeakPolarHBondContact O-CB 3.44Å; I539-A731 HydrophobicContact CG1-CB 3.87Å; K669-A731 PolarHBondContact NZ-O 3.48Å; L727-A731 WeakPolarHBondContact O-CB 3.42Å; L727-A731 PolarHBondContact O-N 2.95Å; L727-A731 VanDerWaalsContact O-N 3.12Å; R728-A731 WeakPolarHBondContact O-CB 3.33Å; R728-A731 PolarHBondContact O-N 3.02Å; R728-A731 VanDerWaalsContact O-N 3.1Å; Y729-A731 VanDerWaalsContact C-N 3.27Å; Y729-A731 PolarHBondContact O-N 3.22Å; A731-P733 VanDerWaalsContact O-CD 3.32Å; A731-P733 WeakPolarHBondContact O-CD 3.5Å; A731-P733 VanDerWaalsContact O-N 3.16Å
732	E	71.8	Confident	69.5	Low	30.6667 Å²	30.6667	50.4 Å²	50.4	14%	0.143	25%	0.25	C	S	.	.			trans	-67.2	125.6	-180	-67.8	-93.7	-178.1	0	0	111.5	K695 R728 Y729 I730 N734 L738 R741	K695-E732 PolarHBondContact NZ-O 3.13Å; R728-E732 PolarHBondContact O-N 3Å; Y729-E732 WeakPolarHBondContact O-CB 3.49Å; Y729-E732 PolarHBondContact O-N 3.43Å; Y729-E732 VanDerWaalsContact O-N 3.14Å; I730-E732 PolarHBondContact O-N 3.32Å; E732-N734 PolarHBondContact O-N 3.37Å; E732-L738 HydrophobicContact CB-CD2 4.27Å; E732-L738 HydrophobicContact CG-CD1 4.16Å; E732-L738 HydrophobicContact CG-CD2 3.87Å; E732-L738 WeakPolarHBondContact OE2-CA 3.09Å; E732-L738 VanDerWaalsContact OE2-CG 3.29Å; E732-L738 WeakPolarHBondContact OE2-CG 3.4Å; E732-L738 PolarHBondContact OE2-N 2.89Å; E732-R741 WeakPolarHBondContact OE1-CD 3.35Å; E732-R741 IonicContact OE1-CZ 2.67Å; E732-R741 IonicContact OE1-NE 3.66Å; E732-R741 IonicContact OE1-NH1 2.79Å; E732-R741 PolarHBondContact OE1-NH1 2.8Å
733	P	58.7	Low	69.7	Low	55.6667 Å²	55.6667	52.4 Å²	52.4	36%	0.361	25%	0.254	S	S	.	.			trans	-68.8	-46.7	-171.6	23.3	-31	0	0	0	112.6	K695 A731 K737	K695-P733 VanDerWaalsContact NZ-C 3.35Å; K695-P733 PolarHBondContact NZ-O 3.13Å; A731-P733 VanDerWaalsContact O-CD 3.32Å; A731-P733 WeakPolarHBondContact O-CD 3.5Å; A731-P733 VanDerWaalsContact O-N 3.16Å; P733-K737 HydrophobicContact CB-CD 4.2Å; P733-K737 HydrophobicContact CG-CB 4.27Å; P733-K737 HydrophobicContact CG-CD 3.69Å; P733-K737 VanDerWaalsContact CG-CD 3.46Å; P733-K737 VanDerWaalsContact CG-CE 3.47Å; P733-K737 HydrophobicContact CG-CG 4.16Å
734	N	59.6	Low	69.6	Low	88.6667 Å²	88.6667	54.3 Å²	54.3	47%	0.474	26%	0.262	S	S	.	.			trans	-134.3	156.6	-176	-95.7	-5.5	0	0	0	112.3	E732 D736 K737 L738	E732-N734 PolarHBondContact O-N 3.37Å; N734-D736 PolarHBondContact O-N 3.23Å; N734-K737 PolarHBondContact O-N 2.93Å; N734-K737 VanDerWaalsContact O-N 3.08Å; N734-L738 PolarHBondContact O-N 3.49Å
735	E	60.3	Low	69.6	Low	109.333 Å²	109.333	55.7 Å²	55.7	51%	0.511	27%	0.269	S	S	.	.	H	α-helix	trans	-61.8	-34	174.7	-74.3	-175.9	179.8	0	0	111.9	L154 K737 L738 L739	L154-E735 HydrophobicContact CD1-CB 4.33Å; L154-E735 HydrophobicContact CD2-CB 3.76Å; L154-E735 HydrophobicContact CD2-CG 4.47Å; E735-K737 PolarHBondContact O-N 3.29Å; E735-L738 WeakPolarHBondContact O-CA 3.24Å; E735-L738 VanDerWaalsContact O-CB 3.3Å; E735-L738 WeakPolarHBondContact O-CB 3.43Å; E735-L738 PolarHBondContact O-N 3.35Å; E735-L738 VanDerWaalsContact O-N 3.1Å; E735-L739 WeakPolarHBondContact O-CB 3.35Å; E735-L739 PolarHBondContact O-N 3.04Å
736	D	58.1	Low	69.4	Low	94.6667 Å²	94.6667	54.8 Å²	54.8	51%	0.506	27%	0.266	S	S	.	.	H	α-helix	trans	-61.6	-37.2	177.3	-57.3	-28.3	0	0	0	112.5	K150 N734 L738 L739 E740	K150-D736 VanDerWaalsContact CE-CG 3.43Å; K150-D736 WeakPolarHBondContact CE-OD1 3.25Å; K150-D736 IonicContact NZ-OD1 3.05Å; K150-D736 PolarHBondContact NZ-OD1 3.48Å; K150-D736 IonicContact NZ-OD2 2.7Å; K150-D736 PolarHBondContact NZ-OD2 3.5Å; N734-D736 PolarHBondContact O-N 3.23Å; D736-L738 VanDerWaalsContact C-N 3.25Å; D736-L738 PolarHBondContact O-N 3.31Å; D736-L739 CarbonylContact O-C 3.56Å; D736-L739 WeakPolarHBondContact O-CA 3.46Å; D736-L739 WeakPolarHBondContact O-CB 3.39Å; D736-L739 PolarHBondContact O-N 3.02Å; D736-E740 WeakPolarHBondContact O-CB 3.31Å; D736-E740 PolarHBondContact O-N 2.87Å
737	K	60.5	Low	69.2	Low	93.6667 Å²	93.6667	60 Å²	60	41%	0.407	29%	0.289	S	S	.	.	H	α-helix	trans	-70.8	-29.1	176.3	-70.5	-161.5	178.1	-174.6	0	113	P733 N734 E735 L739 E740 R741	P733-K737 HydrophobicContact CB-CD 4.2Å; P733-K737 HydrophobicContact CG-CB 4.27Å; P733-K737 HydrophobicContact CG-CD 3.69Å; P733-K737 VanDerWaalsContact CG-CD 3.46Å; P733-K737 VanDerWaalsContact CG-CE 3.47Å; P733-K737 HydrophobicContact CG-CG 4.16Å; N734-K737 PolarHBondContact O-N 2.93Å; N734-K737 VanDerWaalsContact O-N 3.08Å; E735-K737 PolarHBondContact O-N 3.29Å; K737-L739 VanDerWaalsContact C-N 3.31Å; K737-E740 PolarHBondContact O-N 3.08Å; K737-R741 VanDerWaalsContact O-CB 3.27Å; K737-R741 WeakPolarHBondContact O-CB 3.39Å; K737-R741 PolarHBondContact O-N 3.34Å
738	L	63	Low	68.5	Low	23.3333 Å²	23.3333	63.3 Å²	63.3	12%	0.122	31%	0.307	C	S	.	.	H	α-helix	trans	-68	-38.9	172.4	-108.9	134	0	0	0	110.6	I157 Y198 Y729 E732 N734 E735 D736 E740 R741 I742	I157-L738 HydrophobicContact CG2-CD2 3.59Å; I157-L738 HydrophobicContact CG2-CG 4.21Å; Y198-L738 HydrophobicContact CE1-CD1 4.44Å; Y198-L738 HydrophobicContact CE2-CD1 4.04Å; Y198-L738 WeakPolarHBondContact OH-CD1 3.14Å; Y729-L738 HydrophobicContact CD1-CD1 4.22Å; Y729-L738 HydrophobicContact CD1-CD2 3.46Å; Y729-L738 VanDerWaalsContact CD1-CD2 3.46Å; Y729-L738 HydrophobicContact CD1-CG 4.49Å; Y729-L738 HydrophobicContact CD2-CD2 4.23Å; Y729-L738 HydrophobicContact CE1-CD1 3.86Å; Y729-L738 HydrophobicContact CE1-CD2 3.79Å; Y729-L738 HydrophobicContact CE2-CD1 3.73Å; Y729-L738 HydrophobicContact CE2-CD2 3.58Å; Y729-L738 HydrophobicContact CE2-CG 4.26Å; Y729-L738 VanDerWaalsContact OH-CD1 3.25Å; Y729-L738 WeakPolarHBondContact OH-CD1 3.34Å; E732-L738 HydrophobicContact CB-CD2 4.27Å; E732-L738 HydrophobicContact CG-CD1 4.16Å; E732-L738 HydrophobicContact CG-CD2 3.87Å; E732-L738 WeakPolarHBondContact OE2-CA 3.09Å; E732-L738 VanDerWaalsContact OE2-CG 3.29Å; E732-L738 WeakPolarHBondContact OE2-CG 3.4Å; E732-L738 PolarHBondContact OE2-N 2.89Å; N734-L738 PolarHBondContact O-N 3.49Å; E735-L738 WeakPolarHBondContact O-CA 3.24Å; E735-L738 VanDerWaalsContact O-CB 3.3Å; E735-L738 WeakPolarHBondContact O-CB 3.43Å; E735-L738 PolarHBondContact O-N 3.35Å; E735-L738 VanDerWaalsContact O-N 3.1Å; D736-L738 VanDerWaalsContact C-N 3.25Å; D736-L738 PolarHBondContact O-N 3.31Å; L738-E740 VanDerWaalsContact C-N 3.35Å; L738-R741 PolarHBondContact O-N 2.99Å; L738-I742 HydrophobicContact CD1-CD1 3.98Å; L738-I742 HydrophobicContact CD1-CG1 4.23Å; L738-I742 HydrophobicContact CG-CD1 4.1Å; L738-I742 WeakPolarHBondContact O-CD1 3.28Å; L738-I742 VanDerWaalsContact O-CG1 3.25Å; L738-I742 WeakPolarHBondContact O-CG1 3.38Å; L738-I742 PolarHBondContact O-N 3.32Å; L738-I742 VanDerWaalsContact O-N 3.14Å
739	L	67.3	Low	68.1	Low	69.3333 Å²	69.3333	64.3 Å²	64.3	36%	0.363	31%	0.311	S	S	.	.	H	α-helix	trans	-64.7	-49.2	174	-108.6	132.2	0	0	0	110.9	K150 K153 L154 I157 F191 E735 D736 K737 R741 I742 E743	K150-L739 HydrophobicContact CG-CD2 3.98Å; K153-L739 HydrophobicContact CB-CD1 3.59Å; K153-L739 HydrophobicContact CB-CD2 4.38Å; K153-L739 HydrophobicContact CD-CD1 3.68Å; K153-L739 HydrophobicContact CG-CD1 4.28Å; L154-L739 HydrophobicContact CD2-CB 4.02Å; L154-L739 HydrophobicContact CD2-CD2 4.31Å; L154-L739 HydrophobicContact CG-CD2 4.41Å; I157-L739 HydrophobicContact CD1-CB 4.19Å; I157-L739 HydrophobicContact CD1-CD1 3.69Å; F191-L739 HydrophobicContact CE2-CD1 3.65Å; F191-L739 HydrophobicContact CZ-CD1 3.55Å; E735-L739 WeakPolarHBondContact O-CB 3.35Å; E735-L739 PolarHBondContact O-N 3.04Å; D736-L739 CarbonylContact O-C 3.56Å; D736-L739 WeakPolarHBondContact O-CA 3.46Å; D736-L739 WeakPolarHBondContact O-CB 3.39Å; D736-L739 PolarHBondContact O-N 3.02Å; K737-L739 VanDerWaalsContact C-N 3.31Å; L739-R741 VanDerWaalsContact C-N 3.28Å; L739-R741 PolarHBondContact O-N 3.05Å; L739-I742 CarbonylContact O-C 3.55Å; L739-I742 WeakPolarHBondContact O-CA 3.37Å; L739-I742 WeakPolarHBondContact O-CB 3.13Å; L739-I742 PolarHBondContact O-N 3.32Å; L739-E743 HydrophobicContact CD1-CG 4.31Å; L739-E743 WeakPolarHBondContact O-CB 3.43Å; L739-E743 VanDerWaalsContact O-CG 3.3Å; L739-E743 WeakPolarHBondContact O-CG 3.28Å; L739-E743 PolarHBondContact O-N 2.87Å
740	E	64.9	Low	67.7	Low	63 Å²	63	63.9 Å²	63.9	29%	0.294	32%	0.324	S	S	.	.	H	α-helix	trans	-54.2	-45.1	173.3	-105.6	173.5	-179.9	0	0	111.5	D736 K737 L738 I742 E743 E744 Q843 I914 R917	D736-E740 WeakPolarHBondContact O-CB 3.31Å; D736-E740 PolarHBondContact O-N 2.87Å; K737-E740 PolarHBondContact O-N 3.08Å; L738-E740 VanDerWaalsContact C-N 3.35Å; E740-I742 PolarHBondContact O-N 3.08Å; E740-E743 CarbonylContact O-C 3.54Å; E740-E743 WeakPolarHBondContact O-CA 3.3Å; E740-E743 VanDerWaalsContact O-CB 3.26Å; E740-E743 WeakPolarHBondContact O-CB 3.25Å; E740-E743 PolarHBondContact O-N 3.12Å; E740-E744 WeakPolarHBondContact O-CB 3.47Å; E740-E744 VanDerWaalsContact O-CG 3.31Å; E740-E744 WeakPolarHBondContact O-CG 3.43Å; E740-E744 PolarHBondContact O-N 3Å; E740-Q843 PolarHBondContact OE1-NE2 2.94Å; E740-Q843 PolarHBondContact OE1-OE1 3.39Å; E740-I914 HydrophobicContact CB-CD1 3.72Å; E740-I914 HydrophobicContact CG-CD1 3.66Å; E740-R917 IonicContact OE1-CZ 2.68Å; E740-R917 IonicContact OE1-NH1 3.66Å; E740-R917 PolarHBondContact OE1-NH1 3.42Å; E740-R917 IonicContact OE1-NH2 3.39Å; E740-R917 PolarHBondContact OE1-NH2 3.17Å
741	R	65.6	Low	67.2	Low	71 Å²	71	66.7 Å²	66.7	27%	0.268	34%	0.339	S	S	.	.	H	α-helix	trans	-65	-34.3	178.1	-171	175.1	-175.8	122.4	11	113.1	E202 E732 K737 L738 L739 E743 E744 I745 I748	E202-R741 IonicContact OE1-NH2 2.94Å; E202-R741 PolarHBondContact OE1-NH2 3.05Å; E202-R741 VanDerWaalsContact OE1-NH2 3.12Å; E202-R741 IonicContact OE2-NH2 3.93Å; E732-R741 WeakPolarHBondContact OE1-CD 3.35Å; E732-R741 IonicContact OE1-CZ 2.67Å; E732-R741 IonicContact OE1-NE 3.66Å; E732-R741 IonicContact OE1-NH1 2.79Å; E732-R741 PolarHBondContact OE1-NH1 2.8Å; K737-R741 VanDerWaalsContact O-CB 3.27Å; K737-R741 WeakPolarHBondContact O-CB 3.39Å; K737-R741 PolarHBondContact O-N 3.34Å; L738-R741 PolarHBondContact O-N 2.99Å; L739-R741 VanDerWaalsContact C-N 3.28Å; L739-R741 PolarHBondContact O-N 3.05Å; R741-E743 VanDerWaalsContact C-N 3.27Å; R741-E744 PolarHBondContact O-N 3.03Å; R741-I745 WeakPolarHBondContact O-CG1 3.4Å; R741-I745 PolarHBondContact O-N 3.05Å; R741-I745 VanDerWaalsContact O-N 3.13Å; R741-I748 HydrophobicContact CB-CD1 4.43Å; R741-I748 HydrophobicContact CG-CD1 3.72Å; R741-I748 VanDerWaalsContact CG-CD1 3.43Å
742	I	72.9	Confident	66.1	Low	70.6667 Å²	70.6667	71.1 Å²	71.1	36%	0.362	36%	0.361	S	S	.	.	H	α-helix	trans	-71.5	-37.2	173.7	-69.9	166.9	0	0	0	110	I157 F191 K194 Y198 L738 L739 E740 E744 I745	I157-I742 HydrophobicContact CD1-CD1 3.67Å; I157-I742 HydrophobicContact CG1-CD1 3.63Å; I157-I742 HydrophobicContact CG2-CD1 4.12Å; F191-I742 HydrophobicContact CD2-CG2 4.49Å; F191-I742 HydrophobicContact CE2-CB 4.39Å; F191-I742 HydrophobicContact CE2-CG2 3.69Å; F191-I742 HydrophobicContact CZ-CG2 4Å; K194-I742 HydrophobicContact CB-CG2 4.22Å; K194-I742 WeakPolarHBondContact CB-O 3.47Å; Y198-I742 HydrophobicContact CD1-CD1 3.61Å; Y198-I742 HydrophobicContact CD1-CG1 3.95Å; Y198-I742 HydrophobicContact CD2-CD1 4.29Å; Y198-I742 HydrophobicContact CD2-CG1 3.77Å; Y198-I742 HydrophobicContact CE1-CD1 3.82Å; Y198-I742 HydrophobicContact CE1-CG1 4.36Å; Y198-I742 HydrophobicContact CE2-CD1 4.49Å; Y198-I742 HydrophobicContact CE2-CG1 4.23Å; Y198-I742 HydrophobicContact CG-CD1 3.87Å; Y198-I742 HydrophobicContact CG-CG1 3.64Å; L738-I742 HydrophobicContact CD1-CD1 3.98Å; L738-I742 HydrophobicContact CD1-CG1 4.23Å; L738-I742 HydrophobicContact CG-CD1 4.1Å; L738-I742 WeakPolarHBondContact O-CD1 3.28Å; L738-I742 VanDerWaalsContact O-CG1 3.25Å; L738-I742 WeakPolarHBondContact O-CG1 3.38Å; L738-I742 PolarHBondContact O-N 3.32Å; L738-I742 VanDerWaalsContact O-N 3.14Å; L739-I742 CarbonylContact O-C 3.55Å; L739-I742 WeakPolarHBondContact O-CA 3.37Å; L739-I742 WeakPolarHBondContact O-CB 3.13Å; L739-I742 PolarHBondContact O-N 3.32Å; E740-I742 PolarHBondContact O-N 3.08Å; I742-E744 VanDerWaalsContact C-N 3.33Å; I742-I745 HydrophobicContact CB-CD1 4.37Å; I742-I745 HydrophobicContact CG1-CD1 4.37Å; I742-I745 HydrophobicContact CG2-CD1 4.35Å; I742-I745 WeakPolarHBondContact O-CB 3.42Å; I742-I745 WeakPolarHBondContact O-CG1 3.02Å; I742-I745 WeakPolarHBondContact O-CG2 3.39Å; I742-I745 PolarHBondContact O-N 3.27Å
743	E	71.3	Confident	64.8	Low	91.6667 Å²	91.6667	77.8 Å²	77.8	43%	0.428	39%	0.39	S	S	.	.	H	α-helix	trans	-66.1	-35.5	175.3	-75.2	-173.2	-176.6	0	0	112	K153 F191 K194 L739 E740 R741 I745 I914 R918	K153-E743 IonicContact NZ-OE1 2.8Å; K153-E743 PolarHBondContact NZ-OE1 2.92Å; K153-E743 IonicContact NZ-OE2 2.72Å; F191-E743 HydrophobicContact CD2-CG 4.1Å; F191-E743 HydrophobicContact CE2-CG 3.9Å; K194-E743 PolarHBondContact NZ-O 3.43Å; L739-E743 HydrophobicContact CD1-CG 4.31Å; L739-E743 WeakPolarHBondContact O-CB 3.43Å; L739-E743 VanDerWaalsContact O-CG 3.3Å; L739-E743 WeakPolarHBondContact O-CG 3.28Å; L739-E743 PolarHBondContact O-N 2.87Å; E740-E743 CarbonylContact O-C 3.54Å; E740-E743 WeakPolarHBondContact O-CA 3.3Å; E740-E743 VanDerWaalsContact O-CB 3.26Å; E740-E743 WeakPolarHBondContact O-CB 3.25Å; E740-E743 PolarHBondContact O-N 3.12Å; R741-E743 VanDerWaalsContact C-N 3.27Å; E743-I745 VanDerWaalsContact C-N 3.28Å; E743-I745 PolarHBondContact O-N 3.07Å; E743-I914 HydrophobicContact CB-CD1 4.46Å; E743-I914 WeakPolarHBondContact OE2-CG2 3.47Å; E743-R918 VanDerWaalsContact C-NH2 3.26Å; E743-R918 VanDerWaalsContact CA-NH2 3.34Å; E743-R918 PolarHBondContact O-NH2 3.16Å; E743-R918 IonicContact OE2-CZ 3.92Å; E743-R918 IonicContact OE2-NH1 3.81Å; E743-R918 PolarHBondContact OE2-NH1 3.42Å; E743-R918 IonicContact OE2-NH2 2.88Å; E743-R918 PolarHBondContact OE2-NH2 3.48Å
744	E	72.1	Confident	63.9	Low	71.3333 Å²	71.3333	82.1 Å²	82.1	33%	0.333	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	2.8	176.9	-68	177.5	179.3	0	0	113.7	E740 R741 I742 D746 E747 I748	E740-E744 WeakPolarHBondContact O-CB 3.47Å; E740-E744 VanDerWaalsContact O-CG 3.31Å; E740-E744 WeakPolarHBondContact O-CG 3.43Å; E740-E744 PolarHBondContact O-N 3Å; R741-E744 PolarHBondContact O-N 3.03Å; I742-E744 VanDerWaalsContact C-N 3.33Å; E744-D746 PolarHBondContact O-N 3.03Å; E744-D746 VanDerWaalsContact O-N 3.13Å; E744-E747 WeakPolarHBondContact O-CA 3.29Å; E744-E747 WeakPolarHBondContact O-CB 3.4Å; E744-E747 PolarHBondContact O-N 3.35Å; E744-I748 HydrophobicContact CB-CD1 4.1Å; E744-I748 HydrophobicContact CB-CG1 4.23Å; E744-I748 VanDerWaalsContact O-CG1 3.3Å; E744-I748 WeakPolarHBondContact O-CG1 3.43Å; E744-I748 PolarHBondContact O-N 3.28Å
745	I	73.5	Confident	62.9	Low	39.6667 Å²	39.6667	81.9 Å²	81.9	20%	0.203	41%	0.408	C	S	.	.	H	α-helix	trans	-57.8	-34.4	-173.4	-121.6	168.4	0	0	0	112.4	K194 L197 Y198 R741 I742 E743 E747 I748 Y749	K194-I745 HydrophobicContact CB-CG2 3.76Å; K194-I745 HydrophobicContact CD-CG2 4.46Å; K194-I745 HydrophobicContact CG-CG2 4.07Å; L197-I745 HydrophobicContact CB-CD1 4.32Å; L197-I745 HydrophobicContact CB-CG2 4.45Å; L197-I745 HydrophobicContact CD2-CG1 4.04Å; L197-I745 HydrophobicContact CD2-CG2 4.12Å; L197-I745 HydrophobicContact CG-CD1 4.17Å; L197-I745 HydrophobicContact CG-CG1 4.23Å; Y198-I745 HydrophobicContact CD2-CD1 4.19Å; Y198-I745 HydrophobicContact CG-CD1 4.38Å; Y198-I745 VanDerWaalsContact N-CD1 3.31Å; R741-I745 WeakPolarHBondContact O-CG1 3.4Å; R741-I745 PolarHBondContact O-N 3.05Å; R741-I745 VanDerWaalsContact O-N 3.13Å; I742-I745 HydrophobicContact CB-CD1 4.37Å; I742-I745 HydrophobicContact CG1-CD1 4.37Å; I742-I745 HydrophobicContact CG2-CD1 4.35Å; I742-I745 WeakPolarHBondContact O-CB 3.42Å; I742-I745 WeakPolarHBondContact O-CG1 3.02Å; I742-I745 WeakPolarHBondContact O-CG2 3.39Å; I742-I745 PolarHBondContact O-N 3.27Å; E743-I745 VanDerWaalsContact C-N 3.28Å; E743-I745 PolarHBondContact O-N 3.07Å; I745-E747 VanDerWaalsContact C-N 3.33Å; I745-I748 PolarHBondContact O-N 3.48Å; I745-Y749 HydrophobicContact CD1-CD2 4.4Å; I745-Y749 HydrophobicContact CD1-CE2 4.1Å; I745-Y749 HydrophobicContact CG1-CD2 3.78Å; I745-Y749 HydrophobicContact CG1-CE2 3.76Å; I745-Y749 HydrophobicContact CG2-CD2 4.08Å; I745-Y749 HydrophobicContact CG2-CE2 4.46Å; I745-Y749 WeakPolarHBondContact O-CB 3.43Å; I745-Y749 VanDerWaalsContact O-CD2 3.27Å; I745-Y749 WeakPolarHBondContact O-CD2 3.37Å; I745-Y749 PolarHBondContact O-N 2.98Å; I745-Y749 VanDerWaalsContact O-N 3.1Å
746	D	71.8	Confident	61.6	Low	36.3333 Å²	36.3333	81.6 Å²	81.6	19%	0.194	42%	0.418	C	S	.	.	H	α-helix	trans	-66.5	-38.3	177	-40.9	-29	0	0	0	112.1	K194 K228 Y229 E744 Y749 G750 L751 N752	K194-D746 WeakPolarHBondContact CE-OD1 3.38Å; K194-D746 WeakPolarHBondContact CE-OD2 3.45Å; K194-D746 VanDerWaalsContact NZ-CG 3.25Å; K194-D746 IonicContact NZ-OD1 3.4Å; K194-D746 PolarHBondContact NZ-OD1 3.47Å; K194-D746 IonicContact NZ-OD2 3.79Å; K194-D746 PolarHBondContact NZ-OD2 2.88Å; K228-D746 IonicContact NZ-OD2 2.65Å; K228-D746 PolarHBondContact NZ-OD2 3.45Å; Y229-D746 HydrophobicContact CE1-CB 3.95Å; Y229-D746 PolarHBondContact OH-OD2 2.87Å; E744-D746 PolarHBondContact O-N 3.03Å; E744-D746 VanDerWaalsContact O-N 3.13Å; D746-Y749 CarbonylContact O-C 3.55Å; D746-Y749 PolarHBondContact O-N 3.14Å; D746-G750 CarbonylContact O-C 3.49Å; D746-G750 WeakPolarHBondContact O-CA 3.39Å; D746-G750 PolarHBondContact O-N 2.97Å; D746-G750 VanDerWaalsContact O-N 3.16Å; D746-L751 HydrophobicContact CB-CB 4.09Å; D746-L751 HydrophobicContact CB-CD1 4.4Å; D746-L751 PolarHBondContact O-N 3.27Å; D746-L751 WeakPolarHBondContact OD1-CD1 3.49Å; D746-N752 PolarHBondContact OD2-OD1 3.39Å
747	E	70.5	Confident	60.5	Low	119 Å²	119	82.5 Å²	82.5	56%	0.556	42%	0.415	S	S	*	.	H	α-helix	trans	-70.7	-46.2	175.3	-65.1	-178.9	-176.9	0	0	111.4	E744 I745 Y749 G750 N752 H1335	E744-E747 WeakPolarHBondContact O-CA 3.29Å; E744-E747 WeakPolarHBondContact O-CB 3.4Å; E744-E747 PolarHBondContact O-N 3.35Å; I745-E747 VanDerWaalsContact C-N 3.33Å; E747-Y749 VanDerWaalsContact C-N 3.35Å; E747-Y749 PolarHBondContact O-N 3.11Å; E747-Y749 VanDerWaalsContact O-N 3.07Å; E747-G750 PolarHBondContact O-N 3.04Å; E747-G750 VanDerWaalsContact O-N 3.16Å; E747-N752 WeakPolarHBondContact CG-ND2 3.33Å; E747-H1335 IonicContact OE1-CE1 3.87Å
748	I	67	Low	59.1	Low	71.6667 Å²	71.6667	85.8 Å²	85.8	37%	0.368	43%	0.432	S	S	.	.	H	α-helix	trans	-58.4	-36.3	179.6	-66.9	168.2	0	0	0	111.5	R741 E744 I745	R741-I748 HydrophobicContact CB-CD1 4.43Å; R741-I748 HydrophobicContact CG-CD1 3.72Å; R741-I748 VanDerWaalsContact CG-CD1 3.43Å; E744-I748 HydrophobicContact CB-CD1 4.1Å; E744-I748 HydrophobicContact CB-CG1 4.23Å; E744-I748 VanDerWaalsContact O-CG1 3.3Å; E744-I748 WeakPolarHBondContact O-CG1 3.43Å; E744-I748 PolarHBondContact O-N 3.28Å; I745-I748 PolarHBondContact O-N 3.48Å
749	Y	68.8	Low	57.6	Low	84 Å²	84	91.6 Å²	91.6	33%	0.329	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	4.5	178.1	-69.8	-72	0	0	0	113.9	L197 R201 E202 I745 D746 E747 L751	L197-Y749 HydrophobicContact CD2-CD2 4.16Å; R201-Y749 HydrophobicContact CB-CE1 4.08Å; R201-Y749 HydrophobicContact CB-CE2 3.77Å; R201-Y749 WeakPolarHBondContact CB-OH 3.42Å; R201-Y749 HydrophobicContact CG-CD1 4.45Å; R201-Y749 HydrophobicContact CG-CD2 4.45Å; R201-Y749 HydrophobicContact CG-CE1 4.07Å; R201-Y749 HydrophobicContact CG-CE2 4.11Å; E202-Y749 PolarHBondContact OE1-OH 2.77Å; I745-Y749 HydrophobicContact CD1-CD2 4.4Å; I745-Y749 HydrophobicContact CD1-CE2 4.1Å; I745-Y749 HydrophobicContact CG1-CD2 3.78Å; I745-Y749 HydrophobicContact CG1-CE2 3.76Å; I745-Y749 HydrophobicContact CG2-CD2 4.08Å; I745-Y749 HydrophobicContact CG2-CE2 4.46Å; I745-Y749 WeakPolarHBondContact O-CB 3.43Å; I745-Y749 VanDerWaalsContact O-CD2 3.27Å; I745-Y749 WeakPolarHBondContact O-CD2 3.37Å; I745-Y749 PolarHBondContact O-N 2.98Å; I745-Y749 VanDerWaalsContact O-N 3.1Å; D746-Y749 CarbonylContact O-C 3.55Å; D746-Y749 PolarHBondContact O-N 3.14Å; E747-Y749 VanDerWaalsContact C-N 3.35Å; E747-Y749 PolarHBondContact O-N 3.11Å; E747-Y749 VanDerWaalsContact O-N 3.07Å; Y749-L751 PolarHBondContact O-N 3.1Å
750	G	66.4	Low	55.8	Low	49 Å²	49	94.3 Å²	94.3	51%	0.505	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	62	36.1	177.7	0	0	0	0	0	113.9	D746 E747 N752 K753	D746-G750 CarbonylContact O-C 3.49Å; D746-G750 WeakPolarHBondContact O-CA 3.39Å; D746-G750 PolarHBondContact O-N 2.97Å; D746-G750 VanDerWaalsContact O-N 3.16Å; E747-G750 PolarHBondContact O-N 3.04Å; E747-G750 VanDerWaalsContact O-N 3.16Å; G750-N752 PolarHBondContact O-N 2.81Å; G750-K753 WeakPolarHBondContact O-CG 3.4Å; G750-K753 PolarHBondContact O-N 3.14Å
751	L	69.6	Low	54.1	Low	58 Å²	58	98.7 Å²	98.7	30%	0.304	50%	0.496	S	S	.	.			trans	-83.1	10.6	-178.9	-58.1	176.5	0	0	0	111.9	L197 K228 Y229 S232 D746 Y749 K753	L197-L751 HydrophobicContact CD2-CD1 3.53Å; K228-L751 HydrophobicContact CG-CB 4.27Å; Y229-L751 HydrophobicContact CD1-CD1 3.92Å; Y229-L751 HydrophobicContact CE1-CD1 4.13Å; S232-L751 WeakPolarHBondContact OG-CD2 3.36Å; D746-L751 HydrophobicContact CB-CB 4.09Å; D746-L751 HydrophobicContact CB-CD1 4.4Å; D746-L751 PolarHBondContact O-N 3.27Å; D746-L751 WeakPolarHBondContact OD1-CD1 3.49Å; Y749-L751 PolarHBondContact O-N 3.1Å; L751-K753 PolarHBondContact O-N 3.23Å
752	N	54.4	Low	52.3	Low	103.333 Å²	103.333	103.6 Å²	103.6	55%	0.553	52%	0.519	S	S	*	.			trans	-83.6	59	178.8	-69.9	-8.7	0	0	0	112.9	K228 D746 E747 G750 N754	K228-N752 PolarHBondContact NZ-OD1 3.35Å; D746-N752 PolarHBondContact OD2-OD1 3.39Å; E747-N752 WeakPolarHBondContact CG-ND2 3.33Å; G750-N752 PolarHBondContact O-N 2.81Å; N752-N754 PolarHBondContact O-N 2.94Å
753	K	45.2	Very low	50.1	Low	170.333 Å²	170.333	106.3 Å²	106.3	74%	0.741	54%	0.539	S	S	*	.			trans	-99.6	96.4	165	-82.2	-174.3	179.3	179.2	0	110.1	G750 L751 I755	G750-K753 WeakPolarHBondContact O-CG 3.4Å; G750-K753 PolarHBondContact O-N 3.14Å; L751-K753 PolarHBondContact O-N 3.23Å; K753-I755 PolarHBondContact O-N 2.84Å; K753-I755 VanDerWaalsContact O-N 3.09Å
754	N	39.1	Very low	48	Very low	146.333 Å²	146.333	111.1 Å²	111.1	78%	0.783	56%	0.558	S	S	*	*			trans	-61	112.6	166	-72.7	-13.9	0	0	0	111	N752	N752-N754 PolarHBondContact O-N 2.94Å
755	I	38.1	Very low	45.8	Very low	84.6667 Å²	84.6667	113.8 Å²	113.8	43%	0.434	58%	0.579	S	S	.	*			trans	-92.4	103.8	152.7	-54.8	174.7	0	0	0	109.5	K753 Y757 L1066	K753-I755 PolarHBondContact O-N 2.84Å; K753-I755 VanDerWaalsContact O-N 3.09Å; I755-Y757 HydrophobicContact CB-CE2 4.44Å; I755-Y757 HydrophobicContact CG2-CD2 3.59Å; I755-Y757 HydrophobicContact CG2-CE2 3.2Å; I755-Y757 HydrophobicContact CG2-CG 4.49Å; I755-Y757 PolarHBondContact O-N 2.93Å; I755-L1066 HydrophobicContact CD1-CD2 3.74Å; I755-L1066 HydrophobicContact CG2-CD2 4.13Å
756	S	32.9	Very low	43.6	Very low	103 Å²	103	120.4 Å²	120.4	72%	0.72	61%	0.61	S	S	*	*			trans	-71.3	116.8	172.4	144	0	0	0	0	110.3
757	Y	36	Very low	41.4	Very low	113.333 Å²	113.333	127.1 Å²	127.1	44%	0.444	64%	0.64	S	S	.	*			trans	-118	117.7	165.3	-102	-78.3	0	0	0	109.3	I755 F759 P1062 R1180	I755-Y757 HydrophobicContact CB-CE2 4.44Å; I755-Y757 HydrophobicContact CG2-CD2 3.59Å; I755-Y757 HydrophobicContact CG2-CE2 3.2Å; I755-Y757 HydrophobicContact CG2-CG 4.49Å; I755-Y757 PolarHBondContact O-N 2.93Å; Y757-F759 PolarHBondContact O-N 3.05Å; Y757-F759 VanDerWaalsContact O-N 3.12Å; Y757-P1062 HydrophobicContact CD2-CB 4.26Å; Y757-P1062 HydrophobicContact CE2-CB 4.24Å; Y757-R1180 WeakPolarHBondContact OH-CG 3.22Å
758	H	30.2	Very low	39.3	Very low	163.333 Å²	163.333	128.9 Å²	128.9	76%	0.756	65%	0.653	S	S	*	*			trans	-68.7	109.6	172	-85.8	-79.4	0	0	0	110	N760 M1147	H758-N760 PolarHBondContact O-N 3.06Å; H758-M1147 HydrophobicContact CB-CE 4.18Å
759	F	31.8	Very low	37.5	Very low	144.667 Å²	144.667	133.2 Å²	133.2	64%	0.635	68%	0.676	S	S	*	*			trans	-83	111.6	163	-80.3	-93.3	0	0	0	108.9	Y757 L761 I1145	Y757-F759 PolarHBondContact O-N 3.05Å; Y757-F759 VanDerWaalsContact O-N 3.12Å; F759-L761 HydrophobicContact CB-CG 4.28Å; F759-L761 PolarHBondContact O-N 3.14Å; F759-I1145 HydrophobicContact CD1-CD1 3.31Å; F759-I1145 HydrophobicContact CD2-CD1 3.94Å; F759-I1145 HydrophobicContact CE1-CD1 2.91Å; F759-I1145 HydrophobicContact CE1-CG1 4.25Å; F759-I1145 HydrophobicContact CE2-CD1 3.57Å; F759-I1145 HydrophobicContact CG-CD1 3.84Å; F759-I1145 HydrophobicContact CZ-CD1 3.06Å; F759-I1145 HydrophobicContact CZ-CG1 4.44Å
760	N	29.1	Very low	35.4	Very low	126 Å²	126	136.3 Å²	136.3	67%	0.674	70%	0.698	S	S	*	*			trans	-79.7	88.1	171.2	-113.1	-12.9	0	0	0	108.8	H758 K762 M1147 I1151	H758-N760 PolarHBondContact O-N 3.06Å; N760-K762 PolarHBondContact O-N 3.06Å; N760-K762 VanDerWaalsContact O-N 3.11Å; N760-M1147 HydrophobicContact CB-CE 4.05Å; N760-M1147 HydrophobicContact CB-CG 4.32Å; N760-M1147 WeakPolarHBondContact ND2-CE 3.4Å; N760-M1147 PolarHBondContact ND2-SD 3.05Å; N760-I1151 WeakPolarHBondContact ND2-CD1 3.44Å
761	L	30.1	Very low	33.6	Very low	156 Å²	156	141.3 Å²	141.3	82%	0.817	71%	0.713	S	S	*	*			trans	-75.5	82.6	168.2	-84.4	149.8	0	0	0	109.1	F759 T763	F759-L761 HydrophobicContact CB-CG 4.28Å; F759-L761 PolarHBondContact O-N 3.14Å; L761-T763 VanDerWaalsContact C-N 3.28Å; L761-T763 PolarHBondContact O-N 3.09Å; L761-T763 VanDerWaalsContact O-N 3.11Å
762	K	28.1	Very low	31.6	Very low	172.333 Å²	172.333	143.4 Å²	143.4	75%	0.749	73%	0.733	S	S	*	*			trans	-95.4	90.7	162.1	-79.2	-170	175.9	-176.8	0	108.2	N760 K764 I1151	N760-K762 PolarHBondContact O-N 3.06Å; N760-K762 VanDerWaalsContact O-N 3.11Å; K762-K764 VanDerWaalsContact C-N 3.31Å; K762-K764 PolarHBondContact O-N 3.31Å; K762-K764 VanDerWaalsContact O-N 3.1Å; K762-I1151 HydrophobicContact CD-CD1 3.84Å; K762-I1151 HydrophobicContact CD-CG1 4.5Å; K762-I1151 VanDerWaalsContact NZ-CD1 3.35Å; K762-I1151 VanDerWaalsContact NZ-CG1 3.35Å
763	T	26.7	Very low	30.4	Very low	128.667 Å²	128.667	145.1 Å²	145.1	79%	0.789	74%	0.741	S	S	*	*			trans	-95.7	112.5	159.9	33.4	0	0	0	0	109.7	L761 T765	L761-T763 VanDerWaalsContact C-N 3.28Å; L761-T763 PolarHBondContact O-N 3.09Å; L761-T763 VanDerWaalsContact O-N 3.11Å; T763-T765 PolarHBondContact O-N 2.68Å
764	K	26.8	Very low	29.4	Very low	193 Å²	193	144.1 Å²	144.1	84%	0.839	74%	0.743	S	S	*	*			trans	-76.8	99.6	164.8	-80.5	-173.8	172.4	-172.3	0	110.1	K762	K762-K764 VanDerWaalsContact C-N 3.31Å; K762-K764 PolarHBondContact O-N 3.31Å; K762-K764 VanDerWaalsContact O-N 3.1Å
765	T	26.3	Very low	28.9	Very low	126.333 Å²	126.333	142.4 Å²	142.4	78%	0.775	74%	0.74	S	S	*	*			trans	-62.4	122.5	139.9	16.8	0	0	0	0	110.3	T763 E767	T763-T765 PolarHBondContact O-N 2.68Å; T765-E767 PolarHBondContact O-N 2.89Å
766	Q	26.2	Very low	28.5	Very low	178.667 Å²	178.667	144.2 Å²	144.2	84%	0.835	75%	0.745	S	S	*	*			trans	55.2	114.5	155	-81.2	173.2	-29.7	0	0	112.4
767	E	26.4	Very low	28.4	Very low	176.667 Å²	176.667	146 Å²	146	83%	0.826	74%	0.741	S	S	*	*				-133.8	129.2	108.7	-70.2	178.8	160.3	0	0	112.9	T765 L769	T765-E767 PolarHBondContact O-N 2.89Å; E767-L769 PolarHBondContact O-N 3.35Å; E767-L769 VanDerWaalsContact O-N 3.16Å
768	N	26.4	Very low	28	Very low	158 Å²	158	148.4 Å²	148.4	85%	0.845	76%	0.762	S	S	*	*			trans	-67.8	120.9	157.9	-69	-30.4	0	0	0	113.1	D770	N768-D770 PolarHBondContact O-N 2.95Å
769	L	28.1	Very low	28.2	Very low	162 Å²	162	148.6 Å²	148.6	85%	0.848	76%	0.757	S	S	*	*			trans	-94.5	110.7	161.5	-104.6	104.5	0	0	0	108.1	E767 N771	E767-L769 PolarHBondContact O-N 3.35Å; E767-L769 VanDerWaalsContact O-N 3.16Å; L769-N771 PolarHBondContact O-N 3.16Å; L769-N771 VanDerWaalsContact O-N 3.14Å
770	D	25.8	Very low	28.3	Very low	148 Å²	148	146.2 Å²	146.2	79%	0.791	75%	0.747	S	S	*	*			trans	-85.9	121.2	165.8	-84.1	-34.8	0	0	0	109.7	N768 S772	N768-D770 PolarHBondContact O-N 2.95Å; D770-S772 PolarHBondContact O-N 3.22Å
771	N	28.9	Very low	28.7	Very low	153.667 Å²	153.667	149.6 Å²	149.6	82%	0.822	75%	0.75	S	S	*	*			trans	-83.5	78.9	174.2	-76.2	-27.1	0	0	0	110.9	L769 I773	L769-N771 PolarHBondContact O-N 3.16Å; L769-N771 VanDerWaalsContact O-N 3.14Å; N771-I773 PolarHBondContact O-N 3.02Å; N771-I773 VanDerWaalsContact O-N 3.07Å
772	S	26.4	Very low	29.3	Very low	103.667 Å²	103.667	145.3 Å²	145.3	73%	0.725	73%	0.733	S	S	*	*			trans	-102.7	101.5	164.7	63	0	0	0	0	109.6	D770 L774	D770-S772 PolarHBondContact O-N 3.22Å; S772-L774 PolarHBondContact O-N 3.42Å; S772-L774 VanDerWaalsContact O-N 3.09Å
773	I	28.7	Very low	30.3	Very low	138.667 Å²	138.667	139.5 Å²	139.5	71%	0.711	72%	0.722	S	S	*	*			trans	-54.6	119.3	162.8	-62.8	164.9	0	0	0	108.5	N771 P775	N771-I773 PolarHBondContact O-N 3.02Å; N771-I773 VanDerWaalsContact O-N 3.07Å; I773-P775 VanDerWaalsContact O-CD 3.31Å; I773-P775 WeakPolarHBondContact O-CD 3.08Å; I773-P775 VanDerWaalsContact O-N 3.13Å
774	L	25.5	Very low	31.7	Very low	148.667 Å²	148.667	137 Å²	137	78%	0.778	70%	0.698	S	S	*	*			trans	-49.1	127.4	175.6	-84.6	124.8	0	0	0	110.2	S772 K776	S772-L774 PolarHBondContact O-N 3.42Å; S772-L774 VanDerWaalsContact O-N 3.09Å; L774-K776 PolarHBondContact O-N 3.09Å
775	P	27.7	Very low	33.5	Very low	111.333 Å²	111.333	131.7 Å²	131.7	72%	0.723	68%	0.675	S	S	*	*			trans	-65.7	127.6	-178.5	24	-29.2	0	0	0	109.9	I773 H777	I773-P775 VanDerWaalsContact O-CD 3.31Å; I773-P775 WeakPolarHBondContact O-CD 3.08Å; I773-P775 VanDerWaalsContact O-N 3.13Å; P775-H777 PolarHBondContact O-N 3.21Å; P775-H777 VanDerWaalsContact O-N 3.07Å
776	K	30.5	Very low	35.5	Very low	122.667 Å²	122.667	128.4 Å²	128.4	53%	0.533	66%	0.657	S	S	.	*			trans	-53.1	91.4	177.5	-73.7	179.4	175.4	178	0	111.1	L774 D778 Q788 A854 D856	L774-K776 PolarHBondContact O-N 3.09Å; K776-D778 PolarHBondContact O-N 3.07Å; K776-D778 VanDerWaalsContact O-N 3.07Å; K776-Q788 VanDerWaalsContact CE-CD 3.48Å; K776-Q788 VanDerWaalsContact CE-OE1 3.29Å; K776-A854 VanDerWaalsContact CE-O 3.29Å; K776-A854 WeakPolarHBondContact CE-O 3.34Å; K776-A854 PolarHBondContact NZ-O 3.13Å; K776-A854 VanDerWaalsContact NZ-O 3.12Å; K776-D856 IonicContact NZ-OD1 3.63Å; K776-D856 PolarHBondContact NZ-OD1 3.16Å; K776-D856 IonicContact NZ-OD2 3.24Å; K776-D856 PolarHBondContact NZ-OD2 3.11Å
777	H	30.5	Very low	38.1	Very low	140.667 Å²	140.667	119.9 Å²	119.9	65%	0.651	62%	0.617	S	S	*	*			trans	-77	88.7	-177.3	-78.2	-63.8	0	0	0	113.2	P775 Y779	P775-H777 PolarHBondContact O-N 3.21Å; P775-H777 VanDerWaalsContact O-N 3.07Å; H777-Y779 HydrophobicContact CB-CD2 4.49Å; H777-Y779 HydrophobicContact CB-CE2 4.21Å; H777-Y779 WeakPolarHBondContact O-CD2 3.38Å; H777-Y779 VanDerWaalsContact O-CE2 3.26Å; H777-Y779 WeakPolarHBondContact O-CE2 3.38Å; H777-Y779 PolarHBondContact O-N 2.95Å; H777-Y779 VanDerWaalsContact O-N 3.1Å
778	D	27.9	Very low	40.8	Very low	163.333 Å²	163.333	113.6 Å²	113.6	87%	0.873	59%	0.587	S	S	*	*			trans	-78.1	68.6	175.6	-83.2	-24.3	0	0	0	111.6	K776 F780	K776-D778 PolarHBondContact O-N 3.07Å; K776-D778 VanDerWaalsContact O-N 3.07Å; D778-F780 PolarHBondContact O-N 3.43Å; D778-F780 VanDerWaalsContact O-N 3.15Å
779	Y	34	Very low	43.7	Very low	167.667 Å²	167.667	106 Å²	106	66%	0.658	55%	0.547	S	S	*	.			trans	-79	101.2	173.3	-70.5	-82.4	0	0	0	111.4	H777 R781	H777-Y779 HydrophobicContact CB-CD2 4.49Å; H777-Y779 HydrophobicContact CB-CE2 4.21Å; H777-Y779 WeakPolarHBondContact O-CD2 3.38Å; H777-Y779 VanDerWaalsContact O-CE2 3.26Å; H777-Y779 WeakPolarHBondContact O-CE2 3.38Å; H777-Y779 PolarHBondContact O-N 2.95Å; H777-Y779 VanDerWaalsContact O-N 3.1Å; Y779-R781 PolarHBondContact O-N 2.93Å
780	F	34.7	Very low	46.6	Very low	95 Å²	95	98.4 Å²	98.4	42%	0.417	51%	0.507	S	S	.	.			trans	-104.9	114.7	178.4	-63.3	-83.4	0	0	0	114.7	D778 S782 W784 H824 I1046 R1050 Y1054 I1137 E1138	D778-F780 PolarHBondContact O-N 3.43Å; D778-F780 VanDerWaalsContact O-N 3.15Å; F780-S782 VanDerWaalsContact CB-OG 3.28Å; F780-S782 WeakPolarHBondContact CB-OG 3.25Å; F780-S782 PolarHBondContact O-N 3.03Å; F780-W784 HydrophobicContact CB-CB 4.13Å; F780-H824 HydrophobicContact CE2-CB 4.19Å; F780-H824 AromaticContact CE2-CD2 3.39Å; F780-H824 WeakPolarHBondContact CE2-CD2 3.4Å; F780-H824 AromaticContact CE2-CG 3.71Å; F780-H824 AromaticContact CE2-NE2 3.86Å; F780-H824 AromaticContact CZ-CD2 3.19Å; F780-H824 WeakPolarHBondContact CZ-CD2 3.18Å; F780-H824 AromaticContact CZ-CG 3.97Å; F780-H824 AromaticContact CZ-NE2 3.66Å; F780-I1046 HydrophobicContact CE1-CG2 3.84Å; F780-I1046 HydrophobicContact CZ-CG2 3.99Å; F780-R1050 HydrophobicContact CD1-CB 3.93Å; F780-R1050 HydrophobicContact CD1-CG 4.04Å; F780-R1050 HydrophobicContact CE1-CB 4.23Å; F780-Y1054 HydrophobicContact CB-CD2 4.42Å; F780-Y1054 HydrophobicContact CB-CE2 4.2Å; F780-I1137 HydrophobicContact CZ-CG2 4.49Å; F780-E1138 WeakPolarHBondContact CD2-OE2 3.46Å; F780-E1138 VanDerWaalsContact CE2-OE2 3.27Å; F780-E1138 WeakPolarHBondContact CE2-OE2 3.36Å
781	R	36.2	Very low	49.6	Very low	197 Å²	197	91.4 Å²	91.4	74%	0.743	47%	0.469	S	S	*	.			trans	-75.3	99.7	166.7	-84	-174.4	-177.3	-165.4	0.1	111.4	Y779 G783 R1050 I1145	Y779-R781 PolarHBondContact O-N 2.93Å; R781-G783 VanDerWaalsContact C-N 3.27Å; R781-G783 PolarHBondContact O-N 3.29Å; R781-R1050 PolarHBondContact O-NE 3.33Å; R781-R1050 PolarHBondContact O-NH2 3.22Å; R781-I1145 VanDerWaalsContact NH2-CA 3.32Å; R781-I1145 VanDerWaalsContact NH2-CB 3.31Å; R781-I1145 VanDerWaalsContact NH2-CG2 3.27Å
782	S	43.8	Very low	52.5	Low	65.3333 Å²	65.3333	84.1 Å²	84.1	46%	0.457	43%	0.431	S	S	.	.			trans	-38.8	83.1	171.2	60	0	0	0	0	113.3	F780 W784	F780-S782 VanDerWaalsContact CB-OG 3.28Å; F780-S782 WeakPolarHBondContact CB-OG 3.25Å; F780-S782 PolarHBondContact O-N 3.03Å; S782-W784 PolarHBondContact O-N 2.88Å
783	G	47.9	Very low	55.5	Low	50.6667 Å²	50.6667	79.4 Å²	79.4	52%	0.522	40%	0.398	S	S	.	.	S	Bend	trans	54.2	2.6	174.9	0	0	0	0	0	114.7	R781	R781-G783 VanDerWaalsContact C-N 3.27Å; R781-G783 PolarHBondContact O-N 3.29Å
784	W	56.5	Low	58.1	Low	77 Å²	77	73.2 Å²	73.2	29%	0.292	37%	0.366	S	S	.	.			trans	-83.4	127	178.2	-72.3	75.1	0	0	0	111.5	F780 S782 A818 L819 R822 H824 E1051 T1199	F780-W784 HydrophobicContact CB-CB 4.13Å; S782-W784 PolarHBondContact O-N 2.88Å; W784-A818 HydrophobicContact CH2-CB 3.85Å; W784-A818 WeakPolarHBondContact CH2-O 3.12Å; W784-A818 HydrophobicContact CZ3-CB 3.62Å; W784-A818 VanDerWaalsContact CZ3-O 3.32Å; W784-A818 WeakPolarHBondContact CZ3-O 3.37Å; W784-L819 HydrophobicContact CH2-CB 4.02Å; W784-L819 HydrophobicContact CH2-CD2 3.52Å; W784-L819 HydrophobicContact CH2-CG 4.13Å; W784-L819 HydrophobicContact CZ3-CB 4.42Å; W784-L819 HydrophobicContact CZ3-CD2 3.93Å; W784-L819 HydrophobicContact CZ3-CG 4.33Å; W784-R822 CarbonylContact C-O 3.45Å; W784-R822 WeakPolarHBondContact CA-O 3.35Å; W784-R822 HydrophobicContact CD2-CB 4.07Å; W784-R822 HydrophobicContact CE3-CB 4.29Å; W784-R822 HydrophobicContact CG-CB 4.33Å; W784-R822 HydrophobicContact CZ2-CG 4.37Å; W784-H824 AromaticContact CD2-NE2 3.96Å; W784-H824 AromaticContact CE3-CE1 3.61Å; W784-H824 AromaticContact CE3-ND1 3.95Å; W784-H824 AromaticContact CE3-NE2 3.75Å; W784-E1051 PolarHBondContact NE1-O 2.95Å; W784-T1199 HydrophobicContact CZ2-CG2 4.25Å
785	K	63.9	Low	60.3	Low	81.3333 Å²	81.3333	70.6 Å²	70.6	35%	0.354	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	162.8	172.2	-60.9	177.1	-172.7	169	0	109.5	R822 V823 H824 F1019 N1021	K785-R822 PolarHBondContact N-O 3.03Å; K785-V823 HydrophobicContact CB-CG2 4.32Å; K785-V823 CarbonylContact O-C 3.56Å; K785-V823 VanDerWaalsContact O-CA 3.29Å; K785-V823 WeakPolarHBondContact O-CA 3.23Å; K785-H824 PolarHBondContact O-N 3.11Å; K785-F1019 HydrophobicContact CB-CD1 4.12Å; K785-F1019 HydrophobicContact CB-CE1 4.13Å; K785-F1019 HydrophobicContact CD-CD1 3.59Å; K785-F1019 HydrophobicContact CD-CE1 4.21Å; K785-F1019 HydrophobicContact CG-CD1 4.43Å; K785-F1019 PolarHBondContact NZ-O 3.24Å; K785-N1021 PolarHBondContact NZ-OD1 3.02Å; K785-N1021 VanDerWaalsContact NZ-OD1 3.07Å
786	C	69.1	Low	62.5	Low	56.6667 Å²	56.6667	72.4 Å²	72.4	38%	0.383	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	137.9	175.3	-172.9	0	0	0	0	109.6	H824 N826	C786-H824 WeakPolarHBondContact CA-O 3.22Å; C786-H824 PolarHBondContact SG-O 2.99Å; C786-N826 PolarHBondContact SG-ND2 3.01Å; C786-N826 VanDerWaalsContact SG-ND2 3.44Å
787	C	81.6	Confident	65	Low	0 Å²	0	66.7 Å²	66.7	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	120.4	176.4	-179.8	0	0	0	0	109.5	V823 H824 L825 N826 D856 L1015 F1019	C787-V823 HydrophobicContact CB-CG1 3.5Å; C787-V823 VanDerWaalsContact CB-CG1 3.46Å; C787-H824 PolarHBondContact N-O 3.28Å; C787-L825 HydrophobicContact CB-CD1 4.08Å; C787-L825 CarbonylContact O-C 3.59Å; C787-L825 WeakPolarHBondContact O-CA 3.29Å; C787-N826 PolarHBondContact O-N 3.11Å; C787-D856 WeakPolarHBondContact CA-OD2 3.49Å; C787-L1015 HydrophobicContact CB-CD2 4.21Å; C787-L1015 VanDerWaalsContact SG-CD2 3.55Å; C787-F1019 HydrophobicContact CB-CE2 3.57Å; C787-F1019 HydrophobicContact CB-CZ 3.6Å
788	Q	82.3	Confident	67.7	Low	43.6667 Å²	43.6667	60 Å²	60	20%	0.204	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	118.5	173.7	-71.2	-175.5	-31.5	0	0	110.9	K776 N826 I828 A854 D856 I857	K776-Q788 VanDerWaalsContact CE-CD 3.48Å; K776-Q788 VanDerWaalsContact CE-OE1 3.29Å; Q788-N826 WeakPolarHBondContact CA-O 3.38Å; Q788-I828 HydrophobicContact CB-CD1 3.93Å; Q788-I828 HydrophobicContact CG-CD1 4.16Å; Q788-A854 PolarHBondContact OE1-O 3.31Å; Q788-D856 PolarHBondContact N-OD2 2.9Å; Q788-D856 WeakPolarHBondContact O-CA 3.34Å; Q788-D856 WeakPolarHBondContact O-CB 3.32Å; Q788-D856 PolarHBondContact O-N 3.3Å; Q788-I857 PolarHBondContact O-N 2.95Å
789	L	88.4	Confident	70.2	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	104.2	177.3	-176.9	99.2	0	0	0	109	I791 V810 L825 N826 E827 I828 I857 V859 F1007 V1011	L789-I791 HydrophobicContact CD2-CD1 4.07Å; L789-I791 HydrophobicContact CD2-CG1 3.54Å; L789-V810 HydrophobicContact CD2-CB 4.39Å; L789-V810 HydrophobicContact CD2-CG1 4.01Å; L789-V810 HydrophobicContact CD2-CG2 3.61Å; L789-V810 VanDerWaalsContact CD2-CG2 3.5Å; L789-L825 HydrophobicContact CB-CD1 4.04Å; L789-L825 HydrophobicContact CD1-CD1 4.22Å; L789-N826 PolarHBondContact N-O 3.04Å; L789-E827 HydrophobicContact CD2-CB 4.46Å; L789-E827 CarbonylContact O-C 3.54Å; L789-E827 VanDerWaalsContact O-CA 3.26Å; L789-E827 WeakPolarHBondContact O-CA 3.33Å; L789-I828 PolarHBondContact O-N 3.02Å; L789-I857 CarbonylContact C-O 3.51Å; L789-I857 VanDerWaalsContact CA-O 3.31Å; L789-I857 WeakPolarHBondContact CA-O 3.43Å; L789-I857 HydrophobicContact CD1-CB 3.66Å; L789-I857 HydrophobicContact CD1-CG2 3.82Å; L789-I857 VanDerWaalsContact CD1-CG2 3.49Å; L789-I857 HydrophobicContact CG-CB 4.42Å; L789-I857 HydrophobicContact CG-CG2 4.35Å; L789-V859 HydrophobicContact CD1-CG2 3.76Å; L789-V859 VanDerWaalsContact CD1-CG2 3.43Å; L789-V859 HydrophobicContact CD2-CG2 3.73Å; L789-V859 HydrophobicContact CG-CG2 4.09Å; L789-F1007 HydrophobicContact CD1-CZ 4.35Å; L789-F1007 HydrophobicContact CD2-CZ 4.27Å; L789-V1011 HydrophobicContact CD1-CG1 4.21Å; L789-V1011 HydrophobicContact CD1-CG2 4.49Å
790	F	88.6	Confident	72.4	Confident	1.66667 Å²	1.66667	46.7 Å²	46.7	1%	0.007	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	128.3	178.7	-175.4	-95.7	0	0	0	110.7	I828 L830 Q851 A852 S855 I857 F858 V859 E900	F790-I828 HydrophobicContact CD2-CB 3.92Å; F790-I828 HydrophobicContact CD2-CG2 3.7Å; F790-I828 HydrophobicContact CE2-CG2 4.06Å; F790-L830 HydrophobicContact CE2-CD1 3.77Å; F790-L830 HydrophobicContact CE2-CG 4.1Å; F790-L830 HydrophobicContact CZ-CD1 4.06Å; F790-Q851 HydrophobicContact CD2-CB 3.79Å; F790-Q851 HydrophobicContact CE2-CB 3.61Å; F790-Q851 HydrophobicContact CZ-CB 4.43Å; F790-A852 HydrophobicContact CD1-CB 4.36Å; F790-A852 HydrophobicContact CE1-CB 4.1Å; F790-A852 HydrophobicContact CZ-CB 4.41Å; F790-S855 VanDerWaalsContact CB-CB 3.5Å; F790-I857 PolarHBondContact N-O 3.2Å; F790-F858 HydrophobicContact CB-CD2 4.35Å; F790-F858 AromaticContact CD1-CD2 3.51Å; F790-F858 HydrophobicContact CD1-CD2 3.51Å; F790-F858 VanDerWaalsContact CD1-CD2 3.45Å; F790-F858 AromaticContact CD1-CE2 3.36Å; F790-F858 HydrophobicContact CD1-CE2 3.36Å; F790-F858 VanDerWaalsContact CD1-CE2 3.4Å; F790-F858 HydrophobicContact CD1-CZ 4.39Å; F790-F858 HydrophobicContact CE1-CD2 4.26Å; F790-F858 AromaticContact CE1-CE2 3.64Å; F790-F858 HydrophobicContact CE1-CE2 3.64Å; F790-F858 HydrophobicContact CE1-CZ 4.35Å; F790-F858 HydrophobicContact CG-CD2 4.32Å; F790-F858 HydrophobicContact CG-CE2 4.45Å; F790-V859 PolarHBondContact O-N 3.33Å; F790-E900 HydrophobicContact CE1-CG 4.39Å
791	I	88.8	Confident	74.9	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	110.2	179.8	-56.1	170.8	0	0	0	108.8	L789 R802 L805 C806 V810 E827 I828 V859 L861	L789-I791 HydrophobicContact CD2-CD1 4.07Å; L789-I791 HydrophobicContact CD2-CG1 3.54Å; I791-R802 HydrophobicContact CG2-CG 4.16Å; I791-R802 PolarHBondContact O-NH1 3.26Å; I791-R802 PolarHBondContact O-NH2 2.88Å; I791-L805 HydrophobicContact CD1-CB 4.26Å; I791-L805 HydrophobicContact CD1-CD1 4.14Å; I791-L805 HydrophobicContact CG1-CD1 4.44Å; I791-L805 HydrophobicContact CG2-CD1 3.98Å; I791-C806 VanDerWaalsContact CD1-SG 3.53Å; I791-V810 HydrophobicContact CD1-CG2 4.46Å; I791-E827 HydrophobicContact CD1-CB 4.38Å; I791-I828 PolarHBondContact N-O 3.03Å; I791-I828 VanDerWaalsContact N-O 3.12Å; I791-V859 HydrophobicContact CG1-CB 4.45Å; I791-L861 HydrophobicContact CG2-CD1 4.33Å
792	S	90.2	Very high	77.1	Confident	0.666667 Å²	0.666667	33.1 Å²	33.1	1%	0.005	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	130.9	174.6	-177.7	0	0	0	0	110.4	F858 V859 L860 L861 E900	S792-F858 VanDerWaalsContact CB-CZ 3.48Å; S792-V859 PolarHBondContact N-O 3.23Å; S792-L860 CarbonylContact O-C 3.55Å; S792-L860 WeakPolarHBondContact O-CA 3.37Å; S792-L861 PolarHBondContact O-N 2.98Å; S792-E900 VanDerWaalsContact CB-OE2 3.28Å; S792-E900 WeakPolarHBondContact CB-OE2 3.3Å; S792-E900 PolarHBondContact OG-OE2 3.32Å
793	S	88.3	Confident	78.7	Confident	5.33333 Å²	5.33333	33.1 Å²	33.1	4%	0.037	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.6	162.7	171.2	81.5	0	0	0	0	110.1	R802	S793-R802 PolarHBondContact O-NH1 3.41Å; S793-R802 VanDerWaalsContact OG-CD 3.24Å; S793-R802 WeakPolarHBondContact OG-CD 3.22Å; S793-R802 PolarHBondContact OG-NE 3.46Å; S793-R802 PolarHBondContact OG-NH1 3.18Å
794	T	83.4	Confident	80.3	Confident	8.33333 Å²	8.33333	31.8 Å²	31.8	5%	0.051	15%	0.148	C	C	.	.			trans	-66.5	134.2	161.3	44.6	0	0	0	0	109.7	R796 D797 M798 R865 G867 T897	T794-R796 PolarHBondContact O-N 3.27Å; T794-D797 WeakPolarHBondContact CB-OD1 3.25Å; T794-D797 VanDerWaalsContact OG1-CG 3.24Å; T794-D797 PolarHBondContact OG1-OD1 3.35Å; T794-D797 PolarHBondContact OG1-OD2 3.27Å; T794-M798 WeakPolarHBondContact O-CB 3.33Å; T794-M798 PolarHBondContact O-N 2.68Å; T794-R865 HydrophobicContact CG2-CB 4.23Å; T794-G867 VanDerWaalsContact CG2-CA 3.49Å; T794-T897 HydrophobicContact CG2-CG2 4.34Å
795	F	72.6	Confident	81.5	Confident	93.3333 Å²	93.3333	28.1 Å²	28.1	41%	0.409	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-43.5	-170.3	-69.8	-57.8	0	0	0	113.4	D797 H799 R831 T839	F795-D797 VanDerWaalsContact C-N 3.35Å; F795-D797 PolarHBondContact O-N 3.06Å; F795-H799 PolarHBondContact O-CD2 3.13Å; F795-H799 PolarHBondContact O-CE1 3.23Å; F795-H799 VanDerWaalsContact O-CG 3.29Å; F795-H799 PolarHBondContact O-ND1 3.32Å; F795-H799 PolarHBondContact O-NE2 3.02Å; F795-R831 HydrophobicContact CD1-CG 3.81Å; F795-R831 HydrophobicContact CE1-CB 4.39Å; F795-R831 HydrophobicContact CE1-CG 3.6Å; F795-R831 VanDerWaalsContact CE1-CG 3.47Å; F795-R831 PolarHBondContact O-NH2 3.14Å; F795-T839 HydrophobicContact CE2-CG2 4.44Å
796	R	74.1	Confident	82.1	Confident	150 Å²	150	25 Å²	25	57%	0.566	12%	0.122	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-35.3	-168.6	-71.6	-173.6	177.8	-172.8	0.6	114.3	T794 H799	T794-R796 PolarHBondContact O-N 3.27Å; R796-H799 WeakPolarHBondContact CA-NE2 3.46Å; R796-H799 PolarHBondContact O-CD2 3.33Å; R796-H799 VanDerWaalsContact O-CD2 3.24Å; R796-H799 PolarHBondContact O-CE1 3.18Å; R796-H799 PolarHBondContact O-ND1 3.4Å
797	D	82.8	Confident	82	Confident	1.33333 Å²	1.33333	23.4 Å²	23.4	1%	0.007	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-11.9	-169.8	60.5	-49.2	0	0	0	114.1	T794 F795 R865 R938 Y953 F954	T794-D797 WeakPolarHBondContact CB-OD1 3.25Å; T794-D797 VanDerWaalsContact OG1-CG 3.24Å; T794-D797 PolarHBondContact OG1-OD1 3.35Å; T794-D797 PolarHBondContact OG1-OD2 3.27Å; F795-D797 VanDerWaalsContact C-N 3.35Å; F795-D797 PolarHBondContact O-N 3.06Å; D797-R865 HydrophobicContact CB-CG 4.09Å; D797-R938 PolarHBondContact O-NH1 3.04Å; D797-R938 PolarHBondContact O-NH2 3.12Å; D797-R938 IonicContact OD2-NH2 3.92Å; D797-Y953 WeakPolarHBondContact CB-O 3.06Å; D797-F954 HydrophobicContact CB-CB 4.41Å; D797-F954 HydrophobicContact CB-CD1 3.88Å; D797-F954 HydrophobicContact CB-CG 4.46Å
798	M	86.1	Confident	81.6	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.126	C	C	.	.			trans	-119.2	27.6	-175.8	-56.8	-63.8	-107.3	0	0	112.7	T794 A800 E801 R802 R831 L861 L862 R938 Y983	T794-M798 WeakPolarHBondContact O-CB 3.33Å; T794-M798 PolarHBondContact O-N 2.68Å; M798-A800 PolarHBondContact O-N 2.86Å; M798-E801 VanDerWaalsContact C-OE2 3.32Å; M798-E801 VanDerWaalsContact CA-OE2 3.27Å; M798-E801 WeakPolarHBondContact CA-OE2 3.33Å; M798-E801 HydrophobicContact CE-CB 4.32Å; M798-E801 HydrophobicContact CE-CG 4.13Å; M798-E801 HydrophobicContact SD-CG 4.14Å; M798-R802 WeakPolarHBondContact O-CG 3.25Å; M798-R802 PolarHBondContact O-N 2.87Å; M798-R802 VanDerWaalsContact O-N 3.16Å; M798-R831 PolarHBondContact O-NH2 3.5Å; M798-L861 HydrophobicContact CE-CB 3.86Å; M798-L861 HydrophobicContact SD-CB 4.34Å; M798-L862 WeakPolarHBondContact CE-O 3.42Å; M798-R938 HydrophobicContact CE-CB 4.47Å; M798-R938 VanDerWaalsContact SD-CZ 3.55Å; M798-R938 PolarHBondContact SD-NH1 3.24Å; M798-R938 VanDerWaalsContact SD-NH1 3.36Å; M798-Y983 VanDerWaalsContact CE-OH 3.26Å; M798-Y983 WeakPolarHBondContact CE-OH 3.39Å
799	H	79.8	Confident	81.6	Confident	40.3333 Å²	40.3333	23.8 Å²	23.8	19%	0.187	12%	0.118	C	C	.	.	H	α-helix	trans	-64.9	-43.4	-178.1	-50.7	-75.5	0	0	0	112.2	F795 R796 R802 D803 R831 P995 V996	F795-H799 PolarHBondContact O-CD2 3.13Å; F795-H799 PolarHBondContact O-CE1 3.23Å; F795-H799 VanDerWaalsContact O-CG 3.29Å; F795-H799 PolarHBondContact O-ND1 3.32Å; F795-H799 PolarHBondContact O-NE2 3.02Å; R796-H799 WeakPolarHBondContact CA-NE2 3.46Å; R796-H799 PolarHBondContact O-CD2 3.33Å; R796-H799 VanDerWaalsContact O-CD2 3.24Å; R796-H799 PolarHBondContact O-CE1 3.18Å; R796-H799 PolarHBondContact O-ND1 3.4Å; H799-R802 PolarHBondContact O-N 3.45Å; H799-D803 VanDerWaalsContact O-CB 3.27Å; H799-D803 WeakPolarHBondContact O-CB 3.39Å; H799-D803 VanDerWaalsContact O-CG 3.25Å; H799-D803 PolarHBondContact O-N 3.25Å; H799-D803 VanDerWaalsContact O-OD1 3.11Å; H799-R831 VanDerWaalsContact CA-NH2 3.35Å; H799-R831 PolarHBondContact ND1-NH2 2.71Å; H799-R831 PolarHBondContact O-NH1 3.45Å; H799-R831 VanDerWaalsContact O-NH1 3.14Å; H799-P995 PolarHBondContact CE1-O 3.39Å; H799-P995 PolarHBondContact NE2-O 2.88Å; H799-V996 WeakPolarHBondContact NE2-CA 3.5Å
800	A	81.7	Confident	81.2	Confident	12 Å²	12	23.8 Å²	23.8	10%	0.099	12%	0.118	C	C	.	.	H	α-helix	trans	-64.2	-44.8	-178.2	0	0	0	0	0	112.3	M798 R802 D803 L804 V996 M997 L1000	M798-A800 PolarHBondContact O-N 2.86Å; A800-R802 PolarHBondContact O-N 2.91Å; A800-D803 PolarHBondContact O-N 2.95Å; A800-L804 WeakPolarHBondContact O-CB 3.45Å; A800-L804 PolarHBondContact O-N 3.33Å; A800-V996 HydrophobicContact CB-CB 4.43Å; A800-V996 HydrophobicContact CB-CG1 3.74Å; A800-M997 HydrophobicContact CB-CB 4.31Å; A800-M997 WeakPolarHBondContact CB-O 3.28Å; A800-L1000 HydrophobicContact CB-CD1 3.91Å
801	E	87.3	Confident	80.3	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-62.9	-45.1	179	-64.5	86.1	162.1	0	0	110.8	M798 D803 L804 L805 L861 R938 Y983 L1000 F1003	M798-E801 VanDerWaalsContact C-OE2 3.32Å; M798-E801 VanDerWaalsContact CA-OE2 3.27Å; M798-E801 WeakPolarHBondContact CA-OE2 3.33Å; M798-E801 HydrophobicContact CE-CB 4.32Å; M798-E801 HydrophobicContact CE-CG 4.13Å; M798-E801 HydrophobicContact SD-CG 4.14Å; E801-D803 VanDerWaalsContact C-N 3.35Å; E801-D803 PolarHBondContact O-N 3.22Å; E801-L804 WeakPolarHBondContact O-CB 3.25Å; E801-L804 PolarHBondContact O-N 3.18Å; E801-L805 VanDerWaalsContact O-CG 3.29Å; E801-L805 WeakPolarHBondContact O-CG 3.37Å; E801-L805 PolarHBondContact O-N 3.1Å; E801-L861 HydrophobicContact CB-CD1 4.01Å; E801-R938 IonicContact OE1-CZ 3.86Å; E801-R938 IonicContact OE1-NH1 2.9Å; E801-R938 PolarHBondContact OE1-NH1 3.14Å; E801-R938 IonicContact OE2-NH1 2.94Å; E801-Y983 HydrophobicContact CG-CE2 4.41Å; E801-Y983 PolarHBondContact OE1-OH 2.72Å; E801-L1000 HydrophobicContact CB-CD1 4.46Å; E801-L1000 HydrophobicContact CG-CD1 3.96Å; E801-L1000 HydrophobicContact CG-CD2 3.98Å; E801-F1003 HydrophobicContact CB-CD1 4.46Å; E801-F1003 HydrophobicContact CB-CE1 3.89Å; E801-F1003 HydrophobicContact CB-CZ 4.14Å; E801-F1003 HydrophobicContact CG-CD1 4.42Å; E801-F1003 HydrophobicContact CG-CE1 4.3Å
802	R	82	Confident	79.4	Confident	7.25 Å²	7.25	24.9 Å²	24.9	3%	0.027	13%	0.126	C	C	.	.	H	α-helix	trans	-66.7	-39.7	176.3	-96.5	-178.9	128.7	133.1	-3.3	112.6	I791 S793 M798 H799 A800 L804 L805 C806 D829 R831 L861	I791-R802 HydrophobicContact CG2-CG 4.16Å; I791-R802 PolarHBondContact O-NH1 3.26Å; I791-R802 PolarHBondContact O-NH2 2.88Å; S793-R802 PolarHBondContact O-NH1 3.41Å; S793-R802 VanDerWaalsContact OG-CD 3.24Å; S793-R802 WeakPolarHBondContact OG-CD 3.22Å; S793-R802 PolarHBondContact OG-NE 3.46Å; S793-R802 PolarHBondContact OG-NH1 3.18Å; M798-R802 WeakPolarHBondContact O-CG 3.25Å; M798-R802 PolarHBondContact O-N 2.87Å; M798-R802 VanDerWaalsContact O-N 3.16Å; H799-R802 PolarHBondContact O-N 3.45Å; A800-R802 PolarHBondContact O-N 2.91Å; R802-L804 VanDerWaalsContact C-N 3.29Å; R802-L804 PolarHBondContact O-N 3.34Å; R802-L805 WeakPolarHBondContact O-CB 3.42Å; R802-L805 PolarHBondContact O-N 3.09Å; R802-L805 VanDerWaalsContact O-N 3.14Å; R802-C806 WeakPolarHBondContact O-CB 3.36Å; R802-C806 PolarHBondContact O-N 3.17Å; R802-C806 PolarHBondContact O-SG 2.98Å; R802-D829 IonicContact CZ-OD1 3.17Å; R802-D829 VanDerWaalsContact CZ-OD1 3.3Å; R802-D829 IonicContact CZ-OD2 2.84Å; R802-D829 IonicContact NE-OD1 3.07Å; R802-D829 PolarHBondContact NE-OD1 3.09Å; R802-D829 IonicContact NE-OD2 3.38Å; R802-D829 PolarHBondContact NE-OD2 3.41Å; R802-D829 VanDerWaalsContact NH2-CG 3.31Å; R802-D829 IonicContact NH2-OD1 3.15Å; R802-D829 PolarHBondContact NH2-OD1 3.05Å; R802-D829 IonicContact NH2-OD2 3.35Å; R802-R831 VanDerWaalsContact CB-NH1 3.33Å; R802-R831 VanDerWaalsContact CB-NH2 3.3Å; R802-L861 HydrophobicContact CG-CD1 4.01Å
803	D	76.9	Confident	78.8	Confident	64 Å²	64	25 Å²	25	34%	0.342	13%	0.127	S	C	.	.	H	α-helix	trans	-64.2	-39.3	177	-75.4	-5	0	0	0	111	H799 A800 E801 G807 R831 S1387	H799-D803 VanDerWaalsContact O-CB 3.27Å; H799-D803 WeakPolarHBondContact O-CB 3.39Å; H799-D803 VanDerWaalsContact O-CG 3.25Å; H799-D803 PolarHBondContact O-N 3.25Å; H799-D803 VanDerWaalsContact O-OD1 3.11Å; A800-D803 PolarHBondContact O-N 2.95Å; E801-D803 VanDerWaalsContact C-N 3.35Å; E801-D803 PolarHBondContact O-N 3.22Å; D803-G807 VanDerWaalsContact O-CA 3.25Å; D803-G807 WeakPolarHBondContact O-CA 3.42Å; D803-G807 PolarHBondContact O-N 3.2Å; D803-R831 IonicContact OD1-CZ 3.65Å; D803-R831 VanDerWaalsContact OD1-CZ 3.23Å; D803-R831 IonicContact OD1-NH1 3.47Å; D803-R831 PolarHBondContact OD1-NH1 3.29Å; D803-R831 VanDerWaalsContact OD1-NH1 3.14Å; D803-R831 IonicContact OD1-NH2 3.55Å; D803-R831 PolarHBondContact OD1-NH2 2.85Å; D803-S1387 VanDerWaalsContact CG-CB 3.46Å; D803-S1387 VanDerWaalsContact OD2-CB 3.25Å; D803-S1387 WeakPolarHBondContact OD2-CB 3.49Å; D803-S1387 PolarHBondContact OD2-OG 2.94Å
804	L	80.7	Confident	78	Confident	23.25 Å²	23.25	26.5 Å²	26.5	12%	0.122	13%	0.131	C	C	.	.	H	α-helix	trans	-62.8	-45.3	171.5	-179.5	64.7	0	0	0	111.5	A800 E801 R802 I808 L809 L1000 F1003 L1512 I1516	A800-L804 WeakPolarHBondContact O-CB 3.45Å; A800-L804 PolarHBondContact O-N 3.33Å; E801-L804 WeakPolarHBondContact O-CB 3.25Å; E801-L804 PolarHBondContact O-N 3.18Å; R802-L804 VanDerWaalsContact C-N 3.29Å; R802-L804 PolarHBondContact O-N 3.34Å; L804-I808 HydrophobicContact CD1-CB 4.2Å; L804-I808 HydrophobicContact CD1-CD1 4Å; L804-I808 HydrophobicContact CD1-CG1 4.48Å; L804-I808 HydrophobicContact CD1-CG2 4.15Å; L804-I808 WeakPolarHBondContact O-CA 3.38Å; L804-I808 VanDerWaalsContact O-CB 3.29Å; L804-I808 WeakPolarHBondContact O-CB 3.45Å; L804-I808 PolarHBondContact O-N 3.02Å; L804-I808 VanDerWaalsContact O-N 3.08Å; L804-L809 HydrophobicContact CD1-CD1 4.36Å; L804-L809 HydrophobicContact CD1-CG 4.37Å; L804-L809 HydrophobicContact CD2-CD1 4.05Å; L804-L809 HydrophobicContact CG-CD1 3.73Å; L804-L809 HydrophobicContact CG-CD2 4.48Å; L804-L809 HydrophobicContact CG-CG 4.03Å; L804-L809 WeakPolarHBondContact O-CG 3.5Å; L804-L809 PolarHBondContact O-N 3.12Å; L804-L809 VanDerWaalsContact O-N 3.08Å; L804-L1000 HydrophobicContact CD2-CB 3.66Å; L804-L1000 HydrophobicContact CD2-CD1 4.19Å; L804-F1003 HydrophobicContact CD2-CD1 4Å; L804-F1003 HydrophobicContact CD2-CE1 4.33Å; L804-L1512 HydrophobicContact CD1-CD1 4.43Å; L804-L1512 HydrophobicContact CD2-CD2 4.23Å; L804-I1516 HydrophobicContact CD1-CD1 3.82Å; L804-I1516 HydrophobicContact CD1-CG1 4.18Å
805	L	83.7	Confident	76.9	Confident	0 Å²	0	29 Å²	29	0%	0	14%	0.14	C	C	.	.	I	π-helix	trans	-60.3	-58.7	177.1	-73.7	179.2	0	0	0	112.4	I791 E801 R802 L809 V810 V859 L861 F1003 F1007	I791-L805 HydrophobicContact CD1-CB 4.26Å; I791-L805 HydrophobicContact CD1-CD1 4.14Å; I791-L805 HydrophobicContact CG1-CD1 4.44Å; I791-L805 HydrophobicContact CG2-CD1 3.98Å; E801-L805 VanDerWaalsContact O-CG 3.29Å; E801-L805 WeakPolarHBondContact O-CG 3.37Å; E801-L805 PolarHBondContact O-N 3.1Å; R802-L805 WeakPolarHBondContact O-CB 3.42Å; R802-L805 PolarHBondContact O-N 3.09Å; R802-L805 VanDerWaalsContact O-N 3.14Å; L805-L809 HydrophobicContact CD2-CB 4.39Å; L805-L809 HydrophobicContact CD2-CD1 3.82Å; L805-L809 HydrophobicContact CG-CD1 4.43Å; L805-L809 PolarHBondContact O-N 3.12Å; L805-V810 WeakPolarHBondContact O-CB 3.38Å; L805-V810 WeakPolarHBondContact O-CG2 3.42Å; L805-V810 PolarHBondContact O-N 2.89Å; L805-V859 HydrophobicContact CD1-CG1 4.5Å; L805-L861 HydrophobicContact CD1-CD1 3.76Å; L805-L861 HydrophobicContact CD1-CD2 4.23Å; L805-L861 HydrophobicContact CD1-CG 4.37Å; L805-F1003 HydrophobicContact CD1-CE1 4.36Å; L805-F1003 HydrophobicContact CD1-CZ 4.03Å; L805-F1003 HydrophobicContact CD2-CE1 4.13Å; L805-F1003 HydrophobicContact CD2-CZ 3.88Å; L805-F1003 HydrophobicContact CG-CE1 4.06Å; L805-F1003 HydrophobicContact CG-CZ 3.89Å; L805-F1007 HydrophobicContact CD1-CE2 4.33Å; L805-F1007 HydrophobicContact CD2-CB 4.31Å; L805-F1007 HydrophobicContact CD2-CD1 3.41Å; L805-F1007 VanDerWaalsContact CD2-CD1 3.45Å; L805-F1007 HydrophobicContact CD2-CD2 3.39Å; L805-F1007 VanDerWaalsContact CD2-CD2 3.41Å; L805-F1007 HydrophobicContact CD2-CE1 3.4Å; L805-F1007 VanDerWaalsContact CD2-CE1 3.44Å; L805-F1007 HydrophobicContact CD2-CE2 3.39Å; L805-F1007 VanDerWaalsContact CD2-CE2 3.43Å; L805-F1007 HydrophobicContact CD2-CG 3.4Å; L805-F1007 VanDerWaalsContact CD2-CG 3.43Å; L805-F1007 HydrophobicContact CD2-CZ 3.4Å; L805-F1007 VanDerWaalsContact CD2-CZ 3.46Å; L805-F1007 HydrophobicContact CG-CE2 4.5Å
806	C	74.8	Confident	76.6	Confident	15.5 Å²	15.5	27.7 Å²	27.7	11%	0.105	14%	0.138	C	C	.	.	I	π-helix	trans	-75.1	-34.6	-171.9	-61.2	0	0	0	0	112.2	I791 R802 P811 E827 D829	I791-C806 VanDerWaalsContact CD1-SG 3.53Å; R802-C806 WeakPolarHBondContact O-CB 3.36Å; R802-C806 PolarHBondContact O-N 3.17Å; R802-C806 PolarHBondContact O-SG 2.98Å; C806-P811 WeakPolarHBondContact O-CD 3.32Å; C806-P811 VanDerWaalsContact O-CG 3.31Å; C806-P811 WeakPolarHBondContact O-CG 3.37Å; C806-E827 VanDerWaalsContact CA-OE1 3.28Å; C806-E827 WeakPolarHBondContact CA-OE1 3.23Å; C806-E827 WeakPolarHBondContact CB-OE1 3.49Å; C806-E827 PolarHBondContact SG-OE1 3.1Å; C806-D829 PolarHBondContact SG-OD2 3.19Å
807	G	68.5	Low	76.3	Confident	22.75 Å²	22.75	21.1 Å²	21.1	24%	0.235	11%	0.114	C	C	.	.	I	π-helix	trans	-79.1	-37.1	-178.8	0	0	0	0	0	113.4	D803	D803-G807 VanDerWaalsContact O-CA 3.25Å; D803-G807 WeakPolarHBondContact O-CA 3.42Å; D803-G807 PolarHBondContact O-N 3.2Å
808	I	72.8	Confident	75.4	Confident	46.5 Å²	46.5	21.5 Å²	21.5	24%	0.238	12%	0.117	C	C	.	.	I	π-helix	trans	-125.6	-57.9	-166	-61.6	177.4	0	0	0	112.1	L804 P811 A812 Y1515 I1516 T1519	L804-I808 HydrophobicContact CD1-CB 4.2Å; L804-I808 HydrophobicContact CD1-CD1 4Å; L804-I808 HydrophobicContact CD1-CG1 4.48Å; L804-I808 HydrophobicContact CD1-CG2 4.15Å; L804-I808 WeakPolarHBondContact O-CA 3.38Å; L804-I808 VanDerWaalsContact O-CB 3.29Å; L804-I808 WeakPolarHBondContact O-CB 3.45Å; L804-I808 PolarHBondContact O-N 3.02Å; L804-I808 VanDerWaalsContact O-N 3.08Å; I808-P811 WeakPolarHBondContact O-CD 3.22Å; I808-A812 WeakPolarHBondContact O-CB 3.32Å; I808-A812 PolarHBondContact O-N 3.24Å; I808-A812 VanDerWaalsContact O-N 3.12Å; I808-Y1515 HydrophobicContact CG2-CD1 3.79Å; I808-Y1515 HydrophobicContact CG2-CE1 3.39Å; I808-I1516 HydrophobicContact CD1-CB 4.32Å; I808-I1516 HydrophobicContact CD1-CG1 3.92Å; I808-I1516 HydrophobicContact CD1-CG2 4.01Å; I808-T1519 HydrophobicContact CG1-CG2 4.24Å; I808-T1519 HydrophobicContact CG2-CG2 4.3Å
809	L	81.4	Confident	74	Confident	5.5 Å²	5.5	24.9 Å²	24.9	3%	0.029	14%	0.135	C	C	.	.	I	π-helix	trans	-74.7	-46.6	-166.1	-56.8	172.8	0	0	0	113.8	L804 L805 A812 L813 F1003 F1007 L1008 L1512 W1559	L804-L809 HydrophobicContact CD1-CD1 4.36Å; L804-L809 HydrophobicContact CD1-CG 4.37Å; L804-L809 HydrophobicContact CD2-CD1 4.05Å; L804-L809 HydrophobicContact CG-CD1 3.73Å; L804-L809 HydrophobicContact CG-CD2 4.48Å; L804-L809 HydrophobicContact CG-CG 4.03Å; L804-L809 WeakPolarHBondContact O-CG 3.5Å; L804-L809 PolarHBondContact O-N 3.12Å; L804-L809 VanDerWaalsContact O-N 3.08Å; L805-L809 HydrophobicContact CD2-CB 4.39Å; L805-L809 HydrophobicContact CD2-CD1 3.82Å; L805-L809 HydrophobicContact CG-CD1 4.43Å; L805-L809 PolarHBondContact O-N 3.12Å; L809-A812 WeakPolarHBondContact O-CA 3.12Å; L809-A812 VanDerWaalsContact O-CB 3.31Å; L809-A812 WeakPolarHBondContact O-CB 3.29Å; L809-A812 PolarHBondContact O-N 3.03Å; L809-A812 VanDerWaalsContact O-N 3.15Å; L809-L813 PolarHBondContact O-N 3.15Å; L809-F1003 HydrophobicContact CD1-CE1 4.32Å; L809-F1007 HydrophobicContact CB-CD1 3.89Å; L809-F1007 HydrophobicContact CB-CE1 3.96Å; L809-F1007 HydrophobicContact CD1-CB 4.43Å; L809-F1007 HydrophobicContact CD1-CD1 3.95Å; L809-F1007 HydrophobicContact CD1-CG 4.37Å; L809-F1007 HydrophobicContact CG-CD1 4.44Å; L809-L1008 HydrophobicContact CB-CD2 4.06Å; L809-L1008 HydrophobicContact CB-CG 4.43Å; L809-L1008 HydrophobicContact CD2-CD1 3.82Å; L809-L1008 HydrophobicContact CD2-CD2 4.24Å; L809-L1008 HydrophobicContact CD2-CG 3.92Å; L809-L1512 HydrophobicContact CD2-CD1 4.34Å; L809-W1559 HydrophobicContact CD2-CH2 3.77Å; L809-W1559 HydrophobicContact CD2-CZ3 3.84Å
810	V	79.8	Confident	73.1	Confident	0 Å²	0	26 Å²	26	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-66.2	-42.6	177.9	179.4	0	0	0	0	111.8	L789 I791 L805 A812 L813 R814 L825 E827 F1007	L789-V810 HydrophobicContact CD2-CB 4.39Å; L789-V810 HydrophobicContact CD2-CG1 4.01Å; L789-V810 HydrophobicContact CD2-CG2 3.61Å; L789-V810 VanDerWaalsContact CD2-CG2 3.5Å; I791-V810 HydrophobicContact CD1-CG2 4.46Å; L805-V810 WeakPolarHBondContact O-CB 3.38Å; L805-V810 WeakPolarHBondContact O-CG2 3.42Å; L805-V810 PolarHBondContact O-N 2.89Å; V810-A812 VanDerWaalsContact C-N 3.28Å; V810-A812 PolarHBondContact O-N 3.09Å; V810-L813 PolarHBondContact O-N 3.15Å; V810-R814 WeakPolarHBondContact O-CB 3.41Å; V810-R814 WeakPolarHBondContact O-CG 3.38Å; V810-R814 PolarHBondContact O-N 3.18Å; V810-L825 HydrophobicContact CG1-CD2 3.82Å; V810-L825 HydrophobicContact CG1-CG 4.3Å; V810-E827 HydrophobicContact CG1-CB 4.15Å; V810-E827 HydrophobicContact CG1-CG 4.39Å; V810-E827 WeakPolarHBondContact CG1-OE2 3.36Å; V810-F1007 HydrophobicContact CG2-CE1 4.14Å; V810-F1007 HydrophobicContact CG2-CZ 4.01Å
811	P	69.9	Low	72.3	Confident	16.25 Å²	16.25	27.1 Å²	27.1	11%	0.106	16%	0.161	C	C	.	.	H	α-helix	trans	-55.4	-37.1	169.2	-28.9	36.8	0	0	0	113.7	C806 I808 R814 R815	C806-P811 WeakPolarHBondContact O-CD 3.32Å; C806-P811 VanDerWaalsContact O-CG 3.31Å; C806-P811 WeakPolarHBondContact O-CG 3.37Å; I808-P811 WeakPolarHBondContact O-CD 3.22Å; P811-R814 PolarHBondContact O-N 3.04Å; P811-R815 VanDerWaalsContact C-NH1 3.32Å; P811-R815 WeakPolarHBondContact O-CG 3.12Å; P811-R815 PolarHBondContact O-N 3.13Å; P811-R815 VanDerWaalsContact O-N 3.12Å; P811-R815 PolarHBondContact O-NH1 3.14Å
812	A	70.9	Confident	71	Confident	10.25 Å²	10.25	32.9 Å²	32.9	9%	0.085	18%	0.183	C	C	.	.	H	α-helix	trans	-64.8	-50	174.3	0	0	0	0	0	111.4	I808 L809 V810 R814 R815 N816 L1008 Y1515	I808-A812 WeakPolarHBondContact O-CB 3.32Å; I808-A812 PolarHBondContact O-N 3.24Å; I808-A812 VanDerWaalsContact O-N 3.12Å; L809-A812 WeakPolarHBondContact O-CA 3.12Å; L809-A812 VanDerWaalsContact O-CB 3.31Å; L809-A812 WeakPolarHBondContact O-CB 3.29Å; L809-A812 PolarHBondContact O-N 3.03Å; L809-A812 VanDerWaalsContact O-N 3.15Å; V810-A812 VanDerWaalsContact C-N 3.28Å; V810-A812 PolarHBondContact O-N 3.09Å; A812-R814 VanDerWaalsContact C-N 3.29Å; A812-R814 PolarHBondContact O-N 3.25Å; A812-R815 WeakPolarHBondContact O-CB 3.44Å; A812-R815 PolarHBondContact O-N 3.17Å; A812-R815 VanDerWaalsContact O-N 3.07Å; A812-N816 VanDerWaalsContact O-CB 3.27Å; A812-N816 WeakPolarHBondContact O-CB 3.28Å; A812-N816 VanDerWaalsContact O-CG 3.3Å; A812-N816 PolarHBondContact O-N 3.04Å; A812-N816 VanDerWaalsContact O-N 3.15Å; A812-N816 PolarHBondContact O-ND2 3.43Å; A812-N816 VanDerWaalsContact O-ND2 3.08Å; A812-N816 PolarHBondContact O-OD1 3.36Å; A812-L1008 HydrophobicContact CB-CD2 4.37Å; A812-Y1515 WeakPolarHBondContact CB-OH 3.43Å
813	L	76.9	Confident	70.2	Confident	3.75 Å²	3.75	32.6 Å²	32.6	2%	0.02	18%	0.182	C	C	.	.	H	α-helix	trans	-58	-43.5	176.8	-73.7	167	0	0	0	112.5	L809 V810 R815 N816 V817 A818 L825 F1007 L1008 V1011 K1012	L809-L813 PolarHBondContact O-N 3.15Å; V810-L813 PolarHBondContact O-N 3.15Å; L813-R815 VanDerWaalsContact C-N 3.33Å; L813-R815 PolarHBondContact O-N 3.06Å; L813-N816 PolarHBondContact O-N 3.21Å; L813-N816 VanDerWaalsContact O-N 3.13Å; L813-V817 HydrophobicContact CD2-CG2 4.16Å; L813-V817 WeakPolarHBondContact O-CA 3.37Å; L813-V817 VanDerWaalsContact O-CB 3.29Å; L813-V817 WeakPolarHBondContact O-CB 3.28Å; L813-V817 WeakPolarHBondContact O-CG2 3.08Å; L813-V817 PolarHBondContact O-N 3.29Å; L813-A818 PolarHBondContact O-N 3.11Å; L813-L825 HydrophobicContact CB-CD2 3.8Å; L813-F1007 HydrophobicContact CD1-CD1 4.31Å; L813-F1007 HydrophobicContact CD1-CE1 3.54Å; L813-F1007 VanDerWaalsContact CD1-CE1 3.41Å; L813-F1007 HydrophobicContact CD1-CZ 4.15Å; L813-L1008 HydrophobicContact CD1-CD2 4Å; L813-L1008 HydrophobicContact CD2-CD2 3.84Å; L813-L1008 HydrophobicContact CG-CD2 3.53Å; L813-L1008 VanDerWaalsContact CG-CD2 3.43Å; L813-V1011 HydrophobicContact CD1-CB 3.83Å; L813-V1011 HydrophobicContact CD1-CG1 3.66Å; L813-V1011 HydrophobicContact CD1-CG2 4.49Å; L813-K1012 HydrophobicContact CD2-CB 4.18Å
814	R	71.6	Confident	69.7	Low	35.5 Å²	35.5	32.3 Å²	32.3	13%	0.134	18%	0.178	C	C	.	.	I	π-helix	trans	-56.4	-43.9	178.3	-153.2	-174.9	-98	135	-8	111.1	V810 P811 A812 A818 L819 L825 E827 Y1348	V810-R814 WeakPolarHBondContact O-CB 3.41Å; V810-R814 WeakPolarHBondContact O-CG 3.38Å; V810-R814 PolarHBondContact O-N 3.18Å; P811-R814 PolarHBondContact O-N 3.04Å; A812-R814 VanDerWaalsContact C-N 3.29Å; A812-R814 PolarHBondContact O-N 3.25Å; R814-A818 WeakPolarHBondContact O-CB 3.36Å; R814-A818 PolarHBondContact O-N 3.03Å; R814-L819 WeakPolarHBondContact O-CD1 3.5Å; R814-L819 PolarHBondContact O-N 2.89Å; R814-L819 VanDerWaalsContact O-N 3.16Å; R814-L825 HydrophobicContact CB-CB 4.23Å; R814-L825 HydrophobicContact CB-CD2 4.44Å; R814-L825 WeakPolarHBondContact CD-O 3.44Å; R814-L825 HydrophobicContact CG-CB 4.29Å; R814-L825 HydrophobicContact CG-CD2 3.63Å; R814-L825 HydrophobicContact CG-CG 4.39Å; R814-L825 WeakPolarHBondContact CG-O 3.4Å; R814-L825 VanDerWaalsContact CZ-O 3.26Å; R814-L825 PolarHBondContact NE-O 2.82Å; R814-L825 PolarHBondContact NH2-O 3.17Å; R814-E827 IonicContact CZ-OE1 3.22Å; R814-E827 IonicContact CZ-OE2 3.32Å; R814-E827 IonicContact NH1-OE1 3.33Å; R814-E827 PolarHBondContact NH1-OE1 3.14Å; R814-E827 IonicContact NH1-OE2 3.35Å; R814-E827 PolarHBondContact NH1-OE2 3.17Å; R814-E827 VanDerWaalsContact NH1-OE2 3.13Å; R814-E827 IonicContact NH2-OE1 3.21Å; R814-E827 PolarHBondContact NH2-OE1 3.05Å; R814-E827 IonicContact NH2-OE2 3.23Å; R814-E827 PolarHBondContact NH2-OE2 3.15Å; R814-Y1348 PolarHBondContact NH2-O 3.44Å
815	R	61.3	Low	69.4	Low	62 Å²	62	31.2 Å²	31.2	23%	0.234	17%	0.173	C	C	.	.	I	π-helix	trans	-69.4	-44.6	179.2	-91.3	-174.7	-150	101.3	-5.1	112.3	P811 A812 L813 V817 A818 L819 Y1348 R1384 N1529 D1530	P811-R815 VanDerWaalsContact C-NH1 3.32Å; P811-R815 WeakPolarHBondContact O-CG 3.12Å; P811-R815 PolarHBondContact O-N 3.13Å; P811-R815 VanDerWaalsContact O-N 3.12Å; P811-R815 PolarHBondContact O-NH1 3.14Å; A812-R815 WeakPolarHBondContact O-CB 3.44Å; A812-R815 PolarHBondContact O-N 3.17Å; A812-R815 VanDerWaalsContact O-N 3.07Å; L813-R815 VanDerWaalsContact C-N 3.33Å; L813-R815 PolarHBondContact O-N 3.06Å; R815-V817 VanDerWaalsContact C-N 3.32Å; R815-V817 PolarHBondContact O-N 3.01Å; R815-A818 PolarHBondContact O-N 3.3Å; R815-L819 HydrophobicContact CG-CD1 4.27Å; R815-L819 WeakPolarHBondContact O-CD1 3.26Å; R815-L819 PolarHBondContact O-N 3.06Å; R815-Y1348 PolarHBondContact NH1-OH 3.29Å; R815-Y1348 PolarHBondContact NH2-OH 3.37Å; R815-R1384 VanDerWaalsContact NH2-NH2 3.19Å; R815-N1529 PolarHBondContact NE-O 2.81Å; R815-N1529 VanDerWaalsContact NE-O 3.17Å; R815-D1530 IonicContact CZ-OD1 3.75Å; R815-D1530 IonicContact NH2-OD1 2.85Å; R815-D1530 PolarHBondContact NH2-OD1 3.18Å
816	N	65.7	Low	68.8	Low	66.5 Å²	66.5	32.9 Å²	32.9	36%	0.356	18%	0.182	S	C	.	.	I	π-helix	trans	-78.6	-35.5	-171.9	-63.8	-10.9	0	0	0	112.6	A812 L813 L819 G820 E1531 N1560	A812-N816 VanDerWaalsContact O-CB 3.27Å; A812-N816 WeakPolarHBondContact O-CB 3.28Å; A812-N816 VanDerWaalsContact O-CG 3.3Å; A812-N816 PolarHBondContact O-N 3.04Å; A812-N816 VanDerWaalsContact O-N 3.15Å; A812-N816 PolarHBondContact O-ND2 3.43Å; A812-N816 VanDerWaalsContact O-ND2 3.08Å; A812-N816 PolarHBondContact O-OD1 3.36Å; L813-N816 PolarHBondContact O-N 3.21Å; L813-N816 VanDerWaalsContact O-N 3.13Å; N816-L819 PolarHBondContact O-N 3.06Å; N816-G820 PolarHBondContact O-N 3.05Å; N816-E1531 WeakPolarHBondContact CA-OE2 3.39Å; N816-E1531 WeakPolarHBondContact CB-OE1 3.46Å; N816-E1531 WeakPolarHBondContact CB-OE2 3.31Å; N816-E1531 PolarHBondContact ND2-OE1 3.15Å; N816-E1531 VanDerWaalsContact OD1-CD 3.27Å; N816-E1531 PolarHBondContact OD1-OE1 3.22Å; N816-N1560 WeakPolarHBondContact CB-ND2 3.46Å; N816-N1560 WeakPolarHBondContact ND2-CB 3.32Å; N816-N1560 PolarHBondContact ND2-ND2 3.23Å; N816-N1560 VanDerWaalsContact ND2-ND2 3.17Å; N816-N1560 PolarHBondContact ND2-OD1 3.38Å; N816-N1560 PolarHBondContact OD1-ND2 3.47Å; N816-N1560 VanDerWaalsContact OD1-ND2 3.08Å
817	V	68.5	Low	68.9	Low	10.25 Å²	10.25	33.3 Å²	33.3	6%	0.062	18%	0.182	C	C	.	.	I	π-helix	trans	-101.5	-43.5	-173.1	-175.2	0	0	0	0	110.9	L813 R815 L819 G820 L821 R822 V823 K1012 L1015	L813-V817 HydrophobicContact CD2-CG2 4.16Å; L813-V817 WeakPolarHBondContact O-CA 3.37Å; L813-V817 VanDerWaalsContact O-CB 3.29Å; L813-V817 WeakPolarHBondContact O-CB 3.28Å; L813-V817 WeakPolarHBondContact O-CG2 3.08Å; L813-V817 PolarHBondContact O-N 3.29Å; R815-V817 VanDerWaalsContact C-N 3.32Å; R815-V817 PolarHBondContact O-N 3.01Å; V817-L819 VanDerWaalsContact C-N 3.25Å; V817-L819 PolarHBondContact O-N 3.24Å; V817-G820 PolarHBondContact O-N 3.37Å; V817-G820 VanDerWaalsContact O-N 3.08Å; V817-L821 HydrophobicContact CG1-CB 4.09Å; V817-L821 HydrophobicContact CG1-CD1 3.85Å; V817-L821 HydrophobicContact CG1-CG 4.22Å; V817-L821 CarbonylContact O-C 3.54Å; V817-L821 WeakPolarHBondContact O-CA 3.48Å; V817-L821 WeakPolarHBondContact O-CB 3.07Å; V817-L821 PolarHBondContact O-N 3.18Å; V817-L821 VanDerWaalsContact O-N 3.07Å; V817-R822 PolarHBondContact O-N 3.09Å; V817-R822 VanDerWaalsContact O-N 3.1Å; V817-V823 HydrophobicContact CG1-CB 3.66Å; V817-V823 HydrophobicContact CG1-CG1 4.38Å; V817-V823 HydrophobicContact CG1-CG2 4.12Å; V817-V823 PolarHBondContact O-N 3.07Å; V817-K1012 HydrophobicContact CG1-CG 4.19Å; V817-K1012 HydrophobicContact CG2-CB 4.17Å; V817-K1012 HydrophobicContact CG2-CD 4Å; V817-K1012 HydrophobicContact CG2-CG 3.74Å; V817-L1015 HydrophobicContact CB-CD1 4.32Å; V817-L1015 HydrophobicContact CG1-CB 4.24Å; V817-L1015 HydrophobicContact CG1-CD1 4.12Å; V817-L1015 HydrophobicContact CG1-CD2 4.47Å; V817-L1015 HydrophobicContact CG2-CB 4.4Å; V817-L1015 HydrophobicContact CG2-CD1 3.43Å; V817-L1015 VanDerWaalsContact CG2-CD1 3.49Å; V817-L1015 HydrophobicContact CG2-CG 4.41Å
818	A	63.2	Low	69	Low	10.25 Å²	10.25	33 Å²	33	9%	0.085	18%	0.175	C	C	.	.	I	π-helix	trans	-62.5	-38.2	-178.5	0	0	0	0	0	112.2	W784 L813 R814 R815 G820 L821 R822 V823 L825	W784-A818 HydrophobicContact CH2-CB 3.85Å; W784-A818 WeakPolarHBondContact CH2-O 3.12Å; W784-A818 HydrophobicContact CZ3-CB 3.62Å; W784-A818 VanDerWaalsContact CZ3-O 3.32Å; W784-A818 WeakPolarHBondContact CZ3-O 3.37Å; L813-A818 PolarHBondContact O-N 3.11Å; R814-A818 WeakPolarHBondContact O-CB 3.36Å; R814-A818 PolarHBondContact O-N 3.03Å; R815-A818 PolarHBondContact O-N 3.3Å; A818-G820 PolarHBondContact O-N 2.65Å; A818-L821 CarbonylContact O-C 3.58Å; A818-L821 PolarHBondContact O-N 3.04Å; A818-R822 WeakPolarHBondContact O-CA 3.41Å; A818-R822 PolarHBondContact O-N 2.94Å; A818-R822 VanDerWaalsContact O-N 3.13Å; A818-V823 CarbonylContact C-O 3.53Å; A818-V823 VanDerWaalsContact C-O 3.29Å; A818-V823 WeakPolarHBondContact CA-O 3.19Å; A818-V823 HydrophobicContact CB-CB 4.38Å; A818-V823 VanDerWaalsContact CB-O 3.27Å; A818-V823 WeakPolarHBondContact CB-O 3.44Å; A818-V823 PolarHBondContact N-O 3.2Å; A818-V823 PolarHBondContact O-N 3.13Å; A818-V823 VanDerWaalsContact O-O 3.08Å; A818-L825 HydrophobicContact CB-CB 3.96Å
819	L	57	Low	68.9	Low	70.75 Å²	70.75	31.7 Å²	31.7	37%	0.37	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-41	179.5	-85.7	151.7	0	0	0	112.8	W784 R814 R815 N816 V817 L821 R822 E1531	W784-L819 HydrophobicContact CH2-CB 4.02Å; W784-L819 HydrophobicContact CH2-CD2 3.52Å; W784-L819 HydrophobicContact CH2-CG 4.13Å; W784-L819 HydrophobicContact CZ3-CB 4.42Å; W784-L819 HydrophobicContact CZ3-CD2 3.93Å; W784-L819 HydrophobicContact CZ3-CG 4.33Å; R814-L819 WeakPolarHBondContact O-CD1 3.5Å; R814-L819 PolarHBondContact O-N 2.89Å; R814-L819 VanDerWaalsContact O-N 3.16Å; R815-L819 HydrophobicContact CG-CD1 4.27Å; R815-L819 WeakPolarHBondContact O-CD1 3.26Å; R815-L819 PolarHBondContact O-N 3.06Å; N816-L819 PolarHBondContact O-N 3.06Å; V817-L819 VanDerWaalsContact C-N 3.25Å; V817-L819 PolarHBondContact O-N 3.24Å; L819-L821 VanDerWaalsContact C-N 3.32Å; L819-L821 PolarHBondContact O-N 3.43Å; L819-R822 PolarHBondContact O-N 3.14Å; L819-E1531 HydrophobicContact CD1-CG 3.62Å; L819-E1531 WeakPolarHBondContact CD1-OE1 3.19Å; L819-E1531 VanDerWaalsContact CD2-OE1 3.25Å; L819-E1531 WeakPolarHBondContact CD2-OE1 3.5Å; L819-E1531 WeakPolarHBondContact CD2-OE2 3.48Å
820	G	60	Low	68.2	Low	63 Å²	63	32.8 Å²	32.8	65%	0.649	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-42.5	178.7	0	0	0	0	0	113.3	N816 V817 A818 R822	N816-G820 PolarHBondContact O-N 3.05Å; V817-G820 PolarHBondContact O-N 3.37Å; V817-G820 VanDerWaalsContact O-N 3.08Å; A818-G820 PolarHBondContact O-N 2.65Å; G820-R822 VanDerWaalsContact C-N 3.3Å; G820-R822 PolarHBondContact O-N 2.98Å
821	L	64.5	Low	67.4	Low	35.25 Å²	35.25	34.7 Å²	34.7	19%	0.185	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-3.9	-178.2	-63.9	172.8	0	0	0	113.9	V817 A818 L819 V823 L1015 L1016 F1019	V817-L821 HydrophobicContact CG1-CB 4.09Å; V817-L821 HydrophobicContact CG1-CD1 3.85Å; V817-L821 HydrophobicContact CG1-CG 4.22Å; V817-L821 CarbonylContact O-C 3.54Å; V817-L821 WeakPolarHBondContact O-CA 3.48Å; V817-L821 WeakPolarHBondContact O-CB 3.07Å; V817-L821 PolarHBondContact O-N 3.18Å; V817-L821 VanDerWaalsContact O-N 3.07Å; A818-L821 CarbonylContact O-C 3.58Å; A818-L821 PolarHBondContact O-N 3.04Å; L819-L821 VanDerWaalsContact C-N 3.32Å; L819-L821 PolarHBondContact O-N 3.43Å; L821-V823 VanDerWaalsContact C-N 3.28Å; L821-V823 HydrophobicContact CB-CB 4.34Å; L821-V823 HydrophobicContact CB-CG2 3.75Å; L821-V823 PolarHBondContact O-N 2.99Å; L821-L1015 HydrophobicContact CD1-CB 4.17Å; L821-L1015 WeakPolarHBondContact CD1-O 3.2Å; L821-L1016 HydrophobicContact CD1-CD2 4.05Å; L821-L1016 HydrophobicContact CD1-CG 4.46Å; L821-L1016 HydrophobicContact CD2-CD2 4.01Å; L821-L1016 HydrophobicContact CG-CD2 4.36Å; L821-F1019 HydrophobicContact CB-CB 4.49Å; L821-F1019 HydrophobicContact CD1-CB 4.1Å
822	R	60.2	Low	66.3	Low	123 Å²	123	36.3 Å²	36.3	46%	0.464	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	43.6	-170.6	-56.5	177.9	179.1	-151.2	-3.6	111.6	W784 K785 V817 A818 L819 G820 E1051	W784-R822 CarbonylContact C-O 3.45Å; W784-R822 WeakPolarHBondContact CA-O 3.35Å; W784-R822 HydrophobicContact CD2-CB 4.07Å; W784-R822 HydrophobicContact CE3-CB 4.29Å; W784-R822 HydrophobicContact CG-CB 4.33Å; W784-R822 HydrophobicContact CZ2-CG 4.37Å; K785-R822 PolarHBondContact N-O 3.03Å; V817-R822 PolarHBondContact O-N 3.09Å; V817-R822 VanDerWaalsContact O-N 3.1Å; A818-R822 WeakPolarHBondContact O-CA 3.41Å; A818-R822 PolarHBondContact O-N 2.94Å; A818-R822 VanDerWaalsContact O-N 3.13Å; L819-R822 PolarHBondContact O-N 3.14Å; G820-R822 VanDerWaalsContact C-N 3.3Å; G820-R822 PolarHBondContact O-N 2.98Å; R822-E1051 IonicContact CZ-OE1 2.55Å; R822-E1051 IonicContact CZ-OE2 2.68Å; R822-E1051 IonicContact NH1-OE1 2.82Å; R822-E1051 PolarHBondContact NH1-OE1 3.49Å; R822-E1051 IonicContact NH1-OE2 3.84Å; R822-E1051 IonicContact NH2-OE1 2.82Å; R822-E1051 PolarHBondContact NH2-OE1 2.75Å; R822-E1051 IonicContact NH2-OE2 3.61Å; R822-E1051 PolarHBondContact NH2-OE2 3.36Å
823	V	65.6	Low	65	Low	0.75 Å²	0.75	37.7 Å²	37.7	1%	0.005	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	128.4	177.6	-179.1	0	0	0	0	109.7	K785 C787 V817 A818 L821 L825 F1019	K785-V823 HydrophobicContact CB-CG2 4.32Å; K785-V823 CarbonylContact O-C 3.56Å; K785-V823 VanDerWaalsContact O-CA 3.29Å; K785-V823 WeakPolarHBondContact O-CA 3.23Å; C787-V823 HydrophobicContact CB-CG1 3.5Å; C787-V823 VanDerWaalsContact CB-CG1 3.46Å; V817-V823 HydrophobicContact CG1-CB 3.66Å; V817-V823 HydrophobicContact CG1-CG1 4.38Å; V817-V823 HydrophobicContact CG1-CG2 4.12Å; V817-V823 PolarHBondContact O-N 3.07Å; A818-V823 CarbonylContact C-O 3.53Å; A818-V823 VanDerWaalsContact C-O 3.29Å; A818-V823 WeakPolarHBondContact CA-O 3.19Å; A818-V823 HydrophobicContact CB-CB 4.38Å; A818-V823 VanDerWaalsContact CB-O 3.27Å; A818-V823 WeakPolarHBondContact CB-O 3.44Å; A818-V823 PolarHBondContact N-O 3.2Å; A818-V823 PolarHBondContact O-N 3.13Å; A818-V823 VanDerWaalsContact O-O 3.08Å; L821-V823 VanDerWaalsContact C-N 3.28Å; L821-V823 HydrophobicContact CB-CB 4.34Å; L821-V823 HydrophobicContact CB-CG2 3.75Å; L821-V823 PolarHBondContact O-N 2.99Å; V823-L825 PolarHBondContact O-N 3.13Å; V823-F1019 HydrophobicContact CG1-CD2 4.16Å; V823-F1019 HydrophobicContact CG1-CE1 4.46Å; V823-F1019 HydrophobicContact CG1-CE2 4.01Å; V823-F1019 HydrophobicContact CG1-CG 4.42Å; V823-F1019 HydrophobicContact CG1-CZ 4.21Å; V823-F1019 HydrophobicContact CG2-CB 3.69Å; V823-F1019 HydrophobicContact CG2-CD1 3.95Å; V823-F1019 HydrophobicContact CG2-CD2 3.8Å; V823-F1019 HydrophobicContact CG2-CE1 4.47Å; V823-F1019 HydrophobicContact CG2-CE2 4.42Å; V823-F1019 HydrophobicContact CG2-CG 3.53Å; V823-F1019 VanDerWaalsContact CG2-CG 3.41Å
824	H	65.5	Low	63.4	Low	56.75 Å²	56.75	39.1 Å²	39.1	26%	0.263	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	102.5	166.9	-150.3	-2.5	0	0	0	109.4	F780 W784 K785 C786 C787 N826	F780-H824 HydrophobicContact CE2-CB 4.19Å; F780-H824 AromaticContact CE2-CD2 3.39Å; F780-H824 WeakPolarHBondContact CE2-CD2 3.4Å; F780-H824 AromaticContact CE2-CG 3.71Å; F780-H824 AromaticContact CE2-NE2 3.86Å; F780-H824 AromaticContact CZ-CD2 3.19Å; F780-H824 WeakPolarHBondContact CZ-CD2 3.18Å; F780-H824 AromaticContact CZ-CG 3.97Å; F780-H824 AromaticContact CZ-NE2 3.66Å; W784-H824 AromaticContact CD2-NE2 3.96Å; W784-H824 AromaticContact CE3-CE1 3.61Å; W784-H824 AromaticContact CE3-ND1 3.95Å; W784-H824 AromaticContact CE3-NE2 3.75Å; K785-H824 PolarHBondContact O-N 3.11Å; C786-H824 WeakPolarHBondContact CA-O 3.22Å; C786-H824 PolarHBondContact SG-O 2.99Å; C787-H824 PolarHBondContact N-O 3.28Å; H824-N826 PolarHBondContact CD2-OD1 2.78Å; H824-N826 PolarHBondContact NE2-OD1 2.88Å; H824-N826 VanDerWaalsContact NE2-OD1 3.16Å
825	L	75.1	Confident	62	Low	0.25 Å²	0.25	40 Å²	40	0%	0.001	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	118.5	176	-175.5	81.2	0	0	0	110.1	C787 L789 V810 L813 R814 A818 V823 L1015	C787-L825 HydrophobicContact CB-CD1 4.08Å; C787-L825 CarbonylContact O-C 3.59Å; C787-L825 WeakPolarHBondContact O-CA 3.29Å; L789-L825 HydrophobicContact CB-CD1 4.04Å; L789-L825 HydrophobicContact CD1-CD1 4.22Å; V810-L825 HydrophobicContact CG1-CD2 3.82Å; V810-L825 HydrophobicContact CG1-CG 4.3Å; L813-L825 HydrophobicContact CB-CD2 3.8Å; R814-L825 HydrophobicContact CB-CB 4.23Å; R814-L825 HydrophobicContact CB-CD2 4.44Å; R814-L825 WeakPolarHBondContact CD-O 3.44Å; R814-L825 HydrophobicContact CG-CB 4.29Å; R814-L825 HydrophobicContact CG-CD2 3.63Å; R814-L825 HydrophobicContact CG-CG 4.39Å; R814-L825 WeakPolarHBondContact CG-O 3.4Å; R814-L825 VanDerWaalsContact CZ-O 3.26Å; R814-L825 PolarHBondContact NE-O 2.82Å; R814-L825 PolarHBondContact NH2-O 3.17Å; A818-L825 HydrophobicContact CB-CB 3.96Å; V823-L825 PolarHBondContact O-N 3.13Å; L825-L1015 HydrophobicContact CD1-CD1 3.84Å; L825-L1015 HydrophobicContact CD1-CD2 4.12Å; L825-L1015 HydrophobicContact CD1-CG 4.44Å; L825-L1015 HydrophobicContact CD2-CD1 4.17Å
826	N	71.9	Confident	61	Low	35.5 Å²	35.5	41.2 Å²	41.2	19%	0.19	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	110.6	178.8	-92.4	-1.7	0	0	0	109.9	C786 C787 Q788 L789 H824 K1347	C786-N826 PolarHBondContact SG-ND2 3.01Å; C786-N826 VanDerWaalsContact SG-ND2 3.44Å; C787-N826 PolarHBondContact O-N 3.11Å; Q788-N826 WeakPolarHBondContact CA-O 3.38Å; L789-N826 PolarHBondContact N-O 3.04Å; H824-N826 PolarHBondContact CD2-OD1 2.78Å; H824-N826 PolarHBondContact NE2-OD1 2.88Å; H824-N826 VanDerWaalsContact NE2-OD1 3.16Å; N826-K1347 PolarHBondContact OD1-O 3.04Å
827	E	75.9	Confident	59.9	Low	24.75 Å²	24.75	42.3 Å²	42.3	12%	0.116	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	133	168.7	82.2	-92.9	173.2	0	0	110.7	L789 I791 C806 V810 R814	L789-E827 HydrophobicContact CD2-CB 4.46Å; L789-E827 CarbonylContact O-C 3.54Å; L789-E827 VanDerWaalsContact O-CA 3.26Å; L789-E827 WeakPolarHBondContact O-CA 3.33Å; I791-E827 HydrophobicContact CD1-CB 4.38Å; C806-E827 VanDerWaalsContact CA-OE1 3.28Å; C806-E827 WeakPolarHBondContact CA-OE1 3.23Å; C806-E827 WeakPolarHBondContact CB-OE1 3.49Å; C806-E827 PolarHBondContact SG-OE1 3.1Å; V810-E827 HydrophobicContact CG1-CB 4.15Å; V810-E827 HydrophobicContact CG1-CG 4.39Å; V810-E827 WeakPolarHBondContact CG1-OE2 3.36Å; R814-E827 IonicContact CZ-OE1 3.22Å; R814-E827 IonicContact CZ-OE2 3.32Å; R814-E827 IonicContact NH1-OE1 3.33Å; R814-E827 PolarHBondContact NH1-OE1 3.14Å; R814-E827 IonicContact NH1-OE2 3.35Å; R814-E827 PolarHBondContact NH1-OE2 3.17Å; R814-E827 VanDerWaalsContact NH1-OE2 3.13Å; R814-E827 IonicContact NH2-OE1 3.21Å; R814-E827 PolarHBondContact NH2-OE1 3.05Å; R814-E827 IonicContact NH2-OE2 3.23Å; R814-E827 PolarHBondContact NH2-OE2 3.15Å
828	I	70.7	Confident	58.8	Low	15.75 Å²	15.75	43.4 Å²	43.4	8%	0.081	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	98	170.4	-57.1	163.9	0	0	0	106.2	Q788 L789 F790 I791 L830 Q851	Q788-I828 HydrophobicContact CB-CD1 3.93Å; Q788-I828 HydrophobicContact CG-CD1 4.16Å; L789-I828 PolarHBondContact O-N 3.02Å; F790-I828 HydrophobicContact CD2-CB 3.92Å; F790-I828 HydrophobicContact CD2-CG2 3.7Å; F790-I828 HydrophobicContact CE2-CG2 4.06Å; I791-I828 PolarHBondContact N-O 3.03Å; I791-I828 VanDerWaalsContact N-O 3.12Å; I828-L830 HydrophobicContact CG2-CD2 4.06Å; I828-L830 HydrophobicContact CG2-CG 4.24Å; I828-Q851 VanDerWaalsContact CD1-OE1 3.25Å; I828-Q851 HydrophobicContact CG2-CB 4.15Å; I828-Q851 HydrophobicContact CG2-CG 4.18Å
829	D	71.8	Confident	58	Low	19.25 Å²	19.25	45.8 Å²	45.8	10%	0.103	26%	0.259	C	S	.	.			trans	-109.8	105.6	170.3	-175	-3.3	0	0	0	108.9	R802 C806 R831 W832	R802-D829 IonicContact CZ-OD1 3.17Å; R802-D829 VanDerWaalsContact CZ-OD1 3.3Å; R802-D829 IonicContact CZ-OD2 2.84Å; R802-D829 IonicContact NE-OD1 3.07Å; R802-D829 PolarHBondContact NE-OD1 3.09Å; R802-D829 IonicContact NE-OD2 3.38Å; R802-D829 PolarHBondContact NE-OD2 3.41Å; R802-D829 VanDerWaalsContact NH2-CG 3.31Å; R802-D829 IonicContact NH2-OD1 3.15Å; R802-D829 PolarHBondContact NH2-OD1 3.05Å; R802-D829 IonicContact NH2-OD2 3.35Å; C806-D829 PolarHBondContact SG-OD2 3.19Å; D829-R831 VanDerWaalsContact C-N 3.29Å; D829-R831 PolarHBondContact O-N 3.14Å; D829-R831 VanDerWaalsContact O-N 3.11Å; D829-R831 WeakPolarHBondContact OD1-CB 3.36Å; D829-R831 VanDerWaalsContact OD1-CG 3.31Å; D829-R831 WeakPolarHBondContact OD1-CG 3.43Å; D829-R831 PolarHBondContact OD1-N 3.22Å; D829-R831 VanDerWaalsContact OD1-N 3.13Å; D829-R831 IonicContact OD1-NE 3.58Å; D829-R831 PolarHBondContact OD1-NE 3.31Å; D829-R831 IonicContact OD2-CZ 3.57Å; D829-R831 IonicContact OD2-NE 3.13Å; D829-R831 PolarHBondContact OD2-NE 3.4Å; D829-R831 IonicContact OD2-NH2 3.57Å; D829-R831 PolarHBondContact OD2-NH2 2.7Å; D829-W832 HydrophobicContact CB-CB 4.48Å; D829-W832 VanDerWaalsContact O-CB 3.3Å; D829-W832 WeakPolarHBondContact O-CB 3.22Å; D829-W832 PolarHBondContact O-N 3.12Å
830	L	66.8	Low	57.7	Low	28 Å²	28	50 Å²	50	15%	0.147	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	1.2	-176.6	-65.4	178.5	0	0	0	114.2	F790 I828 W832 V834 I847 C848 Q851	F790-L830 HydrophobicContact CE2-CD1 3.77Å; F790-L830 HydrophobicContact CE2-CG 4.1Å; F790-L830 HydrophobicContact CZ-CD1 4.06Å; I828-L830 HydrophobicContact CG2-CD2 4.06Å; I828-L830 HydrophobicContact CG2-CG 4.24Å; L830-W832 VanDerWaalsContact C-N 3.25Å; L830-W832 PolarHBondContact O-N 2.87Å; L830-W832 VanDerWaalsContact O-N 3.09Å; L830-V834 HydrophobicContact CB-CG2 4.32Å; L830-V834 HydrophobicContact CD2-CG2 4.43Å; L830-V834 VanDerWaalsContact O-CG2 3.27Å; L830-V834 WeakPolarHBondContact O-CG2 3.38Å; L830-I847 HydrophobicContact CD1-CG2 4.16Å; L830-I847 HydrophobicContact CD2-CG2 4.03Å; L830-I847 HydrophobicContact CG-CG2 4.48Å; L830-C848 VanDerWaalsContact CD1-CA 3.41Å; L830-C848 HydrophobicContact CD1-CB 4.19Å; L830-C848 WeakPolarHBondContact CD1-SG 3.42Å; L830-Q851 HydrophobicContact CD1-CB 4.33Å; L830-Q851 HydrophobicContact CD1-CG 4.25Å; L830-Q851 HydrophobicContact CD2-CG 4.35Å
831	R	62.1	Low	57.6	Low	40.75 Å²	40.75	50.8 Å²	50.8	15%	0.154	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-27.2	164.3	-71.1	-174.2	-162.5	174.6	4.5	112.2	F795 M798 H799 R802 D803 D829 G833 V834 Y1389	F795-R831 HydrophobicContact CD1-CG 3.81Å; F795-R831 HydrophobicContact CE1-CB 4.39Å; F795-R831 HydrophobicContact CE1-CG 3.6Å; F795-R831 VanDerWaalsContact CE1-CG 3.47Å; F795-R831 PolarHBondContact O-NH2 3.14Å; M798-R831 PolarHBondContact O-NH2 3.5Å; H799-R831 VanDerWaalsContact CA-NH2 3.35Å; H799-R831 PolarHBondContact ND1-NH2 2.71Å; H799-R831 PolarHBondContact O-NH1 3.45Å; H799-R831 VanDerWaalsContact O-NH1 3.14Å; R802-R831 VanDerWaalsContact CB-NH1 3.33Å; R802-R831 VanDerWaalsContact CB-NH2 3.3Å; D803-R831 IonicContact OD1-CZ 3.65Å; D803-R831 VanDerWaalsContact OD1-CZ 3.23Å; D803-R831 IonicContact OD1-NH1 3.47Å; D803-R831 PolarHBondContact OD1-NH1 3.29Å; D803-R831 VanDerWaalsContact OD1-NH1 3.14Å; D803-R831 IonicContact OD1-NH2 3.55Å; D803-R831 PolarHBondContact OD1-NH2 2.85Å; D829-R831 VanDerWaalsContact C-N 3.29Å; D829-R831 PolarHBondContact O-N 3.14Å; D829-R831 VanDerWaalsContact O-N 3.11Å; D829-R831 WeakPolarHBondContact OD1-CB 3.36Å; D829-R831 VanDerWaalsContact OD1-CG 3.31Å; D829-R831 WeakPolarHBondContact OD1-CG 3.43Å; D829-R831 PolarHBondContact OD1-N 3.22Å; D829-R831 VanDerWaalsContact OD1-N 3.13Å; D829-R831 IonicContact OD1-NE 3.58Å; D829-R831 PolarHBondContact OD1-NE 3.31Å; D829-R831 IonicContact OD2-CZ 3.57Å; D829-R831 IonicContact OD2-NE 3.13Å; D829-R831 PolarHBondContact OD2-NE 3.4Å; D829-R831 IonicContact OD2-NH2 3.57Å; D829-R831 PolarHBondContact OD2-NH2 2.7Å; R831-G833 PolarHBondContact O-N 2.99Å; R831-V834 PolarHBondContact O-N 3.36Å; R831-Y1389 HydrophobicContact CB-CD2 4.38Å
832	W	46.9	Very low	57.5	Low	50.5 Å²	50.5	51.1 Å²	51.1	19%	0.191	27%	0.265	C	S	.	.	S	Bend	trans	-104.9	92.1	-171.1	-141.5	54.2	0	0	0	112.1	D829 L830 K1350 L1383 Y1386 S1387 Y1389 L1392	D829-W832 HydrophobicContact CB-CB 4.48Å; D829-W832 VanDerWaalsContact O-CB 3.3Å; D829-W832 WeakPolarHBondContact O-CB 3.22Å; D829-W832 PolarHBondContact O-N 3.12Å; L830-W832 VanDerWaalsContact C-N 3.25Å; L830-W832 PolarHBondContact O-N 2.87Å; L830-W832 VanDerWaalsContact O-N 3.09Å; W832-K1350 HydrophobicContact CD2-CD 4.04Å; W832-K1350 HydrophobicContact CD2-CG 4.32Å; W832-K1350 HydrophobicContact CE3-CB 3.63Å; W832-K1350 HydrophobicContact CE3-CD 3.79Å; W832-K1350 HydrophobicContact CE3-CG 3.85Å; W832-K1350 VanDerWaalsContact CE3-NZ 3.33Å; W832-K1350 HydrophobicContact CH2-CB 3.14Å; W832-K1350 HydrophobicContact CH2-CD 3.64Å; W832-K1350 HydrophobicContact CH2-CG 3.09Å; W832-K1350 HydrophobicContact CZ2-CB 4.16Å; W832-K1350 HydrophobicContact CZ2-CD 3.67Å; W832-K1350 HydrophobicContact CZ2-CG 4.1Å; W832-K1350 HydrophobicContact CZ3-CB 3.67Å; W832-K1350 HydrophobicContact CZ3-CD 3.38Å; W832-K1350 HydrophobicContact CZ3-CG 3.44Å; W832-L1383 HydrophobicContact CH2-CB 4.25Å; W832-L1383 WeakPolarHBondContact CH2-O 3.27Å; W832-L1383 WeakPolarHBondContact CZ2-O 3.32Å; W832-Y1386 VanDerWaalsContact CZ2-O 3.25Å; W832-Y1386 WeakPolarHBondContact CZ2-O 3.38Å; W832-Y1386 PolarHBondContact NE1-O 3.25Å; W832-S1387 WeakPolarHBondContact CZ2-O 3.39Å; W832-S1387 PolarHBondContact NE1-O 3.29Å; W832-Y1389 HydrophobicContact CB-CD2 4.3Å; W832-Y1389 HydrophobicContact CB-CG 4.28Å; W832-Y1389 VanDerWaalsContact CD1-CB 3.47Å; W832-Y1389 AromaticContact CD1-CD1 3.26Å; W832-Y1389 AromaticContact CD1-CG 3.34Å; W832-Y1389 HydrophobicContact CD2-CD1 4.13Å; W832-Y1389 HydrophobicContact CD2-CE1 4.17Å; W832-Y1389 HydrophobicContact CD2-CG 4.5Å; W832-Y1389 AromaticContact CE2-CD1 3.79Å; W832-Y1389 AromaticContact CE2-CE1 3.88Å; W832-Y1389 HydrophobicContact CE3-CG 4.48Å; W832-Y1389 AromaticContact CG-CD1 3.82Å; W832-Y1389 HydrophobicContact CG-CD1 3.82Å; W832-Y1389 HydrophobicContact CG-CD2 4.15Å; W832-Y1389 HydrophobicContact CG-CE1 4.26Å; W832-Y1389 AromaticContact CG-CG 3.77Å; W832-Y1389 HydrophobicContact CG-CG 3.77Å; W832-Y1389 HydrophobicContact CZ3-CD2 4.11Å; W832-Y1389 HydrophobicContact CZ3-CG 4.4Å; W832-Y1389 AromaticContact NE1-CD1 3.13Å; W832-Y1389 AromaticContact NE1-CE1 3.69Å; W832-Y1389 AromaticContact NE1-CG 3.76Å; W832-L1392 HydrophobicContact CZ2-CD1 4.33Å
833	G	43.4	Very low	57.8	Low	39.5 Å²	39.5	50.3 Å²	50.3	41%	0.407	27%	0.267	S	S	.	.	S	Bend	trans	128.1	-4.4	-179.6	0	0	0	0	0	116	R831 P835	R831-G833 PolarHBondContact O-N 2.99Å; G833-P835 WeakPolarHBondContact O-CD 3.35Å
834	V	44.3	Very low	58	Low	32.5 Å²	32.5	50.8 Å²	50.8	20%	0.197	27%	0.271	C	S	.	.	S	Bend	trans	-109.1	110.9	177.7	-174.5	0	0	0	0	108.7	L830 R831 E836 V838 T839 A844 I847 E1390	L830-V834 HydrophobicContact CB-CG2 4.32Å; L830-V834 HydrophobicContact CD2-CG2 4.43Å; L830-V834 VanDerWaalsContact O-CG2 3.27Å; L830-V834 WeakPolarHBondContact O-CG2 3.38Å; R831-V834 PolarHBondContact O-N 3.36Å; V834-E836 PolarHBondContact O-N 2.8Å; V834-V838 HydrophobicContact CG1-CB 3.58Å; V834-V838 VanDerWaalsContact CG1-CB 3.41Å; V834-V838 HydrophobicContact CG1-CG1 3.66Å; V834-V838 VanDerWaalsContact CG1-CG1 3.49Å; V834-T839 HydrophobicContact CB-CG2 4.29Å; V834-T839 HydrophobicContact CG1-CG2 4Å; V834-A844 HydrophobicContact CG1-CB 4.06Å; V834-I847 HydrophobicContact CG2-CD1 4.29Å; V834-E1390 WeakPolarHBondContact CA-OE1 3.48Å; V834-E1390 PolarHBondContact N-OE1 3.44Å
835	P	41.1	Very low	58.6	Low	53.75 Å²	53.75	48.3 Å²	48.3	35%	0.349	26%	0.26	S	S	.	.			trans	-60.3	144.4	177.4	-10.4	17.2	0	0	0	111.2	G833 P837 V838 E1390	G833-P835 WeakPolarHBondContact O-CD 3.35Å; P835-P837 VanDerWaalsContact C-N 3.3Å; P835-P837 HydrophobicContact CB-CG 4.16Å; P835-P837 WeakPolarHBondContact O-CD 3.38Å; P835-P837 VanDerWaalsContact O-N 3.12Å; P835-V838 HydrophobicContact CB-CG2 4.26Å; P835-V838 HydrophobicContact CG-CG2 4.18Å; P835-V838 WeakPolarHBondContact O-CA 3.31Å; P835-V838 WeakPolarHBondContact O-CB 3.38Å; P835-V838 PolarHBondContact O-N 3.25Å; P835-E1390 VanDerWaalsContact CD-OE1 3.3Å; P835-E1390 WeakPolarHBondContact CD-OE1 3.25Å; P835-E1390 VanDerWaalsContact N-OE1 3.11Å
836	E	39.9	Very low	58.8	Low	88.75 Å²	88.75	50.7 Å²	50.7	42%	0.415	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-38.8	-43.4	177.1	-84.6	-179.1	157.5	0	0	115.8	V834 V838 T839 Y840 R1358 Y1389	V834-E836 PolarHBondContact O-N 2.8Å; E836-V838 PolarHBondContact O-N 3.35Å; E836-V838 VanDerWaalsContact O-N 3.11Å; E836-T839 WeakPolarHBondContact CA-OG1 2.93Å; E836-T839 PolarHBondContact O-N 3.1Å; E836-T839 VanDerWaalsContact O-N 3.1Å; E836-T839 PolarHBondContact O-OG1 3.1Å; E836-Y840 WeakPolarHBondContact O-CD2 3.47Å; E836-Y840 WeakPolarHBondContact O-CE2 3.49Å; E836-R1358 IonicContact OE2-NH1 2.73Å; E836-R1358 PolarHBondContact OE2-NH1 3.45Å; E836-Y1389 HydrophobicContact CG-CD1 4.48Å; E836-Y1389 HydrophobicContact CG-CE1 4.18Å
837	P	42.4	Very low	59	Low	88 Å²	88	51.8 Å²	51.8	57%	0.571	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-66.3	-14.2	177.9	12.1	-18.1	0	0	0	114.6	P835 T839 Y840 N841	P835-P837 VanDerWaalsContact C-N 3.3Å; P835-P837 HydrophobicContact CB-CG 4.16Å; P835-P837 WeakPolarHBondContact O-CD 3.38Å; P835-P837 VanDerWaalsContact O-N 3.12Å; P837-T839 VanDerWaalsContact C-N 3.33Å; P837-Y840 WeakPolarHBondContact O-CD2 3.37Å; P837-Y840 PolarHBondContact O-N 3.45Å; P837-N841 PolarHBondContact O-ND2 3.37Å
838	V	46.2	Very low	59.2	Low	33.75 Å²	33.75	51.2 Å²	51.2	21%	0.205	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-93.9	-24.3	-177.7	-173.7	0	0	0	0	111.4	V834 P835 E836 Y840 N841 Q843 A844 I847	V834-V838 HydrophobicContact CG1-CB 3.58Å; V834-V838 VanDerWaalsContact CG1-CB 3.41Å; V834-V838 HydrophobicContact CG1-CG1 3.66Å; V834-V838 VanDerWaalsContact CG1-CG1 3.49Å; P835-V838 HydrophobicContact CB-CG2 4.26Å; P835-V838 HydrophobicContact CG-CG2 4.18Å; P835-V838 WeakPolarHBondContact O-CA 3.31Å; P835-V838 WeakPolarHBondContact O-CB 3.38Å; P835-V838 PolarHBondContact O-N 3.25Å; E836-V838 PolarHBondContact O-N 3.35Å; E836-V838 VanDerWaalsContact O-N 3.11Å; V838-Y840 VanDerWaalsContact C-N 3.26Å; V838-Y840 PolarHBondContact O-N 3.08Å; V838-Y840 VanDerWaalsContact O-N 3.14Å; V838-N841 PolarHBondContact O-N 3.05Å; V838-N841 VanDerWaalsContact O-N 3.11Å; V838-Q843 HydrophobicContact CG1-CB 3.6Å; V838-Q843 VanDerWaalsContact CG1-CB 3.46Å; V838-A844 HydrophobicContact CG1-CB 4.49Å; V838-A844 VanDerWaalsContact O-CB 3.29Å; V838-A844 WeakPolarHBondContact O-CB 3.39Å; V838-I847 HydrophobicContact CG1-CD1 4.11Å
839	T	46.3	Very low	59.9	Low	61.5 Å²	61.5	50.4 Å²	50.4	38%	0.377	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-19.4	179.7	25.5	0	0	0	0	114.5	F795 V834 E836 P837	F795-T839 HydrophobicContact CE2-CG2 4.44Å; V834-T839 HydrophobicContact CB-CG2 4.29Å; V834-T839 HydrophobicContact CG1-CG2 4Å; E836-T839 WeakPolarHBondContact CA-OG1 2.93Å; E836-T839 PolarHBondContact O-N 3.1Å; E836-T839 VanDerWaalsContact O-N 3.1Å; E836-T839 PolarHBondContact O-OG1 3.1Å; P837-T839 VanDerWaalsContact C-N 3.33Å
840	Y	50.1	Low	60.4	Low	158.5 Å²	158.5	53 Å²	53	62%	0.622	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.4	18.7	179.4	-61.9	-75.6	0	0	0	113.5	E836 P837 V838	E836-Y840 WeakPolarHBondContact O-CD2 3.47Å; E836-Y840 WeakPolarHBondContact O-CE2 3.49Å; P837-Y840 WeakPolarHBondContact O-CD2 3.37Å; P837-Y840 PolarHBondContact O-N 3.45Å; V838-Y840 VanDerWaalsContact C-N 3.26Å; V838-Y840 PolarHBondContact O-N 3.08Å; V838-Y840 VanDerWaalsContact O-N 3.14Å
841	N	57.8	Low	61	Low	80.5 Å²	80.5	54.2 Å²	54.2	43%	0.43	29%	0.287	S	S	.	.	S	Bend	trans	-120.5	156.8	179.5	-78.1	-24.3	0	0	0	111.3	P837 V838 Q843 A844 L845	P837-N841 PolarHBondContact O-ND2 3.37Å; V838-N841 PolarHBondContact O-N 3.05Å; V838-N841 VanDerWaalsContact O-N 3.11Å; N841-Q843 PolarHBondContact O-N 3.2Å; N841-Q843 VanDerWaalsContact O-N 3.09Å; N841-A844 WeakPolarHBondContact O-CB 3.48Å; N841-A844 PolarHBondContact O-N 3.14Å; N841-L845 PolarHBondContact O-N 3.14Å
842	S	62.9	Low	62	Low	41.25 Å²	41.25	52.3 Å²	52.3	29%	0.288	28%	0.28	S	S	.	.	H	α-helix	trans	-50	-25.6	176.4	58	0	0	0	0	114.6	L845 Q846 E874 L878	S842-L845 PolarHBondContact O-N 2.87Å; S842-Q846 WeakPolarHBondContact O-CB 3.32Å; S842-Q846 PolarHBondContact O-N 3.15Å; S842-E874 WeakPolarHBondContact CB-O 3.42Å; S842-L878 WeakPolarHBondContact O-CD2 3.47Å
843	Q	66.6	Low	63.8	Low	105 Å²	105	51.2 Å²	51.2	49%	0.491	28%	0.282	S	S	.	.	H	α-helix	trans	-68	-35.4	174.1	-73.4	-177.8	-10.7	0	0	113.9	E740 V838 N841 L845 Q846 I847	E740-Q843 PolarHBondContact OE1-NE2 2.94Å; E740-Q843 PolarHBondContact OE1-OE1 3.39Å; V838-Q843 HydrophobicContact CG1-CB 3.6Å; V838-Q843 VanDerWaalsContact CG1-CB 3.46Å; N841-Q843 PolarHBondContact O-N 3.2Å; N841-Q843 VanDerWaalsContact O-N 3.09Å; Q843-L845 VanDerWaalsContact C-N 3.27Å; Q843-L845 PolarHBondContact O-N 2.76Å; Q843-Q846 WeakPolarHBondContact O-CB 3.45Å; Q843-Q846 PolarHBondContact O-N 3.11Å; Q843-Q846 VanDerWaalsContact O-N 3.16Å; Q843-I847 WeakPolarHBondContact O-CD1 3.32Å; Q843-I847 VanDerWaalsContact O-CG1 3.24Å; Q843-I847 WeakPolarHBondContact O-CG1 3.45Å; Q843-I847 PolarHBondContact O-N 3.06Å
844	A	69.2	Low	65.5	Low	12.25 Å²	12.25	51.3 Å²	51.3	10%	0.101	28%	0.278	C	S	.	.	H	α-helix	trans	-65.9	-43.7	176.2	0	0	0	0	0	110.7	V834 V838 N841 Q846 I847 C848 M896	V834-A844 HydrophobicContact CG1-CB 4.06Å; V838-A844 HydrophobicContact CG1-CB 4.49Å; V838-A844 VanDerWaalsContact O-CB 3.29Å; V838-A844 WeakPolarHBondContact O-CB 3.39Å; N841-A844 WeakPolarHBondContact O-CB 3.48Å; N841-A844 PolarHBondContact O-N 3.14Å; A844-Q846 VanDerWaalsContact C-N 3.29Å; A844-Q846 PolarHBondContact O-N 3.25Å; A844-I847 PolarHBondContact O-N 3.12Å; A844-C848 WeakPolarHBondContact O-CB 3.42Å; A844-C848 PolarHBondContact O-N 3.18Å; A844-C848 PolarHBondContact O-SG 2.99Å; A844-C848 VanDerWaalsContact O-SG 3.4Å; A844-M896 HydrophobicContact CB-CE 4.31Å
845	L	79.2	Confident	67.4	Low	3.25 Å²	3.25	50.1 Å²	50.1	2%	0.017	27%	0.272	C	S	.	.	H	α-helix	trans	-57.3	-46.2	172.5	179.7	64.6	0	0	0	111.3	N841 S842 Q843 I847 C848 L849 P870 V875 L878 M896 M899	N841-L845 PolarHBondContact O-N 3.14Å; S842-L845 PolarHBondContact O-N 2.87Å; Q843-L845 VanDerWaalsContact C-N 3.27Å; Q843-L845 PolarHBondContact O-N 2.76Å; L845-I847 PolarHBondContact O-N 3.25Å; L845-C848 PolarHBondContact O-N 3.16Å; L845-L849 HydrophobicContact CD1-CD1 3.89Å; L845-L849 HydrophobicContact CD1-CD2 4.5Å; L845-L849 HydrophobicContact CD1-CG 4.17Å; L845-L849 HydrophobicContact CG-CD1 3.97Å; L845-L849 HydrophobicContact CG-CG 4.43Å; L845-L849 WeakPolarHBondContact O-CB 3.29Å; L845-L849 VanDerWaalsContact O-CG 3.31Å; L845-L849 WeakPolarHBondContact O-CG 3.28Å; L845-L849 PolarHBondContact O-N 3.14Å; L845-L849 VanDerWaalsContact O-N 3.1Å; L845-P870 HydrophobicContact CD1-CG 4.36Å; L845-P870 HydrophobicContact CD2-CB 4.14Å; L845-P870 HydrophobicContact CD2-CG 4.21Å; L845-V875 HydrophobicContact CD2-CB 4.48Å; L845-V875 HydrophobicContact CD2-CG2 3.96Å; L845-L878 HydrophobicContact CB-CD2 4.4Å; L845-L878 HydrophobicContact CD2-CD1 4.05Å; L845-L878 HydrophobicContact CD2-CD2 4.19Å; L845-L878 HydrophobicContact CD2-CG 4.3Å; L845-L878 HydrophobicContact CG-CD1 4.33Å; L845-L878 HydrophobicContact CG-CD2 4.17Å; L845-M896 VanDerWaalsContact CA-CE 3.44Å; L845-M896 HydrophobicContact CB-CE 4.1Å; L845-M896 HydrophobicContact CB-SD 4.4Å; L845-M896 HydrophobicContact CD1-CE 3.83Å; L845-M896 VanDerWaalsContact CD1-CE 3.48Å; L845-M896 HydrophobicContact CD1-CG 4.05Å; L845-M896 HydrophobicContact CD1-SD 3.26Å; L845-M896 WeakPolarHBondContact CD1-SD 3.49Å; L845-M896 HydrophobicContact CG-CE 4.4Å; L845-M896 HydrophobicContact CG-SD 4.34Å; L845-M899 HydrophobicContact CD1-CE 4.14Å; L845-M899 HydrophobicContact CD1-SD 4.22Å; L845-M899 HydrophobicContact CD2-CE 4.23Å
846	Q	79.9	Confident	69.5	Low	50.75 Å²	50.75	49 Å²	49	24%	0.237	26%	0.263	C	S	.	.	H	α-helix	trans	-56.5	-51.8	176.1	-177.8	-173.5	-14.1	0	0	111.9	S842 Q843 A844 C848 L849 E850 L878 P879 L882	S842-Q846 WeakPolarHBondContact O-CB 3.32Å; S842-Q846 PolarHBondContact O-N 3.15Å; Q843-Q846 WeakPolarHBondContact O-CB 3.45Å; Q843-Q846 PolarHBondContact O-N 3.11Å; Q843-Q846 VanDerWaalsContact O-N 3.16Å; A844-Q846 VanDerWaalsContact C-N 3.29Å; A844-Q846 PolarHBondContact O-N 3.25Å; Q846-C848 PolarHBondContact O-N 3.16Å; Q846-L849 PolarHBondContact O-N 3.1Å; Q846-E850 HydrophobicContact CG-CG 4.34Å; Q846-E850 WeakPolarHBondContact CG-OE1 3.37Å; Q846-E850 PolarHBondContact NE2-OE1 3.2Å; Q846-E850 WeakPolarHBondContact O-CB 3.34Å; Q846-E850 WeakPolarHBondContact O-CG 3.4Å; Q846-E850 PolarHBondContact O-N 3.2Å; Q846-L878 HydrophobicContact CB-CD2 3.82Å; Q846-L878 HydrophobicContact CG-CD2 4.4Å; Q846-P879 HydrophobicContact CG-CG 4.35Å; Q846-L882 HydrophobicContact CB-CD2 4.29Å; Q846-L882 HydrophobicContact CG-CD2 3.82Å
847	I	74.4	Confident	71.9	Confident	59.25 Å²	59.25	44.8 Å²	44.8	30%	0.304	24%	0.243	S	C	.	.	H	α-helix	trans	-62.2	-44.8	-177.9	-66.6	167.2	0	0	0	110.7	L830 V834 V838 Q843 A844 L845 L849 E850 Q851	L830-I847 HydrophobicContact CD1-CG2 4.16Å; L830-I847 HydrophobicContact CD2-CG2 4.03Å; L830-I847 HydrophobicContact CG-CG2 4.48Å; V834-I847 HydrophobicContact CG2-CD1 4.29Å; V838-I847 HydrophobicContact CG1-CD1 4.11Å; Q843-I847 WeakPolarHBondContact O-CD1 3.32Å; Q843-I847 VanDerWaalsContact O-CG1 3.24Å; Q843-I847 WeakPolarHBondContact O-CG1 3.45Å; Q843-I847 PolarHBondContact O-N 3.06Å; A844-I847 PolarHBondContact O-N 3.12Å; L845-I847 PolarHBondContact O-N 3.25Å; I847-L849 VanDerWaalsContact C-N 3.31Å; I847-L849 PolarHBondContact O-N 3.11Å; I847-E850 PolarHBondContact O-N 2.99Å; I847-Q851 HydrophobicContact CG2-CG 4.08Å; I847-Q851 WeakPolarHBondContact O-CB 3.31Å; I847-Q851 VanDerWaalsContact O-CG 3.28Å; I847-Q851 WeakPolarHBondContact O-CG 3.33Å; I847-Q851 PolarHBondContact O-N 3.19Å
848	C	81	Confident	74.3	Confident	11.75 Å²	11.75	40.6 Å²	40.6	8%	0.079	22%	0.216	C	C	.	.	H	α-helix	trans	-55.5	-49.1	177.2	-77.3	0	0	0	0	111.9	L830 A844 L845 Q846 Q851 A852 M896 E900	L830-C848 VanDerWaalsContact CD1-CA 3.41Å; L830-C848 HydrophobicContact CD1-CB 4.19Å; L830-C848 WeakPolarHBondContact CD1-SG 3.42Å; A844-C848 WeakPolarHBondContact O-CB 3.42Å; A844-C848 PolarHBondContact O-N 3.18Å; A844-C848 PolarHBondContact O-SG 2.99Å; A844-C848 VanDerWaalsContact O-SG 3.4Å; L845-C848 PolarHBondContact O-N 3.16Å; Q846-C848 PolarHBondContact O-N 3.16Å; C848-Q851 PolarHBondContact O-N 3.27Å; C848-A852 VanDerWaalsContact O-CB 3.27Å; C848-A852 WeakPolarHBondContact O-CB 3.46Å; C848-A852 PolarHBondContact O-N 3.24Å; C848-M896 HydrophobicContact CB-CE 3.81Å; C848-M896 HydrophobicContact CB-SD 4.37Å; C848-M896 WeakPolarHBondContact SG-CE 3.25Å; C848-E900 HydrophobicContact CB-CG 4.25Å; C848-E900 WeakPolarHBondContact CB-OE1 3.39Å; C848-E900 PolarHBondContact SG-OE1 3.09Å; C848-E900 VanDerWaalsContact SG-OE1 3.32Å
849	L	85.2	Confident	76.5	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-69.8	-39.7	-178.4	-63.4	173.7	0	0	0	112.4	L845 Q846 I847 A852 A853 L878 L882 V886 M899 E900 M903	L845-L849 HydrophobicContact CD1-CD1 3.89Å; L845-L849 HydrophobicContact CD1-CD2 4.5Å; L845-L849 HydrophobicContact CD1-CG 4.17Å; L845-L849 HydrophobicContact CG-CD1 3.97Å; L845-L849 HydrophobicContact CG-CG 4.43Å; L845-L849 WeakPolarHBondContact O-CB 3.29Å; L845-L849 VanDerWaalsContact O-CG 3.31Å; L845-L849 WeakPolarHBondContact O-CG 3.28Å; L845-L849 PolarHBondContact O-N 3.14Å; L845-L849 VanDerWaalsContact O-N 3.1Å; Q846-L849 PolarHBondContact O-N 3.1Å; I847-L849 VanDerWaalsContact C-N 3.31Å; I847-L849 PolarHBondContact O-N 3.11Å; L849-A852 PolarHBondContact O-N 3.2Å; L849-A853 VanDerWaalsContact O-CB 3.31Å; L849-A853 WeakPolarHBondContact O-CB 3.32Å; L849-A853 PolarHBondContact O-N 3.14Å; L849-L878 HydrophobicContact CD1-CD1 3.92Å; L849-L882 HydrophobicContact CB-CD1 4.17Å; L849-L882 HydrophobicContact CB-CD2 4.18Å; L849-L882 HydrophobicContact CD1-CD2 4.35Å; L849-V886 HydrophobicContact CD1-CG2 3.75Å; L849-M899 HydrophobicContact CD1-CE 4.16Å; L849-M899 HydrophobicContact CD2-CB 3.85Å; L849-E900 HydrophobicContact CD2-CG 4.42Å; L849-M903 HydrophobicContact CB-CE 4.33Å; L849-M903 HydrophobicContact CB-CG 4.28Å; L849-M903 HydrophobicContact CD2-CB 4.19Å; L849-M903 HydrophobicContact CD2-CE 4.38Å; L849-M903 HydrophobicContact CD2-CG 4.04Å; L849-M903 VanDerWaalsContact CD2-CG 3.5Å; L849-M903 HydrophobicContact CG-CG 4.26Å; L849-M903 WeakPolarHBondContact O-CG 3.39Å
850	E	81.6	Confident	78.7	Confident	73.75 Å²	73.75	36.1 Å²	36.1	35%	0.345	19%	0.189	S	C	.	.	H	α-helix	trans	-64.6	-43.3	176.1	-75.4	178	-178.1	0	0	111.8	Q846 I847 A853 A854 L882	Q846-E850 HydrophobicContact CG-CG 4.34Å; Q846-E850 WeakPolarHBondContact CG-OE1 3.37Å; Q846-E850 PolarHBondContact NE2-OE1 3.2Å; Q846-E850 WeakPolarHBondContact O-CB 3.34Å; Q846-E850 WeakPolarHBondContact O-CG 3.4Å; Q846-E850 PolarHBondContact O-N 3.2Å; I847-E850 PolarHBondContact O-N 2.99Å; E850-A853 PolarHBondContact O-N 3.07Å; E850-A854 VanDerWaalsContact O-CB 3.27Å; E850-A854 WeakPolarHBondContact O-CB 3.35Å; E850-A854 PolarHBondContact O-N 2.85Å; E850-L882 HydrophobicContact CG-CD1 4.34Å; E850-L882 HydrophobicContact CG-CD2 4.26Å
851	Q	80.3	Confident	80.7	Confident	53 Å²	53	28.5 Å²	28.5	25%	0.248	16%	0.159	C	C	.	.	H	α-helix	trans	-69.6	-39	177.5	-65.7	-54.5	-45	0	0	111.9	F790 I828 L830 I847 C848 A853 A854 S855	F790-Q851 HydrophobicContact CD2-CB 3.79Å; F790-Q851 HydrophobicContact CE2-CB 3.61Å; F790-Q851 HydrophobicContact CZ-CB 4.43Å; I828-Q851 VanDerWaalsContact CD1-OE1 3.25Å; I828-Q851 HydrophobicContact CG2-CB 4.15Å; I828-Q851 HydrophobicContact CG2-CG 4.18Å; L830-Q851 HydrophobicContact CD1-CB 4.33Å; L830-Q851 HydrophobicContact CD1-CG 4.25Å; L830-Q851 HydrophobicContact CD2-CG 4.35Å; I847-Q851 HydrophobicContact CG2-CG 4.08Å; I847-Q851 WeakPolarHBondContact O-CB 3.31Å; I847-Q851 VanDerWaalsContact O-CG 3.28Å; I847-Q851 WeakPolarHBondContact O-CG 3.33Å; I847-Q851 PolarHBondContact O-N 3.19Å; C848-Q851 PolarHBondContact O-N 3.27Å; Q851-A853 VanDerWaalsContact C-N 3.32Å; Q851-A853 PolarHBondContact O-N 2.83Å; Q851-A854 PolarHBondContact O-N 2.99Å; Q851-S855 WeakPolarHBondContact O-CB 3.25Å; Q851-S855 PolarHBondContact O-N 3.17Å
852	A	83.8	Confident	82.2	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-59.9	-43.6	172.9	0	0	0	0	0	111.2	F790 C848 L849 S855 F858 E900 M903	F790-A852 HydrophobicContact CD1-CB 4.36Å; F790-A852 HydrophobicContact CE1-CB 4.1Å; F790-A852 HydrophobicContact CZ-CB 4.41Å; C848-A852 VanDerWaalsContact O-CB 3.27Å; C848-A852 WeakPolarHBondContact O-CB 3.46Å; C848-A852 PolarHBondContact O-N 3.24Å; L849-A852 PolarHBondContact O-N 3.2Å; A852-S855 PolarHBondContact O-N 3.1Å; A852-S855 PolarHBondContact O-OG 3.04Å; A852-F858 HydrophobicContact CB-CD2 4.39Å; A852-F858 HydrophobicContact CB-CE2 3.97Å; A852-E900 HydrophobicContact CB-CB 4.23Å; A852-E900 HydrophobicContact CB-CG 4.41Å; A852-M903 HydrophobicContact CB-CB 4.41Å
853	A	83.6	Confident	83.4	Confident	29 Å²	29	22.9 Å²	22.9	24%	0.24	13%	0.125	C	C	.	.	H	α-helix	trans	-68.1	-35.9	176.9	0	0	0	0	0	113.4	L849 E850 Q851 S855 M903 A907	L849-A853 VanDerWaalsContact O-CB 3.31Å; L849-A853 WeakPolarHBondContact O-CB 3.32Å; L849-A853 PolarHBondContact O-N 3.14Å; E850-A853 PolarHBondContact O-N 3.07Å; Q851-A853 VanDerWaalsContact C-N 3.32Å; Q851-A853 PolarHBondContact O-N 2.83Å; A853-S855 VanDerWaalsContact C-N 3.33Å; A853-M903 HydrophobicContact CB-CE 4Å; A853-M903 HydrophobicContact CB-CG 3.89Å; A853-M903 HydrophobicContact CB-SD 4.21Å; A853-A907 HydrophobicContact CB-CB 4.32Å; A853-A907 VanDerWaalsContact O-CB 3.28Å; A853-A907 WeakPolarHBondContact O-CB 3.35Å
854	A	79.4	Confident	84.5	Confident	40 Å²	40	19 Å²	19	33%	0.331	11%	0.108	S	C	.	.	H	α-helix	trans	-76.6	-20.7	-179.7	0	0	0	0	0	113.5	K776 Q788 E850 Q851 K911	K776-A854 VanDerWaalsContact CE-O 3.29Å; K776-A854 WeakPolarHBondContact CE-O 3.34Å; K776-A854 PolarHBondContact NZ-O 3.13Å; K776-A854 VanDerWaalsContact NZ-O 3.12Å; Q788-A854 PolarHBondContact OE1-O 3.31Å; E850-A854 VanDerWaalsContact O-CB 3.27Å; E850-A854 WeakPolarHBondContact O-CB 3.35Å; E850-A854 PolarHBondContact O-N 2.85Å; Q851-A854 PolarHBondContact O-N 2.99Å; A854-K911 PolarHBondContact O-NZ 3.08Å
855	S	84.8	Confident	85.4	Confident	9 Å²	9	20.1 Å²	20.1	6%	0.063	11%	0.11	C	C	.	.			trans	-57.9	147	-176	72.6	0	0	0	0	113.7	F790 Q851 A852 A853 K911	F790-S855 VanDerWaalsContact CB-CB 3.5Å; Q851-S855 WeakPolarHBondContact O-CB 3.25Å; Q851-S855 PolarHBondContact O-N 3.17Å; A852-S855 PolarHBondContact O-N 3.1Å; A852-S855 PolarHBondContact O-OG 3.04Å; A853-S855 VanDerWaalsContact C-N 3.33Å; S855-K911 PolarHBondContact O-NZ 3.14Å
856	D	85.1	Confident	85.9	Confident	29.5 Å²	29.5	20.1 Å²	20.1	16%	0.158	11%	0.109	C	C	.	.	S	Bend	trans	-91.5	-38.8	172.6	-65.6	-54.7	0	0	0	111.1	K776 C787 Q788 K911 R932	K776-D856 IonicContact NZ-OD1 3.63Å; K776-D856 PolarHBondContact NZ-OD1 3.16Å; K776-D856 IonicContact NZ-OD2 3.24Å; K776-D856 PolarHBondContact NZ-OD2 3.11Å; C787-D856 WeakPolarHBondContact CA-OD2 3.49Å; Q788-D856 PolarHBondContact N-OD2 2.9Å; Q788-D856 WeakPolarHBondContact O-CA 3.34Å; Q788-D856 WeakPolarHBondContact O-CB 3.32Å; Q788-D856 PolarHBondContact O-N 3.3Å; D856-K911 IonicContact OD1-NZ 3.31Å; D856-K911 PolarHBondContact OD1-NZ 3Å; D856-R932 WeakPolarHBondContact O-CB 3.3Å; D856-R932 WeakPolarHBondContact O-CG 3.36Å; D856-R932 PolarHBondContact O-NH1 3.31Å; D856-R932 IonicContact OD1-NH1 3.09Å; D856-R932 PolarHBondContact OD1-NH1 2.89Å
857	I	89.7	Confident	86.1	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	128.3	172	-58.1	175.2	0	0	0	108.5	Q788 L789 F790 V859 R932 V1011 L1014 L1015 L1018	Q788-I857 PolarHBondContact O-N 2.95Å; L789-I857 CarbonylContact C-O 3.51Å; L789-I857 VanDerWaalsContact CA-O 3.31Å; L789-I857 WeakPolarHBondContact CA-O 3.43Å; L789-I857 HydrophobicContact CD1-CB 3.66Å; L789-I857 HydrophobicContact CD1-CG2 3.82Å; L789-I857 VanDerWaalsContact CD1-CG2 3.49Å; L789-I857 HydrophobicContact CG-CB 4.42Å; L789-I857 HydrophobicContact CG-CG2 4.35Å; F790-I857 PolarHBondContact N-O 3.2Å; I857-V859 HydrophobicContact CG2-CG2 4.33Å; I857-R932 CarbonylContact C-O 3.56Å; I857-R932 VanDerWaalsContact CA-O 3.27Å; I857-R932 WeakPolarHBondContact CA-O 3.33Å; I857-V1011 HydrophobicContact CD1-CG1 4.4Å; I857-L1014 HydrophobicContact CD1-CB 4.11Å; I857-L1014 HydrophobicContact CG2-CD1 4.14Å; I857-L1015 HydrophobicContact CD1-CD2 3.84Å; I857-L1015 HydrophobicContact CD1-CG 4.11Å; I857-L1018 HydrophobicContact CD1-CD1 3.99Å; I857-L1018 HydrophobicContact CG1-CD1 3.72Å
858	F	92.4	Very high	86.4	Confident	1.25 Å²	1.25	19.2 Å²	19.2	1%	0.005	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	122.5	175.3	-174.1	-90.2	0	0	0	109.6	F790 S792 A852 L860 E900 Y901 A904 R932 I933 C934	F790-F858 HydrophobicContact CB-CD2 4.35Å; F790-F858 AromaticContact CD1-CD2 3.51Å; F790-F858 HydrophobicContact CD1-CD2 3.51Å; F790-F858 VanDerWaalsContact CD1-CD2 3.45Å; F790-F858 AromaticContact CD1-CE2 3.36Å; F790-F858 HydrophobicContact CD1-CE2 3.36Å; F790-F858 VanDerWaalsContact CD1-CE2 3.4Å; F790-F858 HydrophobicContact CD1-CZ 4.39Å; F790-F858 HydrophobicContact CE1-CD2 4.26Å; F790-F858 AromaticContact CE1-CE2 3.64Å; F790-F858 HydrophobicContact CE1-CE2 3.64Å; F790-F858 HydrophobicContact CE1-CZ 4.35Å; F790-F858 HydrophobicContact CG-CD2 4.32Å; F790-F858 HydrophobicContact CG-CE2 4.45Å; S792-F858 VanDerWaalsContact CB-CZ 3.48Å; A852-F858 HydrophobicContact CB-CD2 4.39Å; A852-F858 HydrophobicContact CB-CE2 3.97Å; F858-L860 HydrophobicContact CD1-CB 4.34Å; F858-L860 HydrophobicContact CE1-CB 3.86Å; F858-L860 HydrophobicContact CE1-CD1 4.4Å; F858-L860 HydrophobicContact CE1-CG 4.48Å; F858-E900 HydrophobicContact CE2-CB 4.07Å; F858-E900 HydrophobicContact CZ-CB 3.95Å; F858-Y901 HydrophobicContact CE1-CD2 4.27Å; F858-A904 HydrophobicContact CB-CB 3.93Å; F858-A904 HydrophobicContact CD1-CB 4.17Å; F858-A904 HydrophobicContact CD2-CB 3.37Å; F858-A904 VanDerWaalsContact CD2-CB 3.42Å; F858-A904 HydrophobicContact CE1-CB 4.46Å; F858-A904 HydrophobicContact CE2-CB 3.81Å; F858-A904 HydrophobicContact CG-CB 3.57Å; F858-A904 VanDerWaalsContact CG-CB 3.48Å; F858-A904 HydrophobicContact CZ-CB 4.36Å; F858-R932 PolarHBondContact N-O 3.04Å; F858-I933 HydrophobicContact CB-CG1 4.29Å; F858-I933 HydrophobicContact CB-CG2 4.42Å; F858-I933 HydrophobicContact CD1-CG2 4.06Å; F858-I933 CarbonylContact O-C 3.57Å; F858-I933 WeakPolarHBondContact O-CA 3.42Å; F858-C934 PolarHBondContact O-N 3.28Å
859	V	92.2	Very high	86.7	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	120.2	178	179.4	0	0	0	0	108.1	L789 F790 I791 S792 L805 I857 L861 C934 F936 F1007	L789-V859 HydrophobicContact CD1-CG2 3.76Å; L789-V859 VanDerWaalsContact CD1-CG2 3.43Å; L789-V859 HydrophobicContact CD2-CG2 3.73Å; L789-V859 HydrophobicContact CG-CG2 4.09Å; F790-V859 PolarHBondContact O-N 3.33Å; I791-V859 HydrophobicContact CG1-CB 4.45Å; S792-V859 PolarHBondContact N-O 3.23Å; L805-V859 HydrophobicContact CD1-CG1 4.5Å; I857-V859 HydrophobicContact CG2-CG2 4.33Å; V859-L861 HydrophobicContact CG1-CD2 4.1Å; V859-C934 CarbonylContact C-O 3.5Å; V859-C934 WeakPolarHBondContact CA-O 3.27Å; V859-F936 HydrophobicContact CG1-CD2 4.12Å; V859-F936 HydrophobicContact CG1-CE2 4.09Å; V859-F1007 HydrophobicContact CB-CE2 4.48Å; V859-F1007 HydrophobicContact CG1-CD2 4.42Å; V859-F1007 HydrophobicContact CG1-CE2 3.98Å; V859-F1007 HydrophobicContact CG2-CE2 3.98Å
860	L	92.9	Very high	86.7	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	125.9	176.5	-177.1	60.8	0	0	0	110.5	S792 F858 L862 T897 Y901 C934 V935 F936 F968 I972	S792-L860 CarbonylContact O-C 3.55Å; S792-L860 WeakPolarHBondContact O-CA 3.37Å; F858-L860 HydrophobicContact CD1-CB 4.34Å; F858-L860 HydrophobicContact CE1-CB 3.86Å; F858-L860 HydrophobicContact CE1-CD1 4.4Å; F858-L860 HydrophobicContact CE1-CG 4.48Å; L860-L862 HydrophobicContact CD1-CD2 4.14Å; L860-L862 HydrophobicContact CD1-CG 4.39Å; L860-L862 HydrophobicContact CD2-CD1 4Å; L860-L862 HydrophobicContact CD2-CD2 4.25Å; L860-L862 HydrophobicContact CD2-CG 4.13Å; L860-L862 HydrophobicContact CG-CD1 4.39Å; L860-L862 HydrophobicContact CG-CD2 4.1Å; L860-L862 HydrophobicContact CG-CG 3.98Å; L860-T897 HydrophobicContact CD1-CG2 3.46Å; L860-T897 VanDerWaalsContact CD1-CG2 3.46Å; L860-Y901 HydrophobicContact CD2-CD2 3.96Å; L860-Y901 HydrophobicContact CD2-CG 4.44Å; L860-C934 PolarHBondContact N-O 3.09Å; L860-V935 HydrophobicContact CB-CB 4.36Å; L860-V935 HydrophobicContact CB-CG1 4.08Å; L860-V935 HydrophobicContact CB-CG2 4Å; L860-V935 HydrophobicContact CD2-CG1 4.02Å; L860-V935 HydrophobicContact CD2-CG2 4.14Å; L860-V935 HydrophobicContact CG-CG1 4.13Å; L860-V935 CarbonylContact O-C 3.55Å; L860-V935 VanDerWaalsContact O-CA 3.31Å; L860-V935 WeakPolarHBondContact O-CA 3.35Å; L860-F936 PolarHBondContact O-N 3.05Å; L860-F968 HydrophobicContact CD2-CE1 4.13Å; L860-F968 HydrophobicContact CD2-CZ 3.92Å; L860-I972 HydrophobicContact CD2-CD1 3.72Å
861	L	91.7	Very high	86.8	Confident	0 Å²	0	23 Å²	23	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	125	172.2	-47	176.7	0	0	0	109.4	I791 S792 M798 E801 R802 L805 V859 F936 F1003	I791-L861 HydrophobicContact CG2-CD1 4.33Å; S792-L861 PolarHBondContact O-N 2.98Å; M798-L861 HydrophobicContact CE-CB 3.86Å; M798-L861 HydrophobicContact SD-CB 4.34Å; E801-L861 HydrophobicContact CB-CD1 4.01Å; R802-L861 HydrophobicContact CG-CD1 4.01Å; L805-L861 HydrophobicContact CD1-CD1 3.76Å; L805-L861 HydrophobicContact CD1-CD2 4.23Å; L805-L861 HydrophobicContact CD1-CG 4.37Å; V859-L861 HydrophobicContact CG1-CD2 4.1Å; L861-F936 WeakPolarHBondContact CA-O 3.23Å; L861-F936 HydrophobicContact CD2-CB 3.89Å; L861-F936 HydrophobicContact CD2-CD2 3.97Å; L861-F936 HydrophobicContact CD2-CG 4.24Å; L861-F1003 HydrophobicContact CD1-CZ 4.43Å; L861-F1003 HydrophobicContact CD2-CE2 3.64Å; L861-F1003 HydrophobicContact CD2-CZ 3.74Å
862	L	90.5	Very high	87	Confident	2.25 Å²	2.25	25.3 Å²	25.3	1%	0.012	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	131.1	-180	-66.6	177.5	0	0	0	112	M798 L860 T897 V935 F936 I937 R938 F968 K969 I972	M798-L862 WeakPolarHBondContact CE-O 3.42Å; L860-L862 HydrophobicContact CD1-CD2 4.14Å; L860-L862 HydrophobicContact CD1-CG 4.39Å; L860-L862 HydrophobicContact CD2-CD1 4Å; L860-L862 HydrophobicContact CD2-CD2 4.25Å; L860-L862 HydrophobicContact CD2-CG 4.13Å; L860-L862 HydrophobicContact CG-CD1 4.39Å; L860-L862 HydrophobicContact CG-CD2 4.1Å; L860-L862 HydrophobicContact CG-CG 3.98Å; L862-T897 HydrophobicContact CD2-CG2 4.38Å; L862-V935 HydrophobicContact CD1-CG1 4.21Å; L862-V935 HydrophobicContact CG-CG1 4.46Å; L862-F936 PolarHBondContact N-O 3.03Å; L862-I937 HydrophobicContact CB-CG1 4.33Å; L862-I937 HydrophobicContact CD1-CD1 4.38Å; L862-I937 HydrophobicContact CD1-CG1 4.47Å; L862-I937 WeakPolarHBondContact O-CA 3.21Å; L862-R938 PolarHBondContact O-N 3.1Å; L862-F968 HydrophobicContact CD1-CD1 4.29Å; L862-F968 HydrophobicContact CD1-CE1 4.13Å; L862-F968 HydrophobicContact CD2-CD1 4.44Å; L862-F968 HydrophobicContact CD2-CE1 4.05Å; L862-K969 HydrophobicContact CD1-CG 4.39Å; L862-I972 HydrophobicContact CD1-CD1 3.43Å; L862-I972 VanDerWaalsContact CD1-CD1 3.45Å
863	G	88.8	Confident	87	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	18%	0.178	C	C	.	.			trans	-111.9	-136.3	170.4	0	0	0	0	0	110.9	K969	G863-K969 VanDerWaalsContact O-CE 3.26Å; G863-K969 WeakPolarHBondContact O-CE 3.38Å; G863-K969 PolarHBondContact O-NZ 3.09Å
864	D	89.2	Confident	86.9	Confident	23.5 Å²	23.5	31.4 Å²	31.4	13%	0.126	18%	0.179	C	C	.	.	B	Isolated β-bridge	trans	-108.4	16.1	179.8	-65.4	-41.8	0	0	0	112.9	S940 F954 E955 E956 L965 K969	D864-S940 PolarHBondContact OD1-OG 3.03Å; D864-S940 VanDerWaalsContact OD1-OG 3.08Å; D864-S940 WeakPolarHBondContact OD2-CA 3.09Å; D864-S940 WeakPolarHBondContact OD2-CB 3.43Å; D864-S940 PolarHBondContact OD2-OG 3.29Å; D864-F954 CarbonylContact C-O 3.43Å; D864-E955 HydrophobicContact CB-CG 4.48Å; D864-E956 WeakPolarHBondContact O-CB 3.37Å; D864-E956 PolarHBondContact O-N 3.15Å; D864-E956 VanDerWaalsContact O-N 3.13Å; D864-L965 VanDerWaalsContact C-CD2 3.45Å; D864-K969 IonicContact OD1-NZ 2.98Å; D864-K969 PolarHBondContact OD1-NZ 3.15Å
865	R	88.1	Confident	87.1	Confident	36.25 Å²	36.25	29.6 Å²	29.6	14%	0.137	16%	0.163	C	C	.	.			trans	-109	142.4	169.6	-60.4	-166.9	68.1	136.2	11.4	112.4	T794 D797 H952 Y953 F954 E956	T794-R865 HydrophobicContact CG2-CB 4.23Å; D797-R865 HydrophobicContact CB-CG 4.09Å; R865-H952 PolarHBondContact NH1-O 3.06Å; R865-H952 VanDerWaalsContact NH1-O 3.08Å; R865-Y953 VanDerWaalsContact CD-O 3.29Å; R865-Y953 WeakPolarHBondContact CD-O 3.28Å; R865-Y953 PolarHBondContact NH1-O 3.13Å; R865-Y953 VanDerWaalsContact NH1-O 3.09Å; R865-F954 VanDerWaalsContact CG-O 3.27Å; R865-F954 WeakPolarHBondContact CG-O 3.35Å; R865-E956 IonicContact NE-OE2 3.37Å; R865-E956 IonicContact NH2-OE2 3.65Å
866	Y	88.3	Confident	87.1	Confident	3.25 Å²	3.25	34.6 Å²	34.6	1%	0.013	19%	0.187	C	C	.	.			trans	-84.3	-30.3	177.1	-173	-125.4	0	0	0	112.9	I869 G893 M894 S895 T897 E898 K961 R964 L965	Y866-I869 HydrophobicContact CD1-CD1 4.23Å; Y866-I869 HydrophobicContact CD1-CG1 4.32Å; Y866-I869 HydrophobicContact CE1-CD1 4.07Å; Y866-I869 HydrophobicContact CE1-CG1 4.13Å; Y866-G893 WeakPolarHBondContact CE1-O 3.31Å; Y866-G893 PolarHBondContact OH-O 3.23Å; Y866-M894 WeakPolarHBondContact OH-CA 3.3Å; Y866-S895 VanDerWaalsContact O-CB 3.24Å; Y866-S895 WeakPolarHBondContact O-CB 3.4Å; Y866-S895 PolarHBondContact O-OG 3.03Å; Y866-S895 VanDerWaalsContact O-OG 3.06Å; Y866-S895 PolarHBondContact OH-N 3.45Å; Y866-T897 PolarHBondContact O-OG1 3.06Å; Y866-E898 VanDerWaalsContact CE2-OE2 3.25Å; Y866-E898 WeakPolarHBondContact CE2-OE2 3.4Å; Y866-E898 VanDerWaalsContact CZ-OE2 3.27Å; Y866-E898 PolarHBondContact OH-OE2 3.05Å; Y866-K961 HydrophobicContact CD1-CB 4.08Å; Y866-K961 HydrophobicContact CD1-CG 4.1Å; Y866-K961 HydrophobicContact CG-CB 4.35Å; Y866-R964 HydrophobicContact CD1-CB 4.32Å; Y866-R964 HydrophobicContact CD2-CB 4.22Å; Y866-R964 HydrophobicContact CE1-CB 3.89Å; Y866-R964 HydrophobicContact CE1-CG 4.45Å; Y866-R964 HydrophobicContact CE2-CB 3.74Å; Y866-R964 HydrophobicContact CG-CB 4.43Å; Y866-R964 PolarHBondContact OH-NE 2.89Å; Y866-L965 HydrophobicContact CD2-CB 3.91Å; Y866-L965 HydrophobicContact CD2-CD1 4.38Å; Y866-L965 HydrophobicContact CG-CB 4.41Å
867	G	84	Confident	87	Confident	15.75 Å²	15.75	36.1 Å²	36.1	16%	0.162	20%	0.204	C	C	.	.			trans	104.3	-166.9	177.6	0	0	0	0	0	114.3	T794	T794-G867 VanDerWaalsContact CG2-CA 3.49Å
868	C	82	Confident	86.7	Confident	74.5 Å²	74.5	36.5 Å²	36.5	50%	0.503	21%	0.206	S	C	.	.			trans	-81.6	134.5	178.6	-170.9	0	0	0	0	110.2	S895 M896	C868-S895 CarbonylContact O-C 3.56Å; C868-S895 VanDerWaalsContact O-CA 3.28Å; C868-S895 WeakPolarHBondContact O-CA 3.29Å; C868-S895 WeakPolarHBondContact O-CB 3.42Å; C868-M896 PolarHBondContact O-N 3.17Å
869	I	86.8	Confident	86.3	Confident	54 Å²	54	38.6 Å²	38.6	28%	0.277	22%	0.22	S	C	.	.			trans	-101.7	114.9	173.6	-63.4	173.1	0	0	0	106.2	Y866 G893 K961	Y866-I869 HydrophobicContact CD1-CD1 4.23Å; Y866-I869 HydrophobicContact CD1-CG1 4.32Å; Y866-I869 HydrophobicContact CE1-CD1 4.07Å; Y866-I869 HydrophobicContact CE1-CG1 4.13Å; I869-G893 WeakPolarHBondContact CD1-O 3.44Å; I869-G893 VanDerWaalsContact CG2-CA 3.49Å; I869-K961 HydrophobicContact CD1-CD 4.42Å; I869-K961 HydrophobicContact CD1-CG 4.18Å
870	P	84.9	Confident	85.7	Confident	8.75 Å²	8.75	46.5 Å²	46.5	6%	0.057	26%	0.257	C	S	.	.			trans	-67.8	147.9	175.7	28.8	-32.8	0	0	0	110.5	L845 E874 V875 M894 M896 M899	L845-P870 HydrophobicContact CD1-CG 4.36Å; L845-P870 HydrophobicContact CD2-CB 4.14Å; L845-P870 HydrophobicContact CD2-CG 4.21Å; P870-E874 WeakPolarHBondContact CA-OE2 3.26Å; P870-E874 WeakPolarHBondContact CB-OE2 3.48Å; P870-V875 HydrophobicContact CB-CG2 4.21Å; P870-V875 HydrophobicContact CG-CG2 3.94Å; P870-M894 WeakPolarHBondContact CD-O 3.44Å; P870-M896 HydrophobicContact CB-SD 4.1Å; P870-M896 HydrophobicContact CG-SD 3.88Å; P870-M899 HydrophobicContact CG-SD 3.83Å
871	D	84.6	Confident	85	Confident	102.25 Å²	102.25	50.5 Å²	50.5	55%	0.547	28%	0.284	S	S	.	.			trans	-66.5	145.4	175.5	-100.9	-9.8	0	0	0	110	T873 E874 V875	D871-T873 PolarHBondContact O-N 3.36Å; D871-T873 VanDerWaalsContact O-N 3.13Å; D871-T873 PolarHBondContact OD2-OG1 3.1Å; D871-E874 HydrophobicContact CB-CG 4.15Å; D871-E874 PolarHBondContact N-OE2 3Å; D871-E874 WeakPolarHBondContact O-CA 3.31Å; D871-E874 WeakPolarHBondContact O-CB 3.36Å; D871-E874 PolarHBondContact O-N 3.07Å; D871-V875 PolarHBondContact O-N 2.97Å; D871-V875 VanDerWaalsContact O-N 3.17Å
872	E	84.4	Confident	84.6	Confident	103 Å²	103	51.1 Å²	51.1	48%	0.481	29%	0.287	S	S	.	.	H	α-helix	trans	-57.1	-33	179.8	-69.7	-174.4	177.4	0	0	111.8	E874 V875 M876 P892	E872-E874 VanDerWaalsContact C-N 3.29Å; E872-E874 PolarHBondContact O-N 3.03Å; E872-V875 PolarHBondContact O-N 3.22Å; E872-M876 WeakPolarHBondContact O-CB 3.39Å; E872-M876 VanDerWaalsContact O-CG 3.23Å; E872-M876 WeakPolarHBondContact O-CG 3.27Å; E872-M876 PolarHBondContact O-N 3.25Å; E872-P892 VanDerWaalsContact OE1-CB 3.24Å; E872-P892 WeakPolarHBondContact OE1-CB 3.27Å; E872-P892 VanDerWaalsContact OE1-CG 3.23Å; E872-P892 WeakPolarHBondContact OE1-CG 3.35Å
873	T	83.1	Confident	84.4	Confident	103 Å²	103	52.6 Å²	52.6	63%	0.632	30%	0.295	S	S	*	.	H	α-helix	trans	-64	-33.3	175.8	54.3	0	0	0	0	112.8	D871 A877	D871-T873 PolarHBondContact O-N 3.36Å; D871-T873 VanDerWaalsContact O-N 3.13Å; D871-T873 PolarHBondContact OD2-OG1 3.1Å; T873-A877 VanDerWaalsContact O-CB 3.31Å; T873-A877 WeakPolarHBondContact O-CB 3.43Å; T873-A877 PolarHBondContact O-N 3.06Å; T873-A877 VanDerWaalsContact O-N 3.16Å
874	E	81.2	Confident	84.2	Confident	53.25 Å²	53.25	55.9 Å²	55.9	25%	0.249	32%	0.318	C	S	.	.	H	α-helix	trans	-73.1	-40	177.3	-62.8	177.9	160.7	0	0	111.2	S842 P870 D871 E872 M876 A877	S842-E874 WeakPolarHBondContact CB-O 3.42Å; P870-E874 WeakPolarHBondContact CA-OE2 3.26Å; P870-E874 WeakPolarHBondContact CB-OE2 3.48Å; D871-E874 HydrophobicContact CB-CG 4.15Å; D871-E874 PolarHBondContact N-OE2 3Å; D871-E874 WeakPolarHBondContact O-CA 3.31Å; D871-E874 WeakPolarHBondContact O-CB 3.36Å; D871-E874 PolarHBondContact O-N 3.07Å; E872-E874 VanDerWaalsContact C-N 3.29Å; E872-E874 PolarHBondContact O-N 3.03Å; E874-M876 VanDerWaalsContact C-N 3.35Å; E874-A877 PolarHBondContact O-N 3.08Å
875	V	84	Confident	84	Confident	1.25 Å²	1.25	57.9 Å²	57.9	1%	0.008	33%	0.327	C	S	.	.	H	α-helix	trans	-63.7	-44.3	175.4	-177.4	0	0	0	0	110.2	L845 P870 D871 E872 A877 L878 L883 V886 Y890 M899	L845-V875 HydrophobicContact CD2-CB 4.48Å; L845-V875 HydrophobicContact CD2-CG2 3.96Å; P870-V875 HydrophobicContact CB-CG2 4.21Å; P870-V875 HydrophobicContact CG-CG2 3.94Å; D871-V875 PolarHBondContact O-N 2.97Å; D871-V875 VanDerWaalsContact O-N 3.17Å; E872-V875 PolarHBondContact O-N 3.22Å; V875-A877 PolarHBondContact O-N 3.23Å; V875-L878 HydrophobicContact CG1-CD1 4.38Å; V875-L878 VanDerWaalsContact O-CB 3.31Å; V875-L878 WeakPolarHBondContact O-CB 3.28Å; V875-L878 VanDerWaalsContact O-CG 3.26Å; V875-L878 WeakPolarHBondContact O-CG 3.4Å; V875-L878 PolarHBondContact O-N 2.97Å; V875-L883 HydrophobicContact CG1-CD1 4.42Å; V875-L883 WeakPolarHBondContact O-CD1 3.36Å; V875-V886 HydrophobicContact CG1-CG1 4.06Å; V875-Y890 HydrophobicContact CB-CE1 4.48Å; V875-Y890 HydrophobicContact CB-CE2 4.42Å; V875-Y890 HydrophobicContact CG1-CD1 4.19Å; V875-Y890 HydrophobicContact CG1-CD2 4.28Å; V875-Y890 HydrophobicContact CG1-CE1 4.05Å; V875-Y890 HydrophobicContact CG1-CE2 4.14Å; V875-Y890 HydrophobicContact CG1-CG 4.3Å; V875-Y890 HydrophobicContact CG2-CE2 3.87Å; V875-M899 HydrophobicContact CG1-CE 4.34Å; V875-M899 HydrophobicContact CG2-CE 4.31Å
876	M	84.7	Confident	83.9	Confident	115 Å²	115	56.1 Å²	56.1	57%	0.567	32%	0.32	S	S	*	.	H	α-helix	trans	-69.9	-15.9	177.7	-63.6	-63.2	169.8	0	0	113.5	E872 E874 L878 L883	E872-M876 WeakPolarHBondContact O-CB 3.39Å; E872-M876 VanDerWaalsContact O-CG 3.23Å; E872-M876 WeakPolarHBondContact O-CG 3.27Å; E872-M876 PolarHBondContact O-N 3.25Å; E874-M876 VanDerWaalsContact C-N 3.35Å; M876-L878 VanDerWaalsContact C-N 3.31Å; M876-L883 HydrophobicContact SD-CD1 4.47Å
877	A	83.9	Confident	83.9	Confident	61.25 Å²	61.25	59.6 Å²	59.6	51%	0.506	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-2	175.1	0	0	0	0	0	113.6	T873 E874 V875	T873-A877 VanDerWaalsContact O-CB 3.31Å; T873-A877 WeakPolarHBondContact O-CB 3.43Å; T873-A877 PolarHBondContact O-N 3.06Å; T873-A877 VanDerWaalsContact O-N 3.16Å; E874-A877 PolarHBondContact O-N 3.08Å; V875-A877 PolarHBondContact O-N 3.23Å
878	L	83.7	Confident	84.1	Confident	9 Å²	9	65 Å²	65	5%	0.047	36%	0.363	C	S	.	.	S	Bend	trans	-65.2	150.4	176.3	-67.8	174.3	0	0	0	111.6	S842 L845 Q846 L849 V875 M876 E880 L882 L883 V886	S842-L878 WeakPolarHBondContact O-CD2 3.47Å; L845-L878 HydrophobicContact CB-CD2 4.4Å; L845-L878 HydrophobicContact CD2-CD1 4.05Å; L845-L878 HydrophobicContact CD2-CD2 4.19Å; L845-L878 HydrophobicContact CD2-CG 4.3Å; L845-L878 HydrophobicContact CG-CD1 4.33Å; L845-L878 HydrophobicContact CG-CD2 4.17Å; Q846-L878 HydrophobicContact CB-CD2 3.82Å; Q846-L878 HydrophobicContact CG-CD2 4.4Å; L849-L878 HydrophobicContact CD1-CD1 3.92Å; V875-L878 HydrophobicContact CG1-CD1 4.38Å; V875-L878 VanDerWaalsContact O-CB 3.31Å; V875-L878 WeakPolarHBondContact O-CB 3.28Å; V875-L878 VanDerWaalsContact O-CG 3.26Å; V875-L878 WeakPolarHBondContact O-CG 3.4Å; V875-L878 PolarHBondContact O-N 2.97Å; M876-L878 VanDerWaalsContact C-N 3.31Å; L878-E880 PolarHBondContact O-N 3.18Å; L878-L882 HydrophobicContact CB-CD2 4.45Å; L878-L882 HydrophobicContact CD1-CD2 4.35Å; L878-L882 HydrophobicContact CD2-CD2 4.1Å; L878-L882 HydrophobicContact CG-CD2 4.47Å; L878-L883 HydrophobicContact CB-CB 4.29Å; L878-V886 HydrophobicContact CD1-CG2 4.2Å
879	P	82.8	Confident	84.4	Confident	45 Å²	45	62.6 Å²	62.6	29%	0.292	34%	0.344	S	S	.	.			trans	-55.2	142.2	174.4	-22.3	31.4	0	0	0	111.9	Q846 S881 L882 L883	Q846-P879 HydrophobicContact CG-CG 4.35Å; P879-S881 PolarHBondContact O-N 3.28Å; P879-S881 VanDerWaalsContact O-N 3.09Å; P879-L882 PolarHBondContact O-N 3.05Å; P879-L883 WeakPolarHBondContact O-CB 3.41Å; P879-L883 PolarHBondContact O-N 3.08Å
880	E	80.2	Confident	84.6	Confident	166.25 Å²	166.25	61.6 Å²	61.6	78%	0.777	34%	0.337	S	S	*	.	H	α-helix	trans	-52.4	-38.1	-173.3	-93.6	-178.4	172.7	0	0	113.7	L878 L882 L883 S884	L878-E880 PolarHBondContact O-N 3.18Å; E880-L882 VanDerWaalsContact C-N 3.32Å; E880-L882 PolarHBondContact O-N 3.24Å; E880-L883 PolarHBondContact O-N 2.81Å; E880-S884 WeakPolarHBondContact O-CB 3.31Å; E880-S884 PolarHBondContact O-N 3.06Å
881	S	79.2	Confident	84.8	Confident	82.25 Å²	82.25	67.9 Å²	67.9	58%	0.575	36%	0.364	S	S	*	.	H	α-helix	trans	-62.2	-43.3	177.6	54.6	0	0	0	0	112.5	P879 S884	P879-S881 PolarHBondContact O-N 3.28Å; P879-S881 VanDerWaalsContact O-N 3.09Å; S881-S884 PolarHBondContact O-OG 3.06Å
882	L	81.5	Confident	84.9	Confident	12.5 Å²	12.5	66.6 Å²	66.6	7%	0.065	36%	0.361	C	S	.	.	H	α-helix	trans	-77.5	-42.4	179.4	-173	65.9	0	0	0	110.8	Q846 L849 E850 L878 P879 E880 S884 E885 V886 M903	Q846-L882 HydrophobicContact CB-CD2 4.29Å; Q846-L882 HydrophobicContact CG-CD2 3.82Å; L849-L882 HydrophobicContact CB-CD1 4.17Å; L849-L882 HydrophobicContact CB-CD2 4.18Å; L849-L882 HydrophobicContact CD1-CD2 4.35Å; E850-L882 HydrophobicContact CG-CD1 4.34Å; E850-L882 HydrophobicContact CG-CD2 4.26Å; L878-L882 HydrophobicContact CB-CD2 4.45Å; L878-L882 HydrophobicContact CD1-CD2 4.35Å; L878-L882 HydrophobicContact CD2-CD2 4.1Å; L878-L882 HydrophobicContact CG-CD2 4.47Å; P879-L882 PolarHBondContact O-N 3.05Å; E880-L882 VanDerWaalsContact C-N 3.32Å; E880-L882 PolarHBondContact O-N 3.24Å; L882-S884 VanDerWaalsContact C-N 3.28Å; L882-S884 PolarHBondContact O-N 3.13Å; L882-E885 PolarHBondContact O-N 3.14Å; L882-E885 VanDerWaalsContact O-N 3.09Å; L882-V886 HydrophobicContact CG-CG2 4.35Å; L882-V886 WeakPolarHBondContact O-CG2 3.45Å; L882-V886 PolarHBondContact O-N 3.26Å; L882-M903 HydrophobicContact CD1-CE 3.62Å; L882-M903 HydrophobicContact CD1-SD 4.5Å; L882-M903 HydrophobicContact CG-CE 4.3Å
883	L	86.1	Confident	85	Confident	33.75 Å²	33.75	62.5 Å²	62.5	18%	0.177	35%	0.346	C	S	.	.	H	α-helix	trans	-56.8	-40.6	177	-176.3	60.7	0	0	0	111.4	V875 M876 L878 P879 E880 E885 V886 C887	V875-L883 HydrophobicContact CG1-CD1 4.42Å; V875-L883 WeakPolarHBondContact O-CD1 3.36Å; M876-L883 HydrophobicContact SD-CD1 4.47Å; L878-L883 HydrophobicContact CB-CB 4.29Å; P879-L883 WeakPolarHBondContact O-CB 3.41Å; P879-L883 PolarHBondContact O-N 3.08Å; E880-L883 PolarHBondContact O-N 2.81Å; L883-E885 VanDerWaalsContact C-N 3.29Å; L883-E885 PolarHBondContact O-N 3.13Å; L883-V886 PolarHBondContact O-N 3.17Å; L883-C887 VanDerWaalsContact O-CB 3.32Å; L883-C887 WeakPolarHBondContact O-CB 3.35Å; L883-C887 PolarHBondContact O-N 3.3Å; L883-C887 PolarHBondContact O-SG 2.98Å
884	S	85.3	Confident	85.4	Confident	69.5 Å²	69.5	58 Å²	58	49%	0.486	32%	0.318	S	S	.	.	H	α-helix	trans	-62.3	-31.6	177.1	130.4	0	0	0	0	113.7	E880 S881 L882 K888	E880-S884 WeakPolarHBondContact O-CB 3.31Å; E880-S884 PolarHBondContact O-N 3.06Å; S881-S884 PolarHBondContact O-OG 3.06Å; L882-S884 VanDerWaalsContact C-N 3.28Å; L882-S884 PolarHBondContact O-N 3.13Å; S884-K888 WeakPolarHBondContact O-CE 3.43Å
885	E	85.4	Confident	85.8	Confident	65.25 Å²	65.25	55.4 Å²	55.4	31%	0.305	31%	0.306	S	S	.	.	H	α-helix	trans	-78.2	-44.6	175.3	-66.6	-80	143.6	0	0	110.7	L882 L883 C887 K888 M903 Q906	L882-E885 PolarHBondContact O-N 3.14Å; L882-E885 VanDerWaalsContact O-N 3.09Å; L883-E885 VanDerWaalsContact C-N 3.29Å; L883-E885 PolarHBondContact O-N 3.13Å; E885-C887 VanDerWaalsContact C-N 3.34Å; E885-C887 PolarHBondContact O-N 2.89Å; E885-K888 VanDerWaalsContact O-CB 3.3Å; E885-K888 WeakPolarHBondContact O-CB 3.24Å; E885-K888 PolarHBondContact O-N 3.17Å; E885-K888 VanDerWaalsContact O-N 3.13Å; E885-K888 IonicContact OE1-NZ 3.06Å; E885-K888 PolarHBondContact OE1-NZ 2.8Å; E885-K888 WeakPolarHBondContact OE2-CE 3.36Å; E885-K888 IonicContact OE2-NZ 3Å; E885-K888 PolarHBondContact OE2-NZ 2.94Å; E885-M903 HydrophobicContact CB-CE 4.11Å; E885-M903 HydrophobicContact CB-SD 4.31Å; E885-M903 WeakPolarHBondContact OE2-CE 3.44Å; E885-Q906 PolarHBondContact O-OE1 3Å; E885-Q906 PolarHBondContact OE2-NE2 3.41Å; E885-Q906 PolarHBondContact OE2-OE1 3.06Å
886	V	86.9	Confident	85.9	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-59.9	-43.3	178.1	174.2	0	0	0	0	111.6	L849 V875 L878 L882 L883 K888 F889 Y890 M899 M903	L849-V886 HydrophobicContact CD1-CG2 3.75Å; V875-V886 HydrophobicContact CG1-CG1 4.06Å; L878-V886 HydrophobicContact CD1-CG2 4.2Å; L882-V886 HydrophobicContact CG-CG2 4.35Å; L882-V886 WeakPolarHBondContact O-CG2 3.45Å; L882-V886 PolarHBondContact O-N 3.26Å; L883-V886 PolarHBondContact O-N 3.17Å; V886-K888 PolarHBondContact O-N 3.05Å; V886-F889 HydrophobicContact CB-CZ 4.43Å; V886-F889 HydrophobicContact CG1-CZ 4.42Å; V886-F889 HydrophobicContact CG2-CZ 4.33Å; V886-F889 PolarHBondContact O-N 3.16Å; V886-F889 VanDerWaalsContact O-N 3.11Å; V886-Y890 HydrophobicContact CG1-CD2 4.39Å; V886-Y890 HydrophobicContact CG1-CG 4.17Å; V886-Y890 VanDerWaalsContact O-CB 3.22Å; V886-Y890 WeakPolarHBondContact O-CB 3.15Å; V886-Y890 PolarHBondContact O-N 3.05Å; V886-M899 HydrophobicContact CG1-CE 3.7Å; V886-M903 HydrophobicContact CG2-CE 3.82Å; V886-M903 VanDerWaalsContact CG2-CE 3.49Å; V886-M903 HydrophobicContact CG2-SD 4.08Å
887	C	88	Confident	86.2	Confident	76.25 Å²	76.25	51.9 Å²	51.9	52%	0.515	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-17	178.3	-75.3	0	0	0	0	114.3	L883 E885 F889	L883-C887 VanDerWaalsContact O-CB 3.32Å; L883-C887 WeakPolarHBondContact O-CB 3.35Å; L883-C887 PolarHBondContact O-N 3.3Å; L883-C887 PolarHBondContact O-SG 2.98Å; E885-C887 VanDerWaalsContact C-N 3.34Å; E885-C887 PolarHBondContact O-N 2.89Å; C887-F889 VanDerWaalsContact C-N 3.27Å; C887-F889 PolarHBondContact O-N 2.99Å
888	K	87.1	Confident	86.6	Confident	128 Å²	128	49.9 Å²	49.9	56%	0.557	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-21.9	177.6	-63.5	173.7	-170.8	168.3	0	112.9	S884 E885 V886 Q906	S884-K888 WeakPolarHBondContact O-CE 3.43Å; E885-K888 VanDerWaalsContact O-CB 3.3Å; E885-K888 WeakPolarHBondContact O-CB 3.24Å; E885-K888 PolarHBondContact O-N 3.17Å; E885-K888 VanDerWaalsContact O-N 3.13Å; E885-K888 IonicContact OE1-NZ 3.06Å; E885-K888 PolarHBondContact OE1-NZ 2.8Å; E885-K888 WeakPolarHBondContact OE2-CE 3.36Å; E885-K888 IonicContact OE2-NZ 3Å; E885-K888 PolarHBondContact OE2-NZ 2.94Å; V886-K888 PolarHBondContact O-N 3.05Å; K888-Q906 VanDerWaalsContact CD-NE2 3.27Å
889	F	88.7	Confident	86.9	Confident	25.75 Å²	25.75	49.5 Å²	49.5	11%	0.113	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-131.6	-23.1	-178	63.2	-96.8	0	0	0	114.1	V886 C887 K891 M894 M899 H902 M903 Q906	V886-F889 HydrophobicContact CB-CZ 4.43Å; V886-F889 HydrophobicContact CG1-CZ 4.42Å; V886-F889 HydrophobicContact CG2-CZ 4.33Å; V886-F889 PolarHBondContact O-N 3.16Å; V886-F889 VanDerWaalsContact O-N 3.11Å; C887-F889 VanDerWaalsContact C-N 3.27Å; C887-F889 PolarHBondContact O-N 2.99Å; F889-K891 PolarHBondContact O-N 3.07Å; F889-M894 HydrophobicContact CD2-SD 4.26Å; F889-M894 VanDerWaalsContact O-CE 3.28Å; F889-M894 WeakPolarHBondContact O-CE 3.36Å; F889-M899 HydrophobicContact CE2-CB 4.25Å; F889-M899 HydrophobicContact CE2-CG 4.35Å; F889-H902 HydrophobicContact CB-CB 4.3Å; F889-H902 HydrophobicContact CD1-CB 3.99Å; F889-H902 HydrophobicContact CD2-CB 3.31Å; F889-H902 AromaticContact CD2-CD2 3.87Å; F889-H902 AromaticContact CD2-CG 3.71Å; F889-H902 HydrophobicContact CE1-CB 4.07Å; F889-H902 HydrophobicContact CE2-CB 3.45Å; F889-H902 VanDerWaalsContact CE2-CB 3.47Å; F889-H902 HydrophobicContact CG-CB 3.6Å; F889-H902 AromaticContact CG-CG 3.88Å; F889-H902 HydrophobicContact CZ-CB 3.82Å; F889-M903 HydrophobicContact CE1-CE 3.97Å; F889-M903 HydrophobicContact CE1-CG 4.13Å; F889-M903 HydrophobicContact CE1-SD 3.77Å; F889-M903 VanDerWaalsContact CE1-SD 3.51Å; F889-M903 HydrophobicContact CZ-CB 4.24Å; F889-M903 HydrophobicContact CZ-CE 3.99Å; F889-M903 HydrophobicContact CZ-CG 3.82Å; F889-M903 HydrophobicContact CZ-SD 3.98Å; F889-Q906 HydrophobicContact CD1-CG 4.46Å; F889-Q906 VanDerWaalsContact CD1-NE2 3.33Å
890	Y	90.9	Very high	87.4	Confident	31.75 Å²	31.75	47.9 Å²	47.9	13%	0.125	26%	0.256	C	S	.	.			trans	-59.7	132.2	-172.9	178.5	-104.4	0	0	0	112.6	V875 V886 M894 M899	V875-Y890 HydrophobicContact CB-CE1 4.48Å; V875-Y890 HydrophobicContact CB-CE2 4.42Å; V875-Y890 HydrophobicContact CG1-CD1 4.19Å; V875-Y890 HydrophobicContact CG1-CD2 4.28Å; V875-Y890 HydrophobicContact CG1-CE1 4.05Å; V875-Y890 HydrophobicContact CG1-CE2 4.14Å; V875-Y890 HydrophobicContact CG1-CG 4.3Å; V875-Y890 HydrophobicContact CG2-CE2 3.87Å; V886-Y890 HydrophobicContact CG1-CD2 4.39Å; V886-Y890 HydrophobicContact CG1-CG 4.17Å; V886-Y890 VanDerWaalsContact O-CB 3.22Å; V886-Y890 WeakPolarHBondContact O-CB 3.15Å; V886-Y890 PolarHBondContact O-N 3.05Å; Y890-M894 HydrophobicContact CD2-CB 4.39Å; Y890-M894 HydrophobicContact CD2-SD 4.4Å; Y890-M894 HydrophobicContact CE2-CB 4.37Å; Y890-M899 HydrophobicContact CD2-CE 3.77Å; Y890-M899 HydrophobicContact CD2-CG 4.3Å; Y890-M899 HydrophobicContact CD2-SD 3.93Å; Y890-M899 HydrophobicContact CE2-CE 4.09Å; Y890-M899 HydrophobicContact CE2-SD 3.9Å
891	K	88.7	Confident	88	Confident	141.75 Å²	141.75	40 Å²	40	62%	0.616	22%	0.219	S	C	*	.			trans	-125.6	140.2	169	-63.8	176.7	-176	173.1	0	108.4	F889 G893 M894	F889-K891 PolarHBondContact O-N 3.07Å; K891-G893 PolarHBondContact O-N 3.23Å; K891-G893 VanDerWaalsContact O-N 3.13Å; K891-M894 HydrophobicContact CB-CE 4.03Å; K891-M894 HydrophobicContact CB-CG 4.36Å; K891-M894 HydrophobicContact CB-SD 4.4Å; K891-M894 HydrophobicContact CD-CE 4.22Å; K891-M894 HydrophobicContact CG-CE 4.04Å; K891-M894 PolarHBondContact N-SD 3.24Å; K891-M894 VanDerWaalsContact N-SD 3.37Å; K891-M894 WeakPolarHBondContact O-CB 3.28Å; K891-M894 VanDerWaalsContact O-CG 3.28Å; K891-M894 WeakPolarHBondContact O-CG 3.31Å; K891-M894 PolarHBondContact O-N 3.13Å; K891-M894 VanDerWaalsContact O-N 3.12Å
892	P	86.4	Confident	88.6	Confident	75.25 Å²	75.25	36.9 Å²	36.9	49%	0.489	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-43.5	127.8	172.7	-36	40.3	0	0	0	113.4	E872 R964	E872-P892 VanDerWaalsContact OE1-CB 3.24Å; E872-P892 WeakPolarHBondContact OE1-CB 3.27Å; E872-P892 VanDerWaalsContact OE1-CG 3.23Å; E872-P892 WeakPolarHBondContact OE1-CG 3.35Å; P892-R964 PolarHBondContact O-NH1 2.95Å; P892-R964 PolarHBondContact O-NH2 3.15Å
893	G	86.5	Confident	89	Confident	16.25 Å²	16.25	36.7 Å²	36.7	17%	0.168	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.5	9.3	179.3	0	0	0	0	0	116.1	Y866 I869 K891 R964	Y866-G893 WeakPolarHBondContact CE1-O 3.31Å; Y866-G893 PolarHBondContact OH-O 3.23Å; I869-G893 WeakPolarHBondContact CD1-O 3.44Å; I869-G893 VanDerWaalsContact CG2-CA 3.49Å; K891-G893 PolarHBondContact O-N 3.23Å; K891-G893 VanDerWaalsContact O-N 3.13Å; G893-R964 VanDerWaalsContact C-NH2 3.32Å; G893-R964 VanDerWaalsContact CA-NH1 3.32Å; G893-R964 PolarHBondContact O-NE 3.17Å; G893-R964 PolarHBondContact O-NH1 3.22Å; G893-R964 PolarHBondContact O-NH2 3Å
894	M	92	Very high	89.2	Confident	7.75 Å²	7.75	35.3 Å²	35.3	4%	0.038	19%	0.188	C	C	.	.			trans	-62.2	138.1	169	-81.6	-178.9	168.5	0	0	110.5	Y866 P870 F889 Y890 K891 E898 M899 R964	Y866-M894 WeakPolarHBondContact OH-CA 3.3Å; P870-M894 WeakPolarHBondContact CD-O 3.44Å; F889-M894 HydrophobicContact CD2-SD 4.26Å; F889-M894 VanDerWaalsContact O-CE 3.28Å; F889-M894 WeakPolarHBondContact O-CE 3.36Å; Y890-M894 HydrophobicContact CD2-CB 4.39Å; Y890-M894 HydrophobicContact CD2-SD 4.4Å; Y890-M894 HydrophobicContact CE2-CB 4.37Å; K891-M894 HydrophobicContact CB-CE 4.03Å; K891-M894 HydrophobicContact CB-CG 4.36Å; K891-M894 HydrophobicContact CB-SD 4.4Å; K891-M894 HydrophobicContact CD-CE 4.22Å; K891-M894 HydrophobicContact CG-CE 4.04Å; K891-M894 PolarHBondContact N-SD 3.24Å; K891-M894 VanDerWaalsContact N-SD 3.37Å; K891-M894 WeakPolarHBondContact O-CB 3.28Å; K891-M894 VanDerWaalsContact O-CG 3.28Å; K891-M894 WeakPolarHBondContact O-CG 3.31Å; K891-M894 PolarHBondContact O-N 3.13Å; K891-M894 VanDerWaalsContact O-N 3.12Å; M894-E898 WeakPolarHBondContact CE-OE1 3.27Å; M894-E898 HydrophobicContact CG-CG 4.39Å; M894-M899 HydrophobicContact CB-CG 3.97Å; M894-R964 VanDerWaalsContact CA-NH2 3.33Å; M894-R964 VanDerWaalsContact N-NH2 3.13Å
895	S	90.2	Very high	89.4	Confident	0.5 Å²	0.5	35.2 Å²	35.2	0%	0.003	18%	0.176	C	C	.	.			trans	-74.7	156.3	172.8	71.6	0	0	0	0	111.5	Y866 C868 T897 E898 M899	Y866-S895 VanDerWaalsContact O-CB 3.24Å; Y866-S895 WeakPolarHBondContact O-CB 3.4Å; Y866-S895 PolarHBondContact O-OG 3.03Å; Y866-S895 VanDerWaalsContact O-OG 3.06Å; Y866-S895 PolarHBondContact OH-N 3.45Å; C868-S895 CarbonylContact O-C 3.56Å; C868-S895 VanDerWaalsContact O-CA 3.28Å; C868-S895 WeakPolarHBondContact O-CA 3.29Å; C868-S895 WeakPolarHBondContact O-CB 3.42Å; S895-T897 VanDerWaalsContact C-N 3.26Å; S895-T897 PolarHBondContact O-N 3.11Å; S895-T897 PolarHBondContact OG-OG1 3.36Å; S895-T897 VanDerWaalsContact OG-OG1 3.08Å; S895-E898 WeakPolarHBondContact O-CB 3.37Å; S895-E898 PolarHBondContact O-N 3.06Å; S895-E898 VanDerWaalsContact O-N 3.1Å; S895-E898 PolarHBondContact OG-N 3Å; S895-M899 WeakPolarHBondContact O-CG 3.27Å; S895-M899 PolarHBondContact O-N 2.91Å
896	M	86.7	Confident	89.4	Confident	32.25 Å²	32.25	34.2 Å²	34.2	16%	0.159	17%	0.172	C	C	.	.	H	α-helix	trans	-52.9	-42.7	175.2	-153.2	-162.1	-104.8	0	0	112.1	A844 L845 C848 C868 P870 M899 E900	A844-M896 HydrophobicContact CB-CE 4.31Å; L845-M896 VanDerWaalsContact CA-CE 3.44Å; L845-M896 HydrophobicContact CB-CE 4.1Å; L845-M896 HydrophobicContact CB-SD 4.4Å; L845-M896 HydrophobicContact CD1-CE 3.83Å; L845-M896 VanDerWaalsContact CD1-CE 3.48Å; L845-M896 HydrophobicContact CD1-CG 4.05Å; L845-M896 HydrophobicContact CD1-SD 3.26Å; L845-M896 WeakPolarHBondContact CD1-SD 3.49Å; L845-M896 HydrophobicContact CG-CE 4.4Å; L845-M896 HydrophobicContact CG-SD 4.34Å; C848-M896 HydrophobicContact CB-CE 3.81Å; C848-M896 HydrophobicContact CB-SD 4.37Å; C848-M896 WeakPolarHBondContact SG-CE 3.25Å; C868-M896 PolarHBondContact O-N 3.17Å; P870-M896 HydrophobicContact CB-SD 4.1Å; P870-M896 HydrophobicContact CG-SD 3.88Å; M896-M899 WeakPolarHBondContact O-CB 3.34Å; M896-M899 PolarHBondContact O-N 3.23Å; M896-E900 VanDerWaalsContact O-CG 3.31Å; M896-E900 WeakPolarHBondContact O-CG 3.38Å; M896-E900 PolarHBondContact O-N 3.11Å
897	T	89.4	Confident	89.3	Confident	9.75 Å²	9.75	34.8 Å²	34.8	6%	0.06	18%	0.177	C	C	.	.	H	α-helix	trans	-65.1	-38.7	178.3	-4	0	0	0	0	112.4	T794 L860 L862 Y866 S895 E900 Y901	T794-T897 HydrophobicContact CG2-CG2 4.34Å; L860-T897 HydrophobicContact CD1-CG2 3.46Å; L860-T897 VanDerWaalsContact CD1-CG2 3.46Å; L862-T897 HydrophobicContact CD2-CG2 4.38Å; Y866-T897 PolarHBondContact O-OG1 3.06Å; S895-T897 VanDerWaalsContact C-N 3.26Å; S895-T897 PolarHBondContact O-N 3.11Å; S895-T897 PolarHBondContact OG-OG1 3.36Å; S895-T897 VanDerWaalsContact OG-OG1 3.08Å; T897-E900 PolarHBondContact O-N 2.68Å; T897-Y901 PolarHBondContact O-N 3.17Å; T897-Y901 VanDerWaalsContact O-N 3.1Å
898	E	92.7	Very high	89.1	Confident	19.25 Å²	19.25	31.3 Å²	31.3	9%	0.09	15%	0.154	C	C	.	.	H	α-helix	trans	-66.7	-40.3	173	179.8	173.6	171.7	0	0	111.4	Y866 M894 S895 Y901 H902 F968	Y866-E898 VanDerWaalsContact CE2-OE2 3.25Å; Y866-E898 WeakPolarHBondContact CE2-OE2 3.4Å; Y866-E898 VanDerWaalsContact CZ-OE2 3.27Å; Y866-E898 PolarHBondContact OH-OE2 3.05Å; M894-E898 WeakPolarHBondContact CE-OE1 3.27Å; M894-E898 HydrophobicContact CG-CG 4.39Å; S895-E898 WeakPolarHBondContact O-CB 3.37Å; S895-E898 PolarHBondContact O-N 3.06Å; S895-E898 VanDerWaalsContact O-N 3.1Å; S895-E898 PolarHBondContact OG-N 3Å; E898-Y901 PolarHBondContact O-N 3.11Å; E898-H902 PolarHBondContact O-CD2 2.95Å; E898-H902 VanDerWaalsContact O-CD2 3.25Å; E898-H902 PolarHBondContact O-N 3.1Å; E898-H902 IonicContact OE1-NE2 3.33Å; E898-F968 HydrophobicContact CB-CD1 4.44Å; E898-F968 HydrophobicContact CB-CD2 4.41Å; E898-F968 HydrophobicContact CB-CE1 4.27Å; E898-F968 HydrophobicContact CB-CE2 4.22Å; E898-F968 HydrophobicContact CB-CZ 4.14Å; E898-F968 HydrophobicContact CG-CD2 3.87Å; E898-F968 HydrophobicContact CG-CE2 3.86Å; E898-F968 HydrophobicContact CG-CG 4.36Å; E898-F968 HydrophobicContact CG-CZ 4.29Å
899	M	91.2	Very high	88.8	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-64.5	-41.6	175.8	-64.8	175.6	68.1	0	0	112.2	L845 L849 P870 V875 V886 F889 Y890 M894 S895 M896 Y901 H902 M903	L845-M899 HydrophobicContact CD1-CE 4.14Å; L845-M899 HydrophobicContact CD1-SD 4.22Å; L845-M899 HydrophobicContact CD2-CE 4.23Å; L849-M899 HydrophobicContact CD1-CE 4.16Å; L849-M899 HydrophobicContact CD2-CB 3.85Å; P870-M899 HydrophobicContact CG-SD 3.83Å; V875-M899 HydrophobicContact CG1-CE 4.34Å; V875-M899 HydrophobicContact CG2-CE 4.31Å; V886-M899 HydrophobicContact CG1-CE 3.7Å; F889-M899 HydrophobicContact CE2-CB 4.25Å; F889-M899 HydrophobicContact CE2-CG 4.35Å; Y890-M899 HydrophobicContact CD2-CE 3.77Å; Y890-M899 HydrophobicContact CD2-CG 4.3Å; Y890-M899 HydrophobicContact CD2-SD 3.93Å; Y890-M899 HydrophobicContact CE2-CE 4.09Å; Y890-M899 HydrophobicContact CE2-SD 3.9Å; M894-M899 HydrophobicContact CB-CG 3.97Å; S895-M899 WeakPolarHBondContact O-CG 3.27Å; S895-M899 PolarHBondContact O-N 2.91Å; M896-M899 WeakPolarHBondContact O-CB 3.34Å; M896-M899 PolarHBondContact O-N 3.23Å; M899-Y901 VanDerWaalsContact C-N 3.35Å; M899-Y901 PolarHBondContact O-N 2.98Å; M899-H902 PolarHBondContact O-N 3.36Å; M899-M903 VanDerWaalsContact O-CB 3.31Å; M899-M903 WeakPolarHBondContact O-CB 3.32Å; M899-M903 WeakPolarHBondContact O-CG 3.38Å; M899-M903 PolarHBondContact O-N 2.99Å
900	E	91.3	Very high	88.3	Confident	12 Å²	12	29 Å²	29	6%	0.056	15%	0.153	C	C	.	.	H	α-helix	trans	-58.8	-45.3	174.5	-75.1	171.3	176.3	0	0	111.5	F790 S792 C848 L849 A852 F858 M896 T897 H902 M903 A904	F790-E900 HydrophobicContact CE1-CG 4.39Å; S792-E900 VanDerWaalsContact CB-OE2 3.28Å; S792-E900 WeakPolarHBondContact CB-OE2 3.3Å; S792-E900 PolarHBondContact OG-OE2 3.32Å; C848-E900 HydrophobicContact CB-CG 4.25Å; C848-E900 WeakPolarHBondContact CB-OE1 3.39Å; C848-E900 PolarHBondContact SG-OE1 3.09Å; C848-E900 VanDerWaalsContact SG-OE1 3.32Å; L849-E900 HydrophobicContact CD2-CG 4.42Å; A852-E900 HydrophobicContact CB-CB 4.23Å; A852-E900 HydrophobicContact CB-CG 4.41Å; F858-E900 HydrophobicContact CE2-CB 4.07Å; F858-E900 HydrophobicContact CZ-CB 3.95Å; M896-E900 VanDerWaalsContact O-CG 3.31Å; M896-E900 WeakPolarHBondContact O-CG 3.38Å; M896-E900 PolarHBondContact O-N 3.11Å; T897-E900 PolarHBondContact O-N 2.68Å; E900-H902 PolarHBondContact O-N 2.86Å; E900-M903 PolarHBondContact O-N 2.96Å; E900-A904 WeakPolarHBondContact O-CB 3.32Å; E900-A904 PolarHBondContact O-N 3.23Å
901	Y	93.2	Very high	87.4	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-60	-47.9	176	173.4	-95.7	0	0	0	111.8	F858 L860 T897 E898 M899 M903 A904 R905 I933 V935 F968 L971 I972 D975 V977	F858-Y901 HydrophobicContact CE1-CD2 4.27Å; L860-Y901 HydrophobicContact CD2-CD2 3.96Å; L860-Y901 HydrophobicContact CD2-CG 4.44Å; T897-Y901 PolarHBondContact O-N 3.17Å; T897-Y901 VanDerWaalsContact O-N 3.1Å; E898-Y901 PolarHBondContact O-N 3.11Å; M899-Y901 VanDerWaalsContact C-N 3.35Å; M899-Y901 PolarHBondContact O-N 2.98Å; Y901-M903 VanDerWaalsContact C-N 3.31Å; Y901-M903 PolarHBondContact O-N 3.27Å; Y901-A904 PolarHBondContact O-N 2.91Å; Y901-R905 VanDerWaalsContact O-CB 3.28Å; Y901-R905 WeakPolarHBondContact O-CB 3.37Å; Y901-R905 PolarHBondContact O-N 3.29Å; Y901-I933 HydrophobicContact CD2-CG2 4.36Å; Y901-I933 HydrophobicContact CE2-CD1 4.35Å; Y901-I933 HydrophobicContact CE2-CG2 3.97Å; Y901-V935 HydrophobicContact CE2-CG2 4.41Å; Y901-F968 AromaticContact CD1-CE2 3.71Å; Y901-F968 HydrophobicContact CD1-CE2 3.71Å; Y901-F968 HydrophobicContact CD1-CZ 4.17Å; Y901-F968 HydrophobicContact CE1-CE2 4.34Å; Y901-F968 AromaticContact CG-CE2 3.96Å; Y901-F968 HydrophobicContact CG-CE2 3.98Å; Y901-F968 AromaticContact CG-CZ 3.94Å; Y901-F968 HydrophobicContact CG-CZ 3.94Å; Y901-L971 HydrophobicContact CD1-CD2 4.39Å; Y901-L971 HydrophobicContact CE1-CD2 3.65Å; Y901-I972 HydrophobicContact CE1-CG1 4.44Å; Y901-I972 HydrophobicContact CE2-CG1 4.23Å; Y901-D975 WeakPolarHBondContact CE1-OD2 3.07Å; Y901-D975 VanDerWaalsContact OH-CB 3.28Å; Y901-D975 WeakPolarHBondContact OH-CB 3.41Å; Y901-D975 PolarHBondContact OH-OD2 2.99Å; Y901-V977 HydrophobicContact CE2-CG1 4.31Å; Y901-V977 HydrophobicContact CE2-CG2 4.24Å; Y901-V977 WeakPolarHBondContact OH-CG1 3.31Å; Y901-V977 WeakPolarHBondContact OH-CG2 3.43Å
902	H	92.2	Very high	86.5	Confident	17.75 Å²	17.75	25.2 Å²	25.2	8%	0.082	14%	0.138	C	C	.	.	H	α-helix	trans	-63.6	-38.5	179.1	-81	-59	0	0	0	112.6	F889 E898 M899 E900 R905 Q906	F889-H902 HydrophobicContact CB-CB 4.3Å; F889-H902 HydrophobicContact CD1-CB 3.99Å; F889-H902 HydrophobicContact CD2-CB 3.31Å; F889-H902 AromaticContact CD2-CD2 3.87Å; F889-H902 AromaticContact CD2-CG 3.71Å; F889-H902 HydrophobicContact CE1-CB 4.07Å; F889-H902 HydrophobicContact CE2-CB 3.45Å; F889-H902 VanDerWaalsContact CE2-CB 3.47Å; F889-H902 HydrophobicContact CG-CB 3.6Å; F889-H902 AromaticContact CG-CG 3.88Å; F889-H902 HydrophobicContact CZ-CB 3.82Å; E898-H902 PolarHBondContact O-CD2 2.95Å; E898-H902 VanDerWaalsContact O-CD2 3.25Å; E898-H902 PolarHBondContact O-N 3.1Å; E898-H902 IonicContact OE1-NE2 3.33Å; M899-H902 PolarHBondContact O-N 3.36Å; E900-H902 PolarHBondContact O-N 2.86Å; H902-R905 PolarHBondContact O-N 3.01Å; H902-Q906 VanDerWaalsContact O-CB 3.29Å; H902-Q906 WeakPolarHBondContact O-CB 3.17Å; H902-Q906 WeakPolarHBondContact O-CG 3.46Å; H902-Q906 PolarHBondContact O-N 3.12Å
903	M	90.9	Very high	85.5	Confident	7.75 Å²	7.75	24.5 Å²	24.5	4%	0.038	13%	0.133	C	C	.	.	H	α-helix	trans	-63.9	-47	174.7	-122	0.8	-106.8	0	0	111.8	L849 A852 A853 L882 E885 V886 F889 M899 E900 Y901 R905 Q906 A907	L849-M903 HydrophobicContact CB-CE 4.33Å; L849-M903 HydrophobicContact CB-CG 4.28Å; L849-M903 HydrophobicContact CD2-CB 4.19Å; L849-M903 HydrophobicContact CD2-CE 4.38Å; L849-M903 HydrophobicContact CD2-CG 4.04Å; L849-M903 VanDerWaalsContact CD2-CG 3.5Å; L849-M903 HydrophobicContact CG-CG 4.26Å; L849-M903 WeakPolarHBondContact O-CG 3.39Å; A852-M903 HydrophobicContact CB-CB 4.41Å; A853-M903 HydrophobicContact CB-CE 4Å; A853-M903 HydrophobicContact CB-CG 3.89Å; A853-M903 HydrophobicContact CB-SD 4.21Å; L882-M903 HydrophobicContact CD1-CE 3.62Å; L882-M903 HydrophobicContact CD1-SD 4.5Å; L882-M903 HydrophobicContact CG-CE 4.3Å; E885-M903 HydrophobicContact CB-CE 4.11Å; E885-M903 HydrophobicContact CB-SD 4.31Å; E885-M903 WeakPolarHBondContact OE2-CE 3.44Å; V886-M903 HydrophobicContact CG2-CE 3.82Å; V886-M903 VanDerWaalsContact CG2-CE 3.49Å; V886-M903 HydrophobicContact CG2-SD 4.08Å; F889-M903 HydrophobicContact CE1-CE 3.97Å; F889-M903 HydrophobicContact CE1-CG 4.13Å; F889-M903 HydrophobicContact CE1-SD 3.77Å; F889-M903 VanDerWaalsContact CE1-SD 3.51Å; F889-M903 HydrophobicContact CZ-CB 4.24Å; F889-M903 HydrophobicContact CZ-CE 3.99Å; F889-M903 HydrophobicContact CZ-CG 3.82Å; F889-M903 HydrophobicContact CZ-SD 3.98Å; M899-M903 VanDerWaalsContact O-CB 3.31Å; M899-M903 WeakPolarHBondContact O-CB 3.32Å; M899-M903 WeakPolarHBondContact O-CG 3.38Å; M899-M903 PolarHBondContact O-N 2.99Å; E900-M903 PolarHBondContact O-N 2.96Å; Y901-M903 VanDerWaalsContact C-N 3.31Å; Y901-M903 PolarHBondContact O-N 3.27Å; M903-R905 VanDerWaalsContact C-N 3.3Å; M903-R905 PolarHBondContact O-N 3.16Å; M903-Q906 PolarHBondContact O-N 3.04Å; M903-A907 WeakPolarHBondContact O-CB 3.24Å; M903-A907 PolarHBondContact O-N 3.2Å
904	A	89.1	Confident	84.3	Confident	5 Å²	5	27.9 Å²	27.9	4%	0.041	15%	0.147	C	C	.	.	H	α-helix	trans	-62	-40.2	177	0	0	0	0	0	111.9	F858 E900 Y901 Q906 A907 A908 I933	F858-A904 HydrophobicContact CB-CB 3.93Å; F858-A904 HydrophobicContact CD1-CB 4.17Å; F858-A904 HydrophobicContact CD2-CB 3.37Å; F858-A904 VanDerWaalsContact CD2-CB 3.42Å; F858-A904 HydrophobicContact CE1-CB 4.46Å; F858-A904 HydrophobicContact CE2-CB 3.81Å; F858-A904 HydrophobicContact CG-CB 3.57Å; F858-A904 VanDerWaalsContact CG-CB 3.48Å; F858-A904 HydrophobicContact CZ-CB 4.36Å; E900-A904 WeakPolarHBondContact O-CB 3.32Å; E900-A904 PolarHBondContact O-N 3.23Å; Y901-A904 PolarHBondContact O-N 2.91Å; A904-Q906 PolarHBondContact O-N 3.46Å; A904-A907 PolarHBondContact O-N 3.11Å; A904-A908 WeakPolarHBondContact O-CB 3.36Å; A904-A908 PolarHBondContact O-N 3.15Å; A904-I933 HydrophobicContact CB-CD1 4.25Å
905	R	89.1	Confident	83	Confident	66.5 Å²	66.5	33.4 Å²	33.4	25%	0.251	17%	0.172	S	C	.	.	H	α-helix	trans	-62.1	-45.9	175.2	-172.7	179.9	160.5	-113.3	5.7	111.8	Y901 H902 M903 A907 A908 I909 I929 I933 D975	Y901-R905 VanDerWaalsContact O-CB 3.28Å; Y901-R905 WeakPolarHBondContact O-CB 3.37Å; Y901-R905 PolarHBondContact O-N 3.29Å; H902-R905 PolarHBondContact O-N 3.01Å; M903-R905 VanDerWaalsContact C-N 3.3Å; M903-R905 PolarHBondContact O-N 3.16Å; R905-A907 VanDerWaalsContact C-N 3.33Å; R905-A907 PolarHBondContact O-N 3.12Å; R905-A908 WeakPolarHBondContact O-CB 3.31Å; R905-A908 PolarHBondContact O-N 3.16Å; R905-I909 HydrophobicContact CG-CD1 4.17Å; R905-I909 WeakPolarHBondContact O-CD1 3.27Å; R905-I909 VanDerWaalsContact O-CG1 3.28Å; R905-I909 WeakPolarHBondContact O-CG1 3.39Å; R905-I909 PolarHBondContact O-N 3.12Å; R905-I909 VanDerWaalsContact O-N 3.11Å; R905-I929 HydrophobicContact CG-CD1 4.12Å; R905-I929 HydrophobicContact CG-CG1 4.31Å; R905-I933 HydrophobicContact CB-CD1 4.08Å; R905-I933 HydrophobicContact CG-CD1 4.42Å; R905-D975 WeakPolarHBondContact CD-OD2 3.32Å; R905-D975 IonicContact CZ-OD1 3.63Å; R905-D975 IonicContact CZ-OD2 3.37Å; R905-D975 VanDerWaalsContact NE-CG 3.29Å; R905-D975 IonicContact NE-OD1 2.85Å; R905-D975 PolarHBondContact NE-OD1 3.05Å; R905-D975 VanDerWaalsContact NE-OD1 3.09Å; R905-D975 IonicContact NE-OD2 3.23Å; R905-D975 PolarHBondContact NE-OD2 3.06Å; R905-D975 IonicContact NH1-OD1 2.69Å; R905-D975 PolarHBondContact NH1-OD1 3.05Å; R905-D975 IonicContact NH1-OD2 2.98Å; R905-D975 PolarHBondContact NH1-OD2 3.41Å; R905-D975 IonicContact NH2-OD1 3.43Å; R905-D975 PolarHBondContact NH2-OD1 3Å; R905-D975 IonicContact NH2-OD2 2.89Å
906	Q	86.2	Confident	81.6	Confident	43.75 Å²	43.75	36.6 Å²	36.6	20%	0.204	19%	0.187	C	C	.	.	H	α-helix	trans	-64	-40.8	176.3	-94.7	-174	-12.7	0	0	112.2	E885 K888 F889 H902 M903 A904 A908 I909 S910	E885-Q906 PolarHBondContact O-OE1 3Å; E885-Q906 PolarHBondContact OE2-NE2 3.41Å; E885-Q906 PolarHBondContact OE2-OE1 3.06Å; K888-Q906 VanDerWaalsContact CD-NE2 3.27Å; F889-Q906 HydrophobicContact CD1-CG 4.46Å; F889-Q906 VanDerWaalsContact CD1-NE2 3.33Å; H902-Q906 VanDerWaalsContact O-CB 3.29Å; H902-Q906 WeakPolarHBondContact O-CB 3.17Å; H902-Q906 WeakPolarHBondContact O-CG 3.46Å; H902-Q906 PolarHBondContact O-N 3.12Å; M903-Q906 PolarHBondContact O-N 3.04Å; A904-Q906 PolarHBondContact O-N 3.46Å; Q906-A908 VanDerWaalsContact C-N 3.35Å; Q906-A908 PolarHBondContact O-N 2.89Å; Q906-I909 PolarHBondContact O-N 2.97Å; Q906-S910 WeakPolarHBondContact O-CB 3.35Å; Q906-S910 PolarHBondContact O-N 3Å
907	A	84.6	Confident	80.3	Confident	13.5 Å²	13.5	38.7 Å²	38.7	11%	0.112	19%	0.193	C	C	.	.	H	α-helix	trans	-64	-39.6	175.4	0	0	0	0	0	112.2	A853 M903 A904 R905 I909 S910 K911	A853-A907 HydrophobicContact CB-CB 4.32Å; A853-A907 VanDerWaalsContact O-CB 3.28Å; A853-A907 WeakPolarHBondContact O-CB 3.35Å; M903-A907 WeakPolarHBondContact O-CB 3.24Å; M903-A907 PolarHBondContact O-N 3.2Å; A904-A907 PolarHBondContact O-N 3.11Å; R905-A907 VanDerWaalsContact C-N 3.33Å; R905-A907 PolarHBondContact O-N 3.12Å; A907-I909 PolarHBondContact O-N 3.11Å; A907-S910 WeakPolarHBondContact CA-OG 3.39Å; A907-S910 PolarHBondContact O-N 3.11Å; A907-S910 PolarHBondContact O-OG 3.25Å; A907-K911 WeakPolarHBondContact O-CG 3.37Å; A907-K911 PolarHBondContact O-N 3.23Å
908	A	83.2	Confident	79	Confident	2.75 Å²	2.75	46.8 Å²	46.8	2%	0.023	22%	0.223	C	C	.	.	H	α-helix	trans	-61.6	-45.7	174.1	0	0	0	0	0	111.5	A904 R905 Q906 S910 K911 I929 R932	A904-A908 WeakPolarHBondContact O-CB 3.36Å; A904-A908 PolarHBondContact O-N 3.15Å; R905-A908 WeakPolarHBondContact O-CB 3.31Å; R905-A908 PolarHBondContact O-N 3.16Å; Q906-A908 VanDerWaalsContact C-N 3.35Å; Q906-A908 PolarHBondContact O-N 2.89Å; A908-S910 VanDerWaalsContact C-N 3.32Å; A908-S910 PolarHBondContact O-N 3.03Å; A908-K911 PolarHBondContact O-N 3.28Å; A908-I929 HydrophobicContact CB-CG1 4.37Å; A908-R932 HydrophobicContact CB-CB 4.33Å
909	I	81.5	Confident	77.4	Confident	41 Å²	41	52.3 Å²	52.3	21%	0.21	25%	0.249	C	C	.	.	H	α-helix	trans	-64.5	-38.4	177.1	-66.7	164.4	0	0	0	111.4	R905 Q906 A907 K911 V912 R917 F925 I929	R905-I909 HydrophobicContact CG-CD1 4.17Å; R905-I909 WeakPolarHBondContact O-CD1 3.27Å; R905-I909 VanDerWaalsContact O-CG1 3.28Å; R905-I909 WeakPolarHBondContact O-CG1 3.39Å; R905-I909 PolarHBondContact O-N 3.12Å; R905-I909 VanDerWaalsContact O-N 3.11Å; Q906-I909 PolarHBondContact O-N 2.97Å; A907-I909 PolarHBondContact O-N 3.11Å; I909-K911 VanDerWaalsContact C-N 3.27Å; I909-K911 PolarHBondContact O-N 3.03Å; I909-K911 VanDerWaalsContact O-N 3.14Å; I909-V912 WeakPolarHBondContact O-CB 3.31Å; I909-V912 PolarHBondContact O-N 3.28Å; I909-V912 VanDerWaalsContact O-N 3.09Å; I909-R917 PolarHBondContact O-NE 3.39Å; I909-F925 HydrophobicContact CB-CE2 4.46Å; I909-F925 HydrophobicContact CD1-CE2 4.14Å; I909-F925 HydrophobicContact CD1-CZ 3.68Å; I909-F925 HydrophobicContact CG1-CD1 4.41Å; I909-F925 HydrophobicContact CG1-CE2 3.83Å; I909-F925 HydrophobicContact CG1-CZ 3.8Å; I909-F925 HydrophobicContact CG2-CD1 3.9Å; I909-F925 HydrophobicContact CG2-CE1 3.77Å; I909-F925 HydrophobicContact CG2-CE2 3.85Å; I909-F925 HydrophobicContact CG2-CZ 4.48Å; I909-I929 HydrophobicContact CD1-CD1 4.27Å; I909-I929 HydrophobicContact CG1-CD1 4.15Å; I909-I929 HydrophobicContact CG1-CG1 4.27Å
910	S	77.5	Confident	75.6	Confident	65 Å²	65	60 Å²	60	46%	0.455	28%	0.284	S	S	.	.	H	α-helix	trans	-66.5	-21.2	-179.8	79.1	0	0	0	0	113.4	Q906 A907 A908 V912 R917	Q906-S910 WeakPolarHBondContact O-CB 3.35Å; Q906-S910 PolarHBondContact O-N 3Å; A907-S910 WeakPolarHBondContact CA-OG 3.39Å; A907-S910 PolarHBondContact O-N 3.11Å; A907-S910 PolarHBondContact O-OG 3.25Å; A908-S910 VanDerWaalsContact C-N 3.32Å; A908-S910 PolarHBondContact O-N 3.03Å; S910-V912 VanDerWaalsContact C-N 3.3Å; S910-V912 PolarHBondContact O-N 3.48Å; S910-R917 VanDerWaalsContact C-NH2 3.34Å; S910-R917 PolarHBondContact O-NH2 3.13Å
911	K	73	Confident	74	Confident	85.5 Å²	85.5	63.8 Å²	63.8	37%	0.372	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-11.6	175	-68.1	176.2	-175.2	177.3	0	113.1	A854 S855 D856 A907 A908 I909 R932	A854-K911 PolarHBondContact O-NZ 3.08Å; S855-K911 PolarHBondContact O-NZ 3.14Å; D856-K911 IonicContact OD1-NZ 3.31Å; D856-K911 PolarHBondContact OD1-NZ 3Å; A907-K911 WeakPolarHBondContact O-CG 3.37Å; A907-K911 PolarHBondContact O-N 3.23Å; A908-K911 PolarHBondContact O-N 3.28Å; I909-K911 VanDerWaalsContact C-N 3.27Å; I909-K911 PolarHBondContact O-N 3.03Å; I909-K911 VanDerWaalsContact O-N 3.14Å; K911-R932 VanDerWaalsContact CD-NH2 3.33Å
912	V	69.5	Low	72.3	Confident	7.25 Å²	7.25	67.5 Å²	67.5	4%	0.044	33%	0.328	C	S	.	.	S	Bend	trans	-72.9	132	173.1	-179	0	0	0	0	109.8	I909 S910 I914 E916 R917 F925 A928	I909-V912 WeakPolarHBondContact O-CB 3.31Å; I909-V912 PolarHBondContact O-N 3.28Å; I909-V912 VanDerWaalsContact O-N 3.09Å; S910-V912 VanDerWaalsContact C-N 3.3Å; S910-V912 PolarHBondContact O-N 3.48Å; V912-I914 PolarHBondContact O-N 3.15Å; V912-E916 HydrophobicContact CG1-CB 3.88Å; V912-E916 WeakPolarHBondContact CG1-OE2 3.45Å; V912-R917 HydrophobicContact CB-CG 4.09Å; V912-R917 HydrophobicContact CG1-CG 3.98Å; V912-R917 VanDerWaalsContact O-CZ 3.32Å; V912-R917 PolarHBondContact O-NE 3.03Å; V912-R917 PolarHBondContact O-NH2 3.45Å; V912-F925 HydrophobicContact CB-CD1 4.3Å; V912-F925 HydrophobicContact CB-CE1 4.41Å; V912-F925 HydrophobicContact CG1-CD1 4.31Å; V912-F925 HydrophobicContact CG1-CE1 4.37Å; V912-F925 HydrophobicContact CG2-CD1 4.2Å; V912-A928 HydrophobicContact CG2-CB 3.34Å; V912-A928 VanDerWaalsContact CG2-CB 3.44Å
913	P	64.6	Low	70.9	Confident	60 Å²	60	72.5 Å²	72.5	39%	0.39	35%	0.354	S	S	.	.			trans	-53.5	139.6	176.6	-26.1	34.5	0	0	0	113.1	H915 E916 R917	P913-H915 WeakPolarHBondContact CB-CE1 3.36Å; P913-H915 WeakPolarHBondContact CB-ND1 3.38Å; P913-H915 PolarHBondContact O-N 3.35Å; P913-H915 VanDerWaalsContact O-N 3.11Å; P913-E916 WeakPolarHBondContact O-CB 3.35Å; P913-E916 PolarHBondContact O-N 3.16Å; P913-E916 VanDerWaalsContact O-N 3.14Å; P913-R917 PolarHBondContact O-N 2.92Å
914	I	63	Low	69.7	Low	89.25 Å²	89.25	73.3 Å²	73.3	46%	0.458	36%	0.361	S	S	.	.	H	α-helix	trans	-57	-32.9	-173.8	-67.9	164.3	0	0	0	112.8	E740 E743 V912 E916 R917 R918	E740-I914 HydrophobicContact CB-CD1 3.72Å; E740-I914 HydrophobicContact CG-CD1 3.66Å; E743-I914 HydrophobicContact CB-CD1 4.46Å; E743-I914 WeakPolarHBondContact OE2-CG2 3.47Å; V912-I914 PolarHBondContact O-N 3.15Å; I914-E916 PolarHBondContact O-N 3.45Å; I914-R917 WeakPolarHBondContact O-CB 3.44Å; I914-R917 PolarHBondContact O-N 3.28Å; I914-R917 VanDerWaalsContact O-N 3.1Å; I914-R918 HydrophobicContact CG2-CG 4.2Å; I914-R918 WeakPolarHBondContact O-CG 3.31Å; I914-R918 PolarHBondContact O-N 3.14Å; I914-R918 VanDerWaalsContact O-N 3.14Å
915	H	63.7	Low	68.8	Low	123 Å²	123	75.2 Å²	75.2	57%	0.569	37%	0.368	S	S	*	.	H	α-helix	trans	-67.2	-36.9	-179.5	60.3	-87.8	0	0	0	112.4	P913 R917 R918 Q919	P913-H915 WeakPolarHBondContact CB-CE1 3.36Å; P913-H915 WeakPolarHBondContact CB-ND1 3.38Å; P913-H915 PolarHBondContact O-N 3.35Å; P913-H915 VanDerWaalsContact O-N 3.11Å; H915-R917 VanDerWaalsContact C-N 3.35Å; H915-R918 PolarHBondContact O-N 3.24Å; H915-Q919 WeakPolarHBondContact O-CG 3.38Å; H915-Q919 PolarHBondContact O-N 3.18Å
916	E	60.4	Low	68.1	Low	67.25 Å²	67.25	75.4 Å²	75.4	31%	0.314	37%	0.371	S	S	.	.	H	α-helix	trans	-72.4	-34.9	174.3	-67.7	177.6	-176.6	0	0	111.7	V912 P913 I914 R918 Q919 Q920 N921 S924	V912-E916 HydrophobicContact CG1-CB 3.88Å; V912-E916 WeakPolarHBondContact CG1-OE2 3.45Å; P913-E916 WeakPolarHBondContact O-CB 3.35Å; P913-E916 PolarHBondContact O-N 3.16Å; P913-E916 VanDerWaalsContact O-N 3.14Å; I914-E916 PolarHBondContact O-N 3.45Å; E916-R918 VanDerWaalsContact C-N 3.31Å; E916-R918 PolarHBondContact O-N 3.19Å; E916-Q919 PolarHBondContact O-N 3.21Å; E916-Q919 VanDerWaalsContact O-N 3.09Å; E916-Q920 PolarHBondContact O-N 3.32Å; E916-N921 PolarHBondContact O-N 2.85Å; E916-S924 WeakPolarHBondContact OE2-CB 3.42Å; E916-S924 PolarHBondContact OE2-OG 3.1Å
917	R	60.4	Low	67.6	Low	77 Å²	77	78.5 Å²	78.5	29%	0.291	39%	0.386	S	S	.	.	H	α-helix	trans	-62.8	-34.8	176.9	-64.7	-164.9	-122.5	164.6	-2.1	113.4	E740 I909 S910 V912 P913 I914 H915 Q919 Q920 F925	E740-R917 IonicContact OE1-CZ 2.68Å; E740-R917 IonicContact OE1-NH1 3.66Å; E740-R917 PolarHBondContact OE1-NH1 3.42Å; E740-R917 IonicContact OE1-NH2 3.39Å; E740-R917 PolarHBondContact OE1-NH2 3.17Å; I909-R917 PolarHBondContact O-NE 3.39Å; S910-R917 VanDerWaalsContact C-NH2 3.34Å; S910-R917 PolarHBondContact O-NH2 3.13Å; V912-R917 HydrophobicContact CB-CG 4.09Å; V912-R917 HydrophobicContact CG1-CG 3.98Å; V912-R917 VanDerWaalsContact O-CZ 3.32Å; V912-R917 PolarHBondContact O-NE 3.03Å; V912-R917 PolarHBondContact O-NH2 3.45Å; P913-R917 PolarHBondContact O-N 2.92Å; I914-R917 WeakPolarHBondContact O-CB 3.44Å; I914-R917 PolarHBondContact O-N 3.28Å; I914-R917 VanDerWaalsContact O-N 3.1Å; H915-R917 VanDerWaalsContact C-N 3.35Å; R917-Q919 VanDerWaalsContact C-N 3.29Å; R917-Q919 PolarHBondContact O-N 2.92Å; R917-Q920 WeakPolarHBondContact O-CA 3.37Å; R917-Q920 PolarHBondContact O-N 2.99Å; R917-Q920 VanDerWaalsContact O-N 3.07Å; R917-F925 HydrophobicContact CB-CE1 4.12Å; R917-F925 HydrophobicContact CB-CZ 3.9Å; R917-F925 HydrophobicContact CG-CE1 3.6Å; R917-F925 HydrophobicContact CG-CZ 3.91Å
918	R	61	Low	67.2	Low	178.75 Å²	178.75	78.5 Å²	78.5	68%	0.675	39%	0.386	S	S	*	.	H	α-helix	trans	-72.8	-25	-179.1	-74.9	-176.8	-178.8	169.3	2.9	113.3	E743 I914 H915 E916 Q920	E743-R918 VanDerWaalsContact C-NH2 3.26Å; E743-R918 VanDerWaalsContact CA-NH2 3.34Å; E743-R918 PolarHBondContact O-NH2 3.16Å; E743-R918 IonicContact OE2-CZ 3.92Å; E743-R918 IonicContact OE2-NH1 3.81Å; E743-R918 PolarHBondContact OE2-NH1 3.42Å; E743-R918 IonicContact OE2-NH2 2.88Å; E743-R918 PolarHBondContact OE2-NH2 3.48Å; I914-R918 HydrophobicContact CG2-CG 4.2Å; I914-R918 WeakPolarHBondContact O-CG 3.31Å; I914-R918 PolarHBondContact O-N 3.14Å; I914-R918 VanDerWaalsContact O-N 3.14Å; H915-R918 PolarHBondContact O-N 3.24Å; E916-R918 VanDerWaalsContact C-N 3.31Å; E916-R918 PolarHBondContact O-N 3.19Å; R918-Q920 PolarHBondContact O-N 3.1Å; R918-Q920 VanDerWaalsContact O-N 3.15Å
919	Q	59.7	Low	67.1	Low	136.25 Å²	136.25	78.6 Å²	78.6	64%	0.637	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	16.1	176.2	-69.1	179.9	5.5	0	0	111.4	H915 E916 R917 N921 T922	H915-Q919 WeakPolarHBondContact O-CG 3.38Å; H915-Q919 PolarHBondContact O-N 3.18Å; E916-Q919 PolarHBondContact O-N 3.21Å; E916-Q919 VanDerWaalsContact O-N 3.09Å; R917-Q919 VanDerWaalsContact C-N 3.29Å; R917-Q919 PolarHBondContact O-N 2.92Å; Q919-N921 HydrophobicContact CB-CB 4.39Å; Q919-N921 PolarHBondContact O-N 3.16Å; Q919-N921 VanDerWaalsContact O-N 3.13Å; Q919-T922 HydrophobicContact CB-CG2 4.04Å; Q919-T922 PolarHBondContact O-N 2.8Å; Q919-T922 PolarHBondContact O-OG1 2.92Å
920	Q	54.4	Low	67.1	Low	159.75 Å²	159.75	82.8 Å²	82.8	75%	0.746	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	29.5	22.8	-176.4	-74.1	179.7	-10.9	0	0	113.2	E916 R917 R918 T922	E916-Q920 PolarHBondContact O-N 3.32Å; R917-Q920 WeakPolarHBondContact O-CA 3.37Å; R917-Q920 PolarHBondContact O-N 2.99Å; R917-Q920 VanDerWaalsContact O-N 3.07Å; R918-Q920 PolarHBondContact O-N 3.1Å; R918-Q920 VanDerWaalsContact O-N 3.15Å; Q920-T922 PolarHBondContact O-N 3.1Å
921	N	56.4	Low	67.2	Low	91.75 Å²	91.75	81.6 Å²	81.6	49%	0.491	39%	0.388	S	S	.	.			trans	-83.5	79.6	178.3	-119.2	-2.3	0	0	0	109.6	E916 Q919 I923 S924 F925	E916-N921 PolarHBondContact O-N 2.85Å; Q919-N921 HydrophobicContact CB-CB 4.39Å; Q919-N921 PolarHBondContact O-N 3.16Å; Q919-N921 VanDerWaalsContact O-N 3.13Å; N921-I923 PolarHBondContact O-N 3.01Å; N921-I923 VanDerWaalsContact O-N 3.07Å; N921-S924 WeakPolarHBondContact O-CB 3.38Å; N921-S924 PolarHBondContact O-N 2.91Å; N921-S924 VanDerWaalsContact O-N 3.15Å; N921-F925 VanDerWaalsContact O-CD2 3.25Å; N921-F925 WeakPolarHBondContact O-CD2 3.19Å
922	T	58.5	Low	67.8	Low	79.25 Å²	79.25	80 Å²	80	49%	0.486	38%	0.379	S	S	.	.	H	α-helix	trans	-60.9	-26.6	178.9	41.5	0	0	0	0	112	Q919 Q920 S924 F925 H926	Q919-T922 HydrophobicContact CB-CG2 4.04Å; Q919-T922 PolarHBondContact O-N 2.8Å; Q919-T922 PolarHBondContact O-OG1 2.92Å; Q920-T922 PolarHBondContact O-N 3.1Å; T922-S924 VanDerWaalsContact C-N 3.31Å; T922-S924 WeakPolarHBondContact CB-OG 3.41Å; T922-S924 PolarHBondContact O-N 3.01Å; T922-S924 PolarHBondContact OG1-OG 3.18Å; T922-F925 WeakPolarHBondContact O-CB 3.43Å; T922-F925 PolarHBondContact O-N 3.32Å; T922-H926 WeakPolarHBondContact O-CB 3.11Å; T922-H926 PolarHBondContact O-CD2 3.23Å; T922-H926 PolarHBondContact O-N 2.98Å; T922-H926 VanDerWaalsContact O-N 3.08Å
923	I	63.1	Low	68.8	Low	123 Å²	123	79.8 Å²	79.8	63%	0.631	38%	0.378	S	S	*	.	H	α-helix	trans	-56.1	-45.6	177.7	-62.2	165.4	0	0	0	111.3	N921 F925 H926 E927	N921-I923 PolarHBondContact O-N 3.01Å; N921-I923 VanDerWaalsContact O-N 3.07Å; I923-F925 VanDerWaalsContact C-N 3.29Å; I923-F925 PolarHBondContact O-N 3.31Å; I923-H926 PolarHBondContact O-N 3.06Å; I923-E927 WeakPolarHBondContact O-CB 3.38Å; I923-E927 PolarHBondContact O-N 3.16Å; I923-E927 VanDerWaalsContact O-N 3.12Å
924	S	65.3	Low	70	Confident	24.75 Å²	24.75	76.9 Å²	76.9	17%	0.173	36%	0.36	C	S	.	.	H	α-helix	trans	-61.9	-35.5	-179.9	-50.4	0	0	0	0	113.1	E916 N921 T922 A928	E916-S924 WeakPolarHBondContact OE2-CB 3.42Å; E916-S924 PolarHBondContact OE2-OG 3.1Å; N921-S924 WeakPolarHBondContact O-CB 3.38Å; N921-S924 PolarHBondContact O-N 2.91Å; N921-S924 VanDerWaalsContact O-N 3.15Å; T922-S924 VanDerWaalsContact C-N 3.31Å; T922-S924 WeakPolarHBondContact CB-OG 3.41Å; T922-S924 PolarHBondContact O-N 3.01Å; T922-S924 PolarHBondContact OG1-OG 3.18Å; S924-A928 WeakPolarHBondContact O-CB 3.34Å; S924-A928 PolarHBondContact O-N 2.99Å
925	F	70.6	Confident	71.4	Confident	44.5 Å²	44.5	72.7 Å²	72.7	20%	0.195	34%	0.338	C	S	.	.	H	α-helix	trans	-68.3	-48.8	177.5	-87.6	-66.8	0	0	0	112.1	I909 V912 R917 N921 T922 I923 E927 A928 I929	I909-F925 HydrophobicContact CB-CE2 4.46Å; I909-F925 HydrophobicContact CD1-CE2 4.14Å; I909-F925 HydrophobicContact CD1-CZ 3.68Å; I909-F925 HydrophobicContact CG1-CD1 4.41Å; I909-F925 HydrophobicContact CG1-CE2 3.83Å; I909-F925 HydrophobicContact CG1-CZ 3.8Å; I909-F925 HydrophobicContact CG2-CD1 3.9Å; I909-F925 HydrophobicContact CG2-CE1 3.77Å; I909-F925 HydrophobicContact CG2-CE2 3.85Å; I909-F925 HydrophobicContact CG2-CZ 4.48Å; V912-F925 HydrophobicContact CB-CD1 4.3Å; V912-F925 HydrophobicContact CB-CE1 4.41Å; V912-F925 HydrophobicContact CG1-CD1 4.31Å; V912-F925 HydrophobicContact CG1-CE1 4.37Å; V912-F925 HydrophobicContact CG2-CD1 4.2Å; R917-F925 HydrophobicContact CB-CE1 4.12Å; R917-F925 HydrophobicContact CB-CZ 3.9Å; R917-F925 HydrophobicContact CG-CE1 3.6Å; R917-F925 HydrophobicContact CG-CZ 3.91Å; N921-F925 VanDerWaalsContact O-CD2 3.25Å; N921-F925 WeakPolarHBondContact O-CD2 3.19Å; T922-F925 WeakPolarHBondContact O-CB 3.43Å; T922-F925 PolarHBondContact O-N 3.32Å; I923-F925 VanDerWaalsContact C-N 3.29Å; I923-F925 PolarHBondContact O-N 3.31Å; F925-E927 VanDerWaalsContact C-N 3.31Å; F925-E927 PolarHBondContact O-N 3.17Å; F925-A928 PolarHBondContact O-N 3.13Å; F925-I929 HydrophobicContact CD1-CD1 4.26Å; F925-I929 HydrophobicContact CE1-CD1 3.79Å; F925-I929 HydrophobicContact CZ-CD1 4.22Å; F925-I929 WeakPolarHBondContact O-CB 3.33Å; F925-I929 VanDerWaalsContact O-CG1 3.28Å; F925-I929 WeakPolarHBondContact O-CG1 3.44Å; F925-I929 PolarHBondContact O-N 3.21Å; F925-I929 VanDerWaalsContact O-N 3.09Å
926	H	73.7	Confident	72.8	Confident	69.75 Å²	69.75	66.9 Å²	66.9	32%	0.323	31%	0.311	S	S	.	.	H	α-helix	trans	-64.4	-37.1	177.7	-78.7	-73.6	0	0	0	111.6	T922 I923 I929 R930 D975	T922-H926 WeakPolarHBondContact O-CB 3.11Å; T922-H926 PolarHBondContact O-CD2 3.23Å; T922-H926 PolarHBondContact O-N 2.98Å; T922-H926 VanDerWaalsContact O-N 3.08Å; I923-H926 PolarHBondContact O-N 3.06Å; H926-I929 PolarHBondContact O-N 3.17Å; H926-R930 WeakPolarHBondContact O-CB 3.38Å; H926-R930 VanDerWaalsContact O-CG 3.28Å; H926-R930 WeakPolarHBondContact O-CG 3.32Å; H926-R930 PolarHBondContact O-N 3.29Å; H926-D975 PolarHBondContact CE1-O 3.01Å; H926-D975 PolarHBondContact ND1-O 3.19Å; H926-D975 VanDerWaalsContact ND1-O 3.1Å
927	E	75.4	Confident	74.2	Confident	108.25 Å²	108.25	63.8 Å²	63.8	51%	0.506	30%	0.296	S	S	.	.	H	α-helix	trans	-66.7	-43.7	177.5	-167.8	168.8	-165.7	0	0	112	I923 F925 I929 R930 L931	I923-E927 WeakPolarHBondContact O-CB 3.38Å; I923-E927 PolarHBondContact O-N 3.16Å; I923-E927 VanDerWaalsContact O-N 3.12Å; F925-E927 VanDerWaalsContact C-N 3.31Å; F925-E927 PolarHBondContact O-N 3.17Å; E927-I929 VanDerWaalsContact C-N 3.28Å; E927-I929 PolarHBondContact O-N 2.98Å; E927-R930 CarbonylContact O-C 3.55Å; E927-R930 PolarHBondContact O-N 3.2Å; E927-L931 HydrophobicContact CG-CD1 4.15Å; E927-L931 HydrophobicContact CG-CG 4.44Å; E927-L931 WeakPolarHBondContact O-CB 3.33Å; E927-L931 VanDerWaalsContact O-CG 3.27Å; E927-L931 WeakPolarHBondContact O-CG 3.39Å; E927-L931 PolarHBondContact O-N 3.02Å
928	A	75.5	Confident	75.6	Confident	15.5 Å²	15.5	60.1 Å²	60.1	13%	0.128	28%	0.283	C	S	.	.	H	α-helix	trans	-61.1	-36.4	175.8	0	0	0	0	0	113.1	V912 S924 F925 R932	V912-A928 HydrophobicContact CG2-CB 3.34Å; V912-A928 VanDerWaalsContact CG2-CB 3.44Å; S924-A928 WeakPolarHBondContact O-CB 3.34Å; S924-A928 PolarHBondContact O-N 2.99Å; F925-A928 PolarHBondContact O-N 3.13Å; A928-R932 WeakPolarHBondContact O-CD 3.4Å; A928-R932 WeakPolarHBondContact O-CG 3.37Å
929	I	81.3	Confident	76.9	Confident	4.25 Å²	4.25	53.9 Å²	53.9	2%	0.022	26%	0.263	C	S	.	.	H	α-helix	trans	-70	-47.7	174	-65.1	169	0	0	0	110.1	R905 A908 I909 F925 H926 E927 L931 R932 I933 V977	R905-I929 HydrophobicContact CG-CD1 4.12Å; R905-I929 HydrophobicContact CG-CG1 4.31Å; A908-I929 HydrophobicContact CB-CG1 4.37Å; I909-I929 HydrophobicContact CD1-CD1 4.27Å; I909-I929 HydrophobicContact CG1-CD1 4.15Å; I909-I929 HydrophobicContact CG1-CG1 4.27Å; F925-I929 HydrophobicContact CD1-CD1 4.26Å; F925-I929 HydrophobicContact CE1-CD1 3.79Å; F925-I929 HydrophobicContact CZ-CD1 4.22Å; F925-I929 WeakPolarHBondContact O-CB 3.33Å; F925-I929 VanDerWaalsContact O-CG1 3.28Å; F925-I929 WeakPolarHBondContact O-CG1 3.44Å; F925-I929 PolarHBondContact O-N 3.21Å; F925-I929 VanDerWaalsContact O-N 3.09Å; H926-I929 PolarHBondContact O-N 3.17Å; E927-I929 VanDerWaalsContact C-N 3.28Å; E927-I929 PolarHBondContact O-N 2.98Å; I929-L931 PolarHBondContact O-N 3.15Å; I929-R932 PolarHBondContact O-N 3.19Å; I929-I933 HydrophobicContact CG2-CB 4.38Å; I929-I933 HydrophobicContact CG2-CD1 4.07Å; I929-I933 HydrophobicContact CG2-CG1 4.25Å; I929-I933 PolarHBondContact O-N 3.06Å; I929-V977 HydrophobicContact CB-CG1 4.49Å; I929-V977 HydrophobicContact CG2-CB 4.44Å; I929-V977 HydrophobicContact CG2-CG1 3.39Å; I929-V977 VanDerWaalsContact CG2-CG1 3.44Å; I929-V977 HydrophobicContact CG2-CG2 3.67Å
930	R	81	Confident	78	Confident	127.75 Å²	127.75	50.3 Å²	50.3	48%	0.482	25%	0.253	S	S	.	.	H	α-helix	trans	-62.6	-24.9	178.5	-78.2	176.2	171.8	172.4	-1.1	114.1	H926 E927 R932 G976 I978 L1014	H926-R930 WeakPolarHBondContact O-CB 3.38Å; H926-R930 VanDerWaalsContact O-CG 3.28Å; H926-R930 WeakPolarHBondContact O-CG 3.32Å; H926-R930 PolarHBondContact O-N 3.29Å; E927-R930 CarbonylContact O-C 3.55Å; E927-R930 PolarHBondContact O-N 3.2Å; R930-R932 VanDerWaalsContact C-N 3.3Å; R930-R932 PolarHBondContact O-N 2.9Å; R930-G976 WeakPolarHBondContact CG-O 3.31Å; R930-G976 PolarHBondContact NE-O 3.14Å; R930-I978 HydrophobicContact CB-CG1 4.47Å; R930-I978 VanDerWaalsContact O-CD1 3.28Å; R930-I978 WeakPolarHBondContact O-CD1 3.37Å; R930-L1014 WeakPolarHBondContact O-CD2 3.39Å
931	L	81	Confident	79.4	Confident	40 Å²	40	44.9 Å²	44.9	21%	0.209	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-9.2	175.5	-75.2	168.8	0	0	0	113.2	E927 I929 L1014 R1017 L1018	E927-L931 HydrophobicContact CG-CD1 4.15Å; E927-L931 HydrophobicContact CG-CG 4.44Å; E927-L931 WeakPolarHBondContact O-CB 3.33Å; E927-L931 VanDerWaalsContact O-CG 3.27Å; E927-L931 WeakPolarHBondContact O-CG 3.39Å; E927-L931 PolarHBondContact O-N 3.02Å; I929-L931 PolarHBondContact O-N 3.15Å; L931-L1014 VanDerWaalsContact C-CD2 3.43Å; L931-L1014 HydrophobicContact CD2-CD2 4.21Å; L931-L1014 VanDerWaalsContact O-CD2 3.29Å; L931-L1014 WeakPolarHBondContact O-CD2 3.21Å; L931-R1017 HydrophobicContact CD2-CB 3.72Å; L931-R1017 HydrophobicContact CD2-CG 4.41Å; L931-R1017 VanDerWaalsContact CD2-NH1 3.32Å; L931-L1018 HydrophobicContact CB-CD2 4.2Å; L931-L1018 WeakPolarHBondContact O-CD1 3.43Å; L931-L1018 WeakPolarHBondContact O-CG 3.26Å
932	R	85.2	Confident	80.5	Confident	52.5 Å²	52.5	40.9 Å²	40.9	20%	0.198	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-132.5	-21.2	-170.7	-64.2	-179	177.2	-84.8	-1.4	114.3	D856 I857 F858 A908 K911 A928 I929 R930 L1018	D856-R932 WeakPolarHBondContact O-CB 3.3Å; D856-R932 WeakPolarHBondContact O-CG 3.36Å; D856-R932 PolarHBondContact O-NH1 3.31Å; D856-R932 IonicContact OD1-NH1 3.09Å; D856-R932 PolarHBondContact OD1-NH1 2.89Å; I857-R932 CarbonylContact C-O 3.56Å; I857-R932 VanDerWaalsContact CA-O 3.27Å; I857-R932 WeakPolarHBondContact CA-O 3.33Å; F858-R932 PolarHBondContact N-O 3.04Å; A908-R932 HydrophobicContact CB-CB 4.33Å; K911-R932 VanDerWaalsContact CD-NH2 3.33Å; A928-R932 WeakPolarHBondContact O-CD 3.4Å; A928-R932 WeakPolarHBondContact O-CG 3.37Å; I929-R932 PolarHBondContact O-N 3.19Å; R930-R932 VanDerWaalsContact C-N 3.3Å; R930-R932 PolarHBondContact O-N 2.9Å; R932-L1018 HydrophobicContact CG-CD2 4.47Å
933	I	90.6	Very high	81.5	Confident	2.25 Å²	2.25	37.6 Å²	37.6	1%	0.012	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	130.5	-175.7	-53.1	-170.5	0	0	0	109.8	F858 Y901 A904 R905 I929 V935 V977 I978	F858-I933 HydrophobicContact CB-CG1 4.29Å; F858-I933 HydrophobicContact CB-CG2 4.42Å; F858-I933 HydrophobicContact CD1-CG2 4.06Å; F858-I933 CarbonylContact O-C 3.57Å; F858-I933 WeakPolarHBondContact O-CA 3.42Å; Y901-I933 HydrophobicContact CD2-CG2 4.36Å; Y901-I933 HydrophobicContact CE2-CD1 4.35Å; Y901-I933 HydrophobicContact CE2-CG2 3.97Å; A904-I933 HydrophobicContact CB-CD1 4.25Å; R905-I933 HydrophobicContact CB-CD1 4.08Å; R905-I933 HydrophobicContact CG-CD1 4.42Å; I929-I933 HydrophobicContact CG2-CB 4.38Å; I929-I933 HydrophobicContact CG2-CD1 4.07Å; I929-I933 HydrophobicContact CG2-CG1 4.25Å; I929-I933 PolarHBondContact O-N 3.06Å; I933-V935 HydrophobicContact CG2-CG2 4.36Å; I933-V977 HydrophobicContact CB-CB 4.4Å; I933-V977 HydrophobicContact CB-CG1 3.82Å; I933-V977 VanDerWaalsContact CB-CG1 3.43Å; I933-V977 HydrophobicContact CG2-CB 4.14Å; I933-V977 HydrophobicContact CG2-CG1 3.72Å; I933-V977 HydrophobicContact CG2-CG2 4.3Å; I933-V977 WeakPolarHBondContact O-CG1 3.34Å; I933-I978 PolarHBondContact O-N 3.09Å
934	C	90.3	Very high	82.3	Confident	0.75 Å²	0.75	39.4 Å²	39.4	1%	0.005	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	134.9	172.2	-3.9	0	0	0	0	110.6	F858 V859 L860 F936 I978 V979 T1010 L1014	F858-C934 PolarHBondContact O-N 3.28Å; V859-C934 CarbonylContact C-O 3.5Å; V859-C934 WeakPolarHBondContact CA-O 3.27Å; L860-C934 PolarHBondContact N-O 3.09Å; C934-F936 HydrophobicContact CB-CE2 4.08Å; C934-F936 HydrophobicContact CB-CZ 4.45Å; C934-I978 CarbonylContact C-O 3.56Å; C934-I978 VanDerWaalsContact CA-O 3.29Å; C934-I978 WeakPolarHBondContact CA-O 3.46Å; C934-I978 HydrophobicContact CB-CB 4.33Å; C934-V979 HydrophobicContact CB-CG2 3.9Å; C934-T1010 HydrophobicContact CB-CG2 3.96Å; C934-T1010 WeakPolarHBondContact SG-CG2 3.43Å; C934-L1014 HydrophobicContact CB-CD1 4.16Å; C934-L1014 WeakPolarHBondContact SG-CD1 3.35Å
935	V	91.8	Very high	82.9	Confident	0.25 Å²	0.25	43 Å²	43	0%	0.002	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	134.3	-179.7	-171.8	0	0	0	0	110.7	L860 L862 Y901 I933 I937 I972 V977 I978 V979 S980	L860-V935 HydrophobicContact CB-CB 4.36Å; L860-V935 HydrophobicContact CB-CG1 4.08Å; L860-V935 HydrophobicContact CB-CG2 4Å; L860-V935 HydrophobicContact CD2-CG1 4.02Å; L860-V935 HydrophobicContact CD2-CG2 4.14Å; L860-V935 HydrophobicContact CG-CG1 4.13Å; L860-V935 CarbonylContact O-C 3.55Å; L860-V935 VanDerWaalsContact O-CA 3.31Å; L860-V935 WeakPolarHBondContact O-CA 3.35Å; L862-V935 HydrophobicContact CD1-CG1 4.21Å; L862-V935 HydrophobicContact CG-CG1 4.46Å; Y901-V935 HydrophobicContact CE2-CG2 4.41Å; I933-V935 HydrophobicContact CG2-CG2 4.36Å; V935-I937 HydrophobicContact CG1-CD1 4.42Å; V935-I937 HydrophobicContact CG1-CG1 4.05Å; V935-I972 HydrophobicContact CB-CG2 4.04Å; V935-I972 HydrophobicContact CG1-CD1 4.35Å; V935-I972 HydrophobicContact CG1-CG2 4.06Å; V935-I972 HydrophobicContact CG2-CG2 3.74Å; V935-V977 HydrophobicContact CG2-CB 4.31Å; V935-V977 HydrophobicContact CG2-CG1 3.94Å; V935-V977 HydrophobicContact CG2-CG2 3.81Å; V935-V977 PolarHBondContact N-O 3.13Å; V935-V977 VanDerWaalsContact N-O 3.1Å; V935-I978 PolarHBondContact N-O 3.36Å; V935-V979 HydrophobicContact CB-CG1 4.17Å; V935-V979 HydrophobicContact CB-CG2 4.22Å; V935-V979 HydrophobicContact CG1-CG1 4.42Å; V935-V979 HydrophobicContact CG2-CG2 4.49Å; V935-V979 VanDerWaalsContact O-CA 3.31Å; V935-V979 WeakPolarHBondContact O-CA 3.39Å; V935-V979 PolarHBondContact O-N 3.06Å; V935-S980 PolarHBondContact O-N 3.09Å
936	F	92.3	Very high	83.5	Confident	0.5 Å²	0.5	41.1 Å²	41.1	0%	0.002	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	124.1	175.5	-59.5	-93.5	0	0	0	109.2	V859 L860 L861 L862 C934 V979 S980 Y983 F1003 Q1006 F1007 T1010	V859-F936 HydrophobicContact CG1-CD2 4.12Å; V859-F936 HydrophobicContact CG1-CE2 4.09Å; L860-F936 PolarHBondContact O-N 3.05Å; L861-F936 WeakPolarHBondContact CA-O 3.23Å; L861-F936 HydrophobicContact CD2-CB 3.89Å; L861-F936 HydrophobicContact CD2-CD2 3.97Å; L861-F936 HydrophobicContact CD2-CG 4.24Å; L862-F936 PolarHBondContact N-O 3.03Å; C934-F936 HydrophobicContact CB-CE2 4.08Å; C934-F936 HydrophobicContact CB-CZ 4.45Å; F936-V979 HydrophobicContact CD1-CB 4.45Å; F936-V979 HydrophobicContact CE1-CB 4.12Å; F936-V979 HydrophobicContact CE1-CG1 3.8Å; F936-V979 HydrophobicContact CZ-CB 4.17Å; F936-V979 HydrophobicContact CZ-CG1 3.95Å; F936-V979 HydrophobicContact CZ-CG2 4.35Å; F936-S980 VanDerWaalsContact CD1-CB 3.47Å; F936-Y983 HydrophobicContact CB-CD1 4.41Å; F936-Y983 HydrophobicContact CB-CE1 3.93Å; F936-F1003 HydrophobicContact CB-CD2 4.09Å; F936-F1003 HydrophobicContact CB-CE2 3.77Å; F936-F1003 AromaticContact CD1-CD2 3.9Å; F936-F1003 HydrophobicContact CD1-CD2 3.95Å; F936-F1003 AromaticContact CD1-CE2 3.89Å; F936-F1003 HydrophobicContact CD1-CE2 3.92Å; F936-F1003 HydrophobicContact CD2-CE2 4.26Å; F936-F1003 HydrophobicContact CE1-CE2 4.45Å; F936-F1003 AromaticContact CG-CD2 4Å; F936-F1003 HydrophobicContact CG-CD2 4.12Å; F936-F1003 AromaticContact CG-CE2 3.72Å; F936-F1003 HydrophobicContact CG-CE2 3.72Å; F936-Q1006 HydrophobicContact CE1-CB 4.26Å; F936-F1007 HydrophobicContact CD2-CD2 4.46Å; F936-F1007 HydrophobicContact CE1-CB 4.13Å; F936-F1007 AromaticContact CE2-CD2 3.78Å; F936-F1007 HydrophobicContact CE2-CD2 3.78Å; F936-F1007 HydrophobicContact CE2-CE2 4.45Å; F936-F1007 HydrophobicContact CZ-CB 4.03Å; F936-F1007 AromaticContact CZ-CD2 3.86Å; F936-F1007 HydrophobicContact CZ-CD2 3.86Å; F936-F1007 HydrophobicContact CZ-CG 4.42Å; F936-T1010 HydrophobicContact CZ-CG2 4.36Å
937	I	90.6	Very high	83.9	Confident	2.25 Å²	2.25	40.5 Å²	40.5	1%	0.012	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	121.9	-177.4	-52.5	-173.7	0	0	0	109.4	L862 V935 K969 I978 V979 S980 Y981 N982 Y983	L862-I937 HydrophobicContact CB-CG1 4.33Å; L862-I937 HydrophobicContact CD1-CD1 4.38Å; L862-I937 HydrophobicContact CD1-CG1 4.47Å; L862-I937 WeakPolarHBondContact O-CA 3.21Å; V935-I937 HydrophobicContact CG1-CD1 4.42Å; V935-I937 HydrophobicContact CG1-CG1 4.05Å; I937-K969 HydrophobicContact CD1-CG 4.47Å; I937-I978 HydrophobicContact CD1-CD1 3.85Å; I937-I978 HydrophobicContact CD1-CG1 4.44Å; I937-V979 HydrophobicContact CD1-CG1 4Å; I937-V979 HydrophobicContact CG1-CG1 4.1Å; I937-S980 PolarHBondContact N-O 3.12Å; I937-S980 VanDerWaalsContact N-O 3.11Å; I937-Y981 HydrophobicContact CB-CD1 4.37Å; I937-Y981 HydrophobicContact CB-CD2 4.38Å; I937-Y981 HydrophobicContact CD1-CD1 3.84Å; I937-Y981 HydrophobicContact CD1-CD2 4.01Å; I937-Y981 HydrophobicContact CD1-CE1 3.6Å; I937-Y981 HydrophobicContact CD1-CE2 3.98Å; I937-Y981 HydrophobicContact CG1-CD1 4.43Å; I937-Y981 HydrophobicContact CG1-CE1 4.43Å; I937-N982 WeakPolarHBondContact O-CA 3.41Å; I937-N982 PolarHBondContact O-N 2.94Å; I937-Y983 VanDerWaalsContact C-CE1 3.4Å; I937-Y983 VanDerWaalsContact O-CD1 3.27Å; I937-Y983 WeakPolarHBondContact O-CD1 3.36Å; I937-Y983 WeakPolarHBondContact O-CE1 3.32Å; I937-Y983 PolarHBondContact O-N 3.05Å
938	R	89.9	Confident	84.2	Confident	1 Å²	1	41.1 Å²	41.1	0%	0.004	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	141.1	176.8	-173.2	166.7	65.4	-154.4	1.1	110.7	D797 M798 E801 L862 S940 Y983 A985	D797-R938 PolarHBondContact O-NH1 3.04Å; D797-R938 PolarHBondContact O-NH2 3.12Å; D797-R938 IonicContact OD2-NH2 3.92Å; M798-R938 HydrophobicContact CE-CB 4.47Å; M798-R938 VanDerWaalsContact SD-CZ 3.55Å; M798-R938 PolarHBondContact SD-NH1 3.24Å; M798-R938 VanDerWaalsContact SD-NH1 3.36Å; E801-R938 IonicContact OE1-CZ 3.86Å; E801-R938 IonicContact OE1-NH1 2.9Å; E801-R938 PolarHBondContact OE1-NH1 3.14Å; E801-R938 IonicContact OE2-NH1 2.94Å; L862-R938 PolarHBondContact O-N 3.1Å; R938-S940 PolarHBondContact O-N 3.12Å; R938-Y983 HydrophobicContact CB-CE1 4.19Å; R938-Y983 HydrophobicContact CB-CE2 3.96Å; R938-Y983 HydrophobicContact CG-CD2 4.42Å; R938-Y983 HydrophobicContact CG-CE2 3.98Å; R938-Y983 VanDerWaalsContact N-CE1 3.3Å; R938-A985 HydrophobicContact CG-CB 4.18Å
939	D	87.3	Confident	84.5	Confident	48.25 Å²	48.25	48.6 Å²	48.6	26%	0.258	25%	0.25	S	C	.	.			trans	-66.7	128.5	174	-169.7	2.1	0	0	0	110.9	A941 S942 N982 Y983	D939-A941 PolarHBondContact O-N 2.98Å; D939-A941 PolarHBondContact OD1-N 3.25Å; D939-A941 VanDerWaalsContact OD1-N 3.11Å; D939-A941 WeakPolarHBondContact OD2-CB 3.39Å; D939-S942 WeakPolarHBondContact O-CB 3.41Å; D939-S942 PolarHBondContact O-N 3.03Å; D939-S942 PolarHBondContact O-OG 3.07Å; D939-N982 HydrophobicContact CB-CB 3.9Å; D939-Y983 WeakPolarHBondContact CB-O 3.32Å; D939-Y983 PolarHBondContact N-O 3.01Å
940	S	84.3	Confident	84.6	Confident	60.75 Å²	60.75	49.8 Å²	49.8	43%	0.425	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-63.7	-22.8	176.3	-58.9	0	0	0	0	112.4	D864 R938 S942 M943	D864-S940 PolarHBondContact OD1-OG 3.03Å; D864-S940 VanDerWaalsContact OD1-OG 3.08Å; D864-S940 WeakPolarHBondContact OD2-CA 3.09Å; D864-S940 WeakPolarHBondContact OD2-CB 3.43Å; D864-S940 PolarHBondContact OD2-OG 3.29Å; R938-S940 PolarHBondContact O-N 3.12Å; S940-S942 PolarHBondContact O-N 3.27Å; S940-M943 VanDerWaalsContact O-CB 3.31Å; S940-M943 WeakPolarHBondContact O-CB 3.17Å; S940-M943 WeakPolarHBondContact O-CG 3.44Å; S940-M943 PolarHBondContact O-N 3.24Å; S940-M943 VanDerWaalsContact O-N 3.11Å
941	A	82.9	Confident	84.7	Confident	46.25 Å²	46.25	46.1 Å²	46.1	38%	0.382	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-63.1	-19.9	172.6	0	0	0	0	0	113.1	D939 M943 E944	D939-A941 PolarHBondContact O-N 2.98Å; D939-A941 PolarHBondContact OD1-N 3.25Å; D939-A941 VanDerWaalsContact OD1-N 3.11Å; D939-A941 WeakPolarHBondContact OD2-CB 3.39Å; A941-M943 PolarHBondContact O-N 2.95Å; A941-M943 VanDerWaalsContact O-N 3.11Å; A941-E944 PolarHBondContact O-N 3.03Å; A941-E944 VanDerWaalsContact O-N 3.15Å
942	S	81.1	Confident	84.7	Confident	6.5 Å²	6.5	47.8 Å²	47.8	5%	0.045	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-60.3	-17.5	174.9	-53.3	0	0	0	0	113.1	D939 S940 A985	D939-S942 WeakPolarHBondContact O-CB 3.41Å; D939-S942 PolarHBondContact O-N 3.03Å; D939-S942 PolarHBondContact O-OG 3.07Å; S940-S942 PolarHBondContact O-N 3.27Å; S942-A985 WeakPolarHBondContact CA-O 3.44Å; S942-A985 WeakPolarHBondContact CB-O 3.4Å; S942-A985 PolarHBondContact OG-N 3.01Å; S942-A985 PolarHBondContact OG-O 3.06Å
943	M	78.6	Confident	84.5	Confident	11.25 Å²	11.25	48.1 Å²	48.1	6%	0.055	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-80.6	-16	-178.2	-60.7	-55.8	25.6	0	0	114	S940 A941 N945 V946 F954 E955 M997	S940-M943 VanDerWaalsContact O-CB 3.31Å; S940-M943 WeakPolarHBondContact O-CB 3.17Å; S940-M943 WeakPolarHBondContact O-CG 3.44Å; S940-M943 PolarHBondContact O-N 3.24Å; S940-M943 VanDerWaalsContact O-N 3.11Å; A941-M943 PolarHBondContact O-N 2.95Å; A941-M943 VanDerWaalsContact O-N 3.11Å; M943-N945 VanDerWaalsContact C-N 3.26Å; M943-N945 PolarHBondContact O-N 2.98Å; M943-N945 VanDerWaalsContact O-N 3.15Å; M943-V946 HydrophobicContact CE-CB 4.19Å; M943-V946 HydrophobicContact CE-CG2 3.76Å; M943-V946 PolarHBondContact O-N 3.32Å; M943-V946 VanDerWaalsContact O-N 3.14Å; M943-V946 HydrophobicContact SD-CG2 4.38Å; M943-F954 HydrophobicContact CE-CB 3.85Å; M943-F954 HydrophobicContact CE-CD2 3.95Å; M943-F954 HydrophobicContact CE-CG 4.07Å; M943-F954 HydrophobicContact SD-CB 3.67Å; M943-F954 VanDerWaalsContact SD-CB 3.57Å; M943-F954 HydrophobicContact SD-CG 4.34Å; M943-E955 HydrophobicContact CE-CB 3.96Å; M943-E955 HydrophobicContact CE-CG 4.2Å; M943-E955 HydrophobicContact CG-CG 4.4Å; M943-M997 HydrophobicContact CE-CE 3.41Å; M943-M997 VanDerWaalsContact CE-CE 3.41Å; M943-M997 HydrophobicContact SD-CE 3.93Å
944	E	79.6	Confident	84.2	Confident	160.25 Å²	160.25	48.1 Å²	48.1	75%	0.749	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-31.5	-176.8	-69.6	-176.5	175	0	0	112.8	A941 V946	A941-E944 PolarHBondContact O-N 3.03Å; A941-E944 VanDerWaalsContact O-N 3.15Å; E944-V946 VanDerWaalsContact C-N 3.35Å
945	N	77.4	Confident	83.9	Confident	100.5 Å²	100.5	51.3 Å²	51.3	54%	0.537	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-2.2	-178.5	-65.7	-42.8	0	0	0	114	M943 F987	M943-N945 VanDerWaalsContact C-N 3.26Å; M943-N945 PolarHBondContact O-N 2.98Å; M943-N945 VanDerWaalsContact O-N 3.15Å; N945-F987 HydrophobicContact CB-CB 4.49Å; N945-F987 WeakPolarHBondContact O-CB 3.43Å
946	V	83.2	Confident	83.6	Confident	4 Å²	4	52.2 Å²	52.2	2%	0.024	27%	0.271	C	S	.	.	S	Bend	trans	-83.6	127.7	179.8	-177.9	0	0	0	0	109.3	M943 E944 D948 L950 K951 F954 F987 M997	M943-V946 HydrophobicContact CE-CB 4.19Å; M943-V946 HydrophobicContact CE-CG2 3.76Å; M943-V946 PolarHBondContact O-N 3.32Å; M943-V946 VanDerWaalsContact O-N 3.14Å; M943-V946 HydrophobicContact SD-CG2 4.38Å; E944-V946 VanDerWaalsContact C-N 3.35Å; V946-D948 PolarHBondContact O-N 3.18Å; V946-L950 HydrophobicContact CG1-CB 4.08Å; V946-K951 HydrophobicContact CB-CG 4.22Å; V946-K951 HydrophobicContact CG1-CG 4.05Å; V946-K951 VanDerWaalsContact O-CE 3.26Å; V946-K951 WeakPolarHBondContact O-CE 3.37Å; V946-F954 HydrophobicContact CG1-CD2 4Å; V946-F954 HydrophobicContact CG1-CE2 4.1Å; V946-F954 HydrophobicContact CG2-CD2 4.39Å; V946-F954 HydrophobicContact CG2-CE2 4.44Å; V946-F987 HydrophobicContact CG1-CD2 4.39Å; V946-F987 HydrophobicContact CG2-CB 4.03Å; V946-F987 HydrophobicContact CG2-CD2 4.32Å; V946-F987 HydrophobicContact CG2-CG 4.35Å; V946-M997 HydrophobicContact CG2-CE 3.64Å; V946-M997 HydrophobicContact CG2-SD 4.3Å
947	P	82.8	Confident	83.1	Confident	57 Å²	57	58.9 Å²	58.9	37%	0.37	30%	0.297	S	S	.	.			trans	-54.9	138.6	174.1	-25.5	34.2	0	0	0	112	E949 L950 K951 F987	P947-E949 PolarHBondContact O-N 3.14Å; P947-E949 VanDerWaalsContact O-N 3.11Å; P947-L950 HydrophobicContact CB-CD1 4.42Å; P947-L950 HydrophobicContact CG-CD1 4.24Å; P947-L950 WeakPolarHBondContact O-CA 3.28Å; P947-L950 PolarHBondContact O-N 3.05Å; P947-K951 PolarHBondContact O-N 3.08Å; P947-K951 VanDerWaalsContact O-N 3.16Å; P947-F987 HydrophobicContact CG-CD1 4.39Å; P947-F987 HydrophobicContact CG-CE1 3.96Å; P947-F987 HydrophobicContact CG-CZ 4.45Å
948	D	82.5	Confident	82.9	Confident	121.75 Å²	121.75	61.9 Å²	61.9	65%	0.651	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-35.5	-174.3	-71.1	-36.8	0	0	0	113.3	V946 L950 K951	V946-D948 PolarHBondContact O-N 3.18Å; D948-L950 PolarHBondContact O-N 3.18Å; D948-K951 PolarHBondContact O-N 3.07Å; D948-K951 VanDerWaalsContact OD1-CE 3.28Å; D948-K951 WeakPolarHBondContact OD1-CE 3.38Å; D948-K951 IonicContact OD1-NZ 3.16Å; D948-K951 PolarHBondContact OD1-NZ 3.12Å
949	E	81.2	Confident	82.8	Confident	172 Å²	172	66.7 Å²	66.7	80%	0.804	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-28.3	176.7	-61.6	177.9	-175.1	0	0	112.9	P947 H952	P947-E949 PolarHBondContact O-N 3.14Å; P947-E949 VanDerWaalsContact O-N 3.11Å; E949-H952 PolarHBondContact O-CE1 2.92Å; E949-H952 PolarHBondContact O-ND1 3.26Å
950	L	82.7	Confident	82.9	Confident	30 Å²	30	70.4 Å²	70.4	16%	0.157	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-9.8	-175.5	-61.7	175.6	0	0	0	113.3	V946 P947 D948 H952 Y953 F987 L990 P995	V946-L950 HydrophobicContact CG1-CB 4.08Å; P947-L950 HydrophobicContact CB-CD1 4.42Å; P947-L950 HydrophobicContact CG-CD1 4.24Å; P947-L950 WeakPolarHBondContact O-CA 3.28Å; P947-L950 PolarHBondContact O-N 3.05Å; D948-L950 PolarHBondContact O-N 3.18Å; L950-H952 PolarHBondContact O-N 3.27Å; L950-H952 VanDerWaalsContact O-N 3.1Å; L950-Y953 HydrophobicContact CD2-CD2 4.31Å; L950-Y953 HydrophobicContact CD2-CE2 4.16Å; L950-Y953 WeakPolarHBondContact O-CB 3.28Å; L950-Y953 WeakPolarHBondContact O-CD2 3.35Å; L950-Y953 PolarHBondContact O-N 2.95Å; L950-F987 HydrophobicContact CD1-CE2 4.19Å; L950-F987 HydrophobicContact CD1-CZ 3.72Å; L950-L990 HydrophobicContact CD1-CD1 4.06Å; L950-L990 HydrophobicContact CD1-CD2 4.15Å; L950-L990 HydrophobicContact CD1-CG 4.3Å; L950-L990 HydrophobicContact CD2-CD2 4.3Å; L950-P995 HydrophobicContact CB-CB 4.5Å; L950-P995 HydrophobicContact CD1-CB 4.35Å
951	K	83.4	Confident	83.1	Confident	49.75 Å²	49.75	70.2 Å²	70.2	22%	0.216	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-55.6	-29.9	179.5	-76.7	-177.1	178.5	165.9	0	113.2	V946 P947 D948 Y953 F954 E955	V946-K951 HydrophobicContact CB-CG 4.22Å; V946-K951 HydrophobicContact CG1-CG 4.05Å; V946-K951 VanDerWaalsContact O-CE 3.26Å; V946-K951 WeakPolarHBondContact O-CE 3.37Å; P947-K951 PolarHBondContact O-N 3.08Å; P947-K951 VanDerWaalsContact O-N 3.16Å; D948-K951 PolarHBondContact O-N 3.07Å; D948-K951 VanDerWaalsContact OD1-CE 3.28Å; D948-K951 WeakPolarHBondContact OD1-CE 3.38Å; D948-K951 IonicContact OD1-NZ 3.16Å; D948-K951 PolarHBondContact OD1-NZ 3.12Å; K951-Y953 PolarHBondContact O-N 3.13Å; K951-Y953 VanDerWaalsContact O-N 3.09Å; K951-F954 PolarHBondContact O-N 3.04Å; K951-E955 PolarHBondContact O-N 3.12Å
952	H	81.7	Confident	83.3	Confident	77 Å²	77	72.4 Å²	72.4	36%	0.356	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-61.7	-18.2	177.5	76.9	-88.3	0	0	0	115.5	R865 E949 L950 F954 Y957	R865-H952 PolarHBondContact NH1-O 3.06Å; R865-H952 VanDerWaalsContact NH1-O 3.08Å; E949-H952 PolarHBondContact O-CE1 2.92Å; E949-H952 PolarHBondContact O-ND1 3.26Å; L950-H952 PolarHBondContact O-N 3.27Å; L950-H952 VanDerWaalsContact O-N 3.1Å; H952-F954 VanDerWaalsContact C-N 3.35Å; H952-Y957 VanDerWaalsContact CA-CE2 3.44Å; H952-Y957 VanDerWaalsContact CA-OH 3.28Å; H952-Y957 WeakPolarHBondContact CA-OH 3.39Å; H952-Y957 HydrophobicContact CB-CD2 4.46Å; H952-Y957 HydrophobicContact CB-CE2 3.42Å; H952-Y957 VanDerWaalsContact CB-CE2 3.43Å; H952-Y957 VanDerWaalsContact CB-OH 3.25Å; H952-Y957 WeakPolarHBondContact CB-OH 3.41Å; H952-Y957 PolarHBondContact N-OH 3.01Å; H952-Y957 VanDerWaalsContact N-OH 3.11Å
953	Y	80.2	Confident	83.8	Confident	58 Å²	58	77 Å²	77	23%	0.227	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-74.2	-29.7	173.1	-77	-88.8	0	0	0	112.2	D797 R865 L950 K951 Y994 P995	D797-Y953 WeakPolarHBondContact CB-O 3.06Å; R865-Y953 VanDerWaalsContact CD-O 3.29Å; R865-Y953 WeakPolarHBondContact CD-O 3.28Å; R865-Y953 PolarHBondContact NH1-O 3.13Å; R865-Y953 VanDerWaalsContact NH1-O 3.09Å; L950-Y953 HydrophobicContact CD2-CD2 4.31Å; L950-Y953 HydrophobicContact CD2-CE2 4.16Å; L950-Y953 WeakPolarHBondContact O-CB 3.28Å; L950-Y953 WeakPolarHBondContact O-CD2 3.35Å; L950-Y953 PolarHBondContact O-N 2.95Å; K951-Y953 PolarHBondContact O-N 3.13Å; K951-Y953 VanDerWaalsContact O-N 3.09Å; Y953-Y994 AromaticContact CE1-CD1 4Å; Y953-Y994 HydrophobicContact CE1-CD1 4.3Å; Y953-Y994 HydrophobicContact CE1-CE1 4.21Å; Y953-P995 HydrophobicContact CD1-CG 3.94Å; Y953-P995 HydrophobicContact CD2-CG 3.66Å; Y953-P995 HydrophobicContact CE1-CG 4.45Å; Y953-P995 HydrophobicContact CE2-CG 4.3Å; Y953-P995 HydrophobicContact CG-CG 3.45Å; Y953-P995 VanDerWaalsContact CG-CG 3.44Å
954	F	84.5	Confident	84.4	Confident	2 Å²	2	79.9 Å²	79.9	1%	0.009	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.9	-24.1	-169.5	-58.6	-78.6	0	0	0	115.2	D797 D864 R865 M943 V946 K951 H952 F987 P995 M997	D797-F954 HydrophobicContact CB-CB 4.41Å; D797-F954 HydrophobicContact CB-CD1 3.88Å; D797-F954 HydrophobicContact CB-CG 4.46Å; D864-F954 CarbonylContact C-O 3.43Å; R865-F954 VanDerWaalsContact CG-O 3.27Å; R865-F954 WeakPolarHBondContact CG-O 3.35Å; M943-F954 HydrophobicContact CE-CB 3.85Å; M943-F954 HydrophobicContact CE-CD2 3.95Å; M943-F954 HydrophobicContact CE-CG 4.07Å; M943-F954 HydrophobicContact SD-CB 3.67Å; M943-F954 VanDerWaalsContact SD-CB 3.57Å; M943-F954 HydrophobicContact SD-CG 4.34Å; V946-F954 HydrophobicContact CG1-CD2 4Å; V946-F954 HydrophobicContact CG1-CE2 4.1Å; V946-F954 HydrophobicContact CG2-CD2 4.39Å; V946-F954 HydrophobicContact CG2-CE2 4.44Å; K951-F954 PolarHBondContact O-N 3.04Å; H952-F954 VanDerWaalsContact C-N 3.35Å; F954-F987 HydrophobicContact CE2-CD2 4.44Å; F954-P995 HydrophobicContact CE2-CB 3.65Å; F954-P995 HydrophobicContact CE2-CG 3.77Å; F954-P995 HydrophobicContact CZ-CB 3.76Å; F954-P995 HydrophobicContact CZ-CG 3.92Å; F954-P995 WeakPolarHBondContact CZ-O 3.3Å; F954-M997 HydrophobicContact CD1-CE 3.64Å; F954-M997 HydrophobicContact CD1-CG 4.4Å; F954-M997 HydrophobicContact CD2-CE 4.12Å; F954-M997 HydrophobicContact CE1-CE 3.7Å; F954-M997 HydrophobicContact CE1-CG 3.76Å; F954-M997 HydrophobicContact CE1-SD 4.32Å; F954-M997 HydrophobicContact CE2-CE 3.96Å; F954-M997 HydrophobicContact CG-CE 3.86Å; F954-M997 HydrophobicContact CZ-CE 3.95Å; F954-M997 HydrophobicContact CZ-CG 4.22Å; F954-M997 HydrophobicContact CZ-SD 4.22Å
955	E	84.3	Confident	84.9	Confident	67.25 Å²	67.25	72.5 Å²	72.5	31%	0.314	34%	0.344	S	S	.	.	B	Isolated β-bridge	trans	-111	149	-178.4	-116.8	-178.4	178.2	0	0	112.2	D864 M943 K951	D864-E955 HydrophobicContact CB-CG 4.48Å; M943-E955 HydrophobicContact CE-CB 3.96Å; M943-E955 HydrophobicContact CE-CG 4.2Å; M943-E955 HydrophobicContact CG-CG 4.4Å; K951-E955 PolarHBondContact O-N 3.12Å
956	E	84.5	Confident	85.5	Confident	20.25 Å²	20.25	71.3 Å²	71.3	10%	0.095	34%	0.338	C	S	.	.			trans	-93.2	116.8	173.1	-165.2	66.1	-110.5	0	0	111.6	D864 R865 D958 K961 R962	D864-E956 WeakPolarHBondContact O-CB 3.37Å; D864-E956 PolarHBondContact O-N 3.15Å; D864-E956 VanDerWaalsContact O-N 3.13Å; R865-E956 IonicContact NE-OE2 3.37Å; R865-E956 IonicContact NH2-OE2 3.65Å; E956-D958 HydrophobicContact CG-CB 4.37Å; E956-K961 VanDerWaalsContact CD-CD 3.49Å; E956-K961 HydrophobicContact CG-CB 3.54Å; E956-K961 VanDerWaalsContact CG-CB 3.46Å; E956-K961 HydrophobicContact CG-CD 4.1Å; E956-K961 HydrophobicContact CG-CG 4.45Å; E956-K961 IonicContact OE1-NZ 2.67Å; E956-R962 PolarHBondContact O-NE 2.92Å; E956-R962 PolarHBondContact O-NH2 3.22Å
957	Y	81.9	Confident	85.9	Confident	141 Å²	141	73.8 Å²	73.8	55%	0.553	36%	0.36	S	S	*	.			trans	-79	-24.3	177.5	-65.4	-76	0	0	0	113.6	H952 N959 R962	H952-Y957 VanDerWaalsContact CA-CE2 3.44Å; H952-Y957 VanDerWaalsContact CA-OH 3.28Å; H952-Y957 WeakPolarHBondContact CA-OH 3.39Å; H952-Y957 HydrophobicContact CB-CD2 4.46Å; H952-Y957 HydrophobicContact CB-CE2 3.42Å; H952-Y957 VanDerWaalsContact CB-CE2 3.43Å; H952-Y957 VanDerWaalsContact CB-OH 3.25Å; H952-Y957 WeakPolarHBondContact CB-OH 3.41Å; H952-Y957 PolarHBondContact N-OH 3.01Å; H952-Y957 VanDerWaalsContact N-OH 3.11Å; Y957-N959 PolarHBondContact O-N 3.07Å; Y957-R962 VanDerWaalsContact C-NH2 3.25Å; Y957-R962 PolarHBondContact O-NH2 2.96Å
958	D	87.3	Confident	86.3	Confident	65.5 Å²	65.5	71.3 Å²	71.3	35%	0.35	34%	0.343	S	S	.	.			trans	-71.9	115.4	179.6	-175.7	-13.4	0	0	0	110.3	E956 E960 K961 R962	E956-D958 HydrophobicContact CG-CB 4.37Å; D958-E960 VanDerWaalsContact C-N 3.26Å; D958-E960 PolarHBondContact O-N 3.1Å; D958-E960 WeakPolarHBondContact OD1-CB 3.34Å; D958-E960 PolarHBondContact OD1-N 3.2Å; D958-K961 HydrophobicContact CB-CB 4.09Å; D958-K961 HydrophobicContact CB-CD 4.02Å; D958-K961 HydrophobicContact CB-CG 4.06Å; D958-K961 PolarHBondContact O-N 3.04Å; D958-K961 WeakPolarHBondContact OD2-CE 3.44Å; D958-K961 WeakPolarHBondContact OD2-CG 3.38Å; D958-R962 WeakPolarHBondContact O-CB 3.45Å; D958-R962 PolarHBondContact O-N 3.27Å
959	N	87.8	Confident	86.7	Confident	100.5 Å²	100.5	66.1 Å²	66.1	54%	0.537	31%	0.314	S	S	.	.	H	α-helix	trans	-58.8	-35.7	179.9	-75.7	-23.1	0	0	0	112.5	Y957 R962 N963	Y957-N959 PolarHBondContact O-N 3.07Å; N959-R962 PolarHBondContact OD1-NH1 3.08Å; N959-R962 PolarHBondContact OD1-NH2 3.43Å; N959-N963 WeakPolarHBondContact O-CB 3.36Å; N959-N963 PolarHBondContact O-N 3.17Å; N959-N963 PolarHBondContact O-ND2 3.14Å
960	E	88	Confident	87	Confident	127.5 Å²	127.5	63 Å²	63	60%	0.596	30%	0.3	S	S	*	.	H	α-helix	trans	-67.8	-47.4	179.6	-118	-171	165.1	0	0	110.6	D958 R962 N963 R964	D958-E960 VanDerWaalsContact C-N 3.26Å; D958-E960 PolarHBondContact O-N 3.1Å; D958-E960 WeakPolarHBondContact OD1-CB 3.34Å; D958-E960 PolarHBondContact OD1-N 3.2Å; E960-R962 VanDerWaalsContact C-N 3.33Å; E960-R962 PolarHBondContact O-N 3.04Å; E960-N963 PolarHBondContact O-N 3.04Å; E960-R964 WeakPolarHBondContact O-CG 3.4Å; E960-R964 PolarHBondContact O-N 2.9Å; E960-R964 IonicContact OE1-CZ 2.87Å; E960-R964 IonicContact OE1-NE 3.36Å; E960-R964 PolarHBondContact OE1-NE 3.25Å; E960-R964 IonicContact OE1-NH2 3.7Å; E960-R964 PolarHBondContact OE1-NH2 2.91Å
961	K	88.7	Confident	87.3	Confident	55 Å²	55	64.2 Å²	64.2	24%	0.239	31%	0.306	C	S	.	.	H	α-helix	trans	-63.8	-38.5	177.3	-67.8	-176.5	-171.4	177.7	0	112.3	Y866 I869 E956 D958 R964 L965	Y866-K961 HydrophobicContact CD1-CB 4.08Å; Y866-K961 HydrophobicContact CD1-CG 4.1Å; Y866-K961 HydrophobicContact CG-CB 4.35Å; I869-K961 HydrophobicContact CD1-CD 4.42Å; I869-K961 HydrophobicContact CD1-CG 4.18Å; E956-K961 VanDerWaalsContact CD-CD 3.49Å; E956-K961 HydrophobicContact CG-CB 3.54Å; E956-K961 VanDerWaalsContact CG-CB 3.46Å; E956-K961 HydrophobicContact CG-CD 4.1Å; E956-K961 HydrophobicContact CG-CG 4.45Å; E956-K961 IonicContact OE1-NZ 2.67Å; D958-K961 HydrophobicContact CB-CB 4.09Å; D958-K961 HydrophobicContact CB-CD 4.02Å; D958-K961 HydrophobicContact CB-CG 4.06Å; D958-K961 PolarHBondContact O-N 3.04Å; D958-K961 WeakPolarHBondContact OD2-CE 3.44Å; D958-K961 WeakPolarHBondContact OD2-CG 3.38Å; K961-R964 PolarHBondContact O-N 3.18Å; K961-L965 WeakPolarHBondContact O-CB 3.36Å; K961-L965 PolarHBondContact O-N 2.89Å
962	R	88.5	Confident	87.5	Confident	92.75 Å²	92.75	61.8 Å²	61.8	35%	0.35	30%	0.296	S	S	.	.	H	α-helix	trans	-63.3	-42.6	175.7	-167.9	175.8	5	109.2	5.7	111.8	E956 Y957 D958 N959 E960 R964 L965 N966	E956-R962 PolarHBondContact O-NE 2.92Å; E956-R962 PolarHBondContact O-NH2 3.22Å; Y957-R962 VanDerWaalsContact C-NH2 3.25Å; Y957-R962 PolarHBondContact O-NH2 2.96Å; D958-R962 WeakPolarHBondContact O-CB 3.45Å; D958-R962 PolarHBondContact O-N 3.27Å; N959-R962 PolarHBondContact OD1-NH1 3.08Å; N959-R962 PolarHBondContact OD1-NH2 3.43Å; E960-R962 VanDerWaalsContact C-N 3.33Å; E960-R962 PolarHBondContact O-N 3.04Å; R962-R964 VanDerWaalsContact C-N 3.33Å; R962-R964 PolarHBondContact O-N 2.72Å; R962-L965 PolarHBondContact O-N 3.18Å; R962-N966 VanDerWaalsContact O-CG 3.29Å; R962-N966 PolarHBondContact O-N 2.94Å; R962-N966 PolarHBondContact O-ND2 3.01Å
963	N	91.1	Very high	87.6	Confident	104 Å²	104	63.6 Å²	63.6	56%	0.556	30%	0.3	S	S	*	.	H	α-helix	trans	-63.7	-40.7	174.8	-71.5	-19.1	0	0	0	111.8	N959 E960 N966 A967	N959-N963 WeakPolarHBondContact O-CB 3.36Å; N959-N963 PolarHBondContact O-N 3.17Å; N959-N963 PolarHBondContact O-ND2 3.14Å; E960-N963 PolarHBondContact O-N 3.04Å; N963-N966 PolarHBondContact O-N 3.02Å; N963-A967 WeakPolarHBondContact O-CB 3.18Å; N963-A967 PolarHBondContact O-N 3.1Å
964	R	90.5	Very high	87.7	Confident	72.5 Å²	72.5	67 Å²	67	27%	0.274	32%	0.322	S	S	.	.	H	α-helix	trans	-65.6	-41.1	174.9	-70.1	-179.9	161.5	-139.2	3.3	112.5	Y866 P892 G893 M894 E960 K961 R962 N966 A967 F968	Y866-R964 HydrophobicContact CD1-CB 4.32Å; Y866-R964 HydrophobicContact CD2-CB 4.22Å; Y866-R964 HydrophobicContact CE1-CB 3.89Å; Y866-R964 HydrophobicContact CE1-CG 4.45Å; Y866-R964 HydrophobicContact CE2-CB 3.74Å; Y866-R964 HydrophobicContact CG-CB 4.43Å; Y866-R964 PolarHBondContact OH-NE 2.89Å; P892-R964 PolarHBondContact O-NH1 2.95Å; P892-R964 PolarHBondContact O-NH2 3.15Å; G893-R964 VanDerWaalsContact C-NH2 3.32Å; G893-R964 VanDerWaalsContact CA-NH1 3.32Å; G893-R964 PolarHBondContact O-NE 3.17Å; G893-R964 PolarHBondContact O-NH1 3.22Å; G893-R964 PolarHBondContact O-NH2 3Å; M894-R964 VanDerWaalsContact CA-NH2 3.33Å; M894-R964 VanDerWaalsContact N-NH2 3.13Å; E960-R964 WeakPolarHBondContact O-CG 3.4Å; E960-R964 PolarHBondContact O-N 2.9Å; E960-R964 IonicContact OE1-CZ 2.87Å; E960-R964 IonicContact OE1-NE 3.36Å; E960-R964 PolarHBondContact OE1-NE 3.25Å; E960-R964 IonicContact OE1-NH2 3.7Å; E960-R964 PolarHBondContact OE1-NH2 2.91Å; K961-R964 PolarHBondContact O-N 3.18Å; R962-R964 VanDerWaalsContact C-N 3.33Å; R962-R964 PolarHBondContact O-N 2.72Å; R964-N966 VanDerWaalsContact C-N 3.32Å; R964-N966 PolarHBondContact O-N 2.99Å; R964-A967 PolarHBondContact O-N 3.12Å; R964-F968 VanDerWaalsContact O-CB 3.32Å; R964-F968 WeakPolarHBondContact O-CB 3.39Å; R964-F968 PolarHBondContact O-N 3.02Å
965	L	91.2	Very high	87.4	Confident	3.25 Å²	3.25	67.8 Å²	67.8	2%	0.017	33%	0.326	C	S	.	.	H	α-helix	trans	-60	-44.1	174.2	178.2	62.6	0	0	0	111.4	D864 Y866 K961 R962 F968 K969	D864-L965 VanDerWaalsContact C-CD2 3.45Å; Y866-L965 HydrophobicContact CD2-CB 3.91Å; Y866-L965 HydrophobicContact CD2-CD1 4.38Å; Y866-L965 HydrophobicContact CG-CB 4.41Å; K961-L965 WeakPolarHBondContact O-CB 3.36Å; K961-L965 PolarHBondContact O-N 2.89Å; R962-L965 PolarHBondContact O-N 3.18Å; L965-F968 PolarHBondContact O-N 3.16Å; L965-K969 HydrophobicContact CD1-CG 4.46Å; L965-K969 HydrophobicContact CG-CD 4.46Å; L965-K969 WeakPolarHBondContact O-CG 3.34Å; L965-K969 PolarHBondContact O-N 3.15Å
966	N	90.2	Very high	86.9	Confident	75.75 Å²	75.75	65.5 Å²	65.5	41%	0.405	32%	0.321	S	S	.	.	H	α-helix	trans	-63.9	-44	176.8	-71.6	-22.4	0	0	0	111.7	R962 N963 R964 F968 K969 E970	R962-N966 VanDerWaalsContact O-CG 3.29Å; R962-N966 PolarHBondContact O-N 2.94Å; R962-N966 PolarHBondContact O-ND2 3.01Å; N963-N966 PolarHBondContact O-N 3.02Å; R964-N966 VanDerWaalsContact C-N 3.32Å; R964-N966 PolarHBondContact O-N 2.99Å; N966-F968 VanDerWaalsContact C-N 3.28Å; N966-F968 PolarHBondContact O-N 3.22Å; N966-K969 PolarHBondContact O-N 2.87Å; N966-E970 WeakPolarHBondContact O-CG 3.27Å; N966-E970 PolarHBondContact O-N 3.06Å
967	A	90.4	Very high	86.6	Confident	57.5 Å²	57.5	65 Å²	65	48%	0.475	32%	0.319	S	S	.	.	H	α-helix	trans	-61.3	-36.7	174	0	0	0	0	0	112.2	N963 R964 E970 L971	N963-A967 WeakPolarHBondContact O-CB 3.18Å; N963-A967 PolarHBondContact O-N 3.1Å; R964-A967 PolarHBondContact O-N 3.12Å; A967-E970 PolarHBondContact O-N 3.17Å; A967-L971 WeakPolarHBondContact O-CB 3.41Å; A967-L971 PolarHBondContact O-N 3.08Å
968	F	91.9	Very high	86.2	Confident	3.5 Å²	3.5	60.3 Å²	60.3	2%	0.015	30%	0.303	C	S	.	.	H	α-helix	trans	-69.7	-43.2	176.2	-176.5	-136.6	0	0	0	112	L860 L862 E898 Y901 R964 L965 N966 E970 L971 I972	L860-F968 HydrophobicContact CD2-CE1 4.13Å; L860-F968 HydrophobicContact CD2-CZ 3.92Å; L862-F968 HydrophobicContact CD1-CD1 4.29Å; L862-F968 HydrophobicContact CD1-CE1 4.13Å; L862-F968 HydrophobicContact CD2-CD1 4.44Å; L862-F968 HydrophobicContact CD2-CE1 4.05Å; E898-F968 HydrophobicContact CB-CD1 4.44Å; E898-F968 HydrophobicContact CB-CD2 4.41Å; E898-F968 HydrophobicContact CB-CE1 4.27Å; E898-F968 HydrophobicContact CB-CE2 4.22Å; E898-F968 HydrophobicContact CB-CZ 4.14Å; E898-F968 HydrophobicContact CG-CD2 3.87Å; E898-F968 HydrophobicContact CG-CE2 3.86Å; E898-F968 HydrophobicContact CG-CG 4.36Å; E898-F968 HydrophobicContact CG-CZ 4.29Å; Y901-F968 AromaticContact CD1-CE2 3.71Å; Y901-F968 HydrophobicContact CD1-CE2 3.71Å; Y901-F968 HydrophobicContact CD1-CZ 4.17Å; Y901-F968 HydrophobicContact CE1-CE2 4.34Å; Y901-F968 AromaticContact CG-CE2 3.96Å; Y901-F968 HydrophobicContact CG-CE2 3.98Å; Y901-F968 AromaticContact CG-CZ 3.94Å; Y901-F968 HydrophobicContact CG-CZ 3.94Å; R964-F968 VanDerWaalsContact O-CB 3.32Å; R964-F968 WeakPolarHBondContact O-CB 3.39Å; R964-F968 PolarHBondContact O-N 3.02Å; L965-F968 PolarHBondContact O-N 3.16Å; N966-F968 VanDerWaalsContact C-N 3.28Å; N966-F968 PolarHBondContact O-N 3.22Å; F968-E970 VanDerWaalsContact C-N 3.29Å; F968-E970 PolarHBondContact O-N 3.22Å; F968-L971 WeakPolarHBondContact O-CB 3.19Å; F968-L971 PolarHBondContact O-N 3.08Å; F968-L971 VanDerWaalsContact O-N 3.15Å; F968-I972 HydrophobicContact CD1-CD1 4.17Å; F968-I972 HydrophobicContact CD2-CD1 4.13Å; F968-I972 HydrophobicContact CD2-CG1 4.28Å; F968-I972 HydrophobicContact CE1-CD1 3.88Å; F968-I972 HydrophobicContact CE2-CD1 3.81Å; F968-I972 HydrophobicContact CE2-CG1 4Å; F968-I972 HydrophobicContact CG-CD1 4.29Å; F968-I972 HydrophobicContact CZ-CD1 3.69Å; F968-I972 HydrophobicContact CZ-CG1 4.33Å; F968-I972 VanDerWaalsContact O-CG1 3.31Å; F968-I972 WeakPolarHBondContact O-CG1 3.41Å; F968-I972 PolarHBondContact O-N 3.19Å
969	K	89.8	Confident	85.4	Confident	12.5 Å²	12.5	59.1 Å²	59.1	5%	0.054	30%	0.298	C	S	.	.	H	α-helix	trans	-58.8	-39.9	172.1	-72.8	179.7	179.6	-179.7	0	111.2	L862 G863 D864 I937 L965 N966 I972 R973	L862-K969 HydrophobicContact CD1-CG 4.39Å; G863-K969 VanDerWaalsContact O-CE 3.26Å; G863-K969 WeakPolarHBondContact O-CE 3.38Å; G863-K969 PolarHBondContact O-NZ 3.09Å; D864-K969 IonicContact OD1-NZ 2.98Å; D864-K969 PolarHBondContact OD1-NZ 3.15Å; I937-K969 HydrophobicContact CD1-CG 4.47Å; L965-K969 HydrophobicContact CD1-CG 4.46Å; L965-K969 HydrophobicContact CG-CD 4.46Å; L965-K969 WeakPolarHBondContact O-CG 3.34Å; L965-K969 PolarHBondContact O-N 3.15Å; N966-K969 PolarHBondContact O-N 2.87Å; K969-I972 PolarHBondContact O-N 3.39Å; K969-R973 WeakPolarHBondContact O-CG 3.41Å; K969-R973 PolarHBondContact O-N 3.23Å; K969-R973 VanDerWaalsContact O-N 3.14Å
970	E	88.4	Confident	84.8	Confident	108.5 Å²	108.5	54.9 Å²	54.9	51%	0.507	28%	0.276	S	S	.	.	H	α-helix	trans	-66.6	-39.9	173.6	-76.3	-156.6	161.7	0	0	113.2	N966 A967 F968 I972 R973 N974	N966-E970 WeakPolarHBondContact O-CG 3.27Å; N966-E970 PolarHBondContact O-N 3.06Å; A967-E970 PolarHBondContact O-N 3.17Å; F968-E970 VanDerWaalsContact C-N 3.29Å; F968-E970 PolarHBondContact O-N 3.22Å; E970-I972 VanDerWaalsContact C-N 3.34Å; E970-I972 PolarHBondContact O-N 3.36Å; E970-R973 WeakPolarHBondContact O-CB 3.24Å; E970-R973 PolarHBondContact O-N 3.25Å; E970-R973 IonicContact OE1-CZ 3.66Å; E970-R973 IonicContact OE1-NH1 3.81Å; E970-R973 PolarHBondContact OE1-NH1 3.31Å; E970-N974 VanDerWaalsContact O-CG 3.26Å; E970-N974 PolarHBondContact O-N 2.94Å; E970-N974 VanDerWaalsContact O-N 3.14Å; E970-N974 PolarHBondContact O-ND2 3.15Å
971	L	88.4	Confident	84.2	Confident	53.75 Å²	53.75	53.2 Å²	53.2	28%	0.281	27%	0.265	S	S	.	.	H	α-helix	trans	-60.2	-46.2	175.7	-175.1	152.7	0	0	0	111.2	Y901 A967 F968 R973 N974 D975	Y901-L971 HydrophobicContact CD1-CD2 4.39Å; Y901-L971 HydrophobicContact CE1-CD2 3.65Å; A967-L971 WeakPolarHBondContact O-CB 3.41Å; A967-L971 PolarHBondContact O-N 3.08Å; F968-L971 WeakPolarHBondContact O-CB 3.19Å; F968-L971 PolarHBondContact O-N 3.08Å; F968-L971 VanDerWaalsContact O-N 3.15Å; L971-R973 VanDerWaalsContact C-N 3.33Å; L971-R973 PolarHBondContact O-N 3.05Å; L971-N974 PolarHBondContact O-N 3.01Å; L971-N974 VanDerWaalsContact O-N 3.13Å; L971-D975 VanDerWaalsContact CD2-OD2 3.31Å; L971-D975 WeakPolarHBondContact CD2-OD2 3.39Å; L971-D975 PolarHBondContact O-N 3.06Å; L971-D975 VanDerWaalsContact O-N 3.1Å
972	I	87.6	Confident	83.7	Confident	0 Å²	0	54 Å²	54	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-63.6	-39	179.2	-66.5	166	0	0	0	111.3	L860 L862 Y901 V935 F968 K969 E970 N974 D975 G976 V977 I978 V979	L860-I972 HydrophobicContact CD2-CD1 3.72Å; L862-I972 HydrophobicContact CD1-CD1 3.43Å; L862-I972 VanDerWaalsContact CD1-CD1 3.45Å; Y901-I972 HydrophobicContact CE1-CG1 4.44Å; Y901-I972 HydrophobicContact CE2-CG1 4.23Å; V935-I972 HydrophobicContact CB-CG2 4.04Å; V935-I972 HydrophobicContact CG1-CD1 4.35Å; V935-I972 HydrophobicContact CG1-CG2 4.06Å; V935-I972 HydrophobicContact CG2-CG2 3.74Å; F968-I972 HydrophobicContact CD1-CD1 4.17Å; F968-I972 HydrophobicContact CD2-CD1 4.13Å; F968-I972 HydrophobicContact CD2-CG1 4.28Å; F968-I972 HydrophobicContact CE1-CD1 3.88Å; F968-I972 HydrophobicContact CE2-CD1 3.81Å; F968-I972 HydrophobicContact CE2-CG1 4Å; F968-I972 HydrophobicContact CG-CD1 4.29Å; F968-I972 HydrophobicContact CZ-CD1 3.69Å; F968-I972 HydrophobicContact CZ-CG1 4.33Å; F968-I972 VanDerWaalsContact O-CG1 3.31Å; F968-I972 WeakPolarHBondContact O-CG1 3.41Å; F968-I972 PolarHBondContact O-N 3.19Å; K969-I972 PolarHBondContact O-N 3.39Å; E970-I972 VanDerWaalsContact C-N 3.34Å; E970-I972 PolarHBondContact O-N 3.36Å; I972-N974 VanDerWaalsContact C-N 3.29Å; I972-N974 PolarHBondContact O-N 3.32Å; I972-D975 PolarHBondContact O-N 3.22Å; I972-G976 PolarHBondContact O-N 3.05Å; I972-V977 HydrophobicContact CG2-CB 4.46Å; I972-V977 HydrophobicContact CG2-CG2 3.66Å; I972-I978 HydrophobicContact CB-CD1 4.47Å; I972-I978 HydrophobicContact CB-CG1 4.39Å; I972-I978 HydrophobicContact CG2-CD1 4.12Å; I972-I978 HydrophobicContact CG2-CG1 3.56Å; I972-V979 HydrophobicContact CG2-CG2 3.65Å
973	R	83.8	Confident	83.7	Confident	115 Å²	115	49.6 Å²	49.6	43%	0.434	26%	0.255	S	S	.	.	H	α-helix	trans	-57	-42.8	173.3	-78.9	172.9	-178	149.2	-3.2	111.6	K969 E970 L971 D975 G976 I978 Y981	K969-R973 WeakPolarHBondContact O-CG 3.41Å; K969-R973 PolarHBondContact O-N 3.23Å; K969-R973 VanDerWaalsContact O-N 3.14Å; E970-R973 WeakPolarHBondContact O-CB 3.24Å; E970-R973 PolarHBondContact O-N 3.25Å; E970-R973 IonicContact OE1-CZ 3.66Å; E970-R973 IonicContact OE1-NH1 3.81Å; E970-R973 PolarHBondContact OE1-NH1 3.31Å; L971-R973 VanDerWaalsContact C-N 3.33Å; L971-R973 PolarHBondContact O-N 3.05Å; R973-D975 PolarHBondContact O-N 2.91Å; R973-G976 PolarHBondContact O-N 3.03Å; R973-G976 VanDerWaalsContact O-N 3.1Å; R973-I978 HydrophobicContact CB-CD1 4.07Å; R973-I978 HydrophobicContact CG-CD1 3.3Å; R973-Y981 WeakPolarHBondContact CA-OH 3.31Å; R973-Y981 HydrophobicContact CG-CE1 3.8Å; R973-Y981 HydrophobicContact CG-CE2 4.49Å; R973-Y981 WeakPolarHBondContact CG-OH 3.3Å; R973-Y981 VanDerWaalsContact NH2-CE2 3.33Å; R973-Y981 PolarHBondContact NH2-OH 3.26Å
974	N	82.4	Confident	83.3	Confident	129.5 Å²	129.5	46.9 Å²	46.9	69%	0.693	25%	0.245	S	C	*	.	H	α-helix	trans	-76.8	-26	-177.4	-66.9	-28.9	0	0	0	113.5	E970 L971 I972 G976	E970-N974 VanDerWaalsContact O-CG 3.26Å; E970-N974 PolarHBondContact O-N 2.94Å; E970-N974 VanDerWaalsContact O-N 3.14Å; E970-N974 PolarHBondContact O-ND2 3.15Å; L971-N974 PolarHBondContact O-N 3.01Å; L971-N974 VanDerWaalsContact O-N 3.13Å; I972-N974 VanDerWaalsContact C-N 3.29Å; I972-N974 PolarHBondContact O-N 3.32Å; N974-G976 VanDerWaalsContact C-N 3.32Å; N974-G976 PolarHBondContact O-N 2.9Å
975	D	79.3	Confident	83	Confident	17.25 Å²	17.25	43.6 Å²	43.6	9%	0.092	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-15.1	179	-96.8	-17.7	0	0	0	112.9	Y901 R905 H926 L971 I972 R973 V977	Y901-D975 WeakPolarHBondContact CE1-OD2 3.07Å; Y901-D975 VanDerWaalsContact OH-CB 3.28Å; Y901-D975 WeakPolarHBondContact OH-CB 3.41Å; Y901-D975 PolarHBondContact OH-OD2 2.99Å; R905-D975 WeakPolarHBondContact CD-OD2 3.32Å; R905-D975 IonicContact CZ-OD1 3.63Å; R905-D975 IonicContact CZ-OD2 3.37Å; R905-D975 VanDerWaalsContact NE-CG 3.29Å; R905-D975 IonicContact NE-OD1 2.85Å; R905-D975 PolarHBondContact NE-OD1 3.05Å; R905-D975 VanDerWaalsContact NE-OD1 3.09Å; R905-D975 IonicContact NE-OD2 3.23Å; R905-D975 PolarHBondContact NE-OD2 3.06Å; R905-D975 IonicContact NH1-OD1 2.69Å; R905-D975 PolarHBondContact NH1-OD1 3.05Å; R905-D975 IonicContact NH1-OD2 2.98Å; R905-D975 PolarHBondContact NH1-OD2 3.41Å; R905-D975 IonicContact NH2-OD1 3.43Å; R905-D975 PolarHBondContact NH2-OD1 3Å; R905-D975 IonicContact NH2-OD2 2.89Å; H926-D975 PolarHBondContact CE1-O 3.01Å; H926-D975 PolarHBondContact ND1-O 3.19Å; H926-D975 VanDerWaalsContact ND1-O 3.1Å; L971-D975 VanDerWaalsContact CD2-OD2 3.31Å; L971-D975 WeakPolarHBondContact CD2-OD2 3.39Å; L971-D975 PolarHBondContact O-N 3.06Å; L971-D975 VanDerWaalsContact O-N 3.1Å; I972-D975 PolarHBondContact O-N 3.22Å; R973-D975 PolarHBondContact O-N 2.91Å; D975-V977 VanDerWaalsContact C-N 3.32Å; D975-V977 HydrophobicContact CB-CG1 4.4Å; D975-V977 HydrophobicContact CB-CG2 3.9Å; D975-V977 PolarHBondContact O-N 3.25Å
976	G	72.5	Confident	82.6	Confident	20.25 Å²	20.25	47.8 Å²	47.8	21%	0.209	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.1	23.2	176.5	0	0	0	0	0	114.4	R930 I972 R973 N974	R930-G976 WeakPolarHBondContact CG-O 3.31Å; R930-G976 PolarHBondContact NE-O 3.14Å; I972-G976 PolarHBondContact O-N 3.05Å; R973-G976 PolarHBondContact O-N 3.03Å; R973-G976 VanDerWaalsContact O-N 3.1Å; N974-G976 VanDerWaalsContact C-N 3.32Å; N974-G976 PolarHBondContact O-N 2.9Å
977	V	78	Confident	82.2	Confident	8.75 Å²	8.75	46.4 Å²	46.4	5%	0.053	24%	0.243	C	C	.	.			trans	-82.3	80.1	179.1	-117.1	0	0	0	0	112	Y901 I929 I933 V935 I972 D975 V979	Y901-V977 HydrophobicContact CE2-CG1 4.31Å; Y901-V977 HydrophobicContact CE2-CG2 4.24Å; Y901-V977 WeakPolarHBondContact OH-CG1 3.31Å; Y901-V977 WeakPolarHBondContact OH-CG2 3.43Å; I929-V977 HydrophobicContact CB-CG1 4.49Å; I929-V977 HydrophobicContact CG2-CB 4.44Å; I929-V977 HydrophobicContact CG2-CG1 3.39Å; I929-V977 VanDerWaalsContact CG2-CG1 3.44Å; I929-V977 HydrophobicContact CG2-CG2 3.67Å; I933-V977 HydrophobicContact CB-CB 4.4Å; I933-V977 HydrophobicContact CB-CG1 3.82Å; I933-V977 VanDerWaalsContact CB-CG1 3.43Å; I933-V977 HydrophobicContact CG2-CB 4.14Å; I933-V977 HydrophobicContact CG2-CG1 3.72Å; I933-V977 HydrophobicContact CG2-CG2 4.3Å; I933-V977 WeakPolarHBondContact O-CG1 3.34Å; V935-V977 HydrophobicContact CG2-CB 4.31Å; V935-V977 HydrophobicContact CG2-CG1 3.94Å; V935-V977 HydrophobicContact CG2-CG2 3.81Å; V935-V977 PolarHBondContact N-O 3.13Å; V935-V977 VanDerWaalsContact N-O 3.1Å; I972-V977 HydrophobicContact CG2-CB 4.46Å; I972-V977 HydrophobicContact CG2-CG2 3.66Å; D975-V977 VanDerWaalsContact C-N 3.32Å; D975-V977 HydrophobicContact CB-CG1 4.4Å; D975-V977 HydrophobicContact CB-CG2 3.9Å; D975-V977 PolarHBondContact O-N 3.25Å; V977-V979 HydrophobicContact CB-CG2 4.2Å; V977-V979 HydrophobicContact CG2-CG2 3.58Å; V977-V979 PolarHBondContact O-N 3.23Å
978	I	73.5	Confident	81.6	Confident	43.25 Å²	43.25	49.2 Å²	49.2	22%	0.222	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	118.4	174.9	-57.7	179.9	0	0	0	108.5	R930 I933 C934 V935 I937 I972 R973 S980 Y981 T1010 L1014	R930-I978 HydrophobicContact CB-CG1 4.47Å; R930-I978 VanDerWaalsContact O-CD1 3.28Å; R930-I978 WeakPolarHBondContact O-CD1 3.37Å; I933-I978 PolarHBondContact O-N 3.09Å; C934-I978 CarbonylContact C-O 3.56Å; C934-I978 VanDerWaalsContact CA-O 3.29Å; C934-I978 WeakPolarHBondContact CA-O 3.46Å; C934-I978 HydrophobicContact CB-CB 4.33Å; V935-I978 PolarHBondContact N-O 3.36Å; I937-I978 HydrophobicContact CD1-CD1 3.85Å; I937-I978 HydrophobicContact CD1-CG1 4.44Å; I972-I978 HydrophobicContact CB-CD1 4.47Å; I972-I978 HydrophobicContact CB-CG1 4.39Å; I972-I978 HydrophobicContact CG2-CD1 4.12Å; I972-I978 HydrophobicContact CG2-CG1 3.56Å; R973-I978 HydrophobicContact CB-CD1 4.07Å; R973-I978 HydrophobicContact CG-CD1 3.3Å; I978-S980 WeakPolarHBondContact CG2-O 3.48Å; I978-Y981 HydrophobicContact CD1-CD2 3.93Å; I978-Y981 HydrophobicContact CD1-CE2 4.28Å; I978-Y981 HydrophobicContact CG2-CD2 4.27Å; I978-T1010 HydrophobicContact CD1-CG2 4.49Å; I978-T1010 HydrophobicContact CG2-CG2 3.76Å; I978-L1014 HydrophobicContact CD1-CD2 3.93Å; I978-L1014 HydrophobicContact CD1-CG 4.36Å
979	V	71.9	Confident	80.9	Confident	41 Å²	41	50.2 Å²	50.2	25%	0.248	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	41.7	179.1	-175.4	0	0	0	0	110.2	C934 V935 F936 I937 I972 V977 Y981 T1010	C934-V979 HydrophobicContact CB-CG2 3.9Å; V935-V979 HydrophobicContact CB-CG1 4.17Å; V935-V979 HydrophobicContact CB-CG2 4.22Å; V935-V979 HydrophobicContact CG1-CG1 4.42Å; V935-V979 HydrophobicContact CG2-CG2 4.49Å; V935-V979 VanDerWaalsContact O-CA 3.31Å; V935-V979 WeakPolarHBondContact O-CA 3.39Å; V935-V979 PolarHBondContact O-N 3.06Å; F936-V979 HydrophobicContact CD1-CB 4.45Å; F936-V979 HydrophobicContact CE1-CB 4.12Å; F936-V979 HydrophobicContact CE1-CG1 3.8Å; F936-V979 HydrophobicContact CZ-CB 4.17Å; F936-V979 HydrophobicContact CZ-CG1 3.95Å; F936-V979 HydrophobicContact CZ-CG2 4.35Å; I937-V979 HydrophobicContact CD1-CG1 4Å; I937-V979 HydrophobicContact CG1-CG1 4.1Å; I972-V979 HydrophobicContact CG2-CG2 3.65Å; V977-V979 HydrophobicContact CB-CG2 4.2Å; V977-V979 HydrophobicContact CG2-CG2 3.58Å; V977-V979 PolarHBondContact O-N 3.23Å; V979-Y981 HydrophobicContact CB-CD2 4.21Å; V979-Y981 HydrophobicContact CB-CE1 4.39Å; V979-Y981 HydrophobicContact CB-CE2 3.53Å; V979-Y981 WeakPolarHBondContact CB-OH 3.09Å; V979-Y981 HydrophobicContact CG1-CD1 3.95Å; V979-Y981 HydrophobicContact CG1-CD2 3.91Å; V979-Y981 HydrophobicContact CG1-CE1 3.52Å; V979-Y981 VanDerWaalsContact CG1-CE1 3.45Å; V979-Y981 HydrophobicContact CG1-CE2 3.48Å; V979-Y981 VanDerWaalsContact CG1-CE2 3.44Å; V979-Y981 HydrophobicContact CG1-CG 4.1Å; V979-Y981 WeakPolarHBondContact CG1-OH 3.33Å; V979-Y981 HydrophobicContact CG2-CE2 4.4Å; V979-Y981 WeakPolarHBondContact CG2-OH 3.33Å; V979-T1010 HydrophobicContact CB-CG2 4.38Å; V979-T1010 HydrophobicContact CG1-CG2 3.67Å; V979-T1010 WeakPolarHBondContact CG1-OG1 3.25Å; V979-T1010 HydrophobicContact CG2-CG2 3.77Å
980	S	74.2	Confident	79.9	Confident	12 Å²	12	54.2 Å²	54.2	8%	0.084	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	115.6	172.9	-123.7	0	0	0	0	109.2	V935 F936 I937 I978 Q1006	V935-S980 PolarHBondContact O-N 3.09Å; F936-S980 VanDerWaalsContact CD1-CB 3.47Å; I937-S980 PolarHBondContact N-O 3.12Å; I937-S980 VanDerWaalsContact N-O 3.11Å; I978-S980 WeakPolarHBondContact CG2-O 3.48Å; S980-Q1006 VanDerWaalsContact CB-OE1 3.28Å; S980-Q1006 PolarHBondContact OG-OE1 3.09Å
981	Y	75	Confident	78.6	Confident	91.25 Å²	91.25	53.8 Å²	53.8	36%	0.358	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	133.2	175.9	-114.4	-88.2	0	0	0	109.9	I937 R973 I978 V979 Y983	I937-Y981 HydrophobicContact CB-CD1 4.37Å; I937-Y981 HydrophobicContact CB-CD2 4.38Å; I937-Y981 HydrophobicContact CD1-CD1 3.84Å; I937-Y981 HydrophobicContact CD1-CD2 4.01Å; I937-Y981 HydrophobicContact CD1-CE1 3.6Å; I937-Y981 HydrophobicContact CD1-CE2 3.98Å; I937-Y981 HydrophobicContact CG1-CD1 4.43Å; I937-Y981 HydrophobicContact CG1-CE1 4.43Å; R973-Y981 WeakPolarHBondContact CA-OH 3.31Å; R973-Y981 HydrophobicContact CG-CE1 3.8Å; R973-Y981 HydrophobicContact CG-CE2 4.49Å; R973-Y981 WeakPolarHBondContact CG-OH 3.3Å; R973-Y981 VanDerWaalsContact NH2-CE2 3.33Å; R973-Y981 PolarHBondContact NH2-OH 3.26Å; I978-Y981 HydrophobicContact CD1-CD2 3.93Å; I978-Y981 HydrophobicContact CD1-CE2 4.28Å; I978-Y981 HydrophobicContact CG2-CD2 4.27Å; V979-Y981 HydrophobicContact CB-CD2 4.21Å; V979-Y981 HydrophobicContact CB-CE1 4.39Å; V979-Y981 HydrophobicContact CB-CE2 3.53Å; V979-Y981 WeakPolarHBondContact CB-OH 3.09Å; V979-Y981 HydrophobicContact CG1-CD1 3.95Å; V979-Y981 HydrophobicContact CG1-CD2 3.91Å; V979-Y981 HydrophobicContact CG1-CE1 3.52Å; V979-Y981 VanDerWaalsContact CG1-CE1 3.45Å; V979-Y981 HydrophobicContact CG1-CE2 3.48Å; V979-Y981 VanDerWaalsContact CG1-CE2 3.44Å; V979-Y981 HydrophobicContact CG1-CG 4.1Å; V979-Y981 WeakPolarHBondContact CG1-OH 3.33Å; V979-Y981 HydrophobicContact CG2-CE2 4.4Å; V979-Y981 WeakPolarHBondContact CG2-OH 3.33Å; Y981-Y983 VanDerWaalsContact C-N 3.32Å; Y981-Y983 PolarHBondContact O-N 3.4Å
982	N	79.2	Confident	77.2	Confident	72.25 Å²	72.25	57.4 Å²	57.4	39%	0.386	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	61.1	46.6	169.3	-57.8	-8.3	0	0	0	114.4	I937 D939 S984	I937-N982 WeakPolarHBondContact O-CA 3.41Å; I937-N982 PolarHBondContact O-N 2.94Å; D939-N982 HydrophobicContact CB-CB 3.9Å; N982-S984 PolarHBondContact O-N 3.2Å
983	Y	87.2	Confident	76	Confident	0 Å²	0	64 Å²	64	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	139.7	165	66.8	-95	0	0	0	109.4	M798 E801 F936 I937 R938 D939 Y981 L1000 F1003	M798-Y983 VanDerWaalsContact CE-OH 3.26Å; M798-Y983 WeakPolarHBondContact CE-OH 3.39Å; E801-Y983 HydrophobicContact CG-CE2 4.41Å; E801-Y983 PolarHBondContact OE1-OH 2.72Å; F936-Y983 HydrophobicContact CB-CD1 4.41Å; F936-Y983 HydrophobicContact CB-CE1 3.93Å; I937-Y983 VanDerWaalsContact C-CE1 3.4Å; I937-Y983 VanDerWaalsContact O-CD1 3.27Å; I937-Y983 WeakPolarHBondContact O-CD1 3.36Å; I937-Y983 WeakPolarHBondContact O-CE1 3.32Å; I937-Y983 PolarHBondContact O-N 3.05Å; R938-Y983 HydrophobicContact CB-CE1 4.19Å; R938-Y983 HydrophobicContact CB-CE2 3.96Å; R938-Y983 HydrophobicContact CG-CD2 4.42Å; R938-Y983 HydrophobicContact CG-CE2 3.98Å; R938-Y983 VanDerWaalsContact N-CE1 3.3Å; D939-Y983 WeakPolarHBondContact CB-O 3.32Å; D939-Y983 PolarHBondContact N-O 3.01Å; Y981-Y983 VanDerWaalsContact C-N 3.32Å; Y981-Y983 PolarHBondContact O-N 3.4Å; Y983-L1000 HydrophobicContact CD2-CD2 4.5Å; Y983-L1000 HydrophobicContact CE2-CD2 4.09Å; Y983-F1003 HydrophobicContact CD1-CB 4.41Å; Y983-F1003 HydrophobicContact CD1-CD2 4.15Å; Y983-F1003 HydrophobicContact CD2-CB 3.64Å; Y983-F1003 HydrophobicContact CD2-CD2 4.42Å; Y983-F1003 HydrophobicContact CD2-CG 4.34Å; Y983-F1003 AromaticContact CE1-CD2 3.85Å; Y983-F1003 HydrophobicContact CE1-CD2 3.85Å; Y983-F1003 HydrophobicContact CE1-CE2 4.44Å; Y983-F1003 HydrophobicContact CE1-CG 4.47Å; Y983-F1003 HydrophobicContact CE2-CB 3.91Å; Y983-F1003 HydrophobicContact CE2-CD2 4.25Å; Y983-F1003 HydrophobicContact CE2-CG 4.16Å; Y983-F1003 HydrophobicContact CG-CB 3.9Å; Y983-F1003 HydrophobicContact CG-CD2 4.35Å; Y983-F1003 AromaticContact CZ-CD2 3.87Å
984	S	83.2	Confident	75.3	Confident	47.75 Å²	47.75	64.2 Å²	64.2	33%	0.334	34%	0.339	S	S	.	.			trans	-76.6	144.2	-179.7	61.9	0	0	0	0	111.8	N982 E1002	N982-S984 PolarHBondContact O-N 3.2Å; S984-E1002 PolarHBondContact N-OE2 3.2Å; S984-E1002 PolarHBondContact OG-OE2 3.14Å; S984-E1002 VanDerWaalsContact OG-OE2 3.12Å
985	A	84.7	Confident	75	Confident	2.75 Å²	2.75	58.2 Å²	58.2	2%	0.023	31%	0.307	C	S	.	.			trans	-140.6	155.2	169.7	0	0	0	0	0	109.5	R938 S942 M997 G998 L1000	R938-A985 HydrophobicContact CG-CB 4.18Å; S942-A985 WeakPolarHBondContact CA-O 3.44Å; S942-A985 WeakPolarHBondContact CB-O 3.4Å; S942-A985 PolarHBondContact OG-N 3.01Å; S942-A985 PolarHBondContact OG-O 3.06Å; A985-M997 HydrophobicContact CB-CB 4.28Å; A985-M997 HydrophobicContact CB-CE 3.78Å; A985-M997 HydrophobicContact CB-CG 4.49Å; A985-G998 WeakPolarHBondContact CA-O 3.33Å; A985-L1000 HydrophobicContact CB-CD2 3.86Å
986	Q	82.7	Confident	74.9	Confident	91.75 Å²	91.75	58.3 Å²	58.3	43%	0.429	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	143.9	179.2	-67.1	-178.6	1.2	0	0	110.8	N988 M997 G998 N999	Q986-N988 PolarHBondContact O-N 3.27Å; Q986-M997 CarbonylContact O-C 3.54Å; Q986-M997 WeakPolarHBondContact O-CA 3.35Å; Q986-G998 PolarHBondContact N-O 3.18Å; Q986-G998 PolarHBondContact O-N 3.02Å; Q986-N999 HydrophobicContact CB-CB 4.26Å; Q986-N999 HydrophobicContact CG-CB 4.25Å
987	F	82.2	Confident	75.4	Confident	46.5 Å²	46.5	57.6 Å²	57.6	20%	0.204	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	123.5	174.7	-179.9	-112.6	0	0	0	110.8	N945 V946 P947 L950 F954 G989 L990 P995	N945-F987 HydrophobicContact CB-CB 4.49Å; N945-F987 WeakPolarHBondContact O-CB 3.43Å; V946-F987 HydrophobicContact CG1-CD2 4.39Å; V946-F987 HydrophobicContact CG2-CB 4.03Å; V946-F987 HydrophobicContact CG2-CD2 4.32Å; V946-F987 HydrophobicContact CG2-CG 4.35Å; P947-F987 HydrophobicContact CG-CD1 4.39Å; P947-F987 HydrophobicContact CG-CE1 3.96Å; P947-F987 HydrophobicContact CG-CZ 4.45Å; L950-F987 HydrophobicContact CD1-CE2 4.19Å; L950-F987 HydrophobicContact CD1-CZ 3.72Å; F954-F987 HydrophobicContact CE2-CD2 4.44Å; F987-G989 VanDerWaalsContact CE2-O 3.31Å; F987-G989 WeakPolarHBondContact CE2-O 3.3Å; F987-G989 VanDerWaalsContact CZ-CA 3.48Å; F987-G989 WeakPolarHBondContact CZ-O 3.21Å; F987-L990 HydrophobicContact CZ-CD1 4.48Å; F987-P995 HydrophobicContact CE2-CB 3.74Å
988	N	77.3	Confident	75.5	Confident	115.75 Å²	115.75	57.7 Å²	57.7	62%	0.619	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.7	22	-174.7	-161.9	29.2	0	0	0	112.8	Q986 V996	Q986-N988 PolarHBondContact O-N 3.27Å; N988-V996 PolarHBondContact N-O 2.97Å
989	G	76.7	Confident	75.8	Confident	23.5 Å²	23.5	59.2 Å²	59.2	24%	0.242	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	91	-158.3	177.4	0	0	0	0	0	114.6	F987 P995 V996	F987-G989 VanDerWaalsContact CE2-O 3.31Å; F987-G989 WeakPolarHBondContact CE2-O 3.3Å; F987-G989 VanDerWaalsContact CZ-CA 3.48Å; F987-G989 WeakPolarHBondContact CZ-O 3.21Å; G989-P995 WeakPolarHBondContact O-CA 3.26Å; G989-V996 WeakPolarHBondContact O-CG2 3.22Å; G989-V996 PolarHBondContact O-N 3.3Å
990	L	70.8	Confident	76.4	Confident	97.25 Å²	97.25	57.9 Å²	57.9	51%	0.509	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	129.1	-176.8	-66.6	144.2	0	0	0	110.5	L950 F987 Y994 P995	L950-L990 HydrophobicContact CD1-CD1 4.06Å; L950-L990 HydrophobicContact CD1-CD2 4.15Å; L950-L990 HydrophobicContact CD1-CG 4.3Å; L950-L990 HydrophobicContact CD2-CD2 4.3Å; F987-L990 HydrophobicContact CZ-CD1 4.48Å; L990-Y994 CarbonylContact C-O 3.57Å; L990-Y994 VanDerWaalsContact CA-O 3.3Å; L990-Y994 WeakPolarHBondContact CA-O 3.38Å; L990-P995 HydrophobicContact CD2-CB 4.14Å
991	I	61	Low	76.6	Confident	100.5 Å²	100.5	61.2 Å²	61.2	52%	0.515	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	117.1	170.6	-58.8	-178.7	0	0	0	107.8	D993 Y994 V996	I991-D993 VanDerWaalsContact C-N 3.29Å; I991-D993 PolarHBondContact O-N 3.38Å; I991-Y994 PolarHBondContact N-O 3.07Å; I991-Y994 PolarHBondContact O-N 3.03Å; I991-Y994 VanDerWaalsContact O-N 3.1Å; I991-V996 HydrophobicContact CB-CG1 4.46Å; I991-V996 HydrophobicContact CB-CG2 4.04Å; I991-V996 HydrophobicContact CD1-CB 4.37Å; I991-V996 HydrophobicContact CD1-CG1 4.32Å; I991-V996 HydrophobicContact CD1-CG2 3.89Å; I991-V996 HydrophobicContact CG1-CB 4.42Å; I991-V996 HydrophobicContact CG1-CG2 3.8Å
992	N	57.4	Low	77.1	Confident	128.5 Å²	128.5	60.5 Å²	60.5	69%	0.687	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	46.6	-174.5	-59	-35	0	0	0	112.9	Y994	N992-Y994 VanDerWaalsContact O-CD2 3.27Å; N992-Y994 WeakPolarHBondContact O-CD2 3.26Å; N992-Y994 PolarHBondContact O-N 3.14Å; N992-Y994 VanDerWaalsContact O-N 3.13Å
993	D	63.9	Low	77.5	Confident	140.25 Å²	140.25	57.1 Å²	57.1	75%	0.75	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.5	7.1	-177.7	-51.9	-41.7	0	0	0	115.9	I991	I991-D993 VanDerWaalsContact C-N 3.29Å; I991-D993 PolarHBondContact O-N 3.38Å
994	Y	68.3	Low	77.4	Confident	118.75 Å²	118.75	57.3 Å²	57.3	47%	0.466	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	132.7	171.8	-73	-84.8	0	0	0	111.4	Y953 L990 I991 N992 V996	Y953-Y994 AromaticContact CE1-CD1 4Å; Y953-Y994 HydrophobicContact CE1-CD1 4.3Å; Y953-Y994 HydrophobicContact CE1-CE1 4.21Å; L990-Y994 CarbonylContact C-O 3.57Å; L990-Y994 VanDerWaalsContact CA-O 3.3Å; L990-Y994 WeakPolarHBondContact CA-O 3.38Å; I991-Y994 PolarHBondContact N-O 3.07Å; I991-Y994 PolarHBondContact O-N 3.03Å; I991-Y994 VanDerWaalsContact O-N 3.1Å; N992-Y994 VanDerWaalsContact O-CD2 3.27Å; N992-Y994 WeakPolarHBondContact O-CD2 3.26Å; N992-Y994 PolarHBondContact O-N 3.14Å; N992-Y994 VanDerWaalsContact O-N 3.13Å; Y994-V996 WeakPolarHBondContact O-CG2 3.26Å
995	P	76.4	Confident	77.3	Confident	3.75 Å²	3.75	57.8 Å²	57.8	2%	0.024	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	135.8	178.1	30.6	-34.1	0	0	0	110.8	H799 L950 Y953 F954 F987 G989 L990	H799-P995 PolarHBondContact CE1-O 3.39Å; H799-P995 PolarHBondContact NE2-O 2.88Å; L950-P995 HydrophobicContact CB-CB 4.5Å; L950-P995 HydrophobicContact CD1-CB 4.35Å; Y953-P995 HydrophobicContact CD1-CG 3.94Å; Y953-P995 HydrophobicContact CD2-CG 3.66Å; Y953-P995 HydrophobicContact CE1-CG 4.45Å; Y953-P995 HydrophobicContact CE2-CG 4.3Å; Y953-P995 HydrophobicContact CG-CG 3.45Å; Y953-P995 VanDerWaalsContact CG-CG 3.44Å; F954-P995 HydrophobicContact CE2-CB 3.65Å; F954-P995 HydrophobicContact CE2-CG 3.77Å; F954-P995 HydrophobicContact CZ-CB 3.76Å; F954-P995 HydrophobicContact CZ-CG 3.92Å; F954-P995 WeakPolarHBondContact CZ-O 3.3Å; F987-P995 HydrophobicContact CE2-CB 3.74Å; G989-P995 WeakPolarHBondContact O-CA 3.26Å; L990-P995 HydrophobicContact CD2-CB 4.14Å
996	V	77.3	Confident	77.4	Confident	19.5 Å²	19.5	60.3 Å²	60.3	12%	0.118	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	141.2	-173.5	-156.7	0	0	0	0	111.3	H799 A800 N988 G989 I991 Y994	H799-V996 WeakPolarHBondContact NE2-CA 3.5Å; A800-V996 HydrophobicContact CB-CB 4.43Å; A800-V996 HydrophobicContact CB-CG1 3.74Å; N988-V996 PolarHBondContact N-O 2.97Å; G989-V996 WeakPolarHBondContact O-CG2 3.22Å; G989-V996 PolarHBondContact O-N 3.3Å; I991-V996 HydrophobicContact CB-CG1 4.46Å; I991-V996 HydrophobicContact CB-CG2 4.04Å; I991-V996 HydrophobicContact CD1-CB 4.37Å; I991-V996 HydrophobicContact CD1-CG1 4.32Å; I991-V996 HydrophobicContact CD1-CG2 3.89Å; I991-V996 HydrophobicContact CG1-CB 4.42Å; I991-V996 HydrophobicContact CG1-CG2 3.8Å; Y994-V996 WeakPolarHBondContact O-CG2 3.26Å
997	M	81.9	Confident	77.7	Confident	5.25 Å²	5.25	56 Å²	56	3%	0.026	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	149.3	170.7	-64.6	-63.3	-155.7	0	0	110.8	A800 M943 V946 F954 A985 Q986	A800-M997 HydrophobicContact CB-CB 4.31Å; A800-M997 WeakPolarHBondContact CB-O 3.28Å; M943-M997 HydrophobicContact CE-CE 3.41Å; M943-M997 VanDerWaalsContact CE-CE 3.41Å; M943-M997 HydrophobicContact SD-CE 3.93Å; V946-M997 HydrophobicContact CG2-CE 3.64Å; V946-M997 HydrophobicContact CG2-SD 4.3Å; F954-M997 HydrophobicContact CD1-CE 3.64Å; F954-M997 HydrophobicContact CD1-CG 4.4Å; F954-M997 HydrophobicContact CD2-CE 4.12Å; F954-M997 HydrophobicContact CE1-CE 3.7Å; F954-M997 HydrophobicContact CE1-CG 3.76Å; F954-M997 HydrophobicContact CE1-SD 4.32Å; F954-M997 HydrophobicContact CE2-CE 3.96Å; F954-M997 HydrophobicContact CG-CE 3.86Å; F954-M997 HydrophobicContact CZ-CE 3.95Å; F954-M997 HydrophobicContact CZ-CG 4.22Å; F954-M997 HydrophobicContact CZ-SD 4.22Å; A985-M997 HydrophobicContact CB-CB 4.28Å; A985-M997 HydrophobicContact CB-CE 3.78Å; A985-M997 HydrophobicContact CB-CG 4.49Å; Q986-M997 CarbonylContact O-C 3.54Å; Q986-M997 WeakPolarHBondContact O-CA 3.35Å
998	G	79.9	Confident	77.8	Confident	10 Å²	10	55.5 Å²	55.5	10%	0.103	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	-168.6	176.6	0	0	0	0	0	111.3	A985 Q986 L1000	A985-G998 WeakPolarHBondContact CA-O 3.33Å; Q986-G998 PolarHBondContact N-O 3.18Å; Q986-G998 PolarHBondContact O-N 3.02Å; G998-L1000 VanDerWaalsContact C-N 3.3Å; G998-L1000 PolarHBondContact O-N 3.43Å
999	N	80.5	Confident	78.1	Confident	75.75 Å²	75.75	52.6 Å²	52.6	41%	0.405	29%	0.289	S	S	.	.			trans	57.2	43.3	-173.9	-159.1	28.8	0	0	0	113.4	Q986 D1001	Q986-N999 HydrophobicContact CB-CB 4.26Å; Q986-N999 HydrophobicContact CG-CB 4.25Å; N999-D1001 VanDerWaalsContact C-N 3.29Å; N999-D1001 PolarHBondContact O-N 2.91Å
1000	L	83.7	Confident	78.6	Confident	13.25 Å²	13.25	52.7 Å²	52.7	7%	0.069	29%	0.285	C	S	.	.			trans	-90.8	22.7	-173.9	-63.4	175	0	0	0	113.2	A800 E801 L804 Y983 A985 G998 E1002 F1003 G1004 L1512	A800-L1000 HydrophobicContact CB-CD1 3.91Å; E801-L1000 HydrophobicContact CB-CD1 4.46Å; E801-L1000 HydrophobicContact CG-CD1 3.96Å; E801-L1000 HydrophobicContact CG-CD2 3.98Å; L804-L1000 HydrophobicContact CD2-CB 3.66Å; L804-L1000 HydrophobicContact CD2-CD1 4.19Å; Y983-L1000 HydrophobicContact CD2-CD2 4.5Å; Y983-L1000 HydrophobicContact CE2-CD2 4.09Å; A985-L1000 HydrophobicContact CB-CD2 3.86Å; G998-L1000 VanDerWaalsContact C-N 3.3Å; G998-L1000 PolarHBondContact O-N 3.43Å; L1000-E1002 VanDerWaalsContact C-N 3.33Å; L1000-E1002 PolarHBondContact O-N 3.1Å; L1000-F1003 HydrophobicContact CB-CB 4.48Å; L1000-F1003 HydrophobicContact CB-CD1 4.41Å; L1000-F1003 WeakPolarHBondContact O-CB 3.32Å; L1000-F1003 PolarHBondContact O-N 3.2Å; L1000-G1004 PolarHBondContact O-N 3.02Å; L1000-L1512 WeakPolarHBondContact O-CD2 3.33Å
1001	D	80.3	Confident	79.4	Confident	81 Å²	81	48.1 Å²	48.1	43%	0.433	26%	0.261	S	S	.	.	H	α-helix	trans	-63.1	-42.4	-175.9	-63.4	-37.8	0	0	0	112.3	N999 G1004 S1005 P1510 L1512	N999-D1001 VanDerWaalsContact C-N 3.29Å; N999-D1001 PolarHBondContact O-N 2.91Å; D1001-G1004 PolarHBondContact O-N 3.02Å; D1001-S1005 WeakPolarHBondContact O-CB 3.38Å; D1001-S1005 PolarHBondContact O-N 3.24Å; D1001-S1005 VanDerWaalsContact O-N 3.08Å; D1001-S1005 PolarHBondContact O-OG 3.23Å; D1001-P1510 WeakPolarHBondContact OD2-CB 3.11Å; D1001-L1512 HydrophobicContact CB-CB 4.19Å; D1001-L1512 HydrophobicContact CB-CD2 4.28Å; D1001-L1512 VanDerWaalsContact OD1-CB 3.3Å; D1001-L1512 WeakPolarHBondContact OD1-CB 3.29Å; D1001-L1512 WeakPolarHBondContact OD1-CD2 3.38Å; D1001-L1512 WeakPolarHBondContact OD1-CG 3.29Å
1002	E	83.5	Confident	80.5	Confident	77.4 Å²	77.4	48.1 Å²	48.1	36%	0.362	26%	0.257	S	S	.	.	H	α-helix	trans	-62.1	-49.5	176.2	-174.9	-176.5	-177.6	0	0	111	S984 L1000 G1004 S1005 Q1006	S984-E1002 PolarHBondContact N-OE2 3.2Å; S984-E1002 PolarHBondContact OG-OE2 3.14Å; S984-E1002 VanDerWaalsContact OG-OE2 3.12Å; L1000-E1002 VanDerWaalsContact C-N 3.33Å; L1000-E1002 PolarHBondContact O-N 3.1Å; E1002-G1004 VanDerWaalsContact C-N 3.33Å; E1002-G1004 PolarHBondContact O-N 3.32Å; E1002-S1005 PolarHBondContact O-N 3.27Å; E1002-S1005 PolarHBondContact O-OG 3.08Å; E1002-Q1006 WeakPolarHBondContact O-CB 3.34Å; E1002-Q1006 VanDerWaalsContact O-CG 3.29Å; E1002-Q1006 WeakPolarHBondContact O-CG 3.4Å; E1002-Q1006 PolarHBondContact O-N 3.11Å; E1002-Q1006 VanDerWaalsContact O-N 3.11Å; E1002-Q1006 PolarHBondContact OE1-NE2 3.3Å; E1002-Q1006 VanDerWaalsContact OE1-NE2 3.12Å
1003	F	88.3	Confident	81.7	Confident	0.2 Å²	0.2	44.4 Å²	44.4	0%	0.001	24%	0.241	C	C	.	.	H	α-helix	trans	-57.1	-48.5	175.9	166.4	-107.9	0	0	0	111.7	E801 L804 L805 L809 L861 F936 Y983 L1000 S1005 Q1006 F1007	E801-F1003 HydrophobicContact CB-CD1 4.46Å; E801-F1003 HydrophobicContact CB-CE1 3.89Å; E801-F1003 HydrophobicContact CB-CZ 4.14Å; E801-F1003 HydrophobicContact CG-CD1 4.42Å; E801-F1003 HydrophobicContact CG-CE1 4.3Å; L804-F1003 HydrophobicContact CD2-CD1 4Å; L804-F1003 HydrophobicContact CD2-CE1 4.33Å; L805-F1003 HydrophobicContact CD1-CE1 4.36Å; L805-F1003 HydrophobicContact CD1-CZ 4.03Å; L805-F1003 HydrophobicContact CD2-CE1 4.13Å; L805-F1003 HydrophobicContact CD2-CZ 3.88Å; L805-F1003 HydrophobicContact CG-CE1 4.06Å; L805-F1003 HydrophobicContact CG-CZ 3.89Å; L809-F1003 HydrophobicContact CD1-CE1 4.32Å; L861-F1003 HydrophobicContact CD1-CZ 4.43Å; L861-F1003 HydrophobicContact CD2-CE2 3.64Å; L861-F1003 HydrophobicContact CD2-CZ 3.74Å; F936-F1003 HydrophobicContact CB-CD2 4.09Å; F936-F1003 HydrophobicContact CB-CE2 3.77Å; F936-F1003 AromaticContact CD1-CD2 3.9Å; F936-F1003 HydrophobicContact CD1-CD2 3.95Å; F936-F1003 AromaticContact CD1-CE2 3.89Å; F936-F1003 HydrophobicContact CD1-CE2 3.92Å; F936-F1003 HydrophobicContact CD2-CE2 4.26Å; F936-F1003 HydrophobicContact CE1-CE2 4.45Å; F936-F1003 AromaticContact CG-CD2 4Å; F936-F1003 HydrophobicContact CG-CD2 4.12Å; F936-F1003 AromaticContact CG-CE2 3.72Å; F936-F1003 HydrophobicContact CG-CE2 3.72Å; Y983-F1003 HydrophobicContact CD1-CB 4.41Å; Y983-F1003 HydrophobicContact CD1-CD2 4.15Å; Y983-F1003 HydrophobicContact CD2-CB 3.64Å; Y983-F1003 HydrophobicContact CD2-CD2 4.42Å; Y983-F1003 HydrophobicContact CD2-CG 4.34Å; Y983-F1003 AromaticContact CE1-CD2 3.85Å; Y983-F1003 HydrophobicContact CE1-CD2 3.85Å; Y983-F1003 HydrophobicContact CE1-CE2 4.44Å; Y983-F1003 HydrophobicContact CE1-CG 4.47Å; Y983-F1003 HydrophobicContact CE2-CB 3.91Å; Y983-F1003 HydrophobicContact CE2-CD2 4.25Å; Y983-F1003 HydrophobicContact CE2-CG 4.16Å; Y983-F1003 HydrophobicContact CG-CB 3.9Å; Y983-F1003 HydrophobicContact CG-CD2 4.35Å; Y983-F1003 AromaticContact CZ-CD2 3.87Å; L1000-F1003 HydrophobicContact CB-CB 4.48Å; L1000-F1003 HydrophobicContact CB-CD1 4.41Å; L1000-F1003 WeakPolarHBondContact O-CB 3.32Å; L1000-F1003 PolarHBondContact O-N 3.2Å; F1003-S1005 VanDerWaalsContact C-N 3.34Å; F1003-S1005 PolarHBondContact O-N 3.09Å; F1003-Q1006 PolarHBondContact O-N 3.24Å; F1003-F1007 VanDerWaalsContact O-CB 3.29Å; F1003-F1007 WeakPolarHBondContact O-CB 3.31Å; F1003-F1007 PolarHBondContact O-N 3.12Å
1004	G	84.4	Confident	82.7	Confident	3 Å²	3	37.7 Å²	37.7	3%	0.031	21%	0.205	C	C	.	.	H	α-helix	trans	-63.6	-41.4	-178.3	0	0	0	0	0	113.1	L1000 D1001 E1002 F1007 L1008	L1000-G1004 PolarHBondContact O-N 3.02Å; D1001-G1004 PolarHBondContact O-N 3.02Å; E1002-G1004 VanDerWaalsContact C-N 3.33Å; E1002-G1004 PolarHBondContact O-N 3.32Å; G1004-F1007 PolarHBondContact O-N 3.25Å; G1004-L1008 WeakPolarHBondContact O-CB 3.25Å; G1004-L1008 WeakPolarHBondContact O-CG 3.38Å; G1004-L1008 PolarHBondContact O-N 3.19Å; G1004-L1008 VanDerWaalsContact O-N 3.13Å
1005	S	82.7	Confident	83.4	Confident	60.2 Å²	60.2	32.1 Å²	32.1	42%	0.421	18%	0.184	S	C	.	.	H	α-helix	trans	-65.1	-45.7	177.5	-17.1	0	0	0	0	112	D1001 E1002 F1003 F1007 L1008 A1009 W1559	D1001-S1005 WeakPolarHBondContact O-CB 3.38Å; D1001-S1005 PolarHBondContact O-N 3.24Å; D1001-S1005 VanDerWaalsContact O-N 3.08Å; D1001-S1005 PolarHBondContact O-OG 3.23Å; E1002-S1005 PolarHBondContact O-N 3.27Å; E1002-S1005 PolarHBondContact O-OG 3.08Å; F1003-S1005 VanDerWaalsContact C-N 3.34Å; F1003-S1005 PolarHBondContact O-N 3.09Å; S1005-F1007 PolarHBondContact O-N 2.77Å; S1005-L1008 PolarHBondContact O-N 3.17Å; S1005-A1009 WeakPolarHBondContact O-CB 3.33Å; S1005-A1009 PolarHBondContact O-N 3.26Å; S1005-A1009 VanDerWaalsContact O-N 3.1Å; S1005-W1559 WeakPolarHBondContact OG-CZ2 3.27Å
1006	Q	86	Confident	83.7	Confident	54.6 Å²	54.6	35 Å²	35	26%	0.255	20%	0.199	S	C	.	.	H	α-helix	trans	-66.1	-39.7	177.9	-70.7	175.8	3.3	0	0	112	F936 S980 E1002 F1003 A1009 T1010	F936-Q1006 HydrophobicContact CE1-CB 4.26Å; S980-Q1006 VanDerWaalsContact CB-OE1 3.28Å; S980-Q1006 PolarHBondContact OG-OE1 3.09Å; E1002-Q1006 WeakPolarHBondContact O-CB 3.34Å; E1002-Q1006 VanDerWaalsContact O-CG 3.29Å; E1002-Q1006 WeakPolarHBondContact O-CG 3.4Å; E1002-Q1006 PolarHBondContact O-N 3.11Å; E1002-Q1006 VanDerWaalsContact O-N 3.11Å; E1002-Q1006 PolarHBondContact OE1-NE2 3.3Å; E1002-Q1006 VanDerWaalsContact OE1-NE2 3.12Å; F1003-Q1006 PolarHBondContact O-N 3.24Å; Q1006-A1009 PolarHBondContact O-N 3.38Å; Q1006-T1010 VanDerWaalsContact O-CB 3.28Å; Q1006-T1010 WeakPolarHBondContact O-CB 3.34Å; Q1006-T1010 PolarHBondContact O-N 3.12Å; Q1006-T1010 PolarHBondContact O-OG1 3.08Å
1007	F	89.5	Confident	83.8	Confident	1.8 Å²	1.8	39.9 Å²	39.9	1%	0.008	22%	0.215	C	C	.	.	H	α-helix	trans	-60.3	-51.7	175.3	175.1	-94.7	0	0	0	111.7	L789 L805 L809 V810 L813 V859 F936 F1003 G1004 S1005 A1009 T1010 V1011	L789-F1007 HydrophobicContact CD1-CZ 4.35Å; L789-F1007 HydrophobicContact CD2-CZ 4.27Å; L805-F1007 HydrophobicContact CD1-CE2 4.33Å; L805-F1007 HydrophobicContact CD2-CB 4.31Å; L805-F1007 HydrophobicContact CD2-CD1 3.41Å; L805-F1007 VanDerWaalsContact CD2-CD1 3.45Å; L805-F1007 HydrophobicContact CD2-CD2 3.39Å; L805-F1007 VanDerWaalsContact CD2-CD2 3.41Å; L805-F1007 HydrophobicContact CD2-CE1 3.4Å; L805-F1007 VanDerWaalsContact CD2-CE1 3.44Å; L805-F1007 HydrophobicContact CD2-CE2 3.39Å; L805-F1007 VanDerWaalsContact CD2-CE2 3.43Å; L805-F1007 HydrophobicContact CD2-CG 3.4Å; L805-F1007 VanDerWaalsContact CD2-CG 3.43Å; L805-F1007 HydrophobicContact CD2-CZ 3.4Å; L805-F1007 VanDerWaalsContact CD2-CZ 3.46Å; L805-F1007 HydrophobicContact CG-CE2 4.5Å; L809-F1007 HydrophobicContact CB-CD1 3.89Å; L809-F1007 HydrophobicContact CB-CE1 3.96Å; L809-F1007 HydrophobicContact CD1-CB 4.43Å; L809-F1007 HydrophobicContact CD1-CD1 3.95Å; L809-F1007 HydrophobicContact CD1-CG 4.37Å; L809-F1007 HydrophobicContact CG-CD1 4.44Å; V810-F1007 HydrophobicContact CG2-CE1 4.14Å; V810-F1007 HydrophobicContact CG2-CZ 4.01Å; L813-F1007 HydrophobicContact CD1-CD1 4.31Å; L813-F1007 HydrophobicContact CD1-CE1 3.54Å; L813-F1007 VanDerWaalsContact CD1-CE1 3.41Å; L813-F1007 HydrophobicContact CD1-CZ 4.15Å; V859-F1007 HydrophobicContact CB-CE2 4.48Å; V859-F1007 HydrophobicContact CG1-CD2 4.42Å; V859-F1007 HydrophobicContact CG1-CE2 3.98Å; V859-F1007 HydrophobicContact CG2-CE2 3.98Å; F936-F1007 HydrophobicContact CD2-CD2 4.46Å; F936-F1007 HydrophobicContact CE1-CB 4.13Å; F936-F1007 AromaticContact CE2-CD2 3.78Å; F936-F1007 HydrophobicContact CE2-CD2 3.78Å; F936-F1007 HydrophobicContact CE2-CE2 4.45Å; F936-F1007 HydrophobicContact CZ-CB 4.03Å; F936-F1007 AromaticContact CZ-CD2 3.86Å; F936-F1007 HydrophobicContact CZ-CD2 3.86Å; F936-F1007 HydrophobicContact CZ-CG 4.42Å; F1003-F1007 VanDerWaalsContact O-CB 3.29Å; F1003-F1007 WeakPolarHBondContact O-CB 3.31Å; F1003-F1007 PolarHBondContact O-N 3.12Å; G1004-F1007 PolarHBondContact O-N 3.25Å; S1005-F1007 PolarHBondContact O-N 2.77Å; F1007-A1009 VanDerWaalsContact C-N 3.34Å; F1007-A1009 PolarHBondContact O-N 3.17Å; F1007-T1010 PolarHBondContact O-N 3.04Å; F1007-V1011 HydrophobicContact CD2-CG2 3.96Å; F1007-V1011 HydrophobicContact CE1-CG2 4.24Å; F1007-V1011 HydrophobicContact CE2-CG2 3.55Å; F1007-V1011 VanDerWaalsContact CE2-CG2 3.47Å; F1007-V1011 HydrophobicContact CG-CG2 4.45Å; F1007-V1011 HydrophobicContact CZ-CB 4.44Å; F1007-V1011 HydrophobicContact CZ-CG2 3.7Å; F1007-V1011 WeakPolarHBondContact O-CB 3.47Å; F1007-V1011 WeakPolarHBondContact O-CG2 3.32Å; F1007-V1011 PolarHBondContact O-N 3.14Å
1008	L	83.9	Confident	83.6	Confident	34.4 Å²	34.4	41.8 Å²	41.8	18%	0.18	23%	0.225	C	C	.	.	H	α-helix	trans	-60.4	-46.7	-179.6	-87.4	173.2	0	0	0	111.6	L809 A812 L813 G1004 S1005 T1010 K1012 I1558 W1559	L809-L1008 HydrophobicContact CB-CD2 4.06Å; L809-L1008 HydrophobicContact CB-CG 4.43Å; L809-L1008 HydrophobicContact CD2-CD1 3.82Å; L809-L1008 HydrophobicContact CD2-CD2 4.24Å; L809-L1008 HydrophobicContact CD2-CG 3.92Å; A812-L1008 HydrophobicContact CB-CD2 4.37Å; L813-L1008 HydrophobicContact CD1-CD2 4Å; L813-L1008 HydrophobicContact CD2-CD2 3.84Å; L813-L1008 HydrophobicContact CG-CD2 3.53Å; L813-L1008 VanDerWaalsContact CG-CD2 3.43Å; G1004-L1008 WeakPolarHBondContact O-CB 3.25Å; G1004-L1008 WeakPolarHBondContact O-CG 3.38Å; G1004-L1008 PolarHBondContact O-N 3.19Å; G1004-L1008 VanDerWaalsContact O-N 3.13Å; S1005-L1008 PolarHBondContact O-N 3.17Å; L1008-T1010 VanDerWaalsContact C-N 3.31Å; L1008-T1010 PolarHBondContact O-N 3.18Å; L1008-K1012 WeakPolarHBondContact O-CB 3.37Å; L1008-K1012 PolarHBondContact O-N 3.01Å; L1008-I1558 HydrophobicContact CB-CG2 3.64Å; L1008-I1558 HydrophobicContact CD1-CG2 4.1Å; L1008-I1558 HydrophobicContact CG-CG2 4.35Å; L1008-W1559 HydrophobicContact CD1-CD2 4.33Å; L1008-W1559 HydrophobicContact CD1-CE3 3.93Å; L1008-W1559 HydrophobicContact CD1-CH2 3.59Å; L1008-W1559 HydrophobicContact CD1-CZ2 3.91Å; L1008-W1559 HydrophobicContact CD1-CZ3 3.43Å; L1008-W1559 VanDerWaalsContact CD1-CZ3 3.5Å; L1008-W1559 HydrophobicContact CG-CH2 4.35Å
1009	A	84.4	Confident	83.4	Confident	55.6 Å²	55.6	43 Å²	43	46%	0.46	23%	0.228	S	C	.	.	H	α-helix	trans	-59.2	-46.1	178.8	0	0	0	0	0	111.8	S1005 Q1006 F1007 S1013 I1558	S1005-A1009 WeakPolarHBondContact O-CB 3.33Å; S1005-A1009 PolarHBondContact O-N 3.26Å; S1005-A1009 VanDerWaalsContact O-N 3.1Å; Q1006-A1009 PolarHBondContact O-N 3.38Å; F1007-A1009 VanDerWaalsContact C-N 3.34Å; F1007-A1009 PolarHBondContact O-N 3.17Å; A1009-S1013 WeakPolarHBondContact O-CB 3.37Å; A1009-S1013 PolarHBondContact O-N 3.18Å; A1009-S1013 VanDerWaalsContact O-N 3.08Å; A1009-I1558 VanDerWaalsContact CA-CD1 3.44Å; A1009-I1558 HydrophobicContact CB-CD1 3.33Å
1010	T	86.7	Confident	82.7	Confident	25.8 Å²	25.8	44.7 Å²	44.7	16%	0.158	23%	0.233	C	C	.	.	H	α-helix	trans	-69.3	-49.6	-176	-56.6	0	0	0	0	111.8	C934 F936 I978 V979 Q1006 F1007 L1008 K1012 S1013 L1014	C934-T1010 HydrophobicContact CB-CG2 3.96Å; C934-T1010 WeakPolarHBondContact SG-CG2 3.43Å; F936-T1010 HydrophobicContact CZ-CG2 4.36Å; I978-T1010 HydrophobicContact CD1-CG2 4.49Å; I978-T1010 HydrophobicContact CG2-CG2 3.76Å; V979-T1010 HydrophobicContact CB-CG2 4.38Å; V979-T1010 HydrophobicContact CG1-CG2 3.67Å; V979-T1010 WeakPolarHBondContact CG1-OG1 3.25Å; V979-T1010 HydrophobicContact CG2-CG2 3.77Å; Q1006-T1010 VanDerWaalsContact O-CB 3.28Å; Q1006-T1010 WeakPolarHBondContact O-CB 3.34Å; Q1006-T1010 PolarHBondContact O-N 3.12Å; Q1006-T1010 PolarHBondContact O-OG1 3.08Å; F1007-T1010 PolarHBondContact O-N 3.04Å; L1008-T1010 VanDerWaalsContact C-N 3.31Å; L1008-T1010 PolarHBondContact O-N 3.18Å; T1010-K1012 VanDerWaalsContact C-N 3.31Å; T1010-K1012 PolarHBondContact O-N 3.15Å; T1010-S1013 WeakPolarHBondContact O-CB 3.41Å; T1010-S1013 PolarHBondContact O-N 3.18Å; T1010-S1013 VanDerWaalsContact O-N 3.15Å; T1010-L1014 HydrophobicContact CG2-CD1 4.24Å; T1010-L1014 WeakPolarHBondContact O-CG 3.3Å; T1010-L1014 PolarHBondContact O-N 3.2Å
1011	V	87.2	Confident	81.1	Confident	1.4 Å²	1.4	48.7 Å²	48.7	1%	0.008	25%	0.254	C	S	.	.	H	α-helix	trans	-68.7	-35.5	-179.1	179.8	0	0	0	0	111.1	L789 L813 I857 F1007 S1013 L1014 L1015	L789-V1011 HydrophobicContact CD1-CG1 4.21Å; L789-V1011 HydrophobicContact CD1-CG2 4.49Å; L813-V1011 HydrophobicContact CD1-CB 3.83Å; L813-V1011 HydrophobicContact CD1-CG1 3.66Å; L813-V1011 HydrophobicContact CD1-CG2 4.49Å; I857-V1011 HydrophobicContact CD1-CG1 4.4Å; F1007-V1011 HydrophobicContact CD2-CG2 3.96Å; F1007-V1011 HydrophobicContact CE1-CG2 4.24Å; F1007-V1011 HydrophobicContact CE2-CG2 3.55Å; F1007-V1011 VanDerWaalsContact CE2-CG2 3.47Å; F1007-V1011 HydrophobicContact CG-CG2 4.45Å; F1007-V1011 HydrophobicContact CZ-CB 4.44Å; F1007-V1011 HydrophobicContact CZ-CG2 3.7Å; F1007-V1011 WeakPolarHBondContact O-CB 3.47Å; F1007-V1011 WeakPolarHBondContact O-CG2 3.32Å; F1007-V1011 PolarHBondContact O-N 3.14Å; V1011-S1013 VanDerWaalsContact C-N 3.34Å; V1011-S1013 PolarHBondContact O-N 3.14Å; V1011-L1014 PolarHBondContact O-N 3.06Å; V1011-L1015 HydrophobicContact CG1-CD1 4.04Å; V1011-L1015 HydrophobicContact CG1-CG 4.28Å; V1011-L1015 WeakPolarHBondContact O-CB 3.3Å; V1011-L1015 VanDerWaalsContact O-CG 3.28Å; V1011-L1015 WeakPolarHBondContact O-CG 3.3Å; V1011-L1015 PolarHBondContact O-N 2.98Å
1012	K	83.8	Confident	79.3	Confident	100 Å²	100	51.6 Å²	51.6	44%	0.435	27%	0.27	S	S	.	.	H	α-helix	trans	-58.5	-48.3	170.9	-179.7	177.2	179.6	-175.5	0	111.2	L813 V817 L1008 T1010 L1014 L1015 L1016	L813-K1012 HydrophobicContact CD2-CB 4.18Å; V817-K1012 HydrophobicContact CG1-CG 4.19Å; V817-K1012 HydrophobicContact CG2-CB 4.17Å; V817-K1012 HydrophobicContact CG2-CD 4Å; V817-K1012 HydrophobicContact CG2-CG 3.74Å; L1008-K1012 WeakPolarHBondContact O-CB 3.37Å; L1008-K1012 PolarHBondContact O-N 3.01Å; T1010-K1012 VanDerWaalsContact C-N 3.31Å; T1010-K1012 PolarHBondContact O-N 3.15Å; K1012-L1014 VanDerWaalsContact C-N 3.31Å; K1012-L1014 PolarHBondContact O-N 3.15Å; K1012-L1015 PolarHBondContact O-N 3.1Å; K1012-L1016 HydrophobicContact CG-CD1 4.15Å; K1012-L1016 WeakPolarHBondContact O-CB 3.13Å; K1012-L1016 VanDerWaalsContact O-CG 3.31Å; K1012-L1016 WeakPolarHBondContact O-CG 3.37Å; K1012-L1016 PolarHBondContact O-N 3Å; K1012-L1016 VanDerWaalsContact O-N 3.08Å
1013	S	83.5	Confident	77.2	Confident	50 Å²	50	54.4 Å²	54.4	35%	0.35	29%	0.287	S	S	.	.	H	α-helix	trans	-59.9	-40.7	176.3	173.4	0	0	0	0	112.5	A1009 T1010 V1011 L1016 R1017	A1009-S1013 WeakPolarHBondContact O-CB 3.37Å; A1009-S1013 PolarHBondContact O-N 3.18Å; A1009-S1013 VanDerWaalsContact O-N 3.08Å; T1010-S1013 WeakPolarHBondContact O-CB 3.41Å; T1010-S1013 PolarHBondContact O-N 3.18Å; T1010-S1013 VanDerWaalsContact O-N 3.15Å; V1011-S1013 VanDerWaalsContact C-N 3.34Å; V1011-S1013 PolarHBondContact O-N 3.14Å; S1013-L1016 PolarHBondContact O-N 3.42Å; S1013-R1017 WeakPolarHBondContact O-CB 3.48Å; S1013-R1017 WeakPolarHBondContact O-CG 3.35Å; S1013-R1017 PolarHBondContact O-N 3.05Å; S1013-R1017 PolarHBondContact O-NE 3.05Å; S1013-R1017 PolarHBondContact OG-NE 3.06Å; S1013-R1017 PolarHBondContact OG-NH2 3.01Å; S1013-R1017 VanDerWaalsContact OG-NH2 3.1Å
1014	L	85.4	Confident	74.7	Confident	0.4 Å²	0.4	60.9 Å²	60.9	0%	0.002	32%	0.322	C	S	.	.	H	α-helix	trans	-65.8	-45.2	176.7	-73.1	173.6	0	0	0	112.5	I857 R930 L931 C934 I978 T1010 V1011 K1012 L1016 R1017 L1018	I857-L1014 HydrophobicContact CD1-CB 4.11Å; I857-L1014 HydrophobicContact CG2-CD1 4.14Å; R930-L1014 WeakPolarHBondContact O-CD2 3.39Å; L931-L1014 VanDerWaalsContact C-CD2 3.43Å; L931-L1014 HydrophobicContact CD2-CD2 4.21Å; L931-L1014 VanDerWaalsContact O-CD2 3.29Å; L931-L1014 WeakPolarHBondContact O-CD2 3.21Å; C934-L1014 HydrophobicContact CB-CD1 4.16Å; C934-L1014 WeakPolarHBondContact SG-CD1 3.35Å; I978-L1014 HydrophobicContact CD1-CD2 3.93Å; I978-L1014 HydrophobicContact CD1-CG 4.36Å; T1010-L1014 HydrophobicContact CG2-CD1 4.24Å; T1010-L1014 WeakPolarHBondContact O-CG 3.3Å; T1010-L1014 PolarHBondContact O-N 3.2Å; V1011-L1014 PolarHBondContact O-N 3.06Å; K1012-L1014 VanDerWaalsContact C-N 3.31Å; K1012-L1014 PolarHBondContact O-N 3.15Å; L1014-L1016 VanDerWaalsContact C-N 3.31Å; L1014-L1016 PolarHBondContact O-N 3.29Å; L1014-R1017 VanDerWaalsContact CD2-NH2 3.3Å; L1014-R1017 PolarHBondContact O-N 3.06Å; L1014-L1018 WeakPolarHBondContact O-CB 3.34Å; L1014-L1018 VanDerWaalsContact O-CG 3.27Å; L1014-L1018 WeakPolarHBondContact O-CG 3.39Å; L1014-L1018 PolarHBondContact O-N 3.09Å
1015	L	83	Confident	72.1	Confident	0.8 Å²	0.8	67.9 Å²	67.9	0%	0.004	36%	0.358	C	S	.	.	H	α-helix	trans	-61.7	-42.7	177.8	-73.1	169.9	0	0	0	111.4	C787 V817 L821 L825 I857 V1011 K1012 R1017 L1018 F1019	C787-L1015 HydrophobicContact CB-CD2 4.21Å; C787-L1015 VanDerWaalsContact SG-CD2 3.55Å; V817-L1015 HydrophobicContact CB-CD1 4.32Å; V817-L1015 HydrophobicContact CG1-CB 4.24Å; V817-L1015 HydrophobicContact CG1-CD1 4.12Å; V817-L1015 HydrophobicContact CG1-CD2 4.47Å; V817-L1015 HydrophobicContact CG2-CB 4.4Å; V817-L1015 HydrophobicContact CG2-CD1 3.43Å; V817-L1015 VanDerWaalsContact CG2-CD1 3.49Å; V817-L1015 HydrophobicContact CG2-CG 4.41Å; L821-L1015 HydrophobicContact CD1-CB 4.17Å; L821-L1015 WeakPolarHBondContact CD1-O 3.2Å; L825-L1015 HydrophobicContact CD1-CD1 3.84Å; L825-L1015 HydrophobicContact CD1-CD2 4.12Å; L825-L1015 HydrophobicContact CD1-CG 4.44Å; L825-L1015 HydrophobicContact CD2-CD1 4.17Å; I857-L1015 HydrophobicContact CD1-CD2 3.84Å; I857-L1015 HydrophobicContact CD1-CG 4.11Å; V1011-L1015 HydrophobicContact CG1-CD1 4.04Å; V1011-L1015 HydrophobicContact CG1-CG 4.28Å; V1011-L1015 WeakPolarHBondContact O-CB 3.3Å; V1011-L1015 VanDerWaalsContact O-CG 3.28Å; V1011-L1015 WeakPolarHBondContact O-CG 3.3Å; V1011-L1015 PolarHBondContact O-N 2.98Å; K1012-L1015 PolarHBondContact O-N 3.1Å; L1015-R1017 PolarHBondContact O-N 3.46Å; L1015-L1018 PolarHBondContact O-N 3.19Å; L1015-F1019 HydrophobicContact CD2-CD2 4.06Å; L1015-F1019 HydrophobicContact CD2-CE2 3.93Å; L1015-F1019 WeakPolarHBondContact O-CB 3.41Å; L1015-F1019 WeakPolarHBondContact O-CD2 3.39Å; L1015-F1019 PolarHBondContact O-N 3.21Å; L1015-F1019 VanDerWaalsContact O-N 3.08Å
1016	L	81.2	Confident	69.5	Low	65.4 Å²	65.4	69.7 Å²	69.7	34%	0.342	37%	0.367	S	S	.	.	H	α-helix	trans	-58.9	-51.9	173.4	-71.1	167.5	0	0	0	110.3	L821 K1012 S1013 L1014 L1018 F1019 H1020	L821-L1016 HydrophobicContact CD1-CD2 4.05Å; L821-L1016 HydrophobicContact CD1-CG 4.46Å; L821-L1016 HydrophobicContact CD2-CD2 4.01Å; L821-L1016 HydrophobicContact CG-CD2 4.36Å; K1012-L1016 HydrophobicContact CG-CD1 4.15Å; K1012-L1016 WeakPolarHBondContact O-CB 3.13Å; K1012-L1016 VanDerWaalsContact O-CG 3.31Å; K1012-L1016 WeakPolarHBondContact O-CG 3.37Å; K1012-L1016 PolarHBondContact O-N 3Å; K1012-L1016 VanDerWaalsContact O-N 3.08Å; S1013-L1016 PolarHBondContact O-N 3.42Å; L1014-L1016 VanDerWaalsContact C-N 3.31Å; L1014-L1016 PolarHBondContact O-N 3.29Å; L1016-L1018 VanDerWaalsContact C-N 3.32Å; L1016-L1018 PolarHBondContact O-N 3.15Å; L1016-F1019 PolarHBondContact O-N 2.95Å; L1016-H1020 VanDerWaalsContact O-CA 3.31Å; L1016-H1020 WeakPolarHBondContact O-CA 3.47Å; L1016-H1020 WeakPolarHBondContact O-CB 3.34Å; L1016-H1020 PolarHBondContact O-N 3.09Å
1017	R	80.3	Confident	66.7	Low	121.6 Å²	121.6	72.7 Å²	72.7	46%	0.459	39%	0.391	S	S	.	.	H	α-helix	trans	-64.8	-34	-179.3	-73.5	-177	-73.4	152.3	-5	114.6	L931 S1013 L1014 L1015	L931-R1017 HydrophobicContact CD2-CB 3.72Å; L931-R1017 HydrophobicContact CD2-CG 4.41Å; L931-R1017 VanDerWaalsContact CD2-NH1 3.32Å; S1013-R1017 WeakPolarHBondContact O-CB 3.48Å; S1013-R1017 WeakPolarHBondContact O-CG 3.35Å; S1013-R1017 PolarHBondContact O-N 3.05Å; S1013-R1017 PolarHBondContact O-NE 3.05Å; S1013-R1017 PolarHBondContact OG-NE 3.06Å; S1013-R1017 PolarHBondContact OG-NH2 3.01Å; S1013-R1017 VanDerWaalsContact OG-NH2 3.1Å; L1014-R1017 VanDerWaalsContact CD2-NH2 3.3Å; L1014-R1017 PolarHBondContact O-N 3.06Å; L1015-R1017 PolarHBondContact O-N 3.46Å
1018	L	77.9	Confident	63.8	Low	44.6 Å²	44.6	79.7 Å²	79.7	23%	0.234	43%	0.427	C	S	.	.	H	α-helix	trans	-77.9	-30.8	-179.4	-75.3	173.9	0	0	0	113.2	I857 L931 R932 L1014 L1015 L1016	I857-L1018 HydrophobicContact CD1-CD1 3.99Å; I857-L1018 HydrophobicContact CG1-CD1 3.72Å; L931-L1018 HydrophobicContact CB-CD2 4.2Å; L931-L1018 WeakPolarHBondContact O-CD1 3.43Å; L931-L1018 WeakPolarHBondContact O-CG 3.26Å; R932-L1018 HydrophobicContact CG-CD2 4.47Å; L1014-L1018 WeakPolarHBondContact O-CB 3.34Å; L1014-L1018 VanDerWaalsContact O-CG 3.27Å; L1014-L1018 WeakPolarHBondContact O-CG 3.39Å; L1014-L1018 PolarHBondContact O-N 3.09Å; L1015-L1018 PolarHBondContact O-N 3.19Å; L1016-L1018 VanDerWaalsContact C-N 3.32Å; L1016-L1018 PolarHBondContact O-N 3.15Å
1019	F	74.3	Confident	61.1	Low	36.6 Å²	36.6	87.8 Å²	87.8	16%	0.161	46%	0.457	C	S	.	.	H	α-helix	trans	-124.9	-5.2	-168.1	-60.8	-71.4	0	0	0	115.2	K785 C787 L821 V823 L1015 L1016 N1021	K785-F1019 HydrophobicContact CB-CD1 4.12Å; K785-F1019 HydrophobicContact CB-CE1 4.13Å; K785-F1019 HydrophobicContact CD-CD1 3.59Å; K785-F1019 HydrophobicContact CD-CE1 4.21Å; K785-F1019 HydrophobicContact CG-CD1 4.43Å; K785-F1019 PolarHBondContact NZ-O 3.24Å; C787-F1019 HydrophobicContact CB-CE2 3.57Å; C787-F1019 HydrophobicContact CB-CZ 3.6Å; L821-F1019 HydrophobicContact CB-CB 4.49Å; L821-F1019 HydrophobicContact CD1-CB 4.1Å; V823-F1019 HydrophobicContact CG1-CD2 4.16Å; V823-F1019 HydrophobicContact CG1-CE1 4.46Å; V823-F1019 HydrophobicContact CG1-CE2 4.01Å; V823-F1019 HydrophobicContact CG1-CG 4.42Å; V823-F1019 HydrophobicContact CG1-CZ 4.21Å; V823-F1019 HydrophobicContact CG2-CB 3.69Å; V823-F1019 HydrophobicContact CG2-CD1 3.95Å; V823-F1019 HydrophobicContact CG2-CD2 3.8Å; V823-F1019 HydrophobicContact CG2-CE1 4.47Å; V823-F1019 HydrophobicContact CG2-CE2 4.42Å; V823-F1019 HydrophobicContact CG2-CG 3.53Å; V823-F1019 VanDerWaalsContact CG2-CG 3.41Å; L1015-F1019 HydrophobicContact CD2-CD2 4.06Å; L1015-F1019 HydrophobicContact CD2-CE2 3.93Å; L1015-F1019 WeakPolarHBondContact O-CB 3.41Å; L1015-F1019 WeakPolarHBondContact O-CD2 3.39Å; L1015-F1019 PolarHBondContact O-N 3.21Å; L1015-F1019 VanDerWaalsContact O-N 3.08Å; L1016-F1019 PolarHBondContact O-N 2.95Å; F1019-N1021 PolarHBondContact O-N 3.19Å
1020	H	66.1	Low	58.4	Low	110.4 Å²	110.4	91.7 Å²	91.7	51%	0.511	47%	0.47	S	S	.	.			trans	-63.1	124.7	172.1	-149.3	-49.5	0	0	0	109	L1016 D1022	L1016-H1020 VanDerWaalsContact O-CA 3.31Å; L1016-H1020 WeakPolarHBondContact O-CA 3.47Å; L1016-H1020 WeakPolarHBondContact O-CB 3.34Å; L1016-H1020 PolarHBondContact O-N 3.09Å; H1020-D1022 PolarHBondContact O-N 3.08Å
1021	N	51.1	Low	55.5	Low	98 Å²	98	97.1 Å²	97.1	52%	0.524	50%	0.498	S	S	.	.			trans	-86.5	118.2	174.3	-73.4	-24.1	0	0	0	108.3	K785 F1019 N1023	K785-N1021 PolarHBondContact NZ-OD1 3.02Å; K785-N1021 VanDerWaalsContact NZ-OD1 3.07Å; F1019-N1021 PolarHBondContact O-N 3.19Å; N1021-N1023 HydrophobicContact CB-CB 4.4Å; N1021-N1023 PolarHBondContact O-N 3.11Å; N1021-N1023 VanDerWaalsContact O-N 3.1Å
1022	D	42.7	Very low	52.7	Low	142.2 Å²	142.2	104 Å²	104	76%	0.76	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	4.7	169.6	-76.5	-28	0	0	0	113.2	H1020 D1024 N1025	H1020-D1022 PolarHBondContact O-N 3.08Å; D1022-D1024 VanDerWaalsContact C-N 3.27Å; D1022-D1024 PolarHBondContact O-N 3.02Å; D1022-D1024 VanDerWaalsContact O-N 3.13Å; D1022-N1025 PolarHBondContact O-N 2.98Å
1023	N	39.1	Very low	50	Low	135.6 Å²	135.6	107.7 Å²	107.7	73%	0.725	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	5.1	-175.7	-84.6	-6.7	0	0	0	115.1	N1021 N1025 T1026	N1021-N1023 HydrophobicContact CB-CB 4.4Å; N1021-N1023 PolarHBondContact O-N 3.11Å; N1021-N1023 VanDerWaalsContact O-N 3.1Å; N1023-N1025 PolarHBondContact O-N 2.87Å; N1023-T1026 PolarHBondContact O-N 3.32Å; N1023-T1026 PolarHBondContact O-OG1 3.17Å; N1023-T1026 PolarHBondContact OD1-OG1 3.29Å
1024	D	35.7	Very low	47.4	Very low	136.2 Å²	136.2	111.9 Å²	111.9	73%	0.728	57%	0.572	S	S	*	*			trans	-90.1	32.6	171.9	-72.3	-24.1	0	0	0	112.2	D1022 T1026	D1022-D1024 VanDerWaalsContact C-N 3.27Å; D1022-D1024 PolarHBondContact O-N 3.02Å; D1022-D1024 VanDerWaalsContact O-N 3.13Å; D1024-T1026 PolarHBondContact O-N 3.28Å
1025	N	29.9	Very low	44.5	Very low	149.6 Å²	149.6	118.7 Å²	118.7	80%	0.8	61%	0.607	S	S	*	*			trans	-90.2	42.2	169.7	-84	-26.7	0	0	0	113.1	D1022 N1023 P1027	D1022-N1025 PolarHBondContact O-N 2.98Å; N1023-N1025 PolarHBondContact O-N 2.87Å; N1025-P1027 WeakPolarHBondContact O-CD 3.17Å
1026	T	27.8	Very low	41.7	Very low	97.8 Å²	97.8	123.4 Å²	123.4	60%	0.6	64%	0.638	S	S	*	*			trans	-111.8	112.6	158.5	50.8	0	0	0	0	109.6	N1023 D1024 I1028	N1023-T1026 PolarHBondContact O-N 3.32Å; N1023-T1026 PolarHBondContact O-OG1 3.17Å; N1023-T1026 PolarHBondContact OD1-OG1 3.29Å; D1024-T1026 PolarHBondContact O-N 3.28Å; T1026-I1028 VanDerWaalsContact C-N 3.27Å; T1026-I1028 PolarHBondContact O-N 3.31Å
1027	P	27	Very low	39.1	Very low	117.8 Å²	117.8	126.4 Å²	126.4	77%	0.765	66%	0.659	S	S	*	*			trans	-75.6	105.3	-179.6	29.7	-30.5	0	0	0	109.3	N1025 Y1029	N1025-P1027 WeakPolarHBondContact O-CD 3.17Å; P1027-Y1029 VanDerWaalsContact C-N 3.29Å; P1027-Y1029 WeakPolarHBondContact O-CD2 3.47Å; P1027-Y1029 PolarHBondContact O-N 2.99Å; P1027-Y1029 VanDerWaalsContact O-N 3.15Å
1028	I	29.3	Very low	36.5	Very low	149 Å²	149	125.8 Å²	125.8	76%	0.764	67%	0.669	S	S	*	*			trans	-93.5	88	166	-56.9	175.5	0	0	0	107.3	T1026 N1030	T1026-I1028 VanDerWaalsContact C-N 3.27Å; T1026-I1028 PolarHBondContact O-N 3.31Å; I1028-N1030 HydrophobicContact CG2-CB 4.11Å; I1028-N1030 PolarHBondContact O-N 3.32Å
1029	Y	27	Very low	34.1	Very low	205.6 Å²	205.6	127.3 Å²	127.3	81%	0.806	69%	0.687	S	S	*	*			trans	-73.1	98.6	158.6	-87.9	-86.5	0	0	0	110.7	P1027 N1031	P1027-Y1029 VanDerWaalsContact C-N 3.29Å; P1027-Y1029 WeakPolarHBondContact O-CD2 3.47Å; P1027-Y1029 PolarHBondContact O-N 2.99Å; P1027-Y1029 VanDerWaalsContact O-N 3.15Å; Y1029-N1031 VanDerWaalsContact C-N 3.26Å; Y1029-N1031 PolarHBondContact O-N 3.4Å
1030	N	26.6	Very low	31.9	Very low	136.6 Å²	136.6	132.6 Å²	132.6	73%	0.73	72%	0.718	S	S	*	*			trans	-158.7	105.5	141	-81.3	-20.3	0	0	0	110.2	I1028 D1032	I1028-N1030 HydrophobicContact CG2-CB 4.11Å; I1028-N1030 PolarHBondContact O-N 3.32Å; N1030-D1032 PolarHBondContact O-N 3.1Å
1031	N	27.6	Very low	30.3	Very low	140.4 Å²	140.4	135.7 Å²	135.7	75%	0.751	73%	0.73	S	S	*	*			trans	40	78.4	151	-70.2	-14.7	0	0	0	114.9	Y1029 N1034	Y1029-N1031 VanDerWaalsContact C-N 3.26Å; Y1029-N1031 PolarHBondContact O-N 3.4Å; N1031-N1034 PolarHBondContact O-ND2 3.39Å
1032	D	28.6	Very low	29.7	Very low	146.4 Å²	146.4	134.9 Å²	134.9	78%	0.783	73%	0.731	S	S	*	*			trans	-162.6	98.3	138.8	-89.3	-20.5	0	0	0	110.3	N1030 N1034 L1035	N1030-D1032 PolarHBondContact O-N 3.1Å; D1032-N1034 VanDerWaalsContact C-N 3.26Å; D1032-N1034 CarbonylContact O-C 3.6Å; D1032-N1034 PolarHBondContact O-N 3.21Å; D1032-L1035 PolarHBondContact O-N 2.75Å; D1032-L1035 VanDerWaalsContact O-N 3.12Å
1033	H	26.8	Very low	29.7	Very low	176.8 Å²	176.8	132.1 Å²	132.1	82%	0.819	72%	0.716	S	S	*	*			trans	-49.6	74.5	167.3	-73.5	-70.3	0	0	0	113.8	L1035	H1033-L1035 PolarHBondContact O-N 3.2Å
1034	N	27.9	Very low	30.6	Very low	138.2 Å²	138.2	129.7 Å²	129.7	74%	0.739	70%	0.703	S	S	*	*			trans	-145.4	92	151.7	-71.6	-32.8	0	0	0	111.2	N1031 D1032 P1036	N1031-N1034 PolarHBondContact O-ND2 3.39Å; D1032-N1034 VanDerWaalsContact C-N 3.26Å; D1032-N1034 CarbonylContact O-C 3.6Å; D1032-N1034 PolarHBondContact O-N 3.21Å; N1034-P1036 VanDerWaalsContact C-N 3.33Å; N1034-P1036 WeakPolarHBondContact O-CD 3.32Å
1035	L	24.3	Very low	31.9	Very low	143.2 Å²	143.2	124.9 Å²	124.9	75%	0.75	68%	0.679	S	S	*	*			trans	-59.1	115.3	159.1	-102	119.2	0	0	0	109.9	D1032 H1033 V1037	D1032-L1035 PolarHBondContact O-N 2.75Å; D1032-L1035 VanDerWaalsContact O-N 3.12Å; H1033-L1035 PolarHBondContact O-N 3.2Å; L1035-V1037 VanDerWaalsContact C-N 3.26Å; L1035-V1037 HydrophobicContact CD2-CG2 3.9Å; L1035-V1037 PolarHBondContact O-N 3.16Å; L1035-V1037 VanDerWaalsContact O-N 3.13Å
1036	P	24.5	Very low	33.6	Very low	98.6 Å²	98.6	120.7 Å²	120.7	64%	0.64	66%	0.656	S	S	*	*			trans	-89.8	110.2	160.3	22.7	-14.3	0	0	0	109.9	N1034 T1038 L1043	N1034-P1036 VanDerWaalsContact C-N 3.33Å; N1034-P1036 WeakPolarHBondContact O-CD 3.32Å; P1036-T1038 WeakPolarHBondContact CB-OG1 2.98Å; P1036-T1038 PolarHBondContact O-N 3.09Å; P1036-T1038 PolarHBondContact O-OG1 2.84Å; P1036-L1043 HydrophobicContact CB-CD1 4.33Å; P1036-L1043 HydrophobicContact CG-CD1 4.24Å
1037	V	26.7	Very low	35.4	Very low	129 Å²	129	120.8 Å²	120.8	78%	0.782	65%	0.65	S	S	*	*			trans	-65.6	92	162	179.4	0	0	0	0	107.7	L1035 A1039	L1035-V1037 VanDerWaalsContact C-N 3.26Å; L1035-V1037 HydrophobicContact CD2-CG2 3.9Å; L1035-V1037 PolarHBondContact O-N 3.16Å; L1035-V1037 VanDerWaalsContact O-N 3.13Å; V1037-A1039 PolarHBondContact O-N 3.27Å
1038	T	26	Very low	37.4	Very low	109.6 Å²	109.6	116.8 Å²	116.8	67%	0.672	62%	0.62	S	S	*	*			trans	-93.7	108.8	175.1	51.2	0	0	0	0	111.7	P1036 N1040	P1036-T1038 WeakPolarHBondContact CB-OG1 2.98Å; P1036-T1038 PolarHBondContact O-N 3.09Å; P1036-T1038 PolarHBondContact O-OG1 2.84Å; T1038-N1040 VanDerWaalsContact C-N 3.33Å; T1038-N1040 PolarHBondContact O-N 2.92Å
1039	A	28.1	Very low	39.6	Very low	75.8 Å²	75.8	109.8 Å²	109.8	63%	0.626	58%	0.584	S	S	*	*	S	Bend	trans	-16.3	29.1	169	0	0	0	0	0	116.7	V1037	V1037-A1039 PolarHBondContact O-N 3.27Å
1040	N	27.7	Very low	41.5	Very low	148.6 Å²	148.6	105.6 Å²	105.6	80%	0.795	57%	0.567	S	S	*	*			trans	-152	20.8	174.2	-73.1	-15.2	0	0	0	117.7	T1038 S1042 L1043	T1038-N1040 VanDerWaalsContact C-N 3.33Å; T1038-N1040 PolarHBondContact O-N 2.92Å; N1040-S1042 PolarHBondContact O-N 3.13Å; N1040-L1043 HydrophobicContact CB-CB 4.43Å; N1040-L1043 PolarHBondContact O-N 3.18Å
1041	K	32.6	Very low	43.3	Very low	175 Å²	175	102.9 Å²	102.9	76%	0.761	55%	0.55	S	S	*	.	S	Bend	trans	-91.6	95.1	164.5	-78.9	-176	178.2	178.4	0	110.3	L1043 T1045	K1041-L1043 PolarHBondContact O-N 3.22Å; K1041-L1043 VanDerWaalsContact O-N 3.13Å; K1041-T1045 PolarHBondContact O-OG1 3.13Å
1042	S	38.3	Very low	45.2	Very low	80.4 Å²	80.4	98.6 Å²	98.6	56%	0.562	52%	0.524	S	S	*	.			trans	-52.2	97.7	170.7	53.4	0	0	0	0	110.8	N1040 N1044 T1045 I1046	N1040-S1042 PolarHBondContact O-N 3.13Å; S1042-N1044 PolarHBondContact O-N 3.13Å; S1042-N1044 VanDerWaalsContact O-N 3.14Å; S1042-T1045 PolarHBondContact O-N 2.93Å; S1042-I1046 WeakPolarHBondContact O-CG1 3.49Å
1043	L	42.3	Very low	47.5	Very low	84.6 Å²	84.6	91.7 Å²	91.7	44%	0.443	49%	0.486	S	S	.	.			trans	-55.6	120	177.7	-127.6	94.6	0	0	0	109.1	P1036 N1040 K1041 T1045 I1046 F1048	P1036-L1043 HydrophobicContact CB-CD1 4.33Å; P1036-L1043 HydrophobicContact CG-CD1 4.24Å; N1040-L1043 HydrophobicContact CB-CB 4.43Å; N1040-L1043 PolarHBondContact O-N 3.18Å; K1041-L1043 PolarHBondContact O-N 3.22Å; K1041-L1043 VanDerWaalsContact O-N 3.13Å; L1043-T1045 PolarHBondContact O-N 2.94Å; L1043-T1045 VanDerWaalsContact O-N 3.15Å; L1043-I1046 WeakPolarHBondContact O-CB 3.34Å; L1043-I1046 PolarHBondContact O-N 3.24Å; L1043-F1048 HydrophobicContact CD2-CB 3.95Å; L1043-F1048 HydrophobicContact CD2-CD2 4.22Å
1044	N	57.3	Low	49.9	Very low	85.4 Å²	85.4	86.4 Å²	86.4	46%	0.457	46%	0.46	S	S	.	.			trans	-64.3	113.3	177.8	-152.3	-10.9	0	0	0	108.3	S1042 I1046 E1047 F1048	S1042-N1044 PolarHBondContact O-N 3.13Å; S1042-N1044 VanDerWaalsContact O-N 3.14Å; N1044-I1046 PolarHBondContact O-N 3.23Å; N1044-I1046 PolarHBondContact OD1-N 2.99Å; N1044-E1047 HydrophobicContact CB-CB 4.32Å; N1044-E1047 HydrophobicContact CB-CG 4.26Å; N1044-E1047 PolarHBondContact ND2-OE1 2.77Å; N1044-E1047 WeakPolarHBondContact O-CA 3.48Å; N1044-E1047 WeakPolarHBondContact O-CB 3.41Å; N1044-E1047 PolarHBondContact O-N 3.13Å; N1044-F1048 HydrophobicContact CB-CD2 4.39Å; N1044-F1048 HydrophobicContact CB-CE2 3.91Å; N1044-F1048 WeakPolarHBondContact O-CD2 3.18Å; N1044-F1048 WeakPolarHBondContact O-CG 3.09Å; N1044-F1048 PolarHBondContact O-N 3.08Å
1045	T	62.8	Low	51.9	Low	35 Å²	35	81.8 Å²	81.8	22%	0.215	44%	0.438	C	S	.	.	H	α-helix	trans	-52.1	-31.7	-178.1	-48.7	0	0	0	0	112.2	K1041 S1042 L1043 F1048 L1049 I1190 L1201	K1041-T1045 PolarHBondContact O-OG1 3.13Å; S1042-T1045 PolarHBondContact O-N 2.93Å; L1043-T1045 PolarHBondContact O-N 2.94Å; L1043-T1045 VanDerWaalsContact O-N 3.15Å; T1045-F1048 PolarHBondContact O-N 3.38Å; T1045-L1049 HydrophobicContact CG2-CD1 4.13Å; T1045-L1049 HydrophobicContact CG2-CG 4.34Å; T1045-L1049 WeakPolarHBondContact O-CB 3.26Å; T1045-L1049 WeakPolarHBondContact O-CD1 3.23Å; T1045-L1049 VanDerWaalsContact O-CG 3.23Å; T1045-L1049 WeakPolarHBondContact O-CG 3.36Å; T1045-L1049 PolarHBondContact O-N 3.27Å; T1045-L1049 VanDerWaalsContact O-N 3.11Å; T1045-I1190 HydrophobicContact CG2-CG2 4.42Å; T1045-L1201 HydrophobicContact CG2-CD1 4.35Å
1046	I	66.5	Low	54.3	Low	61 Å²	61	75.4 Å²	75.4	31%	0.313	41%	0.406	S	S	.	.	H	α-helix	trans	-65.7	-41.8	178.2	-61.2	171.3	0	0	0	111.9	F780 S1042 L1043 N1044 F1048 L1049 R1050 I1137	F780-I1046 HydrophobicContact CE1-CG2 3.84Å; F780-I1046 HydrophobicContact CZ-CG2 3.99Å; S1042-I1046 WeakPolarHBondContact O-CG1 3.49Å; L1043-I1046 WeakPolarHBondContact O-CB 3.34Å; L1043-I1046 PolarHBondContact O-N 3.24Å; N1044-I1046 PolarHBondContact O-N 3.23Å; N1044-I1046 PolarHBondContact OD1-N 2.99Å; I1046-F1048 PolarHBondContact O-N 3.07Å; I1046-L1049 PolarHBondContact O-N 3.16Å; I1046-L1049 VanDerWaalsContact O-N 3.14Å; I1046-R1050 HydrophobicContact CG2-CG 4.23Å; I1046-R1050 WeakPolarHBondContact O-CB 3.2Å; I1046-R1050 VanDerWaalsContact O-CG 3.3Å; I1046-R1050 WeakPolarHBondContact O-CG 3.27Å; I1046-R1050 PolarHBondContact O-N 3.25Å; I1046-I1137 HydrophobicContact CD1-CD1 3.62Å; I1046-I1137 HydrophobicContact CD1-CG2 4.03Å; I1046-I1137 HydrophobicContact CG1-CD1 3.65Å; I1046-I1137 HydrophobicContact CG1-CG2 4.22Å
1047	E	64.6	Low	56.9	Low	100.6 Å²	100.6	70.7 Å²	70.7	47%	0.47	38%	0.376	S	S	.	.	H	α-helix	trans	-65.8	-46.2	178.9	-84.8	174.8	-178.8	0	0	110.7	N1044 L1049 R1050 E1051	N1044-E1047 HydrophobicContact CB-CB 4.32Å; N1044-E1047 HydrophobicContact CB-CG 4.26Å; N1044-E1047 PolarHBondContact ND2-OE1 2.77Å; N1044-E1047 WeakPolarHBondContact O-CA 3.48Å; N1044-E1047 WeakPolarHBondContact O-CB 3.41Å; N1044-E1047 PolarHBondContact O-N 3.13Å; E1047-L1049 VanDerWaalsContact C-N 3.27Å; E1047-L1049 PolarHBondContact O-N 3.36Å; E1047-R1050 WeakPolarHBondContact O-CB 3.49Å; E1047-R1050 PolarHBondContact O-N 2.95Å; E1047-R1050 VanDerWaalsContact O-N 3.11Å; E1047-E1051 VanDerWaalsContact O-CB 3.25Å; E1047-E1051 WeakPolarHBondContact O-CB 3.42Å; E1047-E1051 VanDerWaalsContact O-CG 3.28Å; E1047-E1051 WeakPolarHBondContact O-CG 3.33Å; E1047-E1051 PolarHBondContact O-N 3.14Å
1048	F	69.8	Low	59.3	Low	33.6 Å²	33.6	67.2 Å²	67.2	15%	0.147	36%	0.357	C	S	.	.	H	α-helix	trans	-55.2	-45.8	173.8	-174	-88.5	0	0	0	112.2	L1043 N1044 T1045 I1046 R1050 E1051 Y1052 V1053 I1190 T1199 L1201 W1559	L1043-F1048 HydrophobicContact CD2-CB 3.95Å; L1043-F1048 HydrophobicContact CD2-CD2 4.22Å; N1044-F1048 HydrophobicContact CB-CD2 4.39Å; N1044-F1048 HydrophobicContact CB-CE2 3.91Å; N1044-F1048 WeakPolarHBondContact O-CD2 3.18Å; N1044-F1048 WeakPolarHBondContact O-CG 3.09Å; N1044-F1048 PolarHBondContact O-N 3.08Å; T1045-F1048 PolarHBondContact O-N 3.38Å; I1046-F1048 PolarHBondContact O-N 3.07Å; F1048-R1050 VanDerWaalsContact C-N 3.28Å; F1048-R1050 PolarHBondContact O-N 3.15Å; F1048-E1051 PolarHBondContact O-N 3.25Å; F1048-Y1052 AromaticContact CD2-CD2 3.53Å; F1048-Y1052 HydrophobicContact CD2-CD2 3.53Å; F1048-Y1052 VanDerWaalsContact CD2-CD2 3.46Å; F1048-Y1052 AromaticContact CD2-CE2 3.98Å; F1048-Y1052 HydrophobicContact CD2-CE2 4.08Å; F1048-Y1052 HydrophobicContact CD2-CG 4.31Å; F1048-Y1052 AromaticContact CE2-CD2 3.77Å; F1048-Y1052 HydrophobicContact CE2-CD2 3.77Å; F1048-Y1052 HydrophobicContact CE2-CE2 4.38Å; F1048-Y1052 HydrophobicContact CE2-CG 4.12Å; F1048-Y1052 HydrophobicContact CG-CD2 4.3Å; F1048-Y1052 WeakPolarHBondContact O-CB 3.32Å; F1048-Y1052 WeakPolarHBondContact O-CD2 3.46Å; F1048-Y1052 PolarHBondContact O-N 3.25Å; F1048-V1053 HydrophobicContact CD1-CG2 4.37Å; F1048-V1053 HydrophobicContact CE1-CG2 4.15Å; F1048-V1053 HydrophobicContact CZ-CG2 4.49Å; F1048-I1190 HydrophobicContact CD1-CG2 4.4Å; F1048-I1190 HydrophobicContact CE1-CG2 3.96Å; F1048-T1199 HydrophobicContact CB-CG2 3.68Å; F1048-L1201 HydrophobicContact CE2-CD1 3.79Å; F1048-L1201 HydrophobicContact CE2-CD2 4.24Å; F1048-L1201 HydrophobicContact CZ-CD1 4.09Å; F1048-L1201 HydrophobicContact CZ-CD2 4.11Å; F1048-W1559 HydrophobicContact CD2-CE3 4.45Å; F1048-W1559 HydrophobicContact CD2-CH2 4.34Å; F1048-W1559 HydrophobicContact CD2-CZ3 4.12Å; F1048-W1559 HydrophobicContact CE1-CH2 4.32Å; F1048-W1559 HydrophobicContact CE1-CZ3 4.31Å; F1048-W1559 AromaticContact CE2-CE3 3.83Å; F1048-W1559 HydrophobicContact CE2-CE3 3.83Å; F1048-W1559 AromaticContact CE2-CH2 3.97Å; F1048-W1559 HydrophobicContact CE2-CH2 3.97Å; F1048-W1559 AromaticContact CE2-CZ3 3.4Å; F1048-W1559 HydrophobicContact CE2-CZ3 3.4Å; F1048-W1559 HydrophobicContact CZ-CE3 4.36Å; F1048-W1559 AromaticContact CZ-CH2 3.97Å; F1048-W1559 HydrophobicContact CZ-CH2 3.97Å; F1048-W1559 AromaticContact CZ-CZ3 3.52Å; F1048-W1559 HydrophobicContact CZ-CZ3 3.52Å
1049	L	75.1	Confident	61.7	Low	1.8 Å²	1.8	65.1 Å²	65.1	1%	0.009	35%	0.35	C	S	.	.	I	π-helix	trans	-67.5	-36.9	179.6	-68.8	174	0	0	0	112.3	T1045 I1046 E1047 Y1052 V1053 Y1054 T1133 I1134 I1137 I1190 F1192 L1196	T1045-L1049 HydrophobicContact CG2-CD1 4.13Å; T1045-L1049 HydrophobicContact CG2-CG 4.34Å; T1045-L1049 WeakPolarHBondContact O-CB 3.26Å; T1045-L1049 WeakPolarHBondContact O-CD1 3.23Å; T1045-L1049 VanDerWaalsContact O-CG 3.23Å; T1045-L1049 WeakPolarHBondContact O-CG 3.36Å; T1045-L1049 PolarHBondContact O-N 3.27Å; T1045-L1049 VanDerWaalsContact O-N 3.11Å; I1046-L1049 PolarHBondContact O-N 3.16Å; I1046-L1049 VanDerWaalsContact O-N 3.14Å; E1047-L1049 VanDerWaalsContact C-N 3.27Å; E1047-L1049 PolarHBondContact O-N 3.36Å; L1049-Y1052 PolarHBondContact O-N 3.31Å; L1049-V1053 HydrophobicContact CD2-CB 3.98Å; L1049-V1053 HydrophobicContact CD2-CG1 4.34Å; L1049-V1053 HydrophobicContact CD2-CG2 3.6Å; L1049-V1053 CarbonylContact O-C 3.36Å; L1049-V1053 WeakPolarHBondContact O-CA 3.36Å; L1049-V1053 VanDerWaalsContact O-CB 3.27Å; L1049-V1053 WeakPolarHBondContact O-CB 3.38Å; L1049-V1053 WeakPolarHBondContact O-CG2 3.46Å; L1049-V1053 PolarHBondContact O-N 3.05Å; L1049-V1053 VanDerWaalsContact O-N 3.09Å; L1049-Y1054 PolarHBondContact O-N 3.19Å; L1049-T1133 HydrophobicContact CD1-CG2 4.08Å; L1049-T1133 HydrophobicContact CD2-CG2 3.6Å; L1049-T1133 HydrophobicContact CG-CG2 4.43Å; L1049-I1134 HydrophobicContact CB-CD1 4.32Å; L1049-I1134 HydrophobicContact CB-CG1 4.29Å; L1049-I1137 HydrophobicContact CB-CD1 4.37Å; L1049-I1137 HydrophobicContact CD1-CD1 3.09Å; L1049-I1137 HydrophobicContact CD1-CG1 4.49Å; L1049-I1137 HydrophobicContact CG-CD1 4.42Å; L1049-I1190 HydrophobicContact CD1-CD1 4.47Å; L1049-I1190 HydrophobicContact CD2-CG2 3.81Å; L1049-F1192 HydrophobicContact CD2-CE2 4.15Å; L1049-F1192 HydrophobicContact CD2-CZ 3.87Å; L1049-L1196 HydrophobicContact CD2-CD1 4.07Å
1050	R	68.3	Low	64.3	Low	118 Å²	118	61.9 Å²	61.9	45%	0.445	32%	0.322	S	S	.	.	I	π-helix	trans	-66.3	-41	176	-92.2	179.6	161.3	-179.1	0.5	112.1	F780 R781 I1046 E1047 F1048 Y1052 V1053 Y1054 I1134 E1138 S1144	F780-R1050 HydrophobicContact CD1-CB 3.93Å; F780-R1050 HydrophobicContact CD1-CG 4.04Å; F780-R1050 HydrophobicContact CE1-CB 4.23Å; R781-R1050 PolarHBondContact O-NE 3.33Å; R781-R1050 PolarHBondContact O-NH2 3.22Å; I1046-R1050 HydrophobicContact CG2-CG 4.23Å; I1046-R1050 WeakPolarHBondContact O-CB 3.2Å; I1046-R1050 VanDerWaalsContact O-CG 3.3Å; I1046-R1050 WeakPolarHBondContact O-CG 3.27Å; I1046-R1050 PolarHBondContact O-N 3.25Å; E1047-R1050 WeakPolarHBondContact O-CB 3.49Å; E1047-R1050 PolarHBondContact O-N 2.95Å; E1047-R1050 VanDerWaalsContact O-N 3.11Å; F1048-R1050 VanDerWaalsContact C-N 3.28Å; F1048-R1050 PolarHBondContact O-N 3.15Å; R1050-Y1052 VanDerWaalsContact C-N 3.3Å; R1050-Y1052 PolarHBondContact O-N 3.28Å; R1050-V1053 PolarHBondContact O-N 3.12Å; R1050-Y1054 HydrophobicContact CB-CD2 3.99Å; R1050-Y1054 HydrophobicContact CB-CE2 3.93Å; R1050-Y1054 HydrophobicContact CG-CE2 4.22Å; R1050-Y1054 PolarHBondContact NH2-OH 3.43Å; R1050-Y1054 WeakPolarHBondContact O-CB 3.23Å; R1050-Y1054 WeakPolarHBondContact O-CD2 3.32Å; R1050-Y1054 PolarHBondContact O-N 3.09Å; R1050-I1134 HydrophobicContact CG-CD1 3.93Å; R1050-I1134 HydrophobicContact CG-CG2 4.47Å; R1050-E1138 IonicContact CZ-OE1 3.51Å; R1050-E1138 VanDerWaalsContact CZ-OE1 3.27Å; R1050-E1138 IonicContact NE-OE1 3.31Å; R1050-E1138 PolarHBondContact NE-OE1 3.21Å; R1050-E1138 IonicContact NH2-OE1 3.42Å; R1050-E1138 PolarHBondContact NH2-OE1 3.21Å; R1050-S1144 PolarHBondContact NH2-OG 2.75Å
1051	E	62.7	Low	66.8	Low	78.6 Å²	78.6	55.5 Å²	55.5	37%	0.367	29%	0.292	S	S	.	.	I	π-helix	trans	-74	-45.6	-177.9	-84.7	-159	161.8	0	0	112.3	W784 R822 E1047 F1048 R1532	W784-E1051 PolarHBondContact NE1-O 2.95Å; R822-E1051 IonicContact CZ-OE1 2.55Å; R822-E1051 IonicContact CZ-OE2 2.68Å; R822-E1051 IonicContact NH1-OE1 2.82Å; R822-E1051 PolarHBondContact NH1-OE1 3.49Å; R822-E1051 IonicContact NH1-OE2 3.84Å; R822-E1051 IonicContact NH2-OE1 2.82Å; R822-E1051 PolarHBondContact NH2-OE1 2.75Å; R822-E1051 IonicContact NH2-OE2 3.61Å; R822-E1051 PolarHBondContact NH2-OE2 3.36Å; E1047-E1051 VanDerWaalsContact O-CB 3.25Å; E1047-E1051 WeakPolarHBondContact O-CB 3.42Å; E1047-E1051 VanDerWaalsContact O-CG 3.28Å; E1047-E1051 WeakPolarHBondContact O-CG 3.33Å; E1047-E1051 PolarHBondContact O-N 3.14Å; F1048-E1051 PolarHBondContact O-N 3.25Å; E1051-R1532 IonicContact OE1-CZ 3.71Å; E1051-R1532 IonicContact OE1-NH1 2.82Å; E1051-R1532 IonicContact OE1-NH2 3.99Å; E1051-R1532 PolarHBondContact OE1-NH2 3.44Å
1052	Y	68.5	Low	69.2	Low	51.2 Å²	51.2	50.5 Å²	50.5	20%	0.201	28%	0.277	C	S	.	.	I	π-helix	trans	-95.2	-40.7	-173	-76.7	-89.4	0	0	0	113.3	F1048 L1049 R1050 S1055 T1126 T1127 L1196 I1198 T1199 L1201 L1561	F1048-Y1052 AromaticContact CD2-CD2 3.53Å; F1048-Y1052 HydrophobicContact CD2-CD2 3.53Å; F1048-Y1052 VanDerWaalsContact CD2-CD2 3.46Å; F1048-Y1052 AromaticContact CD2-CE2 3.98Å; F1048-Y1052 HydrophobicContact CD2-CE2 4.08Å; F1048-Y1052 HydrophobicContact CD2-CG 4.31Å; F1048-Y1052 AromaticContact CE2-CD2 3.77Å; F1048-Y1052 HydrophobicContact CE2-CD2 3.77Å; F1048-Y1052 HydrophobicContact CE2-CE2 4.38Å; F1048-Y1052 HydrophobicContact CE2-CG 4.12Å; F1048-Y1052 HydrophobicContact CG-CD2 4.3Å; F1048-Y1052 WeakPolarHBondContact O-CB 3.32Å; F1048-Y1052 WeakPolarHBondContact O-CD2 3.46Å; F1048-Y1052 PolarHBondContact O-N 3.25Å; L1049-Y1052 PolarHBondContact O-N 3.31Å; R1050-Y1052 VanDerWaalsContact C-N 3.3Å; R1050-Y1052 PolarHBondContact O-N 3.28Å; Y1052-S1055 PolarHBondContact O-OG 3.23Å; Y1052-T1126 HydrophobicContact CE1-CG2 4.15Å; Y1052-T1127 PolarHBondContact OH-OG1 3.18Å; Y1052-L1196 HydrophobicContact CD1-CD2 4.02Å; Y1052-L1196 HydrophobicContact CD2-CD2 4.2Å; Y1052-L1196 HydrophobicContact CE1-CD2 3.82Å; Y1052-L1196 HydrophobicContact CE2-CD2 4.03Å; Y1052-L1196 HydrophobicContact CG-CD2 4.19Å; Y1052-L1196 WeakPolarHBondContact O-CD1 3.23Å; Y1052-I1198 HydrophobicContact CD2-CG2 3.75Å; Y1052-I1198 HydrophobicContact CE2-CG2 4.41Å; Y1052-I1198 HydrophobicContact CG-CG2 4.32Å; Y1052-T1199 VanDerWaalsContact O-CG2 3.24Å; Y1052-T1199 WeakPolarHBondContact O-CG2 3.28Å; Y1052-T1199 PolarHBondContact O-OG1 3.39Å; Y1052-T1199 VanDerWaalsContact O-OG1 3.04Å; Y1052-L1201 HydrophobicContact CD1-CB 4.1Å; Y1052-L1201 HydrophobicContact CD1-CD1 4.13Å; Y1052-L1201 HydrophobicContact CE1-CD1 4.28Å; Y1052-L1201 HydrophobicContact CG-CD1 4.34Å; Y1052-L1561 HydrophobicContact CE1-CD2 3.67Å
1053	V	77.3	Confident	71.4	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.264	C	S	.	.	I	π-helix	trans	-89.3	-34.3	-169.8	179.7	0	0	0	0	112.6	F1048 L1049 R1050 S1055 A1056 A1057 S1130 A1131 T1133 I1134 W1141 F1192 L1196	F1048-V1053 HydrophobicContact CD1-CG2 4.37Å; F1048-V1053 HydrophobicContact CE1-CG2 4.15Å; F1048-V1053 HydrophobicContact CZ-CG2 4.49Å; L1049-V1053 HydrophobicContact CD2-CB 3.98Å; L1049-V1053 HydrophobicContact CD2-CG1 4.34Å; L1049-V1053 HydrophobicContact CD2-CG2 3.6Å; L1049-V1053 CarbonylContact O-C 3.36Å; L1049-V1053 WeakPolarHBondContact O-CA 3.36Å; L1049-V1053 VanDerWaalsContact O-CB 3.27Å; L1049-V1053 WeakPolarHBondContact O-CB 3.38Å; L1049-V1053 WeakPolarHBondContact O-CG2 3.46Å; L1049-V1053 PolarHBondContact O-N 3.05Å; L1049-V1053 VanDerWaalsContact O-N 3.09Å; R1050-V1053 PolarHBondContact O-N 3.12Å; V1053-S1055 VanDerWaalsContact C-N 3.32Å; V1053-S1055 PolarHBondContact O-N 3.18Å; V1053-A1056 CarbonylContact O-C 3.58Å; V1053-A1056 PolarHBondContact O-N 3.19Å; V1053-A1056 VanDerWaalsContact O-N 3.14Å; V1053-A1057 HydrophobicContact CG1-CB 3.74Å; V1053-A1057 PolarHBondContact O-N 3.14Å; V1053-S1130 VanDerWaalsContact CG1-CB 3.49Å; V1053-S1130 VanDerWaalsContact CG2-CB 3.48Å; V1053-A1131 HydrophobicContact CG1-CB 3.74Å; V1053-A1131 HydrophobicContact CG2-CB 4.15Å; V1053-T1133 HydrophobicContact CG1-CG2 4.46Å; V1053-I1134 HydrophobicContact CB-CD1 4.18Å; V1053-I1134 HydrophobicContact CG1-CD1 4.27Å; V1053-I1134 HydrophobicContact CG2-CD1 3.82Å; V1053-W1141 HydrophobicContact CG1-CH2 3.38Å; V1053-W1141 HydrophobicContact CG1-CZ2 4.19Å; V1053-W1141 HydrophobicContact CG1-CZ3 3.94Å; V1053-F1192 HydrophobicContact CG1-CZ 4.29Å; V1053-F1192 HydrophobicContact CG2-CE2 3.7Å; V1053-F1192 HydrophobicContact CG2-CZ 3.97Å; V1053-L1196 HydrophobicContact CG2-CD1 4.22Å
1054	Y	76.5	Confident	73.6	Confident	65.8 Å²	65.8	46.7 Å²	46.7	26%	0.258	25%	0.245	S	C	.	.	H	α-helix	trans	-60.9	-37.9	-176.2	-153.3	-89	0	0	0	113.1	F780 L1049 R1050 A1056 A1057 C1058 I1134 W1141 I1145	F780-Y1054 HydrophobicContact CB-CD2 4.42Å; F780-Y1054 HydrophobicContact CB-CE2 4.2Å; L1049-Y1054 PolarHBondContact O-N 3.19Å; R1050-Y1054 HydrophobicContact CB-CD2 3.99Å; R1050-Y1054 HydrophobicContact CB-CE2 3.93Å; R1050-Y1054 HydrophobicContact CG-CE2 4.22Å; R1050-Y1054 PolarHBondContact NH2-OH 3.43Å; R1050-Y1054 WeakPolarHBondContact O-CB 3.23Å; R1050-Y1054 WeakPolarHBondContact O-CD2 3.32Å; R1050-Y1054 PolarHBondContact O-N 3.09Å; Y1054-A1056 VanDerWaalsContact C-N 3.32Å; Y1054-A1056 PolarHBondContact O-N 2.88Å; Y1054-A1057 WeakPolarHBondContact O-CA 3.15Å; Y1054-A1057 WeakPolarHBondContact O-CB 3.42Å; Y1054-A1057 PolarHBondContact O-N 3.15Å; Y1054-A1057 VanDerWaalsContact O-N 3.15Å; Y1054-C1058 VanDerWaalsContact CD1-SG 3.55Å; Y1054-C1058 WeakPolarHBondContact CE1-SG 3.44Å; Y1054-C1058 PolarHBondContact O-N 3.17Å; Y1054-C1058 PolarHBondContact O-SG 3.21Å; Y1054-C1058 VanDerWaalsContact O-SG 3.35Å; Y1054-I1134 HydrophobicContact CD2-CD1 4.29Å; Y1054-I1134 HydrophobicContact CD2-CG1 4.27Å; Y1054-I1134 HydrophobicContact CD2-CG2 4.21Å; Y1054-I1134 HydrophobicContact CE2-CG2 4.18Å; Y1054-W1141 HydrophobicContact CD1-CZ3 4.2Å; Y1054-W1141 HydrophobicContact CD2-CE3 4.44Å; Y1054-W1141 AromaticContact CE1-CE3 3.96Å; Y1054-W1141 HydrophobicContact CE1-CE3 3.96Å; Y1054-W1141 AromaticContact CE1-CZ3 3.79Å; Y1054-W1141 HydrophobicContact CE1-CZ3 3.79Å; Y1054-W1141 HydrophobicContact CE2-CB 4.24Å; Y1054-W1141 HydrophobicContact CE2-CD2 4.4Å; Y1054-W1141 AromaticContact CE2-CE3 3.73Å; Y1054-W1141 HydrophobicContact CE2-CE3 3.82Å; Y1054-W1141 HydrophobicContact CE2-CZ3 4.39Å; Y1054-W1141 AromaticContact CZ-CE3 3.95Å; Y1054-W1141 PolarHBondContact OH-O 3.23Å; Y1054-I1145 HydrophobicContact CE1-CG1 4.28Å
1055	S	69.3	Low	75.1	Confident	41 Å²	41	42.6 Å²	42.6	29%	0.287	22%	0.223	S	C	.	.	H	α-helix	trans	-63.6	-38.2	177.8	107.4	0	0	0	0	112.4	Y1052 V1053 A1057 C1058 I1198 T1199	Y1052-S1055 PolarHBondContact O-OG 3.23Å; V1053-S1055 VanDerWaalsContact C-N 3.32Å; V1053-S1055 PolarHBondContact O-N 3.18Å; S1055-A1057 VanDerWaalsContact C-N 3.33Å; S1055-A1057 PolarHBondContact O-N 3.11Å; S1055-C1058 PolarHBondContact O-N 3.46Å; S1055-I1198 WeakPolarHBondContact OG-CD1 3.48Å; S1055-T1199 WeakPolarHBondContact OG-CG2 3.44Å
1056	A	75.2	Confident	76.3	Confident	9.4 Å²	9.4	42.6 Å²	42.6	8%	0.078	22%	0.222	C	C	.	.	H	α-helix	trans	-79.5	-40.6	178.3	0	0	0	0	0	112.5	V1053 Y1054 A1059 I1060 T1127 S1130 L1196 I1198	V1053-A1056 CarbonylContact O-C 3.58Å; V1053-A1056 PolarHBondContact O-N 3.19Å; V1053-A1056 VanDerWaalsContact O-N 3.14Å; Y1054-A1056 VanDerWaalsContact C-N 3.32Å; Y1054-A1056 PolarHBondContact O-N 2.88Å; A1056-A1059 PolarHBondContact O-N 3.21Å; A1056-I1060 HydrophobicContact CB-CD1 3.91Å; A1056-I1060 WeakPolarHBondContact O-CB 3.28Å; A1056-I1060 WeakPolarHBondContact O-CD1 3.48Å; A1056-I1060 WeakPolarHBondContact O-CG1 3.45Å; A1056-I1060 PolarHBondContact O-N 2.95Å; A1056-T1127 HydrophobicContact CB-CG2 3.87Å; A1056-T1127 WeakPolarHBondContact O-CG2 3.41Å; A1056-S1130 WeakPolarHBondContact CB-OG 3.32Å; A1056-L1196 HydrophobicContact CB-CD2 4.35Å; A1056-I1198 HydrophobicContact CB-CG2 4.26Å
1057	A	79.7	Confident	77.4	Confident	0.4 Å²	0.4	42.2 Å²	42.2	0%	0.003	22%	0.218	C	C	.	.	H	α-helix	trans	-66.2	-42.4	-178.9	0	0	0	0	0	112.9	V1053 Y1054 S1055 A1059 I1060 G1061 T1127 A1131 I1134 W1141	V1053-A1057 HydrophobicContact CG1-CB 3.74Å; V1053-A1057 PolarHBondContact O-N 3.14Å; Y1054-A1057 WeakPolarHBondContact O-CA 3.15Å; Y1054-A1057 WeakPolarHBondContact O-CB 3.42Å; Y1054-A1057 PolarHBondContact O-N 3.15Å; Y1054-A1057 VanDerWaalsContact O-N 3.15Å; S1055-A1057 VanDerWaalsContact C-N 3.33Å; S1055-A1057 PolarHBondContact O-N 3.11Å; A1057-A1059 PolarHBondContact O-N 3.04Å; A1057-A1059 VanDerWaalsContact O-N 3.09Å; A1057-I1060 WeakPolarHBondContact O-CB 3.18Å; A1057-I1060 VanDerWaalsContact O-CG2 3.25Å; A1057-I1060 WeakPolarHBondContact O-CG2 3.33Å; A1057-I1060 PolarHBondContact O-N 3.37Å; A1057-I1060 VanDerWaalsContact O-N 3.08Å; A1057-G1061 PolarHBondContact O-N 2.56Å; A1057-T1127 HydrophobicContact CB-CG2 3.55Å; A1057-A1131 HydrophobicContact CB-CB 4.26Å; A1057-I1134 HydrophobicContact CB-CB 4.46Å; A1057-I1134 HydrophobicContact CB-CG1 3.82Å; A1057-W1141 HydrophobicContact CB-CH2 3.75Å; A1057-W1141 HydrophobicContact CB-CZ2 4.4Å; A1057-W1141 HydrophobicContact CB-CZ3 4.06Å; A1057-W1141 WeakPolarHBondContact O-CH2 3.48Å
1058	C	76.3	Confident	78.7	Confident	56.2 Å²	56.2	37.4 Å²	37.4	38%	0.38	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-20.1	-177.6	-73.4	0	0	0	0	114.3	Y1054 S1055 I1060 W1141	Y1054-C1058 VanDerWaalsContact CD1-SG 3.55Å; Y1054-C1058 WeakPolarHBondContact CE1-SG 3.44Å; Y1054-C1058 PolarHBondContact O-N 3.17Å; Y1054-C1058 PolarHBondContact O-SG 3.21Å; Y1054-C1058 VanDerWaalsContact O-SG 3.35Å; S1055-C1058 PolarHBondContact O-N 3.46Å; C1058-I1060 VanDerWaalsContact C-N 3.27Å; C1058-I1060 PolarHBondContact O-N 3.16Å; C1058-W1141 WeakPolarHBondContact SG-CH2 3.32Å; C1058-W1141 WeakPolarHBondContact SG-CZ3 3.34Å
1059	A	76.8	Confident	79.7	Confident	64.4 Å²	64.4	35.8 Å²	35.8	53%	0.532	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-14.1	177.6	0	0	0	0	0	113.5	A1056 A1057 T1127 A1339 S1343	A1056-A1059 PolarHBondContact O-N 3.21Å; A1057-A1059 PolarHBondContact O-N 3.04Å; A1057-A1059 VanDerWaalsContact O-N 3.09Å; A1059-T1127 HydrophobicContact CB-CG2 4.11Å; A1059-A1339 WeakPolarHBondContact O-CB 3.49Å; A1059-S1343 WeakPolarHBondContact CB-OG 3.33Å
1060	I	82.4	Confident	80.4	Confident	8.2 Å²	8.2	40.4 Å²	40.4	4%	0.042	21%	0.211	C	C	.	.			trans	-74.3	135.7	-174.9	-143.9	165.3	0	0	0	112.6	A1056 A1057 C1058 H1064 L1065 V1068 T1127 Y1128 A1131 W1141 Y1142 L1332 A1340 L1344 P1373	A1056-I1060 HydrophobicContact CB-CD1 3.91Å; A1056-I1060 WeakPolarHBondContact O-CB 3.28Å; A1056-I1060 WeakPolarHBondContact O-CD1 3.48Å; A1056-I1060 WeakPolarHBondContact O-CG1 3.45Å; A1056-I1060 PolarHBondContact O-N 2.95Å; A1057-I1060 WeakPolarHBondContact O-CB 3.18Å; A1057-I1060 VanDerWaalsContact O-CG2 3.25Å; A1057-I1060 WeakPolarHBondContact O-CG2 3.33Å; A1057-I1060 PolarHBondContact O-N 3.37Å; A1057-I1060 VanDerWaalsContact O-N 3.08Å; C1058-I1060 VanDerWaalsContact C-N 3.27Å; C1058-I1060 PolarHBondContact O-N 3.16Å; I1060-H1064 HydrophobicContact CD1-CB 4.24Å; I1060-H1064 HydrophobicContact CG1-CB 3.87Å; I1060-L1065 HydrophobicContact CD1-CB 4.11Å; I1060-L1065 HydrophobicContact CD1-CD1 4.38Å; I1060-L1065 HydrophobicContact CG1-CB 4.29Å; I1060-L1065 HydrophobicContact CG2-CB 4.07Å; I1060-L1065 HydrophobicContact CG2-CD1 4.4Å; I1060-L1065 HydrophobicContact CG2-CD2 4.45Å; I1060-V1068 HydrophobicContact CD1-CG1 4.45Å; I1060-T1127 HydrophobicContact CB-CG2 3.7Å; I1060-T1127 HydrophobicContact CG1-CG2 4.18Å; I1060-Y1128 HydrophobicContact CD1-CD2 4.43Å; I1060-Y1128 HydrophobicContact CD1-CG 4.43Å; I1060-A1131 HydrophobicContact CB-CB 3.98Å; I1060-A1131 HydrophobicContact CD1-CB 3.4Å; I1060-A1131 VanDerWaalsContact CD1-CB 3.42Å; I1060-A1131 HydrophobicContact CG1-CB 4.28Å; I1060-A1131 HydrophobicContact CG2-CB 3.78Å; I1060-W1141 HydrophobicContact CG2-CH2 4.19Å; I1060-Y1142 HydrophobicContact CG2-CE2 4.16Å; I1060-Y1142 PolarHBondContact O-OH 3.24Å; I1060-Y1142 VanDerWaalsContact O-OH 3.08Å; I1060-L1332 HydrophobicContact CG2-CD1 3.69Å; I1060-L1332 HydrophobicContact CG2-CD2 4.15Å; I1060-L1332 WeakPolarHBondContact O-CD2 3.25Å; I1060-A1340 HydrophobicContact CB-CB 4.02Å; I1060-A1340 HydrophobicContact CD1-CB 4.49Å; I1060-A1340 HydrophobicContact CG1-CB 3.65Å; I1060-A1340 HydrophobicContact CG2-CB 3.82Å; I1060-L1344 HydrophobicContact CD1-CD1 4.44Å; I1060-L1344 HydrophobicContact CD1-CD2 4.35Å; I1060-L1344 HydrophobicContact CD1-CG 4.38Å; I1060-P1373 HydrophobicContact CG2-CB 4.26Å; I1060-P1373 HydrophobicContact CG2-CG 4.37Å
1061	G	80.6	Confident	81.6	Confident	15.6 Å²	15.6	35.3 Å²	35.3	16%	0.161	19%	0.193	C	C	.	.			trans	-90.3	136.8	173.7	0	0	0	0	0	112.8	A1057 R1063 H1064 L1065	A1057-G1061 PolarHBondContact O-N 2.56Å; G1061-R1063 VanDerWaalsContact C-N 3.3Å; G1061-R1063 PolarHBondContact O-N 2.84Å; G1061-H1064 WeakPolarHBondContact O-CB 3.41Å; G1061-H1064 PolarHBondContact O-N 3.24Å; G1061-H1064 VanDerWaalsContact O-N 3.13Å; G1061-L1065 PolarHBondContact O-N 3.2Å
1062	P	82	Confident	83	Confident	69.6 Å²	69.6	31.6 Å²	31.6	45%	0.452	18%	0.176	S	C	.	.	H	α-helix	trans	-57.6	-36.5	-178.7	-14.9	19	0	0	0	114.2	Y757 L1065 L1066 Y1142	Y757-P1062 HydrophobicContact CD2-CB 4.26Å; Y757-P1062 HydrophobicContact CE2-CB 4.24Å; P1062-L1065 PolarHBondContact O-N 3.39Å; P1062-L1066 WeakPolarHBondContact O-CB 3.09Å; P1062-L1066 PolarHBondContact O-N 3.12Å; P1062-L1066 VanDerWaalsContact O-N 3.1Å; P1062-Y1142 HydrophobicContact CB-CE1 4.31Å; P1062-Y1142 WeakPolarHBondContact CD-OH 3.19Å; P1062-Y1142 HydrophobicContact CG-CE1 4.31Å; P1062-Y1142 VanDerWaalsContact CG-OH 3.32Å; P1062-Y1142 WeakPolarHBondContact CG-OH 3.45Å
1063	R	85.8	Confident	84.1	Confident	74.8 Å²	74.8	33.4 Å²	33.4	28%	0.282	19%	0.189	S	C	.	.	H	α-helix	trans	-65.3	-50.2	177.4	-179.6	-179.3	64.3	97.2	-7.7	111.5	G1061 L1065 L1066 E1067 S1330 G1331 E1336	G1061-R1063 VanDerWaalsContact C-N 3.3Å; G1061-R1063 PolarHBondContact O-N 2.84Å; R1063-L1065 VanDerWaalsContact C-N 3.3Å; R1063-L1065 PolarHBondContact O-N 3.12Å; R1063-L1066 WeakPolarHBondContact O-CA 3.41Å; R1063-L1066 WeakPolarHBondContact O-CB 3.21Å; R1063-L1066 PolarHBondContact O-N 3.15Å; R1063-L1066 VanDerWaalsContact O-N 3.15Å; R1063-E1067 WeakPolarHBondContact CG-OE1 3.29Å; R1063-E1067 IonicContact CZ-OE1 3.39Å; R1063-E1067 IonicContact NH1-OE1 3.58Å; R1063-E1067 PolarHBondContact NH1-OE1 3Å; R1063-E1067 IonicContact NH1-OE2 3.42Å; R1063-E1067 PolarHBondContact NH1-OE2 3.34Å; R1063-E1067 WeakPolarHBondContact O-CB 3.27Å; R1063-E1067 WeakPolarHBondContact O-CG 3.29Å; R1063-E1067 PolarHBondContact O-N 3.06Å; R1063-S1330 PolarHBondContact NH1-OG 3.23Å; R1063-S1330 PolarHBondContact NH2-OG 3.01Å; R1063-S1330 VanDerWaalsContact NH2-OG 3.13Å; R1063-G1331 PolarHBondContact NH2-O 3.16Å; R1063-E1336 VanDerWaalsContact CB-OE1 3.32Å; R1063-E1336 WeakPolarHBondContact CB-OE1 3.4Å; R1063-E1336 IonicContact CZ-OE1 3.75Å; R1063-E1336 IonicContact CZ-OE2 3.01Å; R1063-E1336 IonicContact NE-OE1 3.25Å; R1063-E1336 PolarHBondContact NE-OE1 3.27Å; R1063-E1336 IonicContact NE-OE2 3.01Å; R1063-E1336 IonicContact NH2-OE1 3.06Å; R1063-E1336 PolarHBondContact NH2-OE1 3.21Å; R1063-E1336 IonicContact NH2-OE2 3.55Å; R1063-E1336 PolarHBondContact NH2-OE2 3.2Å
1064	H	88.7	Confident	84.7	Confident	9.2 Å²	9.2	35.2 Å²	35.2	4%	0.043	20%	0.202	C	C	.	.	H	α-helix	trans	-62	-38.6	179	-60.9	124.5	0	0	0	112	I1060 G1061 L1066 E1067 V1068 Y1128 S1330 L1332 E1336	I1060-H1064 HydrophobicContact CD1-CB 4.24Å; I1060-H1064 HydrophobicContact CG1-CB 3.87Å; G1061-H1064 WeakPolarHBondContact O-CB 3.41Å; G1061-H1064 PolarHBondContact O-N 3.24Å; G1061-H1064 VanDerWaalsContact O-N 3.13Å; H1064-L1066 VanDerWaalsContact C-N 3.33Å; H1064-L1066 PolarHBondContact O-N 3.06Å; H1064-E1067 IonicContact CD2-OE2 3.16Å; H1064-E1067 PolarHBondContact O-N 3.01Å; H1064-V1068 VanDerWaalsContact O-CG2 3.28Å; H1064-V1068 WeakPolarHBondContact O-CG2 3.43Å; H1064-V1068 PolarHBondContact O-N 3.09Å; H1064-V1068 VanDerWaalsContact O-N 3.1Å; H1064-Y1128 WeakPolarHBondContact CA-OH 2.94Å; H1064-Y1128 HydrophobicContact CB-CD1 4.28Å; H1064-Y1128 HydrophobicContact CB-CD2 4.48Å; H1064-Y1128 HydrophobicContact CB-CE1 4.12Å; H1064-Y1128 HydrophobicContact CB-CE2 3.74Å; H1064-Y1128 VanDerWaalsContact CB-CZ 3.43Å; H1064-Y1128 WeakPolarHBondContact CB-OH 3.42Å; H1064-Y1128 AromaticContact CD2-CE2 3.68Å; H1064-Y1128 AromaticContact CD2-CZ 3.85Å; H1064-Y1128 PolarHBondContact CD2-OH 2.99Å; H1064-Y1128 AromaticContact CG-CE2 3.96Å; H1064-Y1128 AromaticContact CG-CZ 3.92Å; H1064-Y1128 VanDerWaalsContact CG-OH 3.23Å; H1064-Y1128 AromaticContact ND1-CZ 3.8Å; H1064-Y1128 PolarHBondContact ND1-OH 2.87Å; H1064-Y1128 VanDerWaalsContact ND1-OH 3.1Å; H1064-S1330 PolarHBondContact CE1-O 2.98Å; H1064-S1330 PolarHBondContact NE2-N 3.47Å; H1064-S1330 PolarHBondContact NE2-O 3.47Å; H1064-S1330 PolarHBondContact NE2-OG 2.86Å; H1064-L1332 VanDerWaalsContact CE1-CD2 3.43Å; H1064-L1332 WeakPolarHBondContact CE1-CD2 3.43Å; H1064-E1336 VanDerWaalsContact CE1-CD 3.48Å; H1064-E1336 IonicContact CE1-OE1 3.87Å; H1064-E1336 PolarHBondContact CE1-OE1 3.1Å; H1064-E1336 IonicContact CE1-OE2 3.47Å; H1064-E1336 IonicContact ND1-OE1 3.85Å; H1064-E1336 IonicContact NE2-OE1 3.61Å; H1064-E1336 IonicContact NE2-OE2 3.32Å
1065	L	89	Confident	85.4	Confident	1.2 Å²	1.2	32.1 Å²	32.1	1%	0.006	19%	0.19	C	C	.	.	H	α-helix	trans	-61.6	-47.2	173.4	-179.7	60	0	0	0	111.3	I1060 G1061 P1062 R1063 E1067 V1068 E1069 Y1128 A1131 W1141 Y1142 R1180	I1060-L1065 HydrophobicContact CD1-CB 4.11Å; I1060-L1065 HydrophobicContact CD1-CD1 4.38Å; I1060-L1065 HydrophobicContact CG1-CB 4.29Å; I1060-L1065 HydrophobicContact CG2-CB 4.07Å; I1060-L1065 HydrophobicContact CG2-CD1 4.4Å; I1060-L1065 HydrophobicContact CG2-CD2 4.45Å; G1061-L1065 PolarHBondContact O-N 3.2Å; P1062-L1065 PolarHBondContact O-N 3.39Å; R1063-L1065 VanDerWaalsContact C-N 3.3Å; R1063-L1065 PolarHBondContact O-N 3.12Å; L1065-E1067 VanDerWaalsContact C-N 3.32Å; L1065-E1067 PolarHBondContact O-N 3.16Å; L1065-V1068 HydrophobicContact CD1-CG1 4.45Å; L1065-V1068 VanDerWaalsContact O-CG1 3.26Å; L1065-V1068 WeakPolarHBondContact O-CG1 3.35Å; L1065-V1068 PolarHBondContact O-N 3.26Å; L1065-E1069 HydrophobicContact CD1-CG 4.21Å; L1065-E1069 WeakPolarHBondContact CD1-OE1 3.23Å; L1065-E1069 HydrophobicContact CG-CG 4.48Å; L1065-E1069 WeakPolarHBondContact O-CB 3.36Å; L1065-E1069 VanDerWaalsContact O-CG 3.24Å; L1065-E1069 WeakPolarHBondContact O-CG 3.34Å; L1065-E1069 PolarHBondContact O-N 3.17Å; L1065-E1069 VanDerWaalsContact O-N 3.08Å; L1065-Y1128 HydrophobicContact CB-CD1 4.25Å; L1065-Y1128 HydrophobicContact CB-CE1 4.46Å; L1065-A1131 HydrophobicContact CD1-CB 3.93Å; L1065-A1131 VanDerWaalsContact CD1-CB 3.48Å; L1065-A1131 HydrophobicContact CD2-CB 4.15Å; L1065-A1131 HydrophobicContact CG-CB 4.47Å; L1065-W1141 HydrophobicContact CD1-CZ2 4.11Å; L1065-W1141 HydrophobicContact CD2-CZ2 4.3Å; L1065-Y1142 VanDerWaalsContact CD2-CB 3.49Å; L1065-Y1142 HydrophobicContact CD2-CD1 3.71Å; L1065-Y1142 HydrophobicContact CD2-CD2 3.67Å; L1065-Y1142 HydrophobicContact CD2-CE1 4.18Å; L1065-Y1142 HydrophobicContact CD2-CE2 4.13Å; L1065-Y1142 HydrophobicContact CD2-CG 3.43Å; L1065-Y1142 VanDerWaalsContact CD2-CG 3.46Å; L1065-R1180 VanDerWaalsContact CD2-NH1 3.32Å
1066	L	87.4	Confident	86.3	Confident	34.2 Å²	34.2	32.5 Å²	32.5	18%	0.179	19%	0.191	C	C	.	.	H	α-helix	trans	-62.4	-41	177.4	-176.5	66.4	0	0	0	111.9	I755 P1062 R1063 H1064 V1068 E1069 Q1070 Q1179 R1180	I755-L1066 HydrophobicContact CD1-CD2 3.74Å; I755-L1066 HydrophobicContact CG2-CD2 4.13Å; P1062-L1066 WeakPolarHBondContact O-CB 3.09Å; P1062-L1066 PolarHBondContact O-N 3.12Å; P1062-L1066 VanDerWaalsContact O-N 3.1Å; R1063-L1066 WeakPolarHBondContact O-CA 3.41Å; R1063-L1066 WeakPolarHBondContact O-CB 3.21Å; R1063-L1066 PolarHBondContact O-N 3.15Å; R1063-L1066 VanDerWaalsContact O-N 3.15Å; H1064-L1066 VanDerWaalsContact C-N 3.33Å; H1064-L1066 PolarHBondContact O-N 3.06Å; L1066-V1068 PolarHBondContact O-N 3.18Å; L1066-E1069 PolarHBondContact O-N 2.96Å; L1066-Q1070 HydrophobicContact CD1-CG 4.22Å; L1066-Q1070 HydrophobicContact CG-CG 4.34Å; L1066-Q1070 WeakPolarHBondContact O-CB 3.36Å; L1066-Q1070 VanDerWaalsContact O-CG 3.25Å; L1066-Q1070 WeakPolarHBondContact O-CG 3.32Å; L1066-Q1070 PolarHBondContact O-N 3.26Å; L1066-Q1179 WeakPolarHBondContact CD1-O 3.32Å; L1066-R1180 HydrophobicContact CD1-CB 4.42Å; L1066-R1180 HydrophobicContact CD1-CG 3.95Å
1067	E	89.5	Confident	86.9	Confident	51.4 Å²	51.4	36.9 Å²	36.9	24%	0.24	21%	0.209	C	C	.	.	H	α-helix	trans	-59.9	-47	177.5	-90	173.5	-168.4	0	0	112	R1063 H1064 L1065 E1069 Q1070 A1071 Y1128 L1327 S1330	R1063-E1067 WeakPolarHBondContact CG-OE1 3.29Å; R1063-E1067 IonicContact CZ-OE1 3.39Å; R1063-E1067 IonicContact NH1-OE1 3.58Å; R1063-E1067 PolarHBondContact NH1-OE1 3Å; R1063-E1067 IonicContact NH1-OE2 3.42Å; R1063-E1067 PolarHBondContact NH1-OE2 3.34Å; R1063-E1067 WeakPolarHBondContact O-CB 3.27Å; R1063-E1067 WeakPolarHBondContact O-CG 3.29Å; R1063-E1067 PolarHBondContact O-N 3.06Å; H1064-E1067 IonicContact CD2-OE2 3.16Å; H1064-E1067 PolarHBondContact O-N 3.01Å; L1065-E1067 VanDerWaalsContact C-N 3.32Å; L1065-E1067 PolarHBondContact O-N 3.16Å; E1067-E1069 VanDerWaalsContact C-N 3.34Å; E1067-Q1070 PolarHBondContact O-N 3.11Å; E1067-A1071 VanDerWaalsContact O-CB 3.32Å; E1067-A1071 WeakPolarHBondContact O-CB 3.37Å; E1067-A1071 PolarHBondContact O-N 3.21Å; E1067-Y1128 PolarHBondContact OE2-OH 3.2Å; E1067-Y1128 VanDerWaalsContact OE2-OH 3.12Å; E1067-L1327 HydrophobicContact CB-CD1 4.18Å; E1067-L1327 HydrophobicContact CG-CD1 3.64Å; E1067-L1327 WeakPolarHBondContact O-CD1 3.47Å; E1067-S1330 PolarHBondContact OE2-OG 2.78Å
1068	V	91.9	Very high	87.5	Confident	0.2 Å²	0.2	40.5 Å²	40.5	0%	0.001	22%	0.223	C	C	.	.	H	α-helix	trans	-68.2	-38.6	179.7	87.6	0	0	0	0	111.9	I1060 H1064 L1065 L1066 A1071 F1072 I1117 Y1128 L1132 L1327	I1060-V1068 HydrophobicContact CD1-CG1 4.45Å; H1064-V1068 VanDerWaalsContact O-CG2 3.28Å; H1064-V1068 WeakPolarHBondContact O-CG2 3.43Å; H1064-V1068 PolarHBondContact O-N 3.09Å; H1064-V1068 VanDerWaalsContact O-N 3.1Å; L1065-V1068 HydrophobicContact CD1-CG1 4.45Å; L1065-V1068 VanDerWaalsContact O-CG1 3.26Å; L1065-V1068 WeakPolarHBondContact O-CG1 3.35Å; L1065-V1068 PolarHBondContact O-N 3.26Å; L1066-V1068 PolarHBondContact O-N 3.18Å; V1068-A1071 PolarHBondContact O-N 3.3Å; V1068-F1072 WeakPolarHBondContact O-CB 3.28Å; V1068-F1072 PolarHBondContact O-N 2.97Å; V1068-I1117 HydrophobicContact CG1-CD1 3.88Å; V1068-I1117 HydrophobicContact CG2-CD1 3.9Å; V1068-Y1128 HydrophobicContact CB-CD1 3.66Å; V1068-Y1128 HydrophobicContact CB-CE1 4.13Å; V1068-Y1128 HydrophobicContact CB-CG 4.49Å; V1068-Y1128 HydrophobicContact CG1-CD1 4.39Å; V1068-Y1128 HydrophobicContact CG2-CD1 3.93Å; V1068-L1132 HydrophobicContact CG1-CB 4.27Å; V1068-L1132 HydrophobicContact CG1-CD1 4.25Å; V1068-L1132 HydrophobicContact CG1-CD2 3.87Å; V1068-L1132 HydrophobicContact CG1-CG 4.29Å; V1068-L1132 HydrophobicContact CG2-CB 4.06Å; V1068-L1132 HydrophobicContact CG2-CD1 4.45Å; V1068-L1132 HydrophobicContact CG2-CD2 4.09Å; V1068-L1132 HydrophobicContact CG2-CG 4.42Å; V1068-L1327 HydrophobicContact CB-CD2 4.1Å; V1068-L1327 HydrophobicContact CG2-CD1 4.33Å; V1068-L1327 HydrophobicContact CG2-CD2 3.92Å
1069	E	90.9	Very high	88.1	Confident	1.2 Å²	1.2	37.8 Å²	37.8	1%	0.006	21%	0.205	C	C	.	.	H	α-helix	trans	-66.3	-43.5	176.9	-72.8	-179.2	159.8	0	0	112	L1065 L1066 E1067 A1071 F1072 N1073 L1132 S1135 R1180 P1181 F1183	L1065-E1069 HydrophobicContact CD1-CG 4.21Å; L1065-E1069 WeakPolarHBondContact CD1-OE1 3.23Å; L1065-E1069 HydrophobicContact CG-CG 4.48Å; L1065-E1069 WeakPolarHBondContact O-CB 3.36Å; L1065-E1069 VanDerWaalsContact O-CG 3.24Å; L1065-E1069 WeakPolarHBondContact O-CG 3.34Å; L1065-E1069 PolarHBondContact O-N 3.17Å; L1065-E1069 VanDerWaalsContact O-N 3.08Å; L1066-E1069 PolarHBondContact O-N 2.96Å; E1067-E1069 VanDerWaalsContact C-N 3.34Å; E1069-A1071 VanDerWaalsContact C-N 3.32Å; E1069-A1071 PolarHBondContact O-N 3.18Å; E1069-F1072 PolarHBondContact O-N 3.07Å; E1069-N1073 WeakPolarHBondContact O-CB 3.38Å; E1069-N1073 PolarHBondContact O-N 3.24Å; E1069-L1132 HydrophobicContact CG-CD1 4.34Å; E1069-S1135 VanDerWaalsContact OE1-CB 3.24Å; E1069-S1135 WeakPolarHBondContact OE1-CB 3.38Å; E1069-S1135 PolarHBondContact OE1-OG 2.94Å; E1069-S1135 VanDerWaalsContact OE1-OG 3.09Å; E1069-R1180 IonicContact OE1-CZ 3.04Å; E1069-R1180 VanDerWaalsContact OE1-CZ 3.27Å; E1069-R1180 IonicContact OE1-NE 3.03Å; E1069-R1180 PolarHBondContact OE1-NE 3.19Å; E1069-R1180 IonicContact OE1-NH1 3.37Å; E1069-R1180 PolarHBondContact OE1-NH1 3.24Å; E1069-R1180 IonicContact OE1-NH2 2.98Å; E1069-R1180 PolarHBondContact OE1-NH2 2.95Å; E1069-R1180 WeakPolarHBondContact OE2-CD 3.33Å; E1069-R1180 WeakPolarHBondContact OE2-CG 3.39Å; E1069-R1180 IonicContact OE2-CZ 3.25Å; E1069-R1180 IonicContact OE2-NE 3.16Å; E1069-R1180 PolarHBondContact OE2-NE 3.1Å; E1069-R1180 IonicContact OE2-NH1 3.58Å; E1069-R1180 PolarHBondContact OE2-NH1 3.17Å; E1069-R1180 IonicContact OE2-NH2 3.59Å; E1069-R1180 PolarHBondContact OE2-NH2 2.82Å; E1069-P1181 HydrophobicContact CB-CG 3.75Å; E1069-F1183 HydrophobicContact CB-CE2 4.07Å; E1069-F1183 HydrophobicContact CB-CZ 3.86Å; E1069-F1183 HydrophobicContact CG-CE2 3.89Å; E1069-F1183 HydrophobicContact CG-CZ 4.17Å; E1069-F1183 WeakPolarHBondContact O-CZ 3.34Å
1070	Q	90.6	Very high	88.7	Confident	98.4 Å²	98.4	41.1 Å²	41.1	46%	0.46	20%	0.204	S	C	.	.	H	α-helix	trans	-64.7	-41.4	175.6	-74.2	177.2	-7.8	0	0	111.7	L1066 E1067 F1072 N1073 S1074	L1066-Q1070 HydrophobicContact CD1-CG 4.22Å; L1066-Q1070 HydrophobicContact CG-CG 4.34Å; L1066-Q1070 WeakPolarHBondContact O-CB 3.36Å; L1066-Q1070 VanDerWaalsContact O-CG 3.25Å; L1066-Q1070 WeakPolarHBondContact O-CG 3.32Å; L1066-Q1070 PolarHBondContact O-N 3.26Å; E1067-Q1070 PolarHBondContact O-N 3.11Å; Q1070-F1072 VanDerWaalsContact C-N 3.34Å; Q1070-F1072 PolarHBondContact O-N 3.12Å; Q1070-N1073 WeakPolarHBondContact O-CB 3.42Å; Q1070-N1073 PolarHBondContact O-N 3.11Å; Q1070-N1073 VanDerWaalsContact O-N 3.15Å; Q1070-S1074 PolarHBondContact O-N 3.3Å; Q1070-S1074 PolarHBondContact O-OG 3.41Å
1071	A	92.1	Very high	88.9	Confident	10 Å²	10	48.1 Å²	48.1	8%	0.083	23%	0.229	C	C	.	.	H	α-helix	trans	-61.4	-43.1	175.7	0	0	0	0	0	111.4	E1067 V1068 E1069 N1073 S1074 L1075 L1115 L1327	E1067-A1071 VanDerWaalsContact O-CB 3.32Å; E1067-A1071 WeakPolarHBondContact O-CB 3.37Å; E1067-A1071 PolarHBondContact O-N 3.21Å; V1068-A1071 PolarHBondContact O-N 3.3Å; E1069-A1071 VanDerWaalsContact C-N 3.32Å; E1069-A1071 PolarHBondContact O-N 3.18Å; A1071-N1073 VanDerWaalsContact C-N 3.33Å; A1071-N1073 PolarHBondContact O-N 3.05Å; A1071-S1074 WeakPolarHBondContact CA-OG 3.37Å; A1071-S1074 PolarHBondContact O-N 3.02Å; A1071-S1074 PolarHBondContact O-OG 3.24Å; A1071-L1075 PolarHBondContact O-N 3.38Å; A1071-L1115 HydrophobicContact CB-CD1 3.86Å; A1071-L1115 HydrophobicContact CB-CD2 4.4Å; A1071-L1327 HydrophobicContact CB-CB 4.39Å; A1071-L1327 HydrophobicContact CB-CD1 4.11Å; A1071-L1327 HydrophobicContact CB-CD2 3.99Å; A1071-L1327 HydrophobicContact CB-CG 4.44Å
1072	F	93.4	Very high	89.3	Confident	1.6 Å²	1.6	47.4 Å²	47.4	1%	0.007	22%	0.222	C	C	.	.	H	α-helix	trans	-65	-39.3	174.6	-170.3	-89.2	0	0	0	112.3	V1068 E1069 Q1070 S1074 L1075 L1115 L1132 L1136 F1183 H1186 A1277 R1303 V1305	V1068-F1072 WeakPolarHBondContact O-CB 3.28Å; V1068-F1072 PolarHBondContact O-N 2.97Å; E1069-F1072 PolarHBondContact O-N 3.07Å; Q1070-F1072 VanDerWaalsContact C-N 3.34Å; Q1070-F1072 PolarHBondContact O-N 3.12Å; F1072-S1074 VanDerWaalsContact C-N 3.3Å; F1072-S1074 PolarHBondContact O-N 3.2Å; F1072-L1075 HydrophobicContact CD2-CD1 3.71Å; F1072-L1075 HydrophobicContact CE2-CD1 3.96Å; F1072-L1075 HydrophobicContact CG-CD1 4.22Å; F1072-L1075 VanDerWaalsContact O-CB 3.25Å; F1072-L1075 WeakPolarHBondContact O-CB 3.37Å; F1072-L1075 WeakPolarHBondContact O-CG 3.27Å; F1072-L1075 PolarHBondContact O-N 3.19Å; F1072-L1075 VanDerWaalsContact O-N 3.15Å; F1072-L1115 HydrophobicContact CB-CD2 4.24Å; F1072-L1115 HydrophobicContact CD2-CD2 4.37Å; F1072-L1132 HydrophobicContact CB-CD1 3.82Å; F1072-L1132 HydrophobicContact CB-CD2 4.35Å; F1072-L1132 HydrophobicContact CD2-CD1 4.25Å; F1072-L1132 HydrophobicContact CD2-CD2 3.88Å; F1072-L1132 HydrophobicContact CD2-CG 4.48Å; F1072-L1132 HydrophobicContact CE2-CD2 4.5Å; F1072-L1132 HydrophobicContact CG-CD1 4.04Å; F1072-L1132 HydrophobicContact CG-CD2 4.35Å; F1072-L1136 HydrophobicContact CD1-CD2 3.65Å; F1072-L1136 HydrophobicContact CD2-CD1 4.45Å; F1072-L1136 HydrophobicContact CD2-CD2 4.44Å; F1072-L1136 HydrophobicContact CE1-CD1 4.35Å; F1072-L1136 HydrophobicContact CE1-CD2 3.24Å; F1072-L1136 HydrophobicContact CE1-CG 4.43Å; F1072-L1136 HydrophobicContact CE2-CD1 3.96Å; F1072-L1136 HydrophobicContact CE2-CD2 4.26Å; F1072-L1136 HydrophobicContact CG-CD2 4.31Å; F1072-L1136 HydrophobicContact CZ-CD1 3.84Å; F1072-L1136 HydrophobicContact CZ-CD2 3.57Å; F1072-L1136 HydrophobicContact CZ-CG 4.37Å; F1072-F1183 HydrophobicContact CB-CE1 4.43Å; F1072-F1183 HydrophobicContact CB-CZ 4.4Å; F1072-F1183 AromaticContact CD1-CD1 3.94Å; F1072-F1183 HydrophobicContact CD1-CD1 3.94Å; F1072-F1183 AromaticContact CD1-CE1 3.62Å; F1072-F1183 HydrophobicContact CD1-CE1 3.62Å; F1072-F1183 HydrophobicContact CD1-CZ 4.25Å; F1072-F1183 HydrophobicContact CE1-CD1 4.29Å; F1072-F1183 HydrophobicContact CE1-CE1 4.41Å; F1072-F1183 HydrophobicContact CG-CE1 4.45Å; F1072-H1186 AromaticContact CE1-CE1 3.84Å; F1072-H1186 AromaticContact CE1-NE2 3.83Å; F1072-H1186 AromaticContact CZ-NE2 3.84Å; F1072-A1277 HydrophobicContact CZ-CB 4.37Å; F1072-R1303 HydrophobicContact CE2-CB 4.42Å; F1072-R1303 HydrophobicContact CZ-CB 4.47Å; F1072-R1303 VanDerWaalsContact CZ-CD 3.47Å; F1072-R1303 PolarHBondContact O-NH1 3.06Å; F1072-V1305 HydrophobicContact CD2-CG2 3.92Å; F1072-V1305 HydrophobicContact CE2-CG2 3.81Å
1073	N	90	Very high	89.5	Confident	87.8 Å²	87.8	46.1 Å²	46.1	47%	0.47	21%	0.21	S	C	.	.	H	α-helix	trans	-64.7	-35.1	177.3	-164.5	40.6	0	0	0	112.2	E1069 Q1070 A1071 L1075 T1076 P1181 F1183	E1069-N1073 WeakPolarHBondContact O-CB 3.38Å; E1069-N1073 PolarHBondContact O-N 3.24Å; Q1070-N1073 WeakPolarHBondContact O-CB 3.42Å; Q1070-N1073 PolarHBondContact O-N 3.11Å; Q1070-N1073 VanDerWaalsContact O-N 3.15Å; A1071-N1073 VanDerWaalsContact C-N 3.33Å; A1071-N1073 PolarHBondContact O-N 3.05Å; N1073-L1075 PolarHBondContact O-N 3.16Å; N1073-T1076 PolarHBondContact O-N 2.66Å; N1073-T1076 PolarHBondContact O-OG1 3.16Å; N1073-P1181 HydrophobicContact CB-CB 4.12Å; N1073-P1181 HydrophobicContact CB-CG 4.18Å; N1073-F1183 HydrophobicContact CB-CE1 4.13Å
1074	S	90.7	Very high	89.6	Confident	39.4 Å²	39.4	46.2 Å²	46.2	28%	0.276	22%	0.216	S	C	.	.	H	α-helix	trans	-69.8	-13.3	178	71.2	0	0	0	0	114.6	Q1070 A1071 F1072 T1076 E1077 R1078 Q1325	Q1070-S1074 PolarHBondContact O-N 3.3Å; Q1070-S1074 PolarHBondContact O-OG 3.41Å; A1071-S1074 WeakPolarHBondContact CA-OG 3.37Å; A1071-S1074 PolarHBondContact O-N 3.02Å; A1071-S1074 PolarHBondContact O-OG 3.24Å; F1072-S1074 VanDerWaalsContact C-N 3.3Å; F1072-S1074 PolarHBondContact O-N 3.2Å; S1074-T1076 VanDerWaalsContact C-N 3.29Å; S1074-T1076 PolarHBondContact O-N 3.22Å; S1074-T1076 VanDerWaalsContact O-N 3.14Å; S1074-E1077 WeakPolarHBondContact O-CB 3.19Å; S1074-E1077 PolarHBondContact O-N 3.35Å; S1074-E1077 VanDerWaalsContact O-N 3.13Å; S1074-R1078 PolarHBondContact O-N 3.06Å; S1074-R1078 VanDerWaalsContact O-N 3.08Å; S1074-Q1325 PolarHBondContact OG-NE2 2.98Å; S1074-Q1325 PolarHBondContact OG-OE1 3.22Å; S1074-Q1325 VanDerWaalsContact OG-OE1 3.11Å
1075	L	91.2	Very high	89.4	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-58.2	-33.7	179.6	-77.1	-175.6	0	0	0	113.5	A1071 F1072 N1073 E1077 R1078 G1079 S1113 L1115 R1303 Q1325	A1071-L1075 PolarHBondContact O-N 3.38Å; F1072-L1075 HydrophobicContact CD2-CD1 3.71Å; F1072-L1075 HydrophobicContact CE2-CD1 3.96Å; F1072-L1075 HydrophobicContact CG-CD1 4.22Å; F1072-L1075 VanDerWaalsContact O-CB 3.25Å; F1072-L1075 WeakPolarHBondContact O-CB 3.37Å; F1072-L1075 WeakPolarHBondContact O-CG 3.27Å; F1072-L1075 PolarHBondContact O-N 3.19Å; F1072-L1075 VanDerWaalsContact O-N 3.15Å; N1073-L1075 PolarHBondContact O-N 3.16Å; L1075-E1077 VanDerWaalsContact C-N 3.32Å; L1075-E1077 PolarHBondContact O-N 2.92Å; L1075-R1078 WeakPolarHBondContact O-CB 3.49Å; L1075-R1078 PolarHBondContact O-N 3.04Å; L1075-G1079 PolarHBondContact O-N 3.15Å; L1075-S1113 VanDerWaalsContact CB-OG 3.28Å; L1075-S1113 WeakPolarHBondContact CB-OG 3.28Å; L1075-S1113 PolarHBondContact O-OG 3.35Å; L1075-S1113 VanDerWaalsContact O-OG 3.09Å; L1075-L1115 HydrophobicContact CD1-CB 3.96Å; L1075-L1115 HydrophobicContact CD2-CB 4.01Å; L1075-L1115 HydrophobicContact CG-CB 4.35Å; L1075-R1303 HydrophobicContact CD1-CB 4.34Å; L1075-R1303 HydrophobicContact CD1-CG 4.43Å; L1075-Q1325 HydrophobicContact CD2-CB 3.89Å; L1075-Q1325 HydrophobicContact CD2-CG 4.47Å
1076	T	88	Confident	89.2	Confident	49.2 Å²	49.2	50.4 Å²	50.4	30%	0.302	24%	0.237	S	C	.	.	H	α-helix	trans	-63.1	-41.2	177.2	-51.5	0	0	0	0	111.3	N1073 S1074 G1079 R1080 C1110 R1303	N1073-T1076 PolarHBondContact O-N 2.66Å; N1073-T1076 PolarHBondContact O-OG1 3.16Å; S1074-T1076 VanDerWaalsContact C-N 3.29Å; S1074-T1076 PolarHBondContact O-N 3.22Å; S1074-T1076 VanDerWaalsContact O-N 3.14Å; T1076-G1079 PolarHBondContact O-N 3.22Å; T1076-R1080 WeakPolarHBondContact O-CG 3.28Å; T1076-R1080 PolarHBondContact O-N 3.23Å; T1076-R1080 VanDerWaalsContact O-N 3.15Å; T1076-C1110 PolarHBondContact O-SG 3.22Å; T1076-R1303 PolarHBondContact OG1-NH2 3.37Å
1077	E	88.2	Confident	89	Confident	101 Å²	101	49.7 Å²	49.7	47%	0.472	24%	0.236	S	C	.	.	H	α-helix	trans	-70.7	-37	176.8	-157.4	99	-172.6	0	0	111.3	S1074 L1075 G1079 R1080 R1081	S1074-E1077 WeakPolarHBondContact O-CB 3.19Å; S1074-E1077 PolarHBondContact O-N 3.35Å; S1074-E1077 VanDerWaalsContact O-N 3.13Å; L1075-E1077 VanDerWaalsContact C-N 3.32Å; L1075-E1077 PolarHBondContact O-N 2.92Å; E1077-G1079 VanDerWaalsContact C-N 3.33Å; E1077-G1079 PolarHBondContact O-N 3.47Å; E1077-R1080 PolarHBondContact O-N 3.23Å; E1077-R1080 IonicContact OE2-CZ 3.18Å; E1077-R1080 IonicContact OE2-NE 2.74Å; E1077-R1080 IonicContact OE2-NH1 3.13Å; E1077-R1080 PolarHBondContact OE2-NH1 3.26Å; E1077-R1081 WeakPolarHBondContact O-CG 3.37Å; E1077-R1081 PolarHBondContact O-N 3.03Å; E1077-R1081 VanDerWaalsContact O-N 3.09Å; E1077-R1081 IonicContact OE1-CZ 2.96Å; E1077-R1081 IonicContact OE1-NH1 3.19Å; E1077-R1081 PolarHBondContact OE1-NH1 3.39Å; E1077-R1081 IonicContact OE1-NH2 3.88Å; E1077-R1081 PolarHBondContact OE1-NH2 3.05Å; E1077-R1081 IonicContact OE2-NH1 2.78Å
1078	R	90.9	Very high	88.5	Confident	77.2 Å²	77.2	51.2 Å²	51.2	29%	0.291	24%	0.244	S	C	.	.	H	α-helix	trans	-61	-43.6	173.4	-173	66.7	-175.7	-161.1	-0.9	111.8	S1074 L1075 R1080 R1081 A1082 I1322 C1324 Q1325	S1074-R1078 PolarHBondContact O-N 3.06Å; S1074-R1078 VanDerWaalsContact O-N 3.08Å; L1075-R1078 WeakPolarHBondContact O-CB 3.49Å; L1075-R1078 PolarHBondContact O-N 3.04Å; R1078-R1080 VanDerWaalsContact C-N 3.34Å; R1078-R1080 PolarHBondContact O-N 3.22Å; R1078-R1081 WeakPolarHBondContact O-CB 3.44Å; R1078-R1081 PolarHBondContact O-N 3.08Å; R1078-A1082 WeakPolarHBondContact O-CB 3.32Å; R1078-A1082 PolarHBondContact O-N 3.18Å; R1078-I1322 VanDerWaalsContact CZ-O 3.27Å; R1078-I1322 PolarHBondContact NE-O 3.11Å; R1078-I1322 PolarHBondContact NH2-O 3.17Å; R1078-C1324 VanDerWaalsContact CZ-O 3.25Å; R1078-C1324 PolarHBondContact NE-O 3.08Å; R1078-C1324 VanDerWaalsContact NE-O 3.13Å; R1078-C1324 PolarHBondContact NH2-O 3.08Å; R1078-C1324 VanDerWaalsContact NH2-O 3.11Å; R1078-Q1325 HydrophobicContact CG-CB 4.37Å
1079	G	89.3	Confident	87.9	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-60.1	-41.9	176.5	0	0	0	0	0	113.2	L1075 T1076 E1077 R1081 A1082 H1083 C1110 D1111	L1075-G1079 PolarHBondContact O-N 3.15Å; T1076-G1079 PolarHBondContact O-N 3.22Å; E1077-G1079 VanDerWaalsContact C-N 3.33Å; E1077-G1079 PolarHBondContact O-N 3.47Å; G1079-R1081 PolarHBondContact O-N 3.38Å; G1079-A1082 PolarHBondContact O-N 3.16Å; G1079-H1083 WeakPolarHBondContact O-CB 3.35Å; G1079-H1083 PolarHBondContact O-N 3Å; G1079-C1110 VanDerWaalsContact C-SG 3.55Å; G1079-D1111 VanDerWaalsContact CA-O 3.23Å; G1079-D1111 WeakPolarHBondContact CA-O 3.36Å; G1079-D1111 PolarHBondContact O-N 3.29Å; G1079-D1111 VanDerWaalsContact O-N 3.11Å
1080	R	89.2	Confident	87	Confident	133.8 Å²	133.8	57.9 Å²	57.9	51%	0.505	28%	0.281	S	S	.	.	H	α-helix	trans	-62.7	-44.4	173.3	-84.1	-178.5	-154.6	156.3	-2.8	112.2	T1076 E1077 R1078 A1082 H1083 L1084 C1110	T1076-R1080 WeakPolarHBondContact O-CG 3.28Å; T1076-R1080 PolarHBondContact O-N 3.23Å; T1076-R1080 VanDerWaalsContact O-N 3.15Å; E1077-R1080 PolarHBondContact O-N 3.23Å; E1077-R1080 IonicContact OE2-CZ 3.18Å; E1077-R1080 IonicContact OE2-NE 2.74Å; E1077-R1080 IonicContact OE2-NH1 3.13Å; E1077-R1080 PolarHBondContact OE2-NH1 3.26Å; R1078-R1080 VanDerWaalsContact C-N 3.34Å; R1078-R1080 PolarHBondContact O-N 3.22Å; R1080-A1082 VanDerWaalsContact C-N 3.35Å; R1080-A1082 PolarHBondContact O-N 2.98Å; R1080-H1083 WeakPolarHBondContact O-CB 3.41Å; R1080-H1083 PolarHBondContact O-N 2.98Å; R1080-L1084 HydrophobicContact CG-CD1 4.43Å; R1080-L1084 WeakPolarHBondContact O-CB 3.37Å; R1080-L1084 WeakPolarHBondContact O-CG 3.33Å; R1080-L1084 PolarHBondContact O-N 3.12Å; R1080-C1110 HydrophobicContact CG-CB 3.92Å; R1080-C1110 PolarHBondContact N-SG 3.12Å; R1080-C1110 VanDerWaalsContact N-SG 3.42Å
1081	R	88.2	Confident	85.9	Confident	153.4 Å²	153.4	55.7 Å²	55.7	58%	0.579	27%	0.274	S	S	*	.	H	α-helix	trans	-63	-43.5	177.8	-86.3	162	99.2	124.6	3.4	111.9	E1077 R1078 G1079 H1083 L1084 T1085	E1077-R1081 WeakPolarHBondContact O-CG 3.37Å; E1077-R1081 PolarHBondContact O-N 3.03Å; E1077-R1081 VanDerWaalsContact O-N 3.09Å; E1077-R1081 IonicContact OE1-CZ 2.96Å; E1077-R1081 IonicContact OE1-NH1 3.19Å; E1077-R1081 PolarHBondContact OE1-NH1 3.39Å; E1077-R1081 IonicContact OE1-NH2 3.88Å; E1077-R1081 PolarHBondContact OE1-NH2 3.05Å; E1077-R1081 IonicContact OE2-NH1 2.78Å; R1078-R1081 WeakPolarHBondContact O-CB 3.44Å; R1078-R1081 PolarHBondContact O-N 3.08Å; G1079-R1081 PolarHBondContact O-N 3.38Å; R1081-H1083 VanDerWaalsContact C-N 3.33Å; R1081-H1083 PolarHBondContact O-N 2.83Å; R1081-L1084 PolarHBondContact O-N 2.95Å; R1081-T1085 WeakPolarHBondContact O-CB 3.36Å; R1081-T1085 PolarHBondContact O-N 2.98Å; R1081-T1085 PolarHBondContact O-OG1 3.17Å; R1081-T1085 VanDerWaalsContact O-OG1 3.06Å
1082	A	87.7	Confident	84.4	Confident	1.2 Å²	1.2	61.2 Å²	61.2	1%	0.01	30%	0.298	C	S	.	.	H	α-helix	trans	-62.5	-44.4	177	0	0	0	0	0	111.3	R1078 G1079 R1080 T1085 R1086 I1322 D1323	R1078-A1082 WeakPolarHBondContact O-CB 3.32Å; R1078-A1082 PolarHBondContact O-N 3.18Å; G1079-A1082 PolarHBondContact O-N 3.16Å; R1080-A1082 VanDerWaalsContact C-N 3.35Å; R1080-A1082 PolarHBondContact O-N 2.98Å; A1082-T1085 PolarHBondContact O-N 2.96Å; A1082-R1086 WeakPolarHBondContact O-CG 3.38Å; A1082-R1086 PolarHBondContact O-N 3.04Å; A1082-I1322 HydrophobicContact CB-CG1 4.38Å; A1082-I1322 HydrophobicContact CB-CG2 4.05Å; A1082-D1323 HydrophobicContact CB-CB 4.03Å
1083	H	87.6	Confident	82.7	Confident	42.8 Å²	42.8	66.7 Å²	66.7	20%	0.198	33%	0.328	C	S	.	.	H	α-helix	trans	-58.4	-50.2	175.4	-173.1	81.5	0	0	0	112.1	G1079 R1080 R1081 T1085 R1086 A1087 N1106 G1109 D1111	G1079-H1083 WeakPolarHBondContact O-CB 3.35Å; G1079-H1083 PolarHBondContact O-N 3Å; R1080-H1083 WeakPolarHBondContact O-CB 3.41Å; R1080-H1083 PolarHBondContact O-N 2.98Å; R1081-H1083 VanDerWaalsContact C-N 3.33Å; R1081-H1083 PolarHBondContact O-N 2.83Å; H1083-T1085 VanDerWaalsContact C-N 3.31Å; H1083-T1085 PolarHBondContact O-N 3.15Å; H1083-R1086 PolarHBondContact O-N 3.24Å; H1083-A1087 WeakPolarHBondContact O-CB 3.36Å; H1083-A1087 PolarHBondContact O-N 3.22Å; H1083-N1106 PolarHBondContact NE2-O 3.2Å; H1083-N1106 VanDerWaalsContact NE2-O 3.15Å; H1083-G1109 VanDerWaalsContact CD2-C 3.43Å; H1083-G1109 VanDerWaalsContact CD2-CA 3.47Å; H1083-G1109 WeakPolarHBondContact CD2-CA 3.34Å; H1083-G1109 PolarHBondContact CD2-N 3.17Å; H1083-G1109 PolarHBondContact CD2-O 2.96Å; H1083-G1109 VanDerWaalsContact CG-C 3.47Å; H1083-G1109 VanDerWaalsContact NE2-CA 3.33Å; H1083-G1109 WeakPolarHBondContact NE2-CA 3.34Å; H1083-D1111 VanDerWaalsContact CA-OD2 3.26Å; H1083-D1111 WeakPolarHBondContact CA-OD2 3.27Å; H1083-D1111 HydrophobicContact CB-CB 4.38Å; H1083-D1111 IonicContact CE1-OD1 3.47Å; H1083-D1111 IonicContact CG-OD1 3.02Å; H1083-D1111 PolarHBondContact N-OD2 3.22Å; H1083-D1111 IonicContact ND1-OD1 2.99Å; H1083-D1111 PolarHBondContact ND1-OD1 3.21Å; H1083-D1111 IonicContact ND1-OD2 3.46Å
1084	L	86.4	Confident	80.9	Confident	77 Å²	77	68.4 Å²	68.4	40%	0.403	33%	0.331	S	S	.	.	H	α-helix	trans	-59.9	-42	177.5	-110.9	157.5	0	0	0	111.8	R1080 R1081 R1086 A1087 I1088 L1107	R1080-L1084 HydrophobicContact CG-CD1 4.43Å; R1080-L1084 WeakPolarHBondContact O-CB 3.37Å; R1080-L1084 WeakPolarHBondContact O-CG 3.33Å; R1080-L1084 PolarHBondContact O-N 3.12Å; R1081-L1084 PolarHBondContact O-N 2.95Å; L1084-R1086 PolarHBondContact O-N 3.16Å; L1084-A1087 PolarHBondContact O-N 2.96Å; L1084-I1088 HydrophobicContact CD2-CD1 3.51Å; L1084-I1088 VanDerWaalsContact CD2-CD1 3.47Å; L1084-I1088 HydrophobicContact CD2-CG1 4.37Å; L1084-I1088 HydrophobicContact CG-CD1 4.09Å; L1084-I1088 WeakPolarHBondContact O-CB 3.35Å; L1084-I1088 WeakPolarHBondContact O-CD1 3.47Å; L1084-I1088 VanDerWaalsContact O-CG1 3.26Å; L1084-I1088 WeakPolarHBondContact O-CG1 3.35Å; L1084-I1088 PolarHBondContact O-N 3.11Å; L1084-L1107 HydrophobicContact CD2-CB 4.33Å; L1084-L1107 HydrophobicContact CD2-CD2 4.19Å; L1084-L1107 HydrophobicContact CD2-CG 4.31Å; L1084-L1107 WeakPolarHBondContact CD2-O 3.49Å
1085	T	85.8	Confident	79.1	Confident	52.2 Å²	52.2	73.9 Å²	73.9	32%	0.32	36%	0.356	S	S	.	.	H	α-helix	trans	-61.8	-44.4	177.3	-55.1	0	0	0	0	111.4	R1081 A1082 H1083 I1088 Q1089 I1322	R1081-T1085 WeakPolarHBondContact O-CB 3.36Å; R1081-T1085 PolarHBondContact O-N 2.98Å; R1081-T1085 PolarHBondContact O-OG1 3.17Å; R1081-T1085 VanDerWaalsContact O-OG1 3.06Å; A1082-T1085 PolarHBondContact O-N 2.96Å; H1083-T1085 VanDerWaalsContact C-N 3.31Å; H1083-T1085 PolarHBondContact O-N 3.15Å; T1085-I1088 PolarHBondContact O-N 3.21Å; T1085-Q1089 WeakPolarHBondContact O-CB 3.25Å; T1085-Q1089 VanDerWaalsContact O-CG 3.3Å; T1085-Q1089 WeakPolarHBondContact O-CG 3.38Å; T1085-Q1089 PolarHBondContact O-N 3.27Å; T1085-Q1089 VanDerWaalsContact O-N 3.08Å; T1085-I1322 HydrophobicContact CG2-CD1 4.39Å; T1085-I1322 HydrophobicContact CG2-CG2 4.32Å
1086	R	85.1	Confident	77.2	Confident	47.4 Å²	47.4	78.3 Å²	78.3	18%	0.179	39%	0.387	C	S	.	.	H	α-helix	trans	-65.5	-40.3	175.8	-70.8	179.9	-147	-171.7	0.8	112	A1082 H1083 L1084 I1088 Q1089 S1090 D1111 Q1296 I1322 D1323	A1082-R1086 WeakPolarHBondContact O-CG 3.38Å; A1082-R1086 PolarHBondContact O-N 3.04Å; H1083-R1086 PolarHBondContact O-N 3.24Å; L1084-R1086 PolarHBondContact O-N 3.16Å; R1086-I1088 VanDerWaalsContact C-N 3.34Å; R1086-I1088 PolarHBondContact O-N 2.89Å; R1086-Q1089 PolarHBondContact O-N 3.26Å; R1086-S1090 WeakPolarHBondContact O-CB 3.38Å; R1086-S1090 PolarHBondContact O-N 3.26Å; R1086-D1111 WeakPolarHBondContact CD-OD2 3.18Å; R1086-D1111 IonicContact CZ-OD2 3.06Å; R1086-D1111 IonicContact NE-OD2 3.17Å; R1086-D1111 PolarHBondContact NE-OD2 3.06Å; R1086-D1111 VanDerWaalsContact NH1-CG 3.28Å; R1086-D1111 IonicContact NH1-OD2 3.35Å; R1086-D1111 PolarHBondContact NH1-OD2 3.28Å; R1086-D1111 IonicContact NH2-OD2 3.56Å; R1086-D1111 PolarHBondContact NH2-OD2 3.39Å; R1086-Q1296 PolarHBondContact NH1-O 3.01Å; R1086-Q1296 VanDerWaalsContact NH1-O 3.14Å; R1086-Q1296 PolarHBondContact NH2-O 3.21Å; R1086-I1322 HydrophobicContact CG-CD1 3.53Å; R1086-I1322 VanDerWaalsContact CG-CD1 3.48Å; R1086-D1323 IonicContact CZ-OD2 3.41Å; R1086-D1323 IonicContact NH2-OD2 3.51Å; R1086-D1323 PolarHBondContact NH2-OD2 2.94Å
1087	A	81.5	Confident	75.3	Confident	18.6 Å²	18.6	81 Å²	81	15%	0.154	40%	0.403	C	S	.	.	H	α-helix	trans	-61	-45.8	176.3	0	0	0	0	0	111.1	H1083 L1084 S1090 T1091 L1107	H1083-A1087 WeakPolarHBondContact O-CB 3.36Å; H1083-A1087 PolarHBondContact O-N 3.22Å; L1084-A1087 PolarHBondContact O-N 2.96Å; A1087-S1090 CarbonylContact O-C 3.48Å; A1087-S1090 WeakPolarHBondContact O-CA 3.41Å; A1087-S1090 WeakPolarHBondContact O-CB 3.25Å; A1087-S1090 PolarHBondContact O-N 3.29Å; A1087-S1090 VanDerWaalsContact O-N 3.08Å; A1087-S1090 PolarHBondContact O-OG 3.15Å; A1087-T1091 WeakPolarHBondContact O-CG2 3.4Å; A1087-T1091 PolarHBondContact O-N 3.32Å; A1087-T1091 VanDerWaalsContact O-N 3.11Å; A1087-T1091 PolarHBondContact O-OG1 3.21Å; A1087-L1107 HydrophobicContact CB-CD2 4.3Å
1088	I	80.5	Confident	72.9	Confident	81.8 Å²	81.8	84.5 Å²	84.5	42%	0.419	42%	0.42	S	S	.	.	H	α-helix	trans	-61.9	-48.5	176.6	-67.4	165.5	0	0	0	111.1	L1084 T1085 R1086 S1090 T1091 E1092	L1084-I1088 HydrophobicContact CD2-CD1 3.51Å; L1084-I1088 VanDerWaalsContact CD2-CD1 3.47Å; L1084-I1088 HydrophobicContact CD2-CG1 4.37Å; L1084-I1088 HydrophobicContact CG-CD1 4.09Å; L1084-I1088 WeakPolarHBondContact O-CB 3.35Å; L1084-I1088 WeakPolarHBondContact O-CD1 3.47Å; L1084-I1088 VanDerWaalsContact O-CG1 3.26Å; L1084-I1088 WeakPolarHBondContact O-CG1 3.35Å; L1084-I1088 PolarHBondContact O-N 3.11Å; T1085-I1088 PolarHBondContact O-N 3.21Å; R1086-I1088 VanDerWaalsContact C-N 3.34Å; R1086-I1088 PolarHBondContact O-N 2.89Å; I1088-S1090 VanDerWaalsContact C-N 3.25Å; I1088-S1090 PolarHBondContact O-N 3.04Å; I1088-T1091 VanDerWaalsContact CA-OG1 3.28Å; I1088-T1091 WeakPolarHBondContact CA-OG1 3.37Å; I1088-T1091 WeakPolarHBondContact O-CA 3.22Å; I1088-T1091 PolarHBondContact O-N 3.08Å; I1088-T1091 PolarHBondContact O-OG1 3.17Å; I1088-E1092 HydrophobicContact CG2-CG 4.46Å; I1088-E1092 PolarHBondContact O-N 3.1Å
1089	Q	78.1	Confident	70.5	Confident	98 Å²	98	87.4 Å²	87.4	46%	0.458	44%	0.441	S	S	.	.	H	α-helix	trans	-58.7	-36.5	176.6	-73.9	175.3	-15.3	0	0	112.2	T1085 R1086 T1091 E1092 N1093	T1085-Q1089 WeakPolarHBondContact O-CB 3.25Å; T1085-Q1089 VanDerWaalsContact O-CG 3.3Å; T1085-Q1089 WeakPolarHBondContact O-CG 3.38Å; T1085-Q1089 PolarHBondContact O-N 3.27Å; T1085-Q1089 VanDerWaalsContact O-N 3.08Å; R1086-Q1089 PolarHBondContact O-N 3.26Å; Q1089-T1091 VanDerWaalsContact C-N 3.32Å; Q1089-T1091 PolarHBondContact O-N 3.27Å; Q1089-E1092 PolarHBondContact O-N 2.96Å; Q1089-N1093 WeakPolarHBondContact O-CB 3.33Å; Q1089-N1093 PolarHBondContact O-N 3.21Å; Q1089-N1093 VanDerWaalsContact O-N 3.09Å; Q1089-N1093 PolarHBondContact O-ND2 2.9Å
1090	S	73.3	Confident	68	Low	44.8 Å²	44.8	94.7 Å²	94.7	31%	0.313	48%	0.48	S	S	.	.	H	α-helix	trans	-69.7	-33.1	175.4	81.2	0	0	0	0	112.9	R1086 A1087 I1088 N1093 K1094	R1086-S1090 WeakPolarHBondContact O-CB 3.38Å; R1086-S1090 PolarHBondContact O-N 3.26Å; A1087-S1090 CarbonylContact O-C 3.48Å; A1087-S1090 WeakPolarHBondContact O-CA 3.41Å; A1087-S1090 WeakPolarHBondContact O-CB 3.25Å; A1087-S1090 PolarHBondContact O-N 3.29Å; A1087-S1090 VanDerWaalsContact O-N 3.08Å; A1087-S1090 PolarHBondContact O-OG 3.15Å; I1088-S1090 VanDerWaalsContact C-N 3.25Å; I1088-S1090 PolarHBondContact O-N 3.04Å; S1090-N1093 PolarHBondContact O-N 3.13Å; S1090-K1094 WeakPolarHBondContact O-CB 3.3Å; S1090-K1094 VanDerWaalsContact O-CG 3.29Å; S1090-K1094 WeakPolarHBondContact O-CG 3.41Å; S1090-K1094 PolarHBondContact O-N 3.01Å; S1090-K1094 VanDerWaalsContact O-N 3.13Å
1091	T	65.9	Low	65.5	Low	52.8 Å²	52.8	92.8 Å²	92.8	32%	0.324	49%	0.487	S	S	.	.	H	α-helix	trans	-73.7	-38.6	176.2	51.6	0	0	0	0	112.5	A1087 I1088 Q1089 N1093 K1094 L1095 P1104 T1105	A1087-T1091 WeakPolarHBondContact O-CG2 3.4Å; A1087-T1091 PolarHBondContact O-N 3.32Å; A1087-T1091 VanDerWaalsContact O-N 3.11Å; A1087-T1091 PolarHBondContact O-OG1 3.21Å; I1088-T1091 VanDerWaalsContact CA-OG1 3.28Å; I1088-T1091 WeakPolarHBondContact CA-OG1 3.37Å; I1088-T1091 WeakPolarHBondContact O-CA 3.22Å; I1088-T1091 PolarHBondContact O-N 3.08Å; I1088-T1091 PolarHBondContact O-OG1 3.17Å; Q1089-T1091 VanDerWaalsContact C-N 3.32Å; Q1089-T1091 PolarHBondContact O-N 3.27Å; T1091-N1093 PolarHBondContact O-N 3.26Å; T1091-K1094 PolarHBondContact O-N 3.18Å; T1091-K1094 VanDerWaalsContact O-N 3.17Å; T1091-L1095 WeakPolarHBondContact O-CG 3.45Å; T1091-L1095 PolarHBondContact O-N 3.07Å; T1091-L1095 VanDerWaalsContact O-N 3.13Å; T1091-P1104 HydrophobicContact CG2-CG 3.82Å; T1091-T1105 HydrophobicContact CG2-CG2 3.79Å
1092	E	61.7	Low	63.1	Low	124.8 Å²	124.8	91.2 Å²	91.2	58%	0.583	50%	0.499	S	S	*	.	H	α-helix	trans	-64.3	-40.7	175.7	-72.2	179.8	167.6	0	0	111.5	I1088 Q1089 K1094 L1095 S1096	I1088-E1092 HydrophobicContact CG2-CG 4.46Å; I1088-E1092 PolarHBondContact O-N 3.1Å; Q1089-E1092 PolarHBondContact O-N 2.96Å; E1092-K1094 VanDerWaalsContact C-N 3.32Å; E1092-K1094 PolarHBondContact O-N 3.06Å; E1092-L1095 PolarHBondContact O-N 3.3Å; E1092-L1095 VanDerWaalsContact O-N 3.16Å; E1092-S1096 PolarHBondContact O-N 3.17Å; E1092-S1096 PolarHBondContact O-OG 2.84Å
1093	N	57.1	Low	60.8	Low	116.8 Å²	116.8	99.8 Å²	99.8	63%	0.625	53%	0.533	S	S	*	.	H	α-helix	trans	-68.5	-31.1	174.6	-74.7	-16.2	0	0	0	112.9	Q1089 S1090 T1091 L1095 S1096 V1097	Q1089-N1093 WeakPolarHBondContact O-CB 3.33Å; Q1089-N1093 PolarHBondContact O-N 3.21Å; Q1089-N1093 VanDerWaalsContact O-N 3.09Å; Q1089-N1093 PolarHBondContact O-ND2 2.9Å; S1090-N1093 PolarHBondContact O-N 3.13Å; T1091-N1093 PolarHBondContact O-N 3.26Å; N1093-L1095 VanDerWaalsContact C-N 3.32Å; N1093-L1095 PolarHBondContact O-N 2.91Å; N1093-S1096 PolarHBondContact O-N 3.07Å; N1093-S1096 PolarHBondContact O-OG 3.05Å; N1093-S1096 VanDerWaalsContact O-OG 3.1Å; N1093-V1097 PolarHBondContact O-N 2.6Å
1094	K	53.1	Low	58.6	Low	124.8 Å²	124.8	103 Å²	103	54%	0.543	56%	0.557	S	S	.	*	H	α-helix	trans	-74.1	-28.2	176.1	-78.2	177.9	-179.4	-178.1	0	113.4	S1090 T1091 E1092 S1096 V1097 Y1103	S1090-K1094 WeakPolarHBondContact O-CB 3.3Å; S1090-K1094 VanDerWaalsContact O-CG 3.29Å; S1090-K1094 WeakPolarHBondContact O-CG 3.41Å; S1090-K1094 PolarHBondContact O-N 3.01Å; S1090-K1094 VanDerWaalsContact O-N 3.13Å; T1091-K1094 PolarHBondContact O-N 3.18Å; T1091-K1094 VanDerWaalsContact O-N 3.17Å; E1092-K1094 VanDerWaalsContact C-N 3.32Å; E1092-K1094 PolarHBondContact O-N 3.06Å; K1094-S1096 VanDerWaalsContact C-N 3.28Å; K1094-S1096 PolarHBondContact O-N 3.11Å; K1094-V1097 CarbonylContact O-C 3.38Å; K1094-V1097 PolarHBondContact O-N 3.3Å; K1094-V1097 VanDerWaalsContact O-N 3.11Å; K1094-V1097 VanDerWaalsContact O-O 3.09Å; K1094-Y1103 PolarHBondContact NZ-O 3.24Å
1095	L	51.9	Low	56.7	Low	153.6 Å²	153.6	103.2 Å²	103.2	80%	0.804	56%	0.562	S	S	*	*	H	α-helix	trans	-69	-17.7	175.6	-78	160.8	0	0	0	113	T1091 E1092 N1093 V1097	T1091-L1095 WeakPolarHBondContact O-CG 3.45Å; T1091-L1095 PolarHBondContact O-N 3.07Å; T1091-L1095 VanDerWaalsContact O-N 3.13Å; E1092-L1095 PolarHBondContact O-N 3.3Å; E1092-L1095 VanDerWaalsContact O-N 3.16Å; N1093-L1095 VanDerWaalsContact C-N 3.32Å; N1093-L1095 PolarHBondContact O-N 2.91Å; L1095-V1097 PolarHBondContact O-N 3.18Å
1096	S	51.8	Low	55.1	Low	93 Å²	93	106.6 Å²	106.6	65%	0.65	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90	-10.6	175.4	56.2	0	0	0	0	114.9	E1092 N1093 K1094	E1092-S1096 PolarHBondContact O-N 3.17Å; E1092-S1096 PolarHBondContact O-OG 2.84Å; N1093-S1096 PolarHBondContact O-N 3.07Å; N1093-S1096 PolarHBondContact O-OG 3.05Å; N1093-S1096 VanDerWaalsContact O-OG 3.1Å; K1094-S1096 VanDerWaalsContact C-N 3.28Å; K1094-S1096 PolarHBondContact O-N 3.11Å
1097	V	48.1	Very low	53.8	Low	105 Å²	105	109.6 Å²	109.6	64%	0.636	60%	0.598	S	S	*	*	S	Bend	trans	-125.6	103.5	179.6	-174.8	0	0	0	0	109.5	N1093 K1094 L1095 N1099	N1093-V1097 PolarHBondContact O-N 2.6Å; K1094-V1097 CarbonylContact O-C 3.38Å; K1094-V1097 PolarHBondContact O-N 3.3Å; K1094-V1097 VanDerWaalsContact O-N 3.11Å; K1094-V1097 VanDerWaalsContact O-O 3.09Å; L1095-V1097 PolarHBondContact O-N 3.18Å; V1097-N1099 PolarHBondContact O-N 3.08Å
1098	Q	38.4	Very low	52.8	Low	174.8 Å²	174.8	117.5 Å²	117.5	82%	0.817	63%	0.631	S	S	*	*			trans	-59	123.9	168.8	-70.2	179	-9.9	0	0	109.8
1099	N	39	Very low	52.3	Low	138 Å²	138	114.9 Å²	114.9	74%	0.738	62%	0.624	S	S	*	*	S	Bend	trans	132.8	117.6	149.4	-67.1	-27.2	0	0	0	115.3	V1097 S1101	V1097-N1099 PolarHBondContact O-N 3.08Å; N1099-S1101 PolarHBondContact O-N 3.35Å
1100	N	36.5	Very low	52.5	Low	154 Å²	154	111.8 Å²	111.8	82%	0.824	61%	0.613	S	S	*	*			trans	48.1	89.2	142.7	-61.6	-12.5	0	0	0	119.8
1101	S	38.6	Very low	53.2	Low	94.4 Å²	94.4	110.4 Å²	110.4	66%	0.66	60%	0.602	S	S	*	*			trans	-169.3	112	132.4	54.2	0	0	0	0	112.4	N1099 Y1103	N1099-S1101 PolarHBondContact O-N 3.35Å; S1101-Y1103 VanDerWaalsContact C-N 3.3Å; S1101-Y1103 PolarHBondContact O-N 3.21Å; S1101-Y1103 VanDerWaalsContact O-N 3.15Å
1102	S	37.2	Very low	54.3	Low	118.6 Å²	118.6	108 Å²	108	83%	0.829	59%	0.587	S	S	*	*			trans	-91.4	90.5	173.4	49.2	0	0	0	0	110.6
1103	Y	38.7	Very low	55.8	Low	183.4 Å²	183.4	102.1 Å²	102.1	72%	0.719	56%	0.56	S	S	*	*			trans	-84.6	127.2	160.9	-72.7	-80.6	0	0	0	108.6	K1094 S1101 T1105	K1094-Y1103 PolarHBondContact NZ-O 3.24Å; S1101-Y1103 VanDerWaalsContact C-N 3.3Å; S1101-Y1103 PolarHBondContact O-N 3.21Å; S1101-Y1103 VanDerWaalsContact O-N 3.15Å; Y1103-T1105 PolarHBondContact O-N 3.11Å; Y1103-T1105 VanDerWaalsContact O-N 3.1Å
1104	P	41.3	Very low	57.6	Low	108.2 Å²	108.2	96.5 Å²	96.5	70%	0.703	53%	0.53	S	S	*	.			trans	-65.7	109.5	177.3	26.2	-31.3	0	0	0	109	T1091 N1106 L1107	T1091-P1104 HydrophobicContact CG2-CG 3.82Å; P1104-N1106 VanDerWaalsContact C-N 3.25Å; P1104-N1106 PolarHBondContact O-N 3.07Å; P1104-N1106 VanDerWaalsContact O-N 3.1Å; P1104-L1107 WeakPolarHBondContact O-CD1 3.41Å
1105	T	46.6	Very low	59.7	Low	83.2 Å²	83.2	90.6 Å²	90.6	51%	0.51	50%	0.504	S	S	.	.			trans	-71.8	73.3	174.6	44.8	0	0	0	0	109.9	T1091 Y1103 L1107	T1091-T1105 HydrophobicContact CG2-CG2 3.79Å; Y1103-T1105 PolarHBondContact O-N 3.11Å; Y1103-T1105 VanDerWaalsContact O-N 3.1Å; T1105-L1107 PolarHBondContact O-N 3.19Å
1106	N	51.8	Low	61.8	Low	122.8 Å²	122.8	83.3 Å²	83.3	66%	0.657	47%	0.466	S	S	*	.			trans	-90.4	74.6	177.1	-117.9	-3.1	0	0	0	110.9	H1083 P1104 Q1108 G1109	H1083-N1106 PolarHBondContact NE2-O 3.2Å; H1083-N1106 VanDerWaalsContact NE2-O 3.15Å; P1104-N1106 VanDerWaalsContact C-N 3.25Å; P1104-N1106 PolarHBondContact O-N 3.07Å; P1104-N1106 VanDerWaalsContact O-N 3.1Å; N1106-Q1108 PolarHBondContact O-N 3.2Å; N1106-Q1108 PolarHBondContact OD1-N 2.96Å; N1106-G1109 PolarHBondContact O-N 3.33Å
1107	L	58	Low	63.9	Low	111.2 Å²	111.2	78.8 Å²	78.8	58%	0.582	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	3.8	173.3	-77.8	130.4	0	0	0	112.4	L1084 A1087 P1104 T1105 G1109	L1084-L1107 HydrophobicContact CD2-CB 4.33Å; L1084-L1107 HydrophobicContact CD2-CD2 4.19Å; L1084-L1107 HydrophobicContact CD2-CG 4.31Å; L1084-L1107 WeakPolarHBondContact CD2-O 3.49Å; A1087-L1107 HydrophobicContact CB-CD2 4.3Å; P1104-L1107 WeakPolarHBondContact O-CD1 3.41Å; T1105-L1107 PolarHBondContact O-N 3.19Å; L1107-G1109 PolarHBondContact O-N 3.13Å; L1107-G1109 VanDerWaalsContact O-N 3.15Å
1108	Q	61.2	Low	66.1	Low	184.4 Å²	184.4	74.2 Å²	74.2	86%	0.862	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	51.3	180	-83.8	-179.5	-10	0	0	112.6	N1106 C1110	N1106-Q1108 PolarHBondContact O-N 3.2Å; N1106-Q1108 PolarHBondContact OD1-N 2.96Å; Q1108-C1110 PolarHBondContact O-N 3.34Å
1109	G	70.9	Confident	68.6	Low	26.8 Å²	26.8	66.2 Å²	66.2	28%	0.276	37%	0.371	S	S	.	.			trans	-101.4	167	168.6	0	0	0	0	0	115.5	H1083 N1106 L1107	H1083-G1109 VanDerWaalsContact CD2-C 3.43Å; H1083-G1109 VanDerWaalsContact CD2-CA 3.47Å; H1083-G1109 WeakPolarHBondContact CD2-CA 3.34Å; H1083-G1109 PolarHBondContact CD2-N 3.17Å; H1083-G1109 PolarHBondContact CD2-O 2.96Å; H1083-G1109 VanDerWaalsContact CG-C 3.47Å; H1083-G1109 VanDerWaalsContact NE2-CA 3.33Å; H1083-G1109 WeakPolarHBondContact NE2-CA 3.34Å; N1106-G1109 PolarHBondContact O-N 3.33Å; L1107-G1109 PolarHBondContact O-N 3.13Å; L1107-G1109 VanDerWaalsContact O-N 3.15Å
1110	C	81.7	Confident	70.9	Confident	31.4 Å²	31.4	62.2 Å²	62.2	21%	0.212	35%	0.354	C	S	.	.			trans	-143.6	131	174.4	-174	0	0	0	0	108.6	T1076 G1079 R1080 Q1108 K1300	T1076-C1110 PolarHBondContact O-SG 3.22Å; G1079-C1110 VanDerWaalsContact C-SG 3.55Å; R1080-C1110 HydrophobicContact CG-CB 3.92Å; R1080-C1110 PolarHBondContact N-SG 3.12Å; R1080-C1110 VanDerWaalsContact N-SG 3.42Å; Q1108-C1110 PolarHBondContact O-N 3.34Å; C1110-K1300 HydrophobicContact CB-CB 4.4Å; C1110-K1300 VanDerWaalsContact O-CB 3.28Å; C1110-K1300 WeakPolarHBondContact O-CB 3.4Å
1111	D	86.9	Confident	73.2	Confident	16.8 Å²	16.8	57.6 Å²	57.6	9%	0.09	33%	0.329	C	S	.	.			trans	-88.7	160.6	171.4	-63.3	-18.4	0	0	0	109.8	G1079 H1083 R1086	G1079-D1111 VanDerWaalsContact CA-O 3.23Å; G1079-D1111 WeakPolarHBondContact CA-O 3.36Å; G1079-D1111 PolarHBondContact O-N 3.29Å; G1079-D1111 VanDerWaalsContact O-N 3.11Å; H1083-D1111 VanDerWaalsContact CA-OD2 3.26Å; H1083-D1111 WeakPolarHBondContact CA-OD2 3.27Å; H1083-D1111 HydrophobicContact CB-CB 4.38Å; H1083-D1111 IonicContact CE1-OD1 3.47Å; H1083-D1111 IonicContact CG-OD1 3.02Å; H1083-D1111 PolarHBondContact N-OD2 3.22Å; H1083-D1111 IonicContact ND1-OD1 2.99Å; H1083-D1111 PolarHBondContact ND1-OD1 3.21Å; H1083-D1111 IonicContact ND1-OD2 3.46Å; R1086-D1111 WeakPolarHBondContact CD-OD2 3.18Å; R1086-D1111 IonicContact CZ-OD2 3.06Å; R1086-D1111 IonicContact NE-OD2 3.17Å; R1086-D1111 PolarHBondContact NE-OD2 3.06Å; R1086-D1111 VanDerWaalsContact NH1-CG 3.28Å; R1086-D1111 IonicContact NH1-OD2 3.35Å; R1086-D1111 PolarHBondContact NH1-OD2 3.28Å; R1086-D1111 IonicContact NH2-OD2 3.56Å; R1086-D1111 PolarHBondContact NH2-OD2 3.39Å
1112	G	89.2	Confident	75.3	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.01	31%	0.309	C	S	.	.			trans	-65.6	166.2	161.6	0	0	0	0	0	110.7	L1298 P1299 V1302	G1112-L1298 PolarHBondContact N-O 3.14Å; G1112-P1299 WeakPolarHBondContact CA-O 3.32Å; G1112-P1299 PolarHBondContact N-O 3.08Å; G1112-V1302 VanDerWaalsContact CA-O 3.26Å; G1112-V1302 WeakPolarHBondContact CA-O 3.35Å
1113	S	93.7	Very high	77.7	Confident	1.4 Å²	1.4	49.1 Å²	49.1	1%	0.01	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	163	-171.9	53.9	0	0	0	0	112.6	L1075 R1303 F1304 D1323	L1075-S1113 VanDerWaalsContact CB-OG 3.28Å; L1075-S1113 WeakPolarHBondContact CB-OG 3.28Å; L1075-S1113 PolarHBondContact O-OG 3.35Å; L1075-S1113 VanDerWaalsContact O-OG 3.09Å; S1113-R1303 WeakPolarHBondContact O-CA 3.25Å; S1113-F1304 PolarHBondContact O-N 3.17Å; S1113-F1304 VanDerWaalsContact O-N 3.11Å; S1113-D1323 WeakPolarHBondContact CA-O 3.3Å; S1113-D1323 WeakPolarHBondContact CB-O 3.43Å
1114	I	95.5	Very high	80	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	126.3	-175.5	-56.8	155.7	0	0	0	108.5	L1294 L1298 F1304 L1306 D1323 C1324 Q1325	I1114-L1294 HydrophobicContact CD1-CD2 3.67Å; I1114-L1294 HydrophobicContact CD1-CG 4.47Å; I1114-L1294 HydrophobicContact CG1-CD2 4.45Å; I1114-L1298 HydrophobicContact CD1-CD1 4.31Å; I1114-L1298 HydrophobicContact CG1-CD1 3.79Å; I1114-F1304 CarbonylContact C-O 3.53Å; I1114-F1304 WeakPolarHBondContact CA-O 3.36Å; I1114-F1304 HydrophobicContact CB-CB 4.46Å; I1114-F1304 HydrophobicContact CG1-CB 4.11Å; I1114-F1304 HydrophobicContact CG2-CB 4.23Å; I1114-L1306 HydrophobicContact CG2-CD1 3.97Å; I1114-L1306 HydrophobicContact CG2-CG 4.31Å; I1114-D1323 PolarHBondContact N-O 3.18Å; I1114-C1324 HydrophobicContact CB-CB 4.42Å; I1114-C1324 CarbonylContact O-C 3.52Å; I1114-C1324 WeakPolarHBondContact O-CA 3.26Å; I1114-Q1325 PolarHBondContact O-N 2.93Å
1115	L	96.6	Very high	82.4	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	117.7	165.5	179	62.2	0	0	0	108.8	A1071 F1072 L1075 I1117 L1132 F1304 V1305 L1306 Q1325 L1327	A1071-L1115 HydrophobicContact CB-CD1 3.86Å; A1071-L1115 HydrophobicContact CB-CD2 4.4Å; F1072-L1115 HydrophobicContact CB-CD2 4.24Å; F1072-L1115 HydrophobicContact CD2-CD2 4.37Å; L1075-L1115 HydrophobicContact CD1-CB 3.96Å; L1075-L1115 HydrophobicContact CD2-CB 4.01Å; L1075-L1115 HydrophobicContact CG-CB 4.35Å; L1115-I1117 HydrophobicContact CD2-CD1 4.35Å; L1115-I1117 HydrophobicContact CD2-CG1 4.31Å; L1115-I1117 HydrophobicContact CG-CG1 4.1Å; L1115-L1132 HydrophobicContact CD2-CD2 4.17Å; L1115-F1304 PolarHBondContact N-O 3.09Å; L1115-V1305 HydrophobicContact CB-CG1 4.28Å; L1115-V1305 HydrophobicContact CB-CG2 4.28Å; L1115-V1305 HydrophobicContact CD2-CG1 4.1Å; L1115-V1305 HydrophobicContact CD2-CG2 4.49Å; L1115-V1305 HydrophobicContact CG-CG1 4.3Å; L1115-V1305 CarbonylContact O-C 3.5Å; L1115-V1305 VanDerWaalsContact O-CA 3.3Å; L1115-V1305 WeakPolarHBondContact O-CA 3.33Å; L1115-L1306 PolarHBondContact O-N 3.02Å; L1115-Q1325 HydrophobicContact CD1-CB 4.46Å; L1115-Q1325 HydrophobicContact CD1-CG 4.34Å; L1115-L1327 HydrophobicContact CD1-CB 4.11Å
1116	L	96.4	Very high	84.5	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	113.1	175.9	179.7	63.8	0	0	0	109.4	V1118 L1306 C1308 A1315 L1318 Q1325 L1326 L1327	L1116-V1118 HydrophobicContact CD1-CG1 4.44Å; L1116-V1118 HydrophobicContact CD1-CG2 4.18Å; L1116-V1118 HydrophobicContact CD2-CG1 4.09Å; L1116-V1118 HydrophobicContact CD2-CG2 3.98Å; L1116-V1118 HydrophobicContact CG-CG1 3.88Å; L1116-V1118 HydrophobicContact CG-CG2 3.64Å; L1116-L1306 CarbonylContact C-O 3.52Å; L1116-L1306 WeakPolarHBondContact CA-O 3.31Å; L1116-L1306 HydrophobicContact CD1-CB 4.16Å; L1116-C1308 HydrophobicContact CD1-CB 4.23Å; L1116-C1308 VanDerWaalsContact CD1-SG 3.53Å; L1116-A1315 HydrophobicContact CD2-CB 4.37Å; L1116-L1318 HydrophobicContact CD1-CD1 3.84Å; L1116-L1318 HydrophobicContact CD2-CB 3.88Å; L1116-L1318 HydrophobicContact CD2-CD1 4.39Å; L1116-Q1325 PolarHBondContact N-O 3.08Å; L1116-L1326 HydrophobicContact CB-CD1 4.35Å; L1116-L1326 HydrophobicContact CD2-CD1 4.03Å; L1116-L1326 HydrophobicContact CG-CD1 4.19Å; L1116-L1327 PolarHBondContact O-N 3.18Å
1117	I	95.9	Very high	86.3	Confident	0 Å²	0	30 Å²	30	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	115.5	178	-54.8	178.4	0	0	0	108.9	V1068 L1115 Y1128 V1305 L1306 T1307 C1308 L1327 V1329	V1068-I1117 HydrophobicContact CG1-CD1 3.88Å; V1068-I1117 HydrophobicContact CG2-CD1 3.9Å; L1115-I1117 HydrophobicContact CD2-CD1 4.35Å; L1115-I1117 HydrophobicContact CD2-CG1 4.31Å; L1115-I1117 HydrophobicContact CG-CG1 4.1Å; I1117-Y1128 HydrophobicContact CG2-CD1 4.35Å; I1117-V1305 HydrophobicContact CD1-CG1 3.83Å; I1117-V1305 HydrophobicContact CG1-CG1 4.29Å; I1117-L1306 PolarHBondContact N-O 3.09Å; I1117-T1307 HydrophobicContact CB-CG2 3.92Å; I1117-T1307 HydrophobicContact CD1-CG2 4.43Å; I1117-T1307 HydrophobicContact CG2-CG2 4.35Å; I1117-T1307 VanDerWaalsContact O-CA 3.24Å; I1117-T1307 WeakPolarHBondContact O-CA 3.28Å; I1117-C1308 PolarHBondContact O-N 3Å; I1117-C1308 VanDerWaalsContact O-N 3.14Å; I1117-L1327 CarbonylContact C-O 3.56Å; I1117-L1327 WeakPolarHBondContact CA-O 3.36Å; I1117-L1327 HydrophobicContact CG1-CB 4.49Å; I1117-L1327 HydrophobicContact CG1-CD2 4.33Å; I1117-L1327 HydrophobicContact CG2-CD2 4.09Å; I1117-V1329 HydrophobicContact CG2-CG2 3.64Å
1118	V	94.5	Very high	87.9	Confident	8.8 Å²	8.8	24.9 Å²	24.9	5%	0.053	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	143.2	-174.7	-137.1	0	0	0	0	111	L1116 C1308 S1310 A1315 L1326 L1327 T1328 V1329	L1116-V1118 HydrophobicContact CD1-CG1 4.44Å; L1116-V1118 HydrophobicContact CD1-CG2 4.18Å; L1116-V1118 HydrophobicContact CD2-CG1 4.09Å; L1116-V1118 HydrophobicContact CD2-CG2 3.98Å; L1116-V1118 HydrophobicContact CG-CG1 3.88Å; L1116-V1118 HydrophobicContact CG-CG2 3.64Å; V1118-C1308 WeakPolarHBondContact CA-O 3.31Å; V1118-S1310 VanDerWaalsContact CG1-N 3.3Å; V1118-A1315 HydrophobicContact CG1-CB 4.18Å; V1118-A1315 HydrophobicContact CG2-CB 4.27Å; V1118-L1326 HydrophobicContact CB-CD1 3.98Å; V1118-L1326 HydrophobicContact CG1-CD1 3.67Å; V1118-L1326 HydrophobicContact CG2-CD1 3.37Å; V1118-L1326 VanDerWaalsContact CG2-CD1 3.49Å; V1118-L1326 HydrophobicContact CG2-CG 4.2Å; V1118-L1327 PolarHBondContact N-O 3.18Å; V1118-T1328 HydrophobicContact CB-CG2 4.42Å; V1118-T1328 HydrophobicContact CG2-CG2 4.21Å; V1118-T1328 WeakPolarHBondContact CG2-OG1 3.45Å; V1118-T1328 CarbonylContact O-C 3.41Å; V1118-T1328 VanDerWaalsContact O-CA 3.31Å; V1118-T1328 WeakPolarHBondContact O-CA 3.28Å; V1118-V1329 PolarHBondContact O-N 3.15Å
1119	G	90.1	Very high	89.4	Confident	5 Å²	5	16.2 Å²	16.2	5%	0.052	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.4	162.8	177.4	0	0	0	0	0	111.4	K1125	G1119-K1125 PolarHBondContact O-NZ 3.35Å
1120	S	87.3	Confident	90.3	Very high	54.8 Å²	54.8	14.9 Å²	14.9	38%	0.383	10%	0.1	S	C	.	.			trans	-61	164.5	174	59.4	0	0	0	0	111.4	G1122 S1123 K1125	S1120-G1122 PolarHBondContact O-N 3.16Å; S1120-S1123 VanDerWaalsContact O-CB 3.27Å; S1120-S1123 WeakPolarHBondContact O-CB 3.37Å; S1120-S1123 PolarHBondContact O-N 3.08Å; S1120-S1123 VanDerWaalsContact O-N 3.17Å; S1120-S1123 PolarHBondContact O-OG 3.42Å; S1120-S1123 VanDerWaalsContact O-OG 3.05Å; S1120-K1125 PolarHBondContact O-NZ 2.92Å
1121	N	84.4	Confident	90.7	Very high	57.4 Å²	57.4	13.4 Å²	13.4	31%	0.307	9%	0.09	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	142	171.1	-66.4	-22.9	0	0	0	110.3	S1123 D1309 E1572	N1121-S1123 VanDerWaalsContact C-N 3.28Å; N1121-S1123 PolarHBondContact O-N 3.06Å; N1121-S1123 VanDerWaalsContact O-N 3.1Å; N1121-D1309 PolarHBondContact OD1-OD2 3.11Å; N1121-E1572 HydrophobicContact CB-CB 4.19Å; N1121-E1572 WeakPolarHBondContact CB-OE2 3.47Å
1122	G	83.3	Confident	90.9	Very high	23.6 Å²	23.6	12.6 Å²	12.6	24%	0.243	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.5	1.9	-177.5	0	0	0	0	0	116.4	S1120 G1124 I1372 P1373 L1374	S1120-G1122 PolarHBondContact O-N 3.16Å; G1122-G1124 VanDerWaalsContact C-N 3.26Å; G1122-G1124 PolarHBondContact O-N 2.96Å; G1122-I1372 VanDerWaalsContact C-CG2 3.49Å; G1122-I1372 VanDerWaalsContact O-CG2 3.3Å; G1122-I1372 WeakPolarHBondContact O-CG2 3.33Å; G1122-P1373 WeakPolarHBondContact O-CD 3.33Å; G1122-L1374 PolarHBondContact O-N 3.11Å
1123	S	87.9	Confident	91	Very high	11.8 Å²	11.8	12.6 Å²	12.6	8%	0.083	9%	0.085	C	C	.	.	S	Bend	trans	-71.1	-12.9	-179.2	67.9	0	0	0	0	114.8	S1120 N1121 K1125 V1329	S1120-S1123 VanDerWaalsContact O-CB 3.27Å; S1120-S1123 WeakPolarHBondContact O-CB 3.37Å; S1120-S1123 PolarHBondContact O-N 3.08Å; S1120-S1123 VanDerWaalsContact O-N 3.17Å; S1120-S1123 PolarHBondContact O-OG 3.42Å; S1120-S1123 VanDerWaalsContact O-OG 3.05Å; N1121-S1123 VanDerWaalsContact C-N 3.28Å; N1121-S1123 PolarHBondContact O-N 3.06Å; N1121-S1123 VanDerWaalsContact O-N 3.1Å; S1123-K1125 WeakPolarHBondContact OG-CG 3.22Å; S1123-V1329 WeakPolarHBondContact O-CG1 3.34Å
1124	G	87.8	Confident	90.7	Very high	16.4 Å²	16.4	12.8 Å²	12.8	17%	0.169	9%	0.086	C	C	.	.	S	Bend	trans	99	20.4	-179.2	0	0	0	0	0	115.6	G1122 T1126 T1127 Y1128	G1122-G1124 VanDerWaalsContact C-N 3.26Å; G1122-G1124 PolarHBondContact O-N 2.96Å; G1124-T1126 VanDerWaalsContact C-N 3.33Å; G1124-T1126 PolarHBondContact O-N 3.24Å; G1124-T1127 WeakPolarHBondContact O-CA 3.39Å; G1124-T1127 VanDerWaalsContact O-CB 3.29Å; G1124-T1127 WeakPolarHBondContact O-CB 3.29Å; G1124-T1127 PolarHBondContact O-N 3.14Å; G1124-T1127 VanDerWaalsContact O-N 3.09Å; G1124-Y1128 WeakPolarHBondContact O-CD2 3.45Å; G1124-Y1128 PolarHBondContact O-N 3.1Å
1125	K	91.2	Very high	90.3	Very high	10.8 Å²	10.8	12.9 Å²	12.9	5%	0.047	9%	0.087	C	C	.	.	H	α-helix	trans	-51.2	-49.4	177.3	-62.7	-173.9	-67.3	-80.3	0	113.2	G1119 S1120 S1123 T1127 Y1128 L1129 T1307 C1308 V1329	G1119-K1125 PolarHBondContact O-NZ 3.35Å; S1120-K1125 PolarHBondContact O-NZ 2.92Å; S1123-K1125 WeakPolarHBondContact OG-CG 3.22Å; K1125-T1127 VanDerWaalsContact C-N 3.28Å; K1125-T1127 PolarHBondContact O-N 3.27Å; K1125-Y1128 VanDerWaalsContact O-CB 3.3Å; K1125-Y1128 WeakPolarHBondContact O-CB 3.4Å; K1125-Y1128 PolarHBondContact O-N 3.22Å; K1125-Y1128 VanDerWaalsContact O-N 3.12Å; K1125-L1129 PolarHBondContact O-N 3.11Å; K1125-T1307 HydrophobicContact CB-CG2 4.25Å; K1125-C1308 VanDerWaalsContact CD-O 3.28Å; K1125-C1308 WeakPolarHBondContact CD-O 3.42Å; K1125-C1308 WeakPolarHBondContact CE-O 3.1Å; K1125-V1329 HydrophobicContact CG-CG2 4.23Å
1126	T	89.3	Confident	89.9	Confident	38.4 Å²	38.4	13 Å²	13	24%	0.236	9%	0.087	C	C	.	.	H	α-helix	trans	-57.5	-41.6	176	-49.7	0	0	0	0	111.5	Y1052 G1124 Y1128 L1129 S1130 F1192 L1196 D1281	Y1052-T1126 HydrophobicContact CE1-CG2 4.15Å; G1124-T1126 VanDerWaalsContact C-N 3.33Å; G1124-T1126 PolarHBondContact O-N 3.24Å; T1126-Y1128 VanDerWaalsContact C-N 3.34Å; T1126-Y1128 PolarHBondContact O-N 2.97Å; T1126-L1129 PolarHBondContact O-N 3.17Å; T1126-S1130 VanDerWaalsContact O-CB 3.27Å; T1126-S1130 WeakPolarHBondContact O-CB 3.28Å; T1126-S1130 PolarHBondContact O-N 3.18Å; T1126-S1130 PolarHBondContact O-OG 3Å; T1126-F1192 HydrophobicContact CG2-CD1 4.1Å; T1126-F1192 HydrophobicContact CG2-CE1 3.89Å; T1126-L1196 HydrophobicContact CG2-CD2 3.58Å; T1126-L1196 VanDerWaalsContact CG2-CD2 3.44Å; T1126-L1196 HydrophobicContact CG2-CG 4.49Å; T1126-D1281 VanDerWaalsContact CB-OD2 3.27Å; T1126-D1281 WeakPolarHBondContact CB-OD2 3.33Å; T1126-D1281 VanDerWaalsContact CG2-OD2 3.26Å; T1126-D1281 WeakPolarHBondContact CG2-OD2 3.19Å; T1126-D1281 PolarHBondContact OG1-OD1 2.93Å; T1126-D1281 PolarHBondContact OG1-OD2 2.93Å
1127	T	89.7	Confident	89.2	Confident	29.6 Å²	29.6	14.9 Å²	14.9	18%	0.182	10%	0.097	C	C	.	.	H	α-helix	trans	-63.6	-41.5	176	-56.6	0	0	0	0	112	Y1052 A1056 A1057 A1059 I1060 G1124 K1125 S1130 A1131	Y1052-T1127 PolarHBondContact OH-OG1 3.18Å; A1056-T1127 HydrophobicContact CB-CG2 3.87Å; A1056-T1127 WeakPolarHBondContact O-CG2 3.41Å; A1057-T1127 HydrophobicContact CB-CG2 3.55Å; A1059-T1127 HydrophobicContact CB-CG2 4.11Å; I1060-T1127 HydrophobicContact CB-CG2 3.7Å; I1060-T1127 HydrophobicContact CG1-CG2 4.18Å; G1124-T1127 WeakPolarHBondContact O-CA 3.39Å; G1124-T1127 VanDerWaalsContact O-CB 3.29Å; G1124-T1127 WeakPolarHBondContact O-CB 3.29Å; G1124-T1127 PolarHBondContact O-N 3.14Å; G1124-T1127 VanDerWaalsContact O-N 3.09Å; K1125-T1127 VanDerWaalsContact C-N 3.28Å; K1125-T1127 PolarHBondContact O-N 3.27Å; T1127-S1130 PolarHBondContact O-N 3.45Å; T1127-A1131 WeakPolarHBondContact O-CB 3.35Å; T1127-A1131 PolarHBondContact O-N 3.14Å
1128	Y	92.5	Very high	88.4	Confident	5.4 Å²	5.4	18 Å²	18	2%	0.021	11%	0.112	C	C	.	.	H	α-helix	trans	-61.8	-46.7	173.9	-86.2	-103.6	0	0	0	111.9	I1060 H1064 L1065 E1067 V1068 I1117 G1124 K1125 T1126 S1130 A1131 L1132 L1327 V1329	I1060-Y1128 HydrophobicContact CD1-CD2 4.43Å; I1060-Y1128 HydrophobicContact CD1-CG 4.43Å; H1064-Y1128 WeakPolarHBondContact CA-OH 2.94Å; H1064-Y1128 HydrophobicContact CB-CD1 4.28Å; H1064-Y1128 HydrophobicContact CB-CD2 4.48Å; H1064-Y1128 HydrophobicContact CB-CE1 4.12Å; H1064-Y1128 HydrophobicContact CB-CE2 3.74Å; H1064-Y1128 VanDerWaalsContact CB-CZ 3.43Å; H1064-Y1128 WeakPolarHBondContact CB-OH 3.42Å; H1064-Y1128 AromaticContact CD2-CE2 3.68Å; H1064-Y1128 AromaticContact CD2-CZ 3.85Å; H1064-Y1128 PolarHBondContact CD2-OH 2.99Å; H1064-Y1128 AromaticContact CG-CE2 3.96Å; H1064-Y1128 AromaticContact CG-CZ 3.92Å; H1064-Y1128 VanDerWaalsContact CG-OH 3.23Å; H1064-Y1128 AromaticContact ND1-CZ 3.8Å; H1064-Y1128 PolarHBondContact ND1-OH 2.87Å; H1064-Y1128 VanDerWaalsContact ND1-OH 3.1Å; L1065-Y1128 HydrophobicContact CB-CD1 4.25Å; L1065-Y1128 HydrophobicContact CB-CE1 4.46Å; E1067-Y1128 PolarHBondContact OE2-OH 3.2Å; E1067-Y1128 VanDerWaalsContact OE2-OH 3.12Å; V1068-Y1128 HydrophobicContact CB-CD1 3.66Å; V1068-Y1128 HydrophobicContact CB-CE1 4.13Å; V1068-Y1128 HydrophobicContact CB-CG 4.49Å; V1068-Y1128 HydrophobicContact CG1-CD1 4.39Å; V1068-Y1128 HydrophobicContact CG2-CD1 3.93Å; I1117-Y1128 HydrophobicContact CG2-CD1 4.35Å; G1124-Y1128 WeakPolarHBondContact O-CD2 3.45Å; G1124-Y1128 PolarHBondContact O-N 3.1Å; K1125-Y1128 VanDerWaalsContact O-CB 3.3Å; K1125-Y1128 WeakPolarHBondContact O-CB 3.4Å; K1125-Y1128 PolarHBondContact O-N 3.22Å; K1125-Y1128 VanDerWaalsContact O-N 3.12Å; T1126-Y1128 VanDerWaalsContact C-N 3.34Å; T1126-Y1128 PolarHBondContact O-N 2.97Å; Y1128-S1130 VanDerWaalsContact C-N 3.35Å; Y1128-A1131 PolarHBondContact O-N 3.1Å; Y1128-L1132 WeakPolarHBondContact O-CB 3.39Å; Y1128-L1132 PolarHBondContact O-N 3.15Å; Y1128-L1327 HydrophobicContact CD1-CD2 4.15Å; Y1128-L1327 HydrophobicContact CE1-CD2 4.16Å; Y1128-V1329 HydrophobicContact CD1-CG2 4.37Å; Y1128-V1329 HydrophobicContact CD2-CG1 4.22Å; Y1128-V1329 HydrophobicContact CD2-CG2 4.22Å; Y1128-V1329 HydrophobicContact CE1-CG2 4.36Å; Y1128-V1329 HydrophobicContact CE2-CB 4.41Å; Y1128-V1329 HydrophobicContact CE2-CG1 3.61Å; Y1128-V1329 HydrophobicContact CE2-CG2 4.13Å; Y1128-V1329 HydrophobicContact CG-CG2 4.29Å
1129	L	92.9	Very high	87.2	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-63.9	-46.1	178.8	-172.5	121.9	0	0	0	111.2	K1125 T1126 A1131 L1132 T1133 I1190 F1192 L1279 D1281 V1305 T1307	K1125-L1129 PolarHBondContact O-N 3.11Å; T1126-L1129 PolarHBondContact O-N 3.17Å; L1129-A1131 VanDerWaalsContact C-N 3.35Å; L1129-A1131 PolarHBondContact O-N 3.16Å; L1129-L1132 PolarHBondContact O-N 3.1Å; L1129-T1133 WeakPolarHBondContact O-CB 3.22Å; L1129-T1133 PolarHBondContact O-N 3.18Å; L1129-T1133 PolarHBondContact O-OG1 3.16Å; L1129-I1190 HydrophobicContact CD2-CD1 3.69Å; L1129-I1190 VanDerWaalsContact CD2-CD1 3.45Å; L1129-I1190 HydrophobicContact CD2-CG1 4.21Å; L1129-I1190 HydrophobicContact CG-CD1 4.33Å; L1129-F1192 HydrophobicContact CD2-CD1 4.45Å; L1129-F1192 HydrophobicContact CD2-CE1 3.93Å; L1129-F1192 HydrophobicContact CD2-CZ 4.13Å; L1129-L1279 HydrophobicContact CD1-CB 4.26Å; L1129-L1279 HydrophobicContact CD1-CD2 3.87Å; L1129-L1279 HydrophobicContact CD1-CG 4.48Å; L1129-L1279 HydrophobicContact CD2-CB 4.35Å; L1129-L1279 HydrophobicContact CD2-CD2 4.34Å; L1129-L1279 HydrophobicContact CG-CB 4.35Å; L1129-L1279 HydrophobicContact CG-CD2 4.16Å; L1129-D1281 HydrophobicContact CD1-CB 4.19Å; L1129-D1281 HydrophobicContact CD2-CB 4.15Å; L1129-V1305 HydrophobicContact CD1-CB 4.27Å; L1129-V1305 HydrophobicContact CD1-CG1 3.77Å; L1129-T1307 HydrophobicContact CB-CG2 3.97Å; L1129-T1307 HydrophobicContact CD1-CG2 3.6Å; L1129-T1307 VanDerWaalsContact CD1-CG2 3.49Å; L1129-T1307 HydrophobicContact CG-CG2 4.39Å
1130	S	90.1	Very high	86.2	Confident	0 Å²	0	24 Å²	24	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-60.5	-45.7	177.1	-61.6	0	0	0	0	111.8	V1053 A1056 T1126 T1127 Y1128 T1133 I1134	V1053-S1130 VanDerWaalsContact CG1-CB 3.49Å; V1053-S1130 VanDerWaalsContact CG2-CB 3.48Å; A1056-S1130 WeakPolarHBondContact CB-OG 3.32Å; T1126-S1130 VanDerWaalsContact O-CB 3.27Å; T1126-S1130 WeakPolarHBondContact O-CB 3.28Å; T1126-S1130 PolarHBondContact O-N 3.18Å; T1126-S1130 PolarHBondContact O-OG 3Å; T1127-S1130 PolarHBondContact O-N 3.45Å; Y1128-S1130 VanDerWaalsContact C-N 3.35Å; S1130-T1133 VanDerWaalsContact O-CB 3.3Å; S1130-T1133 WeakPolarHBondContact O-CB 3.41Å; S1130-T1133 PolarHBondContact O-N 3.26Å; S1130-I1134 WeakPolarHBondContact O-CG1 3.34Å; S1130-I1134 PolarHBondContact O-N 3Å; S1130-I1134 VanDerWaalsContact O-N 3.14Å
1131	A	89.4	Confident	85.4	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-66	-42	179.2	0	0	0	0	0	112.8	V1053 A1057 I1060 L1065 T1127 Y1128 L1129 T1133 I1134 S1135 W1141	V1053-A1131 HydrophobicContact CG1-CB 3.74Å; V1053-A1131 HydrophobicContact CG2-CB 4.15Å; A1057-A1131 HydrophobicContact CB-CB 4.26Å; I1060-A1131 HydrophobicContact CB-CB 3.98Å; I1060-A1131 HydrophobicContact CD1-CB 3.4Å; I1060-A1131 VanDerWaalsContact CD1-CB 3.42Å; I1060-A1131 HydrophobicContact CG1-CB 4.28Å; I1060-A1131 HydrophobicContact CG2-CB 3.78Å; L1065-A1131 HydrophobicContact CD1-CB 3.93Å; L1065-A1131 VanDerWaalsContact CD1-CB 3.48Å; L1065-A1131 HydrophobicContact CD2-CB 4.15Å; L1065-A1131 HydrophobicContact CG-CB 4.47Å; T1127-A1131 WeakPolarHBondContact O-CB 3.35Å; T1127-A1131 PolarHBondContact O-N 3.14Å; Y1128-A1131 PolarHBondContact O-N 3.1Å; L1129-A1131 VanDerWaalsContact C-N 3.35Å; L1129-A1131 PolarHBondContact O-N 3.16Å; A1131-T1133 VanDerWaalsContact C-N 3.28Å; A1131-T1133 PolarHBondContact O-N 2.98Å; A1131-I1134 PolarHBondContact O-N 3Å; A1131-S1135 PolarHBondContact O-N 3.24Å; A1131-S1135 VanDerWaalsContact O-N 3.07Å; A1131-S1135 PolarHBondContact O-OG 3.09Å; A1131-W1141 HydrophobicContact CB-CH2 4.23Å; A1131-W1141 HydrophobicContact CB-CZ2 4.04Å; A1131-W1141 WeakPolarHBondContact O-CZ2 3.43Å
1132	L	91.9	Very high	84.4	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-60	-42.4	173.3	179.3	66.2	0	0	0	110.8	V1068 E1069 F1072 L1115 Y1128 L1129 I1134 S1135 L1136 L1279 V1305	V1068-L1132 HydrophobicContact CG1-CB 4.27Å; V1068-L1132 HydrophobicContact CG1-CD1 4.25Å; V1068-L1132 HydrophobicContact CG1-CD2 3.87Å; V1068-L1132 HydrophobicContact CG1-CG 4.29Å; V1068-L1132 HydrophobicContact CG2-CB 4.06Å; V1068-L1132 HydrophobicContact CG2-CD1 4.45Å; V1068-L1132 HydrophobicContact CG2-CD2 4.09Å; V1068-L1132 HydrophobicContact CG2-CG 4.42Å; E1069-L1132 HydrophobicContact CG-CD1 4.34Å; F1072-L1132 HydrophobicContact CB-CD1 3.82Å; F1072-L1132 HydrophobicContact CB-CD2 4.35Å; F1072-L1132 HydrophobicContact CD2-CD1 4.25Å; F1072-L1132 HydrophobicContact CD2-CD2 3.88Å; F1072-L1132 HydrophobicContact CD2-CG 4.48Å; F1072-L1132 HydrophobicContact CE2-CD2 4.5Å; F1072-L1132 HydrophobicContact CG-CD1 4.04Å; F1072-L1132 HydrophobicContact CG-CD2 4.35Å; L1115-L1132 HydrophobicContact CD2-CD2 4.17Å; Y1128-L1132 WeakPolarHBondContact O-CB 3.39Å; Y1128-L1132 PolarHBondContact O-N 3.15Å; L1129-L1132 PolarHBondContact O-N 3.1Å; L1132-I1134 VanDerWaalsContact C-N 3.33Å; L1132-I1134 PolarHBondContact O-N 3.21Å; L1132-S1135 WeakPolarHBondContact O-CA 3.38Å; L1132-S1135 WeakPolarHBondContact O-CB 3.22Å; L1132-S1135 PolarHBondContact O-N 3.16Å; L1132-S1135 VanDerWaalsContact O-N 3.1Å; L1132-L1136 HydrophobicContact CD1-CD1 4.47Å; L1132-L1136 HydrophobicContact CD1-CD2 4.36Å; L1132-L1136 HydrophobicContact CD1-CG 4.27Å; L1132-L1136 HydrophobicContact CG-CD1 4.16Å; L1132-L1136 HydrophobicContact CG-CG 4.3Å; L1132-L1136 VanDerWaalsContact O-CG 3.3Å; L1132-L1136 WeakPolarHBondContact O-CG 3.3Å; L1132-L1136 PolarHBondContact O-N 3.11Å; L1132-L1279 HydrophobicContact CD2-CD2 4.41Å; L1132-V1305 HydrophobicContact CD2-CB 4.48Å; L1132-V1305 HydrophobicContact CD2-CG1 4.01Å; L1132-V1305 HydrophobicContact CD2-CG2 3.97Å
1133	T	90.3	Very high	83.2	Confident	0.8 Å²	0.8	27.8 Å²	27.8	1%	0.005	14%	0.144	C	C	.	.	H	α-helix	trans	-55.3	-47.9	178	-55.8	0	0	0	0	111.6	L1049 V1053 L1129 S1130 A1131 S1135 L1136 I1137 I1188 I1190 L1279	L1049-T1133 HydrophobicContact CD1-CG2 4.08Å; L1049-T1133 HydrophobicContact CD2-CG2 3.6Å; L1049-T1133 HydrophobicContact CG-CG2 4.43Å; V1053-T1133 HydrophobicContact CG1-CG2 4.46Å; L1129-T1133 WeakPolarHBondContact O-CB 3.22Å; L1129-T1133 PolarHBondContact O-N 3.18Å; L1129-T1133 PolarHBondContact O-OG1 3.16Å; S1130-T1133 VanDerWaalsContact O-CB 3.3Å; S1130-T1133 WeakPolarHBondContact O-CB 3.41Å; S1130-T1133 PolarHBondContact O-N 3.26Å; A1131-T1133 VanDerWaalsContact C-N 3.28Å; A1131-T1133 PolarHBondContact O-N 2.98Å; T1133-S1135 VanDerWaalsContact C-N 3.34Å; T1133-S1135 PolarHBondContact O-N 3.02Å; T1133-L1136 PolarHBondContact O-N 3.36Å; T1133-I1137 HydrophobicContact CG2-CD1 4.34Å; T1133-I1137 WeakPolarHBondContact O-CG1 3.35Å; T1133-I1137 PolarHBondContact O-N 3.36Å; T1133-I1188 HydrophobicContact CG2-CD1 4.06Å; T1133-I1188 HydrophobicContact CG2-CG2 4.03Å; T1133-I1188 VanDerWaalsContact O-CD1 3.25Å; T1133-I1188 WeakPolarHBondContact O-CD1 3.33Å; T1133-I1190 HydrophobicContact CG2-CD1 3.97Å; T1133-I1190 VanDerWaalsContact OG1-CD1 3.29Å; T1133-I1190 WeakPolarHBondContact OG1-CD1 3.39Å; T1133-L1279 WeakPolarHBondContact OG1-CD2 3.38Å
1134	I	87.6	Confident	81	Confident	5.8 Å²	5.8	30.6 Å²	30.6	3%	0.03	16%	0.163	C	C	.	.	H	α-helix	trans	-65.7	-41	177.4	-55.5	-67.7	0	0	0	110.8	L1049 R1050 V1053 Y1054 A1057 S1130 A1131 L1132 L1136 I1137 E1138 W1141	L1049-I1134 HydrophobicContact CB-CD1 4.32Å; L1049-I1134 HydrophobicContact CB-CG1 4.29Å; R1050-I1134 HydrophobicContact CG-CD1 3.93Å; R1050-I1134 HydrophobicContact CG-CG2 4.47Å; V1053-I1134 HydrophobicContact CB-CD1 4.18Å; V1053-I1134 HydrophobicContact CG1-CD1 4.27Å; V1053-I1134 HydrophobicContact CG2-CD1 3.82Å; Y1054-I1134 HydrophobicContact CD2-CD1 4.29Å; Y1054-I1134 HydrophobicContact CD2-CG1 4.27Å; Y1054-I1134 HydrophobicContact CD2-CG2 4.21Å; Y1054-I1134 HydrophobicContact CE2-CG2 4.18Å; A1057-I1134 HydrophobicContact CB-CB 4.46Å; A1057-I1134 HydrophobicContact CB-CG1 3.82Å; S1130-I1134 WeakPolarHBondContact O-CG1 3.34Å; S1130-I1134 PolarHBondContact O-N 3Å; S1130-I1134 VanDerWaalsContact O-N 3.14Å; A1131-I1134 PolarHBondContact O-N 3Å; L1132-I1134 VanDerWaalsContact C-N 3.33Å; L1132-I1134 PolarHBondContact O-N 3.21Å; I1134-L1136 VanDerWaalsContact C-N 3.29Å; I1134-L1136 PolarHBondContact O-N 3.21Å; I1134-I1137 PolarHBondContact O-N 3.12Å; I1134-I1137 VanDerWaalsContact O-N 3.12Å; I1134-E1138 PolarHBondContact O-N 3.26Å; I1134-W1141 HydrophobicContact CB-CD2 4.13Å; I1134-W1141 HydrophobicContact CB-CE3 4.44Å; I1134-W1141 HydrophobicContact CB-CG 4.31Å; I1134-W1141 HydrophobicContact CB-CZ2 4.4Å; I1134-W1141 HydrophobicContact CG2-CB 3.73Å; I1134-W1141 HydrophobicContact CG2-CD2 3.5Å; I1134-W1141 VanDerWaalsContact CG2-CD2 3.46Å; I1134-W1141 HydrophobicContact CG2-CE3 4.04Å; I1134-W1141 HydrophobicContact CG2-CG 3.36Å
1135	S	87.6	Confident	78.7	Confident	2 Å²	2	34.7 Å²	34.7	1%	0.014	18%	0.18	C	C	.	.	H	α-helix	trans	-61.6	-31.9	177.8	-66.3	0	0	0	0	114.1	E1069 A1131 L1132 T1133 I1137 W1141 R1180	E1069-S1135 VanDerWaalsContact OE1-CB 3.24Å; E1069-S1135 WeakPolarHBondContact OE1-CB 3.38Å; E1069-S1135 PolarHBondContact OE1-OG 2.94Å; E1069-S1135 VanDerWaalsContact OE1-OG 3.09Å; A1131-S1135 PolarHBondContact O-N 3.24Å; A1131-S1135 VanDerWaalsContact O-N 3.07Å; A1131-S1135 PolarHBondContact O-OG 3.09Å; L1132-S1135 WeakPolarHBondContact O-CA 3.38Å; L1132-S1135 WeakPolarHBondContact O-CB 3.22Å; L1132-S1135 PolarHBondContact O-N 3.16Å; L1132-S1135 VanDerWaalsContact O-N 3.1Å; T1133-S1135 VanDerWaalsContact C-N 3.34Å; T1133-S1135 PolarHBondContact O-N 3.02Å; S1135-I1137 VanDerWaalsContact C-N 3.29Å; S1135-I1137 PolarHBondContact O-N 2.95Å; S1135-W1141 PolarHBondContact OG-NE1 3.31Å; S1135-R1180 PolarHBondContact OG-NH2 3.28Å
1136	L	87.5	Confident	75.9	Confident	1.6 Å²	1.6	39 Å²	39	1%	0.008	21%	0.209	C	C	.	.	H	α-helix	trans	-74.8	-19.3	178	-68.1	177.2	0	0	0	113.5	F1072 L1132 T1133 I1134 F1183 H1186 I1188 A1277	F1072-L1136 HydrophobicContact CD1-CD2 3.65Å; F1072-L1136 HydrophobicContact CD2-CD1 4.45Å; F1072-L1136 HydrophobicContact CD2-CD2 4.44Å; F1072-L1136 HydrophobicContact CE1-CD1 4.35Å; F1072-L1136 HydrophobicContact CE1-CD2 3.24Å; F1072-L1136 HydrophobicContact CE1-CG 4.43Å; F1072-L1136 HydrophobicContact CE2-CD1 3.96Å; F1072-L1136 HydrophobicContact CE2-CD2 4.26Å; F1072-L1136 HydrophobicContact CG-CD2 4.31Å; F1072-L1136 HydrophobicContact CZ-CD1 3.84Å; F1072-L1136 HydrophobicContact CZ-CD2 3.57Å; F1072-L1136 HydrophobicContact CZ-CG 4.37Å; L1132-L1136 HydrophobicContact CD1-CD1 4.47Å; L1132-L1136 HydrophobicContact CD1-CD2 4.36Å; L1132-L1136 HydrophobicContact CD1-CG 4.27Å; L1132-L1136 HydrophobicContact CG-CD1 4.16Å; L1132-L1136 HydrophobicContact CG-CG 4.3Å; L1132-L1136 VanDerWaalsContact O-CG 3.3Å; L1132-L1136 WeakPolarHBondContact O-CG 3.3Å; L1132-L1136 PolarHBondContact O-N 3.11Å; T1133-L1136 PolarHBondContact O-N 3.36Å; I1134-L1136 VanDerWaalsContact C-N 3.29Å; I1134-L1136 PolarHBondContact O-N 3.21Å; L1136-F1183 HydrophobicContact CD2-CB 4.13Å; L1136-F1183 HydrophobicContact CD2-CD1 4.14Å; L1136-F1183 HydrophobicContact CD2-CD2 4.06Å; L1136-F1183 HydrophobicContact CD2-CE1 4.37Å; L1136-F1183 HydrophobicContact CD2-CE2 4.41Å; L1136-F1183 HydrophobicContact CD2-CG 3.83Å; L1136-H1186 HydrophobicContact CB-CB 4.41Å; L1136-H1186 PolarHBondContact O-N 3.01Å; L1136-I1188 HydrophobicContact CB-CD1 3.65Å; L1136-I1188 HydrophobicContact CB-CG1 4.49Å; L1136-I1188 HydrophobicContact CD1-CD1 4.32Å; L1136-A1277 HydrophobicContact CD1-CB 4.14Å
1137	I	82.3	Confident	73	Confident	40.6 Å²	40.6	42.9 Å²	42.9	21%	0.208	23%	0.227	C	C	.	.	H	α-helix	trans	-97.2	-48	177.2	-61.1	175.5	0	0	0	110.7	F780 I1046 L1049 T1133 I1134 S1135 I1188	F780-I1137 HydrophobicContact CZ-CG2 4.49Å; I1046-I1137 HydrophobicContact CD1-CD1 3.62Å; I1046-I1137 HydrophobicContact CD1-CG2 4.03Å; I1046-I1137 HydrophobicContact CG1-CD1 3.65Å; I1046-I1137 HydrophobicContact CG1-CG2 4.22Å; L1049-I1137 HydrophobicContact CB-CD1 4.37Å; L1049-I1137 HydrophobicContact CD1-CD1 3.09Å; L1049-I1137 HydrophobicContact CD1-CG1 4.49Å; L1049-I1137 HydrophobicContact CG-CD1 4.42Å; T1133-I1137 HydrophobicContact CG2-CD1 4.34Å; T1133-I1137 WeakPolarHBondContact O-CG1 3.35Å; T1133-I1137 PolarHBondContact O-N 3.36Å; I1134-I1137 PolarHBondContact O-N 3.12Å; I1134-I1137 VanDerWaalsContact O-N 3.12Å; S1135-I1137 VanDerWaalsContact C-N 3.29Å; S1135-I1137 PolarHBondContact O-N 2.95Å; I1137-I1188 HydrophobicContact CD1-CD1 3.79Å; I1137-I1188 HydrophobicContact CD1-CG1 4.34Å; I1137-I1188 HydrophobicContact CG1-CD1 3.45Å; I1137-I1188 VanDerWaalsContact CG1-CD1 3.47Å; I1137-I1188 HydrophobicContact CG1-CG1 4.22Å
1138	E	79	Confident	70.3	Confident	64.6 Å²	64.6	46 Å²	46	30%	0.302	24%	0.242	S	C	.	.			trans	-126.2	101	-175.7	-80.3	-174.2	-177.4	0	0	109.7	F780 R1050 I1134 N1140 W1141	F780-E1138 WeakPolarHBondContact CD2-OE2 3.46Å; F780-E1138 VanDerWaalsContact CE2-OE2 3.27Å; F780-E1138 WeakPolarHBondContact CE2-OE2 3.36Å; R1050-E1138 IonicContact CZ-OE1 3.51Å; R1050-E1138 VanDerWaalsContact CZ-OE1 3.27Å; R1050-E1138 IonicContact NE-OE1 3.31Å; R1050-E1138 PolarHBondContact NE-OE1 3.21Å; R1050-E1138 IonicContact NH2-OE1 3.42Å; R1050-E1138 PolarHBondContact NH2-OE1 3.21Å; I1134-E1138 PolarHBondContact O-N 3.26Å; E1138-N1140 PolarHBondContact O-N 3.16Å; E1138-W1141 HydrophobicContact CB-CB 4.18Å; E1138-W1141 HydrophobicContact CG-CB 4.47Å; E1138-W1141 PolarHBondContact O-N 3.21Å; E1138-W1141 VanDerWaalsContact O-N 3.09Å
1139	S	69.9	Low	67.5	Low	42.2 Å²	42.2	54.2 Å²	54.2	30%	0.295	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-15.7	177.3	56.2	0	0	0	0	113	R1180	S1139-R1180 PolarHBondContact O-NH1 3.27Å; S1139-R1180 PolarHBondContact O-NH2 3.08Å
1140	N	67.8	Low	64.8	Low	97.2 Å²	97.2	59.1 Å²	59.1	52%	0.52	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	14.7	-173.3	-62.1	-30.7	0	0	0	115.3	E1138 Y1142 K1143	E1138-N1140 PolarHBondContact O-N 3.16Å; N1140-Y1142 VanDerWaalsContact C-N 3.32Å; N1140-Y1142 HydrophobicContact CB-CE1 4.37Å; N1140-Y1142 PolarHBondContact O-N 3.32Å; N1140-Y1142 PolarHBondContact OD1-OH 3.43Å; N1140-Y1142 VanDerWaalsContact OD1-OH 3.04Å; N1140-K1143 HydrophobicContact CB-CD 4.11Å; N1140-K1143 HydrophobicContact CB-CG 4.29Å; N1140-K1143 WeakPolarHBondContact O-CB 3.17Å; N1140-K1143 WeakPolarHBondContact O-CG 3.24Å; N1140-K1143 PolarHBondContact O-N 2.85Å
1141	W	71.1	Confident	62.4	Low	16.2 Å²	16.2	62.4 Å²	62.4	6%	0.061	33%	0.325	C	S	.	.	S	Bend	trans	-61.3	-33.7	178.6	75.2	-83.3	0	0	0	112.9	V1053 Y1054 A1057 C1058 I1060 L1065 A1131 I1134 S1135 E1138 K1143 S1144	V1053-W1141 HydrophobicContact CG1-CH2 3.38Å; V1053-W1141 HydrophobicContact CG1-CZ2 4.19Å; V1053-W1141 HydrophobicContact CG1-CZ3 3.94Å; Y1054-W1141 HydrophobicContact CD1-CZ3 4.2Å; Y1054-W1141 HydrophobicContact CD2-CE3 4.44Å; Y1054-W1141 AromaticContact CE1-CE3 3.96Å; Y1054-W1141 HydrophobicContact CE1-CE3 3.96Å; Y1054-W1141 AromaticContact CE1-CZ3 3.79Å; Y1054-W1141 HydrophobicContact CE1-CZ3 3.79Å; Y1054-W1141 HydrophobicContact CE2-CB 4.24Å; Y1054-W1141 HydrophobicContact CE2-CD2 4.4Å; Y1054-W1141 AromaticContact CE2-CE3 3.73Å; Y1054-W1141 HydrophobicContact CE2-CE3 3.82Å; Y1054-W1141 HydrophobicContact CE2-CZ3 4.39Å; Y1054-W1141 AromaticContact CZ-CE3 3.95Å; Y1054-W1141 PolarHBondContact OH-O 3.23Å; A1057-W1141 HydrophobicContact CB-CH2 3.75Å; A1057-W1141 HydrophobicContact CB-CZ2 4.4Å; A1057-W1141 HydrophobicContact CB-CZ3 4.06Å; A1057-W1141 WeakPolarHBondContact O-CH2 3.48Å; C1058-W1141 WeakPolarHBondContact SG-CH2 3.32Å; C1058-W1141 WeakPolarHBondContact SG-CZ3 3.34Å; I1060-W1141 HydrophobicContact CG2-CH2 4.19Å; L1065-W1141 HydrophobicContact CD1-CZ2 4.11Å; L1065-W1141 HydrophobicContact CD2-CZ2 4.3Å; A1131-W1141 HydrophobicContact CB-CH2 4.23Å; A1131-W1141 HydrophobicContact CB-CZ2 4.04Å; A1131-W1141 WeakPolarHBondContact O-CZ2 3.43Å; I1134-W1141 HydrophobicContact CB-CD2 4.13Å; I1134-W1141 HydrophobicContact CB-CE3 4.44Å; I1134-W1141 HydrophobicContact CB-CG 4.31Å; I1134-W1141 HydrophobicContact CB-CZ2 4.4Å; I1134-W1141 HydrophobicContact CG2-CB 3.73Å; I1134-W1141 HydrophobicContact CG2-CD2 3.5Å; I1134-W1141 VanDerWaalsContact CG2-CD2 3.46Å; I1134-W1141 HydrophobicContact CG2-CE3 4.04Å; I1134-W1141 HydrophobicContact CG2-CG 3.36Å; S1135-W1141 PolarHBondContact OG-NE1 3.31Å; E1138-W1141 HydrophobicContact CB-CB 4.18Å; E1138-W1141 HydrophobicContact CG-CB 4.47Å; E1138-W1141 PolarHBondContact O-N 3.21Å; E1138-W1141 VanDerWaalsContact O-N 3.09Å; W1141-K1143 PolarHBondContact O-N 3.04Å; W1141-K1143 VanDerWaalsContact O-N 3.16Å; W1141-S1144 WeakPolarHBondContact O-CA 3.31Å; W1141-S1144 WeakPolarHBondContact O-CB 3.11Å; W1141-S1144 PolarHBondContact O-N 3.03Å
1142	Y	63.5	Low	59.8	Low	63 Å²	63	68 Å²	68	25%	0.247	35%	0.351	C	S	.	.	S	Bend	trans	-90.2	77	177	-166.1	-89.6	0	0	0	110.2	I1060 P1062 L1065 N1140 S1144 I1145 R1180	I1060-Y1142 HydrophobicContact CG2-CE2 4.16Å; I1060-Y1142 PolarHBondContact O-OH 3.24Å; I1060-Y1142 VanDerWaalsContact O-OH 3.08Å; P1062-Y1142 HydrophobicContact CB-CE1 4.31Å; P1062-Y1142 WeakPolarHBondContact CD-OH 3.19Å; P1062-Y1142 HydrophobicContact CG-CE1 4.31Å; P1062-Y1142 VanDerWaalsContact CG-OH 3.32Å; P1062-Y1142 WeakPolarHBondContact CG-OH 3.45Å; L1065-Y1142 VanDerWaalsContact CD2-CB 3.49Å; L1065-Y1142 HydrophobicContact CD2-CD1 3.71Å; L1065-Y1142 HydrophobicContact CD2-CD2 3.67Å; L1065-Y1142 HydrophobicContact CD2-CE1 4.18Å; L1065-Y1142 HydrophobicContact CD2-CE2 4.13Å; L1065-Y1142 HydrophobicContact CD2-CG 3.43Å; L1065-Y1142 VanDerWaalsContact CD2-CG 3.46Å; N1140-Y1142 VanDerWaalsContact C-N 3.32Å; N1140-Y1142 HydrophobicContact CB-CE1 4.37Å; N1140-Y1142 PolarHBondContact O-N 3.32Å; N1140-Y1142 PolarHBondContact OD1-OH 3.43Å; N1140-Y1142 VanDerWaalsContact OD1-OH 3.04Å; Y1142-S1144 VanDerWaalsContact C-N 3.3Å; Y1142-S1144 PolarHBondContact O-N 3.46Å; Y1142-I1145 WeakPolarHBondContact O-CD1 3.02Å; Y1142-I1145 WeakPolarHBondContact O-CG1 3.33Å; Y1142-I1145 PolarHBondContact O-N 3.23Å; Y1142-R1180 PolarHBondContact O-NH1 3.07Å
1143	K	57.2	Low	57.3	Low	138 Å²	138	73.9 Å²	73.9	60%	0.6	38%	0.382	S	S	*	.			trans	-80.8	112.9	175.4	-74.7	-177.8	-175.6	-174.7	0	111.2	N686 Y690 N1140 W1141 I1145	N686-K1143 HydrophobicContact CB-CD 4Å; N686-K1143 VanDerWaalsContact CG-CE 3.41Å; N686-K1143 WeakPolarHBondContact ND2-CD 3.35Å; N686-K1143 WeakPolarHBondContact OD1-CD 3.2Å; N686-K1143 WeakPolarHBondContact OD1-CE 3.46Å; N686-K1143 PolarHBondContact OD1-NZ 2.88Å; Y690-K1143 HydrophobicContact CD2-CD 4.38Å; Y690-K1143 HydrophobicContact CE2-CD 3.98Å; Y690-K1143 HydrophobicContact CE2-CG 4.35Å; N1140-K1143 HydrophobicContact CB-CD 4.11Å; N1140-K1143 HydrophobicContact CB-CG 4.29Å; N1140-K1143 WeakPolarHBondContact O-CB 3.17Å; N1140-K1143 WeakPolarHBondContact O-CG 3.24Å; N1140-K1143 PolarHBondContact O-N 2.85Å; W1141-K1143 PolarHBondContact O-N 3.04Å; W1141-K1143 VanDerWaalsContact O-N 3.16Å; K1143-I1145 PolarHBondContact O-N 3.18Å
1144	S	42.5	Very low	54.8	Low	69.6 Å²	69.6	81.9 Å²	81.9	49%	0.487	42%	0.417	S	S	.	.			trans	-65.4	120.2	165.5	72.9	0	0	0	0	110	R1050 W1141 Y1142 P1146	R1050-S1144 PolarHBondContact NH2-OG 2.75Å; W1141-S1144 WeakPolarHBondContact O-CA 3.31Å; W1141-S1144 WeakPolarHBondContact O-CB 3.11Å; W1141-S1144 PolarHBondContact O-N 3.03Å; Y1142-S1144 VanDerWaalsContact C-N 3.3Å; Y1142-S1144 PolarHBondContact O-N 3.46Å; S1144-P1146 WeakPolarHBondContact O-CD 3.36Å
1145	I	39.1	Very low	52.2	Low	102.6 Å²	102.6	88.3 Å²	88.3	53%	0.526	45%	0.445	S	S	.	.			trans	-42.1	124.6	171.3	-62.1	160.3	0	0	0	109.6	E658 F759 R781 Y1054 Y1142 K1143 M1147	E658-I1145 HydrophobicContact CB-CG2 3.37Å; E658-I1145 VanDerWaalsContact CD-CG2 3.49Å; E658-I1145 HydrophobicContact CG-CB 4.43Å; E658-I1145 HydrophobicContact CG-CG2 3.2Å; E658-I1145 WeakPolarHBondContact OE1-CG2 3.46Å; F759-I1145 HydrophobicContact CD1-CD1 3.31Å; F759-I1145 HydrophobicContact CD2-CD1 3.94Å; F759-I1145 HydrophobicContact CE1-CD1 2.91Å; F759-I1145 HydrophobicContact CE1-CG1 4.25Å; F759-I1145 HydrophobicContact CE2-CD1 3.57Å; F759-I1145 HydrophobicContact CG-CD1 3.84Å; F759-I1145 HydrophobicContact CZ-CD1 3.06Å; F759-I1145 HydrophobicContact CZ-CG1 4.44Å; R781-I1145 VanDerWaalsContact NH2-CA 3.32Å; R781-I1145 VanDerWaalsContact NH2-CB 3.31Å; R781-I1145 VanDerWaalsContact NH2-CG2 3.27Å; Y1054-I1145 HydrophobicContact CE1-CG1 4.28Å; Y1142-I1145 WeakPolarHBondContact O-CD1 3.02Å; Y1142-I1145 WeakPolarHBondContact O-CG1 3.33Å; Y1142-I1145 PolarHBondContact O-N 3.23Å; K1143-I1145 PolarHBondContact O-N 3.18Å; I1145-M1147 PolarHBondContact O-N 2.93Å; I1145-M1147 VanDerWaalsContact O-N 3.11Å
1146	P	33.1	Very low	49.8	Very low	100.8 Å²	100.8	90.7 Å²	90.7	66%	0.655	47%	0.465	S	S	*	.			trans	-65.4	102.5	-180	11.4	-10.5	0	0	0	110.2	T654 E658 S1144 N1148	T654-P1146 HydrophobicContact CG2-CB 3.83Å; T654-P1146 HydrophobicContact CG2-CG 3.63Å; T654-P1146 WeakPolarHBondContact CG2-O 3.39Å; E658-P1146 HydrophobicContact CG-CG 4.38Å; S1144-P1146 WeakPolarHBondContact O-CD 3.36Å; P1146-N1148 PolarHBondContact O-N 2.84Å; P1146-N1148 VanDerWaalsContact O-N 3.08Å
1147	M	28.8	Very low	47.4	Very low	121 Å²	121	95.7 Å²	95.7	60%	0.596	50%	0.496	S	S	*	.			trans	-64.1	128.3	168.5	-100.5	-107.7	176	0	0	108.9	E658 H758 N760 I1145 K1149 I1151 Q1179	E658-M1147 WeakPolarHBondContact OE1-CA 3.39Å; E658-M1147 PolarHBondContact OE1-N 3.03Å; H758-M1147 HydrophobicContact CB-CE 4.18Å; N760-M1147 HydrophobicContact CB-CE 4.05Å; N760-M1147 HydrophobicContact CB-CG 4.32Å; N760-M1147 WeakPolarHBondContact ND2-CE 3.4Å; N760-M1147 PolarHBondContact ND2-SD 3.05Å; I1145-M1147 PolarHBondContact O-N 2.93Å; I1145-M1147 VanDerWaalsContact O-N 3.11Å; M1147-K1149 PolarHBondContact O-N 3.28Å; M1147-K1149 VanDerWaalsContact O-N 3.08Å; M1147-I1151 HydrophobicContact CE-CD1 4.46Å; M1147-Q1179 PolarHBondContact SD-NE2 3.33Å
1148	N	31.6	Very low	45.2	Very low	94.8 Å²	94.8	101.9 Å²	101.9	51%	0.507	52%	0.521	S	S	.	.			trans	-46.4	115.4	-178.1	-109.7	-26.7	0	0	0	112.9	S652 T655 P1146 T1150 I1151	S652-N1148 PolarHBondContact OG-ND2 3.2Å; T655-N1148 PolarHBondContact OG1-ND2 3.11Å; T655-N1148 VanDerWaalsContact OG1-ND2 3.16Å; P1146-N1148 PolarHBondContact O-N 2.84Å; P1146-N1148 VanDerWaalsContact O-N 3.08Å; N1148-T1150 PolarHBondContact O-N 2.94Å; N1148-T1150 VanDerWaalsContact O-N 3.12Å; N1148-T1150 PolarHBondContact OD1-N 3.28Å; N1148-T1150 PolarHBondContact OD1-OG1 3.39Å; N1148-I1151 HydrophobicContact CB-CD1 4.18Å; N1148-I1151 HydrophobicContact CB-CG1 4.35Å; N1148-I1151 PolarHBondContact O-N 2.95Å; N1148-I1151 VanDerWaalsContact O-N 3.11Å
1149	K	35.2	Very low	43	Very low	177.6 Å²	177.6	105.3 Å²	105.3	77%	0.772	54%	0.541	S	S	*	.	H	α-helix	trans	-57.7	-15.3	176.3	-83.2	-177.1	174	-179.4	0	113.9	M1147 I1151 Q1152 N1153	M1147-K1149 PolarHBondContact O-N 3.28Å; M1147-K1149 VanDerWaalsContact O-N 3.08Å; K1149-I1151 VanDerWaalsContact C-N 3.28Å; K1149-I1151 PolarHBondContact O-N 3.33Å; K1149-Q1152 WeakPolarHBondContact O-CB 3.12Å; K1149-Q1152 PolarHBondContact O-N 2.97Å; K1149-N1153 PolarHBondContact O-N 3.5Å
1150	T	35.8	Very low	41.3	Very low	102.4 Å²	102.4	110.1 Å²	110.1	63%	0.628	56%	0.563	S	S	*	*	H	α-helix	trans	-70.6	-21.2	178.5	6.2	0	0	0	0	113.8	N1148	N1148-T1150 PolarHBondContact O-N 2.94Å; N1148-T1150 VanDerWaalsContact O-N 3.12Å; N1148-T1150 PolarHBondContact OD1-N 3.28Å; N1148-T1150 PolarHBondContact OD1-OG1 3.39Å
1151	I	40.1	Very low	39.8	Very low	69.8 Å²	69.8	109.9 Å²	109.9	36%	0.358	57%	0.569	S	S	.	*	H	α-helix	trans	-82.2	-35.7	-179.2	-61.1	173.1	0	0	0	111.1	N760 K762 M1147 N1148 K1149 N1153 K1154 F1155	N760-I1151 WeakPolarHBondContact ND2-CD1 3.44Å; K762-I1151 HydrophobicContact CD-CD1 3.84Å; K762-I1151 HydrophobicContact CD-CG1 4.5Å; K762-I1151 VanDerWaalsContact NZ-CD1 3.35Å; K762-I1151 VanDerWaalsContact NZ-CG1 3.35Å; M1147-I1151 HydrophobicContact CE-CD1 4.46Å; N1148-I1151 HydrophobicContact CB-CD1 4.18Å; N1148-I1151 HydrophobicContact CB-CG1 4.35Å; N1148-I1151 PolarHBondContact O-N 2.95Å; N1148-I1151 VanDerWaalsContact O-N 3.11Å; K1149-I1151 VanDerWaalsContact C-N 3.28Å; K1149-I1151 PolarHBondContact O-N 3.33Å; I1151-N1153 VanDerWaalsContact C-N 3.34Å; I1151-N1153 PolarHBondContact O-N 3.15Å; I1151-K1154 PolarHBondContact O-N 3.31Å; I1151-F1155 HydrophobicContact CG2-CD2 3.78Å; I1151-F1155 HydrophobicContact CG2-CE2 3.76Å; I1151-F1155 VanDerWaalsContact O-CD2 3.29Å; I1151-F1155 WeakPolarHBondContact O-CD2 3.29Å; I1151-F1155 PolarHBondContact O-N 3.22Å; I1151-F1155 VanDerWaalsContact O-N 3.13Å
1152	Q	34.9	Very low	38.1	Very low	116.6 Å²	116.6	116.3 Å²	116.3	55%	0.545	60%	0.603	S	S	.	*	H	α-helix	trans	-65.6	-37.1	-180	-77.4	-179.6	-18.4	0	0	113.4	K1149 K1154 F1155 A1156 I1176	K1149-Q1152 WeakPolarHBondContact O-CB 3.12Å; K1149-Q1152 PolarHBondContact O-N 2.97Å; Q1152-K1154 VanDerWaalsContact C-N 3.3Å; Q1152-K1154 PolarHBondContact O-N 3.08Å; Q1152-F1155 PolarHBondContact O-N 3.15Å; Q1152-A1156 VanDerWaalsContact O-CB 3.29Å; Q1152-A1156 WeakPolarHBondContact O-CB 3.28Å; Q1152-A1156 PolarHBondContact O-N 3.28Å; Q1152-A1156 VanDerWaalsContact O-N 3.16Å; Q1152-I1176 HydrophobicContact CB-CD1 4.2Å; Q1152-I1176 HydrophobicContact CG-CB 4.02Å; Q1152-I1176 HydrophobicContact CG-CD1 3.85Å; Q1152-I1176 HydrophobicContact CG-CG2 3.81Å; Q1152-I1176 PolarHBondContact NE2-O 2.9Å
1153	N	37.7	Very low	36.5	Very low	124.4 Å²	124.4	116.3 Å²	116.3	67%	0.665	62%	0.623	S	S	*	*	H	α-helix	trans	-72.4	-22.2	-178.5	-75.8	-1.9	0	0	0	113.9	K1149 I1151 T1157	K1149-N1153 PolarHBondContact O-N 3.5Å; I1151-N1153 VanDerWaalsContact C-N 3.34Å; I1151-N1153 PolarHBondContact O-N 3.15Å; N1153-T1157 WeakPolarHBondContact O-CG2 3.47Å; N1153-T1157 PolarHBondContact O-N 3.17Å; N1153-T1157 PolarHBondContact O-OG1 3Å
1154	K	37.5	Very low	35.2	Very low	168.2 Å²	168.2	114.6 Å²	114.6	73%	0.731	63%	0.628	S	S	*	*	H	α-helix	trans	-84.6	-23.6	174.5	-95.8	-176.9	177.5	179.9	0	113.4	I1151 Q1152 T1157 K1158	I1151-K1154 PolarHBondContact O-N 3.31Å; Q1152-K1154 VanDerWaalsContact C-N 3.3Å; Q1152-K1154 PolarHBondContact O-N 3.08Å; K1154-T1157 PolarHBondContact O-OG1 3.18Å; K1154-K1158 PolarHBondContact O-N 2.88Å
1155	F	33.7	Very low	34.6	Very low	140.6 Å²	140.6	120.4 Å²	120.4	62%	0.617	65%	0.645	S	S	*	*	H	α-helix	trans	-86	-31.2	175	-81.3	-77.2	0	0	0	112.7	I1151 Q1152 T1157 K1158 L1159	I1151-F1155 HydrophobicContact CG2-CD2 3.78Å; I1151-F1155 HydrophobicContact CG2-CE2 3.76Å; I1151-F1155 VanDerWaalsContact O-CD2 3.29Å; I1151-F1155 WeakPolarHBondContact O-CD2 3.29Å; I1151-F1155 PolarHBondContact O-N 3.22Å; I1151-F1155 VanDerWaalsContact O-N 3.13Å; Q1152-F1155 PolarHBondContact O-N 3.15Å; F1155-T1157 VanDerWaalsContact C-N 3.32Å; F1155-T1157 PolarHBondContact O-N 3.34Å; F1155-K1158 PolarHBondContact O-N 2.98Å; F1155-L1159 PolarHBondContact O-N 3.22Å
1156	A	36.9	Very low	34.1	Very low	53.4 Å²	53.4	124.1 Å²	124.1	44%	0.441	66%	0.662	S	S	.	*	H	α-helix	trans	-67.5	-30	177.6	0	0	0	0	0	113.4	Q1152 K1158 L1159 N1160	Q1152-A1156 VanDerWaalsContact O-CB 3.29Å; Q1152-A1156 WeakPolarHBondContact O-CB 3.28Å; Q1152-A1156 PolarHBondContact O-N 3.28Å; Q1152-A1156 VanDerWaalsContact O-N 3.16Å; A1156-K1158 VanDerWaalsContact C-N 3.26Å; A1156-K1158 PolarHBondContact O-N 3.07Å; A1156-L1159 PolarHBondContact O-N 2.86Å; A1156-N1160 WeakPolarHBondContact O-CB 3.36Å; A1156-N1160 VanDerWaalsContact O-CG 3.26Å; A1156-N1160 PolarHBondContact O-N 3.25Å; A1156-N1160 PolarHBondContact O-OD1 3.36Å
1157	T	37.3	Very low	33.9	Very low	106.6 Å²	106.6	126.7 Å²	126.7	65%	0.654	67%	0.671	S	S	*	*	H	α-helix	trans	-79.4	-16.3	-179.1	46.7	0	0	0	0	113.9	N1153 K1154 F1155	N1153-T1157 WeakPolarHBondContact O-CG2 3.47Å; N1153-T1157 PolarHBondContact O-N 3.17Å; N1153-T1157 PolarHBondContact O-OG1 3Å; K1154-T1157 PolarHBondContact O-OG1 3.18Å; F1155-T1157 VanDerWaalsContact C-N 3.32Å; F1155-T1157 PolarHBondContact O-N 3.34Å
1158	K	35.9	Very low	34	Very low	170.4 Å²	170.4	128.6 Å²	128.6	74%	0.741	68%	0.683	S	S	*	*	H	α-helix	trans	-95.2	-14.3	178.7	-122	176.8	-176.7	179.5	0	114.2	K1154 F1155 A1156 S1161 I1162	K1154-K1158 PolarHBondContact O-N 2.88Å; F1155-K1158 PolarHBondContact O-N 2.98Å; A1156-K1158 VanDerWaalsContact C-N 3.26Å; A1156-K1158 PolarHBondContact O-N 3.07Å; K1158-S1161 PolarHBondContact O-N 2.76Å; K1158-S1161 PolarHBondContact O-OG 3.03Å; K1158-I1162 WeakPolarHBondContact O-CG1 3.27Å; K1158-I1162 PolarHBondContact O-N 3.32Å
1159	L	32.7	Very low	34	Very low	135 Å²	135	129.5 Å²	129.5	71%	0.707	70%	0.697	S	S	*	*	H	α-helix	trans	-94.4	-11.2	179.7	-101.3	135.9	0	0	0	113.4	F1155 A1156 S1161 I1162 G1163	F1155-L1159 PolarHBondContact O-N 3.22Å; A1156-L1159 PolarHBondContact O-N 2.86Å; L1159-S1161 VanDerWaalsContact C-N 3.28Å; L1159-S1161 PolarHBondContact O-N 3.07Å; L1159-S1161 VanDerWaalsContact O-N 3.11Å; L1159-I1162 PolarHBondContact O-N 3.07Å; L1159-G1163 PolarHBondContact O-N 3.41Å
1160	N	34.3	Very low	33.7	Very low	144.4 Å²	144.4	128.6 Å²	128.6	77%	0.772	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	1.6	177.3	-73.8	-5.3	0	0	0	113.9	A1156 I1162	A1156-N1160 WeakPolarHBondContact O-CB 3.36Å; A1156-N1160 VanDerWaalsContact O-CG 3.26Å; A1156-N1160 PolarHBondContact O-N 3.25Å; A1156-N1160 PolarHBondContact O-OD1 3.36Å; N1160-I1162 VanDerWaalsContact C-N 3.32Å
1161	S	36.6	Very low	33.5	Very low	92.6 Å²	92.6	129.1 Å²	129.1	65%	0.648	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.9	10.8	177.2	61.7	0	0	0	0	113.7	K1158 L1159	K1158-S1161 PolarHBondContact O-N 2.76Å; K1158-S1161 PolarHBondContact O-OG 3.03Å; L1159-S1161 VanDerWaalsContact C-N 3.28Å; L1159-S1161 PolarHBondContact O-N 3.07Å; L1159-S1161 VanDerWaalsContact O-N 3.11Å
1162	I	35.7	Very low	33.2	Very low	149.8 Å²	149.8	133.2 Å²	133.2	77%	0.768	71%	0.713	S	S	*	*	S	Bend	trans	-123.3	54.3	178.9	-58.2	169.2	0	0	0	109.9	K1158 L1159 N1160 S1164 F1165	K1158-I1162 WeakPolarHBondContact O-CG1 3.27Å; K1158-I1162 PolarHBondContact O-N 3.32Å; L1159-I1162 PolarHBondContact O-N 3.07Å; N1160-I1162 VanDerWaalsContact C-N 3.32Å; I1162-S1164 PolarHBondContact O-N 3.49Å; I1162-F1165 PolarHBondContact O-N 2.87Å
1163	G	29.4	Very low	33.2	Very low	63.6 Å²	63.6	132.4 Å²	132.4	66%	0.656	72%	0.721	S	S	*	*			trans	-85.1	91.9	164.5	0	0	0	0	0	112.6	L1159 F1165	L1159-G1163 PolarHBondContact O-N 3.41Å; G1163-F1165 PolarHBondContact O-N 3.08Å
1164	S	31.1	Very low	33	Very low	102 Å²	102	133.3 Å²	133.3	71%	0.713	72%	0.719	S	S	*	*			trans	22.2	67.8	160.9	-174.1	0	0	0	0	114.8	I1162	I1162-S1164 PolarHBondContact O-N 3.49Å
1165	F	30	Very low	32.8	Very low	191.2 Å²	191.2	130.9 Å²	130.9	84%	0.839	71%	0.713	S	S	*	*	S	Bend	trans	-161.7	110.6	141.6	-89.7	-77.1	0	0	0	109	I1162 G1163	I1162-F1165 PolarHBondContact O-N 2.87Å; G1163-F1165 PolarHBondContact O-N 3.08Å
1166	M	27.9	Very low	33.1	Very low	181 Å²	181	129.8 Å²	129.8	89%	0.892	71%	0.712	S	S	*	*			trans	104.5	105.3	163.2	-69.2	-117.2	158.7	0	0	113	D1168	M1166-D1168 VanDerWaalsContact C-N 3.28Å; M1166-D1168 PolarHBondContact O-N 3.09Å
1167	N	28.6	Very low	33.2	Very low	156 Å²	156	131.7 Å²	131.7	83%	0.834	72%	0.719	S	S	*	*			trans	-91.7	108.2	163.7	-79.4	-21.8	0	0	0	110.9	S1169	N1167-S1169 VanDerWaalsContact C-N 3.3Å; N1167-S1169 PolarHBondContact O-N 3.41Å
1168	D	32.1	Very low	33.8	Very low	160.4 Å²	160.4	130.1 Å²	130.1	86%	0.858	71%	0.712	S	S	*	*			trans	-140.4	96	153.8	-86.1	-30.6	0	0	0	110.5	M1166 M1170	M1166-D1168 VanDerWaalsContact C-N 3.28Å; M1166-D1168 PolarHBondContact O-N 3.09Å; D1168-M1170 PolarHBondContact O-N 2.95Å
1169	S	30.7	Very low	34.9	Very low	113.4 Å²	113.4	127.5 Å²	127.5	79%	0.793	70%	0.702	S	S	*	*			trans	-93.5	104.4	173.6	53	0	0	0	0	111.5	N1167 D1171	N1167-S1169 VanDerWaalsContact C-N 3.3Å; N1167-S1169 PolarHBondContact O-N 3.41Å; S1169-D1171 PolarHBondContact O-N 3.37Å; S1169-D1171 VanDerWaalsContact O-N 3.13Å
1170	M	28.2	Very low	36.8	Very low	157.8 Å²	157.8	123.2 Å²	123.2	78%	0.777	68%	0.677	S	S	*	*			trans	-103.9	126.2	164.1	-99.5	-108.9	157.1	0	0	111.8	D1168 H1172	D1168-M1170 PolarHBondContact O-N 2.95Å; M1170-H1172 PolarHBondContact O-N 3.06Å; M1170-H1172 VanDerWaalsContact O-N 3.13Å
1171	D	33.3	Very low	38.6	Very low	113.8 Å²	113.8	117.5 Å²	117.5	61%	0.609	65%	0.648	S	S	*	*			trans	-26.3	96.7	172.6	-87.5	-32.7	0	0	0	116.1	S1169 S1173 K1174	S1169-D1171 PolarHBondContact O-N 3.37Å; S1169-D1171 VanDerWaalsContact O-N 3.13Å; D1171-S1173 PolarHBondContact O-N 3.26Å; D1171-S1173 VanDerWaalsContact O-N 3.13Å; D1171-S1173 PolarHBondContact OD1-OG 3.35Å; D1171-K1174 HydrophobicContact CB-CD 4.16Å; D1171-K1174 HydrophobicContact CB-CG 4.34Å; D1171-K1174 PolarHBondContact O-N 3.2Å; D1171-K1174 IonicContact OD2-NZ 3.01Å; D1171-K1174 PolarHBondContact OD2-NZ 3.5Å
1172	H	33.3	Very low	40.6	Very low	155 Å²	155	119.3 Å²	119.3	72%	0.718	65%	0.649	S	S	*	*	G	3₁₀ helix	trans	-77.1	-4.1	175.6	-77	-56.9	0	0	0	115.6	Y690 M1170 K1174 L1175	Y690-H1172 HydrophobicContact CD1-CB 4.15Å; Y690-H1172 HydrophobicContact CE1-CB 4.02Å; Y690-H1172 AromaticContact CZ-CD2 3.8Å; M1170-H1172 PolarHBondContact O-N 3.06Å; M1170-H1172 VanDerWaalsContact O-N 3.13Å; H1172-K1174 VanDerWaalsContact C-N 3.3Å; H1172-K1174 PolarHBondContact O-N 3.04Å; H1172-L1175 PolarHBondContact O-N 2.82Å
1173	S	34.4	Very low	42.8	Very low	100.2 Å²	100.2	113.3 Å²	113.3	70%	0.701	62%	0.617	S	S	*	*	G	3₁₀ helix	trans	-76.4	-10.7	178	61.1	0	0	0	0	114.2	D1171	D1171-S1173 PolarHBondContact O-N 3.26Å; D1171-S1173 VanDerWaalsContact O-N 3.13Å; D1171-S1173 PolarHBondContact OD1-OG 3.35Å
1174	K	33.5	Very low	45.3	Very low	143.4 Å²	143.4	115.2 Å²	115.2	62%	0.623	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-89.6	-6.1	-179.7	-76.5	-179.8	179.4	166.5	0	115.6	D1171 H1172 I1176 T1177 S1178	D1171-K1174 HydrophobicContact CB-CD 4.16Å; D1171-K1174 HydrophobicContact CB-CG 4.34Å; D1171-K1174 PolarHBondContact O-N 3.2Å; D1171-K1174 IonicContact OD2-NZ 3.01Å; D1171-K1174 PolarHBondContact OD2-NZ 3.5Å; H1172-K1174 VanDerWaalsContact C-N 3.3Å; H1172-K1174 PolarHBondContact O-N 3.04Å; K1174-I1176 PolarHBondContact O-N 3.12Å; K1174-T1177 PolarHBondContact O-OG1 3.06Å; K1174-S1178 PolarHBondContact O-N 2.82Å
1175	L	34	Very low	47.7	Very low	117.4 Å²	117.4	118.2 Å²	118.2	62%	0.615	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	-14.8	-169.7	-99.7	134.3	0	0	0	115.7	R664 H1172 T1177 S1178	R664-L1175 PolarHBondContact NH1-O 2.95Å; R664-L1175 VanDerWaalsContact NH1-O 3.11Å; R664-L1175 PolarHBondContact NH2-O 3.29Å; H1172-L1175 PolarHBondContact O-N 2.82Å; L1175-T1177 PolarHBondContact O-N 2.93Å; L1175-S1178 WeakPolarHBondContact O-CA 3.44Å; L1175-S1178 WeakPolarHBondContact O-CB 3.11Å; L1175-S1178 PolarHBondContact O-N 3.2Å; L1175-S1178 PolarHBondContact O-OG 3.33Å; L1175-S1178 VanDerWaalsContact O-OG 3.04Å
1176	I	38.6	Very low	50.4	Low	117.6 Å²	117.6	109.8 Å²	109.8	60%	0.603	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106	-2.8	177.7	-51.5	175.1	0	0	0	111.5	R664 Q1152 K1174 S1178	R664-I1176 VanDerWaalsContact NH1-C 3.32Å; R664-I1176 PolarHBondContact NH1-O 2.88Å; Q1152-I1176 HydrophobicContact CB-CD1 4.2Å; Q1152-I1176 HydrophobicContact CG-CB 4.02Å; Q1152-I1176 HydrophobicContact CG-CD1 3.85Å; Q1152-I1176 HydrophobicContact CG-CG2 3.81Å; Q1152-I1176 PolarHBondContact NE2-O 2.9Å; K1174-I1176 PolarHBondContact O-N 3.12Å; I1176-S1178 VanDerWaalsContact C-N 3.26Å; I1176-S1178 PolarHBondContact O-N 3.04Å
1177	T	40.5	Very low	53.2	Low	94.8 Å²	94.8	104.2 Å²	104.2	58%	0.582	55%	0.551	S	S	*	*	S	Bend	trans	-75.4	33.5	167.8	36	0	0	0	0	111.6	K1174 L1175 Q1179	K1174-T1177 PolarHBondContact O-OG1 3.06Å; L1175-T1177 PolarHBondContact O-N 2.93Å; T1177-Q1179 VanDerWaalsContact C-N 3.35Å; T1177-Q1179 PolarHBondContact O-N 2.83Å; T1177-Q1179 VanDerWaalsContact O-N 3.08Å
1178	S	48.2	Very low	56	Low	71.6 Å²	71.6	97.2 Å²	97.2	50%	0.501	51%	0.513	S	S	.	.			trans	-64	36.9	-175	67.2	0	0	0	0	114.5	R664 K1174 L1175 I1176 R1180	R664-S1178 PolarHBondContact NH2-OG 2.9Å; K1174-S1178 PolarHBondContact O-N 2.82Å; L1175-S1178 WeakPolarHBondContact O-CA 3.44Å; L1175-S1178 WeakPolarHBondContact O-CB 3.11Å; L1175-S1178 PolarHBondContact O-N 3.2Å; L1175-S1178 PolarHBondContact O-OG 3.33Å; L1175-S1178 VanDerWaalsContact O-OG 3.04Å; I1176-S1178 VanDerWaalsContact C-N 3.26Å; I1176-S1178 PolarHBondContact O-N 3.04Å; S1178-R1180 PolarHBondContact O-N 3.35Å; S1178-R1180 PolarHBondContact OG-O 2.86Å
1179	Q	59.9	Low	58.7	Low	115.6 Å²	115.6	89.7 Å²	89.7	54%	0.54	47%	0.473	S	S	.	.	S	Bend	trans	-88.1	-19	179.7	-72.5	-177.3	-11.9	0	0	114.3	A662 L1066 M1147 T1177	A662-Q1179 PolarHBondContact O-NE2 3.25Å; L1066-Q1179 WeakPolarHBondContact CD1-O 3.32Å; M1147-Q1179 PolarHBondContact SD-NE2 3.33Å; T1177-Q1179 VanDerWaalsContact C-N 3.35Å; T1177-Q1179 PolarHBondContact O-N 2.83Å; T1177-Q1179 VanDerWaalsContact O-N 3.08Å
1180	R	72.2	Confident	61.4	Low	46.4 Å²	46.4	85.3 Å²	85.3	18%	0.175	44%	0.441	C	S	.	.	S	Bend	trans	-84.6	133.1	177.9	-73.4	-180	78.6	-134.2	0.2	110.2	Y757 L1065 L1066 E1069 S1135 S1139 Y1142 S1178 I1182	Y757-R1180 WeakPolarHBondContact OH-CG 3.22Å; L1065-R1180 VanDerWaalsContact CD2-NH1 3.32Å; L1066-R1180 HydrophobicContact CD1-CB 4.42Å; L1066-R1180 HydrophobicContact CD1-CG 3.95Å; E1069-R1180 IonicContact OE1-CZ 3.04Å; E1069-R1180 VanDerWaalsContact OE1-CZ 3.27Å; E1069-R1180 IonicContact OE1-NE 3.03Å; E1069-R1180 PolarHBondContact OE1-NE 3.19Å; E1069-R1180 IonicContact OE1-NH1 3.37Å; E1069-R1180 PolarHBondContact OE1-NH1 3.24Å; E1069-R1180 IonicContact OE1-NH2 2.98Å; E1069-R1180 PolarHBondContact OE1-NH2 2.95Å; E1069-R1180 WeakPolarHBondContact OE2-CD 3.33Å; E1069-R1180 WeakPolarHBondContact OE2-CG 3.39Å; E1069-R1180 IonicContact OE2-CZ 3.25Å; E1069-R1180 IonicContact OE2-NE 3.16Å; E1069-R1180 PolarHBondContact OE2-NE 3.1Å; E1069-R1180 IonicContact OE2-NH1 3.58Å; E1069-R1180 PolarHBondContact OE2-NH1 3.17Å; E1069-R1180 IonicContact OE2-NH2 3.59Å; E1069-R1180 PolarHBondContact OE2-NH2 2.82Å; S1135-R1180 PolarHBondContact OG-NH2 3.28Å; S1139-R1180 PolarHBondContact O-NH1 3.27Å; S1139-R1180 PolarHBondContact O-NH2 3.08Å; Y1142-R1180 PolarHBondContact O-NH1 3.07Å; S1178-R1180 PolarHBondContact O-N 3.35Å; S1178-R1180 PolarHBondContact OG-O 2.86Å; R1180-I1182 PolarHBondContact O-N 3.4Å
1181	P	73	Confident	64.3	Low	24 Å²	24	79.1 Å²	79.1	16%	0.156	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-65.5	138.4	176	28.1	-33.3	0	0	0	110.3	E1069 N1073 F1183	E1069-P1181 HydrophobicContact CB-CG 3.75Å; N1073-P1181 HydrophobicContact CB-CB 4.12Å; N1073-P1181 HydrophobicContact CB-CG 4.18Å; P1181-F1183 HydrophobicContact CB-CE1 4.17Å; P1181-F1183 HydrophobicContact CB-CZ 4.12Å; P1181-F1183 HydrophobicContact CG-CE1 4.06Å; P1181-F1183 HydrophobicContact CG-CE2 4.1Å; P1181-F1183 HydrophobicContact CG-CZ 3.54Å; P1181-F1183 VanDerWaalsContact CG-CZ 3.47Å; P1181-F1183 PolarHBondContact O-N 2.88Å
1182	I	77.9	Confident	66.8	Low	130.8 Å²	130.8	73.9 Å²	73.9	67%	0.671	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-91.1	119.4	172.4	-59.7	170.9	0	0	0	107.1	R1180	R1180-I1182 PolarHBondContact O-N 3.4Å
1183	F	82.2	Confident	69.1	Low	22.6 Å²	22.6	66.5 Å²	66.5	10%	0.099	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-88.9	143.1	178.1	-58.2	-66.8	0	0	0	111.4	E1069 F1072 N1073 L1136 P1181	E1069-F1183 HydrophobicContact CB-CE2 4.07Å; E1069-F1183 HydrophobicContact CB-CZ 3.86Å; E1069-F1183 HydrophobicContact CG-CE2 3.89Å; E1069-F1183 HydrophobicContact CG-CZ 4.17Å; E1069-F1183 WeakPolarHBondContact O-CZ 3.34Å; F1072-F1183 HydrophobicContact CB-CE1 4.43Å; F1072-F1183 HydrophobicContact CB-CZ 4.4Å; F1072-F1183 AromaticContact CD1-CD1 3.94Å; F1072-F1183 HydrophobicContact CD1-CD1 3.94Å; F1072-F1183 AromaticContact CD1-CE1 3.62Å; F1072-F1183 HydrophobicContact CD1-CE1 3.62Å; F1072-F1183 HydrophobicContact CD1-CZ 4.25Å; F1072-F1183 HydrophobicContact CE1-CD1 4.29Å; F1072-F1183 HydrophobicContact CE1-CE1 4.41Å; F1072-F1183 HydrophobicContact CG-CE1 4.45Å; N1073-F1183 HydrophobicContact CB-CE1 4.13Å; L1136-F1183 HydrophobicContact CD2-CB 4.13Å; L1136-F1183 HydrophobicContact CD2-CD1 4.14Å; L1136-F1183 HydrophobicContact CD2-CD2 4.06Å; L1136-F1183 HydrophobicContact CD2-CE1 4.37Å; L1136-F1183 HydrophobicContact CD2-CE2 4.41Å; L1136-F1183 HydrophobicContact CD2-CG 3.83Å; P1181-F1183 HydrophobicContact CB-CE1 4.17Å; P1181-F1183 HydrophobicContact CB-CZ 4.12Å; P1181-F1183 HydrophobicContact CG-CE1 4.06Å; P1181-F1183 HydrophobicContact CG-CE2 4.1Å; P1181-F1183 HydrophobicContact CG-CZ 3.54Å; P1181-F1183 VanDerWaalsContact CG-CZ 3.47Å; P1181-F1183 PolarHBondContact O-N 2.88Å
1184	V	81.5	Confident	71.1	Confident	103.8 Å²	103.8	64.4 Å²	64.4	63%	0.629	33%	0.328	S	S	*	.	P	Polyproline II helix	trans	-63.4	145	160.9	-177.6	0	0	0	0	107.5	H1186 Q1275	V1184-H1186 PolarHBondContact O-CE1 3.12Å; V1184-H1186 VanDerWaalsContact O-CE1 3.24Å; V1184-H1186 PolarHBondContact O-N 3.26Å; V1184-H1186 PolarHBondContact O-ND1 3.23Å; V1184-Q1275 HydrophobicContact CG1-CG 4.38Å
1185	K	82.4	Confident	73	Confident	165.6 Å²	165.6	58 Å²	58	72%	0.72	30%	0.303	S	S	*	.	P	Polyproline II helix	trans	-60	124.5	177.7	-85.9	-175.5	176.4	-176.6	0	110.4
1186	H	86.6	Confident	74.6	Confident	15.4 Å²	15.4	52.8 Å²	52.8	7%	0.071	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	145	174.3	-66.9	72.7	0	0	0	110.7	F1072 L1136 V1184 I1188 Q1275 A1277 R1303	F1072-H1186 AromaticContact CE1-CE1 3.84Å; F1072-H1186 AromaticContact CE1-NE2 3.83Å; F1072-H1186 AromaticContact CZ-NE2 3.84Å; L1136-H1186 HydrophobicContact CB-CB 4.41Å; L1136-H1186 PolarHBondContact O-N 3.01Å; V1184-H1186 PolarHBondContact O-CE1 3.12Å; V1184-H1186 VanDerWaalsContact O-CE1 3.24Å; V1184-H1186 PolarHBondContact O-N 3.26Å; V1184-H1186 PolarHBondContact O-ND1 3.23Å; H1186-I1188 HydrophobicContact CB-CG1 4.2Å; H1186-I1188 PolarHBondContact O-N 2.88Å; H1186-Q1275 CarbonylContact C-O 3.48Å; H1186-Q1275 WeakPolarHBondContact CA-O 3.34Å; H1186-Q1275 HydrophobicContact CB-CB 4.48Å; H1186-Q1275 VanDerWaalsContact CD2-CB 3.46Å; H1186-Q1275 WeakPolarHBondContact CD2-CB 3.36Å; H1186-A1277 HydrophobicContact CB-CB 4.1Å; H1186-R1303 PolarHBondContact NE2-NH1 3.05Å; H1186-R1303 VanDerWaalsContact NE2-NH1 3.14Å
1187	Q	86.5	Confident	75.7	Confident	62.8 Å²	62.8	49.7 Å²	49.7	29%	0.293	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	117.4	160.6	-131.4	17.8	14.2	0	0	108.3	I1274 Q1275 F1276 A1277	Q1187-I1274 HydrophobicContact CB-CG2 4.47Å; Q1187-I1274 HydrophobicContact CG-CG2 3.72Å; Q1187-Q1275 PolarHBondContact N-O 3.18Å; Q1187-F1276 HydrophobicContact CB-CD1 3.7Å; Q1187-F1276 HydrophobicContact CB-CE1 3.84Å; Q1187-F1276 HydrophobicContact CB-CG 4.45Å; Q1187-F1276 HydrophobicContact CG-CD1 4.23Å; Q1187-F1276 HydrophobicContact CG-CE1 4.01Å; Q1187-F1276 WeakPolarHBondContact O-CA 3.18Å; Q1187-A1277 PolarHBondContact O-N 3.23Å
1188	I	86.6	Confident	76.6	Confident	8.2 Å²	8.2	48.7 Å²	48.7	4%	0.042	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	130.7	-170.5	-61	-173.9	0	0	0	110.6	T1133 L1136 I1137 H1186 I1190 A1277 L1279	T1133-I1188 HydrophobicContact CG2-CD1 4.06Å; T1133-I1188 HydrophobicContact CG2-CG2 4.03Å; T1133-I1188 VanDerWaalsContact O-CD1 3.25Å; T1133-I1188 WeakPolarHBondContact O-CD1 3.33Å; L1136-I1188 HydrophobicContact CB-CD1 3.65Å; L1136-I1188 HydrophobicContact CB-CG1 4.49Å; L1136-I1188 HydrophobicContact CD1-CD1 4.32Å; I1137-I1188 HydrophobicContact CD1-CD1 3.79Å; I1137-I1188 HydrophobicContact CD1-CG1 4.34Å; I1137-I1188 HydrophobicContact CG1-CD1 3.45Å; I1137-I1188 VanDerWaalsContact CG1-CD1 3.47Å; I1137-I1188 HydrophobicContact CG1-CG1 4.22Å; H1186-I1188 HydrophobicContact CB-CG1 4.2Å; H1186-I1188 PolarHBondContact O-N 2.88Å; I1188-I1190 HydrophobicContact CG2-CB 4.29Å; I1188-I1190 HydrophobicContact CG2-CG2 4.33Å; I1188-A1277 WeakPolarHBondContact CA-O 3.44Å; I1188-A1277 HydrophobicContact CG1-CB 4.37Å; I1188-L1279 HydrophobicContact CG1-CD1 4.44Å; I1188-L1279 HydrophobicContact CG2-CD1 3.62Å; I1188-L1279 VanDerWaalsContact CG2-CD1 3.46Å
1189	L	88.4	Confident	77	Confident	4.4 Å²	4.4	46.4 Å²	46.4	2%	0.023	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	113.2	163.7	-67.8	107.9	0	0	0	107.8	W1214 L1217 L1218 A1277 F1278 L1279	L1189-W1214 HydrophobicContact CB-CD2 4.43Å; L1189-W1214 HydrophobicContact CB-CG 4.47Å; L1189-W1214 HydrophobicContact CB-CZ2 4.47Å; L1189-W1214 HydrophobicContact CD2-CB 3.99Å; L1189-W1214 HydrophobicContact CD2-CD2 4.46Å; L1189-W1214 HydrophobicContact CD2-CG 3.9Å; L1189-L1217 HydrophobicContact CD2-CB 4.05Å; L1189-L1217 HydrophobicContact CD2-CD1 4.2Å; L1189-L1218 HydrophobicContact CD1-CD1 4.4Å; L1189-L1218 HydrophobicContact CD1-CD2 3.82Å; L1189-L1218 HydrophobicContact CD1-CG 4.04Å; L1189-L1218 HydrophobicContact CD2-CD2 4.24Å; L1189-L1218 HydrophobicContact CD2-CG 4.08Å; L1189-A1277 PolarHBondContact N-O 3.1Å; L1189-F1278 HydrophobicContact CB-CD1 3.93Å; L1189-F1278 HydrophobicContact CB-CE1 4.2Å; L1189-F1278 HydrophobicContact CD1-CD1 4.16Å; L1189-F1278 HydrophobicContact CD1-CE1 3.66Å; L1189-F1278 HydrophobicContact CD1-CZ 4.04Å; L1189-F1278 HydrophobicContact CD2-CE1 4.19Å; L1189-F1278 HydrophobicContact CG-CD1 4.47Å; L1189-F1278 HydrophobicContact CG-CE1 4.29Å; L1189-F1278 CarbonylContact O-C 3.46Å; L1189-F1278 WeakPolarHBondContact O-CA 3.31Å; L1189-L1279 PolarHBondContact O-N 3.04Å
1190	I	88.8	Confident	76.7	Confident	20.4 Å²	20.4	42.6 Å²	42.6	11%	0.105	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	144	-177.4	-173.9	160.4	0	0	0	110.7	T1045 F1048 L1049 L1129 T1133 I1188 F1192 L1279	T1045-I1190 HydrophobicContact CG2-CG2 4.42Å; F1048-I1190 HydrophobicContact CD1-CG2 4.4Å; F1048-I1190 HydrophobicContact CE1-CG2 3.96Å; L1049-I1190 HydrophobicContact CD1-CD1 4.47Å; L1049-I1190 HydrophobicContact CD2-CG2 3.81Å; L1129-I1190 HydrophobicContact CD2-CD1 3.69Å; L1129-I1190 VanDerWaalsContact CD2-CD1 3.45Å; L1129-I1190 HydrophobicContact CD2-CG1 4.21Å; L1129-I1190 HydrophobicContact CG-CD1 4.33Å; T1133-I1190 HydrophobicContact CG2-CD1 3.97Å; T1133-I1190 VanDerWaalsContact OG1-CD1 3.29Å; T1133-I1190 WeakPolarHBondContact OG1-CD1 3.39Å; I1188-I1190 HydrophobicContact CG2-CB 4.29Å; I1188-I1190 HydrophobicContact CG2-CG2 4.33Å; I1190-F1192 HydrophobicContact CD1-CD2 4.44Å; I1190-F1192 HydrophobicContact CD1-CE1 4.33Å; I1190-F1192 HydrophobicContact CD1-CE2 3.55Å; I1190-F1192 VanDerWaalsContact CD1-CE2 3.43Å; I1190-F1192 HydrophobicContact CD1-CZ 3.42Å; I1190-F1192 VanDerWaalsContact CD1-CZ 3.45Å; I1190-F1192 HydrophobicContact CG1-CD2 4.27Å; I1190-F1192 HydrophobicContact CG1-CE2 3.69Å; I1190-F1192 HydrophobicContact CG1-CZ 3.99Å; I1190-F1192 HydrophobicContact CG2-CE2 4.41Å; I1190-L1279 CarbonylContact C-O 3.47Å; I1190-L1279 VanDerWaalsContact CA-O 3.31Å; I1190-L1279 WeakPolarHBondContact CA-O 3.28Å; I1190-L1279 HydrophobicContact CB-CB 4.28Å; I1190-L1279 HydrophobicContact CD1-CB 4.28Å; I1190-L1279 HydrophobicContact CD1-CD2 4.31Å; I1190-L1279 HydrophobicContact CG1-CB 4.02Å
1191	H	88.1	Confident	76.1	Confident	27 Å²	27	42 Å²	42	13%	0.125	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	136.3	174.1	-170.5	66.2	0	0	0	111.5	N1204 I1210 W1214 L1279 I1280 D1281	H1191-N1204 PolarHBondContact NE2-O 3.23Å; H1191-I1210 HydrophobicContact CB-CG2 4.43Å; H1191-I1210 VanDerWaalsContact CD2-CD1 3.44Å; H1191-I1210 WeakPolarHBondContact CD2-CD1 3.33Å; H1191-I1210 VanDerWaalsContact NE2-CD1 3.3Å; H1191-I1210 WeakPolarHBondContact NE2-CD1 3.42Å; H1191-I1210 WeakPolarHBondContact NE2-CG1 3.41Å; H1191-W1214 HydrophobicContact CB-CZ2 4.02Å; H1191-L1279 PolarHBondContact N-O 3.06Å; H1191-I1280 WeakPolarHBondContact O-CA 3.38Å; H1191-D1281 PolarHBondContact O-N 3.33Å
1192	F	85.4	Confident	75.3	Confident	4.6 Å²	4.6	44.5 Å²	44.5	2%	0.02	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	104	176.1	-65.5	-86.7	0	0	0	109.7	L1049 V1053 T1126 L1129 I1190 N1194 G1195 L1196 L1201 D1281	L1049-F1192 HydrophobicContact CD2-CE2 4.15Å; L1049-F1192 HydrophobicContact CD2-CZ 3.87Å; V1053-F1192 HydrophobicContact CG1-CZ 4.29Å; V1053-F1192 HydrophobicContact CG2-CE2 3.7Å; V1053-F1192 HydrophobicContact CG2-CZ 3.97Å; T1126-F1192 HydrophobicContact CG2-CD1 4.1Å; T1126-F1192 HydrophobicContact CG2-CE1 3.89Å; L1129-F1192 HydrophobicContact CD2-CD1 4.45Å; L1129-F1192 HydrophobicContact CD2-CE1 3.93Å; L1129-F1192 HydrophobicContact CD2-CZ 4.13Å; I1190-F1192 HydrophobicContact CD1-CD2 4.44Å; I1190-F1192 HydrophobicContact CD1-CE1 4.33Å; I1190-F1192 HydrophobicContact CD1-CE2 3.55Å; I1190-F1192 VanDerWaalsContact CD1-CE2 3.43Å; I1190-F1192 HydrophobicContact CD1-CZ 3.42Å; I1190-F1192 VanDerWaalsContact CD1-CZ 3.45Å; I1190-F1192 HydrophobicContact CG1-CD2 4.27Å; I1190-F1192 HydrophobicContact CG1-CE2 3.69Å; I1190-F1192 HydrophobicContact CG1-CZ 3.99Å; I1190-F1192 HydrophobicContact CG2-CE2 4.41Å; F1192-N1194 VanDerWaalsContact C-N 3.28Å; F1192-N1194 PolarHBondContact O-N 3.12Å; F1192-G1195 PolarHBondContact O-N 3.05Å; F1192-L1196 HydrophobicContact CD1-CD1 4.25Å; F1192-L1196 HydrophobicContact CD1-CD2 3.71Å; F1192-L1196 HydrophobicContact CD1-CG 4.01Å; F1192-L1196 HydrophobicContact CD2-CD1 3.92Å; F1192-L1196 HydrophobicContact CD2-CG 4.12Å; F1192-L1196 HydrophobicContact CE1-CD1 4.08Å; F1192-L1196 HydrophobicContact CE1-CD2 3.7Å; F1192-L1196 HydrophobicContact CE1-CG 4.2Å; F1192-L1196 HydrophobicContact CE2-CD1 3.71Å; F1192-L1196 VanDerWaalsContact CE2-CD1 3.47Å; F1192-L1196 HydrophobicContact CE2-CG 4.29Å; F1192-L1196 HydrophobicContact CG-CD1 4.19Å; F1192-L1196 HydrophobicContact CG-CD2 4.23Å; F1192-L1196 HydrophobicContact CG-CG 4.03Å; F1192-L1196 HydrophobicContact CZ-CD1 3.79Å; F1192-L1196 HydrophobicContact CZ-CD2 4.18Å; F1192-L1196 HydrophobicContact CZ-CG 4.23Å; F1192-L1201 HydrophobicContact CB-CD2 4.2Å; F1192-L1201 HydrophobicContact CD2-CD1 4.11Å; F1192-L1201 HydrophobicContact CD2-CD2 3.71Å; F1192-L1201 HydrophobicContact CE2-CD1 4.24Å; F1192-L1201 HydrophobicContact CE2-CD2 4.43Å; F1192-L1201 HydrophobicContact CG-CD2 4.28Å; F1192-D1281 HydrophobicContact CB-CB 4.49Å; F1192-D1281 HydrophobicContact CD1-CB 3.54Å; F1192-D1281 VanDerWaalsContact CD1-CB 3.46Å; F1192-D1281 HydrophobicContact CE1-CB 4.12Å; F1192-D1281 HydrophobicContact CG-CB 4.33Å
1193	C	83.2	Confident	74.8	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-38	-174	-67.7	0	0	0	0	113.1	G1195 S1203 N1204 K1205 D1281 D1282 R1285	C1193-G1195 VanDerWaalsContact C-N 3.27Å; C1193-S1203 WeakPolarHBondContact O-CB 3.36Å; C1193-N1204 WeakPolarHBondContact CA-O 3.29Å; C1193-N1204 CarbonylContact O-C 3.54Å; C1193-N1204 PolarHBondContact O-N 3.21Å; C1193-K1205 WeakPolarHBondContact O-CG 3.19Å; C1193-D1281 VanDerWaalsContact CB-O 3.29Å; C1193-D1281 WeakPolarHBondContact CB-O 3.36Å; C1193-D1281 PolarHBondContact N-O 3.23Å; C1193-D1281 PolarHBondContact SG-O 3.04Å; C1193-D1282 HydrophobicContact CB-CB 4.41Å; C1193-D1282 PolarHBondContact SG-O 2.89Å; C1193-R1285 HydrophobicContact CB-CB 4.32Å
1194	N	75.8	Confident	74.3	Confident	56.6 Å²	56.6	41.4 Å²	41.4	30%	0.303	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	5.4	176.9	-70	-37.2	0	0	0	113.4	F1192 S1203 K1205 D1282	F1192-N1194 VanDerWaalsContact C-N 3.28Å; F1192-N1194 PolarHBondContact O-N 3.12Å; N1194-S1203 VanDerWaalsContact C-CB 3.43Å; N1194-S1203 WeakPolarHBondContact O-CB 3.44Å; N1194-K1205 VanDerWaalsContact OD1-CE 3.3Å; N1194-K1205 WeakPolarHBondContact OD1-CE 3.41Å; N1194-D1282 PolarHBondContact ND2-OD2 3.15Å
1195	G	72.5	Confident	74.1	Confident	8.8 Å²	8.8	39.3 Å²	39.3	9%	0.091	22%	0.219	C	C	.	.			trans	72.1	-167.8	-173.4	0	0	0	0	0	113.2	F1192 C1193 L1201 P1202	F1192-G1195 PolarHBondContact O-N 3.05Å; C1193-G1195 VanDerWaalsContact C-N 3.27Å; G1195-L1201 CarbonylContact C-O 3.52Å; G1195-L1201 WeakPolarHBondContact CA-O 3.38Å; G1195-P1202 WeakPolarHBondContact CA-O 3.29Å
1196	L	69	Low	73.9	Confident	7.2 Å²	7.2	35.2 Å²	35.2	4%	0.038	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-130	101.1	175.7	-75.8	167.3	0	0	0	108.5	L1049 Y1052 V1053 A1056 T1126 F1192 I1198 T1199 G1200 L1201	L1049-L1196 HydrophobicContact CD2-CD1 4.07Å; Y1052-L1196 HydrophobicContact CD1-CD2 4.02Å; Y1052-L1196 HydrophobicContact CD2-CD2 4.2Å; Y1052-L1196 HydrophobicContact CE1-CD2 3.82Å; Y1052-L1196 HydrophobicContact CE2-CD2 4.03Å; Y1052-L1196 HydrophobicContact CG-CD2 4.19Å; Y1052-L1196 WeakPolarHBondContact O-CD1 3.23Å; V1053-L1196 HydrophobicContact CG2-CD1 4.22Å; A1056-L1196 HydrophobicContact CB-CD2 4.35Å; T1126-L1196 HydrophobicContact CG2-CD2 3.58Å; T1126-L1196 VanDerWaalsContact CG2-CD2 3.44Å; T1126-L1196 HydrophobicContact CG2-CG 4.49Å; F1192-L1196 HydrophobicContact CD1-CD1 4.25Å; F1192-L1196 HydrophobicContact CD1-CD2 3.71Å; F1192-L1196 HydrophobicContact CD1-CG 4.01Å; F1192-L1196 HydrophobicContact CD2-CD1 3.92Å; F1192-L1196 HydrophobicContact CD2-CG 4.12Å; F1192-L1196 HydrophobicContact CE1-CD1 4.08Å; F1192-L1196 HydrophobicContact CE1-CD2 3.7Å; F1192-L1196 HydrophobicContact CE1-CG 4.2Å; F1192-L1196 HydrophobicContact CE2-CD1 3.71Å; F1192-L1196 VanDerWaalsContact CE2-CD1 3.47Å; F1192-L1196 HydrophobicContact CE2-CG 4.29Å; F1192-L1196 HydrophobicContact CG-CD1 4.19Å; F1192-L1196 HydrophobicContact CG-CD2 4.23Å; F1192-L1196 HydrophobicContact CG-CG 4.03Å; F1192-L1196 HydrophobicContact CZ-CD1 3.79Å; F1192-L1196 HydrophobicContact CZ-CD2 4.18Å; F1192-L1196 HydrophobicContact CZ-CG 4.23Å; L1196-I1198 VanDerWaalsContact C-N 3.28Å; L1196-I1198 HydrophobicContact CD2-CG2 4.2Å; L1196-I1198 PolarHBondContact O-N 3.1Å; L1196-I1198 VanDerWaalsContact O-N 3.1Å; L1196-T1199 HydrophobicContact CB-CG2 4.05Å; L1196-T1199 WeakPolarHBondContact CB-OG1 3.37Å; L1196-T1199 HydrophobicContact CD1-CG2 4.49Å; L1196-T1199 CarbonylContact O-C 3.54Å; L1196-T1199 PolarHBondContact O-N 3.04Å; L1196-T1199 PolarHBondContact O-OG1 3.33Å; L1196-G1200 WeakPolarHBondContact O-CA 3.29Å; L1196-G1200 PolarHBondContact O-N 3.06Å; L1196-L1201 HydrophobicContact CB-CB 3.93Å; L1196-L1201 HydrophobicContact CB-CD1 4.41Å; L1196-L1201 HydrophobicContact CB-CD2 4.47Å; L1196-L1201 HydrophobicContact CD1-CD1 4.12Å; L1196-L1201 HydrophobicContact CD1-CD2 4.1Å; L1196-L1201 HydrophobicContact CG-CB 4.42Å; L1196-L1201 HydrophobicContact CG-CD2 4.19Å; L1196-L1201 PolarHBondContact N-O 3.17Å; L1196-L1201 VanDerWaalsContact N-O 3.14Å; L1196-L1201 PolarHBondContact O-N 3.2Å; L1196-L1201 VanDerWaalsContact O-N 3.14Å
1197	S	60.7	Low	73.8	Confident	53.8 Å²	53.8	34.6 Å²	34.6	38%	0.376	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-35.4	-178.4	22	0	0	0	0	113	T1199 G1200 S1526 R1564 S1567 S1569	S1197-T1199 VanDerWaalsContact C-N 3.33Å; S1197-T1199 PolarHBondContact O-N 3.23Å; S1197-G1200 PolarHBondContact O-N 2.79Å; S1197-S1526 WeakPolarHBondContact CA-OG 3.37Å; S1197-S1526 VanDerWaalsContact CB-CB 3.43Å; S1197-S1526 VanDerWaalsContact CB-OG 3.31Å; S1197-S1526 WeakPolarHBondContact CB-OG 3.4Å; S1197-S1526 WeakPolarHBondContact O-CB 3.49Å; S1197-S1526 PolarHBondContact O-OG 3.08Å; S1197-S1526 PolarHBondContact OG-OG 3.16Å; S1197-R1564 WeakPolarHBondContact O-CD 3.07Å; S1197-R1564 PolarHBondContact O-NE 2.92Å; S1197-R1564 VanDerWaalsContact O-NE 3.07Å; S1197-S1567 PolarHBondContact OG-OG 3.04Å; S1197-S1569 PolarHBondContact OG-O 2.88Å
1198	I	59.5	Low	73.5	Confident	73.2 Å²	73.2	34.1 Å²	34.1	38%	0.375	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-26.7	-178.3	-162.6	157.8	0	0	0	113.7	Y1052 S1055 A1056 L1196 D1530 R1564	Y1052-I1198 HydrophobicContact CD2-CG2 3.75Å; Y1052-I1198 HydrophobicContact CE2-CG2 4.41Å; Y1052-I1198 HydrophobicContact CG-CG2 4.32Å; S1055-I1198 WeakPolarHBondContact OG-CD1 3.48Å; A1056-I1198 HydrophobicContact CB-CG2 4.26Å; L1196-I1198 VanDerWaalsContact C-N 3.28Å; L1196-I1198 HydrophobicContact CD2-CG2 4.2Å; L1196-I1198 PolarHBondContact O-N 3.1Å; L1196-I1198 VanDerWaalsContact O-N 3.1Å; I1198-D1530 WeakPolarHBondContact CD1-OD2 3.41Å; I1198-D1530 WeakPolarHBondContact CG1-OD2 3.4Å; I1198-D1530 VanDerWaalsContact O-CG 3.29Å; I1198-R1564 PolarHBondContact O-NH2 3.48Å
1199	T	56.7	Low	73.1	Confident	23 Å²	23	36.7 Å²	36.7	14%	0.141	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.8	-3.3	179.9	58	0	0	0	0	112.7	W784 F1048 Y1052 S1055 L1196 S1197 L1201 R1564	W784-T1199 HydrophobicContact CZ2-CG2 4.25Å; F1048-T1199 HydrophobicContact CB-CG2 3.68Å; Y1052-T1199 VanDerWaalsContact O-CG2 3.24Å; Y1052-T1199 WeakPolarHBondContact O-CG2 3.28Å; Y1052-T1199 PolarHBondContact O-OG1 3.39Å; Y1052-T1199 VanDerWaalsContact O-OG1 3.04Å; S1055-T1199 WeakPolarHBondContact OG-CG2 3.44Å; L1196-T1199 HydrophobicContact CB-CG2 4.05Å; L1196-T1199 WeakPolarHBondContact CB-OG1 3.37Å; L1196-T1199 HydrophobicContact CD1-CG2 4.49Å; L1196-T1199 CarbonylContact O-C 3.54Å; L1196-T1199 PolarHBondContact O-N 3.04Å; L1196-T1199 PolarHBondContact O-OG1 3.33Å; S1197-T1199 VanDerWaalsContact C-N 3.33Å; S1197-T1199 PolarHBondContact O-N 3.23Å; T1199-L1201 VanDerWaalsContact C-N 3.32Å; T1199-L1201 HydrophobicContact CG2-CD1 4.42Å; T1199-L1201 PolarHBondContact O-N 3.22Å; T1199-L1201 WeakPolarHBondContact OG1-CB 3.38Å; T1199-L1201 WeakPolarHBondContact OG1-CD1 3.41Å; T1199-L1201 WeakPolarHBondContact OG1-CG 3.2Å; T1199-L1201 PolarHBondContact OG1-N 2.82Å; T1199-R1564 PolarHBondContact O-NH2 3.24Å
1200	G	54.4	Low	72.9	Confident	35.4 Å²	35.4	36.6 Å²	36.6	37%	0.365	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.6	16.2	-177.2	0	0	0	0	0	114.4	L1196 S1197 P1202 R1564	L1196-G1200 WeakPolarHBondContact O-CA 3.29Å; L1196-G1200 PolarHBondContact O-N 3.06Å; S1197-G1200 PolarHBondContact O-N 2.79Å; G1200-P1202 WeakPolarHBondContact O-CD 3.42Å; G1200-R1564 VanDerWaalsContact N-NH2 3.18Å
1201	L	58.5	Low	72.8	Confident	33.8 Å²	33.8	35.7 Å²	35.7	18%	0.177	20%	0.204	C	C	.	.	B	Isolated β-bridge	trans	-65.4	122.8	175.5	-154.7	94.9	0	0	0	108.8	T1045 F1048 Y1052 F1192 G1195 L1196 T1199 W1559	T1045-L1201 HydrophobicContact CG2-CD1 4.35Å; F1048-L1201 HydrophobicContact CE2-CD1 3.79Å; F1048-L1201 HydrophobicContact CE2-CD2 4.24Å; F1048-L1201 HydrophobicContact CZ-CD1 4.09Å; F1048-L1201 HydrophobicContact CZ-CD2 4.11Å; Y1052-L1201 HydrophobicContact CD1-CB 4.1Å; Y1052-L1201 HydrophobicContact CD1-CD1 4.13Å; Y1052-L1201 HydrophobicContact CE1-CD1 4.28Å; Y1052-L1201 HydrophobicContact CG-CD1 4.34Å; F1192-L1201 HydrophobicContact CB-CD2 4.2Å; F1192-L1201 HydrophobicContact CD2-CD1 4.11Å; F1192-L1201 HydrophobicContact CD2-CD2 3.71Å; F1192-L1201 HydrophobicContact CE2-CD1 4.24Å; F1192-L1201 HydrophobicContact CE2-CD2 4.43Å; F1192-L1201 HydrophobicContact CG-CD2 4.28Å; G1195-L1201 CarbonylContact C-O 3.52Å; G1195-L1201 WeakPolarHBondContact CA-O 3.38Å; L1196-L1201 HydrophobicContact CB-CB 3.93Å; L1196-L1201 HydrophobicContact CB-CD1 4.41Å; L1196-L1201 HydrophobicContact CB-CD2 4.47Å; L1196-L1201 HydrophobicContact CD1-CD1 4.12Å; L1196-L1201 HydrophobicContact CD1-CD2 4.1Å; L1196-L1201 HydrophobicContact CG-CB 4.42Å; L1196-L1201 HydrophobicContact CG-CD2 4.19Å; L1196-L1201 PolarHBondContact N-O 3.17Å; L1196-L1201 VanDerWaalsContact N-O 3.14Å; L1196-L1201 PolarHBondContact O-N 3.2Å; L1196-L1201 VanDerWaalsContact O-N 3.14Å; T1199-L1201 VanDerWaalsContact C-N 3.32Å; T1199-L1201 HydrophobicContact CG2-CD1 4.42Å; T1199-L1201 PolarHBondContact O-N 3.22Å; T1199-L1201 WeakPolarHBondContact OG1-CB 3.38Å; T1199-L1201 WeakPolarHBondContact OG1-CD1 3.41Å; T1199-L1201 WeakPolarHBondContact OG1-CG 3.2Å; T1199-L1201 PolarHBondContact OG1-N 2.82Å; L1201-W1559 HydrophobicContact CD1-CE3 4.4Å
1202	P	57	Low	72.6	Confident	76.8 Å²	76.8	37.4 Å²	37.4	50%	0.499	21%	0.212	S	C	.	.	P	Polyproline II helix	trans	-70.4	152.6	-175.3	27.8	-34.1	0	0	0	112	G1195 G1200 N1204	G1195-P1202 WeakPolarHBondContact CA-O 3.29Å; G1200-P1202 WeakPolarHBondContact O-CD 3.42Å; P1202-N1204 PolarHBondContact O-N 2.92Å
1203	S	66.7	Low	72.3	Confident	56.2 Å²	56.2	40.5 Å²	40.5	39%	0.393	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-74.9	130.6	175	66	0	0	0	0	111.1	C1193 N1194	C1193-S1203 WeakPolarHBondContact O-CB 3.36Å; N1194-S1203 VanDerWaalsContact C-CB 3.43Å; N1194-S1203 WeakPolarHBondContact O-CB 3.44Å
1204	N	71.3	Confident	72.4	Confident	33.2 Å²	33.2	40.8 Å²	40.8	18%	0.178	23%	0.23	C	C	.	.			trans	-132.7	118.7	165.9	-172.1	-11.5	0	0	0	110	H1191 C1193 P1202 K1206 E1209	H1191-N1204 PolarHBondContact NE2-O 3.23Å; C1193-N1204 WeakPolarHBondContact CA-O 3.29Å; C1193-N1204 CarbonylContact O-C 3.54Å; C1193-N1204 PolarHBondContact O-N 3.21Å; P1202-N1204 PolarHBondContact O-N 2.92Å; N1204-K1206 PolarHBondContact OD1-N 3.02Å; N1204-E1209 WeakPolarHBondContact ND2-CB 3.37Å; N1204-E1209 PolarHBondContact ND2-OE2 3.16Å; N1204-E1209 PolarHBondContact OD1-OE2 3.08Å
1205	K	77.4	Confident	72.9	Confident	59.8 Å²	59.8	38.1 Å²	38.1	26%	0.26	22%	0.216	S	C	.	.			trans	-105	-13.5	-176.9	-63.9	172.7	-173.4	160.2	0	113	C1193 N1194 L1207 R1285 L1286 E1287	C1193-K1205 WeakPolarHBondContact O-CG 3.19Å; N1194-K1205 VanDerWaalsContact OD1-CE 3.3Å; N1194-K1205 WeakPolarHBondContact OD1-CE 3.41Å; K1205-L1207 PolarHBondContact O-N 3.08Å; K1205-R1285 WeakPolarHBondContact CB-O 3.33Å; K1205-L1286 CarbonylContact O-C 3.48Å; K1205-L1286 WeakPolarHBondContact O-CA 3.39Å; K1205-E1287 HydrophobicContact CB-CB 4.48Å; K1205-E1287 HydrophobicContact CB-CG 4.31Å; K1205-E1287 PolarHBondContact O-N 3.29Å
1206	K	78.4	Confident	73.3	Confident	79 Å²	79	39.9 Å²	39.9	34%	0.343	22%	0.223	S	C	.	.	B	Isolated β-bridge	trans	-76.6	114.9	-171.9	-72.9	174.2	173.6	-174.3	0	110.2	N1204 N1208 E1209 I1210	N1204-K1206 PolarHBondContact OD1-N 3.02Å; K1206-N1208 VanDerWaalsContact C-N 3.27Å; K1206-N1208 WeakPolarHBondContact CB-OD1 3.26Å; K1206-N1208 PolarHBondContact O-N 3.03Å; K1206-E1209 HydrophobicContact CB-CB 4.28Å; K1206-E1209 HydrophobicContact CB-CG 4.13Å; K1206-E1209 VanDerWaalsContact CD-CD 3.46Å; K1206-E1209 HydrophobicContact CD-CG 4.16Å; K1206-E1209 WeakPolarHBondContact CD-OE1 3.36Å; K1206-E1209 WeakPolarHBondContact CE-OE1 3.45Å; K1206-E1209 IonicContact NZ-OE1 2.96Å; K1206-E1209 PolarHBondContact NZ-OE1 3.26Å; K1206-E1209 PolarHBondContact O-N 3.16Å; K1206-I1210 WeakPolarHBondContact O-CD1 3.41Å; K1206-I1210 VanDerWaalsContact O-CG1 3.3Å; K1206-I1210 WeakPolarHBondContact O-CG1 3.36Å; K1206-I1210 PolarHBondContact O-N 3.21Å; K1206-I1210 VanDerWaalsContact O-N 3.14Å
1207	L	84.1	Confident	73.8	Confident	2 Å²	2	42.2 Å²	42.2	1%	0.01	24%	0.235	C	C	.	.	H	α-helix	trans	-59	-36.3	-178.4	180	61.3	0	0	0	112.2	K1205 E1209 I1210 L1211 L1254 L1286 E1287 T1290 W1293	K1205-L1207 PolarHBondContact O-N 3.08Å; L1207-E1209 PolarHBondContact O-N 3.36Å; L1207-I1210 PolarHBondContact O-N 3.2Å; L1207-L1211 HydrophobicContact CD1-CD1 4.15Å; L1207-L1211 HydrophobicContact CD1-CD2 4.45Å; L1207-L1211 HydrophobicContact CD1-CG 3.99Å; L1207-L1211 HydrophobicContact CG-CD1 4Å; L1207-L1211 HydrophobicContact CG-CG 4.27Å; L1207-L1211 WeakPolarHBondContact O-CB 3.21Å; L1207-L1211 VanDerWaalsContact O-CG 3.3Å; L1207-L1211 WeakPolarHBondContact O-CG 3.33Å; L1207-L1211 PolarHBondContact O-N 3.03Å; L1207-L1254 HydrophobicContact CB-CD1 4.24Å; L1207-L1254 HydrophobicContact CD2-CD1 3.95Å; L1207-L1254 HydrophobicContact CD2-CD2 4.39Å; L1207-L1254 HydrophobicContact CG-CD1 3.96Å; L1207-L1286 HydrophobicContact CD1-CD1 4.4Å; L1207-L1286 HydrophobicContact CD1-CD2 4.36Å; L1207-E1287 WeakPolarHBondContact CB-O 3.24Å; L1207-E1287 PolarHBondContact N-O 3.03Å; L1207-T1290 HydrophobicContact CD2-CG2 3.76Å; L1207-W1293 HydrophobicContact CD1-CB 4.38Å; L1207-W1293 HydrophobicContact CD1-CD2 4.15Å; L1207-W1293 HydrophobicContact CD1-CG 3.91Å; L1207-W1293 HydrophobicContact CD2-CB 4.21Å; L1207-W1293 VanDerWaalsContact CD2-CD1 3.46Å; L1207-W1293 HydrophobicContact CD2-CG 3.96Å; L1207-W1293 HydrophobicContact CG-CG 4.43Å
1208	N	81.5	Confident	74.9	Confident	52.4 Å²	52.4	39.7 Å²	39.7	28%	0.28	22%	0.218	S	C	.	.	H	α-helix	trans	-58.8	-50.6	178	-160.4	-7.1	0	0	0	112	K1206 I1210 L1211 Q1212 I1252 L1254 Y1257	K1206-N1208 VanDerWaalsContact C-N 3.27Å; K1206-N1208 WeakPolarHBondContact CB-OD1 3.26Å; K1206-N1208 PolarHBondContact O-N 3.03Å; N1208-I1210 VanDerWaalsContact C-N 3.32Å; N1208-I1210 PolarHBondContact O-N 3.12Å; N1208-L1211 PolarHBondContact O-N 3.06Å; N1208-Q1212 VanDerWaalsContact O-CB 3.27Å; N1208-Q1212 WeakPolarHBondContact O-CB 3.33Å; N1208-Q1212 PolarHBondContact O-N 3.19Å; N1208-I1252 PolarHBondContact ND2-O 3.45Å; N1208-L1254 HydrophobicContact CB-CD1 4.17Å; N1208-L1254 WeakPolarHBondContact OD1-CA 3.03Å; N1208-L1254 WeakPolarHBondContact OD1-CB 3.41Å; N1208-L1254 WeakPolarHBondContact OD1-CD1 3.49Å; N1208-L1254 WeakPolarHBondContact OD1-CG 3.48Å; N1208-Y1257 HydrophobicContact CB-CD2 4.41Å; N1208-Y1257 WeakPolarHBondContact OD1-CD2 3.41Å; N1208-Y1257 WeakPolarHBondContact OD1-CE2 3.43Å
1209	E	78.6	Confident	76	Confident	63.6 Å²	63.6	37.2 Å²	37.2	30%	0.297	21%	0.205	S	C	.	.	H	α-helix	trans	-65.4	-37.6	-179.9	-65.1	177.8	-167.7	0	0	111.3	N1204 K1206 L1207 Q1212 N1213	N1204-E1209 WeakPolarHBondContact ND2-CB 3.37Å; N1204-E1209 PolarHBondContact ND2-OE2 3.16Å; N1204-E1209 PolarHBondContact OD1-OE2 3.08Å; K1206-E1209 HydrophobicContact CB-CB 4.28Å; K1206-E1209 HydrophobicContact CB-CG 4.13Å; K1206-E1209 VanDerWaalsContact CD-CD 3.46Å; K1206-E1209 HydrophobicContact CD-CG 4.16Å; K1206-E1209 WeakPolarHBondContact CD-OE1 3.36Å; K1206-E1209 WeakPolarHBondContact CE-OE1 3.45Å; K1206-E1209 IonicContact NZ-OE1 2.96Å; K1206-E1209 PolarHBondContact NZ-OE1 3.26Å; K1206-E1209 PolarHBondContact O-N 3.16Å; L1207-E1209 PolarHBondContact O-N 3.36Å; E1209-Q1212 PolarHBondContact O-N 3.19Å; E1209-N1213 VanDerWaalsContact O-CB 3.3Å; E1209-N1213 WeakPolarHBondContact O-CB 3.28Å; E1209-N1213 PolarHBondContact O-N 3.04Å; E1209-N1213 PolarHBondContact O-ND2 2.99Å; E1209-N1213 PolarHBondContact O-OD1 3.01Å
1210	I	84.2	Confident	77.1	Confident	2.4 Å²	2.4	40 Å²	40	1%	0.012	22%	0.218	C	C	.	.	H	α-helix	trans	-63.2	-50.3	176.5	-62.8	164.8	0	0	0	110.8	H1191 K1206 L1207 N1208 Q1212 N1213 W1214 L1286	H1191-I1210 HydrophobicContact CB-CG2 4.43Å; H1191-I1210 VanDerWaalsContact CD2-CD1 3.44Å; H1191-I1210 WeakPolarHBondContact CD2-CD1 3.33Å; H1191-I1210 VanDerWaalsContact NE2-CD1 3.3Å; H1191-I1210 WeakPolarHBondContact NE2-CD1 3.42Å; H1191-I1210 WeakPolarHBondContact NE2-CG1 3.41Å; K1206-I1210 WeakPolarHBondContact O-CD1 3.41Å; K1206-I1210 VanDerWaalsContact O-CG1 3.3Å; K1206-I1210 WeakPolarHBondContact O-CG1 3.36Å; K1206-I1210 PolarHBondContact O-N 3.21Å; K1206-I1210 VanDerWaalsContact O-N 3.14Å; L1207-I1210 PolarHBondContact O-N 3.2Å; N1208-I1210 VanDerWaalsContact C-N 3.32Å; N1208-I1210 PolarHBondContact O-N 3.12Å; I1210-Q1212 VanDerWaalsContact C-N 3.34Å; I1210-Q1212 PolarHBondContact O-N 3.19Å; I1210-N1213 PolarHBondContact O-N 3.15Å; I1210-W1214 HydrophobicContact CG2-CD2 4.23Å; I1210-W1214 HydrophobicContact CG2-CZ2 4.43Å; I1210-W1214 WeakPolarHBondContact O-CB 3.46Å; I1210-W1214 PolarHBondContact O-N 3.34Å; I1210-L1286 HydrophobicContact CD1-CD2 3.4Å; I1210-L1286 VanDerWaalsContact CD1-CD2 3.46Å
1211	L	86.7	Confident	78.2	Confident	0.6 Å²	0.6	39.9 Å²	39.9	0%	0.003	21%	0.208	C	C	.	.	H	α-helix	trans	-63.5	-42	179.4	-69.7	177	0	0	0	111.4	L1207 N1208 N1213 W1214 L1215 L1254 I1258 F1261 W1293	L1207-L1211 HydrophobicContact CD1-CD1 4.15Å; L1207-L1211 HydrophobicContact CD1-CD2 4.45Å; L1207-L1211 HydrophobicContact CD1-CG 3.99Å; L1207-L1211 HydrophobicContact CG-CD1 4Å; L1207-L1211 HydrophobicContact CG-CG 4.27Å; L1207-L1211 WeakPolarHBondContact O-CB 3.21Å; L1207-L1211 VanDerWaalsContact O-CG 3.3Å; L1207-L1211 WeakPolarHBondContact O-CG 3.33Å; L1207-L1211 PolarHBondContact O-N 3.03Å; N1208-L1211 PolarHBondContact O-N 3.06Å; L1211-N1213 VanDerWaalsContact C-N 3.34Å; L1211-N1213 PolarHBondContact O-N 3.36Å; L1211-W1214 PolarHBondContact O-N 3.21Å; L1211-L1215 VanDerWaalsContact O-CB 3.3Å; L1211-L1215 WeakPolarHBondContact O-CB 3.36Å; L1211-L1215 WeakPolarHBondContact O-CD1 3.42Å; L1211-L1215 VanDerWaalsContact O-CG 3.25Å; L1211-L1215 WeakPolarHBondContact O-CG 3.39Å; L1211-L1215 PolarHBondContact O-N 3.13Å; L1211-L1254 HydrophobicContact CD1-CD1 4.19Å; L1211-I1258 HydrophobicContact CD1-CG1 3.97Å; L1211-F1261 HydrophobicContact CD2-CB 4.14Å; L1211-F1261 HydrophobicContact CD2-CD1 3.98Å; L1211-F1261 HydrophobicContact CD2-CD2 3.97Å; L1211-F1261 HydrophobicContact CD2-CE1 4.37Å; L1211-F1261 HydrophobicContact CD2-CE2 4.38Å; L1211-F1261 HydrophobicContact CD2-CG 3.76Å; L1211-W1293 HydrophobicContact CD1-CB 4.16Å; L1211-W1293 HydrophobicContact CD2-CB 4.48Å; L1211-W1293 HydrophobicContact CD2-CE3 4.25Å
1212	Q	81.9	Confident	79.3	Confident	63 Å²	63	38.3 Å²	38.3	29%	0.294	20%	0.2	S	C	.	.	H	α-helix	trans	-59.9	-45.9	175.7	-176.2	-178	5.8	0	0	111.4	N1208 E1209 I1210 L1215 N1216 Y1257	N1208-Q1212 VanDerWaalsContact O-CB 3.27Å; N1208-Q1212 WeakPolarHBondContact O-CB 3.33Å; N1208-Q1212 PolarHBondContact O-N 3.19Å; E1209-Q1212 PolarHBondContact O-N 3.19Å; I1210-Q1212 VanDerWaalsContact C-N 3.34Å; I1210-Q1212 PolarHBondContact O-N 3.19Å; Q1212-L1215 PolarHBondContact O-N 3.07Å; Q1212-N1216 WeakPolarHBondContact O-CB 3.12Å; Q1212-N1216 VanDerWaalsContact O-CG 3.29Å; Q1212-N1216 PolarHBondContact O-N 3.1Å; Q1212-N1216 PolarHBondContact O-ND2 2.93Å; Q1212-Y1257 HydrophobicContact CB-CD1 4.44Å; Q1212-Y1257 HydrophobicContact CB-CE1 3.97Å; Q1212-Y1257 VanDerWaalsContact CD-OH 3.24Å; Q1212-Y1257 HydrophobicContact CG-CE1 4.05Å; Q1212-Y1257 WeakPolarHBondContact CG-OH 3.14Å; Q1212-Y1257 PolarHBondContact NE2-OH 3.21Å
1213	N	80.3	Confident	80.3	Confident	69.6 Å²	69.6	37.2 Å²	37.2	37%	0.372	19%	0.19	S	C	.	.	H	α-helix	trans	-64.1	-45.5	178.2	-89.3	-4.6	0	0	0	111.8	E1209 I1210 L1211 L1215 N1216 L1217	E1209-N1213 VanDerWaalsContact O-CB 3.3Å; E1209-N1213 WeakPolarHBondContact O-CB 3.28Å; E1209-N1213 PolarHBondContact O-N 3.04Å; E1209-N1213 PolarHBondContact O-ND2 2.99Å; E1209-N1213 PolarHBondContact O-OD1 3.01Å; I1210-N1213 PolarHBondContact O-N 3.15Å; L1211-N1213 VanDerWaalsContact C-N 3.34Å; L1211-N1213 PolarHBondContact O-N 3.36Å; N1213-L1215 VanDerWaalsContact C-N 3.34Å; N1213-L1215 PolarHBondContact O-N 3.14Å; N1213-N1216 PolarHBondContact O-N 3.24Å; N1213-L1217 WeakPolarHBondContact O-CB 3.09Å; N1213-L1217 VanDerWaalsContact O-CG 3.3Å; N1213-L1217 WeakPolarHBondContact O-CG 3.37Å; N1213-L1217 PolarHBondContact O-N 3.16Å
1214	W	85.6	Confident	80.7	Confident	5.6 Å²	5.6	39.7 Å²	39.7	2%	0.021	20%	0.199	C	C	.	.	H	α-helix	trans	-63	-40.8	176.7	-77	6.7	0	0	0	112.6	L1189 H1191 I1210 L1211 L1217 L1218 F1261 F1278 I1280 W1293 F1304	L1189-W1214 HydrophobicContact CB-CD2 4.43Å; L1189-W1214 HydrophobicContact CB-CG 4.47Å; L1189-W1214 HydrophobicContact CB-CZ2 4.47Å; L1189-W1214 HydrophobicContact CD2-CB 3.99Å; L1189-W1214 HydrophobicContact CD2-CD2 4.46Å; L1189-W1214 HydrophobicContact CD2-CG 3.9Å; H1191-W1214 HydrophobicContact CB-CZ2 4.02Å; I1210-W1214 HydrophobicContact CG2-CD2 4.23Å; I1210-W1214 HydrophobicContact CG2-CZ2 4.43Å; I1210-W1214 WeakPolarHBondContact O-CB 3.46Å; I1210-W1214 PolarHBondContact O-N 3.34Å; L1211-W1214 PolarHBondContact O-N 3.21Å; W1214-L1217 PolarHBondContact O-N 3.11Å; W1214-L1218 VanDerWaalsContact O-CB 3.28Å; W1214-L1218 WeakPolarHBondContact O-CB 3.31Å; W1214-L1218 VanDerWaalsContact O-CG 3.24Å; W1214-L1218 WeakPolarHBondContact O-CG 3.38Å; W1214-L1218 PolarHBondContact O-N 3.28Å; W1214-F1261 HydrophobicContact CB-CE2 4.45Å; W1214-F1261 AromaticContact CE3-CE2 3.72Å; W1214-F1261 HydrophobicContact CE3-CE2 3.72Å; W1214-F1261 AromaticContact CE3-CZ 3.74Å; W1214-F1261 HydrophobicContact CE3-CZ 3.74Å; W1214-F1261 HydrophobicContact CZ3-CE2 4.4Å; W1214-F1261 AromaticContact CZ3-CZ 3.95Å; W1214-F1261 HydrophobicContact CZ3-CZ 3.95Å; W1214-F1278 HydrophobicContact CD2-CD1 4.24Å; W1214-F1278 AromaticContact CE3-CD1 3.72Å; W1214-F1278 HydrophobicContact CE3-CD1 3.72Å; W1214-F1278 HydrophobicContact CE3-CE1 4.13Å; W1214-F1278 HydrophobicContact CH2-CB 4.01Å; W1214-F1278 AromaticContact CH2-CD1 3.93Å; W1214-F1278 HydrophobicContact CH2-CD1 3.93Å; W1214-F1278 HydrophobicContact CH2-CG 4.44Å; W1214-F1278 HydrophobicContact CZ2-CD1 4.44Å; W1214-F1278 HydrophobicContact CZ3-CB 4.23Å; W1214-F1278 AromaticContact CZ3-CD1 3.56Å; W1214-F1278 HydrophobicContact CZ3-CD1 3.56Å; W1214-F1278 VanDerWaalsContact CZ3-CD1 3.5Å; W1214-F1278 HydrophobicContact CZ3-CE1 4.37Å; W1214-F1278 HydrophobicContact CZ3-CG 4.3Å; W1214-I1280 HydrophobicContact CH2-CD1 3.55Å; W1214-I1280 VanDerWaalsContact CH2-CD1 3.48Å; W1214-I1280 HydrophobicContact CH2-CG1 3.46Å; W1214-I1280 VanDerWaalsContact CH2-CG1 3.46Å; W1214-I1280 HydrophobicContact CZ2-CD1 4.26Å; W1214-I1280 HydrophobicContact CZ2-CG1 3.87Å; W1214-I1280 HydrophobicContact CZ3-CD1 4.18Å; W1214-I1280 HydrophobicContact CZ3-CG1 4.44Å; W1214-W1293 HydrophobicContact CZ3-CH2 4.41Å; W1214-W1293 HydrophobicContact CZ3-CZ3 4.19Å; W1214-F1304 HydrophobicContact CH2-CE1 4.5Å; W1214-F1304 HydrophobicContact CZ3-CE1 4.21Å
1215	L	85.7	Confident	81	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-62.5	-44.7	175	-75.8	167.7	0	0	0	111.6	L1211 Q1212 N1213 L1217 L1218 I1219 F1243 Y1257 C1260 F1261 F1264	L1211-L1215 VanDerWaalsContact O-CB 3.3Å; L1211-L1215 WeakPolarHBondContact O-CB 3.36Å; L1211-L1215 WeakPolarHBondContact O-CD1 3.42Å; L1211-L1215 VanDerWaalsContact O-CG 3.25Å; L1211-L1215 WeakPolarHBondContact O-CG 3.39Å; L1211-L1215 PolarHBondContact O-N 3.13Å; Q1212-L1215 PolarHBondContact O-N 3.07Å; N1213-L1215 VanDerWaalsContact C-N 3.34Å; N1213-L1215 PolarHBondContact O-N 3.14Å; L1215-L1217 VanDerWaalsContact C-N 3.35Å; L1215-L1217 PolarHBondContact O-N 3.15Å; L1215-L1218 PolarHBondContact O-N 3.2Å; L1215-I1219 WeakPolarHBondContact O-CB 3.29Å; L1215-I1219 WeakPolarHBondContact O-CD1 3.39Å; L1215-I1219 VanDerWaalsContact O-CG1 3.27Å; L1215-I1219 WeakPolarHBondContact O-CG1 3.32Å; L1215-I1219 PolarHBondContact O-N 3.28Å; L1215-F1243 HydrophobicContact CB-CE2 4.04Å; L1215-F1243 HydrophobicContact CB-CZ 4.15Å; L1215-F1243 HydrophobicContact CD1-CD2 4.33Å; L1215-F1243 HydrophobicContact CD1-CE2 3.8Å; L1215-F1243 HydrophobicContact CD1-CZ 4.47Å; L1215-F1243 HydrophobicContact CG-CE2 4.44Å; L1215-Y1257 HydrophobicContact CD1-CD1 3.87Å; L1215-C1260 HydrophobicContact CD1-CB 4.02Å; L1215-C1260 HydrophobicContact CD2-CB 4.34Å; L1215-F1261 HydrophobicContact CD2-CB 4.5Å; L1215-F1261 HydrophobicContact CD2-CD2 4.36Å; L1215-F1261 HydrophobicContact CG-CD2 4.43Å; L1215-F1264 HydrophobicContact CD2-CB 4.09Å; L1215-F1264 HydrophobicContact CD2-CD1 4.44Å; L1215-F1264 HydrophobicContact CD2-CD2 3.45Å; L1215-F1264 VanDerWaalsContact CD2-CD2 3.44Å; L1215-F1264 HydrophobicContact CD2-CE2 3.94Å; L1215-F1264 HydrophobicContact CD2-CG 3.74Å
1216	N	80.6	Confident	80.9	Confident	46.6 Å²	46.6	37.7 Å²	37.7	25%	0.249	19%	0.191	C	C	.	.	H	α-helix	trans	-61.2	-44.7	175.8	-71.6	-32.3	0	0	0	111.7	Q1212 N1213 I1219 I1220 F1243 K1247	Q1212-N1216 WeakPolarHBondContact O-CB 3.12Å; Q1212-N1216 VanDerWaalsContact O-CG 3.29Å; Q1212-N1216 PolarHBondContact O-N 3.1Å; Q1212-N1216 PolarHBondContact O-ND2 2.93Å; N1213-N1216 PolarHBondContact O-N 3.24Å; N1216-I1219 PolarHBondContact O-N 3.24Å; N1216-I1220 WeakPolarHBondContact O-CD1 3.43Å; N1216-I1220 VanDerWaalsContact O-CG1 3.31Å; N1216-I1220 WeakPolarHBondContact O-CG1 3.37Å; N1216-I1220 PolarHBondContact O-N 3.43Å; N1216-I1220 VanDerWaalsContact O-N 3.12Å; N1216-F1243 VanDerWaalsContact OD1-CE1 3.27Å; N1216-F1243 WeakPolarHBondContact OD1-CE1 3.43Å; N1216-F1243 WeakPolarHBondContact OD1-CZ 3.48Å; N1216-K1247 PolarHBondContact OD1-NZ 3.24Å
1217	L	80.3	Confident	80.5	Confident	56.8 Å²	56.8	38.4 Å²	38.4	30%	0.297	20%	0.198	S	C	.	.	H	α-helix	trans	-63.9	-43.5	177.1	-72.1	173.5	0	0	0	112.1	L1189 N1213 W1214 L1215 I1219 I1220 Q1221	L1189-L1217 HydrophobicContact CD2-CB 4.05Å; L1189-L1217 HydrophobicContact CD2-CD1 4.2Å; N1213-L1217 WeakPolarHBondContact O-CB 3.09Å; N1213-L1217 VanDerWaalsContact O-CG 3.3Å; N1213-L1217 WeakPolarHBondContact O-CG 3.37Å; N1213-L1217 PolarHBondContact O-N 3.16Å; W1214-L1217 PolarHBondContact O-N 3.11Å; L1215-L1217 VanDerWaalsContact C-N 3.35Å; L1215-L1217 PolarHBondContact O-N 3.15Å; L1217-I1219 VanDerWaalsContact C-N 3.34Å; L1217-I1219 PolarHBondContact O-N 3.34Å; L1217-I1220 PolarHBondContact O-N 3.06Å; L1217-Q1221 WeakPolarHBondContact O-CB 3.33Å; L1217-Q1221 VanDerWaalsContact O-CG 3.26Å; L1217-Q1221 WeakPolarHBondContact O-CG 3.32Å; L1217-Q1221 PolarHBondContact O-N 3.14Å
1218	L	84.1	Confident	79.6	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-62.2	-42.4	176.1	-76.9	172	0	0	0	111.2	L1189 W1214 L1215 I1220 Q1221 L1222 F1261 F1264 L1268 F1276 F1278	L1189-L1218 HydrophobicContact CD1-CD1 4.4Å; L1189-L1218 HydrophobicContact CD1-CD2 3.82Å; L1189-L1218 HydrophobicContact CD1-CG 4.04Å; L1189-L1218 HydrophobicContact CD2-CD2 4.24Å; L1189-L1218 HydrophobicContact CD2-CG 4.08Å; W1214-L1218 VanDerWaalsContact O-CB 3.28Å; W1214-L1218 WeakPolarHBondContact O-CB 3.31Å; W1214-L1218 VanDerWaalsContact O-CG 3.24Å; W1214-L1218 WeakPolarHBondContact O-CG 3.38Å; W1214-L1218 PolarHBondContact O-N 3.28Å; L1215-L1218 PolarHBondContact O-N 3.2Å; L1218-I1220 VanDerWaalsContact C-N 3.34Å; L1218-I1220 PolarHBondContact O-N 3.05Å; L1218-Q1221 PolarHBondContact O-N 3.34Å; L1218-L1222 HydrophobicContact CB-CD1 4.46Å; L1218-L1222 WeakPolarHBondContact O-CB 3.28Å; L1218-L1222 WeakPolarHBondContact O-CG 3.4Å; L1218-L1222 PolarHBondContact O-N 3.13Å; L1218-F1261 HydrophobicContact CD1-CE2 4.41Å; L1218-F1264 HydrophobicContact CB-CD1 4.36Å; L1218-F1264 HydrophobicContact CD1-CB 4.47Å; L1218-L1268 HydrophobicContact CD2-CD1 4.33Å; L1218-L1268 HydrophobicContact CD2-CD2 4.34Å; L1218-F1276 HydrophobicContact CD2-CE1 4.43Å; L1218-F1278 HydrophobicContact CD1-CE1 4.27Å; L1218-F1278 HydrophobicContact CD1-CZ 4.23Å; L1218-F1278 HydrophobicContact CD2-CZ 4.3Å
1219	I	82.6	Confident	79.4	Confident	21.8 Å²	21.8	45.3 Å²	45.3	11%	0.112	24%	0.243	C	C	.	.	H	α-helix	trans	-58.4	-47.5	177	-75.1	164.9	0	0	0	110.8	L1215 N1216 L1217 Q1221 L1222 D1223 K1240 F1243 F1264	L1215-I1219 WeakPolarHBondContact O-CB 3.29Å; L1215-I1219 WeakPolarHBondContact O-CD1 3.39Å; L1215-I1219 VanDerWaalsContact O-CG1 3.27Å; L1215-I1219 WeakPolarHBondContact O-CG1 3.32Å; L1215-I1219 PolarHBondContact O-N 3.28Å; N1216-I1219 PolarHBondContact O-N 3.24Å; L1217-I1219 VanDerWaalsContact C-N 3.34Å; L1217-I1219 PolarHBondContact O-N 3.34Å; I1219-Q1221 PolarHBondContact O-N 2.9Å; I1219-L1222 PolarHBondContact O-N 3.15Å; I1219-D1223 WeakPolarHBondContact O-CB 3.37Å; I1219-D1223 VanDerWaalsContact O-CG 3.28Å; I1219-D1223 PolarHBondContact O-N 3.17Å; I1219-K1240 HydrophobicContact CG1-CG 4.37Å; I1219-K1240 HydrophobicContact CG2-CD 4.43Å; I1219-K1240 HydrophobicContact CG2-CG 4.21Å; I1219-F1243 HydrophobicContact CD1-CB 4.39Å; I1219-F1243 HydrophobicContact CD1-CD1 3.5Å; I1219-F1243 VanDerWaalsContact CD1-CD1 3.44Å; I1219-F1243 HydrophobicContact CD1-CE1 3.74Å; I1219-F1243 HydrophobicContact CD1-CG 4.13Å; I1219-F1243 HydrophobicContact CD1-CZ 4.46Å; I1219-F1264 HydrophobicContact CD1-CE1 4.46Å; I1219-F1264 HydrophobicContact CD1-CZ 4.06Å; I1219-F1264 HydrophobicContact CG1-CE1 3.77Å; I1219-F1264 HydrophobicContact CG1-CZ 3.66Å
1220	I	78.2	Confident	79.3	Confident	82.2 Å²	82.2	48.5 Å²	48.5	42%	0.422	26%	0.262	S	S	.	.	H	α-helix	trans	-63.8	-44.4	179.4	-65.1	164.1	0	0	0	110.9	N1216 L1217 L1218 D1223 N1224	N1216-I1220 WeakPolarHBondContact O-CD1 3.43Å; N1216-I1220 VanDerWaalsContact O-CG1 3.31Å; N1216-I1220 WeakPolarHBondContact O-CG1 3.37Å; N1216-I1220 PolarHBondContact O-N 3.43Å; N1216-I1220 VanDerWaalsContact O-N 3.12Å; L1217-I1220 PolarHBondContact O-N 3.06Å; L1218-I1220 VanDerWaalsContact C-N 3.34Å; L1218-I1220 PolarHBondContact O-N 3.05Å; I1220-D1223 PolarHBondContact O-N 2.83Å; I1220-N1224 PolarHBondContact O-N 3.4Å; I1220-N1224 PolarHBondContact O-ND2 3.06Å
1221	Q	78	Confident	79.1	Confident	32.4 Å²	32.4	54.3 Å²	54.3	15%	0.151	29%	0.292	C	S	.	.	H	α-helix	trans	-67.1	-43.9	179.6	-72.7	176.8	-0.9	0	0	112.1	L1217 L1218 I1219 D1223 N1224 I1225	L1217-Q1221 WeakPolarHBondContact O-CB 3.33Å; L1217-Q1221 VanDerWaalsContact O-CG 3.26Å; L1217-Q1221 WeakPolarHBondContact O-CG 3.32Å; L1217-Q1221 PolarHBondContact O-N 3.14Å; L1218-Q1221 PolarHBondContact O-N 3.34Å; I1219-Q1221 PolarHBondContact O-N 2.9Å; Q1221-D1223 VanDerWaalsContact C-N 3.33Å; Q1221-D1223 PolarHBondContact O-N 3.39Å; Q1221-N1224 PolarHBondContact O-N 3.07Å; Q1221-I1225 WeakPolarHBondContact O-CD1 3.18Å; Q1221-I1225 VanDerWaalsContact O-CG1 3.29Å; Q1221-I1225 WeakPolarHBondContact O-CG1 3.33Å; Q1221-I1225 PolarHBondContact O-N 3.21Å; Q1221-I1225 VanDerWaalsContact O-N 3.16Å
1222	L	81.8	Confident	78.8	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-69	-31.4	-179.3	-70.5	174.1	0	0	0	112.2	L1218 I1219 N1224 I1225 C1226 L1236 F1264 F1267 L1268 L1271 F1276	L1218-L1222 HydrophobicContact CB-CD1 4.46Å; L1218-L1222 WeakPolarHBondContact O-CB 3.28Å; L1218-L1222 WeakPolarHBondContact O-CG 3.4Å; L1218-L1222 PolarHBondContact O-N 3.13Å; I1219-L1222 PolarHBondContact O-N 3.15Å; L1222-N1224 VanDerWaalsContact C-N 3.32Å; L1222-N1224 PolarHBondContact O-N 3.22Å; L1222-I1225 PolarHBondContact O-N 3.06Å; L1222-C1226 VanDerWaalsContact O-CB 3.23Å; L1222-C1226 WeakPolarHBondContact O-CB 3.2Å; L1222-C1226 PolarHBondContact O-N 3.16Å; L1222-C1226 PolarHBondContact O-SG 3.28Å; L1222-C1226 VanDerWaalsContact O-SG 3.36Å; L1222-L1236 HydrophobicContact CB-CD1 3.9Å; L1222-L1236 HydrophobicContact CB-CD2 3.91Å; L1222-L1236 HydrophobicContact CD1-CD1 4.01Å; L1222-F1264 HydrophobicContact CD1-CD1 3.95Å; L1222-F1264 HydrophobicContact CD1-CE1 4.09Å; L1222-F1267 HydrophobicContact CD1-CD1 3.99Å; L1222-F1267 HydrophobicContact CD1-CE1 4.05Å; L1222-F1267 HydrophobicContact CD2-CD1 4.47Å; L1222-F1267 HydrophobicContact CD2-CE1 4.18Å; L1222-L1268 HydrophobicContact CD1-CD2 4.09Å; L1222-L1268 HydrophobicContact CD2-CD2 3.83Å; L1222-L1268 HydrophobicContact CG-CD2 4.41Å; L1222-L1271 HydrophobicContact CD2-CD1 3.47Å; L1222-L1271 VanDerWaalsContact CD2-CD1 3.46Å; L1222-F1276 HydrophobicContact CD2-CZ 4.35Å
1223	D	79.1	Confident	78.7	Confident	53.6 Å²	53.6	56.9 Å²	56.9	29%	0.287	30%	0.303	S	S	.	.	H	α-helix	trans	-59	-45.6	172.7	-98.6	-14.3	0	0	0	112.3	I1219 I1220 Q1221 I1225 N1227 L1236 K1240	I1219-D1223 WeakPolarHBondContact O-CB 3.37Å; I1219-D1223 VanDerWaalsContact O-CG 3.28Å; I1219-D1223 PolarHBondContact O-N 3.17Å; I1220-D1223 PolarHBondContact O-N 2.83Å; Q1221-D1223 VanDerWaalsContact C-N 3.33Å; Q1221-D1223 PolarHBondContact O-N 3.39Å; D1223-I1225 VanDerWaalsContact C-N 3.3Å; D1223-I1225 PolarHBondContact O-N 3.05Å; D1223-N1227 PolarHBondContact O-N 3.2Å; D1223-N1227 PolarHBondContact O-ND2 3.17Å; D1223-N1227 VanDerWaalsContact O-ND2 3.15Å; D1223-N1227 PolarHBondContact O-OD1 3.25Å; D1223-L1236 WeakPolarHBondContact OD1-CD2 3.49Å; D1223-K1240 VanDerWaalsContact CG-CE 3.44Å; D1223-K1240 WeakPolarHBondContact OD1-CE 3.28Å; D1223-K1240 IonicContact OD1-NZ 3.11Å; D1223-K1240 PolarHBondContact OD1-NZ 3.17Å; D1223-K1240 WeakPolarHBondContact OD2-CE 3.2Å; D1223-K1240 IonicContact OD2-NZ 3.37Å; D1223-K1240 PolarHBondContact OD2-NZ 3.21Å
1224	N	74.3	Confident	78.8	Confident	108.8 Å²	108.8	60.3 Å²	60.3	58%	0.582	32%	0.315	S	S	*	.	H	α-helix	trans	-65.7	-36.6	179.3	-67.8	-22.6	0	0	0	111.7	I1220 Q1221 L1222	I1220-N1224 PolarHBondContact O-N 3.4Å; I1220-N1224 PolarHBondContact O-ND2 3.06Å; Q1221-N1224 PolarHBondContact O-N 3.07Å; L1222-N1224 VanDerWaalsContact C-N 3.32Å; L1222-N1224 PolarHBondContact O-N 3.22Å
1225	I	76.6	Confident	78.5	Confident	50 Å²	50	63 Å²	63	26%	0.256	33%	0.33	S	S	.	.	H	α-helix	trans	-78.5	-46.4	-177.6	-66	162.7	0	0	0	111.8	Q1221 L1222 D1223 N1227 L1271 I1274	Q1221-I1225 WeakPolarHBondContact O-CD1 3.18Å; Q1221-I1225 VanDerWaalsContact O-CG1 3.29Å; Q1221-I1225 WeakPolarHBondContact O-CG1 3.33Å; Q1221-I1225 PolarHBondContact O-N 3.21Å; Q1221-I1225 VanDerWaalsContact O-N 3.16Å; L1222-I1225 PolarHBondContact O-N 3.06Å; D1223-I1225 VanDerWaalsContact C-N 3.3Å; D1223-I1225 PolarHBondContact O-N 3.05Å; I1225-N1227 VanDerWaalsContact C-N 3.27Å; I1225-N1227 PolarHBondContact O-N 3.19Å; I1225-L1271 HydrophobicContact CG2-CD1 4.46Å; I1225-L1271 HydrophobicContact CG2-CD2 4.44Å; I1225-I1274 HydrophobicContact CB-CD1 4.43Å; I1225-I1274 HydrophobicContact CD1-CD1 3.83Å; I1225-I1274 HydrophobicContact CG1-CD1 4.14Å; I1225-I1274 HydrophobicContact CG2-CD1 3.44Å; I1225-I1274 VanDerWaalsContact CG2-CD1 3.47Å
1226	C	75.3	Confident	78.3	Confident	1.8 Å²	1.8	63.2 Å²	63.2	1%	0.012	33%	0.33	C	S	.	.	H	α-helix	trans	-76.4	-7	-173.8	-66	0	0	0	0	113.2	L1222 C1228 N1229 L1232 K1233 L1236	L1222-C1226 VanDerWaalsContact O-CB 3.23Å; L1222-C1226 WeakPolarHBondContact O-CB 3.2Å; L1222-C1226 PolarHBondContact O-N 3.16Å; L1222-C1226 PolarHBondContact O-SG 3.28Å; L1222-C1226 VanDerWaalsContact O-SG 3.36Å; C1226-C1228 PolarHBondContact O-N 3.28Å; C1226-N1229 PolarHBondContact O-N 3.27Å; C1226-N1229 VanDerWaalsContact O-N 3.14Å; C1226-L1232 HydrophobicContact CB-CB 4.25Å; C1226-K1233 HydrophobicContact CB-CG 4.46Å; C1226-K1233 WeakPolarHBondContact O-CE 3.35Å; C1226-K1233 VanDerWaalsContact O-CG 3.28Å; C1226-K1233 WeakPolarHBondContact O-CG 3.22Å; C1226-L1236 HydrophobicContact CB-CD2 4.01Å
1227	N	71.1	Confident	78.3	Confident	93.2 Å²	93.2	63.4 Å²	63.4	50%	0.498	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-19	176.7	-89.6	-21.5	0	0	0	114.3	D1223 I1225 K1233	D1223-N1227 PolarHBondContact O-N 3.2Å; D1223-N1227 PolarHBondContact O-ND2 3.17Å; D1223-N1227 VanDerWaalsContact O-ND2 3.15Å; D1223-N1227 PolarHBondContact O-OD1 3.25Å; I1225-N1227 VanDerWaalsContact C-N 3.27Å; I1225-N1227 PolarHBondContact O-N 3.19Å; N1227-K1233 VanDerWaalsContact C-CE 3.42Å; N1227-K1233 WeakPolarHBondContact O-CE 3.3Å; N1227-K1233 PolarHBondContact O-NZ 2.83Å; N1227-K1233 PolarHBondContact OD1-NZ 3.4Å
1228	C	65.7	Low	78.4	Confident	122 Å²	122	65.4 Å²	65.4	82%	0.824	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-8.4	-180	-56.3	0	0	0	0	115.1	C1226	C1226-C1228 PolarHBondContact O-N 3.28Å
1229	N	76.4	Confident	78.1	Confident	77.4 Å²	77.4	66 Å²	66	41%	0.414	35%	0.347	S	S	.	.			trans	-140	112.5	-174.3	-158.7	-22.6	0	0	0	112.4	C1226 I1231 L1232 K1233	C1226-N1229 PolarHBondContact O-N 3.27Å; C1226-N1229 VanDerWaalsContact O-N 3.14Å; N1229-I1231 VanDerWaalsContact C-N 3.3Å; N1229-I1231 PolarHBondContact O-N 3.19Å; N1229-I1231 PolarHBondContact OD1-N 3.07Å; N1229-I1231 VanDerWaalsContact OD1-N 3.15Å; N1229-L1232 HydrophobicContact CB-CB 4.23Å; N1229-L1232 HydrophobicContact CB-CD1 4Å; N1229-L1232 HydrophobicContact CB-CG 4.26Å; N1229-L1232 PolarHBondContact O-N 3.02Å; N1229-L1232 VanDerWaalsContact O-N 3.16Å; N1229-K1233 WeakPolarHBondContact O-CB 3.26Å; N1229-K1233 PolarHBondContact O-N 2.98Å
1230	D	77	Confident	78.1	Confident	129.8 Å²	129.8	67.2 Å²	67.2	69%	0.694	35%	0.351	S	S	*	.	H	α-helix	trans	-61.3	-34.2	-174.1	-68.2	-32	0	0	0	114	L1232 K1233 K1234	D1230-L1232 PolarHBondContact O-N 3.32Å; D1230-K1233 PolarHBondContact O-N 3.19Å; D1230-K1233 IonicContact OD1-NZ 3.15Å; D1230-K1234 WeakPolarHBondContact O-CB 3.33Å; D1230-K1234 PolarHBondContact O-N 3.17Å
1231	I	80	Confident	78	Confident	125.8 Å²	125.8	68.3 Å²	68.3	65%	0.645	36%	0.357	S	S	*	.	H	α-helix	trans	-66.3	-45.6	178.3	-60	171.9	0	0	0	110.1	N1229 K1233 K1234 L1235	N1229-I1231 VanDerWaalsContact C-N 3.3Å; N1229-I1231 PolarHBondContact O-N 3.19Å; N1229-I1231 PolarHBondContact OD1-N 3.07Å; N1229-I1231 VanDerWaalsContact OD1-N 3.15Å; I1231-K1233 VanDerWaalsContact C-N 3.33Å; I1231-K1234 PolarHBondContact O-N 3.11Å; I1231-L1235 HydrophobicContact CG2-CD1 4.38Å; I1231-L1235 WeakPolarHBondContact O-CG 3.28Å; I1231-L1235 PolarHBondContact O-N 3.22Å; I1231-L1235 VanDerWaalsContact O-N 3.11Å
1232	L	80	Confident	77.7	Confident	27 Å²	27	68.3 Å²	68.3	14%	0.141	36%	0.361	C	S	.	.	H	α-helix	trans	-68	-37.5	178.1	-67.9	175.7	0	0	0	111.2	C1226 N1229 D1230 K1234 L1235 L1236 F1267 L1271	C1226-L1232 HydrophobicContact CB-CB 4.25Å; N1229-L1232 HydrophobicContact CB-CB 4.23Å; N1229-L1232 HydrophobicContact CB-CD1 4Å; N1229-L1232 HydrophobicContact CB-CG 4.26Å; N1229-L1232 PolarHBondContact O-N 3.02Å; N1229-L1232 VanDerWaalsContact O-N 3.16Å; D1230-L1232 PolarHBondContact O-N 3.32Å; L1232-K1234 VanDerWaalsContact C-N 3.34Å; L1232-K1234 PolarHBondContact O-N 2.81Å; L1232-L1235 PolarHBondContact O-N 2.94Å; L1232-L1236 VanDerWaalsContact O-CB 3.26Å; L1232-L1236 WeakPolarHBondContact O-CB 3.36Å; L1232-L1236 PolarHBondContact O-N 3.26Å; L1232-F1267 HydrophobicContact CB-CZ 4.43Å; L1232-F1267 HydrophobicContact CD2-CE2 4.16Å; L1232-F1267 HydrophobicContact CD2-CZ 4.16Å; L1232-L1271 HydrophobicContact CD1-CD2 3.68Å; L1232-L1271 HydrophobicContact CD2-CD2 4.43Å
1233	K	80.4	Confident	77.3	Confident	90 Å²	90	68.4 Å²	68.4	39%	0.391	36%	0.361	S	S	.	.	H	α-helix	trans	-61.2	-42.8	173.9	-132.5	176	-178.3	167.2	0	112	C1226 N1227 N1229 D1230 I1231 L1236 S1237	C1226-K1233 HydrophobicContact CB-CG 4.46Å; C1226-K1233 WeakPolarHBondContact O-CE 3.35Å; C1226-K1233 VanDerWaalsContact O-CG 3.28Å; C1226-K1233 WeakPolarHBondContact O-CG 3.22Å; N1227-K1233 VanDerWaalsContact C-CE 3.42Å; N1227-K1233 WeakPolarHBondContact O-CE 3.3Å; N1227-K1233 PolarHBondContact O-NZ 2.83Å; N1227-K1233 PolarHBondContact OD1-NZ 3.4Å; N1229-K1233 WeakPolarHBondContact O-CB 3.26Å; N1229-K1233 PolarHBondContact O-N 2.98Å; D1230-K1233 PolarHBondContact O-N 3.19Å; D1230-K1233 IonicContact OD1-NZ 3.15Å; I1231-K1233 VanDerWaalsContact C-N 3.33Å; K1233-L1236 PolarHBondContact O-N 3.21Å; K1233-S1237 WeakPolarHBondContact O-CB 3.34Å; K1233-S1237 PolarHBondContact O-N 3.13Å; K1233-S1237 PolarHBondContact O-OG 3.2Å
1234	K	81.3	Confident	76.9	Confident	141.2 Å²	141.2	69.8 Å²	69.8	61%	0.614	37%	0.369	S	S	*	.	H	α-helix	trans	-62.8	-49.6	177.1	-170.9	177.6	178.3	-179	0	111.3	D1230 I1231 L1232 L1236 S1237 E1238	D1230-K1234 WeakPolarHBondContact O-CB 3.33Å; D1230-K1234 PolarHBondContact O-N 3.17Å; I1231-K1234 PolarHBondContact O-N 3.11Å; L1232-K1234 VanDerWaalsContact C-N 3.34Å; L1232-K1234 PolarHBondContact O-N 2.81Å; K1234-L1236 VanDerWaalsContact C-N 3.33Å; K1234-L1236 PolarHBondContact O-N 3.18Å; K1234-S1237 WeakPolarHBondContact CA-OG 3.4Å; K1234-S1237 PolarHBondContact O-N 3.12Å; K1234-S1237 VanDerWaalsContact O-N 3.12Å; K1234-S1237 PolarHBondContact O-OG 3.39Å; K1234-E1238 WeakPolarHBondContact O-CG 3.46Å; K1234-E1238 PolarHBondContact O-N 3.14Å
1235	L	79.6	Confident	76.1	Confident	63.4 Å²	63.4	71.1 Å²	71.1	33%	0.332	37%	0.373	S	S	.	.	H	α-helix	trans	-60.9	-41	176.3	-71.8	172.2	0	0	0	112.4	I1231 L1232 S1237 E1238 L1239 F1267	I1231-L1235 HydrophobicContact CG2-CD1 4.38Å; I1231-L1235 WeakPolarHBondContact O-CG 3.28Å; I1231-L1235 PolarHBondContact O-N 3.22Å; I1231-L1235 VanDerWaalsContact O-N 3.11Å; L1232-L1235 PolarHBondContact O-N 2.94Å; L1235-S1237 VanDerWaalsContact C-N 3.34Å; L1235-S1237 PolarHBondContact O-N 2.81Å; L1235-E1238 WeakPolarHBondContact O-CB 3.1Å; L1235-E1238 PolarHBondContact O-N 3.06Å; L1235-L1239 WeakPolarHBondContact O-CG 3.38Å; L1235-L1239 PolarHBondContact O-N 3.17Å; L1235-L1239 VanDerWaalsContact O-N 3.1Å; L1235-F1267 HydrophobicContact CB-CD2 4.25Å; L1235-F1267 HydrophobicContact CB-CE2 3.66Å; L1235-F1267 HydrophobicContact CD1-CE2 4.34Å
1236	L	81.7	Confident	75.1	Confident	3.2 Å²	3.2	71.8 Å²	71.8	2%	0.017	38%	0.377	C	S	.	.	H	α-helix	trans	-64.6	-39.7	175.3	-177.1	64.4	0	0	0	111.4	L1222 D1223 C1226 L1232 K1233 K1234 E1238 L1239 K1240 F1264 F1267	L1222-L1236 HydrophobicContact CB-CD1 3.9Å; L1222-L1236 HydrophobicContact CB-CD2 3.91Å; L1222-L1236 HydrophobicContact CD1-CD1 4.01Å; D1223-L1236 WeakPolarHBondContact OD1-CD2 3.49Å; C1226-L1236 HydrophobicContact CB-CD2 4.01Å; L1232-L1236 VanDerWaalsContact O-CB 3.26Å; L1232-L1236 WeakPolarHBondContact O-CB 3.36Å; L1232-L1236 PolarHBondContact O-N 3.26Å; K1233-L1236 PolarHBondContact O-N 3.21Å; K1234-L1236 VanDerWaalsContact C-N 3.33Å; K1234-L1236 PolarHBondContact O-N 3.18Å; L1236-E1238 VanDerWaalsContact C-N 3.34Å; L1236-E1238 PolarHBondContact O-N 3.11Å; L1236-L1239 PolarHBondContact O-N 3.16Å; L1236-K1240 HydrophobicContact CD1-CG 4.47Å; L1236-K1240 HydrophobicContact CG-CD 4.3Å; L1236-K1240 HydrophobicContact CG-CG 4.43Å; L1236-K1240 WeakPolarHBondContact O-CB 3.35Å; L1236-K1240 VanDerWaalsContact O-CG 3.24Å; L1236-K1240 WeakPolarHBondContact O-CG 3.38Å; L1236-K1240 PolarHBondContact O-N 3.23Å; L1236-F1264 HydrophobicContact CD1-CE1 4.3Å; L1236-F1267 HydrophobicContact CB-CZ 4.17Å; L1236-F1267 HydrophobicContact CD1-CE1 4.33Å
1237	S	80.4	Confident	74	Confident	51.4 Å²	51.4	76.4 Å²	76.4	36%	0.359	40%	0.397	S	S	.	.	H	α-helix	trans	-64.2	-38	176.7	74	0	0	0	0	112.3	K1233 K1234 L1235 K1240 L1241	K1233-S1237 WeakPolarHBondContact O-CB 3.34Å; K1233-S1237 PolarHBondContact O-N 3.13Å; K1233-S1237 PolarHBondContact O-OG 3.2Å; K1234-S1237 WeakPolarHBondContact CA-OG 3.4Å; K1234-S1237 PolarHBondContact O-N 3.12Å; K1234-S1237 VanDerWaalsContact O-N 3.12Å; K1234-S1237 PolarHBondContact O-OG 3.39Å; L1235-S1237 VanDerWaalsContact C-N 3.34Å; L1235-S1237 PolarHBondContact O-N 2.81Å; S1237-K1240 PolarHBondContact O-N 3.22Å; S1237-L1241 WeakPolarHBondContact O-CB 3.36Å; S1237-L1241 VanDerWaalsContact O-CG 3.25Å; S1237-L1241 WeakPolarHBondContact O-CG 3.39Å; S1237-L1241 PolarHBondContact O-N 3.38Å
1238	E	81.5	Confident	73	Confident	98.4 Å²	98.4	79.2 Å²	79.2	46%	0.46	41%	0.41	S	S	.	.	H	α-helix	trans	-64	-43.3	173.3	-86.1	178.2	-179.8	0	0	111.5	K1234 L1235 L1236 L1241 S1242 R1263	K1234-E1238 WeakPolarHBondContact O-CG 3.46Å; K1234-E1238 PolarHBondContact O-N 3.14Å; L1235-E1238 WeakPolarHBondContact O-CB 3.1Å; L1235-E1238 PolarHBondContact O-N 3.06Å; L1236-E1238 VanDerWaalsContact C-N 3.34Å; L1236-E1238 PolarHBondContact O-N 3.11Å; E1238-L1241 PolarHBondContact O-N 3.01Å; E1238-S1242 WeakPolarHBondContact O-CB 3.24Å; E1238-S1242 PolarHBondContact O-N 3.15Å; E1238-R1263 IonicContact OE1-NH2 3.61Å
1239	L	79.5	Confident	72.1	Confident	13.6 Å²	13.6	76.5 Å²	76.5	7%	0.071	39%	0.393	C	S	.	.	H	α-helix	trans	-64.5	-42.4	175.2	-70	177.4	0	0	0	112	L1235 L1236 S1242 F1243 R1263 F1264 F1267	L1235-L1239 WeakPolarHBondContact O-CG 3.38Å; L1235-L1239 PolarHBondContact O-N 3.17Å; L1235-L1239 VanDerWaalsContact O-N 3.1Å; L1236-L1239 PolarHBondContact O-N 3.16Å; L1239-S1242 PolarHBondContact O-N 3.13Å; L1239-S1242 PolarHBondContact O-OG 3.12Å; L1239-F1243 PolarHBondContact O-N 3.11Å; L1239-R1263 HydrophobicContact CD2-CB 4.02Å; L1239-F1264 HydrophobicContact CB-CE1 4.46Å; L1239-F1264 HydrophobicContact CB-CE2 4.08Å; L1239-F1264 HydrophobicContact CB-CZ 4.02Å; L1239-F1264 HydrophobicContact CD1-CD1 4.47Å; L1239-F1264 HydrophobicContact CD1-CG 4.49Å; L1239-F1267 HydrophobicContact CD1-CB 3.73Å; L1239-F1267 HydrophobicContact CD1-CD1 4.37Å; L1239-F1267 HydrophobicContact CD1-CD2 3.93Å; L1239-F1267 HydrophobicContact CD1-CG 3.75Å
1240	K	81	Confident	70.7	Confident	46.6 Å²	46.6	77.3 Å²	77.3	20%	0.203	41%	0.405	C	S	.	.	H	α-helix	trans	-63	-43.2	175.7	-77.8	174.9	165.1	-160.9	0	112.6	I1219 D1223 L1236 S1237 S1242 F1243 N1244	I1219-K1240 HydrophobicContact CG1-CG 4.37Å; I1219-K1240 HydrophobicContact CG2-CD 4.43Å; I1219-K1240 HydrophobicContact CG2-CG 4.21Å; D1223-K1240 VanDerWaalsContact CG-CE 3.44Å; D1223-K1240 WeakPolarHBondContact OD1-CE 3.28Å; D1223-K1240 IonicContact OD1-NZ 3.11Å; D1223-K1240 PolarHBondContact OD1-NZ 3.17Å; D1223-K1240 WeakPolarHBondContact OD2-CE 3.2Å; D1223-K1240 IonicContact OD2-NZ 3.37Å; D1223-K1240 PolarHBondContact OD2-NZ 3.21Å; L1236-K1240 HydrophobicContact CD1-CG 4.47Å; L1236-K1240 HydrophobicContact CG-CD 4.3Å; L1236-K1240 HydrophobicContact CG-CG 4.43Å; L1236-K1240 WeakPolarHBondContact O-CB 3.35Å; L1236-K1240 VanDerWaalsContact O-CG 3.24Å; L1236-K1240 WeakPolarHBondContact O-CG 3.38Å; L1236-K1240 PolarHBondContact O-N 3.23Å; S1237-K1240 PolarHBondContact O-N 3.22Å; K1240-S1242 VanDerWaalsContact C-N 3.3Å; K1240-S1242 PolarHBondContact O-N 3.18Å; K1240-F1243 PolarHBondContact O-N 3.18Å; K1240-F1243 VanDerWaalsContact O-N 3.14Å; K1240-N1244 VanDerWaalsContact O-CB 3.29Å; K1240-N1244 WeakPolarHBondContact O-CB 3.31Å; K1240-N1244 PolarHBondContact O-N 2.93Å
1241	L	76.6	Confident	69.4	Low	105.6 Å²	105.6	75.6 Å²	75.6	55%	0.553	40%	0.396	S	S	*	.	H	α-helix	trans	-60.4	-44.7	175.2	-76	166.9	0	0	0	110.1	S1237 E1238 F1243 N1244 M1245	S1237-L1241 WeakPolarHBondContact O-CB 3.36Å; S1237-L1241 VanDerWaalsContact O-CG 3.25Å; S1237-L1241 WeakPolarHBondContact O-CG 3.39Å; S1237-L1241 PolarHBondContact O-N 3.38Å; E1238-L1241 PolarHBondContact O-N 3.01Å; L1241-F1243 PolarHBondContact O-N 3.22Å; L1241-N1244 PolarHBondContact O-N 3.37Å; L1241-M1245 VanDerWaalsContact O-CB 3.26Å; L1241-M1245 WeakPolarHBondContact O-CB 3.33Å; L1241-M1245 VanDerWaalsContact O-CG 3.24Å; L1241-M1245 WeakPolarHBondContact O-CG 3.4Å; L1241-M1245 PolarHBondContact O-N 3.26Å
1242	S	72.6	Confident	68.4	Low	31.2 Å²	31.2	71 Å²	71	22%	0.218	37%	0.372	C	S	.	.	H	α-helix	trans	-61.5	-31.3	176.3	77	0	0	0	0	113.4	E1238 L1239 K1240	E1238-S1242 WeakPolarHBondContact O-CB 3.24Å; E1238-S1242 PolarHBondContact O-N 3.15Å; L1239-S1242 PolarHBondContact O-N 3.13Å; L1239-S1242 PolarHBondContact O-OG 3.12Å; K1240-S1242 VanDerWaalsContact C-N 3.3Å; K1240-S1242 PolarHBondContact O-N 3.18Å
1243	F	73.8	Confident	67.9	Low	2.2 Å²	2.2	74.9 Å²	74.9	1%	0.01	39%	0.393	C	S	.	.	H	α-helix	trans	-80.8	-42.5	177.1	-176.5	-107.4	0	0	0	112.9	L1215 N1216 I1219 L1239 K1240 L1241 K1247 F1256 Y1257	L1215-F1243 HydrophobicContact CB-CE2 4.04Å; L1215-F1243 HydrophobicContact CB-CZ 4.15Å; L1215-F1243 HydrophobicContact CD1-CD2 4.33Å; L1215-F1243 HydrophobicContact CD1-CE2 3.8Å; L1215-F1243 HydrophobicContact CD1-CZ 4.47Å; L1215-F1243 HydrophobicContact CG-CE2 4.44Å; N1216-F1243 VanDerWaalsContact OD1-CE1 3.27Å; N1216-F1243 WeakPolarHBondContact OD1-CE1 3.43Å; N1216-F1243 WeakPolarHBondContact OD1-CZ 3.48Å; I1219-F1243 HydrophobicContact CD1-CB 4.39Å; I1219-F1243 HydrophobicContact CD1-CD1 3.5Å; I1219-F1243 VanDerWaalsContact CD1-CD1 3.44Å; I1219-F1243 HydrophobicContact CD1-CE1 3.74Å; I1219-F1243 HydrophobicContact CD1-CG 4.13Å; I1219-F1243 HydrophobicContact CD1-CZ 4.46Å; L1239-F1243 PolarHBondContact O-N 3.11Å; K1240-F1243 PolarHBondContact O-N 3.18Å; K1240-F1243 VanDerWaalsContact O-N 3.14Å; L1241-F1243 PolarHBondContact O-N 3.22Å; F1243-K1247 HydrophobicContact CE1-CD 4.15Å; F1243-K1247 PolarHBondContact O-N 3.49Å; F1243-F1256 HydrophobicContact CD2-CE1 4.35Å; F1243-F1256 HydrophobicContact CD2-CZ 4.48Å; F1243-F1256 HydrophobicContact CE2-CE1 4.48Å; F1243-Y1257 HydrophobicContact CE2-CD1 4.27Å; F1243-Y1257 AromaticContact CE2-CE1 3.93Å; F1243-Y1257 HydrophobicContact CE2-CE1 3.93Å; F1243-Y1257 HydrophobicContact CZ-CE1 4.45Å
1244	N	69.7	Low	67.7	Low	84 Å²	84	72.4 Å²	72.4	45%	0.449	38%	0.383	S	S	.	.	H	α-helix	trans	-78.9	-34.5	-175.3	-80.7	-12.5	0	0	0	113.6	K1240 L1241 N1246 K1247	K1240-N1244 VanDerWaalsContact O-CB 3.29Å; K1240-N1244 WeakPolarHBondContact O-CB 3.31Å; K1240-N1244 PolarHBondContact O-N 2.93Å; L1241-N1244 PolarHBondContact O-N 3.37Å; N1244-N1246 PolarHBondContact O-N 3.15Å; N1244-N1246 VanDerWaalsContact O-N 3.12Å; N1244-K1247 WeakPolarHBondContact O-CB 3.38Å; N1244-K1247 PolarHBondContact O-N 3.04Å; N1244-K1247 VanDerWaalsContact O-N 3.13Å; N1244-K1247 PolarHBondContact OD1-NZ 2.47Å; N1244-K1247 VanDerWaalsContact OD1-NZ 3.08Å
1245	M	58.7	Low	67.7	Low	135.4 Å²	135.4	71.1 Å²	71.1	67%	0.667	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-26.6	-180	-72.7	-68.8	-98.4	0	0	112.4	L1241	L1241-M1245 VanDerWaalsContact O-CB 3.26Å; L1241-M1245 WeakPolarHBondContact O-CB 3.33Å; L1241-M1245 VanDerWaalsContact O-CG 3.24Å; L1241-M1245 WeakPolarHBondContact O-CG 3.4Å; L1241-M1245 PolarHBondContact O-N 3.26Å
1246	N	54.6	Low	67.8	Low	64 Å²	64	69.7 Å²	69.7	34%	0.342	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-3.1	-179.5	-69.4	-1.8	0	0	0	114.2	N1244 I1248 S1249 I1252 F1256	N1244-N1246 PolarHBondContact O-N 3.15Å; N1244-N1246 VanDerWaalsContact O-N 3.12Å; N1246-I1248 VanDerWaalsContact C-N 3.27Å; N1246-I1248 PolarHBondContact O-N 2.85Å; N1246-I1248 VanDerWaalsContact O-N 3.16Å; N1246-S1249 PolarHBondContact O-N 3.32Å; N1246-S1249 VanDerWaalsContact O-N 3.14Å; N1246-S1249 VanDerWaalsContact O-O 3.12Å; N1246-S1249 PolarHBondContact O-OG 3.31Å; N1246-S1249 VanDerWaalsContact O-OG 3.04Å; N1246-I1252 HydrophobicContact CB-CD1 4.48Å; N1246-I1252 VanDerWaalsContact O-CD1 3.3Å; N1246-I1252 WeakPolarHBondContact O-CD1 3.46Å; N1246-F1256 HydrophobicContact CB-CE1 4.28Å; N1246-F1256 HydrophobicContact CB-CE2 4.13Å; N1246-F1256 HydrophobicContact CB-CZ 3.93Å; N1246-F1256 WeakPolarHBondContact ND2-CE2 3.35Å; N1246-F1256 WeakPolarHBondContact ND2-CZ 3.47Å
1247	K	53	Low	67.9	Low	99 Å²	99	70.1 Å²	70.1	43%	0.43	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-21.1	173.3	-115.8	-179.5	-178	175.3	0	112.7	N1216 F1243 N1244 S1249 I1252	N1216-K1247 PolarHBondContact OD1-NZ 3.24Å; F1243-K1247 HydrophobicContact CE1-CD 4.15Å; F1243-K1247 PolarHBondContact O-N 3.49Å; N1244-K1247 WeakPolarHBondContact O-CB 3.38Å; N1244-K1247 PolarHBondContact O-N 3.04Å; N1244-K1247 VanDerWaalsContact O-N 3.13Å; N1244-K1247 PolarHBondContact OD1-NZ 2.47Å; N1244-K1247 VanDerWaalsContact OD1-NZ 3.08Å; K1247-S1249 VanDerWaalsContact C-N 3.34Å; K1247-S1249 PolarHBondContact O-N 3.41Å; K1247-I1252 HydrophobicContact CG-CD1 4.28Å
1248	I	48.9	Very low	68.2	Low	152.4 Å²	152.4	68.7 Å²	68.7	78%	0.782	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-21.6	-178.9	-58.1	167.1	0	0	0	111.2	N1246 S1250	N1246-I1248 VanDerWaalsContact C-N 3.27Å; N1246-I1248 PolarHBondContact O-N 2.85Å; N1246-I1248 VanDerWaalsContact O-N 3.16Å; I1248-S1250 PolarHBondContact O-N 3.2Å
1249	S	47.8	Very low	68.4	Low	65 Å²	65	68.6 Å²	68.6	46%	0.455	36%	0.358	S	S	.	.	S	Bend	trans	-90.8	104.1	168.9	42.8	0	0	0	0	109.3	N1246 K1247 N1251 I1252	N1246-S1249 PolarHBondContact O-N 3.32Å; N1246-S1249 VanDerWaalsContact O-N 3.14Å; N1246-S1249 VanDerWaalsContact O-O 3.12Å; N1246-S1249 PolarHBondContact O-OG 3.31Å; N1246-S1249 VanDerWaalsContact O-OG 3.04Å; K1247-S1249 VanDerWaalsContact C-N 3.34Å; K1247-S1249 PolarHBondContact O-N 3.41Å; S1249-N1251 PolarHBondContact O-N 3.23Å; S1249-N1251 VanDerWaalsContact O-N 3.08Å; S1249-I1252 WeakPolarHBondContact O-CG1 3.44Å
1250	S	47	Very low	68.6	Low	95 Å²	95	68.2 Å²	68.2	66%	0.664	36%	0.357	S	S	*	.	S	Bend	trans	-64	6.7	-173.4	46.7	0	0	0	0	116.4	I1248	I1248-S1250 PolarHBondContact O-N 3.2Å
1251	N	49.3	Very low	69	Low	94 Å²	94	66 Å²	66	50%	0.503	35%	0.347	S	S	.	.			trans	-127.4	80.7	174.9	-89.7	-27.5	0	0	0	110.7	S1249 D1253 I1728	S1249-N1251 PolarHBondContact O-N 3.23Å; S1249-N1251 VanDerWaalsContact O-N 3.08Å; N1251-D1253 PolarHBondContact O-N 2.96Å; N1251-I1728 VanDerWaalsContact ND2-CD1 3.26Å; N1251-I1728 WeakPolarHBondContact ND2-CD1 3.44Å
1252	I	58	Low	69.6	Low	28.2 Å²	28.2	62.4 Å²	62.4	15%	0.145	33%	0.333	C	S	.	.			trans	-86.3	117	175.9	-62.1	168.8	0	0	0	109.2	N1208 N1246 K1247 S1249 F1256 Y1257	N1208-I1252 PolarHBondContact ND2-O 3.45Å; N1246-I1252 HydrophobicContact CB-CD1 4.48Å; N1246-I1252 VanDerWaalsContact O-CD1 3.3Å; N1246-I1252 WeakPolarHBondContact O-CD1 3.46Å; K1247-I1252 HydrophobicContact CG-CD1 4.28Å; S1249-I1252 WeakPolarHBondContact O-CG1 3.44Å; I1252-F1256 HydrophobicContact CB-CD1 4.48Å; I1252-F1256 HydrophobicContact CD1-CE1 4.42Å; I1252-F1256 HydrophobicContact CG2-CB 3.75Å; I1252-F1256 HydrophobicContact CG2-CD1 3.18Å; I1252-F1256 HydrophobicContact CG2-CD2 4.19Å; I1252-F1256 HydrophobicContact CG2-CE1 3.93Å; I1252-F1256 HydrophobicContact CG2-CG 3.69Å; I1252-F1256 VanDerWaalsContact CG2-CG 3.41Å; I1252-Y1257 HydrophobicContact CB-CD2 4.25Å; I1252-Y1257 HydrophobicContact CB-CE1 4.5Å; I1252-Y1257 HydrophobicContact CB-CE2 3.55Å; I1252-Y1257 VanDerWaalsContact CB-CE2 3.47Å; I1252-Y1257 HydrophobicContact CD1-CE1 4.23Å; I1252-Y1257 HydrophobicContact CD1-CE2 4.44Å; I1252-Y1257 VanDerWaalsContact CD1-OH 3.31Å; I1252-Y1257 WeakPolarHBondContact CD1-OH 3.35Å; I1252-Y1257 HydrophobicContact CG2-CD1 4.21Å; I1252-Y1257 HydrophobicContact CG2-CD2 3.59Å; I1252-Y1257 VanDerWaalsContact CG2-CD2 3.41Å; I1252-Y1257 HydrophobicContact CG2-CE1 4.15Å; I1252-Y1257 HydrophobicContact CG2-CE2 3.24Å; I1252-Y1257 HydrophobicContact CG2-CG 4.14Å; I1252-Y1257 VanDerWaalsContact CG2-CZ 3.42Å
1253	D	70.3	Confident	70.3	Confident	108.6 Å²	108.6	66.7 Å²	66.7	58%	0.581	34%	0.344	S	S	*	.			trans	-58.6	140.4	174.4	-122.8	-13.4	0	0	0	111.5	N1251 K1255 F1256 Y1257 V1799	N1251-D1253 PolarHBondContact O-N 2.96Å; D1253-K1255 HydrophobicContact CB-CB 4.43Å; D1253-K1255 PolarHBondContact O-N 3.05Å; D1253-K1255 VanDerWaalsContact O-N 3.1Å; D1253-K1255 PolarHBondContact OD1-N 2.89Å; D1253-F1256 VanDerWaalsContact O-CB 3.29Å; D1253-F1256 WeakPolarHBondContact O-CB 3.36Å; D1253-F1256 PolarHBondContact O-N 3.27Å; D1253-Y1257 PolarHBondContact O-N 3.24Å; D1253-V1799 WeakPolarHBondContact OD2-CG1 3.47Å
1254	L	77	Confident	71.1	Confident	37.8 Å²	37.8	66.6 Å²	66.6	20%	0.198	34%	0.344	C	S	.	.	H	α-helix	trans	-49.1	-37.6	173.3	176	69.6	0	0	0	111.5	L1207 N1208 L1211 F1256 Y1257 I1258 P1288	L1207-L1254 HydrophobicContact CB-CD1 4.24Å; L1207-L1254 HydrophobicContact CD2-CD1 3.95Å; L1207-L1254 HydrophobicContact CD2-CD2 4.39Å; L1207-L1254 HydrophobicContact CG-CD1 3.96Å; N1208-L1254 HydrophobicContact CB-CD1 4.17Å; N1208-L1254 WeakPolarHBondContact OD1-CA 3.03Å; N1208-L1254 WeakPolarHBondContact OD1-CB 3.41Å; N1208-L1254 WeakPolarHBondContact OD1-CD1 3.49Å; N1208-L1254 WeakPolarHBondContact OD1-CG 3.48Å; L1211-L1254 HydrophobicContact CD1-CD1 4.19Å; L1254-F1256 VanDerWaalsContact C-N 3.29Å; L1254-F1256 PolarHBondContact O-N 2.99Å; L1254-Y1257 PolarHBondContact O-N 3Å; L1254-I1258 HydrophobicContact CD1-CD1 4.23Å; L1254-I1258 HydrophobicContact CD1-CG1 4.29Å; L1254-I1258 HydrophobicContact CD2-CD1 4.29Å; L1254-I1258 HydrophobicContact CG-CD1 3.9Å; L1254-I1258 HydrophobicContact CG-CG1 4.39Å; L1254-I1258 VanDerWaalsContact O-CG1 3.29Å; L1254-I1258 WeakPolarHBondContact O-CG1 3.38Å; L1254-I1258 PolarHBondContact O-N 3.04Å; L1254-P1288 HydrophobicContact CD1-CG 4.46Å; L1254-P1288 HydrophobicContact CD2-CG 3.61Å; L1254-P1288 VanDerWaalsContact CD2-CG 3.45Å
1255	K	79.9	Confident	72.1	Confident	115 Å²	115	62.6 Å²	62.6	50%	0.5	32%	0.322	S	S	.	.	H	α-helix	trans	-58.7	-37.2	177.9	-168.3	175.9	-177.9	179.2	0	112.7	D1253 I1258 Q1259 S1843	D1253-K1255 HydrophobicContact CB-CB 4.43Å; D1253-K1255 PolarHBondContact O-N 3.05Å; D1253-K1255 VanDerWaalsContact O-N 3.1Å; D1253-K1255 PolarHBondContact OD1-N 2.89Å; K1255-I1258 PolarHBondContact O-N 2.99Å; K1255-Q1259 WeakPolarHBondContact O-CG 3.25Å; K1255-Q1259 PolarHBondContact O-N 3.01Å; K1255-Q1259 VanDerWaalsContact O-N 3.08Å; K1255-S1843 VanDerWaalsContact NZ-CB 3.33Å; K1255-S1843 PolarHBondContact NZ-OG 3.45Å
1256	F	81.7	Confident	73.4	Confident	32.6 Å²	32.6	60.5 Å²	60.5	14%	0.143	31%	0.314	C	S	.	.	H	α-helix	trans	-65.7	-48.9	175.7	172.3	-88.4	0	0	0	110.9	F1243 N1246 I1252 D1253 L1254 I1258 Q1259 C1260 L1802	F1243-F1256 HydrophobicContact CD2-CE1 4.35Å; F1243-F1256 HydrophobicContact CD2-CZ 4.48Å; F1243-F1256 HydrophobicContact CE2-CE1 4.48Å; N1246-F1256 HydrophobicContact CB-CE1 4.28Å; N1246-F1256 HydrophobicContact CB-CE2 4.13Å; N1246-F1256 HydrophobicContact CB-CZ 3.93Å; N1246-F1256 WeakPolarHBondContact ND2-CE2 3.35Å; N1246-F1256 WeakPolarHBondContact ND2-CZ 3.47Å; I1252-F1256 HydrophobicContact CB-CD1 4.48Å; I1252-F1256 HydrophobicContact CD1-CE1 4.42Å; I1252-F1256 HydrophobicContact CG2-CB 3.75Å; I1252-F1256 HydrophobicContact CG2-CD1 3.18Å; I1252-F1256 HydrophobicContact CG2-CD2 4.19Å; I1252-F1256 HydrophobicContact CG2-CE1 3.93Å; I1252-F1256 HydrophobicContact CG2-CG 3.69Å; I1252-F1256 VanDerWaalsContact CG2-CG 3.41Å; D1253-F1256 VanDerWaalsContact O-CB 3.29Å; D1253-F1256 WeakPolarHBondContact O-CB 3.36Å; D1253-F1256 PolarHBondContact O-N 3.27Å; L1254-F1256 VanDerWaalsContact C-N 3.29Å; L1254-F1256 PolarHBondContact O-N 2.99Å; F1256-I1258 VanDerWaalsContact C-N 3.27Å; F1256-I1258 PolarHBondContact O-N 3.22Å; F1256-Q1259 PolarHBondContact O-N 2.98Å; F1256-Q1259 VanDerWaalsContact O-N 3.12Å; F1256-C1260 WeakPolarHBondContact CE1-SG 3.29Å; F1256-C1260 VanDerWaalsContact CE2-SG 3.53Å; F1256-C1260 VanDerWaalsContact CZ-SG 3.54Å; F1256-C1260 WeakPolarHBondContact CZ-SG 3.34Å; F1256-C1260 WeakPolarHBondContact O-CB 3.45Å; F1256-C1260 PolarHBondContact O-N 3.21Å; F1256-C1260 PolarHBondContact O-SG 3.47Å; F1256-L1802 VanDerWaalsContact CA-CD1 3.48Å; F1256-L1802 HydrophobicContact CB-CD1 3.56Å; F1256-L1802 HydrophobicContact CD2-CB 4.44Å; F1256-L1802 HydrophobicContact CD2-CD1 2.98Å; F1256-L1802 HydrophobicContact CD2-CD2 3.94Å; F1256-L1802 HydrophobicContact CD2-CG 3.2Å; F1256-L1802 HydrophobicContact CE2-CD1 3.7Å; F1256-L1802 HydrophobicContact CE2-CD2 3.76Å; F1256-L1802 HydrophobicContact CE2-CG 3.33Å; F1256-L1802 HydrophobicContact CG-CD1 3.44Å; F1256-L1802 VanDerWaalsContact CG-CD1 3.44Å; F1256-L1802 HydrophobicContact CG-CG 4.07Å; F1256-L1802 HydrophobicContact CZ-CD2 4.35Å; F1256-L1802 HydrophobicContact CZ-CG 4.35Å
1257	Y	83.7	Confident	75	Confident	12.2 Å²	12.2	57.8 Å²	57.8	5%	0.048	30%	0.299	C	S	.	.	H	α-helix	trans	-62.1	-36.2	178.9	-72.3	-65.1	0	0	0	112.2	N1208 Q1212 L1215 F1243 I1252 D1253 L1254 C1260 F1261	N1208-Y1257 HydrophobicContact CB-CD2 4.41Å; N1208-Y1257 WeakPolarHBondContact OD1-CD2 3.41Å; N1208-Y1257 WeakPolarHBondContact OD1-CE2 3.43Å; Q1212-Y1257 HydrophobicContact CB-CD1 4.44Å; Q1212-Y1257 HydrophobicContact CB-CE1 3.97Å; Q1212-Y1257 VanDerWaalsContact CD-OH 3.24Å; Q1212-Y1257 HydrophobicContact CG-CE1 4.05Å; Q1212-Y1257 WeakPolarHBondContact CG-OH 3.14Å; Q1212-Y1257 PolarHBondContact NE2-OH 3.21Å; L1215-Y1257 HydrophobicContact CD1-CD1 3.87Å; F1243-Y1257 HydrophobicContact CE2-CD1 4.27Å; F1243-Y1257 AromaticContact CE2-CE1 3.93Å; F1243-Y1257 HydrophobicContact CE2-CE1 3.93Å; F1243-Y1257 HydrophobicContact CZ-CE1 4.45Å; I1252-Y1257 HydrophobicContact CB-CD2 4.25Å; I1252-Y1257 HydrophobicContact CB-CE1 4.5Å; I1252-Y1257 HydrophobicContact CB-CE2 3.55Å; I1252-Y1257 VanDerWaalsContact CB-CE2 3.47Å; I1252-Y1257 HydrophobicContact CD1-CE1 4.23Å; I1252-Y1257 HydrophobicContact CD1-CE2 4.44Å; I1252-Y1257 VanDerWaalsContact CD1-OH 3.31Å; I1252-Y1257 WeakPolarHBondContact CD1-OH 3.35Å; I1252-Y1257 HydrophobicContact CG2-CD1 4.21Å; I1252-Y1257 HydrophobicContact CG2-CD2 3.59Å; I1252-Y1257 VanDerWaalsContact CG2-CD2 3.41Å; I1252-Y1257 HydrophobicContact CG2-CE1 4.15Å; I1252-Y1257 HydrophobicContact CG2-CE2 3.24Å; I1252-Y1257 HydrophobicContact CG2-CG 4.14Å; I1252-Y1257 VanDerWaalsContact CG2-CZ 3.42Å; D1253-Y1257 PolarHBondContact O-N 3.24Å; L1254-Y1257 PolarHBondContact O-N 3Å; Y1257-C1260 PolarHBondContact O-N 2.97Å; Y1257-F1261 WeakPolarHBondContact O-CB 3.38Å; Y1257-F1261 PolarHBondContact O-N 3.18Å
1258	I	86.9	Confident	76.7	Confident	22.6 Å²	22.6	53.1 Å²	53.1	12%	0.116	28%	0.279	C	S	.	.	H	α-helix	trans	-60	-48.4	172.5	-71.3	173.9	0	0	0	111.2	L1211 L1254 K1255 F1256 F1261 A1262 E1292 W1293	L1211-I1258 HydrophobicContact CD1-CG1 3.97Å; L1254-I1258 HydrophobicContact CD1-CD1 4.23Å; L1254-I1258 HydrophobicContact CD1-CG1 4.29Å; L1254-I1258 HydrophobicContact CD2-CD1 4.29Å; L1254-I1258 HydrophobicContact CG-CD1 3.9Å; L1254-I1258 HydrophobicContact CG-CG1 4.39Å; L1254-I1258 VanDerWaalsContact O-CG1 3.29Å; L1254-I1258 WeakPolarHBondContact O-CG1 3.38Å; L1254-I1258 PolarHBondContact O-N 3.04Å; K1255-I1258 PolarHBondContact O-N 2.99Å; F1256-I1258 VanDerWaalsContact C-N 3.27Å; F1256-I1258 PolarHBondContact O-N 3.22Å; I1258-F1261 PolarHBondContact O-N 3Å; I1258-A1262 WeakPolarHBondContact O-CB 3.35Å; I1258-A1262 PolarHBondContact O-N 3.18Å; I1258-E1292 HydrophobicContact CD1-CB 4.36Å; I1258-W1293 HydrophobicContact CD1-CB 4.18Å; I1258-W1293 HydrophobicContact CG1-CB 3.75Å
1259	Q	85.3	Confident	78.4	Confident	96.4 Å²	96.4	46.8 Å²	46.8	45%	0.45	25%	0.251	S	S	.	.	H	α-helix	trans	-65.4	-44.3	179.5	-72.8	177.1	-3.2	0	0	112.2	K1255 F1256 F1261 A1262 R1263	K1255-Q1259 WeakPolarHBondContact O-CG 3.25Å; K1255-Q1259 PolarHBondContact O-N 3.01Å; K1255-Q1259 VanDerWaalsContact O-N 3.08Å; F1256-Q1259 PolarHBondContact O-N 2.98Å; F1256-Q1259 VanDerWaalsContact O-N 3.12Å; Q1259-F1261 VanDerWaalsContact C-N 3.35Å; Q1259-A1262 PolarHBondContact O-N 3.05Å; Q1259-R1263 WeakPolarHBondContact O-CG 3.35Å; Q1259-R1263 PolarHBondContact O-N 3.27Å; Q1259-R1263 VanDerWaalsContact O-N 3.07Å
1260	C	85.4	Confident	80.1	Confident	5.2 Å²	5.2	51.3 Å²	51.3	4%	0.035	26%	0.259	C	S	.	.	H	α-helix	trans	-59.1	-49.6	174	-75.9	0	0	0	0	110.7	L1215 F1256 Y1257 A1262 R1263 F1264	L1215-C1260 HydrophobicContact CD1-CB 4.02Å; L1215-C1260 HydrophobicContact CD2-CB 4.34Å; F1256-C1260 WeakPolarHBondContact CE1-SG 3.29Å; F1256-C1260 VanDerWaalsContact CE2-SG 3.53Å; F1256-C1260 VanDerWaalsContact CZ-SG 3.54Å; F1256-C1260 WeakPolarHBondContact CZ-SG 3.34Å; F1256-C1260 WeakPolarHBondContact O-CB 3.45Å; F1256-C1260 PolarHBondContact O-N 3.21Å; F1256-C1260 PolarHBondContact O-SG 3.47Å; Y1257-C1260 PolarHBondContact O-N 2.97Å; C1260-A1262 VanDerWaalsContact C-N 3.33Å; C1260-A1262 PolarHBondContact O-N 3.03Å; C1260-R1263 WeakPolarHBondContact O-CB 3.23Å; C1260-R1263 PolarHBondContact O-N 3.22Å; C1260-R1263 VanDerWaalsContact O-N 3.12Å; C1260-F1264 WeakPolarHBondContact O-CD2 3.38Å; C1260-F1264 PolarHBondContact O-N 2.94Å
1261	F	89.7	Confident	81.9	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-57.5	-45.5	178.6	-172.5	-106.5	0	0	0	111.8	L1211 W1214 L1215 L1218 Y1257 I1258 Q1259 R1263 F1264 I1265 F1278 W1293 F1304	L1211-F1261 HydrophobicContact CD2-CB 4.14Å; L1211-F1261 HydrophobicContact CD2-CD1 3.98Å; L1211-F1261 HydrophobicContact CD2-CD2 3.97Å; L1211-F1261 HydrophobicContact CD2-CE1 4.37Å; L1211-F1261 HydrophobicContact CD2-CE2 4.38Å; L1211-F1261 HydrophobicContact CD2-CG 3.76Å; W1214-F1261 HydrophobicContact CB-CE2 4.45Å; W1214-F1261 AromaticContact CE3-CE2 3.72Å; W1214-F1261 HydrophobicContact CE3-CE2 3.72Å; W1214-F1261 AromaticContact CE3-CZ 3.74Å; W1214-F1261 HydrophobicContact CE3-CZ 3.74Å; W1214-F1261 HydrophobicContact CZ3-CE2 4.4Å; W1214-F1261 AromaticContact CZ3-CZ 3.95Å; W1214-F1261 HydrophobicContact CZ3-CZ 3.95Å; L1215-F1261 HydrophobicContact CD2-CB 4.5Å; L1215-F1261 HydrophobicContact CD2-CD2 4.36Å; L1215-F1261 HydrophobicContact CG-CD2 4.43Å; L1218-F1261 HydrophobicContact CD1-CE2 4.41Å; Y1257-F1261 WeakPolarHBondContact O-CB 3.38Å; Y1257-F1261 PolarHBondContact O-N 3.18Å; I1258-F1261 PolarHBondContact O-N 3Å; Q1259-F1261 VanDerWaalsContact C-N 3.35Å; F1261-R1263 VanDerWaalsContact C-N 3.34Å; F1261-R1263 PolarHBondContact O-N 3.12Å; F1261-F1264 PolarHBondContact O-N 3.21Å; F1261-I1265 HydrophobicContact CD1-CG1 4.06Å; F1261-I1265 HydrophobicContact CE1-CD1 4.06Å; F1261-I1265 HydrophobicContact CE1-CG1 3.73Å; F1261-I1265 HydrophobicContact CE2-CD1 4.15Å; F1261-I1265 HydrophobicContact CE2-CG1 4.34Å; F1261-I1265 HydrophobicContact CG-CG1 4.48Å; F1261-I1265 HydrophobicContact CZ-CD1 3.72Å; F1261-I1265 HydrophobicContact CZ-CG1 3.88Å; F1261-I1265 WeakPolarHBondContact O-CG1 3.34Å; F1261-I1265 PolarHBondContact O-N 3.17Å; F1261-F1278 HydrophobicContact CE2-CD1 4.5Å; F1261-F1278 AromaticContact CE2-CE1 3.87Å; F1261-F1278 HydrophobicContact CE2-CE1 4.06Å; F1261-F1278 HydrophobicContact CE2-CZ 4.5Å; F1261-F1278 HydrophobicContact CZ-CD1 4.29Å; F1261-F1278 AromaticContact CZ-CE1 3.86Å; F1261-F1278 HydrophobicContact CZ-CE1 4.04Å; F1261-F1278 HydrophobicContact CZ-CZ 4.43Å; F1261-W1293 HydrophobicContact CD1-CE3 4.32Å; F1261-W1293 AromaticContact CE1-CE3 3.89Å; F1261-W1293 HydrophobicContact CE1-CE3 3.89Å; F1261-W1293 AromaticContact CE1-CZ3 3.89Å; F1261-W1293 HydrophobicContact CE1-CZ3 4.03Å; F1261-W1293 HydrophobicContact CZ-CZ3 4.36Å; F1261-F1304 HydrophobicContact CE1-CZ 4.12Å; F1261-F1304 HydrophobicContact CZ-CE1 4.47Å; F1261-F1304 HydrophobicContact CZ-CZ 4.08Å
1262	A	88.6	Confident	83.1	Confident	30.2 Å²	30.2	46.9 Å²	46.9	25%	0.25	23%	0.228	C	C	.	.	H	α-helix	trans	-59.6	-41.1	175.8	0	0	0	0	0	112.9	I1258 Q1259 C1260 I1265 N1266 P1295	I1258-A1262 WeakPolarHBondContact O-CB 3.35Å; I1258-A1262 PolarHBondContact O-N 3.18Å; Q1259-A1262 PolarHBondContact O-N 3.05Å; C1260-A1262 VanDerWaalsContact C-N 3.33Å; C1260-A1262 PolarHBondContact O-N 3.03Å; A1262-I1265 PolarHBondContact O-N 3.14Å; A1262-N1266 PolarHBondContact O-N 3.1Å; A1262-N1266 PolarHBondContact O-ND2 3.23Å; A1262-P1295 HydrophobicContact CB-CG 4.4Å
1263	R	87.6	Confident	84.2	Confident	120.4 Å²	120.4	53.1 Å²	53.1	45%	0.454	26%	0.262	S	S	.	.	H	α-helix	trans	-64.4	-42.5	175	-70.7	177.7	71.6	171.1	2.5	112	E1238 L1239 Q1259 C1260 F1261 N1266 F1267	E1238-R1263 IonicContact OE1-NH2 3.61Å; L1239-R1263 HydrophobicContact CD2-CB 4.02Å; Q1259-R1263 WeakPolarHBondContact O-CG 3.35Å; Q1259-R1263 PolarHBondContact O-N 3.27Å; Q1259-R1263 VanDerWaalsContact O-N 3.07Å; C1260-R1263 WeakPolarHBondContact O-CB 3.23Å; C1260-R1263 PolarHBondContact O-N 3.22Å; C1260-R1263 VanDerWaalsContact O-N 3.12Å; F1261-R1263 VanDerWaalsContact C-N 3.34Å; F1261-R1263 PolarHBondContact O-N 3.12Å; R1263-N1266 PolarHBondContact O-N 3.06Å; R1263-F1267 WeakPolarHBondContact O-CB 3.37Å; R1263-F1267 PolarHBondContact O-N 3.07Å
1264	F	89.5	Confident	85	Confident	0.8 Å²	0.8	50 Å²	50	0%	0.004	24%	0.244	C	C	.	.	H	α-helix	trans	-63.6	-45	175.6	-90.9	-94.1	0	0	0	111.5	L1215 L1218 I1219 L1222 L1236 L1239 C1260 F1261 N1266 F1267 L1268	L1215-F1264 HydrophobicContact CD2-CB 4.09Å; L1215-F1264 HydrophobicContact CD2-CD1 4.44Å; L1215-F1264 HydrophobicContact CD2-CD2 3.45Å; L1215-F1264 VanDerWaalsContact CD2-CD2 3.44Å; L1215-F1264 HydrophobicContact CD2-CE2 3.94Å; L1215-F1264 HydrophobicContact CD2-CG 3.74Å; L1218-F1264 HydrophobicContact CB-CD1 4.36Å; L1218-F1264 HydrophobicContact CD1-CB 4.47Å; I1219-F1264 HydrophobicContact CD1-CE1 4.46Å; I1219-F1264 HydrophobicContact CD1-CZ 4.06Å; I1219-F1264 HydrophobicContact CG1-CE1 3.77Å; I1219-F1264 HydrophobicContact CG1-CZ 3.66Å; L1222-F1264 HydrophobicContact CD1-CD1 3.95Å; L1222-F1264 HydrophobicContact CD1-CE1 4.09Å; L1236-F1264 HydrophobicContact CD1-CE1 4.3Å; L1239-F1264 HydrophobicContact CB-CE1 4.46Å; L1239-F1264 HydrophobicContact CB-CE2 4.08Å; L1239-F1264 HydrophobicContact CB-CZ 4.02Å; L1239-F1264 HydrophobicContact CD1-CD1 4.47Å; L1239-F1264 HydrophobicContact CD1-CG 4.49Å; C1260-F1264 WeakPolarHBondContact O-CD2 3.38Å; C1260-F1264 PolarHBondContact O-N 2.94Å; F1261-F1264 PolarHBondContact O-N 3.21Å; F1264-N1266 VanDerWaalsContact C-N 3.33Å; F1264-N1266 PolarHBondContact O-N 3.21Å; F1264-F1267 WeakPolarHBondContact O-CA 3.24Å; F1264-F1267 WeakPolarHBondContact O-CB 3.24Å; F1264-F1267 PolarHBondContact O-N 3.29Å; F1264-F1267 VanDerWaalsContact O-N 3.09Å; F1264-L1268 WeakPolarHBondContact O-CG 3.35Å; F1264-L1268 PolarHBondContact O-N 3.03Å
1265	I	90.2	Very high	85.6	Confident	0 Å²	0	50 Å²	50	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-58.4	-45.4	175.4	-66.8	-58.3	0	0	0	110.9	F1261 A1262 F1267 L1268 G1269 F1278 P1295 L1298 P1299 V1302 F1304	F1261-I1265 HydrophobicContact CD1-CG1 4.06Å; F1261-I1265 HydrophobicContact CE1-CD1 4.06Å; F1261-I1265 HydrophobicContact CE1-CG1 3.73Å; F1261-I1265 HydrophobicContact CE2-CD1 4.15Å; F1261-I1265 HydrophobicContact CE2-CG1 4.34Å; F1261-I1265 HydrophobicContact CG-CG1 4.48Å; F1261-I1265 HydrophobicContact CZ-CD1 3.72Å; F1261-I1265 HydrophobicContact CZ-CG1 3.88Å; F1261-I1265 WeakPolarHBondContact O-CG1 3.34Å; F1261-I1265 PolarHBondContact O-N 3.17Å; A1262-I1265 PolarHBondContact O-N 3.14Å; I1265-F1267 VanDerWaalsContact C-N 3.29Å; I1265-F1267 PolarHBondContact O-N 3.11Å; I1265-L1268 HydrophobicContact CD1-CD1 4.07Å; I1265-L1268 WeakPolarHBondContact O-CB 3.36Å; I1265-L1268 PolarHBondContact O-N 3.31Å; I1265-L1268 VanDerWaalsContact O-N 3.17Å; I1265-G1269 PolarHBondContact O-N 3.33Å; I1265-F1278 HydrophobicContact CD1-CD2 4.42Å; I1265-F1278 HydrophobicContact CD1-CE1 4.24Å; I1265-F1278 HydrophobicContact CD1-CE2 3.62Å; I1265-F1278 HydrophobicContact CD1-CZ 3.5Å; I1265-F1278 VanDerWaalsContact CD1-CZ 3.46Å; I1265-P1295 HydrophobicContact CB-CG 4.3Å; I1265-P1295 HydrophobicContact CG1-CG 4.43Å; I1265-P1295 HydrophobicContact CG2-CG 4.14Å; I1265-L1298 HydrophobicContact CG2-CD2 4.25Å; I1265-P1299 HydrophobicContact CG2-CG 4.28Å; I1265-P1299 WeakPolarHBondContact O-CG 3.45Å; I1265-V1302 HydrophobicContact CD1-CG1 4.4Å; I1265-V1302 HydrophobicContact CG2-CG1 4.36Å; I1265-F1304 HydrophobicContact CD1-CZ 4.36Å
1266	N	87.6	Confident	86.1	Confident	91.6 Å²	91.6	44.5 Å²	44.5	49%	0.49	22%	0.22	S	C	.	.	H	α-helix	trans	-61.5	-38.1	175.3	-73.6	-20.5	0	0	0	112.3	A1262 R1263 F1264 L1268 G1269	A1262-N1266 PolarHBondContact O-N 3.1Å; A1262-N1266 PolarHBondContact O-ND2 3.23Å; R1263-N1266 PolarHBondContact O-N 3.06Å; F1264-N1266 VanDerWaalsContact C-N 3.33Å; F1264-N1266 PolarHBondContact O-N 3.21Å; N1266-L1268 VanDerWaalsContact C-N 3.33Å; N1266-L1268 PolarHBondContact O-N 3.07Å; N1266-G1269 PolarHBondContact O-N 3.19Å; N1266-G1269 VanDerWaalsContact O-N 3.1Å
1267	F	87.7	Confident	86.5	Confident	7.8 Å²	7.8	43 Å²	43	3%	0.034	21%	0.213	C	C	.	.	H	α-helix	trans	-62.2	-39.1	175.3	179	-97.9	0	0	0	112.5	L1222 L1232 L1235 L1236 L1239 R1263 F1264 I1265 G1269 Y1270 L1271	L1222-F1267 HydrophobicContact CD1-CD1 3.99Å; L1222-F1267 HydrophobicContact CD1-CE1 4.05Å; L1222-F1267 HydrophobicContact CD2-CD1 4.47Å; L1222-F1267 HydrophobicContact CD2-CE1 4.18Å; L1232-F1267 HydrophobicContact CB-CZ 4.43Å; L1232-F1267 HydrophobicContact CD2-CE2 4.16Å; L1232-F1267 HydrophobicContact CD2-CZ 4.16Å; L1235-F1267 HydrophobicContact CB-CD2 4.25Å; L1235-F1267 HydrophobicContact CB-CE2 3.66Å; L1235-F1267 HydrophobicContact CD1-CE2 4.34Å; L1236-F1267 HydrophobicContact CB-CZ 4.17Å; L1236-F1267 HydrophobicContact CD1-CE1 4.33Å; L1239-F1267 HydrophobicContact CD1-CB 3.73Å; L1239-F1267 HydrophobicContact CD1-CD1 4.37Å; L1239-F1267 HydrophobicContact CD1-CD2 3.93Å; L1239-F1267 HydrophobicContact CD1-CG 3.75Å; R1263-F1267 WeakPolarHBondContact O-CB 3.37Å; R1263-F1267 PolarHBondContact O-N 3.07Å; F1264-F1267 WeakPolarHBondContact O-CA 3.24Å; F1264-F1267 WeakPolarHBondContact O-CB 3.24Å; F1264-F1267 PolarHBondContact O-N 3.29Å; F1264-F1267 VanDerWaalsContact O-N 3.09Å; I1265-F1267 VanDerWaalsContact C-N 3.29Å; I1265-F1267 PolarHBondContact O-N 3.11Å; F1267-G1269 PolarHBondContact O-N 3.16Å; F1267-G1269 VanDerWaalsContact O-N 3.13Å; F1267-Y1270 HydrophobicContact CD2-CD2 4.29Å; F1267-Y1270 WeakPolarHBondContact O-CD2 3.4Å; F1267-Y1270 PolarHBondContact O-N 2.92Å; F1267-Y1270 VanDerWaalsContact O-N 3.07Å; F1267-L1271 HydrophobicContact CE1-CD1 4.46Å
1268	L	88	Confident	87	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-57.4	-28.8	174.4	-59.6	-176.9	0	0	0	112	L1218 L1222 F1264 I1265 N1266 Y1270 L1271 F1276 F1278 N1301 V1302	L1218-L1268 HydrophobicContact CD2-CD1 4.33Å; L1218-L1268 HydrophobicContact CD2-CD2 4.34Å; L1222-L1268 HydrophobicContact CD1-CD2 4.09Å; L1222-L1268 HydrophobicContact CD2-CD2 3.83Å; L1222-L1268 HydrophobicContact CG-CD2 4.41Å; F1264-L1268 WeakPolarHBondContact O-CG 3.35Å; F1264-L1268 PolarHBondContact O-N 3.03Å; I1265-L1268 HydrophobicContact CD1-CD1 4.07Å; I1265-L1268 WeakPolarHBondContact O-CB 3.36Å; I1265-L1268 PolarHBondContact O-N 3.31Å; I1265-L1268 VanDerWaalsContact O-N 3.17Å; N1266-L1268 VanDerWaalsContact C-N 3.33Å; N1266-L1268 PolarHBondContact O-N 3.07Å; L1268-Y1270 PolarHBondContact O-N 3.22Å; L1268-Y1270 VanDerWaalsContact O-N 3.16Å; L1268-L1271 HydrophobicContact CD2-CD1 4.28Å; L1268-L1271 WeakPolarHBondContact O-CB 3.3Å; L1268-L1271 PolarHBondContact O-N 3.04Å; L1268-F1276 HydrophobicContact CB-CD2 4.18Å; L1268-F1276 HydrophobicContact CB-CE2 4.23Å; L1268-F1276 HydrophobicContact CD1-CB 4.28Å; L1268-F1276 HydrophobicContact CD1-CD1 3.98Å; L1268-F1276 HydrophobicContact CD1-CD2 4.11Å; L1268-F1276 HydrophobicContact CD1-CE1 4.36Å; L1268-F1276 HydrophobicContact CD1-CE2 4.46Å; L1268-F1276 HydrophobicContact CD1-CG 3.85Å; L1268-F1276 HydrophobicContact CD2-CD1 4.37Å; L1268-F1276 HydrophobicContact CD2-CD2 4.34Å; L1268-F1276 HydrophobicContact CD2-CE1 3.92Å; L1268-F1276 HydrophobicContact CD2-CE2 3.89Å; L1268-F1276 HydrophobicContact CD2-CZ 3.66Å; L1268-F1276 HydrophobicContact CG-CD2 4.43Å; L1268-F1276 HydrophobicContact CG-CE2 4.41Å; L1268-F1278 HydrophobicContact CD1-CE2 4Å; L1268-F1278 HydrophobicContact CD1-CZ 3.9Å; L1268-N1301 PolarHBondContact O-ND2 3.07Å; L1268-N1301 PolarHBondContact O-OD1 3Å; L1268-V1302 HydrophobicContact CB-CG2 3.91Å; L1268-V1302 HydrophobicContact CD1-CG2 4.16Å
1269	G	85	Confident	87.3	Confident	19.4 Å²	19.4	41.3 Å²	41.3	20%	0.2	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-22.5	176.4	0	0	0	0	0	115.2	I1265 N1266 F1267 L1271 N1272 P1299 N1301	I1265-G1269 PolarHBondContact O-N 3.33Å; N1266-G1269 PolarHBondContact O-N 3.19Å; N1266-G1269 VanDerWaalsContact O-N 3.1Å; F1267-G1269 PolarHBondContact O-N 3.16Å; F1267-G1269 VanDerWaalsContact O-N 3.13Å; G1269-L1271 VanDerWaalsContact C-N 3.32Å; G1269-N1272 PolarHBondContact O-OD1 3.25Å; G1269-P1299 VanDerWaalsContact CA-CB 3.46Å; G1269-N1301 WeakPolarHBondContact CA-OD1 3.28Å
1270	Y	84.6	Confident	87.6	Confident	159.6 Å²	159.6	36.8 Å²	36.8	63%	0.626	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-18.9	173.9	-62.6	-72.7	0	0	0	112.7	F1267 L1268 N1272	F1267-Y1270 HydrophobicContact CD2-CD2 4.29Å; F1267-Y1270 WeakPolarHBondContact O-CD2 3.4Å; F1267-Y1270 PolarHBondContact O-N 2.92Å; F1267-Y1270 VanDerWaalsContact O-N 3.07Å; L1268-Y1270 PolarHBondContact O-N 3.22Å; L1268-Y1270 VanDerWaalsContact O-N 3.16Å; Y1270-N1272 VanDerWaalsContact C-N 3.33Å; Y1270-N1272 PolarHBondContact O-N 3.23Å; Y1270-N1272 VanDerWaalsContact O-N 3.13Å
1271	L	83.6	Confident	87.8	Confident	12.6 Å²	12.6	36.7 Å²	36.7	7%	0.066	18%	0.183	C	C	.	.			trans	-88.6	68.5	-178.7	-59.1	176.4	0	0	0	111.4	L1222 I1225 L1232 F1267 L1268 G1269 D1273 I1274 F1276 N1301	L1222-L1271 HydrophobicContact CD2-CD1 3.47Å; L1222-L1271 VanDerWaalsContact CD2-CD1 3.46Å; I1225-L1271 HydrophobicContact CG2-CD1 4.46Å; I1225-L1271 HydrophobicContact CG2-CD2 4.44Å; L1232-L1271 HydrophobicContact CD1-CD2 3.68Å; L1232-L1271 HydrophobicContact CD2-CD2 4.43Å; F1267-L1271 HydrophobicContact CE1-CD1 4.46Å; L1268-L1271 HydrophobicContact CD2-CD1 4.28Å; L1268-L1271 WeakPolarHBondContact O-CB 3.3Å; L1268-L1271 PolarHBondContact O-N 3.04Å; G1269-L1271 VanDerWaalsContact C-N 3.32Å; L1271-D1273 PolarHBondContact O-N 3Å; L1271-D1273 VanDerWaalsContact O-N 3.12Å; L1271-I1274 PolarHBondContact O-N 3.06Å; L1271-I1274 VanDerWaalsContact O-N 3.16Å; L1271-F1276 HydrophobicContact CB-CE2 4.44Å; L1271-F1276 HydrophobicContact CD1-CE2 4.2Å; L1271-F1276 HydrophobicContact CD1-CZ 4.1Å; L1271-N1301 PolarHBondContact O-ND2 3.12Å
1272	N	75.8	Confident	87.7	Confident	83.2 Å²	83.2	37.8 Å²	37.8	45%	0.445	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-27.3	-173.8	-73.7	-40.7	0	0	0	115	G1269 Y1270 I1274 K1300	G1269-N1272 PolarHBondContact O-OD1 3.25Å; Y1270-N1272 VanDerWaalsContact C-N 3.33Å; Y1270-N1272 PolarHBondContact O-N 3.23Å; Y1270-N1272 VanDerWaalsContact O-N 3.13Å; N1272-I1274 VanDerWaalsContact C-N 3.33Å; N1272-K1300 WeakPolarHBondContact OD1-CE 3.31Å; N1272-K1300 PolarHBondContact OD1-NZ 3.11Å; N1272-K1300 VanDerWaalsContact OD1-NZ 3.16Å
1273	D	80.1	Confident	87.7	Confident	159.8 Å²	159.8	36.5 Å²	36.5	86%	0.855	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-11.9	-175.2	-58.4	-35.3	0	0	0	113.4	L1271	L1271-D1273 PolarHBondContact O-N 3Å; L1271-D1273 VanDerWaalsContact O-N 3.12Å
1274	I	86.5	Confident	87.7	Confident	42.8 Å²	42.8	31.4 Å²	31.4	22%	0.219	16%	0.16	C	C	.	.			trans	-117.9	129.6	-173.8	-54.7	175.4	0	0	0	109.5	Q1187 I1225 L1271 N1272 F1276 N1301	Q1187-I1274 HydrophobicContact CB-CG2 4.47Å; Q1187-I1274 HydrophobicContact CG-CG2 3.72Å; I1225-I1274 HydrophobicContact CB-CD1 4.43Å; I1225-I1274 HydrophobicContact CD1-CD1 3.83Å; I1225-I1274 HydrophobicContact CG1-CD1 4.14Å; I1225-I1274 HydrophobicContact CG2-CD1 3.44Å; I1225-I1274 VanDerWaalsContact CG2-CD1 3.47Å; L1271-I1274 PolarHBondContact O-N 3.06Å; L1271-I1274 VanDerWaalsContact O-N 3.16Å; N1272-I1274 VanDerWaalsContact C-N 3.33Å; I1274-F1276 HydrophobicContact CB-CE2 3.92Å; I1274-F1276 HydrophobicContact CB-CZ 4.3Å; I1274-F1276 HydrophobicContact CG2-CD2 4.25Å; I1274-F1276 HydrophobicContact CG2-CE1 4.36Å; I1274-F1276 HydrophobicContact CG2-CE2 3.61Å; I1274-F1276 HydrophobicContact CG2-CZ 3.67Å; I1274-N1301 WeakPolarHBondContact O-CB 3.36Å; I1274-N1301 PolarHBondContact O-ND2 2.99Å
1275	Q	89.2	Confident	87.4	Confident	37.8 Å²	37.8	34.6 Å²	34.6	18%	0.177	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	133.8	176.8	-59	-65.4	-49.2	0	0	110.1	V1184 H1186 Q1187 R1303	V1184-Q1275 HydrophobicContact CG1-CG 4.38Å; H1186-Q1275 CarbonylContact C-O 3.48Å; H1186-Q1275 WeakPolarHBondContact CA-O 3.34Å; H1186-Q1275 HydrophobicContact CB-CB 4.48Å; H1186-Q1275 VanDerWaalsContact CD2-CB 3.46Å; H1186-Q1275 WeakPolarHBondContact CD2-CB 3.36Å; Q1187-Q1275 PolarHBondContact N-O 3.18Å; Q1275-R1303 VanDerWaalsContact OE1-NH2 3.15Å
1276	F	91.3	Very high	87.1	Confident	0.4 Å²	0.4	34.8 Å²	34.8	0%	0.002	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	134.5	179.3	-66.8	-91.5	0	0	0	110.6	Q1187 L1218 L1222 L1268 L1271 I1274 F1278 N1301 V1302 R1303	Q1187-F1276 HydrophobicContact CB-CD1 3.7Å; Q1187-F1276 HydrophobicContact CB-CE1 3.84Å; Q1187-F1276 HydrophobicContact CB-CG 4.45Å; Q1187-F1276 HydrophobicContact CG-CD1 4.23Å; Q1187-F1276 HydrophobicContact CG-CE1 4.01Å; Q1187-F1276 WeakPolarHBondContact O-CA 3.18Å; L1218-F1276 HydrophobicContact CD2-CE1 4.43Å; L1222-F1276 HydrophobicContact CD2-CZ 4.35Å; L1268-F1276 HydrophobicContact CB-CD2 4.18Å; L1268-F1276 HydrophobicContact CB-CE2 4.23Å; L1268-F1276 HydrophobicContact CD1-CB 4.28Å; L1268-F1276 HydrophobicContact CD1-CD1 3.98Å; L1268-F1276 HydrophobicContact CD1-CD2 4.11Å; L1268-F1276 HydrophobicContact CD1-CE1 4.36Å; L1268-F1276 HydrophobicContact CD1-CE2 4.46Å; L1268-F1276 HydrophobicContact CD1-CG 3.85Å; L1268-F1276 HydrophobicContact CD2-CD1 4.37Å; L1268-F1276 HydrophobicContact CD2-CD2 4.34Å; L1268-F1276 HydrophobicContact CD2-CE1 3.92Å; L1268-F1276 HydrophobicContact CD2-CE2 3.89Å; L1268-F1276 HydrophobicContact CD2-CZ 3.66Å; L1268-F1276 HydrophobicContact CG-CD2 4.43Å; L1268-F1276 HydrophobicContact CG-CE2 4.41Å; L1271-F1276 HydrophobicContact CB-CE2 4.44Å; L1271-F1276 HydrophobicContact CD1-CE2 4.2Å; L1271-F1276 HydrophobicContact CD1-CZ 4.1Å; I1274-F1276 HydrophobicContact CB-CE2 3.92Å; I1274-F1276 HydrophobicContact CB-CZ 4.3Å; I1274-F1276 HydrophobicContact CG2-CD2 4.25Å; I1274-F1276 HydrophobicContact CG2-CE1 4.36Å; I1274-F1276 HydrophobicContact CG2-CE2 3.61Å; I1274-F1276 HydrophobicContact CG2-CZ 3.67Å; F1276-F1278 HydrophobicContact CB-CE2 4.04Å; F1276-N1301 PolarHBondContact N-O 3.12Å; F1276-V1302 HydrophobicContact CB-CG2 4.4Å; F1276-R1303 PolarHBondContact O-N 3.07Å
1277	A	91.3	Very high	86.6	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	120.6	175.3	0	0	0	0	0	110.3	F1072 L1136 H1186 Q1187 I1188 L1189 L1279 R1303	F1072-A1277 HydrophobicContact CZ-CB 4.37Å; L1136-A1277 HydrophobicContact CD1-CB 4.14Å; H1186-A1277 HydrophobicContact CB-CB 4.1Å; Q1187-A1277 PolarHBondContact O-N 3.23Å; I1188-A1277 WeakPolarHBondContact CA-O 3.44Å; I1188-A1277 HydrophobicContact CG1-CB 4.37Å; L1189-A1277 PolarHBondContact N-O 3.1Å; A1277-L1279 HydrophobicContact CB-CD1 3.98Å; A1277-R1303 CarbonylContact C-O 3.57Å; A1277-R1303 WeakPolarHBondContact CA-O 3.31Å
1278	F	93	Very high	86.3	Confident	0.2 Å²	0.2	38.1 Å²	38.1	0%	0.001	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	117.8	176.5	-67.4	-94.2	0	0	0	109.1	L1189 W1214 L1218 F1261 I1265 L1268 F1276 V1302 R1303 F1304 V1305	L1189-F1278 HydrophobicContact CB-CD1 3.93Å; L1189-F1278 HydrophobicContact CB-CE1 4.2Å; L1189-F1278 HydrophobicContact CD1-CD1 4.16Å; L1189-F1278 HydrophobicContact CD1-CE1 3.66Å; L1189-F1278 HydrophobicContact CD1-CZ 4.04Å; L1189-F1278 HydrophobicContact CD2-CE1 4.19Å; L1189-F1278 HydrophobicContact CG-CD1 4.47Å; L1189-F1278 HydrophobicContact CG-CE1 4.29Å; L1189-F1278 CarbonylContact O-C 3.46Å; L1189-F1278 WeakPolarHBondContact O-CA 3.31Å; W1214-F1278 HydrophobicContact CD2-CD1 4.24Å; W1214-F1278 AromaticContact CE3-CD1 3.72Å; W1214-F1278 HydrophobicContact CE3-CD1 3.72Å; W1214-F1278 HydrophobicContact CE3-CE1 4.13Å; W1214-F1278 HydrophobicContact CH2-CB 4.01Å; W1214-F1278 AromaticContact CH2-CD1 3.93Å; W1214-F1278 HydrophobicContact CH2-CD1 3.93Å; W1214-F1278 HydrophobicContact CH2-CG 4.44Å; W1214-F1278 HydrophobicContact CZ2-CD1 4.44Å; W1214-F1278 HydrophobicContact CZ3-CB 4.23Å; W1214-F1278 AromaticContact CZ3-CD1 3.56Å; W1214-F1278 HydrophobicContact CZ3-CD1 3.56Å; W1214-F1278 VanDerWaalsContact CZ3-CD1 3.5Å; W1214-F1278 HydrophobicContact CZ3-CE1 4.37Å; W1214-F1278 HydrophobicContact CZ3-CG 4.3Å; L1218-F1278 HydrophobicContact CD1-CE1 4.27Å; L1218-F1278 HydrophobicContact CD1-CZ 4.23Å; L1218-F1278 HydrophobicContact CD2-CZ 4.3Å; F1261-F1278 HydrophobicContact CE2-CD1 4.5Å; F1261-F1278 AromaticContact CE2-CE1 3.87Å; F1261-F1278 HydrophobicContact CE2-CE1 4.06Å; F1261-F1278 HydrophobicContact CE2-CZ 4.5Å; F1261-F1278 HydrophobicContact CZ-CD1 4.29Å; F1261-F1278 AromaticContact CZ-CE1 3.86Å; F1261-F1278 HydrophobicContact CZ-CE1 4.04Å; F1261-F1278 HydrophobicContact CZ-CZ 4.43Å; I1265-F1278 HydrophobicContact CD1-CD2 4.42Å; I1265-F1278 HydrophobicContact CD1-CE1 4.24Å; I1265-F1278 HydrophobicContact CD1-CE2 3.62Å; I1265-F1278 HydrophobicContact CD1-CZ 3.5Å; I1265-F1278 VanDerWaalsContact CD1-CZ 3.46Å; L1268-F1278 HydrophobicContact CD1-CE2 4Å; L1268-F1278 HydrophobicContact CD1-CZ 3.9Å; F1276-F1278 HydrophobicContact CB-CE2 4.04Å; F1278-V1302 HydrophobicContact CD2-CG1 3.99Å; F1278-V1302 HydrophobicContact CE2-CG1 3.89Å; F1278-R1303 PolarHBondContact N-O 3.1Å; F1278-F1304 HydrophobicContact CB-CD1 3.46Å; F1278-F1304 VanDerWaalsContact CB-CD1 3.46Å; F1278-F1304 HydrophobicContact CB-CD2 4.46Å; F1278-F1304 HydrophobicContact CB-CE1 3.31Å; F1278-F1304 HydrophobicContact CB-CE2 4.4Å; F1278-F1304 HydrophobicContact CB-CG 4.07Å; F1278-F1304 HydrophobicContact CB-CZ 3.84Å; F1278-F1304 HydrophobicContact CD1-CE1 4.31Å; F1278-F1304 HydrophobicContact CD1-CZ 4.37Å; F1278-F1304 HydrophobicContact CD2-CD2 4.48Å; F1278-F1304 HydrophobicContact CD2-CE1 4.24Å; F1278-F1304 AromaticContact CD2-CE2 3.95Å; F1278-F1304 HydrophobicContact CD2-CE2 4.05Å; F1278-F1304 AromaticContact CD2-CZ 3.85Å; F1278-F1304 HydrophobicContact CD2-CZ 3.85Å; F1278-F1304 HydrophobicContact CE2-CZ 4.42Å; F1278-F1304 HydrophobicContact CG-CD1 4.31Å; F1278-F1304 AromaticContact CG-CE1 3.73Å; F1278-F1304 HydrophobicContact CG-CE1 3.73Å; F1278-F1304 HydrophobicContact CG-CE2 4.37Å; F1278-F1304 AromaticContact CG-CZ 3.77Å; F1278-F1304 HydrophobicContact CG-CZ 3.77Å; F1278-F1304 CarbonylContact O-C 3.56Å; F1278-F1304 VanDerWaalsContact O-CA 3.28Å; F1278-F1304 WeakPolarHBondContact O-CA 3.32Å; F1278-V1305 PolarHBondContact O-N 3.19Å
1279	L	92.7	Very high	85.9	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	126.3	-175.7	-62.7	92	0	0	0	110.2	L1129 L1132 T1133 I1188 L1189 I1190 H1191 A1277 V1305	L1129-L1279 HydrophobicContact CD1-CB 4.26Å; L1129-L1279 HydrophobicContact CD1-CD2 3.87Å; L1129-L1279 HydrophobicContact CD1-CG 4.48Å; L1129-L1279 HydrophobicContact CD2-CB 4.35Å; L1129-L1279 HydrophobicContact CD2-CD2 4.34Å; L1129-L1279 HydrophobicContact CG-CB 4.35Å; L1129-L1279 HydrophobicContact CG-CD2 4.16Å; L1132-L1279 HydrophobicContact CD2-CD2 4.41Å; T1133-L1279 WeakPolarHBondContact OG1-CD2 3.38Å; I1188-L1279 HydrophobicContact CG1-CD1 4.44Å; I1188-L1279 HydrophobicContact CG2-CD1 3.62Å; I1188-L1279 VanDerWaalsContact CG2-CD1 3.46Å; L1189-L1279 PolarHBondContact O-N 3.04Å; I1190-L1279 CarbonylContact C-O 3.47Å; I1190-L1279 VanDerWaalsContact CA-O 3.31Å; I1190-L1279 WeakPolarHBondContact CA-O 3.28Å; I1190-L1279 HydrophobicContact CB-CB 4.28Å; I1190-L1279 HydrophobicContact CD1-CB 4.28Å; I1190-L1279 HydrophobicContact CD1-CD2 4.31Å; I1190-L1279 HydrophobicContact CG1-CB 4.02Å; H1191-L1279 PolarHBondContact N-O 3.06Å; A1277-L1279 HydrophobicContact CB-CD1 3.98Å; L1279-V1305 CarbonylContact C-O 3.52Å; L1279-V1305 VanDerWaalsContact CA-O 3.27Å; L1279-V1305 WeakPolarHBondContact CA-O 3.42Å; L1279-V1305 HydrophobicContact CB-CB 4.44Å; L1279-V1305 HydrophobicContact CD2-CB 3.86Å; L1279-V1305 HydrophobicContact CD2-CG1 4.29Å; L1279-V1305 HydrophobicContact CD2-CG2 4.05Å; L1279-V1305 HydrophobicContact CG-CB 3.91Å; L1279-V1305 HydrophobicContact CG-CG2 4.15Å
1280	I	91.7	Very high	85.8	Confident	1.4 Å²	1.4	43.8 Å²	43.8	1%	0.007	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	121.3	175.6	-54.5	-176.6	0	0	0	109.2	H1191 W1214 C1283 W1293 V1305 L1306 T1307	H1191-I1280 WeakPolarHBondContact O-CA 3.38Å; W1214-I1280 HydrophobicContact CH2-CD1 3.55Å; W1214-I1280 VanDerWaalsContact CH2-CD1 3.48Å; W1214-I1280 HydrophobicContact CH2-CG1 3.46Å; W1214-I1280 VanDerWaalsContact CH2-CG1 3.46Å; W1214-I1280 HydrophobicContact CZ2-CD1 4.26Å; W1214-I1280 HydrophobicContact CZ2-CG1 3.87Å; W1214-I1280 HydrophobicContact CZ3-CD1 4.18Å; W1214-I1280 HydrophobicContact CZ3-CG1 4.44Å; I1280-C1283 HydrophobicContact CG2-CB 4.15Å; I1280-W1293 HydrophobicContact CD1-CH2 3.37Å; I1280-W1293 VanDerWaalsContact CD1-CH2 3.44Å; I1280-W1293 HydrophobicContact CD1-CZ2 3.67Å; I1280-W1293 HydrophobicContact CD1-CZ3 4.3Å; I1280-V1305 PolarHBondContact N-O 3.23Å; I1280-L1306 HydrophobicContact CB-CD2 3.74Å; I1280-L1306 HydrophobicContact CD1-CD2 4.03Å; I1280-L1306 HydrophobicContact CG1-CD2 3.94Å; I1280-L1306 WeakPolarHBondContact O-CA 3.29Å; I1280-T1307 PolarHBondContact O-N 3.1Å
1281	D	90.4	Very high	85.9	Confident	2.6 Å²	2.6	38.2 Å²	38.2	1%	0.014	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	136	171.1	-159.2	40.2	0	0	0	111.3	T1126 L1129 H1191 F1192 C1193 T1307	T1126-D1281 VanDerWaalsContact CB-OD2 3.27Å; T1126-D1281 WeakPolarHBondContact CB-OD2 3.33Å; T1126-D1281 VanDerWaalsContact CG2-OD2 3.26Å; T1126-D1281 WeakPolarHBondContact CG2-OD2 3.19Å; T1126-D1281 PolarHBondContact OG1-OD1 2.93Å; T1126-D1281 PolarHBondContact OG1-OD2 2.93Å; L1129-D1281 HydrophobicContact CD1-CB 4.19Å; L1129-D1281 HydrophobicContact CD2-CB 4.15Å; H1191-D1281 PolarHBondContact O-N 3.33Å; F1192-D1281 HydrophobicContact CB-CB 4.49Å; F1192-D1281 HydrophobicContact CD1-CB 3.54Å; F1192-D1281 VanDerWaalsContact CD1-CB 3.46Å; F1192-D1281 HydrophobicContact CE1-CB 4.12Å; F1192-D1281 HydrophobicContact CG-CB 4.33Å; C1193-D1281 VanDerWaalsContact CB-O 3.29Å; C1193-D1281 WeakPolarHBondContact CB-O 3.36Å; C1193-D1281 PolarHBondContact N-O 3.23Å; C1193-D1281 PolarHBondContact SG-O 3.04Å; D1281-T1307 VanDerWaalsContact CA-OG1 3.24Å; D1281-T1307 WeakPolarHBondContact CA-OG1 3.42Å; D1281-T1307 WeakPolarHBondContact OD1-CB 3.13Å; D1281-T1307 WeakPolarHBondContact OD1-CG2 3.28Å; D1281-T1307 PolarHBondContact OD1-OG1 3.29Å
1282	D	88.2	Confident	85.9	Confident	23.6 Å²	23.6	44.6 Å²	44.6	13%	0.126	23%	0.226	C	C	.	.	S	Bend	trans	53.3	54.8	-178.3	-70	-28.6	0	0	0	113.1	C1193 N1194 D1284 R1285 T1307	C1193-D1282 HydrophobicContact CB-CB 4.41Å; C1193-D1282 PolarHBondContact SG-O 2.89Å; N1194-D1282 PolarHBondContact ND2-OD2 3.15Å; D1282-D1284 PolarHBondContact O-N 3.17Å; D1282-D1284 VanDerWaalsContact O-N 3.1Å; D1282-R1285 HydrophobicContact CB-CB 4.48Å; D1282-R1285 HydrophobicContact CB-CG 3.99Å; D1282-R1285 VanDerWaalsContact O-CB 3.31Å; D1282-R1285 WeakPolarHBondContact O-CB 3.23Å; D1282-R1285 PolarHBondContact O-N 3.27Å; D1282-T1307 CarbonylContact C-O 3.54Å; D1282-T1307 WeakPolarHBondContact CA-O 3.37Å; D1282-T1307 PolarHBondContact N-O 3.11Å; D1282-T1307 PolarHBondContact N-OG1 3.22Å
1283	C	88.4	Confident	86.6	Confident	2 Å²	2	40.7 Å²	40.7	1%	0.014	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-59.7	-22.9	-179.1	-174.1	0	0	0	0	113.2	I1280 R1285 L1286 L1306 T1307	I1280-C1283 HydrophobicContact CG2-CB 4.15Å; C1283-R1285 PolarHBondContact O-N 3.4Å; C1283-R1285 VanDerWaalsContact O-N 3.11Å; C1283-L1286 WeakPolarHBondContact O-CG 3.37Å; C1283-L1286 PolarHBondContact O-N 3.2Å; C1283-L1306 HydrophobicContact CB-CB 4.34Å; C1283-L1306 HydrophobicContact CB-CD2 4.48Å; C1283-T1307 WeakPolarHBondContact CB-O 3.39Å; C1283-T1307 PolarHBondContact N-O 2.97Å
1284	D	87.5	Confident	87	Confident	14 Å²	14	33.4 Å²	33.4	8%	0.075	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-69.8	-0.1	172.3	63.1	-49.6	0	0	0	114.3	D1282 M1289 C1308 D1309 S1312 V1314	D1282-D1284 PolarHBondContact O-N 3.17Å; D1282-D1284 VanDerWaalsContact O-N 3.1Å; D1284-M1289 HydrophobicContact CB-CE 3.86Å; D1284-M1289 VanDerWaalsContact O-CE 3.32Å; D1284-M1289 WeakPolarHBondContact O-CE 3.29Å; D1284-M1289 VanDerWaalsContact O-SD 3.4Å; D1284-C1308 HydrophobicContact CB-CB 4.26Å; D1284-C1308 VanDerWaalsContact OD1-CA 3.28Å; D1284-C1308 WeakPolarHBondContact OD1-CA 3.3Å; D1284-C1308 VanDerWaalsContact OD1-CB 3.27Å; D1284-C1308 WeakPolarHBondContact OD1-CB 3.18Å; D1284-D1309 PolarHBondContact OD2-N 2.85Å; D1284-S1312 WeakPolarHBondContact CB-OG 3.27Å; D1284-V1314 HydrophobicContact CB-CB 4.34Å; D1284-V1314 HydrophobicContact CB-CG2 4.38Å
1285	R	82.4	Confident	87.1	Confident	67.8 Å²	67.8	32.2 Å²	32.2	26%	0.256	16%	0.161	S	C	.	.	G	3₁₀ helix	trans	-110.2	4.2	178.7	-55.3	-58.9	-162	171.5	-0.8	114.3	C1193 K1205 D1282 C1283 R1571	C1193-R1285 HydrophobicContact CB-CB 4.32Å; K1205-R1285 WeakPolarHBondContact CB-O 3.33Å; D1282-R1285 HydrophobicContact CB-CB 4.48Å; D1282-R1285 HydrophobicContact CB-CG 3.99Å; D1282-R1285 VanDerWaalsContact O-CB 3.31Å; D1282-R1285 WeakPolarHBondContact O-CB 3.23Å; D1282-R1285 PolarHBondContact O-N 3.27Å; C1283-R1285 PolarHBondContact O-N 3.4Å; C1283-R1285 VanDerWaalsContact O-N 3.11Å; R1285-R1571 VanDerWaalsContact CD-NH1 3.33Å; R1285-R1571 VanDerWaalsContact NE-NH1 3.11Å; R1285-R1571 VanDerWaalsContact NH1-NH1 3.16Å
1286	L	83.7	Confident	86.9	Confident	3.6 Å²	3.6	38.2 Å²	38.2	2%	0.019	19%	0.189	C	C	.	.			trans	-63.4	141	175.6	-68.2	171.6	0	0	0	111.1	K1205 L1207 I1210 C1283 P1288 M1289 W1293	K1205-L1286 CarbonylContact O-C 3.48Å; K1205-L1286 WeakPolarHBondContact O-CA 3.39Å; L1207-L1286 HydrophobicContact CD1-CD1 4.4Å; L1207-L1286 HydrophobicContact CD1-CD2 4.36Å; I1210-L1286 HydrophobicContact CD1-CD2 3.4Å; I1210-L1286 VanDerWaalsContact CD1-CD2 3.46Å; C1283-L1286 WeakPolarHBondContact O-CG 3.37Å; C1283-L1286 PolarHBondContact O-N 3.2Å; L1286-P1288 CarbonylContact C-O 3.3Å; L1286-P1288 CarbonylContact O-C 3.48Å; L1286-P1288 VanDerWaalsContact O-C 3.23Å; L1286-M1289 VanDerWaalsContact O-CA 3.27Å; L1286-M1289 WeakPolarHBondContact O-CA 3.41Å; L1286-M1289 WeakPolarHBondContact O-CB 3.21Å; L1286-M1289 WeakPolarHBondContact O-CG 3.33Å; L1286-M1289 PolarHBondContact O-N 3.11Å; L1286-M1289 VanDerWaalsContact O-N 3.07Å; L1286-W1293 HydrophobicContact CD1-CZ2 4.24Å
1287	E	78.7	Confident	86.7	Confident	106.8 Å²	106.8	42.6 Å²	42.6	50%	0.499	21%	0.212	S	C	.	.	B	Isolated β-bridge	trans	-117.1	113.9	177	-70.1	176.9	-170.4	0	0	109.1	K1205 L1207	K1205-E1287 HydrophobicContact CB-CB 4.48Å; K1205-E1287 HydrophobicContact CB-CG 4.31Å; K1205-E1287 PolarHBondContact O-N 3.29Å; L1207-E1287 WeakPolarHBondContact CB-O 3.24Å; L1207-E1287 PolarHBondContact N-O 3.03Å
1288	P	80.2	Confident	86.6	Confident	62.8 Å²	62.8	42.7 Å²	42.7	41%	0.408	21%	0.212	S	C	.	.	S	Bend	cis	-72	156.4	-5.6	33.1	-36	0	0	0	112.4	L1254 L1286 T1290	L1254-P1288 HydrophobicContact CD1-CG 4.46Å; L1254-P1288 HydrophobicContact CD2-CG 3.61Å; L1254-P1288 VanDerWaalsContact CD2-CG 3.45Å; L1286-P1288 CarbonylContact C-O 3.3Å; L1286-P1288 CarbonylContact O-C 3.48Å; L1286-P1288 VanDerWaalsContact O-C 3.23Å; P1288-T1290 HydrophobicContact CB-CG2 4.09Å; P1288-T1290 HydrophobicContact CG-CG2 4.07Å; P1288-T1290 PolarHBondContact O-N 3.23Å
1289	M	79.8	Confident	86.5	Confident	103.8 Å²	103.8	43.6 Å²	43.6	51%	0.511	22%	0.218	S	C	.	.			trans	-76.6	62.4	179.6	-131.2	-172.8	-168.5	0	0	111.4	D1284 L1286 S1312 S1313 V1314	D1284-M1289 HydrophobicContact CB-CE 3.86Å; D1284-M1289 VanDerWaalsContact O-CE 3.32Å; D1284-M1289 WeakPolarHBondContact O-CE 3.29Å; D1284-M1289 VanDerWaalsContact O-SD 3.4Å; L1286-M1289 VanDerWaalsContact O-CA 3.27Å; L1286-M1289 WeakPolarHBondContact O-CA 3.41Å; L1286-M1289 WeakPolarHBondContact O-CB 3.21Å; L1286-M1289 WeakPolarHBondContact O-CG 3.33Å; L1286-M1289 PolarHBondContact O-N 3.11Å; L1286-M1289 VanDerWaalsContact O-N 3.07Å; M1289-S1312 WeakPolarHBondContact CE-OG 3.46Å; M1289-S1313 WeakPolarHBondContact CE-OG 3Å; M1289-V1314 HydrophobicContact CE-CB 4.09Å; M1289-V1314 HydrophobicContact CE-CG2 3.43Å; M1289-V1314 VanDerWaalsContact CE-CG2 3.43Å; M1289-V1314 HydrophobicContact CG-CG2 3.78Å; M1289-V1314 HydrophobicContact SD-CG2 4.18Å
1290	T	82.8	Confident	86.3	Confident	35.8 Å²	35.8	48.2 Å²	48.2	22%	0.22	24%	0.238	C	C	.	.			trans	-114.4	152.5	-178.9	78.9	0	0	0	0	111.8	L1207 P1288 E1292 W1293	L1207-T1290 HydrophobicContact CD2-CG2 3.76Å; P1288-T1290 HydrophobicContact CB-CG2 4.09Å; P1288-T1290 HydrophobicContact CG-CG2 4.07Å; P1288-T1290 PolarHBondContact O-N 3.23Å; T1290-E1292 WeakPolarHBondContact OG1-CG 3.46Å; T1290-E1292 PolarHBondContact OG1-N 3.4Å; T1290-W1293 VanDerWaalsContact O-CD1 3.27Å; T1290-W1293 PolarHBondContact O-NE1 3.11Å; T1290-W1293 VanDerWaalsContact O-NE1 3.11Å
1291	L	86	Confident	86.3	Confident	40.6 Å²	40.6	48.1 Å²	48.1	21%	0.213	24%	0.238	C	C	.	.			trans	-108.9	5.9	175.2	-68.9	174.6	0	0	0	112.7	W1293 L1294 V1314 N1317 L1318	L1291-W1293 PolarHBondContact O-N 3.16Å; L1291-L1294 WeakPolarHBondContact O-CB 3.43Å; L1291-L1294 PolarHBondContact O-N 3.2Å; L1291-L1294 VanDerWaalsContact O-N 3.1Å; L1291-V1314 HydrophobicContact CD1-CG1 4.31Å; L1291-V1314 HydrophobicContact CD2-CG1 3.94Å; L1291-V1314 HydrophobicContact CG-CG1 4.28Å; L1291-N1317 HydrophobicContact CD1-CB 3.81Å; L1291-L1318 HydrophobicContact CD1-CD2 3.93Å; L1291-L1318 HydrophobicContact CD1-CG 3.81Å; L1291-L1318 HydrophobicContact CD2-CD1 4.31Å; L1291-L1318 HydrophobicContact CD2-CD2 4.02Å; L1291-L1318 HydrophobicContact CD2-CG 4.2Å; L1291-L1318 HydrophobicContact CG-CD2 4.44Å
1292	E	85.3	Confident	86.3	Confident	146.8 Å²	146.8	48 Å²	48	69%	0.686	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-26.7	-177.6	-66.6	-176.9	172.9	0	0	113.2	I1258 T1290 L1294	I1258-E1292 HydrophobicContact CD1-CB 4.36Å; T1290-E1292 WeakPolarHBondContact OG1-CG 3.46Å; T1290-E1292 PolarHBondContact OG1-N 3.4Å; E1292-L1294 PolarHBondContact O-N 3.08Å
1293	W	88.8	Confident	86.6	Confident	2.2 Å²	2.2	48 Å²	48	1%	0.008	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-18.9	176.7	68.3	-92.3	0	0	0	113.3	L1207 L1211 W1214 I1258 F1261 I1280 L1286 T1290 L1291 P1295 F1304 L1306	L1207-W1293 HydrophobicContact CD1-CB 4.38Å; L1207-W1293 HydrophobicContact CD1-CD2 4.15Å; L1207-W1293 HydrophobicContact CD1-CG 3.91Å; L1207-W1293 HydrophobicContact CD2-CB 4.21Å; L1207-W1293 VanDerWaalsContact CD2-CD1 3.46Å; L1207-W1293 HydrophobicContact CD2-CG 3.96Å; L1207-W1293 HydrophobicContact CG-CG 4.43Å; L1211-W1293 HydrophobicContact CD1-CB 4.16Å; L1211-W1293 HydrophobicContact CD2-CB 4.48Å; L1211-W1293 HydrophobicContact CD2-CE3 4.25Å; W1214-W1293 HydrophobicContact CZ3-CH2 4.41Å; W1214-W1293 HydrophobicContact CZ3-CZ3 4.19Å; I1258-W1293 HydrophobicContact CD1-CB 4.18Å; I1258-W1293 HydrophobicContact CG1-CB 3.75Å; F1261-W1293 HydrophobicContact CD1-CE3 4.32Å; F1261-W1293 AromaticContact CE1-CE3 3.89Å; F1261-W1293 HydrophobicContact CE1-CE3 3.89Å; F1261-W1293 AromaticContact CE1-CZ3 3.89Å; F1261-W1293 HydrophobicContact CE1-CZ3 4.03Å; F1261-W1293 HydrophobicContact CZ-CZ3 4.36Å; I1280-W1293 HydrophobicContact CD1-CH2 3.37Å; I1280-W1293 VanDerWaalsContact CD1-CH2 3.44Å; I1280-W1293 HydrophobicContact CD1-CZ2 3.67Å; I1280-W1293 HydrophobicContact CD1-CZ3 4.3Å; L1286-W1293 HydrophobicContact CD1-CZ2 4.24Å; T1290-W1293 VanDerWaalsContact O-CD1 3.27Å; T1290-W1293 PolarHBondContact O-NE1 3.11Å; T1290-W1293 VanDerWaalsContact O-NE1 3.11Å; L1291-W1293 PolarHBondContact O-N 3.16Å; W1293-P1295 WeakPolarHBondContact O-CD 3.38Å; W1293-F1304 HydrophobicContact CH2-CD1 4.25Å; W1293-F1304 AromaticContact CH2-CE1 3.89Å; W1293-F1304 HydrophobicContact CH2-CE1 3.95Å; W1293-F1304 HydrophobicContact CZ3-CD1 4.37Å; W1293-F1304 AromaticContact CZ3-CE1 3.64Å; W1293-F1304 HydrophobicContact CZ3-CE1 3.64Å; W1293-F1304 VanDerWaalsContact CZ3-CE1 3.48Å; W1293-F1304 HydrophobicContact CZ3-CZ 4.29Å; W1293-L1306 HydrophobicContact CH2-CD2 4.45Å
1294	L	89.9	Confident	86.9	Confident	6 Å²	6	47.9 Å²	47.9	3%	0.031	24%	0.235	C	C	.	.	S	Bend	trans	-91.3	113.4	-178.8	-172.6	68.3	0	0	0	110.5	I1114 L1291 E1292 F1304 L1306 L1318 R1321	I1114-L1294 HydrophobicContact CD1-CD2 3.67Å; I1114-L1294 HydrophobicContact CD1-CG 4.47Å; I1114-L1294 HydrophobicContact CG1-CD2 4.45Å; L1291-L1294 WeakPolarHBondContact O-CB 3.43Å; L1291-L1294 PolarHBondContact O-N 3.2Å; L1291-L1294 VanDerWaalsContact O-N 3.1Å; E1292-L1294 PolarHBondContact O-N 3.08Å; L1294-F1304 HydrophobicContact CD1-CD1 3.83Å; L1294-F1304 HydrophobicContact CD1-CD2 3.84Å; L1294-F1304 HydrophobicContact CD1-CE1 3.85Å; L1294-F1304 HydrophobicContact CD1-CE2 3.85Å; L1294-F1304 HydrophobicContact CD1-CG 3.83Å; L1294-F1304 HydrophobicContact CD1-CZ 3.86Å; L1294-L1306 HydrophobicContact CD2-CD1 4.4Å; L1294-L1318 HydrophobicContact CD2-CD2 3.89Å; L1294-R1321 PolarHBondContact O-NH1 3.14Å
1295	P	87.6	Confident	87.3	Confident	18 Å²	18	47.3 Å²	47.3	12%	0.117	23%	0.231	C	C	.	.			trans	-55.9	146.6	-176.9	-26.4	35.5	0	0	0	113.3	A1262 I1265 W1293 I1297 L1298 R1321	A1262-P1295 HydrophobicContact CB-CG 4.4Å; I1265-P1295 HydrophobicContact CB-CG 4.3Å; I1265-P1295 HydrophobicContact CG1-CG 4.43Å; I1265-P1295 HydrophobicContact CG2-CG 4.14Å; W1293-P1295 WeakPolarHBondContact O-CD 3.38Å; P1295-I1297 VanDerWaalsContact C-N 3.32Å; P1295-I1297 PolarHBondContact O-N 3.01Å; P1295-L1298 HydrophobicContact CB-CD2 4.24Å; P1295-L1298 HydrophobicContact CG-CD2 4.34Å; P1295-R1321 PolarHBondContact O-NH1 3.21Å; P1295-R1321 PolarHBondContact O-NH2 3.02Å
1296	Q	84.8	Confident	87.9	Confident	162.8 Å²	162.8	44 Å²	44	76%	0.761	22%	0.219	S	C	*	.	S	Bend	trans	-67.7	-33.4	178.3	-72.4	-172.1	-6.1	0	0	113	R1086 R1321	R1086-Q1296 PolarHBondContact NH1-O 3.01Å; R1086-Q1296 VanDerWaalsContact NH1-O 3.14Å; R1086-Q1296 PolarHBondContact NH2-O 3.21Å; Q1296-R1321 PolarHBondContact O-NH2 3.13Å; Q1296-R1321 VanDerWaalsContact O-NH2 3.13Å
1297	I	86.8	Confident	88.4	Confident	94 Å²	94	43.9 Å²	43.9	48%	0.482	22%	0.218	S	C	.	.	S	Bend	trans	-122.9	123.8	177.1	-56.1	175.6	0	0	0	107.2	P1295	P1295-I1297 VanDerWaalsContact C-N 3.32Å; P1295-I1297 PolarHBondContact O-N 3.01Å
1298	L	90.9	Very high	89	Confident	1.8 Å²	1.8	38.8 Å²	38.8	1%	0.009	19%	0.194	C	C	.	.			trans	-99.1	141.6	177.5	-65.8	172.5	0	0	0	109.8	G1112 I1114 I1265 P1295 V1302 F1304	G1112-L1298 PolarHBondContact N-O 3.14Å; I1114-L1298 HydrophobicContact CD1-CD1 4.31Å; I1114-L1298 HydrophobicContact CG1-CD1 3.79Å; I1265-L1298 HydrophobicContact CG2-CD2 4.25Å; P1295-L1298 HydrophobicContact CB-CD2 4.24Å; P1295-L1298 HydrophobicContact CG-CD2 4.34Å; L1298-V1302 HydrophobicContact CD2-CG1 4.45Å; L1298-F1304 HydrophobicContact CD1-CD2 3.8Å; L1298-F1304 HydrophobicContact CD1-CE2 4.32Å; L1298-F1304 HydrophobicContact CD2-CD2 3.98Å; L1298-F1304 HydrophobicContact CD2-CE2 3.67Å
1299	P	90.1	Very high	89.4	Confident	19.8 Å²	19.8	37.1 Å²	37.1	13%	0.129	18%	0.182	C	C	.	.			trans	-63.9	152	171.4	-20.7	31.5	0	0	0	112.7	G1112 I1265 G1269 N1301 V1302	G1112-P1299 WeakPolarHBondContact CA-O 3.32Å; G1112-P1299 PolarHBondContact N-O 3.08Å; I1265-P1299 HydrophobicContact CG2-CG 4.28Å; I1265-P1299 WeakPolarHBondContact O-CG 3.45Å; G1269-P1299 VanDerWaalsContact CA-CB 3.46Å; P1299-N1301 WeakPolarHBondContact CB-OD1 3.31Å; P1299-N1301 PolarHBondContact O-N 2.93Å; P1299-V1302 HydrophobicContact CB-CB 4.5Å; P1299-V1302 HydrophobicContact CB-CG2 4.15Å; P1299-V1302 HydrophobicContact CG-CG2 4.16Å; P1299-V1302 PolarHBondContact O-N 3.06Å
1300	K	89	Confident	89.7	Confident	95 Å²	95	35.2 Å²	35.2	41%	0.413	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-29.8	-175.2	75.4	-177.2	177	-174.3	0	115.2	C1110 N1272	C1110-K1300 HydrophobicContact CB-CB 4.4Å; C1110-K1300 VanDerWaalsContact O-CB 3.28Å; C1110-K1300 WeakPolarHBondContact O-CB 3.4Å; N1272-K1300 WeakPolarHBondContact OD1-CE 3.31Å; N1272-K1300 PolarHBondContact OD1-NZ 3.11Å; N1272-K1300 VanDerWaalsContact OD1-NZ 3.16Å
1301	N	90	Very high	89.8	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	3.4	-176.9	66.4	-38.9	0	0	0	113	L1268 G1269 L1271 I1274 F1276 P1299	L1268-N1301 PolarHBondContact O-ND2 3.07Å; L1268-N1301 PolarHBondContact O-OD1 3Å; G1269-N1301 WeakPolarHBondContact CA-OD1 3.28Å; L1271-N1301 PolarHBondContact O-ND2 3.12Å; I1274-N1301 WeakPolarHBondContact O-CB 3.36Å; I1274-N1301 PolarHBondContact O-ND2 2.99Å; F1276-N1301 PolarHBondContact N-O 3.12Å; P1299-N1301 WeakPolarHBondContact CB-OD1 3.31Å; P1299-N1301 PolarHBondContact O-N 2.93Å
1302	V	92.4	Very high	89.8	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	127.3	179.4	178	0	0	0	0	109.9	G1112 I1265 L1268 F1276 F1278 L1298 P1299 F1304	G1112-V1302 VanDerWaalsContact CA-O 3.26Å; G1112-V1302 WeakPolarHBondContact CA-O 3.35Å; I1265-V1302 HydrophobicContact CD1-CG1 4.4Å; I1265-V1302 HydrophobicContact CG2-CG1 4.36Å; L1268-V1302 HydrophobicContact CB-CG2 3.91Å; L1268-V1302 HydrophobicContact CD1-CG2 4.16Å; F1276-V1302 HydrophobicContact CB-CG2 4.4Å; F1278-V1302 HydrophobicContact CD2-CG1 3.99Å; F1278-V1302 HydrophobicContact CE2-CG1 3.89Å; L1298-V1302 HydrophobicContact CD2-CG1 4.45Å; P1299-V1302 HydrophobicContact CB-CB 4.5Å; P1299-V1302 HydrophobicContact CB-CG2 4.15Å; P1299-V1302 HydrophobicContact CG-CG2 4.16Å; P1299-V1302 PolarHBondContact O-N 3.06Å; V1302-F1304 HydrophobicContact CG1-CD2 4.28Å; V1302-F1304 HydrophobicContact CG1-CE2 3.83Å
1303	R	93.8	Very high	89.9	Confident	25.2 Å²	25.2	35.9 Å²	35.9	10%	0.095	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	143.7	177.3	-60.9	178.7	-170.4	166.7	1	110.8	F1072 L1075 T1076 S1113 H1186 Q1275 F1276 A1277 F1278	F1072-R1303 HydrophobicContact CE2-CB 4.42Å; F1072-R1303 HydrophobicContact CZ-CB 4.47Å; F1072-R1303 VanDerWaalsContact CZ-CD 3.47Å; F1072-R1303 PolarHBondContact O-NH1 3.06Å; L1075-R1303 HydrophobicContact CD1-CB 4.34Å; L1075-R1303 HydrophobicContact CD1-CG 4.43Å; T1076-R1303 PolarHBondContact OG1-NH2 3.37Å; S1113-R1303 WeakPolarHBondContact O-CA 3.25Å; H1186-R1303 PolarHBondContact NE2-NH1 3.05Å; H1186-R1303 VanDerWaalsContact NE2-NH1 3.14Å; Q1275-R1303 VanDerWaalsContact OE1-NH2 3.15Å; F1276-R1303 PolarHBondContact O-N 3.07Å; A1277-R1303 CarbonylContact C-O 3.57Å; A1277-R1303 WeakPolarHBondContact CA-O 3.31Å; F1278-R1303 PolarHBondContact N-O 3.1Å
1304	F	95.1	Very high	89.8	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	139.1	173.1	-80.5	-95.5	0	0	0	110.4	S1113 I1114 L1115 W1214 F1261 I1265 F1278 W1293 L1294 L1298 V1302 L1306	S1113-F1304 PolarHBondContact O-N 3.17Å; S1113-F1304 VanDerWaalsContact O-N 3.11Å; I1114-F1304 CarbonylContact C-O 3.53Å; I1114-F1304 WeakPolarHBondContact CA-O 3.36Å; I1114-F1304 HydrophobicContact CB-CB 4.46Å; I1114-F1304 HydrophobicContact CG1-CB 4.11Å; I1114-F1304 HydrophobicContact CG2-CB 4.23Å; L1115-F1304 PolarHBondContact N-O 3.09Å; W1214-F1304 HydrophobicContact CH2-CE1 4.5Å; W1214-F1304 HydrophobicContact CZ3-CE1 4.21Å; F1261-F1304 HydrophobicContact CE1-CZ 4.12Å; F1261-F1304 HydrophobicContact CZ-CE1 4.47Å; F1261-F1304 HydrophobicContact CZ-CZ 4.08Å; I1265-F1304 HydrophobicContact CD1-CZ 4.36Å; F1278-F1304 HydrophobicContact CB-CD1 3.46Å; F1278-F1304 VanDerWaalsContact CB-CD1 3.46Å; F1278-F1304 HydrophobicContact CB-CD2 4.46Å; F1278-F1304 HydrophobicContact CB-CE1 3.31Å; F1278-F1304 HydrophobicContact CB-CE2 4.4Å; F1278-F1304 HydrophobicContact CB-CG 4.07Å; F1278-F1304 HydrophobicContact CB-CZ 3.84Å; F1278-F1304 HydrophobicContact CD1-CE1 4.31Å; F1278-F1304 HydrophobicContact CD1-CZ 4.37Å; F1278-F1304 HydrophobicContact CD2-CD2 4.48Å; F1278-F1304 HydrophobicContact CD2-CE1 4.24Å; F1278-F1304 AromaticContact CD2-CE2 3.95Å; F1278-F1304 HydrophobicContact CD2-CE2 4.05Å; F1278-F1304 AromaticContact CD2-CZ 3.85Å; F1278-F1304 HydrophobicContact CD2-CZ 3.85Å; F1278-F1304 HydrophobicContact CE2-CZ 4.42Å; F1278-F1304 HydrophobicContact CG-CD1 4.31Å; F1278-F1304 AromaticContact CG-CE1 3.73Å; F1278-F1304 HydrophobicContact CG-CE1 3.73Å; F1278-F1304 HydrophobicContact CG-CE2 4.37Å; F1278-F1304 AromaticContact CG-CZ 3.77Å; F1278-F1304 HydrophobicContact CG-CZ 3.77Å; F1278-F1304 CarbonylContact O-C 3.56Å; F1278-F1304 VanDerWaalsContact O-CA 3.28Å; F1278-F1304 WeakPolarHBondContact O-CA 3.32Å; W1293-F1304 HydrophobicContact CH2-CD1 4.25Å; W1293-F1304 AromaticContact CH2-CE1 3.89Å; W1293-F1304 HydrophobicContact CH2-CE1 3.95Å; W1293-F1304 HydrophobicContact CZ3-CD1 4.37Å; W1293-F1304 AromaticContact CZ3-CE1 3.64Å; W1293-F1304 HydrophobicContact CZ3-CE1 3.64Å; W1293-F1304 VanDerWaalsContact CZ3-CE1 3.48Å; W1293-F1304 HydrophobicContact CZ3-CZ 4.29Å; L1294-F1304 HydrophobicContact CD1-CD1 3.83Å; L1294-F1304 HydrophobicContact CD1-CD2 3.84Å; L1294-F1304 HydrophobicContact CD1-CE1 3.85Å; L1294-F1304 HydrophobicContact CD1-CE2 3.85Å; L1294-F1304 HydrophobicContact CD1-CG 3.83Å; L1294-F1304 HydrophobicContact CD1-CZ 3.86Å; L1298-F1304 HydrophobicContact CD1-CD2 3.8Å; L1298-F1304 HydrophobicContact CD1-CE2 4.32Å; L1298-F1304 HydrophobicContact CD2-CD2 3.98Å; L1298-F1304 HydrophobicContact CD2-CE2 3.67Å; V1302-F1304 HydrophobicContact CG1-CD2 4.28Å; V1302-F1304 HydrophobicContact CG1-CE2 3.83Å; F1304-L1306 HydrophobicContact CD1-CD2 4.41Å
1305	V	95.3	Very high	89.7	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	116	170.1	-172.7	0	0	0	0	108.1	F1072 L1115 I1117 L1129 L1132 F1278 L1279 I1280	F1072-V1305 HydrophobicContact CD2-CG2 3.92Å; F1072-V1305 HydrophobicContact CE2-CG2 3.81Å; L1115-V1305 HydrophobicContact CB-CG1 4.28Å; L1115-V1305 HydrophobicContact CB-CG2 4.28Å; L1115-V1305 HydrophobicContact CD2-CG1 4.1Å; L1115-V1305 HydrophobicContact CD2-CG2 4.49Å; L1115-V1305 HydrophobicContact CG-CG1 4.3Å; L1115-V1305 CarbonylContact O-C 3.5Å; L1115-V1305 VanDerWaalsContact O-CA 3.3Å; L1115-V1305 WeakPolarHBondContact O-CA 3.33Å; I1117-V1305 HydrophobicContact CD1-CG1 3.83Å; I1117-V1305 HydrophobicContact CG1-CG1 4.29Å; L1129-V1305 HydrophobicContact CD1-CB 4.27Å; L1129-V1305 HydrophobicContact CD1-CG1 3.77Å; L1132-V1305 HydrophobicContact CD2-CB 4.48Å; L1132-V1305 HydrophobicContact CD2-CG1 4.01Å; L1132-V1305 HydrophobicContact CD2-CG2 3.97Å; F1278-V1305 PolarHBondContact O-N 3.19Å; L1279-V1305 CarbonylContact C-O 3.52Å; L1279-V1305 VanDerWaalsContact CA-O 3.27Å; L1279-V1305 WeakPolarHBondContact CA-O 3.42Å; L1279-V1305 HydrophobicContact CB-CB 4.44Å; L1279-V1305 HydrophobicContact CD2-CB 3.86Å; L1279-V1305 HydrophobicContact CD2-CG1 4.29Å; L1279-V1305 HydrophobicContact CD2-CG2 4.05Å; L1279-V1305 HydrophobicContact CG-CB 3.91Å; L1279-V1305 HydrophobicContact CG-CG2 4.15Å; I1280-V1305 PolarHBondContact N-O 3.23Å
1306	L	95.1	Very high	89.7	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	135.2	-175.2	-54.4	176	0	0	0	108.7	I1114 L1115 L1116 I1117 I1280 C1283 W1293 L1294 F1304 L1318	I1114-L1306 HydrophobicContact CG2-CD1 3.97Å; I1114-L1306 HydrophobicContact CG2-CG 4.31Å; L1115-L1306 PolarHBondContact O-N 3.02Å; L1116-L1306 CarbonylContact C-O 3.52Å; L1116-L1306 WeakPolarHBondContact CA-O 3.31Å; L1116-L1306 HydrophobicContact CD1-CB 4.16Å; I1117-L1306 PolarHBondContact N-O 3.09Å; I1280-L1306 HydrophobicContact CB-CD2 3.74Å; I1280-L1306 HydrophobicContact CD1-CD2 4.03Å; I1280-L1306 HydrophobicContact CG1-CD2 3.94Å; I1280-L1306 WeakPolarHBondContact O-CA 3.29Å; C1283-L1306 HydrophobicContact CB-CB 4.34Å; C1283-L1306 HydrophobicContact CB-CD2 4.48Å; W1293-L1306 HydrophobicContact CH2-CD2 4.45Å; L1294-L1306 HydrophobicContact CD2-CD1 4.4Å; F1304-L1306 HydrophobicContact CD1-CD2 4.41Å; L1306-L1318 HydrophobicContact CD1-CD1 3.61Å; L1306-L1318 HydrophobicContact CD1-CD2 4.18Å
1307	T	94	Very high	89.9	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	144.3	168.6	69.4	0	0	0	0	110.7	I1117 K1125 L1129 I1280 D1281 D1282 C1283	I1117-T1307 HydrophobicContact CB-CG2 3.92Å; I1117-T1307 HydrophobicContact CD1-CG2 4.43Å; I1117-T1307 HydrophobicContact CG2-CG2 4.35Å; I1117-T1307 VanDerWaalsContact O-CA 3.24Å; I1117-T1307 WeakPolarHBondContact O-CA 3.28Å; K1125-T1307 HydrophobicContact CB-CG2 4.25Å; L1129-T1307 HydrophobicContact CB-CG2 3.97Å; L1129-T1307 HydrophobicContact CD1-CG2 3.6Å; L1129-T1307 VanDerWaalsContact CD1-CG2 3.49Å; L1129-T1307 HydrophobicContact CG-CG2 4.39Å; I1280-T1307 PolarHBondContact O-N 3.1Å; D1281-T1307 VanDerWaalsContact CA-OG1 3.24Å; D1281-T1307 WeakPolarHBondContact CA-OG1 3.42Å; D1281-T1307 WeakPolarHBondContact OD1-CB 3.13Å; D1281-T1307 WeakPolarHBondContact OD1-CG2 3.28Å; D1281-T1307 PolarHBondContact OD1-OG1 3.29Å; D1282-T1307 CarbonylContact C-O 3.54Å; D1282-T1307 WeakPolarHBondContact CA-O 3.37Å; D1282-T1307 PolarHBondContact N-O 3.11Å; D1282-T1307 PolarHBondContact N-OG1 3.22Å; C1283-T1307 WeakPolarHBondContact CB-O 3.39Å; C1283-T1307 PolarHBondContact N-O 2.97Å
1308	C	91.5	Very high	90	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	162	176.9	-56.7	0	0	0	0	111.3	L1116 I1117 V1118 K1125 D1284 A1315	L1116-C1308 HydrophobicContact CD1-CB 4.23Å; L1116-C1308 VanDerWaalsContact CD1-SG 3.53Å; I1117-C1308 PolarHBondContact O-N 3Å; I1117-C1308 VanDerWaalsContact O-N 3.14Å; V1118-C1308 WeakPolarHBondContact CA-O 3.31Å; K1125-C1308 VanDerWaalsContact CD-O 3.28Å; K1125-C1308 WeakPolarHBondContact CD-O 3.42Å; K1125-C1308 WeakPolarHBondContact CE-O 3.1Å; D1284-C1308 HydrophobicContact CB-CB 4.26Å; D1284-C1308 VanDerWaalsContact OD1-CA 3.28Å; D1284-C1308 WeakPolarHBondContact OD1-CA 3.3Å; D1284-C1308 VanDerWaalsContact OD1-CB 3.27Å; D1284-C1308 WeakPolarHBondContact OD1-CB 3.18Å; C1308-A1315 HydrophobicContact CB-CB 3.99Å
1309	D	89	Confident	89.9	Confident	27.4 Å²	27.4	36.9 Å²	36.9	15%	0.147	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	142.6	163.6	-171.6	-3.1	0	0	0	111	N1121 D1284 K1311 S1312	N1121-D1309 PolarHBondContact OD1-OD2 3.11Å; D1284-D1309 PolarHBondContact OD2-N 2.85Å; D1309-K1311 PolarHBondContact O-N 3.1Å; D1309-K1311 VanDerWaalsContact O-N 3.11Å; D1309-K1311 PolarHBondContact OD1-N 2.99Å; D1309-K1311 VanDerWaalsContact OD1-N 3.1Å; D1309-S1312 VanDerWaalsContact O-CB 3.26Å; D1309-S1312 WeakPolarHBondContact O-CB 3.36Å; D1309-S1312 PolarHBondContact O-N 3.04Å; D1309-S1312 VanDerWaalsContact O-N 3.11Å; D1309-S1312 PolarHBondContact O-OG 3.3Å
1310	S	85.1	Confident	89.7	Confident	64.8 Å²	64.8	42.3 Å²	42.3	45%	0.453	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-29	172.7	60.7	0	0	0	0	115.3	V1118	V1118-S1310 VanDerWaalsContact CG1-N 3.3Å
1311	K	85.1	Confident	89.7	Confident	176 Å²	176	40.1 Å²	40.1	77%	0.765	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-4.3	-179.1	-62.1	178.2	-177.5	175.3	0	113.5	D1309	D1309-K1311 PolarHBondContact O-N 3.1Å; D1309-K1311 VanDerWaalsContact O-N 3.11Å; D1309-K1311 PolarHBondContact OD1-N 2.99Å; D1309-K1311 VanDerWaalsContact OD1-N 3.1Å
1312	S	85.9	Confident	89.6	Confident	13 Å²	13	42.9 Å²	42.9	9%	0.091	22%	0.218	C	C	.	.			trans	-67.6	143.8	-173.9	163.6	0	0	0	0	113.3	D1284 M1289 D1309 V1314 A1315 R1316	D1284-S1312 WeakPolarHBondContact CB-OG 3.27Å; M1289-S1312 WeakPolarHBondContact CE-OG 3.46Å; D1309-S1312 VanDerWaalsContact O-CB 3.26Å; D1309-S1312 WeakPolarHBondContact O-CB 3.36Å; D1309-S1312 PolarHBondContact O-N 3.04Å; D1309-S1312 VanDerWaalsContact O-N 3.11Å; D1309-S1312 PolarHBondContact O-OG 3.3Å; S1312-V1314 VanDerWaalsContact C-N 3.3Å; S1312-V1314 PolarHBondContact O-N 3.37Å; S1312-V1314 PolarHBondContact OG-N 3.08Å; S1312-V1314 VanDerWaalsContact OG-N 3.13Å; S1312-A1315 PolarHBondContact O-N 2.87Å; S1312-A1315 VanDerWaalsContact OG-CB 3.26Å; S1312-A1315 WeakPolarHBondContact OG-CB 3.47Å; S1312-A1315 PolarHBondContact OG-N 2.81Å; S1312-R1316 PolarHBondContact O-N 3.11Å
1313	S	86.8	Confident	89.5	Confident	47.4 Å²	47.4	43 Å²	43	33%	0.331	22%	0.218	S	C	.	.	H	α-helix	trans	-64.7	-34.8	169.8	52	0	0	0	0	112.2	M1289 A1315 R1316 N1317	M1289-S1313 WeakPolarHBondContact CE-OG 3Å; S1313-A1315 VanDerWaalsContact C-N 3.33Å; S1313-A1315 PolarHBondContact O-N 3.36Å; S1313-R1316 PolarHBondContact O-N 3.13Å; S1313-N1317 VanDerWaalsContact O-CG 3.31Å; S1313-N1317 PolarHBondContact O-N 3.1Å
1314	V	87.5	Confident	89.5	Confident	5.6 Å²	5.6	42.1 Å²	42.1	3%	0.034	22%	0.216	C	C	.	.	H	α-helix	trans	-61.7	-43.5	176.7	175.7	0	0	0	0	110.7	D1284 M1289 L1291 S1312 R1316 N1317 L1318	D1284-V1314 HydrophobicContact CB-CB 4.34Å; D1284-V1314 HydrophobicContact CB-CG2 4.38Å; M1289-V1314 HydrophobicContact CE-CB 4.09Å; M1289-V1314 HydrophobicContact CE-CG2 3.43Å; M1289-V1314 VanDerWaalsContact CE-CG2 3.43Å; M1289-V1314 HydrophobicContact CG-CG2 3.78Å; M1289-V1314 HydrophobicContact SD-CG2 4.18Å; L1291-V1314 HydrophobicContact CD1-CG1 4.31Å; L1291-V1314 HydrophobicContact CD2-CG1 3.94Å; L1291-V1314 HydrophobicContact CG-CG1 4.28Å; S1312-V1314 VanDerWaalsContact C-N 3.3Å; S1312-V1314 PolarHBondContact O-N 3.37Å; S1312-V1314 PolarHBondContact OG-N 3.08Å; S1312-V1314 VanDerWaalsContact OG-N 3.13Å; V1314-R1316 VanDerWaalsContact C-N 3.34Å; V1314-R1316 PolarHBondContact O-N 3.2Å; V1314-N1317 PolarHBondContact O-N 3.24Å; V1314-L1318 HydrophobicContact CG1-CD1 3.84Å; V1314-L1318 HydrophobicContact CG1-CG 4.39Å; V1314-L1318 WeakPolarHBondContact O-CB 3.38Å; V1314-L1318 WeakPolarHBondContact O-CG 3.39Å; V1314-L1318 PolarHBondContact O-N 3.01Å
1315	A	88	Confident	89.4	Confident	6.4 Å²	6.4	44.4 Å²	44.4	5%	0.053	23%	0.227	C	C	.	.	H	α-helix	trans	-60.2	-44.5	176.1	0	0	0	0	0	111.8	L1116 V1118 C1308 S1312 S1313 N1317 L1318 C1319	L1116-A1315 HydrophobicContact CD2-CB 4.37Å; V1118-A1315 HydrophobicContact CG1-CB 4.18Å; V1118-A1315 HydrophobicContact CG2-CB 4.27Å; C1308-A1315 HydrophobicContact CB-CB 3.99Å; S1312-A1315 PolarHBondContact O-N 2.87Å; S1312-A1315 VanDerWaalsContact OG-CB 3.26Å; S1312-A1315 WeakPolarHBondContact OG-CB 3.47Å; S1312-A1315 PolarHBondContact OG-N 2.81Å; S1313-A1315 VanDerWaalsContact C-N 3.33Å; S1313-A1315 PolarHBondContact O-N 3.36Å; A1315-N1317 PolarHBondContact O-N 2.94Å; A1315-L1318 PolarHBondContact O-N 3.36Å; A1315-C1319 VanDerWaalsContact O-CB 3.28Å; A1315-C1319 WeakPolarHBondContact O-CB 3.32Å; A1315-C1319 PolarHBondContact O-N 3.07Å; A1315-C1319 PolarHBondContact O-SG 2.96Å
1316	R	88.3	Confident	89.3	Confident	152.8 Å²	152.8	48.5 Å²	48.5	58%	0.577	25%	0.248	S	C	*	.	H	α-helix	trans	-61.3	-44	175.9	-76.5	-176.6	-78.2	117.9	-7.1	112.3	S1312 S1313 V1314 C1319 N1320	S1312-R1316 PolarHBondContact O-N 3.11Å; S1313-R1316 PolarHBondContact O-N 3.13Å; V1314-R1316 VanDerWaalsContact C-N 3.34Å; V1314-R1316 PolarHBondContact O-N 3.2Å; R1316-C1319 PolarHBondContact O-N 3.32Å; R1316-N1320 PolarHBondContact O-N 3.25Å; R1316-N1320 PolarHBondContact O-ND2 3.34Å
1317	N	87.7	Confident	89.2	Confident	84.2 Å²	84.2	49.5 Å²	49.5	45%	0.45	25%	0.254	S	S	.	.	H	α-helix	trans	-67.6	-40.3	-179.9	-70.1	-11.5	0	0	0	112.3	L1291 S1313 V1314 A1315 N1320	L1291-N1317 HydrophobicContact CD1-CB 3.81Å; S1313-N1317 VanDerWaalsContact O-CG 3.31Å; S1313-N1317 PolarHBondContact O-N 3.1Å; V1314-N1317 PolarHBondContact O-N 3.24Å; A1315-N1317 PolarHBondContact O-N 2.94Å; N1317-N1320 WeakPolarHBondContact O-CB 3.21Å; N1317-N1320 PolarHBondContact O-N 2.82Å
1318	L	89.2	Confident	89.1	Confident	0.2 Å²	0.2	53.8 Å²	53.8	0%	0.001	28%	0.28	C	S	.	.	H	α-helix	trans	-68.1	-39.1	176.4	-75	171.1	0	0	0	112.3	L1116 L1291 L1294 L1306 V1314 A1315 N1320 R1321 C1324	L1116-L1318 HydrophobicContact CD1-CD1 3.84Å; L1116-L1318 HydrophobicContact CD2-CB 3.88Å; L1116-L1318 HydrophobicContact CD2-CD1 4.39Å; L1291-L1318 HydrophobicContact CD1-CD2 3.93Å; L1291-L1318 HydrophobicContact CD1-CG 3.81Å; L1291-L1318 HydrophobicContact CD2-CD1 4.31Å; L1291-L1318 HydrophobicContact CD2-CD2 4.02Å; L1291-L1318 HydrophobicContact CD2-CG 4.2Å; L1291-L1318 HydrophobicContact CG-CD2 4.44Å; L1294-L1318 HydrophobicContact CD2-CD2 3.89Å; L1306-L1318 HydrophobicContact CD1-CD1 3.61Å; L1306-L1318 HydrophobicContact CD1-CD2 4.18Å; V1314-L1318 HydrophobicContact CG1-CD1 3.84Å; V1314-L1318 HydrophobicContact CG1-CG 4.39Å; V1314-L1318 WeakPolarHBondContact O-CB 3.38Å; V1314-L1318 WeakPolarHBondContact O-CG 3.39Å; V1314-L1318 PolarHBondContact O-N 3.01Å; A1315-L1318 PolarHBondContact O-N 3.36Å; L1318-N1320 PolarHBondContact O-N 2.99Å; L1318-N1320 VanDerWaalsContact O-N 3.17Å; L1318-R1321 VanDerWaalsContact O-CB 3.32Å; L1318-R1321 WeakPolarHBondContact O-CB 3.35Å; L1318-R1321 PolarHBondContact O-N 3.32Å; L1318-C1324 VanDerWaalsContact O-CB 3.24Å; L1318-C1324 WeakPolarHBondContact O-CB 3.27Å; L1318-C1324 PolarHBondContact O-SG 2.68Å; L1318-C1324 VanDerWaalsContact O-SG 3.41Å
1319	C	88.1	Confident	89	Confident	56.4 Å²	56.4	54.6 Å²	54.6	38%	0.381	29%	0.285	S	S	.	.	H	α-helix	trans	-60	-26.5	176.1	-90.8	0	0	0	0	113.3	A1315 R1316 R1321	A1315-C1319 VanDerWaalsContact O-CB 3.28Å; A1315-C1319 WeakPolarHBondContact O-CB 3.32Å; A1315-C1319 PolarHBondContact O-N 3.07Å; A1315-C1319 PolarHBondContact O-SG 2.96Å; R1316-C1319 PolarHBondContact O-N 3.32Å; C1319-R1321 VanDerWaalsContact C-N 3.26Å; C1319-R1321 PolarHBondContact O-N 3.06Å
1320	N	87.2	Confident	88.9	Confident	133.8 Å²	133.8	55.5 Å²	55.5	72%	0.716	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-13.5	176.3	-68.7	-18.5	0	0	0	113.2	R1316 N1317 L1318	R1316-N1320 PolarHBondContact O-N 3.25Å; R1316-N1320 PolarHBondContact O-ND2 3.34Å; N1317-N1320 WeakPolarHBondContact O-CB 3.21Å; N1317-N1320 PolarHBondContact O-N 2.82Å; L1318-N1320 PolarHBondContact O-N 2.99Å; L1318-N1320 VanDerWaalsContact O-N 3.17Å
1321	R	88.5	Confident	88.9	Confident	49 Å²	49	54.4 Å²	54.4	19%	0.185	29%	0.293	C	S	.	.	S	Bend	trans	-78.4	133.4	177.5	-61.7	-178.2	56.5	125.5	-6	111.2	L1294 P1295 Q1296 L1318 C1319 D1323 C1324	L1294-R1321 PolarHBondContact O-NH1 3.14Å; P1295-R1321 PolarHBondContact O-NH1 3.21Å; P1295-R1321 PolarHBondContact O-NH2 3.02Å; Q1296-R1321 PolarHBondContact O-NH2 3.13Å; Q1296-R1321 VanDerWaalsContact O-NH2 3.13Å; L1318-R1321 VanDerWaalsContact O-CB 3.32Å; L1318-R1321 WeakPolarHBondContact O-CB 3.35Å; L1318-R1321 PolarHBondContact O-N 3.32Å; C1319-R1321 VanDerWaalsContact C-N 3.26Å; C1319-R1321 PolarHBondContact O-N 3.06Å; R1321-D1323 VanDerWaalsContact C-N 3.29Å; R1321-D1323 VanDerWaalsContact CB-OD1 3.25Å; R1321-D1323 WeakPolarHBondContact CB-OD1 3.43Å; R1321-D1323 IonicContact CZ-OD1 3.22Å; R1321-D1323 IonicContact CZ-OD2 3.4Å; R1321-D1323 IonicContact NE-OD1 3.32Å; R1321-D1323 PolarHBondContact NE-OD1 3.29Å; R1321-D1323 IonicContact NE-OD2 3.21Å; R1321-D1323 IonicContact NH2-OD1 3.25Å; R1321-D1323 PolarHBondContact NH2-OD1 3.21Å; R1321-D1323 IonicContact NH2-OD2 3.32Å; R1321-D1323 PolarHBondContact NH2-OD2 3.04Å; R1321-D1323 PolarHBondContact O-N 3.11Å; R1321-C1324 HydrophobicContact CB-CB 4.14Å; R1321-C1324 WeakPolarHBondContact O-CB 3.31Å; R1321-C1324 PolarHBondContact O-N 3.06Å; R1321-C1324 VanDerWaalsContact O-N 3.13Å
1322	I	88.6	Confident	89	Confident	59.4 Å²	59.4	46.7 Å²	46.7	31%	0.305	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-29.7	-179	15.7	170.6	0	0	0	112.7	R1078 A1082 T1085 R1086 C1324	R1078-I1322 VanDerWaalsContact CZ-O 3.27Å; R1078-I1322 PolarHBondContact NE-O 3.11Å; R1078-I1322 PolarHBondContact NH2-O 3.17Å; A1082-I1322 HydrophobicContact CB-CG1 4.38Å; A1082-I1322 HydrophobicContact CB-CG2 4.05Å; T1085-I1322 HydrophobicContact CG2-CD1 4.39Å; T1085-I1322 HydrophobicContact CG2-CG2 4.32Å; R1086-I1322 HydrophobicContact CG-CD1 3.53Å; R1086-I1322 VanDerWaalsContact CG-CD1 3.48Å; I1322-C1324 VanDerWaalsContact C-N 3.33Å; I1322-C1324 PolarHBondContact O-N 3.23Å
1323	D	90.3	Very high	89.1	Confident	0.8 Å²	0.8	48.8 Å²	48.8	0%	0.004	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	0.5	179.2	57.6	-5.6	0	0	0	114.1	A1082 R1086 S1113 I1114 R1321	A1082-D1323 HydrophobicContact CB-CB 4.03Å; R1086-D1323 IonicContact CZ-OD2 3.41Å; R1086-D1323 IonicContact NH2-OD2 3.51Å; R1086-D1323 PolarHBondContact NH2-OD2 2.94Å; S1113-D1323 WeakPolarHBondContact CA-O 3.3Å; S1113-D1323 WeakPolarHBondContact CB-O 3.43Å; I1114-D1323 PolarHBondContact N-O 3.18Å; R1321-D1323 VanDerWaalsContact C-N 3.29Å; R1321-D1323 VanDerWaalsContact CB-OD1 3.25Å; R1321-D1323 WeakPolarHBondContact CB-OD1 3.43Å; R1321-D1323 IonicContact CZ-OD1 3.22Å; R1321-D1323 IonicContact CZ-OD2 3.4Å; R1321-D1323 IonicContact NE-OD1 3.32Å; R1321-D1323 PolarHBondContact NE-OD1 3.29Å; R1321-D1323 IonicContact NE-OD2 3.21Å; R1321-D1323 IonicContact NH2-OD1 3.25Å; R1321-D1323 PolarHBondContact NH2-OD1 3.21Å; R1321-D1323 IonicContact NH2-OD2 3.32Å; R1321-D1323 PolarHBondContact NH2-OD2 3.04Å; R1321-D1323 PolarHBondContact O-N 3.11Å
1324	C	92.6	Very high	89	Confident	6 Å²	6	50.3 Å²	50.3	4%	0.041	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	136.8	179.5	-171.6	0	0	0	0	112.5	R1078 I1114 L1318 R1321 I1322	R1078-C1324 VanDerWaalsContact CZ-O 3.25Å; R1078-C1324 PolarHBondContact NE-O 3.08Å; R1078-C1324 VanDerWaalsContact NE-O 3.13Å; R1078-C1324 PolarHBondContact NH2-O 3.08Å; R1078-C1324 VanDerWaalsContact NH2-O 3.11Å; I1114-C1324 HydrophobicContact CB-CB 4.42Å; I1114-C1324 CarbonylContact O-C 3.52Å; I1114-C1324 WeakPolarHBondContact O-CA 3.26Å; L1318-C1324 VanDerWaalsContact O-CB 3.24Å; L1318-C1324 WeakPolarHBondContact O-CB 3.27Å; L1318-C1324 PolarHBondContact O-SG 2.68Å; L1318-C1324 VanDerWaalsContact O-SG 3.41Å; R1321-C1324 HydrophobicContact CB-CB 4.14Å; R1321-C1324 WeakPolarHBondContact O-CB 3.31Å; R1321-C1324 PolarHBondContact O-N 3.06Å; R1321-C1324 VanDerWaalsContact O-N 3.13Å; I1322-C1324 VanDerWaalsContact C-N 3.33Å; I1322-C1324 PolarHBondContact O-N 3.23Å
1325	Q	93.1	Very high	88.7	Confident	49.2 Å²	49.2	56 Å²	56	23%	0.23	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	123.1	171.2	-179.9	133	0.8	0	0	109.3	S1074 L1075 R1078 I1114 L1115 L1116	S1074-Q1325 PolarHBondContact OG-NE2 2.98Å; S1074-Q1325 PolarHBondContact OG-OE1 3.22Å; S1074-Q1325 VanDerWaalsContact OG-OE1 3.11Å; L1075-Q1325 HydrophobicContact CD2-CB 3.89Å; L1075-Q1325 HydrophobicContact CD2-CG 4.47Å; R1078-Q1325 HydrophobicContact CG-CB 4.37Å; I1114-Q1325 PolarHBondContact O-N 2.93Å; L1115-Q1325 HydrophobicContact CD1-CB 4.46Å; L1115-Q1325 HydrophobicContact CD1-CG 4.34Å; L1116-Q1325 PolarHBondContact N-O 3.08Å
1326	L	93.2	Very high	88.5	Confident	85.4 Å²	85.4	56.9 Å²	56.9	45%	0.447	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	130.5	179.6	178.2	66.1	0	0	0	110.9	L1116 V1118 T1328	L1116-L1326 HydrophobicContact CB-CD1 4.35Å; L1116-L1326 HydrophobicContact CD2-CD1 4.03Å; L1116-L1326 HydrophobicContact CG-CD1 4.19Å; V1118-L1326 HydrophobicContact CB-CD1 3.98Å; V1118-L1326 HydrophobicContact CG1-CD1 3.67Å; V1118-L1326 HydrophobicContact CG2-CD1 3.37Å; V1118-L1326 VanDerWaalsContact CG2-CD1 3.49Å; V1118-L1326 HydrophobicContact CG2-CG 4.2Å; L1326-T1328 HydrophobicContact CD1-CG2 4.45Å; L1326-T1328 HydrophobicContact CD2-CG2 4.29Å; L1326-T1328 HydrophobicContact CG-CG2 4.26Å
1327	L	93.6	Very high	88.5	Confident	21.8 Å²	21.8	51.9 Å²	51.9	11%	0.114	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	117.4	167.9	177.8	78.9	0	0	0	109.3	E1067 V1068 A1071 L1115 L1116 I1117 V1118 Y1128 V1329	E1067-L1327 HydrophobicContact CB-CD1 4.18Å; E1067-L1327 HydrophobicContact CG-CD1 3.64Å; E1067-L1327 WeakPolarHBondContact O-CD1 3.47Å; V1068-L1327 HydrophobicContact CB-CD2 4.1Å; V1068-L1327 HydrophobicContact CG2-CD1 4.33Å; V1068-L1327 HydrophobicContact CG2-CD2 3.92Å; A1071-L1327 HydrophobicContact CB-CB 4.39Å; A1071-L1327 HydrophobicContact CB-CD1 4.11Å; A1071-L1327 HydrophobicContact CB-CD2 3.99Å; A1071-L1327 HydrophobicContact CB-CG 4.44Å; L1115-L1327 HydrophobicContact CD1-CB 4.11Å; L1116-L1327 PolarHBondContact O-N 3.18Å; I1117-L1327 CarbonylContact C-O 3.56Å; I1117-L1327 WeakPolarHBondContact CA-O 3.36Å; I1117-L1327 HydrophobicContact CG1-CB 4.49Å; I1117-L1327 HydrophobicContact CG1-CD2 4.33Å; I1117-L1327 HydrophobicContact CG2-CD2 4.09Å; V1118-L1327 PolarHBondContact N-O 3.18Å; Y1128-L1327 HydrophobicContact CD1-CD2 4.15Å; Y1128-L1327 HydrophobicContact CE1-CD2 4.16Å; L1327-V1329 HydrophobicContact CD2-CG2 4.07Å
1328	T	92.7	Very high	88.4	Confident	90 Å²	90	48 Å²	48	55%	0.552	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.4	119.5	175.6	37.5	0	0	0	0	110.5	V1118 L1326 S1330	V1118-T1328 HydrophobicContact CB-CG2 4.42Å; V1118-T1328 HydrophobicContact CG2-CG2 4.21Å; V1118-T1328 WeakPolarHBondContact CG2-OG1 3.45Å; V1118-T1328 CarbonylContact O-C 3.41Å; V1118-T1328 VanDerWaalsContact O-CA 3.31Å; V1118-T1328 WeakPolarHBondContact O-CA 3.28Å; L1326-T1328 HydrophobicContact CD1-CG2 4.45Å; L1326-T1328 HydrophobicContact CD2-CG2 4.29Å; L1326-T1328 HydrophobicContact CG-CG2 4.26Å; T1328-S1330 PolarHBondContact O-N 3.13Å
1329	V	89.6	Confident	88.1	Confident	16.6 Å²	16.6	50.4 Å²	50.4	10%	0.101	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-67.6	117.5	176.1	179.5	0	0	0	0	109.2	I1117 V1118 S1123 K1125 Y1128 L1327	I1117-V1329 HydrophobicContact CG2-CG2 3.64Å; V1118-V1329 PolarHBondContact O-N 3.15Å; S1123-V1329 WeakPolarHBondContact O-CG1 3.34Å; K1125-V1329 HydrophobicContact CG-CG2 4.23Å; Y1128-V1329 HydrophobicContact CD1-CG2 4.37Å; Y1128-V1329 HydrophobicContact CD2-CG1 4.22Å; Y1128-V1329 HydrophobicContact CD2-CG2 4.22Å; Y1128-V1329 HydrophobicContact CE1-CG2 4.36Å; Y1128-V1329 HydrophobicContact CE2-CB 4.41Å; Y1128-V1329 HydrophobicContact CE2-CG1 3.61Å; Y1128-V1329 HydrophobicContact CE2-CG2 4.13Å; Y1128-V1329 HydrophobicContact CG-CG2 4.29Å; L1327-V1329 HydrophobicContact CD2-CG2 4.07Å
1330	S	86	Confident	87.8	Confident	46.2 Å²	46.2	48.5 Å²	48.5	32%	0.323	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-81.9	157.9	177.9	59.9	0	0	0	0	111.5	R1063 H1064 E1067 T1328	R1063-S1330 PolarHBondContact NH1-OG 3.23Å; R1063-S1330 PolarHBondContact NH2-OG 3.01Å; R1063-S1330 VanDerWaalsContact NH2-OG 3.13Å; H1064-S1330 PolarHBondContact CE1-O 2.98Å; H1064-S1330 PolarHBondContact NE2-N 3.47Å; H1064-S1330 PolarHBondContact NE2-O 3.47Å; H1064-S1330 PolarHBondContact NE2-OG 2.86Å; E1067-S1330 PolarHBondContact OE2-OG 2.78Å; T1328-S1330 PolarHBondContact O-N 3.13Å
1331	G	85.8	Confident	87.7	Confident	43 Å²	43	42.2 Å²	42.2	44%	0.443	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-69.1	159.9	173.7	0	0	0	0	0	112.3	R1063 T1333	R1063-G1331 PolarHBondContact NH2-O 3.16Å; G1331-T1333 PolarHBondContact O-N 3.09Å
1332	L	87.3	Confident	87.4	Confident	12.6 Å²	12.6	45.3 Å²	45.3	7%	0.066	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-65	133.7	177.1	-61.9	175.5	0	0	0	111.5	I1060 H1064 E1336 R1337 S1371 P1373 L1376	I1060-L1332 HydrophobicContact CG2-CD1 3.69Å; I1060-L1332 HydrophobicContact CG2-CD2 4.15Å; I1060-L1332 WeakPolarHBondContact O-CD2 3.25Å; H1064-L1332 VanDerWaalsContact CE1-CD2 3.43Å; H1064-L1332 WeakPolarHBondContact CE1-CD2 3.43Å; L1332-E1336 HydrophobicContact CB-CB 4.21Å; L1332-E1336 HydrophobicContact CD2-CB 4.1Å; L1332-R1337 HydrophobicContact CB-CG 3.69Å; L1332-R1337 HydrophobicContact CD1-CG 4.42Å; L1332-R1337 PolarHBondContact O-NE 3.18Å; L1332-R1337 PolarHBondContact O-NH2 2.9Å; L1332-R1337 VanDerWaalsContact O-NH2 3.1Å; L1332-S1371 WeakPolarHBondContact CB-O 3.41Å; L1332-S1371 WeakPolarHBondContact CG-O 3.41Å; L1332-S1371 PolarHBondContact N-O 3.18Å; L1332-P1373 HydrophobicContact CD1-CB 4.37Å; L1332-P1373 HydrophobicContact CD1-CG 3.91Å; L1332-P1373 HydrophobicContact CD2-CG 4.33Å; L1332-P1373 HydrophobicContact CG-CG 4.09Å; L1332-L1376 HydrophobicContact CD1-CD1 3.81Å
1333	T	86.3	Confident	86.8	Confident	57.6 Å²	57.6	45.2 Å²	45.2	35%	0.353	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-67.8	159.6	168.7	61.9	0	0	0	0	110.9	G1331 H1335 E1336 R1337	G1331-T1333 PolarHBondContact O-N 3.09Å; T1333-H1335 VanDerWaalsContact C-N 3.28Å; T1333-H1335 PolarHBondContact O-N 3.31Å; T1333-H1335 VanDerWaalsContact O-N 3.08Å; T1333-E1336 WeakPolarHBondContact CB-OE2 3.28Å; T1333-E1336 WeakPolarHBondContact CG2-OE2 3.35Å; T1333-E1336 PolarHBondContact N-OE2 3.22Å; T1333-E1336 PolarHBondContact O-N 3.11Å; T1333-E1336 VanDerWaalsContact O-N 3.12Å; T1333-E1336 WeakPolarHBondContact OG1-CB 3.4Å; T1333-E1336 VanDerWaalsContact OG1-CD 3.23Å; T1333-E1336 WeakPolarHBondContact OG1-CG 3.28Å; T1333-E1336 PolarHBondContact OG1-N 3.26Å; T1333-E1336 PolarHBondContact OG1-OE2 2.93Å; T1333-R1337 VanDerWaalsContact O-CG 3.26Å; T1333-R1337 WeakPolarHBondContact O-CG 3.45Å; T1333-R1337 PolarHBondContact O-N 3.1Å
1334	T	84.6	Confident	86.2	Confident	79 Å²	79	46.6 Å²	46.6	49%	0.485	27%	0.267	S	S	.	.	H	α-helix	trans	-54.7	-38.4	179.7	45.4	0	0	0	0	113.2	R1337 G1338 I1365	T1334-R1337 WeakPolarHBondContact O-CB 3.46Å; T1334-R1337 PolarHBondContact O-N 3.05Å; T1334-G1338 PolarHBondContact O-N 3.31Å; T1334-G1338 VanDerWaalsContact O-N 3.14Å; T1334-I1365 HydrophobicContact CG2-CG2 4.38Å
1335	H	81.2	Confident	85.5	Confident	125 Å²	125	46.6 Å²	46.6	58%	0.579	27%	0.267	S	S	*	.	H	α-helix	trans	-66.7	-45.4	174.5	-70.3	-64.4	0	0	0	112.9	S542 T582 E747 T1333 R1337 G1338 A1339	S542-H1335 PolarHBondContact N-CE1 3.34Å; T582-H1335 WeakPolarHBondContact CB-NE2 3.3Å; T582-H1335 WeakPolarHBondContact CG2-CD2 3.35Å; T582-H1335 WeakPolarHBondContact CG2-CE1 3.44Å; T582-H1335 WeakPolarHBondContact CG2-NE2 3.47Å; T582-H1335 PolarHBondContact OG1-CE1 2.86Å; T582-H1335 PolarHBondContact OG1-NE2 3.02Å; E747-H1335 IonicContact OE1-CE1 3.87Å; T1333-H1335 VanDerWaalsContact C-N 3.28Å; T1333-H1335 PolarHBondContact O-N 3.31Å; T1333-H1335 VanDerWaalsContact O-N 3.08Å; H1335-R1337 VanDerWaalsContact C-N 3.31Å; H1335-R1337 PolarHBondContact O-N 3.36Å; H1335-G1338 PolarHBondContact O-N 3.04Å; H1335-G1338 VanDerWaalsContact O-N 3.08Å; H1335-A1339 WeakPolarHBondContact O-CB 3.5Å; H1335-A1339 PolarHBondContact O-N 3.39Å
1336	E	84.8	Confident	84.3	Confident	26.8 Å²	26.8	46 Å²	46	13%	0.125	27%	0.274	C	S	.	.	H	α-helix	trans	-63.4	-38	177.7	-72.2	165.2	156	0	0	111.3	R1063 H1064 L1332 T1333 G1338 A1339 A1340	R1063-E1336 VanDerWaalsContact CB-OE1 3.32Å; R1063-E1336 WeakPolarHBondContact CB-OE1 3.4Å; R1063-E1336 IonicContact CZ-OE1 3.75Å; R1063-E1336 IonicContact CZ-OE2 3.01Å; R1063-E1336 IonicContact NE-OE1 3.25Å; R1063-E1336 PolarHBondContact NE-OE1 3.27Å; R1063-E1336 IonicContact NE-OE2 3.01Å; R1063-E1336 IonicContact NH2-OE1 3.06Å; R1063-E1336 PolarHBondContact NH2-OE1 3.21Å; R1063-E1336 IonicContact NH2-OE2 3.55Å; R1063-E1336 PolarHBondContact NH2-OE2 3.2Å; H1064-E1336 VanDerWaalsContact CE1-CD 3.48Å; H1064-E1336 IonicContact CE1-OE1 3.87Å; H1064-E1336 PolarHBondContact CE1-OE1 3.1Å; H1064-E1336 IonicContact CE1-OE2 3.47Å; H1064-E1336 IonicContact ND1-OE1 3.85Å; H1064-E1336 IonicContact NE2-OE1 3.61Å; H1064-E1336 IonicContact NE2-OE2 3.32Å; L1332-E1336 HydrophobicContact CB-CB 4.21Å; L1332-E1336 HydrophobicContact CD2-CB 4.1Å; T1333-E1336 WeakPolarHBondContact CB-OE2 3.28Å; T1333-E1336 WeakPolarHBondContact CG2-OE2 3.35Å; T1333-E1336 PolarHBondContact N-OE2 3.22Å; T1333-E1336 PolarHBondContact O-N 3.11Å; T1333-E1336 VanDerWaalsContact O-N 3.12Å; T1333-E1336 WeakPolarHBondContact OG1-CB 3.4Å; T1333-E1336 VanDerWaalsContact OG1-CD 3.23Å; T1333-E1336 WeakPolarHBondContact OG1-CG 3.28Å; T1333-E1336 PolarHBondContact OG1-N 3.26Å; T1333-E1336 PolarHBondContact OG1-OE2 2.93Å; E1336-G1338 VanDerWaalsContact C-N 3.31Å; E1336-G1338 PolarHBondContact O-N 3.32Å; E1336-A1339 PolarHBondContact O-N 3.07Å; E1336-A1340 VanDerWaalsContact O-CB 3.28Å; E1336-A1340 WeakPolarHBondContact O-CB 3.37Å; E1336-A1340 PolarHBondContact O-N 2.97Å
1337	R	88.9	Confident	82.8	Confident	47.2 Å²	47.2	48 Å²	48	18%	0.178	28%	0.279	C	S	.	.	H	α-helix	trans	-59.6	-46	173.3	-64.3	174.2	-158.6	-176	5.3	111.4	L1332 T1333 T1334 H1335 A1340 V1341 I1365 A1370 L1376	L1332-R1337 HydrophobicContact CB-CG 3.69Å; L1332-R1337 HydrophobicContact CD1-CG 4.42Å; L1332-R1337 PolarHBondContact O-NE 3.18Å; L1332-R1337 PolarHBondContact O-NH2 2.9Å; L1332-R1337 VanDerWaalsContact O-NH2 3.1Å; T1333-R1337 VanDerWaalsContact O-CG 3.26Å; T1333-R1337 WeakPolarHBondContact O-CG 3.45Å; T1333-R1337 PolarHBondContact O-N 3.1Å; T1334-R1337 WeakPolarHBondContact O-CB 3.46Å; T1334-R1337 PolarHBondContact O-N 3.05Å; H1335-R1337 VanDerWaalsContact C-N 3.31Å; H1335-R1337 PolarHBondContact O-N 3.36Å; R1337-A1340 WeakPolarHBondContact O-CB 3.28Å; R1337-A1340 PolarHBondContact O-N 3.22Å; R1337-V1341 WeakPolarHBondContact O-CG2 3.33Å; R1337-V1341 PolarHBondContact O-N 3.29Å; R1337-V1341 VanDerWaalsContact O-N 3.1Å; R1337-I1365 HydrophobicContact CB-CB 4.44Å; R1337-I1365 HydrophobicContact CB-CG1 4.07Å; R1337-I1365 HydrophobicContact CB-CG2 3.93Å; R1337-I1365 HydrophobicContact CG-CG2 4.45Å; R1337-I1365 PolarHBondContact NH1-O 3.01Å; R1337-I1365 VanDerWaalsContact NH1-O 3.13Å; R1337-A1370 VanDerWaalsContact CD-O 3.28Å; R1337-A1370 WeakPolarHBondContact CD-O 3.35Å; R1337-A1370 VanDerWaalsContact CG-O 3.27Å; R1337-A1370 WeakPolarHBondContact CG-O 3.38Å; R1337-L1376 HydrophobicContact CB-CD1 4.01Å; R1337-L1376 HydrophobicContact CG-CD1 4.14Å
1338	G	85.1	Confident	81.3	Confident	1.8 Å²	1.8	49.2 Å²	49.2	2%	0.019	28%	0.283	C	S	.	.	H	α-helix	trans	-65.4	-41.7	177.4	0	0	0	0	0	113.1	T1334 H1335 E1336 A1340 V1341 R1342 I1365	T1334-G1338 PolarHBondContact O-N 3.31Å; T1334-G1338 VanDerWaalsContact O-N 3.14Å; H1335-G1338 PolarHBondContact O-N 3.04Å; H1335-G1338 VanDerWaalsContact O-N 3.08Å; E1336-G1338 VanDerWaalsContact C-N 3.31Å; E1336-G1338 PolarHBondContact O-N 3.32Å; G1338-A1340 VanDerWaalsContact C-N 3.32Å; G1338-A1340 PolarHBondContact O-N 3.07Å; G1338-V1341 PolarHBondContact O-N 2.98Å; G1338-R1342 VanDerWaalsContact C-NH1 3.33Å; G1338-R1342 WeakPolarHBondContact O-CB 3.35Å; G1338-R1342 VanDerWaalsContact O-CG 3.3Å; G1338-R1342 WeakPolarHBondContact O-CG 3.29Å; G1338-R1342 PolarHBondContact O-N 3.13Å; G1338-R1342 VanDerWaalsContact O-N 3.13Å; G1338-R1342 PolarHBondContact O-NH1 3.19Å; G1338-I1365 VanDerWaalsContact CA-CD1 3.44Å
1339	A	81.7	Confident	79.8	Confident	50 Å²	50	47.3 Å²	47.3	41%	0.413	28%	0.28	S	S	.	.	H	α-helix	trans	-62.5	-41.3	173.6	0	0	0	0	0	112	A1059 H1335 E1336 V1341 R1342 S1343	A1059-A1339 WeakPolarHBondContact O-CB 3.49Å; H1335-A1339 WeakPolarHBondContact O-CB 3.5Å; H1335-A1339 PolarHBondContact O-N 3.39Å; E1336-A1339 PolarHBondContact O-N 3.07Å; A1339-V1341 PolarHBondContact O-N 2.98Å; A1339-R1342 PolarHBondContact O-N 3.04Å; A1339-S1343 VanDerWaalsContact O-CB 3.27Å; A1339-S1343 WeakPolarHBondContact O-CB 3.35Å; A1339-S1343 PolarHBondContact O-N 3Å
1340	A	83	Confident	78.8	Confident	17.4 Å²	17.4	48.4 Å²	48.4	14%	0.144	28%	0.284	C	S	.	.	H	α-helix	trans	-61.9	-47.8	177.1	0	0	0	0	0	111.9	I1060 E1336 R1337 G1338 R1342 S1343 L1344 L1376	I1060-A1340 HydrophobicContact CB-CB 4.02Å; I1060-A1340 HydrophobicContact CD1-CB 4.49Å; I1060-A1340 HydrophobicContact CG1-CB 3.65Å; I1060-A1340 HydrophobicContact CG2-CB 3.82Å; E1336-A1340 VanDerWaalsContact O-CB 3.28Å; E1336-A1340 WeakPolarHBondContact O-CB 3.37Å; E1336-A1340 PolarHBondContact O-N 2.97Å; R1337-A1340 WeakPolarHBondContact O-CB 3.28Å; R1337-A1340 PolarHBondContact O-N 3.22Å; G1338-A1340 VanDerWaalsContact C-N 3.32Å; G1338-A1340 PolarHBondContact O-N 3.07Å; A1340-R1342 VanDerWaalsContact C-N 3.34Å; A1340-R1342 PolarHBondContact O-N 3.34Å; A1340-S1343 PolarHBondContact O-N 2.96Å; A1340-L1344 VanDerWaalsContact O-CB 3.25Å; A1340-L1344 WeakPolarHBondContact O-CB 3.35Å; A1340-L1344 VanDerWaalsContact O-CG 3.27Å; A1340-L1344 WeakPolarHBondContact O-CG 3.3Å; A1340-L1344 PolarHBondContact O-N 3.12Å; A1340-L1376 HydrophobicContact CB-CD1 4.02Å
1341	V	84.9	Confident	78.2	Confident	2 Å²	2	51 Å²	51	1%	0.012	30%	0.298	C	S	.	.	H	α-helix	trans	-61.5	-45.6	177.5	172.4	0	0	0	0	111.2	R1337 G1338 A1339 S1343 L1344 L1345 L1352 L1361 L1364 L1376	R1337-V1341 WeakPolarHBondContact O-CG2 3.33Å; R1337-V1341 PolarHBondContact O-N 3.29Å; R1337-V1341 VanDerWaalsContact O-N 3.1Å; G1338-V1341 PolarHBondContact O-N 2.98Å; A1339-V1341 PolarHBondContact O-N 2.98Å; V1341-S1343 VanDerWaalsContact C-N 3.31Å; V1341-S1343 PolarHBondContact O-N 3.26Å; V1341-L1344 PolarHBondContact O-N 3.21Å; V1341-L1345 HydrophobicContact CG1-CD1 3.74Å; V1341-L1345 HydrophobicContact CG1-CG 4.4Å; V1341-L1345 WeakPolarHBondContact O-CB 3.39Å; V1341-L1345 WeakPolarHBondContact O-CG 3.32Å; V1341-L1345 PolarHBondContact O-N 3.18Å; V1341-L1352 HydrophobicContact CG1-CD1 3.79Å; V1341-L1352 HydrophobicContact CG1-CG 4.47Å; V1341-L1361 HydrophobicContact CB-CD1 3.8Å; V1341-L1361 HydrophobicContact CG1-CD1 3.55Å; V1341-L1361 VanDerWaalsContact CG1-CD1 3.48Å; V1341-L1361 HydrophobicContact CG2-CD1 4.37Å; V1341-L1364 HydrophobicContact CG1-CD2 3.96Å; V1341-L1364 HydrophobicContact CG2-CD2 3.77Å; V1341-L1364 HydrophobicContact CG2-CG 4.44Å; V1341-L1376 HydrophobicContact CG2-CD1 4.42Å; V1341-L1376 HydrophobicContact CG2-CD2 3.92Å
1342	R	81.3	Confident	77.8	Confident	113.8 Å²	113.8	49.5 Å²	49.5	43%	0.429	28%	0.28	S	S	.	.	H	α-helix	trans	-60.5	-40.8	176.4	-71.5	-179.9	-164.9	110.4	-4.3	112.2	G1338 A1339 A1340 G1346 E1354	G1338-R1342 VanDerWaalsContact C-NH1 3.33Å; G1338-R1342 WeakPolarHBondContact O-CB 3.35Å; G1338-R1342 VanDerWaalsContact O-CG 3.3Å; G1338-R1342 WeakPolarHBondContact O-CG 3.29Å; G1338-R1342 PolarHBondContact O-N 3.13Å; G1338-R1342 VanDerWaalsContact O-N 3.13Å; G1338-R1342 PolarHBondContact O-NH1 3.19Å; A1339-R1342 PolarHBondContact O-N 3.04Å; A1340-R1342 VanDerWaalsContact C-N 3.34Å; A1340-R1342 PolarHBondContact O-N 3.34Å; R1342-G1346 VanDerWaalsContact O-CA 3.26Å; R1342-G1346 WeakPolarHBondContact O-CA 3.36Å; R1342-G1346 PolarHBondContact O-N 3.02Å; R1342-E1354 IonicContact CZ-OE1 3.36Å; R1342-E1354 IonicContact CZ-OE2 3.39Å; R1342-E1354 IonicContact NE-OE1 3.59Å; R1342-E1354 PolarHBondContact NE-OE1 3.3Å; R1342-E1354 IonicContact NE-OE2 3.26Å; R1342-E1354 VanDerWaalsContact NH2-CD 3.3Å; R1342-E1354 IonicContact NH2-OE1 3.25Å; R1342-E1354 PolarHBondContact NH2-OE1 3.16Å; R1342-E1354 IonicContact NH2-OE2 3Å; R1342-E1354 PolarHBondContact NH2-OE2 3.25Å
1343	S	77.1	Confident	77.1	Confident	57.6 Å²	57.6	51.2 Å²	51.2	40%	0.403	29%	0.289	S	S	.	.	H	α-helix	trans	-68.7	-46.1	178.1	-174	0	0	0	0	111.9	A1059 A1339 A1340 V1341 L1345 G1346 K1347	A1059-S1343 WeakPolarHBondContact CB-OG 3.33Å; A1339-S1343 VanDerWaalsContact O-CB 3.27Å; A1339-S1343 WeakPolarHBondContact O-CB 3.35Å; A1339-S1343 PolarHBondContact O-N 3Å; A1340-S1343 PolarHBondContact O-N 2.96Å; V1341-S1343 VanDerWaalsContact C-N 3.31Å; V1341-S1343 PolarHBondContact O-N 3.26Å; S1343-L1345 PolarHBondContact O-N 2.8Å; S1343-G1346 PolarHBondContact O-N 2.86Å; S1343-K1347 VanDerWaalsContact O-CG 3.31Å; S1343-K1347 WeakPolarHBondContact O-CG 3.37Å; S1343-K1347 PolarHBondContact O-N 3.11Å; S1343-K1347 VanDerWaalsContact O-N 3.1Å
1344	L	78.1	Confident	76.5	Confident	30 Å²	30	52.1 Å²	52.1	16%	0.157	29%	0.289	C	S	.	.	H	α-helix	trans	-65.5	-45	-178.7	-74.3	169.2	0	0	0	112.4	I1060 A1340 V1341 Y1348 L1376 K1377 C1380	I1060-L1344 HydrophobicContact CD1-CD1 4.44Å; I1060-L1344 HydrophobicContact CD1-CD2 4.35Å; I1060-L1344 HydrophobicContact CD1-CG 4.38Å; A1340-L1344 VanDerWaalsContact O-CB 3.25Å; A1340-L1344 WeakPolarHBondContact O-CB 3.35Å; A1340-L1344 VanDerWaalsContact O-CG 3.27Å; A1340-L1344 WeakPolarHBondContact O-CG 3.3Å; A1340-L1344 PolarHBondContact O-N 3.12Å; V1341-L1344 PolarHBondContact O-N 3.21Å; L1344-Y1348 VanDerWaalsContact O-CD2 3.25Å; L1344-Y1348 WeakPolarHBondContact O-CD2 3.34Å; L1344-Y1348 VanDerWaalsContact O-CE2 3.29Å; L1344-Y1348 WeakPolarHBondContact O-CE2 3.43Å; L1344-L1376 HydrophobicContact CD1-CB 4.45Å; L1344-K1377 HydrophobicContact CD1-CB 4.45Å; L1344-K1377 HydrophobicContact CD1-CD 4.46Å; L1344-K1377 HydrophobicContact CD2-CD 3.74Å; L1344-C1380 HydrophobicContact CB-CB 4.11Å; L1344-C1380 HydrophobicContact CD1-CB 4.42Å
1345	L	76.4	Confident	75.6	Confident	5 Å²	5	50.8 Å²	50.8	3%	0.026	28%	0.283	C	S	.	.	H	α-helix	trans	-77.3	-35.7	177.1	-66.8	176.2	0	0	0	111.9	V1341 S1343 K1347 Y1348 G1349 K1350 L1352 C1380 R1384	V1341-L1345 HydrophobicContact CG1-CD1 3.74Å; V1341-L1345 HydrophobicContact CG1-CG 4.4Å; V1341-L1345 WeakPolarHBondContact O-CB 3.39Å; V1341-L1345 WeakPolarHBondContact O-CG 3.32Å; V1341-L1345 PolarHBondContact O-N 3.18Å; S1343-L1345 PolarHBondContact O-N 2.8Å; L1345-K1347 VanDerWaalsContact C-N 3.26Å; L1345-K1347 PolarHBondContact O-N 3.08Å; L1345-Y1348 CarbonylContact O-C 3.55Å; L1345-Y1348 WeakPolarHBondContact O-CA 3.32Å; L1345-Y1348 PolarHBondContact O-N 2.97Å; L1345-G1349 PolarHBondContact O-N 3.14Å; L1345-K1350 CarbonylContact C-O 3.55Å; L1345-K1350 VanDerWaalsContact C-O 3.23Å; L1345-K1350 HydrophobicContact CB-CB 4.01Å; L1345-K1350 VanDerWaalsContact CB-O 3.25Å; L1345-K1350 WeakPolarHBondContact CB-O 3.38Å; L1345-K1350 HydrophobicContact CD2-CB 4.36Å; L1345-K1350 VanDerWaalsContact O-CB 3.3Å; L1345-K1350 WeakPolarHBondContact O-CB 3.47Å; L1345-K1350 PolarHBondContact O-N 2.95Å; L1345-L1352 HydrophobicContact CD1-CD1 3.91Å; L1345-L1352 HydrophobicContact CD1-CD2 4.12Å; L1345-L1352 HydrophobicContact CD1-CG 3.62Å; L1345-C1380 HydrophobicContact CD2-CB 3.93Å; L1345-C1380 HydrophobicContact CG-CB 4.24Å; L1345-R1384 HydrophobicContact CD2-CG 4.12Å
1346	G	67.8	Low	74.3	Confident	38 Å²	38	48 Å²	48	39%	0.392	29%	0.288	S	S	.	.	H	α-helix	trans	-61.4	-30.6	178	0	0	0	0	0	113.3	R1342 S1343 Y1348 G1349 K1350	R1342-G1346 VanDerWaalsContact O-CA 3.26Å; R1342-G1346 WeakPolarHBondContact O-CA 3.36Å; R1342-G1346 PolarHBondContact O-N 3.02Å; S1343-G1346 PolarHBondContact O-N 2.86Å; G1346-Y1348 PolarHBondContact O-N 3.03Å; G1346-Y1348 VanDerWaalsContact O-N 3.13Å; G1346-G1349 PolarHBondContact O-N 2.94Å; G1346-K1350 PolarHBondContact N-O 3.16Å
1347	K	63.3	Low	72.7	Confident	127.4 Å²	127.4	56.2 Å²	56.2	55%	0.554	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-27.1	169.6	-113.1	176.8	-179	-172.1	0	113.2	N826 S1343 L1345	N826-K1347 PolarHBondContact OD1-O 3.04Å; S1343-K1347 VanDerWaalsContact O-CG 3.31Å; S1343-K1347 WeakPolarHBondContact O-CG 3.37Å; S1343-K1347 PolarHBondContact O-N 3.11Å; S1343-K1347 VanDerWaalsContact O-N 3.1Å; L1345-K1347 VanDerWaalsContact C-N 3.26Å; L1345-K1347 PolarHBondContact O-N 3.08Å
1348	Y	62.1	Low	71.4	Confident	46.6 Å²	46.6	62.8 Å²	62.8	18%	0.183	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.7	13.6	179.9	-55.2	-72.2	0	0	0	112.8	R814 R815 L1344 L1345 G1346 K1350 R1384	R814-Y1348 PolarHBondContact NH2-O 3.44Å; R815-Y1348 PolarHBondContact NH1-OH 3.29Å; R815-Y1348 PolarHBondContact NH2-OH 3.37Å; L1344-Y1348 VanDerWaalsContact O-CD2 3.25Å; L1344-Y1348 WeakPolarHBondContact O-CD2 3.34Å; L1344-Y1348 VanDerWaalsContact O-CE2 3.29Å; L1344-Y1348 WeakPolarHBondContact O-CE2 3.43Å; L1345-Y1348 CarbonylContact O-C 3.55Å; L1345-Y1348 WeakPolarHBondContact O-CA 3.32Å; L1345-Y1348 PolarHBondContact O-N 2.97Å; G1346-Y1348 PolarHBondContact O-N 3.03Å; G1346-Y1348 VanDerWaalsContact O-N 3.13Å; Y1348-K1350 VanDerWaalsContact C-N 3.27Å; Y1348-K1350 WeakPolarHBondContact O-CG 3.45Å; Y1348-K1350 PolarHBondContact O-N 2.94Å; Y1348-R1384 HydrophobicContact CD2-CG 4.34Å; Y1348-R1384 VanDerWaalsContact CE2-CD 3.45Å; Y1348-R1384 VanDerWaalsContact CE2-NH1 3.31Å; Y1348-R1384 HydrophobicContact CG-CG 4.35Å; Y1348-R1384 VanDerWaalsContact CZ-NH1 3.28Å; Y1348-R1384 VanDerWaalsContact CZ-NH2 3.31Å; Y1348-R1384 PolarHBondContact OH-NH1 3.1Å; Y1348-R1384 VanDerWaalsContact OH-NH1 3.09Å
1349	G	59.8	Low	70.9	Confident	48.8 Å²	48.8	64.8 Å²	64.8	50%	0.503	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	68	15.1	-175.8	0	0	0	0	0	114.4	L1345 G1346	L1345-G1349 PolarHBondContact O-N 3.14Å; G1346-G1349 PolarHBondContact O-N 2.94Å
1350	K	69	Low	70.8	Confident	39.8 Å²	39.8	63.6 Å²	63.6	17%	0.173	35%	0.345	C	S	.	.			trans	-97	137	-176.9	-66.8	-171.9	169.8	-164.6	0	110.7	W832 L1345 G1346 Y1348 R1384 Y1386 Y1389	W832-K1350 HydrophobicContact CD2-CD 4.04Å; W832-K1350 HydrophobicContact CD2-CG 4.32Å; W832-K1350 HydrophobicContact CE3-CB 3.63Å; W832-K1350 HydrophobicContact CE3-CD 3.79Å; W832-K1350 HydrophobicContact CE3-CG 3.85Å; W832-K1350 VanDerWaalsContact CE3-NZ 3.33Å; W832-K1350 HydrophobicContact CH2-CB 3.14Å; W832-K1350 HydrophobicContact CH2-CD 3.64Å; W832-K1350 HydrophobicContact CH2-CG 3.09Å; W832-K1350 HydrophobicContact CZ2-CB 4.16Å; W832-K1350 HydrophobicContact CZ2-CD 3.67Å; W832-K1350 HydrophobicContact CZ2-CG 4.1Å; W832-K1350 HydrophobicContact CZ3-CB 3.67Å; W832-K1350 HydrophobicContact CZ3-CD 3.38Å; W832-K1350 HydrophobicContact CZ3-CG 3.44Å; L1345-K1350 CarbonylContact C-O 3.55Å; L1345-K1350 VanDerWaalsContact C-O 3.23Å; L1345-K1350 HydrophobicContact CB-CB 4.01Å; L1345-K1350 VanDerWaalsContact CB-O 3.25Å; L1345-K1350 WeakPolarHBondContact CB-O 3.38Å; L1345-K1350 HydrophobicContact CD2-CB 4.36Å; L1345-K1350 VanDerWaalsContact O-CB 3.3Å; L1345-K1350 WeakPolarHBondContact O-CB 3.47Å; L1345-K1350 PolarHBondContact O-N 2.95Å; G1346-K1350 PolarHBondContact N-O 3.16Å; Y1348-K1350 VanDerWaalsContact C-N 3.27Å; Y1348-K1350 WeakPolarHBondContact O-CG 3.45Å; Y1348-K1350 PolarHBondContact O-N 2.94Å; K1350-R1384 HydrophobicContact CD-CB 4.48Å; K1350-R1384 HydrophobicContact CD-CG 4.26Å; K1350-R1384 VanDerWaalsContact NZ-CG 3.29Å; K1350-R1384 PolarHBondContact NZ-O 3.1Å; K1350-Y1386 PolarHBondContact NZ-O 3.06Å; K1350-Y1389 PolarHBondContact NZ-OH 3.19Å
1351	V	73.4	Confident	70.9	Confident	101 Å²	101	63.2 Å²	63.2	61%	0.612	34%	0.34	S	S	*	.			trans	-133.3	137.5	177.7	-175	0	0	0	0	109.6
1352	L	77.6	Confident	70.8	Confident	12.6 Å²	12.6	64.6 Å²	64.6	7%	0.066	35%	0.35	C	S	.	.			trans	-88.4	147.8	173.2	-65.4	179.8	0	0	0	110.4	V1341 L1345 E1354 Q1360 L1361 L1364 L1392 L1396	V1341-L1352 HydrophobicContact CG1-CD1 3.79Å; V1341-L1352 HydrophobicContact CG1-CG 4.47Å; L1345-L1352 HydrophobicContact CD1-CD1 3.91Å; L1345-L1352 HydrophobicContact CD1-CD2 4.12Å; L1345-L1352 HydrophobicContact CD1-CG 3.62Å; L1352-E1354 PolarHBondContact O-N 3.11Å; L1352-Q1360 HydrophobicContact CB-CB 4.13Å; L1352-Q1360 HydrophobicContact CD2-CB 4.42Å; L1352-L1361 HydrophobicContact CB-CB 4.31Å; L1352-L1361 HydrophobicContact CD1-CD1 4.27Å; L1352-L1364 HydrophobicContact CD1-CB 4.49Å; L1352-L1364 HydrophobicContact CD1-CD2 4.12Å; L1352-L1392 HydrophobicContact CD2-CD2 4.03Å; L1352-L1396 HydrophobicContact CD2-CD1 4.4Å
1353	N	72.6	Confident	71	Confident	48.6 Å²	48.6	61.3 Å²	61.3	26%	0.26	34%	0.342	S	S	.	.			trans	-66.8	122.9	177	-168.9	-13	0	0	0	111.2	S1355 N1359 Q1360 L1361	N1353-S1355 VanDerWaalsContact CG-OG 3.23Å; N1353-S1355 PolarHBondContact ND2-OG 3.03Å; N1353-S1355 VanDerWaalsContact OD1-CB 3.27Å; N1353-S1355 WeakPolarHBondContact OD1-CB 3.36Å; N1353-S1355 PolarHBondContact OD1-N 3Å; N1353-S1355 PolarHBondContact OD1-OG 3.39Å; N1353-N1359 CarbonylContact O-C 3.51Å; N1353-N1359 WeakPolarHBondContact O-CA 3.27Å; N1353-N1359 PolarHBondContact O-OD1 3.48Å; N1353-Q1360 HydrophobicContact CB-CB 4.4Å; N1353-Q1360 HydrophobicContact CB-CG 4.13Å; N1353-Q1360 PolarHBondContact O-N 3.13Å; N1353-L1361 PolarHBondContact O-N 3.31Å
1354	E	74.1	Confident	71.4	Confident	75 Å²	75	58.6 Å²	58.6	35%	0.35	32%	0.323	S	S	.	.			trans	-103.3	1.5	179	-60	-172.8	-160.6	0	0	113.2	R1342 L1352 N1359 L1361	R1342-E1354 IonicContact CZ-OE1 3.36Å; R1342-E1354 IonicContact CZ-OE2 3.39Å; R1342-E1354 IonicContact NE-OE1 3.59Å; R1342-E1354 PolarHBondContact NE-OE1 3.3Å; R1342-E1354 IonicContact NE-OE2 3.26Å; R1342-E1354 VanDerWaalsContact NH2-CD 3.3Å; R1342-E1354 IonicContact NH2-OE1 3.25Å; R1342-E1354 PolarHBondContact NH2-OE1 3.16Å; R1342-E1354 IonicContact NH2-OE2 3Å; R1342-E1354 PolarHBondContact NH2-OE2 3.25Å; L1352-E1354 PolarHBondContact O-N 3.11Å; E1354-N1359 PolarHBondContact O-ND2 3.26Å; E1354-L1361 HydrophobicContact CG-CB 4.12Å; E1354-L1361 HydrophobicContact CG-CD2 3.82Å; E1354-L1361 WeakPolarHBondContact OE1-CD2 3.47Å
1355	S	64.4	Low	71.8	Confident	53 Å²	53	58 Å²	58	37%	0.371	32%	0.32	S	S	.	.			trans	-64.1	142.7	-179.5	64.8	0	0	0	0	112.3	N1353 F1357 R1358 N1359	N1353-S1355 VanDerWaalsContact CG-OG 3.23Å; N1353-S1355 PolarHBondContact ND2-OG 3.03Å; N1353-S1355 VanDerWaalsContact OD1-CB 3.27Å; N1353-S1355 WeakPolarHBondContact OD1-CB 3.36Å; N1353-S1355 PolarHBondContact OD1-N 3Å; N1353-S1355 PolarHBondContact OD1-OG 3.39Å; S1355-F1357 VanDerWaalsContact C-N 3.26Å; S1355-F1357 PolarHBondContact O-N 3.12Å; S1355-F1357 VanDerWaalsContact O-N 3.14Å; S1355-R1358 CarbonylContact O-C 3.56Å; S1355-R1358 VanDerWaalsContact O-C 3.31Å; S1355-R1358 PolarHBondContact O-N 3.27Å; S1355-R1358 VanDerWaalsContact O-N 3.08Å; S1355-N1359 VanDerWaalsContact O-CA 3.3Å; S1355-N1359 WeakPolarHBondContact O-CA 3.41Å; S1355-N1359 VanDerWaalsContact O-CB 3.27Å; S1355-N1359 WeakPolarHBondContact O-CB 3.35Å; S1355-N1359 PolarHBondContact O-N 2.96Å; S1355-N1359 VanDerWaalsContact O-N 3.1Å
1356	G	54.4	Low	72.4	Confident	66 Å²	66	65 Å²	65	68%	0.68	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-24.8	-172.1	0	0	0	0	0	115.9
1357	F	52.1	Low	73.4	Confident	199.6 Å²	199.6	64.2 Å²	64.2	88%	0.875	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-20.8	-179.3	-71.1	-79.7	0	0	0	114	S1355	S1355-F1357 VanDerWaalsContact C-N 3.26Å; S1355-F1357 PolarHBondContact O-N 3.12Å; S1355-F1357 VanDerWaalsContact O-N 3.14Å
1358	R	61.3	Low	74.6	Confident	184.8 Å²	184.8	67.4 Å²	67.4	70%	0.697	35%	0.347	S	S	*	.	S	Bend	trans	-148.4	59.7	178.3	-69.2	-172.5	-177.9	178.2	0.9	110.9	E836 S1355 Q1360	E836-R1358 IonicContact OE2-NH1 2.73Å; E836-R1358 PolarHBondContact OE2-NH1 3.45Å; S1355-R1358 CarbonylContact O-C 3.56Å; S1355-R1358 VanDerWaalsContact O-C 3.31Å; S1355-R1358 PolarHBondContact O-N 3.27Å; S1355-R1358 VanDerWaalsContact O-N 3.08Å; R1358-Q1360 VanDerWaalsContact C-N 3.31Å; R1358-Q1360 PolarHBondContact O-N 3.22Å
1359	N	74.2	Confident	75.9	Confident	43.6 Å²	43.6	66.8 Å²	66.8	23%	0.233	35%	0.347	C	S	.	.			trans	-73.7	87	-178.5	-168.1	-22.8	0	0	0	110.8	N1353 E1354 S1355 L1361 S1362 V1363	N1353-N1359 CarbonylContact O-C 3.51Å; N1353-N1359 WeakPolarHBondContact O-CA 3.27Å; N1353-N1359 PolarHBondContact O-OD1 3.48Å; E1354-N1359 PolarHBondContact O-ND2 3.26Å; S1355-N1359 VanDerWaalsContact O-CA 3.3Å; S1355-N1359 WeakPolarHBondContact O-CA 3.41Å; S1355-N1359 VanDerWaalsContact O-CB 3.27Å; S1355-N1359 WeakPolarHBondContact O-CB 3.35Å; S1355-N1359 PolarHBondContact O-N 2.96Å; S1355-N1359 VanDerWaalsContact O-N 3.1Å; N1359-L1361 VanDerWaalsContact C-N 3.27Å; N1359-L1361 PolarHBondContact O-N 3.13Å; N1359-L1361 WeakPolarHBondContact OD1-CB 3.3Å; N1359-L1361 PolarHBondContact OD1-N 3.11Å; N1359-S1362 VanDerWaalsContact CB-OG 3.31Å; N1359-S1362 WeakPolarHBondContact CB-OG 3.38Å; N1359-S1362 VanDerWaalsContact CG-CB 3.49Å; N1359-S1362 PolarHBondContact O-N 3.06Å; N1359-S1362 PolarHBondContact O-OG 3.22Å; N1359-S1362 PolarHBondContact OD1-N 3.24Å; N1359-V1363 PolarHBondContact O-N 3.14Å
1360	Q	80.7	Confident	77.2	Confident	25.4 Å²	25.4	64.4 Å²	64.4	12%	0.119	32%	0.323	C	S	.	.	H	α-helix	trans	-61.7	-35.9	177.5	-73.4	174.7	-16.6	0	0	111.3	L1352 N1353 R1358 S1362 V1363 L1364 Y1389 L1396	L1352-Q1360 HydrophobicContact CB-CB 4.13Å; L1352-Q1360 HydrophobicContact CD2-CB 4.42Å; N1353-Q1360 HydrophobicContact CB-CB 4.4Å; N1353-Q1360 HydrophobicContact CB-CG 4.13Å; N1353-Q1360 PolarHBondContact O-N 3.13Å; R1358-Q1360 VanDerWaalsContact C-N 3.31Å; R1358-Q1360 PolarHBondContact O-N 3.22Å; Q1360-S1362 VanDerWaalsContact C-N 3.35Å; Q1360-S1362 PolarHBondContact O-N 2.96Å; Q1360-V1363 PolarHBondContact O-N 3.09Å; Q1360-L1364 PolarHBondContact O-N 3.16Å; Q1360-Y1389 PolarHBondContact OE1-OH 3.26Å; Q1360-L1396 HydrophobicContact CB-CD1 3.6Å; Q1360-L1396 VanDerWaalsContact CB-CD1 3.46Å; Q1360-L1396 HydrophobicContact CG-CD1 3.75Å
1361	L	83.7	Confident	78.2	Confident	7.8 Å²	7.8	64.1 Å²	64.1	4%	0.041	33%	0.326	C	S	.	.	H	α-helix	trans	-63	-43	177.6	-179.6	65.9	0	0	0	111.4	V1341 L1352 N1353 E1354 N1359 V1363 L1364 I1365	V1341-L1361 HydrophobicContact CB-CD1 3.8Å; V1341-L1361 HydrophobicContact CG1-CD1 3.55Å; V1341-L1361 VanDerWaalsContact CG1-CD1 3.48Å; V1341-L1361 HydrophobicContact CG2-CD1 4.37Å; L1352-L1361 HydrophobicContact CB-CB 4.31Å; L1352-L1361 HydrophobicContact CD1-CD1 4.27Å; N1353-L1361 PolarHBondContact O-N 3.31Å; E1354-L1361 HydrophobicContact CG-CB 4.12Å; E1354-L1361 HydrophobicContact CG-CD2 3.82Å; E1354-L1361 WeakPolarHBondContact OE1-CD2 3.47Å; N1359-L1361 VanDerWaalsContact C-N 3.27Å; N1359-L1361 PolarHBondContact O-N 3.13Å; N1359-L1361 WeakPolarHBondContact OD1-CB 3.3Å; N1359-L1361 PolarHBondContact OD1-N 3.11Å; L1361-V1363 VanDerWaalsContact C-N 3.31Å; L1361-V1363 PolarHBondContact O-N 3.07Å; L1361-L1364 PolarHBondContact O-N 3.21Å; L1361-L1364 VanDerWaalsContact O-N 3.16Å; L1361-I1365 HydrophobicContact CD1-CD1 3.77Å; L1361-I1365 HydrophobicContact CD1-CG1 4.14Å; L1361-I1365 HydrophobicContact CD2-CD1 4.05Å; L1361-I1365 HydrophobicContact CG-CD1 3.53Å; L1361-I1365 HydrophobicContact CG-CG1 4.26Å; L1361-I1365 WeakPolarHBondContact O-CB 3.19Å; L1361-I1365 VanDerWaalsContact O-CG1 3.27Å; L1361-I1365 WeakPolarHBondContact O-CG1 3.25Å; L1361-I1365 PolarHBondContact O-N 3.05Å
1362	S	83	Confident	78.9	Confident	32.6 Å²	32.6	60.6 Å²	60.6	23%	0.228	30%	0.303	C	S	.	.	H	α-helix	trans	-63.9	-35.8	179	71.4	0	0	0	0	112.5	N1359 Q1360 L1364 I1365 Q1366	N1359-S1362 VanDerWaalsContact CB-OG 3.31Å; N1359-S1362 WeakPolarHBondContact CB-OG 3.38Å; N1359-S1362 VanDerWaalsContact CG-CB 3.49Å; N1359-S1362 PolarHBondContact O-N 3.06Å; N1359-S1362 PolarHBondContact O-OG 3.22Å; N1359-S1362 PolarHBondContact OD1-N 3.24Å; Q1360-S1362 VanDerWaalsContact C-N 3.35Å; Q1360-S1362 PolarHBondContact O-N 2.96Å; S1362-L1364 VanDerWaalsContact C-N 3.31Å; S1362-L1364 PolarHBondContact O-N 3.19Å; S1362-I1365 PolarHBondContact O-N 3.05Å; S1362-Q1366 VanDerWaalsContact O-CB 3.27Å; S1362-Q1366 WeakPolarHBondContact O-CB 3.33Å; S1362-Q1366 WeakPolarHBondContact O-CG 3.39Å; S1362-Q1366 PolarHBondContact O-N 3.21Å; S1362-Q1366 VanDerWaalsContact O-N 3.08Å
1363	V	85.1	Confident	79.3	Confident	43.6 Å²	43.6	61.7 Å²	61.7	26%	0.264	31%	0.311	S	S	.	.	H	α-helix	trans	-60.7	-41.7	176.5	177.2	0	0	0	0	110.9	N1359 Q1360 L1361 K1367 L1396 K1397	N1359-V1363 PolarHBondContact O-N 3.14Å; Q1360-V1363 PolarHBondContact O-N 3.09Å; L1361-V1363 VanDerWaalsContact C-N 3.31Å; L1361-V1363 PolarHBondContact O-N 3.07Å; V1363-K1367 WeakPolarHBondContact O-CG 3.35Å; V1363-L1396 HydrophobicContact CG1-CB 4.27Å; V1363-K1397 HydrophobicContact CG1-CG 4.39Å
1364	L	86.4	Confident	80	Confident	0.6 Å²	0.6	60.3 Å²	60.3	0%	0.003	30%	0.303	C	S	.	.	H	α-helix	trans	-74	-42	179	-175.7	61.5	0	0	0	112.4	V1341 L1352 Q1360 L1361 S1362 Q1366 K1367 A1370 Y1375 L1376 A1379 L1383 L1396 L1399	V1341-L1364 HydrophobicContact CG1-CD2 3.96Å; V1341-L1364 HydrophobicContact CG2-CD2 3.77Å; V1341-L1364 HydrophobicContact CG2-CG 4.44Å; L1352-L1364 HydrophobicContact CD1-CB 4.49Å; L1352-L1364 HydrophobicContact CD1-CD2 4.12Å; Q1360-L1364 PolarHBondContact O-N 3.16Å; L1361-L1364 PolarHBondContact O-N 3.21Å; L1361-L1364 VanDerWaalsContact O-N 3.16Å; S1362-L1364 VanDerWaalsContact C-N 3.31Å; S1362-L1364 PolarHBondContact O-N 3.19Å; L1364-Q1366 VanDerWaalsContact C-N 3.27Å; L1364-Q1366 PolarHBondContact O-N 3.27Å; L1364-K1367 HydrophobicContact CD1-CG 4.46Å; L1364-K1367 WeakPolarHBondContact O-CB 3.23Å; L1364-K1367 VanDerWaalsContact O-CG 3.28Å; L1364-K1367 WeakPolarHBondContact O-CG 3.37Å; L1364-K1367 PolarHBondContact O-N 3.25Å; L1364-A1370 WeakPolarHBondContact O-CB 3.45Å; L1364-Y1375 HydrophobicContact CD1-CE1 4.38Å; L1364-L1376 HydrophobicContact CG-CD2 4.45Å; L1364-A1379 HydrophobicContact CD1-CB 3.82Å; L1364-L1383 HydrophobicContact CD1-CD1 4.45Å; L1364-L1383 HydrophobicContact CD2-CD1 4.03Å; L1364-L1396 HydrophobicContact CB-CD2 4.37Å; L1364-L1399 HydrophobicContact CD1-CD1 4.4Å
1365	I	87.3	Confident	80.8	Confident	17.6 Å²	17.6	56.7 Å²	56.7	9%	0.09	29%	0.287	C	S	.	.	H	α-helix	trans	-67.4	-28	-178.3	-69.6	174.6	0	0	0	112.6	T1334 R1337 G1338 L1361 S1362 K1367 A1370	T1334-I1365 HydrophobicContact CG2-CG2 4.38Å; R1337-I1365 HydrophobicContact CB-CB 4.44Å; R1337-I1365 HydrophobicContact CB-CG1 4.07Å; R1337-I1365 HydrophobicContact CB-CG2 3.93Å; R1337-I1365 HydrophobicContact CG-CG2 4.45Å; R1337-I1365 PolarHBondContact NH1-O 3.01Å; R1337-I1365 VanDerWaalsContact NH1-O 3.13Å; G1338-I1365 VanDerWaalsContact CA-CD1 3.44Å; L1361-I1365 HydrophobicContact CD1-CD1 3.77Å; L1361-I1365 HydrophobicContact CD1-CG1 4.14Å; L1361-I1365 HydrophobicContact CD2-CD1 4.05Å; L1361-I1365 HydrophobicContact CG-CD1 3.53Å; L1361-I1365 HydrophobicContact CG-CG1 4.26Å; L1361-I1365 WeakPolarHBondContact O-CB 3.19Å; L1361-I1365 VanDerWaalsContact O-CG1 3.27Å; L1361-I1365 WeakPolarHBondContact O-CG1 3.25Å; L1361-I1365 PolarHBondContact O-N 3.05Å; S1362-I1365 PolarHBondContact O-N 3.05Å; I1365-K1367 VanDerWaalsContact C-N 3.34Å; I1365-A1370 VanDerWaalsContact O-CB 3.3Å; I1365-A1370 WeakPolarHBondContact O-CB 3.37Å
1366	Q	87.6	Confident	81.9	Confident	153.4 Å²	153.4	54.2 Å²	54.2	72%	0.717	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-5.4	-179.9	-72.1	176	7.1	0	0	113.9	S1362 L1364	S1362-Q1366 VanDerWaalsContact O-CB 3.27Å; S1362-Q1366 WeakPolarHBondContact O-CB 3.33Å; S1362-Q1366 WeakPolarHBondContact O-CG 3.39Å; S1362-Q1366 PolarHBondContact O-N 3.21Å; S1362-Q1366 VanDerWaalsContact O-N 3.08Å; L1364-Q1366 VanDerWaalsContact C-N 3.27Å; L1364-Q1366 PolarHBondContact O-N 3.27Å
1367	K	89.1	Confident	83.4	Confident	20 Å²	20	54.6 Å²	54.6	9%	0.087	25%	0.252	C	S	.	.	S	Bend	trans	-60.2	148.4	175.1	-62.1	-75.2	174.7	175	0	110.9	V1363 L1364 I1365 D1369 A1370 Y1375 L1396 K1397 L1399 D1401	V1363-K1367 WeakPolarHBondContact O-CG 3.35Å; L1364-K1367 HydrophobicContact CD1-CG 4.46Å; L1364-K1367 WeakPolarHBondContact O-CB 3.23Å; L1364-K1367 VanDerWaalsContact O-CG 3.28Å; L1364-K1367 WeakPolarHBondContact O-CG 3.37Å; L1364-K1367 PolarHBondContact O-N 3.25Å; I1365-K1367 VanDerWaalsContact C-N 3.34Å; K1367-D1369 PolarHBondContact O-N 3.19Å; K1367-A1370 HydrophobicContact CB-CB 4.13Å; K1367-A1370 WeakPolarHBondContact O-CB 3.38Å; K1367-A1370 PolarHBondContact O-N 3Å; K1367-A1370 VanDerWaalsContact O-N 3.11Å; K1367-Y1375 HydrophobicContact CB-CE1 3.75Å; K1367-Y1375 VanDerWaalsContact CB-OH 3.29Å; K1367-Y1375 WeakPolarHBondContact CB-OH 3.34Å; K1367-Y1375 HydrophobicContact CG-CE1 4.26Å; K1367-Y1375 VanDerWaalsContact CG-OH 3.27Å; K1367-Y1375 WeakPolarHBondContact CG-OH 3.36Å; K1367-L1396 WeakPolarHBondContact CE-O 3.34Å; K1367-K1397 PolarHBondContact NZ-O 3.25Å; K1367-L1399 WeakPolarHBondContact CE-O 3.29Å; K1367-L1399 PolarHBondContact NZ-O 2.95Å; K1367-D1401 HydrophobicContact CD-CB 4.45Å; K1367-D1401 WeakPolarHBondContact CD-OD1 3.46Å; K1367-D1401 WeakPolarHBondContact CE-OD1 3.37Å; K1367-D1401 IonicContact NZ-OD1 3.18Å; K1367-D1401 PolarHBondContact NZ-OD1 3.02Å
1368	R	88	Confident	85	Confident	194.2 Å²	194.2	45.2 Å²	45.2	73%	0.733	21%	0.211	S	C	*	.	G	3₁₀ helix	trans	-58.2	-48.2	-171	-161.6	179.6	178.1	171.5	-0.4	112.5	A1370 D1401	R1368-A1370 VanDerWaalsContact C-N 3.32Å; R1368-A1370 PolarHBondContact O-N 3.24Å; R1368-D1401 HydrophobicContact CB-CB 4.12Å; R1368-D1401 HydrophobicContact CG-CB 4.15Å; R1368-D1401 PolarHBondContact N-O 3.04Å
1369	D	89.6	Confident	86.3	Confident	33.8 Å²	33.8	36.4 Å²	36.4	18%	0.181	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-89.2	7.3	-179.6	-70.9	-5.8	0	0	0	113.3	K1367 S1371 I1372 Y1375 D1401 T1402 I1403	K1367-D1369 PolarHBondContact O-N 3.19Å; D1369-S1371 PolarHBondContact O-N 2.84Å; D1369-I1372 HydrophobicContact CB-CD1 4.31Å; D1369-I1372 WeakPolarHBondContact O-CB 3.39Å; D1369-I1372 PolarHBondContact O-N 3.02Å; D1369-Y1375 HydrophobicContact CB-CD2 3.79Å; D1369-Y1375 HydrophobicContact CB-CE2 4.41Å; D1369-Y1375 HydrophobicContact CB-CG 3.9Å; D1369-Y1375 VanDerWaalsContact O-CB 3.31Å; D1369-Y1375 WeakPolarHBondContact O-CB 3.37Å; D1369-D1401 PolarHBondContact N-O 3.14Å; D1369-D1401 VanDerWaalsContact N-O 3.11Å; D1369-T1402 WeakPolarHBondContact OD2-CA 3.44Å; D1369-T1402 VanDerWaalsContact OD2-CB 3.28Å; D1369-T1402 WeakPolarHBondContact OD2-CB 3.36Å; D1369-I1403 HydrophobicContact CB-CG1 4.28Å; D1369-I1403 PolarHBondContact OD2-N 3.18Å
1370	A	88.3	Confident	86.8	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-62.1	-14.5	178.5	0	0	0	0	0	114	R1337 L1364 I1365 K1367 R1368 I1372 Y1375 L1376	R1337-A1370 VanDerWaalsContact CD-O 3.28Å; R1337-A1370 WeakPolarHBondContact CD-O 3.35Å; R1337-A1370 VanDerWaalsContact CG-O 3.27Å; R1337-A1370 WeakPolarHBondContact CG-O 3.38Å; L1364-A1370 WeakPolarHBondContact O-CB 3.45Å; I1365-A1370 VanDerWaalsContact O-CB 3.3Å; I1365-A1370 WeakPolarHBondContact O-CB 3.37Å; K1367-A1370 HydrophobicContact CB-CB 4.13Å; K1367-A1370 WeakPolarHBondContact O-CB 3.38Å; K1367-A1370 PolarHBondContact O-N 3Å; K1367-A1370 VanDerWaalsContact O-N 3.11Å; R1368-A1370 VanDerWaalsContact C-N 3.32Å; R1368-A1370 PolarHBondContact O-N 3.24Å; A1370-I1372 PolarHBondContact O-N 3.17Å; A1370-Y1375 HydrophobicContact CB-CD1 4.27Å; A1370-Y1375 HydrophobicContact CB-CE1 4.31Å; A1370-L1376 HydrophobicContact CB-CD2 4.01Å; A1370-L1376 WeakPolarHBondContact O-CD1 3.36Å
1371	S	88.2	Confident	86.7	Confident	32.6 Å²	32.6	33.6 Å²	33.6	23%	0.228	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-68.9	-19	170	60.7	0	0	0	0	113.5	L1332 D1369	L1332-S1371 WeakPolarHBondContact CB-O 3.41Å; L1332-S1371 WeakPolarHBondContact CG-O 3.41Å; L1332-S1371 PolarHBondContact N-O 3.18Å; D1369-S1371 PolarHBondContact O-N 2.84Å
1372	I	88.6	Confident	86.5	Confident	28.6 Å²	28.6	33.7 Å²	33.7	15%	0.147	16%	0.164	C	C	.	.	S	Bend	trans	-95.3	121.3	-177.6	-54.8	174.7	0	0	0	108.4	G1122 D1369 A1370 L1374 Y1375 L1376 I1403	G1122-I1372 VanDerWaalsContact C-CG2 3.49Å; G1122-I1372 VanDerWaalsContact O-CG2 3.3Å; G1122-I1372 WeakPolarHBondContact O-CG2 3.33Å; D1369-I1372 HydrophobicContact CB-CD1 4.31Å; D1369-I1372 WeakPolarHBondContact O-CB 3.39Å; D1369-I1372 PolarHBondContact O-N 3.02Å; A1370-I1372 PolarHBondContact O-N 3.17Å; I1372-L1374 VanDerWaalsContact C-N 3.26Å; I1372-L1374 HydrophobicContact CG2-CB 4.13Å; I1372-L1374 PolarHBondContact O-N 3.28Å; I1372-Y1375 WeakPolarHBondContact O-CB 3.37Å; I1372-Y1375 PolarHBondContact O-N 3.26Å; I1372-Y1375 VanDerWaalsContact O-N 3.1Å; I1372-L1376 PolarHBondContact O-N 3.14Å; I1372-I1403 HydrophobicContact CB-CD1 4.42Å; I1372-I1403 HydrophobicContact CD1-CD1 4.12Å; I1372-I1403 HydrophobicContact CG2-CD1 4.08Å
1373	P	87.6	Confident	86.4	Confident	34.2 Å²	34.2	32.5 Å²	32.5	22%	0.222	16%	0.155	C	C	.	.	H	α-helix	trans	-53	-38.8	179.2	-26.7	31.6	0	0	0	114.3	I1060 G1122 L1332 Y1375 L1376 K1377	I1060-P1373 HydrophobicContact CG2-CB 4.26Å; I1060-P1373 HydrophobicContact CG2-CG 4.37Å; G1122-P1373 WeakPolarHBondContact O-CD 3.33Å; L1332-P1373 HydrophobicContact CD1-CB 4.37Å; L1332-P1373 HydrophobicContact CD1-CG 3.91Å; L1332-P1373 HydrophobicContact CD2-CG 4.33Å; L1332-P1373 HydrophobicContact CG-CG 4.09Å; P1373-Y1375 VanDerWaalsContact C-N 3.33Å; P1373-Y1375 PolarHBondContact O-N 3.07Å; P1373-L1376 PolarHBondContact O-N 3.19Å; P1373-K1377 WeakPolarHBondContact O-CB 3.45Å; P1373-K1377 PolarHBondContact O-N 3.06Å
1374	L	86.4	Confident	85.9	Confident	19.4 Å²	19.4	32.1 Å²	32.1	10%	0.102	15%	0.149	C	C	.	.	H	α-helix	trans	-58.5	-41.6	178.1	-179	62.9	0	0	0	112.6	G1122 I1372 K1377 L1378 I1403 S1570 E1572 I1573	G1122-L1374 PolarHBondContact O-N 3.11Å; I1372-L1374 VanDerWaalsContact C-N 3.26Å; I1372-L1374 HydrophobicContact CG2-CB 4.13Å; I1372-L1374 PolarHBondContact O-N 3.28Å; L1374-K1377 PolarHBondContact O-N 3.01Å; L1374-L1378 HydrophobicContact CD1-CD1 4.4Å; L1374-L1378 HydrophobicContact CD1-CG 4.36Å; L1374-L1378 HydrophobicContact CG-CD1 4.19Å; L1374-L1378 WeakPolarHBondContact O-CB 3.49Å; L1374-L1378 VanDerWaalsContact O-CG 3.31Å; L1374-L1378 WeakPolarHBondContact O-CG 3.39Å; L1374-L1378 PolarHBondContact O-N 2.99Å; L1374-I1403 HydrophobicContact CB-CD1 4.41Å; L1374-I1403 HydrophobicContact CD2-CD1 4.38Å; L1374-I1403 HydrophobicContact CG-CD1 4.48Å; L1374-S1570 VanDerWaalsContact CD2-OG 3.3Å; L1374-S1570 WeakPolarHBondContact CD2-OG 3.41Å; L1374-E1572 WeakPolarHBondContact CD2-OE2 3.47Å; L1374-I1573 HydrophobicContact CD1-CD1 4.28Å; L1374-I1573 HydrophobicContact CD2-CD1 4.46Å
1375	Y	90.8	Very high	85.1	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-62.4	-46.8	177.2	175.2	-89	0	0	0	111.2	L1364 K1367 D1369 A1370 I1372 P1373 K1377 L1378 A1379 L1399 P1400 I1403 L1406	L1364-Y1375 HydrophobicContact CD1-CE1 4.38Å; K1367-Y1375 HydrophobicContact CB-CE1 3.75Å; K1367-Y1375 VanDerWaalsContact CB-OH 3.29Å; K1367-Y1375 WeakPolarHBondContact CB-OH 3.34Å; K1367-Y1375 HydrophobicContact CG-CE1 4.26Å; K1367-Y1375 VanDerWaalsContact CG-OH 3.27Å; K1367-Y1375 WeakPolarHBondContact CG-OH 3.36Å; D1369-Y1375 HydrophobicContact CB-CD2 3.79Å; D1369-Y1375 HydrophobicContact CB-CE2 4.41Å; D1369-Y1375 HydrophobicContact CB-CG 3.9Å; D1369-Y1375 VanDerWaalsContact O-CB 3.31Å; D1369-Y1375 WeakPolarHBondContact O-CB 3.37Å; A1370-Y1375 HydrophobicContact CB-CD1 4.27Å; A1370-Y1375 HydrophobicContact CB-CE1 4.31Å; I1372-Y1375 WeakPolarHBondContact O-CB 3.37Å; I1372-Y1375 PolarHBondContact O-N 3.26Å; I1372-Y1375 VanDerWaalsContact O-N 3.1Å; P1373-Y1375 VanDerWaalsContact C-N 3.33Å; P1373-Y1375 PolarHBondContact O-N 3.07Å; Y1375-K1377 VanDerWaalsContact C-N 3.3Å; Y1375-K1377 PolarHBondContact O-N 3.06Å; Y1375-L1378 PolarHBondContact O-N 2.91Å; Y1375-A1379 HydrophobicContact CE1-CB 4.28Å; Y1375-A1379 VanDerWaalsContact O-CB 3.29Å; Y1375-A1379 WeakPolarHBondContact O-CB 3.37Å; Y1375-A1379 PolarHBondContact O-N 3.05Å; Y1375-L1399 WeakPolarHBondContact OH-CD2 3.47Å; Y1375-P1400 WeakPolarHBondContact CE2-O 3.25Å; Y1375-P1400 PolarHBondContact OH-O 3.22Å; Y1375-I1403 HydrophobicContact CD2-CG1 3.98Å; Y1375-I1403 HydrophobicContact CG-CG1 4.39Å; Y1375-L1406 HydrophobicContact CD2-CD2 4.16Å; Y1375-L1406 HydrophobicContact CE2-CD2 4.08Å
1376	L	88.5	Confident	84.2	Confident	0.8 Å²	0.8	36 Å²	36	0%	0.004	17%	0.166	C	C	.	.	H	α-helix	trans	-62.9	-39.2	179.1	-67.9	-179.6	0	0	0	111.6	L1332 R1337 A1340 V1341 L1344 L1364 A1370 I1372 P1373 C1380	L1332-L1376 HydrophobicContact CD1-CD1 3.81Å; R1337-L1376 HydrophobicContact CB-CD1 4.01Å; R1337-L1376 HydrophobicContact CG-CD1 4.14Å; A1340-L1376 HydrophobicContact CB-CD1 4.02Å; V1341-L1376 HydrophobicContact CG2-CD1 4.42Å; V1341-L1376 HydrophobicContact CG2-CD2 3.92Å; L1344-L1376 HydrophobicContact CD1-CB 4.45Å; L1364-L1376 HydrophobicContact CG-CD2 4.45Å; A1370-L1376 HydrophobicContact CB-CD2 4.01Å; A1370-L1376 WeakPolarHBondContact O-CD1 3.36Å; I1372-L1376 PolarHBondContact O-N 3.14Å; P1373-L1376 PolarHBondContact O-N 3.19Å; L1376-C1380 VanDerWaalsContact O-CB 3.27Å; L1376-C1380 WeakPolarHBondContact O-CB 3.4Å; L1376-C1380 PolarHBondContact O-N 3.13Å; L1376-C1380 PolarHBondContact O-SG 3.21Å
1377	K	85	Confident	82.7	Confident	73.8 Å²	73.8	31.4 Å²	31.4	32%	0.321	15%	0.151	S	C	.	.	H	α-helix	trans	-60.6	-53.6	174.5	-178	135.9	176.8	168.7	0	111.2	L1344 P1373 L1374 Y1375 A1379 C1380 D1381	L1344-K1377 HydrophobicContact CD1-CB 4.45Å; L1344-K1377 HydrophobicContact CD1-CD 4.46Å; L1344-K1377 HydrophobicContact CD2-CD 3.74Å; P1373-K1377 WeakPolarHBondContact O-CB 3.45Å; P1373-K1377 PolarHBondContact O-N 3.06Å; L1374-K1377 PolarHBondContact O-N 3.01Å; Y1375-K1377 VanDerWaalsContact C-N 3.3Å; Y1375-K1377 PolarHBondContact O-N 3.06Å; K1377-A1379 VanDerWaalsContact C-N 3.33Å; K1377-A1379 PolarHBondContact O-N 3.4Å; K1377-C1380 PolarHBondContact O-N 3.22Å; K1377-C1380 VanDerWaalsContact O-N 3.17Å; K1377-D1381 WeakPolarHBondContact CD-OD2 3.32Å; K1377-D1381 WeakPolarHBondContact CE-OD2 3.31Å; K1377-D1381 IonicContact NZ-OD1 3.25Å; K1377-D1381 PolarHBondContact NZ-OD1 3.16Å; K1377-D1381 IonicContact NZ-OD2 3.38Å; K1377-D1381 PolarHBondContact NZ-OD2 2.99Å; K1377-D1381 WeakPolarHBondContact O-CB 3.34Å; K1377-D1381 PolarHBondContact O-N 2.99Å
1378	L	85.8	Confident	81.4	Confident	2.8 Å²	2.8	33.7 Å²	33.7	2%	0.015	16%	0.164	C	C	.	.	H	α-helix	trans	-58.3	-45.7	178.4	-72.4	173.3	0	0	0	112.2	L1374 Y1375 C1380 D1381 E1382 I1403 L1406 V1407 P1523 L1524 I1573	L1374-L1378 HydrophobicContact CD1-CD1 4.4Å; L1374-L1378 HydrophobicContact CD1-CG 4.36Å; L1374-L1378 HydrophobicContact CG-CD1 4.19Å; L1374-L1378 WeakPolarHBondContact O-CB 3.49Å; L1374-L1378 VanDerWaalsContact O-CG 3.31Å; L1374-L1378 WeakPolarHBondContact O-CG 3.39Å; L1374-L1378 PolarHBondContact O-N 2.99Å; Y1375-L1378 PolarHBondContact O-N 2.91Å; L1378-C1380 PolarHBondContact O-N 3.06Å; L1378-D1381 PolarHBondContact O-N 3.32Å; L1378-E1382 VanDerWaalsContact O-CB 3.26Å; L1378-E1382 WeakPolarHBondContact O-CB 3.3Å; L1378-E1382 PolarHBondContact O-N 3.29Å; L1378-I1403 HydrophobicContact CD1-CG2 4.06Å; L1378-L1406 HydrophobicContact CB-CD2 3.53Å; L1378-L1406 VanDerWaalsContact CB-CD2 3.49Å; L1378-L1406 HydrophobicContact CB-CG 4.44Å; L1378-L1406 HydrophobicContact CD1-CD2 4.45Å; L1378-V1407 HydrophobicContact CD1-CG2 4.43Å; L1378-P1523 HydrophobicContact CD2-CB 4.17Å; L1378-P1523 WeakPolarHBondContact CD2-O 3.36Å; L1378-L1524 HydrophobicContact CD2-CD2 4.15Å; L1378-I1573 HydrophobicContact CD1-CD1 4.03Å; L1378-I1573 HydrophobicContact CD1-CG1 4.4Å; L1378-I1573 HydrophobicContact CD2-CD1 3.9Å; L1378-I1573 HydrophobicContact CG-CD1 4.41Å
1379	A	88	Confident	80	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-66.5	-40	-179.7	0	0	0	0	0	111.7	L1364 Y1375 K1377 E1382 L1383 L1399 L1406	L1364-A1379 HydrophobicContact CD1-CB 3.82Å; Y1375-A1379 HydrophobicContact CE1-CB 4.28Å; Y1375-A1379 VanDerWaalsContact O-CB 3.29Å; Y1375-A1379 WeakPolarHBondContact O-CB 3.37Å; Y1375-A1379 PolarHBondContact O-N 3.05Å; K1377-A1379 VanDerWaalsContact C-N 3.33Å; K1377-A1379 PolarHBondContact O-N 3.4Å; A1379-E1382 PolarHBondContact O-N 3.06Å; A1379-L1383 WeakPolarHBondContact O-CB 3.37Å; A1379-L1383 WeakPolarHBondContact O-CD1 3.27Å; A1379-L1383 WeakPolarHBondContact O-CG 3.32Å; A1379-L1383 PolarHBondContact O-N 3.24Å; A1379-L1399 HydrophobicContact CB-CD1 4.48Å; A1379-L1399 HydrophobicContact CB-CD2 4.1Å; A1379-L1406 HydrophobicContact CB-CD2 4.17Å
1380	C	84.2	Confident	78.5	Confident	1.4 Å²	1.4	32.4 Å²	32.4	1%	0.009	16%	0.163	C	C	.	.	H	α-helix	trans	-67.4	-41.3	175.4	-69.1	0	0	0	0	112	L1344 L1345 L1376 K1377 L1378 E1382 L1383 R1384	L1344-C1380 HydrophobicContact CB-CB 4.11Å; L1344-C1380 HydrophobicContact CD1-CB 4.42Å; L1345-C1380 HydrophobicContact CD2-CB 3.93Å; L1345-C1380 HydrophobicContact CG-CB 4.24Å; L1376-C1380 VanDerWaalsContact O-CB 3.27Å; L1376-C1380 WeakPolarHBondContact O-CB 3.4Å; L1376-C1380 PolarHBondContact O-N 3.13Å; L1376-C1380 PolarHBondContact O-SG 3.21Å; K1377-C1380 PolarHBondContact O-N 3.22Å; K1377-C1380 VanDerWaalsContact O-N 3.17Å; L1378-C1380 PolarHBondContact O-N 3.06Å; C1380-E1382 VanDerWaalsContact C-N 3.32Å; C1380-E1382 PolarHBondContact O-N 3.4Å; C1380-L1383 PolarHBondContact O-N 3.22Å; C1380-R1384 WeakPolarHBondContact O-CB 3.37Å; C1380-R1384 WeakPolarHBondContact O-CG 3.2Å; C1380-R1384 PolarHBondContact O-N 3.1Å
1381	D	79.2	Confident	77.4	Confident	9.4 Å²	9.4	37.4 Å²	37.4	5%	0.05	19%	0.186	C	C	.	.	H	α-helix	trans	-65.6	-36.3	176.4	-73.8	-25.6	0	0	0	111.6	K1377 L1378 R1384 L1385 P1523	K1377-D1381 WeakPolarHBondContact CD-OD2 3.32Å; K1377-D1381 WeakPolarHBondContact CE-OD2 3.31Å; K1377-D1381 IonicContact NZ-OD1 3.25Å; K1377-D1381 PolarHBondContact NZ-OD1 3.16Å; K1377-D1381 IonicContact NZ-OD2 3.38Å; K1377-D1381 PolarHBondContact NZ-OD2 2.99Å; K1377-D1381 WeakPolarHBondContact O-CB 3.34Å; K1377-D1381 PolarHBondContact O-N 2.99Å; L1378-D1381 PolarHBondContact O-N 3.32Å; D1381-R1384 VanDerWaalsContact O-CB 3.29Å; D1381-R1384 WeakPolarHBondContact O-CB 3.44Å; D1381-R1384 PolarHBondContact O-N 3.28Å; D1381-R1384 IonicContact OD1-CZ 3.68Å; D1381-R1384 IonicContact OD1-NH1 3.3Å; D1381-R1384 PolarHBondContact OD1-NH1 3Å; D1381-R1384 IonicContact OD1-NH2 3.76Å; D1381-L1385 WeakPolarHBondContact O-CG 3.42Å; D1381-L1385 PolarHBondContact O-N 3.06Å; D1381-P1523 HydrophobicContact CB-CB 4.1Å; D1381-P1523 HydrophobicContact CB-CG 4.1Å
1382	E	80.7	Confident	76.7	Confident	9.6 Å²	9.6	36.3 Å²	36.3	5%	0.045	18%	0.178	C	C	.	.	H	α-helix	trans	-69.9	-43.9	174.3	-177.4	59.7	-164.1	0	0	112	L1378 A1379 C1380 R1384 L1385 Y1386 L1399 L1406 V1410 R1413	L1378-E1382 VanDerWaalsContact O-CB 3.26Å; L1378-E1382 WeakPolarHBondContact O-CB 3.3Å; L1378-E1382 PolarHBondContact O-N 3.29Å; A1379-E1382 PolarHBondContact O-N 3.06Å; C1380-E1382 VanDerWaalsContact C-N 3.32Å; C1380-E1382 PolarHBondContact O-N 3.4Å; E1382-R1384 PolarHBondContact O-N 3.06Å; E1382-L1385 PolarHBondContact O-N 3.13Å; E1382-L1385 VanDerWaalsContact O-N 3.14Å; E1382-Y1386 HydrophobicContact CG-CE2 4.3Å; E1382-Y1386 WeakPolarHBondContact O-CD2 3.4Å; E1382-Y1386 WeakPolarHBondContact O-CE2 3.36Å; E1382-Y1386 PolarHBondContact O-N 3.08Å; E1382-Y1386 PolarHBondContact OE1-OH 3.12Å; E1382-L1399 HydrophobicContact CG-CD2 4.31Å; E1382-L1406 HydrophobicContact CG-CD1 4.47Å; E1382-V1410 HydrophobicContact CG-CG2 4.37Å; E1382-V1410 WeakPolarHBondContact OE2-CG2 3.45Å; E1382-R1413 VanDerWaalsContact CD-NE 3.34Å; E1382-R1413 VanDerWaalsContact OE1-CD 3.25Å; E1382-R1413 WeakPolarHBondContact OE1-CD 3.4Å; E1382-R1413 IonicContact OE1-CZ 3.18Å; E1382-R1413 IonicContact OE1-NE 3.03Å; E1382-R1413 PolarHBondContact OE1-NE 2.98Å; E1382-R1413 IonicContact OE1-NH1 2.7Å; E1382-R1413 PolarHBondContact OE1-NH1 2.99Å; E1382-R1413 IonicContact OE1-NH2 3.12Å; E1382-R1413 IonicContact OE2-CZ 3.3Å; E1382-R1413 IonicContact OE2-NE 3.16Å; E1382-R1413 PolarHBondContact OE2-NE 2.81Å; E1382-R1413 VanDerWaalsContact OE2-NE 3.1Å; E1382-R1413 IonicContact OE2-NH1 3.7Å; E1382-R1413 PolarHBondContact OE2-NH1 2.99Å; E1382-R1413 IonicContact OE2-NH2 3.2Å; E1382-R1413 PolarHBondContact OE2-NH2 2.97Å
1383	L	80.1	Confident	75.9	Confident	6.4 Å²	6.4	36.3 Å²	36.3	3%	0.034	19%	0.185	C	C	.	.	H	α-helix	trans	-61.3	-31.5	173.9	-73.1	168.7	0	0	0	111.8	W832 L1364 A1379 C1380 L1385 Y1386 L1392 L1396 L1399	W832-L1383 HydrophobicContact CH2-CB 4.25Å; W832-L1383 WeakPolarHBondContact CH2-O 3.27Å; W832-L1383 WeakPolarHBondContact CZ2-O 3.32Å; L1364-L1383 HydrophobicContact CD1-CD1 4.45Å; L1364-L1383 HydrophobicContact CD2-CD1 4.03Å; A1379-L1383 WeakPolarHBondContact O-CB 3.37Å; A1379-L1383 WeakPolarHBondContact O-CD1 3.27Å; A1379-L1383 WeakPolarHBondContact O-CG 3.32Å; A1379-L1383 PolarHBondContact O-N 3.24Å; C1380-L1383 PolarHBondContact O-N 3.22Å; L1383-L1385 VanDerWaalsContact C-N 3.32Å; L1383-L1385 PolarHBondContact O-N 3.15Å; L1383-Y1386 HydrophobicContact CD2-CD2 4.47Å; L1383-Y1386 WeakPolarHBondContact O-CB 3.29Å; L1383-Y1386 PolarHBondContact O-N 3.28Å; L1383-Y1386 VanDerWaalsContact O-N 3.1Å; L1383-L1392 HydrophobicContact CD2-CD1 3.79Å; L1383-L1396 HydrophobicContact CD1-CD2 3.66Å; L1383-L1396 HydrophobicContact CD2-CD2 3.77Å; L1383-L1396 HydrophobicContact CD2-CG 4.08Å; L1383-L1396 HydrophobicContact CG-CD2 4.35Å; L1383-L1399 HydrophobicContact CD1-CD1 4.19Å; L1383-L1399 HydrophobicContact CD2-CD1 3.63Å; L1383-L1399 VanDerWaalsContact CD2-CD1 3.43Å; L1383-L1399 HydrophobicContact CG-CD1 3.84Å
1384	R	74.8	Confident	75.3	Confident	35.8 Å²	35.8	37.1 Å²	37.1	14%	0.135	20%	0.195	C	C	.	.	H	α-helix	trans	-63.3	-35.4	177.1	-160.8	-177.2	68.8	-176.8	-2.2	112.3	R815 L1345 Y1348 K1350 C1380 D1381 E1382 Y1386 H1522	R815-R1384 VanDerWaalsContact NH2-NH2 3.19Å; L1345-R1384 HydrophobicContact CD2-CG 4.12Å; Y1348-R1384 HydrophobicContact CD2-CG 4.34Å; Y1348-R1384 VanDerWaalsContact CE2-CD 3.45Å; Y1348-R1384 VanDerWaalsContact CE2-NH1 3.31Å; Y1348-R1384 HydrophobicContact CG-CG 4.35Å; Y1348-R1384 VanDerWaalsContact CZ-NH1 3.28Å; Y1348-R1384 VanDerWaalsContact CZ-NH2 3.31Å; Y1348-R1384 PolarHBondContact OH-NH1 3.1Å; Y1348-R1384 VanDerWaalsContact OH-NH1 3.09Å; K1350-R1384 HydrophobicContact CD-CB 4.48Å; K1350-R1384 HydrophobicContact CD-CG 4.26Å; K1350-R1384 VanDerWaalsContact NZ-CG 3.29Å; K1350-R1384 PolarHBondContact NZ-O 3.1Å; C1380-R1384 WeakPolarHBondContact O-CB 3.37Å; C1380-R1384 WeakPolarHBondContact O-CG 3.2Å; C1380-R1384 PolarHBondContact O-N 3.1Å; D1381-R1384 VanDerWaalsContact O-CB 3.29Å; D1381-R1384 WeakPolarHBondContact O-CB 3.44Å; D1381-R1384 PolarHBondContact O-N 3.28Å; D1381-R1384 IonicContact OD1-CZ 3.68Å; D1381-R1384 IonicContact OD1-NH1 3.3Å; D1381-R1384 PolarHBondContact OD1-NH1 3Å; D1381-R1384 IonicContact OD1-NH2 3.76Å; E1382-R1384 PolarHBondContact O-N 3.06Å; R1384-Y1386 VanDerWaalsContact C-N 3.27Å; R1384-Y1386 PolarHBondContact O-N 3.11Å; R1384-H1522 PolarHBondContact NH2-CE1 2.97Å; R1384-H1522 PolarHBondContact NH2-ND1 3.05Å; R1384-H1522 PolarHBondContact NH2-NE2 3.12Å
1385	L	68.6	Low	74.9	Confident	48.6 Å²	48.6	38.5 Å²	38.5	25%	0.254	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-13.4	-177.6	-66.6	171.9	0	0	0	113.4	D1381 E1382 L1383 S1387 R1413 T1519 P1523	D1381-L1385 WeakPolarHBondContact O-CG 3.42Å; D1381-L1385 PolarHBondContact O-N 3.06Å; E1382-L1385 PolarHBondContact O-N 3.13Å; E1382-L1385 VanDerWaalsContact O-N 3.14Å; L1383-L1385 VanDerWaalsContact C-N 3.32Å; L1383-L1385 PolarHBondContact O-N 3.15Å; L1385-S1387 PolarHBondContact O-N 3.18Å; L1385-R1413 VanDerWaalsContact CD1-NH2 3.32Å; L1385-T1519 HydrophobicContact CD2-CG2 4.02Å; L1385-P1523 HydrophobicContact CD1-CG 3.86Å
1386	Y	68.2	Low	74.5	Confident	51.4 Å²	51.4	38.6 Å²	38.6	20%	0.202	20%	0.2	C	C	.	.			trans	-79.7	119.4	179.6	-150.9	-102.6	0	0	0	111.5	W832 K1350 E1382 L1383 R1384 N1388 Y1389 Q1391 L1392 K1395	W832-Y1386 VanDerWaalsContact CZ2-O 3.25Å; W832-Y1386 WeakPolarHBondContact CZ2-O 3.38Å; W832-Y1386 PolarHBondContact NE1-O 3.25Å; K1350-Y1386 PolarHBondContact NZ-O 3.06Å; E1382-Y1386 HydrophobicContact CG-CE2 4.3Å; E1382-Y1386 WeakPolarHBondContact O-CD2 3.4Å; E1382-Y1386 WeakPolarHBondContact O-CE2 3.36Å; E1382-Y1386 PolarHBondContact O-N 3.08Å; E1382-Y1386 PolarHBondContact OE1-OH 3.12Å; L1383-Y1386 HydrophobicContact CD2-CD2 4.47Å; L1383-Y1386 WeakPolarHBondContact O-CB 3.29Å; L1383-Y1386 PolarHBondContact O-N 3.28Å; L1383-Y1386 VanDerWaalsContact O-N 3.1Å; R1384-Y1386 VanDerWaalsContact C-N 3.27Å; R1384-Y1386 PolarHBondContact O-N 3.11Å; Y1386-N1388 WeakPolarHBondContact CD1-O 3.49Å; Y1386-N1388 HydrophobicContact CE1-CB 4.13Å; Y1386-N1388 WeakPolarHBondContact CE1-O 3.36Å; Y1386-N1388 PolarHBondContact O-N 3.27Å; Y1386-Y1389 WeakPolarHBondContact O-CE1 3.38Å; Y1386-Y1389 PolarHBondContact O-OH 3.4Å; Y1386-Q1391 HydrophobicContact CE1-CB 4.27Å; Y1386-Q1391 VanDerWaalsContact OH-CB 3.27Å; Y1386-Q1391 WeakPolarHBondContact OH-CB 3.39Å; Y1386-Q1391 PolarHBondContact OH-OE1 3.09Å; Y1386-Q1391 VanDerWaalsContact OH-OE1 3.09Å; Y1386-L1392 HydrophobicContact CD1-CD1 4.31Å; Y1386-K1395 HydrophobicContact CD1-CB 4.32Å; Y1386-K1395 HydrophobicContact CD1-CD 3.54Å; Y1386-K1395 HydrophobicContact CD1-CG 4.16Å; Y1386-K1395 HydrophobicContact CD2-CD 4.09Å; Y1386-K1395 HydrophobicContact CD2-CG 4.07Å; Y1386-K1395 HydrophobicContact CE1-CB 4.03Å; Y1386-K1395 HydrophobicContact CE1-CD 3.62Å; Y1386-K1395 HydrophobicContact CE1-CG 4.27Å; Y1386-K1395 HydrophobicContact CE2-CB 4.48Å; Y1386-K1395 HydrophobicContact CE2-CD 3.95Å; Y1386-K1395 HydrophobicContact CE2-CG 4.17Å; Y1386-K1395 HydrophobicContact CG-CD 3.67Å; Y1386-K1395 HydrophobicContact CG-CG 4.15Å
1387	S	58	Low	74.2	Confident	56.6 Å²	56.6	46 Å²	46	40%	0.396	23%	0.233	S	C	.	.			trans	-80.9	-32.8	-177.8	46.6	0	0	0	0	114.1	D803 W832 L1385 Y1389	D803-S1387 VanDerWaalsContact CG-CB 3.46Å; D803-S1387 VanDerWaalsContact OD2-CB 3.25Å; D803-S1387 WeakPolarHBondContact OD2-CB 3.49Å; D803-S1387 PolarHBondContact OD2-OG 2.94Å; W832-S1387 WeakPolarHBondContact CZ2-O 3.39Å; W832-S1387 PolarHBondContact NE1-O 3.29Å; L1385-S1387 PolarHBondContact O-N 3.18Å; S1387-Y1389 VanDerWaalsContact C-N 3.32Å; S1387-Y1389 WeakPolarHBondContact O-CD2 3.49Å; S1387-Y1389 WeakPolarHBondContact O-CE2 3.22Å; S1387-Y1389 PolarHBondContact O-N 3.18Å
1388	N	61.8	Low	74.1	Confident	68 Å²	68	49 Å²	49	36%	0.364	25%	0.248	S	C	.	.			trans	-90.6	91.5	-172.2	-70.2	-7.7	0	0	0	113.4	Y1386 E1390 Q1391 L1392	Y1386-N1388 WeakPolarHBondContact CD1-O 3.49Å; Y1386-N1388 HydrophobicContact CE1-CB 4.13Å; Y1386-N1388 WeakPolarHBondContact CE1-O 3.36Å; Y1386-N1388 PolarHBondContact O-N 3.27Å; N1388-E1390 VanDerWaalsContact C-N 3.27Å; N1388-E1390 PolarHBondContact O-N 3.19Å; N1388-E1390 VanDerWaalsContact O-N 3.17Å; N1388-Q1391 HydrophobicContact CB-CG 4.47Å; N1388-Q1391 PolarHBondContact O-N 3.07Å; N1388-Q1391 VanDerWaalsContact O-N 3.14Å; N1388-L1392 PolarHBondContact O-N 3.07Å
1389	Y	58.2	Low	74.2	Confident	62 Å²	62	49.2 Å²	49.2	24%	0.243	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-61	-32	-177.3	-157.3	-86.1	0	0	0	114.5	R831 W832 E836 K1350 Q1360 Y1386 S1387 Q1391 L1392	R831-Y1389 HydrophobicContact CB-CD2 4.38Å; W832-Y1389 HydrophobicContact CB-CD2 4.3Å; W832-Y1389 HydrophobicContact CB-CG 4.28Å; W832-Y1389 VanDerWaalsContact CD1-CB 3.47Å; W832-Y1389 AromaticContact CD1-CD1 3.26Å; W832-Y1389 AromaticContact CD1-CG 3.34Å; W832-Y1389 HydrophobicContact CD2-CD1 4.13Å; W832-Y1389 HydrophobicContact CD2-CE1 4.17Å; W832-Y1389 HydrophobicContact CD2-CG 4.5Å; W832-Y1389 AromaticContact CE2-CD1 3.79Å; W832-Y1389 AromaticContact CE2-CE1 3.88Å; W832-Y1389 HydrophobicContact CE3-CG 4.48Å; W832-Y1389 AromaticContact CG-CD1 3.82Å; W832-Y1389 HydrophobicContact CG-CD1 3.82Å; W832-Y1389 HydrophobicContact CG-CD2 4.15Å; W832-Y1389 HydrophobicContact CG-CE1 4.26Å; W832-Y1389 AromaticContact CG-CG 3.77Å; W832-Y1389 HydrophobicContact CG-CG 3.77Å; W832-Y1389 HydrophobicContact CZ3-CD2 4.11Å; W832-Y1389 HydrophobicContact CZ3-CG 4.4Å; W832-Y1389 AromaticContact NE1-CD1 3.13Å; W832-Y1389 AromaticContact NE1-CE1 3.69Å; W832-Y1389 AromaticContact NE1-CG 3.76Å; E836-Y1389 HydrophobicContact CG-CD1 4.48Å; E836-Y1389 HydrophobicContact CG-CE1 4.18Å; K1350-Y1389 PolarHBondContact NZ-OH 3.19Å; Q1360-Y1389 PolarHBondContact OE1-OH 3.26Å; Y1386-Y1389 WeakPolarHBondContact O-CE1 3.38Å; Y1386-Y1389 PolarHBondContact O-OH 3.4Å; S1387-Y1389 VanDerWaalsContact C-N 3.32Å; S1387-Y1389 WeakPolarHBondContact O-CD2 3.49Å; S1387-Y1389 WeakPolarHBondContact O-CE2 3.22Å; S1387-Y1389 PolarHBondContact O-N 3.18Å; Y1389-Q1391 VanDerWaalsContact C-N 3.27Å; Y1389-Q1391 PolarHBondContact O-N 3.25Å; Y1389-Q1391 VanDerWaalsContact O-N 3.08Å; Y1389-L1392 HydrophobicContact CD2-CB 4.39Å; Y1389-L1392 HydrophobicContact CD2-CD2 3.74Å; Y1389-L1392 HydrophobicContact CE2-CD2 3.56Å; Y1389-L1392 VanDerWaalsContact CE2-CD2 3.47Å; Y1389-L1392 WeakPolarHBondContact O-CB 3.3Å; Y1389-L1392 PolarHBondContact O-N 3.36Å; Y1389-L1392 VanDerWaalsContact O-N 3.1Å
1390	E	57	Low	74.2	Confident	139.2 Å²	139.2	50 Å²	50	65%	0.65	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-58.2	-35	179.2	-65.2	-179.6	-179.6	0	0	112.6	V834 P835 N1388 L1392	V834-E1390 WeakPolarHBondContact CA-OE1 3.48Å; V834-E1390 PolarHBondContact N-OE1 3.44Å; P835-E1390 VanDerWaalsContact CD-OE1 3.3Å; P835-E1390 WeakPolarHBondContact CD-OE1 3.25Å; P835-E1390 VanDerWaalsContact N-OE1 3.11Å; N1388-E1390 VanDerWaalsContact C-N 3.27Å; N1388-E1390 PolarHBondContact O-N 3.19Å; N1388-E1390 VanDerWaalsContact O-N 3.17Å; E1390-L1392 VanDerWaalsContact C-N 3.32Å
1391	Q	66.8	Low	74.3	Confident	104.4 Å²	104.4	53.6 Å²	53.6	49%	0.488	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-91.5	1.1	179.1	-63.8	-177.6	0.7	0	0	112.8	Y1386 N1388 Y1389 G1393 A1394 K1395	Y1386-Q1391 HydrophobicContact CE1-CB 4.27Å; Y1386-Q1391 VanDerWaalsContact OH-CB 3.27Å; Y1386-Q1391 WeakPolarHBondContact OH-CB 3.39Å; Y1386-Q1391 PolarHBondContact OH-OE1 3.09Å; Y1386-Q1391 VanDerWaalsContact OH-OE1 3.09Å; N1388-Q1391 HydrophobicContact CB-CG 4.47Å; N1388-Q1391 PolarHBondContact O-N 3.07Å; N1388-Q1391 VanDerWaalsContact O-N 3.14Å; Y1389-Q1391 VanDerWaalsContact C-N 3.27Å; Y1389-Q1391 PolarHBondContact O-N 3.25Å; Y1389-Q1391 VanDerWaalsContact O-N 3.08Å; Q1391-G1393 VanDerWaalsContact C-N 3.3Å; Q1391-G1393 PolarHBondContact O-N 3.16Å; Q1391-G1393 VanDerWaalsContact O-N 3.13Å; Q1391-A1394 CarbonylContact O-C 3.58Å; Q1391-A1394 WeakPolarHBondContact O-CA 3.21Å; Q1391-A1394 WeakPolarHBondContact O-CB 3.31Å; Q1391-A1394 PolarHBondContact O-N 2.99Å; Q1391-A1394 VanDerWaalsContact O-N 3.14Å; Q1391-K1395 HydrophobicContact CB-CD 4.38Å; Q1391-K1395 WeakPolarHBondContact O-CG 3.4Å; Q1391-K1395 PolarHBondContact O-N 3.25Å
1392	L	72.6	Confident	74.7	Confident	9.2 Å²	9.2	54.9 Å²	54.9	5%	0.048	28%	0.281	C	S	.	.	H	α-helix	trans	-55.9	-39.8	-177.6	-172.8	69.8	0	0	0	111.8	W832 L1352 L1383 Y1386 N1388 Y1389 E1390 A1394 K1395 L1396	W832-L1392 HydrophobicContact CZ2-CD1 4.33Å; L1352-L1392 HydrophobicContact CD2-CD2 4.03Å; L1383-L1392 HydrophobicContact CD2-CD1 3.79Å; Y1386-L1392 HydrophobicContact CD1-CD1 4.31Å; N1388-L1392 PolarHBondContact O-N 3.07Å; Y1389-L1392 HydrophobicContact CD2-CB 4.39Å; Y1389-L1392 HydrophobicContact CD2-CD2 3.74Å; Y1389-L1392 HydrophobicContact CE2-CD2 3.56Å; Y1389-L1392 VanDerWaalsContact CE2-CD2 3.47Å; Y1389-L1392 WeakPolarHBondContact O-CB 3.3Å; Y1389-L1392 PolarHBondContact O-N 3.36Å; Y1389-L1392 VanDerWaalsContact O-N 3.1Å; E1390-L1392 VanDerWaalsContact C-N 3.32Å; L1392-A1394 VanDerWaalsContact C-N 3.32Å; L1392-A1394 PolarHBondContact O-N 3.17Å; L1392-K1395 PolarHBondContact O-N 3.16Å; L1392-L1396 HydrophobicContact CD2-CD1 4.45Å; L1392-L1396 HydrophobicContact CG-CD1 4.06Å; L1392-L1396 HydrophobicContact CG-CG 4.39Å; L1392-L1396 VanDerWaalsContact O-CB 3.27Å; L1392-L1396 WeakPolarHBondContact O-CB 3.38Å; L1392-L1396 WeakPolarHBondContact O-CD1 3.49Å; L1392-L1396 VanDerWaalsContact O-CG 3.26Å; L1392-L1396 WeakPolarHBondContact O-CG 3.25Å; L1392-L1396 PolarHBondContact O-N 3.03Å
1393	G	71.8	Confident	75	Confident	29.4 Å²	29.4	54.6 Å²	54.6	30%	0.303	28%	0.28	S	S	.	.	H	α-helix	trans	-63.9	-36.4	176.8	0	0	0	0	0	113.6	Q1391 K1397	Q1391-G1393 VanDerWaalsContact C-N 3.3Å; Q1391-G1393 PolarHBondContact O-N 3.16Å; Q1391-G1393 VanDerWaalsContact O-N 3.13Å; G1393-K1397 WeakPolarHBondContact O-CG 3.31Å; G1393-K1397 PolarHBondContact O-N 3.09Å
1394	A	75.9	Confident	75.2	Confident	51.2 Å²	51.2	56.5 Å²	56.5	42%	0.423	29%	0.294	S	S	.	.	H	α-helix	trans	-73.7	-42.4	175	0	0	0	0	0	111.1	Q1391 L1392 L1396 K1397 Q1398	Q1391-A1394 CarbonylContact O-C 3.58Å; Q1391-A1394 WeakPolarHBondContact O-CA 3.21Å; Q1391-A1394 WeakPolarHBondContact O-CB 3.31Å; Q1391-A1394 PolarHBondContact O-N 2.99Å; Q1391-A1394 VanDerWaalsContact O-N 3.14Å; L1392-A1394 VanDerWaalsContact C-N 3.32Å; L1392-A1394 PolarHBondContact O-N 3.17Å; A1394-L1396 PolarHBondContact O-N 3.13Å; A1394-K1397 WeakPolarHBondContact O-CB 3.26Å; A1394-K1397 PolarHBondContact O-N 3.33Å; A1394-K1397 VanDerWaalsContact O-N 3.12Å; A1394-Q1398 WeakPolarHBondContact O-CG 3.31Å; A1394-Q1398 PolarHBondContact O-N 3.2Å; A1394-Q1398 VanDerWaalsContact O-N 3.09Å
1395	K	77.3	Confident	75.8	Confident	47.8 Å²	47.8	56.7 Å²	56.7	21%	0.208	30%	0.301	C	S	.	.	H	α-helix	trans	-63.6	-40.2	177.2	-158.2	77.4	177.3	178.8	0	112.3	Y1386 Q1391 L1392 K1397 Q1398 L1399	Y1386-K1395 HydrophobicContact CD1-CB 4.32Å; Y1386-K1395 HydrophobicContact CD1-CD 3.54Å; Y1386-K1395 HydrophobicContact CD1-CG 4.16Å; Y1386-K1395 HydrophobicContact CD2-CD 4.09Å; Y1386-K1395 HydrophobicContact CD2-CG 4.07Å; Y1386-K1395 HydrophobicContact CE1-CB 4.03Å; Y1386-K1395 HydrophobicContact CE1-CD 3.62Å; Y1386-K1395 HydrophobicContact CE1-CG 4.27Å; Y1386-K1395 HydrophobicContact CE2-CB 4.48Å; Y1386-K1395 HydrophobicContact CE2-CD 3.95Å; Y1386-K1395 HydrophobicContact CE2-CG 4.17Å; Y1386-K1395 HydrophobicContact CG-CD 3.67Å; Y1386-K1395 HydrophobicContact CG-CG 4.15Å; Q1391-K1395 HydrophobicContact CB-CD 4.38Å; Q1391-K1395 WeakPolarHBondContact O-CG 3.4Å; Q1391-K1395 PolarHBondContact O-N 3.25Å; L1392-K1395 PolarHBondContact O-N 3.16Å; K1395-K1397 VanDerWaalsContact C-N 3.27Å; K1395-K1397 PolarHBondContact O-N 3.2Å; K1395-Q1398 CarbonylContact O-C 3.54Å; K1395-Q1398 PolarHBondContact O-N 3.07Å; K1395-Q1398 VanDerWaalsContact O-N 3.09Å; K1395-L1399 WeakPolarHBondContact O-CB 3.34Å; K1395-L1399 PolarHBondContact O-N 3.08Å
1396	L	82.4	Confident	76.8	Confident	2.2 Å²	2.2	54.5 Å²	54.5	1%	0.012	29%	0.289	C	S	.	.	H	α-helix	trans	-59.8	-35.8	173.1	-80.9	165.8	0	0	0	112.7	L1352 Q1360 V1363 L1364 K1367 L1383 L1392 A1394 L1399	L1352-L1396 HydrophobicContact CD2-CD1 4.4Å; Q1360-L1396 HydrophobicContact CB-CD1 3.6Å; Q1360-L1396 VanDerWaalsContact CB-CD1 3.46Å; Q1360-L1396 HydrophobicContact CG-CD1 3.75Å; V1363-L1396 HydrophobicContact CG1-CB 4.27Å; L1364-L1396 HydrophobicContact CB-CD2 4.37Å; K1367-L1396 WeakPolarHBondContact CE-O 3.34Å; L1383-L1396 HydrophobicContact CD1-CD2 3.66Å; L1383-L1396 HydrophobicContact CD2-CD2 3.77Å; L1383-L1396 HydrophobicContact CD2-CG 4.08Å; L1383-L1396 HydrophobicContact CG-CD2 4.35Å; L1392-L1396 HydrophobicContact CD2-CD1 4.45Å; L1392-L1396 HydrophobicContact CG-CD1 4.06Å; L1392-L1396 HydrophobicContact CG-CG 4.39Å; L1392-L1396 VanDerWaalsContact O-CB 3.27Å; L1392-L1396 WeakPolarHBondContact O-CB 3.38Å; L1392-L1396 WeakPolarHBondContact O-CD1 3.49Å; L1392-L1396 VanDerWaalsContact O-CG 3.26Å; L1392-L1396 WeakPolarHBondContact O-CG 3.25Å; L1392-L1396 PolarHBondContact O-N 3.03Å; A1394-L1396 PolarHBondContact O-N 3.13Å; L1396-L1399 HydrophobicContact CD2-CD1 4.13Å; L1396-L1399 WeakPolarHBondContact O-CB 3.39Å
1397	K	82	Confident	77.7	Confident	157.8 Å²	157.8	52.1 Å²	52.1	69%	0.686	28%	0.28	S	S	*	.	H	α-helix	trans	-72.1	-38.2	174.4	-71.2	177.4	-179.4	-178.3	0	111.9	V1363 K1367 G1393 A1394 K1395 L1399	V1363-K1397 HydrophobicContact CG1-CG 4.39Å; K1367-K1397 PolarHBondContact NZ-O 3.25Å; G1393-K1397 WeakPolarHBondContact O-CG 3.31Å; G1393-K1397 PolarHBondContact O-N 3.09Å; A1394-K1397 WeakPolarHBondContact O-CB 3.26Å; A1394-K1397 PolarHBondContact O-N 3.33Å; A1394-K1397 VanDerWaalsContact O-N 3.12Å; K1395-K1397 VanDerWaalsContact C-N 3.27Å; K1395-K1397 PolarHBondContact O-N 3.2Å; K1397-L1399 VanDerWaalsContact C-N 3.3Å; K1397-L1399 PolarHBondContact O-N 3.42Å
1398	Q	84	Confident	79.1	Confident	136.2 Å²	136.2	50.8 Å²	50.8	64%	0.636	27%	0.268	S	S	*	.	H	α-helix	trans	-73.3	-23.3	177.5	-70.5	174.2	-1.5	0	0	113.5	A1394 K1395	A1394-Q1398 WeakPolarHBondContact O-CG 3.31Å; A1394-Q1398 PolarHBondContact O-N 3.2Å; A1394-Q1398 VanDerWaalsContact O-N 3.09Å; K1395-Q1398 CarbonylContact O-C 3.54Å; K1395-Q1398 PolarHBondContact O-N 3.07Å; K1395-Q1398 VanDerWaalsContact O-N 3.09Å
1399	L	85.9	Confident	80.2	Confident	6.4 Å²	6.4	50.2 Å²	50.2	3%	0.034	27%	0.265	C	S	.	.	S	Bend	trans	-54.6	127.7	-179.7	-109.4	160.2	0	0	0	110.4	L1364 K1367 Y1375 A1379 E1382 L1383 K1395 L1396 K1397 L1406	L1364-L1399 HydrophobicContact CD1-CD1 4.4Å; K1367-L1399 WeakPolarHBondContact CE-O 3.29Å; K1367-L1399 PolarHBondContact NZ-O 2.95Å; Y1375-L1399 WeakPolarHBondContact OH-CD2 3.47Å; A1379-L1399 HydrophobicContact CB-CD1 4.48Å; A1379-L1399 HydrophobicContact CB-CD2 4.1Å; E1382-L1399 HydrophobicContact CG-CD2 4.31Å; L1383-L1399 HydrophobicContact CD1-CD1 4.19Å; L1383-L1399 HydrophobicContact CD2-CD1 3.63Å; L1383-L1399 VanDerWaalsContact CD2-CD1 3.43Å; L1383-L1399 HydrophobicContact CG-CD1 3.84Å; K1395-L1399 WeakPolarHBondContact O-CB 3.34Å; K1395-L1399 PolarHBondContact O-N 3.08Å; L1396-L1399 HydrophobicContact CD2-CD1 4.13Å; L1396-L1399 WeakPolarHBondContact O-CB 3.39Å; K1397-L1399 VanDerWaalsContact C-N 3.3Å; K1397-L1399 PolarHBondContact O-N 3.42Å; L1399-L1406 HydrophobicContact CD2-CD1 3.55Å; L1399-L1406 VanDerWaalsContact CD2-CD1 3.5Å; L1399-L1406 HydrophobicContact CG-CD1 4.15Å
1400	P	88.2	Confident	81.6	Confident	17.4 Å²	17.4	47.4 Å²	47.4	11%	0.113	25%	0.254	C	S	.	.			trans	-63.4	150.4	-175.9	-25	34	0	0	0	113.9	Y1375 T1402 S1405 L1406 D1409	Y1375-P1400 WeakPolarHBondContact CE2-O 3.25Å; Y1375-P1400 PolarHBondContact OH-O 3.22Å; P1400-T1402 VanDerWaalsContact C-N 3.33Å; P1400-T1402 PolarHBondContact O-N 3.04Å; P1400-S1405 VanDerWaalsContact CB-CB 3.44Å; P1400-S1405 WeakPolarHBondContact CB-OG 3.2Å; P1400-L1406 HydrophobicContact CB-CB 4.45Å; P1400-D1409 VanDerWaalsContact CD-OD2 3.29Å; P1400-D1409 WeakPolarHBondContact CD-OD2 3.29Å; P1400-D1409 HydrophobicContact CG-CB 4.11Å; P1400-D1409 WeakPolarHBondContact CG-OD2 3.41Å
1401	D	86.6	Confident	83	Confident	77.4 Å²	77.4	40.9 Å²	40.9	41%	0.414	22%	0.224	S	C	.	.	S	Bend	trans	-79.6	-12.9	-174.9	-65.4	-15.4	0	0	0	114.2	K1367 R1368 D1369	K1367-D1401 HydrophobicContact CD-CB 4.45Å; K1367-D1401 WeakPolarHBondContact CD-OD1 3.46Å; K1367-D1401 WeakPolarHBondContact CE-OD1 3.37Å; K1367-D1401 IonicContact NZ-OD1 3.18Å; K1367-D1401 PolarHBondContact NZ-OD1 3.02Å; R1368-D1401 HydrophobicContact CB-CB 4.12Å; R1368-D1401 HydrophobicContact CG-CB 4.15Å; R1368-D1401 PolarHBondContact N-O 3.04Å; D1369-D1401 PolarHBondContact N-O 3.14Å; D1369-D1401 VanDerWaalsContact N-O 3.11Å
1402	T	87.5	Confident	83.8	Confident	36.2 Å²	36.2	39.3 Å²	39.3	22%	0.222	22%	0.215	C	C	.	.	S	Bend	trans	-126.6	154.9	-175	64.8	0	0	0	0	113.1	D1369 P1400 S1404 S1405 L1406	D1369-T1402 WeakPolarHBondContact OD2-CA 3.44Å; D1369-T1402 VanDerWaalsContact OD2-CB 3.28Å; D1369-T1402 WeakPolarHBondContact OD2-CB 3.36Å; P1400-T1402 VanDerWaalsContact C-N 3.33Å; P1400-T1402 PolarHBondContact O-N 3.04Å; T1402-S1404 VanDerWaalsContact C-N 3.33Å; T1402-S1404 PolarHBondContact O-N 3.11Å; T1402-S1404 PolarHBondContact OG1-OG 3.43Å; T1402-S1405 PolarHBondContact N-OG 3.3Å; T1402-S1405 PolarHBondContact O-N 3.27Å; T1402-S1405 PolarHBondContact O-OG 3.1Å; T1402-S1405 VanDerWaalsContact O-OG 3.06Å; T1402-S1405 WeakPolarHBondContact OG1-CB 3.07Å; T1402-S1405 PolarHBondContact OG1-N 3.17Å; T1402-S1405 PolarHBondContact OG1-OG 3.08Å; T1402-L1406 WeakPolarHBondContact O-CB 3.28Å; T1402-L1406 PolarHBondContact O-N 3.26Å
1403	I	86.8	Confident	84.4	Confident	3.4 Å²	3.4	41.8 Å²	41.8	2%	0.017	22%	0.224	C	C	.	.	H	α-helix	trans	-58	-46	177.9	-63.7	172.6	0	0	0	110.8	D1369 I1372 L1374 Y1375 L1378 S1405 L1406 V1407 E1572 L1576	D1369-I1403 HydrophobicContact CB-CG1 4.28Å; D1369-I1403 PolarHBondContact OD2-N 3.18Å; I1372-I1403 HydrophobicContact CB-CD1 4.42Å; I1372-I1403 HydrophobicContact CD1-CD1 4.12Å; I1372-I1403 HydrophobicContact CG2-CD1 4.08Å; L1374-I1403 HydrophobicContact CB-CD1 4.41Å; L1374-I1403 HydrophobicContact CD2-CD1 4.38Å; L1374-I1403 HydrophobicContact CG-CD1 4.48Å; Y1375-I1403 HydrophobicContact CD2-CG1 3.98Å; Y1375-I1403 HydrophobicContact CG-CG1 4.39Å; L1378-I1403 HydrophobicContact CD1-CG2 4.06Å; I1403-S1405 VanDerWaalsContact C-N 3.33Å; I1403-S1405 PolarHBondContact O-N 3.06Å; I1403-L1406 PolarHBondContact O-N 3.09Å; I1403-V1407 HydrophobicContact CG2-CG2 4.34Å; I1403-V1407 WeakPolarHBondContact O-CG2 3.27Å; I1403-V1407 PolarHBondContact O-N 3.16Å; I1403-E1572 HydrophobicContact CG2-CG 4.48Å; I1403-L1576 HydrophobicContact CG2-CD1 4.16Å
1404	S	86.1	Confident	84.9	Confident	45.2 Å²	45.2	40.4 Å²	40.4	32%	0.316	21%	0.21	S	C	.	.	H	α-helix	trans	-58.8	-44.2	-179.6	-33.4	0	0	0	0	112.9	T1402 L1406 V1407 I1408 L1576	T1402-S1404 VanDerWaalsContact C-N 3.33Å; T1402-S1404 PolarHBondContact O-N 3.11Å; T1402-S1404 PolarHBondContact OG1-OG 3.43Å; S1404-L1406 VanDerWaalsContact C-N 3.35Å; S1404-V1407 PolarHBondContact O-N 3.12Å; S1404-I1408 WeakPolarHBondContact O-CD1 3.35Å; S1404-I1408 VanDerWaalsContact O-CG1 3.28Å; S1404-I1408 WeakPolarHBondContact O-CG1 3.37Å; S1404-I1408 PolarHBondContact O-N 3.32Å; S1404-L1576 WeakPolarHBondContact OG-CD2 3.28Å
1405	S	87	Confident	85.2	Confident	41.2 Å²	41.2	39.1 Å²	39.1	29%	0.288	20%	0.195	S	C	.	.	H	α-helix	trans	-73.3	-34.4	179.9	13.6	0	0	0	0	112	P1400 T1402 I1403 I1408 D1409	P1400-S1405 VanDerWaalsContact CB-CB 3.44Å; P1400-S1405 WeakPolarHBondContact CB-OG 3.2Å; T1402-S1405 PolarHBondContact N-OG 3.3Å; T1402-S1405 PolarHBondContact O-N 3.27Å; T1402-S1405 PolarHBondContact O-OG 3.1Å; T1402-S1405 VanDerWaalsContact O-OG 3.06Å; T1402-S1405 WeakPolarHBondContact OG1-CB 3.07Å; T1402-S1405 PolarHBondContact OG1-N 3.17Å; T1402-S1405 PolarHBondContact OG1-OG 3.08Å; I1403-S1405 VanDerWaalsContact C-N 3.33Å; I1403-S1405 PolarHBondContact O-N 3.06Å; S1405-I1408 WeakPolarHBondContact O-CB 3.49Å; S1405-I1408 PolarHBondContact O-N 3.19Å; S1405-D1409 PolarHBondContact O-N 3.22Å
1406	L	88.1	Confident	85.3	Confident	2 Å²	2	41.8 Å²	41.8	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-64	-44	174.6	-174.8	63.8	0	0	0	111.9	Y1375 L1378 A1379 E1382 L1399 P1400 T1402 I1403 S1404 I1408 D1409 V1410	Y1375-L1406 HydrophobicContact CD2-CD2 4.16Å; Y1375-L1406 HydrophobicContact CE2-CD2 4.08Å; L1378-L1406 HydrophobicContact CB-CD2 3.53Å; L1378-L1406 VanDerWaalsContact CB-CD2 3.49Å; L1378-L1406 HydrophobicContact CB-CG 4.44Å; L1378-L1406 HydrophobicContact CD1-CD2 4.45Å; A1379-L1406 HydrophobicContact CB-CD2 4.17Å; E1382-L1406 HydrophobicContact CG-CD1 4.47Å; L1399-L1406 HydrophobicContact CD2-CD1 3.55Å; L1399-L1406 VanDerWaalsContact CD2-CD1 3.5Å; L1399-L1406 HydrophobicContact CG-CD1 4.15Å; P1400-L1406 HydrophobicContact CB-CB 4.45Å; T1402-L1406 WeakPolarHBondContact O-CB 3.28Å; T1402-L1406 PolarHBondContact O-N 3.26Å; I1403-L1406 PolarHBondContact O-N 3.09Å; S1404-L1406 VanDerWaalsContact C-N 3.35Å; L1406-I1408 VanDerWaalsContact C-N 3.33Å; L1406-I1408 PolarHBondContact O-N 3.21Å; L1406-D1409 PolarHBondContact O-N 3.01Å; L1406-D1409 VanDerWaalsContact O-N 3.13Å; L1406-V1410 WeakPolarHBondContact O-CB 3.4Å; L1406-V1410 VanDerWaalsContact O-CG2 3.26Å; L1406-V1410 WeakPolarHBondContact O-CG2 3.36Å; L1406-V1410 PolarHBondContact O-N 3.11Å
1407	V	87.9	Confident	84.8	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-60.6	-42.8	175.7	173.2	0	0	0	0	111	L1378 I1403 S1404 D1409 V1410 V1411 L1524 I1573 L1576 V1577 I1580	L1378-V1407 HydrophobicContact CD1-CG2 4.43Å; I1403-V1407 HydrophobicContact CG2-CG2 4.34Å; I1403-V1407 WeakPolarHBondContact O-CG2 3.27Å; I1403-V1407 PolarHBondContact O-N 3.16Å; S1404-V1407 PolarHBondContact O-N 3.12Å; V1407-D1409 VanDerWaalsContact C-N 3.3Å; V1407-D1409 PolarHBondContact O-N 3.13Å; V1407-V1410 WeakPolarHBondContact O-CB 3.37Å; V1407-V1410 PolarHBondContact O-N 3.2Å; V1407-V1411 HydrophobicContact CG1-CG2 4.45Å; V1407-V1411 VanDerWaalsContact O-CG2 3.32Å; V1407-V1411 WeakPolarHBondContact O-CG2 3.37Å; V1407-V1411 PolarHBondContact O-N 3.2Å; V1407-L1524 HydrophobicContact CB-CD2 4.41Å; V1407-L1524 HydrophobicContact CG1-CD1 4.33Å; V1407-L1524 HydrophobicContact CG1-CD2 4.11Å; V1407-L1524 HydrophobicContact CG2-CD2 3.99Å; V1407-I1573 HydrophobicContact CG2-CG1 4.1Å; V1407-I1573 HydrophobicContact CG2-CG2 4.49Å; V1407-L1576 HydrophobicContact CB-CD1 4.41Å; V1407-L1576 HydrophobicContact CG1-CB 4.34Å; V1407-L1576 HydrophobicContact CG2-CD1 4.21Å; V1407-V1577 HydrophobicContact CG1-CG2 3.96Å; V1407-I1580 HydrophobicContact CG1-CD1 3.93Å
1408	I	87.2	Confident	84.5	Confident	31 Å²	31	38.6 Å²	38.6	16%	0.159	22%	0.216	C	C	.	.	H	α-helix	trans	-58.7	-44	175.8	-69.2	165.5	0	0	0	111.1	S1404 S1405 L1406 V1411 K1412 I1580 Y1587	S1404-I1408 WeakPolarHBondContact O-CD1 3.35Å; S1404-I1408 VanDerWaalsContact O-CG1 3.28Å; S1404-I1408 WeakPolarHBondContact O-CG1 3.37Å; S1404-I1408 PolarHBondContact O-N 3.32Å; S1405-I1408 WeakPolarHBondContact O-CB 3.49Å; S1405-I1408 PolarHBondContact O-N 3.19Å; L1406-I1408 VanDerWaalsContact C-N 3.33Å; L1406-I1408 PolarHBondContact O-N 3.21Å; I1408-V1411 PolarHBondContact O-N 2.98Å; I1408-K1412 HydrophobicContact CG2-CD 4.03Å; I1408-K1412 VanDerWaalsContact CG2-CE 3.48Å; I1408-K1412 HydrophobicContact CG2-CG 4.4Å; I1408-K1412 WeakPolarHBondContact O-CB 3.38Å; I1408-K1412 VanDerWaalsContact O-CG 3.31Å; I1408-K1412 WeakPolarHBondContact O-CG 3.27Å; I1408-K1412 PolarHBondContact O-N 3.04Å; I1408-I1580 HydrophobicContact CB-CD1 4.44Å; I1408-I1580 HydrophobicContact CG1-CD1 3.59Å; I1408-I1580 HydrophobicContact CG1-CG1 3.94Å; I1408-Y1587 HydrophobicContact CD1-CD1 3.89Å; I1408-Y1587 HydrophobicContact CD1-CE1 3.69Å; I1408-Y1587 HydrophobicContact CG1-CE1 4.33Å
1409	D	86.1	Confident	84.1	Confident	55.6 Å²	55.6	33.2 Å²	33.2	30%	0.297	20%	0.196	S	C	.	.	H	α-helix	trans	-69.2	-36.4	-179.9	-82.8	8.1	0	0	0	112.7	P1400 S1405 L1406 V1407 K1412 R1413	P1400-D1409 VanDerWaalsContact CD-OD2 3.29Å; P1400-D1409 WeakPolarHBondContact CD-OD2 3.29Å; P1400-D1409 HydrophobicContact CG-CB 4.11Å; P1400-D1409 WeakPolarHBondContact CG-OD2 3.41Å; S1405-D1409 PolarHBondContact O-N 3.22Å; L1406-D1409 PolarHBondContact O-N 3.01Å; L1406-D1409 VanDerWaalsContact O-N 3.13Å; V1407-D1409 VanDerWaalsContact C-N 3.3Å; V1407-D1409 PolarHBondContact O-N 3.13Å; D1409-K1412 PolarHBondContact O-N 2.96Å; D1409-K1412 IonicContact OD1-NZ 3.33Å; D1409-K1412 PolarHBondContact OD1-NZ 3.2Å; D1409-R1413 VanDerWaalsContact O-CB 3.3Å; D1409-R1413 WeakPolarHBondContact O-CB 3.26Å; D1409-R1413 PolarHBondContact O-N 3.14Å
1410	V	86.4	Confident	83.8	Confident	1.2 Å²	1.2	34.4 Å²	34.4	1%	0.007	21%	0.206	C	C	.	.	H	α-helix	trans	-60.4	-48.2	171.8	173.6	0	0	0	0	110.5	E1382 L1406 V1407 K1412 R1413 V1414 P1523 L1524	E1382-V1410 HydrophobicContact CG-CG2 4.37Å; E1382-V1410 WeakPolarHBondContact OE2-CG2 3.45Å; L1406-V1410 WeakPolarHBondContact O-CB 3.4Å; L1406-V1410 VanDerWaalsContact O-CG2 3.26Å; L1406-V1410 WeakPolarHBondContact O-CG2 3.36Å; L1406-V1410 PolarHBondContact O-N 3.11Å; V1407-V1410 WeakPolarHBondContact O-CB 3.37Å; V1407-V1410 PolarHBondContact O-N 3.2Å; V1410-K1412 PolarHBondContact O-N 3.42Å; V1410-R1413 WeakPolarHBondContact O-CB 3.36Å; V1410-R1413 PolarHBondContact O-N 3.2Å; V1410-V1414 WeakPolarHBondContact O-CG2 3.3Å; V1410-V1414 PolarHBondContact O-N 3.02Å; V1410-V1414 VanDerWaalsContact O-N 3.13Å; V1410-P1523 HydrophobicContact CG1-CB 4.5Å; V1410-P1523 HydrophobicContact CG1-CG 4.44Å; V1410-L1524 HydrophobicContact CB-CD1 4.38Å; V1410-L1524 HydrophobicContact CB-CD2 4.33Å; V1410-L1524 HydrophobicContact CB-CG 4.47Å; V1410-L1524 HydrophobicContact CG1-CD1 3.86Å; V1410-L1524 HydrophobicContact CG1-CD2 4.1Å; V1410-L1524 HydrophobicContact CG1-CG 3.79Å; V1410-L1524 HydrophobicContact CG2-CD2 4.41Å
1411	V	87	Confident	83.5	Confident	3.4 Å²	3.4	35.2 Å²	35.2	2%	0.021	21%	0.208	C	C	.	.	H	α-helix	trans	-61.2	-48.9	178	174.4	0	0	0	0	110.5	V1407 I1408 R1413 V1414 E1415 T1423 L1427 L1524 I1580	V1407-V1411 HydrophobicContact CG1-CG2 4.45Å; V1407-V1411 VanDerWaalsContact O-CG2 3.32Å; V1407-V1411 WeakPolarHBondContact O-CG2 3.37Å; V1407-V1411 PolarHBondContact O-N 3.2Å; I1408-V1411 PolarHBondContact O-N 2.98Å; V1411-R1413 VanDerWaalsContact C-N 3.31Å; V1411-R1413 PolarHBondContact O-N 3.24Å; V1411-V1414 PolarHBondContact O-N 3.14Å; V1411-V1414 VanDerWaalsContact O-N 3.11Å; V1411-E1415 HydrophobicContact CG1-CG 4.12Å; V1411-E1415 WeakPolarHBondContact O-CG 3.37Å; V1411-E1415 PolarHBondContact O-N 3.26Å; V1411-T1423 HydrophobicContact CG1-CG2 4.41Å; V1411-L1427 HydrophobicContact CG1-CD1 4Å; V1411-L1427 HydrophobicContact CG2-CD1 3.85Å; V1411-L1524 HydrophobicContact CG2-CD1 3.92Å; V1411-I1580 HydrophobicContact CG1-CG2 4.35Å; V1411-I1580 HydrophobicContact CG2-CD1 4.44Å
1412	K	84.2	Confident	83.4	Confident	70.6 Å²	70.6	32.2 Å²	32.2	31%	0.307	19%	0.192	S	C	.	.	H	α-helix	trans	-57.4	-41	177.3	-76	174.1	-177.5	168.3	0	112.8	I1408 D1409 V1410 V1414 E1415 C1416	I1408-K1412 HydrophobicContact CG2-CD 4.03Å; I1408-K1412 VanDerWaalsContact CG2-CE 3.48Å; I1408-K1412 HydrophobicContact CG2-CG 4.4Å; I1408-K1412 WeakPolarHBondContact O-CB 3.38Å; I1408-K1412 VanDerWaalsContact O-CG 3.31Å; I1408-K1412 WeakPolarHBondContact O-CG 3.27Å; I1408-K1412 PolarHBondContact O-N 3.04Å; D1409-K1412 PolarHBondContact O-N 2.96Å; D1409-K1412 IonicContact OD1-NZ 3.33Å; D1409-K1412 PolarHBondContact OD1-NZ 3.2Å; V1410-K1412 PolarHBondContact O-N 3.42Å; K1412-V1414 VanDerWaalsContact C-N 3.31Å; K1412-V1414 PolarHBondContact O-N 3.24Å; K1412-E1415 PolarHBondContact O-N 3.13Å; K1412-C1416 WeakPolarHBondContact O-CB 3.37Å; K1412-C1416 PolarHBondContact O-N 3.16Å; K1412-C1416 PolarHBondContact O-SG 3.17Å
1413	R	84.4	Confident	83.3	Confident	63.2 Å²	63.2	30.4 Å²	30.4	24%	0.238	18%	0.181	C	C	.	.	H	α-helix	trans	-60	-44.3	176.8	176.8	-163.9	42.1	57.7	-1.1	110.8	E1382 L1385 D1409 V1410 V1411 C1416 S1417 G1520	E1382-R1413 VanDerWaalsContact CD-NE 3.34Å; E1382-R1413 VanDerWaalsContact OE1-CD 3.25Å; E1382-R1413 WeakPolarHBondContact OE1-CD 3.4Å; E1382-R1413 IonicContact OE1-CZ 3.18Å; E1382-R1413 IonicContact OE1-NE 3.03Å; E1382-R1413 PolarHBondContact OE1-NE 2.98Å; E1382-R1413 IonicContact OE1-NH1 2.7Å; E1382-R1413 PolarHBondContact OE1-NH1 2.99Å; E1382-R1413 IonicContact OE1-NH2 3.12Å; E1382-R1413 IonicContact OE2-CZ 3.3Å; E1382-R1413 IonicContact OE2-NE 3.16Å; E1382-R1413 PolarHBondContact OE2-NE 2.81Å; E1382-R1413 VanDerWaalsContact OE2-NE 3.1Å; E1382-R1413 IonicContact OE2-NH1 3.7Å; E1382-R1413 PolarHBondContact OE2-NH1 2.99Å; E1382-R1413 IonicContact OE2-NH2 3.2Å; E1382-R1413 PolarHBondContact OE2-NH2 2.97Å; L1385-R1413 VanDerWaalsContact CD1-NH2 3.32Å; D1409-R1413 VanDerWaalsContact O-CB 3.3Å; D1409-R1413 WeakPolarHBondContact O-CB 3.26Å; D1409-R1413 PolarHBondContact O-N 3.14Å; V1410-R1413 WeakPolarHBondContact O-CB 3.36Å; V1410-R1413 PolarHBondContact O-N 3.2Å; V1411-R1413 VanDerWaalsContact C-N 3.31Å; V1411-R1413 PolarHBondContact O-N 3.24Å; R1413-C1416 WeakPolarHBondContact O-CB 3.38Å; R1413-C1416 PolarHBondContact O-N 3.11Å; R1413-S1417 PolarHBondContact O-N 3.12Å; R1413-S1417 VanDerWaalsContact O-N 3.13Å; R1413-S1417 PolarHBondContact O-OG 3.11Å; R1413-G1520 PolarHBondContact NH1-O 3.16Å; R1413-G1520 PolarHBondContact NH2-O 3.16Å
1414	V	82.2	Confident	83.2	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-71	-41	179	-178.8	0	0	0	0	111.4	V1410 V1411 K1412 C1416 S1417 C1418 T1423 L1517 G1520 L1521	V1410-V1414 WeakPolarHBondContact O-CG2 3.3Å; V1410-V1414 PolarHBondContact O-N 3.02Å; V1410-V1414 VanDerWaalsContact O-N 3.13Å; V1411-V1414 PolarHBondContact O-N 3.14Å; V1411-V1414 VanDerWaalsContact O-N 3.11Å; K1412-V1414 VanDerWaalsContact C-N 3.31Å; K1412-V1414 PolarHBondContact O-N 3.24Å; V1414-C1416 VanDerWaalsContact C-N 3.27Å; V1414-C1416 PolarHBondContact O-N 3.16Å; V1414-S1417 WeakPolarHBondContact CA-OG 3.27Å; V1414-S1417 WeakPolarHBondContact O-CA 3.43Å; V1414-S1417 PolarHBondContact O-N 3.21Å; V1414-S1417 VanDerWaalsContact O-N 3.11Å; V1414-S1417 PolarHBondContact O-OG 3.06Å; V1414-S1417 VanDerWaalsContact O-OG 3.12Å; V1414-C1418 HydrophobicContact CG1-CB 4.47Å; V1414-C1418 PolarHBondContact O-N 3.01Å; V1414-T1423 HydrophobicContact CB-CG2 4.09Å; V1414-T1423 HydrophobicContact CG1-CG2 3.79Å; V1414-L1517 HydrophobicContact CG1-CD1 3.6Å; V1414-G1520 VanDerWaalsContact CG2-C 3.45Å; V1414-G1520 WeakPolarHBondContact CG2-O 3.22Å; V1414-L1521 HydrophobicContact CB-CD2 4.11Å; V1414-L1521 HydrophobicContact CG1-CD2 4.05Å; V1414-L1521 HydrophobicContact CG1-CG 4.08Å; V1414-L1521 HydrophobicContact CG2-CD2 3.93Å; V1414-L1521 HydrophobicContact CG2-CG 4.33Å
1415	E	83.1	Confident	83.3	Confident	23.6 Å²	23.6	30.3 Å²	30.3	11%	0.11	17%	0.173	C	C	.	.	H	α-helix	trans	-56.2	-39.4	173.3	-71.4	-174.1	139.7	0	0	111.5	V1411 K1412 S1417 G1419 S1420 T1423 R1424	V1411-E1415 HydrophobicContact CG1-CG 4.12Å; V1411-E1415 WeakPolarHBondContact O-CG 3.37Å; V1411-E1415 PolarHBondContact O-N 3.26Å; K1412-E1415 PolarHBondContact O-N 3.13Å; E1415-S1417 VanDerWaalsContact C-N 3.3Å; E1415-S1417 PolarHBondContact O-N 3.13Å; E1415-G1419 CarbonylContact O-C 3.47Å; E1415-G1419 VanDerWaalsContact O-C 3.25Å; E1415-G1419 WeakPolarHBondContact O-CA 3.41Å; E1415-G1419 PolarHBondContact O-N 3.11Å; E1415-G1419 VanDerWaalsContact O-N 3.08Å; E1415-S1420 PolarHBondContact OE1-OG 2.88Å; E1415-T1423 HydrophobicContact CG-CG2 3.94Å; E1415-R1424 IonicContact OE1-CZ 3.58Å; E1415-R1424 IonicContact OE1-NE 3.12Å; E1415-R1424 PolarHBondContact OE1-NE 3.17Å; E1415-R1424 IonicContact OE1-NH2 3.07Å; E1415-R1424 PolarHBondContact OE1-NH2 3.06Å
1416	C	78.4	Confident	83.4	Confident	103 Å²	103	28.3 Å²	28.3	70%	0.696	16%	0.16	S	C	*	.	H	α-helix	trans	-68.2	-29.9	175.4	-72.2	0	0	0	0	113.9	K1412 R1413 V1414 Y1594	K1412-C1416 WeakPolarHBondContact O-CB 3.37Å; K1412-C1416 PolarHBondContact O-N 3.16Å; K1412-C1416 PolarHBondContact O-SG 3.17Å; R1413-C1416 WeakPolarHBondContact O-CB 3.38Å; R1413-C1416 PolarHBondContact O-N 3.11Å; V1414-C1416 VanDerWaalsContact C-N 3.27Å; V1414-C1416 PolarHBondContact O-N 3.16Å; C1416-Y1594 HydrophobicContact CB-CE2 4.42Å; C1416-Y1594 WeakPolarHBondContact SG-CE2 3.41Å
1417	S	72.6	Confident	83.5	Confident	77.6 Å²	77.6	28.3 Å²	28.3	54%	0.543	16%	0.159	S	C	.	.	H	α-helix	trans	-92	-38.5	-175.4	64.8	0	0	0	0	113.8	R1413 V1414 E1415	R1413-S1417 PolarHBondContact O-N 3.12Å; R1413-S1417 VanDerWaalsContact O-N 3.13Å; R1413-S1417 PolarHBondContact O-OG 3.11Å; V1414-S1417 WeakPolarHBondContact CA-OG 3.27Å; V1414-S1417 WeakPolarHBondContact O-CA 3.43Å; V1414-S1417 PolarHBondContact O-N 3.21Å; V1414-S1417 VanDerWaalsContact O-N 3.11Å; V1414-S1417 PolarHBondContact O-OG 3.06Å; V1414-S1417 VanDerWaalsContact O-OG 3.12Å; E1415-S1417 VanDerWaalsContact C-N 3.3Å; E1415-S1417 PolarHBondContact O-N 3.13Å
1418	C	74.1	Confident	83.4	Confident	17 Å²	17	28.3 Å²	28.3	12%	0.115	16%	0.159	C	C	.	.	H	α-helix	trans	-112.6	-9.9	-172.9	-59.1	0	0	0	0	113.1	V1414 L1422 L1517 Y1596	V1414-C1418 HydrophobicContact CG1-CB 4.47Å; V1414-C1418 PolarHBondContact O-N 3.01Å; C1418-L1422 HydrophobicContact CB-CD2 4.3Å; C1418-L1422 WeakPolarHBondContact O-CD1 3.34Å; C1418-L1517 HydrophobicContact CB-CD1 3.66Å; C1418-Y1596 PolarHBondContact O-OH 3.03Å
1419	G	76	Confident	83.5	Confident	21 Å²	21	26.8 Å²	26.8	22%	0.216	15%	0.152	C	C	.	.			trans	100.3	145.8	-174.5	0	0	0	0	0	112.9	E1415 T1423	E1415-G1419 CarbonylContact O-C 3.47Å; E1415-G1419 VanDerWaalsContact O-C 3.25Å; E1415-G1419 WeakPolarHBondContact O-CA 3.41Å; E1415-G1419 PolarHBondContact O-N 3.11Å; E1415-G1419 VanDerWaalsContact O-N 3.08Å; G1419-T1423 WeakPolarHBondContact O-CB 3.43Å; G1419-T1423 PolarHBondContact O-N 3.24Å; G1419-T1423 VanDerWaalsContact O-N 3.12Å; G1419-T1423 PolarHBondContact O-OG1 3.29Å
1420	S	80.6	Confident	83.6	Confident	32.6 Å²	32.6	24.6 Å²	24.6	23%	0.228	14%	0.14	C	C	.	.	H	α-helix	trans	-65	-49.4	-176.6	99.1	0	0	0	0	112.5	E1415 L1422 T1423 R1424 Y1594	E1415-S1420 PolarHBondContact OE1-OG 2.88Å; S1420-L1422 PolarHBondContact O-N 2.78Å; S1420-T1423 PolarHBondContact O-N 2.99Å; S1420-R1424 WeakPolarHBondContact O-CB 3.25Å; S1420-R1424 VanDerWaalsContact O-CG 3.26Å; S1420-R1424 WeakPolarHBondContact O-CG 3.31Å; S1420-R1424 PolarHBondContact O-N 3.07Å; S1420-R1424 PolarHBondContact OG-NE 3.21Å; S1420-Y1594 PolarHBondContact N-O 3.46Å
1421	E	81.5	Confident	83.5	Confident	34 Å²	34	24.9 Å²	24.9	16%	0.159	14%	0.142	C	C	.	.	H	α-helix	trans	-65.2	-43.9	-176.2	-59.1	-53.1	125.5	0	0	111.7	T1423 R1424 I1425 W1449 V1626	E1421-T1423 VanDerWaalsContact C-N 3.34Å; E1421-T1423 PolarHBondContact O-N 3.17Å; E1421-R1424 PolarHBondContact O-N 3.06Å; E1421-I1425 WeakPolarHBondContact O-CG2 3.36Å; E1421-I1425 PolarHBondContact O-N 3.11Å; E1421-W1449 HydrophobicContact CB-CH2 3.78Å; E1421-W1449 HydrophobicContact CB-CZ2 4.03Å; E1421-V1626 HydrophobicContact CB-CG2 4.41Å; E1421-V1626 WeakPolarHBondContact OE2-CG2 3.42Å; E1421-V1626 PolarHBondContact OE2-N 3.29Å
1422	L	83.4	Confident	83.4	Confident	13.8 Å²	13.8	25 Å²	25	7%	0.072	14%	0.143	C	C	.	.	H	α-helix	trans	-62.9	-38.9	177.6	-157.1	107.1	0	0	0	112.4	C1418 S1420 I1425 T1426 I1446 W1449 L1509 L1513 L1517 Y1596	C1418-L1422 HydrophobicContact CB-CD2 4.3Å; C1418-L1422 WeakPolarHBondContact O-CD1 3.34Å; S1420-L1422 PolarHBondContact O-N 2.78Å; L1422-I1425 HydrophobicContact CD1-CG2 4.32Å; L1422-I1425 VanDerWaalsContact O-CG2 3.26Å; L1422-I1425 WeakPolarHBondContact O-CG2 3.28Å; L1422-T1426 WeakPolarHBondContact O-CB 3.38Å; L1422-T1426 PolarHBondContact O-N 2.95Å; L1422-T1426 PolarHBondContact O-OG1 3.06Å; L1422-I1446 HydrophobicContact CD1-CG2 3.99Å; L1422-I1446 HydrophobicContact CD2-CG2 4.18Å; L1422-W1449 HydrophobicContact CD1-CZ3 4.44Å; L1422-W1449 HydrophobicContact CD2-CE3 4.44Å; L1422-W1449 HydrophobicContact CD2-CZ3 3.71Å; L1422-W1449 HydrophobicContact CG-CZ3 4.32Å; L1422-L1509 HydrophobicContact CD1-CD1 4.03Å; L1422-L1509 HydrophobicContact CD1-CD2 4.34Å; L1422-L1509 HydrophobicContact CD2-CD1 4.18Å; L1422-L1513 HydrophobicContact CD2-CD2 4.39Å; L1422-L1513 HydrophobicContact CD2-CG 4.32Å; L1422-L1517 HydrophobicContact CD1-CD2 4.47Å; L1422-L1517 HydrophobicContact CD2-CB 4.43Å; L1422-L1517 HydrophobicContact CD2-CD1 3.92Å; L1422-L1517 VanDerWaalsContact CD2-CD1 3.43Å; L1422-L1517 HydrophobicContact CD2-CD2 3.96Å; L1422-L1517 HydrophobicContact CD2-CG 4Å; L1422-L1517 HydrophobicContact CG-CD2 4Å; L1422-Y1596 HydrophobicContact CD1-CD1 3.65Å; L1422-Y1596 HydrophobicContact CD1-CD2 3.47Å; L1422-Y1596 VanDerWaalsContact CD1-CD2 3.47Å; L1422-Y1596 HydrophobicContact CD1-CE1 4.12Å; L1422-Y1596 HydrophobicContact CD1-CE2 3.97Å; L1422-Y1596 HydrophobicContact CD1-CG 3.28Å; L1422-Y1596 HydrophobicContact CG-CD1 4.33Å; L1422-Y1596 HydrophobicContact CG-CG 4.15Å
1423	T	86.2	Confident	83.3	Confident	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-68	-42.7	176.6	-54.1	0	0	0	0	110.8	V1411 V1414 E1415 G1419 S1420 E1421 T1426 L1427 L1521	V1411-T1423 HydrophobicContact CG1-CG2 4.41Å; V1414-T1423 HydrophobicContact CB-CG2 4.09Å; V1414-T1423 HydrophobicContact CG1-CG2 3.79Å; E1415-T1423 HydrophobicContact CG-CG2 3.94Å; G1419-T1423 WeakPolarHBondContact O-CB 3.43Å; G1419-T1423 PolarHBondContact O-N 3.24Å; G1419-T1423 VanDerWaalsContact O-N 3.12Å; G1419-T1423 PolarHBondContact O-OG1 3.29Å; S1420-T1423 PolarHBondContact O-N 2.99Å; E1421-T1423 VanDerWaalsContact C-N 3.34Å; E1421-T1423 PolarHBondContact O-N 3.17Å; T1423-T1426 PolarHBondContact O-N 3.06Å; T1423-L1427 HydrophobicContact CG2-CD1 3.96Å; T1423-L1427 WeakPolarHBondContact O-CB 3.39Å; T1423-L1427 WeakPolarHBondContact O-CG 3.28Å; T1423-L1427 PolarHBondContact O-N 3.19Å; T1423-L1521 HydrophobicContact CG2-CD2 4.36Å
1424	R	85.6	Confident	82.8	Confident	45.6 Å²	45.6	25 Å²	25	17%	0.172	14%	0.143	C	C	.	.	H	α-helix	trans	-68.9	-41.6	-179.9	-74	175.4	-176.4	-160.5	-3	113.2	E1415 S1420 E1421 T1426 G1428 H1591 V1626	E1415-R1424 IonicContact OE1-CZ 3.58Å; E1415-R1424 IonicContact OE1-NE 3.12Å; E1415-R1424 PolarHBondContact OE1-NE 3.17Å; E1415-R1424 IonicContact OE1-NH2 3.07Å; E1415-R1424 PolarHBondContact OE1-NH2 3.06Å; S1420-R1424 WeakPolarHBondContact O-CB 3.25Å; S1420-R1424 VanDerWaalsContact O-CG 3.26Å; S1420-R1424 WeakPolarHBondContact O-CG 3.31Å; S1420-R1424 PolarHBondContact O-N 3.07Å; S1420-R1424 PolarHBondContact OG-NE 3.21Å; E1421-R1424 PolarHBondContact O-N 3.06Å; R1424-T1426 VanDerWaalsContact C-N 3.31Å; R1424-T1426 PolarHBondContact O-N 2.98Å; R1424-G1428 WeakPolarHBondContact O-CA 3.35Å; R1424-G1428 PolarHBondContact O-N 3.26Å; R1424-H1591 PolarHBondContact NH2-CE1 2.89Å; R1424-H1591 PolarHBondContact NH2-ND1 2.82Å; R1424-V1626 HydrophobicContact CB-CB 4.33Å; R1424-V1626 HydrophobicContact CB-CG1 4.33Å; R1424-V1626 HydrophobicContact CB-CG2 4.38Å
1425	I	87.3	Confident	82.3	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-63.5	-41.7	176.6	-170.5	64.4	0	0	0	110.4	E1421 L1422 G1428 L1429 W1449 V1626 I1631 I1634	E1421-I1425 WeakPolarHBondContact O-CG2 3.36Å; E1421-I1425 PolarHBondContact O-N 3.11Å; L1422-I1425 HydrophobicContact CD1-CG2 4.32Å; L1422-I1425 VanDerWaalsContact O-CG2 3.26Å; L1422-I1425 WeakPolarHBondContact O-CG2 3.28Å; I1425-G1428 PolarHBondContact O-N 3.02Å; I1425-L1429 HydrophobicContact CD1-CD1 4.43Å; I1425-L1429 HydrophobicContact CD1-CG 4.31Å; I1425-L1429 HydrophobicContact CG1-CD1 3.98Å; I1425-L1429 HydrophobicContact CG1-CG 4.31Å; I1425-L1429 WeakPolarHBondContact O-CB 3.38Å; I1425-L1429 VanDerWaalsContact O-CG 3.24Å; I1425-L1429 WeakPolarHBondContact O-CG 3.36Å; I1425-L1429 PolarHBondContact O-N 3.08Å; I1425-W1449 HydrophobicContact CB-CD2 4.25Å; I1425-W1449 HydrophobicContact CB-CE3 4.42Å; I1425-W1449 HydrophobicContact CB-CG 4.49Å; I1425-W1449 HydrophobicContact CD1-CB 4.36Å; I1425-W1449 HydrophobicContact CD1-CD2 4.4Å; I1425-W1449 HydrophobicContact CD1-CG 3.94Å; I1425-W1449 HydrophobicContact CG1-CB 4.12Å; I1425-W1449 HydrophobicContact CG1-CD2 3.91Å; I1425-W1449 HydrophobicContact CG1-CE3 4.33Å; I1425-W1449 HydrophobicContact CG1-CG 3.8Å; I1425-W1449 HydrophobicContact CG2-CD2 4.24Å; I1425-W1449 HydrophobicContact CG2-CE3 3.91Å; I1425-W1449 HydrophobicContact CG2-CH2 4.45Å; I1425-W1449 HydrophobicContact CG2-CZ3 4.06Å; I1425-V1626 HydrophobicContact CB-CG1 4.32Å; I1425-V1626 HydrophobicContact CB-CG2 3.89Å; I1425-V1626 HydrophobicContact CD1-CG1 4.04Å; I1425-V1626 HydrophobicContact CD1-CG2 4.34Å; I1425-I1631 HydrophobicContact CD1-CD1 4.31Å; I1425-I1631 HydrophobicContact CD1-CG1 3.78Å; I1425-I1634 HydrophobicContact CD1-CD1 4.04Å
1426	T	88.9	Confident	81.7	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-64.9	-48.8	179.9	-57.1	0	0	0	0	111.8	L1422 T1423 R1424 G1428 L1430 L1442 I1446 L1517 L1518 L1521	L1422-T1426 WeakPolarHBondContact O-CB 3.38Å; L1422-T1426 PolarHBondContact O-N 2.95Å; L1422-T1426 PolarHBondContact O-OG1 3.06Å; T1423-T1426 PolarHBondContact O-N 3.06Å; R1424-T1426 VanDerWaalsContact C-N 3.31Å; R1424-T1426 PolarHBondContact O-N 2.98Å; T1426-G1428 VanDerWaalsContact C-N 3.33Å; T1426-G1428 PolarHBondContact O-N 3.43Å; T1426-L1430 HydrophobicContact CG2-CD1 4.39Å; T1426-L1430 WeakPolarHBondContact O-CG 3.41Å; T1426-L1430 PolarHBondContact O-N 3.1Å; T1426-L1442 HydrophobicContact CG2-CD1 4.37Å; T1426-L1442 HydrophobicContact CG2-CD2 4.06Å; T1426-I1446 HydrophobicContact CG2-CD1 4.38Å; T1426-I1446 WeakPolarHBondContact OG1-CD1 3.28Å; T1426-L1517 HydrophobicContact CG2-CD2 3.87Å; T1426-L1517 VanDerWaalsContact OG1-CD2 3.26Å; T1426-L1517 WeakPolarHBondContact OG1-CD2 3.37Å; T1426-L1518 HydrophobicContact CG2-CD2 4.43Å; T1426-L1521 HydrophobicContact CG2-CD1 4.15Å
1427	L	89.6	Confident	81.7	Confident	0.6 Å²	0.6	26 Å²	26	0%	0.003	14%	0.143	C	C	.	.	H	α-helix	trans	-66.2	-36.9	175.8	-71	175.1	0	0	0	112.1	V1411 T1423 L1430 T1431 L1521 F1568 V1577	V1411-L1427 HydrophobicContact CG1-CD1 4Å; V1411-L1427 HydrophobicContact CG2-CD1 3.85Å; T1423-L1427 HydrophobicContact CG2-CD1 3.96Å; T1423-L1427 WeakPolarHBondContact O-CB 3.39Å; T1423-L1427 WeakPolarHBondContact O-CG 3.28Å; T1423-L1427 PolarHBondContact O-N 3.19Å; L1427-L1430 PolarHBondContact O-N 2.9Å; L1427-T1431 WeakPolarHBondContact O-CB 3.29Å; L1427-T1431 VanDerWaalsContact O-CG2 3.31Å; L1427-T1431 WeakPolarHBondContact O-CG2 3.41Å; L1427-T1431 PolarHBondContact O-N 3.29Å; L1427-T1431 PolarHBondContact O-OG1 3.02Å; L1427-L1521 HydrophobicContact CD1-CD2 4.21Å; L1427-L1521 HydrophobicContact CD2-CD1 3.93Å; L1427-L1521 HydrophobicContact CD2-CD2 3.98Å; L1427-L1521 HydrophobicContact CD2-CG 4.49Å; L1427-L1521 HydrophobicContact CG-CD1 4.17Å; L1427-L1521 HydrophobicContact CG-CD2 4.3Å; L1427-F1568 HydrophobicContact CD2-CE1 3.93Å; L1427-F1568 HydrophobicContact CD2-CZ 4.14Å; L1427-V1577 HydrophobicContact CB-CG1 3.78Å; L1427-V1577 HydrophobicContact CD1-CG1 4.14Å; L1427-V1577 HydrophobicContact CD2-CG1 3.96Å; L1427-V1577 HydrophobicContact CG-CG1 4.18Å
1428	G	87.3	Confident	81.8	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-63.8	-48.5	177.2	0	0	0	0	0	112.7	R1424 I1425 T1426 L1430 T1431 C1432 I1631	R1424-G1428 WeakPolarHBondContact O-CA 3.35Å; R1424-G1428 PolarHBondContact O-N 3.26Å; I1425-G1428 PolarHBondContact O-N 3.02Å; T1426-G1428 VanDerWaalsContact C-N 3.33Å; T1426-G1428 PolarHBondContact O-N 3.43Å; G1428-L1430 VanDerWaalsContact C-N 3.33Å; G1428-L1430 PolarHBondContact O-N 3.21Å; G1428-T1431 WeakPolarHBondContact CA-OG1 3.32Å; G1428-T1431 PolarHBondContact O-N 3Å; G1428-T1431 VanDerWaalsContact O-N 3.14Å; G1428-T1431 PolarHBondContact O-OG1 3.29Å; G1428-T1431 VanDerWaalsContact O-OG1 3.07Å; G1428-C1432 VanDerWaalsContact O-CB 3.28Å; G1428-C1432 WeakPolarHBondContact O-CB 3.26Å; G1428-C1432 PolarHBondContact O-N 3.28Å; G1428-C1432 PolarHBondContact O-SG 3.31Å; G1428-C1432 VanDerWaalsContact O-SG 3.37Å; G1428-I1631 VanDerWaalsContact CA-CD1 3.47Å
1429	L	88.6	Confident	81.8	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-58.1	-46.9	175.1	-72.7	167.1	0	0	0	111.1	I1425 T1431 C1432 S1433 L1437 L1442 L1445 I1446 I1631 I1634 L1635	I1425-L1429 HydrophobicContact CD1-CD1 4.43Å; I1425-L1429 HydrophobicContact CD1-CG 4.31Å; I1425-L1429 HydrophobicContact CG1-CD1 3.98Å; I1425-L1429 HydrophobicContact CG1-CG 4.31Å; I1425-L1429 WeakPolarHBondContact O-CB 3.38Å; I1425-L1429 VanDerWaalsContact O-CG 3.24Å; I1425-L1429 WeakPolarHBondContact O-CG 3.36Å; I1425-L1429 PolarHBondContact O-N 3.08Å; L1429-T1431 VanDerWaalsContact C-N 3.34Å; L1429-T1431 PolarHBondContact O-N 2.93Å; L1429-C1432 PolarHBondContact O-N 3.11Å; L1429-S1433 VanDerWaalsContact O-CB 3.28Å; L1429-S1433 WeakPolarHBondContact O-CB 3.37Å; L1429-S1433 PolarHBondContact O-N 3.33Å; L1429-S1433 VanDerWaalsContact O-N 3.07Å; L1429-S1433 PolarHBondContact O-OG 3.19Å; L1429-S1433 VanDerWaalsContact O-OG 3.13Å; L1429-L1437 HydrophobicContact CB-CD1 4.34Å; L1429-L1442 HydrophobicContact CB-CD1 4.08Å; L1429-L1442 HydrophobicContact CD1-CD1 4.08Å; L1429-L1445 HydrophobicContact CD1-CB 3.76Å; L1429-L1445 HydrophobicContact CD2-CB 4.14Å; L1429-L1445 HydrophobicContact CD2-CD1 4.32Å; L1429-I1446 HydrophobicContact CD1-CG1 3.96Å; L1429-I1631 HydrophobicContact CD2-CG2 4.15Å; L1429-I1631 HydrophobicContact CG-CG2 4.38Å; L1429-I1634 HydrophobicContact CD2-CG2 4.29Å; L1429-L1635 HydrophobicContact CD2-CD1 4.48Å; L1429-L1635 HydrophobicContact CD2-CD2 3.82Å; L1429-L1635 HydrophobicContact CD2-CG 3.98Å
1430	L	87.3	Confident	81.7	Confident	9.6 Å²	9.6	27.8 Å²	27.8	5%	0.05	14%	0.139	C	C	.	.	H	α-helix	trans	-66.8	-32.4	178.5	-70.5	170.3	0	0	0	113.6	T1426 L1427 G1428 S1433 L1437 L1442 L1525 L1566 F1568	T1426-L1430 HydrophobicContact CG2-CD1 4.39Å; T1426-L1430 WeakPolarHBondContact O-CG 3.41Å; T1426-L1430 PolarHBondContact O-N 3.1Å; L1427-L1430 PolarHBondContact O-N 2.9Å; G1428-L1430 VanDerWaalsContact C-N 3.33Å; G1428-L1430 PolarHBondContact O-N 3.21Å; L1430-S1433 PolarHBondContact O-OG 2.85Å; L1430-S1433 VanDerWaalsContact O-OG 3.08Å; L1430-L1437 HydrophobicContact CD2-CB 4.29Å; L1430-L1437 HydrophobicContact CD2-CD1 4.26Å; L1430-L1442 HydrophobicContact CD1-CD2 4.4Å; L1430-L1442 HydrophobicContact CD2-CD2 4.43Å; L1430-L1442 HydrophobicContact CG-CD1 4.35Å; L1430-L1442 HydrophobicContact CG-CD2 4.4Å; L1430-L1525 HydrophobicContact CD1-CD1 4.38Å; L1430-L1525 HydrophobicContact CD1-CD2 3.8Å; L1430-L1566 HydrophobicContact CD2-CB 3.84Å; L1430-L1566 HydrophobicContact CD2-CD1 4.39Å; L1430-F1568 HydrophobicContact CB-CE2 3.77Å; L1430-F1568 HydrophobicContact CB-CZ 3.89Å
1431	T	85.4	Confident	81.6	Confident	8 Å²	8	30 Å²	30	5%	0.049	15%	0.145	C	C	.	.	H	α-helix	trans	-80.6	-35.2	178.5	47.7	0	0	0	0	113.1	L1427 G1428 L1429 F1568 H1574 V1577	L1427-T1431 WeakPolarHBondContact O-CB 3.29Å; L1427-T1431 VanDerWaalsContact O-CG2 3.31Å; L1427-T1431 WeakPolarHBondContact O-CG2 3.41Å; L1427-T1431 PolarHBondContact O-N 3.29Å; L1427-T1431 PolarHBondContact O-OG1 3.02Å; G1428-T1431 WeakPolarHBondContact CA-OG1 3.32Å; G1428-T1431 PolarHBondContact O-N 3Å; G1428-T1431 VanDerWaalsContact O-N 3.14Å; G1428-T1431 PolarHBondContact O-OG1 3.29Å; G1428-T1431 VanDerWaalsContact O-OG1 3.07Å; L1429-T1431 VanDerWaalsContact C-N 3.34Å; L1429-T1431 PolarHBondContact O-N 2.93Å; T1431-F1568 HydrophobicContact CG2-CD2 4.43Å; T1431-F1568 HydrophobicContact CG2-CE2 3.46Å; T1431-F1568 VanDerWaalsContact CG2-CE2 3.43Å; T1431-F1568 HydrophobicContact CG2-CZ 3.57Å; T1431-H1574 PolarHBondContact O-NE2 3.04Å; T1431-H1574 VanDerWaalsContact O-NE2 3.08Å; T1431-V1577 HydrophobicContact CG2-CB 4.06Å; T1431-V1577 HydrophobicContact CG2-CG1 3.63Å
1432	C	84.4	Confident	81.8	Confident	5.8 Å²	5.8	28.4 Å²	28.4	4%	0.039	14%	0.138	C	C	.	.	H	α-helix	trans	-83.9	-22.4	-178.9	-72.4	0	0	0	0	113.2	G1428 L1429 R1434 L1628 I1631 L1635 H1648	G1428-C1432 VanDerWaalsContact O-CB 3.28Å; G1428-C1432 WeakPolarHBondContact O-CB 3.26Å; G1428-C1432 PolarHBondContact O-N 3.28Å; G1428-C1432 PolarHBondContact O-SG 3.31Å; G1428-C1432 VanDerWaalsContact O-SG 3.37Å; L1429-C1432 PolarHBondContact O-N 3.11Å; C1432-R1434 PolarHBondContact O-N 3.31Å; C1432-L1628 VanDerWaalsContact SG-CD1 3.56Å; C1432-I1631 HydrophobicContact CB-CG2 3.7Å; C1432-L1635 HydrophobicContact CB-CD1 3.73Å; C1432-H1648 PolarHBondContact O-CE1 3.16Å
1433	S	81.7	Confident	81.7	Confident	16.2 Å²	16.2	28.6 Å²	28.6	11%	0.113	14%	0.138	C	C	.	.			trans	-67.4	127.9	175.3	75.2	0	0	0	0	111.5	L1429 L1430 Q1435 L1437	L1429-S1433 VanDerWaalsContact O-CB 3.28Å; L1429-S1433 WeakPolarHBondContact O-CB 3.37Å; L1429-S1433 PolarHBondContact O-N 3.33Å; L1429-S1433 VanDerWaalsContact O-N 3.07Å; L1429-S1433 PolarHBondContact O-OG 3.19Å; L1429-S1433 VanDerWaalsContact O-OG 3.13Å; L1430-S1433 PolarHBondContact O-OG 2.85Å; L1430-S1433 VanDerWaalsContact O-OG 3.08Å; S1433-Q1435 VanDerWaalsContact C-N 3.31Å; S1433-Q1435 WeakPolarHBondContact CB-O 3.3Å; S1433-Q1435 PolarHBondContact OG-N 3.35Å; S1433-Q1435 PolarHBondContact OG-O 3.16Å; S1433-L1437 WeakPolarHBondContact OG-CD2 3.45Å
1434	R	74.2	Confident	81.5	Confident	116.2 Å²	116.2	32.2 Å²	32.2	44%	0.438	16%	0.158	S	C	.	.	S	Bend	trans	-79	-17.1	176.7	-68.7	-176.3	80.7	-170.7	7.1	113.5	C1432 D1644 Y1647	C1432-R1434 PolarHBondContact O-N 3.31Å; R1434-D1644 WeakPolarHBondContact CD-OD1 3.26Å; R1434-D1644 IonicContact CZ-OD1 3.28Å; R1434-D1644 IonicContact NE-OD1 3.05Å; R1434-D1644 IonicContact NH1-OD1 3.26Å; R1434-D1644 PolarHBondContact NH1-OD1 3.25Å; R1434-Y1647 VanDerWaalsContact CD-CD1 3.44Å; R1434-Y1647 VanDerWaalsContact CD-CE1 3.45Å; R1434-Y1647 HydrophobicContact CG-CD1 4.17Å; R1434-Y1647 HydrophobicContact CG-CE1 3.95Å
1435	Q	71	Confident	81.5	Confident	84.2 Å²	84.2	30.3 Å²	30.3	39%	0.393	15%	0.151	S	C	.	.	S	Bend	trans	-118.7	144.9	175.7	-63.2	-177.6	5.1	0	0	108.8	S1433 L1437 N1641 D1644	S1433-Q1435 VanDerWaalsContact C-N 3.31Å; S1433-Q1435 WeakPolarHBondContact CB-O 3.3Å; S1433-Q1435 PolarHBondContact OG-N 3.35Å; S1433-Q1435 PolarHBondContact OG-O 3.16Å; Q1435-L1437 PolarHBondContact O-N 3.27Å; Q1435-N1641 PolarHBondContact NE2-ND2 3.01Å; Q1435-N1641 VanDerWaalsContact NE2-ND2 3.17Å; Q1435-N1641 PolarHBondContact NE2-OD1 2.85Å; Q1435-N1641 PolarHBondContact OE1-ND2 2.89Å; Q1435-D1644 PolarHBondContact NE2-OD2 3.17Å
1436	P	72	Confident	81.4	Confident	59.8 Å²	59.8	30.3 Å²	30.3	39%	0.388	15%	0.151	S	C	.	.	P	Polyproline II helix	trans	-64.3	131.9	177.7	28.9	-34.2	0	0	0	109.7	A1565 L1566	P1436-A1565 HydrophobicContact CB-CB 3.7Å; P1436-A1565 HydrophobicContact CG-CB 3.81Å; P1436-L1566 WeakPolarHBondContact CA-O 3.27Å; P1436-L1566 VanDerWaalsContact CB-O 3.23Å; P1436-L1566 WeakPolarHBondContact CB-O 3.32Å
1437	L	77.3	Confident	81.1	Confident	3 Å²	3	30.8 Å²	30.8	2%	0.016	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	135.7	-174.5	-63.6	175.6	0	0	0	110.4	L1429 L1430 S1433 Q1435 L1442 L1445 A1565 L1566 L1639	L1429-L1437 HydrophobicContact CB-CD1 4.34Å; L1430-L1437 HydrophobicContact CD2-CB 4.29Å; L1430-L1437 HydrophobicContact CD2-CD1 4.26Å; S1433-L1437 WeakPolarHBondContact OG-CD2 3.45Å; Q1435-L1437 PolarHBondContact O-N 3.27Å; L1437-L1442 HydrophobicContact CD1-CD1 4.3Å; L1437-L1445 HydrophobicContact CD1-CD1 3.92Å; L1437-L1445 HydrophobicContact CD2-CD1 4.22Å; L1437-A1565 CarbonylContact O-C 3.53Å; L1437-A1565 WeakPolarHBondContact O-CA 3.34Å; L1437-L1566 PolarHBondContact N-O 3.1Å; L1437-L1566 WeakPolarHBondContact O-CA 3.47Å; L1437-L1566 VanDerWaalsContact O-CB 3.29Å; L1437-L1566 WeakPolarHBondContact O-CB 3.32Å; L1437-L1566 PolarHBondContact O-N 3.07Å; L1437-L1639 HydrophobicContact CD2-CD1 3.68Å; L1437-L1639 VanDerWaalsContact CD2-CD1 3.49Å; L1437-L1639 HydrophobicContact CD2-CD2 4.15Å; L1437-L1639 HydrophobicContact CD2-CG 4.43Å
1438	S	75.2	Confident	80.7	Confident	21.2 Å²	21.2	32.6 Å²	32.6	15%	0.148	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	158.7	166.6	64.6	0	0	0	0	111.3	E1440 E1441 L1442 R1564	S1438-E1440 VanDerWaalsContact C-N 3.29Å; S1438-E1440 PolarHBondContact O-N 2.96Å; S1438-E1441 WeakPolarHBondContact CB-OE2 3.29Å; S1438-E1441 PolarHBondContact N-OE2 3.13Å; S1438-E1441 PolarHBondContact O-N 3.15Å; S1438-E1441 VanDerWaalsContact OG-CB 3.29Å; S1438-E1441 WeakPolarHBondContact OG-CB 3.4Å; S1438-E1441 WeakPolarHBondContact OG-CG 3.37Å; S1438-E1441 PolarHBondContact OG-N 3.15Å; S1438-E1441 VanDerWaalsContact OG-N 3.15Å; S1438-E1441 PolarHBondContact OG-OE2 3.32Å; S1438-L1442 WeakPolarHBondContact O-CB 3.39Å; S1438-L1442 PolarHBondContact O-N 3.18Å; S1438-R1564 WeakPolarHBondContact CA-O 3.38Å
1439	T	75.1	Confident	80.6	Confident	15.4 Å²	15.4	32.6 Å²	32.6	9%	0.094	16%	0.162	C	C	.	.	H	α-helix	trans	-58.2	-36.6	174.1	51.5	0	0	0	0	112.5	L1442 H1443 L1518 F1528 L1561 G1562 R1564 L1566	T1439-L1442 PolarHBondContact O-N 2.8Å; T1439-H1443 WeakPolarHBondContact O-CB 3.33Å; T1439-H1443 PolarHBondContact O-N 3.08Å; T1439-H1443 VanDerWaalsContact O-N 3.12Å; T1439-L1518 HydrophobicContact CG2-CD1 4.4Å; T1439-F1528 HydrophobicContact CG2-CD2 4.35Å; T1439-F1528 HydrophobicContact CG2-CE2 4.46Å; T1439-L1561 VanDerWaalsContact CB-CB 3.42Å; T1439-L1561 WeakPolarHBondContact CB-O 3.29Å; T1439-L1561 HydrophobicContact CG2-CB 3.86Å; T1439-L1561 HydrophobicContact CG2-CD2 4.4Å; T1439-L1561 WeakPolarHBondContact CG2-O 3.26Å; T1439-L1561 WeakPolarHBondContact OG1-CB 3.28Å; T1439-L1561 PolarHBondContact OG1-O 3.41Å; T1439-G1562 WeakPolarHBondContact CG2-O 3.38Å; T1439-G1562 PolarHBondContact OG1-O 3.26Å; T1439-R1564 PolarHBondContact N-O 2.88Å; T1439-L1566 HydrophobicContact CG2-CD1 3.92Å; T1439-L1566 HydrophobicContact CG2-CD2 4.17Å; T1439-L1566 HydrophobicContact CG2-CG 4.06Å
1440	E	73.1	Confident	80.2	Confident	117.4 Å²	117.4	33.6 Å²	33.6	55%	0.549	17%	0.167	S	C	.	.	H	α-helix	trans	-69.3	-44.8	177	-80.4	-176	-179	0	0	111.7	S1438 L1442 H1443 N1444 K1499 K1555	S1438-E1440 VanDerWaalsContact C-N 3.29Å; S1438-E1440 PolarHBondContact O-N 2.96Å; E1440-L1442 PolarHBondContact O-N 3.27Å; E1440-H1443 PolarHBondContact O-N 3.18Å; E1440-N1444 VanDerWaalsContact O-CG 3.27Å; E1440-N1444 PolarHBondContact O-N 3.06Å; E1440-N1444 PolarHBondContact O-ND2 3.12Å; E1440-N1444 VanDerWaalsContact O-ND2 3.17Å; E1440-K1499 WeakPolarHBondContact OE1-CE 3.28Å; E1440-K1499 IonicContact OE1-NZ 2.71Å; E1440-K1499 PolarHBondContact OE1-NZ 3.35Å; E1440-K1499 IonicContact OE2-NZ 3.93Å; E1440-K1499 PolarHBondContact OE2-NZ 2.86Å; E1440-K1555 IonicContact OE1-NZ 3.57Å
1441	E	78.7	Confident	79.7	Confident	78.8 Å²	78.8	34.1 Å²	34.1	37%	0.368	17%	0.17	S	C	.	.	H	α-helix	trans	-62.3	-44.4	175.3	-73.9	163.3	150.4	0	0	111.3	S1438 H1443 N1444 L1445	S1438-E1441 WeakPolarHBondContact CB-OE2 3.29Å; S1438-E1441 PolarHBondContact N-OE2 3.13Å; S1438-E1441 PolarHBondContact O-N 3.15Å; S1438-E1441 VanDerWaalsContact OG-CB 3.29Å; S1438-E1441 WeakPolarHBondContact OG-CB 3.4Å; S1438-E1441 WeakPolarHBondContact OG-CG 3.37Å; S1438-E1441 PolarHBondContact OG-N 3.15Å; S1438-E1441 VanDerWaalsContact OG-N 3.15Å; S1438-E1441 PolarHBondContact OG-OE2 3.32Å; E1441-H1443 VanDerWaalsContact C-N 3.31Å; E1441-H1443 PolarHBondContact O-N 3.11Å; E1441-N1444 PolarHBondContact O-N 3.2Å; E1441-L1445 WeakPolarHBondContact O-CB 3.44Å; E1441-L1445 WeakPolarHBondContact O-CD1 3.37Å; E1441-L1445 WeakPolarHBondContact O-CG 3.34Å; E1441-L1445 PolarHBondContact O-N 3.27Å
1442	L	84.8	Confident	79.1	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-60	-42.2	176.4	-179.4	64	0	0	0	111.6	T1426 L1429 L1430 L1437 S1438 T1439 E1440 L1445 I1446 L1518 L1566	T1426-L1442 HydrophobicContact CG2-CD1 4.37Å; T1426-L1442 HydrophobicContact CG2-CD2 4.06Å; L1429-L1442 HydrophobicContact CB-CD1 4.08Å; L1429-L1442 HydrophobicContact CD1-CD1 4.08Å; L1430-L1442 HydrophobicContact CD1-CD2 4.4Å; L1430-L1442 HydrophobicContact CD2-CD2 4.43Å; L1430-L1442 HydrophobicContact CG-CD1 4.35Å; L1430-L1442 HydrophobicContact CG-CD2 4.4Å; L1437-L1442 HydrophobicContact CD1-CD1 4.3Å; S1438-L1442 WeakPolarHBondContact O-CB 3.39Å; S1438-L1442 PolarHBondContact O-N 3.18Å; T1439-L1442 PolarHBondContact O-N 2.8Å; E1440-L1442 PolarHBondContact O-N 3.27Å; L1442-L1445 PolarHBondContact O-N 3.21Å; L1442-I1446 HydrophobicContact CD1-CD1 4.16Å; L1442-I1446 HydrophobicContact CD1-CG1 4.46Å; L1442-I1446 HydrophobicContact CG-CD1 3.99Å; L1442-I1446 WeakPolarHBondContact O-CD1 3.39Å; L1442-I1446 VanDerWaalsContact O-CG1 3.29Å; L1442-I1446 WeakPolarHBondContact O-CG1 3.36Å; L1442-I1446 PolarHBondContact O-N 3.24Å; L1442-I1446 VanDerWaalsContact O-N 3.1Å; L1442-L1518 HydrophobicContact CD2-CD2 3.98Å; L1442-L1566 HydrophobicContact CB-CD1 4.43Å; L1442-L1566 HydrophobicContact CD2-CD1 3.47Å; L1442-L1566 VanDerWaalsContact CD2-CD1 3.45Å
1443	H	82.4	Confident	78.6	Confident	18 Å²	18	35.8 Å²	35.8	8%	0.083	18%	0.177	C	C	.	.	H	α-helix	trans	-60.7	-50.8	176.7	-163.3	170.1	0	0	0	111	T1439 E1440 E1441 L1445 I1446 D1447 H1508 L1509 L1514	T1439-H1443 WeakPolarHBondContact O-CB 3.33Å; T1439-H1443 PolarHBondContact O-N 3.08Å; T1439-H1443 VanDerWaalsContact O-N 3.12Å; E1440-H1443 PolarHBondContact O-N 3.18Å; E1441-H1443 VanDerWaalsContact C-N 3.31Å; E1441-H1443 PolarHBondContact O-N 3.11Å; H1443-L1445 VanDerWaalsContact C-N 3.29Å; H1443-L1445 PolarHBondContact O-N 3.04Å; H1443-I1446 PolarHBondContact O-N 3.25Å; H1443-I1446 VanDerWaalsContact O-N 3.13Å; H1443-D1447 IonicContact CD2-OD1 3.47Å; H1443-D1447 IonicContact CD2-OD2 3.14Å; H1443-D1447 PolarHBondContact CD2-OD2 3.25Å; H1443-D1447 VanDerWaalsContact CD2-OD2 3.31Å; H1443-D1447 IonicContact NE2-OD1 3.43Å; H1443-D1447 IonicContact NE2-OD2 3.6Å; H1443-D1447 PolarHBondContact O-N 3.04Å; H1443-H1508 AromaticContact CE1-CE1 3.32Å; H1443-H1508 PolarHBondContact CE1-CE1 3.11Å; H1443-H1508 VanDerWaalsContact CE1-CE1 3.47Å; H1443-H1508 AromaticContact CE1-NE2 3.75Å; H1443-H1508 AromaticContact NE2-CE1 3.15Å; H1443-H1508 PolarHBondContact NE2-CE1 3.26Å; H1443-H1508 AromaticContact NE2-ND1 3.71Å; H1443-H1508 AromaticContact NE2-NE2 3.79Å; H1443-L1509 PolarHBondContact CE1-O 3.13Å; H1443-L1509 VanDerWaalsContact CE1-O 3.24Å; H1443-L1509 PolarHBondContact NE2-O 3.07Å; H1443-L1514 HydrophobicContact CB-CD2 3.61Å; H1443-L1514 VanDerWaalsContact CG-CD2 3.49Å
1444	N	81.2	Confident	77.9	Confident	76.6 Å²	76.6	39.2 Å²	39.2	41%	0.41	19%	0.187	S	C	.	.	H	α-helix	trans	-58.5	-40.2	178.4	-67.7	-36	0	0	0	112.1	E1440 E1441 I1446 D1447 E1448	E1440-N1444 VanDerWaalsContact O-CG 3.27Å; E1440-N1444 PolarHBondContact O-N 3.06Å; E1440-N1444 PolarHBondContact O-ND2 3.12Å; E1440-N1444 VanDerWaalsContact O-ND2 3.17Å; E1441-N1444 PolarHBondContact O-N 3.2Å; N1444-I1446 VanDerWaalsContact C-N 3.34Å; N1444-I1446 PolarHBondContact O-N 2.93Å; N1444-D1447 PolarHBondContact O-N 3.23Å; N1444-E1448 WeakPolarHBondContact O-CB 3.27Å; N1444-E1448 VanDerWaalsContact O-CG 3.23Å; N1444-E1448 WeakPolarHBondContact O-CG 3.32Å; N1444-E1448 PolarHBondContact O-N 3.19Å; N1444-E1448 VanDerWaalsContact O-N 3.07Å
1445	L	86.4	Confident	77.3	Confident	4.8 Å²	4.8	35.9 Å²	35.9	3%	0.025	18%	0.178	C	C	.	.	H	α-helix	trans	-67.4	-34.8	178.1	-67.6	164.8	0	0	0	112.6	L1429 L1437 E1441 L1442 H1443 E1448 W1449 I1634 L1635 K1638 L1639	L1429-L1445 HydrophobicContact CD1-CB 3.76Å; L1429-L1445 HydrophobicContact CD2-CB 4.14Å; L1429-L1445 HydrophobicContact CD2-CD1 4.32Å; L1437-L1445 HydrophobicContact CD1-CD1 3.92Å; L1437-L1445 HydrophobicContact CD2-CD1 4.22Å; E1441-L1445 WeakPolarHBondContact O-CB 3.44Å; E1441-L1445 WeakPolarHBondContact O-CD1 3.37Å; E1441-L1445 WeakPolarHBondContact O-CG 3.34Å; E1441-L1445 PolarHBondContact O-N 3.27Å; L1442-L1445 PolarHBondContact O-N 3.21Å; H1443-L1445 VanDerWaalsContact C-N 3.29Å; H1443-L1445 PolarHBondContact O-N 3.04Å; L1445-E1448 PolarHBondContact O-N 3.1Å; L1445-W1449 PolarHBondContact O-N 3.3Å; L1445-W1449 VanDerWaalsContact O-N 3.15Å; L1445-I1634 HydrophobicContact CB-CG2 4.28Å; L1445-I1634 HydrophobicContact CD2-CG2 3.84Å; L1445-L1635 HydrophobicContact CD1-CD2 4.04Å; L1445-L1635 HydrophobicContact CD2-CD2 4.37Å; L1445-K1638 HydrophobicContact CD2-CB 4.09Å; L1445-L1639 HydrophobicContact CD1-CD1 3.93Å; L1445-L1639 HydrophobicContact CD2-CD1 4.26Å
1446	I	85.1	Confident	76.8	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-71.5	-40.4	175.4	-65.3	163.8	0	0	0	110.8	L1422 T1426 L1429 L1442 H1443 N1444 E1448 W1449 L1450 L1509 L1514	L1422-I1446 HydrophobicContact CD1-CG2 3.99Å; L1422-I1446 HydrophobicContact CD2-CG2 4.18Å; T1426-I1446 HydrophobicContact CG2-CD1 4.38Å; T1426-I1446 WeakPolarHBondContact OG1-CD1 3.28Å; L1429-I1446 HydrophobicContact CD1-CG1 3.96Å; L1442-I1446 HydrophobicContact CD1-CD1 4.16Å; L1442-I1446 HydrophobicContact CD1-CG1 4.46Å; L1442-I1446 HydrophobicContact CG-CD1 3.99Å; L1442-I1446 WeakPolarHBondContact O-CD1 3.39Å; L1442-I1446 VanDerWaalsContact O-CG1 3.29Å; L1442-I1446 WeakPolarHBondContact O-CG1 3.36Å; L1442-I1446 PolarHBondContact O-N 3.24Å; L1442-I1446 VanDerWaalsContact O-N 3.1Å; H1443-I1446 PolarHBondContact O-N 3.25Å; H1443-I1446 VanDerWaalsContact O-N 3.13Å; N1444-I1446 VanDerWaalsContact C-N 3.34Å; N1444-I1446 PolarHBondContact O-N 2.93Å; I1446-E1448 VanDerWaalsContact C-N 3.3Å; I1446-E1448 PolarHBondContact O-N 3.09Å; I1446-W1449 WeakPolarHBondContact O-CB 3.3Å; I1446-W1449 PolarHBondContact O-N 3.24Å; I1446-L1450 HydrophobicContact CG2-CD1 4.43Å; I1446-L1450 WeakPolarHBondContact O-CG 3.4Å; I1446-L1450 PolarHBondContact O-N 3.24Å; I1446-L1509 HydrophobicContact CD1-CD2 4.45Å; I1446-L1509 HydrophobicContact CG2-CB 4.48Å; I1446-L1509 HydrophobicContact CG2-CD2 3.94Å; I1446-L1514 HydrophobicContact CD1-CD1 3.88Å
1447	D	81.9	Confident	76	Confident	10.8 Å²	10.8	39.2 Å²	39.2	6%	0.058	19%	0.188	C	C	.	.	H	α-helix	trans	-60.8	-40.9	175.1	-72.1	-20.4	0	0	0	111.5	H1443 N1444 W1449 L1450 I1451 H1508 L1509	H1443-D1447 IonicContact CD2-OD1 3.47Å; H1443-D1447 IonicContact CD2-OD2 3.14Å; H1443-D1447 PolarHBondContact CD2-OD2 3.25Å; H1443-D1447 VanDerWaalsContact CD2-OD2 3.31Å; H1443-D1447 IonicContact NE2-OD1 3.43Å; H1443-D1447 IonicContact NE2-OD2 3.6Å; H1443-D1447 PolarHBondContact O-N 3.04Å; N1444-D1447 PolarHBondContact O-N 3.23Å; D1447-W1449 VanDerWaalsContact C-N 3.34Å; D1447-W1449 PolarHBondContact O-N 3.08Å; D1447-L1450 CarbonylContact O-C 3.57Å; D1447-L1450 WeakPolarHBondContact O-CB 3.38Å; D1447-L1450 PolarHBondContact O-N 3.23Å; D1447-L1450 VanDerWaalsContact O-N 3.14Å; D1447-I1451 VanDerWaalsContact O-CG1 3.28Å; D1447-I1451 WeakPolarHBondContact O-CG1 3.46Å; D1447-I1451 PolarHBondContact O-N 2.96Å; D1447-H1508 VanDerWaalsContact CG-ND1 3.3Å; D1447-H1508 WeakPolarHBondContact OD1-CA 3.35Å; D1447-H1508 IonicContact OD1-CG 3.81Å; D1447-H1508 IonicContact OD1-ND1 3.34Å; D1447-H1508 PolarHBondContact OD1-ND1 3.1Å; D1447-H1508 IonicContact OD2-CE1 3.76Å; D1447-H1508 PolarHBondContact OD2-CE1 3.22Å; D1447-H1508 VanDerWaalsContact OD2-CE1 3.26Å; D1447-H1508 IonicContact OD2-CG 3Å; D1447-H1508 IonicContact OD2-ND1 3.45Å; D1447-H1508 PolarHBondContact OD2-ND1 3.02Å; D1447-L1509 WeakPolarHBondContact OD1-CB 3.19Å; D1447-L1509 PolarHBondContact OD1-N 3.11Å
1448	E	81.2	Confident	74.7	Confident	38.4 Å²	38.4	45 Å²	45	18%	0.179	22%	0.215	C	C	.	.	H	α-helix	trans	-64.1	-38.6	176	-83.7	-68.4	177.6	0	0	112	N1444 L1445 I1446 L1450 I1451 E1452 I1634 K1638	N1444-E1448 WeakPolarHBondContact O-CB 3.27Å; N1444-E1448 VanDerWaalsContact O-CG 3.23Å; N1444-E1448 WeakPolarHBondContact O-CG 3.32Å; N1444-E1448 PolarHBondContact O-N 3.19Å; N1444-E1448 VanDerWaalsContact O-N 3.07Å; L1445-E1448 PolarHBondContact O-N 3.1Å; I1446-E1448 VanDerWaalsContact C-N 3.3Å; I1446-E1448 PolarHBondContact O-N 3.09Å; E1448-L1450 VanDerWaalsContact C-N 3.32Å; E1448-L1450 PolarHBondContact O-N 3.01Å; E1448-I1451 PolarHBondContact O-N 3.27Å; E1448-E1452 WeakPolarHBondContact O-CG 3.42Å; E1448-E1452 PolarHBondContact O-N 3.03Å; E1448-I1634 HydrophobicContact CB-CG2 4.38Å; E1448-K1638 HydrophobicContact CB-CG 4.31Å; E1448-K1638 VanDerWaalsContact CD-CE 3.48Å; E1448-K1638 HydrophobicContact CG-CB 4.42Å; E1448-K1638 HydrophobicContact CG-CD 4.11Å; E1448-K1638 HydrophobicContact CG-CG 3.89Å; E1448-K1638 WeakPolarHBondContact OE1-CD 3.33Å; E1448-K1638 VanDerWaalsContact OE1-CE 3.26Å; E1448-K1638 WeakPolarHBondContact OE1-CE 3.34Å; E1448-K1638 IonicContact OE1-NZ 3.24Å; E1448-K1638 PolarHBondContact OE1-NZ 3.39Å; E1448-K1638 WeakPolarHBondContact OE2-CE 3.32Å; E1448-K1638 IonicContact OE2-NZ 3.66Å; E1448-K1638 PolarHBondContact OE2-NZ 3Å
1449	W	84.9	Confident	73.6	Confident	1.4 Å²	1.4	50.5 Å²	50.5	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-63.4	-38	171.8	174.4	68.9	0	0	0	112.8	E1421 L1422 I1425 L1445 I1446 D1447 E1452 S1453 L1623 K1624 V1626 I1634	E1421-W1449 HydrophobicContact CB-CH2 3.78Å; E1421-W1449 HydrophobicContact CB-CZ2 4.03Å; L1422-W1449 HydrophobicContact CD1-CZ3 4.44Å; L1422-W1449 HydrophobicContact CD2-CE3 4.44Å; L1422-W1449 HydrophobicContact CD2-CZ3 3.71Å; L1422-W1449 HydrophobicContact CG-CZ3 4.32Å; I1425-W1449 HydrophobicContact CB-CD2 4.25Å; I1425-W1449 HydrophobicContact CB-CE3 4.42Å; I1425-W1449 HydrophobicContact CB-CG 4.49Å; I1425-W1449 HydrophobicContact CD1-CB 4.36Å; I1425-W1449 HydrophobicContact CD1-CD2 4.4Å; I1425-W1449 HydrophobicContact CD1-CG 3.94Å; I1425-W1449 HydrophobicContact CG1-CB 4.12Å; I1425-W1449 HydrophobicContact CG1-CD2 3.91Å; I1425-W1449 HydrophobicContact CG1-CE3 4.33Å; I1425-W1449 HydrophobicContact CG1-CG 3.8Å; I1425-W1449 HydrophobicContact CG2-CD2 4.24Å; I1425-W1449 HydrophobicContact CG2-CE3 3.91Å; I1425-W1449 HydrophobicContact CG2-CH2 4.45Å; I1425-W1449 HydrophobicContact CG2-CZ3 4.06Å; L1445-W1449 PolarHBondContact O-N 3.3Å; L1445-W1449 VanDerWaalsContact O-N 3.15Å; I1446-W1449 WeakPolarHBondContact O-CB 3.3Å; I1446-W1449 PolarHBondContact O-N 3.24Å; D1447-W1449 VanDerWaalsContact C-N 3.34Å; D1447-W1449 PolarHBondContact O-N 3.08Å; W1449-E1452 PolarHBondContact O-N 3.28Å; W1449-S1453 VanDerWaalsContact O-CB 3.28Å; W1449-S1453 WeakPolarHBondContact O-CB 3.38Å; W1449-S1453 PolarHBondContact O-N 3.1Å; W1449-S1453 PolarHBondContact O-OG 3.05Å; W1449-L1623 HydrophobicContact CH2-CB 4.28Å; W1449-L1623 HydrophobicContact CH2-CD1 3.99Å; W1449-L1623 HydrophobicContact CH2-CD2 4.27Å; W1449-L1623 HydrophobicContact CH2-CG 4.22Å; W1449-L1623 HydrophobicContact CZ2-CB 4.3Å; W1449-L1623 HydrophobicContact CZ3-CD1 4.4Å; W1449-L1623 HydrophobicContact CZ3-CD2 4.27Å; W1449-K1624 WeakPolarHBondContact CZ2-O 3.28Å; W1449-K1624 PolarHBondContact NE1-O 3.32Å; W1449-V1626 HydrophobicContact CZ2-CG2 3.82Å; W1449-I1634 HydrophobicContact CB-CD1 3.7Å; W1449-I1634 HydrophobicContact CG-CD1 4.08Å
1450	L	80.5	Confident	72.4	Confident	20 Å²	20	58.6 Å²	58.6	11%	0.105	27%	0.267	C	S	.	.	H	α-helix	trans	-65.6	-40.8	174.5	-71.3	171.7	0	0	0	111.2	I1446 D1447 E1448 S1453 W1454 P1507 L1509 F1598 L1623	I1446-L1450 HydrophobicContact CG2-CD1 4.43Å; I1446-L1450 WeakPolarHBondContact O-CG 3.4Å; I1446-L1450 PolarHBondContact O-N 3.24Å; D1447-L1450 CarbonylContact O-C 3.57Å; D1447-L1450 WeakPolarHBondContact O-CB 3.38Å; D1447-L1450 PolarHBondContact O-N 3.23Å; D1447-L1450 VanDerWaalsContact O-N 3.14Å; E1448-L1450 VanDerWaalsContact C-N 3.32Å; E1448-L1450 PolarHBondContact O-N 3.01Å; L1450-S1453 PolarHBondContact O-N 3.17Å; L1450-W1454 VanDerWaalsContact O-CB 3.26Å; L1450-W1454 WeakPolarHBondContact O-CB 3.37Å; L1450-W1454 VanDerWaalsContact O-CD1 3.29Å; L1450-W1454 PolarHBondContact O-N 3.25Å; L1450-P1507 HydrophobicContact CB-CB 4.22Å; L1450-P1507 HydrophobicContact CB-CG 4.33Å; L1450-L1509 HydrophobicContact CD1-CB 4.02Å; L1450-F1598 HydrophobicContact CD2-CZ 4.3Å; L1450-L1623 HydrophobicContact CD2-CD2 4.2Å
1451	I	76.7	Confident	70.9	Confident	19.4 Å²	19.4	60.3 Å²	60.3	10%	0.099	28%	0.28	C	S	.	.	H	α-helix	trans	-63.7	-49.9	175.3	-66.8	163.6	0	0	0	110.4	D1447 E1448 S1453 W1454 M1455 Q1506 P1507	D1447-I1451 VanDerWaalsContact O-CG1 3.28Å; D1447-I1451 WeakPolarHBondContact O-CG1 3.46Å; D1447-I1451 PolarHBondContact O-N 2.96Å; E1448-I1451 PolarHBondContact O-N 3.27Å; I1451-S1453 VanDerWaalsContact C-N 3.29Å; I1451-S1453 PolarHBondContact O-N 3.01Å; I1451-W1454 PolarHBondContact O-N 3.23Å; I1451-W1454 VanDerWaalsContact O-N 3.13Å; I1451-M1455 HydrophobicContact CG2-CG 4.13Å; I1451-M1455 HydrophobicContact CG2-SD 4.05Å; I1451-M1455 WeakPolarHBondContact O-CB 3.27Å; I1451-M1455 VanDerWaalsContact O-CG 3.29Å; I1451-M1455 WeakPolarHBondContact O-CG 3.27Å; I1451-M1455 PolarHBondContact O-N 2.99Å; I1451-Q1506 HydrophobicContact CD1-CB 4.37Å; I1451-Q1506 HydrophobicContact CG1-CB 4.43Å; I1451-P1507 HydrophobicContact CB-CG 4.44Å; I1451-P1507 HydrophobicContact CG1-CG 3.85Å
1452	E	73.5	Confident	69.3	Low	46.2 Å²	46.2	59.9 Å²	59.9	22%	0.216	30%	0.297	C	S	.	.	H	α-helix	trans	-57.5	-40.8	177	-80.4	-164.3	-175.9	0	0	112	E1448 W1449 W1454 M1455 E1456 K1624 N1633	E1448-E1452 WeakPolarHBondContact O-CG 3.42Å; E1448-E1452 PolarHBondContact O-N 3.03Å; W1449-E1452 PolarHBondContact O-N 3.28Å; E1452-W1454 VanDerWaalsContact C-N 3.31Å; E1452-W1454 PolarHBondContact O-N 3.17Å; E1452-M1455 PolarHBondContact O-N 3.22Å; E1452-E1456 PolarHBondContact O-N 3.18Å; E1452-E1456 VanDerWaalsContact O-N 3.16Å; E1452-K1624 HydrophobicContact CB-CD 4.39Å; E1452-K1624 IonicContact OE2-NZ 3.41Å; E1452-K1624 PolarHBondContact OE2-NZ 3.17Å; E1452-N1633 PolarHBondContact OE1-ND2 3.31Å
1453	S	72.8	Confident	67.5	Low	4.6 Å²	4.6	67 Å²	67	3%	0.032	33%	0.325	C	S	.	.	H	α-helix	trans	-67.6	-35.6	177.8	-61.3	0	0	0	0	112.5	W1449 L1450 I1451 K1624	W1449-S1453 VanDerWaalsContact O-CB 3.28Å; W1449-S1453 WeakPolarHBondContact O-CB 3.38Å; W1449-S1453 PolarHBondContact O-N 3.1Å; W1449-S1453 PolarHBondContact O-OG 3.05Å; L1450-S1453 PolarHBondContact O-N 3.17Å; I1451-S1453 VanDerWaalsContact C-N 3.29Å; I1451-S1453 PolarHBondContact O-N 3.01Å; S1453-K1624 VanDerWaalsContact OG-CB 3.31Å; S1453-K1624 WeakPolarHBondContact OG-CB 3.34Å; S1453-K1624 PolarHBondContact OG-N 3.07Å; S1453-K1624 VanDerWaalsContact OG-N 3.12Å
1454	W	68.5	Low	66	Low	86 Å²	86	70.4 Å²	70.4	33%	0.326	35%	0.347	S	S	.	.	H	α-helix	trans	-78	-34.1	179.6	-163.7	74.5	0	0	0	113.1	L1450 I1451 E1452 E1456 E1457 Q1458 P1507	L1450-W1454 VanDerWaalsContact O-CB 3.26Å; L1450-W1454 WeakPolarHBondContact O-CB 3.37Å; L1450-W1454 VanDerWaalsContact O-CD1 3.29Å; L1450-W1454 PolarHBondContact O-N 3.25Å; I1451-W1454 PolarHBondContact O-N 3.23Å; I1451-W1454 VanDerWaalsContact O-N 3.13Å; E1452-W1454 VanDerWaalsContact C-N 3.31Å; E1452-W1454 PolarHBondContact O-N 3.17Å; W1454-E1456 PolarHBondContact O-N 2.93Å; W1454-E1457 PolarHBondContact O-N 3.11Å; W1454-Q1458 HydrophobicContact CD2-CG 4.38Å; W1454-Q1458 HydrophobicContact CH2-CG 4.45Å; W1454-Q1458 VanDerWaalsContact CH2-OE1 3.24Å; W1454-Q1458 HydrophobicContact CZ2-CG 4.15Å; W1454-Q1458 PolarHBondContact O-N 3.09Å; W1454-P1507 HydrophobicContact CB-CG 3.98Å; W1454-P1507 HydrophobicContact CD2-CB 4Å; W1454-P1507 HydrophobicContact CD2-CG 4.32Å; W1454-P1507 HydrophobicContact CE3-CB 4.47Å; W1454-P1507 HydrophobicContact CG-CB 4.08Å; W1454-P1507 HydrophobicContact CG-CG 4.16Å
1455	M	61.5	Low	65	Low	47.2 Å²	47.2	68.2 Å²	68.2	23%	0.233	34%	0.335	C	S	.	.	H	α-helix	trans	-72.6	-21.3	-178.9	-67.8	-160	82	0	0	112.7	I1451 E1452 E1457 Q1458 Y1459 Y1463	I1451-M1455 HydrophobicContact CG2-CG 4.13Å; I1451-M1455 HydrophobicContact CG2-SD 4.05Å; I1451-M1455 WeakPolarHBondContact O-CB 3.27Å; I1451-M1455 VanDerWaalsContact O-CG 3.29Å; I1451-M1455 WeakPolarHBondContact O-CG 3.27Å; I1451-M1455 PolarHBondContact O-N 2.99Å; E1452-M1455 PolarHBondContact O-N 3.22Å; M1455-E1457 PolarHBondContact O-N 3.23Å; M1455-Q1458 PolarHBondContact O-N 3.19Å; M1455-Y1459 HydrophobicContact CE-CD2 4.12Å; M1455-Y1459 HydrophobicContact CE-CE2 4.01Å; M1455-Y1459 HydrophobicContact CE-CG 4.38Å; M1455-Y1459 VanDerWaalsContact CE-O 3.26Å; M1455-Y1459 WeakPolarHBondContact CE-O 3.4Å; M1455-Y1459 PolarHBondContact O-N 3.08Å; M1455-Y1459 VanDerWaalsContact O-N 3.14Å; M1455-Y1463 HydrophobicContact CE-CD1 4.22Å; M1455-Y1463 HydrophobicContact CE-CD2 3.66Å; M1455-Y1463 VanDerWaalsContact CE-CD2 3.43Å; M1455-Y1463 HydrophobicContact CE-CE2 4.03Å; M1455-Y1463 HydrophobicContact CE-CG 3.88Å; M1455-Y1463 HydrophobicContact SD-CD2 4.1Å; M1455-Y1463 HydrophobicContact SD-CE2 3.95Å; M1455-Y1463 HydrophobicContact SD-CG 4.33Å
1456	E	59.6	Low	64	Low	113.8 Å²	113.8	70.1 Å²	70.1	53%	0.532	35%	0.349	S	S	.	.	H	α-helix	trans	-59.3	-30.3	172.9	-82.1	-178.8	-178.3	0	0	112.3	E1452 W1454 Q1458 Y1459 K1624	E1452-E1456 PolarHBondContact O-N 3.18Å; E1452-E1456 VanDerWaalsContact O-N 3.16Å; W1454-E1456 PolarHBondContact O-N 2.93Å; E1456-Q1458 PolarHBondContact O-N 3.07Å; E1456-Y1459 PolarHBondContact O-N 2.92Å; E1456-Y1459 VanDerWaalsContact O-N 3.11Å; E1456-K1624 WeakPolarHBondContact OE1-CD 3.37Å; E1456-K1624 WeakPolarHBondContact OE1-CE 3.26Å; E1456-K1624 IonicContact OE1-NZ 3.12Å; E1456-K1624 PolarHBondContact OE1-NZ 3.29Å; E1456-K1624 IonicContact OE2-NZ 3.25Å
1457	E	55	Low	63.2	Low	100.6 Å²	100.6	70.7 Å²	70.7	47%	0.47	35%	0.351	S	S	.	.	H	α-helix	trans	-74	-34.3	178.2	-71.5	-169.4	151.2	0	0	113.5	W1454 M1455 Y1459 I1621 H1622	W1454-E1457 PolarHBondContact O-N 3.11Å; M1455-E1457 PolarHBondContact O-N 3.23Å; E1457-Y1459 VanDerWaalsContact C-N 3.34Å; E1457-Y1459 PolarHBondContact O-N 3.08Å; E1457-I1621 VanDerWaalsContact OE2-CA 3.26Å; E1457-I1621 WeakPolarHBondContact OE2-CA 3.4Å; E1457-I1621 WeakPolarHBondContact OE2-CG2 3.43Å; E1457-H1622 WeakPolarHBondContact OE1-CA 3.49Å; E1457-H1622 PolarHBondContact OE1-N 3.08Å
1458	Q	51.6	Low	62.6	Low	124.4 Å²	124.4	76.1 Å²	76.1	58%	0.581	38%	0.376	S	S	*	.	H	α-helix	trans	-84	-28.2	-176.1	-64.7	-133.5	-14.3	0	0	114.3	W1454 M1455 E1456	W1454-Q1458 HydrophobicContact CD2-CG 4.38Å; W1454-Q1458 HydrophobicContact CH2-CG 4.45Å; W1454-Q1458 VanDerWaalsContact CH2-OE1 3.24Å; W1454-Q1458 HydrophobicContact CZ2-CG 4.15Å; W1454-Q1458 PolarHBondContact O-N 3.09Å; M1455-Q1458 PolarHBondContact O-N 3.19Å; E1456-Q1458 PolarHBondContact O-N 3.07Å
1459	Y	51.5	Low	62.1	Low	137.2 Å²	137.2	78.6 Å²	78.6	54%	0.538	39%	0.388	S	S	.	.			trans	-118.5	67.8	-174.7	-71.9	-87.1	0	0	0	112.2	M1455 E1456 E1457 N1461	M1455-Y1459 HydrophobicContact CE-CD2 4.12Å; M1455-Y1459 HydrophobicContact CE-CE2 4.01Å; M1455-Y1459 HydrophobicContact CE-CG 4.38Å; M1455-Y1459 VanDerWaalsContact CE-O 3.26Å; M1455-Y1459 WeakPolarHBondContact CE-O 3.4Å; M1455-Y1459 PolarHBondContact O-N 3.08Å; M1455-Y1459 VanDerWaalsContact O-N 3.14Å; E1456-Y1459 PolarHBondContact O-N 2.92Å; E1456-Y1459 VanDerWaalsContact O-N 3.11Å; E1457-Y1459 VanDerWaalsContact C-N 3.34Å; E1457-Y1459 PolarHBondContact O-N 3.08Å; Y1459-N1461 PolarHBondContact O-N 3.15Å; Y1459-N1461 VanDerWaalsContact O-N 3.09Å
1460	K	49.6	Very low	61.5	Low	185 Å²	185	79.6 Å²	79.6	80%	0.804	39%	0.393	S	S	*	.	S	Bend	trans	-60.9	-13.5	164.4	-85.4	-177.1	176.5	174.3	0	113.6	G1462	K1460-G1462 VanDerWaalsContact C-N 3.28Å; K1460-G1462 PolarHBondContact O-N 3.15Å
1461	N	42.2	Very low	61	Low	153 Å²	153	84 Å²	84	82%	0.818	41%	0.411	S	S	*	.	S	Bend	trans	-130.3	97.6	176.8	-68.6	-32.6	0	0	0	110.9	Y1459	Y1459-N1461 PolarHBondContact O-N 3.15Å; Y1459-N1461 VanDerWaalsContact O-N 3.09Å
1462	G	45.5	Very low	60.5	Low	70.2 Å²	70.2	85.2 Å²	85.2	72%	0.724	42%	0.42	S	S	*	.			trans	140.4	11.3	157.5	0	0	0	0	0	119.3	K1460	K1460-G1462 VanDerWaalsContact C-N 3.28Å; K1460-G1462 PolarHBondContact O-N 3.15Å
1463	Y	46	Very low	59.8	Low	149.6 Å²	149.6	86.1 Å²	86.1	59%	0.587	43%	0.43	S	S	*	.			trans	-106.9	102.6	166	-158.9	-95.3	0	0	0	109.2	M1455 D1465	M1455-Y1463 HydrophobicContact CE-CD1 4.22Å; M1455-Y1463 HydrophobicContact CE-CD2 3.66Å; M1455-Y1463 VanDerWaalsContact CE-CD2 3.43Å; M1455-Y1463 HydrophobicContact CE-CE2 4.03Å; M1455-Y1463 HydrophobicContact CE-CG 3.88Å; M1455-Y1463 HydrophobicContact SD-CD2 4.1Å; M1455-Y1463 HydrophobicContact SD-CE2 3.95Å; M1455-Y1463 HydrophobicContact SD-CG 4.33Å; Y1463-D1465 PolarHBondContact O-N 3.02Å
1464	T	51	Low	59.6	Low	88.8 Å²	88.8	86.2 Å²	86.2	55%	0.545	43%	0.43	S	S	.	.			trans	-87.1	111.2	172.7	48.2	0	0	0	0	108.5	S1466 E1469	T1464-S1466 PolarHBondContact O-N 3.12Å; T1464-S1466 VanDerWaalsContact O-N 3.12Å; T1464-E1469 PolarHBondContact OG1-OE1 3.38Å
1465	D	60.7	Low	59.5	Low	31.4 Å²	31.4	86.4 Å²	86.4	17%	0.168	44%	0.437	C	S	.	.			trans	-60.4	122.9	165.7	-177.7	-1.6	0	0	0	107.4	Y1463 W1467 Q1468 R1654	Y1463-D1465 PolarHBondContact O-N 3.02Å; D1465-W1467 PolarHBondContact O-N 3.09Å; D1465-W1467 VanDerWaalsContact OD1-CD1 3.28Å; D1465-W1467 PolarHBondContact OD1-N 3.37Å; D1465-Q1468 HydrophobicContact CB-CB 4.35Å; D1465-Q1468 HydrophobicContact CB-CG 3.95Å; D1465-Q1468 WeakPolarHBondContact O-CA 3.23Å; D1465-Q1468 WeakPolarHBondContact O-CB 3.19Å; D1465-Q1468 PolarHBondContact O-N 3.23Å; D1465-R1654 IonicContact OD2-CZ 3.35Å; D1465-R1654 VanDerWaalsContact OD2-CZ 3.26Å; D1465-R1654 IonicContact OD2-NH1 3.14Å; D1465-R1654 PolarHBondContact OD2-NH1 3.18Å; D1465-R1654 IonicContact OD2-NH2 3.13Å; D1465-R1654 PolarHBondContact OD2-NH2 2.98Å
1466	S	64.9	Low	60.1	Low	45 Å²	45	88.3 Å²	88.3	32%	0.315	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-55.7	-26.4	-173.5	-48.9	0	0	0	0	112.5	T1464 Q1468 E1469 I1486	T1464-S1466 PolarHBondContact O-N 3.12Å; T1464-S1466 VanDerWaalsContact O-N 3.12Å; S1466-Q1468 VanDerWaalsContact C-N 3.33Å; S1466-Q1468 PolarHBondContact O-N 2.9Å; S1466-E1469 PolarHBondContact O-N 3.18Å; S1466-I1486 WeakPolarHBondContact O-CG2 3.43Å
1467	W	69	Low	60.7	Low	11.4 Å²	11.4	85.3 Å²	85.3	4%	0.043	44%	0.436	C	S	.	.	G	3₁₀ helix	trans	-68.5	-29.6	174.2	-65.8	107.6	0	0	0	114	D1465 E1469 L1470 I1487 I1490 F1494 L1645 L1649 E1657 L1661	D1465-W1467 PolarHBondContact O-N 3.09Å; D1465-W1467 VanDerWaalsContact OD1-CD1 3.28Å; D1465-W1467 PolarHBondContact OD1-N 3.37Å; W1467-E1469 VanDerWaalsContact C-N 3.27Å; W1467-E1469 PolarHBondContact O-N 3.26Å; W1467-L1470 HydrophobicContact CE3-CD1 3.87Å; W1467-L1470 HydrophobicContact CZ3-CD1 4.38Å; W1467-L1470 WeakPolarHBondContact O-CB 3.35Å; W1467-L1470 VanDerWaalsContact O-CG 3.3Å; W1467-L1470 WeakPolarHBondContact O-CG 3.33Å; W1467-L1470 PolarHBondContact O-N 3.23Å; W1467-I1487 HydrophobicContact CZ3-CG1 4.36Å; W1467-I1490 HydrophobicContact CD2-CD1 3.98Å; W1467-I1490 HydrophobicContact CE3-CD1 3.96Å; W1467-I1490 HydrophobicContact CG-CD1 4.42Å; W1467-I1490 HydrophobicContact CH2-CB 4.39Å; W1467-I1490 HydrophobicContact CH2-CD1 4.32Å; W1467-I1490 HydrophobicContact CH2-CG2 3.77Å; W1467-I1490 HydrophobicContact CZ2-CB 4.47Å; W1467-I1490 HydrophobicContact CZ2-CD1 4.32Å; W1467-I1490 HydrophobicContact CZ2-CG2 3.54Å; W1467-I1490 VanDerWaalsContact CZ2-CG2 3.41Å; W1467-I1490 HydrophobicContact CZ3-CD1 4.11Å; W1467-I1490 HydrophobicContact CZ3-CG2 4.35Å; W1467-F1494 HydrophobicContact CH2-CE2 4.43Å; W1467-F1494 AromaticContact CZ2-CE2 3.89Å; W1467-F1494 HydrophobicContact CZ2-CE2 4.01Å; W1467-F1494 HydrophobicContact CZ2-CZ 4.22Å; W1467-L1645 HydrophobicContact CH2-CD2 4.08Å; W1467-L1645 HydrophobicContact CZ2-CD1 4.45Å; W1467-L1645 HydrophobicContact CZ2-CD2 4.17Å; W1467-L1649 HydrophobicContact CH2-CD1 4.4Å; W1467-L1649 HydrophobicContact CZ3-CD1 4.34Å; W1467-E1657 HydrophobicContact CB-CG 4.36Å; W1467-E1657 HydrophobicContact CE3-CB 4.35Å; W1467-E1657 HydrophobicContact CE3-CG 4.48Å; W1467-L1661 HydrophobicContact CH2-CD1 4.09Å; W1467-L1661 HydrophobicContact CH2-CD2 4.05Å; W1467-L1661 HydrophobicContact CH2-CG 4.44Å; W1467-L1661 HydrophobicContact CZ3-CD1 3.92Å; W1467-L1661 HydrophobicContact CZ3-CD2 3.82Å; W1467-L1661 HydrophobicContact CZ3-CG 4.04Å
1468	Q	68.1	Low	61.5	Low	125 Å²	125	85.9 Å²	85.9	58%	0.584	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-74.6	-12.4	179.7	-67.2	177.3	3.2	0	0	113	D1465 S1466 L1470	D1465-Q1468 HydrophobicContact CB-CB 4.35Å; D1465-Q1468 HydrophobicContact CB-CG 3.95Å; D1465-Q1468 WeakPolarHBondContact O-CA 3.23Å; D1465-Q1468 WeakPolarHBondContact O-CB 3.19Å; D1465-Q1468 PolarHBondContact O-N 3.23Å; S1466-Q1468 VanDerWaalsContact C-N 3.33Å; S1466-Q1468 PolarHBondContact O-N 2.9Å; Q1468-L1470 VanDerWaalsContact C-N 3.28Å; Q1468-L1470 PolarHBondContact O-N 3.22Å
1469	E	71.4	Confident	62.7	Low	91.2 Å²	91.2	81.5 Å²	81.5	43%	0.426	42%	0.422	S	S	.	.	G	3₁₀ helix	trans	-76.9	-11	174.9	-62.9	-173.6	-178.4	0	0	113	T1464 S1466 W1467 K1471 I1486	T1464-E1469 PolarHBondContact OG1-OE1 3.38Å; S1466-E1469 PolarHBondContact O-N 3.18Å; W1467-E1469 VanDerWaalsContact C-N 3.27Å; W1467-E1469 PolarHBondContact O-N 3.26Å; E1469-K1471 PolarHBondContact O-N 3.45Å; E1469-I1486 HydrophobicContact CB-CD1 3.78Å
1470	L	71.8	Confident	63.8	Low	20.8 Å²	20.8	75.4 Å²	75.4	11%	0.109	40%	0.399	C	S	.	.			trans	-68.1	127.4	178.4	-66	174.4	0	0	0	111.7	W1467 Q1468 N1483 I1486 I1487 E1657 C1660	W1467-L1470 HydrophobicContact CE3-CD1 3.87Å; W1467-L1470 HydrophobicContact CZ3-CD1 4.38Å; W1467-L1470 WeakPolarHBondContact O-CB 3.35Å; W1467-L1470 VanDerWaalsContact O-CG 3.3Å; W1467-L1470 WeakPolarHBondContact O-CG 3.33Å; W1467-L1470 PolarHBondContact O-N 3.23Å; Q1468-L1470 VanDerWaalsContact C-N 3.28Å; Q1468-L1470 PolarHBondContact O-N 3.22Å; L1470-N1483 WeakPolarHBondContact CA-OD1 3.4Å; L1470-N1483 HydrophobicContact CD2-CB 3.9Å; L1470-I1486 HydrophobicContact CD2-CB 4.13Å; L1470-I1486 HydrophobicContact CD2-CD1 4.35Å; L1470-I1486 HydrophobicContact CD2-CG2 3.98Å; L1470-I1486 HydrophobicContact CG-CG2 4.36Å; L1470-I1487 HydrophobicContact CD2-CD1 4.27Å; L1470-I1487 HydrophobicContact CD2-CG1 4.02Å; L1470-E1657 HydrophobicContact CD1-CB 4.41Å; L1470-E1657 HydrophobicContact CD1-CG 4.33Å; L1470-C1660 HydrophobicContact CB-CB 4.47Å; L1470-C1660 HydrophobicContact CD1-CB 4.02Å; L1470-C1660 HydrophobicContact CD2-CB 4.45Å
1471	K	69.6	Low	65	Low	112.6 Å²	112.6	68.5 Å²	68.5	49%	0.49	37%	0.37	S	S	.	.			trans	-101.2	137.5	-174.4	-64.2	177.2	-175.9	172.1	0	112.5	E1469 N1479 N1483	E1469-K1471 PolarHBondContact O-N 3.45Å; K1471-N1479 HydrophobicContact CB-CB 4.34Å; K1471-N1483 PolarHBondContact N-OD1 3.3Å; K1471-N1483 PolarHBondContact O-ND2 3.05Å
1472	V	66.5	Low	66.8	Low	45.4 Å²	45.4	62.8 Å²	62.8	28%	0.275	34%	0.342	S	S	.	.	S	Bend	trans	-126.3	139.1	172.5	175.7	0	0	0	0	107.3	N1656 M1709	V1472-N1656 HydrophobicContact CG2-CB 4.12Å; V1472-M1709 HydrophobicContact CB-CE 4.27Å; V1472-M1709 HydrophobicContact CG1-CE 3.59Å; V1472-M1709 HydrophobicContact CG1-CG 4.34Å; V1472-M1709 HydrophobicContact CG1-SD 3.97Å; V1472-M1709 HydrophobicContact CG2-CE 3.74Å
1473	P	59.8	Low	68.5	Low	64.8 Å²	64.8	59.6 Å²	59.6	42%	0.421	31%	0.309	S	S	.	.			cis	-87.8	155.3	11	34.8	-35.2	0	0	0	115.5	D1475 N1479	P1473-D1475 VanDerWaalsContact C-N 3.28Å; P1473-D1475 WeakPolarHBondContact CB-OD2 3.49Å; P1473-D1475 PolarHBondContact O-N 3.28Å; P1473-D1475 VanDerWaalsContact O-N 3.11Å; P1473-N1479 PolarHBondContact O-ND2 3.02Å; P1473-N1479 VanDerWaalsContact O-ND2 3.11Å
1474	L	67.2	Low	70	Confident	6.6 Å²	6.6	53.3 Å²	53.3	4%	0.035	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	31.4	-177.5	-67.5	162.4	0	0	0	113.5	I1480 N1483 V1659 T1663 M1709 K1712 W1746	L1474-I1480 HydrophobicContact CB-CG1 4.43Å; L1474-I1480 HydrophobicContact CD2-CG1 4.16Å; L1474-I1480 VanDerWaalsContact O-CD1 3.29Å; L1474-I1480 WeakPolarHBondContact O-CD1 3.25Å; L1474-N1483 WeakPolarHBondContact CD2-ND2 3.39Å; L1474-V1659 HydrophobicContact CD1-CG1 4.05Å; L1474-T1663 HydrophobicContact CD1-CG2 4.15Å; L1474-T1663 WeakPolarHBondContact CD1-OG1 3.34Å; L1474-M1709 HydrophobicContact CB-CE 4.13Å; L1474-M1709 HydrophobicContact CB-SD 4.39Å; L1474-M1709 HydrophobicContact CD1-CE 3.51Å; L1474-M1709 VanDerWaalsContact CD1-CE 3.47Å; L1474-M1709 HydrophobicContact CD1-SD 4.05Å; L1474-M1709 HydrophobicContact CG-CE 3.91Å; L1474-M1709 HydrophobicContact CG-SD 4.18Å; L1474-K1712 HydrophobicContact CB-CD 4.34Å; L1474-K1712 PolarHBondContact O-NZ 3.15Å; L1474-W1746 HydrophobicContact CB-CZ2 4.41Å; L1474-W1746 HydrophobicContact CD1-CZ2 4.37Å; L1474-W1746 PolarHBondContact O-NE1 3.19Å
1475	D	67.9	Low	71.3	Confident	90 Å²	90	54.7 Å²	54.7	48%	0.481	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-29.3	179.1	-64	-51.2	0	0	0	112.1	P1473 K1712	P1473-D1475 VanDerWaalsContact C-N 3.28Å; P1473-D1475 WeakPolarHBondContact CB-OD2 3.49Å; P1473-D1475 PolarHBondContact O-N 3.28Å; P1473-D1475 VanDerWaalsContact O-N 3.11Å; D1475-K1712 VanDerWaalsContact OD1-CE 3.28Å; D1475-K1712 WeakPolarHBondContact OD1-CE 3.35Å; D1475-K1712 IonicContact OD1-NZ 3.56Å; D1475-K1712 PolarHBondContact OD1-NZ 2.96Å; D1475-K1712 IonicContact OD2-NZ 2.67Å
1476	N	72.2	Confident	72.1	Confident	87.4 Å²	87.4	54 Å²	54	47%	0.467	28%	0.279	S	S	.	.	S	Bend	trans	-88.8	131.9	-179.1	-132.3	2.2	0	0	0	111.2	D1478 N1479 I1480	N1476-D1478 VanDerWaalsContact C-N 3.26Å; N1476-D1478 PolarHBondContact O-N 3.32Å; N1476-D1478 PolarHBondContact OD1-N 3.21Å; N1476-N1479 HydrophobicContact CB-CB 4.39Å; N1476-N1479 WeakPolarHBondContact O-CB 3.21Å; N1476-N1479 PolarHBondContact O-N 3.2Å; N1476-N1479 VanDerWaalsContact O-N 3.1Å; N1476-I1480 PolarHBondContact O-N 3.12Å; N1476-I1480 VanDerWaalsContact O-N 3.11Å
1477	L	72.3	Confident	72.6	Confident	50.6 Å²	50.6	51.9 Å²	51.9	27%	0.265	26%	0.264	S	S	.	.	H	α-helix	trans	-52.9	-41.3	176.7	-171.1	73.6	0	0	0	112	N1479 I1480 M1481 T1749 A1753 L1756	L1477-N1479 VanDerWaalsContact C-N 3.34Å; L1477-N1479 PolarHBondContact O-N 3.04Å; L1477-I1480 PolarHBondContact O-N 3.23Å; L1477-M1481 HydrophobicContact CD2-SD 4.44Å; L1477-M1481 HydrophobicContact CG-CG 4.48Å; L1477-M1481 HydrophobicContact CG-SD 4.23Å; L1477-M1481 WeakPolarHBondContact O-CB 3.46Å; L1477-M1481 WeakPolarHBondContact O-CG 3.28Å; L1477-M1481 PolarHBondContact O-N 3.19Å; L1477-T1749 HydrophobicContact CD1-CG2 3.91Å; L1477-A1753 HydrophobicContact CD1-CB 3.73Å; L1477-L1756 HydrophobicContact CD2-CD1 4.04Å
1478	D	73.7	Confident	72.8	Confident	113.4 Å²	113.4	55.9 Å²	55.9	61%	0.606	28%	0.28	S	S	*	.	H	α-helix	trans	-62.5	-39.2	179.2	-65.9	-30.7	0	0	0	112.6	N1476 M1481 S1482	N1476-D1478 VanDerWaalsContact C-N 3.26Å; N1476-D1478 PolarHBondContact O-N 3.32Å; N1476-D1478 PolarHBondContact OD1-N 3.21Å; D1478-M1481 PolarHBondContact O-N 3.14Å; D1478-S1482 VanDerWaalsContact O-CB 3.28Å; D1478-S1482 WeakPolarHBondContact O-CB 3.38Å; D1478-S1482 PolarHBondContact O-N 2.99Å; D1478-S1482 PolarHBondContact O-OG 3.14Å
1479	N	76.2	Confident	73.1	Confident	32 Å²	32	54.9 Å²	54.9	17%	0.171	28%	0.276	C	S	.	.	H	α-helix	trans	-68.1	-42.4	177.6	-73	-11.4	0	0	0	110.6	K1471 P1473 N1476 L1477 M1481 S1482 N1483	K1471-N1479 HydrophobicContact CB-CB 4.34Å; P1473-N1479 PolarHBondContact O-ND2 3.02Å; P1473-N1479 VanDerWaalsContact O-ND2 3.11Å; N1476-N1479 HydrophobicContact CB-CB 4.39Å; N1476-N1479 WeakPolarHBondContact O-CB 3.21Å; N1476-N1479 PolarHBondContact O-N 3.2Å; N1476-N1479 VanDerWaalsContact O-N 3.1Å; L1477-N1479 VanDerWaalsContact C-N 3.34Å; L1477-N1479 PolarHBondContact O-N 3.04Å; N1479-M1481 PolarHBondContact O-N 3.37Å; N1479-S1482 WeakPolarHBondContact CA-OG 3.39Å; N1479-S1482 PolarHBondContact O-N 3.06Å; N1479-S1482 PolarHBondContact O-OG 3.45Å; N1479-S1482 VanDerWaalsContact O-OG 3.05Å; N1479-N1483 WeakPolarHBondContact O-CB 3.4Å; N1479-N1483 PolarHBondContact O-N 3.08Å; N1479-N1483 PolarHBondContact O-ND2 3.18Å; N1479-N1483 PolarHBondContact O-OD1 3.21Å
1480	I	75.1	Confident	73	Confident	8.2 Å²	8.2	51 Å²	51	4%	0.042	26%	0.257	C	S	.	.	H	α-helix	trans	-60.4	-50.7	176	-62.2	168.2	0	0	0	109.7	L1474 N1476 L1477 S1482 N1483 E1484 T1749 I1750 A1753	L1474-I1480 HydrophobicContact CB-CG1 4.43Å; L1474-I1480 HydrophobicContact CD2-CG1 4.16Å; L1474-I1480 VanDerWaalsContact O-CD1 3.29Å; L1474-I1480 WeakPolarHBondContact O-CD1 3.25Å; N1476-I1480 PolarHBondContact O-N 3.12Å; N1476-I1480 VanDerWaalsContact O-N 3.11Å; L1477-I1480 PolarHBondContact O-N 3.23Å; I1480-S1482 VanDerWaalsContact C-N 3.33Å; I1480-S1482 PolarHBondContact O-N 3.21Å; I1480-N1483 PolarHBondContact O-N 3.15Å; I1480-E1484 HydrophobicContact CG2-CG 4.45Å; I1480-E1484 WeakPolarHBondContact O-CG 3.42Å; I1480-E1484 PolarHBondContact O-N 2.97Å; I1480-T1749 HydrophobicContact CD1-CG2 4.41Å; I1480-I1750 HydrophobicContact CD1-CG1 4.28Å; I1480-A1753 HydrophobicContact CG2-CB 3.95Å
1481	M	74.8	Confident	72.9	Confident	40.4 Å²	40.4	50.5 Å²	50.5	20%	0.199	26%	0.255	C	S	.	.	H	α-helix	trans	-63	-39.1	179.7	-71.3	-176.4	69.8	0	0	112.9	L1477 D1478 N1479 E1484 K1485 A1753 L1756 Y1760	L1477-M1481 HydrophobicContact CD2-SD 4.44Å; L1477-M1481 HydrophobicContact CG-CG 4.48Å; L1477-M1481 HydrophobicContact CG-SD 4.23Å; L1477-M1481 WeakPolarHBondContact O-CB 3.46Å; L1477-M1481 WeakPolarHBondContact O-CG 3.28Å; L1477-M1481 PolarHBondContact O-N 3.19Å; D1478-M1481 PolarHBondContact O-N 3.14Å; N1479-M1481 PolarHBondContact O-N 3.37Å; M1481-E1484 PolarHBondContact O-N 3.38Å; M1481-K1485 WeakPolarHBondContact O-CB 3.3Å; M1481-K1485 WeakPolarHBondContact O-CG 3.36Å; M1481-K1485 PolarHBondContact O-N 3.16Å; M1481-A1753 HydrophobicContact CG-CB 4.12Å; M1481-L1756 HydrophobicContact CE-CB 4.1Å; M1481-L1756 HydrophobicContact SD-CB 4.28Å; M1481-L1756 HydrophobicContact SD-CD1 4.28Å; M1481-Y1760 HydrophobicContact CE-CD2 4.36Å
1482	S	79.9	Confident	72.7	Confident	33.4 Å²	33.4	49 Å²	49	23%	0.234	25%	0.252	C	S	.	.	H	α-helix	trans	-65.9	-43.1	176.2	79.1	0	0	0	0	112	D1478 N1479 I1480 K1485 I1486	D1478-S1482 VanDerWaalsContact O-CB 3.28Å; D1478-S1482 WeakPolarHBondContact O-CB 3.38Å; D1478-S1482 PolarHBondContact O-N 2.99Å; D1478-S1482 PolarHBondContact O-OG 3.14Å; N1479-S1482 WeakPolarHBondContact CA-OG 3.39Å; N1479-S1482 PolarHBondContact O-N 3.06Å; N1479-S1482 PolarHBondContact O-OG 3.45Å; N1479-S1482 VanDerWaalsContact O-OG 3.05Å; I1480-S1482 VanDerWaalsContact C-N 3.33Å; I1480-S1482 PolarHBondContact O-N 3.21Å; S1482-K1485 PolarHBondContact O-N 3.23Å; S1482-I1486 WeakPolarHBondContact O-CD1 3.39Å; S1482-I1486 WeakPolarHBondContact O-CG1 3.31Å; S1482-I1486 PolarHBondContact O-N 3.08Å; S1482-I1486 VanDerWaalsContact O-N 3.11Å
1483	N	79.9	Confident	72.7	Confident	3.6 Å²	3.6	53.2 Å²	53.2	2%	0.019	27%	0.269	C	S	.	.	H	α-helix	trans	-65.4	-43.4	178.2	-71	-8.4	0	0	0	111.5	L1470 K1471 L1474 N1479 I1480 K1485 I1486 I1487	L1470-N1483 WeakPolarHBondContact CA-OD1 3.4Å; L1470-N1483 HydrophobicContact CD2-CB 3.9Å; K1471-N1483 PolarHBondContact N-OD1 3.3Å; K1471-N1483 PolarHBondContact O-ND2 3.05Å; L1474-N1483 WeakPolarHBondContact CD2-ND2 3.39Å; N1479-N1483 WeakPolarHBondContact O-CB 3.4Å; N1479-N1483 PolarHBondContact O-N 3.08Å; N1479-N1483 PolarHBondContact O-ND2 3.18Å; N1479-N1483 PolarHBondContact O-OD1 3.21Å; I1480-N1483 PolarHBondContact O-N 3.15Å; N1483-K1485 VanDerWaalsContact C-N 3.29Å; N1483-K1485 PolarHBondContact O-N 3.23Å; N1483-I1486 PolarHBondContact O-N 3.07Å; N1483-I1487 WeakPolarHBondContact O-CB 3.34Å; N1483-I1487 VanDerWaalsContact O-CG1 3.26Å; N1483-I1487 WeakPolarHBondContact O-CG1 3.24Å; N1483-I1487 PolarHBondContact O-N 2.95Å
1484	E	78.4	Confident	72.7	Confident	17.2 Å²	17.2	52.7 Å²	52.7	8%	0.08	26%	0.26	C	S	.	.	H	α-helix	trans	-58.1	-41.5	175.8	-75.9	-56.6	111.2	0	0	112	I1480 M1481 I1487 Y1488 S1664 P1665 A1666	I1480-E1484 HydrophobicContact CG2-CG 4.45Å; I1480-E1484 WeakPolarHBondContact O-CG 3.42Å; I1480-E1484 PolarHBondContact O-N 2.97Å; M1481-E1484 PolarHBondContact O-N 3.38Å; E1484-I1487 PolarHBondContact O-N 3.26Å; E1484-Y1488 VanDerWaalsContact O-CB 3.28Å; E1484-Y1488 WeakPolarHBondContact O-CB 3.33Å; E1484-Y1488 VanDerWaalsContact O-CD2 3.28Å; E1484-Y1488 WeakPolarHBondContact O-CD2 3.36Å; E1484-Y1488 PolarHBondContact O-N 3.03Å; E1484-S1664 VanDerWaalsContact CD-OG 3.26Å; E1484-S1664 WeakPolarHBondContact OE1-CA 3.15Å; E1484-S1664 WeakPolarHBondContact OE1-CB 3.25Å; E1484-S1664 PolarHBondContact OE1-OG 3.2Å; E1484-S1664 PolarHBondContact OE2-OG 3.11Å; E1484-P1665 VanDerWaalsContact CD-CD 3.47Å; E1484-P1665 VanDerWaalsContact OE1-CD 3.27Å; E1484-P1665 WeakPolarHBondContact OE1-CD 3.24Å; E1484-P1665 WeakPolarHBondContact OE2-CD 3.42Å; E1484-A1666 VanDerWaalsContact OE2-CB 3.27Å; E1484-A1666 WeakPolarHBondContact OE2-CB 3.42Å; E1484-A1666 PolarHBondContact OE2-N 3.26Å
1485	K	77.9	Confident	72.2	Confident	118.4 Å²	118.4	56.9 Å²	56.9	52%	0.515	28%	0.283	S	S	.	.	H	α-helix	trans	-63.7	-44.3	177.4	-135.9	179	-179.8	-178.4	0	112	M1481 S1482 N1483 Y1488 Q1489	M1481-K1485 WeakPolarHBondContact O-CB 3.3Å; M1481-K1485 WeakPolarHBondContact O-CG 3.36Å; M1481-K1485 PolarHBondContact O-N 3.16Å; S1482-K1485 PolarHBondContact O-N 3.23Å; N1483-K1485 VanDerWaalsContact C-N 3.29Å; N1483-K1485 PolarHBondContact O-N 3.23Å; K1485-Y1488 PolarHBondContact O-N 3.22Å; K1485-Q1489 WeakPolarHBondContact O-CB 3.47Å; K1485-Q1489 VanDerWaalsContact O-CG 3.29Å; K1485-Q1489 WeakPolarHBondContact O-CG 3.4Å; K1485-Q1489 PolarHBondContact O-N 3.03Å; K1485-Q1489 VanDerWaalsContact O-N 3.1Å
1486	I	77.5	Confident	71.4	Confident	17.4 Å²	17.4	56.7 Å²	56.7	9%	0.089	28%	0.281	C	S	.	.	H	α-helix	trans	-63.7	-47	178.1	-66.7	161.7	0	0	0	110.1	S1466 E1469 L1470 S1482 N1483 Y1488 Q1489 I1490	S1466-I1486 WeakPolarHBondContact O-CG2 3.43Å; E1469-I1486 HydrophobicContact CB-CD1 3.78Å; L1470-I1486 HydrophobicContact CD2-CB 4.13Å; L1470-I1486 HydrophobicContact CD2-CD1 4.35Å; L1470-I1486 HydrophobicContact CD2-CG2 3.98Å; L1470-I1486 HydrophobicContact CG-CG2 4.36Å; S1482-I1486 WeakPolarHBondContact O-CD1 3.39Å; S1482-I1486 WeakPolarHBondContact O-CG1 3.31Å; S1482-I1486 PolarHBondContact O-N 3.08Å; S1482-I1486 VanDerWaalsContact O-N 3.11Å; N1483-I1486 PolarHBondContact O-N 3.07Å; I1486-Y1488 VanDerWaalsContact C-N 3.33Å; I1486-Y1488 PolarHBondContact O-N 3.31Å; I1486-Q1489 WeakPolarHBondContact O-CB 3.47Å; I1486-Q1489 PolarHBondContact O-N 3.15Å; I1486-Q1489 VanDerWaalsContact O-N 3.16Å; I1486-I1490 HydrophobicContact CG2-CD1 3.66Å; I1486-I1490 HydrophobicContact CG2-CG1 4.35Å; I1486-I1490 WeakPolarHBondContact O-CB 3.39Å; I1486-I1490 VanDerWaalsContact O-CG1 3.26Å; I1486-I1490 WeakPolarHBondContact O-CG1 3.27Å; I1486-I1490 PolarHBondContact O-N 2.99Å
1487	I	75.9	Confident	70.3	Confident	0.4 Å²	0.4	61.9 Å²	61.9	0%	0.002	30%	0.3	C	S	.	.	H	α-helix	trans	-63.2	-40.6	179.8	-67.5	168.5	0	0	0	111.2	W1467 L1470 N1483 E1484 I1490 N1491 C1660 L1661 S1664 A1666 F1667	W1467-I1487 HydrophobicContact CZ3-CG1 4.36Å; L1470-I1487 HydrophobicContact CD2-CD1 4.27Å; L1470-I1487 HydrophobicContact CD2-CG1 4.02Å; N1483-I1487 WeakPolarHBondContact O-CB 3.34Å; N1483-I1487 VanDerWaalsContact O-CG1 3.26Å; N1483-I1487 WeakPolarHBondContact O-CG1 3.24Å; N1483-I1487 PolarHBondContact O-N 2.95Å; E1484-I1487 PolarHBondContact O-N 3.26Å; I1487-I1490 PolarHBondContact O-N 3.15Å; I1487-N1491 WeakPolarHBondContact O-CB 3.36Å; I1487-N1491 VanDerWaalsContact O-CG 3.31Å; I1487-N1491 PolarHBondContact O-N 3.1Å; I1487-C1660 HydrophobicContact CD1-CB 4.42Å; I1487-L1661 HydrophobicContact CD1-CD2 4.24Å; I1487-L1661 HydrophobicContact CG1-CD2 4.28Å; I1487-L1661 HydrophobicContact CG2-CD2 4.2Å; I1487-S1664 VanDerWaalsContact CD1-CB 3.46Å; I1487-S1664 WeakPolarHBondContact CD1-OG 3.33Å; I1487-A1666 HydrophobicContact CG2-CB 4.44Å; I1487-F1667 HydrophobicContact CG2-CB 4.13Å
1488	Y	73.4	Confident	68.8	Low	95.4 Å²	95.4	65.8 Å²	65.8	37%	0.374	32%	0.321	S	S	.	.	H	α-helix	trans	-62.8	-43.8	174.4	-139.3	-81.8	0	0	0	112.2	E1484 K1485 I1486 I1490 N1491 D1492 A1666 N1771	E1484-Y1488 VanDerWaalsContact O-CB 3.28Å; E1484-Y1488 WeakPolarHBondContact O-CB 3.33Å; E1484-Y1488 VanDerWaalsContact O-CD2 3.28Å; E1484-Y1488 WeakPolarHBondContact O-CD2 3.36Å; E1484-Y1488 PolarHBondContact O-N 3.03Å; K1485-Y1488 PolarHBondContact O-N 3.22Å; I1486-Y1488 VanDerWaalsContact C-N 3.33Å; I1486-Y1488 PolarHBondContact O-N 3.31Å; Y1488-I1490 VanDerWaalsContact C-N 3.34Å; Y1488-I1490 PolarHBondContact O-N 3.08Å; Y1488-N1491 PolarHBondContact O-N 3.08Å; Y1488-D1492 WeakPolarHBondContact O-CB 3.44Å; Y1488-D1492 PolarHBondContact O-N 3.11Å; Y1488-A1666 HydrophobicContact CD2-CB 4.05Å; Y1488-A1666 HydrophobicContact CE1-CB 4.28Å; Y1488-A1666 HydrophobicContact CE2-CB 3.28Å; Y1488-A1666 HydrophobicContact CG-CB 4.31Å; Y1488-N1771 PolarHBondContact OH-ND2 3.27Å
1489	Q	72.9	Confident	67.4	Low	104.2 Å²	104.2	67.9 Å²	67.9	49%	0.487	33%	0.325	S	S	.	.	H	α-helix	trans	-62.9	-41.8	176.5	-74.7	175	-14.8	0	0	112	K1485 I1486 D1492 Q1493	K1485-Q1489 WeakPolarHBondContact O-CB 3.47Å; K1485-Q1489 VanDerWaalsContact O-CG 3.29Å; K1485-Q1489 WeakPolarHBondContact O-CG 3.4Å; K1485-Q1489 PolarHBondContact O-N 3.03Å; K1485-Q1489 VanDerWaalsContact O-N 3.1Å; I1486-Q1489 WeakPolarHBondContact O-CB 3.47Å; I1486-Q1489 PolarHBondContact O-N 3.15Å; I1486-Q1489 VanDerWaalsContact O-N 3.16Å; Q1489-D1492 PolarHBondContact O-N 3.24Å; Q1489-Q1493 WeakPolarHBondContact O-CB 3.36Å; Q1489-Q1493 VanDerWaalsContact O-CG 3.28Å; Q1489-Q1493 WeakPolarHBondContact O-CG 3.25Å; Q1489-Q1493 PolarHBondContact O-N 3.13Å
1490	I	71.1	Confident	66	Low	7.8 Å²	7.8	70.4 Å²	70.4	4%	0.04	34%	0.343	C	S	.	.	H	α-helix	trans	-63.2	-46.1	175.9	-70.9	171	0	0	0	110.2	W1467 I1486 I1487 Y1488 D1492 Q1493 F1494	W1467-I1490 HydrophobicContact CD2-CD1 3.98Å; W1467-I1490 HydrophobicContact CE3-CD1 3.96Å; W1467-I1490 HydrophobicContact CG-CD1 4.42Å; W1467-I1490 HydrophobicContact CH2-CB 4.39Å; W1467-I1490 HydrophobicContact CH2-CD1 4.32Å; W1467-I1490 HydrophobicContact CH2-CG2 3.77Å; W1467-I1490 HydrophobicContact CZ2-CB 4.47Å; W1467-I1490 HydrophobicContact CZ2-CD1 4.32Å; W1467-I1490 HydrophobicContact CZ2-CG2 3.54Å; W1467-I1490 VanDerWaalsContact CZ2-CG2 3.41Å; W1467-I1490 HydrophobicContact CZ3-CD1 4.11Å; W1467-I1490 HydrophobicContact CZ3-CG2 4.35Å; I1486-I1490 HydrophobicContact CG2-CD1 3.66Å; I1486-I1490 HydrophobicContact CG2-CG1 4.35Å; I1486-I1490 WeakPolarHBondContact O-CB 3.39Å; I1486-I1490 VanDerWaalsContact O-CG1 3.26Å; I1486-I1490 WeakPolarHBondContact O-CG1 3.27Å; I1486-I1490 PolarHBondContact O-N 2.99Å; I1487-I1490 PolarHBondContact O-N 3.15Å; Y1488-I1490 VanDerWaalsContact C-N 3.34Å; Y1488-I1490 PolarHBondContact O-N 3.08Å; I1490-D1492 VanDerWaalsContact C-N 3.32Å; I1490-D1492 PolarHBondContact O-N 3.22Å; I1490-Q1493 WeakPolarHBondContact O-CB 3.48Å; I1490-Q1493 PolarHBondContact O-N 3.21Å; I1490-Q1493 VanDerWaalsContact O-N 3.14Å; I1490-F1494 HydrophobicContact CG2-CD2 3.64Å; I1490-F1494 HydrophobicContact CG2-CE2 3.25Å; I1490-F1494 VanDerWaalsContact CG2-CE2 3.42Å; I1490-F1494 HydrophobicContact CG2-CZ 4.15Å; I1490-F1494 VanDerWaalsContact O-CD2 3.26Å; I1490-F1494 WeakPolarHBondContact O-CD2 3.28Å; I1490-F1494 WeakPolarHBondContact O-CG 3.42Å; I1490-F1494 PolarHBondContact O-N 3.13Å
1491	N	68.5	Low	64.4	Low	10.8 Å²	10.8	76.1 Å²	76.1	6%	0.058	38%	0.378	C	S	.	.	H	α-helix	trans	-61.8	-38.8	176.2	-76.5	-11.5	0	0	0	112.8	I1487 Y1488 F1494 N1495 M1642	I1487-N1491 WeakPolarHBondContact O-CB 3.36Å; I1487-N1491 VanDerWaalsContact O-CG 3.31Å; I1487-N1491 PolarHBondContact O-N 3.1Å; Y1488-N1491 PolarHBondContact O-N 3.08Å; N1491-F1494 WeakPolarHBondContact O-CB 3.44Å; N1491-F1494 PolarHBondContact O-N 3.11Å; N1491-N1495 WeakPolarHBondContact O-CB 3.31Å; N1491-N1495 PolarHBondContact O-N 3.29Å; N1491-N1495 VanDerWaalsContact O-N 3.13Å; N1491-N1495 PolarHBondContact O-ND2 3.2Å; N1491-M1642 WeakPolarHBondContact OD1-CE 3.4Å
1492	D	66.4	Low	63	Low	81.8 Å²	81.8	78.6 Å²	78.6	44%	0.437	39%	0.392	S	S	.	.	H	α-helix	trans	-69.7	-36.9	176.5	-156.7	41.2	0	0	0	112	Y1488 Q1489 I1490 F1494 N1495 N1496	Y1488-D1492 WeakPolarHBondContact O-CB 3.44Å; Y1488-D1492 PolarHBondContact O-N 3.11Å; Q1489-D1492 PolarHBondContact O-N 3.24Å; I1490-D1492 VanDerWaalsContact C-N 3.32Å; I1490-D1492 PolarHBondContact O-N 3.22Å; D1492-F1494 VanDerWaalsContact C-N 3.28Å; D1492-F1494 PolarHBondContact O-N 3.2Å; D1492-N1495 PolarHBondContact O-N 3.09Å; D1492-N1496 VanDerWaalsContact CG-ND2 3.29Å; D1492-N1496 WeakPolarHBondContact O-CB 3.41Å; D1492-N1496 PolarHBondContact O-N 3.09Å; D1492-N1496 VanDerWaalsContact O-N 3.15Å; D1492-N1496 PolarHBondContact O-ND2 3.19Å; D1492-N1496 VanDerWaalsContact O-ND2 3.16Å; D1492-N1496 PolarHBondContact OD1-ND2 2.89Å; D1492-N1496 VanDerWaalsContact OD1-ND2 3.16Å; D1492-N1496 PolarHBondContact OD2-ND2 3.05Å; D1492-N1496 VanDerWaalsContact OD2-ND2 3.14Å
1493	Q	65.1	Low	61.5	Low	132.6 Å²	132.6	80.2 Å²	80.2	62%	0.62	40%	0.403	S	S	*	.	H	α-helix	trans	-63.6	-34.6	170.5	-73.3	178.4	15.7	0	0	112.3	Q1489 I1490	Q1489-Q1493 WeakPolarHBondContact O-CB 3.36Å; Q1489-Q1493 VanDerWaalsContact O-CG 3.28Å; Q1489-Q1493 WeakPolarHBondContact O-CG 3.25Å; Q1489-Q1493 PolarHBondContact O-N 3.13Å; I1490-Q1493 WeakPolarHBondContact O-CB 3.48Å; I1490-Q1493 PolarHBondContact O-N 3.21Å; I1490-Q1493 VanDerWaalsContact O-N 3.14Å
1494	F	61.5	Low	59.8	Low	54.4 Å²	54.4	90.4 Å²	90.4	24%	0.239	45%	0.447	C	S	.	.	H	α-helix	trans	-70.6	-34.6	174.7	-77.6	-60.8	0	0	0	113.1	W1467 I1490 N1491 D1492 S1637 M1642	W1467-F1494 HydrophobicContact CH2-CE2 4.43Å; W1467-F1494 AromaticContact CZ2-CE2 3.89Å; W1467-F1494 HydrophobicContact CZ2-CE2 4.01Å; W1467-F1494 HydrophobicContact CZ2-CZ 4.22Å; I1490-F1494 HydrophobicContact CG2-CD2 3.64Å; I1490-F1494 HydrophobicContact CG2-CE2 3.25Å; I1490-F1494 VanDerWaalsContact CG2-CE2 3.42Å; I1490-F1494 HydrophobicContact CG2-CZ 4.15Å; I1490-F1494 VanDerWaalsContact O-CD2 3.26Å; I1490-F1494 WeakPolarHBondContact O-CD2 3.28Å; I1490-F1494 WeakPolarHBondContact O-CG 3.42Å; I1490-F1494 PolarHBondContact O-N 3.13Å; N1491-F1494 WeakPolarHBondContact O-CB 3.44Å; N1491-F1494 PolarHBondContact O-N 3.11Å; D1492-F1494 VanDerWaalsContact C-N 3.28Å; D1492-F1494 PolarHBondContact O-N 3.2Å; F1494-S1637 WeakPolarHBondContact CZ-O 3.47Å; F1494-M1642 HydrophobicContact CD2-SD 4.31Å; F1494-M1642 HydrophobicContact CE2-SD 4.46Å; F1494-M1642 HydrophobicContact CG-SD 4.42Å
1495	N	56.3	Low	58.7	Low	96.2 Å²	96.2	92.7 Å²	92.7	51%	0.514	48%	0.475	S	S	.	.	H	α-helix	trans	-82.1	-33.2	-178.9	-76.8	-35.1	0	0	0	113.5	N1491 D1492 K1497 H1670	N1491-N1495 WeakPolarHBondContact O-CB 3.31Å; N1491-N1495 PolarHBondContact O-N 3.29Å; N1491-N1495 VanDerWaalsContact O-N 3.13Å; N1491-N1495 PolarHBondContact O-ND2 3.2Å; D1492-N1495 PolarHBondContact O-N 3.09Å; N1495-K1497 PolarHBondContact O-N 3.43Å; N1495-H1670 PolarHBondContact ND2-CE1 2.94Å; N1495-H1670 VanDerWaalsContact ND2-CE1 3.31Å; N1495-H1670 PolarHBondContact ND2-NE2 3.34Å
1496	N	51.3	Low	58	Low	84.2 Å²	84.2	90.5 Å²	90.5	45%	0.45	47%	0.467	S	S	.	.	S	Bend	trans	-73.2	113.4	177.1	-78.1	-41.2	0	0	0	110.4	D1492 N1498	D1492-N1496 VanDerWaalsContact CG-ND2 3.29Å; D1492-N1496 WeakPolarHBondContact O-CB 3.41Å; D1492-N1496 PolarHBondContact O-N 3.09Å; D1492-N1496 VanDerWaalsContact O-N 3.15Å; D1492-N1496 PolarHBondContact O-ND2 3.19Å; D1492-N1496 VanDerWaalsContact O-ND2 3.16Å; D1492-N1496 PolarHBondContact OD1-ND2 2.89Å; D1492-N1496 VanDerWaalsContact OD1-ND2 3.16Å; D1492-N1496 PolarHBondContact OD2-ND2 3.05Å; D1492-N1496 VanDerWaalsContact OD2-ND2 3.14Å; N1496-N1498 PolarHBondContact O-N 3.2Å
1497	K	47.4	Very low	57.5	Low	196.8 Å²	196.8	90.8 Å²	90.8	86%	0.856	47%	0.47	S	S	*	.			trans	-66.7	38.2	177.1	-70.5	-176.3	176.9	176.5	0	113.9	N1495 K1499	N1495-K1497 PolarHBondContact O-N 3.43Å; K1497-K1499 VanDerWaalsContact C-N 3.33Å; K1497-K1499 PolarHBondContact O-N 3.19Å
1498	N	42.6	Very low	57.4	Low	133.8 Å²	133.8	94.3 Å²	94.3	72%	0.716	49%	0.486	S	S	*	.			trans	-70.1	106.1	170.6	-69.3	-16.8	0	0	0	107.2	N1496 R1640	N1496-N1498 PolarHBondContact O-N 3.2Å; N1498-R1640 PolarHBondContact O-NH2 2.89Å
1499	K	44.1	Very low	57.5	Low	156.6 Å²	156.6	90.1 Å²	90.1	68%	0.681	47%	0.47	S	S	*	.			trans	-51.7	133.8	169.3	-79.4	-179.9	174.8	180	0	107.5	E1440 K1497 T1501	E1440-K1499 WeakPolarHBondContact OE1-CE 3.28Å; E1440-K1499 IonicContact OE1-NZ 2.71Å; E1440-K1499 PolarHBondContact OE1-NZ 3.35Å; E1440-K1499 IonicContact OE2-NZ 3.93Å; E1440-K1499 PolarHBondContact OE2-NZ 2.86Å; K1497-K1499 VanDerWaalsContact C-N 3.33Å; K1497-K1499 PolarHBondContact O-N 3.19Å; K1499-T1501 VanDerWaalsContact C-N 3.33Å; K1499-T1501 PolarHBondContact O-N 3.21Å; K1499-T1501 VanDerWaalsContact O-N 3.13Å
1500	P	45.2	Very low	57.6	Low	84.4 Å²	84.4	88.1 Å²	88.1	55%	0.548	47%	0.467	S	S	.	.			trans	-58.8	110.1	174.3	24.6	-31.4	0	0	0	107.7	L1502	P1500-L1502 VanDerWaalsContact C-N 3.31Å; P1500-L1502 PolarHBondContact O-N 3.24Å; P1500-L1502 VanDerWaalsContact O-N 3.12Å
1501	T	42.1	Very low	57.5	Low	128.8 Å²	128.8	90.4 Å²	90.4	79%	0.79	48%	0.483	S	S	*	.			trans	-75.3	103	170.5	46	0	0	0	0	106	K1499 S1503	K1499-T1501 VanDerWaalsContact C-N 3.33Å; K1499-T1501 PolarHBondContact O-N 3.21Å; K1499-T1501 VanDerWaalsContact O-N 3.13Å; T1501-S1503 PolarHBondContact O-N 3.22Å
1502	L	46.4	Very low	57.5	Low	91.4 Å²	91.4	93.3 Å²	93.3	48%	0.479	50%	0.498	S	S	.	.			trans	-54.8	114.7	172.2	-99.1	102.2	0	0	0	108.1	P1500 K1504 Q1506 H1508	P1500-L1502 VanDerWaalsContact C-N 3.31Å; P1500-L1502 PolarHBondContact O-N 3.24Å; P1500-L1502 VanDerWaalsContact O-N 3.12Å; L1502-K1504 PolarHBondContact O-N 3.23Å; L1502-Q1506 HydrophobicContact CD1-CB 4.5Å; L1502-Q1506 HydrophobicContact CD2-CB 4.12Å; L1502-H1508 HydrophobicContact CD2-CB 4.14Å
1503	S	47.2	Very low	57.7	Low	67 Å²	67	92.1 Å²	92.1	47%	0.469	49%	0.492	S	S	.	.			trans	-70.2	137.8	173.6	59.6	0	0	0	0	108.4	T1501 G1505 Q1506	T1501-S1503 PolarHBondContact O-N 3.22Å; S1503-G1505 PolarHBondContact O-N 3.29Å; S1503-G1505 VanDerWaalsContact O-N 3.11Å; S1503-Q1506 VanDerWaalsContact N-OE1 3.07Å; S1503-Q1506 PolarHBondContact O-N 3.13Å; S1503-Q1506 VanDerWaalsContact OG-CD 3.28Å; S1503-Q1506 WeakPolarHBondContact OG-CG 3.3Å; S1503-Q1506 PolarHBondContact OG-NE2 3.16Å; S1503-Q1506 VanDerWaalsContact OG-NE2 3.13Å; S1503-Q1506 PolarHBondContact OG-OE1 3.15Å
1504	K	45.7	Very low	58.3	Low	218.2 Å²	218.2	86 Å²	86	95%	0.949	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	110.7	179.8	-76.8	-178.6	176	178.3	0	109.7	L1502	L1502-K1504 PolarHBondContact O-N 3.23Å
1505	G	54.5	Low	58.8	Low	65.2 Å²	65.2	85.9 Å²	85.9	67%	0.672	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	121.9	-6.4	176.1	0	0	0	0	0	116.2	S1503	S1503-G1505 PolarHBondContact O-N 3.29Å; S1503-G1505 VanDerWaalsContact O-N 3.11Å
1506	Q	62.4	Low	59.7	Low	73.2 Å²	73.2	84.4 Å²	84.4	34%	0.342	45%	0.453	S	S	.	.			trans	-71	143.8	175.2	-75.8	174	-35.3	0	0	112.2	I1451 L1502 S1503 H1508	I1451-Q1506 HydrophobicContact CD1-CB 4.37Å; I1451-Q1506 HydrophobicContact CG1-CB 4.43Å; L1502-Q1506 HydrophobicContact CD1-CB 4.5Å; L1502-Q1506 HydrophobicContact CD2-CB 4.12Å; S1503-Q1506 VanDerWaalsContact N-OE1 3.07Å; S1503-Q1506 PolarHBondContact O-N 3.13Å; S1503-Q1506 VanDerWaalsContact OG-CD 3.28Å; S1503-Q1506 WeakPolarHBondContact OG-CG 3.3Å; S1503-Q1506 PolarHBondContact OG-NE2 3.16Å; S1503-Q1506 VanDerWaalsContact OG-NE2 3.13Å; S1503-Q1506 PolarHBondContact OG-OE1 3.15Å; Q1506-H1508 PolarHBondContact O-N 3.08Å
1507	P	68.5	Low	61	Low	22.6 Å²	22.6	80.4 Å²	80.4	15%	0.147	43%	0.431	C	S	.	.			trans	-64.2	131	173	28.1	-34.4	0	0	0	110.1	L1450 I1451 W1454 F1598	L1450-P1507 HydrophobicContact CB-CB 4.22Å; L1450-P1507 HydrophobicContact CB-CG 4.33Å; I1451-P1507 HydrophobicContact CB-CG 4.44Å; I1451-P1507 HydrophobicContact CG1-CG 3.85Å; W1454-P1507 HydrophobicContact CB-CG 3.98Å; W1454-P1507 HydrophobicContact CD2-CB 4Å; W1454-P1507 HydrophobicContact CD2-CG 4.32Å; W1454-P1507 HydrophobicContact CE3-CB 4.47Å; W1454-P1507 HydrophobicContact CG-CB 4.08Å; W1454-P1507 HydrophobicContact CG-CG 4.16Å; P1507-F1598 HydrophobicContact CB-CE1 4.23Å; P1507-F1598 HydrophobicContact CB-CE2 4.32Å; P1507-F1598 HydrophobicContact CB-CZ 4.16Å
1508	H	73.4	Confident	62.6	Low	74.8 Å²	74.8	71.1 Å²	71.1	35%	0.346	39%	0.391	S	S	.	.			trans	-138.3	134.5	-179	172.4	68.6	0	0	0	108.9	H1443 D1447 L1502 Q1506 P1510	H1443-H1508 AromaticContact CE1-CE1 3.32Å; H1443-H1508 PolarHBondContact CE1-CE1 3.11Å; H1443-H1508 VanDerWaalsContact CE1-CE1 3.47Å; H1443-H1508 AromaticContact CE1-NE2 3.75Å; H1443-H1508 AromaticContact NE2-CE1 3.15Å; H1443-H1508 PolarHBondContact NE2-CE1 3.26Å; H1443-H1508 AromaticContact NE2-ND1 3.71Å; H1443-H1508 AromaticContact NE2-NE2 3.79Å; D1447-H1508 VanDerWaalsContact CG-ND1 3.3Å; D1447-H1508 WeakPolarHBondContact OD1-CA 3.35Å; D1447-H1508 IonicContact OD1-CG 3.81Å; D1447-H1508 IonicContact OD1-ND1 3.34Å; D1447-H1508 PolarHBondContact OD1-ND1 3.1Å; D1447-H1508 IonicContact OD2-CE1 3.76Å; D1447-H1508 PolarHBondContact OD2-CE1 3.22Å; D1447-H1508 VanDerWaalsContact OD2-CE1 3.26Å; D1447-H1508 IonicContact OD2-CG 3Å; D1447-H1508 IonicContact OD2-ND1 3.45Å; D1447-H1508 PolarHBondContact OD2-ND1 3.02Å; L1502-H1508 HydrophobicContact CD2-CB 4.14Å; Q1506-H1508 PolarHBondContact O-N 3.08Å; H1508-P1510 VanDerWaalsContact O-CD 3.31Å; H1508-P1510 WeakPolarHBondContact O-CD 3.3Å
1509	L	76.1	Confident	64.2	Low	6.4 Å²	6.4	65.9 Å²	65.9	3%	0.034	37%	0.365	C	S	.	.			trans	-73.7	120.6	174	-174.8	70.8	0	0	0	109.2	L1422 H1443 I1446 D1447 L1450 S1511 L1513 L1514	L1422-L1509 HydrophobicContact CD1-CD1 4.03Å; L1422-L1509 HydrophobicContact CD1-CD2 4.34Å; L1422-L1509 HydrophobicContact CD2-CD1 4.18Å; H1443-L1509 PolarHBondContact CE1-O 3.13Å; H1443-L1509 VanDerWaalsContact CE1-O 3.24Å; H1443-L1509 PolarHBondContact NE2-O 3.07Å; I1446-L1509 HydrophobicContact CD1-CD2 4.45Å; I1446-L1509 HydrophobicContact CG2-CB 4.48Å; I1446-L1509 HydrophobicContact CG2-CD2 3.94Å; D1447-L1509 WeakPolarHBondContact OD1-CB 3.19Å; D1447-L1509 PolarHBondContact OD1-N 3.11Å; L1450-L1509 HydrophobicContact CD1-CB 4.02Å; L1509-S1511 PolarHBondContact O-N 3.01Å; L1509-L1513 HydrophobicContact CD1-CB 4.21Å; L1509-L1513 HydrophobicContact CD1-CD2 3.6Å; L1509-L1513 HydrophobicContact CD1-CG 4Å; L1509-L1514 HydrophobicContact CD2-CB 3.86Å; L1509-L1514 HydrophobicContact CD2-CD1 4.07Å; L1509-L1514 HydrophobicContact CD2-CG 4.49Å; L1509-L1514 HydrophobicContact CG-CB 4.43Å
1510	P	73.8	Confident	65.7	Low	63.4 Å²	63.4	58.9 Å²	58.9	41%	0.412	34%	0.336	S	S	.	.			trans	-59.6	136.4	175.9	-24.2	34.9	0	0	0	111.6	D1001 H1508 L1512 L1513 L1514	D1001-P1510 WeakPolarHBondContact OD2-CB 3.11Å; H1508-P1510 VanDerWaalsContact O-CD 3.31Å; H1508-P1510 WeakPolarHBondContact O-CD 3.3Å; P1510-L1512 VanDerWaalsContact C-N 3.29Å; P1510-L1512 PolarHBondContact O-N 3.16Å; P1510-L1513 HydrophobicContact CB-CB 4.41Å; P1510-L1513 WeakPolarHBondContact O-CA 3.39Å; P1510-L1513 WeakPolarHBondContact O-CB 3.33Å; P1510-L1513 PolarHBondContact O-N 3.17Å; P1510-L1514 PolarHBondContact O-N 3.1Å; P1510-L1514 VanDerWaalsContact O-N 3.1Å
1511	S	69.9	Low	67.6	Low	55.4 Å²	55.4	54.9 Å²	54.9	39%	0.387	31%	0.31	S	S	.	.	H	α-helix	trans	-57.1	-31.1	-176.9	-49.9	0	0	0	0	113.8	L1509 L1513 L1514 Y1515	L1509-S1511 PolarHBondContact O-N 3.01Å; S1511-L1513 VanDerWaalsContact C-N 3.34Å; S1511-L1513 PolarHBondContact O-N 2.9Å; S1511-L1514 PolarHBondContact O-N 3.2Å; S1511-Y1515 WeakPolarHBondContact O-CB 3.46Å; S1511-Y1515 PolarHBondContact O-N 3.18Å
1512	L	67.3	Low	69.4	Low	72 Å²	72	49.8 Å²	49.8	38%	0.377	28%	0.278	S	S	.	.	H	α-helix	trans	-64.3	-40.6	174	178.1	64	0	0	0	111.6	L804 L809 L1000 D1001 P1510 L1514 Y1515 I1516 W1559	L804-L1512 HydrophobicContact CD1-CD1 4.43Å; L804-L1512 HydrophobicContact CD2-CD2 4.23Å; L809-L1512 HydrophobicContact CD2-CD1 4.34Å; L1000-L1512 WeakPolarHBondContact O-CD2 3.33Å; D1001-L1512 HydrophobicContact CB-CB 4.19Å; D1001-L1512 HydrophobicContact CB-CD2 4.28Å; D1001-L1512 VanDerWaalsContact OD1-CB 3.3Å; D1001-L1512 WeakPolarHBondContact OD1-CB 3.29Å; D1001-L1512 WeakPolarHBondContact OD1-CD2 3.38Å; D1001-L1512 WeakPolarHBondContact OD1-CG 3.29Å; P1510-L1512 VanDerWaalsContact C-N 3.29Å; P1510-L1512 PolarHBondContact O-N 3.16Å; L1512-L1514 VanDerWaalsContact C-N 3.3Å; L1512-L1514 PolarHBondContact O-N 3.09Å; L1512-Y1515 HydrophobicContact CD1-CD1 4.35Å; L1512-Y1515 CarbonylContact O-C 3.45Å; L1512-Y1515 WeakPolarHBondContact O-CA 3.41Å; L1512-Y1515 WeakPolarHBondContact O-CB 3.36Å; L1512-Y1515 PolarHBondContact O-N 3.26Å; L1512-I1516 HydrophobicContact CD1-CD1 4.09Å; L1512-I1516 HydrophobicContact CD1-CG1 3.95Å; L1512-I1516 HydrophobicContact CD2-CD1 4.07Å; L1512-I1516 HydrophobicContact CG-CD1 4.04Å; L1512-I1516 HydrophobicContact CG-CG1 4.13Å; L1512-I1516 WeakPolarHBondContact O-CD1 3.26Å; L1512-I1516 VanDerWaalsContact O-CG1 3.29Å; L1512-I1516 WeakPolarHBondContact O-CG1 3.37Å; L1512-I1516 PolarHBondContact O-N 3.1Å; L1512-W1559 HydrophobicContact CB-CH2 4.46Å; L1512-W1559 HydrophobicContact CB-CZ2 4.03Å; L1512-W1559 HydrophobicContact CD1-CD2 4.48Å; L1512-W1559 HydrophobicContact CD1-CE3 4.02Å; L1512-W1559 HydrophobicContact CD1-CH2 3.26Å; L1512-W1559 HydrophobicContact CD1-CZ2 3.65Å; L1512-W1559 VanDerWaalsContact CD1-CZ2 3.43Å; L1512-W1559 HydrophobicContact CD1-CZ3 3.62Å; L1512-W1559 VanDerWaalsContact CD1-CZ3 3.43Å; L1512-W1559 HydrophobicContact CD2-CH2 4.44Å; L1512-W1559 HydrophobicContact CG-CH2 4.32Å; L1512-W1559 HydrophobicContact CG-CZ2 4.3Å
1513	L	71.3	Confident	70.9	Confident	57 Å²	57	45.7 Å²	45.7	30%	0.298	26%	0.256	S	S	.	.	H	α-helix	trans	-68.2	-39.3	179.6	-171.4	58.6	0	0	0	111.1	L1422 L1509 P1510 S1511 Y1515 I1516 L1517 Y1596	L1422-L1513 HydrophobicContact CD2-CD2 4.39Å; L1422-L1513 HydrophobicContact CD2-CG 4.32Å; L1509-L1513 HydrophobicContact CD1-CB 4.21Å; L1509-L1513 HydrophobicContact CD1-CD2 3.6Å; L1509-L1513 HydrophobicContact CD1-CG 4Å; P1510-L1513 HydrophobicContact CB-CB 4.41Å; P1510-L1513 WeakPolarHBondContact O-CA 3.39Å; P1510-L1513 WeakPolarHBondContact O-CB 3.33Å; P1510-L1513 PolarHBondContact O-N 3.17Å; S1511-L1513 VanDerWaalsContact C-N 3.34Å; S1511-L1513 PolarHBondContact O-N 2.9Å; L1513-Y1515 VanDerWaalsContact C-N 3.31Å; L1513-Y1515 PolarHBondContact O-N 3.22Å; L1513-I1516 HydrophobicContact CD1-CD1 4.47Å; L1513-I1516 PolarHBondContact O-N 3.12Å; L1513-L1517 WeakPolarHBondContact O-CB 3.45Å; L1513-L1517 PolarHBondContact O-N 3.14Å; L1513-Y1596 HydrophobicContact CD2-CD2 4.36Å; L1513-Y1596 HydrophobicContact CD2-CE2 3.41Å; L1513-Y1596 VanDerWaalsContact CD2-CE2 3.41Å
1514	L	76.6	Confident	72.7	Confident	4.2 Å²	4.2	42.5 Å²	42.5	2%	0.022	23%	0.234	C	C	.	.	H	α-helix	trans	-60	-43.1	170	-178	63.5	0	0	0	111.5	H1443 I1446 L1509 P1510 S1511 L1512 I1516 L1517 L1518 L1561	H1443-L1514 HydrophobicContact CB-CD2 3.61Å; H1443-L1514 VanDerWaalsContact CG-CD2 3.49Å; I1446-L1514 HydrophobicContact CD1-CD1 3.88Å; L1509-L1514 HydrophobicContact CD2-CB 3.86Å; L1509-L1514 HydrophobicContact CD2-CD1 4.07Å; L1509-L1514 HydrophobicContact CD2-CG 4.49Å; L1509-L1514 HydrophobicContact CG-CB 4.43Å; P1510-L1514 PolarHBondContact O-N 3.1Å; P1510-L1514 VanDerWaalsContact O-N 3.1Å; S1511-L1514 PolarHBondContact O-N 3.2Å; L1512-L1514 VanDerWaalsContact C-N 3.3Å; L1512-L1514 PolarHBondContact O-N 3.09Å; L1514-I1516 PolarHBondContact O-N 3.28Å; L1514-L1517 HydrophobicContact CD1-CD2 4.38Å; L1514-L1517 WeakPolarHBondContact O-CB 3.38Å; L1514-L1517 PolarHBondContact O-N 3.25Å; L1514-L1518 HydrophobicContact CD1-CD1 4.2Å; L1514-L1518 HydrophobicContact CD1-CG 4.22Å; L1514-L1518 HydrophobicContact CG-CD1 4.02Å; L1514-L1518 HydrophobicContact CG-CG 4.41Å; L1514-L1518 WeakPolarHBondContact O-CB 3.31Å; L1514-L1518 WeakPolarHBondContact O-CG 3.2Å; L1514-L1518 PolarHBondContact O-N 3.13Å; L1514-L1561 HydrophobicContact CD2-CD1 4.03Å; L1514-L1561 HydrophobicContact CD2-CD2 4.47Å
1515	Y	73.5	Confident	74.3	Confident	52.4 Å²	52.4	32.5 Å²	32.5	21%	0.205	19%	0.191	C	C	.	.	H	α-helix	trans	-62.6	-42.7	177	-177.5	-95.3	0	0	0	112.4	I808 A812 S1511 L1512 L1513 L1517 L1518 T1519 F1528 N1529 W1559 L1561	I808-Y1515 HydrophobicContact CG2-CD1 3.79Å; I808-Y1515 HydrophobicContact CG2-CE1 3.39Å; A812-Y1515 WeakPolarHBondContact CB-OH 3.43Å; S1511-Y1515 WeakPolarHBondContact O-CB 3.46Å; S1511-Y1515 PolarHBondContact O-N 3.18Å; L1512-Y1515 HydrophobicContact CD1-CD1 4.35Å; L1512-Y1515 CarbonylContact O-C 3.45Å; L1512-Y1515 WeakPolarHBondContact O-CA 3.41Å; L1512-Y1515 WeakPolarHBondContact O-CB 3.36Å; L1512-Y1515 PolarHBondContact O-N 3.26Å; L1513-Y1515 VanDerWaalsContact C-N 3.31Å; L1513-Y1515 PolarHBondContact O-N 3.22Å; Y1515-L1517 VanDerWaalsContact C-N 3.33Å; Y1515-L1517 PolarHBondContact O-N 2.85Å; Y1515-L1518 PolarHBondContact O-N 3.09Å; Y1515-T1519 VanDerWaalsContact CE1-OG1 3.31Å; Y1515-T1519 WeakPolarHBondContact CE1-OG1 3.4Å; Y1515-T1519 VanDerWaalsContact O-CB 3.28Å; Y1515-T1519 WeakPolarHBondContact O-CB 3.34Å; Y1515-T1519 PolarHBondContact O-N 2.99Å; Y1515-T1519 PolarHBondContact O-OG1 3.31Å; Y1515-F1528 HydrophobicContact CD2-CE2 4.31Å; Y1515-F1528 AromaticContact CD2-CZ 3.7Å; Y1515-F1528 HydrophobicContact CD2-CZ 3.76Å; Y1515-F1528 HydrophobicContact CE2-CE1 4.32Å; Y1515-F1528 HydrophobicContact CE2-CE2 4.42Å; Y1515-F1528 AromaticContact CE2-CZ 3.7Å; Y1515-F1528 HydrophobicContact CE2-CZ 3.77Å; Y1515-F1528 HydrophobicContact CG-CZ 4.37Å; Y1515-N1529 WeakPolarHBondContact CE2-ND2 3.26Å; Y1515-N1529 WeakPolarHBondContact CE2-OD1 3.3Å; Y1515-N1529 PolarHBondContact OH-ND2 3.25Å; Y1515-N1529 VanDerWaalsContact OH-ND2 3.09Å; Y1515-W1559 AromaticContact CD1-CE3 3.73Å; Y1515-W1559 HydrophobicContact CD1-CE3 3.73Å; Y1515-W1559 HydrophobicContact CD1-CH2 4.22Å; Y1515-W1559 AromaticContact CD1-CZ3 3.33Å; Y1515-W1559 HydrophobicContact CD1-CZ3 3.72Å; Y1515-W1559 HydrophobicContact CD2-CB 4.01Å; Y1515-W1559 AromaticContact CD2-CE3 3.51Å; Y1515-W1559 HydrophobicContact CD2-CE3 3.99Å; Y1515-W1559 AromaticContact CD2-CZ3 3.89Å; Y1515-W1559 HydrophobicContact CD2-CZ3 3.89Å; Y1515-W1559 VanDerWaalsContact CD2-O 3.23Å; Y1515-W1559 WeakPolarHBondContact CD2-O 3.26Å; Y1515-W1559 HydrophobicContact CE1-CE3 4.19Å; Y1515-W1559 AromaticContact CE1-CZ3 3.65Å; Y1515-W1559 HydrophobicContact CE1-CZ3 4.07Å; Y1515-W1559 HydrophobicContact CE2-CE3 4.02Å; Y1515-W1559 HydrophobicContact CE2-CZ3 4.16Å; Y1515-W1559 WeakPolarHBondContact CE2-O 3.44Å; Y1515-W1559 HydrophobicContact CG-CB 4.29Å; Y1515-W1559 HydrophobicContact CG-CD2 4.45Å; Y1515-W1559 AromaticContact CG-CE3 3.64Å; Y1515-W1559 HydrophobicContact CG-CE3 3.64Å; Y1515-W1559 AromaticContact CG-CZ3 3.47Å; Y1515-W1559 HydrophobicContact CG-CZ3 3.47Å; Y1515-W1559 VanDerWaalsContact CG-CZ3 3.47Å; Y1515-L1561 HydrophobicContact CD2-CD2 4.07Å; Y1515-L1561 HydrophobicContact CD2-CG 4.18Å
1516	I	73.6	Confident	75	Confident	63.8 Å²	63.8	30.1 Å²	30.1	33%	0.327	16%	0.163	S	C	.	.	H	α-helix	trans	-61	-45.1	175.2	-68.9	165.9	0	0	0	110.2	L804 I808 L1512 L1513 L1514 T1519 G1520	L804-I1516 HydrophobicContact CD1-CD1 3.82Å; L804-I1516 HydrophobicContact CD1-CG1 4.18Å; I808-I1516 HydrophobicContact CD1-CB 4.32Å; I808-I1516 HydrophobicContact CD1-CG1 3.92Å; I808-I1516 HydrophobicContact CD1-CG2 4.01Å; L1512-I1516 HydrophobicContact CD1-CD1 4.09Å; L1512-I1516 HydrophobicContact CD1-CG1 3.95Å; L1512-I1516 HydrophobicContact CD2-CD1 4.07Å; L1512-I1516 HydrophobicContact CG-CD1 4.04Å; L1512-I1516 HydrophobicContact CG-CG1 4.13Å; L1512-I1516 WeakPolarHBondContact O-CD1 3.26Å; L1512-I1516 VanDerWaalsContact O-CG1 3.29Å; L1512-I1516 WeakPolarHBondContact O-CG1 3.37Å; L1512-I1516 PolarHBondContact O-N 3.1Å; L1513-I1516 HydrophobicContact CD1-CD1 4.47Å; L1513-I1516 PolarHBondContact O-N 3.12Å; L1514-I1516 PolarHBondContact O-N 3.28Å; I1516-T1519 PolarHBondContact O-N 2.91Å; I1516-G1520 PolarHBondContact O-N 3.03Å
1517	L	79.7	Confident	75	Confident	0.4 Å²	0.4	27.3 Å²	27.3	0%	0.002	16%	0.155	C	C	.	.	H	α-helix	trans	-60.2	-51.5	177.7	-179.5	70.9	0	0	0	111.8	V1414 C1418 L1422 T1426 L1513 L1514 Y1515 T1519 G1520 L1521	V1414-L1517 HydrophobicContact CG1-CD1 3.6Å; C1418-L1517 HydrophobicContact CB-CD1 3.66Å; L1422-L1517 HydrophobicContact CD1-CD2 4.47Å; L1422-L1517 HydrophobicContact CD2-CB 4.43Å; L1422-L1517 HydrophobicContact CD2-CD1 3.92Å; L1422-L1517 VanDerWaalsContact CD2-CD1 3.43Å; L1422-L1517 HydrophobicContact CD2-CD2 3.96Å; L1422-L1517 HydrophobicContact CD2-CG 4Å; L1422-L1517 HydrophobicContact CG-CD2 4Å; T1426-L1517 HydrophobicContact CG2-CD2 3.87Å; T1426-L1517 VanDerWaalsContact OG1-CD2 3.26Å; T1426-L1517 WeakPolarHBondContact OG1-CD2 3.37Å; L1513-L1517 WeakPolarHBondContact O-CB 3.45Å; L1513-L1517 PolarHBondContact O-N 3.14Å; L1514-L1517 HydrophobicContact CD1-CD2 4.38Å; L1514-L1517 WeakPolarHBondContact O-CB 3.38Å; L1514-L1517 PolarHBondContact O-N 3.25Å; Y1515-L1517 VanDerWaalsContact C-N 3.33Å; Y1515-L1517 PolarHBondContact O-N 2.85Å; L1517-T1519 VanDerWaalsContact C-N 3.32Å; L1517-T1519 PolarHBondContact O-N 3.34Å; L1517-G1520 WeakPolarHBondContact O-CA 3.23Å; L1517-G1520 PolarHBondContact O-N 3.09Å; L1517-G1520 VanDerWaalsContact O-N 3.07Å; L1517-L1521 HydrophobicContact CD1-CD1 4.36Å; L1517-L1521 HydrophobicContact CG-CD1 4.29Å; L1517-L1521 WeakPolarHBondContact O-CG 3.42Å; L1517-L1521 PolarHBondContact O-N 3.21Å
1518	L	80.1	Confident	74.7	Confident	1.2 Å²	1.2	26.7 Å²	26.7	1%	0.006	15%	0.15	C	C	.	.	H	α-helix	trans	-65.4	-35	179.4	-68.7	176.8	0	0	0	112.1	T1426 T1439 L1442 L1514 Y1515 G1520 L1521 H1522 L1525 F1528 L1561 L1566	T1426-L1518 HydrophobicContact CG2-CD2 4.43Å; T1439-L1518 HydrophobicContact CG2-CD1 4.4Å; L1442-L1518 HydrophobicContact CD2-CD2 3.98Å; L1514-L1518 HydrophobicContact CD1-CD1 4.2Å; L1514-L1518 HydrophobicContact CD1-CG 4.22Å; L1514-L1518 HydrophobicContact CG-CD1 4.02Å; L1514-L1518 HydrophobicContact CG-CG 4.41Å; L1514-L1518 WeakPolarHBondContact O-CB 3.31Å; L1514-L1518 WeakPolarHBondContact O-CG 3.2Å; L1514-L1518 PolarHBondContact O-N 3.13Å; Y1515-L1518 PolarHBondContact O-N 3.09Å; L1518-G1520 VanDerWaalsContact C-N 3.3Å; L1518-G1520 PolarHBondContact O-N 3.42Å; L1518-L1521 CarbonylContact O-C 3.5Å; L1518-L1521 PolarHBondContact O-N 3.07Å; L1518-L1521 VanDerWaalsContact O-N 3.16Å; L1518-H1522 WeakPolarHBondContact O-CA 3.46Å; L1518-H1522 PolarHBondContact O-N 3.33Å; L1518-L1525 HydrophobicContact CD2-CD1 3.9Å; L1518-F1528 VanDerWaalsContact C-CE1 3.44Å; L1518-F1528 HydrophobicContact CB-CD1 4.19Å; L1518-F1528 HydrophobicContact CB-CD2 4.01Å; L1518-F1528 HydrophobicContact CB-CE1 3.76Å; L1518-F1528 HydrophobicContact CB-CE2 3.54Å; L1518-F1528 VanDerWaalsContact CB-CE2 3.44Å; L1518-F1528 HydrophobicContact CB-CG 4.32Å; L1518-F1528 HydrophobicContact CB-CZ 3.41Å; L1518-F1528 VanDerWaalsContact CB-CZ 3.46Å; L1518-F1528 HydrophobicContact CD1-CD2 3.96Å; L1518-F1528 HydrophobicContact CD1-CE2 3.58Å; L1518-F1528 VanDerWaalsContact CD1-CE2 3.49Å; L1518-F1528 HydrophobicContact CD1-CZ 4.28Å; L1518-F1528 HydrophobicContact CG-CD2 4.48Å; L1518-F1528 HydrophobicContact CG-CE2 4.21Å; L1518-F1528 HydrophobicContact CG-CZ 4.43Å; L1518-L1561 HydrophobicContact CD1-CD2 4.09Å; L1518-L1566 HydrophobicContact CD1-CD1 4.34Å; L1518-L1566 HydrophobicContact CD2-CD1 4.11Å
1519	T	76	Confident	73.8	Confident	26.4 Å²	26.4	25.4 Å²	25.4	16%	0.162	15%	0.145	C	C	.	.	H	α-helix	trans	-65.9	-38.9	173	-58	0	0	0	0	111.3	I808 L1385 Y1515 I1516 L1517 L1521 H1522	I808-T1519 HydrophobicContact CG1-CG2 4.24Å; I808-T1519 HydrophobicContact CG2-CG2 4.3Å; L1385-T1519 HydrophobicContact CD2-CG2 4.02Å; Y1515-T1519 VanDerWaalsContact CE1-OG1 3.31Å; Y1515-T1519 WeakPolarHBondContact CE1-OG1 3.4Å; Y1515-T1519 VanDerWaalsContact O-CB 3.28Å; Y1515-T1519 WeakPolarHBondContact O-CB 3.34Å; Y1515-T1519 PolarHBondContact O-N 2.99Å; Y1515-T1519 PolarHBondContact O-OG1 3.31Å; I1516-T1519 PolarHBondContact O-N 2.91Å; L1517-T1519 VanDerWaalsContact C-N 3.32Å; L1517-T1519 PolarHBondContact O-N 3.34Å; T1519-L1521 VanDerWaalsContact C-N 3.33Å; T1519-L1521 PolarHBondContact O-N 2.8Å; T1519-H1522 VanDerWaalsContact O-CB 3.26Å; T1519-H1522 WeakPolarHBondContact O-CB 3.26Å; T1519-H1522 PolarHBondContact O-N 3.23Å
1520	G	77.5	Confident	72.5	Confident	8.6 Å²	8.6	27.8 Å²	27.8	9%	0.089	16%	0.158	C	C	.	.	H	α-helix	trans	-63.5	-38.9	172.7	0	0	0	0	0	112.9	R1413 V1414 I1516 L1517 L1518 H1522 P1523	R1413-G1520 PolarHBondContact NH1-O 3.16Å; R1413-G1520 PolarHBondContact NH2-O 3.16Å; V1414-G1520 VanDerWaalsContact CG2-C 3.45Å; V1414-G1520 WeakPolarHBondContact CG2-O 3.22Å; I1516-G1520 PolarHBondContact O-N 3.03Å; L1517-G1520 WeakPolarHBondContact O-CA 3.23Å; L1517-G1520 PolarHBondContact O-N 3.09Å; L1517-G1520 VanDerWaalsContact O-N 3.07Å; L1518-G1520 VanDerWaalsContact C-N 3.3Å; L1518-G1520 PolarHBondContact O-N 3.42Å; G1520-H1522 VanDerWaalsContact C-N 3.35Å; G1520-P1523 WeakPolarHBondContact O-CD 3.19Å
1521	L	85.1	Confident	71.1	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-85	-8.2	179	-67.9	176	0	0	0	114.2	V1414 T1423 T1426 L1427 L1517 L1518 T1519 P1523 L1524 L1525	V1414-L1521 HydrophobicContact CB-CD2 4.11Å; V1414-L1521 HydrophobicContact CG1-CD2 4.05Å; V1414-L1521 HydrophobicContact CG1-CG 4.08Å; V1414-L1521 HydrophobicContact CG2-CD2 3.93Å; V1414-L1521 HydrophobicContact CG2-CG 4.33Å; T1423-L1521 HydrophobicContact CG2-CD2 4.36Å; T1426-L1521 HydrophobicContact CG2-CD1 4.15Å; L1427-L1521 HydrophobicContact CD1-CD2 4.21Å; L1427-L1521 HydrophobicContact CD2-CD1 3.93Å; L1427-L1521 HydrophobicContact CD2-CD2 3.98Å; L1427-L1521 HydrophobicContact CD2-CG 4.49Å; L1427-L1521 HydrophobicContact CG-CD1 4.17Å; L1427-L1521 HydrophobicContact CG-CD2 4.3Å; L1517-L1521 HydrophobicContact CD1-CD1 4.36Å; L1517-L1521 HydrophobicContact CG-CD1 4.29Å; L1517-L1521 WeakPolarHBondContact O-CG 3.42Å; L1517-L1521 PolarHBondContact O-N 3.21Å; L1518-L1521 CarbonylContact O-C 3.5Å; L1518-L1521 PolarHBondContact O-N 3.07Å; L1518-L1521 VanDerWaalsContact O-N 3.16Å; T1519-L1521 VanDerWaalsContact C-N 3.33Å; T1519-L1521 PolarHBondContact O-N 2.8Å; L1521-P1523 VanDerWaalsContact C-N 3.28Å; L1521-P1523 WeakPolarHBondContact O-CD 3.3Å; L1521-P1523 VanDerWaalsContact O-N 3.09Å; L1521-L1524 HydrophobicContact CD2-CD1 4.4Å; L1521-L1524 WeakPolarHBondContact O-CA 3.23Å; L1521-L1524 WeakPolarHBondContact O-CB 3.36Å; L1521-L1524 PolarHBondContact O-N 3.1Å; L1521-L1525 HydrophobicContact CB-CD1 3.78Å; L1521-L1525 HydrophobicContact CB-CG 4.2Å; L1521-L1525 WeakPolarHBondContact O-CG 3.35Å; L1521-L1525 PolarHBondContact O-N 3.24Å
1522	H	79.3	Confident	69.7	Low	22.6 Å²	22.6	36.2 Å²	36.2	11%	0.105	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-45.4	-40.7	-177.2	177.8	-56.6	0	0	0	114.4	R1384 L1518 T1519 G1520 L1524 L1525 F1528	R1384-H1522 PolarHBondContact NH2-CE1 2.97Å; R1384-H1522 PolarHBondContact NH2-ND1 3.05Å; R1384-H1522 PolarHBondContact NH2-NE2 3.12Å; L1518-H1522 WeakPolarHBondContact O-CA 3.46Å; L1518-H1522 PolarHBondContact O-N 3.33Å; T1519-H1522 VanDerWaalsContact O-CB 3.26Å; T1519-H1522 WeakPolarHBondContact O-CB 3.26Å; T1519-H1522 PolarHBondContact O-N 3.23Å; G1520-H1522 VanDerWaalsContact C-N 3.35Å; H1522-L1524 PolarHBondContact O-N 2.92Å; H1522-L1524 VanDerWaalsContact O-N 3.12Å; H1522-L1525 PolarHBondContact O-N 2.89Å; H1522-L1525 VanDerWaalsContact O-N 3.14Å; H1522-L1525 VanDerWaalsContact O-O 3.1Å; H1522-F1528 HydrophobicContact CB-CD1 4.31Å; H1522-F1528 AromaticContact CD2-CD1 3.82Å; H1522-F1528 PolarHBondContact CD2-O 3.03Å; H1522-F1528 VanDerWaalsContact CD2-O 3.29Å; H1522-F1528 PolarHBondContact NE2-O 3.33Å
1523	P	78.4	Confident	68.3	Low	4.4 Å²	4.4	35.8 Å²	35.8	3%	0.029	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-57	-30.1	177.6	-25	35.1	0	0	0	113.5	L1378 D1381 L1385 V1410 G1520 L1521 S1569	L1378-P1523 HydrophobicContact CD2-CB 4.17Å; L1378-P1523 WeakPolarHBondContact CD2-O 3.36Å; D1381-P1523 HydrophobicContact CB-CB 4.1Å; D1381-P1523 HydrophobicContact CB-CG 4.1Å; L1385-P1523 HydrophobicContact CD1-CG 3.86Å; V1410-P1523 HydrophobicContact CG1-CB 4.5Å; V1410-P1523 HydrophobicContact CG1-CG 4.44Å; G1520-P1523 WeakPolarHBondContact O-CD 3.19Å; L1521-P1523 VanDerWaalsContact C-N 3.28Å; L1521-P1523 WeakPolarHBondContact O-CD 3.3Å; L1521-P1523 VanDerWaalsContact O-N 3.09Å; P1523-S1569 PolarHBondContact O-OG 3.4Å
1524	L	84.3	Confident	66.7	Low	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-90.3	-20	-178.3	-52.7	-176.4	0	0	0	113.1	L1378 V1407 V1410 V1411 L1521 H1522 F1568 S1569 I1573 V1577	L1378-L1524 HydrophobicContact CD2-CD2 4.15Å; V1407-L1524 HydrophobicContact CB-CD2 4.41Å; V1407-L1524 HydrophobicContact CG1-CD1 4.33Å; V1407-L1524 HydrophobicContact CG1-CD2 4.11Å; V1407-L1524 HydrophobicContact CG2-CD2 3.99Å; V1410-L1524 HydrophobicContact CB-CD1 4.38Å; V1410-L1524 HydrophobicContact CB-CD2 4.33Å; V1410-L1524 HydrophobicContact CB-CG 4.47Å; V1410-L1524 HydrophobicContact CG1-CD1 3.86Å; V1410-L1524 HydrophobicContact CG1-CD2 4.1Å; V1410-L1524 HydrophobicContact CG1-CG 3.79Å; V1410-L1524 HydrophobicContact CG2-CD2 4.41Å; V1411-L1524 HydrophobicContact CG2-CD1 3.92Å; L1521-L1524 HydrophobicContact CD2-CD1 4.4Å; L1521-L1524 WeakPolarHBondContact O-CA 3.23Å; L1521-L1524 WeakPolarHBondContact O-CB 3.36Å; L1521-L1524 PolarHBondContact O-N 3.1Å; H1522-L1524 PolarHBondContact O-N 2.92Å; H1522-L1524 VanDerWaalsContact O-N 3.12Å; L1524-F1568 HydrophobicContact CB-CD1 4.42Å; L1524-F1568 CarbonylContact O-C 3.51Å; L1524-F1568 WeakPolarHBondContact O-CA 3.35Å; L1524-F1568 WeakPolarHBondContact O-CD1 3.45Å; L1524-S1569 PolarHBondContact O-N 3.28Å; L1524-S1569 PolarHBondContact O-OG 3.21Å; L1524-I1573 HydrophobicContact CB-CG2 3.9Å; L1524-I1573 HydrophobicContact CD2-CG2 3.86Å; L1524-I1573 HydrophobicContact CG-CG2 4.34Å; L1524-V1577 HydrophobicContact CD1-CG2 4.28Å
1525	L	79	Confident	64.8	Low	8.2 Å²	8.2	44.2 Å²	44.2	4%	0.043	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	159.5	-171.1	-58.9	179.4	0	0	0	112.2	L1430 L1518 L1521 H1522 S1567 F1568	L1430-L1525 HydrophobicContact CD1-CD1 4.38Å; L1430-L1525 HydrophobicContact CD1-CD2 3.8Å; L1518-L1525 HydrophobicContact CD2-CD1 3.9Å; L1521-L1525 HydrophobicContact CB-CD1 3.78Å; L1521-L1525 HydrophobicContact CB-CG 4.2Å; L1521-L1525 WeakPolarHBondContact O-CG 3.35Å; L1521-L1525 PolarHBondContact O-N 3.24Å; H1522-L1525 PolarHBondContact O-N 2.89Å; H1522-L1525 VanDerWaalsContact O-N 3.14Å; H1522-L1525 VanDerWaalsContact O-O 3.1Å; L1525-S1567 CarbonylContact C-O 3.53Å; L1525-S1567 VanDerWaalsContact CA-O 3.28Å; L1525-S1567 WeakPolarHBondContact CA-O 3.36Å; L1525-F1568 HydrophobicContact CD2-CD1 3.97Å; L1525-F1568 HydrophobicContact CD2-CE1 3.94Å
1526	S	69.7	Low	63	Low	14.2 Å²	14.2	47.8 Å²	47.8	10%	0.099	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	151.3	171.9	52.6	0	0	0	0	109.9	S1197 F1528 D1530 S1567 F1568	S1197-S1526 WeakPolarHBondContact CA-OG 3.37Å; S1197-S1526 VanDerWaalsContact CB-CB 3.43Å; S1197-S1526 VanDerWaalsContact CB-OG 3.31Å; S1197-S1526 WeakPolarHBondContact CB-OG 3.4Å; S1197-S1526 WeakPolarHBondContact O-CB 3.49Å; S1197-S1526 PolarHBondContact O-OG 3.08Å; S1197-S1526 PolarHBondContact OG-OG 3.16Å; S1526-F1528 PolarHBondContact O-N 3.22Å; S1526-D1530 VanDerWaalsContact CA-OD2 3.27Å; S1526-D1530 WeakPolarHBondContact CA-OD2 2.97Å; S1526-S1567 PolarHBondContact N-O 2.99Å; S1526-S1567 PolarHBondContact O-N 3Å; S1526-S1567 VanDerWaalsContact O-N 3.11Å; S1526-S1567 PolarHBondContact O-OG 2.81Å; S1526-S1567 PolarHBondContact OG-O 2.92Å; S1526-S1567 VanDerWaalsContact OG-O 3.13Å; S1526-S1567 PolarHBondContact OG-OG 3.14Å; S1526-F1568 PolarHBondContact OG-O 3.22Å
1527	G	62.8	Low	61.1	Low	16.2 Å²	16.2	52.9 Å²	52.9	17%	0.167	27%	0.274	C	S	.	.	S	Bend	trans	85.9	-3.5	-173.9	0	0	0	0	0	114.4	D1530 R1564	G1527-D1530 PolarHBondContact N-OD2 3.17Å; G1527-R1564 WeakPolarHBondContact O-CB 3.45Å; G1527-R1564 WeakPolarHBondContact O-CD 3.47Å
1528	F	61.8	Low	59.1	Low	9.8 Å²	9.8	58.8 Å²	58.8	4%	0.043	31%	0.305	C	S	.	.	S	Bend	trans	-101.2	120.6	173.3	-171.7	-107	0	0	0	110.3	T1439 Y1515 L1518 H1522 S1526 D1530 L1561 L1566	T1439-F1528 HydrophobicContact CG2-CD2 4.35Å; T1439-F1528 HydrophobicContact CG2-CE2 4.46Å; Y1515-F1528 HydrophobicContact CD2-CE2 4.31Å; Y1515-F1528 AromaticContact CD2-CZ 3.7Å; Y1515-F1528 HydrophobicContact CD2-CZ 3.76Å; Y1515-F1528 HydrophobicContact CE2-CE1 4.32Å; Y1515-F1528 HydrophobicContact CE2-CE2 4.42Å; Y1515-F1528 AromaticContact CE2-CZ 3.7Å; Y1515-F1528 HydrophobicContact CE2-CZ 3.77Å; Y1515-F1528 HydrophobicContact CG-CZ 4.37Å; L1518-F1528 VanDerWaalsContact C-CE1 3.44Å; L1518-F1528 HydrophobicContact CB-CD1 4.19Å; L1518-F1528 HydrophobicContact CB-CD2 4.01Å; L1518-F1528 HydrophobicContact CB-CE1 3.76Å; L1518-F1528 HydrophobicContact CB-CE2 3.54Å; L1518-F1528 VanDerWaalsContact CB-CE2 3.44Å; L1518-F1528 HydrophobicContact CB-CG 4.32Å; L1518-F1528 HydrophobicContact CB-CZ 3.41Å; L1518-F1528 VanDerWaalsContact CB-CZ 3.46Å; L1518-F1528 HydrophobicContact CD1-CD2 3.96Å; L1518-F1528 HydrophobicContact CD1-CE2 3.58Å; L1518-F1528 VanDerWaalsContact CD1-CE2 3.49Å; L1518-F1528 HydrophobicContact CD1-CZ 4.28Å; L1518-F1528 HydrophobicContact CG-CD2 4.48Å; L1518-F1528 HydrophobicContact CG-CE2 4.21Å; L1518-F1528 HydrophobicContact CG-CZ 4.43Å; H1522-F1528 HydrophobicContact CB-CD1 4.31Å; H1522-F1528 AromaticContact CD2-CD1 3.82Å; H1522-F1528 PolarHBondContact CD2-O 3.03Å; H1522-F1528 VanDerWaalsContact CD2-O 3.29Å; H1522-F1528 PolarHBondContact NE2-O 3.33Å; S1526-F1528 PolarHBondContact O-N 3.22Å; F1528-D1530 VanDerWaalsContact C-N 3.3Å; F1528-D1530 PolarHBondContact O-N 3.1Å; F1528-D1530 VanDerWaalsContact O-N 3.1Å; F1528-L1561 HydrophobicContact CE2-CD2 3.66Å; F1528-L1561 HydrophobicContact CZ-CD2 4.35Å; F1528-L1566 HydrophobicContact CB-CD2 3.71Å; F1528-L1566 HydrophobicContact CD2-CD2 4.15Å; F1528-L1566 HydrophobicContact CG-CD2 4.31Å
1529	N	53.9	Low	56.9	Low	45.8 Å²	45.8	65.7 Å²	65.7	25%	0.245	34%	0.342	C	S	.	.	S	Bend	trans	58.7	22.7	-179.6	-67.1	-16.6	0	0	0	116.7	R815 Y1515 E1531	R815-N1529 PolarHBondContact NE-O 2.81Å; R815-N1529 VanDerWaalsContact NE-O 3.17Å; Y1515-N1529 WeakPolarHBondContact CE2-ND2 3.26Å; Y1515-N1529 WeakPolarHBondContact CE2-OD1 3.3Å; Y1515-N1529 PolarHBondContact OH-ND2 3.25Å; Y1515-N1529 VanDerWaalsContact OH-ND2 3.09Å; N1529-E1531 VanDerWaalsContact C-N 3.33Å; N1529-E1531 VanDerWaalsContact O-CG 3.23Å; N1529-E1531 WeakPolarHBondContact O-CG 3Å; N1529-E1531 PolarHBondContact O-N 2.99Å
1530	D	49.3	Very low	54.9	Low	57.8 Å²	57.8	73.6 Å²	73.6	31%	0.309	38%	0.377	S	S	.	.			trans	-74	116.7	169.4	-77.9	-42.8	0	0	0	110	R815 I1198 S1526 G1527 F1528 R1532 R1564	R815-D1530 IonicContact CZ-OD1 3.75Å; R815-D1530 IonicContact NH2-OD1 2.85Å; R815-D1530 PolarHBondContact NH2-OD1 3.18Å; I1198-D1530 WeakPolarHBondContact CD1-OD2 3.41Å; I1198-D1530 WeakPolarHBondContact CG1-OD2 3.4Å; I1198-D1530 VanDerWaalsContact O-CG 3.29Å; S1526-D1530 VanDerWaalsContact CA-OD2 3.27Å; S1526-D1530 WeakPolarHBondContact CA-OD2 2.97Å; G1527-D1530 PolarHBondContact N-OD2 3.17Å; F1528-D1530 VanDerWaalsContact C-N 3.3Å; F1528-D1530 PolarHBondContact O-N 3.1Å; F1528-D1530 VanDerWaalsContact O-N 3.1Å; D1530-R1532 PolarHBondContact O-N 3.13Å; D1530-R1564 PolarHBondContact O-NH1 3.46Å
1531	E	44.7	Very low	52.9	Low	108.8 Å²	108.8	81.9 Å²	81.9	51%	0.508	41%	0.413	S	S	.	.			trans	-73.2	101.1	-160.2	-64.3	178.2	162.5	0	0	113.7	N816 L819 N1529 A1533	N816-E1531 WeakPolarHBondContact CA-OE2 3.39Å; N816-E1531 WeakPolarHBondContact CB-OE1 3.46Å; N816-E1531 WeakPolarHBondContact CB-OE2 3.31Å; N816-E1531 PolarHBondContact ND2-OE1 3.15Å; N816-E1531 VanDerWaalsContact OD1-CD 3.27Å; N816-E1531 PolarHBondContact OD1-OE1 3.22Å; L819-E1531 HydrophobicContact CD1-CG 3.62Å; L819-E1531 WeakPolarHBondContact CD1-OE1 3.19Å; L819-E1531 VanDerWaalsContact CD2-OE1 3.25Å; L819-E1531 WeakPolarHBondContact CD2-OE1 3.5Å; L819-E1531 WeakPolarHBondContact CD2-OE2 3.48Å; N1529-E1531 VanDerWaalsContact C-N 3.33Å; N1529-E1531 VanDerWaalsContact O-CG 3.23Å; N1529-E1531 WeakPolarHBondContact O-CG 3Å; N1529-E1531 PolarHBondContact O-N 2.99Å; E1531-A1533 PolarHBondContact O-N 3.2Å
1532	R	39.8	Very low	50.4	Low	187.4 Å²	187.4	89.2 Å²	89.2	71%	0.707	45%	0.451	S	S	*	.			trans	-59.6	64.9	158.9	-74.1	-178.8	-176.8	-179.4	1.5	112.2	E1051 D1530 D1534 I1535 R1564	E1051-R1532 IonicContact OE1-CZ 3.71Å; E1051-R1532 IonicContact OE1-NH1 2.82Å; E1051-R1532 IonicContact OE1-NH2 3.99Å; E1051-R1532 PolarHBondContact OE1-NH2 3.44Å; D1530-R1532 PolarHBondContact O-N 3.13Å; R1532-D1534 PolarHBondContact O-N 3.31Å; R1532-I1535 PolarHBondContact O-N 3.26Å; R1532-R1564 PolarHBondContact O-NH2 3.33Å
1533	A	37	Very low	48.4	Very low	63.2 Å²	63.2	93.6 Å²	93.6	52%	0.522	48%	0.482	S	S	.	.			trans	-92.7	13.6	170.6	0	0	0	0	0	111.2	E1531 I1535	E1531-A1533 PolarHBondContact O-N 3.2Å; A1533-I1535 VanDerWaalsContact C-N 3.29Å; A1533-I1535 PolarHBondContact O-N 3.34Å
1534	D	37.9	Very low	46.2	Very low	115 Å²	115	103.1 Å²	103.1	62%	0.615	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	45.8	176.4	-58.4	-24.4	0	0	0	114.8	R1532 D1536 I1538 N1560 R1564	R1532-D1534 PolarHBondContact O-N 3.31Å; D1534-D1536 HydrophobicContact CB-CB 4.5Å; D1534-D1536 PolarHBondContact O-N 3.32Å; D1534-I1538 WeakPolarHBondContact O-CD1 3.49Å; D1534-I1538 WeakPolarHBondContact O-CG1 3.38Å; D1534-N1560 PolarHBondContact OD2-ND2 3.37Å; D1534-R1564 IonicContact OD2-NH2 2.76Å
1535	I	38.4	Very low	44	Very low	122.4 Å²	122.4	109.5 Å²	109.5	63%	0.628	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	9.7	171.9	-58	168.6	0	0	0	112.3	R1532 A1533 E1537	R1532-I1535 PolarHBondContact O-N 3.26Å; A1533-I1535 VanDerWaalsContact C-N 3.29Å; A1533-I1535 PolarHBondContact O-N 3.34Å; I1535-E1537 VanDerWaalsContact C-N 3.28Å; I1535-E1537 PolarHBondContact O-N 3.2Å
1536	D	33.9	Very low	42.1	Very low	127.6 Å²	127.6	115.6 Å²	115.6	68%	0.682	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	21.1	177.3	-72.4	-19.9	0	0	0	111.7	D1534	D1534-D1536 HydrophobicContact CB-CB 4.5Å; D1534-D1536 PolarHBondContact O-N 3.32Å
1537	E	35.7	Very low	40.7	Very low	170 Å²	170	118.7 Å²	118.7	79%	0.794	61%	0.612	S	S	*	*			trans	-123.5	31.8	173.7	-88.7	-178.2	-170.1	0	0	112.8	I1535 D1539	I1535-E1537 VanDerWaalsContact C-N 3.28Å; I1535-E1537 PolarHBondContact O-N 3.2Å; E1537-D1539 VanDerWaalsContact C-N 3.32Å; E1537-D1539 PolarHBondContact O-N 3.45Å
1538	I	35.8	Very low	39.3	Very low	126.2 Å²	126.2	123 Å²	123	65%	0.647	63%	0.628	S	S	*	*	S	Bend	trans	-106.8	56.4	163.7	-59.8	177.3	0	0	0	108.8	D1534 E1540 L1542	D1534-I1538 WeakPolarHBondContact O-CD1 3.49Å; D1534-I1538 WeakPolarHBondContact O-CG1 3.38Å; I1538-E1540 VanDerWaalsContact C-N 3.34Å; I1538-E1540 HydrophobicContact CG2-CG 4.42Å; I1538-E1540 PolarHBondContact O-N 2.94Å; I1538-L1542 HydrophobicContact CG2-CD1 4.03Å
1539	D	33.9	Very low	38.2	Very low	145.6 Å²	145.6	128.8 Å²	128.8	78%	0.779	66%	0.656	S	S	*	*			trans	-81.2	56.9	171.3	-75.4	-18.7	0	0	0	113.8	E1537 E1541	E1537-D1539 VanDerWaalsContact C-N 3.32Å; E1537-D1539 PolarHBondContact O-N 3.45Å; D1539-E1541 PolarHBondContact O-N 3.08Å
1540	E	35.6	Very low	37.5	Very low	192.2 Å²	192.2	130.5 Å²	130.5	90%	0.898	67%	0.668	S	S	*	*			trans	-99.1	33.8	164.8	-82.2	-162.1	166.9	0	0	113.4	I1538	I1538-E1540 VanDerWaalsContact C-N 3.34Å; I1538-E1540 HydrophobicContact CG2-CG 4.42Å; I1538-E1540 PolarHBondContact O-N 2.94Å
1541	E	34.5	Very low	37	Very low	182.8 Å²	182.8	131.6 Å²	131.6	85%	0.854	67%	0.673	S	S	*	*			trans	-112.1	61	172.5	-72	-168	161.2	0	0	112.6	D1539	D1539-E1541 PolarHBondContact O-N 3.08Å
1542	L	32.7	Very low	36.6	Very low	153 Å²	153	132.6 Å²	132.6	80%	0.801	68%	0.676	S	S	*	*	S	Bend	trans	-147.1	134.6	163.8	-77.1	162.8	0	0	0	113.6	I1538	I1538-L1542 HydrophobicContact CG2-CD1 4.03Å
1543	P	36.5	Very low	36.4	Very low	116 Å²	116	130.1 Å²	130.1	75%	0.753	67%	0.672	S	S	*	*			trans	-77.8	148.7	-166.4	9.5	-0.2	0	0	0	113.5	D1545	P1543-D1545 VanDerWaalsContact C-N 3.32Å; P1543-D1545 PolarHBondContact O-N 3.11Å; P1543-D1545 VanDerWaalsContact O-N 3.09Å
1544	F	34.1	Very low	36.4	Very low	203 Å²	203	133.2 Å²	133.2	89%	0.89	68%	0.676	S	S	*	*			trans	-76.5	106.6	179.4	-85.9	-96.3	0	0	0	113.5	D1546	F1544-D1546 PolarHBondContact O-N 3.26Å; F1544-D1546 VanDerWaalsContact O-N 3.08Å
1545	D	36.8	Very low	36.2	Very low	134.6 Å²	134.6	133.2 Å²	133.2	72%	0.72	67%	0.67	S	S	*	*			trans	-118.4	119	171.1	-114.3	-16.1	0	0	0	111	P1543 S1547 M1548	P1543-D1545 VanDerWaalsContact C-N 3.32Å; P1543-D1545 PolarHBondContact O-N 3.11Å; P1543-D1545 VanDerWaalsContact O-N 3.09Å; D1545-S1547 VanDerWaalsContact C-N 3.27Å; D1545-S1547 PolarHBondContact O-N 3.24Å; D1545-M1548 PolarHBondContact O-N 3.01Å
1546	D	38.8	Very low	36.1	Very low	135.4 Å²	135.4	131.8 Å²	131.8	72%	0.724	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	25.2	-176.9	-91.2	-23.7	0	0	0	115.2	F1544 M1548 Q1549 T1550	F1544-D1546 PolarHBondContact O-N 3.26Å; F1544-D1546 VanDerWaalsContact O-N 3.08Å; D1546-M1548 VanDerWaalsContact C-N 3.31Å; D1546-M1548 PolarHBondContact O-N 3.24Å; D1546-Q1549 PolarHBondContact O-N 3.49Å; D1546-T1550 PolarHBondContact O-N 3.13Å; D1546-T1550 PolarHBondContact O-OG1 2.91Å
1547	S	40.3	Very low	36.2	Very low	79.4 Å²	79.4	129.6 Å²	129.6	56%	0.555	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	7.6	169.7	57.1	0	0	0	0	115	D1545 Q1549 T1550 I1551	D1545-S1547 VanDerWaalsContact C-N 3.27Å; D1545-S1547 PolarHBondContact O-N 3.24Å; S1547-Q1549 PolarHBondContact O-N 3.06Å; S1547-T1550 PolarHBondContact O-N 2.96Å; S1547-T1550 PolarHBondContact O-OG1 3.01Å; S1547-T1550 WeakPolarHBondContact OG-CG2 3.27Å; S1547-T1550 PolarHBondContact OG-OG1 3.47Å; S1547-I1551 WeakPolarHBondContact O-CD1 3.34Å; S1547-I1551 WeakPolarHBondContact O-CG1 3.43Å
1548	M	34.9	Very low	36.4	Very low	106 Å²	106	126.2 Å²	126.2	52%	0.522	64%	0.641	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.7	-8.3	-179.4	-104.4	-141.3	81	0	0	114.9	D1545 D1546 T1550 I1551 K1552	D1545-M1548 PolarHBondContact O-N 3.01Å; D1546-M1548 VanDerWaalsContact C-N 3.31Å; D1546-M1548 PolarHBondContact O-N 3.24Å; M1548-T1550 VanDerWaalsContact C-N 3.33Å; M1548-T1550 PolarHBondContact O-N 2.92Å; M1548-I1551 HydrophobicContact CE-CB 3.96Å; M1548-I1551 HydrophobicContact CE-CD1 3.69Å; M1548-I1551 HydrophobicContact CE-CG1 3.62Å; M1548-I1551 HydrophobicContact CE-CG2 4.01Å; M1548-I1551 PolarHBondContact O-N 3.2Å; M1548-I1551 HydrophobicContact SD-CB 3.89Å; M1548-I1551 HydrophobicContact SD-CD1 3.75Å; M1548-I1551 HydrophobicContact SD-CG1 4Å; M1548-I1551 HydrophobicContact SD-CG2 4.37Å; M1548-K1552 WeakPolarHBondContact O-CB 3.29Å; M1548-K1552 WeakPolarHBondContact O-CG 3.23Å; M1548-K1552 PolarHBondContact O-N 3.21Å; M1548-K1552 VanDerWaalsContact O-N 3.14Å
1549	Q	37.7	Very low	36.5	Very low	133 Å²	133	125 Å²	125	62%	0.621	63%	0.629	S	S	*	*	H	α-helix	trans	-76.1	-35.2	179.6	-75.6	-171	4.4	0	0	112.8	D1546 S1547 K1552 Q1553	D1546-Q1549 PolarHBondContact O-N 3.49Å; S1547-Q1549 PolarHBondContact O-N 3.06Å; Q1549-K1552 PolarHBondContact O-N 3.06Å; Q1549-Q1553 WeakPolarHBondContact O-CB 3.28Å; Q1549-Q1553 WeakPolarHBondContact O-CG 3.28Å; Q1549-Q1553 PolarHBondContact O-N 3.14Å; Q1549-Q1553 VanDerWaalsContact O-N 3.15Å
1550	T	38.7	Very low	36.8	Very low	80.4 Å²	80.4	121.8 Å²	121.8	49%	0.493	61%	0.612	S	S	.	*	H	α-helix	trans	-66.9	-40	174	42.2	0	0	0	0	111.6	D1546 S1547 M1548 K1552 Q1553 E1554	D1546-T1550 PolarHBondContact O-N 3.13Å; D1546-T1550 PolarHBondContact O-OG1 2.91Å; S1547-T1550 PolarHBondContact O-N 2.96Å; S1547-T1550 PolarHBondContact O-OG1 3.01Å; S1547-T1550 WeakPolarHBondContact OG-CG2 3.27Å; S1547-T1550 PolarHBondContact OG-OG1 3.47Å; M1548-T1550 VanDerWaalsContact C-N 3.33Å; M1548-T1550 PolarHBondContact O-N 2.92Å; T1550-K1552 VanDerWaalsContact C-N 3.34Å; T1550-K1552 PolarHBondContact O-N 3.27Å; T1550-K1552 VanDerWaalsContact O-N 3.09Å; T1550-Q1553 CarbonylContact O-C 3.59Å; T1550-Q1553 WeakPolarHBondContact O-CA 3.22Å; T1550-Q1553 PolarHBondContact O-N 3.25Å; T1550-E1554 WeakPolarHBondContact O-CB 3.25Å; T1550-E1554 WeakPolarHBondContact O-CG 3.17Å; T1550-E1554 PolarHBondContact O-N 3.11Å
1551	I	38.3	Very low	37.1	Very low	81 Å²	81	114.7 Å²	114.7	42%	0.415	58%	0.579	S	S	.	*	H	α-helix	trans	-69.8	-32.2	178.1	-60	178.8	0	0	0	112.1	S1547 M1548 Q1553 E1554 K1555	S1547-I1551 WeakPolarHBondContact O-CD1 3.34Å; S1547-I1551 WeakPolarHBondContact O-CG1 3.43Å; M1548-I1551 HydrophobicContact CE-CB 3.96Å; M1548-I1551 HydrophobicContact CE-CD1 3.69Å; M1548-I1551 HydrophobicContact CE-CG1 3.62Å; M1548-I1551 HydrophobicContact CE-CG2 4.01Å; M1548-I1551 PolarHBondContact O-N 3.2Å; M1548-I1551 HydrophobicContact SD-CB 3.89Å; M1548-I1551 HydrophobicContact SD-CD1 3.75Å; M1548-I1551 HydrophobicContact SD-CG1 4Å; M1548-I1551 HydrophobicContact SD-CG2 4.37Å; I1551-Q1553 PolarHBondContact O-N 3.37Å; I1551-E1554 PolarHBondContact O-N 2.86Å; I1551-K1555 HydrophobicContact CG2-CD 4.24Å; I1551-K1555 HydrophobicContact CG2-CG 4.38Å; I1551-K1555 VanDerWaalsContact O-CB 3.32Å; I1551-K1555 WeakPolarHBondContact O-CB 3.35Å; I1551-K1555 VanDerWaalsContact O-CG 3.25Å; I1551-K1555 WeakPolarHBondContact O-CG 3.32Å; I1551-K1555 PolarHBondContact O-N 3.21Å; I1551-K1555 VanDerWaalsContact O-N 3.12Å
1552	K	37.8	Very low	37.4	Very low	130.6 Å²	130.6	107.6 Å²	107.6	57%	0.568	56%	0.555	S	S	*	*	H	α-helix	trans	-71	-36	173.5	-84.7	-174.9	175.3	-177.5	0	112.3	M1548 Q1549 T1550 K1555 L1556	M1548-K1552 WeakPolarHBondContact O-CB 3.29Å; M1548-K1552 WeakPolarHBondContact O-CG 3.23Å; M1548-K1552 PolarHBondContact O-N 3.21Å; M1548-K1552 VanDerWaalsContact O-N 3.14Å; Q1549-K1552 PolarHBondContact O-N 3.06Å; T1550-K1552 VanDerWaalsContact C-N 3.34Å; T1550-K1552 PolarHBondContact O-N 3.27Å; T1550-K1552 VanDerWaalsContact O-N 3.09Å; K1552-K1555 PolarHBondContact O-N 2.76Å; K1552-L1556 VanDerWaalsContact O-CB 3.25Å; K1552-L1556 WeakPolarHBondContact O-CB 3.44Å; K1552-L1556 WeakPolarHBondContact O-CD1 3.44Å; K1552-L1556 WeakPolarHBondContact O-CG 3.36Å; K1552-L1556 PolarHBondContact O-N 2.85Å; K1552-L1556 VanDerWaalsContact O-N 3.16Å
1553	Q	34.8	Very low	38	Very low	134 Å²	134	104.9 Å²	104.9	63%	0.626	55%	0.549	S	S	*	.	H	α-helix	trans	-69.7	-38.7	174.9	-76.3	-179.9	-20.4	0	0	112	Q1549 T1550 I1551 L1556 T1557	Q1549-Q1553 WeakPolarHBondContact O-CB 3.28Å; Q1549-Q1553 WeakPolarHBondContact O-CG 3.28Å; Q1549-Q1553 PolarHBondContact O-N 3.14Å; Q1549-Q1553 VanDerWaalsContact O-N 3.15Å; T1550-Q1553 CarbonylContact O-C 3.59Å; T1550-Q1553 WeakPolarHBondContact O-CA 3.22Å; T1550-Q1553 PolarHBondContact O-N 3.25Å; I1551-Q1553 PolarHBondContact O-N 3.37Å; Q1553-L1556 WeakPolarHBondContact O-CA 3.44Å; Q1553-L1556 WeakPolarHBondContact O-CB 3.32Å; Q1553-L1556 PolarHBondContact O-N 3.29Å; Q1553-L1556 VanDerWaalsContact O-N 3.08Å; Q1553-T1557 VanDerWaalsContact O-CB 3.32Å; Q1553-T1557 WeakPolarHBondContact O-CB 3.37Å; Q1553-T1557 WeakPolarHBondContact O-CG2 3.32Å; Q1553-T1557 PolarHBondContact O-N 3.15Å; Q1553-T1557 PolarHBondContact O-OG1 3.3Å
1554	E	36.7	Very low	39	Very low	128.6 Å²	128.6	105.1 Å²	105.1	60%	0.601	54%	0.535	S	S	*	.	H	α-helix	trans	-70.7	-32.5	177.5	-73.9	-179.3	166.6	0	0	112.9	T1550 I1551 L1556 T1557 I1558	T1550-E1554 WeakPolarHBondContact O-CB 3.25Å; T1550-E1554 WeakPolarHBondContact O-CG 3.17Å; T1550-E1554 PolarHBondContact O-N 3.11Å; I1551-E1554 PolarHBondContact O-N 2.86Å; E1554-L1556 VanDerWaalsContact C-N 3.29Å; E1554-L1556 PolarHBondContact O-N 2.97Å; E1554-T1557 VanDerWaalsContact C-OG1 3.23Å; E1554-T1557 VanDerWaalsContact CA-OG1 3.25Å; E1554-T1557 WeakPolarHBondContact CA-OG1 3.41Å; E1554-T1557 PolarHBondContact O-N 3.23Å; E1554-T1557 PolarHBondContact O-OG1 3.06Å; E1554-I1558 WeakPolarHBondContact O-CB 3.4Å; E1554-I1558 VanDerWaalsContact O-CD1 3.25Å; E1554-I1558 WeakPolarHBondContact O-CD1 3.41Å; E1554-I1558 WeakPolarHBondContact O-CG1 3.36Å; E1554-I1558 PolarHBondContact O-N 3.21Å; E1554-I1558 VanDerWaalsContact O-N 3.14Å
1555	K	34.9	Very low	40.4	Very low	115.8 Å²	115.8	97.1 Å²	97.1	50%	0.503	51%	0.506	S	S	.	.	H	α-helix	trans	-74.2	-24.9	174.4	-81.3	-178	175.5	-173.2	0	113.9	E1440 I1551 K1552 T1557 I1558 W1559 N1560	E1440-K1555 IonicContact OE1-NZ 3.57Å; I1551-K1555 HydrophobicContact CG2-CD 4.24Å; I1551-K1555 HydrophobicContact CG2-CG 4.38Å; I1551-K1555 VanDerWaalsContact O-CB 3.32Å; I1551-K1555 WeakPolarHBondContact O-CB 3.35Å; I1551-K1555 VanDerWaalsContact O-CG 3.25Å; I1551-K1555 WeakPolarHBondContact O-CG 3.32Å; I1551-K1555 PolarHBondContact O-N 3.21Å; I1551-K1555 VanDerWaalsContact O-N 3.12Å; K1552-K1555 PolarHBondContact O-N 2.76Å; K1555-T1557 VanDerWaalsContact C-N 3.35Å; K1555-T1557 PolarHBondContact O-N 3.02Å; K1555-I1558 HydrophobicContact CG-CD1 4.23Å; K1555-I1558 PolarHBondContact O-N 3.43Å; K1555-W1559 PolarHBondContact O-N 2.68Å; K1555-N1560 PolarHBondContact O-OD1 3.4Å
1556	L	34.7	Very low	42.2	Very low	92.6 Å²	92.6	90.8 Å²	90.8	49%	0.485	47%	0.473	S	S	.	.	H	α-helix	trans	-75.2	-20.5	169.7	-83.7	156.5	0	0	0	111.5	K1552 Q1553 E1554 I1558 W1559 N1560 L1561	K1552-L1556 VanDerWaalsContact O-CB 3.25Å; K1552-L1556 WeakPolarHBondContact O-CB 3.44Å; K1552-L1556 WeakPolarHBondContact O-CD1 3.44Å; K1552-L1556 WeakPolarHBondContact O-CG 3.36Å; K1552-L1556 PolarHBondContact O-N 2.85Å; K1552-L1556 VanDerWaalsContact O-N 3.16Å; Q1553-L1556 WeakPolarHBondContact O-CA 3.44Å; Q1553-L1556 WeakPolarHBondContact O-CB 3.32Å; Q1553-L1556 PolarHBondContact O-N 3.29Å; Q1553-L1556 VanDerWaalsContact O-N 3.08Å; E1554-L1556 VanDerWaalsContact C-N 3.29Å; E1554-L1556 PolarHBondContact O-N 2.97Å; L1556-I1558 PolarHBondContact O-N 3.01Å; L1556-W1559 CarbonylContact O-C 3.51Å; L1556-W1559 PolarHBondContact O-N 3.01Å; L1556-N1560 WeakPolarHBondContact O-CA 3.13Å; L1556-N1560 WeakPolarHBondContact O-CB 2.91Å; L1556-N1560 PolarHBondContact O-N 3.27Å; L1556-N1560 VanDerWaalsContact O-N 3.15Å; L1556-N1560 PolarHBondContact O-OD1 2.99Å; L1556-L1561 HydrophobicContact CB-CB 4.34Å; L1556-L1561 HydrophobicContact CD2-CB 3.76Å; L1556-L1561 HydrophobicContact CD2-CD1 3.76Å; L1556-L1561 HydrophobicContact CD2-CG 4.4Å; L1556-L1561 WeakPolarHBondContact O-CA 3.12Å; L1556-L1561 WeakPolarHBondContact O-CB 3.24Å; L1556-L1561 PolarHBondContact O-N 3.27Å
1557	T	36.9	Very low	43.9	Very low	81.6 Å²	81.6	86.2 Å²	86.2	50%	0.501	45%	0.451	S	S	.	.	H	α-helix	trans	-66.2	-19.4	174.1	53.8	0	0	0	0	112.5	Q1553 E1554 K1555 W1559 N1560	Q1553-T1557 VanDerWaalsContact O-CB 3.32Å; Q1553-T1557 WeakPolarHBondContact O-CB 3.37Å; Q1553-T1557 WeakPolarHBondContact O-CG2 3.32Å; Q1553-T1557 PolarHBondContact O-N 3.15Å; Q1553-T1557 PolarHBondContact O-OG1 3.3Å; E1554-T1557 VanDerWaalsContact C-OG1 3.23Å; E1554-T1557 VanDerWaalsContact CA-OG1 3.25Å; E1554-T1557 WeakPolarHBondContact CA-OG1 3.41Å; E1554-T1557 PolarHBondContact O-N 3.23Å; E1554-T1557 PolarHBondContact O-OG1 3.06Å; K1555-T1557 VanDerWaalsContact C-N 3.35Å; K1555-T1557 PolarHBondContact O-N 3.02Å; T1557-W1559 VanDerWaalsContact C-N 3.29Å; T1557-W1559 CarbonylContact O-C 3.58Å; T1557-W1559 PolarHBondContact O-N 3.09Å; T1557-N1560 PolarHBondContact O-N 3.34Å; T1557-N1560 PolarHBondContact O-OD1 3Å
1558	I	39.4	Very low	45.8	Very low	98.6 Å²	98.6	83.4 Å²	83.4	51%	0.506	43%	0.429	S	S	.	.	H	α-helix	trans	-63	-28	177.9	-63.9	164.4	0	0	0	111.7	L1008 A1009 E1554 K1555 L1556 N1560	L1008-I1558 HydrophobicContact CB-CG2 3.64Å; L1008-I1558 HydrophobicContact CD1-CG2 4.1Å; L1008-I1558 HydrophobicContact CG-CG2 4.35Å; A1009-I1558 VanDerWaalsContact CA-CD1 3.44Å; A1009-I1558 HydrophobicContact CB-CD1 3.33Å; E1554-I1558 WeakPolarHBondContact O-CB 3.4Å; E1554-I1558 VanDerWaalsContact O-CD1 3.25Å; E1554-I1558 WeakPolarHBondContact O-CD1 3.41Å; E1554-I1558 WeakPolarHBondContact O-CG1 3.36Å; E1554-I1558 PolarHBondContact O-N 3.21Å; E1554-I1558 VanDerWaalsContact O-N 3.14Å; K1555-I1558 HydrophobicContact CG-CD1 4.23Å; K1555-I1558 PolarHBondContact O-N 3.43Å; L1556-I1558 PolarHBondContact O-N 3.01Å; I1558-N1560 VanDerWaalsContact C-N 3.27Å; I1558-N1560 PolarHBondContact O-N 2.86Å
1559	W	38.9	Very low	47.6	Very low	101 Å²	101	79.8 Å²	79.8	38%	0.383	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	19.1	174.9	-62.8	91.3	0	0	0	112.4	L809 S1005 L1008 F1048 L1201 L1512 Y1515 K1555 L1556 T1557 L1561	L809-W1559 HydrophobicContact CD2-CH2 3.77Å; L809-W1559 HydrophobicContact CD2-CZ3 3.84Å; S1005-W1559 WeakPolarHBondContact OG-CZ2 3.27Å; L1008-W1559 HydrophobicContact CD1-CD2 4.33Å; L1008-W1559 HydrophobicContact CD1-CE3 3.93Å; L1008-W1559 HydrophobicContact CD1-CH2 3.59Å; L1008-W1559 HydrophobicContact CD1-CZ2 3.91Å; L1008-W1559 HydrophobicContact CD1-CZ3 3.43Å; L1008-W1559 VanDerWaalsContact CD1-CZ3 3.5Å; L1008-W1559 HydrophobicContact CG-CH2 4.35Å; F1048-W1559 HydrophobicContact CD2-CE3 4.45Å; F1048-W1559 HydrophobicContact CD2-CH2 4.34Å; F1048-W1559 HydrophobicContact CD2-CZ3 4.12Å; F1048-W1559 HydrophobicContact CE1-CH2 4.32Å; F1048-W1559 HydrophobicContact CE1-CZ3 4.31Å; F1048-W1559 AromaticContact CE2-CE3 3.83Å; F1048-W1559 HydrophobicContact CE2-CE3 3.83Å; F1048-W1559 AromaticContact CE2-CH2 3.97Å; F1048-W1559 HydrophobicContact CE2-CH2 3.97Å; F1048-W1559 AromaticContact CE2-CZ3 3.4Å; F1048-W1559 HydrophobicContact CE2-CZ3 3.4Å; F1048-W1559 HydrophobicContact CZ-CE3 4.36Å; F1048-W1559 AromaticContact CZ-CH2 3.97Å; F1048-W1559 HydrophobicContact CZ-CH2 3.97Å; F1048-W1559 AromaticContact CZ-CZ3 3.52Å; F1048-W1559 HydrophobicContact CZ-CZ3 3.52Å; L1201-W1559 HydrophobicContact CD1-CE3 4.4Å; L1512-W1559 HydrophobicContact CB-CH2 4.46Å; L1512-W1559 HydrophobicContact CB-CZ2 4.03Å; L1512-W1559 HydrophobicContact CD1-CD2 4.48Å; L1512-W1559 HydrophobicContact CD1-CE3 4.02Å; L1512-W1559 HydrophobicContact CD1-CH2 3.26Å; L1512-W1559 HydrophobicContact CD1-CZ2 3.65Å; L1512-W1559 VanDerWaalsContact CD1-CZ2 3.43Å; L1512-W1559 HydrophobicContact CD1-CZ3 3.62Å; L1512-W1559 VanDerWaalsContact CD1-CZ3 3.43Å; L1512-W1559 HydrophobicContact CD2-CH2 4.44Å; L1512-W1559 HydrophobicContact CG-CH2 4.32Å; L1512-W1559 HydrophobicContact CG-CZ2 4.3Å; Y1515-W1559 AromaticContact CD1-CE3 3.73Å; Y1515-W1559 HydrophobicContact CD1-CE3 3.73Å; Y1515-W1559 HydrophobicContact CD1-CH2 4.22Å; Y1515-W1559 AromaticContact CD1-CZ3 3.33Å; Y1515-W1559 HydrophobicContact CD1-CZ3 3.72Å; Y1515-W1559 HydrophobicContact CD2-CB 4.01Å; Y1515-W1559 AromaticContact CD2-CE3 3.51Å; Y1515-W1559 HydrophobicContact CD2-CE3 3.99Å; Y1515-W1559 AromaticContact CD2-CZ3 3.89Å; Y1515-W1559 HydrophobicContact CD2-CZ3 3.89Å; Y1515-W1559 VanDerWaalsContact CD2-O 3.23Å; Y1515-W1559 WeakPolarHBondContact CD2-O 3.26Å; Y1515-W1559 HydrophobicContact CE1-CE3 4.19Å; Y1515-W1559 AromaticContact CE1-CZ3 3.65Å; Y1515-W1559 HydrophobicContact CE1-CZ3 4.07Å; Y1515-W1559 HydrophobicContact CE2-CE3 4.02Å; Y1515-W1559 HydrophobicContact CE2-CZ3 4.16Å; Y1515-W1559 WeakPolarHBondContact CE2-O 3.44Å; Y1515-W1559 HydrophobicContact CG-CB 4.29Å; Y1515-W1559 HydrophobicContact CG-CD2 4.45Å; Y1515-W1559 AromaticContact CG-CE3 3.64Å; Y1515-W1559 HydrophobicContact CG-CE3 3.64Å; Y1515-W1559 AromaticContact CG-CZ3 3.47Å; Y1515-W1559 HydrophobicContact CG-CZ3 3.47Å; Y1515-W1559 VanDerWaalsContact CG-CZ3 3.47Å; K1555-W1559 PolarHBondContact O-N 2.68Å; L1556-W1559 CarbonylContact O-C 3.51Å; L1556-W1559 PolarHBondContact O-N 3.01Å; T1557-W1559 VanDerWaalsContact C-N 3.29Å; T1557-W1559 CarbonylContact O-C 3.58Å; T1557-W1559 PolarHBondContact O-N 3.09Å; W1559-L1561 HydrophobicContact CB-CD1 4.11Å; W1559-L1561 HydrophobicContact CB-CG 3.91Å; W1559-L1561 WeakPolarHBondContact O-CD1 3.33Å; W1559-L1561 WeakPolarHBondContact O-CG 3.5Å; W1559-L1561 PolarHBondContact O-N 2.9Å; W1559-L1561 VanDerWaalsContact O-N 3.1Å
1560	N	40.3	Very low	49.3	Very low	79 Å²	79	74.6 Å²	74.6	42%	0.422	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-27.1	75.5	171.5	-88.6	4.2	0	0	0	109.3	N816 D1534 K1555 L1556 T1557 I1558 G1562	N816-N1560 WeakPolarHBondContact CB-ND2 3.46Å; N816-N1560 WeakPolarHBondContact ND2-CB 3.32Å; N816-N1560 PolarHBondContact ND2-ND2 3.23Å; N816-N1560 VanDerWaalsContact ND2-ND2 3.17Å; N816-N1560 PolarHBondContact ND2-OD1 3.38Å; N816-N1560 PolarHBondContact OD1-ND2 3.47Å; N816-N1560 VanDerWaalsContact OD1-ND2 3.08Å; D1534-N1560 PolarHBondContact OD2-ND2 3.37Å; K1555-N1560 PolarHBondContact O-OD1 3.4Å; L1556-N1560 WeakPolarHBondContact O-CA 3.13Å; L1556-N1560 WeakPolarHBondContact O-CB 2.91Å; L1556-N1560 PolarHBondContact O-N 3.27Å; L1556-N1560 VanDerWaalsContact O-N 3.15Å; L1556-N1560 PolarHBondContact O-OD1 2.99Å; T1557-N1560 PolarHBondContact O-N 3.34Å; T1557-N1560 PolarHBondContact O-OD1 3Å; I1558-N1560 VanDerWaalsContact C-N 3.27Å; I1558-N1560 PolarHBondContact O-N 2.86Å; N1560-G1562 VanDerWaalsContact C-N 3.28Å; N1560-G1562 WeakPolarHBondContact O-CA 3.29Å; N1560-G1562 PolarHBondContact O-N 3.25Å
1561	L	41.6	Very low	50.8	Low	42.8 Å²	42.8	76 Å²	76	22%	0.224	39%	0.389	C	S	.	.			trans	-61.2	66.9	168.1	-73.9	135.5	0	0	0	107.7	Y1052 T1439 L1514 Y1515 L1518 F1528 L1556 W1559 S1563	Y1052-L1561 HydrophobicContact CE1-CD2 3.67Å; T1439-L1561 VanDerWaalsContact CB-CB 3.42Å; T1439-L1561 WeakPolarHBondContact CB-O 3.29Å; T1439-L1561 HydrophobicContact CG2-CB 3.86Å; T1439-L1561 HydrophobicContact CG2-CD2 4.4Å; T1439-L1561 WeakPolarHBondContact CG2-O 3.26Å; T1439-L1561 WeakPolarHBondContact OG1-CB 3.28Å; T1439-L1561 PolarHBondContact OG1-O 3.41Å; L1514-L1561 HydrophobicContact CD2-CD1 4.03Å; L1514-L1561 HydrophobicContact CD2-CD2 4.47Å; Y1515-L1561 HydrophobicContact CD2-CD2 4.07Å; Y1515-L1561 HydrophobicContact CD2-CG 4.18Å; L1518-L1561 HydrophobicContact CD1-CD2 4.09Å; F1528-L1561 HydrophobicContact CE2-CD2 3.66Å; F1528-L1561 HydrophobicContact CZ-CD2 4.35Å; L1556-L1561 HydrophobicContact CB-CB 4.34Å; L1556-L1561 HydrophobicContact CD2-CB 3.76Å; L1556-L1561 HydrophobicContact CD2-CD1 3.76Å; L1556-L1561 HydrophobicContact CD2-CG 4.4Å; L1556-L1561 WeakPolarHBondContact O-CA 3.12Å; L1556-L1561 WeakPolarHBondContact O-CB 3.24Å; L1556-L1561 PolarHBondContact O-N 3.27Å; W1559-L1561 HydrophobicContact CB-CD1 4.11Å; W1559-L1561 HydrophobicContact CB-CG 3.91Å; W1559-L1561 WeakPolarHBondContact O-CD1 3.33Å; W1559-L1561 WeakPolarHBondContact O-CG 3.5Å; W1559-L1561 PolarHBondContact O-N 2.9Å; W1559-L1561 VanDerWaalsContact O-N 3.1Å; L1561-S1563 PolarHBondContact O-N 3.09Å
1562	G	40.6	Very low	52.7	Low	34 Å²	34	75 Å²	75	35%	0.351	38%	0.382	S	S	.	.			trans	-54	128.6	-171.6	0	0	0	0	0	111.1	T1439 N1560 R1564	T1439-G1562 WeakPolarHBondContact CG2-O 3.38Å; T1439-G1562 PolarHBondContact OG1-O 3.26Å; N1560-G1562 VanDerWaalsContact C-N 3.28Å; N1560-G1562 WeakPolarHBondContact O-CA 3.29Å; N1560-G1562 PolarHBondContact O-N 3.25Å; G1562-R1564 PolarHBondContact O-N 3.14Å
1563	S	46.1	Very low	54.8	Low	96 Å²	96	68.8 Å²	68.8	67%	0.671	36%	0.355	S	S	*	.	S	Bend	trans	-51.1	46.7	170.5	55.7	0	0	0	0	113.3	L1561 A1565	L1561-S1563 PolarHBondContact O-N 3.09Å; S1563-A1565 VanDerWaalsContact C-N 3.28Å; S1563-A1565 PolarHBondContact O-N 3.15Å
1564	R	56.4	Low	57.1	Low	120.6 Å²	120.6	64.6 Å²	64.6	46%	0.455	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-32.6	102.5	171.9	-71.8	-177.7	163.4	133	-2.2	113.4	S1197 I1198 T1199 G1200 S1438 T1439 G1527 D1530 R1532 D1534 G1562 L1566	S1197-R1564 WeakPolarHBondContact O-CD 3.07Å; S1197-R1564 PolarHBondContact O-NE 2.92Å; S1197-R1564 VanDerWaalsContact O-NE 3.07Å; I1198-R1564 PolarHBondContact O-NH2 3.48Å; T1199-R1564 PolarHBondContact O-NH2 3.24Å; G1200-R1564 VanDerWaalsContact N-NH2 3.18Å; S1438-R1564 WeakPolarHBondContact CA-O 3.38Å; T1439-R1564 PolarHBondContact N-O 2.88Å; G1527-R1564 WeakPolarHBondContact O-CB 3.45Å; G1527-R1564 WeakPolarHBondContact O-CD 3.47Å; D1530-R1564 PolarHBondContact O-NH1 3.46Å; R1532-R1564 PolarHBondContact O-NH2 3.33Å; D1534-R1564 IonicContact OD2-NH2 2.76Å; G1562-R1564 PolarHBondContact O-N 3.14Å; R1564-L1566 PolarHBondContact O-N 3.22Å
1565	A	64.7	Low	59.2	Low	34.8 Å²	34.8	62 Å²	62	29%	0.288	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	118.1	178.2	0	0	0	0	0	110.6	P1436 L1437 S1563	P1436-A1565 HydrophobicContact CB-CB 3.7Å; P1436-A1565 HydrophobicContact CG-CB 3.81Å; L1437-A1565 CarbonylContact O-C 3.53Å; L1437-A1565 WeakPolarHBondContact O-CA 3.34Å; S1563-A1565 VanDerWaalsContact C-N 3.28Å; S1563-A1565 PolarHBondContact O-N 3.15Å
1566	L	74.3	Confident	61.6	Low	1.6 Å²	1.6	57.6 Å²	57.6	1%	0.008	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	131.6	176.6	-63.3	171.5	0	0	0	110.1	L1430 P1436 L1437 T1439 L1442 L1518 F1528 R1564	L1430-L1566 HydrophobicContact CD2-CB 3.84Å; L1430-L1566 HydrophobicContact CD2-CD1 4.39Å; P1436-L1566 WeakPolarHBondContact CA-O 3.27Å; P1436-L1566 VanDerWaalsContact CB-O 3.23Å; P1436-L1566 WeakPolarHBondContact CB-O 3.32Å; L1437-L1566 PolarHBondContact N-O 3.1Å; L1437-L1566 WeakPolarHBondContact O-CA 3.47Å; L1437-L1566 VanDerWaalsContact O-CB 3.29Å; L1437-L1566 WeakPolarHBondContact O-CB 3.32Å; L1437-L1566 PolarHBondContact O-N 3.07Å; T1439-L1566 HydrophobicContact CG2-CD1 3.92Å; T1439-L1566 HydrophobicContact CG2-CD2 4.17Å; T1439-L1566 HydrophobicContact CG2-CG 4.06Å; L1442-L1566 HydrophobicContact CB-CD1 4.43Å; L1442-L1566 HydrophobicContact CD2-CD1 3.47Å; L1442-L1566 VanDerWaalsContact CD2-CD1 3.45Å; L1518-L1566 HydrophobicContact CD1-CD1 4.34Å; L1518-L1566 HydrophobicContact CD2-CD1 4.11Å; F1528-L1566 HydrophobicContact CB-CD2 3.71Å; F1528-L1566 HydrophobicContact CD2-CD2 4.15Å; F1528-L1566 HydrophobicContact CG-CD2 4.31Å; R1564-L1566 PolarHBondContact O-N 3.22Å
1567	S	74.2	Confident	64	Low	38.4 Å²	38.4	53.2 Å²	53.2	27%	0.269	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	164.9	173.6	57.5	0	0	0	0	110.2	S1197 L1525 S1526	S1197-S1567 PolarHBondContact OG-OG 3.04Å; L1525-S1567 CarbonylContact C-O 3.53Å; L1525-S1567 VanDerWaalsContact CA-O 3.28Å; L1525-S1567 WeakPolarHBondContact CA-O 3.36Å; S1526-S1567 PolarHBondContact N-O 2.99Å; S1526-S1567 PolarHBondContact O-N 3Å; S1526-S1567 VanDerWaalsContact O-N 3.11Å; S1526-S1567 PolarHBondContact O-OG 2.81Å; S1526-S1567 PolarHBondContact OG-O 2.92Å; S1526-S1567 VanDerWaalsContact OG-O 3.13Å; S1526-S1567 PolarHBondContact OG-OG 3.14Å
1568	F	80.6	Confident	66.3	Low	20.6 Å²	20.6	52.9 Å²	52.9	9%	0.09	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	141.8	171	-69.4	-79.7	0	0	0	110.9	L1427 L1430 T1431 L1524 L1525 S1526 S1570 I1573 H1574 V1577	L1427-F1568 HydrophobicContact CD2-CE1 3.93Å; L1427-F1568 HydrophobicContact CD2-CZ 4.14Å; L1430-F1568 HydrophobicContact CB-CE2 3.77Å; L1430-F1568 HydrophobicContact CB-CZ 3.89Å; T1431-F1568 HydrophobicContact CG2-CD2 4.43Å; T1431-F1568 HydrophobicContact CG2-CE2 3.46Å; T1431-F1568 VanDerWaalsContact CG2-CE2 3.43Å; T1431-F1568 HydrophobicContact CG2-CZ 3.57Å; L1524-F1568 HydrophobicContact CB-CD1 4.42Å; L1524-F1568 CarbonylContact O-C 3.51Å; L1524-F1568 WeakPolarHBondContact O-CA 3.35Å; L1524-F1568 WeakPolarHBondContact O-CD1 3.45Å; L1525-F1568 HydrophobicContact CD2-CD1 3.97Å; L1525-F1568 HydrophobicContact CD2-CE1 3.94Å; S1526-F1568 PolarHBondContact OG-O 3.22Å; F1568-S1570 PolarHBondContact O-N 3.23Å; F1568-S1570 VanDerWaalsContact O-N 3.12Å; F1568-I1573 HydrophobicContact CD1-CG2 3.89Å; F1568-H1574 HydrophobicContact CB-CB 4.07Å; F1568-H1574 HydrophobicContact CD2-CB 3.88Å; F1568-H1574 AromaticContact CD2-CD2 3.63Å; F1568-H1574 AromaticContact CE2-CD2 3.85Å; F1568-H1574 HydrophobicContact CG-CB 4.07Å; F1568-V1577 HydrophobicContact CD1-CG2 4.49Å; F1568-V1577 HydrophobicContact CE1-CB 4.25Å; F1568-V1577 HydrophobicContact CE1-CG1 4.11Å; F1568-V1577 HydrophobicContact CE1-CG2 3.99Å; F1568-V1577 HydrophobicContact CZ-CB 4.38Å; F1568-V1577 HydrophobicContact CZ-CG1 3.97Å
1569	S	71.8	Confident	68.3	Low	31.6 Å²	31.6	50.3 Å²	50.3	22%	0.221	26%	0.262	C	S	.	.	S	Bend	trans	-64.6	-20.9	-177	63.1	0	0	0	0	113.7	S1197 P1523 L1524 I1573	S1197-S1569 PolarHBondContact OG-O 2.88Å; P1523-S1569 PolarHBondContact O-OG 3.4Å; L1524-S1569 PolarHBondContact O-N 3.28Å; L1524-S1569 PolarHBondContact O-OG 3.21Å; S1569-I1573 WeakPolarHBondContact OG-CD1 3.33Å
1570	S	73.3	Confident	70.2	Confident	22.6 Å²	22.6	47 Å²	47	16%	0.158	25%	0.251	C	S	.	.			trans	-150	155.6	168.3	95.2	0	0	0	0	111.6	L1374 F1568 E1572 I1573 H1574	L1374-S1570 VanDerWaalsContact CD2-OG 3.3Å; L1374-S1570 WeakPolarHBondContact CD2-OG 3.41Å; F1568-S1570 PolarHBondContact O-N 3.23Å; F1568-S1570 VanDerWaalsContact O-N 3.12Å; S1570-E1572 VanDerWaalsContact C-N 3.26Å; S1570-E1572 PolarHBondContact O-N 3.36Å; S1570-E1572 PolarHBondContact OG-N 3.37Å; S1570-I1573 WeakPolarHBondContact O-CB 3.35Å; S1570-I1573 PolarHBondContact O-N 3.23Å; S1570-I1573 VanDerWaalsContact O-N 3.16Å; S1570-I1573 WeakPolarHBondContact OG-CD1 3.29Å; S1570-I1573 VanDerWaalsContact OG-CG1 3.29Å; S1570-I1573 WeakPolarHBondContact OG-CG1 3.41Å; S1570-I1573 PolarHBondContact OG-N 3.07Å; S1570-I1573 VanDerWaalsContact OG-N 3.16Å; S1570-H1574 PolarHBondContact O-N 3.11Å; S1570-H1574 VanDerWaalsContact O-N 3.09Å
1571	R	71.2	Confident	72	Confident	110.4 Å²	110.4	44 Å²	44	42%	0.417	24%	0.236	S	C	.	.	H	α-helix	trans	-65.9	-28.1	174.2	-172.4	156.7	-175.4	166.5	1.1	113.1	R1285 I1573 H1574 N1575	R1285-R1571 VanDerWaalsContact CD-NH1 3.33Å; R1285-R1571 VanDerWaalsContact NE-NH1 3.11Å; R1285-R1571 VanDerWaalsContact NH1-NH1 3.16Å; R1571-I1573 VanDerWaalsContact C-N 3.28Å; R1571-I1573 PolarHBondContact O-N 3.4Å; R1571-H1574 VanDerWaalsContact CZ-CE1 3.43Å; R1571-H1574 PolarHBondContact NH1-CD2 2.91Å; R1571-H1574 PolarHBondContact NH1-CE1 2.94Å; R1571-H1574 VanDerWaalsContact NH1-CE1 3.25Å; R1571-H1574 PolarHBondContact NH1-ND1 3.49Å; R1571-H1574 PolarHBondContact NH1-NE2 3.29Å; R1571-H1574 VanDerWaalsContact NH1-NE2 3.16Å; R1571-H1574 PolarHBondContact NH2-CE1 3.48Å; R1571-H1574 WeakPolarHBondContact O-CB 3.4Å; R1571-H1574 PolarHBondContact O-N 3.12Å; R1571-N1575 PolarHBondContact NE-OD1 3.39Å; R1571-N1575 PolarHBondContact NH2-OD1 2.64Å; R1571-N1575 WeakPolarHBondContact O-CB 3.32Å; R1571-N1575 VanDerWaalsContact O-CG 3.28Å; R1571-N1575 PolarHBondContact O-N 3.12Å; R1571-N1575 PolarHBondContact O-ND2 3.28Å
1572	E	77.3	Confident	73.6	Confident	60.8 Å²	60.8	43.8 Å²	43.8	28%	0.284	23%	0.234	S	C	.	.	H	α-helix	trans	-62.8	-43.4	174.2	-135.8	177.7	169.2	0	0	110.5	N1121 L1374 I1403 S1570 N1575 L1576	N1121-E1572 HydrophobicContact CB-CB 4.19Å; N1121-E1572 WeakPolarHBondContact CB-OE2 3.47Å; L1374-E1572 WeakPolarHBondContact CD2-OE2 3.47Å; I1403-E1572 HydrophobicContact CG2-CG 4.48Å; S1570-E1572 VanDerWaalsContact C-N 3.26Å; S1570-E1572 PolarHBondContact O-N 3.36Å; S1570-E1572 PolarHBondContact OG-N 3.37Å; E1572-N1575 PolarHBondContact O-N 2.97Å; E1572-L1576 HydrophobicContact CG-CD1 4Å; E1572-L1576 VanDerWaalsContact O-CB 3.32Å; E1572-L1576 WeakPolarHBondContact O-CB 3.38Å; E1572-L1576 WeakPolarHBondContact O-CD1 3.24Å; E1572-L1576 VanDerWaalsContact O-CG 3.23Å; E1572-L1576 WeakPolarHBondContact O-CG 3.4Å; E1572-L1576 PolarHBondContact O-N 3.18Å
1573	I	83	Confident	75	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-64.3	-45.8	174.7	-65.2	162.7	0	0	0	110.4	L1374 L1378 V1407 L1524 F1568 S1569 S1570 R1571 N1575 L1576 V1577	L1374-I1573 HydrophobicContact CD1-CD1 4.28Å; L1374-I1573 HydrophobicContact CD2-CD1 4.46Å; L1378-I1573 HydrophobicContact CD1-CD1 4.03Å; L1378-I1573 HydrophobicContact CD1-CG1 4.4Å; L1378-I1573 HydrophobicContact CD2-CD1 3.9Å; L1378-I1573 HydrophobicContact CG-CD1 4.41Å; V1407-I1573 HydrophobicContact CG2-CG1 4.1Å; V1407-I1573 HydrophobicContact CG2-CG2 4.49Å; L1524-I1573 HydrophobicContact CB-CG2 3.9Å; L1524-I1573 HydrophobicContact CD2-CG2 3.86Å; L1524-I1573 HydrophobicContact CG-CG2 4.34Å; F1568-I1573 HydrophobicContact CD1-CG2 3.89Å; S1569-I1573 WeakPolarHBondContact OG-CD1 3.33Å; S1570-I1573 WeakPolarHBondContact O-CB 3.35Å; S1570-I1573 PolarHBondContact O-N 3.23Å; S1570-I1573 VanDerWaalsContact O-N 3.16Å; S1570-I1573 WeakPolarHBondContact OG-CD1 3.29Å; S1570-I1573 VanDerWaalsContact OG-CG1 3.29Å; S1570-I1573 WeakPolarHBondContact OG-CG1 3.41Å; S1570-I1573 PolarHBondContact OG-N 3.07Å; S1570-I1573 VanDerWaalsContact OG-N 3.16Å; R1571-I1573 VanDerWaalsContact C-N 3.28Å; R1571-I1573 PolarHBondContact O-N 3.4Å; I1573-N1575 VanDerWaalsContact C-N 3.33Å; I1573-N1575 PolarHBondContact O-N 3.42Å; I1573-L1576 PolarHBondContact O-N 3.29Å; I1573-V1577 HydrophobicContact CG2-CG2 4.02Å; I1573-V1577 WeakPolarHBondContact O-CB 3.37Å; I1573-V1577 VanDerWaalsContact O-CG2 3.25Å; I1573-V1577 WeakPolarHBondContact O-CG2 3.37Å; I1573-V1577 PolarHBondContact O-N 3.28Å
1574	H	82.7	Confident	75.4	Confident	45.8 Å²	45.8	46.4 Å²	46.4	21%	0.212	23%	0.228	C	C	.	.	H	α-helix	trans	-53.4	-50.6	175.4	172.3	-78	0	0	0	112.1	T1431 F1568 S1570 R1571 L1576 V1577 Y1578	T1431-H1574 PolarHBondContact O-NE2 3.04Å; T1431-H1574 VanDerWaalsContact O-NE2 3.08Å; F1568-H1574 HydrophobicContact CB-CB 4.07Å; F1568-H1574 HydrophobicContact CD2-CB 3.88Å; F1568-H1574 AromaticContact CD2-CD2 3.63Å; F1568-H1574 AromaticContact CE2-CD2 3.85Å; F1568-H1574 HydrophobicContact CG-CB 4.07Å; S1570-H1574 PolarHBondContact O-N 3.11Å; S1570-H1574 VanDerWaalsContact O-N 3.09Å; R1571-H1574 VanDerWaalsContact CZ-CE1 3.43Å; R1571-H1574 PolarHBondContact NH1-CD2 2.91Å; R1571-H1574 PolarHBondContact NH1-CE1 2.94Å; R1571-H1574 VanDerWaalsContact NH1-CE1 3.25Å; R1571-H1574 PolarHBondContact NH1-ND1 3.49Å; R1571-H1574 PolarHBondContact NH1-NE2 3.29Å; R1571-H1574 VanDerWaalsContact NH1-NE2 3.16Å; R1571-H1574 PolarHBondContact NH2-CE1 3.48Å; R1571-H1574 WeakPolarHBondContact O-CB 3.4Å; R1571-H1574 PolarHBondContact O-N 3.12Å; H1574-L1576 VanDerWaalsContact C-N 3.34Å; H1574-L1576 PolarHBondContact O-N 3.27Å; H1574-V1577 PolarHBondContact O-N 3.15Å; H1574-Y1578 WeakPolarHBondContact O-CB 3.36Å; H1574-Y1578 PolarHBondContact O-N 3.01Å
1575	N	81.3	Confident	75	Confident	74 Å²	74	45.5 Å²	45.5	40%	0.396	24%	0.24	S	C	.	.	H	α-helix	trans	-64.4	-40.8	179.9	-71	-11.7	0	0	0	112	R1571 E1572 I1573 Y1578 D1579	R1571-N1575 PolarHBondContact NE-OD1 3.39Å; R1571-N1575 PolarHBondContact NH2-OD1 2.64Å; R1571-N1575 WeakPolarHBondContact O-CB 3.32Å; R1571-N1575 VanDerWaalsContact O-CG 3.28Å; R1571-N1575 PolarHBondContact O-N 3.12Å; R1571-N1575 PolarHBondContact O-ND2 3.28Å; E1572-N1575 PolarHBondContact O-N 2.97Å; I1573-N1575 VanDerWaalsContact C-N 3.33Å; I1573-N1575 PolarHBondContact O-N 3.42Å; N1575-Y1578 WeakPolarHBondContact O-CB 3.48Å; N1575-Y1578 PolarHBondContact O-N 3.33Å; N1575-D1579 WeakPolarHBondContact O-CB 3.44Å; N1575-D1579 PolarHBondContact O-N 3.26Å
1576	L	84.2	Confident	74.1	Confident	22.2 Å²	22.2	50.9 Å²	50.9	12%	0.116	26%	0.257	C	S	.	.	H	α-helix	trans	-64.6	-43.9	177	-73.7	166.7	0	0	0	111.6	I1403 S1404 V1407 E1572 I1573 H1574 Y1578 D1579 I1580	I1403-L1576 HydrophobicContact CG2-CD1 4.16Å; S1404-L1576 WeakPolarHBondContact OG-CD2 3.28Å; V1407-L1576 HydrophobicContact CB-CD1 4.41Å; V1407-L1576 HydrophobicContact CG1-CB 4.34Å; V1407-L1576 HydrophobicContact CG2-CD1 4.21Å; E1572-L1576 HydrophobicContact CG-CD1 4Å; E1572-L1576 VanDerWaalsContact O-CB 3.32Å; E1572-L1576 WeakPolarHBondContact O-CB 3.38Å; E1572-L1576 WeakPolarHBondContact O-CD1 3.24Å; E1572-L1576 VanDerWaalsContact O-CG 3.23Å; E1572-L1576 WeakPolarHBondContact O-CG 3.4Å; E1572-L1576 PolarHBondContact O-N 3.18Å; I1573-L1576 PolarHBondContact O-N 3.29Å; H1574-L1576 VanDerWaalsContact C-N 3.34Å; H1574-L1576 PolarHBondContact O-N 3.27Å; L1576-Y1578 VanDerWaalsContact C-N 3.34Å; L1576-D1579 PolarHBondContact O-N 3.23Å; L1576-I1580 WeakPolarHBondContact O-CB 3.34Å; L1576-I1580 WeakPolarHBondContact O-CD1 3.37Å; L1576-I1580 WeakPolarHBondContact O-CG1 3.35Å; L1576-I1580 PolarHBondContact O-N 3.03Å
1577	V	85.7	Confident	72.8	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-63.8	-42.2	176.3	172.3	0	0	0	0	110.6	V1407 L1427 T1431 L1524 F1568 I1573 H1574 D1579 I1580 C1581	V1407-V1577 HydrophobicContact CG1-CG2 3.96Å; L1427-V1577 HydrophobicContact CB-CG1 3.78Å; L1427-V1577 HydrophobicContact CD1-CG1 4.14Å; L1427-V1577 HydrophobicContact CD2-CG1 3.96Å; L1427-V1577 HydrophobicContact CG-CG1 4.18Å; T1431-V1577 HydrophobicContact CG2-CB 4.06Å; T1431-V1577 HydrophobicContact CG2-CG1 3.63Å; L1524-V1577 HydrophobicContact CD1-CG2 4.28Å; F1568-V1577 HydrophobicContact CD1-CG2 4.49Å; F1568-V1577 HydrophobicContact CE1-CB 4.25Å; F1568-V1577 HydrophobicContact CE1-CG1 4.11Å; F1568-V1577 HydrophobicContact CE1-CG2 3.99Å; F1568-V1577 HydrophobicContact CZ-CB 4.38Å; F1568-V1577 HydrophobicContact CZ-CG1 3.97Å; I1573-V1577 HydrophobicContact CG2-CG2 4.02Å; I1573-V1577 WeakPolarHBondContact O-CB 3.37Å; I1573-V1577 VanDerWaalsContact O-CG2 3.25Å; I1573-V1577 WeakPolarHBondContact O-CG2 3.37Å; I1573-V1577 PolarHBondContact O-N 3.28Å; H1574-V1577 PolarHBondContact O-N 3.15Å; V1577-D1579 VanDerWaalsContact C-N 3.31Å; V1577-D1579 PolarHBondContact O-N 3.04Å; V1577-I1580 WeakPolarHBondContact O-CB 3.03Å; V1577-I1580 PolarHBondContact O-N 3.3Å; V1577-I1580 VanDerWaalsContact O-N 3.12Å; V1577-C1581 WeakPolarHBondContact O-CB 3.28Å; V1577-C1581 PolarHBondContact O-N 2.95Å; V1577-C1581 PolarHBondContact O-SG 3.25Å; V1577-C1581 VanDerWaalsContact O-SG 3.38Å
1578	Y	84	Confident	71	Confident	76.8 Å²	76.8	58.1 Å²	58.1	30%	0.301	29%	0.294	S	S	.	.	H	α-helix	trans	-58.8	-46	174.3	-176	-85.9	0	0	0	111.4	H1574 N1575 L1576 I1580 C1581 F1582 L1628	H1574-Y1578 WeakPolarHBondContact O-CB 3.36Å; H1574-Y1578 PolarHBondContact O-N 3.01Å; N1575-Y1578 WeakPolarHBondContact O-CB 3.48Å; N1575-Y1578 PolarHBondContact O-N 3.33Å; L1576-Y1578 VanDerWaalsContact C-N 3.34Å; Y1578-I1580 VanDerWaalsContact C-N 3.33Å; Y1578-I1580 PolarHBondContact O-N 3.26Å; Y1578-C1581 PolarHBondContact O-N 3.11Å; Y1578-F1582 HydrophobicContact CD1-CD2 4.29Å; Y1578-F1582 AromaticContact CD2-CD2 3.6Å; Y1578-F1582 HydrophobicContact CD2-CD2 3.6Å; Y1578-F1582 AromaticContact CD2-CE2 3.77Å; Y1578-F1582 HydrophobicContact CD2-CE2 3.77Å; Y1578-F1582 HydrophobicContact CE1-CD2 4.27Å; Y1578-F1582 AromaticContact CE2-CD2 3.58Å; Y1578-F1582 HydrophobicContact CE2-CD2 3.58Å; Y1578-F1582 AromaticContact CE2-CE2 3.85Å; Y1578-F1582 HydrophobicContact CE2-CE2 3.85Å; Y1578-F1582 AromaticContact CG-CD2 3.95Å; Y1578-F1582 HydrophobicContact CG-CD2 3.97Å; Y1578-F1582 HydrophobicContact CG-CE2 4.42Å; Y1578-F1582 AromaticContact CZ-CD2 3.91Å; Y1578-F1582 VanDerWaalsContact O-CD2 3.28Å; Y1578-F1582 WeakPolarHBondContact O-CD2 3.33Å; Y1578-F1582 PolarHBondContact O-N 3.28Å; Y1578-L1628 HydrophobicContact CE2-CD1 4.21Å; Y1578-L1628 WeakPolarHBondContact OH-CD1 3.31Å
1579	D	81.4	Confident	68.9	Low	43.4 Å²	43.4	63.1 Å²	63.1	23%	0.232	32%	0.321	C	S	.	.	H	α-helix	trans	-63.5	-38	176.3	-82.8	-18.3	0	0	0	112.2	N1575 L1576 V1577 N1583 K1586 Y1587	N1575-D1579 WeakPolarHBondContact O-CB 3.44Å; N1575-D1579 PolarHBondContact O-N 3.26Å; L1576-D1579 PolarHBondContact O-N 3.23Å; V1577-D1579 VanDerWaalsContact C-N 3.31Å; V1577-D1579 PolarHBondContact O-N 3.04Å; D1579-N1583 HydrophobicContact CB-CB 4.41Å; D1579-N1583 CarbonylContact O-C 3.53Å; D1579-N1583 WeakPolarHBondContact O-CA 3.37Å; D1579-N1583 WeakPolarHBondContact O-CB 3.4Å; D1579-N1583 PolarHBondContact O-N 3.23Å; D1579-N1583 PolarHBondContact OD1-ND2 2.98Å; D1579-K1586 IonicContact OD1-NZ 3.18Å; D1579-K1586 PolarHBondContact OD1-NZ 3.05Å; D1579-K1586 IonicContact OD2-NZ 2.61Å; D1579-K1586 PolarHBondContact OD2-NZ 3.31Å; D1579-Y1587 HydrophobicContact CB-CE2 3.95Å; D1579-Y1587 WeakPolarHBondContact O-CE2 3.4Å
1580	I	80	Confident	67.2	Low	31 Å²	31	65 Å²	65	16%	0.159	35%	0.345	C	S	.	.	H	α-helix	trans	-65.9	-42.5	175.9	-69.1	161.1	0	0	0	111.3	V1407 I1408 V1411 L1576 V1577 Y1578 Y1587	V1407-I1580 HydrophobicContact CG1-CD1 3.93Å; I1408-I1580 HydrophobicContact CB-CD1 4.44Å; I1408-I1580 HydrophobicContact CG1-CD1 3.59Å; I1408-I1580 HydrophobicContact CG1-CG1 3.94Å; V1411-I1580 HydrophobicContact CG1-CG2 4.35Å; V1411-I1580 HydrophobicContact CG2-CD1 4.44Å; L1576-I1580 WeakPolarHBondContact O-CB 3.34Å; L1576-I1580 WeakPolarHBondContact O-CD1 3.37Å; L1576-I1580 WeakPolarHBondContact O-CG1 3.35Å; L1576-I1580 PolarHBondContact O-N 3.03Å; V1577-I1580 WeakPolarHBondContact O-CB 3.03Å; V1577-I1580 PolarHBondContact O-N 3.3Å; V1577-I1580 VanDerWaalsContact O-N 3.12Å; Y1578-I1580 VanDerWaalsContact C-N 3.33Å; Y1578-I1580 PolarHBondContact O-N 3.26Å; I1580-Y1587 HydrophobicContact CG1-CE2 4.33Å
1581	C	77.7	Confident	65.4	Low	16.6 Å²	16.6	70.5 Å²	70.5	11%	0.112	37%	0.368	C	S	.	.	H	α-helix	trans	-72.8	-38.3	-177.6	-67.4	0	0	0	0	112.4	V1577 Y1578	V1577-C1581 WeakPolarHBondContact O-CB 3.28Å; V1577-C1581 PolarHBondContact O-N 2.95Å; V1577-C1581 PolarHBondContact O-SG 3.25Å; V1577-C1581 VanDerWaalsContact O-SG 3.38Å; Y1578-C1581 PolarHBondContact O-N 3.11Å
1582	F	76	Confident	63.7	Low	39.4 Å²	39.4	73.8 Å²	73.8	17%	0.173	39%	0.385	C	S	.	.	H	α-helix	trans	-122.2	-25.6	-166.3	-53	-62.2	0	0	0	115.8	Y1578 Q1584 L1628 I1631	Y1578-F1582 HydrophobicContact CD1-CD2 4.29Å; Y1578-F1582 AromaticContact CD2-CD2 3.6Å; Y1578-F1582 HydrophobicContact CD2-CD2 3.6Å; Y1578-F1582 AromaticContact CD2-CE2 3.77Å; Y1578-F1582 HydrophobicContact CD2-CE2 3.77Å; Y1578-F1582 HydrophobicContact CE1-CD2 4.27Å; Y1578-F1582 AromaticContact CE2-CD2 3.58Å; Y1578-F1582 HydrophobicContact CE2-CD2 3.58Å; Y1578-F1582 AromaticContact CE2-CE2 3.85Å; Y1578-F1582 HydrophobicContact CE2-CE2 3.85Å; Y1578-F1582 AromaticContact CG-CD2 3.95Å; Y1578-F1582 HydrophobicContact CG-CD2 3.97Å; Y1578-F1582 HydrophobicContact CG-CE2 4.42Å; Y1578-F1582 AromaticContact CZ-CD2 3.91Å; Y1578-F1582 VanDerWaalsContact O-CD2 3.28Å; Y1578-F1582 WeakPolarHBondContact O-CD2 3.33Å; Y1578-F1582 PolarHBondContact O-N 3.28Å; F1582-Q1584 PolarHBondContact O-N 3.16Å; F1582-L1628 HydrophobicContact CB-CD1 4.41Å; F1582-L1628 HydrophobicContact CD1-CB 3.87Å; F1582-L1628 HydrophobicContact CD1-CD1 4Å; F1582-L1628 HydrophobicContact CD1-CG 4.41Å; F1582-L1628 HydrophobicContact CD2-CD1 4.01Å; F1582-L1628 VanDerWaalsContact CE1-CA 3.48Å; F1582-L1628 HydrophobicContact CE1-CB 3.99Å; F1582-L1628 HydrophobicContact CE1-CD1 4.01Å; F1582-L1628 HydrophobicContact CE1-CG 4.4Å; F1582-L1628 HydrophobicContact CE2-CD1 4.01Å; F1582-L1628 HydrophobicContact CG-CB 4.33Å; F1582-L1628 HydrophobicContact CG-CD1 4Å; F1582-L1628 HydrophobicContact CZ-CD1 4Å; F1582-I1631 HydrophobicContact CE1-CD1 3.67Å; F1582-I1631 HydrophobicContact CZ-CD1 3.54Å; F1582-I1631 VanDerWaalsContact CZ-CD1 3.46Å
1583	N	68.4	Low	61.6	Low	63.6 Å²	63.6	79.4 Å²	79.4	34%	0.34	41%	0.409	S	S	.	.			trans	-101.3	67.5	-176	-76.4	-31.2	0	0	0	112.3	D1579 S1585 K1586 Y1587	D1579-N1583 HydrophobicContact CB-CB 4.41Å; D1579-N1583 CarbonylContact O-C 3.53Å; D1579-N1583 WeakPolarHBondContact O-CA 3.37Å; D1579-N1583 WeakPolarHBondContact O-CB 3.4Å; D1579-N1583 PolarHBondContact O-N 3.23Å; D1579-N1583 PolarHBondContact OD1-ND2 2.98Å; N1583-S1585 VanDerWaalsContact C-N 3.32Å; N1583-S1585 PolarHBondContact O-N 3.13Å; N1583-S1585 VanDerWaalsContact O-N 3.13Å; N1583-K1586 PolarHBondContact O-N 3.22Å; N1583-Y1587 WeakPolarHBondContact O-CD2 3.39Å
1584	Q	55.9	Low	59.4	Low	121.2 Å²	121.2	86.4 Å²	86.4	57%	0.566	44%	0.436	S	S	*	.	G	3₁₀ helix	trans	-62.7	-22.3	-177.7	-66.6	-177.9	1.5	0	0	114.4	F1582 K1586 Y1587 S1588	F1582-Q1584 PolarHBondContact O-N 3.16Å; Q1584-K1586 VanDerWaalsContact C-N 3.27Å; Q1584-K1586 PolarHBondContact O-N 3.29Å; Q1584-K1586 VanDerWaalsContact O-N 3.13Å; Q1584-Y1587 CarbonylContact O-C 3.46Å; Q1584-Y1587 PolarHBondContact O-N 3.19Å; Q1584-S1588 PolarHBondContact O-N 2.96Å; Q1584-S1588 PolarHBondContact O-OG 3.26Å; Q1584-S1588 VanDerWaalsContact O-OG 3.14Å
1585	S	47	Very low	56.9	Low	100.4 Å²	100.4	91.7 Å²	91.7	70%	0.702	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-68.7	-22.7	-175.3	61.1	0	0	0	0	114.6	N1583 Y1587 S1588	N1583-S1585 VanDerWaalsContact C-N 3.32Å; N1583-S1585 PolarHBondContact O-N 3.13Å; N1583-S1585 VanDerWaalsContact O-N 3.13Å; S1585-Y1587 VanDerWaalsContact C-N 3.34Å; S1585-Y1587 PolarHBondContact O-N 3.42Å; S1585-S1588 PolarHBondContact O-N 3.07Å; S1585-S1588 PolarHBondContact O-OG 3.26Å
1586	K	45.7	Very low	54.8	Low	148.2 Å²	148.2	93.5 Å²	93.5	64%	0.644	46%	0.463	S	S	*	.	G	3₁₀ helix	trans	-87.6	-20.3	179.2	-75.9	-178.5	-179.2	170.3	0	114.1	D1579 N1583 Q1584 S1588	D1579-K1586 IonicContact OD1-NZ 3.18Å; D1579-K1586 PolarHBondContact OD1-NZ 3.05Å; D1579-K1586 IonicContact OD2-NZ 2.61Å; D1579-K1586 PolarHBondContact OD2-NZ 3.31Å; N1583-K1586 PolarHBondContact O-N 3.22Å; Q1584-K1586 VanDerWaalsContact C-N 3.27Å; Q1584-K1586 PolarHBondContact O-N 3.29Å; Q1584-K1586 VanDerWaalsContact O-N 3.13Å; K1586-S1588 VanDerWaalsContact C-N 3.34Å
1587	Y	47	Very low	52.2	Low	92.6 Å²	92.6	96.4 Å²	96.4	36%	0.363	49%	0.485	S	S	.	.			trans	-112.1	24.6	-173.4	-64	-75.5	0	0	0	113	I1408 D1579 I1580 N1583 Q1584 S1585 I1589 H1591	I1408-Y1587 HydrophobicContact CD1-CD1 3.89Å; I1408-Y1587 HydrophobicContact CD1-CE1 3.69Å; I1408-Y1587 HydrophobicContact CG1-CE1 4.33Å; D1579-Y1587 HydrophobicContact CB-CE2 3.95Å; D1579-Y1587 WeakPolarHBondContact O-CE2 3.4Å; I1580-Y1587 HydrophobicContact CG1-CE2 4.33Å; N1583-Y1587 WeakPolarHBondContact O-CD2 3.39Å; Q1584-Y1587 CarbonylContact O-C 3.46Å; Q1584-Y1587 PolarHBondContact O-N 3.19Å; S1585-Y1587 VanDerWaalsContact C-N 3.34Å; S1585-Y1587 PolarHBondContact O-N 3.42Å; Y1587-I1589 VanDerWaalsContact C-N 3.3Å; Y1587-I1589 PolarHBondContact O-N 3.1Å; Y1587-H1591 PolarHBondContact O-CD2 3.12Å
1588	S	36.3	Very low	49.7	Very low	99.6 Å²	99.6	102 Å²	102	70%	0.697	51%	0.51	S	S	*	.			trans	-77.6	35.8	176.4	-39.3	0	0	0	0	113.1	Q1584 S1585 K1586 G1590	Q1584-S1588 PolarHBondContact O-N 2.96Å; Q1584-S1588 PolarHBondContact O-OG 3.26Å; Q1584-S1588 VanDerWaalsContact O-OG 3.14Å; S1585-S1588 PolarHBondContact O-N 3.07Å; S1585-S1588 PolarHBondContact O-OG 3.26Å; K1586-S1588 VanDerWaalsContact C-N 3.34Å; S1588-G1590 PolarHBondContact O-N 3.04Å
1589	I	37.6	Very low	47.2	Very low	125.8 Å²	125.8	106.4 Å²	106.4	65%	0.645	53%	0.53	S	S	*	.	S	Bend	trans	-103.5	89.3	178	-61.4	170.4	0	0	0	109.6	Y1587 H1591	Y1587-I1589 VanDerWaalsContact C-N 3.3Å; Y1587-I1589 PolarHBondContact O-N 3.1Å; I1589-H1591 VanDerWaalsContact C-N 3.34Å; I1589-H1591 PolarHBondContact O-N 2.87Å; I1589-H1591 VanDerWaalsContact O-N 3.12Å
1590	G	35.7	Very low	44.8	Very low	70 Å²	70	110.1 Å²	110.1	72%	0.722	55%	0.55	S	S	*	*	S	Bend	trans	11.7	63	175.3	0	0	0	0	0	116	S1588 K1592	S1588-G1590 PolarHBondContact O-N 3.04Å; G1590-K1592 PolarHBondContact O-N 3.21Å; G1590-K1592 VanDerWaalsContact O-N 3.09Å
1591	H	36.1	Very low	42.4	Very low	138.2 Å²	138.2	115.5 Å²	115.5	64%	0.64	58%	0.579	S	S	*	*			trans	-76.4	95.3	178.5	-70.8	-83.1	0	0	0	112.3	R1424 Y1587 I1589 K1593 Y1594	R1424-H1591 PolarHBondContact NH2-CE1 2.89Å; R1424-H1591 PolarHBondContact NH2-ND1 2.82Å; Y1587-H1591 PolarHBondContact O-CD2 3.12Å; I1589-H1591 VanDerWaalsContact C-N 3.34Å; I1589-H1591 PolarHBondContact O-N 2.87Å; I1589-H1591 VanDerWaalsContact O-N 3.12Å; H1591-K1593 PolarHBondContact O-N 3.13Å; H1591-Y1594 HydrophobicContact CB-CD2 4.35Å
1592	K	33.7	Very low	40.2	Very low	180.8 Å²	180.8	122.2 Å²	122.2	79%	0.786	61%	0.609	S	S	*	*			trans	-54.7	99.7	153.2	-76.1	-177.3	175.7	179.7	0	110.7	G1590 Y1594	G1590-K1592 PolarHBondContact O-N 3.21Å; G1590-K1592 VanDerWaalsContact O-N 3.09Å; K1592-Y1594 HydrophobicContact CB-CD2 4.25Å; K1592-Y1594 HydrophobicContact CB-CE2 4.13Å; K1592-Y1594 VanDerWaalsContact O-CD2 3.29Å; K1592-Y1594 WeakPolarHBondContact O-CD2 3.17Å; K1592-Y1594 WeakPolarHBondContact O-CE2 3.37Å; K1592-Y1594 PolarHBondContact O-N 3.16Å
1593	K	34.3	Very low	38	Very low	177.6 Å²	177.6	126.2 Å²	126.2	77%	0.772	64%	0.636	S	S	*	*			trans	-63.8	87	171.3	-82.6	-176	173	-174.8	0	111.6	H1591	H1591-K1593 PolarHBondContact O-N 3.13Å
1594	Y	35.8	Very low	36.1	Very low	146.2 Å²	146.2	132.3 Å²	132.3	57%	0.573	66%	0.66	S	S	*	*			trans	-107.4	90.7	163.2	-68.8	-75.9	0	0	0	108.2	C1416 S1420 H1591 K1592 Y1596	C1416-Y1594 HydrophobicContact CB-CE2 4.42Å; C1416-Y1594 WeakPolarHBondContact SG-CE2 3.41Å; S1420-Y1594 PolarHBondContact N-O 3.46Å; H1591-Y1594 HydrophobicContact CB-CD2 4.35Å; K1592-Y1594 HydrophobicContact CB-CD2 4.25Å; K1592-Y1594 HydrophobicContact CB-CE2 4.13Å; K1592-Y1594 VanDerWaalsContact O-CD2 3.29Å; K1592-Y1594 WeakPolarHBondContact O-CD2 3.17Å; K1592-Y1594 WeakPolarHBondContact O-CE2 3.37Å; K1592-Y1594 PolarHBondContact O-N 3.16Å; Y1594-Y1596 VanDerWaalsContact C-N 3.35Å; Y1594-Y1596 HydrophobicContact CD1-CE2 4.49Å; Y1594-Y1596 HydrophobicContact CG-CE2 4.48Å; Y1594-Y1596 PolarHBondContact O-N 3.32Å; Y1594-Y1596 VanDerWaalsContact O-N 3.1Å
1595	E	31.1	Very low	34.9	Very low	157.2 Å²	157.2	133.7 Å²	133.7	74%	0.735	67%	0.671	S	S	*	*			trans	-78.4	111.2	170.4	-77.7	179.7	152.3	0	0	108.9	S1597 H1622	E1595-S1597 VanDerWaalsContact C-N 3.33Å; E1595-S1597 PolarHBondContact O-N 3.24Å; E1595-H1622 IonicContact OE1-CE1 2.7Å; E1595-H1622 IonicContact OE1-ND1 3.48Å; E1595-H1622 PolarHBondContact OE1-ND1 3.1Å; E1595-H1622 VanDerWaalsContact OE1-ND1 3.12Å; E1595-H1622 IonicContact OE2-CE1 3.25Å; E1595-H1622 IonicContact OE2-ND1 3.14Å
1596	Y	36.3	Very low	34	Very low	113.4 Å²	113.4	134.8 Å²	134.8	45%	0.445	68%	0.678	S	S	.	*			trans	-83.7	98.5	163.8	-87.1	-87	0	0	0	108.6	C1418 L1422 L1513 Y1594 F1598 L1623	C1418-Y1596 PolarHBondContact O-OH 3.03Å; L1422-Y1596 HydrophobicContact CD1-CD1 3.65Å; L1422-Y1596 HydrophobicContact CD1-CD2 3.47Å; L1422-Y1596 VanDerWaalsContact CD1-CD2 3.47Å; L1422-Y1596 HydrophobicContact CD1-CE1 4.12Å; L1422-Y1596 HydrophobicContact CD1-CE2 3.97Å; L1422-Y1596 HydrophobicContact CD1-CG 3.28Å; L1422-Y1596 HydrophobicContact CG-CD1 4.33Å; L1422-Y1596 HydrophobicContact CG-CG 4.15Å; L1513-Y1596 HydrophobicContact CD2-CD2 4.36Å; L1513-Y1596 HydrophobicContact CD2-CE2 3.41Å; L1513-Y1596 VanDerWaalsContact CD2-CE2 3.41Å; Y1594-Y1596 VanDerWaalsContact C-N 3.35Å; Y1594-Y1596 HydrophobicContact CD1-CE2 4.49Å; Y1594-Y1596 HydrophobicContact CG-CE2 4.48Å; Y1594-Y1596 PolarHBondContact O-N 3.32Å; Y1594-Y1596 VanDerWaalsContact O-N 3.1Å; Y1596-F1598 HydrophobicContact CE1-CD2 4.39Å; Y1596-F1598 PolarHBondContact O-N 3.38Å; Y1596-F1598 VanDerWaalsContact O-N 3.14Å; Y1596-L1623 HydrophobicContact CD1-CD1 4.1Å; Y1596-L1623 HydrophobicContact CD2-CD1 3.61Å; Y1596-L1623 HydrophobicContact CE2-CD1 3.93Å; Y1596-L1623 WeakPolarHBondContact O-CD1 3.41Å
1597	S	31.6	Very low	33.1	Very low	82.6 Å²	82.6	135.2 Å²	135.2	58%	0.578	69%	0.687	S	S	*	*			trans	-86.7	111.2	172.9	61.2	0	0	0	0	110.2	E1595 K1599	E1595-S1597 VanDerWaalsContact C-N 3.33Å; E1595-S1597 PolarHBondContact O-N 3.24Å; S1597-K1599 VanDerWaalsContact C-N 3.31Å; S1597-K1599 PolarHBondContact O-N 3.32Å
1598	F	32.9	Very low	32.3	Very low	117.4 Å²	117.4	140.4 Å²	140.4	52%	0.515	71%	0.711	S	S	.	*			trans	-72.8	101.1	162.8	-100.7	-90.2	0	0	0	109	L1450 P1507 Y1596 N1600 I1621	L1450-F1598 HydrophobicContact CD2-CZ 4.3Å; P1507-F1598 HydrophobicContact CB-CE1 4.23Å; P1507-F1598 HydrophobicContact CB-CE2 4.32Å; P1507-F1598 HydrophobicContact CB-CZ 4.16Å; Y1596-F1598 HydrophobicContact CE1-CD2 4.39Å; Y1596-F1598 PolarHBondContact O-N 3.38Å; Y1596-F1598 VanDerWaalsContact O-N 3.14Å; F1598-N1600 PolarHBondContact O-N 3.29Å; F1598-I1621 HydrophobicContact CB-CD1 4.39Å
1599	K	31.7	Very low	31.9	Very low	170.2 Å²	170.2	147.6 Å²	147.6	74%	0.74	72%	0.723	S	S	*	*			trans	-105.8	112	170.4	-82.2	-174.2	176.8	177	0	109.2	S1597 N1601	S1597-K1599 VanDerWaalsContact C-N 3.31Å; S1597-K1599 PolarHBondContact O-N 3.32Å; K1599-N1601 PolarHBondContact O-N 3Å; K1599-N1601 VanDerWaalsContact O-N 3.12Å
1600	N	29.7	Very low	31.5	Very low	121 Å²	121	146.3 Å²	146.3	65%	0.647	73%	0.731	S	S	*	*			trans	-57.9	109.9	164.3	-100.1	-12	0	0	0	109.3	F1598 Q1602	F1598-N1600 PolarHBondContact O-N 3.29Å; N1600-Q1602 VanDerWaalsContact C-N 3.29Å; N1600-Q1602 PolarHBondContact O-N 3.17Å
1601	N	29.8	Very low	31.1	Very low	143.2 Å²	143.2	152.4 Å²	152.4	77%	0.766	74%	0.738	S	S	*	*			trans	-114	83.5	163.7	-90	-24	0	0	0	111.2	K1599 T1603	K1599-N1601 PolarHBondContact O-N 3Å; K1599-N1601 VanDerWaalsContact O-N 3.12Å; N1601-T1603 VanDerWaalsContact C-N 3.33Å; N1601-T1603 PolarHBondContact O-N 3.38Å
1602	Q	30.9	Very low	30.8	Very low	157.4 Å²	157.4	156.4 Å²	156.4	74%	0.736	75%	0.749	S	S	*	*			trans	-32.9	86.3	157.7	-67.2	-175.5	8.8	0	0	114.2	N1600 K1604	N1600-Q1602 VanDerWaalsContact C-N 3.29Å; N1600-Q1602 PolarHBondContact O-N 3.17Å; Q1602-K1604 PolarHBondContact O-N 3.29Å
1603	T	29.8	Very low	30.5	Very low	122.6 Å²	122.6	152.9 Å²	152.9	75%	0.752	75%	0.747	S	S	*	*			trans	-14.4	94.6	150.7	51.1	0	0	0	0	114.7	N1601 N1605	N1601-T1603 VanDerWaalsContact C-N 3.33Å; N1601-T1603 PolarHBondContact O-N 3.38Å; T1603-N1605 PolarHBondContact O-N 3.39Å
1604	K	29.9	Very low	30.3	Very low	193.6 Å²	193.6	153.1 Å²	153.1	84%	0.842	75%	0.751	S	S	*	*			trans	-123.4	99.8	150	-90.6	174.7	179.7	177.2	0	111.4	Q1602 C1606	Q1602-K1604 PolarHBondContact O-N 3.29Å; K1604-C1606 PolarHBondContact O-N 3.5Å
1605	N	29	Very low	29.9	Very low	150 Å²	150	151.8 Å²	151.8	80%	0.802	76%	0.763	S	S	*	*			trans	49.6	72.3	159.5	-73.2	-14.9	0	0	0	115.5	T1603 N1607	T1603-N1605 PolarHBondContact O-N 3.39Å; N1605-N1607 VanDerWaalsContact C-N 3.31Å; N1605-N1607 PolarHBondContact O-N 3.14Å; N1605-N1607 VanDerWaalsContact O-N 3.1Å
1606	C	28.5	Very low	30	Very low	122.8 Å²	122.8	151.6 Å²	151.6	83%	0.83	77%	0.766	S	S	*	*			trans	-129.8	70.2	147.9	-89.6	0	0	0	0	111.5	K1604 K1608	K1604-C1606 PolarHBondContact O-N 3.5Å; C1606-K1608 PolarHBondContact O-N 3.03Å; C1606-K1608 VanDerWaalsContact O-N 3.15Å
1607	N	28.1	Very low	29.8	Very low	157.4 Å²	157.4	151.1 Å²	151.1	84%	0.842	78%	0.776	S	S	*	*			trans	-69.2	106.6	159.9	-75.6	-18.4	0	0	0	111.9	N1605 R1609	N1605-N1607 VanDerWaalsContact C-N 3.31Å; N1605-N1607 PolarHBondContact O-N 3.14Å; N1605-N1607 VanDerWaalsContact O-N 3.1Å; N1607-R1609 PolarHBondContact O-N 3.06Å
1608	K	29.5	Very low	29.9	Very low	202 Å²	202	154.4 Å²	154.4	88%	0.878	79%	0.787	S	S	*	*			trans	-124.2	90.2	163.4	-74.9	179.2	179.3	175.7	0	112.4	C1606	C1606-K1608 PolarHBondContact O-N 3.03Å; C1606-K1608 VanDerWaalsContact O-N 3.15Å
1609	R	27.8	Very low	30.1	Very low	250.2 Å²	250.2	155.7 Å²	155.7	94%	0.944	80%	0.8	S	S	*	*	S	Bend	trans	150.9	97.9	145.2	-91.7	170.8	171.6	167.4	-2.8	112.9	N1607	N1607-R1609 PolarHBondContact O-N 3.06Å
1610	A	30.1	Very low	30.6	Very low	99 Å²	99	154.6 Å²	154.6	82%	0.818	80%	0.795	S	S	*	*			trans	-178.3	102.7	145.4	0	0	0	0	0	109.8	Y1612	A1610-Y1612 PolarHBondContact O-N 3.34Å
1611	K	26.4	Very low	31.6	Very low	197.2 Å²	197.2	153.1 Å²	153.1	86%	0.857	79%	0.786	S	S	*	*			trans	-84.6	119.2	163.7	-80.2	179.8	171.3	-177.4	0	107.4
1612	Y	29.6	Very low	32.7	Very low	222 Å²	222	152.2 Å²	152.2	87%	0.871	78%	0.777	S	S	*	*			trans	-173.3	117.1	151.1	-84.1	-75.3	0	0	0	109	A1610	A1610-Y1612 PolarHBondContact O-N 3.34Å
1613	S	26.9	Very low	34.2	Very low	107.6 Å²	107.6	147.4 Å²	147.4	75%	0.752	76%	0.756	S	S	*	*			trans	29.5	103.2	158	58	0	0	0	0	112.8
1614	E	30.4	Very low	35.9	Very low	182 Å²	182	143.8 Å²	143.8	85%	0.85	73%	0.73	S	S	*	*				-169	128.6	113.4	-87.1	176.5	174.9	0	0	109.3	I1616	E1614-I1616 PolarHBondContact O-N 3.08Å; E1614-I1616 VanDerWaalsContact O-N 3.13Å
1615	S	28.5	Very low	37.7	Very low	118.4 Å²	118.4	138.8 Å²	138.8	83%	0.828	72%	0.716	S	S	*	*			trans	-46.5	108.5	175.7	50.2	0	0	0	0	113.7	P1617	S1615-P1617 WeakPolarHBondContact O-CD 3.49Å
1616	I	31.8	Very low	39.8	Very low	153 Å²	153	132.8 Å²	132.8	79%	0.785	69%	0.685	S	S	*	*			trans	-102.1	127.1	159	-57.6	171.6	0	0	0	106.1	E1614 D1618	E1614-I1616 PolarHBondContact O-N 3.08Å; E1614-I1616 VanDerWaalsContact O-N 3.13Å; I1616-D1618 PolarHBondContact O-N 3.27Å
1617	P	33.2	Very low	42.1	Very low	103.8 Å²	103.8	129.6 Å²	129.6	67%	0.674	66%	0.662	S	S	*	*			trans	-65.9	145.6	-179.6	3.5	4.3	0	0	0	110.7	S1615 D1619	S1615-P1617 WeakPolarHBondContact O-CD 3.49Å; P1617-D1619 VanDerWaalsContact C-N 3.32Å; P1617-D1619 PolarHBondContact O-N 3.23Å; P1617-D1619 VanDerWaalsContact O-N 3.1Å
1618	D	33.5	Very low	44.6	Very low	150.6 Å²	150.6	124.3 Å²	124.3	81%	0.805	63%	0.633	S	S	*	*			trans	-59.7	91.7	176.2	-74.8	-47.4	0	0	0	111.3	I1616 K1620	I1616-D1618 PolarHBondContact O-N 3.27Å; D1618-K1620 VanDerWaalsContact C-N 3.25Å; D1618-K1620 HydrophobicContact CB-CG 4.15Å; D1618-K1620 PolarHBondContact O-N 3.13Å
1619	D	36.1	Very low	46.9	Very low	145.2 Å²	145.2	120 Å²	120	78%	0.776	62%	0.616	S	S	*	*			trans	-83.2	94.7	167.3	-78.7	-26.9	0	0	0	109	P1617 I1621	P1617-D1619 VanDerWaalsContact C-N 3.32Å; P1617-D1619 PolarHBondContact O-N 3.23Å; P1617-D1619 VanDerWaalsContact O-N 3.1Å; D1619-I1621 PolarHBondContact O-N 3.1Å; D1619-I1621 VanDerWaalsContact O-N 3.1Å
1620	K	43.5	Very low	49.3	Very low	148.4 Å²	148.4	108.6 Å²	108.6	65%	0.645	57%	0.574	S	S	*	*			trans	-80.6	107.6	171.7	-73.9	-178.5	179.6	177.1	0	108.6	D1618 H1622	D1618-K1620 VanDerWaalsContact C-N 3.25Å; D1618-K1620 HydrophobicContact CB-CG 4.15Å; D1618-K1620 PolarHBondContact O-N 3.13Å; K1620-H1622 PolarHBondContact O-CD2 3.05Å; K1620-H1622 PolarHBondContact O-N 3.15Å
1621	I	49.4	Very low	51.8	Low	88 Å²	88	103.9 Å²	103.9	45%	0.451	54%	0.535	S	S	.	.			trans	-60.7	117.1	172.1	-58.8	164.7	0	0	0	108.8	E1457 F1598 D1619 L1623	E1457-I1621 VanDerWaalsContact OE2-CA 3.26Å; E1457-I1621 WeakPolarHBondContact OE2-CA 3.4Å; E1457-I1621 WeakPolarHBondContact OE2-CG2 3.43Å; F1598-I1621 HydrophobicContact CB-CD1 4.39Å; D1619-I1621 PolarHBondContact O-N 3.1Å; D1619-I1621 VanDerWaalsContact O-N 3.1Å; I1621-L1623 HydrophobicContact CG2-CD2 4.4Å; I1621-L1623 HydrophobicContact CG2-CG 4.34Å; I1621-L1623 PolarHBondContact O-N 2.98Å
1622	H	54.3	Low	54.5	Low	125.6 Å²	125.6	94.7 Å²	94.7	58%	0.581	50%	0.495	S	S	*	.			trans	-91.4	100.4	176.8	-82.1	-67.4	0	0	0	109.7	E1457 E1595 K1620	E1457-H1622 WeakPolarHBondContact OE1-CA 3.49Å; E1457-H1622 PolarHBondContact OE1-N 3.08Å; E1595-H1622 IonicContact OE1-CE1 2.7Å; E1595-H1622 IonicContact OE1-ND1 3.48Å; E1595-H1622 PolarHBondContact OE1-ND1 3.1Å; E1595-H1622 VanDerWaalsContact OE1-ND1 3.12Å; E1595-H1622 IonicContact OE2-CE1 3.25Å; E1595-H1622 IonicContact OE2-ND1 3.14Å; K1620-H1622 PolarHBondContact O-CD2 3.05Å; K1620-H1622 PolarHBondContact O-N 3.15Å
1623	L	62	Low	56.9	Low	56.8 Å²	56.8	85.3 Å²	85.3	30%	0.297	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-64.4	143.5	175.1	-66.7	168.4	0	0	0	111.6	W1449 L1450 Y1596 I1621 T1625	W1449-L1623 HydrophobicContact CH2-CB 4.28Å; W1449-L1623 HydrophobicContact CH2-CD1 3.99Å; W1449-L1623 HydrophobicContact CH2-CD2 4.27Å; W1449-L1623 HydrophobicContact CH2-CG 4.22Å; W1449-L1623 HydrophobicContact CZ2-CB 4.3Å; W1449-L1623 HydrophobicContact CZ3-CD1 4.4Å; W1449-L1623 HydrophobicContact CZ3-CD2 4.27Å; L1450-L1623 HydrophobicContact CD2-CD2 4.2Å; Y1596-L1623 HydrophobicContact CD1-CD1 4.1Å; Y1596-L1623 HydrophobicContact CD2-CD1 3.61Å; Y1596-L1623 HydrophobicContact CE2-CD1 3.93Å; Y1596-L1623 WeakPolarHBondContact O-CD1 3.41Å; I1621-L1623 HydrophobicContact CG2-CD2 4.4Å; I1621-L1623 HydrophobicContact CG2-CG 4.34Å; I1621-L1623 PolarHBondContact O-N 2.98Å; L1623-T1625 PolarHBondContact O-N 3.31Å
1624	K	65.6	Low	59.5	Low	46 Å²	46	80.2 Å²	80.2	20%	0.2	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-63.8	131.5	-179.8	-170.5	173	-173.4	167.2	0	110.5	W1449 E1452 S1453 E1456 V1626 T1630	W1449-K1624 WeakPolarHBondContact CZ2-O 3.28Å; W1449-K1624 PolarHBondContact NE1-O 3.32Å; E1452-K1624 HydrophobicContact CB-CD 4.39Å; E1452-K1624 IonicContact OE2-NZ 3.41Å; E1452-K1624 PolarHBondContact OE2-NZ 3.17Å; S1453-K1624 VanDerWaalsContact OG-CB 3.31Å; S1453-K1624 WeakPolarHBondContact OG-CB 3.34Å; S1453-K1624 PolarHBondContact OG-N 3.07Å; S1453-K1624 VanDerWaalsContact OG-N 3.12Å; E1456-K1624 WeakPolarHBondContact OE1-CD 3.37Å; E1456-K1624 WeakPolarHBondContact OE1-CE 3.26Å; E1456-K1624 IonicContact OE1-NZ 3.12Å; E1456-K1624 PolarHBondContact OE1-NZ 3.29Å; E1456-K1624 IonicContact OE2-NZ 3.25Å; K1624-V1626 PolarHBondContact O-N 3.19Å; K1624-T1630 HydrophobicContact CD-CG2 4.23Å; K1624-T1630 HydrophobicContact CG-CG2 4.39Å
1625	T	68.1	Low	61.9	Low	89.8 Å²	89.8	71.6 Å²	71.6	55%	0.551	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-62.3	126.5	-179.5	49.8	0	0	0	0	111.2	L1623 T1627 T1630	L1623-T1625 PolarHBondContact O-N 3.31Å; T1625-T1627 PolarHBondContact O-N 3.18Å; T1625-T1627 VanDerWaalsContact O-N 3.11Å; T1625-T1630 WeakPolarHBondContact O-CG2 3.3Å; T1625-T1630 PolarHBondContact O-OG1 3.18Å
1626	V	73.2	Confident	64.3	Low	23.4 Å²	23.4	66.1 Å²	66.1	14%	0.142	35%	0.346	C	S	.	.			trans	-71.8	103.3	179.4	-175.5	0	0	0	0	109.9	E1421 R1424 I1425 W1449 K1624 I1631	E1421-V1626 HydrophobicContact CB-CG2 4.41Å; E1421-V1626 WeakPolarHBondContact OE2-CG2 3.42Å; E1421-V1626 PolarHBondContact OE2-N 3.29Å; R1424-V1626 HydrophobicContact CB-CB 4.33Å; R1424-V1626 HydrophobicContact CB-CG1 4.33Å; R1424-V1626 HydrophobicContact CB-CG2 4.38Å; I1425-V1626 HydrophobicContact CB-CG1 4.32Å; I1425-V1626 HydrophobicContact CB-CG2 3.89Å; I1425-V1626 HydrophobicContact CD1-CG1 4.04Å; I1425-V1626 HydrophobicContact CD1-CG2 4.34Å; W1449-V1626 HydrophobicContact CZ2-CG2 3.82Å; K1624-V1626 PolarHBondContact O-N 3.19Å; V1626-I1631 HydrophobicContact CG1-CD1 3.59Å; V1626-I1631 HydrophobicContact CG1-CG1 3.98Å
1627	T	76.6	Confident	66.3	Low	56.2 Å²	56.2	60 Å²	60	35%	0.345	32%	0.317	S	S	.	.			trans	-112.2	163.1	172.6	65.1	0	0	0	0	110.7	T1625 Q1629 T1630 I1631	T1625-T1627 PolarHBondContact O-N 3.18Å; T1625-T1627 VanDerWaalsContact O-N 3.11Å; T1627-Q1629 PolarHBondContact O-N 2.97Å; T1627-T1630 WeakPolarHBondContact CA-OG1 3.41Å; T1627-T1630 PolarHBondContact N-OG1 3.11Å; T1627-T1630 PolarHBondContact O-N 3.22Å; T1627-T1630 VanDerWaalsContact O-N 3.16Å; T1627-T1630 PolarHBondContact O-OG1 3.06Å; T1627-T1630 WeakPolarHBondContact OG1-CG2 3.3Å; T1627-T1630 PolarHBondContact OG1-N 2.95Å; T1627-T1630 VanDerWaalsContact OG1-N 3.14Å; T1627-T1630 PolarHBondContact OG1-OG1 3.09Å; T1627-T1630 VanDerWaalsContact OG1-OG1 3.05Å; T1627-I1631 WeakPolarHBondContact O-CG1 3.24Å; T1627-I1631 PolarHBondContact O-N 3.11Å; T1627-I1631 VanDerWaalsContact O-N 3.11Å
1628	L	79.4	Confident	68.1	Low	44.4 Å²	44.4	59.5 Å²	59.5	23%	0.232	30%	0.304	C	S	.	.	H	α-helix	trans	-55.7	-37.8	174.7	-171.7	86.1	0	0	0	111.4	C1432 Y1578 F1582 I1631 H1632	C1432-L1628 VanDerWaalsContact SG-CD1 3.56Å; Y1578-L1628 HydrophobicContact CE2-CD1 4.21Å; Y1578-L1628 WeakPolarHBondContact OH-CD1 3.31Å; F1582-L1628 HydrophobicContact CB-CD1 4.41Å; F1582-L1628 HydrophobicContact CD1-CB 3.87Å; F1582-L1628 HydrophobicContact CD1-CD1 4Å; F1582-L1628 HydrophobicContact CD1-CG 4.41Å; F1582-L1628 HydrophobicContact CD2-CD1 4.01Å; F1582-L1628 VanDerWaalsContact CE1-CA 3.48Å; F1582-L1628 HydrophobicContact CE1-CB 3.99Å; F1582-L1628 HydrophobicContact CE1-CD1 4.01Å; F1582-L1628 HydrophobicContact CE1-CG 4.4Å; F1582-L1628 HydrophobicContact CE2-CD1 4.01Å; F1582-L1628 HydrophobicContact CG-CB 4.33Å; F1582-L1628 HydrophobicContact CG-CD1 4Å; F1582-L1628 HydrophobicContact CZ-CD1 4Å; L1628-I1631 PolarHBondContact O-N 3.36Å; L1628-H1632 PolarHBondContact O-CD2 3.09Å; L1628-H1632 VanDerWaalsContact O-CD2 3.28Å; L1628-H1632 PolarHBondContact O-N 3.2Å; L1628-H1632 VanDerWaalsContact O-N 3.1Å
1629	Q	78.3	Confident	69.8	Low	112.6 Å²	112.6	53.5 Å²	53.5	53%	0.526	27%	0.272	S	S	.	.	H	α-helix	trans	-65.6	-44	178	-102.9	175.4	-10.8	0	0	112.2	T1627 I1631 H1632 N1633 A1652	T1627-Q1629 PolarHBondContact O-N 2.97Å; Q1629-I1631 VanDerWaalsContact C-N 3.33Å; Q1629-I1631 PolarHBondContact O-N 3.2Å; Q1629-H1632 PolarHBondContact O-N 3.15Å; Q1629-N1633 WeakPolarHBondContact O-CB 3.4Å; Q1629-N1633 PolarHBondContact O-N 3.08Å; Q1629-N1633 PolarHBondContact O-ND2 3.37Å; Q1629-N1633 VanDerWaalsContact O-ND2 3.14Å; Q1629-A1652 HydrophobicContact CG-CB 4.47Å; Q1629-A1652 WeakPolarHBondContact CG-O 3.25Å; Q1629-A1652 PolarHBondContact NE2-O 3.36Å
1630	T	78	Confident	71.2	Confident	11.2 Å²	11.2	55 Å²	55	7%	0.069	27%	0.267	C	S	.	.	H	α-helix	trans	-63.5	-40.5	177.8	52.3	0	0	0	0	112.1	K1624 T1625 T1627 N1633 I1634	K1624-T1630 HydrophobicContact CD-CG2 4.23Å; K1624-T1630 HydrophobicContact CG-CG2 4.39Å; T1625-T1630 WeakPolarHBondContact O-CG2 3.3Å; T1625-T1630 PolarHBondContact O-OG1 3.18Å; T1627-T1630 WeakPolarHBondContact CA-OG1 3.41Å; T1627-T1630 PolarHBondContact N-OG1 3.11Å; T1627-T1630 PolarHBondContact O-N 3.22Å; T1627-T1630 VanDerWaalsContact O-N 3.16Å; T1627-T1630 PolarHBondContact O-OG1 3.06Å; T1627-T1630 WeakPolarHBondContact OG1-CG2 3.3Å; T1627-T1630 PolarHBondContact OG1-N 2.95Å; T1627-T1630 VanDerWaalsContact OG1-N 3.14Å; T1627-T1630 PolarHBondContact OG1-OG1 3.09Å; T1627-T1630 VanDerWaalsContact OG1-OG1 3.05Å; T1630-N1633 WeakPolarHBondContact O-CB 3.4Å; T1630-N1633 PolarHBondContact O-N 3.06Å; T1630-I1634 VanDerWaalsContact O-CD1 3.27Å; T1630-I1634 WeakPolarHBondContact O-CD1 3.36Å; T1630-I1634 VanDerWaalsContact O-CG1 3.3Å; T1630-I1634 WeakPolarHBondContact O-CG1 3.42Å; T1630-I1634 PolarHBondContact O-N 3.08Å; T1630-I1634 VanDerWaalsContact O-N 3.1Å
1631	I	82.2	Confident	72.3	Confident	0.2 Å²	0.2	49.1 Å²	49.1	0%	0.001	24%	0.242	C	C	.	.	H	α-helix	trans	-64.9	-47.3	179	-70.2	164.4	0	0	0	110.7	I1425 G1428 L1429 C1432 F1582 V1626 T1627 L1628 Q1629 N1633 I1634 L1635	I1425-I1631 HydrophobicContact CD1-CD1 4.31Å; I1425-I1631 HydrophobicContact CD1-CG1 3.78Å; G1428-I1631 VanDerWaalsContact CA-CD1 3.47Å; L1429-I1631 HydrophobicContact CD2-CG2 4.15Å; L1429-I1631 HydrophobicContact CG-CG2 4.38Å; C1432-I1631 HydrophobicContact CB-CG2 3.7Å; F1582-I1631 HydrophobicContact CE1-CD1 3.67Å; F1582-I1631 HydrophobicContact CZ-CD1 3.54Å; F1582-I1631 VanDerWaalsContact CZ-CD1 3.46Å; V1626-I1631 HydrophobicContact CG1-CD1 3.59Å; V1626-I1631 HydrophobicContact CG1-CG1 3.98Å; T1627-I1631 WeakPolarHBondContact O-CG1 3.24Å; T1627-I1631 PolarHBondContact O-N 3.11Å; T1627-I1631 VanDerWaalsContact O-N 3.11Å; L1628-I1631 PolarHBondContact O-N 3.36Å; Q1629-I1631 VanDerWaalsContact C-N 3.33Å; Q1629-I1631 PolarHBondContact O-N 3.2Å; I1631-N1633 VanDerWaalsContact C-N 3.32Å; I1631-N1633 PolarHBondContact O-N 3.06Å; I1631-I1634 PolarHBondContact O-N 3.19Å; I1631-L1635 HydrophobicContact CG2-CD1 3.88Å; I1631-L1635 HydrophobicContact CG2-CG 4.39Å; I1631-L1635 WeakPolarHBondContact O-CB 3.31Å; I1631-L1635 VanDerWaalsContact O-CG 3.29Å; I1631-L1635 WeakPolarHBondContact O-CG 3.31Å; I1631-L1635 PolarHBondContact O-N 3.1Å
1632	H	83	Confident	73	Confident	3.8 Å²	3.8	46.2 Å²	46.2	2%	0.018	23%	0.227	C	C	.	.	H	α-helix	trans	-66.2	-31	177.7	-79.5	-60.3	0	0	0	112.9	L1628 Q1629 L1635 A1636 Y1647 H1648 H1651 A1652	L1628-H1632 PolarHBondContact O-CD2 3.09Å; L1628-H1632 VanDerWaalsContact O-CD2 3.28Å; L1628-H1632 PolarHBondContact O-N 3.2Å; L1628-H1632 VanDerWaalsContact O-N 3.1Å; Q1629-H1632 PolarHBondContact O-N 3.15Å; H1632-L1635 PolarHBondContact O-N 2.77Å; H1632-A1636 VanDerWaalsContact O-CB 3.27Å; H1632-A1636 WeakPolarHBondContact O-CB 3.4Å; H1632-A1636 PolarHBondContact O-N 3.17Å; H1632-Y1647 AromaticContact CE1-CE1 3.88Å; H1632-H1648 WeakPolarHBondContact CB-O 3.33Å; H1632-H1648 AromaticContact CE1-CE1 3.99Å; H1632-H1648 AromaticContact CE1-ND1 3.55Å; H1632-H1648 PolarHBondContact CE1-ND1 3.41Å; H1632-H1648 AromaticContact ND1-CE1 3.79Å; H1632-H1648 AromaticContact ND1-CG 3.89Å; H1632-H1648 AromaticContact ND1-ND1 2.99Å; H1632-H1648 PolarHBondContact ND1-ND1 3.06Å; H1632-H1651 HydrophobicContact CB-CB 4.25Å; H1632-H1651 WeakPolarHBondContact CD2-CB 3.29Å; H1632-H1651 AromaticContact CE1-CG 3.97Å; H1632-H1651 WeakPolarHBondContact ND1-CB 3.28Å; H1632-A1652 HydrophobicContact CB-CB 4.01Å
1633	N	80.6	Confident	73.6	Confident	23.6 Å²	23.6	43.1 Å²	43.1	13%	0.126	21%	0.212	C	C	.	.	H	α-helix	trans	-61.6	-48	171.2	-96.3	-23.5	0	0	0	112.3	E1452 Q1629 T1630 I1631 L1635 A1636 S1637 A1652 R1654	E1452-N1633 PolarHBondContact OE1-ND2 3.31Å; Q1629-N1633 WeakPolarHBondContact O-CB 3.4Å; Q1629-N1633 PolarHBondContact O-N 3.08Å; Q1629-N1633 PolarHBondContact O-ND2 3.37Å; Q1629-N1633 VanDerWaalsContact O-ND2 3.14Å; T1630-N1633 WeakPolarHBondContact O-CB 3.4Å; T1630-N1633 PolarHBondContact O-N 3.06Å; I1631-N1633 VanDerWaalsContact C-N 3.32Å; I1631-N1633 PolarHBondContact O-N 3.06Å; N1633-L1635 VanDerWaalsContact C-N 3.35Å; N1633-L1635 PolarHBondContact O-N 2.7Å; N1633-A1636 PolarHBondContact O-N 3.27Å; N1633-S1637 WeakPolarHBondContact O-CB 3.35Å; N1633-S1637 PolarHBondContact O-N 3.24Å; N1633-S1637 PolarHBondContact O-OG 3.08Å; N1633-S1637 VanDerWaalsContact O-OG 3.08Å; N1633-A1652 HydrophobicContact CB-CB 4.23Å; N1633-A1652 WeakPolarHBondContact OD1-CB 3.28Å; N1633-R1654 VanDerWaalsContact CG-NH2 3.3Å; N1633-R1654 PolarHBondContact ND2-NH2 2.96Å; N1633-R1654 VanDerWaalsContact ND2-NH2 3.16Å; N1633-R1654 WeakPolarHBondContact OD1-CD 3.28Å; N1633-R1654 PolarHBondContact OD1-NE 3Å; N1633-R1654 PolarHBondContact OD1-NH2 3.25Å
1634	I	81.5	Confident	74.2	Confident	0.8 Å²	0.8	40.6 Å²	40.6	0%	0.004	20%	0.199	C	C	.	.	H	α-helix	trans	-64.9	-41.9	179.4	-64.4	154.7	0	0	0	110.9	I1425 L1429 L1445 E1448 W1449 T1630 I1631 A1636 S1637 K1638	I1425-I1634 HydrophobicContact CD1-CD1 4.04Å; L1429-I1634 HydrophobicContact CD2-CG2 4.29Å; L1445-I1634 HydrophobicContact CB-CG2 4.28Å; L1445-I1634 HydrophobicContact CD2-CG2 3.84Å; E1448-I1634 HydrophobicContact CB-CG2 4.38Å; W1449-I1634 HydrophobicContact CB-CD1 3.7Å; W1449-I1634 HydrophobicContact CG-CD1 4.08Å; T1630-I1634 VanDerWaalsContact O-CD1 3.27Å; T1630-I1634 WeakPolarHBondContact O-CD1 3.36Å; T1630-I1634 VanDerWaalsContact O-CG1 3.3Å; T1630-I1634 WeakPolarHBondContact O-CG1 3.42Å; T1630-I1634 PolarHBondContact O-N 3.08Å; T1630-I1634 VanDerWaalsContact O-N 3.1Å; I1631-I1634 PolarHBondContact O-N 3.19Å; I1634-A1636 VanDerWaalsContact C-N 3.34Å; I1634-A1636 PolarHBondContact O-N 3.29Å; I1634-S1637 PolarHBondContact O-N 3.18Å; I1634-S1637 PolarHBondContact O-OG 3Å; I1634-S1637 VanDerWaalsContact O-OG 3.07Å; I1634-K1638 PolarHBondContact O-N 3.31Å; I1634-K1638 VanDerWaalsContact O-N 3.15Å
1635	L	82.2	Confident	74.9	Confident	1.4 Å²	1.4	38.7 Å²	38.7	1%	0.007	19%	0.191	C	C	.	.	H	α-helix	trans	-63.6	-41.3	175.8	-68.5	170.9	0	0	0	111.4	L1429 C1432 L1445 I1631 H1632 N1633 S1637 L1639 H1648	L1429-L1635 HydrophobicContact CD2-CD1 4.48Å; L1429-L1635 HydrophobicContact CD2-CD2 3.82Å; L1429-L1635 HydrophobicContact CD2-CG 3.98Å; C1432-L1635 HydrophobicContact CB-CD1 3.73Å; L1445-L1635 HydrophobicContact CD1-CD2 4.04Å; L1445-L1635 HydrophobicContact CD2-CD2 4.37Å; I1631-L1635 HydrophobicContact CG2-CD1 3.88Å; I1631-L1635 HydrophobicContact CG2-CG 4.39Å; I1631-L1635 WeakPolarHBondContact O-CB 3.31Å; I1631-L1635 VanDerWaalsContact O-CG 3.29Å; I1631-L1635 WeakPolarHBondContact O-CG 3.31Å; I1631-L1635 PolarHBondContact O-N 3.1Å; H1632-L1635 PolarHBondContact O-N 2.77Å; N1633-L1635 VanDerWaalsContact C-N 3.35Å; N1633-L1635 PolarHBondContact O-N 2.7Å; L1635-S1637 PolarHBondContact O-N 3.43Å; L1635-L1639 HydrophobicContact CB-CD1 3.93Å; L1635-L1639 HydrophobicContact CD2-CD1 3.89Å; L1635-L1639 VanDerWaalsContact CD2-CD1 3.47Å; L1635-L1639 HydrophobicContact CD2-CD2 4.43Å; L1635-L1639 HydrophobicContact CG-CD1 4.08Å; L1635-L1639 WeakPolarHBondContact O-CB 3.47Å; L1635-L1639 PolarHBondContact O-N 3.09Å; L1635-L1639 VanDerWaalsContact O-N 3.11Å; L1635-H1648 HydrophobicContact CB-CB 4.4Å
1636	A	77.3	Confident	75.5	Confident	2.8 Å²	2.8	34.8 Å²	34.8	2%	0.023	17%	0.166	C	C	.	.	H	α-helix	trans	-67.1	-39.9	178	0	0	0	0	0	113	H1632 N1633 I1634 L1645 H1648 L1649	H1632-A1636 VanDerWaalsContact O-CB 3.27Å; H1632-A1636 WeakPolarHBondContact O-CB 3.4Å; H1632-A1636 PolarHBondContact O-N 3.17Å; N1633-A1636 PolarHBondContact O-N 3.27Å; I1634-A1636 VanDerWaalsContact C-N 3.34Å; I1634-A1636 PolarHBondContact O-N 3.29Å; A1636-L1645 HydrophobicContact CB-CD1 4.05Å; A1636-L1645 VanDerWaalsContact O-CD1 3.25Å; A1636-L1645 WeakPolarHBondContact O-CD1 3.36Å; A1636-H1648 HydrophobicContact CB-CB 3.84Å; A1636-L1649 HydrophobicContact CB-CD2 3.66Å; A1636-L1649 HydrophobicContact CB-CG 3.84Å
1637	S	73.7	Confident	75.8	Confident	26 Å²	26	36.5 Å²	36.5	18%	0.182	17%	0.171	C	C	.	.	H	α-helix	trans	-77.6	-28.7	-173.8	59.3	0	0	0	0	113.7	F1494 N1633 I1634 L1635	F1494-S1637 WeakPolarHBondContact CZ-O 3.47Å; N1633-S1637 WeakPolarHBondContact O-CB 3.35Å; N1633-S1637 PolarHBondContact O-N 3.24Å; N1633-S1637 PolarHBondContact O-OG 3.08Å; N1633-S1637 VanDerWaalsContact O-OG 3.08Å; I1634-S1637 PolarHBondContact O-N 3.18Å; I1634-S1637 PolarHBondContact O-OG 3Å; I1634-S1637 VanDerWaalsContact O-OG 3.07Å; L1635-S1637 PolarHBondContact O-N 3.43Å
1638	K	72.1	Confident	76.1	Confident	92.2 Å²	92.2	34 Å²	34	40%	0.401	16%	0.155	S	C	.	.	H	α-helix	trans	-128.1	-21.2	-168.1	-61.9	-66.9	175.1	152	0	116	L1445 E1448 I1634 R1640	L1445-K1638 HydrophobicContact CD2-CB 4.09Å; E1448-K1638 HydrophobicContact CB-CG 4.31Å; E1448-K1638 VanDerWaalsContact CD-CE 3.48Å; E1448-K1638 HydrophobicContact CG-CB 4.42Å; E1448-K1638 HydrophobicContact CG-CD 4.11Å; E1448-K1638 HydrophobicContact CG-CG 3.89Å; E1448-K1638 WeakPolarHBondContact OE1-CD 3.33Å; E1448-K1638 VanDerWaalsContact OE1-CE 3.26Å; E1448-K1638 WeakPolarHBondContact OE1-CE 3.34Å; E1448-K1638 IonicContact OE1-NZ 3.24Å; E1448-K1638 PolarHBondContact OE1-NZ 3.39Å; E1448-K1638 WeakPolarHBondContact OE2-CE 3.32Å; E1448-K1638 IonicContact OE2-NZ 3.66Å; E1448-K1638 PolarHBondContact OE2-NZ 3Å; I1634-K1638 PolarHBondContact O-N 3.31Å; I1634-K1638 VanDerWaalsContact O-N 3.15Å; K1638-R1640 PolarHBondContact O-N 3.13Å; K1638-R1640 VanDerWaalsContact O-N 3.16Å
1639	L	69.8	Low	76.2	Confident	24.4 Å²	24.4	32 Å²	32	13%	0.128	15%	0.145	C	C	.	.			trans	-69.5	123.7	177	-145.8	97.2	0	0	0	109	L1437 L1445 L1635 N1641	L1437-L1639 HydrophobicContact CD2-CD1 3.68Å; L1437-L1639 VanDerWaalsContact CD2-CD1 3.49Å; L1437-L1639 HydrophobicContact CD2-CD2 4.15Å; L1437-L1639 HydrophobicContact CD2-CG 4.43Å; L1445-L1639 HydrophobicContact CD1-CD1 3.93Å; L1445-L1639 HydrophobicContact CD2-CD1 4.26Å; L1635-L1639 HydrophobicContact CB-CD1 3.93Å; L1635-L1639 HydrophobicContact CD2-CD1 3.89Å; L1635-L1639 VanDerWaalsContact CD2-CD1 3.47Å; L1635-L1639 HydrophobicContact CD2-CD2 4.43Å; L1635-L1639 HydrophobicContact CG-CD1 4.08Å; L1635-L1639 WeakPolarHBondContact O-CB 3.47Å; L1635-L1639 PolarHBondContact O-N 3.09Å; L1635-L1639 VanDerWaalsContact O-N 3.11Å; L1639-N1641 HydrophobicContact CD2-CB 4.02Å; L1639-N1641 HydrophobicContact CG-CB 4.19Å; L1639-N1641 PolarHBondContact O-N 3.08Å
1640	R	63.5	Low	76.2	Confident	176.8 Å²	176.8	28.7 Å²	28.7	67%	0.667	13%	0.129	S	C	*	.	S	Bend	trans	-73.1	44.9	-177.3	-64	-179.8	176.2	170.5	-2.1	113	N1498 K1638	N1498-R1640 PolarHBondContact O-NH2 2.89Å; K1638-R1640 PolarHBondContact O-N 3.13Å; K1638-R1640 VanDerWaalsContact O-N 3.16Å
1641	N	66.9	Low	76.1	Confident	24.8 Å²	24.8	31.7 Å²	31.7	13%	0.133	14%	0.142	C	C	.	.			trans	-135.9	90	-173.9	-174.8	10.7	0	0	0	111	Q1435 L1639 K1643 D1644 L1645	Q1435-N1641 PolarHBondContact NE2-ND2 3.01Å; Q1435-N1641 VanDerWaalsContact NE2-ND2 3.17Å; Q1435-N1641 PolarHBondContact NE2-OD1 2.85Å; Q1435-N1641 PolarHBondContact OE1-ND2 2.89Å; L1639-N1641 HydrophobicContact CD2-CB 4.02Å; L1639-N1641 HydrophobicContact CG-CB 4.19Å; L1639-N1641 PolarHBondContact O-N 3.08Å; N1641-K1643 PolarHBondContact O-N 3.16Å; N1641-K1643 VanDerWaalsContact O-N 3.12Å; N1641-K1643 VanDerWaalsContact OD1-CB 3.27Å; N1641-K1643 WeakPolarHBondContact OD1-CB 3.24Å; N1641-K1643 PolarHBondContact OD1-N 3.23Å; N1641-K1643 VanDerWaalsContact OD1-N 3.12Å; N1641-D1644 PolarHBondContact ND2-OD2 2.87Å; N1641-D1644 VanDerWaalsContact ND2-OD2 3.09Å; N1641-D1644 PolarHBondContact O-N 3.07Å; N1641-D1644 VanDerWaalsContact O-N 3.15Å; N1641-L1645 PolarHBondContact O-N 3.15Å
1642	M	65.7	Low	75.9	Confident	26.6 Å²	26.6	31.9 Å²	31.9	13%	0.131	14%	0.144	C	C	.	.	H	α-helix	trans	-57.8	-23.4	177.6	-69.1	-63.9	-81.5	0	0	113.4	N1491 F1494 D1644 L1645 F1667 Q1671	N1491-M1642 WeakPolarHBondContact OD1-CE 3.4Å; F1494-M1642 HydrophobicContact CD2-SD 4.31Å; F1494-M1642 HydrophobicContact CE2-SD 4.46Å; F1494-M1642 HydrophobicContact CG-SD 4.42Å; M1642-D1644 VanDerWaalsContact C-N 3.34Å; M1642-D1644 PolarHBondContact O-N 3.3Å; M1642-L1645 HydrophobicContact CE-CD2 4.19Å; M1642-L1645 WeakPolarHBondContact O-CB 3.28Å; M1642-L1645 PolarHBondContact O-N 3.05Å; M1642-L1645 HydrophobicContact SD-CD2 3.87Å; M1642-F1667 HydrophobicContact CE-CD2 3.67Å; M1642-F1667 VanDerWaalsContact CE-CD2 3.49Å; M1642-F1667 HydrophobicContact CE-CE2 3.56Å; M1642-F1667 VanDerWaalsContact CE-CE2 3.41Å; M1642-F1667 HydrophobicContact SD-CE2 4.42Å; M1642-Q1671 PolarHBondContact O-NE2 3.04Å
1643	K	66.9	Low	75.5	Confident	60.6 Å²	60.6	33.9 Å²	33.9	26%	0.263	17%	0.166	S	C	.	.	H	α-helix	trans	-64.5	-38.1	179.8	-173.7	-170.6	177.3	-176.3	0	112.8	N1641 Y1676	N1641-K1643 PolarHBondContact O-N 3.16Å; N1641-K1643 VanDerWaalsContact O-N 3.12Å; N1641-K1643 VanDerWaalsContact OD1-CB 3.27Å; N1641-K1643 WeakPolarHBondContact OD1-CB 3.24Å; N1641-K1643 PolarHBondContact OD1-N 3.23Å; N1641-K1643 VanDerWaalsContact OD1-N 3.12Å; K1643-Y1676 HydrophobicContact CB-CD1 4.43Å; K1643-Y1676 HydrophobicContact CB-CD2 4.33Å; K1643-Y1676 HydrophobicContact CB-CE1 4.26Å; K1643-Y1676 HydrophobicContact CB-CE2 4.08Å; K1643-Y1676 HydrophobicContact CB-CG 4.44Å; K1643-Y1676 HydrophobicContact CD-CD1 4.21Å; K1643-Y1676 HydrophobicContact CD-CE1 3.69Å; K1643-Y1676 HydrophobicContact CD-CE2 4.35Å; K1643-Y1676 HydrophobicContact CG-CD1 4.01Å; K1643-Y1676 HydrophobicContact CG-CD2 4.35Å; K1643-Y1676 HydrophobicContact CG-CE1 3.92Å; K1643-Y1676 HydrophobicContact CG-CE2 4.34Å; K1643-Y1676 HydrophobicContact CG-CG 4.37Å
1644	D	73.6	Confident	75.3	Confident	5.2 Å²	5.2	34.7 Å²	34.7	3%	0.028	17%	0.167	C	C	.	.	H	α-helix	trans	-103.9	3.6	-175.8	-66.9	-50.5	0	0	0	112.4	R1434 Q1435 N1641 M1642 I1646 Y1647 H1648	R1434-D1644 WeakPolarHBondContact CD-OD1 3.26Å; R1434-D1644 IonicContact CZ-OD1 3.28Å; R1434-D1644 IonicContact NE-OD1 3.05Å; R1434-D1644 IonicContact NH1-OD1 3.26Å; R1434-D1644 PolarHBondContact NH1-OD1 3.25Å; Q1435-D1644 PolarHBondContact NE2-OD2 3.17Å; N1641-D1644 PolarHBondContact ND2-OD2 2.87Å; N1641-D1644 VanDerWaalsContact ND2-OD2 3.09Å; N1641-D1644 PolarHBondContact O-N 3.07Å; N1641-D1644 VanDerWaalsContact O-N 3.15Å; M1642-D1644 VanDerWaalsContact C-N 3.34Å; M1642-D1644 PolarHBondContact O-N 3.3Å; D1644-I1646 PolarHBondContact O-N 3.25Å; D1644-Y1647 WeakPolarHBondContact O-CB 3.35Å; D1644-Y1647 PolarHBondContact O-N 3.1Å; D1644-H1648 WeakPolarHBondContact O-CB 3.48Å; D1644-H1648 PolarHBondContact O-CD2 3.23Å; D1644-H1648 VanDerWaalsContact O-CD2 3.27Å; D1644-H1648 PolarHBondContact O-N 3.08Å
1645	L	80.3	Confident	75	Confident	6 Å²	6	36.5 Å²	36.5	3%	0.031	18%	0.177	C	C	.	.	H	α-helix	trans	-58.7	-50.8	-179.5	179.3	62.7	0	0	0	112.3	W1467 A1636 N1641 M1642 Y1647 H1648 L1649 L1661 F1667	W1467-L1645 HydrophobicContact CH2-CD2 4.08Å; W1467-L1645 HydrophobicContact CZ2-CD1 4.45Å; W1467-L1645 HydrophobicContact CZ2-CD2 4.17Å; A1636-L1645 HydrophobicContact CB-CD1 4.05Å; A1636-L1645 VanDerWaalsContact O-CD1 3.25Å; A1636-L1645 WeakPolarHBondContact O-CD1 3.36Å; N1641-L1645 PolarHBondContact O-N 3.15Å; M1642-L1645 HydrophobicContact CE-CD2 4.19Å; M1642-L1645 WeakPolarHBondContact O-CB 3.28Å; M1642-L1645 PolarHBondContact O-N 3.05Å; M1642-L1645 HydrophobicContact SD-CD2 3.87Å; L1645-Y1647 VanDerWaalsContact C-N 3.29Å; L1645-Y1647 PolarHBondContact O-N 3.13Å; L1645-H1648 PolarHBondContact O-N 3.41Å; L1645-L1649 HydrophobicContact CD1-CD1 3.94Å; L1645-L1649 HydrophobicContact CD1-CG 4.13Å; L1645-L1649 HydrophobicContact CG-CD1 3.94Å; L1645-L1649 HydrophobicContact CG-CG 4.47Å; L1645-L1649 WeakPolarHBondContact O-CB 3.37Å; L1645-L1649 WeakPolarHBondContact O-CG 3.22Å; L1645-L1649 PolarHBondContact O-N 3.28Å; L1645-L1661 HydrophobicContact CD2-CD1 4Å; L1645-L1661 HydrophobicContact CG-CD1 4.35Å; L1645-F1667 HydrophobicContact CD2-CE2 4.15Å
1646	I	80.9	Confident	74.7	Confident	7.6 Å²	7.6	40.1 Å²	40.1	4%	0.039	20%	0.196	C	C	.	.	H	α-helix	trans	-60.4	-41.4	179.1	-61.1	161.3	0	0	0	110.5	D1644 H1648 L1649 H1650 V1658 L1662 F1667 L1680 D1683 Y1687	D1644-I1646 PolarHBondContact O-N 3.25Å; I1646-H1648 PolarHBondContact O-N 2.98Å; I1646-L1649 PolarHBondContact O-N 3.04Å; I1646-H1650 VanDerWaalsContact O-CB 3.25Å; I1646-H1650 WeakPolarHBondContact O-CB 3.39Å; I1646-H1650 PolarHBondContact O-N 2.99Å; I1646-V1658 HydrophobicContact CG2-CG1 3.96Å; I1646-V1658 HydrophobicContact CG2-CG2 4.22Å; I1646-L1662 HydrophobicContact CD1-CD2 3.73Å; I1646-L1662 HydrophobicContact CG1-CD2 4.33Å; I1646-F1667 HydrophobicContact CD1-CE1 3.8Å; I1646-F1667 HydrophobicContact CD1-CZ 3.79Å; I1646-F1667 HydrophobicContact CG1-CE1 4.22Å; I1646-F1667 HydrophobicContact CG1-CZ 3.88Å; I1646-L1680 HydrophobicContact CD1-CD1 4.19Å; I1646-D1683 HydrophobicContact CD1-CB 4.2Å; I1646-D1683 HydrophobicContact CG2-CB 4.04Å; I1646-Y1687 HydrophobicContact CB-CE2 4.42Å; I1646-Y1687 HydrophobicContact CG2-CD2 4.27Å; I1646-Y1687 HydrophobicContact CG2-CE2 3.37Å; I1646-Y1687 WeakPolarHBondContact CG2-OH 3.29Å; I1646-Y1687 PolarHBondContact O-OH 3.49Å
1647	Y	79.5	Confident	74.8	Confident	59.4 Å²	59.4	41.1 Å²	41.1	23%	0.233	20%	0.2	C	C	.	.	H	α-helix	trans	-60.9	-46.9	178.2	171.9	-98.9	0	0	0	111.6	R1434 H1632 D1644 L1645 H1650 H1651	R1434-Y1647 VanDerWaalsContact CD-CD1 3.44Å; R1434-Y1647 VanDerWaalsContact CD-CE1 3.45Å; R1434-Y1647 HydrophobicContact CG-CD1 4.17Å; R1434-Y1647 HydrophobicContact CG-CE1 3.95Å; H1632-Y1647 AromaticContact CE1-CE1 3.88Å; D1644-Y1647 WeakPolarHBondContact O-CB 3.35Å; D1644-Y1647 PolarHBondContact O-N 3.1Å; L1645-Y1647 VanDerWaalsContact C-N 3.29Å; L1645-Y1647 PolarHBondContact O-N 3.13Å; Y1647-H1650 PolarHBondContact O-N 3.31Å; Y1647-H1651 AromaticContact CD2-CD2 3.67Å; Y1647-H1651 AromaticContact CD2-NE2 3.85Å; Y1647-H1651 AromaticContact CE1-CD2 3.77Å; Y1647-H1651 AromaticContact CE2-CD2 3.26Å; Y1647-H1651 WeakPolarHBondContact CE2-CD2 3.28Å; Y1647-H1651 AromaticContact CE2-NE2 3.14Å; Y1647-H1651 WeakPolarHBondContact CE2-NE2 3.38Å; Y1647-H1651 AromaticContact CZ-CD2 3.45Å; Y1647-H1651 VanDerWaalsContact CZ-CD2 3.44Å; Y1647-H1651 AromaticContact CZ-NE2 3.55Å; Y1647-H1651 PolarHBondContact O-CD2 3.02Å; Y1647-H1651 VanDerWaalsContact O-CD2 3.29Å; Y1647-H1651 PolarHBondContact O-N 3.23Å; Y1647-H1651 VanDerWaalsContact O-N 3.14Å; Y1647-H1651 PolarHBondContact OH-NE2 3.16Å
1648	H	82.6	Confident	75	Confident	3.8 Å²	3.8	39.8 Å²	39.8	2%	0.018	19%	0.191	C	C	.	.	H	α-helix	trans	-69.3	-43.4	179	-68.1	-42.7	0	0	0	112.4	C1432 H1632 L1635 A1636 D1644 L1645 I1646 H1650 H1651 A1652	C1432-H1648 PolarHBondContact O-CE1 3.16Å; H1632-H1648 WeakPolarHBondContact CB-O 3.33Å; H1632-H1648 AromaticContact CE1-CE1 3.99Å; H1632-H1648 AromaticContact CE1-ND1 3.55Å; H1632-H1648 PolarHBondContact CE1-ND1 3.41Å; H1632-H1648 AromaticContact ND1-CE1 3.79Å; H1632-H1648 AromaticContact ND1-CG 3.89Å; H1632-H1648 AromaticContact ND1-ND1 2.99Å; H1632-H1648 PolarHBondContact ND1-ND1 3.06Å; L1635-H1648 HydrophobicContact CB-CB 4.4Å; A1636-H1648 HydrophobicContact CB-CB 3.84Å; D1644-H1648 WeakPolarHBondContact O-CB 3.48Å; D1644-H1648 PolarHBondContact O-CD2 3.23Å; D1644-H1648 VanDerWaalsContact O-CD2 3.27Å; D1644-H1648 PolarHBondContact O-N 3.08Å; L1645-H1648 PolarHBondContact O-N 3.41Å; I1646-H1648 PolarHBondContact O-N 2.98Å; H1648-H1650 VanDerWaalsContact C-N 3.32Å; H1648-H1650 PolarHBondContact O-N 3.07Å; H1648-H1651 PolarHBondContact O-N 3.24Å; H1648-A1652 VanDerWaalsContact O-CB 3.28Å; H1648-A1652 WeakPolarHBondContact O-CB 3.38Å; H1648-A1652 PolarHBondContact O-N 3.15Å
1649	L	80.8	Confident	75.4	Confident	1.8 Å²	1.8	35.5 Å²	35.5	1%	0.009	17%	0.173	C	C	.	.	H	α-helix	trans	-61.5	-39.4	175.8	-71.4	172.5	0	0	0	112.6	W1467 A1636 L1645 I1646 A1652 G1653 R1654 E1657 V1658 L1661	W1467-L1649 HydrophobicContact CH2-CD1 4.4Å; W1467-L1649 HydrophobicContact CZ3-CD1 4.34Å; A1636-L1649 HydrophobicContact CB-CD2 3.66Å; A1636-L1649 HydrophobicContact CB-CG 3.84Å; L1645-L1649 HydrophobicContact CD1-CD1 3.94Å; L1645-L1649 HydrophobicContact CD1-CG 4.13Å; L1645-L1649 HydrophobicContact CG-CD1 3.94Å; L1645-L1649 HydrophobicContact CG-CG 4.47Å; L1645-L1649 WeakPolarHBondContact O-CB 3.37Å; L1645-L1649 WeakPolarHBondContact O-CG 3.22Å; L1645-L1649 PolarHBondContact O-N 3.28Å; I1646-L1649 PolarHBondContact O-N 3.04Å; L1649-A1652 WeakPolarHBondContact O-CB 3.38Å; L1649-A1652 PolarHBondContact O-N 3.01Å; L1649-G1653 PolarHBondContact O-N 3.15Å; L1649-R1654 HydrophobicContact CB-CB 4.44Å; L1649-R1654 HydrophobicContact CD2-CB 4.2Å; L1649-R1654 PolarHBondContact O-N 3.06Å; L1649-R1654 VanDerWaalsContact O-N 3.09Å; L1649-E1657 HydrophobicContact CD1-CB 4.35Å; L1649-V1658 HydrophobicContact CB-CG2 3.53Å; L1649-V1658 VanDerWaalsContact CB-CG2 3.49Å; L1649-V1658 HydrophobicContact CD1-CG2 4.47Å; L1649-L1661 HydrophobicContact CD1-CD1 3.4Å; L1649-L1661 VanDerWaalsContact CD1-CD1 3.43Å
1650	H	78.7	Confident	75.9	Confident	42.8 Å²	42.8	34.5 Å²	34.5	20%	0.198	17%	0.167	C	C	.	.	H	α-helix	trans	-62	-49.6	175.9	-179.8	-82.6	0	0	0	111.9	I1646 Y1647 H1648 A1652 G1653 V1658 Y1687 T1690	I1646-H1650 VanDerWaalsContact O-CB 3.25Å; I1646-H1650 WeakPolarHBondContact O-CB 3.39Å; I1646-H1650 PolarHBondContact O-N 2.99Å; Y1647-H1650 PolarHBondContact O-N 3.31Å; H1648-H1650 VanDerWaalsContact C-N 3.32Å; H1648-H1650 PolarHBondContact O-N 3.07Å; H1650-A1652 VanDerWaalsContact C-N 3.27Å; H1650-A1652 PolarHBondContact O-N 3.01Å; H1650-G1653 PolarHBondContact O-N 3Å; H1650-G1653 VanDerWaalsContact O-N 3.09Å; H1650-V1658 HydrophobicContact CB-CG2 4.34Å; H1650-Y1687 HydrophobicContact CB-CE1 3.6Å; H1650-Y1687 AromaticContact CD2-CD1 3.38Å; H1650-Y1687 WeakPolarHBondContact CD2-CD1 3.47Å; H1650-Y1687 AromaticContact CD2-CD2 3.83Å; H1650-Y1687 AromaticContact CD2-CE1 3.23Å; H1650-Y1687 WeakPolarHBondContact CD2-CE1 3.34Å; H1650-Y1687 AromaticContact CG-CE1 3.35Å; H1650-Y1687 AromaticContact ND1-CE1 3.99Å; H1650-Y1687 AromaticContact NE2-CD1 3.77Å; H1650-Y1687 AromaticContact NE2-CE1 3.82Å; H1650-T1690 PolarHBondContact CE1-OG1 3.03Å; H1650-T1690 VanDerWaalsContact NE2-CG2 3.31Å; H1650-T1690 WeakPolarHBondContact NE2-CG2 3.31Å; H1650-T1690 PolarHBondContact NE2-OG1 3.29Å
1651	H	76.3	Confident	76.8	Confident	74.2 Å²	74.2	26.1 Å²	26.1	34%	0.344	14%	0.136	S	C	.	.	H	α-helix	trans	-70.5	-20.4	177.6	-80.3	-72.7	0	0	0	113.9	H1632 Y1647 H1648 G1653	H1632-H1651 HydrophobicContact CB-CB 4.25Å; H1632-H1651 WeakPolarHBondContact CD2-CB 3.29Å; H1632-H1651 AromaticContact CE1-CG 3.97Å; H1632-H1651 WeakPolarHBondContact ND1-CB 3.28Å; Y1647-H1651 AromaticContact CD2-CD2 3.67Å; Y1647-H1651 AromaticContact CD2-NE2 3.85Å; Y1647-H1651 AromaticContact CE1-CD2 3.77Å; Y1647-H1651 AromaticContact CE2-CD2 3.26Å; Y1647-H1651 WeakPolarHBondContact CE2-CD2 3.28Å; Y1647-H1651 AromaticContact CE2-NE2 3.14Å; Y1647-H1651 WeakPolarHBondContact CE2-NE2 3.38Å; Y1647-H1651 AromaticContact CZ-CD2 3.45Å; Y1647-H1651 VanDerWaalsContact CZ-CD2 3.44Å; Y1647-H1651 AromaticContact CZ-NE2 3.55Å; Y1647-H1651 PolarHBondContact O-CD2 3.02Å; Y1647-H1651 VanDerWaalsContact O-CD2 3.29Å; Y1647-H1651 PolarHBondContact O-N 3.23Å; Y1647-H1651 VanDerWaalsContact O-N 3.14Å; Y1647-H1651 PolarHBondContact OH-NE2 3.16Å; H1648-H1651 PolarHBondContact O-N 3.24Å; H1651-G1653 VanDerWaalsContact C-N 3.26Å; H1651-G1653 PolarHBondContact O-N 2.87Å
1652	A	78.7	Confident	77.6	Confident	5.4 Å²	5.4	24.9 Å²	24.9	5%	0.045	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-8.1	170.1	0	0	0	0	0	113.7	Q1629 H1632 N1633 H1648 L1649 H1650 R1654	Q1629-A1652 HydrophobicContact CG-CB 4.47Å; Q1629-A1652 WeakPolarHBondContact CG-O 3.25Å; Q1629-A1652 PolarHBondContact NE2-O 3.36Å; H1632-A1652 HydrophobicContact CB-CB 4.01Å; N1633-A1652 HydrophobicContact CB-CB 4.23Å; N1633-A1652 WeakPolarHBondContact OD1-CB 3.28Å; H1648-A1652 VanDerWaalsContact O-CB 3.28Å; H1648-A1652 WeakPolarHBondContact O-CB 3.38Å; H1648-A1652 PolarHBondContact O-N 3.15Å; L1649-A1652 WeakPolarHBondContact O-CB 3.38Å; L1649-A1652 PolarHBondContact O-N 3.01Å; H1650-A1652 VanDerWaalsContact C-N 3.27Å; H1650-A1652 PolarHBondContact O-N 3.01Å; A1652-R1654 VanDerWaalsContact C-N 3.29Å; A1652-R1654 HydrophobicContact CB-CG 4.36Å; A1652-R1654 PolarHBondContact O-N 3.34Å
1653	G	73.2	Confident	78.4	Confident	46.6 Å²	46.6	24 Å²	24	48%	0.48	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.3	8.5	-176.3	0	0	0	0	0	114.3	L1649 H1650 H1651 L1655	L1649-G1653 PolarHBondContact O-N 3.15Å; H1650-G1653 PolarHBondContact O-N 3Å; H1650-G1653 VanDerWaalsContact O-N 3.09Å; H1651-G1653 VanDerWaalsContact C-N 3.26Å; H1651-G1653 PolarHBondContact O-N 2.87Å; G1653-L1655 VanDerWaalsContact C-N 3.25Å; G1653-L1655 PolarHBondContact O-N 3.14Å
1654	R	76.3	Confident	79.2	Confident	39.2 Å²	39.2	21.2 Å²	21.2	15%	0.148	11%	0.114	C	C	.	.			trans	-82.1	60.9	178.2	-73	-164.1	-162.4	-155.2	4.9	111.3	D1465 N1633 L1649 A1652 N1656 E1657 V1658	D1465-R1654 IonicContact OD2-CZ 3.35Å; D1465-R1654 VanDerWaalsContact OD2-CZ 3.26Å; D1465-R1654 IonicContact OD2-NH1 3.14Å; D1465-R1654 PolarHBondContact OD2-NH1 3.18Å; D1465-R1654 IonicContact OD2-NH2 3.13Å; D1465-R1654 PolarHBondContact OD2-NH2 2.98Å; N1633-R1654 VanDerWaalsContact CG-NH2 3.3Å; N1633-R1654 PolarHBondContact ND2-NH2 2.96Å; N1633-R1654 VanDerWaalsContact ND2-NH2 3.16Å; N1633-R1654 WeakPolarHBondContact OD1-CD 3.28Å; N1633-R1654 PolarHBondContact OD1-NE 3Å; N1633-R1654 PolarHBondContact OD1-NH2 3.25Å; L1649-R1654 HydrophobicContact CB-CB 4.44Å; L1649-R1654 HydrophobicContact CD2-CB 4.2Å; L1649-R1654 PolarHBondContact O-N 3.06Å; L1649-R1654 VanDerWaalsContact O-N 3.09Å; A1652-R1654 VanDerWaalsContact C-N 3.29Å; A1652-R1654 HydrophobicContact CB-CG 4.36Å; A1652-R1654 PolarHBondContact O-N 3.34Å; R1654-N1656 VanDerWaalsContact C-N 3.33Å; R1654-N1656 PolarHBondContact O-N 3.1Å; R1654-E1657 VanDerWaalsContact CA-OE2 3.26Å; R1654-E1657 WeakPolarHBondContact CA-OE2 3.44Å; R1654-E1657 HydrophobicContact CB-CB 4.4Å; R1654-E1657 VanDerWaalsContact CB-CD 3.48Å; R1654-E1657 HydrophobicContact CB-CG 4.39Å; R1654-E1657 WeakPolarHBondContact CB-OE1 3.34Å; R1654-E1657 VanDerWaalsContact CB-OE2 3.24Å; R1654-E1657 WeakPolarHBondContact CB-OE2 3.34Å; R1654-E1657 VanDerWaalsContact CD-OE1 3.23Å; R1654-E1657 WeakPolarHBondContact CD-OE1 3.26Å; R1654-E1657 WeakPolarHBondContact CD-OE2 3.4Å; R1654-E1657 VanDerWaalsContact CG-OE1 3.23Å; R1654-E1657 WeakPolarHBondContact CG-OE1 3.31Å; R1654-E1657 IonicContact CZ-OE1 2.66Å; R1654-E1657 IonicContact NE-OE1 3.33Å; R1654-E1657 IonicContact NE-OE2 2.79Å; R1654-E1657 IonicContact NH1-OE1 3.78Å; R1654-E1657 PolarHBondContact NH1-OE1 3.21Å; R1654-E1657 IonicContact NH1-OE2 3.54Å; R1654-E1657 PolarHBondContact O-N 2.99Å; R1654-E1657 VanDerWaalsContact O-OE2 3.08Å; R1654-V1658 WeakPolarHBondContact O-CG2 3.39Å; R1654-V1658 PolarHBondContact O-N 3.15Å; R1654-V1658 VanDerWaalsContact O-N 3.15Å
1655	L	75.2	Confident	79.6	Confident	39.4 Å²	39.4	21.1 Å²	21.1	21%	0.206	11%	0.113	C	C	.	.	H	α-helix	trans	-68.3	-32.5	-172	-63.1	180	0	0	0	112.8	G1653 E1657 V1658 V1659 Y1687 L1706	G1653-L1655 VanDerWaalsContact C-N 3.25Å; G1653-L1655 PolarHBondContact O-N 3.14Å; L1655-E1657 VanDerWaalsContact C-N 3.33Å; L1655-E1657 PolarHBondContact O-N 3.35Å; L1655-V1658 WeakPolarHBondContact O-CB 3.46Å; L1655-V1658 PolarHBondContact O-N 3.05Å; L1655-V1659 VanDerWaalsContact O-CG2 3.28Å; L1655-V1659 WeakPolarHBondContact O-CG2 3.37Å; L1655-V1659 PolarHBondContact O-N 2.96Å; L1655-V1659 VanDerWaalsContact O-N 3.08Å; L1655-Y1687 HydrophobicContact CB-CE2 4.22Å; L1655-Y1687 HydrophobicContact CD2-CD2 4.41Å; L1655-Y1687 HydrophobicContact CD2-CE2 3.94Å; L1655-Y1687 PolarHBondContact O-OH 3.48Å; L1655-L1706 HydrophobicContact CB-CD1 4.17Å; L1655-L1706 HydrophobicContact CB-CD2 4.06Å; L1655-L1706 HydrophobicContact CD1-CD1 4.38Å; L1655-L1706 HydrophobicContact CD1-CD2 3.92Å; L1655-L1706 HydrophobicContact CD2-CD1 4.13Å; L1655-L1706 HydrophobicContact CG-CD1 4.34Å; L1655-L1706 HydrophobicContact CG-CD2 4.48Å
1656	N	76.1	Confident	79.6	Confident	75.8 Å²	75.8	21.5 Å²	21.5	41%	0.405	12%	0.117	S	C	.	.	H	α-helix	trans	-64.1	-41.9	178.2	-71.2	-20.5	0	0	0	111.3	V1472 R1654 V1659 C1660 S1705	V1472-N1656 HydrophobicContact CG2-CB 4.12Å; R1654-N1656 VanDerWaalsContact C-N 3.33Å; R1654-N1656 PolarHBondContact O-N 3.1Å; N1656-V1659 WeakPolarHBondContact O-CB 3.43Å; N1656-V1659 PolarHBondContact O-N 3.2Å; N1656-C1660 PolarHBondContact O-N 3.22Å; N1656-C1660 VanDerWaalsContact O-N 3.09Å; N1656-C1660 PolarHBondContact O-SG 2.99Å; N1656-C1660 VanDerWaalsContact O-SG 3.35Å; N1656-S1705 WeakPolarHBondContact OD1-CB 3.08Å; N1656-S1705 PolarHBondContact OD1-OG 3.09Å
1657	E	79.2	Confident	79.6	Confident	23.6 Å²	23.6	21.1 Å²	21.1	11%	0.11	12%	0.115	C	C	.	.	H	α-helix	trans	-67.5	-40.7	178.6	-60.1	104.2	151.7	0	0	110.9	W1467 L1470 L1649 R1654 L1655 V1659 C1660 L1661	W1467-E1657 HydrophobicContact CB-CG 4.36Å; W1467-E1657 HydrophobicContact CE3-CB 4.35Å; W1467-E1657 HydrophobicContact CE3-CG 4.48Å; L1470-E1657 HydrophobicContact CD1-CB 4.41Å; L1470-E1657 HydrophobicContact CD1-CG 4.33Å; L1649-E1657 HydrophobicContact CD1-CB 4.35Å; R1654-E1657 VanDerWaalsContact CA-OE2 3.26Å; R1654-E1657 WeakPolarHBondContact CA-OE2 3.44Å; R1654-E1657 HydrophobicContact CB-CB 4.4Å; R1654-E1657 VanDerWaalsContact CB-CD 3.48Å; R1654-E1657 HydrophobicContact CB-CG 4.39Å; R1654-E1657 WeakPolarHBondContact CB-OE1 3.34Å; R1654-E1657 VanDerWaalsContact CB-OE2 3.24Å; R1654-E1657 WeakPolarHBondContact CB-OE2 3.34Å; R1654-E1657 VanDerWaalsContact CD-OE1 3.23Å; R1654-E1657 WeakPolarHBondContact CD-OE1 3.26Å; R1654-E1657 WeakPolarHBondContact CD-OE2 3.4Å; R1654-E1657 VanDerWaalsContact CG-OE1 3.23Å; R1654-E1657 WeakPolarHBondContact CG-OE1 3.31Å; R1654-E1657 IonicContact CZ-OE1 2.66Å; R1654-E1657 IonicContact NE-OE1 3.33Å; R1654-E1657 IonicContact NE-OE2 2.79Å; R1654-E1657 IonicContact NH1-OE1 3.78Å; R1654-E1657 PolarHBondContact NH1-OE1 3.21Å; R1654-E1657 IonicContact NH1-OE2 3.54Å; R1654-E1657 PolarHBondContact O-N 2.99Å; R1654-E1657 VanDerWaalsContact O-OE2 3.08Å; L1655-E1657 VanDerWaalsContact C-N 3.33Å; L1655-E1657 PolarHBondContact O-N 3.35Å; E1657-V1659 VanDerWaalsContact C-N 3.32Å; E1657-V1659 PolarHBondContact O-N 3.17Å; E1657-C1660 PolarHBondContact O-N 3.24Å; E1657-L1661 WeakPolarHBondContact O-CB 3.38Å; E1657-L1661 WeakPolarHBondContact O-CG 3.19Å; E1657-L1661 PolarHBondContact O-N 2.96Å
1658	V	79.5	Confident	79.8	Confident	0.4 Å²	0.4	18.3 Å²	18.3	0%	0.002	10%	0.104	C	C	.	.	H	α-helix	trans	-58.6	-44.2	172.3	172.4	0	0	0	0	111.1	I1646 L1649 H1650 R1654 L1655 L1661 L1662 Y1687	I1646-V1658 HydrophobicContact CG2-CG1 3.96Å; I1646-V1658 HydrophobicContact CG2-CG2 4.22Å; L1649-V1658 HydrophobicContact CB-CG2 3.53Å; L1649-V1658 VanDerWaalsContact CB-CG2 3.49Å; L1649-V1658 HydrophobicContact CD1-CG2 4.47Å; H1650-V1658 HydrophobicContact CB-CG2 4.34Å; R1654-V1658 WeakPolarHBondContact O-CG2 3.39Å; R1654-V1658 PolarHBondContact O-N 3.15Å; R1654-V1658 VanDerWaalsContact O-N 3.15Å; L1655-V1658 WeakPolarHBondContact O-CB 3.46Å; L1655-V1658 PolarHBondContact O-N 3.05Å; V1658-L1661 PolarHBondContact O-N 3.13Å; V1658-L1662 HydrophobicContact CG1-CD1 3.79Å; V1658-L1662 HydrophobicContact CG1-CG 4.22Å; V1658-L1662 WeakPolarHBondContact O-CB 3.33Å; V1658-L1662 VanDerWaalsContact O-CG 3.3Å; V1658-L1662 WeakPolarHBondContact O-CG 3.35Å; V1658-L1662 PolarHBondContact O-N 3.09Å; V1658-Y1687 HydrophobicContact CB-CD2 4.35Å; V1658-Y1687 HydrophobicContact CB-CE2 4.16Å; V1658-Y1687 HydrophobicContact CG1-CD2 3.61Å; V1658-Y1687 VanDerWaalsContact CG1-CD2 3.5Å; V1658-Y1687 HydrophobicContact CG1-CE2 3.88Å; V1658-Y1687 HydrophobicContact CG1-CG 4.41Å
1659	V	79.5	Confident	79.8	Confident	1 Å²	1	19.2 Å²	19.2	1%	0.006	11%	0.109	C	C	.	.	H	α-helix	trans	-63.2	-47.6	177.2	178.3	0	0	0	0	110.7	L1474 L1655 N1656 E1657 L1661 L1662 T1663 Y1687 L1706 M1709 I1713	L1474-V1659 HydrophobicContact CD1-CG1 4.05Å; L1655-V1659 VanDerWaalsContact O-CG2 3.28Å; L1655-V1659 WeakPolarHBondContact O-CG2 3.37Å; L1655-V1659 PolarHBondContact O-N 2.96Å; L1655-V1659 VanDerWaalsContact O-N 3.08Å; N1656-V1659 WeakPolarHBondContact O-CB 3.43Å; N1656-V1659 PolarHBondContact O-N 3.2Å; E1657-V1659 VanDerWaalsContact C-N 3.32Å; E1657-V1659 PolarHBondContact O-N 3.17Å; V1659-L1661 VanDerWaalsContact C-N 3.29Å; V1659-L1661 PolarHBondContact O-N 3.07Å; V1659-L1662 PolarHBondContact O-N 3.21Å; V1659-T1663 HydrophobicContact CG1-CG2 4.1Å; V1659-T1663 WeakPolarHBondContact O-CB 3.16Å; V1659-T1663 VanDerWaalsContact O-CG2 3.28Å; V1659-T1663 WeakPolarHBondContact O-CG2 3.37Å; V1659-T1663 PolarHBondContact O-N 3.32Å; V1659-T1663 VanDerWaalsContact O-N 3.1Å; V1659-T1663 PolarHBondContact O-OG1 3.27Å; V1659-T1663 VanDerWaalsContact O-OG1 3.06Å; V1659-Y1687 HydrophobicContact CG2-CE1 3.96Å; V1659-Y1687 HydrophobicContact CG2-CE2 4.07Å; V1659-Y1687 VanDerWaalsContact CG2-OH 3.23Å; V1659-Y1687 WeakPolarHBondContact CG2-OH 3.38Å; V1659-L1706 HydrophobicContact CG2-CB 4.48Å; V1659-L1706 HydrophobicContact CG2-CD1 3.52Å; V1659-L1706 HydrophobicContact CG2-CG 3.88Å; V1659-M1709 HydrophobicContact CB-CE 3.77Å; V1659-M1709 VanDerWaalsContact CB-CE 3.42Å; V1659-M1709 HydrophobicContact CB-SD 4.3Å; V1659-M1709 HydrophobicContact CG1-CB 3.87Å; V1659-M1709 HydrophobicContact CG1-CE 3.4Å; V1659-M1709 HydrophobicContact CG1-CG 4.07Å; V1659-M1709 HydrophobicContact CG1-SD 3.9Å; V1659-M1709 HydrophobicContact CG2-CB 4.14Å; V1659-M1709 HydrophobicContact CG2-CE 3.97Å; V1659-I1713 HydrophobicContact CB-CD1 4.36Å; V1659-I1713 HydrophobicContact CG1-CD1 4.11Å; V1659-I1713 HydrophobicContact CG1-CG1 4.12Å; V1659-I1713 HydrophobicContact CG2-CD1 4.02Å
1660	C	81.5	Confident	79.6	Confident	2.8 Å²	2.8	20.9 Å²	20.9	2%	0.019	12%	0.117	C	C	.	.	H	α-helix	trans	-57.4	-43	178.5	-68.9	0	0	0	0	111.6	L1470 I1487 N1656 E1657 T1663 S1664	L1470-C1660 HydrophobicContact CB-CB 4.47Å; L1470-C1660 HydrophobicContact CD1-CB 4.02Å; L1470-C1660 HydrophobicContact CD2-CB 4.45Å; I1487-C1660 HydrophobicContact CD1-CB 4.42Å; N1656-C1660 PolarHBondContact O-N 3.22Å; N1656-C1660 VanDerWaalsContact O-N 3.09Å; N1656-C1660 PolarHBondContact O-SG 2.99Å; N1656-C1660 VanDerWaalsContact O-SG 3.35Å; E1657-C1660 PolarHBondContact O-N 3.24Å; C1660-T1663 PolarHBondContact O-N 3.32Å; C1660-T1663 PolarHBondContact O-OG1 3.2Å; C1660-T1663 VanDerWaalsContact O-OG1 3.07Å; C1660-S1664 VanDerWaalsContact O-CB 3.25Å; C1660-S1664 WeakPolarHBondContact O-CB 3.36Å; C1660-S1664 PolarHBondContact O-N 3.17Å; C1660-S1664 VanDerWaalsContact O-N 3.11Å
1661	L	82.4	Confident	79.6	Confident	0.4 Å²	0.4	19.2 Å²	19.2	0%	0.002	11%	0.109	C	C	.	.	H	α-helix	trans	-65.4	-47.8	176	-73	174.7	0	0	0	112.8	W1467 I1487 L1645 L1649 E1657 V1658 V1659 T1663 S1664 F1667	W1467-L1661 HydrophobicContact CH2-CD1 4.09Å; W1467-L1661 HydrophobicContact CH2-CD2 4.05Å; W1467-L1661 HydrophobicContact CH2-CG 4.44Å; W1467-L1661 HydrophobicContact CZ3-CD1 3.92Å; W1467-L1661 HydrophobicContact CZ3-CD2 3.82Å; W1467-L1661 HydrophobicContact CZ3-CG 4.04Å; I1487-L1661 HydrophobicContact CD1-CD2 4.24Å; I1487-L1661 HydrophobicContact CG1-CD2 4.28Å; I1487-L1661 HydrophobicContact CG2-CD2 4.2Å; L1645-L1661 HydrophobicContact CD2-CD1 4Å; L1645-L1661 HydrophobicContact CG-CD1 4.35Å; L1649-L1661 HydrophobicContact CD1-CD1 3.4Å; L1649-L1661 VanDerWaalsContact CD1-CD1 3.43Å; E1657-L1661 WeakPolarHBondContact O-CB 3.38Å; E1657-L1661 WeakPolarHBondContact O-CG 3.19Å; E1657-L1661 PolarHBondContact O-N 2.96Å; V1658-L1661 PolarHBondContact O-N 3.13Å; V1659-L1661 VanDerWaalsContact C-N 3.29Å; V1659-L1661 PolarHBondContact O-N 3.07Å; L1661-T1663 PolarHBondContact O-N 3.17Å; L1661-T1663 VanDerWaalsContact O-N 3.17Å; L1661-S1664 PolarHBondContact O-N 3.3Å; L1661-S1664 VanDerWaalsContact O-N 3.13Å; L1661-S1664 PolarHBondContact O-OG 2.94Å; L1661-F1667 HydrophobicContact CB-CD1 4.17Å; L1661-F1667 HydrophobicContact CB-CD2 4.46Å; L1661-F1667 HydrophobicContact CB-CE1 4.29Å; L1661-F1667 HydrophobicContact CB-CG 4.31Å; L1661-F1667 HydrophobicContact CB-CZ 4.42Å; L1661-F1667 HydrophobicContact CD1-CE2 4.42Å; L1661-F1667 HydrophobicContact CD2-CB 4.25Å; L1661-F1667 HydrophobicContact CD2-CD1 4.47Å; L1661-F1667 HydrophobicContact CD2-CD2 3.72Å; L1661-F1667 HydrophobicContact CD2-CE2 4.19Å; L1661-F1667 HydrophobicContact CD2-CG 3.95Å; L1661-F1667 HydrophobicContact CG-CD2 4.5Å; L1661-F1667 WeakPolarHBondContact O-CD1 3.32Å
1662	L	83.4	Confident	79.7	Confident	0.2 Å²	0.2	16.2 Å²	16.2	0%	0.001	10%	0.095	C	C	.	.	H	α-helix	trans	-66.3	-20.4	179.7	-71.1	179.7	0	0	0	113.1	I1646 V1658 V1659 L1680 M1684 Y1687 I1713	I1646-L1662 HydrophobicContact CD1-CD2 3.73Å; I1646-L1662 HydrophobicContact CG1-CD2 4.33Å; V1658-L1662 HydrophobicContact CG1-CD1 3.79Å; V1658-L1662 HydrophobicContact CG1-CG 4.22Å; V1658-L1662 WeakPolarHBondContact O-CB 3.33Å; V1658-L1662 VanDerWaalsContact O-CG 3.3Å; V1658-L1662 WeakPolarHBondContact O-CG 3.35Å; V1658-L1662 PolarHBondContact O-N 3.09Å; V1659-L1662 PolarHBondContact O-N 3.21Å; L1662-L1680 HydrophobicContact CD2-CD1 3.98Å; L1662-L1680 HydrophobicContact CD2-CD2 4.39Å; L1662-L1680 HydrophobicContact CD2-CG 4.37Å; L1662-M1684 HydrophobicContact CB-CE 4.01Å; L1662-M1684 HydrophobicContact CB-SD 4.02Å; L1662-M1684 HydrophobicContact CD1-CG 4.33Å; L1662-M1684 HydrophobicContact CD1-SD 4.03Å; L1662-M1684 HydrophobicContact CD2-CE 4.04Å; L1662-M1684 HydrophobicContact CD2-CG 3.94Å; L1662-M1684 HydrophobicContact CD2-SD 4.23Å; L1662-M1684 HydrophobicContact CG-CE 4.41Å; L1662-M1684 HydrophobicContact CG-CG 4.46Å; L1662-M1684 HydrophobicContact CG-SD 4.2Å; L1662-M1684 WeakPolarHBondContact O-CE 3.37Å; L1662-Y1687 HydrophobicContact CD1-CD2 4.09Å; L1662-Y1687 HydrophobicContact CD1-CG 4.35Å; L1662-I1713 HydrophobicContact CB-CG1 4.44Å; L1662-I1713 HydrophobicContact CD1-CD1 4.28Å
1663	T	82.1	Confident	79.6	Confident	8.4 Å²	8.4	20.2 Å²	20.2	5%	0.052	11%	0.113	C	C	.	.	H	α-helix	trans	-98.4	-6.3	176.6	57	0	0	0	0	113.7	L1474 V1659 C1660 L1661 P1665 M1709 K1712 I1713 M1716 W1746	L1474-T1663 HydrophobicContact CD1-CG2 4.15Å; L1474-T1663 WeakPolarHBondContact CD1-OG1 3.34Å; V1659-T1663 HydrophobicContact CG1-CG2 4.1Å; V1659-T1663 WeakPolarHBondContact O-CB 3.16Å; V1659-T1663 VanDerWaalsContact O-CG2 3.28Å; V1659-T1663 WeakPolarHBondContact O-CG2 3.37Å; V1659-T1663 PolarHBondContact O-N 3.32Å; V1659-T1663 VanDerWaalsContact O-N 3.1Å; V1659-T1663 PolarHBondContact O-OG1 3.27Å; V1659-T1663 VanDerWaalsContact O-OG1 3.06Å; C1660-T1663 PolarHBondContact O-N 3.32Å; C1660-T1663 PolarHBondContact O-OG1 3.2Å; C1660-T1663 VanDerWaalsContact O-OG1 3.07Å; L1661-T1663 PolarHBondContact O-N 3.17Å; L1661-T1663 VanDerWaalsContact O-N 3.17Å; T1663-P1665 WeakPolarHBondContact O-CD 3.15Å; T1663-M1709 HydrophobicContact CG2-CE 3.96Å; T1663-K1712 HydrophobicContact CG2-CB 4.44Å; T1663-I1713 HydrophobicContact CG2-CG1 4.25Å; T1663-M1716 WeakPolarHBondContact O-CE 3.25Å; T1663-W1746 HydrophobicContact CG2-CH2 3.64Å; T1663-W1746 HydrophobicContact CG2-CZ2 4.14Å
1664	S	83.1	Confident	79.5	Confident	1.2 Å²	1.2	20.4 Å²	20.4	1%	0.008	11%	0.107	C	C	.	.			trans	-87.8	115.1	-174.3	154.9	0	0	0	0	112.9	E1484 I1487 C1660 L1661 A1666 F1667 L1668	E1484-S1664 VanDerWaalsContact CD-OG 3.26Å; E1484-S1664 WeakPolarHBondContact OE1-CA 3.15Å; E1484-S1664 WeakPolarHBondContact OE1-CB 3.25Å; E1484-S1664 PolarHBondContact OE1-OG 3.2Å; E1484-S1664 PolarHBondContact OE2-OG 3.11Å; I1487-S1664 VanDerWaalsContact CD1-CB 3.46Å; I1487-S1664 WeakPolarHBondContact CD1-OG 3.33Å; C1660-S1664 VanDerWaalsContact O-CB 3.25Å; C1660-S1664 WeakPolarHBondContact O-CB 3.36Å; C1660-S1664 PolarHBondContact O-N 3.17Å; C1660-S1664 VanDerWaalsContact O-N 3.11Å; L1661-S1664 PolarHBondContact O-N 3.3Å; L1661-S1664 VanDerWaalsContact O-N 3.13Å; L1661-S1664 PolarHBondContact O-OG 2.94Å; S1664-A1666 VanDerWaalsContact C-N 3.29Å; S1664-A1666 PolarHBondContact O-N 3.27Å; S1664-A1666 PolarHBondContact OG-N 2.96Å; S1664-F1667 PolarHBondContact O-N 3.16Å; S1664-F1667 VanDerWaalsContact O-N 3.1Å; S1664-F1667 WeakPolarHBondContact OG-CB 3.38Å; S1664-F1667 PolarHBondContact OG-N 3.04Å; S1664-L1668 WeakPolarHBondContact O-CB 3.31Å; S1664-L1668 VanDerWaalsContact O-CG 3.32Å; S1664-L1668 WeakPolarHBondContact O-CG 3.43Å; S1664-L1668 PolarHBondContact O-N 3.14Å; S1664-L1668 VanDerWaalsContact O-N 3.12Å
1665	P	82.9	Confident	79.2	Confident	2.2 Å²	2.2	21.3 Å²	21.3	1%	0.014	13%	0.128	C	C	.	.	H	α-helix	trans	-53.3	-41.1	174.5	-24.6	29.1	0	0	0	114.1	E1484 T1663 F1667 L1668 I1669 F1734 I1750 C1754	E1484-P1665 VanDerWaalsContact CD-CD 3.47Å; E1484-P1665 VanDerWaalsContact OE1-CD 3.27Å; E1484-P1665 WeakPolarHBondContact OE1-CD 3.24Å; E1484-P1665 WeakPolarHBondContact OE2-CD 3.42Å; T1663-P1665 WeakPolarHBondContact O-CD 3.15Å; P1665-F1667 VanDerWaalsContact C-N 3.34Å; P1665-F1667 PolarHBondContact O-N 3.34Å; P1665-L1668 PolarHBondContact O-N 3.26Å; P1665-I1669 VanDerWaalsContact O-CB 3.3Å; P1665-I1669 WeakPolarHBondContact O-CB 3.35Å; P1665-I1669 WeakPolarHBondContact O-CD1 3.36Å; P1665-I1669 VanDerWaalsContact O-CG1 3.29Å; P1665-I1669 WeakPolarHBondContact O-CG1 3.36Å; P1665-I1669 PolarHBondContact O-N 3.01Å; P1665-F1734 HydrophobicContact CB-CD1 3.86Å; P1665-F1734 HydrophobicContact CB-CE1 3.65Å; P1665-F1734 HydrophobicContact CB-CG 4.48Å; P1665-F1734 HydrophobicContact CB-CZ 4.1Å; P1665-F1734 HydrophobicContact CG-CD1 4.17Å; P1665-F1734 HydrophobicContact CG-CE1 3.65Å; P1665-F1734 VanDerWaalsContact CG-CE1 3.48Å; P1665-F1734 HydrophobicContact CG-CZ 3.99Å; P1665-I1750 HydrophobicContact CG-CG2 3.34Å; P1665-C1754 VanDerWaalsContact CB-SG 3.53Å; P1665-C1754 WeakPolarHBondContact CB-SG 3.26Å; P1665-C1754 VanDerWaalsContact CG-SG 3.54Å; P1665-C1754 WeakPolarHBondContact CG-SG 3.33Å
1666	A	79.2	Confident	78.9	Confident	14.4 Å²	14.4	22.8 Å²	22.8	12%	0.119	13%	0.132	C	C	.	.	H	α-helix	trans	-59.1	-44.3	178.9	0	0	0	0	0	112.6	E1484 I1487 Y1488 S1664 H1670	E1484-A1666 VanDerWaalsContact OE2-CB 3.27Å; E1484-A1666 WeakPolarHBondContact OE2-CB 3.42Å; E1484-A1666 PolarHBondContact OE2-N 3.26Å; I1487-A1666 HydrophobicContact CG2-CB 4.44Å; Y1488-A1666 HydrophobicContact CD2-CB 4.05Å; Y1488-A1666 HydrophobicContact CE1-CB 4.28Å; Y1488-A1666 HydrophobicContact CE2-CB 3.28Å; Y1488-A1666 HydrophobicContact CG-CB 4.31Å; S1664-A1666 VanDerWaalsContact C-N 3.29Å; S1664-A1666 PolarHBondContact O-N 3.27Å; S1664-A1666 PolarHBondContact OG-N 2.96Å; A1666-H1670 WeakPolarHBondContact O-CB 3.29Å; A1666-H1670 PolarHBondContact O-N 3.17Å; A1666-H1670 VanDerWaalsContact O-N 3.15Å
1667	F	82.4	Confident	78.4	Confident	0.4 Å²	0.4	19.3 Å²	19.3	0%	0.002	11%	0.114	C	C	.	.	H	α-helix	trans	-68.9	-43.4	177.2	177	-97.7	0	0	0	112	I1487 M1642 L1645 I1646 L1661 S1664 P1665 I1669 H1670 Q1671 L1680	I1487-F1667 HydrophobicContact CG2-CB 4.13Å; M1642-F1667 HydrophobicContact CE-CD2 3.67Å; M1642-F1667 VanDerWaalsContact CE-CD2 3.49Å; M1642-F1667 HydrophobicContact CE-CE2 3.56Å; M1642-F1667 VanDerWaalsContact CE-CE2 3.41Å; M1642-F1667 HydrophobicContact SD-CE2 4.42Å; L1645-F1667 HydrophobicContact CD2-CE2 4.15Å; I1646-F1667 HydrophobicContact CD1-CE1 3.8Å; I1646-F1667 HydrophobicContact CD1-CZ 3.79Å; I1646-F1667 HydrophobicContact CG1-CE1 4.22Å; I1646-F1667 HydrophobicContact CG1-CZ 3.88Å; L1661-F1667 HydrophobicContact CB-CD1 4.17Å; L1661-F1667 HydrophobicContact CB-CD2 4.46Å; L1661-F1667 HydrophobicContact CB-CE1 4.29Å; L1661-F1667 HydrophobicContact CB-CG 4.31Å; L1661-F1667 HydrophobicContact CB-CZ 4.42Å; L1661-F1667 HydrophobicContact CD1-CE2 4.42Å; L1661-F1667 HydrophobicContact CD2-CB 4.25Å; L1661-F1667 HydrophobicContact CD2-CD1 4.47Å; L1661-F1667 HydrophobicContact CD2-CD2 3.72Å; L1661-F1667 HydrophobicContact CD2-CE2 4.19Å; L1661-F1667 HydrophobicContact CD2-CG 3.95Å; L1661-F1667 HydrophobicContact CG-CD2 4.5Å; L1661-F1667 WeakPolarHBondContact O-CD1 3.32Å; S1664-F1667 PolarHBondContact O-N 3.16Å; S1664-F1667 VanDerWaalsContact O-N 3.1Å; S1664-F1667 WeakPolarHBondContact OG-CB 3.38Å; S1664-F1667 PolarHBondContact OG-N 3.04Å; P1665-F1667 VanDerWaalsContact C-N 3.34Å; P1665-F1667 PolarHBondContact O-N 3.34Å; F1667-I1669 PolarHBondContact O-N 2.84Å; F1667-H1670 PolarHBondContact O-N 3.18Å; F1667-Q1671 HydrophobicContact CD1-CG 4.15Å; F1667-Q1671 HydrophobicContact CD2-CG 4.47Å; F1667-Q1671 HydrophobicContact CE1-CG 3.73Å; F1667-Q1671 HydrophobicContact CE2-CG 4.13Å; F1667-Q1671 VanDerWaalsContact CE2-NE2 3.28Å; F1667-Q1671 HydrophobicContact CG-CG 4.49Å; F1667-Q1671 HydrophobicContact CZ-CG 3.74Å; F1667-Q1671 WeakPolarHBondContact O-CG 3.38Å; F1667-Q1671 PolarHBondContact O-N 3.05Å; F1667-L1680 HydrophobicContact CE1-CD1 4.1Å
1668	L	83.7	Confident	77.8	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-62	-45	-179.8	-63.8	171.6	0	0	0	111.7	S1664 P1665 H1670 Q1671 I1672 L1680 M1684 M1716 L1720 F1734	S1664-L1668 WeakPolarHBondContact O-CB 3.31Å; S1664-L1668 VanDerWaalsContact O-CG 3.32Å; S1664-L1668 WeakPolarHBondContact O-CG 3.43Å; S1664-L1668 PolarHBondContact O-N 3.14Å; S1664-L1668 VanDerWaalsContact O-N 3.12Å; P1665-L1668 PolarHBondContact O-N 3.26Å; L1668-H1670 VanDerWaalsContact C-N 3.34Å; L1668-H1670 PolarHBondContact O-N 3.35Å; L1668-Q1671 PolarHBondContact O-N 3.11Å; L1668-I1672 WeakPolarHBondContact O-CD1 3.28Å; L1668-I1672 VanDerWaalsContact O-CG1 3.26Å; L1668-I1672 WeakPolarHBondContact O-CG1 3.32Å; L1668-I1672 PolarHBondContact O-N 2.89Å; L1668-L1680 HydrophobicContact CB-CD2 4.44Å; L1668-L1680 HydrophobicContact CD2-CD1 3.71Å; L1668-L1680 VanDerWaalsContact CD2-CD1 3.42Å; L1668-L1680 HydrophobicContact CD2-CD2 3.4Å; L1668-L1680 VanDerWaalsContact CD2-CD2 3.49Å; L1668-L1680 HydrophobicContact CD2-CG 4.03Å; L1668-L1680 HydrophobicContact CG-CD2 4.47Å; L1668-M1684 HydrophobicContact CD2-CE 3.83Å; L1668-M1716 HydrophobicContact CD1-CE 4.02Å; L1668-M1716 HydrophobicContact CD1-CG 3.87Å; L1668-M1716 HydrophobicContact CD1-SD 3.63Å; L1668-M1716 VanDerWaalsContact CD1-SD 3.59Å; L1668-L1720 HydrophobicContact CD1-CD1 4.16Å; L1668-L1720 HydrophobicContact CD1-CD2 4.44Å; L1668-L1720 HydrophobicContact CD2-CD1 3.95Å; L1668-L1720 HydrophobicContact CG-CD1 4.46Å; L1668-F1734 HydrophobicContact CB-CE2 4.4Å; L1668-F1734 HydrophobicContact CD1-CE2 4.23Å; L1668-F1734 HydrophobicContact CD1-CZ 4.28Å
1669	I	81.6	Confident	77.4	Confident	23.4 Å²	23.4	25.1 Å²	25.1	12%	0.12	15%	0.147	C	C	.	.	H	α-helix	trans	-59.3	-47.6	176	-71.6	167.6	0	0	0	110.3	P1665 F1667 Q1671 I1672 E1673 P1731 Y1732 F1734	P1665-I1669 VanDerWaalsContact O-CB 3.3Å; P1665-I1669 WeakPolarHBondContact O-CB 3.35Å; P1665-I1669 WeakPolarHBondContact O-CD1 3.36Å; P1665-I1669 VanDerWaalsContact O-CG1 3.29Å; P1665-I1669 WeakPolarHBondContact O-CG1 3.36Å; P1665-I1669 PolarHBondContact O-N 3.01Å; F1667-I1669 PolarHBondContact O-N 2.84Å; I1669-Q1671 VanDerWaalsContact C-N 3.34Å; I1669-Q1671 PolarHBondContact O-N 3.22Å; I1669-I1672 PolarHBondContact O-N 2.93Å; I1669-I1672 VanDerWaalsContact O-N 3.14Å; I1669-E1673 HydrophobicContact CG2-CG 4.47Å; I1669-E1673 WeakPolarHBondContact O-CG 3.29Å; I1669-E1673 PolarHBondContact O-N 3.17Å; I1669-P1731 HydrophobicContact CG2-CB 3.92Å; I1669-Y1732 HydrophobicContact CG2-CD1 4.32Å; I1669-Y1732 HydrophobicContact CG2-CE1 4.12Å; I1669-F1734 HydrophobicContact CD1-CB 3.91Å; I1669-F1734 HydrophobicContact CD1-CG 4.37Å; I1669-F1734 HydrophobicContact CG1-CB 4.18Å; I1669-F1734 HydrophobicContact CG1-CD2 4.35Å; I1669-F1734 HydrophobicContact CG1-CG 4.39Å
1670	H	77.1	Confident	77.3	Confident	38 Å²	38	25.3 Å²	25.3	18%	0.176	15%	0.148	C	C	.	.	H	α-helix	trans	-63.9	-37.5	-179.4	-169.1	63.1	0	0	0	112.9	N1495 A1666 F1667 L1668 I1672 E1673 S1674	N1495-H1670 PolarHBondContact ND2-CE1 2.94Å; N1495-H1670 VanDerWaalsContact ND2-CE1 3.31Å; N1495-H1670 PolarHBondContact ND2-NE2 3.34Å; A1666-H1670 WeakPolarHBondContact O-CB 3.29Å; A1666-H1670 PolarHBondContact O-N 3.17Å; A1666-H1670 VanDerWaalsContact O-N 3.15Å; F1667-H1670 PolarHBondContact O-N 3.18Å; L1668-H1670 VanDerWaalsContact C-N 3.34Å; L1668-H1670 PolarHBondContact O-N 3.35Å; H1670-I1672 VanDerWaalsContact C-N 3.31Å; H1670-E1673 PolarHBondContact O-N 3.07Å; H1670-S1674 VanDerWaalsContact O-CB 3.28Å; H1670-S1674 WeakPolarHBondContact O-CB 3.37Å; H1670-S1674 PolarHBondContact O-N 3.2Å; H1670-S1674 PolarHBondContact O-OG 3Å
1671	Q	78.5	Confident	77	Confident	5.2 Å²	5.2	26.3 Å²	26.3	2%	0.024	15%	0.153	C	C	.	.	H	α-helix	trans	-66.7	-36.6	173.7	-71	-72.1	3.4	0	0	112.3	M1642 F1667 L1668 I1669 S1674 G1675 Y1676 G1677 L1680	M1642-Q1671 PolarHBondContact O-NE2 3.04Å; F1667-Q1671 HydrophobicContact CD1-CG 4.15Å; F1667-Q1671 HydrophobicContact CD2-CG 4.47Å; F1667-Q1671 HydrophobicContact CE1-CG 3.73Å; F1667-Q1671 HydrophobicContact CE2-CG 4.13Å; F1667-Q1671 VanDerWaalsContact CE2-NE2 3.28Å; F1667-Q1671 HydrophobicContact CG-CG 4.49Å; F1667-Q1671 HydrophobicContact CZ-CG 3.74Å; F1667-Q1671 WeakPolarHBondContact O-CG 3.38Å; F1667-Q1671 PolarHBondContact O-N 3.05Å; L1668-Q1671 PolarHBondContact O-N 3.11Å; I1669-Q1671 VanDerWaalsContact C-N 3.34Å; I1669-Q1671 PolarHBondContact O-N 3.22Å; Q1671-S1674 WeakPolarHBondContact CA-OG 3.23Å; Q1671-S1674 PolarHBondContact O-N 3.33Å; Q1671-S1674 PolarHBondContact O-OG 3.21Å; Q1671-S1674 VanDerWaalsContact O-OG 3.11Å; Q1671-G1675 PolarHBondContact O-N 2.97Å; Q1671-Y1676 CarbonylContact O-C 3.54Å; Q1671-Y1676 WeakPolarHBondContact O-CA 3.39Å; Q1671-Y1676 WeakPolarHBondContact O-CB 3.48Å; Q1671-Y1676 PolarHBondContact O-N 3.28Å; Q1671-Y1676 VanDerWaalsContact OE1-CB 3.27Å; Q1671-G1677 PolarHBondContact O-N 3.07Å; Q1671-L1680 HydrophobicContact CB-CD1 3.98Å; Q1671-L1680 HydrophobicContact CB-CD2 4.33Å; Q1671-L1680 HydrophobicContact CG-CD1 4.05Å
1672	I	78.7	Confident	76.6	Confident	11.6 Å²	11.6	29.3 Å²	29.3	6%	0.059	17%	0.169	C	C	.	.	H	α-helix	trans	-68.5	-45.6	176.3	-68.4	166.1	0	0	0	110.5	L1668 I1669 H1670 S1674 G1675 L1720 Y1724 L1727 I1728 P1731	L1668-I1672 WeakPolarHBondContact O-CD1 3.28Å; L1668-I1672 VanDerWaalsContact O-CG1 3.26Å; L1668-I1672 WeakPolarHBondContact O-CG1 3.32Å; L1668-I1672 PolarHBondContact O-N 2.89Å; I1669-I1672 PolarHBondContact O-N 2.93Å; I1669-I1672 VanDerWaalsContact O-N 3.14Å; H1670-I1672 VanDerWaalsContact C-N 3.31Å; I1672-S1674 VanDerWaalsContact C-N 3.28Å; I1672-S1674 PolarHBondContact O-N 3.3Å; I1672-G1675 PolarHBondContact O-N 3.13Å; I1672-G1675 VanDerWaalsContact O-N 3.08Å; I1672-L1720 HydrophobicContact CD1-CD2 4.29Å; I1672-Y1724 HydrophobicContact CG1-CE2 4.47Å; I1672-L1727 HydrophobicContact CD1-CB 4.16Å; I1672-L1727 HydrophobicContact CD1-CD1 4.42Å; I1672-L1727 WeakPolarHBondContact CG2-O 3.37Å; I1672-I1728 HydrophobicContact CG2-CB 4.45Å; I1672-I1728 HydrophobicContact CG2-CG1 4.19Å; I1672-P1731 HydrophobicContact CG2-CB 4.33Å; I1672-P1731 HydrophobicContact CG2-CG 4.41Å
1673	E	76.3	Confident	76.1	Confident	90.2 Å²	90.2	30.1 Å²	30.1	42%	0.421	17%	0.173	S	C	.	.	H	α-helix	trans	-60.1	-37.6	175.6	-74.2	-174.1	144.6	0	0	112.7	I1669 H1670 G1675 P1731 Y1732	I1669-E1673 HydrophobicContact CG2-CG 4.47Å; I1669-E1673 WeakPolarHBondContact O-CG 3.29Å; I1669-E1673 PolarHBondContact O-N 3.17Å; H1670-E1673 PolarHBondContact O-N 3.07Å; E1673-G1675 PolarHBondContact O-N 3.16Å; E1673-P1731 HydrophobicContact CG-CB 4.08Å; E1673-P1731 HydrophobicContact CG-CG 3.81Å; E1673-Y1732 WeakPolarHBondContact OE1-CE2 3.42Å; E1673-Y1732 VanDerWaalsContact OE1-CZ 3.29Å; E1673-Y1732 PolarHBondContact OE1-OH 3.17Å; E1673-Y1732 PolarHBondContact OE2-OH 3.08Å
1674	S	71.3	Confident	75.9	Confident	49.6 Å²	49.6	29.7 Å²	29.7	35%	0.347	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-1.5	177	-18.8	0	0	0	0	113.8	H1670 Q1671 I1672 Y1676	H1670-S1674 VanDerWaalsContact O-CB 3.28Å; H1670-S1674 WeakPolarHBondContact O-CB 3.37Å; H1670-S1674 PolarHBondContact O-N 3.2Å; H1670-S1674 PolarHBondContact O-OG 3Å; Q1671-S1674 WeakPolarHBondContact CA-OG 3.23Å; Q1671-S1674 PolarHBondContact O-N 3.33Å; Q1671-S1674 PolarHBondContact O-OG 3.21Å; Q1671-S1674 VanDerWaalsContact O-OG 3.11Å; I1672-S1674 VanDerWaalsContact C-N 3.28Å; I1672-S1674 PolarHBondContact O-N 3.3Å; S1674-Y1676 VanDerWaalsContact C-N 3.34Å; S1674-Y1676 VanDerWaalsContact CB-CD2 3.45Å; S1674-Y1676 VanDerWaalsContact OG-CD2 3.3Å; S1674-Y1676 WeakPolarHBondContact OG-CD2 3.41Å
1675	G	69.3	Low	75.6	Confident	58.4 Å²	58.4	32 Å²	32	60%	0.602	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.5	13.4	179.3	0	0	0	0	0	114.9	Q1671 I1672 E1673	Q1671-G1675 PolarHBondContact O-N 2.97Å; I1672-G1675 PolarHBondContact O-N 3.13Å; I1672-G1675 VanDerWaalsContact O-N 3.08Å; E1673-G1675 PolarHBondContact O-N 3.16Å
1676	Y	68.8	Low	75	Confident	71.6 Å²	71.6	37 Å²	37	28%	0.281	20%	0.201	S	C	.	.			trans	-100.3	11.9	-178.2	-60.2	-51.8	0	0	0	113.9	K1643 Q1671 S1674 L1678 T1679 L1680	K1643-Y1676 HydrophobicContact CB-CD1 4.43Å; K1643-Y1676 HydrophobicContact CB-CD2 4.33Å; K1643-Y1676 HydrophobicContact CB-CE1 4.26Å; K1643-Y1676 HydrophobicContact CB-CE2 4.08Å; K1643-Y1676 HydrophobicContact CB-CG 4.44Å; K1643-Y1676 HydrophobicContact CD-CD1 4.21Å; K1643-Y1676 HydrophobicContact CD-CE1 3.69Å; K1643-Y1676 HydrophobicContact CD-CE2 4.35Å; K1643-Y1676 HydrophobicContact CG-CD1 4.01Å; K1643-Y1676 HydrophobicContact CG-CD2 4.35Å; K1643-Y1676 HydrophobicContact CG-CE1 3.92Å; K1643-Y1676 HydrophobicContact CG-CE2 4.34Å; K1643-Y1676 HydrophobicContact CG-CG 4.37Å; Q1671-Y1676 CarbonylContact O-C 3.54Å; Q1671-Y1676 WeakPolarHBondContact O-CA 3.39Å; Q1671-Y1676 WeakPolarHBondContact O-CB 3.48Å; Q1671-Y1676 PolarHBondContact O-N 3.28Å; Q1671-Y1676 VanDerWaalsContact OE1-CB 3.27Å; S1674-Y1676 VanDerWaalsContact C-N 3.34Å; S1674-Y1676 VanDerWaalsContact CB-CD2 3.45Å; S1674-Y1676 VanDerWaalsContact OG-CD2 3.3Å; S1674-Y1676 WeakPolarHBondContact OG-CD2 3.41Å; Y1676-L1678 VanDerWaalsContact C-N 3.3Å; Y1676-L1678 PolarHBondContact O-N 3.2Å; Y1676-L1678 VanDerWaalsContact O-N 3.14Å; Y1676-T1679 WeakPolarHBondContact CA-OG1 3.32Å; Y1676-T1679 WeakPolarHBondContact CB-OG1 3.45Å; Y1676-T1679 PolarHBondContact O-N 3.15Å; Y1676-T1679 PolarHBondContact O-OG1 3.23Å; Y1676-L1680 WeakPolarHBondContact O-CB 3.48Å; Y1676-L1680 PolarHBondContact O-N 3.1Å; Y1676-L1680 VanDerWaalsContact O-N 3.11Å
1677	G	66.8	Low	74.7	Confident	2 Å²	2	36.6 Å²	36.6	2%	0.021	20%	0.197	C	C	.	.	H	α-helix	trans	-58.8	-33	-177.9	0	0	0	0	0	115.4	Q1671 T1679 L1680 L1681 Y1724	Q1671-G1677 PolarHBondContact O-N 3.07Å; G1677-T1679 VanDerWaalsContact C-N 3.3Å; G1677-T1679 PolarHBondContact O-N 2.74Å; G1677-L1680 WeakPolarHBondContact O-CB 3.34Å; G1677-L1680 PolarHBondContact O-N 3.46Å; G1677-L1680 VanDerWaalsContact O-N 3.12Å; G1677-L1681 PolarHBondContact O-N 3.36Å; G1677-Y1724 VanDerWaalsContact C-OH 3.28Å; G1677-Y1724 VanDerWaalsContact CA-OH 3.3Å; G1677-Y1724 WeakPolarHBondContact CA-OH 3.34Å
1678	L	65.8	Low	74.3	Confident	98.4 Å²	98.4	37.5 Å²	37.5	52%	0.515	20%	0.201	S	C	.	.	H	α-helix	trans	-72.3	-38.8	175.9	-78.7	166	0	0	0	112.2	Y1676 L1680 L1681 D1682 Y1724	Y1676-L1678 VanDerWaalsContact C-N 3.3Å; Y1676-L1678 PolarHBondContact O-N 3.2Å; Y1676-L1678 VanDerWaalsContact O-N 3.14Å; L1678-L1680 VanDerWaalsContact C-N 3.25Å; L1678-L1680 PolarHBondContact O-N 3.24Å; L1678-L1681 PolarHBondContact O-N 2.91Å; L1678-D1682 PolarHBondContact O-N 3.16Å; L1678-Y1724 HydrophobicContact CD1-CE1 3.89Å; L1678-Y1724 HydrophobicContact CD2-CD1 4.42Å; L1678-Y1724 HydrophobicContact CD2-CE1 3.85Å; L1678-Y1724 HydrophobicContact CG-CE1 3.89Å; L1678-Y1724 WeakPolarHBondContact CG-OH 3.39Å; L1678-Y1724 PolarHBondContact N-OH 3.15Å; L1678-Y1724 VanDerWaalsContact N-OH 3.12Å
1679	T	71.4	Confident	73.5	Confident	48.4 Å²	48.4	41.4 Å²	41.4	30%	0.297	23%	0.226	S	C	.	.	H	α-helix	trans	-65.1	-29.8	176.1	42.8	0	0	0	0	111.7	Y1676 G1677 D1682 D1683	Y1676-T1679 WeakPolarHBondContact CA-OG1 3.32Å; Y1676-T1679 WeakPolarHBondContact CB-OG1 3.45Å; Y1676-T1679 PolarHBondContact O-N 3.15Å; Y1676-T1679 PolarHBondContact O-OG1 3.23Å; G1677-T1679 VanDerWaalsContact C-N 3.3Å; G1677-T1679 PolarHBondContact O-N 2.74Å; T1679-D1682 CarbonylContact O-C 3.54Å; T1679-D1682 WeakPolarHBondContact O-CB 3.32Å; T1679-D1682 PolarHBondContact O-N 3.1Å; T1679-D1683 WeakPolarHBondContact O-CB 3.31Å; T1679-D1683 VanDerWaalsContact O-CG 3.25Å; T1679-D1683 PolarHBondContact O-N 3.23Å
1680	L	77	Confident	72.7	Confident	4.2 Å²	4.2	42.5 Å²	42.5	2%	0.022	23%	0.233	C	C	.	.	H	α-helix	trans	-64.2	-42.1	176.6	-174.1	93.9	0	0	0	112.7	I1646 L1662 F1667 L1668 Q1671 Y1676 G1677 L1678 D1682 D1683 M1684 L1720	I1646-L1680 HydrophobicContact CD1-CD1 4.19Å; L1662-L1680 HydrophobicContact CD2-CD1 3.98Å; L1662-L1680 HydrophobicContact CD2-CD2 4.39Å; L1662-L1680 HydrophobicContact CD2-CG 4.37Å; F1667-L1680 HydrophobicContact CE1-CD1 4.1Å; L1668-L1680 HydrophobicContact CB-CD2 4.44Å; L1668-L1680 HydrophobicContact CD2-CD1 3.71Å; L1668-L1680 VanDerWaalsContact CD2-CD1 3.42Å; L1668-L1680 HydrophobicContact CD2-CD2 3.4Å; L1668-L1680 VanDerWaalsContact CD2-CD2 3.49Å; L1668-L1680 HydrophobicContact CD2-CG 4.03Å; L1668-L1680 HydrophobicContact CG-CD2 4.47Å; Q1671-L1680 HydrophobicContact CB-CD1 3.98Å; Q1671-L1680 HydrophobicContact CB-CD2 4.33Å; Q1671-L1680 HydrophobicContact CG-CD1 4.05Å; Y1676-L1680 WeakPolarHBondContact O-CB 3.48Å; Y1676-L1680 PolarHBondContact O-N 3.1Å; Y1676-L1680 VanDerWaalsContact O-N 3.11Å; G1677-L1680 WeakPolarHBondContact O-CB 3.34Å; G1677-L1680 PolarHBondContact O-N 3.46Å; G1677-L1680 VanDerWaalsContact O-N 3.12Å; L1678-L1680 VanDerWaalsContact C-N 3.25Å; L1678-L1680 PolarHBondContact O-N 3.24Å; L1680-D1682 VanDerWaalsContact C-N 3.31Å; L1680-D1682 PolarHBondContact O-N 3Å; L1680-D1683 PolarHBondContact O-N 3.14Å; L1680-M1684 HydrophobicContact CD1-CE 4.4Å; L1680-M1684 HydrophobicContact CD2-CE 4Å; L1680-M1684 HydrophobicContact CD2-CG 4.03Å; L1680-M1684 HydrophobicContact CG-CE 4.36Å; L1680-M1684 WeakPolarHBondContact O-CB 3.48Å; L1680-M1684 WeakPolarHBondContact O-CG 3.31Å; L1680-M1684 PolarHBondContact O-N 3.15Å; L1680-L1720 HydrophobicContact CD2-CD1 3.89Å; L1680-L1720 VanDerWaalsContact CD2-CD1 3.45Å
1681	L	75.5	Confident	71.9	Confident	23.4 Å²	23.4	41.1 Å²	41.1	12%	0.123	23%	0.228	C	C	.	.	H	α-helix	trans	-64.6	-37.9	175.2	-70.3	173.3	0	0	0	111.7	G1677 L1678 N1685 Q1717 L1720 A1721 Y1724	G1677-L1681 PolarHBondContact O-N 3.36Å; L1678-L1681 PolarHBondContact O-N 2.91Å; L1681-N1685 WeakPolarHBondContact O-CB 3.33Å; L1681-N1685 PolarHBondContact O-N 3.17Å; L1681-N1685 VanDerWaalsContact O-N 3.09Å; L1681-N1685 PolarHBondContact O-ND2 3.2Å; L1681-N1685 VanDerWaalsContact O-ND2 3.09Å; L1681-Q1717 HydrophobicContact CD2-CG 3.94Å; L1681-L1720 HydrophobicContact CD2-CB 4.16Å; L1681-A1721 HydrophobicContact CD2-CB 4.46Å; L1681-Y1724 HydrophobicContact CD1-CD2 4.39Å
1682	D	72.7	Confident	70.8	Confident	63.2 Å²	63.2	43.9 Å²	43.9	34%	0.338	25%	0.245	S	C	.	.	H	α-helix	trans	-66.4	-40.6	174.3	-87.4	-2.6	0	0	0	111.9	L1678 T1679 L1680 N1685 R1686 K1839	L1678-D1682 PolarHBondContact O-N 3.16Å; T1679-D1682 CarbonylContact O-C 3.54Å; T1679-D1682 WeakPolarHBondContact O-CB 3.32Å; T1679-D1682 PolarHBondContact O-N 3.1Å; L1680-D1682 VanDerWaalsContact C-N 3.31Å; L1680-D1682 PolarHBondContact O-N 3Å; D1682-N1685 WeakPolarHBondContact O-CB 2.92Å; D1682-N1685 PolarHBondContact O-N 3.06Å; D1682-R1686 WeakPolarHBondContact O-CB 3.41Å; D1682-R1686 VanDerWaalsContact O-CG 3.28Å; D1682-R1686 WeakPolarHBondContact O-CG 3.38Å; D1682-R1686 PolarHBondContact O-N 3.15Å; D1682-R1686 IonicContact OD2-CZ 3.38Å; D1682-R1686 IonicContact OD2-NE 3.98Å; D1682-R1686 IonicContact OD2-NH2 3.8Å; D1682-R1686 PolarHBondContact OD2-NH2 2.9Å; D1682-K1839 IonicContact OD1-NZ 3.91Å; D1682-K1839 PolarHBondContact OD1-NZ 3.27Å; D1682-K1839 IonicContact OD2-NZ 3.33Å; D1682-K1839 PolarHBondContact OD2-NZ 3.06Å
1683	D	74.5	Confident	69.6	Low	18 Å²	18	46.6 Å²	46.6	10%	0.096	27%	0.269	C	S	.	.	H	α-helix	trans	-68.6	-39.4	177.6	-72.2	-25.8	0	0	0	111.5	I1646 T1679 L1680 N1685 R1686 Y1687	I1646-D1683 HydrophobicContact CD1-CB 4.2Å; I1646-D1683 HydrophobicContact CG2-CB 4.04Å; T1679-D1683 WeakPolarHBondContact O-CB 3.31Å; T1679-D1683 VanDerWaalsContact O-CG 3.25Å; T1679-D1683 PolarHBondContact O-N 3.23Å; L1680-D1683 PolarHBondContact O-N 3.14Å; D1683-N1685 VanDerWaalsContact C-N 3.33Å; D1683-N1685 PolarHBondContact O-N 2.94Å; D1683-R1686 WeakPolarHBondContact O-CB 3.47Å; D1683-R1686 PolarHBondContact O-N 3.29Å; D1683-R1686 VanDerWaalsContact O-N 3.13Å; D1683-R1686 IonicContact OD1-CZ 3.65Å; D1683-R1686 IonicContact OD1-NE 3.7Å; D1683-R1686 IonicContact OD1-NH1 3.49Å; D1683-R1686 PolarHBondContact OD1-NH1 3.07Å; D1683-R1686 VanDerWaalsContact OD1-NH1 3.11Å; D1683-R1686 IonicContact OD1-NH2 3.65Å; D1683-R1686 PolarHBondContact OD1-NH2 2.95Å; D1683-Y1687 HydrophobicContact CB-CD2 4.45Å; D1683-Y1687 HydrophobicContact CB-CE2 4Å; D1683-Y1687 WeakPolarHBondContact O-CB 3.34Å; D1683-Y1687 WeakPolarHBondContact O-CD2 3.48Å; D1683-Y1687 PolarHBondContact O-N 3.06Å
1684	M	78.1	Confident	68.4	Low	0 Å²	0	48.9 Å²	48.9	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-58.5	-46.7	170.5	-70.5	-146.2	-177.9	0	0	111.5	L1662 L1668 L1680 R1686 Y1687 I1688 I1713 M1716 Q1717 L1720	L1662-M1684 HydrophobicContact CB-CE 4.01Å; L1662-M1684 HydrophobicContact CB-SD 4.02Å; L1662-M1684 HydrophobicContact CD1-CG 4.33Å; L1662-M1684 HydrophobicContact CD1-SD 4.03Å; L1662-M1684 HydrophobicContact CD2-CE 4.04Å; L1662-M1684 HydrophobicContact CD2-CG 3.94Å; L1662-M1684 HydrophobicContact CD2-SD 4.23Å; L1662-M1684 HydrophobicContact CG-CE 4.41Å; L1662-M1684 HydrophobicContact CG-CG 4.46Å; L1662-M1684 HydrophobicContact CG-SD 4.2Å; L1662-M1684 WeakPolarHBondContact O-CE 3.37Å; L1668-M1684 HydrophobicContact CD2-CE 3.83Å; L1680-M1684 HydrophobicContact CD1-CE 4.4Å; L1680-M1684 HydrophobicContact CD2-CE 4Å; L1680-M1684 HydrophobicContact CD2-CG 4.03Å; L1680-M1684 HydrophobicContact CG-CE 4.36Å; L1680-M1684 WeakPolarHBondContact O-CB 3.48Å; L1680-M1684 WeakPolarHBondContact O-CG 3.31Å; L1680-M1684 PolarHBondContact O-N 3.15Å; M1684-R1686 VanDerWaalsContact C-N 3.27Å; M1684-R1686 PolarHBondContact O-N 2.89Å; M1684-Y1687 WeakPolarHBondContact O-CB 3.32Å; M1684-Y1687 PolarHBondContact O-N 3.21Å; M1684-I1688 WeakPolarHBondContact O-CD1 3.28Å; M1684-I1688 VanDerWaalsContact O-CG1 3.27Å; M1684-I1688 WeakPolarHBondContact O-CG1 3.38Å; M1684-I1688 PolarHBondContact O-N 3.18Å; M1684-I1688 VanDerWaalsContact O-N 3.07Å; M1684-I1713 HydrophobicContact CB-CG2 4.22Å; M1684-I1713 HydrophobicContact CG-CG2 4.27Å; M1684-I1713 HydrophobicContact SD-CG2 3.75Å; M1684-M1716 HydrophobicContact CE-CB 4.42Å; M1684-M1716 HydrophobicContact CE-CG 4.03Å; M1684-Q1717 HydrophobicContact CB-CG 4.41Å; M1684-Q1717 HydrophobicContact SD-CB 4.05Å; M1684-Q1717 HydrophobicContact SD-CG 4.15Å; M1684-L1720 HydrophobicContact CE-CD1 3.91Å; M1684-L1720 HydrophobicContact SD-CD1 4.13Å
1685	N	75.3	Confident	67.2	Low	48.6 Å²	48.6	50.2 Å²	50.2	26%	0.26	28%	0.28	S	S	.	.	H	α-helix	trans	-61.8	-41.7	176	-84.4	-37.1	0	0	0	112.6	L1681 D1682 D1683 Y1687 I1688 T1689 Q1717 S1837	L1681-N1685 WeakPolarHBondContact O-CB 3.33Å; L1681-N1685 PolarHBondContact O-N 3.17Å; L1681-N1685 VanDerWaalsContact O-N 3.09Å; L1681-N1685 PolarHBondContact O-ND2 3.2Å; L1681-N1685 VanDerWaalsContact O-ND2 3.09Å; D1682-N1685 WeakPolarHBondContact O-CB 2.92Å; D1682-N1685 PolarHBondContact O-N 3.06Å; D1683-N1685 VanDerWaalsContact C-N 3.33Å; D1683-N1685 PolarHBondContact O-N 2.94Å; N1685-Y1687 VanDerWaalsContact C-N 3.31Å; N1685-Y1687 PolarHBondContact O-N 3.07Å; N1685-I1688 PolarHBondContact O-N 3.18Å; N1685-T1689 WeakPolarHBondContact O-CB 3.34Å; N1685-T1689 WeakPolarHBondContact O-CG2 3.39Å; N1685-T1689 PolarHBondContact O-N 3.18Å; N1685-T1689 VanDerWaalsContact O-N 3.14Å; N1685-T1689 PolarHBondContact O-OG1 3.07Å; N1685-Q1717 PolarHBondContact ND2-NE2 3.08Å; N1685-Q1717 VanDerWaalsContact ND2-NE2 3.16Å; N1685-Q1717 PolarHBondContact OD1-NE2 3.14Å; N1685-S1837 VanDerWaalsContact ND2-CA 3.28Å; N1685-S1837 WeakPolarHBondContact ND2-CA 3.48Å; N1685-S1837 WeakPolarHBondContact ND2-CB 3.49Å
1686	R	71.8	Confident	66.2	Low	107.4 Å²	107.4	55.9 Å²	55.9	41%	0.405	29%	0.291	S	S	.	.	H	α-helix	trans	-64	-40.4	176	-78.1	179.9	-160.5	163.1	3.6	111.8	D1682 D1683 M1684 I1688 T1689 T1690	D1682-R1686 WeakPolarHBondContact O-CB 3.41Å; D1682-R1686 VanDerWaalsContact O-CG 3.28Å; D1682-R1686 WeakPolarHBondContact O-CG 3.38Å; D1682-R1686 PolarHBondContact O-N 3.15Å; D1682-R1686 IonicContact OD2-CZ 3.38Å; D1682-R1686 IonicContact OD2-NE 3.98Å; D1682-R1686 IonicContact OD2-NH2 3.8Å; D1682-R1686 PolarHBondContact OD2-NH2 2.9Å; D1683-R1686 WeakPolarHBondContact O-CB 3.47Å; D1683-R1686 PolarHBondContact O-N 3.29Å; D1683-R1686 VanDerWaalsContact O-N 3.13Å; D1683-R1686 IonicContact OD1-CZ 3.65Å; D1683-R1686 IonicContact OD1-NE 3.7Å; D1683-R1686 IonicContact OD1-NH1 3.49Å; D1683-R1686 PolarHBondContact OD1-NH1 3.07Å; D1683-R1686 VanDerWaalsContact OD1-NH1 3.11Å; D1683-R1686 IonicContact OD1-NH2 3.65Å; D1683-R1686 PolarHBondContact OD1-NH2 2.95Å; M1684-R1686 VanDerWaalsContact C-N 3.27Å; M1684-R1686 PolarHBondContact O-N 2.89Å; R1686-I1688 PolarHBondContact O-N 3.08Å; R1686-T1689 WeakPolarHBondContact CA-OG1 3.32Å; R1686-T1689 PolarHBondContact O-N 3.19Å; R1686-T1689 PolarHBondContact O-OG1 3.17Å; R1686-T1689 VanDerWaalsContact O-OG1 3.14Å; R1686-T1690 WeakPolarHBondContact O-CB 3.38Å; R1686-T1690 VanDerWaalsContact O-CG2 3.28Å; R1686-T1690 WeakPolarHBondContact O-CG2 3.29Å; R1686-T1690 PolarHBondContact O-N 3.16Å; R1686-T1690 PolarHBondContact O-OG1 3.2Å
1687	Y	73.1	Confident	65.1	Low	7.6 Å²	7.6	57.1 Å²	57.1	3%	0.03	31%	0.31	C	S	.	.	H	α-helix	trans	-64.2	-43.9	175.5	-160.1	-82.3	0	0	0	111.9	I1646 H1650 L1655 V1658 V1659 L1662 D1683 M1684 N1685 T1689 T1690 T1691 L1706 I1713	I1646-Y1687 HydrophobicContact CB-CE2 4.42Å; I1646-Y1687 HydrophobicContact CG2-CD2 4.27Å; I1646-Y1687 HydrophobicContact CG2-CE2 3.37Å; I1646-Y1687 WeakPolarHBondContact CG2-OH 3.29Å; I1646-Y1687 PolarHBondContact O-OH 3.49Å; H1650-Y1687 HydrophobicContact CB-CE1 3.6Å; H1650-Y1687 AromaticContact CD2-CD1 3.38Å; H1650-Y1687 WeakPolarHBondContact CD2-CD1 3.47Å; H1650-Y1687 AromaticContact CD2-CD2 3.83Å; H1650-Y1687 AromaticContact CD2-CE1 3.23Å; H1650-Y1687 WeakPolarHBondContact CD2-CE1 3.34Å; H1650-Y1687 AromaticContact CG-CE1 3.35Å; H1650-Y1687 AromaticContact ND1-CE1 3.99Å; H1650-Y1687 AromaticContact NE2-CD1 3.77Å; H1650-Y1687 AromaticContact NE2-CE1 3.82Å; L1655-Y1687 HydrophobicContact CB-CE2 4.22Å; L1655-Y1687 HydrophobicContact CD2-CD2 4.41Å; L1655-Y1687 HydrophobicContact CD2-CE2 3.94Å; L1655-Y1687 PolarHBondContact O-OH 3.48Å; V1658-Y1687 HydrophobicContact CB-CD2 4.35Å; V1658-Y1687 HydrophobicContact CB-CE2 4.16Å; V1658-Y1687 HydrophobicContact CG1-CD2 3.61Å; V1658-Y1687 VanDerWaalsContact CG1-CD2 3.5Å; V1658-Y1687 HydrophobicContact CG1-CE2 3.88Å; V1658-Y1687 HydrophobicContact CG1-CG 4.41Å; V1659-Y1687 HydrophobicContact CG2-CE1 3.96Å; V1659-Y1687 HydrophobicContact CG2-CE2 4.07Å; V1659-Y1687 VanDerWaalsContact CG2-OH 3.23Å; V1659-Y1687 WeakPolarHBondContact CG2-OH 3.38Å; L1662-Y1687 HydrophobicContact CD1-CD2 4.09Å; L1662-Y1687 HydrophobicContact CD1-CG 4.35Å; D1683-Y1687 HydrophobicContact CB-CD2 4.45Å; D1683-Y1687 HydrophobicContact CB-CE2 4Å; D1683-Y1687 WeakPolarHBondContact O-CB 3.34Å; D1683-Y1687 WeakPolarHBondContact O-CD2 3.48Å; D1683-Y1687 PolarHBondContact O-N 3.06Å; M1684-Y1687 WeakPolarHBondContact O-CB 3.32Å; M1684-Y1687 PolarHBondContact O-N 3.21Å; N1685-Y1687 VanDerWaalsContact C-N 3.31Å; N1685-Y1687 PolarHBondContact O-N 3.07Å; Y1687-T1689 VanDerWaalsContact C-N 3.3Å; Y1687-T1689 PolarHBondContact O-N 3.01Å; Y1687-T1690 PolarHBondContact O-OG1 3.03Å; Y1687-T1690 VanDerWaalsContact O-OG1 3.07Å; Y1687-T1691 HydrophobicContact CD1-CG2 4.22Å; Y1687-T1691 HydrophobicContact CE1-CG2 3.83Å; Y1687-T1691 WeakPolarHBondContact CE1-OG1 3.17Å; Y1687-T1691 HydrophobicContact CE2-CG2 4.33Å; Y1687-T1691 VanDerWaalsContact O-CB 3.32Å; Y1687-T1691 WeakPolarHBondContact O-CB 3.31Å; Y1687-T1691 VanDerWaalsContact O-CG2 3.28Å; Y1687-T1691 WeakPolarHBondContact O-CG2 3.42Å; Y1687-T1691 PolarHBondContact O-N 3.01Å; Y1687-T1691 VanDerWaalsContact O-N 3.12Å; Y1687-T1691 PolarHBondContact O-OG1 3.11Å; Y1687-L1706 VanDerWaalsContact OH-CD2 3.25Å; Y1687-L1706 WeakPolarHBondContact OH-CD2 3.1Å; Y1687-I1713 HydrophobicContact CD1-CD1 3.41Å; Y1687-I1713 VanDerWaalsContact CD1-CD1 3.43Å; Y1687-I1713 HydrophobicContact CE1-CD1 3.41Å; Y1687-I1713 VanDerWaalsContact CE1-CD1 3.41Å; Y1687-I1713 HydrophobicContact CG-CD1 4.28Å
1688	I	72.3	Confident	64.1	Low	18.2 Å²	18.2	64.5 Å²	64.5	9%	0.093	34%	0.343	C	S	.	.	H	α-helix	trans	-61.4	-42	177.5	-66.6	162.5	0	0	0	111	M1684 N1685 R1686 T1691 T1692 R1710 I1713 R1714 Q1717	M1684-I1688 WeakPolarHBondContact O-CD1 3.28Å; M1684-I1688 VanDerWaalsContact O-CG1 3.27Å; M1684-I1688 WeakPolarHBondContact O-CG1 3.38Å; M1684-I1688 PolarHBondContact O-N 3.18Å; M1684-I1688 VanDerWaalsContact O-N 3.07Å; N1685-I1688 PolarHBondContact O-N 3.18Å; R1686-I1688 PolarHBondContact O-N 3.08Å; I1688-T1691 PolarHBondContact O-OG1 3.25Å; I1688-T1691 VanDerWaalsContact O-OG1 3.09Å; I1688-T1692 WeakPolarHBondContact O-CG2 3.3Å; I1688-T1692 PolarHBondContact O-N 3.35Å; I1688-T1692 VanDerWaalsContact O-N 3.13Å; I1688-T1692 PolarHBondContact O-OG1 3.2Å; I1688-R1710 HydrophobicContact CG1-CG 4.44Å; I1688-R1710 HydrophobicContact CG2-CG 4.41Å; I1688-I1713 HydrophobicContact CD1-CG2 4.11Å; I1688-I1713 HydrophobicContact CG1-CG2 4.15Å; I1688-R1714 HydrophobicContact CD1-CG 3.82Å; I1688-R1714 HydrophobicContact CG1-CG 4.36Å; I1688-Q1717 VanDerWaalsContact CD1-OE1 3.23Å
1689	T	68.3	Low	62.9	Low	82.4 Å²	82.4	65.2 Å²	65.2	51%	0.506	36%	0.357	S	S	.	.	H	α-helix	trans	-78.3	-38.4	-177.4	49.6	0	0	0	0	113.9	N1685 R1686 Y1687 T1691 T1692 A1693	N1685-T1689 WeakPolarHBondContact O-CB 3.34Å; N1685-T1689 WeakPolarHBondContact O-CG2 3.39Å; N1685-T1689 PolarHBondContact O-N 3.18Å; N1685-T1689 VanDerWaalsContact O-N 3.14Å; N1685-T1689 PolarHBondContact O-OG1 3.07Å; R1686-T1689 WeakPolarHBondContact CA-OG1 3.32Å; R1686-T1689 PolarHBondContact O-N 3.19Å; R1686-T1689 PolarHBondContact O-OG1 3.17Å; R1686-T1689 VanDerWaalsContact O-OG1 3.14Å; Y1687-T1689 VanDerWaalsContact C-N 3.3Å; Y1687-T1689 PolarHBondContact O-N 3.01Å; T1689-T1691 VanDerWaalsContact C-N 3.3Å; T1689-T1691 PolarHBondContact O-N 3.05Å; T1689-T1692 WeakPolarHBondContact CA-OG1 3.3Å; T1689-T1692 PolarHBondContact O-N 3.11Å; T1689-T1692 PolarHBondContact O-OG1 3.04Å; T1689-A1693 PolarHBondContact O-N 3Å; T1689-A1693 VanDerWaalsContact O-N 3.15Å
1690	T	64.1	Low	61.7	Low	45.4 Å²	45.4	69.2 Å²	69.2	28%	0.279	38%	0.377	S	S	.	.	H	α-helix	trans	-69.1	-36.2	179.4	48.8	0	0	0	0	112.4	H1650 R1686 Y1687 T1692 A1693 H1694	H1650-T1690 PolarHBondContact CE1-OG1 3.03Å; H1650-T1690 VanDerWaalsContact NE2-CG2 3.31Å; H1650-T1690 WeakPolarHBondContact NE2-CG2 3.31Å; H1650-T1690 PolarHBondContact NE2-OG1 3.29Å; R1686-T1690 WeakPolarHBondContact O-CB 3.38Å; R1686-T1690 VanDerWaalsContact O-CG2 3.28Å; R1686-T1690 WeakPolarHBondContact O-CG2 3.29Å; R1686-T1690 PolarHBondContact O-N 3.16Å; R1686-T1690 PolarHBondContact O-OG1 3.2Å; Y1687-T1690 PolarHBondContact O-OG1 3.03Å; Y1687-T1690 VanDerWaalsContact O-OG1 3.07Å; T1690-T1692 VanDerWaalsContact C-N 3.31Å; T1690-T1692 PolarHBondContact O-N 3.25Å; T1690-A1693 PolarHBondContact O-N 3.32Å; T1690-A1693 VanDerWaalsContact O-N 3.15Å; T1690-H1694 PolarHBondContact O-CD2 3.34Å; T1690-H1694 PolarHBondContact O-N 2.88Å
1691	T	60.1	Low	60.2	Low	9.6 Å²	9.6	77.2 Å²	77.2	6%	0.059	42%	0.419	C	S	.	.	H	α-helix	trans	-65	-33.1	177.4	39.7	0	0	0	0	112	Y1687 I1688 T1689 A1693 H1694 H1695 L1706 R1710	Y1687-T1691 HydrophobicContact CD1-CG2 4.22Å; Y1687-T1691 HydrophobicContact CE1-CG2 3.83Å; Y1687-T1691 WeakPolarHBondContact CE1-OG1 3.17Å; Y1687-T1691 HydrophobicContact CE2-CG2 4.33Å; Y1687-T1691 VanDerWaalsContact O-CB 3.32Å; Y1687-T1691 WeakPolarHBondContact O-CB 3.31Å; Y1687-T1691 VanDerWaalsContact O-CG2 3.28Å; Y1687-T1691 WeakPolarHBondContact O-CG2 3.42Å; Y1687-T1691 PolarHBondContact O-N 3.01Å; Y1687-T1691 VanDerWaalsContact O-N 3.12Å; Y1687-T1691 PolarHBondContact O-OG1 3.11Å; I1688-T1691 PolarHBondContact O-OG1 3.25Å; I1688-T1691 VanDerWaalsContact O-OG1 3.09Å; T1689-T1691 VanDerWaalsContact C-N 3.3Å; T1689-T1691 PolarHBondContact O-N 3.05Å; T1691-A1693 VanDerWaalsContact C-N 3.3Å; T1691-A1693 PolarHBondContact O-N 3.22Å; T1691-H1694 PolarHBondContact O-N 3.07Å; T1691-H1695 PolarHBondContact O-CD2 3.21Å; T1691-H1695 VanDerWaalsContact O-CD2 3.25Å; T1691-H1695 PolarHBondContact O-N 3.11Å; T1691-L1706 HydrophobicContact CG2-CB 4.47Å; T1691-L1706 HydrophobicContact CG2-CD2 3.77Å; T1691-R1710 VanDerWaalsContact CB-NH2 3.26Å; T1691-R1710 PolarHBondContact O-NH2 3.48Å; T1691-R1710 PolarHBondContact OG1-NE 3.11Å; T1691-R1710 PolarHBondContact OG1-NH2 3.2Å; T1691-R1710 VanDerWaalsContact OG1-NH2 3.11Å
1692	T	56	Low	58.8	Low	64.6 Å²	64.6	82.6 Å²	82.6	40%	0.396	45%	0.447	S	S	.	.	H	α-helix	trans	-68.2	-28.9	176	53.8	0	0	0	0	113.7	I1688 T1689 T1690 H1695 Q1696	I1688-T1692 WeakPolarHBondContact O-CG2 3.3Å; I1688-T1692 PolarHBondContact O-N 3.35Å; I1688-T1692 VanDerWaalsContact O-N 3.13Å; I1688-T1692 PolarHBondContact O-OG1 3.2Å; T1689-T1692 WeakPolarHBondContact CA-OG1 3.3Å; T1689-T1692 PolarHBondContact O-N 3.11Å; T1689-T1692 PolarHBondContact O-OG1 3.04Å; T1690-T1692 VanDerWaalsContact C-N 3.31Å; T1690-T1692 PolarHBondContact O-N 3.25Å; T1692-H1695 PolarHBondContact O-N 3.14Å; T1692-Q1696 PolarHBondContact O-N 3.48Å; T1692-Q1696 PolarHBondContact O-NE2 3.5Å
1693	A	52.8	Low	57.7	Low	66.4 Å²	66.4	84.2 Å²	84.2	55%	0.549	46%	0.461	S	S	.	.	H	α-helix	trans	-78.8	-37.3	-179.5	0	0	0	0	0	113.2	T1689 T1690 T1691 H1695 Q1696	T1689-A1693 PolarHBondContact O-N 3Å; T1689-A1693 VanDerWaalsContact O-N 3.15Å; T1690-A1693 PolarHBondContact O-N 3.32Å; T1690-A1693 VanDerWaalsContact O-N 3.15Å; T1691-A1693 VanDerWaalsContact C-N 3.3Å; T1691-A1693 PolarHBondContact O-N 3.22Å; A1693-H1695 VanDerWaalsContact C-N 3.32Å; A1693-H1695 PolarHBondContact O-N 3.01Å; A1693-Q1696 PolarHBondContact O-N 2.78Å
1694	H	51.6	Low	56.8	Low	138.6 Å²	138.6	86.1 Å²	86.1	64%	0.642	47%	0.473	S	S	*	.	H	α-helix	trans	-76.6	-28.7	-177.4	-82	-65.2	0	0	0	114.2	T1690 T1691 Q1696 S1697	T1690-H1694 PolarHBondContact O-CD2 3.34Å; T1690-H1694 PolarHBondContact O-N 2.88Å; T1691-H1694 PolarHBondContact O-N 3.07Å; H1694-Q1696 VanDerWaalsContact C-N 3.29Å; H1694-Q1696 PolarHBondContact O-N 3.2Å; H1694-S1697 PolarHBondContact O-N 2.6Å; H1694-S1697 VanDerWaalsContact O-N 3.13Å; H1694-S1697 PolarHBondContact O-OG 3.2Å
1695	H	46.8	Very low	55.9	Low	77.4 Å²	77.4	89.1 Å²	89.1	36%	0.358	49%	0.494	S	S	.	.	H	α-helix	trans	-84.2	-9.4	-178.7	-75.8	-60.2	0	0	0	115.1	T1691 T1692 A1693 S1697 E1698 T1704 D1707 R1710	T1691-H1695 PolarHBondContact O-CD2 3.21Å; T1691-H1695 VanDerWaalsContact O-CD2 3.25Å; T1691-H1695 PolarHBondContact O-N 3.11Å; T1692-H1695 PolarHBondContact O-N 3.14Å; A1693-H1695 VanDerWaalsContact C-N 3.32Å; A1693-H1695 PolarHBondContact O-N 3.01Å; H1695-S1697 PolarHBondContact O-N 3.01Å; H1695-S1697 VanDerWaalsContact O-N 3.13Å; H1695-E1698 PolarHBondContact O-N 3.29Å; H1695-E1698 VanDerWaalsContact O-N 3.13Å; H1695-T1704 PolarHBondContact CE1-OG1 3.03Å; H1695-T1704 VanDerWaalsContact CE1-OG1 3.31Å; H1695-T1704 PolarHBondContact NE2-OG1 3.46Å; H1695-D1707 IonicContact NE2-OD1 2.77Å; H1695-R1710 PolarHBondContact CD2-NH2 3.16Å; H1695-R1710 VanDerWaalsContact CD2-NH2 3.31Å
1696	Q	47	Very low	55.3	Low	178.4 Å²	178.4	88.2 Å²	88.2	83%	0.834	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-7.6	175.5	-71.2	-173.3	-3.8	0	0	113.6	T1692 A1693 H1694	T1692-Q1696 PolarHBondContact O-N 3.48Å; T1692-Q1696 PolarHBondContact O-NE2 3.5Å; A1693-Q1696 PolarHBondContact O-N 2.78Å; H1694-Q1696 VanDerWaalsContact C-N 3.29Å; H1694-Q1696 PolarHBondContact O-N 3.2Å
1697	S	46.7	Very low	54.9	Low	97.8 Å²	97.8	85.5 Å²	85.5	68%	0.684	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	-8.8	-177	56.7	0	0	0	0	116.1	H1694 H1695	H1694-S1697 PolarHBondContact O-N 2.6Å; H1694-S1697 VanDerWaalsContact O-N 3.13Å; H1694-S1697 PolarHBondContact O-OG 3.2Å; H1695-S1697 PolarHBondContact O-N 3.01Å; H1695-S1697 VanDerWaalsContact O-N 3.13Å
1698	E	45	Very low	54.5	Low	155.8 Å²	155.8	89.8 Å²	89.8	73%	0.728	51%	0.506	S	S	*	.			trans	-116	109.8	178.6	-70.8	-169.9	166.4	0	0	112	H1695 N1700	H1695-E1698 PolarHBondContact O-N 3.29Å; H1695-E1698 VanDerWaalsContact O-N 3.13Å; E1698-N1700 VanDerWaalsContact C-N 3.29Å; E1698-N1700 PolarHBondContact O-N 3.18Å; E1698-N1700 VanDerWaalsContact O-N 3.11Å
1699	S	39.9	Very low	54.4	Low	114 Å²	114	89.2 Å²	89.2	80%	0.797	50%	0.502	S	S	*	.			trans	-80.7	43	-169.6	63.4	0	0	0	0	115
1700	N	46	Very low	54.7	Low	133.2 Å²	133.2	86.7 Å²	86.7	71%	0.712	48%	0.484	S	S	*	.			trans	-122.3	112.3	178	-74.1	-27	0	0	0	111.1	E1698 I1702	E1698-N1700 VanDerWaalsContact C-N 3.29Å; E1698-N1700 PolarHBondContact O-N 3.18Å; E1698-N1700 VanDerWaalsContact O-N 3.11Å; N1700-I1702 VanDerWaalsContact C-N 3.3Å; N1700-I1702 PolarHBondContact O-N 3.03Å
1701	N	45.7	Very low	55.3	Low	172.2 Å²	172.2	88.9 Å²	88.9	92%	0.921	49%	0.494	S	S	*	.			trans	-70.1	42.6	-174.3	-72.5	-25.5	0	0	0	115.2
1702	I	46.4	Very low	56.2	Low	135.2 Å²	135.2	89.5 Å²	89.5	69%	0.693	50%	0.496	S	S	*	.			trans	-105.1	118.2	172	-56.7	169.8	0	0	0	106.8	N1700 T1704	N1700-I1702 VanDerWaalsContact C-N 3.3Å; N1700-I1702 PolarHBondContact O-N 3.03Å; I1702-T1704 PolarHBondContact O-N 3.2Å
1703	P	49.6	Very low	57.4	Low	98.2 Å²	98.2	86.5 Å²	86.5	64%	0.638	48%	0.477	S	S	*	.			trans	-59.1	115.7	175.7	24	-30.8	0	0	0	107.9	D1707 L1708	P1703-D1707 WeakPolarHBondContact CA-OD2 3.29Å; P1703-D1707 HydrophobicContact CB-CB 4.41Å; P1703-L1708 HydrophobicContact CG-CD1 4.39Å
1704	T	56.3	Low	58.8	Low	57 Å²	57	87.1 Å²	87.1	35%	0.35	47%	0.465	S	S	.	.			trans	-70.1	155.6	178.6	55.2	0	0	0	0	108.9	H1695 I1702 L1706 D1707 L1708	H1695-T1704 PolarHBondContact CE1-OG1 3.03Å; H1695-T1704 VanDerWaalsContact CE1-OG1 3.31Å; H1695-T1704 PolarHBondContact NE2-OG1 3.46Å; I1702-T1704 PolarHBondContact O-N 3.2Å; T1704-L1706 PolarHBondContact O-N 3.22Å; T1704-D1707 PolarHBondContact N-OD2 3.04Å; T1704-D1707 VanDerWaalsContact N-OD2 3.07Å; T1704-D1707 WeakPolarHBondContact O-CB 3.37Å; T1704-D1707 PolarHBondContact O-N 3.21Å; T1704-D1707 PolarHBondContact OG1-OD2 3Å; T1704-L1708 PolarHBondContact O-N 3.2Å
1705	S	60	Low	60.2	Low	63 Å²	63	80.9 Å²	80.9	44%	0.441	44%	0.437	S	S	.	.	H	α-helix	trans	-50.8	-26.3	175	51.2	0	0	0	0	113	N1656 D1707 L1708 M1709	N1656-S1705 WeakPolarHBondContact OD1-CB 3.08Å; N1656-S1705 PolarHBondContact OD1-OG 3.09Å; S1705-D1707 PolarHBondContact O-N 3.49Å; S1705-L1708 PolarHBondContact O-N 3.1Å; S1705-M1709 VanDerWaalsContact O-CG 3.28Å; S1705-M1709 WeakPolarHBondContact O-CG 3.4Å; S1705-M1709 PolarHBondContact O-N 2.87Å
1706	L	61.3	Low	62	Low	28.8 Å²	28.8	77.3 Å²	77.3	15%	0.151	42%	0.42	C	S	.	.	H	α-helix	trans	-66.3	-33.9	174.8	-98.4	115.2	0	0	0	114.2	L1655 V1659 Y1687 T1691 T1704 M1709 R1710	L1655-L1706 HydrophobicContact CB-CD1 4.17Å; L1655-L1706 HydrophobicContact CB-CD2 4.06Å; L1655-L1706 HydrophobicContact CD1-CD1 4.38Å; L1655-L1706 HydrophobicContact CD1-CD2 3.92Å; L1655-L1706 HydrophobicContact CD2-CD1 4.13Å; L1655-L1706 HydrophobicContact CG-CD1 4.34Å; L1655-L1706 HydrophobicContact CG-CD2 4.48Å; V1659-L1706 HydrophobicContact CG2-CB 4.48Å; V1659-L1706 HydrophobicContact CG2-CD1 3.52Å; V1659-L1706 HydrophobicContact CG2-CG 3.88Å; Y1687-L1706 VanDerWaalsContact OH-CD2 3.25Å; Y1687-L1706 WeakPolarHBondContact OH-CD2 3.1Å; T1691-L1706 HydrophobicContact CG2-CB 4.47Å; T1691-L1706 HydrophobicContact CG2-CD2 3.77Å; T1704-L1706 PolarHBondContact O-N 3.22Å; L1706-M1709 WeakPolarHBondContact O-CB 3.38Å; L1706-M1709 PolarHBondContact O-N 3.11Å; L1706-R1710 WeakPolarHBondContact O-CG 3.42Å; L1706-R1710 PolarHBondContact O-N 3.16Å; L1706-R1710 VanDerWaalsContact O-N 3.11Å
1707	D	64.1	Low	63.7	Low	52.2 Å²	52.2	70 Å²	70	28%	0.279	39%	0.387	S	S	.	.	H	α-helix	trans	-68.5	-42	179.6	-71.6	-47.6	0	0	0	111.3	H1695 P1703 T1704 S1705 M1709 R1710 D1711	H1695-D1707 IonicContact NE2-OD1 2.77Å; P1703-D1707 WeakPolarHBondContact CA-OD2 3.29Å; P1703-D1707 HydrophobicContact CB-CB 4.41Å; T1704-D1707 PolarHBondContact N-OD2 3.04Å; T1704-D1707 VanDerWaalsContact N-OD2 3.07Å; T1704-D1707 WeakPolarHBondContact O-CB 3.37Å; T1704-D1707 PolarHBondContact O-N 3.21Å; T1704-D1707 PolarHBondContact OG1-OD2 3Å; S1705-D1707 PolarHBondContact O-N 3.49Å; D1707-M1709 VanDerWaalsContact C-N 3.27Å; D1707-M1709 PolarHBondContact O-N 3.24Å; D1707-R1710 VanDerWaalsContact O-CB 3.3Å; D1707-R1710 WeakPolarHBondContact O-CB 3.42Å; D1707-R1710 PolarHBondContact O-N 3.18Å; D1707-R1710 VanDerWaalsContact O-N 3.13Å; D1707-R1710 IonicContact OD1-CZ 3.55Å; D1707-R1710 VanDerWaalsContact OD1-CZ 3.28Å; D1707-R1710 IonicContact OD1-NH1 3.51Å; D1707-R1710 PolarHBondContact OD1-NH1 3.14Å; D1707-R1710 VanDerWaalsContact OD1-NH1 3.1Å; D1707-R1710 IonicContact OD1-NH2 3.56Å; D1707-R1710 PolarHBondContact OD1-NH2 3.37Å; D1707-D1711 PolarHBondContact O-N 3.17Å
1708	L	63.7	Low	65.2	Low	97.6 Å²	97.6	71.7 Å²	71.7	51%	0.511	38%	0.378	S	S	.	.	H	α-helix	trans	-60.6	-36.9	174	-126.8	96.2	0	0	0	111.8	P1703 T1704 S1705 R1710 D1711 K1712	P1703-L1708 HydrophobicContact CG-CD1 4.39Å; T1704-L1708 PolarHBondContact O-N 3.2Å; S1705-L1708 PolarHBondContact O-N 3.1Å; L1708-R1710 VanDerWaalsContact C-N 3.33Å; L1708-R1710 PolarHBondContact O-N 3.25Å; L1708-D1711 PolarHBondContact O-N 3.01Å; L1708-K1712 WeakPolarHBondContact O-CG 3.22Å; L1708-K1712 PolarHBondContact O-N 3.02Å
1709	M	71.3	Confident	67.1	Low	4.6 Å²	4.6	64.3 Å²	64.3	2%	0.023	34%	0.343	C	S	.	.	H	α-helix	trans	-78.6	-22	-178.8	-67	-70.1	-86.6	0	0	112.8	V1472 L1474 V1659 T1663 S1705 L1706 D1707 D1711 K1712 I1713 W1746	V1472-M1709 HydrophobicContact CB-CE 4.27Å; V1472-M1709 HydrophobicContact CG1-CE 3.59Å; V1472-M1709 HydrophobicContact CG1-CG 4.34Å; V1472-M1709 HydrophobicContact CG1-SD 3.97Å; V1472-M1709 HydrophobicContact CG2-CE 3.74Å; L1474-M1709 HydrophobicContact CB-CE 4.13Å; L1474-M1709 HydrophobicContact CB-SD 4.39Å; L1474-M1709 HydrophobicContact CD1-CE 3.51Å; L1474-M1709 VanDerWaalsContact CD1-CE 3.47Å; L1474-M1709 HydrophobicContact CD1-SD 4.05Å; L1474-M1709 HydrophobicContact CG-CE 3.91Å; L1474-M1709 HydrophobicContact CG-SD 4.18Å; V1659-M1709 HydrophobicContact CB-CE 3.77Å; V1659-M1709 VanDerWaalsContact CB-CE 3.42Å; V1659-M1709 HydrophobicContact CB-SD 4.3Å; V1659-M1709 HydrophobicContact CG1-CB 3.87Å; V1659-M1709 HydrophobicContact CG1-CE 3.4Å; V1659-M1709 HydrophobicContact CG1-CG 4.07Å; V1659-M1709 HydrophobicContact CG1-SD 3.9Å; V1659-M1709 HydrophobicContact CG2-CB 4.14Å; V1659-M1709 HydrophobicContact CG2-CE 3.97Å; T1663-M1709 HydrophobicContact CG2-CE 3.96Å; S1705-M1709 VanDerWaalsContact O-CG 3.28Å; S1705-M1709 WeakPolarHBondContact O-CG 3.4Å; S1705-M1709 PolarHBondContact O-N 2.87Å; L1706-M1709 WeakPolarHBondContact O-CB 3.38Å; L1706-M1709 PolarHBondContact O-N 3.11Å; D1707-M1709 VanDerWaalsContact C-N 3.27Å; D1707-M1709 PolarHBondContact O-N 3.24Å; M1709-D1711 VanDerWaalsContact C-N 3.31Å; M1709-D1711 PolarHBondContact O-N 3.03Å; M1709-K1712 HydrophobicContact CE-CB 3.82Å; M1709-K1712 HydrophobicContact CE-CD 3.88Å; M1709-K1712 HydrophobicContact CE-CG 4.24Å; M1709-K1712 WeakPolarHBondContact O-CB 3.46Å; M1709-K1712 PolarHBondContact O-N 3.3Å; M1709-K1712 VanDerWaalsContact O-N 3.12Å; M1709-K1712 HydrophobicContact SD-CD 3.95Å; M1709-K1712 VanDerWaalsContact SD-CD 3.52Å; M1709-I1713 WeakPolarHBondContact O-CB 3.15Å; M1709-I1713 WeakPolarHBondContact O-CG1 3.26Å; M1709-I1713 PolarHBondContact O-N 3.25Å; M1709-I1713 VanDerWaalsContact O-N 3.08Å; M1709-W1746 HydrophobicContact CE-CZ2 4.45Å
1710	R	73.9	Confident	69	Low	30.8 Å²	30.8	59 Å²	59	12%	0.116	31%	0.306	C	S	.	.	H	α-helix	trans	-62.2	-41.2	177.4	-157	-178.9	-86.8	136.3	3.5	111.8	I1688 T1691 H1695 L1706 D1707 L1708 K1712 I1713 R1714	I1688-R1710 HydrophobicContact CG1-CG 4.44Å; I1688-R1710 HydrophobicContact CG2-CG 4.41Å; T1691-R1710 VanDerWaalsContact CB-NH2 3.26Å; T1691-R1710 PolarHBondContact O-NH2 3.48Å; T1691-R1710 PolarHBondContact OG1-NE 3.11Å; T1691-R1710 PolarHBondContact OG1-NH2 3.2Å; T1691-R1710 VanDerWaalsContact OG1-NH2 3.11Å; H1695-R1710 PolarHBondContact CD2-NH2 3.16Å; H1695-R1710 VanDerWaalsContact CD2-NH2 3.31Å; L1706-R1710 WeakPolarHBondContact O-CG 3.42Å; L1706-R1710 PolarHBondContact O-N 3.16Å; L1706-R1710 VanDerWaalsContact O-N 3.11Å; D1707-R1710 VanDerWaalsContact O-CB 3.3Å; D1707-R1710 WeakPolarHBondContact O-CB 3.42Å; D1707-R1710 PolarHBondContact O-N 3.18Å; D1707-R1710 VanDerWaalsContact O-N 3.13Å; D1707-R1710 IonicContact OD1-CZ 3.55Å; D1707-R1710 VanDerWaalsContact OD1-CZ 3.28Å; D1707-R1710 IonicContact OD1-NH1 3.51Å; D1707-R1710 PolarHBondContact OD1-NH1 3.14Å; D1707-R1710 VanDerWaalsContact OD1-NH1 3.1Å; D1707-R1710 IonicContact OD1-NH2 3.56Å; D1707-R1710 PolarHBondContact OD1-NH2 3.37Å; L1708-R1710 VanDerWaalsContact C-N 3.33Å; L1708-R1710 PolarHBondContact O-N 3.25Å; R1710-K1712 VanDerWaalsContact C-N 3.31Å; R1710-K1712 PolarHBondContact O-N 3.41Å; R1710-I1713 PolarHBondContact O-N 3.26Å; R1710-R1714 VanDerWaalsContact O-CG 3.32Å; R1710-R1714 WeakPolarHBondContact O-CG 3.36Å; R1710-R1714 PolarHBondContact O-N 3.24Å; R1710-R1714 VanDerWaalsContact O-N 3.1Å
1711	D	77.1	Confident	70.5	Confident	92 Å²	92	54.6 Å²	54.6	49%	0.492	29%	0.289	S	S	.	.	H	α-helix	trans	-68.6	-38.3	179.7	-71.1	-21.6	0	0	0	111.3	D1707 L1708 M1709 I1713 R1714 T1715	D1707-D1711 PolarHBondContact O-N 3.17Å; L1708-D1711 PolarHBondContact O-N 3.01Å; M1709-D1711 VanDerWaalsContact C-N 3.31Å; M1709-D1711 PolarHBondContact O-N 3.03Å; D1711-I1713 PolarHBondContact O-N 3.12Å; D1711-R1714 WeakPolarHBondContact O-CB 3.33Å; D1711-R1714 PolarHBondContact O-N 2.98Å; D1711-R1714 VanDerWaalsContact O-N 3.11Å; D1711-R1714 IonicContact OD1-CZ 3.98Å; D1711-R1714 IonicContact OD1-NH1 3.22Å; D1711-R1714 PolarHBondContact OD1-NH1 3Å; D1711-T1715 WeakPolarHBondContact O-CB 3.33Å; D1711-T1715 VanDerWaalsContact O-CG2 3.31Å; D1711-T1715 WeakPolarHBondContact O-CG2 3.38Å; D1711-T1715 PolarHBondContact O-N 3.07Å; D1711-T1715 PolarHBondContact O-OG1 3.18Å
1712	K	79.9	Confident	72	Confident	22 Å²	22	49.2 Å²	49.2	10%	0.096	26%	0.264	C	S	.	.	H	α-helix	trans	-61.2	-44.1	172.3	-71	-167.4	175.7	-179.3	0	113.3	L1474 D1475 T1663 L1708 M1709 R1710 R1714 T1715 M1716 W1746	L1474-K1712 HydrophobicContact CB-CD 4.34Å; L1474-K1712 PolarHBondContact O-NZ 3.15Å; D1475-K1712 VanDerWaalsContact OD1-CE 3.28Å; D1475-K1712 WeakPolarHBondContact OD1-CE 3.35Å; D1475-K1712 IonicContact OD1-NZ 3.56Å; D1475-K1712 PolarHBondContact OD1-NZ 2.96Å; D1475-K1712 IonicContact OD2-NZ 2.67Å; T1663-K1712 HydrophobicContact CG2-CB 4.44Å; L1708-K1712 WeakPolarHBondContact O-CG 3.22Å; L1708-K1712 PolarHBondContact O-N 3.02Å; M1709-K1712 HydrophobicContact CE-CB 3.82Å; M1709-K1712 HydrophobicContact CE-CD 3.88Å; M1709-K1712 HydrophobicContact CE-CG 4.24Å; M1709-K1712 WeakPolarHBondContact O-CB 3.46Å; M1709-K1712 PolarHBondContact O-N 3.3Å; M1709-K1712 VanDerWaalsContact O-N 3.12Å; M1709-K1712 HydrophobicContact SD-CD 3.95Å; M1709-K1712 VanDerWaalsContact SD-CD 3.52Å; R1710-K1712 VanDerWaalsContact C-N 3.31Å; R1710-K1712 PolarHBondContact O-N 3.41Å; K1712-R1714 VanDerWaalsContact C-N 3.34Å; K1712-R1714 PolarHBondContact O-N 3.16Å; K1712-T1715 WeakPolarHBondContact CA-OG1 3.41Å; K1712-T1715 PolarHBondContact O-N 3Å; K1712-T1715 PolarHBondContact O-OG1 3.39Å; K1712-M1716 WeakPolarHBondContact O-CB 3.43Å; K1712-M1716 PolarHBondContact O-N 3.2Å; K1712-W1746 HydrophobicContact CB-CD2 4.3Å; K1712-W1746 HydrophobicContact CB-CE3 4.09Å; K1712-W1746 HydrophobicContact CB-CH2 3.6Å; K1712-W1746 HydrophobicContact CB-CZ2 3.84Å; K1712-W1746 HydrophobicContact CB-CZ3 3.73Å; K1712-W1746 HydrophobicContact CD-CB 4.48Å; K1712-W1746 HydrophobicContact CD-CD2 3.97Å; K1712-W1746 HydrophobicContact CD-CE3 4.22Å; K1712-W1746 HydrophobicContact CD-CG 4.25Å; K1712-W1746 HydrophobicContact CD-CH2 4.38Å; K1712-W1746 HydrophobicContact CD-CZ2 3.8Å; K1712-W1746 HydrophobicContact CD-CZ3 4.4Å; K1712-W1746 HydrophobicContact CG-CD2 3.91Å; K1712-W1746 HydrophobicContact CG-CE3 3.93Å; K1712-W1746 HydrophobicContact CG-CG 4.39Å; K1712-W1746 HydrophobicContact CG-CH2 4.15Å; K1712-W1746 HydrophobicContact CG-CZ2 3.94Å; K1712-W1746 HydrophobicContact CG-CZ3 4.09Å; K1712-W1746 WeakPolarHBondContact O-CZ3 3.36Å
1713	I	81.2	Confident	73.5	Confident	1.4 Å²	1.4	43.7 Å²	43.7	1%	0.007	24%	0.236	C	C	.	.	H	α-helix	trans	-63	-42.1	175.3	-68.6	172.2	0	0	0	110.6	V1659 L1662 T1663 M1684 Y1687 I1688 M1709 R1710 D1711 T1715 M1716 Q1717	V1659-I1713 HydrophobicContact CB-CD1 4.36Å; V1659-I1713 HydrophobicContact CG1-CD1 4.11Å; V1659-I1713 HydrophobicContact CG1-CG1 4.12Å; V1659-I1713 HydrophobicContact CG2-CD1 4.02Å; L1662-I1713 HydrophobicContact CB-CG1 4.44Å; L1662-I1713 HydrophobicContact CD1-CD1 4.28Å; T1663-I1713 HydrophobicContact CG2-CG1 4.25Å; M1684-I1713 HydrophobicContact CB-CG2 4.22Å; M1684-I1713 HydrophobicContact CG-CG2 4.27Å; M1684-I1713 HydrophobicContact SD-CG2 3.75Å; Y1687-I1713 HydrophobicContact CD1-CD1 3.41Å; Y1687-I1713 VanDerWaalsContact CD1-CD1 3.43Å; Y1687-I1713 HydrophobicContact CE1-CD1 3.41Å; Y1687-I1713 VanDerWaalsContact CE1-CD1 3.41Å; Y1687-I1713 HydrophobicContact CG-CD1 4.28Å; I1688-I1713 HydrophobicContact CD1-CG2 4.11Å; I1688-I1713 HydrophobicContact CG1-CG2 4.15Å; M1709-I1713 WeakPolarHBondContact O-CB 3.15Å; M1709-I1713 WeakPolarHBondContact O-CG1 3.26Å; M1709-I1713 PolarHBondContact O-N 3.25Å; M1709-I1713 VanDerWaalsContact O-N 3.08Å; R1710-I1713 PolarHBondContact O-N 3.26Å; D1711-I1713 PolarHBondContact O-N 3.12Å; I1713-T1715 VanDerWaalsContact C-N 3.34Å; I1713-T1715 PolarHBondContact O-N 3.09Å; I1713-M1716 PolarHBondContact O-N 3.26Å; I1713-Q1717 VanDerWaalsContact O-CB 3.27Å; I1713-Q1717 WeakPolarHBondContact O-CB 3.31Å; I1713-Q1717 PolarHBondContact O-N 3.15Å
1714	R	80.6	Confident	74.8	Confident	79 Å²	79	40.7 Å²	40.7	30%	0.298	21%	0.212	S	C	.	.	H	α-helix	trans	-62.4	-41.5	175.6	-74.2	170.9	178	153	-5.6	112.1	I1688 R1710 D1711 K1712 Q1717 R1718	I1688-R1714 HydrophobicContact CD1-CG 3.82Å; I1688-R1714 HydrophobicContact CG1-CG 4.36Å; R1710-R1714 VanDerWaalsContact O-CG 3.32Å; R1710-R1714 WeakPolarHBondContact O-CG 3.36Å; R1710-R1714 PolarHBondContact O-N 3.24Å; R1710-R1714 VanDerWaalsContact O-N 3.1Å; D1711-R1714 WeakPolarHBondContact O-CB 3.33Å; D1711-R1714 PolarHBondContact O-N 2.98Å; D1711-R1714 VanDerWaalsContact O-N 3.11Å; D1711-R1714 IonicContact OD1-CZ 3.98Å; D1711-R1714 IonicContact OD1-NH1 3.22Å; D1711-R1714 PolarHBondContact OD1-NH1 3Å; K1712-R1714 VanDerWaalsContact C-N 3.34Å; K1712-R1714 PolarHBondContact O-N 3.16Å; R1714-Q1717 WeakPolarHBondContact O-CB 3.36Å; R1714-Q1717 PolarHBondContact O-N 3.11Å; R1714-R1718 VanDerWaalsContact O-CG 3.29Å; R1714-R1718 WeakPolarHBondContact O-CG 3.2Å; R1714-R1718 PolarHBondContact O-N 3.22Å
1715	T	81.8	Confident	75.5	Confident	9.2 Å²	9.2	43.7 Å²	43.7	6%	0.056	22%	0.222	C	C	.	.	H	α-helix	trans	-65.6	-45.3	177.9	-25.3	0	0	0	0	110.8	D1711 K1712 I1713 Q1717 R1718 F1719 V1743 D1744 W1746 I1747	D1711-T1715 WeakPolarHBondContact O-CB 3.33Å; D1711-T1715 VanDerWaalsContact O-CG2 3.31Å; D1711-T1715 WeakPolarHBondContact O-CG2 3.38Å; D1711-T1715 PolarHBondContact O-N 3.07Å; D1711-T1715 PolarHBondContact O-OG1 3.18Å; K1712-T1715 WeakPolarHBondContact CA-OG1 3.41Å; K1712-T1715 PolarHBondContact O-N 3Å; K1712-T1715 PolarHBondContact O-OG1 3.39Å; I1713-T1715 VanDerWaalsContact C-N 3.34Å; I1713-T1715 PolarHBondContact O-N 3.09Å; T1715-Q1717 VanDerWaalsContact C-N 3.32Å; T1715-Q1717 PolarHBondContact O-N 3.1Å; T1715-R1718 PolarHBondContact O-N 3.24Å; T1715-R1718 VanDerWaalsContact O-N 3.1Å; T1715-R1718 PolarHBondContact OG1-NH1 3.08Å; T1715-R1718 VanDerWaalsContact OG1-NH1 3.15Å; T1715-F1719 PolarHBondContact O-N 2.76Å; T1715-F1719 VanDerWaalsContact O-N 3.12Å; T1715-V1743 HydrophobicContact CG2-CG1 4.44Å; T1715-D1744 VanDerWaalsContact CB-OD2 3.29Å; T1715-D1744 WeakPolarHBondContact CB-OD2 3.32Å; T1715-D1744 HydrophobicContact CG2-CB 3.78Å; T1715-D1744 VanDerWaalsContact CG2-CG 3.49Å; T1715-D1744 WeakPolarHBondContact CG2-OD1 3.44Å; T1715-D1744 WeakPolarHBondContact CG2-OD2 3.3Å; T1715-D1744 PolarHBondContact OG1-OD1 2.95Å; T1715-D1744 PolarHBondContact OG1-OD2 3.13Å; T1715-D1744 VanDerWaalsContact OG1-OD2 3.05Å; T1715-W1746 HydrophobicContact CG2-CE3 4.02Å; T1715-W1746 HydrophobicContact CG2-CZ3 4.33Å; T1715-I1747 HydrophobicContact CG2-CD1 3.39Å; T1715-I1747 VanDerWaalsContact CG2-CD1 3.46Å; T1715-I1747 HydrophobicContact CG2-CG1 3.61Å; T1715-I1747 VanDerWaalsContact CG2-CG1 3.43Å; T1715-I1747 WeakPolarHBondContact O-CD1 3.41Å
1716	M	84.6	Confident	76.3	Confident	0.8 Å²	0.8	44.4 Å²	44.4	0%	0.004	22%	0.218	C	C	.	.	H	α-helix	trans	-59.7	-42	172.9	-174.8	60.1	77.2	0	0	112.1	T1663 L1668 M1684 K1712 I1713 R1718 F1719 L1720 F1734 W1746 I1750	T1663-M1716 WeakPolarHBondContact O-CE 3.25Å; L1668-M1716 HydrophobicContact CD1-CE 4.02Å; L1668-M1716 HydrophobicContact CD1-CG 3.87Å; L1668-M1716 HydrophobicContact CD1-SD 3.63Å; L1668-M1716 VanDerWaalsContact CD1-SD 3.59Å; M1684-M1716 HydrophobicContact CE-CB 4.42Å; M1684-M1716 HydrophobicContact CE-CG 4.03Å; K1712-M1716 WeakPolarHBondContact O-CB 3.43Å; K1712-M1716 PolarHBondContact O-N 3.2Å; I1713-M1716 PolarHBondContact O-N 3.26Å; M1716-R1718 VanDerWaalsContact C-N 3.33Å; M1716-R1718 PolarHBondContact O-N 3.05Å; M1716-F1719 WeakPolarHBondContact O-CB 3.41Å; M1716-F1719 PolarHBondContact O-N 3.08Å; M1716-F1719 HydrophobicContact SD-CD1 4.2Å; M1716-L1720 HydrophobicContact CG-CD1 4.15Å; M1716-L1720 HydrophobicContact CG-CG 4.45Å; M1716-L1720 WeakPolarHBondContact O-CB 3.46Å; M1716-L1720 WeakPolarHBondContact O-CG 3.35Å; M1716-L1720 PolarHBondContact O-N 3.25Å; M1716-L1720 HydrophobicContact SD-CD1 4.49Å; M1716-L1720 HydrophobicContact SD-CG 4.38Å; M1716-F1734 HydrophobicContact CE-CZ 4.09Å; M1716-F1734 HydrophobicContact SD-CE2 4.34Å; M1716-F1734 HydrophobicContact SD-CZ 3.9Å; M1716-W1746 HydrophobicContact CB-CZ3 4.32Å; M1716-W1746 HydrophobicContact CE-CH2 4.38Å; M1716-W1746 HydrophobicContact CE-CZ3 4.36Å; M1716-I1750 HydrophobicContact CE-CD1 3.81Å
1717	Q	82.4	Confident	77.1	Confident	26 Å²	26	43.1 Å²	43.1	12%	0.121	21%	0.211	C	C	.	.	H	α-helix	trans	-60.8	-43.2	176.3	-174.3	-173	13.4	0	0	111.9	L1681 M1684 N1685 I1688 I1713 R1714 T1715 F1719 L1720 A1721 Q1836	L1681-Q1717 HydrophobicContact CD2-CG 3.94Å; M1684-Q1717 HydrophobicContact CB-CG 4.41Å; M1684-Q1717 HydrophobicContact SD-CB 4.05Å; M1684-Q1717 HydrophobicContact SD-CG 4.15Å; N1685-Q1717 PolarHBondContact ND2-NE2 3.08Å; N1685-Q1717 VanDerWaalsContact ND2-NE2 3.16Å; N1685-Q1717 PolarHBondContact OD1-NE2 3.14Å; I1688-Q1717 VanDerWaalsContact CD1-OE1 3.23Å; I1713-Q1717 VanDerWaalsContact O-CB 3.27Å; I1713-Q1717 WeakPolarHBondContact O-CB 3.31Å; I1713-Q1717 PolarHBondContact O-N 3.15Å; R1714-Q1717 WeakPolarHBondContact O-CB 3.36Å; R1714-Q1717 PolarHBondContact O-N 3.11Å; T1715-Q1717 VanDerWaalsContact C-N 3.32Å; T1715-Q1717 PolarHBondContact O-N 3.1Å; Q1717-F1719 VanDerWaalsContact C-N 3.34Å; Q1717-F1719 PolarHBondContact O-N 3.12Å; Q1717-L1720 PolarHBondContact O-N 3.14Å; Q1717-A1721 VanDerWaalsContact O-CB 3.25Å; Q1717-A1721 WeakPolarHBondContact O-CB 3.4Å; Q1717-A1721 PolarHBondContact O-N 3.11Å; Q1717-Q1836 PolarHBondContact NE2-O 3.11Å
1718	R	79.2	Confident	77.7	Confident	132 Å²	132	43.3 Å²	43.3	50%	0.498	21%	0.211	S	C	.	.	H	α-helix	trans	-62.8	-42.5	175.3	-70.6	178.9	-159.3	127.8	-0.5	111.6	R1714 T1715 M1716 L1720 A1721 S1722 V1743 D1744 I1793	R1714-R1718 VanDerWaalsContact O-CG 3.29Å; R1714-R1718 WeakPolarHBondContact O-CG 3.2Å; R1714-R1718 PolarHBondContact O-N 3.22Å; T1715-R1718 PolarHBondContact O-N 3.24Å; T1715-R1718 VanDerWaalsContact O-N 3.1Å; T1715-R1718 PolarHBondContact OG1-NH1 3.08Å; T1715-R1718 VanDerWaalsContact OG1-NH1 3.15Å; M1716-R1718 VanDerWaalsContact C-N 3.33Å; M1716-R1718 PolarHBondContact O-N 3.05Å; R1718-L1720 PolarHBondContact O-N 3.48Å; R1718-A1721 PolarHBondContact O-N 3.33Å; R1718-S1722 WeakPolarHBondContact O-CB 3.42Å; R1718-S1722 PolarHBondContact O-N 3.3Å; R1718-S1722 PolarHBondContact O-OG 3.03Å; R1718-V1743 HydrophobicContact CB-CG1 4.34Å; R1718-D1744 IonicContact NH1-OD2 3.42Å; R1718-I1793 HydrophobicContact CB-CG2 4.26Å; R1718-I1793 HydrophobicContact CG-CG2 3.75Å
1719	F	83.5	Confident	78.2	Confident	0.2 Å²	0.2	45.3 Å²	45.3	0%	0.001	22%	0.216	C	C	.	.	H	α-helix	trans	-62.5	-46.3	176.5	173.4	-95.3	0	0	0	112.5	T1715 M1716 Q1717 S1722 N1723 L1727 F1734 L1737 A1738 Q1741 V1743 I1747	T1715-F1719 PolarHBondContact O-N 2.76Å; T1715-F1719 VanDerWaalsContact O-N 3.12Å; M1716-F1719 WeakPolarHBondContact O-CB 3.41Å; M1716-F1719 PolarHBondContact O-N 3.08Å; M1716-F1719 HydrophobicContact SD-CD1 4.2Å; Q1717-F1719 VanDerWaalsContact C-N 3.34Å; Q1717-F1719 PolarHBondContact O-N 3.12Å; F1719-S1722 WeakPolarHBondContact CA-OG 3.09Å; F1719-S1722 PolarHBondContact O-N 3.15Å; F1719-S1722 PolarHBondContact O-OG 3.11Å; F1719-N1723 VanDerWaalsContact CD2-ND2 3.32Å; F1719-N1723 WeakPolarHBondContact CD2-ND2 3.45Å; F1719-N1723 WeakPolarHBondContact CE2-ND2 3.25Å; F1719-N1723 WeakPolarHBondContact O-CB 3.27Å; F1719-N1723 PolarHBondContact O-N 3.32Å; F1719-N1723 VanDerWaalsContact O-N 3.13Å; F1719-N1723 PolarHBondContact O-ND2 3.09Å; F1719-N1723 VanDerWaalsContact O-ND2 3.1Å; F1719-L1727 HydrophobicContact CE1-CD1 4.22Å; F1719-F1734 AromaticContact CD1-CE2 3.92Å; F1719-F1734 HydrophobicContact CD1-CE2 4.03Å; F1719-F1734 HydrophobicContact CD1-CZ 4.16Å; F1719-F1734 HydrophobicContact CE1-CD1 4.42Å; F1719-F1734 AromaticContact CE1-CD2 3.8Å; F1719-F1734 HydrophobicContact CE1-CD2 3.8Å; F1719-F1734 HydrophobicContact CE1-CE1 4.26Å; F1719-F1734 AromaticContact CE1-CE2 3.43Å; F1719-F1734 HydrophobicContact CE1-CE2 3.43Å; F1719-F1734 VanDerWaalsContact CE1-CE2 3.44Å; F1719-F1734 HydrophobicContact CE1-CG 4.38Å; F1719-F1734 AromaticContact CE1-CZ 3.68Å; F1719-F1734 HydrophobicContact CE1-CZ 3.68Å; F1719-F1734 HydrophobicContact CZ-CD2 4.37Å; F1719-F1734 HydrophobicContact CZ-CE2 4.39Å; F1719-F1734 HydrophobicContact CZ-CZ 4.44Å; F1719-L1737 HydrophobicContact CE2-CB 4.11Å; F1719-L1737 HydrophobicContact CZ-CB 3.86Å; F1719-A1738 HydrophobicContact CE2-CB 4.13Å; F1719-A1738 HydrophobicContact CZ-CB 3.97Å; F1719-Q1741 HydrophobicContact CD2-CB 4.44Å; F1719-Q1741 HydrophobicContact CD2-CG 4.28Å; F1719-Q1741 HydrophobicContact CE2-CB 4.44Å; F1719-V1743 HydrophobicContact CD2-CG2 4.17Å; F1719-I1747 HydrophobicContact CB-CD1 3.57Å; F1719-I1747 HydrophobicContact CB-CG1 4.39Å; F1719-I1747 HydrophobicContact CD2-CD1 4.32Å; F1719-I1747 HydrophobicContact CD2-CG2 3.78Å; F1719-I1747 HydrophobicContact CE2-CG2 4.1Å; F1719-I1747 HydrophobicContact CG-CD1 4.15Å; F1719-I1747 HydrophobicContact CG-CG2 4.19Å
1720	L	81.5	Confident	78.6	Confident	3.2 Å²	3.2	49.7 Å²	49.7	2%	0.017	24%	0.236	C	C	.	.	H	α-helix	trans	-64.8	-45	176.3	-71.4	174	0	0	0	110.8	L1668 I1672 L1680 L1681 M1684 M1716 Q1717 R1718 S1722 N1723 Y1724 L1727 F1734	L1668-L1720 HydrophobicContact CD1-CD1 4.16Å; L1668-L1720 HydrophobicContact CD1-CD2 4.44Å; L1668-L1720 HydrophobicContact CD2-CD1 3.95Å; L1668-L1720 HydrophobicContact CG-CD1 4.46Å; I1672-L1720 HydrophobicContact CD1-CD2 4.29Å; L1680-L1720 HydrophobicContact CD2-CD1 3.89Å; L1680-L1720 VanDerWaalsContact CD2-CD1 3.45Å; L1681-L1720 HydrophobicContact CD2-CB 4.16Å; M1684-L1720 HydrophobicContact CE-CD1 3.91Å; M1684-L1720 HydrophobicContact SD-CD1 4.13Å; M1716-L1720 HydrophobicContact CG-CD1 4.15Å; M1716-L1720 HydrophobicContact CG-CG 4.45Å; M1716-L1720 WeakPolarHBondContact O-CB 3.46Å; M1716-L1720 WeakPolarHBondContact O-CG 3.35Å; M1716-L1720 PolarHBondContact O-N 3.25Å; M1716-L1720 HydrophobicContact SD-CD1 4.49Å; M1716-L1720 HydrophobicContact SD-CG 4.38Å; Q1717-L1720 PolarHBondContact O-N 3.14Å; R1718-L1720 PolarHBondContact O-N 3.48Å; L1720-S1722 VanDerWaalsContact C-N 3.3Å; L1720-S1722 PolarHBondContact O-N 3.3Å; L1720-N1723 CarbonylContact O-C 3.56Å; L1720-N1723 PolarHBondContact O-N 3.15Å; L1720-N1723 VanDerWaalsContact O-N 3.15Å; L1720-Y1724 VanDerWaalsContact O-CA 3.25Å; L1720-Y1724 WeakPolarHBondContact O-CA 3.28Å; L1720-Y1724 WeakPolarHBondContact O-CB 3.33Å; L1720-Y1724 PolarHBondContact O-N 3.25Å; L1720-L1727 HydrophobicContact CD2-CD1 3.81Å; L1720-F1734 HydrophobicContact CD2-CE2 4.1Å
1721	A	77	Confident	78.8	Confident	42 Å²	42	49 Å²	49	35%	0.347	24%	0.235	S	C	.	.	H	α-helix	trans	-63.4	-34	179.6	0	0	0	0	0	113.2	L1681 Q1717 R1718 A1794 I1795	L1681-A1721 HydrophobicContact CD2-CB 4.46Å; Q1717-A1721 VanDerWaalsContact O-CB 3.25Å; Q1717-A1721 WeakPolarHBondContact O-CB 3.4Å; Q1717-A1721 PolarHBondContact O-N 3.11Å; R1718-A1721 PolarHBondContact O-N 3.33Å; A1721-A1794 HydrophobicContact CB-CB 3.81Å; A1721-I1795 PolarHBondContact O-N 3.13Å
1722	S	76.2	Confident	78.8	Confident	58 Å²	58	50.7 Å²	50.7	41%	0.406	24%	0.236	S	C	.	.	H	α-helix	trans	-75.6	-32.8	176.5	57.2	0	0	0	0	113.2	R1718 F1719 L1720 Q1741 I1795	R1718-S1722 WeakPolarHBondContact O-CB 3.42Å; R1718-S1722 PolarHBondContact O-N 3.3Å; R1718-S1722 PolarHBondContact O-OG 3.03Å; F1719-S1722 WeakPolarHBondContact CA-OG 3.09Å; F1719-S1722 PolarHBondContact O-N 3.15Å; F1719-S1722 PolarHBondContact O-OG 3.11Å; L1720-S1722 VanDerWaalsContact C-N 3.3Å; L1720-S1722 PolarHBondContact O-N 3.3Å; S1722-Q1741 PolarHBondContact OG-NE2 3.09Å; S1722-I1795 WeakPolarHBondContact O-CD1 3.4Å
1723	N	78.6	Confident	78.8	Confident	20.6 Å²	20.6	50.6 Å²	50.6	11%	0.11	24%	0.238	C	C	.	.	H	α-helix	trans	-107.1	3.3	-175.3	-62.4	-65.2	0	0	0	114.6	F1719 L1720 E1725 F1726 L1727 L1737 Q1741	F1719-N1723 VanDerWaalsContact CD2-ND2 3.32Å; F1719-N1723 WeakPolarHBondContact CD2-ND2 3.45Å; F1719-N1723 WeakPolarHBondContact CE2-ND2 3.25Å; F1719-N1723 WeakPolarHBondContact O-CB 3.27Å; F1719-N1723 PolarHBondContact O-N 3.32Å; F1719-N1723 VanDerWaalsContact O-N 3.13Å; F1719-N1723 PolarHBondContact O-ND2 3.09Å; F1719-N1723 VanDerWaalsContact O-ND2 3.1Å; L1720-N1723 CarbonylContact O-C 3.56Å; L1720-N1723 PolarHBondContact O-N 3.15Å; L1720-N1723 VanDerWaalsContact O-N 3.15Å; N1723-E1725 VanDerWaalsContact C-N 3.33Å; N1723-E1725 PolarHBondContact O-N 3.15Å; N1723-E1725 VanDerWaalsContact O-N 3.17Å; N1723-F1726 WeakPolarHBondContact O-CA 3.26Å; N1723-F1726 PolarHBondContact O-N 3.18Å; N1723-L1727 HydrophobicContact CB-CD1 3.9Å; N1723-L1727 HydrophobicContact CB-CG 4.09Å; N1723-L1727 WeakPolarHBondContact O-CG 3.22Å; N1723-L1727 PolarHBondContact O-N 3.27Å; N1723-L1737 HydrophobicContact CB-CD1 3.92Å; N1723-Q1741 VanDerWaalsContact CG-NE2 3.28Å; N1723-Q1741 PolarHBondContact ND2-NE2 3.26Å; N1723-Q1741 VanDerWaalsContact ND2-NE2 3.16Å; N1723-Q1741 PolarHBondContact ND2-OE1 3.1Å; N1723-Q1741 PolarHBondContact OD1-NE2 2.7Å; N1723-Q1741 PolarHBondContact OD1-OE1 2.98Å
1724	Y	76.2	Confident	79	Confident	34.4 Å²	34.4	50.6 Å²	50.6	14%	0.135	24%	0.238	C	C	.	.	H	α-helix	trans	-53.4	-48.7	-167.5	-172.1	-116	0	0	0	113.1	I1672 G1677 L1678 L1681 L1720 F1726 L1727 I1728	I1672-Y1724 HydrophobicContact CG1-CE2 4.47Å; G1677-Y1724 VanDerWaalsContact C-OH 3.28Å; G1677-Y1724 VanDerWaalsContact CA-OH 3.3Å; G1677-Y1724 WeakPolarHBondContact CA-OH 3.34Å; L1678-Y1724 HydrophobicContact CD1-CE1 3.89Å; L1678-Y1724 HydrophobicContact CD2-CD1 4.42Å; L1678-Y1724 HydrophobicContact CD2-CE1 3.85Å; L1678-Y1724 HydrophobicContact CG-CE1 3.89Å; L1678-Y1724 WeakPolarHBondContact CG-OH 3.39Å; L1678-Y1724 PolarHBondContact N-OH 3.15Å; L1678-Y1724 VanDerWaalsContact N-OH 3.12Å; L1681-Y1724 HydrophobicContact CD1-CD2 4.39Å; L1720-Y1724 VanDerWaalsContact O-CA 3.25Å; L1720-Y1724 WeakPolarHBondContact O-CA 3.28Å; L1720-Y1724 WeakPolarHBondContact O-CB 3.33Å; L1720-Y1724 PolarHBondContact O-N 3.25Å; Y1724-F1726 VanDerWaalsContact C-N 3.27Å; Y1724-F1726 PolarHBondContact O-N 2.92Å; Y1724-L1727 PolarHBondContact O-N 3.25Å; Y1724-I1728 HydrophobicContact CD1-CD1 3.56Å; Y1724-I1728 VanDerWaalsContact CD1-CD1 3.5Å; Y1724-I1728 HydrophobicContact CD1-CG1 4.43Å; Y1724-I1728 HydrophobicContact CD2-CD1 4.35Å; Y1724-I1728 HydrophobicContact CD2-CG1 4.41Å; Y1724-I1728 HydrophobicContact CE1-CD1 3.14Å; Y1724-I1728 HydrophobicContact CE1-CG1 4.08Å; Y1724-I1728 HydrophobicContact CE2-CD1 4.03Å; Y1724-I1728 HydrophobicContact CE2-CG1 4.07Å; Y1724-I1728 HydrophobicContact CG-CD1 4.15Å; Y1724-I1728 VanDerWaalsContact CZ-CD1 3.46Å; Y1724-I1728 WeakPolarHBondContact O-CD1 3.39Å; Y1724-I1728 VanDerWaalsContact O-CG1 3.28Å; Y1724-I1728 WeakPolarHBondContact O-CG1 3.31Å; Y1724-I1728 PolarHBondContact O-N 3.28Å; Y1724-I1728 VanDerWaalsContact O-N 3.08Å
1725	E	72	Confident	78.9	Confident	119.4 Å²	119.4	47.3 Å²	47.3	56%	0.558	23%	0.227	S	C	*	.	H	α-helix	trans	-60.9	-34.4	-179.4	-81.7	-167.7	161.4	0	0	113	N1723 L1727 I1728 K1729 K1797	N1723-E1725 VanDerWaalsContact C-N 3.33Å; N1723-E1725 PolarHBondContact O-N 3.15Å; N1723-E1725 VanDerWaalsContact O-N 3.17Å; E1725-L1727 VanDerWaalsContact C-N 3.35Å; E1725-I1728 PolarHBondContact O-N 3.29Å; E1725-K1729 PolarHBondContact O-N 3.4Å; E1725-K1729 IonicContact OE1-NZ 3.69Å; E1725-K1797 VanDerWaalsContact OE1-CB 3.32Å; E1725-K1797 WeakPolarHBondContact OE1-CB 3.33Å; E1725-K1797 WeakPolarHBondContact OE1-CD 3.43Å; E1725-K1797 WeakPolarHBondContact OE1-CG 3.47Å; E1725-K1797 IonicContact OE1-NZ 2.69Å; E1725-K1797 WeakPolarHBondContact OE2-CD 3.48Å; E1725-K1797 WeakPolarHBondContact OE2-CE 3.39Å; E1725-K1797 IonicContact OE2-NZ 3.58Å; E1725-K1797 PolarHBondContact OE2-NZ 3.2Å
1726	F	76.8	Confident	78.7	Confident	78.2 Å²	78.2	49.6 Å²	49.6	34%	0.343	24%	0.237	S	C	.	.	H	α-helix	trans	-78.3	-44.4	178.3	-175.2	-90.9	0	0	0	111.1	N1723 Y1724 I1728 K1729 H1730 L1737 Y2067	N1723-F1726 WeakPolarHBondContact O-CA 3.26Å; N1723-F1726 PolarHBondContact O-N 3.18Å; Y1724-F1726 VanDerWaalsContact C-N 3.27Å; Y1724-F1726 PolarHBondContact O-N 2.92Å; F1726-I1728 VanDerWaalsContact C-N 3.29Å; F1726-I1728 PolarHBondContact O-N 3.11Å; F1726-K1729 PolarHBondContact O-N 3.13Å; F1726-H1730 HydrophobicContact CD1-CB 4.45Å; F1726-H1730 HydrophobicContact CE1-CB 4.07Å; F1726-H1730 AromaticContact CE2-CD2 3.9Å; F1726-H1730 HydrophobicContact CZ-CB 4.25Å; F1726-H1730 AromaticContact CZ-CD2 3.79Å; F1726-H1730 PolarHBondContact O-N 3.19Å; F1726-L1737 HydrophobicContact CD1-CD1 3.43Å; F1726-L1737 VanDerWaalsContact CD1-CD1 3.47Å; F1726-L1737 HydrophobicContact CD1-CD2 4.39Å; F1726-L1737 HydrophobicContact CD1-CG 4.25Å; F1726-L1737 HydrophobicContact CE1-CD1 3.85Å; F1726-L1737 HydrophobicContact CE1-CD2 4.38Å; F1726-L1737 HydrophobicContact CE1-CG 4.22Å; F1726-L1737 HydrophobicContact CG-CD1 4.39Å; F1726-Y2067 HydrophobicContact CE2-CE1 4.21Å
1727	L	77.7	Confident	78.5	Confident	0.6 Å²	0.6	50.8 Å²	50.8	0%	0.003	24%	0.244	C	C	.	.	H	α-helix	trans	-64.2	-30.8	179.5	-70.5	172.6	0	0	0	112.9	I1672 F1719 L1720 N1723 Y1724 E1725 K1729 H1730 P1731 F1734 L1737	I1672-L1727 HydrophobicContact CD1-CB 4.16Å; I1672-L1727 HydrophobicContact CD1-CD1 4.42Å; I1672-L1727 WeakPolarHBondContact CG2-O 3.37Å; F1719-L1727 HydrophobicContact CE1-CD1 4.22Å; L1720-L1727 HydrophobicContact CD2-CD1 3.81Å; N1723-L1727 HydrophobicContact CB-CD1 3.9Å; N1723-L1727 HydrophobicContact CB-CG 4.09Å; N1723-L1727 WeakPolarHBondContact O-CG 3.22Å; N1723-L1727 PolarHBondContact O-N 3.27Å; Y1724-L1727 PolarHBondContact O-N 3.25Å; E1725-L1727 VanDerWaalsContact C-N 3.35Å; L1727-K1729 VanDerWaalsContact C-N 3.3Å; L1727-K1729 PolarHBondContact O-N 3.28Å; L1727-H1730 CarbonylContact O-C 3.51Å; L1727-P1731 VanDerWaalsContact O-CA 3.23Å; L1727-P1731 WeakPolarHBondContact O-CA 3.37Å; L1727-P1731 VanDerWaalsContact O-CB 3.28Å; L1727-P1731 WeakPolarHBondContact O-CB 3.49Å; L1727-P1731 VanDerWaalsContact O-CD 3.31Å; L1727-P1731 WeakPolarHBondContact O-CD 3.34Å; L1727-P1731 VanDerWaalsContact O-CG 3.29Å; L1727-P1731 WeakPolarHBondContact O-CG 3.37Å; L1727-F1734 HydrophobicContact CD1-CD2 4.23Å; L1727-F1734 HydrophobicContact CD2-CB 4Å; L1727-F1734 HydrophobicContact CD2-CD2 4.22Å; L1727-F1734 HydrophobicContact CD2-CG 4.48Å; L1727-L1737 HydrophobicContact CD2-CD1 3.77Å; L1727-L1737 HydrophobicContact CG-CD1 4.09Å
1728	I	76.7	Confident	78.5	Confident	57.4 Å²	57.4	49.6 Å²	49.6	29%	0.294	24%	0.238	S	C	.	.	H	α-helix	trans	-61.9	-39.4	171.9	-69.1	161.1	0	0	0	111.6	N1251 I1672 Y1724 E1725 F1726	N1251-I1728 VanDerWaalsContact ND2-CD1 3.26Å; N1251-I1728 WeakPolarHBondContact ND2-CD1 3.44Å; I1672-I1728 HydrophobicContact CG2-CB 4.45Å; I1672-I1728 HydrophobicContact CG2-CG1 4.19Å; Y1724-I1728 HydrophobicContact CD1-CD1 3.56Å; Y1724-I1728 VanDerWaalsContact CD1-CD1 3.5Å; Y1724-I1728 HydrophobicContact CD1-CG1 4.43Å; Y1724-I1728 HydrophobicContact CD2-CD1 4.35Å; Y1724-I1728 HydrophobicContact CD2-CG1 4.41Å; Y1724-I1728 HydrophobicContact CE1-CD1 3.14Å; Y1724-I1728 HydrophobicContact CE1-CG1 4.08Å; Y1724-I1728 HydrophobicContact CE2-CD1 4.03Å; Y1724-I1728 HydrophobicContact CE2-CG1 4.07Å; Y1724-I1728 HydrophobicContact CG-CD1 4.15Å; Y1724-I1728 VanDerWaalsContact CZ-CD1 3.46Å; Y1724-I1728 WeakPolarHBondContact O-CD1 3.39Å; Y1724-I1728 VanDerWaalsContact O-CG1 3.28Å; Y1724-I1728 WeakPolarHBondContact O-CG1 3.31Å; Y1724-I1728 PolarHBondContact O-N 3.28Å; Y1724-I1728 VanDerWaalsContact O-N 3.08Å; E1725-I1728 PolarHBondContact O-N 3.29Å; F1726-I1728 VanDerWaalsContact C-N 3.29Å; F1726-I1728 PolarHBondContact O-N 3.11Å
1729	K	75	Confident	78.4	Confident	140.4 Å²	140.4	44.1 Å²	44.1	61%	0.61	22%	0.219	S	C	*	.	H	α-helix	trans	-81	-36.9	-179.1	-66.6	-179.6	-179.6	177.5	0	112.1	E1725 F1726 L1727	E1725-K1729 PolarHBondContact O-N 3.4Å; E1725-K1729 IonicContact OE1-NZ 3.69Å; F1726-K1729 PolarHBondContact O-N 3.13Å; L1727-K1729 VanDerWaalsContact C-N 3.3Å; L1727-K1729 PolarHBondContact O-N 3.28Å
1730	H	79	Confident	77.7	Confident	96 Å²	96	47.6 Å²	47.6	44%	0.444	24%	0.237	S	C	.	.			trans	-135.3	73.6	-175.7	-59.3	-56.5	0	0	0	110.9	F1726 L1727 Y1732 S1733	F1726-H1730 HydrophobicContact CD1-CB 4.45Å; F1726-H1730 HydrophobicContact CE1-CB 4.07Å; F1726-H1730 AromaticContact CE2-CD2 3.9Å; F1726-H1730 HydrophobicContact CZ-CB 4.25Å; F1726-H1730 AromaticContact CZ-CD2 3.79Å; F1726-H1730 PolarHBondContact O-N 3.19Å; L1727-H1730 CarbonylContact O-C 3.51Å; H1730-Y1732 VanDerWaalsContact C-N 3.27Å; H1730-Y1732 PolarHBondContact O-N 3.29Å; H1730-S1733 WeakPolarHBondContact O-CB 3.39Å; H1730-S1733 PolarHBondContact O-N 3.19Å; H1730-S1733 VanDerWaalsContact O-N 3.15Å
1731	P	77.4	Confident	77.2	Confident	15.6 Å²	15.6	48.9 Å²	48.9	10%	0.101	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-61.1	-35.3	-175.5	-5.4	7.4	0	0	0	113	I1669 I1672 E1673 L1727 S1733 F1734	I1669-P1731 HydrophobicContact CG2-CB 3.92Å; I1672-P1731 HydrophobicContact CG2-CB 4.33Å; I1672-P1731 HydrophobicContact CG2-CG 4.41Å; E1673-P1731 HydrophobicContact CG-CB 4.08Å; E1673-P1731 HydrophobicContact CG-CG 3.81Å; L1727-P1731 VanDerWaalsContact O-CA 3.23Å; L1727-P1731 WeakPolarHBondContact O-CA 3.37Å; L1727-P1731 VanDerWaalsContact O-CB 3.28Å; L1727-P1731 WeakPolarHBondContact O-CB 3.49Å; L1727-P1731 VanDerWaalsContact O-CD 3.31Å; L1727-P1731 WeakPolarHBondContact O-CD 3.34Å; L1727-P1731 VanDerWaalsContact O-CG 3.29Å; L1727-P1731 WeakPolarHBondContact O-CG 3.37Å; P1731-S1733 VanDerWaalsContact C-N 3.27Å; P1731-S1733 PolarHBondContact O-N 3.3Å; P1731-F1734 WeakPolarHBondContact O-CB 3.34Å; P1731-F1734 PolarHBondContact O-N 3.31Å
1732	Y	77.9	Confident	76.5	Confident	128.6 Å²	128.6	52.2 Å²	52.2	50%	0.504	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-69.6	-15	-179.1	-62.3	-76.4	0	0	0	114.7	I1669 E1673 H1730 F1734 N1771 F1773	I1669-Y1732 HydrophobicContact CG2-CD1 4.32Å; I1669-Y1732 HydrophobicContact CG2-CE1 4.12Å; E1673-Y1732 WeakPolarHBondContact OE1-CE2 3.42Å; E1673-Y1732 VanDerWaalsContact OE1-CZ 3.29Å; E1673-Y1732 PolarHBondContact OE1-OH 3.17Å; E1673-Y1732 PolarHBondContact OE2-OH 3.08Å; H1730-Y1732 VanDerWaalsContact C-N 3.27Å; H1730-Y1732 PolarHBondContact O-N 3.29Å; Y1732-F1734 PolarHBondContact O-N 3.11Å; Y1732-N1771 HydrophobicContact CE1-CB 4.31Å; Y1732-F1773 WeakPolarHBondContact O-CD1 3.48Å; Y1732-F1773 WeakPolarHBondContact O-CE1 3.33Å
1733	S	79.8	Confident	75.8	Confident	20 Å²	20	52.7 Å²	52.7	14%	0.14	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-80.4	7.8	174.8	-67.9	0	0	0	0	113.2	H1730 P1731 A1735 E1736 L1737	H1730-S1733 WeakPolarHBondContact O-CB 3.39Å; H1730-S1733 PolarHBondContact O-N 3.19Å; H1730-S1733 VanDerWaalsContact O-N 3.15Å; P1731-S1733 VanDerWaalsContact C-N 3.27Å; P1731-S1733 PolarHBondContact O-N 3.3Å; S1733-A1735 VanDerWaalsContact C-N 3.32Å; S1733-A1735 PolarHBondContact O-N 3.06Å; S1733-E1736 WeakPolarHBondContact CB-OE2 3.34Å; S1733-E1736 PolarHBondContact O-N 3.19Å; S1733-E1736 PolarHBondContact OG-OE2 3.22Å; S1733-L1737 WeakPolarHBondContact O-CG 3.41Å; S1733-L1737 PolarHBondContact O-N 3.27Å
1734	F	83.9	Confident	75.5	Confident	2 Å²	2	54.5 Å²	54.5	1%	0.009	27%	0.265	C	S	.	.	H	α-helix	trans	-51.3	-48.7	175.7	-175.7	-77.3	0	0	0	112.6	P1665 L1668 I1669 M1716 F1719 L1720 L1727 P1731 Y1732 E1736 L1737 A1738 I1750	P1665-F1734 HydrophobicContact CB-CD1 3.86Å; P1665-F1734 HydrophobicContact CB-CE1 3.65Å; P1665-F1734 HydrophobicContact CB-CG 4.48Å; P1665-F1734 HydrophobicContact CB-CZ 4.1Å; P1665-F1734 HydrophobicContact CG-CD1 4.17Å; P1665-F1734 HydrophobicContact CG-CE1 3.65Å; P1665-F1734 VanDerWaalsContact CG-CE1 3.48Å; P1665-F1734 HydrophobicContact CG-CZ 3.99Å; L1668-F1734 HydrophobicContact CB-CE2 4.4Å; L1668-F1734 HydrophobicContact CD1-CE2 4.23Å; L1668-F1734 HydrophobicContact CD1-CZ 4.28Å; I1669-F1734 HydrophobicContact CD1-CB 3.91Å; I1669-F1734 HydrophobicContact CD1-CG 4.37Å; I1669-F1734 HydrophobicContact CG1-CB 4.18Å; I1669-F1734 HydrophobicContact CG1-CD2 4.35Å; I1669-F1734 HydrophobicContact CG1-CG 4.39Å; M1716-F1734 HydrophobicContact CE-CZ 4.09Å; M1716-F1734 HydrophobicContact SD-CE2 4.34Å; M1716-F1734 HydrophobicContact SD-CZ 3.9Å; F1719-F1734 AromaticContact CD1-CE2 3.92Å; F1719-F1734 HydrophobicContact CD1-CE2 4.03Å; F1719-F1734 HydrophobicContact CD1-CZ 4.16Å; F1719-F1734 HydrophobicContact CE1-CD1 4.42Å; F1719-F1734 AromaticContact CE1-CD2 3.8Å; F1719-F1734 HydrophobicContact CE1-CD2 3.8Å; F1719-F1734 HydrophobicContact CE1-CE1 4.26Å; F1719-F1734 AromaticContact CE1-CE2 3.43Å; F1719-F1734 HydrophobicContact CE1-CE2 3.43Å; F1719-F1734 VanDerWaalsContact CE1-CE2 3.44Å; F1719-F1734 HydrophobicContact CE1-CG 4.38Å; F1719-F1734 AromaticContact CE1-CZ 3.68Å; F1719-F1734 HydrophobicContact CE1-CZ 3.68Å; F1719-F1734 HydrophobicContact CZ-CD2 4.37Å; F1719-F1734 HydrophobicContact CZ-CE2 4.39Å; F1719-F1734 HydrophobicContact CZ-CZ 4.44Å; L1720-F1734 HydrophobicContact CD2-CE2 4.1Å; L1727-F1734 HydrophobicContact CD1-CD2 4.23Å; L1727-F1734 HydrophobicContact CD2-CB 4Å; L1727-F1734 HydrophobicContact CD2-CD2 4.22Å; L1727-F1734 HydrophobicContact CD2-CG 4.48Å; P1731-F1734 WeakPolarHBondContact O-CB 3.34Å; P1731-F1734 PolarHBondContact O-N 3.31Å; Y1732-F1734 PolarHBondContact O-N 3.11Å; F1734-E1736 PolarHBondContact O-N 2.97Å; F1734-L1737 PolarHBondContact O-N 3.21Å; F1734-A1738 HydrophobicContact CD1-CB 4.42Å; F1734-A1738 HydrophobicContact CE1-CB 4.29Å; F1734-A1738 VanDerWaalsContact O-CB 3.29Å; F1734-A1738 WeakPolarHBondContact O-CB 3.37Å; F1734-A1738 PolarHBondContact O-N 3.28Å; F1734-I1750 HydrophobicContact CE1-CG2 4.25Å
1735	A	79.9	Confident	75.5	Confident	8.2 Å²	8.2	60.6 Å²	60.6	7%	0.068	30%	0.295	C	S	.	.	H	α-helix	trans	-65.6	-40.5	-177.2	0	0	0	0	0	112	S1733 L1737 A1738 I1739 C1754 L1755 F1772 F1773	S1733-A1735 VanDerWaalsContact C-N 3.32Å; S1733-A1735 PolarHBondContact O-N 3.06Å; A1735-L1737 VanDerWaalsContact C-N 3.34Å; A1735-L1737 PolarHBondContact O-N 3.35Å; A1735-A1738 PolarHBondContact O-N 3.04Å; A1735-I1739 WeakPolarHBondContact O-CB 3.45Å; A1735-I1739 WeakPolarHBondContact O-CD1 3.37Å; A1735-I1739 VanDerWaalsContact O-CG1 3.31Å; A1735-I1739 WeakPolarHBondContact O-CG1 3.36Å; A1735-I1739 PolarHBondContact O-N 3.07Å; A1735-C1754 HydrophobicContact CB-CB 3.81Å; A1735-L1755 HydrophobicContact CB-CD1 3.98Å; A1735-L1755 HydrophobicContact CB-CD2 3.89Å; A1735-L1755 HydrophobicContact CB-CG 4.08Å; A1735-F1772 HydrophobicContact CB-CD1 4.07Å; A1735-F1772 HydrophobicContact CB-CE1 3.7Å; A1735-F1772 HydrophobicContact CB-CZ 4.43Å; A1735-F1773 HydrophobicContact CB-CD1 3.79Å; A1735-F1773 HydrophobicContact CB-CE1 3.44Å; A1735-F1773 HydrophobicContact CB-CG 4.44Å; A1735-F1773 HydrophobicContact CB-CZ 4.16Å
1736	E	77.7	Confident	75.9	Confident	58.2 Å²	58.2	56 Å²	56	27%	0.272	27%	0.272	S	S	.	.	H	α-helix	trans	-64.8	-41.3	177.7	-62.5	173.3	168.2	0	0	111.5	S1733 F1734 N1740 F1772 F1773 R1774 I1775	S1733-E1736 WeakPolarHBondContact CB-OE2 3.34Å; S1733-E1736 PolarHBondContact O-N 3.19Å; S1733-E1736 PolarHBondContact OG-OE2 3.22Å; F1734-E1736 PolarHBondContact O-N 2.97Å; E1736-N1740 WeakPolarHBondContact O-CB 3.37Å; E1736-N1740 VanDerWaalsContact O-CG 3.3Å; E1736-N1740 PolarHBondContact O-N 3.25Å; E1736-N1740 VanDerWaalsContact O-N 3.09Å; E1736-N1740 PolarHBondContact O-ND2 3.14Å; E1736-F1772 HydrophobicContact CG-CD1 3.78Å; E1736-F1773 HydrophobicContact CG-CD1 4.3Å; E1736-F1773 HydrophobicContact CG-CE1 4.42Å; E1736-F1773 WeakPolarHBondContact OE1-CD1 2.85Å; E1736-F1773 WeakPolarHBondContact OE1-CE1 3.12Å; E1736-F1773 PolarHBondContact OE1-N 2.85Å; E1736-R1774 WeakPolarHBondContact OE1-CA 3.42Å; E1736-R1774 WeakPolarHBondContact OE1-CB 3.13Å; E1736-R1774 VanDerWaalsContact OE1-CG 3.24Å; E1736-R1774 WeakPolarHBondContact OE1-CG 3.45Å; E1736-R1774 PolarHBondContact OE1-N 3.09Å; E1736-R1774 VanDerWaalsContact OE1-N 3.08Å; E1736-R1774 WeakPolarHBondContact OE2-CD 3.35Å; E1736-I1775 HydrophobicContact CG-CD1 3.92Å; E1736-I1775 HydrophobicContact CG-CG1 4.16Å
1737	L	80.9	Confident	76.2	Confident	26.4 Å²	26.4	52.4 Å²	52.4	14%	0.138	26%	0.256	C	S	.	.	H	α-helix	trans	-67.2	-44.6	175.1	-72.8	175.6	0	0	0	111.9	F1719 N1723 F1726 L1727 S1733 F1734 A1735 I1739 N1740 Q1741	F1719-L1737 HydrophobicContact CE2-CB 4.11Å; F1719-L1737 HydrophobicContact CZ-CB 3.86Å; N1723-L1737 HydrophobicContact CB-CD1 3.92Å; F1726-L1737 HydrophobicContact CD1-CD1 3.43Å; F1726-L1737 VanDerWaalsContact CD1-CD1 3.47Å; F1726-L1737 HydrophobicContact CD1-CD2 4.39Å; F1726-L1737 HydrophobicContact CD1-CG 4.25Å; F1726-L1737 HydrophobicContact CE1-CD1 3.85Å; F1726-L1737 HydrophobicContact CE1-CD2 4.38Å; F1726-L1737 HydrophobicContact CE1-CG 4.22Å; F1726-L1737 HydrophobicContact CG-CD1 4.39Å; L1727-L1737 HydrophobicContact CD2-CD1 3.77Å; L1727-L1737 HydrophobicContact CG-CD1 4.09Å; S1733-L1737 WeakPolarHBondContact O-CG 3.41Å; S1733-L1737 PolarHBondContact O-N 3.27Å; F1734-L1737 PolarHBondContact O-N 3.21Å; A1735-L1737 VanDerWaalsContact C-N 3.34Å; A1735-L1737 PolarHBondContact O-N 3.35Å; L1737-I1739 VanDerWaalsContact C-N 3.29Å; L1737-I1739 PolarHBondContact O-N 3.12Å; L1737-N1740 PolarHBondContact O-N 3.18Å; L1737-N1740 VanDerWaalsContact O-N 3.12Å; L1737-Q1741 WeakPolarHBondContact O-CB 3.38Å; L1737-Q1741 WeakPolarHBondContact O-CG 3.36Å; L1737-Q1741 PolarHBondContact O-N 3.16Å; L1737-Q1741 VanDerWaalsContact O-N 3.16Å
1738	A	81.7	Confident	76.2	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-62.1	-37	-179.9	0	0	0	0	0	112.3	F1719 F1734 A1735 N1740 Q1741 I1747 H1748	F1719-A1738 HydrophobicContact CE2-CB 4.13Å; F1719-A1738 HydrophobicContact CZ-CB 3.97Å; F1734-A1738 HydrophobicContact CD1-CB 4.42Å; F1734-A1738 HydrophobicContact CE1-CB 4.29Å; F1734-A1738 VanDerWaalsContact O-CB 3.29Å; F1734-A1738 WeakPolarHBondContact O-CB 3.37Å; F1734-A1738 PolarHBondContact O-N 3.28Å; A1735-A1738 PolarHBondContact O-N 3.04Å; A1738-N1740 VanDerWaalsContact C-N 3.28Å; A1738-N1740 PolarHBondContact O-N 3.5Å; A1738-Q1741 WeakPolarHBondContact O-CB 3.31Å; A1738-Q1741 PolarHBondContact O-N 3.19Å; A1738-I1747 HydrophobicContact CB-CG2 3.76Å; A1738-H1748 WeakPolarHBondContact O-CA 3.42Å; A1738-H1748 PolarHBondContact O-ND1 3.36Å; A1738-H1748 VanDerWaalsContact O-ND1 3.15Å
1739	I	76.4	Confident	76.3	Confident	17.2 Å²	17.2	53.4 Å²	53.4	9%	0.088	26%	0.262	C	S	.	.	H	α-helix	trans	-70.5	-33.7	175.8	-69.3	170.2	0	0	0	111.9	A1735 L1737 Q1741 H1748 G1751 Y1752 L1755 R1774 I1775 L1786	A1735-I1739 WeakPolarHBondContact O-CB 3.45Å; A1735-I1739 WeakPolarHBondContact O-CD1 3.37Å; A1735-I1739 VanDerWaalsContact O-CG1 3.31Å; A1735-I1739 WeakPolarHBondContact O-CG1 3.36Å; A1735-I1739 PolarHBondContact O-N 3.07Å; L1737-I1739 VanDerWaalsContact C-N 3.29Å; L1737-I1739 PolarHBondContact O-N 3.12Å; I1739-Q1741 VanDerWaalsContact C-N 3.3Å; I1739-Q1741 PolarHBondContact O-N 3.01Å; I1739-H1748 WeakPolarHBondContact CA-ND1 3.12Å; I1739-H1748 PolarHBondContact O-CE1 3.07Å; I1739-H1748 PolarHBondContact O-ND1 3Å; I1739-G1751 VanDerWaalsContact CG1-C 3.48Å; I1739-Y1752 HydrophobicContact CD1-CD1 3.99Å; I1739-Y1752 HydrophobicContact CD1-CD2 4.49Å; I1739-Y1752 HydrophobicContact CD1-CE1 4.17Å; I1739-Y1752 HydrophobicContact CD1-CG 4.12Å; I1739-Y1752 HydrophobicContact CG1-CD1 4.42Å; I1739-Y1752 HydrophobicContact CG1-CD2 4.28Å; I1739-Y1752 HydrophobicContact CG1-CE2 4.32Å; I1739-Y1752 HydrophobicContact CG1-CG 4.34Å; I1739-Y1752 HydrophobicContact CG2-CE1 4.39Å; I1739-Y1752 HydrophobicContact CG2-CE2 4.43Å; I1739-L1755 HydrophobicContact CD1-CB 4.25Å; I1739-L1755 HydrophobicContact CD1-CD1 3.32Å; I1739-L1755 HydrophobicContact CD1-CD2 4.27Å; I1739-L1755 HydrophobicContact CD1-CG 4.19Å; I1739-L1755 HydrophobicContact CG1-CD1 4.37Å; I1739-R1774 HydrophobicContact CG2-CG 4.23Å; I1739-I1775 HydrophobicContact CG2-CB 4.39Å; I1739-I1775 HydrophobicContact CG2-CG1 4.12Å; I1739-I1775 HydrophobicContact CG2-CG2 4.17Å; I1739-L1786 HydrophobicContact CG2-CD1 4.35Å
1740	N	69.7	Low	76.5	Confident	72.8 Å²	72.8	46.8 Å²	46.8	39%	0.389	23%	0.234	S	C	.	.	H	α-helix	trans	-90.5	-5.6	-175.4	-70.7	-50.9	0	0	0	114.2	E1736 L1737 A1738 D1742 F1773 Q1791	E1736-N1740 WeakPolarHBondContact O-CB 3.37Å; E1736-N1740 VanDerWaalsContact O-CG 3.3Å; E1736-N1740 PolarHBondContact O-N 3.25Å; E1736-N1740 VanDerWaalsContact O-N 3.09Å; E1736-N1740 PolarHBondContact O-ND2 3.14Å; L1737-N1740 PolarHBondContact O-N 3.18Å; L1737-N1740 VanDerWaalsContact O-N 3.12Å; A1738-N1740 VanDerWaalsContact C-N 3.28Å; A1738-N1740 PolarHBondContact O-N 3.5Å; N1740-D1742 PolarHBondContact O-N 3.21Å; N1740-F1773 PolarHBondContact ND2-O 2.83Å; N1740-Q1791 HydrophobicContact CB-CG 4.41Å
1741	Q	70	Confident	76.5	Confident	31.2 Å²	31.2	42.3 Å²	42.3	15%	0.146	21%	0.213	C	C	.	.			trans	-95.6	118.5	-176.1	-147	161.2	-11.8	0	0	113	F1719 S1722 N1723 L1737 A1738 I1739 V1743 I1747 H1748 I1789 Q1791	F1719-Q1741 HydrophobicContact CD2-CB 4.44Å; F1719-Q1741 HydrophobicContact CD2-CG 4.28Å; F1719-Q1741 HydrophobicContact CE2-CB 4.44Å; S1722-Q1741 PolarHBondContact OG-NE2 3.09Å; N1723-Q1741 VanDerWaalsContact CG-NE2 3.28Å; N1723-Q1741 PolarHBondContact ND2-NE2 3.26Å; N1723-Q1741 VanDerWaalsContact ND2-NE2 3.16Å; N1723-Q1741 PolarHBondContact ND2-OE1 3.1Å; N1723-Q1741 PolarHBondContact OD1-NE2 2.7Å; N1723-Q1741 PolarHBondContact OD1-OE1 2.98Å; L1737-Q1741 WeakPolarHBondContact O-CB 3.38Å; L1737-Q1741 WeakPolarHBondContact O-CG 3.36Å; L1737-Q1741 PolarHBondContact O-N 3.16Å; L1737-Q1741 VanDerWaalsContact O-N 3.16Å; A1738-Q1741 WeakPolarHBondContact O-CB 3.31Å; A1738-Q1741 PolarHBondContact O-N 3.19Å; I1739-Q1741 VanDerWaalsContact C-N 3.3Å; I1739-Q1741 PolarHBondContact O-N 3.01Å; Q1741-V1743 VanDerWaalsContact C-N 3.29Å; Q1741-V1743 HydrophobicContact CB-CG2 4.24Å; Q1741-V1743 VanDerWaalsContact CD-CG2 3.41Å; Q1741-V1743 HydrophobicContact CG-CB 4.13Å; Q1741-V1743 HydrophobicContact CG-CG2 3.76Å; Q1741-V1743 VanDerWaalsContact NE2-CG2 3.3Å; Q1741-V1743 PolarHBondContact O-N 3.21Å; Q1741-I1747 HydrophobicContact CB-CG2 4.06Å; Q1741-I1747 HydrophobicContact CG-CG2 4.43Å; Q1741-H1748 VanDerWaalsContact C-CE1 3.49Å; Q1741-H1748 PolarHBondContact O-CE1 3.13Å; Q1741-H1748 PolarHBondContact O-NE2 3.41Å; Q1741-I1789 VanDerWaalsContact O-CD1 3.31Å; Q1741-I1789 WeakPolarHBondContact O-CD1 3.32Å; Q1741-Q1791 VanDerWaalsContact CG-OE1 3.27Å
1742	D	62.3	Low	76.4	Confident	111.2 Å²	111.2	44.7 Å²	44.7	60%	0.595	22%	0.221	S	C	*	.			trans	-78.1	30.7	-178.2	-131	7.3	0	0	0	113.3	N1740 K1788 I1789 Q1791	N1740-D1742 PolarHBondContact O-N 3.21Å; D1742-K1788 WeakPolarHBondContact OD1-CE 3.42Å; D1742-K1788 IonicContact OD1-NZ 2.79Å; D1742-K1788 WeakPolarHBondContact OD2-CE 3.38Å; D1742-K1788 IonicContact OD2-NZ 3.57Å; D1742-K1788 PolarHBondContact OD2-NZ 3.19Å; D1742-I1789 HydrophobicContact CB-CD1 4.09Å; D1742-I1789 HydrophobicContact CB-CG2 4.14Å; D1742-I1789 VanDerWaalsContact OD1-CD1 3.31Å; D1742-I1789 WeakPolarHBondContact OD1-CD1 3.35Å; D1742-Q1791 PolarHBondContact OD2-NE2 3.31Å
1743	V	62.3	Low	76.2	Confident	68.8 Å²	68.8	38.7 Å²	38.7	42%	0.417	20%	0.197	S	C	.	.	S	Bend	trans	-90.9	-44.7	-175.1	-176.6	0	0	0	0	112	T1715 R1718 F1719 Q1741 I1747 I1793	T1715-V1743 HydrophobicContact CG2-CG1 4.44Å; R1718-V1743 HydrophobicContact CB-CG1 4.34Å; F1719-V1743 HydrophobicContact CD2-CG2 4.17Å; Q1741-V1743 VanDerWaalsContact C-N 3.29Å; Q1741-V1743 HydrophobicContact CB-CG2 4.24Å; Q1741-V1743 VanDerWaalsContact CD-CG2 3.41Å; Q1741-V1743 HydrophobicContact CG-CB 4.13Å; Q1741-V1743 HydrophobicContact CG-CG2 3.76Å; Q1741-V1743 VanDerWaalsContact NE2-CG2 3.3Å; Q1741-V1743 PolarHBondContact O-N 3.21Å; V1743-I1747 HydrophobicContact CB-CD1 4.03Å; V1743-I1747 HydrophobicContact CG1-CD1 3.87Å; V1743-I1793 HydrophobicContact CG2-CD1 4.37Å
1744	D	72.2	Confident	75.9	Confident	57.4 Å²	57.4	38.5 Å²	38.5	31%	0.307	20%	0.196	S	C	.	.			trans	-154.3	132.1	-176.8	-132.8	-55.5	0	0	0	110.7	T1715 R1718 W1746 I1747 H1748	T1715-D1744 VanDerWaalsContact CB-OD2 3.29Å; T1715-D1744 WeakPolarHBondContact CB-OD2 3.32Å; T1715-D1744 HydrophobicContact CG2-CB 3.78Å; T1715-D1744 VanDerWaalsContact CG2-CG 3.49Å; T1715-D1744 WeakPolarHBondContact CG2-OD1 3.44Å; T1715-D1744 WeakPolarHBondContact CG2-OD2 3.3Å; T1715-D1744 PolarHBondContact OG1-OD1 2.95Å; T1715-D1744 PolarHBondContact OG1-OD2 3.13Å; T1715-D1744 VanDerWaalsContact OG1-OD2 3.05Å; R1718-D1744 IonicContact NH1-OD2 3.42Å; D1744-W1746 PolarHBondContact O-N 3.18Å; D1744-W1746 VanDerWaalsContact O-N 3.16Å; D1744-W1746 VanDerWaalsContact OD1-CB 3.25Å; D1744-W1746 WeakPolarHBondContact OD1-CB 3.19Å; D1744-W1746 PolarHBondContact OD1-N 3.36Å; D1744-W1746 VanDerWaalsContact OD1-N 3.07Å; D1744-I1747 HydrophobicContact CB-CB 4.46Å; D1744-I1747 HydrophobicContact CB-CD1 4.19Å; D1744-I1747 HydrophobicContact CB-CG1 4.35Å; D1744-I1747 PolarHBondContact O-N 3.08Å; D1744-I1747 VanDerWaalsContact O-N 3.09Å; D1744-H1748 PolarHBondContact O-CD2 3.42Å; D1744-H1748 PolarHBondContact O-N 2.87Å
1745	E	76.1	Confident	75.3	Confident	162.2 Å²	162.2	39.2 Å²	39.2	76%	0.758	20%	0.199	S	C	*	.	H	α-helix	trans	-56.7	-31.5	178.9	-159	178	-178.2	0	0	112.3	I1747 H1748 T1749	E1745-I1747 PolarHBondContact O-N 3.44Å; E1745-H1748 WeakPolarHBondContact O-CB 3.4Å; E1745-H1748 PolarHBondContact O-N 3.12Å; E1745-T1749 WeakPolarHBondContact O-CB 3.39Å; E1745-T1749 PolarHBondContact O-N 3.07Å; E1745-T1749 VanDerWaalsContact O-N 3.08Å; E1745-T1749 PolarHBondContact O-OG1 3.2Å
1746	W	80.5	Confident	74.8	Confident	23.8 Å²	23.8	41.6 Å²	41.6	9%	0.09	21%	0.211	C	C	.	.	H	α-helix	trans	-68.1	-38	178	-178.4	68.4	0	0	0	112.8	L1474 T1663 M1709 K1712 T1715 M1716 D1744 H1748 T1749 I1750	L1474-W1746 HydrophobicContact CB-CZ2 4.41Å; L1474-W1746 HydrophobicContact CD1-CZ2 4.37Å; L1474-W1746 PolarHBondContact O-NE1 3.19Å; T1663-W1746 HydrophobicContact CG2-CH2 3.64Å; T1663-W1746 HydrophobicContact CG2-CZ2 4.14Å; M1709-W1746 HydrophobicContact CE-CZ2 4.45Å; K1712-W1746 HydrophobicContact CB-CD2 4.3Å; K1712-W1746 HydrophobicContact CB-CE3 4.09Å; K1712-W1746 HydrophobicContact CB-CH2 3.6Å; K1712-W1746 HydrophobicContact CB-CZ2 3.84Å; K1712-W1746 HydrophobicContact CB-CZ3 3.73Å; K1712-W1746 HydrophobicContact CD-CB 4.48Å; K1712-W1746 HydrophobicContact CD-CD2 3.97Å; K1712-W1746 HydrophobicContact CD-CE3 4.22Å; K1712-W1746 HydrophobicContact CD-CG 4.25Å; K1712-W1746 HydrophobicContact CD-CH2 4.38Å; K1712-W1746 HydrophobicContact CD-CZ2 3.8Å; K1712-W1746 HydrophobicContact CD-CZ3 4.4Å; K1712-W1746 HydrophobicContact CG-CD2 3.91Å; K1712-W1746 HydrophobicContact CG-CE3 3.93Å; K1712-W1746 HydrophobicContact CG-CG 4.39Å; K1712-W1746 HydrophobicContact CG-CH2 4.15Å; K1712-W1746 HydrophobicContact CG-CZ2 3.94Å; K1712-W1746 HydrophobicContact CG-CZ3 4.09Å; K1712-W1746 WeakPolarHBondContact O-CZ3 3.36Å; T1715-W1746 HydrophobicContact CG2-CE3 4.02Å; T1715-W1746 HydrophobicContact CG2-CZ3 4.33Å; M1716-W1746 HydrophobicContact CB-CZ3 4.32Å; M1716-W1746 HydrophobicContact CE-CH2 4.38Å; M1716-W1746 HydrophobicContact CE-CZ3 4.36Å; D1744-W1746 PolarHBondContact O-N 3.18Å; D1744-W1746 VanDerWaalsContact O-N 3.16Å; D1744-W1746 VanDerWaalsContact OD1-CB 3.25Å; D1744-W1746 WeakPolarHBondContact OD1-CB 3.19Å; D1744-W1746 PolarHBondContact OD1-N 3.36Å; D1744-W1746 VanDerWaalsContact OD1-N 3.07Å; W1746-H1748 VanDerWaalsContact C-N 3.3Å; W1746-H1748 PolarHBondContact O-N 3.16Å; W1746-T1749 WeakPolarHBondContact O-CB 3.38Å; W1746-T1749 PolarHBondContact O-N 3.1Å; W1746-I1750 HydrophobicContact CD2-CD1 3.81Å; W1746-I1750 VanDerWaalsContact CE2-CD1 3.5Å; W1746-I1750 HydrophobicContact CE3-CD1 3.89Å; W1746-I1750 HydrophobicContact CG-CD1 4.45Å; W1746-I1750 HydrophobicContact CH2-CD1 3.53Å; W1746-I1750 VanDerWaalsContact CH2-CD1 3.4Å; W1746-I1750 HydrophobicContact CZ2-CD1 3.48Å; W1746-I1750 VanDerWaalsContact CZ2-CD1 3.45Å; W1746-I1750 HydrophobicContact CZ2-CG1 4.38Å; W1746-I1750 HydrophobicContact CZ3-CD1 3.74Å; W1746-I1750 WeakPolarHBondContact O-CG1 3.28Å; W1746-I1750 PolarHBondContact O-N 2.86Å; W1746-I1750 VanDerWaalsContact O-N 3.07Å
1747	I	82.9	Confident	74.2	Confident	2 Å²	2	40.6 Å²	40.6	1%	0.01	21%	0.21	C	C	.	.	H	α-helix	trans	-66.1	-42.1	175	-67.2	175.3	0	0	0	110.4	T1715 F1719 A1738 Q1741 V1743 D1744 E1745 T1749 I1750 G1751	T1715-I1747 HydrophobicContact CG2-CD1 3.39Å; T1715-I1747 VanDerWaalsContact CG2-CD1 3.46Å; T1715-I1747 HydrophobicContact CG2-CG1 3.61Å; T1715-I1747 VanDerWaalsContact CG2-CG1 3.43Å; T1715-I1747 WeakPolarHBondContact O-CD1 3.41Å; F1719-I1747 HydrophobicContact CB-CD1 3.57Å; F1719-I1747 HydrophobicContact CB-CG1 4.39Å; F1719-I1747 HydrophobicContact CD2-CD1 4.32Å; F1719-I1747 HydrophobicContact CD2-CG2 3.78Å; F1719-I1747 HydrophobicContact CE2-CG2 4.1Å; F1719-I1747 HydrophobicContact CG-CD1 4.15Å; F1719-I1747 HydrophobicContact CG-CG2 4.19Å; A1738-I1747 HydrophobicContact CB-CG2 3.76Å; Q1741-I1747 HydrophobicContact CB-CG2 4.06Å; Q1741-I1747 HydrophobicContact CG-CG2 4.43Å; V1743-I1747 HydrophobicContact CB-CD1 4.03Å; V1743-I1747 HydrophobicContact CG1-CD1 3.87Å; D1744-I1747 HydrophobicContact CB-CB 4.46Å; D1744-I1747 HydrophobicContact CB-CD1 4.19Å; D1744-I1747 HydrophobicContact CB-CG1 4.35Å; D1744-I1747 PolarHBondContact O-N 3.08Å; D1744-I1747 VanDerWaalsContact O-N 3.09Å; E1745-I1747 PolarHBondContact O-N 3.44Å; I1747-T1749 VanDerWaalsContact C-N 3.28Å; I1747-T1749 PolarHBondContact O-N 3.27Å; I1747-I1750 WeakPolarHBondContact O-CB 3.38Å; I1747-I1750 PolarHBondContact O-N 3.34Å; I1747-I1750 VanDerWaalsContact O-N 3.12Å; I1747-G1751 PolarHBondContact O-N 3.24Å
1748	H	77.8	Confident	73.2	Confident	40.2 Å²	40.2	41.1 Å²	41.1	19%	0.186	22%	0.216	C	C	.	.	H	α-helix	trans	-58.4	-43.5	175.5	-155.3	77.3	0	0	0	111.3	A1738 I1739 Q1741 D1744 E1745 W1746 I1750 G1751 Y1752 L1786	A1738-H1748 WeakPolarHBondContact O-CA 3.42Å; A1738-H1748 PolarHBondContact O-ND1 3.36Å; A1738-H1748 VanDerWaalsContact O-ND1 3.15Å; I1739-H1748 WeakPolarHBondContact CA-ND1 3.12Å; I1739-H1748 PolarHBondContact O-CE1 3.07Å; I1739-H1748 PolarHBondContact O-ND1 3Å; Q1741-H1748 VanDerWaalsContact C-CE1 3.49Å; Q1741-H1748 PolarHBondContact O-CE1 3.13Å; Q1741-H1748 PolarHBondContact O-NE2 3.41Å; D1744-H1748 PolarHBondContact O-CD2 3.42Å; D1744-H1748 PolarHBondContact O-N 2.87Å; E1745-H1748 WeakPolarHBondContact O-CB 3.4Å; E1745-H1748 PolarHBondContact O-N 3.12Å; W1746-H1748 VanDerWaalsContact C-N 3.3Å; W1746-H1748 PolarHBondContact O-N 3.16Å; H1748-I1750 VanDerWaalsContact C-N 3.33Å; H1748-I1750 PolarHBondContact O-N 3.09Å; H1748-G1751 PolarHBondContact O-N 3.12Å; H1748-G1751 VanDerWaalsContact O-N 3.15Å; H1748-Y1752 AromaticContact CD2-CD2 3.84Å; H1748-Y1752 AromaticContact CD2-CE2 3.25Å; H1748-Y1752 WeakPolarHBondContact CD2-CE2 3.29Å; H1748-Y1752 AromaticContact CE1-CE2 3.61Å; H1748-Y1752 AromaticContact CE1-CZ 3.74Å; H1748-Y1752 AromaticContact CG-CE2 3.98Å; H1748-Y1752 AromaticContact NE2-CD2 3.96Å; H1748-Y1752 AromaticContact NE2-CE2 2.98Å; H1748-Y1752 WeakPolarHBondContact NE2-CE2 3.43Å; H1748-Y1752 AromaticContact NE2-CZ 3.39Å; H1748-Y1752 PolarHBondContact NE2-OH 3.49Å; H1748-Y1752 VanDerWaalsContact NE2-OH 3.17Å; H1748-Y1752 WeakPolarHBondContact O-CB 3.3Å; H1748-Y1752 WeakPolarHBondContact O-CD2 3.37Å; H1748-Y1752 PolarHBondContact O-N 3.13Å; H1748-L1786 HydrophobicContact CB-CD2 3.93Å; H1748-L1786 WeakPolarHBondContact CD2-CD2 3.14Å; H1748-L1786 WeakPolarHBondContact NE2-CD2 3.14Å
1749	T	78.1	Confident	71.8	Confident	38.6 Å²	38.6	43.8 Å²	43.8	24%	0.237	23%	0.23	C	C	.	.	H	α-helix	trans	-61.6	-40.6	176.4	-54.6	0	0	0	0	112.1	L1477 I1480 E1745 W1746 I1747 Y1752 A1753	L1477-T1749 HydrophobicContact CD1-CG2 3.91Å; I1480-T1749 HydrophobicContact CD1-CG2 4.41Å; E1745-T1749 WeakPolarHBondContact O-CB 3.39Å; E1745-T1749 PolarHBondContact O-N 3.07Å; E1745-T1749 VanDerWaalsContact O-N 3.08Å; E1745-T1749 PolarHBondContact O-OG1 3.2Å; W1746-T1749 WeakPolarHBondContact O-CB 3.38Å; W1746-T1749 PolarHBondContact O-N 3.1Å; I1747-T1749 VanDerWaalsContact C-N 3.28Å; I1747-T1749 PolarHBondContact O-N 3.27Å; T1749-Y1752 PolarHBondContact O-N 3.19Å; T1749-A1753 WeakPolarHBondContact O-CB 3.19Å; T1749-A1753 PolarHBondContact O-N 3.29Å
1750	I	81	Confident	70.4	Confident	3 Å²	3	50.2 Å²	50.2	2%	0.015	26%	0.255	C	S	.	.	H	α-helix	trans	-63.8	-45.7	174.1	-69.4	168	0	0	0	111.2	I1480 P1665 M1716 F1734 W1746 I1747 H1748 Y1752 A1753 C1754	I1480-I1750 HydrophobicContact CD1-CG1 4.28Å; P1665-I1750 HydrophobicContact CG-CG2 3.34Å; M1716-I1750 HydrophobicContact CE-CD1 3.81Å; F1734-I1750 HydrophobicContact CE1-CG2 4.25Å; W1746-I1750 HydrophobicContact CD2-CD1 3.81Å; W1746-I1750 VanDerWaalsContact CE2-CD1 3.5Å; W1746-I1750 HydrophobicContact CE3-CD1 3.89Å; W1746-I1750 HydrophobicContact CG-CD1 4.45Å; W1746-I1750 HydrophobicContact CH2-CD1 3.53Å; W1746-I1750 VanDerWaalsContact CH2-CD1 3.4Å; W1746-I1750 HydrophobicContact CZ2-CD1 3.48Å; W1746-I1750 VanDerWaalsContact CZ2-CD1 3.45Å; W1746-I1750 HydrophobicContact CZ2-CG1 4.38Å; W1746-I1750 HydrophobicContact CZ3-CD1 3.74Å; W1746-I1750 WeakPolarHBondContact O-CG1 3.28Å; W1746-I1750 PolarHBondContact O-N 2.86Å; W1746-I1750 VanDerWaalsContact O-N 3.07Å; I1747-I1750 WeakPolarHBondContact O-CB 3.38Å; I1747-I1750 PolarHBondContact O-N 3.34Å; I1747-I1750 VanDerWaalsContact O-N 3.12Å; H1748-I1750 VanDerWaalsContact C-N 3.33Å; H1748-I1750 PolarHBondContact O-N 3.09Å; I1750-Y1752 VanDerWaalsContact C-N 3.28Å; I1750-Y1752 PolarHBondContact O-N 3.15Å; I1750-A1753 WeakPolarHBondContact O-CB 3.31Å; I1750-A1753 PolarHBondContact O-N 3.31Å; I1750-A1753 VanDerWaalsContact O-N 3.11Å; I1750-C1754 PolarHBondContact O-N 3.27Å; I1750-C1754 PolarHBondContact O-SG 3.23Å; I1750-C1754 VanDerWaalsContact O-SG 3.37Å
1751	G	78.2	Confident	69.3	Low	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-57.4	-42.8	176.6	0	0	0	0	0	111.9	I1739 I1747 H1748 C1754 L1755	I1739-G1751 VanDerWaalsContact CG1-C 3.48Å; I1747-G1751 PolarHBondContact O-N 3.24Å; H1748-G1751 PolarHBondContact O-N 3.12Å; H1748-G1751 VanDerWaalsContact O-N 3.15Å; G1751-C1754 WeakPolarHBondContact O-CB 3.43Å; G1751-C1754 PolarHBondContact O-N 3.17Å; G1751-L1755 WeakPolarHBondContact O-CB 3.34Å; G1751-L1755 PolarHBondContact O-N 3.25Å; G1751-L1755 VanDerWaalsContact O-N 3.15Å
1752	Y	74.5	Confident	68.1	Low	67.2 Å²	67.2	56 Å²	56	26%	0.264	28%	0.279	S	S	.	.	H	α-helix	trans	-64.6	-42.1	173.8	-134.5	-92	0	0	0	112.9	I1739 H1748 T1749 I1750 C1754 L1755 L1756 R1774 I1775 L1777 I1785	I1739-Y1752 HydrophobicContact CD1-CD1 3.99Å; I1739-Y1752 HydrophobicContact CD1-CD2 4.49Å; I1739-Y1752 HydrophobicContact CD1-CE1 4.17Å; I1739-Y1752 HydrophobicContact CD1-CG 4.12Å; I1739-Y1752 HydrophobicContact CG1-CD1 4.42Å; I1739-Y1752 HydrophobicContact CG1-CD2 4.28Å; I1739-Y1752 HydrophobicContact CG1-CE2 4.32Å; I1739-Y1752 HydrophobicContact CG1-CG 4.34Å; I1739-Y1752 HydrophobicContact CG2-CE1 4.39Å; I1739-Y1752 HydrophobicContact CG2-CE2 4.43Å; H1748-Y1752 AromaticContact CD2-CD2 3.84Å; H1748-Y1752 AromaticContact CD2-CE2 3.25Å; H1748-Y1752 WeakPolarHBondContact CD2-CE2 3.29Å; H1748-Y1752 AromaticContact CE1-CE2 3.61Å; H1748-Y1752 AromaticContact CE1-CZ 3.74Å; H1748-Y1752 AromaticContact CG-CE2 3.98Å; H1748-Y1752 AromaticContact NE2-CD2 3.96Å; H1748-Y1752 AromaticContact NE2-CE2 2.98Å; H1748-Y1752 WeakPolarHBondContact NE2-CE2 3.43Å; H1748-Y1752 AromaticContact NE2-CZ 3.39Å; H1748-Y1752 PolarHBondContact NE2-OH 3.49Å; H1748-Y1752 VanDerWaalsContact NE2-OH 3.17Å; H1748-Y1752 WeakPolarHBondContact O-CB 3.3Å; H1748-Y1752 WeakPolarHBondContact O-CD2 3.37Å; H1748-Y1752 PolarHBondContact O-N 3.13Å; T1749-Y1752 PolarHBondContact O-N 3.19Å; I1750-Y1752 VanDerWaalsContact C-N 3.28Å; I1750-Y1752 PolarHBondContact O-N 3.15Å; Y1752-C1754 VanDerWaalsContact C-N 3.33Å; Y1752-C1754 PolarHBondContact O-N 3.15Å; Y1752-L1755 HydrophobicContact CD2-CD2 4.28Å; Y1752-L1755 HydrophobicContact CE2-CD2 4.39Å; Y1752-L1755 WeakPolarHBondContact O-CB 3.49Å; Y1752-L1755 PolarHBondContact O-N 3.24Å; Y1752-L1755 VanDerWaalsContact O-N 3.16Å; Y1752-L1756 HydrophobicContact CD1-CD1 3.78Å; Y1752-L1756 HydrophobicContact CD1-CG 4.31Å; Y1752-L1756 HydrophobicContact CE1-CD1 3.48Å; Y1752-L1756 VanDerWaalsContact CE1-CD1 3.47Å; Y1752-L1756 HydrophobicContact CE1-CD2 4.45Å; Y1752-L1756 HydrophobicContact CE1-CG 4.03Å; Y1752-L1756 WeakPolarHBondContact O-CB 3.26Å; Y1752-L1756 WeakPolarHBondContact O-CG 3.36Å; Y1752-L1756 PolarHBondContact O-N 3.25Å; Y1752-R1774 VanDerWaalsContact CE2-NH1 3.28Å; Y1752-I1775 HydrophobicContact CE1-CD1 3.84Å; Y1752-I1775 HydrophobicContact CE1-CG1 4.08Å; Y1752-I1775 HydrophobicContact CE1-CG2 4.21Å; Y1752-I1775 WeakPolarHBondContact OH-CG2 3.45Å; Y1752-L1777 HydrophobicContact CD1-CD1 4.5Å; Y1752-L1777 HydrophobicContact CD2-CD1 4.13Å; Y1752-L1777 HydrophobicContact CE1-CD1 3.81Å; Y1752-L1777 HydrophobicContact CE2-CD1 3.98Å; Y1752-L1777 HydrophobicContact CE2-CD2 4.32Å; Y1752-I1785 HydrophobicContact CE1-CG2 4.42Å
1753	A	73.9	Confident	67.3	Low	1.8 Å²	1.8	58.9 Å²	58.9	2%	0.015	29%	0.287	C	S	.	.	H	α-helix	trans	-59.3	-41.2	176	0	0	0	0	0	112.1	L1477 I1480 M1481 T1749 I1750 L1755 L1756 S1757	L1477-A1753 HydrophobicContact CD1-CB 3.73Å; I1480-A1753 HydrophobicContact CG2-CB 3.95Å; M1481-A1753 HydrophobicContact CG-CB 4.12Å; T1749-A1753 WeakPolarHBondContact O-CB 3.19Å; T1749-A1753 PolarHBondContact O-N 3.29Å; I1750-A1753 WeakPolarHBondContact O-CB 3.31Å; I1750-A1753 PolarHBondContact O-N 3.31Å; I1750-A1753 VanDerWaalsContact O-N 3.11Å; A1753-L1755 VanDerWaalsContact C-N 3.33Å; A1753-L1755 PolarHBondContact O-N 2.94Å; A1753-L1756 PolarHBondContact O-N 3.22Å; A1753-S1757 WeakPolarHBondContact O-CB 3.39Å; A1753-S1757 PolarHBondContact O-N 3.12Å; A1753-S1757 PolarHBondContact O-OG 3.26Å
1754	C	74	Confident	66.5	Low	16.2 Å²	16.2	61.9 Å²	61.9	11%	0.109	30%	0.299	C	S	.	.	H	α-helix	trans	-64.2	-41.5	175.8	-67.1	0	0	0	0	112.4	P1665 A1735 I1750 G1751 Y1752 L1756 S1757 S1758 F1773	P1665-C1754 VanDerWaalsContact CB-SG 3.53Å; P1665-C1754 WeakPolarHBondContact CB-SG 3.26Å; P1665-C1754 VanDerWaalsContact CG-SG 3.54Å; P1665-C1754 WeakPolarHBondContact CG-SG 3.33Å; A1735-C1754 HydrophobicContact CB-CB 3.81Å; I1750-C1754 PolarHBondContact O-N 3.27Å; I1750-C1754 PolarHBondContact O-SG 3.23Å; I1750-C1754 VanDerWaalsContact O-SG 3.37Å; G1751-C1754 WeakPolarHBondContact O-CB 3.43Å; G1751-C1754 PolarHBondContact O-N 3.17Å; Y1752-C1754 VanDerWaalsContact C-N 3.33Å; Y1752-C1754 PolarHBondContact O-N 3.15Å; C1754-L1756 VanDerWaalsContact C-N 3.32Å; C1754-L1756 PolarHBondContact O-N 2.91Å; C1754-S1757 WeakPolarHBondContact CA-OG 3.24Å; C1754-S1757 PolarHBondContact O-N 3.24Å; C1754-S1757 VanDerWaalsContact O-N 3.14Å; C1754-S1757 PolarHBondContact O-OG 3.04Å; C1754-S1757 VanDerWaalsContact O-OG 3.09Å; C1754-S1758 PolarHBondContact O-N 3.14Å; C1754-S1758 VanDerWaalsContact O-N 3.12Å; C1754-S1758 PolarHBondContact O-OG 3.25Å; C1754-F1773 HydrophobicContact CB-CE1 4.35Å; C1754-F1773 HydrophobicContact CB-CZ 4.01Å
1755	L	71	Confident	65	Low	16.2 Å²	16.2	64.7 Å²	64.7	9%	0.085	31%	0.314	C	S	.	.	H	α-helix	trans	-67.3	-36.7	177.3	-127.9	144.6	0	0	0	112.1	A1735 I1739 G1751 Y1752 A1753 S1757 S1758 N1759 F1772 F1773 I1775 L1777	A1735-L1755 HydrophobicContact CB-CD1 3.98Å; A1735-L1755 HydrophobicContact CB-CD2 3.89Å; A1735-L1755 HydrophobicContact CB-CG 4.08Å; I1739-L1755 HydrophobicContact CD1-CB 4.25Å; I1739-L1755 HydrophobicContact CD1-CD1 3.32Å; I1739-L1755 HydrophobicContact CD1-CD2 4.27Å; I1739-L1755 HydrophobicContact CD1-CG 4.19Å; I1739-L1755 HydrophobicContact CG1-CD1 4.37Å; G1751-L1755 WeakPolarHBondContact O-CB 3.34Å; G1751-L1755 PolarHBondContact O-N 3.25Å; G1751-L1755 VanDerWaalsContact O-N 3.15Å; Y1752-L1755 HydrophobicContact CD2-CD2 4.28Å; Y1752-L1755 HydrophobicContact CE2-CD2 4.39Å; Y1752-L1755 WeakPolarHBondContact O-CB 3.49Å; Y1752-L1755 PolarHBondContact O-N 3.24Å; Y1752-L1755 VanDerWaalsContact O-N 3.16Å; A1753-L1755 VanDerWaalsContact C-N 3.33Å; A1753-L1755 PolarHBondContact O-N 2.94Å; L1755-S1757 PolarHBondContact O-N 2.99Å; L1755-S1758 PolarHBondContact O-N 3.42Å; L1755-S1758 PolarHBondContact O-OG 3.34Å; L1755-S1758 VanDerWaalsContact O-OG 3.11Å; L1755-N1759 WeakPolarHBondContact CD2-ND2 3.24Å; L1755-N1759 WeakPolarHBondContact O-CB 3.28Å; L1755-N1759 PolarHBondContact O-N 2.9Å; L1755-N1759 PolarHBondContact O-ND2 3.33Å; L1755-F1772 HydrophobicContact CD1-CB 3.48Å; L1755-F1772 VanDerWaalsContact CD1-CB 3.48Å; L1755-F1772 HydrophobicContact CD1-CD2 3.62Å; L1755-F1772 HydrophobicContact CD1-CG 3.74Å; L1755-F1773 HydrophobicContact CD1-CB 3.99Å; L1755-F1773 HydrophobicContact CD1-CD1 3.88Å; L1755-F1773 HydrophobicContact CD1-CD2 3.88Å; L1755-F1773 HydrophobicContact CD1-CE1 4.33Å; L1755-F1773 HydrophobicContact CD1-CE2 4.33Å; L1755-F1773 HydrophobicContact CD1-CG 3.63Å; L1755-F1773 HydrophobicContact CD2-CB 3.79Å; L1755-F1773 HydrophobicContact CD2-CD1 4.41Å; L1755-F1773 HydrophobicContact CD2-CD2 4.46Å; L1755-F1773 HydrophobicContact CD2-CE2 4.26Å; L1755-F1773 HydrophobicContact CD2-CG 4.02Å; L1755-F1773 HydrophobicContact CD2-CZ 3.96Å; L1755-F1773 HydrophobicContact CG-CD2 4.33Å; L1755-F1773 HydrophobicContact CG-CE2 4.47Å; L1755-I1775 HydrophobicContact CD1-CB 4.44Å; L1755-I1775 HydrophobicContact CD1-CG2 4.24Å; L1755-I1775 HydrophobicContact CD2-CB 4.42Å; L1755-I1775 WeakPolarHBondContact CD2-O 3.48Å; L1755-L1777 HydrophobicContact CB-CD1 3.72Å; L1755-L1777 HydrophobicContact CB-CG 4.31Å; L1755-L1777 HydrophobicContact CD1-CD1 4.37Å; L1755-L1777 HydrophobicContact CD1-CG 4.31Å; L1755-L1777 HydrophobicContact CD2-CD1 4.19Å
1756	L	69.2	Low	63.2	Low	59.8 Å²	59.8	60.4 Å²	60.4	31%	0.313	31%	0.313	S	S	.	.	H	α-helix	trans	-69.3	-37.5	174.5	-72.2	173	0	0	0	112.4	L1477 M1481 Y1752 A1753 C1754 S1758 N1759 Y1760 L1777	L1477-L1756 HydrophobicContact CD2-CD1 4.04Å; M1481-L1756 HydrophobicContact CE-CB 4.1Å; M1481-L1756 HydrophobicContact SD-CB 4.28Å; M1481-L1756 HydrophobicContact SD-CD1 4.28Å; Y1752-L1756 HydrophobicContact CD1-CD1 3.78Å; Y1752-L1756 HydrophobicContact CD1-CG 4.31Å; Y1752-L1756 HydrophobicContact CE1-CD1 3.48Å; Y1752-L1756 VanDerWaalsContact CE1-CD1 3.47Å; Y1752-L1756 HydrophobicContact CE1-CD2 4.45Å; Y1752-L1756 HydrophobicContact CE1-CG 4.03Å; Y1752-L1756 WeakPolarHBondContact O-CB 3.26Å; Y1752-L1756 WeakPolarHBondContact O-CG 3.36Å; Y1752-L1756 PolarHBondContact O-N 3.25Å; A1753-L1756 PolarHBondContact O-N 3.22Å; C1754-L1756 VanDerWaalsContact C-N 3.32Å; C1754-L1756 PolarHBondContact O-N 2.91Å; L1756-S1758 VanDerWaalsContact C-N 3.32Å; L1756-S1758 PolarHBondContact O-N 2.88Å; L1756-N1759 PolarHBondContact O-N 2.99Å; L1756-Y1760 PolarHBondContact O-N 2.97Å; L1756-Y1760 VanDerWaalsContact O-N 3.1Å; L1756-L1777 HydrophobicContact CD2-CD1 3.82Å; L1756-L1777 HydrophobicContact CG-CD1 4.18Å
1757	S	65.6	Low	61.2	Low	36.2 Å²	36.2	66.2 Å²	66.2	25%	0.253	35%	0.346	S	S	.	.	H	α-helix	trans	-69.2	-38	-179.5	54.7	0	0	0	0	112.6	A1753 C1754 L1755 N1759 Y1760 Q1761	A1753-S1757 WeakPolarHBondContact O-CB 3.39Å; A1753-S1757 PolarHBondContact O-N 3.12Å; A1753-S1757 PolarHBondContact O-OG 3.26Å; C1754-S1757 WeakPolarHBondContact CA-OG 3.24Å; C1754-S1757 PolarHBondContact O-N 3.24Å; C1754-S1757 VanDerWaalsContact O-N 3.14Å; C1754-S1757 PolarHBondContact O-OG 3.04Å; C1754-S1757 VanDerWaalsContact O-OG 3.09Å; L1755-S1757 PolarHBondContact O-N 2.99Å; S1757-N1759 VanDerWaalsContact C-N 3.32Å; S1757-N1759 PolarHBondContact O-N 3.49Å; S1757-Y1760 WeakPolarHBondContact O-CB 3.49Å; S1757-Y1760 PolarHBondContact O-N 3.03Å; S1757-Q1761 PolarHBondContact O-N 3.24Å; S1757-Q1761 VanDerWaalsContact O-N 3.15Å
1758	S	60	Low	59	Low	38 Å²	38	73.5 Å²	73.5	27%	0.266	38%	0.384	S	S	.	.	H	α-helix	trans	-65.3	-40.9	175.8	60.2	0	0	0	0	112.5	C1754 L1755 L1756 Y1760 Q1761 E1762 F1772 F1773	C1754-S1758 PolarHBondContact O-N 3.14Å; C1754-S1758 VanDerWaalsContact O-N 3.12Å; C1754-S1758 PolarHBondContact O-OG 3.25Å; L1755-S1758 PolarHBondContact O-N 3.42Å; L1755-S1758 PolarHBondContact O-OG 3.34Å; L1755-S1758 VanDerWaalsContact O-OG 3.11Å; L1756-S1758 VanDerWaalsContact C-N 3.32Å; L1756-S1758 PolarHBondContact O-N 2.88Å; S1758-Y1760 VanDerWaalsContact C-N 3.29Å; S1758-Y1760 PolarHBondContact O-N 3.26Å; S1758-Q1761 PolarHBondContact O-N 3.03Å; S1758-E1762 PolarHBondContact O-N 3.17Å; S1758-E1762 VanDerWaalsContact O-N 3.09Å; S1758-F1772 VanDerWaalsContact OG-CE2 3.23Å; S1758-F1772 WeakPolarHBondContact OG-CE2 3.39Å; S1758-F1773 VanDerWaalsContact CB-CD2 3.46Å; S1758-F1773 VanDerWaalsContact OG-CD2 3.3Å; S1758-F1773 WeakPolarHBondContact OG-CD2 3.42Å
1759	N	53.1	Low	57.1	Low	55 Å²	55	74.8 Å²	74.8	29%	0.294	40%	0.397	S	S	.	.	H	α-helix	trans	-66	-23.3	175.7	-76.5	-28.1	0	0	0	113.3	L1755 L1756 S1757 Q1761 E1762 K1763 L1777	L1755-N1759 WeakPolarHBondContact CD2-ND2 3.24Å; L1755-N1759 WeakPolarHBondContact O-CB 3.28Å; L1755-N1759 PolarHBondContact O-N 2.9Å; L1755-N1759 PolarHBondContact O-ND2 3.33Å; L1756-N1759 PolarHBondContact O-N 2.99Å; S1757-N1759 VanDerWaalsContact C-N 3.32Å; S1757-N1759 PolarHBondContact O-N 3.49Å; N1759-Q1761 VanDerWaalsContact C-N 3.25Å; N1759-Q1761 PolarHBondContact O-N 3.13Å; N1759-E1762 WeakPolarHBondContact O-CB 3.49Å; N1759-E1762 PolarHBondContact O-N 2.92Å; N1759-K1763 PolarHBondContact O-N 2.99Å; N1759-L1777 PolarHBondContact ND2-O 3.32Å
1760	Y	47	Very low	55.3	Low	153.4 Å²	153.4	80.4 Å²	80.4	60%	0.602	42%	0.418	S	S	*	.	H	α-helix	trans	-75.3	-30.5	176.1	-110.2	-84.4	0	0	0	113	M1481 L1756 S1757 S1758 E1762 K1763 I1764	M1481-Y1760 HydrophobicContact CE-CD2 4.36Å; L1756-Y1760 PolarHBondContact O-N 2.97Å; L1756-Y1760 VanDerWaalsContact O-N 3.1Å; S1757-Y1760 WeakPolarHBondContact O-CB 3.49Å; S1757-Y1760 PolarHBondContact O-N 3.03Å; S1758-Y1760 VanDerWaalsContact C-N 3.29Å; S1758-Y1760 PolarHBondContact O-N 3.26Å; Y1760-E1762 VanDerWaalsContact C-N 3.25Å; Y1760-E1762 PolarHBondContact O-N 3.09Å; Y1760-K1763 PolarHBondContact O-N 3.18Å; Y1760-I1764 HydrophobicContact CD1-CD1 4.36Å
1761	Q	46.2	Very low	53.5	Low	113.6 Å²	113.6	85.2 Å²	85.2	53%	0.531	44%	0.444	S	S	.	.	H	α-helix	trans	-73.6	-31.6	176.3	-76.2	-175.4	-21.1	0	0	112.5	S1757 S1758 N1759 K1763 I1764 N1765	S1757-Q1761 PolarHBondContact O-N 3.24Å; S1757-Q1761 VanDerWaalsContact O-N 3.15Å; S1758-Q1761 PolarHBondContact O-N 3.03Å; N1759-Q1761 VanDerWaalsContact C-N 3.25Å; N1759-Q1761 PolarHBondContact O-N 3.13Å; Q1761-K1763 VanDerWaalsContact C-N 3.34Å; Q1761-K1763 PolarHBondContact O-N 3.26Å; Q1761-K1763 VanDerWaalsContact O-N 3.13Å; Q1761-I1764 WeakPolarHBondContact O-CB 3.43Å; Q1761-I1764 PolarHBondContact O-N 3.16Å; Q1761-I1764 VanDerWaalsContact O-N 3.11Å; Q1761-N1765 PolarHBondContact O-N 3.14Å
1762	E	45	Very low	51.9	Low	111.6 Å²	111.6	92.1 Å²	92.1	52%	0.521	47%	0.474	S	S	.	.	H	α-helix	trans	-68.5	-17.3	174.8	-74	-170	157.6	0	0	112.9	S1758 N1759 Y1760 I1764 N1765 C1769 K1776	S1758-E1762 PolarHBondContact O-N 3.17Å; S1758-E1762 VanDerWaalsContact O-N 3.09Å; N1759-E1762 WeakPolarHBondContact O-CB 3.49Å; N1759-E1762 PolarHBondContact O-N 2.92Å; Y1760-E1762 VanDerWaalsContact C-N 3.25Å; Y1760-E1762 PolarHBondContact O-N 3.09Å; E1762-I1764 VanDerWaalsContact C-N 3.34Å; E1762-I1764 PolarHBondContact O-N 2.97Å; E1762-N1765 CarbonylContact O-C 3.52Å; E1762-N1765 PolarHBondContact O-N 3.21Å; E1762-C1769 PolarHBondContact OE1-SG 2.98Å; E1762-K1776 IonicContact OE1-NZ 3.69Å; E1762-K1776 PolarHBondContact OE1-NZ 2.91Å; E1762-K1776 IonicContact OE2-NZ 2.67Å; E1762-K1776 PolarHBondContact OE2-NZ 2.88Å
1763	K	43.9	Very low	50.6	Low	171 Å²	171	93 Å²	93	74%	0.743	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-3.8	173.9	-84.4	-174.5	177.5	177.5	0	113.4	N1759 Y1760 Q1761	N1759-K1763 PolarHBondContact O-N 2.99Å; Y1760-K1763 PolarHBondContact O-N 3.18Å; Q1761-K1763 VanDerWaalsContact C-N 3.34Å; Q1761-K1763 PolarHBondContact O-N 3.26Å; Q1761-K1763 VanDerWaalsContact O-N 3.13Å
1764	I	45.9	Very low	49.3	Very low	132.4 Å²	132.4	100.5 Å²	100.5	68%	0.679	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.2	-34.4	178.6	-63.7	168.2	0	0	0	110.1	Y1760 Q1761 E1762	Y1760-I1764 HydrophobicContact CD1-CD1 4.36Å; Q1761-I1764 WeakPolarHBondContact O-CB 3.43Å; Q1761-I1764 PolarHBondContact O-N 3.16Å; Q1761-I1764 VanDerWaalsContact O-N 3.11Å; E1762-I1764 VanDerWaalsContact C-N 3.34Å; E1762-I1764 PolarHBondContact O-N 2.97Å
1765	N	40.5	Very low	48	Very low	116 Å²	116	103 Å²	103	62%	0.62	52%	0.519	S	S	*	.	S	Bend	trans	-124.8	88.2	-178	-66.4	-15	0	0	0	110.8	Q1761 E1762 D1767	Q1761-N1765 PolarHBondContact O-N 3.14Å; E1762-N1765 CarbonylContact O-C 3.52Å; E1762-N1765 PolarHBondContact O-N 3.21Å; N1765-D1767 PolarHBondContact O-N 3.16Å
1766	G	38.7	Very low	46.7	Very low	72 Å²	72	109.9 Å²	109.9	74%	0.742	55%	0.549	S	S	*	.			trans	-65.9	41.3	-175.3	0	0	0	0	0	117.1
1767	D	39.2	Very low	45.5	Very low	146.4 Å²	146.4	110.8 Å²	110.8	78%	0.783	55%	0.553	S	S	*	*			trans	-140.6	32.5	173.7	-87	-29.9	0	0	0	115.4	N1765 C1769	N1765-D1767 PolarHBondContact O-N 3.16Å; D1767-C1769 VanDerWaalsContact C-N 3.33Å; D1767-C1769 PolarHBondContact O-N 3.2Å
1768	L	37	Very low	44.3	Very low	154.8 Å²	154.8	115.5 Å²	115.5	81%	0.81	58%	0.576	S	S	*	*			trans	-89.2	21.9	-170.6	-80.9	126.4	0	0	0	115.9	K1770	L1768-K1770 VanDerWaalsContact C-N 3.3Å; L1768-K1770 PolarHBondContact O-N 3.16Å
1769	C	36.5	Very low	43.5	Very low	68 Å²	68	118.3 Å²	118.3	46%	0.459	59%	0.591	S	S	.	*			trans	-83.5	79.4	172.9	-69.2	0	0	0	0	111.8	E1762 D1767 N1771	E1762-C1769 PolarHBondContact OE1-SG 2.98Å; D1767-C1769 VanDerWaalsContact C-N 3.33Å; D1767-C1769 PolarHBondContact O-N 3.2Å; C1769-N1771 VanDerWaalsContact C-N 3.33Å; C1769-N1771 PolarHBondContact O-N 3.32Å
1770	K	39.9	Very low	43	Very low	154.8 Å²	154.8	122.2 Å²	122.2	67%	0.673	61%	0.612	S	S	*	*			trans	-78	56.8	169.9	-74.4	-177.2	179.5	174.1	0	111.1	L1768 F1772	L1768-K1770 VanDerWaalsContact C-N 3.3Å; L1768-K1770 PolarHBondContact O-N 3.16Å; K1770-F1772 HydrophobicContact CB-CD2 4.26Å; K1770-F1772 HydrophobicContact CB-CE2 4.05Å; K1770-F1772 HydrophobicContact CB-CZ 4.05Å; K1770-F1772 HydrophobicContact CD-CE2 4.35Å; K1770-F1772 HydrophobicContact CG-CE2 4.46Å; K1770-F1772 WeakPolarHBondContact O-CD2 3.28Å; K1770-F1772 WeakPolarHBondContact O-CE2 3.39Å; K1770-F1772 PolarHBondContact O-N 2.89Å
1771	N	43.8	Very low	42.6	Very low	105 Å²	105	119.8 Å²	119.8	56%	0.561	61%	0.609	S	S	*	*			trans	-91.1	83.1	175	-74.9	-11.9	0	0	0	110.1	Y1488 Y1732 C1769 F1773	Y1488-N1771 PolarHBondContact OH-ND2 3.27Å; Y1732-N1771 HydrophobicContact CE1-CB 4.31Å; C1769-N1771 VanDerWaalsContact C-N 3.33Å; C1769-N1771 PolarHBondContact O-N 3.32Å; N1771-F1773 HydrophobicContact CB-CD2 4.46Å; N1771-F1773 HydrophobicContact CB-CE1 4.3Å; N1771-F1773 HydrophobicContact CB-CE2 3.76Å; N1771-F1773 HydrophobicContact CB-CZ 3.67Å; N1771-F1773 WeakPolarHBondContact O-CD2 3.43Å; N1771-F1773 WeakPolarHBondContact O-CE2 3.29Å; N1771-F1773 PolarHBondContact O-N 3.23Å
1772	F	44.1	Very low	42.3	Very low	144.6 Å²	144.6	122.3 Å²	122.3	63%	0.634	63%	0.627	S	S	*	*			trans	-84.3	97	-178.3	-75.8	-87.7	0	0	0	111.9	A1735 E1736 L1755 S1758 K1770 R1774	A1735-F1772 HydrophobicContact CB-CD1 4.07Å; A1735-F1772 HydrophobicContact CB-CE1 3.7Å; A1735-F1772 HydrophobicContact CB-CZ 4.43Å; E1736-F1772 HydrophobicContact CG-CD1 3.78Å; L1755-F1772 HydrophobicContact CD1-CB 3.48Å; L1755-F1772 VanDerWaalsContact CD1-CB 3.48Å; L1755-F1772 HydrophobicContact CD1-CD2 3.62Å; L1755-F1772 HydrophobicContact CD1-CG 3.74Å; S1758-F1772 VanDerWaalsContact OG-CE2 3.23Å; S1758-F1772 WeakPolarHBondContact OG-CE2 3.39Å; K1770-F1772 HydrophobicContact CB-CD2 4.26Å; K1770-F1772 HydrophobicContact CB-CE2 4.05Å; K1770-F1772 HydrophobicContact CB-CZ 4.05Å; K1770-F1772 HydrophobicContact CD-CE2 4.35Å; K1770-F1772 HydrophobicContact CG-CE2 4.46Å; K1770-F1772 WeakPolarHBondContact O-CD2 3.28Å; K1770-F1772 WeakPolarHBondContact O-CE2 3.39Å; K1770-F1772 PolarHBondContact O-N 2.89Å; F1772-R1774 PolarHBondContact O-N 3.13Å
1773	F	47	Very low	42	Very low	85.6 Å²	85.6	121.5 Å²	121.5	38%	0.375	63%	0.633	S	S	.	*			trans	-89.2	128.1	166	-63.7	-78.1	0	0	0	110.1	Y1732 A1735 E1736 N1740 C1754 L1755 S1758 N1771 I1775	Y1732-F1773 WeakPolarHBondContact O-CD1 3.48Å; Y1732-F1773 WeakPolarHBondContact O-CE1 3.33Å; A1735-F1773 HydrophobicContact CB-CD1 3.79Å; A1735-F1773 HydrophobicContact CB-CE1 3.44Å; A1735-F1773 HydrophobicContact CB-CG 4.44Å; A1735-F1773 HydrophobicContact CB-CZ 4.16Å; E1736-F1773 HydrophobicContact CG-CD1 4.3Å; E1736-F1773 HydrophobicContact CG-CE1 4.42Å; E1736-F1773 WeakPolarHBondContact OE1-CD1 2.85Å; E1736-F1773 WeakPolarHBondContact OE1-CE1 3.12Å; E1736-F1773 PolarHBondContact OE1-N 2.85Å; N1740-F1773 PolarHBondContact ND2-O 2.83Å; C1754-F1773 HydrophobicContact CB-CE1 4.35Å; C1754-F1773 HydrophobicContact CB-CZ 4.01Å; L1755-F1773 HydrophobicContact CD1-CB 3.99Å; L1755-F1773 HydrophobicContact CD1-CD1 3.88Å; L1755-F1773 HydrophobicContact CD1-CD2 3.88Å; L1755-F1773 HydrophobicContact CD1-CE1 4.33Å; L1755-F1773 HydrophobicContact CD1-CE2 4.33Å; L1755-F1773 HydrophobicContact CD1-CG 3.63Å; L1755-F1773 HydrophobicContact CD2-CB 3.79Å; L1755-F1773 HydrophobicContact CD2-CD1 4.41Å; L1755-F1773 HydrophobicContact CD2-CD2 4.46Å; L1755-F1773 HydrophobicContact CD2-CE2 4.26Å; L1755-F1773 HydrophobicContact CD2-CG 4.02Å; L1755-F1773 HydrophobicContact CD2-CZ 3.96Å; L1755-F1773 HydrophobicContact CG-CD2 4.33Å; L1755-F1773 HydrophobicContact CG-CE2 4.47Å; S1758-F1773 VanDerWaalsContact CB-CD2 3.46Å; S1758-F1773 VanDerWaalsContact OG-CD2 3.3Å; S1758-F1773 WeakPolarHBondContact OG-CD2 3.42Å; N1771-F1773 HydrophobicContact CB-CD2 4.46Å; N1771-F1773 HydrophobicContact CB-CE1 4.3Å; N1771-F1773 HydrophobicContact CB-CE2 3.76Å; N1771-F1773 HydrophobicContact CB-CZ 3.67Å; N1771-F1773 WeakPolarHBondContact O-CD2 3.43Å; N1771-F1773 WeakPolarHBondContact O-CE2 3.29Å; N1771-F1773 PolarHBondContact O-N 3.23Å; F1773-I1775 VanDerWaalsContact C-N 3.26Å; F1773-I1775 PolarHBondContact O-N 3.19Å
1774	R	47.4	Very low	41.6	Very low	159.6 Å²	159.6	117.3 Å²	117.3	60%	0.602	63%	0.625	S	S	*	*	S	Bend	trans	-86.7	36.6	178.6	-100.9	179.9	174.5	-175.8	-3	112.3	E1736 I1739 Y1752 F1772 K1776 P1787 Y2067	E1736-R1774 WeakPolarHBondContact OE1-CA 3.42Å; E1736-R1774 WeakPolarHBondContact OE1-CB 3.13Å; E1736-R1774 VanDerWaalsContact OE1-CG 3.24Å; E1736-R1774 WeakPolarHBondContact OE1-CG 3.45Å; E1736-R1774 PolarHBondContact OE1-N 3.09Å; E1736-R1774 VanDerWaalsContact OE1-N 3.08Å; E1736-R1774 WeakPolarHBondContact OE2-CD 3.35Å; I1739-R1774 HydrophobicContact CG2-CG 4.23Å; Y1752-R1774 VanDerWaalsContact CE2-NH1 3.28Å; F1772-R1774 PolarHBondContact O-N 3.13Å; R1774-K1776 PolarHBondContact O-N 3.29Å; R1774-P1787 VanDerWaalsContact NH2-CD 3.34Å; R1774-Y2067 PolarHBondContact NH1-O 2.78Å
1775	I	47	Very low	41.4	Very low	70 Å²	70	117.5 Å²	117.5	36%	0.359	63%	0.626	S	S	.	*			trans	-99.7	114.5	176.8	-55.7	169.7	0	0	0	108.6	E1736 I1739 Y1752 L1755 F1773 L1777 L1786 I1790 L2129	E1736-I1775 HydrophobicContact CG-CD1 3.92Å; E1736-I1775 HydrophobicContact CG-CG1 4.16Å; I1739-I1775 HydrophobicContact CG2-CB 4.39Å; I1739-I1775 HydrophobicContact CG2-CG1 4.12Å; I1739-I1775 HydrophobicContact CG2-CG2 4.17Å; Y1752-I1775 HydrophobicContact CE1-CD1 3.84Å; Y1752-I1775 HydrophobicContact CE1-CG1 4.08Å; Y1752-I1775 HydrophobicContact CE1-CG2 4.21Å; Y1752-I1775 WeakPolarHBondContact OH-CG2 3.45Å; L1755-I1775 HydrophobicContact CD1-CB 4.44Å; L1755-I1775 HydrophobicContact CD1-CG2 4.24Å; L1755-I1775 HydrophobicContact CD2-CB 4.42Å; L1755-I1775 WeakPolarHBondContact CD2-O 3.48Å; F1773-I1775 VanDerWaalsContact C-N 3.26Å; F1773-I1775 PolarHBondContact O-N 3.19Å; I1775-L1777 HydrophobicContact CG2-CD1 4.4Å; I1775-L1777 HydrophobicContact CG2-CG 4.13Å; I1775-L1777 PolarHBondContact O-N 2.8Å; I1775-L1786 HydrophobicContact CD1-CD1 4.17Å; I1775-L1786 HydrophobicContact CD1-CD2 3.53Å; I1775-L1786 HydrophobicContact CD1-CG 4.5Å; I1775-L1786 HydrophobicContact CG1-CD2 4.08Å; I1775-I1790 HydrophobicContact CB-CD1 4.09Å; I1775-I1790 HydrophobicContact CD1-CD1 4.05Å; I1775-I1790 HydrophobicContact CG2-CD1 3.37Å; I1775-L2129 HydrophobicContact CD1-CD1 4.48Å
1776	K	44.3	Very low	41.4	Very low	160 Å²	160	115.6 Å²	115.6	70%	0.696	62%	0.615	S	S	*	*			trans	-83.5	113	167.9	-125.6	-177.3	178.2	-176.7	0	108.7	E1762 R1774 N1778	E1762-K1776 IonicContact OE1-NZ 3.69Å; E1762-K1776 PolarHBondContact OE1-NZ 2.91Å; E1762-K1776 IonicContact OE2-NZ 2.67Å; E1762-K1776 PolarHBondContact OE2-NZ 2.88Å; R1774-K1776 PolarHBondContact O-N 3.29Å; K1776-N1778 PolarHBondContact O-N 3.01Å
1777	L	42.6	Very low	41.4	Very low	79.2 Å²	79.2	115.6 Å²	115.6	42%	0.415	60%	0.602	S	S	.	*			trans	-74.2	123.1	169	-80.7	157.9	0	0	0	108.7	Y1752 L1755 L1756 N1759 I1775 T1779 K1788 I1790	Y1752-L1777 HydrophobicContact CD1-CD1 4.5Å; Y1752-L1777 HydrophobicContact CD2-CD1 4.13Å; Y1752-L1777 HydrophobicContact CE1-CD1 3.81Å; Y1752-L1777 HydrophobicContact CE2-CD1 3.98Å; Y1752-L1777 HydrophobicContact CE2-CD2 4.32Å; L1755-L1777 HydrophobicContact CB-CD1 3.72Å; L1755-L1777 HydrophobicContact CB-CG 4.31Å; L1755-L1777 HydrophobicContact CD1-CD1 4.37Å; L1755-L1777 HydrophobicContact CD1-CG 4.31Å; L1755-L1777 HydrophobicContact CD2-CD1 4.19Å; L1756-L1777 HydrophobicContact CD2-CD1 3.82Å; L1756-L1777 HydrophobicContact CG-CD1 4.18Å; N1759-L1777 PolarHBondContact ND2-O 3.32Å; I1775-L1777 HydrophobicContact CG2-CD1 4.4Å; I1775-L1777 HydrophobicContact CG2-CG 4.13Å; I1775-L1777 PolarHBondContact O-N 2.8Å; L1777-T1779 VanDerWaalsContact C-N 3.27Å; L1777-T1779 HydrophobicContact CB-CG2 4.27Å; L1777-T1779 PolarHBondContact O-N 3.21Å; L1777-K1788 WeakPolarHBondContact CD1-O 3.4Å; L1777-I1790 HydrophobicContact CD2-CG1 4.25Å; L1777-I1790 HydrophobicContact CG-CG1 4.49Å
1778	N	40.8	Very low	41.5	Very low	134.6 Å²	134.6	116.4 Å²	116.4	72%	0.72	60%	0.599	S	S	*	*			trans	-75.4	102.6	170.7	-152.8	12.4	0	0	0	108	K1776 N1780	K1776-N1778 PolarHBondContact O-N 3.01Å; N1778-N1780 VanDerWaalsContact C-N 3.29Å; N1778-N1780 PolarHBondContact O-N 3.17Å
1779	T	43.3	Very low	41.8	Very low	96.2 Å²	96.2	113 Å²	113	59%	0.59	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	46.3	-173.7	51	0	0	0	0	112.3	L1777 D1781	L1777-T1779 VanDerWaalsContact C-N 3.27Å; L1777-T1779 HydrophobicContact CB-CG2 4.27Å; L1777-T1779 PolarHBondContact O-N 3.21Å; T1779-D1781 PolarHBondContact O-N 3.03Å
1780	N	43.2	Very low	42.2	Very low	137.2 Å²	137.2	114.2 Å²	114.2	73%	0.734	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.4	1.2	-176.2	-71.8	-7.5	0	0	0	114.4	N1778 N1782	N1778-N1780 VanDerWaalsContact C-N 3.29Å; N1778-N1780 PolarHBondContact O-N 3.17Å; N1780-N1782 PolarHBondContact O-N 3.15Å
1781	D	38.6	Very low	42.5	Very low	102.6 Å²	102.6	111.6 Å²	111.6	55%	0.549	57%	0.571	S	S	.	*			trans	-102.1	95.9	178.8	-73.4	-32.2	0	0	0	110.5	T1779 S1783	T1779-D1781 PolarHBondContact O-N 3.03Å; D1781-S1783 PolarHBondContact O-N 3.02Å; D1781-S1783 VanDerWaalsContact O-N 3.09Å
1782	N	39.4	Very low	42.7	Very low	166.6 Å²	166.6	109.8 Å²	109.8	89%	0.891	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	20.6	169.9	-74.9	-17.8	0	0	0	112.9	N1780	N1780-N1782 PolarHBondContact O-N 3.15Å
1783	S	39.5	Very low	43	Very low	95.2 Å²	95.2	108.4 Å²	108.4	67%	0.666	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.8	27.9	-179.3	60.1	0	0	0	0	112.8	D1781 I1785	D1781-S1783 PolarHBondContact O-N 3.02Å; D1781-S1783 VanDerWaalsContact O-N 3.09Å; S1783-I1785 PolarHBondContact O-N 2.95Å
1784	C	34.9	Very low	43.2	Very low	82.2 Å²	82.2	106.7 Å²	106.7	56%	0.555	57%	0.565	S	S	*	*			trans	-93.6	105.8	172.7	-82.5	0	0	0	0	110.6	L1786	C1784-L1786 WeakPolarHBondContact CB-O 3.31Å; C1784-L1786 PolarHBondContact O-N 3.24Å; C1784-L1786 VanDerWaalsContact O-N 3.1Å
1785	I	41.4	Very low	43.6	Very low	137.2 Å²	137.2	103.8 Å²	103.8	70%	0.704	56%	0.561	S	S	*	*			trans	-72	103.9	175.1	-60.3	166.8	0	0	0	107.4	Y1752 S1783 P1787	Y1752-I1785 HydrophobicContact CE1-CG2 4.42Å; S1783-I1785 PolarHBondContact O-N 2.95Å; I1785-P1787 WeakPolarHBondContact O-CD 3.12Å
1786	L	40.7	Very low	44.1	Very low	75 Å²	75	102.8 Å²	102.8	39%	0.393	55%	0.554	S	S	.	*			trans	-85.9	130.8	169.9	-88.1	138.2	0	0	0	110.4	I1739 H1748 I1775 C1784 K1788	I1739-L1786 HydrophobicContact CG2-CD1 4.35Å; H1748-L1786 HydrophobicContact CB-CD2 3.93Å; H1748-L1786 WeakPolarHBondContact CD2-CD2 3.14Å; H1748-L1786 WeakPolarHBondContact NE2-CD2 3.14Å; I1775-L1786 HydrophobicContact CD1-CD1 4.17Å; I1775-L1786 HydrophobicContact CD1-CD2 3.53Å; I1775-L1786 HydrophobicContact CD1-CG 4.5Å; I1775-L1786 HydrophobicContact CG1-CD2 4.08Å; C1784-L1786 WeakPolarHBondContact CB-O 3.31Å; C1784-L1786 PolarHBondContact O-N 3.24Å; C1784-L1786 VanDerWaalsContact O-N 3.1Å; L1786-K1788 PolarHBondContact O-N 2.92Å; L1786-K1788 VanDerWaalsContact O-N 3.12Å
1787	P	39	Very low	44.8	Very low	72.8 Å²	72.8	100.9 Å²	100.9	47%	0.473	55%	0.546	S	S	.	.			trans	-66.5	126.2	172.7	28.5	-33.5	0	0	0	109.7	R1774 I1785 I1789 A2131	R1774-P1787 VanDerWaalsContact NH2-CD 3.34Å; I1785-P1787 WeakPolarHBondContact O-CD 3.12Å; P1787-I1789 VanDerWaalsContact C-N 3.34Å; P1787-I1789 PolarHBondContact O-N 3.1Å; P1787-A2131 HydrophobicContact CB-CB 3.92Å; P1787-A2131 HydrophobicContact CG-CB 3.73Å
1788	K	41.8	Very low	45.5	Very low	164 Å²	164	98.6 Å²	98.6	71%	0.713	54%	0.536	S	S	*	.			trans	-67.4	117.8	173.9	-118.5	176.4	176.9	177	0	109.6	D1742 L1777 L1786 I1790	D1742-K1788 WeakPolarHBondContact OD1-CE 3.42Å; D1742-K1788 IonicContact OD1-NZ 2.79Å; D1742-K1788 WeakPolarHBondContact OD2-CE 3.38Å; D1742-K1788 IonicContact OD2-NZ 3.57Å; D1742-K1788 PolarHBondContact OD2-NZ 3.19Å; L1777-K1788 WeakPolarHBondContact CD1-O 3.4Å; L1786-K1788 PolarHBondContact O-N 2.92Å; L1786-K1788 VanDerWaalsContact O-N 3.12Å; K1788-I1790 WeakPolarHBondContact O-CD1 3.45Å; K1788-I1790 WeakPolarHBondContact O-CG1 3.28Å; K1788-I1790 PolarHBondContact O-N 3.19Å; K1788-I1790 VanDerWaalsContact O-N 3.11Å
1789	I	43.1	Very low	46.3	Very low	82.4 Å²	82.4	95.8 Å²	95.8	42%	0.423	52%	0.524	S	S	.	.			trans	-74.5	121.5	171.4	-66.1	168.2	0	0	0	108.1	Q1741 D1742 P1787 Q1791 P2132	Q1741-I1789 VanDerWaalsContact O-CD1 3.31Å; Q1741-I1789 WeakPolarHBondContact O-CD1 3.32Å; D1742-I1789 HydrophobicContact CB-CD1 4.09Å; D1742-I1789 HydrophobicContact CB-CG2 4.14Å; D1742-I1789 VanDerWaalsContact OD1-CD1 3.31Å; D1742-I1789 WeakPolarHBondContact OD1-CD1 3.35Å; P1787-I1789 VanDerWaalsContact C-N 3.34Å; P1787-I1789 PolarHBondContact O-N 3.1Å; I1789-Q1791 VanDerWaalsContact C-N 3.27Å; I1789-Q1791 HydrophobicContact CG2-CG 3.92Å; I1789-Q1791 PolarHBondContact O-N 3.05Å; I1789-P2132 HydrophobicContact CB-CG 3.98Å; I1789-P2132 HydrophobicContact CG1-CG 3.81Å; I1789-P2132 HydrophobicContact CG2-CG 4Å
1790	I	44.3	Very low	46.6	Very low	93 Å²	93	94.6 Å²	94.6	48%	0.477	52%	0.516	S	S	.	.			trans	-82	112.5	176.7	-60.3	160.5	0	0	0	108.1	I1775 L1777 K1788 P2132 G2134 W2136	I1775-I1790 HydrophobicContact CB-CD1 4.09Å; I1775-I1790 HydrophobicContact CD1-CD1 4.05Å; I1775-I1790 HydrophobicContact CG2-CD1 3.37Å; L1777-I1790 HydrophobicContact CD2-CG1 4.25Å; L1777-I1790 HydrophobicContact CG-CG1 4.49Å; K1788-I1790 WeakPolarHBondContact O-CD1 3.45Å; K1788-I1790 WeakPolarHBondContact O-CG1 3.28Å; K1788-I1790 PolarHBondContact O-N 3.19Å; K1788-I1790 VanDerWaalsContact O-N 3.11Å; I1790-P2132 WeakPolarHBondContact O-CB 3.45Å; I1790-G2134 WeakPolarHBondContact CB-O 3.42Å; I1790-G2134 VanDerWaalsContact CD1-O 3.22Å; I1790-G2134 WeakPolarHBondContact CD1-O 3.28Å; I1790-G2134 WeakPolarHBondContact CG1-O 3.24Å; I1790-G2134 WeakPolarHBondContact CG2-O 3.19Å; I1790-W2136 VanDerWaalsContact CG2-CD1 3.5Å
1791	Q	46.3	Very low	46.8	Very low	100.8 Å²	100.8	90.5 Å²	90.5	47%	0.471	50%	0.497	S	S	.	.			trans	-87.6	139.6	169.1	-72.2	-174.7	-18.3	0	0	109.7	N1740 Q1741 D1742 I1789 I1793	N1740-Q1791 HydrophobicContact CB-CG 4.41Å; Q1741-Q1791 VanDerWaalsContact CG-OE1 3.27Å; D1742-Q1791 PolarHBondContact OD2-NE2 3.31Å; I1789-Q1791 VanDerWaalsContact C-N 3.27Å; I1789-Q1791 HydrophobicContact CG2-CG 3.92Å; I1789-Q1791 PolarHBondContact O-N 3.05Å; Q1791-I1793 PolarHBondContact O-N 2.88Å; Q1791-I1793 VanDerWaalsContact O-N 3.12Å
1792	P	47.1	Very low	47.1	Very low	68 Å²	68	92.4 Å²	92.4	44%	0.442	51%	0.506	S	S	.	.			trans	-70.9	127.7	170.4	28.6	-31.5	0	0	0	109.7	A1794 I1795	P1792-A1794 PolarHBondContact O-N 3.12Å; P1792-I1795 HydrophobicContact CB-CG1 4.27Å; P1792-I1795 HydrophobicContact CG-CD1 3.91Å; P1792-I1795 HydrophobicContact CG-CG1 3.91Å
1793	I	51.8	Low	47.3	Very low	113.6 Å²	113.6	89.7 Å²	89.7	58%	0.583	50%	0.496	S	S	*	.	S	Bend	trans	-71.7	-1.1	179.7	-64	166.5	0	0	0	110.1	R1718 V1743 Q1791 I1795 Y2109	R1718-I1793 HydrophobicContact CB-CG2 4.26Å; R1718-I1793 HydrophobicContact CG-CG2 3.75Å; V1743-I1793 HydrophobicContact CG2-CD1 4.37Å; Q1791-I1793 PolarHBondContact O-N 2.88Å; Q1791-I1793 VanDerWaalsContact O-N 3.12Å; I1793-I1795 HydrophobicContact CG2-CD1 3.96Å; I1793-I1795 HydrophobicContact CG2-CG1 3.78Å; I1793-Y2109 HydrophobicContact CD1-CD1 4.13Å; I1793-Y2109 HydrophobicContact CD1-CE1 3.5Å; I1793-Y2109 VanDerWaalsContact CD1-CE1 3.5Å
1794	A	51.6	Low	47.6	Very low	49.8 Å²	49.8	88.1 Å²	88.1	41%	0.412	50%	0.495	S	S	.	.			trans	-163.5	139.4	172.3	0	0	0	0	0	112.1	A1721 P1792 S1837 L1838	A1721-A1794 HydrophobicContact CB-CB 3.81Å; P1792-A1794 PolarHBondContact O-N 3.12Å; A1794-S1837 WeakPolarHBondContact CB-O 3.46Å; A1794-L1838 HydrophobicContact CB-CD1 3.7Å
1795	I	55.5	Low	48.4	Very low	99.8 Å²	99.8	87.3 Å²	87.3	51%	0.512	49%	0.49	S	S	.	.			trans	-118.1	115	-178.7	-56.1	173.8	0	0	0	108.1	A1721 S1722 P1792 I1793 K1797	A1721-I1795 PolarHBondContact O-N 3.13Å; S1722-I1795 WeakPolarHBondContact O-CD1 3.4Å; P1792-I1795 HydrophobicContact CB-CG1 4.27Å; P1792-I1795 HydrophobicContact CG-CD1 3.91Å; P1792-I1795 HydrophobicContact CG-CG1 3.91Å; I1793-I1795 HydrophobicContact CG2-CD1 3.96Å; I1793-I1795 HydrophobicContact CG2-CG1 3.78Å; I1795-K1797 HydrophobicContact CG2-CG 4.18Å; I1795-K1797 PolarHBondContact O-N 3.45Å
1796	H	57.3	Low	49.2	Very low	49.6 Å²	49.6	85.5 Å²	85.5	23%	0.23	48%	0.479	C	S	.	.	P	Polyproline II helix	trans	-95.4	121.8	170	179.9	-76.2	0	0	0	109.6	Y1823 L1838 I2122	H1796-Y1823 AromaticContact CE1-CE1 3.91Å; H1796-Y1823 AromaticContact NE2-CE1 3.68Å; H1796-Y1823 AromaticContact NE2-CZ 3.69Å; H1796-Y1823 PolarHBondContact NE2-OH 3.43Å; H1796-Y1823 VanDerWaalsContact NE2-OH 3.11Å; H1796-L1838 HydrophobicContact CB-CB 4.35Å; H1796-L1838 HydrophobicContact CB-CD1 3.99Å; H1796-L1838 HydrophobicContact CB-CD2 3.97Å; H1796-L1838 HydrophobicContact CB-CG 4.41Å; H1796-I2122 HydrophobicContact CB-CD1 4.47Å
1797	K	58.4	Low	50.5	Low	118.2 Å²	118.2	82.8 Å²	82.8	51%	0.514	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-94.7	122.5	171.1	-71	-176.9	-178.5	163.9	0	109.2	E1725 I1795	E1725-K1797 VanDerWaalsContact OE1-CB 3.32Å; E1725-K1797 WeakPolarHBondContact OE1-CB 3.33Å; E1725-K1797 WeakPolarHBondContact OE1-CD 3.43Å; E1725-K1797 WeakPolarHBondContact OE1-CG 3.47Å; E1725-K1797 IonicContact OE1-NZ 2.69Å; E1725-K1797 WeakPolarHBondContact OE2-CD 3.48Å; E1725-K1797 WeakPolarHBondContact OE2-CE 3.39Å; E1725-K1797 IonicContact OE2-NZ 3.58Å; E1725-K1797 PolarHBondContact OE2-NZ 3.2Å; I1795-K1797 HydrophobicContact CG2-CG 4.18Å; I1795-K1797 PolarHBondContact O-N 3.45Å
1798	P	57	Low	52.1	Low	30.8 Å²	30.8	81.3 Å²	81.3	20%	0.2	45%	0.453	C	S	.	.	P	Polyproline II helix	trans	-63	145	176.3	15.6	-18.8	0	0	0	111.2	T1800 Q1806 P1809 Y1823	P1798-T1800 PolarHBondContact O-N 2.91Å; P1798-T1800 VanDerWaalsContact O-N 3.13Å; P1798-Q1806 HydrophobicContact CB-CB 4.28Å; P1798-Q1806 HydrophobicContact CB-CG 4.34Å; P1798-Q1806 HydrophobicContact CG-CB 4.27Å; P1798-Q1806 HydrophobicContact CG-CG 3.8Å; P1798-P1809 HydrophobicContact CG-CB 4.18Å; P1798-P1809 HydrophobicContact CG-CG 3.68Å; P1798-Y1823 HydrophobicContact CB-CD2 4.36Å; P1798-Y1823 HydrophobicContact CB-CE2 3.75Å; P1798-Y1823 VanDerWaalsContact CB-CE2 3.42Å; P1798-Y1823 WeakPolarHBondContact CB-OH 3.49Å; P1798-Y1823 HydrophobicContact CG-CE2 4.41Å
1799	V	57.4	Low	53.8	Low	77 Å²	77	74.4 Å²	74.4	47%	0.467	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-79	126.4	177.4	-178	0	0	0	0	108.6	D1253 P1801 D1807	D1253-V1799 WeakPolarHBondContact OD2-CG1 3.47Å; V1799-P1801 WeakPolarHBondContact O-CD 3.29Å; V1799-D1807 HydrophobicContact CB-CB 4.28Å; V1799-D1807 WeakPolarHBondContact O-CB 3.34Å; V1799-D1807 PolarHBondContact O-N 3.05Å
1800	T	50.9	Low	55.4	Low	71 Å²	71	71.6 Å²	71.6	44%	0.436	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-74.6	120	174.1	38.3	0	0	0	0	110.2	P1798 L1802 T1803 G1804 S1805 Q1806 D1807	P1798-T1800 PolarHBondContact O-N 2.91Å; P1798-T1800 VanDerWaalsContact O-N 3.13Å; T1800-L1802 PolarHBondContact O-N 3.36Å; T1800-T1803 PolarHBondContact OG1-OG1 3.12Å; T1800-T1803 VanDerWaalsContact OG1-OG1 3.07Å; T1800-G1804 WeakPolarHBondContact O-CA 2.96Å; T1800-G1804 PolarHBondContact O-N 3.25Å; T1800-S1805 PolarHBondContact N-O 2.85Å; T1800-S1805 PolarHBondContact OG1-O 3.05Å; T1800-S1805 PolarHBondContact OG1-OG 2.87Å; T1800-Q1806 HydrophobicContact CG2-CB 4.2Å; T1800-Q1806 HydrophobicContact CG2-CG 3.69Å; T1800-D1807 HydrophobicContact CG2-CB 3.44Å; T1800-D1807 VanDerWaalsContact CG2-CB 3.44Å; T1800-D1807 VanDerWaalsContact CG2-OD2 3.24Å; T1800-D1807 WeakPolarHBondContact CG2-OD2 3.2Å
1801	P	47	Very low	57.2	Low	50.8 Å²	50.8	67.5 Å²	67.5	33%	0.33	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-66.5	166.1	170.4	16.7	-15.8	0	0	0	111.6	V1799 T1803 G1804 S1805 D1807	V1799-P1801 WeakPolarHBondContact O-CD 3.29Å; P1801-T1803 VanDerWaalsContact C-N 3.27Å; P1801-T1803 PolarHBondContact O-N 3.05Å; P1801-G1804 PolarHBondContact O-N 2.91Å; P1801-G1804 VanDerWaalsContact O-N 3.15Å; P1801-S1805 VanDerWaalsContact CD-O 3.27Å; P1801-S1805 WeakPolarHBondContact CD-O 3.32Å; P1801-S1805 WeakPolarHBondContact CG-O 3.42Å; P1801-D1807 VanDerWaalsContact CD-CB 3.48Å; P1801-D1807 HydrophobicContact CG-CB 3.52Å; P1801-D1807 WeakPolarHBondContact CG-OD2 3.26Å
1802	L	43.8	Very low	59.1	Low	141.8 Å²	141.8	64.1 Å²	64.1	74%	0.742	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-20.3	-173.1	-114	89	0	0	0	115.6	F1256 T1800 G1804	F1256-L1802 VanDerWaalsContact CA-CD1 3.48Å; F1256-L1802 HydrophobicContact CB-CD1 3.56Å; F1256-L1802 HydrophobicContact CD2-CB 4.44Å; F1256-L1802 HydrophobicContact CD2-CD1 2.98Å; F1256-L1802 HydrophobicContact CD2-CD2 3.94Å; F1256-L1802 HydrophobicContact CD2-CG 3.2Å; F1256-L1802 HydrophobicContact CE2-CD1 3.7Å; F1256-L1802 HydrophobicContact CE2-CD2 3.76Å; F1256-L1802 HydrophobicContact CE2-CG 3.33Å; F1256-L1802 HydrophobicContact CG-CD1 3.44Å; F1256-L1802 VanDerWaalsContact CG-CD1 3.44Å; F1256-L1802 HydrophobicContact CG-CG 4.07Å; F1256-L1802 HydrophobicContact CZ-CD2 4.35Å; F1256-L1802 HydrophobicContact CZ-CG 4.35Å; T1800-L1802 PolarHBondContact O-N 3.36Å; L1802-G1804 VanDerWaalsContact C-N 3.27Å; L1802-G1804 PolarHBondContact O-N 3.07Å
1803	T	45.1	Very low	61	Low	110 Å²	110	63.1 Å²	63.1	68%	0.675	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-7.6	-177.7	48.3	0	0	0	0	113.5	T1800 P1801 S1805	T1800-T1803 PolarHBondContact OG1-OG1 3.12Å; T1800-T1803 VanDerWaalsContact OG1-OG1 3.07Å; P1801-T1803 VanDerWaalsContact C-N 3.27Å; P1801-T1803 PolarHBondContact O-N 3.05Å; T1803-S1805 VanDerWaalsContact C-N 3.29Å; T1803-S1805 WeakPolarHBondContact CB-OG 3.35Å; T1803-S1805 PolarHBondContact O-N 3.14Å; T1803-S1805 VanDerWaalsContact O-N 3.12Å; T1803-S1805 PolarHBondContact OG1-N 3.44Å; T1803-S1805 PolarHBondContact OG1-OG 3.03Å
1804	G	45.1	Very low	62.5	Low	62.6 Å²	62.6	59 Å²	59	65%	0.645	34%	0.343	S	S	*	.	S	Bend	trans	74.5	-6.1	-176.8	0	0	0	0	0	114.3	T1800 P1801 L1802	T1800-G1804 WeakPolarHBondContact O-CA 2.96Å; T1800-G1804 PolarHBondContact O-N 3.25Å; P1801-G1804 PolarHBondContact O-N 2.91Å; P1801-G1804 VanDerWaalsContact O-N 3.15Å; L1802-G1804 VanDerWaalsContact C-N 3.27Å; L1802-G1804 PolarHBondContact O-N 3.07Å
1805	S	51.9	Low	63.9	Low	65.6 Å²	65.6	56.9 Å²	56.9	46%	0.459	33%	0.325	S	S	.	.	S	Bend	trans	-81.8	138.7	169.1	58.9	0	0	0	0	110.1	T1800 P1801 T1803 D1807	T1800-S1805 PolarHBondContact N-O 2.85Å; T1800-S1805 PolarHBondContact OG1-O 3.05Å; T1800-S1805 PolarHBondContact OG1-OG 2.87Å; P1801-S1805 VanDerWaalsContact CD-O 3.27Å; P1801-S1805 WeakPolarHBondContact CD-O 3.32Å; P1801-S1805 WeakPolarHBondContact CG-O 3.42Å; T1803-S1805 VanDerWaalsContact C-N 3.29Å; T1803-S1805 WeakPolarHBondContact CB-OG 3.35Å; T1803-S1805 PolarHBondContact O-N 3.14Å; T1803-S1805 VanDerWaalsContact O-N 3.12Å; T1803-S1805 PolarHBondContact OG1-N 3.44Å; T1803-S1805 PolarHBondContact OG1-OG 3.03Å; S1805-D1807 PolarHBondContact O-N 2.81Å; S1805-D1807 VanDerWaalsContact O-N 3.15Å
1806	Q	58.3	Low	64.8	Low	98.6 Å²	98.6	56.4 Å²	56.4	46%	0.461	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-64.4	130.4	169	-70.6	-178.2	-2	0	0	109.2	P1798 T1800 I1808 I2694	P1798-Q1806 HydrophobicContact CB-CB 4.28Å; P1798-Q1806 HydrophobicContact CB-CG 4.34Å; P1798-Q1806 HydrophobicContact CG-CB 4.27Å; P1798-Q1806 HydrophobicContact CG-CG 3.8Å; T1800-Q1806 HydrophobicContact CG2-CB 4.2Å; T1800-Q1806 HydrophobicContact CG2-CG 3.69Å; Q1806-I1808 PolarHBondContact O-N 2.82Å; Q1806-I2694 HydrophobicContact CB-CB 3.93Å; Q1806-I2694 HydrophobicContact CB-CG2 3.73Å; Q1806-I2694 WeakPolarHBondContact O-CD1 3.18Å; Q1806-I2694 PolarHBondContact OE1-O 3.44Å
1807	D	67.3	Low	65.4	Low	18.4 Å²	18.4	56.7 Å²	56.7	10%	0.098	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-90.3	127.9	175.6	-157.2	0.4	0	0	0	108.4	V1799 T1800 P1801 S1805 P1809 T1825 E1826 S1827 T1829	V1799-D1807 HydrophobicContact CB-CB 4.28Å; V1799-D1807 WeakPolarHBondContact O-CB 3.34Å; V1799-D1807 PolarHBondContact O-N 3.05Å; T1800-D1807 HydrophobicContact CG2-CB 3.44Å; T1800-D1807 VanDerWaalsContact CG2-CB 3.44Å; T1800-D1807 VanDerWaalsContact CG2-OD2 3.24Å; T1800-D1807 WeakPolarHBondContact CG2-OD2 3.2Å; P1801-D1807 VanDerWaalsContact CD-CB 3.48Å; P1801-D1807 HydrophobicContact CG-CB 3.52Å; P1801-D1807 WeakPolarHBondContact CG-OD2 3.26Å; S1805-D1807 PolarHBondContact O-N 2.81Å; S1805-D1807 VanDerWaalsContact O-N 3.15Å; D1807-P1809 WeakPolarHBondContact O-CD 3.35Å; D1807-T1825 HydrophobicContact CB-CG2 4.1Å; D1807-T1825 VanDerWaalsContact CG-OG1 3.27Å; D1807-T1825 VanDerWaalsContact OD1-CB 3.26Å; D1807-T1825 WeakPolarHBondContact OD1-CB 3.31Å; D1807-T1825 PolarHBondContact OD1-OG1 3.13Å; D1807-T1825 WeakPolarHBondContact OD2-CB 3.34Å; D1807-T1825 WeakPolarHBondContact OD2-CG2 3.3Å; D1807-T1825 PolarHBondContact OD2-OG1 3.15Å; D1807-E1826 PolarHBondContact OD1-N 2.94Å; D1807-S1827 VanDerWaalsContact CG-OG 3.27Å; D1807-S1827 WeakPolarHBondContact OD1-CB 3.25Å; D1807-S1827 PolarHBondContact OD1-N 3Å; D1807-S1827 VanDerWaalsContact OD1-N 3.11Å; D1807-S1827 PolarHBondContact OD1-OG 2.99Å; D1807-S1827 VanDerWaalsContact OD2-CB 3.26Å; D1807-S1827 WeakPolarHBondContact OD2-CB 3.41Å; D1807-S1827 PolarHBondContact OD2-N 2.93Å; D1807-S1827 PolarHBondContact OD2-OG 3.11Å; D1807-T1829 PolarHBondContact OD2-OG1 3.21Å
1808	I	72.5	Confident	66.1	Low	42.2 Å²	42.2	52 Å²	52	22%	0.216	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-82.3	121.1	-172.9	-59.3	176.3	0	0	0	108.4	Q1806 I1810 T1825 E1826 N2688 I2694	Q1806-I1808 PolarHBondContact O-N 2.82Å; I1808-I1810 HydrophobicContact CG2-CG1 4.46Å; I1808-I1810 PolarHBondContact O-N 3.06Å; I1808-I1810 VanDerWaalsContact O-N 3.1Å; I1808-T1825 CarbonylContact O-C 3.55Å; I1808-T1825 VanDerWaalsContact O-CA 3.28Å; I1808-T1825 WeakPolarHBondContact O-CA 3.37Å; I1808-E1826 HydrophobicContact CB-CB 4.31Å; I1808-E1826 WeakPolarHBondContact CD1-OE2 3.17Å; I1808-E1826 PolarHBondContact O-N 3.16Å; I1808-N2688 HydrophobicContact CD1-CB 4.01Å; I1808-I2694 HydrophobicContact CD1-CD1 4.46Å; I1808-I2694 HydrophobicContact CD1-CG1 4.28Å; I1808-I2694 HydrophobicContact CD1-CG2 3.63Å; I1808-I2694 HydrophobicContact CG1-CB 4.49Å; I1808-I2694 HydrophobicContact CG1-CG2 3.25Å
1809	P	77.1	Confident	67.1	Low	17.8 Å²	17.8	52.6 Å²	52.6	12%	0.116	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	120.4	169.5	30.8	-35.2	0	0	0	109.3	P1798 D1807 Y1823 G1824 C2664 V2684 C2696	P1798-P1809 HydrophobicContact CG-CB 4.18Å; P1798-P1809 HydrophobicContact CG-CG 3.68Å; D1807-P1809 WeakPolarHBondContact O-CD 3.35Å; P1809-Y1823 HydrophobicContact CB-CD2 4.07Å; P1809-Y1823 HydrophobicContact CB-CG 4.43Å; P1809-G1824 CarbonylContact C-O 3.58Å; P1809-C2664 PolarHBondContact O-SG 3.49Å; P1809-C2664 VanDerWaalsContact O-SG 3.32Å; P1809-V2684 HydrophobicContact CB-CG1 3.65Å; P1809-V2684 HydrophobicContact CG-CG1 3.44Å; P1809-V2684 VanDerWaalsContact CG-CG1 3.44Å; P1809-V2684 WeakPolarHBondContact O-CG1 2.91Å; P1809-C2696 VanDerWaalsContact CD-CB 3.45Å; P1809-C2696 HydrophobicContact CG-CB 4.02Å
1810	I	78.3	Confident	68.3	Low	24 Å²	24	49.1 Å²	49.1	12%	0.123	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	-35.9	-176.7	-65.3	174.8	0	0	0	111.3	I1808 G1824 E1826 P1850 I1851 P2094 S2095 Q2096	I1808-I1810 HydrophobicContact CG2-CG1 4.46Å; I1808-I1810 PolarHBondContact O-N 3.06Å; I1808-I1810 VanDerWaalsContact O-N 3.1Å; I1810-G1824 PolarHBondContact N-O 2.97Å; I1810-E1826 VanDerWaalsContact CD1-CA 3.41Å; I1810-E1826 HydrophobicContact CD1-CB 3.66Å; I1810-E1826 HydrophobicContact CD1-CG 3.91Å; I1810-E1826 HydrophobicContact CG1-CB 4.44Å; I1810-P1850 HydrophobicContact CD1-CB 3.93Å; I1810-P1850 HydrophobicContact CD1-CG 4.45Å; I1810-I1851 WeakPolarHBondContact CB-O 3.07Å; I1810-I1851 VanDerWaalsContact CG2-O 3.26Å; I1810-I1851 WeakPolarHBondContact CG2-O 3.38Å; I1810-P2094 HydrophobicContact CD1-CB 4.15Å; I1810-S2095 WeakPolarHBondContact CG2-OG 3.43Å; I1810-Q2096 HydrophobicContact CG2-CG 4Å; I1810-Q2096 VanDerWaalsContact CG2-NE2 3.31Å
1811	A	81.7	Confident	69.9	Low	6.2 Å²	6.2	46.2 Å²	46.2	5%	0.051	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	143.9	178.9	0	0	0	0	0	109.9	Y1823 G1824 I1851 L1854	A1811-Y1823 CarbonylContact O-C 3.56Å; A1811-Y1823 VanDerWaalsContact O-CA 3.23Å; A1811-Y1823 WeakPolarHBondContact O-CA 3.18Å; A1811-Y1823 WeakPolarHBondContact O-CB 3.41Å; A1811-G1824 PolarHBondContact N-O 3.1Å; A1811-G1824 VanDerWaalsContact N-O 3.1Å; A1811-G1824 PolarHBondContact O-N 3.12Å; A1811-I1851 HydrophobicContact CB-CG2 4.03Å; A1811-L1854 HydrophobicContact CB-CD1 4.28Å; A1811-L1854 HydrophobicContact CB-CG 4.08Å
1812	I	86.6	Confident	71.9	Confident	29.6 Å²	29.6	43.8 Å²	43.8	15%	0.152	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	143.1	176.3	-163.8	163.5	0	0	0	109.7	L1821 A1822 V2099 T2113 I2122 I2682 V2684 I2698	I1812-L1821 HydrophobicContact CD1-CD1 3.66Å; I1812-L1821 VanDerWaalsContact CD1-CD1 3.48Å; I1812-L1821 HydrophobicContact CD1-CD2 4.22Å; I1812-L1821 HydrophobicContact CD1-CG 4.25Å; I1812-L1821 HydrophobicContact CG1-CD1 3.57Å; I1812-L1821 VanDerWaalsContact CG1-CD1 3.46Å; I1812-L1821 HydrophobicContact CG1-CG 4.28Å; I1812-A1822 CarbonylContact C-O 3.55Å; I1812-A1822 WeakPolarHBondContact CA-O 3.29Å; I1812-V2099 HydrophobicContact CG2-CB 4.31Å; I1812-V2099 HydrophobicContact CG2-CG1 4.22Å; I1812-T2113 HydrophobicContact CD1-CG2 4Å; I1812-T2113 HydrophobicContact CG2-CG2 3.85Å; I1812-I2122 HydrophobicContact CD1-CD1 3.59Å; I1812-I2682 HydrophobicContact CD1-CG2 3.52Å; I1812-I2682 HydrophobicContact CG1-CG2 4.45Å; I1812-V2684 HydrophobicContact CB-CG2 3.53Å; I1812-V2684 HydrophobicContact CD1-CG2 3.08Å; I1812-V2684 HydrophobicContact CG1-CG2 3.9Å; I1812-V2684 HydrophobicContact CG2-CG2 3.77Å; I1812-I2698 HydrophobicContact CD1-CD1 4.23Å; I1812-I2698 HydrophobicContact CD1-CG2 3.71Å
1813	E	85.8	Confident	74	Confident	47.8 Å²	47.8	37.7 Å²	37.7	22%	0.223	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	141.9	174.5	-170.8	87.6	164.1	0	0	109.7	A1822 L1854 C1855 F1856 S2667	E1813-A1822 PolarHBondContact N-O 2.98Å; E1813-A1822 PolarHBondContact O-N 3.14Å; E1813-L1854 HydrophobicContact CB-CB 3.91Å; E1813-L1854 VanDerWaalsContact OE2-O 3.11Å; E1813-C1855 VanDerWaalsContact CD-CA 3.43Å; E1813-C1855 VanDerWaalsContact OE1-CA 3.32Å; E1813-C1855 WeakPolarHBondContact OE1-CA 3.17Å; E1813-C1855 WeakPolarHBondContact OE2-CA 3.34Å; E1813-C1855 PolarHBondContact OE2-N 3.26Å; E1813-F1856 HydrophobicContact CB-CD2 4.27Å; E1813-F1856 HydrophobicContact CB-CE2 4.29Å; E1813-F1856 HydrophobicContact CG-CD2 3.69Å; E1813-F1856 HydrophobicContact CG-CE2 4.18Å; E1813-F1856 WeakPolarHBondContact O-CE2 3.37Å; E1813-F1856 PolarHBondContact OE1-N 2.87Å; E1813-F1856 PolarHBondContact OE2-N 3.08Å; E1813-S2667 WeakPolarHBondContact OE2-CB 3.23Å; E1813-S2667 PolarHBondContact OE2-OG 3.21Å
1814	L	84.5	Confident	75.9	Confident	26.4 Å²	26.4	32.5 Å²	32.5	14%	0.138	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	142.5	172.5	-86.5	160.3	0	0	0	110.4	L1820 L1821 V1835 F1856 I2111 S2667 T2669 I2682	L1814-L1820 WeakPolarHBondContact CD2-O 3.42Å; L1814-L1821 HydrophobicContact CD1-CD1 4.02Å; L1814-L1821 HydrophobicContact CD2-CB 4.27Å; L1814-L1821 HydrophobicContact CD2-CD1 3.86Å; L1814-L1821 HydrophobicContact CG-CD1 3.82Å; L1814-V1835 HydrophobicContact CD2-CG2 3.68Å; L1814-F1856 VanDerWaalsContact C-CE2 3.45Å; L1814-F1856 WeakPolarHBondContact O-CD2 3.19Å; L1814-I2111 HydrophobicContact CD1-CD1 3.49Å; L1814-I2111 VanDerWaalsContact CD1-CD1 3.49Å; L1814-S2667 PolarHBondContact N-OG 2.94Å; L1814-T2669 HydrophobicContact CB-CG2 4.35Å; L1814-T2669 HydrophobicContact CD1-CG2 3.87Å; L1814-I2682 HydrophobicContact CD1-CB 4.1Å; L1814-I2682 HydrophobicContact CD1-CD1 3.65Å; L1814-I2682 HydrophobicContact CD1-CG1 3.78Å; L1814-I2682 HydrophobicContact CD2-CD1 3.56Å; L1814-I2682 HydrophobicContact CG-CD1 3.76Å; L1814-I2682 HydrophobicContact CG-CG1 4.36Å
1815	D	81.1	Confident	77.8	Confident	6.2 Å²	6.2	29.6 Å²	29.6	3%	0.033	16%	0.158	C	C	.	.			trans	-67.5	166.8	171.3	83.6	-31.5	0	0	0	111.6	T1817 G1818 I1819 L1820 F1856 T2669	D1815-T1817 VanDerWaalsContact C-N 3.25Å; D1815-T1817 PolarHBondContact O-N 3.14Å; D1815-T1817 WeakPolarHBondContact OD1-CA 2.86Å; D1815-T1817 WeakPolarHBondContact OD1-CB 3.16Å; D1815-T1817 PolarHBondContact OD1-N 3.26Å; D1815-T1817 PolarHBondContact OD1-OG1 3.01Å; D1815-T1817 WeakPolarHBondContact OD2-CB 3.33Å; D1815-T1817 PolarHBondContact OD2-N 2.91Å; D1815-T1817 VanDerWaalsContact OD2-N 3.1Å; D1815-T1817 PolarHBondContact OD2-OG1 2.99Å; D1815-T1817 VanDerWaalsContact OD2-OG1 3.1Å; D1815-G1818 PolarHBondContact O-N 3.09Å; D1815-G1818 VanDerWaalsContact O-N 3.12Å; D1815-G1818 VanDerWaalsContact OD1-CA 3.27Å; D1815-G1818 WeakPolarHBondContact OD1-CA 3.37Å; D1815-G1818 PolarHBondContact OD1-N 3.23Å; D1815-I1819 PolarHBondContact OD1-N 3.06Å; D1815-I1819 VanDerWaalsContact OD1-N 3.17Å; D1815-L1820 HydrophobicContact CB-CB 4.13Å; D1815-L1820 VanDerWaalsContact CG-N 3.28Å; D1815-L1820 PolarHBondContact N-O 3.14Å; D1815-L1820 PolarHBondContact OD1-N 3.12Å; D1815-L1820 VanDerWaalsContact OD1-O 3.12Å; D1815-L1820 WeakPolarHBondContact OD2-CA 3.3Å; D1815-L1820 WeakPolarHBondContact OD2-CB 3.26Å; D1815-L1820 WeakPolarHBondContact OD2-CG 3.2Å; D1815-L1820 PolarHBondContact OD2-N 2.83Å; D1815-L1820 VanDerWaalsContact OD2-N 3.11Å; D1815-F1856 HydrophobicContact CB-CD1 4.43Å; D1815-F1856 HydrophobicContact CB-CD2 4.19Å; D1815-F1856 HydrophobicContact CB-CE1 4.38Å; D1815-F1856 HydrophobicContact CB-CE2 4.13Å; D1815-F1856 HydrophobicContact CB-CG 4.41Å; D1815-F1856 HydrophobicContact CB-CZ 4.28Å; D1815-T2669 PolarHBondContact O-OG1 3.09Å
1816	R	73.2	Confident	79.1	Confident	90 Å²	90	30.1 Å²	30.1	34%	0.34	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-25.5	179.9	-78.4	-167	-166	148.2	16.1	114.2	G1818 D1858 V1860 P1928 K2104 T2669	R1816-G1818 VanDerWaalsContact C-N 3.33Å; R1816-D1858 WeakPolarHBondContact CB-OD2 3.38Å; R1816-D1858 WeakPolarHBondContact CD-OD2 3.38Å; R1816-D1858 WeakPolarHBondContact CG-OD2 3.37Å; R1816-D1858 IonicContact CZ-OD1 3.38Å; R1816-D1858 IonicContact CZ-OD2 3.34Å; R1816-D1858 IonicContact NE-OD1 3.27Å; R1816-D1858 PolarHBondContact NE-OD1 3.19Å; R1816-D1858 IonicContact NE-OD2 2.97Å; R1816-D1858 PolarHBondContact NE-OD2 3.08Å; R1816-D1858 IonicContact NH1-OD1 2.7Å; R1816-D1858 PolarHBondContact NH1-OD1 2.82Å; R1816-D1858 VanDerWaalsContact NH1-OD1 3.11Å; R1816-D1858 IonicContact NH1-OD2 3.27Å; R1816-D1858 PolarHBondContact NH1-OD2 3.06Å; R1816-D1858 IonicContact NH2-OD1 3.04Å; R1816-D1858 PolarHBondContact NH2-OD1 2.93Å; R1816-D1858 IonicContact NH2-OD2 3.74Å; R1816-D1858 PolarHBondContact NH2-OD2 2.84Å; R1816-V1860 VanDerWaalsContact NH1-CG2 3.28Å; R1816-P1928 VanDerWaalsContact NH2-CG 3.3Å; R1816-K2104 HydrophobicContact CG-CD 4.17Å; R1816-T2669 PolarHBondContact O-OG1 3.39Å; R1816-T2669 VanDerWaalsContact O-OG1 3.04Å
1817	T	70.6	Confident	80	Confident	55.8 Å²	55.8	28.2 Å²	28.2	34%	0.342	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-15.6	-179.6	60.7	0	0	0	0	113.1	D1815 I1819 P1871 L2672	D1815-T1817 VanDerWaalsContact C-N 3.25Å; D1815-T1817 PolarHBondContact O-N 3.14Å; D1815-T1817 WeakPolarHBondContact OD1-CA 2.86Å; D1815-T1817 WeakPolarHBondContact OD1-CB 3.16Å; D1815-T1817 PolarHBondContact OD1-N 3.26Å; D1815-T1817 PolarHBondContact OD1-OG1 3.01Å; D1815-T1817 WeakPolarHBondContact OD2-CB 3.33Å; D1815-T1817 PolarHBondContact OD2-N 2.91Å; D1815-T1817 VanDerWaalsContact OD2-N 3.1Å; D1815-T1817 PolarHBondContact OD2-OG1 2.99Å; D1815-T1817 VanDerWaalsContact OD2-OG1 3.1Å; T1817-I1819 VanDerWaalsContact C-N 3.26Å; T1817-I1819 HydrophobicContact CG2-CD1 4.36Å; T1817-I1819 PolarHBondContact O-N 3.13Å; T1817-I1819 WeakPolarHBondContact OG1-CB 3.43Å; T1817-I1819 VanDerWaalsContact OG1-CD1 3.3Å; T1817-I1819 WeakPolarHBondContact OG1-CD1 3.39Å; T1817-I1819 VanDerWaalsContact OG1-CG1 3.29Å; T1817-I1819 WeakPolarHBondContact OG1-CG1 3.35Å; T1817-I1819 PolarHBondContact OG1-N 3.33Å; T1817-P1871 HydrophobicContact CG2-CB 4.49Å; T1817-L2672 WeakPolarHBondContact O-CD1 3.41Å
1818	G	73.6	Confident	80.8	Confident	20 Å²	20	27.4 Å²	27.4	21%	0.206	15%	0.147	C	C	.	.	S	Bend	trans	71.9	15.9	-174.2	0	0	0	0	0	113.9	D1815 R1816 V1835 T2669	D1815-G1818 PolarHBondContact O-N 3.09Å; D1815-G1818 VanDerWaalsContact O-N 3.12Å; D1815-G1818 VanDerWaalsContact OD1-CA 3.27Å; D1815-G1818 WeakPolarHBondContact OD1-CA 3.37Å; D1815-G1818 PolarHBondContact OD1-N 3.23Å; R1816-G1818 VanDerWaalsContact C-N 3.33Å; G1818-V1835 WeakPolarHBondContact O-CB 3.36Å; G1818-V1835 WeakPolarHBondContact O-CG2 3.31Å; G1818-T2669 VanDerWaalsContact CA-CG2 3.41Å
1819	I	77.1	Confident	81.4	Confident	43.6 Å²	43.6	26.1 Å²	26.1	22%	0.224	14%	0.141	C	C	.	.	S	Bend	trans	-91	-36.6	-179.4	-61.6	173.4	0	0	0	110.5	D1815 T1817 E1834 V1835 V1898 T1899 L2672	D1815-I1819 PolarHBondContact OD1-N 3.06Å; D1815-I1819 VanDerWaalsContact OD1-N 3.17Å; T1817-I1819 VanDerWaalsContact C-N 3.26Å; T1817-I1819 HydrophobicContact CG2-CD1 4.36Å; T1817-I1819 PolarHBondContact O-N 3.13Å; T1817-I1819 WeakPolarHBondContact OG1-CB 3.43Å; T1817-I1819 VanDerWaalsContact OG1-CD1 3.3Å; T1817-I1819 WeakPolarHBondContact OG1-CD1 3.39Å; T1817-I1819 VanDerWaalsContact OG1-CG1 3.29Å; T1817-I1819 WeakPolarHBondContact OG1-CG1 3.35Å; T1817-I1819 PolarHBondContact OG1-N 3.33Å; I1819-E1834 CarbonylContact O-C 3.47Å; I1819-E1834 WeakPolarHBondContact O-CA 3.47Å; I1819-V1835 WeakPolarHBondContact O-CB 3.03Å; I1819-V1835 WeakPolarHBondContact O-CG2 3.26Å; I1819-V1835 PolarHBondContact O-N 3.05Å; I1819-V1898 HydrophobicContact CG2-CB 4.48Å; I1819-V1898 HydrophobicContact CG2-CG1 3.98Å; I1819-T1899 HydrophobicContact CD1-CG2 4.37Å; I1819-L2672 HydrophobicContact CD1-CD1 3.82Å; I1819-L2672 HydrophobicContact CD1-CD2 4.18Å; I1819-L2672 HydrophobicContact CG1-CD1 3.86Å
1820	L	82.7	Confident	81.9	Confident	2.8 Å²	2.8	25.3 Å²	25.3	2%	0.015	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	132.9	-175.6	-60.7	176	0	0	0	111.2	L1814 D1815 V1832 V1833 L1841 F1856 L1875 I1895 V1898	L1814-L1820 WeakPolarHBondContact CD2-O 3.42Å; D1815-L1820 HydrophobicContact CB-CB 4.13Å; D1815-L1820 VanDerWaalsContact CG-N 3.28Å; D1815-L1820 PolarHBondContact N-O 3.14Å; D1815-L1820 PolarHBondContact OD1-N 3.12Å; D1815-L1820 VanDerWaalsContact OD1-O 3.12Å; D1815-L1820 WeakPolarHBondContact OD2-CA 3.3Å; D1815-L1820 WeakPolarHBondContact OD2-CB 3.26Å; D1815-L1820 WeakPolarHBondContact OD2-CG 3.2Å; D1815-L1820 PolarHBondContact OD2-N 2.83Å; D1815-L1820 VanDerWaalsContact OD2-N 3.11Å; L1820-V1832 HydrophobicContact CB-CG1 4.38Å; L1820-V1832 HydrophobicContact CD2-CG1 4.31Å; L1820-V1833 WeakPolarHBondContact CA-O 3.2Å; L1820-L1841 HydrophobicContact CD2-CD1 3.37Å; L1820-L1841 VanDerWaalsContact CD2-CD1 3.41Å; L1820-F1856 HydrophobicContact CB-CZ 4.35Å; L1820-L1875 HydrophobicContact CD1-CD2 3.79Å; L1820-I1895 HydrophobicContact CD1-CB 4.05Å; L1820-I1895 HydrophobicContact CD1-CD1 4.32Å; L1820-I1895 HydrophobicContact CD1-CG1 3.88Å; L1820-I1895 VanDerWaalsContact CD1-CG1 3.49Å; L1820-V1898 HydrophobicContact CD2-CG2 4.28Å
1821	L	85.6	Confident	82.3	Confident	10.4 Å²	10.4	24.3 Å²	24.3	5%	0.054	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	124.1	172.7	-178.7	70.1	0	0	0	108.8	I1812 L1814 Y1823 V1832 V1833 V1835 I2682 I2698	I1812-L1821 HydrophobicContact CD1-CD1 3.66Å; I1812-L1821 VanDerWaalsContact CD1-CD1 3.48Å; I1812-L1821 HydrophobicContact CD1-CD2 4.22Å; I1812-L1821 HydrophobicContact CD1-CG 4.25Å; I1812-L1821 HydrophobicContact CG1-CD1 3.57Å; I1812-L1821 VanDerWaalsContact CG1-CD1 3.46Å; I1812-L1821 HydrophobicContact CG1-CG 4.28Å; L1814-L1821 HydrophobicContact CD1-CD1 4.02Å; L1814-L1821 HydrophobicContact CD2-CB 4.27Å; L1814-L1821 HydrophobicContact CD2-CD1 3.86Å; L1814-L1821 HydrophobicContact CG-CD1 3.82Å; L1821-Y1823 HydrophobicContact CD2-CD1 4.35Å; L1821-V1832 CarbonylContact O-C 3.53Å; L1821-V1832 VanDerWaalsContact O-CA 3.3Å; L1821-V1832 WeakPolarHBondContact O-CA 3.33Å; L1821-V1833 HydrophobicContact CB-CB 4.34Å; L1821-V1833 HydrophobicContact CD2-CB 4.47Å; L1821-V1833 PolarHBondContact N-O 3.07Å; L1821-V1833 PolarHBondContact O-N 3.13Å; L1821-V1835 HydrophobicContact CB-CG2 3.85Å; L1821-I2682 HydrophobicContact CD1-CD1 3.66Å; L1821-I2682 HydrophobicContact CD1-CG2 4.18Å; L1821-I2682 HydrophobicContact CD2-CD1 4.03Å; L1821-I2682 HydrophobicContact CD2-CG2 4.41Å; L1821-I2682 HydrophobicContact CG-CD1 4.32Å; L1821-I2698 HydrophobicContact CD2-CG2 4.1Å
1822	A	88.2	Confident	82.5	Confident	0 Å²	0	24 Å²	24	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	134.3	168.7	0	0	0	0	0	109.8	I1812 E1813 T1831 V1832 L1854 F1856 L1877	I1812-A1822 CarbonylContact C-O 3.55Å; I1812-A1822 WeakPolarHBondContact CA-O 3.29Å; E1813-A1822 PolarHBondContact N-O 2.98Å; E1813-A1822 PolarHBondContact O-N 3.14Å; A1822-T1831 CarbonylContact C-O 3.52Å; A1822-T1831 VanDerWaalsContact CA-O 3.3Å; A1822-T1831 WeakPolarHBondContact CA-O 3.44Å; A1822-V1832 HydrophobicContact CB-CG2 4.22Å; A1822-L1854 HydrophobicContact CB-CD1 4.11Å; A1822-L1854 WeakPolarHBondContact O-CD1 3.25Å; A1822-F1856 HydrophobicContact CB-CE2 3.95Å; A1822-F1856 HydrophobicContact CB-CZ 3.65Å; A1822-L1877 HydrophobicContact CB-CD1 4.12Å; A1822-L1877 HydrophobicContact CB-CD2 3.8Å
1823	Y	87.9	Confident	82.4	Confident	13.6 Å²	13.6	22.7 Å²	22.7	5%	0.053	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	145.9	170.2	69.8	-95.3	0	0	0	111.6	H1796 P1798 P1809 A1811 L1821 T1825 V1830 T1831 V1833 L1854 I2698	H1796-Y1823 AromaticContact CE1-CE1 3.91Å; H1796-Y1823 AromaticContact NE2-CE1 3.68Å; H1796-Y1823 AromaticContact NE2-CZ 3.69Å; H1796-Y1823 PolarHBondContact NE2-OH 3.43Å; H1796-Y1823 VanDerWaalsContact NE2-OH 3.11Å; P1798-Y1823 HydrophobicContact CB-CD2 4.36Å; P1798-Y1823 HydrophobicContact CB-CE2 3.75Å; P1798-Y1823 VanDerWaalsContact CB-CE2 3.42Å; P1798-Y1823 WeakPolarHBondContact CB-OH 3.49Å; P1798-Y1823 HydrophobicContact CG-CE2 4.41Å; P1809-Y1823 HydrophobicContact CB-CD2 4.07Å; P1809-Y1823 HydrophobicContact CB-CG 4.43Å; A1811-Y1823 CarbonylContact O-C 3.56Å; A1811-Y1823 VanDerWaalsContact O-CA 3.23Å; A1811-Y1823 WeakPolarHBondContact O-CA 3.18Å; A1811-Y1823 WeakPolarHBondContact O-CB 3.41Å; L1821-Y1823 HydrophobicContact CD2-CD1 4.35Å; Y1823-T1825 HydrophobicContact CD2-CG2 3.94Å; Y1823-T1825 HydrophobicContact CE2-CG2 3.81Å; Y1823-V1830 CarbonylContact O-C 3.54Å; Y1823-V1830 WeakPolarHBondContact O-CA 3.39Å; Y1823-T1831 HydrophobicContact CD1-CG2 4.44Å; Y1823-T1831 VanDerWaalsContact CD1-OG1 3.29Å; Y1823-T1831 WeakPolarHBondContact CD1-OG1 3.38Å; Y1823-T1831 WeakPolarHBondContact CD2-OG1 3.17Å; Y1823-T1831 HydrophobicContact CE1-CG2 3.69Å; Y1823-T1831 WeakPolarHBondContact CE1-OG1 3.41Å; Y1823-T1831 HydrophobicContact CE2-CG2 4.39Å; Y1823-T1831 WeakPolarHBondContact CE2-OG1 3.31Å; Y1823-T1831 VanDerWaalsContact CZ-CB 3.44Å; Y1823-T1831 PolarHBondContact N-O 3.26Å; Y1823-T1831 PolarHBondContact O-N 3Å; Y1823-T1831 PolarHBondContact O-OG1 3.22Å; Y1823-T1831 VanDerWaalsContact O-OG1 3.13Å; Y1823-T1831 WeakPolarHBondContact OH-CG2 3.41Å; Y1823-T1831 PolarHBondContact OH-OG1 3.17Å; Y1823-V1833 HydrophobicContact CD1-CG2 4.16Å; Y1823-V1833 HydrophobicContact CE1-CG2 3.62Å; Y1823-L1854 VanDerWaalsContact C-CD1 3.41Å; Y1823-I2698 HydrophobicContact CD1-CD1 3.57Å; Y1823-I2698 HydrophobicContact CD2-CD1 4.38Å; Y1823-I2698 HydrophobicContact CE1-CD1 4Å; Y1823-I2698 HydrophobicContact CG-CD1 3.78Å
1824	G	85.8	Confident	82	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	136.7	-179.5	0	0	0	0	0	110.2	P1809 I1810 A1811 T1829 I1851	P1809-G1824 CarbonylContact C-O 3.58Å; I1810-G1824 PolarHBondContact N-O 2.97Å; A1811-G1824 PolarHBondContact N-O 3.1Å; A1811-G1824 VanDerWaalsContact N-O 3.1Å; A1811-G1824 PolarHBondContact O-N 3.12Å; G1824-T1829 CarbonylContact C-O 3.58Å; G1824-T1829 WeakPolarHBondContact CA-O 3.31Å; G1824-I1851 VanDerWaalsContact CA-CD1 3.44Å
1825	T	83.9	Confident	81.6	Confident	3 Å²	3	22.3 Å²	22.3	2%	0.018	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	169.8	-172.3	68.6	0	0	0	0	114	D1807 I1808 Y1823 S1827 G1828 T1829 I1851	D1807-T1825 HydrophobicContact CB-CG2 4.1Å; D1807-T1825 VanDerWaalsContact CG-OG1 3.27Å; D1807-T1825 VanDerWaalsContact OD1-CB 3.26Å; D1807-T1825 WeakPolarHBondContact OD1-CB 3.31Å; D1807-T1825 PolarHBondContact OD1-OG1 3.13Å; D1807-T1825 WeakPolarHBondContact OD2-CB 3.34Å; D1807-T1825 WeakPolarHBondContact OD2-CG2 3.3Å; D1807-T1825 PolarHBondContact OD2-OG1 3.15Å; I1808-T1825 CarbonylContact O-C 3.55Å; I1808-T1825 VanDerWaalsContact O-CA 3.28Å; I1808-T1825 WeakPolarHBondContact O-CA 3.37Å; Y1823-T1825 HydrophobicContact CD2-CG2 3.94Å; Y1823-T1825 HydrophobicContact CE2-CG2 3.81Å; T1825-S1827 VanDerWaalsContact C-N 3.3Å; T1825-S1827 PolarHBondContact O-N 3Å; T1825-S1827 PolarHBondContact OG1-N 3.18Å; T1825-S1827 PolarHBondContact OG1-OG 3.09Å; T1825-S1827 VanDerWaalsContact OG1-OG 3.06Å; T1825-G1828 PolarHBondContact O-N 3.16Å; T1825-G1828 VanDerWaalsContact O-N 3.14Å; T1825-T1829 WeakPolarHBondContact CG2-OG1 3.39Å; T1825-T1829 PolarHBondContact N-O 3.12Å; T1825-T1829 WeakPolarHBondContact OG1-CB 3.4Å; T1825-T1829 PolarHBondContact OG1-N 3.16Å; T1825-T1829 VanDerWaalsContact OG1-N 3.15Å; T1825-T1829 PolarHBondContact OG1-O 3.04Å; T1825-T1829 PolarHBondContact OG1-OG1 3.07Å; T1825-I1851 PolarHBondContact O-N 3.15Å; T1825-I1851 VanDerWaalsContact O-N 3.15Å
1826	E	79.9	Confident	81	Confident	75.6 Å²	75.6	28.4 Å²	28.4	35%	0.353	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-34.7	172.8	-164.1	173.7	-179.1	0	0	112.3	D1807 I1808 I1810 G1828 P1850	D1807-E1826 PolarHBondContact OD1-N 2.94Å; I1808-E1826 HydrophobicContact CB-CB 4.31Å; I1808-E1826 WeakPolarHBondContact CD1-OE2 3.17Å; I1808-E1826 PolarHBondContact O-N 3.16Å; I1810-E1826 VanDerWaalsContact CD1-CA 3.41Å; I1810-E1826 HydrophobicContact CD1-CB 3.66Å; I1810-E1826 HydrophobicContact CD1-CG 3.91Å; I1810-E1826 HydrophobicContact CG1-CB 4.44Å; E1826-G1828 PolarHBondContact O-N 3.07Å; E1826-G1828 VanDerWaalsContact O-N 3.14Å; E1826-P1850 HydrophobicContact CG-CB 4.44Å; E1826-P1850 HydrophobicContact CG-CG 3.94Å; E1826-P1850 VanDerWaalsContact O-CA 3.29Å; E1826-P1850 WeakPolarHBondContact O-CA 3.26Å; E1826-P1850 WeakPolarHBondContact O-CD 3.29Å; E1826-P1850 VanDerWaalsContact O-CG 3.26Å; E1826-P1850 WeakPolarHBondContact O-CG 3.42Å
1827	S	77.7	Confident	80.6	Confident	59 Å²	59	25.3 Å²	25.3	41%	0.413	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-4.9	174.7	73.7	0	0	0	0	114.9	D1807 T1825 T1829	D1807-S1827 VanDerWaalsContact CG-OG 3.27Å; D1807-S1827 WeakPolarHBondContact OD1-CB 3.25Å; D1807-S1827 PolarHBondContact OD1-N 3Å; D1807-S1827 VanDerWaalsContact OD1-N 3.11Å; D1807-S1827 PolarHBondContact OD1-OG 2.99Å; D1807-S1827 VanDerWaalsContact OD2-CB 3.26Å; D1807-S1827 WeakPolarHBondContact OD2-CB 3.41Å; D1807-S1827 PolarHBondContact OD2-N 2.93Å; D1807-S1827 PolarHBondContact OD2-OG 3.11Å; T1825-S1827 VanDerWaalsContact C-N 3.3Å; T1825-S1827 PolarHBondContact O-N 3Å; T1825-S1827 PolarHBondContact OG1-N 3.18Å; T1825-S1827 PolarHBondContact OG1-OG 3.09Å; T1825-S1827 VanDerWaalsContact OG1-OG 3.06Å; S1827-T1829 WeakPolarHBondContact OG-CG2 3.37Å; S1827-T1829 PolarHBondContact OG-OG1 3.42Å
1828	G	82.3	Confident	80.6	Confident	1.2 Å²	1.2	24.9 Å²	24.9	1%	0.012	14%	0.137	C	C	.	.	S	Bend	trans	85.7	16.9	-178.3	0	0	0	0	0	114.5	T1825 E1826 M1849 I1851	T1825-G1828 PolarHBondContact O-N 3.16Å; T1825-G1828 VanDerWaalsContact O-N 3.14Å; E1826-G1828 PolarHBondContact O-N 3.07Å; E1826-G1828 VanDerWaalsContact O-N 3.14Å; G1828-M1849 VanDerWaalsContact CA-O 3.26Å; G1828-M1849 WeakPolarHBondContact CA-O 3.35Å; G1828-I1851 VanDerWaalsContact C-CD1 3.41Å; G1828-I1851 WeakPolarHBondContact O-CD1 3.49Å
1829	T	85.5	Confident	80.5	Confident	15.6 Å²	15.6	28.9 Å²	28.9	10%	0.096	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	134.5	175.5	68.1	0	0	0	0	111.9	D1807 G1824 T1825 S1827 F1844 L1845 I1851	D1807-T1829 PolarHBondContact OD2-OG1 3.21Å; G1824-T1829 CarbonylContact C-O 3.58Å; G1824-T1829 WeakPolarHBondContact CA-O 3.31Å; T1825-T1829 WeakPolarHBondContact CG2-OG1 3.39Å; T1825-T1829 PolarHBondContact N-O 3.12Å; T1825-T1829 WeakPolarHBondContact OG1-CB 3.4Å; T1825-T1829 PolarHBondContact OG1-N 3.16Å; T1825-T1829 VanDerWaalsContact OG1-N 3.15Å; T1825-T1829 PolarHBondContact OG1-O 3.04Å; T1825-T1829 PolarHBondContact OG1-OG1 3.07Å; S1827-T1829 WeakPolarHBondContact OG-CG2 3.37Å; S1827-T1829 PolarHBondContact OG-OG1 3.42Å; T1829-F1844 WeakPolarHBondContact CA-O 3.44Å; T1829-L1845 HydrophobicContact CG2-CD1 3.66Å; T1829-L1845 HydrophobicContact CG2-CD2 3.64Å; T1829-L1845 HydrophobicContact CG2-CG 4.31Å; T1829-I1851 WeakPolarHBondContact O-CD1 3.3Å
1830	V	88.3	Confident	80.5	Confident	0.2 Å²	0.2	30.2 Å²	30.2	0%	0.001	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	122.5	171.6	-176.3	0	0	0	0	107.8	Y1823 S1843 F1844 I1851 L1854 L1877	Y1823-V1830 CarbonylContact O-C 3.54Å; Y1823-V1830 WeakPolarHBondContact O-CA 3.39Å; V1830-S1843 CarbonylContact O-C 3.55Å; V1830-S1843 WeakPolarHBondContact O-CA 3.31Å; V1830-F1844 HydrophobicContact CB-CB 4.19Å; V1830-F1844 HydrophobicContact CB-CD2 4.08Å; V1830-F1844 HydrophobicContact CB-CE2 3.51Å; V1830-F1844 HydrophobicContact CB-CG 4.44Å; V1830-F1844 HydrophobicContact CB-CZ 3.91Å; V1830-F1844 HydrophobicContact CG1-CD2 4.17Å; V1830-F1844 HydrophobicContact CG1-CE1 4.4Å; V1830-F1844 HydrophobicContact CG1-CE2 3.69Å; V1830-F1844 HydrophobicContact CG1-CZ 3.62Å; V1830-F1844 HydrophobicContact CG2-CD2 4.47Å; V1830-F1844 HydrophobicContact CG2-CE2 4.07Å; V1830-F1844 PolarHBondContact N-O 2.99Å; V1830-F1844 VanDerWaalsContact N-O 3.1Å; V1830-F1844 WeakPolarHBondContact O-CD2 3.36Å; V1830-F1844 PolarHBondContact O-N 3.14Å; V1830-I1851 HydrophobicContact CB-CD1 4.35Å; V1830-I1851 HydrophobicContact CG2-CD1 3.44Å; V1830-I1851 VanDerWaalsContact CG2-CD1 3.43Å; V1830-I1851 HydrophobicContact CG2-CG1 4.31Å; V1830-L1854 HydrophobicContact CG1-CD1 4.34Å; V1830-L1854 HydrophobicContact CG1-CD2 3.98Å; V1830-L1854 HydrophobicContact CG2-CD2 4.24Å; V1830-L1877 HydrophobicContact CG1-CD2 3.63Å
1831	T	86.5	Confident	80.3	Confident	3.6 Å²	3.6	31.6 Å²	31.6	2%	0.022	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	137.9	179.7	-44.5	0	0	0	0	110.1	A1822 Y1823 V1833 T1840 S1843	A1822-T1831 CarbonylContact C-O 3.52Å; A1822-T1831 VanDerWaalsContact CA-O 3.3Å; A1822-T1831 WeakPolarHBondContact CA-O 3.44Å; Y1823-T1831 HydrophobicContact CD1-CG2 4.44Å; Y1823-T1831 VanDerWaalsContact CD1-OG1 3.29Å; Y1823-T1831 WeakPolarHBondContact CD1-OG1 3.38Å; Y1823-T1831 WeakPolarHBondContact CD2-OG1 3.17Å; Y1823-T1831 HydrophobicContact CE1-CG2 3.69Å; Y1823-T1831 WeakPolarHBondContact CE1-OG1 3.41Å; Y1823-T1831 HydrophobicContact CE2-CG2 4.39Å; Y1823-T1831 WeakPolarHBondContact CE2-OG1 3.31Å; Y1823-T1831 VanDerWaalsContact CZ-CB 3.44Å; Y1823-T1831 PolarHBondContact N-O 3.26Å; Y1823-T1831 PolarHBondContact O-N 3Å; Y1823-T1831 PolarHBondContact O-OG1 3.22Å; Y1823-T1831 VanDerWaalsContact O-OG1 3.13Å; Y1823-T1831 WeakPolarHBondContact OH-CG2 3.41Å; Y1823-T1831 PolarHBondContact OH-OG1 3.17Å; T1831-V1833 HydrophobicContact CG2-CG2 4.18Å; T1831-T1840 HydrophobicContact CG2-CG2 3.96Å; T1831-S1843 VanDerWaalsContact CG2-OG 3.28Å; T1831-S1843 WeakPolarHBondContact CG2-OG 3.35Å; T1831-S1843 WeakPolarHBondContact OG1-CB 3.44Å; T1831-S1843 PolarHBondContact OG1-OG 3.01Å
1832	V	87	Confident	80.1	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	131.3	177.5	-177.2	0	0	0	0	109.2	L1820 L1821 A1822 T1840 L1841 C1842 F1844 L1877 L1891	L1820-V1832 HydrophobicContact CB-CG1 4.38Å; L1820-V1832 HydrophobicContact CD2-CG1 4.31Å; L1821-V1832 CarbonylContact O-C 3.53Å; L1821-V1832 VanDerWaalsContact O-CA 3.3Å; L1821-V1832 WeakPolarHBondContact O-CA 3.33Å; A1822-V1832 HydrophobicContact CB-CG2 4.22Å; V1832-T1840 CarbonylContact O-C 3.55Å; V1832-L1841 PolarHBondContact O-N 3.11Å; V1832-C1842 PolarHBondContact N-O 2.97Å; V1832-C1842 PolarHBondContact O-N 3.01Å; V1832-F1844 HydrophobicContact CG2-CE1 4.06Å; V1832-F1844 HydrophobicContact CG2-CE2 3.9Å; V1832-F1844 HydrophobicContact CG2-CZ 4.38Å; V1832-L1877 HydrophobicContact CG2-CD2 4.32Å; V1832-L1891 HydrophobicContact CG2-CD1 4.23Å; V1832-L1891 HydrophobicContact CG2-CD2 4.07Å
1833	V	82.7	Confident	79.9	Confident	1.6 Å²	1.6	34.5 Å²	34.5	1%	0.01	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	141.9	-172.6	-178.9	0	0	0	0	109.3	L1820 L1821 Y1823 T1831 L1838 K1839 T1840	L1820-V1833 WeakPolarHBondContact CA-O 3.2Å; L1821-V1833 HydrophobicContact CB-CB 4.34Å; L1821-V1833 HydrophobicContact CD2-CB 4.47Å; L1821-V1833 PolarHBondContact N-O 3.07Å; L1821-V1833 PolarHBondContact O-N 3.13Å; Y1823-V1833 HydrophobicContact CD1-CG2 4.16Å; Y1823-V1833 HydrophobicContact CE1-CG2 3.62Å; T1831-V1833 HydrophobicContact CG2-CG2 4.18Å; V1833-L1838 VanDerWaalsContact CG1-C 3.42Å; V1833-L1838 HydrophobicContact CG1-CB 4.42Å; V1833-L1838 HydrophobicContact CG1-CD2 4.28Å; V1833-L1838 WeakPolarHBondContact CG1-O 3.27Å; V1833-K1839 CarbonylContact C-O 3.53Å; V1833-K1839 VanDerWaalsContact CA-O 3.29Å; V1833-K1839 WeakPolarHBondContact CA-O 3.24Å; V1833-K1839 WeakPolarHBondContact CG1-O 3.29Å; V1833-T1840 HydrophobicContact CG2-CG2 4.05Å
1834	E	79.1	Confident	79.6	Confident	35.6 Å²	35.6	34.5 Å²	34.5	17%	0.166	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	122.8	168.1	177.8	179.3	-145.4	0	0	109.8	I1819 Q1836 S1837 L1838 K1839 L1841 V1898	I1819-E1834 CarbonylContact O-C 3.47Å; I1819-E1834 WeakPolarHBondContact O-CA 3.47Å; E1834-Q1836 VanDerWaalsContact C-N 3.33Å; E1834-Q1836 PolarHBondContact O-N 3.06Å; E1834-S1837 WeakPolarHBondContact CB-OG 3.27Å; E1834-S1837 VanDerWaalsContact CD-OG 3.26Å; E1834-S1837 WeakPolarHBondContact CG-OG 3.4Å; E1834-S1837 PolarHBondContact O-N 2.9Å; E1834-S1837 WeakPolarHBondContact OE2-CB 3.3Å; E1834-S1837 PolarHBondContact OE2-OG 3.22Å; E1834-L1838 WeakPolarHBondContact O-CA 3.37Å; E1834-L1838 PolarHBondContact O-N 3.2Å; E1834-K1839 PolarHBondContact N-O 3.14Å; E1834-L1841 HydrophobicContact CB-CD1 4.09Å; E1834-L1841 HydrophobicContact CB-CD2 4.21Å; E1834-L1841 HydrophobicContact CB-CG 4.19Å; E1834-V1898 HydrophobicContact CG-CG1 4.44Å; E1834-V1898 WeakPolarHBondContact OE1-CG1 3.26Å
1835	V	75.8	Confident	79.4	Confident	31.2 Å²	31.2	40.1 Å²	40.1	19%	0.189	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-36.4	-172.6	174.8	0	0	0	0	112.7	L1814 G1818 I1819 L1821 L2680 I2682 L2700	L1814-V1835 HydrophobicContact CD2-CG2 3.68Å; G1818-V1835 WeakPolarHBondContact O-CB 3.36Å; G1818-V1835 WeakPolarHBondContact O-CG2 3.31Å; I1819-V1835 WeakPolarHBondContact O-CB 3.03Å; I1819-V1835 WeakPolarHBondContact O-CG2 3.26Å; I1819-V1835 PolarHBondContact O-N 3.05Å; L1821-V1835 HydrophobicContact CB-CG2 3.85Å; V1835-L2680 HydrophobicContact CG1-CD2 4.07Å; V1835-I2682 HydrophobicContact CG1-CD1 4.45Å; V1835-I2682 HydrophobicContact CG2-CD1 4.35Å; V1835-L2700 HydrophobicContact CG1-CD1 4.01Å; V1835-L2700 HydrophobicContact CG1-CD2 4.22Å
1836	Q	68.4	Low	78.9	Confident	134 Å²	134	41.7 Å²	41.7	63%	0.626	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-38	-176	-67.3	-176.2	-1.8	0	0	113.3	Q1717 E1834	Q1717-Q1836 PolarHBondContact NE2-O 3.11Å; E1834-Q1836 VanDerWaalsContact C-N 3.33Å; E1834-Q1836 PolarHBondContact O-N 3.06Å
1837	S	64.9	Low	79.1	Confident	24 Å²	24	38.5 Å²	38.5	17%	0.168	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-14.9	-178.6	63.7	0	0	0	0	112.8	N1685 A1794 E1834 K1839	N1685-S1837 VanDerWaalsContact ND2-CA 3.28Å; N1685-S1837 WeakPolarHBondContact ND2-CA 3.48Å; N1685-S1837 WeakPolarHBondContact ND2-CB 3.49Å; A1794-S1837 WeakPolarHBondContact CB-O 3.46Å; E1834-S1837 WeakPolarHBondContact CB-OG 3.27Å; E1834-S1837 VanDerWaalsContact CD-OG 3.26Å; E1834-S1837 WeakPolarHBondContact CG-OG 3.4Å; E1834-S1837 PolarHBondContact O-N 2.9Å; E1834-S1837 WeakPolarHBondContact OE2-CB 3.3Å; E1834-S1837 PolarHBondContact OE2-OG 3.22Å; S1837-K1839 PolarHBondContact O-N 3.12Å; S1837-K1839 VanDerWaalsContact O-N 3.1Å; S1837-K1839 WeakPolarHBondContact OG-CB 3.35Å; S1837-K1839 PolarHBondContact OG-N 3.31Å; S1837-K1839 VanDerWaalsContact OG-N 3.14Å
1838	L	70.2	Confident	79.4	Confident	47 Å²	47	42.2 Å²	42.2	25%	0.246	23%	0.234	C	C	.	.			trans	52.5	23	-165	-66.3	172.7	0	0	0	113.7	A1794 H1796 V1833 E1834	A1794-L1838 HydrophobicContact CB-CD1 3.7Å; H1796-L1838 HydrophobicContact CB-CB 4.35Å; H1796-L1838 HydrophobicContact CB-CD1 3.99Å; H1796-L1838 HydrophobicContact CB-CD2 3.97Å; H1796-L1838 HydrophobicContact CB-CG 4.41Å; V1833-L1838 VanDerWaalsContact CG1-C 3.42Å; V1833-L1838 HydrophobicContact CG1-CB 4.42Å; V1833-L1838 HydrophobicContact CG1-CD2 4.28Å; V1833-L1838 WeakPolarHBondContact CG1-O 3.27Å; E1834-L1838 WeakPolarHBondContact O-CA 3.37Å; E1834-L1838 PolarHBondContact O-N 3.2Å
1839	K	71.2	Confident	79.5	Confident	104 Å²	104	46.7 Å²	46.7	45%	0.452	26%	0.256	S	S	.	.			trans	-78.1	128.3	177.7	-174.7	179	-176.4	169.3	0	110.6	D1682 V1833 E1834 S1837 L1841	D1682-K1839 IonicContact OD1-NZ 3.91Å; D1682-K1839 PolarHBondContact OD1-NZ 3.27Å; D1682-K1839 IonicContact OD2-NZ 3.33Å; D1682-K1839 PolarHBondContact OD2-NZ 3.06Å; V1833-K1839 CarbonylContact C-O 3.53Å; V1833-K1839 VanDerWaalsContact CA-O 3.29Å; V1833-K1839 WeakPolarHBondContact CA-O 3.24Å; V1833-K1839 WeakPolarHBondContact CG1-O 3.29Å; E1834-K1839 PolarHBondContact N-O 3.14Å; S1837-K1839 PolarHBondContact O-N 3.12Å; S1837-K1839 VanDerWaalsContact O-N 3.1Å; S1837-K1839 WeakPolarHBondContact OG-CB 3.35Å; S1837-K1839 PolarHBondContact OG-N 3.31Å; S1837-K1839 VanDerWaalsContact OG-N 3.14Å; K1839-L1841 PolarHBondContact O-N 3.18Å
1840	T	77.5	Confident	79.5	Confident	71.4 Å²	71.4	46.7 Å²	46.7	44%	0.438	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	117.1	169.3	51.7	0	0	0	0	109.7	T1831 V1832 V1833	T1831-T1840 HydrophobicContact CG2-CG2 3.96Å; V1832-T1840 CarbonylContact O-C 3.55Å; V1833-T1840 HydrophobicContact CG2-CG2 4.05Å
1841	L	78.9	Confident	79.5	Confident	32 Å²	32	46.7 Å²	46.7	17%	0.168	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	-43	-179.6	-62.3	175.7	0	0	0	111.3	L1820 V1832 E1834 K1839 V1894 V1898 S1905	L1820-L1841 HydrophobicContact CD2-CD1 3.37Å; L1820-L1841 VanDerWaalsContact CD2-CD1 3.41Å; V1832-L1841 PolarHBondContact O-N 3.11Å; E1834-L1841 HydrophobicContact CB-CD1 4.09Å; E1834-L1841 HydrophobicContact CB-CD2 4.21Å; E1834-L1841 HydrophobicContact CB-CG 4.19Å; K1839-L1841 PolarHBondContact O-N 3.18Å; L1841-V1894 HydrophobicContact CB-CG1 3.87Å; L1841-V1894 HydrophobicContact CD1-CG1 3.69Å; L1841-V1894 HydrophobicContact CG-CG1 4.38Å; L1841-V1898 HydrophobicContact CD1-CG2 3.53Å; L1841-V1898 VanDerWaalsContact CD1-CG2 3.47Å; L1841-V1898 HydrophobicContact CD2-CG2 4.01Å; L1841-V1898 HydrophobicContact CG-CG2 4.37Å; L1841-S1905 WeakPolarHBondContact O-CB 3.42Å; L1841-S1905 PolarHBondContact O-OG 2.54Å
1842	C	80.8	Confident	79.6	Confident	16.4 Å²	16.4	47.5 Å²	47.5	11%	0.111	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	158.1	174.9	60	0	0	0	0	111.4	V1832 F1844	V1832-C1842 PolarHBondContact N-O 2.97Å; V1832-C1842 PolarHBondContact O-N 3.01Å; C1842-F1844 VanDerWaalsContact SG-CZ 3.58Å
1843	S	82.7	Confident	79.7	Confident	55.8 Å²	55.8	48.3 Å²	48.3	39%	0.39	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	133.9	171.4	-79.4	0	0	0	0	109.3	K1255 V1830 T1831	K1255-S1843 VanDerWaalsContact NZ-CB 3.33Å; K1255-S1843 PolarHBondContact NZ-OG 3.45Å; V1830-S1843 CarbonylContact O-C 3.55Å; V1830-S1843 WeakPolarHBondContact O-CA 3.31Å; T1831-S1843 VanDerWaalsContact CG2-OG 3.28Å; T1831-S1843 WeakPolarHBondContact CG2-OG 3.35Å; T1831-S1843 WeakPolarHBondContact OG1-CB 3.44Å; T1831-S1843 PolarHBondContact OG1-OG 3.01Å
1844	F	82.8	Confident	80.1	Confident	13.4 Å²	13.4	48.7 Å²	48.7	6%	0.059	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	136.2	-179.3	-40.2	-79.1	0	0	0	111	T1829 V1830 V1832 C1842 L1877 W1889 L1891 S1907	T1829-F1844 WeakPolarHBondContact CA-O 3.44Å; V1830-F1844 HydrophobicContact CB-CB 4.19Å; V1830-F1844 HydrophobicContact CB-CD2 4.08Å; V1830-F1844 HydrophobicContact CB-CE2 3.51Å; V1830-F1844 HydrophobicContact CB-CG 4.44Å; V1830-F1844 HydrophobicContact CB-CZ 3.91Å; V1830-F1844 HydrophobicContact CG1-CD2 4.17Å; V1830-F1844 HydrophobicContact CG1-CE1 4.4Å; V1830-F1844 HydrophobicContact CG1-CE2 3.69Å; V1830-F1844 HydrophobicContact CG1-CZ 3.62Å; V1830-F1844 HydrophobicContact CG2-CD2 4.47Å; V1830-F1844 HydrophobicContact CG2-CE2 4.07Å; V1830-F1844 PolarHBondContact N-O 2.99Å; V1830-F1844 VanDerWaalsContact N-O 3.1Å; V1830-F1844 WeakPolarHBondContact O-CD2 3.36Å; V1830-F1844 PolarHBondContact O-N 3.14Å; V1832-F1844 HydrophobicContact CG2-CE1 4.06Å; V1832-F1844 HydrophobicContact CG2-CE2 3.9Å; V1832-F1844 HydrophobicContact CG2-CZ 4.38Å; C1842-F1844 VanDerWaalsContact SG-CZ 3.58Å; F1844-L1877 HydrophobicContact CZ-CD2 4.19Å; F1844-W1889 HydrophobicContact CB-CD2 4.09Å; F1844-W1889 HydrophobicContact CB-CE3 3.87Å; F1844-W1889 HydrophobicContact CB-CH2 3.75Å; F1844-W1889 HydrophobicContact CB-CZ2 3.96Å; F1844-W1889 HydrophobicContact CB-CZ3 3.69Å; F1844-W1889 AromaticContact CD1-CD2 3.91Å; F1844-W1889 HydrophobicContact CD1-CD2 4.01Å; F1844-W1889 AromaticContact CD1-CE3 3.4Å; F1844-W1889 HydrophobicContact CD1-CE3 3.4Å; F1844-W1889 VanDerWaalsContact CD1-CE3 3.48Å; F1844-W1889 HydrophobicContact CD1-CG 4.4Å; F1844-W1889 AromaticContact CD1-CZ3 3.78Å; F1844-W1889 HydrophobicContact CD1-CZ3 3.78Å; F1844-W1889 HydrophobicContact CD2-CB 4.39Å; F1844-W1889 AromaticContact CD2-CD2 3.64Å; F1844-W1889 HydrophobicContact CD2-CD2 4.13Å; F1844-W1889 AromaticContact CD2-CE2 3.76Å; F1844-W1889 AromaticContact CD2-CE3 3.59Å; F1844-W1889 HydrophobicContact CD2-CE3 3.94Å; F1844-W1889 HydrophobicContact CD2-CG 4.2Å; F1844-W1889 AromaticContact CD2-CH2 3.8Å; F1844-W1889 HydrophobicContact CD2-CH2 3.8Å; F1844-W1889 AromaticContact CD2-CZ2 3.85Å; F1844-W1889 HydrophobicContact CD2-CZ2 3.85Å; F1844-W1889 AromaticContact CD2-CZ3 3.67Å; F1844-W1889 HydrophobicContact CD2-CZ3 3.67Å; F1844-W1889 HydrophobicContact CE1-CB 4.31Å; F1844-W1889 HydrophobicContact CE1-CD2 4.44Å; F1844-W1889 AromaticContact CE1-CE3 3.98Å; F1844-W1889 HydrophobicContact CE1-CE3 4.01Å; F1844-W1889 HydrophobicContact CE2-CB 4.12Å; F1844-W1889 AromaticContact CE2-CD1 3.83Å; F1844-W1889 AromaticContact CE2-CD2 3.34Å; F1844-W1889 HydrophobicContact CE2-CD2 3.34Å; F1844-W1889 AromaticContact CE2-CE2 3.57Å; F1844-W1889 AromaticContact CE2-CE3 3.74Å; F1844-W1889 HydrophobicContact CE2-CE3 3.74Å; F1844-W1889 AromaticContact CE2-CG 3.54Å; F1844-W1889 HydrophobicContact CE2-CG 3.9Å; F1844-W1889 HydrophobicContact CE2-CH2 4.44Å; F1844-W1889 HydrophobicContact CE2-CZ2 4.12Å; F1844-W1889 HydrophobicContact CE2-CZ3 4.27Å; F1844-W1889 AromaticContact CE2-NE1 3.84Å; F1844-W1889 AromaticContact CG-CD2 3.85Å; F1844-W1889 HydrophobicContact CG-CD2 3.89Å; F1844-W1889 AromaticContact CG-CE3 3.69Å; F1844-W1889 HydrophobicContact CG-CE3 3.83Å; F1844-W1889 HydrophobicContact CG-CG 4.37Å; F1844-W1889 HydrophobicContact CG-CH2 4.45Å; F1844-W1889 AromaticContact CG-CZ3 3.95Å; F1844-W1889 HydrophobicContact CG-CZ3 4.08Å; F1844-W1889 HydrophobicContact CZ-CB 4.33Å; F1844-W1889 HydrophobicContact CZ-CD2 4.32Å; F1844-W1889 HydrophobicContact CZ-CG 4.16Å; F1844-L1891 HydrophobicContact CE1-CD2 3.94Å; F1844-L1891 HydrophobicContact CE2-CD2 3.8Å; F1844-L1891 HydrophobicContact CZ-CD2 3.68Å; F1844-L1891 VanDerWaalsContact CZ-CD2 3.45Å; F1844-L1891 HydrophobicContact CZ-CG 4.49Å; F1844-S1907 WeakPolarHBondContact CD1-OG 3.44Å; F1844-S1907 VanDerWaalsContact CE1-OG 3.24Å; F1844-S1907 WeakPolarHBondContact CE1-OG 3.3Å; F1844-S1907 VanDerWaalsContact CZ-OG 3.27Å; F1844-S1907 WeakPolarHBondContact CZ-OG 3.41Å
1845	L	80.9	Confident	80.6	Confident	118.2 Å²	118.2	47.4 Å²	47.4	62%	0.619	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.8	129.2	172.4	-87	135.4	0	0	0	107.7	T1829	T1829-L1845 HydrophobicContact CG2-CD1 3.66Å; T1829-L1845 HydrophobicContact CG2-CD2 3.64Å; T1829-L1845 HydrophobicContact CG2-CG 4.31Å
1846	G	73.7	Confident	81.2	Confident	35.8 Å²	35.8	46.4 Å²	46.4	37%	0.369	26%	0.256	S	S	.	.			trans	-173.5	-26.2	178.2	0	0	0	0	0	115	L1887	G1846-L1887 WeakPolarHBondContact O-CD1 3.24Å
1847	H	84.4	Confident	82.1	Confident	9.2 Å²	9.2	40.1 Å²	40.1	4%	0.043	23%	0.226	C	C	.	.			trans	-85.8	148.1	169.6	-66.9	-68.4	0	0	0	110.7	I1851 S1879 S1881 D1883 S1885 L1887	H1847-I1851 HydrophobicContact CB-CG1 4.5Å; H1847-S1879 PolarHBondContact CD2-OG 3.08Å; H1847-S1879 PolarHBondContact CE1-O 3.17Å; H1847-S1879 VanDerWaalsContact NE2-CB 3.32Å; H1847-S1879 WeakPolarHBondContact NE2-CB 3.36Å; H1847-S1879 PolarHBondContact NE2-O 3.12Å; H1847-S1879 PolarHBondContact NE2-OG 3.11Å; H1847-S1881 VanDerWaalsContact CG-CB 3.45Å; H1847-S1881 VanDerWaalsContact ND1-CB 3.25Å; H1847-S1881 WeakPolarHBondContact ND1-CB 3.32Å; H1847-D1883 IonicContact ND1-OD1 3.31Å; H1847-D1883 IonicContact ND1-OD2 3.09Å; H1847-S1885 PolarHBondContact CE1-OG 3Å; H1847-S1885 VanDerWaalsContact CE1-OG 3.28Å; H1847-S1885 PolarHBondContact ND1-OG 3.41Å; H1847-L1887 VanDerWaalsContact CE1-CG 3.45Å; H1847-L1887 WeakPolarHBondContact CE1-CG 3.42Å
1848	N	83.3	Confident	82.6	Confident	136.8 Å²	136.8	39.6 Å²	39.6	73%	0.732	22%	0.222	S	C	*	.	S	Bend	trans	-97.6	-4.9	178.7	-69.3	-27.6	0	0	0	112.9	D1883	N1848-D1883 PolarHBondContact N-OD2 3.16Å
1849	M	85.4	Confident	82.4	Confident	94 Å²	94	39.4 Å²	39.4	46%	0.463	22%	0.22	S	C	.	.	S	Bend	trans	-144.2	167.1	-171	-74.1	-70.7	147.7	0	0	110	G1828 I1851 S1881 Q1882 D1883	G1828-M1849 VanDerWaalsContact CA-O 3.26Å; G1828-M1849 WeakPolarHBondContact CA-O 3.35Å; M1849-I1851 PolarHBondContact O-N 3.03Å; M1849-S1881 VanDerWaalsContact C-OG 3.29Å; M1849-S1881 WeakPolarHBondContact CB-OG 3.45Å; M1849-S1881 PolarHBondContact O-OG 3.05Å; M1849-Q1882 HydrophobicContact CB-CB 4.06Å; M1849-D1883 HydrophobicContact CB-CB 3.86Å; M1849-D1883 HydrophobicContact CG-CB 3.86Å
1850	P	85.8	Confident	81.8	Confident	17.2 Å²	17.2	37 Å²	37	11%	0.112	21%	0.213	C	C	.	.			trans	-48	136.3	-178.9	-31.2	34.4	0	0	0	114.4	I1810 E1826 L1852 S1881 Q1882 P2094	I1810-P1850 HydrophobicContact CD1-CB 3.93Å; I1810-P1850 HydrophobicContact CD1-CG 4.45Å; E1826-P1850 HydrophobicContact CG-CB 4.44Å; E1826-P1850 HydrophobicContact CG-CG 3.94Å; E1826-P1850 VanDerWaalsContact O-CA 3.29Å; E1826-P1850 WeakPolarHBondContact O-CA 3.26Å; E1826-P1850 WeakPolarHBondContact O-CD 3.29Å; E1826-P1850 VanDerWaalsContact O-CG 3.26Å; E1826-P1850 WeakPolarHBondContact O-CG 3.42Å; P1850-L1852 HydrophobicContact CB-CD2 4.37Å; P1850-S1881 VanDerWaalsContact O-CA 3.31Å; P1850-S1881 WeakPolarHBondContact O-CA 3.27Å; P1850-S1881 PolarHBondContact O-OG 3.18Å; P1850-S1881 VanDerWaalsContact O-OG 3.07Å; P1850-Q1882 PolarHBondContact O-N 3.04Å; P1850-Q1882 VanDerWaalsContact O-N 3.08Å; P1850-P2094 HydrophobicContact CB-CG 4.43Å; P1850-P2094 HydrophobicContact CG-CG 4.22Å
1851	I	88.4	Confident	80.6	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	127.8	174.1	-66.3	150.2	0	0	0	109.1	I1810 A1811 G1824 T1825 G1828 T1829 V1830 H1847 M1849 L1854 T1880	I1810-I1851 WeakPolarHBondContact CB-O 3.07Å; I1810-I1851 VanDerWaalsContact CG2-O 3.26Å; I1810-I1851 WeakPolarHBondContact CG2-O 3.38Å; A1811-I1851 HydrophobicContact CB-CG2 4.03Å; G1824-I1851 VanDerWaalsContact CA-CD1 3.44Å; T1825-I1851 PolarHBondContact O-N 3.15Å; T1825-I1851 VanDerWaalsContact O-N 3.15Å; G1828-I1851 VanDerWaalsContact C-CD1 3.41Å; G1828-I1851 WeakPolarHBondContact O-CD1 3.49Å; T1829-I1851 WeakPolarHBondContact O-CD1 3.3Å; V1830-I1851 HydrophobicContact CB-CD1 4.35Å; V1830-I1851 HydrophobicContact CG2-CD1 3.44Å; V1830-I1851 VanDerWaalsContact CG2-CD1 3.43Å; V1830-I1851 HydrophobicContact CG2-CG1 4.31Å; H1847-I1851 HydrophobicContact CB-CG1 4.5Å; M1849-I1851 PolarHBondContact O-N 3.03Å; I1851-L1854 HydrophobicContact CG2-CD2 4.05Å; I1851-L1854 HydrophobicContact CG2-CG 4.17Å; I1851-T1880 CarbonylContact C-O 3.56Å; I1851-T1880 WeakPolarHBondContact CA-O 3.31Å
1852	L	87.9	Confident	79	Confident	20.8 Å²	20.8	42.1 Å²	42.1	11%	0.109	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	-27.9	-173.3	-59.9	-177.8	0	0	0	113.4	P1850 T1880 Q1882 P1920 V1921 T1922 L2093 P2094 K2097	P1850-L1852 HydrophobicContact CB-CD2 4.37Å; L1852-T1880 PolarHBondContact N-O 3.27Å; L1852-Q1882 HydrophobicContact CD1-CB 4.04Å; L1852-Q1882 HydrophobicContact CD2-CB 4.41Å; L1852-Q1882 HydrophobicContact CG-CB 4.34Å; L1852-P1920 HydrophobicContact CD1-CB 3.98Å; L1852-V1921 WeakPolarHBondContact CD1-O 3.39Å; L1852-T1922 HydrophobicContact CD1-CG2 4.37Å; L1852-L2093 HydrophobicContact CD1-CD1 3.92Å; L1852-L2093 HydrophobicContact CD2-CD1 3.74Å; L1852-P2094 HydrophobicContact CD2-CB 3.6Å; L1852-P2094 HydrophobicContact CD2-CG 4.44Å; L1852-K2097 PolarHBondContact O-NZ 2.77Å; L1852-K2097 VanDerWaalsContact O-NZ 3.08Å
1853	S	88.7	Confident	77.1	Confident	16.8 Å²	16.8	44.9 Å²	44.9	12%	0.117	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	146.8	178.6	-179.2	0	0	0	0	111.1	S1879 T1880 S1924	S1853-S1879 WeakPolarHBondContact O-CA 3.49Å; S1853-T1880 VanDerWaalsContact CB-OG1 3.25Å; S1853-T1880 WeakPolarHBondContact CB-OG1 3.32Å; S1853-T1880 PolarHBondContact N-OG1 3.15Å; S1853-T1880 PolarHBondContact O-N 3.05Å; S1853-S1924 PolarHBondContact OG-N 3.15Å; S1853-S1924 VanDerWaalsContact OG-N 3.14Å; S1853-S1924 PolarHBondContact OG-OG 3.13Å
1854	L	90.6	Very high	75	Confident	9.2 Å²	9.2	46.9 Å²	46.9	5%	0.048	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	144.9	172.1	-69.7	174.7	0	0	0	109	A1811 E1813 A1822 Y1823 V1830 I1851 L1877 V1878	A1811-L1854 HydrophobicContact CB-CD1 4.28Å; A1811-L1854 HydrophobicContact CB-CG 4.08Å; E1813-L1854 HydrophobicContact CB-CB 3.91Å; E1813-L1854 VanDerWaalsContact OE2-O 3.11Å; A1822-L1854 HydrophobicContact CB-CD1 4.11Å; A1822-L1854 WeakPolarHBondContact O-CD1 3.25Å; Y1823-L1854 VanDerWaalsContact C-CD1 3.41Å; V1830-L1854 HydrophobicContact CG1-CD1 4.34Å; V1830-L1854 HydrophobicContact CG1-CD2 3.98Å; V1830-L1854 HydrophobicContact CG2-CD2 4.24Å; I1851-L1854 HydrophobicContact CG2-CD2 4.05Å; I1851-L1854 HydrophobicContact CG2-CG 4.17Å; L1854-L1877 HydrophobicContact CB-CD1 4.42Å; L1854-L1877 HydrophobicContact CD2-CD1 4.45Å; L1854-L1877 HydrophobicContact CD2-CD2 4.42Å; L1854-L1877 HydrophobicContact CD2-CG 4.47Å; L1854-V1878 CarbonylContact C-O 3.31Å; L1854-V1878 VanDerWaalsContact CA-O 3.31Å; L1854-V1878 WeakPolarHBondContact CA-O 3.35Å
1855	C	90.2	Very high	72.8	Confident	8.2 Å²	8.2	52.5 Å²	52.5	6%	0.055	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	123.3	176.8	-171.7	0	0	0	0	111.4	E1813 V1878 S1924 W1926	E1813-C1855 VanDerWaalsContact CD-CA 3.43Å; E1813-C1855 VanDerWaalsContact OE1-CA 3.32Å; E1813-C1855 WeakPolarHBondContact OE1-CA 3.17Å; E1813-C1855 WeakPolarHBondContact OE2-CA 3.34Å; E1813-C1855 PolarHBondContact OE2-N 3.26Å; C1855-V1878 HydrophobicContact CB-CB 4.41Å; C1855-V1878 PolarHBondContact N-O 3.11Å; C1855-V1878 PolarHBondContact O-N 3.08Å; C1855-S1924 WeakPolarHBondContact CB-OG 3.39Å; C1855-W1926 VanDerWaalsContact SG-CB 3.52Å; C1855-W1926 WeakPolarHBondContact SG-CB 3.45Å; C1855-W1926 PolarHBondContact SG-N 3.28Å; C1855-W1926 VanDerWaalsContact SG-N 3.4Å
1856	F	89.2	Confident	70.6	Confident	10.4 Å²	10.4	55.7 Å²	55.7	5%	0.046	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	135.8	174.4	-76.9	-76.7	0	0	0	111.9	E1813 L1814 D1815 L1820 A1822 L1875 L1877 L1891	E1813-F1856 HydrophobicContact CB-CD2 4.27Å; E1813-F1856 HydrophobicContact CB-CE2 4.29Å; E1813-F1856 HydrophobicContact CG-CD2 3.69Å; E1813-F1856 HydrophobicContact CG-CE2 4.18Å; E1813-F1856 WeakPolarHBondContact O-CE2 3.37Å; E1813-F1856 PolarHBondContact OE1-N 2.87Å; E1813-F1856 PolarHBondContact OE2-N 3.08Å; L1814-F1856 VanDerWaalsContact C-CE2 3.45Å; L1814-F1856 WeakPolarHBondContact O-CD2 3.19Å; D1815-F1856 HydrophobicContact CB-CD1 4.43Å; D1815-F1856 HydrophobicContact CB-CD2 4.19Å; D1815-F1856 HydrophobicContact CB-CE1 4.38Å; D1815-F1856 HydrophobicContact CB-CE2 4.13Å; D1815-F1856 HydrophobicContact CB-CG 4.41Å; D1815-F1856 HydrophobicContact CB-CZ 4.28Å; L1820-F1856 HydrophobicContact CB-CZ 4.35Å; A1822-F1856 HydrophobicContact CB-CE2 3.95Å; A1822-F1856 HydrophobicContact CB-CZ 3.65Å; F1856-L1875 HydrophobicContact CB-CD1 4.31Å; F1856-L1875 HydrophobicContact CD1-CD1 3.97Å; F1856-L1875 HydrophobicContact CD1-CD2 4.02Å; F1856-L1875 HydrophobicContact CD1-CG 4.15Å; F1856-L1875 HydrophobicContact CE1-CD2 3.96Å; F1856-L1875 HydrophobicContact CE1-CG 4.48Å; F1856-L1875 HydrophobicContact CG-CD1 4.45Å; F1856-L1877 HydrophobicContact CD1-CB 4.32Å; F1856-L1877 HydrophobicContact CD1-CD1 3.89Å; F1856-L1877 HydrophobicContact CD2-CD1 4.28Å; F1856-L1877 HydrophobicContact CE1-CB 4.36Å; F1856-L1877 HydrophobicContact CE1-CD1 3.93Å; F1856-L1877 HydrophobicContact CE1-CG 4.46Å; F1856-L1877 HydrophobicContact CE2-CD1 4.3Å; F1856-L1877 HydrophobicContact CG-CD1 4.09Å; F1856-L1877 HydrophobicContact CZ-CD1 4.13Å; F1856-L1891 HydrophobicContact CD1-CD1 4.33Å; F1856-L1891 HydrophobicContact CE1-CD1 3.61Å; F1856-L1891 VanDerWaalsContact CE1-CD1 3.49Å; F1856-L1891 HydrophobicContact CZ-CD1 4.49Å
1857	L	86.1	Confident	68.8	Low	1.8 Å²	1.8	57.8 Å²	57.8	1%	0.009	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	102.2	175.2	-53.9	176.6	0	0	0	109.3	W1876 V1878 I1888 W1926 L1933 V1947 F1952	L1857-W1876 HydrophobicContact CB-CB 4.09Å; L1857-W1876 HydrophobicContact CD1-CB 4Å; L1857-W1876 HydrophobicContact CD1-CE3 4.11Å; L1857-W1876 HydrophobicContact CG-CB 4.43Å; L1857-W1876 PolarHBondContact N-O 2.96Å; L1857-W1876 PolarHBondContact O-N 3.09Å; L1857-W1876 VanDerWaalsContact O-N 3.1Å; L1857-V1878 HydrophobicContact CD1-CG2 3.53Å; L1857-V1878 VanDerWaalsContact CD1-CG2 3.44Å; L1857-V1878 HydrophobicContact CD2-CG2 3.85Å; L1857-V1878 HydrophobicContact CG-CG2 3.69Å; L1857-I1888 HydrophobicContact CD1-CD1 4.42Å; L1857-I1888 HydrophobicContact CD1-CG2 4.16Å; L1857-W1926 HydrophobicContact CB-CZ2 4.42Å; L1857-W1926 HydrophobicContact CD2-CB 3.99Å; L1857-W1926 HydrophobicContact CD2-CD2 3.29Å; L1857-W1926 HydrophobicContact CD2-CE3 3.29Å; L1857-W1926 HydrophobicContact CD2-CG 3.63Å; L1857-W1926 HydrophobicContact CD2-CH2 4.22Å; L1857-W1926 HydrophobicContact CD2-CZ2 4.26Å; L1857-W1926 HydrophobicContact CD2-CZ3 3.78Å; L1857-W1926 HydrophobicContact CG-CD2 4.49Å; L1857-L1933 HydrophobicContact CD2-CD1 4.38Å; L1857-V1947 HydrophobicContact CD1-CG1 4.36Å; L1857-F1952 HydrophobicContact CB-CE2 4.24Å; L1857-F1952 HydrophobicContact CB-CZ 4.11Å; L1857-F1952 WeakPolarHBondContact O-CZ 3.42Å
1858	D	75.3	Confident	66.9	Low	13.6 Å²	13.6	67.8 Å²	67.8	7%	0.073	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	144.6	177.3	-9.2	-26.6	0	0	0	111.2	R1816 L1875 W1926	R1816-D1858 WeakPolarHBondContact CB-OD2 3.38Å; R1816-D1858 WeakPolarHBondContact CD-OD2 3.38Å; R1816-D1858 WeakPolarHBondContact CG-OD2 3.37Å; R1816-D1858 IonicContact CZ-OD1 3.38Å; R1816-D1858 IonicContact CZ-OD2 3.34Å; R1816-D1858 IonicContact NE-OD1 3.27Å; R1816-D1858 PolarHBondContact NE-OD1 3.19Å; R1816-D1858 IonicContact NE-OD2 2.97Å; R1816-D1858 PolarHBondContact NE-OD2 3.08Å; R1816-D1858 IonicContact NH1-OD1 2.7Å; R1816-D1858 PolarHBondContact NH1-OD1 2.82Å; R1816-D1858 VanDerWaalsContact NH1-OD1 3.11Å; R1816-D1858 IonicContact NH1-OD2 3.27Å; R1816-D1858 PolarHBondContact NH1-OD2 3.06Å; R1816-D1858 IonicContact NH2-OD1 3.04Å; R1816-D1858 PolarHBondContact NH2-OD1 2.93Å; R1816-D1858 IonicContact NH2-OD2 3.74Å; R1816-D1858 PolarHBondContact NH2-OD2 2.84Å; D1858-L1875 HydrophobicContact CB-CD1 4.18Å; D1858-L1875 WeakPolarHBondContact OD1-CD1 3.2Å; D1858-W1926 PolarHBondContact O-NE1 3.15Å; D1858-W1926 VanDerWaalsContact O-NE1 3.14Å; D1858-W1926 PolarHBondContact OD1-NE1 3.34Å
1859	E	66.2	Low	65	Low	43.4 Å²	43.4	65.2 Å²	65.2	20%	0.203	36%	0.357	C	S	.	.			trans	-88.5	134.2	174.4	-168.3	165	-151.8	0	0	110.2	R1931 F1952 G1953	E1859-R1931 IonicContact OE1-CZ 3.04Å; E1859-R1931 IonicContact OE1-NE 2.79Å; E1859-R1931 IonicContact OE1-NH1 2.9Å; E1859-R1931 PolarHBondContact OE1-NH1 3.02Å; E1859-R1931 IonicContact OE1-NH2 3.51Å; E1859-R1931 PolarHBondContact OE1-NH2 2.86Å; E1859-F1952 HydrophobicContact CB-CE1 4.16Å; E1859-F1952 HydrophobicContact CB-CZ 4.36Å; E1859-F1952 WeakPolarHBondContact OE2-CD1 3.17Å; E1859-G1953 VanDerWaalsContact OE1-CA 3.25Å; E1859-G1953 WeakPolarHBondContact OE1-CA 3.36Å; E1859-G1953 WeakPolarHBondContact OE2-CA 3.31Å
1860	V	60.1	Low	63	Low	52.2 Å²	52.2	66.4 Å²	66.4	32%	0.316	36%	0.364	S	S	.	.			trans	-100	103.4	171	179.3	0	0	0	0	107.1	R1816 S1862 P1928 Y1988	R1816-V1860 VanDerWaalsContact NH1-CG2 3.28Å; V1860-S1862 PolarHBondContact O-N 3.18Å; V1860-S1862 VanDerWaalsContact O-N 3.09Å; V1860-P1928 HydrophobicContact CG2-CB 3.77Å; V1860-P1928 HydrophobicContact CG2-CG 4.29Å; V1860-Y1988 HydrophobicContact CB-CE1 4.45Å; V1860-Y1988 HydrophobicContact CG1-CD1 4.17Å; V1860-Y1988 HydrophobicContact CG1-CE1 4.01Å; V1860-Y1988 HydrophobicContact CG2-CD1 4.46Å; V1860-Y1988 HydrophobicContact CG2-CE1 4.02Å
1861	D	51.6	Low	61.2	Low	86.4 Å²	86.4	67.6 Å²	67.6	46%	0.462	37%	0.372	S	S	.	.			trans	-63.1	113.6	169.6	-82	-24.1	0	0	0	108.8	S1863 R1866	D1861-S1863 PolarHBondContact O-N 3.09Å; D1861-S1863 VanDerWaalsContact O-N 3.11Å; D1861-R1866 IonicContact OD2-NH1 3.21Å; D1861-R1866 PolarHBondContact OD2-NH1 3.09Å
1862	S	45.1	Very low	59.5	Low	123.6 Å²	123.6	69.4 Å²	69.4	86%	0.864	39%	0.385	S	S	*	.	S	Bend	trans	-68.4	-3.1	-178.9	54.3	0	0	0	0	114.3	V1860 T1864	V1860-S1862 PolarHBondContact O-N 3.18Å; V1860-S1862 VanDerWaalsContact O-N 3.09Å; S1862-T1864 PolarHBondContact O-N 3.04Å; S1862-T1864 VanDerWaalsContact O-N 3.12Å
1863	S	41.6	Very low	58.1	Low	76.8 Å²	76.8	72.2 Å²	72.2	54%	0.537	41%	0.406	S	S	.	.	S	Bend	trans	-96.3	84.6	-178.3	57.4	0	0	0	0	112	D1861 T1865	D1861-S1863 PolarHBondContact O-N 3.09Å; D1861-S1863 VanDerWaalsContact O-N 3.11Å; S1863-T1865 PolarHBondContact O-N 3.46Å
1864	T	37.2	Very low	57.3	Low	97.4 Å²	97.4	73.5 Å²	73.5	60%	0.598	41%	0.41	S	S	*	.	S	Bend	trans	3	103.8	163	48.6	0	0	0	0	116.4	S1862 R1866	S1862-T1864 PolarHBondContact O-N 3.04Å; S1862-T1864 VanDerWaalsContact O-N 3.12Å; T1864-R1866 VanDerWaalsContact C-N 3.31Å; T1864-R1866 PolarHBondContact O-N 3.03Å; T1864-R1866 VanDerWaalsContact O-N 3.08Å
1865	T	38.1	Very low	56.8	Low	129.8 Å²	129.8	73.2 Å²	73.2	80%	0.796	41%	0.409	S	S	*	.			trans	0.7	58.3	159.2	56.2	0	0	0	0	114.6	S1863 S1867 D1991	S1863-T1865 PolarHBondContact O-N 3.46Å; T1865-S1867 PolarHBondContact O-N 3.34Å; T1865-D1991 VanDerWaalsContact CG2-OD2 3.25Å; T1865-D1991 WeakPolarHBondContact CG2-OD2 3.39Å
1866	R	33.6	Very low	56.7	Low	185.8 Å²	185.8	73.7 Å²	73.7	70%	0.701	41%	0.41	S	S	*	.			trans	-104	127.5	162.4	-82	-175.1	174.5	166	-0.3	109.1	D1861 T1864 I1870	D1861-R1866 IonicContact OD2-NH1 3.21Å; D1861-R1866 PolarHBondContact OD2-NH1 3.09Å; T1864-R1866 VanDerWaalsContact C-N 3.31Å; T1864-R1866 PolarHBondContact O-N 3.03Å; T1864-R1866 VanDerWaalsContact O-N 3.08Å; R1866-I1870 HydrophobicContact CG-CD1 4.03Å
1867	S	36.7	Very low	56.7	Low	81.4 Å²	81.4	73.2 Å²	73.2	57%	0.569	41%	0.407	S	S	*	.			trans	-47.2	147.4	173.9	50	0	0	0	0	111.8	T1865 S1869	T1865-S1867 PolarHBondContact O-N 3.34Å; S1867-S1869 PolarHBondContact O-N 3.01Å; S1867-S1869 PolarHBondContact OG-OG 3.21Å
1868	Y	44.2	Very low	57	Low	219.2 Å²	219.2	73.1 Å²	73.1	86%	0.86	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	20.6	177.9	-77.9	-88.3	0	0	0	116.3	P2105	Y1868-P2105 HydrophobicContact CE1-CB 4.36Å; Y1868-P2105 HydrophobicContact CE2-CB 4.18Å; Y1868-P2105 WeakPolarHBondContact OH-CB 3.41Å
1869	S	43	Very low	57.8	Low	81 Å²	81	72.5 Å²	72.5	57%	0.566	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.8	-3.2	-168.7	60.2	0	0	0	0	115.6	S1867 P1871	S1867-S1869 PolarHBondContact O-N 3.01Å; S1867-S1869 PolarHBondContact OG-OG 3.21Å; S1869-P1871 WeakPolarHBondContact O-CD 3.48Å
1870	I	43.5	Very low	58.9	Low	119 Å²	119	70.4 Å²	70.4	61%	0.61	39%	0.394	S	S	*	.	S	Bend	trans	-118.3	110.8	-179.7	-51.5	172.5	0	0	0	109	R1866 S1872	R1866-I1870 HydrophobicContact CG-CD1 4.03Å; I1870-S1872 PolarHBondContact O-N 3.35Å
1871	P	48	Very low	60.4	Low	43.2 Å²	43.2	67.9 Å²	67.9	28%	0.281	38%	0.379	S	S	.	.			trans	-65	142.7	176.3	22.1	-26.2	0	0	0	110.6	T1817 S1869 S1873 I1895 T1899	T1817-P1871 HydrophobicContact CG2-CB 4.49Å; S1869-P1871 WeakPolarHBondContact O-CD 3.48Å; P1871-S1873 PolarHBondContact O-N 3.48Å; P1871-I1895 HydrophobicContact CB-CD1 4.14Å; P1871-I1895 HydrophobicContact CB-CG1 4.14Å; P1871-I1895 HydrophobicContact CB-CG2 3.82Å; P1871-I1895 HydrophobicContact CG-CG2 3.78Å; P1871-T1899 HydrophobicContact CB-CG2 4.06Å; P1871-T1899 HydrophobicContact CG-CG2 3.64Å
1872	S	53.3	Low	62.1	Low	36.6 Å²	36.6	67.1 Å²	67.1	26%	0.256	37%	0.372	S	S	.	.			trans	-56.5	140.2	177.7	52.4	0	0	0	0	110.7	I1870 Q1874	I1870-S1872 PolarHBondContact O-N 3.35Å; S1872-Q1874 WeakPolarHBondContact CB-O 3.44Å; S1872-Q1874 PolarHBondContact O-N 3.07Å; S1872-Q1874 VanDerWaalsContact O-N 3.15Å; S1872-Q1874 PolarHBondContact OG-O 3.05Å
1873	S	58.7	Low	64.1	Low	79.6 Å²	79.6	63.6 Å²	63.6	56%	0.557	34%	0.344	S	S	*	.	S	Bend	trans	-65.3	-17.4	-175.9	65.5	0	0	0	0	114.1	P1871 K1896	P1871-S1873 PolarHBondContact O-N 3.48Å; S1873-K1896 WeakPolarHBondContact O-CE 3.47Å
1874	Q	71	Confident	66.3	Low	44.4 Å²	44.4	60.8 Å²	60.8	21%	0.207	33%	0.325	C	S	.	.			trans	-128.6	131.2	177.9	-64.5	-179.4	4.6	0	0	109.5	S1872 S1892 F1952 G1953 S1954	S1872-Q1874 WeakPolarHBondContact CB-O 3.44Å; S1872-Q1874 PolarHBondContact O-N 3.07Å; S1872-Q1874 VanDerWaalsContact O-N 3.15Å; S1872-Q1874 PolarHBondContact OG-O 3.05Å; Q1874-S1892 VanDerWaalsContact CA-OG 3.31Å; Q1874-S1892 WeakPolarHBondContact CA-OG 3.3Å; Q1874-F1952 HydrophobicContact CB-CE2 4.42Å; Q1874-G1953 VanDerWaalsContact OE1-N 3.1Å; Q1874-S1954 PolarHBondContact NE2-O 3.26Å
1875	L	80.2	Confident	68.7	Low	4 Å²	4	57.1 Å²	57.1	2%	0.021	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	124.2	173.4	178.9	74.9	0	0	0	108.5	L1820 F1856 D1858 L1891 S1892 I1895	L1820-L1875 HydrophobicContact CD1-CD2 3.79Å; F1856-L1875 HydrophobicContact CB-CD1 4.31Å; F1856-L1875 HydrophobicContact CD1-CD1 3.97Å; F1856-L1875 HydrophobicContact CD1-CD2 4.02Å; F1856-L1875 HydrophobicContact CD1-CG 4.15Å; F1856-L1875 HydrophobicContact CE1-CD2 3.96Å; F1856-L1875 HydrophobicContact CE1-CG 4.48Å; F1856-L1875 HydrophobicContact CG-CD1 4.45Å; D1858-L1875 HydrophobicContact CB-CD1 4.18Å; D1858-L1875 WeakPolarHBondContact OD1-CD1 3.2Å; L1875-L1891 HydrophobicContact CB-CB 4.4Å; L1875-L1891 HydrophobicContact CD2-CB 4.04Å; L1875-L1891 HydrophobicContact CD2-CD1 4.2Å; L1875-L1891 HydrophobicContact CG-CB 4.24Å; L1875-L1891 HydrophobicContact CG-CD1 4.42Å; L1875-L1891 CarbonylContact O-C 3.55Å; L1875-L1891 WeakPolarHBondContact O-CA 3.33Å; L1875-L1891 WeakPolarHBondContact O-CB 3.29Å; L1875-L1891 PolarHBondContact O-N 3.21Å; L1875-S1892 PolarHBondContact N-OG 3.12Å; L1875-S1892 PolarHBondContact O-N 3.13Å; L1875-I1895 HydrophobicContact CB-CD1 3.29Å; L1875-I1895 HydrophobicContact CB-CG1 4.27Å; L1875-I1895 HydrophobicContact CB-CG2 4.31Å; L1875-I1895 HydrophobicContact CD1-CD1 4.37Å; L1875-I1895 HydrophobicContact CD2-CB 4.31Å; L1875-I1895 HydrophobicContact CD2-CD1 3.55Å; L1875-I1895 VanDerWaalsContact CD2-CD1 3.43Å; L1875-I1895 HydrophobicContact CD2-CG1 3.94Å; L1875-I1895 HydrophobicContact CG-CD1 3.88Å
1876	W	87.8	Confident	71.2	Confident	18 Å²	18	51 Å²	51	7%	0.068	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	157.2	174	-55.5	-20.3	0	0	0	111	L1857 I1888 W1889 L1910 V1947 L1950 F1952	L1857-W1876 HydrophobicContact CB-CB 4.09Å; L1857-W1876 HydrophobicContact CD1-CB 4Å; L1857-W1876 HydrophobicContact CD1-CE3 4.11Å; L1857-W1876 HydrophobicContact CG-CB 4.43Å; L1857-W1876 PolarHBondContact N-O 2.96Å; L1857-W1876 PolarHBondContact O-N 3.09Å; L1857-W1876 VanDerWaalsContact O-N 3.1Å; W1876-I1888 HydrophobicContact CB-CG2 4.08Å; W1876-I1888 HydrophobicContact CD2-CG2 4.43Å; W1876-I1888 HydrophobicContact CE3-CG2 3.99Å; W1876-I1888 HydrophobicContact CG-CG2 4.46Å; W1876-W1889 CarbonylContact C-O 3.51Å; W1876-W1889 VanDerWaalsContact CA-O 3.24Å; W1876-W1889 WeakPolarHBondContact CA-O 3.3Å; W1876-W1889 VanDerWaalsContact CB-O 3.26Å; W1876-W1889 WeakPolarHBondContact CB-O 3.35Å; W1876-L1910 HydrophobicContact CB-CD1 4.44Å; W1876-L1910 VanDerWaalsContact CD1-CD1 3.49Å; W1876-L1910 HydrophobicContact CD2-CD1 3.58Å; W1876-L1910 VanDerWaalsContact CD2-CD1 3.47Å; W1876-L1910 HydrophobicContact CE3-CD1 3.92Å; W1876-L1910 HydrophobicContact CG-CD1 3.67Å; W1876-L1910 HydrophobicContact CH2-CD1 4.28Å; W1876-L1910 HydrophobicContact CZ2-CD1 3.8Å; W1876-L1910 HydrophobicContact CZ3-CD1 4.33Å; W1876-V1947 HydrophobicContact CE3-CG1 4.17Å; W1876-V1947 HydrophobicContact CZ3-CG1 3.75Å; W1876-L1950 HydrophobicContact CH2-CB 4.03Å; W1876-L1950 HydrophobicContact CH2-CD1 4.5Å; W1876-L1950 HydrophobicContact CZ3-CB 4.08Å; W1876-L1950 HydrophobicContact CZ3-CD1 4.1Å; W1876-F1952 HydrophobicContact CB-CE2 4.44Å; W1876-F1952 AromaticContact CD2-CD2 3.47Å; W1876-F1952 HydrophobicContact CD2-CD2 3.47Å; W1876-F1952 VanDerWaalsContact CD2-CD2 3.47Å; W1876-F1952 AromaticContact CD2-CE2 3.82Å; W1876-F1952 HydrophobicContact CD2-CE2 3.82Å; W1876-F1952 AromaticContact CE2-CD2 3.68Å; W1876-F1952 HydrophobicContact CE3-CB 4.34Å; W1876-F1952 AromaticContact CE3-CD2 3.4Å; W1876-F1952 HydrophobicContact CE3-CD2 3.4Å; W1876-F1952 VanDerWaalsContact CE3-CD2 3.43Å; W1876-F1952 HydrophobicContact CE3-CE1 4.3Å; W1876-F1952 HydrophobicContact CE3-CE2 4.03Å; W1876-F1952 HydrophobicContact CE3-CG 4.19Å; W1876-F1952 HydrophobicContact CE3-CZ 4.26Å; W1876-F1952 HydrophobicContact CG-CD2 4.2Å; W1876-F1952 AromaticContact CG-CE2 3.97Å; W1876-F1952 HydrophobicContact CG-CE2 4.05Å; W1876-F1952 HydrophobicContact CH2-CB 3.68Å; W1876-F1952 AromaticContact CH2-CD1 3.94Å; W1876-F1952 HydrophobicContact CH2-CD1 3.94Å; W1876-F1952 AromaticContact CH2-CD2 3.79Å; W1876-F1952 HydrophobicContact CH2-CD2 3.89Å; W1876-F1952 AromaticContact CH2-CE1 3.69Å; W1876-F1952 HydrophobicContact CH2-CE1 3.69Å; W1876-F1952 HydrophobicContact CH2-CE2 4.14Å; W1876-F1952 HydrophobicContact CH2-CG 4.25Å; W1876-F1952 AromaticContact CH2-CZ 3.8Å; W1876-F1952 HydrophobicContact CH2-CZ 3.8Å; W1876-F1952 HydrophobicContact CZ2-CB 4.38Å; W1876-F1952 HydrophobicContact CZ2-CD1 4.21Å; W1876-F1952 AromaticContact CZ2-CD2 3.84Å; W1876-F1952 HydrophobicContact CZ2-CD2 3.84Å; W1876-F1952 HydrophobicContact CZ2-CE1 4.14Å; W1876-F1952 HydrophobicContact CZ3-CB 3.65Å; W1876-F1952 HydrophobicContact CZ3-CD1 4.48Å; W1876-F1952 AromaticContact CZ3-CD2 3.58Å; W1876-F1952 HydrophobicContact CZ3-CD2 3.58Å; W1876-F1952 AromaticContact CZ3-CE1 3.79Å; W1876-F1952 HydrophobicContact CZ3-CE1 3.79Å; W1876-F1952 AromaticContact CZ3-CE2 3.94Å; W1876-F1952 HydrophobicContact CZ3-CE2 4.1Å; W1876-F1952 AromaticContact CZ3-CG 3.98Å; W1876-F1952 HydrophobicContact CZ3-CG 4.01Å; W1876-F1952 AromaticContact CZ3-CZ 3.57Å; W1876-F1952 HydrophobicContact CZ3-CZ 3.57Å
1877	L	90.2	Very high	73.9	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	133.3	176.5	176.9	69	0	0	0	109.5	A1822 V1830 V1832 F1844 L1854 F1856 I1888 W1889 L1891	A1822-L1877 HydrophobicContact CB-CD1 4.12Å; A1822-L1877 HydrophobicContact CB-CD2 3.8Å; V1830-L1877 HydrophobicContact CG1-CD2 3.63Å; V1832-L1877 HydrophobicContact CG2-CD2 4.32Å; F1844-L1877 HydrophobicContact CZ-CD2 4.19Å; L1854-L1877 HydrophobicContact CB-CD1 4.42Å; L1854-L1877 HydrophobicContact CD2-CD1 4.45Å; L1854-L1877 HydrophobicContact CD2-CD2 4.42Å; L1854-L1877 HydrophobicContact CD2-CG 4.47Å; F1856-L1877 HydrophobicContact CD1-CB 4.32Å; F1856-L1877 HydrophobicContact CD1-CD1 3.89Å; F1856-L1877 HydrophobicContact CD2-CD1 4.28Å; F1856-L1877 HydrophobicContact CE1-CB 4.36Å; F1856-L1877 HydrophobicContact CE1-CD1 3.93Å; F1856-L1877 HydrophobicContact CE1-CG 4.46Å; F1856-L1877 HydrophobicContact CE2-CD1 4.3Å; F1856-L1877 HydrophobicContact CG-CD1 4.09Å; F1856-L1877 HydrophobicContact CZ-CD1 4.13Å; L1877-I1888 CarbonylContact O-C 3.55Å; L1877-I1888 WeakPolarHBondContact O-CA 3.44Å; L1877-W1889 HydrophobicContact CB-CB 4.37Å; L1877-W1889 PolarHBondContact N-O 2.98Å; L1877-W1889 VanDerWaalsContact O-CD1 3.26Å; L1877-W1889 PolarHBondContact O-N 3.07Å; L1877-L1891 HydrophobicContact CB-CD1 3.63Å; L1877-L1891 HydrophobicContact CB-CG 4.37Å; L1877-L1891 HydrophobicContact CD2-CD1 4.18Å; L1877-L1891 HydrophobicContact CG-CD1 4.47Å
1878	V	91.1	Very high	76.4	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	134.4	171.7	-177.7	0	0	0	0	109.1	L1854 C1855 L1857 T1880 I1886 L1887 I1888 L1933	L1854-V1878 CarbonylContact C-O 3.31Å; L1854-V1878 VanDerWaalsContact CA-O 3.31Å; L1854-V1878 WeakPolarHBondContact CA-O 3.35Å; C1855-V1878 HydrophobicContact CB-CB 4.41Å; C1855-V1878 PolarHBondContact N-O 3.11Å; C1855-V1878 PolarHBondContact O-N 3.08Å; L1857-V1878 HydrophobicContact CD1-CG2 3.53Å; L1857-V1878 VanDerWaalsContact CD1-CG2 3.44Å; L1857-V1878 HydrophobicContact CD2-CG2 3.85Å; L1857-V1878 HydrophobicContact CG-CG2 3.69Å; V1878-T1880 HydrophobicContact CG1-CG2 4.43Å; V1878-I1886 HydrophobicContact CG1-CG2 3.82Å; V1878-L1887 CarbonylContact C-O 3.53Å; V1878-L1887 VanDerWaalsContact CA-O 3.32Å; V1878-L1887 WeakPolarHBondContact CA-O 3.29Å; V1878-I1888 HydrophobicContact CG2-CD1 4.38Å; V1878-I1888 HydrophobicContact CG2-CG1 4.21Å; V1878-L1933 HydrophobicContact CB-CD1 4.48Å; V1878-L1933 HydrophobicContact CG1-CD1 4.38Å; V1878-L1933 HydrophobicContact CG1-CD2 4.13Å; V1878-L1933 HydrophobicContact CG2-CD1 4.12Å; V1878-L1933 HydrophobicContact CG2-CD2 4.03Å
1879	S	92.2	Very high	78.5	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	137.8	170.1	58.3	0	0	0	0	111	H1847 S1853 I1886 L1887 W1889	H1847-S1879 PolarHBondContact CD2-OG 3.08Å; H1847-S1879 PolarHBondContact CE1-O 3.17Å; H1847-S1879 VanDerWaalsContact NE2-CB 3.32Å; H1847-S1879 WeakPolarHBondContact NE2-CB 3.36Å; H1847-S1879 PolarHBondContact NE2-O 3.12Å; H1847-S1879 PolarHBondContact NE2-OG 3.11Å; S1853-S1879 WeakPolarHBondContact O-CA 3.49Å; S1879-I1886 CarbonylContact O-C 3.57Å; S1879-I1886 WeakPolarHBondContact O-CA 3.43Å; S1879-L1887 PolarHBondContact N-O 2.96Å; S1879-L1887 PolarHBondContact O-N 3.22Å; S1879-W1889 PolarHBondContact OG-NE1 3.27Å
1880	T	90.8	Very high	80.4	Confident	0 Å²	0	26 Å²	26	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	143.8	174.8	75.3	0	0	0	0	110.2	I1851 L1852 S1853 V1878 I1886 V1921	I1851-T1880 CarbonylContact C-O 3.56Å; I1851-T1880 WeakPolarHBondContact CA-O 3.31Å; L1852-T1880 PolarHBondContact N-O 3.27Å; S1853-T1880 VanDerWaalsContact CB-OG1 3.25Å; S1853-T1880 WeakPolarHBondContact CB-OG1 3.32Å; S1853-T1880 PolarHBondContact N-OG1 3.15Å; S1853-T1880 PolarHBondContact O-N 3.05Å; V1878-T1880 HydrophobicContact CG1-CG2 4.43Å; T1880-I1886 HydrophobicContact CG2-CG1 4.11Å; T1880-I1886 HydrophobicContact CG2-CG2 4.41Å; T1880-V1921 WeakPolarHBondContact CB-O 3.31Å; T1880-V1921 HydrophobicContact CG2-CB 4.48Å; T1880-V1921 HydrophobicContact CG2-CG1 3.77Å; T1880-V1921 PolarHBondContact OG1-O 2.97Å
1881	S	90.1	Very high	82.3	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	162.1	-175	169.3	0	0	0	0	112.6	H1847 M1849 P1850 D1883 A1884 S1885 V1921	H1847-S1881 VanDerWaalsContact CG-CB 3.45Å; H1847-S1881 VanDerWaalsContact ND1-CB 3.25Å; H1847-S1881 WeakPolarHBondContact ND1-CB 3.32Å; M1849-S1881 VanDerWaalsContact C-OG 3.29Å; M1849-S1881 WeakPolarHBondContact CB-OG 3.45Å; M1849-S1881 PolarHBondContact O-OG 3.05Å; P1850-S1881 VanDerWaalsContact O-CA 3.31Å; P1850-S1881 WeakPolarHBondContact O-CA 3.27Å; P1850-S1881 PolarHBondContact O-OG 3.18Å; P1850-S1881 VanDerWaalsContact O-OG 3.07Å; S1881-D1883 VanDerWaalsContact CB-OD1 3.32Å; S1881-D1883 WeakPolarHBondContact CB-OD1 3.33Å; S1881-D1883 PolarHBondContact O-N 3.08Å; S1881-D1883 VanDerWaalsContact OG-CG 3.28Å; S1881-D1883 PolarHBondContact OG-N 3.06Å; S1881-D1883 PolarHBondContact OG-OD1 3.23Å; S1881-D1883 VanDerWaalsContact OG-OD1 3.07Å; S1881-D1883 PolarHBondContact OG-OD2 3Å; S1881-A1884 PolarHBondContact O-N 3.12Å; S1881-A1884 VanDerWaalsContact O-N 3.16Å; S1881-S1885 PolarHBondContact N-O 3.29Å; S1881-S1885 VanDerWaalsContact N-O 3.15Å; S1881-V1921 PolarHBondContact O-N 3.07Å
1882	Q	88.4	Confident	83.8	Confident	70.2 Å²	70.2	18.8 Å²	18.8	33%	0.328	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-19.4	171.2	-176.1	176.8	-5.7	0	0	113.2	M1849 P1850 L1852 A1884 P1920 P2094	M1849-Q1882 HydrophobicContact CB-CB 4.06Å; P1850-Q1882 PolarHBondContact O-N 3.04Å; P1850-Q1882 VanDerWaalsContact O-N 3.08Å; L1852-Q1882 HydrophobicContact CD1-CB 4.04Å; L1852-Q1882 HydrophobicContact CD2-CB 4.41Å; L1852-Q1882 HydrophobicContact CG-CB 4.34Å; Q1882-A1884 PolarHBondContact O-N 3.13Å; Q1882-A1884 VanDerWaalsContact O-N 3.13Å; Q1882-P1920 HydrophobicContact CB-CB 4.43Å; Q1882-P1920 HydrophobicContact CB-CG 4.48Å; Q1882-P1920 HydrophobicContact CG-CB 4.14Å; Q1882-P1920 HydrophobicContact CG-CG 3.76Å; Q1882-P1920 WeakPolarHBondContact O-CG 3.43Å; Q1882-P2094 HydrophobicContact CB-CB 4.41Å; Q1882-P2094 VanDerWaalsContact CD-CG 3.44Å; Q1882-P2094 HydrophobicContact CG-CB 4.22Å
1883	D	87.1	Confident	84.7	Confident	50.2 Å²	50.2	19.7 Å²	19.7	27%	0.268	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	6.7	172.1	62.8	19.4	0	0	0	114.4	H1847 N1848 M1849 S1881 S1885	H1847-D1883 IonicContact ND1-OD1 3.31Å; H1847-D1883 IonicContact ND1-OD2 3.09Å; N1848-D1883 PolarHBondContact N-OD2 3.16Å; M1849-D1883 HydrophobicContact CB-CB 3.86Å; M1849-D1883 HydrophobicContact CG-CB 3.86Å; S1881-D1883 VanDerWaalsContact CB-OD1 3.32Å; S1881-D1883 WeakPolarHBondContact CB-OD1 3.33Å; S1881-D1883 PolarHBondContact O-N 3.08Å; S1881-D1883 VanDerWaalsContact OG-CG 3.28Å; S1881-D1883 PolarHBondContact OG-N 3.06Å; S1881-D1883 PolarHBondContact OG-OD1 3.23Å; S1881-D1883 VanDerWaalsContact OG-OD1 3.07Å; S1881-D1883 PolarHBondContact OG-OD2 3Å; D1883-S1885 VanDerWaalsContact CG-OG 3.27Å; D1883-S1885 PolarHBondContact O-N 3.17Å; D1883-S1885 WeakPolarHBondContact OD1-CA 3.3Å; D1883-S1885 WeakPolarHBondContact OD1-CB 3.43Å; D1883-S1885 PolarHBondContact OD1-N 3.09Å; D1883-S1885 PolarHBondContact OD1-OG 3.29Å; D1883-S1885 PolarHBondContact OD2-OG 3.17Å
1884	A	87	Confident	85.4	Confident	17.4 Å²	17.4	16 Å²	16	14%	0.144	9%	0.085	C	C	.	.	S	Bend	trans	65.1	12	-175.8	0	0	0	0	0	115	S1881 Q1882 H1917 K1919	S1881-A1884 PolarHBondContact O-N 3.12Å; S1881-A1884 VanDerWaalsContact O-N 3.16Å; Q1882-A1884 PolarHBondContact O-N 3.13Å; Q1882-A1884 VanDerWaalsContact O-N 3.13Å; A1884-H1917 HydrophobicContact CB-CB 4.49Å; A1884-K1919 VanDerWaalsContact CB-O 3.25Å; A1884-K1919 WeakPolarHBondContact CB-O 3.25Å
1885	S	88.3	Confident	85.4	Confident	20.2 Å²	20.2	14.6 Å²	14.6	14%	0.141	8%	0.078	C	C	.	.			trans	-90.5	149.2	173.2	74.7	0	0	0	0	112.1	H1847 S1881 D1883	H1847-S1885 PolarHBondContact CE1-OG 3Å; H1847-S1885 VanDerWaalsContact CE1-OG 3.28Å; H1847-S1885 PolarHBondContact ND1-OG 3.41Å; S1881-S1885 PolarHBondContact N-O 3.29Å; S1881-S1885 VanDerWaalsContact N-O 3.15Å; D1883-S1885 VanDerWaalsContact CG-OG 3.27Å; D1883-S1885 PolarHBondContact O-N 3.17Å; D1883-S1885 WeakPolarHBondContact OD1-CA 3.3Å; D1883-S1885 WeakPolarHBondContact OD1-CB 3.43Å; D1883-S1885 PolarHBondContact OD1-N 3.09Å; D1883-S1885 PolarHBondContact OD1-OG 3.29Å; D1883-S1885 PolarHBondContact OD2-OG 3.17Å
1886	I	90.3	Very high	84.8	Confident	0.6 Å²	0.6	19.1 Å²	19.1	0%	0.003	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	121.3	174.9	-61.5	153.3	0	0	0	106	V1878 S1879 T1880 S1912 L1913 V1921 T1935 W1945	V1878-I1886 HydrophobicContact CG1-CG2 3.82Å; S1879-I1886 CarbonylContact O-C 3.57Å; S1879-I1886 WeakPolarHBondContact O-CA 3.43Å; T1880-I1886 HydrophobicContact CG2-CG1 4.11Å; T1880-I1886 HydrophobicContact CG2-CG2 4.41Å; I1886-S1912 CarbonylContact O-C 3.57Å; I1886-S1912 WeakPolarHBondContact O-CA 3.39Å; I1886-L1913 HydrophobicContact CB-CB 3.98Å; I1886-L1913 HydrophobicContact CD1-CB 4.5Å; I1886-L1913 HydrophobicContact CG2-CB 4.11Å; I1886-L1913 HydrophobicContact CG2-CD1 4.06Å; I1886-L1913 HydrophobicContact CG2-CG 4.45Å; I1886-L1913 PolarHBondContact O-N 2.98Å; I1886-V1921 HydrophobicContact CD1-CG1 4.23Å; I1886-V1921 HydrophobicContact CD1-CG2 4.21Å; I1886-V1921 HydrophobicContact CG1-CB 4.39Å; I1886-V1921 HydrophobicContact CG1-CG1 4.06Å; I1886-V1921 HydrophobicContact CG1-CG2 4.16Å; I1886-T1935 HydrophobicContact CD1-CG2 3.86Å; I1886-T1935 HydrophobicContact CG1-CG2 4.4Å; I1886-T1935 HydrophobicContact CG2-CG2 4.5Å; I1886-W1945 HydrophobicContact CD1-CZ2 3.97Å
1887	L	89.8	Confident	83.7	Confident	5 Å²	5	19.4 Å²	19.4	3%	0.026	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	144.2	-177.9	-60.4	-177.1	0	0	0	110.3	G1846 H1847 V1878 S1879 W1889 Q1909 S1912	G1846-L1887 WeakPolarHBondContact O-CD1 3.24Å; H1847-L1887 VanDerWaalsContact CE1-CG 3.45Å; H1847-L1887 WeakPolarHBondContact CE1-CG 3.42Å; V1878-L1887 CarbonylContact C-O 3.53Å; V1878-L1887 VanDerWaalsContact CA-O 3.32Å; V1878-L1887 WeakPolarHBondContact CA-O 3.29Å; S1879-L1887 PolarHBondContact N-O 2.96Å; S1879-L1887 PolarHBondContact O-N 3.22Å; L1887-W1889 HydrophobicContact CB-CZ2 3.93Å; L1887-W1889 HydrophobicContact CD1-CH2 4Å; L1887-W1889 HydrophobicContact CD1-CZ2 3.54Å; L1887-W1889 VanDerWaalsContact CD1-CZ2 3.48Å; L1887-W1889 HydrophobicContact CG-CZ2 4.34Å; L1887-Q1909 VanDerWaalsContact CD2-NE2 3.29Å; L1887-S1912 VanDerWaalsContact CD2-CB 3.45Å; L1887-S1912 VanDerWaalsContact CD2-OG 3.31Å; L1887-S1912 WeakPolarHBondContact CD2-OG 3.33Å
1888	I	88.7	Confident	82.4	Confident	0.2 Å²	0.2	21.3 Å²	21.3	0%	0.001	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	128.5	173.6	-51.1	-170.2	0	0	0	108.8	L1857 W1876 L1877 V1878 L1910 C1911 L1913 L1950	L1857-I1888 HydrophobicContact CD1-CD1 4.42Å; L1857-I1888 HydrophobicContact CD1-CG2 4.16Å; W1876-I1888 HydrophobicContact CB-CG2 4.08Å; W1876-I1888 HydrophobicContact CD2-CG2 4.43Å; W1876-I1888 HydrophobicContact CE3-CG2 3.99Å; W1876-I1888 HydrophobicContact CG-CG2 4.46Å; L1877-I1888 CarbonylContact O-C 3.55Å; L1877-I1888 WeakPolarHBondContact O-CA 3.44Å; V1878-I1888 HydrophobicContact CG2-CD1 4.38Å; V1878-I1888 HydrophobicContact CG2-CG1 4.21Å; I1888-L1910 HydrophobicContact CB-CB 4.44Å; I1888-L1910 HydrophobicContact CG2-CB 4.43Å; I1888-L1910 HydrophobicContact CG2-CD1 4.13Å; I1888-L1910 PolarHBondContact O-N 3.23Å; I1888-C1911 HydrophobicContact CB-CB 4.36Å; I1888-C1911 HydrophobicContact CD1-CB 4.41Å; I1888-C1911 VanDerWaalsContact CD1-SG 3.58Å; I1888-C1911 HydrophobicContact CG1-CB 4.48Å; I1888-C1911 VanDerWaalsContact CG1-SG 3.56Å; I1888-C1911 PolarHBondContact N-O 3.08Å; I1888-C1911 VanDerWaalsContact N-O 3.09Å; I1888-C1911 PolarHBondContact O-N 3.36Å; I1888-L1913 HydrophobicContact CD1-CD1 3.98Å; I1888-L1913 HydrophobicContact CD1-CG 4.46Å; I1888-L1913 HydrophobicContact CG1-CD1 4.34Å; I1888-L1950 HydrophobicContact CD1-CD1 4.16Å
1889	W	87.9	Confident	80.8	Confident	8 Å²	8	24.7 Å²	24.7	3%	0.03	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	138.8	-176.1	-50.4	96.3	0	0	0	111	F1844 W1876 L1877 S1879 L1887 S1908 Q1909	F1844-W1889 HydrophobicContact CB-CD2 4.09Å; F1844-W1889 HydrophobicContact CB-CE3 3.87Å; F1844-W1889 HydrophobicContact CB-CH2 3.75Å; F1844-W1889 HydrophobicContact CB-CZ2 3.96Å; F1844-W1889 HydrophobicContact CB-CZ3 3.69Å; F1844-W1889 AromaticContact CD1-CD2 3.91Å; F1844-W1889 HydrophobicContact CD1-CD2 4.01Å; F1844-W1889 AromaticContact CD1-CE3 3.4Å; F1844-W1889 HydrophobicContact CD1-CE3 3.4Å; F1844-W1889 VanDerWaalsContact CD1-CE3 3.48Å; F1844-W1889 HydrophobicContact CD1-CG 4.4Å; F1844-W1889 AromaticContact CD1-CZ3 3.78Å; F1844-W1889 HydrophobicContact CD1-CZ3 3.78Å; F1844-W1889 HydrophobicContact CD2-CB 4.39Å; F1844-W1889 AromaticContact CD2-CD2 3.64Å; F1844-W1889 HydrophobicContact CD2-CD2 4.13Å; F1844-W1889 AromaticContact CD2-CE2 3.76Å; F1844-W1889 AromaticContact CD2-CE3 3.59Å; F1844-W1889 HydrophobicContact CD2-CE3 3.94Å; F1844-W1889 HydrophobicContact CD2-CG 4.2Å; F1844-W1889 AromaticContact CD2-CH2 3.8Å; F1844-W1889 HydrophobicContact CD2-CH2 3.8Å; F1844-W1889 AromaticContact CD2-CZ2 3.85Å; F1844-W1889 HydrophobicContact CD2-CZ2 3.85Å; F1844-W1889 AromaticContact CD2-CZ3 3.67Å; F1844-W1889 HydrophobicContact CD2-CZ3 3.67Å; F1844-W1889 HydrophobicContact CE1-CB 4.31Å; F1844-W1889 HydrophobicContact CE1-CD2 4.44Å; F1844-W1889 AromaticContact CE1-CE3 3.98Å; F1844-W1889 HydrophobicContact CE1-CE3 4.01Å; F1844-W1889 HydrophobicContact CE2-CB 4.12Å; F1844-W1889 AromaticContact CE2-CD1 3.83Å; F1844-W1889 AromaticContact CE2-CD2 3.34Å; F1844-W1889 HydrophobicContact CE2-CD2 3.34Å; F1844-W1889 AromaticContact CE2-CE2 3.57Å; F1844-W1889 AromaticContact CE2-CE3 3.74Å; F1844-W1889 HydrophobicContact CE2-CE3 3.74Å; F1844-W1889 AromaticContact CE2-CG 3.54Å; F1844-W1889 HydrophobicContact CE2-CG 3.9Å; F1844-W1889 HydrophobicContact CE2-CH2 4.44Å; F1844-W1889 HydrophobicContact CE2-CZ2 4.12Å; F1844-W1889 HydrophobicContact CE2-CZ3 4.27Å; F1844-W1889 AromaticContact CE2-NE1 3.84Å; F1844-W1889 AromaticContact CG-CD2 3.85Å; F1844-W1889 HydrophobicContact CG-CD2 3.89Å; F1844-W1889 AromaticContact CG-CE3 3.69Å; F1844-W1889 HydrophobicContact CG-CE3 3.83Å; F1844-W1889 HydrophobicContact CG-CG 4.37Å; F1844-W1889 HydrophobicContact CG-CH2 4.45Å; F1844-W1889 AromaticContact CG-CZ3 3.95Å; F1844-W1889 HydrophobicContact CG-CZ3 4.08Å; F1844-W1889 HydrophobicContact CZ-CB 4.33Å; F1844-W1889 HydrophobicContact CZ-CD2 4.32Å; F1844-W1889 HydrophobicContact CZ-CG 4.16Å; W1876-W1889 CarbonylContact C-O 3.51Å; W1876-W1889 VanDerWaalsContact CA-O 3.24Å; W1876-W1889 WeakPolarHBondContact CA-O 3.3Å; W1876-W1889 VanDerWaalsContact CB-O 3.26Å; W1876-W1889 WeakPolarHBondContact CB-O 3.35Å; L1877-W1889 HydrophobicContact CB-CB 4.37Å; L1877-W1889 PolarHBondContact N-O 2.98Å; L1877-W1889 VanDerWaalsContact O-CD1 3.26Å; L1877-W1889 PolarHBondContact O-N 3.07Å; S1879-W1889 PolarHBondContact OG-NE1 3.27Å; L1887-W1889 HydrophobicContact CB-CZ2 3.93Å; L1887-W1889 HydrophobicContact CD1-CH2 4Å; L1887-W1889 HydrophobicContact CD1-CZ2 3.54Å; L1887-W1889 VanDerWaalsContact CD1-CZ2 3.48Å; L1887-W1889 HydrophobicContact CG-CZ2 4.34Å; W1889-S1908 CarbonylContact C-O 3.57Å; W1889-S1908 WeakPolarHBondContact CA-O 3.45Å; W1889-Q1909 HydrophobicContact CE3-CB 3.9Å; W1889-Q1909 HydrophobicContact CE3-CG 4.31Å; W1889-Q1909 HydrophobicContact CH2-CB 4.46Å; W1889-Q1909 HydrophobicContact CH2-CG 4.41Å; W1889-Q1909 HydrophobicContact CZ3-CB 3.72Å; W1889-Q1909 HydrophobicContact CZ3-CG 4.11Å
1890	D	84.7	Confident	79	Confident	30 Å²	30	28.8 Å²	28.8	16%	0.16	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	121	172	-167.6	3.2	0	0	0	111.3	S1892 S1907 S1908 L1910	D1890-S1892 WeakPolarHBondContact OD1-CB 3.34Å; D1890-S1892 PolarHBondContact OD1-N 3.14Å; D1890-S1892 PolarHBondContact OD1-OG 3.29Å; D1890-S1907 WeakPolarHBondContact O-CA 3.33Å; D1890-S1907 VanDerWaalsContact O-CB 3.24Å; D1890-S1907 WeakPolarHBondContact O-CB 3.31Å; D1890-S1908 PolarHBondContact N-O 3.21Å; D1890-S1908 PolarHBondContact O-N 3.31Å; D1890-L1910 HydrophobicContact CB-CD1 3.73Å; D1890-L1910 HydrophobicContact CB-CD2 4.04Å; D1890-L1910 HydrophobicContact CB-CG 3.82Å
1891	L	83.2	Confident	77.1	Confident	0.2 Å²	0.2	31.7 Å²	31.7	0%	0.001	19%	0.193	C	C	.	.			trans	-111.7	7.8	176.7	-65.5	175.2	0	0	0	113	V1832 F1844 F1856 L1875 L1877 N1893 V1894 I1895	V1832-L1891 HydrophobicContact CG2-CD1 4.23Å; V1832-L1891 HydrophobicContact CG2-CD2 4.07Å; F1844-L1891 HydrophobicContact CE1-CD2 3.94Å; F1844-L1891 HydrophobicContact CE2-CD2 3.8Å; F1844-L1891 HydrophobicContact CZ-CD2 3.68Å; F1844-L1891 VanDerWaalsContact CZ-CD2 3.45Å; F1844-L1891 HydrophobicContact CZ-CG 4.49Å; F1856-L1891 HydrophobicContact CD1-CD1 4.33Å; F1856-L1891 HydrophobicContact CE1-CD1 3.61Å; F1856-L1891 VanDerWaalsContact CE1-CD1 3.49Å; F1856-L1891 HydrophobicContact CZ-CD1 4.49Å; L1875-L1891 HydrophobicContact CB-CB 4.4Å; L1875-L1891 HydrophobicContact CD2-CB 4.04Å; L1875-L1891 HydrophobicContact CD2-CD1 4.2Å; L1875-L1891 HydrophobicContact CG-CB 4.24Å; L1875-L1891 HydrophobicContact CG-CD1 4.42Å; L1875-L1891 CarbonylContact O-C 3.55Å; L1875-L1891 WeakPolarHBondContact O-CA 3.33Å; L1875-L1891 WeakPolarHBondContact O-CB 3.29Å; L1875-L1891 PolarHBondContact O-N 3.21Å; L1877-L1891 HydrophobicContact CB-CD1 3.63Å; L1877-L1891 HydrophobicContact CB-CG 4.37Å; L1877-L1891 HydrophobicContact CD2-CD1 4.18Å; L1877-L1891 HydrophobicContact CG-CD1 4.47Å; L1891-N1893 VanDerWaalsContact C-N 3.28Å; L1891-N1893 PolarHBondContact O-N 3.27Å; L1891-N1893 VanDerWaalsContact O-N 3.16Å; L1891-V1894 HydrophobicContact CB-CB 4.38Å; L1891-V1894 HydrophobicContact CB-CG2 4.46Å; L1891-V1894 HydrophobicContact CD2-CB 4.32Å; L1891-V1894 HydrophobicContact CD2-CG2 3.97Å; L1891-V1894 WeakPolarHBondContact O-CA 3.38Å; L1891-V1894 WeakPolarHBondContact O-CB 3.38Å; L1891-V1894 PolarHBondContact O-N 3.01Å; L1891-I1895 PolarHBondContact O-N 3.17Å; L1891-I1895 VanDerWaalsContact O-N 3.1Å
1892	S	78	Confident	75.2	Confident	9.8 Å²	9.8	36.3 Å²	36.3	7%	0.069	22%	0.216	C	C	.	.	H	α-helix	trans	-59.7	-34.3	-176.2	-51.4	0	0	0	0	112.9	Q1874 L1875 D1890 I1895 K1896	Q1874-S1892 VanDerWaalsContact CA-OG 3.31Å; Q1874-S1892 WeakPolarHBondContact CA-OG 3.3Å; L1875-S1892 PolarHBondContact N-OG 3.12Å; L1875-S1892 PolarHBondContact O-N 3.13Å; D1890-S1892 WeakPolarHBondContact OD1-CB 3.34Å; D1890-S1892 PolarHBondContact OD1-N 3.14Å; D1890-S1892 PolarHBondContact OD1-OG 3.29Å; S1892-I1895 VanDerWaalsContact O-CG2 3.31Å; S1892-I1895 WeakPolarHBondContact O-CG2 3.49Å; S1892-K1896 WeakPolarHBondContact O-CD 3.4Å; S1892-K1896 VanDerWaalsContact O-CG 3.28Å; S1892-K1896 WeakPolarHBondContact O-CG 3.27Å; S1892-K1896 PolarHBondContact O-N 3.06Å
1893	N	72.9	Confident	73.3	Confident	56.8 Å²	56.8	39 Å²	39	30%	0.304	24%	0.238	S	C	.	.	H	α-helix	trans	-75.2	-30.9	175.1	-69.2	-21.6	0	0	0	112.6	L1891 K1896 S1897 T1906	L1891-N1893 VanDerWaalsContact C-N 3.28Å; L1891-N1893 PolarHBondContact O-N 3.27Å; L1891-N1893 VanDerWaalsContact O-N 3.16Å; N1893-K1896 PolarHBondContact O-N 3.09Å; N1893-S1897 PolarHBondContact O-N 2.92Å; N1893-S1897 VanDerWaalsContact O-N 3.11Å; N1893-T1906 PolarHBondContact ND2-O 3.12Å
1894	V	73.8	Confident	71.4	Confident	1.2 Å²	1.2	40.6 Å²	40.6	1%	0.007	25%	0.249	C	C	.	.	H	α-helix	trans	-69.8	-43.5	179.7	-178.1	0	0	0	0	110.2	L1841 L1891 K1896 S1897 V1898	L1841-V1894 HydrophobicContact CB-CG1 3.87Å; L1841-V1894 HydrophobicContact CD1-CG1 3.69Å; L1841-V1894 HydrophobicContact CG-CG1 4.38Å; L1891-V1894 HydrophobicContact CB-CB 4.38Å; L1891-V1894 HydrophobicContact CB-CG2 4.46Å; L1891-V1894 HydrophobicContact CD2-CB 4.32Å; L1891-V1894 HydrophobicContact CD2-CG2 3.97Å; L1891-V1894 WeakPolarHBondContact O-CA 3.38Å; L1891-V1894 WeakPolarHBondContact O-CB 3.38Å; L1891-V1894 PolarHBondContact O-N 3.01Å; V1894-K1896 VanDerWaalsContact C-N 3.32Å; V1894-K1896 PolarHBondContact O-N 2.92Å; V1894-S1897 WeakPolarHBondContact CA-OG 3.38Å; V1894-S1897 WeakPolarHBondContact O-CB 3.26Å; V1894-S1897 PolarHBondContact O-N 3.04Å; V1894-S1897 VanDerWaalsContact O-N 3.15Å; V1894-S1897 PolarHBondContact O-OG 2.98Å; V1894-V1898 WeakPolarHBondContact O-CG2 3.45Å; V1894-V1898 PolarHBondContact O-N 3.15Å; V1894-V1898 VanDerWaalsContact O-N 3.13Å
1895	I	70.4	Confident	69.7	Low	14.8 Å²	14.8	42.7 Å²	42.7	8%	0.076	26%	0.263	C	S	.	.	H	α-helix	trans	-58.6	-45.5	172.5	-86	174	0	0	0	111	L1820 P1871 L1875 L1891 S1892 S1897 V1898 T1899	L1820-I1895 HydrophobicContact CD1-CB 4.05Å; L1820-I1895 HydrophobicContact CD1-CD1 4.32Å; L1820-I1895 HydrophobicContact CD1-CG1 3.88Å; L1820-I1895 VanDerWaalsContact CD1-CG1 3.49Å; P1871-I1895 HydrophobicContact CB-CD1 4.14Å; P1871-I1895 HydrophobicContact CB-CG1 4.14Å; P1871-I1895 HydrophobicContact CB-CG2 3.82Å; P1871-I1895 HydrophobicContact CG-CG2 3.78Å; L1875-I1895 HydrophobicContact CB-CD1 3.29Å; L1875-I1895 HydrophobicContact CB-CG1 4.27Å; L1875-I1895 HydrophobicContact CB-CG2 4.31Å; L1875-I1895 HydrophobicContact CD1-CD1 4.37Å; L1875-I1895 HydrophobicContact CD2-CB 4.31Å; L1875-I1895 HydrophobicContact CD2-CD1 3.55Å; L1875-I1895 VanDerWaalsContact CD2-CD1 3.43Å; L1875-I1895 HydrophobicContact CD2-CG1 3.94Å; L1875-I1895 HydrophobicContact CG-CD1 3.88Å; L1891-I1895 PolarHBondContact O-N 3.17Å; L1891-I1895 VanDerWaalsContact O-N 3.1Å; S1892-I1895 VanDerWaalsContact O-CG2 3.31Å; S1892-I1895 WeakPolarHBondContact O-CG2 3.49Å; I1895-S1897 VanDerWaalsContact C-N 3.28Å; I1895-S1897 PolarHBondContact O-N 2.95Å; I1895-V1898 PolarHBondContact O-N 2.92Å; I1895-V1898 VanDerWaalsContact O-N 3.15Å; I1895-T1899 HydrophobicContact CG1-CG2 4.19Å; I1895-T1899 HydrophobicContact CG2-CG2 4.17Å; I1895-T1899 WeakPolarHBondContact O-CB 3.43Å; I1895-T1899 VanDerWaalsContact O-CG2 3.27Å; I1895-T1899 WeakPolarHBondContact O-CG2 3.21Å; I1895-T1899 PolarHBondContact O-N 3.11Å; I1895-T1899 PolarHBondContact O-OG1 3.02Å; I1895-T1899 VanDerWaalsContact O-OG1 3.11Å
1896	K	66.9	Low	68.1	Low	99.4 Å²	99.4	46.4 Å²	46.4	43%	0.432	29%	0.285	S	S	.	.	H	α-helix	trans	-62.5	-32.7	178.2	-71.6	173.4	-173.6	171.7	0	112.4	S1873 S1892 N1893 V1894 V1898 T1899 C1900	S1873-K1896 WeakPolarHBondContact O-CE 3.47Å; S1892-K1896 WeakPolarHBondContact O-CD 3.4Å; S1892-K1896 VanDerWaalsContact O-CG 3.28Å; S1892-K1896 WeakPolarHBondContact O-CG 3.27Å; S1892-K1896 PolarHBondContact O-N 3.06Å; N1893-K1896 PolarHBondContact O-N 3.09Å; V1894-K1896 VanDerWaalsContact C-N 3.32Å; V1894-K1896 PolarHBondContact O-N 2.92Å; K1896-V1898 VanDerWaalsContact C-N 3.34Å; K1896-T1899 WeakPolarHBondContact CA-OG1 3.28Å; K1896-C1900 WeakPolarHBondContact O-CA 3.37Å; K1896-C1900 VanDerWaalsContact O-CB 3.24Å; K1896-C1900 WeakPolarHBondContact O-CB 3.38Å; K1896-C1900 PolarHBondContact O-N 3.15Å
1897	S	65.6	Low	66.8	Low	22.6 Å²	22.6	47.9 Å²	47.9	16%	0.158	30%	0.295	C	S	.	.	H	α-helix	trans	-66.9	-40.6	175.8	72.4	0	0	0	0	112.1	N1893 V1894 I1895 G1901 I1902	N1893-S1897 PolarHBondContact O-N 2.92Å; N1893-S1897 VanDerWaalsContact O-N 3.11Å; V1894-S1897 WeakPolarHBondContact CA-OG 3.38Å; V1894-S1897 WeakPolarHBondContact O-CB 3.26Å; V1894-S1897 PolarHBondContact O-N 3.04Å; V1894-S1897 VanDerWaalsContact O-N 3.15Å; V1894-S1897 PolarHBondContact O-OG 2.98Å; I1895-S1897 VanDerWaalsContact C-N 3.28Å; I1895-S1897 PolarHBondContact O-N 2.95Å; S1897-G1901 WeakPolarHBondContact O-CA 3.45Å; S1897-G1901 PolarHBondContact O-N 3.25Å; S1897-I1902 VanDerWaalsContact CA-O 3.26Å; S1897-I1902 WeakPolarHBondContact CA-O 3.35Å; S1897-I1902 WeakPolarHBondContact CB-O 3.33Å
1898	V	62.2	Low	65.8	Low	40 Å²	40	50.8 Å²	50.8	24%	0.242	32%	0.316	C	S	.	.	H	α-helix	trans	-71.1	-44	177.5	177.4	0	0	0	0	111	I1819 L1820 E1834 L1841 V1894 I1895 K1896	I1819-V1898 HydrophobicContact CG2-CB 4.48Å; I1819-V1898 HydrophobicContact CG2-CG1 3.98Å; L1820-V1898 HydrophobicContact CD2-CG2 4.28Å; E1834-V1898 HydrophobicContact CG-CG1 4.44Å; E1834-V1898 WeakPolarHBondContact OE1-CG1 3.26Å; L1841-V1898 HydrophobicContact CD1-CG2 3.53Å; L1841-V1898 VanDerWaalsContact CD1-CG2 3.47Å; L1841-V1898 HydrophobicContact CD2-CG2 4.01Å; L1841-V1898 HydrophobicContact CG-CG2 4.37Å; V1894-V1898 WeakPolarHBondContact O-CG2 3.45Å; V1894-V1898 PolarHBondContact O-N 3.15Å; V1894-V1898 VanDerWaalsContact O-N 3.13Å; I1895-V1898 PolarHBondContact O-N 2.92Å; I1895-V1898 VanDerWaalsContact O-N 3.15Å; K1896-V1898 VanDerWaalsContact C-N 3.34Å
1899	T	59.4	Low	65.3	Low	71.8 Å²	71.8	54.6 Å²	54.6	44%	0.44	33%	0.334	S	S	.	.	H	α-helix	trans	-78.6	-31.4	-176.1	55.5	0	0	0	0	114.2	I1819 P1871 I1895 K1896	I1819-T1899 HydrophobicContact CD1-CG2 4.37Å; P1871-T1899 HydrophobicContact CB-CG2 4.06Å; P1871-T1899 HydrophobicContact CG-CG2 3.64Å; I1895-T1899 HydrophobicContact CG1-CG2 4.19Å; I1895-T1899 HydrophobicContact CG2-CG2 4.17Å; I1895-T1899 WeakPolarHBondContact O-CB 3.43Å; I1895-T1899 VanDerWaalsContact O-CG2 3.27Å; I1895-T1899 WeakPolarHBondContact O-CG2 3.21Å; I1895-T1899 PolarHBondContact O-N 3.11Å; I1895-T1899 PolarHBondContact O-OG1 3.02Å; I1895-T1899 VanDerWaalsContact O-OG1 3.11Å; K1896-T1899 WeakPolarHBondContact CA-OG1 3.28Å
1900	C	52.9	Low	64.7	Low	86 Å²	86	56.8 Å²	56.8	58%	0.581	35%	0.346	S	S	*	.	H	α-helix	trans	-112.9	-2.7	-175.2	-57.8	0	0	0	0	114.1	K1896 I1902	K1896-C1900 WeakPolarHBondContact O-CA 3.37Å; K1896-C1900 VanDerWaalsContact O-CB 3.24Å; K1896-C1900 WeakPolarHBondContact O-CB 3.38Å; K1896-C1900 PolarHBondContact O-N 3.15Å; C1900-I1902 VanDerWaalsContact C-N 3.3Å; C1900-I1902 HydrophobicContact CB-CD1 3.96Å; C1900-I1902 HydrophobicContact CB-CG1 4.05Å; C1900-I1902 PolarHBondContact O-N 3.08Å
1901	G	51.1	Low	64.4	Low	61.4 Å²	61.4	55.4 Å²	55.4	63%	0.633	34%	0.338	S	S	*	.			trans	69.3	16.6	-179.3	0	0	0	0	0	115.1	S1897	S1897-G1901 WeakPolarHBondContact O-CA 3.45Å; S1897-G1901 PolarHBondContact O-N 3.25Å
1902	I	49.6	Very low	64.3	Low	95.8 Å²	95.8	57.2 Å²	57.2	49%	0.491	35%	0.351	S	S	.	.			trans	-88.3	122.2	-177	-57.4	171.1	0	0	0	109.7	S1897 C1900 T1904	S1897-I1902 VanDerWaalsContact CA-O 3.26Å; S1897-I1902 WeakPolarHBondContact CA-O 3.35Å; S1897-I1902 WeakPolarHBondContact CB-O 3.33Å; C1900-I1902 VanDerWaalsContact C-N 3.3Å; C1900-I1902 HydrophobicContact CB-CD1 3.96Å; C1900-I1902 HydrophobicContact CB-CG1 4.05Å; C1900-I1902 PolarHBondContact O-N 3.08Å; I1902-T1904 VanDerWaalsContact C-N 3.28Å; I1902-T1904 HydrophobicContact CG2-CG2 4.32Å; I1902-T1904 PolarHBondContact O-N 3.24Å; I1902-T1904 VanDerWaalsContact O-N 3.09Å
1903	T	48.6	Very low	64.3	Low	128 Å²	128	56.9 Å²	56.9	79%	0.785	35%	0.349	S	S	*	.			trans	-79.6	29.2	-170.1	51.9	0	0	0	0	115.5	S1905	T1903-S1905 PolarHBondContact O-N 3.25Å
1904	T	47.5	Very low	64.3	Low	83.6 Å²	83.6	55.4 Å²	55.4	51%	0.513	35%	0.347	S	S	.	.			trans	-105.5	87.8	177.4	55.6	0	0	0	0	111	I1902 T1906	I1902-T1904 VanDerWaalsContact C-N 3.28Å; I1902-T1904 HydrophobicContact CG2-CG2 4.32Å; I1902-T1904 PolarHBondContact O-N 3.24Å; I1902-T1904 VanDerWaalsContact O-N 3.09Å; T1904-T1906 PolarHBondContact O-N 2.96Å; T1904-T1906 VanDerWaalsContact O-N 3.09Å
1905	S	51.4	Low	64.3	Low	61.8 Å²	61.8	58.6 Å²	58.6	43%	0.432	38%	0.38	S	S	.	.			trans	-85.7	46.9	178	58.2	0	0	0	0	112.8	L1841 T1903 S1907	L1841-S1905 WeakPolarHBondContact O-CB 3.42Å; L1841-S1905 PolarHBondContact O-OG 2.54Å; T1903-S1905 PolarHBondContact O-N 3.25Å; S1905-S1907 VanDerWaalsContact C-N 3.34Å; S1905-S1907 PolarHBondContact O-N 3.24Å; S1905-S1907 VanDerWaalsContact O-N 3.13Å
1906	T	54.6	Low	64.8	Low	96.8 Å²	96.8	60.5 Å²	60.5	59%	0.594	39%	0.386	S	S	*	.			trans	-85.9	98.7	171.8	50.2	0	0	0	0	109.5	N1893 T1904	N1893-T1906 PolarHBondContact ND2-O 3.12Å; T1904-T1906 PolarHBondContact O-N 2.96Å; T1904-T1906 VanDerWaalsContact O-N 3.09Å
1907	S	62.6	Low	65.7	Low	32 Å²	32	56.1 Å²	56.1	22%	0.224	37%	0.367	C	S	.	.			trans	-98.5	146.2	166.6	50.5	0	0	0	0	109.7	F1844 D1890 S1905	F1844-S1907 WeakPolarHBondContact CD1-OG 3.44Å; F1844-S1907 VanDerWaalsContact CE1-OG 3.24Å; F1844-S1907 WeakPolarHBondContact CE1-OG 3.3Å; F1844-S1907 VanDerWaalsContact CZ-OG 3.27Å; F1844-S1907 WeakPolarHBondContact CZ-OG 3.41Å; D1890-S1907 WeakPolarHBondContact O-CA 3.33Å; D1890-S1907 VanDerWaalsContact O-CB 3.24Å; D1890-S1907 WeakPolarHBondContact O-CB 3.31Å; S1905-S1907 VanDerWaalsContact C-N 3.34Å; S1905-S1907 PolarHBondContact O-N 3.24Å; S1905-S1907 VanDerWaalsContact O-N 3.13Å
1908	S	70.5	Confident	66.7	Low	65.6 Å²	65.6	61.7 Å²	61.7	46%	0.459	40%	0.396	S	S	.	.			trans	-130.4	150.1	-179.1	61.5	0	0	0	0	111.8	W1889 D1890 L1910	W1889-S1908 CarbonylContact C-O 3.57Å; W1889-S1908 WeakPolarHBondContact CA-O 3.45Å; D1890-S1908 PolarHBondContact N-O 3.21Å; D1890-S1908 PolarHBondContact O-N 3.31Å; S1908-L1910 PolarHBondContact O-N 3.19Å
1909	Q	76.9	Confident	67.9	Low	80.2 Å²	80.2	65.2 Å²	65.2	38%	0.375	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	120.9	167.2	-173	-172.7	-22.1	0	0	109.2	L1887 W1889	L1887-Q1909 VanDerWaalsContact CD2-NE2 3.29Å; W1889-Q1909 HydrophobicContact CE3-CB 3.9Å; W1889-Q1909 HydrophobicContact CE3-CG 4.31Å; W1889-Q1909 HydrophobicContact CH2-CB 4.46Å; W1889-Q1909 HydrophobicContact CH2-CG 4.41Å; W1889-Q1909 HydrophobicContact CZ3-CB 3.72Å; W1889-Q1909 HydrophobicContact CZ3-CG 4.11Å
1910	L	76.1	Confident	69.3	Low	54 Å²	54	63.1 Å²	63.1	28%	0.283	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	-48.1	180	-73.7	163.9	0	0	0	111.8	W1876 I1888 D1890 S1908	W1876-L1910 HydrophobicContact CB-CD1 4.44Å; W1876-L1910 VanDerWaalsContact CD1-CD1 3.49Å; W1876-L1910 HydrophobicContact CD2-CD1 3.58Å; W1876-L1910 VanDerWaalsContact CD2-CD1 3.47Å; W1876-L1910 HydrophobicContact CE3-CD1 3.92Å; W1876-L1910 HydrophobicContact CG-CD1 3.67Å; W1876-L1910 HydrophobicContact CH2-CD1 4.28Å; W1876-L1910 HydrophobicContact CZ2-CD1 3.8Å; W1876-L1910 HydrophobicContact CZ3-CD1 4.33Å; I1888-L1910 HydrophobicContact CB-CB 4.44Å; I1888-L1910 HydrophobicContact CG2-CB 4.43Å; I1888-L1910 HydrophobicContact CG2-CD1 4.13Å; I1888-L1910 PolarHBondContact O-N 3.23Å; D1890-L1910 HydrophobicContact CB-CD1 3.73Å; D1890-L1910 HydrophobicContact CB-CD2 4.04Å; D1890-L1910 HydrophobicContact CB-CG 3.82Å; S1908-L1910 PolarHBondContact O-N 3.19Å
1911	C	77.4	Confident	71.1	Confident	0.6 Å²	0.6	59 Å²	59	0%	0.004	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	158.2	-176.2	106.8	0	0	0	0	112	I1888 L1950 K1964	I1888-C1911 HydrophobicContact CB-CB 4.36Å; I1888-C1911 HydrophobicContact CD1-CB 4.41Å; I1888-C1911 VanDerWaalsContact CD1-SG 3.58Å; I1888-C1911 HydrophobicContact CG1-CB 4.48Å; I1888-C1911 VanDerWaalsContact CG1-SG 3.56Å; I1888-C1911 PolarHBondContact N-O 3.08Å; I1888-C1911 VanDerWaalsContact N-O 3.09Å; I1888-C1911 PolarHBondContact O-N 3.36Å; C1911-L1950 HydrophobicContact CB-CD1 4.3Å; C1911-L1950 HydrophobicContact CB-CD2 4.47Å; C1911-K1964 WeakPolarHBondContact CB-O 3.5Å; C1911-K1964 PolarHBondContact SG-O 3.09Å
1912	S	81.8	Confident	72.8	Confident	38.6 Å²	38.6	56.5 Å²	56.5	27%	0.27	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	118.7	167.5	178.8	0	0	0	0	109	I1886 L1887 G1914	I1886-S1912 CarbonylContact O-C 3.57Å; I1886-S1912 WeakPolarHBondContact O-CA 3.39Å; L1887-S1912 VanDerWaalsContact CD2-CB 3.45Å; L1887-S1912 VanDerWaalsContact CD2-OG 3.31Å; L1887-S1912 WeakPolarHBondContact CD2-OG 3.33Å; S1912-G1914 VanDerWaalsContact C-N 3.27Å; S1912-G1914 PolarHBondContact O-N 3.04Å
1913	L	77.7	Confident	74.7	Confident	4.4 Å²	4.4	52.6 Å²	52.6	2%	0.023	32%	0.32	C	S	.	.			trans	-92.5	41.8	177.8	-58.4	176.8	0	0	0	111.3	I1886 I1888 L1933 W1945 I1966	I1886-L1913 HydrophobicContact CB-CB 3.98Å; I1886-L1913 HydrophobicContact CD1-CB 4.5Å; I1886-L1913 HydrophobicContact CG2-CB 4.11Å; I1886-L1913 HydrophobicContact CG2-CD1 4.06Å; I1886-L1913 HydrophobicContact CG2-CG 4.45Å; I1886-L1913 PolarHBondContact O-N 2.98Å; I1888-L1913 HydrophobicContact CD1-CD1 3.98Å; I1888-L1913 HydrophobicContact CD1-CG 4.46Å; I1888-L1913 HydrophobicContact CG1-CD1 4.34Å; L1913-L1933 HydrophobicContact CD1-CD2 4.22Å; L1913-W1945 HydrophobicContact CB-CE3 4.45Å; L1913-W1945 HydrophobicContact CB-CH2 4.14Å; L1913-W1945 HydrophobicContact CB-CZ2 4.41Å; L1913-W1945 HydrophobicContact CB-CZ3 4.15Å; L1913-W1945 HydrophobicContact CD1-CD2 4.04Å; L1913-W1945 HydrophobicContact CD1-CE3 4.11Å; L1913-W1945 HydrophobicContact CD1-CG 4.26Å; L1913-W1945 HydrophobicContact CD1-CZ3 4.43Å; L1913-W1945 HydrophobicContact CD2-CE3 4.16Å; L1913-W1945 HydrophobicContact CD2-CZ3 4.21Å; L1913-W1945 HydrophobicContact CG-CE3 4.42Å; L1913-W1945 HydrophobicContact CG-CZ3 4.44Å; L1913-I1966 HydrophobicContact CD2-CB 3.74Å; L1913-I1966 HydrophobicContact CD2-CD1 3.9Å; L1913-I1966 HydrophobicContact CD2-CG1 3.93Å
1914	G	72.9	Confident	76.8	Confident	24.8 Å²	24.8	46.9 Å²	46.9	26%	0.256	29%	0.286	S	S	.	.			trans	-81.1	157.3	-179.4	0	0	0	0	0	114.5	S1912	S1912-G1914 VanDerWaalsContact C-N 3.27Å; S1912-G1914 PolarHBondContact O-N 3.04Å
1915	G	73.3	Confident	78.8	Confident	67.8 Å²	67.8	43.4 Å²	43.4	70%	0.699	27%	0.266	S	S	*	.	S	Bend	trans	96.4	6.6	170.3	0	0	0	0	0	116.3
1916	Y	82.9	Confident	80.6	Confident	54.8 Å²	54.8	41.4 Å²	41.4	22%	0.215	25%	0.249	C	C	.	.	S	Bend	trans	-107.6	-34.1	176.4	-69.2	-78.9	0	0	0	113.8	W1945 I1966 K1967 P1968	Y1916-W1945 AromaticContact CD2-CH2 3.43Å; Y1916-W1945 HydrophobicContact CD2-CH2 3.43Å; Y1916-W1945 VanDerWaalsContact CD2-CH2 3.44Å; Y1916-W1945 AromaticContact CD2-CZ3 3.79Å; Y1916-W1945 HydrophobicContact CD2-CZ3 3.79Å; Y1916-W1945 HydrophobicContact CE2-CH2 4.15Å; Y1916-W1945 AromaticContact CE2-CZ3 3.98Å; Y1916-W1945 HydrophobicContact CE2-CZ3 4.03Å; Y1916-W1945 AromaticContact CG-CH2 3.84Å; Y1916-W1945 HydrophobicContact CG-CH2 3.84Å; Y1916-W1945 HydrophobicContact CG-CZ3 4.41Å; Y1916-I1966 VanDerWaalsContact CE2-O 3.27Å; Y1916-I1966 WeakPolarHBondContact CE2-O 3.38Å; Y1916-K1967 WeakPolarHBondContact OH-CA 3.26Å; Y1916-K1967 VanDerWaalsContact OH-CG 3.26Å; Y1916-K1967 WeakPolarHBondContact OH-CG 3.34Å; Y1916-P1968 HydrophobicContact CD1-CG 3.73Å; Y1916-P1968 HydrophobicContact CD2-CG 4.44Å; Y1916-P1968 HydrophobicContact CE1-CG 3.92Å; Y1916-P1968 HydrophobicContact CG-CG 4.1Å; Y1916-P1968 VanDerWaalsContact CZ-CD 3.43Å
1917	H	85.5	Confident	82.1	Confident	8 Å²	8	36.8 Å²	36.8	4%	0.037	22%	0.22	C	C	.	.			trans	-90.1	137.9	166.9	-73.1	-82.2	0	0	0	109.3	A1884 V1921 T1935 D1939 L1941 C1943	A1884-H1917 HydrophobicContact CB-CB 4.49Å; H1917-V1921 HydrophobicContact CB-CG2 3.58Å; H1917-T1935 PolarHBondContact NE2-OG1 3.08Å; H1917-D1939 WeakPolarHBondContact CA-OD2 3.37Å; H1917-D1939 VanDerWaalsContact CB-OD2 3.3Å; H1917-D1939 WeakPolarHBondContact CB-OD2 3.36Å; H1917-D1939 IonicContact CE1-OD1 3.18Å; H1917-D1939 IonicContact CG-OD2 3.19Å; H1917-D1939 IonicContact ND1-OD1 3.55Å; H1917-D1939 PolarHBondContact ND1-OD1 3.21Å; H1917-D1939 VanDerWaalsContact ND1-OD1 3.11Å; H1917-D1939 IonicContact ND1-OD2 3.39Å; H1917-D1939 PolarHBondContact ND1-OD2 3.2Å; H1917-L1941 PolarHBondContact CE1-O 3.08Å; H1917-L1941 VanDerWaalsContact CE1-O 3.31Å; H1917-C1943 PolarHBondContact NE2-SG 3.21Å
1918	N	85.3	Confident	82.8	Confident	140.2 Å²	140.2	35.6 Å²	35.6	75%	0.75	21%	0.212	S	C	*	.	S	Bend	trans	-103.1	-1.7	-179.6	-67.7	-16.7	0	0	0	112.5	D1939	N1918-D1939 PolarHBondContact N-OD2 3.05Å; N1918-D1939 VanDerWaalsContact N-OD2 3.11Å
1919	K	87.7	Confident	83	Confident	112.2 Å²	112.2	38.7 Å²	38.7	49%	0.488	22%	0.217	S	C	.	.	S	Bend	trans	-140.7	168.4	-177	-76.2	-170.2	179.1	-178.9	0	109.6	A1884 V1921 L1938 D1939	A1884-K1919 VanDerWaalsContact CB-O 3.25Å; A1884-K1919 WeakPolarHBondContact CB-O 3.25Å; K1919-V1921 PolarHBondContact O-N 3.07Å; K1919-L1938 HydrophobicContact CB-CB 4.13Å; K1919-L1938 VanDerWaalsContact CD-C 3.44Å; K1919-L1938 HydrophobicContact CD-CB 4.23Å; K1919-L1938 VanDerWaalsContact CD-O 3.25Å; K1919-L1938 WeakPolarHBondContact CD-O 3.45Å; K1919-L1938 PolarHBondContact NZ-O 3.03Å; K1919-L1938 VanDerWaalsContact NZ-O 3.12Å; K1919-D1939 HydrophobicContact CB-CB 3.92Å; K1919-D1939 HydrophobicContact CD-CB 4.28Å; K1919-D1939 HydrophobicContact CG-CB 4.22Å
1920	P	88.9	Confident	82.9	Confident	28.2 Å²	28.2	39.3 Å²	39.3	18%	0.183	22%	0.216	C	C	.	.			trans	-44.4	130.9	177.8	-34	37.5	0	0	0	113.7	L1852 Q1882 T1922 G1937 L1938	L1852-P1920 HydrophobicContact CD1-CB 3.98Å; Q1882-P1920 HydrophobicContact CB-CB 4.43Å; Q1882-P1920 HydrophobicContact CB-CG 4.48Å; Q1882-P1920 HydrophobicContact CG-CB 4.14Å; Q1882-P1920 HydrophobicContact CG-CG 3.76Å; Q1882-P1920 WeakPolarHBondContact O-CG 3.43Å; P1920-T1922 PolarHBondContact O-N 3.22Å; P1920-G1937 VanDerWaalsContact O-CA 3.25Å; P1920-G1937 WeakPolarHBondContact O-CA 3.34Å; P1920-L1938 HydrophobicContact CB-CD1 3.93Å; P1920-L1938 HydrophobicContact CB-CG 4.26Å; P1920-L1938 HydrophobicContact CG-CD1 4.03Å; P1920-L1938 PolarHBondContact O-N 3.31Å
1921	V	90.1	Very high	83.1	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	103	176.3	-178.5	0	0	0	0	108.1	L1852 T1880 S1881 I1886 H1917 K1919 G1936	L1852-V1921 WeakPolarHBondContact CD1-O 3.39Å; T1880-V1921 WeakPolarHBondContact CB-O 3.31Å; T1880-V1921 HydrophobicContact CG2-CB 4.48Å; T1880-V1921 HydrophobicContact CG2-CG1 3.77Å; T1880-V1921 PolarHBondContact OG1-O 2.97Å; S1881-V1921 PolarHBondContact O-N 3.07Å; I1886-V1921 HydrophobicContact CD1-CG1 4.23Å; I1886-V1921 HydrophobicContact CD1-CG2 4.21Å; I1886-V1921 HydrophobicContact CG1-CB 4.39Å; I1886-V1921 HydrophobicContact CG1-CG1 4.06Å; I1886-V1921 HydrophobicContact CG1-CG2 4.16Å; H1917-V1921 HydrophobicContact CB-CG2 3.58Å; K1919-V1921 PolarHBondContact O-N 3.07Å; V1921-G1936 CarbonylContact C-O 3.57Å; V1921-G1936 WeakPolarHBondContact CG1-O 3.34Å
1922	T	88.3	Confident	83.5	Confident	8.2 Å²	8.2	41.2 Å²	41.2	5%	0.05	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	-27.1	-167.4	47.6	0	0	0	0	113.7	L1852 P1920 G1936 L1938 I1978	L1852-T1922 HydrophobicContact CD1-CG2 4.37Å; P1920-T1922 PolarHBondContact O-N 3.22Å; T1922-G1936 PolarHBondContact N-O 3.2Å; T1922-G1936 PolarHBondContact OG1-O 3.06Å; T1922-L1938 HydrophobicContact CG2-CD1 4.45Å; T1922-L1938 HydrophobicContact CG2-CD2 3.67Å; T1922-L1938 HydrophobicContact CG2-CG 3.72Å; T1922-I1978 WeakPolarHBondContact CB-O 3.39Å; T1922-I1978 PolarHBondContact OG1-O 3.13Å
1923	V	89.7	Confident	83.9	Confident	13.8 Å²	13.8	39.4 Å²	39.4	8%	0.084	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	146.7	-173.1	64	0	0	0	0	112.8	T1935 G1936 I1978 N1979 I1981	V1923-T1935 CarbonylContact O-C 3.53Å; V1923-T1935 VanDerWaalsContact O-CA 3.29Å; V1923-T1935 WeakPolarHBondContact O-CA 3.35Å; V1923-G1936 PolarHBondContact N-O 3.14Å; V1923-G1936 PolarHBondContact O-N 3.13Å; V1923-I1978 HydrophobicContact CG1-CG2 4.2Å; V1923-N1979 WeakPolarHBondContact CB-O 3.26Å; V1923-I1981 HydrophobicContact CG1-CB 3.98Å; V1923-I1981 HydrophobicContact CG1-CD1 3.85Å; V1923-I1981 HydrophobicContact CG1-CG1 3.66Å; V1923-I1981 HydrophobicContact CG2-CB 4.28Å
1924	S	91.3	Very high	84.5	Confident	9.2 Å²	9.2	39.2 Å²	39.2	6%	0.064	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	147.4	168.7	56.5	0	0	0	0	111	S1853 C1855 A1934	S1853-S1924 PolarHBondContact OG-N 3.15Å; S1853-S1924 VanDerWaalsContact OG-N 3.14Å; S1853-S1924 PolarHBondContact OG-OG 3.13Å; C1855-S1924 WeakPolarHBondContact CB-OG 3.39Å; S1924-A1934 CarbonylContact C-O 3.51Å; S1924-A1934 VanDerWaalsContact CA-O 3.27Å; S1924-A1934 WeakPolarHBondContact CA-O 3.28Å
1925	A	90.7	Very high	85.5	Confident	10.8 Å²	10.8	38 Å²	38	9%	0.089	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	144.3	175.6	0	0	0	0	0	110.9	L1933 A1934 I1981 F1983	A1925-L1933 CarbonylContact O-C 3.52Å; A1925-L1933 WeakPolarHBondContact O-CA 3.3Å; A1925-L1933 WeakPolarHBondContact O-CD1 3.43Å; A1925-A1934 PolarHBondContact N-O 3.02Å; A1925-A1934 PolarHBondContact O-N 3.22Å; A1925-I1981 HydrophobicContact CB-CG2 4.09Å; A1925-F1983 HydrophobicContact CB-CD2 3.84Å; A1925-F1983 HydrophobicContact CB-CE2 4Å; A1925-F1983 WeakPolarHBondContact O-CE2 3.37Å
1926	W	89.5	Confident	86.3	Confident	19.6 Å²	19.6	34.8 Å²	34.8	7%	0.074	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	135.5	-177.4	177.7	-127.5	0	0	0	113	C1855 L1857 D1858 P1928 R1931 L1932 L1933 V1947 F1952 F1983	C1855-W1926 VanDerWaalsContact SG-CB 3.52Å; C1855-W1926 WeakPolarHBondContact SG-CB 3.45Å; C1855-W1926 PolarHBondContact SG-N 3.28Å; C1855-W1926 VanDerWaalsContact SG-N 3.4Å; L1857-W1926 HydrophobicContact CB-CZ2 4.42Å; L1857-W1926 HydrophobicContact CD2-CB 3.99Å; L1857-W1926 HydrophobicContact CD2-CD2 3.29Å; L1857-W1926 HydrophobicContact CD2-CE3 3.29Å; L1857-W1926 HydrophobicContact CD2-CG 3.63Å; L1857-W1926 HydrophobicContact CD2-CH2 4.22Å; L1857-W1926 HydrophobicContact CD2-CZ2 4.26Å; L1857-W1926 HydrophobicContact CD2-CZ3 3.78Å; L1857-W1926 HydrophobicContact CG-CD2 4.49Å; D1858-W1926 PolarHBondContact O-NE1 3.15Å; D1858-W1926 VanDerWaalsContact O-NE1 3.14Å; D1858-W1926 PolarHBondContact OD1-NE1 3.34Å; W1926-P1928 WeakPolarHBondContact O-CD 3.21Å; W1926-R1931 HydrophobicContact CH2-CB 3.83Å; W1926-R1931 HydrophobicContact CH2-CG 4.47Å; W1926-R1931 WeakPolarHBondContact CH2-O 3.05Å; W1926-R1931 HydrophobicContact CZ2-CB 4.32Å; W1926-R1931 WeakPolarHBondContact CZ3-O 3.32Å; W1926-L1932 VanDerWaalsContact CE3-C 3.41Å; W1926-L1932 VanDerWaalsContact CZ3-C 3.46Å; W1926-L1933 HydrophobicContact CE3-CB 3.96Å; W1926-L1933 HydrophobicContact CZ3-CB 4.09Å; W1926-V1947 HydrophobicContact CH2-CB 3.83Å; W1926-V1947 HydrophobicContact CH2-CG1 4.25Å; W1926-V1947 HydrophobicContact CH2-CG2 4.17Å; W1926-V1947 HydrophobicContact CZ3-CB 3.88Å; W1926-V1947 HydrophobicContact CZ3-CG1 4.48Å; W1926-V1947 HydrophobicContact CZ3-CG2 3.69Å; W1926-F1952 HydrophobicContact CH2-CD1 4.38Å; W1926-F1952 HydrophobicContact CH2-CE1 4.44Å; W1926-F1952 HydrophobicContact CZ2-CD1 4.19Å; W1926-F1952 AromaticContact CZ2-CE1 3.82Å; W1926-F1952 HydrophobicContact CZ2-CE1 3.82Å; W1926-F1983 WeakPolarHBondContact O-CD2 3.22Å
1927	H	86.1	Confident	86.6	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	99	171.2	-168.5	-48.7	0	0	0	110.3	K1929 R1930 R1931 L1932 F1983 D2003	H1927-K1929 PolarHBondContact ND1-N 2.73Å; H1927-K1929 PolarHBondContact O-N 3.11Å; H1927-R1930 PolarHBondContact ND1-N 3.01Å; H1927-R1930 PolarHBondContact O-N 3.09Å; H1927-R1931 WeakPolarHBondContact O-CA 3.35Å; H1927-R1931 PolarHBondContact O-N 3.2Å; H1927-R1931 VanDerWaalsContact O-N 3.08Å; H1927-L1932 HydrophobicContact CB-CB 4.25Å; H1927-L1932 WeakPolarHBondContact CB-O 3.36Å; H1927-L1932 PolarHBondContact N-O 3.1Å; H1927-L1932 PolarHBondContact O-N 3.25Å; H1927-L1932 VanDerWaalsContact O-N 3.14Å; H1927-F1983 HydrophobicContact CB-CD1 4.29Å; H1927-F1983 HydrophobicContact CB-CD2 3.88Å; H1927-F1983 HydrophobicContact CB-CE1 4.29Å; H1927-F1983 HydrophobicContact CB-CE2 3.88Å; H1927-F1983 HydrophobicContact CB-CG 4.1Å; H1927-F1983 HydrophobicContact CB-CZ 4.1Å; H1927-F1983 AromaticContact CD2-CD1 3.78Å; H1927-F1983 AromaticContact CD2-CG 3.99Å; H1927-D2003 IonicContact NE2-OD1 3.49Å; H1927-D2003 PolarHBondContact NE2-OD1 2.72Å
1928	P	77.2	Confident	86.8	Confident	6.6 Å²	6.6	33.1 Å²	33.1	4%	0.043	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-46.6	-171.6	22.7	-35.8	0	0	0	114.6	R1816 V1860 W1926 R1930 R1931 L1985 Y1988	R1816-P1928 VanDerWaalsContact NH2-CG 3.3Å; V1860-P1928 HydrophobicContact CG2-CB 3.77Å; V1860-P1928 HydrophobicContact CG2-CG 4.29Å; W1926-P1928 WeakPolarHBondContact O-CD 3.21Å; P1928-R1930 VanDerWaalsContact C-N 3.3Å; P1928-R1930 PolarHBondContact O-N 3.24Å; P1928-R1930 VanDerWaalsContact O-N 3.16Å; P1928-R1931 PolarHBondContact O-N 2.97Å; P1928-L1985 HydrophobicContact CG-CD2 4.36Å; P1928-Y1988 WeakPolarHBondContact CG-OH 3.39Å
1929	K	74.1	Confident	87	Confident	130.2 Å²	130.2	27.8 Å²	27.8	57%	0.566	13%	0.127	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-37.7	-176.2	-175	-179	179.8	179.5	0	113.3	H1927 P1986 E1993	H1927-K1929 PolarHBondContact ND1-N 2.73Å; H1927-K1929 PolarHBondContact O-N 3.11Å; K1929-P1986 HydrophobicContact CD-CG 4.28Å; K1929-E1993 IonicContact NZ-OE1 3.93Å
1930	R	74.5	Confident	87.1	Confident	93.4 Å²	93.4	23.8 Å²	23.8	35%	0.352	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-4.7	178.2	-69.1	-174.4	174.3	-107.4	-2.5	113	H1927 P1928 L1932 D2003 L2019 I2020	H1927-R1930 PolarHBondContact ND1-N 3.01Å; H1927-R1930 PolarHBondContact O-N 3.09Å; P1928-R1930 VanDerWaalsContact C-N 3.3Å; P1928-R1930 PolarHBondContact O-N 3.24Å; P1928-R1930 VanDerWaalsContact O-N 3.16Å; R1930-L1932 HydrophobicContact CB-CB 4.21Å; R1930-L1932 HydrophobicContact CB-CD1 3.66Å; R1930-L1932 HydrophobicContact CB-CG 3.85Å; R1930-L1932 HydrophobicContact CG-CD1 4.37Å; R1930-L1932 PolarHBondContact O-N 3.01Å; R1930-D2003 IonicContact CZ-OD2 3.35Å; R1930-D2003 IonicContact NE-OD2 3.14Å; R1930-D2003 PolarHBondContact NE-OD2 3.28Å; R1930-D2003 IonicContact NH2-OD2 3.03Å; R1930-D2003 PolarHBondContact NH2-OD2 3.37Å; R1930-L2019 PolarHBondContact NH1-O 2.73Å; R1930-I2020 VanDerWaalsContact NH2-CG1 3.28Å
1931	R	80	Confident	87.2	Confident	80.8 Å²	80.8	23.7 Å²	23.7	31%	0.305	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.6	40.8	-171.6	-58.4	-177.6	-178.1	-169.3	0.7	112.7	E1859 W1926 H1927 P1928 V1947 F1952 G1953	E1859-R1931 IonicContact OE1-CZ 3.04Å; E1859-R1931 IonicContact OE1-NE 2.79Å; E1859-R1931 IonicContact OE1-NH1 2.9Å; E1859-R1931 PolarHBondContact OE1-NH1 3.02Å; E1859-R1931 IonicContact OE1-NH2 3.51Å; E1859-R1931 PolarHBondContact OE1-NH2 2.86Å; W1926-R1931 HydrophobicContact CH2-CB 3.83Å; W1926-R1931 HydrophobicContact CH2-CG 4.47Å; W1926-R1931 WeakPolarHBondContact CH2-O 3.05Å; W1926-R1931 HydrophobicContact CZ2-CB 4.32Å; W1926-R1931 WeakPolarHBondContact CZ3-O 3.32Å; H1927-R1931 WeakPolarHBondContact O-CA 3.35Å; H1927-R1931 PolarHBondContact O-N 3.2Å; H1927-R1931 VanDerWaalsContact O-N 3.08Å; P1928-R1931 PolarHBondContact O-N 2.97Å; R1931-V1947 PolarHBondContact O-N 2.95Å; R1931-V1947 VanDerWaalsContact O-N 3.1Å; R1931-F1952 PolarHBondContact NH1-O 3.03Å; R1931-F1952 VanDerWaalsContact NH1-O 3.14Å; R1931-G1953 PolarHBondContact NH1-O 2.76Å; R1931-G1953 PolarHBondContact NH2-O 3.18Å; R1931-G1953 VanDerWaalsContact NH2-O 3.15Å
1932	L	86.2	Confident	87.3	Confident	14.6 Å²	14.6	23.7 Å²	23.7	8%	0.076	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	123.8	-176	-107.9	137.2	0	0	0	110.6	W1926 H1927 R1930 L1944 W1945 E1946 F1983 L2019	W1926-L1932 VanDerWaalsContact CE3-C 3.41Å; W1926-L1932 VanDerWaalsContact CZ3-C 3.46Å; H1927-L1932 HydrophobicContact CB-CB 4.25Å; H1927-L1932 WeakPolarHBondContact CB-O 3.36Å; H1927-L1932 PolarHBondContact N-O 3.1Å; H1927-L1932 PolarHBondContact O-N 3.25Å; H1927-L1932 VanDerWaalsContact O-N 3.14Å; R1930-L1932 HydrophobicContact CB-CB 4.21Å; R1930-L1932 HydrophobicContact CB-CD1 3.66Å; R1930-L1932 HydrophobicContact CB-CG 3.85Å; R1930-L1932 HydrophobicContact CG-CD1 4.37Å; R1930-L1932 PolarHBondContact O-N 3.01Å; L1932-L1944 HydrophobicContact CD1-CB 4.29Å; L1932-L1944 HydrophobicContact CD2-CB 4.33Å; L1932-L1944 HydrophobicContact CD2-CD1 4.3Å; L1932-L1944 HydrophobicContact CD2-CD2 4.11Å; L1932-L1944 HydrophobicContact CD2-CG 4.46Å; L1932-L1944 HydrophobicContact CG-CB 4.48Å; L1932-W1945 WeakPolarHBondContact CA-O 3.34Å; L1932-E1946 HydrophobicContact CD2-CB 4.26Å; L1932-E1946 HydrophobicContact CD2-CG 4.48Å; L1932-F1983 HydrophobicContact CD2-CE1 4.38Å; L1932-F1983 HydrophobicContact CD2-CZ 4.18Å; L1932-L2019 HydrophobicContact CD2-CD2 3.98Å
1933	L	89.6	Confident	87.4	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	131.7	169.7	172.9	71.7	0	0	0	108.4	L1857 V1878 L1913 A1925 W1926 T1935 L1944 W1945 V1947	L1857-L1933 HydrophobicContact CD2-CD1 4.38Å; V1878-L1933 HydrophobicContact CB-CD1 4.48Å; V1878-L1933 HydrophobicContact CG1-CD1 4.38Å; V1878-L1933 HydrophobicContact CG1-CD2 4.13Å; V1878-L1933 HydrophobicContact CG2-CD1 4.12Å; V1878-L1933 HydrophobicContact CG2-CD2 4.03Å; L1913-L1933 HydrophobicContact CD1-CD2 4.22Å; A1925-L1933 CarbonylContact O-C 3.52Å; A1925-L1933 WeakPolarHBondContact O-CA 3.3Å; A1925-L1933 WeakPolarHBondContact O-CD1 3.43Å; W1926-L1933 HydrophobicContact CE3-CB 3.96Å; W1926-L1933 HydrophobicContact CZ3-CB 4.09Å; L1933-T1935 HydrophobicContact CD2-CG2 4.44Å; L1933-T1935 HydrophobicContact CG-CG2 4.33Å; L1933-L1944 CarbonylContact O-C 3.51Å; L1933-L1944 WeakPolarHBondContact O-CA 3.34Å; L1933-W1945 HydrophobicContact CB-CB 4.19Å; L1933-W1945 HydrophobicContact CD2-CB 4.49Å; L1933-W1945 HydrophobicContact CD2-CG 4.43Å; L1933-W1945 PolarHBondContact N-O 2.87Å; L1933-W1945 VanDerWaalsContact O-CD1 3.3Å; L1933-W1945 PolarHBondContact O-N 3.15Å; L1933-V1947 HydrophobicContact CB-CG2 3.96Å; L1933-V1947 HydrophobicContact CD2-CG2 4.48Å
1934	A	91.4	Very high	87.4	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	138	169.9	0	0	0	0	0	109.9	S1924 A1925 C1943 L1944 I1981 F1983	S1924-A1934 CarbonylContact C-O 3.51Å; S1924-A1934 VanDerWaalsContact CA-O 3.27Å; S1924-A1934 WeakPolarHBondContact CA-O 3.28Å; A1925-A1934 PolarHBondContact N-O 3.02Å; A1925-A1934 PolarHBondContact O-N 3.22Å; A1934-C1943 CarbonylContact C-O 3.49Å; A1934-C1943 WeakPolarHBondContact CA-O 3.36Å; A1934-L1944 HydrophobicContact CB-CD2 3.58Å; A1934-I1981 HydrophobicContact CB-CG2 4.21Å; A1934-F1983 HydrophobicContact CB-CE1 4.47Å; A1934-F1983 HydrophobicContact CB-CE2 3.77Å; A1934-F1983 HydrophobicContact CB-CZ 3.57Å; A1934-F1983 VanDerWaalsContact CB-CZ 3.48Å
1935	T	92.5	Very high	87.2	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	138.6	171.3	60.6	0	0	0	0	110.6	I1886 H1917 V1923 L1933 I1942 C1943 W1945	I1886-T1935 HydrophobicContact CD1-CG2 3.86Å; I1886-T1935 HydrophobicContact CG1-CG2 4.4Å; I1886-T1935 HydrophobicContact CG2-CG2 4.5Å; H1917-T1935 PolarHBondContact NE2-OG1 3.08Å; V1923-T1935 CarbonylContact O-C 3.53Å; V1923-T1935 VanDerWaalsContact O-CA 3.29Å; V1923-T1935 WeakPolarHBondContact O-CA 3.35Å; L1933-T1935 HydrophobicContact CD2-CG2 4.44Å; L1933-T1935 HydrophobicContact CG-CG2 4.33Å; T1935-I1942 CarbonylContact O-C 3.57Å; T1935-I1942 VanDerWaalsContact O-CA 3.3Å; T1935-I1942 WeakPolarHBondContact O-CA 3.36Å; T1935-C1943 PolarHBondContact N-O 3.12Å; T1935-C1943 PolarHBondContact O-N 3.17Å; T1935-W1945 PolarHBondContact OG1-NE1 3.07Å
1936	G	90.7	Very high	86.8	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	145.7	177.1	0	0	0	0	0	111.1	V1921 T1922 V1923 L1941	V1921-G1936 CarbonylContact C-O 3.57Å; V1921-G1936 WeakPolarHBondContact CG1-O 3.34Å; T1922-G1936 PolarHBondContact N-O 3.2Å; T1922-G1936 PolarHBondContact OG1-O 3.06Å; V1923-G1936 PolarHBondContact N-O 3.14Å; V1923-G1936 PolarHBondContact O-N 3.13Å; G1936-L1941 WeakPolarHBondContact CA-O 3.45Å
1937	G	89.8	Confident	86.2	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	172.7	-179.3	0	0	0	0	0	114.7	P1920 D1939 C1940 L1941 I1978	P1920-G1937 VanDerWaalsContact O-CA 3.25Å; P1920-G1937 WeakPolarHBondContact O-CA 3.34Å; G1937-D1939 WeakPolarHBondContact CA-OD1 3.29Å; G1937-D1939 PolarHBondContact O-N 2.98Å; G1937-C1940 PolarHBondContact O-N 3.08Å; G1937-C1940 VanDerWaalsContact O-N 3.17Å; G1937-L1941 PolarHBondContact N-O 3.1Å; G1937-I1978 PolarHBondContact O-N 3.19Å
1938	L	89	Confident	85.3	Confident	27.4 Å²	27.4	27 Å²	27	14%	0.143	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-2.2	173.9	-60.9	-177.5	0	0	0	113.4	K1919 P1920 T1922 C1940 S1977 W2010 L2093	K1919-L1938 HydrophobicContact CB-CB 4.13Å; K1919-L1938 VanDerWaalsContact CD-C 3.44Å; K1919-L1938 HydrophobicContact CD-CB 4.23Å; K1919-L1938 VanDerWaalsContact CD-O 3.25Å; K1919-L1938 WeakPolarHBondContact CD-O 3.45Å; K1919-L1938 PolarHBondContact NZ-O 3.03Å; K1919-L1938 VanDerWaalsContact NZ-O 3.12Å; P1920-L1938 HydrophobicContact CB-CD1 3.93Å; P1920-L1938 HydrophobicContact CB-CG 4.26Å; P1920-L1938 HydrophobicContact CG-CD1 4.03Å; P1920-L1938 PolarHBondContact O-N 3.31Å; T1922-L1938 HydrophobicContact CG2-CD1 4.45Å; T1922-L1938 HydrophobicContact CG2-CD2 3.67Å; T1922-L1938 HydrophobicContact CG2-CG 3.72Å; L1938-C1940 VanDerWaalsContact C-N 3.29Å; L1938-C1940 PolarHBondContact O-N 3.06Å; L1938-S1977 PolarHBondContact O-OG 2.99Å; L1938-W2010 HydrophobicContact CD1-CZ2 4.47Å; L1938-W2010 HydrophobicContact CD2-CH2 4.49Å; L1938-W2010 HydrophobicContact CD2-CZ2 3.72Å; L1938-L2093 HydrophobicContact CD1-CD2 3.82Å
1939	D	89.3	Confident	84.5	Confident	28.2 Å²	28.2	33.2 Å²	33.2	15%	0.151	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	6.6	169.6	52.5	3.3	0	0	0	113.3	H1917 N1918 K1919 G1937 L1941	H1917-D1939 WeakPolarHBondContact CA-OD2 3.37Å; H1917-D1939 VanDerWaalsContact CB-OD2 3.3Å; H1917-D1939 WeakPolarHBondContact CB-OD2 3.36Å; H1917-D1939 IonicContact CE1-OD1 3.18Å; H1917-D1939 IonicContact CG-OD2 3.19Å; H1917-D1939 IonicContact ND1-OD1 3.55Å; H1917-D1939 PolarHBondContact ND1-OD1 3.21Å; H1917-D1939 VanDerWaalsContact ND1-OD1 3.11Å; H1917-D1939 IonicContact ND1-OD2 3.39Å; H1917-D1939 PolarHBondContact ND1-OD2 3.2Å; N1918-D1939 PolarHBondContact N-OD2 3.05Å; N1918-D1939 VanDerWaalsContact N-OD2 3.11Å; K1919-D1939 HydrophobicContact CB-CB 3.92Å; K1919-D1939 HydrophobicContact CD-CB 4.28Å; K1919-D1939 HydrophobicContact CG-CB 4.22Å; G1937-D1939 WeakPolarHBondContact CA-OD1 3.29Å; G1937-D1939 PolarHBondContact O-N 2.98Å; D1939-L1941 HydrophobicContact CB-CB 4.43Å; D1939-L1941 HydrophobicContact CB-CD1 4.23Å; D1939-L1941 HydrophobicContact CB-CG 4.25Å; D1939-L1941 PolarHBondContact O-N 3.17Å; D1939-L1941 WeakPolarHBondContact OD1-CB 3.4Å; D1939-L1941 PolarHBondContact OD1-N 3.15Å; D1939-L1941 WeakPolarHBondContact OD2-CD1 3.49Å
1940	C	90.8	Very high	83.9	Confident	28.8 Å²	28.8	28.3 Å²	28.3	20%	0.195	14%	0.139	C	C	.	.	S	Bend	trans	61.6	23.3	-179.2	-43.3	0	0	0	0	112.9	G1937 L1938 I1974 S1976 S1977	G1937-C1940 PolarHBondContact O-N 3.08Å; G1937-C1940 VanDerWaalsContact O-N 3.17Å; L1938-C1940 VanDerWaalsContact C-N 3.29Å; L1938-C1940 PolarHBondContact O-N 3.06Å; C1940-I1974 WeakPolarHBondContact CB-O 3.26Å; C1940-I1974 PolarHBondContact O-N 3.05Å; C1940-S1976 WeakPolarHBondContact CB-O 3.33Å; C1940-S1976 VanDerWaalsContact SG-C 3.53Å; C1940-S1977 PolarHBondContact SG-N 2.83Å
1941	L	90.9	Very high	82.9	Confident	26 Å²	26	25.1 Å²	25.1	14%	0.136	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	137.1	-179.6	-88.7	159.9	0	0	0	110.5	H1917 G1936 G1937 D1939 C1943 K1971 N1973 I1978	H1917-L1941 PolarHBondContact CE1-O 3.08Å; H1917-L1941 VanDerWaalsContact CE1-O 3.31Å; G1936-L1941 WeakPolarHBondContact CA-O 3.45Å; G1937-L1941 PolarHBondContact N-O 3.1Å; D1939-L1941 HydrophobicContact CB-CB 4.43Å; D1939-L1941 HydrophobicContact CB-CD1 4.23Å; D1939-L1941 HydrophobicContact CB-CG 4.25Å; D1939-L1941 PolarHBondContact O-N 3.17Å; D1939-L1941 WeakPolarHBondContact OD1-CB 3.4Å; D1939-L1941 PolarHBondContact OD1-N 3.15Å; D1939-L1941 WeakPolarHBondContact OD2-CD1 3.49Å; L1941-C1943 WeakPolarHBondContact CD2-SG 3.09Å; L1941-K1971 HydrophobicContact CD2-CB 4.27Å; L1941-K1971 HydrophobicContact CD2-CD 4.27Å; L1941-K1971 HydrophobicContact CD2-CG 4.1Å; L1941-N1973 WeakPolarHBondContact CD1-OD1 3.4Å; L1941-N1973 HydrophobicContact CD2-CB 4.33Å; L1941-N1973 VanDerWaalsContact CD2-CG 3.45Å; L1941-N1973 WeakPolarHBondContact CD2-OD1 3.32Å; L1941-N1973 WeakPolarHBondContact CG-OD1 3.24Å; L1941-I1978 VanDerWaalsContact O-CD1 3.28Å; L1941-I1978 WeakPolarHBondContact O-CD1 3.2Å
1942	I	90.8	Very high	81.8	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	123.3	161.8	-55.8	171.4	0	0	0	108	T1935 L1944 K1971 L1972 I1974 I1978 I1981 L2005 V2007 Y2017	T1935-I1942 CarbonylContact O-C 3.57Å; T1935-I1942 VanDerWaalsContact O-CA 3.3Å; T1935-I1942 WeakPolarHBondContact O-CA 3.36Å; I1942-L1944 HydrophobicContact CG2-CD2 4.24Å; I1942-L1944 HydrophobicContact CG2-CG 4.46Å; I1942-K1971 CarbonylContact O-C 3.53Å; I1942-K1971 VanDerWaalsContact O-CA 3.29Å; I1942-K1971 WeakPolarHBondContact O-CA 3.43Å; I1942-L1972 HydrophobicContact CB-CB 4.24Å; I1942-L1972 HydrophobicContact CD1-CB 4.46Å; I1942-L1972 PolarHBondContact N-O 3.15Å; I1942-L1972 PolarHBondContact O-N 3.26Å; I1942-I1974 HydrophobicContact CD1-CD1 3.46Å; I1942-I1974 VanDerWaalsContact CD1-CD1 3.44Å; I1942-I1974 HydrophobicContact CD1-CG1 4.38Å; I1942-I1974 HydrophobicContact CG1-CD1 4.1Å; I1942-I1978 HydrophobicContact CD1-CD1 4.34Å; I1942-I1978 HydrophobicContact CG1-CD1 3.5Å; I1942-I1978 VanDerWaalsContact CG1-CD1 3.48Å; I1942-I1981 HydrophobicContact CD1-CD1 4.21Å; I1942-I1981 HydrophobicContact CG1-CD1 4.21Å; I1942-I1981 HydrophobicContact CG2-CD1 4.25Å; I1942-L2005 HydrophobicContact CD1-CD2 4.39Å; I1942-L2005 HydrophobicContact CG2-CD2 4.36Å; I1942-V2007 HydrophobicContact CD1-CB 4.37Å; I1942-V2007 HydrophobicContact CD1-CG1 4Å; I1942-V2007 HydrophobicContact CD1-CG2 3.5Å; I1942-V2007 VanDerWaalsContact CD1-CG2 3.45Å; I1942-Y2017 HydrophobicContact CD1-CE2 4.41Å
1943	C	90.7	Very high	80	Confident	0 Å²	0	23 Å²	23	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	130.2	169.5	-66.3	0	0	0	0	109.7	H1917 A1934 T1935 L1941 W1945 P1968	H1917-C1943 PolarHBondContact NE2-SG 3.21Å; A1934-C1943 CarbonylContact C-O 3.49Å; A1934-C1943 WeakPolarHBondContact CA-O 3.36Å; T1935-C1943 PolarHBondContact N-O 3.12Å; T1935-C1943 PolarHBondContact O-N 3.17Å; L1941-C1943 WeakPolarHBondContact CD2-SG 3.09Å; C1943-W1945 HydrophobicContact CB-CD2 4.48Å; C1943-W1945 HydrophobicContact CB-CH2 4.46Å; C1943-W1945 HydrophobicContact CB-CZ2 3.62Å; C1943-W1945 PolarHBondContact O-NE1 2.81Å; C1943-P1968 HydrophobicContact CB-CB 4.04Å
1944	L	89.5	Confident	78	Confident	0.4 Å²	0.4	26.1 Å²	26.1	0%	0.002	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	129.3	171	-61.3	178.7	0	0	0	108.9	L1932 L1933 A1934 I1942 P1968 S1969 K1970 F1983 L2005 L2019 M2022	L1932-L1944 HydrophobicContact CD1-CB 4.29Å; L1932-L1944 HydrophobicContact CD2-CB 4.33Å; L1932-L1944 HydrophobicContact CD2-CD1 4.3Å; L1932-L1944 HydrophobicContact CD2-CD2 4.11Å; L1932-L1944 HydrophobicContact CD2-CG 4.46Å; L1932-L1944 HydrophobicContact CG-CB 4.48Å; L1933-L1944 CarbonylContact O-C 3.51Å; L1933-L1944 WeakPolarHBondContact O-CA 3.34Å; A1934-L1944 HydrophobicContact CB-CD2 3.58Å; I1942-L1944 HydrophobicContact CG2-CD2 4.24Å; I1942-L1944 HydrophobicContact CG2-CG 4.46Å; L1944-P1968 CarbonylContact O-C 3.53Å; L1944-P1968 VanDerWaalsContact O-CA 3.26Å; L1944-P1968 WeakPolarHBondContact O-CA 3.31Å; L1944-P1968 WeakPolarHBondContact O-CB 3.45Å; L1944-S1969 PolarHBondContact O-N 3.2Å; L1944-S1969 PolarHBondContact O-OG 2.95Å; L1944-S1969 VanDerWaalsContact O-OG 3.12Å; L1944-K1970 HydrophobicContact CB-CB 4.36Å; L1944-K1970 HydrophobicContact CD1-CB 4.33Å; L1944-K1970 PolarHBondContact N-O 3.12Å; L1944-K1970 PolarHBondContact O-N 2.89Å; L1944-F1983 HydrophobicContact CD2-CZ 4.41Å; L1944-L2005 HydrophobicContact CD2-CD2 4.38Å; L1944-L2019 HydrophobicContact CD1-CD2 4.37Å; L1944-M2022 HydrophobicContact CD1-CE 3.4Å; L1944-M2022 HydrophobicContact CD1-SD 3.74Å
1945	W	87.5	Confident	75.5	Confident	0.8 Å²	0.8	33.7 Å²	33.7	0%	0.003	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	126	-175.6	-44	85.3	0	0	0	109.4	I1886 L1913 Y1916 L1932 L1933 T1935 C1943 V1947 P1968	I1886-W1945 HydrophobicContact CD1-CZ2 3.97Å; L1913-W1945 HydrophobicContact CB-CE3 4.45Å; L1913-W1945 HydrophobicContact CB-CH2 4.14Å; L1913-W1945 HydrophobicContact CB-CZ2 4.41Å; L1913-W1945 HydrophobicContact CB-CZ3 4.15Å; L1913-W1945 HydrophobicContact CD1-CD2 4.04Å; L1913-W1945 HydrophobicContact CD1-CE3 4.11Å; L1913-W1945 HydrophobicContact CD1-CG 4.26Å; L1913-W1945 HydrophobicContact CD1-CZ3 4.43Å; L1913-W1945 HydrophobicContact CD2-CE3 4.16Å; L1913-W1945 HydrophobicContact CD2-CZ3 4.21Å; L1913-W1945 HydrophobicContact CG-CE3 4.42Å; L1913-W1945 HydrophobicContact CG-CZ3 4.44Å; Y1916-W1945 AromaticContact CD2-CH2 3.43Å; Y1916-W1945 HydrophobicContact CD2-CH2 3.43Å; Y1916-W1945 VanDerWaalsContact CD2-CH2 3.44Å; Y1916-W1945 AromaticContact CD2-CZ3 3.79Å; Y1916-W1945 HydrophobicContact CD2-CZ3 3.79Å; Y1916-W1945 HydrophobicContact CE2-CH2 4.15Å; Y1916-W1945 AromaticContact CE2-CZ3 3.98Å; Y1916-W1945 HydrophobicContact CE2-CZ3 4.03Å; Y1916-W1945 AromaticContact CG-CH2 3.84Å; Y1916-W1945 HydrophobicContact CG-CH2 3.84Å; Y1916-W1945 HydrophobicContact CG-CZ3 4.41Å; L1932-W1945 WeakPolarHBondContact CA-O 3.34Å; L1933-W1945 HydrophobicContact CB-CB 4.19Å; L1933-W1945 HydrophobicContact CD2-CB 4.49Å; L1933-W1945 HydrophobicContact CD2-CG 4.43Å; L1933-W1945 PolarHBondContact N-O 2.87Å; L1933-W1945 VanDerWaalsContact O-CD1 3.3Å; L1933-W1945 PolarHBondContact O-N 3.15Å; T1935-W1945 PolarHBondContact OG1-NE1 3.07Å; C1943-W1945 HydrophobicContact CB-CD2 4.48Å; C1943-W1945 HydrophobicContact CB-CH2 4.46Å; C1943-W1945 HydrophobicContact CB-CZ2 3.62Å; C1943-W1945 PolarHBondContact O-NE1 2.81Å; W1945-V1947 PolarHBondContact O-N 3.19Å; W1945-P1968 HydrophobicContact CD2-CB 4.21Å; W1945-P1968 HydrophobicContact CE3-CB 3.96Å; W1945-P1968 HydrophobicContact CH2-CB 4.24Å; W1945-P1968 HydrophobicContact CH2-CG 4.37Å; W1945-P1968 HydrophobicContact CZ2-CB 4.44Å; W1945-P1968 HydrophobicContact CZ3-CB 3.99Å; W1945-P1968 HydrophobicContact CZ3-CG 4.23Å
1946	E	83.3	Confident	72.7	Confident	98.4 Å²	98.4	42.3 Å²	42.3	46%	0.46	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	104	174.5	-168.4	167.7	177.4	0	0	108.7	L1932 G1948	L1932-E1946 HydrophobicContact CD2-CB 4.26Å; L1932-E1946 HydrophobicContact CD2-CG 4.48Å; E1946-G1948 VanDerWaalsContact C-N 3.29Å; E1946-G1948 PolarHBondContact O-N 3.11Å
1947	V	77.3	Confident	70	Confident	1.4 Å²	1.4	48.4 Å²	48.4	1%	0.008	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-80.7	-11.8	-172.8	176.6	0	0	0	0	111.4	L1857 W1876 W1926 R1931 L1933 W1945 E1949 L1950 F1952	L1857-V1947 HydrophobicContact CD1-CG1 4.36Å; W1876-V1947 HydrophobicContact CE3-CG1 4.17Å; W1876-V1947 HydrophobicContact CZ3-CG1 3.75Å; W1926-V1947 HydrophobicContact CH2-CB 3.83Å; W1926-V1947 HydrophobicContact CH2-CG1 4.25Å; W1926-V1947 HydrophobicContact CH2-CG2 4.17Å; W1926-V1947 HydrophobicContact CZ3-CB 3.88Å; W1926-V1947 HydrophobicContact CZ3-CG1 4.48Å; W1926-V1947 HydrophobicContact CZ3-CG2 3.69Å; R1931-V1947 PolarHBondContact O-N 2.95Å; R1931-V1947 VanDerWaalsContact O-N 3.1Å; L1933-V1947 HydrophobicContact CB-CG2 3.96Å; L1933-V1947 HydrophobicContact CD2-CG2 4.48Å; W1945-V1947 PolarHBondContact O-N 3.19Å; V1947-E1949 PolarHBondContact O-N 2.95Å; V1947-E1949 VanDerWaalsContact O-N 3.15Å; V1947-L1950 HydrophobicContact CG1-CD1 4.11Å; V1947-L1950 WeakPolarHBondContact O-CB 3.34Å; V1947-L1950 PolarHBondContact O-N 2.99Å; V1947-L1950 VanDerWaalsContact O-N 3.13Å; V1947-F1952 HydrophobicContact CG1-CB 4.07Å; V1947-F1952 HydrophobicContact CG1-CG 4.41Å
1948	G	66	Low	67.4	Low	29.2 Å²	29.2	52.3 Å²	52.3	30%	0.301	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-55.2	-31.7	174.6	0	0	0	0	0	113.8	E1946 L1950 G1951	E1946-G1948 VanDerWaalsContact C-N 3.29Å; E1946-G1948 PolarHBondContact O-N 3.11Å; G1948-L1950 PolarHBondContact O-N 2.94Å; G1948-G1951 PolarHBondContact O-N 3.1Å; G1948-G1951 VanDerWaalsContact O-N 3.13Å
1949	E	61	Low	64.7	Low	137.8 Å²	137.8	57.9 Å²	57.9	64%	0.644	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-64.8	-20.5	177.8	-65.5	-168.8	161.7	0	0	113.8	V1947 G1951 I1966	V1947-E1949 PolarHBondContact O-N 2.95Å; V1947-E1949 VanDerWaalsContact O-N 3.15Å; E1949-G1951 VanDerWaalsContact C-N 3.26Å; E1949-G1951 PolarHBondContact O-N 3.29Å; E1949-G1951 VanDerWaalsContact O-N 3.13Å; E1949-I1966 WeakPolarHBondContact OE2-CG2 3.35Å
1950	L	61.2	Low	62.3	Low	27.6 Å²	27.6	60.1 Å²	60.1	15%	0.145	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-75.9	-2.2	175	-76.8	166.3	0	0	0	113.6	W1876 I1888 C1911 V1947 G1948 Y1955 K1964 I1966	W1876-L1950 HydrophobicContact CH2-CB 4.03Å; W1876-L1950 HydrophobicContact CH2-CD1 4.5Å; W1876-L1950 HydrophobicContact CZ3-CB 4.08Å; W1876-L1950 HydrophobicContact CZ3-CD1 4.1Å; I1888-L1950 HydrophobicContact CD1-CD1 4.16Å; C1911-L1950 HydrophobicContact CB-CD1 4.3Å; C1911-L1950 HydrophobicContact CB-CD2 4.47Å; V1947-L1950 HydrophobicContact CG1-CD1 4.11Å; V1947-L1950 WeakPolarHBondContact O-CB 3.34Å; V1947-L1950 PolarHBondContact O-N 2.99Å; V1947-L1950 VanDerWaalsContact O-N 3.13Å; G1948-L1950 PolarHBondContact O-N 2.94Å; L1950-Y1955 VanDerWaalsContact O-CD2 3.32Å; L1950-Y1955 WeakPolarHBondContact O-CD2 3.34Å; L1950-Y1955 WeakPolarHBondContact O-CE2 3.33Å; L1950-K1964 HydrophobicContact CD2-CB 4.26Å; L1950-I1966 HydrophobicContact CD1-CD1 3.41Å; L1950-I1966 HydrophobicContact CD1-CG1 4.4Å; L1950-I1966 HydrophobicContact CD2-CD1 3.87Å; L1950-I1966 HydrophobicContact CD2-CG1 3.91Å; L1950-I1966 HydrophobicContact CG-CD1 3.41Å; L1950-I1966 VanDerWaalsContact CG-CD1 3.46Å; L1950-I1966 HydrophobicContact CG-CG1 3.97Å
1951	G	54	Low	59.8	Low	26 Å²	26	65.1 Å²	65.1	27%	0.268	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.6	39.3	178.1	0	0	0	0	0	113.9	G1948 E1949 G1953 S1954 Y1955	G1948-G1951 PolarHBondContact O-N 3.1Å; G1948-G1951 VanDerWaalsContact O-N 3.13Å; E1949-G1951 VanDerWaalsContact C-N 3.26Å; E1949-G1951 PolarHBondContact O-N 3.29Å; E1949-G1951 VanDerWaalsContact O-N 3.13Å; G1951-G1953 PolarHBondContact O-N 3.21Å; G1951-S1954 WeakPolarHBondContact O-CB 3.47Å; G1951-S1954 PolarHBondContact O-N 3.21Å; G1951-S1954 VanDerWaalsContact O-N 3.11Å; G1951-S1954 PolarHBondContact O-OG 3.37Å; G1951-Y1955 WeakPolarHBondContact O-CD2 3.43Å
1952	F	55.4	Low	57.4	Low	21.2 Å²	21.2	66.4 Å²	66.4	9%	0.093	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	112.4	171.2	-132	-102.7	0	0	0	109.7	L1857 E1859 Q1874 W1876 W1926 R1931 V1947	L1857-F1952 HydrophobicContact CB-CE2 4.24Å; L1857-F1952 HydrophobicContact CB-CZ 4.11Å; L1857-F1952 WeakPolarHBondContact O-CZ 3.42Å; E1859-F1952 HydrophobicContact CB-CE1 4.16Å; E1859-F1952 HydrophobicContact CB-CZ 4.36Å; E1859-F1952 WeakPolarHBondContact OE2-CD1 3.17Å; Q1874-F1952 HydrophobicContact CB-CE2 4.42Å; W1876-F1952 HydrophobicContact CB-CE2 4.44Å; W1876-F1952 AromaticContact CD2-CD2 3.47Å; W1876-F1952 HydrophobicContact CD2-CD2 3.47Å; W1876-F1952 VanDerWaalsContact CD2-CD2 3.47Å; W1876-F1952 AromaticContact CD2-CE2 3.82Å; W1876-F1952 HydrophobicContact CD2-CE2 3.82Å; W1876-F1952 AromaticContact CE2-CD2 3.68Å; W1876-F1952 HydrophobicContact CE3-CB 4.34Å; W1876-F1952 AromaticContact CE3-CD2 3.4Å; W1876-F1952 HydrophobicContact CE3-CD2 3.4Å; W1876-F1952 VanDerWaalsContact CE3-CD2 3.43Å; W1876-F1952 HydrophobicContact CE3-CE1 4.3Å; W1876-F1952 HydrophobicContact CE3-CE2 4.03Å; W1876-F1952 HydrophobicContact CE3-CG 4.19Å; W1876-F1952 HydrophobicContact CE3-CZ 4.26Å; W1876-F1952 HydrophobicContact CG-CD2 4.2Å; W1876-F1952 AromaticContact CG-CE2 3.97Å; W1876-F1952 HydrophobicContact CG-CE2 4.05Å; W1876-F1952 HydrophobicContact CH2-CB 3.68Å; W1876-F1952 AromaticContact CH2-CD1 3.94Å; W1876-F1952 HydrophobicContact CH2-CD1 3.94Å; W1876-F1952 AromaticContact CH2-CD2 3.79Å; W1876-F1952 HydrophobicContact CH2-CD2 3.89Å; W1876-F1952 AromaticContact CH2-CE1 3.69Å; W1876-F1952 HydrophobicContact CH2-CE1 3.69Å; W1876-F1952 HydrophobicContact CH2-CE2 4.14Å; W1876-F1952 HydrophobicContact CH2-CG 4.25Å; W1876-F1952 AromaticContact CH2-CZ 3.8Å; W1876-F1952 HydrophobicContact CH2-CZ 3.8Å; W1876-F1952 HydrophobicContact CZ2-CB 4.38Å; W1876-F1952 HydrophobicContact CZ2-CD1 4.21Å; W1876-F1952 AromaticContact CZ2-CD2 3.84Å; W1876-F1952 HydrophobicContact CZ2-CD2 3.84Å; W1876-F1952 HydrophobicContact CZ2-CE1 4.14Å; W1876-F1952 HydrophobicContact CZ3-CB 3.65Å; W1876-F1952 HydrophobicContact CZ3-CD1 4.48Å; W1876-F1952 AromaticContact CZ3-CD2 3.58Å; W1876-F1952 HydrophobicContact CZ3-CD2 3.58Å; W1876-F1952 AromaticContact CZ3-CE1 3.79Å; W1876-F1952 HydrophobicContact CZ3-CE1 3.79Å; W1876-F1952 AromaticContact CZ3-CE2 3.94Å; W1876-F1952 HydrophobicContact CZ3-CE2 4.1Å; W1876-F1952 AromaticContact CZ3-CG 3.98Å; W1876-F1952 HydrophobicContact CZ3-CG 4.01Å; W1876-F1952 AromaticContact CZ3-CZ 3.57Å; W1876-F1952 HydrophobicContact CZ3-CZ 3.57Å; W1926-F1952 HydrophobicContact CH2-CD1 4.38Å; W1926-F1952 HydrophobicContact CH2-CE1 4.44Å; W1926-F1952 HydrophobicContact CZ2-CD1 4.19Å; W1926-F1952 AromaticContact CZ2-CE1 3.82Å; W1926-F1952 HydrophobicContact CZ2-CE1 3.82Å; R1931-F1952 PolarHBondContact NH1-O 3.03Å; R1931-F1952 VanDerWaalsContact NH1-O 3.14Å; V1947-F1952 HydrophobicContact CG1-CB 4.07Å; V1947-F1952 HydrophobicContact CG1-CG 4.41Å
1953	G	50.1	Low	55.2	Low	29.6 Å²	29.6	70.3 Å²	70.3	31%	0.305	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.4	8.7	179	0	0	0	0	0	116.9	E1859 Q1874 R1931 G1951	E1859-G1953 VanDerWaalsContact OE1-CA 3.25Å; E1859-G1953 WeakPolarHBondContact OE1-CA 3.36Å; E1859-G1953 WeakPolarHBondContact OE2-CA 3.31Å; Q1874-G1953 VanDerWaalsContact OE1-N 3.1Å; R1931-G1953 PolarHBondContact NH1-O 2.76Å; R1931-G1953 PolarHBondContact NH2-O 3.18Å; R1931-G1953 VanDerWaalsContact NH2-O 3.15Å; G1951-G1953 PolarHBondContact O-N 3.21Å
1954	S	45.8	Very low	53.5	Low	65.2 Å²	65.2	75.8 Å²	75.8	46%	0.456	45%	0.448	S	S	.	.			trans	-100.5	87.9	175.1	92.7	0	0	0	0	112.8	Q1874 G1951 F1956	Q1874-S1954 PolarHBondContact NE2-O 3.26Å; G1951-S1954 WeakPolarHBondContact O-CB 3.47Å; G1951-S1954 PolarHBondContact O-N 3.21Å; G1951-S1954 VanDerWaalsContact O-N 3.11Å; G1951-S1954 PolarHBondContact O-OG 3.37Å; S1954-F1956 PolarHBondContact O-N 3.2Å; S1954-F1956 VanDerWaalsContact O-N 3.13Å; S1954-F1956 PolarHBondContact OG-N 3.49Å
1955	Y	39	Very low	52	Low	158.8 Å²	158.8	84.2 Å²	84.2	62%	0.623	48%	0.484	S	S	*	.			trans	-78.8	-2.8	-175.8	-73.3	-84	0	0	0	115	L1950 G1951 T1957 K1964	L1950-Y1955 VanDerWaalsContact O-CD2 3.32Å; L1950-Y1955 WeakPolarHBondContact O-CD2 3.34Å; L1950-Y1955 WeakPolarHBondContact O-CE2 3.33Å; G1951-Y1955 WeakPolarHBondContact O-CD2 3.43Å; Y1955-T1957 PolarHBondContact O-N 2.78Å; Y1955-K1964 PolarHBondContact OH-NZ 3.06Å; Y1955-K1964 VanDerWaalsContact OH-NZ 3.11Å
1956	F	34.8	Very low	51.1	Low	181 Å²	181	84.7 Å²	84.7	79%	0.794	49%	0.487	S	S	*	.	S	Bend	trans	-82.4	82.2	-178.3	-83.6	-79.5	0	0	0	113.4	S1954 S1958	S1954-F1956 PolarHBondContact O-N 3.2Å; S1954-F1956 VanDerWaalsContact O-N 3.13Å; S1954-F1956 PolarHBondContact OG-N 3.49Å; F1956-S1958 PolarHBondContact O-N 3.33Å
1957	T	33.4	Very low	50.6	Low	129 Å²	129	87.6 Å²	87.6	79%	0.791	50%	0.499	S	S	*	.			trans	-83.5	62.8	177.5	51.8	0	0	0	0	113.7	Y1955 T1959	Y1955-T1957 PolarHBondContact O-N 2.78Å; T1957-T1959 VanDerWaalsContact C-N 3.33Å; T1957-T1959 PolarHBondContact O-N 3.16Å
1958	S	35.1	Very low	50.6	Low	81.6 Å²	81.6	88.5 Å²	88.5	57%	0.571	50%	0.504	S	S	*	.			trans	-94.2	91.6	175.9	93.8	0	0	0	0	111.8	F1956 S1960	F1956-S1958 PolarHBondContact O-N 3.33Å; S1958-S1960 VanDerWaalsContact C-N 3.32Å; S1958-S1960 PolarHBondContact O-N 2.98Å; S1958-S1960 VanDerWaalsContact O-N 3.12Å
1959	T	33	Very low	51.2	Low	145.6 Å²	145.6	90 Å²	90	89%	0.893	51%	0.51	S	S	*	.			trans	-68.9	68.7	165.4	46.8	0	0	0	0	111.3	T1957	T1957-T1959 VanDerWaalsContact C-N 3.33Å; T1957-T1959 PolarHBondContact O-N 3.16Å
1960	S	38.2	Very low	52.3	Low	72.8 Å²	72.8	88.2 Å²	88.2	51%	0.509	50%	0.5	S	S	.	.			trans	-133.8	101.7	168.5	64.8	0	0	0	0	110.3	S1958 G1962	S1958-S1960 VanDerWaalsContact C-N 3.32Å; S1958-S1960 PolarHBondContact O-N 2.98Å; S1958-S1960 VanDerWaalsContact O-N 3.12Å; S1960-G1962 VanDerWaalsContact C-N 3.27Å; S1960-G1962 PolarHBondContact O-N 3.19Å
1961	S	39.2	Very low	53.4	Low	134.8 Å²	134.8	91.6 Å²	91.6	94%	0.943	51%	0.514	S	S	*	.			trans	-76.1	51.3	-178.3	64.3	0	0	0	0	113.3
1962	G	40.1	Very low	55	Low	52.6 Å²	52.6	91.4 Å²	91.4	54%	0.542	51%	0.507	S	S	.	.	S	Bend	trans	-126.1	123.1	175.9	0	0	0	0	0	111.5	S1960 K1964	S1960-G1962 VanDerWaalsContact C-N 3.27Å; S1960-G1962 PolarHBondContact O-N 3.19Å; G1962-K1964 PolarHBondContact O-N 3.1Å
1963	C	45.3	Very low	56.4	Low	82.6 Å²	82.6	96.5 Å²	96.5	56%	0.558	54%	0.535	S	S	*	.			trans	-58.1	106.1	173.3	-98.9	0	0	0	0	110.3	K1965	C1963-K1965 PolarHBondContact O-N 3.4Å
1964	K	54.4	Low	58.2	Low	116 Å²	116	96 Å²	96	50%	0.504	53%	0.525	S	S	.	.			trans	-74.3	126	174.1	-70.8	-179.9	-178.6	173.7	0	109.4	C1911 L1950 Y1955 G1962 I1966	C1911-K1964 WeakPolarHBondContact CB-O 3.5Å; C1911-K1964 PolarHBondContact SG-O 3.09Å; L1950-K1964 HydrophobicContact CD2-CB 4.26Å; Y1955-K1964 PolarHBondContact OH-NZ 3.06Å; Y1955-K1964 VanDerWaalsContact OH-NZ 3.11Å; G1962-K1964 PolarHBondContact O-N 3.1Å; K1964-I1966 PolarHBondContact O-N 2.96Å
1965	K	56.9	Low	60	Low	175.2 Å²	175.2	102.9 Å²	102.9	76%	0.762	55%	0.547	S	S	*	.			trans	-84.5	115.3	170.4	-71.3	-174.2	177.3	-176.4	0	109.4	C1963	C1963-K1965 PolarHBondContact O-N 3.4Å
1966	I	69.3	Low	62.3	Low	12.4 Å²	12.4	96.1 Å²	96.1	6%	0.064	52%	0.522	C	S	.	.	P	Polyproline II helix	trans	-84.9	144.5	172.2	-47.7	173.2	0	0	0	108.6	L1913 Y1916 E1949 L1950 K1964	L1913-I1966 HydrophobicContact CD2-CB 3.74Å; L1913-I1966 HydrophobicContact CD2-CD1 3.9Å; L1913-I1966 HydrophobicContact CD2-CG1 3.93Å; Y1916-I1966 VanDerWaalsContact CE2-O 3.27Å; Y1916-I1966 WeakPolarHBondContact CE2-O 3.38Å; E1949-I1966 WeakPolarHBondContact OE2-CG2 3.35Å; L1950-I1966 HydrophobicContact CD1-CD1 3.41Å; L1950-I1966 HydrophobicContact CD1-CG1 4.4Å; L1950-I1966 HydrophobicContact CD2-CD1 3.87Å; L1950-I1966 HydrophobicContact CD2-CG1 3.91Å; L1950-I1966 HydrophobicContact CG-CD1 3.41Å; L1950-I1966 VanDerWaalsContact CG-CD1 3.46Å; L1950-I1966 HydrophobicContact CG-CG1 3.97Å; K1964-I1966 PolarHBondContact O-N 2.96Å
1967	K	72.5	Confident	65	Low	160.2 Å²	160.2	88.7 Å²	88.7	70%	0.697	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-91.9	142.8	170.5	-56.4	-161.9	172.7	171.9	0	109.6	Y1916 S1969	Y1916-K1967 WeakPolarHBondContact OH-CA 3.26Å; Y1916-K1967 VanDerWaalsContact OH-CG 3.26Å; Y1916-K1967 WeakPolarHBondContact OH-CG 3.34Å; K1967-S1969 PolarHBondContact O-N 3.1Å
1968	P	77.8	Confident	67.6	Low	19.2 Å²	19.2	82.6 Å²	82.6	13%	0.125	46%	0.455	C	S	.	.	P	Polyproline II helix	trans	-63.9	131.9	173.6	27.2	-32.6	0	0	0	109.4	Y1916 C1943 L1944 W1945 K1970 K1971	Y1916-P1968 HydrophobicContact CD1-CG 3.73Å; Y1916-P1968 HydrophobicContact CD2-CG 4.44Å; Y1916-P1968 HydrophobicContact CE1-CG 3.92Å; Y1916-P1968 HydrophobicContact CG-CG 4.1Å; Y1916-P1968 VanDerWaalsContact CZ-CD 3.43Å; C1943-P1968 HydrophobicContact CB-CB 4.04Å; L1944-P1968 CarbonylContact O-C 3.53Å; L1944-P1968 VanDerWaalsContact O-CA 3.26Å; L1944-P1968 WeakPolarHBondContact O-CA 3.31Å; L1944-P1968 WeakPolarHBondContact O-CB 3.45Å; W1945-P1968 HydrophobicContact CD2-CB 4.21Å; W1945-P1968 HydrophobicContact CE3-CB 3.96Å; W1945-P1968 HydrophobicContact CH2-CB 4.24Å; W1945-P1968 HydrophobicContact CH2-CG 4.37Å; W1945-P1968 HydrophobicContact CZ2-CB 4.44Å; W1945-P1968 HydrophobicContact CZ3-CB 3.99Å; W1945-P1968 HydrophobicContact CZ3-CG 4.23Å; P1968-K1970 VanDerWaalsContact C-N 3.27Å; P1968-K1970 PolarHBondContact O-N 3.13Å; P1968-K1971 HydrophobicContact CB-CG 4.43Å; P1968-K1971 HydrophobicContact CG-CD 4.36Å; P1968-K1971 VanDerWaalsContact CG-CE 3.46Å; P1968-K1971 HydrophobicContact CG-CG 4.14Å
1969	S	79.1	Confident	70.1	Confident	60.8 Å²	60.8	79.3 Å²	79.3	43%	0.425	43%	0.432	S	S	.	.	S	Bend	trans	-62.5	-36.4	178.4	63.1	0	0	0	0	111.6	L1944 K1967	L1944-S1969 PolarHBondContact O-N 3.2Å; L1944-S1969 PolarHBondContact O-OG 2.95Å; L1944-S1969 VanDerWaalsContact O-OG 3.12Å; K1967-S1969 PolarHBondContact O-N 3.1Å
1970	K	83.2	Confident	72.8	Confident	99 Å²	99	72.7 Å²	72.7	43%	0.43	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	149.4	176.2	-146.5	114.3	-179.7	-179	0	111.1	L1944 P1968 L1972 M2022	L1944-K1970 HydrophobicContact CB-CB 4.36Å; L1944-K1970 HydrophobicContact CD1-CB 4.33Å; L1944-K1970 PolarHBondContact N-O 3.12Å; L1944-K1970 PolarHBondContact O-N 2.89Å; P1968-K1970 VanDerWaalsContact C-N 3.27Å; P1968-K1970 PolarHBondContact O-N 3.13Å; K1970-L1972 HydrophobicContact CG-CD2 4.26Å; K1970-L1972 HydrophobicContact CG-CG 4.42Å; K1970-M2022 HydrophobicContact CD-CB 4.44Å; K1970-M2022 HydrophobicContact CD-CE 4.04Å; K1970-M2022 HydrophobicContact CD-CG 3.81Å; K1970-M2022 HydrophobicContact CD-SD 4.29Å; K1970-M2022 VanDerWaalsContact NZ-CB 3.25Å
1971	K	85.6	Confident	75.3	Confident	99.6 Å²	99.6	69.7 Å²	69.7	43%	0.433	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	134.1	170.3	-61.4	-174.2	-178.7	-173.5	0	109.6	L1941 I1942 P1968	L1941-K1971 HydrophobicContact CD2-CB 4.27Å; L1941-K1971 HydrophobicContact CD2-CD 4.27Å; L1941-K1971 HydrophobicContact CD2-CG 4.1Å; I1942-K1971 CarbonylContact O-C 3.53Å; I1942-K1971 VanDerWaalsContact O-CA 3.29Å; I1942-K1971 WeakPolarHBondContact O-CA 3.43Å; P1968-K1971 HydrophobicContact CB-CG 4.43Å; P1968-K1971 HydrophobicContact CG-CD 4.36Å; P1968-K1971 VanDerWaalsContact CG-CE 3.46Å; P1968-K1971 HydrophobicContact CG-CG 4.14Å
1972	L	86	Confident	77.8	Confident	23 Å²	23	64.3 Å²	64.3	12%	0.12	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	129	173.9	-57.5	170.3	0	0	0	108.7	I1942 K1970 Y2017 M2022	I1942-L1972 HydrophobicContact CB-CB 4.24Å; I1942-L1972 HydrophobicContact CD1-CB 4.46Å; I1942-L1972 PolarHBondContact N-O 3.15Å; I1942-L1972 PolarHBondContact O-N 3.26Å; K1970-L1972 HydrophobicContact CG-CD2 4.26Å; K1970-L1972 HydrophobicContact CG-CG 4.42Å; L1972-Y2017 HydrophobicContact CD1-CD1 4.11Å; L1972-Y2017 HydrophobicContact CD1-CE1 4.3Å; L1972-Y2017 HydrophobicContact CD1-CG 4.34Å; L1972-M2022 HydrophobicContact CD1-SD 4.49Å
1973	N	86.4	Confident	80.1	Confident	128 Å²	128	62.3 Å²	62.3	68%	0.684	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.4	130.9	177.3	-69.8	-10.5	0	0	0	109.8	L1941	L1941-N1973 WeakPolarHBondContact CD1-OD1 3.4Å; L1941-N1973 HydrophobicContact CD2-CB 4.33Å; L1941-N1973 VanDerWaalsContact CD2-CG 3.45Å; L1941-N1973 WeakPolarHBondContact CD2-OD1 3.32Å; L1941-N1973 WeakPolarHBondContact CG-OD1 3.24Å
1974	I	87	Confident	82	Confident	17.8 Å²	17.8	59 Å²	59	9%	0.091	28%	0.284	C	S	.	.			trans	-115.2	160.3	176.5	-60.4	-177.4	0	0	0	108.8	C1940 I1942 S1976 I1978 V2007 H2015 Y2017	C1940-I1974 WeakPolarHBondContact CB-O 3.26Å; C1940-I1974 PolarHBondContact O-N 3.05Å; I1942-I1974 HydrophobicContact CD1-CD1 3.46Å; I1942-I1974 VanDerWaalsContact CD1-CD1 3.44Å; I1942-I1974 HydrophobicContact CD1-CG1 4.38Å; I1942-I1974 HydrophobicContact CG1-CD1 4.1Å; I1974-S1976 VanDerWaalsContact C-N 3.34Å; I1974-I1978 HydrophobicContact CD1-CD1 4.27Å; I1974-I1978 HydrophobicContact CD1-CG1 4.36Å; I1974-V2007 HydrophobicContact CD1-CB 4.38Å; I1974-V2007 HydrophobicContact CD1-CG1 3.82Å; I1974-V2007 HydrophobicContact CD1-CG2 4.45Å; I1974-H2015 VanDerWaalsContact CG2-CD2 3.49Å; I1974-H2015 WeakPolarHBondContact CG2-CD2 3.34Å; I1974-Y2017 HydrophobicContact CD1-CE2 4Å; I1974-Y2017 WeakPolarHBondContact CG1-OH 3.5Å
1975	K	84.1	Confident	82.9	Confident	211 Å²	211	56.3 Å²	56.3	92%	0.917	28%	0.275	S	S	*	.	S	Bend	trans	-81	-15.3	-178.7	-67.9	-175.3	178.1	-179.2	0	114.1
1976	S	87.9	Confident	83.1	Confident	15.8 Å²	15.8	49 Å²	49	11%	0.11	25%	0.245	C	C	.	.	S	Bend	trans	-130.6	152.9	-174.4	140.9	0	0	0	0	111	C1940 I1974 C2009 W2010 D2011	C1940-S1976 WeakPolarHBondContact CB-O 3.33Å; C1940-S1976 VanDerWaalsContact SG-C 3.53Å; I1974-S1976 VanDerWaalsContact C-N 3.34Å; S1976-C2009 VanDerWaalsContact OG-CB 3.23Å; S1976-C2009 WeakPolarHBondContact OG-CB 3.33Å; S1976-C2009 PolarHBondContact OG-SG 3.02Å; S1976-C2009 VanDerWaalsContact OG-SG 3.38Å; S1976-W2010 PolarHBondContact OG-N 3.22Å; S1976-D2011 VanDerWaalsContact CB-OD2 3.22Å; S1976-D2011 WeakPolarHBondContact CB-OD2 3.19Å; S1976-D2011 PolarHBondContact OG-OD2 2.98Å
1977	S	89.6	Confident	82.6	Confident	26.2 Å²	26.2	51.2 Å²	51.2	18%	0.183	26%	0.257	C	S	.	.			trans	-61.9	140.7	177.8	-61.9	0	0	0	0	110.9	L1938 C1940 C2009 W2010	L1938-S1977 PolarHBondContact O-OG 2.99Å; C1940-S1977 PolarHBondContact SG-N 2.83Å; S1977-C2009 CarbonylContact O-C 3.4Å; S1977-C2009 VanDerWaalsContact O-CA 3.3Å; S1977-C2009 WeakPolarHBondContact O-CA 3.23Å; S1977-W2010 VanDerWaalsContact O-CD1 3.3Å; S1977-W2010 PolarHBondContact O-N 3.03Å
1978	I	89.8	Confident	81.6	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	136	-174.5	-59.4	154.1	0	0	0	109	T1922 V1923 G1937 L1941 I1942 I1974 I1981 V2007	T1922-I1978 WeakPolarHBondContact CB-O 3.39Å; T1922-I1978 PolarHBondContact OG1-O 3.13Å; V1923-I1978 HydrophobicContact CG1-CG2 4.2Å; G1937-I1978 PolarHBondContact O-N 3.19Å; L1941-I1978 VanDerWaalsContact O-CD1 3.28Å; L1941-I1978 WeakPolarHBondContact O-CD1 3.2Å; I1942-I1978 HydrophobicContact CD1-CD1 4.34Å; I1942-I1978 HydrophobicContact CG1-CD1 3.5Å; I1942-I1978 VanDerWaalsContact CG1-CD1 3.48Å; I1974-I1978 HydrophobicContact CD1-CD1 4.27Å; I1974-I1978 HydrophobicContact CD1-CG1 4.36Å; I1978-I1981 HydrophobicContact CG2-CD1 4.03Å; I1978-I1981 HydrophobicContact CG2-CG1 3.85Å; I1978-V2007 HydrophobicContact CB-CG1 4.46Å; I1978-V2007 HydrophobicContact CD1-CG1 4.46Å; I1978-V2007 HydrophobicContact CG1-CG1 4.03Å; I1978-V2007 HydrophobicContact CG2-CG1 3.75Å
1979	N	87	Confident	80.2	Confident	13.6 Å²	13.6	51.9 Å²	51.9	7%	0.073	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	-32.5	176.7	-112.1	-2.3	0	0	0	113.3	V1923 G2008 W2010 I2035 C2036 P2094 Q2096 K2097	V1923-N1979 WeakPolarHBondContact CB-O 3.26Å; N1979-G2008 PolarHBondContact N-O 3.06Å; N1979-W2010 VanDerWaalsContact CG-CD1 3.47Å; N1979-W2010 VanDerWaalsContact CG-NE1 3.26Å; N1979-W2010 PolarHBondContact ND2-NE1 3.06Å; N1979-W2010 VanDerWaalsContact ND2-NE1 3.18Å; N1979-W2010 PolarHBondContact OD1-NE1 3.18Å; N1979-I2035 VanDerWaalsContact CB-O 3.31Å; N1979-I2035 WeakPolarHBondContact CB-O 3.37Å; N1979-I2035 PolarHBondContact ND2-O 2.91Å; N1979-C2036 WeakPolarHBondContact ND2-CA 3.07Å; N1979-P2094 WeakPolarHBondContact ND2-CB 3.11Å; N1979-Q2096 VanDerWaalsContact CB-OE1 3.25Å; N1979-Q2096 VanDerWaalsContact CG-NE2 3.31Å; N1979-Q2096 PolarHBondContact ND2-NE2 3.33Å; N1979-Q2096 PolarHBondContact ND2-OE1 2.79Å; N1979-Q2096 PolarHBondContact OD1-NE2 3.01Å; N1979-Q2096 PolarHBondContact OD1-OE1 2.97Å; N1979-K2097 WeakPolarHBondContact OD1-CE 3.34Å; N1979-K2097 PolarHBondContact OD1-NZ 3.49Å
1980	S	89	Confident	78.5	Confident	7 Å²	7	51.2 Å²	51.2	5%	0.049	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	144.6	-175.3	95.3	0	0	0	0	111	V2007 G2008 L2038	S1980-V2007 CarbonylContact O-C 3.57Å; S1980-V2007 WeakPolarHBondContact O-CA 3.38Å; S1980-G2008 PolarHBondContact N-O 3.03Å; S1980-G2008 PolarHBondContact O-N 3.23Å; S1980-G2008 WeakPolarHBondContact OG-CA 3.3Å; S1980-L2038 WeakPolarHBondContact OG-CD1 3.48Å; S1980-L2038 VanDerWaalsContact OG-CG 3.3Å; S1980-L2038 WeakPolarHBondContact OG-CG 3.3Å; S1980-L2038 PolarHBondContact OG-N 2.83Å
1981	I	91.8	Very high	76.7	Confident	9.4 Å²	9.4	52.2 Å²	52.2	5%	0.048	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	137.5	178.4	-69.3	179.8	0	0	0	107.2	V1923 A1925 A1934 I1942 I1978 L2005 A2006 V2007	V1923-I1981 HydrophobicContact CG1-CB 3.98Å; V1923-I1981 HydrophobicContact CG1-CD1 3.85Å; V1923-I1981 HydrophobicContact CG1-CG1 3.66Å; V1923-I1981 HydrophobicContact CG2-CB 4.28Å; A1925-I1981 HydrophobicContact CB-CG2 4.09Å; A1934-I1981 HydrophobicContact CB-CG2 4.21Å; I1942-I1981 HydrophobicContact CD1-CD1 4.21Å; I1942-I1981 HydrophobicContact CG1-CD1 4.21Å; I1942-I1981 HydrophobicContact CG2-CD1 4.25Å; I1978-I1981 HydrophobicContact CG2-CD1 4.03Å; I1978-I1981 HydrophobicContact CG2-CG1 3.85Å; I1981-L2005 HydrophobicContact CG2-CD1 3.32Å; I1981-L2005 HydrophobicContact CG2-CG 4.28Å; I1981-A2006 CarbonylContact C-O 3.23Å; I1981-A2006 VanDerWaalsContact CA-O 3.3Å; I1981-A2006 WeakPolarHBondContact CA-O 3.26Å; I1981-V2007 HydrophobicContact CG1-CG1 4.21Å; I1981-V2007 HydrophobicContact CG1-CG2 4.44Å
1982	S	90.8	Very high	74.8	Confident	20 Å²	20	51.6 Å²	51.6	14%	0.14	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	137.8	175.6	-159.9	0	0	0	0	111.4	A2006 L2038 Y2040	S1982-A2006 PolarHBondContact N-O 3.23Å; S1982-A2006 PolarHBondContact O-N 3.16Å; S1982-L2038 WeakPolarHBondContact CB-O 3.33Å; S1982-L2038 PolarHBondContact OG-O 2.85Å; S1982-Y2040 WeakPolarHBondContact O-CE2 3.29Å; S1982-Y2040 PolarHBondContact OG-N 2.99Å
1983	F	89	Confident	72.8	Confident	11 Å²	11	54.1 Å²	54.1	5%	0.048	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	135.4	174.5	-76	-64.8	0	0	0	110.9	A1925 W1926 H1927 L1932 A1934 L1944 L1985 L2005 L2019 Y2040	A1925-F1983 HydrophobicContact CB-CD2 3.84Å; A1925-F1983 HydrophobicContact CB-CE2 4Å; A1925-F1983 WeakPolarHBondContact O-CE2 3.37Å; W1926-F1983 WeakPolarHBondContact O-CD2 3.22Å; H1927-F1983 HydrophobicContact CB-CD1 4.29Å; H1927-F1983 HydrophobicContact CB-CD2 3.88Å; H1927-F1983 HydrophobicContact CB-CE1 4.29Å; H1927-F1983 HydrophobicContact CB-CE2 3.88Å; H1927-F1983 HydrophobicContact CB-CG 4.1Å; H1927-F1983 HydrophobicContact CB-CZ 4.1Å; H1927-F1983 AromaticContact CD2-CD1 3.78Å; H1927-F1983 AromaticContact CD2-CG 3.99Å; L1932-F1983 HydrophobicContact CD2-CE1 4.38Å; L1932-F1983 HydrophobicContact CD2-CZ 4.18Å; A1934-F1983 HydrophobicContact CB-CE1 4.47Å; A1934-F1983 HydrophobicContact CB-CE2 3.77Å; A1934-F1983 HydrophobicContact CB-CZ 3.57Å; A1934-F1983 VanDerWaalsContact CB-CZ 3.48Å; L1944-F1983 HydrophobicContact CD2-CZ 4.41Å; F1983-L1985 HydrophobicContact CB-CD2 4.25Å; F1983-L1985 HydrophobicContact CB-CG 4.47Å; F1983-L1985 PolarHBondContact O-N 3.09Å; F1983-L2005 HydrophobicContact CD1-CB 4.39Å; F1983-L2005 HydrophobicContact CD1-CD1 3.64Å; F1983-L2005 HydrophobicContact CE1-CB 4.36Å; F1983-L2005 HydrophobicContact CE1-CD1 3.56Å; F1983-L2005 VanDerWaalsContact CE1-CD1 3.5Å; F1983-L2005 HydrophobicContact CE1-CG 4.38Å; F1983-L2005 HydrophobicContact CG-CD1 4.26Å; F1983-L2005 HydrophobicContact CZ-CD1 4.12Å; F1983-L2019 HydrophobicContact CD1-CD1 3.67Å; F1983-L2019 HydrophobicContact CE1-CD1 3.65Å; F1983-L2019 HydrophobicContact CE1-CD2 3.79Å; F1983-L2019 HydrophobicContact CE1-CG 4.28Å; F1983-Y2040 VanDerWaalsContact C-CD2 3.45Å; F1983-Y2040 WeakPolarHBondContact O-CD2 3.35Å
1984	R	84.7	Confident	71	Confident	13.6 Å²	13.6	57 Å²	57	5%	0.051	30%	0.302	C	S	.	.			trans	-77.8	110.3	164.8	-168.4	177.8	178.3	169.7	1.3	108.7	V2004 Y2040 N2044 G2045 A2062 D2063	R1984-V2004 HydrophobicContact CB-CB 4.17Å; R1984-V2004 WeakPolarHBondContact CB-O 3.32Å; R1984-V2004 PolarHBondContact N-O 3.3Å; R1984-Y2040 HydrophobicContact CB-CD1 4.25Å; R1984-Y2040 HydrophobicContact CB-CD2 4.2Å; R1984-Y2040 HydrophobicContact CB-CE1 4.08Å; R1984-Y2040 HydrophobicContact CB-CE2 4.01Å; R1984-Y2040 HydrophobicContact CB-CG 4.3Å; R1984-Y2040 HydrophobicContact CG-CD1 4.16Å; R1984-Y2040 HydrophobicContact CG-CE1 4.16Å; R1984-Y2040 HydrophobicContact CG-CG 4.46Å; R1984-N2044 PolarHBondContact NE-O 3.14Å; R1984-N2044 VanDerWaalsContact NE-O 3.1Å; R1984-N2044 PolarHBondContact NH2-O 3.12Å; R1984-N2044 VanDerWaalsContact NH2-O 3.16Å; R1984-G2045 VanDerWaalsContact CZ-O 3.27Å; R1984-G2045 PolarHBondContact NE-O 3.09Å; R1984-G2045 VanDerWaalsContact NE-O 3.15Å; R1984-G2045 PolarHBondContact NH2-O 3.42Å; R1984-A2062 PolarHBondContact NH1-O 3.36Å; R1984-D2063 IonicContact CZ-OD1 3.22Å; R1984-D2063 IonicContact NH1-OD1 3.2Å; R1984-D2063 PolarHBondContact NH1-OD1 2.74Å; R1984-D2063 VanDerWaalsContact NH2-CG 3.31Å; R1984-D2063 IonicContact NH2-OD1 3.3Å; R1984-D2063 PolarHBondContact NH2-OD1 2.89Å; R1984-D2063 IonicContact NH2-OD2 3.42Å; R1984-D2063 PolarHBondContact NH2-OD2 3.02Å
1985	L	73.7	Confident	69	Low	60 Å²	60	60.8 Å²	60.8	31%	0.314	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-91.2	137.4	-178.8	-62.3	175.5	0	0	0	111.2	P1928 F1983	P1928-L1985 HydrophobicContact CG-CD2 4.36Å; F1983-L1985 HydrophobicContact CB-CD2 4.25Å; F1983-L1985 HydrophobicContact CB-CG 4.47Å; F1983-L1985 PolarHBondContact O-N 3.09Å
1986	P	61.6	Low	67.2	Low	20.4 Å²	20.4	55.1 Å²	55.1	13%	0.132	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-69.2	149.4	171.2	27.9	-32.7	0	0	0	111.1	K1929 Y1988 L2001	K1929-P1986 HydrophobicContact CD-CG 4.28Å; P1986-Y1988 WeakPolarHBondContact O-CD2 3.2Å; P1986-Y1988 VanDerWaalsContact O-CE2 3.29Å; P1986-Y1988 WeakPolarHBondContact O-CE2 3.4Å; P1986-Y1988 PolarHBondContact O-N 3.25Å; P1986-L2001 HydrophobicContact CB-CD2 4Å; P1986-L2001 HydrophobicContact CG-CD2 4.27Å
1987	N	57.6	Low	65.1	Low	59.4 Å²	59.4	58.1 Å²	58.1	32%	0.318	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-71.9	134.8	178.8	-163.9	-2.1	0	0	0	111	A1989 S1990 N2044	N1987-A1989 VanDerWaalsContact C-N 3.34Å; N1987-A1989 WeakPolarHBondContact OD1-CB 3.17Å; N1987-A1989 PolarHBondContact OD1-N 3.28Å; N1987-A1989 VanDerWaalsContact OD1-N 3.08Å; N1987-S1990 PolarHBondContact ND2-OG 3.48Å; N1987-N2044 HydrophobicContact CB-CB 4.42Å; N1987-N2044 VanDerWaalsContact CB-OD1 3.24Å; N1987-N2044 WeakPolarHBondContact CB-OD1 3.41Å; N1987-N2044 VanDerWaalsContact CG-OD1 3.24Å; N1987-N2044 PolarHBondContact ND2-OD1 3.39Å
1988	Y	51.9	Low	63	Low	111.6 Å²	111.6	62 Å²	62	44%	0.438	35%	0.353	S	S	.	.			trans	-91.7	-11.8	179.3	-61.7	-80.7	0	0	0	113	V1860 P1928 P1986 S1990	V1860-Y1988 HydrophobicContact CB-CE1 4.45Å; V1860-Y1988 HydrophobicContact CG1-CD1 4.17Å; V1860-Y1988 HydrophobicContact CG1-CE1 4.01Å; V1860-Y1988 HydrophobicContact CG2-CD1 4.46Å; V1860-Y1988 HydrophobicContact CG2-CE1 4.02Å; P1928-Y1988 WeakPolarHBondContact CG-OH 3.39Å; P1986-Y1988 WeakPolarHBondContact O-CD2 3.2Å; P1986-Y1988 VanDerWaalsContact O-CE2 3.29Å; P1986-Y1988 WeakPolarHBondContact O-CE2 3.4Å; P1986-Y1988 PolarHBondContact O-N 3.25Å; Y1988-S1990 PolarHBondContact O-N 2.98Å
1989	A	48.1	Very low	60.9	Low	82.8 Å²	82.8	69.4 Å²	69.4	68%	0.684	39%	0.387	S	S	*	.	S	Bend	trans	-92.6	-6.9	-161.7	0	0	0	0	0	116.1	N1987 D1991	N1987-A1989 VanDerWaalsContact C-N 3.34Å; N1987-A1989 WeakPolarHBondContact OD1-CB 3.17Å; N1987-A1989 PolarHBondContact OD1-N 3.28Å; N1987-A1989 VanDerWaalsContact OD1-N 3.08Å; A1989-D1991 PolarHBondContact O-N 3.31Å
1990	S	44	Very low	59	Low	45.2 Å²	45.2	77.1 Å²	77.1	32%	0.316	42%	0.417	S	S	.	.			trans	-119.3	101.9	-177.1	59	0	0	0	0	112.4	N1987 Y1988 S1992 E1993	N1987-S1990 PolarHBondContact ND2-OG 3.48Å; Y1988-S1990 PolarHBondContact O-N 2.98Å; S1990-S1992 WeakPolarHBondContact CB-OG 3.44Å; S1990-S1992 PolarHBondContact O-N 3.16Å; S1990-E1993 PolarHBondContact O-N 3.23Å; S1990-E1993 PolarHBondContact OG-OE2 3Å
1991	D	44.5	Very low	57.2	Low	119.8 Å²	119.8	79.9 Å²	79.9	64%	0.641	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-58.2	-8.9	172	-90.8	-44.7	0	0	0	114	T1865 A1989 E1993 K1994	T1865-D1991 VanDerWaalsContact CG2-OD2 3.25Å; T1865-D1991 WeakPolarHBondContact CG2-OD2 3.39Å; A1989-D1991 PolarHBondContact O-N 3.31Å; D1991-E1993 VanDerWaalsContact C-N 3.3Å; D1991-E1993 PolarHBondContact O-N 2.9Å; D1991-K1994 WeakPolarHBondContact OD1-CE 3.33Å; D1991-K1994 IonicContact OD1-NZ 3.37Å; D1991-K1994 PolarHBondContact OD1-NZ 3.14Å
1992	S	45.3	Very low	55.8	Low	88.6 Å²	88.6	84.6 Å²	84.6	62%	0.62	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-78.1	1.7	178.5	56.7	0	0	0	0	114.5	S1990 K1994 S1995	S1990-S1992 WeakPolarHBondContact CB-OG 3.44Å; S1990-S1992 PolarHBondContact O-N 3.16Å; S1992-K1994 VanDerWaalsContact C-N 3.34Å; S1992-K1994 PolarHBondContact O-N 3.21Å; S1992-S1995 PolarHBondContact O-N 3.29Å; S1992-S1995 PolarHBondContact O-OG 3.24Å
1993	E	44.4	Very low	55.1	Low	75 Å²	75	84.2 Å²	84.2	35%	0.35	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-83.2	3.3	-179.3	-75.3	-167.6	149.5	0	0	114.4	K1929 S1990 D1991 S1995 I1996 R2002	K1929-E1993 IonicContact NZ-OE1 3.93Å; S1990-E1993 PolarHBondContact O-N 3.23Å; S1990-E1993 PolarHBondContact OG-OE2 3Å; D1991-E1993 VanDerWaalsContact C-N 3.3Å; D1991-E1993 PolarHBondContact O-N 2.9Å; E1993-S1995 VanDerWaalsContact C-N 3.26Å; E1993-S1995 PolarHBondContact O-N 3.03Å; E1993-S1995 VanDerWaalsContact O-N 3.16Å; E1993-I1996 HydrophobicContact CB-CD1 4.41Å; E1993-I1996 HydrophobicContact CG-CD1 4.17Å; E1993-I1996 PolarHBondContact O-N 3.39Å; E1993-R2002 IonicContact OE1-CZ 2.96Å; E1993-R2002 VanDerWaalsContact OE1-CZ 3.3Å; E1993-R2002 IonicContact OE1-NH1 2.97Å; E1993-R2002 PolarHBondContact OE1-NH1 2.85Å; E1993-R2002 IonicContact OE1-NH2 2.86Å; E1993-R2002 PolarHBondContact OE1-NH2 3.39Å; E1993-R2002 IonicContact OE2-CZ 2.69Å; E1993-R2002 VanDerWaalsContact OE2-CZ 3.27Å; E1993-R2002 IonicContact OE2-NH1 3.06Å; E1993-R2002 PolarHBondContact OE2-NH1 2.9Å; E1993-R2002 IonicContact OE2-NH2 3.18Å; E1993-R2002 PolarHBondContact OE2-NH2 3.42Å
1994	K	49.4	Very low	55	Low	188.8 Å²	188.8	84.2 Å²	84.2	82%	0.821	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-64.9	-8.7	176.5	-74.2	178.4	179.2	162.6	0	114.7	D1991 S1992	D1991-K1994 WeakPolarHBondContact OD1-CE 3.33Å; D1991-K1994 IonicContact OD1-NZ 3.37Å; D1991-K1994 PolarHBondContact OD1-NZ 3.14Å; S1992-K1994 VanDerWaalsContact C-N 3.34Å; S1992-K1994 PolarHBondContact O-N 3.21Å
1995	S	45.7	Very low	55.2	Low	98.6 Å²	98.6	83.6 Å²	83.6	69%	0.69	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-100.8	-7.2	-177.3	59.1	0	0	0	0	115.2	S1992 E1993	S1992-S1995 PolarHBondContact O-N 3.29Å; S1992-S1995 PolarHBondContact O-OG 3.24Å; E1993-S1995 VanDerWaalsContact C-N 3.26Å; E1993-S1995 PolarHBondContact O-N 3.03Å; E1993-S1995 VanDerWaalsContact O-N 3.16Å
1996	I	45.4	Very low	56.1	Low	90 Å²	90	80.7 Å²	80.7	46%	0.462	43%	0.428	S	S	.	.	S	Bend	trans	-94.9	121.2	-177.9	-55.3	170.7	0	0	0	108.7	E1993 Y2000	E1993-I1996 HydrophobicContact CB-CD1 4.41Å; E1993-I1996 HydrophobicContact CG-CD1 4.17Å; E1993-I1996 PolarHBondContact O-N 3.39Å; I1996-Y2000 HydrophobicContact CG2-CG 4.34Å
1997	P	43	Very low	57.6	Low	79.2 Å²	79.2	79.8 Å²	79.8	51%	0.514	42%	0.421	S	S	.	.			trans	-59	136.5	178.4	7.1	-8.9	0	0	0	110.4	E1999 Y2000	P1997-E1999 PolarHBondContact O-N 3.07Å; P1997-E1999 VanDerWaalsContact O-N 3.08Å; P1997-Y2000 HydrophobicContact CB-CD2 4.03Å; P1997-Y2000 HydrophobicContact CB-CE2 4.4Å; P1997-Y2000 HydrophobicContact CG-CD2 3.93Å; P1997-Y2000 HydrophobicContact CG-CE2 4.2Å; P1997-Y2000 PolarHBondContact O-N 3.42Å
1998	P	46.7	Very low	59.2	Low	108.8 Å²	108.8	76.9 Å²	76.9	71%	0.706	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-9	-171.8	24.7	-34.3	0	0	0	114.5	Y2000 L2001	P1998-Y2000 PolarHBondContact O-N 2.81Å; P1998-L2001 HydrophobicContact CB-CD1 4.3Å; P1998-L2001 PolarHBondContact O-N 2.98Å
1999	E	44.4	Very low	61.1	Low	154.2 Å²	154.2	71.6 Å²	71.6	72%	0.721	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-13.9	-169.6	-65.2	-173.5	160.2	0	0	115	P1997	P1997-E1999 PolarHBondContact O-N 3.07Å; P1997-E1999 VanDerWaalsContact O-N 3.08Å
2000	Y	47.9	Very low	63	Low	176.6 Å²	176.6	73.3 Å²	73.3	69%	0.693	37%	0.374	S	S	*	.	S	Bend	trans	-108.9	4.3	-173.8	-74.3	-82.7	0	0	0	116.2	I1996 P1997 P1998 R2002	I1996-Y2000 HydrophobicContact CG2-CG 4.34Å; P1997-Y2000 HydrophobicContact CB-CD2 4.03Å; P1997-Y2000 HydrophobicContact CB-CE2 4.4Å; P1997-Y2000 HydrophobicContact CG-CD2 3.93Å; P1997-Y2000 HydrophobicContact CG-CE2 4.2Å; P1997-Y2000 PolarHBondContact O-N 3.42Å; P1998-Y2000 PolarHBondContact O-N 2.81Å; Y2000-R2002 PolarHBondContact O-N 3.35Å; Y2000-R2002 VanDerWaalsContact O-N 3.14Å
2001	L	51.5	Low	65.1	Low	64.2 Å²	64.2	75.2 Å²	75.2	34%	0.336	38%	0.381	S	S	.	.			trans	-74	65.2	171.2	-77.8	167.2	0	0	0	113.5	P1986 P1998 D2003 I2020	P1986-L2001 HydrophobicContact CB-CD2 4Å; P1986-L2001 HydrophobicContact CG-CD2 4.27Å; P1998-L2001 HydrophobicContact CB-CD1 4.3Å; P1998-L2001 PolarHBondContact O-N 2.98Å; L2001-D2003 PolarHBondContact O-N 3.19Å; L2001-I2020 HydrophobicContact CB-CD1 4.3Å; L2001-I2020 VanDerWaalsContact O-CD1 3.31Å; L2001-I2020 WeakPolarHBondContact O-CD1 3.41Å
2002	R	62.5	Low	67.1	Low	109.8 Å²	109.8	69.4 Å²	69.4	41%	0.414	35%	0.35	S	S	.	.			trans	-84.7	31.1	-175.5	-65.6	-173.4	177.5	-163.9	-1.8	113.8	E1993 Y2000 V2004 D2063	E1993-R2002 IonicContact OE1-CZ 2.96Å; E1993-R2002 VanDerWaalsContact OE1-CZ 3.3Å; E1993-R2002 IonicContact OE1-NH1 2.97Å; E1993-R2002 PolarHBondContact OE1-NH1 2.85Å; E1993-R2002 IonicContact OE1-NH2 2.86Å; E1993-R2002 PolarHBondContact OE1-NH2 3.39Å; E1993-R2002 IonicContact OE2-CZ 2.69Å; E1993-R2002 VanDerWaalsContact OE2-CZ 3.27Å; E1993-R2002 IonicContact OE2-NH1 3.06Å; E1993-R2002 PolarHBondContact OE2-NH1 2.9Å; E1993-R2002 IonicContact OE2-NH2 3.18Å; E1993-R2002 PolarHBondContact OE2-NH2 3.42Å; Y2000-R2002 PolarHBondContact O-N 3.35Å; Y2000-R2002 VanDerWaalsContact O-N 3.14Å; R2002-V2004 VanDerWaalsContact C-N 3.34Å; R2002-V2004 HydrophobicContact CB-CG2 4.23Å; R2002-V2004 PolarHBondContact O-N 2.99Å; R2002-D2063 IonicContact CZ-OD1 3.61Å; R2002-D2063 VanDerWaalsContact NH1-CB 3.3Å; R2002-D2063 VanDerWaalsContact NH1-CG 3.29Å; R2002-D2063 PolarHBondContact NH1-O 3.2Å; R2002-D2063 IonicContact NH1-OD1 3.46Å; R2002-D2063 PolarHBondContact NH1-OD1 3.08Å; R2002-D2063 IonicContact NH1-OD2 2.63Å; R2002-D2063 PolarHBondContact NH1-OD2 2.82Å
2003	D	76.1	Confident	69.3	Low	11 Å²	11	65.7 Å²	65.7	6%	0.059	32%	0.323	C	S	.	.			trans	-90.3	88	176.9	-70.2	-13.7	0	0	0	109.4	H1927 R1930 L2001 L2019	H1927-D2003 IonicContact NE2-OD1 3.49Å; H1927-D2003 PolarHBondContact NE2-OD1 2.72Å; R1930-D2003 IonicContact CZ-OD2 3.35Å; R1930-D2003 IonicContact NE-OD2 3.14Å; R1930-D2003 PolarHBondContact NE-OD2 3.28Å; R1930-D2003 IonicContact NH2-OD2 3.03Å; R1930-D2003 PolarHBondContact NH2-OD2 3.37Å; L2001-D2003 PolarHBondContact O-N 3.19Å; D2003-L2019 HydrophobicContact CB-CB 3.94Å; D2003-L2019 HydrophobicContact CB-CD1 3.93Å; D2003-L2019 HydrophobicContact CB-CG 4.41Å; D2003-L2019 WeakPolarHBondContact O-CB 3.29Å; D2003-L2019 PolarHBondContact O-N 2.99Å
2004	V	85.9	Confident	71.6	Confident	10.6 Å²	10.6	62.1 Å²	62.1	6%	0.064	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	138.7	-177	179.2	0	0	0	0	110.6	R1984 R2002 F2016 Y2017 I2025	R1984-V2004 HydrophobicContact CB-CB 4.17Å; R1984-V2004 WeakPolarHBondContact CB-O 3.32Å; R1984-V2004 PolarHBondContact N-O 3.3Å; R2002-V2004 VanDerWaalsContact C-N 3.34Å; R2002-V2004 HydrophobicContact CB-CG2 4.23Å; R2002-V2004 PolarHBondContact O-N 2.99Å; V2004-F2016 HydrophobicContact CG1-CB 4.31Å; V2004-F2016 HydrophobicContact CG1-CD1 4.12Å; V2004-Y2017 CarbonylContact C-O 3.55Å; V2004-Y2017 WeakPolarHBondContact CA-O 3.28Å; V2004-I2025 HydrophobicContact CG1-CD1 4Å; V2004-I2025 HydrophobicContact CG2-CD1 3.93Å
2005	L	90.2	Very high	73.6	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.005	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	121.9	172.1	-179.6	64.1	0	0	0	109.5	I1942 L1944 I1981 F1983 V2007 F2016 Y2017 L2019	I1942-L2005 HydrophobicContact CD1-CD2 4.39Å; I1942-L2005 HydrophobicContact CG2-CD2 4.36Å; L1944-L2005 HydrophobicContact CD2-CD2 4.38Å; I1981-L2005 HydrophobicContact CG2-CD1 3.32Å; I1981-L2005 HydrophobicContact CG2-CG 4.28Å; F1983-L2005 HydrophobicContact CD1-CB 4.39Å; F1983-L2005 HydrophobicContact CD1-CD1 3.64Å; F1983-L2005 HydrophobicContact CE1-CB 4.36Å; F1983-L2005 HydrophobicContact CE1-CD1 3.56Å; F1983-L2005 VanDerWaalsContact CE1-CD1 3.5Å; F1983-L2005 HydrophobicContact CE1-CG 4.38Å; F1983-L2005 HydrophobicContact CG-CD1 4.26Å; F1983-L2005 HydrophobicContact CZ-CD1 4.12Å; L2005-V2007 HydrophobicContact CD2-CG2 4.33Å; L2005-V2007 HydrophobicContact CG-CG2 4.12Å; L2005-F2016 CarbonylContact O-C 3.5Å; L2005-F2016 WeakPolarHBondContact O-CA 3.37Å; L2005-Y2017 PolarHBondContact N-O 3.21Å; L2005-Y2017 PolarHBondContact O-N 3.16Å; L2005-L2019 HydrophobicContact CB-CD2 4.27Å; L2005-L2019 HydrophobicContact CB-CG 4.45Å; L2005-L2019 HydrophobicContact CD2-CD2 4.48Å
2006	A	92.1	Very high	75.8	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	139.8	169.8	0	0	0	0	0	110.5	I1981 S1982 V2014 H2015 F2016 L2038 Y2040 L2048	I1981-A2006 CarbonylContact C-O 3.23Å; I1981-A2006 VanDerWaalsContact CA-O 3.3Å; I1981-A2006 WeakPolarHBondContact CA-O 3.26Å; S1982-A2006 PolarHBondContact N-O 3.23Å; S1982-A2006 PolarHBondContact O-N 3.16Å; A2006-V2014 HydrophobicContact CB-CG1 4.34Å; A2006-H2015 CarbonylContact C-O 3.56Å; A2006-H2015 WeakPolarHBondContact CA-O 3.39Å; A2006-F2016 HydrophobicContact CB-CD1 4.04Å; A2006-F2016 HydrophobicContact CB-CE1 3.88Å; A2006-L2038 HydrophobicContact CB-CD1 4.14Å; A2006-Y2040 HydrophobicContact CB-CE2 3.66Å; A2006-Y2040 WeakPolarHBondContact CB-OH 3.29Å; A2006-L2048 HydrophobicContact CB-CD1 4.27Å; A2006-L2048 HydrophobicContact CB-CD2 4.2Å
2007	V	92.8	Very high	77.8	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	121.7	-175.8	-174.6	0	0	0	0	109.1	I1942 I1974 I1978 S1980 I1981 L2005 V2014 H2015 Y2017	I1942-V2007 HydrophobicContact CD1-CB 4.37Å; I1942-V2007 HydrophobicContact CD1-CG1 4Å; I1942-V2007 HydrophobicContact CD1-CG2 3.5Å; I1942-V2007 VanDerWaalsContact CD1-CG2 3.45Å; I1974-V2007 HydrophobicContact CD1-CB 4.38Å; I1974-V2007 HydrophobicContact CD1-CG1 3.82Å; I1974-V2007 HydrophobicContact CD1-CG2 4.45Å; I1978-V2007 HydrophobicContact CB-CG1 4.46Å; I1978-V2007 HydrophobicContact CD1-CG1 4.46Å; I1978-V2007 HydrophobicContact CG1-CG1 4.03Å; I1978-V2007 HydrophobicContact CG2-CG1 3.75Å; S1980-V2007 CarbonylContact O-C 3.57Å; S1980-V2007 WeakPolarHBondContact O-CA 3.38Å; I1981-V2007 HydrophobicContact CG1-CG1 4.21Å; I1981-V2007 HydrophobicContact CG1-CG2 4.44Å; L2005-V2007 HydrophobicContact CD2-CG2 4.33Å; L2005-V2007 HydrophobicContact CG-CG2 4.12Å; V2007-V2014 CarbonylContact O-C 3.56Å; V2007-V2014 VanDerWaalsContact O-CA 3.24Å; V2007-V2014 WeakPolarHBondContact O-CA 3.39Å; V2007-V2014 WeakPolarHBondContact O-CG1 3.34Å; V2007-H2015 HydrophobicContact CB-CB 4.41Å; V2007-H2015 PolarHBondContact N-O 3.14Å; V2007-H2015 PolarHBondContact O-N 3.12Å; V2007-Y2017 HydrophobicContact CG2-CD2 4.11Å; V2007-Y2017 HydrophobicContact CG2-CE2 4.23Å
2008	G	91.4	Very high	79.9	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	127.8	-179.5	0	0	0	0	0	111.2	N1979 S1980 L2038	N1979-G2008 PolarHBondContact N-O 3.06Å; S1980-G2008 PolarHBondContact N-O 3.03Å; S1980-G2008 PolarHBondContact O-N 3.23Å; S1980-G2008 WeakPolarHBondContact OG-CA 3.3Å; G2008-L2038 VanDerWaalsContact N-CD1 3.28Å
2009	C	91.7	Very high	81.5	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	163.5	-171.3	-69.1	0	0	0	0	113.1	S1976 S1977 D2011 G2012 S2013 H2015 I2035	S1976-C2009 VanDerWaalsContact OG-CB 3.23Å; S1976-C2009 WeakPolarHBondContact OG-CB 3.33Å; S1976-C2009 PolarHBondContact OG-SG 3.02Å; S1976-C2009 VanDerWaalsContact OG-SG 3.38Å; S1977-C2009 CarbonylContact O-C 3.4Å; S1977-C2009 VanDerWaalsContact O-CA 3.3Å; S1977-C2009 WeakPolarHBondContact O-CA 3.23Å; C2009-D2011 VanDerWaalsContact C-N 3.25Å; C2009-D2011 VanDerWaalsContact CB-OD1 3.23Å; C2009-D2011 WeakPolarHBondContact CB-OD1 3.29Å; C2009-D2011 PolarHBondContact O-N 3.35Å; C2009-G2012 PolarHBondContact O-N 3.09Å; C2009-S2013 WeakPolarHBondContact CB-O 3.02Å; C2009-S2013 PolarHBondContact N-O 2.93Å; C2009-H2015 VanDerWaalsContact SG-CD2 3.53Å; C2009-I2035 PolarHBondContact O-N 3.12Å; C2009-I2035 VanDerWaalsContact O-N 3.09Å
2010	W	88.3	Confident	83.1	Confident	118.6 Å²	118.6	36 Å²	36	45%	0.449	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-21.2	177.7	-101.8	25	0	0	0	114.5	L1938 S1976 S1977 N1979 G2012 A2034 L2093 P2094	L1938-W2010 HydrophobicContact CD1-CZ2 4.47Å; L1938-W2010 HydrophobicContact CD2-CH2 4.49Å; L1938-W2010 HydrophobicContact CD2-CZ2 3.72Å; S1976-W2010 PolarHBondContact OG-N 3.22Å; S1977-W2010 VanDerWaalsContact O-CD1 3.3Å; S1977-W2010 PolarHBondContact O-N 3.03Å; N1979-W2010 VanDerWaalsContact CG-CD1 3.47Å; N1979-W2010 VanDerWaalsContact CG-NE1 3.26Å; N1979-W2010 PolarHBondContact ND2-NE1 3.06Å; N1979-W2010 VanDerWaalsContact ND2-NE1 3.18Å; N1979-W2010 PolarHBondContact OD1-NE1 3.18Å; W2010-G2012 VanDerWaalsContact C-N 3.31Å; W2010-G2012 PolarHBondContact O-N 3.32Å; W2010-A2034 HydrophobicContact CB-CB 4.44Å; W2010-A2034 HydrophobicContact CD2-CB 4.13Å; W2010-A2034 HydrophobicContact CG-CB 4.25Å; W2010-A2034 VanDerWaalsContact O-CA 3.28Å; W2010-A2034 WeakPolarHBondContact O-CA 3.29Å; W2010-A2034 WeakPolarHBondContact O-CB 3.32Å; W2010-L2093 HydrophobicContact CZ2-CD1 4.46Å; W2010-L2093 HydrophobicContact CZ2-CD2 4.19Å; W2010-P2094 HydrophobicContact CZ2-CG 3.81Å
2011	D	88.1	Confident	84.4	Confident	83.4 Å²	83.4	30.9 Å²	30.9	45%	0.446	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84	6.6	178.9	60.6	5.4	0	0	0	113.5	S1976 C2009 S2013	S1976-D2011 VanDerWaalsContact CB-OD2 3.22Å; S1976-D2011 WeakPolarHBondContact CB-OD2 3.19Å; S1976-D2011 PolarHBondContact OG-OD2 2.98Å; C2009-D2011 VanDerWaalsContact C-N 3.25Å; C2009-D2011 VanDerWaalsContact CB-OD1 3.23Å; C2009-D2011 WeakPolarHBondContact CB-OD1 3.29Å; C2009-D2011 PolarHBondContact O-N 3.35Å; D2011-S2013 VanDerWaalsContact C-N 3.29Å; D2011-S2013 VanDerWaalsContact CG-OG 3.25Å; D2011-S2013 PolarHBondContact O-N 3Å; D2011-S2013 VanDerWaalsContact OD1-CB 3.28Å; D2011-S2013 WeakPolarHBondContact OD1-CB 3.35Å; D2011-S2013 PolarHBondContact OD1-N 3.15Å; D2011-S2013 PolarHBondContact OD1-OG 3.16Å; D2011-S2013 PolarHBondContact OD2-OG 3.07Å
2012	G	87	Confident	85.7	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.148	C	C	.	.	S	Bend	trans	78.1	7.9	-177.9	0	0	0	0	0	114.5	C2009 W2010 I2030 S2031 S2033 I2035	C2009-G2012 PolarHBondContact O-N 3.09Å; W2010-G2012 VanDerWaalsContact C-N 3.31Å; W2010-G2012 PolarHBondContact O-N 3.32Å; G2012-I2030 PolarHBondContact O-N 3.07Å; G2012-I2030 VanDerWaalsContact O-N 3.14Å; G2012-S2031 CarbonylContact C-O 3.48Å; G2012-S2031 WeakPolarHBondContact CA-O 3.34Å; G2012-S2031 PolarHBondContact O-N 3.15Å; G2012-S2033 VanDerWaalsContact CA-O 3.24Å; G2012-S2033 WeakPolarHBondContact CA-O 3.39Å; G2012-I2035 VanDerWaalsContact C-CD1 3.42Å
2013	S	91.3	Very high	86.7	Confident	9 Å²	9	27.6 Å²	27.6	6%	0.063	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	148.6	176	76.5	0	0	0	0	113.3	C2009 D2011 H2015 L2028 I2035	C2009-S2013 WeakPolarHBondContact CB-O 3.02Å; C2009-S2013 PolarHBondContact N-O 2.93Å; D2011-S2013 VanDerWaalsContact C-N 3.29Å; D2011-S2013 VanDerWaalsContact CG-OG 3.25Å; D2011-S2013 PolarHBondContact O-N 3Å; D2011-S2013 VanDerWaalsContact OD1-CB 3.28Å; D2011-S2013 WeakPolarHBondContact OD1-CB 3.35Å; D2011-S2013 PolarHBondContact OD1-N 3.15Å; D2011-S2013 PolarHBondContact OD1-OG 3.16Å; D2011-S2013 PolarHBondContact OD2-OG 3.07Å; S2013-H2015 PolarHBondContact OG-CE1 3.39Å; S2013-H2015 VanDerWaalsContact OG-CE1 3.31Å; S2013-H2015 PolarHBondContact OG-NE2 3.11Å; S2013-L2028 CarbonylContact C-O 3.56Å; S2013-L2028 VanDerWaalsContact CA-O 3.24Å; S2013-L2028 WeakPolarHBondContact CA-O 3.32Å; S2013-I2035 VanDerWaalsContact O-CD1 3.32Å; S2013-I2035 WeakPolarHBondContact O-CD1 3.27Å
2014	V	92.1	Very high	87	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	123.8	170	-179.1	0	0	0	0	109.5	A2006 V2007 F2016 S2027 L2028 I2030 I2035 L2038 L2048 I2050	A2006-V2014 HydrophobicContact CB-CG1 4.34Å; V2007-V2014 CarbonylContact O-C 3.56Å; V2007-V2014 VanDerWaalsContact O-CA 3.24Å; V2007-V2014 WeakPolarHBondContact O-CA 3.39Å; V2007-V2014 WeakPolarHBondContact O-CG1 3.34Å; V2014-F2016 HydrophobicContact CB-CE2 4.31Å; V2014-F2016 HydrophobicContact CB-CZ 4.42Å; V2014-F2016 HydrophobicContact CG1-CD2 4.46Å; V2014-F2016 HydrophobicContact CG1-CE1 4.15Å; V2014-F2016 HydrophobicContact CG1-CE2 3.81Å; V2014-F2016 HydrophobicContact CG1-CZ 3.62Å; V2014-S2027 CarbonylContact O-C 3.59Å; V2014-S2027 WeakPolarHBondContact O-CA 3.4Å; V2014-L2028 PolarHBondContact N-O 3.07Å; V2014-L2028 PolarHBondContact O-N 3.15Å; V2014-I2030 HydrophobicContact CB-CD1 3.71Å; V2014-I2030 HydrophobicContact CG2-CD1 3.46Å; V2014-I2030 VanDerWaalsContact CG2-CD1 3.44Å; V2014-I2030 HydrophobicContact CG2-CG1 4.38Å; V2014-I2035 HydrophobicContact CB-CD1 4.36Å; V2014-I2035 HydrophobicContact CG2-CD1 3.69Å; V2014-I2035 VanDerWaalsContact CG2-CD1 3.44Å; V2014-I2035 HydrophobicContact CG2-CG1 4.18Å; V2014-L2038 HydrophobicContact CG1-CD1 4.26Å; V2014-L2038 HydrophobicContact CG1-CD2 4.41Å; V2014-L2038 HydrophobicContact CG2-CD2 4.08Å; V2014-L2048 HydrophobicContact CG1-CD2 4.43Å; V2014-I2050 HydrophobicContact CG2-CD1 4.17Å; V2014-I2050 HydrophobicContact CG2-CG1 4.4Å; V2014-I2050 HydrophobicContact CG2-CG2 4.4Å
2015	H	91.8	Very high	87	Confident	24.4 Å²	24.4	36.4 Å²	36.4	11%	0.113	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	139.9	176.1	-59.3	-62.9	0	0	0	111	I1974 A2006 V2007 C2009 S2013 Y2017 W2024 S2027	I1974-H2015 VanDerWaalsContact CG2-CD2 3.49Å; I1974-H2015 WeakPolarHBondContact CG2-CD2 3.34Å; A2006-H2015 CarbonylContact C-O 3.56Å; A2006-H2015 WeakPolarHBondContact CA-O 3.39Å; V2007-H2015 HydrophobicContact CB-CB 4.41Å; V2007-H2015 PolarHBondContact N-O 3.14Å; V2007-H2015 PolarHBondContact O-N 3.12Å; C2009-H2015 VanDerWaalsContact SG-CD2 3.53Å; S2013-H2015 PolarHBondContact OG-CE1 3.39Å; S2013-H2015 VanDerWaalsContact OG-CE1 3.31Å; S2013-H2015 PolarHBondContact OG-NE2 3.11Å; H2015-Y2017 HydrophobicContact CB-CD2 4.48Å; H2015-Y2017 HydrophobicContact CB-CE2 3.75Å; H2015-W2024 AromaticContact ND1-NE1 3.98Å; H2015-S2027 PolarHBondContact CE1-OG 3.02Å; H2015-S2027 VanDerWaalsContact CE1-OG 3.26Å; H2015-S2027 WeakPolarHBondContact ND1-CB 3.33Å; H2015-S2027 PolarHBondContact ND1-OG 3.18Å
2016	F	90.8	Very high	86.8	Confident	0.6 Å²	0.6	40.3 Å²	40.3	0%	0.003	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	131.8	178.9	-61.5	-85.7	0	0	0	110.6	V2004 L2005 A2006 V2014 I2025 K2026 L2028 L2048 L2060 F2065	V2004-F2016 HydrophobicContact CG1-CB 4.31Å; V2004-F2016 HydrophobicContact CG1-CD1 4.12Å; L2005-F2016 CarbonylContact O-C 3.5Å; L2005-F2016 WeakPolarHBondContact O-CA 3.37Å; A2006-F2016 HydrophobicContact CB-CD1 4.04Å; A2006-F2016 HydrophobicContact CB-CE1 3.88Å; V2014-F2016 HydrophobicContact CB-CE2 4.31Å; V2014-F2016 HydrophobicContact CB-CZ 4.42Å; V2014-F2016 HydrophobicContact CG1-CD2 4.46Å; V2014-F2016 HydrophobicContact CG1-CE1 4.15Å; V2014-F2016 HydrophobicContact CG1-CE2 3.81Å; V2014-F2016 HydrophobicContact CG1-CZ 3.62Å; F2016-I2025 HydrophobicContact CB-CB 4.16Å; F2016-I2025 HydrophobicContact CB-CD1 4.45Å; F2016-I2025 WeakPolarHBondContact O-CB 3.2Å; F2016-I2025 PolarHBondContact O-N 3.16Å; F2016-K2026 HydrophobicContact CD2-CB 4.39Å; F2016-K2026 PolarHBondContact N-O 3.03Å; F2016-L2028 HydrophobicContact CE2-CD1 3.78Å; F2016-L2028 HydrophobicContact CE2-CG 4.06Å; F2016-L2028 HydrophobicContact CZ-CD1 4.33Å; F2016-L2048 HydrophobicContact CE1-CD2 3.57Å; F2016-L2048 VanDerWaalsContact CE1-CD2 3.48Å; F2016-L2048 HydrophobicContact CZ-CD2 3.68Å; F2016-L2060 HydrophobicContact CZ-CD1 4.29Å; F2016-F2065 HydrophobicContact CB-CE1 4.29Å; F2016-F2065 AromaticContact CD1-CD1 3.97Å; F2016-F2065 HydrophobicContact CD1-CD1 4.15Å; F2016-F2065 AromaticContact CD1-CE1 3.52Å; F2016-F2065 HydrophobicContact CD1-CE1 3.52Å; F2016-F2065 VanDerWaalsContact CD1-CE1 3.43Å; F2016-F2065 HydrophobicContact CD1-CZ 4.44Å; F2016-F2065 AromaticContact CD2-CD1 3.97Å; F2016-F2065 HydrophobicContact CD2-CD1 4.11Å; F2016-F2065 AromaticContact CD2-CE1 3.91Å; F2016-F2065 HydrophobicContact CD2-CE1 4.05Å; F2016-F2065 AromaticContact CE1-CD1 3.83Å; F2016-F2065 HydrophobicContact CE1-CD1 3.98Å; F2016-F2065 AromaticContact CE1-CE1 3.73Å; F2016-F2065 HydrophobicContact CE1-CE1 3.73Å; F2016-F2065 AromaticContact CE2-CD1 3.91Å; F2016-F2065 HydrophobicContact CE2-CD1 3.97Å; F2016-F2065 AromaticContact CE2-CE1 3.95Å; F2016-F2065 HydrophobicContact CE2-CE1 4.26Å; F2016-F2065 HydrophobicContact CG-CD1 4.2Å; F2016-F2065 AromaticContact CG-CE1 3.68Å; F2016-F2065 HydrophobicContact CG-CE1 3.68Å; F2016-F2065 HydrophobicContact CG-CZ 4.41Å; F2016-F2065 AromaticContact CZ-CD1 3.89Å; F2016-F2065 HydrophobicContact CZ-CD1 3.89Å; F2016-F2065 AromaticContact CZ-CE1 3.85Å; F2016-F2065 HydrophobicContact CZ-CE1 4.1Å
2017	Y	89	Confident	86.6	Confident	25.6 Å²	25.6	42.6 Å²	42.6	10%	0.1	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	139.7	178.1	-66.4	-91.7	0	0	0	111	I1942 L1972 I1974 V2004 L2005 V2007 H2015 S2023 W2024	I1942-Y2017 HydrophobicContact CD1-CE2 4.41Å; L1972-Y2017 HydrophobicContact CD1-CD1 4.11Å; L1972-Y2017 HydrophobicContact CD1-CE1 4.3Å; L1972-Y2017 HydrophobicContact CD1-CG 4.34Å; I1974-Y2017 HydrophobicContact CD1-CE2 4Å; I1974-Y2017 WeakPolarHBondContact CG1-OH 3.5Å; V2004-Y2017 CarbonylContact C-O 3.55Å; V2004-Y2017 WeakPolarHBondContact CA-O 3.28Å; L2005-Y2017 PolarHBondContact N-O 3.21Å; L2005-Y2017 PolarHBondContact O-N 3.16Å; V2007-Y2017 HydrophobicContact CG2-CD2 4.11Å; V2007-Y2017 HydrophobicContact CG2-CE2 4.23Å; H2015-Y2017 HydrophobicContact CB-CD2 4.48Å; H2015-Y2017 HydrophobicContact CB-CE2 3.75Å; Y2017-S2023 WeakPolarHBondContact CA-O 3.35Å; Y2017-W2024 HydrophobicContact CD1-CB 4.15Å; Y2017-W2024 HydrophobicContact CE1-CB 3.85Å; Y2017-W2024 HydrophobicContact CE1-CG 4.48Å
2018	S	85.5	Confident	86.4	Confident	22.6 Å²	22.6	44 Å²	44	16%	0.158	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	128.3	171.2	169.9	0	0	0	0	109.1	I2020 S2021 M2022 S2023	S2018-I2020 VanDerWaalsContact C-N 3.3Å; S2018-I2020 PolarHBondContact O-N 2.94Å; S2018-I2020 PolarHBondContact OG-N 3Å; S2018-S2021 VanDerWaalsContact CB-OG 3.3Å; S2018-S2021 WeakPolarHBondContact CB-OG 3.33Å; S2018-S2021 PolarHBondContact OG-N 2.93Å; S2018-S2021 PolarHBondContact OG-OG 3.03Å; S2018-S2021 VanDerWaalsContact OG-OG 3.09Å; S2018-M2022 WeakPolarHBondContact O-CA 3.35Å; S2018-M2022 PolarHBondContact O-N 2.99Å; S2018-S2023 PolarHBondContact N-O 2.87Å
2019	L	81.6	Confident	86.3	Confident	6.2 Å²	6.2	48.1 Å²	48.1	3%	0.032	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-19.9	178.7	-70.2	166.1	0	0	0	113.3	R1930 L1932 L1944 F1983 D2003 L2005 M2022	R1930-L2019 PolarHBondContact NH1-O 2.73Å; L1932-L2019 HydrophobicContact CD2-CD2 3.98Å; L1944-L2019 HydrophobicContact CD1-CD2 4.37Å; F1983-L2019 HydrophobicContact CD1-CD1 3.67Å; F1983-L2019 HydrophobicContact CE1-CD1 3.65Å; F1983-L2019 HydrophobicContact CE1-CD2 3.79Å; F1983-L2019 HydrophobicContact CE1-CG 4.28Å; D2003-L2019 HydrophobicContact CB-CB 3.94Å; D2003-L2019 HydrophobicContact CB-CD1 3.93Å; D2003-L2019 HydrophobicContact CB-CG 4.41Å; D2003-L2019 WeakPolarHBondContact O-CB 3.29Å; D2003-L2019 PolarHBondContact O-N 2.99Å; L2005-L2019 HydrophobicContact CB-CD2 4.27Å; L2005-L2019 HydrophobicContact CB-CG 4.45Å; L2005-L2019 HydrophobicContact CD2-CD2 4.48Å; L2019-M2022 HydrophobicContact CD2-CE 4.15Å; L2019-M2022 HydrophobicContact CD2-SD 4.46Å; L2019-M2022 WeakPolarHBondContact O-CE 3.46Å
2020	I	77.3	Confident	86	Confident	91.8 Å²	91.8	49.8 Å²	49.8	47%	0.471	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-55.3	178.8	-61.8	167.2	0	0	0	109.5	R1930 L2001 S2018 M2022	R1930-I2020 VanDerWaalsContact NH2-CG1 3.28Å; L2001-I2020 HydrophobicContact CB-CD1 4.3Å; L2001-I2020 VanDerWaalsContact O-CD1 3.31Å; L2001-I2020 WeakPolarHBondContact O-CD1 3.41Å; S2018-I2020 VanDerWaalsContact C-N 3.3Å; S2018-I2020 PolarHBondContact O-N 2.94Å; S2018-I2020 PolarHBondContact OG-N 3Å; I2020-M2022 VanDerWaalsContact C-N 3.35Å
2021	S	76.4	Confident	85.8	Confident	70.6 Å²	70.6	45 Å²	45	49%	0.494	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-13.8	-178.7	55.4	0	0	0	0	113.1	S2018 S2023	S2018-S2021 VanDerWaalsContact CB-OG 3.3Å; S2018-S2021 WeakPolarHBondContact CB-OG 3.33Å; S2018-S2021 PolarHBondContact OG-N 2.93Å; S2018-S2021 PolarHBondContact OG-OG 3.03Å; S2018-S2021 VanDerWaalsContact OG-OG 3.09Å; S2021-S2023 PolarHBondContact O-N 2.97Å; S2021-S2023 VanDerWaalsContact O-N 3.11Å; S2021-S2023 WeakPolarHBondContact OG-CB 3.42Å; S2021-S2023 PolarHBondContact OG-N 2.96Å; S2021-S2023 PolarHBondContact OG-OG 3.04Å
2022	M	78.3	Confident	85.5	Confident	47 Å²	47	46.9 Å²	46.9	23%	0.232	27%	0.269	C	S	.	.			trans	52.2	23.4	-167.6	-67.6	-69	-175.8	0	0	113	L1944 K1970 L1972 S2018 L2019 I2020	L1944-M2022 HydrophobicContact CD1-CE 3.4Å; L1944-M2022 HydrophobicContact CD1-SD 3.74Å; K1970-M2022 HydrophobicContact CD-CB 4.44Å; K1970-M2022 HydrophobicContact CD-CE 4.04Å; K1970-M2022 HydrophobicContact CD-CG 3.81Å; K1970-M2022 HydrophobicContact CD-SD 4.29Å; K1970-M2022 VanDerWaalsContact NZ-CB 3.25Å; L1972-M2022 HydrophobicContact CD1-SD 4.49Å; S2018-M2022 WeakPolarHBondContact O-CA 3.35Å; S2018-M2022 PolarHBondContact O-N 2.99Å; L2019-M2022 HydrophobicContact CD2-CE 4.15Å; L2019-M2022 HydrophobicContact CD2-SD 4.46Å; L2019-M2022 WeakPolarHBondContact O-CE 3.46Å; I2020-M2022 VanDerWaalsContact C-N 3.35Å
2023	S	82.1	Confident	85.3	Confident	56.6 Å²	56.6	47.6 Å²	47.6	40%	0.396	27%	0.274	S	S	.	.			trans	-92.9	145.3	179.1	67.5	0	0	0	0	110.4	Y2017 S2018 S2021 I2025	Y2017-S2023 WeakPolarHBondContact CA-O 3.35Å; S2018-S2023 PolarHBondContact N-O 2.87Å; S2021-S2023 PolarHBondContact O-N 2.97Å; S2021-S2023 VanDerWaalsContact O-N 3.11Å; S2021-S2023 WeakPolarHBondContact OG-CB 3.42Å; S2021-S2023 PolarHBondContact OG-N 2.96Å; S2021-S2023 PolarHBondContact OG-OG 3.04Å; S2023-I2025 PolarHBondContact O-N 3.16Å
2024	W	83.9	Confident	85.1	Confident	146.4 Å²	146.4	47.8 Å²	47.8	56%	0.555	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.9	130.9	165.7	170.4	85.6	0	0	0	109.4	H2015 Y2017 K2026 S2027	H2015-W2024 AromaticContact ND1-NE1 3.98Å; Y2017-W2024 HydrophobicContact CD1-CB 4.15Å; Y2017-W2024 HydrophobicContact CE1-CB 3.85Å; Y2017-W2024 HydrophobicContact CE1-CG 4.48Å; W2024-K2026 VanDerWaalsContact CE2-C 3.44Å; W2024-K2026 VanDerWaalsContact CZ2-C 3.48Å; W2024-K2026 VanDerWaalsContact CZ2-CA 3.47Å; W2024-K2026 PolarHBondContact NE1-O 3Å; W2024-K2026 VanDerWaalsContact NE1-O 3.11Å; W2024-S2027 VanDerWaalsContact CZ2-N 3.3Å
2025	I	85.5	Confident	85	Confident	60.8 Å²	60.8	47.8 Å²	47.8	31%	0.312	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	-56.3	178	-57.5	171.4	0	0	0	109.3	V2004 F2016 S2023 F2065	V2004-I2025 HydrophobicContact CG1-CD1 4Å; V2004-I2025 HydrophobicContact CG2-CD1 3.93Å; F2016-I2025 HydrophobicContact CB-CB 4.16Å; F2016-I2025 HydrophobicContact CB-CD1 4.45Å; F2016-I2025 WeakPolarHBondContact O-CB 3.2Å; F2016-I2025 PolarHBondContact O-N 3.16Å; S2023-I2025 PolarHBondContact O-N 3.16Å; I2025-F2065 HydrophobicContact CG2-CE2 4.17Å; I2025-F2065 HydrophobicContact CG2-CZ 4.26Å
2026	K	86	Confident	84.7	Confident	83.6 Å²	83.6	47.2 Å²	47.2	36%	0.363	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	156.9	-172.1	-158.7	171.2	-175.4	-176.3	0	111.1	F2016 W2024 L2028 F2065	F2016-K2026 HydrophobicContact CD2-CB 4.39Å; F2016-K2026 PolarHBondContact N-O 3.03Å; W2024-K2026 VanDerWaalsContact CE2-C 3.44Å; W2024-K2026 VanDerWaalsContact CZ2-C 3.48Å; W2024-K2026 VanDerWaalsContact CZ2-CA 3.47Å; W2024-K2026 PolarHBondContact NE1-O 3Å; W2024-K2026 VanDerWaalsContact NE1-O 3.11Å; K2026-L2028 HydrophobicContact CD-CD2 4.08Å; K2026-L2028 HydrophobicContact CG-CD2 4.33Å; K2026-F2065 HydrophobicContact CD-CB 4.26Å; K2026-F2065 HydrophobicContact CD-CD2 4.18Å; K2026-F2065 HydrophobicContact CD-CG 4.15Å
2027	S	88.5	Confident	84.6	Confident	47.6 Å²	47.6	47.8 Å²	47.8	33%	0.333	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	135	168.8	-175.5	0	0	0	0	108.6	V2014 H2015 W2024	V2014-S2027 CarbonylContact O-C 3.59Å; V2014-S2027 WeakPolarHBondContact O-CA 3.4Å; H2015-S2027 PolarHBondContact CE1-OG 3.02Å; H2015-S2027 VanDerWaalsContact CE1-OG 3.26Å; H2015-S2027 WeakPolarHBondContact ND1-CB 3.33Å; H2015-S2027 PolarHBondContact ND1-OG 3.18Å; W2024-S2027 VanDerWaalsContact CZ2-N 3.3Å
2028	L	88.9	Confident	84.7	Confident	30 Å²	30	47 Å²	47	16%	0.157	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	126.2	176.8	-61.3	178.5	0	0	0	108.9	S2013 V2014 F2016 K2026 I2030 L2060 F2065	S2013-L2028 CarbonylContact C-O 3.56Å; S2013-L2028 VanDerWaalsContact CA-O 3.24Å; S2013-L2028 WeakPolarHBondContact CA-O 3.32Å; V2014-L2028 PolarHBondContact N-O 3.07Å; V2014-L2028 PolarHBondContact O-N 3.15Å; F2016-L2028 HydrophobicContact CE2-CD1 3.78Å; F2016-L2028 HydrophobicContact CE2-CG 4.06Å; F2016-L2028 HydrophobicContact CZ-CD1 4.33Å; K2026-L2028 HydrophobicContact CD-CD2 4.08Å; K2026-L2028 HydrophobicContact CG-CD2 4.33Å; L2028-I2030 HydrophobicContact CB-CD1 3.97Å; L2028-I2030 HydrophobicContact CB-CG1 3.93Å; L2028-I2030 PolarHBondContact O-N 3.13Å; L2028-L2060 HydrophobicContact CD1-CD1 4.09Å; L2028-L2060 HydrophobicContact CD1-CD2 4.29Å; L2028-F2065 HydrophobicContact CD1-CB 4.26Å; L2028-F2065 HydrophobicContact CD1-CD1 4.41Å
2029	A	88.1	Confident	84.9	Confident	85.2 Å²	85.2	46.5 Å²	46.5	70%	0.704	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.5	105.9	166.7	0	0	0	0	0	107.8
2030	I	85	Confident	85.3	Confident	35.2 Å²	35.2	47.2 Å²	47.2	18%	0.181	28%	0.276	C	S	.	.			trans	-100	-43	-169.7	-66	153.6	0	0	0	111.1	G2012 V2014 L2028 I2050 F2058 L2060	G2012-I2030 PolarHBondContact O-N 3.07Å; G2012-I2030 VanDerWaalsContact O-N 3.14Å; V2014-I2030 HydrophobicContact CB-CD1 3.71Å; V2014-I2030 HydrophobicContact CG2-CD1 3.46Å; V2014-I2030 VanDerWaalsContact CG2-CD1 3.44Å; V2014-I2030 HydrophobicContact CG2-CG1 4.38Å; L2028-I2030 HydrophobicContact CB-CD1 3.97Å; L2028-I2030 HydrophobicContact CB-CG1 3.93Å; L2028-I2030 PolarHBondContact O-N 3.13Å; I2030-I2050 HydrophobicContact CB-CD1 4.44Å; I2030-I2050 HydrophobicContact CD1-CD1 3.46Å; I2030-I2050 VanDerWaalsContact CD1-CD1 3.46Å; I2030-I2050 HydrophobicContact CD1-CG1 4.44Å; I2030-I2050 HydrophobicContact CG1-CD1 4.36Å; I2030-I2050 HydrophobicContact CG2-CD1 4.19Å; I2030-I2050 HydrophobicContact CG2-CG2 4.28Å; I2030-F2058 HydrophobicContact CG2-CB 4.14Å; I2030-F2058 HydrophobicContact CG2-CD1 4.21Å; I2030-F2058 HydrophobicContact CG2-CD2 3.93Å; I2030-F2058 HydrophobicContact CG2-CE1 4.19Å; I2030-F2058 HydrophobicContact CG2-CE2 4.26Å; I2030-F2058 HydrophobicContact CG2-CG 3.84Å; I2030-F2058 HydrophobicContact CG2-CZ 4.44Å; I2030-L2060 HydrophobicContact CD1-CD1 3.95Å; I2030-L2060 HydrophobicContact CG1-CD1 4.38Å
2031	S	84.3	Confident	85.6	Confident	19 Å²	19	43.1 Å²	43.1	13%	0.133	26%	0.255	C	S	.	.			trans	-125.5	161	175.9	-174.4	0	0	0	0	110	G2012 S2033 D2052	G2012-S2031 CarbonylContact C-O 3.48Å; G2012-S2031 WeakPolarHBondContact CA-O 3.34Å; G2012-S2031 PolarHBondContact O-N 3.15Å; S2031-S2033 VanDerWaalsContact C-N 3.3Å; S2031-S2033 PolarHBondContact OG-N 3.01Å; S2031-S2033 VanDerWaalsContact OG-N 3.1Å; S2031-S2033 PolarHBondContact OG-OG 2.96Å; S2031-D2052 VanDerWaalsContact CB-OD2 3.28Å; S2031-D2052 WeakPolarHBondContact CB-OD2 3.31Å; S2031-D2052 PolarHBondContact OG-OD2 3.03Å
2032	S	82.1	Confident	85.6	Confident	122.6 Å²	122.6	42 Å²	42	86%	0.857	25%	0.246	S	C	*	.	S	Bend	trans	-82.1	-9.2	165.3	50.9	0	0	0	0	112.5
2033	S	83.6	Confident	85.1	Confident	14.4 Å²	14.4	42.3 Å²	42.3	10%	0.101	25%	0.249	C	C	.	.	S	Bend	trans	-107.7	158.6	-179.8	124.6	0	0	0	0	111.6	G2012 S2031 I2035 D2052 R2053 E2054	G2012-S2033 VanDerWaalsContact CA-O 3.24Å; G2012-S2033 WeakPolarHBondContact CA-O 3.39Å; S2031-S2033 VanDerWaalsContact C-N 3.3Å; S2031-S2033 PolarHBondContact OG-N 3.01Å; S2031-S2033 VanDerWaalsContact OG-N 3.1Å; S2031-S2033 PolarHBondContact OG-OG 2.96Å; S2033-I2035 PolarHBondContact O-N 2.86Å; S2033-D2052 VanDerWaalsContact OG-CB 3.22Å; S2033-D2052 WeakPolarHBondContact OG-CB 3.37Å; S2033-D2052 PolarHBondContact OG-OD2 3.13Å; S2033-R2053 WeakPolarHBondContact OG-CB 3.36Å; S2033-R2053 PolarHBondContact OG-N 3.18Å; S2033-E2054 PolarHBondContact OG-OE1 2.92Å
2034	A	86.6	Confident	84.4	Confident	13.4 Å²	13.4	41.7 Å²	41.7	11%	0.111	24%	0.242	C	C	.	.			trans	-60.3	136.8	-176.6	0	0	0	0	0	112	W2010 C2036 D2052 R2053 P2094	W2010-A2034 HydrophobicContact CB-CB 4.44Å; W2010-A2034 HydrophobicContact CD2-CB 4.13Å; W2010-A2034 HydrophobicContact CG-CB 4.25Å; W2010-A2034 VanDerWaalsContact O-CA 3.28Å; W2010-A2034 WeakPolarHBondContact O-CA 3.29Å; W2010-A2034 WeakPolarHBondContact O-CB 3.32Å; A2034-C2036 PolarHBondContact O-N 3Å; A2034-D2052 CarbonylContact O-C 3.49Å; A2034-D2052 VanDerWaalsContact O-CA 3.24Å; A2034-D2052 WeakPolarHBondContact O-CA 3.35Å; A2034-R2053 HydrophobicContact CB-CB 4.48Å; A2034-R2053 PolarHBondContact O-N 2.98Å; A2034-P2094 HydrophobicContact CB-CB 4.25Å; A2034-P2094 HydrophobicContact CB-CG 4.3Å
2035	I	89.3	Confident	83.8	Confident	0.2 Å²	0.2	34.8 Å²	34.8	0%	0.001	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	122.1	175	-57	-89.8	0	0	0	109	N1979 C2009 G2012 S2013 V2014 S2033 L2038 I2050 L2051 D2052 Q2096	N1979-I2035 VanDerWaalsContact CB-O 3.31Å; N1979-I2035 WeakPolarHBondContact CB-O 3.37Å; N1979-I2035 PolarHBondContact ND2-O 2.91Å; C2009-I2035 PolarHBondContact O-N 3.12Å; C2009-I2035 VanDerWaalsContact O-N 3.09Å; G2012-I2035 VanDerWaalsContact C-CD1 3.42Å; S2013-I2035 VanDerWaalsContact O-CD1 3.32Å; S2013-I2035 WeakPolarHBondContact O-CD1 3.27Å; V2014-I2035 HydrophobicContact CB-CD1 4.36Å; V2014-I2035 HydrophobicContact CG2-CD1 3.69Å; V2014-I2035 VanDerWaalsContact CG2-CD1 3.44Å; V2014-I2035 HydrophobicContact CG2-CG1 4.18Å; S2033-I2035 PolarHBondContact O-N 2.86Å; I2035-L2038 HydrophobicContact CG2-CD2 4.08Å; I2035-L2038 HydrophobicContact CG2-CG 4.15Å; I2035-I2050 HydrophobicContact CD1-CG2 3.9Å; I2035-I2050 HydrophobicContact CG1-CG2 4.37Å; I2035-I2050 HydrophobicContact CG2-CG2 3.86Å; I2035-L2051 CarbonylContact C-O 3.48Å; I2035-D2052 HydrophobicContact CD1-CB 4.42Å; I2035-Q2096 PolarHBondContact O-OE1 3.33Å
2036	C	86	Confident	83.5	Confident	12.6 Å²	12.6	37.9 Å²	37.9	9%	0.085	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	-42.1	-179.4	-68.8	0	0	0	0	112.2	N1979 A2034 L2051 R2053 P2094 Q2096 G2098	N1979-C2036 WeakPolarHBondContact ND2-CA 3.07Å; A2034-C2036 PolarHBondContact O-N 3Å; C2036-L2051 HydrophobicContact CB-CG 4.43Å; C2036-L2051 PolarHBondContact N-O 3.08Å; C2036-R2053 VanDerWaalsContact SG-CA 3.58Å; C2036-R2053 WeakPolarHBondContact SG-CA 3.43Å; C2036-R2053 PolarHBondContact SG-N 3.1Å; C2036-R2053 VanDerWaalsContact SG-N 3.38Å; C2036-P2094 WeakPolarHBondContact CB-O 3.38Å; C2036-P2094 PolarHBondContact SG-O 3.2Å; C2036-Q2096 HydrophobicContact CB-CB 4.01Å; C2036-Q2096 VanDerWaalsContact SG-CB 3.55Å; C2036-Q2096 PolarHBondContact SG-O 3.07Å; C2036-G2098 WeakPolarHBondContact CB-O 3.32Å
2037	S	88.2	Confident	83.4	Confident	12 Å²	12	35.2 Å²	35.2	8%	0.084	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	151.3	-174.7	-167.3	0	0	0	0	112.5	I2050 L2051 G2098 L2100	S2037-I2050 WeakPolarHBondContact O-CA 3.4Å; S2037-L2051 PolarHBondContact N-O 3.1Å; S2037-L2051 PolarHBondContact O-N 3.26Å; S2037-G2098 WeakPolarHBondContact CB-O 3.4Å; S2037-L2100 VanDerWaalsContact C-CD2 3.48Å; S2037-L2100 VanDerWaalsContact O-CD2 3.25Å; S2037-L2100 WeakPolarHBondContact O-CD2 3.28Å; S2037-L2100 PolarHBondContact OG-N 3.07Å
2038	L	91.3	Very high	83.4	Confident	9.6 Å²	9.6	33 Å²	33	5%	0.05	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	132.5	177.1	-70	178.6	0	0	0	109.3	S1980 S1982 A2006 G2008 V2014 I2035 L2048 A2049 I2050	S1980-L2038 WeakPolarHBondContact OG-CD1 3.48Å; S1980-L2038 VanDerWaalsContact OG-CG 3.3Å; S1980-L2038 WeakPolarHBondContact OG-CG 3.3Å; S1980-L2038 PolarHBondContact OG-N 2.83Å; S1982-L2038 WeakPolarHBondContact CB-O 3.33Å; S1982-L2038 PolarHBondContact OG-O 2.85Å; A2006-L2038 HydrophobicContact CB-CD1 4.14Å; G2008-L2038 VanDerWaalsContact N-CD1 3.28Å; V2014-L2038 HydrophobicContact CG1-CD1 4.26Å; V2014-L2038 HydrophobicContact CG1-CD2 4.41Å; V2014-L2038 HydrophobicContact CG2-CD2 4.08Å; I2035-L2038 HydrophobicContact CG2-CD2 4.08Å; I2035-L2038 HydrophobicContact CG2-CG 4.15Å; L2038-L2048 HydrophobicContact CB-CD1 4.41Å; L2038-L2048 HydrophobicContact CD2-CD1 4.36Å; L2038-A2049 WeakPolarHBondContact CA-O 3.25Å; L2038-I2050 HydrophobicContact CD2-CB 3.99Å; L2038-I2050 HydrophobicContact CD2-CD1 4.3Å; L2038-I2050 HydrophobicContact CD2-CG1 3.5Å; L2038-I2050 VanDerWaalsContact CD2-CG1 3.49Å; L2038-I2050 HydrophobicContact CD2-CG2 3.87Å
2039	A	90.3	Very high	83.5	Confident	11.2 Å²	11.2	31.6 Å²	31.6	9%	0.093	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	132.9	172.9	0	0	0	0	0	111	L2048 A2049 L2100 F2102	A2039-L2048 WeakPolarHBondContact O-CA 3.31Å; A2039-L2048 WeakPolarHBondContact O-CD1 3.26Å; A2039-A2049 PolarHBondContact N-O 3.21Å; A2039-A2049 VanDerWaalsContact N-O 3.09Å; A2039-A2049 PolarHBondContact O-N 3.15Å; A2039-L2100 HydrophobicContact CB-CB 3.99Å; A2039-L2100 HydrophobicContact CB-CD1 3.33Å; A2039-L2100 HydrophobicContact CB-CG 4.41Å; A2039-F2102 HydrophobicContact CB-CD2 3.92Å; A2039-F2102 HydrophobicContact CB-CE2 4.22Å; A2039-F2102 VanDerWaalsContact O-CE2 3.31Å; A2039-F2102 WeakPolarHBondContact O-CE2 3.42Å
2040	Y	89.7	Confident	83.6	Confident	21.6 Å²	21.6	27.5 Å²	27.5	9%	0.085	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	144.3	165.9	-81.3	-75.7	0	0	0	110.9	S1982 F1983 R1984 A2006 L2047 L2048 A2062 F2102	S1982-Y2040 WeakPolarHBondContact O-CE2 3.29Å; S1982-Y2040 PolarHBondContact OG-N 2.99Å; F1983-Y2040 VanDerWaalsContact C-CD2 3.45Å; F1983-Y2040 WeakPolarHBondContact O-CD2 3.35Å; R1984-Y2040 HydrophobicContact CB-CD1 4.25Å; R1984-Y2040 HydrophobicContact CB-CD2 4.2Å; R1984-Y2040 HydrophobicContact CB-CE1 4.08Å; R1984-Y2040 HydrophobicContact CB-CE2 4.01Å; R1984-Y2040 HydrophobicContact CB-CG 4.3Å; R1984-Y2040 HydrophobicContact CG-CD1 4.16Å; R1984-Y2040 HydrophobicContact CG-CE1 4.16Å; R1984-Y2040 HydrophobicContact CG-CG 4.46Å; A2006-Y2040 HydrophobicContact CB-CE2 3.66Å; A2006-Y2040 WeakPolarHBondContact CB-OH 3.29Å; Y2040-L2047 WeakPolarHBondContact CA-O 3.31Å; Y2040-L2048 HydrophobicContact CD1-CB 4.09Å; Y2040-L2048 HydrophobicContact CD1-CD1 4.08Å; Y2040-L2048 HydrophobicContact CD2-CD1 4.06Å; Y2040-L2048 HydrophobicContact CE1-CB 3.89Å; Y2040-L2048 HydrophobicContact CE1-CD1 4.01Å; Y2040-L2048 HydrophobicContact CE1-CD2 4.4Å; Y2040-L2048 HydrophobicContact CE1-CG 4.36Å; Y2040-L2048 HydrophobicContact CE2-CD1 4Å; Y2040-L2048 HydrophobicContact CG-CD1 4.12Å; Y2040-A2062 HydrophobicContact CD1-CB 4.24Å; Y2040-A2062 HydrophobicContact CE1-CB 3.69Å; Y2040-F2102 WeakPolarHBondContact O-CD2 3.31Å
2041	S	84.7	Confident	83.7	Confident	5.2 Å²	5.2	25.8 Å²	25.8	4%	0.036	15%	0.148	C	C	.	.			trans	-70	143	174.2	63.2	0	0	0	0	111.8	N2043 G2045 R2046 L2047	S2041-N2043 WeakPolarHBondContact CB-OD1 3.31Å; S2041-N2043 PolarHBondContact O-N 2.98Å; S2041-N2043 PolarHBondContact OG-OD1 2.85Å; S2041-G2045 WeakPolarHBondContact O-CA 3.29Å; S2041-G2045 PolarHBondContact O-N 3.12Å; S2041-R2046 PolarHBondContact OG-N 2.94Å; S2041-L2047 PolarHBondContact N-O 3.13Å; S2041-L2047 PolarHBondContact OG-N 3.12Å; S2041-L2047 VanDerWaalsContact OG-N 3.11Å; S2041-L2047 PolarHBondContact OG-O 3.02Å
2042	P	74.9	Confident	83.7	Confident	47 Å²	47	25 Å²	25	31%	0.305	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-17.1	179.6	26.6	-35	0	0	0	113.9	N2044 K2104 P2105 G2107	P2042-N2044 VanDerWaalsContact C-N 3.3Å; P2042-N2044 PolarHBondContact O-N 3.14Å; P2042-K2104 HydrophobicContact CB-CG 4.35Å; P2042-P2105 WeakPolarHBondContact CB-O 3.28Å; P2042-P2105 VanDerWaalsContact CG-O 3.26Å; P2042-P2105 WeakPolarHBondContact CG-O 3.32Å; P2042-G2107 VanDerWaalsContact CG-CA 3.46Å; P2042-G2107 VanDerWaalsContact CG-N 3.32Å
2043	N	67.4	Low	83.6	Confident	54.4 Å²	54.4	25.6 Å²	25.6	29%	0.291	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	70.3	176.5	21.4	-7	0	0	0	112.4	S2041 G2045 R2046 T2106	S2041-N2043 WeakPolarHBondContact CB-OD1 3.31Å; S2041-N2043 PolarHBondContact O-N 2.98Å; S2041-N2043 PolarHBondContact OG-OD1 2.85Å; N2043-G2045 VanDerWaalsContact C-N 3.26Å; N2043-G2045 PolarHBondContact O-N 2.97Å; N2043-G2045 VanDerWaalsContact O-N 3.1Å; N2043-R2046 WeakPolarHBondContact O-CG 3.32Å; N2043-R2046 PolarHBondContact O-N 3.09Å; N2043-T2106 PolarHBondContact ND2-O 3.15Å; N2043-T2106 VanDerWaalsContact OD1-C 3.27Å; N2043-T2106 PolarHBondContact OD1-O 2.89Å
2044	N	67.5	Low	83.1	Confident	44.2 Å²	44.2	30 Å²	30	24%	0.236	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.7	14.9	-177.7	-66.1	19.7	0	0	0	114.4	R1984 N1987 P2042 R2046	R1984-N2044 PolarHBondContact NE-O 3.14Å; R1984-N2044 VanDerWaalsContact NE-O 3.1Å; R1984-N2044 PolarHBondContact NH2-O 3.12Å; R1984-N2044 VanDerWaalsContact NH2-O 3.16Å; N1987-N2044 HydrophobicContact CB-CB 4.42Å; N1987-N2044 VanDerWaalsContact CB-OD1 3.24Å; N1987-N2044 WeakPolarHBondContact CB-OD1 3.41Å; N1987-N2044 VanDerWaalsContact CG-OD1 3.24Å; N1987-N2044 PolarHBondContact ND2-OD1 3.39Å; P2042-N2044 VanDerWaalsContact C-N 3.3Å; P2042-N2044 PolarHBondContact O-N 3.14Å; N2044-R2046 HydrophobicContact CB-CG 4.35Å; N2044-R2046 PolarHBondContact O-N 3.19Å
2045	G	72.9	Confident	82.5	Confident	1.6 Å²	1.6	29.9 Å²	29.9	2%	0.016	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.3	31.5	-175.2	0	0	0	0	0	113.3	R1984 S2041 N2043 L2047 A2062	R1984-G2045 VanDerWaalsContact CZ-O 3.27Å; R1984-G2045 PolarHBondContact NE-O 3.09Å; R1984-G2045 VanDerWaalsContact NE-O 3.15Å; R1984-G2045 PolarHBondContact NH2-O 3.42Å; S2041-G2045 WeakPolarHBondContact O-CA 3.29Å; S2041-G2045 PolarHBondContact O-N 3.12Å; N2043-G2045 VanDerWaalsContact C-N 3.26Å; N2043-G2045 PolarHBondContact O-N 2.97Å; N2043-G2045 VanDerWaalsContact O-N 3.1Å; G2045-L2047 VanDerWaalsContact C-N 3.29Å; G2045-L2047 PolarHBondContact O-N 3.02Å; G2045-A2062 WeakPolarHBondContact O-CB 3.21Å
2046	R	77.4	Confident	82	Confident	125 Å²	125	31.7 Å²	31.7	47%	0.472	15%	0.153	S	C	.	.			trans	-64.4	-30.9	179	-76.1	-178.5	176.9	-179.7	1	112.6	S2041 N2043 N2044 A2062 E2459	S2041-R2046 PolarHBondContact OG-N 2.94Å; N2043-R2046 WeakPolarHBondContact O-CG 3.32Å; N2043-R2046 PolarHBondContact O-N 3.09Å; N2044-R2046 HydrophobicContact CB-CG 4.35Å; N2044-R2046 PolarHBondContact O-N 3.19Å; R2046-A2062 WeakPolarHBondContact O-CB 3.32Å; R2046-A2062 PolarHBondContact O-N 3.09Å; R2046-E2459 IonicContact NH1-OE2 3.72Å; R2046-E2459 PolarHBondContact NH1-OE2 3.14Å
2047	L	84.3	Confident	81.9	Confident	27.4 Å²	27.4	31.1 Å²	31.1	14%	0.143	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	141.7	178.2	-56.2	175.1	0	0	0	110	Y2040 S2041 G2045 I2059 L2060 L2068 F2102	Y2040-L2047 WeakPolarHBondContact CA-O 3.31Å; S2041-L2047 PolarHBondContact N-O 3.13Å; S2041-L2047 PolarHBondContact OG-N 3.12Å; S2041-L2047 VanDerWaalsContact OG-N 3.11Å; S2041-L2047 PolarHBondContact OG-O 3.02Å; G2045-L2047 VanDerWaalsContact C-N 3.29Å; G2045-L2047 PolarHBondContact O-N 3.02Å; L2047-I2059 HydrophobicContact CB-CG2 4.42Å; L2047-I2059 HydrophobicContact CD2-CG2 4.14Å; L2047-L2060 CarbonylContact C-O 3.59Å; L2047-L2060 WeakPolarHBondContact CA-O 3.39Å; L2047-L2068 HydrophobicContact CD2-CD1 3.4Å; L2047-L2068 VanDerWaalsContact CD2-CD1 3.43Å; L2047-F2102 HydrophobicContact CB-CZ 4.26Å
2048	L	89	Confident	81.8	Confident	0.6 Å²	0.6	31.2 Å²	31.2	0%	0.003	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	118.7	167.2	174.7	67.8	0	0	0	107.9	A2006 V2014 F2016 L2038 A2039 Y2040 I2050 L2060	A2006-L2048 HydrophobicContact CB-CD1 4.27Å; A2006-L2048 HydrophobicContact CB-CD2 4.2Å; V2014-L2048 HydrophobicContact CG1-CD2 4.43Å; F2016-L2048 HydrophobicContact CE1-CD2 3.57Å; F2016-L2048 VanDerWaalsContact CE1-CD2 3.48Å; F2016-L2048 HydrophobicContact CZ-CD2 3.68Å; L2038-L2048 HydrophobicContact CB-CD1 4.41Å; L2038-L2048 HydrophobicContact CD2-CD1 4.36Å; A2039-L2048 WeakPolarHBondContact O-CA 3.31Å; A2039-L2048 WeakPolarHBondContact O-CD1 3.26Å; Y2040-L2048 HydrophobicContact CD1-CB 4.09Å; Y2040-L2048 HydrophobicContact CD1-CD1 4.08Å; Y2040-L2048 HydrophobicContact CD2-CD1 4.06Å; Y2040-L2048 HydrophobicContact CE1-CB 3.89Å; Y2040-L2048 HydrophobicContact CE1-CD1 4.01Å; Y2040-L2048 HydrophobicContact CE1-CD2 4.4Å; Y2040-L2048 HydrophobicContact CE1-CG 4.36Å; Y2040-L2048 HydrophobicContact CE2-CD1 4Å; Y2040-L2048 HydrophobicContact CG-CD1 4.12Å; L2048-I2050 HydrophobicContact CD2-CD1 4.3Å; L2048-I2050 HydrophobicContact CD2-CG1 4.39Å; L2048-I2050 HydrophobicContact CG-CD1 4.17Å; L2048-I2050 HydrophobicContact CG-CG1 4.18Å; L2048-L2060 HydrophobicContact CB-CB 4.34Å; L2048-L2060 HydrophobicContact CD2-CD1 4.14Å; L2048-L2060 PolarHBondContact N-O 3.13Å; L2048-L2060 PolarHBondContact O-N 2.91Å
2049	A	90	Very high	81.6	Confident	0.2 Å²	0.2	30.8 Å²	30.8	0%	0.002	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	139.5	171.8	0	0	0	0	0	110	L2038 A2039 F2058 L2100 F2102 L2110	L2038-A2049 WeakPolarHBondContact CA-O 3.25Å; A2039-A2049 PolarHBondContact N-O 3.21Å; A2039-A2049 VanDerWaalsContact N-O 3.09Å; A2039-A2049 PolarHBondContact O-N 3.15Å; A2049-F2058 CarbonylContact C-O 3.55Å; A2049-F2058 WeakPolarHBondContact CA-O 3.4Å; A2049-L2100 VanDerWaalsContact C-CD1 3.46Å; A2049-L2100 HydrophobicContact CB-CD1 3.65Å; A2049-F2102 HydrophobicContact CB-CE2 3.65Å; A2049-F2102 HydrophobicContact CB-CZ 3.68Å; A2049-L2110 HydrophobicContact CB-CD1 3.67Å; A2049-L2110 HydrophobicContact CB-CD2 3.86Å; A2049-L2110 HydrophobicContact CB-CG 4.39Å
2050	I	90.5	Very high	81.4	Confident	0.4 Å²	0.4	30.6 Å²	30.6	0%	0.002	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	134.2	-175.3	-54.6	160.3	0	0	0	107.7	V2014 I2030 I2035 S2037 L2038 L2048 S2057 F2058 L2060 L2100	V2014-I2050 HydrophobicContact CG2-CD1 4.17Å; V2014-I2050 HydrophobicContact CG2-CG1 4.4Å; V2014-I2050 HydrophobicContact CG2-CG2 4.4Å; I2030-I2050 HydrophobicContact CB-CD1 4.44Å; I2030-I2050 HydrophobicContact CD1-CD1 3.46Å; I2030-I2050 VanDerWaalsContact CD1-CD1 3.46Å; I2030-I2050 HydrophobicContact CD1-CG1 4.44Å; I2030-I2050 HydrophobicContact CG1-CD1 4.36Å; I2030-I2050 HydrophobicContact CG2-CD1 4.19Å; I2030-I2050 HydrophobicContact CG2-CG2 4.28Å; I2035-I2050 HydrophobicContact CD1-CG2 3.9Å; I2035-I2050 HydrophobicContact CG1-CG2 4.37Å; I2035-I2050 HydrophobicContact CG2-CG2 3.86Å; S2037-I2050 WeakPolarHBondContact O-CA 3.4Å; L2038-I2050 HydrophobicContact CD2-CB 3.99Å; L2038-I2050 HydrophobicContact CD2-CD1 4.3Å; L2038-I2050 HydrophobicContact CD2-CG1 3.5Å; L2038-I2050 VanDerWaalsContact CD2-CG1 3.49Å; L2038-I2050 HydrophobicContact CD2-CG2 3.87Å; L2048-I2050 HydrophobicContact CD2-CD1 4.3Å; L2048-I2050 HydrophobicContact CD2-CG1 4.39Å; L2048-I2050 HydrophobicContact CG-CD1 4.17Å; L2048-I2050 HydrophobicContact CG-CG1 4.18Å; I2050-S2057 CarbonylContact O-C 3.51Å; I2050-S2057 WeakPolarHBondContact O-CA 3.36Å; I2050-F2058 HydrophobicContact CB-CB 4.31Å; I2050-F2058 PolarHBondContact N-O 3.07Å; I2050-F2058 PolarHBondContact O-N 3.15Å; I2050-L2060 HydrophobicContact CD1-CB 4.4Å; I2050-L2060 HydrophobicContact CD1-CD1 3.36Å; I2050-L2060 VanDerWaalsContact CD1-CD1 3.46Å; I2050-L2060 HydrophobicContact CD1-CG 3.86Å; I2050-L2060 VanDerWaalsContact CD1-CG 3.5Å; I2050-L2060 HydrophobicContact CG1-CD1 4.34Å; I2050-L2100 VanDerWaalsContact C-CD2 3.44Å
2051	L	87.6	Confident	80.9	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	131.6	174.2	178.7	61.6	0	0	0	109.2	I2035 C2036 S2037 Q2056 G2098 L2100 Q2112	I2035-L2051 CarbonylContact C-O 3.48Å; C2036-L2051 HydrophobicContact CB-CG 4.43Å; C2036-L2051 PolarHBondContact N-O 3.08Å; S2037-L2051 PolarHBondContact N-O 3.1Å; S2037-L2051 PolarHBondContact O-N 3.26Å; L2051-Q2056 WeakPolarHBondContact CA-O 3.27Å; L2051-G2098 VanDerWaalsContact CD2-C 3.45Å; L2051-G2098 WeakPolarHBondContact CD2-O 3.33Å; L2051-L2100 HydrophobicContact CB-CB 4.37Å; L2051-L2100 HydrophobicContact CB-CD1 3.56Å; L2051-L2100 HydrophobicContact CB-CD2 3.71Å; L2051-L2100 HydrophobicContact CB-CG 4.1Å; L2051-L2100 HydrophobicContact CD2-CB 4.45Å; L2051-L2100 HydrophobicContact CD2-CD2 4.28Å; L2051-L2100 HydrophobicContact CD2-CG 4.12Å; L2051-Q2112 HydrophobicContact CD1-CG 4.23Å; L2051-Q2112 VanDerWaalsContact CD1-NE2 3.27Å; L2051-Q2112 HydrophobicContact CD2-CG 4.1Å
2052	D	85	Confident	80.8	Confident	1.8 Å²	1.8	30.7 Å²	30.7	1%	0.01	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	173.2	173.7	81.5	1.2	0	0	0	112.5	S2031 S2033 A2034 I2035 E2054 G2055 Q2056 F2058	S2031-D2052 VanDerWaalsContact CB-OD2 3.28Å; S2031-D2052 WeakPolarHBondContact CB-OD2 3.31Å; S2031-D2052 PolarHBondContact OG-OD2 3.03Å; S2033-D2052 VanDerWaalsContact OG-CB 3.22Å; S2033-D2052 WeakPolarHBondContact OG-CB 3.37Å; S2033-D2052 PolarHBondContact OG-OD2 3.13Å; A2034-D2052 CarbonylContact O-C 3.49Å; A2034-D2052 VanDerWaalsContact O-CA 3.24Å; A2034-D2052 WeakPolarHBondContact O-CA 3.35Å; I2035-D2052 HydrophobicContact CD1-CB 4.42Å; D2052-E2054 PolarHBondContact O-N 3.16Å; D2052-E2054 WeakPolarHBondContact OD1-CA 3.36Å; D2052-E2054 WeakPolarHBondContact OD1-CB 3.41Å; D2052-E2054 PolarHBondContact OD1-N 3.33Å; D2052-E2054 VanDerWaalsContact OD1-N 3.08Å; D2052-G2055 PolarHBondContact O-N 2.98Å; D2052-G2055 VanDerWaalsContact O-N 3.16Å; D2052-G2055 PolarHBondContact OD1-N 3.13Å; D2052-G2055 VanDerWaalsContact OD1-N 3.13Å; D2052-Q2056 PolarHBondContact N-O 2.95Å; D2052-Q2056 VanDerWaalsContact N-O 3.09Å; D2052-Q2056 WeakPolarHBondContact OD1-CA 3.48Å; D2052-Q2056 WeakPolarHBondContact OD1-CB 3.39Å; D2052-Q2056 PolarHBondContact OD1-N 3.3Å; D2052-Q2056 PolarHBondContact OD2-OE1 3.27Å; D2052-F2058 HydrophobicContact CB-CE2 4.26Å
2053	R	79.4	Confident	80.8	Confident	135.4 Å²	135.4	31.2 Å²	31.2	51%	0.511	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-25.4	-179.4	-176.4	-178.5	174.2	-164.7	-1.8	113.2	S2033 A2034 C2036 G2055 Q2096 K2097 G2116	S2033-R2053 WeakPolarHBondContact OG-CB 3.36Å; S2033-R2053 PolarHBondContact OG-N 3.18Å; A2034-R2053 HydrophobicContact CB-CB 4.48Å; A2034-R2053 PolarHBondContact O-N 2.98Å; C2036-R2053 VanDerWaalsContact SG-CA 3.58Å; C2036-R2053 WeakPolarHBondContact SG-CA 3.43Å; C2036-R2053 PolarHBondContact SG-N 3.1Å; C2036-R2053 VanDerWaalsContact SG-N 3.38Å; R2053-G2055 PolarHBondContact O-N 3.1Å; R2053-Q2096 HydrophobicContact CG-CB 4.38Å; R2053-K2097 HydrophobicContact CG-CD 4.04Å; R2053-G2116 PolarHBondContact O-N 3.43Å
2054	E	73.5	Confident	81.1	Confident	107.2 Å²	107.2	31.5 Å²	31.5	50%	0.501	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	0.4	177.4	-61.8	-97.9	159.8	0	0	112.6	S2033 D2052 Q2056 G2116	S2033-E2054 PolarHBondContact OG-OE1 2.92Å; D2052-E2054 PolarHBondContact O-N 3.16Å; D2052-E2054 WeakPolarHBondContact OD1-CA 3.36Å; D2052-E2054 WeakPolarHBondContact OD1-CB 3.41Å; D2052-E2054 PolarHBondContact OD1-N 3.33Å; D2052-E2054 VanDerWaalsContact OD1-N 3.08Å; E2054-Q2056 VanDerWaalsContact C-N 3.31Å; E2054-Q2056 HydrophobicContact CB-CG 4.1Å; E2054-Q2056 PolarHBondContact O-N 2.9Å; E2054-Q2056 PolarHBondContact OE2-NE2 3.03Å; E2054-G2116 VanDerWaalsContact C-CA 3.47Å; E2054-G2116 VanDerWaalsContact O-CA 3.25Å; E2054-G2116 WeakPolarHBondContact O-CA 3.24Å; E2054-G2116 PolarHBondContact O-N 3.18Å
2055	G	74.1	Confident	81.6	Confident	10.6 Å²	10.6	31 Å²	31	11%	0.109	15%	0.145	C	C	.	.	S	Bend	trans	81.5	9.9	-178.6	0	0	0	0	0	114.1	D2052 R2053 S2057 Q2112 G2115	D2052-G2055 PolarHBondContact O-N 2.98Å; D2052-G2055 VanDerWaalsContact O-N 3.16Å; D2052-G2055 PolarHBondContact OD1-N 3.13Å; D2052-G2055 VanDerWaalsContact OD1-N 3.13Å; R2053-G2055 PolarHBondContact O-N 3.1Å; G2055-S2057 PolarHBondContact O-N 2.56Å; G2055-Q2112 PolarHBondContact O-NE2 2.88Å; G2055-G2115 VanDerWaalsContact CA-C 3.41Å; G2055-G2115 VanDerWaalsContact CA-CA 3.46Å; G2055-G2115 WeakPolarHBondContact CA-O 3.46Å
2056	Q	78.4	Confident	81.7	Confident	37.2 Å²	37.2	33.9 Å²	33.9	17%	0.174	16%	0.162	C	C	.	.			trans	-83.4	121.9	178.8	-52.7	-143.6	-8.9	0	0	108.5	L2051 D2052 E2054 F2058 R2070 T2072	L2051-Q2056 WeakPolarHBondContact CA-O 3.27Å; D2052-Q2056 PolarHBondContact N-O 2.95Å; D2052-Q2056 VanDerWaalsContact N-O 3.09Å; D2052-Q2056 WeakPolarHBondContact OD1-CA 3.48Å; D2052-Q2056 WeakPolarHBondContact OD1-CB 3.39Å; D2052-Q2056 PolarHBondContact OD1-N 3.3Å; D2052-Q2056 PolarHBondContact OD2-OE1 3.27Å; E2054-Q2056 VanDerWaalsContact C-N 3.31Å; E2054-Q2056 HydrophobicContact CB-CG 4.1Å; E2054-Q2056 PolarHBondContact O-N 2.9Å; E2054-Q2056 PolarHBondContact OE2-NE2 3.03Å; Q2056-F2058 HydrophobicContact CB-CD2 4.5Å; Q2056-F2058 HydrophobicContact CB-CE1 4.5Å; Q2056-F2058 HydrophobicContact CB-CE2 3.74Å; Q2056-F2058 HydrophobicContact CB-CZ 3.78Å; Q2056-F2058 WeakPolarHBondContact O-CD2 3.35Å; Q2056-F2058 VanDerWaalsContact O-CE2 3.31Å; Q2056-F2058 WeakPolarHBondContact O-CE2 3.28Å; Q2056-R2070 HydrophobicContact CB-CG 4.45Å; Q2056-R2070 VanDerWaalsContact CD-CZ 3.41Å; Q2056-R2070 VanDerWaalsContact CD-NE 3.25Å; Q2056-R2070 VanDerWaalsContact NE2-CZ 3.34Å; Q2056-R2070 VanDerWaalsContact OE1-CZ 3.25Å; Q2056-T2072 HydrophobicContact CB-CG2 4.34Å; Q2056-T2072 HydrophobicContact CG-CG2 4.16Å
2057	S	84.1	Confident	81.6	Confident	1 Å²	1	31.4 Å²	31.4	1%	0.007	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	135.5	172.5	50.5	0	0	0	0	111.2	I2050 G2055 R2070 L2071 Q2112	I2050-S2057 CarbonylContact O-C 3.51Å; I2050-S2057 WeakPolarHBondContact O-CA 3.36Å; G2055-S2057 PolarHBondContact O-N 2.56Å; S2057-R2070 CarbonylContact O-C 3.39Å; S2057-R2070 WeakPolarHBondContact O-CA 3.42Å; S2057-L2071 PolarHBondContact N-O 3.1Å; S2057-L2071 VanDerWaalsContact N-O 3.07Å; S2057-L2071 PolarHBondContact O-N 3.17Å; S2057-L2071 VanDerWaalsContact OG-CB 3.27Å; S2057-L2071 WeakPolarHBondContact OG-CB 3.31Å; S2057-L2071 VanDerWaalsContact OG-CD1 3.29Å; S2057-L2071 WeakPolarHBondContact OG-CD1 3.3Å; S2057-L2071 WeakPolarHBondContact OG-CG 3.34Å; S2057-L2071 PolarHBondContact OG-O 3.46Å; S2057-Q2112 VanDerWaalsContact CB-OE1 3.32Å; S2057-Q2112 PolarHBondContact OG-OE1 3.08Å
2058	F	86.1	Confident	81.1	Confident	12.6 Å²	12.6	31.3 Å²	31.3	6%	0.055	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	140	-177.5	-54	-90.8	0	0	0	109	I2030 A2049 I2050 D2052 Q2056 Y2067 G2069 R2070	I2030-F2058 HydrophobicContact CG2-CB 4.14Å; I2030-F2058 HydrophobicContact CG2-CD1 4.21Å; I2030-F2058 HydrophobicContact CG2-CD2 3.93Å; I2030-F2058 HydrophobicContact CG2-CE1 4.19Å; I2030-F2058 HydrophobicContact CG2-CE2 4.26Å; I2030-F2058 HydrophobicContact CG2-CG 3.84Å; I2030-F2058 HydrophobicContact CG2-CZ 4.44Å; A2049-F2058 CarbonylContact C-O 3.55Å; A2049-F2058 WeakPolarHBondContact CA-O 3.4Å; I2050-F2058 HydrophobicContact CB-CB 4.31Å; I2050-F2058 PolarHBondContact N-O 3.07Å; I2050-F2058 PolarHBondContact O-N 3.15Å; D2052-F2058 HydrophobicContact CB-CE2 4.26Å; Q2056-F2058 HydrophobicContact CB-CD2 4.5Å; Q2056-F2058 HydrophobicContact CB-CE1 4.5Å; Q2056-F2058 HydrophobicContact CB-CE2 3.74Å; Q2056-F2058 HydrophobicContact CB-CZ 3.78Å; Q2056-F2058 WeakPolarHBondContact O-CD2 3.35Å; Q2056-F2058 VanDerWaalsContact O-CE2 3.31Å; Q2056-F2058 WeakPolarHBondContact O-CE2 3.28Å; F2058-Y2067 HydrophobicContact CB-CE2 4.1Å; F2058-Y2067 AromaticContact CD1-CE2 3.69Å; F2058-Y2067 HydrophobicContact CD1-CE2 3.69Å; F2058-Y2067 WeakPolarHBondContact CD1-OH 3.47Å; F2058-Y2067 HydrophobicContact CE1-CE2 4.48Å; F2058-Y2067 HydrophobicContact CG-CE2 4.35Å; F2058-G2069 CarbonylContact C-O 3.46Å; F2058-G2069 WeakPolarHBondContact CA-O 3.42Å; F2058-R2070 HydrophobicContact CD1-CB 4.35Å; F2058-R2070 HydrophobicContact CD1-CG 3.99Å; F2058-R2070 HydrophobicContact CE1-CG 3.92Å; F2058-R2070 HydrophobicContact CG-CG 4.37Å
2059	I	86.5	Confident	80.3	Confident	3.2 Å²	3.2	32 Å²	32	2%	0.016	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	125.9	175.9	-55.8	-179.2	0	0	0	108.7	L2047 L2068 G2069 L2071 L2110 T2649	L2047-I2059 HydrophobicContact CB-CG2 4.42Å; L2047-I2059 HydrophobicContact CD2-CG2 4.14Å; I2059-L2068 HydrophobicContact CB-CB 4.44Å; I2059-L2068 HydrophobicContact CG2-CB 4.32Å; I2059-L2068 HydrophobicContact CG2-CD1 4.04Å; I2059-L2068 WeakPolarHBondContact O-CA 3.06Å; I2059-L2068 WeakPolarHBondContact O-CB 3.15Å; I2059-L2068 PolarHBondContact O-N 2.89Å; I2059-G2069 PolarHBondContact N-O 3.12Å; I2059-G2069 VanDerWaalsContact N-O 3.07Å; I2059-G2069 PolarHBondContact O-N 3.19Å; I2059-L2071 HydrophobicContact CD1-CD1 4.15Å; I2059-L2071 HydrophobicContact CD1-CD2 4.04Å; I2059-L2071 HydrophobicContact CD1-CG 4.43Å; I2059-L2071 HydrophobicContact CG1-CD1 4.37Å; I2059-L2071 HydrophobicContact CG1-CD2 4.3Å; I2059-L2110 HydrophobicContact CD1-CD2 4.33Å; I2059-L2110 HydrophobicContact CG1-CD2 4.43Å; I2059-T2649 HydrophobicContact CD1-CG2 3.83Å
2060	L	85.4	Confident	79.6	Confident	5.2 Å²	5.2	37.4 Å²	37.4	3%	0.027	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	145.7	172.7	-67	172.8	0	0	0	110.5	F2016 L2028 I2030 L2047 L2048 I2050 A2062 V2066 Y2067	F2016-L2060 HydrophobicContact CZ-CD1 4.29Å; L2028-L2060 HydrophobicContact CD1-CD1 4.09Å; L2028-L2060 HydrophobicContact CD1-CD2 4.29Å; I2030-L2060 HydrophobicContact CD1-CD1 3.95Å; I2030-L2060 HydrophobicContact CG1-CD1 4.38Å; L2047-L2060 CarbonylContact C-O 3.59Å; L2047-L2060 WeakPolarHBondContact CA-O 3.39Å; L2048-L2060 HydrophobicContact CB-CB 4.34Å; L2048-L2060 HydrophobicContact CD2-CD1 4.14Å; L2048-L2060 PolarHBondContact N-O 3.13Å; L2048-L2060 PolarHBondContact O-N 2.91Å; I2050-L2060 HydrophobicContact CD1-CB 4.4Å; I2050-L2060 HydrophobicContact CD1-CD1 3.36Å; I2050-L2060 VanDerWaalsContact CD1-CD1 3.46Å; I2050-L2060 HydrophobicContact CD1-CG 3.86Å; I2050-L2060 VanDerWaalsContact CD1-CG 3.5Å; I2050-L2060 HydrophobicContact CG1-CD1 4.34Å; L2060-A2062 PolarHBondContact O-N 3.04Å; L2060-V2066 CarbonylContact C-O 3.53Å; L2060-V2066 WeakPolarHBondContact CA-O 3.36Å; L2060-Y2067 HydrophobicContact CD2-CD2 4.2Å; L2060-Y2067 HydrophobicContact CD2-CG 4.42Å
2061	N	81	Confident	78.5	Confident	27.4 Å²	27.4	38.1 Å²	38.1	15%	0.147	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	118.2	159.4	-175.9	-39.5	0	0	0	108.1	D2063 T2064 F2065 V2066 L2068	N2061-D2063 VanDerWaalsContact C-N 3.29Å; N2061-D2063 PolarHBondContact O-N 2.95Å; N2061-D2063 WeakPolarHBondContact OD1-CA 3.34Å; N2061-D2063 VanDerWaalsContact OD1-CB 3.31Å; N2061-D2063 WeakPolarHBondContact OD1-CB 3.35Å; N2061-D2063 PolarHBondContact OD1-N 3.05Å; N2061-T2064 WeakPolarHBondContact CB-OG1 3.38Å; N2061-T2064 VanDerWaalsContact CG-OG1 3.27Å; N2061-T2064 PolarHBondContact OD1-N 3.02Å; N2061-T2064 VanDerWaalsContact OD1-N 3.14Å; N2061-T2064 PolarHBondContact OD1-OG1 3.08Å; N2061-F2065 WeakPolarHBondContact O-CA 3.36Å; N2061-F2065 PolarHBondContact O-N 3.16Å; N2061-V2066 PolarHBondContact N-O 2.97Å; N2061-V2066 PolarHBondContact O-N 2.92Å; N2061-L2068 HydrophobicContact CB-CD1 3.98Å; N2061-L2068 HydrophobicContact CB-CD2 4.04Å; N2061-L2068 HydrophobicContact CB-CG 4.05Å
2062	A	81.2	Confident	77.2	Confident	3 Å²	3	40.6 Å²	40.6	3%	0.025	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-18.8	-176.8	0	0	0	0	0	114.1	R1984 Y2040 G2045 R2046 L2060	R1984-A2062 PolarHBondContact NH1-O 3.36Å; Y2040-A2062 HydrophobicContact CD1-CB 4.24Å; Y2040-A2062 HydrophobicContact CE1-CB 3.69Å; G2045-A2062 WeakPolarHBondContact O-CB 3.21Å; R2046-A2062 WeakPolarHBondContact O-CB 3.32Å; R2046-A2062 PolarHBondContact O-N 3.09Å; L2060-A2062 PolarHBondContact O-N 3.04Å
2063	D	75.5	Confident	75.7	Confident	56.2 Å²	56.2	43.1 Å²	43.1	30%	0.301	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-42.7	178.2	-71.1	-39.8	0	0	0	111.7	R1984 R2002 N2061	R1984-D2063 IonicContact CZ-OD1 3.22Å; R1984-D2063 IonicContact NH1-OD1 3.2Å; R1984-D2063 PolarHBondContact NH1-OD1 2.74Å; R1984-D2063 VanDerWaalsContact NH2-CG 3.31Å; R1984-D2063 IonicContact NH2-OD1 3.3Å; R1984-D2063 PolarHBondContact NH2-OD1 2.89Å; R1984-D2063 IonicContact NH2-OD2 3.42Å; R1984-D2063 PolarHBondContact NH2-OD2 3.02Å; R2002-D2063 IonicContact CZ-OD1 3.61Å; R2002-D2063 VanDerWaalsContact NH1-CB 3.3Å; R2002-D2063 VanDerWaalsContact NH1-CG 3.29Å; R2002-D2063 PolarHBondContact NH1-O 3.2Å; R2002-D2063 IonicContact NH1-OD1 3.46Å; R2002-D2063 PolarHBondContact NH1-OD1 3.08Å; R2002-D2063 IonicContact NH1-OD2 2.63Å; R2002-D2063 PolarHBondContact NH1-OD2 2.82Å; N2061-D2063 VanDerWaalsContact C-N 3.29Å; N2061-D2063 PolarHBondContact O-N 2.95Å; N2061-D2063 WeakPolarHBondContact OD1-CA 3.34Å; N2061-D2063 VanDerWaalsContact OD1-CB 3.31Å; N2061-D2063 WeakPolarHBondContact OD1-CB 3.35Å; N2061-D2063 PolarHBondContact OD1-N 3.05Å
2064	T	72.8	Confident	73.9	Confident	61.8 Å²	61.8	43.3 Å²	43.3	38%	0.379	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-11.5	-177.1	58.9	0	0	0	0	112.8	N2061 V2066 E2455	N2061-T2064 WeakPolarHBondContact CB-OG1 3.38Å; N2061-T2064 VanDerWaalsContact CG-OG1 3.27Å; N2061-T2064 PolarHBondContact OD1-N 3.02Å; N2061-T2064 VanDerWaalsContact OD1-N 3.14Å; N2061-T2064 PolarHBondContact OD1-OG1 3.08Å; T2064-V2066 PolarHBondContact O-N 3.11Å; T2064-V2066 WeakPolarHBondContact OG1-CB 3.37Å; T2064-V2066 WeakPolarHBondContact OG1-CG2 3.37Å; T2064-V2066 PolarHBondContact OG1-N 3.21Å; T2064-E2455 WeakPolarHBondContact CG2-OE2 3.49Å
2065	F	78.4	Confident	72.3	Confident	34.2 Å²	34.2	41.7 Å²	41.7	15%	0.15	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.8	31	-169.5	-55.1	-75.9	0	0	0	112.6	F2016 I2025 K2026 L2028 N2061	F2016-F2065 HydrophobicContact CB-CE1 4.29Å; F2016-F2065 AromaticContact CD1-CD1 3.97Å; F2016-F2065 HydrophobicContact CD1-CD1 4.15Å; F2016-F2065 AromaticContact CD1-CE1 3.52Å; F2016-F2065 HydrophobicContact CD1-CE1 3.52Å; F2016-F2065 VanDerWaalsContact CD1-CE1 3.43Å; F2016-F2065 HydrophobicContact CD1-CZ 4.44Å; F2016-F2065 AromaticContact CD2-CD1 3.97Å; F2016-F2065 HydrophobicContact CD2-CD1 4.11Å; F2016-F2065 AromaticContact CD2-CE1 3.91Å; F2016-F2065 HydrophobicContact CD2-CE1 4.05Å; F2016-F2065 AromaticContact CE1-CD1 3.83Å; F2016-F2065 HydrophobicContact CE1-CD1 3.98Å; F2016-F2065 AromaticContact CE1-CE1 3.73Å; F2016-F2065 HydrophobicContact CE1-CE1 3.73Å; F2016-F2065 AromaticContact CE2-CD1 3.91Å; F2016-F2065 HydrophobicContact CE2-CD1 3.97Å; F2016-F2065 AromaticContact CE2-CE1 3.95Å; F2016-F2065 HydrophobicContact CE2-CE1 4.26Å; F2016-F2065 HydrophobicContact CG-CD1 4.2Å; F2016-F2065 AromaticContact CG-CE1 3.68Å; F2016-F2065 HydrophobicContact CG-CE1 3.68Å; F2016-F2065 HydrophobicContact CG-CZ 4.41Å; F2016-F2065 AromaticContact CZ-CD1 3.89Å; F2016-F2065 HydrophobicContact CZ-CD1 3.89Å; F2016-F2065 AromaticContact CZ-CE1 3.85Å; F2016-F2065 HydrophobicContact CZ-CE1 4.1Å; I2025-F2065 HydrophobicContact CG2-CE2 4.17Å; I2025-F2065 HydrophobicContact CG2-CZ 4.26Å; K2026-F2065 HydrophobicContact CD-CB 4.26Å; K2026-F2065 HydrophobicContact CD-CD2 4.18Å; K2026-F2065 HydrophobicContact CD-CG 4.15Å; L2028-F2065 HydrophobicContact CD1-CB 4.26Å; L2028-F2065 HydrophobicContact CD1-CD1 4.41Å; N2061-F2065 WeakPolarHBondContact O-CA 3.36Å; N2061-F2065 PolarHBondContact O-N 3.16Å
2066	V	74.5	Confident	70.2	Confident	60.8 Å²	60.8	46.3 Å²	46.3	37%	0.368	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	138.3	179.7	173.5	0	0	0	0	109.9	L2060 N2061 T2064 L2068	L2060-V2066 CarbonylContact C-O 3.53Å; L2060-V2066 WeakPolarHBondContact CA-O 3.36Å; N2061-V2066 PolarHBondContact N-O 2.97Å; N2061-V2066 PolarHBondContact O-N 2.92Å; T2064-V2066 PolarHBondContact O-N 3.11Å; T2064-V2066 WeakPolarHBondContact OG1-CB 3.37Å; T2064-V2066 WeakPolarHBondContact OG1-CG2 3.37Å; T2064-V2066 PolarHBondContact OG1-N 3.21Å; V2066-L2068 PolarHBondContact O-N 3.11Å
2067	Y	76.7	Confident	68	Low	72.8 Å²	72.8	50.3 Å²	50.3	29%	0.285	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	120.3	173.5	-179.4	-102.5	0	0	0	111.5	F1726 R1774 F2058 L2060 G2069 R2070 L2616	F1726-Y2067 HydrophobicContact CE2-CE1 4.21Å; R1774-Y2067 PolarHBondContact NH1-O 2.78Å; F2058-Y2067 HydrophobicContact CB-CE2 4.1Å; F2058-Y2067 AromaticContact CD1-CE2 3.69Å; F2058-Y2067 HydrophobicContact CD1-CE2 3.69Å; F2058-Y2067 WeakPolarHBondContact CD1-OH 3.47Å; F2058-Y2067 HydrophobicContact CE1-CE2 4.48Å; F2058-Y2067 HydrophobicContact CG-CE2 4.35Å; L2060-Y2067 HydrophobicContact CD2-CD2 4.2Å; L2060-Y2067 HydrophobicContact CD2-CG 4.42Å; Y2067-G2069 VanDerWaalsContact CE2-O 3.31Å; Y2067-G2069 WeakPolarHBondContact CE2-O 3.24Å; Y2067-G2069 VanDerWaalsContact CZ-C 3.45Å; Y2067-G2069 VanDerWaalsContact CZ-O 3.31Å; Y2067-G2069 VanDerWaalsContact OH-C 3.28Å; Y2067-G2069 PolarHBondContact OH-O 3.07Å; Y2067-R2070 WeakPolarHBondContact OH-CA 3.41Å; Y2067-R2070 VanDerWaalsContact OH-CB 3.23Å; Y2067-R2070 WeakPolarHBondContact OH-CB 3.36Å; Y2067-R2070 WeakPolarHBondContact OH-CG 3.48Å; Y2067-R2070 PolarHBondContact OH-N 3.07Å; Y2067-R2070 VanDerWaalsContact OH-N 3.1Å; Y2067-L2616 HydrophobicContact CE1-CD1 4.31Å
2068	L	74.1	Confident	65.5	Low	26.4 Å²	26.4	54.7 Å²	54.7	14%	0.138	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	-41.1	-178.2	-64	-178.5	0	0	0	112.4	L2047 I2059 N2061 V2066 L2129 P2132 W2136 I2457	L2047-L2068 HydrophobicContact CD2-CD1 3.4Å; L2047-L2068 VanDerWaalsContact CD2-CD1 3.43Å; I2059-L2068 HydrophobicContact CB-CB 4.44Å; I2059-L2068 HydrophobicContact CG2-CB 4.32Å; I2059-L2068 HydrophobicContact CG2-CD1 4.04Å; I2059-L2068 WeakPolarHBondContact O-CA 3.06Å; I2059-L2068 WeakPolarHBondContact O-CB 3.15Å; I2059-L2068 PolarHBondContact O-N 2.89Å; N2061-L2068 HydrophobicContact CB-CD1 3.98Å; N2061-L2068 HydrophobicContact CB-CD2 4.04Å; N2061-L2068 HydrophobicContact CB-CG 4.05Å; V2066-L2068 PolarHBondContact O-N 3.11Å; L2068-L2129 HydrophobicContact CB-CD1 3.98Å; L2068-L2129 HydrophobicContact CD1-CD1 4.02Å; L2068-L2129 HydrophobicContact CD2-CD1 4.41Å; L2068-L2129 HydrophobicContact CG-CD1 4.41Å; L2068-P2132 HydrophobicContact CD2-CG 4.26Å; L2068-W2136 WeakPolarHBondContact O-CZ2 3.2Å; L2068-I2457 HydrophobicContact CD2-CD1 4.33Å; L2068-I2457 HydrophobicContact CD2-CG2 3.37Å; L2068-I2457 HydrophobicContact CG-CG2 4.39Å
2069	G	71.4	Confident	62.7	Low	14 Å²	14	58.8 Å²	58.8	14%	0.144	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.9	170.6	-178.6	0	0	0	0	0	113.9	F2058 I2059 Y2067	F2058-G2069 CarbonylContact C-O 3.46Å; F2058-G2069 WeakPolarHBondContact CA-O 3.42Å; I2059-G2069 PolarHBondContact N-O 3.12Å; I2059-G2069 VanDerWaalsContact N-O 3.07Å; I2059-G2069 PolarHBondContact O-N 3.19Å; Y2067-G2069 VanDerWaalsContact CE2-O 3.31Å; Y2067-G2069 WeakPolarHBondContact CE2-O 3.24Å; Y2067-G2069 VanDerWaalsContact CZ-C 3.45Å; Y2067-G2069 VanDerWaalsContact CZ-O 3.31Å; Y2067-G2069 VanDerWaalsContact OH-C 3.28Å; Y2067-G2069 PolarHBondContact OH-O 3.07Å
2070	R	74.4	Confident	60.2	Low	114.4 Å²	114.4	64 Å²	64	43%	0.432	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	139.8	173	-157.8	173.3	156.4	180	-24	108.8	Q2056 S2057 F2058 Y2067 T2072	Q2056-R2070 HydrophobicContact CB-CG 4.45Å; Q2056-R2070 VanDerWaalsContact CD-CZ 3.41Å; Q2056-R2070 VanDerWaalsContact CD-NE 3.25Å; Q2056-R2070 VanDerWaalsContact NE2-CZ 3.34Å; Q2056-R2070 VanDerWaalsContact OE1-CZ 3.25Å; S2057-R2070 CarbonylContact O-C 3.39Å; S2057-R2070 WeakPolarHBondContact O-CA 3.42Å; F2058-R2070 HydrophobicContact CD1-CB 4.35Å; F2058-R2070 HydrophobicContact CD1-CG 3.99Å; F2058-R2070 HydrophobicContact CE1-CG 3.92Å; F2058-R2070 HydrophobicContact CG-CG 4.37Å; Y2067-R2070 WeakPolarHBondContact OH-CA 3.41Å; Y2067-R2070 VanDerWaalsContact OH-CB 3.23Å; Y2067-R2070 WeakPolarHBondContact OH-CB 3.36Å; Y2067-R2070 WeakPolarHBondContact OH-CG 3.48Å; Y2067-R2070 PolarHBondContact OH-N 3.07Å; Y2067-R2070 VanDerWaalsContact OH-N 3.1Å; R2070-T2072 HydrophobicContact CB-CG2 4.45Å; R2070-T2072 HydrophobicContact CG-CG2 3.96Å; R2070-T2072 VanDerWaalsContact CZ-CG2 3.48Å; R2070-T2072 VanDerWaalsContact NE-CG2 3.35Å
2071	L	68.5	Low	57.7	Low	15.8 Å²	15.8	69.9 Å²	69.9	8%	0.083	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	110.8	165.4	-42.7	176.1	0	0	0	106.6	S2057 I2059 L2110 W2125 T2649	S2057-L2071 PolarHBondContact N-O 3.1Å; S2057-L2071 VanDerWaalsContact N-O 3.07Å; S2057-L2071 PolarHBondContact O-N 3.17Å; S2057-L2071 VanDerWaalsContact OG-CB 3.27Å; S2057-L2071 WeakPolarHBondContact OG-CB 3.31Å; S2057-L2071 VanDerWaalsContact OG-CD1 3.29Å; S2057-L2071 WeakPolarHBondContact OG-CD1 3.3Å; S2057-L2071 WeakPolarHBondContact OG-CG 3.34Å; S2057-L2071 PolarHBondContact OG-O 3.46Å; I2059-L2071 HydrophobicContact CD1-CD1 4.15Å; I2059-L2071 HydrophobicContact CD1-CD2 4.04Å; I2059-L2071 HydrophobicContact CD1-CG 4.43Å; I2059-L2071 HydrophobicContact CG1-CD1 4.37Å; I2059-L2071 HydrophobicContact CG1-CD2 4.3Å; L2071-L2110 HydrophobicContact CD1-CD2 3.85Å; L2071-W2125 HydrophobicContact CB-CD2 4.22Å; L2071-W2125 HydrophobicContact CB-CE3 4.28Å; L2071-W2125 HydrophobicContact CB-CH2 4.25Å; L2071-W2125 HydrophobicContact CB-CZ2 4.19Å; L2071-W2125 HydrophobicContact CB-CZ3 4.28Å; L2071-W2125 HydrophobicContact CD1-CB 4.17Å; L2071-W2125 HydrophobicContact CD1-CD2 4.06Å; L2071-W2125 HydrophobicContact CD1-CE3 4.25Å; L2071-W2125 HydrophobicContact CD1-CG 3.88Å; L2071-W2125 HydrophobicContact CD2-CD2 4.43Å; L2071-W2125 HydrophobicContact CD2-CE3 4.14Å; L2071-W2125 HydrophobicContact CD2-CZ3 4.37Å; L2071-W2125 HydrophobicContact CG-CD2 4.31Å; L2071-W2125 HydrophobicContact CG-CE3 4.33Å; L2071-T2649 HydrophobicContact CD2-CG2 3.46Å; L2071-T2649 WeakPolarHBondContact CD2-OG1 3.41Å
2072	T	59.7	Low	55.4	Low	52.2 Å²	52.2	75.7 Å²	75.7	32%	0.32	41%	0.412	S	S	.	.			trans	-114.1	129.8	172.3	44.4	0	0	0	0	108.7	Q2056 R2070 N2074	Q2056-T2072 HydrophobicContact CB-CG2 4.34Å; Q2056-T2072 HydrophobicContact CG-CG2 4.16Å; R2070-T2072 HydrophobicContact CB-CG2 4.45Å; R2070-T2072 HydrophobicContact CG-CG2 3.96Å; R2070-T2072 VanDerWaalsContact CZ-CG2 3.48Å; R2070-T2072 VanDerWaalsContact NE-CG2 3.35Å; T2072-N2074 VanDerWaalsContact C-N 3.3Å; T2072-N2074 PolarHBondContact O-N 2.83Å; T2072-N2074 VanDerWaalsContact O-N 3.12Å; T2072-N2074 PolarHBondContact OG1-OD1 2.82Å; T2072-N2074 VanDerWaalsContact OG1-OD1 3.1Å
2073	E	54.4	Low	53.3	Low	54.4 Å²	54.4	83.6 Å²	83.6	25%	0.254	45%	0.446	S	S	.	.			trans	-65.4	106.2	159.2	-72.4	-172	157.1	0	0	107.9	V2075 S2118 N2123 W2125	E2073-V2075 VanDerWaalsContact C-N 3.34Å; E2073-V2075 HydrophobicContact CB-CG2 4.18Å; E2073-V2075 PolarHBondContact O-N 3Å; E2073-V2075 VanDerWaalsContact O-N 3.14Å; E2073-S2118 WeakPolarHBondContact OE1-CB 3.31Å; E2073-S2118 PolarHBondContact OE1-OG 3.43Å; E2073-S2118 WeakPolarHBondContact OE2-CB 3.33Å; E2073-S2118 PolarHBondContact OE2-OG 3.08Å; E2073-N2123 PolarHBondContact OE1-ND2 3.09Å; E2073-N2123 PolarHBondContact OE1-OD1 3.15Å; E2073-N2123 PolarHBondContact OE2-ND2 2.95Å; E2073-W2125 HydrophobicContact CG-CH2 4.03Å; E2073-W2125 HydrophobicContact CG-CZ2 4.17Å
2074	N	41.4	Very low	51.2	Low	138.6 Å²	138.6	86.5 Å²	86.5	74%	0.741	47%	0.466	S	S	*	.			trans	-74.6	45.4	168.4	-77	-9.5	0	0	0	110.3	T2072 S2076	T2072-N2074 VanDerWaalsContact C-N 3.3Å; T2072-N2074 PolarHBondContact O-N 2.83Å; T2072-N2074 VanDerWaalsContact O-N 3.12Å; T2072-N2074 PolarHBondContact OG1-OD1 2.82Å; T2072-N2074 VanDerWaalsContact OG1-OD1 3.1Å; N2074-S2076 PolarHBondContact O-N 3.22Å; N2074-S2076 VanDerWaalsContact O-N 3.08Å
2075	V	40.1	Very low	49.2	Very low	73 Å²	73	88 Å²	88	44%	0.442	48%	0.479	S	S	.	.			trans	-89.2	94.1	171.6	-166	0	0	0	0	107.5	E2073 F2077	E2073-V2075 VanDerWaalsContact C-N 3.34Å; E2073-V2075 HydrophobicContact CB-CG2 4.18Å; E2073-V2075 PolarHBondContact O-N 3Å; E2073-V2075 VanDerWaalsContact O-N 3.14Å; V2075-F2077 HydrophobicContact CB-CD2 4.03Å; V2075-F2077 HydrophobicContact CB-CE2 3.8Å; V2075-F2077 VanDerWaalsContact CB-CE2 3.47Å; V2075-F2077 HydrophobicContact CB-CZ 3.96Å; V2075-F2077 HydrophobicContact CG1-CD1 4.18Å; V2075-F2077 HydrophobicContact CG1-CD2 3.51Å; V2075-F2077 HydrophobicContact CG1-CE1 4.01Å; V2075-F2077 HydrophobicContact CG1-CE2 3.14Å; V2075-F2077 HydrophobicContact CG1-CG 4.11Å; V2075-F2077 HydrophobicContact CG1-CZ 3.4Å; V2075-F2077 HydrophobicContact CG2-CE2 4.3Å; V2075-F2077 WeakPolarHBondContact O-CD2 3.4Å; V2075-F2077 PolarHBondContact O-N 2.98Å
2076	S	29.5	Very low	47.2	Very low	108.6 Å²	108.6	93.1 Å²	93.1	76%	0.759	51%	0.507	S	S	*	.			trans	-65.1	89.4	165.4	54	0	0	0	0	108.5	N2074 S2078	N2074-S2076 PolarHBondContact O-N 3.22Å; N2074-S2076 VanDerWaalsContact O-N 3.08Å; S2076-S2078 PolarHBondContact O-N 2.94Å; S2076-S2078 VanDerWaalsContact O-N 3.16Å
2077	F	32.8	Very low	45.4	Very low	120.8 Å²	120.8	95.9 Å²	95.9	53%	0.53	52%	0.52	S	S	.	.			trans	-66.1	119.7	164.8	-74.2	-76.7	0	0	0	107.9	V2075 S2079 S2117	V2075-F2077 HydrophobicContact CB-CD2 4.03Å; V2075-F2077 HydrophobicContact CB-CE2 3.8Å; V2075-F2077 VanDerWaalsContact CB-CE2 3.47Å; V2075-F2077 HydrophobicContact CB-CZ 3.96Å; V2075-F2077 HydrophobicContact CG1-CD1 4.18Å; V2075-F2077 HydrophobicContact CG1-CD2 3.51Å; V2075-F2077 HydrophobicContact CG1-CE1 4.01Å; V2075-F2077 HydrophobicContact CG1-CE2 3.14Å; V2075-F2077 HydrophobicContact CG1-CG 4.11Å; V2075-F2077 HydrophobicContact CG1-CZ 3.4Å; V2075-F2077 HydrophobicContact CG2-CE2 4.3Å; V2075-F2077 WeakPolarHBondContact O-CD2 3.4Å; V2075-F2077 PolarHBondContact O-N 2.98Å; F2077-S2079 PolarHBondContact O-N 3.16Å; F2077-S2079 VanDerWaalsContact O-N 3.14Å; F2077-S2117 VanDerWaalsContact CE2-CB 3.44Å
2078	S	30.6	Very low	43.4	Very low	94.2 Å²	94.2	101.8 Å²	101.8	66%	0.659	55%	0.55	S	S	*	*			trans	-57.5	124.2	160.8	52.4	0	0	0	0	107.8	S2076 I2080 K2797	S2076-S2078 PolarHBondContact O-N 2.94Å; S2076-S2078 VanDerWaalsContact O-N 3.16Å; S2078-I2080 VanDerWaalsContact C-N 3.33Å; S2078-I2080 WeakPolarHBondContact O-CG1 3.27Å; S2078-I2080 PolarHBondContact O-N 3.03Å; S2078-K2797 PolarHBondContact OG-NZ 3.11Å
2079	S	28.6	Very low	41.5	Very low	98.2 Å²	98.2	107.5 Å²	107.5	69%	0.687	58%	0.581	S	S	*	*			trans	-36.3	93.6	-179.4	-6.9	0	0	0	0	112.4	F2077 N2081 K2797	F2077-S2079 PolarHBondContact O-N 3.16Å; F2077-S2079 VanDerWaalsContact O-N 3.14Å; S2079-N2081 WeakPolarHBondContact CB-OD1 3.06Å; S2079-N2081 PolarHBondContact O-N 3.03Å; S2079-K2797 PolarHBondContact O-NZ 3.19Å
2080	I	33.5	Very low	39.6	Very low	112.6 Å²	112.6	113.5 Å²	113.5	58%	0.577	60%	0.604	S	S	*	*			trans	-92.2	79.7	164.2	-56.8	170.8	0	0	0	105.7	S2078 E2082 F2083	S2078-I2080 VanDerWaalsContact C-N 3.33Å; S2078-I2080 WeakPolarHBondContact O-CG1 3.27Å; S2078-I2080 PolarHBondContact O-N 3.03Å; I2080-E2082 HydrophobicContact CG2-CB 4.18Å; I2080-E2082 PolarHBondContact O-N 3.07Å; I2080-E2082 VanDerWaalsContact O-N 3.08Å; I2080-F2083 HydrophobicContact CB-CD2 4.37Å; I2080-F2083 HydrophobicContact CG2-CD2 3.9Å; I2080-F2083 HydrophobicContact CG2-CE2 3.9Å; I2080-F2083 PolarHBondContact O-N 3.46Å
2081	N	31.9	Very low	37.8	Very low	129 Å²	129	115.6 Å²	115.6	69%	0.69	62%	0.619	S	S	*	*			trans	-79.8	7.7	176.7	-81.3	-4.6	0	0	0	112.4	S2079 F2083 T2084	S2079-N2081 WeakPolarHBondContact CB-OD1 3.06Å; S2079-N2081 PolarHBondContact O-N 3.03Å; N2081-F2083 VanDerWaalsContact C-N 3.28Å; N2081-F2083 PolarHBondContact O-N 3.17Å; N2081-F2083 VanDerWaalsContact O-N 3.15Å; N2081-T2084 PolarHBondContact O-N 3.02Å; N2081-T2084 PolarHBondContact O-OG1 3.09Å
2082	E	34.4	Very low	36.3	Very low	149 Å²	149	121.5 Å²	121.5	70%	0.696	65%	0.65	S	S	*	*			trans	-86.4	-5.6	-173.3	-80.1	-174.4	156.8	0	0	115.3	I2080 S2085 K2797 P2798	I2080-E2082 HydrophobicContact CG2-CB 4.18Å; I2080-E2082 PolarHBondContact O-N 3.07Å; I2080-E2082 VanDerWaalsContact O-N 3.08Å; E2082-S2085 PolarHBondContact O-OG 3.21Å; E2082-K2797 VanDerWaalsContact OE1-C 3.22Å; E2082-P2798 WeakPolarHBondContact OE1-CD 3.42Å; E2082-P2798 WeakPolarHBondContact OE2-CA 3.29Å; E2082-P2798 WeakPolarHBondContact OE2-CB 3.44Å
2083	F	36	Very low	35.4	Very low	168 Å²	168	122.9 Å²	122.9	74%	0.737	66%	0.655	S	S	*	*	S	Bend	trans	-108.2	9.4	177.7	-74.6	-75.8	0	0	0	114.7	I2080 N2081 S2085 V2119	I2080-F2083 HydrophobicContact CB-CD2 4.37Å; I2080-F2083 HydrophobicContact CG2-CD2 3.9Å; I2080-F2083 HydrophobicContact CG2-CE2 3.9Å; I2080-F2083 PolarHBondContact O-N 3.46Å; N2081-F2083 VanDerWaalsContact C-N 3.28Å; N2081-F2083 PolarHBondContact O-N 3.17Å; N2081-F2083 VanDerWaalsContact O-N 3.15Å; F2083-S2085 PolarHBondContact O-N 2.85Å; F2083-V2119 HydrophobicContact CB-CG2 4.49Å
2084	T	31.7	Very low	34.7	Very low	117.6 Å²	117.6	121.6 Å²	121.6	72%	0.721	65%	0.651	S	S	*	*			trans	-96.7	35.8	175.5	54.7	0	0	0	0	112.6	N2081	N2081-T2084 PolarHBondContact O-N 3.02Å; N2081-T2084 PolarHBondContact O-OG1 3.09Å
2085	S	31.6	Very low	34.7	Very low	92.6 Å²	92.6	117 Å²	117	65%	0.648	63%	0.63	S	S	*	*			trans	-136	71	173.7	58.2	0	0	0	0	113	E2082 F2083	E2082-S2085 PolarHBondContact O-OG 3.21Å; F2083-S2085 PolarHBondContact O-N 2.85Å
2086	L	35.6	Very low	35.3	Very low	141.4 Å²	141.4	117.2 Å²	117.2	74%	0.74	63%	0.626	S	S	*	*	S	Bend	trans	-177.1	98.6	171.8	-111	80	0	0	0	113.2	E2088 L2089	L2086-E2088 PolarHBondContact O-N 2.72Å; L2086-L2089 PolarHBondContact O-N 3.08Å; L2086-L2089 VanDerWaalsContact O-N 3.11Å
2087	D	35.5	Very low	36.7	Very low	120.2 Å²	120.2	115.1 Å²	115.1	64%	0.643	60%	0.603	S	S	*	*			trans	76.5	42.4	161.4	-76.1	-7.6	0	0	0	116.6	L2089 K2097	D2087-L2089 PolarHBondContact O-N 3.1Å; D2087-K2097 IonicContact OD2-NZ 3.08Å; D2087-K2097 PolarHBondContact OD2-NZ 3.47Å
2088	E	35.6	Very low	38.5	Very low	195.8 Å²	195.8	109.5 Å²	109.5	92%	0.915	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	0.9	172.2	-71.7	-166.9	145.6	0	0	115	L2086	L2086-E2088 PolarHBondContact O-N 2.72Å
2089	L	33.9	Very low	40.8	Very low	147.6 Å²	147.6	106.7 Å²	106.7	77%	0.773	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.7	-3.5	-173.3	-88.1	156.4	0	0	0	114.6	L2086 D2087 H2091	L2086-L2089 PolarHBondContact O-N 3.08Å; L2086-L2089 VanDerWaalsContact O-N 3.11Å; D2087-L2089 PolarHBondContact O-N 3.1Å; L2089-H2091 PolarHBondContact O-N 2.86Å
2090	H	32.4	Very low	43.5	Very low	139.4 Å²	139.4	102.4 Å²	102.4	65%	0.645	53%	0.527	S	S	*	.	S	Bend	trans	-121.6	80.8	179.1	-69.2	-84.4	0	0	0	114.8	L2092	H2090-L2092 PolarHBondContact O-N 2.99Å
2091	H	35.7	Very low	45.9	Very low	159.6 Å²	159.6	98.3 Å²	98.3	74%	0.739	51%	0.508	S	S	*	.			trans	-73.8	91.6	168.6	-65.6	-72.9	0	0	0	114.1	L2089 L2093	L2089-H2091 PolarHBondContact O-N 2.86Å; H2091-L2093 VanDerWaalsContact C-N 3.31Å; H2091-L2093 HydrophobicContact CB-CD1 3.6Å; H2091-L2093 HydrophobicContact CB-CG 3.67Å; H2091-L2093 WeakPolarHBondContact O-CA 2.94Å; H2091-L2093 WeakPolarHBondContact O-CB 3.06Å; H2091-L2093 WeakPolarHBondContact O-CD1 3.35Å; H2091-L2093 WeakPolarHBondContact O-CG 3.48Å; H2091-L2093 PolarHBondContact O-N 3.15Å; H2091-L2093 VanDerWaalsContact O-N 3.08Å
2092	L	36.6	Very low	48.4	Very low	139 Å²	139	92.6 Å²	92.6	73%	0.728	48%	0.477	S	S	*	.			trans	-53.8	86.2	162.5	-75.7	159.3	0	0	0	111.5	H2090 P2094 Q2096	H2090-L2092 PolarHBondContact O-N 2.99Å; L2092-P2094 WeakPolarHBondContact O-CD 3.46Å; L2092-Q2096 HydrophobicContact CB-CB 4.4Å; L2092-Q2096 HydrophobicContact CD2-CB 4.45Å
2093	L	41.7	Very low	50.4	Low	80.8 Å²	80.8	85.9 Å²	85.9	42%	0.423	45%	0.447	S	S	.	.			trans	-60	121.6	-178.7	-74.1	146.3	0	0	0	111.7	L1852 L1938 W2010 H2091 S2095 Q2096	L1852-L2093 HydrophobicContact CD1-CD1 3.92Å; L1852-L2093 HydrophobicContact CD2-CD1 3.74Å; L1938-L2093 HydrophobicContact CD1-CD2 3.82Å; W2010-L2093 HydrophobicContact CZ2-CD1 4.46Å; W2010-L2093 HydrophobicContact CZ2-CD2 4.19Å; H2091-L2093 VanDerWaalsContact C-N 3.31Å; H2091-L2093 HydrophobicContact CB-CD1 3.6Å; H2091-L2093 HydrophobicContact CB-CG 3.67Å; H2091-L2093 WeakPolarHBondContact O-CA 2.94Å; H2091-L2093 WeakPolarHBondContact O-CB 3.06Å; H2091-L2093 WeakPolarHBondContact O-CD1 3.35Å; H2091-L2093 WeakPolarHBondContact O-CG 3.48Å; H2091-L2093 PolarHBondContact O-N 3.15Å; H2091-L2093 VanDerWaalsContact O-N 3.08Å; L2093-S2095 PolarHBondContact O-N 3.26Å; L2093-S2095 VanDerWaalsContact O-N 3.11Å; L2093-Q2096 HydrophobicContact CB-CG 4.46Å; L2093-Q2096 WeakPolarHBondContact O-CB 3.41Å; L2093-Q2096 PolarHBondContact O-N 3.28Å
2094	P	39.1	Very low	52.1	Low	27.6 Å²	27.6	82.3 Å²	82.3	18%	0.179	43%	0.431	C	S	.	.	G	3₁₀ helix	trans	-80.4	-16.4	172.7	-13.2	28.3	0	0	0	114.9	I1810 P1850 L1852 Q1882 N1979 W2010 A2034 C2036 L2092 Q2096 K2097	I1810-P2094 HydrophobicContact CD1-CB 4.15Å; P1850-P2094 HydrophobicContact CB-CG 4.43Å; P1850-P2094 HydrophobicContact CG-CG 4.22Å; L1852-P2094 HydrophobicContact CD2-CB 3.6Å; L1852-P2094 HydrophobicContact CD2-CG 4.44Å; Q1882-P2094 HydrophobicContact CB-CB 4.41Å; Q1882-P2094 VanDerWaalsContact CD-CG 3.44Å; Q1882-P2094 HydrophobicContact CG-CB 4.22Å; N1979-P2094 WeakPolarHBondContact ND2-CB 3.11Å; W2010-P2094 HydrophobicContact CZ2-CG 3.81Å; A2034-P2094 HydrophobicContact CB-CB 4.25Å; A2034-P2094 HydrophobicContact CB-CG 4.3Å; C2036-P2094 WeakPolarHBondContact CB-O 3.38Å; C2036-P2094 PolarHBondContact SG-O 3.2Å; L2092-P2094 WeakPolarHBondContact O-CD 3.46Å; P2094-Q2096 VanDerWaalsContact C-N 3.28Å; P2094-Q2096 PolarHBondContact O-N 3.09Å; P2094-Q2096 VanDerWaalsContact O-N 3.16Å; P2094-K2097 HydrophobicContact CB-CD 4.13Å; P2094-K2097 VanDerWaalsContact O-CB 3.28Å; P2094-K2097 WeakPolarHBondContact O-CB 3.47Å; P2094-K2097 VanDerWaalsContact O-CG 3.22Å; P2094-K2097 WeakPolarHBondContact O-CG 3.36Å; P2094-K2097 PolarHBondContact O-N 3.05Å; P2094-K2097 VanDerWaalsContact O-N 3.09Å
2095	S	42.3	Very low	53.5	Low	41.6 Å²	41.6	79.9 Å²	79.9	29%	0.291	42%	0.417	S	S	.	.	G	3₁₀ helix	trans	-83.7	1.7	-174.1	55.6	0	0	0	0	114.5	I1810 L2093 K2097 I2662	I1810-S2095 WeakPolarHBondContact CG2-OG 3.43Å; L2093-S2095 PolarHBondContact O-N 3.26Å; L2093-S2095 VanDerWaalsContact O-N 3.11Å; S2095-K2097 VanDerWaalsContact C-N 3.31Å; S2095-K2097 WeakPolarHBondContact O-CA 3.35Å; S2095-K2097 PolarHBondContact O-N 3.47Å; S2095-I2662 WeakPolarHBondContact O-CG2 3Å
2096	Q	52.6	Low	55.1	Low	77.4 Å²	77.4	78.3 Å²	78.3	36%	0.362	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-83.3	15.7	164.6	-65.6	-172.2	-15.7	0	0	113.9	I1810 N1979 I2035 C2036 R2053 L2092 L2093 P2094 G2098	I1810-Q2096 HydrophobicContact CG2-CG 4Å; I1810-Q2096 VanDerWaalsContact CG2-NE2 3.31Å; N1979-Q2096 VanDerWaalsContact CB-OE1 3.25Å; N1979-Q2096 VanDerWaalsContact CG-NE2 3.31Å; N1979-Q2096 PolarHBondContact ND2-NE2 3.33Å; N1979-Q2096 PolarHBondContact ND2-OE1 2.79Å; N1979-Q2096 PolarHBondContact OD1-NE2 3.01Å; N1979-Q2096 PolarHBondContact OD1-OE1 2.97Å; I2035-Q2096 PolarHBondContact O-OE1 3.33Å; C2036-Q2096 HydrophobicContact CB-CB 4.01Å; C2036-Q2096 VanDerWaalsContact SG-CB 3.55Å; C2036-Q2096 PolarHBondContact SG-O 3.07Å; R2053-Q2096 HydrophobicContact CG-CB 4.38Å; L2092-Q2096 HydrophobicContact CB-CB 4.4Å; L2092-Q2096 HydrophobicContact CD2-CB 4.45Å; L2093-Q2096 HydrophobicContact CB-CG 4.46Å; L2093-Q2096 WeakPolarHBondContact O-CB 3.41Å; L2093-Q2096 PolarHBondContact O-N 3.28Å; P2094-Q2096 VanDerWaalsContact C-N 3.28Å; P2094-Q2096 PolarHBondContact O-N 3.09Å; P2094-Q2096 VanDerWaalsContact O-N 3.16Å; Q2096-G2098 PolarHBondContact O-N 3.12Å
2097	K	59.4	Low	56.8	Low	65.4 Å²	65.4	71.7 Å²	71.7	28%	0.284	37%	0.37	S	S	.	.			trans	-76.7	68.8	-177.5	-71.9	-173.2	175.7	-162.4	0	112.2	L1852 N1979 R2053 D2087 P2094 S2095 G2114 G2115 V2119	L1852-K2097 PolarHBondContact O-NZ 2.77Å; L1852-K2097 VanDerWaalsContact O-NZ 3.08Å; N1979-K2097 WeakPolarHBondContact OD1-CE 3.34Å; N1979-K2097 PolarHBondContact OD1-NZ 3.49Å; R2053-K2097 HydrophobicContact CG-CD 4.04Å; D2087-K2097 IonicContact OD2-NZ 3.08Å; D2087-K2097 PolarHBondContact OD2-NZ 3.47Å; P2094-K2097 HydrophobicContact CB-CD 4.13Å; P2094-K2097 VanDerWaalsContact O-CB 3.28Å; P2094-K2097 WeakPolarHBondContact O-CB 3.47Å; P2094-K2097 VanDerWaalsContact O-CG 3.22Å; P2094-K2097 WeakPolarHBondContact O-CG 3.36Å; P2094-K2097 PolarHBondContact O-N 3.05Å; P2094-K2097 VanDerWaalsContact O-N 3.09Å; S2095-K2097 VanDerWaalsContact C-N 3.31Å; S2095-K2097 WeakPolarHBondContact O-CA 3.35Å; S2095-K2097 PolarHBondContact O-N 3.47Å; K2097-G2114 CarbonylContact O-C 3.57Å; K2097-G2114 WeakPolarHBondContact O-CA 3.1Å; K2097-G2115 PolarHBondContact O-N 3.44Å; K2097-V2119 HydrophobicContact CD-CG2 4.16Å
2098	G	70.3	Confident	58.5	Low	2 Å²	2	69.9 Å²	69.9	2%	0.021	35%	0.354	C	S	.	.			trans	-102.3	141.8	169.9	0	0	0	0	0	112	C2036 S2037 L2051 Q2096 T2113 G2114	C2036-G2098 WeakPolarHBondContact CB-O 3.32Å; S2037-G2098 WeakPolarHBondContact CB-O 3.4Å; L2051-G2098 VanDerWaalsContact CD2-C 3.45Å; L2051-G2098 WeakPolarHBondContact CD2-O 3.33Å; Q2096-G2098 PolarHBondContact O-N 3.12Å; G2098-T2113 CarbonylContact C-O 3.54Å; G2098-T2113 WeakPolarHBondContact CA-O 3.28Å; G2098-G2114 WeakPolarHBondContact CA-O 3.28Å
2099	V	78.3	Confident	60.5	Low	36.2 Å²	36.2	62 Å²	62	22%	0.219	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	144.1	175.9	-176.8	0	0	0	0	109.5	I1812 Q2112 T2113 C2664 L2666	I1812-V2099 HydrophobicContact CG2-CB 4.31Å; I1812-V2099 HydrophobicContact CG2-CG1 4.22Å; V2099-Q2112 CarbonylContact O-C 3.55Å; V2099-Q2112 WeakPolarHBondContact O-CA 3.35Å; V2099-T2113 WeakPolarHBondContact CA-OG1 3.44Å; V2099-T2113 WeakPolarHBondContact CB-OG1 3.31Å; V2099-T2113 PolarHBondContact N-O 3.14Å; V2099-T2113 PolarHBondContact N-OG1 3.04Å; V2099-T2113 PolarHBondContact O-N 2.99Å; V2099-T2113 PolarHBondContact O-OG1 3.12Å; V2099-T2113 VanDerWaalsContact O-OG1 3.13Å; V2099-C2664 VanDerWaalsContact CG2-O 3.26Å; V2099-C2664 WeakPolarHBondContact CG2-O 3.45Å; V2099-L2666 HydrophobicContact CB-CB 4.39Å; V2099-L2666 HydrophobicContact CB-CD1 4.4Å; V2099-L2666 HydrophobicContact CG1-CB 4.16Å; V2099-L2666 WeakPolarHBondContact O-CD1 2.93Å
2100	L	85	Confident	62.8	Low	7.6 Å²	7.6	55.1 Å²	55.1	4%	0.04	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	141.6	173.8	38.1	125.8	0	0	0	110.8	S2037 A2039 A2049 I2050 L2051 L2110 I2111 Q2112	S2037-L2100 VanDerWaalsContact C-CD2 3.48Å; S2037-L2100 VanDerWaalsContact O-CD2 3.25Å; S2037-L2100 WeakPolarHBondContact O-CD2 3.28Å; S2037-L2100 PolarHBondContact OG-N 3.07Å; A2039-L2100 HydrophobicContact CB-CB 3.99Å; A2039-L2100 HydrophobicContact CB-CD1 3.33Å; A2039-L2100 HydrophobicContact CB-CG 4.41Å; A2049-L2100 VanDerWaalsContact C-CD1 3.46Å; A2049-L2100 HydrophobicContact CB-CD1 3.65Å; I2050-L2100 VanDerWaalsContact C-CD2 3.44Å; L2051-L2100 HydrophobicContact CB-CB 4.37Å; L2051-L2100 HydrophobicContact CB-CD1 3.56Å; L2051-L2100 HydrophobicContact CB-CD2 3.71Å; L2051-L2100 HydrophobicContact CB-CG 4.1Å; L2051-L2100 HydrophobicContact CD2-CB 4.45Å; L2051-L2100 HydrophobicContact CD2-CD2 4.28Å; L2051-L2100 HydrophobicContact CD2-CG 4.12Å; L2100-L2110 HydrophobicContact CB-CD1 4.34Å; L2100-L2110 HydrophobicContact CD1-CD1 3.88Å; L2100-L2110 HydrophobicContact CD2-CD1 4.16Å; L2100-L2110 HydrophobicContact CD2-CD2 4.35Å; L2100-L2110 HydrophobicContact CD2-CG 4.27Å; L2100-I2111 CarbonylContact C-O 3.48Å; L2100-I2111 VanDerWaalsContact CA-O 3.28Å; L2100-I2111 WeakPolarHBondContact CA-O 3.15Å; L2100-Q2112 HydrophobicContact CD2-CB 3.73Å; L2100-Q2112 HydrophobicContact CD2-CG 4.03Å
2101	C	84.6	Confident	65	Low	26 Å²	26	49.2 Å²	49.2	18%	0.176	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	147.2	171.8	116.9	0	0	0	0	111.4	I2111 L2666	C2101-I2111 PolarHBondContact N-O 3.27Å; C2101-I2111 WeakPolarHBondContact O-CB 3.45Å; C2101-I2111 PolarHBondContact O-N 3Å; C2101-L2666 HydrophobicContact CB-CD2 3.88Å; C2101-L2666 WeakPolarHBondContact SG-CD2 3.31Å
2102	F	84.2	Confident	67.1	Low	8.8 Å²	8.8	41.8 Å²	41.8	4%	0.039	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	142.9	171.4	-77.5	-81.5	0	0	0	111	A2039 Y2040 L2047 A2049 K2104 Y2109 L2110 A2127	A2039-F2102 HydrophobicContact CB-CD2 3.92Å; A2039-F2102 HydrophobicContact CB-CE2 4.22Å; A2039-F2102 VanDerWaalsContact O-CE2 3.31Å; A2039-F2102 WeakPolarHBondContact O-CE2 3.42Å; Y2040-F2102 WeakPolarHBondContact O-CD2 3.31Å; L2047-F2102 HydrophobicContact CB-CZ 4.26Å; A2049-F2102 HydrophobicContact CB-CE2 3.65Å; A2049-F2102 HydrophobicContact CB-CZ 3.68Å; F2102-K2104 PolarHBondContact O-N 3.11Å; F2102-Y2109 CarbonylContact C-O 3.57Å; F2102-Y2109 WeakPolarHBondContact CA-O 3.2Å; F2102-L2110 HydrophobicContact CD1-CB 4.26Å; F2102-L2110 HydrophobicContact CD1-CD1 4.2Å; F2102-L2110 HydrophobicContact CD2-CD1 4.28Å; F2102-L2110 HydrophobicContact CE1-CB 4.07Å; F2102-L2110 HydrophobicContact CE1-CD1 4.02Å; F2102-L2110 HydrophobicContact CE1-CG 4.44Å; F2102-L2110 HydrophobicContact CE2-CD1 4.12Å; F2102-L2110 HydrophobicContact CG-CD1 4.33Å; F2102-L2110 HydrophobicContact CZ-CD1 4Å; F2102-A2127 HydrophobicContact CD1-CB 4.06Å; F2102-A2127 HydrophobicContact CE1-CB 3.68Å
2103	S	76.3	Confident	68.8	Low	9.2 Å²	9.2	35.7 Å²	35.7	6%	0.064	19%	0.187	C	C	.	.	P	Polyproline II helix	trans	-63.4	125.8	172.7	68.2	0	0	0	0	110.6	G2107 R2108 Y2109	S2103-G2107 WeakPolarHBondContact O-CA 3.33Å; S2103-G2107 PolarHBondContact O-N 3.21Å; S2103-R2108 PolarHBondContact OG-N 3.14Å; S2103-Y2109 PolarHBondContact N-O 3.08Å; S2103-Y2109 PolarHBondContact OG-N 3.06Å; S2103-Y2109 PolarHBondContact OG-O 3.36Å
2104	K	71.6	Confident	69.8	Low	93 Å²	93	32.3 Å²	32.3	40%	0.404	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94	147.3	176.1	-65	175.6	-169.8	157.8	0	110.3	R1816 P2042 F2102 C2668 T2679	R1816-K2104 HydrophobicContact CG-CD 4.17Å; P2042-K2104 HydrophobicContact CB-CG 4.35Å; F2102-K2104 PolarHBondContact O-N 3.11Å; K2104-C2668 WeakPolarHBondContact CD-O 3.45Å; K2104-T2679 WeakPolarHBondContact O-CG2 3.38Å
2105	P	61.4	Low	70.7	Confident	65.8 Å²	65.8	31.5 Å²	31.5	43%	0.427	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	cis	-90.3	-14.5	2	35.1	-34	0	0	0	114	Y1868 P2042 G2107 K2670	Y1868-P2105 HydrophobicContact CE1-CB 4.36Å; Y1868-P2105 HydrophobicContact CE2-CB 4.18Å; Y1868-P2105 WeakPolarHBondContact OH-CB 3.41Å; P2042-P2105 WeakPolarHBondContact CB-O 3.28Å; P2042-P2105 VanDerWaalsContact CG-O 3.26Å; P2042-P2105 WeakPolarHBondContact CG-O 3.32Å; P2105-G2107 PolarHBondContact O-N 2.91Å; P2105-K2670 HydrophobicContact CG-CD 4.28Å
2106	T	65	Low	71.2	Confident	60.6 Å²	60.6	31.4 Å²	31.4	37%	0.372	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-20.9	-166.6	56.9	0	0	0	0	114.6	N2043 R2108	N2043-T2106 PolarHBondContact ND2-O 3.15Å; N2043-T2106 VanDerWaalsContact OD1-C 3.27Å; N2043-T2106 PolarHBondContact OD1-O 2.89Å; T2106-R2108 PolarHBondContact O-N 3.2Å; T2106-R2108 WeakPolarHBondContact OG1-CB 3.26Å; T2106-R2108 PolarHBondContact OG1-N 3.03Å
2107	G	71.7	Confident	71.1	Confident	1.8 Å²	1.8	31.4 Å²	31.4	2%	0.019	18%	0.182	C	C	.	.			trans	68.5	15.4	-173.4	0	0	0	0	0	113.7	P2042 S2103 P2105 Y2109 A2127	P2042-G2107 VanDerWaalsContact CG-CA 3.46Å; P2042-G2107 VanDerWaalsContact CG-N 3.32Å; S2103-G2107 WeakPolarHBondContact O-CA 3.33Å; S2103-G2107 PolarHBondContact O-N 3.21Å; P2105-G2107 PolarHBondContact O-N 2.91Å; G2107-Y2109 VanDerWaalsContact C-N 3.31Å; G2107-Y2109 PolarHBondContact O-N 3.14Å; G2107-A2127 VanDerWaalsContact O-CB 3.28Å; G2107-A2127 WeakPolarHBondContact O-CB 3.31Å
2108	R	71.7	Confident	70.6	Confident	82 Å²	82	28.8 Å²	28.8	31%	0.309	17%	0.172	S	C	.	.			trans	-62.8	-36.4	-174.2	-178.8	175	178.8	179.6	-2	113.2	S2103 T2106 N2126 A2127 H2128 E2133 L2705	S2103-R2108 PolarHBondContact OG-N 3.14Å; T2106-R2108 PolarHBondContact O-N 3.2Å; T2106-R2108 WeakPolarHBondContact OG1-CB 3.26Å; T2106-R2108 PolarHBondContact OG1-N 3.03Å; R2108-N2126 PolarHBondContact O-OD1 3.09Å; R2108-N2126 VanDerWaalsContact O-OD1 3.06Å; R2108-A2127 WeakPolarHBondContact O-CB 3.39Å; R2108-A2127 PolarHBondContact O-N 3.12Å; R2108-H2128 WeakPolarHBondContact CA-CE1 3.43Å; R2108-H2128 WeakPolarHBondContact CA-ND1 3.45Å; R2108-E2133 IonicContact CZ-OE1 3.16Å; R2108-E2133 IonicContact CZ-OE2 2.75Å; R2108-E2133 IonicContact NH1-OE1 3.26Å; R2108-E2133 IonicContact NH1-OE2 3.68Å; R2108-E2133 PolarHBondContact NH1-OE2 2.84Å; R2108-E2133 VanDerWaalsContact NH2-CD 3.27Å; R2108-E2133 IonicContact NH2-OE1 2.77Å; R2108-E2133 PolarHBondContact NH2-OE1 2.94Å; R2108-E2133 IonicContact NH2-OE2 2.71Å; R2108-E2133 PolarHBondContact NH2-OE2 3.24Å; R2108-L2705 HydrophobicContact CB-CD2 4.38Å; R2108-L2705 PolarHBondContact NH1-O 2.75Å
2109	Y	77.3	Confident	69.8	Low	31.4 Å²	31.4	32.6 Å²	32.6	12%	0.123	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	142	-179.7	-54	-71.6	0	0	0	111.1	I1793 F2102 S2103 G2107 V2124 W2125 H2652 P2704 L2705	I1793-Y2109 HydrophobicContact CD1-CD1 4.13Å; I1793-Y2109 HydrophobicContact CD1-CE1 3.5Å; I1793-Y2109 VanDerWaalsContact CD1-CE1 3.5Å; F2102-Y2109 CarbonylContact C-O 3.57Å; F2102-Y2109 WeakPolarHBondContact CA-O 3.2Å; S2103-Y2109 PolarHBondContact N-O 3.08Å; S2103-Y2109 PolarHBondContact OG-N 3.06Å; S2103-Y2109 PolarHBondContact OG-O 3.36Å; G2107-Y2109 VanDerWaalsContact C-N 3.31Å; G2107-Y2109 PolarHBondContact O-N 3.14Å; Y2109-V2124 HydrophobicContact CD1-CG1 4.08Å; Y2109-V2124 HydrophobicContact CD2-CG1 4.47Å; Y2109-V2124 HydrophobicContact CG-CG1 4.06Å; Y2109-W2125 CarbonylContact C-O 3.47Å; Y2109-W2125 WeakPolarHBondContact CA-O 3.38Å; Y2109-W2125 WeakPolarHBondContact CB-O 3.49Å; Y2109-H2652 HydrophobicContact CE1-CB 4.4Å; Y2109-H2652 AromaticContact CE1-CD2 3.77Å; Y2109-H2652 AromaticContact CE1-CG 3.87Å; Y2109-H2652 AromaticContact CE1-NE2 3.74Å; Y2109-H2652 AromaticContact CZ-CD2 3.99Å; Y2109-H2652 AromaticContact CZ-CE1 3.95Å; Y2109-H2652 AromaticContact CZ-NE2 3.85Å; Y2109-P2704 HydrophobicContact CE2-CB 3.85Å; Y2109-P2704 WeakPolarHBondContact OH-CB 3.36Å; Y2109-L2705 HydrophobicContact CD2-CD2 3.62Å; Y2109-L2705 HydrophobicContact CE2-CD2 3.59Å; Y2109-L2705 PolarHBondContact OH-O 3.3Å
2110	L	80.9	Confident	68.8	Low	1.4 Å²	1.4	32.1 Å²	32.1	1%	0.007	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	119.8	167.9	174.3	66.2	0	0	0	107.6	A2049 I2059 L2071 L2100 F2102 W2125 A2127	A2049-L2110 HydrophobicContact CB-CD1 3.67Å; A2049-L2110 HydrophobicContact CB-CD2 3.86Å; A2049-L2110 HydrophobicContact CB-CG 4.39Å; I2059-L2110 HydrophobicContact CD1-CD2 4.33Å; I2059-L2110 HydrophobicContact CG1-CD2 4.43Å; L2071-L2110 HydrophobicContact CD1-CD2 3.85Å; L2100-L2110 HydrophobicContact CB-CD1 4.34Å; L2100-L2110 HydrophobicContact CD1-CD1 3.88Å; L2100-L2110 HydrophobicContact CD2-CD1 4.16Å; L2100-L2110 HydrophobicContact CD2-CD2 4.35Å; L2100-L2110 HydrophobicContact CD2-CG 4.27Å; F2102-L2110 HydrophobicContact CD1-CB 4.26Å; F2102-L2110 HydrophobicContact CD1-CD1 4.2Å; F2102-L2110 HydrophobicContact CD2-CD1 4.28Å; F2102-L2110 HydrophobicContact CE1-CB 4.07Å; F2102-L2110 HydrophobicContact CE1-CD1 4.02Å; F2102-L2110 HydrophobicContact CE1-CG 4.44Å; F2102-L2110 HydrophobicContact CE2-CD1 4.12Å; F2102-L2110 HydrophobicContact CG-CD1 4.33Å; F2102-L2110 HydrophobicContact CZ-CD1 4Å; L2110-W2125 HydrophobicContact CB-CB 4.31Å; L2110-W2125 PolarHBondContact N-O 2.97Å; L2110-W2125 WeakPolarHBondContact O-CA 3.28Å; L2110-W2125 WeakPolarHBondContact O-CB 3.39Å; L2110-W2125 VanDerWaalsContact O-CD1 3.28Å; L2110-W2125 PolarHBondContact O-N 3.03Å; L2110-A2127 HydrophobicContact CB-CB 4.33Å
2111	I	80.1	Confident	67.6	Low	16.4 Å²	16.4	36.7 Å²	36.7	8%	0.084	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	126.6	-177	-54.7	168.8	0	0	0	107.4	L1814 L2100 C2101 I2122 N2123 V2124 L2666 C2668 L2681 L2703	L1814-I2111 HydrophobicContact CD1-CD1 3.49Å; L1814-I2111 VanDerWaalsContact CD1-CD1 3.49Å; L2100-I2111 CarbonylContact C-O 3.48Å; L2100-I2111 VanDerWaalsContact CA-O 3.28Å; L2100-I2111 WeakPolarHBondContact CA-O 3.15Å; C2101-I2111 PolarHBondContact N-O 3.27Å; C2101-I2111 WeakPolarHBondContact O-CB 3.45Å; C2101-I2111 PolarHBondContact O-N 3Å; I2111-I2122 HydrophobicContact CG2-CG2 3.5Å; I2111-I2122 VanDerWaalsContact CG2-CG2 3.45Å; I2111-N2123 CarbonylContact C-O 3.54Å; I2111-N2123 WeakPolarHBondContact CA-O 3.38Å; I2111-V2124 HydrophobicContact CG1-CG1 4.37Å; I2111-V2124 HydrophobicContact CG1-CG2 4.4Å; I2111-V2124 HydrophobicContact CG2-CG2 4.44Å; I2111-L2666 HydrophobicContact CB-CD2 4.01Å; I2111-L2666 HydrophobicContact CG2-CD1 3.86Å; I2111-L2666 HydrophobicContact CG2-CD2 4.03Å; I2111-L2666 HydrophobicContact CG2-CG 4.33Å; I2111-C2668 HydrophobicContact CD1-CB 4.47Å; I2111-L2681 HydrophobicContact CD1-CB 4.49Å; I2111-L2681 HydrophobicContact CD1-CD1 3.8Å; I2111-L2681 HydrophobicContact CD1-CD2 4.14Å; I2111-L2681 HydrophobicContact CD1-CG 4.37Å; I2111-L2681 HydrophobicContact CG2-CD1 4.09Å; I2111-L2681 HydrophobicContact CG2-CD2 3.91Å; I2111-L2703 HydrophobicContact CD1-CD1 3.98Å; I2111-L2703 HydrophobicContact CG1-CD1 4.45Å
2112	Q	79.5	Confident	67	Low	3 Å²	3	36.5 Å²	36.5	1%	0.014	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	129.7	179.3	174.2	-179.4	-14.9	0	0	109.5	L2051 G2055 S2057 V2099 L2100 G2114 I2122 N2123 W2125	L2051-Q2112 HydrophobicContact CD1-CG 4.23Å; L2051-Q2112 VanDerWaalsContact CD1-NE2 3.27Å; L2051-Q2112 HydrophobicContact CD2-CG 4.1Å; G2055-Q2112 PolarHBondContact O-NE2 2.88Å; S2057-Q2112 VanDerWaalsContact CB-OE1 3.32Å; S2057-Q2112 PolarHBondContact OG-OE1 3.08Å; V2099-Q2112 CarbonylContact O-C 3.55Å; V2099-Q2112 WeakPolarHBondContact O-CA 3.35Å; L2100-Q2112 HydrophobicContact CD2-CB 3.73Å; L2100-Q2112 HydrophobicContact CD2-CG 4.03Å; Q2112-G2114 PolarHBondContact NE2-O 2.91Å; Q2112-I2122 CarbonylContact O-C 3.52Å; Q2112-I2122 WeakPolarHBondContact O-CA 3.41Å; Q2112-N2123 HydrophobicContact CB-CB 4.35Å; Q2112-N2123 PolarHBondContact N-O 3.32Å; Q2112-N2123 PolarHBondContact O-N 3.13Å; Q2112-W2125 VanDerWaalsContact OE1-NE1 3.15Å
2113	T	72.5	Confident	66.3	Low	11.8 Å²	11.8	36.5 Å²	36.5	7%	0.072	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	128.6	167.2	50.4	0	0	0	0	110	I1812 G2098 V2099 I2122 P2663 L2666	I1812-T2113 HydrophobicContact CD1-CG2 4Å; I1812-T2113 HydrophobicContact CG2-CG2 3.85Å; G2098-T2113 CarbonylContact C-O 3.54Å; G2098-T2113 WeakPolarHBondContact CA-O 3.28Å; V2099-T2113 WeakPolarHBondContact CA-OG1 3.44Å; V2099-T2113 WeakPolarHBondContact CB-OG1 3.31Å; V2099-T2113 PolarHBondContact N-O 3.14Å; V2099-T2113 PolarHBondContact N-OG1 3.04Å; V2099-T2113 PolarHBondContact O-N 2.99Å; V2099-T2113 PolarHBondContact O-OG1 3.12Å; V2099-T2113 VanDerWaalsContact O-OG1 3.13Å; T2113-I2122 HydrophobicContact CG2-CB 4.35Å; T2113-I2122 HydrophobicContact CG2-CD1 4.36Å; T2113-I2122 HydrophobicContact CG2-CG1 3.83Å; T2113-I2122 HydrophobicContact CG2-CG2 4.1Å; T2113-P2663 HydrophobicContact CG2-CB 3.71Å; T2113-P2663 HydrophobicContact CG2-CG 4.1Å; T2113-L2666 HydrophobicContact CG2-CB 4.2Å; T2113-L2666 HydrophobicContact CG2-CD1 3.37Å; T2113-L2666 HydrophobicContact CG2-CD2 3.58Å; T2113-L2666 HydrophobicContact CG2-CG 3.9Å; T2113-L2666 VanDerWaalsContact CG2-CG 3.47Å; T2113-L2666 WeakPolarHBondContact OG1-CD1 3.45Å
2114	G	62.4	Low	66.2	Low	9.2 Å²	9.2	37 Å²	37	10%	0.095	21%	0.214	C	C	.	.			trans	60.5	-177.5	169.3	0	0	0	0	0	116.7	K2097 G2098 Q2112 S2118 R2121	K2097-G2114 CarbonylContact O-C 3.57Å; K2097-G2114 WeakPolarHBondContact O-CA 3.1Å; G2098-G2114 WeakPolarHBondContact CA-O 3.28Å; Q2112-G2114 PolarHBondContact NE2-O 2.91Å; G2114-S2118 VanDerWaalsContact C-OG 3.27Å; G2114-S2118 WeakPolarHBondContact CA-OG 3.14Å; G2114-R2121 PolarHBondContact N-O 2.98Å; G2114-R2121 VanDerWaalsContact N-O 3.15Å
2115	G	56.9	Low	66.2	Low	10.8 Å²	10.8	34.1 Å²	34.1	11%	0.111	20%	0.2	C	C	.	.			trans	96.1	131.5	-171.1	0	0	0	0	0	112.1	G2055 K2097 S2118	G2055-G2115 VanDerWaalsContact CA-C 3.41Å; G2055-G2115 VanDerWaalsContact CA-CA 3.46Å; G2055-G2115 WeakPolarHBondContact CA-O 3.46Å; K2097-G2115 PolarHBondContact O-N 3.44Å; G2115-S2118 PolarHBondContact O-N 2.98Å; G2115-S2118 PolarHBondContact O-OG 2.93Å
2116	G	53.5	Low	66.6	Low	39.2 Å²	39.2	32.9 Å²	32.9	40%	0.404	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.1	-148.5	-174.8	0	0	0	0	0	113.6	R2053 E2054 S2118 V2119	R2053-G2116 PolarHBondContact O-N 3.43Å; E2054-G2116 VanDerWaalsContact C-CA 3.47Å; E2054-G2116 VanDerWaalsContact O-CA 3.25Å; E2054-G2116 WeakPolarHBondContact O-CA 3.24Å; E2054-G2116 PolarHBondContact O-N 3.18Å; G2116-S2118 VanDerWaalsContact C-N 3.27Å; G2116-S2118 PolarHBondContact O-N 2.92Å; G2116-S2118 VanDerWaalsContact O-N 3.17Å; G2116-V2119 WeakPolarHBondContact O-CG2 3.4Å
2117	S	49.8	Very low	66.8	Low	77.8 Å²	77.8	30.2 Å²	30.2	54%	0.544	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-11.4	-176.7	105.4	0	0	0	0	114.7	F2077 V2119	F2077-S2117 VanDerWaalsContact CE2-CB 3.44Å; S2117-V2119 VanDerWaalsContact C-N 3.31Å; S2117-V2119 PolarHBondContact O-N 3.06Å
2118	S	49.1	Very low	66.4	Low	10.8 Å²	10.8	34.1 Å²	34.1	8%	0.076	19%	0.191	C	C	.	.			trans	-92.7	42.4	-170.9	56.5	0	0	0	0	114.1	E2073 G2114 G2115 G2116 G2120 R2121	E2073-S2118 WeakPolarHBondContact OE1-CB 3.31Å; E2073-S2118 PolarHBondContact OE1-OG 3.43Å; E2073-S2118 WeakPolarHBondContact OE2-CB 3.33Å; E2073-S2118 PolarHBondContact OE2-OG 3.08Å; G2114-S2118 VanDerWaalsContact C-OG 3.27Å; G2114-S2118 WeakPolarHBondContact CA-OG 3.14Å; G2115-S2118 PolarHBondContact O-N 2.98Å; G2115-S2118 PolarHBondContact O-OG 2.93Å; G2116-S2118 VanDerWaalsContact C-N 3.27Å; G2116-S2118 PolarHBondContact O-N 2.92Å; G2116-S2118 VanDerWaalsContact O-N 3.17Å; S2118-G2120 PolarHBondContact O-N 2.98Å; S2118-R2121 PolarHBondContact O-N 3.3Å
2119	V	54.9	Low	65.8	Low	82.2 Å²	82.2	32.6 Å²	32.6	50%	0.498	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	128.3	175.9	-173.2	0	0	0	0	110.3	F2083 K2097 G2116 S2117 I2662	F2083-V2119 HydrophobicContact CB-CG2 4.49Å; K2097-V2119 HydrophobicContact CD-CG2 4.16Å; G2116-V2119 WeakPolarHBondContact O-CG2 3.4Å; S2117-V2119 VanDerWaalsContact C-N 3.31Å; S2117-V2119 PolarHBondContact O-N 3.06Å; V2119-I2662 HydrophobicContact CG1-CG1 3.95Å
2120	G	56.5	Low	64.7	Low	24.6 Å²	24.6	31.7 Å²	31.7	25%	0.254	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.9	2.3	177.3	0	0	0	0	0	116.4	S2118 L2661	S2118-G2120 PolarHBondContact O-N 2.98Å; G2120-L2661 VanDerWaalsContact CA-O 3.31Å; G2120-L2661 WeakPolarHBondContact CA-O 3.2Å
2121	R	60.5	Low	63.4	Low	105 Å²	105	32.7 Å²	32.7	40%	0.396	20%	0.198	S	C	.	.			trans	-112	150.2	179.1	-65.6	-178.1	179.9	178.3	1.4	112.8	G2114 S2118 T2654	G2114-R2121 PolarHBondContact N-O 2.98Å; G2114-R2121 VanDerWaalsContact N-O 3.15Å; S2118-R2121 PolarHBondContact O-N 3.3Å; R2121-T2654 HydrophobicContact CB-CG2 3.92Å; R2121-T2654 HydrophobicContact CG-CG2 3.93Å
2122	I	70.6	Confident	62.1	Low	22.6 Å²	22.6	34.3 Å²	34.3	12%	0.116	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	116.7	171.2	-49.6	178.1	0	0	0	107.3	H1796 I1812 I2111 Q2112 T2113 T2654 L2655 L2666 L2681 S2683 W2701	H1796-I2122 HydrophobicContact CB-CD1 4.47Å; I1812-I2122 HydrophobicContact CD1-CD1 3.59Å; I2111-I2122 HydrophobicContact CG2-CG2 3.5Å; I2111-I2122 VanDerWaalsContact CG2-CG2 3.45Å; Q2112-I2122 CarbonylContact O-C 3.52Å; Q2112-I2122 WeakPolarHBondContact O-CA 3.41Å; T2113-I2122 HydrophobicContact CG2-CB 4.35Å; T2113-I2122 HydrophobicContact CG2-CD1 4.36Å; T2113-I2122 HydrophobicContact CG2-CG1 3.83Å; T2113-I2122 HydrophobicContact CG2-CG2 4.1Å; I2122-T2654 CarbonylContact O-C 3.58Å; I2122-T2654 WeakPolarHBondContact O-CA 3.36Å; I2122-L2655 HydrophobicContact CB-CB 4.12Å; I2122-L2655 HydrophobicContact CB-CD1 4.43Å; I2122-L2655 HydrophobicContact CG2-CD1 4.29Å; I2122-L2655 PolarHBondContact N-O 2.8Å; I2122-L2655 VanDerWaalsContact N-O 3.15Å; I2122-L2655 PolarHBondContact O-N 3.08Å; I2122-L2666 HydrophobicContact CD1-CD2 4.37Å; I2122-L2666 HydrophobicContact CG2-CD1 3.77Å; I2122-L2666 HydrophobicContact CG2-CD2 4.11Å; I2122-L2681 HydrophobicContact CG2-CD2 4.41Å; I2122-S2683 VanDerWaalsContact CD1-OG 3.32Å; I2122-S2683 WeakPolarHBondContact CD1-OG 3.15Å; I2122-W2701 HydrophobicContact CD1-CZ2 4.25Å
2123	N	70.3	Confident	60.8	Low	8 Å²	8	40.4 Å²	40.4	4%	0.043	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	133.6	179	-64.6	-34.1	0	0	0	110	E2073 I2111 Q2112 W2125 Y2651 T2654	E2073-N2123 PolarHBondContact OE1-ND2 3.09Å; E2073-N2123 PolarHBondContact OE1-OD1 3.15Å; E2073-N2123 PolarHBondContact OE2-ND2 2.95Å; I2111-N2123 CarbonylContact C-O 3.54Å; I2111-N2123 WeakPolarHBondContact CA-O 3.38Å; Q2112-N2123 HydrophobicContact CB-CB 4.35Å; Q2112-N2123 PolarHBondContact N-O 3.32Å; Q2112-N2123 PolarHBondContact O-N 3.13Å; N2123-W2125 HydrophobicContact CB-CZ2 4.28Å; N2123-Y2651 HydrophobicContact CB-CE2 4.04Å; N2123-Y2651 PolarHBondContact OD1-OH 2.75Å; N2123-Y2651 VanDerWaalsContact OD1-OH 3.12Å; N2123-T2654 PolarHBondContact OD1-OG1 3.05Å
2124	V	73.6	Confident	59.9	Low	20.2 Å²	20.2	41.5 Å²	41.5	12%	0.122	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	114.1	176.3	-174	0	0	0	0	108.2	Y2109 I2111 H2652 A2653 L2655 L2703	Y2109-V2124 HydrophobicContact CD1-CG1 4.08Å; Y2109-V2124 HydrophobicContact CD2-CG1 4.47Å; Y2109-V2124 HydrophobicContact CG-CG1 4.06Å; I2111-V2124 HydrophobicContact CG1-CG1 4.37Å; I2111-V2124 HydrophobicContact CG1-CG2 4.4Å; I2111-V2124 HydrophobicContact CG2-CG2 4.44Å; V2124-H2652 HydrophobicContact CB-CB 4.43Å; V2124-H2652 HydrophobicContact CG1-CB 4.24Å; V2124-H2652 WeakPolarHBondContact O-CA 3.35Å; V2124-H2652 VanDerWaalsContact O-CB 3.25Å; V2124-H2652 WeakPolarHBondContact O-CB 3.3Å; V2124-H2652 PolarHBondContact O-N 2.72Å; V2124-A2653 HydrophobicContact CB-CB 4.47Å; V2124-A2653 PolarHBondContact N-O 3.23Å; V2124-A2653 PolarHBondContact O-N 3.06Å; V2124-L2655 HydrophobicContact CG2-CD1 4.17Å; V2124-L2655 HydrophobicContact CG2-CG 4.02Å; V2124-L2703 HydrophobicContact CG1-CD1 4.34Å; V2124-L2703 HydrophobicContact CG1-CD2 4.25Å; V2124-L2703 HydrophobicContact CG2-CD1 4.35Å; V2124-L2703 HydrophobicContact CG2-CD2 4.33Å
2125	W	72.5	Confident	59.6	Low	32 Å²	32	45.3 Å²	45.3	12%	0.121	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	148.4	178.6	-52.8	95.7	0	0	0	110	L2071 E2073 Y2109 L2110 Q2112 N2123 A2127 Y2651	L2071-W2125 HydrophobicContact CB-CD2 4.22Å; L2071-W2125 HydrophobicContact CB-CE3 4.28Å; L2071-W2125 HydrophobicContact CB-CH2 4.25Å; L2071-W2125 HydrophobicContact CB-CZ2 4.19Å; L2071-W2125 HydrophobicContact CB-CZ3 4.28Å; L2071-W2125 HydrophobicContact CD1-CB 4.17Å; L2071-W2125 HydrophobicContact CD1-CD2 4.06Å; L2071-W2125 HydrophobicContact CD1-CE3 4.25Å; L2071-W2125 HydrophobicContact CD1-CG 3.88Å; L2071-W2125 HydrophobicContact CD2-CD2 4.43Å; L2071-W2125 HydrophobicContact CD2-CE3 4.14Å; L2071-W2125 HydrophobicContact CD2-CZ3 4.37Å; L2071-W2125 HydrophobicContact CG-CD2 4.31Å; L2071-W2125 HydrophobicContact CG-CE3 4.33Å; E2073-W2125 HydrophobicContact CG-CH2 4.03Å; E2073-W2125 HydrophobicContact CG-CZ2 4.17Å; Y2109-W2125 CarbonylContact C-O 3.47Å; Y2109-W2125 WeakPolarHBondContact CA-O 3.38Å; Y2109-W2125 WeakPolarHBondContact CB-O 3.49Å; L2110-W2125 HydrophobicContact CB-CB 4.31Å; L2110-W2125 PolarHBondContact N-O 2.97Å; L2110-W2125 WeakPolarHBondContact O-CA 3.28Å; L2110-W2125 WeakPolarHBondContact O-CB 3.39Å; L2110-W2125 VanDerWaalsContact O-CD1 3.28Å; L2110-W2125 PolarHBondContact O-N 3.03Å; Q2112-W2125 VanDerWaalsContact OE1-NE1 3.15Å; N2123-W2125 HydrophobicContact CB-CZ2 4.28Å; W2125-A2127 PolarHBondContact O-N 3.27Å; W2125-Y2651 HydrophobicContact CD2-CD2 4.18Å; W2125-Y2651 AromaticContact CE3-CD2 3.85Å; W2125-Y2651 HydrophobicContact CE3-CD2 4.02Å; W2125-Y2651 AromaticContact CH2-CD2 3.69Å; W2125-Y2651 HydrophobicContact CH2-CD2 3.89Å; W2125-Y2651 HydrophobicContact CH2-CE2 4.32Å; W2125-Y2651 HydrophobicContact CZ2-CD2 4.01Å; W2125-Y2651 HydrophobicContact CZ2-CE2 4.27Å; W2125-Y2651 AromaticContact CZ3-CD2 3.77Å; W2125-Y2651 HydrophobicContact CZ3-CD2 3.77Å; W2125-Y2651 HydrophobicContact CZ3-CG 4.35Å
2126	N	68.9	Low	59.9	Low	40.8 Å²	40.8	50.1 Å²	50.1	22%	0.218	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	117.3	164.1	-172.2	-10.7	0	0	0	108.8	R2108 H2128 L2129 G2130 A2131 T2649 G2650	R2108-N2126 PolarHBondContact O-OD1 3.09Å; R2108-N2126 VanDerWaalsContact O-OD1 3.06Å; N2126-H2128 PolarHBondContact O-N 3.14Å; N2126-H2128 VanDerWaalsContact O-N 3.13Å; N2126-H2128 WeakPolarHBondContact OD1-CB 3.34Å; N2126-H2128 PolarHBondContact OD1-N 3.16Å; N2126-H2128 VanDerWaalsContact OD1-N 3.08Å; N2126-H2128 PolarHBondContact OD1-ND1 3.02Å; N2126-L2129 HydrophobicContact CB-CD1 3.75Å; N2126-L2129 HydrophobicContact CB-CG 3.94Å; N2126-L2129 WeakPolarHBondContact O-CB 3.46Å; N2126-L2129 PolarHBondContact O-N 2.89Å; N2126-L2129 VanDerWaalsContact O-N 3.1Å; N2126-G2130 PolarHBondContact O-N 2.92Å; N2126-A2131 WeakPolarHBondContact CB-O 3.42Å; N2126-A2131 PolarHBondContact ND2-O 3.35Å; N2126-T2649 WeakPolarHBondContact O-CB 2.96Å; N2126-G2650 WeakPolarHBondContact CB-O 3.45Å; N2126-G2650 PolarHBondContact N-O 3.35Å
2127	A	69.2	Low	60.5	Low	3 Å²	3	50.4 Å²	50.4	3%	0.025	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	-21	-179.8	0	0	0	0	0	113.1	F2102 G2107 R2108 L2110 W2125 L2129 G2130	F2102-A2127 HydrophobicContact CD1-CB 4.06Å; F2102-A2127 HydrophobicContact CE1-CB 3.68Å; G2107-A2127 VanDerWaalsContact O-CB 3.28Å; G2107-A2127 WeakPolarHBondContact O-CB 3.31Å; R2108-A2127 WeakPolarHBondContact O-CB 3.39Å; R2108-A2127 PolarHBondContact O-N 3.12Å; L2110-A2127 HydrophobicContact CB-CB 4.33Å; W2125-A2127 PolarHBondContact O-N 3.27Å; A2127-L2129 VanDerWaalsContact C-N 3.29Å; A2127-L2129 PolarHBondContact O-N 2.9Å; A2127-G2130 PolarHBondContact O-N 3.18Å
2128	H	64.8	Low	61.4	Low	83.6 Å²	83.6	51.1 Å²	51.1	39%	0.387	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	86.2	175.4	-60.5	84.9	0	0	0	110.6	R2108 N2126 G2130 A2131	R2108-H2128 WeakPolarHBondContact CA-CE1 3.43Å; R2108-H2128 WeakPolarHBondContact CA-ND1 3.45Å; N2126-H2128 PolarHBondContact O-N 3.14Å; N2126-H2128 VanDerWaalsContact O-N 3.13Å; N2126-H2128 WeakPolarHBondContact OD1-CB 3.34Å; N2126-H2128 PolarHBondContact OD1-N 3.16Å; N2126-H2128 VanDerWaalsContact OD1-N 3.08Å; N2126-H2128 PolarHBondContact OD1-ND1 3.02Å; H2128-G2130 PolarHBondContact O-N 2.98Å; H2128-G2130 VanDerWaalsContact O-N 3.16Å; H2128-A2131 PolarHBondContact O-N 3.32Å; H2128-A2131 VanDerWaalsContact O-N 3.14Å
2129	L	58.6	Low	62.3	Low	50.4 Å²	50.4	51.3 Å²	51.3	26%	0.264	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55	111.4	175	-63	157.2	0	0	0	111.4	I1775 L2068 N2126 A2127 I2457 S2458 M2460 P2646 T2649	I1775-L2129 HydrophobicContact CD1-CD1 4.48Å; L2068-L2129 HydrophobicContact CB-CD1 3.98Å; L2068-L2129 HydrophobicContact CD1-CD1 4.02Å; L2068-L2129 HydrophobicContact CD2-CD1 4.41Å; L2068-L2129 HydrophobicContact CG-CD1 4.41Å; N2126-L2129 HydrophobicContact CB-CD1 3.75Å; N2126-L2129 HydrophobicContact CB-CG 3.94Å; N2126-L2129 WeakPolarHBondContact O-CB 3.46Å; N2126-L2129 PolarHBondContact O-N 2.89Å; N2126-L2129 VanDerWaalsContact O-N 3.1Å; A2127-L2129 VanDerWaalsContact C-N 3.29Å; A2127-L2129 PolarHBondContact O-N 2.9Å; L2129-I2457 HydrophobicContact CD1-CG2 4.43Å; L2129-S2458 PolarHBondContact O-OG 2.92Å; L2129-M2460 VanDerWaalsContact O-CG 3.28Å; L2129-M2460 WeakPolarHBondContact O-CG 3.24Å; L2129-P2646 WeakPolarHBondContact CB-O 3.39Å; L2129-T2649 HydrophobicContact CD2-CG2 3.75Å; L2129-T2649 HydrophobicContact CG-CG2 4.49Å
2130	G	54.6	Low	62.8	Low	12.4 Å²	12.4	52.6 Å²	52.6	13%	0.128	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	129.9	36.8	174.5	0	0	0	0	0	115.3	N2126 A2127 H2128 P2132 M2460 E2645 L2648	N2126-G2130 PolarHBondContact O-N 2.92Å; A2127-G2130 PolarHBondContact O-N 3.18Å; H2128-G2130 PolarHBondContact O-N 2.98Å; H2128-G2130 VanDerWaalsContact O-N 3.16Å; G2130-P2132 WeakPolarHBondContact O-CD 3.38Å; G2130-M2460 WeakPolarHBondContact O-CE 3.31Å; G2130-E2645 CarbonylContact C-O 3.48Å; G2130-E2645 VanDerWaalsContact CA-O 3.25Å; G2130-E2645 WeakPolarHBondContact CA-O 3.44Å; G2130-L2648 PolarHBondContact N-O 3.12Å
2131	A	52.1	Low	63.1	Low	22.2 Å²	22.2	53.4 Å²	53.4	18%	0.183	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	125.4	177.3	0	0	0	0	0	111.2	P1787 N2126 H2128 E2133 Y2644 E2645 L2648	P1787-A2131 HydrophobicContact CB-CB 3.92Å; P1787-A2131 HydrophobicContact CG-CB 3.73Å; N2126-A2131 WeakPolarHBondContact CB-O 3.42Å; N2126-A2131 PolarHBondContact ND2-O 3.35Å; H2128-A2131 PolarHBondContact O-N 3.32Å; H2128-A2131 VanDerWaalsContact O-N 3.14Å; A2131-E2133 PolarHBondContact O-N 3.29Å; A2131-Y2644 CarbonylContact O-C 3.57Å; A2131-Y2644 WeakPolarHBondContact O-CA 3.13Å; A2131-E2645 PolarHBondContact N-O 2.95Å; A2131-E2645 VanDerWaalsContact N-O 3.11Å; A2131-E2645 PolarHBondContact O-N 2.9Å; A2131-L2648 HydrophobicContact CB-CB 4.07Å; A2131-L2648 HydrophobicContact CB-CD2 4.2Å; A2131-L2648 PolarHBondContact N-O 3.08Å
2132	P	53	Low	62.8	Low	50 Å²	50	55.3 Å²	55.3	33%	0.325	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	135.9	168.8	19.9	-19.4	0	0	0	111.3	I1789 I1790 L2068 G2130 G2134 R2642 V2643 Y2644	I1789-P2132 HydrophobicContact CB-CG 3.98Å; I1789-P2132 HydrophobicContact CG1-CG 3.81Å; I1789-P2132 HydrophobicContact CG2-CG 4Å; I1790-P2132 WeakPolarHBondContact O-CB 3.45Å; L2068-P2132 HydrophobicContact CD2-CG 4.26Å; G2130-P2132 WeakPolarHBondContact O-CD 3.38Å; P2132-G2134 VanDerWaalsContact C-N 3.33Å; P2132-G2134 PolarHBondContact O-N 3.4Å; P2132-R2642 HydrophobicContact CB-CG 4.38Å; P2132-V2643 WeakPolarHBondContact CA-O 3.48Å; P2132-Y2644 HydrophobicContact CB-CD1 4.05Å; P2132-Y2644 HydrophobicContact CB-CE1 3.95Å
2133	E	52.1	Low	61.9	Low	131 Å²	131	60.3 Å²	60.3	61%	0.612	32%	0.317	S	S	*	.	S	Bend	trans	-87.7	13.7	176.6	-105.8	-172.4	163.1	0	0	111.9	R2108 A2131 K2623 V2643	R2108-E2133 IonicContact CZ-OE1 3.16Å; R2108-E2133 IonicContact CZ-OE2 2.75Å; R2108-E2133 IonicContact NH1-OE1 3.26Å; R2108-E2133 IonicContact NH1-OE2 3.68Å; R2108-E2133 PolarHBondContact NH1-OE2 2.84Å; R2108-E2133 VanDerWaalsContact NH2-CD 3.27Å; R2108-E2133 IonicContact NH2-OE1 2.77Å; R2108-E2133 PolarHBondContact NH2-OE1 2.94Å; R2108-E2133 IonicContact NH2-OE2 2.71Å; R2108-E2133 PolarHBondContact NH2-OE2 3.24Å; A2131-E2133 PolarHBondContact O-N 3.29Å; E2133-K2623 VanDerWaalsContact CD-CE 3.48Å; E2133-K2623 WeakPolarHBondContact OE1-CE 3.35Å; E2133-K2623 IonicContact OE1-NZ 3.01Å; E2133-K2623 PolarHBondContact OE1-NZ 2.8Å; E2133-K2623 WeakPolarHBondContact OE2-CD 3.46Å; E2133-K2623 VanDerWaalsContact OE2-CE 3.32Å; E2133-K2623 WeakPolarHBondContact OE2-CE 3.25Å; E2133-K2623 IonicContact OE2-NZ 2.98Å; E2133-K2623 PolarHBondContact OE2-NZ 2.9Å; E2133-V2643 HydrophobicContact CB-CB 4.48Å; E2133-V2643 PolarHBondContact N-O 3.11Å
2134	G	54.7	Low	60.9	Low	35 Å²	35	69.5 Å²	69.5	36%	0.361	36%	0.357	S	S	.	.	S	Bend	trans	174.6	165.5	177.6	0	0	0	0	0	113.4	I1790 P2132 W2136 R2642	I1790-G2134 WeakPolarHBondContact CB-O 3.42Å; I1790-G2134 VanDerWaalsContact CD1-O 3.22Å; I1790-G2134 WeakPolarHBondContact CD1-O 3.28Å; I1790-G2134 WeakPolarHBondContact CG1-O 3.24Å; I1790-G2134 WeakPolarHBondContact CG2-O 3.19Å; P2132-G2134 VanDerWaalsContact C-N 3.33Å; P2132-G2134 PolarHBondContact O-N 3.4Å; G2134-W2136 PolarHBondContact O-N 3.07Å; G2134-R2642 PolarHBondContact O-NE 2.84Å; G2134-R2642 PolarHBondContact O-NH2 3.09Å
2135	P	55.6	Low	59.6	Low	88.8 Å²	88.8	77.3 Å²	77.3	58%	0.577	39%	0.392	S	S	*	.			trans	-71.3	157.7	177	30.5	-34.2	0	0	0	112.3	I2137 T2179	P2135-I2137 PolarHBondContact O-N 3.08Å; P2135-I2137 VanDerWaalsContact O-N 3.08Å; P2135-T2179 WeakPolarHBondContact CG-O 3.43Å
2136	W	62.6	Low	58.4	Low	111.8 Å²	111.8	82.7 Å²	82.7	42%	0.423	42%	0.42	S	S	.	.			trans	-67.9	127.3	163.3	-75.1	88.4	0	0	0	109.3	I1790 L2068 G2134 N2138 I2462 I2626 Q2628 Q2640 R2642	I1790-W2136 VanDerWaalsContact CG2-CD1 3.5Å; L2068-W2136 WeakPolarHBondContact O-CZ2 3.2Å; G2134-W2136 PolarHBondContact O-N 3.07Å; W2136-N2138 PolarHBondContact O-N 3.45Å; W2136-I2462 HydrophobicContact CH2-CG2 3.99Å; W2136-I2462 HydrophobicContact CZ2-CG2 3.73Å; W2136-I2626 HydrophobicContact CH2-CG2 4.13Å; W2136-Q2628 VanDerWaalsContact CH2-CD 3.47Å; W2136-Q2628 HydrophobicContact CH2-CG 3.78Å; W2136-Q2628 HydrophobicContact CZ3-CG 3.76Å; W2136-Q2640 HydrophobicContact CB-CB 4.48Å; W2136-Q2640 HydrophobicContact CD2-CG 4.2Å; W2136-Q2640 HydrophobicContact CE3-CB 3.97Å; W2136-Q2640 HydrophobicContact CE3-CG 3.55Å; W2136-Q2640 VanDerWaalsContact CE3-NE2 3.26Å; W2136-Q2640 HydrophobicContact CZ3-CG 3.95Å; W2136-R2642 HydrophobicContact CD2-CB 3.86Å; W2136-R2642 HydrophobicContact CE3-CB 3.64Å; W2136-R2642 HydrophobicContact CG-CB 4.47Å; W2136-R2642 HydrophobicContact CH2-CB 4.42Å; W2136-R2642 HydrophobicContact CZ3-CB 3.94Å
2137	I	65.7	Low	57.5	Low	45.4 Å²	45.4	91.4 Å²	91.4	23%	0.233	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	109.4	177.5	-62.5	168.3	0	0	0	108	P2135 V2139 V2176 I2178 Q2640 F2641	P2135-I2137 PolarHBondContact O-N 3.08Å; P2135-I2137 VanDerWaalsContact O-N 3.08Å; I2137-V2139 HydrophobicContact CG2-CG2 3.63Å; I2137-V2139 VanDerWaalsContact CG2-CG2 3.49Å; I2137-V2139 PolarHBondContact O-N 3.11Å; I2137-V2176 HydrophobicContact CG2-CG1 4.15Å; I2137-I2178 HydrophobicContact CD1-CB 4.36Å; I2137-I2178 HydrophobicContact CD1-CG2 4.07Å; I2137-I2178 VanDerWaalsContact CD1-O 3.24Å; I2137-I2178 WeakPolarHBondContact CD1-O 3.29Å; I2137-I2178 WeakPolarHBondContact CG1-O 3.41Å; I2137-Q2640 CarbonylContact O-C 3.52Å; I2137-Q2640 WeakPolarHBondContact O-CA 3.33Å; I2137-F2641 HydrophobicContact CB-CD1 4.41Å; I2137-F2641 HydrophobicContact CB-CE1 4.05Å; I2137-F2641 HydrophobicContact CB-CE2 4.15Å; I2137-F2641 HydrophobicContact CB-CZ 3.92Å; I2137-F2641 HydrophobicContact CD1-CE2 3.78Å; I2137-F2641 HydrophobicContact CD1-CZ 3.96Å; I2137-F2641 HydrophobicContact CG1-CE2 4.49Å; I2137-F2641 HydrophobicContact CG2-CD1 4.44Å; I2137-F2641 HydrophobicContact CG2-CE1 3.7Å; I2137-F2641 HydrophobicContact CG2-CE2 4.39Å; I2137-F2641 HydrophobicContact CG2-CZ 3.67Å; I2137-F2641 PolarHBondContact N-O 3.07Å; I2137-F2641 PolarHBondContact O-N 3.34Å
2138	N	69.9	Low	57	Low	92.8 Å²	92.8	98.6 Å²	98.6	50%	0.496	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	113	175.2	-102.5	5	0	0	0	109.4	W2136 I2140 E2638 Q2640	W2136-N2138 PolarHBondContact O-N 3.45Å; N2138-I2140 PolarHBondContact O-N 2.95Å; N2138-E2638 PolarHBondContact ND2-OE2 3.07Å; N2138-Q2640 WeakPolarHBondContact OD1-CB 3.48Å; N2138-Q2640 PolarHBondContact OD1-OE1 3.13Å
2139	V	67.5	Low	56.9	Low	15.8 Å²	15.8	98.2 Å²	98.2	10%	0.096	49%	0.493	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	98.4	177	-174.6	0	0	0	0	108.7	I2137 R2141 I2166 W2168 V2176 T2183 F2639 F2641	I2137-V2139 HydrophobicContact CG2-CG2 3.63Å; I2137-V2139 VanDerWaalsContact CG2-CG2 3.49Å; I2137-V2139 PolarHBondContact O-N 3.11Å; V2139-R2141 PolarHBondContact O-N 3.32Å; V2139-I2166 HydrophobicContact CB-CD1 4.34Å; V2139-I2166 HydrophobicContact CG1-CD1 4.27Å; V2139-I2166 HydrophobicContact CG2-CD1 3.96Å; V2139-W2168 HydrophobicContact CG1-CH2 4.43Å; V2139-W2168 HydrophobicContact CG1-CZ2 4.22Å; V2139-V2176 HydrophobicContact CG1-CG2 3.84Å; V2139-V2176 HydrophobicContact CG2-CB 4.38Å; V2139-V2176 HydrophobicContact CG2-CG1 4.1Å; V2139-V2176 HydrophobicContact CG2-CG2 4.19Å; V2139-T2183 HydrophobicContact CG1-CG2 4.12Å; V2139-F2639 HydrophobicContact CB-CD1 4.33Å; V2139-F2639 HydrophobicContact CG2-CD1 4.31Å; V2139-F2639 PolarHBondContact N-O 3.21Å; V2139-F2641 HydrophobicContact CG2-CD1 3.92Å; V2139-F2641 HydrophobicContact CG2-CE1 3.53Å
2140	I	65.4	Low	57.4	Low	108.4 Å²	108.4	98.4 Å²	98.4	56%	0.556	49%	0.494	S	S	*	.			trans	-92.8	119.3	177.3	-55.2	173.3	0	0	0	108.9	N2138 N2142	N2138-I2140 PolarHBondContact O-N 2.95Å; I2140-N2142 PolarHBondContact O-N 3.08Å; I2140-N2142 VanDerWaalsContact O-N 3.15Å
2141	R	63	Low	58.5	Low	43 Å²	43	100.5 Å²	100.5	16%	0.162	50%	0.501	C	S	.	.			trans	-84.7	117.2	169.9	-137.3	-178.4	175.2	-172.1	-2.9	110	V2139 K2143 W2168 D2170 L2172 T2174 S2186 D2188	V2139-R2141 PolarHBondContact O-N 3.32Å; R2141-K2143 PolarHBondContact O-N 3.11Å; R2141-K2143 VanDerWaalsContact O-N 3.07Å; R2141-W2168 HydrophobicContact CG-CZ2 4.39Å; R2141-D2170 IonicContact CZ-OD2 2.82Å; R2141-D2170 VanDerWaalsContact NH1-CG 3.3Å; R2141-D2170 IonicContact NH1-OD1 3.22Å; R2141-D2170 PolarHBondContact NH1-OD1 3.13Å; R2141-D2170 VanDerWaalsContact NH1-OD1 3.08Å; R2141-D2170 IonicContact NH1-OD2 2.9Å; R2141-D2170 PolarHBondContact NH1-OD2 3.03Å; R2141-D2170 IonicContact NH2-OD2 3.49Å; R2141-L2172 VanDerWaalsContact NH1-CD1 3.26Å; R2141-L2172 VanDerWaalsContact NH2-CB 3.31Å; R2141-T2174 HydrophobicContact CG-CG2 4.45Å; R2141-S2186 PolarHBondContact NH2-OG 3.04Å; R2141-S2186 VanDerWaalsContact NH2-OG 3.08Å; R2141-D2188 IonicContact CZ-OD1 2.75Å; R2141-D2188 IonicContact CZ-OD2 3.87Å; R2141-D2188 IonicContact NE-OD2 3.02Å; R2141-D2188 VanDerWaalsContact NH2-CG 3.3Å; R2141-D2188 IonicContact NH2-OD1 2.71Å; R2141-D2188 PolarHBondContact NH2-OD1 3.15Å; R2141-D2188 IonicContact NH2-OD2 3.24Å; R2141-D2188 PolarHBondContact NH2-OD2 3.23Å
2142	N	54.7	Low	59.8	Low	145 Å²	145	100.6 Å²	100.6	78%	0.775	50%	0.503	S	S	*	.			trans	-66.1	99.8	178.8	-79.7	-26.5	0	0	0	111.4	I2140 K2144	I2140-N2142 PolarHBondContact O-N 3.08Å; I2140-N2142 VanDerWaalsContact O-N 3.15Å; N2142-K2144 PolarHBondContact O-N 3.41Å
2143	K	51.9	Low	61.3	Low	127.4 Å²	127.4	100.3 Å²	100.3	55%	0.554	50%	0.5	S	S	*	.			trans	-93.1	92.9	171.5	-82.7	178.5	179.3	179.6	0	112.5	R2141 E2145 D2188	R2141-K2143 PolarHBondContact O-N 3.11Å; R2141-K2143 VanDerWaalsContact O-N 3.07Å; K2143-E2145 VanDerWaalsContact C-N 3.34Å; K2143-E2145 PolarHBondContact O-N 3.04Å; K2143-E2145 VanDerWaalsContact O-N 3.13Å; K2143-D2188 VanDerWaalsContact CD-OD2 3.31Å; K2143-D2188 WeakPolarHBondContact CD-OD2 3.15Å; K2143-D2188 WeakPolarHBondContact CE-OD2 3.11Å; K2143-D2188 IonicContact NZ-OD1 3.52Å; K2143-D2188 PolarHBondContact NZ-OD1 3.33Å; K2143-D2188 IonicContact NZ-OD2 3.83Å; K2143-D2188 PolarHBondContact NZ-OD2 3.16Å
2144	K	48.6	Very low	63	Low	201.4 Å²	201.4	94.9 Å²	94.9	88%	0.876	48%	0.476	S	S	*	.	S	Bend	trans	-73.1	-14.4	-174.7	-82.6	-176	172.8	179.8	0	114.7	N2142	N2142-K2144 PolarHBondContact O-N 3.41Å
2145	E	45.2	Very low	64.6	Low	184 Å²	184	95.2 Å²	95.2	86%	0.86	47%	0.466	S	S	*	.	S	Bend	trans	-139.7	39.9	-172.4	-68.8	-171.4	161.4	0	0	116.4	K2143 K2147	K2143-E2145 VanDerWaalsContact C-N 3.34Å; K2143-E2145 PolarHBondContact O-N 3.04Å; K2143-E2145 VanDerWaalsContact O-N 3.13Å; E2145-K2147 PolarHBondContact O-N 3.08Å
2146	M	47.3	Very low	66.2	Low	144.4 Å²	144.4	91.2 Å²	91.2	71%	0.711	44%	0.441	S	S	*	.			trans	-115.9	129.9	177.8	-72.2	-143.1	-179.9	0	0	113.9	Q2148	M2146-Q2148 VanDerWaalsContact C-N 3.26Å; M2146-Q2148 PolarHBondContact O-N 3.07Å
2147	K	51.5	Low	67.3	Low	223 Å²	223	87 Å²	87	97%	0.97	43%	0.427	S	S	*	.	S	Bend	trans	-87	-9.8	170.2	-83.5	176.8	179.1	177.7	0	114.9	E2145	E2145-K2147 PolarHBondContact O-N 3.08Å
2148	Q	57.5	Low	68.2	Low	154.6 Å²	154.6	85.2 Å²	85.2	72%	0.722	42%	0.417	S	S	*	.	S	Bend	trans	-103.2	143	-173.8	-123.4	169	-6.6	0	0	111.4	M2146 I2150	M2146-Q2148 VanDerWaalsContact C-N 3.26Å; M2146-Q2148 PolarHBondContact O-N 3.07Å; Q2148-I2150 PolarHBondContact O-N 2.94Å
2149	T	62.7	Low	68.6	Low	76.2 Å²	76.2	85.1 Å²	85.1	47%	0.467	42%	0.416	S	S	.	.			trans	-69.5	114.4	175.3	47.1	0	0	0	0	109.8	L2151 N2169 N2635	T2149-L2151 PolarHBondContact O-N 3.12Å; T2149-N2169 PolarHBondContact O-ND2 3.27Å; T2149-N2635 HydrophobicContact CG2-CB 4.23Å; T2149-N2635 VanDerWaalsContact CG2-O 3.25Å; T2149-N2635 WeakPolarHBondContact CG2-O 3.38Å
2150	I	69.6	Low	69	Low	54.2 Å²	54.2	87 Å²	87	28%	0.278	43%	0.43	S	S	.	.			trans	-80.5	124.8	176.4	-57.8	171.6	0	0	0	108.1	Q2148 W2168 N2169	Q2148-I2150 PolarHBondContact O-N 2.94Å; I2150-W2168 HydrophobicContact CG2-CB 4.46Å; I2150-W2168 HydrophobicContact CG2-CD2 4.22Å; I2150-W2168 HydrophobicContact CG2-CE3 3.66Å; I2150-W2168 HydrophobicContact CG2-CZ3 4.27Å; I2150-N2169 WeakPolarHBondContact CA-OD1 3.34Å
2151	L	77	Confident	69.6	Low	55.8 Å²	55.8	82.5 Å²	82.5	29%	0.292	41%	0.41	S	S	.	.			trans	-124.6	136.7	-177	-58.9	177.4	0	0	0	109.6	T2149 W2168 N2169 Q2637	T2149-L2151 PolarHBondContact O-N 3.12Å; L2151-W2168 WeakPolarHBondContact O-CA 3.26Å; L2151-N2169 HydrophobicContact CB-CB 4.27Å; L2151-N2169 VanDerWaalsContact N-CG 3.33Å; L2151-N2169 PolarHBondContact N-ND2 3.08Å; L2151-N2169 PolarHBondContact N-OD1 3Å; L2151-N2169 PolarHBondContact O-N 3.1Å; L2151-N2169 PolarHBondContact O-OD1 3.07Å; L2151-Q2637 HydrophobicContact CD2-CB 3.44Å; L2151-Q2637 VanDerWaalsContact CD2-CB 3.44Å; L2151-Q2637 HydrophobicContact CD2-CG 3.48Å; L2151-Q2637 VanDerWaalsContact CD2-CG 3.44Å
2152	A	81.1	Confident	70.4	Confident	25.4 Å²	25.4	85.6 Å²	85.6	21%	0.21	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	128.8	167.1	0	0	0	0	0	108.8	I2166 G2167 W2168 T2629 F2639	A2152-I2166 HydrophobicContact CB-CG2 3.84Å; A2152-G2167 WeakPolarHBondContact CA-O 3.19Å; A2152-W2168 HydrophobicContact CB-CE3 4.05Å; A2152-W2168 HydrophobicContact CB-CH2 4.34Å; A2152-W2168 HydrophobicContact CB-CZ3 3.86Å; A2152-T2629 HydrophobicContact CB-CG2 4.02Å; A2152-F2639 HydrophobicContact CB-CB 3.74Å; A2152-F2639 HydrophobicContact CB-CD2 3.61Å; A2152-F2639 HydrophobicContact CB-CE2 4.38Å; A2152-F2639 HydrophobicContact CB-CG 3.72Å
2153	T	84.1	Confident	71.8	Confident	42.6 Å²	42.6	79.1 Å²	79.1	26%	0.261	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	-26.2	-173.2	50.2	0	0	0	0	112.7	G2167 N2169 S2199 V2200 L2481	T2153-G2167 PolarHBondContact N-O 3.09Å; T2153-G2167 PolarHBondContact OG1-O 3.02Å; T2153-G2167 VanDerWaalsContact OG1-O 3.14Å; T2153-N2169 HydrophobicContact CG2-CB 3.75Å; T2153-S2199 WeakPolarHBondContact CG2-OG 3.36Å; T2153-V2200 VanDerWaalsContact CB-O 3.24Å; T2153-V2200 WeakPolarHBondContact CB-O 3.36Å; T2153-V2200 PolarHBondContact OG1-O 2.94Å; T2153-L2481 WeakPolarHBondContact O-CD1 3.34Å
2154	T	86.5	Confident	73.5	Confident	18.6 Å²	18.6	73.7 Å²	73.7	11%	0.114	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.4	162.3	176.7	-168	0	0	0	0	109.8	G2167 V2200 Q2201 I2203	T2154-G2167 PolarHBondContact O-N 3.23Å; T2154-V2200 HydrophobicContact CG2-CB 4.46Å; T2154-V2200 HydrophobicContact CG2-CG1 4.02Å; T2154-Q2201 WeakPolarHBondContact CB-O 3.14Å; T2154-I2203 HydrophobicContact CG2-CB 4.03Å; T2154-I2203 HydrophobicContact CG2-CD1 3.93Å; T2154-I2203 HydrophobicContact CG2-CG1 3.64Å
2155	Y	90.2	Very high	75.5	Confident	41 Å²	41	64.2 Å²	64.2	16%	0.161	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	161	171	67.2	-93.7	0	0	0	111.6	I2164 I2165 L2481 K2483 L2625 G2627 F2639	Y2155-I2164 HydrophobicContact CD2-CD1 3.81Å; Y2155-I2164 HydrophobicContact CD2-CG1 4.2Å; Y2155-I2164 HydrophobicContact CE2-CD1 4.31Å; Y2155-I2164 HydrophobicContact CG-CD1 4.15Å; Y2155-I2164 HydrophobicContact CG-CG1 4.42Å; Y2155-I2165 CarbonylContact C-O 3.53Å; Y2155-I2165 WeakPolarHBondContact CA-O 3.36Å; Y2155-I2165 VanDerWaalsContact CB-O 3.3Å; Y2155-I2165 WeakPolarHBondContact CB-O 3.43Å; Y2155-L2481 HydrophobicContact CD1-CD2 3.57Å; Y2155-L2481 HydrophobicContact CE1-CD2 3.65Å; Y2155-K2483 HydrophobicContact CE1-CB 3.75Å; Y2155-K2483 HydrophobicContact CE1-CD 4.49Å; Y2155-K2483 HydrophobicContact CE1-CG 4.49Å; Y2155-K2483 HydrophobicContact CE2-CB 4.37Å; Y2155-K2483 HydrophobicContact CE2-CD 4.44Å; Y2155-K2483 HydrophobicContact CE2-CG 4.47Å; Y2155-K2483 WeakPolarHBondContact O-CD 3.22Å; Y2155-K2483 WeakPolarHBondContact O-CE 3.32Å; Y2155-K2483 PolarHBondContact O-NZ 3.17Å; Y2155-K2483 VanDerWaalsContact OH-C 3.24Å; Y2155-K2483 PolarHBondContact OH-O 3.03Å; Y2155-L2625 HydrophobicContact CD2-CD2 4.29Å; Y2155-L2625 HydrophobicContact CE2-CD2 3.52Å; Y2155-L2625 VanDerWaalsContact CE2-CD2 3.44Å; Y2155-G2627 PolarHBondContact OH-N 3.12Å; Y2155-F2639 AromaticContact CD1-CE2 3.87Å; Y2155-F2639 HydrophobicContact CD1-CE2 3.87Å; Y2155-F2639 AromaticContact CD1-CZ 3.7Å; Y2155-F2639 HydrophobicContact CD1-CZ 3.7Å; Y2155-F2639 HydrophobicContact CE1-CE2 4.13Å; Y2155-F2639 HydrophobicContact CE1-CZ 4.06Å; Y2155-F2639 HydrophobicContact CG-CZ 4.29Å
2156	A	88.5	Confident	77.6	Confident	4.2 Å²	4.2	55.7 Å²	55.7	4%	0.035	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	149.4	170.4	0	0	0	0	0	110.3	I2165 I2203 C2205	A2156-I2165 PolarHBondContact N-O 3.18Å; A2156-I2165 PolarHBondContact O-N 3.12Å; A2156-I2203 HydrophobicContact CB-CB 4.45Å; A2156-I2203 HydrophobicContact CB-CG2 3.87Å; A2156-C2205 HydrophobicContact CB-CB 4.19Å
2157	I	86.5	Confident	79.5	Confident	24.8 Å²	24.8	48.9 Å²	48.9	13%	0.127	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	142.6	173.1	-54.7	173.1	0	0	0	108.6	H2163 I2164 I2178 C2205 Q2485 F2487 L2625	I2157-H2163 WeakPolarHBondContact CA-O 3.39Å; I2157-H2163 WeakPolarHBondContact CG2-O 3.24Å; I2157-I2164 HydrophobicContact CG1-CB 4.41Å; I2157-I2164 HydrophobicContact CG1-CD1 4.32Å; I2157-I2164 HydrophobicContact CG1-CG1 4.23Å; I2157-I2178 HydrophobicContact CG2-CD1 3.88Å; I2157-C2205 WeakPolarHBondContact O-CB 3.27Å; I2157-Q2485 HydrophobicContact CB-CG 4.41Å; I2157-Q2485 HydrophobicContact CD1-CB 3.69Å; I2157-Q2485 HydrophobicContact CD1-CG 3.85Å; I2157-Q2485 HydrophobicContact CG1-CB 4.26Å; I2157-Q2485 HydrophobicContact CG1-CG 4.23Å; I2157-Q2485 PolarHBondContact O-NE2 3.28Å; I2157-F2487 HydrophobicContact CD1-CD1 3.94Å; I2157-F2487 HydrophobicContact CD1-CE1 4.33Å; I2157-L2625 HydrophobicContact CD1-CB 3.6Å; I2157-L2625 HydrophobicContact CD1-CD1 4.01Å; I2157-L2625 HydrophobicContact CD1-CD2 4.25Å; I2157-L2625 HydrophobicContact CD1-CG 4.16Å; I2157-L2625 HydrophobicContact CG1-CD1 4.41Å; I2157-L2625 HydrophobicContact CG1-CD2 4.49Å
2158	D	83.1	Confident	81.2	Confident	6.6 Å²	6.6	38.9 Å²	38.9	4%	0.035	21%	0.208	C	C	.	.			trans	-66.7	160.3	171.9	107.1	-6.3	0	0	0	112	S2160 G2161 K2162 H2163 N2215 F2233	D2158-S2160 VanDerWaalsContact CG-OG 3.24Å; D2158-S2160 PolarHBondContact O-N 2.96Å; D2158-S2160 VanDerWaalsContact O-N 3.08Å; D2158-S2160 VanDerWaalsContact OD1-CA 3.24Å; D2158-S2160 WeakPolarHBondContact OD1-CA 3.5Å; D2158-S2160 VanDerWaalsContact OD1-CB 3.31Å; D2158-S2160 WeakPolarHBondContact OD1-CB 3.45Å; D2158-S2160 PolarHBondContact OD1-N 2.95Å; D2158-S2160 PolarHBondContact OD1-OG 3.31Å; D2158-S2160 PolarHBondContact OD2-OG 3.14Å; D2158-G2161 PolarHBondContact O-N 3.08Å; D2158-G2161 VanDerWaalsContact O-N 3.14Å; D2158-G2161 WeakPolarHBondContact OD1-CA 3.27Å; D2158-G2161 PolarHBondContact OD1-N 2.98Å; D2158-K2162 PolarHBondContact OD1-N 3.12Å; D2158-H2163 HydrophobicContact CB-CB 4.2Å; D2158-H2163 WeakPolarHBondContact CB-O 3.29Å; D2158-H2163 PolarHBondContact N-O 3.11Å; D2158-H2163 PolarHBondContact OD1-N 3.06Å; D2158-H2163 VanDerWaalsContact OD1-O 3.12Å; D2158-H2163 WeakPolarHBondContact OD2-CB 3.48Å; D2158-H2163 IonicContact OD2-CE1 3.59Å; D2158-H2163 IonicContact OD2-CG 3.25Å; D2158-H2163 PolarHBondContact OD2-N 2.92Å; D2158-H2163 VanDerWaalsContact OD2-N 3.08Å; D2158-H2163 IonicContact OD2-ND1 3.21Å; D2158-H2163 PolarHBondContact OD2-ND1 2.93Å; D2158-N2215 PolarHBondContact OD1-ND2 3.12Å; D2158-N2215 PolarHBondContact OD1-OD1 3.35Å; D2158-F2233 HydrophobicContact CB-CE2 4.45Å; D2158-F2233 VanDerWaalsContact OD2-CE2 3.22Å; D2158-F2233 WeakPolarHBondContact OD2-CE2 3.24Å
2159	I	78.6	Confident	82.5	Confident	90.8 Å²	90.8	33.6 Å²	33.6	47%	0.466	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-31.2	-178.5	-82	125	0	0	0	112.2	G2161 G2206 I2207 N2215	I2159-G2161 VanDerWaalsContact C-N 3.32Å; I2159-G2161 PolarHBondContact O-N 3.05Å; I2159-G2206 WeakPolarHBondContact CD1-O 3.41Å; I2159-I2207 VanDerWaalsContact CD1-CA 3.42Å; I2159-I2207 HydrophobicContact CD1-CB 4.01Å; I2159-I2207 HydrophobicContact CD1-CG1 3.71Å; I2159-I2207 VanDerWaalsContact CD1-CG1 3.45Å; I2159-I2207 VanDerWaalsContact CD1-N 3.32Å; I2159-I2207 HydrophobicContact CG1-CD1 4.39Å; I2159-I2207 HydrophobicContact CG1-CG1 4.22Å; I2159-I2207 HydrophobicContact CG2-CG1 4.43Å; I2159-N2215 WeakPolarHBondContact CB-OD1 3.02Å; I2159-N2215 HydrophobicContact CD1-CB 4.35Å; I2159-N2215 VanDerWaalsContact CD1-OD1 3.25Å; I2159-N2215 WeakPolarHBondContact CD1-OD1 3.28Å; I2159-N2215 VanDerWaalsContact CG1-OD1 3.26Å; I2159-N2215 WeakPolarHBondContact CG1-OD1 3.31Å; I2159-N2215 PolarHBondContact N-OD1 3.28Å; I2159-N2215 VanDerWaalsContact N-OD1 3.16Å
2160	S	75.9	Confident	83.3	Confident	56.2 Å²	56.2	31.7 Å²	31.7	39%	0.393	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-12.2	179.2	81.2	0	0	0	0	113.7	D2158 K2162	D2158-S2160 VanDerWaalsContact CG-OG 3.24Å; D2158-S2160 PolarHBondContact O-N 2.96Å; D2158-S2160 VanDerWaalsContact O-N 3.08Å; D2158-S2160 VanDerWaalsContact OD1-CA 3.24Å; D2158-S2160 WeakPolarHBondContact OD1-CA 3.5Å; D2158-S2160 VanDerWaalsContact OD1-CB 3.31Å; D2158-S2160 WeakPolarHBondContact OD1-CB 3.45Å; D2158-S2160 PolarHBondContact OD1-N 2.95Å; D2158-S2160 PolarHBondContact OD1-OG 3.31Å; D2158-S2160 PolarHBondContact OD2-OG 3.14Å; S2160-K2162 PolarHBondContact O-N 3.16Å; S2160-K2162 VanDerWaalsContact O-N 3.16Å; S2160-K2162 WeakPolarHBondContact OG-CB 3.32Å; S2160-K2162 WeakPolarHBondContact OG-CG 3.23Å; S2160-K2162 PolarHBondContact OG-N 3.04Å
2161	G	78.1	Confident	83.9	Confident	13.6 Å²	13.6	29.4 Å²	29.4	14%	0.14	16%	0.162	C	C	.	.	S	Bend	trans	68.2	12.6	-176	0	0	0	0	0	114.2	D2158 I2159 I2178	D2158-G2161 PolarHBondContact O-N 3.08Å; D2158-G2161 VanDerWaalsContact O-N 3.14Å; D2158-G2161 WeakPolarHBondContact OD1-CA 3.27Å; D2158-G2161 PolarHBondContact OD1-N 2.98Å; I2159-G2161 VanDerWaalsContact C-N 3.32Å; I2159-G2161 PolarHBondContact O-N 3.05Å; G2161-I2178 WeakPolarHBondContact O-CD1 3.27Å
2162	K	79.6	Confident	84.3	Confident	106.8 Å²	106.8	28.8 Å²	28.8	46%	0.464	16%	0.158	S	C	.	.	S	Bend	trans	-96.3	-28.7	-178.1	-64.7	177.7	-177.6	175.4	0	112.7	D2158 S2160 L2177 I2178	D2158-K2162 PolarHBondContact OD1-N 3.12Å; S2160-K2162 PolarHBondContact O-N 3.16Å; S2160-K2162 VanDerWaalsContact O-N 3.16Å; S2160-K2162 WeakPolarHBondContact OG-CB 3.32Å; S2160-K2162 WeakPolarHBondContact OG-CG 3.23Å; S2160-K2162 PolarHBondContact OG-N 3.04Å; K2162-L2177 HydrophobicContact CB-CD1 4.5Å; K2162-L2177 WeakPolarHBondContact O-CD1 3.24Å; K2162-I2178 WeakPolarHBondContact O-CB 3.33Å; K2162-I2178 WeakPolarHBondContact O-CG1 3.39Å; K2162-I2178 PolarHBondContact O-N 3Å
2163	H	84.7	Confident	84.6	Confident	10.4 Å²	10.4	27.7 Å²	27.7	5%	0.048	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	141.7	-172.2	-48.9	100.6	0	0	0	112.2	I2157 D2158 I2175 V2176 I2184 F2233	I2157-H2163 WeakPolarHBondContact CA-O 3.39Å; I2157-H2163 WeakPolarHBondContact CG2-O 3.24Å; D2158-H2163 HydrophobicContact CB-CB 4.2Å; D2158-H2163 WeakPolarHBondContact CB-O 3.29Å; D2158-H2163 PolarHBondContact N-O 3.11Å; D2158-H2163 PolarHBondContact OD1-N 3.06Å; D2158-H2163 VanDerWaalsContact OD1-O 3.12Å; D2158-H2163 WeakPolarHBondContact OD2-CB 3.48Å; D2158-H2163 IonicContact OD2-CE1 3.59Å; D2158-H2163 IonicContact OD2-CG 3.25Å; D2158-H2163 PolarHBondContact OD2-N 2.92Å; D2158-H2163 VanDerWaalsContact OD2-N 3.08Å; D2158-H2163 IonicContact OD2-ND1 3.21Å; D2158-H2163 PolarHBondContact OD2-ND1 2.93Å; H2163-I2175 HydrophobicContact CB-CG2 3.97Å; H2163-V2176 CarbonylContact C-O 3.47Å; H2163-V2176 VanDerWaalsContact CA-O 3.31Å; H2163-V2176 WeakPolarHBondContact CA-O 3.37Å; H2163-I2184 WeakPolarHBondContact CD2-CD1 3.15Å; H2163-F2233 HydrophobicContact CB-CE1 4.47Å; H2163-F2233 HydrophobicContact CB-CZ 4.12Å; H2163-F2233 AromaticContact CD2-CZ 3.88Å; H2163-F2233 AromaticContact CE1-CD1 3.66Å; H2163-F2233 AromaticContact CE1-CD2 3.89Å; H2163-F2233 AromaticContact CE1-CE1 3.92Å; H2163-F2233 AromaticContact CE1-CE2 3.5Å; H2163-F2233 AromaticContact CE1-CG 3.65Å; H2163-F2233 AromaticContact CE1-CZ 3.51Å; H2163-F2233 AromaticContact CG-CE1 3.88Å; H2163-F2233 AromaticContact CG-CZ 3.72Å; H2163-F2233 AromaticContact ND1-CD1 3.92Å; H2163-F2233 AromaticContact ND1-CD2 3.75Å; H2163-F2233 AromaticContact ND1-CE1 3.82Å; H2163-F2233 AromaticContact ND1-CE2 3.53Å; H2163-F2233 WeakPolarHBondContact ND1-CE2 3.17Å; H2163-F2233 AromaticContact ND1-CG 3.92Å; H2163-F2233 AromaticContact ND1-CZ 3.55Å; H2163-F2233 WeakPolarHBondContact ND1-CZ 3.37Å; H2163-F2233 AromaticContact NE2-CD1 3.92Å; H2163-F2233 AromaticContact NE2-CE1 3.84Å; H2163-F2233 AromaticContact NE2-CZ 3.83Å
2164	I	87.9	Confident	84.8	Confident	12.2 Å²	12.2	25.8 Å²	25.8	6%	0.063	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	131.2	171	-170.8	174.9	0	0	0	109.8	Y2155 I2157 I2166 I2175 V2176 I2178 L2625 F2639 F2641	Y2155-I2164 HydrophobicContact CD2-CD1 3.81Å; Y2155-I2164 HydrophobicContact CD2-CG1 4.2Å; Y2155-I2164 HydrophobicContact CE2-CD1 4.31Å; Y2155-I2164 HydrophobicContact CG-CD1 4.15Å; Y2155-I2164 HydrophobicContact CG-CG1 4.42Å; I2157-I2164 HydrophobicContact CG1-CB 4.41Å; I2157-I2164 HydrophobicContact CG1-CD1 4.32Å; I2157-I2164 HydrophobicContact CG1-CG1 4.23Å; I2164-I2166 HydrophobicContact CD1-CG1 4.35Å; I2164-I2166 HydrophobicContact CG1-CG1 4.18Å; I2164-I2166 HydrophobicContact CG2-CD1 4.41Å; I2164-I2166 HydrophobicContact CG2-CG1 4.43Å; I2164-I2175 WeakPolarHBondContact O-CA 3.35Å; I2164-V2176 HydrophobicContact CG2-CB 3.71Å; I2164-V2176 HydrophobicContact CG2-CG1 4.36Å; I2164-V2176 PolarHBondContact N-O 3.03Å; I2164-V2176 PolarHBondContact O-N 3.1Å; I2164-I2178 HydrophobicContact CB-CD1 4.31Å; I2164-I2178 HydrophobicContact CB-CG1 4.09Å; I2164-I2178 HydrophobicContact CG2-CG1 4.21Å; I2164-L2625 HydrophobicContact CD1-CD1 4.32Å; I2164-L2625 HydrophobicContact CD1-CD2 3.8Å; I2164-F2639 HydrophobicContact CD1-CE1 4.42Å; I2164-F2639 HydrophobicContact CD1-CZ 4.41Å; I2164-F2641 HydrophobicContact CD1-CD1 4.42Å; I2164-F2641 HydrophobicContact CD1-CG 4.38Å; I2164-F2641 HydrophobicContact CG2-CE1 4.18Å; I2164-F2641 HydrophobicContact CG2-CZ 4.26Å
2165	I	89.4	Confident	84.8	Confident	2.2 Å²	2.2	25 Å²	25	1%	0.011	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	118.9	174.8	-54.6	168.5	0	0	0	107.5	Y2155 A2156 F2173 T2174 I2175 I2203 C2205 V2217 F2231	Y2155-I2165 CarbonylContact C-O 3.53Å; Y2155-I2165 WeakPolarHBondContact CA-O 3.36Å; Y2155-I2165 VanDerWaalsContact CB-O 3.3Å; Y2155-I2165 WeakPolarHBondContact CB-O 3.43Å; A2156-I2165 PolarHBondContact N-O 3.18Å; A2156-I2165 PolarHBondContact O-N 3.12Å; I2165-F2173 HydrophobicContact CG2-CB 4.47Å; I2165-F2173 HydrophobicContact CG2-CD2 4.13Å; I2165-T2174 CarbonylContact C-O 3.58Å; I2165-T2174 WeakPolarHBondContact CA-O 3.37Å; I2165-I2175 HydrophobicContact CG1-CG1 4.17Å; I2165-I2175 HydrophobicContact CG1-CG2 4.46Å; I2165-I2175 HydrophobicContact CG2-CG1 4.42Å; I2165-I2203 HydrophobicContact CB-CG2 4.42Å; I2165-I2203 HydrophobicContact CG2-CD1 4.13Å; I2165-I2203 HydrophobicContact CG2-CG2 4.11Å; I2165-C2205 VanDerWaalsContact CD1-SG 3.55Å; I2165-C2205 WeakPolarHBondContact CD1-SG 3.4Å; I2165-V2217 HydrophobicContact CD1-CG1 4.31Å; I2165-V2217 HydrophobicContact CD1-CG2 3.9Å; I2165-F2231 HydrophobicContact CD1-CD2 3.83Å; I2165-F2231 HydrophobicContact CD1-CE2 3.65Å; I2165-F2231 HydrophobicContact CG1-CE2 4.21Å
2166	I	88.8	Confident	84.6	Confident	7 Å²	7	23 Å²	23	4%	0.036	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	126.5	-177.1	-56.4	167.9	0	0	0	108.4	V2139 A2152 I2164 W2168 F2173 T2174 V2176 F2639	V2139-I2166 HydrophobicContact CB-CD1 4.34Å; V2139-I2166 HydrophobicContact CG1-CD1 4.27Å; V2139-I2166 HydrophobicContact CG2-CD1 3.96Å; A2152-I2166 HydrophobicContact CB-CG2 3.84Å; I2164-I2166 HydrophobicContact CD1-CG1 4.35Å; I2164-I2166 HydrophobicContact CG1-CG1 4.18Å; I2164-I2166 HydrophobicContact CG2-CD1 4.41Å; I2164-I2166 HydrophobicContact CG2-CG1 4.43Å; I2166-W2168 HydrophobicContact CB-CZ2 4.28Å; I2166-W2168 HydrophobicContact CD1-CZ2 4.47Å; I2166-W2168 HydrophobicContact CG2-CD2 4.23Å; I2166-W2168 HydrophobicContact CG2-CE3 4.47Å; I2166-W2168 HydrophobicContact CG2-CH2 4.15Å; I2166-W2168 HydrophobicContact CG2-CZ2 3.74Å; I2166-W2168 HydrophobicContact CG2-CZ3 4.44Å; I2166-W2168 PolarHBondContact O-NE1 2.99Å; I2166-F2173 CarbonylContact O-C 3.43Å; I2166-F2173 WeakPolarHBondContact O-CA 3.43Å; I2166-F2173 VanDerWaalsContact O-CB 3.31Å; I2166-F2173 WeakPolarHBondContact O-CB 3.28Å; I2166-T2174 PolarHBondContact N-O 3.09Å; I2166-T2174 PolarHBondContact O-N 3.03Å; I2166-V2176 HydrophobicContact CD1-CG2 4.12Å; I2166-F2639 HydrophobicContact CD1-CD1 3.77Å; I2166-F2639 HydrophobicContact CD1-CE1 3.54Å; I2166-F2639 HydrophobicContact CG1-CD1 4.49Å; I2166-F2639 HydrophobicContact CG1-CE1 4Å
2167	G	88.2	Confident	84.3	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	139.8	171.6	0	0	0	0	0	111	A2152 T2153 T2154	A2152-G2167 WeakPolarHBondContact CA-O 3.19Å; T2153-G2167 PolarHBondContact N-O 3.09Å; T2153-G2167 PolarHBondContact OG1-O 3.02Å; T2153-G2167 VanDerWaalsContact OG1-O 3.14Å; T2154-G2167 PolarHBondContact O-N 3.23Å
2168	W	87.2	Confident	84	Confident	13.2 Å²	13.2	24.5 Å²	24.5	5%	0.05	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	157.9	-175.6	-57	98.7	0	0	0	111.6	V2139 R2141 I2150 L2151 A2152 I2166 D2170 G2171 L2172 T2174 V2200 F2639	V2139-W2168 HydrophobicContact CG1-CH2 4.43Å; V2139-W2168 HydrophobicContact CG1-CZ2 4.22Å; R2141-W2168 HydrophobicContact CG-CZ2 4.39Å; I2150-W2168 HydrophobicContact CG2-CB 4.46Å; I2150-W2168 HydrophobicContact CG2-CD2 4.22Å; I2150-W2168 HydrophobicContact CG2-CE3 3.66Å; I2150-W2168 HydrophobicContact CG2-CZ3 4.27Å; L2151-W2168 WeakPolarHBondContact O-CA 3.26Å; A2152-W2168 HydrophobicContact CB-CE3 4.05Å; A2152-W2168 HydrophobicContact CB-CH2 4.34Å; A2152-W2168 HydrophobicContact CB-CZ3 3.86Å; I2166-W2168 HydrophobicContact CB-CZ2 4.28Å; I2166-W2168 HydrophobicContact CD1-CZ2 4.47Å; I2166-W2168 HydrophobicContact CG2-CD2 4.23Å; I2166-W2168 HydrophobicContact CG2-CE3 4.47Å; I2166-W2168 HydrophobicContact CG2-CH2 4.15Å; I2166-W2168 HydrophobicContact CG2-CZ2 3.74Å; I2166-W2168 HydrophobicContact CG2-CZ3 4.44Å; I2166-W2168 PolarHBondContact O-NE1 2.99Å; W2168-D2170 VanDerWaalsContact CB-OD1 3.28Å; W2168-D2170 WeakPolarHBondContact CB-OD1 3.35Å; W2168-D2170 PolarHBondContact O-N 3.35Å; W2168-G2171 PolarHBondContact O-N 2.99Å; W2168-L2172 WeakPolarHBondContact CB-O 3.38Å; W2168-L2172 PolarHBondContact N-O 3.09Å; W2168-T2174 WeakPolarHBondContact CZ2-OG1 3.43Å; W2168-T2174 VanDerWaalsContact NE1-CG2 3.35Å; W2168-T2174 PolarHBondContact NE1-OG1 3.04Å; W2168-V2200 PolarHBondContact O-N 3.07Å; W2168-V2200 VanDerWaalsContact O-N 3.13Å; W2168-F2639 HydrophobicContact CH2-CB 4.27Å; W2168-F2639 HydrophobicContact CZ3-CB 4.39Å
2169	N	84.9	Confident	83.4	Confident	43.6 Å²	43.6	28.9 Å²	28.9	23%	0.233	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-15.1	177.9	68.3	-23.9	0	0	0	114.6	T2149 I2150 L2151 T2153 G2171 S2199	T2149-N2169 PolarHBondContact O-ND2 3.27Å; I2150-N2169 WeakPolarHBondContact CA-OD1 3.34Å; L2151-N2169 HydrophobicContact CB-CB 4.27Å; L2151-N2169 VanDerWaalsContact N-CG 3.33Å; L2151-N2169 PolarHBondContact N-ND2 3.08Å; L2151-N2169 PolarHBondContact N-OD1 3Å; L2151-N2169 PolarHBondContact O-N 3.1Å; L2151-N2169 PolarHBondContact O-OD1 3.07Å; T2153-N2169 HydrophobicContact CG2-CB 3.75Å; N2169-G2171 VanDerWaalsContact C-N 3.27Å; N2169-G2171 PolarHBondContact O-N 2.88Å; N2169-S2199 WeakPolarHBondContact CA-OG 3.34Å; N2169-S2199 VanDerWaalsContact O-CA 3.24Å; N2169-S2199 WeakPolarHBondContact O-CA 3.32Å; N2169-S2199 WeakPolarHBondContact O-CB 3.34Å; N2169-S2199 PolarHBondContact O-N 2.77Å
2170	D	80	Confident	83	Confident	37.4 Å²	37.4	28.7 Å²	28.7	20%	0.2	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84	1	175.5	64.5	3.4	0	0	0	113.6	R2141 W2168 L2172	R2141-D2170 IonicContact CZ-OD2 2.82Å; R2141-D2170 VanDerWaalsContact NH1-CG 3.3Å; R2141-D2170 IonicContact NH1-OD1 3.22Å; R2141-D2170 PolarHBondContact NH1-OD1 3.13Å; R2141-D2170 VanDerWaalsContact NH1-OD1 3.08Å; R2141-D2170 IonicContact NH1-OD2 2.9Å; R2141-D2170 PolarHBondContact NH1-OD2 3.03Å; R2141-D2170 IonicContact NH2-OD2 3.49Å; W2168-D2170 VanDerWaalsContact CB-OD1 3.28Å; W2168-D2170 WeakPolarHBondContact CB-OD1 3.35Å; W2168-D2170 PolarHBondContact O-N 3.35Å; D2170-L2172 VanDerWaalsContact OD1-CB 3.22Å; D2170-L2172 WeakPolarHBondContact OD1-CB 3.36Å; D2170-L2172 WeakPolarHBondContact OD1-CG 3.46Å; D2170-L2172 PolarHBondContact OD1-N 3.11Å; D2170-L2172 VanDerWaalsContact OD1-N 3.16Å
2171	G	80.6	Confident	82.9	Confident	6 Å²	6	26.7 Å²	26.7	6%	0.062	15%	0.147	C	C	.	.	S	Bend	trans	89.9	1.6	178.3	0	0	0	0	0	115.3	W2168 N2169 S2198 W2221	W2168-G2171 PolarHBondContact O-N 2.99Å; N2169-G2171 VanDerWaalsContact C-N 3.27Å; N2169-G2171 PolarHBondContact O-N 2.88Å; G2171-S2198 WeakPolarHBondContact CA-O 3.39Å; G2171-S2198 PolarHBondContact N-O 3.06Å; G2171-W2221 PolarHBondContact O-NE1 3.14Å; G2171-W2221 VanDerWaalsContact O-NE1 3.08Å
2172	L	86	Confident	82.7	Confident	41.6 Å²	41.6	31.5 Å²	31.5	22%	0.218	17%	0.166	C	C	.	.			trans	-98.2	165.3	178.8	-58.5	166.5	0	0	0	111.2	R2141 W2168 D2170 S2187 D2188 V2200	R2141-L2172 VanDerWaalsContact NH1-CD1 3.26Å; R2141-L2172 VanDerWaalsContact NH2-CB 3.31Å; W2168-L2172 WeakPolarHBondContact CB-O 3.38Å; W2168-L2172 PolarHBondContact N-O 3.09Å; D2170-L2172 VanDerWaalsContact OD1-CB 3.22Å; D2170-L2172 WeakPolarHBondContact OD1-CB 3.36Å; D2170-L2172 WeakPolarHBondContact OD1-CG 3.46Å; D2170-L2172 PolarHBondContact OD1-N 3.11Å; D2170-L2172 VanDerWaalsContact OD1-N 3.16Å; L2172-S2187 VanDerWaalsContact CA-OG 3.29Å; L2172-S2187 WeakPolarHBondContact CA-OG 3.32Å; L2172-S2187 VanDerWaalsContact CB-OG 3.3Å; L2172-S2187 WeakPolarHBondContact CB-OG 3.34Å; L2172-S2187 VanDerWaalsContact CD2-OG 3.27Å; L2172-S2187 WeakPolarHBondContact CD2-OG 3.37Å; L2172-D2188 WeakPolarHBondContact CD1-OD1 3.27Å; L2172-V2200 WeakPolarHBondContact O-CG2 3.4Å
2173	F	87.9	Confident	82.7	Confident	2.4 Å²	2.4	29.9 Å²	29.9	1%	0.011	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	153.7	170.2	66.4	-92.5	0	0	0	111.5	I2165 I2166 F2185 S2187 L2190 I2194 I2203 V2219 Y2229 F2231	I2165-F2173 HydrophobicContact CG2-CB 4.47Å; I2165-F2173 HydrophobicContact CG2-CD2 4.13Å; I2166-F2173 CarbonylContact O-C 3.43Å; I2166-F2173 WeakPolarHBondContact O-CA 3.43Å; I2166-F2173 VanDerWaalsContact O-CB 3.31Å; I2166-F2173 WeakPolarHBondContact O-CB 3.28Å; F2173-F2185 HydrophobicContact CE2-CD1 4.34Å; F2173-F2185 AromaticContact CE2-CE1 3.88Å; F2173-F2185 HydrophobicContact CE2-CE1 4.05Å; F2173-F2185 HydrophobicContact CZ-CE1 4.41Å; F2173-S2187 PolarHBondContact N-OG 2.93Å; F2173-S2187 WeakPolarHBondContact O-CB 3.35Å; F2173-S2187 PolarHBondContact O-N 3.02Å; F2173-S2187 PolarHBondContact O-OG 3.31Å; F2173-L2190 HydrophobicContact CZ-CD1 4.31Å; F2173-I2194 HydrophobicContact CE1-CD1 4.28Å; F2173-I2203 HydrophobicContact CB-CD1 4.3Å; F2173-V2219 HydrophobicContact CD1-CG2 4.39Å; F2173-V2219 HydrophobicContact CE1-CG2 4.44Å; F2173-Y2229 HydrophobicContact CE1-CE2 4.3Å; F2173-F2231 HydrophobicContact CD2-CZ 4.48Å; F2173-F2231 HydrophobicContact CE2-CE1 4.34Å; F2173-F2231 HydrophobicContact CE2-CE2 4.24Å; F2173-F2231 AromaticContact CE2-CZ 3.58Å; F2173-F2231 HydrophobicContact CE2-CZ 3.58Å; F2173-F2231 HydrophobicContact CZ-CE1 4.46Å; F2173-F2231 AromaticContact CZ-CZ 3.85Å; F2173-F2231 HydrophobicContact CZ-CZ 3.85Å
2174	T	87.7	Confident	82.6	Confident	3.2 Å²	3.2	31.7 Å²	31.7	2%	0.02	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	145.2	178.8	51.4	0	0	0	0	110.9	R2141 I2165 I2166 W2168 F2185 S2186	R2141-T2174 HydrophobicContact CG-CG2 4.45Å; I2165-T2174 CarbonylContact C-O 3.58Å; I2165-T2174 WeakPolarHBondContact CA-O 3.37Å; I2166-T2174 PolarHBondContact N-O 3.09Å; I2166-T2174 PolarHBondContact O-N 3.03Å; W2168-T2174 WeakPolarHBondContact CZ2-OG1 3.43Å; W2168-T2174 VanDerWaalsContact NE1-CG2 3.35Å; W2168-T2174 PolarHBondContact NE1-OG1 3.04Å; T2174-F2185 CarbonylContact C-O 3.54Å; T2174-F2185 VanDerWaalsContact CA-O 3.27Å; T2174-F2185 WeakPolarHBondContact CA-O 3.29Å; T2174-S2186 WeakPolarHBondContact CG2-OG 3.29Å
2175	I	87.8	Confident	82.3	Confident	1 Å²	1	32.4 Å²	32.4	1%	0.005	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	127.9	173.7	-50.2	-177.2	0	0	0	108.4	H2163 I2164 I2165 T2183 I2184 F2185 F2231 F2233 V2257 I2259	H2163-I2175 HydrophobicContact CB-CG2 3.97Å; I2164-I2175 WeakPolarHBondContact O-CA 3.35Å; I2165-I2175 HydrophobicContact CG1-CG1 4.17Å; I2165-I2175 HydrophobicContact CG1-CG2 4.46Å; I2165-I2175 HydrophobicContact CG2-CG1 4.42Å; I2175-T2183 CarbonylContact O-C 3.54Å; I2175-I2184 PolarHBondContact O-N 3.07Å; I2175-F2185 HydrophobicContact CB-CB 4.12Å; I2175-F2185 HydrophobicContact CD1-CB 4.22Å; I2175-F2185 HydrophobicContact CD1-CD1 4.15Å; I2175-F2185 HydrophobicContact CD1-CG 4.45Å; I2175-F2185 HydrophobicContact CG1-CB 4.24Å; I2175-F2185 HydrophobicContact CG1-CD1 4.26Å; I2175-F2185 PolarHBondContact N-O 3.26Å; I2175-F2185 PolarHBondContact O-N 3.03Å; I2175-F2231 HydrophobicContact CD1-CD1 3.43Å; I2175-F2231 VanDerWaalsContact CD1-CD1 3.43Å; I2175-F2231 HydrophobicContact CD1-CD2 4Å; I2175-F2231 HydrophobicContact CD1-CE1 3.41Å; I2175-F2231 VanDerWaalsContact CD1-CE1 3.41Å; I2175-F2231 HydrophobicContact CD1-CE2 3.82Å; I2175-F2231 HydrophobicContact CD1-CG 4.18Å; I2175-F2231 HydrophobicContact CD1-CZ 4.35Å; I2175-F2231 HydrophobicContact CG1-CE2 4.48Å; I2175-F2233 HydrophobicContact CG2-CE1 4.17Å; I2175-F2233 HydrophobicContact CG2-CZ 4.26Å; I2175-V2257 HydrophobicContact CD1-CG1 4.31Å; I2175-I2259 HydrophobicContact CD1-CD1 4.29Å
2176	V	86	Confident	82	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	140.8	-174.6	-177.6	0	0	0	0	109.6	I2137 V2139 H2163 I2164 I2166 G2181 E2182 T2183 F2641	I2137-V2176 HydrophobicContact CG2-CG1 4.15Å; V2139-V2176 HydrophobicContact CG1-CG2 3.84Å; V2139-V2176 HydrophobicContact CG2-CB 4.38Å; V2139-V2176 HydrophobicContact CG2-CG1 4.1Å; V2139-V2176 HydrophobicContact CG2-CG2 4.19Å; H2163-V2176 CarbonylContact C-O 3.47Å; H2163-V2176 VanDerWaalsContact CA-O 3.31Å; H2163-V2176 WeakPolarHBondContact CA-O 3.37Å; I2164-V2176 HydrophobicContact CG2-CB 3.71Å; I2164-V2176 HydrophobicContact CG2-CG1 4.36Å; I2164-V2176 PolarHBondContact N-O 3.03Å; I2164-V2176 PolarHBondContact O-N 3.1Å; I2166-V2176 HydrophobicContact CD1-CG2 4.12Å; V2176-G2181 VanDerWaalsContact CG1-C 3.45Å; V2176-G2181 VanDerWaalsContact CG1-O 3.28Å; V2176-G2181 WeakPolarHBondContact CG1-O 3.4Å; V2176-E2182 CarbonylContact C-O 3.53Å; V2176-E2182 VanDerWaalsContact CA-O 3.3Å; V2176-E2182 WeakPolarHBondContact CA-O 3.24Å; V2176-E2182 WeakPolarHBondContact CG1-O 3.1Å; V2176-T2183 HydrophobicContact CG2-CG2 4.02Å; V2176-F2641 HydrophobicContact CG1-CE1 4.27Å; V2176-F2641 HydrophobicContact CG1-CZ 4.39Å
2177	L	81.7	Confident	81.5	Confident	35.2 Å²	35.2	33.2 Å²	33.2	18%	0.184	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	127.5	172.6	-171.5	66.2	0	0	0	110	K2162 T2179 N2180 G2181 E2182 I2184	K2162-L2177 HydrophobicContact CB-CD1 4.5Å; K2162-L2177 WeakPolarHBondContact O-CD1 3.24Å; L2177-T2179 VanDerWaalsContact C-N 3.31Å; L2177-T2179 VanDerWaalsContact CD2-OG1 3.24Å; L2177-T2179 WeakPolarHBondContact CD2-OG1 3.33Å; L2177-T2179 WeakPolarHBondContact CG-OG1 3.27Å; L2177-T2179 PolarHBondContact O-N 3.12Å; L2177-N2180 WeakPolarHBondContact CB-OD1 3.23Å; L2177-N2180 WeakPolarHBondContact CD2-OD1 3.28Å; L2177-G2181 VanDerWaalsContact O-CA 3.27Å; L2177-G2181 WeakPolarHBondContact O-CA 3.44Å; L2177-G2181 PolarHBondContact O-N 3.08Å; L2177-E2182 PolarHBondContact N-O 3.06Å; L2177-I2184 HydrophobicContact CB-CD1 4.05Å; L2177-I2184 HydrophobicContact CB-CG1 4.28Å; L2177-I2184 HydrophobicContact CD1-CD1 4.28Å
2178	I	79.7	Confident	80.9	Confident	25.8 Å²	25.8	36.7 Å²	36.7	13%	0.132	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-31.3	-174.5	-69.5	170.9	0	0	0	112	I2137 I2157 G2161 K2162 I2164 L2625 F2641 V2643	I2137-I2178 HydrophobicContact CD1-CB 4.36Å; I2137-I2178 HydrophobicContact CD1-CG2 4.07Å; I2137-I2178 VanDerWaalsContact CD1-O 3.24Å; I2137-I2178 WeakPolarHBondContact CD1-O 3.29Å; I2137-I2178 WeakPolarHBondContact CG1-O 3.41Å; I2157-I2178 HydrophobicContact CG2-CD1 3.88Å; G2161-I2178 WeakPolarHBondContact O-CD1 3.27Å; K2162-I2178 WeakPolarHBondContact O-CB 3.33Å; K2162-I2178 WeakPolarHBondContact O-CG1 3.39Å; K2162-I2178 PolarHBondContact O-N 3Å; I2164-I2178 HydrophobicContact CB-CD1 4.31Å; I2164-I2178 HydrophobicContact CB-CG1 4.09Å; I2164-I2178 HydrophobicContact CG2-CG1 4.21Å; I2178-L2625 HydrophobicContact CD1-CD1 3.94Å; I2178-L2625 HydrophobicContact CG1-CD1 4.08Å; I2178-L2625 HydrophobicContact CG2-CD1 4.13Å; I2178-F2641 HydrophobicContact CG2-CE2 4.3Å; I2178-V2643 HydrophobicContact CG2-CG2 3.66Å
2179	T	70.5	Confident	79.7	Confident	98.2 Å²	98.2	44 Å²	44	60%	0.602	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-37.2	-173.2	53.6	0	0	0	0	113.9	P2135 L2177	P2135-T2179 WeakPolarHBondContact CG-O 3.43Å; L2177-T2179 VanDerWaalsContact C-N 3.31Å; L2177-T2179 VanDerWaalsContact CD2-OG1 3.24Å; L2177-T2179 WeakPolarHBondContact CD2-OG1 3.33Å; L2177-T2179 WeakPolarHBondContact CG-OG1 3.27Å; L2177-T2179 PolarHBondContact O-N 3.12Å
2180	N	70.4	Confident	78.8	Confident	86.6 Å²	86.6	44.1 Å²	44.1	46%	0.463	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.5	-8.9	-175.4	69.6	-4.7	0	0	0	114	L2177 E2182	L2177-N2180 WeakPolarHBondContact CB-OD1 3.23Å; L2177-N2180 WeakPolarHBondContact CD2-OD1 3.28Å; N2180-E2182 VanDerWaalsContact C-N 3.3Å; N2180-E2182 WeakPolarHBondContact ND2-CB 3.4Å; N2180-E2182 PolarHBondContact ND2-OE2 3.29Å; N2180-E2182 VanDerWaalsContact ND2-OE2 3.08Å; N2180-E2182 PolarHBondContact O-N 2.88Å; N2180-E2182 VanDerWaalsContact OD1-CB 3.23Å; N2180-E2182 WeakPolarHBondContact OD1-CB 3.36Å; N2180-E2182 PolarHBondContact OD1-N 3.07Å
2181	G	73	Confident	77.6	Confident	14.6 Å²	14.6	48.2 Å²	48.2	15%	0.151	26%	0.256	C	S	.	.			trans	77.4	12.1	-177.2	0	0	0	0	0	115.3	V2176 L2177	V2176-G2181 VanDerWaalsContact CG1-C 3.45Å; V2176-G2181 VanDerWaalsContact CG1-O 3.28Å; V2176-G2181 WeakPolarHBondContact CG1-O 3.4Å; L2177-G2181 VanDerWaalsContact O-CA 3.27Å; L2177-G2181 WeakPolarHBondContact O-CA 3.44Å; L2177-G2181 PolarHBondContact O-N 3.08Å
2182	E	75.6	Confident	76.2	Confident	114.2 Å²	114.2	52.6 Å²	52.6	53%	0.534	28%	0.283	S	S	.	.			trans	-74.6	130	-177.6	-171.2	176.7	-179.9	0	0	111.5	V2176 L2177 N2180 I2184	V2176-E2182 CarbonylContact C-O 3.53Å; V2176-E2182 VanDerWaalsContact CA-O 3.3Å; V2176-E2182 WeakPolarHBondContact CA-O 3.24Å; V2176-E2182 WeakPolarHBondContact CG1-O 3.1Å; L2177-E2182 PolarHBondContact N-O 3.06Å; N2180-E2182 VanDerWaalsContact C-N 3.3Å; N2180-E2182 WeakPolarHBondContact ND2-CB 3.4Å; N2180-E2182 PolarHBondContact ND2-OE2 3.29Å; N2180-E2182 VanDerWaalsContact ND2-OE2 3.08Å; N2180-E2182 PolarHBondContact O-N 2.88Å; N2180-E2182 VanDerWaalsContact OD1-CB 3.23Å; N2180-E2182 WeakPolarHBondContact OD1-CB 3.36Å; N2180-E2182 PolarHBondContact OD1-N 3.07Å; E2182-I2184 PolarHBondContact O-N 3.09Å; E2182-I2184 VanDerWaalsContact O-N 3.16Å
2183	T	79.4	Confident	74.6	Confident	74 Å²	74	56.3 Å²	56.3	45%	0.454	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	103.5	175.9	55.8	0	0	0	0	110	V2139 I2175 V2176	V2139-T2183 HydrophobicContact CG1-CG2 4.12Å; I2175-T2183 CarbonylContact O-C 3.54Å; V2176-T2183 HydrophobicContact CG2-CG2 4.02Å
2184	I	81.4	Confident	73	Confident	48.2 Å²	48.2	58 Å²	58	25%	0.247	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	-40.6	178.8	-50.1	175.6	0	0	0	110.4	H2163 I2175 L2177 E2182 F2233 V2257	H2163-I2184 WeakPolarHBondContact CD2-CD1 3.15Å; I2175-I2184 PolarHBondContact O-N 3.07Å; L2177-I2184 HydrophobicContact CB-CD1 4.05Å; L2177-I2184 HydrophobicContact CB-CG1 4.28Å; L2177-I2184 HydrophobicContact CD1-CD1 4.28Å; E2182-I2184 PolarHBondContact O-N 3.09Å; E2182-I2184 VanDerWaalsContact O-N 3.16Å; I2184-F2233 HydrophobicContact CD1-CE1 4.13Å; I2184-V2257 HydrophobicContact CB-CG2 4.43Å; I2184-V2257 HydrophobicContact CG2-CG2 3.37Å
2185	F	82.8	Confident	71.4	Confident	25.6 Å²	25.6	64.1 Å²	64.1	11%	0.112	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	144.8	-174.8	-178.5	-96	0	0	0	112.2	F2173 T2174 I2175 K2189 L2190 F2231 V2257 I2259	F2173-F2185 HydrophobicContact CE2-CD1 4.34Å; F2173-F2185 AromaticContact CE2-CE1 3.88Å; F2173-F2185 HydrophobicContact CE2-CE1 4.05Å; F2173-F2185 HydrophobicContact CZ-CE1 4.41Å; T2174-F2185 CarbonylContact C-O 3.54Å; T2174-F2185 VanDerWaalsContact CA-O 3.27Å; T2174-F2185 WeakPolarHBondContact CA-O 3.29Å; I2175-F2185 HydrophobicContact CB-CB 4.12Å; I2175-F2185 HydrophobicContact CD1-CB 4.22Å; I2175-F2185 HydrophobicContact CD1-CD1 4.15Å; I2175-F2185 HydrophobicContact CD1-CG 4.45Å; I2175-F2185 HydrophobicContact CG1-CB 4.24Å; I2175-F2185 HydrophobicContact CG1-CD1 4.26Å; I2175-F2185 PolarHBondContact N-O 3.26Å; I2175-F2185 PolarHBondContact O-N 3.03Å; F2185-K2189 HydrophobicContact CE2-CB 4.23Å; F2185-K2189 HydrophobicContact CE2-CD 4.35Å; F2185-K2189 HydrophobicContact CZ-CB 4.48Å; F2185-L2190 HydrophobicContact CE1-CD1 3.99Å; F2185-L2190 HydrophobicContact CZ-CD1 3.68Å; F2185-L2190 HydrophobicContact CZ-CG 3.88Å; F2185-F2231 HydrophobicContact CD1-CE1 4.46Å; F2185-V2257 HydrophobicContact CB-CG1 4.49Å; F2185-I2259 HydrophobicContact CD1-CD1 3.5Å; F2185-I2259 VanDerWaalsContact CD1-CD1 3.44Å; F2185-I2259 HydrophobicContact CD2-CD1 3.87Å; F2185-I2259 HydrophobicContact CE1-CD1 3.24Å; F2185-I2259 HydrophobicContact CE2-CD1 3.63Å; F2185-I2259 HydrophobicContact CG-CD1 3.82Å; F2185-I2259 HydrophobicContact CZ-CD1 3.31Å
2186	S	82	Confident	70.1	Confident	21.2 Å²	21.2	65.3 Å²	65.3	15%	0.148	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	136	168	-171.2	0	0	0	0	109	R2141 T2174 D2188 K2189	R2141-S2186 PolarHBondContact NH2-OG 3.04Å; R2141-S2186 VanDerWaalsContact NH2-OG 3.08Å; T2174-S2186 WeakPolarHBondContact CG2-OG 3.29Å; S2186-D2188 VanDerWaalsContact C-OD1 3.24Å; S2186-D2188 WeakPolarHBondContact CB-OD1 3.41Å; S2186-D2188 PolarHBondContact O-N 3.14Å; S2186-D2188 VanDerWaalsContact OG-CG 3.26Å; S2186-D2188 PolarHBondContact OG-OD1 3.06Å; S2186-D2188 PolarHBondContact OG-OD2 3.07Å; S2186-K2189 PolarHBondContact O-N 2.94Å
2187	S	79.5	Confident	69.4	Low	6.2 Å²	6.2	71.8 Å²	71.8	4%	0.043	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-67.5	-5.1	-178.8	65.6	0	0	0	0	113.9	L2172 F2173 K2189 L2190	L2172-S2187 VanDerWaalsContact CA-OG 3.29Å; L2172-S2187 WeakPolarHBondContact CA-OG 3.32Å; L2172-S2187 VanDerWaalsContact CB-OG 3.3Å; L2172-S2187 WeakPolarHBondContact CB-OG 3.34Å; L2172-S2187 VanDerWaalsContact CD2-OG 3.27Å; L2172-S2187 WeakPolarHBondContact CD2-OG 3.37Å; F2173-S2187 PolarHBondContact N-OG 2.93Å; F2173-S2187 WeakPolarHBondContact O-CB 3.35Å; F2173-S2187 PolarHBondContact O-N 3.02Å; F2173-S2187 PolarHBondContact O-OG 3.31Å; S2187-K2189 PolarHBondContact O-N 3.11Å; S2187-K2189 VanDerWaalsContact O-N 3.09Å; S2187-L2190 WeakPolarHBondContact O-CA 3.4Å; S2187-L2190 WeakPolarHBondContact O-CB 3.36Å; S2187-L2190 PolarHBondContact O-N 3.2Å; S2187-L2190 VanDerWaalsContact O-N 3.13Å
2188	D	73.9	Confident	69.4	Low	71.8 Å²	71.8	71.1 Å²	71.1	38%	0.384	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-56.3	-24.5	169.2	-7.5	-22	0	0	0	112.9	R2141 K2143 L2172 S2186 L2190 I2191	R2141-D2188 IonicContact CZ-OD1 2.75Å; R2141-D2188 IonicContact CZ-OD2 3.87Å; R2141-D2188 IonicContact NE-OD2 3.02Å; R2141-D2188 VanDerWaalsContact NH2-CG 3.3Å; R2141-D2188 IonicContact NH2-OD1 2.71Å; R2141-D2188 PolarHBondContact NH2-OD1 3.15Å; R2141-D2188 IonicContact NH2-OD2 3.24Å; R2141-D2188 PolarHBondContact NH2-OD2 3.23Å; K2143-D2188 VanDerWaalsContact CD-OD2 3.31Å; K2143-D2188 WeakPolarHBondContact CD-OD2 3.15Å; K2143-D2188 WeakPolarHBondContact CE-OD2 3.11Å; K2143-D2188 IonicContact NZ-OD1 3.52Å; K2143-D2188 PolarHBondContact NZ-OD1 3.33Å; K2143-D2188 IonicContact NZ-OD2 3.83Å; K2143-D2188 PolarHBondContact NZ-OD2 3.16Å; L2172-D2188 WeakPolarHBondContact CD1-OD1 3.27Å; S2186-D2188 VanDerWaalsContact C-OD1 3.24Å; S2186-D2188 WeakPolarHBondContact CB-OD1 3.41Å; S2186-D2188 PolarHBondContact O-N 3.14Å; S2186-D2188 VanDerWaalsContact OG-CG 3.26Å; S2186-D2188 PolarHBondContact OG-OD1 3.06Å; S2186-D2188 PolarHBondContact OG-OD2 3.07Å; D2188-L2190 VanDerWaalsContact C-N 3.29Å; D2188-I2191 HydrophobicContact CB-CD1 4.41Å; D2188-I2191 WeakPolarHBondContact O-CD1 3.35Å; D2188-I2191 VanDerWaalsContact O-CG1 3.28Å; D2188-I2191 WeakPolarHBondContact O-CG1 3.45Å
2189	K	63.9	Low	69.7	Low	167 Å²	167	71.3 Å²	71.3	73%	0.726	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-81	-14.9	175.5	-65	-178.5	-178.3	177.1	0	113.6	F2185 S2186 S2187 I2191	F2185-K2189 HydrophobicContact CE2-CB 4.23Å; F2185-K2189 HydrophobicContact CE2-CD 4.35Å; F2185-K2189 HydrophobicContact CZ-CB 4.48Å; S2186-K2189 PolarHBondContact O-N 2.94Å; S2187-K2189 PolarHBondContact O-N 3.11Å; S2187-K2189 VanDerWaalsContact O-N 3.09Å; K2189-I2191 PolarHBondContact O-N 3.25Å
2190	L	65.5	Low	70.5	Confident	45 Å²	45	66.6 Å²	66.6	24%	0.236	36%	0.358	C	S	.	.	S	Bend	trans	-87.5	89.7	176.4	-70.2	160.7	0	0	0	109.5	F2173 F2185 S2187 D2188 P2192 L2193 I2194 I2259	F2173-L2190 HydrophobicContact CZ-CD1 4.31Å; F2185-L2190 HydrophobicContact CE1-CD1 3.99Å; F2185-L2190 HydrophobicContact CZ-CD1 3.68Å; F2185-L2190 HydrophobicContact CZ-CG 3.88Å; S2187-L2190 WeakPolarHBondContact O-CA 3.4Å; S2187-L2190 WeakPolarHBondContact O-CB 3.36Å; S2187-L2190 PolarHBondContact O-N 3.2Å; S2187-L2190 VanDerWaalsContact O-N 3.13Å; D2188-L2190 VanDerWaalsContact C-N 3.29Å; L2190-P2192 VanDerWaalsContact C-N 3.3Å; L2190-P2192 VanDerWaalsContact O-CD 3.29Å; L2190-P2192 WeakPolarHBondContact O-CD 3.4Å; L2190-P2192 VanDerWaalsContact O-N 3.09Å; L2190-L2193 HydrophobicContact CD2-CD1 4.32Å; L2190-L2193 WeakPolarHBondContact O-CB 3.35Å; L2190-L2193 PolarHBondContact O-N 3.14Å; L2190-I2194 HydrophobicContact CB-CD1 4Å; L2190-I2194 HydrophobicContact CB-CG1 4.44Å; L2190-I2194 PolarHBondContact O-N 2.79Å; L2190-I2259 HydrophobicContact CD1-CD1 4.19Å; L2190-I2259 HydrophobicContact CD1-CG2 4.4Å
2191	I	54.6	Low	71.4	Confident	124.4 Å²	124.4	65.2 Å²	65.2	64%	0.638	35%	0.348	S	S	*	.			trans	-51.1	83.1	174.9	-63.5	165.7	0	0	0	109.4	D2188 K2189 L2193 I2194	D2188-I2191 HydrophobicContact CB-CD1 4.41Å; D2188-I2191 WeakPolarHBondContact O-CD1 3.35Å; D2188-I2191 VanDerWaalsContact O-CG1 3.28Å; D2188-I2191 WeakPolarHBondContact O-CG1 3.45Å; K2189-I2191 PolarHBondContact O-N 3.25Å; I2191-L2193 VanDerWaalsContact C-N 3.28Å; I2191-L2193 PolarHBondContact O-N 3.15Å; I2191-I2194 PolarHBondContact O-N 2.98Å
2192	P	50.3	Low	72.1	Confident	97.6 Å²	97.6	64.7 Å²	64.7	63%	0.634	34%	0.343	S	S	*	.			trans	-64.4	62.2	176.1	16.5	-20.5	0	0	0	109.8	L2190 I2194	L2190-P2192 VanDerWaalsContact C-N 3.3Å; L2190-P2192 VanDerWaalsContact O-CD 3.29Å; L2190-P2192 WeakPolarHBondContact O-CD 3.4Å; L2190-P2192 VanDerWaalsContact O-N 3.09Å; P2192-I2194 PolarHBondContact O-N 2.92Å; P2192-I2194 VanDerWaalsContact O-N 3.13Å
2193	L	52.3	Low	72.9	Confident	120.6 Å²	120.6	59.5 Å²	59.5	63%	0.631	32%	0.319	S	S	*	.	S	Bend	trans	-79.3	-20	177.4	-91.5	103.7	0	0	0	111.2	L2190 I2191 P2261	L2190-L2193 HydrophobicContact CD2-CD1 4.32Å; L2190-L2193 WeakPolarHBondContact O-CB 3.35Å; L2190-L2193 PolarHBondContact O-N 3.14Å; I2191-L2193 VanDerWaalsContact C-N 3.28Å; I2191-L2193 PolarHBondContact O-N 3.15Å; L2193-P2261 HydrophobicContact CD2-CB 4.27Å; L2193-P2261 HydrophobicContact CD2-CG 3.95Å
2194	I	54.1	Low	73.5	Confident	37.4 Å²	37.4	57.1 Å²	57.1	19%	0.192	31%	0.306	C	S	.	.	S	Bend	trans	-140.2	114.7	-178.8	-53.1	175.9	0	0	0	108.7	F2173 L2190 I2191 P2192 D2196 W2221 W2266 N2275	F2173-I2194 HydrophobicContact CE1-CD1 4.28Å; L2190-I2194 HydrophobicContact CB-CD1 4Å; L2190-I2194 HydrophobicContact CB-CG1 4.44Å; L2190-I2194 PolarHBondContact O-N 2.79Å; I2191-I2194 PolarHBondContact O-N 2.98Å; P2192-I2194 PolarHBondContact O-N 2.92Å; P2192-I2194 VanDerWaalsContact O-N 3.13Å; I2194-D2196 VanDerWaalsContact C-N 3.26Å; I2194-D2196 PolarHBondContact O-N 2.91Å; I2194-D2196 VanDerWaalsContact O-N 3.1Å; I2194-W2221 HydrophobicContact CG2-CZ2 4.1Å; I2194-W2266 HydrophobicContact CD1-CH2 3.75Å; I2194-W2266 HydrophobicContact CD1-CZ2 3.56Å; I2194-N2275 VanDerWaalsContact CG2-OD1 3.25Å; I2194-N2275 WeakPolarHBondContact CG2-OD1 3.37Å
2195	N	55.5	Low	73.9	Confident	130.8 Å²	130.8	55.8 Å²	55.8	70%	0.699	30%	0.3	S	S	*	.			trans	-77.6	26.8	-178.5	-85.4	-1.7	0	0	0	114.3	N2197	N2195-N2197 PolarHBondContact O-N 3.16Å; N2195-N2197 VanDerWaalsContact O-N 3.07Å
2196	D	60.7	Low	73.9	Confident	26.6 Å²	26.6	54.8 Å²	54.8	14%	0.142	30%	0.297	C	S	.	.			trans	-89.9	97.3	180	-100.6	-25.4	0	0	0	110.8	I2194 S2198 W2221 S2223 R2227 W2266	I2194-D2196 VanDerWaalsContact C-N 3.26Å; I2194-D2196 PolarHBondContact O-N 2.91Å; I2194-D2196 VanDerWaalsContact O-N 3.1Å; D2196-S2198 PolarHBondContact O-N 3.17Å; D2196-S2198 VanDerWaalsContact O-N 3.13Å; D2196-S2198 WeakPolarHBondContact OD1-CB 3.48Å; D2196-S2198 PolarHBondContact OD1-N 3.37Å; D2196-S2198 VanDerWaalsContact OD1-N 3.12Å; D2196-S2198 PolarHBondContact OD1-OG 3.5Å; D2196-S2198 PolarHBondContact OD2-OG 2.78Å; D2196-W2221 HydrophobicContact CB-CG 4.14Å; D2196-S2223 VanDerWaalsContact OD1-CB 3.24Å; D2196-S2223 WeakPolarHBondContact OD1-CB 3.44Å; D2196-S2223 PolarHBondContact OD1-OG 3.1Å; D2196-S2223 VanDerWaalsContact OD2-CB 3.23Å; D2196-S2223 WeakPolarHBondContact OD2-CB 3.48Å; D2196-S2223 PolarHBondContact OD2-OG 3.29Å; D2196-R2227 IonicContact OD2-CZ 3.59Å; D2196-R2227 IonicContact OD2-NH1 2.66Å; D2196-R2227 PolarHBondContact OD2-NH1 2.89Å; D2196-R2227 IonicContact OD2-NH2 2.71Å; D2196-R2227 PolarHBondContact OD2-NH2 3.19Å; D2196-W2266 VanDerWaalsContact OD2-CH2 3.3Å; D2196-W2266 WeakPolarHBondContact OD2-CH2 3.23Å
2197	N	70.8	Confident	73.9	Confident	136.2 Å²	136.2	57 Å²	57	73%	0.728	31%	0.307	S	S	*	.			trans	-77.4	25.7	170.7	-70.7	-3	0	0	0	112.4	N2195	N2195-N2197 PolarHBondContact O-N 3.16Å; N2195-N2197 VanDerWaalsContact O-N 3.07Å
2198	S	81	Confident	73.9	Confident	22 Å²	22	56.9 Å²	56.9	15%	0.154	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-86.6	146.2	-177.7	70.6	0	0	0	0	110	G2171 D2196 V2200 W2221 S2222 S2223	G2171-S2198 WeakPolarHBondContact CA-O 3.39Å; G2171-S2198 PolarHBondContact N-O 3.06Å; D2196-S2198 PolarHBondContact O-N 3.17Å; D2196-S2198 VanDerWaalsContact O-N 3.13Å; D2196-S2198 WeakPolarHBondContact OD1-CB 3.48Å; D2196-S2198 PolarHBondContact OD1-N 3.37Å; D2196-S2198 VanDerWaalsContact OD1-N 3.12Å; D2196-S2198 PolarHBondContact OD1-OG 3.5Å; D2196-S2198 PolarHBondContact OD2-OG 2.78Å; S2198-V2200 PolarHBondContact O-N 3.19Å; S2198-W2221 VanDerWaalsContact O-CD1 3.3Å; S2198-W2221 WeakPolarHBondContact OG-CB 3.45Å; S2198-S2222 WeakPolarHBondContact CB-OG 3.27Å; S2198-S2223 VanDerWaalsContact OG-CB 3.29Å; S2198-S2223 WeakPolarHBondContact OG-CB 3.22Å; S2198-S2223 PolarHBondContact OG-N 3.07Å; S2198-S2223 VanDerWaalsContact OG-N 3.11Å; S2198-S2223 PolarHBondContact OG-OG 3.03Å; S2198-S2223 VanDerWaalsContact OG-OG 3.06Å
2199	S	85.9	Confident	73.7	Confident	29 Å²	29	54.6 Å²	54.6	20%	0.203	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-57.6	134.8	-176.3	176.8	0	0	0	0	112.3	T2153 N2169 Q2201 W2221 S2222	T2153-S2199 WeakPolarHBondContact CG2-OG 3.36Å; N2169-S2199 WeakPolarHBondContact CA-OG 3.34Å; N2169-S2199 VanDerWaalsContact O-CA 3.24Å; N2169-S2199 WeakPolarHBondContact O-CA 3.32Å; N2169-S2199 WeakPolarHBondContact O-CB 3.34Å; N2169-S2199 PolarHBondContact O-N 2.77Å; S2199-Q2201 PolarHBondContact O-N 3.01Å; S2199-W2221 CarbonylContact O-C 3.52Å; S2199-W2221 WeakPolarHBondContact O-CA 3.34Å; S2199-S2222 PolarHBondContact N-OG 3.11Å; S2199-S2222 VanDerWaalsContact N-OG 3.11Å; S2199-S2222 WeakPolarHBondContact O-CB 3.39Å; S2199-S2222 PolarHBondContact O-N 3.06Å; S2199-S2222 PolarHBondContact O-OG 3.24Å; S2199-S2222 VanDerWaalsContact O-OG 3.13Å
2200	V	88.2	Confident	74.1	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	128.1	167.3	-173.5	0	0	0	0	108.3	T2153 T2154 W2168 L2172 S2198 I2203 V2219	T2153-V2200 VanDerWaalsContact CB-O 3.24Å; T2153-V2200 WeakPolarHBondContact CB-O 3.36Å; T2153-V2200 PolarHBondContact OG1-O 2.94Å; T2154-V2200 HydrophobicContact CG2-CB 4.46Å; T2154-V2200 HydrophobicContact CG2-CG1 4.02Å; W2168-V2200 PolarHBondContact O-N 3.07Å; W2168-V2200 VanDerWaalsContact O-N 3.13Å; L2172-V2200 WeakPolarHBondContact O-CG2 3.4Å; S2198-V2200 PolarHBondContact O-N 3.19Å; V2200-I2203 HydrophobicContact CG1-CD1 3.87Å; V2200-I2203 HydrophobicContact CG1-CG1 3.71Å; V2200-V2219 HydrophobicContact CG1-CG1 3.7Å
2201	Q	88.2	Confident	74.3	Confident	56 Å²	56	52.8 Å²	52.8	26%	0.262	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	-36.7	-177.2	-77.4	-177	-20.4	0	0	112.6	T2154 S2199 G2220 S2222 G2281 T2283	T2154-Q2201 WeakPolarHBondContact CB-O 3.14Å; S2199-Q2201 PolarHBondContact O-N 3.01Å; Q2201-G2220 PolarHBondContact N-O 2.88Å; Q2201-S2222 VanDerWaalsContact NE2-CB 3.28Å; Q2201-G2281 VanDerWaalsContact CD-O 3.27Å; Q2201-G2281 PolarHBondContact NE2-O 3.16Å; Q2201-G2281 VanDerWaalsContact NE2-O 3.08Å; Q2201-G2281 PolarHBondContact OE1-O 3.04Å; Q2201-T2283 WeakPolarHBondContact CB-O 3.33Å; Q2201-T2283 VanDerWaalsContact OE1-C 3.32Å; Q2201-T2283 PolarHBondContact OE1-O 3.14Å; Q2201-T2283 VanDerWaalsContact OE1-O 3.05Å
2202	A	89.5	Confident	74.8	Confident	5 Å²	5	54.2 Å²	54.2	4%	0.041	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	132.5	-178.1	0	0	0	0	0	110.9	V2219 G2220 T2283 A2286	A2202-V2219 CarbonylContact O-C 3.56Å; A2202-V2219 WeakPolarHBondContact O-CA 3.39Å; A2202-G2220 PolarHBondContact N-O 3.14Å; A2202-G2220 VanDerWaalsContact N-O 3.16Å; A2202-G2220 PolarHBondContact O-N 3.14Å; A2202-T2283 HydrophobicContact CB-CG2 4.47Å; A2202-A2286 HydrophobicContact CB-CB 3.85Å
2203	I	91.8	Very high	75.8	Confident	4.5 Å²	4.5	56.6 Å²	56.6	2%	0.023	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	135.2	168.1	-62.2	178	0	0	0	107.8	T2154 A2156 I2165 F2173 V2200 V2217 I2218 V2219	T2154-I2203 HydrophobicContact CG2-CB 4.03Å; T2154-I2203 HydrophobicContact CG2-CD1 3.93Å; T2154-I2203 HydrophobicContact CG2-CG1 3.64Å; A2156-I2203 HydrophobicContact CB-CB 4.45Å; A2156-I2203 HydrophobicContact CB-CG2 3.87Å; I2165-I2203 HydrophobicContact CB-CG2 4.42Å; I2165-I2203 HydrophobicContact CG2-CD1 4.13Å; I2165-I2203 HydrophobicContact CG2-CG2 4.11Å; F2173-I2203 HydrophobicContact CB-CD1 4.3Å; V2200-I2203 HydrophobicContact CG1-CD1 3.87Å; V2200-I2203 HydrophobicContact CG1-CG1 3.71Å; I2203-V2217 HydrophobicContact CG2-CG1 4.21Å; I2203-I2218 WeakPolarHBondContact CA-O 3.26Å; I2203-V2219 HydrophobicContact CG1-CG1 4.2Å; I2203-V2219 HydrophobicContact CG1-CG2 4.36Å
2204	S	91.3	Very high	77.1	Confident	24.75 Å²	24.75	50.9 Å²	50.9	17%	0.173	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	148.7	170.1	-165.1	0	0	0	0	110.7	V2217 I2218 A2286 A2287 A2288	S2204-V2217 WeakPolarHBondContact O-CA 3.38Å; S2204-I2218 PolarHBondContact N-O 3.03Å; S2204-I2218 VanDerWaalsContact N-O 3.1Å; S2204-I2218 WeakPolarHBondContact O-CG2 3.26Å; S2204-I2218 PolarHBondContact O-N 2.96Å; S2204-A2286 WeakPolarHBondContact CB-O 3.43Å; S2204-A2286 PolarHBondContact OG-O 3.12Å; S2204-A2287 WeakPolarHBondContact OG-CA 3.38Å; S2204-A2288 PolarHBondContact OG-N 2.98Å
2205	C	89.4	Confident	78.5	Confident	20 Å²	20	49.3 Å²	49.3	14%	0.135	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	139.9	177.6	-76	0	0	0	0	109.1	A2156 I2157 I2165 L2216 V2217	A2156-C2205 HydrophobicContact CB-CB 4.19Å; I2157-C2205 WeakPolarHBondContact O-CB 3.27Å; I2165-C2205 VanDerWaalsContact CD1-SG 3.55Å; I2165-C2205 WeakPolarHBondContact CD1-SG 3.4Å; C2205-L2216 CarbonylContact C-O 3.53Å; C2205-L2216 WeakPolarHBondContact CA-O 3.27Å; C2205-V2217 HydrophobicContact CB-CG2 4.42Å
2206	G	84.7	Confident	80.1	Confident	5.25 Å²	5.25	43.1 Å²	43.1	5%	0.054	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	175	172.8	0	0	0	0	0	110.1	I2159 S2208 N2215 L2216	I2159-G2206 WeakPolarHBondContact CD1-O 3.41Å; G2206-S2208 PolarHBondContact O-N 2.76Å; G2206-N2215 CarbonylContact O-C 3.51Å; G2206-N2215 WeakPolarHBondContact O-CA 3.35Å; G2206-L2216 PolarHBondContact N-O 2.87Å; G2206-L2216 PolarHBondContact O-N 2.83Å
2207	I	81.3	Confident	81.5	Confident	66.75 Å²	66.75	41.9 Å²	41.9	34%	0.342	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	137.7	-179.2	-59.5	169.5	0	0	0	108.7	I2159 D2290	I2159-I2207 VanDerWaalsContact CD1-CA 3.42Å; I2159-I2207 HydrophobicContact CD1-CB 4.01Å; I2159-I2207 HydrophobicContact CD1-CG1 3.71Å; I2159-I2207 VanDerWaalsContact CD1-CG1 3.45Å; I2159-I2207 VanDerWaalsContact CD1-N 3.32Å; I2159-I2207 HydrophobicContact CG1-CD1 4.39Å; I2159-I2207 HydrophobicContact CG1-CG1 4.22Å; I2159-I2207 HydrophobicContact CG2-CG1 4.43Å; I2207-D2290 WeakPolarHBondContact CB-OD1 3.45Å; I2207-D2290 WeakPolarHBondContact CD1-OD1 3.25Å; I2207-D2290 CarbonylContact O-C 3.56Å; I2207-D2290 VanDerWaalsContact O-CA 3.28Å; I2207-D2290 WeakPolarHBondContact O-CA 3.29Å; I2207-D2290 VanDerWaalsContact O-O 3.04Å
2208	S	79.3	Confident	82.5	Confident	5 Å²	5	35.4 Å²	35.4	4%	0.035	19%	0.186	C	C	.	.			trans	-74.8	139.5	173.4	176.6	0	0	0	0	110.7	G2206 Y2210 A2214 H2230	G2206-S2208 PolarHBondContact O-N 2.76Å; S2208-Y2210 PolarHBondContact O-N 2.89Å; S2208-Y2210 VanDerWaalsContact OG-CD2 3.27Å; S2208-Y2210 WeakPolarHBondContact OG-CD2 3.33Å; S2208-Y2210 PolarHBondContact OG-N 3.04Å; S2208-Y2210 VanDerWaalsContact OG-N 3.13Å; S2208-A2214 VanDerWaalsContact CB-C 3.45Å; S2208-A2214 WeakPolarHBondContact CB-O 3.36Å; S2208-A2214 PolarHBondContact N-O 2.86Å; S2208-H2230 PolarHBondContact OG-CD2 3.25Å; S2208-H2230 PolarHBondContact OG-CE1 2.75Å; S2208-H2230 PolarHBondContact OG-ND1 2.61Å; S2208-H2230 VanDerWaalsContact OG-ND1 3.1Å; S2208-H2230 PolarHBondContact OG-NE2 3.27Å
2209	P	69.7	Low	83	Confident	23.5 Å²	23.5	34.3 Å²	34.3	15%	0.153	18%	0.179	C	C	.	.	S	Bend	trans	-74.3	-6.2	173.4	33.1	-36.9	0	0	0	113.4	D2290 F2291 V2307	P2209-D2290 VanDerWaalsContact CD-O 3.3Å; P2209-D2290 WeakPolarHBondContact CD-O 3.36Å; P2209-F2291 HydrophobicContact CB-CD1 3.34Å; P2209-F2291 VanDerWaalsContact CB-CD1 3.49Å; P2209-F2291 HydrophobicContact CB-CE1 3.39Å; P2209-F2291 VanDerWaalsContact CB-CE1 3.42Å; P2209-F2291 HydrophobicContact CB-CG 4.29Å; P2209-F2291 HydrophobicContact CB-CZ 4.33Å; P2209-F2291 HydrophobicContact CG-CD1 4.4Å; P2209-V2307 HydrophobicContact CG-CB 4.49Å; P2209-V2307 HydrophobicContact CG-CG1 4.06Å
2210	Y	72.6	Confident	83.2	Confident	33.5 Å²	33.5	33 Å²	33	13%	0.131	17%	0.169	C	C	.	.	S	Bend	trans	-99.6	-37	-172.2	-55.6	-65.8	0	0	0	113.7	S2208 H2230 L2262 V2307 G2308 S2309 V2310 L2311 P2314	S2208-Y2210 PolarHBondContact O-N 2.89Å; S2208-Y2210 VanDerWaalsContact OG-CD2 3.27Å; S2208-Y2210 WeakPolarHBondContact OG-CD2 3.33Å; S2208-Y2210 PolarHBondContact OG-N 3.04Å; S2208-Y2210 VanDerWaalsContact OG-N 3.13Å; Y2210-H2230 HydrophobicContact CD2-CB 4.5Å; Y2210-H2230 AromaticContact CD2-CD2 3.61Å; Y2210-H2230 AromaticContact CD2-CE1 3.83Å; Y2210-H2230 AromaticContact CD2-NE2 3.72Å; Y2210-H2230 VanDerWaalsContact CD2-NE2 3.28Å; Y2210-H2230 WeakPolarHBondContact CD2-NE2 3.41Å; Y2210-H2230 AromaticContact CE2-CD2 3.51Å; Y2210-H2230 AromaticContact CE2-NE2 3.26Å; Y2210-H2230 VanDerWaalsContact CE2-NE2 3.26Å; Y2210-H2230 WeakPolarHBondContact CE2-NE2 3.42Å; Y2210-L2262 HydrophobicContact CE2-CD1 4.04Å; Y2210-L2262 HydrophobicContact CE2-CD2 4.02Å; Y2210-V2307 HydrophobicContact CE2-CG1 4.25Å; Y2210-V2307 VanDerWaalsContact OH-CG1 3.25Å; Y2210-V2307 WeakPolarHBondContact OH-CG1 3.29Å; Y2210-G2308 WeakPolarHBondContact CE1-O 3.25Å; Y2210-G2308 VanDerWaalsContact CZ-O 3.3Å; Y2210-G2308 PolarHBondContact OH-O 3.05Å; Y2210-S2309 VanDerWaalsContact CD1-O 3.27Å; Y2210-S2309 WeakPolarHBondContact CD1-O 3.35Å; Y2210-S2309 VanDerWaalsContact CE1-C 3.42Å; Y2210-S2309 WeakPolarHBondContact CE1-O 3.4Å; Y2210-V2310 PolarHBondContact OH-O 2.9Å; Y2210-L2311 HydrophobicContact CD1-CB 3.81Å; Y2210-L2311 HydrophobicContact CD1-CD1 4.24Å; Y2210-L2311 HydrophobicContact CD1-CG 3.79Å; Y2210-L2311 HydrophobicContact CD2-CB 4.37Å; Y2210-L2311 HydrophobicContact CD2-CD1 3.67Å; Y2210-L2311 HydrophobicContact CD2-CG 4.42Å; Y2210-L2311 VanDerWaalsContact CE1-CA 3.47Å; Y2210-L2311 HydrophobicContact CE1-CB 3.87Å; Y2210-L2311 HydrophobicContact CE1-CD1 4.4Å; Y2210-L2311 HydrophobicContact CE1-CG 3.88Å; Y2210-L2311 HydrophobicContact CE2-CB 4.45Å; Y2210-L2311 HydrophobicContact CE2-CD1 3.55Å; Y2210-L2311 HydrophobicContact CG-CB 3.99Å; Y2210-L2311 HydrophobicContact CG-CD1 4.17Å; Y2210-L2311 HydrophobicContact CG-CG 4.46Å; Y2210-P2314 WeakPolarHBondContact OH-CB 3.27Å
2211	Y	70.4	Confident	83.3	Confident	140.25 Å²	140.25	33.3 Å²	33.3	55%	0.55	17%	0.17	S	C	*	.			trans	-147.7	138.2	-178.8	-61.1	-77.9	0	0	0	110	D2213 A2214 H2230 L2311	Y2211-D2213 PolarHBondContact O-N 2.92Å; Y2211-A2214 HydrophobicContact CD2-CB 4.25Å; Y2211-A2214 PolarHBondContact O-N 3.06Å; Y2211-H2230 AromaticContact CD2-CE1 3.86Å; Y2211-H2230 AromaticContact CD2-NE2 3.88Å; Y2211-L2311 HydrophobicContact CE2-CD1 3.93Å; Y2211-L2311 HydrophobicContact CE2-CD2 4.48Å
2212	D	64.9	Low	83.3	Confident	153.5 Å²	153.5	32.1 Å²	32.1	82%	0.821	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-29.2	-179.6	-62.9	-28.8	0	0	0	112.9	A2214	D2212-A2214 VanDerWaalsContact C-N 3.35Å
2213	D	69.5	Low	83.1	Confident	147.75 Å²	147.75	32.3 Å²	32.3	79%	0.79	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.6	11	178.3	-71.8	-29.1	0	0	0	113.8	Y2211	Y2211-D2213 PolarHBondContact O-N 2.92Å
2214	A	79.7	Confident	82.8	Confident	1.75 Å²	1.75	32.1 Å²	32.1	1%	0.014	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	151.4	-179.9	0	0	0	0	0	112.5	S2208 Y2211 D2212 H2230 F2231	S2208-A2214 VanDerWaalsContact CB-C 3.45Å; S2208-A2214 WeakPolarHBondContact CB-O 3.36Å; S2208-A2214 PolarHBondContact N-O 2.86Å; Y2211-A2214 HydrophobicContact CD2-CB 4.25Å; Y2211-A2214 PolarHBondContact O-N 3.06Å; D2212-A2214 VanDerWaalsContact C-N 3.35Å; A2214-H2230 WeakPolarHBondContact CB-NE2 3.31Å; A2214-F2231 CarbonylContact C-O 3.52Å; A2214-F2231 WeakPolarHBondContact CA-O 3.24Å; A2214-F2231 WeakPolarHBondContact CB-O 3.29Å
2215	N	85.2	Confident	82.6	Confident	3.75 Å²	3.75	31 Å²	31	2%	0.02	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	133.6	179.3	-61.5	-77.1	0	0	0	110.4	D2158 I2159 G2206 V2217 H2230 F2231	D2158-N2215 PolarHBondContact OD1-ND2 3.12Å; D2158-N2215 PolarHBondContact OD1-OD1 3.35Å; I2159-N2215 WeakPolarHBondContact CB-OD1 3.02Å; I2159-N2215 HydrophobicContact CD1-CB 4.35Å; I2159-N2215 VanDerWaalsContact CD1-OD1 3.25Å; I2159-N2215 WeakPolarHBondContact CD1-OD1 3.28Å; I2159-N2215 VanDerWaalsContact CG1-OD1 3.26Å; I2159-N2215 WeakPolarHBondContact CG1-OD1 3.31Å; I2159-N2215 PolarHBondContact N-OD1 3.28Å; I2159-N2215 VanDerWaalsContact N-OD1 3.16Å; G2206-N2215 CarbonylContact O-C 3.51Å; G2206-N2215 WeakPolarHBondContact O-CA 3.35Å; N2215-V2217 HydrophobicContact CB-CG2 3.96Å; N2215-H2230 WeakPolarHBondContact O-CA 3.26Å; N2215-H2230 PolarHBondContact O-ND1 3.42Å; N2215-F2231 HydrophobicContact CB-CB 4.4Å; N2215-F2231 PolarHBondContact N-O 2.84Å; N2215-F2231 PolarHBondContact O-N 3.23Å
2216	L	88.7	Confident	82.6	Confident	0.5 Å²	0.5	30.2 Å²	30.2	0%	0.003	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	119.7	159.6	178.2	64	0	0	0	108.2	C2205 G2206 L2228 L2262 V2307	C2205-L2216 CarbonylContact C-O 3.53Å; C2205-L2216 WeakPolarHBondContact CA-O 3.27Å; G2206-L2216 PolarHBondContact N-O 2.87Å; G2206-L2216 PolarHBondContact O-N 2.83Å; L2216-L2228 HydrophobicContact CD1-CD2 4.17Å; L2216-L2262 HydrophobicContact CD1-CD1 3.84Å; L2216-V2307 HydrophobicContact CD1-CG2 4.23Å; L2216-V2307 HydrophobicContact CD2-CG2 4.13Å
2217	V	90	Very high	82.8	Confident	0.25 Å²	0.25	31.7 Å²	31.7	0%	0.002	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	124.5	-178.7	179.8	0	0	0	0	109.7	I2165 I2203 S2204 C2205 N2215 V2219 L2228 Y2229 F2231	I2165-V2217 HydrophobicContact CD1-CG1 4.31Å; I2165-V2217 HydrophobicContact CD1-CG2 3.9Å; I2203-V2217 HydrophobicContact CG2-CG1 4.21Å; S2204-V2217 WeakPolarHBondContact O-CA 3.38Å; C2205-V2217 HydrophobicContact CB-CG2 4.42Å; N2215-V2217 HydrophobicContact CB-CG2 3.96Å; V2217-V2219 HydrophobicContact CG1-CG2 4.03Å; V2217-L2228 CarbonylContact O-C 3.54Å; V2217-L2228 WeakPolarHBondContact O-CA 3.35Å; V2217-Y2229 PolarHBondContact N-O 3.03Å; V2217-Y2229 PolarHBondContact O-N 3.24Å; V2217-F2231 HydrophobicContact CB-CD2 4.12Å; V2217-F2231 HydrophobicContact CB-CE2 3.95Å; V2217-F2231 HydrophobicContact CB-CZ 4.25Å; V2217-F2231 HydrophobicContact CG1-CE2 4.04Å; V2217-F2231 HydrophobicContact CG1-CZ 4.26Å; V2217-F2231 HydrophobicContact CG2-CB 4.4Å; V2217-F2231 HydrophobicContact CG2-CD1 4.36Å; V2217-F2231 HydrophobicContact CG2-CD2 3.47Å; V2217-F2231 VanDerWaalsContact CG2-CD2 3.44Å; V2217-F2231 HydrophobicContact CG2-CE2 3.72Å; V2217-F2231 HydrophobicContact CG2-CG 4.06Å; V2217-F2231 HydrophobicContact CG2-CZ 4.33Å
2218	I	91.9	Very high	83.3	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	131.4	171.1	-178.1	165.1	0	0	0	109.2	I2203 S2204 V2226 R2227 L2228 A2286 A2288 A2293 Y2305	I2203-I2218 WeakPolarHBondContact CA-O 3.26Å; S2204-I2218 PolarHBondContact N-O 3.03Å; S2204-I2218 VanDerWaalsContact N-O 3.1Å; S2204-I2218 WeakPolarHBondContact O-CG2 3.26Å; S2204-I2218 PolarHBondContact O-N 2.96Å; I2218-V2226 HydrophobicContact CD1-CG1 3.68Å; I2218-V2226 HydrophobicContact CG1-CG1 3.87Å; I2218-R2227 WeakPolarHBondContact CA-O 3.31Å; I2218-L2228 HydrophobicContact CB-CD2 3.73Å; I2218-L2228 HydrophobicContact CB-CG 4.43Å; I2218-L2228 HydrophobicContact CD1-CD2 3.91Å; I2218-L2228 HydrophobicContact CG1-CD2 3.76Å; I2218-L2228 HydrophobicContact CG1-CG 4.43Å; I2218-A2286 HydrophobicContact CD1-CB 4.11Å; I2218-A2286 HydrophobicContact CG1-CB 4.12Å; I2218-A2286 HydrophobicContact CG2-CB 3.79Å; I2218-A2288 HydrophobicContact CG2-CB 4.02Å; I2218-A2293 HydrophobicContact CB-CB 4.24Å; I2218-A2293 HydrophobicContact CD1-CB 3.8Å; I2218-A2293 HydrophobicContact CG1-CB 4.49Å; I2218-A2293 HydrophobicContact CG2-CB 4.47Å; I2218-Y2305 HydrophobicContact CD1-CD2 4.34Å; I2218-Y2305 HydrophobicContact CD1-CE2 4.23Å
2219	V	91.2	Very high	83.7	Confident	0.25 Å²	0.25	28.9 Å²	28.9	0%	0.002	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	133.1	176.6	-174.4	0	0	0	0	108.6	F2173 V2200 A2202 I2203 V2217 W2221 V2226 R2227 Y2229	F2173-V2219 HydrophobicContact CD1-CG2 4.39Å; F2173-V2219 HydrophobicContact CE1-CG2 4.44Å; V2200-V2219 HydrophobicContact CG1-CG1 3.7Å; A2202-V2219 CarbonylContact O-C 3.56Å; A2202-V2219 WeakPolarHBondContact O-CA 3.39Å; I2203-V2219 HydrophobicContact CG1-CG1 4.2Å; I2203-V2219 HydrophobicContact CG1-CG2 4.36Å; V2217-V2219 HydrophobicContact CG1-CG2 4.03Å; V2219-W2221 HydrophobicContact CB-CE3 4.48Å; V2219-W2221 HydrophobicContact CB-CH2 3.53Å; V2219-W2221 VanDerWaalsContact CB-CH2 3.46Å; V2219-W2221 HydrophobicContact CB-CZ2 4.16Å; V2219-W2221 HydrophobicContact CB-CZ3 3.73Å; V2219-W2221 HydrophobicContact CG1-CD2 4.2Å; V2219-W2221 HydrophobicContact CG1-CE3 4.12Å; V2219-W2221 HydrophobicContact CG1-CH2 3.43Å; V2219-W2221 VanDerWaalsContact CG1-CH2 3.45Å; V2219-W2221 HydrophobicContact CG1-CZ2 3.54Å; V2219-W2221 VanDerWaalsContact CG1-CZ2 3.49Å; V2219-W2221 HydrophobicContact CG1-CZ3 3.73Å; V2219-W2221 HydrophobicContact CG2-CH2 4.46Å; V2219-W2221 VanDerWaalsContact O-CZ3 3.23Å; V2219-W2221 WeakPolarHBondContact O-CZ3 3.42Å; V2219-V2226 WeakPolarHBondContact O-CA 3.24Å; V2219-R2227 PolarHBondContact N-O 3.3Å; V2219-R2227 PolarHBondContact O-N 3.22Å; V2219-Y2229 HydrophobicContact CB-CE2 4.32Å; V2219-Y2229 HydrophobicContact CG2-CD2 4.06Å; V2219-Y2229 HydrophobicContact CG2-CE2 3.97Å
2220	G	90.6	Very high	84.5	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	133.7	178.3	0	0	0	0	0	111.2	Q2201 A2202 A2225	Q2201-G2220 PolarHBondContact N-O 2.88Å; A2202-G2220 PolarHBondContact N-O 3.14Å; A2202-G2220 VanDerWaalsContact N-O 3.16Å; A2202-G2220 PolarHBondContact O-N 3.14Å; G2220-A2225 WeakPolarHBondContact CA-O 3.4Å
2221	W	89.9	Confident	85.1	Confident	6 Å²	6	26.5 Å²	26.5	2%	0.023	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	159.6	-177.7	-70.4	-99	0	0	0	112.4	G2171 I2194 D2196 S2198 S2199 V2219 S2223 G2224 A2225 R2227 Y2229 T2283	G2171-W2221 PolarHBondContact O-NE1 3.14Å; G2171-W2221 VanDerWaalsContact O-NE1 3.08Å; I2194-W2221 HydrophobicContact CG2-CZ2 4.1Å; D2196-W2221 HydrophobicContact CB-CG 4.14Å; S2198-W2221 VanDerWaalsContact O-CD1 3.3Å; S2198-W2221 WeakPolarHBondContact OG-CB 3.45Å; S2199-W2221 CarbonylContact O-C 3.52Å; S2199-W2221 WeakPolarHBondContact O-CA 3.34Å; V2219-W2221 HydrophobicContact CB-CE3 4.48Å; V2219-W2221 HydrophobicContact CB-CH2 3.53Å; V2219-W2221 VanDerWaalsContact CB-CH2 3.46Å; V2219-W2221 HydrophobicContact CB-CZ2 4.16Å; V2219-W2221 HydrophobicContact CB-CZ3 3.73Å; V2219-W2221 HydrophobicContact CG1-CD2 4.2Å; V2219-W2221 HydrophobicContact CG1-CE3 4.12Å; V2219-W2221 HydrophobicContact CG1-CH2 3.43Å; V2219-W2221 VanDerWaalsContact CG1-CH2 3.45Å; V2219-W2221 HydrophobicContact CG1-CZ2 3.54Å; V2219-W2221 VanDerWaalsContact CG1-CZ2 3.49Å; V2219-W2221 HydrophobicContact CG1-CZ3 3.73Å; V2219-W2221 HydrophobicContact CG2-CH2 4.46Å; V2219-W2221 VanDerWaalsContact O-CZ3 3.23Å; V2219-W2221 WeakPolarHBondContact O-CZ3 3.42Å; W2221-S2223 VanDerWaalsContact C-N 3.25Å; W2221-S2223 PolarHBondContact O-N 3.05Å; W2221-G2224 WeakPolarHBondContact O-CA 3.43Å; W2221-G2224 PolarHBondContact O-N 3Å; W2221-A2225 HydrophobicContact CB-CB 4.34Å; W2221-A2225 HydrophobicContact CE3-CB 4.11Å; W2221-A2225 PolarHBondContact N-O 2.86Å; W2221-R2227 HydrophobicContact CE3-CG 4.34Å; W2221-R2227 HydrophobicContact CH2-CB 3.64Å; W2221-R2227 VanDerWaalsContact CH2-CD 3.45Å; W2221-R2227 HydrophobicContact CH2-CG 3.64Å; W2221-R2227 HydrophobicContact CZ3-CB 3.5Å; W2221-R2227 VanDerWaalsContact CZ3-CB 3.47Å; W2221-R2227 HydrophobicContact CZ3-CG 3.39Å; W2221-Y2229 HydrophobicContact CH2-CE2 4.17Å; W2221-T2283 PolarHBondContact O-N 3.26Å; W2221-T2283 VanDerWaalsContact O-N 3.15Å; W2221-T2283 PolarHBondContact O-OG1 3.08Å
2222	S	87.9	Confident	85.6	Confident	32.5 Å²	32.5	20.6 Å²	20.6	23%	0.227	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-16.2	175.5	63.9	0	0	0	0	114.1	S2198 S2199 Q2201 G2224 G2278	S2198-S2222 WeakPolarHBondContact CB-OG 3.27Å; S2199-S2222 PolarHBondContact N-OG 3.11Å; S2199-S2222 VanDerWaalsContact N-OG 3.11Å; S2199-S2222 WeakPolarHBondContact O-CB 3.39Å; S2199-S2222 PolarHBondContact O-N 3.06Å; S2199-S2222 PolarHBondContact O-OG 3.24Å; S2199-S2222 VanDerWaalsContact O-OG 3.13Å; Q2201-S2222 VanDerWaalsContact NE2-CB 3.28Å; S2222-G2224 PolarHBondContact O-N 2.96Å; S2222-G2278 WeakPolarHBondContact O-CA 3.3Å
2223	S	85.1	Confident	86.2	Confident	8.75 Å²	8.75	15.1 Å²	15.1	6%	0.061	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-11	166.3	59.7	0	0	0	0	113.1	D2196 S2198 W2221 A2225 S2269 T2277 G2278	D2196-S2223 VanDerWaalsContact OD1-CB 3.24Å; D2196-S2223 WeakPolarHBondContact OD1-CB 3.44Å; D2196-S2223 PolarHBondContact OD1-OG 3.1Å; D2196-S2223 VanDerWaalsContact OD2-CB 3.23Å; D2196-S2223 WeakPolarHBondContact OD2-CB 3.48Å; D2196-S2223 PolarHBondContact OD2-OG 3.29Å; S2198-S2223 VanDerWaalsContact OG-CB 3.29Å; S2198-S2223 WeakPolarHBondContact OG-CB 3.22Å; S2198-S2223 PolarHBondContact OG-N 3.07Å; S2198-S2223 VanDerWaalsContact OG-N 3.11Å; S2198-S2223 PolarHBondContact OG-OG 3.03Å; S2198-S2223 VanDerWaalsContact OG-OG 3.06Å; W2221-S2223 VanDerWaalsContact C-N 3.25Å; W2221-S2223 PolarHBondContact O-N 3.05Å; S2223-A2225 WeakPolarHBondContact OG-CB 3.34Å; S2223-A2225 PolarHBondContact OG-N 3.18Å; S2223-S2269 WeakPolarHBondContact O-CB 3.38Å; S2223-T2277 CarbonylContact O-C 3.55Å; S2223-G2278 VanDerWaalsContact C-CA 3.44Å; S2223-G2278 VanDerWaalsContact O-CA 3.27Å; S2223-G2278 WeakPolarHBondContact O-CA 3.36Å; S2223-G2278 PolarHBondContact O-N 2.91Å; S2223-G2278 VanDerWaalsContact O-N 3.08Å
2224	G	85.2	Confident	86.1	Confident	0 Å²	0	14.2 Å²	14.2	0%	0	7%	0.069	C	C	.	.	S	Bend	trans	88.9	0.3	-173.3	0	0	0	0	0	114	W2221 S2222 W2266 S2267 H2268 T2283	W2221-G2224 WeakPolarHBondContact O-CA 3.43Å; W2221-G2224 PolarHBondContact O-N 3Å; S2222-G2224 PolarHBondContact O-N 2.96Å; G2224-W2266 CarbonylContact O-C 3.52Å; G2224-S2267 CarbonylContact O-C 3.34Å; G2224-S2267 VanDerWaalsContact O-CA 3.25Å; G2224-S2267 WeakPolarHBondContact O-CA 2.99Å; G2224-S2267 PolarHBondContact O-N 3.02Å; G2224-S2267 PolarHBondContact O-OG 3.03Å; G2224-H2268 VanDerWaalsContact CA-C 3.48Å; G2224-H2268 PolarHBondContact O-N 2.93Å; G2224-T2283 PolarHBondContact O-OG1 3.08Å
2225	A	87.9	Confident	84.9	Confident	2.25 Å²	2.25	18.8 Å²	18.8	2%	0.019	10%	0.098	C	C	.	.			trans	-65.5	147.9	172.4	0	0	0	0	0	111.7	G2220 W2221 S2223 S2265 W2266 S2267 T2283	G2220-A2225 WeakPolarHBondContact CA-O 3.4Å; W2221-A2225 HydrophobicContact CB-CB 4.34Å; W2221-A2225 HydrophobicContact CE3-CB 4.11Å; W2221-A2225 PolarHBondContact N-O 2.86Å; S2223-A2225 WeakPolarHBondContact OG-CB 3.34Å; S2223-A2225 PolarHBondContact OG-N 3.18Å; A2225-S2265 CarbonylContact C-O 3.22Å; A2225-S2265 WeakPolarHBondContact CA-O 3.34Å; A2225-W2266 HydrophobicContact CB-CD2 4.27Å; A2225-W2266 HydrophobicContact CB-CE3 4.21Å; A2225-W2266 HydrophobicContact CB-CH2 4.19Å; A2225-W2266 HydrophobicContact CB-CZ2 4.34Å; A2225-W2266 HydrophobicContact CB-CZ3 4.23Å; A2225-S2267 PolarHBondContact N-OG 2.98Å; A2225-T2283 PolarHBondContact O-OG1 3.07Å; A2225-T2283 VanDerWaalsContact O-OG1 3.13Å
2226	V	89.9	Confident	83.2	Confident	2 Å²	2	19.9 Å²	19.9	1%	0.012	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	130.9	174.6	-175.7	0	0	0	0	108.4	I2218 V2219 T2264 S2265 W2266 T2283 Y2305	I2218-V2226 HydrophobicContact CD1-CG1 3.68Å; I2218-V2226 HydrophobicContact CG1-CG1 3.87Å; V2219-V2226 WeakPolarHBondContact O-CA 3.24Å; V2226-T2264 WeakPolarHBondContact O-CA 3.34Å; V2226-T2264 PolarHBondContact O-OG1 2.86Å; V2226-T2264 VanDerWaalsContact O-OG1 3.13Å; V2226-S2265 PolarHBondContact N-O 3.04Å; V2226-S2265 PolarHBondContact O-N 3.15Å; V2226-W2266 PolarHBondContact N-O 3.19Å; V2226-T2283 HydrophobicContact CG2-CG2 3.99Å; V2226-Y2305 HydrophobicContact CG1-CE2 3.91Å
2227	R	88.8	Confident	81	Confident	36.75 Å²	36.75	26.2 Å²	26.2	14%	0.139	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	145.2	178.1	-59.3	-176.5	-177.8	143.5	2.7	110.9	D2196 I2218 V2219 W2221 Y2229 Y2263 T2264	D2196-R2227 IonicContact OD2-CZ 3.59Å; D2196-R2227 IonicContact OD2-NH1 2.66Å; D2196-R2227 PolarHBondContact OD2-NH1 2.89Å; D2196-R2227 IonicContact OD2-NH2 2.71Å; D2196-R2227 PolarHBondContact OD2-NH2 3.19Å; I2218-R2227 WeakPolarHBondContact CA-O 3.31Å; V2219-R2227 PolarHBondContact N-O 3.3Å; V2219-R2227 PolarHBondContact O-N 3.22Å; W2221-R2227 HydrophobicContact CE3-CG 4.34Å; W2221-R2227 HydrophobicContact CH2-CB 3.64Å; W2221-R2227 VanDerWaalsContact CH2-CD 3.45Å; W2221-R2227 HydrophobicContact CH2-CG 3.64Å; W2221-R2227 HydrophobicContact CZ3-CB 3.5Å; W2221-R2227 VanDerWaalsContact CZ3-CB 3.47Å; W2221-R2227 HydrophobicContact CZ3-CG 3.39Å; R2227-Y2229 HydrophobicContact CB-CD2 4.47Å; R2227-Y2229 HydrophobicContact CB-CE2 3.81Å; R2227-Y2229 WeakPolarHBondContact CD-OH 3.43Å; R2227-Y2263 VanDerWaalsContact CA-O 3.29Å; R2227-Y2263 WeakPolarHBondContact CA-O 3.31Å; R2227-T2264 HydrophobicContact CG-CG2 3.85Å; R2227-T2264 WeakPolarHBondContact CG-OG1 3.37Å
2228	L	90.1	Very high	78.8	Confident	0.75 Å²	0.75	34.5 Å²	34.5	0%	0.004	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	135.4	176.5	-59.6	160.3	0	0	0	109.5	L2216 V2217 I2218 L2262 Y2263 T2264 A2293 Y2305 V2307 V2316	L2216-L2228 HydrophobicContact CD1-CD2 4.17Å; V2217-L2228 CarbonylContact O-C 3.54Å; V2217-L2228 WeakPolarHBondContact O-CA 3.35Å; I2218-L2228 HydrophobicContact CB-CD2 3.73Å; I2218-L2228 HydrophobicContact CB-CG 4.43Å; I2218-L2228 HydrophobicContact CD1-CD2 3.91Å; I2218-L2228 HydrophobicContact CG1-CD2 3.76Å; I2218-L2228 HydrophobicContact CG1-CG 4.43Å; L2228-L2262 HydrophobicContact CB-CB 4.16Å; L2228-L2262 HydrophobicContact CB-CD1 4.02Å; L2228-L2262 HydrophobicContact CB-CG 4.44Å; L2228-L2262 PolarHBondContact O-N 3.09Å; L2228-Y2263 HydrophobicContact CD1-CD1 4.48Å; L2228-Y2263 PolarHBondContact N-O 3.38Å; L2228-Y2263 PolarHBondContact O-N 2.9Å; L2228-T2264 HydrophobicContact CD1-CG2 3.71Å; L2228-A2293 HydrophobicContact CD1-CB 4.47Å; L2228-A2293 HydrophobicContact CD2-CB 3.52Å; L2228-A2293 VanDerWaalsContact CD2-CB 3.48Å; L2228-Y2305 HydrophobicContact CD1-CD2 4.27Å; L2228-Y2305 HydrophobicContact CD1-CG 4.28Å; L2228-V2307 HydrophobicContact CD1-CG2 3.82Å; L2228-V2307 HydrophobicContact CD2-CG2 3.97Å; L2228-V2316 HydrophobicContact CD1-CG1 4.3Å
2229	Y	88.1	Confident	76.4	Confident	12.5 Å²	12.5	39.8 Å²	39.8	5%	0.049	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	149.1	177.6	-60	-87.6	0	0	0	110.8	F2173 V2217 V2219 W2221 R2227 F2231 I2259 V2260 P2261	F2173-Y2229 HydrophobicContact CE1-CE2 4.3Å; V2217-Y2229 PolarHBondContact N-O 3.03Å; V2217-Y2229 PolarHBondContact O-N 3.24Å; V2219-Y2229 HydrophobicContact CB-CE2 4.32Å; V2219-Y2229 HydrophobicContact CG2-CD2 4.06Å; V2219-Y2229 HydrophobicContact CG2-CE2 3.97Å; W2221-Y2229 HydrophobicContact CH2-CE2 4.17Å; R2227-Y2229 HydrophobicContact CB-CD2 4.47Å; R2227-Y2229 HydrophobicContact CB-CE2 3.81Å; R2227-Y2229 WeakPolarHBondContact CD-OH 3.43Å; Y2229-F2231 VanDerWaalsContact CB-CE2 3.45Å; Y2229-F2231 HydrophobicContact CD1-CE1 4.32Å; Y2229-F2231 HydrophobicContact CD2-CE1 4.46Å; Y2229-F2231 AromaticContact CG-CE1 3.86Å; Y2229-F2231 HydrophobicContact CG-CE1 3.86Å; Y2229-F2231 HydrophobicContact CG-CE2 4.2Å; Y2229-F2231 HydrophobicContact CG-CZ 4.41Å; Y2229-I2259 HydrophobicContact CD1-CG2 4.02Å; Y2229-V2260 WeakPolarHBondContact CA-O 3.34Å; Y2229-P2261 HydrophobicContact CD1-CB 4.06Å; Y2229-P2261 HydrophobicContact CE1-CB 4.01Å
2230	H	86.3	Confident	74	Confident	6.5 Å²	6.5	48.7 Å²	48.7	3%	0.03	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	122.4	164.5	-166.9	-94	0	0	0	109.9	S2208 Y2210 Y2211 A2214 N2215 I2259 V2260 L2262 L2311	S2208-H2230 PolarHBondContact OG-CD2 3.25Å; S2208-H2230 PolarHBondContact OG-CE1 2.75Å; S2208-H2230 PolarHBondContact OG-ND1 2.61Å; S2208-H2230 VanDerWaalsContact OG-ND1 3.1Å; S2208-H2230 PolarHBondContact OG-NE2 3.27Å; Y2210-H2230 HydrophobicContact CD2-CB 4.5Å; Y2210-H2230 AromaticContact CD2-CD2 3.61Å; Y2210-H2230 AromaticContact CD2-CE1 3.83Å; Y2210-H2230 AromaticContact CD2-NE2 3.72Å; Y2210-H2230 VanDerWaalsContact CD2-NE2 3.28Å; Y2210-H2230 WeakPolarHBondContact CD2-NE2 3.41Å; Y2210-H2230 AromaticContact CE2-CD2 3.51Å; Y2210-H2230 AromaticContact CE2-NE2 3.26Å; Y2210-H2230 VanDerWaalsContact CE2-NE2 3.26Å; Y2210-H2230 WeakPolarHBondContact CE2-NE2 3.42Å; Y2211-H2230 AromaticContact CD2-CE1 3.86Å; Y2211-H2230 AromaticContact CD2-NE2 3.88Å; A2214-H2230 WeakPolarHBondContact CB-NE2 3.31Å; N2215-H2230 WeakPolarHBondContact O-CA 3.26Å; N2215-H2230 PolarHBondContact O-ND1 3.42Å; H2230-I2259 CarbonylContact O-C 3.6Å; H2230-I2259 VanDerWaalsContact O-CA 3.26Å; H2230-I2259 WeakPolarHBondContact O-CA 3.37Å; H2230-V2260 HydrophobicContact CB-CB 4.29Å; H2230-V2260 PolarHBondContact N-O 3.21Å; H2230-V2260 PolarHBondContact O-N 3.06Å; H2230-L2262 HydrophobicContact CB-CD1 4.08Å; H2230-L2262 HydrophobicContact CB-CD2 4.04Å; H2230-L2262 HydrophobicContact CB-CG 4.14Å; H2230-L2311 HydrophobicContact CB-CD1 4.3Å
2231	F	85.2	Confident	71.6	Confident	0.75 Å²	0.75	59.5 Å²	59.5	0%	0.003	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	126.3	176.9	-68.6	-20.2	0	0	0	109.9	I2165 F2173 I2175 F2185 A2214 N2215 V2217 Y2229 V2257 S2258 I2259	I2165-F2231 HydrophobicContact CD1-CD2 3.83Å; I2165-F2231 HydrophobicContact CD1-CE2 3.65Å; I2165-F2231 HydrophobicContact CG1-CE2 4.21Å; F2173-F2231 HydrophobicContact CD2-CZ 4.48Å; F2173-F2231 HydrophobicContact CE2-CE1 4.34Å; F2173-F2231 HydrophobicContact CE2-CE2 4.24Å; F2173-F2231 AromaticContact CE2-CZ 3.58Å; F2173-F2231 HydrophobicContact CE2-CZ 3.58Å; F2173-F2231 HydrophobicContact CZ-CE1 4.46Å; F2173-F2231 AromaticContact CZ-CZ 3.85Å; F2173-F2231 HydrophobicContact CZ-CZ 3.85Å; I2175-F2231 HydrophobicContact CD1-CD1 3.43Å; I2175-F2231 VanDerWaalsContact CD1-CD1 3.43Å; I2175-F2231 HydrophobicContact CD1-CD2 4Å; I2175-F2231 HydrophobicContact CD1-CE1 3.41Å; I2175-F2231 VanDerWaalsContact CD1-CE1 3.41Å; I2175-F2231 HydrophobicContact CD1-CE2 3.82Å; I2175-F2231 HydrophobicContact CD1-CG 4.18Å; I2175-F2231 HydrophobicContact CD1-CZ 4.35Å; I2175-F2231 HydrophobicContact CG1-CE2 4.48Å; F2185-F2231 HydrophobicContact CD1-CE1 4.46Å; A2214-F2231 CarbonylContact C-O 3.52Å; A2214-F2231 WeakPolarHBondContact CA-O 3.24Å; A2214-F2231 WeakPolarHBondContact CB-O 3.29Å; N2215-F2231 HydrophobicContact CB-CB 4.4Å; N2215-F2231 PolarHBondContact N-O 2.84Å; N2215-F2231 PolarHBondContact O-N 3.23Å; V2217-F2231 HydrophobicContact CB-CD2 4.12Å; V2217-F2231 HydrophobicContact CB-CE2 3.95Å; V2217-F2231 HydrophobicContact CB-CZ 4.25Å; V2217-F2231 HydrophobicContact CG1-CE2 4.04Å; V2217-F2231 HydrophobicContact CG1-CZ 4.26Å; V2217-F2231 HydrophobicContact CG2-CB 4.4Å; V2217-F2231 HydrophobicContact CG2-CD1 4.36Å; V2217-F2231 HydrophobicContact CG2-CD2 3.47Å; V2217-F2231 VanDerWaalsContact CG2-CD2 3.44Å; V2217-F2231 HydrophobicContact CG2-CE2 3.72Å; V2217-F2231 HydrophobicContact CG2-CG 4.06Å; V2217-F2231 HydrophobicContact CG2-CZ 4.33Å; Y2229-F2231 VanDerWaalsContact CB-CE2 3.45Å; Y2229-F2231 HydrophobicContact CD1-CE1 4.32Å; Y2229-F2231 HydrophobicContact CD2-CE1 4.46Å; Y2229-F2231 AromaticContact CG-CE1 3.86Å; Y2229-F2231 HydrophobicContact CG-CE1 3.86Å; Y2229-F2231 HydrophobicContact CG-CE2 4.2Å; Y2229-F2231 HydrophobicContact CG-CZ 4.41Å; F2231-V2257 HydrophobicContact CD1-CG1 4.35Å; F2231-S2258 WeakPolarHBondContact CA-O 3.13Å; F2231-I2259 HydrophobicContact CD1-CB 4.12Å; F2231-I2259 HydrophobicContact CD1-CD1 4.31Å; F2231-I2259 HydrophobicContact CD1-CG1 3.65Å; F2231-I2259 HydrophobicContact CD1-CG2 3.96Å; F2231-I2259 HydrophobicContact CE1-CB 4.21Å; F2231-I2259 HydrophobicContact CE1-CD1 4.02Å; F2231-I2259 VanDerWaalsContact CE1-CD1 3.48Å; F2231-I2259 HydrophobicContact CE1-CG1 3.72Å; F2231-I2259 HydrophobicContact CE1-CG2 3.58Å; F2231-I2259 VanDerWaalsContact CE1-CG2 3.48Å; F2231-I2259 HydrophobicContact CG-CG1 4.34Å; F2231-I2259 HydrophobicContact CZ-CD1 4.45Å; F2231-I2259 HydrophobicContact CZ-CG1 4.42Å; F2231-I2259 HydrophobicContact CZ-CG2 4.07Å
2232	S	81.7	Confident	69.4	Low	16.75 Å²	16.75	66.3 Å²	66.3	12%	0.117	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	140.6	168.3	67.8	0	0	0	0	111.3	S2258	S2232-S2258 PolarHBondContact N-O 3.17Å; S2232-S2258 PolarHBondContact O-N 3.1Å; S2232-S2258 PolarHBondContact O-OG 3.02Å; S2232-S2258 PolarHBondContact OG-OG 3.02Å
2233	F	78	Confident	67.2	Low	37.5 Å²	37.5	71.9 Å²	71.9	16%	0.164	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	117.1	-178.7	-59.2	-82.5	0	0	0	108.6	D2158 H2163 I2175 I2184 V2257	D2158-F2233 HydrophobicContact CB-CE2 4.45Å; D2158-F2233 VanDerWaalsContact OD2-CE2 3.22Å; D2158-F2233 WeakPolarHBondContact OD2-CE2 3.24Å; H2163-F2233 HydrophobicContact CB-CE1 4.47Å; H2163-F2233 HydrophobicContact CB-CZ 4.12Å; H2163-F2233 AromaticContact CD2-CZ 3.88Å; H2163-F2233 AromaticContact CE1-CD1 3.66Å; H2163-F2233 AromaticContact CE1-CD2 3.89Å; H2163-F2233 AromaticContact CE1-CE1 3.92Å; H2163-F2233 AromaticContact CE1-CE2 3.5Å; H2163-F2233 AromaticContact CE1-CG 3.65Å; H2163-F2233 AromaticContact CE1-CZ 3.51Å; H2163-F2233 AromaticContact CG-CE1 3.88Å; H2163-F2233 AromaticContact CG-CZ 3.72Å; H2163-F2233 AromaticContact ND1-CD1 3.92Å; H2163-F2233 AromaticContact ND1-CD2 3.75Å; H2163-F2233 AromaticContact ND1-CE1 3.82Å; H2163-F2233 AromaticContact ND1-CE2 3.53Å; H2163-F2233 WeakPolarHBondContact ND1-CE2 3.17Å; H2163-F2233 AromaticContact ND1-CG 3.92Å; H2163-F2233 AromaticContact ND1-CZ 3.55Å; H2163-F2233 WeakPolarHBondContact ND1-CZ 3.37Å; H2163-F2233 AromaticContact NE2-CD1 3.92Å; H2163-F2233 AromaticContact NE2-CE1 3.84Å; H2163-F2233 AromaticContact NE2-CZ 3.83Å; I2175-F2233 HydrophobicContact CG2-CE1 4.17Å; I2175-F2233 HydrophobicContact CG2-CZ 4.26Å; I2184-F2233 HydrophobicContact CD1-CE1 4.13Å; F2233-V2257 HydrophobicContact CD1-CG1 4.37Å; F2233-V2257 HydrophobicContact CD1-CG2 3.92Å; F2233-V2257 HydrophobicContact CE1-CG1 4.16Å; F2233-V2257 HydrophobicContact CE1-CG2 4.01Å
2234	K	66.2	Low	65.1	Low	128.5 Å²	128.5	79.6 Å²	79.6	56%	0.559	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.8	131.9	175.9	-68.7	-174	-179.8	-177.6	0	110.1	G2236 C2255 D2256	K2234-G2236 PolarHBondContact O-N 2.99Å; K2234-C2255 CarbonylContact O-C 3.53Å; K2234-C2255 VanDerWaalsContact O-CA 3.28Å; K2234-C2255 WeakPolarHBondContact O-CA 3.28Å; K2234-D2256 PolarHBondContact N-O 2.89Å; K2234-D2256 PolarHBondContact O-N 2.99Å
2235	P	54.6	Low	63	Low	97.75 Å²	97.75	83.7 Å²	83.7	64%	0.635	44%	0.436	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.5	126.9	170.1	25.8	-30.9	0	0	0	109.2	T2237	P2235-T2237 PolarHBondContact O-N 2.84Å
2236	G	49.3	Very low	60.7	Low	27.75 Å²	27.75	90.9 Å²	90.9	29%	0.286	48%	0.479	S	S	.	.			trans	-67.4	100.7	-178.5	0	0	0	0	0	111.4	K2234 K2238 I2254	K2234-G2236 PolarHBondContact O-N 2.99Å; G2236-K2238 PolarHBondContact O-N 3.21Å; G2236-K2238 VanDerWaalsContact O-N 3.09Å; G2236-I2254 VanDerWaalsContact CA-O 3.3Å; G2236-I2254 WeakPolarHBondContact CA-O 3.23Å; G2236-I2254 PolarHBondContact N-O 3.16Å; G2236-I2254 VanDerWaalsContact N-O 3.14Å
2237	T	43.7	Very low	58.3	Low	132.25 Å²	132.25	95.8 Å²	95.8	81%	0.811	51%	0.509	S	S	*	.			trans	-76.2	98.3	171.7	48.7	0	0	0	0	109.2	P2235 S2239	P2235-T2237 PolarHBondContact O-N 2.84Å; T2237-S2239 PolarHBondContact O-N 3.13Å; T2237-S2239 VanDerWaalsContact O-N 3.08Å
2238	K	42.7	Very low	55.9	Low	175 Å²	175	102.6 Å²	102.6	76%	0.761	54%	0.543	S	S	*	.			trans	-63	109.8	166.9	-75.5	-175.4	179.1	175.3	0	108.3	G2236 K2240	G2236-K2238 PolarHBondContact O-N 3.21Å; G2236-K2238 VanDerWaalsContact O-N 3.09Å; K2238-K2240 PolarHBondContact O-N 3.26Å
2239	S	41.3	Very low	53.4	Low	110.75 Å²	110.75	106.9 Å²	106.9	77%	0.774	57%	0.573	S	S	*	*			trans	-68	103.5	174.6	65.7	0	0	0	0	109.8	T2237 R2241	T2237-S2239 PolarHBondContact O-N 3.13Å; T2237-S2239 VanDerWaalsContact O-N 3.08Å; S2239-R2241 PolarHBondContact O-N 3.14Å; S2239-R2241 VanDerWaalsContact O-N 3.14Å
2240	K	41.1	Very low	51	Low	188.25 Å²	188.25	113.3 Å²	113.3	82%	0.818	61%	0.608	S	S	*	*			trans	-81.9	103.6	158.3	-91.4	178.3	174.5	179	0	109.3	K2238 D2242	K2238-K2240 PolarHBondContact O-N 3.26Å; K2240-D2242 PolarHBondContact O-N 2.85Å
2241	R	40.3	Very low	48.9	Very low	225.75 Å²	225.75	119.6 Å²	119.6	85%	0.852	64%	0.641	S	S	*	*			trans	-76.5	112.8	143.6	-73.6	-176.2	177.3	178	-1.1	108.5	S2239	S2239-R2241 PolarHBondContact O-N 3.14Å; S2239-R2241 VanDerWaalsContact O-N 3.14Å
2242	D	43.6	Very low	46.9	Very low	150.25 Å²	150.25	128.3 Å²	128.3	80%	0.803	68%	0.681	S	S	*	*			trans	163.5	125.5	139.6	-74.9	-17.5	0	0	0	110.1	K2240	K2240-D2242 PolarHBondContact O-N 2.85Å
2243	D	41.7	Very low	45.1	Very low	150 Å²	150	131.3 Å²	131.3	80%	0.802	70%	0.702	S	S	*	*			trans	-50.4	141.2	-178.4	-61.4	-40	0	0	0	115.8	S2245	D2243-S2245 PolarHBondContact O-N 3Å
2244	N	42.2	Very low	43.8	Very low	170.25 Å²	170.25	134.2 Å²	134.2	91%	0.91	72%	0.718	S	S	*	*			trans	66.7	43.8	153	-66	-15.1	0	0	0	120.3
2245	S	41.3	Very low	43.2	Very low	86.25 Å²	86.25	130.8 Å²	130.8	60%	0.603	71%	0.711	S	S	*	*			trans	-131.4	122	152.4	64	0	0	0	0	111.4	D2243 V2247	D2243-S2245 PolarHBondContact O-N 3Å; S2245-V2247 WeakPolarHBondContact O-CG2 3.5Å; S2245-V2247 PolarHBondContact O-N 3.22Å; S2245-V2247 WeakPolarHBondContact OG-CG2 3.43Å
2246	T	38.4	Very low	43.6	Very low	152 Å²	152	131.3 Å²	131.3	93%	0.933	71%	0.707	S	S	*	*			trans	-68.7	74.8	170.4	46.4	0	0	0	0	109.4	Q2248	T2246-Q2248 PolarHBondContact O-N 3Å
2247	V	40.5	Very low	44.8	Very low	105.75 Å²	105.75	131.6 Å²	131.6	64%	0.641	70%	0.704	S	S	*	*			trans	-88.8	112.2	174.4	179.6	0	0	0	0	107.5	S2245 S2249	S2245-V2247 WeakPolarHBondContact O-CG2 3.5Å; S2245-V2247 PolarHBondContact O-N 3.22Å; S2245-V2247 WeakPolarHBondContact OG-CG2 3.43Å; V2247-S2249 PolarHBondContact O-N 3.01Å
2248	Q	37.6	Very low	46.5	Very low	179.25 Å²	179.25	127.3 Å²	127.3	84%	0.838	68%	0.679	S	S	*	*			trans	-49.9	123.4	166.4	-95.2	166.9	-38.2	0	0	108.6	T2246 D2250	T2246-Q2248 PolarHBondContact O-N 3Å; Q2248-D2250 PolarHBondContact O-N 3.02Å
2249	S	38.3	Very low	48.3	Very low	91.5 Å²	91.5	120.3 Å²	120.3	64%	0.64	65%	0.65	S	S	*	*			trans	-66.1	105.1	177.4	49.8	0	0	0	0	109.7	V2247 L2251	V2247-S2249 PolarHBondContact O-N 3.01Å; S2249-L2251 VanDerWaalsContact C-N 3.28Å; S2249-L2251 PolarHBondContact O-N 3.21Å; S2249-L2251 VanDerWaalsContact O-N 3.12Å; S2249-L2251 WeakPolarHBondContact OG-CD1 3.3Å
2250	D	37.6	Very low	50.2	Low	146.75 Å²	146.75	117.9 Å²	117.9	79%	0.785	63%	0.63	S	S	*	*			trans	-60.7	95.1	166.1	-74.1	-36.3	0	0	0	109.1	Q2248 H2252 S2253	Q2248-D2250 PolarHBondContact O-N 3.02Å; D2250-H2252 PolarHBondContact O-N 3.21Å; D2250-H2252 VanDerWaalsContact O-N 3.12Å; D2250-S2253 PolarHBondContact O-N 2.79Å; D2250-S2253 PolarHBondContact O-OG 2.99Å; D2250-S2253 VanDerWaalsContact O-OG 3.09Å
2251	L	41.5	Very low	52.1	Low	139 Å²	139	112.3 Å²	112.3	73%	0.728	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	6.4	-171.6	-99.3	127.7	0	0	0	114.8	S2249	S2249-L2251 VanDerWaalsContact C-N 3.28Å; S2249-L2251 PolarHBondContact O-N 3.21Å; S2249-L2251 VanDerWaalsContact O-N 3.12Å; S2249-L2251 WeakPolarHBondContact OG-CD1 3.3Å
2252	H	42.5	Very low	54.1	Low	183.5 Å²	183.5	102.3 Å²	102.3	85%	0.85	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.1	5.8	-166.9	-79.8	-55.2	0	0	0	116.8	D2250 I2254	D2250-H2252 PolarHBondContact O-N 3.21Å; D2250-H2252 VanDerWaalsContact O-N 3.12Å; H2252-I2254 PolarHBondContact O-N 2.9Å
2253	S	45.1	Very low	55.8	Low	79.75 Å²	79.75	100.2 Å²	100.2	56%	0.558	56%	0.558	S	S	*	*	S	Bend	trans	-116.2	58.9	-176.3	67	0	0	0	0	115.8	D2250 C2255	D2250-S2253 PolarHBondContact O-N 2.79Å; D2250-S2253 PolarHBondContact O-OG 2.99Å; D2250-S2253 VanDerWaalsContact O-OG 3.09Å; S2253-C2255 PolarHBondContact O-N 3.36Å
2254	I	49.6	Very low	57.7	Low	97.75 Å²	97.75	95.3 Å²	95.3	50%	0.501	53%	0.534	S	S	.	.			trans	-168	91.6	169.5	-48.6	171.3	0	0	0	111.9	G2236 H2252 D2256	G2236-I2254 VanDerWaalsContact CA-O 3.3Å; G2236-I2254 WeakPolarHBondContact CA-O 3.23Å; G2236-I2254 PolarHBondContact N-O 3.16Å; G2236-I2254 VanDerWaalsContact N-O 3.14Å; H2252-I2254 PolarHBondContact O-N 2.9Å; I2254-D2256 PolarHBondContact O-N 3.25Å
2255	C	55	Low	59.5	Low	58.25 Å²	58.25	88.5 Å²	88.5	39%	0.394	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	120.3	164.4	-68.7	0	0	0	0	109	K2234 S2253 V2257	K2234-C2255 CarbonylContact O-C 3.53Å; K2234-C2255 VanDerWaalsContact O-CA 3.28Å; K2234-C2255 WeakPolarHBondContact O-CA 3.28Å; S2253-C2255 PolarHBondContact O-N 3.36Å; C2255-V2257 PolarHBondContact O-N 2.87Å
2256	D	63	Low	61.6	Low	106.25 Å²	106.25	85.9 Å²	85.9	57%	0.568	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.1	117.5	167.5	-84.3	-27.5	0	0	0	108.6	K2234 I2254	K2234-D2256 PolarHBondContact N-O 2.89Å; K2234-D2256 PolarHBondContact O-N 2.99Å; I2254-D2256 PolarHBondContact O-N 3.25Å
2257	V	74	Confident	63.8	Low	35.75 Å²	35.75	78.7 Å²	78.7	22%	0.217	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	120.5	177.5	-176.3	0	0	0	0	109	I2175 I2184 F2185 F2231 F2233 C2255 I2259	I2175-V2257 HydrophobicContact CD1-CG1 4.31Å; I2184-V2257 HydrophobicContact CB-CG2 4.43Å; I2184-V2257 HydrophobicContact CG2-CG2 3.37Å; F2185-V2257 HydrophobicContact CB-CG1 4.49Å; F2231-V2257 HydrophobicContact CD1-CG1 4.35Å; F2233-V2257 HydrophobicContact CD1-CG1 4.37Å; F2233-V2257 HydrophobicContact CD1-CG2 3.92Å; F2233-V2257 HydrophobicContact CE1-CG1 4.16Å; F2233-V2257 HydrophobicContact CE1-CG2 4.01Å; C2255-V2257 PolarHBondContact O-N 2.87Å; V2257-I2259 HydrophobicContact CG1-CD1 4Å; V2257-I2259 HydrophobicContact CG1-CG1 3.86Å
2258	S	78.8	Confident	66.1	Low	40.5 Å²	40.5	73.7 Å²	73.7	28%	0.283	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	125.5	170.6	56.2	0	0	0	0	110.5	F2231 S2232	F2231-S2258 WeakPolarHBondContact CA-O 3.13Å; S2232-S2258 PolarHBondContact N-O 3.17Å; S2232-S2258 PolarHBondContact O-N 3.1Å; S2232-S2258 PolarHBondContact O-OG 3.02Å; S2232-S2258 PolarHBondContact OG-OG 3.02Å
2259	I	80.6	Confident	68.2	Low	29.25 Å²	29.25	65.2 Å²	65.2	15%	0.15	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	121.7	-178.3	-62.2	167.9	0	0	0	108.4	I2175 F2185 L2190 Y2229 H2230 F2231 V2257	I2175-I2259 HydrophobicContact CD1-CD1 4.29Å; F2185-I2259 HydrophobicContact CD1-CD1 3.5Å; F2185-I2259 VanDerWaalsContact CD1-CD1 3.44Å; F2185-I2259 HydrophobicContact CD2-CD1 3.87Å; F2185-I2259 HydrophobicContact CE1-CD1 3.24Å; F2185-I2259 HydrophobicContact CE2-CD1 3.63Å; F2185-I2259 HydrophobicContact CG-CD1 3.82Å; F2185-I2259 HydrophobicContact CZ-CD1 3.31Å; L2190-I2259 HydrophobicContact CD1-CD1 4.19Å; L2190-I2259 HydrophobicContact CD1-CG2 4.4Å; Y2229-I2259 HydrophobicContact CD1-CG2 4.02Å; H2230-I2259 CarbonylContact O-C 3.6Å; H2230-I2259 VanDerWaalsContact O-CA 3.26Å; H2230-I2259 WeakPolarHBondContact O-CA 3.37Å; F2231-I2259 HydrophobicContact CD1-CB 4.12Å; F2231-I2259 HydrophobicContact CD1-CD1 4.31Å; F2231-I2259 HydrophobicContact CD1-CG1 3.65Å; F2231-I2259 HydrophobicContact CD1-CG2 3.96Å; F2231-I2259 HydrophobicContact CE1-CB 4.21Å; F2231-I2259 HydrophobicContact CE1-CD1 4.02Å; F2231-I2259 VanDerWaalsContact CE1-CD1 3.48Å; F2231-I2259 HydrophobicContact CE1-CG1 3.72Å; F2231-I2259 HydrophobicContact CE1-CG2 3.58Å; F2231-I2259 VanDerWaalsContact CE1-CG2 3.48Å; F2231-I2259 HydrophobicContact CG-CG1 4.34Å; F2231-I2259 HydrophobicContact CZ-CD1 4.45Å; F2231-I2259 HydrophobicContact CZ-CG1 4.42Å; F2231-I2259 HydrophobicContact CZ-CG2 4.07Å; V2257-I2259 HydrophobicContact CG1-CD1 4Å; V2257-I2259 HydrophobicContact CG1-CG1 3.86Å
2260	V	81.2	Confident	70.1	Confident	59.5 Å²	59.5	64.5 Å²	64.5	36%	0.361	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	116	177.1	-177	0	0	0	0	109	Y2229 H2230 L2262 L2311	Y2229-V2260 WeakPolarHBondContact CA-O 3.34Å; H2230-V2260 HydrophobicContact CB-CB 4.29Å; H2230-V2260 PolarHBondContact N-O 3.21Å; H2230-V2260 PolarHBondContact O-N 3.06Å; V2260-L2262 HydrophobicContact CG1-CD2 4.41Å; V2260-L2262 PolarHBondContact O-N 3.07Å; V2260-L2311 HydrophobicContact CG1-CD1 4.33Å
2261	P	81	Confident	71.9	Confident	71.5 Å²	71.5	66 Å²	66	46%	0.464	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	128.7	172	29.1	-31.9	0	0	0	109.8	L2193 Y2229	L2193-P2261 HydrophobicContact CD2-CB 4.27Å; L2193-P2261 HydrophobicContact CD2-CG 3.95Å; Y2229-P2261 HydrophobicContact CD1-CB 4.06Å; Y2229-P2261 HydrophobicContact CE1-CB 4.01Å
2262	L	82.3	Confident	73.7	Confident	14.75 Å²	14.75	62.5 Å²	62.5	8%	0.077	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	-44.9	-179.9	-58.9	177.2	0	0	0	111.3	Y2210 L2216 L2228 H2230 V2260 T2264 V2307 L2311 P2314	Y2210-L2262 HydrophobicContact CE2-CD1 4.04Å; Y2210-L2262 HydrophobicContact CE2-CD2 4.02Å; L2216-L2262 HydrophobicContact CD1-CD1 3.84Å; L2228-L2262 HydrophobicContact CB-CB 4.16Å; L2228-L2262 HydrophobicContact CB-CD1 4.02Å; L2228-L2262 HydrophobicContact CB-CG 4.44Å; L2228-L2262 PolarHBondContact O-N 3.09Å; H2230-L2262 HydrophobicContact CB-CD1 4.08Å; H2230-L2262 HydrophobicContact CB-CD2 4.04Å; H2230-L2262 HydrophobicContact CB-CG 4.14Å; V2260-L2262 HydrophobicContact CG1-CD2 4.41Å; V2260-L2262 PolarHBondContact O-N 3.07Å; L2262-T2264 PolarHBondContact O-N 3.22Å; L2262-T2264 VanDerWaalsContact O-N 3.17Å; L2262-V2307 HydrophobicContact CD1-CG1 4.1Å; L2262-V2307 HydrophobicContact CD1-CG2 4.26Å; L2262-L2311 HydrophobicContact CD2-CD1 3.65Å; L2262-P2314 HydrophobicContact CB-CB 4.46Å; L2262-P2314 HydrophobicContact CB-CG 4.39Å; L2262-P2314 HydrophobicContact CD2-CB 4.05Å; L2262-P2314 HydrophobicContact CD2-CG 4.08Å
2263	Y	80.7	Confident	75.2	Confident	106.5 Å²	106.5	55.9 Å²	55.9	42%	0.418	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	140.2	-172.5	-169.5	-103.6	0	0	0	111.8	R2227 L2228 Y2305 V2316	R2227-Y2263 VanDerWaalsContact CA-O 3.29Å; R2227-Y2263 WeakPolarHBondContact CA-O 3.31Å; L2228-Y2263 HydrophobicContact CD1-CD1 4.48Å; L2228-Y2263 PolarHBondContact N-O 3.38Å; L2228-Y2263 PolarHBondContact O-N 2.9Å; Y2263-Y2305 HydrophobicContact CD1-CD1 4.32Å; Y2263-Y2305 HydrophobicContact CE1-CD1 4.04Å; Y2263-Y2305 HydrophobicContact CE1-CE1 4.18Å; Y2263-V2316 HydrophobicContact CD1-CB 4.31Å; Y2263-V2316 HydrophobicContact CD1-CG1 3.8Å; Y2263-V2316 HydrophobicContact CD2-CB 3.8Å; Y2263-V2316 HydrophobicContact CD2-CG1 4.19Å; Y2263-V2316 HydrophobicContact CD2-CG2 4.18Å; Y2263-V2316 HydrophobicContact CE1-CG1 4.08Å; Y2263-V2316 HydrophobicContact CE2-CB 4.23Å; Y2263-V2316 HydrophobicContact CE2-CG1 4.47Å; Y2263-V2316 HydrophobicContact CG-CB 3.86Å; Y2263-V2316 HydrophobicContact CG-CG1 3.86Å; Y2263-V2316 HydrophobicContact CG-CG2 4.01Å
2264	T	81.2	Confident	76.5	Confident	46.75 Å²	46.75	58.9 Å²	58.9	29%	0.287	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	131.9	175.2	-43.3	0	0	0	0	109.8	V2226 R2227 L2228 L2262 W2266 V2316	V2226-T2264 WeakPolarHBondContact O-CA 3.34Å; V2226-T2264 PolarHBondContact O-OG1 2.86Å; V2226-T2264 VanDerWaalsContact O-OG1 3.13Å; R2227-T2264 HydrophobicContact CG-CG2 3.85Å; R2227-T2264 WeakPolarHBondContact CG-OG1 3.37Å; L2228-T2264 HydrophobicContact CD1-CG2 3.71Å; L2262-T2264 PolarHBondContact O-N 3.22Å; L2262-T2264 VanDerWaalsContact O-N 3.17Å; T2264-W2266 HydrophobicContact CG2-CH2 4.09Å; T2264-W2266 HydrophobicContact CG2-CZ2 4.38Å; T2264-W2266 HydrophobicContact CG2-CZ3 4.21Å; T2264-V2316 HydrophobicContact CG2-CB 4.34Å; T2264-V2316 HydrophobicContact CG2-CG1 4.08Å; T2264-V2316 HydrophobicContact CG2-CG2 4.19Å
2265	S	80.5	Confident	77.3	Confident	27.5 Å²	27.5	58.9 Å²	58.9	19%	0.192	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	132.3	177.3	166.1	0	0	0	0	110.8	A2225 V2226 S2267 E2274	A2225-S2265 CarbonylContact C-O 3.22Å; A2225-S2265 WeakPolarHBondContact CA-O 3.34Å; V2226-S2265 PolarHBondContact N-O 3.04Å; V2226-S2265 PolarHBondContact O-N 3.15Å; S2265-S2267 VanDerWaalsContact C-N 3.33Å; S2265-S2267 WeakPolarHBondContact CB-OG 3.47Å; S2265-S2267 PolarHBondContact O-N 2.76Å; S2265-S2267 PolarHBondContact OG-OG 2.79Å; S2265-E2274 VanDerWaalsContact CB-OE1 3.3Å; S2265-E2274 WeakPolarHBondContact CB-OE1 3.38Å
2266	W	84.3	Confident	77.6	Confident	32.75 Å²	32.75	57 Å²	57	12%	0.124	31%	0.306	C	S	.	.			trans	-106.7	65.2	179.7	-68.7	100.5	0	0	0	111.3	I2194 D2196 G2224 A2225 V2226 T2264 H2268 S2269 H2272 E2274 N2275 G2276 W2303 Y2305 S2318	I2194-W2266 HydrophobicContact CD1-CH2 3.75Å; I2194-W2266 HydrophobicContact CD1-CZ2 3.56Å; D2196-W2266 VanDerWaalsContact OD2-CH2 3.3Å; D2196-W2266 WeakPolarHBondContact OD2-CH2 3.23Å; G2224-W2266 CarbonylContact O-C 3.52Å; A2225-W2266 HydrophobicContact CB-CD2 4.27Å; A2225-W2266 HydrophobicContact CB-CE3 4.21Å; A2225-W2266 HydrophobicContact CB-CH2 4.19Å; A2225-W2266 HydrophobicContact CB-CZ2 4.34Å; A2225-W2266 HydrophobicContact CB-CZ3 4.23Å; V2226-W2266 PolarHBondContact N-O 3.19Å; T2264-W2266 HydrophobicContact CG2-CH2 4.09Å; T2264-W2266 HydrophobicContact CG2-CZ2 4.38Å; T2264-W2266 HydrophobicContact CG2-CZ3 4.21Å; W2266-H2268 VanDerWaalsContact C-N 3.25Å; W2266-H2268 PolarHBondContact O-N 2.98Å; W2266-H2268 VanDerWaalsContact O-N 3.13Å; W2266-S2269 WeakPolarHBondContact CB-OG 3.45Å; W2266-S2269 PolarHBondContact O-N 3.03Å; W2266-S2269 VanDerWaalsContact O-N 3.17Å; W2266-S2269 PolarHBondContact O-OG 3.12Å; W2266-S2269 VanDerWaalsContact O-OG 3.11Å; W2266-H2272 WeakPolarHBondContact O-CA 3.39Å; W2266-H2272 PolarHBondContact O-ND1 2.93Å; W2266-E2274 HydrophobicContact CD2-CB 4.16Å; W2266-E2274 HydrophobicContact CD2-CG 4.19Å; W2266-E2274 HydrophobicContact CE3-CB 4.13Å; W2266-E2274 HydrophobicContact CE3-CG 3.66Å; W2266-E2274 HydrophobicContact CG-CG 4.49Å; W2266-E2274 HydrophobicContact CH2-CB 4.12Å; W2266-E2274 HydrophobicContact CH2-CG 4.02Å; W2266-E2274 HydrophobicContact CZ2-CB 4.16Å; W2266-E2274 HydrophobicContact CZ3-CB 4.11Å; W2266-E2274 HydrophobicContact CZ3-CG 3.57Å; W2266-E2274 WeakPolarHBondContact CZ3-OE1 3.43Å; W2266-N2275 VanDerWaalsContact CE2-N 3.31Å; W2266-N2275 VanDerWaalsContact CE3-N 3.26Å; W2266-N2275 HydrophobicContact CH2-CB 4.21Å; W2266-N2275 VanDerWaalsContact CH2-OD1 3.27Å; W2266-N2275 WeakPolarHBondContact CH2-OD1 3.4Å; W2266-N2275 HydrophobicContact CZ2-CB 4.45Å; W2266-N2275 VanDerWaalsContact CZ2-N 3.31Å; W2266-N2275 WeakPolarHBondContact CZ2-OD1 3.46Å; W2266-N2275 VanDerWaalsContact CZ3-C 3.49Å; W2266-N2275 VanDerWaalsContact CZ3-CA 3.41Å; W2266-N2275 VanDerWaalsContact NE1-N 3.1Å; W2266-N2275 PolarHBondContact NE1-OD1 2.99Å; W2266-G2276 VanDerWaalsContact CZ3-N 3.28Å; W2266-G2276 WeakPolarHBondContact CZ3-O 3.26Å; W2266-W2303 HydrophobicContact CD2-CE3 4.09Å; W2266-W2303 AromaticContact CD2-CH2 3.92Å; W2266-W2303 HydrophobicContact CD2-CH2 3.92Å; W2266-W2303 AromaticContact CD2-CZ3 3.53Å; W2266-W2303 HydrophobicContact CD2-CZ3 3.53Å; W2266-W2303 AromaticContact CE2-CZ3 3.85Å; W2266-W2303 HydrophobicContact CE3-CE3 4.32Å; W2266-W2303 AromaticContact CE3-CH2 3.31Å; W2266-W2303 HydrophobicContact CE3-CH2 3.31Å; W2266-W2303 HydrophobicContact CE3-CZ2 4.07Å; W2266-W2303 AromaticContact CE3-CZ3 3.46Å; W2266-W2303 HydrophobicContact CE3-CZ3 3.46Å; W2266-W2303 VanDerWaalsContact CE3-CZ3 3.46Å; W2266-W2303 HydrophobicContact CG-CE3 4.23Å; W2266-W2303 HydrophobicContact CG-CZ3 4.15Å; W2266-W2303 HydrophobicContact CH2-CH2 4.09Å; W2266-W2303 HydrophobicContact CH2-CZ3 4.05Å; W2266-W2303 HydrophobicContact CZ2-CZ3 4.11Å; W2266-W2303 AromaticContact CZ3-CH2 3.43Å; W2266-W2303 HydrophobicContact CZ3-CH2 3.43Å; W2266-W2303 VanDerWaalsContact CZ3-CH2 3.43Å; W2266-W2303 HydrophobicContact CZ3-CZ2 4.42Å; W2266-W2303 AromaticContact CZ3-CZ3 3.74Å; W2266-W2303 HydrophobicContact CZ3-CZ3 3.74Å; W2266-Y2305 HydrophobicContact CB-CE1 4.23Å; W2266-Y2305 AromaticContact CD1-CE1 3.51Å; W2266-Y2305 HydrophobicContact CG-CE1 4.03Å; W2266-S2318 VanDerWaalsContact CZ2-OG 3.24Å; W2266-S2318 WeakPolarHBondContact CZ2-OG 3.39Å
2267	S	85.3	Confident	78	Confident	0.5 Å²	0.5	56.8 Å²	56.8	0%	0.003	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-15.8	-170.4	-79.9	0	0	0	0	114.2	G2224 A2225 S2265 S2269 H2272 A2273 N2299 W2303 Y2305	G2224-S2267 CarbonylContact O-C 3.34Å; G2224-S2267 VanDerWaalsContact O-CA 3.25Å; G2224-S2267 WeakPolarHBondContact O-CA 2.99Å; G2224-S2267 PolarHBondContact O-N 3.02Å; G2224-S2267 PolarHBondContact O-OG 3.03Å; A2225-S2267 PolarHBondContact N-OG 2.98Å; S2265-S2267 VanDerWaalsContact C-N 3.33Å; S2265-S2267 WeakPolarHBondContact CB-OG 3.47Å; S2265-S2267 PolarHBondContact O-N 2.76Å; S2265-S2267 PolarHBondContact OG-OG 2.79Å; S2267-S2269 PolarHBondContact O-N 2.99Å; S2267-S2269 WeakPolarHBondContact OG-CB 3.15Å; S2267-S2269 PolarHBondContact OG-N 3.1Å; S2267-S2269 PolarHBondContact OG-OG 3.01Å; S2267-H2272 PolarHBondContact O-CE1 2.91Å; S2267-H2272 PolarHBondContact O-ND1 3.18Å; S2267-A2273 PolarHBondContact OG-O 2.95Å; S2267-N2299 PolarHBondContact O-ND2 3.1Å; S2267-N2299 VanDerWaalsContact O-ND2 3.15Å; S2267-W2303 PolarHBondContact O-NE1 3.15Å; S2267-W2303 VanDerWaalsContact O-NE1 3.15Å; S2267-Y2305 VanDerWaalsContact CB-OH 3.25Å; S2267-Y2305 WeakPolarHBondContact CB-OH 3.3Å; S2267-Y2305 PolarHBondContact OG-OH 3.14Å
2268	H	87.7	Confident	77.8	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.9	17.1	178.1	-57.2	-70.8	0	0	0	113.3	G2224 W2266 E2279 T2283 S2295 G2297 N2299 E2301 W2303	G2224-H2268 VanDerWaalsContact CA-C 3.48Å; G2224-H2268 PolarHBondContact O-N 2.93Å; W2266-H2268 VanDerWaalsContact C-N 3.25Å; W2266-H2268 PolarHBondContact O-N 2.98Å; W2266-H2268 VanDerWaalsContact O-N 3.13Å; H2268-E2279 PolarHBondContact O-N 3.1Å; H2268-E2279 VanDerWaalsContact O-N 3.13Å; H2268-T2283 PolarHBondContact CD2-OG1 3.19Å; H2268-T2283 VanDerWaalsContact CD2-OG1 3.32Å; H2268-S2295 WeakPolarHBondContact NE2-CB 3.2Å; H2268-S2295 PolarHBondContact NE2-OG 3.1Å; H2268-G2297 PolarHBondContact CE1-N 2.83Å; H2268-G2297 VanDerWaalsContact CE1-N 3.28Å; H2268-G2297 VanDerWaalsContact ND1-CA 3.28Å; H2268-G2297 WeakPolarHBondContact ND1-CA 3.35Å; H2268-G2297 PolarHBondContact ND1-N 3.24Å; H2268-N2299 WeakPolarHBondContact CA-ND2 3.27Å; H2268-N2299 PolarHBondContact ND1-OD1 3Å; H2268-N2299 VanDerWaalsContact ND1-OD1 3.09Å; H2268-N2299 WeakPolarHBondContact O-CB 3.48Å; H2268-E2301 PolarHBondContact CE1-O 2.95Å; H2268-E2301 VanDerWaalsContact CE1-O 3.23Å; H2268-W2303 AromaticContact CE1-CD1 3.53Å; H2268-W2303 VanDerWaalsContact CE1-CD1 3.43Å; H2268-W2303 AromaticContact ND1-CD1 3.82Å
2269	S	82.7	Confident	77.2	Confident	0.75 Å²	0.75	59.3 Å²	59.3	1%	0.005	32%	0.32	C	S	.	.	B	Isolated β-bridge	trans	-81	160.1	168.9	68.6	0	0	0	0	110.9	S2223 W2266 S2267 E2271 H2272 A2273	S2223-S2269 WeakPolarHBondContact O-CB 3.38Å; W2266-S2269 WeakPolarHBondContact CB-OG 3.45Å; W2266-S2269 PolarHBondContact O-N 3.03Å; W2266-S2269 VanDerWaalsContact O-N 3.17Å; W2266-S2269 PolarHBondContact O-OG 3.12Å; W2266-S2269 VanDerWaalsContact O-OG 3.11Å; S2267-S2269 PolarHBondContact O-N 2.99Å; S2267-S2269 WeakPolarHBondContact OG-CB 3.15Å; S2267-S2269 PolarHBondContact OG-N 3.1Å; S2267-S2269 PolarHBondContact OG-OG 3.01Å; S2269-E2271 PolarHBondContact O-N 2.9Å; S2269-H2272 PolarHBondContact O-N 2.9Å; S2269-H2272 VanDerWaalsContact OG-C 3.23Å; S2269-H2272 VanDerWaalsContact OG-CA 3.28Å; S2269-H2272 WeakPolarHBondContact OG-CA 3.35Å; S2269-A2273 WeakPolarHBondContact CB-O 3.24Å; S2269-A2273 PolarHBondContact OG-N 2.93Å; S2269-A2273 VanDerWaalsContact OG-N 3.11Å; S2269-A2273 PolarHBondContact OG-O 3.2Å; S2269-A2273 VanDerWaalsContact OG-O 3.11Å
2270	I	78.1	Confident	76.8	Confident	78 Å²	78	60 Å²	60	40%	0.4	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-57.9	128.4	172	-63.1	174.3	0	0	0	108.7	H2272 A2273 T2277 E2279 A2280	I2270-H2272 PolarHBondContact O-N 3Å; I2270-H2272 VanDerWaalsContact O-N 3.16Å; I2270-A2273 WeakPolarHBondContact O-CB 3.2Å; I2270-A2273 PolarHBondContact O-N 2.99Å; I2270-A2273 VanDerWaalsContact O-N 3.08Å; I2270-T2277 VanDerWaalsContact CD1-OG1 3.22Å; I2270-T2277 WeakPolarHBondContact CD1-OG1 3.32Å; I2270-T2277 WeakPolarHBondContact CG1-O 3.31Å; I2270-T2277 PolarHBondContact N-O 2.94Å; I2270-T2277 VanDerWaalsContact N-O 3.08Å; I2270-E2279 HydrophobicContact CD1-CB 3.88Å; I2270-E2279 HydrophobicContact CG1-CB 3.77Å; I2270-E2279 HydrophobicContact CG1-CG 4.16Å; I2270-A2280 HydrophobicContact CG1-CB 3.92Å
2271	E	75.9	Confident	76.6	Confident	176.5 Å²	176.5	58.6 Å²	58.6	83%	0.825	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	57	17.3	-177.1	-61.7	179.3	174.8	0	0	114.9	S2269 A2273	S2269-E2271 PolarHBondContact O-N 2.9Å; E2271-A2273 PolarHBondContact O-N 2.8Å; E2271-A2273 VanDerWaalsContact O-N 3.14Å
2272	H	79	Confident	76.9	Confident	67.5 Å²	67.5	55.2 Å²	55.2	31%	0.313	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	55.9	23.3	-173.1	-48.6	-58.7	0	0	0	114.2	W2266 S2267 S2269 I2270 E2274 E2301 W2303	W2266-H2272 WeakPolarHBondContact O-CA 3.39Å; W2266-H2272 PolarHBondContact O-ND1 2.93Å; S2267-H2272 PolarHBondContact O-CE1 2.91Å; S2267-H2272 PolarHBondContact O-ND1 3.18Å; S2269-H2272 PolarHBondContact O-N 2.9Å; S2269-H2272 VanDerWaalsContact OG-C 3.23Å; S2269-H2272 VanDerWaalsContact OG-CA 3.28Å; S2269-H2272 WeakPolarHBondContact OG-CA 3.35Å; I2270-H2272 PolarHBondContact O-N 3Å; I2270-H2272 VanDerWaalsContact O-N 3.16Å; H2272-E2274 PolarHBondContact O-N 3.06Å; H2272-E2301 IonicContact CE1-OE1 3.46Å; H2272-E2301 IonicContact CE1-OE2 3.25Å; H2272-E2301 PolarHBondContact CE1-OE2 2.92Å; H2272-E2301 IonicContact ND1-OE2 3.82Å; H2272-E2301 IonicContact NE2-OE1 3.79Å; H2272-E2301 IonicContact NE2-OE2 3.44Å; H2272-E2301 PolarHBondContact NE2-OE2 3.47Å; H2272-W2303 AromaticContact CE1-CZ2 3.84Å; H2272-W2303 AromaticContact NE2-CZ2 3.93Å
2273	A	74.2	Confident	77.3	Confident	43.5 Å²	43.5	54.5 Å²	54.5	36%	0.36	30%	0.302	S	S	.	.			trans	-64.7	131.7	179.2	0	0	0	0	0	110.8	S2267 S2269 I2270 E2271 N2275 G2276	S2267-A2273 PolarHBondContact OG-O 2.95Å; S2269-A2273 WeakPolarHBondContact CB-O 3.24Å; S2269-A2273 PolarHBondContact OG-N 2.93Å; S2269-A2273 VanDerWaalsContact OG-N 3.11Å; S2269-A2273 PolarHBondContact OG-O 3.2Å; S2269-A2273 VanDerWaalsContact OG-O 3.11Å; I2270-A2273 WeakPolarHBondContact O-CB 3.2Å; I2270-A2273 PolarHBondContact O-N 2.99Å; I2270-A2273 VanDerWaalsContact O-N 3.08Å; E2271-A2273 PolarHBondContact O-N 2.8Å; E2271-A2273 VanDerWaalsContact O-N 3.14Å; A2273-N2275 PolarHBondContact O-N 3Å; A2273-N2275 VanDerWaalsContact O-N 3.12Å; A2273-G2276 PolarHBondContact O-N 3.12Å; A2273-G2276 VanDerWaalsContact O-N 3.1Å
2274	E	71.7	Confident	77.7	Confident	143 Å²	143	51.9 Å²	51.9	67%	0.668	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	120.3	173.9	-62.4	-172.2	161.3	0	0	110.7	S2265 W2266 H2272 G2276	S2265-E2274 VanDerWaalsContact CB-OE1 3.3Å; S2265-E2274 WeakPolarHBondContact CB-OE1 3.38Å; W2266-E2274 HydrophobicContact CD2-CB 4.16Å; W2266-E2274 HydrophobicContact CD2-CG 4.19Å; W2266-E2274 HydrophobicContact CE3-CB 4.13Å; W2266-E2274 HydrophobicContact CE3-CG 3.66Å; W2266-E2274 HydrophobicContact CG-CG 4.49Å; W2266-E2274 HydrophobicContact CH2-CB 4.12Å; W2266-E2274 HydrophobicContact CH2-CG 4.02Å; W2266-E2274 HydrophobicContact CZ2-CB 4.16Å; W2266-E2274 HydrophobicContact CZ3-CB 4.11Å; W2266-E2274 HydrophobicContact CZ3-CG 3.57Å; W2266-E2274 WeakPolarHBondContact CZ3-OE1 3.43Å; H2272-E2274 PolarHBondContact O-N 3.06Å; E2274-G2276 PolarHBondContact O-N 3.18Å
2275	N	66.6	Low	78.2	Confident	98 Å²	98	50.3 Å²	50.3	52%	0.524	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.9	23.2	-176.4	-57	-29.1	0	0	0	113.9	I2194 W2266 A2273 T2277	I2194-N2275 VanDerWaalsContact CG2-OD1 3.25Å; I2194-N2275 WeakPolarHBondContact CG2-OD1 3.37Å; W2266-N2275 VanDerWaalsContact CE2-N 3.31Å; W2266-N2275 VanDerWaalsContact CE3-N 3.26Å; W2266-N2275 HydrophobicContact CH2-CB 4.21Å; W2266-N2275 VanDerWaalsContact CH2-OD1 3.27Å; W2266-N2275 WeakPolarHBondContact CH2-OD1 3.4Å; W2266-N2275 HydrophobicContact CZ2-CB 4.45Å; W2266-N2275 VanDerWaalsContact CZ2-N 3.31Å; W2266-N2275 WeakPolarHBondContact CZ2-OD1 3.46Å; W2266-N2275 VanDerWaalsContact CZ3-C 3.49Å; W2266-N2275 VanDerWaalsContact CZ3-CA 3.41Å; W2266-N2275 VanDerWaalsContact NE1-N 3.1Å; W2266-N2275 PolarHBondContact NE1-OD1 2.99Å; A2273-N2275 PolarHBondContact O-N 3Å; A2273-N2275 VanDerWaalsContact O-N 3.12Å; N2275-T2277 PolarHBondContact O-N 3.17Å
2276	G	61.7	Low	78.9	Confident	17.25 Å²	17.25	49.8 Å²	49.8	18%	0.178	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-67	158.3	173.2	0	0	0	0	0	112.6	W2266 A2273 E2274 G2278	W2266-G2276 VanDerWaalsContact CZ3-N 3.28Å; W2266-G2276 WeakPolarHBondContact CZ3-O 3.26Å; A2273-G2276 PolarHBondContact O-N 3.12Å; A2273-G2276 VanDerWaalsContact O-N 3.1Å; E2274-G2276 PolarHBondContact O-N 3.18Å; G2276-G2278 PolarHBondContact O-N 2.91Å
2277	T	70.9	Confident	79.3	Confident	102.5 Å²	102.5	48.7 Å²	48.7	63%	0.629	28%	0.281	S	S	*	.	P	Polyproline II helix	trans	-74.9	140.4	169.9	52	0	0	0	0	109.8	S2223 I2270 N2275 E2279	S2223-T2277 CarbonylContact O-C 3.55Å; I2270-T2277 VanDerWaalsContact CD1-OG1 3.22Å; I2270-T2277 WeakPolarHBondContact CD1-OG1 3.32Å; I2270-T2277 WeakPolarHBondContact CG1-O 3.31Å; I2270-T2277 PolarHBondContact N-O 2.94Å; I2270-T2277 VanDerWaalsContact N-O 3.08Å; N2275-T2277 PolarHBondContact O-N 3.17Å; T2277-E2279 PolarHBondContact O-N 3.17Å
2278	G	68.7	Low	79.5	Confident	24.75 Å²	24.75	49.3 Å²	49.3	26%	0.255	29%	0.286	S	S	.	.	B	Isolated β-bridge	trans	-66.5	108.1	-177.6	0	0	0	0	0	112.5	S2222 S2223 G2276 A2280 G2281	S2222-G2278 WeakPolarHBondContact O-CA 3.3Å; S2223-G2278 VanDerWaalsContact C-CA 3.44Å; S2223-G2278 VanDerWaalsContact O-CA 3.27Å; S2223-G2278 WeakPolarHBondContact O-CA 3.36Å; S2223-G2278 PolarHBondContact O-N 2.91Å; S2223-G2278 VanDerWaalsContact O-N 3.08Å; G2276-G2278 PolarHBondContact O-N 2.91Å; G2278-A2280 PolarHBondContact O-N 3.25Å; G2278-A2280 VanDerWaalsContact O-N 3.16Å; G2278-G2281 PolarHBondContact O-N 2.63Å
2279	E	68	Low	79.4	Confident	104.25 Å²	104.25	50 Å²	50	49%	0.487	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-69.7	116.7	179.2	-150.9	178.9	172.6	0	0	110.5	H2268 I2270 T2277 G2281 G2282 G2298 N2299	H2268-E2279 PolarHBondContact O-N 3.1Å; H2268-E2279 VanDerWaalsContact O-N 3.13Å; I2270-E2279 HydrophobicContact CD1-CB 3.88Å; I2270-E2279 HydrophobicContact CG1-CB 3.77Å; I2270-E2279 HydrophobicContact CG1-CG 4.16Å; T2277-E2279 PolarHBondContact O-N 3.17Å; E2279-G2281 PolarHBondContact O-N 3.09Å; E2279-G2282 PolarHBondContact O-N 3.11Å; E2279-G2282 VanDerWaalsContact O-N 3.13Å; E2279-G2298 CarbonylContact O-C 3.56Å; E2279-G2298 WeakPolarHBondContact O-CA 3.4Å; E2279-N2299 HydrophobicContact CB-CB 4.11Å; E2279-N2299 HydrophobicContact CG-CB 4.31Å; E2279-N2299 WeakPolarHBondContact OE2-CB 3.33Å
2280	A	72.1	Confident	79.1	Confident	45.25 Å²	45.25	53.3 Å²	53.3	37%	0.374	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	30	20	177	0	0	0	0	0	114.9	I2270 G2278 G2298 N2299 Q2327	I2270-A2280 HydrophobicContact CG1-CB 3.92Å; G2278-A2280 PolarHBondContact O-N 3.25Å; G2278-A2280 VanDerWaalsContact O-N 3.16Å; A2280-G2298 WeakPolarHBondContact CB-O 3.45Å; A2280-G2298 CarbonylContact O-C 3.51Å; A2280-G2298 WeakPolarHBondContact O-CA 3.24Å; A2280-N2299 HydrophobicContact CB-CB 4.03Å; A2280-Q2327 HydrophobicContact CB-CG 4.47Å; A2280-Q2327 PolarHBondContact O-NE2 3.32Å; A2280-Q2327 VanDerWaalsContact O-NE2 3.12Å
2281	G	76.6	Confident	79.3	Confident	29.5 Å²	29.5	53.9 Å²	53.9	30%	0.304	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	117.9	-13.5	177.2	0	0	0	0	0	115.5	Q2201 G2278 E2279 L2284	Q2201-G2281 VanDerWaalsContact CD-O 3.27Å; Q2201-G2281 PolarHBondContact NE2-O 3.16Å; Q2201-G2281 VanDerWaalsContact NE2-O 3.08Å; Q2201-G2281 PolarHBondContact OE1-O 3.04Å; G2278-G2281 PolarHBondContact O-N 2.63Å; E2279-G2281 PolarHBondContact O-N 3.09Å; G2281-L2284 WeakPolarHBondContact O-CD2 3.34Å
2282	G	87.5	Confident	79.9	Confident	0.5 Å²	0.5	45.5 Å²	45.5	1%	0.005	27%	0.269	C	S	.	.	S	Bend	trans	84	-145	-179.6	0	0	0	0	0	113.5	E2279 L2284 G2297 G2298	E2279-G2282 PolarHBondContact O-N 3.11Å; E2279-G2282 VanDerWaalsContact O-N 3.13Å; G2282-L2284 PolarHBondContact O-N 2.99Å; G2282-G2297 CarbonylContact O-C 3.53Å; G2282-G2297 WeakPolarHBondContact O-CA 3.36Å; G2282-G2298 PolarHBondContact O-N 2.98Å
2283	T	90.3	Very high	80.5	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	96.9	-177.8	-51.4	0	0	0	0	111.5	Q2201 A2202 W2221 G2224 A2225 V2226 H2268	Q2201-T2283 WeakPolarHBondContact CB-O 3.33Å; Q2201-T2283 VanDerWaalsContact OE1-C 3.32Å; Q2201-T2283 PolarHBondContact OE1-O 3.14Å; Q2201-T2283 VanDerWaalsContact OE1-O 3.05Å; A2202-T2283 HydrophobicContact CB-CG2 4.47Å; W2221-T2283 PolarHBondContact O-N 3.26Å; W2221-T2283 VanDerWaalsContact O-N 3.15Å; W2221-T2283 PolarHBondContact O-OG1 3.08Å; G2224-T2283 PolarHBondContact O-OG1 3.08Å; A2225-T2283 PolarHBondContact O-OG1 3.07Å; A2225-T2283 VanDerWaalsContact O-OG1 3.13Å; V2226-T2283 HydrophobicContact CG2-CG2 3.99Å; H2268-T2283 PolarHBondContact CD2-OG1 3.19Å; H2268-T2283 VanDerWaalsContact CD2-OG1 3.32Å
2284	L	89.8	Confident	81.5	Confident	51.75 Å²	51.75	40.2 Å²	40.2	27%	0.271	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	-30.2	-170.4	-61.8	177.5	0	0	0	114.2	G2281 G2282 G2296 Q2327 I2328 T2329	G2281-L2284 WeakPolarHBondContact O-CD2 3.34Å; G2282-L2284 PolarHBondContact O-N 2.99Å; L2284-G2296 PolarHBondContact N-O 3.2Å; L2284-Q2327 HydrophobicContact CD1-CB 3.9Å; L2284-I2328 WeakPolarHBondContact CB-O 3.35Å; L2284-T2329 HydrophobicContact CD1-CG2 4.42Å
2285	C	91.4	Very high	82.5	Confident	13 Å²	13	33.4 Å²	33.4	9%	0.088	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	152.9	-179.1	59.8	0	0	0	0	111.9	S2295 G2296 I2328 A2330 V2331	C2285-S2295 WeakPolarHBondContact O-CA 3.39Å; C2285-G2296 PolarHBondContact N-O 3Å; C2285-G2296 VanDerWaalsContact N-O 3.14Å; C2285-G2296 PolarHBondContact O-N 3.05Å; C2285-I2328 PolarHBondContact SG-O 2.88Å; C2285-A2330 VanDerWaalsContact SG-C 3.59Å; C2285-V2331 HydrophobicContact CB-CG1 4.08Å; C2285-V2331 VanDerWaalsContact SG-CG2 3.56Å
2286	A	93.5	Very high	83.8	Confident	16 Å²	16	28.7 Å²	28.7	13%	0.132	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	150.5	177	0	0	0	0	0	110.9	A2202 S2204 I2218 V2294 V2331	A2202-A2286 HydrophobicContact CB-CB 3.85Å; S2204-A2286 WeakPolarHBondContact CB-O 3.43Å; S2204-A2286 PolarHBondContact OG-O 3.12Å; I2218-A2286 HydrophobicContact CD1-CB 4.11Å; I2218-A2286 HydrophobicContact CG1-CB 4.12Å; I2218-A2286 HydrophobicContact CG2-CB 3.79Å; A2286-V2294 CarbonylContact C-O 3.58Å; A2286-V2294 VanDerWaalsContact CA-O 3.25Å; A2286-V2294 WeakPolarHBondContact CA-O 3.22Å; A2286-V2331 VanDerWaalsContact C-CG1 3.41Å
2287	A	92.7	Very high	85.3	Confident	9.25 Å²	9.25	27.9 Å²	27.9	8%	0.076	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	147.1	173.6	0	0	0	0	0	109.8	S2204 A2293 V2294 V2331 V2333	S2204-A2287 WeakPolarHBondContact OG-CA 3.38Å; A2287-A2293 CarbonylContact O-C 3.58Å; A2287-A2293 WeakPolarHBondContact O-CA 3.26Å; A2287-V2294 PolarHBondContact N-O 2.86Å; A2287-V2294 PolarHBondContact O-N 3.29Å; A2287-V2331 HydrophobicContact CB-CB 4.42Å; A2287-V2331 HydrophobicContact CB-CG1 3.81Å; A2287-V2331 HydrophobicContact CB-CG2 4.37Å; A2287-V2333 HydrophobicContact CB-CB 4.45Å; A2287-V2333 HydrophobicContact CB-CG2 3.85Å
2288	A	90	Very high	86.1	Confident	13.75 Å²	13.75	23.2 Å²	23.2	11%	0.114	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	147.6	175.2	0	0	0	0	0	110.8	S2204 I2218 I2292 A2293	S2204-A2288 PolarHBondContact OG-N 2.98Å; I2218-A2288 HydrophobicContact CG2-CB 4.02Å; A2288-I2292 WeakPolarHBondContact CA-O 3.28Å; A2288-A2293 HydrophobicContact CB-CB 4.47Å
2289	S	85.2	Confident	87.1	Confident	14 Å²	14	23.1 Å²	23.1	10%	0.098	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	178	168.5	86.7	0	0	0	0	108.8	F2291 I2292 V2333 Y2352	S2289-F2291 VanDerWaalsContact C-N 3.31Å; S2289-F2291 PolarHBondContact O-N 2.95Å; S2289-I2292 PolarHBondContact N-O 2.99Å; S2289-I2292 PolarHBondContact O-N 3.07Å; S2289-I2292 VanDerWaalsContact O-N 3.09Å; S2289-I2292 WeakPolarHBondContact OG-CG2 3.32Å; S2289-V2333 VanDerWaalsContact OG-CG1 3.26Å; S2289-V2333 WeakPolarHBondContact OG-CG1 3.31Å; S2289-Y2352 PolarHBondContact OG-OH 2.87Å
2290	D	78.2	Confident	88.2	Confident	70.75 Å²	70.75	19.8 Å²	19.8	38%	0.378	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-30.2	-53.2	-167.4	-47.5	-7.8	0	0	0	116.8	I2207 P2209	I2207-D2290 WeakPolarHBondContact CB-OD1 3.45Å; I2207-D2290 WeakPolarHBondContact CD1-OD1 3.25Å; I2207-D2290 CarbonylContact O-C 3.56Å; I2207-D2290 VanDerWaalsContact O-CA 3.28Å; I2207-D2290 WeakPolarHBondContact O-CA 3.29Å; I2207-D2290 VanDerWaalsContact O-O 3.04Å; P2209-D2290 VanDerWaalsContact CD-O 3.3Å; P2209-D2290 WeakPolarHBondContact CD-O 3.36Å
2291	F	81.9	Confident	89.2	Confident	90.25 Å²	90.25	18 Å²	18	40%	0.396	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.4	6.4	-176.2	-55.3	-83.9	0	0	0	113.5	P2209 S2289 V2307	P2209-F2291 HydrophobicContact CB-CD1 3.34Å; P2209-F2291 VanDerWaalsContact CB-CD1 3.49Å; P2209-F2291 HydrophobicContact CB-CE1 3.39Å; P2209-F2291 VanDerWaalsContact CB-CE1 3.42Å; P2209-F2291 HydrophobicContact CB-CG 4.29Å; P2209-F2291 HydrophobicContact CB-CZ 4.33Å; P2209-F2291 HydrophobicContact CG-CD1 4.4Å; S2289-F2291 VanDerWaalsContact C-N 3.31Å; S2289-F2291 PolarHBondContact O-N 2.95Å; F2291-V2307 PolarHBondContact O-N 3Å
2292	I	88.5	Confident	90	Very high	0.5 Å²	0.5	16.6 Å²	16.6	0%	0.003	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	135.8	-165.2	-163.3	172.3	0	0	0	111.2	A2288 S2289 V2294 V2304 Y2305 F2306 V2333 I2338 Y2352	A2288-I2292 WeakPolarHBondContact CA-O 3.28Å; S2289-I2292 PolarHBondContact N-O 2.99Å; S2289-I2292 PolarHBondContact O-N 3.07Å; S2289-I2292 VanDerWaalsContact O-N 3.09Å; S2289-I2292 WeakPolarHBondContact OG-CG2 3.32Å; I2292-V2294 HydrophobicContact CG1-CG2 4.4Å; I2292-V2304 HydrophobicContact CD1-CG1 3.51Å; I2292-V2304 VanDerWaalsContact CD1-CG1 3.48Å; I2292-V2304 HydrophobicContact CG1-CG1 3.69Å; I2292-Y2305 VanDerWaalsContact CA-O 3.31Å; I2292-Y2305 WeakPolarHBondContact CA-O 3.33Å; I2292-F2306 HydrophobicContact CD1-CD1 4.44Å; I2292-F2306 HydrophobicContact CD1-CE1 3.98Å; I2292-F2306 HydrophobicContact CD1-CZ 4.02Å; I2292-F2306 HydrophobicContact CG1-CE1 4.47Å; I2292-V2333 HydrophobicContact CG2-CG1 3.8Å; I2292-I2338 HydrophobicContact CD1-CD1 3.88Å; I2292-Y2352 HydrophobicContact CD1-CD1 3.97Å; I2292-Y2352 HydrophobicContact CD1-CD2 3.86Å; I2292-Y2352 HydrophobicContact CD1-CE1 4.08Å; I2292-Y2352 HydrophobicContact CD1-CE2 4.02Å; I2292-Y2352 HydrophobicContact CD1-CG 3.81Å; I2292-Y2352 HydrophobicContact CG2-CE1 4.3Å; I2292-Y2352 HydrophobicContact CG2-CE2 4.29Å
2293	A	91.3	Very high	90.3	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	147.2	168.8	0	0	0	0	0	109.1	I2218 L2228 A2287 A2288 Y2305	I2218-A2293 HydrophobicContact CB-CB 4.24Å; I2218-A2293 HydrophobicContact CD1-CB 3.8Å; I2218-A2293 HydrophobicContact CG1-CB 4.49Å; I2218-A2293 HydrophobicContact CG2-CB 4.47Å; L2228-A2293 HydrophobicContact CD1-CB 4.47Å; L2228-A2293 HydrophobicContact CD2-CB 3.52Å; L2228-A2293 VanDerWaalsContact CD2-CB 3.48Å; A2287-A2293 CarbonylContact O-C 3.58Å; A2287-A2293 WeakPolarHBondContact O-CA 3.26Å; A2288-A2293 HydrophobicContact CB-CB 4.47Å; A2293-Y2305 HydrophobicContact CB-CD2 4.3Å; A2293-Y2305 PolarHBondContact N-O 2.92Å; A2293-Y2305 WeakPolarHBondContact O-CD2 3.43Å; A2293-Y2305 PolarHBondContact O-N 3.27Å
2294	V	93.8	Very high	90.4	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	135.2	-178.2	-173.7	0	0	0	0	108.9	A2286 A2287 I2292 V2302 W2303 V2304 V2331 V2333 I2338	A2286-V2294 CarbonylContact C-O 3.58Å; A2286-V2294 VanDerWaalsContact CA-O 3.25Å; A2286-V2294 WeakPolarHBondContact CA-O 3.22Å; A2287-V2294 PolarHBondContact N-O 2.86Å; A2287-V2294 PolarHBondContact O-N 3.29Å; I2292-V2294 HydrophobicContact CG1-CG2 4.4Å; V2294-V2302 HydrophobicContact CG1-CG1 3.67Å; V2294-W2303 CarbonylContact C-O 3.53Å; V2294-W2303 VanDerWaalsContact CA-O 3.25Å; V2294-W2303 WeakPolarHBondContact CA-O 3.36Å; V2294-W2303 WeakPolarHBondContact CG1-O 3.25Å; V2294-V2304 HydrophobicContact CG1-CG2 4.15Å; V2294-V2304 HydrophobicContact CG2-CB 4.49Å; V2294-V2304 HydrophobicContact CG2-CG1 4.24Å; V2294-V2304 HydrophobicContact CG2-CG2 4.16Å; V2294-V2331 HydrophobicContact CB-CG1 3.77Å; V2294-V2331 HydrophobicContact CB-CG2 3.91Å; V2294-V2331 HydrophobicContact CG1-CG1 3.52Å; V2294-V2331 HydrophobicContact CG1-CG2 4Å; V2294-V2333 HydrophobicContact CB-CG2 4.09Å; V2294-V2333 HydrophobicContact CG2-CG2 3.57Å; V2294-I2338 HydrophobicContact CG1-CG2 4.11Å; V2294-I2338 HydrophobicContact CG2-CD1 3.94Å; V2294-I2338 HydrophobicContact CG2-CG1 4.24Å; V2294-I2338 HydrophobicContact CG2-CG2 4.16Å
2295	S	94.6	Very high	90.5	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	144.9	173.2	63.5	0	0	0	0	111.4	H2268 C2285 V2302 W2303 Y2305	H2268-S2295 WeakPolarHBondContact NE2-CB 3.2Å; H2268-S2295 PolarHBondContact NE2-OG 3.1Å; C2285-S2295 WeakPolarHBondContact O-CA 3.39Å; S2295-V2302 WeakPolarHBondContact O-CA 3.35Å; S2295-W2303 PolarHBondContact N-O 3.09Å; S2295-W2303 PolarHBondContact O-N 3.2Å; S2295-Y2305 WeakPolarHBondContact OG-CE2 3.37Å; S2295-Y2305 PolarHBondContact OG-OH 3.07Å; S2295-Y2305 VanDerWaalsContact OG-OH 3.06Å
2296	G	93.3	Very high	90.4	Very high	0.25 Å²	0.25	15.4 Å²	15.4	0%	0.003	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	134.4	174.5	0	0	0	0	0	110.3	L2284 C2285	L2284-G2296 PolarHBondContact N-O 3.2Å; C2285-G2296 PolarHBondContact N-O 3Å; C2285-G2296 VanDerWaalsContact N-O 3.14Å; C2285-G2296 PolarHBondContact O-N 3.05Å
2297	G	92	Very high	89.9	Confident	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	173.3	-174.4	0	0	0	0	0	115.2	H2268 G2282 N2299 C2300 E2301 I2328	H2268-G2297 PolarHBondContact CE1-N 2.83Å; H2268-G2297 VanDerWaalsContact CE1-N 3.28Å; H2268-G2297 VanDerWaalsContact ND1-CA 3.28Å; H2268-G2297 WeakPolarHBondContact ND1-CA 3.35Å; H2268-G2297 PolarHBondContact ND1-N 3.24Å; G2282-G2297 CarbonylContact O-C 3.53Å; G2282-G2297 WeakPolarHBondContact O-CA 3.36Å; G2297-N2299 VanDerWaalsContact C-N 3.26Å; G2297-N2299 PolarHBondContact O-N 3.15Å; G2297-C2300 PolarHBondContact O-N 2.89Å; G2297-E2301 PolarHBondContact N-O 2.9Å; G2297-I2328 PolarHBondContact O-N 3.19Å; G2297-I2328 VanDerWaalsContact O-N 3.12Å
2298	G	89.2	Confident	89.1	Confident	3.5 Å²	3.5	15.7 Å²	15.7	4%	0.036	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-23.3	172.4	0	0	0	0	0	113.6	E2279 A2280 G2282 C2300 Q2327	E2279-G2298 CarbonylContact O-C 3.56Å; E2279-G2298 WeakPolarHBondContact O-CA 3.4Å; A2280-G2298 WeakPolarHBondContact CB-O 3.45Å; A2280-G2298 CarbonylContact O-C 3.51Å; A2280-G2298 WeakPolarHBondContact O-CA 3.24Å; G2282-G2298 PolarHBondContact O-N 2.98Å; G2298-C2300 PolarHBondContact O-N 3.04Å; G2298-C2300 VanDerWaalsContact O-N 3.12Å; G2298-Q2327 WeakPolarHBondContact O-CG 3.5Å
2299	N	89.3	Confident	88.2	Confident	22.25 Å²	22.25	19.3 Å²	19.3	12%	0.119	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	9.8	175.2	67.1	-17.4	0	0	0	114.7	S2267 H2268 E2279 A2280 G2297 E2301	S2267-N2299 PolarHBondContact O-ND2 3.1Å; S2267-N2299 VanDerWaalsContact O-ND2 3.15Å; H2268-N2299 WeakPolarHBondContact CA-ND2 3.27Å; H2268-N2299 PolarHBondContact ND1-OD1 3Å; H2268-N2299 VanDerWaalsContact ND1-OD1 3.09Å; H2268-N2299 WeakPolarHBondContact O-CB 3.48Å; E2279-N2299 HydrophobicContact CB-CB 4.11Å; E2279-N2299 HydrophobicContact CG-CB 4.31Å; E2279-N2299 WeakPolarHBondContact OE2-CB 3.33Å; A2280-N2299 HydrophobicContact CB-CB 4.03Å; G2297-N2299 VanDerWaalsContact C-N 3.26Å; G2297-N2299 PolarHBondContact O-N 3.15Å; N2299-E2301 HydrophobicContact CB-CG 4.32Å; N2299-E2301 VanDerWaalsContact ND2-CD 3.25Å; N2299-E2301 WeakPolarHBondContact ND2-CG 3.22Å; N2299-E2301 PolarHBondContact ND2-OE2 3.29Å; N2299-E2301 WeakPolarHBondContact O-CG 3.25Å; N2299-E2301 PolarHBondContact O-N 2.85Å; N2299-E2301 WeakPolarHBondContact OD1-CB 3.49Å; N2299-E2301 PolarHBondContact OD1-N 2.97Å
2300	C	90.9	Very high	87.4	Confident	34.75 Å²	34.75	22.8 Å²	22.8	24%	0.235	13%	0.134	C	C	.	.	S	Bend	trans	65	16.1	-178.5	-47.5	0	0	0	0	114.4	G2297 G2298 S2326 I2328	G2297-C2300 PolarHBondContact O-N 2.89Å; G2298-C2300 PolarHBondContact O-N 3.04Å; G2298-C2300 VanDerWaalsContact O-N 3.12Å; C2300-S2326 WeakPolarHBondContact SG-CA 3.33Å; C2300-I2328 VanDerWaalsContact C-CD1 3.41Å
2301	E	92.6	Very high	86.8	Confident	7 Å²	7	22.3 Å²	22.3	3%	0.033	13%	0.132	C	C	.	.			trans	-104.8	142.6	179.4	-53.9	-171.7	154.9	0	0	113.2	H2268 H2272 G2297 N2299 W2303 C2320 F2321 R2322 I2328	H2268-E2301 PolarHBondContact CE1-O 2.95Å; H2268-E2301 VanDerWaalsContact CE1-O 3.23Å; H2272-E2301 IonicContact CE1-OE1 3.46Å; H2272-E2301 IonicContact CE1-OE2 3.25Å; H2272-E2301 PolarHBondContact CE1-OE2 2.92Å; H2272-E2301 IonicContact ND1-OE2 3.82Å; H2272-E2301 IonicContact NE2-OE1 3.79Å; H2272-E2301 IonicContact NE2-OE2 3.44Å; H2272-E2301 PolarHBondContact NE2-OE2 3.47Å; G2297-E2301 PolarHBondContact N-O 2.9Å; N2299-E2301 HydrophobicContact CB-CG 4.32Å; N2299-E2301 VanDerWaalsContact ND2-CD 3.25Å; N2299-E2301 WeakPolarHBondContact ND2-CG 3.22Å; N2299-E2301 PolarHBondContact ND2-OE2 3.29Å; N2299-E2301 WeakPolarHBondContact O-CG 3.25Å; N2299-E2301 PolarHBondContact O-N 2.85Å; N2299-E2301 WeakPolarHBondContact OD1-CB 3.49Å; N2299-E2301 PolarHBondContact OD1-N 2.97Å; E2301-W2303 PolarHBondContact OE2-NE1 2.93Å; E2301-C2320 VanDerWaalsContact CD-SG 3.58Å; E2301-C2320 PolarHBondContact OE1-SG 2.82Å; E2301-C2320 PolarHBondContact OE2-SG 2.81Å; E2301-C2320 VanDerWaalsContact OE2-SG 3.35Å; E2301-F2321 WeakPolarHBondContact CA-O 3.46Å; E2301-R2322 HydrophobicContact CG-CG 4.05Å; E2301-R2322 IonicContact OE1-CZ 3.18Å; E2301-R2322 IonicContact OE1-NE 2.98Å; E2301-R2322 PolarHBondContact OE1-NE 2.94Å; E2301-R2322 IonicContact OE1-NH2 2.92Å; E2301-R2322 PolarHBondContact OE1-NH2 3.14Å; E2301-I2328 WeakPolarHBondContact O-CD1 3.43Å
2302	V	93.3	Very high	85.9	Confident	0.75 Å²	0.75	27.1 Å²	27.1	1%	0.005	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	125.1	169.1	-176.3	0	0	0	0	108.1	V2294 S2295 V2304 C2320 F2321 I2328 T2340	V2294-V2302 HydrophobicContact CG1-CG1 3.67Å; S2295-V2302 WeakPolarHBondContact O-CA 3.35Å; V2302-V2304 HydrophobicContact CG1-CG2 4.38Å; V2302-C2320 CarbonylContact O-C 3.56Å; V2302-C2320 WeakPolarHBondContact O-CA 3.43Å; V2302-F2321 HydrophobicContact CB-CB 4.33Å; V2302-F2321 PolarHBondContact N-O 2.86Å; V2302-F2321 PolarHBondContact O-N 2.93Å; V2302-I2328 HydrophobicContact CB-CD1 4.44Å; V2302-I2328 HydrophobicContact CG2-CD1 3.46Å; V2302-I2328 VanDerWaalsContact CG2-CD1 3.45Å; V2302-I2328 HydrophobicContact CG2-CG1 4.23Å; V2302-T2340 HydrophobicContact CB-CG2 4.43Å; V2302-T2340 HydrophobicContact CG1-CG2 3.8Å; V2302-T2340 HydrophobicContact CG2-CG2 3.72Å
2303	W	93.8	Very high	84.8	Confident	29.5 Å²	29.5	32.6 Å²	32.6	11%	0.112	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	132.5	173.3	-75.3	76.9	0	0	0	110.6	W2266 S2267 H2268 H2272 V2294 S2295 E2301 Y2305 F2319 C2320	W2266-W2303 HydrophobicContact CD2-CE3 4.09Å; W2266-W2303 AromaticContact CD2-CH2 3.92Å; W2266-W2303 HydrophobicContact CD2-CH2 3.92Å; W2266-W2303 AromaticContact CD2-CZ3 3.53Å; W2266-W2303 HydrophobicContact CD2-CZ3 3.53Å; W2266-W2303 AromaticContact CE2-CZ3 3.85Å; W2266-W2303 HydrophobicContact CE3-CE3 4.32Å; W2266-W2303 AromaticContact CE3-CH2 3.31Å; W2266-W2303 HydrophobicContact CE3-CH2 3.31Å; W2266-W2303 HydrophobicContact CE3-CZ2 4.07Å; W2266-W2303 AromaticContact CE3-CZ3 3.46Å; W2266-W2303 HydrophobicContact CE3-CZ3 3.46Å; W2266-W2303 VanDerWaalsContact CE3-CZ3 3.46Å; W2266-W2303 HydrophobicContact CG-CE3 4.23Å; W2266-W2303 HydrophobicContact CG-CZ3 4.15Å; W2266-W2303 HydrophobicContact CH2-CH2 4.09Å; W2266-W2303 HydrophobicContact CH2-CZ3 4.05Å; W2266-W2303 HydrophobicContact CZ2-CZ3 4.11Å; W2266-W2303 AromaticContact CZ3-CH2 3.43Å; W2266-W2303 HydrophobicContact CZ3-CH2 3.43Å; W2266-W2303 VanDerWaalsContact CZ3-CH2 3.43Å; W2266-W2303 HydrophobicContact CZ3-CZ2 4.42Å; W2266-W2303 AromaticContact CZ3-CZ3 3.74Å; W2266-W2303 HydrophobicContact CZ3-CZ3 3.74Å; S2267-W2303 PolarHBondContact O-NE1 3.15Å; S2267-W2303 VanDerWaalsContact O-NE1 3.15Å; H2268-W2303 AromaticContact CE1-CD1 3.53Å; H2268-W2303 VanDerWaalsContact CE1-CD1 3.43Å; H2268-W2303 AromaticContact ND1-CD1 3.82Å; H2272-W2303 AromaticContact CE1-CZ2 3.84Å; H2272-W2303 AromaticContact NE2-CZ2 3.93Å; V2294-W2303 CarbonylContact C-O 3.53Å; V2294-W2303 VanDerWaalsContact CA-O 3.25Å; V2294-W2303 WeakPolarHBondContact CA-O 3.36Å; V2294-W2303 WeakPolarHBondContact CG1-O 3.25Å; S2295-W2303 PolarHBondContact N-O 3.09Å; S2295-W2303 PolarHBondContact O-N 3.2Å; E2301-W2303 PolarHBondContact OE2-NE1 2.93Å; W2303-Y2305 HydrophobicContact CB-CE1 4.24Å; W2303-Y2305 HydrophobicContact CB-CE2 3.95Å; W2303-Y2305 VanDerWaalsContact CB-OH 3.3Å; W2303-Y2305 WeakPolarHBondContact CB-OH 3.4Å; W2303-Y2305 HydrophobicContact CE3-CE1 4.38Å; W2303-F2319 CarbonylContact C-O 3.54Å; W2303-F2319 VanDerWaalsContact CA-O 3.31Å; W2303-F2319 WeakPolarHBondContact CA-O 3.3Å; W2303-C2320 HydrophobicContact CD2-CB 3.99Å; W2303-C2320 HydrophobicContact CE3-CB 4.19Å; W2303-C2320 HydrophobicContact CH2-CB 4Å; W2303-C2320 HydrophobicContact CZ2-CB 3.76Å; W2303-C2320 HydrophobicContact CZ3-CB 4.2Å
2304	V	92.8	Very high	83.5	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	125.2	178.9	-179.2	0	0	0	0	108.7	I2292 V2294 V2302 F2306 S2318 F2319 F2321 I2338 V2359	I2292-V2304 HydrophobicContact CD1-CG1 3.51Å; I2292-V2304 VanDerWaalsContact CD1-CG1 3.48Å; I2292-V2304 HydrophobicContact CG1-CG1 3.69Å; V2294-V2304 HydrophobicContact CG1-CG2 4.15Å; V2294-V2304 HydrophobicContact CG2-CB 4.49Å; V2294-V2304 HydrophobicContact CG2-CG1 4.24Å; V2294-V2304 HydrophobicContact CG2-CG2 4.16Å; V2302-V2304 HydrophobicContact CG1-CG2 4.38Å; V2304-F2306 HydrophobicContact CG1-CD2 4.45Å; V2304-F2306 HydrophobicContact CG1-CE2 4.06Å; V2304-F2306 HydrophobicContact CG1-CZ 4.43Å; V2304-S2318 CarbonylContact O-C 3.54Å; V2304-S2318 VanDerWaalsContact O-CA 3.25Å; V2304-S2318 WeakPolarHBondContact O-CA 3.41Å; V2304-F2319 HydrophobicContact CB-CB 4.47Å; V2304-F2319 PolarHBondContact N-O 2.94Å; V2304-F2319 PolarHBondContact O-N 3.13Å; V2304-F2321 HydrophobicContact CB-CE2 4.42Å; V2304-F2321 HydrophobicContact CG2-CD2 4.13Å; V2304-F2321 HydrophobicContact CG2-CE2 3.96Å; V2304-I2338 HydrophobicContact CG1-CD1 4.02Å; V2304-I2338 HydrophobicContact CG2-CD1 3.89Å; V2304-V2359 HydrophobicContact CB-CG2 4.48Å; V2304-V2359 HydrophobicContact CG1-CG2 3.97Å
2305	Y	91.9	Very high	82.5	Confident	0.75 Å²	0.75	40.6 Å²	40.6	0%	0.003	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	117.1	-177.3	-47.2	-83.8	0	0	0	109.5	I2218 V2226 L2228 Y2263 W2266 S2267 I2292 A2293 S2295 W2303 V2316 K2317	I2218-Y2305 HydrophobicContact CD1-CD2 4.34Å; I2218-Y2305 HydrophobicContact CD1-CE2 4.23Å; V2226-Y2305 HydrophobicContact CG1-CE2 3.91Å; L2228-Y2305 HydrophobicContact CD1-CD2 4.27Å; L2228-Y2305 HydrophobicContact CD1-CG 4.28Å; Y2263-Y2305 HydrophobicContact CD1-CD1 4.32Å; Y2263-Y2305 HydrophobicContact CE1-CD1 4.04Å; Y2263-Y2305 HydrophobicContact CE1-CE1 4.18Å; W2266-Y2305 HydrophobicContact CB-CE1 4.23Å; W2266-Y2305 AromaticContact CD1-CE1 3.51Å; W2266-Y2305 HydrophobicContact CG-CE1 4.03Å; S2267-Y2305 VanDerWaalsContact CB-OH 3.25Å; S2267-Y2305 WeakPolarHBondContact CB-OH 3.3Å; S2267-Y2305 PolarHBondContact OG-OH 3.14Å; I2292-Y2305 VanDerWaalsContact CA-O 3.31Å; I2292-Y2305 WeakPolarHBondContact CA-O 3.33Å; A2293-Y2305 HydrophobicContact CB-CD2 4.3Å; A2293-Y2305 PolarHBondContact N-O 2.92Å; A2293-Y2305 WeakPolarHBondContact O-CD2 3.43Å; A2293-Y2305 PolarHBondContact O-N 3.27Å; S2295-Y2305 WeakPolarHBondContact OG-CE2 3.37Å; S2295-Y2305 PolarHBondContact OG-OH 3.07Å; S2295-Y2305 VanDerWaalsContact OG-OH 3.06Å; W2303-Y2305 HydrophobicContact CB-CE1 4.24Å; W2303-Y2305 HydrophobicContact CB-CE2 3.95Å; W2303-Y2305 VanDerWaalsContact CB-OH 3.3Å; W2303-Y2305 WeakPolarHBondContact CB-OH 3.4Å; W2303-Y2305 HydrophobicContact CE3-CE1 4.38Å; Y2305-V2316 HydrophobicContact CD1-CG1 4.33Å; Y2305-V2316 HydrophobicContact CG-CG1 4.4Å; Y2305-K2317 WeakPolarHBondContact CA-O 3.34Å
2306	F	88.7	Confident	81.7	Confident	10 Å²	10	41.9 Å²	41.9	4%	0.044	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	126.1	168.4	-70.3	-90.3	0	0	0	109.4	I2292 V2304 V2316 K2317 F2319 Y2352 T2357 V2359	I2292-F2306 HydrophobicContact CD1-CD1 4.44Å; I2292-F2306 HydrophobicContact CD1-CE1 3.98Å; I2292-F2306 HydrophobicContact CD1-CZ 4.02Å; I2292-F2306 HydrophobicContact CG1-CE1 4.47Å; V2304-F2306 HydrophobicContact CG1-CD2 4.45Å; V2304-F2306 HydrophobicContact CG1-CE2 4.06Å; V2304-F2306 HydrophobicContact CG1-CZ 4.43Å; F2306-V2316 VanDerWaalsContact O-CA 3.27Å; F2306-V2316 WeakPolarHBondContact O-CA 3.4Å; F2306-K2317 HydrophobicContact CB-CB 4.39Å; F2306-K2317 PolarHBondContact N-O 3.11Å; F2306-K2317 PolarHBondContact O-N 3.07Å; F2306-F2319 AromaticContact CD2-CD2 3.87Å; F2306-F2319 HydrophobicContact CD2-CD2 3.87Å; F2306-F2319 AromaticContact CD2-CE2 3.69Å; F2306-F2319 HydrophobicContact CD2-CE2 3.69Å; F2306-F2319 AromaticContact CE2-CD2 3.67Å; F2306-F2319 HydrophobicContact CE2-CD2 3.67Å; F2306-F2319 AromaticContact CE2-CE2 3.55Å; F2306-F2319 HydrophobicContact CE2-CE2 3.55Å; F2306-Y2352 HydrophobicContact CE1-CD2 4.08Å; F2306-Y2352 HydrophobicContact CZ-CD2 4.41Å; F2306-T2357 HydrophobicContact CD1-CG2 4.3Å; F2306-T2357 HydrophobicContact CG-CG2 4.42Å; F2306-V2359 HydrophobicContact CE2-CG2 3.56Å; F2306-V2359 VanDerWaalsContact CE2-CG2 3.48Å; F2306-V2359 HydrophobicContact CZ-CG2 3.54Å; F2306-V2359 VanDerWaalsContact CZ-CG2 3.48Å
2307	V	84.2	Confident	81.3	Confident	5.75 Å²	5.75	46.3 Å²	46.3	4%	0.035	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	117.4	177.8	-177.2	0	0	0	0	108.5	P2209 Y2210 L2216 L2228 L2262 F2291 V2316	P2209-V2307 HydrophobicContact CG-CB 4.49Å; P2209-V2307 HydrophobicContact CG-CG1 4.06Å; Y2210-V2307 HydrophobicContact CE2-CG1 4.25Å; Y2210-V2307 VanDerWaalsContact OH-CG1 3.25Å; Y2210-V2307 WeakPolarHBondContact OH-CG1 3.29Å; L2216-V2307 HydrophobicContact CD1-CG2 4.23Å; L2216-V2307 HydrophobicContact CD2-CG2 4.13Å; L2228-V2307 HydrophobicContact CD1-CG2 3.82Å; L2228-V2307 HydrophobicContact CD2-CG2 3.97Å; L2262-V2307 HydrophobicContact CD1-CG1 4.1Å; L2262-V2307 HydrophobicContact CD1-CG2 4.26Å; F2291-V2307 PolarHBondContact O-N 3Å; V2307-V2316 HydrophobicContact CG2-CG2 4.47Å
2308	G	76.3	Confident	81.1	Confident	26.75 Å²	26.75	48.2 Å²	48.2	28%	0.276	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-64.5	157.4	176.7	0	0	0	0	0	112.9	Y2210 V2310 L2315	Y2210-G2308 WeakPolarHBondContact CE1-O 3.25Å; Y2210-G2308 VanDerWaalsContact CZ-O 3.3Å; Y2210-G2308 PolarHBondContact OH-O 3.05Å; G2308-V2310 VanDerWaalsContact C-N 3.33Å; G2308-V2310 PolarHBondContact O-N 3.1Å; G2308-L2315 PolarHBondContact N-O 3.22Å
2309	S	70.6	Confident	81.1	Confident	87.75 Å²	87.75	50.7 Å²	50.7	61%	0.614	28%	0.279	S	S	*	.	S	Bend	trans	-79.5	-4	-175.7	54.1	0	0	0	0	115.5	Y2210	Y2210-S2309 VanDerWaalsContact CD1-O 3.27Å; Y2210-S2309 WeakPolarHBondContact CD1-O 3.35Å; Y2210-S2309 VanDerWaalsContact CE1-C 3.42Å; Y2210-S2309 WeakPolarHBondContact CE1-O 3.4Å
2310	V	68.9	Low	81.2	Confident	87.5 Å²	87.5	52 Å²	52	53%	0.53	29%	0.289	S	S	.	.			trans	-103	116.3	-179.4	-176.5	0	0	0	0	110.7	Y2210 G2308 E2312 N2313	Y2210-V2310 PolarHBondContact OH-O 2.9Å; G2308-V2310 VanDerWaalsContact C-N 3.33Å; G2308-V2310 PolarHBondContact O-N 3.1Å; V2310-E2312 HydrophobicContact CG1-CB 4.44Å; V2310-N2313 CarbonylContact O-C 3.53Å
2311	L	65.1	Low	81.2	Confident	61.5 Å²	61.5	51.9 Å²	51.9	32%	0.322	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-30.8	-173.3	-167.9	83	0	0	0	113.1	Y2210 Y2211 H2230 V2260 L2262 N2313 P2314	Y2210-L2311 HydrophobicContact CD1-CB 3.81Å; Y2210-L2311 HydrophobicContact CD1-CD1 4.24Å; Y2210-L2311 HydrophobicContact CD1-CG 3.79Å; Y2210-L2311 HydrophobicContact CD2-CB 4.37Å; Y2210-L2311 HydrophobicContact CD2-CD1 3.67Å; Y2210-L2311 HydrophobicContact CD2-CG 4.42Å; Y2210-L2311 VanDerWaalsContact CE1-CA 3.47Å; Y2210-L2311 HydrophobicContact CE1-CB 3.87Å; Y2210-L2311 HydrophobicContact CE1-CD1 4.4Å; Y2210-L2311 HydrophobicContact CE1-CG 3.88Å; Y2210-L2311 HydrophobicContact CE2-CB 4.45Å; Y2210-L2311 HydrophobicContact CE2-CD1 3.55Å; Y2210-L2311 HydrophobicContact CG-CB 3.99Å; Y2210-L2311 HydrophobicContact CG-CD1 4.17Å; Y2210-L2311 HydrophobicContact CG-CG 4.46Å; Y2211-L2311 HydrophobicContact CE2-CD1 3.93Å; Y2211-L2311 HydrophobicContact CE2-CD2 4.48Å; H2230-L2311 HydrophobicContact CB-CD1 4.3Å; V2260-L2311 HydrophobicContact CG1-CD1 4.33Å; L2262-L2311 HydrophobicContact CD2-CD1 3.65Å; L2311-N2313 VanDerWaalsContact C-N 3.33Å; L2311-N2313 PolarHBondContact O-N 3.03Å; L2311-P2314 WeakPolarHBondContact O-CD 3.24Å
2312	E	63.1	Low	81.1	Confident	190 Å²	190	59.6 Å²	59.6	89%	0.888	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-25.6	-177.4	-64.8	-175.3	168.6	0	0	113.2	V2310	V2310-E2312 HydrophobicContact CG1-CB 4.44Å
2313	N	64	Low	80.9	Confident	116 Å²	116	63.8 Å²	63.8	62%	0.62	33%	0.333	S	S	*	.	S	Bend	trans	-147.7	81.8	176	-154.5	1.6	0	0	0	109.1	V2310 L2311 L2315	V2310-N2313 CarbonylContact O-C 3.53Å; L2311-N2313 VanDerWaalsContact C-N 3.33Å; L2311-N2313 PolarHBondContact O-N 3.03Å; N2313-L2315 VanDerWaalsContact C-N 3.26Å; N2313-L2315 PolarHBondContact O-N 3.04Å
2314	P	65.6	Low	80.9	Confident	33 Å²	33	63 Å²	63	21%	0.214	33%	0.33	C	S	.	.			trans	-69.8	93.4	-176.1	29.1	-33.2	0	0	0	109	Y2210 L2262 L2311 V2316	Y2210-P2314 WeakPolarHBondContact OH-CB 3.27Å; L2262-P2314 HydrophobicContact CB-CB 4.46Å; L2262-P2314 HydrophobicContact CB-CG 4.39Å; L2262-P2314 HydrophobicContact CD2-CB 4.05Å; L2262-P2314 HydrophobicContact CD2-CG 4.08Å; L2311-P2314 WeakPolarHBondContact O-CD 3.24Å; P2314-V2316 VanDerWaalsContact C-N 3.34Å; P2314-V2316 PolarHBondContact O-N 3Å; P2314-V2316 VanDerWaalsContact O-N 3.1Å
2315	L	71.6	Confident	80.7	Confident	136.25 Å²	136.25	67.7 Å²	67.7	71%	0.713	36%	0.363	S	S	*	.			trans	-68.3	103.1	171.5	-75	167.4	0	0	0	108.2	G2308 N2313 K2317	G2308-L2315 PolarHBondContact N-O 3.22Å; N2313-L2315 VanDerWaalsContact C-N 3.26Å; N2313-L2315 PolarHBondContact O-N 3.04Å; L2315-K2317 PolarHBondContact O-N 2.87Å; L2315-K2317 VanDerWaalsContact O-N 3.1Å
2316	V	78.7	Confident	80.7	Confident	26.5 Å²	26.5	69.5 Å²	69.5	16%	0.161	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	114.4	174.5	-178.9	0	0	0	0	109.4	L2228 Y2263 T2264 Y2305 F2306 V2307 P2314 S2318	L2228-V2316 HydrophobicContact CD1-CG1 4.3Å; Y2263-V2316 HydrophobicContact CD1-CB 4.31Å; Y2263-V2316 HydrophobicContact CD1-CG1 3.8Å; Y2263-V2316 HydrophobicContact CD2-CB 3.8Å; Y2263-V2316 HydrophobicContact CD2-CG1 4.19Å; Y2263-V2316 HydrophobicContact CD2-CG2 4.18Å; Y2263-V2316 HydrophobicContact CE1-CG1 4.08Å; Y2263-V2316 HydrophobicContact CE2-CB 4.23Å; Y2263-V2316 HydrophobicContact CE2-CG1 4.47Å; Y2263-V2316 HydrophobicContact CG-CB 3.86Å; Y2263-V2316 HydrophobicContact CG-CG1 3.86Å; Y2263-V2316 HydrophobicContact CG-CG2 4.01Å; T2264-V2316 HydrophobicContact CG2-CB 4.34Å; T2264-V2316 HydrophobicContact CG2-CG1 4.08Å; T2264-V2316 HydrophobicContact CG2-CG2 4.19Å; Y2305-V2316 HydrophobicContact CD1-CG1 4.33Å; Y2305-V2316 HydrophobicContact CG-CG1 4.4Å; F2306-V2316 VanDerWaalsContact O-CA 3.27Å; F2306-V2316 WeakPolarHBondContact O-CA 3.4Å; V2307-V2316 HydrophobicContact CG2-CG2 4.47Å; P2314-V2316 VanDerWaalsContact C-N 3.34Å; P2314-V2316 PolarHBondContact O-N 3Å; P2314-V2316 VanDerWaalsContact O-N 3.1Å; V2316-S2318 PolarHBondContact O-N 3.1Å
2317	K	83.7	Confident	80.9	Confident	92.75 Å²	92.75	71.3 Å²	71.3	40%	0.403	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	121.1	175	-169.4	-175.2	-175.8	-168.6	0	108.9	Y2305 F2306 L2315 F2319 T2357	Y2305-K2317 WeakPolarHBondContact CA-O 3.34Å; F2306-K2317 HydrophobicContact CB-CB 4.39Å; F2306-K2317 PolarHBondContact N-O 3.11Å; F2306-K2317 PolarHBondContact O-N 3.07Å; L2315-K2317 PolarHBondContact O-N 2.87Å; L2315-K2317 VanDerWaalsContact O-N 3.1Å; K2317-F2319 HydrophobicContact CD-CE2 3.89Å; K2317-F2319 HydrophobicContact CD-CZ 3.93Å; K2317-F2319 VanDerWaalsContact CE-CZ 3.41Å; K2317-F2319 HydrophobicContact CG-CE2 4.01Å; K2317-F2319 HydrophobicContact CG-CZ 4.3Å; K2317-T2357 WeakPolarHBondContact CD-OG1 3.36Å; K2317-T2357 PolarHBondContact NZ-O 2.88Å; K2317-T2357 PolarHBondContact NZ-OG1 3.02Å
2318	S	87.6	Confident	81.3	Confident	40.75 Å²	40.75	71 Å²	71	29%	0.285	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	144.1	-177.5	58.5	0	0	0	0	112.7	W2266 V2304 V2316	W2266-S2318 VanDerWaalsContact CZ2-OG 3.24Å; W2266-S2318 WeakPolarHBondContact CZ2-OG 3.39Å; V2304-S2318 CarbonylContact O-C 3.54Å; V2304-S2318 VanDerWaalsContact O-CA 3.25Å; V2304-S2318 WeakPolarHBondContact O-CA 3.41Å; V2316-S2318 PolarHBondContact O-N 3.1Å
2319	F	89.7	Confident	82.1	Confident	54.5 Å²	54.5	71.3 Å²	71.3	24%	0.239	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	140.2	172.9	-64.9	-87.7	0	0	0	110.3	W2303 V2304 F2306 K2317 F2321 T2357 V2359	W2303-F2319 CarbonylContact C-O 3.54Å; W2303-F2319 VanDerWaalsContact CA-O 3.31Å; W2303-F2319 WeakPolarHBondContact CA-O 3.3Å; V2304-F2319 HydrophobicContact CB-CB 4.47Å; V2304-F2319 PolarHBondContact N-O 2.94Å; V2304-F2319 PolarHBondContact O-N 3.13Å; F2306-F2319 AromaticContact CD2-CD2 3.87Å; F2306-F2319 HydrophobicContact CD2-CD2 3.87Å; F2306-F2319 AromaticContact CD2-CE2 3.69Å; F2306-F2319 HydrophobicContact CD2-CE2 3.69Å; F2306-F2319 AromaticContact CE2-CD2 3.67Å; F2306-F2319 HydrophobicContact CE2-CD2 3.67Å; F2306-F2319 AromaticContact CE2-CE2 3.55Å; F2306-F2319 HydrophobicContact CE2-CE2 3.55Å; K2317-F2319 HydrophobicContact CD-CE2 3.89Å; K2317-F2319 HydrophobicContact CD-CZ 3.93Å; K2317-F2319 VanDerWaalsContact CE-CZ 3.41Å; K2317-F2319 HydrophobicContact CG-CE2 4.01Å; K2317-F2319 HydrophobicContact CG-CZ 4.3Å; F2319-F2321 HydrophobicContact CB-CE2 3.64Å; F2319-F2321 HydrophobicContact CB-CZ 3.92Å; F2319-F2321 HydrophobicContact CG-CZ 4.37Å; F2319-T2357 VanDerWaalsContact CE2-O 3.24Å; F2319-T2357 WeakPolarHBondContact CE2-O 3.37Å; F2319-T2357 WeakPolarHBondContact CZ-O 3.18Å; F2319-V2359 HydrophobicContact CD2-CG2 4.44Å
2320	C	90.9	Very high	83.1	Confident	49.5 Å²	49.5	67.3 Å²	67.3	33%	0.334	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	131.6	176.5	176.2	0	0	0	0	110	E2301 V2302 W2303	E2301-C2320 VanDerWaalsContact CD-SG 3.58Å; E2301-C2320 PolarHBondContact OE1-SG 2.82Å; E2301-C2320 PolarHBondContact OE2-SG 2.81Å; E2301-C2320 VanDerWaalsContact OE2-SG 3.35Å; V2302-C2320 CarbonylContact O-C 3.56Å; V2302-C2320 WeakPolarHBondContact O-CA 3.43Å; W2303-C2320 HydrophobicContact CD2-CB 3.99Å; W2303-C2320 HydrophobicContact CE3-CB 4.19Å; W2303-C2320 HydrophobicContact CH2-CB 4Å; W2303-C2320 HydrophobicContact CZ2-CB 3.76Å; W2303-C2320 HydrophobicContact CZ3-CB 4.2Å
2321	F	92	Very high	84.4	Confident	32.5 Å²	32.5	63.8 Å²	63.8	14%	0.143	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	138.6	176.2	-59.9	-80.9	0	0	0	110.6	E2301 V2302 V2304 F2319 Y2350 V2359	E2301-F2321 WeakPolarHBondContact CA-O 3.46Å; V2302-F2321 HydrophobicContact CB-CB 4.33Å; V2302-F2321 PolarHBondContact N-O 2.86Å; V2302-F2321 PolarHBondContact O-N 2.93Å; V2304-F2321 HydrophobicContact CB-CE2 4.42Å; V2304-F2321 HydrophobicContact CG2-CD2 4.13Å; V2304-F2321 HydrophobicContact CG2-CE2 3.96Å; F2319-F2321 HydrophobicContact CB-CE2 3.64Å; F2319-F2321 HydrophobicContact CB-CZ 3.92Å; F2319-F2321 HydrophobicContact CG-CZ 4.37Å; F2321-Y2350 HydrophobicContact CB-CE1 4.03Å; F2321-Y2350 HydrophobicContact CD1-CD1 4.4Å; F2321-Y2350 AromaticContact CD1-CE1 3.81Å; F2321-Y2350 HydrophobicContact CD1-CE1 4Å; F2321-Y2350 HydrophobicContact CD2-CE1 4.42Å; F2321-Y2350 HydrophobicContact CE1-CE1 4.5Å; F2321-Y2350 HydrophobicContact CG-CD1 4.41Å; F2321-Y2350 AromaticContact CG-CE1 3.9Å; F2321-Y2350 HydrophobicContact CG-CE1 3.9Å; F2321-V2359 HydrophobicContact CE1-CG1 4.49Å; F2321-V2359 HydrophobicContact CE2-CB 3.95Å; F2321-V2359 HydrophobicContact CE2-CG1 3.76Å; F2321-V2359 HydrophobicContact CE2-CG2 4.48Å; F2321-V2359 HydrophobicContact CZ-CB 3.63Å; F2321-V2359 HydrophobicContact CZ-CG1 3.68Å; F2321-V2359 HydrophobicContact CZ-CG2 4.47Å
2322	R	91.2	Very high	85.7	Confident	170.5 Å²	170.5	61.2 Å²	61.2	64%	0.643	32%	0.318	S	S	*	.			trans	-128.4	52.8	-175.8	-64.7	-171	179.4	172.7	-1.3	111.7	E2301	E2301-R2322 HydrophobicContact CG-CG 4.05Å; E2301-R2322 IonicContact OE1-CZ 3.18Å; E2301-R2322 IonicContact OE1-NE 2.98Å; E2301-R2322 PolarHBondContact OE1-NE 2.94Å; E2301-R2322 IonicContact OE1-NH2 2.92Å; E2301-R2322 PolarHBondContact OE1-NH2 3.14Å
2323	E	89.2	Confident	87	Confident	87 Å²	87	52.9 Å²	52.9	41%	0.407	28%	0.28	S	S	.	.			trans	-87.2	-22.8	-177.8	-59.2	-59.5	150.9	0	0	113.4	Y2350 L2361 I2364	E2323-Y2350 HydrophobicContact CG-CE1 4.11Å; E2323-Y2350 WeakPolarHBondContact CG-OH 3.43Å; E2323-L2361 HydrophobicContact CG-CD1 4.28Å; E2323-L2361 HydrophobicContact CG-CD2 4.06Å; E2323-I2364 HydrophobicContact CB-CD1 4.33Å
2324	H	92	Very high	88	Confident	13.25 Å²	13.25	50.4 Å²	50.4	6%	0.061	27%	0.265	C	S	.	.			trans	-90.8	145.3	-178.8	-73.9	-70.6	0	0	0	111.7	S2326 I2328 T2340 S2342 D2344 N2346	H2324-S2326 VanDerWaalsContact C-N 3.32Å; H2324-I2328 HydrophobicContact CB-CG1 4.31Å; H2324-T2340 PolarHBondContact CD2-OG1 3.07Å; H2324-T2340 PolarHBondContact NE2-O 3.18Å; H2324-T2340 PolarHBondContact NE2-OG1 2.82Å; H2324-S2342 VanDerWaalsContact ND1-CB 3.33Å; H2324-S2342 WeakPolarHBondContact ND1-CB 3.4Å; H2324-D2344 WeakPolarHBondContact CA-OD2 3.45Å; H2324-D2344 IonicContact CE1-OD1 2.62Å; H2324-D2344 IonicContact CG-OD2 3.31Å; H2324-D2344 IonicContact ND1-OD1 3.35Å; H2324-D2344 PolarHBondContact ND1-OD1 3.23Å; H2324-D2344 IonicContact ND1-OD2 3.48Å; H2324-D2344 PolarHBondContact ND1-OD2 3.11Å; H2324-D2344 VanDerWaalsContact ND1-OD2 3.13Å; H2324-N2346 PolarHBondContact CE1-O 2.94Å; H2324-N2346 VanDerWaalsContact CE1-O 3.32Å
2325	S	89.6	Confident	88.6	Confident	99.25 Å²	99.25	52.8 Å²	52.8	69%	0.694	27%	0.274	S	S	*	.	S	Bend	trans	-95.1	1.8	177.7	63.5	0	0	0	0	113.5	D2344	S2325-D2344 PolarHBondContact N-OD2 3.13Å; S2325-D2344 VanDerWaalsContact N-OD2 3.14Å; S2325-D2344 VanDerWaalsContact OG-CB 3.31Å; S2325-D2344 WeakPolarHBondContact OG-CB 3.35Å; S2325-D2344 PolarHBondContact OG-OD2 2.93Å
2326	S	91.9	Very high	89.3	Confident	38 Å²	38	50 Å²	50	27%	0.266	26%	0.26	S	S	.	.	S	Bend	trans	-149.6	173.5	179.7	-156.1	0	0	0	0	111.7	C2300 H2324 I2328 S2342	C2300-S2326 WeakPolarHBondContact SG-CA 3.33Å; H2324-S2326 VanDerWaalsContact C-N 3.32Å; S2326-I2328 PolarHBondContact O-N 3.02Å; S2326-S2342 PolarHBondContact O-OG 3Å
2327	Q	92.1	Very high	89.8	Confident	47.5 Å²	47.5	50.3 Å²	50.3	22%	0.222	26%	0.259	C	S	.	.			trans	-51.3	133.7	-176.3	-57.3	179	-11.9	0	0	112.1	A2280 L2284 G2298 T2329 S2342 K2343	A2280-Q2327 HydrophobicContact CB-CG 4.47Å; A2280-Q2327 PolarHBondContact O-NE2 3.32Å; A2280-Q2327 VanDerWaalsContact O-NE2 3.12Å; L2284-Q2327 HydrophobicContact CD1-CB 3.9Å; G2298-Q2327 WeakPolarHBondContact O-CG 3.5Å; Q2327-T2329 PolarHBondContact O-N 3.14Å; Q2327-S2342 VanDerWaalsContact O-CA 3.31Å; Q2327-S2342 WeakPolarHBondContact O-CA 3.33Å; Q2327-S2342 WeakPolarHBondContact O-CB 3.21Å; Q2327-S2342 PolarHBondContact O-OG 2.99Å; Q2327-K2343 HydrophobicContact CB-CD 4.21Å; Q2327-K2343 HydrophobicContact CB-CG 4.44Å; Q2327-K2343 PolarHBondContact O-N 3.06Å; Q2327-K2343 VanDerWaalsContact OE1-CE 3.32Å
2328	I	94.3	Very high	90.2	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	117.2	179.2	-61.9	143.9	0	0	0	108.6	L2284 C2285 G2297 C2300 E2301 V2302 H2324 S2326 V2331	L2284-I2328 WeakPolarHBondContact CB-O 3.35Å; C2285-I2328 PolarHBondContact SG-O 2.88Å; G2297-I2328 PolarHBondContact O-N 3.19Å; G2297-I2328 VanDerWaalsContact O-N 3.12Å; C2300-I2328 VanDerWaalsContact C-CD1 3.41Å; E2301-I2328 WeakPolarHBondContact O-CD1 3.43Å; V2302-I2328 HydrophobicContact CB-CD1 4.44Å; V2302-I2328 HydrophobicContact CG2-CD1 3.46Å; V2302-I2328 VanDerWaalsContact CG2-CD1 3.45Å; V2302-I2328 HydrophobicContact CG2-CG1 4.23Å; H2324-I2328 HydrophobicContact CB-CG1 4.31Å; S2326-I2328 PolarHBondContact O-N 3.02Å; I2328-V2331 HydrophobicContact CG2-CG2 4.08Å
2329	T	92.3	Very high	90.5	Very high	32.25 Å²	32.25	44 Å²	44	20%	0.198	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	-19.2	-169.8	39.2	0	0	0	0	113	L2284 Q2327 G2341 K2343 I2373	L2284-T2329 HydrophobicContact CD1-CG2 4.42Å; Q2327-T2329 PolarHBondContact O-N 3.14Å; T2329-G2341 PolarHBondContact N-O 3.11Å; T2329-G2341 PolarHBondContact OG1-O 3.02Å; T2329-K2343 HydrophobicContact CG2-CD 4.37Å; T2329-K2343 HydrophobicContact CG2-CG 3.78Å; T2329-I2373 VanDerWaalsContact CB-O 3.3Å; T2329-I2373 WeakPolarHBondContact CB-O 3.31Å; T2329-I2373 PolarHBondContact OG1-O 3.26Å
2330	A	92.4	Very high	90.8	Very high	4.25 Å²	4.25	41.4 Å²	41.4	4%	0.035	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	142.2	178.6	0	0	0	0	0	111.7	C2285 T2340 G2341 I2373 L2376	C2285-A2330 VanDerWaalsContact SG-C 3.59Å; A2330-T2340 CarbonylContact O-C 3.56Å; A2330-T2340 WeakPolarHBondContact O-CA 3.19Å; A2330-G2341 PolarHBondContact N-O 3.07Å; A2330-G2341 VanDerWaalsContact N-O 3.12Å; A2330-G2341 PolarHBondContact O-N 3.19Å; A2330-I2373 HydrophobicContact CB-CG2 4.33Å; A2330-L2376 HydrophobicContact CB-CB 4.13Å; A2330-L2376 HydrophobicContact CB-CD1 4.1Å; A2330-L2376 HydrophobicContact CB-CG 3.78Å
2331	V	94.4	Very high	90.9	Very high	15.25 Å²	15.25	39 Å²	39	9%	0.092	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	140.7	173.2	118.6	0	0	0	0	109	C2285 A2286 A2287 V2294 I2328 V2333 I2338 A2339 T2340	C2285-V2331 HydrophobicContact CB-CG1 4.08Å; C2285-V2331 VanDerWaalsContact SG-CG2 3.56Å; A2286-V2331 VanDerWaalsContact C-CG1 3.41Å; A2287-V2331 HydrophobicContact CB-CB 4.42Å; A2287-V2331 HydrophobicContact CB-CG1 3.81Å; A2287-V2331 HydrophobicContact CB-CG2 4.37Å; V2294-V2331 HydrophobicContact CB-CG1 3.77Å; V2294-V2331 HydrophobicContact CB-CG2 3.91Å; V2294-V2331 HydrophobicContact CG1-CG1 3.52Å; V2294-V2331 HydrophobicContact CG1-CG2 4Å; I2328-V2331 HydrophobicContact CG2-CG2 4.08Å; V2331-V2333 HydrophobicContact CG1-CG2 4.42Å; V2331-I2338 HydrophobicContact CG2-CG2 4.28Å; V2331-A2339 CarbonylContact C-O 3.58Å; V2331-A2339 WeakPolarHBondContact CA-O 3.38Å; V2331-T2340 HydrophobicContact CG2-CG2 4.05Å
2332	A	92.8	Very high	91	Very high	6.75 Å²	6.75	37.5 Å²	37.5	6%	0.056	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	136.3	173.5	0	0	0	0	0	110.5	I2338 A2339 L2376 W2378	A2332-I2338 CarbonylContact O-C 3.57Å; A2332-I2338 WeakPolarHBondContact O-CA 3.44Å; A2332-A2339 PolarHBondContact N-O 2.93Å; A2332-A2339 PolarHBondContact O-N 3.07Å; A2332-L2376 HydrophobicContact CB-CB 3.83Å; A2332-W2378 VanDerWaalsContact C-NE1 3.33Å; A2332-W2378 HydrophobicContact CB-CG 4.48Å; A2332-W2378 PolarHBondContact O-NE1 3.19Å
2333	V	90.7	Very high	91.1	Very high	15.25 Å²	15.25	31.9 Å²	31.9	9%	0.092	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	133.6	178.1	-175	0	0	0	0	108.4	A2287 S2289 I2292 V2294 V2331 F2337 I2338 Y2352	A2287-V2333 HydrophobicContact CB-CB 4.45Å; A2287-V2333 HydrophobicContact CB-CG2 3.85Å; S2289-V2333 VanDerWaalsContact OG-CG1 3.26Å; S2289-V2333 WeakPolarHBondContact OG-CG1 3.31Å; I2292-V2333 HydrophobicContact CG2-CG1 3.8Å; V2294-V2333 HydrophobicContact CB-CG2 4.09Å; V2294-V2333 HydrophobicContact CG2-CG2 3.57Å; V2331-V2333 HydrophobicContact CG1-CG2 4.42Å; V2333-F2337 WeakPolarHBondContact CA-O 3.44Å; V2333-I2338 HydrophobicContact CG1-CG1 4.31Å; V2333-I2338 HydrophobicContact CG2-CG1 4.23Å; V2333-I2338 HydrophobicContact CG2-CG2 4.33Å; V2333-Y2352 HydrophobicContact CG1-CE1 4.07Å
2334	Q	84.7	Confident	91.3	Very high	64.25 Å²	64.25	28.8 Å²	28.8	30%	0.3	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.9	133.3	172.3	-166.4	90.3	15.4	0	0	110	D2336 F2337 W2378 Y2380	Q2334-D2336 PolarHBondContact O-N 3.19Å; Q2334-F2337 PolarHBondContact N-O 2.95Å; Q2334-F2337 VanDerWaalsContact N-O 3.09Å; Q2334-F2337 PolarHBondContact O-N 3.22Å; Q2334-W2378 HydrophobicContact CB-CB 3.49Å; Q2334-W2378 VanDerWaalsContact CB-CB 3.46Å; Q2334-W2378 VanDerWaalsContact CB-CD1 3.45Å; Q2334-W2378 HydrophobicContact CB-CD2 4.46Å; Q2334-W2378 HydrophobicContact CB-CG 3.57Å; Q2334-W2378 VanDerWaalsContact CB-CG 3.49Å; Q2334-W2378 HydrophobicContact CG-CB 4.04Å; Q2334-W2378 HydrophobicContact CG-CG 4.46Å; Q2334-Y2380 VanDerWaalsContact CD-CE2 3.41Å; Q2334-Y2380 HydrophobicContact CG-CE2 4.21Å; Q2334-Y2380 WeakPolarHBondContact CG-OH 3.31Å
2335	M	79.3	Confident	91.3	Very high	82.25 Å²	82.25	31.7 Å²	31.7	41%	0.405	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	-132	-175.5	-63	170.2	179.4	0	0	110.5	F2337 Y2352 Y2380 L2390	M2335-F2337 PolarHBondContact O-N 3.19Å; M2335-F2337 VanDerWaalsContact O-N 3.17Å; M2335-Y2352 WeakPolarHBondContact O-CE1 3.37Å; M2335-Y2352 PolarHBondContact O-OH 2.92Å; M2335-Y2380 HydrophobicContact CE-CE1 4.32Å; M2335-Y2380 HydrophobicContact CE-CG 4.33Å; M2335-Y2380 WeakPolarHBondContact CG-OH 3.16Å; M2335-Y2380 HydrophobicContact SD-CE1 3.9Å; M2335-Y2380 PolarHBondContact SD-OH 3.28Å; M2335-L2390 HydrophobicContact SD-CD1 4.16Å
2336	D	85.1	Confident	91.5	Very high	77.25 Å²	77.25	28 Å²	28	41%	0.413	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	11.5	-177.6	-55.6	-12.6	0	0	0	114.3	Q2334 K2351 Y2352	Q2334-D2336 PolarHBondContact O-N 3.19Å; D2336-K2351 HydrophobicContact CB-CG 4.27Å; D2336-K2351 CarbonylContact O-C 3.58Å; D2336-K2351 WeakPolarHBondContact O-CA 3.29Å; D2336-K2351 IonicContact OD2-NZ 3.68Å; D2336-Y2352 VanDerWaalsContact C-CD1 3.42Å; D2336-Y2352 WeakPolarHBondContact O-CD1 3.35Å; D2336-Y2352 PolarHBondContact O-N 3.05Å
2337	F	89.6	Confident	91.6	Very high	33.5 Å²	33.5	26.2 Å²	26.2	15%	0.147	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	139.3	-171.4	-61.3	-77.9	0	0	0	113.5	V2333 Q2334 M2335 I2349 Y2350 K2351 Q2362 W2378 L2390	V2333-F2337 WeakPolarHBondContact CA-O 3.44Å; Q2334-F2337 PolarHBondContact N-O 2.95Å; Q2334-F2337 VanDerWaalsContact N-O 3.09Å; Q2334-F2337 PolarHBondContact O-N 3.22Å; M2335-F2337 PolarHBondContact O-N 3.19Å; M2335-F2337 VanDerWaalsContact O-N 3.17Å; F2337-I2349 HydrophobicContact CD1-CG2 4.22Å; F2337-Y2350 WeakPolarHBondContact CA-O 3.39Å; F2337-K2351 HydrophobicContact CD1-CB 4.26Å; F2337-K2351 HydrophobicContact CD1-CG 4.35Å; F2337-K2351 HydrophobicContact CE1-CB 4.1Å; F2337-K2351 HydrophobicContact CE1-CD 4.3Å; F2337-K2351 HydrophobicContact CE1-CG 3.97Å; F2337-K2351 HydrophobicContact CZ-CG 4.47Å; F2337-Q2362 VanDerWaalsContact CE1-OE1 3.25Å; F2337-W2378 HydrophobicContact CB-CH2 3.9Å; F2337-W2378 HydrophobicContact CB-CZ2 3.68Å; F2337-L2390 HydrophobicContact CB-CD2 4.32Å; F2337-L2390 HydrophobicContact CD2-CD2 3.4Å; F2337-L2390 VanDerWaalsContact CD2-CD2 3.44Å; F2337-L2390 HydrophobicContact CE2-CD2 3.93Å; F2337-L2390 HydrophobicContact CG-CD2 4.04Å
2338	I	92.6	Very high	91.7	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	131.4	171.6	-55.3	164.5	0	0	0	107	I2292 V2294 V2304 V2331 A2332 V2333 T2340 I2349 Y2350 Y2352 V2359	I2292-I2338 HydrophobicContact CD1-CD1 3.88Å; V2294-I2338 HydrophobicContact CG1-CG2 4.11Å; V2294-I2338 HydrophobicContact CG2-CD1 3.94Å; V2294-I2338 HydrophobicContact CG2-CG1 4.24Å; V2294-I2338 HydrophobicContact CG2-CG2 4.16Å; V2304-I2338 HydrophobicContact CG1-CD1 4.02Å; V2304-I2338 HydrophobicContact CG2-CD1 3.89Å; V2331-I2338 HydrophobicContact CG2-CG2 4.28Å; A2332-I2338 CarbonylContact O-C 3.57Å; A2332-I2338 WeakPolarHBondContact O-CA 3.44Å; V2333-I2338 HydrophobicContact CG1-CG1 4.31Å; V2333-I2338 HydrophobicContact CG2-CG1 4.23Å; V2333-I2338 HydrophobicContact CG2-CG2 4.33Å; I2338-T2340 HydrophobicContact CG2-CG2 4.22Å; I2338-I2349 CarbonylContact O-C 3.49Å; I2338-I2349 WeakPolarHBondContact O-CA 3.3Å; I2338-Y2350 HydrophobicContact CB-CD2 4.34Å; I2338-Y2350 HydrophobicContact CG2-CD2 4.33Å; I2338-Y2350 PolarHBondContact N-O 3.01Å; I2338-Y2350 PolarHBondContact O-N 3.07Å; I2338-Y2352 HydrophobicContact CD1-CD1 4.03Å; I2338-Y2352 HydrophobicContact CD1-CE1 4.49Å; I2338-Y2352 HydrophobicContact CG1-CD1 3.82Å; I2338-Y2352 HydrophobicContact CG1-CE1 4.19Å; I2338-V2359 HydrophobicContact CD1-CG1 4.38Å
2339	A	93.7	Very high	91.6	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	135.6	170.1	0	0	0	0	0	109.8	V2331 A2332 V2347 A2348 I2349 L2376 W2378 L2392	V2331-A2339 CarbonylContact C-O 3.58Å; V2331-A2339 WeakPolarHBondContact CA-O 3.38Å; A2332-A2339 PolarHBondContact N-O 2.93Å; A2332-A2339 PolarHBondContact O-N 3.07Å; A2339-V2347 HydrophobicContact CB-CG1 4.41Å; A2339-A2348 CarbonylContact C-O 3.6Å; A2339-A2348 WeakPolarHBondContact CA-O 3.34Å; A2339-I2349 HydrophobicContact CB-CD1 3.54Å; A2339-I2349 HydrophobicContact CB-CG1 4.32Å; A2339-L2376 HydrophobicContact CB-CD1 4.1Å; A2339-W2378 HydrophobicContact CB-CH2 4.27Å; A2339-W2378 HydrophobicContact CB-CZ2 3.47Å; A2339-W2378 VanDerWaalsContact CB-CZ2 3.45Å; A2339-L2392 HydrophobicContact CB-CD1 3.72Å; A2339-L2392 HydrophobicContact CB-CD2 3.85Å; A2339-L2392 HydrophobicContact CB-CG 4.47Å
2340	T	95.7	Very high	91.6	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	137.5	175.4	61.3	0	0	0	0	110.1	V2302 H2324 A2330 V2331 I2338 V2347 A2348 Y2350 L2376	V2302-T2340 HydrophobicContact CB-CG2 4.43Å; V2302-T2340 HydrophobicContact CG1-CG2 3.8Å; V2302-T2340 HydrophobicContact CG2-CG2 3.72Å; H2324-T2340 PolarHBondContact CD2-OG1 3.07Å; H2324-T2340 PolarHBondContact NE2-O 3.18Å; H2324-T2340 PolarHBondContact NE2-OG1 2.82Å; A2330-T2340 CarbonylContact O-C 3.56Å; A2330-T2340 WeakPolarHBondContact O-CA 3.19Å; V2331-T2340 HydrophobicContact CG2-CG2 4.05Å; I2338-T2340 HydrophobicContact CG2-CG2 4.22Å; T2340-V2347 CarbonylContact O-C 3.55Å; T2340-V2347 VanDerWaalsContact O-CA 3.23Å; T2340-V2347 WeakPolarHBondContact O-CA 3.33Å; T2340-A2348 PolarHBondContact N-O 2.89Å; T2340-A2348 PolarHBondContact O-N 3.25Å; T2340-Y2350 HydrophobicContact CG2-CD2 4.48Å; T2340-Y2350 HydrophobicContact CG2-CE2 4.02Å; T2340-Y2350 WeakPolarHBondContact OG1-CE2 3.45Å; T2340-L2376 VanDerWaalsContact C-CD1 3.49Å
2341	G	94	Very high	91.5	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	139.9	-179.3	0	0	0	0	0	109.9	T2329 A2330 L2376	T2329-G2341 PolarHBondContact N-O 3.11Å; T2329-G2341 PolarHBondContact OG1-O 3.02Å; A2330-G2341 PolarHBondContact N-O 3.07Å; A2330-G2341 VanDerWaalsContact N-O 3.12Å; A2330-G2341 PolarHBondContact O-N 3.19Å; G2341-L2376 VanDerWaalsContact N-CD1 3.28Å
2342	S	94.4	Very high	91.3	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	165.8	-173.7	166.8	0	0	0	0	112	H2324 S2326 Q2327 D2344 K2345 N2346	H2324-S2342 VanDerWaalsContact ND1-CB 3.33Å; H2324-S2342 WeakPolarHBondContact ND1-CB 3.4Å; S2326-S2342 PolarHBondContact O-OG 3Å; Q2327-S2342 VanDerWaalsContact O-CA 3.31Å; Q2327-S2342 WeakPolarHBondContact O-CA 3.33Å; Q2327-S2342 WeakPolarHBondContact O-CB 3.21Å; Q2327-S2342 PolarHBondContact O-OG 2.99Å; S2342-D2344 VanDerWaalsContact CB-OD1 3.23Å; S2342-D2344 WeakPolarHBondContact CB-OD1 3.43Å; S2342-D2344 PolarHBondContact O-N 3.16Å; S2342-D2344 PolarHBondContact OG-N 2.87Å; S2342-D2344 VanDerWaalsContact OG-N 3.15Å; S2342-D2344 PolarHBondContact OG-OD1 2.98Å; S2342-K2345 PolarHBondContact O-N 3.11Å; S2342-K2345 VanDerWaalsContact O-N 3.13Å; S2342-N2346 PolarHBondContact N-O 2.94Å
2343	K	92.2	Very high	90.9	Very high	53.25 Å²	53.25	29 Å²	29	23%	0.232	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-14.5	167.9	-68.6	-172.3	176.8	171.9	0	113.3	Q2327 T2329 K2345 W2372	Q2327-K2343 HydrophobicContact CB-CD 4.21Å; Q2327-K2343 HydrophobicContact CB-CG 4.44Å; Q2327-K2343 PolarHBondContact O-N 3.06Å; Q2327-K2343 VanDerWaalsContact OE1-CE 3.32Å; T2329-K2343 HydrophobicContact CG2-CD 4.37Å; T2329-K2343 HydrophobicContact CG2-CG 3.78Å; K2343-K2345 PolarHBondContact O-N 3.1Å; K2343-W2372 HydrophobicContact CB-CD2 4.5Å; K2343-W2372 HydrophobicContact CB-CG 4.16Å; K2343-W2372 HydrophobicContact CD-CD2 4.06Å; K2343-W2372 HydrophobicContact CD-CE3 4.35Å; K2343-W2372 HydrophobicContact CD-CG 4.38Å; K2343-W2372 HydrophobicContact CD-CZ2 4.33Å; K2343-W2372 HydrophobicContact CG-CB 4.32Å; K2343-W2372 HydrophobicContact CG-CD2 3.99Å; K2343-W2372 HydrophobicContact CG-CE3 4.46Å; K2343-W2372 HydrophobicContact CG-CG 3.86Å
2344	D	92.7	Very high	90.2	Very high	22.5 Å²	22.5	30.6 Å²	30.6	12%	0.12	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-1.9	170.9	74.3	0.3	0	0	0	113.9	H2324 S2325 S2342 N2346	H2324-D2344 WeakPolarHBondContact CA-OD2 3.45Å; H2324-D2344 IonicContact CE1-OD1 2.62Å; H2324-D2344 IonicContact CG-OD2 3.31Å; H2324-D2344 IonicContact ND1-OD1 3.35Å; H2324-D2344 PolarHBondContact ND1-OD1 3.23Å; H2324-D2344 IonicContact ND1-OD2 3.48Å; H2324-D2344 PolarHBondContact ND1-OD2 3.11Å; H2324-D2344 VanDerWaalsContact ND1-OD2 3.13Å; S2325-D2344 PolarHBondContact N-OD2 3.13Å; S2325-D2344 VanDerWaalsContact N-OD2 3.14Å; S2325-D2344 VanDerWaalsContact OG-CB 3.31Å; S2325-D2344 WeakPolarHBondContact OG-CB 3.35Å; S2325-D2344 PolarHBondContact OG-OD2 2.93Å; S2342-D2344 VanDerWaalsContact CB-OD1 3.23Å; S2342-D2344 WeakPolarHBondContact CB-OD1 3.43Å; S2342-D2344 PolarHBondContact O-N 3.16Å; S2342-D2344 PolarHBondContact OG-N 2.87Å; S2342-D2344 VanDerWaalsContact OG-N 3.15Å; S2342-D2344 PolarHBondContact OG-OD1 2.98Å; D2344-N2346 PolarHBondContact O-N 3.23Å; D2344-N2346 WeakPolarHBondContact OD1-CA 3.3Å; D2344-N2346 VanDerWaalsContact OD1-CB 3.29Å; D2344-N2346 WeakPolarHBondContact OD1-CB 3.29Å; D2344-N2346 PolarHBondContact OD1-N 3.2Å; D2344-N2346 PolarHBondContact OD1-ND2 3.08Å; D2344-N2346 PolarHBondContact OD2-ND2 3.12Å
2345	K	92.6	Very high	89.9	Confident	73.5 Å²	73.5	34.7 Å²	34.7	32%	0.32	18%	0.175	S	C	.	.	S	Bend	trans	72.1	7.8	178.9	-43.9	174.1	-175.1	-167.4	0	114.3	S2342 K2343 N2367 A2368 K2370	S2342-K2345 PolarHBondContact O-N 3.11Å; S2342-K2345 VanDerWaalsContact O-N 3.13Å; K2343-K2345 PolarHBondContact O-N 3.1Å; K2345-N2367 CarbonylContact O-C 3.42Å; K2345-N2367 WeakPolarHBondContact O-CA 3.29Å; K2345-A2368 PolarHBondContact O-N 3.04Å; K2345-K2370 WeakPolarHBondContact CD-O 3.47Å; K2345-K2370 VanDerWaalsContact CE-O 3.31Å; K2345-K2370 WeakPolarHBondContact CE-O 3.17Å; K2345-K2370 PolarHBondContact NZ-O 3.14Å
2346	N	94.8	Very high	90	Very high	22 Å²	22	33.1 Å²	33.1	12%	0.118	17%	0.172	C	C	.	.			trans	-99.6	153.5	179.9	-54.9	-38.4	0	0	0	110.9	H2324 S2342 D2344 I2364 I2365 Y2366 N2367 I2373	H2324-N2346 PolarHBondContact CE1-O 2.94Å; H2324-N2346 VanDerWaalsContact CE1-O 3.32Å; S2342-N2346 PolarHBondContact N-O 2.94Å; D2344-N2346 PolarHBondContact O-N 3.23Å; D2344-N2346 WeakPolarHBondContact OD1-CA 3.3Å; D2344-N2346 VanDerWaalsContact OD1-CB 3.29Å; D2344-N2346 WeakPolarHBondContact OD1-CB 3.29Å; D2344-N2346 PolarHBondContact OD1-N 3.2Å; D2344-N2346 PolarHBondContact OD1-ND2 3.08Å; D2344-N2346 PolarHBondContact OD2-ND2 3.12Å; N2346-I2364 HydrophobicContact CB-CG2 4.2Å; N2346-I2365 WeakPolarHBondContact CA-O 3.28Å; N2346-Y2366 VanDerWaalsContact OD1-CA 3.29Å; N2346-Y2366 WeakPolarHBondContact OD1-CA 3.23Å; N2346-N2367 PolarHBondContact OD1-N 2.98Å; N2346-I2373 VanDerWaalsContact O-CD1 3.3Å; N2346-I2373 WeakPolarHBondContact O-CD1 3.4Å
2347	V	93.8	Very high	89.8	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	120.9	168.2	175.5	0	0	0	0	109	A2339 T2340 I2349 I2364 I2365 A2368 I2373 L2376 L2392 V2394	A2339-V2347 HydrophobicContact CB-CG1 4.41Å; T2340-V2347 CarbonylContact O-C 3.55Å; T2340-V2347 VanDerWaalsContact O-CA 3.23Å; T2340-V2347 WeakPolarHBondContact O-CA 3.33Å; V2347-I2349 HydrophobicContact CG1-CD1 4.1Å; V2347-I2349 HydrophobicContact CG1-CG1 4.16Å; V2347-I2364 CarbonylContact O-C 3.53Å; V2347-I2364 WeakPolarHBondContact O-CA 3.24Å; V2347-I2365 HydrophobicContact CB-CB 4.3Å; V2347-I2365 PolarHBondContact N-O 2.98Å; V2347-I2365 PolarHBondContact O-N 3.01Å; V2347-A2368 HydrophobicContact CB-CB 4.26Å; V2347-A2368 HydrophobicContact CG2-CB 3.69Å; V2347-I2373 HydrophobicContact CG2-CD1 3.44Å; V2347-I2373 VanDerWaalsContact CG2-CD1 3.5Å; V2347-L2376 HydrophobicContact CG2-CD2 4.32Å; V2347-L2392 HydrophobicContact CG1-CD2 3.71Å; V2347-V2394 HydrophobicContact CG2-CG1 4.38Å; V2347-V2394 HydrophobicContact CG2-CG2 4.25Å
2348	A	93.8	Very high	89.6	Confident	0.25 Å²	0.25	32.9 Å²	32.9	0%	0.002	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	137.3	169	0	0	0	0	0	109.9	A2339 T2340 Y2350 L2361 I2364	A2339-A2348 CarbonylContact C-O 3.6Å; A2339-A2348 WeakPolarHBondContact CA-O 3.34Å; T2340-A2348 PolarHBondContact N-O 2.89Å; T2340-A2348 PolarHBondContact O-N 3.25Å; A2348-Y2350 HydrophobicContact CB-CE2 3.78Å; A2348-L2361 HydrophobicContact CB-CD1 4.14Å; A2348-I2364 HydrophobicContact CB-CG1 4.28Å
2349	I	93	Very high	89.4	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	122.5	178	-62.7	173.9	0	0	0	108.4	F2337 I2338 A2339 V2347 Q2362 Y2363 I2365 W2378 L2392 I2406	F2337-I2349 HydrophobicContact CD1-CG2 4.22Å; I2338-I2349 CarbonylContact O-C 3.49Å; I2338-I2349 WeakPolarHBondContact O-CA 3.3Å; A2339-I2349 HydrophobicContact CB-CD1 3.54Å; A2339-I2349 HydrophobicContact CB-CG1 4.32Å; V2347-I2349 HydrophobicContact CG1-CD1 4.1Å; V2347-I2349 HydrophobicContact CG1-CG1 4.16Å; I2349-Q2362 WeakPolarHBondContact O-CA 3.23Å; I2349-Q2362 WeakPolarHBondContact O-CB 3.15Å; I2349-Q2362 PolarHBondContact O-N 2.91Å; I2349-Y2363 HydrophobicContact CB-CD2 4.32Å; I2349-Y2363 HydrophobicContact CB-CE1 4.45Å; I2349-Y2363 HydrophobicContact CB-CE2 3.9Å; I2349-Y2363 HydrophobicContact CD1-CD2 4.25Å; I2349-Y2363 HydrophobicContact CD1-CE2 3.18Å; I2349-Y2363 HydrophobicContact CG1-CD2 4.2Å; I2349-Y2363 HydrophobicContact CG1-CE2 3.85Å; I2349-Y2363 HydrophobicContact CG2-CD2 4.41Å; I2349-Y2363 HydrophobicContact CG2-CE1 4.17Å; I2349-Y2363 HydrophobicContact CG2-CE2 4.2Å; I2349-Y2363 WeakPolarHBondContact CG2-OH 3.34Å; I2349-Y2363 PolarHBondContact N-O 3.13Å; I2349-Y2363 PolarHBondContact O-N 2.89Å; I2349-Y2363 VanDerWaalsContact O-N 3.14Å; I2349-I2365 HydrophobicContact CD1-CD1 3.83Å; I2349-I2365 HydrophobicContact CD1-CG1 4.31Å; I2349-W2378 HydrophobicContact CD1-CH2 4.22Å; I2349-W2378 HydrophobicContact CD1-CZ2 4.28Å; I2349-W2378 HydrophobicContact CG1-CH2 4.39Å; I2349-W2378 HydrophobicContact CG2-CH2 4.31Å; I2349-L2392 HydrophobicContact CD1-CD2 4.05Å; I2349-L2392 HydrophobicContact CG1-CD2 4.49Å; I2349-I2406 HydrophobicContact CD1-CD1 3.72Å; I2349-I2406 HydrophobicContact CD1-CG1 4.22Å; I2349-I2406 HydrophobicContact CG1-CD1 4.19Å; I2349-I2406 HydrophobicContact CG2-CD1 4.37Å
2350	Y	92.4	Very high	89.2	Confident	0.25 Å²	0.25	37.4 Å²	37.4	0%	0.001	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	143.6	176.9	-48.6	-95.8	0	0	0	109.2	F2321 E2323 F2337 I2338 T2340 A2348 V2359 T2360 L2361	F2321-Y2350 HydrophobicContact CB-CE1 4.03Å; F2321-Y2350 HydrophobicContact CD1-CD1 4.4Å; F2321-Y2350 AromaticContact CD1-CE1 3.81Å; F2321-Y2350 HydrophobicContact CD1-CE1 4Å; F2321-Y2350 HydrophobicContact CD2-CE1 4.42Å; F2321-Y2350 HydrophobicContact CE1-CE1 4.5Å; F2321-Y2350 HydrophobicContact CG-CD1 4.41Å; F2321-Y2350 AromaticContact CG-CE1 3.9Å; F2321-Y2350 HydrophobicContact CG-CE1 3.9Å; E2323-Y2350 HydrophobicContact CG-CE1 4.11Å; E2323-Y2350 WeakPolarHBondContact CG-OH 3.43Å; F2337-Y2350 WeakPolarHBondContact CA-O 3.39Å; I2338-Y2350 HydrophobicContact CB-CD2 4.34Å; I2338-Y2350 HydrophobicContact CG2-CD2 4.33Å; I2338-Y2350 PolarHBondContact N-O 3.01Å; I2338-Y2350 PolarHBondContact O-N 3.07Å; T2340-Y2350 HydrophobicContact CG2-CD2 4.48Å; T2340-Y2350 HydrophobicContact CG2-CE2 4.02Å; T2340-Y2350 WeakPolarHBondContact OG1-CE2 3.45Å; A2348-Y2350 HydrophobicContact CB-CE2 3.78Å; Y2350-V2359 HydrophobicContact CD1-CG1 4.32Å; Y2350-V2359 HydrophobicContact CG-CG1 4.29Å; Y2350-T2360 CarbonylContact C-O 3.54Å; Y2350-T2360 VanDerWaalsContact CA-O 3.29Å; Y2350-T2360 WeakPolarHBondContact CA-O 3.3Å; Y2350-L2361 HydrophobicContact CD1-CB 4Å; Y2350-L2361 HydrophobicContact CD1-CD1 3.8Å; Y2350-L2361 HydrophobicContact CD1-CG 4.49Å; Y2350-L2361 HydrophobicContact CE1-CB 4.12Å; Y2350-L2361 HydrophobicContact CE1-CD1 3.52Å; Y2350-L2361 VanDerWaalsContact CE1-CD1 3.48Å; Y2350-L2361 HydrophobicContact CE1-CG 4.4Å; Y2350-L2361 HydrophobicContact CG-CD1 4.44Å
2351	K	89.7	Confident	89	Confident	81.75 Å²	81.75	40.5 Å²	40.5	36%	0.355	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	130.9	166.5	-171.6	-177.8	179.2	-171.1	0	108.4	D2336 F2337 V2359 T2360 Q2362	D2336-K2351 HydrophobicContact CB-CG 4.27Å; D2336-K2351 CarbonylContact O-C 3.58Å; D2336-K2351 WeakPolarHBondContact O-CA 3.29Å; D2336-K2351 IonicContact OD2-NZ 3.68Å; F2337-K2351 HydrophobicContact CD1-CB 4.26Å; F2337-K2351 HydrophobicContact CD1-CG 4.35Å; F2337-K2351 HydrophobicContact CE1-CB 4.1Å; F2337-K2351 HydrophobicContact CE1-CD 4.3Å; F2337-K2351 HydrophobicContact CE1-CG 3.97Å; F2337-K2351 HydrophobicContact CZ-CG 4.47Å; K2351-V2359 WeakPolarHBondContact O-CA 3.38Å; K2351-T2360 PolarHBondContact N-O 3.24Å; K2351-T2360 PolarHBondContact O-N 2.92Å; K2351-T2360 PolarHBondContact O-OG1 2.98Å; K2351-T2360 VanDerWaalsContact O-OG1 3.13Å; K2351-Q2362 HydrophobicContact CB-CB 4.48Å
2352	Y	88.9	Confident	88.6	Confident	17.25 Å²	17.25	43 Å²	43	7%	0.068	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	156.2	171.5	76	-91.2	0	0	0	111.2	S2289 I2292 F2306 V2333 M2335 D2336 I2338 T2358	S2289-Y2352 PolarHBondContact OG-OH 2.87Å; I2292-Y2352 HydrophobicContact CD1-CD1 3.97Å; I2292-Y2352 HydrophobicContact CD1-CD2 3.86Å; I2292-Y2352 HydrophobicContact CD1-CE1 4.08Å; I2292-Y2352 HydrophobicContact CD1-CE2 4.02Å; I2292-Y2352 HydrophobicContact CD1-CG 3.81Å; I2292-Y2352 HydrophobicContact CG2-CE1 4.3Å; I2292-Y2352 HydrophobicContact CG2-CE2 4.29Å; F2306-Y2352 HydrophobicContact CE1-CD2 4.08Å; F2306-Y2352 HydrophobicContact CZ-CD2 4.41Å; V2333-Y2352 HydrophobicContact CG1-CE1 4.07Å; M2335-Y2352 WeakPolarHBondContact O-CE1 3.37Å; M2335-Y2352 PolarHBondContact O-OH 2.92Å; D2336-Y2352 VanDerWaalsContact C-CD1 3.42Å; D2336-Y2352 WeakPolarHBondContact O-CD1 3.35Å; D2336-Y2352 PolarHBondContact O-N 3.05Å; I2338-Y2352 HydrophobicContact CD1-CD1 4.03Å; I2338-Y2352 HydrophobicContact CD1-CE1 4.49Å; I2338-Y2352 HydrophobicContact CG1-CD1 3.82Å; I2338-Y2352 HydrophobicContact CG1-CE1 4.19Å; Y2352-T2358 VanDerWaalsContact CA-O 3.3Å; Y2352-T2358 WeakPolarHBondContact CA-O 3.37Å
2353	D	84.7	Confident	88.3	Confident	65.25 Å²	65.25	44.5 Å²	44.5	35%	0.349	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	118.6	171.2	169.9	22.7	0	0	0	108.1	N2355 S2356 T2357 T2358	D2353-N2355 VanDerWaalsContact C-N 3.29Å; D2353-N2355 PolarHBondContact O-N 2.86Å; D2353-N2355 WeakPolarHBondContact OD1-CB 3.35Å; D2353-N2355 PolarHBondContact OD1-N 3.06Å; D2353-N2355 VanDerWaalsContact OD1-N 3.13Å; D2353-S2356 WeakPolarHBondContact CB-OG 3.36Å; D2353-S2356 VanDerWaalsContact CG-OG 3.25Å; D2353-S2356 VanDerWaalsContact OD2-CB 3.25Å; D2353-S2356 WeakPolarHBondContact OD2-CB 3.4Å; D2353-S2356 PolarHBondContact OD2-N 3.11Å; D2353-S2356 PolarHBondContact OD2-OG 2.99Å; D2353-T2357 WeakPolarHBondContact O-CA 3.24Å; D2353-T2357 PolarHBondContact O-N 3.1Å; D2353-T2358 PolarHBondContact N-O 3.09Å; D2353-T2358 PolarHBondContact O-N 2.94Å
2354	S	77.4	Confident	88.2	Confident	49.75 Å²	49.75	43.3 Å²	43.3	35%	0.348	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-35.9	-178.1	51.7	0	0	0	0	111.9	T2357	S2354-T2357 WeakPolarHBondContact O-CG2 3.4Å; S2354-T2357 PolarHBondContact O-N 2.76Å
2355	N	78.3	Confident	88.1	Confident	149.25 Å²	149.25	42.4 Å²	42.4	80%	0.798	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-44.6	-175	-68	-17.1	0	0	0	111.7	D2353 T2357	D2353-N2355 VanDerWaalsContact C-N 3.29Å; D2353-N2355 PolarHBondContact O-N 2.86Å; D2353-N2355 WeakPolarHBondContact OD1-CB 3.35Å; D2353-N2355 PolarHBondContact OD1-N 3.06Å; D2353-N2355 VanDerWaalsContact OD1-N 3.13Å; N2355-T2357 VanDerWaalsContact C-N 3.32Å
2356	S	80.1	Confident	87.9	Confident	49.75 Å²	49.75	46.2 Å²	46.2	35%	0.348	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-11.8	176.8	62.7	0	0	0	0	113.3	D2353 T2358	D2353-S2356 WeakPolarHBondContact CB-OG 3.36Å; D2353-S2356 VanDerWaalsContact CG-OG 3.25Å; D2353-S2356 VanDerWaalsContact OD2-CB 3.25Å; D2353-S2356 WeakPolarHBondContact OD2-CB 3.4Å; D2353-S2356 PolarHBondContact OD2-N 3.11Å; D2353-S2356 PolarHBondContact OD2-OG 2.99Å; S2356-T2358 WeakPolarHBondContact O-CG2 3.37Å; S2356-T2358 PolarHBondContact O-N 3.35Å; S2356-T2358 PolarHBondContact OG-OG1 3.21Å
2357	T	81.9	Confident	87.6	Confident	45 Å²	45	50.8 Å²	50.8	28%	0.276	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.8	44.3	-171.5	64.8	0	0	0	0	111.5	F2306 K2317 F2319 D2353 S2354 N2355	F2306-T2357 HydrophobicContact CD1-CG2 4.3Å; F2306-T2357 HydrophobicContact CG-CG2 4.42Å; K2317-T2357 WeakPolarHBondContact CD-OG1 3.36Å; K2317-T2357 PolarHBondContact NZ-O 2.88Å; K2317-T2357 PolarHBondContact NZ-OG1 3.02Å; F2319-T2357 VanDerWaalsContact CE2-O 3.24Å; F2319-T2357 WeakPolarHBondContact CE2-O 3.37Å; F2319-T2357 WeakPolarHBondContact CZ-O 3.18Å; D2353-T2357 WeakPolarHBondContact O-CA 3.24Å; D2353-T2357 PolarHBondContact O-N 3.1Å; S2354-T2357 WeakPolarHBondContact O-CG2 3.4Å; S2354-T2357 PolarHBondContact O-N 2.76Å; N2355-T2357 VanDerWaalsContact C-N 3.32Å
2358	T	85.7	Confident	87.2	Confident	62 Å²	62	50.8 Å²	50.8	38%	0.38	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	149.9	177.8	65.3	0	0	0	0	110.7	Y2352 D2353 S2356	Y2352-T2358 VanDerWaalsContact CA-O 3.3Å; Y2352-T2358 WeakPolarHBondContact CA-O 3.37Å; D2353-T2358 PolarHBondContact N-O 3.09Å; D2353-T2358 PolarHBondContact O-N 2.94Å; S2356-T2358 WeakPolarHBondContact O-CG2 3.37Å; S2356-T2358 PolarHBondContact O-N 3.35Å; S2356-T2358 PolarHBondContact OG-OG1 3.21Å
2359	V	88.4	Confident	86.9	Confident	15 Å²	15	51 Å²	51	9%	0.091	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	132	175.6	-178.4	0	0	0	0	107.4	V2304 F2306 F2319 F2321 I2338 Y2350 K2351	V2304-V2359 HydrophobicContact CB-CG2 4.48Å; V2304-V2359 HydrophobicContact CG1-CG2 3.97Å; F2306-V2359 HydrophobicContact CE2-CG2 3.56Å; F2306-V2359 VanDerWaalsContact CE2-CG2 3.48Å; F2306-V2359 HydrophobicContact CZ-CG2 3.54Å; F2306-V2359 VanDerWaalsContact CZ-CG2 3.48Å; F2319-V2359 HydrophobicContact CD2-CG2 4.44Å; F2321-V2359 HydrophobicContact CE1-CG1 4.49Å; F2321-V2359 HydrophobicContact CE2-CB 3.95Å; F2321-V2359 HydrophobicContact CE2-CG1 3.76Å; F2321-V2359 HydrophobicContact CE2-CG2 4.48Å; F2321-V2359 HydrophobicContact CZ-CB 3.63Å; F2321-V2359 HydrophobicContact CZ-CG1 3.68Å; F2321-V2359 HydrophobicContact CZ-CG2 4.47Å; I2338-V2359 HydrophobicContact CD1-CG1 4.38Å; Y2350-V2359 HydrophobicContact CD1-CG1 4.32Å; Y2350-V2359 HydrophobicContact CG-CG1 4.29Å; K2351-V2359 WeakPolarHBondContact O-CA 3.38Å
2360	T	89.8	Confident	86.6	Confident	79 Å²	79	58.7 Å²	58.7	49%	0.485	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	133.7	-179.3	54.5	0	0	0	0	109.6	Y2350 K2351 Q2362	Y2350-T2360 CarbonylContact C-O 3.54Å; Y2350-T2360 VanDerWaalsContact CA-O 3.29Å; Y2350-T2360 WeakPolarHBondContact CA-O 3.3Å; K2351-T2360 PolarHBondContact N-O 3.24Å; K2351-T2360 PolarHBondContact O-N 2.92Å; K2351-T2360 PolarHBondContact O-OG1 2.98Å; K2351-T2360 VanDerWaalsContact O-OG1 3.13Å; T2360-Q2362 PolarHBondContact O-N 2.97Å
2361	L	90.1	Very high	86.5	Confident	65 Å²	65	61 Å²	61	34%	0.34	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	127.3	171.1	179	70.5	0	0	0	109.1	E2323 A2348 Y2350 I2364	E2323-L2361 HydrophobicContact CG-CD1 4.28Å; E2323-L2361 HydrophobicContact CG-CD2 4.06Å; A2348-L2361 HydrophobicContact CB-CD1 4.14Å; Y2350-L2361 HydrophobicContact CD1-CB 4Å; Y2350-L2361 HydrophobicContact CD1-CD1 3.8Å; Y2350-L2361 HydrophobicContact CD1-CG 4.49Å; Y2350-L2361 HydrophobicContact CE1-CB 4.12Å; Y2350-L2361 HydrophobicContact CE1-CD1 3.52Å; Y2350-L2361 VanDerWaalsContact CE1-CD1 3.48Å; Y2350-L2361 HydrophobicContact CE1-CG 4.4Å; Y2350-L2361 HydrophobicContact CG-CD1 4.44Å; L2361-I2364 HydrophobicContact CD1-CG1 4.15Å; L2361-I2364 HydrophobicContact CD2-CD1 4.1Å; L2361-I2364 HydrophobicContact CD2-CG1 4.18Å
2362	Q	86.2	Confident	86.5	Confident	52.75 Å²	52.75	62.9 Å²	62.9	25%	0.246	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	-46.8	-178.2	-160.3	164.1	8.2	0	0	111.8	F2337 I2349 K2351 T2360 S2408	F2337-Q2362 VanDerWaalsContact CE1-OE1 3.25Å; I2349-Q2362 WeakPolarHBondContact O-CA 3.23Å; I2349-Q2362 WeakPolarHBondContact O-CB 3.15Å; I2349-Q2362 PolarHBondContact O-N 2.91Å; K2351-Q2362 HydrophobicContact CB-CB 4.48Å; T2360-Q2362 PolarHBondContact O-N 2.97Å; Q2362-S2408 PolarHBondContact NE2-O 3.17Å
2363	Y	87	Confident	86.6	Confident	32 Å²	32	62.1 Å²	62.1	13%	0.125	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	157.8	176.5	-0.9	-78.2	0	0	0	111.6	I2349 I2365 I2406 K2407 S2408 K2409 Y2411	I2349-Y2363 HydrophobicContact CB-CD2 4.32Å; I2349-Y2363 HydrophobicContact CB-CE1 4.45Å; I2349-Y2363 HydrophobicContact CB-CE2 3.9Å; I2349-Y2363 HydrophobicContact CD1-CD2 4.25Å; I2349-Y2363 HydrophobicContact CD1-CE2 3.18Å; I2349-Y2363 HydrophobicContact CG1-CD2 4.2Å; I2349-Y2363 HydrophobicContact CG1-CE2 3.85Å; I2349-Y2363 HydrophobicContact CG2-CD2 4.41Å; I2349-Y2363 HydrophobicContact CG2-CE1 4.17Å; I2349-Y2363 HydrophobicContact CG2-CE2 4.2Å; I2349-Y2363 WeakPolarHBondContact CG2-OH 3.34Å; I2349-Y2363 PolarHBondContact N-O 3.13Å; I2349-Y2363 PolarHBondContact O-N 2.89Å; I2349-Y2363 VanDerWaalsContact O-N 3.14Å; Y2363-I2365 HydrophobicContact CD2-CG1 4.08Å; Y2363-I2365 HydrophobicContact CE2-CD1 4.31Å; Y2363-I2365 HydrophobicContact CE2-CG1 4.19Å; Y2363-I2406 HydrophobicContact CE2-CG1 4.45Å; Y2363-I2406 HydrophobicContact CE2-CG2 4.32Å; Y2363-I2406 WeakPolarHBondContact OH-CD1 3.39Å; Y2363-I2406 VanDerWaalsContact OH-CG1 3.27Å; Y2363-I2406 WeakPolarHBondContact OH-CG1 3.27Å; Y2363-I2406 WeakPolarHBondContact OH-CG2 3.4Å; Y2363-K2407 PolarHBondContact OH-O 2.75Å; Y2363-S2408 PolarHBondContact OH-O 3.18Å; Y2363-K2409 WeakPolarHBondContact OH-CA 3.39Å; Y2363-K2409 PolarHBondContact OH-N 2.52Å; Y2363-Y2411 AromaticContact CD2-CD1 3.59Å; Y2363-Y2411 HydrophobicContact CD2-CD1 3.59Å; Y2363-Y2411 AromaticContact CD2-CE1 3.92Å; Y2363-Y2411 HydrophobicContact CD2-CE1 4.09Å; Y2363-Y2411 HydrophobicContact CD2-CG 4.43Å; Y2363-Y2411 AromaticContact CE2-CD1 3.52Å; Y2363-Y2411 HydrophobicContact CE2-CD1 3.79Å; Y2363-Y2411 HydrophobicContact CE2-CE1 4.35Å; Y2363-Y2411 HydrophobicContact CE2-CG 4.23Å; Y2363-Y2411 HydrophobicContact CG-CD1 4.3Å
2364	I	90.2	Very high	86.9	Confident	27.5 Å²	27.5	60.9 Å²	60.9	14%	0.141	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	122.5	165.3	-58.2	174.1	0	0	0	107.6	E2323 N2346 V2347 A2348 L2361 Y2366	E2323-I2364 HydrophobicContact CB-CD1 4.33Å; N2346-I2364 HydrophobicContact CB-CG2 4.2Å; V2347-I2364 CarbonylContact O-C 3.53Å; V2347-I2364 WeakPolarHBondContact O-CA 3.24Å; A2348-I2364 HydrophobicContact CB-CG1 4.28Å; L2361-I2364 HydrophobicContact CD1-CG1 4.15Å; L2361-I2364 HydrophobicContact CD2-CD1 4.1Å; L2361-I2364 HydrophobicContact CD2-CG1 4.18Å; I2364-Y2366 HydrophobicContact CB-CE1 4.38Å; I2364-Y2366 HydrophobicContact CB-CE2 4.14Å; I2364-Y2366 HydrophobicContact CG2-CD1 3.95Å; I2364-Y2366 HydrophobicContact CG2-CD2 4.38Å; I2364-Y2366 HydrophobicContact CG2-CE1 3.69Å; I2364-Y2366 HydrophobicContact CG2-CE2 4.19Å; I2364-Y2366 HydrophobicContact CG2-CG 4.31Å; I2364-Y2366 PolarHBondContact O-N 3.02Å
2365	I	90.7	Very high	87.5	Confident	3 Å²	3	59.3 Å²	59.3	2%	0.015	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	95.6	171.4	-53	177.8	0	0	0	106.9	N2346 V2347 I2349 Y2363 A2368 Y2404 Y2411	N2346-I2365 WeakPolarHBondContact CA-O 3.28Å; V2347-I2365 HydrophobicContact CB-CB 4.3Å; V2347-I2365 PolarHBondContact N-O 2.98Å; V2347-I2365 PolarHBondContact O-N 3.01Å; I2349-I2365 HydrophobicContact CD1-CD1 3.83Å; I2349-I2365 HydrophobicContact CD1-CG1 4.31Å; Y2363-I2365 HydrophobicContact CD2-CG1 4.08Å; Y2363-I2365 HydrophobicContact CE2-CD1 4.31Å; Y2363-I2365 HydrophobicContact CE2-CG1 4.19Å; I2365-A2368 HydrophobicContact CB-CB 4.27Å; I2365-A2368 HydrophobicContact CG2-CB 3.79Å; I2365-Y2404 HydrophobicContact CD1-CD1 3.99Å; I2365-Y2404 HydrophobicContact CD1-CE1 4.47Å; I2365-Y2404 HydrophobicContact CD1-CG 4.02Å; I2365-Y2404 HydrophobicContact CG2-CD1 4.45Å; I2365-Y2404 HydrophobicContact CG2-CE1 3.94Å; I2365-Y2411 HydrophobicContact CB-CE2 4.49Å; I2365-Y2411 HydrophobicContact CD1-CD2 4.15Å; I2365-Y2411 HydrophobicContact CD1-CG 4.22Å; I2365-Y2411 HydrophobicContact CG1-CD1 4.19Å; I2365-Y2411 HydrophobicContact CG1-CD2 4.1Å; I2365-Y2411 HydrophobicContact CG1-CE1 4.2Å; I2365-Y2411 HydrophobicContact CG1-CE2 4.1Å; I2365-Y2411 HydrophobicContact CG1-CG 4.15Å; I2365-Y2411 HydrophobicContact CG2-CD2 4.45Å; I2365-Y2411 HydrophobicContact CG2-CE2 3.95Å
2366	Y	89.3	Confident	88.2	Confident	153.25 Å²	153.25	52.6 Å²	52.6	60%	0.601	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	138.8	176	-63.6	-74.9	0	0	0	111.4	N2346 I2364 A2368	N2346-Y2366 VanDerWaalsContact OD1-CA 3.29Å; N2346-Y2366 WeakPolarHBondContact OD1-CA 3.23Å; I2364-Y2366 HydrophobicContact CB-CE1 4.38Å; I2364-Y2366 HydrophobicContact CB-CE2 4.14Å; I2364-Y2366 HydrophobicContact CG2-CD1 3.95Å; I2364-Y2366 HydrophobicContact CG2-CD2 4.38Å; I2364-Y2366 HydrophobicContact CG2-CE1 3.69Å; I2364-Y2366 HydrophobicContact CG2-CE2 4.19Å; I2364-Y2366 HydrophobicContact CG2-CG 4.31Å; I2364-Y2366 PolarHBondContact O-N 3.02Å; Y2366-A2368 VanDerWaalsContact C-N 3.3Å; Y2366-A2368 PolarHBondContact O-N 3.12Å
2367	N	87.7	Confident	88.7	Confident	119.75 Å²	119.75	53.6 Å²	53.6	64%	0.64	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.2	45.8	-178.3	-65	-40.9	0	0	0	112.5	K2345 N2346 S2369	K2345-N2367 CarbonylContact O-C 3.42Å; K2345-N2367 WeakPolarHBondContact O-CA 3.29Å; N2346-N2367 PolarHBondContact OD1-N 2.98Å; N2367-S2369 PolarHBondContact O-N 3.19Å; N2367-S2369 VanDerWaalsContact O-N 3.1Å
2368	A	86.1	Confident	89.1	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.249	C	C	.	.	S	Bend	trans	-58.8	-24.1	176.8	0	0	0	0	0	112.1	K2345 V2347 I2365 Y2366 I2373 R2402 Y2404	K2345-A2368 PolarHBondContact O-N 3.04Å; V2347-A2368 HydrophobicContact CB-CB 4.26Å; V2347-A2368 HydrophobicContact CG2-CB 3.69Å; I2365-A2368 HydrophobicContact CB-CB 4.27Å; I2365-A2368 HydrophobicContact CG2-CB 3.79Å; Y2366-A2368 VanDerWaalsContact C-N 3.3Å; Y2366-A2368 PolarHBondContact O-N 3.12Å; A2368-I2373 HydrophobicContact CB-CD1 4.44Å; A2368-R2402 WeakPolarHBondContact O-CD 3.35Å; A2368-R2402 PolarHBondContact O-NE 2.95Å; A2368-Y2404 WeakPolarHBondContact CA-OH 3.44Å; A2368-Y2404 HydrophobicContact CB-CE2 4.34Å; A2368-Y2404 PolarHBondContact O-OH 3.09Å; A2368-Y2404 VanDerWaalsContact O-OH 3.09Å
2369	S	87.9	Confident	89.1	Confident	4.5 Å²	4.5	48.9 Å²	48.9	3%	0.031	23%	0.231	C	C	.	.	S	Bend	trans	-139.9	166.2	175.3	52.7	0	0	0	0	111.3	N2367 D2371 I2373 S2396	N2367-S2369 PolarHBondContact O-N 3.19Å; N2367-S2369 VanDerWaalsContact O-N 3.1Å; S2369-D2371 VanDerWaalsContact C-N 3.34Å; S2369-D2371 VanDerWaalsContact CB-O 3.27Å; S2369-D2371 WeakPolarHBondContact CB-O 3.43Å; S2369-D2371 PolarHBondContact OG-O 3.21Å; S2369-I2373 VanDerWaalsContact OG-CG1 3.28Å; S2369-I2373 WeakPolarHBondContact OG-CG1 3.33Å; S2369-S2396 VanDerWaalsContact CB-CB 3.47Å; S2369-S2396 WeakPolarHBondContact CB-OG 3.24Å
2370	K	85.9	Confident	88.6	Confident	161.25 Å²	161.25	51.5 Å²	51.5	70%	0.701	24%	0.239	S	C	*	.	S	Bend	trans	-83	-18.8	176.3	-68.1	-177.1	176.9	-180	0	112.9	K2345 D2398	K2345-K2370 WeakPolarHBondContact CD-O 3.47Å; K2345-K2370 VanDerWaalsContact CE-O 3.31Å; K2345-K2370 WeakPolarHBondContact CE-O 3.17Å; K2345-K2370 PolarHBondContact NZ-O 3.14Å; K2370-D2398 HydrophobicContact CB-CB 4.29Å; K2370-D2398 WeakPolarHBondContact CB-OD2 3.38Å; K2370-D2398 PolarHBondContact N-OD2 3.13Å
2371	D	89.7	Confident	87.5	Confident	48.25 Å²	48.25	48.3 Å²	48.3	26%	0.258	22%	0.219	S	C	.	.	S	Bend	trans	-140.1	-176.2	-177.7	-160.5	6.1	0	0	0	110.5	S2369 I2373 N2397 D2398	S2369-D2371 VanDerWaalsContact C-N 3.34Å; S2369-D2371 VanDerWaalsContact CB-O 3.27Å; S2369-D2371 WeakPolarHBondContact CB-O 3.43Å; S2369-D2371 PolarHBondContact OG-O 3.21Å; D2371-I2373 PolarHBondContact O-N 3.12Å; D2371-N2397 HydrophobicContact CB-CB 4.2Å; D2371-N2397 WeakPolarHBondContact OD2-CB 3.28Å; D2371-N2397 PolarHBondContact OD2-ND2 3.27Å; D2371-D2398 HydrophobicContact CB-CB 4.03Å
2372	W	89.8	Confident	86	Confident	121.5 Å²	121.5	49.4 Å²	49.4	46%	0.46	23%	0.225	S	C	.	.			trans	-52.7	138.1	-176.6	-56.1	-16.5	0	0	0	113.1	K2343 S2396 N2397	K2343-W2372 HydrophobicContact CB-CD2 4.5Å; K2343-W2372 HydrophobicContact CB-CG 4.16Å; K2343-W2372 HydrophobicContact CD-CD2 4.06Å; K2343-W2372 HydrophobicContact CD-CE3 4.35Å; K2343-W2372 HydrophobicContact CD-CG 4.38Å; K2343-W2372 HydrophobicContact CD-CZ2 4.33Å; K2343-W2372 HydrophobicContact CG-CB 4.32Å; K2343-W2372 HydrophobicContact CG-CD2 3.99Å; K2343-W2372 HydrophobicContact CG-CE3 4.46Å; K2343-W2372 HydrophobicContact CG-CG 3.86Å; W2372-S2396 CarbonylContact O-C 3.55Å; W2372-S2396 VanDerWaalsContact O-CA 3.3Å; W2372-S2396 WeakPolarHBondContact O-CA 3.31Å; W2372-S2396 VanDerWaalsContact O-CB 3.3Å; W2372-S2396 WeakPolarHBondContact O-CB 3.36Å; W2372-N2397 HydrophobicContact CB-CB 4.47Å; W2372-N2397 PolarHBondContact O-N 3.16Å
2373	I	92.6	Very high	84.3	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	126.3	171.4	-59.7	166.8	0	0	0	107.5	T2329 A2330 N2346 V2347 A2368 S2369 D2371 L2376 V2394	T2329-I2373 VanDerWaalsContact CB-O 3.3Å; T2329-I2373 WeakPolarHBondContact CB-O 3.31Å; T2329-I2373 PolarHBondContact OG1-O 3.26Å; A2330-I2373 HydrophobicContact CB-CG2 4.33Å; N2346-I2373 VanDerWaalsContact O-CD1 3.3Å; N2346-I2373 WeakPolarHBondContact O-CD1 3.4Å; V2347-I2373 HydrophobicContact CG2-CD1 3.44Å; V2347-I2373 VanDerWaalsContact CG2-CD1 3.5Å; A2368-I2373 HydrophobicContact CB-CD1 4.44Å; S2369-I2373 VanDerWaalsContact OG-CG1 3.28Å; S2369-I2373 WeakPolarHBondContact OG-CG1 3.33Å; D2371-I2373 PolarHBondContact O-N 3.12Å; I2373-L2376 HydrophobicContact CG2-CD2 4.05Å; I2373-L2376 HydrophobicContact CG2-CG 4.12Å; I2373-V2394 HydrophobicContact CD1-CG1 4.21Å; I2373-V2394 HydrophobicContact CG1-CG1 4.19Å; I2373-V2394 HydrophobicContact CG2-CG1 4.02Å
2374	I	89.4	Confident	82.4	Confident	39.75 Å²	39.75	60 Å²	60	20%	0.204	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	-34.6	-175.7	-60	170.6	0	0	0	111.1	G2395 N2397 I2424 K2425	I2374-G2395 PolarHBondContact N-O 3.01Å; I2374-N2397 HydrophobicContact CD1-CB 3.65Å; I2374-N2397 HydrophobicContact CG1-CB 4.35Å; I2374-I2424 VanDerWaalsContact CB-O 3.26Å; I2374-I2424 WeakPolarHBondContact CB-O 3.34Å; I2374-I2424 VanDerWaalsContact CD1-O 3.26Å; I2374-I2424 WeakPolarHBondContact CD1-O 3.4Å; I2374-I2424 WeakPolarHBondContact CG2-O 3.28Å; I2374-K2425 HydrophobicContact CG2-CD 4.48Å
2375	S	90.2	Very high	80.2	Confident	16.25 Å²	16.25	67 Å²	67	11%	0.114	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	140.6	-177.2	-167.2	0	0	0	0	111.2	G2395 L2427	S2375-G2395 PolarHBondContact N-O 3.22Å; S2375-G2395 VanDerWaalsContact N-O 3.16Å; S2375-G2395 PolarHBondContact O-N 3.23Å; S2375-L2427 PolarHBondContact OG-N 3.16Å; S2375-L2427 VanDerWaalsContact OG-N 3.09Å
2376	L	93.2	Very high	78.1	Confident	9 Å²	9	72.4 Å²	72.4	5%	0.047	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	139	172.9	-71.1	177.4	0	0	0	108.7	A2330 A2332 A2339 T2340 G2341 V2347 I2373 L2392 L2393 V2394	A2330-L2376 HydrophobicContact CB-CB 4.13Å; A2330-L2376 HydrophobicContact CB-CD1 4.1Å; A2330-L2376 HydrophobicContact CB-CG 3.78Å; A2332-L2376 HydrophobicContact CB-CB 3.83Å; A2339-L2376 HydrophobicContact CB-CD1 4.1Å; T2340-L2376 VanDerWaalsContact C-CD1 3.49Å; G2341-L2376 VanDerWaalsContact N-CD1 3.28Å; V2347-L2376 HydrophobicContact CG2-CD2 4.32Å; I2373-L2376 HydrophobicContact CG2-CD2 4.05Å; I2373-L2376 HydrophobicContact CG2-CG 4.12Å; L2376-L2392 HydrophobicContact CD2-CD1 4.34Å; L2376-L2392 HydrophobicContact CD2-CD2 4.3Å; L2376-L2392 HydrophobicContact CD2-CG 4.39Å; L2376-L2393 WeakPolarHBondContact CA-O 3.35Å; L2376-V2394 HydrophobicContact CD2-CB 4.14Å; L2376-V2394 HydrophobicContact CD2-CG1 4.09Å; L2376-V2394 HydrophobicContact CD2-CG2 3.73Å
2377	K	91.9	Very high	76.3	Confident	71.75 Å²	71.75	69.1 Å²	69.1	31%	0.312	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	138.5	171.4	-164.2	81.7	-171.9	-151.6	0	110	L2393 L2427 D2428 F2429	K2377-L2393 HydrophobicContact CB-CB 4.45Å; K2377-L2393 HydrophobicContact CB-CD1 4.43Å; K2377-L2393 PolarHBondContact N-O 3.19Å; K2377-L2393 VanDerWaalsContact N-O 3.12Å; K2377-L2393 VanDerWaalsContact O-CB 3.29Å; K2377-L2393 WeakPolarHBondContact O-CB 3.29Å; K2377-L2393 PolarHBondContact O-N 3.09Å; K2377-L2427 HydrophobicContact CB-CB 4.44Å; K2377-D2428 WeakPolarHBondContact CE-OD1 3.44Å; K2377-D2428 IonicContact NZ-OD1 3.46Å; K2377-D2428 PolarHBondContact NZ-OD1 3.04Å; K2377-F2429 HydrophobicContact CG-CB 4.16Å
2378	W	90	Very high	75.1	Confident	7 Å²	7	71.4 Å²	71.4	3%	0.027	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	142.6	171.7	-68.3	108.7	0	0	0	110.8	A2332 Q2334 F2337 A2339 I2349 L2390 L2392 I2406	A2332-W2378 VanDerWaalsContact C-NE1 3.33Å; A2332-W2378 HydrophobicContact CB-CG 4.48Å; A2332-W2378 PolarHBondContact O-NE1 3.19Å; Q2334-W2378 HydrophobicContact CB-CB 3.49Å; Q2334-W2378 VanDerWaalsContact CB-CB 3.46Å; Q2334-W2378 VanDerWaalsContact CB-CD1 3.45Å; Q2334-W2378 HydrophobicContact CB-CD2 4.46Å; Q2334-W2378 HydrophobicContact CB-CG 3.57Å; Q2334-W2378 VanDerWaalsContact CB-CG 3.49Å; Q2334-W2378 HydrophobicContact CG-CB 4.04Å; Q2334-W2378 HydrophobicContact CG-CG 4.46Å; F2337-W2378 HydrophobicContact CB-CH2 3.9Å; F2337-W2378 HydrophobicContact CB-CZ2 3.68Å; A2339-W2378 HydrophobicContact CB-CH2 4.27Å; A2339-W2378 HydrophobicContact CB-CZ2 3.47Å; A2339-W2378 VanDerWaalsContact CB-CZ2 3.45Å; I2349-W2378 HydrophobicContact CD1-CH2 4.22Å; I2349-W2378 HydrophobicContact CD1-CZ2 4.28Å; I2349-W2378 HydrophobicContact CG1-CH2 4.39Å; I2349-W2378 HydrophobicContact CG2-CH2 4.31Å; W2378-L2390 HydrophobicContact CD2-CD1 4.33Å; W2378-L2390 HydrophobicContact CD2-CD2 4.41Å; W2378-L2390 HydrophobicContact CE3-CD1 4.02Å; W2378-L2390 HydrophobicContact CE3-CD2 3.75Å; W2378-L2390 HydrophobicContact CE3-CG 3.69Å; W2378-L2390 HydrophobicContact CH2-CD2 4.16Å; W2378-L2390 HydrophobicContact CZ3-CD1 4.13Å; W2378-L2390 HydrophobicContact CZ3-CD2 3.5Å; W2378-L2390 VanDerWaalsContact CZ3-CD2 3.46Å; W2378-L2390 HydrophobicContact CZ3-CG 3.79Å; W2378-L2392 HydrophobicContact CD2-CD1 3.79Å; W2378-L2392 HydrophobicContact CE3-CB 3.96Å; W2378-L2392 HydrophobicContact CE3-CD1 3.88Å; W2378-L2392 HydrophobicContact CE3-CG 4.49Å; W2378-L2392 HydrophobicContact CG-CD1 4.39Å; W2378-L2392 HydrophobicContact CH2-CB 4.36Å; W2378-L2392 HydrophobicContact CH2-CD1 4.27Å; W2378-L2392 HydrophobicContact CZ2-CD1 4.17Å; W2378-L2392 HydrophobicContact CZ3-CB 3.78Å; W2378-L2392 HydrophobicContact CZ3-CD1 4.13Å; W2378-L2392 HydrophobicContact CZ3-CG 4.43Å; W2378-I2406 HydrophobicContact CE3-CD1 4.44Å; W2378-I2406 HydrophobicContact CH2-CD1 3.43Å; W2378-I2406 VanDerWaalsContact CH2-CD1 3.46Å; W2378-I2406 HydrophobicContact CZ3-CD1 3.27Å; W2378-I2406 HydrophobicContact CZ3-CG1 4.35Å
2379	S	85.2	Confident	74.3	Confident	1 Å²	1	73.4 Å²	73.4	1%	0.007	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	145.4	173.1	64.1	0	0	0	0	110.3	T2391 F2429	S2379-T2391 WeakPolarHBondContact CA-O 3.44Å; S2379-T2391 PolarHBondContact N-O 3.15Å; S2379-T2391 PolarHBondContact O-N 3.07Å; S2379-T2391 VanDerWaalsContact O-O 3.08Å; S2379-T2391 VanDerWaalsContact OG-CB 3.31Å; S2379-T2391 WeakPolarHBondContact OG-CB 3.38Å; S2379-T2391 PolarHBondContact OG-O 3.19Å; S2379-F2429 VanDerWaalsContact CA-CD1 3.49Å
2380	Y	77.7	Confident	74	Confident	69.25 Å²	69.25	74 Å²	74	27%	0.272	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	128.4	174.7	36.4	-84.1	0	0	0	108.8	Q2334 M2335 L2382 L2390 F2429	Q2334-Y2380 VanDerWaalsContact CD-CE2 3.41Å; Q2334-Y2380 HydrophobicContact CG-CE2 4.21Å; Q2334-Y2380 WeakPolarHBondContact CG-OH 3.31Å; M2335-Y2380 HydrophobicContact CE-CE1 4.32Å; M2335-Y2380 HydrophobicContact CE-CG 4.33Å; M2335-Y2380 WeakPolarHBondContact CG-OH 3.16Å; M2335-Y2380 HydrophobicContact SD-CE1 3.9Å; M2335-Y2380 PolarHBondContact SD-OH 3.28Å; Y2380-L2382 HydrophobicContact CD2-CD1 3.95Å; Y2380-L2382 HydrophobicContact CE2-CD1 3.9Å; Y2380-L2390 HydrophobicContact CD1-CD1 4.3Å; Y2380-L2390 HydrophobicContact CE1-CD1 3.65Å; Y2380-F2429 HydrophobicContact CD1-CE1 4.18Å; Y2380-F2429 HydrophobicContact CE1-CE1 4.27Å; Y2380-F2429 HydrophobicContact CG-CE1 4.44Å; Y2380-F2429 WeakPolarHBondContact O-CZ 3.41Å
2381	I	67.5	Low	74.1	Confident	11 Å²	11	66.5 Å²	66.5	6%	0.056	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	117.4	173.5	-59.1	165.6	0	0	0	106.7	Y2383 K2389 T2391 F2431 Y2448	I2381-Y2383 VanDerWaalsContact C-N 3.26Å; I2381-Y2383 HydrophobicContact CG2-CD2 4.41Å; I2381-Y2383 PolarHBondContact O-N 2.85Å; I2381-K2389 PolarHBondContact N-O 3.13Å; I2381-K2389 VanDerWaalsContact N-O 3.16Å; I2381-K2389 PolarHBondContact O-N 2.58Å; I2381-T2391 HydrophobicContact CD1-CG2 4.21Å; I2381-F2431 HydrophobicContact CG2-CE2 4.22Å; I2381-Y2448 HydrophobicContact CD1-CD2 4.36Å; I2381-Y2448 HydrophobicContact CD1-CE2 3.65Å; I2381-Y2448 HydrophobicContact CG1-CE2 4.37Å; I2381-Y2448 HydrophobicContact CG2-CE1 4.26Å
2382	L	57.5	Low	74.2	Confident	88.25 Å²	88.25	64.2 Å²	64.2	46%	0.462	30%	0.299	S	S	.	.			trans	-69.8	100	167.5	-85.2	114.7	0	0	0	108.4	Y2380 R2388 F2431	Y2380-L2382 HydrophobicContact CD2-CD1 3.95Å; Y2380-L2382 HydrophobicContact CE2-CD1 3.9Å; L2382-R2388 HydrophobicContact CD2-CG 3.91Å; L2382-F2431 HydrophobicContact CD1-CD1 4.43Å
2383	Y	50	Low	74.3	Confident	130.25 Å²	130.25	58.4 Å²	58.4	51%	0.511	28%	0.278	S	S	.	.			trans	-107	113.7	167.1	-148.6	-89.8	0	0	0	107.5	I2381 M2385 D2387 K2389	I2381-Y2383 VanDerWaalsContact C-N 3.26Å; I2381-Y2383 HydrophobicContact CG2-CD2 4.41Å; I2381-Y2383 PolarHBondContact O-N 2.85Å; Y2383-M2385 PolarHBondContact O-N 2.93Å; Y2383-D2387 PolarHBondContact N-O 2.62Å; Y2383-D2387 PolarHBondContact O-N 3.36Å; Y2383-K2389 HydrophobicContact CG-CD 4.32Å; Y2383-K2389 PolarHBondContact O-NZ 3.29Å
2384	K	48	Very low	74.3	Confident	178 Å²	178	58.4 Å²	58.4	77%	0.774	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	32.8	110.8	-176.6	-69.5	-174.5	175.3	-173.7	0	112.5	S2386 D2387	K2384-S2386 WeakPolarHBondContact O-CA 3.28Å; K2384-S2386 PolarHBondContact O-N 3.24Å; K2384-S2386 PolarHBondContact O-OG 3.16Å; K2384-D2387 PolarHBondContact O-N 3.13Å; K2384-D2387 VanDerWaalsContact O-N 3.13Å
2385	M	44.5	Very low	74.4	Confident	173.75 Å²	173.75	56.5 Å²	56.5	86%	0.856	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-3.9	-37.7	-176.2	-76.4	-66.4	-161	0	0	119.3	Y2383	Y2383-M2385 PolarHBondContact O-N 2.93Å
2386	S	46.1	Very low	74.4	Confident	116 Å²	116	55.7 Å²	55.7	81%	0.811	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-19.2	-177.3	59	0	0	0	0	117	K2384	K2384-S2386 WeakPolarHBondContact O-CA 3.28Å; K2384-S2386 PolarHBondContact O-N 3.24Å; K2384-S2386 PolarHBondContact O-OG 3.16Å
2387	D	52.3	Low	74.1	Confident	85 Å²	85	58.2 Å²	58.2	46%	0.455	28%	0.276	S	S	.	.			trans	-122.8	67.5	-167.4	-156.5	23.5	0	0	0	112.7	Y2383 K2384 K2389	Y2383-D2387 PolarHBondContact N-O 2.62Å; Y2383-D2387 PolarHBondContact O-N 3.36Å; K2384-D2387 PolarHBondContact O-N 3.13Å; K2384-D2387 VanDerWaalsContact O-N 3.13Å; D2387-K2389 WeakPolarHBondContact O-CD 3.43Å; D2387-K2389 PolarHBondContact O-N 2.93Å; D2387-K2389 VanDerWaalsContact O-N 3.14Å; D2387-K2389 PolarHBondContact O-NZ 3.23Å; D2387-K2389 WeakPolarHBondContact OD1-CE 3.32Å; D2387-K2389 IonicContact OD1-NZ 3.31Å; D2387-K2389 WeakPolarHBondContact OD2-CE 3.29Å; D2387-K2389 IonicContact OD2-NZ 3.06Å; D2387-K2389 PolarHBondContact OD2-NZ 2.92Å; D2387-K2389 VanDerWaalsContact OD2-NZ 3.15Å
2388	R	60.7	Low	73.9	Confident	168.25 Å²	168.25	56.2 Å²	56.2	64%	0.635	27%	0.269	S	S	*	.			trans	-65	113.8	176.5	-68.4	-175.5	-178.7	-177.1	-0.6	110.3	L2382	L2382-R2388 HydrophobicContact CD2-CG 3.91Å
2389	K	70.1	Confident	73.7	Confident	41.75 Å²	41.75	59.8 Å²	59.8	18%	0.182	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	110.2	179.3	-73.5	154.9	-170.7	161.6	0	110.5	I2381 Y2383 D2387 T2391 R2405	I2381-K2389 PolarHBondContact N-O 3.13Å; I2381-K2389 VanDerWaalsContact N-O 3.16Å; I2381-K2389 PolarHBondContact O-N 2.58Å; Y2383-K2389 HydrophobicContact CG-CD 4.32Å; Y2383-K2389 PolarHBondContact O-NZ 3.29Å; D2387-K2389 WeakPolarHBondContact O-CD 3.43Å; D2387-K2389 PolarHBondContact O-N 2.93Å; D2387-K2389 VanDerWaalsContact O-N 3.14Å; D2387-K2389 PolarHBondContact O-NZ 3.23Å; D2387-K2389 WeakPolarHBondContact OD1-CE 3.32Å; D2387-K2389 IonicContact OD1-NZ 3.31Å; D2387-K2389 WeakPolarHBondContact OD2-CE 3.29Å; D2387-K2389 IonicContact OD2-NZ 3.06Å; D2387-K2389 PolarHBondContact OD2-NZ 2.92Å; D2387-K2389 VanDerWaalsContact OD2-NZ 3.15Å; K2389-T2391 PolarHBondContact O-N 3.08Å; K2389-T2391 PolarHBondContact O-OG1 2.88Å; K2389-R2405 VanDerWaalsContact CD-NH2 3.34Å; K2389-R2405 VanDerWaalsContact CE-NH2 3.3Å
2390	L	82.8	Confident	73.9	Confident	17 Å²	17	61.3 Å²	61.3	9%	0.089	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	129.3	175.1	-164.2	72.1	0	0	0	110.7	M2335 F2337 W2378 Y2380 I2406	M2335-L2390 HydrophobicContact SD-CD1 4.16Å; F2337-L2390 HydrophobicContact CB-CD2 4.32Å; F2337-L2390 HydrophobicContact CD2-CD2 3.4Å; F2337-L2390 VanDerWaalsContact CD2-CD2 3.44Å; F2337-L2390 HydrophobicContact CE2-CD2 3.93Å; F2337-L2390 HydrophobicContact CG-CD2 4.04Å; W2378-L2390 HydrophobicContact CD2-CD1 4.33Å; W2378-L2390 HydrophobicContact CD2-CD2 4.41Å; W2378-L2390 HydrophobicContact CE3-CD1 4.02Å; W2378-L2390 HydrophobicContact CE3-CD2 3.75Å; W2378-L2390 HydrophobicContact CE3-CG 3.69Å; W2378-L2390 HydrophobicContact CH2-CD2 4.16Å; W2378-L2390 HydrophobicContact CZ3-CD1 4.13Å; W2378-L2390 HydrophobicContact CZ3-CD2 3.5Å; W2378-L2390 VanDerWaalsContact CZ3-CD2 3.46Å; W2378-L2390 HydrophobicContact CZ3-CG 3.79Å; Y2380-L2390 HydrophobicContact CD1-CD1 4.3Å; Y2380-L2390 HydrophobicContact CE1-CD1 3.65Å; L2390-I2406 PolarHBondContact O-N 3.11Å; L2390-I2406 VanDerWaalsContact O-N 3.1Å
2391	T	87.9	Confident	74.5	Confident	2.75 Å²	2.75	58 Å²	58	2%	0.017	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	129.1	179	-54.6	0	0	0	0	108.9	S2379 I2381 K2389 L2403 Y2404	S2379-T2391 WeakPolarHBondContact CA-O 3.44Å; S2379-T2391 PolarHBondContact N-O 3.15Å; S2379-T2391 PolarHBondContact O-N 3.07Å; S2379-T2391 VanDerWaalsContact O-O 3.08Å; S2379-T2391 VanDerWaalsContact OG-CB 3.31Å; S2379-T2391 WeakPolarHBondContact OG-CB 3.38Å; S2379-T2391 PolarHBondContact OG-O 3.19Å; I2381-T2391 HydrophobicContact CD1-CG2 4.21Å; K2389-T2391 PolarHBondContact O-N 3.08Å; K2389-T2391 PolarHBondContact O-OG1 2.88Å; T2391-L2403 HydrophobicContact CG2-CB 3.99Å; T2391-L2403 HydrophobicContact CG2-CD2 4.48Å; T2391-L2403 HydrophobicContact CG2-CG 4.38Å; T2391-Y2404 CarbonylContact C-O 3.56Å; T2391-Y2404 WeakPolarHBondContact CA-O 3.22Å; T2391-Y2404 WeakPolarHBondContact CG2-O 3.38Å
2392	L	91.3	Very high	75.6	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	129.4	175.8	-178.2	67.7	0	0	0	110	A2339 V2347 I2349 L2376 W2378 V2394 L2403 Y2404 I2406	A2339-L2392 HydrophobicContact CB-CD1 3.72Å; A2339-L2392 HydrophobicContact CB-CD2 3.85Å; A2339-L2392 HydrophobicContact CB-CG 4.47Å; V2347-L2392 HydrophobicContact CG1-CD2 3.71Å; I2349-L2392 HydrophobicContact CD1-CD2 4.05Å; I2349-L2392 HydrophobicContact CG1-CD2 4.49Å; L2376-L2392 HydrophobicContact CD2-CD1 4.34Å; L2376-L2392 HydrophobicContact CD2-CD2 4.3Å; L2376-L2392 HydrophobicContact CD2-CG 4.39Å; W2378-L2392 HydrophobicContact CD2-CD1 3.79Å; W2378-L2392 HydrophobicContact CE3-CB 3.96Å; W2378-L2392 HydrophobicContact CE3-CD1 3.88Å; W2378-L2392 HydrophobicContact CE3-CG 4.49Å; W2378-L2392 HydrophobicContact CG-CD1 4.39Å; W2378-L2392 HydrophobicContact CH2-CB 4.36Å; W2378-L2392 HydrophobicContact CH2-CD1 4.27Å; W2378-L2392 HydrophobicContact CZ2-CD1 4.17Å; W2378-L2392 HydrophobicContact CZ3-CB 3.78Å; W2378-L2392 HydrophobicContact CZ3-CD1 4.13Å; W2378-L2392 HydrophobicContact CZ3-CG 4.43Å; L2392-V2394 HydrophobicContact CD2-CG2 4.09Å; L2392-V2394 HydrophobicContact CG-CG2 4.12Å; L2392-L2403 WeakPolarHBondContact O-CA 3.32Å; L2392-Y2404 PolarHBondContact N-O 3.4Å; L2392-Y2404 PolarHBondContact O-N 3.09Å; L2392-I2406 HydrophobicContact CB-CD1 3.78Å; L2392-I2406 HydrophobicContact CD2-CD1 4.49Å
2393	L	91.7	Very high	77.2	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	124.4	171	-54.3	176.5	0	0	0	108.8	L2376 K2377 I2401 L2403 L2427 F2429 I2434	L2376-L2393 WeakPolarHBondContact CA-O 3.35Å; K2377-L2393 HydrophobicContact CB-CB 4.45Å; K2377-L2393 HydrophobicContact CB-CD1 4.43Å; K2377-L2393 PolarHBondContact N-O 3.19Å; K2377-L2393 VanDerWaalsContact N-O 3.12Å; K2377-L2393 VanDerWaalsContact O-CB 3.29Å; K2377-L2393 WeakPolarHBondContact O-CB 3.29Å; K2377-L2393 PolarHBondContact O-N 3.09Å; L2393-I2401 HydrophobicContact CD2-CG2 4.3Å; L2393-L2403 HydrophobicContact CD2-CD1 3.88Å; L2393-L2403 HydrophobicContact CD2-CD2 4.09Å; L2393-L2403 HydrophobicContact CD2-CG 3.55Å; L2393-L2427 HydrophobicContact CB-CD1 4.23Å; L2393-F2429 HydrophobicContact CD1-CB 3.93Å; L2393-F2429 HydrophobicContact CD1-CD2 4.31Å; L2393-F2429 HydrophobicContact CD1-CG 4.39Å; L2393-I2434 HydrophobicContact CD1-CD1 4.11Å; L2393-I2434 HydrophobicContact CD1-CG1 3.93Å; L2393-I2434 HydrophobicContact CD1-CG2 4.1Å; L2393-I2434 HydrophobicContact CD2-CD1 3.69Å; L2393-I2434 HydrophobicContact CD2-CG1 4.35Å
2394	V	92.5	Very high	79.1	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	112.2	178.6	-176	0	0	0	0	108.8	V2347 I2373 L2376 L2392 I2401 R2402 Y2404	V2347-V2394 HydrophobicContact CG2-CG1 4.38Å; V2347-V2394 HydrophobicContact CG2-CG2 4.25Å; I2373-V2394 HydrophobicContact CD1-CG1 4.21Å; I2373-V2394 HydrophobicContact CG1-CG1 4.19Å; I2373-V2394 HydrophobicContact CG2-CG1 4.02Å; L2376-V2394 HydrophobicContact CD2-CB 4.14Å; L2376-V2394 HydrophobicContact CD2-CG1 4.09Å; L2376-V2394 HydrophobicContact CD2-CG2 3.73Å; L2392-V2394 HydrophobicContact CD2-CG2 4.09Å; L2392-V2394 HydrophobicContact CG-CG2 4.12Å; V2394-I2401 CarbonylContact O-C 3.55Å; V2394-I2401 WeakPolarHBondContact O-CA 3.38Å; V2394-R2402 HydrophobicContact CB-CB 4.36Å; V2394-R2402 PolarHBondContact N-O 3.23Å; V2394-R2402 PolarHBondContact O-N 3.18Å; V2394-Y2404 HydrophobicContact CB-CE2 4.47Å; V2394-Y2404 HydrophobicContact CG2-CD2 3.73Å; V2394-Y2404 HydrophobicContact CG2-CE2 4.03Å
2395	G	91.4	Very high	80.9	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	122.1	174.9	0	0	0	0	0	110.1	I2374 S2375 L2427	I2374-G2395 PolarHBondContact N-O 3.01Å; S2375-G2395 PolarHBondContact N-O 3.22Å; S2375-G2395 VanDerWaalsContact N-O 3.16Å; S2375-G2395 PolarHBondContact O-N 3.23Å; G2395-L2427 VanDerWaalsContact CA-CD1 3.44Å; G2395-L2427 VanDerWaalsContact N-CD1 3.26Å
2396	S	90	Very high	82.7	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	163.9	-176.1	36.8	0	0	0	0	112.6	S2369 W2372 D2398 Q2399 L2400 R2402 I2424	S2369-S2396 VanDerWaalsContact CB-CB 3.47Å; S2369-S2396 WeakPolarHBondContact CB-OG 3.24Å; W2372-S2396 CarbonylContact O-C 3.55Å; W2372-S2396 VanDerWaalsContact O-CA 3.3Å; W2372-S2396 WeakPolarHBondContact O-CA 3.31Å; W2372-S2396 VanDerWaalsContact O-CB 3.3Å; W2372-S2396 WeakPolarHBondContact O-CB 3.36Å; S2396-D2398 VanDerWaalsContact CB-OD1 3.29Å; S2396-D2398 WeakPolarHBondContact CB-OD1 3.28Å; S2396-D2398 PolarHBondContact O-N 3.15Å; S2396-D2398 VanDerWaalsContact O-N 3.15Å; S2396-D2398 PolarHBondContact OG-OD1 2.96Å; S2396-Q2399 PolarHBondContact O-N 3.14Å; S2396-L2400 PolarHBondContact N-O 2.86Å; S2396-L2400 PolarHBondContact OG-O 3.15Å; S2396-R2402 PolarHBondContact OG-NH1 3.15Å; S2396-R2402 VanDerWaalsContact OG-NH1 3.15Å; S2396-I2424 PolarHBondContact O-N 3.29Å
2397	N	87.8	Confident	84.1	Confident	61.5 Å²	61.5	36.6 Å²	36.6	33%	0.329	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-15	177.2	-162.5	52.6	0	0	0	113.1	D2371 W2372 I2374 Q2399	D2371-N2397 HydrophobicContact CB-CB 4.2Å; D2371-N2397 WeakPolarHBondContact OD2-CB 3.28Å; D2371-N2397 PolarHBondContact OD2-ND2 3.27Å; W2372-N2397 HydrophobicContact CB-CB 4.47Å; W2372-N2397 PolarHBondContact O-N 3.16Å; I2374-N2397 HydrophobicContact CD1-CB 3.65Å; I2374-N2397 HydrophobicContact CG1-CB 4.35Å; N2397-Q2399 PolarHBondContact O-N 3Å; N2397-Q2399 VanDerWaalsContact O-N 3.15Å
2398	D	87.5	Confident	85	Confident	30.25 Å²	30.25	36.6 Å²	36.6	16%	0.162	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	15.7	176	72.6	-7.8	0	0	0	114.4	K2370 D2371 S2396 L2400 R2402	K2370-D2398 HydrophobicContact CB-CB 4.29Å; K2370-D2398 WeakPolarHBondContact CB-OD2 3.38Å; K2370-D2398 PolarHBondContact N-OD2 3.13Å; D2371-D2398 HydrophobicContact CB-CB 4.03Å; S2396-D2398 VanDerWaalsContact CB-OD1 3.29Å; S2396-D2398 WeakPolarHBondContact CB-OD1 3.28Å; S2396-D2398 PolarHBondContact O-N 3.15Å; S2396-D2398 VanDerWaalsContact O-N 3.15Å; S2396-D2398 PolarHBondContact OG-OD1 2.96Å; D2398-L2400 WeakPolarHBondContact O-CG 3.4Å; D2398-L2400 PolarHBondContact O-N 3.22Å; D2398-L2400 WeakPolarHBondContact OD1-CB 3.33Å; D2398-L2400 PolarHBondContact OD1-N 3.09Å; D2398-R2402 IonicContact OD1-NH1 3.13Å; D2398-R2402 PolarHBondContact OD1-NH1 3.28Å; D2398-R2402 IonicContact OD2-CZ 3.49Å; D2398-R2402 VanDerWaalsContact OD2-CZ 3.28Å; D2398-R2402 IonicContact OD2-NH1 3.6Å; D2398-R2402 PolarHBondContact OD2-NH1 3.07Å; D2398-R2402 IonicContact OD2-NH2 3.54Å; D2398-R2402 PolarHBondContact OD2-NH2 3.13Å
2399	Q	85.3	Confident	85.4	Confident	81 Å²	81	37.6 Å²	37.6	38%	0.379	18%	0.18	S	C	.	.	S	Bend	trans	68.6	15.3	176.2	-45.1	169.5	-0.3	0	0	114.4	S2396 N2397 S2419 Q2421	S2396-Q2399 PolarHBondContact O-N 3.14Å; N2397-Q2399 PolarHBondContact O-N 3Å; N2397-Q2399 VanDerWaalsContact O-N 3.15Å; Q2399-S2419 WeakPolarHBondContact O-CB 3.43Å; Q2399-S2419 PolarHBondContact O-N 3.04Å; Q2399-S2419 PolarHBondContact O-OG 3.17Å; Q2399-Q2421 PolarHBondContact NE2-O 2.99Å
2400	L	89.7	Confident	85.9	Confident	33 Å²	33	43.4 Å²	43.4	17%	0.173	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	140.6	-175.9	-59.9	175.7	0	0	0	112.4	S2396 D2398 R2402 T2416 L2417 V2418 I2424	S2396-L2400 PolarHBondContact N-O 2.86Å; S2396-L2400 PolarHBondContact OG-O 3.15Å; D2398-L2400 WeakPolarHBondContact O-CG 3.4Å; D2398-L2400 PolarHBondContact O-N 3.22Å; D2398-L2400 WeakPolarHBondContact OD1-CB 3.33Å; D2398-L2400 PolarHBondContact OD1-N 3.09Å; L2400-R2402 VanDerWaalsContact CD1-NH2 3.34Å; L2400-T2416 HydrophobicContact CB-CG2 4.15Å; L2400-T2416 HydrophobicContact CD1-CG2 4.16Å; L2400-T2416 HydrophobicContact CD2-CG2 4.12Å; L2400-T2416 HydrophobicContact CG-CG2 4.38Å; L2400-L2417 WeakPolarHBondContact CA-O 3.31Å; L2400-V2418 HydrophobicContact CD2-CB 4.01Å; L2400-V2418 HydrophobicContact CD2-CG1 4Å; L2400-V2418 HydrophobicContact CD2-CG2 3.64Å; L2400-I2424 WeakPolarHBondContact O-CD1 3.39Å
2401	I	89.3	Confident	86	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	121.1	165.9	-47.8	168.6	0	0	0	107.8	L2393 V2394 L2403 T2416 L2417 I2424 L2427	L2393-I2401 HydrophobicContact CD2-CG2 4.3Å; V2394-I2401 CarbonylContact O-C 3.55Å; V2394-I2401 WeakPolarHBondContact O-CA 3.38Å; I2401-L2403 HydrophobicContact CG2-CD1 4.11Å; I2401-T2416 CarbonylContact O-C 3.57Å; I2401-T2416 WeakPolarHBondContact O-CA 3.34Å; I2401-L2417 HydrophobicContact CB-CB 4.09Å; I2401-L2417 HydrophobicContact CB-CD1 4.35Å; I2401-L2417 HydrophobicContact CD1-CB 4.46Å; I2401-L2417 HydrophobicContact CD1-CD1 4.37Å; I2401-L2417 HydrophobicContact CG2-CD1 4.49Å; I2401-L2417 PolarHBondContact N-O 3.11Å; I2401-L2417 PolarHBondContact O-N 2.95Å; I2401-I2424 HydrophobicContact CB-CD1 4.33Å; I2401-I2424 HydrophobicContact CD1-CD1 4.22Å; I2401-I2424 HydrophobicContact CG1-CD1 3.25Å; I2401-I2424 VanDerWaalsContact CG1-CD1 3.43Å; I2401-I2424 HydrophobicContact CG1-CG1 4.36Å; I2401-L2427 HydrophobicContact CD1-CD2 3.92Å; I2401-L2427 HydrophobicContact CG1-CD2 4.13Å; I2401-L2427 HydrophobicContact CG2-CD1 4.17Å; I2401-L2427 HydrophobicContact CG2-CD2 4.37Å
2402	R	92	Very high	85.9	Confident	20.3333 Å²	20.3333	54.8 Å²	54.8	8%	0.077	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	134.4	176.9	-69.7	174.3	-178.4	85.6	-5.9	111	A2368 V2394 S2396 D2398 L2400 Y2404 L2413 T2416	A2368-R2402 WeakPolarHBondContact O-CD 3.35Å; A2368-R2402 PolarHBondContact O-NE 2.95Å; V2394-R2402 HydrophobicContact CB-CB 4.36Å; V2394-R2402 PolarHBondContact N-O 3.23Å; V2394-R2402 PolarHBondContact O-N 3.18Å; S2396-R2402 PolarHBondContact OG-NH1 3.15Å; S2396-R2402 VanDerWaalsContact OG-NH1 3.15Å; D2398-R2402 IonicContact OD1-NH1 3.13Å; D2398-R2402 PolarHBondContact OD1-NH1 3.28Å; D2398-R2402 IonicContact OD2-CZ 3.49Å; D2398-R2402 VanDerWaalsContact OD2-CZ 3.28Å; D2398-R2402 IonicContact OD2-NH1 3.6Å; D2398-R2402 PolarHBondContact OD2-NH1 3.07Å; D2398-R2402 IonicContact OD2-NH2 3.54Å; D2398-R2402 PolarHBondContact OD2-NH2 3.13Å; L2400-R2402 VanDerWaalsContact CD1-NH2 3.34Å; R2402-Y2404 HydrophobicContact CB-CD2 4.24Å; R2402-Y2404 HydrophobicContact CB-CE2 3.7Å; R2402-L2413 HydrophobicContact CB-CD1 3.89Å; R2402-L2413 HydrophobicContact CG-CD1 4.23Å; R2402-T2416 HydrophobicContact CG-CG2 4.12Å
2403	L	91.1	Very high	85.7	Confident	0.333333 Å²	0.333333	58.3 Å²	58.3	0%	0.002	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	104.8	179.7	-78.8	72.6	0	0	0	109.6	T2391 L2392 L2393 I2401 K2414 Q2415 L2417 I2434 F2454	T2391-L2403 HydrophobicContact CG2-CB 3.99Å; T2391-L2403 HydrophobicContact CG2-CD2 4.48Å; T2391-L2403 HydrophobicContact CG2-CG 4.38Å; L2392-L2403 WeakPolarHBondContact O-CA 3.32Å; L2393-L2403 HydrophobicContact CD2-CD1 3.88Å; L2393-L2403 HydrophobicContact CD2-CD2 4.09Å; L2393-L2403 HydrophobicContact CD2-CG 3.55Å; I2401-L2403 HydrophobicContact CG2-CD1 4.11Å; L2403-K2414 HydrophobicContact CB-CB 4.45Å; L2403-K2414 PolarHBondContact O-N 3.06Å; L2403-Q2415 HydrophobicContact CB-CB 4.36Å; L2403-Q2415 HydrophobicContact CD1-CB 4.49Å; L2403-Q2415 HydrophobicContact CD2-CB 4.39Å; L2403-Q2415 PolarHBondContact N-O 3.23Å; L2403-L2417 HydrophobicContact CD1-CD1 3.87Å; L2403-L2417 HydrophobicContact CD1-CG 4.04Å; L2403-I2434 HydrophobicContact CD2-CD1 4.34Å; L2403-F2454 HydrophobicContact CD2-CD2 3.32Å; L2403-F2454 HydrophobicContact CD2-CE2 3.54Å; L2403-F2454 VanDerWaalsContact CD2-CE2 3.49Å; L2403-F2454 HydrophobicContact CD2-CG 4.37Å
2404	Y	89.4	Confident	85.4	Confident	18 Å²	18	61.6 Å²	61.6	7%	0.071	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	112.6	175.5	-72.6	-84.1	0	0	0	110.2	I2365 A2368 T2391 L2392 V2394 R2402 I2406 Y2411 L2413	I2365-Y2404 HydrophobicContact CD1-CD1 3.99Å; I2365-Y2404 HydrophobicContact CD1-CE1 4.47Å; I2365-Y2404 HydrophobicContact CD1-CG 4.02Å; I2365-Y2404 HydrophobicContact CG2-CD1 4.45Å; I2365-Y2404 HydrophobicContact CG2-CE1 3.94Å; A2368-Y2404 WeakPolarHBondContact CA-OH 3.44Å; A2368-Y2404 HydrophobicContact CB-CE2 4.34Å; A2368-Y2404 PolarHBondContact O-OH 3.09Å; A2368-Y2404 VanDerWaalsContact O-OH 3.09Å; T2391-Y2404 CarbonylContact C-O 3.56Å; T2391-Y2404 WeakPolarHBondContact CA-O 3.22Å; T2391-Y2404 WeakPolarHBondContact CG2-O 3.38Å; L2392-Y2404 PolarHBondContact N-O 3.4Å; L2392-Y2404 PolarHBondContact O-N 3.09Å; V2394-Y2404 HydrophobicContact CB-CE2 4.47Å; V2394-Y2404 HydrophobicContact CG2-CD2 3.73Å; V2394-Y2404 HydrophobicContact CG2-CE2 4.03Å; R2402-Y2404 HydrophobicContact CB-CD2 4.24Å; R2402-Y2404 HydrophobicContact CB-CE2 3.7Å; Y2404-I2406 PolarHBondContact O-N 3.49Å; Y2404-Y2411 HydrophobicContact CD1-CD2 4.2Å; Y2404-Y2411 HydrophobicContact CE1-CD2 4.45Å; Y2404-L2413 HydrophobicContact CD1-CB 4.27Å; Y2404-L2413 HydrophobicContact CD1-CD1 4.37Å; Y2404-L2413 HydrophobicContact CD2-CD1 4.49Å; Y2404-L2413 HydrophobicContact CE1-CB 3.97Å; Y2404-L2413 HydrophobicContact CE1-CD1 4.04Å; Y2404-L2413 HydrophobicContact CE2-CD1 4.2Å
2405	R	85.8	Confident	85.1	Confident	75.3333 Å²	75.3333	63.3 Å²	63.3	28%	0.284	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	129.3	170.7	-177.3	173.4	179.8	179.9	-3.2	108.9	K2389 Y2411 K2412	K2389-R2405 VanDerWaalsContact CD-NH2 3.34Å; K2389-R2405 VanDerWaalsContact CE-NH2 3.3Å; R2405-Y2411 CarbonylContact O-C 3.46Å; R2405-Y2411 VanDerWaalsContact O-CA 3.28Å; R2405-Y2411 WeakPolarHBondContact O-CA 3.41Å; R2405-K2412 PolarHBondContact N-O 2.98Å; R2405-K2412 PolarHBondContact O-N 2.92Å
2406	I	82.6	Confident	84.9	Confident	11.6667 Å²	11.6667	66.2 Å²	66.2	6%	0.06	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	126.2	-178.2	-68.4	167.5	0	0	0	109	I2349 Y2363 W2378 L2390 L2392 Y2404	I2349-I2406 HydrophobicContact CD1-CD1 3.72Å; I2349-I2406 HydrophobicContact CD1-CG1 4.22Å; I2349-I2406 HydrophobicContact CG1-CD1 4.19Å; I2349-I2406 HydrophobicContact CG2-CD1 4.37Å; Y2363-I2406 HydrophobicContact CE2-CG1 4.45Å; Y2363-I2406 HydrophobicContact CE2-CG2 4.32Å; Y2363-I2406 WeakPolarHBondContact OH-CD1 3.39Å; Y2363-I2406 VanDerWaalsContact OH-CG1 3.27Å; Y2363-I2406 WeakPolarHBondContact OH-CG1 3.27Å; Y2363-I2406 WeakPolarHBondContact OH-CG2 3.4Å; W2378-I2406 HydrophobicContact CE3-CD1 4.44Å; W2378-I2406 HydrophobicContact CH2-CD1 3.43Å; W2378-I2406 VanDerWaalsContact CH2-CD1 3.46Å; W2378-I2406 HydrophobicContact CZ3-CD1 3.27Å; W2378-I2406 HydrophobicContact CZ3-CG1 4.35Å; L2390-I2406 PolarHBondContact O-N 3.11Å; L2390-I2406 VanDerWaalsContact O-N 3.1Å; L2392-I2406 HydrophobicContact CB-CD1 3.78Å; L2392-I2406 HydrophobicContact CD2-CD1 4.49Å; Y2404-I2406 PolarHBondContact O-N 3.49Å
2407	K	75.4	Confident	84.6	Confident	121.667 Å²	121.667	66.4 Å²	66.4	53%	0.529	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	156.7	167.9	-66.5	-172.6	174.9	-170.9	0	108	Y2363 K2409 K2410	Y2363-K2407 PolarHBondContact OH-O 2.75Å; K2407-K2409 PolarHBondContact O-N 2.99Å; K2407-K2410 WeakPolarHBondContact CA-O 3.36Å; K2407-K2410 WeakPolarHBondContact CB-O 3.38Å; K2407-K2410 PolarHBondContact N-O 3.14Å; K2407-K2410 PolarHBondContact O-N 3.12Å; K2407-K2410 VanDerWaalsContact O-N 3.11Å; K2407-K2410 VanDerWaalsContact O-O 3.05Å
2408	S	69.6	Low	84.2	Confident	85.3333 Å²	85.3333	67.7 Å²	67.7	60%	0.597	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.4	-26.1	-173.7	-165	0	0	0	0	116.5	Q2362 Y2363	Q2362-S2408 PolarHBondContact NE2-O 3.17Å; Y2363-S2408 PolarHBondContact OH-O 3.18Å
2409	K	70.7	Confident	83.4	Confident	190.333 Å²	190.333	66.4 Å²	66.4	83%	0.828	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131	1.6	175.3	-67	-169.7	177.2	-175.5	0	115.4	Y2363 K2407	Y2363-K2409 WeakPolarHBondContact OH-CA 3.39Å; Y2363-K2409 PolarHBondContact OH-N 2.52Å; K2407-K2409 PolarHBondContact O-N 2.99Å
2410	K	79	Confident	82.3	Confident	163.667 Å²	163.667	66.8 Å²	66.8	71%	0.712	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-149	142.6	-173.6	-66	-172.4	179.3	-177.1	0	110.6	K2407	K2407-K2410 WeakPolarHBondContact CA-O 3.36Å; K2407-K2410 WeakPolarHBondContact CB-O 3.38Å; K2407-K2410 PolarHBondContact N-O 3.14Å; K2407-K2410 PolarHBondContact O-N 3.12Å; K2407-K2410 VanDerWaalsContact O-N 3.11Å; K2407-K2410 VanDerWaalsContact O-O 3.05Å
2411	Y	85.9	Confident	81.2	Confident	101 Å²	101	71.6 Å²	71.6	40%	0.396	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	154	167	63.7	-90.1	0	0	0	110.4	Y2363 I2365 Y2404 R2405	Y2363-Y2411 AromaticContact CD2-CD1 3.59Å; Y2363-Y2411 HydrophobicContact CD2-CD1 3.59Å; Y2363-Y2411 AromaticContact CD2-CE1 3.92Å; Y2363-Y2411 HydrophobicContact CD2-CE1 4.09Å; Y2363-Y2411 HydrophobicContact CD2-CG 4.43Å; Y2363-Y2411 AromaticContact CE2-CD1 3.52Å; Y2363-Y2411 HydrophobicContact CE2-CD1 3.79Å; Y2363-Y2411 HydrophobicContact CE2-CE1 4.35Å; Y2363-Y2411 HydrophobicContact CE2-CG 4.23Å; Y2363-Y2411 HydrophobicContact CG-CD1 4.3Å; I2365-Y2411 HydrophobicContact CB-CE2 4.49Å; I2365-Y2411 HydrophobicContact CD1-CD2 4.15Å; I2365-Y2411 HydrophobicContact CD1-CG 4.22Å; I2365-Y2411 HydrophobicContact CG1-CD1 4.19Å; I2365-Y2411 HydrophobicContact CG1-CD2 4.1Å; I2365-Y2411 HydrophobicContact CG1-CE1 4.2Å; I2365-Y2411 HydrophobicContact CG1-CE2 4.1Å; I2365-Y2411 HydrophobicContact CG1-CG 4.15Å; I2365-Y2411 HydrophobicContact CG2-CD2 4.45Å; I2365-Y2411 HydrophobicContact CG2-CE2 3.95Å; Y2404-Y2411 HydrophobicContact CD1-CD2 4.2Å; Y2404-Y2411 HydrophobicContact CE1-CD2 4.45Å; R2405-Y2411 CarbonylContact O-C 3.46Å; R2405-Y2411 VanDerWaalsContact O-CA 3.28Å; R2405-Y2411 WeakPolarHBondContact O-CA 3.41Å
2412	K	86.5	Confident	80.5	Confident	156.667 Å²	156.667	72.1 Å²	72.1	68%	0.681	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.7	130.8	172.8	-175.1	176.5	178.6	178.1	0	109.7	R2405 K2414	R2405-K2412 PolarHBondContact N-O 2.98Å; R2405-K2412 PolarHBondContact O-N 2.92Å; K2412-K2414 PolarHBondContact O-N 3.06Å
2413	L	86.9	Confident	79.8	Confident	74 Å²	74	71.5 Å²	71.5	39%	0.387	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	116.8	168	-178.8	65.5	0	0	0	108.5	R2402 Y2404	R2402-L2413 HydrophobicContact CB-CD1 3.89Å; R2402-L2413 HydrophobicContact CG-CD1 4.23Å; Y2404-L2413 HydrophobicContact CD1-CB 4.27Å; Y2404-L2413 HydrophobicContact CD1-CD1 4.37Å; Y2404-L2413 HydrophobicContact CD2-CD1 4.49Å; Y2404-L2413 HydrophobicContact CE1-CB 3.97Å; Y2404-L2413 HydrophobicContact CE1-CD1 4.04Å; Y2404-L2413 HydrophobicContact CE2-CD1 4.2Å
2414	K	84.6	Confident	79.5	Confident	69.3333 Å²	69.3333	71.4 Å²	71.4	30%	0.301	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	-47.3	-177.9	-176.9	-174.6	174.3	-172.2	0	111.2	L2403 K2412 Y2448 G2452	L2403-K2414 HydrophobicContact CB-CB 4.45Å; L2403-K2414 PolarHBondContact O-N 3.06Å; K2412-K2414 PolarHBondContact O-N 3.06Å; K2414-Y2448 PolarHBondContact NZ-OH 3.45Å; K2414-G2452 WeakPolarHBondContact CE-O 3.46Å; K2414-G2452 PolarHBondContact NZ-O 2.9Å
2415	Q	85.6	Confident	79.2	Confident	35.6667 Å²	35.6667	75.8 Å²	75.8	17%	0.167	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	149.5	-172.5	-168.2	173.9	3.1	0	0	109.8	L2403 L2417 F2454	L2403-Q2415 HydrophobicContact CB-CB 4.36Å; L2403-Q2415 HydrophobicContact CD1-CB 4.49Å; L2403-Q2415 HydrophobicContact CD2-CB 4.39Å; L2403-Q2415 PolarHBondContact N-O 3.23Å; Q2415-L2417 HydrophobicContact CG-CD2 3.92Å; Q2415-L2417 VanDerWaalsContact NE2-CD2 3.26Å; Q2415-F2454 PolarHBondContact NE2-O 3.13Å
2416	T	87.8	Confident	79.2	Confident	60.3333 Å²	60.3333	72.6 Å²	72.6	37%	0.37	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	127	168.3	-56.1	0	0	0	0	107.3	L2400 I2401 R2402	L2400-T2416 HydrophobicContact CB-CG2 4.15Å; L2400-T2416 HydrophobicContact CD1-CG2 4.16Å; L2400-T2416 HydrophobicContact CD2-CG2 4.12Å; L2400-T2416 HydrophobicContact CG-CG2 4.38Å; I2401-T2416 CarbonylContact O-C 3.57Å; I2401-T2416 WeakPolarHBondContact O-CA 3.34Å; R2402-T2416 HydrophobicContact CG-CG2 4.12Å
2417	L	84.6	Confident	79.6	Confident	6 Å²	6	72.4 Å²	72.4	3%	0.031	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	137.2	175.2	-47.8	171.1	0	0	0	107.6	L2400 I2401 L2403 Q2415 I2434 W2446 F2454	L2400-L2417 WeakPolarHBondContact CA-O 3.31Å; I2401-L2417 HydrophobicContact CB-CB 4.09Å; I2401-L2417 HydrophobicContact CB-CD1 4.35Å; I2401-L2417 HydrophobicContact CD1-CB 4.46Å; I2401-L2417 HydrophobicContact CD1-CD1 4.37Å; I2401-L2417 HydrophobicContact CG2-CD1 4.49Å; I2401-L2417 PolarHBondContact N-O 3.11Å; I2401-L2417 PolarHBondContact O-N 2.95Å; L2403-L2417 HydrophobicContact CD1-CD1 3.87Å; L2403-L2417 HydrophobicContact CD1-CG 4.04Å; Q2415-L2417 HydrophobicContact CG-CD2 3.92Å; Q2415-L2417 VanDerWaalsContact NE2-CD2 3.26Å; L2417-I2434 HydrophobicContact CD1-CD1 4.42Å; L2417-W2446 HydrophobicContact CB-CE3 4.26Å; L2417-W2446 HydrophobicContact CB-CH2 3.85Å; L2417-W2446 HydrophobicContact CB-CZ2 4.08Å; L2417-W2446 HydrophobicContact CB-CZ3 3.91Å; L2417-W2446 HydrophobicContact CD1-CD2 3.85Å; L2417-W2446 HydrophobicContact CD1-CE3 3.92Å; L2417-W2446 HydrophobicContact CD1-CG 4.16Å; L2417-W2446 HydrophobicContact CD1-CZ3 4.42Å; L2417-W2446 HydrophobicContact CD2-CE3 3.87Å; L2417-W2446 HydrophobicContact CD2-CZ3 3.87Å; L2417-W2446 HydrophobicContact CG-CE3 4.24Å; L2417-W2446 HydrophobicContact CG-CZ3 4.28Å; L2417-F2454 HydrophobicContact CD1-CB 4.17Å; L2417-F2454 HydrophobicContact CD2-CB 4.21Å
2418	V	79.1	Confident	80.2	Confident	88.6667 Å²	88.6667	66.9 Å²	66.9	54%	0.537	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	121.9	177.9	-173.1	0	0	0	0	107.5	L2400 W2446	L2400-V2418 HydrophobicContact CD2-CB 4.01Å; L2400-V2418 HydrophobicContact CD2-CG1 4Å; L2400-V2418 HydrophobicContact CD2-CG2 3.64Å; V2418-W2446 WeakPolarHBondContact O-CH2 3.24Å
2419	S	70.7	Confident	81	Confident	3 Å²	3	63.5 Å²	63.5	2%	0.021	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-92.7	140.4	168.5	94.3	0	0	0	0	109.2	Q2399 Q2421 T2438	Q2399-S2419 WeakPolarHBondContact O-CB 3.43Å; Q2399-S2419 PolarHBondContact O-N 3.04Å; Q2399-S2419 PolarHBondContact O-OG 3.17Å; S2419-Q2421 VanDerWaalsContact C-N 3.28Å; S2419-Q2421 PolarHBondContact O-N 3.45Å; S2419-Q2421 VanDerWaalsContact O-N 3.11Å; S2419-T2438 VanDerWaalsContact OG-CG2 3.31Å; S2419-T2438 WeakPolarHBondContact OG-CG2 3.35Å
2420	D	61.7	Low	81.5	Confident	88.3333 Å²	88.3333	55.3 Å²	55.3	47%	0.472	27%	0.267	S	S	.	.	S	Bend	trans	-74.6	104.5	-173.5	-93.4	-10	0	0	0	113.1	S2422	D2420-S2422 PolarHBondContact O-N 3.15Å; D2420-S2422 PolarHBondContact O-OG 3.25Å
2421	Q	65.9	Low	81.3	Confident	133.333 Å²	133.333	50.8 Å²	50.8	62%	0.623	25%	0.248	S	C	*	.	S	Bend	trans	64.9	-16.2	176.4	-58.8	-171.6	-0.8	0	0	120.8	Q2399 S2419 H2442	Q2399-Q2421 PolarHBondContact NE2-O 2.99Å; S2419-Q2421 VanDerWaalsContact C-N 3.28Å; S2419-Q2421 PolarHBondContact O-N 3.45Å; S2419-Q2421 VanDerWaalsContact O-N 3.11Å; Q2421-H2442 VanDerWaalsContact CD-CD2 3.45Å; Q2421-H2442 PolarHBondContact OE1-CD2 3.34Å
2422	S	74.7	Confident	80.8	Confident	11 Å²	11	47.3 Å²	47.3	8%	0.077	24%	0.238	C	C	.	.	S	Bend	trans	-164.3	167.2	-179.2	47.8	0	0	0	0	113	D2420 T2438 S2439 N2440	D2420-S2422 PolarHBondContact O-N 3.15Å; D2420-S2422 PolarHBondContact O-OG 3.25Å; S2422-T2438 VanDerWaalsContact OG-CB 3.24Å; S2422-T2438 WeakPolarHBondContact OG-CB 3.28Å; S2422-T2438 PolarHBondContact OG-OG1 3.19Å; S2422-S2439 WeakPolarHBondContact CB-OG 3.09Å; S2422-S2439 PolarHBondContact OG-OG 3.04Å; S2422-N2440 PolarHBondContact OG-ND2 3.23Å
2423	G	77.9	Confident	80.7	Confident	7 Å²	7	40.9 Å²	40.9	7%	0.072	21%	0.209	C	C	.	.			trans	-62.8	143.8	-178.9	0	0	0	0	0	112.5	K2425 T2438 S2439	G2423-K2425 PolarHBondContact O-N 3.01Å; G2423-T2438 WeakPolarHBondContact O-CA 3.26Å; G2423-S2439 PolarHBondContact O-N 2.97Å
2424	I	84.1	Confident	80.6	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	119.6	-175	-57.3	174.2	0	0	0	109.6	I2374 S2396 L2400 I2401 L2427	I2374-I2424 VanDerWaalsContact CB-O 3.26Å; I2374-I2424 WeakPolarHBondContact CB-O 3.34Å; I2374-I2424 VanDerWaalsContact CD1-O 3.26Å; I2374-I2424 WeakPolarHBondContact CD1-O 3.4Å; I2374-I2424 WeakPolarHBondContact CG2-O 3.28Å; S2396-I2424 PolarHBondContact O-N 3.29Å; L2400-I2424 WeakPolarHBondContact O-CD1 3.39Å; I2401-I2424 HydrophobicContact CB-CD1 4.33Å; I2401-I2424 HydrophobicContact CD1-CD1 4.22Å; I2401-I2424 HydrophobicContact CG1-CD1 3.25Å; I2401-I2424 VanDerWaalsContact CG1-CD1 3.43Å; I2401-I2424 HydrophobicContact CG1-CG1 4.36Å; I2424-L2427 HydrophobicContact CG2-CD1 4.5Å; I2424-L2427 HydrophobicContact CG2-CD2 3.8Å; I2424-L2427 HydrophobicContact CG2-CG 3.83Å
2425	K	84.3	Confident	80.7	Confident	109 Å²	109	34 Å²	34	47%	0.474	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	-36.4	-178.5	-75.7	-67	-174	175.6	0	113.7	I2374 G2423 A2437	I2374-K2425 HydrophobicContact CG2-CD 4.48Å; G2423-K2425 PolarHBondContact O-N 3.01Å; K2425-A2437 PolarHBondContact N-O 2.95Å
2426	S	86.3	Confident	80.8	Confident	9.33333 Å²	9.33333	32.3 Å²	32.3	7%	0.065	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	136.8	-177.6	-172	0	0	0	0	110	S2436 A2437 I2484	S2426-S2436 WeakPolarHBondContact O-CA 3.32Å; S2426-A2437 PolarHBondContact N-O 2.97Å; S2426-A2437 PolarHBondContact O-N 3.1Å; S2426-I2484 PolarHBondContact OG-N 3.25Å; S2426-I2484 VanDerWaalsContact OG-N 3.12Å
2427	L	89.1	Confident	80.7	Confident	6.33333 Å²	6.33333	29.5 Å²	29.5	3%	0.033	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	140	170.1	-72.3	177.5	0	0	0	110	S2375 K2377 L2393 G2395 I2401 I2424 F2435	S2375-L2427 PolarHBondContact OG-N 3.16Å; S2375-L2427 VanDerWaalsContact OG-N 3.09Å; K2377-L2427 HydrophobicContact CB-CB 4.44Å; L2393-L2427 HydrophobicContact CB-CD1 4.23Å; G2395-L2427 VanDerWaalsContact CA-CD1 3.44Å; G2395-L2427 VanDerWaalsContact N-CD1 3.26Å; I2401-L2427 HydrophobicContact CD1-CD2 3.92Å; I2401-L2427 HydrophobicContact CG1-CD2 4.13Å; I2401-L2427 HydrophobicContact CG2-CD1 4.17Å; I2401-L2427 HydrophobicContact CG2-CD2 4.37Å; I2424-L2427 HydrophobicContact CG2-CD1 4.5Å; I2424-L2427 HydrophobicContact CG2-CD2 3.8Å; I2424-L2427 HydrophobicContact CG2-CG 3.83Å; L2427-F2435 WeakPolarHBondContact CA-O 3.31Å
2428	D	88.9	Confident	80.6	Confident	5.66667 Å²	5.66667	29.2 Å²	29.2	3%	0.03	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	158.5	168.6	-160.1	36.5	0	0	0	111.7	K2377 F2435 I2484 S2486	K2377-D2428 WeakPolarHBondContact CE-OD1 3.44Å; K2377-D2428 IonicContact NZ-OD1 3.46Å; K2377-D2428 PolarHBondContact NZ-OD1 3.04Å; D2428-F2435 PolarHBondContact N-O 3.32Å; D2428-F2435 PolarHBondContact O-N 3.06Å; D2428-I2484 HydrophobicContact CB-CG2 4.39Å; D2428-S2486 WeakPolarHBondContact OD2-CA 3.4Å; D2428-S2486 VanDerWaalsContact OD2-CB 3.3Å; D2428-S2486 WeakPolarHBondContact OD2-CB 3.38Å; D2428-S2486 PolarHBondContact OD2-N 3.05Å; D2428-S2486 PolarHBondContact OD2-OG 3Å
2429	F	85.7	Confident	80.3	Confident	15.3333 Å²	15.3333	26.9 Å²	26.9	7%	0.067	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	125.3	-175.9	174.6	-99.9	0	0	0	110.3	K2377 S2379 Y2380 L2393 F2431 Y2433 I2434 F2454	K2377-F2429 HydrophobicContact CG-CB 4.16Å; S2379-F2429 VanDerWaalsContact CA-CD1 3.49Å; Y2380-F2429 HydrophobicContact CD1-CE1 4.18Å; Y2380-F2429 HydrophobicContact CE1-CE1 4.27Å; Y2380-F2429 HydrophobicContact CG-CE1 4.44Å; Y2380-F2429 WeakPolarHBondContact O-CZ 3.41Å; L2393-F2429 HydrophobicContact CD1-CB 3.93Å; L2393-F2429 HydrophobicContact CD1-CD2 4.31Å; L2393-F2429 HydrophobicContact CD1-CG 4.39Å; F2429-F2431 HydrophobicContact CE1-CB 4.05Å; F2429-F2431 HydrophobicContact CZ-CB 3.72Å; F2429-F2431 HydrophobicContact CZ-CD2 4.13Å; F2429-F2431 HydrophobicContact CZ-CG 4.44Å; F2429-Y2433 WeakPolarHBondContact CD2-O 3.36Å; F2429-I2434 HydrophobicContact CD2-CG1 3.76Å; F2429-I2434 HydrophobicContact CE2-CG1 4.32Å; F2429-F2454 HydrophobicContact CE2-CE1 4.41Å; F2429-F2454 HydrophobicContact CE2-CZ 4.11Å
2430	N	81.3	Confident	80.2	Confident	17.3333 Å²	17.3333	31.7 Å²	31.7	9%	0.093	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	110.9	166.5	-175.2	-5.8	0	0	0	107.9	Y2433 F2435 S2486 V2622	N2430-Y2433 CarbonylContact C-O 3.51Å; N2430-Y2433 PolarHBondContact N-O 2.88Å; N2430-Y2433 VanDerWaalsContact N-O 3.1Å; N2430-Y2433 CarbonylContact O-C 3.5Å; N2430-Y2433 WeakPolarHBondContact O-CA 3.3Å; N2430-Y2433 WeakPolarHBondContact O-CB 3.41Å; N2430-Y2433 PolarHBondContact O-N 3.04Å; N2430-Y2433 VanDerWaalsContact O-O 3.05Å; N2430-F2435 HydrophobicContact CB-CE2 4.44Å; N2430-S2486 VanDerWaalsContact CB-OG 3.27Å; N2430-S2486 WeakPolarHBondContact CB-OG 3.43Å; N2430-V2622 HydrophobicContact CB-CG1 4.29Å
2431	F	76.6	Confident	80.6	Confident	70.3333 Å²	70.3333	27.7 Å²	27.7	31%	0.308	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	130.9	-172.1	178.9	-93.5	0	0	0	111.1	I2381 L2382 F2429 Y2448	I2381-F2431 HydrophobicContact CG2-CE2 4.22Å; L2382-F2431 HydrophobicContact CD1-CD1 4.43Å; F2429-F2431 HydrophobicContact CE1-CB 4.05Å; F2429-F2431 HydrophobicContact CZ-CB 3.72Å; F2429-F2431 HydrophobicContact CZ-CD2 4.13Å; F2429-F2431 HydrophobicContact CZ-CG 4.44Å; F2431-Y2448 HydrophobicContact CE2-CD1 4.37Å
2432	P	74.5	Confident	81.1	Confident	27 Å²	27	22 Å²	22	18%	0.175	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	cis	-93.4	15.8	10.2	37.2	-37.9	0	0	0	115.8	R2447 Y2448	P2432-R2447 HydrophobicContact CB-CG 4.38Å; P2432-R2447 HydrophobicContact CG-CG 4.35Å; P2432-R2447 WeakPolarHBondContact O-CA 3.25Å; P2432-Y2448 PolarHBondContact O-N 3.15Å
2433	Y	83.7	Confident	81.4	Confident	21.3333 Å²	21.3333	21.5 Å²	21.5	8%	0.084	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	145	-170.8	-54.6	-75.2	0	0	0	114.4	F2429 N2430 F2435 V2445 W2446 R2447 I2457 V2622	F2429-Y2433 WeakPolarHBondContact CD2-O 3.36Å; N2430-Y2433 CarbonylContact C-O 3.51Å; N2430-Y2433 PolarHBondContact N-O 2.88Å; N2430-Y2433 VanDerWaalsContact N-O 3.1Å; N2430-Y2433 CarbonylContact O-C 3.5Å; N2430-Y2433 WeakPolarHBondContact O-CA 3.3Å; N2430-Y2433 WeakPolarHBondContact O-CB 3.41Å; N2430-Y2433 PolarHBondContact O-N 3.04Å; N2430-Y2433 VanDerWaalsContact O-O 3.05Å; Y2433-F2435 HydrophobicContact CG-CZ 4.27Å; Y2433-V2445 HydrophobicContact CD1-CG1 4.08Å; Y2433-W2446 CarbonylContact C-O 3.5Å; Y2433-W2446 VanDerWaalsContact CA-O 3.24Å; Y2433-W2446 WeakPolarHBondContact CA-O 3.33Å; Y2433-R2447 HydrophobicContact CD1-CB 3.91Å; Y2433-R2447 HydrophobicContact CD1-CG 4.09Å; Y2433-R2447 HydrophobicContact CE1-CB 4.2Å; Y2433-R2447 HydrophobicContact CE1-CG 3.76Å; Y2433-I2457 HydrophobicContact CD1-CD1 3.82Å; Y2433-I2457 HydrophobicContact CE1-CD1 3.63Å; Y2433-V2622 HydrophobicContact CD2-CG2 4.37Å
2434	I	86	Confident	81.6	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	135.4	161.9	-62.2	165.4	0	0	0	107.7	L2393 L2403 L2417 F2429 W2446 F2454	L2393-I2434 HydrophobicContact CD1-CD1 4.11Å; L2393-I2434 HydrophobicContact CD1-CG1 3.93Å; L2393-I2434 HydrophobicContact CD1-CG2 4.1Å; L2393-I2434 HydrophobicContact CD2-CD1 3.69Å; L2393-I2434 HydrophobicContact CD2-CG1 4.35Å; L2403-I2434 HydrophobicContact CD2-CD1 4.34Å; L2417-I2434 HydrophobicContact CD1-CD1 4.42Å; F2429-I2434 HydrophobicContact CD2-CG1 3.76Å; F2429-I2434 HydrophobicContact CE2-CG1 4.32Å; I2434-W2446 HydrophobicContact CB-CB 4.16Å; I2434-W2446 HydrophobicContact CB-CG 4.5Å; I2434-W2446 PolarHBondContact N-O 3.18Å; I2434-W2446 PolarHBondContact O-N 3.08Å; I2434-F2454 HydrophobicContact CD1-CB 4.44Å; I2434-F2454 HydrophobicContact CD1-CD1 3.47Å; I2434-F2454 VanDerWaalsContact CD1-CD1 3.47Å; I2434-F2454 HydrophobicContact CD1-CD2 3.78Å; I2434-F2454 HydrophobicContact CD1-CE1 3.46Å; I2434-F2454 VanDerWaalsContact CD1-CE1 3.46Å; I2434-F2454 HydrophobicContact CD1-CE2 3.75Å; I2434-F2454 HydrophobicContact CD1-CG 3.63Å; I2434-F2454 HydrophobicContact CD1-CZ 3.59Å; I2434-F2454 HydrophobicContact CG1-CD1 3.9Å; I2434-F2454 HydrophobicContact CG1-CE1 3.6Å; I2434-F2454 HydrophobicContact CG1-CZ 3.98Å
2435	F	86.7	Confident	81.5	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	131.6	173.8	-56	-78.4	0	0	0	109.9	L2427 D2428 N2430 Y2433 V2445 I2484 V2622 L2624 P2646	L2427-F2435 WeakPolarHBondContact CA-O 3.31Å; D2428-F2435 PolarHBondContact N-O 3.32Å; D2428-F2435 PolarHBondContact O-N 3.06Å; N2430-F2435 HydrophobicContact CB-CE2 4.44Å; Y2433-F2435 HydrophobicContact CG-CZ 4.27Å; F2435-V2445 HydrophobicContact CD1-CB 4.46Å; F2435-V2445 HydrophobicContact CD1-CG1 4.11Å; F2435-V2445 HydrophobicContact CD1-CG2 3.95Å; F2435-V2445 HydrophobicContact CE1-CB 4.44Å; F2435-V2445 HydrophobicContact CE1-CG1 3.71Å; F2435-V2445 HydrophobicContact CE1-CG2 4.03Å; F2435-I2484 HydrophobicContact CB-CD1 4.42Å; F2435-I2484 HydrophobicContact CB-CG2 3.89Å; F2435-I2484 HydrophobicContact CG-CG2 4.46Å; F2435-V2622 HydrophobicContact CE2-CG1 4.02Å; F2435-V2622 HydrophobicContact CZ-CG1 3.86Å; F2435-L2624 HydrophobicContact CB-CD1 4.07Å; F2435-L2624 HydrophobicContact CD1-CD1 3.56Å; F2435-L2624 VanDerWaalsContact CD1-CD1 3.42Å; F2435-L2624 HydrophobicContact CD1-CD2 4.13Å; F2435-L2624 HydrophobicContact CD2-CD1 3.87Å; F2435-L2624 HydrophobicContact CE1-CD1 3.91Å; F2435-L2624 HydrophobicContact CE2-CD1 4.19Å; F2435-L2624 HydrophobicContact CG-CD1 3.55Å; F2435-L2624 VanDerWaalsContact CG-CD1 3.46Å; F2435-L2624 HydrophobicContact CZ-CD1 4.21Å; F2435-P2646 HydrophobicContact CE1-CB 3.98Å; F2435-P2646 HydrophobicContact CE1-CG 3.82Å; F2435-P2646 HydrophobicContact CZ-CG 3.97Å
2436	S	87.5	Confident	81.4	Confident	0 Å²	0	17 Å²	17	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	129.8	175.9	51.3	0	0	0	0	111	S2426 I2443 S2444 W2446	S2426-S2436 WeakPolarHBondContact O-CA 3.32Å; S2436-I2443 CarbonylContact O-C 3.58Å; S2436-I2443 VanDerWaalsContact O-CA 3.26Å; S2436-I2443 WeakPolarHBondContact O-CA 3.19Å; S2436-S2444 PolarHBondContact N-O 2.99Å; S2436-S2444 PolarHBondContact O-N 3.03Å; S2436-S2444 WeakPolarHBondContact OG-CB 3.4Å; S2436-S2444 PolarHBondContact OG-O 3.33Å; S2436-S2444 PolarHBondContact OG-OG 3.14Å; S2436-W2446 PolarHBondContact OG-NE1 2.86Å
2437	A	85.8	Confident	81.1	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	135.9	171.7	0	0	0	0	0	110.1	K2425 S2426 H2442 I2443 V2482 I2484	K2425-A2437 PolarHBondContact N-O 2.95Å; S2426-A2437 PolarHBondContact N-O 2.97Å; S2426-A2437 PolarHBondContact O-N 3.1Å; A2437-H2442 CarbonylContact C-O 3.53Å; A2437-H2442 WeakPolarHBondContact CA-O 3.33Å; A2437-I2443 HydrophobicContact CB-CG1 4.36Å; A2437-V2482 HydrophobicContact CB-CB 4.48Å; A2437-V2482 HydrophobicContact CB-CG1 3.65Å; A2437-I2484 HydrophobicContact CB-CD1 3.28Å; A2437-I2484 HydrophobicContact CB-CG1 3.61Å
2438	T	82.6	Confident	80.5	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	169	171.1	70.5	0	0	0	0	111.5	S2419 S2422 G2423 N2440 G2441 H2442	S2419-T2438 VanDerWaalsContact OG-CG2 3.31Å; S2419-T2438 WeakPolarHBondContact OG-CG2 3.35Å; S2422-T2438 VanDerWaalsContact OG-CB 3.24Å; S2422-T2438 WeakPolarHBondContact OG-CB 3.28Å; S2422-T2438 PolarHBondContact OG-OG1 3.19Å; G2423-T2438 WeakPolarHBondContact O-CA 3.26Å; T2438-N2440 PolarHBondContact O-N 3.25Å; T2438-N2440 PolarHBondContact OG1-N 3.25Å; T2438-G2441 PolarHBondContact O-N 3.25Å; T2438-H2442 HydrophobicContact CG2-CB 4.3Å; T2438-H2442 PolarHBondContact N-O 3.03Å; T2438-H2442 WeakPolarHBondContact OG1-CB 3.38Å; T2438-H2442 PolarHBondContact OG1-N 3.18Å; T2438-H2442 PolarHBondContact OG1-O 3.02Å; T2438-H2442 VanDerWaalsContact OG1-O 3.07Å
2439	S	72.7	Confident	79.5	Confident	40.3333 Å²	40.3333	22.2 Å²	22.2	28%	0.282	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-22.4	176.9	52.6	0	0	0	0	114.3	S2422 G2423 G2441	S2422-S2439 WeakPolarHBondContact CB-OG 3.09Å; S2422-S2439 PolarHBondContact OG-OG 3.04Å; G2423-S2439 PolarHBondContact O-N 2.97Å; S2439-G2441 VanDerWaalsContact C-N 3.32Å; S2439-G2441 PolarHBondContact O-N 3.29Å
2440	N	67.6	Low	78.4	Confident	104.333 Å²	104.333	31.2 Å²	31.2	56%	0.558	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.8	10.9	-174.7	-57.9	5.1	0	0	0	112.3	S2422 T2438 H2442	S2422-N2440 PolarHBondContact OG-ND2 3.23Å; T2438-N2440 PolarHBondContact O-N 3.25Å; T2438-N2440 PolarHBondContact OG1-N 3.25Å; N2440-H2442 VanDerWaalsContact C-N 3.29Å; N2440-H2442 PolarHBondContact O-N 2.92Å
2441	G	71.2	Confident	77.6	Confident	4 Å²	4	36.9 Å²	36.9	4%	0.041	18%	0.182	C	C	.	.	S	Bend	trans	77.4	10.4	-177.9	0	0	0	0	0	114.6	T2438 S2439 I2462	T2438-G2441 PolarHBondContact O-N 3.25Å; S2439-G2441 VanDerWaalsContact C-N 3.32Å; S2439-G2441 PolarHBondContact O-N 3.29Å; G2441-I2462 PolarHBondContact O-N 3.11Å; G2441-I2462 VanDerWaalsContact O-N 3.13Å
2442	H	76.2	Confident	77.3	Confident	14 Å²	14	34.2 Å²	34.2	7%	0.065	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	128.2	173	-172.8	-82.3	0	0	0	110.1	Q2421 A2437 T2438 N2440 S2444 E2459	Q2421-H2442 VanDerWaalsContact CD-CD2 3.45Å; Q2421-H2442 PolarHBondContact OE1-CD2 3.34Å; A2437-H2442 CarbonylContact C-O 3.53Å; A2437-H2442 WeakPolarHBondContact CA-O 3.33Å; T2438-H2442 HydrophobicContact CG2-CB 4.3Å; T2438-H2442 PolarHBondContact N-O 3.03Å; T2438-H2442 WeakPolarHBondContact OG1-CB 3.38Å; T2438-H2442 PolarHBondContact OG1-N 3.18Å; T2438-H2442 PolarHBondContact OG1-O 3.02Å; T2438-H2442 VanDerWaalsContact OG1-O 3.07Å; N2440-H2442 VanDerWaalsContact C-N 3.29Å; N2440-H2442 PolarHBondContact O-N 2.92Å; H2442-S2444 PolarHBondContact CE1-OG 2.79Å; H2442-S2444 PolarHBondContact ND1-OG 3.22Å; H2442-E2459 VanDerWaalsContact CE1-CD 3.5Å; H2442-E2459 IonicContact CE1-OE1 3.39Å; H2442-E2459 PolarHBondContact CE1-OE1 3.16Å; H2442-E2459 IonicContact CE1-OE2 2.78Å; H2442-E2459 IonicContact NE2-OE1 2.93Å; H2442-E2459 PolarHBondContact NE2-OE1 3.11Å; H2442-E2459 IonicContact NE2-OE2 3.69Å; H2442-E2459 PolarHBondContact NE2-OE2 2.84Å
2443	I	81.3	Confident	77.5	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	125.1	-179.7	-59.3	-174.3	0	0	0	109.1	S2436 A2437 E2459 M2460 I2462 I2484 L2624 I2626	S2436-I2443 CarbonylContact O-C 3.58Å; S2436-I2443 VanDerWaalsContact O-CA 3.26Å; S2436-I2443 WeakPolarHBondContact O-CA 3.19Å; A2437-I2443 HydrophobicContact CB-CG1 4.36Å; I2443-E2459 CarbonylContact O-C 3.46Å; I2443-E2459 VanDerWaalsContact O-CA 3.3Å; I2443-E2459 WeakPolarHBondContact O-CA 3.26Å; I2443-M2460 HydrophobicContact CB-CB 4.23Å; I2443-M2460 PolarHBondContact N-O 2.73Å; I2443-M2460 PolarHBondContact O-N 3.32Å; I2443-I2462 HydrophobicContact CD1-CD1 3.32Å; I2443-I2462 HydrophobicContact CD1-CG1 4.1Å; I2443-I2462 HydrophobicContact CG1-CD1 4.12Å; I2443-I2484 HydrophobicContact CB-CD1 4.32Å; I2443-I2484 HydrophobicContact CD1-CD1 3.74Å; I2443-I2484 HydrophobicContact CD1-CG1 4.16Å; I2443-I2484 HydrophobicContact CG1-CD1 3.86Å; I2443-I2484 HydrophobicContact CG2-CD1 3.69Å; I2443-L2624 HydrophobicContact CD1-CD2 4.39Å; I2443-L2624 HydrophobicContact CG2-CD2 4.31Å; I2443-I2626 HydrophobicContact CD1-CD1 3.42Å; I2443-I2626 VanDerWaalsContact CD1-CD1 3.47Å; I2443-I2626 HydrophobicContact CD1-CG1 3.61Å
2444	S	81.4	Confident	77.4	Confident	0.333333 Å²	0.333333	35.5 Å²	35.5	0%	0.002	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	135.8	175.8	-24.1	0	0	0	0	110.4	S2436 H2442	S2436-S2444 PolarHBondContact N-O 2.99Å; S2436-S2444 PolarHBondContact O-N 3.03Å; S2436-S2444 WeakPolarHBondContact OG-CB 3.4Å; S2436-S2444 PolarHBondContact OG-O 3.33Å; S2436-S2444 PolarHBondContact OG-OG 3.14Å; H2442-S2444 PolarHBondContact CE1-OG 2.79Å; H2442-S2444 PolarHBondContact ND1-OG 3.22Å
2445	V	81.8	Confident	77	Confident	5 Å²	5	38.4 Å²	38.4	3%	0.03	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	120.7	177.7	-173.1	0	0	0	0	108.9	Y2433 F2435 I2457 S2458 P2646	Y2433-V2445 HydrophobicContact CD1-CG1 4.08Å; F2435-V2445 HydrophobicContact CD1-CB 4.46Å; F2435-V2445 HydrophobicContact CD1-CG1 4.11Å; F2435-V2445 HydrophobicContact CD1-CG2 3.95Å; F2435-V2445 HydrophobicContact CE1-CB 4.44Å; F2435-V2445 HydrophobicContact CE1-CG1 3.71Å; F2435-V2445 HydrophobicContact CE1-CG2 4.03Å; V2445-I2457 HydrophobicContact CG1-CD1 4.3Å; V2445-I2457 PolarHBondContact O-N 3.26Å; V2445-S2458 PolarHBondContact N-O 2.9Å; V2445-S2458 PolarHBondContact O-N 3.24Å; V2445-P2646 HydrophobicContact CG2-CB 4.39Å
2446	W	82.8	Confident	76.5	Confident	15.6667 Å²	15.6667	41.1 Å²	41.1	6%	0.059	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	134	-179.2	-47.8	77.8	0	0	0	110.2	L2417 V2418 Y2433 I2434 S2436 F2454 E2455 L2456	L2417-W2446 HydrophobicContact CB-CE3 4.26Å; L2417-W2446 HydrophobicContact CB-CH2 3.85Å; L2417-W2446 HydrophobicContact CB-CZ2 4.08Å; L2417-W2446 HydrophobicContact CB-CZ3 3.91Å; L2417-W2446 HydrophobicContact CD1-CD2 3.85Å; L2417-W2446 HydrophobicContact CD1-CE3 3.92Å; L2417-W2446 HydrophobicContact CD1-CG 4.16Å; L2417-W2446 HydrophobicContact CD1-CZ3 4.42Å; L2417-W2446 HydrophobicContact CD2-CE3 3.87Å; L2417-W2446 HydrophobicContact CD2-CZ3 3.87Å; L2417-W2446 HydrophobicContact CG-CE3 4.24Å; L2417-W2446 HydrophobicContact CG-CZ3 4.28Å; V2418-W2446 WeakPolarHBondContact O-CH2 3.24Å; Y2433-W2446 CarbonylContact C-O 3.5Å; Y2433-W2446 VanDerWaalsContact CA-O 3.24Å; Y2433-W2446 WeakPolarHBondContact CA-O 3.33Å; I2434-W2446 HydrophobicContact CB-CB 4.16Å; I2434-W2446 HydrophobicContact CB-CG 4.5Å; I2434-W2446 PolarHBondContact N-O 3.18Å; I2434-W2446 PolarHBondContact O-N 3.08Å; S2436-W2446 PolarHBondContact OG-NE1 2.86Å; W2446-F2454 HydrophobicContact CB-CB 4.34Å; W2446-F2454 HydrophobicContact CB-CD1 4.39Å; W2446-E2455 CarbonylContact C-O 3.54Å; W2446-E2455 VanDerWaalsContact CA-O 3.25Å; W2446-E2455 WeakPolarHBondContact CA-O 3.31Å; W2446-L2456 HydrophobicContact CD2-CB 4.37Å; W2446-L2456 HydrophobicContact CD2-CD1 4.02Å; W2446-L2456 HydrophobicContact CE3-CB 3.73Å; W2446-L2456 HydrophobicContact CE3-CD1 4.22Å; W2446-L2456 HydrophobicContact CH2-CB 4.02Å; W2446-L2456 HydrophobicContact CH2-CD1 4.07Å; W2446-L2456 HydrophobicContact CH2-CD2 4.45Å; W2446-L2456 HydrophobicContact CH2-CG 4.43Å; W2446-L2456 HydrophobicContact CZ2-CD1 3.9Å; W2446-L2456 HydrophobicContact CZ3-CB 3.54Å; W2446-L2456 HydrophobicContact CZ3-CD1 4.26Å; W2446-L2456 HydrophobicContact CZ3-CG 4.39Å
2447	R	78.9	Confident	75.7	Confident	66.6667 Å²	66.6667	42.6 Å²	42.6	25%	0.252	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	145.2	174.7	-151.1	174.5	165.1	152.2	-1.4	110.7	P2432 Y2433 G2449 F2454 E2455 I2457	P2432-R2447 HydrophobicContact CB-CG 4.38Å; P2432-R2447 HydrophobicContact CG-CG 4.35Å; P2432-R2447 WeakPolarHBondContact O-CA 3.25Å; Y2433-R2447 HydrophobicContact CD1-CB 3.91Å; Y2433-R2447 HydrophobicContact CD1-CG 4.09Å; Y2433-R2447 HydrophobicContact CE1-CB 4.2Å; Y2433-R2447 HydrophobicContact CE1-CG 3.76Å; R2447-G2449 PolarHBondContact O-N 2.83Å; R2447-F2454 CarbonylContact O-C 3.58Å; R2447-F2454 WeakPolarHBondContact O-CA 3.38Å; R2447-E2455 PolarHBondContact N-O 3Å; R2447-E2455 PolarHBondContact O-N 2.97Å; R2447-I2457 HydrophobicContact CB-CD1 3.22Å; R2447-I2457 HydrophobicContact CB-CG1 3.59Å; R2447-I2457 HydrophobicContact CG-CD1 3.76Å; R2447-I2457 HydrophobicContact CG-CG1 4.48Å
2448	Y	77.2	Confident	74.9	Confident	47.3333 Å²	47.3333	43.3 Å²	43.3	19%	0.186	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	112.3	162.5	-162.6	-106.9	0	0	0	111	I2381 K2414 F2431 P2432 G2452 F2454	I2381-Y2448 HydrophobicContact CD1-CD2 4.36Å; I2381-Y2448 HydrophobicContact CD1-CE2 3.65Å; I2381-Y2448 HydrophobicContact CG1-CE2 4.37Å; I2381-Y2448 HydrophobicContact CG2-CE1 4.26Å; K2414-Y2448 PolarHBondContact NZ-OH 3.45Å; F2431-Y2448 HydrophobicContact CE2-CD1 4.37Å; P2432-Y2448 PolarHBondContact O-N 3.15Å; Y2448-G2452 VanDerWaalsContact CE2-O 3.23Å; Y2448-G2452 WeakPolarHBondContact CE2-O 3.26Å; Y2448-G2452 VanDerWaalsContact CZ-CA 3.47Å; Y2448-G2452 VanDerWaalsContact OH-CA 3.26Å; Y2448-G2452 WeakPolarHBondContact OH-CA 3.27Å; Y2448-G2452 PolarHBondContact OH-O 3.09Å; Y2448-F2454 HydrophobicContact CD2-CD1 4.34Å; Y2448-F2454 AromaticContact CD2-CD2 3.94Å; Y2448-F2454 HydrophobicContact CD2-CD2 3.94Å; Y2448-F2454 AromaticContact CD2-CE1 3.98Å; Y2448-F2454 HydrophobicContact CD2-CE1 3.98Å; Y2448-F2454 AromaticContact CD2-CE2 3.57Å; Y2448-F2454 HydrophobicContact CD2-CE2 3.57Å; Y2448-F2454 HydrophobicContact CD2-CG 4.32Å; Y2448-F2454 AromaticContact CD2-CZ 3.59Å; Y2448-F2454 HydrophobicContact CD2-CZ 3.59Å; Y2448-F2454 HydrophobicContact CE2-CD2 4.49Å; Y2448-F2454 HydrophobicContact CE2-CE2 4.1Å; Y2448-F2454 HydrophobicContact CE2-CZ 4.45Å; Y2448-F2454 HydrophobicContact CG-CE1 4.39Å; Y2448-F2454 HydrophobicContact CG-CZ 4.31Å
2449	G	67.2	Low	74.4	Confident	16.3333 Å²	16.3333	45.3 Å²	45.3	17%	0.168	23%	0.231	C	C	.	.			trans	-85.6	168.6	178.8	0	0	0	0	0	113.8	R2447 N2451 G2452 N2453	R2447-G2449 PolarHBondContact O-N 2.83Å; G2449-N2451 PolarHBondContact O-N 3.06Å; G2449-G2452 PolarHBondContact O-N 3.12Å; G2449-N2453 PolarHBondContact N-O 3.13Å
2450	K	64	Low	74.2	Confident	204.667 Å²	204.667	44.1 Å²	44.1	89%	0.89	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-29	179.5	-71	-171.6	177.9	-175.2	0	113.6	G2452	K2450-G2452 PolarHBondContact O-N 2.99Å; K2450-G2452 VanDerWaalsContact O-N 3.15Å
2451	N	64.5	Low	74.2	Confident	136.667 Å²	136.667	45.1 Å²	45.1	73%	0.731	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.5	0.3	177.9	-63.2	-10.2	0	0	0	112.8	G2449 N2453	G2449-N2451 PolarHBondContact O-N 3.06Å; N2451-N2453 VanDerWaalsContact C-N 3.32Å; N2451-N2453 PolarHBondContact O-N 3Å
2452	G	69.3	Low	73.8	Confident	14 Å²	14	45.6 Å²	45.6	14%	0.144	23%	0.227	C	C	.	.	S	Bend	trans	78.6	13.2	179.8	0	0	0	0	0	114.4	K2414 Y2448 G2449 K2450	K2414-G2452 WeakPolarHBondContact CE-O 3.46Å; K2414-G2452 PolarHBondContact NZ-O 2.9Å; Y2448-G2452 VanDerWaalsContact CE2-O 3.23Å; Y2448-G2452 WeakPolarHBondContact CE2-O 3.26Å; Y2448-G2452 VanDerWaalsContact CZ-CA 3.47Å; Y2448-G2452 VanDerWaalsContact OH-CA 3.26Å; Y2448-G2452 WeakPolarHBondContact OH-CA 3.27Å; Y2448-G2452 PolarHBondContact OH-O 3.09Å; G2449-G2452 PolarHBondContact O-N 3.12Å; K2450-G2452 PolarHBondContact O-N 2.99Å; K2450-G2452 VanDerWaalsContact O-N 3.15Å
2453	N	79.6	Confident	72.6	Confident	71 Å²	71	48.1 Å²	48.1	38%	0.38	25%	0.246	S	C	.	.	S	Bend	trans	-112.9	154.8	176.3	-68.7	-17.2	0	0	0	110.1	G2449 N2451	G2449-N2453 PolarHBondContact N-O 3.13Å; N2451-N2453 VanDerWaalsContact C-N 3.32Å; N2451-N2453 PolarHBondContact O-N 3Å
2454	F	81.2	Confident	71	Confident	5 Å²	5	49.3 Å²	49.3	2%	0.022	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	135	171.8	-73.7	-88.7	0	0	0	110.5	L2403 Q2415 L2417 F2429 I2434 W2446 R2447 Y2448	L2403-F2454 HydrophobicContact CD2-CD2 3.32Å; L2403-F2454 HydrophobicContact CD2-CE2 3.54Å; L2403-F2454 VanDerWaalsContact CD2-CE2 3.49Å; L2403-F2454 HydrophobicContact CD2-CG 4.37Å; Q2415-F2454 PolarHBondContact NE2-O 3.13Å; L2417-F2454 HydrophobicContact CD1-CB 4.17Å; L2417-F2454 HydrophobicContact CD2-CB 4.21Å; F2429-F2454 HydrophobicContact CE2-CE1 4.41Å; F2429-F2454 HydrophobicContact CE2-CZ 4.11Å; I2434-F2454 HydrophobicContact CD1-CB 4.44Å; I2434-F2454 HydrophobicContact CD1-CD1 3.47Å; I2434-F2454 VanDerWaalsContact CD1-CD1 3.47Å; I2434-F2454 HydrophobicContact CD1-CD2 3.78Å; I2434-F2454 HydrophobicContact CD1-CE1 3.46Å; I2434-F2454 VanDerWaalsContact CD1-CE1 3.46Å; I2434-F2454 HydrophobicContact CD1-CE2 3.75Å; I2434-F2454 HydrophobicContact CD1-CG 3.63Å; I2434-F2454 HydrophobicContact CD1-CZ 3.59Å; I2434-F2454 HydrophobicContact CG1-CD1 3.9Å; I2434-F2454 HydrophobicContact CG1-CE1 3.6Å; I2434-F2454 HydrophobicContact CG1-CZ 3.98Å; W2446-F2454 HydrophobicContact CB-CB 4.34Å; W2446-F2454 HydrophobicContact CB-CD1 4.39Å; R2447-F2454 CarbonylContact O-C 3.58Å; R2447-F2454 WeakPolarHBondContact O-CA 3.38Å; Y2448-F2454 HydrophobicContact CD2-CD1 4.34Å; Y2448-F2454 AromaticContact CD2-CD2 3.94Å; Y2448-F2454 HydrophobicContact CD2-CD2 3.94Å; Y2448-F2454 AromaticContact CD2-CE1 3.98Å; Y2448-F2454 HydrophobicContact CD2-CE1 3.98Å; Y2448-F2454 AromaticContact CD2-CE2 3.57Å; Y2448-F2454 HydrophobicContact CD2-CE2 3.57Å; Y2448-F2454 HydrophobicContact CD2-CG 4.32Å; Y2448-F2454 AromaticContact CD2-CZ 3.59Å; Y2448-F2454 HydrophobicContact CD2-CZ 3.59Å; Y2448-F2454 HydrophobicContact CE2-CD2 4.49Å; Y2448-F2454 HydrophobicContact CE2-CE2 4.1Å; Y2448-F2454 HydrophobicContact CE2-CZ 4.45Å; Y2448-F2454 HydrophobicContact CG-CE1 4.39Å; Y2448-F2454 HydrophobicContact CG-CZ 4.31Å
2455	E	76.9	Confident	69	Low	60.6667 Å²	60.6667	52.6 Å²	52.6	28%	0.283	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	139.4	179.5	-66.7	175.3	-171.3	0	0	109.2	T2064 W2446 R2447 I2457	T2064-E2455 WeakPolarHBondContact CG2-OE2 3.49Å; W2446-E2455 CarbonylContact C-O 3.54Å; W2446-E2455 VanDerWaalsContact CA-O 3.25Å; W2446-E2455 WeakPolarHBondContact CA-O 3.31Å; R2447-E2455 PolarHBondContact N-O 3Å; R2447-E2455 PolarHBondContact O-N 2.97Å; E2455-I2457 PolarHBondContact O-N 3.28Å
2456	L	76.9	Confident	66.8	Low	57.3333 Å²	57.3333	56 Å²	56	30%	0.3	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	121.4	175.7	-176.5	64.1	0	0	0	108.7	W2446 E2459	W2446-L2456 HydrophobicContact CD2-CB 4.37Å; W2446-L2456 HydrophobicContact CD2-CD1 4.02Å; W2446-L2456 HydrophobicContact CE3-CB 3.73Å; W2446-L2456 HydrophobicContact CE3-CD1 4.22Å; W2446-L2456 HydrophobicContact CH2-CB 4.02Å; W2446-L2456 HydrophobicContact CH2-CD1 4.07Å; W2446-L2456 HydrophobicContact CH2-CD2 4.45Å; W2446-L2456 HydrophobicContact CH2-CG 4.43Å; W2446-L2456 HydrophobicContact CZ2-CD1 3.9Å; W2446-L2456 HydrophobicContact CZ3-CB 3.54Å; W2446-L2456 HydrophobicContact CZ3-CD1 4.26Å; W2446-L2456 HydrophobicContact CZ3-CG 4.39Å; L2456-E2459 HydrophobicContact CD1-CG 4.12Å; L2456-E2459 HydrophobicContact CD2-CG 4.14Å; L2456-E2459 WeakPolarHBondContact CD2-OE1 3.35Å; L2456-E2459 HydrophobicContact CG-CG 4.4Å
2457	I	70.5	Confident	64.6	Low	31 Å²	31	60.7 Å²	60.7	16%	0.159	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	-47.5	-179.1	-54	-171.9	0	0	0	111	L2068 L2129 Y2433 V2445 R2447 E2455	L2068-I2457 HydrophobicContact CD2-CD1 4.33Å; L2068-I2457 HydrophobicContact CD2-CG2 3.37Å; L2068-I2457 HydrophobicContact CG-CG2 4.39Å; L2129-I2457 HydrophobicContact CD1-CG2 4.43Å; Y2433-I2457 HydrophobicContact CD1-CD1 3.82Å; Y2433-I2457 HydrophobicContact CE1-CD1 3.63Å; V2445-I2457 HydrophobicContact CG1-CD1 4.3Å; V2445-I2457 PolarHBondContact O-N 3.26Å; R2447-I2457 HydrophobicContact CB-CD1 3.22Å; R2447-I2457 HydrophobicContact CB-CG1 3.59Å; R2447-I2457 HydrophobicContact CG-CD1 3.76Å; R2447-I2457 HydrophobicContact CG-CG1 4.48Å; E2455-I2457 PolarHBondContact O-N 3.28Å
2458	S	69.2	Low	62.6	Low	14 Å²	14	62.6 Å²	62.6	10%	0.098	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	151.8	-169.5	-167.3	0	0	0	0	110.4	L2129 V2445	L2129-S2458 PolarHBondContact O-OG 2.92Å; V2445-S2458 PolarHBondContact N-O 2.9Å; V2445-S2458 PolarHBondContact O-N 3.24Å
2459	E	72.2	Confident	60.5	Low	44 Å²	44	66.2 Å²	66.2	21%	0.206	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	131.4	172.2	-66.3	-176.8	140.9	0	0	107.8	R2046 H2442 I2443 L2456	R2046-E2459 IonicContact NH1-OE2 3.72Å; R2046-E2459 PolarHBondContact NH1-OE2 3.14Å; H2442-E2459 VanDerWaalsContact CE1-CD 3.5Å; H2442-E2459 IonicContact CE1-OE1 3.39Å; H2442-E2459 PolarHBondContact CE1-OE1 3.16Å; H2442-E2459 IonicContact CE1-OE2 2.78Å; H2442-E2459 IonicContact NE2-OE1 2.93Å; H2442-E2459 PolarHBondContact NE2-OE1 3.11Å; H2442-E2459 IonicContact NE2-OE2 3.69Å; H2442-E2459 PolarHBondContact NE2-OE2 2.84Å; I2443-E2459 CarbonylContact O-C 3.46Å; I2443-E2459 VanDerWaalsContact O-CA 3.3Å; I2443-E2459 WeakPolarHBondContact O-CA 3.26Å; L2456-E2459 HydrophobicContact CD1-CG 4.12Å; L2456-E2459 HydrophobicContact CD2-CG 4.14Å; L2456-E2459 WeakPolarHBondContact CD2-OE1 3.35Å; L2456-E2459 HydrophobicContact CG-CG 4.4Å
2460	M	68.8	Low	58.8	Low	15 Å²	15	70.6 Å²	70.6	7%	0.074	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	124.4	176.6	-64.2	172.1	64.3	0	0	107.7	L2129 G2130 I2443 Y2644	L2129-M2460 VanDerWaalsContact O-CG 3.28Å; L2129-M2460 WeakPolarHBondContact O-CG 3.24Å; G2130-M2460 WeakPolarHBondContact O-CE 3.31Å; I2443-M2460 HydrophobicContact CB-CB 4.23Å; I2443-M2460 PolarHBondContact N-O 2.73Å; I2443-M2460 PolarHBondContact O-N 3.32Å; M2460-Y2644 HydrophobicContact CE-CD1 3.43Å; M2460-Y2644 VanDerWaalsContact CE-CD1 3.46Å; M2460-Y2644 HydrophobicContact CE-CE1 3.94Å; M2460-Y2644 HydrophobicContact CE-CG 3.94Å
2461	I	66.4	Low	57.2	Low	123.667 Å²	123.667	67.3 Å²	67.3	63%	0.634	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.1	113.1	171.4	-59	174.2	0	0	0	106.7	S2463	I2461-S2463 PolarHBondContact O-N 3.06Å
2462	I	63.4	Low	55.8	Low	14.3333 Å²	14.3333	65.8 Å²	65.8	7%	0.074	38%	0.379	C	S	.	.			trans	-82.3	97	169.2	-57.8	170.9	0	0	0	106.4	W2136 G2441 I2443 S2464 I2626	W2136-I2462 HydrophobicContact CH2-CG2 3.99Å; W2136-I2462 HydrophobicContact CZ2-CG2 3.73Å; G2441-I2462 PolarHBondContact O-N 3.11Å; G2441-I2462 VanDerWaalsContact O-N 3.13Å; I2443-I2462 HydrophobicContact CD1-CD1 3.32Å; I2443-I2462 HydrophobicContact CD1-CG1 4.1Å; I2443-I2462 HydrophobicContact CG1-CD1 4.12Å; I2462-S2464 PolarHBondContact O-N 3.21Å; I2462-I2626 HydrophobicContact CD1-CB 4.12Å; I2462-I2626 HydrophobicContact CD1-CD1 3.8Å; I2462-I2626 HydrophobicContact CD1-CG1 4.04Å; I2462-I2626 HydrophobicContact CD1-CG2 3.38Å; I2462-I2626 VanDerWaalsContact CD1-CG2 3.45Å; I2462-I2626 HydrophobicContact CG1-CD1 4.41Å; I2462-I2626 HydrophobicContact CG1-CG2 4.31Å
2463	S	51.1	Low	54.2	Low	68.3333 Å²	68.3333	69.5 Å²	69.5	48%	0.478	40%	0.399	S	S	.	.			trans	-64.3	135.2	172.1	38	0	0	0	0	109.6	I2461	I2461-S2463 PolarHBondContact O-N 3.06Å
2464	S	46.8	Very low	52	Low	24.3333 Å²	24.3333	72.9 Å²	72.9	17%	0.17	42%	0.423	C	S	.	.			trans	-61.8	138.7	164.7	79.9	0	0	0	0	107.4	I2462 L2466 D2467	I2462-S2464 PolarHBondContact O-N 3.21Å; S2464-L2466 PolarHBondContact O-N 3.28Å; S2464-D2467 PolarHBondContact N-OD2 2.84Å; S2464-D2467 PolarHBondContact O-N 2.91Å; S2464-D2467 PolarHBondContact OG-N 3.32Å; S2464-D2467 PolarHBondContact OG-OD1 2.98Å; S2464-D2467 PolarHBondContact OG-OD2 2.96Å
2465	P	39.8	Very low	49.8	Very low	69 Å²	69	78.7 Å²	78.7	45%	0.448	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-7.4	179.2	-5.7	9.5	0	0	0	113.8	I2630	P2465-I2630 HydrophobicContact CG-CD1 3.86Å
2466	L	36.6	Very low	47.9	Very low	77.3333 Å²	77.3333	84.3 Å²	84.3	41%	0.405	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-8.5	-172.9	-101.1	90.8	0	0	0	116.2	S2464 N2468 L2469 I2630	S2464-L2466 PolarHBondContact O-N 3.28Å; L2466-N2468 PolarHBondContact O-N 3.21Å; L2466-L2469 HydrophobicContact CD2-CB 4.35Å; L2466-L2469 HydrophobicContact CG-CD1 4.25Å; L2466-L2469 PolarHBondContact O-N 3.05Å; L2466-L2469 VanDerWaalsContact O-N 3.11Å; L2466-I2630 HydrophobicContact CD1-CG2 4.47Å
2467	D	36.4	Very low	46.1	Very low	113 Å²	113	84.8 Å²	84.8	60%	0.604	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-15.3	177	-70.5	-30.4	0	0	0	112.7	S2464	S2464-D2467 PolarHBondContact N-OD2 2.84Å; S2464-D2467 PolarHBondContact O-N 2.91Å; S2464-D2467 PolarHBondContact OG-N 3.32Å; S2464-D2467 PolarHBondContact OG-OD1 2.98Å; S2464-D2467 PolarHBondContact OG-OD2 2.96Å
2468	N	36.1	Very low	44.9	Very low	107 Å²	107	87 Å²	87	57%	0.572	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-6	176.8	-71.5	-5.3	0	0	0	115	L2466	L2466-N2468 PolarHBondContact O-N 3.21Å
2469	L	33.4	Very low	43.8	Very low	122.667 Å²	122.667	88.3 Å²	88.3	64%	0.642	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.2	3.3	-175.1	-93	150	0	0	0	114	L2466	L2466-L2469 HydrophobicContact CD2-CB 4.35Å; L2466-L2469 HydrophobicContact CG-CD1 4.25Å; L2466-L2469 PolarHBondContact O-N 3.05Å; L2466-L2469 VanDerWaalsContact O-N 3.11Å
2470	N	31.6	Very low	43	Very low	109.333 Å²	109.333	90.6 Å²	90.6	59%	0.585	52%	0.519	S	S	*	.			trans	-168.2	86.5	176.8	-67.5	-29.3	0	0	0	114.4	S2472	N2470-S2472 PolarHBondContact O-N 3.25Å; N2470-S2472 VanDerWaalsContact O-N 3.08Å
2471	S	31.3	Very low	42.5	Very low	135.667 Å²	135.667	91.1 Å²	91.1	95%	0.949	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	21.7	173.4	63.4	0	0	0	0	115
2472	S	35.4	Very low	42.5	Very low	105.667 Å²	105.667	86 Å²	86	74%	0.739	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127	0.9	-178.3	62.5	0	0	0	0	116.6	N2470	N2470-S2472 PolarHBondContact O-N 3.25Å; N2470-S2472 VanDerWaalsContact O-N 3.08Å
2473	T	34.3	Very low	43.1	Very low	90.3333 Å²	90.3333	87.9 Å²	87.9	55%	0.554	50%	0.504	S	S	*	.			trans	-122.7	106.2	171.4	53.6	0	0	0	0	109.3	D2475	T2473-D2475 PolarHBondContact O-N 3.24Å
2474	T	34.8	Very low	44.3	Very low	143 Å²	143	84.8 Å²	84.8	88%	0.877	48%	0.482	S	S	*	.			trans	-68.3	56.7	169.9	53	0	0	0	0	110.8	E2476	T2474-E2476 PolarHBondContact O-N 2.8Å
2475	D	34	Very low	45.7	Very low	127.333 Å²	127.333	85.6 Å²	85.6	68%	0.681	48%	0.483	S	S	*	.			trans	-94.9	99.9	160.3	-80.5	-22	0	0	0	105.2	T2473 N2477	T2473-D2475 PolarHBondContact O-N 3.24Å; D2475-N2477 VanDerWaalsContact C-N 3.31Å; D2475-N2477 PolarHBondContact O-N 3.18Å
2476	E	36.6	Very low	47.4	Very low	177.667 Å²	177.667	83.1 Å²	83.1	83%	0.83	47%	0.467	S	S	*	.			trans	-51.7	100.6	171.5	-68.9	-179.3	158	0	0	108.3	T2474 V2478	T2474-E2476 PolarHBondContact O-N 2.8Å; E2476-V2478 VanDerWaalsContact C-N 3.34Å; E2476-V2478 WeakPolarHBondContact O-CG2 3.44Å; E2476-V2478 PolarHBondContact O-N 3.2Å
2477	N	38.7	Very low	49	Very low	68.3333 Å²	68.3333	80.3 Å²	80.3	37%	0.365	45%	0.452	S	S	.	.			trans	-69.1	95.1	172.7	-77.5	-29.4	0	0	0	107.4	D2475 V2479 S2631	D2475-N2477 VanDerWaalsContact C-N 3.31Å; D2475-N2477 PolarHBondContact O-N 3.18Å; N2477-V2479 PolarHBondContact O-N 3.14Å; N2477-S2631 VanDerWaalsContact CG-O 3.24Å; N2477-S2631 PolarHBondContact OD1-O 2.98Å
2478	V	45	Very low	50	Low	76 Å²	76	81 Å²	81	46%	0.461	45%	0.451	S	S	.	.			trans	-72.4	108.8	-177.2	-169.6	0	0	0	0	109	E2476 N2480 S2631	E2476-V2478 VanDerWaalsContact C-N 3.34Å; E2476-V2478 WeakPolarHBondContact O-CG2 3.44Å; E2476-V2478 PolarHBondContact O-N 3.2Å; V2478-N2480 VanDerWaalsContact C-N 3.29Å; V2478-N2480 WeakPolarHBondContact CG1-OD1 3.23Å; V2478-N2480 PolarHBondContact O-N 3.04Å; V2478-N2480 VanDerWaalsContact O-N 3.1Å; V2478-N2480 PolarHBondContact O-OD1 3.16Å; V2478-S2631 PolarHBondContact O-OG 3.27Å
2479	V	47.1	Very low	50.6	Low	42 Å²	42	79 Å²	79	26%	0.255	44%	0.436	S	S	.	.			trans	-66.8	96.9	163.8	-175.4	0	0	0	0	107.1	N2477 V2482 Q2628	N2477-V2479 PolarHBondContact O-N 3.14Å; V2479-V2482 HydrophobicContact CB-CG2 4.35Å; V2479-V2482 HydrophobicContact CG1-CG2 3.4Å; V2479-V2482 VanDerWaalsContact CG1-CG2 3.44Å; V2479-Q2628 HydrophobicContact CG1-CB 4.24Å
2480	N	56	Low	50.8	Low	92.6667 Å²	92.6667	78.4 Å²	78.4	50%	0.496	44%	0.438	S	S	.	.			trans	-75.3	-28	-172.1	-71	-39.5	0	0	0	113.1	V2478 T2629 Q2637	V2478-N2480 VanDerWaalsContact C-N 3.29Å; V2478-N2480 WeakPolarHBondContact CG1-OD1 3.23Å; V2478-N2480 PolarHBondContact O-N 3.04Å; V2478-N2480 VanDerWaalsContact O-N 3.1Å; V2478-N2480 PolarHBondContact O-OD1 3.16Å; N2480-T2629 WeakPolarHBondContact CB-OG1 3.45Å; N2480-T2629 PolarHBondContact N-OG1 3.43Å; N2480-Q2637 PolarHBondContact ND2-OE1 2.93Å
2481	L	58.6	Low	50.8	Low	24.6667 Å²	24.6667	76.9 Å²	76.9	13%	0.129	43%	0.434	C	S	.	.			trans	-132.3	118	-176.5	-164.2	95.9	0	0	0	110.2	T2153 Y2155 G2627 Q2628 T2629 F2639	T2153-L2481 WeakPolarHBondContact O-CD1 3.34Å; Y2155-L2481 HydrophobicContact CD1-CD2 3.57Å; Y2155-L2481 HydrophobicContact CE1-CD2 3.65Å; L2481-G2627 VanDerWaalsContact O-O 3.12Å; L2481-Q2628 VanDerWaalsContact O-CA 3.32Å; L2481-Q2628 WeakPolarHBondContact O-CA 3.34Å; L2481-T2629 HydrophobicContact CB-CG2 4.09Å; L2481-T2629 PolarHBondContact N-OG1 2.82Å; L2481-F2639 HydrophobicContact CD2-CD2 4.46Å; L2481-F2639 HydrophobicContact CD2-CE2 3.86Å
2482	V	66.3	Low	50.9	Low	16.3333 Å²	16.3333	74.5 Å²	74.5	10%	0.099	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	109.5	163.5	-175.3	0	0	0	0	106.9	A2437 V2479	A2437-V2482 HydrophobicContact CB-CB 4.48Å; A2437-V2482 HydrophobicContact CB-CG1 3.65Å; V2479-V2482 HydrophobicContact CB-CG2 4.35Å; V2479-V2482 HydrophobicContact CG1-CG2 3.4Å; V2479-V2482 VanDerWaalsContact CG1-CG2 3.44Å
2483	K	75.4	Confident	50.5	Low	54.6667 Å²	54.6667	77.6 Å²	77.6	24%	0.238	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	148.7	171.7	-172.8	174.9	-177.3	178.5	0	107.9	Y2155	Y2155-K2483 HydrophobicContact CE1-CB 3.75Å; Y2155-K2483 HydrophobicContact CE1-CD 4.49Å; Y2155-K2483 HydrophobicContact CE1-CG 4.49Å; Y2155-K2483 HydrophobicContact CE2-CB 4.37Å; Y2155-K2483 HydrophobicContact CE2-CD 4.44Å; Y2155-K2483 HydrophobicContact CE2-CG 4.47Å; Y2155-K2483 WeakPolarHBondContact O-CD 3.22Å; Y2155-K2483 WeakPolarHBondContact O-CE 3.32Å; Y2155-K2483 PolarHBondContact O-NZ 3.17Å; Y2155-K2483 VanDerWaalsContact OH-C 3.24Å; Y2155-K2483 PolarHBondContact OH-O 3.03Å
2484	I	76.5	Confident	50.2	Low	4 Å²	4	78.6 Å²	78.6	2%	0.021	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	132.6	176.5	-66	178.6	0	0	0	107.1	S2426 D2428 F2435 A2437 I2443 L2624 I2626	S2426-I2484 PolarHBondContact OG-N 3.25Å; S2426-I2484 VanDerWaalsContact OG-N 3.12Å; D2428-I2484 HydrophobicContact CB-CG2 4.39Å; F2435-I2484 HydrophobicContact CB-CD1 4.42Å; F2435-I2484 HydrophobicContact CB-CG2 3.89Å; F2435-I2484 HydrophobicContact CG-CG2 4.46Å; A2437-I2484 HydrophobicContact CB-CD1 3.28Å; A2437-I2484 HydrophobicContact CB-CG1 3.61Å; I2443-I2484 HydrophobicContact CB-CD1 4.32Å; I2443-I2484 HydrophobicContact CD1-CD1 3.74Å; I2443-I2484 HydrophobicContact CD1-CG1 4.16Å; I2443-I2484 HydrophobicContact CG1-CD1 3.86Å; I2443-I2484 HydrophobicContact CG2-CD1 3.69Å; I2484-L2624 HydrophobicContact CG2-CD1 3.21Å; I2484-L2624 HydrophobicContact CG2-CD2 4.21Å; I2484-L2624 HydrophobicContact CG2-CG 3.76Å; I2484-I2626 HydrophobicContact CG1-CG1 4.2Å
2485	Q	76.4	Confident	50.1	Low	40.6667 Å²	40.6667	77.3 Å²	77.3	19%	0.19	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	123.9	169.5	-167.8	170.3	-6.8	0	0	108.8	I2157 L2625	I2157-Q2485 HydrophobicContact CB-CG 4.41Å; I2157-Q2485 HydrophobicContact CD1-CB 3.69Å; I2157-Q2485 HydrophobicContact CD1-CG 3.85Å; I2157-Q2485 HydrophobicContact CG1-CB 4.26Å; I2157-Q2485 HydrophobicContact CG1-CG 4.23Å; I2157-Q2485 PolarHBondContact O-NE2 3.28Å; Q2485-L2625 PolarHBondContact N-O 2.98Å; Q2485-L2625 PolarHBondContact O-N 2.87Å
2486	S	73.9	Confident	50	Low	16 Å²	16	75.5 Å²	75.5	11%	0.112	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	144.1	174.4	64.1	0	0	0	0	109.7	D2428 N2430 K2623	D2428-S2486 WeakPolarHBondContact OD2-CA 3.4Å; D2428-S2486 VanDerWaalsContact OD2-CB 3.3Å; D2428-S2486 WeakPolarHBondContact OD2-CB 3.38Å; D2428-S2486 PolarHBondContact OD2-N 3.05Å; D2428-S2486 PolarHBondContact OD2-OG 3Å; N2430-S2486 VanDerWaalsContact CB-OG 3.27Å; N2430-S2486 WeakPolarHBondContact CB-OG 3.43Å; S2486-K2623 CarbonylContact C-O 3.58Å; S2486-K2623 WeakPolarHBondContact CA-O 3.31Å
2487	F	71.3	Confident	49.8	Very low	20.3333 Å²	20.3333	71.7 Å²	71.7	9%	0.089	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	147.9	178.7	61.1	-78	0	0	0	109.1	I2157 K2623 L2625 V2643	I2157-F2487 HydrophobicContact CD1-CD1 3.94Å; I2157-F2487 HydrophobicContact CD1-CE1 4.33Å; F2487-K2623 HydrophobicContact CD1-CB 4.17Å; F2487-K2623 HydrophobicContact CD2-CB 4.34Å; F2487-K2623 HydrophobicContact CE1-CB 3.63Å; F2487-K2623 HydrophobicContact CE2-CB 3.87Å; F2487-K2623 HydrophobicContact CE2-CD 3.98Å; F2487-K2623 HydrophobicContact CE2-CG 4.44Å; F2487-K2623 HydrophobicContact CG-CB 4.45Å; F2487-K2623 HydrophobicContact CZ-CB 3.48Å; F2487-K2623 VanDerWaalsContact CZ-CB 3.46Å; F2487-K2623 HydrophobicContact CZ-CD 3.98Å; F2487-K2623 HydrophobicContact CZ-CG 4.36Å; F2487-K2623 PolarHBondContact N-O 3.09Å; F2487-K2623 VanDerWaalsContact N-O 3.1Å; F2487-K2623 PolarHBondContact O-N 3Å; F2487-L2625 HydrophobicContact CE1-CB 4.01Å; F2487-V2643 HydrophobicContact CE1-CG1 4.32Å; F2487-V2643 HydrophobicContact CZ-CG1 3.95Å; F2487-V2643 HydrophobicContact CZ-CG2 4.37Å
2488	E	58.1	Low	49.4	Very low	126.667 Å²	126.667	75.2 Å²	75.2	59%	0.592	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.6	123	169.1	-71	-174.4	172.3	0	0	108
2489	Y	48	Very low	48.7	Very low	65 Å²	65	79.1 Å²	79.1	26%	0.255	43%	0.427	S	S	.	.			trans	-105.6	114.9	174	-177.3	-102.3	0	0	0	108.6	P2491 N2621 K2623	Y2489-P2491 HydrophobicContact CD1-CB 4.38Å; Y2489-P2491 VanDerWaalsContact CE1-CA 3.47Å; Y2489-P2491 HydrophobicContact CE1-CB 4.03Å; Y2489-P2491 VanDerWaalsContact O-CD 3.28Å; Y2489-P2491 WeakPolarHBondContact O-CD 3.35Å; Y2489-N2621 PolarHBondContact N-O 2.96Å; Y2489-K2623 HydrophobicContact CG-CD 4.4Å
2490	T	37.4	Very low	47.8	Very low	110 Å²	110	81.7 Å²	81.7	68%	0.675	45%	0.447	S	S	*	.			trans	-82.9	111.4	164.3	42	0	0	0	0	107.7	C2492	T2490-C2492 PolarHBondContact O-N 3.28Å; T2490-C2492 VanDerWaalsContact O-N 3.12Å
2491	P	31.7	Very low	46.6	Very low	77.3333 Å²	77.3333	82.4 Å²	82.4	50%	0.502	45%	0.454	S	S	.	.			trans	-59.6	123.3	172.1	24	-30.7	0	0	0	108	Y2489 Y2493	Y2489-P2491 HydrophobicContact CD1-CB 4.38Å; Y2489-P2491 VanDerWaalsContact CE1-CA 3.47Å; Y2489-P2491 HydrophobicContact CE1-CB 4.03Å; Y2489-P2491 VanDerWaalsContact O-CD 3.28Å; Y2489-P2491 WeakPolarHBondContact O-CD 3.35Å; P2491-Y2493 PolarHBondContact O-N 2.85Å
2492	C	32.6	Very low	45.3	Very low	85.6667 Å²	85.6667	87.7 Å²	87.7	58%	0.579	48%	0.482	S	S	*	.	S	Bend	trans	-68.3	29	173.3	-60	0	0	0	0	111.9	T2490	T2490-C2492 PolarHBondContact O-N 3.28Å; T2490-C2492 VanDerWaalsContact O-N 3.12Å
2493	Y	27.5	Very low	43.5	Very low	170.667 Å²	170.667	93.7 Å²	93.7	67%	0.669	51%	0.513	S	S	*	.			trans	-137.4	106.8	177.2	-124.7	-89.9	0	0	0	108	P2491 P2495 N2498	P2491-Y2493 PolarHBondContact O-N 2.85Å; Y2493-P2495 VanDerWaalsContact O-CD 3.26Å; Y2493-P2495 WeakPolarHBondContact O-CD 3.41Å; Y2493-N2498 PolarHBondContact OH-OD1 3.22Å
2494	N	27.8	Very low	41.3	Very low	111 Å²	111	96.3 Å²	96.3	59%	0.594	53%	0.534	S	S	*	.			trans	-84.2	110.7	168.4	-127.9	-5.7	0	0	0	106.9	S2496 T2497 N2498 V2501	N2494-S2496 PolarHBondContact O-N 2.94Å; N2494-S2496 VanDerWaalsContact O-N 3.08Å; N2494-S2496 PolarHBondContact OD1-OG 3.33Å; N2494-T2497 PolarHBondContact O-N 2.89Å; N2494-N2498 PolarHBondContact O-N 2.88Å; N2494-V2501 HydrophobicContact CB-CG2 4.35Å
2495	P	32.3	Very low	39	Very low	115.667 Å²	115.667	101.9 Å²	101.9	75%	0.751	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	-4.1	-174.6	18.1	-18.6	0	0	0	113.5	Y2493 T2497	Y2493-P2495 VanDerWaalsContact O-CD 3.26Å; Y2493-P2495 WeakPolarHBondContact O-CD 3.41Å; P2495-T2497 VanDerWaalsContact C-N 3.28Å; P2495-T2497 PolarHBondContact O-N 2.77Å
2496	S	33	Very low	36.8	Very low	89.6667 Å²	89.6667	106.8 Å²	106.8	63%	0.627	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	-12.7	-176.2	57.2	0	0	0	0	114.9	N2494	N2494-S2496 PolarHBondContact O-N 2.94Å; N2494-S2496 VanDerWaalsContact O-N 3.08Å; N2494-S2496 PolarHBondContact OD1-OG 3.33Å
2497	T	32.5	Very low	34.6	Very low	98 Å²	98	114.8 Å²	114.8	60%	0.601	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.9	35.1	178.7	52.2	0	0	0	0	113	N2494 P2495 E2499	N2494-T2497 PolarHBondContact O-N 2.89Å; P2495-T2497 VanDerWaalsContact C-N 3.28Å; P2495-T2497 PolarHBondContact O-N 2.77Å; T2497-E2499 PolarHBondContact O-N 2.98Å
2498	N	30.8	Very low	32.6	Very low	142.333 Å²	142.333	121.8 Å²	121.8	76%	0.761	67%	0.672	S	S	*	*			trans	-69.3	12.2	178.4	-104.8	2.2	0	0	0	113.6	Y2493 N2494 S2500	Y2493-N2498 PolarHBondContact OH-OD1 3.22Å; N2494-N2498 PolarHBondContact O-N 2.88Å; N2498-S2500 PolarHBondContact O-N 2.88Å
2499	E	29.7	Very low	31.1	Very low	158.667 Å²	158.667	123.8 Å²	123.8	74%	0.741	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102	91.2	177	-75	-172.3	165.6	0	0	110.8	T2497 V2501	T2497-E2499 PolarHBondContact O-N 2.98Å; E2499-V2501 PolarHBondContact O-N 3.02Å
2500	S	29	Very low	30.1	Very low	95.3333 Å²	95.3333	126.4 Å²	126.4	67%	0.667	71%	0.707	S	S	*	*			trans	-74.5	73.6	171.2	56.6	0	0	0	0	111	N2498 I2502	N2498-S2500 PolarHBondContact O-N 2.88Å; S2500-I2502 PolarHBondContact O-N 2.96Å
2501	V	29.5	Very low	29.7	Very low	107.667 Å²	107.667	129.7 Å²	129.7	65%	0.653	71%	0.714	S	S	*	*			trans	-89.4	62.6	171	-171.9	0	0	0	0	109.2	N2494 E2499 N2503	N2494-V2501 HydrophobicContact CB-CG2 4.35Å; E2499-V2501 PolarHBondContact O-N 3.02Å; V2501-N2503 VanDerWaalsContact C-N 3.31Å; V2501-N2503 WeakPolarHBondContact CG1-OD1 3.45Å; V2501-N2503 PolarHBondContact O-N 3.43Å
2502	I	32.1	Very low	29.5	Very low	137 Å²	137	134.6 Å²	134.6	70%	0.703	73%	0.73	S	S	*	*			trans	-87.7	85.1	162.7	-53.7	173.7	0	0	0	105.6	S2500 T2504	S2500-I2502 PolarHBondContact O-N 2.96Å; I2502-T2504 HydrophobicContact CB-CG2 4.45Å; I2502-T2504 HydrophobicContact CG2-CG2 4.08Å; I2502-T2504 PolarHBondContact O-N 3.05Å
2503	N	28.9	Very low	29.3	Very low	141.667 Å²	141.667	137.8 Å²	137.8	76%	0.758	74%	0.742	S	S	*	*			trans	-81.8	80.3	164.3	-87.4	-9.9	0	0	0	107.2	V2501 C2505	V2501-N2503 VanDerWaalsContact C-N 3.31Å; V2501-N2503 WeakPolarHBondContact CG1-OD1 3.45Å; V2501-N2503 PolarHBondContact O-N 3.43Å; N2503-C2505 PolarHBondContact O-N 3Å; N2503-C2505 VanDerWaalsContact O-N 3.13Å
2504	T	28.8	Very low	29.2	Very low	109.333 Å²	109.333	138.5 Å²	138.5	67%	0.671	75%	0.751	S	S	*	*			trans	-91.2	96	158.3	46.4	0	0	0	0	106.4	I2502 D2506	I2502-T2504 HydrophobicContact CB-CG2 4.45Å; I2502-T2504 HydrophobicContact CG2-CG2 4.08Å; I2502-T2504 PolarHBondContact O-N 3.05Å; T2504-D2506 VanDerWaalsContact C-N 3.31Å; T2504-D2506 PolarHBondContact O-N 3.02Å
2505	C	27.8	Very low	29.2	Very low	122 Å²	122	140.7 Å²	140.7	82%	0.824	76%	0.763	S	S	*	*			trans	-92.7	69.4	163.4	-81.6	0	0	0	0	109	N2503	N2503-C2505 PolarHBondContact O-N 3Å; N2503-C2505 VanDerWaalsContact O-N 3.13Å
2506	D	29.4	Very low	28.9	Very low	142.333 Å²	142.333	140.3 Å²	140.3	76%	0.761	76%	0.763	S	S	*	*			trans	-92	93.7	166.7	-79.6	-27.9	0	0	0	110	T2504 L2508	T2504-D2506 VanDerWaalsContact C-N 3.31Å; T2504-D2506 PolarHBondContact O-N 3.02Å; D2506-L2508 VanDerWaalsContact C-N 3.31Å
2507	E	28.6	Very low	28.7	Very low	184 Å²	184	142 Å²	142	86%	0.86	77%	0.769	S	S	*	*			trans	19.6	66.3	159.3	-66	-175.6	170.9	0	0	116.4
2508	L	29	Very low	28.4	Very low	167.333 Å²	167.333	143.2 Å²	143.2	88%	0.876	78%	0.776	S	S	*	*			trans	-113.5	90.8	151.3	-74.2	172.5	0	0	0	108.4	D2506 P2510	D2506-L2508 VanDerWaalsContact C-N 3.31Å; L2508-P2510 WeakPolarHBondContact O-CD 3.33Å; L2508-P2510 VanDerWaalsContact O-N 3.12Å
2509	E	26.5	Very low	28.3	Very low	169.667 Å²	169.667	143.4 Å²	143.4	79%	0.793	78%	0.777	S	S	*	*			trans	-53.6	127.8	171.1	-72.5	-173.4	145	0	0	110.1	H2511	E2509-H2511 PolarHBondContact O-N 2.76Å
2510	P	28.2	Very low	28.1	Very low	119.667 Å²	119.667	141.6 Å²	141.6	78%	0.777	78%	0.777	S	S	*	*			trans	-74.4	107.8	178.9	28.9	-30.4	0	0	0	108.8	L2508 Q2512	L2508-P2510 WeakPolarHBondContact O-CD 3.33Å; L2508-P2510 VanDerWaalsContact O-N 3.12Å; P2510-Q2512 PolarHBondContact O-N 3.12Å; P2510-Q2512 VanDerWaalsContact O-N 3.15Å
2511	H	28.8	Very low	27.9	Very low	178.333 Å²	178.333	144.7 Å²	144.7	83%	0.826	79%	0.785	S	S	*	*			trans	-55.6	109.2	168.2	-84.7	-71	0	0	0	109.8	E2509 N2513	E2509-H2511 PolarHBondContact O-N 2.76Å; H2511-N2513 PolarHBondContact O-N 2.85Å
2512	Q	26.6	Very low	27.8	Very low	179.667 Å²	179.667	148.5 Å²	148.5	84%	0.84	80%	0.796	S	S	*	*			trans	-62.6	113.2	168.8	-70.9	179.3	-13.4	0	0	108.5	P2510 E2514	P2510-Q2512 PolarHBondContact O-N 3.12Å; P2510-Q2512 VanDerWaalsContact O-N 3.15Å; Q2512-E2514 PolarHBondContact O-N 2.82Å
2513	N	27.9	Very low	27.3	Very low	154.333 Å²	154.333	151.6 Å²	151.6	83%	0.825	81%	0.805	S	S	*	*			trans	-86.1	108.7	163.5	-79.7	-22.2	0	0	0	108.2	H2511	H2511-N2513 PolarHBondContact O-N 2.85Å
2514	E	26.9	Very low	27.2	Very low	184.667 Å²	184.667	150.3 Å²	150.3	86%	0.863	81%	0.806	S	S	*	*			trans	-72.2	125.7	167.5	-67.9	-173.3	148.6	0	0	110.2	Q2512 S2516	Q2512-E2514 PolarHBondContact O-N 2.82Å; E2514-S2516 PolarHBondContact O-N 3.14Å
2515	D	26.9	Very low	27	Very low	158.333 Å²	158.333	152.2 Å²	152.2	85%	0.847	81%	0.813	S	S	*	*			trans	-81.5	121.6	166.1	-81.5	-44	0	0	0	110.9	V2517	D2515-V2517 PolarHBondContact O-N 2.89Å
2516	S	26.2	Very low	26.8	Very low	106 Å²	106	158 Å²	158	74%	0.741	82%	0.817	S	S	*	*			trans	-48.2	119.6	168.6	66.4	0	0	0	0	112.2	E2514 V2518	E2514-S2516 PolarHBondContact O-N 3.14Å; S2516-V2518 PolarHBondContact O-N 3.41Å
2517	V	29	Very low	26.6	Very low	125.667 Å²	125.667	156.2 Å²	156.2	76%	0.762	82%	0.816	S	S	*	*				-118.7	118.7	123.2	176.4	0	0	0	0	108.5	D2515 D2519	D2515-V2517 PolarHBondContact O-N 2.89Å; V2517-D2519 PolarHBondContact O-N 3.12Å
2518	V	26.5	Very low	26.4	Very low	123.667 Å²	123.667	152.8 Å²	152.8	75%	0.749	81%	0.812	S	S	*	*			trans	-75.7	115.6	169	173.8	0	0	0	0	108.2	S2516 T2520	S2516-V2518 PolarHBondContact O-N 3.41Å; V2518-T2520 HydrophobicContact CG1-CG2 3.81Å
2519	D	27.5	Very low	26.2	Very low	146.667 Å²	146.667	150 Å²	150	78%	0.784	81%	0.807	S	S	*	*			trans	-109.1	120.6	161.4	-87.7	-35.3	0	0	0	111	V2517 L2521	V2517-D2519 PolarHBondContact O-N 3.12Å; D2519-L2521 PolarHBondContact O-N 3.07Å
2520	T	26.2	Very low	26.6	Very low	119.333 Å²	119.333	147.6 Å²	147.6	73%	0.732	81%	0.806	S	S	*	*			trans	-57.6	120.4	178	38.3	0	0	0	0	112.9	V2518 E2522	V2518-T2520 HydrophobicContact CG1-CG2 3.81Å; T2520-E2522 PolarHBondContact O-N 3.07Å
2521	L	25.4	Very low	26.4	Very low	161.667 Å²	161.667	150.1 Å²	150.1	85%	0.846	81%	0.812	S	S	*	*			trans	-74.8	116.1	153.5	-81.2	159.5	0	0	0	111	D2519 F2523	D2519-L2521 PolarHBondContact O-N 3.07Å; L2521-F2523 PolarHBondContact O-N 3.49Å
2522	E	26.2	Very low	26.2	Very low	186.333 Å²	186.333	146.9 Å²	146.9	87%	0.871	81%	0.81	S	S	*	*			trans	-97.5	124.2	173.6	-83.7	177.6	163.6	0	0	112.1	T2520 S2524	T2520-E2522 PolarHBondContact O-N 3.07Å; E2522-S2524 PolarHBondContact O-N 3.4Å
2523	F	22.7	Very low	26.2	Very low	202.667 Å²	202.667	143.6 Å²	143.6	89%	0.889	81%	0.806	S	S	*	*			trans	-69.4	120.9	168.4	-91.7	-99.3	0	0	0	110.1	L2521 N2525	L2521-F2523 PolarHBondContact O-N 3.49Å; F2523-N2525 PolarHBondContact O-N 2.6Å
2524	S	26.3	Very low	26.1	Very low	113.667 Å²	113.667	145 Å²	145	80%	0.795	81%	0.808	S	S	*	*			trans	-113.6	105.5	160.9	56.3	0	0	0	0	111.4	E2522 R2526	E2522-S2524 PolarHBondContact O-N 3.4Å; S2524-R2526 PolarHBondContact O-N 2.91Å
2525	N	24.4	Very low	26.1	Very low	151 Å²	151	143.3 Å²	143.3	81%	0.807	81%	0.805	S	S	*	*			trans	-9.6	123.2	153.6	-71.2	-38	0	0	0	116.9	F2523	F2523-N2525 PolarHBondContact O-N 2.6Å
2526	R	24.2	Very low	26.1	Very low	242.333 Å²	242.333	143.3 Å²	143.3	91%	0.914	81%	0.805	S	S	*	*			trans	23	112.9	133.1	-89.6	-174.3	-177.6	-170.6	0.9	114.1	S2524	S2524-R2526 PolarHBondContact O-N 2.91Å
2527	S	25.5	Very low	26.1	Very low	106 Å²	106	143.3 Å²	143.3	74%	0.741	81%	0.805	S	S	*	*			trans	-86	113.8	151	52.2	0	0	0	0	114.2
2528	S	23.4	Very low	26.1	Very low	111 Å²	111	142.6 Å²	142.6	78%	0.776	81%	0.805	S	S	*	*			trans	-26.7	122.4	145	53.4	0	0	0	0	113.7
2529	S	25.6	Very low	26	Very low	108.333 Å²	108.333	144.9 Å²	144.9	76%	0.758	81%	0.808	S	S	*	*			trans	-69.4	135.6	149.6	53.6	0	0	0	0	112.2
2530	P	33.3	Very low	26	Very low	120 Å²	120	146.4 Å²	146.4	78%	0.779	81%	0.81	S	S	*	*			trans	-110.9	147.1	168.4	34.3	-24.1	0	0	0	112.7	S2532	P2530-S2532 PolarHBondContact O-N 3.45Å; P2530-S2532 VanDerWaalsContact O-N 3.16Å
2531	L	24	Very low	26.1	Very low	173.333 Å²	173.333	149.7 Å²	149.7	91%	0.908	82%	0.816	S	S	*	*			trans	-28.7	112.6	138.2	-84.9	132.2	0	0	0	112.1	S2533	L2531-S2533 PolarHBondContact O-N 3.29Å
2532	S	25.9	Very low	26	Very low	111 Å²	111	145.3 Å²	145.3	78%	0.776	81%	0.811	S	S	*	*			trans	-118.5	108.9	158.1	52.2	0	0	0	0	109.3	P2530	P2530-S2532 PolarHBondContact O-N 3.45Å; P2530-S2532 VanDerWaalsContact O-N 3.16Å
2533	S	25.6	Very low	26.2	Very low	109.333 Å²	109.333	144.6 Å²	144.6	77%	0.765	81%	0.811	S	S	*	*			trans	-48.8	114.9	135.5	58.7	0	0	0	0	111.2	L2531 D2535	L2531-S2533 PolarHBondContact O-N 3.29Å; S2533-D2535 PolarHBondContact O-N 2.93Å
2534	E	27.1	Very low	26.3	Very low	184.333 Å²	184.333	140.6 Å²	140.6	86%	0.861	80%	0.804	S	S	*	*			trans	-140.5	125.4	156.9	-79.2	-179.1	167.5	0	0	106.9
2535	D	26	Very low	26.3	Very low	149.667 Å²	149.667	142.3 Å²	142.3	80%	0.8	80%	0.804	S	S	*	*				-70.8	130.7	87.4	-91.4	-26.1	0	0	0	109.9	S2533	S2533-D2535 PolarHBondContact O-N 2.93Å
2536	D	26.4	Very low	26.5	Very low	157 Å²	157	143.9 Å²	143.9	84%	0.84	81%	0.806	S	S	*	*			trans	-121.8	123.3	147.2	-103.3	-29.1	0	0	0	112.3	S2538	D2536-S2538 PolarHBondContact O-N 3.47Å
2537	S	27.1	Very low	26.5	Very low	107 Å²	107	138.7 Å²	138.7	75%	0.748	80%	0.797	S	S	*	*			trans	-159	108	146	64.2	0	0	0	0	114.3
2538	S	28	Very low	26.7	Very low	109.333 Å²	109.333	141.4 Å²	141.4	77%	0.765	80%	0.802	S	S	*	*			trans	-159	119.8	141.4	62.7	0	0	0	0	115	D2536	D2536-S2538 PolarHBondContact O-N 3.47Å
2539	Q	26.1	Very low	26.8	Very low	172 Å²	172	145.8 Å²	145.8	80%	0.804	81%	0.808	S	S	*	*			trans	68.5	101.3	153.2	-60.4	-178.1	-3.3	0	0	116.3
2540	H	27.6	Very low	26.8	Very low	178.667 Å²	178.667	144 Å²	144	83%	0.827	81%	0.806	S	S	*	*			trans	-122.8	116.2	136.5	-76.3	-65.5	0	0	0	110.8
2541	H	26.5	Very low	26.5	Very low	188 Å²	188	145.5 Å²	145.5	87%	0.87	81%	0.808	S	S	*	*				170.4	109.8	122.5	-84.8	-58	0	0	0	110.2
2542	G	25	Very low	26.6	Very low	71.3333 Å²	71.3333	146.1 Å²	146.1	74%	0.735	80%	0.803	S	S	*	*			trans	-120	125.4	151.1	0	0	0	0	0	108.6
2543	I	29.2	Very low	26.6	Very low	170 Å²	170	148.1 Å²	148.1	87%	0.872	81%	0.805	S	S	*	*			trans	-131.5	114	157.5	-62.3	-179.2	0	0	0	105.9
2544	T	26.2	Very low	26.6	Very low	120 Å²	120	148 Å²	148	74%	0.736	80%	0.804	S	S	*	*			trans	-61.3	139.6	179.2	41.8	0	0	0	0	113
2545	D	26.1	Very low	26.5	Very low	148 Å²	148	148.1 Å²	148.1	79%	0.791	81%	0.807	S	S	*	*			trans	-25.9	129.8	136.7	-70.3	-30.7	0	0	0	114.5
2546	E	26.9	Very low	26.4	Very low	185.333 Å²	185.333	150.3 Å²	150.3	87%	0.866	81%	0.809	S	S	*	*			trans	-108	122	151.2	-72.5	-158.3	151.3	0	0	111.1	L2548	E2546-L2548 PolarHBondContact O-N 2.84Å
2547	N	26.1	Very low	26.4	Very low	132.667 Å²	132.667	146.5 Å²	146.5	71%	0.709	81%	0.807	S	S	*	*			trans	-92.2	132.3	154.2	-77.3	-55.2	0	0	0	112.2
2548	L	28.7	Very low	26.2	Very low	163.667 Å²	163.667	147.3 Å²	147.3	86%	0.857	81%	0.807	S	S	*	*			trans	-139.7	89.9	152.7	-89.1	137.5	0	0	0	112.8	E2546	E2546-L2548 PolarHBondContact O-N 2.84Å
2549	F	24.7	Very low	26.2	Very low	203 Å²	203	146.9 Å²	146.9	89%	0.89	81%	0.805	S	S	*	*			trans	-11.7	124.1	140.4	-80.8	-89.2	0	0	0	114.2
2550	G	26.4	Very low	26.2	Very low	70.6667 Å²	70.6667	145.2 Å²	145.2	73%	0.729	80%	0.801	S	S	*	*			trans	148	86.5	132.9	0	0	0	0	0	112.9
2551	D	26.9	Very low	26.2	Very low	151.667 Å²	151.667	147.7 Å²	147.7	81%	0.811	81%	0.805	S	S	*	*			trans	78.2	125.8	141.8	-89.9	-24.7	0	0	0	121
2552	K	26	Very low	26.3	Very low	185.667 Å²	185.667	145.7 Å²	145.7	81%	0.807	80%	0.801	S	S	*	*			trans	33.8	110.7	137.5	-70.7	175	-179	177.3	0	117.6
2553	N	26.7	Very low	26.3	Very low	152.333 Å²	152.333	150.1 Å²	150.1	82%	0.815	80%	0.802	S	S	*	*			trans	-64.5	124.2	139.9	-77.5	-26.4	0	0	0	116
2554	S	24.8	Very low	26.4	Very low	107.333 Å²	107.333	150.4 Å²	150.4	75%	0.751	81%	0.805	S	S	*	*			trans	79.6	122.5	142.6	67.1	0	0	0	0	117.2
2555	M	25.8	Very low	26.4	Very low	186.667 Å²	186.667	151.5 Å²	151.5	92%	0.92	80%	0.803	S	S	*	*			trans	-153	106.1	142.8	-96.3	-156.4	176.2	0	0	111.7
2556	K	23.4	Very low	26.5	Very low	196.667 Å²	196.667	151.7 Å²	151.7	86%	0.855	80%	0.804	S	S	*	*			trans	-55.6	127	140.3	-83.9	-178.4	171.3	-178.2	0	109.6
2557	G	26.2	Very low	26.4	Very low	77 Å²	77	151.3 Å²	151.3	79%	0.794	80%	0.802	S	S	*	*			trans	-167.8	102.9	153.5	0	0	0	0	0	110.7
2558	T	23.9	Very low	26.5	Very low	122.667 Å²	122.667	148.4 Å²	148.4	75%	0.753	80%	0.804	S	S	*	*			trans	-63	125.9	165.7	44.5	0	0	0	0	113.8
2559	S	26.3	Very low	26.5	Very low	100.667 Å²	100.667	145.9 Å²	145.9	70%	0.704	80%	0.8	S	S	*	*			trans	-172.8	111.2	135.3	58.3	0	0	0	0	111.2
2560	D	26.7	Very low	26.5	Very low	137.333 Å²	137.333	143.6 Å²	143.6	73%	0.734	80%	0.797	S	S	*	*			trans	-117.5	121.3	133.3	-71.8	-35.5	0	0	0	108.6
2561	Y	27.8	Very low	26.7	Very low	230 Å²	230	149.2 Å²	149.2	90%	0.902	80%	0.804	S	S	*	*			trans	-119.9	118.2	155	-83.4	-80	0	0	0	107.8
2562	D	28	Very low	26.6	Very low	148 Å²	148	148.3 Å²	148.3	79%	0.791	80%	0.804	S	S	*	*			trans	-84.2	139	178.9	-83	-38.7	0	0	0	113
2563	E	25.5	Very low	26.8	Very low	163.667 Å²	163.667	145.3 Å²	145.3	77%	0.765	80%	0.804	S	S	*	*			trans	-3.7	130.1	152.8	-61.3	177.8	154.7	0	0	116.9
2564	L	31.1	Very low	26.9	Very low	175.667 Å²	175.667	143.3 Å²	143.3	92%	0.92	80%	0.802	S	S	*	*			trans	-142.5	105.8	133.7	-84.8	171.5	0	0	0	109.3
2565	M	26.3	Very low	26.9	Very low	142.667 Å²	142.667	147.5 Å²	147.5	70%	0.703	81%	0.81	S	S	*	*			trans	-35.6	131.1	157	-60.7	-83.7	-98.9	0	0	114.3
2566	D	28.2	Very low	26.8	Very low	152 Å²	152	144.6 Å²	144.6	81%	0.813	81%	0.806	S	S	*	*			trans	-175.2	121	133.8	-116.3	-8.8	0	0	0	114.7
2567	E	24.7	Very low	27	Very low	177 Å²	177	140.5 Å²	140.5	83%	0.827	80%	0.802	S	S	*	*			trans	-54.9	132.9	166.5	-62.9	-165	157.6	0	0	114.4
2568	G	29.1	Very low	26.9	Very low	72 Å²	72	146 Å²	146	74%	0.742	81%	0.807	S	S	*	*			trans	-165.8	69.9	176.1	0	0	0	0	0	112.5
2569	S	27.8	Very low	27	Very low	111 Å²	111	148.8 Å²	148.8	78%	0.776	81%	0.809	S	S	*	*			trans	21.4	122.5	159.5	57.9	0	0	0	0	119.5	E2571	S2569-E2571 PolarHBondContact O-N 2.96Å
2570	D	25.3	Very low	27	Very low	154 Å²	154	151.3 Å²	151.3	82%	0.824	81%	0.814	S	S	*	*			trans	-20.7	119.7	152.3	-61.7	-47	0	0	0	116.1
2571	E	29.7	Very low	27	Very low	190 Å²	190	152.9 Å²	152.9	89%	0.888	82%	0.822	S	S	*	*			trans	-130.8	110.8	140.9	-85.7	-173.1	176.9	0	0	108.7	S2569 P2573	S2569-E2571 PolarHBondContact O-N 2.96Å; E2571-P2573 WeakPolarHBondContact O-CD 3.43Å
2572	T	25.4	Very low	26.7	Very low	131.333 Å²	131.333	150.6 Å²	150.6	81%	0.806	82%	0.822	S	S	*	*			trans	-79.2	119.5	177.2	42.9	0	0	0	0	110.1	S2574	T2572-S2574 PolarHBondContact O-N 2.96Å
2573	P	29.5	Very low	26.6	Very low	123.333 Å²	123.333	149.3 Å²	149.3	80%	0.801	82%	0.82	S	S	*	*			trans	-84.6	111.8	165.6	15.4	-3.3	0	0	0	108.5	E2571 Q2575	E2571-P2573 WeakPolarHBondContact O-CD 3.43Å; P2573-Q2575 PolarHBondContact O-N 3.43Å
2574	S	28.2	Very low	26.6	Very low	109.333 Å²	109.333	148 Å²	148	77%	0.765	82%	0.822	S	S	*	*			trans	-37.9	125.1	167.9	49.1	0	0	0	0	113.8	T2572 C2576	T2572-S2574 PolarHBondContact O-N 2.96Å; S2574-C2576 PolarHBondContact O-N 3.06Å
2575	Q	24.9	Very low	26.4	Very low	197 Å²	197	146.9 Å²	146.9	92%	0.921	82%	0.817	S	S	*	*			trans	-48.6	115.6	162.2	-69.7	168.8	-22.7	0	0	110.8	P2573 S2577	P2573-Q2575 PolarHBondContact O-N 3.43Å; Q2575-S2577 PolarHBondContact O-N 3.27Å
2576	C	24.8	Very low	26.3	Very low	126 Å²	126	149.3 Å²	149.3	85%	0.851	82%	0.824	S	S	*	*			trans	-105	116.5	157.6	-119.2	0	0	0	0	107.9	S2574 E2578	S2574-C2576 PolarHBondContact O-N 3.06Å; C2576-E2578 PolarHBondContact O-N 3.23Å
2577	S	27.5	Very low	26.1	Very low	110 Å²	110	148.2 Å²	148.2	77%	0.769	83%	0.827	S	S	*	*			trans	-67.2	117.2	-174.4	49.3	0	0	0	0	112.4	Q2575 K2579	Q2575-S2577 PolarHBondContact O-N 3.27Å; S2577-K2579 PolarHBondContact O-N 2.95Å
2578	E	24.9	Very low	26.3	Very low	192 Å²	192	146.7 Å²	146.7	90%	0.897	82%	0.824	S	S	*	*			trans	-76.3	98.4	158.6	-75.8	178.9	149.4	0	0	109.5	C2576	C2576-E2578 PolarHBondContact O-N 3.23Å
2579	K	25.4	Very low	26.1	Very low	182.667 Å²	182.667	151.1 Å²	151.1	79%	0.794	83%	0.831	S	S	*	*			trans	-127.8	132	147.5	-83.2	175.9	-178.1	178.7	0	106.9	S2577	S2577-K2579 PolarHBondContact O-N 2.95Å
2580	D	26.7	Very low	26.1	Very low	151.667 Å²	151.667	151.8 Å²	151.8	81%	0.811	83%	0.83	S	S	*	*			trans	115.4	72.8	163.9	-59	-18.3	0	0	0	113.7
2581	L	26.3	Very low	26.2	Very low	171.667 Å²	171.667	148.7 Å²	148.7	90%	0.899	83%	0.826	S	S	*	*			trans	-163.1	67.7	148.4	-104.3	139.7	0	0	0	109.5
2582	M	21.9	Very low	26	Very low	180.667 Å²	180.667	149.2 Å²	149.2	89%	0.89	83%	0.825	S	S	*	*			trans	-124.6	77.2	167.2	-92	-81.8	-110	0	0	108.1
2583	T	25.9	Very low	26	Very low	122.333 Å²	122.333	150.7 Å²	150.7	75%	0.751	83%	0.829	S	S	*	*			trans	-145.3	79.6	162.4	43.7	0	0	0	0	109	D2585	T2583-D2585 PolarHBondContact O-N 3.15Å
2584	V	25.3	Very low	25.9	Very low	135.667 Å²	135.667	148.1 Å²	148.1	82%	0.822	82%	0.824	S	S	*	*			trans	-107.8	96.4	157.8	179.4	0	0	0	0	106.6	K2586	V2584-K2586 PolarHBondContact O-N 3.26Å
2585	D	25.8	Very low	25.9	Very low	153 Å²	153	150.6 Å²	150.6	82%	0.818	83%	0.829	S	S	*	*			trans	-99.2	108.6	172.8	-91.2	-30.6	0	0	0	110.9	T2583 C2587	T2583-D2585 PolarHBondContact O-N 3.15Å; D2585-C2587 PolarHBondContact O-N 3.01Å; D2585-C2587 VanDerWaalsContact O-N 3.07Å
2586	K	25.2	Very low	26.1	Very low	192.333 Å²	192.333	148.8 Å²	148.8	84%	0.836	83%	0.825	S	S	*	*			trans	-90.5	95.3	168.9	-73.8	-179	176.8	175.1	0	109.3	V2584 N2588	V2584-K2586 PolarHBondContact O-N 3.26Å; K2586-N2588 PolarHBondContact O-N 3.31Å
2587	C	24.8	Very low	26.2	Very low	129 Å²	129	147.6 Å²	147.6	87%	0.872	82%	0.818	S	S	*	*			trans	-83.9	118.6	162	-80.7	0	0	0	0	109.3	D2585 N2589	D2585-C2587 PolarHBondContact O-N 3.01Å; D2585-C2587 VanDerWaalsContact O-N 3.07Å; C2587-N2589 PolarHBondContact O-N 2.75Å
2588	N	27.3	Very low	26.2	Very low	146 Å²	146	149.7 Å²	149.7	78%	0.781	83%	0.826	S	S	*	*			trans	-65	136.1	-172.9	-74.4	-38.1	0	0	0	112.9	K2586 V2590	K2586-N2588 PolarHBondContact O-N 3.31Å; N2588-V2590 PolarHBondContact O-N 2.78Å
2589	N	25.9	Very low	26.4	Very low	164 Å²	164	143.4 Å²	143.4	88%	0.877	81%	0.813	S	S	*	*			trans	-56	114.5	165.2	-71.2	-33.4	0	0	0	110.7	C2587 A2591	C2587-N2589 PolarHBondContact O-N 2.75Å; N2589-A2591 PolarHBondContact O-N 3.23Å
2590	V	27.9	Very low	26.5	Very low	126.667 Å²	126.667	145 Å²	145	77%	0.768	82%	0.82	S	S	*	*			trans	-90.1	112.9	164.2	179.1	0	0	0	0	107.7	N2588 F2592	N2588-V2590 PolarHBondContact O-N 2.78Å; V2590-F2592 HydrophobicContact CG1-CD2 4.19Å; V2590-F2592 HydrophobicContact CG1-CE2 4.27Å; V2590-F2592 PolarHBondContact O-N 2.85Å
2591	A	26.6	Very low	26.5	Very low	89 Å²	89	146.5 Å²	146.5	74%	0.736	82%	0.823	S	S	*	*			trans	-70.7	118.7	-178.7	0	0	0	0	0	111.1	N2589 N2593	N2589-A2591 PolarHBondContact O-N 3.23Å; A2591-N2593 PolarHBondContact O-N 2.93Å
2592	F	25	Very low	26.5	Very low	198.667 Å²	198.667	146.7 Å²	146.7	87%	0.871	82%	0.821	S	S	*	*			trans	-77.1	108	167.7	-94.1	-94.7	0	0	0	109.8	V2590	V2590-F2592 HydrophobicContact CG1-CD2 4.19Å; V2590-F2592 HydrophobicContact CG1-CE2 4.27Å; V2590-F2592 PolarHBondContact O-N 2.85Å
2593	N	26	Very low	26.7	Very low	163.667 Å²	163.667	147.4 Å²	147.4	88%	0.875	82%	0.82	S	S	*	*			trans	-111.7	120.4	160.4	-86.7	-16.9	0	0	0	108.6	A2591	A2591-N2593 PolarHBondContact O-N 2.93Å
2594	G	28.5	Very low	26.8	Very low	68.3333 Å²	68.3333	148.4 Å²	148.4	70%	0.704	82%	0.82	S	S	*	*			trans	155.2	90.5	165.4	0	0	0	0	0	113.4	L2596	G2594-L2596 PolarHBondContact O-N 3.48Å; G2594-L2596 VanDerWaalsContact O-N 3.08Å
2595	D	27.2	Very low	26.8	Very low	163 Å²	163	151.3 Å²	151.3	87%	0.872	82%	0.822	S	S	*	*			trans	-30.1	110.1	157.3	-71.5	-33.7	0	0	0	114.2
2596	L	28.4	Very low	26.7	Very low	157.667 Å²	157.667	154.5 Å²	154.5	83%	0.825	82%	0.824	S	S	*	*			trans	-167.2	113	155.5	-100.4	129.8	0	0	0	113.9	G2594	G2594-L2596 PolarHBondContact O-N 3.48Å; G2594-L2596 VanDerWaalsContact O-N 3.08Å
2597	S	28.2	Very low	26.7	Very low	101.667 Å²	101.667	151 Å²	151	71%	0.711	81%	0.814	S	S	*	*			trans	26.4	104.5	156.2	55.5	0	0	0	0	118.1	G2599	S2597-G2599 PolarHBondContact O-N 2.75Å
2598	T	28.1	Very low	26.7	Very low	154 Å²	154	152.3 Å²	152.3	95%	0.945	81%	0.811	S	S	*	*			trans	-84.5	101.2	150	47.9	0	0	0	0	110.4
2599	G	27.4	Very low	26.7	Very low	60.3333 Å²	60.3333	155.3 Å²	155.3	62%	0.622	81%	0.812	S	S	*	*	S	Bend	trans	-167.6	39.2	174.7	0	0	0	0	0	114.1	S2597 Q2601	S2597-G2599 PolarHBondContact O-N 2.75Å; G2599-Q2601 PolarHBondContact O-N 2.95Å
2600	F	28	Very low	26.8	Very low	215 Å²	215	151.8 Å²	151.8	94%	0.943	80%	0.798	S	S	*	*	S	Bend	trans	-136.2	41.7	174.3	-77.2	-79.3	0	0	0	115.3
2601	Q	27.7	Very low	27.1	Very low	184 Å²	184	147.2 Å²	147.2	86%	0.86	78%	0.776	S	S	*	*			trans	-140.4	54.7	173.9	-73.9	-164.9	-11.6	0	0	112.4	G2599	G2599-Q2601 PolarHBondContact O-N 2.95Å
2602	M	25.8	Very low	27.4	Very low	176 Å²	176	145.6 Å²	145.6	87%	0.867	76%	0.76	S	S	*	*	S	Bend	trans	-143.2	35.7	164.2	-97.4	-98.5	-94.9	0	0	112.9
2603	F	26	Very low	27.8	Very low	196 Å²	196	140.7 Å²	140.7	86%	0.86	75%	0.75	S	S	*	*	S	Bend	trans	-133.5	9.5	171.2	-92.4	-71.5	0	0	0	116.2
2604	D	27.1	Very low	28.2	Very low	143 Å²	143	136 Å²	136	77%	0.765	73%	0.73	S	S	*	*			trans	-89.2	-0.6	-178.1	-99.7	-14.6	0	0	0	115.3	Y2606	D2604-Y2606 PolarHBondContact O-N 3.45Å
2605	K	26.1	Very low	28.6	Very low	196.5 Å²	196.5	138 Å²	138	85%	0.854	72%	0.721	S	S	*	*	S	Bend	trans	-94.3	-1	-175.5	-92.2	-173.4	176.7	179.6	0	116.8
2606	Y	24.1	Very low	29.1	Very low	219 Å²	219	134.8 Å²	134.8	86%	0.859	70%	0.703	S	S	*	*	G	3₁₀ helix	trans	-137.7	57.8	176.6	-71.4	-79.3	0	0	0	112.8	D2604 N2608	D2604-Y2606 PolarHBondContact O-N 3.45Å; Y2606-N2608 PolarHBondContact O-N 2.81Å
2607	I	25.4	Very low	29.5	Very low	120.5 Å²	120.5	132.6 Å²	132.6	62%	0.618	69%	0.692	S	S	*	*			trans	-103.9	93.5	164.1	-56.3	176.9	0	0	0	108.2	R2609	I2607-R2609 PolarHBondContact O-N 2.85Å
2608	N	24.4	Very low	30.1	Very low	154.5 Å²	154.5	133.2 Å²	133.2	83%	0.826	69%	0.687	S	S	*	*			trans	-78	72.6	165.8	-79.6	-42.7	0	0	0	109.4	Y2606 P2610	Y2606-N2608 PolarHBondContact O-N 2.81Å; N2608-P2610 WeakPolarHBondContact O-CD 3.1Å
2609	R	27	Very low	30.9	Very low	209.5 Å²	209.5	126.3 Å²	126.3	79%	0.791	65%	0.647	S	S	*	*			trans	-66.4	117.6	166.3	-75.9	-174	178.8	167.7	1.1	107.7	I2607 G2611	I2607-R2609 PolarHBondContact O-N 2.85Å; R2609-G2611 PolarHBondContact O-N 2.75Å
2610	P	28.7	Very low	32	Very low	90.5 Å²	90.5	126.4 Å²	126.4	59%	0.588	64%	0.636	S	S	*	*	S	Bend	trans	-70.3	112.9	167.3	27.8	-24.7	0	0	0	107.5	N2608	N2608-P2610 WeakPolarHBondContact O-CD 3.1Å
2611	G	34.2	Very low	33.6	Very low	30 Å²	30	119.2 Å²	119.2	31%	0.309	61%	0.607	S	S	.	*	S	Bend	trans	91.8	100.6	-179.2	0	0	0	0	0	112.2	R2609	R2609-G2611 PolarHBondContact O-N 2.75Å
2612	S	32.4	Very low	35.6	Very low	55.5 Å²	55.5	110.5 Å²	110.5	39%	0.388	57%	0.567	S	S	.	*			trans	-61.9	146.9	162.4	57.4	0	0	0	0	108.4	S2614 E2615 L2616	S2612-S2614 PolarHBondContact O-N 3.14Å; S2612-S2614 PolarHBondContact OG-OG 2.97Å; S2612-E2615 PolarHBondContact O-N 2.94Å; S2612-E2615 PolarHBondContact OG-N 2.95Å; S2612-L2616 PolarHBondContact O-N 2.94Å
2613	S	33.9	Very low	38	Very low	95 Å²	95	103.2 Å²	103.2	66%	0.664	53%	0.53	S	S	*	.	H	α-helix	trans	-49.2	-30.9	174.7	47.6	0	0	0	0	112.8	L2616 L2617	S2613-L2616 WeakPolarHBondContact O-CB 3.21Å; S2613-L2616 PolarHBondContact O-N 2.9Å; S2613-L2617 WeakPolarHBondContact O-CG 3.5Å; S2613-L2617 PolarHBondContact O-N 2.92Å; S2613-L2617 VanDerWaalsContact O-N 3.16Å
2614	S	33.8	Very low	40.6	Very low	66 Å²	66	93.8 Å²	93.8	46%	0.462	49%	0.489	S	S	.	.	H	α-helix	trans	-65.4	-34.7	174.4	58.3	0	0	0	0	114.3	S2612 L2616 N2618	S2612-S2614 PolarHBondContact O-N 3.14Å; S2612-S2614 PolarHBondContact OG-OG 2.97Å; S2614-L2616 VanDerWaalsContact C-N 3.27Å; S2614-N2618 PolarHBondContact O-N 2.97Å
2615	E	37	Very low	43.2	Very low	110.5 Å²	110.5	87 Å²	87	52%	0.516	45%	0.452	S	S	.	.	H	α-helix	trans	-73	-27.1	174	-75.4	-176.2	166.9	0	0	111.8	S2612	S2612-E2615 PolarHBondContact O-N 2.94Å; S2612-E2615 PolarHBondContact OG-N 2.95Å
2616	L	36.8	Very low	45.8	Very low	95.5 Å²	95.5	77.7 Å²	77.7	50%	0.5	41%	0.412	S	S	.	.	H	α-helix	trans	-73.3	-45.6	177.1	-130.7	100.2	0	0	0	111.5	Y2067 S2612 S2613 S2614 N2618 G2619 T2620	Y2067-L2616 HydrophobicContact CE1-CD1 4.31Å; S2612-L2616 PolarHBondContact O-N 2.94Å; S2613-L2616 WeakPolarHBondContact O-CB 3.21Å; S2613-L2616 PolarHBondContact O-N 2.9Å; S2614-L2616 VanDerWaalsContact C-N 3.27Å; L2616-N2618 VanDerWaalsContact C-N 3.28Å; L2616-N2618 PolarHBondContact O-N 3.15Å; L2616-G2619 PolarHBondContact O-N 3.35Å; L2616-G2619 VanDerWaalsContact O-N 3.12Å; L2616-T2620 PolarHBondContact O-N 3.39Å
2617	L	37.2	Very low	48.4	Very low	112.5 Å²	112.5	67.3 Å²	67.3	59%	0.589	37%	0.371	S	S	*	.	H	α-helix	trans	-61.5	-33.9	179.3	-81.5	154.7	0	0	0	112.7	S2613 T2620	S2613-L2617 WeakPolarHBondContact O-CG 3.5Å; S2613-L2617 PolarHBondContact O-N 2.92Å; S2613-L2617 VanDerWaalsContact O-N 3.16Å; L2617-T2620 PolarHBondContact O-OG1 3.28Å
2618	N	40.2	Very low	50.8	Low	112.5 Å²	112.5	61.9 Å²	61.9	60%	0.602	34%	0.343	S	S	*	.	H	α-helix	trans	-77.2	-24.1	177.9	-69.7	-0.7	0	0	0	112.5	S2614 L2616	S2614-N2618 PolarHBondContact O-N 2.97Å; L2616-N2618 VanDerWaalsContact C-N 3.28Å; L2616-N2618 PolarHBondContact O-N 3.15Å
2619	G	46	Very low	53.1	Low	11 Å²	11	54.7 Å²	54.7	11%	0.113	31%	0.305	C	S	.	.	H	α-helix	trans	-75.6	-22.8	179.8	0	0	0	0	0	114.4	L2616 S2647	L2616-G2619 PolarHBondContact O-N 3.35Å; L2616-G2619 VanDerWaalsContact O-N 3.12Å; G2619-S2647 WeakPolarHBondContact O-CB 3.27Å; G2619-S2647 PolarHBondContact O-OG 3.36Å
2620	T	51.1	Low	54.8	Low	62 Å²	62	46.2 Å²	46.2	38%	0.38	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-9.6	-176.5	50.9	0	0	0	0	114.2	L2616 L2617	L2616-T2620 PolarHBondContact O-N 3.39Å; L2617-T2620 PolarHBondContact O-OG1 3.28Å
2621	N	60.8	Low	56.2	Low	63 Å²	63	43 Å²	43	34%	0.337	26%	0.255	S	S	.	.	S	Bend	trans	-101.2	-8.9	-172.2	-66.4	-4	0	0	0	114.1	Y2489 K2623	Y2489-N2621 PolarHBondContact N-O 2.96Å; N2621-K2623 PolarHBondContact O-N 2.98Å
2622	V	68.8	Low	57	Low	2 Å²	2	43 Å²	43	1%	0.012	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	112.3	-178.6	-177.1	0	0	0	0	109.2	N2430 Y2433 F2435 P2646	N2430-V2622 HydrophobicContact CB-CG1 4.29Å; Y2433-V2622 HydrophobicContact CD2-CG2 4.37Å; F2435-V2622 HydrophobicContact CE2-CG1 4.02Å; F2435-V2622 HydrophobicContact CZ-CG1 3.86Å; V2622-P2646 VanDerWaalsContact O-CD 3.29Å; V2622-P2646 WeakPolarHBondContact O-CD 3.3Å
2623	K	77.2	Confident	57.7	Low	21.5 Å²	21.5	45.9 Å²	45.9	9%	0.093	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	150	172.8	-65.5	-171.7	178.7	-169.8	0	110.6	E2133 S2486 F2487 Y2489 N2621 V2643	E2133-K2623 VanDerWaalsContact CD-CE 3.48Å; E2133-K2623 WeakPolarHBondContact OE1-CE 3.35Å; E2133-K2623 IonicContact OE1-NZ 3.01Å; E2133-K2623 PolarHBondContact OE1-NZ 2.8Å; E2133-K2623 WeakPolarHBondContact OE2-CD 3.46Å; E2133-K2623 VanDerWaalsContact OE2-CE 3.32Å; E2133-K2623 WeakPolarHBondContact OE2-CE 3.25Å; E2133-K2623 IonicContact OE2-NZ 2.98Å; E2133-K2623 PolarHBondContact OE2-NZ 2.9Å; S2486-K2623 CarbonylContact C-O 3.58Å; S2486-K2623 WeakPolarHBondContact CA-O 3.31Å; F2487-K2623 HydrophobicContact CD1-CB 4.17Å; F2487-K2623 HydrophobicContact CD2-CB 4.34Å; F2487-K2623 HydrophobicContact CE1-CB 3.63Å; F2487-K2623 HydrophobicContact CE2-CB 3.87Å; F2487-K2623 HydrophobicContact CE2-CD 3.98Å; F2487-K2623 HydrophobicContact CE2-CG 4.44Å; F2487-K2623 HydrophobicContact CG-CB 4.45Å; F2487-K2623 HydrophobicContact CZ-CB 3.48Å; F2487-K2623 VanDerWaalsContact CZ-CB 3.46Å; F2487-K2623 HydrophobicContact CZ-CD 3.98Å; F2487-K2623 HydrophobicContact CZ-CG 4.36Å; F2487-K2623 PolarHBondContact N-O 3.09Å; F2487-K2623 VanDerWaalsContact N-O 3.1Å; F2487-K2623 PolarHBondContact O-N 3Å; Y2489-K2623 HydrophobicContact CG-CD 4.4Å; N2621-K2623 PolarHBondContact O-N 2.98Å; K2623-V2643 HydrophobicContact CB-CG1 3.92Å; K2623-V2643 HydrophobicContact CD-CG1 3.97Å; K2623-V2643 HydrophobicContact CG-CG1 4.34Å
2624	L	79.5	Confident	58.5	Low	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	112.5	-177.2	-163.5	81.9	0	0	0	109.3	F2435 I2443 I2484 I2626 V2643 Y2644	F2435-L2624 HydrophobicContact CB-CD1 4.07Å; F2435-L2624 HydrophobicContact CD1-CD1 3.56Å; F2435-L2624 VanDerWaalsContact CD1-CD1 3.42Å; F2435-L2624 HydrophobicContact CD1-CD2 4.13Å; F2435-L2624 HydrophobicContact CD2-CD1 3.87Å; F2435-L2624 HydrophobicContact CE1-CD1 3.91Å; F2435-L2624 HydrophobicContact CE2-CD1 4.19Å; F2435-L2624 HydrophobicContact CG-CD1 3.55Å; F2435-L2624 VanDerWaalsContact CG-CD1 3.46Å; F2435-L2624 HydrophobicContact CZ-CD1 4.21Å; I2443-L2624 HydrophobicContact CD1-CD2 4.39Å; I2443-L2624 HydrophobicContact CG2-CD2 4.31Å; I2484-L2624 HydrophobicContact CG2-CD1 3.21Å; I2484-L2624 HydrophobicContact CG2-CD2 4.21Å; I2484-L2624 HydrophobicContact CG2-CG 3.76Å; L2624-I2626 HydrophobicContact CD2-CD1 3.64Å; L2624-I2626 HydrophobicContact CD2-CG1 4.18Å; L2624-I2626 HydrophobicContact CG-CD1 4.28Å; L2624-I2626 HydrophobicContact CG-CG1 4.47Å; L2624-V2643 CarbonylContact O-C 3.48Å; L2624-V2643 WeakPolarHBondContact O-CA 3.44Å; L2624-Y2644 WeakPolarHBondContact CB-O 3.29Å; L2624-Y2644 PolarHBondContact N-O 2.84Å; L2624-Y2644 PolarHBondContact O-N 2.76Å
2625	L	83	Confident	59.2	Low	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	125.7	173.4	-173	144.3	0	0	0	109.9	Y2155 I2157 I2164 I2178 Q2485 F2487 F2641 V2643	Y2155-L2625 HydrophobicContact CD2-CD2 4.29Å; Y2155-L2625 HydrophobicContact CE2-CD2 3.52Å; Y2155-L2625 VanDerWaalsContact CE2-CD2 3.44Å; I2157-L2625 HydrophobicContact CD1-CB 3.6Å; I2157-L2625 HydrophobicContact CD1-CD1 4.01Å; I2157-L2625 HydrophobicContact CD1-CD2 4.25Å; I2157-L2625 HydrophobicContact CD1-CG 4.16Å; I2157-L2625 HydrophobicContact CG1-CD1 4.41Å; I2157-L2625 HydrophobicContact CG1-CD2 4.49Å; I2164-L2625 HydrophobicContact CD1-CD1 4.32Å; I2164-L2625 HydrophobicContact CD1-CD2 3.8Å; I2178-L2625 HydrophobicContact CD1-CD1 3.94Å; I2178-L2625 HydrophobicContact CG1-CD1 4.08Å; I2178-L2625 HydrophobicContact CG2-CD1 4.13Å; Q2485-L2625 PolarHBondContact N-O 2.98Å; Q2485-L2625 PolarHBondContact O-N 2.87Å; F2487-L2625 HydrophobicContact CE1-CB 4.01Å; L2625-F2641 HydrophobicContact CD1-CD2 3.86Å; L2625-F2641 HydrophobicContact CD1-CE2 4.33Å; L2625-F2641 HydrophobicContact CD2-CB 4.29Å; L2625-F2641 HydrophobicContact CG-CD2 4.3Å; L2625-V2643 HydrophobicContact CD1-CG2 4.23Å
2626	I	80.4	Confident	59.9	Low	1 Å²	1	52.7 Å²	52.7	1%	0.005	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	120.9	175.4	-66.5	138.6	0	0	0	108.5	W2136 I2443 I2462 I2484 L2624 F2641 R2642 Y2644	W2136-I2626 HydrophobicContact CH2-CG2 4.13Å; I2443-I2626 HydrophobicContact CD1-CD1 3.42Å; I2443-I2626 VanDerWaalsContact CD1-CD1 3.47Å; I2443-I2626 HydrophobicContact CD1-CG1 3.61Å; I2462-I2626 HydrophobicContact CD1-CB 4.12Å; I2462-I2626 HydrophobicContact CD1-CD1 3.8Å; I2462-I2626 HydrophobicContact CD1-CG1 4.04Å; I2462-I2626 HydrophobicContact CD1-CG2 3.38Å; I2462-I2626 VanDerWaalsContact CD1-CG2 3.45Å; I2462-I2626 HydrophobicContact CG1-CD1 4.41Å; I2462-I2626 HydrophobicContact CG1-CG2 4.31Å; I2484-I2626 HydrophobicContact CG1-CG1 4.2Å; L2624-I2626 HydrophobicContact CD2-CD1 3.64Å; L2624-I2626 HydrophobicContact CD2-CG1 4.18Å; L2624-I2626 HydrophobicContact CG-CD1 4.28Å; L2624-I2626 HydrophobicContact CG-CG1 4.47Å; I2626-F2641 CarbonylContact O-C 3.51Å; I2626-F2641 VanDerWaalsContact O-CA 3.25Å; I2626-F2641 WeakPolarHBondContact O-CA 3.26Å; I2626-R2642 PolarHBondContact N-O 3.2Å; I2626-R2642 PolarHBondContact O-N 2.82Å; I2626-Y2644 HydrophobicContact CB-CD2 4.37Å; I2626-Y2644 HydrophobicContact CB-CE2 4.2Å; I2626-Y2644 HydrophobicContact CD1-CD2 3.29Å; I2626-Y2644 HydrophobicContact CD1-CE2 3.57Å; I2626-Y2644 HydrophobicContact CD1-CG 3.97Å; I2626-Y2644 HydrophobicContact CG1-CD2 4.32Å; I2626-Y2644 HydrophobicContact CG1-CE2 4.39Å
2627	G	78.9	Confident	60.8	Low	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	138.3	171.5	0	0	0	0	0	110.8	Y2155 L2481 Q2640	Y2155-G2627 PolarHBondContact OH-N 3.12Å; L2481-G2627 VanDerWaalsContact O-O 3.12Å; G2627-Q2640 WeakPolarHBondContact CA-O 3.33Å
2628	Q	76.3	Confident	62.3	Low	7 Å²	7	48.9 Å²	48.9	3%	0.033	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	150.2	174.3	72.1	-178.8	25.1	0	0	112.5	W2136 V2479 L2481 I2630 Q2640	W2136-Q2628 VanDerWaalsContact CH2-CD 3.47Å; W2136-Q2628 HydrophobicContact CH2-CG 3.78Å; W2136-Q2628 HydrophobicContact CZ3-CG 3.76Å; V2479-Q2628 HydrophobicContact CG1-CB 4.24Å; L2481-Q2628 VanDerWaalsContact O-CA 3.32Å; L2481-Q2628 WeakPolarHBondContact O-CA 3.34Å; Q2628-I2630 HydrophobicContact CG-CG1 4.36Å; Q2628-Q2640 HydrophobicContact CG-CG 3.71Å; Q2628-Q2640 PolarHBondContact N-O 2.95Å; Q2628-Q2640 PolarHBondContact O-N 3Å; Q2628-Q2640 VanDerWaalsContact O-O 3.12Å
2629	T	71.3	Confident	64.2	Low	4 Å²	4	43.8 Å²	43.8	3%	0.025	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	120.5	170.5	51.5	0	0	0	0	109.2	A2152 N2480 L2481 E2638 F2639	A2152-T2629 HydrophobicContact CB-CG2 4.02Å; N2480-T2629 WeakPolarHBondContact CB-OG1 3.45Å; N2480-T2629 PolarHBondContact N-OG1 3.43Å; L2481-T2629 HydrophobicContact CB-CG2 4.09Å; L2481-T2629 PolarHBondContact N-OG1 2.82Å; T2629-E2638 WeakPolarHBondContact CA-O 3.24Å; T2629-F2639 HydrophobicContact CG2-CB 4.45Å; T2629-F2639 HydrophobicContact CG2-CD2 3.88Å
2630	I	63.2	Low	65.9	Low	31 Å²	31	43.8 Å²	43.8	16%	0.159	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	126.4	176.9	-58.2	170.9	0	0	0	108.5	P2465 L2466 Q2628 Q2637 E2638 Q2640	P2465-I2630 HydrophobicContact CG-CD1 3.86Å; L2466-I2630 HydrophobicContact CD1-CG2 4.47Å; Q2628-I2630 HydrophobicContact CG-CG1 4.36Å; I2630-Q2637 WeakPolarHBondContact O-CA 3.48Å; I2630-Q2637 WeakPolarHBondContact O-CB 3.14Å; I2630-E2638 PolarHBondContact N-O 2.96Å; I2630-E2638 PolarHBondContact O-N 3.19Å; I2630-Q2640 VanDerWaalsContact CD1-CD 3.42Å; I2630-Q2640 HydrophobicContact CD1-CG 4.16Å
2631	S	57.5	Low	67.5	Low	23.5 Å²	23.5	40.9 Å²	40.9	16%	0.164	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	106.3	168.1	48.3	0	0	0	0	110.3	N2477 V2478	N2477-S2631 VanDerWaalsContact CG-O 3.24Å; N2477-S2631 PolarHBondContact OD1-O 2.98Å; V2478-S2631 PolarHBondContact O-OG 3.27Å
2632	G	51.8	Low	68.4	Low	28.5 Å²	28.5	40.4 Å²	40.4	29%	0.294	21%	0.207	S	C	.	.			trans	-85.6	154.9	172.7	0	0	0	0	0	112.6	R2634 N2635 I2636	G2632-R2634 PolarHBondContact O-N 3.05Å; G2632-N2635 PolarHBondContact O-N 3.11Å; G2632-N2635 VanDerWaalsContact O-N 3.16Å; G2632-I2636 PolarHBondContact N-O 3.4Å
2633	S	46.3	Very low	68.9	Low	117 Å²	117	41 Å²	41	82%	0.818	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-15.9	178.8	62.7	0	0	0	0	115.2
2634	R	50.4	Low	68.7	Low	213 Å²	213	40.8 Å²	40.8	80%	0.804	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.6	21.7	-179.8	-69.6	-172	175.8	-179.3	0.1	114.5	G2632 I2636	G2632-R2634 PolarHBondContact O-N 3.05Å; R2634-I2636 HydrophobicContact CB-CD1 4.39Å; R2634-I2636 HydrophobicContact CB-CG1 4.38Å; R2634-I2636 PolarHBondContact O-N 2.97Å
2635	N	49.5	Very low	68.2	Low	128 Å²	128	42.3 Å²	42.3	68%	0.684	22%	0.216	S	C	*	.	S	Bend	trans	57.1	11.6	-175	-72.1	-22.7	0	0	0	114.4	T2149 G2632 Q2637	T2149-N2635 HydrophobicContact CG2-CB 4.23Å; T2149-N2635 VanDerWaalsContact CG2-O 3.25Å; T2149-N2635 WeakPolarHBondContact CG2-O 3.38Å; G2632-N2635 PolarHBondContact O-N 3.11Å; G2632-N2635 VanDerWaalsContact O-N 3.16Å; N2635-Q2637 PolarHBondContact O-N 3.39Å
2636	I	50.7	Low	67.3	Low	73.5 Å²	73.5	42.8 Å²	42.8	38%	0.377	22%	0.219	S	C	.	.			trans	-93.7	104.2	172.5	-55.4	173	0	0	0	105	G2632 R2634 E2638	G2632-I2636 PolarHBondContact N-O 3.4Å; R2634-I2636 HydrophobicContact CB-CD1 4.39Å; R2634-I2636 HydrophobicContact CB-CG1 4.38Å; R2634-I2636 PolarHBondContact O-N 2.97Å; I2636-E2638 HydrophobicContact CG2-CG 3.93Å
2637	Q	57.1	Low	66.4	Low	54.5 Å²	54.5	44 Å²	44	26%	0.255	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	124.1	166.9	-53.3	-158.5	-2.5	0	0	108	L2151 N2480 I2630 N2635	L2151-Q2637 HydrophobicContact CD2-CB 3.44Å; L2151-Q2637 VanDerWaalsContact CD2-CB 3.44Å; L2151-Q2637 HydrophobicContact CD2-CG 3.48Å; L2151-Q2637 VanDerWaalsContact CD2-CG 3.44Å; N2480-Q2637 PolarHBondContact ND2-OE1 2.93Å; I2630-Q2637 WeakPolarHBondContact O-CA 3.48Å; I2630-Q2637 WeakPolarHBondContact O-CB 3.14Å; N2635-Q2637 PolarHBondContact O-N 3.39Å
2638	E	68	Low	65.5	Low	74.5 Å²	74.5	47.2 Å²	47.2	35%	0.348	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	131.2	177.6	-65.7	-173.6	-179.6	0	0	108.9	N2138 T2629 I2630 I2636	N2138-E2638 PolarHBondContact ND2-OE2 3.07Å; T2629-E2638 WeakPolarHBondContact CA-O 3.24Å; I2630-E2638 PolarHBondContact N-O 2.96Å; I2630-E2638 PolarHBondContact O-N 3.19Å; I2636-E2638 HydrophobicContact CG2-CG 3.93Å
2639	F	80.6	Confident	64.7	Low	4.5 Å²	4.5	47.3 Å²	47.3	2%	0.02	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	128.2	167.7	178	-101.7	0	0	0	108.6	V2139 A2152 Y2155 I2164 I2166 W2168 L2481 T2629 F2641	V2139-F2639 HydrophobicContact CB-CD1 4.33Å; V2139-F2639 HydrophobicContact CG2-CD1 4.31Å; V2139-F2639 PolarHBondContact N-O 3.21Å; A2152-F2639 HydrophobicContact CB-CB 3.74Å; A2152-F2639 HydrophobicContact CB-CD2 3.61Å; A2152-F2639 HydrophobicContact CB-CE2 4.38Å; A2152-F2639 HydrophobicContact CB-CG 3.72Å; Y2155-F2639 AromaticContact CD1-CE2 3.87Å; Y2155-F2639 HydrophobicContact CD1-CE2 3.87Å; Y2155-F2639 AromaticContact CD1-CZ 3.7Å; Y2155-F2639 HydrophobicContact CD1-CZ 3.7Å; Y2155-F2639 HydrophobicContact CE1-CE2 4.13Å; Y2155-F2639 HydrophobicContact CE1-CZ 4.06Å; Y2155-F2639 HydrophobicContact CG-CZ 4.29Å; I2164-F2639 HydrophobicContact CD1-CE1 4.42Å; I2164-F2639 HydrophobicContact CD1-CZ 4.41Å; I2166-F2639 HydrophobicContact CD1-CD1 3.77Å; I2166-F2639 HydrophobicContact CD1-CE1 3.54Å; I2166-F2639 HydrophobicContact CG1-CD1 4.49Å; I2166-F2639 HydrophobicContact CG1-CE1 4Å; W2168-F2639 HydrophobicContact CH2-CB 4.27Å; W2168-F2639 HydrophobicContact CZ3-CB 4.39Å; L2481-F2639 HydrophobicContact CD2-CD2 4.46Å; L2481-F2639 HydrophobicContact CD2-CE2 3.86Å; T2629-F2639 HydrophobicContact CG2-CB 4.45Å; T2629-F2639 HydrophobicContact CG2-CD2 3.88Å; F2639-F2641 HydrophobicContact CE1-CB 4.24Å; F2639-F2641 AromaticContact CE1-CD1 3.91Å; F2639-F2641 HydrophobicContact CE1-CD1 3.91Å; F2639-F2641 HydrophobicContact CZ-CB 4.29Å
2640	Q	82.1	Confident	64.1	Low	11.5 Å²	11.5	47.6 Å²	47.6	5%	0.054	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	145.4	175.2	62.5	173.8	42	0	0	110.3	W2136 I2137 N2138 G2627 Q2628 I2630	W2136-Q2640 HydrophobicContact CB-CB 4.48Å; W2136-Q2640 HydrophobicContact CD2-CG 4.2Å; W2136-Q2640 HydrophobicContact CE3-CB 3.97Å; W2136-Q2640 HydrophobicContact CE3-CG 3.55Å; W2136-Q2640 VanDerWaalsContact CE3-NE2 3.26Å; W2136-Q2640 HydrophobicContact CZ3-CG 3.95Å; I2137-Q2640 CarbonylContact O-C 3.52Å; I2137-Q2640 WeakPolarHBondContact O-CA 3.33Å; N2138-Q2640 WeakPolarHBondContact OD1-CB 3.48Å; N2138-Q2640 PolarHBondContact OD1-OE1 3.13Å; G2627-Q2640 WeakPolarHBondContact CA-O 3.33Å; Q2628-Q2640 HydrophobicContact CG-CG 3.71Å; Q2628-Q2640 PolarHBondContact N-O 2.95Å; Q2628-Q2640 PolarHBondContact O-N 3Å; Q2628-Q2640 VanDerWaalsContact O-O 3.12Å; I2630-Q2640 VanDerWaalsContact CD1-CD 3.42Å; I2630-Q2640 HydrophobicContact CD1-CG 4.16Å
2641	F	84.3	Confident	64.1	Low	0 Å²	0	51 Å²	51	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	159.6	174.2	69.2	-90	0	0	0	111.3	I2137 V2139 I2164 V2176 I2178 L2625 I2626 F2639	I2137-F2641 HydrophobicContact CB-CD1 4.41Å; I2137-F2641 HydrophobicContact CB-CE1 4.05Å; I2137-F2641 HydrophobicContact CB-CE2 4.15Å; I2137-F2641 HydrophobicContact CB-CZ 3.92Å; I2137-F2641 HydrophobicContact CD1-CE2 3.78Å; I2137-F2641 HydrophobicContact CD1-CZ 3.96Å; I2137-F2641 HydrophobicContact CG1-CE2 4.49Å; I2137-F2641 HydrophobicContact CG2-CD1 4.44Å; I2137-F2641 HydrophobicContact CG2-CE1 3.7Å; I2137-F2641 HydrophobicContact CG2-CE2 4.39Å; I2137-F2641 HydrophobicContact CG2-CZ 3.67Å; I2137-F2641 PolarHBondContact N-O 3.07Å; I2137-F2641 PolarHBondContact O-N 3.34Å; V2139-F2641 HydrophobicContact CG2-CD1 3.92Å; V2139-F2641 HydrophobicContact CG2-CE1 3.53Å; I2164-F2641 HydrophobicContact CD1-CD1 4.42Å; I2164-F2641 HydrophobicContact CD1-CG 4.38Å; I2164-F2641 HydrophobicContact CG2-CE1 4.18Å; I2164-F2641 HydrophobicContact CG2-CZ 4.26Å; V2176-F2641 HydrophobicContact CG1-CE1 4.27Å; V2176-F2641 HydrophobicContact CG1-CZ 4.39Å; I2178-F2641 HydrophobicContact CG2-CE2 4.3Å; L2625-F2641 HydrophobicContact CD1-CD2 3.86Å; L2625-F2641 HydrophobicContact CD1-CE2 4.33Å; L2625-F2641 HydrophobicContact CD2-CB 4.29Å; L2625-F2641 HydrophobicContact CG-CD2 4.3Å; I2626-F2641 CarbonylContact O-C 3.51Å; I2626-F2641 VanDerWaalsContact O-CA 3.25Å; I2626-F2641 WeakPolarHBondContact O-CA 3.26Å; F2639-F2641 HydrophobicContact CE1-CB 4.24Å; F2639-F2641 AromaticContact CE1-CD1 3.91Å; F2639-F2641 HydrophobicContact CE1-CD1 3.91Å; F2639-F2641 HydrophobicContact CZ-CB 4.29Å
2642	R	78.5	Confident	64.5	Low	53.5 Å²	53.5	52.9 Å²	52.9	20%	0.202	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	144.1	178.8	-170.2	174.8	-156.2	-175.8	1.5	110	P2132 G2134 W2136 I2626 Y2644	P2132-R2642 HydrophobicContact CB-CG 4.38Å; G2134-R2642 PolarHBondContact O-NE 2.84Å; G2134-R2642 PolarHBondContact O-NH2 3.09Å; W2136-R2642 HydrophobicContact CD2-CB 3.86Å; W2136-R2642 HydrophobicContact CE3-CB 3.64Å; W2136-R2642 HydrophobicContact CG-CB 4.47Å; W2136-R2642 HydrophobicContact CH2-CB 4.42Å; W2136-R2642 HydrophobicContact CZ3-CB 3.94Å; I2626-R2642 PolarHBondContact N-O 3.2Å; I2626-R2642 PolarHBondContact O-N 2.82Å; R2642-Y2644 HydrophobicContact CB-CD2 4.4Å; R2642-Y2644 HydrophobicContact CB-CE2 3.75Å; R2642-Y2644 HydrophobicContact CG-CD2 4.34Å; R2642-Y2644 HydrophobicContact CG-CE2 3.83Å
2643	V	79.4	Confident	65.2	Low	14 Å²	14	52.2 Å²	52.2	9%	0.085	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	134.5	176.4	-176.9	0	0	0	0	109.3	P2132 E2133 I2178 F2487 K2623 L2624 L2625	P2132-V2643 WeakPolarHBondContact CA-O 3.48Å; E2133-V2643 HydrophobicContact CB-CB 4.48Å; E2133-V2643 PolarHBondContact N-O 3.11Å; I2178-V2643 HydrophobicContact CG2-CG2 3.66Å; F2487-V2643 HydrophobicContact CE1-CG1 4.32Å; F2487-V2643 HydrophobicContact CZ-CG1 3.95Å; F2487-V2643 HydrophobicContact CZ-CG2 4.37Å; K2623-V2643 HydrophobicContact CB-CG1 3.92Å; K2623-V2643 HydrophobicContact CD-CG1 3.97Å; K2623-V2643 HydrophobicContact CG-CG1 4.34Å; L2624-V2643 CarbonylContact O-C 3.48Å; L2624-V2643 WeakPolarHBondContact O-CA 3.44Å; L2625-V2643 HydrophobicContact CD1-CG2 4.23Å
2644	Y	73.1	Confident	66.3	Low	18.5 Å²	18.5	48.1 Å²	48.1	7%	0.073	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	144.9	180	-68.5	-98.4	0	0	0	110.5	A2131 P2132 M2460 L2624 I2626 R2642 P2646	A2131-Y2644 CarbonylContact O-C 3.57Å; A2131-Y2644 WeakPolarHBondContact O-CA 3.13Å; P2132-Y2644 HydrophobicContact CB-CD1 4.05Å; P2132-Y2644 HydrophobicContact CB-CE1 3.95Å; M2460-Y2644 HydrophobicContact CE-CD1 3.43Å; M2460-Y2644 VanDerWaalsContact CE-CD1 3.46Å; M2460-Y2644 HydrophobicContact CE-CE1 3.94Å; M2460-Y2644 HydrophobicContact CE-CG 3.94Å; L2624-Y2644 WeakPolarHBondContact CB-O 3.29Å; L2624-Y2644 PolarHBondContact N-O 2.84Å; L2624-Y2644 PolarHBondContact O-N 2.76Å; I2626-Y2644 HydrophobicContact CB-CD2 4.37Å; I2626-Y2644 HydrophobicContact CB-CE2 4.2Å; I2626-Y2644 HydrophobicContact CD1-CD2 3.29Å; I2626-Y2644 HydrophobicContact CD1-CE2 3.57Å; I2626-Y2644 HydrophobicContact CD1-CG 3.97Å; I2626-Y2644 HydrophobicContact CG1-CD2 4.32Å; I2626-Y2644 HydrophobicContact CG1-CE2 4.39Å; R2642-Y2644 HydrophobicContact CB-CD2 4.4Å; R2642-Y2644 HydrophobicContact CB-CE2 3.75Å; R2642-Y2644 HydrophobicContact CG-CD2 4.34Å; R2642-Y2644 HydrophobicContact CG-CE2 3.83Å; Y2644-P2646 WeakPolarHBondContact O-CD 3.35Å
2645	E	70.5	Confident	67.2	Low	30 Å²	30	38.7 Å²	38.7	14%	0.14	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	103.1	171.7	-166.6	174.1	179.8	0	0	108.9	G2130 A2131 S2647 L2648	G2130-E2645 CarbonylContact C-O 3.48Å; G2130-E2645 VanDerWaalsContact CA-O 3.25Å; G2130-E2645 WeakPolarHBondContact CA-O 3.44Å; A2131-E2645 PolarHBondContact N-O 2.95Å; A2131-E2645 VanDerWaalsContact N-O 3.11Å; A2131-E2645 PolarHBondContact O-N 2.9Å; E2645-S2647 PolarHBondContact O-N 2.84Å; E2645-L2648 HydrophobicContact CB-CB 4.17Å; E2645-L2648 HydrophobicContact CG-CB 3.97Å; E2645-L2648 HydrophobicContact CG-CD1 4.03Å; E2645-L2648 PolarHBondContact O-N 3.08Å; E2645-L2648 WeakPolarHBondContact OE1-CD1 3.38Å; E2645-L2648 VanDerWaalsContact OE2-CD1 3.31Å; E2645-L2648 WeakPolarHBondContact OE2-CD1 3.37Å
2646	P	63.9	Low	67.9	Low	10.5 Å²	10.5	35.4 Å²	35.4	7%	0.068	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	-20.8	-172.7	25.4	-32.4	0	0	0	113.6	L2129 F2435 V2445 V2622 Y2644	L2129-P2646 WeakPolarHBondContact CB-O 3.39Å; F2435-P2646 HydrophobicContact CE1-CB 3.98Å; F2435-P2646 HydrophobicContact CE1-CG 3.82Å; F2435-P2646 HydrophobicContact CZ-CG 3.97Å; V2445-P2646 HydrophobicContact CG2-CB 4.39Å; V2622-P2646 VanDerWaalsContact O-CD 3.29Å; V2622-P2646 WeakPolarHBondContact O-CD 3.3Å; Y2644-P2646 WeakPolarHBondContact O-CD 3.35Å
2647	S	60.2	Low	68.3	Low	28 Å²	28	32.5 Å²	32.5	20%	0.196	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	-18.4	-179.9	51.3	0	0	0	0	113.6	G2619 E2645	G2619-S2647 WeakPolarHBondContact O-CB 3.27Å; G2619-S2647 PolarHBondContact O-OG 3.36Å; E2645-S2647 PolarHBondContact O-N 2.84Å
2648	L	60.2	Low	68.6	Low	65.5 Å²	65.5	30 Å²	30	34%	0.343	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	142.3	177.2	-117.9	100.7	0	0	0	111.1	G2130 A2131 E2645	G2130-L2648 PolarHBondContact N-O 3.12Å; A2131-L2648 HydrophobicContact CB-CB 4.07Å; A2131-L2648 HydrophobicContact CB-CD2 4.2Å; A2131-L2648 PolarHBondContact N-O 3.08Å; E2645-L2648 HydrophobicContact CB-CB 4.17Å; E2645-L2648 HydrophobicContact CG-CB 3.97Å; E2645-L2648 HydrophobicContact CG-CD1 4.03Å; E2645-L2648 PolarHBondContact O-N 3.08Å; E2645-L2648 WeakPolarHBondContact OE1-CD1 3.38Å; E2645-L2648 VanDerWaalsContact OE2-CD1 3.31Å; E2645-L2648 WeakPolarHBondContact OE2-CD1 3.37Å
2649	T	60	Low	68.1	Low	10 Å²	10	31.1 Å²	31.1	6%	0.061	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	136.2	167.6	50.4	0	0	0	0	109.7	I2059 L2071 N2126 L2129 Y2651	I2059-T2649 HydrophobicContact CD1-CG2 3.83Å; L2071-T2649 HydrophobicContact CD2-CG2 3.46Å; L2071-T2649 WeakPolarHBondContact CD2-OG1 3.41Å; N2126-T2649 WeakPolarHBondContact O-CB 2.96Å; L2129-T2649 HydrophobicContact CD2-CG2 3.75Å; L2129-T2649 HydrophobicContact CG-CG2 4.49Å; T2649-Y2651 PolarHBondContact O-N 3.12Å
2650	G	59.7	Low	67	Low	10 Å²	10	33.5 Å²	33.5	10%	0.103	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	118.7	177.6	0	0	0	0	0	110.5	N2126 H2652	N2126-G2650 WeakPolarHBondContact CB-O 3.45Å; N2126-G2650 PolarHBondContact N-O 3.35Å; G2650-H2652 PolarHBondContact O-N 3.03Å
2651	Y	63.3	Low	66.2	Low	101.5 Å²	101.5	34.2 Å²	34.2	40%	0.398	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	127	164.2	178.7	-94.5	0	0	0	109	N2123 W2125 T2649 A2653 T2654	N2123-Y2651 HydrophobicContact CB-CE2 4.04Å; N2123-Y2651 PolarHBondContact OD1-OH 2.75Å; N2123-Y2651 VanDerWaalsContact OD1-OH 3.12Å; W2125-Y2651 HydrophobicContact CD2-CD2 4.18Å; W2125-Y2651 AromaticContact CE3-CD2 3.85Å; W2125-Y2651 HydrophobicContact CE3-CD2 4.02Å; W2125-Y2651 AromaticContact CH2-CD2 3.69Å; W2125-Y2651 HydrophobicContact CH2-CD2 3.89Å; W2125-Y2651 HydrophobicContact CH2-CE2 4.32Å; W2125-Y2651 HydrophobicContact CZ2-CD2 4.01Å; W2125-Y2651 HydrophobicContact CZ2-CE2 4.27Å; W2125-Y2651 AromaticContact CZ3-CD2 3.77Å; W2125-Y2651 HydrophobicContact CZ3-CD2 3.77Å; W2125-Y2651 HydrophobicContact CZ3-CG 4.35Å; T2649-Y2651 PolarHBondContact O-N 3.12Å; Y2651-A2653 VanDerWaalsContact OH-C 3.28Å; Y2651-A2653 PolarHBondContact OH-O 2.81Å; Y2651-T2654 WeakPolarHBondContact CE2-OG1 3.32Å; Y2651-T2654 VanDerWaalsContact OH-CA 3.22Å; Y2651-T2654 WeakPolarHBondContact OH-CA 3.02Å; Y2651-T2654 VanDerWaalsContact OH-CB 3.26Å; Y2651-T2654 WeakPolarHBondContact OH-CB 3.43Å; Y2651-T2654 PolarHBondContact OH-N 2.85Å; Y2651-T2654 VanDerWaalsContact OH-N 3.11Å; Y2651-T2654 PolarHBondContact OH-OG1 3.14Å
2652	H	64.9	Low	65.3	Low	64 Å²	64	35.8 Å²	35.8	30%	0.296	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	-52.6	-174.3	-173.1	60.4	0	0	0	112.1	Y2109 V2124 G2650	Y2109-H2652 HydrophobicContact CE1-CB 4.4Å; Y2109-H2652 AromaticContact CE1-CD2 3.77Å; Y2109-H2652 AromaticContact CE1-CG 3.87Å; Y2109-H2652 AromaticContact CE1-NE2 3.74Å; Y2109-H2652 AromaticContact CZ-CD2 3.99Å; Y2109-H2652 AromaticContact CZ-CE1 3.95Å; Y2109-H2652 AromaticContact CZ-NE2 3.85Å; V2124-H2652 HydrophobicContact CB-CB 4.43Å; V2124-H2652 HydrophobicContact CG1-CB 4.24Å; V2124-H2652 WeakPolarHBondContact O-CA 3.35Å; V2124-H2652 VanDerWaalsContact O-CB 3.25Å; V2124-H2652 WeakPolarHBondContact O-CB 3.3Å; V2124-H2652 PolarHBondContact O-N 2.72Å; G2650-H2652 PolarHBondContact O-N 3.03Å
2653	A	65.8	Low	64.5	Low	15 Å²	15	33.3 Å²	33.3	12%	0.124	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	155.2	-178.4	0	0	0	0	0	112.1	V2124 Y2651 L2705	V2124-A2653 HydrophobicContact CB-CB 4.47Å; V2124-A2653 PolarHBondContact N-O 3.23Å; V2124-A2653 PolarHBondContact O-N 3.06Å; Y2651-A2653 VanDerWaalsContact OH-C 3.28Å; Y2651-A2653 PolarHBondContact OH-O 2.81Å; A2653-L2705 HydrophobicContact CB-CD1 4.08Å
2654	T	69.5	Low	64.1	Low	29.5 Å²	29.5	33.3 Å²	33.3	18%	0.181	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	123.9	160.5	-55.7	0	0	0	0	108	R2121 I2122 N2123 Y2651 S2656	R2121-T2654 HydrophobicContact CB-CG2 3.92Å; R2121-T2654 HydrophobicContact CG-CG2 3.93Å; I2122-T2654 CarbonylContact O-C 3.58Å; I2122-T2654 WeakPolarHBondContact O-CA 3.36Å; N2123-T2654 PolarHBondContact OD1-OG1 3.05Å; Y2651-T2654 WeakPolarHBondContact CE2-OG1 3.32Å; Y2651-T2654 VanDerWaalsContact OH-CA 3.22Å; Y2651-T2654 WeakPolarHBondContact OH-CA 3.02Å; Y2651-T2654 VanDerWaalsContact OH-CB 3.26Å; Y2651-T2654 WeakPolarHBondContact OH-CB 3.43Å; Y2651-T2654 PolarHBondContact OH-N 2.85Å; Y2651-T2654 VanDerWaalsContact OH-N 3.11Å; Y2651-T2654 PolarHBondContact OH-OG1 3.14Å; T2654-S2656 PolarHBondContact O-N 3.38Å
2655	L	69	Low	64.4	Low	16.5 Å²	16.5	32.7 Å²	32.7	9%	0.086	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	110.5	166.9	-45.9	170	0	0	0	107	I2122 V2124 G2657 L2681 W2701 L2703	I2122-L2655 HydrophobicContact CB-CB 4.12Å; I2122-L2655 HydrophobicContact CB-CD1 4.43Å; I2122-L2655 HydrophobicContact CG2-CD1 4.29Å; I2122-L2655 PolarHBondContact N-O 2.8Å; I2122-L2655 VanDerWaalsContact N-O 3.15Å; I2122-L2655 PolarHBondContact O-N 3.08Å; V2124-L2655 HydrophobicContact CG2-CD1 4.17Å; V2124-L2655 HydrophobicContact CG2-CG 4.02Å; L2655-G2657 PolarHBondContact O-N 2.74Å; L2655-L2681 HydrophobicContact CD1-CD2 3.6Å; L2655-L2681 VanDerWaalsContact CD1-CD2 3.41Å; L2655-W2701 HydrophobicContact CB-CD2 4.36Å; L2655-W2701 HydrophobicContact CB-CE3 4.1Å; L2655-W2701 HydrophobicContact CB-CH2 3.92Å; L2655-W2701 HydrophobicContact CB-CZ2 4.18Å; L2655-W2701 HydrophobicContact CB-CZ3 3.88Å; L2655-W2701 HydrophobicContact CD1-CB 4.35Å; L2655-W2701 HydrophobicContact CD1-CD2 3.87Å; L2655-W2701 HydrophobicContact CD1-CE3 4.09Å; L2655-W2701 HydrophobicContact CD1-CG 4Å; L2655-W2701 HydrophobicContact CD2-CE3 4.05Å; L2655-W2701 HydrophobicContact CD2-CZ3 4.31Å; L2655-W2701 HydrophobicContact CG-CE3 4.31Å; L2655-W2701 HydrophobicContact CG-CZ3 4.41Å; L2655-L2703 HydrophobicContact CD1-CD1 4.29Å
2656	S	64.1	Low	65.1	Low	58.5 Å²	58.5	31.7 Å²	31.7	41%	0.409	21%	0.205	S	C	.	.			trans	-104.9	106	174.9	61.9	0	0	0	0	109	T2654	T2654-S2656 PolarHBondContact O-N 3.38Å
2657	G	59.1	Low	66.1	Low	13.5 Å²	13.5	31.4 Å²	31.4	14%	0.139	20%	0.203	C	C	.	.			trans	-138.4	-42.1	-178.1	0	0	0	0	0	113.4	L2655 A2659 R2699	L2655-G2657 PolarHBondContact O-N 2.74Å; G2657-A2659 PolarHBondContact O-N 3.11Å; G2657-R2699 PolarHBondContact O-NH1 2.82Å; G2657-R2699 VanDerWaalsContact O-NH1 3.11Å; G2657-R2699 PolarHBondContact O-NH2 3.22Å
2658	H	63.9	Low	67.3	Low	2 Å²	2	30.2 Å²	30.2	1%	0.009	20%	0.195	C	C	.	.			trans	-86.4	45	-174.9	-64.1	-65.7	0	0	0	112.1	G2660 L2661 S2683 A2685 D2697 R2699	H2658-G2660 PolarHBondContact O-N 3.2Å; H2658-G2660 VanDerWaalsContact O-N 3.14Å; H2658-L2661 HydrophobicContact CB-CB 4.32Å; H2658-L2661 PolarHBondContact O-N 3.32Å; H2658-S2683 PolarHBondContact NE2-OG 3.39Å; H2658-A2685 HydrophobicContact CB-CB 3.69Å; H2658-A2685 VanDerWaalsContact CG-CB 3.44Å; H2658-A2685 VanDerWaalsContact ND1-CB 3.27Å; H2658-A2685 WeakPolarHBondContact ND1-CB 3.36Å; H2658-D2697 IonicContact CE1-OD1 3.86Å; H2658-D2697 PolarHBondContact CE1-OD1 2.61Å; H2658-D2697 VanDerWaalsContact CE1-OD1 3.26Å; H2658-D2697 IonicContact CE1-OD2 3.08Å; H2658-D2697 IonicContact CG-OD1 2.72Å; H2658-D2697 VanDerWaalsContact ND1-CG 3.26Å; H2658-D2697 IonicContact ND1-OD1 3.3Å; H2658-D2697 PolarHBondContact ND1-OD1 3.16Å; H2658-D2697 IonicContact ND1-OD2 3.14Å; H2658-D2697 PolarHBondContact ND1-OD2 3.08Å; H2658-R2699 VanDerWaalsContact CE1-CD 3.49Å; H2658-R2699 WeakPolarHBondContact CE1-CD 3.41Å; H2658-R2699 VanDerWaalsContact CE1-CG 3.47Å; H2658-R2699 WeakPolarHBondContact CE1-CG 3.22Å
2659	A	58.3	Low	68.2	Low	96 Å²	96	27.4 Å²	27.4	79%	0.793	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.6	120.2	-176.6	0	0	0	0	0	110.4	G2657 L2661	G2657-A2659 PolarHBondContact O-N 3.11Å; A2659-L2661 VanDerWaalsContact C-N 3.34Å
2660	G	57.6	Low	68.9	Low	56.5 Å²	56.5	29.3 Å²	29.3	58%	0.582	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.8	8.1	-177.1	0	0	0	0	0	115.5	H2658 Q2687	H2658-G2660 PolarHBondContact O-N 3.2Å; H2658-G2660 VanDerWaalsContact O-N 3.14Å; G2660-Q2687 PolarHBondContact O-OE1 3.19Å
2661	L	64.3	Low	69.2	Low	25.5 Å²	25.5	30.2 Å²	30.2	13%	0.134	19%	0.192	C	C	.	.	S	Bend	trans	-123.2	151.2	174	-61	176.4	0	0	0	110.6	G2120 H2658 A2659 P2663 A2685 Q2687 G2695 D2697	G2120-L2661 VanDerWaalsContact CA-O 3.31Å; G2120-L2661 WeakPolarHBondContact CA-O 3.2Å; H2658-L2661 HydrophobicContact CB-CB 4.32Å; H2658-L2661 PolarHBondContact O-N 3.32Å; A2659-L2661 VanDerWaalsContact C-N 3.34Å; L2661-P2663 WeakPolarHBondContact O-CD 3.45Å; L2661-A2685 HydrophobicContact CB-CB 3.65Å; L2661-A2685 HydrophobicContact CD1-CB 4.45Å; L2661-Q2687 HydrophobicContact CD2-CB 4.03Å; L2661-G2695 VanDerWaalsContact CD2-O 3.27Å; L2661-G2695 WeakPolarHBondContact CD2-O 3.36Å; L2661-D2697 HydrophobicContact CD1-CB 3.73Å; L2661-D2697 WeakPolarHBondContact CD1-OD1 3.22Å
2662	I	66	Low	69.1	Low	32.5 Å²	32.5	28.6 Å²	28.6	17%	0.167	19%	0.189	C	C	.	.			trans	-93.4	114	179.9	-54.3	175.4	0	0	0	108.8	S2095 V2119 C2664 A2685 G2686 Q2687	S2095-I2662 WeakPolarHBondContact O-CG2 3Å; V2119-I2662 HydrophobicContact CG1-CG1 3.95Å; I2662-C2664 PolarHBondContact O-N 3.23Å; I2662-A2685 CarbonylContact O-C 3.59Å; I2662-A2685 VanDerWaalsContact O-CA 3.26Å; I2662-A2685 WeakPolarHBondContact O-CA 3.14Å; I2662-A2685 WeakPolarHBondContact O-CB 3.34Å; I2662-G2686 PolarHBondContact O-N 3Å; I2662-Q2687 HydrophobicContact CD1-CG 4.29Å; I2662-Q2687 HydrophobicContact CG1-CB 4.48Å; I2662-Q2687 HydrophobicContact CG1-CG 4.34Å
2663	P	61.8	Low	68.8	Low	1 Å²	1	31.2 Å²	31.2	1%	0.006	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	119.5	176.2	27.9	-33.3	0	0	0	110.2	T2113 L2661 V2684 A2685	T2113-P2663 HydrophobicContact CG2-CB 3.71Å; T2113-P2663 HydrophobicContact CG2-CG 4.1Å; L2661-P2663 WeakPolarHBondContact O-CD 3.45Å; P2663-V2684 CarbonylContact C-O 3.55Å; P2663-V2684 VanDerWaalsContact CA-O 3.3Å; P2663-V2684 WeakPolarHBondContact CA-O 3.31Å; P2663-A2685 HydrophobicContact CB-CB 4.29Å
2664	C	71.6	Confident	68.3	Low	15.5 Å²	15.5	31.6 Å²	31.6	11%	0.105	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	-15.4	-171.1	56.4	0	0	0	0	113.4	P1809 V2099 I2662 V2684	P1809-C2664 PolarHBondContact O-SG 3.49Å; P1809-C2664 VanDerWaalsContact O-SG 3.32Å; V2099-C2664 VanDerWaalsContact CG2-O 3.26Å; V2099-C2664 WeakPolarHBondContact CG2-O 3.45Å; I2662-C2664 PolarHBondContact O-N 3.23Å; C2664-V2684 PolarHBondContact N-O 3.27Å
2665	G	78	Confident	67.6	Low	4.5 Å²	4.5	38.2 Å²	38.2	5%	0.046	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	144.6	-177.3	0	0	0	0	0	113	S2683 V2684	G2665-S2683 WeakPolarHBondContact O-CA 3.37Å; G2665-V2684 PolarHBondContact N-O 3.01Å; G2665-V2684 PolarHBondContact O-N 2.85Å
2666	L	86.6	Confident	66.9	Low	10.5 Å²	10.5	41.4 Å²	41.4	6%	0.055	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	134.5	178.5	-118.5	149.6	0	0	0	110.7	V2099 C2101 I2111 T2113 I2122 L2681 I2682	V2099-L2666 HydrophobicContact CB-CB 4.39Å; V2099-L2666 HydrophobicContact CB-CD1 4.4Å; V2099-L2666 HydrophobicContact CG1-CB 4.16Å; V2099-L2666 WeakPolarHBondContact O-CD1 2.93Å; C2101-L2666 HydrophobicContact CB-CD2 3.88Å; C2101-L2666 WeakPolarHBondContact SG-CD2 3.31Å; I2111-L2666 HydrophobicContact CB-CD2 4.01Å; I2111-L2666 HydrophobicContact CG2-CD1 3.86Å; I2111-L2666 HydrophobicContact CG2-CD2 4.03Å; I2111-L2666 HydrophobicContact CG2-CG 4.33Å; T2113-L2666 HydrophobicContact CG2-CB 4.2Å; T2113-L2666 HydrophobicContact CG2-CD1 3.37Å; T2113-L2666 HydrophobicContact CG2-CD2 3.58Å; T2113-L2666 HydrophobicContact CG2-CG 3.9Å; T2113-L2666 VanDerWaalsContact CG2-CG 3.47Å; T2113-L2666 WeakPolarHBondContact OG1-CD1 3.45Å; I2122-L2666 HydrophobicContact CD1-CD2 4.37Å; I2122-L2666 HydrophobicContact CG2-CD1 3.77Å; I2122-L2666 HydrophobicContact CG2-CD2 4.11Å; L2666-L2681 HydrophobicContact CD1-CD1 3.95Å; L2666-L2681 HydrophobicContact CD2-CD1 3.9Å; L2666-L2681 HydrophobicContact CG-CD1 3.7Å; L2666-I2682 WeakPolarHBondContact CA-O 3.38Å
2667	S	84.8	Confident	66.5	Low	4 Å²	4	42.4 Å²	42.4	3%	0.028	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	146.9	171.8	-160.4	0	0	0	0	110.7	E1813 L1814 I2682	E1813-S2667 WeakPolarHBondContact OE2-CB 3.23Å; E1813-S2667 PolarHBondContact OE2-OG 3.21Å; L1814-S2667 PolarHBondContact N-OG 2.94Å; S2667-I2682 PolarHBondContact N-O 3.14Å; S2667-I2682 PolarHBondContact O-N 2.81Å
2668	C	84.4	Confident	66.8	Low	3 Å²	3	43.4 Å²	43.4	2%	0.02	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	141.2	-175.1	-177.2	0	0	0	0	111.8	K2104 I2111 L2680 L2681	K2104-C2668 WeakPolarHBondContact CD-O 3.45Å; I2111-C2668 HydrophobicContact CD1-CB 4.47Å; C2668-L2680 VanDerWaalsContact CA-O 3.27Å; C2668-L2680 WeakPolarHBondContact CA-O 3.39Å; C2668-L2680 PolarHBondContact SG-O 3.21Å; C2668-L2681 HydrophobicContact CB-CD1 4.22Å
2669	T	79.7	Confident	67.3	Low	5 Å²	5	43.3 Å²	43.3	3%	0.031	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	171.4	177.5	-164	0	0	0	0	112.1	L1814 D1815 R1816 G1818 T2679 L2680	L1814-T2669 HydrophobicContact CB-CG2 4.35Å; L1814-T2669 HydrophobicContact CD1-CG2 3.87Å; D1815-T2669 PolarHBondContact O-OG1 3.09Å; R1816-T2669 PolarHBondContact O-OG1 3.39Å; R1816-T2669 VanDerWaalsContact O-OG1 3.04Å; G1818-T2669 VanDerWaalsContact CA-CG2 3.41Å; T2669-T2679 CarbonylContact O-C 3.58Å; T2669-L2680 HydrophobicContact CG2-CB 4.37Å; T2669-L2680 HydrophobicContact CG2-CD2 4.37Å; T2669-L2680 PolarHBondContact N-O 3.11Å; T2669-L2680 WeakPolarHBondContact O-CB 3.45Å; T2669-L2680 PolarHBondContact O-N 3.03Å; T2669-L2680 VanDerWaalsContact O-O 3.13Å
2670	K	74.1	Confident	68.4	Low	51.5 Å²	51.5	39.4 Å²	39.4	22%	0.224	23%	0.227	C	C	.	.			trans	-88.3	128.4	171.8	-171	172.1	179.3	169.5	0	109.2	P2105 S2674 N2676 D2677	P2105-K2670 HydrophobicContact CG-CD 4.28Å; K2670-S2674 WeakPolarHBondContact CE-O 3.26Å; K2670-S2674 WeakPolarHBondContact CE-OG 3.31Å; K2670-S2674 PolarHBondContact NZ-O 3.16Å; K2670-N2676 PolarHBondContact NZ-O 3.41Å; K2670-D2677 IonicContact NZ-OD1 2.72Å; K2670-D2677 PolarHBondContact NZ-OD1 3.25Å
2671	P	66.6	Low	69.6	Low	29 Å²	29	36.7 Å²	36.7	19%	0.188	20%	0.199	C	C	.	.			trans	-67.6	136.6	175.9	14.7	-11.7	0	0	0	110.8	N2673 S2674 D2678 L2680	P2671-N2673 PolarHBondContact O-N 2.94Å; P2671-N2673 VanDerWaalsContact O-N 3.12Å; P2671-S2674 WeakPolarHBondContact CD-OG 3.26Å; P2671-S2674 WeakPolarHBondContact CG-OG 3.43Å; P2671-S2674 PolarHBondContact O-N 2.75Å; P2671-S2674 PolarHBondContact O-OG 2.9Å; P2671-S2674 VanDerWaalsContact O-OG 3.1Å; P2671-D2678 WeakPolarHBondContact CD-O 3.36Å; P2671-D2678 HydrophobicContact CG-CB 4.15Å; P2671-L2680 HydrophobicContact CG-CB 4.24Å
2672	L	61.1	Low	70.6	Confident	66.5 Å²	66.5	35.6 Å²	35.6	35%	0.348	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-27	-173.7	-145.2	105.7	0	0	0	114.5	T1817 I1819	T1817-L2672 WeakPolarHBondContact O-CD1 3.41Å; I1819-L2672 HydrophobicContact CD1-CD1 3.82Å; I1819-L2672 HydrophobicContact CD1-CD2 4.18Å; I1819-L2672 HydrophobicContact CG1-CD1 3.86Å
2673	N	57.6	Low	71.5	Confident	119.5 Å²	119.5	34.1 Å²	34.1	64%	0.639	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-109.7	7.2	-172.4	-72.4	-17.1	0	0	0	114.5	P2671 N2675	P2671-N2673 PolarHBondContact O-N 2.94Å; P2671-N2673 VanDerWaalsContact O-N 3.12Å; N2673-N2675 PolarHBondContact O-N 2.89Å
2674	S	57.1	Low	72.4	Confident	24 Å²	24	34 Å²	34	17%	0.168	19%	0.185	C	C	.	.			trans	-89.2	114.6	177	68.4	0	0	0	0	110.8	K2670 P2671 N2676	K2670-S2674 WeakPolarHBondContact CE-O 3.26Å; K2670-S2674 WeakPolarHBondContact CE-OG 3.31Å; K2670-S2674 PolarHBondContact NZ-O 3.16Å; P2671-S2674 WeakPolarHBondContact CD-OG 3.26Å; P2671-S2674 WeakPolarHBondContact CG-OG 3.43Å; P2671-S2674 PolarHBondContact O-N 2.75Å; P2671-S2674 PolarHBondContact O-OG 2.9Å; P2671-S2674 VanDerWaalsContact O-OG 3.1Å; S2674-N2676 WeakPolarHBondContact CB-O 3.45Å; S2674-N2676 PolarHBondContact O-N 3.47Å; S2674-N2676 PolarHBondContact OG-O 2.98Å
2675	N	53.5	Low	72.5	Confident	167.5 Å²	167.5	33.3 Å²	33.3	90%	0.896	18%	0.18	S	C	*	.	S	Bend	trans	-67.7	-25.5	164.6	-78.6	-14.5	0	0	0	111.1	N2673	N2673-N2675 PolarHBondContact O-N 2.89Å
2676	N	54	Low	72.1	Confident	83.5 Å²	83.5	33.5 Å²	33.5	45%	0.447	18%	0.183	S	C	.	.	S	Bend	trans	-76.8	161.2	177.1	-68	-10.5	0	0	0	111.7	K2670 S2674 D2678	K2670-N2676 PolarHBondContact NZ-O 3.41Å; S2674-N2676 WeakPolarHBondContact CB-O 3.45Å; S2674-N2676 PolarHBondContact O-N 3.47Å; S2674-N2676 PolarHBondContact OG-O 2.98Å; N2676-D2678 HydrophobicContact CB-CB 4.28Å; N2676-D2678 VanDerWaalsContact CB-CG 3.48Å; N2676-D2678 WeakPolarHBondContact CB-OD1 3.37Å; N2676-D2678 WeakPolarHBondContact CB-OD2 3.4Å; N2676-D2678 PolarHBondContact ND2-OD2 2.91Å; N2676-D2678 PolarHBondContact O-N 3.16Å
2677	D	56.4	Low	71.1	Confident	80 Å²	80	35 Å²	35	43%	0.428	19%	0.189	S	C	.	.			trans	-67.8	32.7	167.8	-84	-18.7	0	0	0	112.2	K2670 T2679 P2704 L2705	K2670-D2677 IonicContact NZ-OD1 2.72Å; K2670-D2677 PolarHBondContact NZ-OD1 3.25Å; D2677-T2679 WeakPolarHBondContact O-CG2 3.13Å; D2677-T2679 PolarHBondContact O-N 3.39Å; D2677-P2704 WeakPolarHBondContact O-CD 3.42Å; D2677-L2705 HydrophobicContact CB-CB 4.01Å; D2677-L2705 HydrophobicContact CB-CD1 3.86Å; D2677-L2705 HydrophobicContact CB-CG 4.42Å; D2677-L2705 WeakPolarHBondContact O-CA 2.92Å; D2677-L2705 WeakPolarHBondContact O-CB 3.39Å; D2677-L2705 WeakPolarHBondContact O-CD1 3.1Å; D2677-L2705 WeakPolarHBondContact O-CG 3.47Å; D2677-L2705 PolarHBondContact O-N 3.02Å
2678	D	66.3	Low	69.7	Low	33.5 Å²	33.5	37.8 Å²	37.8	18%	0.179	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	136.9	179.2	-56.9	-20.9	0	0	0	109.4	P2671 N2676 D2702 L2703 P2704	P2671-D2678 WeakPolarHBondContact CD-O 3.36Å; P2671-D2678 HydrophobicContact CG-CB 4.15Å; N2676-D2678 HydrophobicContact CB-CB 4.28Å; N2676-D2678 VanDerWaalsContact CB-CG 3.48Å; N2676-D2678 WeakPolarHBondContact CB-OD1 3.37Å; N2676-D2678 WeakPolarHBondContact CB-OD2 3.4Å; N2676-D2678 PolarHBondContact ND2-OD2 2.91Å; N2676-D2678 PolarHBondContact O-N 3.16Å; D2678-D2702 WeakPolarHBondContact CB-OD1 3.5Å; D2678-L2703 CarbonylContact C-O 3.57Å; D2678-L2703 WeakPolarHBondContact CA-O 3.45Å; D2678-L2703 WeakPolarHBondContact CB-O 3.41Å; D2678-P2704 VanDerWaalsContact CA-CD 3.41Å; D2678-P2704 WeakPolarHBondContact OD1-CA 3.27Å; D2678-P2704 VanDerWaalsContact OD1-CD 3.31Å; D2678-P2704 WeakPolarHBondContact OD1-CD 3.37Å
2679	T	72.9	Confident	68	Low	1 Å²	1	40.5 Å²	40.5	1%	0.006	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	123.6	-178.6	40	0	0	0	0	109.2	K2104 T2669 D2677 L2681 L2703 L2705	K2104-T2679 WeakPolarHBondContact O-CG2 3.38Å; T2669-T2679 CarbonylContact O-C 3.58Å; D2677-T2679 WeakPolarHBondContact O-CG2 3.13Å; D2677-T2679 PolarHBondContact O-N 3.39Å; T2679-L2681 PolarHBondContact O-N 2.99Å; T2679-L2703 PolarHBondContact N-O 3.4Å; T2679-L2703 PolarHBondContact O-N 3.31Å; T2679-L2703 VanDerWaalsContact OG1-CB 3.26Å; T2679-L2703 WeakPolarHBondContact OG1-CB 3.05Å; T2679-L2703 PolarHBondContact OG1-O 2.85Å; T2679-L2705 HydrophobicContact CG2-CD1 4.09Å; T2679-L2705 HydrophobicContact CG2-CD2 4.29Å; T2679-L2705 HydrophobicContact CG2-CG 4.31Å; T2679-L2705 WeakPolarHBondContact OG1-CD2 3.5Å; T2679-L2705 WeakPolarHBondContact OG1-CG 3.31Å
2680	L	81.1	Confident	66.4	Low	12.5 Å²	12.5	45.6 Å²	45.6	7%	0.065	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	120.5	175	-167.6	72.9	0	0	0	108.7	V1835 C2668 T2669 P2671 L2700 D2702	V1835-L2680 HydrophobicContact CG1-CD2 4.07Å; C2668-L2680 VanDerWaalsContact CA-O 3.27Å; C2668-L2680 WeakPolarHBondContact CA-O 3.39Å; C2668-L2680 PolarHBondContact SG-O 3.21Å; T2669-L2680 HydrophobicContact CG2-CB 4.37Å; T2669-L2680 HydrophobicContact CG2-CD2 4.37Å; T2669-L2680 PolarHBondContact N-O 3.11Å; T2669-L2680 WeakPolarHBondContact O-CB 3.45Å; T2669-L2680 PolarHBondContact O-N 3.03Å; T2669-L2680 VanDerWaalsContact O-O 3.13Å; P2671-L2680 HydrophobicContact CG-CB 4.24Å; L2680-L2700 HydrophobicContact CD1-CD1 3.46Å; L2680-L2700 VanDerWaalsContact CD1-CD1 3.42Å; L2680-L2700 HydrophobicContact CD1-CD2 4Å; L2680-L2700 HydrophobicContact CD1-CG 3.72Å; L2680-L2700 HydrophobicContact CD2-CD1 3.89Å; L2680-L2700 HydrophobicContact CG-CD1 3.68Å; L2680-L2700 HydrophobicContact CG-CG 4.44Å; L2680-D2702 WeakPolarHBondContact CD1-OD1 3.2Å
2681	L	84.8	Confident	65.1	Low	0 Å²	0	48.7 Å²	48.7	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	135.9	175	169.5	70.3	0	0	0	109.1	I2111 I2122 L2655 L2666 C2668 T2679 L2700 W2701 L2703	I2111-L2681 HydrophobicContact CD1-CB 4.49Å; I2111-L2681 HydrophobicContact CD1-CD1 3.8Å; I2111-L2681 HydrophobicContact CD1-CD2 4.14Å; I2111-L2681 HydrophobicContact CD1-CG 4.37Å; I2111-L2681 HydrophobicContact CG2-CD1 4.09Å; I2111-L2681 HydrophobicContact CG2-CD2 3.91Å; I2122-L2681 HydrophobicContact CG2-CD2 4.41Å; L2655-L2681 HydrophobicContact CD1-CD2 3.6Å; L2655-L2681 VanDerWaalsContact CD1-CD2 3.41Å; L2666-L2681 HydrophobicContact CD1-CD1 3.95Å; L2666-L2681 HydrophobicContact CD2-CD1 3.9Å; L2666-L2681 HydrophobicContact CG-CD1 3.7Å; C2668-L2681 HydrophobicContact CB-CD1 4.22Å; T2679-L2681 PolarHBondContact O-N 2.99Å; L2681-L2700 CarbonylContact O-C 3.54Å; L2681-W2701 HydrophobicContact CB-CB 4.11Å; L2681-W2701 HydrophobicContact CD2-CB 4.27Å; L2681-W2701 HydrophobicContact CD2-CG 4.26Å; L2681-W2701 HydrophobicContact CG-CB 4.32Å; L2681-W2701 PolarHBondContact N-O 3.37Å; L2681-W2701 PolarHBondContact O-N 2.95Å; L2681-L2703 HydrophobicContact CB-CD1 4.14Å; L2681-L2703 HydrophobicContact CD2-CD1 3.98Å; L2681-L2703 VanDerWaalsContact CD2-CD1 3.47Å; L2681-L2703 HydrophobicContact CG-CD1 4.26Å
2682	I	84.7	Confident	64.2	Low	3.5 Å²	3.5	56.4 Å²	56.4	2%	0.018	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	138	169.3	-63.2	180	0	0	0	109.7	I1812 L1814 L1821 V1835 L2666 S2667 I2698 R2699 L2700	I1812-I2682 HydrophobicContact CD1-CG2 3.52Å; I1812-I2682 HydrophobicContact CG1-CG2 4.45Å; L1814-I2682 HydrophobicContact CD1-CB 4.1Å; L1814-I2682 HydrophobicContact CD1-CD1 3.65Å; L1814-I2682 HydrophobicContact CD1-CG1 3.78Å; L1814-I2682 HydrophobicContact CD2-CD1 3.56Å; L1814-I2682 HydrophobicContact CG-CD1 3.76Å; L1814-I2682 HydrophobicContact CG-CG1 4.36Å; L1821-I2682 HydrophobicContact CD1-CD1 3.66Å; L1821-I2682 HydrophobicContact CD1-CG2 4.18Å; L1821-I2682 HydrophobicContact CD2-CD1 4.03Å; L1821-I2682 HydrophobicContact CD2-CG2 4.41Å; L1821-I2682 HydrophobicContact CG-CD1 4.32Å; V1835-I2682 HydrophobicContact CG1-CD1 4.45Å; V1835-I2682 HydrophobicContact CG2-CD1 4.35Å; L2666-I2682 WeakPolarHBondContact CA-O 3.38Å; S2667-I2682 PolarHBondContact N-O 3.14Å; S2667-I2682 PolarHBondContact O-N 2.81Å; I2682-I2698 HydrophobicContact CG2-CG2 3.77Å; I2682-R2699 VanDerWaalsContact CA-O 3.3Å; I2682-R2699 WeakPolarHBondContact CA-O 3.47Å; I2682-L2700 HydrophobicContact CD1-CD1 3.5Å; I2682-L2700 VanDerWaalsContact CD1-CD1 3.47Å; I2682-L2700 HydrophobicContact CG1-CD1 3.32Å; I2682-L2700 VanDerWaalsContact CG1-CD1 3.41Å; I2682-L2700 HydrophobicContact CG1-CG 4.48Å
2683	S	84.4	Confident	63.5	Low	0 Å²	0	57.4 Å²	57.4	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	145.5	175.2	60.7	0	0	0	0	111.3	I2122 H2658 G2665 I2698 R2699 W2701	I2122-S2683 VanDerWaalsContact CD1-OG 3.32Å; I2122-S2683 WeakPolarHBondContact CD1-OG 3.15Å; H2658-S2683 PolarHBondContact NE2-OG 3.39Å; G2665-S2683 WeakPolarHBondContact O-CA 3.37Å; S2683-I2698 CarbonylContact O-C 3.58Å; S2683-I2698 WeakPolarHBondContact O-CA 3.22Å; S2683-R2699 PolarHBondContact N-O 2.73Å; S2683-R2699 PolarHBondContact O-N 3.14Å; S2683-W2701 PolarHBondContact OG-NE1 3.02Å
2684	V	80.5	Confident	63.6	Low	0 Å²	0	53.4 Å²	53.4	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	137.5	170.1	-179.3	0	0	0	0	109	P1809 I1812 P2663 C2664 G2665 D2697 I2698	P1809-V2684 HydrophobicContact CB-CG1 3.65Å; P1809-V2684 HydrophobicContact CG-CG1 3.44Å; P1809-V2684 VanDerWaalsContact CG-CG1 3.44Å; P1809-V2684 WeakPolarHBondContact O-CG1 2.91Å; I1812-V2684 HydrophobicContact CB-CG2 3.53Å; I1812-V2684 HydrophobicContact CD1-CG2 3.08Å; I1812-V2684 HydrophobicContact CG1-CG2 3.9Å; I1812-V2684 HydrophobicContact CG2-CG2 3.77Å; P2663-V2684 CarbonylContact C-O 3.55Å; P2663-V2684 VanDerWaalsContact CA-O 3.3Å; P2663-V2684 WeakPolarHBondContact CA-O 3.31Å; C2664-V2684 PolarHBondContact N-O 3.27Å; G2665-V2684 PolarHBondContact N-O 3.01Å; G2665-V2684 PolarHBondContact O-N 2.85Å; V2684-D2697 WeakPolarHBondContact CA-O 3.41Å; V2684-I2698 HydrophobicContact CG1-CG1 4.33Å; V2684-I2698 HydrophobicContact CG2-CB 4.47Å; V2684-I2698 HydrophobicContact CG2-CD1 4.2Å; V2684-I2698 HydrophobicContact CG2-CG1 3.92Å; V2684-I2698 HydrophobicContact CG2-CG2 4.18Å
2685	A	75.1	Confident	63.9	Low	0 Å²	0	53.4 Å²	53.4	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	146.8	166.6	0	0	0	0	0	111.4	H2658 L2661 I2662 P2663 C2696 D2697	H2658-A2685 HydrophobicContact CB-CB 3.69Å; H2658-A2685 VanDerWaalsContact CG-CB 3.44Å; H2658-A2685 VanDerWaalsContact ND1-CB 3.27Å; H2658-A2685 WeakPolarHBondContact ND1-CB 3.36Å; L2661-A2685 HydrophobicContact CB-CB 3.65Å; L2661-A2685 HydrophobicContact CD1-CB 4.45Å; I2662-A2685 CarbonylContact O-C 3.59Å; I2662-A2685 VanDerWaalsContact O-CA 3.26Å; I2662-A2685 WeakPolarHBondContact O-CA 3.14Å; I2662-A2685 WeakPolarHBondContact O-CB 3.34Å; P2663-A2685 HydrophobicContact CB-CB 4.29Å; A2685-C2696 CarbonylContact O-C 3.6Å; A2685-C2696 VanDerWaalsContact O-CA 3.29Å; A2685-C2696 WeakPolarHBondContact O-CA 3.21Å; A2685-D2697 PolarHBondContact N-O 3.22Å; A2685-D2697 PolarHBondContact O-N 3.39Å
2686	G	69	Low	64.9	Low	9 Å²	9	46.8 Å²	46.8	9%	0.093	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	139.8	178.6	0	0	0	0	0	110.8	I2662 G2695	I2662-G2686 PolarHBondContact O-N 3Å; G2686-G2695 WeakPolarHBondContact CA-O 3.24Å
2687	Q	65.6	Low	66.1	Low	42.5 Å²	42.5	43.9 Å²	43.9	20%	0.199	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	136.3	172.8	-169.7	171.9	-10.1	0	0	110.3	G2660 L2661 I2662 C2689 G2695	G2660-Q2687 PolarHBondContact O-OE1 3.19Å; L2661-Q2687 HydrophobicContact CD2-CB 4.03Å; I2662-Q2687 HydrophobicContact CD1-CG 4.29Å; I2662-Q2687 HydrophobicContact CG1-CB 4.48Å; I2662-Q2687 HydrophobicContact CG1-CG 4.34Å; Q2687-C2689 WeakPolarHBondContact CG-SG 3.5Å; Q2687-C2689 PolarHBondContact NE2-SG 3.32Å; Q2687-C2689 VanDerWaalsContact NE2-SG 3.44Å; Q2687-C2689 PolarHBondContact O-N 3.41Å; Q2687-G2695 PolarHBondContact N-O 3.19Å; Q2687-G2695 PolarHBondContact O-N 3.04Å; Q2687-G2695 VanDerWaalsContact O-N 3.11Å
2688	N	55.5	Low	67.3	Low	63 Å²	63	41.6 Å²	41.6	34%	0.337	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	89.7	168.3	-154.4	-7.1	0	0	0	106.4	I1808 D2690 I2694	I1808-N2688 HydrophobicContact CD1-CB 4.01Å; N2688-D2690 VanDerWaalsContact C-N 3.34Å; N2688-D2690 PolarHBondContact OD1-O 3.01Å; N2688-I2694 WeakPolarHBondContact OD1-CG1 3.38Å
2689	C	48	Very low	68.1	Low	59.5 Å²	59.5	43 Å²	43	40%	0.402	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	-30.9	-174.9	-64.9	0	0	0	0	111.7	Q2687 T2693	Q2687-C2689 WeakPolarHBondContact CG-SG 3.5Å; Q2687-C2689 PolarHBondContact NE2-SG 3.32Å; Q2687-C2689 VanDerWaalsContact NE2-SG 3.44Å; Q2687-C2689 PolarHBondContact O-N 3.41Å; C2689-T2693 PolarHBondContact N-O 2.92Å
2690	D	46.9	Very low	68.6	Low	111.5 Å²	111.5	45.5 Å²	45.5	60%	0.596	25%	0.253	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-165.7	158.5	174.8	-86.9	-45.1	0	0	0	108.8	N2688 K2692 T2693	N2688-D2690 VanDerWaalsContact C-N 3.34Å; N2688-D2690 PolarHBondContact OD1-O 3.01Å; D2690-K2692 PolarHBondContact O-N 2.86Å; D2690-T2693 PolarHBondContact O-N 2.87Å
2691	S	47.1	Very low	68.6	Low	116.5 Å²	116.5	46.1 Å²	46.1	82%	0.815	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.5	-8.9	-177.5	63.5	0	0	0	0	116.9
2692	K	45.9	Very low	68.2	Low	191.5 Å²	191.5	49.8 Å²	49.8	83%	0.833	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.1	-19.6	-179.3	-65.1	-177.5	-179.7	177.5	0	114.9	D2690	D2690-K2692 PolarHBondContact O-N 2.86Å
2693	T	46.7	Very low	67.5	Low	86.5 Å²	86.5	49.9 Å²	49.9	53%	0.531	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	98.8	-176.4	44.8	0	0	0	0	109.7	C2689 D2690	C2689-T2693 PolarHBondContact N-O 2.92Å; D2690-T2693 PolarHBondContact O-N 2.87Å
2694	I	59.3	Low	66.4	Low	35 Å²	35	52 Å²	52	18%	0.179	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	131.2	174.3	-69	168.9	0	0	0	107.1	Q1806 I1808 N2688	Q1806-I2694 HydrophobicContact CB-CB 3.93Å; Q1806-I2694 HydrophobicContact CB-CG2 3.73Å; Q1806-I2694 WeakPolarHBondContact O-CD1 3.18Å; Q1806-I2694 PolarHBondContact OE1-O 3.44Å; I1808-I2694 HydrophobicContact CD1-CD1 4.46Å; I1808-I2694 HydrophobicContact CD1-CG1 4.28Å; I1808-I2694 HydrophobicContact CD1-CG2 3.63Å; I1808-I2694 HydrophobicContact CG1-CB 4.49Å; I1808-I2694 HydrophobicContact CG1-CG2 3.25Å; N2688-I2694 WeakPolarHBondContact OD1-CG1 3.38Å
2695	G	65.1	Low	65.2	Low	24 Å²	24	53.5 Å²	53.5	25%	0.247	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	132.5	170.9	0	0	0	0	0	110	L2661 G2686 Q2687	L2661-G2695 VanDerWaalsContact CD2-O 3.27Å; L2661-G2695 WeakPolarHBondContact CD2-O 3.36Å; G2686-G2695 WeakPolarHBondContact CA-O 3.24Å; Q2687-G2695 PolarHBondContact N-O 3.19Å; Q2687-G2695 PolarHBondContact O-N 3.04Å; Q2687-G2695 VanDerWaalsContact O-N 3.11Å
2696	C	74.7	Confident	63.8	Low	29 Å²	29	56.7 Å²	56.7	20%	0.196	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	149	172.1	62.8	0	0	0	0	111.9	P1809 A2685	P1809-C2696 VanDerWaalsContact CD-CB 3.45Å; P1809-C2696 HydrophobicContact CG-CB 4.02Å; A2685-C2696 CarbonylContact O-C 3.6Å; A2685-C2696 VanDerWaalsContact O-CA 3.29Å; A2685-C2696 WeakPolarHBondContact O-CA 3.21Å
2697	D	77.4	Confident	62.5	Low	23.5 Å²	23.5	60.7 Å²	60.7	13%	0.126	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	145.7	177.8	127.7	-7.7	0	0	0	111.2	H2658 L2661 V2684 A2685 R2699	H2658-D2697 IonicContact CE1-OD1 3.86Å; H2658-D2697 PolarHBondContact CE1-OD1 2.61Å; H2658-D2697 VanDerWaalsContact CE1-OD1 3.26Å; H2658-D2697 IonicContact CE1-OD2 3.08Å; H2658-D2697 IonicContact CG-OD1 2.72Å; H2658-D2697 VanDerWaalsContact ND1-CG 3.26Å; H2658-D2697 IonicContact ND1-OD1 3.3Å; H2658-D2697 PolarHBondContact ND1-OD1 3.16Å; H2658-D2697 IonicContact ND1-OD2 3.14Å; H2658-D2697 PolarHBondContact ND1-OD2 3.08Å; L2661-D2697 HydrophobicContact CD1-CB 3.73Å; L2661-D2697 WeakPolarHBondContact CD1-OD1 3.22Å; V2684-D2697 WeakPolarHBondContact CA-O 3.41Å; A2685-D2697 PolarHBondContact N-O 3.22Å; A2685-D2697 PolarHBondContact O-N 3.39Å; D2697-R2699 IonicContact OD1-NE 2.89Å; D2697-R2699 IonicContact OD2-CZ 3.07Å; D2697-R2699 VanDerWaalsContact OD2-CZ 3.28Å; D2697-R2699 IonicContact OD2-NE 3.73Å; D2697-R2699 PolarHBondContact OD2-NE 3.02Å; D2697-R2699 IonicContact OD2-NH2 2.9Å; D2697-R2699 PolarHBondContact OD2-NH2 2.88Å
2698	I	83.1	Confident	61.1	Low	31.5 Å²	31.5	62.3 Å²	62.3	16%	0.162	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	125.6	173.8	-52.9	-172.1	0	0	0	107.3	I1812 L1821 Y1823 I2682 S2683 V2684	I1812-I2698 HydrophobicContact CD1-CD1 4.23Å; I1812-I2698 HydrophobicContact CD1-CG2 3.71Å; L1821-I2698 HydrophobicContact CD2-CG2 4.1Å; Y1823-I2698 HydrophobicContact CD1-CD1 3.57Å; Y1823-I2698 HydrophobicContact CD2-CD1 4.38Å; Y1823-I2698 HydrophobicContact CE1-CD1 4Å; Y1823-I2698 HydrophobicContact CG-CD1 3.78Å; I2682-I2698 HydrophobicContact CG2-CG2 3.77Å; S2683-I2698 CarbonylContact O-C 3.58Å; S2683-I2698 WeakPolarHBondContact O-CA 3.22Å; V2684-I2698 HydrophobicContact CG1-CG1 4.33Å; V2684-I2698 HydrophobicContact CG2-CB 4.47Å; V2684-I2698 HydrophobicContact CG2-CD1 4.2Å; V2684-I2698 HydrophobicContact CG2-CG1 3.92Å; V2684-I2698 HydrophobicContact CG2-CG2 4.18Å
2699	R	82.8	Confident	60.1	Low	64 Å²	64	63.9 Å²	63.9	24%	0.242	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	137.8	-177.5	-68	-173.2	-174.6	-153.8	6.9	112.6	G2657 H2658 I2682 S2683 D2697 W2701	G2657-R2699 PolarHBondContact O-NH1 2.82Å; G2657-R2699 VanDerWaalsContact O-NH1 3.11Å; G2657-R2699 PolarHBondContact O-NH2 3.22Å; H2658-R2699 VanDerWaalsContact CE1-CD 3.49Å; H2658-R2699 WeakPolarHBondContact CE1-CD 3.41Å; H2658-R2699 VanDerWaalsContact CE1-CG 3.47Å; H2658-R2699 WeakPolarHBondContact CE1-CG 3.22Å; I2682-R2699 VanDerWaalsContact CA-O 3.3Å; I2682-R2699 WeakPolarHBondContact CA-O 3.47Å; S2683-R2699 PolarHBondContact N-O 2.73Å; S2683-R2699 PolarHBondContact O-N 3.14Å; D2697-R2699 IonicContact OD1-NE 2.89Å; D2697-R2699 IonicContact OD2-CZ 3.07Å; D2697-R2699 VanDerWaalsContact OD2-CZ 3.28Å; D2697-R2699 IonicContact OD2-NE 3.73Å; D2697-R2699 PolarHBondContact OD2-NE 3.02Å; D2697-R2699 IonicContact OD2-NH2 2.9Å; D2697-R2699 PolarHBondContact OD2-NH2 2.88Å; R2699-W2701 HydrophobicContact CB-CZ2 4.08Å
2700	L	83.2	Confident	59.3	Low	52.5 Å²	52.5	65 Å²	65	28%	0.275	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	133.1	171.8	-168.6	78	0	0	0	109.5	V1835 L2680 L2681 I2682	V1835-L2700 HydrophobicContact CG1-CD1 4.01Å; V1835-L2700 HydrophobicContact CG1-CD2 4.22Å; L2680-L2700 HydrophobicContact CD1-CD1 3.46Å; L2680-L2700 VanDerWaalsContact CD1-CD1 3.42Å; L2680-L2700 HydrophobicContact CD1-CD2 4Å; L2680-L2700 HydrophobicContact CD1-CG 3.72Å; L2680-L2700 HydrophobicContact CD2-CD1 3.89Å; L2680-L2700 HydrophobicContact CG-CD1 3.68Å; L2680-L2700 HydrophobicContact CG-CG 4.44Å; L2681-L2700 CarbonylContact O-C 3.54Å; I2682-L2700 HydrophobicContact CD1-CD1 3.5Å; I2682-L2700 VanDerWaalsContact CD1-CD1 3.47Å; I2682-L2700 HydrophobicContact CG1-CD1 3.32Å; I2682-L2700 VanDerWaalsContact CG1-CD1 3.41Å; I2682-L2700 HydrophobicContact CG1-CG 4.48Å
2701	W	81.3	Confident	58.6	Low	24.5 Å²	24.5	65.5 Å²	65.5	9%	0.093	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	138.6	178.8	-48.1	87.4	0	0	0	109.4	I2122 L2655 L2681 S2683 R2699	I2122-W2701 HydrophobicContact CD1-CZ2 4.25Å; L2655-W2701 HydrophobicContact CB-CD2 4.36Å; L2655-W2701 HydrophobicContact CB-CE3 4.1Å; L2655-W2701 HydrophobicContact CB-CH2 3.92Å; L2655-W2701 HydrophobicContact CB-CZ2 4.18Å; L2655-W2701 HydrophobicContact CB-CZ3 3.88Å; L2655-W2701 HydrophobicContact CD1-CB 4.35Å; L2655-W2701 HydrophobicContact CD1-CD2 3.87Å; L2655-W2701 HydrophobicContact CD1-CE3 4.09Å; L2655-W2701 HydrophobicContact CD1-CG 4Å; L2655-W2701 HydrophobicContact CD2-CE3 4.05Å; L2655-W2701 HydrophobicContact CD2-CZ3 4.31Å; L2655-W2701 HydrophobicContact CG-CE3 4.31Å; L2655-W2701 HydrophobicContact CG-CZ3 4.41Å; L2681-W2701 HydrophobicContact CB-CB 4.11Å; L2681-W2701 HydrophobicContact CD2-CB 4.27Å; L2681-W2701 HydrophobicContact CD2-CG 4.26Å; L2681-W2701 HydrophobicContact CG-CB 4.32Å; L2681-W2701 PolarHBondContact N-O 3.37Å; L2681-W2701 PolarHBondContact O-N 2.95Å; S2683-W2701 PolarHBondContact OG-NE1 3.02Å; R2699-W2701 HydrophobicContact CB-CZ2 4.08Å
2702	D	76.4	Confident	57.9	Low	78.5 Å²	78.5	64.4 Å²	64.4	42%	0.42	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	124.5	169.4	-118.9	-10.1	0	0	0	109	D2678 L2680 P2704	D2678-D2702 WeakPolarHBondContact CB-OD1 3.5Å; L2680-D2702 WeakPolarHBondContact CD1-OD1 3.2Å; D2702-P2704 WeakPolarHBondContact O-CD 3.39Å
2703	L	70.4	Confident	57.3	Low	6 Å²	6	61.5 Å²	61.5	3%	0.031	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	135.8	176.1	-85.5	156.9	0	0	0	108.1	I2111 V2124 L2655 D2678 T2679 L2681 L2705	I2111-L2703 HydrophobicContact CD1-CD1 3.98Å; I2111-L2703 HydrophobicContact CG1-CD1 4.45Å; V2124-L2703 HydrophobicContact CG1-CD1 4.34Å; V2124-L2703 HydrophobicContact CG1-CD2 4.25Å; V2124-L2703 HydrophobicContact CG2-CD1 4.35Å; V2124-L2703 HydrophobicContact CG2-CD2 4.33Å; L2655-L2703 HydrophobicContact CD1-CD1 4.29Å; D2678-L2703 CarbonylContact C-O 3.57Å; D2678-L2703 WeakPolarHBondContact CA-O 3.45Å; D2678-L2703 WeakPolarHBondContact CB-O 3.41Å; T2679-L2703 PolarHBondContact N-O 3.4Å; T2679-L2703 PolarHBondContact O-N 3.31Å; T2679-L2703 VanDerWaalsContact OG1-CB 3.26Å; T2679-L2703 WeakPolarHBondContact OG1-CB 3.05Å; T2679-L2703 PolarHBondContact OG1-O 2.85Å; L2681-L2703 HydrophobicContact CB-CD1 4.14Å; L2681-L2703 HydrophobicContact CD2-CD1 3.98Å; L2681-L2703 VanDerWaalsContact CD2-CD1 3.47Å; L2681-L2703 HydrophobicContact CG-CD1 4.26Å; L2703-L2705 HydrophobicContact CD2-CG 4.42Å; L2703-L2705 PolarHBondContact O-N 3.23Å
2704	P	60.7	Low	56.9	Low	44.5 Å²	44.5	60.7 Å²	60.7	29%	0.289	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)		-63.8	132.9	-102.2	28.6	-31.4	0	0	0	109.3	Y2109 D2677 D2678 D2702 S2706	Y2109-P2704 HydrophobicContact CE2-CB 3.85Å; Y2109-P2704 WeakPolarHBondContact OH-CB 3.36Å; D2677-P2704 WeakPolarHBondContact O-CD 3.42Å; D2678-P2704 VanDerWaalsContact CA-CD 3.41Å; D2678-P2704 WeakPolarHBondContact OD1-CA 3.27Å; D2678-P2704 VanDerWaalsContact OD1-CD 3.31Å; D2678-P2704 WeakPolarHBondContact OD1-CD 3.37Å; D2702-P2704 WeakPolarHBondContact O-CD 3.39Å; P2704-S2706 VanDerWaalsContact C-N 3.27Å; P2704-S2706 PolarHBondContact O-N 2.85Å; P2704-S2706 VanDerWaalsContact O-N 3.09Å
2705	L	54.8	Low	56.3	Low	31 Å²	31	62.2 Å²	62.2	16%	0.162	36%	0.36	C	S	.	.	S	Bend	trans	-64.4	50.3	171.1	-60.8	161.8	0	0	0	108.9	R2108 Y2109 A2653 D2677 T2679 L2703 N2707	R2108-L2705 HydrophobicContact CB-CD2 4.38Å; R2108-L2705 PolarHBondContact NH1-O 2.75Å; Y2109-L2705 HydrophobicContact CD2-CD2 3.62Å; Y2109-L2705 HydrophobicContact CE2-CD2 3.59Å; Y2109-L2705 PolarHBondContact OH-O 3.3Å; A2653-L2705 HydrophobicContact CB-CD1 4.08Å; D2677-L2705 HydrophobicContact CB-CB 4.01Å; D2677-L2705 HydrophobicContact CB-CD1 3.86Å; D2677-L2705 HydrophobicContact CB-CG 4.42Å; D2677-L2705 WeakPolarHBondContact O-CA 2.92Å; D2677-L2705 WeakPolarHBondContact O-CB 3.39Å; D2677-L2705 WeakPolarHBondContact O-CD1 3.1Å; D2677-L2705 WeakPolarHBondContact O-CG 3.47Å; D2677-L2705 PolarHBondContact O-N 3.02Å; T2679-L2705 HydrophobicContact CG2-CD1 4.09Å; T2679-L2705 HydrophobicContact CG2-CD2 4.29Å; T2679-L2705 HydrophobicContact CG2-CG 4.31Å; T2679-L2705 WeakPolarHBondContact OG1-CD2 3.5Å; T2679-L2705 WeakPolarHBondContact OG1-CG 3.31Å; L2703-L2705 HydrophobicContact CD2-CG 4.42Å; L2703-L2705 PolarHBondContact O-N 3.23Å; L2705-N2707 PolarHBondContact O-N 2.86Å; L2705-N2707 VanDerWaalsContact O-N 3.07Å
2706	S	46.7	Very low	56.1	Low	67.5 Å²	67.5	62 Å²	62	47%	0.472	35%	0.353	S	S	.	.	S	Bend	trans	-64.4	128.2	179.4	62.8	0	0	0	0	109.6	P2704 N2708	P2704-S2706 VanDerWaalsContact C-N 3.27Å; P2704-S2706 PolarHBondContact O-N 2.85Å; P2704-S2706 VanDerWaalsContact O-N 3.09Å; S2706-N2708 PolarHBondContact O-N 3.17Å; S2706-N2708 WeakPolarHBondContact OG-CB 3.21Å; S2706-N2708 PolarHBondContact OG-ND2 3.04Å
2707	N	41.7	Very low	55.7	Low	92 Å²	92	63.6 Å²	63.6	49%	0.492	36%	0.358	S	S	.	.			trans	-67.2	31.3	178.5	-104	3.6	0	0	0	112.3	L2705 S2709	L2705-N2707 PolarHBondContact O-N 2.86Å; L2705-N2707 VanDerWaalsContact O-N 3.07Å; N2707-S2709 PolarHBondContact O-N 3.3Å; N2707-S2709 PolarHBondContact O-OG 2.72Å; N2707-S2709 VanDerWaalsContact O-OG 3.09Å
2708	N	34.8	Very low	55.4	Low	76.5 Å²	76.5	62.9 Å²	62.9	41%	0.409	35%	0.353	S	S	.	.			trans	-65.2	63.2	166	-77.4	-11	0	0	0	109.3	S2706 S2710 L2711	S2706-N2708 PolarHBondContact O-N 3.17Å; S2706-N2708 WeakPolarHBondContact OG-CB 3.21Å; S2706-N2708 PolarHBondContact OG-ND2 3.04Å; N2708-S2710 PolarHBondContact O-N 2.93Å; N2708-L2711 HydrophobicContact CB-CD1 4.21Å; N2708-L2711 PolarHBondContact O-N 3.37Å; N2708-L2711 VanDerWaalsContact O-N 3.12Å
2709	S	36	Very low	54.4	Low	96.5 Å²	96.5	65.8 Å²	65.8	68%	0.675	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-10.6	165.1	52.8	0	0	0	0	111.9	N2707 L2711 C2712	N2707-S2709 PolarHBondContact O-N 3.3Å; N2707-S2709 PolarHBondContact O-OG 2.72Å; N2707-S2709 VanDerWaalsContact O-OG 3.09Å; S2709-L2711 PolarHBondContact O-N 3.46Å; S2709-C2712 CarbonylContact O-C 3.59Å; S2709-C2712 PolarHBondContact O-N 2.8Å; S2709-C2712 VanDerWaalsContact O-O 3.05Å
2710	S	30.5	Very low	53.4	Low	81.5 Å²	81.5	63.6 Å²	63.6	57%	0.57	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-17.3	170.3	56.2	0	0	0	0	114.3	N2708	N2708-S2710 PolarHBondContact O-N 2.93Å
2711	L	31.7	Very low	52.7	Low	123.5 Å²	123.5	64.2 Å²	64.2	65%	0.647	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	8.6	176.5	-86.7	135	0	0	0	112.3	N2708 S2709 K2713	N2708-L2711 HydrophobicContact CB-CD1 4.21Å; N2708-L2711 PolarHBondContact O-N 3.37Å; N2708-L2711 VanDerWaalsContact O-N 3.12Å; S2709-L2711 PolarHBondContact O-N 3.46Å; L2711-K2713 PolarHBondContact O-N 3.24Å; L2711-K2713 VanDerWaalsContact O-N 3.1Å
2712	C	31.9	Very low	52.6	Low	92.5 Å²	92.5	63.9 Å²	63.9	63%	0.625	38%	0.377	S	S	*	.			trans	-87.8	72.8	161.6	-70.2	0	0	0	0	109.6	S2709 P2714	S2709-C2712 CarbonylContact O-C 3.59Å; S2709-C2712 PolarHBondContact O-N 2.8Å; S2709-C2712 VanDerWaalsContact O-O 3.05Å; C2712-P2714 VanDerWaalsContact O-CD 3.23Å; C2712-P2714 WeakPolarHBondContact O-CD 3.49Å
2713	K	35.1	Very low	52.7	Low	132 Å²	132	63.3 Å²	63.3	57%	0.574	37%	0.374	S	S	*	.			trans	-95.5	133.1	164.6	-79	171.9	176.3	174.3	0	108.2	L2711 T2715	L2711-K2713 PolarHBondContact O-N 3.24Å; L2711-K2713 VanDerWaalsContact O-N 3.1Å; K2713-T2715 PolarHBondContact O-N 2.71Å
2714	P	37.4	Very low	53.1	Low	69 Å²	69	63.5 Å²	63.5	45%	0.448	38%	0.375	S	S	.	.			trans	-82.6	109.5	-177.5	34.3	-30.6	0	0	0	107.5	C2712 L2716	C2712-P2714 VanDerWaalsContact O-CD 3.23Å; C2712-P2714 WeakPolarHBondContact O-CD 3.49Å; P2714-L2716 PolarHBondContact O-N 3.21Å
2715	T	47.6	Very low	54.3	Low	66.5 Å²	66.5	62.3 Å²	62.3	41%	0.408	37%	0.369	S	S	.	.			trans	-87	133.1	146.3	41	0	0	0	0	104.3	K2713 Q2717	K2713-T2715 PolarHBondContact O-N 2.71Å; T2715-Q2717 PolarHBondContact O-N 3.11Å; T2715-Q2717 VanDerWaalsContact OG1-CD 3.22Å; T2715-Q2717 WeakPolarHBondContact OG1-CG 3.22Å; T2715-Q2717 PolarHBondContact OG1-NE2 2.86Å
2716	L	60.9	Low	55.8	Low	19 Å²	19	62.4 Å²	62.4	10%	0.099	37%	0.369	C	S	.	.	S	Bend	trans	-64.9	77.1	170	-114.6	103.3	0	0	0	107.6	P2714 I2747 W2749 P2787 R2790 L2863	P2714-L2716 PolarHBondContact O-N 3.21Å; L2716-I2747 HydrophobicContact CB-CD1 4.3Å; L2716-I2747 HydrophobicContact CB-CG2 4.45Å; L2716-I2747 HydrophobicContact CD2-CG2 4.16Å; L2716-W2749 WeakPolarHBondContact O-CH2 3.38Å; L2716-P2787 HydrophobicContact CB-CB 3.82Å; L2716-P2787 HydrophobicContact CB-CG 4.05Å; L2716-P2787 HydrophobicContact CD1-CB 4.18Å; L2716-P2787 HydrophobicContact CD1-CG 4.07Å; L2716-P2787 HydrophobicContact CD2-CB 4.17Å; L2716-P2787 HydrophobicContact CG-CB 4.2Å; L2716-P2787 HydrophobicContact CG-CG 4.4Å; L2716-R2790 HydrophobicContact CD2-CB 3.53Å; L2716-R2790 VanDerWaalsContact CD2-N 3.3Å; L2716-R2790 HydrophobicContact CG-CB 3.95Å; L2716-L2863 HydrophobicContact CD1-CB 3.52Å; L2716-L2863 HydrophobicContact CD1-CD1 3.28Å; L2716-L2863 HydrophobicContact CD1-CD2 3.94Å; L2716-L2863 HydrophobicContact CD1-CG 3.72Å; L2716-L2863 HydrophobicContact CD2-CB 4.46Å; L2716-L2863 HydrophobicContact CG-CB 4.48Å
2717	Q	65.7	Low	57.7	Low	62.5 Å²	62.5	62.3 Å²	62.3	29%	0.292	36%	0.359	S	S	.	.			trans	-113.7	144.4	178.8	-117.8	-178.8	-9.3	0	0	107.7	T2715 T2719 S3123 G3124	T2715-Q2717 PolarHBondContact O-N 3.11Å; T2715-Q2717 VanDerWaalsContact OG1-CD 3.22Å; T2715-Q2717 WeakPolarHBondContact OG1-CG 3.22Å; T2715-Q2717 PolarHBondContact OG1-NE2 2.86Å; Q2717-T2719 PolarHBondContact O-N 2.84Å; Q2717-S3123 PolarHBondContact NE2-O 3.31Å; Q2717-G3124 WeakPolarHBondContact CG-O 3.4Å
2718	H	70	Confident	59.7	Low	8.5 Å²	8.5	58.3 Å²	58.3	4%	0.039	34%	0.338	C	S	.	.			trans	-59	137.4	164.7	-70.7	-66.7	0	0	0	109.5	G2720 I2722 T2739 S2741 D2743 D2745	H2718-G2720 VanDerWaalsContact C-N 3.33Å; H2718-G2720 WeakPolarHBondContact CB-O 3.37Å; H2718-I2722 HydrophobicContact CB-CG1 4.24Å; H2718-I2722 VanDerWaalsContact CD2-CG1 3.48Å; H2718-I2722 WeakPolarHBondContact CD2-CG1 3.39Å; H2718-T2739 PolarHBondContact CD2-OG1 3.01Å; H2718-T2739 PolarHBondContact CE1-O 2.98Å; H2718-T2739 PolarHBondContact NE2-O 3.23Å; H2718-T2739 VanDerWaalsContact NE2-O 3.14Å; H2718-T2739 PolarHBondContact NE2-OG1 2.85Å; H2718-S2741 VanDerWaalsContact CG-CB 3.43Å; H2718-S2741 WeakPolarHBondContact ND1-CB 3.26Å; H2718-D2743 IonicContact ND1-OD1 3.39Å; H2718-D2743 IonicContact ND1-OD2 3.11Å; H2718-D2745 PolarHBondContact CE1-O 3.04Å
2719	T	63.5	Low	61.9	Low	93.5 Å²	93.5	58.2 Å²	58.2	57%	0.574	34%	0.337	S	S	*	.	S	Bend	trans	-84.1	-14.7	176	54.4	0	0	0	0	112.3	Q2717 D2743	Q2717-T2719 PolarHBondContact O-N 2.84Å; T2719-D2743 WeakPolarHBondContact CA-OD2 3.48Å; T2719-D2743 PolarHBondContact N-OD2 3.06Å; T2719-D2743 WeakPolarHBondContact OG1-CB 3.35Å; T2719-D2743 PolarHBondContact OG1-OD2 2.86Å
2720	G	62.3	Low	63.9	Low	17 Å²	17	53.9 Å²	53.9	18%	0.175	31%	0.307	C	S	.	.	S	Bend	trans	-123.2	177.3	172.5	0	0	0	0	0	112.6	H2718 I2722 S2741 D2743 G3124	H2718-G2720 VanDerWaalsContact C-N 3.33Å; H2718-G2720 WeakPolarHBondContact CB-O 3.37Å; G2720-I2722 PolarHBondContact O-N 3.24Å; G2720-S2741 WeakPolarHBondContact CA-OG 3.45Å; G2720-S2741 PolarHBondContact O-OG 2.75Å; G2720-S2741 VanDerWaalsContact O-OG 3.04Å; G2720-D2743 PolarHBondContact N-OD2 2.87Å; G2720-G3124 WeakPolarHBondContact O-CA 3.19Å
2721	P	67.8	Low	66.1	Low	66.5 Å²	66.5	50.8 Å²	50.8	43%	0.432	29%	0.285	S	S	.	.			trans	-63.7	140.9	176.2	22.1	-27.5	0	0	0	111.2	I2723 S2741 V2742 K3105 Q3122	P2721-I2723 PolarHBondContact O-N 2.71Å; P2721-S2741 WeakPolarHBondContact O-CA 3.18Å; P2721-S2741 WeakPolarHBondContact O-CB 3.12Å; P2721-S2741 PolarHBondContact O-OG 2.88Å; P2721-S2741 VanDerWaalsContact O-OG 3.05Å; P2721-V2742 HydrophobicContact CB-CG2 4.38Å; P2721-V2742 HydrophobicContact CG-CB 4.46Å; P2721-V2742 HydrophobicContact CG-CG2 3.57Å; P2721-V2742 VanDerWaalsContact O-CG2 3.24Å; P2721-V2742 WeakPolarHBondContact O-CG2 3.43Å; P2721-V2742 PolarHBondContact O-N 3.21Å; P2721-K3105 HydrophobicContact CB-CG 4.21Å; P2721-Q3122 WeakPolarHBondContact CA-O 3.5Å; P2721-Q3122 HydrophobicContact CB-CG 4.32Å; P2721-Q3122 WeakPolarHBondContact CB-O 3.43Å
2722	I	79.2	Confident	68	Low	17.5 Å²	17.5	53 Å²	53	9%	0.09	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	119.8	175.1	-61.8	168.4	0	0	0	107.7	H2718 G2720 C2724 A2725 T2739 G2740 K3105 C3120 I3126	H2718-I2722 HydrophobicContact CB-CG1 4.24Å; H2718-I2722 VanDerWaalsContact CD2-CG1 3.48Å; H2718-I2722 WeakPolarHBondContact CD2-CG1 3.39Å; G2720-I2722 PolarHBondContact O-N 3.24Å; I2722-C2724 WeakPolarHBondContact CG2-O 3.41Å; I2722-A2725 HydrophobicContact CG2-CB 4.43Å; I2722-T2739 HydrophobicContact CD1-CG2 4.48Å; I2722-T2739 HydrophobicContact CG2-CG2 4.39Å; I2722-G2740 CarbonylContact C-O 3.58Å; I2722-G2740 WeakPolarHBondContact CA-O 3.37Å; I2722-G2740 WeakPolarHBondContact CG2-O 3.07Å; I2722-K3105 WeakPolarHBondContact O-CB 3.46Å; I2722-C3120 HydrophobicContact CB-CB 3.79Å; I2722-C3120 HydrophobicContact CD1-CB 3.99Å; I2722-C3120 HydrophobicContact CG2-CB 3.69Å; I2722-I3126 HydrophobicContact CD1-CD1 4.02Å; I2722-I3126 HydrophobicContact CD1-CG1 3.38Å
2723	I	77.6	Confident	70.2	Confident	66.5 Å²	66.5	50.4 Å²	50.4	34%	0.341	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	-29.7	-177.6	-46.4	170	0	0	0	111.3	P2721 G2740 V2742	P2721-I2723 PolarHBondContact O-N 2.71Å; I2723-G2740 PolarHBondContact N-O 3.13Å; I2723-V2742 HydrophobicContact CD1-CB 4.06Å; I2723-V2742 HydrophobicContact CD1-CG1 4.13Å; I2723-V2742 HydrophobicContact CD1-CG2 3.41Å; I2723-V2742 HydrophobicContact CG1-CB 4.47Å; I2723-V2742 HydrophobicContact CG1-CG2 3.68Å; I2723-V2742 VanDerWaalsContact CG1-CG2 3.49Å
2724	C	79.3	Confident	72.4	Confident	10.5 Å²	10.5	44.1 Å²	44.1	7%	0.071	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	148.6	180	58.6	0	0	0	0	110.6	I2722 G2740 I2802	I2722-C2724 WeakPolarHBondContact CG2-O 3.41Å; C2724-G2740 PolarHBondContact N-O 3.17Å; C2724-G2740 PolarHBondContact O-N 3.1Å; C2724-I2802 PolarHBondContact SG-O 3.44Å
2725	A	86.4	Confident	74.6	Confident	17.5 Å²	17.5	41.5 Å²	41.5	15%	0.145	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	145.2	176.9	0	0	0	0	0	109.7	I2722 I2738 T2739 K3106 V3108 M3118	I2722-A2725 HydrophobicContact CG2-CB 4.43Å; A2725-I2738 CarbonylContact C-O 3.57Å; A2725-I2738 VanDerWaalsContact CA-O 3.27Å; A2725-I2738 WeakPolarHBondContact CA-O 3.2Å; A2725-T2739 HydrophobicContact CB-CG2 3.92Å; A2725-K3106 HydrophobicContact CB-CG 4.45Å; A2725-V3108 HydrophobicContact CB-CG2 4Å; A2725-M3118 HydrophobicContact CB-CE 3.54Å
2726	N	86.7	Confident	76.5	Confident	33.5 Å²	33.5	38.4 Å²	38.4	18%	0.179	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	165.7	176.3	-149.3	-23.8	0	0	0	110.7	I2738 I2805 T2807	N2726-I2738 PolarHBondContact N-O 2.94Å; N2726-I2738 PolarHBondContact O-N 3.05Å; N2726-I2805 HydrophobicContact CB-CB 4.47Å; N2726-I2805 HydrophobicContact CB-CG2 3.99Å; N2726-I2805 PolarHBondContact ND2-O 3.49Å; N2726-I2805 VanDerWaalsContact ND2-O 3.12Å; N2726-T2807 HydrophobicContact CB-CG2 4.27Å; N2726-T2807 VanDerWaalsContact CG-OG1 3.3Å; N2726-T2807 PolarHBondContact ND2-N 2.86Å; N2726-T2807 PolarHBondContact ND2-OG1 2.89Å; N2726-T2807 PolarHBondContact OD1-OG1 3.21Å
2727	Y	85.6	Confident	77.7	Confident	65.5 Å²	65.5	37.7 Å²	37.7	26%	0.257	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	144.9	-179.8	-2.4	-85.5	0	0	0	111.6	Q2735 L2736 C2737 V2751 Y2785 T2807 V3108 T3109 F3110	Y2727-Q2735 HydrophobicContact CD1-CB 4.45Å; Y2727-L2736 CarbonylContact C-O 3.59Å; Y2727-L2736 VanDerWaalsContact CA-O 3.24Å; Y2727-L2736 WeakPolarHBondContact CA-O 3.36Å; Y2727-C2737 HydrophobicContact CD1-CB 3.83Å; Y2727-C2737 HydrophobicContact CE1-CB 3.47Å; Y2727-C2737 VanDerWaalsContact CE1-CB 3.47Å; Y2727-V2751 HydrophobicContact CE1-CG2 4.2Å; Y2727-Y2785 HydrophobicContact CE1-CE1 4.41Å; Y2727-Y2785 PolarHBondContact OH-OH 2.97Å; Y2727-T2807 WeakPolarHBondContact O-CB 3.4Å; Y2727-T2807 PolarHBondContact O-OG1 2.79Å; Y2727-V3108 HydrophobicContact CD1-CG1 3.81Å; Y2727-V3108 HydrophobicContact CE1-CG1 4.23Å; Y2727-T3109 WeakPolarHBondContact CE1-O 3.44Å; Y2727-F3110 HydrophobicContact CD1-CB 3.56Å; Y2727-F3110 HydrophobicContact CD2-CB 3.66Å; Y2727-F3110 HydrophobicContact CE1-CB 3.78Å; Y2727-F3110 HydrophobicContact CE2-CB 3.87Å; Y2727-F3110 HydrophobicContact CG-CB 3.5Å; Y2727-F3110 VanDerWaalsContact CG-CB 3.5Å
2728	L	83.4	Confident	78.9	Confident	8 Å²	8	34.7 Å²	34.7	4%	0.042	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	118.1	172.8	-170.4	79.1	0	0	0	109.1	V2730 L2736 T2807 Y2821	L2728-V2730 PolarHBondContact O-N 2.68Å; L2728-L2736 HydrophobicContact CB-CB 4.29Å; L2728-L2736 HydrophobicContact CD2-CD1 4.35Å; L2728-L2736 PolarHBondContact N-O 3.08Å; L2728-L2736 PolarHBondContact O-N 2.92Å; L2728-T2807 HydrophobicContact CB-CG2 4.42Å; L2728-T2807 HydrophobicContact CD1-CG2 4.37Å; L2728-Y2821 HydrophobicContact CD1-CD1 3.95Å; L2728-Y2821 HydrophobicContact CD2-CD1 3.57Å; L2728-Y2821 HydrophobicContact CD2-CE1 4.3Å; L2728-Y2821 HydrophobicContact CD2-CG 4.03Å; L2728-Y2821 HydrophobicContact CG-CD1 3.85Å; L2728-Y2821 HydrophobicContact CG-CE1 4.4Å
2729	N	80.6	Confident	79.8	Confident	74 Å²	74	34.6 Å²	34.6	40%	0.396	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	111.7	175	-72.6	-28.5	0	0	0	109.7	Q2735	N2729-Q2735 VanDerWaalsContact OD1-CD 3.24Å; N2729-Q2735 WeakPolarHBondContact OD1-CG 3.49Å; N2729-Q2735 PolarHBondContact OD1-NE2 2.92Å
2730	V	78.4	Confident	80.9	Confident	6.5 Å²	6.5	30.1 Å²	30.1	4%	0.039	16%	0.159	C	C	.	.			trans	-90.2	-63	175.4	178.5	0	0	0	0	109.6	L2728 L2734 L2736 L2849 I2853	L2728-V2730 PolarHBondContact O-N 2.68Å; V2730-L2734 HydrophobicContact CG1-CD2 4.46Å; V2730-L2734 PolarHBondContact N-O 2.92Å; V2730-L2736 HydrophobicContact CG2-CD1 4.15Å; V2730-L2736 HydrophobicContact CG2-CG 4.1Å; V2730-L2849 HydrophobicContact CG1-CD2 3.88Å; V2730-L2849 HydrophobicContact CG1-CG 4.29Å; V2730-I2853 HydrophobicContact CB-CD1 4.16Å; V2730-I2853 HydrophobicContact CG1-CD1 3.33Å; V2730-I2853 HydrophobicContact CG1-CG1 4.46Å; V2730-I2853 HydrophobicContact CG2-CD1 3.7Å
2731	T	76.7	Confident	81.8	Confident	17 Å²	17	29.3 Å²	29.3	10%	0.104	15%	0.151	C	C	.	.	S	Bend	trans	-125.3	179.8	176.3	65.3	0	0	0	0	109.7	N2733 L2734 E2846 L2849 E2850	T2731-N2733 PolarHBondContact O-N 2.98Å; T2731-N2733 PolarHBondContact OG1-N 2.97Å; T2731-L2734 PolarHBondContact N-O 3.38Å; T2731-L2734 VanDerWaalsContact N-O 3.13Å; T2731-L2734 WeakPolarHBondContact OG1-CB 3.2Å; T2731-L2734 PolarHBondContact OG1-N 3.06Å; T2731-E2846 HydrophobicContact CG2-CB 4.33Å; T2731-L2849 HydrophobicContact CG2-CD2 3.73Å; T2731-E2850 HydrophobicContact CG2-CG 3.83Å; T2731-E2850 PolarHBondContact OG1-OE1 2.93Å
2732	K	72.6	Confident	82.1	Confident	170.5 Å²	170.5	29.4 Å²	29.4	74%	0.741	15%	0.15	S	C	*	.	S	Bend	trans	-66.3	-22.2	170.3	-69.9	-178.3	179.9	175.7	0	112.8
2733	N	76.6	Confident	81.7	Confident	37.5 Å²	37.5	29.6 Å²	29.6	20%	0.201	15%	0.151	C	C	.	.	S	Bend	trans	-103	-33.6	-175.9	-53.1	-30.8	0	0	0	112.9	T2731 Y2752 D2753 T2756	T2731-N2733 PolarHBondContact O-N 2.98Å; T2731-N2733 PolarHBondContact OG1-N 2.97Å; N2733-Y2752 CarbonylContact O-C 3.57Å; N2733-Y2752 VanDerWaalsContact O-CA 3.3Å; N2733-Y2752 WeakPolarHBondContact O-CA 3.2Å; N2733-D2753 PolarHBondContact O-N 2.94Å; N2733-D2753 VanDerWaalsContact O-N 3.09Å; N2733-T2756 PolarHBondContact ND2-OG1 2.92Å; N2733-T2756 PolarHBondContact OD1-OG1 3.49Å
2734	L	81.4	Confident	81.7	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	120.7	-178.4	179.7	67.6	0	0	0	110.8	V2730 T2731 A2750 Y2752 E2850 L2854	V2730-L2734 HydrophobicContact CG1-CD2 4.46Å; V2730-L2734 PolarHBondContact N-O 2.92Å; T2731-L2734 PolarHBondContact N-O 3.38Å; T2731-L2734 VanDerWaalsContact N-O 3.13Å; T2731-L2734 WeakPolarHBondContact OG1-CB 3.2Å; T2731-L2734 PolarHBondContact OG1-N 3.06Å; L2734-A2750 HydrophobicContact CD1-CB 3.88Å; L2734-Y2752 HydrophobicContact CD1-CD1 4.23Å; L2734-Y2752 HydrophobicContact CD1-CE1 3.77Å; L2734-Y2752 HydrophobicContact CD1-CE2 4.44Å; L2734-E2850 HydrophobicContact CB-CG 3.7Å; L2734-E2850 HydrophobicContact CD2-CB 3.89Å; L2734-E2850 HydrophobicContact CD2-CG 3.8Å; L2734-E2850 HydrophobicContact CG-CG 4.39Å; L2734-L2854 HydrophobicContact CD1-CD2 4.4Å; L2734-L2854 HydrophobicContact CD2-CG 4.4Å
2735	Q	84.2	Confident	81.8	Confident	14.5 Å²	14.5	26.2 Å²	26.2	7%	0.068	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	139.9	169.4	-54.4	-175.8	-35.6	0	0	109.2	Y2727 N2729 V2751	Y2727-Q2735 HydrophobicContact CD1-CB 4.45Å; N2729-Q2735 VanDerWaalsContact OD1-CD 3.24Å; N2729-Q2735 WeakPolarHBondContact OD1-CG 3.49Å; N2729-Q2735 PolarHBondContact OD1-NE2 2.92Å; Q2735-V2751 HydrophobicContact CB-CB 4.28Å; Q2735-V2751 PolarHBondContact N-O 3.26Å; Q2735-V2751 WeakPolarHBondContact O-CB 3.35Å; Q2735-V2751 PolarHBondContact O-N 3.15Å
2736	L	86.7	Confident	81.8	Confident	1 Å²	1	25.4 Å²	25.4	1%	0.005	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	116.9	172	-63.8	179.2	0	0	0	109	Y2727 L2728 V2730 I2748 W2749 A2750 L2788 I2853 F2857	Y2727-L2736 CarbonylContact C-O 3.59Å; Y2727-L2736 VanDerWaalsContact CA-O 3.24Å; Y2727-L2736 WeakPolarHBondContact CA-O 3.36Å; L2728-L2736 HydrophobicContact CB-CB 4.29Å; L2728-L2736 HydrophobicContact CD2-CD1 4.35Å; L2728-L2736 PolarHBondContact N-O 3.08Å; L2728-L2736 PolarHBondContact O-N 2.92Å; V2730-L2736 HydrophobicContact CG2-CD1 4.15Å; V2730-L2736 HydrophobicContact CG2-CG 4.1Å; L2736-I2748 HydrophobicContact CB-CG2 4.4Å; L2736-I2748 HydrophobicContact CD2-CG2 4.25Å; L2736-W2749 CarbonylContact C-O 3.5Å; L2736-W2749 VanDerWaalsContact CA-O 3.29Å; L2736-W2749 WeakPolarHBondContact CA-O 3.35Å; L2736-A2750 HydrophobicContact CD2-CB 4.49Å; L2736-L2788 HydrophobicContact CD2-CD1 3.58Å; L2736-I2853 HydrophobicContact CD1-CG2 3.77Å; L2736-I2853 HydrophobicContact CD2-CG2 4.38Å; L2736-I2853 HydrophobicContact CG-CG2 4.44Å; L2736-F2857 HydrophobicContact CD1-CD2 4.45Å; L2736-F2857 HydrophobicContact CD1-CE2 3.84Å
2737	C	87.4	Confident	81.8	Confident	3.5 Å²	3.5	23.8 Å²	23.8	2%	0.024	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	135.7	168.7	-121.8	0	0	0	0	108.7	Y2727 I2748 W2749 V2751 Y2785 M3118 F3128	Y2727-C2737 HydrophobicContact CD1-CB 3.83Å; Y2727-C2737 HydrophobicContact CE1-CB 3.47Å; Y2727-C2737 VanDerWaalsContact CE1-CB 3.47Å; C2737-I2748 CarbonylContact O-C 3.58Å; C2737-I2748 WeakPolarHBondContact O-CA 3.36Å; C2737-W2749 HydrophobicContact CB-CB 4.18Å; C2737-W2749 PolarHBondContact N-O 3.12Å; C2737-W2749 VanDerWaalsContact O-CD1 3.24Å; C2737-W2749 PolarHBondContact O-N 3.04Å; C2737-V2751 HydrophobicContact CB-CG2 4.06Å; C2737-V2751 VanDerWaalsContact SG-CG2 3.5Å; C2737-Y2785 HydrophobicContact CB-CE1 4.15Å; C2737-M3118 HydrophobicContact CB-SD 3.86Å; C2737-F3128 HydrophobicContact CB-CZ 4.28Å
2738	I	90	Very high	81.9	Confident	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	124.1	-177.5	-50.6	178.7	0	0	0	107.1	A2725 N2726 C2746 I2747 I2748 I2805 T2807 I2823	A2725-I2738 CarbonylContact C-O 3.57Å; A2725-I2738 VanDerWaalsContact CA-O 3.27Å; A2725-I2738 WeakPolarHBondContact CA-O 3.2Å; N2726-I2738 PolarHBondContact N-O 2.94Å; N2726-I2738 PolarHBondContact O-N 3.05Å; I2738-C2746 WeakPolarHBondContact CG2-SG 3.2Å; I2738-I2747 WeakPolarHBondContact CA-O 3.25Å; I2738-I2748 HydrophobicContact CG1-CG1 4.32Å; I2738-I2748 HydrophobicContact CG1-CG2 4.43Å; I2738-I2748 HydrophobicContact CG2-CG1 4.22Å; I2738-I2805 HydrophobicContact CB-CG2 4.23Å; I2738-I2805 HydrophobicContact CG2-CD1 4.06Å; I2738-I2805 HydrophobicContact CG2-CG2 3.95Å; I2738-T2807 HydrophobicContact CD1-CG2 3.78Å; I2738-I2823 HydrophobicContact CD1-CB 4.28Å; I2738-I2823 HydrophobicContact CD1-CD1 3.6Å; I2738-I2823 HydrophobicContact CD1-CG1 3.72Å; I2738-I2823 HydrophobicContact CD1-CG2 3.56Å
2739	T	88.9	Confident	82	Confident	6 Å²	6	22 Å²	22	4%	0.037	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	138.3	-177.2	59.4	0	0	0	0	111.5	H2718 I2722 A2725 C2746 I2747 W2749 M3118 I3126	H2718-T2739 PolarHBondContact CD2-OG1 3.01Å; H2718-T2739 PolarHBondContact CE1-O 2.98Å; H2718-T2739 PolarHBondContact NE2-O 3.23Å; H2718-T2739 VanDerWaalsContact NE2-O 3.14Å; H2718-T2739 PolarHBondContact NE2-OG1 2.85Å; I2722-T2739 HydrophobicContact CD1-CG2 4.48Å; I2722-T2739 HydrophobicContact CG2-CG2 4.39Å; A2725-T2739 HydrophobicContact CB-CG2 3.92Å; T2739-C2746 CarbonylContact O-C 3.44Å; T2739-C2746 VanDerWaalsContact O-CA 3.3Å; T2739-C2746 WeakPolarHBondContact O-CA 3.19Å; T2739-I2747 PolarHBondContact N-O 2.93Å; T2739-I2747 PolarHBondContact O-N 3.06Å; T2739-W2749 PolarHBondContact OG1-NE1 2.9Å; T2739-M3118 HydrophobicContact CG2-SD 4.19Å; T2739-I3126 HydrophobicContact CG2-CD1 3.43Å; T2739-I3126 VanDerWaalsContact CG2-CD1 3.43Å; T2739-I3126 HydrophobicContact CG2-CG1 4.22Å
2740	G	86.4	Confident	82.2	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	137.9	178.5	0	0	0	0	0	111.7	I2722 I2723 C2724 I2805	I2722-G2740 CarbonylContact C-O 3.58Å; I2722-G2740 WeakPolarHBondContact CA-O 3.37Å; I2722-G2740 WeakPolarHBondContact CG2-O 3.07Å; I2723-G2740 PolarHBondContact N-O 3.13Å; C2724-G2740 PolarHBondContact N-O 3.17Å; C2724-G2740 PolarHBondContact O-N 3.1Å; G2740-I2805 VanDerWaalsContact N-CD1 3.32Å
2741	S	81.6	Confident	82.2	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	165.9	-175.4	178.8	0	0	0	0	113.1	H2718 G2720 P2721 D2743 G2744 D2745 I2802	H2718-S2741 VanDerWaalsContact CG-CB 3.43Å; H2718-S2741 WeakPolarHBondContact ND1-CB 3.26Å; G2720-S2741 WeakPolarHBondContact CA-OG 3.45Å; G2720-S2741 PolarHBondContact O-OG 2.75Å; G2720-S2741 VanDerWaalsContact O-OG 3.04Å; P2721-S2741 WeakPolarHBondContact O-CA 3.18Å; P2721-S2741 WeakPolarHBondContact O-CB 3.12Å; P2721-S2741 PolarHBondContact O-OG 2.88Å; P2721-S2741 VanDerWaalsContact O-OG 3.05Å; S2741-D2743 VanDerWaalsContact CB-OD1 3.26Å; S2741-D2743 WeakPolarHBondContact CB-OD1 3.3Å; S2741-D2743 PolarHBondContact O-N 3Å; S2741-D2743 PolarHBondContact OG-N 3.32Å; S2741-G2744 PolarHBondContact O-N 2.92Å; S2741-G2744 VanDerWaalsContact O-N 3.12Å; S2741-D2745 PolarHBondContact N-O 3.21Å; S2741-I2802 PolarHBondContact O-N 2.61Å; S2741-I2802 VanDerWaalsContact O-N 3.11Å
2742	V	73.5	Confident	82.2	Confident	68 Å²	68	19.4 Å²	19.4	41%	0.412	9%	0.094	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-24	171.9	-160.2	0	0	0	0	112.3	P2721 I2723 G2744	P2721-V2742 HydrophobicContact CB-CG2 4.38Å; P2721-V2742 HydrophobicContact CG-CB 4.46Å; P2721-V2742 HydrophobicContact CG-CG2 3.57Å; P2721-V2742 VanDerWaalsContact O-CG2 3.24Å; P2721-V2742 WeakPolarHBondContact O-CG2 3.43Å; P2721-V2742 PolarHBondContact O-N 3.21Å; I2723-V2742 HydrophobicContact CD1-CB 4.06Å; I2723-V2742 HydrophobicContact CD1-CG1 4.13Å; I2723-V2742 HydrophobicContact CD1-CG2 3.41Å; I2723-V2742 HydrophobicContact CG1-CB 4.47Å; I2723-V2742 HydrophobicContact CG1-CG2 3.68Å; I2723-V2742 VanDerWaalsContact CG1-CG2 3.49Å; V2742-G2744 PolarHBondContact O-N 3.12Å; V2742-G2744 VanDerWaalsContact O-N 3.15Å
2743	D	71.7	Confident	81.8	Confident	21.5 Å²	21.5	13.1 Å²	13.1	12%	0.115	7%	0.068	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-4.3	177.7	66.4	8.8	0	0	0	114	H2718 T2719 G2720 S2741 D2745 R2790 R2799	H2718-D2743 IonicContact ND1-OD1 3.39Å; H2718-D2743 IonicContact ND1-OD2 3.11Å; T2719-D2743 WeakPolarHBondContact CA-OD2 3.48Å; T2719-D2743 PolarHBondContact N-OD2 3.06Å; T2719-D2743 WeakPolarHBondContact OG1-CB 3.35Å; T2719-D2743 PolarHBondContact OG1-OD2 2.86Å; G2720-D2743 PolarHBondContact N-OD2 2.87Å; S2741-D2743 VanDerWaalsContact CB-OD1 3.26Å; S2741-D2743 WeakPolarHBondContact CB-OD1 3.3Å; S2741-D2743 PolarHBondContact O-N 3Å; S2741-D2743 PolarHBondContact OG-N 3.32Å; D2743-D2745 VanDerWaalsContact C-N 3.32Å; D2743-D2745 WeakPolarHBondContact OD1-CB 3.36Å; D2743-D2745 PolarHBondContact OD1-N 3.13Å; D2743-R2790 IonicContact OD2-NH2 2.64Å; D2743-R2799 VanDerWaalsContact O-CB 3.29Å; D2743-R2799 WeakPolarHBondContact O-CB 3.34Å; D2743-R2799 WeakPolarHBondContact O-CD 3.06Å; D2743-R2799 PolarHBondContact O-NH1 2.83Å
2744	G	76.6	Confident	80.8	Confident	4.5 Å²	4.5	13.5 Å²	13.5	5%	0.046	7%	0.074	C	C	.	.	S	Bend	trans	78.9	14	178.7	0	0	0	0	0	114.1	S2741 V2742 Y2800	S2741-G2744 PolarHBondContact O-N 2.92Å; S2741-G2744 VanDerWaalsContact O-N 3.12Å; V2742-G2744 PolarHBondContact O-N 3.12Å; V2742-G2744 VanDerWaalsContact O-N 3.15Å; G2744-Y2800 WeakPolarHBondContact CA-O 3.38Å
2745	D	82.8	Confident	79.2	Confident	1 Å²	1	18.3 Å²	18.3	1%	0.005	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	144.8	177.8	-59.9	-26.3	0	0	0	111.4	H2718 S2741 D2743 R2790 T2792 R2799 I2802	H2718-D2745 PolarHBondContact CE1-O 3.04Å; S2741-D2745 PolarHBondContact N-O 3.21Å; D2743-D2745 VanDerWaalsContact C-N 3.32Å; D2743-D2745 WeakPolarHBondContact OD1-CB 3.36Å; D2743-D2745 PolarHBondContact OD1-N 3.13Å; D2745-R2790 HydrophobicContact CB-CG 4.17Å; D2745-R2790 IonicContact OD2-CZ 3.2Å; D2745-R2790 IonicContact OD2-NE 3.75Å; D2745-R2790 PolarHBondContact OD2-NE 2.74Å; D2745-R2790 IonicContact OD2-NH2 3.31Å; D2745-R2790 PolarHBondContact OD2-NH2 2.99Å; D2745-T2792 HydrophobicContact CB-CG2 4.2Å; D2745-T2792 VanDerWaalsContact CG-CG2 3.47Å; D2745-T2792 VanDerWaalsContact OD1-CB 3.3Å; D2745-T2792 WeakPolarHBondContact OD1-CB 3.26Å; D2745-T2792 WeakPolarHBondContact OD1-CG2 3.38Å; D2745-R2799 WeakPolarHBondContact OD1-CD 3.39Å; D2745-R2799 IonicContact OD1-CZ 3.01Å; D2745-R2799 IonicContact OD1-NE 3.4Å; D2745-R2799 PolarHBondContact OD1-NE 2.87Å; D2745-R2799 IonicContact OD1-NH1 2.69Å; D2745-R2799 PolarHBondContact OD1-NH1 3.04Å; D2745-R2799 IonicContact OD1-NH2 3.89Å; D2745-R2799 IonicContact OD2-CZ 2.73Å; D2745-R2799 IonicContact OD2-NH1 3.59Å; D2745-R2799 PolarHBondContact OD2-NH1 2.74Å; D2745-I2802 VanDerWaalsContact O-CD1 3.24Å; D2745-I2802 WeakPolarHBondContact O-CD1 3.45Å
2746	C	86.3	Confident	77.2	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	132.5	173.9	-172.9	0	0	0	0	108.4	I2738 T2739 R2790 L2791 I2802 I2825	I2738-C2746 WeakPolarHBondContact CG2-SG 3.2Å; T2739-C2746 CarbonylContact O-C 3.44Å; T2739-C2746 VanDerWaalsContact O-CA 3.3Å; T2739-C2746 WeakPolarHBondContact O-CA 3.19Å; C2746-R2790 CarbonylContact O-C 3.56Å; C2746-R2790 VanDerWaalsContact O-CA 3.31Å; C2746-R2790 WeakPolarHBondContact O-CA 3.36Å; C2746-L2791 HydrophobicContact CB-CB 4.26Å; C2746-L2791 PolarHBondContact N-O 3.24Å; C2746-L2791 PolarHBondContact O-N 3.09Å; C2746-I2802 HydrophobicContact CB-CD1 3.38Å; C2746-I2802 VanDerWaalsContact N-CD1 3.3Å; C2746-I2825 HydrophobicContact CB-CD1 4.34Å
2747	I	87.1	Confident	74.7	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	131.3	175.2	-57.2	173.6	0	0	0	109	L2716 I2738 T2739 W2749 P2787 I2789 R2790	L2716-I2747 HydrophobicContact CB-CD1 4.3Å; L2716-I2747 HydrophobicContact CB-CG2 4.45Å; L2716-I2747 HydrophobicContact CD2-CG2 4.16Å; I2738-I2747 WeakPolarHBondContact CA-O 3.25Å; T2739-I2747 PolarHBondContact N-O 2.93Å; T2739-I2747 PolarHBondContact O-N 3.06Å; I2747-W2749 HydrophobicContact CB-CZ2 3.99Å; I2747-W2749 HydrophobicContact CD1-CZ2 4.08Å; I2747-W2749 HydrophobicContact CG2-CD2 3.94Å; I2747-W2749 HydrophobicContact CG2-CG 4.42Å; I2747-W2749 HydrophobicContact CG2-CH2 4.25Å; I2747-W2749 HydrophobicContact CG2-CZ2 3.52Å; I2747-W2749 PolarHBondContact O-NE1 3.48Å; I2747-P2787 HydrophobicContact CG2-CB 4.47Å; I2747-I2789 WeakPolarHBondContact CA-O 3.22Å; I2747-R2790 HydrophobicContact CG1-CB 4.1Å; I2747-R2790 HydrophobicContact CG1-CG 4.01Å
2748	I	87.6	Confident	72.3	Confident	0.5 Å²	0.5	34.5 Å²	34.5	0%	0.003	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	130.1	174.4	-55.5	175.7	0	0	0	108.6	L2736 C2737 I2738 L2788 I2789 L2791 F2857	L2736-I2748 HydrophobicContact CB-CG2 4.4Å; L2736-I2748 HydrophobicContact CD2-CG2 4.25Å; C2737-I2748 CarbonylContact O-C 3.58Å; C2737-I2748 WeakPolarHBondContact O-CA 3.36Å; I2738-I2748 HydrophobicContact CG1-CG1 4.32Å; I2738-I2748 HydrophobicContact CG1-CG2 4.43Å; I2738-I2748 HydrophobicContact CG2-CG1 4.22Å; I2748-L2788 HydrophobicContact CG2-CD1 4.3Å; I2748-L2788 PolarHBondContact O-N 3.16Å; I2748-I2789 HydrophobicContact CB-CG2 3.94Å; I2748-I2789 HydrophobicContact CD1-CG2 3.88Å; I2748-I2789 HydrophobicContact CG1-CG2 4.1Å; I2748-I2789 PolarHBondContact N-O 2.97Å; I2748-L2791 HydrophobicContact CD1-CD1 3.99Å; I2748-F2857 HydrophobicContact CD1-CD1 3.95Å; I2748-F2857 HydrophobicContact CD1-CE1 3.46Å; I2748-F2857 VanDerWaalsContact CD1-CE1 3.46Å; I2748-F2857 HydrophobicContact CD1-CZ 3.92Å
2749	W	85.8	Confident	69.5	Low	36 Å²	36	39.2 Å²	39.2	14%	0.136	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	131.8	-174.8	-48.8	82.5	0	0	0	109.8	L2716 L2736 C2737 T2739 I2747 Y2785 Q2786 P2787 I3126	L2716-W2749 WeakPolarHBondContact O-CH2 3.38Å; L2736-W2749 CarbonylContact C-O 3.5Å; L2736-W2749 VanDerWaalsContact CA-O 3.29Å; L2736-W2749 WeakPolarHBondContact CA-O 3.35Å; C2737-W2749 HydrophobicContact CB-CB 4.18Å; C2737-W2749 PolarHBondContact N-O 3.12Å; C2737-W2749 VanDerWaalsContact O-CD1 3.24Å; C2737-W2749 PolarHBondContact O-N 3.04Å; T2739-W2749 PolarHBondContact OG1-NE1 2.9Å; I2747-W2749 HydrophobicContact CB-CZ2 3.99Å; I2747-W2749 HydrophobicContact CD1-CZ2 4.08Å; I2747-W2749 HydrophobicContact CG2-CD2 3.94Å; I2747-W2749 HydrophobicContact CG2-CG 4.42Å; I2747-W2749 HydrophobicContact CG2-CH2 4.25Å; I2747-W2749 HydrophobicContact CG2-CZ2 3.52Å; I2747-W2749 PolarHBondContact O-NE1 3.48Å; W2749-Y2785 HydrophobicContact CB-CD1 4.37Å; W2749-Q2786 CarbonylContact C-O 3.59Å; W2749-Q2786 WeakPolarHBondContact CA-O 3.48Å; W2749-P2787 HydrophobicContact CD2-CB 4.5Å; W2749-P2787 HydrophobicContact CE3-CB 3.77Å; W2749-P2787 HydrophobicContact CE3-CG 4.41Å; W2749-P2787 HydrophobicContact CH2-CB 4.48Å; W2749-P2787 HydrophobicContact CZ3-CB 3.75Å; W2749-P2787 HydrophobicContact CZ3-CG 4.14Å; W2749-I3126 HydrophobicContact CD2-CD1 4.18Å; W2749-I3126 VanDerWaalsContact CE2-CD1 3.41Å; W2749-I3126 HydrophobicContact CG-CD1 4.49Å; W2749-I3126 HydrophobicContact CH2-CD1 4.45Å; W2749-I3126 HydrophobicContact CZ2-CD1 3.59Å; W2749-I3126 VanDerWaalsContact NE1-CD1 3.32Å
2750	A	83.3	Confident	66.8	Low	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	129.4	166.4	0	0	0	0	0	110	L2734 L2736 Y2752 Y2785 Q2786 L2788 L2854	L2734-A2750 HydrophobicContact CD1-CB 3.88Å; L2736-A2750 HydrophobicContact CD2-CB 4.49Å; A2750-Y2752 HydrophobicContact CB-CE2 4.01Å; A2750-Y2785 CarbonylContact O-C 3.54Å; A2750-Y2785 VanDerWaalsContact O-CA 3.32Å; A2750-Y2785 WeakPolarHBondContact O-CA 3.43Å; A2750-Q2786 HydrophobicContact CB-CB 4.44Å; A2750-Q2786 PolarHBondContact N-O 2.94Å; A2750-Q2786 PolarHBondContact O-N 3.04Å; A2750-Q2786 VanDerWaalsContact O-N 3.09Å; A2750-L2788 HydrophobicContact CB-CD1 4.01Å; A2750-L2788 HydrophobicContact CB-CD2 3.97Å; A2750-L2788 HydrophobicContact CB-CG 3.97Å; A2750-L2854 HydrophobicContact CB-CD2 3.98Å
2751	V	79.8	Confident	64.1	Low	1.5 Å²	1.5	53.9 Å²	53.9	1%	0.009	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	122.3	176.4	-173.8	0	0	0	0	108.5	Y2727 Q2735 C2737 Y2785 F3128	Y2727-V2751 HydrophobicContact CE1-CG2 4.2Å; Q2735-V2751 HydrophobicContact CB-CB 4.28Å; Q2735-V2751 PolarHBondContact N-O 3.26Å; Q2735-V2751 WeakPolarHBondContact O-CB 3.35Å; Q2735-V2751 PolarHBondContact O-N 3.15Å; C2737-V2751 HydrophobicContact CB-CG2 4.06Å; C2737-V2751 VanDerWaalsContact SG-CG2 3.5Å; V2751-Y2785 HydrophobicContact CB-CD1 4.24Å; V2751-Y2785 HydrophobicContact CB-CE1 4.15Å; V2751-Y2785 HydrophobicContact CG1-CD1 4.12Å; V2751-Y2785 HydrophobicContact CG1-CD2 4.03Å; V2751-Y2785 HydrophobicContact CG1-CE1 3.69Å; V2751-Y2785 HydrophobicContact CG1-CE2 3.65Å; V2751-Y2785 HydrophobicContact CG1-CG 4.4Å; V2751-Y2785 HydrophobicContact CG2-CD1 3.51Å; V2751-Y2785 HydrophobicContact CG2-CD2 4.44Å; V2751-Y2785 HydrophobicContact CG2-CE1 3.52Å; V2751-Y2785 HydrophobicContact CG2-CE2 4.37Å; V2751-Y2785 HydrophobicContact CG2-CG 3.99Å; V2751-F3128 HydrophobicContact CG2-CE1 4.24Å; V2751-F3128 HydrophobicContact CG2-CZ 4Å
2752	Y	75.4	Confident	61.7	Low	42 Å²	42	59.4 Å²	59.4	17%	0.165	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	130.4	177.5	-62.6	-84.7	0	0	0	111.8	N2733 L2734 A2750 S2754 T2784 L2854	N2733-Y2752 CarbonylContact O-C 3.57Å; N2733-Y2752 VanDerWaalsContact O-CA 3.3Å; N2733-Y2752 WeakPolarHBondContact O-CA 3.2Å; L2734-Y2752 HydrophobicContact CD1-CD1 4.23Å; L2734-Y2752 HydrophobicContact CD1-CE1 3.77Å; L2734-Y2752 HydrophobicContact CD1-CE2 4.44Å; A2750-Y2752 HydrophobicContact CB-CE2 4.01Å; Y2752-S2754 PolarHBondContact O-N 3.05Å; Y2752-T2784 PolarHBondContact N-O 2.91Å; Y2752-L2854 WeakPolarHBondContact OH-CD1 3.39Å; Y2752-L2854 VanDerWaalsContact OH-CD2 3.29Å; Y2752-L2854 WeakPolarHBondContact OH-CD2 2.94Å
2753	D	64.9	Low	59.6	Low	38.5 Å²	38.5	64.5 Å²	64.5	21%	0.206	36%	0.357	C	S	.	.			trans	-75.8	122	170.2	-87.8	-4	0	0	0	110.4	N2733 S2755 K3116	N2733-D2753 PolarHBondContact O-N 2.94Å; N2733-D2753 VanDerWaalsContact O-N 3.09Å; D2753-S2755 PolarHBondContact O-N 2.92Å; D2753-S2755 VanDerWaalsContact O-N 3.09Å; D2753-K3116 IonicContact OD1-NZ 3.14Å; D2753-K3116 PolarHBondContact OD1-NZ 3.46Å; D2753-K3116 IonicContact OD2-NZ 2.8Å; D2753-K3116 PolarHBondContact OD2-NZ 2.86Å
2754	S	54.7	Low	57.6	Low	45.5 Å²	45.5	67.8 Å²	67.8	32%	0.318	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-64	-6.3	-170.2	56.7	0	0	0	0	115.8	Y2752 T2756 T2781	Y2752-S2754 PolarHBondContact O-N 3.05Å; S2754-T2756 VanDerWaalsContact C-N 3.28Å; S2754-T2756 PolarHBondContact O-N 3.24Å; S2754-T2781 WeakPolarHBondContact OG-CB 3.43Å
2755	S	49.6	Very low	55.2	Low	99.5 Å²	99.5	74 Å²	74	70%	0.696	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-70.5	-15.7	-171.7	64.2	0	0	0	0	114.9	D2753	D2753-S2755 PolarHBondContact O-N 2.92Å; D2753-S2755 VanDerWaalsContact O-N 3.09Å
2756	T	41.2	Very low	52.5	Low	80 Å²	80	80.4 Å²	80.4	49%	0.491	46%	0.463	S	S	.	.	S	Bend	trans	-137.7	14.7	-174.8	46.8	0	0	0	0	115.5	N2733 S2754 Q2758	N2733-T2756 PolarHBondContact ND2-OG1 2.92Å; N2733-T2756 PolarHBondContact OD1-OG1 3.49Å; S2754-T2756 VanDerWaalsContact C-N 3.28Å; S2754-T2756 PolarHBondContact O-N 3.24Å; T2756-Q2758 VanDerWaalsContact C-N 3.34Å; T2756-Q2758 PolarHBondContact O-N 2.84Å
2757	S	35.1	Very low	49.7	Very low	96 Å²	96	86.8 Å²	86.8	67%	0.671	50%	0.503	S	S	*	.			trans	-68.6	51.5	-178	65.6	0	0	0	0	115	S2759	S2757-S2759 VanDerWaalsContact C-N 3.34Å; S2757-S2759 PolarHBondContact O-N 2.96Å
2758	Q	35.3	Very low	46.9	Very low	185 Å²	185	93.1 Å²	93.1	86%	0.864	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	46.8	167.1	-76.5	-170.1	-6.6	0	0	112.2	T2756 I2760	T2756-Q2758 VanDerWaalsContact C-N 3.34Å; T2756-Q2758 PolarHBondContact O-N 2.84Å; Q2758-I2760 PolarHBondContact O-N 2.99Å
2759	S	33	Very low	44	Very low	98.5 Å²	98.5	99.1 Å²	99.1	69%	0.689	58%	0.578	S	S	*	*	S	Bend	trans	-45.6	29.5	171.3	67.3	0	0	0	0	117.7	S2757 K2761	S2757-S2759 VanDerWaalsContact C-N 3.34Å; S2757-S2759 PolarHBondContact O-N 2.96Å; S2759-K2761 VanDerWaalsContact C-N 3.26Å; S2759-K2761 PolarHBondContact O-N 3.15Å; S2759-K2761 VanDerWaalsContact O-N 3.12Å
2760	I	31.2	Very low	41.3	Very low	130.5 Å²	130.5	103.6 Å²	103.6	67%	0.669	61%	0.61	S	S	*	*			trans	-78.8	90.5	163.7	-55.8	176.8	0	0	0	106.8	Q2758 P2762	Q2758-I2760 PolarHBondContact O-N 2.99Å; I2760-P2762 VanDerWaalsContact O-CD 3.28Å; I2760-P2762 WeakPolarHBondContact O-CD 3.3Å; I2760-P2762 VanDerWaalsContact O-N 3.16Å
2761	K	30.6	Very low	38.8	Very low	182.5 Å²	182.5	110.1 Å²	110.1	79%	0.793	65%	0.65	S	S	*	*			trans	-65.8	116.4	172.1	-78.9	179.8	178	174.6	0	107.8	S2759 M2763	S2759-K2761 VanDerWaalsContact C-N 3.26Å; S2759-K2761 PolarHBondContact O-N 3.15Å; S2759-K2761 VanDerWaalsContact O-N 3.12Å; K2761-M2763 PolarHBondContact O-N 3.46Å
2762	P	30.9	Very low	36.4	Very low	116.5 Å²	116.5	116.2 Å²	116.2	76%	0.756	69%	0.687	S	S	*	*			trans	-57.7	132.4	172.2	4.7	-1.9	0	0	0	108.1	I2760 A2764	I2760-P2762 VanDerWaalsContact O-CD 3.28Å; I2760-P2762 WeakPolarHBondContact O-CD 3.3Å; I2760-P2762 VanDerWaalsContact O-N 3.16Å; P2762-A2764 PolarHBondContact O-N 3.05Å
2763	M	29.3	Very low	34.2	Very low	176 Å²	176	120.7 Å²	120.7	87%	0.867	72%	0.719	S	S	*	*	S	Bend	trans	-48.3	117.7	177.9	-87.2	171.8	76.6	0	0	110	K2761 T2765	K2761-M2763 PolarHBondContact O-N 3.46Å; M2763-T2765 PolarHBondContact O-N 3.1Å
2764	A	28.1	Very low	32.6	Very low	89.5 Å²	89.5	125.4 Å²	125.4	74%	0.74	75%	0.75	S	S	*	*			trans	-52.3	118	-165.4	0	0	0	0	0	114.6	P2762	P2762-A2764 PolarHBondContact O-N 3.05Å
2765	T	27.7	Very low	31.4	Very low	135 Å²	135	128.9 Å²	128.9	83%	0.828	77%	0.769	S	S	*	*			trans	-100.7	113.8	139.2	41.9	0	0	0	0	107.7	M2763 T2767	M2763-T2765 PolarHBondContact O-N 3.1Å; T2765-T2767 PolarHBondContact O-N 3.2Å; T2765-T2767 VanDerWaalsContact O-N 3.08Å
2766	T	25	Very low	30.3	Very low	135 Å²	135	131.4 Å²	131.4	83%	0.828	78%	0.78	S	S	*	*			trans	-67.2	114.7	-177.8	34.8	0	0	0	0	112.1
2767	T	29	Very low	29.8	Very low	134.5 Å²	134.5	132.8 Å²	132.8	83%	0.825	79%	0.789	S	S	*	*			trans	-139.3	119.5	152.2	31	0	0	0	0	110.4	T2765	T2765-T2767 PolarHBondContact O-N 3.2Å; T2765-T2767 VanDerWaalsContact O-N 3.08Å
2768	T	27.6	Very low	29.6	Very low	132 Å²	132	134.4 Å²	134.4	81%	0.81	80%	0.795	S	S	*	*			trans	-55.3	141.7	173.7	35.5	0	0	0	0	112.6
2769	T	27	Very low	29.4	Very low	128 Å²	128	131.8 Å²	131.8	79%	0.785	79%	0.792	S	S	*	*				-118.4	139.1	102.7	23.3	0	0	0	0	111.3
2770	T	28.1	Very low	29.5	Very low	130.5 Å²	130.5	132.5 Å²	132.5	80%	0.801	79%	0.792	S	S	*	*			trans	154.6	137.3	153.3	44.3	0	0	0	0	114.3
2771	T	31.7	Very low	29.8	Very low	136 Å²	136	131.3 Å²	131.3	83%	0.834	79%	0.791	S	S	*	*				-116.3	146.1	-72.1	20	0	0	0	0	112.2
2772	T	29.4	Very low	30.5	Very low	129.5 Å²	129.5	127.5 Å²	127.5	79%	0.794	78%	0.783	S	S	*	*			trans	-60.2	134.7	179.3	43.2	0	0	0	0	116.1
2773	T	29.3	Very low	31.4	Very low	137 Å²	137	123.9 Å²	123.9	84%	0.84	76%	0.759	S	S	*	*			trans	-125.4	119.3	149.4	38.2	0	0	0	0	109.3
2774	T	30.8	Very low	32.8	Very low	137 Å²	137	119.7 Å²	119.7	84%	0.84	74%	0.743	S	S	*	*			trans	-77.1	113.8	-178.7	43.8	0	0	0	0	111.2
2775	T	28.8	Very low	34.7	Very low	117.5 Å²	117.5	118.3 Å²	118.3	72%	0.721	72%	0.719	S	S	*	*			trans	-128.7	117	158.9	41.2	0	0	0	0	108.2	T2777	T2775-T2777 VanDerWaalsContact C-N 3.27Å; T2775-T2777 PolarHBondContact O-N 3.09Å
2776	T	27.8	Very low	36.9	Very low	152.5 Å²	152.5	117.1 Å²	117.1	94%	0.936	71%	0.705	S	S	*	*			trans	-63.9	86	174.5	43.9	0	0	0	0	110.2
2777	T	30	Very low	39.4	Very low	109.5 Å²	109.5	112.1 Å²	112.1	67%	0.672	67%	0.674	S	S	*	*			trans	-93.8	125.2	163.6	45.1	0	0	0	0	108.2	T2775 T2779	T2775-T2777 VanDerWaalsContact C-N 3.27Å; T2775-T2777 PolarHBondContact O-N 3.09Å; T2777-T2779 PolarHBondContact O-N 3.11Å
2778	T	30.5	Very low	41.8	Very low	129 Å²	129	106 Å²	106	79%	0.791	64%	0.636	S	S	*	*			trans	-28.5	111.5	164	43.3	0	0	0	0	111.3	T2780	T2778-T2780 PolarHBondContact O-N 2.77Å
2779	T	30.9	Very low	44.5	Very low	130.5 Å²	130.5	99.7 Å²	99.7	80%	0.801	60%	0.598	S	S	*	*			trans	-63.4	91.3	177	44.6	0	0	0	0	108.6	T2777 T2781	T2777-T2779 PolarHBondContact O-N 3.11Å; T2779-T2781 PolarHBondContact O-N 2.9Å; T2779-T2781 VanDerWaalsContact O-N 3.1Å
2780	T	35.4	Very low	47.2	Very low	114.5 Å²	114.5	95.1 Å²	95.1	70%	0.702	57%	0.566	S	S	*	*			trans	-58.1	110.8	159.1	42.9	0	0	0	0	106	T2778 T2782	T2778-T2780 PolarHBondContact O-N 2.77Å; T2780-T2782 VanDerWaalsContact C-N 3.29Å; T2780-T2782 PolarHBondContact O-N 3.07Å
2781	T	38.3	Very low	49.8	Very low	105.5 Å²	105.5	88.9 Å²	88.9	65%	0.647	53%	0.528	S	S	*	.			trans	-62	92.3	175.2	46.7	0	0	0	0	108.1	S2754 T2779 T2783	S2754-T2781 WeakPolarHBondContact OG-CB 3.43Å; T2779-T2781 PolarHBondContact O-N 2.9Å; T2779-T2781 VanDerWaalsContact O-N 3.1Å; T2781-T2783 PolarHBondContact O-N 3.25Å
2782	T	44	Very low	52.1	Low	102.5 Å²	102.5	83 Å²	83	63%	0.629	49%	0.492	S	S	*	.			trans	-76.1	98.8	177	51.1	0	0	0	0	108.1	T2780 T2784	T2780-T2782 VanDerWaalsContact C-N 3.29Å; T2780-T2782 PolarHBondContact O-N 3.07Å; T2782-T2784 PolarHBondContact O-N 3.05Å
2783	T	51.1	Low	54	Low	41 Å²	41	78.2 Å²	78.2	25%	0.252	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-59.1	123.9	163.4	42.9	0	0	0	0	108.9	T2781 Y2785	T2781-T2783 PolarHBondContact O-N 3.25Å; T2783-Y2785 VanDerWaalsContact CB-CZ 3.4Å; T2783-Y2785 WeakPolarHBondContact CB-OH 3.46Å; T2783-Y2785 WeakPolarHBondContact O-CD2 3.42Å; T2783-Y2785 VanDerWaalsContact O-CE2 3.28Å; T2783-Y2785 WeakPolarHBondContact O-CE2 3.41Å; T2783-Y2785 WeakPolarHBondContact OG1-CE2 3.4Å; T2783-Y2785 PolarHBondContact OG1-OH 3.36Å
2784	T	57.4	Low	55.5	Low	87 Å²	87	73.5 Å²	73.5	53%	0.534	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	125.6	177.2	51.2	0	0	0	0	109.1	Y2752 T2782	Y2752-T2784 PolarHBondContact N-O 2.91Å; T2782-T2784 PolarHBondContact O-N 3.05Å
2785	Y	69.1	Low	56.6	Low	60 Å²	60	73.9 Å²	73.9	24%	0.235	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	127.7	178.8	-64.8	-99.4	0	0	0	108.6	Y2727 C2737 W2749 A2750 V2751 T2783 F3128	Y2727-Y2785 HydrophobicContact CE1-CE1 4.41Å; Y2727-Y2785 PolarHBondContact OH-OH 2.97Å; C2737-Y2785 HydrophobicContact CB-CE1 4.15Å; W2749-Y2785 HydrophobicContact CB-CD1 4.37Å; A2750-Y2785 CarbonylContact O-C 3.54Å; A2750-Y2785 VanDerWaalsContact O-CA 3.32Å; A2750-Y2785 WeakPolarHBondContact O-CA 3.43Å; V2751-Y2785 HydrophobicContact CB-CD1 4.24Å; V2751-Y2785 HydrophobicContact CB-CE1 4.15Å; V2751-Y2785 HydrophobicContact CG1-CD1 4.12Å; V2751-Y2785 HydrophobicContact CG1-CD2 4.03Å; V2751-Y2785 HydrophobicContact CG1-CE1 3.69Å; V2751-Y2785 HydrophobicContact CG1-CE2 3.65Å; V2751-Y2785 HydrophobicContact CG1-CG 4.4Å; V2751-Y2785 HydrophobicContact CG2-CD1 3.51Å; V2751-Y2785 HydrophobicContact CG2-CD2 4.44Å; V2751-Y2785 HydrophobicContact CG2-CE1 3.52Å; V2751-Y2785 HydrophobicContact CG2-CE2 4.37Å; V2751-Y2785 HydrophobicContact CG2-CG 3.99Å; T2783-Y2785 VanDerWaalsContact CB-CZ 3.4Å; T2783-Y2785 WeakPolarHBondContact CB-OH 3.46Å; T2783-Y2785 WeakPolarHBondContact O-CD2 3.42Å; T2783-Y2785 VanDerWaalsContact O-CE2 3.28Å; T2783-Y2785 WeakPolarHBondContact O-CE2 3.41Å; T2783-Y2785 WeakPolarHBondContact OG1-CE2 3.4Å; T2783-Y2785 PolarHBondContact OG1-OH 3.36Å; Y2785-F3128 AromaticContact CD1-CD2 3.73Å; Y2785-F3128 HydrophobicContact CD1-CD2 3.73Å; Y2785-F3128 AromaticContact CD1-CE2 3.57Å; Y2785-F3128 HydrophobicContact CD1-CE2 3.57Å; Y2785-F3128 HydrophobicContact CD1-CG 4.35Å; Y2785-F3128 HydrophobicContact CD1-CZ 4.08Å; Y2785-F3128 HydrophobicContact CD2-CD2 4.22Å; Y2785-F3128 HydrophobicContact CE1-CB 4.07Å; Y2785-F3128 AromaticContact CE1-CD1 3.81Å; Y2785-F3128 HydrophobicContact CE1-CD1 3.81Å; Y2785-F3128 AromaticContact CE1-CD2 3.26Å; Y2785-F3128 HydrophobicContact CE1-CD2 3.26Å; Y2785-F3128 HydrophobicContact CE1-CE1 4Å; Y2785-F3128 AromaticContact CE1-CE2 3.47Å; Y2785-F3128 HydrophobicContact CE1-CE2 3.47Å; Y2785-F3128 VanDerWaalsContact CE1-CE2 3.47Å; Y2785-F3128 AromaticContact CE1-CG 3.45Å; Y2785-F3128 HydrophobicContact CE1-CG 3.45Å; Y2785-F3128 VanDerWaalsContact CE1-CG 3.45Å; Y2785-F3128 AromaticContact CE1-CZ 3.84Å; Y2785-F3128 HydrophobicContact CE1-CZ 3.84Å; Y2785-F3128 HydrophobicContact CE2-CB 4.08Å; Y2785-F3128 AromaticContact CE2-CD2 3.84Å; Y2785-F3128 HydrophobicContact CE2-CD2 3.84Å; Y2785-F3128 HydrophobicContact CE2-CG 4.17Å; Y2785-F3128 HydrophobicContact CG-CD2 4.18Å; Y2785-F3128 HydrophobicContact CG-CE2 4.19Å; Y2785-F3128 VanDerWaalsContact CZ-CB 3.45Å; Y2785-F3128 AromaticContact CZ-CD2 3.37Å; Y2785-F3128 AromaticContact CZ-CG 3.37Å; Y2785-F3128 WeakPolarHBondContact OH-CB 3.18Å; Y2785-F3128 VanDerWaalsContact OH-CG 3.29Å; Y2785-F3128 WeakPolarHBondContact OH-CG 3.44Å
2786	Q	74.2	Confident	57.5	Low	110.5 Å²	110.5	73.3 Å²	73.3	52%	0.516	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	121.1	178.7	-175	177.3	-13.3	0	0	109.8	W2749 A2750 L2788	W2749-Q2786 CarbonylContact C-O 3.59Å; W2749-Q2786 WeakPolarHBondContact CA-O 3.48Å; A2750-Q2786 HydrophobicContact CB-CB 4.44Å; A2750-Q2786 PolarHBondContact N-O 2.94Å; A2750-Q2786 PolarHBondContact O-N 3.04Å; A2750-Q2786 VanDerWaalsContact O-N 3.09Å; Q2786-L2788 PolarHBondContact O-N 3.43Å
2787	P	76.6	Confident	58.4	Low	29 Å²	29	72.2 Å²	72.2	19%	0.188	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	126.6	172	26	-31	0	0	0	109.4	L2716 I2747 W2749	L2716-P2787 HydrophobicContact CB-CB 3.82Å; L2716-P2787 HydrophobicContact CB-CG 4.05Å; L2716-P2787 HydrophobicContact CD1-CB 4.18Å; L2716-P2787 HydrophobicContact CD1-CG 4.07Å; L2716-P2787 HydrophobicContact CD2-CB 4.17Å; L2716-P2787 HydrophobicContact CG-CB 4.2Å; L2716-P2787 HydrophobicContact CG-CG 4.4Å; I2747-P2787 HydrophobicContact CG2-CB 4.47Å; W2749-P2787 HydrophobicContact CD2-CB 4.5Å; W2749-P2787 HydrophobicContact CE3-CB 3.77Å; W2749-P2787 HydrophobicContact CE3-CG 4.41Å; W2749-P2787 HydrophobicContact CH2-CB 4.48Å; W2749-P2787 HydrophobicContact CZ3-CB 3.75Å; W2749-P2787 HydrophobicContact CZ3-CG 4.14Å
2788	L	80.7	Confident	59.3	Low	6.5 Å²	6.5	69.1 Å²	69.1	3%	0.034	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	-50.3	177.4	-63.1	178.1	0	0	0	110.9	L2736 I2748 A2750 Q2786 L2854 F2857 L2863	L2736-L2788 HydrophobicContact CD2-CD1 3.58Å; I2748-L2788 HydrophobicContact CG2-CD1 4.3Å; I2748-L2788 PolarHBondContact O-N 3.16Å; A2750-L2788 HydrophobicContact CB-CD1 4.01Å; A2750-L2788 HydrophobicContact CB-CD2 3.97Å; A2750-L2788 HydrophobicContact CB-CG 3.97Å; Q2786-L2788 PolarHBondContact O-N 3.43Å; L2788-L2854 HydrophobicContact CD1-CD2 4.14Å; L2788-L2854 HydrophobicContact CD2-CD2 3.58Å; L2788-L2854 HydrophobicContact CG-CD2 4.48Å; L2788-F2857 HydrophobicContact CB-CB 3.87Å; L2788-F2857 HydrophobicContact CD1-CB 4.06Å; L2788-F2857 HydrophobicContact CD1-CD2 4.23Å; L2788-F2857 HydrophobicContact CD1-CG 4.45Å; L2788-L2863 WeakPolarHBondContact O-CD2 3.48Å
2789	I	84	Confident	60.7	Low	0.5 Å²	0.5	68.6 Å²	68.6	0%	0.003	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	146.3	-173.5	-166.2	164.7	0	0	0	111.1	I2747 I2748 L2791 F2857 L2863 I2865 L2870	I2747-I2789 WeakPolarHBondContact CA-O 3.22Å; I2748-I2789 HydrophobicContact CB-CG2 3.94Å; I2748-I2789 HydrophobicContact CD1-CG2 3.88Å; I2748-I2789 HydrophobicContact CG1-CG2 4.1Å; I2748-I2789 PolarHBondContact N-O 2.97Å; I2789-L2791 HydrophobicContact CD1-CD2 3.73Å; I2789-L2791 HydrophobicContact CG1-CD2 3.89Å; I2789-L2791 HydrophobicContact CG1-CG 4.34Å; I2789-L2791 HydrophobicContact CG2-CD2 4.43Å; I2789-L2791 HydrophobicContact CG2-CG 4.3Å; I2789-F2857 HydrophobicContact CG2-CB 4.26Å; I2789-F2857 HydrophobicContact CG2-CD1 3.78Å; I2789-F2857 HydrophobicContact CG2-CG 4.36Å; I2789-L2863 CarbonylContact C-O 3.59Å; I2789-I2865 HydrophobicContact CD1-CB 4.07Å; I2789-I2865 HydrophobicContact CD1-CD1 3.8Å; I2789-I2865 HydrophobicContact CD1-CG1 4.27Å; I2789-I2865 HydrophobicContact CG1-CB 4.44Å; I2789-L2870 HydrophobicContact CD1-CD1 3.94Å
2790	R	83.6	Confident	62.4	Low	30.5 Å²	30.5	65.6 Å²	65.6	12%	0.115	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	116.5	167.3	178.9	-174.1	-169	155.6	4.9	107.5	L2716 D2743 D2745 C2746 I2747 T2792 L2863 N2864 I2865	L2716-R2790 HydrophobicContact CD2-CB 3.53Å; L2716-R2790 VanDerWaalsContact CD2-N 3.3Å; L2716-R2790 HydrophobicContact CG-CB 3.95Å; D2743-R2790 IonicContact OD2-NH2 2.64Å; D2745-R2790 HydrophobicContact CB-CG 4.17Å; D2745-R2790 IonicContact OD2-CZ 3.2Å; D2745-R2790 IonicContact OD2-NE 3.75Å; D2745-R2790 PolarHBondContact OD2-NE 2.74Å; D2745-R2790 IonicContact OD2-NH2 3.31Å; D2745-R2790 PolarHBondContact OD2-NH2 2.99Å; C2746-R2790 CarbonylContact O-C 3.56Å; C2746-R2790 VanDerWaalsContact O-CA 3.31Å; C2746-R2790 WeakPolarHBondContact O-CA 3.36Å; I2747-R2790 HydrophobicContact CG1-CB 4.1Å; I2747-R2790 HydrophobicContact CG1-CG 4.01Å; R2790-T2792 HydrophobicContact CG-CG2 4.16Å; R2790-L2863 WeakPolarHBondContact CB-O 3.36Å; R2790-L2863 PolarHBondContact N-O 3.08Å; R2790-N2864 WeakPolarHBondContact CB-OD1 3.38Å; R2790-N2864 VanDerWaalsContact CD-OD1 3.28Å; R2790-N2864 WeakPolarHBondContact CD-OD1 2.95Å; R2790-I2865 PolarHBondContact O-N 2.86Å
2791	L	83.1	Confident	64.4	Low	0 Å²	0	61.8 Å²	61.8	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	125.5	177.5	-59.4	175	0	0	0	109.1	C2746 I2748 I2789 L2834 I2865 F2867 L2870	C2746-L2791 HydrophobicContact CB-CB 4.26Å; C2746-L2791 PolarHBondContact N-O 3.24Å; C2746-L2791 PolarHBondContact O-N 3.09Å; I2748-L2791 HydrophobicContact CD1-CD1 3.99Å; I2789-L2791 HydrophobicContact CD1-CD2 3.73Å; I2789-L2791 HydrophobicContact CG1-CD2 3.89Å; I2789-L2791 HydrophobicContact CG1-CG 4.34Å; I2789-L2791 HydrophobicContact CG2-CD2 4.43Å; I2789-L2791 HydrophobicContact CG2-CG 4.3Å; L2791-L2834 HydrophobicContact CD1-CD2 4.05Å; L2791-I2865 WeakPolarHBondContact CA-O 3.47Å; L2791-F2867 HydrophobicContact CB-CE1 4.07Å; L2791-F2867 HydrophobicContact CB-CE2 4.34Å; L2791-F2867 HydrophobicContact CB-CZ 3.9Å; L2791-F2867 HydrophobicContact CD1-CE1 3.79Å; L2791-F2867 HydrophobicContact CD1-CZ 4.26Å; L2791-F2867 HydrophobicContact CG-CE1 4.45Å; L2791-L2870 HydrophobicContact CD1-CD2 4.13Å; L2791-L2870 HydrophobicContact CD2-CD1 4.46Å; L2791-L2870 HydrophobicContact CD2-CD2 3.71Å; L2791-L2870 HydrophobicContact CD2-CG 4.45Å
2792	T	78.2	Confident	66.6	Low	13.5 Å²	13.5	56.8 Å²	56.8	8%	0.083	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	144	177.8	68.3	0	0	0	0	109.7	D2745 R2790 S2794 I2865 N2866 F2867	D2745-T2792 HydrophobicContact CB-CG2 4.2Å; D2745-T2792 VanDerWaalsContact CG-CG2 3.47Å; D2745-T2792 VanDerWaalsContact OD1-CB 3.3Å; D2745-T2792 WeakPolarHBondContact OD1-CB 3.26Å; D2745-T2792 WeakPolarHBondContact OD1-CG2 3.38Å; R2790-T2792 HydrophobicContact CG-CG2 4.16Å; T2792-S2794 PolarHBondContact O-N 2.89Å; T2792-I2865 PolarHBondContact N-O 2.82Å; T2792-I2865 VanDerWaalsContact N-O 3.08Å; T2792-N2866 CarbonylContact O-C 3.59Å; T2792-N2866 WeakPolarHBondContact O-CA 3.41Å; T2792-N2866 WeakPolarHBondContact O-CB 3.49Å; T2792-F2867 PolarHBondContact O-N 3.4Å
2793	H	70.3	Confident	68.5	Low	27.5 Å²	27.5	53.5 Å²	53.5	13%	0.127	26%	0.259	C	S	.	.			trans	-82.6	20.7	177.1	-172	79.6	0	0	0	111	Y2795 F2827 E2830	H2793-Y2795 VanDerWaalsContact C-N 3.31Å; H2793-Y2795 PolarHBondContact O-N 3.01Å; H2793-F2827 HydrophobicContact CB-CD2 4.29Å; H2793-F2827 HydrophobicContact CB-CE2 4.32Å; H2793-F2827 AromaticContact CE1-CE2 3.31Å; H2793-F2827 WeakPolarHBondContact CE1-CE2 3.29Å; H2793-F2827 AromaticContact CE1-CZ 3.87Å; H2793-F2827 AromaticContact CG-CD2 3.91Å; H2793-F2827 AromaticContact CG-CE2 3.6Å; H2793-F2827 AromaticContact ND1-CD2 3.72Å; H2793-F2827 AromaticContact ND1-CE2 2.94Å; H2793-F2827 WeakPolarHBondContact ND1-CE2 3.29Å; H2793-F2827 AromaticContact ND1-CZ 3.36Å; H2793-F2827 WeakPolarHBondContact ND1-CZ 3.38Å; H2793-E2830 IonicContact CE1-OE2 3.1Å; H2793-E2830 PolarHBondContact CE1-OE2 3.39Å; H2793-E2830 IonicContact ND1-OE2 2.95Å; H2793-E2830 IonicContact NE2-OE2 3.94Å
2794	S	60.8	Low	70.2	Confident	39 Å²	39	52.2 Å²	52.2	27%	0.273	25%	0.251	S	S	.	.			trans	-116.2	72.8	-174.1	81	0	0	0	0	113.7	T2792 K2797	T2792-S2794 PolarHBondContact O-N 2.89Å; S2794-K2797 WeakPolarHBondContact OG-CB 3.43Å; S2794-K2797 PolarHBondContact OG-N 2.97Å; S2794-K2797 VanDerWaalsContact OG-N 3.08Å
2795	Y	54.8	Low	71.8	Confident	146 Å²	146	48.4 Å²	48.4	57%	0.573	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-17.7	-177	-70.1	-75.4	0	0	0	114.6	H2793 N2866 E2869	H2793-Y2795 VanDerWaalsContact C-N 3.31Å; H2793-Y2795 PolarHBondContact O-N 3.01Å; Y2795-N2866 WeakPolarHBondContact CD2-ND2 3.41Å; Y2795-N2866 HydrophobicContact CE2-CB 4.4Å; Y2795-N2866 WeakPolarHBondContact CE2-ND2 3.49Å; Y2795-E2869 VanDerWaalsContact CE2-OE1 3.29Å; Y2795-E2869 WeakPolarHBondContact CE2-OE1 3.36Å; Y2795-E2869 PolarHBondContact OH-OE1 3.01Å; Y2795-E2869 PolarHBondContact OH-OE2 3.4Å
2796	M	47.5	Very low	72.7	Confident	103.5 Å²	103.5	45.9 Å²	45.9	51%	0.51	22%	0.219	S	C	.	.	S	Bend	trans	-106.9	51	-172.6	-75.1	-122.8	155.5	0	0	112.4	P2798 R2799 Y2800	M2796-P2798 CarbonylContact C-O 3.52Å; M2796-P2798 CarbonylContact O-C 3.56Å; M2796-P2798 VanDerWaalsContact O-C 3.29Å; M2796-R2799 PolarHBondContact O-N 2.87Å; M2796-Y2800 HydrophobicContact CB-CD2 4.33Å; M2796-Y2800 HydrophobicContact CB-CE2 4.49Å; M2796-Y2800 HydrophobicContact SD-CD2 3.81Å; M2796-Y2800 HydrophobicContact SD-CE2 3.8Å
2797	K	45.2	Very low	73.4	Confident	131 Å²	131	41.7 Å²	41.7	57%	0.57	20%	0.2	S	C	*	.	S	Bend	trans	-110.7	134.8	169.9	-67.7	-175.3	177.6	-178.7	0	108.5	S2078 S2079 E2082 S2794 R2799	S2078-K2797 PolarHBondContact OG-NZ 3.11Å; S2079-K2797 PolarHBondContact O-NZ 3.19Å; E2082-K2797 VanDerWaalsContact OE1-C 3.22Å; S2794-K2797 WeakPolarHBondContact OG-CB 3.43Å; S2794-K2797 PolarHBondContact OG-N 2.97Å; S2794-K2797 VanDerWaalsContact OG-N 3.08Å; K2797-R2799 PolarHBondContact O-N 2.79Å
2798	P	49.2	Very low	73.8	Confident	44 Å²	44	40.5 Å²	40.5	29%	0.286	19%	0.192	S	C	.	.	S	Bend		-65.8	142.2	92.3	25.8	-32.1	0	0	0	111.1	E2082 M2796 Y2800	E2082-P2798 WeakPolarHBondContact OE1-CD 3.42Å; E2082-P2798 WeakPolarHBondContact OE2-CA 3.29Å; E2082-P2798 WeakPolarHBondContact OE2-CB 3.44Å; M2796-P2798 CarbonylContact C-O 3.52Å; M2796-P2798 CarbonylContact O-C 3.56Å; M2796-P2798 VanDerWaalsContact O-C 3.29Å; P2798-Y2800 HydrophobicContact CG-CE1 4.03Å; P2798-Y2800 HydrophobicContact CG-CE2 4.32Å; P2798-Y2800 WeakPolarHBondContact O-CD2 3.47Å; P2798-Y2800 PolarHBondContact O-N 3.3Å
2799	R	59.7	Low	73.9	Confident	117.5 Å²	117.5	45 Å²	45	44%	0.443	21%	0.209	S	C	.	.			trans	-71	117.6	174.8	-71.3	-175.3	177.2	-170.3	-7.3	108.3	D2743 D2745 M2796 K2797	D2743-R2799 VanDerWaalsContact O-CB 3.29Å; D2743-R2799 WeakPolarHBondContact O-CB 3.34Å; D2743-R2799 WeakPolarHBondContact O-CD 3.06Å; D2743-R2799 PolarHBondContact O-NH1 2.83Å; D2745-R2799 WeakPolarHBondContact OD1-CD 3.39Å; D2745-R2799 IonicContact OD1-CZ 3.01Å; D2745-R2799 IonicContact OD1-NE 3.4Å; D2745-R2799 PolarHBondContact OD1-NE 2.87Å; D2745-R2799 IonicContact OD1-NH1 2.69Å; D2745-R2799 PolarHBondContact OD1-NH1 3.04Å; D2745-R2799 IonicContact OD1-NH2 3.89Å; D2745-R2799 IonicContact OD2-CZ 2.73Å; D2745-R2799 IonicContact OD2-NH1 3.59Å; D2745-R2799 PolarHBondContact OD2-NH1 2.74Å; M2796-R2799 PolarHBondContact O-N 2.87Å; K2797-R2799 PolarHBondContact O-N 2.79Å
2800	Y	67.1	Low	73.4	Confident	67.5 Å²	67.5	45 Å²	45	27%	0.265	21%	0.209	S	C	.	.			trans	-76.3	143.2	170	-66.1	-78	0	0	0	109.5	G2744 M2796 P2798 Y2829	G2744-Y2800 WeakPolarHBondContact CA-O 3.38Å; M2796-Y2800 HydrophobicContact CB-CD2 4.33Å; M2796-Y2800 HydrophobicContact CB-CE2 4.49Å; M2796-Y2800 HydrophobicContact SD-CD2 3.81Å; M2796-Y2800 HydrophobicContact SD-CE2 3.8Å; P2798-Y2800 HydrophobicContact CG-CE1 4.03Å; P2798-Y2800 HydrophobicContact CG-CE2 4.32Å; P2798-Y2800 WeakPolarHBondContact O-CD2 3.47Å; P2798-Y2800 PolarHBondContact O-N 3.3Å; Y2800-Y2829 HydrophobicContact CE1-CE2 4.29Å
2801	S	77	Confident	72.8	Confident	35 Å²	35	47.5 Å²	47.5	25%	0.245	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-56.1	145.9	172.2	49.7	0	0	0	0	110.5	N2803	S2801-N2803 PolarHBondContact O-N 3.25Å; S2801-N2803 PolarHBondContact O-OD1 2.92Å; S2801-N2803 PolarHBondContact OG-OD1 3.02Å
2802	I	84.5	Confident	71.9	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.005	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	106	170.8	-53.8	-163.2	0	0	0	107.6	C2724 S2741 D2745 C2746 I2805 I2825 A2826	C2724-I2802 PolarHBondContact SG-O 3.44Å; S2741-I2802 PolarHBondContact O-N 2.61Å; S2741-I2802 VanDerWaalsContact O-N 3.11Å; D2745-I2802 VanDerWaalsContact O-CD1 3.24Å; D2745-I2802 WeakPolarHBondContact O-CD1 3.45Å; C2746-I2802 HydrophobicContact CB-CD1 3.38Å; C2746-I2802 VanDerWaalsContact N-CD1 3.3Å; I2802-I2805 HydrophobicContact CG2-CD1 4.03Å; I2802-I2805 HydrophobicContact CG2-CG1 3.82Å; I2802-I2825 HydrophobicContact CD1-CG2 4.06Å; I2802-I2825 HydrophobicContact CG2-CG2 3.7Å; I2802-A2826 WeakPolarHBondContact CA-O 3.37Å
2803	N	84.5	Confident	71	Confident	34 Å²	34	54 Å²	54	18%	0.182	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	-38.4	-170.7	-67	-15.6	0	0	0	111.4	S2801 A2826 V2894	S2801-N2803 PolarHBondContact O-N 3.25Å; S2801-N2803 PolarHBondContact O-OD1 2.92Å; S2801-N2803 PolarHBondContact OG-OD1 3.02Å; N2803-A2826 PolarHBondContact N-O 2.84Å; N2803-V2894 WeakPolarHBondContact CB-O 3.14Å; N2803-V2894 PolarHBondContact ND2-O 3.17Å
2804	S	87.7	Confident	70.4	Confident	12 Å²	12	60.1 Å²	60.1	8%	0.084	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	145.2	-178.3	-167.9	0	0	0	0	112	A2826 M2897	S2804-A2826 PolarHBondContact O-N 3.27Å; S2804-M2897 WeakPolarHBondContact O-CE 3.26Å; S2804-M2897 PolarHBondContact OG-N 2.94Å; S2804-M2897 VanDerWaalsContact OG-N 3.12Å
2805	I	90.6	Very high	70.1	Confident	8 Å²	8	62.7 Å²	62.7	4%	0.041	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	125.1	175.5	-64.4	162.1	0	0	0	108.1	N2726 I2738 G2740 I2802 I2823 Y2824	N2726-I2805 HydrophobicContact CB-CB 4.47Å; N2726-I2805 HydrophobicContact CB-CG2 3.99Å; N2726-I2805 PolarHBondContact ND2-O 3.49Å; N2726-I2805 VanDerWaalsContact ND2-O 3.12Å; I2738-I2805 HydrophobicContact CB-CG2 4.23Å; I2738-I2805 HydrophobicContact CG2-CD1 4.06Å; I2738-I2805 HydrophobicContact CG2-CG2 3.95Å; G2740-I2805 VanDerWaalsContact N-CD1 3.32Å; I2802-I2805 HydrophobicContact CG2-CD1 4.03Å; I2802-I2805 HydrophobicContact CG2-CG1 3.82Å; I2805-I2823 HydrophobicContact CG2-CG2 4.48Å; I2805-Y2824 WeakPolarHBondContact CA-O 3.43Å
2806	V	88.5	Confident	70.2	Confident	8 Å²	8	64.1 Å²	64.1	5%	0.048	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	131.2	178.8	178.8	0	0	0	0	108.9	Y2824 M2897 T2899 V2912	V2806-Y2824 HydrophobicContact CB-CD2 4.42Å; V2806-Y2824 HydrophobicContact CG1-CD2 4.41Å; V2806-Y2824 PolarHBondContact N-O 3.21Å; V2806-Y2824 PolarHBondContact O-N 2.68Å; V2806-M2897 HydrophobicContact CG2-CB 3.58Å; V2806-M2897 HydrophobicContact CG2-CE 4.43Å; V2806-M2897 WeakPolarHBondContact CG2-O 3.45Å; V2806-T2899 HydrophobicContact CG1-CG2 3.25Å; V2806-V2912 HydrophobicContact CB-CG1 4.37Å; V2806-V2912 HydrophobicContact CG1-CG1 4.26Å
2807	T	88.3	Confident	71.1	Confident	21 Å²	21	60.9 Å²	60.9	13%	0.129	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	140.7	174.7	50	0	0	0	0	109.5	N2726 Y2727 L2728 I2738 F2822 I2823 T2899	N2726-T2807 HydrophobicContact CB-CG2 4.27Å; N2726-T2807 VanDerWaalsContact CG-OG1 3.3Å; N2726-T2807 PolarHBondContact ND2-N 2.86Å; N2726-T2807 PolarHBondContact ND2-OG1 2.89Å; N2726-T2807 PolarHBondContact OD1-OG1 3.21Å; Y2727-T2807 WeakPolarHBondContact O-CB 3.4Å; Y2727-T2807 PolarHBondContact O-OG1 2.79Å; L2728-T2807 HydrophobicContact CB-CG2 4.42Å; L2728-T2807 HydrophobicContact CD1-CG2 4.37Å; I2738-T2807 HydrophobicContact CD1-CG2 3.78Å; T2807-F2822 WeakPolarHBondContact CA-O 3.43Å; T2807-I2823 HydrophobicContact CG2-CG1 4.34Å; T2807-T2899 WeakPolarHBondContact O-CG2 3.28Å
2808	Q	85.3	Confident	72.5	Confident	5 Å²	5	57.8 Å²	57.8	2%	0.023	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	141.9	177.8	-165.1	-178.3	23.9	0	0	109.1	F2822 Y2824 T2899 H2901 P2904	Q2808-F2822 HydrophobicContact CB-CB 4.22Å; Q2808-F2822 PolarHBondContact N-O 2.91Å; Q2808-F2822 PolarHBondContact O-N 2.6Å; Q2808-Y2824 HydrophobicContact CB-CE2 4.3Å; Q2808-T2899 HydrophobicContact CB-CG2 3.89Å; Q2808-T2899 HydrophobicContact CG-CG2 4.03Å; Q2808-H2901 PolarHBondContact NE2-O 3.36Å; Q2808-P2904 HydrophobicContact CG-CG 4.13Å
2809	R	81.9	Confident	73.8	Confident	100 Å²	100	56.2 Å²	56.2	38%	0.377	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	122.9	173.4	-180	-175.5	178	-175.5	3.8	108.3	I2819 D2820 Y2821	R2809-I2819 HydrophobicContact CG-CG2 3.81Å; R2809-D2820 WeakPolarHBondContact CA-O 3.25Å; R2809-Y2821 HydrophobicContact CG-CD1 4.34Å; R2809-Y2821 HydrophobicContact CG-CE1 4.23Å
2810	G	73.8	Confident	75	Confident	1 Å²	1	50.8 Å²	50.8	1%	0.01	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	134.7	174.3	0	0	0	0	0	111.7	D2820	G2810-D2820 PolarHBondContact N-O 2.82Å; G2810-D2820 PolarHBondContact O-N 3.34Å; G2810-D2820 VanDerWaalsContact O-N 3.16Å
2811	I	69.9	Low	76	Confident	83 Å²	83	47.7 Å²	47.7	43%	0.426	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	110.9	168.5	-57.3	173.6	0	0	0	106.4
2812	M	65.7	Low	76.5	Confident	44 Å²	44	46 Å²	46	22%	0.217	23%	0.225	C	C	.	.			trans	-82	122.5	-175.9	-68.1	-66.5	-67.4	0	0	110.8	N2814 E2815 M2907	M2812-N2814 PolarHBondContact O-N 2.91Å; M2812-E2815 CarbonylContact O-C 3.58Å; M2812-E2815 PolarHBondContact O-N 3.12Å; M2812-M2907 HydrophobicContact CE-CB 4.31Å; M2812-M2907 HydrophobicContact CE-CG 3.66Å; M2812-M2907 HydrophobicContact SD-CB 4.46Å; M2812-M2907 HydrophobicContact SD-CG 3.71Å; M2812-M2907 PolarHBondContact SD-N 3.14Å; M2812-M2907 VanDerWaalsContact SD-N 3.4Å; M2812-M2907 HydrophobicContact SD-SD 4.22Å
2813	D	57.9	Low	76.8	Confident	105 Å²	105	46 Å²	46	56%	0.561	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-29.6	-172.3	-101.4	-11.8	0	0	0	114.9	V2905	D2813-V2905 HydrophobicContact CB-CG1 4.37Å; D2813-V2905 WeakPolarHBondContact OD2-CG1 3.28Å
2814	N	57.7	Low	77.1	Confident	156 Å²	156	44.5 Å²	44.5	83%	0.834	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-19.5	-174.3	-71.8	-21.7	0	0	0	114	M2812	M2812-N2814 PolarHBondContact O-N 2.91Å
2815	E	55	Low	77.2	Confident	95 Å²	95	44 Å²	44	44%	0.444	21%	0.213	S	C	.	.			trans	-146.3	85.1	179	-67.3	-177.4	174.7	0	0	107	M2812 T2817 K2818	M2812-E2815 CarbonylContact O-C 3.58Å; M2812-E2815 PolarHBondContact O-N 3.12Å; E2815-T2817 PolarHBondContact O-N 3.47Å; E2815-K2818 PolarHBondContact O-N 3.2Å; E2815-K2818 VanDerWaalsContact O-N 3.1Å; E2815-K2818 IonicContact OE1-NZ 3.75Å; E2815-K2818 WeakPolarHBondContact OE2-CD 3.38Å; E2815-K2818 WeakPolarHBondContact OE2-CE 3.26Å; E2815-K2818 IonicContact OE2-NZ 3.19Å; E2815-K2818 PolarHBondContact OE2-NZ 3.46Å
2816	K	58.3	Low	77.1	Confident	174 Å²	174	43.6 Å²	43.6	76%	0.757	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.7	-0.1	179.3	-74	-171.2	175	-175.2	0	115.4
2817	T	66.2	Low	76.9	Confident	37 Å²	37	43.5 Å²	43.5	23%	0.227	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.5	-18	-168	61.9	0	0	0	0	111.8	E2815 H2840 D2841	E2815-T2817 PolarHBondContact O-N 3.47Å; T2817-H2840 WeakPolarHBondContact O-CB 3.31Å; T2817-H2840 PolarHBondContact O-N 2.83Å; T2817-D2841 HydrophobicContact CG2-CB 4.26Å; T2817-D2841 VanDerWaalsContact CG2-OD1 3.25Å; T2817-D2841 WeakPolarHBondContact CG2-OD1 3.32Å; T2817-D2841 WeakPolarHBondContact CG2-OD2 3.37Å
2818	K	72.9	Confident	76.6	Confident	66 Å²	66	42.6 Å²	42.6	29%	0.287	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	130	172.1	-71.5	-176.4	-174.7	151.7	0	110.9	E2815 L2838 N2839	E2815-K2818 PolarHBondContact O-N 3.2Å; E2815-K2818 VanDerWaalsContact O-N 3.1Å; E2815-K2818 IonicContact OE1-NZ 3.75Å; E2815-K2818 WeakPolarHBondContact OE2-CD 3.38Å; E2815-K2818 WeakPolarHBondContact OE2-CE 3.26Å; E2815-K2818 IonicContact OE2-NZ 3.19Å; E2815-K2818 PolarHBondContact OE2-NZ 3.46Å; K2818-L2838 WeakPolarHBondContact CA-O 3.38Å; K2818-N2839 HydrophobicContact CG-CB 4.37Å
2819	I	78.1	Confident	76.3	Confident	11 Å²	11	46.8 Å²	46.8	6%	0.056	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	123.3	178.7	-54	-167.4	0	0	0	108	R2809 Y2821 L2838 H2840	R2809-I2819 HydrophobicContact CG-CG2 3.81Å; I2819-Y2821 HydrophobicContact CB-CE2 4.15Å; I2819-Y2821 HydrophobicContact CG2-CD2 4.32Å; I2819-Y2821 HydrophobicContact CG2-CE1 4.04Å; I2819-Y2821 HydrophobicContact CG2-CE2 3.74Å; I2819-L2838 PolarHBondContact N-O 3.08Å; I2819-L2838 PolarHBondContact O-N 3.17Å; I2819-H2840 WeakPolarHBondContact CD1-CD2 3.47Å; I2819-H2840 WeakPolarHBondContact CD1-NE2 3.45Å; I2819-H2840 VanDerWaalsContact CG1-CD2 3.41Å; I2819-H2840 WeakPolarHBondContact CG1-CD2 3.29Å
2820	D	84.3	Confident	76.3	Confident	3 Å²	3	43.7 Å²	43.7	2%	0.016	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	126.5	178.9	-59.8	-52.9	0	0	0	109	R2809 G2810 F2822 H2835 Q2837	R2809-D2820 WeakPolarHBondContact CA-O 3.25Å; G2810-D2820 PolarHBondContact N-O 2.82Å; G2810-D2820 PolarHBondContact O-N 3.34Å; G2810-D2820 VanDerWaalsContact O-N 3.16Å; D2820-F2822 HydrophobicContact CB-CE2 3.66Å; D2820-F2822 HydrophobicContact CB-CZ 3.95Å; D2820-H2835 IonicContact OD1-NE2 2.76Å; D2820-Q2837 VanDerWaalsContact OD1-CB 3.23Å; D2820-Q2837 WeakPolarHBondContact OD1-CB 3.19Å; D2820-Q2837 VanDerWaalsContact OD1-CD 3.26Å; D2820-Q2837 WeakPolarHBondContact OD1-CG 3.36Å; D2820-Q2837 PolarHBondContact OD1-NE2 3.22Å
2821	Y	87	Confident	76.9	Confident	2 Å²	2	43.6 Å²	43.6	1%	0.008	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	125.3	179.2	-61.9	-81.9	0	0	0	109.4	L2728 R2809 I2819 H2835 I2836 L2838	L2728-Y2821 HydrophobicContact CD1-CD1 3.95Å; L2728-Y2821 HydrophobicContact CD2-CD1 3.57Å; L2728-Y2821 HydrophobicContact CD2-CE1 4.3Å; L2728-Y2821 HydrophobicContact CD2-CG 4.03Å; L2728-Y2821 HydrophobicContact CG-CD1 3.85Å; L2728-Y2821 HydrophobicContact CG-CE1 4.4Å; R2809-Y2821 HydrophobicContact CG-CD1 4.34Å; R2809-Y2821 HydrophobicContact CG-CE1 4.23Å; I2819-Y2821 HydrophobicContact CB-CE2 4.15Å; I2819-Y2821 HydrophobicContact CG2-CD2 4.32Å; I2819-Y2821 HydrophobicContact CG2-CE1 4.04Å; I2819-Y2821 HydrophobicContact CG2-CE2 3.74Å; Y2821-H2835 WeakPolarHBondContact O-CA 3.49Å; Y2821-I2836 PolarHBondContact N-O 3.35Å; Y2821-I2836 PolarHBondContact O-N 3.02Å; Y2821-L2838 HydrophobicContact CD2-CD1 4.27Å; Y2821-L2838 HydrophobicContact CE2-CD1 3.94Å
2822	F	88	Confident	77.7	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	134.7	178.1	-57.6	-87.6	0	0	0	110.7	T2807 Q2808 D2820 Y2824 T2833 L2834 H2835 M2907 C2910 F2926	T2807-F2822 WeakPolarHBondContact CA-O 3.43Å; Q2808-F2822 HydrophobicContact CB-CB 4.22Å; Q2808-F2822 PolarHBondContact N-O 2.91Å; Q2808-F2822 PolarHBondContact O-N 2.6Å; D2820-F2822 HydrophobicContact CB-CE2 3.66Å; D2820-F2822 HydrophobicContact CB-CZ 3.95Å; F2822-Y2824 HydrophobicContact CB-CD2 4.3Å; F2822-Y2824 HydrophobicContact CB-CE2 3.53Å; F2822-Y2824 HydrophobicContact CG-CE2 4.37Å; F2822-T2833 HydrophobicContact CD1-CG2 4.45Å; F2822-L2834 CarbonylContact C-O 3.59Å; F2822-L2834 WeakPolarHBondContact CA-O 3.49Å; F2822-H2835 HydrophobicContact CD1-CB 3.96Å; F2822-H2835 AromaticContact CD1-CD2 3.74Å; F2822-H2835 HydrophobicContact CE1-CB 3.94Å; F2822-H2835 AromaticContact CE1-CD2 3.16Å; F2822-H2835 WeakPolarHBondContact CE1-CD2 3.46Å; F2822-H2835 AromaticContact CE1-CG 3.51Å; F2822-H2835 AromaticContact CE1-NE2 3.7Å; F2822-H2835 AromaticContact CZ-CD2 3.49Å; F2822-H2835 VanDerWaalsContact CZ-CD2 3.49Å; F2822-H2835 WeakPolarHBondContact CZ-CD2 3.19Å; F2822-H2835 AromaticContact CZ-NE2 3.62Å; F2822-M2907 HydrophobicContact CZ-CE 3.92Å; F2822-M2907 HydrophobicContact CZ-SD 4.05Å; F2822-C2910 HydrophobicContact CE2-CB 4.12Å; F2822-C2910 HydrophobicContact CZ-CB 4.21Å; F2822-F2926 AromaticContact CD1-CD2 3.98Å; F2822-F2926 HydrophobicContact CD1-CD2 3.98Å; F2822-F2926 HydrophobicContact CD1-CE2 4.07Å; F2822-F2926 HydrophobicContact CD1-CG 4.43Å; F2822-F2926 AromaticContact CE1-CD1 3.95Å; F2822-F2926 HydrophobicContact CE1-CD1 3.95Å; F2822-F2926 AromaticContact CE1-CD2 3.66Å; F2822-F2926 HydrophobicContact CE1-CD2 3.66Å; F2822-F2926 AromaticContact CE1-CE1 3.91Å; F2822-F2926 HydrophobicContact CE1-CE1 3.91Å; F2822-F2926 AromaticContact CE1-CE2 3.62Å; F2822-F2926 HydrophobicContact CE1-CE2 3.62Å; F2822-F2926 AromaticContact CE1-CG 3.83Å; F2822-F2926 HydrophobicContact CE1-CG 3.83Å; F2822-F2926 AromaticContact CE1-CZ 3.75Å; F2822-F2926 HydrophobicContact CE1-CZ 3.75Å; F2822-F2926 HydrophobicContact CZ-CD1 4.36Å; F2822-F2926 HydrophobicContact CZ-CE1 4.41Å
2823	I	90.3	Very high	78.8	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	114.8	171.7	-53.3	161.1	0	0	0	107.4	I2738 I2805 T2807 I2825 T2833 L2834	I2738-I2823 HydrophobicContact CD1-CB 4.28Å; I2738-I2823 HydrophobicContact CD1-CD1 3.6Å; I2738-I2823 HydrophobicContact CD1-CG1 3.72Å; I2738-I2823 HydrophobicContact CD1-CG2 3.56Å; I2805-I2823 HydrophobicContact CG2-CG2 4.48Å; T2807-I2823 HydrophobicContact CG2-CG1 4.34Å; I2823-I2825 HydrophobicContact CG2-CD1 4.15Å; I2823-I2825 HydrophobicContact CG2-CG1 3.93Å; I2823-T2833 WeakPolarHBondContact O-CA 3.39Å; I2823-L2834 HydrophobicContact CB-CB 4.19Å; I2823-L2834 PolarHBondContact N-O 3.17Å; I2823-L2834 PolarHBondContact O-N 3.22Å
2824	Y	91	Very high	80.2	Confident	3 Å²	3	32.6 Å²	32.6	1%	0.012	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	125.7	176.9	-55.8	-88.2	0	0	0	109.4	I2805 V2806 Q2808 F2822 A2832 T2833 G2911 V2912	I2805-Y2824 WeakPolarHBondContact CA-O 3.43Å; V2806-Y2824 HydrophobicContact CB-CD2 4.42Å; V2806-Y2824 HydrophobicContact CG1-CD2 4.41Å; V2806-Y2824 PolarHBondContact N-O 3.21Å; V2806-Y2824 PolarHBondContact O-N 2.68Å; Q2808-Y2824 HydrophobicContact CB-CE2 4.3Å; F2822-Y2824 HydrophobicContact CB-CD2 4.3Å; F2822-Y2824 HydrophobicContact CB-CE2 3.53Å; F2822-Y2824 HydrophobicContact CG-CE2 4.37Å; Y2824-A2832 CarbonylContact C-O 3.51Å; Y2824-A2832 WeakPolarHBondContact CA-O 3.15Å; Y2824-T2833 HydrophobicContact CD1-CG2 3.67Å; Y2824-T2833 VanDerWaalsContact CD1-OG1 3.26Å; Y2824-T2833 WeakPolarHBondContact CD1-OG1 3.43Å; Y2824-T2833 HydrophobicContact CE1-CG2 3.32Å; Y2824-T2833 WeakPolarHBondContact CE1-OG1 3.25Å; Y2824-G2911 PolarHBondContact OH-N 3.14Å; Y2824-V2912 HydrophobicContact CD1-CG1 3.7Å; Y2824-V2912 HydrophobicContact CD1-CG2 4.22Å; Y2824-V2912 HydrophobicContact CD2-CG1 3.39Å; Y2824-V2912 HydrophobicContact CE1-CG1 4.06Å; Y2824-V2912 HydrophobicContact CE2-CG1 3.78Å; Y2824-V2912 HydrophobicContact CG-CG1 3.34Å
2825	I	90.6	Very high	81.5	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	115.8	-176.6	-54.9	175.6	0	0	0	108.4	C2746 I2802 I2823 F2827 I2831 A2832 L2834 F2867	C2746-I2825 HydrophobicContact CB-CD1 4.34Å; I2802-I2825 HydrophobicContact CD1-CG2 4.06Å; I2802-I2825 HydrophobicContact CG2-CG2 3.7Å; I2823-I2825 HydrophobicContact CG2-CD1 4.15Å; I2823-I2825 HydrophobicContact CG2-CG1 3.93Å; I2825-F2827 HydrophobicContact CG2-CD1 4.24Å; I2825-I2831 CarbonylContact O-C 3.58Å; I2825-I2831 WeakPolarHBondContact O-CA 3.29Å; I2825-A2832 PolarHBondContact N-O 3.48Å; I2825-A2832 PolarHBondContact O-N 3.3Å; I2825-L2834 HydrophobicContact CD1-CD1 3.82Å; I2825-L2834 HydrophobicContact CG1-CD1 4.31Å; I2825-F2867 HydrophobicContact CD1-CE1 4.03Å; I2825-F2867 HydrophobicContact CD1-CZ 3.72Å
2826	A	88.4	Confident	83	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	124.8	175.5	0	0	0	0	0	111.2	I2802 N2803 S2804 E2830 I2831 V2894 M2897	I2802-A2826 WeakPolarHBondContact CA-O 3.37Å; N2803-A2826 PolarHBondContact N-O 2.84Å; S2804-A2826 PolarHBondContact O-N 3.27Å; A2826-E2830 WeakPolarHBondContact CA-O 3.5Å; A2826-I2831 HydrophobicContact CB-CG1 4.32Å; A2826-V2894 HydrophobicContact CB-CB 3.89Å; A2826-V2894 HydrophobicContact CB-CG1 3.62Å; A2826-M2897 HydrophobicContact CB-CE 3.47Å; A2826-M2897 VanDerWaalsContact CB-CE 3.47Å; A2826-M2897 HydrophobicContact CB-CG 4.32Å; A2826-M2897 HydrophobicContact CB-SD 3.78Å
2827	F	85	Confident	84.1	Confident	6 Å²	6	16 Å²	16	3%	0.026	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	105.4	173.2	51	-87.5	0	0	0	109.6	H2793 I2825 Y2829 E2830 A2832 F2867	H2793-F2827 HydrophobicContact CB-CD2 4.29Å; H2793-F2827 HydrophobicContact CB-CE2 4.32Å; H2793-F2827 AromaticContact CE1-CE2 3.31Å; H2793-F2827 WeakPolarHBondContact CE1-CE2 3.29Å; H2793-F2827 AromaticContact CE1-CZ 3.87Å; H2793-F2827 AromaticContact CG-CD2 3.91Å; H2793-F2827 AromaticContact CG-CE2 3.6Å; H2793-F2827 AromaticContact ND1-CD2 3.72Å; H2793-F2827 AromaticContact ND1-CE2 2.94Å; H2793-F2827 WeakPolarHBondContact ND1-CE2 3.29Å; H2793-F2827 AromaticContact ND1-CZ 3.36Å; H2793-F2827 WeakPolarHBondContact ND1-CZ 3.38Å; I2825-F2827 HydrophobicContact CG2-CD1 4.24Å; F2827-Y2829 PolarHBondContact O-N 2.81Å; F2827-Y2829 VanDerWaalsContact O-N 3.16Å; F2827-E2830 HydrophobicContact CD2-CB 3.89Å; F2827-E2830 HydrophobicContact CE1-CB 4.41Å; F2827-E2830 HydrophobicContact CE2-CB 3.23Å; F2827-E2830 HydrophobicContact CE2-CG 4.16Å; F2827-E2830 WeakPolarHBondContact CE2-OE2 3.39Å; F2827-E2830 HydrophobicContact CZ-CB 3.55Å; F2827-E2830 PolarHBondContact N-O 3.16Å; F2827-E2830 PolarHBondContact O-N 2.88Å; F2827-A2832 HydrophobicContact CE1-CB 3.65Å; F2827-A2832 HydrophobicContact CZ-CB 4.25Å; F2827-F2867 HydrophobicContact CE1-CE2 4.26Å
2828	G	80.4	Confident	84.6	Confident	2 Å²	2	14.3 Å²	14.3	2%	0.021	6%	0.063	C	C	.	.	T	Hydrogen-bonded Turn	trans	63	-117	-176.1	0	0	0	0	0	111.7	I2893 V2894	G2828-I2893 CarbonylContact O-C 3.59Å; G2828-I2893 WeakPolarHBondContact O-CA 3.37Å; G2828-V2894 PolarHBondContact O-N 3.38Å
2829	Y	79.7	Confident	84.7	Confident	94 Å²	94	13.5 Å²	13.5	37%	0.369	6%	0.062	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95	1.8	-178	-55.3	-93.1	0	0	0	113.2	Y2800 F2827 K2889 T2890 H2892 I2893	Y2800-Y2829 HydrophobicContact CE1-CE2 4.29Å; F2827-Y2829 PolarHBondContact O-N 2.81Å; F2827-Y2829 VanDerWaalsContact O-N 3.16Å; Y2829-K2889 CarbonylContact O-C 3.57Å; Y2829-K2889 WeakPolarHBondContact O-CA 3.39Å; Y2829-T2890 PolarHBondContact O-N 3.15Å; Y2829-T2890 PolarHBondContact O-OG1 2.85Å; Y2829-T2890 VanDerWaalsContact O-OG1 3.1Å; Y2829-H2892 VanDerWaalsContact CD1-C 3.41Å; Y2829-I2893 HydrophobicContact CD1-CG1 4.13Å; Y2829-I2893 HydrophobicContact CD2-CG1 4.17Å; Y2829-I2893 HydrophobicContact CE1-CG1 3.66Å; Y2829-I2893 HydrophobicContact CE2-CD1 4.18Å; Y2829-I2893 HydrophobicContact CE2-CG1 3.7Å; Y2829-I2893 HydrophobicContact CG-CG1 4.36Å; Y2829-I2893 VanDerWaalsContact CZ-CG1 3.41Å
2830	E	83	Confident	84.2	Confident	34 Å²	34	15.6 Å²	15.6	16%	0.159	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	141.8	-175.3	-80.9	-174.1	-159	0	0	111.2	H2793 A2826 F2827 F2888 K2889	H2793-E2830 IonicContact CE1-OE2 3.1Å; H2793-E2830 PolarHBondContact CE1-OE2 3.39Å; H2793-E2830 IonicContact ND1-OE2 2.95Å; H2793-E2830 IonicContact NE2-OE2 3.94Å; A2826-E2830 WeakPolarHBondContact CA-O 3.5Å; F2827-E2830 HydrophobicContact CD2-CB 3.89Å; F2827-E2830 HydrophobicContact CE1-CB 4.41Å; F2827-E2830 HydrophobicContact CE2-CB 3.23Å; F2827-E2830 HydrophobicContact CE2-CG 4.16Å; F2827-E2830 WeakPolarHBondContact CE2-OE2 3.39Å; F2827-E2830 HydrophobicContact CZ-CB 3.55Å; F2827-E2830 PolarHBondContact N-O 3.16Å; F2827-E2830 PolarHBondContact O-N 2.88Å; E2830-F2888 CarbonylContact C-O 3.58Å; E2830-F2888 VanDerWaalsContact CA-O 3.23Å; E2830-F2888 WeakPolarHBondContact CA-O 3.47Å; E2830-K2889 HydrophobicContact CG-CD 4.45Å; E2830-K2889 HydrophobicContact CG-CG 3.57Å; E2830-K2889 WeakPolarHBondContact OE1-CE 3.49Å; E2830-K2889 IonicContact OE1-NZ 2.74Å
2831	I	85.5	Confident	83.3	Confident	0 Å²	0	21 Å²	21	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	115	171.5	-59.5	165.9	0	0	0	107.2	I2825 A2826 R2887 F2888 T2890 V2894 M2897 A2914 I2924	I2825-I2831 CarbonylContact O-C 3.58Å; I2825-I2831 WeakPolarHBondContact O-CA 3.29Å; A2826-I2831 HydrophobicContact CB-CG1 4.32Å; I2831-R2887 WeakPolarHBondContact O-CA 2.84Å; I2831-F2888 HydrophobicContact CB-CB 4.38Å; I2831-F2888 PolarHBondContact N-O 2.87Å; I2831-F2888 PolarHBondContact O-N 3.3Å; I2831-T2890 HydrophobicContact CD1-CG2 4.25Å; I2831-V2894 HydrophobicContact CD1-CG2 3.91Å; I2831-V2894 HydrophobicContact CG1-CG2 3.96Å; I2831-M2897 HydrophobicContact CD1-SD 3.85Å; I2831-M2897 HydrophobicContact CG1-SD 3.95Å; I2831-M2897 HydrophobicContact CG2-SD 3.96Å; I2831-A2914 HydrophobicContact CD1-CB 4.31Å; I2831-I2924 HydrophobicContact CD1-CD1 3.29Å
2832	A	87.8	Confident	82.1	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	128.7	167.8	0	0	0	0	0	109.3	Y2824 I2825 F2827 L2834 F2867 Q2886	Y2824-A2832 CarbonylContact C-O 3.51Å; Y2824-A2832 WeakPolarHBondContact CA-O 3.15Å; I2825-A2832 PolarHBondContact N-O 3.48Å; I2825-A2832 PolarHBondContact O-N 3.3Å; F2827-A2832 HydrophobicContact CE1-CB 3.65Å; F2827-A2832 HydrophobicContact CZ-CB 4.25Å; A2832-L2834 HydrophobicContact CB-CD1 4.27Å; A2832-F2867 HydrophobicContact CB-CD1 4.39Å; A2832-F2867 HydrophobicContact CB-CE1 4.25Å; A2832-F2867 HydrophobicContact CB-CZ 4.42Å; A2832-Q2886 CarbonylContact C-O 3.58Å; A2832-Q2886 WeakPolarHBondContact CA-O 3.15Å
2833	T	87.2	Confident	80.7	Confident	1 Å²	1	24.7 Å²	24.7	1%	0.006	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	116.7	173.5	-56	0	0	0	0	108.3	F2822 I2823 Y2824 I2885 Q2886 F2888 F2926	F2822-T2833 HydrophobicContact CD1-CG2 4.45Å; I2823-T2833 WeakPolarHBondContact O-CA 3.39Å; Y2824-T2833 HydrophobicContact CD1-CG2 3.67Å; Y2824-T2833 VanDerWaalsContact CD1-OG1 3.26Å; Y2824-T2833 WeakPolarHBondContact CD1-OG1 3.43Å; Y2824-T2833 HydrophobicContact CE1-CG2 3.32Å; Y2824-T2833 WeakPolarHBondContact CE1-OG1 3.25Å; T2833-I2885 WeakPolarHBondContact O-CA 3.46Å; T2833-Q2886 PolarHBondContact N-O 3.15Å; T2833-Q2886 PolarHBondContact O-N 3.47Å; T2833-F2888 WeakPolarHBondContact OG1-CE2 3.35Å; T2833-F2926 HydrophobicContact CG2-CD2 3.97Å; T2833-F2926 HydrophobicContact CG2-CE2 4.11Å
2834	L	87.9	Confident	79.1	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	115.8	174.7	-65.3	76.3	0	0	0	106.6	L2791 F2822 I2823 I2825 A2832 F2867 L2870 W2874 I2885	L2791-L2834 HydrophobicContact CD1-CD2 4.05Å; F2822-L2834 CarbonylContact C-O 3.59Å; F2822-L2834 WeakPolarHBondContact CA-O 3.49Å; I2823-L2834 HydrophobicContact CB-CB 4.19Å; I2823-L2834 PolarHBondContact N-O 3.17Å; I2823-L2834 PolarHBondContact O-N 3.22Å; I2825-L2834 HydrophobicContact CD1-CD1 3.82Å; I2825-L2834 HydrophobicContact CG1-CD1 4.31Å; A2832-L2834 HydrophobicContact CB-CD1 4.27Å; L2834-F2867 HydrophobicContact CD1-CE1 3.9Å; L2834-F2867 HydrophobicContact CD2-CE1 4.33Å; L2834-L2870 HydrophobicContact CD2-CD2 4.04Å; L2834-W2874 HydrophobicContact CB-CH2 3.73Å; L2834-W2874 HydrophobicContact CB-CZ3 3.69Å; L2834-W2874 HydrophobicContact CD2-CH2 3.59Å; L2834-W2874 HydrophobicContact CD2-CZ2 4.34Å; L2834-W2874 HydrophobicContact CD2-CZ3 4.11Å; L2834-W2874 HydrophobicContact CG-CH2 3.96Å; L2834-W2874 HydrophobicContact CG-CZ3 3.99Å; L2834-I2885 HydrophobicContact CG-CG1 4.43Å
2835	H	85.7	Confident	78.2	Confident	7 Å²	7	37.1 Å²	37.1	3%	0.032	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	126.9	-179.8	171.3	-143.9	0	0	0	108.6	D2820 Y2821 F2822 A2883 E2884 F2926	D2820-H2835 IonicContact OD1-NE2 2.76Å; Y2821-H2835 WeakPolarHBondContact O-CA 3.49Å; F2822-H2835 HydrophobicContact CD1-CB 3.96Å; F2822-H2835 AromaticContact CD1-CD2 3.74Å; F2822-H2835 HydrophobicContact CE1-CB 3.94Å; F2822-H2835 AromaticContact CE1-CD2 3.16Å; F2822-H2835 WeakPolarHBondContact CE1-CD2 3.46Å; F2822-H2835 AromaticContact CE1-CG 3.51Å; F2822-H2835 AromaticContact CE1-NE2 3.7Å; F2822-H2835 AromaticContact CZ-CD2 3.49Å; F2822-H2835 VanDerWaalsContact CZ-CD2 3.49Å; F2822-H2835 WeakPolarHBondContact CZ-CD2 3.19Å; F2822-H2835 AromaticContact CZ-NE2 3.62Å; H2835-A2883 CarbonylContact O-C 3.54Å; H2835-A2883 VanDerWaalsContact O-CA 3.23Å; H2835-A2883 WeakPolarHBondContact O-CA 3.14Å; H2835-E2884 HydrophobicContact CB-CG 3.82Å; H2835-E2884 IonicContact CE1-OE1 3.91Å; H2835-E2884 IonicContact CG-OE1 2.71Å; H2835-E2884 PolarHBondContact N-O 3.46Å; H2835-E2884 IonicContact ND1-OE1 2.68Å; H2835-E2884 PolarHBondContact ND1-OE1 3.25Å; H2835-E2884 PolarHBondContact O-N 3.41Å; H2835-F2926 HydrophobicContact CB-CE2 4.02Å; H2835-F2926 HydrophobicContact CB-CZ 4.16Å; H2835-F2926 AromaticContact CG-CZ 3.86Å; H2835-F2926 AromaticContact ND1-CZ 3.44Å; H2835-F2926 WeakPolarHBondContact ND1-CZ 3.5Å
2836	I	85.2	Confident	77.3	Confident	7 Å²	7	42.1 Å²	42.1	4%	0.036	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	116.5	177.7	-55.6	170.3	0	0	0	107.9	Y2821 L2838 L2856 F2857 W2874 A2883	Y2821-I2836 PolarHBondContact N-O 3.35Å; Y2821-I2836 PolarHBondContact O-N 3.02Å; I2836-L2838 HydrophobicContact CG2-CD1 4.29Å; I2836-L2838 HydrophobicContact CG2-CD2 4.33Å; I2836-L2838 HydrophobicContact CG2-CG 4.03Å; I2836-L2856 HydrophobicContact CD1-CD2 3.89Å; I2836-L2856 HydrophobicContact CG1-CD2 4.46Å; I2836-L2856 HydrophobicContact CG2-CD1 4.38Å; I2836-F2857 HydrophobicContact CD1-CE2 4.06Å; I2836-F2857 HydrophobicContact CD1-CZ 3.71Å; I2836-W2874 HydrophobicContact CD1-CH2 4.01Å; I2836-W2874 HydrophobicContact CD1-CZ2 4.33Å; I2836-W2874 HydrophobicContact CG1-CH2 3.96Å; I2836-W2874 HydrophobicContact CG1-CZ3 4.32Å; I2836-A2883 HydrophobicContact CG1-CB 4.3Å
2837	Q	81.6	Confident	76.7	Confident	61 Å²	61	47.2 Å²	47.2	29%	0.285	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	122.8	175.9	174.7	162.9	65.3	0	0	109.9	D2820 G2881 Y2882	D2820-Q2837 VanDerWaalsContact OD1-CB 3.23Å; D2820-Q2837 WeakPolarHBondContact OD1-CB 3.19Å; D2820-Q2837 VanDerWaalsContact OD1-CD 3.26Å; D2820-Q2837 WeakPolarHBondContact OD1-CG 3.36Å; D2820-Q2837 PolarHBondContact OD1-NE2 3.22Å; Q2837-G2881 VanDerWaalsContact O-CA 3.27Å; Q2837-G2881 WeakPolarHBondContact O-CA 3.49Å; Q2837-Y2882 PolarHBondContact N-O 2.89Å; Q2837-Y2882 PolarHBondContact O-N 2.97Å
2838	L	77.8	Confident	76.3	Confident	2 Å²	2	49.9 Å²	49.9	1%	0.01	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	137.3	178.7	-64.2	172.6	0	0	0	110.9	K2818 I2819 Y2821 I2836 L2849 I2852 I2853	K2818-L2838 WeakPolarHBondContact CA-O 3.38Å; I2819-L2838 PolarHBondContact N-O 3.08Å; I2819-L2838 PolarHBondContact O-N 3.17Å; Y2821-L2838 HydrophobicContact CD2-CD1 4.27Å; Y2821-L2838 HydrophobicContact CE2-CD1 3.94Å; I2836-L2838 HydrophobicContact CG2-CD1 4.29Å; I2836-L2838 HydrophobicContact CG2-CD2 4.33Å; I2836-L2838 HydrophobicContact CG2-CG 4.03Å; L2838-L2849 HydrophobicContact CB-CD1 4.11Å; L2838-L2849 HydrophobicContact CD1-CD1 3.7Å; L2838-L2849 HydrophobicContact CG-CD1 4.44Å; L2838-I2852 HydrophobicContact CD2-CG2 3.96Å; L2838-I2853 HydrophobicContact CD1-CD1 3.54Å; L2838-I2853 HydrophobicContact CD1-CG1 3.58Å
2839	N	73.5	Confident	76	Confident	49 Å²	49	50 Å²	50	26%	0.262	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	106.3	174.8	-173.3	2.6	0	0	0	109.8	K2818 D2841 S2842 L2843	K2818-N2839 HydrophobicContact CG-CB 4.37Å; N2839-D2841 VanDerWaalsContact C-N 3.29Å; N2839-D2841 PolarHBondContact O-N 2.92Å; N2839-D2841 PolarHBondContact OD1-N 3.37Å; N2839-S2842 WeakPolarHBondContact CB-OG 3.45Å; N2839-S2842 PolarHBondContact O-OG 2.88Å; N2839-L2843 WeakPolarHBondContact O-CD1 3.42Å
2840	H	69.6	Low	76	Confident	56 Å²	56	46.4 Å²	46.4	26%	0.259	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-25.8	-178.7	-83.2	-105	0	0	0	113.3	T2817 I2819 L2843 L2849	T2817-H2840 WeakPolarHBondContact O-CB 3.31Å; T2817-H2840 PolarHBondContact O-N 2.83Å; I2819-H2840 WeakPolarHBondContact CD1-CD2 3.47Å; I2819-H2840 WeakPolarHBondContact CD1-NE2 3.45Å; I2819-H2840 VanDerWaalsContact CG1-CD2 3.41Å; I2819-H2840 WeakPolarHBondContact CG1-CD2 3.29Å; H2840-L2843 PolarHBondContact O-N 2.81Å; H2840-L2843 VanDerWaalsContact O-O 3.12Å; H2840-L2849 WeakPolarHBondContact CE1-CD2 3.39Å
2841	D	65.1	Low	75.8	Confident	117 Å²	117	48.7 Å²	48.7	63%	0.626	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-33.2	-178.6	-95.2	13.7	0	0	0	113.2	T2817 N2839 L2843	T2817-D2841 HydrophobicContact CG2-CB 4.26Å; T2817-D2841 VanDerWaalsContact CG2-OD1 3.25Å; T2817-D2841 WeakPolarHBondContact CG2-OD1 3.32Å; T2817-D2841 WeakPolarHBondContact CG2-OD2 3.37Å; N2839-D2841 VanDerWaalsContact C-N 3.29Å; N2839-D2841 PolarHBondContact O-N 2.92Å; N2839-D2841 PolarHBondContact OD1-N 3.37Å; D2841-L2843 PolarHBondContact O-N 2.86Å
2842	S	60.5	Low	75.5	Confident	56 Å²	56	50.5 Å²	50.5	39%	0.392	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-19	174.3	38.7	0	0	0	0	112.3	N2839	N2839-S2842 WeakPolarHBondContact CB-OG 3.45Å; N2839-S2842 PolarHBondContact O-OG 2.88Å
2843	L	58.5	Low	75	Confident	22 Å²	22	50.7 Å²	50.7	12%	0.115	26%	0.262	C	S	.	.			trans	-97.7	97.4	-176.5	-73.3	158	0	0	0	109.5	N2839 H2840 D2841 N2845 D2848 L2849 I2852	N2839-L2843 WeakPolarHBondContact O-CD1 3.42Å; H2840-L2843 PolarHBondContact O-N 2.81Å; H2840-L2843 VanDerWaalsContact O-O 3.12Å; D2841-L2843 PolarHBondContact O-N 2.86Å; L2843-N2845 PolarHBondContact O-N 3.26Å; L2843-D2848 HydrophobicContact CD2-CB 3.67Å; L2843-L2849 HydrophobicContact CD1-CB 4.26Å; L2843-L2849 HydrophobicContact CD1-CD1 3.6Å; L2843-I2852 HydrophobicContact CD1-CD1 4.08Å; L2843-I2852 HydrophobicContact CD2-CD1 3.34Å; L2843-I2852 HydrophobicContact CD2-CG1 4.41Å; L2843-I2852 HydrophobicContact CG-CD1 4.25Å
2844	M	58.4	Low	74.6	Confident	164 Å²	164	52 Å²	52	81%	0.808	27%	0.269	S	S	*	.	S	Bend	trans	-61.1	-16.7	-172.9	-66	-73.7	-78.8	0	0	114.1
2845	N	70.9	Confident	74.1	Confident	101 Å²	101	58.8 Å²	58.8	54%	0.54	30%	0.301	S	S	.	.	S	Bend	trans	-144.5	151	179.1	-66.6	-52.9	0	0	0	113.5	L2843 I2847 D2848 L2849	L2843-N2845 PolarHBondContact O-N 3.26Å; N2845-I2847 PolarHBondContact O-N 3.18Å; N2845-I2847 VanDerWaalsContact O-N 3.16Å; N2845-D2848 PolarHBondContact O-N 3.14Å; N2845-L2849 PolarHBondContact O-N 3.29Å
2846	E	72.7	Confident	73.6	Confident	105 Å²	105	60 Å²	60	49%	0.491	31%	0.308	S	S	.	.	H	α-helix	trans	-53.8	-33.4	171.4	-74.4	-175	161.1	0	0	112.6	T2731 D2848 L2849 E2850	T2731-E2846 HydrophobicContact CG2-CB 4.33Å; E2846-D2848 VanDerWaalsContact C-N 3.33Å; E2846-D2848 PolarHBondContact O-N 3.01Å; E2846-L2849 WeakPolarHBondContact O-CB 3.44Å; E2846-L2849 PolarHBondContact O-N 3.29Å; E2846-E2850 WeakPolarHBondContact O-CG 3.44Å; E2846-E2850 PolarHBondContact O-N 3.03Å
2847	I	75.9	Confident	73.2	Confident	107 Å²	107	59.7 Å²	59.7	55%	0.549	31%	0.306	S	S	.	.	H	α-helix	trans	-65.6	-36	179.4	-61.2	168.9	0	0	0	111.7	N2845 E2850 N2851	N2845-I2847 PolarHBondContact O-N 3.18Å; N2845-I2847 VanDerWaalsContact O-N 3.16Å; I2847-E2850 PolarHBondContact O-N 3.35Å; I2847-N2851 VanDerWaalsContact O-CG 3.29Å; I2847-N2851 PolarHBondContact O-N 2.78Å; I2847-N2851 PolarHBondContact O-ND2 2.82Å; I2847-N2851 VanDerWaalsContact O-ND2 3.16Å
2848	D	75.7	Confident	72.5	Confident	63 Å²	63	59.3 Å²	59.3	34%	0.337	31%	0.31	S	S	.	.	H	α-helix	trans	-70.5	-39	-179.3	-62.7	-34.9	0	0	0	110.3	L2843 N2845 E2846 N2851 I2852	L2843-D2848 HydrophobicContact CD2-CB 3.67Å; N2845-D2848 PolarHBondContact O-N 3.14Å; E2846-D2848 VanDerWaalsContact C-N 3.33Å; E2846-D2848 PolarHBondContact O-N 3.01Å; D2848-N2851 PolarHBondContact O-N 3.11Å; D2848-I2852 WeakPolarHBondContact O-CG1 3.44Å; D2848-I2852 PolarHBondContact O-N 2.88Å
2849	L	74.7	Confident	71.7	Confident	4 Å²	4	60.5 Å²	60.5	2%	0.021	32%	0.316	C	S	.	.	H	α-helix	trans	-60.7	-45.7	172.2	-176.7	81.9	0	0	0	111.7	V2730 T2731 L2838 H2840 L2843 N2845 E2846 N2851 I2852 I2853	V2730-L2849 HydrophobicContact CG1-CD2 3.88Å; V2730-L2849 HydrophobicContact CG1-CG 4.29Å; T2731-L2849 HydrophobicContact CG2-CD2 3.73Å; L2838-L2849 HydrophobicContact CB-CD1 4.11Å; L2838-L2849 HydrophobicContact CD1-CD1 3.7Å; L2838-L2849 HydrophobicContact CG-CD1 4.44Å; H2840-L2849 WeakPolarHBondContact CE1-CD2 3.39Å; L2843-L2849 HydrophobicContact CD1-CB 4.26Å; L2843-L2849 HydrophobicContact CD1-CD1 3.6Å; N2845-L2849 PolarHBondContact O-N 3.29Å; E2846-L2849 WeakPolarHBondContact O-CB 3.44Å; E2846-L2849 PolarHBondContact O-N 3.29Å; L2849-N2851 VanDerWaalsContact C-N 3.34Å; L2849-N2851 PolarHBondContact O-N 2.86Å; L2849-I2852 PolarHBondContact O-N 3.48Å; L2849-I2853 PolarHBondContact O-N 2.87Å; L2849-I2853 VanDerWaalsContact O-N 3.15Å
2850	E	78.3	Confident	70.9	Confident	19 Å²	19	70 Å²	70	9%	0.089	35%	0.348	C	S	.	.	H	α-helix	trans	-58.6	-47.1	176.4	-71.1	177.1	-169.4	0	0	111	T2731 L2734 E2846 I2847 I2852 I2853 L2854	T2731-E2850 HydrophobicContact CG2-CG 3.83Å; T2731-E2850 PolarHBondContact OG1-OE1 2.93Å; L2734-E2850 HydrophobicContact CB-CG 3.7Å; L2734-E2850 HydrophobicContact CD2-CB 3.89Å; L2734-E2850 HydrophobicContact CD2-CG 3.8Å; L2734-E2850 HydrophobicContact CG-CG 4.39Å; E2846-E2850 WeakPolarHBondContact O-CG 3.44Å; E2846-E2850 PolarHBondContact O-N 3.03Å; I2847-E2850 PolarHBondContact O-N 3.35Å; E2850-I2852 PolarHBondContact O-N 3Å; E2850-I2853 PolarHBondContact O-N 2.93Å; E2850-L2854 WeakPolarHBondContact O-CB 3.44Å; E2850-L2854 VanDerWaalsContact O-CD1 3.32Å; E2850-L2854 WeakPolarHBondContact O-CD1 3.21Å; E2850-L2854 WeakPolarHBondContact O-CG 3.36Å; E2850-L2854 PolarHBondContact O-N 2.91Å
2851	N	79.2	Confident	70.4	Confident	82 Å²	82	75.2 Å²	75.2	44%	0.439	37%	0.37	S	S	.	.	H	α-helix	trans	-61.8	-41.3	178.9	-72.9	-33.2	0	0	0	112.7	I2847 D2848 L2849 L2854 E2855	I2847-N2851 VanDerWaalsContact O-CG 3.29Å; I2847-N2851 PolarHBondContact O-N 2.78Å; I2847-N2851 PolarHBondContact O-ND2 2.82Å; I2847-N2851 VanDerWaalsContact O-ND2 3.16Å; D2848-N2851 PolarHBondContact O-N 3.11Å; L2849-N2851 VanDerWaalsContact C-N 3.34Å; L2849-N2851 PolarHBondContact O-N 2.86Å; N2851-L2854 PolarHBondContact O-N 2.93Å; N2851-E2855 VanDerWaalsContact O-CB 3.28Å; N2851-E2855 WeakPolarHBondContact O-CB 3.46Å; N2851-E2855 PolarHBondContact O-N 3.32Å
2852	I	78.6	Confident	70.3	Confident	37 Å²	37	75.7 Å²	75.7	19%	0.19	37%	0.369	C	S	.	.	H	α-helix	trans	-62.2	-46	178.2	-73.3	178.7	0	0	0	111.1	L2838 L2843 D2848 L2849 E2850 L2854 E2855 L2856 D2880	L2838-I2852 HydrophobicContact CD2-CG2 3.96Å; L2843-I2852 HydrophobicContact CD1-CD1 4.08Å; L2843-I2852 HydrophobicContact CD2-CD1 3.34Å; L2843-I2852 HydrophobicContact CD2-CG1 4.41Å; L2843-I2852 HydrophobicContact CG-CD1 4.25Å; D2848-I2852 WeakPolarHBondContact O-CG1 3.44Å; D2848-I2852 PolarHBondContact O-N 2.88Å; L2849-I2852 PolarHBondContact O-N 3.48Å; E2850-I2852 PolarHBondContact O-N 3Å; I2852-L2854 VanDerWaalsContact C-N 3.34Å; I2852-L2854 PolarHBondContact O-N 2.85Å; I2852-E2855 PolarHBondContact O-N 3.24Å; I2852-L2856 VanDerWaalsContact O-CB 3.3Å; I2852-L2856 WeakPolarHBondContact O-CB 3.29Å; I2852-L2856 PolarHBondContact O-N 3Å; I2852-D2880 HydrophobicContact CD1-CB 4.22Å
2853	I	77.8	Confident	70.8	Confident	5 Å²	5	76.4 Å²	76.4	3%	0.026	37%	0.368	C	S	.	.	H	α-helix	trans	-64.8	-41.8	179.3	-69.3	-165.6	0	0	0	111.1	V2730 L2736 L2838 L2849 E2850 E2855 L2856 F2857	V2730-I2853 HydrophobicContact CB-CD1 4.16Å; V2730-I2853 HydrophobicContact CG1-CD1 3.33Å; V2730-I2853 HydrophobicContact CG1-CG1 4.46Å; V2730-I2853 HydrophobicContact CG2-CD1 3.7Å; L2736-I2853 HydrophobicContact CD1-CG2 3.77Å; L2736-I2853 HydrophobicContact CD2-CG2 4.38Å; L2736-I2853 HydrophobicContact CG-CG2 4.44Å; L2838-I2853 HydrophobicContact CD1-CD1 3.54Å; L2838-I2853 HydrophobicContact CD1-CG1 3.58Å; L2849-I2853 PolarHBondContact O-N 2.87Å; L2849-I2853 VanDerWaalsContact O-N 3.15Å; E2850-I2853 PolarHBondContact O-N 2.93Å; I2853-E2855 VanDerWaalsContact C-N 3.33Å; I2853-L2856 PolarHBondContact O-N 3.15Å; I2853-F2857 HydrophobicContact CG2-CD2 4.1Å; I2853-F2857 HydrophobicContact CG2-CE2 4.11Å; I2853-F2857 VanDerWaalsContact O-CD2 3.28Å; I2853-F2857 WeakPolarHBondContact O-CD2 3.35Å; I2853-F2857 PolarHBondContact O-N 2.87Å
2854	L	79.5	Confident	71.6	Confident	27 Å²	27	78.9 Å²	78.9	14%	0.141	38%	0.381	C	S	.	.	H	α-helix	trans	-64.3	-40.5	176.2	-65.1	162.7	0	0	0	111.4	L2734 A2750 Y2752 L2788 E2850 N2851 I2852 F2857 S2858	L2734-L2854 HydrophobicContact CD1-CD2 4.4Å; L2734-L2854 HydrophobicContact CD2-CG 4.4Å; A2750-L2854 HydrophobicContact CB-CD2 3.98Å; Y2752-L2854 WeakPolarHBondContact OH-CD1 3.39Å; Y2752-L2854 VanDerWaalsContact OH-CD2 3.29Å; Y2752-L2854 WeakPolarHBondContact OH-CD2 2.94Å; L2788-L2854 HydrophobicContact CD1-CD2 4.14Å; L2788-L2854 HydrophobicContact CD2-CD2 3.58Å; L2788-L2854 HydrophobicContact CG-CD2 4.48Å; E2850-L2854 WeakPolarHBondContact O-CB 3.44Å; E2850-L2854 VanDerWaalsContact O-CD1 3.32Å; E2850-L2854 WeakPolarHBondContact O-CD1 3.21Å; E2850-L2854 WeakPolarHBondContact O-CG 3.36Å; E2850-L2854 PolarHBondContact O-N 2.91Å; N2851-L2854 PolarHBondContact O-N 2.93Å; I2852-L2854 VanDerWaalsContact C-N 3.34Å; I2852-L2854 PolarHBondContact O-N 2.85Å; L2854-F2857 PolarHBondContact O-N 3.06Å; L2854-S2858 WeakPolarHBondContact O-CA 3.24Å; L2854-S2858 WeakPolarHBondContact O-CB 3.26Å; L2854-S2858 PolarHBondContact O-N 2.99Å; L2854-S2858 PolarHBondContact O-OG 2.97Å
2855	E	77.3	Confident	72.5	Confident	143 Å²	143	71.1 Å²	71.1	67%	0.668	34%	0.343	S	S	*	.	H	α-helix	trans	-64	-43.6	177.9	-168.7	168.5	-172.7	0	0	111.1	N2851 I2852 I2853 F2857 S2858	N2851-E2855 VanDerWaalsContact O-CB 3.28Å; N2851-E2855 WeakPolarHBondContact O-CB 3.46Å; N2851-E2855 PolarHBondContact O-N 3.32Å; I2852-E2855 PolarHBondContact O-N 3.24Å; I2853-E2855 VanDerWaalsContact C-N 3.33Å; E2855-F2857 PolarHBondContact O-N 2.7Å; E2855-S2858 WeakPolarHBondContact CA-OG 3.27Å; E2855-S2858 PolarHBondContact O-N 3.38Å; E2855-S2858 PolarHBondContact O-OG 3.47Å
2856	L	75.6	Confident	73	Confident	34 Å²	34	66.9 Å²	66.9	18%	0.178	32%	0.32	C	S	.	.	H	α-helix	trans	-59.5	-30.8	178.9	-169.2	142	0	0	0	113.3	I2836 I2852 I2853 W2874 A2883	I2836-L2856 HydrophobicContact CD1-CD2 3.89Å; I2836-L2856 HydrophobicContact CG1-CD2 4.46Å; I2836-L2856 HydrophobicContact CG2-CD1 4.38Å; I2852-L2856 VanDerWaalsContact O-CB 3.3Å; I2852-L2856 WeakPolarHBondContact O-CB 3.29Å; I2852-L2856 PolarHBondContact O-N 3Å; I2853-L2856 PolarHBondContact O-N 3.15Å; L2856-W2874 HydrophobicContact CD2-CH2 4.37Å; L2856-W2874 HydrophobicContact CD2-CZ2 3.43Å; L2856-W2874 VanDerWaalsContact CD2-CZ2 3.43Å; L2856-A2883 HydrophobicContact CD1-CB 4.06Å
2857	F	75.7	Confident	73.3	Confident	0 Å²	0	62 Å²	62	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-99.5	-22.1	175.1	-68.2	-65.8	0	0	0	114.7	L2736 I2748 L2788 I2789 I2836 I2853 L2854 E2855 N2859 W2874	L2736-F2857 HydrophobicContact CD1-CD2 4.45Å; L2736-F2857 HydrophobicContact CD1-CE2 3.84Å; I2748-F2857 HydrophobicContact CD1-CD1 3.95Å; I2748-F2857 HydrophobicContact CD1-CE1 3.46Å; I2748-F2857 VanDerWaalsContact CD1-CE1 3.46Å; I2748-F2857 HydrophobicContact CD1-CZ 3.92Å; L2788-F2857 HydrophobicContact CB-CB 3.87Å; L2788-F2857 HydrophobicContact CD1-CB 4.06Å; L2788-F2857 HydrophobicContact CD1-CD2 4.23Å; L2788-F2857 HydrophobicContact CD1-CG 4.45Å; I2789-F2857 HydrophobicContact CG2-CB 4.26Å; I2789-F2857 HydrophobicContact CG2-CD1 3.78Å; I2789-F2857 HydrophobicContact CG2-CG 4.36Å; I2836-F2857 HydrophobicContact CD1-CE2 4.06Å; I2836-F2857 HydrophobicContact CD1-CZ 3.71Å; I2853-F2857 HydrophobicContact CG2-CD2 4.1Å; I2853-F2857 HydrophobicContact CG2-CE2 4.11Å; I2853-F2857 VanDerWaalsContact O-CD2 3.28Å; I2853-F2857 WeakPolarHBondContact O-CD2 3.35Å; I2853-F2857 PolarHBondContact O-N 2.87Å; L2854-F2857 PolarHBondContact O-N 3.06Å; E2855-F2857 PolarHBondContact O-N 2.7Å; F2857-N2859 VanDerWaalsContact C-N 3.32Å; F2857-N2859 PolarHBondContact O-N 2.96Å; F2857-W2874 HydrophobicContact CD1-CZ2 4.47Å; F2857-W2874 HydrophobicContact CE1-CH2 4.36Å; F2857-W2874 AromaticContact CE1-CZ2 3.77Å; F2857-W2874 HydrophobicContact CE1-CZ2 3.77Å; F2857-W2874 HydrophobicContact CZ-CZ2 4.24Å
2858	S	67.3	Low	73.2	Confident	52 Å²	52	61.5 Å²	61.5	36%	0.364	30%	0.295	S	S	.	.	H	α-helix	trans	-78.2	-10.9	-173.7	68.1	0	0	0	0	114.9	L2854 E2855 R2860 K2861	L2854-S2858 WeakPolarHBondContact O-CA 3.24Å; L2854-S2858 WeakPolarHBondContact O-CB 3.26Å; L2854-S2858 PolarHBondContact O-N 2.99Å; L2854-S2858 PolarHBondContact O-OG 2.97Å; E2855-S2858 WeakPolarHBondContact CA-OG 3.27Å; E2855-S2858 PolarHBondContact O-N 3.38Å; E2855-S2858 PolarHBondContact O-OG 3.47Å; S2858-R2860 PolarHBondContact O-N 2.76Å; S2858-K2861 PolarHBondContact O-N 2.93Å
2859	N	60.8	Low	73.2	Confident	28 Å²	28	61.6 Å²	61.6	15%	0.15	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	29.4	59.8	166.7	-80.2	-28.4	0	0	0	115.5	F2857 K2861 Q2862 I2865	F2857-N2859 VanDerWaalsContact C-N 3.32Å; F2857-N2859 PolarHBondContact O-N 2.96Å; N2859-K2861 PolarHBondContact O-N 2.86Å; N2859-Q2862 PolarHBondContact O-N 3.1Å; N2859-I2865 HydrophobicContact CB-CD1 3.45Å; N2859-I2865 VanDerWaalsContact CB-CD1 3.45Å; N2859-I2865 WeakPolarHBondContact ND2-CD1 3.31Å
2860	R	57.6	Low	73.3	Confident	248 Å²	248	61.4 Å²	61.4	94%	0.936	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	50.1	31.5	177.8	-59.3	-173.9	178.6	-177	2.2	114.7	S2858	S2858-R2860 PolarHBondContact O-N 2.76Å
2861	K	58.5	Low	73.3	Confident	165 Å²	165	63.6 Å²	63.6	72%	0.717	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	78.2	8.7	-178	-46.8	174.6	179	179.5	0	115.9	S2858 N2859 L2863	S2858-K2861 PolarHBondContact O-N 2.93Å; N2859-K2861 PolarHBondContact O-N 2.86Å; K2861-L2863 PolarHBondContact O-N 2.89Å
2862	Q	63.4	Low	72.9	Confident	127 Å²	127	63.7 Å²	63.7	59%	0.593	31%	0.308	S	S	*	.			trans	-80	108.6	167.3	-85.2	-176.7	-21.3	0	0	109.6	N2859 I2865	N2859-Q2862 PolarHBondContact O-N 3.1Å; Q2862-I2865 HydrophobicContact CB-CD1 4.11Å; Q2862-I2865 HydrophobicContact CB-CG1 4.24Å
2863	L	70	Confident	72.5	Confident	71 Å²	71	65.5 Å²	65.5	37%	0.372	32%	0.318	S	S	.	.			trans	-86	-20.3	-178.6	-62.5	159.4	0	0	0	112.7	L2716 L2788 I2789 R2790 K2861	L2716-L2863 HydrophobicContact CD1-CB 3.52Å; L2716-L2863 HydrophobicContact CD1-CD1 3.28Å; L2716-L2863 HydrophobicContact CD1-CD2 3.94Å; L2716-L2863 HydrophobicContact CD1-CG 3.72Å; L2716-L2863 HydrophobicContact CD2-CB 4.46Å; L2716-L2863 HydrophobicContact CG-CB 4.48Å; L2788-L2863 WeakPolarHBondContact O-CD2 3.48Å; I2789-L2863 CarbonylContact C-O 3.59Å; R2790-L2863 WeakPolarHBondContact CB-O 3.36Å; R2790-L2863 PolarHBondContact N-O 3.08Å; K2861-L2863 PolarHBondContact O-N 2.89Å
2864	N	75.9	Confident	72.2	Confident	75 Å²	75	65.9 Å²	65.9	40%	0.401	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	111.2	-179.2	-67.5	-12.7	0	0	0	109.5	R2790	R2790-N2864 WeakPolarHBondContact CB-OD1 3.38Å; R2790-N2864 VanDerWaalsContact CD-OD1 3.28Å; R2790-N2864 WeakPolarHBondContact CD-OD1 2.95Å
2865	I	77.7	Confident	71.3	Confident	1 Å²	1	68.7 Å²	68.7	1%	0.005	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	145.3	-176	-65.5	177.9	0	0	0	108.2	I2789 R2790 L2791 T2792 N2859 Q2862 E2869 L2870 L2873	I2789-I2865 HydrophobicContact CD1-CB 4.07Å; I2789-I2865 HydrophobicContact CD1-CD1 3.8Å; I2789-I2865 HydrophobicContact CD1-CG1 4.27Å; I2789-I2865 HydrophobicContact CG1-CB 4.44Å; R2790-I2865 PolarHBondContact O-N 2.86Å; L2791-I2865 WeakPolarHBondContact CA-O 3.47Å; T2792-I2865 PolarHBondContact N-O 2.82Å; T2792-I2865 VanDerWaalsContact N-O 3.08Å; N2859-I2865 HydrophobicContact CB-CD1 3.45Å; N2859-I2865 VanDerWaalsContact CB-CD1 3.45Å; N2859-I2865 WeakPolarHBondContact ND2-CD1 3.31Å; Q2862-I2865 HydrophobicContact CB-CD1 4.11Å; Q2862-I2865 HydrophobicContact CB-CG1 4.24Å; I2865-E2869 HydrophobicContact CG2-CB 3.77Å; I2865-L2870 HydrophobicContact CG2-CB 4.04Å; I2865-L2870 HydrophobicContact CG2-CD1 4.49Å; I2865-L2873 HydrophobicContact CD1-CD1 4.31Å
2866	N	81.2	Confident	70.3	Confident	12 Å²	12	67.7 Å²	67.7	6%	0.064	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	159.9	173.3	75.1	47.3	0	0	0	111.6	T2792 Y2795 I2868 E2869 L2870	T2792-N2866 CarbonylContact O-C 3.59Å; T2792-N2866 WeakPolarHBondContact O-CA 3.41Å; T2792-N2866 WeakPolarHBondContact O-CB 3.49Å; Y2795-N2866 WeakPolarHBondContact CD2-ND2 3.41Å; Y2795-N2866 HydrophobicContact CE2-CB 4.4Å; Y2795-N2866 WeakPolarHBondContact CE2-ND2 3.49Å; N2866-I2868 PolarHBondContact O-N 3.05Å; N2866-I2868 VanDerWaalsContact O-N 3.11Å; N2866-I2868 VanDerWaalsContact OD1-CA 3.3Å; N2866-I2868 WeakPolarHBondContact OD1-CA 3.43Å; N2866-I2868 VanDerWaalsContact OD1-CB 3.25Å; N2866-I2868 WeakPolarHBondContact OD1-CB 3.3Å; N2866-I2868 PolarHBondContact OD1-N 3.26Å; N2866-E2869 PolarHBondContact N-OE2 3.48Å; N2866-E2869 VanDerWaalsContact ND2-CD 3.26Å; N2866-E2869 PolarHBondContact ND2-OE1 2.82Å; N2866-E2869 PolarHBondContact ND2-OE2 2.7Å; N2866-E2869 PolarHBondContact O-N 3.43Å; N2866-E2869 WeakPolarHBondContact OD1-CG 3.43Å; N2866-E2869 PolarHBondContact OD1-N 3.46Å; N2866-L2870 PolarHBondContact O-N 2.7Å
2867	F	78.7	Confident	69.1	Low	3 Å²	3	73.6 Å²	73.6	1%	0.013	37%	0.365	C	S	.	.	H	α-helix	trans	-61.6	-20.4	179.6	-75.9	-69.4	0	0	0	114.3	L2791 T2792 I2825 F2827 A2832 L2834 N2871 R2887	L2791-F2867 HydrophobicContact CB-CE1 4.07Å; L2791-F2867 HydrophobicContact CB-CE2 4.34Å; L2791-F2867 HydrophobicContact CB-CZ 3.9Å; L2791-F2867 HydrophobicContact CD1-CE1 3.79Å; L2791-F2867 HydrophobicContact CD1-CZ 4.26Å; L2791-F2867 HydrophobicContact CG-CE1 4.45Å; T2792-F2867 PolarHBondContact O-N 3.4Å; I2825-F2867 HydrophobicContact CD1-CE1 4.03Å; I2825-F2867 HydrophobicContact CD1-CZ 3.72Å; F2827-F2867 HydrophobicContact CE1-CE2 4.26Å; A2832-F2867 HydrophobicContact CB-CD1 4.39Å; A2832-F2867 HydrophobicContact CB-CE1 4.25Å; A2832-F2867 HydrophobicContact CB-CZ 4.42Å; L2834-F2867 HydrophobicContact CD1-CE1 3.9Å; L2834-F2867 HydrophobicContact CD2-CE1 4.33Å; F2867-N2871 WeakPolarHBondContact O-CB 3.47Å; F2867-N2871 PolarHBondContact O-N 3.27Å; F2867-R2887 PolarHBondContact O-NH2 2.87Å
2868	I	73.3	Confident	68.1	Low	96 Å²	96	77.9 Å²	77.9	49%	0.492	39%	0.392	S	S	.	.	H	α-helix	trans	-76.5	-47.5	178.5	-57.5	173.6	0	0	0	109.3	N2866 N2871 T2872	N2866-I2868 PolarHBondContact O-N 3.05Å; N2866-I2868 VanDerWaalsContact O-N 3.11Å; N2866-I2868 VanDerWaalsContact OD1-CA 3.3Å; N2866-I2868 WeakPolarHBondContact OD1-CA 3.43Å; N2866-I2868 VanDerWaalsContact OD1-CB 3.25Å; N2866-I2868 WeakPolarHBondContact OD1-CB 3.3Å; N2866-I2868 PolarHBondContact OD1-N 3.26Å; I2868-N2871 WeakPolarHBondContact O-CB 3.44Å; I2868-N2871 PolarHBondContact O-N 3.19Å; I2868-T2872 PolarHBondContact O-N 3.22Å
2869	E	75.4	Confident	67.3	Low	65 Å²	65	84.6 Å²	84.6	30%	0.304	42%	0.42	S	S	.	.	H	α-helix	trans	-64.8	-39	175.4	-71.5	171.1	170.8	0	0	111.7	Y2795 I2865 N2866 N2871 T2872 L2873	Y2795-E2869 VanDerWaalsContact CE2-OE1 3.29Å; Y2795-E2869 WeakPolarHBondContact CE2-OE1 3.36Å; Y2795-E2869 PolarHBondContact OH-OE1 3.01Å; Y2795-E2869 PolarHBondContact OH-OE2 3.4Å; I2865-E2869 HydrophobicContact CG2-CB 3.77Å; N2866-E2869 PolarHBondContact N-OE2 3.48Å; N2866-E2869 VanDerWaalsContact ND2-CD 3.26Å; N2866-E2869 PolarHBondContact ND2-OE1 2.82Å; N2866-E2869 PolarHBondContact ND2-OE2 2.7Å; N2866-E2869 PolarHBondContact O-N 3.43Å; N2866-E2869 WeakPolarHBondContact OD1-CG 3.43Å; N2866-E2869 PolarHBondContact OD1-N 3.46Å; E2869-N2871 VanDerWaalsContact C-N 3.26Å; E2869-N2871 PolarHBondContact O-N 3.14Å; E2869-T2872 WeakPolarHBondContact CA-OG1 3.38Å; E2869-T2872 PolarHBondContact O-N 3.4Å; E2869-T2872 PolarHBondContact O-OG1 2.62Å; E2869-L2873 WeakPolarHBondContact O-CB 3.4Å; E2869-L2873 WeakPolarHBondContact O-CD1 3.17Å; E2869-L2873 VanDerWaalsContact O-CG 3.22Å; E2869-L2873 WeakPolarHBondContact O-CG 3.39Å; E2869-L2873 PolarHBondContact O-N 3.11Å
2870	L	78.2	Confident	67.2	Low	0 Å²	0	87 Å²	87	0%	0	43%	0.432	C	S	.	.	H	α-helix	trans	-62.1	-39.4	174	-168.2	72.1	0	0	0	110.7	I2789 L2791 L2834 I2865 N2866 L2873 W2874 I2885	I2789-L2870 HydrophobicContact CD1-CD1 3.94Å; L2791-L2870 HydrophobicContact CD1-CD2 4.13Å; L2791-L2870 HydrophobicContact CD2-CD1 4.46Å; L2791-L2870 HydrophobicContact CD2-CD2 3.71Å; L2791-L2870 HydrophobicContact CD2-CG 4.45Å; L2834-L2870 HydrophobicContact CD2-CD2 4.04Å; I2865-L2870 HydrophobicContact CG2-CB 4.04Å; I2865-L2870 HydrophobicContact CG2-CD1 4.49Å; N2866-L2870 PolarHBondContact O-N 2.7Å; L2870-L2873 PolarHBondContact O-N 2.96Å; L2870-W2874 HydrophobicContact CD1-CZ2 4.41Å; L2870-W2874 HydrophobicContact CD2-CD2 4.42Å; L2870-W2874 HydrophobicContact CD2-CH2 4.23Å; L2870-W2874 HydrophobicContact CD2-CZ2 3.77Å; L2870-W2874 HydrophobicContact CG-CD2 4.15Å; L2870-W2874 HydrophobicContact CG-CG 4.42Å; L2870-W2874 HydrophobicContact CG-CZ2 4.19Å; L2870-W2874 WeakPolarHBondContact O-CB 3.3Å; L2870-W2874 PolarHBondContact O-N 2.69Å; L2870-I2885 HydrophobicContact CB-CD1 3.73Å; L2870-I2885 HydrophobicContact CD2-CD1 3.58Å; L2870-I2885 HydrophobicContact CG-CD1 3.71Å
2871	N	77	Confident	67.4	Low	65 Å²	65	76.1 Å²	76.1	35%	0.348	40%	0.398	S	S	.	.	H	α-helix	trans	-65.9	-42.4	178	-166.7	39.1	0	0	0	112.1	F2867 I2868 E2869 L2873 W2874 S2875 I2885	F2867-N2871 WeakPolarHBondContact O-CB 3.47Å; F2867-N2871 PolarHBondContact O-N 3.27Å; I2868-N2871 WeakPolarHBondContact O-CB 3.44Å; I2868-N2871 PolarHBondContact O-N 3.19Å; E2869-N2871 VanDerWaalsContact C-N 3.26Å; E2869-N2871 PolarHBondContact O-N 3.14Å; N2871-L2873 VanDerWaalsContact C-N 3.27Å; N2871-L2873 PolarHBondContact O-N 2.58Å; N2871-W2874 PolarHBondContact O-N 3.24Å; N2871-S2875 WeakPolarHBondContact O-CB 3.48Å; N2871-S2875 PolarHBondContact O-N 3.49Å; N2871-I2885 HydrophobicContact CB-CB 4.18Å; N2871-I2885 HydrophobicContact CB-CD1 4.03Å; N2871-I2885 HydrophobicContact CB-CG1 4.34Å
2872	T	71.4	Confident	68.2	Low	84 Å²	84	72.3 Å²	72.3	52%	0.515	38%	0.38	S	S	.	.	H	α-helix	trans	-64.3	-35	176.3	58.1	0	0	0	0	111.6	I2868 E2869 S2875	I2868-T2872 PolarHBondContact O-N 3.22Å; E2869-T2872 WeakPolarHBondContact CA-OG1 3.38Å; E2869-T2872 PolarHBondContact O-N 3.4Å; E2869-T2872 PolarHBondContact O-OG1 2.62Å; T2872-S2875 PolarHBondContact O-OG 2.96Å
2873	L	70.1	Confident	69	Low	74 Å²	74	66.6 Å²	66.6	39%	0.387	35%	0.354	S	S	.	.	H	α-helix	trans	-69.1	-43.8	174.7	-70.3	167	0	0	0	112.7	I2865 E2869 L2870 N2871 S2875	I2865-L2873 HydrophobicContact CD1-CD1 4.31Å; E2869-L2873 WeakPolarHBondContact O-CB 3.4Å; E2869-L2873 WeakPolarHBondContact O-CD1 3.17Å; E2869-L2873 VanDerWaalsContact O-CG 3.22Å; E2869-L2873 WeakPolarHBondContact O-CG 3.39Å; E2869-L2873 PolarHBondContact O-N 3.11Å; L2870-L2873 PolarHBondContact O-N 2.96Å; N2871-L2873 VanDerWaalsContact C-N 3.27Å; N2871-L2873 PolarHBondContact O-N 2.58Å; L2873-S2875 VanDerWaalsContact C-N 3.33Å; L2873-S2875 PolarHBondContact O-N 3.37Å
2874	W	71.6	Confident	69.6	Low	14 Å²	14	65 Å²	65	5%	0.053	35%	0.345	C	S	.	.	H	α-helix	trans	-71.3	-25.4	-179.4	-74.9	6.6	0	0	0	113.7	L2834 I2836 L2856 F2857 L2870 N2871 I2876 A2883 E2884 I2885	L2834-W2874 HydrophobicContact CB-CH2 3.73Å; L2834-W2874 HydrophobicContact CB-CZ3 3.69Å; L2834-W2874 HydrophobicContact CD2-CH2 3.59Å; L2834-W2874 HydrophobicContact CD2-CZ2 4.34Å; L2834-W2874 HydrophobicContact CD2-CZ3 4.11Å; L2834-W2874 HydrophobicContact CG-CH2 3.96Å; L2834-W2874 HydrophobicContact CG-CZ3 3.99Å; I2836-W2874 HydrophobicContact CD1-CH2 4.01Å; I2836-W2874 HydrophobicContact CD1-CZ2 4.33Å; I2836-W2874 HydrophobicContact CG1-CH2 3.96Å; I2836-W2874 HydrophobicContact CG1-CZ3 4.32Å; L2856-W2874 HydrophobicContact CD2-CH2 4.37Å; L2856-W2874 HydrophobicContact CD2-CZ2 3.43Å; L2856-W2874 VanDerWaalsContact CD2-CZ2 3.43Å; F2857-W2874 HydrophobicContact CD1-CZ2 4.47Å; F2857-W2874 HydrophobicContact CE1-CH2 4.36Å; F2857-W2874 AromaticContact CE1-CZ2 3.77Å; F2857-W2874 HydrophobicContact CE1-CZ2 3.77Å; F2857-W2874 HydrophobicContact CZ-CZ2 4.24Å; L2870-W2874 HydrophobicContact CD1-CZ2 4.41Å; L2870-W2874 HydrophobicContact CD2-CD2 4.42Å; L2870-W2874 HydrophobicContact CD2-CH2 4.23Å; L2870-W2874 HydrophobicContact CD2-CZ2 3.77Å; L2870-W2874 HydrophobicContact CG-CD2 4.15Å; L2870-W2874 HydrophobicContact CG-CG 4.42Å; L2870-W2874 HydrophobicContact CG-CZ2 4.19Å; L2870-W2874 WeakPolarHBondContact O-CB 3.3Å; L2870-W2874 PolarHBondContact O-N 2.69Å; N2871-W2874 PolarHBondContact O-N 3.24Å; W2874-I2876 PolarHBondContact O-N 2.85Å; W2874-A2883 HydrophobicContact CB-CB 4.1Å; W2874-A2883 HydrophobicContact CD2-CB 3.68Å; W2874-A2883 HydrophobicContact CE3-CB 3.68Å; W2874-A2883 HydrophobicContact CG-CB 3.88Å; W2874-A2883 HydrophobicContact CZ3-CB 4.23Å; W2874-E2884 WeakPolarHBondContact CZ3-O 3.42Å; W2874-I2885 HydrophobicContact CD2-CD1 4.37Å; W2874-I2885 HydrophobicContact CD2-CG1 4.21Å; W2874-I2885 HydrophobicContact CE3-CD1 3.96Å; W2874-I2885 HydrophobicContact CE3-CG1 3.38Å; W2874-I2885 HydrophobicContact CZ3-CD1 4.27Å; W2874-I2885 HydrophobicContact CZ3-CG1 3.66Å
2875	S	61.4	Low	69.8	Low	85 Å²	85	62.1 Å²	62.1	59%	0.594	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-10.6	178.4	71	0	0	0	0	115	N2871 T2872 L2873 Q2877	N2871-S2875 WeakPolarHBondContact O-CB 3.48Å; N2871-S2875 PolarHBondContact O-N 3.49Å; T2872-S2875 PolarHBondContact O-OG 2.96Å; L2873-S2875 VanDerWaalsContact C-N 3.33Å; L2873-S2875 PolarHBondContact O-N 3.37Å; S2875-Q2877 PolarHBondContact O-N 3.06Å
2876	I	56.3	Low	69.9	Low	122 Å²	122	64.6 Å²	64.6	63%	0.626	34%	0.341	S	S	*	.	S	Bend	trans	-86.3	98	174.6	-53.3	171.7	0	0	0	108.4	W2874 T2878	W2874-I2876 PolarHBondContact O-N 2.85Å; I2876-T2878 PolarHBondContact O-N 2.63Å
2877	Q	50.3	Low	69.9	Low	158 Å²	158	68.5 Å²	68.5	74%	0.738	36%	0.355	S	S	*	.			trans	-51.4	122.9	173.9	-79.3	-178.1	-14.3	0	0	111	S2875 Y2882	S2875-Q2877 PolarHBondContact O-N 3.06Å; Q2877-Y2882 HydrophobicContact CG-CD2 4.26Å
2878	T	53.2	Low	69.9	Low	91 Å²	91	69.4 Å²	69.4	56%	0.558	36%	0.359	S	S	*	.	B	Isolated β-bridge	trans	-91.8	153.2	167.6	55.1	0	0	0	0	109.2	I2876 D2880 G2881	I2876-T2878 PolarHBondContact O-N 2.63Å; T2878-D2880 PolarHBondContact O-N 2.81Å; T2878-G2881 PolarHBondContact OG1-O 3.46Å
2879	M	51.4	Low	70.3	Confident	193 Å²	193	72.1 Å²	72.1	95%	0.951	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-20	-175.3	-80.4	-89	169.4	0	0	113.9
2880	D	57.8	Low	70.5	Confident	77 Å²	77	69.5 Å²	69.5	41%	0.412	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.6	3.7	-168	-55.2	-45.7	0	0	0	114.2	I2852 T2878	I2852-D2880 HydrophobicContact CD1-CB 4.22Å; T2878-D2880 PolarHBondContact O-N 2.81Å
2881	G	63.6	Low	70.4	Confident	21 Å²	21	74.8 Å²	74.8	22%	0.216	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.4	164.2	-179.1	0	0	0	0	0	114.7	Q2837 T2878	Q2837-G2881 VanDerWaalsContact O-CA 3.27Å; Q2837-G2881 WeakPolarHBondContact O-CA 3.49Å; T2878-G2881 PolarHBondContact OG1-O 3.46Å
2882	Y	75	Confident	70.5	Confident	85 Å²	85	75.3 Å²	75.3	33%	0.333	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	136.4	178.3	174.8	-106.5	0	0	0	110	Q2837 Q2877 E2884	Q2837-Y2882 PolarHBondContact N-O 2.89Å; Q2837-Y2882 PolarHBondContact O-N 2.97Å; Q2877-Y2882 HydrophobicContact CG-CD2 4.26Å; Y2882-E2884 HydrophobicContact CE1-CB 3.84Å; Y2882-E2884 HydrophobicContact CE1-CG 3.73Å; Y2882-E2884 WeakPolarHBondContact OH-CB 3.42Å; Y2882-E2884 PolarHBondContact OH-OE2 3.38Å
2883	A	79	Confident	70.8	Confident	7 Å²	7	73.7 Å²	73.7	6%	0.058	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	137.3	173.8	0	0	0	0	0	110.6	H2835 I2836 L2856 W2874	H2835-A2883 CarbonylContact O-C 3.54Å; H2835-A2883 VanDerWaalsContact O-CA 3.23Å; H2835-A2883 WeakPolarHBondContact O-CA 3.14Å; I2836-A2883 HydrophobicContact CG1-CB 4.3Å; L2856-A2883 HydrophobicContact CD1-CB 4.06Å; W2874-A2883 HydrophobicContact CB-CB 4.1Å; W2874-A2883 HydrophobicContact CD2-CB 3.68Å; W2874-A2883 HydrophobicContact CE3-CB 3.68Å; W2874-A2883 HydrophobicContact CG-CB 3.88Å; W2874-A2883 HydrophobicContact CZ3-CB 4.23Å
2884	E	82.4	Confident	71.4	Confident	37 Å²	37	70.2 Å²	70.2	17%	0.173	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	155.4	178.5	66.6	175.9	149.9	0	0	111.8	H2835 W2874 Y2882 Q2886 F2926	H2835-E2884 HydrophobicContact CB-CG 3.82Å; H2835-E2884 IonicContact CE1-OE1 3.91Å; H2835-E2884 IonicContact CG-OE1 2.71Å; H2835-E2884 PolarHBondContact N-O 3.46Å; H2835-E2884 IonicContact ND1-OE1 2.68Å; H2835-E2884 PolarHBondContact ND1-OE1 3.25Å; H2835-E2884 PolarHBondContact O-N 3.41Å; W2874-E2884 WeakPolarHBondContact CZ3-O 3.42Å; Y2882-E2884 HydrophobicContact CE1-CB 3.84Å; Y2882-E2884 HydrophobicContact CE1-CG 3.73Å; Y2882-E2884 WeakPolarHBondContact OH-CB 3.42Å; Y2882-E2884 PolarHBondContact OH-OE2 3.38Å; E2884-Q2886 PolarHBondContact OE1-NE2 3.23Å; E2884-Q2886 PolarHBondContact OE2-NE2 3.24Å; E2884-F2926 WeakPolarHBondContact OE1-CZ 3.43Å
2885	I	80.6	Confident	71.9	Confident	14 Å²	14	72.8 Å²	72.8	7%	0.072	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	117.2	173.5	-52.2	-177.3	0	0	0	108.9	T2833 L2834 L2870 N2871 W2874	T2833-I2885 WeakPolarHBondContact O-CA 3.46Å; L2834-I2885 HydrophobicContact CG-CG1 4.43Å; L2870-I2885 HydrophobicContact CB-CD1 3.73Å; L2870-I2885 HydrophobicContact CD2-CD1 3.58Å; L2870-I2885 HydrophobicContact CG-CD1 3.71Å; N2871-I2885 HydrophobicContact CB-CB 4.18Å; N2871-I2885 HydrophobicContact CB-CD1 4.03Å; N2871-I2885 HydrophobicContact CB-CG1 4.34Å; W2874-I2885 HydrophobicContact CD2-CD1 4.37Å; W2874-I2885 HydrophobicContact CD2-CG1 4.21Å; W2874-I2885 HydrophobicContact CE3-CD1 3.96Å; W2874-I2885 HydrophobicContact CE3-CG1 3.38Å; W2874-I2885 HydrophobicContact CZ3-CD1 4.27Å; W2874-I2885 HydrophobicContact CZ3-CG1 3.66Å
2886	Q	80.1	Confident	73.2	Confident	54 Å²	54	70.4 Å²	70.4	25%	0.252	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	146.4	172.1	-62.6	-177.9	6	0	0	109.8	A2832 T2833 E2884 F2888	A2832-Q2886 CarbonylContact C-O 3.58Å; A2832-Q2886 WeakPolarHBondContact CA-O 3.15Å; T2833-Q2886 PolarHBondContact N-O 3.15Å; T2833-Q2886 PolarHBondContact O-N 3.47Å; E2884-Q2886 PolarHBondContact OE1-NE2 3.23Å; E2884-Q2886 PolarHBondContact OE2-NE2 3.24Å; Q2886-F2888 HydrophobicContact CB-CE2 3.85Å; Q2886-F2888 HydrophobicContact CB-CZ 4.1Å
2887	R	81.5	Confident	74.8	Confident	93 Å²	93	65 Å²	65	35%	0.351	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	133.2	177.7	-64	-174.4	-168.9	173.2	6.4	110.1	I2831 F2867	I2831-R2887 WeakPolarHBondContact O-CA 2.84Å; F2867-R2887 PolarHBondContact O-NH2 2.87Å
2888	F	78.8	Confident	76.6	Confident	22 Å²	22	58.3 Å²	58.3	10%	0.096	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	138	178.2	-58.4	-85	0	0	0	109	E2830 I2831 T2833 Q2886 I2924	E2830-F2888 CarbonylContact C-O 3.58Å; E2830-F2888 VanDerWaalsContact CA-O 3.23Å; E2830-F2888 WeakPolarHBondContact CA-O 3.47Å; I2831-F2888 HydrophobicContact CB-CB 4.38Å; I2831-F2888 PolarHBondContact N-O 2.87Å; I2831-F2888 PolarHBondContact O-N 3.3Å; T2833-F2888 WeakPolarHBondContact OG1-CE2 3.35Å; Q2886-F2888 HydrophobicContact CB-CE2 3.85Å; Q2886-F2888 HydrophobicContact CB-CZ 4.1Å; F2888-I2924 HydrophobicContact CD1-CG2 4.25Å; F2888-I2924 HydrophobicContact CG-CG2 4.22Å
2889	K	81.2	Confident	78.2	Confident	154 Å²	154	54.4 Å²	54.4	67%	0.67	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.9	138	172.9	-82	-179.4	176	-178.1	0	109.8	Y2829 E2830	Y2829-K2889 CarbonylContact O-C 3.57Å; Y2829-K2889 WeakPolarHBondContact O-CA 3.39Å; E2830-K2889 HydrophobicContact CG-CD 4.45Å; E2830-K2889 HydrophobicContact CG-CG 3.57Å; E2830-K2889 WeakPolarHBondContact OE1-CE 3.49Å; E2830-K2889 IonicContact OE1-NZ 2.74Å
2890	T	78.7	Confident	79.7	Confident	10 Å²	10	46 Å²	46	6%	0.061	23%	0.227	C	C	.	.			trans	-110.2	159.1	173.6	55	0	0	0	0	110	Y2829 I2831 H2892 V2894 L2916 I2924	Y2829-T2890 PolarHBondContact O-N 3.15Å; Y2829-T2890 PolarHBondContact O-OG1 2.85Å; Y2829-T2890 VanDerWaalsContact O-OG1 3.1Å; I2831-T2890 HydrophobicContact CD1-CG2 4.25Å; T2890-H2892 VanDerWaalsContact C-N 3.3Å; T2890-H2892 WeakPolarHBondContact CB-O 3.17Å; T2890-H2892 PolarHBondContact O-N 3.39Å; T2890-H2892 PolarHBondContact OG1-O 2.78Å; T2890-V2894 HydrophobicContact CG2-CG2 3.91Å; T2890-L2916 HydrophobicContact CG2-CD2 4.11Å; T2890-I2924 HydrophobicContact CG2-CD1 4.29Å
2891	D	77.4	Confident	80.7	Confident	111 Å²	111	44.1 Å²	44.1	59%	0.594	22%	0.216	S	C	*	.	S	Bend	trans	-72.8	-26.8	180	-59.3	-36.3	0	0	0	112.3
2892	H	78.1	Confident	81.1	Confident	75 Å²	75	48.1 Å²	48.1	35%	0.347	23%	0.229	S	C	.	.	S	Bend	trans	-130.3	167.5	179.9	-65.1	-74.9	0	0	0	111.7	Y2829 T2890 V2894 L2916 N2918	Y2829-H2892 VanDerWaalsContact CD1-C 3.41Å; T2890-H2892 VanDerWaalsContact C-N 3.3Å; T2890-H2892 WeakPolarHBondContact CB-O 3.17Å; T2890-H2892 PolarHBondContact O-N 3.39Å; T2890-H2892 PolarHBondContact OG1-O 2.78Å; H2892-V2894 PolarHBondContact O-N 2.88Å; H2892-L2916 HydrophobicContact CB-CB 4.07Å; H2892-L2916 HydrophobicContact CB-CD1 4.29Å; H2892-N2918 VanDerWaalsContact CD2-CG 3.46Å; H2892-N2918 PolarHBondContact CD2-ND2 3.27Å; H2892-N2918 PolarHBondContact NE2-ND2 3.26Å
2893	I	78.3	Confident	81	Confident	51 Å²	51	51.8 Å²	51.8	26%	0.262	25%	0.249	S	C	.	.			trans	-66.4	130.7	-178.3	-64.9	174.8	0	0	0	109.4	G2828 Y2829 V2895 L2916 S2917	G2828-I2893 CarbonylContact O-C 3.59Å; G2828-I2893 WeakPolarHBondContact O-CA 3.37Å; Y2829-I2893 HydrophobicContact CD1-CG1 4.13Å; Y2829-I2893 HydrophobicContact CD2-CG1 4.17Å; Y2829-I2893 HydrophobicContact CE1-CG1 3.66Å; Y2829-I2893 HydrophobicContact CE2-CD1 4.18Å; Y2829-I2893 HydrophobicContact CE2-CG1 3.7Å; Y2829-I2893 HydrophobicContact CG-CG1 4.36Å; Y2829-I2893 VanDerWaalsContact CZ-CG1 3.41Å; I2893-V2895 PolarHBondContact O-N 3.46Å; I2893-L2916 CarbonylContact O-C 3.58Å; I2893-L2916 WeakPolarHBondContact O-CA 3.29Å; I2893-S2917 PolarHBondContact N-OG 2.92Å; I2893-S2917 PolarHBondContact O-N 3.06Å
2894	V	83.3	Confident	80.9	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	120.1	174.8	-178.8	0	0	0	0	109	N2803 A2826 G2828 I2831 T2890 H2892 M2897 A2914 L2916	N2803-V2894 WeakPolarHBondContact CB-O 3.14Å; N2803-V2894 PolarHBondContact ND2-O 3.17Å; A2826-V2894 HydrophobicContact CB-CB 3.89Å; A2826-V2894 HydrophobicContact CB-CG1 3.62Å; G2828-V2894 PolarHBondContact O-N 3.38Å; I2831-V2894 HydrophobicContact CD1-CG2 3.91Å; I2831-V2894 HydrophobicContact CG1-CG2 3.96Å; T2890-V2894 HydrophobicContact CG2-CG2 3.91Å; H2892-V2894 PolarHBondContact O-N 2.88Å; V2894-M2897 HydrophobicContact CG1-CG 3.58Å; V2894-M2897 HydrophobicContact CG1-SD 4.18Å; V2894-A2914 HydrophobicContact CG1-CB 4.09Å; V2894-L2916 HydrophobicContact CG2-CD2 3.88Å
2895	V	82.4	Confident	80.4	Confident	68 Å²	68	52.9 Å²	52.9	41%	0.412	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	-52.1	-177.6	179.7	0	0	0	0	110.7	I2893 L2915	I2893-V2895 PolarHBondContact O-N 3.46Å; V2895-L2915 PolarHBondContact N-O 3.09Å
2896	E	86.9	Confident	80.1	Confident	35 Å²	35	56 Å²	56	16%	0.164	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	150.2	-179.9	-168.7	169.7	-147.8	0	0	109.4	L2915 S2951 I2952 R2996	E2896-L2915 PolarHBondContact O-N 2.84Å; E2896-S2951 WeakPolarHBondContact OE2-CA 3.43Å; E2896-I2952 HydrophobicContact CB-CG2 4.06Å; E2896-I2952 HydrophobicContact CG-CG2 4.04Å; E2896-I2952 PolarHBondContact OE2-N 2.97Å; E2896-R2996 IonicContact OE1-CZ 3.6Å; E2896-R2996 IonicContact OE1-NH1 3.48Å; E2896-R2996 PolarHBondContact OE1-NH1 2.82Å; E2896-R2996 IonicContact OE1-NH2 3.78Å
2897	M	90.6	Very high	79.9	Confident	9 Å²	9	55 Å²	55	4%	0.044	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	153.4	174.8	-64.6	-173.2	-61	0	0	110.1	S2804 V2806 A2826 I2831 V2894 V2912 V2913 A2914	S2804-M2897 WeakPolarHBondContact O-CE 3.26Å; S2804-M2897 PolarHBondContact OG-N 2.94Å; S2804-M2897 VanDerWaalsContact OG-N 3.12Å; V2806-M2897 HydrophobicContact CG2-CB 3.58Å; V2806-M2897 HydrophobicContact CG2-CE 4.43Å; V2806-M2897 WeakPolarHBondContact CG2-O 3.45Å; A2826-M2897 HydrophobicContact CB-CE 3.47Å; A2826-M2897 VanDerWaalsContact CB-CE 3.47Å; A2826-M2897 HydrophobicContact CB-CG 4.32Å; A2826-M2897 HydrophobicContact CB-SD 3.78Å; I2831-M2897 HydrophobicContact CD1-SD 3.85Å; I2831-M2897 HydrophobicContact CG1-SD 3.95Å; I2831-M2897 HydrophobicContact CG2-SD 3.96Å; V2894-M2897 HydrophobicContact CG1-CG 3.58Å; V2894-M2897 HydrophobicContact CG1-SD 4.18Å; M2897-V2912 HydrophobicContact SD-CG2 4.26Å; M2897-V2913 CarbonylContact C-O 3.21Å; M2897-V2913 VanDerWaalsContact CA-O 3.29Å; M2897-V2913 WeakPolarHBondContact CA-O 3.38Å; M2897-A2914 HydrophobicContact CG-CB 4.18Å
2898	S	88.2	Confident	79.5	Confident	17 Å²	17	56.3 Å²	56.3	12%	0.119	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	154.2	170.2	-160.1	0	0	0	0	110.2	V2912 V2913 T2954	S2898-V2912 CarbonylContact O-C 3.55Å; S2898-V2912 VanDerWaalsContact O-CA 3.27Å; S2898-V2912 WeakPolarHBondContact O-CA 3.33Å; S2898-V2912 WeakPolarHBondContact O-CB 3.3Å; S2898-V2913 PolarHBondContact N-O 3.28Å; S2898-V2913 PolarHBondContact O-N 2.78Å; S2898-T2954 PolarHBondContact OG-N 3.45Å; S2898-T2954 PolarHBondContact OG-OG1 3.18Å
2899	T	86.9	Confident	79.4	Confident	10 Å²	10	58.1 Å²	58.1	6%	0.061	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	140.7	174.2	41.7	0	0	0	0	109.4	V2806 T2807 Q2808 H2902 T2954	V2806-T2899 HydrophobicContact CG1-CG2 3.25Å; T2807-T2899 WeakPolarHBondContact O-CG2 3.28Å; Q2808-T2899 HydrophobicContact CB-CG2 3.89Å; Q2808-T2899 HydrophobicContact CG-CG2 4.03Å; T2899-H2902 PolarHBondContact OG1-CE1 3.48Å; T2899-H2902 PolarHBondContact OG1-ND1 3.24Å; T2899-T2954 VanDerWaalsContact O-CB 3.26Å; T2899-T2954 WeakPolarHBondContact O-CB 3.01Å; T2899-T2954 WeakPolarHBondContact O-CG2 3.27Å; T2899-T2954 PolarHBondContact O-OG1 3.41Å
2900	L	82.8	Confident	79.3	Confident	15 Å²	15	50.8 Å²	50.8	8%	0.079	26%	0.261	C	S	.	.	S	Bend	trans	-63.2	-46.7	175.3	-176.7	63.1	0	0	0	110.8	G2911 V2913 I2923 F2972	L2900-G2911 WeakPolarHBondContact CB-O 3.48Å; L2900-G2911 PolarHBondContact N-O 2.73Å; L2900-V2913 HydrophobicContact CD1-CG2 3.65Å; L2900-I2923 HydrophobicContact CD1-CD1 4.48Å; L2900-I2923 HydrophobicContact CD1-CG2 3.76Å; L2900-I2923 HydrophobicContact CD2-CG2 4.15Å; L2900-F2972 HydrophobicContact CD1-CE1 3.95Å; L2900-F2972 WeakPolarHBondContact O-CE1 3.42Å; L2900-F2972 WeakPolarHBondContact O-CZ 3.19Å
2901	H	78.3	Confident	79.6	Confident	39 Å²	39	50.3 Å²	50.3	18%	0.181	26%	0.258	C	S	.	.			trans	-132.2	134.6	172.5	-67.4	-79.7	0	0	0	110.1	Q2808 P2904 Q2909 F2972	Q2808-H2901 PolarHBondContact NE2-O 3.36Å; H2901-P2904 HydrophobicContact CB-CB 4.49Å; H2901-Q2909 HydrophobicContact CB-CB 4.4Å; H2901-Q2909 VanDerWaalsContact CD2-CB 3.47Å; H2901-Q2909 WeakPolarHBondContact CD2-CB 3.19Å; H2901-Q2909 PolarHBondContact CD2-O 3.4Å; H2901-F2972 AromaticContact CE1-CD2 3.43Å; H2901-F2972 VanDerWaalsContact CE1-CD2 3.43Å; H2901-F2972 WeakPolarHBondContact CE1-CD2 3.46Å; H2901-F2972 AromaticContact CE1-CE2 3.58Å; H2901-F2972 AromaticContact CE1-CG 3.71Å; H2901-F2972 AromaticContact ND1-CD2 3.86Å; H2901-F2972 AromaticContact ND1-CE2 3.59Å
2902	H	73.2	Confident	80.2	Confident	105 Å²	105	45.1 Å²	45.1	49%	0.486	23%	0.23	S	C	.	.	S	Bend	trans	-66.4	-37.8	179	-74.5	-66.6	0	0	0	113.1	T2899 T2954	T2899-H2902 PolarHBondContact OG1-CE1 3.48Å; T2899-H2902 PolarHBondContact OG1-ND1 3.24Å; H2902-T2954 PolarHBondContact NE2-O 3.14Å; H2902-T2954 PolarHBondContact NE2-OG1 2.89Å
2903	E	73.3	Confident	80.7	Confident	162 Å²	162	41.5 Å²	41.5	76%	0.757	21%	0.214	S	C	*	.	S	Bend	trans	-125.9	81.9	177	-67.3	-175.8	168.4	0	0	108.9	V2905	E2903-V2905 PolarHBondContact O-N 3.15Å
2904	P	75.1	Confident	81.2	Confident	6 Å²	6	39.1 Å²	39.1	4%	0.039	20%	0.201	C	C	.	.			trans	-70	131.9	178.8	31.2	-35.1	0	0	0	109.9	Q2808 H2901 Q2909	Q2808-P2904 HydrophobicContact CG-CG 4.13Å; H2901-P2904 HydrophobicContact CB-CB 4.49Å; P2904-Q2909 HydrophobicContact CB-CB 3.77Å
2905	V	72.9	Confident	81.4	Confident	60 Å²	60	39.2 Å²	39.2	36%	0.364	20%	0.202	S	C	.	.	S	Bend	trans	-91	-26.3	177.2	-172.6	0	0	0	0	111	D2813 E2903	D2813-V2905 HydrophobicContact CB-CG1 4.37Å; D2813-V2905 WeakPolarHBondContact OD2-CG1 3.28Å; E2903-V2905 PolarHBondContact O-N 3.15Å
2906	N	74.7	Confident	81.6	Confident	80 Å²	80	36.1 Å²	36.1	43%	0.428	18%	0.183	S	C	.	.	S	Bend	trans	-133.3	154.1	-178.5	-67.1	-44.2	0	0	0	111.4	N2908 Q2909	N2906-N2908 PolarHBondContact O-N 2.85Å; N2906-N2908 VanDerWaalsContact O-N 3.13Å; N2906-Q2909 WeakPolarHBondContact O-CB 3.42Å; N2906-Q2909 PolarHBondContact O-N 3.15Å
2907	M	74.5	Confident	81.1	Confident	34 Å²	34	37.4 Å²	37.4	17%	0.167	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-56.4	-30.5	177.3	-74.9	-62.9	-78.3	0	0	114.2	M2812 F2822 Q2909 C2910 F2926	M2812-M2907 HydrophobicContact CE-CB 4.31Å; M2812-M2907 HydrophobicContact CE-CG 3.66Å; M2812-M2907 HydrophobicContact SD-CB 4.46Å; M2812-M2907 HydrophobicContact SD-CG 3.71Å; M2812-M2907 PolarHBondContact SD-N 3.14Å; M2812-M2907 VanDerWaalsContact SD-N 3.4Å; M2812-M2907 HydrophobicContact SD-SD 4.22Å; F2822-M2907 HydrophobicContact CZ-CE 3.92Å; F2822-M2907 HydrophobicContact CZ-SD 4.05Å; M2907-Q2909 PolarHBondContact O-N 2.78Å; M2907-C2910 WeakPolarHBondContact O-CB 3.11Å; M2907-C2910 PolarHBondContact O-N 3.1Å; M2907-F2926 HydrophobicContact CE-CD1 3.54Å; M2907-F2926 HydrophobicContact CE-CE1 3.32Å; M2907-F2926 HydrophobicContact CE-CZ 4.42Å
2908	N	73.9	Confident	80.3	Confident	119 Å²	119	39.2 Å²	39.2	64%	0.636	21%	0.206	S	C	*	.	G	3₁₀ helix	trans	-67.9	-16.7	177	-63.6	-4	0	0	0	113	N2906 Q2927	N2906-N2908 PolarHBondContact O-N 2.85Å; N2906-N2908 VanDerWaalsContact O-N 3.13Å; N2908-Q2927 PolarHBondContact OD1-OE1 2.55Å
2909	Q	76.2	Confident	79.6	Confident	60 Å²	60	39 Å²	39	28%	0.28	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-91.9	-7	175	-67.3	176.9	-21.6	0	0	112.2	H2901 P2904 N2906 M2907	H2901-Q2909 HydrophobicContact CB-CB 4.4Å; H2901-Q2909 VanDerWaalsContact CD2-CB 3.47Å; H2901-Q2909 WeakPolarHBondContact CD2-CB 3.19Å; H2901-Q2909 PolarHBondContact CD2-O 3.4Å; P2904-Q2909 HydrophobicContact CB-CB 3.77Å; N2906-Q2909 WeakPolarHBondContact O-CB 3.42Å; N2906-Q2909 PolarHBondContact O-N 3.15Å; M2907-Q2909 PolarHBondContact O-N 2.78Å
2910	C	80.4	Confident	79.3	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.007	22%	0.222	C	C	.	.			trans	-79	134.7	173.2	-60.3	0	0	0	0	109.7	F2822 M2907 F2926	F2822-C2910 HydrophobicContact CE2-CB 4.12Å; F2822-C2910 HydrophobicContact CZ-CB 4.21Å; M2907-C2910 WeakPolarHBondContact O-CB 3.11Å; M2907-C2910 PolarHBondContact O-N 3.1Å; C2910-F2926 HydrophobicContact CB-CB 4.01Å; C2910-F2926 WeakPolarHBondContact O-CB 3.45Å; C2910-F2926 PolarHBondContact O-N 3.39Å
2911	G	84.7	Confident	79.4	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	153.9	-179.6	-174.6	0	0	0	0	0	112.5	Y2824 L2900 I2924	Y2824-G2911 PolarHBondContact OH-N 3.14Å; L2900-G2911 WeakPolarHBondContact CB-O 3.48Å; L2900-G2911 PolarHBondContact N-O 2.73Å; G2911-I2924 CarbonylContact C-O 3.56Å; G2911-I2924 VanDerWaalsContact CA-O 3.25Å; G2911-I2924 WeakPolarHBondContact CA-O 3.38Å
2912	V	88.6	Confident	79.8	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.006	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	151.5	179.9	-68	0	0	0	0	111.8	V2806 Y2824 M2897 S2898 I2924	V2806-V2912 HydrophobicContact CB-CG1 4.37Å; V2806-V2912 HydrophobicContact CG1-CG1 4.26Å; Y2824-V2912 HydrophobicContact CD1-CG1 3.7Å; Y2824-V2912 HydrophobicContact CD1-CG2 4.22Å; Y2824-V2912 HydrophobicContact CD2-CG1 3.39Å; Y2824-V2912 HydrophobicContact CE1-CG1 4.06Å; Y2824-V2912 HydrophobicContact CE2-CG1 3.78Å; Y2824-V2912 HydrophobicContact CG-CG1 3.34Å; M2897-V2912 HydrophobicContact SD-CG2 4.26Å; S2898-V2912 CarbonylContact O-C 3.55Å; S2898-V2912 VanDerWaalsContact O-CA 3.27Å; S2898-V2912 WeakPolarHBondContact O-CA 3.33Å; S2898-V2912 WeakPolarHBondContact O-CB 3.3Å; V2912-I2924 HydrophobicContact CG2-CB 4.01Å; V2912-I2924 HydrophobicContact CG2-CD1 4.47Å; V2912-I2924 PolarHBondContact N-O 3.39Å; V2912-I2924 PolarHBondContact O-N 3.01Å
2913	V	88.7	Confident	80.4	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	123.3	164.5	-166	0	0	0	0	107.2	M2897 S2898 L2900 V2921 V2922 I2923 I2952 T2954 I2959	M2897-V2913 CarbonylContact C-O 3.21Å; M2897-V2913 VanDerWaalsContact CA-O 3.29Å; M2897-V2913 WeakPolarHBondContact CA-O 3.38Å; S2898-V2913 PolarHBondContact N-O 3.28Å; S2898-V2913 PolarHBondContact O-N 2.78Å; L2900-V2913 HydrophobicContact CD1-CG2 3.65Å; V2913-V2921 HydrophobicContact CG1-CG1 3.45Å; V2913-V2921 VanDerWaalsContact CG1-CG1 3.45Å; V2913-V2922 CarbonylContact C-O 3.57Å; V2913-V2922 WeakPolarHBondContact CA-O 3.37Å; V2913-I2923 HydrophobicContact CG1-CG1 4.27Å; V2913-I2923 HydrophobicContact CG2-CG1 4.29Å; V2913-I2952 HydrophobicContact CB-CD1 4.04Å; V2913-I2952 HydrophobicContact CG1-CD1 3.43Å; V2913-I2952 VanDerWaalsContact CG1-CD1 3.43Å; V2913-T2954 HydrophobicContact CG2-CG2 4.02Å; V2913-I2959 HydrophobicContact CG1-CD1 4.15Å; V2913-I2959 HydrophobicContact CG1-CG2 4.37Å; V2913-I2959 HydrophobicContact CG2-CD1 3.88Å; V2913-I2959 HydrophobicContact CG2-CG1 4.3Å
2914	A	89.1	Confident	80.9	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	132.4	-177	0	0	0	0	0	110.4	I2831 V2894 M2897 V2921 V2922 I2924	I2831-A2914 HydrophobicContact CD1-CB 4.31Å; V2894-A2914 HydrophobicContact CG1-CB 4.09Å; M2897-A2914 HydrophobicContact CG-CB 4.18Å; A2914-V2921 WeakPolarHBondContact O-CA 3.37Å; A2914-V2922 PolarHBondContact N-O 3.44Å; A2914-V2922 PolarHBondContact O-N 2.65Å; A2914-I2924 HydrophobicContact CB-CD1 4.14Å
2915	L	88	Confident	81.1	Confident	2 Å²	2	30.5 Å²	30.5	1%	0.01	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	126.4	167.2	172.7	61.3	0	0	0	109.1	V2895 E2896 V2921 C2949 I2952	V2895-L2915 PolarHBondContact N-O 3.09Å; E2896-L2915 PolarHBondContact O-N 2.84Å; L2915-V2921 HydrophobicContact CD1-CG2 4.02Å; L2915-C2949 HydrophobicContact CD1-CB 3.42Å; L2915-C2949 VanDerWaalsContact CD1-CB 3.42Å; L2915-C2949 HydrophobicContact CD2-CB 3.87Å; L2915-C2949 HydrophobicContact CG-CB 4.3Å; L2915-I2952 HydrophobicContact CB-CB 4.39Å; L2915-I2952 HydrophobicContact CB-CG2 3.96Å
2916	L	85.6	Confident	81.3	Confident	3 Å²	3	28.3 Å²	28.3	2%	0.016	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	159.2	-179.7	-59.5	-173.1	0	0	0	112	T2890 H2892 I2893 V2894 N2918 G2919 E2920 V2922	T2890-L2916 HydrophobicContact CG2-CD2 4.11Å; H2892-L2916 HydrophobicContact CB-CB 4.07Å; H2892-L2916 HydrophobicContact CB-CD1 4.29Å; I2893-L2916 CarbonylContact O-C 3.58Å; I2893-L2916 WeakPolarHBondContact O-CA 3.29Å; V2894-L2916 HydrophobicContact CG2-CD2 3.88Å; L2916-N2918 WeakPolarHBondContact CB-OD1 3.49Å; L2916-N2918 PolarHBondContact O-N 3.13Å; L2916-G2919 WeakPolarHBondContact O-CA 3.28Å; L2916-G2919 PolarHBondContact O-N 3.05Å; L2916-E2920 WeakPolarHBondContact CB-O 3.44Å; L2916-E2920 HydrophobicContact CD1-CB 4.41Å; L2916-E2920 PolarHBondContact N-O 3.35Å; L2916-V2922 HydrophobicContact CD1-CG2 3.73Å; L2916-V2922 HydrophobicContact CG-CG2 4.19Å
2917	S	77.1	Confident	81.2	Confident	63 Å²	63	29.9 Å²	29.9	44%	0.441	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-18.2	-176.6	62.4	0	0	0	0	114.6	I2893 G2919	I2893-S2917 PolarHBondContact N-OG 2.92Å; I2893-S2917 PolarHBondContact O-N 3.06Å; S2917-G2919 VanDerWaalsContact C-N 3.26Å
2918	N	75	Confident	80.7	Confident	47 Å²	47	33 Å²	33	25%	0.251	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-3.9	171.2	67.1	-14	0	0	0	112.7	H2892 L2916 E2920	H2892-N2918 VanDerWaalsContact CD2-CG 3.46Å; H2892-N2918 PolarHBondContact CD2-ND2 3.27Å; H2892-N2918 PolarHBondContact NE2-ND2 3.26Å; L2916-N2918 WeakPolarHBondContact CB-OD1 3.49Å; L2916-N2918 PolarHBondContact O-N 3.13Å; N2918-E2920 WeakPolarHBondContact ND2-CG 3.49Å; N2918-E2920 PolarHBondContact ND2-OE2 3.16Å; N2918-E2920 WeakPolarHBondContact OD1-CB 3.24Å; N2918-E2920 PolarHBondContact OD1-N 2.92Å
2919	G	72.5	Confident	79.9	Confident	13 Å²	13	33.6 Å²	33.6	13%	0.134	18%	0.178	C	C	.	.	S	Bend	trans	92.4	-4.3	-177.4	0	0	0	0	0	115.3	L2916 S2917 H2947 C2949	L2916-G2919 WeakPolarHBondContact O-CA 3.28Å; L2916-G2919 PolarHBondContact O-N 3.05Å; S2917-G2919 VanDerWaalsContact C-N 3.26Å; G2919-H2947 VanDerWaalsContact CA-O 3.3Å; G2919-H2947 WeakPolarHBondContact CA-O 3.19Å; G2919-C2949 PolarHBondContact O-SG 2.83Å
2920	E	80.7	Confident	78.7	Confident	82 Å²	82	36.5 Å²	36.5	38%	0.383	20%	0.196	S	C	.	.			trans	-71.9	144.5	177.7	-70	-178	158.2	0	0	111.9	L2916 N2918 H2935	L2916-E2920 WeakPolarHBondContact CB-O 3.44Å; L2916-E2920 HydrophobicContact CD1-CB 4.41Å; L2916-E2920 PolarHBondContact N-O 3.35Å; N2918-E2920 WeakPolarHBondContact ND2-CG 3.49Å; N2918-E2920 PolarHBondContact ND2-OE2 3.16Å; N2918-E2920 WeakPolarHBondContact OD1-CB 3.24Å; N2918-E2920 PolarHBondContact OD1-N 2.92Å; E2920-H2935 IonicContact OE2-CE1 2.75Å; E2920-H2935 IonicContact OE2-ND1 3.94Å
2921	V	84.8	Confident	77.5	Confident	4 Å²	4	43.4 Å²	43.4	2%	0.024	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	126.7	176	-178.1	0	0	0	0	109	V2913 A2914 L2915 L2936 I2952 V2961 F2979	V2913-V2921 HydrophobicContact CG1-CG1 3.45Å; V2913-V2921 VanDerWaalsContact CG1-CG1 3.45Å; A2914-V2921 WeakPolarHBondContact O-CA 3.37Å; L2915-V2921 HydrophobicContact CD1-CG2 4.02Å; V2921-L2936 HydrophobicContact CB-CB 4.34Å; V2921-L2936 HydrophobicContact CG1-CD1 3.95Å; V2921-L2936 PolarHBondContact O-N 3.1Å; V2921-I2952 HydrophobicContact CG1-CD1 3.43Å; V2921-I2952 VanDerWaalsContact CG1-CD1 3.43Å; V2921-I2952 HydrophobicContact CG2-CD1 4.36Å; V2921-V2961 HydrophobicContact CG2-CG2 4.12Å; V2921-F2979 HydrophobicContact CB-CE2 4.03Å; V2921-F2979 HydrophobicContact CB-CZ 4.36Å; V2921-F2979 HydrophobicContact CG1-CE2 4.34Å; V2921-F2979 HydrophobicContact CG1-CZ 4.21Å; V2921-F2979 HydrophobicContact CG2-CE2 4.18Å; V2921-F2979 HydrophobicContact CG2-CZ 4.43Å
2922	V	86.3	Confident	76.5	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	134.3	-172.3	-177.3	0	0	0	0	110.6	V2913 A2914 L2916 I2924 L2933 V2934	V2913-V2922 CarbonylContact C-O 3.57Å; V2913-V2922 WeakPolarHBondContact CA-O 3.37Å; A2914-V2922 PolarHBondContact N-O 3.44Å; A2914-V2922 PolarHBondContact O-N 2.65Å; L2916-V2922 HydrophobicContact CD1-CG2 3.73Å; L2916-V2922 HydrophobicContact CG-CG2 4.19Å; V2922-I2924 HydrophobicContact CG1-CG1 4.28Å; V2922-L2933 HydrophobicContact CG1-CB 3.59Å; V2922-L2933 HydrophobicContact CG1-CD1 4.26Å; V2922-L2933 HydrophobicContact CG1-CD2 3.74Å; V2922-L2933 HydrophobicContact CG1-CG 4.05Å; V2922-V2934 WeakPolarHBondContact CA-O 3.13Å
2923	I	86	Confident	75.6	Confident	24 Å²	24	53 Å²	53	12%	0.123	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	130.8	173	-55.2	173.1	0	0	0	109.6	L2900 V2913 V2934 L2936 I2959	L2900-I2923 HydrophobicContact CD1-CD1 4.48Å; L2900-I2923 HydrophobicContact CD1-CG2 3.76Å; L2900-I2923 HydrophobicContact CD2-CG2 4.15Å; V2913-I2923 HydrophobicContact CG1-CG1 4.27Å; V2913-I2923 HydrophobicContact CG2-CG1 4.29Å; I2923-V2934 HydrophobicContact CB-CB 4.22Å; I2923-V2934 PolarHBondContact N-O 3.02Å; I2923-V2934 PolarHBondContact O-N 2.88Å; I2923-L2936 HydrophobicContact CD1-CD1 4.05Å; I2923-L2936 HydrophobicContact CD1-CD2 4.09Å; I2923-L2936 HydrophobicContact CD1-CG 4.22Å; I2923-L2936 HydrophobicContact CG1-CD1 4.07Å; I2923-L2936 HydrophobicContact CG1-CG 4.31Å; I2923-I2959 HydrophobicContact CD1-CD1 4.03Å; I2923-I2959 HydrophobicContact CG1-CD1 4.29Å
2924	I	83.3	Confident	75	Confident	7 Å²	7	55.5 Å²	55.5	4%	0.036	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	91.8	-179.4	-51.6	178.2	0	0	0	108.1	I2831 F2888 T2890 G2911 V2912 A2914 V2922 L2933	I2831-I2924 HydrophobicContact CD1-CD1 3.29Å; F2888-I2924 HydrophobicContact CD1-CG2 4.25Å; F2888-I2924 HydrophobicContact CG-CG2 4.22Å; T2890-I2924 HydrophobicContact CG2-CD1 4.29Å; G2911-I2924 CarbonylContact C-O 3.56Å; G2911-I2924 VanDerWaalsContact CA-O 3.25Å; G2911-I2924 WeakPolarHBondContact CA-O 3.38Å; V2912-I2924 HydrophobicContact CG2-CB 4.01Å; V2912-I2924 HydrophobicContact CG2-CD1 4.47Å; V2912-I2924 PolarHBondContact N-O 3.39Å; V2912-I2924 PolarHBondContact O-N 3.01Å; A2914-I2924 HydrophobicContact CB-CD1 4.14Å; V2922-I2924 HydrophobicContact CG1-CG1 4.28Å; I2924-L2933 HydrophobicContact CD1-CD2 4.26Å; I2924-L2933 HydrophobicContact CG1-CD2 3.8Å
2925	P	80.3	Confident	74.6	Confident	40 Å²	40	58.6 Å²	58.6	26%	0.26	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	148	175	29.2	-32.9	0	0	0	110.6
2926	F	76.6	Confident	74.1	Confident	15 Å²	15	58.9 Å²	58.9	7%	0.066	31%	0.309	C	S	.	.	S	Bend	trans	-66.8	-50.6	176.9	174.2	-101.7	0	0	0	111.8	F2822 T2833 H2835 E2884 M2907 C2910 R2928	F2822-F2926 AromaticContact CD1-CD2 3.98Å; F2822-F2926 HydrophobicContact CD1-CD2 3.98Å; F2822-F2926 HydrophobicContact CD1-CE2 4.07Å; F2822-F2926 HydrophobicContact CD1-CG 4.43Å; F2822-F2926 AromaticContact CE1-CD1 3.95Å; F2822-F2926 HydrophobicContact CE1-CD1 3.95Å; F2822-F2926 AromaticContact CE1-CD2 3.66Å; F2822-F2926 HydrophobicContact CE1-CD2 3.66Å; F2822-F2926 AromaticContact CE1-CE1 3.91Å; F2822-F2926 HydrophobicContact CE1-CE1 3.91Å; F2822-F2926 AromaticContact CE1-CE2 3.62Å; F2822-F2926 HydrophobicContact CE1-CE2 3.62Å; F2822-F2926 AromaticContact CE1-CG 3.83Å; F2822-F2926 HydrophobicContact CE1-CG 3.83Å; F2822-F2926 AromaticContact CE1-CZ 3.75Å; F2822-F2926 HydrophobicContact CE1-CZ 3.75Å; F2822-F2926 HydrophobicContact CZ-CD1 4.36Å; F2822-F2926 HydrophobicContact CZ-CE1 4.41Å; T2833-F2926 HydrophobicContact CG2-CD2 3.97Å; T2833-F2926 HydrophobicContact CG2-CE2 4.11Å; H2835-F2926 HydrophobicContact CB-CE2 4.02Å; H2835-F2926 HydrophobicContact CB-CZ 4.16Å; H2835-F2926 AromaticContact CG-CZ 3.86Å; H2835-F2926 AromaticContact ND1-CZ 3.44Å; H2835-F2926 WeakPolarHBondContact ND1-CZ 3.5Å; E2884-F2926 WeakPolarHBondContact OE1-CZ 3.43Å; M2907-F2926 HydrophobicContact CE-CD1 3.54Å; M2907-F2926 HydrophobicContact CE-CE1 3.32Å; M2907-F2926 HydrophobicContact CE-CZ 4.42Å; C2910-F2926 HydrophobicContact CB-CB 4.01Å; C2910-F2926 WeakPolarHBondContact O-CB 3.45Å; C2910-F2926 PolarHBondContact O-N 3.39Å; F2926-R2928 PolarHBondContact O-N 2.98Å
2927	Q	72.1	Confident	73.6	Confident	112 Å²	112	67.8 Å²	67.8	52%	0.523	34%	0.343	S	S	.	.	S	Bend	trans	-90.4	99.6	-178.6	-154.4	170.3	12.1	0	0	109.8	N2908	N2908-Q2927 PolarHBondContact OD1-OE1 2.55Å
2928	R	64.8	Low	73.3	Confident	101 Å²	101	67 Å²	67	38%	0.381	34%	0.335	S	S	.	.			trans	-85.4	123.7	-179.3	-123.7	-171.7	171.7	166.7	2.8	111.1	F2926 D2930 N2931	F2926-R2928 PolarHBondContact O-N 2.98Å; R2928-D2930 WeakPolarHBondContact CG-O 3.5Å; R2928-D2930 PolarHBondContact NE-O 3.34Å; R2928-D2930 VanDerWaalsContact NE-O 3.16Å; R2928-N2931 PolarHBondContact NH2-O 3.32Å
2929	T	56.4	Low	72.9	Confident	130 Å²	130	71.6 Å²	71.6	80%	0.798	35%	0.349	S	S	*	.	S	Bend	trans	-94.3	-32.3	160.5	53.8	0	0	0	0	111.9
2930	D	52.6	Low	72.3	Confident	121 Å²	121	78.8 Å²	78.8	65%	0.647	38%	0.384	S	S	*	.	S	Bend	trans	-131.1	148.4	-174.2	-62.4	-55.9	0	0	0	112.7	R2928 E2932	R2928-D2930 WeakPolarHBondContact CG-O 3.5Å; R2928-D2930 PolarHBondContact NE-O 3.34Å; R2928-D2930 VanDerWaalsContact NE-O 3.16Å; D2930-E2932 PolarHBondContact O-N 3.29Å; D2930-E2932 VanDerWaalsContact O-N 3.15Å
2931	N	55.1	Low	70.9	Confident	147 Å²	147	82 Å²	82	79%	0.786	40%	0.404	S	S	*	.	S	Bend	trans	-75.2	6.6	-170.2	-84.4	-18.1	0	0	0	115.8	R2928	R2928-N2931 PolarHBondContact NH2-O 3.32Å
2932	E	61.8	Low	69.4	Low	171 Å²	171	83.3 Å²	83.3	80%	0.799	41%	0.413	S	S	*	.			trans	-97.6	136.7	-176.5	-68.3	-174.3	172.5	0	0	111.8	D2930	D2930-E2932 PolarHBondContact O-N 3.29Å; D2930-E2932 VanDerWaalsContact O-N 3.15Å
2933	L	71.5	Confident	67.7	Low	31 Å²	31	91.7 Å²	91.7	16%	0.162	46%	0.458	C	S	.	.			trans	-76.5	136	168.5	-75	170.1	0	0	0	107.9	V2922 I2924 H2935	V2922-L2933 HydrophobicContact CG1-CB 3.59Å; V2922-L2933 HydrophobicContact CG1-CD1 4.26Å; V2922-L2933 HydrophobicContact CG1-CD2 3.74Å; V2922-L2933 HydrophobicContact CG1-CG 4.05Å; I2924-L2933 HydrophobicContact CD1-CD2 4.26Å; I2924-L2933 HydrophobicContact CG1-CD2 3.8Å; L2933-H2935 PolarHBondContact O-CD2 2.6Å; L2933-H2935 PolarHBondContact O-N 3.19Å
2934	V	75.3	Confident	66.1	Low	53 Å²	53	92.7 Å²	92.7	32%	0.321	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	102.5	177.5	-179.1	0	0	0	0	108.3	V2922 I2923 H2977	V2922-V2934 WeakPolarHBondContact CA-O 3.13Å; I2923-V2934 HydrophobicContact CB-CB 4.22Å; I2923-V2934 PolarHBondContact N-O 3.02Å; I2923-V2934 PolarHBondContact O-N 2.88Å; V2934-H2977 VanDerWaalsContact CG1-CE1 3.49Å; V2934-H2977 WeakPolarHBondContact CG1-CE1 3.29Å
2935	H	80.9	Confident	64.5	Low	65 Å²	65	98.2 Å²	98.2	30%	0.301	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	122.7	177.4	-62.6	-102.4	0	0	0	110.3	E2920 L2933	E2920-H2935 IonicContact OE2-CE1 2.75Å; E2920-H2935 IonicContact OE2-ND1 3.94Å; L2933-H2935 PolarHBondContact O-CD2 2.6Å; L2933-H2935 PolarHBondContact O-N 3.19Å
2936	L	77.9	Confident	63.1	Low	8 Å²	8	97.8 Å²	97.8	4%	0.042	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	131	171.5	-60.9	175.1	0	0	0	109.1	V2921 I2923 I2959 H2977 F2979	V2921-L2936 HydrophobicContact CB-CB 4.34Å; V2921-L2936 HydrophobicContact CG1-CD1 3.95Å; V2921-L2936 PolarHBondContact O-N 3.1Å; I2923-L2936 HydrophobicContact CD1-CD1 4.05Å; I2923-L2936 HydrophobicContact CD1-CD2 4.09Å; I2923-L2936 HydrophobicContact CD1-CG 4.22Å; I2923-L2936 HydrophobicContact CG1-CD1 4.07Å; I2923-L2936 HydrophobicContact CG1-CG 4.31Å; L2936-I2959 HydrophobicContact CD1-CD1 3.56Å; L2936-H2977 HydrophobicContact CD2-CB 3.84Å; L2936-F2979 HydrophobicContact CB-CD2 4.14Å; L2936-F2979 HydrophobicContact CB-CE2 3.52Å; L2936-F2979 HydrophobicContact CB-CZ 4.28Å; L2936-F2979 HydrophobicContact CD1-CE2 3.88Å; L2936-F2979 HydrophobicContact CD1-CZ 3.76Å; L2936-F2979 HydrophobicContact CG-CE2 4.35Å
2937	R	74.3	Confident	62.1	Low	190 Å²	190	104.4 Å²	104.4	72%	0.717	53%	0.531	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.3	151.8	-178.8	-64.1	-175	-177.2	178	1.9	111.2	H2977 V2978 F2979	R2937-H2977 PolarHBondContact N-O 3.23Å; R2937-V2978 CarbonylContact O-C 3.57Å; R2937-V2978 VanDerWaalsContact O-CA 3.28Å; R2937-V2978 WeakPolarHBondContact O-CA 3.35Å; R2937-F2979 PolarHBondContact O-N 2.88Å
2938	V	70.3	Confident	61.7	Low	46 Å²	46	108.6 Å²	108.6	28%	0.279	54%	0.542	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	140.5	166.9	-177	0	0	0	0	108.2	D2940 L2944 L2968 F2979	V2938-D2940 PolarHBondContact O-N 2.91Å; V2938-L2944 HydrophobicContact CG1-CD1 4.12Å; V2938-L2968 HydrophobicContact CG1-CD1 3.89Å; V2938-L2968 HydrophobicContact CG2-CD1 3.91Å; V2938-F2979 HydrophobicContact CG2-CD2 4.45Å
2939	R	67.1	Low	62	Low	144 Å²	144	104.9 Å²	104.9	54%	0.543	53%	0.531	S	S	.	.			trans	-62.5	125.5	-177.2	-162.3	-179.8	-135.8	169.4	8.6	111.4	N2941 C2942 V2978	R2939-N2941 PolarHBondContact O-N 2.76Å; R2939-C2942 PolarHBondContact O-N 3.42Å; R2939-C2942 VanDerWaalsContact O-N 3.09Å; R2939-V2978 HydrophobicContact CB-CG1 3.57Å; R2939-V2978 HydrophobicContact CG-CG1 3.99Å
2940	D	59	Low	62.9	Low	163 Å²	163	101 Å²	101	87%	0.872	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-23.9	-177.3	-63.7	-29.4	0	0	0	115.1	V2938	V2938-D2940 PolarHBondContact O-N 2.91Å
2941	N	52.6	Low	64.2	Low	149 Å²	149	95.4 Å²	95.4	80%	0.797	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	3.1	-177.5	-75.1	-8.3	0	0	0	114.5	R2939	R2939-N2941 PolarHBondContact O-N 2.76Å
2942	C	52.9	Low	65.7	Low	32 Å²	32	88.7 Å²	88.7	22%	0.216	44%	0.444	C	S	.	.	S	Bend	trans	-82.7	122.9	170.9	-65.2	0	0	0	0	108	R2939 L2944	R2939-C2942 PolarHBondContact O-N 3.42Å; R2939-C2942 VanDerWaalsContact O-N 3.09Å; C2942-L2944 HydrophobicContact CB-CD1 3.54Å; C2942-L2944 HydrophobicContact CB-CG 3.96Å; C2942-L2944 PolarHBondContact O-N 2.77Å
2943	N	50	Low	66.8	Low	176 Å²	176	81.2 Å²	81.2	94%	0.941	41%	0.41	S	S	*	.			trans	-67.9	40.5	175.4	-77.1	-21	0	0	0	112.7	S2945	N2943-S2945 PolarHBondContact O-N 2.89Å
2944	L	52.7	Low	67.4	Low	46 Å²	46	79.8 Å²	79.8	24%	0.241	40%	0.403	C	S	.	.			trans	-87.6	107.2	179.1	-66.2	159.7	0	0	0	107.1	V2938 C2942 S2946	V2938-L2944 HydrophobicContact CG1-CD1 4.12Å; C2942-L2944 HydrophobicContact CB-CD1 3.54Å; C2942-L2944 HydrophobicContact CB-CG 3.96Å; C2942-L2944 PolarHBondContact O-N 2.77Å; L2944-S2946 VanDerWaalsContact C-N 3.28Å; L2944-S2946 PolarHBondContact O-N 2.98Å
2945	S	49.8	Very low	67.7	Low	122 Å²	122	78 Å²	78	85%	0.853	39%	0.391	S	S	*	.			trans	-77.2	-6.6	-169.6	48.3	0	0	0	0	115.1	N2943	N2943-S2945 PolarHBondContact O-N 2.89Å
2946	S	51.8	Low	67.3	Low	32 Å²	32	80.1 Å²	80.1	22%	0.224	40%	0.401	C	S	.	.			trans	-132	150.9	-176.6	74.2	0	0	0	0	111.4	L2944 W2948 H2963 D2964	L2944-S2946 VanDerWaalsContact C-N 3.28Å; L2944-S2946 PolarHBondContact O-N 2.98Å; S2946-W2948 VanDerWaalsContact C-N 3.29Å; S2946-W2948 PolarHBondContact O-N 2.95Å; S2946-H2963 PolarHBondContact O-CE1 3.29Å; S2946-H2963 PolarHBondContact O-NE2 3.32Å; S2946-D2964 WeakPolarHBondContact OG-CB 3.48Å; S2946-D2964 PolarHBondContact OG-OD2 2.81Å
2947	H	54.9	Low	67.3	Low	153 Å²	153	84.7 Å²	84.7	71%	0.708	43%	0.425	S	S	*	.			trans	-89.1	16.4	178.4	-69.4	-60	0	0	0	113	G2919 C2949	G2919-H2947 VanDerWaalsContact CA-O 3.3Å; G2919-H2947 WeakPolarHBondContact CA-O 3.19Å; H2947-C2949 PolarHBondContact O-N 3.29Å
2948	W	63.8	Low	67.7	Low	201 Å²	201	75.6 Å²	75.6	76%	0.761	39%	0.391	S	S	*	.			trans	-92.4	104.6	-167.1	-68.4	-4.8	0	0	0	112.3	S2946 D2964	S2946-W2948 VanDerWaalsContact C-N 3.29Å; S2946-W2948 PolarHBondContact O-N 2.95Å; W2948-D2964 PolarHBondContact O-N 3.25Å
2949	C	71.7	Confident	68.5	Low	22 Å²	22	73.4 Å²	73.4	15%	0.149	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	129.6	163.2	-62.4	0	0	0	0	109.9	L2915 G2919 H2947 V2961 A2962 H2963	L2915-C2949 HydrophobicContact CD1-CB 3.42Å; L2915-C2949 VanDerWaalsContact CD1-CB 3.42Å; L2915-C2949 HydrophobicContact CD2-CB 3.87Å; L2915-C2949 HydrophobicContact CG-CB 4.3Å; G2919-C2949 PolarHBondContact O-SG 2.83Å; H2947-C2949 PolarHBondContact O-N 3.29Å; C2949-V2961 HydrophobicContact CB-CG1 3.81Å; C2949-V2961 WeakPolarHBondContact SG-CG1 3.42Å; C2949-A2962 CarbonylContact C-O 3.53Å; C2949-A2962 VanDerWaalsContact CA-O 3.28Å; C2949-A2962 WeakPolarHBondContact CA-O 3.21Å; C2949-H2963 VanDerWaalsContact SG-CD2 3.56Å
2950	S	74.4	Confident	69.4	Low	50 Å²	50	66.6 Å²	66.6	35%	0.35	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	-29.2	-179.6	54.3	0	0	0	0	113.4	A2962 I2994 D2995	S2950-A2962 PolarHBondContact N-O 3.37Å; S2950-A2962 VanDerWaalsContact OG-CB 3.24Å; S2950-A2962 WeakPolarHBondContact OG-CB 3.36Å; S2950-A2962 PolarHBondContact OG-O 3.17Å; S2950-I2994 PolarHBondContact OG-O 3.08Å; S2950-I2994 VanDerWaalsContact OG-O 3.09Å; S2950-D2995 WeakPolarHBondContact CB-O 3.49Å; S2950-D2995 PolarHBondContact OG-O 2.92Å; S2950-D2995 VanDerWaalsContact OG-O 3.13Å
2951	S	81.4	Confident	70.6	Confident	3 Å²	3	58.9 Å²	58.9	2%	0.021	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	160.6	179.6	66	0	0	0	0	112.6	E2896 A2962 D2995 R2996	E2896-S2951 WeakPolarHBondContact OE2-CA 3.43Å; S2951-A2962 PolarHBondContact O-N 2.83Å; S2951-A2962 VanDerWaalsContact O-N 3.12Å; S2951-A2962 WeakPolarHBondContact OG-CB 3.4Å; S2951-D2995 PolarHBondContact OG-O 3.01Å; S2951-R2996 VanDerWaalsContact OG-CA 3.31Å; S2951-R2996 WeakPolarHBondContact OG-CA 3.28Å
2952	I	86.6	Confident	72	Confident	6 Å²	6	51.8 Å²	51.8	3%	0.031	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	141.8	176.2	-171.7	165	0	0	0	112.1	E2896 V2913 L2915 V2921 I2959 V2961	E2896-I2952 HydrophobicContact CB-CG2 4.06Å; E2896-I2952 HydrophobicContact CG-CG2 4.04Å; E2896-I2952 PolarHBondContact OE2-N 2.97Å; V2913-I2952 HydrophobicContact CB-CD1 4.04Å; V2913-I2952 HydrophobicContact CG1-CD1 3.43Å; V2913-I2952 VanDerWaalsContact CG1-CD1 3.43Å; L2915-I2952 HydrophobicContact CB-CB 4.39Å; L2915-I2952 HydrophobicContact CB-CG2 3.96Å; V2921-I2952 HydrophobicContact CG1-CD1 3.43Å; V2921-I2952 VanDerWaalsContact CG1-CD1 3.43Å; V2921-I2952 HydrophobicContact CG2-CD1 4.36Å; I2952-I2959 HydrophobicContact CD1-CG2 4.07Å; I2952-I2959 HydrophobicContact CG1-CG2 4.14Å; I2952-V2961 HydrophobicContact CD1-CG2 4.29Å; I2952-V2961 HydrophobicContact CG1-CG2 4.11Å
2953	C	85.1	Confident	73.1	Confident	13 Å²	13	50.5 Å²	50.5	9%	0.088	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	160	168.7	64.1	0	0	0	0	111.7	L2960 I2997 P2999	C2953-L2960 PolarHBondContact N-O 3.31Å; C2953-L2960 PolarHBondContact O-N 2.89Å; C2953-L2960 VanDerWaalsContact O-O 3.07Å; C2953-L2960 WeakPolarHBondContact SG-CB 3.47Å; C2953-I2997 PolarHBondContact SG-O 3.47Å; C2953-P2999 WeakPolarHBondContact SG-CD 3.46Å
2954	T	83.7	Confident	74	Confident	2 Å²	2	44.7 Å²	44.7	1%	0.012	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	156.5	174.5	57.8	0	0	0	0	110.7	S2898 T2899 H2902 V2913 I2959	S2898-T2954 PolarHBondContact OG-N 3.45Å; S2898-T2954 PolarHBondContact OG-OG1 3.18Å; T2899-T2954 VanDerWaalsContact O-CB 3.26Å; T2899-T2954 WeakPolarHBondContact O-CB 3.01Å; T2899-T2954 WeakPolarHBondContact O-CG2 3.27Å; T2899-T2954 PolarHBondContact O-OG1 3.41Å; H2902-T2954 PolarHBondContact NE2-O 3.14Å; H2902-T2954 PolarHBondContact NE2-OG1 2.89Å; V2913-T2954 HydrophobicContact CG2-CG2 4.02Å; T2954-I2959 HydrophobicContact CG2-CG1 4.07Å; T2954-I2959 HydrophobicContact CG2-CG2 4.41Å
2955	Y	80.6	Confident	74.7	Confident	16 Å²	16	43.4 Å²	43.4	6%	0.063	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	-172.4	168.8	71	-73.8	0	0	0	110.2	D2957 G2958 L2960 F2969 F2972 P2999 L3010	Y2955-D2957 VanDerWaalsContact C-N 3.28Å; Y2955-D2957 HydrophobicContact CD2-CB 4.3Å; Y2955-D2957 HydrophobicContact CE2-CB 3.56Å; Y2955-D2957 PolarHBondContact O-N 3.35Å; Y2955-G2958 WeakPolarHBondContact CD1-O 3.27Å; Y2955-G2958 PolarHBondContact N-O 2.88Å; Y2955-G2958 PolarHBondContact O-N 2.81Å; Y2955-L2960 HydrophobicContact CD1-CD1 3.4Å; Y2955-L2960 HydrophobicContact CD1-CG 4.2Å; Y2955-L2960 HydrophobicContact CE1-CD1 3.4Å; Y2955-L2960 HydrophobicContact CE1-CG 3.88Å; Y2955-L2960 HydrophobicContact CG-CD1 4.47Å; Y2955-F2969 HydrophobicContact CD1-CE2 4.42Å; Y2955-F2969 AromaticContact CE1-CD2 3.8Å; Y2955-F2969 HydrophobicContact CE1-CD2 3.8Å; Y2955-F2969 AromaticContact CE1-CE2 3.26Å; Y2955-F2969 HydrophobicContact CE1-CE2 3.26Å; Y2955-F2969 HydrophobicContact CE1-CZ 4.12Å; Y2955-F2969 AromaticContact CZ-CE2 3.46Å; Y2955-F2969 VanDerWaalsContact CZ-CE2 3.46Å; Y2955-F2969 AromaticContact CZ-CZ 3.85Å; Y2955-F2969 WeakPolarHBondContact OH-CE2 3.31Å; Y2955-F2969 WeakPolarHBondContact OH-CZ 3.27Å; Y2955-F2972 WeakPolarHBondContact O-CE2 3.44Å; Y2955-P2999 HydrophobicContact CD1-CG 4.34Å; Y2955-P2999 HydrophobicContact CG-CB 4.28Å; Y2955-P2999 HydrophobicContact CG-CG 4.24Å; Y2955-L3010 HydrophobicContact CD2-CD2 4.44Å; Y2955-L3010 HydrophobicContact CE2-CD2 3.97Å
2956	Q	73.7	Confident	75.9	Confident	109 Å²	109	38.8 Å²	38.8	51%	0.509	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-36.5	-172.7	-75.6	179.4	-21.9	0	0	114.3
2957	D	76.2	Confident	77.3	Confident	103 Å²	103	37.3 Å²	37.3	55%	0.551	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.7	-11.8	-172.9	-54.8	-39.3	0	0	0	114.2	Y2955 F2969 P2971 F2972	Y2955-D2957 VanDerWaalsContact C-N 3.28Å; Y2955-D2957 HydrophobicContact CD2-CB 4.3Å; Y2955-D2957 HydrophobicContact CE2-CB 3.56Å; Y2955-D2957 PolarHBondContact O-N 3.35Å; D2957-F2969 HydrophobicContact CB-CZ 4.41Å; D2957-P2971 WeakPolarHBondContact O-CA 3.36Å; D2957-F2972 PolarHBondContact O-N 2.94Å
2958	G	84	Confident	78.6	Confident	0 Å²	0	30 Å²	30	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	166.2	-159.6	179.9	0	0	0	0	0	116.5	Y2955 H2970 F2972	Y2955-G2958 WeakPolarHBondContact CD1-O 3.27Å; Y2955-G2958 PolarHBondContact N-O 2.88Å; Y2955-G2958 PolarHBondContact O-N 2.81Å; G2958-H2970 CarbonylContact C-O 3.53Å; G2958-H2970 VanDerWaalsContact CA-O 3.25Å; G2958-H2970 WeakPolarHBondContact CA-O 3.34Å; G2958-F2972 VanDerWaalsContact CA-CE2 3.47Å
2959	I	86.5	Confident	79.6	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	131	-174	-52.4	168.2	0	0	0	109.5	V2913 I2923 L2936 I2952 T2954 V2961 F2969 H2970 F2972 F2979	V2913-I2959 HydrophobicContact CG1-CD1 4.15Å; V2913-I2959 HydrophobicContact CG1-CG2 4.37Å; V2913-I2959 HydrophobicContact CG2-CD1 3.88Å; V2913-I2959 HydrophobicContact CG2-CG1 4.3Å; I2923-I2959 HydrophobicContact CD1-CD1 4.03Å; I2923-I2959 HydrophobicContact CG1-CD1 4.29Å; L2936-I2959 HydrophobicContact CD1-CD1 3.56Å; I2952-I2959 HydrophobicContact CD1-CG2 4.07Å; I2952-I2959 HydrophobicContact CG1-CG2 4.14Å; T2954-I2959 HydrophobicContact CG2-CG1 4.07Å; T2954-I2959 HydrophobicContact CG2-CG2 4.41Å; I2959-V2961 HydrophobicContact CG2-CG2 4.31Å; I2959-F2969 CarbonylContact O-C 3.57Å; I2959-F2969 WeakPolarHBondContact O-CA 3.26Å; I2959-F2969 VanDerWaalsContact O-CD2 3.29Å; I2959-F2969 WeakPolarHBondContact O-CD2 3.28Å; I2959-H2970 HydrophobicContact CB-CB 4.46Å; I2959-H2970 PolarHBondContact N-O 2.98Å; I2959-H2970 PolarHBondContact O-N 2.85Å; I2959-F2972 HydrophobicContact CD1-CE1 4.11Å; I2959-F2972 HydrophobicContact CG1-CD1 4.34Å; I2959-F2972 HydrophobicContact CG1-CE1 3.6Å; I2959-F2972 HydrophobicContact CG1-CZ 4.23Å; I2959-F2979 HydrophobicContact CB-CE1 4.35Å; I2959-F2979 HydrophobicContact CG2-CE1 4.15Å; I2959-F2979 HydrophobicContact CG2-CZ 4.07Å
2960	L	86.2	Confident	80.3	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	136.9	176.6	-81.2	149.3	0	0	0	110.1	C2953 Y2955 L2968 F2969 L2982 I2997 P2999 Y3012	C2953-L2960 PolarHBondContact N-O 3.31Å; C2953-L2960 PolarHBondContact O-N 2.89Å; C2953-L2960 VanDerWaalsContact O-O 3.07Å; C2953-L2960 WeakPolarHBondContact SG-CB 3.47Å; Y2955-L2960 HydrophobicContact CD1-CD1 3.4Å; Y2955-L2960 HydrophobicContact CD1-CG 4.2Å; Y2955-L2960 HydrophobicContact CE1-CD1 3.4Å; Y2955-L2960 HydrophobicContact CE1-CG 3.88Å; Y2955-L2960 HydrophobicContact CG-CD1 4.47Å; L2960-L2968 WeakPolarHBondContact CA-O 3.38Å; L2960-F2969 HydrophobicContact CD2-CB 4.4Å; L2960-F2969 HydrophobicContact CD2-CD2 4.31Å; L2960-F2969 HydrophobicContact CG-CD2 4.08Å; L2960-L2982 HydrophobicContact CD2-CD1 3.81Å; L2960-L2982 HydrophobicContact CD2-CD2 4.33Å; L2960-I2997 HydrophobicContact CB-CG2 4.29Å; L2960-I2997 HydrophobicContact CD2-CD1 4.24Å; L2960-P2999 HydrophobicContact CD1-CB 4.15Å; L2960-P2999 HydrophobicContact CD1-CG 4.04Å; L2960-Y3012 HydrophobicContact CD1-CD1 4.32Å; L2960-Y3012 HydrophobicContact CD1-CE1 3.85Å; L2960-Y3012 HydrophobicContact CD2-CE1 4.28Å
2961	V	84.6	Confident	80.7	Confident	1 Å²	1	20.6 Å²	20.6	1%	0.006	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	137	179.4	179.2	0	0	0	0	109.4	V2921 C2949 I2952 I2959 H2963 L2968 F2979	V2921-V2961 HydrophobicContact CG2-CG2 4.12Å; C2949-V2961 HydrophobicContact CB-CG1 3.81Å; C2949-V2961 WeakPolarHBondContact SG-CG1 3.42Å; I2952-V2961 HydrophobicContact CD1-CG2 4.29Å; I2952-V2961 HydrophobicContact CG1-CG2 4.11Å; I2959-V2961 HydrophobicContact CG2-CG2 4.31Å; V2961-H2963 HydrophobicContact CG1-CB 4.5Å; V2961-L2968 PolarHBondContact N-O 2.92Å; V2961-L2968 PolarHBondContact O-N 2.97Å; V2961-F2979 HydrophobicContact CB-CE1 4.28Å; V2961-F2979 HydrophobicContact CB-CZ 4.48Å; V2961-F2979 HydrophobicContact CG2-CD1 4.44Å; V2961-F2979 HydrophobicContact CG2-CE1 3.57Å; V2961-F2979 HydrophobicContact CG2-CE2 4.27Å; V2961-F2979 HydrophobicContact CG2-CZ 3.47Å; V2961-F2979 VanDerWaalsContact CG2-CZ 3.47Å
2962	A	82.2	Confident	80.7	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	122.5	166.6	0	0	0	0	0	109.2	C2949 S2950 S2951 S2966 I2994 I2997	C2949-A2962 CarbonylContact C-O 3.53Å; C2949-A2962 VanDerWaalsContact CA-O 3.28Å; C2949-A2962 WeakPolarHBondContact CA-O 3.21Å; S2950-A2962 PolarHBondContact N-O 3.37Å; S2950-A2962 VanDerWaalsContact OG-CB 3.24Å; S2950-A2962 WeakPolarHBondContact OG-CB 3.36Å; S2950-A2962 PolarHBondContact OG-O 3.17Å; S2951-A2962 PolarHBondContact O-N 2.83Å; S2951-A2962 VanDerWaalsContact O-N 3.12Å; S2951-A2962 WeakPolarHBondContact OG-CB 3.4Å; A2962-S2966 CarbonylContact C-O 3.55Å; A2962-S2966 WeakPolarHBondContact CA-O 3.21Å; A2962-I2994 HydrophobicContact CB-CB 4.38Å; A2962-I2994 HydrophobicContact CB-CG2 3.56Å; A2962-I2997 HydrophobicContact CB-CG2 4.34Å
2963	H	75	Confident	80.2	Confident	5 Å²	5	30.3 Å²	30.3	2%	0.023	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	115	-173.3	179.3	-68	0	0	0	110.2	S2946 C2949 V2961 G2965 S2966 L2968	S2946-H2963 PolarHBondContact O-CE1 3.29Å; S2946-H2963 PolarHBondContact O-NE2 3.32Å; C2949-H2963 VanDerWaalsContact SG-CD2 3.56Å; V2961-H2963 HydrophobicContact CG1-CB 4.5Å; H2963-G2965 PolarHBondContact O-N 3.15Å; H2963-S2966 PolarHBondContact N-O 2.85Å; H2963-S2966 WeakPolarHBondContact O-CA 3.22Å; H2963-S2966 WeakPolarHBondContact O-CB 3.29Å; H2963-S2966 PolarHBondContact O-N 3.17Å; H2963-L2968 HydrophobicContact CB-CD1 3.76Å; H2963-L2968 HydrophobicContact CB-CG 4.21Å
2964	D	69.4	Low	79.8	Confident	55 Å²	55	31.8 Å²	31.8	29%	0.294	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	43.5	54.6	175.3	-160.2	10.7	0	0	0	114.1	S2946 W2948 S2966	S2946-D2964 WeakPolarHBondContact OG-CB 3.48Å; S2946-D2964 PolarHBondContact OG-OD2 2.81Å; W2948-D2964 PolarHBondContact O-N 3.25Å; D2964-S2966 PolarHBondContact O-N 3.04Å
2965	G	68.1	Low	79.4	Confident	18 Å²	18	36.7 Å²	36.7	19%	0.186	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.8	-4	-178.2	0	0	0	0	0	116.1	H2963 I2994	H2963-G2965 PolarHBondContact O-N 3.15Å; G2965-I2994 WeakPolarHBondContact O-CD1 3.44Å; G2965-I2994 WeakPolarHBondContact O-CG1 3.32Å
2966	S	74	Confident	79.2	Confident	26 Å²	26	40 Å²	40	18%	0.182	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	149.8	178.9	-55.2	0	0	0	0	112.2	A2962 H2963 D2964 N2987	A2962-S2966 CarbonylContact C-O 3.55Å; A2962-S2966 WeakPolarHBondContact CA-O 3.21Å; H2963-S2966 PolarHBondContact N-O 2.85Å; H2963-S2966 WeakPolarHBondContact O-CA 3.22Å; H2963-S2966 WeakPolarHBondContact O-CB 3.29Å; H2963-S2966 PolarHBondContact O-N 3.17Å; D2964-S2966 PolarHBondContact O-N 3.04Å; S2966-N2987 VanDerWaalsContact CA-OD1 3.3Å; S2966-N2987 WeakPolarHBondContact CA-OD1 3.44Å
2967	A	80.5	Confident	79.5	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	125.5	167.8	0	0	0	0	0	109.8	L2982 I2986 N2987 I2994 I2997	A2967-L2982 HydrophobicContact CB-CB 4.02Å; A2967-L2982 HydrophobicContact CB-CD2 4.12Å; A2967-L2982 WeakPolarHBondContact O-CB 3.31Å; A2967-L2982 PolarHBondContact O-N 2.9Å; A2967-I2986 HydrophobicContact CB-CG2 3.78Å; A2967-N2987 PolarHBondContact N-OD1 3.02Å; A2967-N2987 PolarHBondContact O-ND2 3.48Å; A2967-N2987 PolarHBondContact O-OD1 2.9Å; A2967-I2994 HydrophobicContact CB-CD1 4.2Å; A2967-I2997 HydrophobicContact CB-CD1 3.7Å
2968	L	83.6	Confident	79.7	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.005	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	146.7	177.9	-58.8	-178.5	0	0	0	110.1	V2938 L2960 V2961 H2963 F2979 T2980 P2981	V2938-L2968 HydrophobicContact CG1-CD1 3.89Å; V2938-L2968 HydrophobicContact CG2-CD1 3.91Å; L2960-L2968 WeakPolarHBondContact CA-O 3.38Å; V2961-L2968 PolarHBondContact N-O 2.92Å; V2961-L2968 PolarHBondContact O-N 2.97Å; H2963-L2968 HydrophobicContact CB-CD1 3.76Å; H2963-L2968 HydrophobicContact CB-CG 4.21Å; L2968-F2979 HydrophobicContact CB-CB 4.08Å; L2968-F2979 HydrophobicContact CB-CD1 4.01Å; L2968-F2979 HydrophobicContact CB-CG 4.29Å; L2968-F2979 HydrophobicContact CD1-CB 4.15Å; L2968-T2980 CarbonylContact C-O 3.57Å; L2968-T2980 WeakPolarHBondContact CA-O 3.3Å; L2968-P2981 HydrophobicContact CD2-CB 4.34Å; L2968-P2981 HydrophobicContact CD2-CG 4.26Å
2969	F	85.1	Confident	79.7	Confident	30 Å²	30	35.4 Å²	35.4	13%	0.132	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	139.9	-179.5	176.9	-115	0	0	0	111.9	Y2955 D2957 I2959 L2960 P2971 T2980 L2982	Y2955-F2969 HydrophobicContact CD1-CE2 4.42Å; Y2955-F2969 AromaticContact CE1-CD2 3.8Å; Y2955-F2969 HydrophobicContact CE1-CD2 3.8Å; Y2955-F2969 AromaticContact CE1-CE2 3.26Å; Y2955-F2969 HydrophobicContact CE1-CE2 3.26Å; Y2955-F2969 HydrophobicContact CE1-CZ 4.12Å; Y2955-F2969 AromaticContact CZ-CE2 3.46Å; Y2955-F2969 VanDerWaalsContact CZ-CE2 3.46Å; Y2955-F2969 AromaticContact CZ-CZ 3.85Å; Y2955-F2969 WeakPolarHBondContact OH-CE2 3.31Å; Y2955-F2969 WeakPolarHBondContact OH-CZ 3.27Å; D2957-F2969 HydrophobicContact CB-CZ 4.41Å; I2959-F2969 CarbonylContact O-C 3.57Å; I2959-F2969 WeakPolarHBondContact O-CA 3.26Å; I2959-F2969 VanDerWaalsContact O-CD2 3.29Å; I2959-F2969 WeakPolarHBondContact O-CD2 3.28Å; L2960-F2969 HydrophobicContact CD2-CB 4.4Å; L2960-F2969 HydrophobicContact CD2-CD2 4.31Å; L2960-F2969 HydrophobicContact CG-CD2 4.08Å; F2969-P2971 HydrophobicContact CD1-CG 4.44Å; F2969-P2971 HydrophobicContact CE1-CB 4.14Å; F2969-P2971 HydrophobicContact CE1-CG 3.83Å; F2969-P2971 HydrophobicContact CZ-CB 4.23Å; F2969-P2971 HydrophobicContact CZ-CG 4.38Å; F2969-T2980 PolarHBondContact N-O 2.61Å; F2969-T2980 PolarHBondContact O-N 3.22Å; F2969-T2980 PolarHBondContact O-OG1 3.22Å; F2969-L2982 HydrophobicContact CB-CD1 3.6Å; F2969-L2982 HydrophobicContact CG-CD1 4.16Å
2970	H	85.4	Confident	79.4	Confident	5 Å²	5	37.5 Å²	37.5	2%	0.023	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	114.1	173.7	-178.9	-74.1	0	0	0	109.8	G2958 I2959 D2974 H2977 V2978 F2979	G2958-H2970 CarbonylContact C-O 3.53Å; G2958-H2970 VanDerWaalsContact CA-O 3.25Å; G2958-H2970 WeakPolarHBondContact CA-O 3.34Å; I2959-H2970 HydrophobicContact CB-CB 4.46Å; I2959-H2970 PolarHBondContact N-O 2.98Å; I2959-H2970 PolarHBondContact O-N 2.85Å; H2970-D2974 PolarHBondContact CE1-O 3.39Å; H2970-D2974 VanDerWaalsContact CE1-O 3.29Å; H2970-D2974 PolarHBondContact NE2-O 2.84Å; H2970-H2977 VanDerWaalsContact NE2-CA 3.29Å; H2970-H2977 WeakPolarHBondContact NE2-CA 3.37Å; H2970-V2978 PolarHBondContact CD2-O 2.79Å; H2970-F2979 HydrophobicContact CB-CD1 3.61Å; H2970-F2979 HydrophobicContact CB-CE1 3.53Å; H2970-F2979 HydrophobicContact CB-CG 4.3Å; H2970-F2979 HydrophobicContact CB-CZ 4.19Å
2971	P	83.2	Confident	78.9	Confident	39 Å²	39	40.5 Å²	40.5	25%	0.253	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	145.3	175.5	-6.2	18.5	0	0	0	111.6	D2957 F2969 D2973 D2974	D2957-P2971 WeakPolarHBondContact O-CA 3.36Å; F2969-P2971 HydrophobicContact CD1-CG 4.44Å; F2969-P2971 HydrophobicContact CE1-CB 4.14Å; F2969-P2971 HydrophobicContact CE1-CG 3.83Å; F2969-P2971 HydrophobicContact CZ-CB 4.23Å; F2969-P2971 HydrophobicContact CZ-CG 4.38Å; P2971-D2973 PolarHBondContact O-N 2.84Å; P2971-D2974 HydrophobicContact CB-CB 4.18Å; P2971-D2974 HydrophobicContact CG-CB 3.95Å; P2971-D2974 WeakPolarHBondContact O-CB 3.38Å; P2971-D2974 PolarHBondContact O-N 2.9Å
2972	F	80.5	Confident	78.5	Confident	49 Å²	49	40.7 Å²	40.7	22%	0.215	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-30.3	175.6	-68.3	-53.7	0	0	0	113.4	L2900 H2901 Y2955 D2957 G2958 I2959 D2974	L2900-F2972 HydrophobicContact CD1-CE1 3.95Å; L2900-F2972 WeakPolarHBondContact O-CE1 3.42Å; L2900-F2972 WeakPolarHBondContact O-CZ 3.19Å; H2901-F2972 AromaticContact CE1-CD2 3.43Å; H2901-F2972 VanDerWaalsContact CE1-CD2 3.43Å; H2901-F2972 WeakPolarHBondContact CE1-CD2 3.46Å; H2901-F2972 AromaticContact CE1-CE2 3.58Å; H2901-F2972 AromaticContact CE1-CG 3.71Å; H2901-F2972 AromaticContact ND1-CD2 3.86Å; H2901-F2972 AromaticContact ND1-CE2 3.59Å; Y2955-F2972 WeakPolarHBondContact O-CE2 3.44Å; D2957-F2972 PolarHBondContact O-N 2.94Å; G2958-F2972 VanDerWaalsContact CA-CE2 3.47Å; I2959-F2972 HydrophobicContact CD1-CE1 4.11Å; I2959-F2972 HydrophobicContact CG1-CD1 4.34Å; I2959-F2972 HydrophobicContact CG1-CE1 3.6Å; I2959-F2972 HydrophobicContact CG1-CZ 4.23Å; F2972-D2974 PolarHBondContact O-N 3.2Å
2973	D	76.2	Confident	77.8	Confident	165 Å²	165	45.6 Å²	45.6	88%	0.882	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-6.3	179.6	-66.1	-20.2	0	0	0	113.3	P2971 S2975	P2971-D2973 PolarHBondContact O-N 2.84Å; D2973-S2975 PolarHBondContact O-N 2.81Å
2974	D	76.9	Confident	77.5	Confident	44 Å²	44	46.7 Å²	46.7	24%	0.235	28%	0.282	C	S	.	.			trans	-85.2	108.6	-178.7	-166.1	-11.2	0	0	0	111.3	H2970 P2971 F2972 T2976	H2970-D2974 PolarHBondContact CE1-O 3.39Å; H2970-D2974 VanDerWaalsContact CE1-O 3.29Å; H2970-D2974 PolarHBondContact NE2-O 2.84Å; P2971-D2974 HydrophobicContact CB-CB 4.18Å; P2971-D2974 HydrophobicContact CG-CB 3.95Å; P2971-D2974 WeakPolarHBondContact O-CB 3.38Å; P2971-D2974 PolarHBondContact O-N 2.9Å; F2972-D2974 PolarHBondContact O-N 3.2Å; D2974-T2976 PolarHBondContact O-N 2.96Å; D2974-T2976 VanDerWaalsContact OD1-CB 3.29Å; D2974-T2976 WeakPolarHBondContact OD1-CB 3.01Å; D2974-T2976 VanDerWaalsContact OD1-CG2 3.25Å; D2974-T2976 WeakPolarHBondContact OD1-CG2 3.35Å; D2974-T2976 PolarHBondContact OD1-N 2.96Å; D2974-T2976 PolarHBondContact OD1-OG1 2.98Å; D2974-T2976 PolarHBondContact OD2-OG1 3.29Å
2975	S	76.1	Confident	77.4	Confident	105 Å²	105	45.8 Å²	45.8	73%	0.734	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-3.1	177.9	67.3	0	0	0	0	113.7	D2973 H2977	D2973-S2975 PolarHBondContact O-N 2.81Å; S2975-H2977 VanDerWaalsContact C-N 3.29Å
2976	T	76.6	Confident	77.7	Confident	84 Å²	84	45.1 Å²	45.1	52%	0.515	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-19.6	-177.8	64.2	0	0	0	0	112.9	D2974 V2978	D2974-T2976 PolarHBondContact O-N 2.96Å; D2974-T2976 VanDerWaalsContact OD1-CB 3.29Å; D2974-T2976 WeakPolarHBondContact OD1-CB 3.01Å; D2974-T2976 VanDerWaalsContact OD1-CG2 3.25Å; D2974-T2976 WeakPolarHBondContact OD1-CG2 3.35Å; D2974-T2976 PolarHBondContact OD1-N 2.96Å; D2974-T2976 PolarHBondContact OD1-OG1 2.98Å; D2974-T2976 PolarHBondContact OD2-OG1 3.29Å; T2976-V2978 WeakPolarHBondContact O-CG2 3.37Å; T2976-V2978 PolarHBondContact O-N 2.95Å
2977	H	79.9	Confident	77.5	Confident	78 Å²	78	45.7 Å²	45.7	36%	0.361	27%	0.273	S	S	.	.			trans	57.3	29.7	-174.6	-61.2	-54.5	0	0	0	113.2	V2934 L2936 R2937 H2970 S2975	V2934-H2977 VanDerWaalsContact CG1-CE1 3.49Å; V2934-H2977 WeakPolarHBondContact CG1-CE1 3.29Å; L2936-H2977 HydrophobicContact CD2-CB 3.84Å; R2937-H2977 PolarHBondContact N-O 3.23Å; H2970-H2977 VanDerWaalsContact NE2-CA 3.29Å; H2970-H2977 WeakPolarHBondContact NE2-CA 3.37Å; S2975-H2977 VanDerWaalsContact C-N 3.29Å
2978	V	80.6	Confident	77	Confident	36 Å²	36	52.1 Å²	52.1	22%	0.218	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	123.8	-177.1	177.3	0	0	0	0	111.3	R2937 R2939 H2970 T2976	R2937-V2978 CarbonylContact O-C 3.57Å; R2937-V2978 VanDerWaalsContact O-CA 3.28Å; R2937-V2978 WeakPolarHBondContact O-CA 3.35Å; R2939-V2978 HydrophobicContact CB-CG1 3.57Å; R2939-V2978 HydrophobicContact CG-CG1 3.99Å; H2970-V2978 PolarHBondContact CD2-O 2.79Å; T2976-V2978 WeakPolarHBondContact O-CG2 3.37Å; T2976-V2978 PolarHBondContact O-N 2.95Å
2979	F	82.7	Confident	76.2	Confident	2 Å²	2	54.6 Å²	54.6	1%	0.009	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	139.6	172.3	-80	-76.3	0	0	0	111.9	V2921 L2936 R2937 V2938 I2959 V2961 L2968 H2970	V2921-F2979 HydrophobicContact CB-CE2 4.03Å; V2921-F2979 HydrophobicContact CB-CZ 4.36Å; V2921-F2979 HydrophobicContact CG1-CE2 4.34Å; V2921-F2979 HydrophobicContact CG1-CZ 4.21Å; V2921-F2979 HydrophobicContact CG2-CE2 4.18Å; V2921-F2979 HydrophobicContact CG2-CZ 4.43Å; L2936-F2979 HydrophobicContact CB-CD2 4.14Å; L2936-F2979 HydrophobicContact CB-CE2 3.52Å; L2936-F2979 HydrophobicContact CB-CZ 4.28Å; L2936-F2979 HydrophobicContact CD1-CE2 3.88Å; L2936-F2979 HydrophobicContact CD1-CZ 3.76Å; L2936-F2979 HydrophobicContact CG-CE2 4.35Å; R2937-F2979 PolarHBondContact O-N 2.88Å; V2938-F2979 HydrophobicContact CG2-CD2 4.45Å; I2959-F2979 HydrophobicContact CB-CE1 4.35Å; I2959-F2979 HydrophobicContact CG2-CE1 4.15Å; I2959-F2979 HydrophobicContact CG2-CZ 4.07Å; V2961-F2979 HydrophobicContact CB-CE1 4.28Å; V2961-F2979 HydrophobicContact CB-CZ 4.48Å; V2961-F2979 HydrophobicContact CG2-CD1 4.44Å; V2961-F2979 HydrophobicContact CG2-CE1 3.57Å; V2961-F2979 HydrophobicContact CG2-CE2 4.27Å; V2961-F2979 HydrophobicContact CG2-CZ 3.47Å; V2961-F2979 VanDerWaalsContact CG2-CZ 3.47Å; L2968-F2979 HydrophobicContact CB-CB 4.08Å; L2968-F2979 HydrophobicContact CB-CD1 4.01Å; L2968-F2979 HydrophobicContact CB-CG 4.29Å; L2968-F2979 HydrophobicContact CD1-CB 4.15Å; H2970-F2979 HydrophobicContact CB-CD1 3.61Å; H2970-F2979 HydrophobicContact CB-CE1 3.53Å; H2970-F2979 HydrophobicContact CB-CG 4.3Å; H2970-F2979 HydrophobicContact CB-CZ 4.19Å
2980	T	79.8	Confident	75.2	Confident	44 Å²	44	61.3 Å²	61.3	27%	0.27	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	145.4	172.8	58.2	0	0	0	0	110.8	L2968 F2969 L2982	L2968-T2980 CarbonylContact C-O 3.57Å; L2968-T2980 WeakPolarHBondContact CA-O 3.3Å; F2969-T2980 PolarHBondContact N-O 2.61Å; F2969-T2980 PolarHBondContact O-N 3.22Å; F2969-T2980 PolarHBondContact O-OG1 3.22Å; T2980-L2982 PolarHBondContact O-N 3.33Å
2981	P	77.2	Confident	74.1	Confident	63 Å²	63	67.5 Å²	67.5	41%	0.409	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58	134.3	174.2	-22.7	32.9	0	0	0	111.3	L2968	L2968-P2981 HydrophobicContact CD2-CB 4.34Å; L2968-P2981 HydrophobicContact CD2-CG 4.26Å
2982	L	75.7	Confident	73.4	Confident	5 Å²	5	66.7 Å²	66.7	3%	0.026	38%	0.379	C	S	.	.			trans	-59.6	127.1	175.5	-161.6	77.2	0	0	0	110	L2960 A2967 F2969 T2980 G2984 I2986 N2987 I2997 Y3012 E3031	L2960-L2982 HydrophobicContact CD2-CD1 3.81Å; L2960-L2982 HydrophobicContact CD2-CD2 4.33Å; A2967-L2982 HydrophobicContact CB-CB 4.02Å; A2967-L2982 HydrophobicContact CB-CD2 4.12Å; A2967-L2982 WeakPolarHBondContact O-CB 3.31Å; A2967-L2982 PolarHBondContact O-N 2.9Å; F2969-L2982 HydrophobicContact CB-CD1 3.6Å; F2969-L2982 HydrophobicContact CG-CD1 4.16Å; T2980-L2982 PolarHBondContact O-N 3.33Å; L2982-G2984 PolarHBondContact O-N 3.39Å; L2982-I2986 HydrophobicContact CD2-CD1 3.6Å; L2982-N2987 PolarHBondContact N-ND2 3.34Å; L2982-N2987 VanDerWaalsContact N-ND2 3.17Å; L2982-N2987 PolarHBondContact O-ND2 3.09Å; L2982-I2997 HydrophobicContact CD2-CD1 4.35Å; L2982-Y3012 HydrophobicContact CD2-CE2 4.3Å; L2982-E3031 WeakPolarHBondContact CG-OE1 2.97Å
2983	P	67.9	Low	73	Confident	103 Å²	103	68.1 Å²	68.1	67%	0.669	39%	0.386	S	S	*	.	S	Bend	trans	-83.3	102	-170.8	31.1	-34.5	0	0	0	114.1	E3031	P2983-E3031 VanDerWaalsContact C-CD 3.41Å; P2983-E3031 VanDerWaalsContact O-OE1 3.08Å
2984	G	68.5	Low	72.9	Confident	29 Å²	29	60.4 Å²	60.4	30%	0.299	34%	0.344	S	S	.	.	S	Bend	trans	161.9	-155.4	174.4	0	0	0	0	0	114.1	L2982 I2986 N2988 E3031	L2982-G2984 PolarHBondContact O-N 3.39Å; G2984-I2986 VanDerWaalsContact C-N 3.33Å; G2984-I2986 PolarHBondContact O-N 3.5Å; G2984-N2988 PolarHBondContact O-ND2 3.34Å; G2984-E3031 WeakPolarHBondContact CA-OE2 3.47Å; G2984-E3031 PolarHBondContact N-OE2 2.83Å
2985	S	67.9	Low	72.8	Confident	36 Å²	36	60.2 Å²	60.2	25%	0.252	34%	0.343	S	S	.	.	S	Bend	trans	-77	-17	-175.9	77.5	0	0	0	0	114.1	N2987 N2988 L2989 E3031	S2985-N2987 VanDerWaalsContact C-N 3.28Å; S2985-N2987 PolarHBondContact O-N 2.83Å; S2985-N2988 PolarHBondContact O-N 3.18Å; S2985-L2989 WeakPolarHBondContact O-CG 3.48Å; S2985-E3031 WeakPolarHBondContact CB-O 3.4Å; S2985-E3031 PolarHBondContact N-O 2.81Å; S2985-E3031 PolarHBondContact OG-O 2.95Å
2986	I	73	Confident	72.8	Confident	4 Å²	4	58.3 Å²	58.3	2%	0.021	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-54	-44.2	-179	-68.8	167.4	0	0	0	111.6	A2967 L2982 G2984 I2994 Y3012 F3027 E3031	A2967-I2986 HydrophobicContact CB-CG2 3.78Å; L2982-I2986 HydrophobicContact CD2-CD1 3.6Å; G2984-I2986 VanDerWaalsContact C-N 3.33Å; G2984-I2986 PolarHBondContact O-N 3.5Å; I2986-I2994 HydrophobicContact CG2-CD1 3.83Å; I2986-Y3012 HydrophobicContact CD1-CD2 3.95Å; I2986-Y3012 HydrophobicContact CD1-CG 4.31Å; I2986-F3027 HydrophobicContact CB-CE1 4.41Å; I2986-F3027 HydrophobicContact CB-CZ 4.46Å; I2986-F3027 HydrophobicContact CD1-CB 3.87Å; I2986-F3027 HydrophobicContact CD1-CD1 4.12Å; I2986-F3027 HydrophobicContact CD1-CD2 3.96Å; I2986-F3027 HydrophobicContact CD1-CG 3.72Å; I2986-F3027 HydrophobicContact CG1-CB 4.11Å; I2986-F3027 HydrophobicContact CG1-CD1 3.37Å; I2986-F3027 HydrophobicContact CG1-CD2 3.65Å; I2986-F3027 HydrophobicContact CG1-CE1 3.55Å; I2986-F3027 HydrophobicContact CG1-CE2 3.81Å; I2986-F3027 HydrophobicContact CG1-CG 3.43Å; I2986-F3027 VanDerWaalsContact CG1-CG 3.43Å; I2986-F3027 HydrophobicContact CG1-CZ 3.76Å; I2986-E3031 HydrophobicContact CD1-CB 4.46Å; I2986-E3031 HydrophobicContact CD1-CG 4.29Å
2987	N	70.4	Confident	72.9	Confident	38 Å²	38	54.3 Å²	54.3	20%	0.203	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-85.6	-5.2	-178.4	-74.5	-32	0	0	0	114.3	S2966 A2967 L2982 S2985	S2966-N2987 VanDerWaalsContact CA-OD1 3.3Å; S2966-N2987 WeakPolarHBondContact CA-OD1 3.44Å; A2967-N2987 PolarHBondContact N-OD1 3.02Å; A2967-N2987 PolarHBondContact O-ND2 3.48Å; A2967-N2987 PolarHBondContact O-OD1 2.9Å; L2982-N2987 PolarHBondContact N-ND2 3.34Å; L2982-N2987 VanDerWaalsContact N-ND2 3.17Å; L2982-N2987 PolarHBondContact O-ND2 3.09Å; S2985-N2987 VanDerWaalsContact C-N 3.28Å; S2985-N2987 PolarHBondContact O-N 2.83Å
2988	N	69.5	Low	72.9	Confident	134 Å²	134	53.1 Å²	53.1	72%	0.717	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-105	11.3	-177	-70.8	-28.9	0	0	0	113	G2984 S2985 E2990	G2984-N2988 PolarHBondContact O-ND2 3.34Å; S2985-N2988 PolarHBondContact O-N 3.18Å; N2988-E2990 PolarHBondContact O-N 2.87Å
2989	L	66.4	Low	72.8	Confident	54 Å²	54	52.9 Å²	52.9	28%	0.283	29%	0.29	S	S	.	.			trans	-85.4	105.4	-179.6	-70.3	160.3	0	0	0	110.4	S2985 N2991 I2992 F3027	S2985-L2989 WeakPolarHBondContact O-CG 3.48Å; L2989-N2991 PolarHBondContact O-N 2.79Å; L2989-I2992 HydrophobicContact CB-CB 3.98Å; L2989-I2992 HydrophobicContact CB-CD1 3.74Å; L2989-I2992 HydrophobicContact CB-CG1 3.93Å; L2989-I2992 HydrophobicContact CD1-CD1 4.11Å; L2989-I2992 HydrophobicContact CD2-CD1 4.18Å; L2989-I2992 HydrophobicContact CG-CD1 4.21Å; L2989-I2992 PolarHBondContact O-N 3.17Å; L2989-F3027 HydrophobicContact CD1-CE1 3.9Å; L2989-F3027 HydrophobicContact CD1-CZ 3.5Å; L2989-F3027 VanDerWaalsContact CD1-CZ 3.5Å
2990	E	63.9	Low	72.3	Confident	170 Å²	170	53.9 Å²	53.9	79%	0.794	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	132.4	176.4	-70.5	-173.5	169	0	0	111.3	N2988 I2992	N2988-E2990 PolarHBondContact O-N 2.87Å; E2990-I2992 VanDerWaalsContact C-N 3.3Å; E2990-I2992 PolarHBondContact O-N 3.02Å
2991	N	64	Low	71.9	Confident	135 Å²	135	54.3 Å²	54.3	72%	0.722	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.3	9.4	174.4	-50.3	-44.4	0	0	0	116.9	L2989 L3018	L2989-N2991 PolarHBondContact O-N 2.79Å; N2991-L3018 HydrophobicContact CB-CD1 3.64Å; N2991-L3018 WeakPolarHBondContact O-CD1 3.37Å
2992	I	67.7	Low	71.6	Confident	23 Å²	23	51.4 Å²	51.4	12%	0.118	28%	0.28	C	S	.	.			trans	-94.8	113.6	-179.9	-63.3	-161.7	0	0	0	110.2	L2989 E2990 S3016 L3018 I3025	L2989-I2992 HydrophobicContact CB-CB 3.98Å; L2989-I2992 HydrophobicContact CB-CD1 3.74Å; L2989-I2992 HydrophobicContact CB-CG1 3.93Å; L2989-I2992 HydrophobicContact CD1-CD1 4.11Å; L2989-I2992 HydrophobicContact CD2-CD1 4.18Å; L2989-I2992 HydrophobicContact CG-CD1 4.21Å; L2989-I2992 PolarHBondContact O-N 3.17Å; E2990-I2992 VanDerWaalsContact C-N 3.3Å; E2990-I2992 PolarHBondContact O-N 3.02Å; I2992-S3016 WeakPolarHBondContact CG2-OG 3.43Å; I2992-L3018 HydrophobicContact CG1-CD1 4.34Å; I2992-I3025 HydrophobicContact CD1-CD1 4.16Å
2993	H	71.6	Confident	70.9	Confident	78 Å²	78	55.5 Å²	55.5	36%	0.361	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	113.4	173.4	-174	-79.9	0	0	0	110.5	D2995 S3016 K3017	H2993-D2995 IonicContact CE1-OD1 2.93Å; H2993-D2995 IonicContact ND1-OD1 3.08Å; H2993-D2995 PolarHBondContact ND1-OD1 3.33Å; H2993-D2995 PolarHBondContact O-N 2.66Å; H2993-S3016 PolarHBondContact N-OG 3.26Å; H2993-S3016 WeakPolarHBondContact O-CA 3.44Å; H2993-S3016 WeakPolarHBondContact O-CB 3.23Å; H2993-S3016 PolarHBondContact O-OG 2.84Å; H2993-K3017 PolarHBondContact N-O 3.24Å; H2993-K3017 PolarHBondContact O-N 3.26Å; H2993-K3017 VanDerWaalsContact O-N 3.16Å
2994	I	73.8	Confident	70.7	Confident	3 Å²	3	53.5 Å²	53.5	2%	0.015	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	112.7	178.5	-60	179	0	0	0	109.5	S2950 A2962 G2965 A2967 I2986 V3014	S2950-I2994 PolarHBondContact OG-O 3.08Å; S2950-I2994 VanDerWaalsContact OG-O 3.09Å; A2962-I2994 HydrophobicContact CB-CB 4.38Å; A2962-I2994 HydrophobicContact CB-CG2 3.56Å; G2965-I2994 WeakPolarHBondContact O-CD1 3.44Å; G2965-I2994 WeakPolarHBondContact O-CG1 3.32Å; A2967-I2994 HydrophobicContact CB-CD1 4.2Å; I2986-I2994 HydrophobicContact CG2-CD1 3.83Å; I2994-V3014 HydrophobicContact CB-CG1 4.42Å; I2994-V3014 HydrophobicContact CD1-CG1 4.45Å; I2994-V3014 HydrophobicContact CG1-CG1 3.98Å; I2994-V3014 HydrophobicContact CG2-CG1 3.97Å
2995	D	74.7	Confident	70.4	Confident	40 Å²	40	55.7 Å²	55.7	21%	0.214	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	-40	176.3	-76.8	2.5	0	0	0	111.5	S2950 S2951 H2993 T3015 K3017	S2950-D2995 WeakPolarHBondContact CB-O 3.49Å; S2950-D2995 PolarHBondContact OG-O 2.92Å; S2950-D2995 VanDerWaalsContact OG-O 3.13Å; S2951-D2995 PolarHBondContact OG-O 3.01Å; H2993-D2995 IonicContact CE1-OD1 2.93Å; H2993-D2995 IonicContact ND1-OD1 3.08Å; H2993-D2995 PolarHBondContact ND1-OD1 3.33Å; H2993-D2995 PolarHBondContact O-N 2.66Å; D2995-T3015 WeakPolarHBondContact CA-O 2.94Å; D2995-T3015 WeakPolarHBondContact CB-O 3.21Å; D2995-T3015 PolarHBondContact N-O 3.28Å; D2995-K3017 WeakPolarHBondContact OD2-CD 3.37Å; D2995-K3017 VanDerWaalsContact OD2-CE 3.27Å; D2995-K3017 WeakPolarHBondContact OD2-CE 3.38Å; D2995-K3017 IonicContact OD2-NZ 3.5Å; D2995-K3017 PolarHBondContact OD2-NZ 3.48Å
2996	R	76.4	Confident	70	Confident	65 Å²	65	62.7 Å²	62.7	25%	0.245	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	143.1	179.6	-164.1	172.9	167.4	109.3	3.6	111.3	E2896 S2951 E2998 V3014 T3015 Y3049	E2896-R2996 IonicContact OE1-CZ 3.6Å; E2896-R2996 IonicContact OE1-NH1 3.48Å; E2896-R2996 PolarHBondContact OE1-NH1 2.82Å; E2896-R2996 IonicContact OE1-NH2 3.78Å; S2951-R2996 VanDerWaalsContact OG-CA 3.31Å; S2951-R2996 WeakPolarHBondContact OG-CA 3.28Å; R2996-E2998 HydrophobicContact CG-CG 4.46Å; R2996-E2998 IonicContact CZ-OE1 3.13Å; R2996-E2998 IonicContact NE-OE1 2.7Å; R2996-E2998 PolarHBondContact NE-OE1 3.24Å; R2996-E2998 IonicContact NH2-OE1 2.7Å; R2996-E2998 PolarHBondContact NH2-OE1 3.15Å; R2996-V3014 CarbonylContact O-C 3.58Å; R2996-V3014 WeakPolarHBondContact O-CA 3.15Å; R2996-T3015 WeakPolarHBondContact CB-OG1 3.2Å; R2996-T3015 PolarHBondContact N-O 3.41Å; R2996-T3015 VanDerWaalsContact N-O 3.16Å; R2996-T3015 PolarHBondContact N-OG1 3.39Å; R2996-T3015 PolarHBondContact O-N 2.72Å; R2996-Y3049 WeakPolarHBondContact CD-OH 3.37Å
2997	I	80	Confident	69.4	Low	1 Å²	1	65.3 Å²	65.3	1%	0.005	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	132.8	171.5	-169.8	163.1	0	0	0	109.8	C2953 L2960 A2962 A2967 L2982 Y3012 I3013 V3014	C2953-I2997 PolarHBondContact SG-O 3.47Å; L2960-I2997 HydrophobicContact CB-CG2 4.29Å; L2960-I2997 HydrophobicContact CD2-CD1 4.24Å; A2962-I2997 HydrophobicContact CB-CG2 4.34Å; A2967-I2997 HydrophobicContact CB-CD1 3.7Å; L2982-I2997 HydrophobicContact CD2-CD1 4.35Å; I2997-Y3012 HydrophobicContact CD1-CD1 4.48Å; I2997-I3013 CarbonylContact C-O 3.56Å; I2997-I3013 WeakPolarHBondContact CA-O 3.03Å; I2997-V3014 HydrophobicContact CD1-CG2 4.05Å; I2997-V3014 HydrophobicContact CG1-CG2 4Å
2998	E	78.6	Confident	69.1	Low	52 Å²	52	68.9 Å²	68.9	24%	0.243	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	131.1	176.3	-69.6	-172.7	171.5	0	0	111.1	R2996 I3013	R2996-E2998 HydrophobicContact CG-CG 4.46Å; R2996-E2998 IonicContact CZ-OE1 3.13Å; R2996-E2998 IonicContact NE-OE1 2.7Å; R2996-E2998 PolarHBondContact NE-OE1 3.24Å; R2996-E2998 IonicContact NH2-OE1 2.7Å; R2996-E2998 PolarHBondContact NH2-OE1 3.15Å; E2998-I3013 PolarHBondContact N-O 3.38Å; E2998-I3013 PolarHBondContact O-N 2.8Å
2999	P	78.4	Confident	69	Low	32 Å²	32	65.6 Å²	65.6	21%	0.208	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	134.2	174.4	29.7	-30	0	0	0	110.9	C2953 Y2955 L2960 L3010 L3011 Y3012	C2953-P2999 WeakPolarHBondContact SG-CD 3.46Å; Y2955-P2999 HydrophobicContact CD1-CG 4.34Å; Y2955-P2999 HydrophobicContact CG-CB 4.28Å; Y2955-P2999 HydrophobicContact CG-CG 4.24Å; L2960-P2999 HydrophobicContact CD1-CB 4.15Å; L2960-P2999 HydrophobicContact CD1-CG 4.04Å; P2999-L3010 HydrophobicContact CB-CD1 3.65Å; P2999-L3011 CarbonylContact C-O 3.53Å; P2999-Y3012 HydrophobicContact CB-CD1 4.34Å; P2999-Y3012 HydrophobicContact CB-CE1 4.37Å
3000	L	74	Confident	69.2	Low	23 Å²	23	63.9 Å²	63.9	12%	0.12	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	98.8	175.2	179.3	75.8	0	0	0	109	L3002 L3011 I3013 T3054	L3000-L3002 HydrophobicContact CD1-CD2 4.26Å; L3000-L3002 HydrophobicContact CD2-CD1 4.33Å; L3000-L3002 HydrophobicContact CD2-CD2 4.04Å; L3000-L3002 HydrophobicContact CD2-CG 4.22Å; L3000-L3002 HydrophobicContact CG-CD2 3.94Å; L3000-L3002 HydrophobicContact CG-CG 4.14Å; L3000-L3011 HydrophobicContact CB-CB 4.2Å; L3000-L3011 HydrophobicContact CD2-CB 4.41Å; L3000-L3011 HydrophobicContact CD2-CD1 3.99Å; L3000-L3011 PolarHBondContact N-O 3.03Å; L3000-L3011 PolarHBondContact O-N 2.82Å; L3000-I3013 HydrophobicContact CB-CD1 4.1Å; L3000-I3013 HydrophobicContact CD2-CD1 4.2Å; L3000-T3054 HydrophobicContact CD1-CG2 4.29Å; L3000-T3054 HydrophobicContact CD2-CG2 3.89Å
3001	C	70.9	Confident	69.7	Low	52 Å²	52	56.1 Å²	56.1	35%	0.351	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	114.7	174.4	-63.3	0	0	0	0	110.4
3002	L	69.6	Low	70.2	Confident	3 Å²	3	50.2 Å²	50.2	2%	0.016	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	131.5	177.5	-60.9	177.7	0	0	0	111.1	L3000 N3004 F3008 K3009 L3011 T3054 F3056 L3061	L3000-L3002 HydrophobicContact CD1-CD2 4.26Å; L3000-L3002 HydrophobicContact CD2-CD1 4.33Å; L3000-L3002 HydrophobicContact CD2-CD2 4.04Å; L3000-L3002 HydrophobicContact CD2-CG 4.22Å; L3000-L3002 HydrophobicContact CG-CD2 3.94Å; L3000-L3002 HydrophobicContact CG-CG 4.14Å; L3002-N3004 PolarHBondContact O-N 3.17Å; L3002-F3008 CarbonylContact O-C 3.59Å; L3002-F3008 VanDerWaalsContact O-CA 3.31Å; L3002-F3008 WeakPolarHBondContact O-CA 3.3Å; L3002-K3009 PolarHBondContact N-O 3.45Å; L3002-K3009 PolarHBondContact O-N 3.3Å; L3002-L3011 HydrophobicContact CD1-CD1 3.24Å; L3002-L3011 HydrophobicContact CG-CD1 4Å; L3002-T3054 HydrophobicContact CD2-CG2 4.44Å; L3002-T3054 WeakPolarHBondContact CD2-OG1 3.29Å; L3002-F3056 HydrophobicContact CB-CD2 4.21Å; L3002-F3056 HydrophobicContact CB-CE2 3.69Å; L3002-F3056 HydrophobicContact CD1-CD2 4.25Å; L3002-F3056 HydrophobicContact CD1-CE2 3.51Å; L3002-F3056 HydrophobicContact CD1-CZ 4.09Å; L3002-F3056 HydrophobicContact CG-CE2 4.28Å; L3002-L3061 HydrophobicContact CD1-CD1 3.31Å; L3002-L3061 HydrophobicContact CD1-CD2 3.56Å; L3002-L3061 HydrophobicContact CD1-CG 4.05Å; L3002-L3061 HydrophobicContact CD2-CD1 4.5Å
3003	P	61.3	Low	70.5	Confident	90 Å²	90	49.2 Å²	49.2	58%	0.584	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.6	125.2	174.1	26.1	-31.2	0	0	0	110.5	F3008	P3003-F3008 HydrophobicContact CB-CD1 4.44Å; P3003-F3008 HydrophobicContact CB-CE1 4.25Å
3004	N	63.8	Low	70.6	Confident	61 Å²	61	45.6 Å²	45.6	33%	0.326	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	77.1	177.1	-178.1	42.8	0	0	0	109.3	L3002 N3006 S3007 K3009	L3002-N3004 PolarHBondContact O-N 3.17Å; N3004-N3006 PolarHBondContact O-N 3.13Å; N3004-S3007 CarbonylContact C-O 3.56Å; N3004-S3007 VanDerWaalsContact CA-O 3.27Å; N3004-S3007 WeakPolarHBondContact CA-O 3.41Å; N3004-S3007 WeakPolarHBondContact CB-O 3.47Å; N3004-S3007 PolarHBondContact N-O 2.94Å; N3004-S3007 PolarHBondContact O-N 2.77Å; N3004-S3007 PolarHBondContact O-OG 3.33Å; N3004-K3009 HydrophobicContact CB-CB 4.44Å; N3004-K3009 HydrophobicContact CB-CD 4.3Å; N3004-K3009 HydrophobicContact CB-CG 4.01Å; N3004-K3009 WeakPolarHBondContact ND2-CE 3.44Å
3005	G	63.1	Low	70.6	Confident	75 Å²	75	46.3 Å²	46.3	77%	0.773	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.4	-124.4	-172.2	0	0	0	0	0	111.4	S3007	G3005-S3007 VanDerWaalsContact C-N 3.29Å
3006	N	59.7	Low	70.5	Confident	183 Å²	183	44.6 Å²	44.6	98%	0.979	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	3.3	175.8	-68.6	0.6	0	0	0	113.5	N3004	N3004-N3006 PolarHBondContact O-N 3.13Å
3007	S	59.1	Low	70.1	Confident	60 Å²	60	46.6 Å²	46.6	42%	0.42	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	156.3	-180	63.5	0	0	0	0	110	N3004 G3005	N3004-S3007 CarbonylContact C-O 3.56Å; N3004-S3007 VanDerWaalsContact CA-O 3.27Å; N3004-S3007 WeakPolarHBondContact CA-O 3.41Å; N3004-S3007 WeakPolarHBondContact CB-O 3.47Å; N3004-S3007 PolarHBondContact N-O 2.94Å; N3004-S3007 PolarHBondContact O-N 2.77Å; N3004-S3007 PolarHBondContact O-OG 3.33Å; G3005-S3007 VanDerWaalsContact C-N 3.29Å
3008	F	64	Low	69.4	Low	113 Å²	113	48 Å²	48	50%	0.496	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	135.4	169.1	-63.2	-81.1	0	0	0	109.5	L3002 P3003	L3002-F3008 CarbonylContact O-C 3.59Å; L3002-F3008 VanDerWaalsContact O-CA 3.31Å; L3002-F3008 WeakPolarHBondContact O-CA 3.3Å; P3003-F3008 HydrophobicContact CB-CD1 4.44Å; P3003-F3008 HydrophobicContact CB-CE1 4.25Å
3009	K	67.2	Low	68.6	Low	65 Å²	65	53.8 Å²	53.8	28%	0.283	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	120.2	162.1	-83.9	-177.7	173.9	-179.1	0	107	L3002 N3004 F3056 V3083	L3002-K3009 PolarHBondContact N-O 3.45Å; L3002-K3009 PolarHBondContact O-N 3.3Å; N3004-K3009 HydrophobicContact CB-CB 4.44Å; N3004-K3009 HydrophobicContact CB-CD 4.3Å; N3004-K3009 HydrophobicContact CB-CG 4.01Å; N3004-K3009 WeakPolarHBondContact ND2-CE 3.44Å; K3009-F3056 HydrophobicContact CB-CE2 4.4Å; K3009-F3056 HydrophobicContact CB-CZ 4.46Å; K3009-F3056 HydrophobicContact CD-CE1 4.32Å; K3009-F3056 HydrophobicContact CD-CE2 4.14Å; K3009-F3056 HydrophobicContact CD-CZ 3.57Å; K3009-V3083 HydrophobicContact CD-CG1 4.3Å; K3009-V3083 VanDerWaalsContact NZ-CG1 3.3Å
3010	L	71.7	Confident	67.8	Low	18 Å²	18	57.6 Å²	57.6	9%	0.094	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	140.6	175.9	162.5	80.7	0	0	0	108.4	Y2955 P2999 Y3012 N3029	Y2955-L3010 HydrophobicContact CD2-CD2 4.44Å; Y2955-L3010 HydrophobicContact CE2-CD2 3.97Å; P2999-L3010 HydrophobicContact CB-CD1 3.65Å; L3010-Y3012 HydrophobicContact CD1-CE1 4.24Å; L3010-Y3012 HydrophobicContact CD2-CE1 4.03Å; L3010-Y3012 HydrophobicContact CD2-CE2 4.34Å; L3010-Y3012 VanDerWaalsContact CD2-OH 3.27Å; L3010-Y3012 WeakPolarHBondContact CD2-OH 2.98Å; L3010-Y3012 HydrophobicContact CG-CE1 4.23Å; L3010-Y3012 HydrophobicContact CG-CE2 4.5Å; L3010-N3029 WeakPolarHBondContact CA-OD1 3.44Å; L3010-N3029 WeakPolarHBondContact CB-OD1 3.45Å; L3010-N3029 WeakPolarHBondContact CG-OD1 3.36Å; L3010-N3029 PolarHBondContact N-ND2 3.43Å; L3010-N3029 VanDerWaalsContact N-ND2 3.15Å; L3010-N3029 PolarHBondContact N-OD1 2.92Å; L3010-N3029 PolarHBondContact O-N 3.25Å; L3010-N3029 PolarHBondContact O-OD1 3.02Å
3011	L	73.2	Confident	67.5	Low	6 Å²	6	60 Å²	60	3%	0.031	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	148.2	176.9	-70	143	0	0	0	106.9	P2999 L3000 L3002 F3027 N3028 L3034 L3061	P2999-L3011 CarbonylContact C-O 3.53Å; L3000-L3011 HydrophobicContact CB-CB 4.2Å; L3000-L3011 HydrophobicContact CD2-CB 4.41Å; L3000-L3011 HydrophobicContact CD2-CD1 3.99Å; L3000-L3011 PolarHBondContact N-O 3.03Å; L3000-L3011 PolarHBondContact O-N 2.82Å; L3002-L3011 HydrophobicContact CD1-CD1 3.24Å; L3002-L3011 HydrophobicContact CG-CD1 4Å; L3011-F3027 CarbonylContact C-O 3.57Å; L3011-F3027 WeakPolarHBondContact CA-O 3.12Å; L3011-F3027 WeakPolarHBondContact CD2-O 3.29Å; L3011-N3028 HydrophobicContact CD2-CB 4.34Å; L3011-L3034 HydrophobicContact CD2-CD1 3.23Å; L3011-L3061 HydrophobicContact CD1-CD2 3.45Å; L3011-L3061 VanDerWaalsContact CD1-CD2 3.45Å
3012	Y	75.2	Confident	67.2	Low	12 Å²	12	59.1 Å²	59.1	5%	0.047	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	136.8	174	-56.6	-75.8	0	0	0	110.1	L2960 L2982 I2986 I2997 P2999 L3010 F3026 F3027 E3031	L2960-Y3012 HydrophobicContact CD1-CD1 4.32Å; L2960-Y3012 HydrophobicContact CD1-CE1 3.85Å; L2960-Y3012 HydrophobicContact CD2-CE1 4.28Å; L2982-Y3012 HydrophobicContact CD2-CE2 4.3Å; I2986-Y3012 HydrophobicContact CD1-CD2 3.95Å; I2986-Y3012 HydrophobicContact CD1-CG 4.31Å; I2997-Y3012 HydrophobicContact CD1-CD1 4.48Å; P2999-Y3012 HydrophobicContact CB-CD1 4.34Å; P2999-Y3012 HydrophobicContact CB-CE1 4.37Å; L3010-Y3012 HydrophobicContact CD1-CE1 4.24Å; L3010-Y3012 HydrophobicContact CD2-CE1 4.03Å; L3010-Y3012 HydrophobicContact CD2-CE2 4.34Å; L3010-Y3012 VanDerWaalsContact CD2-OH 3.27Å; L3010-Y3012 WeakPolarHBondContact CD2-OH 2.98Å; L3010-Y3012 HydrophobicContact CG-CE1 4.23Å; L3010-Y3012 HydrophobicContact CG-CE2 4.5Å; Y3012-F3026 CarbonylContact O-C 3.53Å; Y3012-F3026 WeakPolarHBondContact O-CA 3.2Å; Y3012-F3027 PolarHBondContact N-O 3.36Å; Y3012-F3027 PolarHBondContact O-N 3Å; Y3012-E3031 HydrophobicContact CE2-CG 4.39Å
3013	I	75.2	Confident	67.3	Low	2 Å²	2	60.8 Å²	60.8	1%	0.01	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	116.8	178.1	-57.2	177.1	0	0	0	106.5	I2997 E2998 L3000 I3024 I3025 F3026 I3051	I2997-I3013 CarbonylContact C-O 3.56Å; I2997-I3013 WeakPolarHBondContact CA-O 3.03Å; E2998-I3013 PolarHBondContact N-O 3.38Å; E2998-I3013 PolarHBondContact O-N 2.8Å; L3000-I3013 HydrophobicContact CB-CD1 4.1Å; L3000-I3013 HydrophobicContact CD2-CD1 4.2Å; I3013-I3024 HydrophobicContact CG2-CG2 3.93Å; I3013-I3025 WeakPolarHBondContact CA-O 3.45Å; I3013-F3026 HydrophobicContact CD1-CD1 4.02Å; I3013-F3026 HydrophobicContact CD1-CE1 3.35Å; I3013-F3026 HydrophobicContact CD1-CZ 3.88Å; I3013-F3026 HydrophobicContact CG1-CD1 3.7Å; I3013-F3026 HydrophobicContact CG1-CE1 3.53Å; I3013-F3026 HydrophobicContact CG1-CG 4.44Å; I3013-F3026 HydrophobicContact CG1-CZ 4.14Å; I3013-F3026 HydrophobicContact CG2-CZ 4.35Å; I3013-I3051 HydrophobicContact CD1-CD1 3.06Å; I3013-I3051 HydrophobicContact CD1-CG1 4.24Å; I3013-I3051 HydrophobicContact CG1-CD1 4.49Å
3014	V	73.5	Confident	67.9	Low	2 Å²	2	56.9 Å²	56.9	1%	0.012	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	120.5	-175.8	170.7	0	0	0	0	107.9	I2994 R2996 I2997 I3024 I3025 F3027	I2994-V3014 HydrophobicContact CB-CG1 4.42Å; I2994-V3014 HydrophobicContact CD1-CG1 4.45Å; I2994-V3014 HydrophobicContact CG1-CG1 3.98Å; I2994-V3014 HydrophobicContact CG2-CG1 3.97Å; R2996-V3014 CarbonylContact O-C 3.58Å; R2996-V3014 WeakPolarHBondContact O-CA 3.15Å; I2997-V3014 HydrophobicContact CD1-CG2 4.05Å; I2997-V3014 HydrophobicContact CG1-CG2 4Å; V3014-I3024 WeakPolarHBondContact O-CA 3.22Å; V3014-I3025 HydrophobicContact CB-CB 4.45Å; V3014-I3025 PolarHBondContact N-O 2.94Å; V3014-I3025 PolarHBondContact O-N 3.03Å; V3014-F3027 HydrophobicContact CB-CD2 4.36Å; V3014-F3027 HydrophobicContact CB-CE2 3.9Å; V3014-F3027 HydrophobicContact CG2-CD2 3.87Å; V3014-F3027 HydrophobicContact CG2-CE2 3.71Å
3015	T	74	Confident	68.4	Low	18 Å²	18	54 Å²	54	11%	0.11	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	128.7	165	62.7	0	0	0	0	109.2	D2995 R2996 R3023 I3024 Y3049	D2995-T3015 WeakPolarHBondContact CA-O 2.94Å; D2995-T3015 WeakPolarHBondContact CB-O 3.21Å; D2995-T3015 PolarHBondContact N-O 3.28Å; R2996-T3015 WeakPolarHBondContact CB-OG1 3.2Å; R2996-T3015 PolarHBondContact N-O 3.41Å; R2996-T3015 VanDerWaalsContact N-O 3.16Å; R2996-T3015 PolarHBondContact N-OG1 3.39Å; R2996-T3015 PolarHBondContact O-N 2.72Å; T3015-R3023 CarbonylContact C-O 3.55Å; T3015-R3023 VanDerWaalsContact CA-O 3.29Å; T3015-R3023 WeakPolarHBondContact CA-O 3.46Å; T3015-I3024 HydrophobicContact CG2-CG1 4.05Å; T3015-I3024 HydrophobicContact CG2-CG2 4.49Å; T3015-Y3049 HydrophobicContact CG2-CD1 4.27Å; T3015-Y3049 HydrophobicContact CG2-CE1 3.45Å; T3015-Y3049 VanDerWaalsContact CG2-CE1 3.45Å; T3015-Y3049 HydrophobicContact CG2-CE2 4.22Å; T3015-Y3049 VanDerWaalsContact CG2-CZ 3.41Å; T3015-Y3049 VanDerWaalsContact CG2-OH 3.29Å; T3015-Y3049 WeakPolarHBondContact CG2-OH 3.41Å
3016	S	71.7	Confident	69	Low	3 Å²	3	50.5 Å²	50.5	2%	0.021	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	158.4	-175.9	174.5	0	0	0	0	111.3	I2992 H2993 P3022 R3023	I2992-S3016 WeakPolarHBondContact CG2-OG 3.43Å; H2993-S3016 PolarHBondContact N-OG 3.26Å; H2993-S3016 WeakPolarHBondContact O-CA 3.44Å; H2993-S3016 WeakPolarHBondContact O-CB 3.23Å; H2993-S3016 PolarHBondContact O-OG 2.84Å; S3016-P3022 CarbonylContact O-C 3.56Å; S3016-R3023 PolarHBondContact N-O 3.11Å; S3016-R3023 PolarHBondContact O-N 2.83Å
3017	K	68.4	Low	69.6	Low	108 Å²	108	41.9 Å²	41.9	47%	0.47	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	122.6	162.6	-69.8	171.6	-173.4	126.1	0	109.8	H2993 D2995 E3021	H2993-K3017 PolarHBondContact N-O 3.24Å; H2993-K3017 PolarHBondContact O-N 3.26Å; H2993-K3017 VanDerWaalsContact O-N 3.16Å; D2995-K3017 WeakPolarHBondContact OD2-CD 3.37Å; D2995-K3017 VanDerWaalsContact OD2-CE 3.27Å; D2995-K3017 WeakPolarHBondContact OD2-CE 3.38Å; D2995-K3017 IonicContact OD2-NZ 3.5Å; D2995-K3017 PolarHBondContact OD2-NZ 3.48Å; K3017-E3021 WeakPolarHBondContact CA-O 3.34Å
3018	L	64	Low	70.1	Confident	30 Å²	30	40.4 Å²	40.4	16%	0.157	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	121.3	166.6	178.7	70.3	0	0	0	107.4	N2991 I2992 S3020 E3021 R3023	N2991-L3018 HydrophobicContact CB-CD1 3.64Å; N2991-L3018 WeakPolarHBondContact O-CD1 3.37Å; I2992-L3018 HydrophobicContact CG1-CD1 4.34Å; L3018-S3020 PolarHBondContact O-N 2.85Å; L3018-E3021 PolarHBondContact N-O 2.88Å; L3018-E3021 VanDerWaalsContact N-O 3.15Å; L3018-E3021 WeakPolarHBondContact O-CB 3.38Å; L3018-E3021 PolarHBondContact O-N 3.21Å; L3018-R3023 VanDerWaalsContact CD2-CZ 3.42Å
3019	E	62.9	Low	70.1	Confident	174 Å²	174	38.6 Å²	38.6	81%	0.813	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.1	31.8	179.4	-60.5	-172	164.7	0	0	114.5
3020	S	62.3	Low	70	Confident	112 Å²	112	41.2 Å²	41.2	78%	0.783	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.8	0.7	-174.6	-33.4	0	0	0	0	116.3	L3018	L3018-S3020 PolarHBondContact O-N 2.85Å
3021	E	66	Low	69.6	Low	74 Å²	74	41 Å²	41	35%	0.346	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	122.1	176	-61.3	-169.6	156.5	0	0	111.5	K3017 L3018 R3023	K3017-E3021 WeakPolarHBondContact CA-O 3.34Å; L3018-E3021 PolarHBondContact N-O 2.88Å; L3018-E3021 VanDerWaalsContact N-O 3.15Å; L3018-E3021 WeakPolarHBondContact O-CB 3.38Å; L3018-E3021 PolarHBondContact O-N 3.21Å; E3021-R3023 PolarHBondContact O-N 3.5Å
3022	P	66.6	Low	69.1	Low	33 Å²	33	45.5 Å²	45.5	21%	0.214	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	127.2	175.3	27.9	-32	0	0	0	110.7	S3016 L3039 V3046	S3016-P3022 CarbonylContact O-C 3.56Å; P3022-L3039 HydrophobicContact CG-CD1 4.06Å; P3022-V3046 HydrophobicContact CB-CG2 4.29Å; P3022-V3046 HydrophobicContact CG-CG2 4.25Å
3023	R	71.1	Confident	68.8	Low	38 Å²	38	48.2 Å²	48.2	14%	0.143	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	146.6	176.5	-68.7	-176	174.7	-162.2	-5	111.5	T3015 S3016 L3018 E3021 I3025 N3036 I3037	T3015-R3023 CarbonylContact C-O 3.55Å; T3015-R3023 VanDerWaalsContact CA-O 3.29Å; T3015-R3023 WeakPolarHBondContact CA-O 3.46Å; S3016-R3023 PolarHBondContact N-O 3.11Å; S3016-R3023 PolarHBondContact O-N 2.83Å; L3018-R3023 VanDerWaalsContact CD2-CZ 3.42Å; E3021-R3023 PolarHBondContact O-N 3.5Å; R3023-I3025 HydrophobicContact CB-CG1 4.31Å; R3023-N3036 PolarHBondContact NH1-ND2 2.99Å; R3023-I3037 VanDerWaalsContact CA-O 3.26Å; R3023-I3037 WeakPolarHBondContact CA-O 3.34Å
3024	I	73.5	Confident	68.2	Low	7 Å²	7	49.7 Å²	49.7	4%	0.036	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	114.5	171.9	-53.8	178.6	0	0	0	107.3	I3013 V3014 T3015 F3026 I3037 L3065 L3067	I3013-I3024 HydrophobicContact CG2-CG2 3.93Å; V3014-I3024 WeakPolarHBondContact O-CA 3.22Å; T3015-I3024 HydrophobicContact CG2-CG1 4.05Å; T3015-I3024 HydrophobicContact CG2-CG2 4.49Å; I3024-F3026 HydrophobicContact CG2-CE2 4.02Å; I3024-I3037 HydrophobicContact CB-CB 4.22Å; I3024-I3037 HydrophobicContact CB-CD1 4.05Å; I3024-I3037 HydrophobicContact CB-CG1 4.39Å; I3024-I3037 HydrophobicContact CG2-CD1 4.43Å; I3024-I3037 PolarHBondContact N-O 3.37Å; I3024-I3037 PolarHBondContact O-N 2.93Å; I3024-L3065 HydrophobicContact CD1-CD2 3.94Å; I3024-L3067 HydrophobicContact CD1-CD1 4.46Å; I3024-L3067 HydrophobicContact CD1-CD2 3.55Å
3025	I	74.6	Confident	68	Low	0 Å²	0	50 Å²	50	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	133.1	-170.8	-50.4	176.9	0	0	0	109.1	I2992 I3013 V3014 R3023 F3027 M3033 L3035 N3036	I2992-I3025 HydrophobicContact CD1-CD1 4.16Å; I3013-I3025 WeakPolarHBondContact CA-O 3.45Å; V3014-I3025 HydrophobicContact CB-CB 4.45Å; V3014-I3025 PolarHBondContact N-O 2.94Å; V3014-I3025 PolarHBondContact O-N 3.03Å; R3023-I3025 HydrophobicContact CB-CG1 4.31Å; I3025-F3027 HydrophobicContact CB-CE2 3.84Å; I3025-F3027 HydrophobicContact CB-CZ 4.34Å; I3025-F3027 HydrophobicContact CG2-CD2 4.05Å; I3025-F3027 HydrophobicContact CG2-CE1 4.31Å; I3025-F3027 HydrophobicContact CG2-CE2 3.37Å; I3025-F3027 HydrophobicContact CG2-CZ 3.52Å; I3025-M3033 HydrophobicContact CG2-CG 3.69Å; I3025-M3033 HydrophobicContact CG2-SD 4.1Å; I3025-L3035 CarbonylContact C-O 3.48Å; I3025-L3035 VanDerWaalsContact CA-O 3.27Å; I3025-L3035 WeakPolarHBondContact CA-O 3.47Å; I3025-L3035 VanDerWaalsContact CG2-O 3.31Å; I3025-L3035 WeakPolarHBondContact CG2-O 3.42Å; I3025-N3036 HydrophobicContact CG1-CB 4.35Å
3026	F	75	Confident	67.8	Low	3 Å²	3	51.7 Å²	51.7	1%	0.013	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	129.7	175	-72.8	-104.9	0	0	0	109.6	Y3012 I3013 I3024 L3034 L3035 W3092	Y3012-F3026 CarbonylContact O-C 3.53Å; Y3012-F3026 WeakPolarHBondContact O-CA 3.2Å; I3013-F3026 HydrophobicContact CD1-CD1 4.02Å; I3013-F3026 HydrophobicContact CD1-CE1 3.35Å; I3013-F3026 HydrophobicContact CD1-CZ 3.88Å; I3013-F3026 HydrophobicContact CG1-CD1 3.7Å; I3013-F3026 HydrophobicContact CG1-CE1 3.53Å; I3013-F3026 HydrophobicContact CG1-CG 4.44Å; I3013-F3026 HydrophobicContact CG1-CZ 4.14Å; I3013-F3026 HydrophobicContact CG2-CZ 4.35Å; I3024-F3026 HydrophobicContact CG2-CE2 4.02Å; F3026-L3034 HydrophobicContact CB-CB 4.43Å; F3026-L3034 WeakPolarHBondContact O-CB 3.15Å; F3026-L3034 PolarHBondContact O-N 3.29Å; F3026-L3035 HydrophobicContact CB-CB 4.06Å; F3026-L3035 HydrophobicContact CD2-CB 4.42Å; F3026-L3035 HydrophobicContact CD2-CD2 4.34Å; F3026-L3035 PolarHBondContact N-O 2.94Å; F3026-L3035 PolarHBondContact O-N 2.84Å; F3026-W3092 HydrophobicContact CD2-CZ2 4.03Å; F3026-W3092 AromaticContact CE2-CH2 3.87Å; F3026-W3092 HydrophobicContact CE2-CH2 3.87Å; F3026-W3092 AromaticContact CE2-CZ2 3.46Å; F3026-W3092 HydrophobicContact CE2-CZ2 3.46Å; F3026-W3092 VanDerWaalsContact CE2-CZ2 3.46Å; F3026-W3092 HydrophobicContact CZ-CH2 4.03Å; F3026-W3092 HydrophobicContact CZ-CZ2 4.07Å
3027	F	72.8	Confident	67.7	Low	1 Å²	1	52.1 Å²	52.1	0%	0.004	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	144.1	174.1	-63.9	-91.4	0	0	0	110.2	I2986 L2989 L3011 Y3012 V3014 I3025 H3032 M3033	I2986-F3027 HydrophobicContact CB-CE1 4.41Å; I2986-F3027 HydrophobicContact CB-CZ 4.46Å; I2986-F3027 HydrophobicContact CD1-CB 3.87Å; I2986-F3027 HydrophobicContact CD1-CD1 4.12Å; I2986-F3027 HydrophobicContact CD1-CD2 3.96Å; I2986-F3027 HydrophobicContact CD1-CG 3.72Å; I2986-F3027 HydrophobicContact CG1-CB 4.11Å; I2986-F3027 HydrophobicContact CG1-CD1 3.37Å; I2986-F3027 HydrophobicContact CG1-CD2 3.65Å; I2986-F3027 HydrophobicContact CG1-CE1 3.55Å; I2986-F3027 HydrophobicContact CG1-CE2 3.81Å; I2986-F3027 HydrophobicContact CG1-CG 3.43Å; I2986-F3027 VanDerWaalsContact CG1-CG 3.43Å; I2986-F3027 HydrophobicContact CG1-CZ 3.76Å; L2989-F3027 HydrophobicContact CD1-CE1 3.9Å; L2989-F3027 HydrophobicContact CD1-CZ 3.5Å; L2989-F3027 VanDerWaalsContact CD1-CZ 3.5Å; L3011-F3027 CarbonylContact C-O 3.57Å; L3011-F3027 WeakPolarHBondContact CA-O 3.12Å; L3011-F3027 WeakPolarHBondContact CD2-O 3.29Å; Y3012-F3027 PolarHBondContact N-O 3.36Å; Y3012-F3027 PolarHBondContact O-N 3Å; V3014-F3027 HydrophobicContact CB-CD2 4.36Å; V3014-F3027 HydrophobicContact CB-CE2 3.9Å; V3014-F3027 HydrophobicContact CG2-CD2 3.87Å; V3014-F3027 HydrophobicContact CG2-CE2 3.71Å; I3025-F3027 HydrophobicContact CB-CE2 3.84Å; I3025-F3027 HydrophobicContact CB-CZ 4.34Å; I3025-F3027 HydrophobicContact CG2-CD2 4.05Å; I3025-F3027 HydrophobicContact CG2-CE1 4.31Å; I3025-F3027 HydrophobicContact CG2-CE2 3.37Å; I3025-F3027 HydrophobicContact CG2-CZ 3.52Å; F3027-H3032 WeakPolarHBondContact CA-O 3.47Å; F3027-M3033 HydrophobicContact CD1-CB 4.23Å; F3027-M3033 HydrophobicContact CE1-CB 3.91Å; F3027-M3033 HydrophobicContact CE1-CG 4.44Å
3028	N	68.8	Low	67.7	Low	30 Å²	30	49.1 Å²	49.1	16%	0.16	26%	0.26	C	S	.	.			trans	-83.8	179.2	172.9	83.6	-3	0	0	0	112.8	L3011 N3030 E3031 H3032 L3034	L3011-N3028 HydrophobicContact CD2-CB 4.34Å; N3028-N3030 VanDerWaalsContact C-N 3.26Å; N3028-N3030 PolarHBondContact O-N 3.41Å; N3028-N3030 WeakPolarHBondContact OD1-CA 3.41Å; N3028-N3030 WeakPolarHBondContact OD1-CB 3.3Å; N3028-N3030 PolarHBondContact OD1-N 2.76Å; N3028-E3031 WeakPolarHBondContact O-CA 3.49Å; N3028-E3031 PolarHBondContact O-N 2.8Å; N3028-E3031 PolarHBondContact OD1-N 2.8Å; N3028-H3032 PolarHBondContact N-O 2.89Å; N3028-H3032 VanDerWaalsContact N-O 3.14Å; N3028-H3032 PolarHBondContact OD1-N 3.03Å; N3028-H3032 VanDerWaalsContact OD1-N 3.1Å; N3028-L3034 HydrophobicContact CB-CD1 3.69Å; N3028-L3034 HydrophobicContact CB-CD2 3.99Å; N3028-L3034 HydrophobicContact CB-CG 3.85Å
3029	N	65.1	Low	67.7	Low	74 Å²	74	49 Å²	49	40%	0.396	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-27.9	173.8	-97.1	-3.6	0	0	0	115.5	L3010	L3010-N3029 WeakPolarHBondContact CA-OD1 3.44Å; L3010-N3029 WeakPolarHBondContact CB-OD1 3.45Å; L3010-N3029 WeakPolarHBondContact CG-OD1 3.36Å; L3010-N3029 PolarHBondContact N-ND2 3.43Å; L3010-N3029 VanDerWaalsContact N-ND2 3.15Å; L3010-N3029 PolarHBondContact N-OD1 2.92Å; L3010-N3029 PolarHBondContact O-N 3.25Å; L3010-N3029 PolarHBondContact O-OD1 3.02Å
3030	N	64.7	Low	67.4	Low	121 Å²	121	46.8 Å²	46.8	65%	0.647	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87	8.4	171.5	-59.4	-5.9	0	0	0	111.1	N3028 H3032	N3028-N3030 VanDerWaalsContact C-N 3.26Å; N3028-N3030 PolarHBondContact O-N 3.41Å; N3028-N3030 WeakPolarHBondContact OD1-CA 3.41Å; N3028-N3030 WeakPolarHBondContact OD1-CB 3.3Å; N3028-N3030 PolarHBondContact OD1-N 2.76Å; N3030-H3032 PolarHBondContact O-N 3.14Å; N3030-H3032 VanDerWaalsContact O-N 3.15Å
3031	E	63	Low	67.2	Low	12 Å²	12	45.3 Å²	45.3	6%	0.056	25%	0.252	C	S	.	.			trans	55.9	28.2	177.4	-57.8	-170.7	-163.2	0	0	114.9	L2982 P2983 G2984 S2985 I2986 Y3012 N3028	L2982-E3031 WeakPolarHBondContact CG-OE1 2.97Å; P2983-E3031 VanDerWaalsContact C-CD 3.41Å; P2983-E3031 VanDerWaalsContact O-OE1 3.08Å; G2984-E3031 WeakPolarHBondContact CA-OE2 3.47Å; G2984-E3031 PolarHBondContact N-OE2 2.83Å; S2985-E3031 WeakPolarHBondContact CB-O 3.4Å; S2985-E3031 PolarHBondContact N-O 2.81Å; S2985-E3031 PolarHBondContact OG-O 2.95Å; I2986-E3031 HydrophobicContact CD1-CB 4.46Å; I2986-E3031 HydrophobicContact CD1-CG 4.29Å; Y3012-E3031 HydrophobicContact CE2-CG 4.39Å; N3028-E3031 WeakPolarHBondContact O-CA 3.49Å; N3028-E3031 PolarHBondContact O-N 2.8Å; N3028-E3031 PolarHBondContact OD1-N 2.8Å
3032	H	63.5	Low	67	Low	102 Å²	102	45.3 Å²	45.3	47%	0.472	25%	0.253	S	S	.	.			trans	-78.9	135.4	165.5	-70.7	-69.4	0	0	0	109.6	F3027 N3028 N3030 L3034	F3027-H3032 WeakPolarHBondContact CA-O 3.47Å; N3028-H3032 PolarHBondContact N-O 2.89Å; N3028-H3032 VanDerWaalsContact N-O 3.14Å; N3028-H3032 PolarHBondContact OD1-N 3.03Å; N3028-H3032 VanDerWaalsContact OD1-N 3.1Å; N3030-H3032 PolarHBondContact O-N 3.14Å; N3030-H3032 VanDerWaalsContact O-N 3.15Å; H3032-L3034 PolarHBondContact O-N 3.32Å
3033	M	67.4	Low	66.9	Low	68 Å²	68	53.6 Å²	53.6	34%	0.335	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	110.1	171.3	-176.9	-178.6	69.8	0	0	108.6	I3025 F3027 N3036	I3025-M3033 HydrophobicContact CG2-CG 3.69Å; I3025-M3033 HydrophobicContact CG2-SD 4.1Å; F3027-M3033 HydrophobicContact CD1-CB 4.23Å; F3027-M3033 HydrophobicContact CE1-CB 3.91Å; F3027-M3033 HydrophobicContact CE1-CG 4.44Å; M3033-N3036 HydrophobicContact SD-CB 4.15Å
3034	L	64.2	Low	66.8	Low	33 Å²	33	53.6 Å²	53.6	17%	0.173	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	-35.8	176.8	-69	174.1	0	0	0	111.1	L3011 F3026 N3028 H3032 I3081	L3011-L3034 HydrophobicContact CD2-CD1 3.23Å; F3026-L3034 HydrophobicContact CB-CB 4.43Å; F3026-L3034 WeakPolarHBondContact O-CB 3.15Å; F3026-L3034 PolarHBondContact O-N 3.29Å; N3028-L3034 HydrophobicContact CB-CD1 3.69Å; N3028-L3034 HydrophobicContact CB-CD2 3.99Å; N3028-L3034 HydrophobicContact CB-CG 3.85Å; H3032-L3034 PolarHBondContact O-N 3.32Å; L3034-I3081 HydrophobicContact CD1-CG2 4.45Å
3035	L	68.2	Low	66.8	Low	10 Å²	10	60.1 Å²	60.1	5%	0.052	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.3	141.6	-164.4	-146.4	81.3	0	0	0	111.7	I3025 F3026 C3079 I3081 S3090 W3092	I3025-L3035 CarbonylContact C-O 3.48Å; I3025-L3035 VanDerWaalsContact CA-O 3.27Å; I3025-L3035 WeakPolarHBondContact CA-O 3.47Å; I3025-L3035 VanDerWaalsContact CG2-O 3.31Å; I3025-L3035 WeakPolarHBondContact CG2-O 3.42Å; F3026-L3035 HydrophobicContact CB-CB 4.06Å; F3026-L3035 HydrophobicContact CD2-CB 4.42Å; F3026-L3035 HydrophobicContact CD2-CD2 4.34Å; F3026-L3035 PolarHBondContact N-O 2.94Å; F3026-L3035 PolarHBondContact O-N 2.84Å; L3035-C3079 HydrophobicContact CD2-CB 4.16Å; L3035-C3079 WeakPolarHBondContact CD2-SG 3.49Å; L3035-I3081 HydrophobicContact CD2-CD1 4.17Å; L3035-I3081 HydrophobicContact CD2-CG1 4.42Å; L3035-S3090 VanDerWaalsContact CD1-O 3.27Å; L3035-S3090 WeakPolarHBondContact CD1-O 3.43Å; L3035-S3090 WeakPolarHBondContact CD1-OG 3.4Å; L3035-W3092 HydrophobicContact CD2-CD2 4.37Å; L3035-W3092 HydrophobicContact CD2-CZ2 3.38Å
3036	N	70.2	Confident	66.8	Low	53 Å²	53	61.9 Å²	61.9	28%	0.283	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	118.5	174.6	178.1	9	0	0	0	109.5	R3023 I3025 M3033	R3023-N3036 PolarHBondContact NH1-ND2 2.99Å; I3025-N3036 HydrophobicContact CG1-CB 4.35Å; M3033-N3036 HydrophobicContact SD-CB 4.15Å
3037	I	69.6	Low	66.9	Low	11 Å²	11	63.3 Å²	63.3	6%	0.056	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	107.5	166.9	-57.5	176.5	0	0	0	107.4	R3023 I3024 L3039 L3065 W3092	R3023-I3037 VanDerWaalsContact CA-O 3.26Å; R3023-I3037 WeakPolarHBondContact CA-O 3.34Å; I3024-I3037 HydrophobicContact CB-CB 4.22Å; I3024-I3037 HydrophobicContact CB-CD1 4.05Å; I3024-I3037 HydrophobicContact CB-CG1 4.39Å; I3024-I3037 HydrophobicContact CG2-CD1 4.43Å; I3024-I3037 PolarHBondContact N-O 3.37Å; I3024-I3037 PolarHBondContact O-N 2.93Å; I3037-L3039 HydrophobicContact CG2-CG 4.42Å; I3037-L3065 HydrophobicContact CD1-CD2 3.39Å; I3037-W3092 HydrophobicContact CD1-CD2 3.72Å; I3037-W3092 HydrophobicContact CD1-CE3 4.35Å; I3037-W3092 HydrophobicContact CD1-CG 4.15Å; I3037-W3092 HydrophobicContact CD1-CH2 4.19Å; I3037-W3092 HydrophobicContact CD1-CZ2 3.56Å; I3037-W3092 HydrophobicContact CG1-CD2 3.95Å; I3037-W3092 HydrophobicContact CG1-CG 3.92Å; I3037-W3092 HydrophobicContact CG1-CZ2 4.01Å
3038	S	68.5	Low	67.2	Low	46 Å²	46	63.8 Å²	63.8	32%	0.322	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	129.2	157	65.2	0	0	0	0	109	E3040	S3038-E3040 PolarHBondContact O-N 3.46Å
3039	L	63.3	Low	67.9	Low	28 Å²	28	64.2 Å²	64.2	15%	0.147	35%	0.345	C	S	.	.			trans	-83.5	36.6	169.4	-76.4	153.7	0	0	0	110.8	P3022 I3037 G3041 M3042 V3046	P3022-L3039 HydrophobicContact CG-CD1 4.06Å; I3037-L3039 HydrophobicContact CG2-CG 4.42Å; L3039-G3041 PolarHBondContact O-N 3.03Å; L3039-M3042 PolarHBondContact O-N 3.2Å; L3039-V3046 HydrophobicContact CD1-CG2 3.18Å
3040	E	57.6	Low	68.5	Low	126 Å²	126	61.5 Å²	61.5	59%	0.589	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	128.8	-178.1	-91.5	174.2	-153.9	0	0	110.9	S3038 M3042	S3038-E3040 PolarHBondContact O-N 3.46Å; E3040-M3042 PolarHBondContact O-N 3.28Å
3041	G	57.7	Low	69	Low	82 Å²	82	57 Å²	57	85%	0.845	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.5	-1.4	174.4	0	0	0	0	0	116.7	L3039	L3039-G3041 PolarHBondContact O-N 3.03Å
3042	M	61.7	Low	69.3	Low	74 Å²	74	56.5 Å²	56.5	37%	0.365	31%	0.305	S	S	.	.			trans	-84.3	-21.3	179.8	-76.3	-79.5	-131.7	0	0	114.2	L3039 E3040 L3044	L3039-M3042 PolarHBondContact O-N 3.2Å; E3040-M3042 PolarHBondContact O-N 3.28Å; M3042-L3044 HydrophobicContact CB-CB 4.23Å; M3042-L3044 HydrophobicContact CB-CD1 4.33Å; M3042-L3044 HydrophobicContact CB-CG 4.43Å; M3042-L3044 VanDerWaalsContact O-CG 3.3Å; M3042-L3044 WeakPolarHBondContact O-CG 3.35Å; M3042-L3044 PolarHBondContact O-N 3.19Å; M3042-L3044 HydrophobicContact SD-CD1 4.27Å
3043	E	64.5	Low	69.6	Low	207 Å²	207	52.8 Å²	52.8	97%	0.967	29%	0.29	S	S	*	.			trans	48.3	21.9	-169.8	-69	-171.2	174.4	0	0	114
3044	L	69.3	Low	69.7	Low	38 Å²	38	50.7 Å²	50.7	20%	0.199	28%	0.281	C	S	.	.			trans	-110.1	134.7	-176.3	-70.8	168.7	0	0	0	110.4	M3042 D3071	M3042-L3044 HydrophobicContact CB-CB 4.23Å; M3042-L3044 HydrophobicContact CB-CD1 4.33Å; M3042-L3044 HydrophobicContact CB-CG 4.43Å; M3042-L3044 VanDerWaalsContact O-CG 3.3Å; M3042-L3044 WeakPolarHBondContact O-CG 3.35Å; M3042-L3044 PolarHBondContact O-N 3.19Å; M3042-L3044 HydrophobicContact SD-CD1 4.27Å; L3044-D3071 WeakPolarHBondContact CD1-OD2 3.18Å; L3044-D3071 HydrophobicContact CD2-CB 3.64Å
3045	Q	72.5	Confident	70.1	Confident	143 Å²	143	52.8 Å²	52.8	67%	0.668	29%	0.29	S	S	*	.			trans	-84.9	134.8	173.9	-67.8	-178.5	-6.4	0	0	110	T3047 T3069 S3070	Q3045-T3047 PolarHBondContact O-N 3.21Å; Q3045-T3069 CarbonylContact O-C 3.57Å; Q3045-T3069 VanDerWaalsContact O-CA 3.31Å; Q3045-T3069 WeakPolarHBondContact O-CA 3.04Å; Q3045-S3070 PolarHBondContact N-OG 3.11Å; Q3045-S3070 VanDerWaalsContact N-OG 3.15Å; Q3045-S3070 PolarHBondContact O-N 3.21Å
3046	V	74.6	Confident	70.1	Confident	38 Å²	38	55 Å²	55	23%	0.23	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	123.2	168.8	-177.8	0	0	0	0	108.3	P3022 L3039 L3067 A3068	P3022-V3046 HydrophobicContact CB-CG2 4.29Å; P3022-V3046 HydrophobicContact CG-CG2 4.25Å; L3039-V3046 HydrophobicContact CD1-CG2 3.18Å; V3046-L3067 HydrophobicContact CG1-CD2 4.2Å; V3046-A3068 WeakPolarHBondContact CA-O 3.33Å
3047	T	78.6	Confident	70.1	Confident	33 Å²	33	56.1 Å²	56.1	20%	0.202	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	-32	-175.8	61.6	0	0	0	0	112.1	Q3045 A3068 Q3103 I3104	Q3045-T3047 PolarHBondContact O-N 3.21Å; T3047-A3068 PolarHBondContact N-O 2.97Å; T3047-A3068 WeakPolarHBondContact OG1-CB 3.47Å; T3047-A3068 PolarHBondContact OG1-O 3.08Å; T3047-Q3103 HydrophobicContact CG2-CG 3.8Å; T3047-I3104 WeakPolarHBondContact CB-O 3.44Å; T3047-I3104 PolarHBondContact OG1-O 3.21Å
3048	A	78.9	Confident	69.8	Low	10 Å²	10	62.9 Å²	62.9	8%	0.083	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	156.3	172.1	0	0	0	0	0	109.4	A3068 I3104 L3107	A3048-A3068 HydrophobicContact CB-CB 4.1Å; A3048-A3068 PolarHBondContact O-N 2.99Å; A3048-I3104 HydrophobicContact CB-CG2 4.23Å; A3048-L3107 HydrophobicContact CB-CB 4.34Å; A3048-L3107 HydrophobicContact CB-CD1 4.14Å; A3048-L3107 HydrophobicContact CB-CG 3.96Å
3049	Y	82.2	Confident	69.7	Low	39 Å²	39	67.5 Å²	67.5	15%	0.153	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	157.5	171.7	68	-87.3	0	0	0	110.3	R2996 T3015 L3065 L3066 L3067	R2996-Y3049 WeakPolarHBondContact CD-OH 3.37Å; T3015-Y3049 HydrophobicContact CG2-CD1 4.27Å; T3015-Y3049 HydrophobicContact CG2-CE1 3.45Å; T3015-Y3049 VanDerWaalsContact CG2-CE1 3.45Å; T3015-Y3049 HydrophobicContact CG2-CE2 4.22Å; T3015-Y3049 VanDerWaalsContact CG2-CZ 3.41Å; T3015-Y3049 VanDerWaalsContact CG2-OH 3.29Å; T3015-Y3049 WeakPolarHBondContact CG2-OH 3.41Å; Y3049-L3065 HydrophobicContact CD2-CD1 4.35Å; Y3049-L3066 CarbonylContact C-O 3.5Å; Y3049-L3066 VanDerWaalsContact CA-O 3.23Å; Y3049-L3066 WeakPolarHBondContact CA-O 3.48Å; Y3049-L3067 VanDerWaalsContact CB-CD2 3.44Å
3050	C	78.5	Confident	70.1	Confident	17 Å²	17	68.1 Å²	68.1	12%	0.115	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	148.1	171.6	-163.9	0	0	0	0	110.9	L3066 L3107 T3109	C3050-L3066 PolarHBondContact N-O 2.97Å; C3050-L3066 PolarHBondContact O-N 3Å; C3050-L3107 HydrophobicContact CB-CB 3.76Å; C3050-T3109 HydrophobicContact CB-CG2 4.27Å; C3050-T3109 WeakPolarHBondContact SG-CG2 3.36Å; C3050-T3109 PolarHBondContact SG-N 3.44Å; C3050-T3109 PolarHBondContact SG-OG1 3.06Å
3051	I	74.2	Confident	70.8	Confident	28 Å²	28	62.2 Å²	62.2	14%	0.144	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	117.1	178.1	-60	152.4	0	0	0	108.2	I3013 T3054 L3065	I3013-I3051 HydrophobicContact CD1-CD1 3.06Å; I3013-I3051 HydrophobicContact CD1-CG1 4.24Å; I3013-I3051 HydrophobicContact CG1-CD1 4.49Å; I3051-T3054 HydrophobicContact CG2-CG2 3.67Å; I3051-L3065 HydrophobicContact CG1-CD1 4.09Å
3052	I	70.2	Confident	71.6	Confident	0 Å²	0	59 Å²	59	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	-52.5	-172.3	-74.2	173.5	0	0	0	110.5	Y3064 L3066 L3076 T3109 V3115 I3117 I3131 L3133	I3052-Y3064 PolarHBondContact N-O 2.74Å; I3052-L3066 HydrophobicContact CD1-CB 3.66Å; I3052-L3066 HydrophobicContact CD1-CD1 4.2Å; I3052-L3066 HydrophobicContact CD1-CD2 4.34Å; I3052-L3066 HydrophobicContact CD1-CG 4.29Å; I3052-L3066 HydrophobicContact CG1-CB 4.03Å; I3052-L3076 HydrophobicContact CD1-CD1 3.35Å; I3052-T3109 HydrophobicContact CG1-CG2 4.42Å; I3052-V3115 HydrophobicContact CB-CG1 4.15Å; I3052-V3115 HydrophobicContact CG1-CG1 4.34Å; I3052-V3115 HydrophobicContact CG2-CB 3.85Å; I3052-V3115 HydrophobicContact CG2-CG1 3.35Å; I3052-V3115 HydrophobicContact CG2-CG2 3.56Å; I3052-I3117 HydrophobicContact CD1-CD1 3.89Å; I3052-I3117 HydrophobicContact CG1-CD1 3.72Å; I3052-I3131 HydrophobicContact CD1-CD1 3.79Å; I3052-L3133 HydrophobicContact CG2-CD1 3.77Å; I3052-L3133 HydrophobicContact CG2-CD2 4.2Å; I3052-L3133 HydrophobicContact CG2-CG 4.18Å
3053	S	70	Confident	72.3	Confident	24 Å²	24	55.6 Å²	55.6	17%	0.168	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	146.1	-174.8	-175.5	0	0	0	0	110.1	Y3064	S3053-Y3064 PolarHBondContact O-N 3.49Å
3054	T	70.1	Confident	73.2	Confident	24 Å²	24	46.9 Å²	46.9	15%	0.147	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	122.9	177.5	47.2	0	0	0	0	108.4	L3000 L3002 I3051 I3062 A3063	L3000-T3054 HydrophobicContact CD1-CG2 4.29Å; L3000-T3054 HydrophobicContact CD2-CG2 3.89Å; L3002-T3054 HydrophobicContact CD2-CG2 4.44Å; L3002-T3054 WeakPolarHBondContact CD2-OG1 3.29Å; I3051-T3054 HydrophobicContact CG2-CG2 3.67Å; T3054-I3062 VanDerWaalsContact CA-O 3.31Å; T3054-I3062 WeakPolarHBondContact CA-O 2.76Å; T3054-A3063 HydrophobicContact CG2-CB 4.03Å
3055	H	71.4	Confident	73.9	Confident	78 Å²	78	45.1 Å²	45.1	36%	0.361	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	149.9	178.3	74.8	58.2	0	0	0	111.9	I3062	H3055-I3062 VanDerWaalsContact CE1-CD1 3.47Å; H3055-I3062 WeakPolarHBondContact CE1-CD1 3.08Å; H3055-I3062 PolarHBondContact N-O 2.69Å; H3055-I3062 PolarHBondContact O-N 3.03Å
3056	F	68.4	Low	74.5	Confident	57 Å²	57	38.4 Å²	38.4	25%	0.25	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	122.9	171.3	-90.7	-74.8	0	0	0	110.5	L3002 K3009 T3060 L3061 V3083	L3002-F3056 HydrophobicContact CB-CD2 4.21Å; L3002-F3056 HydrophobicContact CB-CE2 3.69Å; L3002-F3056 HydrophobicContact CD1-CD2 4.25Å; L3002-F3056 HydrophobicContact CD1-CE2 3.51Å; L3002-F3056 HydrophobicContact CD1-CZ 4.09Å; L3002-F3056 HydrophobicContact CG-CE2 4.28Å; K3009-F3056 HydrophobicContact CB-CE2 4.4Å; K3009-F3056 HydrophobicContact CB-CZ 4.46Å; K3009-F3056 HydrophobicContact CD-CE1 4.32Å; K3009-F3056 HydrophobicContact CD-CE2 4.14Å; K3009-F3056 HydrophobicContact CD-CZ 3.57Å; F3056-T3060 WeakPolarHBondContact CA-O 3.33Å; F3056-L3061 HydrophobicContact CD1-CB 4.37Å; F3056-L3061 HydrophobicContact CD2-CD1 4.49Å; F3056-L3061 HydrophobicContact CE1-CB 3.97Å; F3056-L3061 HydrophobicContact CE2-CD1 4.37Å; F3056-L3061 HydrophobicContact CZ-CB 4.23Å; F3056-L3061 HydrophobicContact CZ-CD1 4.48Å; F3056-V3083 HydrophobicContact CE1-CB 4.31Å; F3056-V3083 HydrophobicContact CE1-CG2 3.63Å; F3056-V3083 HydrophobicContact CZ-CG2 4.07Å
3057	D	70.6	Confident	75	Confident	76 Å²	76	36.6 Å²	36.6	41%	0.406	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	107.4	167.5	-175.7	6.4	0	0	0	109.5	K3059 T3060	D3057-K3059 PolarHBondContact O-N 3.38Å; D3057-T3060 PolarHBondContact N-O 2.73Å; D3057-T3060 PolarHBondContact O-N 3.35Å; D3057-T3060 PolarHBondContact O-OG1 3.47Å
3058	N	63.4	Low	75.4	Confident	152 Å²	152	35.1 Å²	35.1	81%	0.813	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	44.7	40	171.9	-67.8	-52.5	0	0	0	115.8
3059	K	66.9	Low	75.6	Confident	143 Å²	143	34.8 Å²	34.8	62%	0.622	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	96.6	-14.3	-177.9	-57	173.1	179.8	-176.3	0	116.5	D3057 V3083	D3057-K3059 PolarHBondContact O-N 3.38Å; K3059-V3083 PolarHBondContact O-N 3.38Å
3060	T	70.1	Confident	75.6	Confident	42 Å²	42	34.9 Å²	34.9	26%	0.258	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	126.4	171.7	62.4	0	0	0	0	110.4	F3056 D3057 I3081 D3082	F3056-T3060 WeakPolarHBondContact CA-O 3.33Å; D3057-T3060 PolarHBondContact N-O 2.73Å; D3057-T3060 PolarHBondContact O-N 3.35Å; D3057-T3060 PolarHBondContact O-OG1 3.47Å; T3060-I3081 CarbonylContact C-O 3.55Å; T3060-I3081 VanDerWaalsContact CA-O 3.3Å; T3060-I3081 WeakPolarHBondContact CA-O 3.43Å; T3060-D3082 HydrophobicContact CG2-CB 4.32Å
3061	L	72.1	Confident	75.9	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	117.7	169.8	171.4	61.4	0	0	0	108.6	L3002 L3011 F3056 I3081 V3083	L3002-L3061 HydrophobicContact CD1-CD1 3.31Å; L3002-L3061 HydrophobicContact CD1-CD2 3.56Å; L3002-L3061 HydrophobicContact CD1-CG 4.05Å; L3002-L3061 HydrophobicContact CD2-CD1 4.5Å; L3011-L3061 HydrophobicContact CD1-CD2 3.45Å; L3011-L3061 VanDerWaalsContact CD1-CD2 3.45Å; F3056-L3061 HydrophobicContact CD1-CB 4.37Å; F3056-L3061 HydrophobicContact CD2-CD1 4.49Å; F3056-L3061 HydrophobicContact CE1-CB 3.97Å; F3056-L3061 HydrophobicContact CE2-CD1 4.37Å; F3056-L3061 HydrophobicContact CZ-CB 4.23Å; F3056-L3061 HydrophobicContact CZ-CD1 4.48Å; L3061-I3081 HydrophobicContact CB-CB 4.28Å; L3061-I3081 HydrophobicContact CD2-CD1 4.34Å; L3061-I3081 PolarHBondContact N-O 3.22Å; L3061-I3081 PolarHBondContact O-N 3.27Å; L3061-V3083 HydrophobicContact CB-CG2 3.86Å
3062	I	76.2	Confident	76.4	Confident	16 Å²	16	36.4 Å²	36.4	8%	0.082	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	125	170.8	-53.3	-166.2	0	0	0	108.4	T3054 H3055 Y3064 K3078 C3079	T3054-I3062 VanDerWaalsContact CA-O 3.31Å; T3054-I3062 WeakPolarHBondContact CA-O 2.76Å; H3055-I3062 VanDerWaalsContact CE1-CD1 3.47Å; H3055-I3062 WeakPolarHBondContact CE1-CD1 3.08Å; H3055-I3062 PolarHBondContact N-O 2.69Å; H3055-I3062 PolarHBondContact O-N 3.03Å; I3062-Y3064 HydrophobicContact CG2-CD2 4.22Å; I3062-Y3064 HydrophobicContact CG2-CE2 3.58Å; I3062-K3078 HydrophobicContact CG2-CD 4.45Å; I3062-K3078 HydrophobicContact CG2-CG 4.08Å; I3062-C3079 WeakPolarHBondContact CA-O 3.19Å
3063	A	76.6	Confident	77.1	Confident	2 Å²	2	39.9 Å²	39.9	2%	0.017	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	133	177.7	0	0	0	0	0	110.8	T3054 C3079 W3092	T3054-A3063 HydrophobicContact CG2-CB 4.03Å; A3063-C3079 PolarHBondContact N-O 3.36Å; A3063-C3079 PolarHBondContact O-N 3.19Å; A3063-W3092 HydrophobicContact CB-CH2 4.47Å
3064	Y	82.3	Confident	77.8	Confident	23 Å²	23	38.9 Å²	38.9	9%	0.09	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	119.2	174	-67.6	-90.8	0	0	0	110	I3052 S3053 I3062 L3076 F3077 K3078 I3095 L3133	I3052-Y3064 PolarHBondContact N-O 2.74Å; S3053-Y3064 PolarHBondContact O-N 3.49Å; I3062-Y3064 HydrophobicContact CG2-CD2 4.22Å; I3062-Y3064 HydrophobicContact CG2-CE2 3.58Å; Y3064-L3076 HydrophobicContact CD1-CD1 4.48Å; Y3064-F3077 WeakPolarHBondContact CA-O 3.25Å; Y3064-K3078 HydrophobicContact CD1-CB 4.42Å; Y3064-K3078 HydrophobicContact CD1-CG 4.3Å; Y3064-K3078 HydrophobicContact CE1-CB 4.28Å; Y3064-K3078 HydrophobicContact CE1-CD 3.95Å; Y3064-K3078 HydrophobicContact CE1-CG 3.88Å; Y3064-K3078 WeakPolarHBondContact OH-CE 3.23Å; Y3064-I3095 HydrophobicContact CD1-CD1 3.76Å; Y3064-I3095 HydrophobicContact CE1-CD1 3.59Å; Y3064-L3133 HydrophobicContact CD1-CD2 3.52Å; Y3064-L3133 HydrophobicContact CD2-CD1 4.14Å; Y3064-L3133 HydrophobicContact CD2-CD2 4.47Å; Y3064-L3133 HydrophobicContact CE1-CD2 3.75Å; Y3064-L3133 HydrophobicContact CE2-CD1 4.39Å; Y3064-L3133 HydrophobicContact CG-CD1 4.26Å; Y3064-L3133 HydrophobicContact CG-CD2 3.9Å
3065	L	83.4	Confident	78.6	Confident	2 Å²	2	38.6 Å²	38.6	1%	0.01	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	130.8	-178.5	-179.5	68.3	0	0	0	110	I3024 I3037 Y3049 I3051 L3067 F3077 W3092	I3024-L3065 HydrophobicContact CD1-CD2 3.94Å; I3037-L3065 HydrophobicContact CD1-CD2 3.39Å; Y3049-L3065 HydrophobicContact CD2-CD1 4.35Å; I3051-L3065 HydrophobicContact CG1-CD1 4.09Å; L3065-L3067 HydrophobicContact CD1-CD2 4.38Å; L3065-L3067 HydrophobicContact CD2-CD1 4.24Å; L3065-L3067 HydrophobicContact CD2-CD2 3.92Å; L3065-L3067 HydrophobicContact CD2-CG 4.08Å; L3065-L3067 HydrophobicContact CG-CD2 4.02Å; L3065-L3067 HydrophobicContact CG-CG 4.15Å; L3065-F3077 HydrophobicContact CB-CB 4.47Å; L3065-F3077 PolarHBondContact N-O 2.81Å; L3065-F3077 PolarHBondContact O-N 3.46Å; L3065-W3092 HydrophobicContact CB-CH2 4Å; L3065-W3092 HydrophobicContact CB-CZ3 3.73Å; L3065-W3092 HydrophobicContact CD2-CH2 4.25Å; L3065-W3092 HydrophobicContact CD2-CZ3 4.4Å
3066	L	86	Confident	79.3	Confident	1 Å²	1	35.1 Å²	35.1	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	126	171.3	-163.8	65.5	0	0	0	110	Y3049 C3050 I3052 L3074 L3076 L3107 I3117 I3131	Y3049-L3066 CarbonylContact C-O 3.5Å; Y3049-L3066 VanDerWaalsContact CA-O 3.23Å; Y3049-L3066 WeakPolarHBondContact CA-O 3.48Å; C3050-L3066 PolarHBondContact N-O 2.97Å; C3050-L3066 PolarHBondContact O-N 3Å; I3052-L3066 HydrophobicContact CD1-CB 3.66Å; I3052-L3066 HydrophobicContact CD1-CD1 4.2Å; I3052-L3066 HydrophobicContact CD1-CD2 4.34Å; I3052-L3066 HydrophobicContact CD1-CG 4.29Å; I3052-L3066 HydrophobicContact CG1-CB 4.03Å; L3066-L3074 HydrophobicContact CD1-CB 4.24Å; L3066-L3074 HydrophobicContact CD1-CD2 4.37Å; L3066-L3074 HydrophobicContact CD2-CD1 4.5Å; L3066-L3074 HydrophobicContact CD2-CD2 3.87Å; L3066-L3074 HydrophobicContact CG-CD2 3.91Å; L3066-L3076 HydrophobicContact CD1-CB 4.21Å; L3066-L3076 HydrophobicContact CD1-CD1 4.42Å; L3066-L3107 HydrophobicContact CD2-CD1 4.24Å; L3066-L3107 HydrophobicContact CD2-CD2 4.39Å; L3066-L3107 HydrophobicContact CG-CD1 4.35Å; L3066-I3117 HydrophobicContact CD2-CD1 3.4Å; L3066-I3117 HydrophobicContact CD2-CG2 4.23Å; L3066-I3131 HydrophobicContact CD1-CD1 4.26Å; L3066-I3131 HydrophobicContact CD2-CD1 4.17Å
3067	L	84.7	Confident	79.9	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.005	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	125.5	177.2	-63.5	-178.5	0	0	0	110.4	I3024 V3046 Y3049 L3065 L3074 R3075 F3077	I3024-L3067 HydrophobicContact CD1-CD1 4.46Å; I3024-L3067 HydrophobicContact CD1-CD2 3.55Å; V3046-L3067 HydrophobicContact CG1-CD2 4.2Å; Y3049-L3067 VanDerWaalsContact CB-CD2 3.44Å; L3065-L3067 HydrophobicContact CD1-CD2 4.38Å; L3065-L3067 HydrophobicContact CD2-CD1 4.24Å; L3065-L3067 HydrophobicContact CD2-CD2 3.92Å; L3065-L3067 HydrophobicContact CD2-CG 4.08Å; L3065-L3067 HydrophobicContact CG-CD2 4.02Å; L3065-L3067 HydrophobicContact CG-CG 4.15Å; L3067-L3074 CarbonylContact O-C 3.6Å; L3067-L3074 WeakPolarHBondContact O-CA 3.36Å; L3067-R3075 PolarHBondContact N-O 3.47Å; L3067-R3075 PolarHBondContact O-N 3.2Å; L3067-F3077 HydrophobicContact CB-CE2 4.36Å; L3067-F3077 HydrophobicContact CD1-CD2 3.89Å; L3067-F3077 HydrophobicContact CD1-CE2 3.67Å; L3067-F3077 HydrophobicContact CG-CD2 4.18Å; L3067-F3077 HydrophobicContact CG-CE2 4.23Å
3068	A	86.3	Confident	80.4	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.008	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	138.8	162.8	0	0	0	0	0	109.6	V3046 T3047 A3048 L3074 I3104 L3107	V3046-A3068 WeakPolarHBondContact CA-O 3.33Å; T3047-A3068 PolarHBondContact N-O 2.97Å; T3047-A3068 WeakPolarHBondContact OG1-CB 3.47Å; T3047-A3068 PolarHBondContact OG1-O 3.08Å; A3048-A3068 HydrophobicContact CB-CB 4.1Å; A3048-A3068 PolarHBondContact O-N 2.99Å; A3068-L3074 HydrophobicContact CB-CD2 3.95Å; A3068-I3104 HydrophobicContact CB-CB 3.84Å; A3068-I3104 HydrophobicContact CB-CD1 4.3Å; A3068-I3104 HydrophobicContact CB-CG2 4.13Å; A3068-L3107 HydrophobicContact CB-CD1 4.01Å
3069	T	84.6	Confident	81	Confident	3 Å²	3	25.5 Å²	25.5	2%	0.018	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	160.9	-173.4	45.4	0	0	0	0	111.1	Q3045 D3071 S3072 F3073 R3075	Q3045-T3069 CarbonylContact O-C 3.57Å; Q3045-T3069 VanDerWaalsContact O-CA 3.31Å; Q3045-T3069 WeakPolarHBondContact O-CA 3.04Å; T3069-D3071 WeakPolarHBondContact CB-OD1 3.42Å; T3069-D3071 PolarHBondContact O-N 3.39Å; T3069-D3071 PolarHBondContact OG1-OD1 3.21Å; T3069-S3072 PolarHBondContact O-N 3.22Å; T3069-F3073 PolarHBondContact N-O 2.89Å; T3069-F3073 PolarHBondContact OG1-O 3.43Å; T3069-F3073 VanDerWaalsContact OG1-O 3.11Å; T3069-R3075 PolarHBondContact OG1-NH1 3.08Å
3070	S	81.1	Confident	81.4	Confident	42 Å²	42	21.4 Å²	21.4	29%	0.294	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-17.5	-175.7	53.3	0	0	0	0	115.3	Q3045 S3072	Q3045-S3070 PolarHBondContact N-OG 3.11Å; Q3045-S3070 VanDerWaalsContact N-OG 3.15Å; Q3045-S3070 PolarHBondContact O-N 3.21Å; S3070-S3072 VanDerWaalsContact C-N 3.29Å; S3070-S3072 PolarHBondContact O-N 3.36Å
3071	D	84.7	Confident	81.2	Confident	50 Å²	50	19.5 Å²	19.5	27%	0.267	10%	0.104	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	9.2	174.6	62.2	-14.8	0	0	0	114.3	L3044 T3069 F3073 R3075	L3044-D3071 WeakPolarHBondContact CD1-OD2 3.18Å; L3044-D3071 HydrophobicContact CD2-CB 3.64Å; T3069-D3071 WeakPolarHBondContact CB-OD1 3.42Å; T3069-D3071 PolarHBondContact O-N 3.39Å; T3069-D3071 PolarHBondContact OG1-OD1 3.21Å; D3071-F3073 HydrophobicContact CB-CD2 4.13Å; D3071-F3073 VanDerWaalsContact O-CD2 3.31Å; D3071-F3073 WeakPolarHBondContact O-CD2 3.45Å; D3071-F3073 WeakPolarHBondContact OD2-CD2 3.41Å; D3071-R3075 IonicContact OD1-CZ 3.44Å; D3071-R3075 IonicContact OD1-NH1 3.04Å; D3071-R3075 PolarHBondContact OD1-NH1 2.9Å; D3071-R3075 IonicContact OD1-NH2 3.96Å; D3071-R3075 IonicContact OD2-CZ 3.79Å; D3071-R3075 IonicContact OD2-NH1 2.71Å; D3071-R3075 PolarHBondContact OD2-NH1 3.48Å; D3071-R3075 VanDerWaalsContact OD2-NH1 3.1Å; D3071-R3075 IonicContact OD2-NH2 3.78Å; D3071-R3075 PolarHBondContact OD2-NH2 3.21Å
3072	S	85.2	Confident	80.9	Confident	26 Å²	26	22.5 Å²	22.5	18%	0.182	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.7	43.5	178	-49.1	0	0	0	0	113.8	T3069 S3070 T3100 E3102 Q3103	T3069-S3072 PolarHBondContact O-N 3.22Å; S3070-S3072 VanDerWaalsContact C-N 3.29Å; S3070-S3072 PolarHBondContact O-N 3.36Å; S3072-T3100 VanDerWaalsContact C-OG1 3.27Å; S3072-T3100 PolarHBondContact O-N 3.28Å; S3072-T3100 PolarHBondContact O-OG1 2.58Å; S3072-E3102 VanDerWaalsContact CB-C 3.46Å; S3072-E3102 WeakPolarHBondContact CB-O 3.23Å; S3072-Q3103 PolarHBondContact OG-N 3.49Å
3073	F	84.6	Confident	80.2	Confident	73 Å²	73	23.5 Å²	23.5	32%	0.32	13%	0.127	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	145.9	174	-76.9	-82.5	0	0	0	111.5	T3069 D3071 I3097 Y3098 P3099	T3069-F3073 PolarHBondContact N-O 2.89Å; T3069-F3073 PolarHBondContact OG1-O 3.43Å; T3069-F3073 VanDerWaalsContact OG1-O 3.11Å; D3071-F3073 HydrophobicContact CB-CD2 4.13Å; D3071-F3073 VanDerWaalsContact O-CD2 3.31Å; D3071-F3073 WeakPolarHBondContact O-CD2 3.45Å; D3071-F3073 WeakPolarHBondContact OD2-CD2 3.41Å; F3073-I3097 HydrophobicContact CB-CG2 3.94Å; F3073-I3097 HydrophobicContact CD1-CG2 3.39Å; F3073-I3097 HydrophobicContact CE1-CG2 4.12Å; F3073-I3097 HydrophobicContact CG-CG2 3.93Å; F3073-Y3098 WeakPolarHBondContact CA-O 3.2Å; F3073-P3099 VanDerWaalsContact CD1-CA 3.49Å; F3073-P3099 HydrophobicContact CD1-CB 3.97Å; F3073-P3099 HydrophobicContact CE1-CB 3.6Å; F3073-P3099 HydrophobicContact CE1-CG 4.41Å; F3073-P3099 HydrophobicContact CZ-CB 4.36Å
3074	L	85	Confident	79.5	Confident	4 Å²	4	26.5 Å²	26.5	2%	0.021	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	119.4	167.4	-77.4	171.6	0	0	0	109.6	L3066 L3067 A3068 I3097 Y3098 T3100 I3104 L3107 Y3129	L3066-L3074 HydrophobicContact CD1-CB 4.24Å; L3066-L3074 HydrophobicContact CD1-CD2 4.37Å; L3066-L3074 HydrophobicContact CD2-CD1 4.5Å; L3066-L3074 HydrophobicContact CD2-CD2 3.87Å; L3066-L3074 HydrophobicContact CG-CD2 3.91Å; L3067-L3074 CarbonylContact O-C 3.6Å; L3067-L3074 WeakPolarHBondContact O-CA 3.36Å; A3068-L3074 HydrophobicContact CB-CD2 3.95Å; L3074-I3097 CarbonylContact O-C 3.57Å; L3074-I3097 VanDerWaalsContact O-CA 3.31Å; L3074-I3097 WeakPolarHBondContact O-CA 3.46Å; L3074-Y3098 HydrophobicContact CB-CD2 4.48Å; L3074-Y3098 PolarHBondContact N-O 3.28Å; L3074-Y3098 PolarHBondContact O-N 2.56Å; L3074-T3100 HydrophobicContact CB-CG2 4.4Å; L3074-T3100 HydrophobicContact CD1-CG2 3.65Å; L3074-T3100 HydrophobicContact CG-CG2 3.71Å; L3074-I3104 HydrophobicContact CD1-CD1 3.76Å; L3074-I3104 HydrophobicContact CD2-CD1 3.56Å; L3074-I3104 HydrophobicContact CG-CD1 3.57Å; L3074-L3107 HydrophobicContact CD2-CD1 3.93Å; L3074-L3107 HydrophobicContact CD2-CD2 4.04Å; L3074-Y3129 HydrophobicContact CD1-CE2 4.42Å
3075	R	86.4	Confident	78.1	Confident	18 Å²	18	30 Å²	30	7%	0.068	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	120	-179.6	-64.4	174.5	165.6	75.6	-3.4	109.5	L3067 T3069 D3071 F3077 I3097	L3067-R3075 PolarHBondContact N-O 3.47Å; L3067-R3075 PolarHBondContact O-N 3.2Å; T3069-R3075 PolarHBondContact OG1-NH1 3.08Å; D3071-R3075 IonicContact OD1-CZ 3.44Å; D3071-R3075 IonicContact OD1-NH1 3.04Å; D3071-R3075 PolarHBondContact OD1-NH1 2.9Å; D3071-R3075 IonicContact OD1-NH2 3.96Å; D3071-R3075 IonicContact OD2-CZ 3.79Å; D3071-R3075 IonicContact OD2-NH1 2.71Å; D3071-R3075 PolarHBondContact OD2-NH1 3.48Å; D3071-R3075 VanDerWaalsContact OD2-NH1 3.1Å; D3071-R3075 IonicContact OD2-NH2 3.78Å; D3071-R3075 PolarHBondContact OD2-NH2 3.21Å; R3075-F3077 HydrophobicContact CB-CD2 4.16Å; R3075-F3077 HydrophobicContact CB-CE2 3.45Å; R3075-F3077 VanDerWaalsContact CB-CE2 3.45Å; R3075-F3077 HydrophobicContact CB-CZ 4.17Å; R3075-I3097 HydrophobicContact CG-CG1 4.26Å; R3075-I3097 HydrophobicContact CG-CG2 4.23Å
3076	L	86	Confident	76.7	Confident	5 Å²	5	38.5 Å²	38.5	3%	0.026	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	122.1	176.8	178.2	64.8	0	0	0	109.5	I3052 Y3064 L3066 Q3094 I3095 K3096 I3131 L3133	I3052-L3076 HydrophobicContact CD1-CD1 3.35Å; Y3064-L3076 HydrophobicContact CD1-CD1 4.48Å; L3066-L3076 HydrophobicContact CD1-CB 4.21Å; L3066-L3076 HydrophobicContact CD1-CD1 4.42Å; L3076-Q3094 CarbonylContact O-C 3.55Å; L3076-I3095 HydrophobicContact CD2-CB 4.28Å; L3076-I3095 HydrophobicContact CD2-CD1 3.89Å; L3076-I3095 HydrophobicContact CG-CB 4.33Å; L3076-I3095 HydrophobicContact CG-CD1 3.89Å; L3076-I3095 HydrophobicContact CG-CG1 4.33Å; L3076-I3095 PolarHBondContact O-N 3.11Å; L3076-K3096 HydrophobicContact CB-CB 4.39Å; L3076-K3096 PolarHBondContact N-O 3.16Å; L3076-K3096 PolarHBondContact O-N 3.03Å; L3076-I3131 HydrophobicContact CD2-CG2 4.42Å; L3076-L3133 HydrophobicContact CD2-CD2 4.29Å
3077	F	82.5	Confident	74.9	Confident	20 Å²	20	42.2 Å²	42.2	9%	0.088	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	141.6	177.5	-67.8	-92.1	0	0	0	111.1	Y3064 L3065 L3067 R3075 W3092 E3093 Q3094	Y3064-F3077 WeakPolarHBondContact CA-O 3.25Å; L3065-F3077 HydrophobicContact CB-CB 4.47Å; L3065-F3077 PolarHBondContact N-O 2.81Å; L3065-F3077 PolarHBondContact O-N 3.46Å; L3067-F3077 HydrophobicContact CB-CE2 4.36Å; L3067-F3077 HydrophobicContact CD1-CD2 3.89Å; L3067-F3077 HydrophobicContact CD1-CE2 3.67Å; L3067-F3077 HydrophobicContact CG-CD2 4.18Å; L3067-F3077 HydrophobicContact CG-CE2 4.23Å; R3075-F3077 HydrophobicContact CB-CD2 4.16Å; R3075-F3077 HydrophobicContact CB-CE2 3.45Å; R3075-F3077 VanDerWaalsContact CB-CE2 3.45Å; R3075-F3077 HydrophobicContact CB-CZ 4.17Å; F3077-W3092 HydrophobicContact CB-CE3 3.61Å; F3077-W3092 HydrophobicContact CB-CZ3 4.14Å; F3077-W3092 HydrophobicContact CD1-CB 4.23Å; F3077-E3093 CarbonylContact C-O 3.52Å; F3077-E3093 WeakPolarHBondContact CA-O 3.27Å; F3077-Q3094 HydrophobicContact CD1-CB 3.74Å; F3077-Q3094 HydrophobicContact CD1-CG 4.08Å; F3077-Q3094 HydrophobicContact CE1-CB 3.49Å; F3077-Q3094 VanDerWaalsContact CE1-CB 3.49Å; F3077-Q3094 HydrophobicContact CE1-CG 3.7Å; F3077-Q3094 HydrophobicContact CE2-CG 4.32Å; F3077-Q3094 HydrophobicContact CZ-CB 4.14Å; F3077-Q3094 HydrophobicContact CZ-CG 3.83Å
3078	K	80.8	Confident	73.4	Confident	61 Å²	61	50 Å²	50	27%	0.265	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	137.4	170.6	-166.5	176.5	177.9	-178.1	0	109.6	I3062 Y3064 E3093 I3095	I3062-K3078 HydrophobicContact CG2-CD 4.45Å; I3062-K3078 HydrophobicContact CG2-CG 4.08Å; Y3064-K3078 HydrophobicContact CD1-CB 4.42Å; Y3064-K3078 HydrophobicContact CD1-CG 4.3Å; Y3064-K3078 HydrophobicContact CE1-CB 4.28Å; Y3064-K3078 HydrophobicContact CE1-CD 3.95Å; Y3064-K3078 HydrophobicContact CE1-CG 3.88Å; Y3064-K3078 WeakPolarHBondContact OH-CE 3.23Å; K3078-E3093 PolarHBondContact N-O 2.87Å; K3078-E3093 PolarHBondContact O-N 2.93Å; K3078-I3095 HydrophobicContact CB-CD1 3.58Å; K3078-I3095 HydrophobicContact CB-CG1 3.74Å; K3078-I3095 HydrophobicContact CD-CD1 4.35Å; K3078-I3095 HydrophobicContact CG-CD1 4.37Å
3079	C	75.3	Confident	71.9	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.007	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	143.1	163.3	-169.3	0	0	0	0	110.2	L3035 I3062 A3063 I3081 W3092	L3035-C3079 HydrophobicContact CD2-CB 4.16Å; L3035-C3079 WeakPolarHBondContact CD2-SG 3.49Å; I3062-C3079 WeakPolarHBondContact CA-O 3.19Å; A3063-C3079 PolarHBondContact N-O 3.36Å; A3063-C3079 PolarHBondContact O-N 3.19Å; C3079-I3081 VanDerWaalsContact SG-CG1 3.57Å; C3079-W3092 HydrophobicContact CB-CD2 3.69Å; C3079-W3092 HydrophobicContact CB-CE3 3.51Å; C3079-W3092 HydrophobicContact CB-CG 4.46Å; C3079-W3092 HydrophobicContact CB-CH2 3.7Å; C3079-W3092 HydrophobicContact CB-CZ2 3.81Å; C3079-W3092 HydrophobicContact CB-CZ3 3.53Å
3080	S	74.5	Confident	70.6	Confident	57 Å²	57	56.4 Å²	56.4	40%	0.399	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	114.2	168.2	-52.6	0	0	0	0	107.8	S3090	S3080-S3090 VanDerWaalsContact O-CB 3.26Å; S3080-S3090 WeakPolarHBondContact O-CB 3.44Å
3081	I	66.7	Low	69.8	Low	3 Å²	3	63.4 Å²	63.4	2%	0.015	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	115	-174.8	-55.1	172.1	0	0	0	107.5	L3034 L3035 T3060 L3061 C3079 V3083	L3034-I3081 HydrophobicContact CD1-CG2 4.45Å; L3035-I3081 HydrophobicContact CD2-CD1 4.17Å; L3035-I3081 HydrophobicContact CD2-CG1 4.42Å; T3060-I3081 CarbonylContact C-O 3.55Å; T3060-I3081 VanDerWaalsContact CA-O 3.3Å; T3060-I3081 WeakPolarHBondContact CA-O 3.43Å; L3061-I3081 HydrophobicContact CB-CB 4.28Å; L3061-I3081 HydrophobicContact CD2-CD1 4.34Å; L3061-I3081 PolarHBondContact N-O 3.22Å; L3061-I3081 PolarHBondContact O-N 3.27Å; C3079-I3081 VanDerWaalsContact SG-CG1 3.57Å; I3081-V3083 PolarHBondContact O-N 2.98Å
3082	D	66.1	Low	69.2	Low	64 Å²	64	63.1 Å²	63.1	34%	0.342	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	112.1	169.3	-157.3	-31.1	0	0	0	108.7	T3060 S3084 D3085	T3060-D3082 HydrophobicContact CG2-CB 4.32Å; D3082-S3084 PolarHBondContact O-N 3.19Å; D3082-S3084 WeakPolarHBondContact OD1-CB 3.01Å; D3082-S3084 PolarHBondContact OD1-N 3.3Å; D3082-S3084 VanDerWaalsContact OD1-N 3.14Å; D3082-S3084 PolarHBondContact OD1-OG 3.3Å; D3082-D3085 HydrophobicContact CB-CB 4.49Å
3083	V	62.3	Low	68.8	Low	36 Å²	36	68.4 Å²	68.4	22%	0.218	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-8.2	-176.4	-172.7	0	0	0	0	111.2	K3009 F3056 K3059 L3061 I3081	K3009-V3083 HydrophobicContact CD-CG1 4.3Å; K3009-V3083 VanDerWaalsContact NZ-CG1 3.3Å; F3056-V3083 HydrophobicContact CE1-CB 4.31Å; F3056-V3083 HydrophobicContact CE1-CG2 3.63Å; F3056-V3083 HydrophobicContact CZ-CG2 4.07Å; K3059-V3083 PolarHBondContact O-N 3.38Å; L3061-V3083 HydrophobicContact CB-CG2 3.86Å; I3081-V3083 PolarHBondContact O-N 2.98Å
3084	S	61.1	Low	68.7	Low	65 Å²	65	68.4 Å²	68.4	46%	0.455	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-34.9	176.7	-27.8	0	0	0	0	113.2	D3082	D3082-S3084 PolarHBondContact O-N 3.19Å; D3082-S3084 WeakPolarHBondContact OD1-CB 3.01Å; D3082-S3084 PolarHBondContact OD1-N 3.3Å; D3082-S3084 VanDerWaalsContact OD1-N 3.14Å; D3082-S3084 PolarHBondContact OD1-OG 3.3Å
3085	D	53.2	Low	68.6	Low	97 Å²	97	71.5 Å²	71.5	52%	0.519	37%	0.374	S	S	.	.			trans	-100.6	118.7	-166.6	-81	-12.9	0	0	0	109.8	D3082 S3087	D3082-D3085 HydrophobicContact CB-CB 4.49Å; D3085-S3087 PolarHBondContact O-N 3.2Å; D3085-S3087 VanDerWaalsContact O-N 3.1Å
3086	E	52.6	Low	68.4	Low	181 Å²	181	75.3 Å²	75.3	85%	0.846	39%	0.391	S	S	*	.			trans	-68.3	3.2	169.2	-66.3	-177.4	166.4	0	0	112.5	E3088	E3086-E3088 PolarHBondContact O-N 3.38Å
3087	S	49.9	Very low	68.4	Low	78 Å²	78	78.6 Å²	78.6	55%	0.545	41%	0.408	S	S	.	.			trans	-85.1	110.6	-176.9	62.8	0	0	0	0	112.7	D3085 S3089	D3085-S3087 PolarHBondContact O-N 3.2Å; D3085-S3087 VanDerWaalsContact O-N 3.1Å; S3087-S3089 PolarHBondContact O-N 3.35Å
3088	E	53.1	Low	68.4	Low	164 Å²	164	81.2 Å²	81.2	77%	0.766	42%	0.418	S	S	*	.			trans	-52.7	93.3	171.3	-61.9	178.2	155	0	0	113	E3086	E3086-E3088 PolarHBondContact O-N 3.38Å
3089	S	53.5	Low	68.4	Low	101 Å²	101	82.8 Å²	82.8	71%	0.706	43%	0.434	S	S	*	.			trans	-164	22.3	161.7	60.3	0	0	0	0	117.1	S3087 K3091	S3087-S3089 PolarHBondContact O-N 3.35Å; S3089-K3091 PolarHBondContact O-N 3.02Å
3090	S	57	Low	68.6	Low	38 Å²	38	83.7 Å²	83.7	27%	0.266	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-75.3	116.4	169.6	28	0	0	0	0	109.9	L3035 S3080	L3035-S3090 VanDerWaalsContact CD1-O 3.27Å; L3035-S3090 WeakPolarHBondContact CD1-O 3.43Å; L3035-S3090 WeakPolarHBondContact CD1-OG 3.4Å; S3080-S3090 VanDerWaalsContact O-CB 3.26Å; S3080-S3090 WeakPolarHBondContact O-CB 3.44Å
3091	K	65.8	Low	68.7	Low	189 Å²	189	84.6 Å²	84.6	82%	0.822	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-93.6	140.5	173.5	-73.6	-173.2	177.3	-176.1	0	109.9	S3089	S3089-K3091 PolarHBondContact O-N 3.02Å
3092	W	71.5	Confident	69.4	Low	44 Å²	44	87.1 Å²	87.1	17%	0.167	47%	0.47	C	S	.	.	P	Polyproline II helix	trans	-70.8	131.5	169.5	-70.5	85.1	0	0	0	110.5	F3026 L3035 I3037 A3063 L3065 F3077 C3079	F3026-W3092 HydrophobicContact CD2-CZ2 4.03Å; F3026-W3092 AromaticContact CE2-CH2 3.87Å; F3026-W3092 HydrophobicContact CE2-CH2 3.87Å; F3026-W3092 AromaticContact CE2-CZ2 3.46Å; F3026-W3092 HydrophobicContact CE2-CZ2 3.46Å; F3026-W3092 VanDerWaalsContact CE2-CZ2 3.46Å; F3026-W3092 HydrophobicContact CZ-CH2 4.03Å; F3026-W3092 HydrophobicContact CZ-CZ2 4.07Å; L3035-W3092 HydrophobicContact CD2-CD2 4.37Å; L3035-W3092 HydrophobicContact CD2-CZ2 3.38Å; I3037-W3092 HydrophobicContact CD1-CD2 3.72Å; I3037-W3092 HydrophobicContact CD1-CE3 4.35Å; I3037-W3092 HydrophobicContact CD1-CG 4.15Å; I3037-W3092 HydrophobicContact CD1-CH2 4.19Å; I3037-W3092 HydrophobicContact CD1-CZ2 3.56Å; I3037-W3092 HydrophobicContact CG1-CD2 3.95Å; I3037-W3092 HydrophobicContact CG1-CG 3.92Å; I3037-W3092 HydrophobicContact CG1-CZ2 4.01Å; A3063-W3092 HydrophobicContact CB-CH2 4.47Å; L3065-W3092 HydrophobicContact CB-CH2 4Å; L3065-W3092 HydrophobicContact CB-CZ3 3.73Å; L3065-W3092 HydrophobicContact CD2-CH2 4.25Å; L3065-W3092 HydrophobicContact CD2-CZ3 4.4Å; F3077-W3092 HydrophobicContact CB-CE3 3.61Å; F3077-W3092 HydrophobicContact CB-CZ3 4.14Å; F3077-W3092 HydrophobicContact CD1-CB 4.23Å; C3079-W3092 HydrophobicContact CB-CD2 3.69Å; C3079-W3092 HydrophobicContact CB-CE3 3.51Å; C3079-W3092 HydrophobicContact CB-CG 4.46Å; C3079-W3092 HydrophobicContact CB-CH2 3.7Å; C3079-W3092 HydrophobicContact CB-CZ2 3.81Å; C3079-W3092 HydrophobicContact CB-CZ3 3.53Å
3093	E	76.9	Confident	70.1	Confident	138 Å²	138	85.8 Å²	85.8	65%	0.645	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.2	119	172.7	-171.2	179.1	-179.9	0	0	108.8	F3077 K3078 I3095	F3077-E3093 CarbonylContact C-O 3.52Å; F3077-E3093 WeakPolarHBondContact CA-O 3.27Å; K3078-E3093 PolarHBondContact N-O 2.87Å; K3078-E3093 PolarHBondContact O-N 2.93Å; E3093-I3095 PolarHBondContact O-N 2.91Å
3094	Q	81.8	Confident	71.2	Confident	72 Å²	72	84.1 Å²	84.1	34%	0.336	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	108.5	172.7	-166.7	-171.1	-101.5	0	0	109	L3076 F3077 I3097	L3076-Q3094 CarbonylContact O-C 3.55Å; F3077-Q3094 HydrophobicContact CD1-CB 3.74Å; F3077-Q3094 HydrophobicContact CD1-CG 4.08Å; F3077-Q3094 HydrophobicContact CE1-CB 3.49Å; F3077-Q3094 VanDerWaalsContact CE1-CB 3.49Å; F3077-Q3094 HydrophobicContact CE1-CG 3.7Å; F3077-Q3094 HydrophobicContact CE2-CG 4.32Å; F3077-Q3094 HydrophobicContact CZ-CB 4.14Å; F3077-Q3094 HydrophobicContact CZ-CG 3.83Å; Q3094-I3097 VanDerWaalsContact NE2-CD1 3.28Å; Q3094-I3097 VanDerWaalsContact NE2-CG1 3.32Å
3095	I	83.3	Confident	72.2	Confident	69 Å²	69	84.4 Å²	84.4	35%	0.354	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	-49.4	-175.4	-40.6	176.8	0	0	0	110.7	Y3064 L3076 K3078 E3093	Y3064-I3095 HydrophobicContact CD1-CD1 3.76Å; Y3064-I3095 HydrophobicContact CE1-CD1 3.59Å; L3076-I3095 HydrophobicContact CD2-CB 4.28Å; L3076-I3095 HydrophobicContact CD2-CD1 3.89Å; L3076-I3095 HydrophobicContact CG-CB 4.33Å; L3076-I3095 HydrophobicContact CG-CD1 3.89Å; L3076-I3095 HydrophobicContact CG-CG1 4.33Å; L3076-I3095 PolarHBondContact O-N 3.11Å; K3078-I3095 HydrophobicContact CB-CD1 3.58Å; K3078-I3095 HydrophobicContact CB-CG1 3.74Å; K3078-I3095 HydrophobicContact CD-CD1 4.35Å; K3078-I3095 HydrophobicContact CG-CD1 4.37Å; E3093-I3095 PolarHBondContact O-N 2.91Å
3096	K	83.3	Confident	73.6	Confident	98 Å²	98	82.5 Å²	82.5	43%	0.426	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	153.6	-170.8	-73.1	-177.6	-176.3	167.3	0	111.7	L3076 Y3098	L3076-K3096 HydrophobicContact CB-CB 4.39Å; L3076-K3096 PolarHBondContact N-O 3.16Å; L3076-K3096 PolarHBondContact O-N 3.03Å; K3096-Y3098 HydrophobicContact CB-CE2 3.75Å; K3096-Y3098 HydrophobicContact CD-CE2 4.4Å; K3096-Y3098 WeakPolarHBondContact CD-OH 3.37Å
3097	I	84.8	Confident	75.1	Confident	75 Å²	75	74.3 Å²	74.3	39%	0.385	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	134.9	171.6	-51.3	-178.3	0	0	0	108.1	F3073 L3074 R3075 Q3094	F3073-I3097 HydrophobicContact CB-CG2 3.94Å; F3073-I3097 HydrophobicContact CD1-CG2 3.39Å; F3073-I3097 HydrophobicContact CE1-CG2 4.12Å; F3073-I3097 HydrophobicContact CG-CG2 3.93Å; L3074-I3097 CarbonylContact O-C 3.57Å; L3074-I3097 VanDerWaalsContact O-CA 3.31Å; L3074-I3097 WeakPolarHBondContact O-CA 3.46Å; R3075-I3097 HydrophobicContact CG-CG1 4.26Å; R3075-I3097 HydrophobicContact CG-CG2 4.23Å; Q3094-I3097 VanDerWaalsContact NE2-CD1 3.28Å; Q3094-I3097 VanDerWaalsContact NE2-CG1 3.32Å
3098	Y	83.3	Confident	76.6	Confident	74 Å²	74	71.3 Å²	71.3	29%	0.29	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	122.8	177.4	-55.3	-89.5	0	0	0	110.3	F3073 L3074 K3096	F3073-Y3098 WeakPolarHBondContact CA-O 3.2Å; L3074-Y3098 HydrophobicContact CB-CD2 4.48Å; L3074-Y3098 PolarHBondContact N-O 3.28Å; L3074-Y3098 PolarHBondContact O-N 2.56Å; K3096-Y3098 HydrophobicContact CB-CE2 3.75Å; K3096-Y3098 HydrophobicContact CD-CE2 4.4Å; K3096-Y3098 WeakPolarHBondContact CD-OH 3.37Å
3099	P	81.4	Confident	77.8	Confident	94 Å²	94	64.7 Å²	64.7	61%	0.61	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.6	132	172.6	27.5	-30.9	0	0	0	110.2	F3073	F3073-P3099 VanDerWaalsContact CD1-CA 3.49Å; F3073-P3099 HydrophobicContact CD1-CB 3.97Å; F3073-P3099 HydrophobicContact CE1-CB 3.6Å; F3073-P3099 HydrophobicContact CE1-CG 4.41Å; F3073-P3099 HydrophobicContact CZ-CB 4.36Å
3100	T	78.7	Confident	78.9	Confident	20 Å²	20	60.2 Å²	60.2	12%	0.123	31%	0.311	C	S	.	.			trans	-104.3	-15.7	176.2	56.8	0	0	0	0	112.3	S3072 L3074 E3102 I3104	S3072-T3100 VanDerWaalsContact C-OG1 3.27Å; S3072-T3100 PolarHBondContact O-N 3.28Å; S3072-T3100 PolarHBondContact O-OG1 2.58Å; L3074-T3100 HydrophobicContact CB-CG2 4.4Å; L3074-T3100 HydrophobicContact CD1-CG2 3.65Å; L3074-T3100 HydrophobicContact CG-CG2 3.71Å; T3100-E3102 PolarHBondContact O-N 2.78Å; T3100-E3102 VanDerWaalsContact O-N 3.07Å; T3100-E3102 PolarHBondContact OG1-O 3.12Å; T3100-I3104 HydrophobicContact CG2-CD1 3.69Å
3101	G	77.6	Confident	79.5	Confident	76 Å²	76	60.3 Å²	60.3	78%	0.784	31%	0.308	S	S	*	.	S	Bend	trans	77.7	-23.3	-179.3	0	0	0	0	0	113.8
3102	E	80.1	Confident	79.6	Confident	57 Å²	57	57.5 Å²	57.5	27%	0.266	30%	0.296	S	S	.	.	S	Bend	trans	-138.7	156.3	176.1	-155.6	-170.2	158.2	0	0	111.9	S3072 T3100 I3104 L3121 S3123	S3072-E3102 VanDerWaalsContact CB-C 3.46Å; S3072-E3102 WeakPolarHBondContact CB-O 3.23Å; T3100-E3102 PolarHBondContact O-N 2.78Å; T3100-E3102 VanDerWaalsContact O-N 3.07Å; T3100-E3102 PolarHBondContact OG1-O 3.12Å; E3102-I3104 PolarHBondContact O-N 2.69Å; E3102-L3121 HydrophobicContact CB-CD1 4.47Å; E3102-L3121 HydrophobicContact CB-CD2 4.31Å; E3102-S3123 WeakPolarHBondContact OE1-CA 3.24Å; E3102-S3123 WeakPolarHBondContact OE1-CB 3.49Å; E3102-S3123 PolarHBondContact OE1-N 3.13Å; E3102-S3123 PolarHBondContact OE1-OG 3.25Å; E3102-S3123 VanDerWaalsContact OE2-CB 3.25Å; E3102-S3123 WeakPolarHBondContact OE2-CB 3.44Å; E3102-S3123 PolarHBondContact OE2-OG 3.24Å
3103	Q	82.1	Confident	79.3	Confident	35 Å²	35	62.3 Å²	62.3	16%	0.164	33%	0.325	C	S	.	.			trans	-69.2	124.1	-179.3	-164.9	-176.7	37.1	0	0	110.8	T3047 S3072 Q3122	T3047-Q3103 HydrophobicContact CG2-CG 3.8Å; S3072-Q3103 PolarHBondContact OG-N 3.49Å; Q3103-Q3122 PolarHBondContact O-N 2.94Å
3104	I	84.3	Confident	79	Confident	1 Å²	1	58.6 Å²	58.6	1%	0.005	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	131.2	173.4	-66.9	162.5	0	0	0	109.7	T3047 A3048 A3068 L3074 T3100 E3102 K3106 L3107 C3119 L3121	T3047-I3104 WeakPolarHBondContact CB-O 3.44Å; T3047-I3104 PolarHBondContact OG1-O 3.21Å; A3048-I3104 HydrophobicContact CB-CG2 4.23Å; A3068-I3104 HydrophobicContact CB-CB 3.84Å; A3068-I3104 HydrophobicContact CB-CD1 4.3Å; A3068-I3104 HydrophobicContact CB-CG2 4.13Å; L3074-I3104 HydrophobicContact CD1-CD1 3.76Å; L3074-I3104 HydrophobicContact CD2-CD1 3.56Å; L3074-I3104 HydrophobicContact CG-CD1 3.57Å; T3100-I3104 HydrophobicContact CG2-CD1 3.69Å; E3102-I3104 PolarHBondContact O-N 2.69Å; I3104-K3106 VanDerWaalsContact CG2-O 3.29Å; I3104-K3106 WeakPolarHBondContact CG2-O 3.49Å; I3104-L3107 HydrophobicContact CD1-CD2 4.38Å; I3104-L3107 HydrophobicContact CG2-CD2 3.96Å; I3104-L3107 HydrophobicContact CG2-CG 3.94Å; I3104-C3119 HydrophobicContact CD1-CB 4.02Å; I3104-C3119 HydrophobicContact CG1-CB 4.27Å; I3104-L3121 HydrophobicContact CG1-CD2 3.63Å
3105	K	82	Confident	78.6	Confident	72 Å²	72	55.4 Å²	55.4	31%	0.313	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	-27.8	176.5	-65.8	-57.5	-166.9	-168.1	0	113.5	P2721 I2722 C3120 Q3122	P2721-K3105 HydrophobicContact CB-CG 4.21Å; I2722-K3105 WeakPolarHBondContact O-CB 3.46Å; K3105-C3120 PolarHBondContact N-O 2.9Å; K3105-Q3122 HydrophobicContact CG-CB 4.15Å
3106	K	83	Confident	78.4	Confident	57 Å²	57	52.9 Å²	52.9	25%	0.248	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	140.8	178.2	-165	70.3	179	-177.2	0	111.4	A2725 I3104 V3108 C3120	A2725-K3106 HydrophobicContact CB-CG 4.45Å; I3104-K3106 VanDerWaalsContact CG2-O 3.29Å; I3104-K3106 WeakPolarHBondContact CG2-O 3.49Å; K3106-V3108 HydrophobicContact CG-CG2 4.28Å; K3106-C3120 HydrophobicContact CB-CB 4.01Å; K3106-C3120 PolarHBondContact N-O 3.22Å; K3106-C3120 PolarHBondContact O-N 3.01Å
3107	L	83.9	Confident	78.3	Confident	8 Å²	8	48.2 Å²	48.2	4%	0.042	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	134.8	172.6	-72.5	171.3	0	0	0	109.5	A3048 C3050 L3066 A3068 L3074 I3104 I3117 M3118 C3119	A3048-L3107 HydrophobicContact CB-CB 4.34Å; A3048-L3107 HydrophobicContact CB-CD1 4.14Å; A3048-L3107 HydrophobicContact CB-CG 3.96Å; C3050-L3107 HydrophobicContact CB-CB 3.76Å; L3066-L3107 HydrophobicContact CD2-CD1 4.24Å; L3066-L3107 HydrophobicContact CD2-CD2 4.39Å; L3066-L3107 HydrophobicContact CG-CD1 4.35Å; A3068-L3107 HydrophobicContact CB-CD1 4.01Å; L3074-L3107 HydrophobicContact CD2-CD1 3.93Å; L3074-L3107 HydrophobicContact CD2-CD2 4.04Å; I3104-L3107 HydrophobicContact CD1-CD2 4.38Å; I3104-L3107 HydrophobicContact CG2-CD2 3.96Å; I3104-L3107 HydrophobicContact CG2-CG 3.94Å; L3107-I3117 HydrophobicContact CD2-CG2 3.88Å; L3107-M3118 WeakPolarHBondContact CA-O 3.31Å; L3107-C3119 HydrophobicContact CD2-CB 4.25Å; L3107-C3119 WeakPolarHBondContact CD2-SG 3.22Å
3108	V	81.5	Confident	78.3	Confident	16 Å²	16	44.7 Å²	44.7	10%	0.097	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	119.7	176	-177.1	0	0	0	0	109.4	A2725 Y2727 K3106 I3117 M3118	A2725-V3108 HydrophobicContact CB-CG2 4Å; Y2727-V3108 HydrophobicContact CD1-CG1 3.81Å; Y2727-V3108 HydrophobicContact CE1-CG1 4.23Å; K3106-V3108 HydrophobicContact CG-CG2 4.28Å; V3108-I3117 WeakPolarHBondContact O-CA 3.3Å; V3108-M3118 HydrophobicContact CB-CB 4.39Å; V3108-M3118 HydrophobicContact CB-CE 3.8Å; V3108-M3118 HydrophobicContact CG1-CE 4.29Å; V3108-M3118 HydrophobicContact CG2-CE 3.87Å; V3108-M3118 PolarHBondContact N-O 2.8Å; V3108-M3118 PolarHBondContact O-N 2.88Å
3109	T	78.6	Confident	78.4	Confident	25 Å²	25	41.1 Å²	41.1	15%	0.153	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	122.5	168.6	49.8	0	0	0	0	109.7	Y2727 C3050 I3052 I3117	Y2727-T3109 WeakPolarHBondContact CE1-O 3.44Å; C3050-T3109 HydrophobicContact CB-CG2 4.27Å; C3050-T3109 WeakPolarHBondContact SG-CG2 3.36Å; C3050-T3109 PolarHBondContact SG-N 3.44Å; C3050-T3109 PolarHBondContact SG-OG1 3.06Å; I3052-T3109 HydrophobicContact CG1-CG2 4.42Å; T3109-I3117 HydrophobicContact CG2-CD1 4.33Å; T3109-I3117 HydrophobicContact CG2-CG1 3.98Å
3110	F	75.2	Confident	78.6	Confident	7 Å²	7	36.7 Å²	36.7	3%	0.031	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	-14.1	-177.2	63.6	-91.2	0	0	0	114	Y2727 K3116 M3118 F3128	Y2727-F3110 HydrophobicContact CD1-CB 3.56Å; Y2727-F3110 HydrophobicContact CD2-CB 3.66Å; Y2727-F3110 HydrophobicContact CE1-CB 3.78Å; Y2727-F3110 HydrophobicContact CE2-CB 3.87Å; Y2727-F3110 HydrophobicContact CG-CB 3.5Å; Y2727-F3110 VanDerWaalsContact CG-CB 3.5Å; F3110-K3116 HydrophobicContact CD1-CB 4.42Å; F3110-K3116 HydrophobicContact CD2-CB 4.24Å; F3110-K3116 HydrophobicContact CE1-CB 3.75Å; F3110-K3116 HydrophobicContact CE2-CB 3.57Å; F3110-K3116 HydrophobicContact CE2-CD 3.84Å; F3110-K3116 HydrophobicContact CE2-CG 4.36Å; F3110-K3116 HydrophobicContact CZ-CB 3.31Å; F3110-K3116 HydrophobicContact CZ-CD 4.05Å; F3110-K3116 HydrophobicContact CZ-CG 4.28Å; F3110-K3116 PolarHBondContact N-O 3.15Å; F3110-K3116 VanDerWaalsContact N-O 3.16Å; F3110-M3118 HydrophobicContact CD1-CB 4.2Å; F3110-M3118 HydrophobicContact CE1-CB 4.17Å; F3110-F3128 HydrophobicContact CD1-CE1 4.45Å; F3110-F3128 AromaticContact CE1-CD1 3.5Å; F3110-F3128 HydrophobicContact CE1-CD1 3.5Å; F3110-F3128 VanDerWaalsContact CE1-CD1 3.5Å; F3110-F3128 AromaticContact CE1-CE1 3.66Å; F3110-F3128 HydrophobicContact CE1-CE1 3.66Å; F3110-F3128 AromaticContact CZ-CD1 3.65Å; F3110-F3128 HydrophobicContact CZ-CD1 3.65Å; F3110-F3128 AromaticContact CZ-CE1 3.89Å; F3110-F3128 HydrophobicContact CZ-CE1 3.89Å
3111	N	69.7	Low	78.7	Confident	40 Å²	40	36 Å²	36	21%	0.214	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	139.4	168.1	-156	-16.2	0	0	0	109	D3113 V3115 K3116	N3111-D3113 PolarHBondContact OD1-N 3.41Å; N3111-V3115 CarbonylContact O-C 3.54Å; N3111-V3115 VanDerWaalsContact O-CA 3.26Å; N3111-V3115 WeakPolarHBondContact O-CA 3.33Å; N3111-K3116 HydrophobicContact CB-CB 3.97Å; N3111-K3116 HydrophobicContact CB-CD 4.15Å; N3111-K3116 HydrophobicContact CB-CG 4.17Å; N3111-K3116 PolarHBondContact O-N 2.83Å
3112	K	68.8	Low	78.8	Confident	129 Å²	129	36.2 Å²	36.2	56%	0.561	18%	0.179	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-102	-16.6	-178.8	-70.8	-173	178.5	-179.5	0	112.9	V3115	K3112-V3115 WeakPolarHBondContact O-CG2 3.43Å
3113	D	65.1	Low	78.6	Confident	146 Å²	146	35.5 Å²	35.5	78%	0.781	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-149.4	99.2	-178.4	-162	3.6	0	0	0	112	N3111	N3111-D3113 PolarHBondContact OD1-N 3.41Å
3114	P	70	Confident	78.3	Confident	60 Å²	60	33.9 Å²	33.9	39%	0.39	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	cis	-66.5	156.9	-8.3	30.5	-35.5	0	0	0	111.4	K3116 T3130	P3114-K3116 PolarHBondContact O-N 2.85Å; P3114-T3130 HydrophobicContact CB-CG2 3.94Å; P3114-T3130 HydrophobicContact CG-CG2 4.12Å
3115	V	74.1	Confident	78.1	Confident	5 Å²	5	38 Å²	38	3%	0.03	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	119.5	-178.3	-174.6	0	0	0	0	110	I3052 N3111 K3112 I3117 T3130 I3131 L3133	I3052-V3115 HydrophobicContact CB-CG1 4.15Å; I3052-V3115 HydrophobicContact CG1-CG1 4.34Å; I3052-V3115 HydrophobicContact CG2-CB 3.85Å; I3052-V3115 HydrophobicContact CG2-CG1 3.35Å; I3052-V3115 HydrophobicContact CG2-CG2 3.56Å; N3111-V3115 CarbonylContact O-C 3.54Å; N3111-V3115 VanDerWaalsContact O-CA 3.26Å; N3111-V3115 WeakPolarHBondContact O-CA 3.33Å; K3112-V3115 WeakPolarHBondContact O-CG2 3.43Å; V3115-I3117 HydrophobicContact CG1-CD1 4.29Å; V3115-I3117 HydrophobicContact CG1-CG1 4.06Å; V3115-T3130 CarbonylContact O-C 3.57Å; V3115-T3130 WeakPolarHBondContact O-CA 3.23Å; V3115-I3131 PolarHBondContact O-N 3.34Å; V3115-L3133 HydrophobicContact CG2-CD1 3.78Å; V3115-L3133 HydrophobicContact CG2-CG 4.24Å
3116	K	78.4	Confident	77.9	Confident	15 Å²	15	35.7 Å²	35.7	7%	0.065	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	135.6	176.5	-62.9	178.2	176.7	168.3	0	111.2	D2753 F3110 N3111 P3114 Y3129 T3130	D2753-K3116 IonicContact OD1-NZ 3.14Å; D2753-K3116 PolarHBondContact OD1-NZ 3.46Å; D2753-K3116 IonicContact OD2-NZ 2.8Å; D2753-K3116 PolarHBondContact OD2-NZ 2.86Å; F3110-K3116 HydrophobicContact CD1-CB 4.42Å; F3110-K3116 HydrophobicContact CD2-CB 4.24Å; F3110-K3116 HydrophobicContact CE1-CB 3.75Å; F3110-K3116 HydrophobicContact CE2-CB 3.57Å; F3110-K3116 HydrophobicContact CE2-CD 3.84Å; F3110-K3116 HydrophobicContact CE2-CG 4.36Å; F3110-K3116 HydrophobicContact CZ-CB 3.31Å; F3110-K3116 HydrophobicContact CZ-CD 4.05Å; F3110-K3116 HydrophobicContact CZ-CG 4.28Å; F3110-K3116 PolarHBondContact N-O 3.15Å; F3110-K3116 VanDerWaalsContact N-O 3.16Å; N3111-K3116 HydrophobicContact CB-CB 3.97Å; N3111-K3116 HydrophobicContact CB-CD 4.15Å; N3111-K3116 HydrophobicContact CB-CG 4.17Å; N3111-K3116 PolarHBondContact O-N 2.83Å; P3114-K3116 PolarHBondContact O-N 2.85Å; K3116-Y3129 WeakPolarHBondContact CA-O 3.44Å; K3116-T3130 HydrophobicContact CG-CG2 4.24Å
3117	I	82	Confident	77.8	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.005	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	129.3	-171.2	-51	-178.5	0	0	0	109	I3052 L3066 L3107 V3108 T3109 V3115 F3128 Y3129 I3131	I3052-I3117 HydrophobicContact CD1-CD1 3.89Å; I3052-I3117 HydrophobicContact CG1-CD1 3.72Å; L3066-I3117 HydrophobicContact CD2-CD1 3.4Å; L3066-I3117 HydrophobicContact CD2-CG2 4.23Å; L3107-I3117 HydrophobicContact CD2-CG2 3.88Å; V3108-I3117 WeakPolarHBondContact O-CA 3.3Å; T3109-I3117 HydrophobicContact CG2-CD1 4.33Å; T3109-I3117 HydrophobicContact CG2-CG1 3.98Å; V3115-I3117 HydrophobicContact CG1-CD1 4.29Å; V3115-I3117 HydrophobicContact CG1-CG1 4.06Å; I3117-F3128 WeakPolarHBondContact O-CA 3.39Å; I3117-Y3129 PolarHBondContact N-O 2.9Å; I3117-Y3129 PolarHBondContact O-N 3.01Å; I3117-I3131 HydrophobicContact CD1-CD1 3.37Å; I3117-I3131 HydrophobicContact CD1-CG1 3.98Å; I3117-I3131 HydrophobicContact CG1-CD1 4.47Å
3118	M	85	Confident	77.5	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	122.5	170	-176.5	174.9	55.2	0	0	108.7	A2725 C2737 T2739 L3107 V3108 F3110 I3126 F3128	A2725-M3118 HydrophobicContact CB-CE 3.54Å; C2737-M3118 HydrophobicContact CB-SD 3.86Å; T2739-M3118 HydrophobicContact CG2-SD 4.19Å; L3107-M3118 WeakPolarHBondContact CA-O 3.31Å; V3108-M3118 HydrophobicContact CB-CB 4.39Å; V3108-M3118 HydrophobicContact CB-CE 3.8Å; V3108-M3118 HydrophobicContact CG1-CE 4.29Å; V3108-M3118 HydrophobicContact CG2-CE 3.87Å; V3108-M3118 PolarHBondContact N-O 2.8Å; V3108-M3118 PolarHBondContact O-N 2.88Å; F3110-M3118 HydrophobicContact CD1-CB 4.2Å; F3110-M3118 HydrophobicContact CE1-CB 4.17Å; M3118-I3126 HydrophobicContact CG-CG2 3.46Å; M3118-I3126 VanDerWaalsContact CG-CG2 3.46Å; M3118-I3126 HydrophobicContact SD-CG2 3.91Å; M3118-F3128 HydrophobicContact CB-CD1 3.99Å; M3118-F3128 HydrophobicContact CB-CE1 3.65Å; M3118-F3128 HydrophobicContact CB-CZ 4.29Å; M3118-F3128 HydrophobicContact CG-CD1 4.24Å; M3118-F3128 HydrophobicContact CG-CE1 3.66Å; M3118-F3128 HydrophobicContact CG-CE2 4.45Å; M3118-F3128 HydrophobicContact CG-CZ 3.78Å; M3118-F3128 HydrophobicContact SD-CE1 3.97Å; M3118-F3128 HydrophobicContact SD-CZ 3.76Å
3119	C	84.4	Confident	77.4	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	113.9	177.9	-68.4	0	0	0	0	109.1	I3104 L3107 I3126 D3127 Y3129	I3104-C3119 HydrophobicContact CD1-CB 4.02Å; I3104-C3119 HydrophobicContact CG1-CB 4.27Å; L3107-C3119 HydrophobicContact CD2-CB 4.25Å; L3107-C3119 WeakPolarHBondContact CD2-SG 3.22Å; C3119-I3126 WeakPolarHBondContact O-CA 3.17Å; C3119-D3127 HydrophobicContact CB-CB 4.4Å; C3119-D3127 WeakPolarHBondContact CB-O 3.45Å; C3119-D3127 PolarHBondContact N-O 2.84Å; C3119-D3127 PolarHBondContact O-N 2.53Å; C3119-Y3129 HydrophobicContact CB-CD2 4.03Å; C3119-Y3129 HydrophobicContact CB-CE2 3.76Å; C3119-Y3129 WeakPolarHBondContact SG-CD2 3.38Å; C3119-Y3129 VanDerWaalsContact SG-CE2 3.51Å
3120	C	85.3	Confident	77.2	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	117.5	178.2	-53.9	0	0	0	0	109.8	I2722 K3105 K3106	I2722-C3120 HydrophobicContact CB-CB 3.79Å; I2722-C3120 HydrophobicContact CD1-CB 3.99Å; I2722-C3120 HydrophobicContact CG2-CB 3.69Å; K3105-C3120 PolarHBondContact N-O 2.9Å; K3106-C3120 HydrophobicContact CB-CB 4.01Å; K3106-C3120 PolarHBondContact N-O 3.22Å; K3106-C3120 PolarHBondContact O-N 3.01Å
3121	L	82.2	Confident	77.1	Confident	5 Å²	5	41 Å²	41	3%	0.026	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	161.4	-175.1	-59.6	178.7	0	0	0	112.2	E3102 I3104 S3123 G3124 Q3125 D3127	E3102-L3121 HydrophobicContact CB-CD1 4.47Å; E3102-L3121 HydrophobicContact CB-CD2 4.31Å; I3104-L3121 HydrophobicContact CG1-CD2 3.63Å; L3121-S3123 VanDerWaalsContact C-N 3.28Å; L3121-S3123 PolarHBondContact O-N 2.72Å; L3121-G3124 PolarHBondContact O-N 2.95Å; L3121-Q3125 HydrophobicContact CB-CB 4.37Å; L3121-Q3125 WeakPolarHBondContact CB-O 3.17Å; L3121-Q3125 HydrophobicContact CD1-CB 3.98Å; L3121-Q3125 HydrophobicContact CD1-CG 4.16Å; L3121-Q3125 PolarHBondContact N-O 3.23Å; L3121-D3127 WeakPolarHBondContact CD1-OD2 3.42Å
3122	Q	79.7	Confident	77.1	Confident	81 Å²	81	47 Å²	47	38%	0.379	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-29.5	177.8	-179	168.5	-7.3	0	0	113.4	P2721 Q3103 K3105 G3124	P2721-Q3122 WeakPolarHBondContact CA-O 3.5Å; P2721-Q3122 HydrophobicContact CB-CG 4.32Å; P2721-Q3122 WeakPolarHBondContact CB-O 3.43Å; Q3103-Q3122 PolarHBondContact O-N 2.94Å; K3105-Q3122 HydrophobicContact CG-CB 4.15Å; Q3122-G3124 PolarHBondContact O-N 3.25Å
3123	S	75.8	Confident	76.8	Confident	43 Å²	43	46.1 Å²	46.1	30%	0.301	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-3.5	175.5	56.7	0	0	0	0	114.2	Q2717 E3102 L3121 Q3125	Q2717-S3123 PolarHBondContact NE2-O 3.31Å; E3102-S3123 WeakPolarHBondContact OE1-CA 3.24Å; E3102-S3123 WeakPolarHBondContact OE1-CB 3.49Å; E3102-S3123 PolarHBondContact OE1-N 3.13Å; E3102-S3123 PolarHBondContact OE1-OG 3.25Å; E3102-S3123 VanDerWaalsContact OE2-CB 3.25Å; E3102-S3123 WeakPolarHBondContact OE2-CB 3.44Å; E3102-S3123 PolarHBondContact OE2-OG 3.24Å; L3121-S3123 VanDerWaalsContact C-N 3.28Å; L3121-S3123 PolarHBondContact O-N 2.72Å; S3123-Q3125 VanDerWaalsContact C-N 3.28Å
3124	G	75.5	Confident	77.4	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.01	21%	0.21	C	C	.	.	S	Bend	trans	81.8	6	-173.4	0	0	0	0	0	114	Q2717 G2720 L3121 Q3122	Q2717-G3124 WeakPolarHBondContact CG-O 3.4Å; G2720-G3124 WeakPolarHBondContact O-CA 3.19Å; L3121-G3124 PolarHBondContact O-N 2.95Å; Q3122-G3124 PolarHBondContact O-N 3.25Å
3125	Q	79.2	Confident	77.8	Confident	86 Å²	86	40.2 Å²	40.2	40%	0.402	20%	0.201	S	C	.	.			trans	-79.3	151	170.7	-177	171.7	-21.5	0	0	111.2	L3121 S3123 D3127	L3121-Q3125 HydrophobicContact CB-CB 4.37Å; L3121-Q3125 WeakPolarHBondContact CB-O 3.17Å; L3121-Q3125 HydrophobicContact CD1-CB 3.98Å; L3121-Q3125 HydrophobicContact CD1-CG 4.16Å; L3121-Q3125 PolarHBondContact N-O 3.23Å; S3123-Q3125 VanDerWaalsContact C-N 3.28Å; Q3125-D3127 PolarHBondContact NE2-OD1 3.33Å
3126	I	78.8	Confident	78	Confident	24 Å²	24	42.1 Å²	42.1	12%	0.123	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	123.9	175.1	-56.1	162.2	0	0	0	108	I2722 T2739 W2749 M3118 C3119 F3128	I2722-I3126 HydrophobicContact CD1-CD1 4.02Å; I2722-I3126 HydrophobicContact CD1-CG1 3.38Å; T2739-I3126 HydrophobicContact CG2-CD1 3.43Å; T2739-I3126 VanDerWaalsContact CG2-CD1 3.43Å; T2739-I3126 HydrophobicContact CG2-CG1 4.22Å; W2749-I3126 HydrophobicContact CD2-CD1 4.18Å; W2749-I3126 VanDerWaalsContact CE2-CD1 3.41Å; W2749-I3126 HydrophobicContact CG-CD1 4.49Å; W2749-I3126 HydrophobicContact CH2-CD1 4.45Å; W2749-I3126 HydrophobicContact CZ2-CD1 3.59Å; W2749-I3126 VanDerWaalsContact NE1-CD1 3.32Å; M3118-I3126 HydrophobicContact CG-CG2 3.46Å; M3118-I3126 VanDerWaalsContact CG-CG2 3.46Å; M3118-I3126 HydrophobicContact SD-CG2 3.91Å; C3119-I3126 WeakPolarHBondContact O-CA 3.17Å; I3126-F3128 HydrophobicContact CG2-CD2 4.08Å; I3126-F3128 HydrophobicContact CG2-CE2 3.54Å; I3126-F3128 HydrophobicContact CG2-CZ 3.95Å
3127	D	80.3	Confident	78	Confident	38 Å²	38	43.7 Å²	43.7	20%	0.203	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	148.2	173.5	-68.9	-18.4	0	0	0	109.7	C3119 L3121 Q3125 Y3129	C3119-D3127 HydrophobicContact CB-CB 4.4Å; C3119-D3127 WeakPolarHBondContact CB-O 3.45Å; C3119-D3127 PolarHBondContact N-O 2.84Å; C3119-D3127 PolarHBondContact O-N 2.53Å; L3121-D3127 WeakPolarHBondContact CD1-OD2 3.42Å; Q3125-D3127 PolarHBondContact NE2-OD1 3.33Å; D3127-Y3129 HydrophobicContact CB-CE2 3.72Å
3128	F	78.2	Confident	77.7	Confident	37 Å²	37	46.4 Å²	46.4	16%	0.162	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	130.4	179.7	-73.4	-92.5	0	0	0	110	C2737 V2751 Y2785 F3110 I3117 M3118 I3126	C2737-F3128 HydrophobicContact CB-CZ 4.28Å; V2751-F3128 HydrophobicContact CG2-CE1 4.24Å; V2751-F3128 HydrophobicContact CG2-CZ 4Å; Y2785-F3128 AromaticContact CD1-CD2 3.73Å; Y2785-F3128 HydrophobicContact CD1-CD2 3.73Å; Y2785-F3128 AromaticContact CD1-CE2 3.57Å; Y2785-F3128 HydrophobicContact CD1-CE2 3.57Å; Y2785-F3128 HydrophobicContact CD1-CG 4.35Å; Y2785-F3128 HydrophobicContact CD1-CZ 4.08Å; Y2785-F3128 HydrophobicContact CD2-CD2 4.22Å; Y2785-F3128 HydrophobicContact CE1-CB 4.07Å; Y2785-F3128 AromaticContact CE1-CD1 3.81Å; Y2785-F3128 HydrophobicContact CE1-CD1 3.81Å; Y2785-F3128 AromaticContact CE1-CD2 3.26Å; Y2785-F3128 HydrophobicContact CE1-CD2 3.26Å; Y2785-F3128 HydrophobicContact CE1-CE1 4Å; Y2785-F3128 AromaticContact CE1-CE2 3.47Å; Y2785-F3128 HydrophobicContact CE1-CE2 3.47Å; Y2785-F3128 VanDerWaalsContact CE1-CE2 3.47Å; Y2785-F3128 AromaticContact CE1-CG 3.45Å; Y2785-F3128 HydrophobicContact CE1-CG 3.45Å; Y2785-F3128 VanDerWaalsContact CE1-CG 3.45Å; Y2785-F3128 AromaticContact CE1-CZ 3.84Å; Y2785-F3128 HydrophobicContact CE1-CZ 3.84Å; Y2785-F3128 HydrophobicContact CE2-CB 4.08Å; Y2785-F3128 AromaticContact CE2-CD2 3.84Å; Y2785-F3128 HydrophobicContact CE2-CD2 3.84Å; Y2785-F3128 HydrophobicContact CE2-CG 4.17Å; Y2785-F3128 HydrophobicContact CG-CD2 4.18Å; Y2785-F3128 HydrophobicContact CG-CE2 4.19Å; Y2785-F3128 VanDerWaalsContact CZ-CB 3.45Å; Y2785-F3128 AromaticContact CZ-CD2 3.37Å; Y2785-F3128 AromaticContact CZ-CG 3.37Å; Y2785-F3128 WeakPolarHBondContact OH-CB 3.18Å; Y2785-F3128 VanDerWaalsContact OH-CG 3.29Å; Y2785-F3128 WeakPolarHBondContact OH-CG 3.44Å; F3110-F3128 HydrophobicContact CD1-CE1 4.45Å; F3110-F3128 AromaticContact CE1-CD1 3.5Å; F3110-F3128 HydrophobicContact CE1-CD1 3.5Å; F3110-F3128 VanDerWaalsContact CE1-CD1 3.5Å; F3110-F3128 AromaticContact CE1-CE1 3.66Å; F3110-F3128 HydrophobicContact CE1-CE1 3.66Å; F3110-F3128 AromaticContact CZ-CD1 3.65Å; F3110-F3128 HydrophobicContact CZ-CD1 3.65Å; F3110-F3128 AromaticContact CZ-CE1 3.89Å; F3110-F3128 HydrophobicContact CZ-CE1 3.89Å; I3117-F3128 WeakPolarHBondContact O-CA 3.39Å; M3118-F3128 HydrophobicContact CB-CD1 3.99Å; M3118-F3128 HydrophobicContact CB-CE1 3.65Å; M3118-F3128 HydrophobicContact CB-CZ 4.29Å; M3118-F3128 HydrophobicContact CG-CD1 4.24Å; M3118-F3128 HydrophobicContact CG-CE1 3.66Å; M3118-F3128 HydrophobicContact CG-CE2 4.45Å; M3118-F3128 HydrophobicContact CG-CZ 3.78Å; M3118-F3128 HydrophobicContact SD-CE1 3.97Å; M3118-F3128 HydrophobicContact SD-CZ 3.76Å; I3126-F3128 HydrophobicContact CG2-CD2 4.08Å; I3126-F3128 HydrophobicContact CG2-CE2 3.54Å; I3126-F3128 HydrophobicContact CG2-CZ 3.95Å
3129	Y	78.3	Confident	77.2	Confident	73 Å²	73	49.5 Å²	49.5	29%	0.286	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	134.5	-180	-62.2	-88.9	0	0	0	109.7	L3074 K3116 I3117 C3119 D3127	L3074-Y3129 HydrophobicContact CD1-CE2 4.42Å; K3116-Y3129 WeakPolarHBondContact CA-O 3.44Å; I3117-Y3129 PolarHBondContact N-O 2.9Å; I3117-Y3129 PolarHBondContact O-N 3.01Å; C3119-Y3129 HydrophobicContact CB-CD2 4.03Å; C3119-Y3129 HydrophobicContact CB-CE2 3.76Å; C3119-Y3129 WeakPolarHBondContact SG-CD2 3.38Å; C3119-Y3129 VanDerWaalsContact SG-CE2 3.51Å; D3127-Y3129 HydrophobicContact CB-CE2 3.72Å
3130	T	76.4	Confident	76.7	Confident	65 Å²	65	53 Å²	53	40%	0.399	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	120.5	164.8	-53.8	0	0	0	0	107.3	P3114 V3115 K3116	P3114-T3130 HydrophobicContact CB-CG2 3.94Å; P3114-T3130 HydrophobicContact CG-CG2 4.12Å; V3115-T3130 CarbonylContact O-C 3.57Å; V3115-T3130 WeakPolarHBondContact O-CA 3.23Å; K3116-T3130 HydrophobicContact CG-CG2 4.24Å
3131	I	72.1	Confident	76.1	Confident	11 Å²	11	57.1 Å²	57.1	6%	0.056	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	110.4	177.1	-58.4	-168.8	0	0	0	107.8	I3052 L3066 L3076 V3115 I3117 L3133	I3052-I3131 HydrophobicContact CD1-CD1 3.79Å; L3066-I3131 HydrophobicContact CD1-CD1 4.26Å; L3066-I3131 HydrophobicContact CD2-CD1 4.17Å; L3076-I3131 HydrophobicContact CD2-CG2 4.42Å; V3115-I3131 PolarHBondContact O-N 3.34Å; I3117-I3131 HydrophobicContact CD1-CD1 3.37Å; I3117-I3131 HydrophobicContact CD1-CG1 3.98Å; I3117-I3131 HydrophobicContact CG1-CD1 4.47Å; I3131-L3133 HydrophobicContact CG2-CD2 4.23Å; I3131-L3133 HydrophobicContact CG2-CG 4.44Å; I3131-L3133 PolarHBondContact O-N 2.9Å
3132	E	69	Low	75.5	Confident	166 Å²	166	61.4 Å²	61.4	78%	0.776	31%	0.307	S	S	*	.			trans	-75.4	107.4	164.2	-66.6	-178.1	171.2	0	0	107.9
3133	L	63.3	Low	75.2	Confident	112 Å²	112	59.6 Å²	59.6	59%	0.586	30%	0.3	S	S	*	.			trans	-76	0	178.3	-81.7	-179.9	0	0	0	112.8	I3052 Y3064 L3076 V3115 I3131	I3052-L3133 HydrophobicContact CG2-CD1 3.77Å; I3052-L3133 HydrophobicContact CG2-CD2 4.2Å; I3052-L3133 HydrophobicContact CG2-CG 4.18Å; Y3064-L3133 HydrophobicContact CD1-CD2 3.52Å; Y3064-L3133 HydrophobicContact CD2-CD1 4.14Å; Y3064-L3133 HydrophobicContact CD2-CD2 4.47Å; Y3064-L3133 HydrophobicContact CE1-CD2 3.75Å; Y3064-L3133 HydrophobicContact CE2-CD1 4.39Å; Y3064-L3133 HydrophobicContact CG-CD1 4.26Å; Y3064-L3133 HydrophobicContact CG-CD2 3.9Å; L3076-L3133 HydrophobicContact CD2-CD2 4.29Å; V3115-L3133 HydrophobicContact CG2-CD1 3.78Å; V3115-L3133 HydrophobicContact CG2-CG 4.24Å; I3131-L3133 HydrophobicContact CG2-CD2 4.23Å; I3131-L3133 HydrophobicContact CG2-CG 4.44Å; I3131-L3133 PolarHBondContact O-N 2.9Å

Retrieved 3,133 of 3,133 residues in 2624.7 ms (Link to these results)

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