A0A5K4ELW6_SCHMA Loading...

Putative nephrin

AlphaFold DB , UniProt , Accession A0A5K4ELW6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,770 aa.

						>A0A5K4ELW6_SCHMA|A0A5K4ELW6
MLTIKFLKQQFIIIFLCNHQSWKRILFIHGNKLHIFIITLLIGWFIDFDTAARVIQSNRCTTEERQKRIQCFEVLPSEQYAIPLGHTVNMQCVVLNQHGKVQWRAKKILLGYDRSIPGYSRFRIIGDVGRGEHTLQITDVQRDDAGEYECQVTPVPVNNHPLLRRKTYLEVLIKPNEPQILYQNVQLPERKLIISQPDPILRISLVCSAVGGRPAPTFKWLINRHEIPNLEVKTKTPMSPNDVAKMNNLLKVWGKLHPIINNEENEEQSNLSILKAGLEDGDEIVCSVSNSATQINHDPMKRNLSITITVDVHTPPGPPKIVSPESNHVYLDGEQLRAVCVSSPPGKPLGGLFWRWLIRPSQVDDNDIQKISGIGGRGGARLSDYTSVEAYLRSLDSSNGGGSPSQKILTPELSQLQQGDFISEDVQPLHYTLTKEKDQLVNTLIIQRVTRKYHAAKLICETGHPVGSAHQTSITIFVKHAPANVTISVETGSIDDDHTGGRHEKVAYARAGEMKTFICKTAPYYGQATIKWLFQAAGTSITTSPKQLVDKSVTYKTPDGESFYQESRIQITVRPEDDRSYIDCLVWSVGDARIDSRVRLDIIHPPDIPKITGYKSGQPVNMAHLLELTCTTTGGNPLPELQWFKDKNPITNNVEPIIIGKQTTIKLKLVPQKEDNGAQYHCSARNTATNNEWIDSEAITLNVLFPPQRVSLNFGGKSVVQSGEQLEINCQADSSNPVAVITWRHYQCGPAHAFYRRHLLQQQKKLPKSSSSTNEGEKCKLLELKGSDETPVPGASGGLLARSHLWLRPTWRYHMDFIECQAENPVYGPPIWHDRLQLNITFAPQFYGLQVDDHRVIREGETTHLDFGLYANPPVTSVSWFRNDQLLPFEPKETDTWQGVFAAGSVGELLSLHKINRENMGNYTVIVSNSQHESRNTFFLNVTYPASIVGKLEENITQTNKDYAALDCKADANPAIPDRTFTWYRYFPPKGWTEEVDEGALQLSEPIYCNQSQIDKPKMLAQCFQQDKFQISSTFYIYQLTEDDVGKYVCEVSNGIGEPVKKTFNLLYHFPPKIIQLPRYTKAAGEQSSKVWLTCYIRTEPTPQIVWLKDNKLIPMDTLIQSKNSDSKNGIKKYENYLIHIRPGLYKAQLAVNDIRKYDFGSYSCQAANLQGEAQLEIHLSGTSTPDVPINFRLLNATSSTLHVAWTQGFDGGLAQTFQVRWREVGSISLYKYADVASNDNRNGVEYIITGLKPGSEYIVSVNSMNSKHGASAYTDPIHLRTLSLDLYNGREPMPPLSTSGYSDDNALLIIVSACVFGFVILLINIIVIIFLIKRRRHRNMMRRRQYKSDQGVTMTNGVALTHHNQTSTDMKSHLQSSFIDQNDNFMDTDISTTCICCHPNKQKLASSGYVKADSYGNFSRTHGYAPHDICPSQCPQYIPTDVDQQGHLMNHNITSSNPDFNHLTSNQMTTSYPVRHLTSPNPYYNNTLNYPMTRHGSTELGIVYSSANPVNQLRHEHGSIKHSTRYGQHTPRQPNQSRYYGTLQNLSSYRKITNDQFIIDNKMKDCAQLQTIISSTASINNSVTVDSNSIGLTIVNNSIDSSVHNVVPNQTADSSTEILSTGLAAFSQIKRKSEFNNNISERNNLTNGFFNTNNIPGENSPIVSINVTSFPDHFNSQSMELGSDLTTFSYSAPFNYNIGPSCTPIFLSLDPSASNSLLMSNSLMNCTQDNNKLYEVNREMSVTPLMIHSPTPVHTDQVLVSSYVPVQHI
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE 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	28.9	Very low	28.6	Very low	118 Å²	118	128.1 Å²	128.1	58%	0.581	61%	0.61	S	S	*	*				0	165.4	0	-68.3	-52	175	0	0	110.7	T3 V54 D1015	M1-T3 PolarHBondContact O-N 2.94Å; M1-V54 HydrophobicContact CB-CB 4.11Å; M1-V54 HydrophobicContact CG-CB 4.1Å; M1-V54 HydrophobicContact SD-CB 3.72Å; M1-V54 HydrophobicContact SD-CG2 3.78Å; M1-V54 PolarHBondContact SD-N 3.47Å; M1-D1015 VanDerWaalsContact CE-OD2 3.25Å; M1-D1015 WeakPolarHBondContact CE-OD2 3.3Å
2	L	25.6	Very low	28.2	Very low	60 Å²	60	129.3 Å²	129.3	31%	0.314	62%	0.62	S	S	.	*			trans	-77.5	91	178.9	-88.1	-175.2	0	0	0	110.7	I4 R53 V54 I55	L2-I4 PolarHBondContact O-N 3.29Å; L2-R53 HydrophobicContact CB-CB 4.27Å; L2-R53 WeakPolarHBondContact CB-O 3.34Å; L2-R53 HydrophobicContact CD1-CG 4.34Å; L2-R53 WeakPolarHBondContact CD1-O 3.26Å; L2-R53 HydrophobicContact CD2-CB 4.15Å; L2-R53 HydrophobicContact CD2-CG 4.1Å; L2-R53 HydrophobicContact CG-CB 3.64Å; L2-R53 HydrophobicContact CG-CG 3.77Å; L2-R53 VanDerWaalsContact CG-O 3.25Å; L2-R53 WeakPolarHBondContact CG-O 3.33Å; L2-V54 CarbonylContact C-O 3.42Å; L2-V54 WeakPolarHBondContact CA-O 3.46Å; L2-V54 PolarHBondContact N-O 2.64Å; L2-V54 VanDerWaalsContact N-O 3.09Å; L2-I55 HydrophobicContact CB-CB 4.47Å; L2-I55 HydrophobicContact CB-CG1 3.59Å; L2-I55 HydrophobicContact CD1-CD1 3.75Å; L2-I55 HydrophobicContact CD1-CG1 3.46Å; L2-I55 VanDerWaalsContact CD1-CG1 3.46Å; L2-I55 HydrophobicContact CG-CG1 4.15Å; L2-I55 WeakPolarHBondContact O-CA 3.36Å
3	T	32.7	Very low	28.2	Very low	116 Å²	116	131.2 Å²	131.2	71%	0.712	63%	0.633	S	S	*	*				8	90.8	109	59.1	0	0	0	0	115.1	M1	M1-T3 PolarHBondContact O-N 2.94Å
4	I	29.7	Very low	28	Very low	95 Å²	95	131.8 Å²	131.8	49%	0.487	64%	0.639	S	S	.	*			trans	-119.3	128	141.1	-74.2	-163.7	0	0	0	107.1	L2 F6 I55	L2-I4 PolarHBondContact O-N 3.29Å; I4-F6 HydrophobicContact CG2-CD2 4.11Å; I4-F6 PolarHBondContact O-N 3.4Å; I4-I55 HydrophobicContact CD1-CB 4.47Å; I4-I55 HydrophobicContact CD1-CD1 4.18Å; I4-I55 HydrophobicContact CD1-CG1 4.2Å; I4-I55 HydrophobicContact CD1-CG2 3.49Å; I4-I55 VanDerWaalsContact CD1-CG2 3.49Å; I4-I55 HydrophobicContact CG1-CG1 4.28Å; I4-I55 HydrophobicContact CG1-CG2 3.91Å
5	K	27.8	Very low	27.8	Very low	177 Å²	177	132.2 Å²	132.2	77%	0.77	64%	0.637	S	S	*	*			trans	-76.4	115.8	170.6	-87.1	174.9	163.1	-178	0	110.2	L7	K5-L7 HydrophobicContact CB-CB 4.22Å; K5-L7 HydrophobicContact CB-CD1 4.35Å; K5-L7 HydrophobicContact CD-CD1 4.13Å
6	F	28.3	Very low	27.8	Very low	145 Å²	145	133.1 Å²	133.1	64%	0.636	65%	0.645	S	S	*	*			trans	-131.5	112.2	143.6	-91.8	-112.9	0	0	0	103.9	I4 N58	I4-F6 HydrophobicContact CG2-CD2 4.11Å; I4-F6 PolarHBondContact O-N 3.4Å; F6-N58 WeakPolarHBondContact CD2-ND2 3.38Å; F6-N58 WeakPolarHBondContact CE2-ND2 3.32Å; F6-N58 WeakPolarHBondContact CG-ND2 3.49Å
7	L	25.6	Very low	27.7	Very low	94 Å²	94	131 Å²	131	49%	0.492	65%	0.646	S	S	.	*			cis	64.3	66.9	10.1	-136.7	177.8	0	0	0	114.2	K5	K5-L7 HydrophobicContact CB-CB 4.22Å; K5-L7 HydrophobicContact CB-CD1 4.35Å; K5-L7 HydrophobicContact CD-CD1 4.13Å
8	K	29.6	Very low	27.6	Very low	171 Å²	171	129.8 Å²	129.8	74%	0.743	64%	0.643	S	S	*	*			trans	-179	88.5	144.9	-100.4	168.7	-177.9	-179.2	0	106.7
9	Q	28.5	Very low	27.7	Very low	128 Å²	128	132.2 Å²	132.2	60%	0.598	65%	0.651	S	S	*	*			cis	52.1	98.1	21.3	-165.3	177.3	24.2	0	0	114.4
10	Q	34.6	Very low	27.8	Very low	153 Å²	153	134.1 Å²	134.1	72%	0.715	66%	0.659	S	S	*	*			trans	65.3	164.1	170.1	-59.9	162.4	-17.4	0	0	111.3
11	F	23.2	Very low	27.9	Very low	152 Å²	152	131.8 Å²	131.8	67%	0.667	66%	0.656	S	S	*	*				-163.2	168.6	70.8	-106.6	-91.2	0	0	0	111.6
12	I	24.2	Very low	27.7	Very low	142 Å²	142	135.7 Å²	135.7	73%	0.728	66%	0.664	S	S	*	*			trans	69.9	86.2	161.4	-62.7	151.7	0	0	0	114.1
13	I	28.2	Very low	27.8	Very low	154 Å²	154	139.7 Å²	139.7	79%	0.79	68%	0.679	S	S	*	*			trans	-19.9	135.8	132.1	-38.2	168.6	0	0	0	112.3
14	I	24.7	Very low	27.6	Very low	140 Å²	140	144.7 Å²	144.7	72%	0.718	69%	0.685	S	S	*	*			trans	159.2	116	137.7	-85.2	159.8	0	0	0	112
15	F	25.8	Very low	27.6	Very low	138 Å²	138	145.9 Å²	145.9	61%	0.605	69%	0.691	S	S	*	*			trans	66	86.1	154.6	-76.3	-113.7	0	0	0	122	L26	F15-L26 HydrophobicContact CE2-CD1 3.58Å; F15-L26 HydrophobicContact CZ-CB 4Å; F15-L26 HydrophobicContact CZ-CD1 3.88Å
16	L	27.3	Very low	27.6	Very low	146 Å²	146	142.8 Å²	142.8	76%	0.764	68%	0.682	S	S	*	*				36.4	131.9	106.2	-70.4	167.3	0	0	0	122
17	C	25.7	Very low	27.6	Very low	98 Å²	98	144.4 Å²	144.4	66%	0.662	69%	0.69	S	S	*	*			trans	69.1	139.7	145	-63.7	0	0	0	0	117.8
18	N	27.2	Very low	27.8	Very low	109 Å²	109	146.7 Å²	146.7	58%	0.583	70%	0.701	S	S	*	*			cis	-141.3	177	18.9	-82.4	-71.6	0	0	0	109.2
19	H	29.3	Very low	27.6	Very low	175 Å²	175	147.4 Å²	147.4	81%	0.81	71%	0.706	S	S	*	*	S	Bend	cis	-147.3	145	34.9	-114.3	-115.1	0	0	0	108.7
20	Q	29.5	Very low	27.7	Very low	171 Å²	171	144.4 Å²	144.4	80%	0.799	71%	0.71	S	S	*	*	S	Bend	cis	-127.7	151.6	3.7	-74.6	165.1	-49.4	0	0	108.5
21	S	29.3	Very low	27.4	Very low	86 Å²	86	144.6 Å²	144.6	60%	0.601	72%	0.716	S	S	*	*			cis	-163.4	129	-1.3	40.8	0	0	0	0	113.3
22	W	25.4	Very low	27.8	Very low	199 Å²	199	145.4 Å²	145.4	75%	0.754	72%	0.719	S	S	*	*			trans	70.4	152.7	159.7	-60.8	30.1	0	0	0	116.7
23	K	26.4	Very low	28	Very low	144 Å²	144	145.2 Å²	145.2	63%	0.626	72%	0.719	S	S	*	*			cis	-173.8	165.7	-18.1	-97.5	169.4	-166	169.8	0	104.4
24	R	29.7	Very low	28	Very low	222 Å²	222	145 Å²	145	84%	0.838	71%	0.714	S	S	*	*			cis	-165.5	171.9	-4.2	-127.8	-168.6	171.9	-166.1	-3.5	104.4
25	I	29.4	Very low	28.4	Very low	119 Å²	119	145 Å²	145	61%	0.61	71%	0.714	S	S	*	*			cis	-156.9	-166.9	-8.3	-156.6	175.4	0	0	0	107.2
26	L	27.5	Very low	28.6	Very low	113 Å²	113	147.5 Å²	147.5	59%	0.592	73%	0.725	S	S	*	*			trans	-152.8	148.8	-179.3	-151	175.6	0	0	0	111	F15	F15-L26 HydrophobicContact CE2-CD1 3.58Å; F15-L26 HydrophobicContact CZ-CB 4Å; F15-L26 HydrophobicContact CZ-CD1 3.88Å
27	F	28.1	Very low	28.6	Very low	179 Å²	179	147.7 Å²	147.7	79%	0.785	73%	0.725	S	S	*	*			trans	-161.5	136.5	162.9	-97.1	-43.5	0	0	0	118
28	I	30.6	Very low	28.9	Very low	142 Å²	142	150.1 Å²	150.1	73%	0.728	73%	0.73	S	S	*	*			trans	82.1	143	136.2	-74.5	161.7	0	0	0	124.8
29	H	25.3	Very low	29.2	Very low	185 Å²	185	151.6 Å²	151.6	86%	0.856	74%	0.743	S	S	*	*			trans	-65.4	167.3	-167.3	-62.5	-94.1	0	0	0	121.9
30	G	29.7	Very low	29.1	Very low	65 Å²	65	150.9 Å²	150.9	67%	0.67	75%	0.745	S	S	*	*				150.1	108.1	107.6	0	0	0	0	0	123
31	N	29.7	Very low	29.2	Very low	157 Å²	157	150.4 Å²	150.4	84%	0.84	75%	0.747	S	S	*	*			trans	60.6	156.4	141.2	-74.2	-24.8	0	0	0	121.1
32	K	30.7	Very low	29.4	Very low	169 Å²	169	154.7 Å²	154.7	74%	0.735	76%	0.761	S	S	*	*			cis	-161	151.4	3.7	-133.8	-178	-178.7	-179.2	0	114
33	L	29.3	Very low	29.7	Very low	139 Å²	139	148 Å²	148	73%	0.728	75%	0.753	S	S	*	*			trans	65.9	169.2	151.9	-114.6	70.9	0	0	0	118
34	H	28.1	Very low	29.8	Very low	149 Å²	149	152.9 Å²	152.9	69%	0.69	77%	0.768	S	S	*	*			cis	-157.4	-173.9	-7.5	-156.2	15.7	0	0	0	112.4
35	I	33.2	Very low	29.8	Very low	141 Å²	141	151 Å²	151	72%	0.723	77%	0.767	S	S	*	*			trans	60.4	122.3	163.1	-60.9	169.4	0	0	0	117.6
36	F	28.3	Very low	29.7	Very low	190 Å²	190	152.6 Å²	152.6	83%	0.833	78%	0.775	S	S	*	*			cis	99.8	149.6	-9.2	-119	-109	0	0	0	122
37	I	28.9	Very low	29.7	Very low	150 Å²	150	153 Å²	153	77%	0.769	78%	0.777	S	S	*	*			trans	77.7	133.8	174	-16.7	-177.2	0	0	0	121.5
38	I	32.3	Very low	29.6	Very low	148 Å²	148	153.6 Å²	153.6	76%	0.759	78%	0.78	S	S	*	*			trans	92.1	93	160.8	-45.7	-176.1	0	0	0	118.7
39	T	31.5	Very low	29.5	Very low	141 Å²	141	151.6 Å²	151.6	87%	0.865	77%	0.771	S	S	*	*				-165.4	128.2	119	8.5	0	0	0	0	110.8
40	L	29.1	Very low	29.8	Very low	160 Å²	160	149.4 Å²	149.4	84%	0.838	77%	0.771	S	S	*	*			trans	-161.5	147.7	174.3	-136.4	174.9	0	0	0	107.5
41	L	29.7	Very low	29.7	Very low	161 Å²	161	148.6 Å²	148.6	84%	0.843	76%	0.758	S	S	*	*			trans	69.1	122.5	-160.7	-45.5	168.8	0	0	0	110
42	I	34.3	Very low	29.7	Very low	175 Å²	175	145.6 Å²	145.6	90%	0.897	76%	0.755	S	S	*	*			cis	-118	154.8	35.2	-69.3	156.2	0	0	0	112.1
43	G	31.5	Very low	30.1	Very low	58 Å²	58	142.8 Å²	142.8	60%	0.598	74%	0.74	S	S	*	*			trans	-151	162.5	170.3	0	0	0	0	0	111.6
44	W	29.9	Very low	31	Very low	247 Å²	247	138 Å²	138	94%	0.936	72%	0.716	S	S	*	*			trans	69	99.7	-167.7	-68.9	66.5	0	0	0	115.2
45	F	29	Very low	32.5	Very low	184 Å²	184	133.9 Å²	133.9	81%	0.807	70%	0.699	S	S	*	*				-175.8	121.4	117.3	-118.6	-100.2	0	0	0	109.7
46	I	27.7	Very low	34.9	Very low	151 Å²	151	129.3 Å²	129.3	77%	0.774	67%	0.674	S	S	*	*			trans	49.8	147.1	153.2	-60	178.9	0	0	0	119.3
47	D	26.9	Very low	37.6	Very low	121 Å²	121	121.1 Å²	121.1	65%	0.647	64%	0.64	S	S	*	*			cis	-177.2	163	-34.3	-159.1	-16.8	0	0	0	105
48	F	25.9	Very low	40.3	Very low	192 Å²	192	116.7 Å²	116.7	84%	0.842	62%	0.618	S	S	*	*			trans	59	122.9	-172.5	-59.5	-100.3	0	0	0	114.2
49	D	28.7	Very low	42.9	Very low	101 Å²	101	117 Å²	117	54%	0.54	61%	0.61	S	S	.	*			cis	-143.6	102	48.7	162.7	39.3	0	0	0	112.2	A51 R53	D49-A51 WeakPolarHBondContact OD1-CB 3.44Å; D49-A51 PolarHBondContact OD1-N 3.03Å; D49-R53 PolarHBondContact O-NH1 3.46Å; D49-R53 IonicContact OD1-NH2 3.47Å; D49-R53 PolarHBondContact OD1-NH2 2.62Å; D49-R53 IonicContact OD2-CZ 2.69Å; D49-R53 IonicContact OD2-NH1 3.73Å; D49-R53 PolarHBondContact OD2-NH1 2.85Å; D49-R53 IonicContact OD2-NH2 3.47Å; D49-R53 PolarHBondContact OD2-NH2 3.46Å
50	T	30.8	Very low	45.6	Very low	138 Å²	138	111.2 Å²	111.2	85%	0.847	58%	0.575	S	S	*	*			trans	-105.2	44.2	178.4	42.7	0	0	0	0	112.8
51	A	27.5	Very low	48.3	Very low	49 Å²	49	107 Å²	107	41%	0.405	56%	0.556	S	S	.	*			trans	-110.4	144.7	-174.4	0	0	0	0	0	116.7	D49 R53	D49-A51 WeakPolarHBondContact OD1-CB 3.44Å; D49-A51 PolarHBondContact OD1-N 3.03Å; A51-R53 PolarHBondContact O-NE 3.29Å; A51-R53 PolarHBondContact O-NH2 3.24Å
52	A	31.4	Very low	50.9	Low	94 Å²	94	104.5 Å²	104.5	78%	0.777	55%	0.547	S	S	*	.			trans	57.7	59.6	159.2	0	0	0	0	0	116.8
53	R	39	Very low	53.2	Low	110 Å²	110	101.3 Å²	101.3	42%	0.415	53%	0.528	S	S	.	.			trans	-143.1	101.8	177.2	44.6	-157.2	82.2	148.8	9	111.1	L2 D49 A51	L2-R53 HydrophobicContact CB-CB 4.27Å; L2-R53 WeakPolarHBondContact CB-O 3.34Å; L2-R53 HydrophobicContact CD1-CG 4.34Å; L2-R53 WeakPolarHBondContact CD1-O 3.26Å; L2-R53 HydrophobicContact CD2-CB 4.15Å; L2-R53 HydrophobicContact CD2-CG 4.1Å; L2-R53 HydrophobicContact CG-CB 3.64Å; L2-R53 HydrophobicContact CG-CG 3.77Å; L2-R53 VanDerWaalsContact CG-O 3.25Å; L2-R53 WeakPolarHBondContact CG-O 3.33Å; D49-R53 PolarHBondContact O-NH1 3.46Å; D49-R53 IonicContact OD1-NH2 3.47Å; D49-R53 PolarHBondContact OD1-NH2 2.62Å; D49-R53 IonicContact OD2-CZ 2.69Å; D49-R53 IonicContact OD2-NH1 3.73Å; D49-R53 PolarHBondContact OD2-NH1 2.85Å; D49-R53 IonicContact OD2-NH2 3.47Å; D49-R53 PolarHBondContact OD2-NH2 3.46Å; A51-R53 PolarHBondContact O-NE 3.29Å; A51-R53 PolarHBondContact O-NH2 3.24Å
54	V	47.6	Very low	55.7	Low	38 Å²	38	100.9 Å²	100.9	23%	0.23	51%	0.511	C	S	.	.			trans	-78.8	115.1	-170.3	159.9	0	0	0	0	114.6	M1 L2	M1-V54 HydrophobicContact CB-CB 4.11Å; M1-V54 HydrophobicContact CG-CB 4.1Å; M1-V54 HydrophobicContact SD-CB 3.72Å; M1-V54 HydrophobicContact SD-CG2 3.78Å; M1-V54 PolarHBondContact SD-N 3.47Å; L2-V54 CarbonylContact C-O 3.42Å; L2-V54 WeakPolarHBondContact CA-O 3.46Å; L2-V54 PolarHBondContact N-O 2.64Å; L2-V54 VanDerWaalsContact N-O 3.09Å
55	I	59.2	Low	58.3	Low	63 Å²	63	94.5 Å²	94.5	32%	0.323	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-79.1	124.3	172.2	-62.3	169.4	0	0	0	110.5	L2 I4 R164	L2-I55 HydrophobicContact CB-CB 4.47Å; L2-I55 HydrophobicContact CB-CG1 3.59Å; L2-I55 HydrophobicContact CD1-CD1 3.75Å; L2-I55 HydrophobicContact CD1-CG1 3.46Å; L2-I55 VanDerWaalsContact CD1-CG1 3.46Å; L2-I55 HydrophobicContact CG-CG1 4.15Å; L2-I55 WeakPolarHBondContact O-CA 3.36Å; I4-I55 HydrophobicContact CD1-CB 4.47Å; I4-I55 HydrophobicContact CD1-CD1 4.18Å; I4-I55 HydrophobicContact CD1-CG1 4.2Å; I4-I55 HydrophobicContact CD1-CG2 3.49Å; I4-I55 VanDerWaalsContact CD1-CG2 3.49Å; I4-I55 HydrophobicContact CG1-CG1 4.28Å; I4-I55 HydrophobicContact CG1-CG2 3.91Å; I55-R164 VanDerWaalsContact N-NH2 3.2Å; I55-R164 PolarHBondContact O-NE 2.84Å; I55-R164 PolarHBondContact O-NH2 2.99Å
56	Q	83.4	Confident	60.9	Low	45 Å²	45	93.5 Å²	93.5	21%	0.21	49%	0.485	C	S	.	.	P	Polyproline II helix	trans	-82.4	137.7	170.4	-66	-73.8	-57.5	0	0	110.9	E149 R165	Q56-E149 PolarHBondContact NE2-OE1 3.13Å; Q56-R165 VanDerWaalsContact OE1-CA 3.27Å
57	S	85.3	Confident	63.5	Low	18 Å²	18	92.6 Å²	92.6	13%	0.126	48%	0.475	C	S	.	.	P	Polyproline II helix	trans	-92	138.3	-174.1	-50	0	0	0	0	111.7	L163 R164 R165	S57-L163 WeakPolarHBondContact OG-CA 3.24Å; S57-R164 PolarHBondContact N-O 2.91Å; S57-R164 PolarHBondContact OG-N 3.18Å; S57-R165 PolarHBondContact O-NE 3.11Å; S57-R165 PolarHBondContact O-NH2 3.48Å
58	N	86.5	Confident	66.3	Low	57 Å²	57	95.5 Å²	95.5	31%	0.305	48%	0.477	S	S	.	.			trans	-92.5	-178.8	-178.9	-67.9	-35.8	0	0	0	112.1	F6 R165	F6-N58 WeakPolarHBondContact CD2-ND2 3.38Å; F6-N58 WeakPolarHBondContact CE2-ND2 3.32Å; F6-N58 WeakPolarHBondContact CG-ND2 3.49Å; N58-R165 PolarHBondContact OD1-NH2 2.93Å
59	R	86.9	Confident	69.1	Low	155 Å²	155	88.2 Å²	88.2	59%	0.585	45%	0.447	S	S	*	.	B	Isolated β-bridge	trans	-69.2	146.8	174.1	-159.5	179.4	-166.5	178.4	6.2	110.7	T61 F72 E73 L75	R59-T61 PolarHBondContact O-N 3.13Å; R59-F72 CarbonylContact C-O 3.59Å; R59-F72 VanDerWaalsContact CA-O 3.29Å; R59-F72 WeakPolarHBondContact CA-O 3.35Å; R59-F72 WeakPolarHBondContact CG-O 3.42Å; R59-E73 VanDerWaalsContact CZ-O 3.23Å; R59-E73 PolarHBondContact NE-O 2.86Å; R59-E73 PolarHBondContact NH2-O 3.27Å; R59-L75 HydrophobicContact CB-CD1 4.27Å
60	C	86.4	Confident	72.1	Confident	19 Å²	19	83.4 Å²	83.4	13%	0.128	42%	0.421	C	S	.	.			trans	-41.5	128.1	179.5	-72.8	0	0	0	0	114	R65 C71 F72	C60-R65 HydrophobicContact CB-CG 4.3Å; C60-C71 HydrophobicContact CB-CB 3.88Å; C60-C71 WeakPolarHBondContact CB-SG 3.42Å; C60-C71 WeakPolarHBondContact SG-CB 3.04Å; C60-C71 PolarHBondContact SG-O 3.18Å; C60-C71 CovalentContact SG-SG 2.03Å; C60-C71 PolarHBondContact SG-SG 3.1Å; C60-F72 PolarHBondContact N-O 3.45Å; C60-F72 VanDerWaalsContact SG-C 3.52Å; C60-F72 PolarHBondContact SG-O 3.25Å; C60-F72 VanDerWaalsContact SG-O 3.37Å
61	T	86.9	Confident	74.9	Confident	71 Å²	71	77 Å²	77	44%	0.436	38%	0.381	S	S	.	.			trans	-75.6	164	162.9	65	0	0	0	0	111.4	R59 E63 E64 R65	R59-T61 PolarHBondContact O-N 3.13Å; T61-E63 VanDerWaalsContact C-N 3.3Å; T61-E64 VanDerWaalsContact CB-OE2 3.31Å; T61-E64 WeakPolarHBondContact CB-OE2 3Å; T61-E64 WeakPolarHBondContact CG2-OE2 3.38Å; T61-E64 PolarHBondContact N-OE2 3.13Å; T61-E64 WeakPolarHBondContact OG1-CB 3.31Å; T61-E64 VanDerWaalsContact OG1-CD 3.27Å; T61-E64 VanDerWaalsContact OG1-CG 3.26Å; T61-E64 WeakPolarHBondContact OG1-CG 3.4Å; T61-E64 PolarHBondContact OG1-N 3.47Å; T61-E64 VanDerWaalsContact OG1-N 3.13Å; T61-E64 PolarHBondContact OG1-OE2 3.07Å; T61-R65 PolarHBondContact O-N 2.63Å
62	T	84	Confident	78	Confident	108 Å²	108	74.7 Å²	74.7	66%	0.663	36%	0.362	S	S	*	.	H	α-helix	trans	-65.3	-33.5	171.2	39.1	0	0	0	0	112.5	R65 Q66	T62-R65 PolarHBondContact O-N 2.87Å; T62-Q66 WeakPolarHBondContact O-CB 3.45Å; T62-Q66 WeakPolarHBondContact O-CG 3.34Å; T62-Q66 PolarHBondContact O-N 3.44Å
63	E	82.2	Confident	80.9	Confident	108 Å²	108	72.8 Å²	72.8	51%	0.505	34%	0.337	S	S	.	.	H	α-helix	trans	-72.5	-42.4	-179	-168.3	178.5	172.6	0	0	112	T61 R65 Q66 K67	T61-E63 VanDerWaalsContact C-N 3.3Å; E63-R65 VanDerWaalsContact C-N 3.32Å; E63-R65 PolarHBondContact O-N 3.37Å; E63-Q66 PolarHBondContact O-N 3.41Å; E63-K67 HydrophobicContact CG-CD 4.02Å; E63-K67 HydrophobicContact CG-CG 4.49Å; E63-K67 WeakPolarHBondContact O-CB 3.44Å; E63-K67 WeakPolarHBondContact O-CG 3.3Å; E63-K67 PolarHBondContact O-N 2.79Å; E63-K67 WeakPolarHBondContact OE1-CE 3.13Å; E63-K67 IonicContact OE1-NZ 2.62Å; E63-K67 PolarHBondContact OE1-NZ 2.83Å
64	E	83.9	Confident	83.4	Confident	50 Å²	50	69.3 Å²	69.3	23%	0.234	33%	0.328	C	S	.	.	H	α-helix	trans	-60.2	-43.1	171.5	-71	160.2	131.7	0	0	111.2	T61 K67 R68 I69 C71	T61-E64 VanDerWaalsContact CB-OE2 3.31Å; T61-E64 WeakPolarHBondContact CB-OE2 3Å; T61-E64 WeakPolarHBondContact CG2-OE2 3.38Å; T61-E64 PolarHBondContact N-OE2 3.13Å; T61-E64 WeakPolarHBondContact OG1-CB 3.31Å; T61-E64 VanDerWaalsContact OG1-CD 3.27Å; T61-E64 VanDerWaalsContact OG1-CG 3.26Å; T61-E64 WeakPolarHBondContact OG1-CG 3.4Å; T61-E64 PolarHBondContact OG1-N 3.47Å; T61-E64 VanDerWaalsContact OG1-N 3.13Å; T61-E64 PolarHBondContact OG1-OE2 3.07Å; E64-K67 PolarHBondContact O-N 2.81Å; E64-R68 PolarHBondContact O-N 3.21Å; E64-I69 HydrophobicContact CB-CB 4.14Å; E64-I69 HydrophobicContact CG-CB 4.3Å; E64-I69 HydrophobicContact CG-CG2 4.38Å; E64-I69 PolarHBondContact O-N 3.23Å; E64-C71 HydrophobicContact CB-CB 4.29Å
65	R	84.9	Confident	85.4	Confident	112 Å²	112	69.8 Å²	69.8	42%	0.423	33%	0.329	S	S	.	.	H	α-helix	trans	-58.7	-46.5	174.3	-88.9	174.8	163.6	175.5	-6.5	112.5	C60 T61 T62 E63 R68 E73 L95	C60-R65 HydrophobicContact CB-CG 4.3Å; T61-R65 PolarHBondContact O-N 2.63Å; T62-R65 PolarHBondContact O-N 2.87Å; E63-R65 VanDerWaalsContact C-N 3.32Å; E63-R65 PolarHBondContact O-N 3.37Å; R65-R68 PolarHBondContact O-N 2.95Å; R65-E73 IonicContact CZ-OE1 3.69Å; R65-E73 IonicContact NH2-OE1 2.63Å; R65-E73 PolarHBondContact NH2-OE1 2.03Å; R65-L95 HydrophobicContact CG-CD2 3.57Å; R65-L95 VanDerWaalsContact NE-CD2 3.27Å
66	Q	84.4	Confident	87	Confident	164 Å²	164	67.3 Å²	67.3	77%	0.766	32%	0.317	S	S	*	.	H	α-helix	trans	-68.3	-42.2	179	-76.8	176.6	-21.8	0	0	112.6	T62 E63 R68	T62-Q66 WeakPolarHBondContact O-CB 3.45Å; T62-Q66 WeakPolarHBondContact O-CG 3.34Å; T62-Q66 PolarHBondContact O-N 3.44Å; E63-Q66 PolarHBondContact O-N 3.41Å; Q66-R68 PolarHBondContact O-N 3.18Å
67	K	82.3	Confident	87.3	Confident	131 Å²	131	68.2 Å²	68.2	57%	0.57	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	3.5	177.5	-67.6	-179.4	175.3	174.6	0	113.8	E63 E64 I69	E63-K67 HydrophobicContact CG-CD 4.02Å; E63-K67 HydrophobicContact CG-CG 4.49Å; E63-K67 WeakPolarHBondContact O-CB 3.44Å; E63-K67 WeakPolarHBondContact O-CG 3.3Å; E63-K67 PolarHBondContact O-N 2.79Å; E63-K67 WeakPolarHBondContact OE1-CE 3.13Å; E63-K67 IonicContact OE1-NZ 2.62Å; E63-K67 PolarHBondContact OE1-NZ 2.83Å; E64-K67 PolarHBondContact O-N 2.81Å; K67-I69 HydrophobicContact CB-CD1 3.8Å; K67-I69 HydrophobicContact CB-CG1 3.85Å; K67-I69 HydrophobicContact CD-CD1 4.25Å; K67-I69 PolarHBondContact O-N 3.36Å
68	R	84.9	Confident	87.4	Confident	183 Å²	183	75.2 Å²	75.2	69%	0.691	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	37.2	-175.8	-61.8	-174.5	177.4	-173.2	-1.7	113.6	E64 R65 Q66 H160	E64-R68 PolarHBondContact O-N 3.21Å; R65-R68 PolarHBondContact O-N 2.95Å; Q66-R68 PolarHBondContact O-N 3.18Å; R68-H160 PolarHBondContact O-CE1 2.77Å
69	I	84.9	Confident	87.6	Confident	39 Å²	39	77.9 Å²	77.9	20%	0.2	37%	0.37	C	S	.	.			trans	-83.9	141.2	175.3	-59.2	173.6	0	0	0	108.5	E64 K67 N96 P161	E64-I69 HydrophobicContact CB-CB 4.14Å; E64-I69 HydrophobicContact CG-CB 4.3Å; E64-I69 HydrophobicContact CG-CG2 4.38Å; E64-I69 PolarHBondContact O-N 3.23Å; K67-I69 HydrophobicContact CB-CD1 3.8Å; K67-I69 HydrophobicContact CB-CG1 3.85Å; K67-I69 HydrophobicContact CD-CD1 4.25Å; K67-I69 PolarHBondContact O-N 3.36Å; I69-N96 PolarHBondContact O-ND2 3.49Å; I69-P161 HydrophobicContact CG2-CG 4.03Å
70	Q	90.7	Very high	87.8	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	35%	0.349	C	S	.	.			trans	-66.3	131.5	178.3	79.8	-175.4	8.1	0	0	111.9	L95 N96 H98 T153 H160 P161 L163	Q70-L95 WeakPolarHBondContact CA-O 3.4Å; Q70-N96 WeakPolarHBondContact CA-O 3.06Å; Q70-N96 WeakPolarHBondContact CB-O 3.08Å; Q70-H98 VanDerWaalsContact OE1-N 3.09Å; Q70-T153 PolarHBondContact NE2-O 3.08Å; Q70-H160 HydrophobicContact CG-CB 4.03Å; Q70-P161 PolarHBondContact NE2-O 3.33Å; Q70-L163 HydrophobicContact CG-CD1 4.19Å; Q70-L163 HydrophobicContact CG-CG 4.44Å
71	C	90.8	Very high	87.9	Confident	2 Å²	2	73.5 Å²	73.5	1%	0.014	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	163	-177.4	58.5	0	0	0	0	111.5	C60 E64 E73 V94 L95	C60-C71 HydrophobicContact CB-CB 3.88Å; C60-C71 WeakPolarHBondContact CB-SG 3.42Å; C60-C71 WeakPolarHBondContact SG-CB 3.04Å; C60-C71 PolarHBondContact SG-O 3.18Å; C60-C71 CovalentContact SG-SG 2.03Å; C60-C71 PolarHBondContact SG-SG 3.1Å; E64-C71 HydrophobicContact CB-CB 4.29Å; C71-E73 PolarHBondContact O-N 2.86Å; C71-V94 CarbonylContact O-C 3.59Å; C71-V94 WeakPolarHBondContact O-CA 3.36Å; C71-L95 PolarHBondContact N-O 2.8Å; C71-L95 VanDerWaalsContact N-O 3.08Å; C71-L95 PolarHBondContact O-N 3.49Å
72	F	92.5	Very high	88.1	Confident	1 Å²	1	71.5 Å²	71.5	0%	0.004	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	120.9	178.9	-71.7	-51.7	0	0	0	112.3	R59 C60 L75 C92 V93 V94 V152 L163 R165	R59-F72 CarbonylContact C-O 3.59Å; R59-F72 VanDerWaalsContact CA-O 3.29Å; R59-F72 WeakPolarHBondContact CA-O 3.35Å; R59-F72 WeakPolarHBondContact CG-O 3.42Å; C60-F72 PolarHBondContact N-O 3.45Å; C60-F72 VanDerWaalsContact SG-C 3.52Å; C60-F72 PolarHBondContact SG-O 3.25Å; C60-F72 VanDerWaalsContact SG-O 3.37Å; F72-L75 HydrophobicContact CB-CD2 3.53Å; F72-L75 HydrophobicContact CB-CG 4.48Å; F72-L75 HydrophobicContact CD2-CD2 3.48Å; F72-L75 VanDerWaalsContact CD2-CD2 3.48Å; F72-L75 HydrophobicContact CE2-CD2 4.33Å; F72-L75 HydrophobicContact CG-CD2 3.71Å; F72-C92 WeakPolarHBondContact CE1-SG 3.37Å; F72-V93 CarbonylContact C-O 3.55Å; F72-V93 WeakPolarHBondContact CA-O 3.23Å; F72-V94 HydrophobicContact CD1-CG2 3.96Å; F72-V94 HydrophobicContact CE1-CG2 4Å; F72-V152 HydrophobicContact CE1-CG2 3.84Å; F72-V152 HydrophobicContact CZ-CG2 4.25Å; F72-L163 HydrophobicContact CD1-CD1 4.31Å; F72-L163 HydrophobicContact CD2-CB 4.27Å; F72-L163 HydrophobicContact CE1-CB 4.13Å; F72-L163 HydrophobicContact CE1-CD1 4.37Å; F72-L163 HydrophobicContact CE2-CB 3.72Å; F72-L163 HydrophobicContact CG-CD1 4.46Å; F72-L163 HydrophobicContact CZ-CB 3.63Å; F72-R165 HydrophobicContact CD2-CB 4.45Å; F72-R165 HydrophobicContact CE2-CB 3.84Å; F72-R165 HydrophobicContact CZ-CB 4.37Å
73	E	91.8	Very high	88.3	Confident	54 Å²	54	67.2 Å²	67.2	25%	0.252	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	-32.5	172.1	179.5	144.3	-107.4	0	0	112.6	R59 R65 C71 V93 L95	R59-E73 VanDerWaalsContact CZ-O 3.23Å; R59-E73 PolarHBondContact NE-O 2.86Å; R59-E73 PolarHBondContact NH2-O 3.27Å; R65-E73 IonicContact CZ-OE1 3.69Å; R65-E73 IonicContact NH2-OE1 2.63Å; R65-E73 PolarHBondContact NH2-OE1 2.03Å; C71-E73 PolarHBondContact O-N 2.86Å; E73-V93 HydrophobicContact CB-CB 4.38Å; E73-V93 HydrophobicContact CB-CG1 4.15Å; E73-V93 PolarHBondContact N-O 3.19Å; E73-L95 HydrophobicContact CB-CB 4.11Å
74	V	91.2	Very high	88.5	Confident	38 Å²	38	65.7 Å²	65.7	23%	0.23	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	133.7	173.1	-173.8	0	0	0	0	108.7	Q91 V93	V74-Q91 HydrophobicContact CG1-CB 4.14Å; V74-V93 HydrophobicContact CB-CB 3.87Å; V74-V93 HydrophobicContact CB-CG2 3.79Å; V74-V93 HydrophobicContact CG2-CB 4Å; V74-V93 HydrophobicContact CG2-CG2 3.9Å; V74-V93 PolarHBondContact N-O 2.82Å; V74-V93 PolarHBondContact O-N 2.78Å; V74-V93 VanDerWaalsContact O-N 3.08Å
75	L	91.3	Very high	88.6	Confident	47 Å²	47	65 Å²	65	25%	0.246	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-102.3	150.3	176.3	-58.4	172.6	0	0	0	109	R59 F72 Q91 R165	R59-L75 HydrophobicContact CB-CD1 4.27Å; F72-L75 HydrophobicContact CB-CD2 3.53Å; F72-L75 HydrophobicContact CB-CG 4.48Å; F72-L75 HydrophobicContact CD2-CD2 3.48Å; F72-L75 VanDerWaalsContact CD2-CD2 3.48Å; F72-L75 HydrophobicContact CE2-CD2 4.33Å; F72-L75 HydrophobicContact CG-CD2 3.71Å; L75-Q91 CarbonylContact C-O 3.5Å; L75-R165 HydrophobicContact CB-CG 4.36Å; L75-R165 HydrophobicContact CD2-CB 4.22Å; L75-R165 HydrophobicContact CD2-CG 4.04Å
76	P	91.7	Very high	88.7	Confident	11 Å²	11	64.7 Å²	64.7	7%	0.071	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-64.5	158.7	166.6	27.9	-33.9	0	0	0	110.6	Y80 Q91 W103 R165 T167	P76-Y80 HydrophobicContact CB-CE2 4.28Å; P76-Q91 VanDerWaalsContact CA-O 3.23Å; P76-Q91 WeakPolarHBondContact CA-O 3.38Å; P76-Q91 VanDerWaalsContact CB-O 3.26Å; P76-Q91 WeakPolarHBondContact CB-O 3.43Å; P76-Q91 WeakPolarHBondContact CD-O 3.49Å; P76-W103 HydrophobicContact CB-CH2 4.27Å; P76-W103 HydrophobicContact CG-CH2 4.25Å; P76-R165 HydrophobicContact CG-CG 3.83Å; P76-T167 HydrophobicContact CB-CG2 3.98Å; P76-T167 HydrophobicContact CG-CG2 4.11Å
77	S	90.5	Very high	89	Confident	64 Å²	64	60.2 Å²	60.2	45%	0.448	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-64.5	163.1	170.4	-56.9	0	0	0	0	110.9	Y80 T167	S77-Y80 PolarHBondContact N-OH 2.85Å; S77-Y80 VanDerWaalsContact N-OH 3.14Å; S77-T167 WeakPolarHBondContact O-CB 3.23Å; S77-T167 PolarHBondContact O-OG1 2.97Å
78	E	87.5	Confident	89.6	Confident	166 Å²	166	54.1 Å²	54.1	78%	0.776	28%	0.284	S	S	*	.	S	Bend	trans	-73.6	-34.8	-179.5	-60.3	-169.2	144	0	0	112.3	Y168	E78-Y168 PolarHBondContact O-N 2.89Å
79	Q	89.9	Confident	90	Very high	113 Å²	113	48.9 Å²	48.9	53%	0.528	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	138.2	175.8	-178.2	171.9	-10.3	0	0	110.3	Y168 E170	Q79-Y168 CarbonylContact C-O 3.53Å; Q79-Y168 WeakPolarHBondContact CA-O 3.46Å; Q79-E170 PolarHBondContact NE2-OE2 3.3Å
80	Y	90.9	Very high	90.4	Very high	35 Å²	35	47 Å²	47	14%	0.137	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	122	168.5	-66.9	-99.5	0	0	0	108.1	P76 S77 V88 M90 T167 Y168 E170	P76-Y80 HydrophobicContact CB-CE2 4.28Å; S77-Y80 PolarHBondContact N-OH 2.85Å; S77-Y80 VanDerWaalsContact N-OH 3.14Å; Y80-V88 HydrophobicContact CD1-CG2 3.75Å; Y80-V88 HydrophobicContact CE1-CG2 4.46Å; Y80-V88 HydrophobicContact CG-CG2 3.97Å; Y80-M90 HydrophobicContact CD2-CG 3.94Å; Y80-M90 HydrophobicContact CE2-CB 4.33Å; Y80-M90 HydrophobicContact CE2-CG 3.8Å; Y80-M90 HydrophobicContact CG-CG 4.47Å; Y80-T167 WeakPolarHBondContact CD2-OG1 3.27Å; Y80-T167 WeakPolarHBondContact CE2-OG1 3.32Å; Y80-Y168 PolarHBondContact N-O 2.85Å; Y80-E170 PolarHBondContact O-N 2.74Å
81	A	89.5	Confident	90.5	Very high	47 Å²	47	51.7 Å²	51.7	39%	0.388	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	112.6	175.7	0	0	0	0	0	109.4	E170 L172	A81-E170 WeakPolarHBondContact CA-O 3.29Å; A81-E170 HydrophobicContact CB-CB 4.36Å; A81-L172 HydrophobicContact CB-CD1 3.98Å; A81-L172 HydrophobicContact CB-CD2 4.34Å; A81-L172 HydrophobicContact CB-CG 4.22Å
82	I	91.1	Very high	90.6	Very high	29 Å²	29	51.6 Å²	51.6	15%	0.149	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	131.2	-162.6	-58.8	-68.9	0	0	0	109.8	H86 V88 V140 L169 E170 V171 L172	I82-H86 HydrophobicContact CG2-CB 3.79Å; I82-V88 HydrophobicContact CD1-CB 4.25Å; I82-V88 HydrophobicContact CD1-CG2 4.02Å; I82-V88 HydrophobicContact CG1-CB 3.95Å; I82-V88 HydrophobicContact CG1-CG2 3.81Å; I82-V88 HydrophobicContact CG2-CB 4.49Å; I82-V140 HydrophobicContact CG2-CB 4.36Å; I82-V140 HydrophobicContact CG2-CG1 4.48Å; I82-V140 HydrophobicContact CG2-CG2 4.26Å; I82-L169 HydrophobicContact CB-CD1 4.25Å; I82-L169 HydrophobicContact CG1-CD1 3.92Å; I82-E170 PolarHBondContact N-O 3.37Å; I82-V171 WeakPolarHBondContact O-CA 3.38Å; I82-L172 PolarHBondContact O-N 2.88Å
83	P	87.1	Confident	90.7	Very high	18 Å²	18	52.3 Å²	52.3	12%	0.117	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	149	176.6	-15.4	28.2	0	0	0	112.7	G85 H86 L172 I295	P83-G85 PolarHBondContact O-N 2.79Å; P83-H86 WeakPolarHBondContact O-CB 3.38Å; P83-H86 PolarHBondContact O-N 3.49Å; P83-H86 VanDerWaalsContact O-N 3.1Å; P83-L172 WeakPolarHBondContact CA-O 3.12Å; P83-I295 HydrophobicContact CG-CB 4.42Å; P83-I295 HydrophobicContact CG-CD1 3.84Å; P83-I295 HydrophobicContact CG-CG2 3.93Å
84	L	87.5	Confident	90.7	Very high	76 Å²	76	49.8 Å²	49.8	40%	0.398	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.5	137.4	172.3	-163.4	78.7	0	0	0	111.4	H86 V140 R142 V171 L172	L84-H86 PolarHBondContact O-N 2.91Å; L84-H86 PolarHBondContact O-ND1 2.92Å; L84-V140 WeakPolarHBondContact CA-O 3.47Å; L84-V140 WeakPolarHBondContact CD1-O 3.23Å; L84-R142 HydrophobicContact CD1-CB 4.3Å; L84-R142 VanDerWaalsContact CD1-N 3.34Å; L84-V171 HydrophobicContact CB-CG1 4.46Å; L84-V171 HydrophobicContact CD1-CG1 3.87Å; L84-L172 PolarHBondContact N-O 2.72Å
85	G	84.5	Confident	90.7	Very high	36 Å²	36	50 Å²	50	37%	0.371	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.6	-4	-179.4	0	0	0	0	0	116	P83 D139 V140	P83-G85 PolarHBondContact O-N 2.79Å; G85-D139 WeakPolarHBondContact CA-OD1 3.36Å; G85-V140 PolarHBondContact N-O 3.47Å
86	H	87.9	Confident	90.5	Very high	104 Å²	104	49.9 Å²	49.9	48%	0.481	27%	0.273	S	S	.	.			trans	-82.7	172.5	176.1	-69.4	53.4	0	0	0	111.5	I82 P83 L84 D139 V140	I82-H86 HydrophobicContact CG2-CB 3.79Å; P83-H86 WeakPolarHBondContact O-CB 3.38Å; P83-H86 PolarHBondContact O-N 3.49Å; P83-H86 VanDerWaalsContact O-N 3.1Å; L84-H86 PolarHBondContact O-N 2.91Å; L84-H86 PolarHBondContact O-ND1 2.92Å; H86-D139 PolarHBondContact O-N 2.75Å; H86-V140 WeakPolarHBondContact O-CB 3.27Å; H86-V140 VanDerWaalsContact O-CG2 3.27Å; H86-V140 WeakPolarHBondContact O-CG2 3.17Å; H86-V140 PolarHBondContact O-N 3.32Å
87	T	91.1	Very high	90.3	Very high	71 Å²	71	52.1 Å²	52.1	44%	0.436	28%	0.282	S	S	.	.			trans	-106.7	135.8	177.7	-63	0	0	0	0	110.5	Q136 I137 T138	T87-Q136 HydrophobicContact CG2-CG 3.6Å; T87-I137 WeakPolarHBondContact CA-O 3.44Å; T87-T138 HydrophobicContact CG2-CG2 4.04Å
88	V	93.7	Very high	90.1	Very high	3 Å²	3	54 Å²	54	2%	0.018	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	141.2	176.5	65.6	0	0	0	0	111.5	Y80 I82 M90 Q136 I137 V140 L169	Y80-V88 HydrophobicContact CD1-CG2 3.75Å; Y80-V88 HydrophobicContact CE1-CG2 4.46Å; Y80-V88 HydrophobicContact CG-CG2 3.97Å; I82-V88 HydrophobicContact CD1-CB 4.25Å; I82-V88 HydrophobicContact CD1-CG2 4.02Å; I82-V88 HydrophobicContact CG1-CB 3.95Å; I82-V88 HydrophobicContact CG1-CG2 3.81Å; I82-V88 HydrophobicContact CG2-CB 4.49Å; V88-M90 HydrophobicContact CG1-CE 4.45Å; V88-M90 HydrophobicContact CG2-CG 4.28Å; V88-Q136 VanDerWaalsContact O-CA 3.28Å; V88-Q136 WeakPolarHBondContact O-CA 3.35Å; V88-I137 HydrophobicContact CG1-CB 3.88Å; V88-I137 HydrophobicContact CG1-CG1 4.47Å; V88-I137 PolarHBondContact N-O 3.42Å; V88-I137 PolarHBondContact O-N 2.82Å; V88-V140 HydrophobicContact CB-CG2 4.33Å; V88-V140 HydrophobicContact CG1-CG2 3.76Å; V88-L169 HydrophobicContact CB-CD1 4.46Å; V88-L169 HydrophobicContact CG1-CD1 4.18Å; V88-L169 HydrophobicContact CG1-CD2 4.2Å; V88-L169 HydrophobicContact CG2-CD1 4.23Å
89	N	94.2	Very high	89.9	Confident	72 Å²	72	46.4 Å²	46.4	39%	0.385	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	95.1	177.4	-69.2	-31.8	0	0	0	109.9	Q91 T134 Q136	N89-Q91 PolarHBondContact O-N 3.01Å; N89-T134 HydrophobicContact CB-CG2 4.06Å; N89-Q136 WeakPolarHBondContact OD1-CB 3.36Å; N89-Q136 WeakPolarHBondContact OD1-CG 3.49Å; N89-Q136 PolarHBondContact OD1-NE2 2.79Å
90	M	94	Very high	89.8	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	101.4	175.8	-67.6	178.9	-81.2	0	0	109.2	Y80 V88 W103 T134 L135 I137 Y148 T167	Y80-M90 HydrophobicContact CD2-CG 3.94Å; Y80-M90 HydrophobicContact CE2-CB 4.33Å; Y80-M90 HydrophobicContact CE2-CG 3.8Å; Y80-M90 HydrophobicContact CG-CG 4.47Å; V88-M90 HydrophobicContact CG1-CE 4.45Å; V88-M90 HydrophobicContact CG2-CG 4.28Å; M90-W103 HydrophobicContact CB-CH2 3.7Å; M90-W103 HydrophobicContact CB-CZ2 4.36Å; M90-W103 HydrophobicContact CB-CZ3 4.17Å; M90-W103 WeakPolarHBondContact O-CH2 3.13Å; M90-W103 WeakPolarHBondContact O-CZ2 3.48Å; M90-T134 CarbonylContact O-C 3.52Å; M90-T134 WeakPolarHBondContact O-CA 3.36Å; M90-L135 HydrophobicContact CB-CB 4.47Å; M90-L135 HydrophobicContact CE-CD2 3.79Å; M90-L135 HydrophobicContact CE-CG 4.06Å; M90-L135 PolarHBondContact N-O 3.14Å; M90-L135 PolarHBondContact O-N 2.85Å; M90-I137 HydrophobicContact CE-CD1 3.6Å; M90-I137 HydrophobicContact CE-CG1 4.16Å; M90-Y148 HydrophobicContact CE-CD1 3.85Å; M90-Y148 HydrophobicContact CE-CD2 4.18Å; M90-Y148 HydrophobicContact CE-CE1 4Å; M90-Y148 HydrophobicContact CE-CE2 4.36Å; M90-Y148 HydrophobicContact CE-CG 3.95Å; M90-Y148 HydrophobicContact SD-CD1 4.43Å; M90-Y148 HydrophobicContact SD-CD2 4.06Å; M90-Y148 HydrophobicContact SD-CG 3.95Å; M90-T167 HydrophobicContact CG-CG2 4.49Å; M90-T167 HydrophobicContact SD-CG2 3.9Å
91	Q	92.6	Very high	89.8	Confident	98 Å²	98	46.1 Å²	46.1	46%	0.458	25%	0.248	S	C	.	.			trans	-69.9	140.7	-171.2	-68.6	-176.6	-7.2	0	0	112.4	V74 L75 P76 N89 T134	V74-Q91 HydrophobicContact CG1-CB 4.14Å; L75-Q91 CarbonylContact C-O 3.5Å; P76-Q91 VanDerWaalsContact CA-O 3.23Å; P76-Q91 WeakPolarHBondContact CA-O 3.38Å; P76-Q91 VanDerWaalsContact CB-O 3.26Å; P76-Q91 WeakPolarHBondContact CB-O 3.43Å; P76-Q91 WeakPolarHBondContact CD-O 3.49Å; N89-Q91 PolarHBondContact O-N 3.01Å; Q91-T134 WeakPolarHBondContact CA-OG1 3.28Å; Q91-T134 HydrophobicContact CG-CG2 4.35Å
92	C	92.9	Very high	89.9	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.234	C	C	.	.			trans	-152.7	126.2	166.9	-172.7	0	0	0	0	108.3	F72 W103 H133 C150	F72-C92 WeakPolarHBondContact CE1-SG 3.37Å; C92-W103 HydrophobicContact CB-CH2 4.21Å; C92-W103 HydrophobicContact CB-CZ2 3.44Å; C92-W103 VanDerWaalsContact CB-CZ2 3.44Å; C92-H133 CarbonylContact O-C 3.37Å; C92-H133 PolarHBondContact O-N 3.47Å; C92-C150 HydrophobicContact CB-CB 3.77Å; C92-C150 WeakPolarHBondContact CB-SG 3.26Å; C92-C150 WeakPolarHBondContact SG-CB 3.48Å; C92-C150 CovalentContact SG-SG 2.05Å; C92-C150 PolarHBondContact SG-SG 2.82Å
93	V	93.6	Very high	90	Very high	16 Å²	16	43.4 Å²	43.4	10%	0.097	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	134.1	-179.2	-174.2	0	0	0	0	109.5	F72 E73 V74 G131 E132	F72-V93 CarbonylContact C-O 3.55Å; F72-V93 WeakPolarHBondContact CA-O 3.23Å; E73-V93 HydrophobicContact CB-CB 4.38Å; E73-V93 HydrophobicContact CB-CG1 4.15Å; E73-V93 PolarHBondContact N-O 3.19Å; V74-V93 HydrophobicContact CB-CB 3.87Å; V74-V93 HydrophobicContact CB-CG2 3.79Å; V74-V93 HydrophobicContact CG2-CB 4Å; V74-V93 HydrophobicContact CG2-CG2 3.9Å; V74-V93 PolarHBondContact N-O 2.82Å; V74-V93 PolarHBondContact O-N 2.78Å; V74-V93 VanDerWaalsContact O-N 3.08Å; V93-G131 CarbonylContact C-O 3.5Å; V93-G131 WeakPolarHBondContact CA-O 3.38Å; V93-E132 HydrophobicContact CG1-CG 3.89Å; V93-E132 HydrophobicContact CG2-CB 4.28Å; V93-E132 HydrophobicContact CG2-CG 3.97Å
94	V	91.8	Very high	90.2	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.006	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	108	-169.1	-173.5	0	0	0	0	110.4	C71 F72 Q97 V101 G131 V152 L163	C71-V94 CarbonylContact O-C 3.59Å; C71-V94 WeakPolarHBondContact O-CA 3.36Å; F72-V94 HydrophobicContact CD1-CG2 3.96Å; F72-V94 HydrophobicContact CE1-CG2 4Å; V94-Q97 HydrophobicContact CB-CB 4.26Å; V94-Q97 HydrophobicContact CB-CG 4.4Å; V94-Q97 HydrophobicContact CG1-CB 3.87Å; V94-Q97 HydrophobicContact CG1-CG 4.01Å; V94-V101 HydrophobicContact CG2-CG2 3.97Å; V94-G131 PolarHBondContact N-O 2.99Å; V94-G131 WeakPolarHBondContact O-CA 3.11Å; V94-V152 HydrophobicContact CG1-CG1 4.41Å; V94-V152 HydrophobicContact CG1-CG2 4.32Å; V94-V152 HydrophobicContact CG2-CG2 3.73Å; V94-L163 HydrophobicContact CG1-CD1 4.03Å
95	L	90.6	Very high	90.3	Very high	44 Å²	44	41.3 Å²	41.3	23%	0.23	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	146.7	176.8	-173.9	62	0	0	0	110.5	R65 Q70 C71 E73 Q97	R65-L95 HydrophobicContact CG-CD2 3.57Å; R65-L95 VanDerWaalsContact NE-CD2 3.27Å; Q70-L95 WeakPolarHBondContact CA-O 3.4Å; C71-L95 PolarHBondContact N-O 2.8Å; C71-L95 VanDerWaalsContact N-O 3.08Å; C71-L95 PolarHBondContact O-N 3.49Å; E73-L95 HydrophobicContact CB-CB 4.11Å; L95-Q97 PolarHBondContact O-N 2.86Å
96	N	87.6	Confident	90.3	Very high	44 Å²	44	43.6 Å²	43.6	24%	0.235	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	41.1	-173.9	-50.4	-48.4	0	0	0	112.6	I69 Q70 H98	I69-N96 PolarHBondContact O-ND2 3.49Å; Q70-N96 WeakPolarHBondContact CA-O 3.06Å; Q70-N96 WeakPolarHBondContact CB-O 3.08Å; N96-H98 PolarHBondContact O-CD2 2.97Å; N96-H98 PolarHBondContact O-N 2.93Å
97	Q	88.5	Confident	90	Very high	58 Å²	58	48.1 Å²	48.1	27%	0.271	23%	0.231	S	C	.	.			trans	-62.1	117.9	-176.1	-172.8	-162.9	-35.2	0	0	111.7	V94 L95 G99 V101 H133	V94-Q97 HydrophobicContact CB-CB 4.26Å; V94-Q97 HydrophobicContact CB-CG 4.4Å; V94-Q97 HydrophobicContact CG1-CB 3.87Å; V94-Q97 HydrophobicContact CG1-CG 4.01Å; L95-Q97 PolarHBondContact O-N 2.86Å; Q97-G99 VanDerWaalsContact CG-O 3.3Å; Q97-G99 WeakPolarHBondContact CG-O 3.48Å; Q97-G99 PolarHBondContact NE2-O 3.04Å; Q97-V101 HydrophobicContact CG-CG2 4.12Å; Q97-H133 PolarHBondContact OE1-NE2 3.5Å
98	H	85.7	Confident	89.5	Confident	104 Å²	104	49 Å²	49	48%	0.481	23%	0.232	S	C	.	.			trans	-113.8	-28.1	170.9	-76.4	-82	0	0	0	112.7	Q70 N96 V155 H160	Q70-H98 VanDerWaalsContact OE1-N 3.09Å; N96-H98 PolarHBondContact O-CD2 2.97Å; N96-H98 PolarHBondContact O-N 2.93Å; H98-V155 HydrophobicContact CB-CG2 4.07Å; H98-H160 WeakPolarHBondContact CB-CD2 3.5Å; H98-H160 AromaticContact CD2-CD2 3.55Å; H98-H160 AromaticContact CD2-CE1 3.55Å; H98-H160 AromaticContact CD2-NE2 3.1Å; H98-H160 PolarHBondContact CD2-NE2 3.08Å; H98-H160 AromaticContact CG-CD2 3.45Å; H98-H160 VanDerWaalsContact CG-CD2 3.45Å; H98-H160 AromaticContact CG-NE2 3.36Å; H98-H160 AromaticContact ND1-NE2 3.91Å; H98-H160 AromaticContact NE2-NE2 3.57Å
99	G	84.2	Confident	89.1	Confident	5 Å²	5	53.1 Å²	53.1	5%	0.052	25%	0.253	C	S	.	.	S	Bend	trans	-84	170.9	174	0	0	0	0	0	113.8	Q97 T153	Q97-G99 VanDerWaalsContact CG-O 3.3Å; Q97-G99 WeakPolarHBondContact CG-O 3.48Å; Q97-G99 PolarHBondContact NE2-O 3.04Å; G99-T153 WeakPolarHBondContact CA-O 3.36Å; G99-T153 WeakPolarHBondContact CA-OG1 3.34Å
100	K	87.4	Confident	88.8	Confident	133 Å²	133	50.2 Å²	50.2	58%	0.578	24%	0.238	S	C	*	.			trans	-84.9	142.7	172.6	-59.2	-173.3	178.4	-175.7	0	110	Y112 V152 T153	K100-Y112 HydrophobicContact CB-CD1 3.42Å; K100-Y112 VanDerWaalsContact CB-CD1 3.42Å; K100-Y112 HydrophobicContact CB-CE1 3.38Å; K100-Y112 HydrophobicContact CB-CG 4.24Å; K100-Y112 HydrophobicContact CD-CD1 4.28Å; K100-Y112 HydrophobicContact CD-CD2 4.48Å; K100-Y112 HydrophobicContact CD-CE1 4.41Å; K100-Y112 HydrophobicContact CD-CG 4.32Å; K100-Y112 HydrophobicContact CG-CD1 4.47Å; K100-V152 WeakPolarHBondContact O-CA 3.28Å; K100-T153 HydrophobicContact CB-CG2 4.37Å; K100-T153 PolarHBondContact N-OG1 2.78Å; K100-T153 PolarHBondContact O-N 3.33Å
101	V	90.3	Very high	88.3	Confident	9 Å²	9	51.3 Å²	51.3	6%	0.055	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	131.7	-178.7	-175.2	0	0	0	0	109.6	V94 Q97 Y112 H133 Q151 V152	V94-V101 HydrophobicContact CG2-CG2 3.97Å; Q97-V101 HydrophobicContact CG-CG2 4.12Å; V101-Y112 WeakPolarHBondContact O-CD1 3.43Å; V101-H133 HydrophobicContact CB-CB 4.37Å; V101-H133 HydrophobicContact CG1-CB 3.72Å; V101-Q151 WeakPolarHBondContact CA-O 3.19Å; V101-V152 HydrophobicContact CG1-CG2 4.27Å; V101-V152 HydrophobicContact CG2-CB 4.43Å; V101-V152 HydrophobicContact CG2-CG1 3.92Å; V101-V152 HydrophobicContact CG2-CG2 3.92Å
102	Q	91.2	Very high	87.9	Confident	20 Å²	20	51.9 Å²	51.9	9%	0.093	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	162.3	176.8	63.6	177.8	7.8	0	0	110.5	G111 Y112 Q151	Q102-G111 WeakPolarHBondContact CA-O 3.47Å; Q102-G111 WeakPolarHBondContact CB-O 3.34Å; Q102-Y112 HydrophobicContact CB-CD1 3.79Å; Q102-Y112 HydrophobicContact CB-CE1 3.77Å; Q102-Y112 HydrophobicContact CG-CD1 4.45Å; Q102-Y112 HydrophobicContact CG-CE1 3.91Å; Q102-Y112 PolarHBondContact OE1-OH 2.81Å; Q102-Q151 HydrophobicContact CG-CB 4.01Å; Q102-Q151 PolarHBondContact N-O 3.28Å; Q102-Q151 PolarHBondContact O-N 2.79Å; Q102-Q151 VanDerWaalsContact O-O 3.14Å
103	W	93.5	Very high	87.5	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	143.7	170.9	-78.8	84.5	0	0	0	111.4	P76 M90 C92 L110 H133 L135 E149 C150 T167	P76-W103 HydrophobicContact CB-CH2 4.27Å; P76-W103 HydrophobicContact CG-CH2 4.25Å; M90-W103 HydrophobicContact CB-CH2 3.7Å; M90-W103 HydrophobicContact CB-CZ2 4.36Å; M90-W103 HydrophobicContact CB-CZ3 4.17Å; M90-W103 WeakPolarHBondContact O-CH2 3.13Å; M90-W103 WeakPolarHBondContact O-CZ2 3.48Å; C92-W103 HydrophobicContact CB-CH2 4.21Å; C92-W103 HydrophobicContact CB-CZ2 3.44Å; C92-W103 VanDerWaalsContact CB-CZ2 3.44Å; W103-L110 HydrophobicContact CB-CD1 3.88Å; W103-L110 WeakPolarHBondContact O-CB 3.42Å; W103-L110 PolarHBondContact O-N 3.17Å; W103-H133 PolarHBondContact NE1-O 2.78Å; W103-L135 HydrophobicContact CB-CD2 4.08Å; W103-L135 HydrophobicContact CD2-CB 3.67Å; W103-L135 HydrophobicContact CD2-CD2 3.91Å; W103-L135 HydrophobicContact CD2-CG 4.43Å; W103-L135 VanDerWaalsContact CE2-CB 3.47Å; W103-L135 HydrophobicContact CE3-CB 4.21Å; W103-L135 HydrophobicContact CE3-CD2 3.95Å; W103-L135 HydrophobicContact CG-CB 3.96Å; W103-L135 HydrophobicContact CG-CD2 3.99Å; W103-L135 HydrophobicContact CH2-CB 4.36Å; W103-L135 HydrophobicContact CZ2-CB 3.83Å; W103-E149 CarbonylContact C-O 3.35Å; W103-E149 WeakPolarHBondContact CA-O 3.25Å; W103-C150 HydrophobicContact CD2-CB 3.92Å; W103-C150 HydrophobicContact CE3-CB 4Å; W103-C150 HydrophobicContact CH2-CB 3.86Å; W103-C150 HydrophobicContact CZ2-CB 3.77Å; W103-C150 HydrophobicContact CZ3-CB 3.96Å; W103-T167 HydrophobicContact CZ3-CG2 4.03Å
104	R	91.3	Very high	87.2	Confident	42 Å²	42	58.5 Å²	58.5	16%	0.158	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	129.4	160.5	-168.7	175.9	65.4	-113.9	-3.8	108.9	K106 I108 L109 E147 Y148 E149	R104-K106 VanDerWaalsContact CD-O 3.27Å; R104-K106 WeakPolarHBondContact CD-O 3.14Å; R104-K106 PolarHBondContact NE-O 2.81Å; R104-I108 CarbonylContact C-O 3.54Å; R104-I108 VanDerWaalsContact CA-O 3.29Å; R104-I108 WeakPolarHBondContact CA-O 3.49Å; R104-I108 VanDerWaalsContact CG-O 3.29Å; R104-I108 WeakPolarHBondContact CG-O 3.32Å; R104-L109 HydrophobicContact CB-CD2 3.96Å; R104-L109 HydrophobicContact CG-CD2 4.21Å; R104-E147 IonicContact CZ-OE1 3.6Å; R104-E147 IonicContact NH2-OE1 2.71Å; R104-E147 PolarHBondContact NH2-OE1 3.01Å; R104-Y148 CarbonylContact O-C 3.49Å; R104-Y148 VanDerWaalsContact O-CA 3.23Å; R104-Y148 WeakPolarHBondContact O-CA 3.25Å; R104-E149 HydrophobicContact CB-CB 4.22Å; R104-E149 IonicContact CZ-OE1 3.15Å; R104-E149 IonicContact CZ-OE2 2.71Å; R104-E149 PolarHBondContact N-O 3.14Å; R104-E149 VanDerWaalsContact NH1-CD 3.32Å; R104-E149 IonicContact NH1-OE1 3.95Å; R104-E149 IonicContact NH1-OE2 3.3Å; R104-E149 PolarHBondContact NH1-OE2 2.78Å; R104-E149 VanDerWaalsContact NH2-CD 3.26Å; R104-E149 IonicContact NH2-OE1 2.72Å; R104-E149 PolarHBondContact NH2-OE1 3.44Å; R104-E149 VanDerWaalsContact NH2-OE1 3.13Å; R104-E149 IonicContact NH2-OE2 2.74Å; R104-E149 PolarHBondContact NH2-OE2 2.8Å; R104-E149 PolarHBondContact O-N 2.99Å
105	A	89.8	Confident	86.7	Confident	7 Å²	7	62.5 Å²	62.5	6%	0.058	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	115.1	161.3	0	0	0	0	0	108.8	K107 I108 L110 F122 Y148	A105-K107 PolarHBondContact O-N 2.88Å; A105-I108 PolarHBondContact N-O 3.48Å; A105-I108 PolarHBondContact O-N 2.82Å; A105-L110 HydrophobicContact CB-CD1 3.99Å; A105-L110 HydrophobicContact CB-CD2 3.88Å; A105-L110 HydrophobicContact CB-CG 4.05Å; A105-F122 HydrophobicContact CB-CE1 4.24Å; A105-Y148 HydrophobicContact CB-CD1 3.76Å; A105-Y148 HydrophobicContact CB-CE1 3.44Å; A105-Y148 VanDerWaalsContact CB-CE1 3.44Å
106	K	84.3	Confident	86.4	Confident	85 Å²	85	60.8 Å²	60.8	37%	0.37	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.3	-98.3	-176.6	-42.7	-171.5	-164.8	-165.4	0	111.7	R104 D143 A145 E147	R104-K106 VanDerWaalsContact CD-O 3.27Å; R104-K106 WeakPolarHBondContact CD-O 3.14Å; R104-K106 PolarHBondContact NE-O 2.81Å; K106-D143 WeakPolarHBondContact CE-O 3.4Å; K106-D143 PolarHBondContact NZ-O 2.93Å; K106-A145 WeakPolarHBondContact CE-O 3.29Å; K106-A145 PolarHBondContact NZ-O 2.68Å; K106-E147 WeakPolarHBondContact CA-O 3.29Å; K106-E147 PolarHBondContact N-O 2.87Å
107	K	81	Confident	85.7	Confident	198 Å²	198	63.3 Å²	63.3	86%	0.861	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.8	-4.1	177.2	-63.5	-177	179.5	178.1	0	113.6	A105	A105-K107 PolarHBondContact O-N 2.88Å
108	I	82.2	Confident	85	Confident	89 Å²	89	64.6 Å²	64.6	46%	0.456	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	130.5	-172.8	-59.2	174.9	0	0	0	109.9	R104 A105 Y119	R104-I108 CarbonylContact C-O 3.54Å; R104-I108 VanDerWaalsContact CA-O 3.29Å; R104-I108 WeakPolarHBondContact CA-O 3.49Å; R104-I108 VanDerWaalsContact CG-O 3.29Å; R104-I108 WeakPolarHBondContact CG-O 3.32Å; A105-I108 PolarHBondContact N-O 3.48Å; A105-I108 PolarHBondContact O-N 2.82Å; I108-Y119 WeakPolarHBondContact CD1-OH 3.47Å
109	L	85.3	Confident	84.8	Confident	91 Å²	91	63.5 Å²	63.5	48%	0.476	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	125.3	169	-67.2	176.1	0	0	0	109.4	R104 G111	R104-L109 HydrophobicContact CB-CD2 3.96Å; R104-L109 HydrophobicContact CG-CD2 4.21Å; L109-G111 PolarHBondContact O-N 2.82Å
110	L	87.1	Confident	84.7	Confident	10 Å²	10	69.3 Å²	69.3	5%	0.052	38%	0.376	C	S	.	.			trans	-79.6	-4.8	-179.9	-58.9	172.3	0	0	0	112.7	W103 A105 I116 Y119 F122 L135	W103-L110 HydrophobicContact CB-CD1 3.88Å; W103-L110 WeakPolarHBondContact O-CB 3.42Å; W103-L110 PolarHBondContact O-N 3.17Å; A105-L110 HydrophobicContact CB-CD1 3.99Å; A105-L110 HydrophobicContact CB-CD2 3.88Å; A105-L110 HydrophobicContact CB-CG 4.05Å; L110-I116 HydrophobicContact CB-CD1 4.08Å; L110-I116 HydrophobicContact CB-CG1 4.31Å; L110-I116 HydrophobicContact CB-CG2 3.97Å; L110-I116 HydrophobicContact CD1-CD1 4Å; L110-I116 HydrophobicContact CD2-CG2 4.1Å; L110-Y119 HydrophobicContact CD2-CD2 4.06Å; L110-Y119 HydrophobicContact CD2-CE2 4Å; L110-Y119 HydrophobicContact CD2-CG 4.35Å; L110-F122 HydrophobicContact CD1-CD1 4.01Å; L110-F122 HydrophobicContact CD1-CE1 4.49Å; L110-F122 HydrophobicContact CD2-CD1 4.19Å; L110-F122 HydrophobicContact CD2-CE1 4.45Å; L110-L135 HydrophobicContact CD1-CD1 4.32Å; L110-L135 HydrophobicContact CD1-CD2 3.92Å
111	G	83.4	Confident	84.9	Confident	24 Å²	24	65.7 Å²	65.7	25%	0.247	36%	0.359	C	S	.	.			trans	78.5	-167.2	-178.6	0	0	0	0	0	114	Q102 L109	Q102-G111 WeakPolarHBondContact CA-O 3.47Å; Q102-G111 WeakPolarHBondContact CB-O 3.34Å; L109-G111 PolarHBondContact O-N 2.82Å
112	Y	84.1	Confident	85	Confident	110 Å²	110	65.7 Å²	65.7	43%	0.431	36%	0.358	S	S	.	.	S	Bend	trans	-102.6	-3.5	-174.6	-55.8	-75	0	0	0	113.6	K100 V101 Q102 T153	K100-Y112 HydrophobicContact CB-CD1 3.42Å; K100-Y112 VanDerWaalsContact CB-CD1 3.42Å; K100-Y112 HydrophobicContact CB-CE1 3.38Å; K100-Y112 HydrophobicContact CB-CG 4.24Å; K100-Y112 HydrophobicContact CD-CD1 4.28Å; K100-Y112 HydrophobicContact CD-CD2 4.48Å; K100-Y112 HydrophobicContact CD-CE1 4.41Å; K100-Y112 HydrophobicContact CD-CG 4.32Å; K100-Y112 HydrophobicContact CG-CD1 4.47Å; V101-Y112 WeakPolarHBondContact O-CD1 3.43Å; Q102-Y112 HydrophobicContact CB-CD1 3.79Å; Q102-Y112 HydrophobicContact CB-CE1 3.77Å; Q102-Y112 HydrophobicContact CG-CD1 4.45Å; Q102-Y112 HydrophobicContact CG-CE1 3.91Å; Q102-Y112 PolarHBondContact OE1-OH 2.81Å; Y112-T153 HydrophobicContact CE1-CG2 4.15Å; Y112-T153 WeakPolarHBondContact OH-CG2 3.44Å
113	D	85	Confident	85	Confident	79 Å²	79	71 Å²	71	42%	0.422	38%	0.377	S	S	.	.			trans	-75.8	145.3	175.9	-157	-46.5	0	0	0	109.9	S115	D113-S115 PolarHBondContact OD1-N 2.05Å; D113-S115 PolarHBondContact OD1-OG 2.92Å
114	R	86.8	Confident	84.9	Confident	75 Å²	75	71.3 Å²	71.3	28%	0.283	38%	0.379	S	S	.	.	S	Bend	trans	-84.7	-28	177.4	-66.1	-175	135.4	-147	-5.2	112.3	R123 I124 G126 E132 H133	R114-R123 VanDerWaalsContact O-CA 3.32Å; R114-R123 WeakPolarHBondContact O-CA 3.28Å; R114-I124 HydrophobicContact CB-CB 4.31Å; R114-I124 HydrophobicContact CG-CB 4.15Å; R114-I124 PolarHBondContact O-N 3.48Å; R114-G126 VanDerWaalsContact CZ-O 3.26Å; R114-G126 PolarHBondContact NH1-O 3.31Å; R114-G126 PolarHBondContact NH2-O 2.84Å; R114-E132 PolarHBondContact NH2-O 2.93Å; R114-H133 PolarHBondContact NH2-ND1 3.09Å
115	S	80.7	Confident	84.9	Confident	86 Å²	86	71.6 Å²	71.6	60%	0.601	38%	0.383	S	S	*	.	B	Isolated β-bridge	trans	-94.2	89.8	164.7	27.7	0	0	0	0	108	D113 P117	D113-S115 PolarHBondContact OD1-N 2.05Å; D113-S115 PolarHBondContact OD1-OG 2.92Å; S115-P117 WeakPolarHBondContact O-CD 3.19Å
116	I	85	Confident	84.7	Confident	8 Å²	8	72.8 Å²	72.8	4%	0.041	40%	0.396	C	S	.	.			trans	-68.3	113.9	-169.1	-65.1	158.5	0	0	0	110.2	L110 G118 Y119 F122 I124 L135	L110-I116 HydrophobicContact CB-CD1 4.08Å; L110-I116 HydrophobicContact CB-CG1 4.31Å; L110-I116 HydrophobicContact CB-CG2 3.97Å; L110-I116 HydrophobicContact CD1-CD1 4Å; L110-I116 HydrophobicContact CD2-CG2 4.1Å; I116-G118 PolarHBondContact O-N 2.81Å; I116-Y119 HydrophobicContact CG2-CD2 3.79Å; I116-Y119 HydrophobicContact CG2-CG 4.18Å; I116-Y119 PolarHBondContact O-N 3.05Å; I116-Y119 VanDerWaalsContact O-N 3.14Å; I116-F122 HydrophobicContact CD1-CB 3.77Å; I116-I124 HydrophobicContact CD1-CG1 4.11Å; I116-L135 HydrophobicContact CD1-CD1 3.89Å
117	P	72.2	Confident	84.8	Confident	97 Å²	97	72.1 Å²	72.1	63%	0.63	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	136	-176.8	-22.5	35.4	0	0	0	111.5	S115 Y119	S115-P117 WeakPolarHBondContact O-CD 3.19Å; P117-Y119 PolarHBondContact O-N 2.84Å
118	G	75	Confident	84.9	Confident	85 Å²	85	66.3 Å²	66.3	88%	0.876	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.6	-12	-175.9	0	0	0	0	0	115.5	I116	I116-G118 PolarHBondContact O-N 2.81Å
119	Y	80.6	Confident	84.8	Confident	80 Å²	80	65.8 Å²	65.8	31%	0.314	39%	0.394	S	S	.	.			trans	-120.6	72	179.3	-66.8	-94.1	0	0	0	111.3	I108 L110 I116 P117 R121 F122	I108-Y119 WeakPolarHBondContact CD1-OH 3.47Å; L110-Y119 HydrophobicContact CD2-CD2 4.06Å; L110-Y119 HydrophobicContact CD2-CE2 4Å; L110-Y119 HydrophobicContact CD2-CG 4.35Å; I116-Y119 HydrophobicContact CG2-CD2 3.79Å; I116-Y119 HydrophobicContact CG2-CG 4.18Å; I116-Y119 PolarHBondContact O-N 3.05Å; I116-Y119 VanDerWaalsContact O-N 3.14Å; P117-Y119 PolarHBondContact O-N 2.84Å; Y119-R121 PolarHBondContact O-N 2.91Å; Y119-F122 HydrophobicContact CD1-CD1 4.13Å; Y119-F122 HydrophobicContact CD1-CD2 4.42Å; Y119-F122 HydrophobicContact CD1-CE1 4.04Å; Y119-F122 HydrophobicContact CD1-CE2 4.35Å; Y119-F122 HydrophobicContact CD1-CG 4.34Å; Y119-F122 HydrophobicContact CD1-CZ 4.16Å; Y119-F122 HydrophobicContact CG-CD1 4.39Å; Y119-F122 HydrophobicContact CG-CG 4.45Å; Y119-F122 PolarHBondContact O-N 2.72Å
120	S	82.9	Confident	84.8	Confident	127 Å²	127	69.3 Å²	69.3	89%	0.888	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-25.2	-174.4	56	0	0	0	0	115.9
121	R	92.2	Very high	84.7	Confident	57 Å²	57	68.9 Å²	68.9	22%	0.215	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-9.5	176.5	-67.9	-172.3	-57.5	98.6	3.2	114.4	Y119 I137 T138 D139 D144	Y119-R121 PolarHBondContact O-N 2.91Å; R121-I137 WeakPolarHBondContact O-CA 3.31Å; R121-T138 WeakPolarHBondContact CB-O 3.46Å; R121-T138 WeakPolarHBondContact CD-O 3.45Å; R121-T138 PolarHBondContact NH1-O 2.72Å; R121-T138 VanDerWaalsContact NH1-O 3.14Å; R121-T138 PolarHBondContact O-N 3.36Å; R121-T138 PolarHBondContact O-OG1 2.82Å; R121-T138 VanDerWaalsContact O-OG1 3.11Å; R121-D139 WeakPolarHBondContact CD-OD2 3.2Å; R121-D139 PolarHBondContact NH1-O 3.23Å; R121-D144 IonicContact CZ-OD1 3.95Å; R121-D144 IonicContact CZ-OD2 2.99Å; R121-D144 IonicContact NH1-OD1 3.97Å; R121-D144 IonicContact NH1-OD2 3.71Å; R121-D144 PolarHBondContact NH1-OD2 2.94Å; R121-D144 VanDerWaalsContact NH2-CG 3.34Å; R121-D144 IonicContact NH2-OD1 3.17Å; R121-D144 PolarHBondContact NH2-OD1 3.11Å; R121-D144 IonicContact NH2-OD2 3.74Å; R121-D144 PolarHBondContact NH2-OD2 2.84Å; R121-D144 VanDerWaalsContact NH2-OD2 3.1Å
122	F	92.4	Very high	85.2	Confident	10 Å²	10	70.5 Å²	70.5	4%	0.044	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	129.4	-172.8	-69.8	-149.6	0	0	0	109.4	A105 L110 I116 Y119 L135 Q136 I137 D144 Y148	A105-F122 HydrophobicContact CB-CE1 4.24Å; L110-F122 HydrophobicContact CD1-CD1 4.01Å; L110-F122 HydrophobicContact CD1-CE1 4.49Å; L110-F122 HydrophobicContact CD2-CD1 4.19Å; L110-F122 HydrophobicContact CD2-CE1 4.45Å; I116-F122 HydrophobicContact CD1-CB 3.77Å; Y119-F122 HydrophobicContact CD1-CD1 4.13Å; Y119-F122 HydrophobicContact CD1-CD2 4.42Å; Y119-F122 HydrophobicContact CD1-CE1 4.04Å; Y119-F122 HydrophobicContact CD1-CE2 4.35Å; Y119-F122 HydrophobicContact CD1-CG 4.34Å; Y119-F122 HydrophobicContact CD1-CZ 4.16Å; Y119-F122 HydrophobicContact CG-CD1 4.39Å; Y119-F122 HydrophobicContact CG-CG 4.45Å; Y119-F122 PolarHBondContact O-N 2.72Å; F122-L135 HydrophobicContact CB-CD1 4.37Å; F122-Q136 WeakPolarHBondContact CA-O 3.35Å; F122-I137 HydrophobicContact CD1-CD1 4.23Å; F122-I137 HydrophobicContact CD1-CG1 4.14Å; F122-I137 HydrophobicContact CD2-CB 4.34Å; F122-I137 HydrophobicContact CD2-CD1 4.33Å; F122-I137 HydrophobicContact CD2-CG1 3.87Å; F122-I137 HydrophobicContact CD2-CG2 3.81Å; F122-I137 HydrophobicContact CE1-CD1 3.84Å; F122-I137 HydrophobicContact CE1-CG1 4.24Å; F122-I137 HydrophobicContact CE2-CB 4.41Å; F122-I137 HydrophobicContact CE2-CD1 3.93Å; F122-I137 HydrophobicContact CE2-CG1 3.95Å; F122-I137 HydrophobicContact CE2-CG2 3.63Å; F122-I137 HydrophobicContact CG-CD1 4.47Å; F122-I137 HydrophobicContact CG-CG1 3.96Å; F122-I137 HydrophobicContact CZ-CD1 3.68Å; F122-I137 HydrophobicContact CZ-CG1 4.14Å; F122-I137 HydrophobicContact CZ-CG2 4.41Å; F122-D144 WeakPolarHBondContact CE2-OD1 3.47Å; F122-D144 WeakPolarHBondContact CZ-OD1 3.09Å; F122-Y148 AromaticContact CE1-CE1 3.94Å; F122-Y148 HydrophobicContact CE1-CE1 3.94Å
123	R	91.3	Very high	85.5	Confident	130 Å²	130	65.9 Å²	65.9	49%	0.491	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	144.5	176.2	56.3	175.3	-177.8	175.4	-2	112.7	R114 I125 Q136	R114-R123 VanDerWaalsContact O-CA 3.32Å; R114-R123 WeakPolarHBondContact O-CA 3.28Å; R123-I125 HydrophobicContact CG-CG2 3.9Å; R123-Q136 HydrophobicContact CG-CB 4.16Å; R123-Q136 PolarHBondContact N-O 3.45Å; R123-Q136 PolarHBondContact O-N 3.4Å
124	I	89.9	Confident	85.9	Confident	7 Å²	7	63 Å²	63	4%	0.036	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	113.1	175.3	-54.9	176.9	0	0	0	108.7	R114 I116 H133 T134 L135	R114-I124 HydrophobicContact CB-CB 4.31Å; R114-I124 HydrophobicContact CG-CB 4.15Å; R114-I124 PolarHBondContact O-N 3.48Å; I116-I124 HydrophobicContact CD1-CG1 4.11Å; I124-H133 HydrophobicContact CG2-CB 3.62Å; I124-T134 CarbonylContact C-O 3.54Å; I124-T134 WeakPolarHBondContact CA-O 3.35Å; I124-L135 HydrophobicContact CG1-CD1 4.49Å
125	I	91.1	Very high	86.3	Confident	48 Å²	48	59.4 Å²	59.4	25%	0.246	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	158.7	-174.2	63.4	169.8	0	0	0	112.5	R123 T134 Q136	R123-I125 HydrophobicContact CG-CG2 3.9Å; I125-T134 HydrophobicContact CD1-CG2 4.31Å; I125-T134 HydrophobicContact CG1-CG2 3.98Å; I125-T134 WeakPolarHBondContact CG1-O 3.32Å; I125-T134 PolarHBondContact N-O 2.77Å; I125-T134 PolarHBondContact O-N 2.8Å; I125-Q136 HydrophobicContact CD1-CB 3.94Å; I125-Q136 HydrophobicContact CG1-CB 4.25Å
126	G	86.4	Confident	86.9	Confident	32 Å²	32	56.2 Å²	56.2	33%	0.33	33%	0.33	S	S	.	.	S	Bend	trans	119.5	173.8	-176	0	0	0	0	0	112.8	R114 E132	R114-G126 VanDerWaalsContact CZ-O 3.26Å; R114-G126 PolarHBondContact NH1-O 3.31Å; R114-G126 PolarHBondContact NH2-O 2.84Å; G126-E132 VanDerWaalsContact CA-OE2 3.27Å; G126-E132 WeakPolarHBondContact CA-OE2 3.45Å
127	D	86.7	Confident	87.4	Confident	71 Å²	71	55.8 Å²	55.8	38%	0.38	33%	0.328	S	S	.	.			trans	-83.6	121.4	174.1	-176.3	-3.4	0	0	0	112.4	G129 R130 G131 E132	D127-G129 VanDerWaalsContact C-N 3.29Å; D127-G129 PolarHBondContact O-N 3.14Å; D127-G129 PolarHBondContact OD1-N 2.9Å; D127-R130 HydrophobicContact CB-CB 4.16Å; D127-R130 HydrophobicContact CB-CG 4Å; D127-R130 PolarHBondContact O-N 3.38Å; D127-R130 WeakPolarHBondContact OD2-CD 3.5Å; D127-R130 WeakPolarHBondContact OD2-CG 3.46Å; D127-R130 IonicContact OD2-CZ 3.84Å; D127-R130 IonicContact OD2-NE 2.87Å; D127-R130 PolarHBondContact OD2-NE 2.97Å; D127-G131 PolarHBondContact O-N 2.86Å; D127-E132 PolarHBondContact N-OE2 2.69Å; D127-E132 PolarHBondContact O-N 2.8Å
128	V	82.8	Confident	88.3	Confident	77 Å²	77	53.2 Å²	53.2	47%	0.467	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-64.4	-33.5	176.2	-175.9	0	0	0	0	111.6	R130 G131	V128-R130 PolarHBondContact O-N 2.84Å; V128-G131 PolarHBondContact O-N 3.01Å
129	G	79.1	Confident	88.9	Confident	78 Å²	78	52.5 Å²	52.5	80%	0.804	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-66.7	-17.8	177.4	0	0	0	0	0	113.4	D127	D127-G129 VanDerWaalsContact C-N 3.29Å; D127-G129 PolarHBondContact O-N 3.14Å; D127-G129 PolarHBondContact OD1-N 2.9Å
130	R	86.3	Confident	89.4	Confident	164 Å²	164	48.7 Å²	48.7	62%	0.619	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-102.4	0.2	172	-58.8	173.9	-160.5	-147.8	-7.7	112.7	D127 V128 E132	D127-R130 HydrophobicContact CB-CB 4.16Å; D127-R130 HydrophobicContact CB-CG 4Å; D127-R130 PolarHBondContact O-N 3.38Å; D127-R130 WeakPolarHBondContact OD2-CD 3.5Å; D127-R130 WeakPolarHBondContact OD2-CG 3.46Å; D127-R130 IonicContact OD2-CZ 3.84Å; D127-R130 IonicContact OD2-NE 2.87Å; D127-R130 PolarHBondContact OD2-NE 2.97Å; V128-R130 PolarHBondContact O-N 2.84Å; R130-E132 HydrophobicContact CB-CG 3.95Å; R130-E132 VanDerWaalsContact CD-OE1 3.32Å; R130-E132 WeakPolarHBondContact CD-OE1 3.16Å; R130-E132 PolarHBondContact O-N 2.91Å
131	G	85	Confident	89.8	Confident	2 Å²	2	46 Å²	46	2%	0.021	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.9	24.9	-173.3	0	0	0	0	0	114.3	V93 V94 D127 V128 H133	V93-G131 CarbonylContact C-O 3.5Å; V93-G131 WeakPolarHBondContact CA-O 3.38Å; V94-G131 PolarHBondContact N-O 2.99Å; V94-G131 WeakPolarHBondContact O-CA 3.11Å; D127-G131 PolarHBondContact O-N 2.86Å; V128-G131 PolarHBondContact O-N 3.01Å; G131-H133 VanDerWaalsContact C-CD2 3.47Å; G131-H133 PolarHBondContact O-CD2 2.97Å
132	E	93	Very high	89.5	Confident	58 Å²	58	49.9 Å²	49.9	27%	0.271	26%	0.259	S	S	.	.	B	Isolated β-bridge	trans	-78.5	119.3	175.7	-61.9	168.6	-175	0	0	110.1	V93 R114 G126 D127 R130	V93-E132 HydrophobicContact CG1-CG 3.89Å; V93-E132 HydrophobicContact CG2-CB 4.28Å; V93-E132 HydrophobicContact CG2-CG 3.97Å; R114-E132 PolarHBondContact NH2-O 2.93Å; G126-E132 VanDerWaalsContact CA-OE2 3.27Å; G126-E132 WeakPolarHBondContact CA-OE2 3.45Å; D127-E132 PolarHBondContact N-OE2 2.69Å; D127-E132 PolarHBondContact O-N 2.8Å; R130-E132 HydrophobicContact CB-CG 3.95Å; R130-E132 VanDerWaalsContact CD-OE1 3.32Å; R130-E132 WeakPolarHBondContact CD-OE1 3.16Å; R130-E132 PolarHBondContact O-N 2.91Å
133	H	92	Very high	89.2	Confident	13 Å²	13	55.5 Å²	55.5	6%	0.06	29%	0.29	C	S	.	.			trans	-137.4	57.4	-179.1	-60	-76.3	0	0	0	110.4	C92 Q97 V101 W103 R114 I124 G131 L135	C92-H133 CarbonylContact O-C 3.37Å; C92-H133 PolarHBondContact O-N 3.47Å; Q97-H133 PolarHBondContact OE1-NE2 3.5Å; V101-H133 HydrophobicContact CB-CB 4.37Å; V101-H133 HydrophobicContact CG1-CB 3.72Å; W103-H133 PolarHBondContact NE1-O 2.78Å; R114-H133 PolarHBondContact NH2-ND1 3.09Å; I124-H133 HydrophobicContact CG2-CB 3.62Å; G131-H133 VanDerWaalsContact C-CD2 3.47Å; G131-H133 PolarHBondContact O-CD2 2.97Å; H133-L135 PolarHBondContact O-N 3.13Å
134	T	93.5	Very high	89.2	Confident	18 Å²	18	49.7 Å²	49.7	11%	0.11	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	123.8	178	-68.7	0	0	0	0	109.8	N89 M90 Q91 I124 I125 Q136	N89-T134 HydrophobicContact CB-CG2 4.06Å; M90-T134 CarbonylContact O-C 3.52Å; M90-T134 WeakPolarHBondContact O-CA 3.36Å; Q91-T134 WeakPolarHBondContact CA-OG1 3.28Å; Q91-T134 HydrophobicContact CG-CG2 4.35Å; I124-T134 CarbonylContact C-O 3.54Å; I124-T134 WeakPolarHBondContact CA-O 3.35Å; I125-T134 HydrophobicContact CD1-CG2 4.31Å; I125-T134 HydrophobicContact CG1-CG2 3.98Å; I125-T134 WeakPolarHBondContact CG1-O 3.32Å; I125-T134 PolarHBondContact N-O 2.77Å; I125-T134 PolarHBondContact O-N 2.8Å; T134-Q136 PolarHBondContact O-N 2.85Å
135	L	93.9	Very high	89.2	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	113.3	173.2	175.9	60.2	0	0	0	109.2	M90 W103 L110 I116 F122 I124 H133 I137 Y148	M90-L135 HydrophobicContact CB-CB 4.47Å; M90-L135 HydrophobicContact CE-CD2 3.79Å; M90-L135 HydrophobicContact CE-CG 4.06Å; M90-L135 PolarHBondContact N-O 3.14Å; M90-L135 PolarHBondContact O-N 2.85Å; W103-L135 HydrophobicContact CB-CD2 4.08Å; W103-L135 HydrophobicContact CD2-CB 3.67Å; W103-L135 HydrophobicContact CD2-CD2 3.91Å; W103-L135 HydrophobicContact CD2-CG 4.43Å; W103-L135 VanDerWaalsContact CE2-CB 3.47Å; W103-L135 HydrophobicContact CE3-CB 4.21Å; W103-L135 HydrophobicContact CE3-CD2 3.95Å; W103-L135 HydrophobicContact CG-CB 3.96Å; W103-L135 HydrophobicContact CG-CD2 3.99Å; W103-L135 HydrophobicContact CH2-CB 4.36Å; W103-L135 HydrophobicContact CZ2-CB 3.83Å; L110-L135 HydrophobicContact CD1-CD1 4.32Å; L110-L135 HydrophobicContact CD1-CD2 3.92Å; I116-L135 HydrophobicContact CD1-CD1 3.89Å; F122-L135 HydrophobicContact CB-CD1 4.37Å; I124-L135 HydrophobicContact CG1-CD1 4.49Å; H133-L135 PolarHBondContact O-N 3.13Å; L135-I137 HydrophobicContact CG-CG1 4.44Å; L135-Y148 HydrophobicContact CD2-CD1 3.69Å; L135-Y148 HydrophobicContact CD2-CE1 4.02Å
136	Q	94.5	Very high	89.1	Confident	18 Å²	18	48.3 Å²	48.3	8%	0.084	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	134.8	167.6	179.6	173.4	98.2	0	0	110.3	T87 V88 N89 F122 R123 I125 T134 T138	T87-Q136 HydrophobicContact CG2-CG 3.6Å; V88-Q136 VanDerWaalsContact O-CA 3.28Å; V88-Q136 WeakPolarHBondContact O-CA 3.35Å; N89-Q136 WeakPolarHBondContact OD1-CB 3.36Å; N89-Q136 WeakPolarHBondContact OD1-CG 3.49Å; N89-Q136 PolarHBondContact OD1-NE2 2.79Å; F122-Q136 WeakPolarHBondContact CA-O 3.35Å; R123-Q136 HydrophobicContact CG-CB 4.16Å; R123-Q136 PolarHBondContact N-O 3.45Å; R123-Q136 PolarHBondContact O-N 3.4Å; I125-Q136 HydrophobicContact CD1-CB 3.94Å; I125-Q136 HydrophobicContact CG1-CB 4.25Å; T134-Q136 PolarHBondContact O-N 2.85Å; Q136-T138 HydrophobicContact CG-CG2 4.2Å
137	I	94.2	Very high	89.4	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	115.4	164.2	-56.9	172.6	0	0	0	107.3	T87 V88 M90 R121 F122 L135 V140 Y148 L169	T87-I137 WeakPolarHBondContact CA-O 3.44Å; V88-I137 HydrophobicContact CG1-CB 3.88Å; V88-I137 HydrophobicContact CG1-CG1 4.47Å; V88-I137 PolarHBondContact N-O 3.42Å; V88-I137 PolarHBondContact O-N 2.82Å; M90-I137 HydrophobicContact CE-CD1 3.6Å; M90-I137 HydrophobicContact CE-CG1 4.16Å; R121-I137 WeakPolarHBondContact O-CA 3.31Å; F122-I137 HydrophobicContact CD1-CD1 4.23Å; F122-I137 HydrophobicContact CD1-CG1 4.14Å; F122-I137 HydrophobicContact CD2-CB 4.34Å; F122-I137 HydrophobicContact CD2-CD1 4.33Å; F122-I137 HydrophobicContact CD2-CG1 3.87Å; F122-I137 HydrophobicContact CD2-CG2 3.81Å; F122-I137 HydrophobicContact CE1-CD1 3.84Å; F122-I137 HydrophobicContact CE1-CG1 4.24Å; F122-I137 HydrophobicContact CE2-CB 4.41Å; F122-I137 HydrophobicContact CE2-CD1 3.93Å; F122-I137 HydrophobicContact CE2-CG1 3.95Å; F122-I137 HydrophobicContact CE2-CG2 3.63Å; F122-I137 HydrophobicContact CG-CD1 4.47Å; F122-I137 HydrophobicContact CG-CG1 3.96Å; F122-I137 HydrophobicContact CZ-CD1 3.68Å; F122-I137 HydrophobicContact CZ-CG1 4.14Å; F122-I137 HydrophobicContact CZ-CG2 4.41Å; L135-I137 HydrophobicContact CG-CG1 4.44Å; I137-V140 HydrophobicContact CB-CG2 4.32Å; I137-V140 HydrophobicContact CG2-CG2 4.01Å; I137-Y148 HydrophobicContact CD1-CE1 3.69Å; I137-Y148 VanDerWaalsContact CD1-OH 3.27Å; I137-Y148 WeakPolarHBondContact CD1-OH 3.33Å; I137-L169 HydrophobicContact CD1-CD2 4.21Å
138	T	90.6	Very high	89.8	Confident	42 Å²	42	46.2 Å²	46.2	26%	0.258	25%	0.246	S	C	.	.	S	Bend	trans	-85.7	150.2	172.3	53.9	0	0	0	0	110.6	T87 R121 Q136	T87-T138 HydrophobicContact CG2-CG2 4.04Å; R121-T138 WeakPolarHBondContact CB-O 3.46Å; R121-T138 WeakPolarHBondContact CD-O 3.45Å; R121-T138 PolarHBondContact NH1-O 2.72Å; R121-T138 VanDerWaalsContact NH1-O 3.14Å; R121-T138 PolarHBondContact O-N 3.36Å; R121-T138 PolarHBondContact O-OG1 2.82Å; R121-T138 VanDerWaalsContact O-OG1 3.11Å; Q136-T138 HydrophobicContact CG-CG2 4.2Å
139	D	89.4	Confident	90.3	Very high	71 Å²	71	42.8 Å²	42.8	38%	0.38	22%	0.224	S	C	.	.	S	Bend	trans	51.2	65.1	177.4	174.7	54.4	0	0	0	111.5	G85 H86 R121 Q141	G85-D139 WeakPolarHBondContact CA-OD1 3.36Å; H86-D139 PolarHBondContact O-N 2.75Å; R121-D139 WeakPolarHBondContact CD-OD2 3.2Å; R121-D139 PolarHBondContact NH1-O 3.23Å; D139-Q141 VanDerWaalsContact CG-NE2 3.33Å; D139-Q141 PolarHBondContact O-N 2.71Å; D139-Q141 PolarHBondContact OD1-NE2 2.88Å; D139-Q141 PolarHBondContact OD2-NE2 2.85Å
140	V	90.6	Very high	91	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.186	C	C	.	.			trans	-63	117.3	-174.1	166.1	0	0	0	0	110.5	I82 L84 G85 H86 V88 I137 D144 L169 V171	I82-V140 HydrophobicContact CG2-CB 4.36Å; I82-V140 HydrophobicContact CG2-CG1 4.48Å; I82-V140 HydrophobicContact CG2-CG2 4.26Å; L84-V140 WeakPolarHBondContact CA-O 3.47Å; L84-V140 WeakPolarHBondContact CD1-O 3.23Å; G85-V140 PolarHBondContact N-O 3.47Å; H86-V140 WeakPolarHBondContact O-CB 3.27Å; H86-V140 VanDerWaalsContact O-CG2 3.27Å; H86-V140 WeakPolarHBondContact O-CG2 3.17Å; H86-V140 PolarHBondContact O-N 3.32Å; V88-V140 HydrophobicContact CB-CG2 4.33Å; V88-V140 HydrophobicContact CG1-CG2 3.76Å; I137-V140 HydrophobicContact CB-CG2 4.32Å; I137-V140 HydrophobicContact CG2-CG2 4.01Å; V140-D144 WeakPolarHBondContact CA-OD2 3.28Å; V140-D144 HydrophobicContact CG1-CB 4.34Å; V140-L169 HydrophobicContact CG1-CD2 4.46Å; V140-V171 HydrophobicContact CG1-CB 4.48Å; V140-V171 HydrophobicContact CG1-CG1 4.19Å; V140-V171 HydrophobicContact CG1-CG2 3.57Å
141	Q	90.7	Very high	91.3	Very high	71 Å²	71	32.7 Å²	32.7	33%	0.332	16%	0.163	S	C	.	.			trans	-94.4	160.3	-177.6	-68.2	-60.2	-22.9	0	0	111.4	D139 D143 D144	D139-Q141 VanDerWaalsContact CG-NE2 3.33Å; D139-Q141 PolarHBondContact O-N 2.71Å; D139-Q141 PolarHBondContact OD1-NE2 2.88Å; D139-Q141 PolarHBondContact OD2-NE2 2.85Å; Q141-D143 PolarHBondContact O-N 3Å; Q141-D143 VanDerWaalsContact O-N 3.07Å; Q141-D144 PolarHBondContact N-OD2 2.74Å; Q141-D144 WeakPolarHBondContact O-CB 3.47Å; Q141-D144 PolarHBondContact O-N 2.89Å
142	R	86.6	Confident	91.6	Very high	137 Å²	137	32.7 Å²	32.7	52%	0.517	16%	0.163	S	C	.	.	G	3₁₀ helix	trans	-51.6	-35.8	178.5	-176.9	179	-72.2	-138.9	-1.3	111.9	L84 I173	L84-R142 HydrophobicContact CD1-CB 4.3Å; L84-R142 VanDerWaalsContact CD1-N 3.34Å; R142-I173 HydrophobicContact CG-CD1 4.1Å
143	D	86.6	Confident	91.3	Very high	129 Å²	129	31.7 Å²	31.7	69%	0.69	16%	0.161	S	C	*	.	G	3₁₀ helix	trans	-85.3	0.5	-177.5	-55.5	-42.4	0	0	0	114.5	K106 Q141 A145	K106-D143 WeakPolarHBondContact CE-O 3.4Å; K106-D143 PolarHBondContact NZ-O 2.93Å; Q141-D143 PolarHBondContact O-N 3Å; Q141-D143 VanDerWaalsContact O-N 3.07Å; D143-A145 VanDerWaalsContact C-N 3.32Å
144	D	90.2	Very high	91.1	Very high	8 Å²	8	34.2 Å²	34.2	4%	0.043	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-77.7	-20	169.5	-64.7	-32.7	0	0	0	111.9	R121 F122 V140 Q141 G146 Y148 L169	R121-D144 IonicContact CZ-OD1 3.95Å; R121-D144 IonicContact CZ-OD2 2.99Å; R121-D144 IonicContact NH1-OD1 3.97Å; R121-D144 IonicContact NH1-OD2 3.71Å; R121-D144 PolarHBondContact NH1-OD2 2.94Å; R121-D144 VanDerWaalsContact NH2-CG 3.34Å; R121-D144 IonicContact NH2-OD1 3.17Å; R121-D144 PolarHBondContact NH2-OD1 3.11Å; R121-D144 IonicContact NH2-OD2 3.74Å; R121-D144 PolarHBondContact NH2-OD2 2.84Å; R121-D144 VanDerWaalsContact NH2-OD2 3.1Å; F122-D144 WeakPolarHBondContact CE2-OD1 3.47Å; F122-D144 WeakPolarHBondContact CZ-OD1 3.09Å; V140-D144 WeakPolarHBondContact CA-OD2 3.28Å; V140-D144 HydrophobicContact CG1-CB 4.34Å; Q141-D144 PolarHBondContact N-OD2 2.74Å; Q141-D144 WeakPolarHBondContact O-CB 3.47Å; Q141-D144 PolarHBondContact O-N 2.89Å; D144-G146 PolarHBondContact O-N 3Å; D144-Y148 WeakPolarHBondContact O-CE2 3.33Å; D144-Y148 PolarHBondContact O-OH 2.86Å; D144-Y148 VanDerWaalsContact O-OH 3.08Å; D144-L169 HydrophobicContact CB-CD2 3.97Å
145	A	89.2	Confident	90.6	Very high	19 Å²	19	35.1 Å²	35.1	16%	0.157	18%	0.184	C	C	.	.			trans	-55.2	129	-177	0	0	0	0	0	113.4	K106 D143 L169 V171	K106-A145 WeakPolarHBondContact CE-O 3.29Å; K106-A145 PolarHBondContact NZ-O 2.68Å; D143-A145 VanDerWaalsContact C-N 3.32Å; A145-L169 CarbonylContact C-O 3.51Å; A145-L169 VanDerWaalsContact CA-O 3.28Å; A145-L169 WeakPolarHBondContact CA-O 3.5Å; A145-V171 HydrophobicContact CB-CB 4.36Å; A145-V171 HydrophobicContact CB-CG2 3.87Å
146	G	90.2	Very high	89.6	Confident	7 Å²	7	40.1 Å²	40.1	7%	0.072	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	149.7	-169.5	177.3	0	0	0	0	0	115.2	D144 L169	D144-G146 PolarHBondContact O-N 3Å; G146-L169 PolarHBondContact N-O 3.21Å; G146-L169 PolarHBondContact O-N 2.81Å
147	E	93.3	Very high	88.5	Confident	58 Å²	58	45.6 Å²	45.6	27%	0.271	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	141	177	-174.5	-171.6	112.8	0	0	112.1	R104 K106 K166 T167 Y168	R104-E147 IonicContact CZ-OE1 3.6Å; R104-E147 IonicContact NH2-OE1 2.71Å; R104-E147 PolarHBondContact NH2-OE1 3.01Å; K106-E147 WeakPolarHBondContact CA-O 3.29Å; K106-E147 PolarHBondContact N-O 2.87Å; E147-K166 HydrophobicContact CG-CD 4.27Å; E147-K166 HydrophobicContact CG-CG 4.36Å; E147-K166 WeakPolarHBondContact OE1-CE 3.32Å; E147-K166 IonicContact OE1-NZ 2.73Å; E147-K166 PolarHBondContact OE1-NZ 2.82Å; E147-K166 WeakPolarHBondContact OE2-CD 3.34Å; E147-K166 WeakPolarHBondContact OE2-CE 3.27Å; E147-K166 IonicContact OE2-NZ 2.72Å; E147-K166 PolarHBondContact OE2-NZ 2.71Å; E147-T167 WeakPolarHBondContact CA-O 3.41Å; E147-Y168 HydrophobicContact CB-CD2 4.45Å
148	Y	94.1	Very high	87.3	Confident	1 Å²	1	50 Å²	50	0%	0.004	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	153.4	165.8	-67.9	-108	0	0	0	109.9	M90 R104 A105 F122 L135 I137 D144 K166 T167 L169	M90-Y148 HydrophobicContact CE-CD1 3.85Å; M90-Y148 HydrophobicContact CE-CD2 4.18Å; M90-Y148 HydrophobicContact CE-CE1 4Å; M90-Y148 HydrophobicContact CE-CE2 4.36Å; M90-Y148 HydrophobicContact CE-CG 3.95Å; M90-Y148 HydrophobicContact SD-CD1 4.43Å; M90-Y148 HydrophobicContact SD-CD2 4.06Å; M90-Y148 HydrophobicContact SD-CG 3.95Å; R104-Y148 CarbonylContact O-C 3.49Å; R104-Y148 VanDerWaalsContact O-CA 3.23Å; R104-Y148 WeakPolarHBondContact O-CA 3.25Å; A105-Y148 HydrophobicContact CB-CD1 3.76Å; A105-Y148 HydrophobicContact CB-CE1 3.44Å; A105-Y148 VanDerWaalsContact CB-CE1 3.44Å; F122-Y148 AromaticContact CE1-CE1 3.94Å; F122-Y148 HydrophobicContact CE1-CE1 3.94Å; L135-Y148 HydrophobicContact CD2-CD1 3.69Å; L135-Y148 HydrophobicContact CD2-CE1 4.02Å; I137-Y148 HydrophobicContact CD1-CE1 3.69Å; I137-Y148 VanDerWaalsContact CD1-OH 3.27Å; I137-Y148 WeakPolarHBondContact CD1-OH 3.33Å; D144-Y148 WeakPolarHBondContact O-CE2 3.33Å; D144-Y148 PolarHBondContact O-OH 2.86Å; D144-Y148 VanDerWaalsContact O-OH 3.08Å; Y148-K166 CarbonylContact O-C 3.44Å; Y148-K166 VanDerWaalsContact O-CA 3.28Å; Y148-K166 WeakPolarHBondContact O-CA 3.44Å; Y148-T167 PolarHBondContact N-O 3.09Å; Y148-T167 PolarHBondContact O-N 2.89Å; Y148-T167 VanDerWaalsContact O-O 3.13Å; Y148-L169 HydrophobicContact CD2-CB 4.2Å; Y148-L169 HydrophobicContact CE2-CB 3.91Å; Y148-L169 HydrophobicContact CE2-CD2 4.05Å
149	E	93	Very high	86.6	Confident	4 Å²	4	55 Å²	55	2%	0.019	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	119.5	177.9	-169.9	179.6	-92.6	0	0	111.6	Q56 W103 R104 Q151 R164 R165 K166	Q56-E149 PolarHBondContact NE2-OE1 3.13Å; W103-E149 CarbonylContact C-O 3.35Å; W103-E149 WeakPolarHBondContact CA-O 3.25Å; R104-E149 HydrophobicContact CB-CB 4.22Å; R104-E149 IonicContact CZ-OE1 3.15Å; R104-E149 IonicContact CZ-OE2 2.71Å; R104-E149 PolarHBondContact N-O 3.14Å; R104-E149 VanDerWaalsContact NH1-CD 3.32Å; R104-E149 IonicContact NH1-OE1 3.95Å; R104-E149 IonicContact NH1-OE2 3.3Å; R104-E149 PolarHBondContact NH1-OE2 2.78Å; R104-E149 VanDerWaalsContact NH2-CD 3.26Å; R104-E149 IonicContact NH2-OE1 2.72Å; R104-E149 PolarHBondContact NH2-OE1 3.44Å; R104-E149 VanDerWaalsContact NH2-OE1 3.13Å; R104-E149 IonicContact NH2-OE2 2.74Å; R104-E149 PolarHBondContact NH2-OE2 2.8Å; R104-E149 PolarHBondContact O-N 2.99Å; E149-Q151 HydrophobicContact CG-CG 4.21Å; E149-Q151 PolarHBondContact OE2-NE2 2.94Å; E149-R164 HydrophobicContact CG-CB 4.24Å; E149-R165 CarbonylContact C-O 3.56Å; E149-R165 VanDerWaalsContact CA-O 3.31Å; E149-R165 WeakPolarHBondContact CA-O 3.45Å; E149-K166 HydrophobicContact CB-CG 4.15Å; E149-K166 HydrophobicContact CG-CG 3.95Å; E149-K166 VanDerWaalsContact OE1-CE 3.28Å; E149-K166 WeakPolarHBondContact OE1-CE 3.39Å; E149-K166 WeakPolarHBondContact OE1-CG 3.4Å
150	C	93.7	Very high	86.4	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	135.5	169.2	-172.6	0	0	0	0	108.9	C92 W103 R164 R165	C92-C150 HydrophobicContact CB-CB 3.77Å; C92-C150 WeakPolarHBondContact CB-SG 3.26Å; C92-C150 WeakPolarHBondContact SG-CB 3.48Å; C92-C150 CovalentContact SG-SG 2.05Å; C92-C150 PolarHBondContact SG-SG 2.82Å; W103-C150 HydrophobicContact CD2-CB 3.92Å; W103-C150 HydrophobicContact CE3-CB 4Å; W103-C150 HydrophobicContact CH2-CB 3.86Å; W103-C150 HydrophobicContact CZ2-CB 3.77Å; W103-C150 HydrophobicContact CZ3-CB 3.96Å; C150-R164 CarbonylContact O-C 3.45Å; C150-R164 WeakPolarHBondContact O-CA 3.27Å; C150-R165 PolarHBondContact N-O 3.39Å; C150-R165 PolarHBondContact O-N 3.35Å
151	Q	92.2	Very high	86.1	Confident	31 Å²	31	54.5 Å²	54.5	15%	0.145	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	146.5	-176.3	-59.9	-174.6	-15.8	0	0	112.1	V101 Q102 E149 L163 R164	V101-Q151 WeakPolarHBondContact CA-O 3.19Å; Q102-Q151 HydrophobicContact CG-CB 4.01Å; Q102-Q151 PolarHBondContact N-O 3.28Å; Q102-Q151 PolarHBondContact O-N 2.79Å; Q102-Q151 VanDerWaalsContact O-O 3.14Å; E149-Q151 HydrophobicContact CG-CG 4.21Å; E149-Q151 PolarHBondContact OE2-NE2 2.94Å; Q151-L163 CarbonylContact C-O 3.53Å; Q151-L163 WeakPolarHBondContact CA-O 3.38Å; Q151-R164 HydrophobicContact CG-CB 4.19Å
152	V	91.8	Very high	86	Confident	1 Å²	1	54.5 Å²	54.5	1%	0.006	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	126.1	177.2	-166.6	0	0	0	0	110.5	F72 V94 K100 V101 L162 L163	F72-V152 HydrophobicContact CE1-CG2 3.84Å; F72-V152 HydrophobicContact CZ-CG2 4.25Å; V94-V152 HydrophobicContact CG1-CG1 4.41Å; V94-V152 HydrophobicContact CG1-CG2 4.32Å; V94-V152 HydrophobicContact CG2-CG2 3.73Å; K100-V152 WeakPolarHBondContact O-CA 3.28Å; V101-V152 HydrophobicContact CG1-CG2 4.27Å; V101-V152 HydrophobicContact CG2-CB 4.43Å; V101-V152 HydrophobicContact CG2-CG1 3.92Å; V101-V152 HydrophobicContact CG2-CG2 3.92Å; V152-L162 WeakPolarHBondContact O-CA 3.43Å; V152-L162 WeakPolarHBondContact O-CD1 3.46Å; V152-L163 HydrophobicContact CB-CB 3.87Å; V152-L163 HydrophobicContact CB-CD1 4.13Å; V152-L163 HydrophobicContact CB-CG 4.18Å; V152-L163 HydrophobicContact CG2-CB 3.87Å; V152-L163 HydrophobicContact CG2-CD1 3.98Å; V152-L163 HydrophobicContact CG2-CG 4.37Å; V152-L163 PolarHBondContact N-O 2.84Å; V152-L163 PolarHBondContact O-N 3.08Å
153	T	87.7	Confident	86.2	Confident	38 Å²	38	48.3 Å²	48.3	23%	0.233	28%	0.278	C	S	.	.			trans	-66.3	143.4	-176.2	65.1	0	0	0	0	112.4	Q70 G99 K100 Y112	Q70-T153 PolarHBondContact NE2-O 3.08Å; G99-T153 WeakPolarHBondContact CA-O 3.36Å; G99-T153 WeakPolarHBondContact CA-OG1 3.34Å; K100-T153 HydrophobicContact CB-CG2 4.37Å; K100-T153 PolarHBondContact N-OG1 2.78Å; K100-T153 PolarHBondContact O-N 3.33Å; Y112-T153 HydrophobicContact CE1-CG2 4.15Å; Y112-T153 WeakPolarHBondContact OH-CG2 3.44Å
154	P	87.2	Confident	86.4	Confident	65 Å²	65	44.8 Å²	44.8	42%	0.422	26%	0.255	S	S	.	.			trans	-66.9	159.8	170	31.5	-35.6	0	0	0	111.2	H160 L162	P154-H160 CarbonylContact C-O 3.55Å; P154-H160 VanDerWaalsContact CA-O 3.23Å; P154-H160 WeakPolarHBondContact CA-O 3.46Å; P154-H160 WeakPolarHBondContact CB-O 3.4Å; P154-L162 HydrophobicContact CB-CB 4.41Å; P154-L162 HydrophobicContact CG-CB 4.43Å
155	V	83.9	Confident	86.5	Confident	37 Å²	37	46.2 Å²	46.2	22%	0.224	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-128	100.5	168.8	-176	0	0	0	0	108.4	H98 V157 N158 H160	H98-V155 HydrophobicContact CB-CG2 4.07Å; V155-V157 VanDerWaalsContact C-N 3.33Å; V155-V157 PolarHBondContact O-N 2.91Å; V155-N158 PolarHBondContact O-N 2.83Å; V155-H160 HydrophobicContact CB-CB 4.07Å; V155-H160 PolarHBondContact N-O 2.79Å; V155-H160 PolarHBondContact O-N 2.82Å; V155-H160 VanDerWaalsContact O-N 3.13Å
156	P	71	Confident	86.7	Confident	106 Å²	106	48.4 Å²	48.4	69%	0.688	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-59.7	-37.9	-170.6	-27.7	35.5	0	0	0	114.6	N158 N159	P156-N158 PolarHBondContact O-N 3.14Å; P156-N159 PolarHBondContact O-N 2.71Å; P156-N159 VanDerWaalsContact O-N 3.13Å
157	V	72.5	Confident	86.8	Confident	133 Å²	133	48.3 Å²	48.3	81%	0.806	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-55.7	-31.6	-173.3	-172.5	0	0	0	0	113	V155	V155-V157 VanDerWaalsContact C-N 3.33Å; V155-V157 PolarHBondContact O-N 2.91Å
158	N	68.9	Low	86.8	Confident	92 Å²	92	51 Å²	51	49%	0.492	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-119.2	17	-176.6	-66.8	3.4	0	0	0	113	V155 P156 H160	V155-N158 PolarHBondContact O-N 2.83Å; P156-N158 PolarHBondContact O-N 3.14Å; N158-H160 VanDerWaalsContact C-N 3.27Å; N158-H160 WeakPolarHBondContact CB-NE2 3.43Å; N158-H160 PolarHBondContact O-N 3.1Å
159	N	76	Confident	86.8	Confident	146 Å²	146	51 Å²	51	78%	0.781	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	33.5	-174.6	-76.6	-26.4	0	0	0	115	P156	P156-N159 PolarHBondContact O-N 2.71Å; P156-N159 VanDerWaalsContact O-N 3.13Å
160	H	85.2	Confident	86.7	Confident	12 Å²	12	53.3 Å²	53.3	6%	0.056	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	-81.1	122.8	176.2	-62.5	-43.8	0	0	0	111.2	R68 Q70 H98 P154 V155 N158	R68-H160 PolarHBondContact O-CE1 2.77Å; Q70-H160 HydrophobicContact CG-CB 4.03Å; H98-H160 WeakPolarHBondContact CB-CD2 3.5Å; H98-H160 AromaticContact CD2-CD2 3.55Å; H98-H160 AromaticContact CD2-CE1 3.55Å; H98-H160 AromaticContact CD2-NE2 3.1Å; H98-H160 PolarHBondContact CD2-NE2 3.08Å; H98-H160 AromaticContact CG-CD2 3.45Å; H98-H160 VanDerWaalsContact CG-CD2 3.45Å; H98-H160 AromaticContact CG-NE2 3.36Å; H98-H160 AromaticContact ND1-NE2 3.91Å; H98-H160 AromaticContact NE2-NE2 3.57Å; P154-H160 CarbonylContact C-O 3.55Å; P154-H160 VanDerWaalsContact CA-O 3.23Å; P154-H160 WeakPolarHBondContact CA-O 3.46Å; P154-H160 WeakPolarHBondContact CB-O 3.4Å; V155-H160 HydrophobicContact CB-CB 4.07Å; V155-H160 PolarHBondContact N-O 2.79Å; V155-H160 PolarHBondContact O-N 2.82Å; V155-H160 VanDerWaalsContact O-N 3.13Å; N158-H160 VanDerWaalsContact C-N 3.27Å; N158-H160 WeakPolarHBondContact CB-NE2 3.43Å; N158-H160 PolarHBondContact O-N 3.1Å
161	P	84.5	Confident	86.5	Confident	49 Å²	49	53.3 Å²	53.3	32%	0.318	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-80.1	157.8	-170.1	32.3	-37	0	0	0	113.6	I69 Q70 L163	I69-P161 HydrophobicContact CG2-CG 4.03Å; Q70-P161 PolarHBondContact NE2-O 3.33Å; P161-L163 HydrophobicContact CG-CD2 4.3Å; P161-L163 PolarHBondContact O-N 3.35Å
162	L	88	Confident	86.4	Confident	72 Å²	72	52.2 Å²	52.2	38%	0.377	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-64.7	128.9	166.8	177	83.5	0	0	0	109.6	V152 P154 R164	V152-L162 WeakPolarHBondContact O-CA 3.43Å; V152-L162 WeakPolarHBondContact O-CD1 3.46Å; P154-L162 HydrophobicContact CB-CB 4.41Å; P154-L162 HydrophobicContact CG-CB 4.43Å; L162-R164 VanDerWaalsContact CD2-NH1 3.34Å
163	L	91.4	Very high	86.2	Confident	7 Å²	7	52.9 Å²	52.9	4%	0.037	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	142.2	172.5	-48.6	174.8	0	0	0	110.8	S57 Q70 F72 V94 Q151 V152 P161	S57-L163 WeakPolarHBondContact OG-CA 3.24Å; Q70-L163 HydrophobicContact CG-CD1 4.19Å; Q70-L163 HydrophobicContact CG-CG 4.44Å; F72-L163 HydrophobicContact CD1-CD1 4.31Å; F72-L163 HydrophobicContact CD2-CB 4.27Å; F72-L163 HydrophobicContact CE1-CB 4.13Å; F72-L163 HydrophobicContact CE1-CD1 4.37Å; F72-L163 HydrophobicContact CE2-CB 3.72Å; F72-L163 HydrophobicContact CG-CD1 4.46Å; F72-L163 HydrophobicContact CZ-CB 3.63Å; V94-L163 HydrophobicContact CG1-CD1 4.03Å; Q151-L163 CarbonylContact C-O 3.53Å; Q151-L163 WeakPolarHBondContact CA-O 3.38Å; V152-L163 HydrophobicContact CB-CB 3.87Å; V152-L163 HydrophobicContact CB-CD1 4.13Å; V152-L163 HydrophobicContact CB-CG 4.18Å; V152-L163 HydrophobicContact CG2-CB 3.87Å; V152-L163 HydrophobicContact CG2-CD1 3.98Å; V152-L163 HydrophobicContact CG2-CG 4.37Å; V152-L163 PolarHBondContact N-O 2.84Å; V152-L163 PolarHBondContact O-N 3.08Å; P161-L163 HydrophobicContact CG-CD2 4.3Å; P161-L163 PolarHBondContact O-N 3.35Å
164	R	91.3	Very high	86.1	Confident	54 Å²	54	58.1 Å²	58.1	20%	0.204	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	139.8	170.3	60.2	-160	159.6	-163.7	-9.6	113.8	I55 S57 E149 C150 Q151 L162	I55-R164 VanDerWaalsContact N-NH2 3.2Å; I55-R164 PolarHBondContact O-NE 2.84Å; I55-R164 PolarHBondContact O-NH2 2.99Å; S57-R164 PolarHBondContact N-O 2.91Å; S57-R164 PolarHBondContact OG-N 3.18Å; E149-R164 HydrophobicContact CG-CB 4.24Å; C150-R164 CarbonylContact O-C 3.45Å; C150-R164 WeakPolarHBondContact O-CA 3.27Å; Q151-R164 HydrophobicContact CG-CB 4.19Å; L162-R164 VanDerWaalsContact CD2-NH1 3.34Å
165	R	92.4	Very high	86.1	Confident	39 Å²	39	55.1 Å²	55.1	15%	0.147	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	123	178	175.5	56.9	60.9	153.4	-0.9	112.2	Q56 S57 N58 F72 L75 P76 E149 C150	Q56-R165 VanDerWaalsContact OE1-CA 3.27Å; S57-R165 PolarHBondContact O-NE 3.11Å; S57-R165 PolarHBondContact O-NH2 3.48Å; N58-R165 PolarHBondContact OD1-NH2 2.93Å; F72-R165 HydrophobicContact CD2-CB 4.45Å; F72-R165 HydrophobicContact CE2-CB 3.84Å; F72-R165 HydrophobicContact CZ-CB 4.37Å; L75-R165 HydrophobicContact CB-CG 4.36Å; L75-R165 HydrophobicContact CD2-CB 4.22Å; L75-R165 HydrophobicContact CD2-CG 4.04Å; P76-R165 HydrophobicContact CG-CG 3.83Å; E149-R165 CarbonylContact C-O 3.56Å; E149-R165 VanDerWaalsContact CA-O 3.31Å; E149-R165 WeakPolarHBondContact CA-O 3.45Å; C150-R165 PolarHBondContact N-O 3.39Å; C150-R165 PolarHBondContact O-N 3.35Å
166	K	91.9	Very high	86.2	Confident	65 Å²	65	58 Å²	58	28%	0.283	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	155.3	173.9	-69.3	-177.2	175.5	-146.3	0	113.6	E147 Y148 E149	E147-K166 HydrophobicContact CG-CD 4.27Å; E147-K166 HydrophobicContact CG-CG 4.36Å; E147-K166 WeakPolarHBondContact OE1-CE 3.32Å; E147-K166 IonicContact OE1-NZ 2.73Å; E147-K166 PolarHBondContact OE1-NZ 2.82Å; E147-K166 WeakPolarHBondContact OE2-CD 3.34Å; E147-K166 WeakPolarHBondContact OE2-CE 3.27Å; E147-K166 IonicContact OE2-NZ 2.72Å; E147-K166 PolarHBondContact OE2-NZ 2.71Å; Y148-K166 CarbonylContact O-C 3.44Å; Y148-K166 VanDerWaalsContact O-CA 3.28Å; Y148-K166 WeakPolarHBondContact O-CA 3.44Å; E149-K166 HydrophobicContact CB-CG 4.15Å; E149-K166 HydrophobicContact CG-CG 3.95Å; E149-K166 VanDerWaalsContact OE1-CE 3.28Å; E149-K166 WeakPolarHBondContact OE1-CE 3.39Å; E149-K166 WeakPolarHBondContact OE1-CG 3.4Å
167	T	93.6	Very high	86.9	Confident	5 Å²	5	59.4 Å²	59.4	3%	0.031	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	158.5	169.4	171.2	0	0	0	0	108.7	P76 S77 Y80 M90 W103 E147 Y148	P76-T167 HydrophobicContact CB-CG2 3.98Å; P76-T167 HydrophobicContact CG-CG2 4.11Å; S77-T167 WeakPolarHBondContact O-CB 3.23Å; S77-T167 PolarHBondContact O-OG1 2.97Å; Y80-T167 WeakPolarHBondContact CD2-OG1 3.27Å; Y80-T167 WeakPolarHBondContact CE2-OG1 3.32Å; M90-T167 HydrophobicContact CG-CG2 4.49Å; M90-T167 HydrophobicContact SD-CG2 3.9Å; W103-T167 HydrophobicContact CZ3-CG2 4.03Å; E147-T167 WeakPolarHBondContact CA-O 3.41Å; Y148-T167 PolarHBondContact N-O 3.09Å; Y148-T167 PolarHBondContact O-N 2.89Å; Y148-T167 VanDerWaalsContact O-O 3.13Å
168	Y	93.7	Very high	87.7	Confident	115 Å²	115	53.4 Å²	53.4	45%	0.451	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	145.1	172.1	-158.6	-93.6	0	0	0	111.7	E78 Q79 Y80 E147	E78-Y168 PolarHBondContact O-N 2.89Å; Q79-Y168 CarbonylContact C-O 3.53Å; Q79-Y168 WeakPolarHBondContact CA-O 3.46Å; Y80-Y168 PolarHBondContact N-O 2.85Å; E147-Y168 HydrophobicContact CB-CD2 4.45Å
169	L	92.6	Very high	88.6	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	118.8	171.1	178.5	60.1	0	0	0	109.3	I82 V88 I137 V140 D144 A145 G146 Y148	I82-L169 HydrophobicContact CB-CD1 4.25Å; I82-L169 HydrophobicContact CG1-CD1 3.92Å; V88-L169 HydrophobicContact CB-CD1 4.46Å; V88-L169 HydrophobicContact CG1-CD1 4.18Å; V88-L169 HydrophobicContact CG1-CD2 4.2Å; V88-L169 HydrophobicContact CG2-CD1 4.23Å; I137-L169 HydrophobicContact CD1-CD2 4.21Å; V140-L169 HydrophobicContact CG1-CD2 4.46Å; D144-L169 HydrophobicContact CB-CD2 3.97Å; A145-L169 CarbonylContact C-O 3.51Å; A145-L169 VanDerWaalsContact CA-O 3.28Å; A145-L169 WeakPolarHBondContact CA-O 3.5Å; G146-L169 PolarHBondContact N-O 3.21Å; G146-L169 PolarHBondContact O-N 2.81Å; Y148-L169 HydrophobicContact CD2-CB 4.2Å; Y148-L169 HydrophobicContact CE2-CB 3.91Å; Y148-L169 HydrophobicContact CE2-CD2 4.05Å
170	E	90.4	Very high	89.2	Confident	52 Å²	52	46.6 Å²	46.6	24%	0.243	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	131.7	172	-179.1	-179.5	-167.4	0	0	109.6	Q79 Y80 A81 I82 L172	Q79-E170 PolarHBondContact NE2-OE2 3.3Å; Y80-E170 PolarHBondContact O-N 2.74Å; A81-E170 WeakPolarHBondContact CA-O 3.29Å; A81-E170 HydrophobicContact CB-CB 4.36Å; I82-E170 PolarHBondContact N-O 3.37Å; E170-L172 HydrophobicContact CG-CD2 4.24Å
171	V	90.8	Very high	89.3	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.006	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	112.9	-179.7	-178.1	0	0	0	0	109.3	I82 L84 V140 A145 I173	I82-V171 WeakPolarHBondContact O-CA 3.38Å; L84-V171 HydrophobicContact CB-CG1 4.46Å; L84-V171 HydrophobicContact CD1-CG1 3.87Å; V140-V171 HydrophobicContact CG1-CB 4.48Å; V140-V171 HydrophobicContact CG1-CG1 4.19Å; V140-V171 HydrophobicContact CG1-CG2 3.57Å; A145-V171 HydrophobicContact CB-CB 4.36Å; A145-V171 HydrophobicContact CB-CG2 3.87Å; V171-I173 HydrophobicContact CG1-CG1 4.4Å
172	L	89.1	Confident	89.2	Confident	7 Å²	7	45.3 Å²	45.3	4%	0.037	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	131.5	-178.4	-57.6	176.7	0	0	0	110	A81 I82 P83 L84 E170 R213 A292 I295	A81-L172 HydrophobicContact CB-CD1 3.98Å; A81-L172 HydrophobicContact CB-CD2 4.34Å; A81-L172 HydrophobicContact CB-CG 4.22Å; I82-L172 PolarHBondContact O-N 2.88Å; P83-L172 WeakPolarHBondContact CA-O 3.12Å; L84-L172 PolarHBondContact N-O 2.72Å; E170-L172 HydrophobicContact CG-CD2 4.24Å; L172-R213 WeakPolarHBondContact CA-O 3.39Å; L172-A292 HydrophobicContact CB-CB 3.81Å; L172-I295 HydrophobicContact CD1-CD1 3.45Å; L172-I295 VanDerWaalsContact CD1-CD1 3.45Å
173	I	87.5	Confident	88.5	Confident	15 Å²	15	46.5 Å²	46.5	8%	0.077	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-130.5	124.7	-171.9	-50.9	-178.7	0	0	0	108.2	R142 V171 R213 N290 A292	R142-I173 HydrophobicContact CG-CD1 4.1Å; V171-I173 HydrophobicContact CG1-CG1 4.4Å; I173-R213 HydrophobicContact CB-CB 3.88Å; I173-R213 HydrophobicContact CD1-CB 4.13Å; I173-R213 HydrophobicContact CG1-CB 3.98Å; I173-R213 PolarHBondContact N-O 3.01Å; I173-R213 PolarHBondContact O-N 3.26Å; I173-N290 PolarHBondContact O-ND2 2.87Å; I173-A292 WeakPolarHBondContact O-CB 3.45Å
174	K	86.2	Confident	87.5	Confident	148 Å²	148	52.5 Å²	52.5	64%	0.643	24%	0.244	S	C	*	.	P	Polyproline II helix	trans	-65.8	143.2	173.4	61.5	166.5	-171.3	164.1	0	110.2	T293	K174-T293 HydrophobicContact CB-CG2 3.74Å
175	P	87.9	Confident	86.3	Confident	2 Å²	2	52 Å²	52	1%	0.013	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-69.3	169.3	168.1	31.3	-33.3	0	0	0	110.8	P216 V288 L304	P175-P216 HydrophobicContact CB-CB 4.33Å; P175-P216 HydrophobicContact CB-CG 4.12Å; P175-P216 HydrophobicContact CG-CB 4.32Å; P175-V288 HydrophobicContact CG-CG1 4.24Å; P175-L304 HydrophobicContact CG-CD1 4.09Å
176	N	86.6	Confident	85.3	Confident	97 Å²	97	55.6 Å²	55.6	52%	0.519	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-64.6	164.2	169.1	-66.4	-19.8	0	0	0	111	V210	N176-V210 VanDerWaalsContact CB-O 3.27Å; N176-V210 WeakPolarHBondContact CB-O 3.22Å; N176-V210 PolarHBondContact N-O 2.9Å; N176-V210 PolarHBondContact ND2-O 3.22Å
177	E	85.4	Confident	84.4	Confident	137 Å²	137	53.2 Å²	53.2	64%	0.64	26%	0.255	S	S	*	.	P	Polyproline II helix	trans	-62.9	133.3	170.5	-70.8	-174.3	-171.2	0	0	110.1
178	P	88	Confident	83.1	Confident	6 Å²	6	55.4 Å²	55.4	4%	0.039	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-66.3	147.1	-176.9	26.2	-34.7	0	0	0	112	S208 A209 V288 L304 I306	P178-S208 VanDerWaalsContact CA-O 3.31Å; P178-S208 WeakPolarHBondContact CA-O 2.86Å; P178-A209 HydrophobicContact CB-CB 4.21Å; P178-V288 HydrophobicContact CB-CG2 3.79Å; P178-V288 HydrophobicContact CG-CG2 4.14Å; P178-L304 HydrophobicContact CG-CB 4.5Å; P178-L304 WeakPolarHBondContact CG-O 3.35Å; P178-I306 HydrophobicContact CB-CG2 3.87Å; P178-I306 HydrophobicContact CG-CB 4.14Å; P178-I306 HydrophobicContact CG-CG2 3.82Å; P178-I306 WeakPolarHBondContact O-CB 3.45Å; P178-I306 WeakPolarHBondContact O-CD1 3.38Å; P178-I306 WeakPolarHBondContact O-CG2 3.39Å
179	Q	89.2	Confident	82.1	Confident	90 Å²	90	58.3 Å²	58.3	42%	0.421	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	135.2	174.5	-57.5	-174.3	13	0	0	109.5	C207 S208	Q179-C207 CarbonylContact O-C 3.56Å; Q179-C207 VanDerWaalsContact O-CA 3.31Å; Q179-C207 WeakPolarHBondContact O-CA 3.44Å; Q179-S208 PolarHBondContact N-O 2.81Å; Q179-S208 PolarHBondContact O-N 3.24Å
180	I	88	Confident	81.5	Confident	5 Å²	5	64 Å²	64	3%	0.026	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	128.8	171.9	-62	164.3	0	0	0	109.1	L187 L205 V206 C207 W220 C286 I306 I308	I180-L187 HydrophobicContact CG2-CD1 4.29Å; I180-L205 HydrophobicContact CG2-CB 4.16Å; I180-L205 HydrophobicContact CG2-CD2 4.17Å; I180-V206 CarbonylContact C-O 3.52Å; I180-V206 WeakPolarHBondContact CA-O 3.49Å; I180-C207 HydrophobicContact CG1-CB 4.33Å; I180-W220 HydrophobicContact CD1-CH2 4.35Å; I180-W220 HydrophobicContact CD1-CZ3 3.83Å; I180-W220 HydrophobicContact CG1-CH2 4.08Å; I180-W220 HydrophobicContact CG1-CZ3 4.08Å; I180-W220 HydrophobicContact CG2-CH2 4.23Å; I180-W220 HydrophobicContact CG2-CZ3 4.49Å; I180-C286 HydrophobicContact CD1-CB 3.87Å; I180-C286 HydrophobicContact CG1-CB 3.94Å; I180-I306 HydrophobicContact CD1-CG2 3.87Å; I180-I306 HydrophobicContact CG1-CG2 3.81Å; I180-I308 HydrophobicContact CB-CD1 4.44Å; I180-I308 HydrophobicContact CB-CG2 4.31Å; I180-I308 HydrophobicContact CD1-CD1 4.2Å; I180-I308 HydrophobicContact CD1-CG1 4.05Å; I180-I308 HydrophobicContact CD1-CG2 4.15Å; I180-I308 HydrophobicContact CG2-CD1 3.85Å
181	L	86.8	Confident	81	Confident	32 Å²	32	65.2 Å²	65.2	17%	0.168	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	142.4	178.8	-53.9	173.5	0	0	0	109.5	V185 Q186 L205 V206	L181-V185 WeakPolarHBondContact CA-O 3.19Å; L181-Q186 HydrophobicContact CD2-CB 4.01Å; L181-Q186 HydrophobicContact CD2-CG 4.38Å; L181-L205 WeakPolarHBondContact O-CA 2.81Å; L181-V206 HydrophobicContact CB-CB 4.45Å; L181-V206 PolarHBondContact N-O 2.71Å; L181-V206 PolarHBondContact O-N 3.01Å
182	Y	82.3	Confident	80.7	Confident	3 Å²	3	65.2 Å²	65.2	1%	0.012	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	119.9	170.2	175.5	-127.1	0	0	0	108.6	N184 V185 L192 I203 L205 V388 E389	Y182-N184 PolarHBondContact O-N 3.04Å; Y182-V185 PolarHBondContact N-O 3.38Å; Y182-V185 WeakPolarHBondContact O-CB 3.42Å; Y182-V185 PolarHBondContact O-N 2.79Å; Y182-L192 HydrophobicContact CD1-CD1 3.92Å; Y182-L192 HydrophobicContact CD2-CD1 4.4Å; Y182-L192 HydrophobicContact CE1-CD1 4.39Å; Y182-L192 HydrophobicContact CG-CD1 3.92Å; Y182-I203 HydrophobicContact CD2-CB 4.47Å; Y182-I203 HydrophobicContact CE2-CB 3.76Å; Y182-I203 HydrophobicContact CE2-CG2 3.75Å; Y182-L205 HydrophobicContact CD2-CD2 4.01Å; Y182-L205 HydrophobicContact CG-CD2 4.33Å; Y182-V388 HydrophobicContact CD1-CB 4.31Å; Y182-V388 HydrophobicContact CD1-CG1 3.93Å; Y182-V388 HydrophobicContact CE1-CG1 4.48Å; Y182-E389 HydrophobicContact CE1-CG 4.36Å
183	Q	73.3	Confident	80.2	Confident	96 Å²	96	66.4 Å²	66.4	45%	0.449	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.5	45.6	-171.2	-55.2	-168.4	14.1	0	0	112.9	V185	Q183-V185 PolarHBondContact O-N 3.14Å; Q183-V185 VanDerWaalsContact O-N 3.09Å
184	N	69.7	Low	79.7	Confident	133 Å²	133	65.7 Å²	65.7	71%	0.711	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.1	4.7	-175.5	-57.9	-14.3	0	0	0	116.2	Y182	Y182-N184 PolarHBondContact O-N 3.04Å
185	V	66.5	Low	79	Confident	43 Å²	43	58.8 Å²	58.8	26%	0.261	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	137.5	172.9	-177.1	0	0	0	0	110.4	L181 Y182 Q183 V388	L181-V185 WeakPolarHBondContact CA-O 3.19Å; Y182-V185 PolarHBondContact N-O 3.38Å; Y182-V185 WeakPolarHBondContact O-CB 3.42Å; Y182-V185 PolarHBondContact O-N 2.79Å; Q183-V185 PolarHBondContact O-N 3.14Å; Q183-V185 VanDerWaalsContact O-N 3.09Å; V185-V388 HydrophobicContact CB-CG1 3.89Å; V185-V388 HydrophobicContact CG1-CG1 4.01Å; V185-V388 HydrophobicContact CG1-CG2 3.98Å; V185-V388 HydrophobicContact CG2-CG1 4.23Å
186	Q	72.9	Confident	78	Confident	116 Å²	116	61.4 Å²	61.4	54%	0.542	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	129.5	176.7	-168.2	175.7	22.3	0	0	111	L181 P188	L181-Q186 HydrophobicContact CD2-CB 4.01Å; L181-Q186 HydrophobicContact CD2-CG 4.38Å; Q186-P188 WeakPolarHBondContact O-CD 3.48Å
187	L	72.4	Confident	76.4	Confident	14 Å²	14	62.6 Å²	62.6	7%	0.073	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-74.5	117.6	-173.9	-69.3	168.2	0	0	0	112.2	I180 R190 L192 I308 V388	I180-L187 HydrophobicContact CG2-CD1 4.29Å; L187-R190 PolarHBondContact O-N 3.13Å; L187-L192 HydrophobicContact CD1-CB 4.27Å; L187-L192 HydrophobicContact CD1-CD1 4.36Å; L187-L192 HydrophobicContact CD2-CD1 3.84Å; L187-I308 HydrophobicContact CD1-CD1 3.63Å; L187-I308 HydrophobicContact CD1-CG2 4.06Å; L187-V388 HydrophobicContact CD2-CG2 4.14Å
188	P	65.8	Low	75	Confident	52 Å²	52	58 Å²	58	34%	0.338	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-64.6	145.8	176.6	26.6	-32	0	0	0	111	Q186 R190 K191 T386	Q186-P188 WeakPolarHBondContact O-CD 3.48Å; P188-R190 PolarHBondContact O-N 2.84Å; P188-K191 PolarHBondContact O-N 3.36Å; P188-T386 WeakPolarHBondContact CG-O 3.49Å
189	E	72.3	Confident	73.3	Confident	175 Å²	175	63.3 Å²	63.3	82%	0.818	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	52.9	12.1	-177.5	-57.9	-172.6	171.6	0	0	115.8	K191	E189-K191 PolarHBondContact O-N 3.04Å
190	R	80.6	Confident	71.5	Confident	121 Å²	121	62.5 Å²	62.5	46%	0.457	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	57.2	32.2	-167.4	-56.4	-179.2	178	-173.1	-4.1	112.8	L187 P188 I306 T307 I308 T309	L187-R190 PolarHBondContact O-N 3.13Å; P188-R190 PolarHBondContact O-N 2.84Å; R190-I306 HydrophobicContact CG-CD1 4.41Å; R190-T307 WeakPolarHBondContact CD-O 3.18Å; R190-I308 HydrophobicContact CB-CG2 4.04Å; R190-I308 CarbonylContact O-C 3.46Å; R190-I308 WeakPolarHBondContact O-CA 3.45Å; R190-I308 VanDerWaalsContact O-CB 3.32Å; R190-I308 WeakPolarHBondContact O-CB 3.49Å; R190-T309 PolarHBondContact O-N 2.83Å
191	K	79.5	Confident	70.3	Confident	77 Å²	77	68.6 Å²	68.6	34%	0.335	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	130.1	172.3	-81.5	-170	167	-161.7	0	112.2	P188 E189 I193 T309 D311	P188-K191 PolarHBondContact O-N 3.36Å; E189-K191 PolarHBondContact O-N 3.04Å; K191-I193 HydrophobicContact CB-CG1 4.43Å; K191-T309 CarbonylContact C-O 3.59Å; K191-T309 WeakPolarHBondContact CA-O 3.45Å; K191-D311 WeakPolarHBondContact CD-OD2 3.48Å; K191-D311 WeakPolarHBondContact CE-OD2 3.43Å; K191-D311 IonicContact NZ-OD2 3.94Å; K191-D311 PolarHBondContact NZ-OD2 3.28Å
192	L	84.4	Confident	69.8	Low	1 Å²	1	71.8 Å²	71.8	1%	0.005	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	95.4	167.2	179.1	64.7	0	0	0	108.7	Y182 L187 I194 I203 L205 I284 I308 T309 V310 D311	Y182-L192 HydrophobicContact CD1-CD1 3.92Å; Y182-L192 HydrophobicContact CD2-CD1 4.4Å; Y182-L192 HydrophobicContact CE1-CD1 4.39Å; Y182-L192 HydrophobicContact CG-CD1 3.92Å; L187-L192 HydrophobicContact CD1-CB 4.27Å; L187-L192 HydrophobicContact CD1-CD1 4.36Å; L187-L192 HydrophobicContact CD2-CD1 3.84Å; L192-I194 HydrophobicContact CD1-CG2 4.2Å; L192-I194 HydrophobicContact CG-CG2 4.08Å; L192-I203 HydrophobicContact CD2-CD1 3.66Å; L192-L205 HydrophobicContact CD1-CD2 4.42Å; L192-L205 HydrophobicContact CD2-CD1 4.16Å; L192-L205 HydrophobicContact CD2-CD2 4.12Å; L192-I284 HydrophobicContact CD2-CD1 4.34Å; L192-I308 HydrophobicContact CB-CD1 4.21Å; L192-I308 HydrophobicContact CD2-CD1 4.5Å; L192-T309 PolarHBondContact N-O 3.18Å; L192-V310 HydrophobicContact CB-CG2 4.46Å; L192-V310 HydrophobicContact CD2-CG2 4.33Å; L192-V310 WeakPolarHBondContact O-CA 3.49Å; L192-D311 PolarHBondContact O-N 3.04Å
193	I	78.5	Confident	69.8	Low	32 Å²	32	71.8 Å²	71.8	16%	0.164	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	123.1	174.6	-54.4	179.2	0	0	0	108.3	K191 D311 H313 V466	K191-I193 HydrophobicContact CB-CG1 4.43Å; I193-D311 HydrophobicContact CG1-CB 4.27Å; I193-H313 HydrophobicContact CG2-CB 4.16Å; I193-H313 VanDerWaalsContact CG2-CE1 3.44Å; I193-H313 WeakPolarHBondContact CG2-CE1 3.35Å; I193-H313 VanDerWaalsContact CG2-CG 3.47Å; I193-H313 VanDerWaalsContact CG2-ND1 3.34Å; I193-H313 WeakPolarHBondContact CG2-ND1 3.18Å; I193-V466 HydrophobicContact CG2-CG1 3.48Å; I193-V466 VanDerWaalsContact CG2-CG1 3.48Å
194	I	77.6	Confident	70.4	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	130.4	-178.6	43	167.9	0	0	0	112.8	L192 K275 L278 V310 D311 V312 H313	L192-I194 HydrophobicContact CD1-CG2 4.2Å; L192-I194 HydrophobicContact CG-CG2 4.08Å; I194-K275 HydrophobicContact CD1-CG 4.44Å; I194-L278 HydrophobicContact CD1-CB 3.96Å; I194-L278 HydrophobicContact CD1-CD1 3.61Å; I194-L278 HydrophobicContact CD1-CG 4.42Å; I194-V310 HydrophobicContact CD1-CG1 3.62Å; I194-V310 HydrophobicContact CG1-CG1 3.86Å; I194-D311 PolarHBondContact N-O 2.95Å; I194-V312 HydrophobicContact CD1-CG2 4.34Å; I194-V312 HydrophobicContact CG1-CG2 4.43Å; I194-H313 PolarHBondContact O-N 2.9Å
195	S	70.7	Confident	71.3	Confident	2 Å²	2	63.1 Å²	63.1	1%	0.014	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	140.7	175.5	46.9	0	0	0	0	114.3	D198 K275 H313 E389	S195-D198 WeakPolarHBondContact O-CB 3.5Å; S195-D198 VanDerWaalsContact OG-CG 3.31Å; S195-D198 PolarHBondContact OG-OD1 2.93Å; S195-K275 WeakPolarHBondContact O-CE 3.23Å; S195-K275 PolarHBondContact O-NZ 3.19Å; S195-K275 VanDerWaalsContact O-NZ 3.09Å; S195-K275 PolarHBondContact OG-NZ 3.13Å; S195-H313 CarbonylContact C-O 3.51Å; S195-H313 VanDerWaalsContact CA-O 3.26Å; S195-H313 WeakPolarHBondContact CA-O 3.3Å; S195-E389 WeakPolarHBondContact CB-OE2 3.46Å; S195-E389 PolarHBondContact N-OE2 2.98Å; S195-E389 PolarHBondContact OG-OE2 2.77Å
196	Q	67	Low	72.4	Confident	58 Å²	58	62.1 Å²	62.1	27%	0.271	32%	0.319	S	S	.	.	S	Bend	trans	-137.9	141.6	159.9	-67.7	-171.9	8.4	0	0	110.9	K275 V312 H313 T314 P315	Q196-K275 PolarHBondContact NE2-O 3.13Å; Q196-K275 VanDerWaalsContact NE2-O 3.09Å; Q196-V312 HydrophobicContact CG-CG1 4.17Å; Q196-H313 PolarHBondContact N-O 2.91Å; Q196-T314 WeakPolarHBondContact O-CA 3.36Å; Q196-T314 WeakPolarHBondContact O-CG2 3.49Å; Q196-P315 VanDerWaalsContact O-CD 3.22Å; Q196-P315 WeakPolarHBondContact O-CD 3.25Å
197	P	54	Low	73.2	Confident	122 Å²	122	56.6 Å²	56.6	79%	0.792	29%	0.293	S	S	*	.	S	Bend	cis	-75.4	151.9	-7.5	33.8	-35.5	0	0	0	111.6
198	D	55.5	Low	73.9	Confident	40 Å²	40	57.1 Å²	57.1	21%	0.214	30%	0.298	C	S	.	.			trans	-154.4	148.9	-171.6	-163.2	57.8	0	0	0	110.1	S195 I200 K275 R393	S195-D198 WeakPolarHBondContact O-CB 3.5Å; S195-D198 VanDerWaalsContact OG-CG 3.31Å; S195-D198 PolarHBondContact OG-OD1 2.93Å; D198-I200 VanDerWaalsContact C-N 3.3Å; D198-I200 PolarHBondContact O-N 3.29Å; D198-K275 VanDerWaalsContact CG-NZ 3.26Å; D198-K275 IonicContact OD2-NZ 2.86Å; D198-K275 PolarHBondContact OD2-NZ 2.87Å; D198-R393 IonicContact OD1-CZ 3.32Å; D198-R393 IonicContact OD1-NH2 3.17Å; D198-R393 PolarHBondContact OD1-NH2 3.07Å
199	P	52	Low	75	Confident	117 Å²	117	54.7 Å²	54.7	76%	0.76	28%	0.283	S	S	*	.	S	Bend	trans	-78.6	-10.5	-173.6	31.3	-33.9	0	0	0	113.9	L201	P199-L201 PolarHBondContact O-N 2.89Å
200	I	50.9	Low	75.6	Confident	73 Å²	73	49.5 Å²	49.5	37%	0.374	26%	0.263	S	S	.	.			trans	-86.2	104.8	-177.4	-57.3	178.2	0	0	0	110.1	D198 R202 K275	D198-I200 VanDerWaalsContact C-N 3.3Å; D198-I200 PolarHBondContact O-N 3.29Å; I200-R202 VanDerWaalsContact CG2-O 3.28Å; I200-R202 WeakPolarHBondContact CG2-O 3.26Å; I200-K275 WeakPolarHBondContact O-CB 3.33Å; I200-K275 WeakPolarHBondContact O-CD 3.42Å
201	L	62.9	Low	75.6	Confident	134 Å²	134	45.1 Å²	45.1	70%	0.702	26%	0.255	S	S	*	.			trans	-68.8	-34.6	-175.7	-87.5	154.9	0	0	0	114.7	P199 L274 K275	P199-L201 PolarHBondContact O-N 2.89Å; L201-L274 WeakPolarHBondContact O-CA 3.06Å; L201-K275 PolarHBondContact O-N 3.08Å
202	R	77.9	Confident	75.6	Confident	98 Å²	98	42 Å²	42	37%	0.37	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	141.4	-179.5	-85.8	-171.9	149.3	160.6	-7.5	111.5	I200 H257 I273 L274	I200-R202 VanDerWaalsContact CG2-O 3.28Å; I200-R202 WeakPolarHBondContact CG2-O 3.26Å; R202-H257 PolarHBondContact NH2-O 2.92Å; R202-I273 VanDerWaalsContact CA-O 3.31Å; R202-I273 WeakPolarHBondContact CA-O 2.98Å; R202-L274 HydrophobicContact CG-CD2 3.8Å; R202-L274 HydrophobicContact CG-CG 4.27Å
203	I	80.9	Confident	75.5	Confident	4 Å²	4	48.4 Å²	48.4	2%	0.021	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	163.5	165.3	61.8	167.2	0	0	0	110.4	Y182 L192 L205 S272 I273 K275 L278	Y182-I203 HydrophobicContact CD2-CB 4.47Å; Y182-I203 HydrophobicContact CE2-CB 3.76Å; Y182-I203 HydrophobicContact CE2-CG2 3.75Å; L192-I203 HydrophobicContact CD2-CD1 3.66Å; I203-L205 HydrophobicContact CD1-CD1 4.05Å; I203-L205 HydrophobicContact CD1-CG 4.24Å; I203-S272 VanDerWaalsContact O-CA 3.3Å; I203-S272 WeakPolarHBondContact O-CA 3.46Å; I203-S272 PolarHBondContact O-OG 3.26Å; I203-I273 HydrophobicContact CD1-CD1 4.11Å; I203-I273 HydrophobicContact CD1-CG1 3.93Å; I203-I273 HydrophobicContact CG1-CD1 4.37Å; I203-I273 HydrophobicContact CG1-CG1 3.63Å; I203-I273 PolarHBondContact N-O 3.06Å; I203-I273 PolarHBondContact O-N 2.69Å; I203-K275 HydrophobicContact CG2-CB 4.24Å; I203-K275 HydrophobicContact CG2-CD 4.29Å; I203-K275 HydrophobicContact CG2-CG 4.13Å; I203-L278 HydrophobicContact CD1-CD1 3.67Å; I203-L278 HydrophobicContact CG1-CD1 4.45Å
204	S	86.2	Confident	75.5	Confident	47 Å²	47	48.9 Å²	48.9	33%	0.329	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	122.3	179.4	-157.3	0	0	0	0	108	N270	S204-N270 PolarHBondContact OG-ND2 2.78Å; S204-N270 PolarHBondContact OG-OD1 2.68Å; S204-N270 VanDerWaalsContact OG-OD1 3.09Å
205	L	88.8	Confident	75.7	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	114.1	-173.4	-66.7	172.1	0	0	0	109.2	I180 L181 Y182 L192 I203 W220 N270 L271 I273 I284 I308	I180-L205 HydrophobicContact CG2-CB 4.16Å; I180-L205 HydrophobicContact CG2-CD2 4.17Å; L181-L205 WeakPolarHBondContact O-CA 2.81Å; Y182-L205 HydrophobicContact CD2-CD2 4.01Å; Y182-L205 HydrophobicContact CG-CD2 4.33Å; L192-L205 HydrophobicContact CD1-CD2 4.42Å; L192-L205 HydrophobicContact CD2-CD1 4.16Å; L192-L205 HydrophobicContact CD2-CD2 4.12Å; I203-L205 HydrophobicContact CD1-CD1 4.05Å; I203-L205 HydrophobicContact CD1-CG 4.24Å; L205-W220 HydrophobicContact CB-CH2 4Å; L205-W220 HydrophobicContact CB-CZ3 4.49Å; L205-W220 WeakPolarHBondContact O-CH2 3.35Å; L205-W220 VanDerWaalsContact O-CZ2 3.31Å; L205-W220 WeakPolarHBondContact O-CZ2 3.38Å; L205-N270 PolarHBondContact O-OD1 2.79Å; L205-L271 PolarHBondContact N-O 3.04Å; L205-L271 PolarHBondContact O-N 2.7Å; L205-I273 HydrophobicContact CD1-CD1 4.28Å; L205-I284 HydrophobicContact CD1-CD1 3.69Å; L205-I284 HydrophobicContact CD1-CG2 4.42Å; L205-I308 HydrophobicContact CD1-CD1 4.34Å
206	V	89.1	Confident	76.3	Confident	21 Å²	21	51.8 Å²	51.8	13%	0.127	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	122.6	179.7	-177.8	0	0	0	0	109.1	I180 L181 Q268 N270	I180-V206 CarbonylContact C-O 3.52Å; I180-V206 WeakPolarHBondContact CA-O 3.49Å; L181-V206 HydrophobicContact CB-CB 4.45Å; L181-V206 PolarHBondContact N-O 2.71Å; L181-V206 PolarHBondContact O-N 3.01Å; V206-Q268 HydrophobicContact CG1-CB 4.36Å; V206-N270 HydrophobicContact CG2-CB 4.36Å
207	C	90.1	Very high	77.2	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	123.4	167.8	-178.4	0	0	0	0	109.6	Q179 I180 F218 W220 Q268 S269 C286	Q179-C207 CarbonylContact O-C 3.56Å; Q179-C207 VanDerWaalsContact O-CA 3.31Å; Q179-C207 WeakPolarHBondContact O-CA 3.44Å; I180-C207 HydrophobicContact CG1-CB 4.33Å; C207-F218 HydrophobicContact CB-CD1 4.44Å; C207-W220 HydrophobicContact CB-CH2 3.68Å; C207-W220 HydrophobicContact CB-CZ2 3.41Å; C207-W220 VanDerWaalsContact CB-CZ2 3.41Å; C207-Q268 CarbonylContact O-C 3.43Å; C207-Q268 VanDerWaalsContact O-CA 3.24Å; C207-Q268 WeakPolarHBondContact O-CA 3.32Å; C207-S269 PolarHBondContact N-O 3.37Å; C207-S269 PolarHBondContact O-N 3.31Å; C207-C286 HydrophobicContact CB-CB 3.66Å; C207-C286 WeakPolarHBondContact CB-SG 3.19Å; C207-C286 WeakPolarHBondContact SG-CB 3.19Å; C207-C286 CovalentContact SG-SG 2.02Å; C207-C286 PolarHBondContact SG-SG 3.45Å
208	S	88.2	Confident	78.8	Confident	25 Å²	25	48 Å²	48	18%	0.175	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	137.6	177.4	-179.8	0	0	0	0	111	P178 Q179	P178-S208 VanDerWaalsContact CA-O 3.31Å; P178-S208 WeakPolarHBondContact CA-O 2.86Å; Q179-S208 PolarHBondContact N-O 2.81Å; Q179-S208 PolarHBondContact O-N 3.24Å
209	A	87.5	Confident	80.3	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.008	28%	0.281	C	S	.	.			trans	-146.8	72.1	179.8	0	0	0	0	0	112.3	P178 P216 F218 E267 V288	P178-A209 HydrophobicContact CB-CB 4.21Å; A209-P216 WeakPolarHBondContact O-CG 3.25Å; A209-F218 HydrophobicContact CB-CE1 3.72Å; A209-F218 HydrophobicContact CB-CZ 3.84Å; A209-E267 PolarHBondContact N-O 3.24Å; A209-V288 HydrophobicContact CB-CB 4.3Å; A209-V288 HydrophobicContact CB-CG1 3.8Å; A209-V288 HydrophobicContact CB-CG2 3.98Å
210	V	85.4	Confident	82.1	Confident	67 Å²	67	44.3 Å²	44.3	41%	0.406	25%	0.245	S	C	.	.			trans	-62.2	151.3	-174.7	-148.9	0	0	0	0	113.9	N176 E267	N176-V210 VanDerWaalsContact CB-O 3.27Å; N176-V210 WeakPolarHBondContact CB-O 3.22Å; N176-V210 PolarHBondContact N-O 2.9Å; N176-V210 PolarHBondContact ND2-O 3.22Å; V210-E267 WeakPolarHBondContact CG1-OE2 3.09Å
211	G	79.8	Confident	83.8	Confident	28 Å²	28	42.3 Å²	42.3	29%	0.289	24%	0.235	S	C	.	.	S	Bend	trans	93.9	5.8	160	0	0	0	0	0	117.6	E267	G211-E267 PolarHBondContact N-OE1 3.12Å
212	G	80	Confident	84.9	Confident	13 Å²	13	36 Å²	36	13%	0.134	20%	0.202	C	C	.	.			trans	-80.1	145.3	-175.9	0	0	0	0	0	114.4	P214	G212-P214 CarbonylContact C-O 3.58Å; G212-P214 VanDerWaalsContact C-O 3.3Å
213	R	83.3	Confident	85.2	Confident	134 Å²	134	34.1 Å²	34.1	51%	0.506	20%	0.199	S	C	.	.	B	Isolated β-bridge	trans	-138.2	118.4	170.2	-149.7	178.8	-162.1	-175.2	5.6	111.8	L172 I173 N290	L172-R213 WeakPolarHBondContact CA-O 3.39Å; I173-R213 HydrophobicContact CB-CB 3.88Å; I173-R213 HydrophobicContact CD1-CB 4.13Å; I173-R213 HydrophobicContact CG1-CB 3.98Å; I173-R213 PolarHBondContact N-O 3.01Å; I173-R213 PolarHBondContact O-N 3.26Å; R213-N290 PolarHBondContact N-ND2 2.84Å; R213-N290 PolarHBondContact O-ND2 2.88Å
214	P	78.5	Confident	85.2	Confident	42 Å²	42	42.6 Å²	42.6	27%	0.273	23%	0.231	S	C	.	.	S	Bend	cis	-60.1	172.8	-9.6	29.3	-37.1	0	0	0	112.3	G212 N290 S291	G212-P214 CarbonylContact C-O 3.58Å; G212-P214 VanDerWaalsContact C-O 3.3Å; P214-N290 PolarHBondContact O-ND2 2.77Å; P214-S291 WeakPolarHBondContact CG-OG 3.25Å
215	A	81.2	Confident	85	Confident	54 Å²	54	44.5 Å²	44.5	45%	0.446	24%	0.235	S	C	.	.	P	Polyproline II helix	trans	-53.3	150.9	-175	0	0	0	0	0	113.1
216	P	83.9	Confident	84.5	Confident	10 Å²	10	48.5 Å²	48.5	7%	0.065	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-69.1	143.4	179.7	1.6	10.7	0	0	0	112.2	P175 A209 F218 V288	P175-P216 HydrophobicContact CB-CB 4.33Å; P175-P216 HydrophobicContact CB-CG 4.12Å; P175-P216 HydrophobicContact CG-CB 4.32Å; A209-P216 WeakPolarHBondContact O-CG 3.25Å; P216-F218 HydrophobicContact CB-CE2 3.9Å; P216-F218 HydrophobicContact CB-CZ 4.02Å; P216-F218 HydrophobicContact CG-CE2 4.14Å; P216-F218 HydrophobicContact CG-CZ 4.13Å; P216-V288 HydrophobicContact CB-CG1 3.33Å
217	T	85.3	Confident	83.9	Confident	79 Å²	79	47.9 Å²	47.9	49%	0.485	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	127.6	168.5	56	0	0	0	0	109.8	V288 S289	T217-V288 VanDerWaalsContact O-CA 3.3Å; T217-V288 WeakPolarHBondContact O-CA 3.45Å; T217-S289 PolarHBondContact N-O 3.25Å; T217-S289 PolarHBondContact O-N 3.46Å; T217-S289 PolarHBondContact OG1-O 2.85Å; T217-S289 PolarHBondContact OG1-OG 2.88Å; T217-S289 VanDerWaalsContact OG1-OG 3.06Å
218	F	88	Confident	82.7	Confident	21 Å²	21	50 Å²	50	9%	0.092	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	137	-175.5	-63.7	-95.3	0	0	0	111.9	C207 A209 P216 E267 V288	C207-F218 HydrophobicContact CB-CD1 4.44Å; A209-F218 HydrophobicContact CB-CE1 3.72Å; A209-F218 HydrophobicContact CB-CZ 3.84Å; P216-F218 HydrophobicContact CB-CE2 3.9Å; P216-F218 HydrophobicContact CB-CZ 4.02Å; P216-F218 HydrophobicContact CG-CE2 4.14Å; P216-F218 HydrophobicContact CG-CZ 4.13Å; F218-E267 VanDerWaalsContact CZ-C 3.42Å; F218-E267 WeakPolarHBondContact CZ-O 3.35Å; F218-V288 HydrophobicContact CD1-CG2 3.51Å; F218-V288 HydrophobicContact CE1-CG1 4.36Å; F218-V288 HydrophobicContact CE1-CG2 3.65Å; F218-V288 HydrophobicContact CG-CG2 4.36Å
219	K	86.8	Confident	81.2	Confident	78 Å²	78	51 Å²	51	34%	0.339	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	129.6	172.7	-74.3	168	166.1	-81.6	0	108.9	E226 S287	K219-E226 HydrophobicContact CB-CG 4.49Å; K219-E226 IonicContact NZ-OE1 3.22Å; K219-E226 PolarHBondContact NZ-OE1 2.95Å; K219-E226 IonicContact NZ-OE2 2.66Å; K219-E226 PolarHBondContact NZ-OE2 3.07Å; K219-S287 PolarHBondContact N-O 3.06Å; K219-S287 PolarHBondContact O-N 2.84Å
220	W	88.5	Confident	79.6	Confident	1 Å²	1	58.2 Å²	58.2	0%	0.004	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	145.1	170.9	-70.5	93.9	0	0	0	110.5	I180 L205 C207 E226 I227 I260 S269 L271 I284 V285 C286	I180-W220 HydrophobicContact CD1-CH2 4.35Å; I180-W220 HydrophobicContact CD1-CZ3 3.83Å; I180-W220 HydrophobicContact CG1-CH2 4.08Å; I180-W220 HydrophobicContact CG1-CZ3 4.08Å; I180-W220 HydrophobicContact CG2-CH2 4.23Å; I180-W220 HydrophobicContact CG2-CZ3 4.49Å; L205-W220 HydrophobicContact CB-CH2 4Å; L205-W220 HydrophobicContact CB-CZ3 4.49Å; L205-W220 WeakPolarHBondContact O-CH2 3.35Å; L205-W220 VanDerWaalsContact O-CZ2 3.31Å; L205-W220 WeakPolarHBondContact O-CZ2 3.38Å; C207-W220 HydrophobicContact CB-CH2 3.68Å; C207-W220 HydrophobicContact CB-CZ2 3.41Å; C207-W220 VanDerWaalsContact CB-CZ2 3.41Å; W220-E226 CarbonylContact O-C 3.54Å; W220-E226 WeakPolarHBondContact O-CA 3.47Å; W220-I227 HydrophobicContact CB-CB 4.46Å; W220-I227 HydrophobicContact CB-CD1 3.82Å; W220-I227 HydrophobicContact CB-CG1 4.23Å; W220-I227 PolarHBondContact O-N 2.72Å; W220-I260 HydrophobicContact CB-CD1 4.07Å; W220-I260 HydrophobicContact CG-CD1 4.32Å; W220-S269 PolarHBondContact NE1-OG 3.15Å; W220-L271 HydrophobicContact CB-CD2 4.39Å; W220-L271 HydrophobicContact CD2-CB 3.75Å; W220-L271 HydrophobicContact CD2-CD2 3.75Å; W220-L271 HydrophobicContact CD2-CG 4.32Å; W220-L271 HydrophobicContact CE3-CB 4.12Å; W220-L271 HydrophobicContact CE3-CD2 3.5Å; W220-L271 VanDerWaalsContact CE3-CD2 3.5Å; W220-L271 HydrophobicContact CE3-CG 4.44Å; W220-L271 HydrophobicContact CG-CB 4.22Å; W220-L271 HydrophobicContact CG-CD2 4.16Å; W220-L271 HydrophobicContact CH2-CB 4.03Å; W220-L271 HydrophobicContact CZ2-CB 3.68Å; W220-L271 HydrophobicContact CZ3-CB 4.25Å; W220-L271 HydrophobicContact CZ3-CD2 3.93Å; W220-I284 HydrophobicContact CE3-CG2 3.97Å; W220-I284 HydrophobicContact CZ3-CG2 3.95Å; W220-V285 CarbonylContact C-O 3.59Å; W220-V285 WeakPolarHBondContact CA-O 3.34Å; W220-C286 HydrophobicContact CD2-CB 4.48Å; W220-C286 HydrophobicContact CE3-CB 4.11Å; W220-C286 HydrophobicContact CH2-CB 4.4Å; W220-C286 HydrophobicContact CZ3-CB 4.07Å
221	L	88.4	Confident	77.5	Confident	31 Å²	31	61 Å²	61	16%	0.162	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	144.9	170.7	-44.8	89.2	0	0	0	109.4	H225 E226 V285	L221-H225 CarbonylContact C-O 3.56Å; L221-H225 VanDerWaalsContact CA-O 3.23Å; L221-H225 WeakPolarHBondContact CA-O 3.42Å; L221-H225 WeakPolarHBondContact CB-O 3.42Å; L221-E226 HydrophobicContact CD2-CB 4Å; L221-E226 HydrophobicContact CG-CB 4.06Å; L221-E226 HydrophobicContact CG-CG 4.3Å; L221-V285 HydrophobicContact CB-CB 4.07Å; L221-V285 HydrophobicContact CB-CG2 4.38Å; L221-V285 HydrophobicContact CD1-CB 3.83Å; L221-V285 HydrophobicContact CD1-CG1 3.96Å; L221-V285 PolarHBondContact N-O 3.22Å; L221-V285 PolarHBondContact O-N 2.99Å
222	I	85.7	Confident	75.6	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.005	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	129.7	169.2	-68.2	171	0	0	0	107.8	R224 H225 I227 L256 I273 E283 I284	I222-R224 PolarHBondContact O-N 2.85Å; I222-H225 PolarHBondContact N-O 2.89Å; I222-H225 WeakPolarHBondContact O-CB 3.39Å; I222-H225 PolarHBondContact O-N 3.25Å; I222-I227 HydrophobicContact CD1-CD1 3.7Å; I222-I227 HydrophobicContact CD1-CG1 4.45Å; I222-I227 HydrophobicContact CG1-CD1 3.94Å; I222-I227 HydrophobicContact CG1-CG1 4.4Å; I222-L256 HydrophobicContact CD1-CD1 4.08Å; I222-L256 HydrophobicContact CG2-CD1 4.11Å; I222-I273 HydrophobicContact CD1-CD1 4.4Å; I222-I273 HydrophobicContact CD1-CG2 4.44Å; I222-E283 CarbonylContact C-O 3.45Å; I222-E283 WeakPolarHBondContact CA-O 3.42Å; I222-I284 HydrophobicContact CG1-CG1 4.36Å; I222-I284 HydrophobicContact CG1-CG2 4.35Å
223	N	84.2	Confident	73.3	Confident	60 Å²	60	71.7 Å²	71.7	32%	0.321	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.1	45	-172.4	-65.8	-26.8	0	0	0	112.1	H225 D282 E283	N223-H225 PolarHBondContact O-CE1 3.19Å; N223-H225 PolarHBondContact O-N 2.61Å; N223-H225 VanDerWaalsContact O-N 3.11Å; N223-H225 PolarHBondContact O-ND1 3.29Å; N223-D282 PolarHBondContact ND2-OD1 2.88Å; N223-D282 WeakPolarHBondContact OD1-CA 3.06Å; N223-E283 PolarHBondContact N-O 3.44Å; N223-E283 PolarHBondContact OD1-N 3.1Å
224	R	80.7	Confident	70.9	Confident	182 Å²	182	68.3 Å²	68.3	69%	0.687	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.6	7.4	-177.2	-48.6	-176.3	-176.3	-152.8	-7	115.9	I222 E283	I222-R224 PolarHBondContact O-N 2.85Å; R224-E283 VanDerWaalsContact CG-OE2 3.28Å; R224-E283 WeakPolarHBondContact CG-OE2 3.48Å; R224-E283 IonicContact CZ-OE1 3.85Å; R224-E283 IonicContact CZ-OE2 3.34Å; R224-E283 IonicContact NE-OE1 2.71Å; R224-E283 IonicContact NE-OE2 3.1Å; R224-E283 PolarHBondContact NE-OE2 3Å; R224-E283 IonicContact NH2-OE1 2.72Å; R224-E283 PolarHBondContact NH2-OE1 3.11Å; R224-E283 IonicContact NH2-OE2 2.66Å; R224-E283 PolarHBondContact NH2-OE2 2.84Å
225	H	81.1	Confident	68.7	Low	87 Å²	87	72.2 Å²	72.2	40%	0.403	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	118.8	173.5	-63.8	83.1	0	0	0	109.7	L221 I222 N223 I227 L249 W253	L221-H225 CarbonylContact C-O 3.56Å; L221-H225 VanDerWaalsContact CA-O 3.23Å; L221-H225 WeakPolarHBondContact CA-O 3.42Å; L221-H225 WeakPolarHBondContact CB-O 3.42Å; I222-H225 PolarHBondContact N-O 2.89Å; I222-H225 WeakPolarHBondContact O-CB 3.39Å; I222-H225 PolarHBondContact O-N 3.25Å; N223-H225 PolarHBondContact O-CE1 3.19Å; N223-H225 PolarHBondContact O-N 2.61Å; N223-H225 VanDerWaalsContact O-N 3.11Å; N223-H225 PolarHBondContact O-ND1 3.29Å; H225-I227 PolarHBondContact O-N 2.8Å; H225-L249 HydrophobicContact CB-CD2 4.09Å; H225-L249 VanDerWaalsContact CD2-CD2 3.42Å; H225-L249 WeakPolarHBondContact CD2-CD2 3.31Å; H225-W253 HydrophobicContact CB-CZ2 4.04Å
226	E	78.1	Confident	66.6	Low	83 Å²	83	73.6 Å²	73.6	39%	0.388	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	123.2	-178.3	-169.5	-175.2	142	0	0	111.6	K219 W220 L221 P228 W253	K219-E226 HydrophobicContact CB-CG 4.49Å; K219-E226 IonicContact NZ-OE1 3.22Å; K219-E226 PolarHBondContact NZ-OE1 2.95Å; K219-E226 IonicContact NZ-OE2 2.66Å; K219-E226 PolarHBondContact NZ-OE2 3.07Å; W220-E226 CarbonylContact O-C 3.54Å; W220-E226 WeakPolarHBondContact O-CA 3.47Å; L221-E226 HydrophobicContact CD2-CB 4Å; L221-E226 HydrophobicContact CG-CB 4.06Å; L221-E226 HydrophobicContact CG-CG 4.3Å; E226-P228 WeakPolarHBondContact O-CD 3.47Å; E226-W253 WeakPolarHBondContact O-CH2 3.26Å; E226-W253 WeakPolarHBondContact O-CZ2 3.3Å
227	I	77.2	Confident	64.6	Low	8 Å²	8	76.5 Å²	76.5	4%	0.041	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-72.8	118.6	173.6	-45.2	178.7	0	0	0	107.8	W220 I222 H225 N229 P258 I260 L271	W220-I227 HydrophobicContact CB-CB 4.46Å; W220-I227 HydrophobicContact CB-CD1 3.82Å; W220-I227 HydrophobicContact CB-CG1 4.23Å; W220-I227 PolarHBondContact O-N 2.72Å; I222-I227 HydrophobicContact CD1-CD1 3.7Å; I222-I227 HydrophobicContact CD1-CG1 4.45Å; I222-I227 HydrophobicContact CG1-CD1 3.94Å; I222-I227 HydrophobicContact CG1-CG1 4.4Å; H225-I227 PolarHBondContact O-N 2.8Å; I227-N229 PolarHBondContact O-N 2.71Å; I227-P258 HydrophobicContact CD1-CB 4.08Å; I227-P258 HydrophobicContact CG2-CB 4.09Å; I227-P258 HydrophobicContact CG2-CG 3.88Å; I227-I260 HydrophobicContact CB-CD1 3.92Å; I227-I260 HydrophobicContact CD1-CD1 4.49Å; I227-I260 HydrophobicContact CG2-CD1 3.8Å; I227-L271 HydrophobicContact CD1-CD1 3.76Å; I227-L271 HydrophobicContact CD1-CD2 4.09Å
228	P	64	Low	62.5	Low	45 Å²	45	76.7 Å²	76.7	29%	0.292	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-69.1	121.1	177.9	28.6	-34	0	0	0	109.3	E226 L230 W253	E226-P228 WeakPolarHBondContact O-CD 3.47Å; P228-L230 PolarHBondContact O-N 2.66Å; P228-L230 VanDerWaalsContact O-N 3.14Å; P228-W253 HydrophobicContact CG-CH2 4.26Å; P228-W253 HydrophobicContact CG-CZ3 3.91Å
229	N	58.5	Low	60.9	Low	47 Å²	47	78.1 Å²	78.1	25%	0.251	39%	0.393	S	S	.	.			trans	-70	110.5	171.2	-169.5	1.9	0	0	0	109	I227 E231 V232 N262	I227-N229 PolarHBondContact O-N 2.71Å; N229-E231 VanDerWaalsContact C-N 3.28Å; N229-E231 PolarHBondContact O-N 3.19Å; N229-V232 WeakPolarHBondContact O-CG2 3.48Å; N229-N262 PolarHBondContact ND2-ND2 2.62Å
230	L	52.4	Low	59.6	Low	151 Å²	151	78.5 Å²	78.5	79%	0.791	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-0.9	-166.2	-91	154.1	0	0	0	114.5	P228 V232	P228-L230 PolarHBondContact O-N 2.66Å; P228-L230 VanDerWaalsContact O-N 3.14Å; L230-V232 VanDerWaalsContact C-N 3.29Å; L230-V232 PolarHBondContact O-N 2.77Å
231	E	42.7	Very low	58.1	Low	127 Å²	127	82.5 Å²	82.5	59%	0.593	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	3.7	179.1	-59.8	-157.8	111	0	0	114.8	N229 K233	N229-E231 VanDerWaalsContact C-N 3.28Å; N229-E231 PolarHBondContact O-N 3.19Å; E231-K233 PolarHBondContact O-N 2.67Å
232	V	38.4	Very low	56.4	Low	94 Å²	94	81.8 Å²	81.8	57%	0.57	42%	0.421	S	S	*	.			trans	-70.4	97.7	-174.8	179.9	0	0	0	0	112.2	N229 L230 T234	N229-V232 WeakPolarHBondContact O-CG2 3.48Å; L230-V232 VanDerWaalsContact C-N 3.29Å; L230-V232 PolarHBondContact O-N 2.77Å; V232-T234 VanDerWaalsContact C-N 3.26Å; V232-T234 HydrophobicContact CG1-CG2 3.54Å; V232-T234 PolarHBondContact O-N 2.89Å
233	K	32.6	Very low	54.9	Low	171 Å²	171	86.3 Å²	86.3	74%	0.743	45%	0.448	S	S	*	.			trans	-69.3	62.1	174.6	-61.8	161.8	-172.7	152.9	0	113	E231	E231-K233 PolarHBondContact O-N 2.67Å
234	T	31.7	Very low	53.6	Low	63 Å²	63	85.9 Å²	85.9	39%	0.387	45%	0.454	S	S	.	.			trans	-110	129.9	180	48.4	0	0	0	0	114.6	V232 T236 L1283	V232-T234 VanDerWaalsContact C-N 3.26Å; V232-T234 HydrophobicContact CG1-CG2 3.54Å; V232-T234 PolarHBondContact O-N 2.89Å; T234-T236 PolarHBondContact O-N 3.29Å; T234-L1283 WeakPolarHBondContact O-CD1 2.99Å
235	K	33.3	Very low	52.2	Low	124 Å²	124	80 Å²	80	54%	0.539	43%	0.433	S	S	.	.			trans	-88.7	33.2	-175.8	-58.7	-176.3	-170.6	-167.7	0	114.9	L1195 N1196 L1283	K235-L1195 WeakPolarHBondContact CE-O 3.19Å; K235-L1195 PolarHBondContact NZ-O 2.9Å; K235-N1196 VanDerWaalsContact CG-OD1 3.26Å; K235-N1196 WeakPolarHBondContact CG-OD1 3.36Å; K235-L1283 VanDerWaalsContact C-CD2 3.42Å; K235-L1283 WeakPolarHBondContact O-CD2 3.25Å
236	T	38.1	Very low	50.5	Low	83 Å²	83	79.1 Å²	79.1	51%	0.509	43%	0.43	S	S	.	.			trans	-110.7	122.8	-169.8	27.9	0	0	0	0	114.2	T234 M238 L1283	T234-T236 PolarHBondContact O-N 3.29Å; T236-M238 WeakPolarHBondContact O-CG 3.44Å; T236-M238 PolarHBondContact O-N 3.36Å; T236-L1283 WeakPolarHBondContact O-CD1 3.43Å
237	P	41.3	Very low	49.3	Very low	71 Å²	71	75.4 Å²	75.4	46%	0.461	41%	0.413	S	S	.	.			trans	-66.9	61.7	173.8	-23.5	35.8	0	0	0	116.5	S239 L1283	P237-S239 PolarHBondContact O-N 3.48Å; P237-L1283 HydrophobicContact CG-CD2 4.01Å
238	M	40.4	Very low	48.2	Very low	82 Å²	82	77.4 Å²	77.4	40%	0.404	42%	0.423	S	S	.	.			trans	-23.8	100.6	150.5	-73	167.3	69	0	0	112.3	T236 S1284 L1285 D1286	T236-M238 WeakPolarHBondContact O-CG 3.44Å; T236-M238 PolarHBondContact O-N 3.36Å; M238-S1284 CarbonylContact O-C 3.55Å; M238-S1284 WeakPolarHBondContact O-CA 3.15Å; M238-S1284 WeakPolarHBondContact O-CB 3.31Å; M238-S1284 VanDerWaalsContact O-O 3.09Å; M238-L1285 PolarHBondContact O-N 3.48Å; M238-D1286 WeakPolarHBondContact CA-OD2 3.12Å; M238-D1286 HydrophobicContact CB-CB 3.76Å; M238-D1286 VanDerWaalsContact CB-CG 3.42Å; M238-D1286 WeakPolarHBondContact CB-OD2 3.46Å; M238-D1286 HydrophobicContact CE-CB 4.1Å; M238-D1286 VanDerWaalsContact CG-OD2 3.29Å; M238-D1286 WeakPolarHBondContact CG-OD2 3.3Å; M238-D1286 WeakPolarHBondContact O-CA 3.42Å; M238-D1286 PolarHBondContact O-N 3.07Å
239	S	55.5	Low	47.5	Very low	51 Å²	51	77 Å²	77	36%	0.357	42%	0.418	S	S	.	.			trans	-45.8	159.7	-163	36.3	0	0	0	0	119.1	P237 L1285 D1286 L1287	P237-S239 PolarHBondContact O-N 3.48Å; S239-L1285 CarbonylContact O-C 3.53Å; S239-D1286 PolarHBondContact N-OD1 3.48Å; S239-D1286 CarbonylContact O-C 3.58Å; S239-D1286 WeakPolarHBondContact O-CA 3.41Å; S239-D1286 PolarHBondContact O-N 2.75Å; S239-D1286 PolarHBondContact OG-OD1 2.66Å; S239-L1287 PolarHBondContact O-N 2.69Å; S239-L1287 WeakPolarHBondContact OG-CB 3.15Å
240	P	59.2	Low	47.2	Very low	86 Å²	86	78.3 Å²	78.3	56%	0.558	43%	0.425	S	S	*	.	S	Bend	trans	-97.5	101.6	-161.6	35.5	-36	0	0	0	117.4
241	N	56.3	Low	47.3	Very low	85 Å²	85	77.8 Å²	77.8	46%	0.455	42%	0.417	S	S	.	.			trans	-167.2	61.4	161.1	-168.1	14.1	0	0	0	115.8	V243 L1285 L1287 N1289	N241-V243 PolarHBondContact O-N 2.78Å; N241-L1285 PolarHBondContact N-O 2.75Å; N241-L1287 HydrophobicContact CB-CD1 4.38Å; N241-L1287 HydrophobicContact CB-CD2 3.38Å; N241-L1287 HydrophobicContact CB-CG 3.51Å; N241-N1289 VanDerWaalsContact O-CA 3.26Å; N241-N1289 WeakPolarHBondContact O-CA 3.19Å; N241-N1289 WeakPolarHBondContact O-CB 3.45Å
242	D	52.7	Low	48	Very low	16 Å²	16	75.2 Å²	75.2	9%	0.086	41%	0.409	C	S	.	.			trans	-79.1	66.8	-169.6	-166.6	-106.9	0	0	0	116.3	N247 L1285 G1290 R1291	D242-N247 PolarHBondContact OD1-ND2 2.89Å; D242-L1285 HydrophobicContact CB-CB 3.7Å; D242-L1285 HydrophobicContact CB-CD1 4.48Å; D242-L1285 HydrophobicContact CB-CD2 3.21Å; D242-L1285 HydrophobicContact CB-CG 3.19Å; D242-L1285 PolarHBondContact N-O 3.35Å; D242-G1290 CarbonylContact O-C 3.37Å; D242-G1290 VanDerWaalsContact O-CA 3.25Å; D242-G1290 WeakPolarHBondContact O-CA 3.18Å; D242-G1290 WeakPolarHBondContact OD1-CA 3.05Å; D242-G1290 WeakPolarHBondContact OD2-CA 3.44Å; D242-G1290 PolarHBondContact OD2-N 3.03Å; D242-R1291 PolarHBondContact O-N 2.75Å
243	V	55.4	Low	49.1	Very low	96 Å²	96	71.2 Å²	71.2	58%	0.582	38%	0.384	S	S	*	.	S	Bend	trans	-114.9	-20.4	-177.4	-162	0	0	0	0	118.7	N241 G1290 R1291	N241-V243 PolarHBondContact O-N 2.78Å; V243-G1290 CarbonylContact C-O 3.58Å; V243-G1290 VanDerWaalsContact C-O 3.28Å; V243-G1290 CarbonylContact O-C 3.58Å; V243-R1291 WeakPolarHBondContact O-CA 3.13Å; V243-R1291 WeakPolarHBondContact O-CB 3.46Å; V243-R1291 PolarHBondContact O-N 2.89Å
244	A	55.4	Low	50.2	Low	52 Å²	52	65.3 Å²	65.3	43%	0.43	37%	0.371	S	S	.	.	S	Bend	trans	-156.6	45.8	-171.6	0	0	0	0	0	127.2	N248 N1289 G1290	A244-N248 VanDerWaalsContact C-CB 3.46Å; A244-N248 PolarHBondContact O-ND2 2.95Å; A244-N1289 VanDerWaalsContact C-ND2 3.28Å; A244-N1289 VanDerWaalsContact CA-ND2 3.29Å; A244-N1289 WeakPolarHBondContact CA-ND2 3.25Å; A244-N1289 WeakPolarHBondContact CB-ND2 3.31Å; A244-N1289 PolarHBondContact N-ND2 2.74Å; A244-G1290 CarbonylContact C-O 3.44Å; A244-G1290 WeakPolarHBondContact CA-O 3.48Å; A244-G1290 PolarHBondContact N-O 2.75Å
245	K	51.1	Low	51.8	Low	58 Å²	58	68.3 Å²	68.3	25%	0.252	38%	0.379	S	S	.	.	S	Bend		144.7	-168.8	-54.7	-51.3	-169.5	-74.7	78.1	0	116.7	N247 N248 L249 Y1288 N1289 G1290	K245-N247 PolarHBondContact O-N 2.9Å; K245-N248 CarbonylContact O-C 3.49Å; K245-N248 VanDerWaalsContact O-CA 3.22Å; K245-N248 WeakPolarHBondContact O-CA 3.01Å; K245-N248 WeakPolarHBondContact O-CB 3.31Å; K245-N248 PolarHBondContact O-N 2.7Å; K245-L249 HydrophobicContact CD-CD1 4.49Å; K245-L249 HydrophobicContact CG-CD1 4.25Å; K245-L249 HydrophobicContact CG-CG 4.47Å; K245-L249 WeakPolarHBondContact O-CG 3.25Å; K245-L249 PolarHBondContact O-N 3.01Å; K245-Y1288 WeakPolarHBondContact CB-O 3.4Å; K245-Y1288 HydrophobicContact CD-CD1 4.49Å; K245-Y1288 PolarHBondContact NZ-O 2.85Å; K245-N1289 CarbonylContact C-O 2.92Å; K245-N1289 VanDerWaalsContact C-O 3.31Å; K245-N1289 WeakPolarHBondContact CA-O 3.39Å; K245-N1289 HydrophobicContact CB-CB 4.42Å; K245-N1289 WeakPolarHBondContact CB-O 3.45Å; K245-N1289 WeakPolarHBondContact CB-OD1 3.01Å; K245-N1289 PolarHBondContact NZ-OD1 2.6Å; K245-G1290 CarbonylContact C-O 3.53Å; K245-G1290 VanDerWaalsContact C-O 3.3Å; K245-G1290 VanDerWaalsContact CA-O 3.25Å; K245-G1290 WeakPolarHBondContact CA-O 3.46Å; K245-G1290 PolarHBondContact N-O 2.6Å
246	M	47	Very low	53.6	Low	69 Å²	69	62.8 Å²	62.8	34%	0.34	36%	0.355	S	S	.	.	H	α-helix	trans	-50.2	-49.1	-178.1	-176.8	179.9	71.8	0	0	112.6	N248 L249 L250 N1289	M246-N248 VanDerWaalsContact C-N 3.33Å; M246-L249 CarbonylContact O-C 3.13Å; M246-L249 WeakPolarHBondContact O-CA 3.39Å; M246-L249 VanDerWaalsContact O-CB 3.32Å; M246-L249 WeakPolarHBondContact O-CB 3.42Å; M246-L249 PolarHBondContact O-N 3.4Å; M246-L250 HydrophobicContact CG-CD1 4.41Å; M246-L250 VanDerWaalsContact O-CD1 3.31Å; M246-L250 WeakPolarHBondContact O-CD1 3.49Å; M246-L250 PolarHBondContact O-N 2.85Å; M246-N1289 PolarHBondContact N-O 2.96Å
247	N	53.2	Low	55.3	Low	5 Å²	5	64.2 Å²	64.2	3%	0.027	36%	0.356	C	S	.	.	H	α-helix	trans	-74.6	-20.5	173.7	-75.1	-56.8	0	0	0	113.3	D242 K245 L249 L250 K251 R1291 E1292 P1293	D242-N247 PolarHBondContact OD1-ND2 2.89Å; K245-N247 PolarHBondContact O-N 2.9Å; N247-L249 VanDerWaalsContact C-N 3.29Å; N247-L250 PolarHBondContact O-N 3.02Å; N247-K251 PolarHBondContact O-N 2.87Å; N247-R1291 HydrophobicContact CB-CB 4.13Å; N247-R1291 WeakPolarHBondContact CB-O 3.42Å; N247-E1292 VanDerWaalsContact CG-C 3.49Å; N247-P1293 VanDerWaalsContact ND2-CD 3.35Å; N247-P1293 WeakPolarHBondContact ND2-CD 3.13Å; N247-P1293 WeakPolarHBondContact OD1-CA 3.14Å
248	N	53.3	Low	56.8	Low	49 Å²	49	62.5 Å²	62.5	26%	0.262	35%	0.345	S	S	.	.	H	α-helix	trans	-68.2	-34.7	167.9	-148.6	-3.3	0	0	0	110.1	A244 K245 M246 K251 V252 G1290 R1291	A244-N248 VanDerWaalsContact C-CB 3.46Å; A244-N248 PolarHBondContact O-ND2 2.95Å; K245-N248 CarbonylContact O-C 3.49Å; K245-N248 VanDerWaalsContact O-CA 3.22Å; K245-N248 WeakPolarHBondContact O-CA 3.01Å; K245-N248 WeakPolarHBondContact O-CB 3.31Å; K245-N248 PolarHBondContact O-N 2.7Å; M246-N248 VanDerWaalsContact C-N 3.33Å; N248-K251 CarbonylContact O-C 3.58Å; N248-K251 WeakPolarHBondContact O-CA 3.46Å; N248-K251 WeakPolarHBondContact O-CB 3.28Å; N248-K251 PolarHBondContact O-N 2.74Å; N248-V252 PolarHBondContact O-N 3.05Å; N248-V252 VanDerWaalsContact O-N 3.17Å; N248-G1290 VanDerWaalsContact CB-O 3.3Å; N248-G1290 WeakPolarHBondContact CB-O 3.19Å; N248-G1290 PolarHBondContact N-O 2.97Å; N248-R1291 HydrophobicContact CB-CB 4.05Å; N248-R1291 WeakPolarHBondContact OD1-CD 3.34Å; N248-R1291 VanDerWaalsContact OD1-CZ 3.3Å; N248-R1291 PolarHBondContact OD1-NE 2.95Å; N248-R1291 PolarHBondContact OD1-NH1 2.94Å
249	L	50.1	Low	58.7	Low	36 Å²	36	62.1 Å²	62.1	19%	0.188	34%	0.344	C	S	.	.	H	α-helix	trans	-72.7	-38.2	171.7	-58.8	164.5	0	0	0	111.7	H225 K245 M246 N247 K251 V252 W253	H225-L249 HydrophobicContact CB-CD2 4.09Å; H225-L249 VanDerWaalsContact CD2-CD2 3.42Å; H225-L249 WeakPolarHBondContact CD2-CD2 3.31Å; K245-L249 HydrophobicContact CD-CD1 4.49Å; K245-L249 HydrophobicContact CG-CD1 4.25Å; K245-L249 HydrophobicContact CG-CG 4.47Å; K245-L249 WeakPolarHBondContact O-CG 3.25Å; K245-L249 PolarHBondContact O-N 3.01Å; M246-L249 CarbonylContact O-C 3.13Å; M246-L249 WeakPolarHBondContact O-CA 3.39Å; M246-L249 VanDerWaalsContact O-CB 3.32Å; M246-L249 WeakPolarHBondContact O-CB 3.42Å; M246-L249 PolarHBondContact O-N 3.4Å; N247-L249 VanDerWaalsContact C-N 3.29Å; L249-K251 PolarHBondContact O-N 2.85Å; L249-V252 CarbonylContact O-C 3.54Å; L249-V252 WeakPolarHBondContact O-CA 3.49Å; L249-V252 VanDerWaalsContact O-CB 3.31Å; L249-V252 WeakPolarHBondContact O-CB 3.02Å; L249-V252 PolarHBondContact O-N 2.86Å; L249-W253 VanDerWaalsContact C-CE3 3.44Å; L249-W253 HydrophobicContact CB-CE3 4.07Å; L249-W253 HydrophobicContact CB-CH2 3.36Å; L249-W253 HydrophobicContact CB-CZ2 3.96Å; L249-W253 HydrophobicContact CB-CZ3 3.42Å; L249-W253 VanDerWaalsContact CB-CZ3 3.42Å; L249-W253 HydrophobicContact CD1-CH2 4.08Å; L249-W253 HydrophobicContact CD2-CH2 4.43Å; L249-W253 HydrophobicContact CD2-CZ2 4.44Å; L249-W253 HydrophobicContact CG-CH2 4.15Å; L249-W253 VanDerWaalsContact O-CD2 3.26Å; L249-W253 PolarHBondContact O-N 2.93Å
250	L	51.6	Low	59.9	Low	75 Å²	75	60.5 Å²	60.5	39%	0.393	33%	0.331	S	S	.	.	H	α-helix	trans	-55.3	-35.5	165.2	-92.1	80.3	0	0	0	111.3	M246 N247 V252 W253 G254	M246-L250 HydrophobicContact CG-CD1 4.41Å; M246-L250 VanDerWaalsContact O-CD1 3.31Å; M246-L250 WeakPolarHBondContact O-CD1 3.49Å; M246-L250 PolarHBondContact O-N 2.85Å; N247-L250 PolarHBondContact O-N 3.02Å; L250-V252 VanDerWaalsContact C-N 3.26Å; L250-V252 PolarHBondContact O-N 3.2Å; L250-W253 CarbonylContact O-C 3.3Å; L250-W253 PolarHBondContact O-N 2.8Å; L250-G254 WeakPolarHBondContact O-CA 3.39Å; L250-G254 PolarHBondContact O-N 3.1Å
251	K	54.3	Low	60.5	Low	141 Å²	141	60.5 Å²	60.5	61%	0.613	33%	0.326	S	S	*	.	H	α-helix	trans	-78.7	-4.2	175.4	-161.1	144.4	170.2	171.9	0	114.2	N247 N248 L249	N247-K251 PolarHBondContact O-N 2.87Å; N248-K251 CarbonylContact O-C 3.58Å; N248-K251 WeakPolarHBondContact O-CA 3.46Å; N248-K251 WeakPolarHBondContact O-CB 3.28Å; N248-K251 PolarHBondContact O-N 2.74Å; L249-K251 PolarHBondContact O-N 2.85Å
252	V	58.1	Low	60.9	Low	72 Å²	72	58.6 Å²	58.6	44%	0.436	32%	0.316	S	S	.	.	H	α-helix	trans	-86.5	-47.2	160.1	177.2	0	0	0	0	109.9	N248 L249 L250 G254	N248-V252 PolarHBondContact O-N 3.05Å; N248-V252 VanDerWaalsContact O-N 3.17Å; L249-V252 CarbonylContact O-C 3.54Å; L249-V252 WeakPolarHBondContact O-CA 3.49Å; L249-V252 VanDerWaalsContact O-CB 3.31Å; L249-V252 WeakPolarHBondContact O-CB 3.02Å; L249-V252 PolarHBondContact O-N 2.86Å; L250-V252 VanDerWaalsContact C-N 3.26Å; L250-V252 PolarHBondContact O-N 3.2Å; V252-G254 PolarHBondContact O-N 3.07Å
253	W	60.6	Low	61	Low	11 Å²	11	64.5 Å²	64.5	4%	0.042	34%	0.343	C	S	.	.	H	α-helix	trans	-85	1.3	-176.3	-50.3	-52.6	0	0	0	115.5	H225 E226 P228 L249 L250 K255 L256 H257 P258	H225-W253 HydrophobicContact CB-CZ2 4.04Å; E226-W253 WeakPolarHBondContact O-CH2 3.26Å; E226-W253 WeakPolarHBondContact O-CZ2 3.3Å; P228-W253 HydrophobicContact CG-CH2 4.26Å; P228-W253 HydrophobicContact CG-CZ3 3.91Å; L249-W253 VanDerWaalsContact C-CE3 3.44Å; L249-W253 HydrophobicContact CB-CE3 4.07Å; L249-W253 HydrophobicContact CB-CH2 3.36Å; L249-W253 HydrophobicContact CB-CZ2 3.96Å; L249-W253 HydrophobicContact CB-CZ3 3.42Å; L249-W253 VanDerWaalsContact CB-CZ3 3.42Å; L249-W253 HydrophobicContact CD1-CH2 4.08Å; L249-W253 HydrophobicContact CD2-CH2 4.43Å; L249-W253 HydrophobicContact CD2-CZ2 4.44Å; L249-W253 HydrophobicContact CG-CH2 4.15Å; L249-W253 VanDerWaalsContact O-CD2 3.26Å; L249-W253 PolarHBondContact O-N 2.93Å; L250-W253 CarbonylContact O-C 3.3Å; L250-W253 PolarHBondContact O-N 2.8Å; W253-K255 PolarHBondContact O-N 2.89Å; W253-K255 VanDerWaalsContact O-N 3.08Å; W253-L256 WeakPolarHBondContact O-CB 3.38Å; W253-L256 PolarHBondContact O-N 3.14Å; W253-H257 PolarHBondContact O-N 3.4Å; W253-P258 HydrophobicContact CB-CG 4.26Å
254	G	56.6	Low	60.7	Low	46 Å²	46	68.3 Å²	68.3	47%	0.474	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-20.7	-171.5	0	0	0	0	0	115.5	L250 V252 H257	L250-G254 WeakPolarHBondContact O-CA 3.39Å; L250-G254 PolarHBondContact O-N 3.1Å; V252-G254 PolarHBondContact O-N 3.07Å; G254-H257 PolarHBondContact O-CE1 2.86Å; G254-H257 PolarHBondContact O-ND1 3.11Å
255	K	64.9	Low	60.5	Low	127 Å²	127	73 Å²	73	55%	0.552	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-30	169.7	-69.5	-173	178.4	-177.7	0	113.4	W253 E279	W253-K255 PolarHBondContact O-N 2.89Å; W253-K255 VanDerWaalsContact O-N 3.08Å; K255-E279 IonicContact NZ-OE1 3.84Å; K255-E279 PolarHBondContact NZ-OE1 2.91Å
256	L	70.1	Confident	60.9	Low	8 Å²	8	74.6 Å²	74.6	4%	0.042	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-32.5	-164.8	-71.2	159.9	0	0	0	113.6	I222 W253 I273 L274 G277 L278	I222-L256 HydrophobicContact CD1-CD1 4.08Å; I222-L256 HydrophobicContact CG2-CD1 4.11Å; W253-L256 WeakPolarHBondContact O-CB 3.38Å; W253-L256 PolarHBondContact O-N 3.14Å; L256-I273 HydrophobicContact CB-CG2 4.3Å; L256-L274 PolarHBondContact O-N 2.83Å; L256-G277 VanDerWaalsContact CD2-C 3.41Å; L256-G277 WeakPolarHBondContact CD2-O 3.28Å; L256-L278 HydrophobicContact CD2-CB 4.39Å; L256-L278 HydrophobicContact CD2-CD2 3.53Å; L256-L278 HydrophobicContact CD2-CG 3.59Å
257	H	73.4	Confident	62.5	Low	112 Å²	112	74.7 Å²	74.7	52%	0.519	38%	0.38	S	S	.	.			trans	46.1	61.3	-174.8	-68.4	58.7	0	0	0	112.8	R202 W253 G254 L274	R202-H257 PolarHBondContact NH2-O 2.92Å; W253-H257 PolarHBondContact O-N 3.4Å; G254-H257 PolarHBondContact O-CE1 2.86Å; G254-H257 PolarHBondContact O-ND1 3.11Å; H257-L274 HydrophobicContact CB-CD1 3.79Å; H257-L274 HydrophobicContact CB-CG 4.37Å
258	P	74.4	Confident	64.1	Low	36 Å²	36	78.1 Å²	78.1	23%	0.234	40%	0.396	C	S	.	.			trans	-64.9	135.7	179.9	27.9	-34.5	0	0	0	112.2	I227 W253 L271 S272 I273	I227-P258 HydrophobicContact CD1-CB 4.08Å; I227-P258 HydrophobicContact CG2-CB 4.09Å; I227-P258 HydrophobicContact CG2-CG 3.88Å; W253-P258 HydrophobicContact CB-CG 4.26Å; P258-L271 HydrophobicContact CB-CD1 3.84Å; P258-S272 CarbonylContact C-O 3.59Å; P258-S272 WeakPolarHBondContact CA-O 3.31Å; P258-I273 HydrophobicContact CB-CG2 3.65Å
259	I	80.1	Confident	65.6	Low	74 Å²	74	75.9 Å²	75.9	38%	0.379	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	132	164.5	-62.7	178.5	0	0	0	106.8	N261 L271 S272	I259-N261 WeakPolarHBondContact CG2-OD1 3.42Å; I259-L271 CarbonylContact O-C 3.31Å; I259-L271 WeakPolarHBondContact O-CA 3.24Å; I259-S272 PolarHBondContact N-O 3.49Å; I259-S272 PolarHBondContact O-N 2.87Å
260	I	79.3	Confident	67.4	Low	16 Å²	16	76.4 Å²	76.4	8%	0.082	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	123.4	173	-64.3	168.1	0	0	0	107.2	W220 I227 N262 N270 L271	W220-I260 HydrophobicContact CB-CD1 4.07Å; W220-I260 HydrophobicContact CG-CD1 4.32Å; I227-I260 HydrophobicContact CB-CD1 3.92Å; I227-I260 HydrophobicContact CD1-CD1 4.49Å; I227-I260 HydrophobicContact CG2-CD1 3.8Å; I260-N262 VanDerWaalsContact CG2-OD1 3.24Å; I260-N262 WeakPolarHBondContact CG2-OD1 3.31Å; I260-N270 CarbonylContact C-O 3.56Å; I260-N270 WeakPolarHBondContact CA-O 3.37Å; I260-L271 HydrophobicContact CG1-CD1 3.88Å
261	N	72.1	Confident	69.2	Low	87 Å²	87	72.9 Å²	72.9	47%	0.465	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	120.7	168.4	-68.7	21	0	0	0	108	I259 N270	I259-N261 WeakPolarHBondContact CG2-OD1 3.42Å; N261-N270 PolarHBondContact N-O 2.84Å; N261-N270 PolarHBondContact O-N 3.48Å
262	N	65.3	Low	70.7	Confident	45 Å²	45	67.4 Å²	67.4	24%	0.241	35%	0.349	C	S	.	.			trans	-120.5	107.1	171.5	-75	7.9	0	0	0	108.1	N229 I260 S269	N229-N262 PolarHBondContact ND2-ND2 2.62Å; I260-N262 VanDerWaalsContact CG2-OD1 3.24Å; I260-N262 WeakPolarHBondContact CG2-OD1 3.31Å; N262-S269 VanDerWaalsContact OD1-CB 3.32Å; N262-S269 WeakPolarHBondContact OD1-CB 3.38Å; N262-S269 PolarHBondContact OD1-OG 3.21Å
263	E	55.6	Low	72	Confident	140 Å²	140	64 Å²	64	65%	0.654	33%	0.328	S	S	*	.			trans	-79.4	135.1	178.3	-70.8	-176	-156.3	0	0	110.7	N265 E266	E263-N265 PolarHBondContact O-N 3.03Å; E263-E266 HydrophobicContact CB-CB 4.29Å; E263-E266 HydrophobicContact CB-CG 3.88Å; E263-E266 PolarHBondContact O-N 2.74Å
264	E	47.6	Very low	72.9	Confident	176 Å²	176	65.6 Å²	65.6	82%	0.822	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	116.3	-173.5	-69.5	-175.1	151.3	0	0	110.3
265	N	52.3	Low	73.9	Confident	150 Å²	150	63.6 Å²	63.6	80%	0.802	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.9	-3.1	-174.7	-52.4	-75.3	0	0	0	117.7	E263	E263-N265 PolarHBondContact O-N 3.03Å
266	E	59.6	Low	74.1	Confident	92 Å²	92	61.4 Å²	61.4	43%	0.43	32%	0.321	S	S	.	.			trans	-77.7	145.5	-179.4	-81.6	-94.4	131.4	0	0	113.8	E263 Q268	E263-E266 HydrophobicContact CB-CB 4.29Å; E263-E266 HydrophobicContact CB-CG 3.88Å; E263-E266 PolarHBondContact O-N 2.74Å; E266-Q268 PolarHBondContact O-N 2.83Å; E266-Q268 VanDerWaalsContact O-N 3.15Å; E266-Q268 PolarHBondContact OE2-NE2 2.94Å
267	E	79.3	Confident	74.3	Confident	70 Å²	70	61.3 Å²	61.3	33%	0.327	32%	0.321	S	S	.	.	S	Bend	trans	-83.6	27.2	172.5	-58.7	-172.6	116.3	0	0	112.1	A209 V210 G211 F218	A209-E267 PolarHBondContact N-O 3.24Å; V210-E267 WeakPolarHBondContact CG1-OE2 3.09Å; G211-E267 PolarHBondContact N-OE1 3.12Å; F218-E267 VanDerWaalsContact CZ-C 3.42Å; F218-E267 WeakPolarHBondContact CZ-O 3.35Å
268	Q	86.7	Confident	74.6	Confident	77 Å²	77	56.2 Å²	56.2	36%	0.36	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	159.6	-171.6	-56.9	-171.2	86.6	0	0	112.1	V206 C207 E266	V206-Q268 HydrophobicContact CG1-CB 4.36Å; C207-Q268 CarbonylContact O-C 3.43Å; C207-Q268 VanDerWaalsContact O-CA 3.24Å; C207-Q268 WeakPolarHBondContact O-CA 3.32Å; E266-Q268 PolarHBondContact O-N 2.83Å; E266-Q268 VanDerWaalsContact O-N 3.15Å; E266-Q268 PolarHBondContact OE2-NE2 2.94Å
269	S	86.5	Confident	74.9	Confident	2 Å²	2	59.4 Å²	59.4	1%	0.014	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	138.7	173.8	171.5	0	0	0	0	109.5	C207 W220 N262	C207-S269 PolarHBondContact N-O 3.37Å; C207-S269 PolarHBondContact O-N 3.31Å; W220-S269 PolarHBondContact NE1-OG 3.15Å; N262-S269 VanDerWaalsContact OD1-CB 3.32Å; N262-S269 WeakPolarHBondContact OD1-CB 3.38Å; N262-S269 PolarHBondContact OD1-OG 3.21Å
270	N	87.9	Confident	74.9	Confident	48 Å²	48	60 Å²	60	26%	0.257	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	127.6	-175.7	-169.6	-1.1	0	0	0	111.8	S204 L205 V206 I260 N261	S204-N270 PolarHBondContact OG-ND2 2.78Å; S204-N270 PolarHBondContact OG-OD1 2.68Å; S204-N270 VanDerWaalsContact OG-OD1 3.09Å; L205-N270 PolarHBondContact O-OD1 2.79Å; V206-N270 HydrophobicContact CG2-CB 4.36Å; I260-N270 CarbonylContact C-O 3.56Å; I260-N270 WeakPolarHBondContact CA-O 3.37Å; N261-N270 PolarHBondContact N-O 2.84Å; N261-N270 PolarHBondContact O-N 3.48Å
271	L	87.9	Confident	74.9	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	119	176.5	171.7	66.4	0	0	0	110.4	L205 W220 I227 P258 I259 I260 I273 I284	L205-L271 PolarHBondContact N-O 3.04Å; L205-L271 PolarHBondContact O-N 2.7Å; W220-L271 HydrophobicContact CB-CD2 4.39Å; W220-L271 HydrophobicContact CD2-CB 3.75Å; W220-L271 HydrophobicContact CD2-CD2 3.75Å; W220-L271 HydrophobicContact CD2-CG 4.32Å; W220-L271 HydrophobicContact CE3-CB 4.12Å; W220-L271 HydrophobicContact CE3-CD2 3.5Å; W220-L271 VanDerWaalsContact CE3-CD2 3.5Å; W220-L271 HydrophobicContact CE3-CG 4.44Å; W220-L271 HydrophobicContact CG-CB 4.22Å; W220-L271 HydrophobicContact CG-CD2 4.16Å; W220-L271 HydrophobicContact CH2-CB 4.03Å; W220-L271 HydrophobicContact CZ2-CB 3.68Å; W220-L271 HydrophobicContact CZ3-CB 4.25Å; W220-L271 HydrophobicContact CZ3-CD2 3.93Å; I227-L271 HydrophobicContact CD1-CD1 3.76Å; I227-L271 HydrophobicContact CD1-CD2 4.09Å; P258-L271 HydrophobicContact CB-CD1 3.84Å; I259-L271 CarbonylContact O-C 3.31Å; I259-L271 WeakPolarHBondContact O-CA 3.24Å; I260-L271 HydrophobicContact CG1-CD1 3.88Å; L271-I273 HydrophobicContact CD1-CG2 4.04Å; L271-I273 HydrophobicContact CD2-CD1 4.4Å; L271-I273 HydrophobicContact CG-CG2 4.32Å; L271-I284 HydrophobicContact CD2-CG2 4.03Å
272	S	85.7	Confident	75.6	Confident	27 Å²	27	58.1 Å²	58.1	19%	0.189	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	129.8	171.1	-171.2	0	0	0	0	112.3	I203 P258 I259	I203-S272 VanDerWaalsContact O-CA 3.3Å; I203-S272 WeakPolarHBondContact O-CA 3.46Å; I203-S272 PolarHBondContact O-OG 3.26Å; P258-S272 CarbonylContact C-O 3.59Å; P258-S272 WeakPolarHBondContact CA-O 3.31Å; I259-S272 PolarHBondContact N-O 3.49Å; I259-S272 PolarHBondContact O-N 2.87Å
273	I	87.2	Confident	76.7	Confident	0 Å²	0	58 Å²	58	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	151.6	-174.6	44.3	-178.2	0	0	0	111.3	R202 I203 L205 I222 L256 P258 L271 K275 L278 I284	R202-I273 VanDerWaalsContact CA-O 3.31Å; R202-I273 WeakPolarHBondContact CA-O 2.98Å; I203-I273 HydrophobicContact CD1-CD1 4.11Å; I203-I273 HydrophobicContact CD1-CG1 3.93Å; I203-I273 HydrophobicContact CG1-CD1 4.37Å; I203-I273 HydrophobicContact CG1-CG1 3.63Å; I203-I273 PolarHBondContact N-O 3.06Å; I203-I273 PolarHBondContact O-N 2.69Å; L205-I273 HydrophobicContact CD1-CD1 4.28Å; I222-I273 HydrophobicContact CD1-CD1 4.4Å; I222-I273 HydrophobicContact CD1-CG2 4.44Å; L256-I273 HydrophobicContact CB-CG2 4.3Å; P258-I273 HydrophobicContact CB-CG2 3.65Å; L271-I273 HydrophobicContact CD1-CG2 4.04Å; L271-I273 HydrophobicContact CD2-CD1 4.4Å; L271-I273 HydrophobicContact CG-CG2 4.32Å; I273-K275 PolarHBondContact O-N 3.06Å; I273-L278 HydrophobicContact CD1-CD1 4.19Å; I273-L278 HydrophobicContact CD1-CD2 4.1Å; I273-L278 HydrophobicContact CD1-CG 4.49Å; I273-I284 HydrophobicContact CD1-CD1 3.85Å
274	L	79.1	Confident	78.4	Confident	44 Å²	44	51.4 Å²	51.4	23%	0.23	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	123.7	178.2	-72.9	165.7	0	0	0	111.3	L201 R202 L256 H257 A276 G277	L201-L274 WeakPolarHBondContact O-CA 3.06Å; R202-L274 HydrophobicContact CG-CD2 3.8Å; R202-L274 HydrophobicContact CG-CG 4.27Å; L256-L274 PolarHBondContact O-N 2.83Å; H257-L274 HydrophobicContact CB-CD1 3.79Å; H257-L274 HydrophobicContact CB-CG 4.37Å; L274-A276 PolarHBondContact O-N 2.99Å; L274-G277 PolarHBondContact O-N 3.15Å
275	K	76.7	Confident	80.5	Confident	5 Å²	5	43.6 Å²	43.6	2%	0.022	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-62.2	-30.6	-179.6	-164.9	-179.4	-176.2	-174.2	0	112.5	I194 S195 Q196 D198 I200 L201 I203 I273 G277 E389	I194-K275 HydrophobicContact CD1-CG 4.44Å; S195-K275 WeakPolarHBondContact O-CE 3.23Å; S195-K275 PolarHBondContact O-NZ 3.19Å; S195-K275 VanDerWaalsContact O-NZ 3.09Å; S195-K275 PolarHBondContact OG-NZ 3.13Å; Q196-K275 PolarHBondContact NE2-O 3.13Å; Q196-K275 VanDerWaalsContact NE2-O 3.09Å; D198-K275 VanDerWaalsContact CG-NZ 3.26Å; D198-K275 IonicContact OD2-NZ 2.86Å; D198-K275 PolarHBondContact OD2-NZ 2.87Å; I200-K275 WeakPolarHBondContact O-CB 3.33Å; I200-K275 WeakPolarHBondContact O-CD 3.42Å; L201-K275 PolarHBondContact O-N 3.08Å; I203-K275 HydrophobicContact CG2-CB 4.24Å; I203-K275 HydrophobicContact CG2-CD 4.29Å; I203-K275 HydrophobicContact CG2-CG 4.13Å; I273-K275 PolarHBondContact O-N 3.06Å; K275-G277 VanDerWaalsContact C-N 3.29Å; K275-G277 PolarHBondContact O-N 3.17Å; K275-E389 WeakPolarHBondContact CE-OE1 3.45Å; K275-E389 IonicContact NZ-OE1 2.71Å; K275-E389 PolarHBondContact NZ-OE1 3.39Å; K275-E389 IonicContact NZ-OE2 3.27Å
276	A	69.1	Low	82.3	Confident	81 Å²	81	36.4 Å²	36.4	67%	0.669	21%	0.208	S	C	*	.	G	3₁₀ helix	trans	-77.7	-8	175.9	0	0	0	0	0	114.3	L274	L274-A276 PolarHBondContact O-N 2.99Å
277	G	73.6	Confident	83.7	Confident	5 Å²	5	32.5 Å²	32.5	5%	0.052	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-96.1	-9.5	-179.9	0	0	0	0	0	114.9	L256 L274 K275	L256-G277 VanDerWaalsContact CD2-C 3.41Å; L256-G277 WeakPolarHBondContact CD2-O 3.28Å; L274-G277 PolarHBondContact O-N 3.15Å; K275-G277 VanDerWaalsContact C-N 3.29Å; K275-G277 PolarHBondContact O-N 3.17Å
278	L	79.6	Confident	84.2	Confident	6 Å²	6	29.1 Å²	29.1	3%	0.031	18%	0.175	C	C	.	.			trans	-85.6	140	-178.4	-73.7	164.4	0	0	0	111.4	I194 I203 L256 I273 D282 I284 V310	I194-L278 HydrophobicContact CD1-CB 3.96Å; I194-L278 HydrophobicContact CD1-CD1 3.61Å; I194-L278 HydrophobicContact CD1-CG 4.42Å; I203-L278 HydrophobicContact CD1-CD1 3.67Å; I203-L278 HydrophobicContact CG1-CD1 4.45Å; L256-L278 HydrophobicContact CD2-CB 4.39Å; L256-L278 HydrophobicContact CD2-CD2 3.53Å; L256-L278 HydrophobicContact CD2-CG 3.59Å; I273-L278 HydrophobicContact CD1-CD1 4.19Å; I273-L278 HydrophobicContact CD1-CD2 4.1Å; I273-L278 HydrophobicContact CD1-CG 4.49Å; L278-D282 HydrophobicContact CD2-CB 4.42Å; L278-I284 HydrophobicContact CD2-CD1 4.23Å; L278-V310 HydrophobicContact CB-CG1 4.39Å; L278-V310 HydrophobicContact CD2-CG2 4.31Å
279	E	82.4	Confident	84.3	Confident	102 Å²	102	25.9 Å²	25.9	48%	0.477	16%	0.161	S	C	.	.			trans	-115.7	165.5	178.1	-69.7	-176.2	-148.8	0	0	111.8	K255 G281 D282	K255-E279 IonicContact NZ-OE1 3.84Å; K255-E279 PolarHBondContact NZ-OE1 2.91Å; E279-G281 PolarHBondContact O-N 3.08Å; E279-D282 PolarHBondContact N-OD2 3.09Å; E279-D282 PolarHBondContact O-N 2.58Å
280	D	78.8	Confident	84.4	Confident	86 Å²	86	26 Å²	26	46%	0.46	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	118.7	-169.3	-155.5	55.5	0	0	0	111.4	V312 K347	D280-V312 HydrophobicContact CB-CB 4.44Å; D280-V312 PolarHBondContact OD1-N 3.31Å; D280-K347 IonicContact OD1-NZ 3.92Å; D280-K347 PolarHBondContact OD1-NZ 2.68Å; D280-K347 WeakPolarHBondContact OD2-CE 3.36Å; D280-K347 IonicContact OD2-NZ 3.06Å; D280-K347 PolarHBondContact OD2-NZ 2.76Å
281	G	80.9	Confident	84.2	Confident	48 Å²	48	26.6 Å²	26.6	50%	0.495	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.6	9.2	-173.6	0	0	0	0	0	115.3	E279 E283 V310	E279-G281 PolarHBondContact O-N 3.08Å; G281-E283 PolarHBondContact O-N 2.86Å; G281-V310 WeakPolarHBondContact CA-O 3.31Å; G281-V310 PolarHBondContact N-O 3.27Å
282	D	86.2	Confident	84	Confident	16 Å²	16	27.2 Å²	27.2	9%	0.086	18%	0.175	C	C	.	.			trans	-55.7	128.4	173.6	-82.9	-21.2	0	0	0	111.2	N223 L278 E279 T309 V310	N223-D282 PolarHBondContact ND2-OD1 2.88Å; N223-D282 WeakPolarHBondContact OD1-CA 3.06Å; L278-D282 HydrophobicContact CD2-CB 4.42Å; E279-D282 PolarHBondContact N-OD2 3.09Å; E279-D282 PolarHBondContact O-N 2.58Å; D282-T309 CarbonylContact O-C 3.58Å; D282-T309 WeakPolarHBondContact O-CA 3.5Å; D282-V310 HydrophobicContact CB-CB 4.04Å; D282-V310 HydrophobicContact CB-CG2 3.99Å; D282-V310 WeakPolarHBondContact O-CG2 3.4Å; D282-V310 PolarHBondContact O-N 3.36Å
283	E	89.1	Confident	83.9	Confident	44 Å²	44	26.4 Å²	26.4	21%	0.206	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	109.3	172.8	-77.5	-174.3	154.8	0	0	110.1	I222 N223 R224 G281 T307 T309	I222-E283 CarbonylContact C-O 3.45Å; I222-E283 WeakPolarHBondContact CA-O 3.42Å; N223-E283 PolarHBondContact N-O 3.44Å; N223-E283 PolarHBondContact OD1-N 3.1Å; R224-E283 VanDerWaalsContact CG-OE2 3.28Å; R224-E283 WeakPolarHBondContact CG-OE2 3.48Å; R224-E283 IonicContact CZ-OE1 3.85Å; R224-E283 IonicContact CZ-OE2 3.34Å; R224-E283 IonicContact NE-OE1 2.71Å; R224-E283 IonicContact NE-OE2 3.1Å; R224-E283 PolarHBondContact NE-OE2 3Å; R224-E283 IonicContact NH2-OE1 2.72Å; R224-E283 PolarHBondContact NH2-OE1 3.11Å; R224-E283 IonicContact NH2-OE2 2.66Å; R224-E283 PolarHBondContact NH2-OE2 2.84Å; G281-E283 PolarHBondContact O-N 2.86Å; E283-T307 HydrophobicContact CB-CG2 3.96Å; E283-T307 HydrophobicContact CG-CG2 3.95Å; E283-T309 HydrophobicContact CG-CG2 4.16Å
284	I	90.7	Very high	83.7	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	124.5	169.7	-49.5	176.6	0	0	0	108.1	L192 L205 W220 I222 L271 I273 L278 T307 I308 V310	L192-I284 HydrophobicContact CD2-CD1 4.34Å; L205-I284 HydrophobicContact CD1-CD1 3.69Å; L205-I284 HydrophobicContact CD1-CG2 4.42Å; W220-I284 HydrophobicContact CE3-CG2 3.97Å; W220-I284 HydrophobicContact CZ3-CG2 3.95Å; I222-I284 HydrophobicContact CG1-CG1 4.36Å; I222-I284 HydrophobicContact CG1-CG2 4.35Å; L271-I284 HydrophobicContact CD2-CG2 4.03Å; I273-I284 HydrophobicContact CD1-CD1 3.85Å; L278-I284 HydrophobicContact CD2-CD1 4.23Å; I284-T307 CarbonylContact O-C 3.56Å; I284-T307 WeakPolarHBondContact O-CA 3.27Å; I284-I308 HydrophobicContact CB-CD1 4.2Å; I284-I308 HydrophobicContact CB-CG1 3.81Å; I284-I308 HydrophobicContact CD1-CD1 4.49Å; I284-I308 PolarHBondContact N-O 3.33Å; I284-I308 WeakPolarHBondContact O-CG1 3.48Å; I284-I308 PolarHBondContact O-N 2.96Å; I284-V310 HydrophobicContact CD1-CG2 3.84Å; I284-V310 HydrophobicContact CG1-CG2 4.06Å
285	V	90.6	Very high	83.6	Confident	12 Å²	12	33.5 Å²	33.5	7%	0.073	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	131.4	-176.9	-166.2	0	0	0	0	109.8	W220 L221 I306 T307	W220-V285 CarbonylContact C-O 3.59Å; W220-V285 WeakPolarHBondContact CA-O 3.34Å; L221-V285 HydrophobicContact CB-CB 4.07Å; L221-V285 HydrophobicContact CB-CG2 4.38Å; L221-V285 HydrophobicContact CD1-CB 3.83Å; L221-V285 HydrophobicContact CD1-CG1 3.96Å; L221-V285 PolarHBondContact N-O 3.22Å; L221-V285 PolarHBondContact O-N 2.99Å; V285-I306 CarbonylContact C-O 3.46Å; V285-I306 WeakPolarHBondContact CA-O 3.45Å; V285-I306 WeakPolarHBondContact CG1-O 3.29Å; V285-T307 HydrophobicContact CG2-CG2 4.03Å
286	C	91.1	Very high	83.5	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	124.9	160.4	178.2	0	0	0	0	109	I180 C207 W220 S305 I306	I180-C286 HydrophobicContact CD1-CB 3.87Å; I180-C286 HydrophobicContact CG1-CB 3.94Å; C207-C286 HydrophobicContact CB-CB 3.66Å; C207-C286 WeakPolarHBondContact CB-SG 3.19Å; C207-C286 WeakPolarHBondContact SG-CB 3.19Å; C207-C286 CovalentContact SG-SG 2.02Å; C207-C286 PolarHBondContact SG-SG 3.45Å; W220-C286 HydrophobicContact CD2-CB 4.48Å; W220-C286 HydrophobicContact CE3-CB 4.11Å; W220-C286 HydrophobicContact CH2-CB 4.4Å; W220-C286 HydrophobicContact CZ3-CB 4.07Å; C286-S305 CarbonylContact O-C 3.55Å; C286-S305 VanDerWaalsContact O-CA 3.24Å; C286-S305 WeakPolarHBondContact O-CA 3.41Å; C286-I306 HydrophobicContact CB-CG2 4.06Å; C286-I306 PolarHBondContact N-O 2.92Å; C286-I306 PolarHBondContact O-N 3.48Å
287	S	89.1	Confident	83.7	Confident	9 Å²	9	40.9 Å²	40.9	6%	0.063	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	129.3	178.4	165.8	0	0	0	0	109.7	K219	K219-S287 PolarHBondContact N-O 3.06Å; K219-S287 PolarHBondContact O-N 2.84Å
288	V	90.1	Very high	83.6	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	134.9	-173.9	-176.2	0	0	0	0	111.1	P175 P178 A209 P216 T217 F218 N303 L304	P175-V288 HydrophobicContact CG-CG1 4.24Å; P178-V288 HydrophobicContact CB-CG2 3.79Å; P178-V288 HydrophobicContact CG-CG2 4.14Å; A209-V288 HydrophobicContact CB-CB 4.3Å; A209-V288 HydrophobicContact CB-CG1 3.8Å; A209-V288 HydrophobicContact CB-CG2 3.98Å; P216-V288 HydrophobicContact CB-CG1 3.33Å; T217-V288 VanDerWaalsContact O-CA 3.3Å; T217-V288 WeakPolarHBondContact O-CA 3.45Å; F218-V288 HydrophobicContact CD1-CG2 3.51Å; F218-V288 HydrophobicContact CE1-CG1 4.36Å; F218-V288 HydrophobicContact CE1-CG2 3.65Å; F218-V288 HydrophobicContact CG-CG2 4.36Å; V288-N303 CarbonylContact O-C 3.51Å; V288-N303 WeakPolarHBondContact O-CA 3.29Å; V288-L304 PolarHBondContact N-O 2.81Å; V288-L304 PolarHBondContact O-N 2.93Å
289	S	88.2	Confident	83.2	Confident	8 Å²	8	47.4 Å²	47.4	6%	0.056	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	154.7	177.4	81.5	0	0	0	0	112.9	T217 R302	T217-S289 PolarHBondContact N-O 3.25Å; T217-S289 PolarHBondContact O-N 3.46Å; T217-S289 PolarHBondContact OG1-O 2.85Å; T217-S289 PolarHBondContact OG1-OG 2.88Å; T217-S289 VanDerWaalsContact OG1-OG 3.06Å; S289-R302 WeakPolarHBondContact CB-O 3.43Å
290	N	87.7	Confident	82.3	Confident	6 Å²	6	50.6 Å²	50.6	3%	0.032	28%	0.281	C	S	.	.			trans	-145.9	179.7	165.5	79.2	-12.7	0	0	0	111.1	I173 R213 P214 A292 T293 Q294	I173-N290 PolarHBondContact O-ND2 2.87Å; R213-N290 PolarHBondContact N-ND2 2.84Å; R213-N290 PolarHBondContact O-ND2 2.88Å; P214-N290 PolarHBondContact O-ND2 2.77Å; N290-A292 PolarHBondContact O-N 3.06Å; N290-A292 VanDerWaalsContact O-N 3.15Å; N290-A292 VanDerWaalsContact OD1-CB 3.3Å; N290-A292 WeakPolarHBondContact OD1-CB 3.44Å; N290-A292 PolarHBondContact OD1-N 2.84Å; N290-T293 PolarHBondContact N-OG1 3.22Å; N290-T293 PolarHBondContact O-N 2.93Å; N290-T293 VanDerWaalsContact O-N 3.11Å; N290-T293 PolarHBondContact O-OG1 3.17Å; N290-T293 VanDerWaalsContact O-OG1 3.08Å; N290-T293 PolarHBondContact OD1-N 2.92Å; N290-T293 VanDerWaalsContact OD1-N 3.09Å; N290-Q294 PolarHBondContact O-N 2.87Å
291	S	84.5	Confident	81.9	Confident	59 Å²	59	52.2 Å²	52.2	41%	0.413	28%	0.283	S	S	.	.	H	α-helix	trans	-57.3	-30.2	179.9	-46.8	0	0	0	0	113.4	P214 I295	P214-S291 WeakPolarHBondContact CG-OG 3.25Å; S291-I295 WeakPolarHBondContact O-CD1 3.39Å; S291-I295 WeakPolarHBondContact O-CG1 3.12Å
292	A	84.3	Confident	81.9	Confident	14 Å²	14	54.6 Å²	54.6	12%	0.116	28%	0.277	C	S	.	.	H	α-helix	trans	-71.9	-38.7	177.6	0	0	0	0	0	112.5	L172 I173 N290	L172-A292 HydrophobicContact CB-CB 3.81Å; I173-A292 WeakPolarHBondContact O-CB 3.45Å; N290-A292 PolarHBondContact O-N 3.06Å; N290-A292 VanDerWaalsContact O-N 3.15Å; N290-A292 VanDerWaalsContact OD1-CB 3.3Å; N290-A292 WeakPolarHBondContact OD1-CB 3.44Å; N290-A292 PolarHBondContact OD1-N 2.84Å
293	T	83.1	Confident	81.7	Confident	9 Å²	9	57.1 Å²	57.1	6%	0.055	29%	0.291	C	S	.	.	H	α-helix	trans	-76.7	-35.5	177.4	61.2	0	0	0	0	112.1	K174 N290 I295 N296 R302 L304	K174-T293 HydrophobicContact CB-CG2 3.74Å; N290-T293 PolarHBondContact N-OG1 3.22Å; N290-T293 PolarHBondContact O-N 2.93Å; N290-T293 VanDerWaalsContact O-N 3.11Å; N290-T293 PolarHBondContact O-OG1 3.17Å; N290-T293 VanDerWaalsContact O-OG1 3.08Å; N290-T293 PolarHBondContact OD1-N 2.92Å; N290-T293 VanDerWaalsContact OD1-N 3.09Å; T293-I295 VanDerWaalsContact C-N 3.26Å; T293-I295 PolarHBondContact O-N 2.71Å; T293-N296 VanDerWaalsContact O-CB 3.25Å; T293-N296 WeakPolarHBondContact O-CB 3.44Å; T293-N296 PolarHBondContact O-N 3.33Å; T293-N296 VanDerWaalsContact O-N 3.12Å; T293-R302 WeakPolarHBondContact CB-O 3.39Å; T293-R302 WeakPolarHBondContact O-CA 3.47Å; T293-R302 PolarHBondContact OG1-O 2.74Å; T293-L304 HydrophobicContact CG2-CD1 4.1Å; T293-L304 HydrophobicContact CG2-CG 4.46Å
294	Q	82.4	Confident	81.5	Confident	111 Å²	111	56.8 Å²	56.8	52%	0.519	29%	0.29	S	S	.	.	H	α-helix	trans	-63.9	-25.9	179.5	-72.5	-164.5	21.1	0	0	114.4	N290 N296 R302	N290-Q294 PolarHBondContact O-N 2.87Å; Q294-N296 PolarHBondContact O-N 2.92Å; Q294-R302 PolarHBondContact O-NE 3.28Å
295	I	78.3	Confident	81.4	Confident	82 Å²	82	60.1 Å²	60.1	42%	0.421	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-18	176.2	-71.8	165.1	0	0	0	112.4	P83 L172 S291 T293	P83-I295 HydrophobicContact CG-CB 4.42Å; P83-I295 HydrophobicContact CG-CD1 3.84Å; P83-I295 HydrophobicContact CG-CG2 3.93Å; L172-I295 HydrophobicContact CD1-CD1 3.45Å; L172-I295 VanDerWaalsContact CD1-CD1 3.45Å; S291-I295 WeakPolarHBondContact O-CD1 3.39Å; S291-I295 WeakPolarHBondContact O-CG1 3.12Å; T293-I295 VanDerWaalsContact C-N 3.26Å; T293-I295 PolarHBondContact O-N 2.71Å
296	N	74.2	Confident	81.3	Confident	65 Å²	65	60.2 Å²	60.2	35%	0.348	31%	0.314	S	S	.	.			trans	-62	140.5	179.4	-156.9	-27.1	0	0	0	112	T293 Q294 D298 K301 R302	T293-N296 VanDerWaalsContact O-CB 3.25Å; T293-N296 WeakPolarHBondContact O-CB 3.44Å; T293-N296 PolarHBondContact O-N 3.33Å; T293-N296 VanDerWaalsContact O-N 3.12Å; Q294-N296 PolarHBondContact O-N 2.92Å; N296-D298 PolarHBondContact OD1-N 2.71Å; N296-K301 VanDerWaalsContact ND2-CB 3.27Å; N296-K301 WeakPolarHBondContact ND2-CB 3.37Å; N296-R302 HydrophobicContact CB-CG 4.5Å; N296-R302 VanDerWaalsContact O-CZ 3.28Å; N296-R302 PolarHBondContact O-NE 2.97Å; N296-R302 PolarHBondContact O-NH2 3.07Å
297	H	72.4	Confident	81.2	Confident	176 Å²	176	62.4 Å²	62.4	82%	0.815	33%	0.327	S	S	*	.	S	Bend	trans	-73.5	-28.8	176	-74.8	-71	0	0	0	112.6	P299	H297-P299 WeakPolarHBondContact O-CD 3.45Å
298	D	72.7	Confident	81.2	Confident	52 Å²	52	62 Å²	62	28%	0.278	33%	0.325	S	S	.	.	S	Bend	trans	-78.3	114.8	177.7	178.8	-8.6	0	0	0	110.6	N296 M300 K301 R302	N296-D298 PolarHBondContact OD1-N 2.71Å; D298-M300 VanDerWaalsContact C-N 3.27Å; D298-M300 PolarHBondContact O-N 2.78Å; D298-M300 WeakPolarHBondContact OD1-CB 3.37Å; D298-M300 PolarHBondContact OD1-N 2.92Å; D298-K301 HydrophobicContact CB-CB 4.19Å; D298-K301 HydrophobicContact CB-CD 4.35Å; D298-K301 HydrophobicContact CB-CG 4.28Å; D298-K301 PolarHBondContact O-N 2.84Å; D298-K301 WeakPolarHBondContact OD2-CD 3.48Å; D298-K301 WeakPolarHBondContact OD2-CE 3.2Å; D298-K301 WeakPolarHBondContact OD2-CG 3.46Å; D298-K301 IonicContact OD2-NZ 3.66Å; D298-K301 PolarHBondContact OD2-NZ 2.87Å; D298-R302 PolarHBondContact O-N 2.86Å
299	P	69.7	Low	81.1	Confident	96 Å²	96	64.3 Å²	64.3	62%	0.623	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-64.7	-27.5	-178.1	27.4	-34.7	0	0	0	113.2	H297 K301 R302	H297-P299 WeakPolarHBondContact O-CD 3.45Å; P299-K301 PolarHBondContact O-N 2.77Å; P299-R302 PolarHBondContact O-N 3.09Å
300	M	64.1	Low	81	Confident	170 Å²	170	64 Å²	64	84%	0.837	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-71.6	-16.4	174.8	-79.9	-171.6	155	0	0	112.9	D298	D298-M300 VanDerWaalsContact C-N 3.27Å; D298-M300 PolarHBondContact O-N 2.78Å; D298-M300 WeakPolarHBondContact OD1-CB 3.37Å; D298-M300 PolarHBondContact OD1-N 2.92Å
301	K	71.1	Confident	80.8	Confident	119 Å²	119	65.5 Å²	65.5	52%	0.517	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-104.4	5.9	179.4	-64.6	-174.3	-178.5	103.5	0	114	N296 D298 P299	N296-K301 VanDerWaalsContact ND2-CB 3.27Å; N296-K301 WeakPolarHBondContact ND2-CB 3.37Å; D298-K301 HydrophobicContact CB-CB 4.19Å; D298-K301 HydrophobicContact CB-CD 4.35Å; D298-K301 HydrophobicContact CB-CG 4.28Å; D298-K301 PolarHBondContact O-N 2.84Å; D298-K301 WeakPolarHBondContact OD2-CD 3.48Å; D298-K301 WeakPolarHBondContact OD2-CE 3.2Å; D298-K301 WeakPolarHBondContact OD2-CG 3.46Å; D298-K301 IonicContact OD2-NZ 3.66Å; D298-K301 PolarHBondContact OD2-NZ 2.87Å; P299-K301 PolarHBondContact O-N 2.77Å
302	R	80.3	Confident	80.6	Confident	98 Å²	98	63.3 Å²	63.3	37%	0.37	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-33.9	172.9	-68.1	-175.7	175	176.3	-3.5	112.8	S289 T293 Q294 N296 D298 P299	S289-R302 WeakPolarHBondContact CB-O 3.43Å; T293-R302 WeakPolarHBondContact CB-O 3.39Å; T293-R302 WeakPolarHBondContact O-CA 3.47Å; T293-R302 PolarHBondContact OG1-O 2.74Å; Q294-R302 PolarHBondContact O-NE 3.28Å; N296-R302 HydrophobicContact CB-CG 4.5Å; N296-R302 VanDerWaalsContact O-CZ 3.28Å; N296-R302 PolarHBondContact O-NE 2.97Å; N296-R302 PolarHBondContact O-NH2 3.07Å; D298-R302 PolarHBondContact O-N 2.86Å; P299-R302 PolarHBondContact O-N 3.09Å
303	N	81.5	Confident	80.4	Confident	70 Å²	70	63.1 Å²	63.1	37%	0.374	33%	0.325	S	S	.	.	S	Bend	trans	-118.4	114.5	178.3	-61.1	-1.6	0	0	0	107.8	V288 S305	V288-N303 CarbonylContact O-C 3.51Å; V288-N303 WeakPolarHBondContact O-CA 3.29Å; N303-S305 PolarHBondContact O-N 3.28Å
304	L	86.2	Confident	80.1	Confident	36 Å²	36	65 Å²	65	19%	0.188	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	115.5	172.6	-65.8	165.7	0	0	0	107.4	P175 P178 V288 T293	P175-L304 HydrophobicContact CG-CD1 4.09Å; P178-L304 HydrophobicContact CG-CB 4.5Å; P178-L304 WeakPolarHBondContact CG-O 3.35Å; V288-L304 PolarHBondContact N-O 2.81Å; V288-L304 PolarHBondContact O-N 2.93Å; T293-L304 HydrophobicContact CG2-CD1 4.1Å; T293-L304 HydrophobicContact CG2-CG 4.46Å
305	S	88	Confident	79.5	Confident	70 Å²	70	61.3 Å²	61.3	49%	0.49	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	133.4	-176.2	62	0	0	0	0	113.1	C286 N303	C286-S305 CarbonylContact O-C 3.55Å; C286-S305 VanDerWaalsContact O-CA 3.24Å; C286-S305 WeakPolarHBondContact O-CA 3.41Å; N303-S305 PolarHBondContact O-N 3.28Å
306	I	88.2	Confident	79.3	Confident	14 Å²	14	57.6 Å²	57.6	7%	0.072	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	126.8	167.2	-173.8	166.8	0	0	0	109.7	P178 I180 R190 V285 C286	P178-I306 HydrophobicContact CB-CG2 3.87Å; P178-I306 HydrophobicContact CG-CB 4.14Å; P178-I306 HydrophobicContact CG-CG2 3.82Å; P178-I306 WeakPolarHBondContact O-CB 3.45Å; P178-I306 WeakPolarHBondContact O-CD1 3.38Å; P178-I306 WeakPolarHBondContact O-CG2 3.39Å; I180-I306 HydrophobicContact CD1-CG2 3.87Å; I180-I306 HydrophobicContact CG1-CG2 3.81Å; R190-I306 HydrophobicContact CG-CD1 4.41Å; V285-I306 CarbonylContact C-O 3.46Å; V285-I306 WeakPolarHBondContact CA-O 3.45Å; V285-I306 WeakPolarHBondContact CG1-O 3.29Å; C286-I306 HydrophobicContact CB-CG2 4.06Å; C286-I306 PolarHBondContact N-O 2.92Å; C286-I306 PolarHBondContact O-N 3.48Å
307	T	88.6	Confident	79.3	Confident	46 Å²	46	55 Å²	55	28%	0.282	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	135.7	169	-54.3	0	0	0	0	109	R190 E283 I284 V285	R190-T307 WeakPolarHBondContact CD-O 3.18Å; E283-T307 HydrophobicContact CB-CG2 3.96Å; E283-T307 HydrophobicContact CG-CG2 3.95Å; I284-T307 CarbonylContact O-C 3.56Å; I284-T307 WeakPolarHBondContact O-CA 3.27Å; V285-T307 HydrophobicContact CG2-CG2 4.03Å
308	I	89.8	Confident	79.7	Confident	2 Å²	2	50.8 Å²	50.8	1%	0.01	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	150.4	159.9	60.4	172.8	0	0	0	109.3	I180 L187 R190 L192 L205 I284	I180-I308 HydrophobicContact CB-CD1 4.44Å; I180-I308 HydrophobicContact CB-CG2 4.31Å; I180-I308 HydrophobicContact CD1-CD1 4.2Å; I180-I308 HydrophobicContact CD1-CG1 4.05Å; I180-I308 HydrophobicContact CD1-CG2 4.15Å; I180-I308 HydrophobicContact CG2-CD1 3.85Å; L187-I308 HydrophobicContact CD1-CD1 3.63Å; L187-I308 HydrophobicContact CD1-CG2 4.06Å; R190-I308 HydrophobicContact CB-CG2 4.04Å; R190-I308 CarbonylContact O-C 3.46Å; R190-I308 WeakPolarHBondContact O-CA 3.45Å; R190-I308 VanDerWaalsContact O-CB 3.32Å; R190-I308 WeakPolarHBondContact O-CB 3.49Å; L192-I308 HydrophobicContact CB-CD1 4.21Å; L192-I308 HydrophobicContact CD2-CD1 4.5Å; L205-I308 HydrophobicContact CD1-CD1 4.34Å; I284-I308 HydrophobicContact CB-CD1 4.2Å; I284-I308 HydrophobicContact CB-CG1 3.81Å; I284-I308 HydrophobicContact CD1-CD1 4.49Å; I284-I308 PolarHBondContact N-O 3.33Å; I284-I308 WeakPolarHBondContact O-CG1 3.48Å; I284-I308 PolarHBondContact O-N 2.96Å
309	T	88	Confident	80.3	Confident	48 Å²	48	48.9 Å²	48.9	29%	0.294	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	142.3	174.5	46.4	0	0	0	0	110.6	R190 K191 L192 D282 E283	R190-T309 PolarHBondContact O-N 2.83Å; K191-T309 CarbonylContact C-O 3.59Å; K191-T309 WeakPolarHBondContact CA-O 3.45Å; L192-T309 PolarHBondContact N-O 3.18Å; D282-T309 CarbonylContact O-C 3.58Å; D282-T309 WeakPolarHBondContact O-CA 3.5Å; E283-T309 HydrophobicContact CG-CG2 4.16Å
310	V	85.7	Confident	81.1	Confident	2 Å²	2	50.2 Å²	50.2	1%	0.012	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	129.1	-178.4	-179.6	0	0	0	0	110.4	L192 I194 L278 G281 D282 I284 V312	L192-V310 HydrophobicContact CB-CG2 4.46Å; L192-V310 HydrophobicContact CD2-CG2 4.33Å; L192-V310 WeakPolarHBondContact O-CA 3.49Å; I194-V310 HydrophobicContact CD1-CG1 3.62Å; I194-V310 HydrophobicContact CG1-CG1 3.86Å; L278-V310 HydrophobicContact CB-CG1 4.39Å; L278-V310 HydrophobicContact CD2-CG2 4.31Å; G281-V310 WeakPolarHBondContact CA-O 3.31Å; G281-V310 PolarHBondContact N-O 3.27Å; D282-V310 HydrophobicContact CB-CB 4.04Å; D282-V310 HydrophobicContact CB-CG2 3.99Å; D282-V310 WeakPolarHBondContact O-CG2 3.4Å; D282-V310 PolarHBondContact O-N 3.36Å; I284-V310 HydrophobicContact CD1-CG2 3.84Å; I284-V310 HydrophobicContact CG1-CG2 4.06Å; V310-V312 HydrophobicContact CG1-CG2 3.98Å
311	D	83.6	Confident	82.2	Confident	36 Å²	36	42.6 Å²	42.6	19%	0.193	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	107.6	173.5	-119.6	-48.4	0	0	0	108.2	K191 L192 I193 I194 H313	K191-D311 WeakPolarHBondContact CD-OD2 3.48Å; K191-D311 WeakPolarHBondContact CE-OD2 3.43Å; K191-D311 IonicContact NZ-OD2 3.94Å; K191-D311 PolarHBondContact NZ-OD2 3.28Å; L192-D311 PolarHBondContact O-N 3.04Å; I193-D311 HydrophobicContact CG1-CB 4.27Å; I194-D311 PolarHBondContact N-O 2.95Å; D311-H313 PolarHBondContact O-N 2.84Å
312	V	80.1	Confident	82.9	Confident	13 Å²	13	39.8 Å²	39.8	8%	0.079	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	99.4	-177.4	-177	0	0	0	0	108.8	I194 Q196 D280 V310 K347	I194-V312 HydrophobicContact CD1-CG2 4.34Å; I194-V312 HydrophobicContact CG1-CG2 4.43Å; Q196-V312 HydrophobicContact CG-CG1 4.17Å; D280-V312 HydrophobicContact CB-CB 4.44Å; D280-V312 PolarHBondContact OD1-N 3.31Å; V310-V312 HydrophobicContact CG1-CG2 3.98Å; V312-K347 PolarHBondContact O-NZ 3.02Å
313	H	80.4	Confident	83	Confident	10 Å²	10	37.3 Å²	37.3	5%	0.046	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	130.4	-177.3	-84.9	-148.4	0	0	0	110.9	I193 I194 S195 Q196 D311 K347 P348 H464 V466	I193-H313 HydrophobicContact CG2-CB 4.16Å; I193-H313 VanDerWaalsContact CG2-CE1 3.44Å; I193-H313 WeakPolarHBondContact CG2-CE1 3.35Å; I193-H313 VanDerWaalsContact CG2-CG 3.47Å; I193-H313 VanDerWaalsContact CG2-ND1 3.34Å; I193-H313 WeakPolarHBondContact CG2-ND1 3.18Å; I194-H313 PolarHBondContact O-N 2.9Å; S195-H313 CarbonylContact C-O 3.51Å; S195-H313 VanDerWaalsContact CA-O 3.26Å; S195-H313 WeakPolarHBondContact CA-O 3.3Å; Q196-H313 PolarHBondContact N-O 2.91Å; D311-H313 PolarHBondContact O-N 2.84Å; H313-K347 CarbonylContact C-O 3.54Å; H313-K347 WeakPolarHBondContact CA-O 3.2Å; H313-P348 WeakPolarHBondContact CD2-CD 3.49Å; H313-P348 WeakPolarHBondContact CE1-CD 3.49Å; H313-P348 WeakPolarHBondContact NE2-CD 3.23Å; H313-H464 WeakPolarHBondContact CB-CE1 3.48Å; H313-H464 AromaticContact CG-CE1 3.58Å; H313-H464 AromaticContact ND1-CE1 3.65Å; H313-V466 HydrophobicContact CB-CG1 4.06Å; H313-V466 HydrophobicContact CB-CG2 3.76Å
314	T	76.3	Confident	82.7	Confident	49 Å²	49	34.6 Å²	34.6	30%	0.301	21%	0.206	S	C	.	.	B	Isolated β-bridge	trans	-112.1	129.7	168.1	64.6	0	0	0	0	109.8	Q196 G346 K347 H464	Q196-T314 WeakPolarHBondContact O-CA 3.36Å; Q196-T314 WeakPolarHBondContact O-CG2 3.49Å; T314-G346 CarbonylContact O-C 3.01Å; T314-G346 WeakPolarHBondContact O-CA 3.43Å; T314-K347 PolarHBondContact N-O 2.92Å; T314-K347 PolarHBondContact O-N 2.87Å; T314-K347 WeakPolarHBondContact OG1-CB 3.08Å; T314-K347 PolarHBondContact OG1-N 2.79Å; T314-H464 PolarHBondContact N-CE1 2.81Å; T314-H464 PolarHBondContact O-CE1 2.84Å; T314-H464 PolarHBondContact O-NE2 2.82Å
315	P	70.7	Confident	82	Confident	33 Å²	33	40.2 Å²	40.2	21%	0.214	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-70.6	154.6	-179.2	25.4	-30.2	0	0	0	112.8	Q196 S468	Q196-P315 VanDerWaalsContact O-CD 3.22Å; Q196-P315 WeakPolarHBondContact O-CD 3.25Å; P315-S468 WeakPolarHBondContact CB-OG 3.15Å
316	P	74.6	Confident	81.6	Confident	5 Å²	5	40.4 Å²	40.4	3%	0.032	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-66.1	144.4	169.7	30.2	-35.9	0	0	0	111	S342 P344 L440 T462 H464	P316-S342 WeakPolarHBondContact CB-OG 3.31Å; P316-P344 CarbonylContact C-O 3.59Å; P316-P344 WeakPolarHBondContact CA-O 3.22Å; P316-L440 HydrophobicContact CB-CD1 4.4Å; P316-T462 HydrophobicContact CB-CG2 4.31Å; P316-T462 HydrophobicContact CG-CG2 4.27Å; P316-H464 VanDerWaalsContact CD-CB 3.46Å; P316-H464 VanDerWaalsContact CD-CD2 3.49Å; P316-H464 WeakPolarHBondContact CD-CD2 3.31Å; P316-H464 VanDerWaalsContact CD-CG 3.43Å; P316-H464 HydrophobicContact CG-CB 4.08Å
317	G	74.5	Confident	81.1	Confident	10 Å²	10	43.9 Å²	43.9	10%	0.103	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-68.2	160.1	174.6	0	0	0	0	0	112.2	S342 P344	G317-S342 PolarHBondContact N-OG 2.9Å; G317-S342 WeakPolarHBondContact O-CB 3.48Å; G317-S342 PolarHBondContact O-OG 2.85Å; G317-P344 PolarHBondContact N-O 3.26Å
318	P	79.1	Confident	80.5	Confident	87 Å²	87	46 Å²	46	57%	0.565	26%	0.258	S	S	*	.	P	Polyproline II helix	trans	-56.9	141.1	-175	23.2	-34.3	0	0	0	112.6	H470	P318-H470 HydrophobicContact CB-CB 4.03Å
319	P	86.3	Confident	80.1	Confident	12 Å²	12	49.1 Å²	49.1	8%	0.078	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-72.4	139.8	-177.4	29.4	-32.7	0	0	0	111.3	V341 L352 T462 H470 T472	P319-V341 WeakPolarHBondContact CA-O 3.42Å; P319-L352 HydrophobicContact CB-CD1 3.83Å; P319-T462 HydrophobicContact CB-CG2 4.06Å; P319-T462 HydrophobicContact CG-CG2 4.11Å; P319-H470 VanDerWaalsContact CD-CB 3.4Å; P319-H470 HydrophobicContact CG-CB 4.38Å; P319-H470 WeakPolarHBondContact CG-O 3.44Å; P319-T472 HydrophobicContact CB-CG2 4.09Å; P319-T472 HydrophobicContact CG-CG2 4.11Å; P319-T472 WeakPolarHBondContact O-CG2 2.97Å
320	K	86.8	Confident	79.9	Confident	125 Å²	125	47.6 Å²	47.6	54%	0.543	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	123.9	168.5	-169.8	-174.7	177.1	-164.1	0	109.5	V322 C340 V341	K320-V322 HydrophobicContact CB-CG2 4.39Å; K320-V322 HydrophobicContact CD-CG2 4.13Å; K320-V322 HydrophobicContact CG-CG2 4.12Å; K320-C340 CarbonylContact O-C 3.59Å; K320-C340 WeakPolarHBondContact O-CA 3.16Å; K320-V341 PolarHBondContact N-O 3.19Å; K320-V341 PolarHBondContact O-N 2.96Å
321	I	87	Confident	79.5	Confident	9 Å²	9	52 Å²	52	5%	0.046	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	124.3	164.1	-61	164.1	0	0	0	107.1	S323 P324 V339 C340 W354 C460 T472 I474	I321-S323 WeakPolarHBondContact CG2-O 3.25Å; I321-P324 WeakPolarHBondContact CG2-O 3.46Å; I321-V339 WeakPolarHBondContact CA-O 3.49Å; I321-C340 HydrophobicContact CG1-CB 4.28Å; I321-W354 HydrophobicContact CD1-CH2 4.24Å; I321-W354 HydrophobicContact CD1-CZ3 3.77Å; I321-W354 HydrophobicContact CG1-CH2 3.87Å; I321-W354 HydrophobicContact CG1-CZ3 3.9Å; I321-W354 HydrophobicContact CG2-CH2 4.26Å; I321-C460 HydrophobicContact CD1-CB 4.03Å; I321-C460 HydrophobicContact CG1-CB 3.82Å; I321-T472 HydrophobicContact CD1-CG2 3.97Å; I321-T472 HydrophobicContact CG1-CG2 3.81Å; I321-I474 HydrophobicContact CD1-CG1 4.2Å; I321-I474 HydrophobicContact CD1-CG2 4.2Å; I321-I474 HydrophobicContact CG2-CD1 4.27Å
322	V	85.1	Confident	79.1	Confident	61 Å²	61	53.5 Å²	53.5	37%	0.37	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	-14.3	-176.1	-173.8	0	0	0	0	111.2	K320 E325 V339 V341	K320-V322 HydrophobicContact CB-CG2 4.39Å; K320-V322 HydrophobicContact CD-CG2 4.13Å; K320-V322 HydrophobicContact CG-CG2 4.12Å; V322-E325 WeakPolarHBondContact O-CG 3.4Å; V322-V339 PolarHBondContact N-O 3Å; V322-V341 HydrophobicContact CB-CG2 4.44Å; V322-V341 HydrophobicContact CG2-CG2 3.4Å
323	S	82.4	Confident	78.7	Confident	46 Å²	46	54.4 Å²	54.4	32%	0.322	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	128	171.1	-168.5	0	0	0	0	108.7	I321 A338 V339	I321-S323 WeakPolarHBondContact CG2-O 3.25Å; S323-A338 CarbonylContact O-C 3.57Å; S323-A338 WeakPolarHBondContact O-CA 3.33Å; S323-V339 PolarHBondContact N-O 3.37Å; S323-V339 PolarHBondContact O-N 3.38Å
324	P	76.3	Confident	78.7	Confident	12 Å²	12	57.9 Å²	57.9	8%	0.078	33%	0.325	C	S	.	.	S	Bend	cis	-63.5	150.9	-23.7	32.7	-35.7	0	0	0	110.7	I321 S326 H328 I474	I321-P324 WeakPolarHBondContact CG2-O 3.46Å; P324-S326 PolarHBondContact O-N 2.83Å; P324-H328 HydrophobicContact CB-CB 3.84Å; P324-H328 HydrophobicContact CG-CB 3.82Å; P324-I474 HydrophobicContact CG-CD1 3.56Å
325	E	71.7	Confident	79.1	Confident	154 Å²	154	60.1 Å²	60.1	72%	0.72	33%	0.332	S	S	*	.	S	Bend	trans	-72	-12.3	-178	-64.2	-166.3	123.4	0	0	114.3	V322	V322-E325 WeakPolarHBondContact O-CG 3.4Å
326	S	78.9	Confident	79.9	Confident	75 Å²	75	58.5 Å²	58.5	52%	0.524	32%	0.322	S	S	.	.	S	Bend	trans	-155.3	-179.9	-176.1	64.7	0	0	0	0	110.9	P324 H328	P324-S326 PolarHBondContact O-N 2.83Å; S326-H328 PolarHBondContact O-N 2.98Å
327	N	77.9	Confident	80.6	Confident	87 Å²	87	63.8 Å²	63.8	47%	0.465	34%	0.341	S	S	.	.			trans	-55.6	121.7	176.6	-66.5	-2.5	0	0	0	110.7	T475 F477	N327-T475 VanDerWaalsContact CA-O 3.25Å; N327-T475 WeakPolarHBondContact CA-O 3.21Å; N327-T475 WeakPolarHBondContact CB-O 3.42Å; N327-T475 PolarHBondContact OD1-N 2.78Å; N327-F477 HydrophobicContact CB-CE2 4.2Å
328	H	76.2	Confident	81.2	Confident	91 Å²	91	63.3 Å²	63.3	42%	0.421	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	145.8	-171.1	-147.9	69.7	0	0	0	111.5	P324 S326 Y330 T475 F477	P324-H328 HydrophobicContact CB-CB 3.84Å; P324-H328 HydrophobicContact CG-CB 3.82Å; S326-H328 PolarHBondContact O-N 2.98Å; H328-Y330 HydrophobicContact CB-CD2 4.46Å; H328-Y330 HydrophobicContact CB-CE2 3.85Å; H328-Y330 AromaticContact CD2-CE2 3.97Å; H328-Y330 AromaticContact CD2-CZ 3.85Å; H328-T475 PolarHBondContact N-O 3.39Å; H328-F477 PolarHBondContact O-N 3.2Å
329	V	81.2	Confident	81.7	Confident	66 Å²	66	60.1 Å²	60.1	40%	0.4	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	102.1	-178.4	-170.5	0	0	0	0	108.7	F477 K479	V329-F477 WeakPolarHBondContact CA-O 3.22Å; V329-F477 HydrophobicContact CB-CB 4.44Å; V329-F477 HydrophobicContact CG1-CB 4.26Å; V329-F477 HydrophobicContact CG2-CB 4.11Å; V329-K479 HydrophobicContact CG1-CD 3.95Å; V329-K479 HydrophobicContact CG1-CG 3.77Å
330	Y	82.6	Confident	81.9	Confident	17 Å²	17	59.6 Å²	59.6	7%	0.067	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	160.6	175.3	-64.4	-92	0	0	0	110.7	H328 E334 L336 I476 F477 V478 K479	H328-Y330 HydrophobicContact CB-CD2 4.46Å; H328-Y330 HydrophobicContact CB-CE2 3.85Å; H328-Y330 AromaticContact CD2-CE2 3.97Å; H328-Y330 AromaticContact CD2-CZ 3.85Å; Y330-E334 WeakPolarHBondContact CA-OE2 3.43Å; Y330-E334 HydrophobicContact CD1-CB 4.28Å; Y330-L336 HydrophobicContact CD2-CD1 4.36Å; Y330-L336 HydrophobicContact CE1-CB 4.18Å; Y330-L336 HydrophobicContact CE1-CG 4.39Å; Y330-L336 HydrophobicContact CE2-CD1 3.78Å; Y330-L336 HydrophobicContact CE2-CG 4.17Å; Y330-I476 HydrophobicContact CD2-CG2 3.85Å; Y330-I476 HydrophobicContact CE2-CD1 4.22Å; Y330-I476 HydrophobicContact CE2-CG2 4.11Å; Y330-F477 PolarHBondContact N-O 3.12Å; Y330-V478 CarbonylContact O-C 3.59Å; Y330-V478 WeakPolarHBondContact O-CA 3.18Å; Y330-K479 PolarHBondContact O-N 3.24Å
331	L	78.5	Confident	82	Confident	93 Å²	93	54.9 Å²	54.9	49%	0.487	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	150.3	163.8	-59.7	169.1	0	0	0	110	G333 E334 K479	L331-G333 PolarHBondContact O-N 2.99Å; L331-E334 HydrophobicContact CB-CG 3.99Å; L331-E334 PolarHBondContact N-OE2 3.3Å; L331-E334 WeakPolarHBondContact O-CB 3.28Å; L331-E334 PolarHBondContact O-N 2.81Å; L331-K479 HydrophobicContact CD2-CB 4.03Å; L331-K479 HydrophobicContact CD2-CD 4.28Å
332	D	75	Confident	81.9	Confident	68 Å²	68	54.5 Å²	54.5	36%	0.364	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	119.8	175.8	-158.8	-4.2	0	0	0	110.3	T450 R451 V478 K479 H480	D332-T450 VanDerWaalsContact OD1-CA 3.24Å; D332-T450 WeakPolarHBondContact OD1-CA 3.49Å; D332-R451 PolarHBondContact OD1-N 2.79Å; D332-V478 HydrophobicContact CB-CG1 4.1Å; D332-K479 PolarHBondContact N-O 2.91Å; D332-H480 HydrophobicContact CB-CB 3.86Å; D332-H480 WeakPolarHBondContact OD2-CB 3.42Å
333	G	72.4	Confident	81.9	Confident	32 Å²	32	54.6 Å²	54.6	33%	0.33	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.7	-0.5	-174.9	0	0	0	0	0	116.3	L331 V449	L331-G333 PolarHBondContact O-N 2.99Å; G333-V449 PolarHBondContact N-O 2.98Å
334	E	79.5	Confident	81.7	Confident	83 Å²	83	55.9 Å²	55.9	39%	0.388	30%	0.302	S	S	.	.			trans	-68.9	152.5	169.6	-87.6	-179	154.4	0	0	112.5	Y330 L331 L336 V449	Y330-E334 WeakPolarHBondContact CA-OE2 3.43Å; Y330-E334 HydrophobicContact CD1-CB 4.28Å; L331-E334 HydrophobicContact CB-CG 3.99Å; L331-E334 PolarHBondContact N-OE2 3.3Å; L331-E334 WeakPolarHBondContact O-CB 3.28Å; L331-E334 PolarHBondContact O-N 2.81Å; E334-L336 PolarHBondContact O-N 2.75Å; E334-V449 PolarHBondContact O-N 3.49Å
335	Q	85.2	Confident	81.7	Confident	96 Å²	96	55.8 Å²	55.8	45%	0.449	30%	0.301	S	S	.	.			trans	-75.7	106.6	172.8	-178.3	-175.1	0.1	0	0	109.8	R337 I445 I446	Q335-R337 PolarHBondContact O-N 2.93Å; Q335-I445 HydrophobicContact CG-CG2 4.09Å; Q335-I445 VanDerWaalsContact NE2-CG2 3.27Å; Q335-I446 WeakPolarHBondContact CA-O 3.45Å
336	L	86.8	Confident	81.8	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	114.6	166.1	178.3	150	0	0	0	108.2	Y330 E334 A338 W356 L444 I445 I446 V449 L458 I476	Y330-L336 HydrophobicContact CD2-CD1 4.36Å; Y330-L336 HydrophobicContact CE1-CB 4.18Å; Y330-L336 HydrophobicContact CE1-CG 4.39Å; Y330-L336 HydrophobicContact CE2-CD1 3.78Å; Y330-L336 HydrophobicContact CE2-CG 4.17Å; E334-L336 PolarHBondContact O-N 2.75Å; L336-A338 HydrophobicContact CD2-CB 3.98Å; L336-W356 HydrophobicContact CD1-CH2 4.27Å; L336-L444 HydrophobicContact CD2-CD2 4.08Å; L336-L444 HydrophobicContact CD2-CG 4.1Å; L336-I445 WeakPolarHBondContact O-CA 3.38Å; L336-I446 HydrophobicContact CB-CB 4.42Å; L336-I446 PolarHBondContact N-O 3.37Å; L336-I446 PolarHBondContact O-N 3.23Å; L336-V449 HydrophobicContact CB-CB 4.12Å; L336-V449 HydrophobicContact CB-CG2 3.41Å; L336-V449 VanDerWaalsContact CB-CG2 3.41Å; L336-V449 HydrophobicContact CD1-CG2 3.84Å; L336-V449 HydrophobicContact CG-CG2 4.2Å; L336-L458 HydrophobicContact CD2-CD2 4.46Å; L336-I476 HydrophobicContact CD1-CD1 3.86Å; L336-I476 HydrophobicContact CD1-CG1 3.96Å; L336-I476 HydrophobicContact CD1-CG2 3.86Å
337	R	88.4	Confident	81.5	Confident	116 Å²	116	49.3 Å²	49.3	44%	0.438	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	110.1	167.6	-176.9	172.9	-176.3	-83.4	-4.2	108.7	Q335 T443 L444 I445	Q335-R337 PolarHBondContact O-N 2.93Å; R337-T443 HydrophobicContact CG-CG2 4.14Å; R337-L444 CarbonylContact C-O 3.39Å; R337-L444 WeakPolarHBondContact CA-O 3.35Å; R337-I445 HydrophobicContact CB-CG1 4.35Å; R337-I445 HydrophobicContact CG-CG1 3.95Å
338	A	88.4	Confident	81.1	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	137.1	175.2	0	0	0	0	0	110.4	S323 L336 W354 T443 L444 L458	S323-A338 CarbonylContact O-C 3.57Å; S323-A338 WeakPolarHBondContact O-CA 3.33Å; L336-A338 HydrophobicContact CD2-CB 3.98Å; A338-W354 HydrophobicContact CB-CH2 3.53Å; A338-W354 HydrophobicContact CB-CZ2 3.88Å; A338-W354 HydrophobicContact CB-CZ3 4.16Å; A338-T443 CarbonylContact O-C 3.09Å; A338-T443 WeakPolarHBondContact O-CA 3.48Å; A338-L444 HydrophobicContact CB-CB 4.31Å; A338-L444 HydrophobicContact CB-CD2 4.47Å; A338-L444 PolarHBondContact N-O 2.68Å; A338-L444 PolarHBondContact O-N 3.37Å; A338-L458 HydrophobicContact CB-CD2 3.95Å
339	V	89.9	Confident	80.9	Confident	20 Å²	20	48.4 Å²	48.4	12%	0.121	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	120.8	179.5	-175.3	0	0	0	0	109.1	I321 V322 S323 V441 T443	I321-V339 WeakPolarHBondContact CA-O 3.49Å; V322-V339 PolarHBondContact N-O 3Å; S323-V339 PolarHBondContact N-O 3.37Å; S323-V339 PolarHBondContact O-N 3.38Å; V339-V441 HydrophobicContact CG1-CG1 3.84Å; V339-T443 HydrophobicContact CG2-CG2 4.19Å
340	C	89.3	Confident	80.4	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	142.7	170.7	-170.3	0	0	0	0	109.6	K320 I321 L352 W354 N442 C460	K320-C340 CarbonylContact O-C 3.59Å; K320-C340 WeakPolarHBondContact O-CA 3.16Å; I321-C340 HydrophobicContact CG1-CB 4.28Å; C340-L352 HydrophobicContact CB-CD2 4.25Å; C340-W354 HydrophobicContact CB-CH2 3.77Å; C340-W354 HydrophobicContact CB-CZ2 3.52Å; C340-N442 PolarHBondContact N-O 3.02Å; C340-N442 PolarHBondContact O-N 2.84Å; C340-C460 HydrophobicContact CB-CB 3.75Å; C340-C460 WeakPolarHBondContact CB-SG 3.42Å; C340-C460 WeakPolarHBondContact SG-CB 3.43Å; C340-C460 CovalentContact SG-SG 2.03Å; C340-C460 PolarHBondContact SG-SG 3.26Å
341	V	90.3	Very high	79.9	Confident	26 Å²	26	45.1 Å²	45.1	16%	0.158	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	145.2	172.1	-89.9	0	0	0	0	112.2	P319 K320 V322 Q439 L440 V441	P319-V341 WeakPolarHBondContact CA-O 3.42Å; K320-V341 PolarHBondContact N-O 3.19Å; K320-V341 PolarHBondContact O-N 2.96Å; V322-V341 HydrophobicContact CB-CG2 4.44Å; V322-V341 HydrophobicContact CG2-CG2 3.4Å; V341-Q439 HydrophobicContact CG1-CB 4.46Å; V341-L440 CarbonylContact C-O 3.58Å; V341-L440 WeakPolarHBondContact CA-O 3.46Å; V341-V441 HydrophobicContact CG1-CB 4.1Å; V341-V441 HydrophobicContact CG1-CG1 4.09Å; V341-V441 HydrophobicContact CG1-CG2 3.76Å
342	S	84.8	Confident	79.9	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.007	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	136	168.2	164.7	0	0	0	0	109.1	P316 G317 P344 Q439 L440	P316-S342 WeakPolarHBondContact CB-OG 3.31Å; G317-S342 PolarHBondContact N-OG 2.9Å; G317-S342 WeakPolarHBondContact O-CB 3.48Å; G317-S342 PolarHBondContact O-OG 2.85Å; S342-P344 PolarHBondContact OG-O 3.04Å; S342-Q439 CarbonylContact O-C 3.5Å; S342-Q439 WeakPolarHBondContact O-CA 3.08Å; S342-L440 PolarHBondContact N-O 3.5Å; S342-L440 PolarHBondContact O-N 2.9Å
343	S	84.1	Confident	80.3	Confident	64 Å²	64	39.6 Å²	39.6	45%	0.448	22%	0.219	S	C	.	.	S	Bend	trans	-146.9	116.3	-173	-175.7	0	0	0	0	108.9	Q439	S343-Q439 PolarHBondContact OG-NE2 3.1Å
344	P	78.1	Confident	80.8	Confident	73 Å²	73	38.4 Å²	38.4	47%	0.474	21%	0.205	S	C	.	.	S	Bend	cis	-68.9	166.9	-2.1	31.9	-37.6	0	0	0	113.1	P316 G317 S342 G346	P316-P344 CarbonylContact C-O 3.59Å; P316-P344 WeakPolarHBondContact CA-O 3.22Å; G317-P344 PolarHBondContact N-O 3.26Å; S342-P344 PolarHBondContact OG-O 3.04Å; P344-G346 PolarHBondContact O-N 2.93Å
345	P	76.6	Confident	80.9	Confident	10 Å²	10	37.2 Å²	37.2	7%	0.065	20%	0.197	C	C	.	.			trans	-79.1	1.4	-177.6	34	-37.9	0	0	0	114.3	L349 G350 D438 L440	P345-L349 HydrophobicContact CB-CD2 3.95Å; P345-G350 PolarHBondContact O-N 2.71Å; P345-D438 WeakPolarHBondContact CD-O 3.38Å; P345-L440 HydrophobicContact CB-CB 4.11Å; P345-L440 HydrophobicContact CB-CD1 4.06Å; P345-L440 HydrophobicContact CB-CG 3.65Å; P345-L440 WeakPolarHBondContact O-CD1 3.38Å
346	G	73.2	Confident	80.7	Confident	13 Å²	13	32.9 Å²	32.9	13%	0.134	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.6	169.1	-168.7	0	0	0	0	0	114.3	T314 P344 P348	T314-G346 CarbonylContact O-C 3.01Å; T314-G346 WeakPolarHBondContact O-CA 3.43Å; P344-G346 PolarHBondContact O-N 2.93Å; G346-P348 CarbonylContact C-O 3.41Å
347	K	73.7	Confident	80.2	Confident	79 Å²	79	34.6 Å²	34.6	34%	0.343	19%	0.185	S	C	.	.	B	Isolated β-bridge	trans	-138.2	125.7	173.8	179.7	-176	165.4	-64.8	0	108.2	D280 V312 H313 T314 H464	D280-K347 IonicContact OD1-NZ 3.92Å; D280-K347 PolarHBondContact OD1-NZ 2.68Å; D280-K347 WeakPolarHBondContact OD2-CE 3.36Å; D280-K347 IonicContact OD2-NZ 3.06Å; D280-K347 PolarHBondContact OD2-NZ 2.76Å; V312-K347 PolarHBondContact O-NZ 3.02Å; H313-K347 CarbonylContact C-O 3.54Å; H313-K347 WeakPolarHBondContact CA-O 3.2Å; T314-K347 PolarHBondContact N-O 2.92Å; T314-K347 PolarHBondContact O-N 2.87Å; T314-K347 WeakPolarHBondContact OG1-CB 3.08Å; T314-K347 PolarHBondContact OG1-N 2.79Å; K347-H464 PolarHBondContact N-NE2 2.94Å; K347-H464 VanDerWaalsContact N-NE2 3.18Å; K347-H464 PolarHBondContact O-CE1 2.77Å; K347-H464 PolarHBondContact O-NE2 3.17Å
348	P	68.9	Low	79.6	Confident	60 Å²	60	29.3 Å²	29.3	39%	0.39	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	cis	-51.3	165.7	-22.9	29.7	-36.9	0	0	0	110.7	H313 G346 G350 H464	H313-P348 WeakPolarHBondContact CD2-CD 3.49Å; H313-P348 WeakPolarHBondContact CE1-CD 3.49Å; H313-P348 WeakPolarHBondContact NE2-CD 3.23Å; G346-P348 CarbonylContact C-O 3.41Å; P348-G350 PolarHBondContact O-N 2.74Å; P348-H464 VanDerWaalsContact C-NE2 3.27Å; P348-H464 PolarHBondContact O-NE2 3.08Å
349	L	72.2	Confident	78.5	Confident	99 Å²	99	32.6 Å²	32.6	52%	0.518	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47	122.6	-179.9	-98.1	153.6	0	0	0	111.3	P345 K435 L440	P345-L349 HydrophobicContact CB-CD2 3.95Å; L349-K435 HydrophobicContact CD1-CD 4.15Å; L349-K435 HydrophobicContact CD2-CB 4.19Å; L349-K435 HydrophobicContact CD2-CD 4.15Å; L349-K435 HydrophobicContact CD2-CG 4.35Å; L349-K435 HydrophobicContact CG-CD 4.42Å; L349-L440 HydrophobicContact CD2-CD1 4.28Å; L349-L440 HydrophobicContact CD2-CD2 3.63Å; L349-L440 HydrophobicContact CD2-CG 3.77Å
350	G	69.9	Low	76.6	Confident	6 Å²	6	35 Å²	35	6%	0.062	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-69.2	165.4	173.2	0	0	0	0	0	112.9	P345 P348 L440 G463	P345-G350 PolarHBondContact O-N 2.71Å; P348-G350 PolarHBondContact O-N 2.74Å; G350-L440 WeakPolarHBondContact O-CD1 3.18Å; G350-G463 WeakPolarHBondContact CA-O 3.2Å
351	G	73.2	Confident	74.7	Confident	8 Å²	8	39.1 Å²	39.1	8%	0.082	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	143.4	163.4	0	0	0	0	0	110.6	T462 G463	G351-T462 WeakPolarHBondContact O-CA 3.45Å; G351-G463 PolarHBondContact N-O 2.61Å; G351-G463 PolarHBondContact O-N 3.33Å
352	L	78	Confident	72.9	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	116.8	168	-170.5	67.4	0	0	0	105.9	P319 C340 L433 L440 N442 C460 E461 T462	P319-L352 HydrophobicContact CB-CD1 3.83Å; C340-L352 HydrophobicContact CB-CD2 4.25Å; L352-L433 HydrophobicContact CB-CD1 3.77Å; L352-L440 HydrophobicContact CD2-CB 4.3Å; L352-L440 WeakPolarHBondContact CD2-O 3.33Å; L352-N442 HydrophobicContact CB-CB 4.22Å; L352-N442 HydrophobicContact CD2-CB 3.83Å; L352-N442 HydrophobicContact CG-CB 4Å; L352-N442 PolarHBondContact O-ND2 3.4Å; L352-C460 VanDerWaalsContact CD1-SG 3.56Å; L352-E461 CarbonylContact C-O 3.58Å; L352-E461 WeakPolarHBondContact CA-O 3.45Å; L352-T462 HydrophobicContact CD1-CG2 3.65Å
353	F	82.6	Confident	71.1	Confident	46 Å²	46	43.6 Å²	43.6	20%	0.202	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	157.7	-163.4	-55.8	-68.3	0	0	0	112.2	C460 E461	F353-C460 CarbonylContact O-C 3.49Å; F353-C460 VanDerWaalsContact O-CA 3.28Å; F353-C460 WeakPolarHBondContact O-CA 3.39Å; F353-E461 PolarHBondContact N-O 2.92Å; F353-E461 PolarHBondContact O-N 3.49Å
354	W	83.2	Confident	68.9	Low	7 Å²	7	48.7 Å²	48.7	3%	0.027	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	137.8	176.2	-67.4	103.5	0	0	0	111.7	I321 A338 C340 V426 N442 L444 L458 I459 C460	I321-W354 HydrophobicContact CD1-CH2 4.24Å; I321-W354 HydrophobicContact CD1-CZ3 3.77Å; I321-W354 HydrophobicContact CG1-CH2 3.87Å; I321-W354 HydrophobicContact CG1-CZ3 3.9Å; I321-W354 HydrophobicContact CG2-CH2 4.26Å; A338-W354 HydrophobicContact CB-CH2 3.53Å; A338-W354 HydrophobicContact CB-CZ2 3.88Å; A338-W354 HydrophobicContact CB-CZ3 4.16Å; C340-W354 HydrophobicContact CB-CH2 3.77Å; C340-W354 HydrophobicContact CB-CZ2 3.52Å; W354-V426 HydrophobicContact CB-CB 3.95Å; W354-V426 HydrophobicContact CB-CG2 3.69Å; W354-V426 WeakPolarHBondContact O-CB 3.48Å; W354-V426 WeakPolarHBondContact O-CG2 3.49Å; W354-V426 PolarHBondContact O-N 2.83Å; W354-N442 VanDerWaalsContact CD1-CG 3.44Å; W354-N442 VanDerWaalsContact CD1-OD1 3.31Å; W354-N442 PolarHBondContact NE1-OD1 3.48Å; W354-L444 HydrophobicContact CB-CD2 4.39Å; W354-L444 HydrophobicContact CD2-CB 4.11Å; W354-L444 HydrophobicContact CD2-CD2 4.03Å; W354-L444 HydrophobicContact CE3-CD2 4.3Å; W354-L444 HydrophobicContact CG-CB 4.16Å; W354-L444 HydrophobicContact CG-CD2 4.11Å; W354-L444 HydrophobicContact CZ2-CB 4.09Å; W354-L458 HydrophobicContact CB-CD1 4.49Å; W354-L458 HydrophobicContact CD2-CD1 4.45Å; W354-L458 HydrophobicContact CE3-CD1 3.68Å; W354-L458 HydrophobicContact CE3-CD2 3.92Å; W354-L458 HydrophobicContact CE3-CG 3.64Å; W354-L458 HydrophobicContact CH2-CD2 4.44Å; W354-L458 HydrophobicContact CZ3-CD1 4.28Å; W354-L458 HydrophobicContact CZ3-CD2 3.68Å; W354-L458 HydrophobicContact CZ3-CG 3.72Å; W354-I459 VanDerWaalsContact CA-O 3.32Å; W354-I459 WeakPolarHBondContact CA-O 3.21Å; W354-C460 HydrophobicContact CD2-CB 4.48Å; W354-C460 HydrophobicContact CE3-CB 3.97Å; W354-C460 HydrophobicContact CH2-CB 4.4Å; W354-C460 HydrophobicContact CZ3-CB 3.92Å
355	R	81.8	Confident	67	Low	58 Å²	58	50.6 Å²	50.6	22%	0.219	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	142	-178.7	-175.4	166.3	71.5	94.6	-3	111.5	S423 D425 I459	R355-S423 WeakPolarHBondContact CD-OG 3.49Å; R355-S423 PolarHBondContact NH1-OG 2.81Å; R355-D425 WeakPolarHBondContact CD-OD1 3.47Å; R355-D425 VanDerWaalsContact CG-OD1 3.25Å; R355-D425 WeakPolarHBondContact CG-OD1 3.36Å; R355-I459 HydrophobicContact CB-CB 4.44Å; R355-I459 PolarHBondContact N-O 3.19Å; R355-I459 PolarHBondContact O-N 3.39Å
356	W	81.7	Confident	64.8	Low	5 Å²	5	58.2 Å²	58.2	2%	0.019	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	149.9	174.3	-69.7	101.5	0	0	0	112.3	L336 I358 S423 E424 I446 Y453 A456 K457 L458 I476	L336-W356 HydrophobicContact CD1-CH2 4.27Å; W356-I358 HydrophobicContact CB-CD1 4.38Å; W356-I358 HydrophobicContact CB-CG1 4.12Å; W356-S423 WeakPolarHBondContact O-CA 3.16Å; W356-E424 HydrophobicContact CB-CB 4.29Å; W356-E424 WeakPolarHBondContact CB-O 3.45Å; W356-E424 PolarHBondContact N-O 3.02Å; W356-E424 PolarHBondContact O-N 3.04Å; W356-E424 VanDerWaalsContact O-N 3.08Å; W356-I446 HydrophobicContact CZ2-CD1 3.7Å; W356-Y453 AromaticContact CD2-CD1 3.99Å; W356-Y453 HydrophobicContact CD2-CD1 3.99Å; W356-Y453 HydrophobicContact CD2-CE1 4.23Å; W356-Y453 AromaticContact CE2-CD1 3.8Å; W356-Y453 AromaticContact CE2-CE1 3.87Å; W356-Y453 HydrophobicContact CE3-CD1 4.13Å; W356-Y453 AromaticContact CH2-CD1 3.91Å; W356-Y453 HydrophobicContact CH2-CD1 3.91Å; W356-Y453 HydrophobicContact CH2-CG 4.25Å; W356-Y453 AromaticContact CZ2-CD1 3.79Å; W356-Y453 HydrophobicContact CZ2-CD1 3.79Å; W356-Y453 HydrophobicContact CZ2-CE1 4.16Å; W356-Y453 HydrophobicContact CZ2-CG 4.34Å; W356-Y453 HydrophobicContact CZ3-CD1 4.09Å; W356-Y453 AromaticContact NE1-CE1 3.95Å; W356-A456 HydrophobicContact CE3-CB 3.81Å; W356-A456 HydrophobicContact CZ3-CB 3.89Å; W356-K457 CarbonylContact C-O 3.58Å; W356-K457 VanDerWaalsContact CA-O 3.31Å; W356-K457 WeakPolarHBondContact CA-O 3.16Å; W356-L458 HydrophobicContact CD2-CD1 4.11Å; W356-L458 HydrophobicContact CE3-CB 4.05Å; W356-L458 HydrophobicContact CE3-CD1 4.42Å; W356-L458 HydrophobicContact CH2-CB 4.19Å; W356-L458 HydrophobicContact CH2-CD1 4.43Å; W356-L458 HydrophobicContact CZ2-CD1 4.08Å; W356-L458 HydrophobicContact CZ3-CB 3.85Å; W356-I476 HydrophobicContact CH2-CB 4.29Å; W356-I476 HydrophobicContact CH2-CG1 3.77Å; W356-I476 HydrophobicContact CZ3-CB 4.14Å; W356-I476 HydrophobicContact CZ3-CG1 3.74Å
357	L	76.4	Confident	63	Low	35 Å²	35	63 Å²	63	18%	0.183	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	114.6	160.4	-69.7	-179.6	0	0	0	108.8	F421 I422 K457 I459	L357-F421 HydrophobicContact CB-CB 4.15Å; L357-F421 HydrophobicContact CB-CD1 4.08Å; L357-F421 HydrophobicContact CB-CG 4.41Å; L357-F421 HydrophobicContact CD2-CB 4.05Å; L357-I422 WeakPolarHBondContact CA-O 3.32Å; L357-K457 HydrophobicContact CB-CB 4Å; L357-K457 PolarHBondContact N-O 2.94Å; L357-K457 PolarHBondContact O-N 2.94Å; L357-I459 HydrophobicContact CD1-CD1 3.74Å; L357-I459 HydrophobicContact CG-CD1 3.9Å
358	I	75.9	Confident	61	Low	5 Å²	5	63 Å²	63	3%	0.026	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	145.7	-174.6	-51.8	-177.5	0	0	0	109.6	W356 F421 I422 E424 Y453 A456	W356-I358 HydrophobicContact CB-CD1 4.38Å; W356-I358 HydrophobicContact CB-CG1 4.12Å; I358-F421 WeakPolarHBondContact O-CA 3.41Å; I358-I422 PolarHBondContact N-O 3.19Å; I358-I422 PolarHBondContact O-N 2.72Å; I358-E424 WeakPolarHBondContact CD1-OE2 3.39Å; I358-Y453 HydrophobicContact CD1-CE1 4.47Å; I358-A456 HydrophobicContact CG1-CB 4.21Å
359	R	64	Low	59.1	Low	69 Å²	69	69.3 Å²	69.3	26%	0.26	37%	0.365	S	S	.	.			trans	-87.6	135.6	176.8	-81.3	-179.1	-85	174.3	-4.9	111	S361 F421 A455 E561	R359-S361 VanDerWaalsContact C-N 3.26Å; R359-S361 PolarHBondContact O-N 2.93Å; R359-F421 HydrophobicContact CG-CD1 4Å; R359-F421 HydrophobicContact CG-CE1 3.59Å; R359-F421 HydrophobicContact CG-CZ 4.23Å; R359-A455 PolarHBondContact NH2-O 3.04Å; R359-E561 IonicContact CZ-OE1 3.47Å; R359-E561 IonicContact NH1-OE1 2.88Å; R359-E561 PolarHBondContact NH1-OE1 3.16Å; R359-E561 IonicContact NH2-OE1 3.36Å; R359-E561 PolarHBondContact NH2-OE1 2.95Å; R359-E561 IonicContact NH2-OE2 3.95Å
360	P	51.6	Low	57.1	Low	70 Å²	70	72.4 Å²	72.4	46%	0.455	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-60.4	-29.9	-177.8	-26.6	34.3	0	0	0	114.8	Q362 V363 D420 I422	P360-Q362 PolarHBondContact O-N 3.35Å; P360-V363 PolarHBondContact O-N 2.88Å; P360-D420 WeakPolarHBondContact CD-O 3.16Å; P360-D420 VanDerWaalsContact CG-O 3.22Å; P360-D420 WeakPolarHBondContact CG-O 3.29Å; P360-I422 HydrophobicContact CG-CD1 4.39Å; P360-I422 HydrophobicContact CG-CG1 4.36Å
361	S	49	Very low	55.2	Low	88 Å²	88	78.3 Å²	78.3	62%	0.615	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-72.2	17.1	-174.3	65.7	0	0	0	0	115.3	R359	R359-S361 VanDerWaalsContact C-N 3.26Å; R359-S361 PolarHBondContact O-N 2.93Å
362	Q	51.8	Low	52.9	Low	51 Å²	51	83.6 Å²	83.6	24%	0.238	44%	0.439	C	S	.	.	G	3₁₀ helix	trans	-123.6	4.3	-175.4	-58.3	-176.4	-75.2	0	0	112.7	P360 H454	P360-Q362 PolarHBondContact O-N 3.35Å; Q362-H454 PolarHBondContact NE2-O 2.88Å; Q362-H454 PolarHBondContact OE1-O 3.04Å
363	V	47	Very low	50.4	Low	70 Å²	70	86.1 Å²	86.1	42%	0.424	47%	0.465	S	S	.	.			trans	-119.5	65.2	-178.4	-147.3	0	0	0	0	109.8	P360 D365 I368	P360-V363 PolarHBondContact O-N 2.88Å; V363-D365 VanDerWaalsContact C-N 3.27Å; V363-D365 PolarHBondContact O-N 3.39Å; V363-I368 HydrophobicContact CB-CD1 4.03Å; V363-I368 HydrophobicContact CG1-CD1 3.26Å
364	D	37.8	Very low	47.7	Very low	171 Å²	171	92.1 Å²	92.1	91%	0.914	50%	0.497	S	S	*	.			trans	-80.7	71.9	-178.4	-159.5	22.7	0	0	0	110.1
365	D	37.9	Very low	44.9	Very low	112 Å²	112	95.3 Å²	95.3	60%	0.599	53%	0.532	S	S	*	.			trans	-144.7	126.5	179.9	-150.2	-16.9	0	0	0	110.8	V363 D367	V363-D365 VanDerWaalsContact C-N 3.27Å; V363-D365 PolarHBondContact O-N 3.39Å; D365-D367 PolarHBondContact O-N 2.93Å
366	N	32.2	Very low	42.3	Very low	171 Å²	171	95.1 Å²	95.1	91%	0.914	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-2.4	-165.9	-84.7	-56.6	0	0	0	114.7
367	D	34.2	Very low	39.9	Very low	112 Å²	112	107.8 Å²	107.8	60%	0.599	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-1.3	178.6	-100.5	-53.9	0	0	0	114.5	D365 Q369 K370	D365-D367 PolarHBondContact O-N 2.93Å; D367-Q369 PolarHBondContact O-N 3.04Å; D367-K370 PolarHBondContact O-N 2.8Å
368	I	31.3	Very low	37.4	Very low	80 Å²	80	108.4 Å²	108.4	41%	0.41	61%	0.611	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.8	53.8	-178.7	-48.1	-172.1	0	0	0	112.3	V363 I371	V363-I368 HydrophobicContact CB-CD1 4.03Å; V363-I368 HydrophobicContact CG1-CD1 3.26Å; I368-I371 HydrophobicContact CD1-CD1 3.97Å; I368-I371 HydrophobicContact CG1-CD1 4Å; I368-I371 HydrophobicContact CG1-CG1 4.49Å; I368-I371 HydrophobicContact CG2-CB 4.42Å; I368-I371 HydrophobicContact CG2-CD1 4.12Å; I368-I371 HydrophobicContact CG2-CG1 4.14Å
369	Q	29.5	Very low	35.1	Very low	192 Å²	192	110.3 Å²	110.3	90%	0.897	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.2	5.3	145.3	-66.8	-167.1	-6.7	0	0	112.1	D367	D367-Q369 PolarHBondContact O-N 3.04Å
370	K	30.1	Very low	33.5	Very low	164 Å²	164	109.1 Å²	109.1	71%	0.713	64%	0.636	S	S	*	*			trans	-114.9	12.1	-178.4	-74.2	176.4	-178.8	161.2	0	116	D367 S372	D367-K370 PolarHBondContact O-N 2.8Å; K370-S372 PolarHBondContact O-N 3.47Å
371	I	31	Very low	32.9	Very low	131 Å²	131	115 Å²	115	67%	0.672	65%	0.65	S	S	*	*			trans	-98	57	172.8	-43.9	-174.5	0	0	0	111.3	I368	I368-I371 HydrophobicContact CD1-CD1 3.97Å; I368-I371 HydrophobicContact CG1-CD1 4Å; I368-I371 HydrophobicContact CG1-CG1 4.49Å; I368-I371 HydrophobicContact CG2-CB 4.42Å; I368-I371 HydrophobicContact CG2-CD1 4.12Å; I368-I371 HydrophobicContact CG2-CG1 4.14Å
372	S	24.8	Very low	32.3	Very low	119 Å²	119	114.3 Å²	114.3	83%	0.832	64%	0.639	S	S	*	*			trans	-94.4	22.8	154.4	50.4	0	0	0	0	111.1	K370 I374	K370-S372 PolarHBondContact O-N 3.47Å; S372-I374 PolarHBondContact O-N 2.73Å
373	G	24	Very low	31.7	Very low	52 Å²	52	116.1 Å²	116.1	54%	0.536	66%	0.657	S	S	.	*			trans	-90	94.6	-169	0	0	0	0	0	114.7	G375	G373-G375 VanDerWaalsContact C-N 3.35Å; G373-G375 PolarHBondContact O-N 2.83Å
374	I	26.2	Very low	31.3	Very low	172 Å²	172	117.1 Å²	117.1	88%	0.882	66%	0.66	S	S	*	*			trans	41.8	50.4	142.4	-38.1	-176.3	0	0	0	115.6	S372 G376	S372-I374 PolarHBondContact O-N 2.73Å; I374-G376 PolarHBondContact O-N 3.05Å
375	G	25	Very low	31.6	Very low	74 Å²	74	112.1 Å²	112.1	76%	0.763	63%	0.629	S	S	*	*			trans	-72.7	104.4	168.3	0	0	0	0	0	110.9	G373	G373-G375 VanDerWaalsContact C-N 3.35Å; G373-G375 PolarHBondContact O-N 2.83Å
376	G	27.3	Very low	32	Very low	55 Å²	55	112.2 Å²	112.2	57%	0.567	63%	0.634	S	S	*	*			trans	-5.3	119.3	179.8	0	0	0	0	0	119.7	I374 G378	I374-G376 PolarHBondContact O-N 3.05Å; G376-G378 PolarHBondContact O-N 2.79Å
377	R	30.4	Very low	32.8	Very low	271 Å²	271	104.3 Å²	104.3	100%	1.023	59%	0.592	S	S	*	*	S	Bend	trans	-69.1	64.2	157.8	-68.4	-178.5	176.1	175.6	-1.7	110.2
378	G	24.2	Very low	33.7	Very low	47 Å²	47	99.5 Å²	99.5	49%	0.485	57%	0.566	S	S	.	*			trans	-130.6	23.1	-159.4	0	0	0	0	0	115.4	G376	G376-G378 PolarHBondContact O-N 2.79Å
379	G	28.6	Very low	34.8	Very low	45 Å²	45	96.1 Å²	96.1	46%	0.464	55%	0.549	S	S	.	.	S	Bend	trans	-152.4	118.2	173.5	0	0	0	0	0	109.7	R381	G379-R381 PolarHBondContact O-N 3.21Å
380	A	30.3	Very low	35.7	Very low	44 Å²	44	87.2 Å²	87.2	36%	0.364	51%	0.508	S	S	.	.			trans	-71.3	108.8	178.4	0	0	0	0	0	109.4	D384 Y385	A380-D384 WeakPolarHBondContact CA-OD2 3.3Å; A380-D384 HydrophobicContact CB-CB 4.13Å; A380-Y385 HydrophobicContact CB-CE2 3.78Å
381	R	37.5	Very low	36.6	Very low	193 Å²	193	85.9 Å²	85.9	73%	0.728	50%	0.499	S	S	*	.			trans	-62	166.1	171.8	-79.1	-179.3	167.1	-172.6	-3.5	110.2	G379 S383 D384 Y385	G379-R381 PolarHBondContact O-N 3.21Å; R381-S383 WeakPolarHBondContact CB-OG 3.25Å; R381-S383 PolarHBondContact O-N 2.86Å; R381-S383 VanDerWaalsContact O-N 3.1Å; R381-D384 PolarHBondContact N-OD2 2.86Å; R381-D384 WeakPolarHBondContact O-CB 3.25Å; R381-D384 PolarHBondContact O-N 3.17Å; R381-Y385 WeakPolarHBondContact O-CD2 3.02Å
382	L	37.9	Very low	37.7	Very low	74 Å²	74	81.5 Å²	81.5	39%	0.387	48%	0.477	S	S	.	.	G	3₁₀ helix	trans	-57.8	-23.9	171.1	-132.9	77.7	0	0	0	113	D384	L382-D384 VanDerWaalsContact C-N 3.29Å
383	S	38.1	Very low	38.9	Very low	89 Å²	89	80.5 Å²	80.5	62%	0.622	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-70.1	-19.5	172.3	50	0	0	0	0	114.8	R381	R381-S383 WeakPolarHBondContact CB-OG 3.25Å; R381-S383 PolarHBondContact O-N 2.86Å; R381-S383 VanDerWaalsContact O-N 3.1Å
384	D	39.7	Very low	39.8	Very low	92 Å²	92	81 Å²	81	49%	0.492	45%	0.451	S	S	.	.	G	3₁₀ helix	trans	-97.6	-2.2	-167.2	-50.7	-9.2	0	0	0	111.3	A380 R381 L382	A380-D384 WeakPolarHBondContact CA-OD2 3.3Å; A380-D384 HydrophobicContact CB-CB 4.13Å; R381-D384 PolarHBondContact N-OD2 2.86Å; R381-D384 WeakPolarHBondContact O-CB 3.25Å; R381-D384 PolarHBondContact O-N 3.17Å; L382-D384 VanDerWaalsContact C-N 3.29Å
385	Y	42.7	Very low	40.6	Very low	65 Å²	65	76.4 Å²	76.4	26%	0.255	43%	0.427	S	S	.	.	S	Bend	trans	-97.3	122.6	172.9	-69.7	-80.4	0	0	0	110.8	A380 R381 S387 P465	A380-Y385 HydrophobicContact CB-CE2 3.78Å; R381-Y385 WeakPolarHBondContact O-CD2 3.02Å; Y385-S387 PolarHBondContact O-N 3.19Å; Y385-P465 HydrophobicContact CD1-CB 3.75Å; Y385-P465 HydrophobicContact CD1-CG 3.69Å; Y385-P465 HydrophobicContact CE1-CB 4.37Å; Y385-P465 HydrophobicContact CE1-CG 3.81Å; Y385-P465 HydrophobicContact CG-CB 4.22Å
386	T	46.1	Very low	41.3	Very low	115 Å²	115	79 Å²	79	71%	0.706	42%	0.424	S	S	*	.			trans	-75.6	17	-174.2	49.8	0	0	0	0	115.3	P188	P188-T386 WeakPolarHBondContact CG-O 3.49Å
387	S	49.1	Very low	41.9	Very low	4 Å²	4	81.3 Å²	81.3	3%	0.028	43%	0.431	C	S	.	.			trans	-80	139.7	-178.4	96.9	0	0	0	0	112.1	Y385 E389 A390 Y391 P465	Y385-S387 PolarHBondContact O-N 3.19Å; S387-E389 VanDerWaalsContact C-N 3.26Å; S387-E389 PolarHBondContact O-N 3.17Å; S387-A390 PolarHBondContact O-N 3.19Å; S387-A390 WeakPolarHBondContact OG-CB 3.23Å; S387-A390 PolarHBondContact OG-N 2.57Å; S387-A390 VanDerWaalsContact OG-N 3.09Å; S387-Y391 PolarHBondContact O-N 2.85Å; S387-Y391 VanDerWaalsContact O-N 3.07Å; S387-P465 VanDerWaalsContact CB-O 3.22Å; S387-P465 WeakPolarHBondContact CB-O 3.47Å; S387-P465 PolarHBondContact OG-O 3.47Å
388	V	53.4	Low	42	Very low	11 Å²	11	72.2 Å²	72.2	7%	0.067	41%	0.409	C	S	.	.	H	α-helix	trans	-63.8	-33.1	179.2	-178.9	0	0	0	0	111.2	Y182 V185 L187 Y391 L392	Y182-V388 HydrophobicContact CD1-CB 4.31Å; Y182-V388 HydrophobicContact CD1-CG1 3.93Å; Y182-V388 HydrophobicContact CE1-CG1 4.48Å; V185-V388 HydrophobicContact CB-CG1 3.89Å; V185-V388 HydrophobicContact CG1-CG1 4.01Å; V185-V388 HydrophobicContact CG1-CG2 3.98Å; V185-V388 HydrophobicContact CG2-CG1 4.23Å; L187-V388 HydrophobicContact CD2-CG2 4.14Å; V388-Y391 PolarHBondContact O-N 2.84Å; V388-L392 HydrophobicContact CG1-CD1 3.89Å; V388-L392 HydrophobicContact CG1-CG 4.31Å; V388-L392 WeakPolarHBondContact O-CB 3.34Å; V388-L392 WeakPolarHBondContact O-CD1 3.43Å; V388-L392 VanDerWaalsContact O-CG 3.24Å; V388-L392 WeakPolarHBondContact O-CG 3.14Å; V388-L392 PolarHBondContact O-N 3.24Å
389	E	55.8	Low	42.3	Very low	10 Å²	10	76.3 Å²	76.3	5%	0.047	42%	0.42	C	S	.	.	H	α-helix	trans	-69.6	-34.4	176.4	-62.8	-167.6	152	0	0	112.9	Y182 S195 K275 S387 R393 V466	Y182-E389 HydrophobicContact CE1-CG 4.36Å; S195-E389 WeakPolarHBondContact CB-OE2 3.46Å; S195-E389 PolarHBondContact N-OE2 2.98Å; S195-E389 PolarHBondContact OG-OE2 2.77Å; K275-E389 WeakPolarHBondContact CE-OE1 3.45Å; K275-E389 IonicContact NZ-OE1 2.71Å; K275-E389 PolarHBondContact NZ-OE1 3.39Å; K275-E389 IonicContact NZ-OE2 3.27Å; S387-E389 VanDerWaalsContact C-N 3.26Å; S387-E389 PolarHBondContact O-N 3.17Å; E389-R393 WeakPolarHBondContact O-CB 3.41Å; E389-R393 WeakPolarHBondContact O-CG 3.28Å; E389-R393 PolarHBondContact O-N 2.88Å; E389-V466 HydrophobicContact CB-CG1 4.4Å
390	A	47.5	Very low	42.2	Very low	4 Å²	4	78.4 Å²	78.4	3%	0.033	44%	0.441	C	S	.	.	H	α-helix	trans	-69.4	-40.8	172.9	0	0	0	0	0	111.9	S387 R393 S394 P465	S387-A390 PolarHBondContact O-N 3.19Å; S387-A390 WeakPolarHBondContact OG-CB 3.23Å; S387-A390 PolarHBondContact OG-N 2.57Å; S387-A390 VanDerWaalsContact OG-N 3.09Å; A390-R393 PolarHBondContact O-N 3.28Å; A390-S394 PolarHBondContact O-N 2.85Å; A390-P465 WeakPolarHBondContact CB-O 3.38Å
391	Y	50	Low	41.9	Very low	136 Å²	136	80 Å²	80	53%	0.533	46%	0.462	S	S	.	.	H	α-helix	trans	-59.8	-49.6	174.4	-179.6	-106.7	0	0	0	111.8	S387 V388 R393 S394 L395	S387-Y391 PolarHBondContact O-N 2.85Å; S387-Y391 VanDerWaalsContact O-N 3.07Å; V388-Y391 PolarHBondContact O-N 2.84Å; Y391-R393 PolarHBondContact O-N 3.32Å; Y391-S394 WeakPolarHBondContact O-CB 3.47Å; Y391-S394 PolarHBondContact O-N 2.85Å; Y391-S394 VanDerWaalsContact O-N 3.11Å; Y391-S394 PolarHBondContact O-OG 2.9Å; Y391-L395 HydrophobicContact CD1-CD1 4.07Å; Y391-L395 HydrophobicContact CE1-CD1 3.62Å; Y391-L395 PolarHBondContact O-N 2.82Å
392	L	52.7	Low	41.2	Very low	40 Å²	40	74.3 Å²	74.3	21%	0.209	46%	0.464	C	S	.	.	H	α-helix	trans	-60.5	-42.6	177.3	-70.3	166.1	0	0	0	112.4	V388 S394 L395 D396	V388-L392 HydrophobicContact CG1-CD1 3.89Å; V388-L392 HydrophobicContact CG1-CG 4.31Å; V388-L392 WeakPolarHBondContact O-CB 3.34Å; V388-L392 WeakPolarHBondContact O-CD1 3.43Å; V388-L392 VanDerWaalsContact O-CG 3.24Å; V388-L392 WeakPolarHBondContact O-CG 3.14Å; V388-L392 PolarHBondContact O-N 3.24Å; L392-S394 VanDerWaalsContact C-N 3.25Å; L392-S394 PolarHBondContact O-N 3.49Å; L392-L395 WeakPolarHBondContact O-CB 3.47Å; L392-L395 PolarHBondContact O-N 2.81Å; L392-L395 VanDerWaalsContact O-N 3.14Å; L392-D396 PolarHBondContact O-N 2.82Å
393	R	50.4	Low	40.6	Very low	98 Å²	98	76.1 Å²	76.1	37%	0.37	48%	0.482	S	S	.	.	H	α-helix	trans	-65.4	-25.7	175.5	-74.9	179.1	-179.3	-175.7	2.7	113.6	D198 E389 A390 Y391 V466 G467	D198-R393 IonicContact OD1-CZ 3.32Å; D198-R393 IonicContact OD1-NH2 3.17Å; D198-R393 PolarHBondContact OD1-NH2 3.07Å; E389-R393 WeakPolarHBondContact O-CB 3.41Å; E389-R393 WeakPolarHBondContact O-CG 3.28Å; E389-R393 PolarHBondContact O-N 2.88Å; A390-R393 PolarHBondContact O-N 3.28Å; Y391-R393 PolarHBondContact O-N 3.32Å; R393-V466 PolarHBondContact NH1-O 2.8Å; R393-G467 PolarHBondContact NH1-O 3.3Å
394	S	44	Very low	40.1	Very low	63 Å²	63	77.9 Å²	77.9	44%	0.441	49%	0.492	S	S	.	.	H	α-helix	trans	-70.5	-37.7	172.6	79.5	0	0	0	0	112	A390 Y391 L392 S397	A390-S394 PolarHBondContact O-N 2.85Å; Y391-S394 WeakPolarHBondContact O-CB 3.47Å; Y391-S394 PolarHBondContact O-N 2.85Å; Y391-S394 VanDerWaalsContact O-N 3.11Å; Y391-S394 PolarHBondContact O-OG 2.9Å; L392-S394 VanDerWaalsContact C-N 3.25Å; L392-S394 PolarHBondContact O-N 3.49Å; S394-S397 PolarHBondContact O-N 2.93Å; S394-S397 PolarHBondContact O-OG 2.84Å
395	L	42.1	Very low	39.5	Very low	74 Å²	74	78.9 Å²	78.9	39%	0.387	51%	0.506	S	S	.	.	H	α-helix	trans	-65.6	-43.7	176.4	-77.8	156.5	0	0	0	112.1	Y391 L392 S397 S398	Y391-L395 HydrophobicContact CD1-CD1 4.07Å; Y391-L395 HydrophobicContact CE1-CD1 3.62Å; Y391-L395 PolarHBondContact O-N 2.82Å; L392-L395 WeakPolarHBondContact O-CB 3.47Å; L392-L395 PolarHBondContact O-N 2.81Å; L392-L395 VanDerWaalsContact O-N 3.14Å; L395-S397 PolarHBondContact O-N 2.88Å; L395-S398 PolarHBondContact O-N 2.8Å; L395-S398 PolarHBondContact O-OG 2.94Å
396	D	40.5	Very low	38.7	Very low	129 Å²	129	83.9 Å²	83.9	69%	0.69	53%	0.532	S	S	*	.	H	α-helix	trans	-56.9	-33.2	175.6	-81.2	-23.9	0	0	0	112.6	L392 S398	L392-D396 PolarHBondContact O-N 2.82Å; D396-S398 PolarHBondContact O-N 3.32Å
397	S	38.3	Very low	37.8	Very low	103 Å²	103	88.8 Å²	88.8	72%	0.72	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-12.5	177.3	79.5	0	0	0	0	114.7	S394 L395	S394-S397 PolarHBondContact O-N 2.93Å; S394-S397 PolarHBondContact O-OG 2.84Å; L395-S397 PolarHBondContact O-N 2.88Å
398	S	33.8	Very low	36.8	Very low	80 Å²	80	94.9 Å²	94.9	56%	0.559	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99	-14.8	-177.9	69	0	0	0	0	115	L395 D396	L395-S398 PolarHBondContact O-N 2.8Å; L395-S398 PolarHBondContact O-OG 2.94Å; D396-S398 PolarHBondContact O-N 3.32Å
399	N	30	Very low	35.4	Very low	133 Å²	133	101.6 Å²	101.6	71%	0.711	61%	0.609	S	S	*	*			trans	-104.7	54.9	-175	-84	-43.5	0	0	0	113.9	G401	N399-G401 VanDerWaalsContact C-N 3.29Å; N399-G401 PolarHBondContact O-N 2.9Å
400	G	26.3	Very low	33.9	Very low	89 Å²	89	107.3 Å²	107.3	92%	0.918	65%	0.645	S	S	*	*			trans	-76.6	57.1	177.7	0	0	0	0	0	115.4
401	G	23.9	Very low	32.9	Very low	77 Å²	77	112.7 Å²	112.7	79%	0.794	68%	0.679	S	S	*	*			trans	-159.7	72.4	-175.1	0	0	0	0	0	116.5	N399	N399-G401 VanDerWaalsContact C-N 3.29Å; N399-G401 PolarHBondContact O-N 2.9Å
402	G	24	Very low	31.6	Very low	75 Å²	75	115.1 Å²	115.1	77%	0.773	70%	0.696	S	S	*	*	S	Bend	trans	-175.5	64.8	-179	0	0	0	0	0	117.7
403	S	24.3	Very low	30.3	Very low	111 Å²	111	121.7 Å²	121.7	78%	0.776	73%	0.73	S	S	*	*			trans	28.7	89.6	157.9	-177	0	0	0	0	120.2
404	P	28.3	Very low	28.9	Very low	127 Å²	127	122.7 Å²	122.7	83%	0.825	75%	0.752	S	S	*	*			trans	-87.4	123.7	163.3	32.9	-30.7	0	0	0	112.3	Q406	P404-Q406 PolarHBondContact O-N 2.86Å
405	S	25.6	Very low	27.9	Very low	112 Å²	112	128.8 Å²	128.8	78%	0.783	77%	0.774	S	S	*	*			trans	-78.2	117.4	-179.8	-68.6	0	0	0	0	113.3
406	Q	26.8	Very low	27.2	Very low	171 Å²	171	133.4 Å²	133.4	80%	0.799	80%	0.798	S	S	*	*			trans	51.8	99.1	158.9	-63.4	-172.9	-4.9	0	0	119.4	P404	P404-Q406 PolarHBondContact O-N 2.86Å
407	K	27.7	Very low	26.6	Very low	217 Å²	217	136.1 Å²	136.1	94%	0.943	81%	0.806	S	S	*	*			trans	-139.9	154.2	130.9	-114.4	170.6	-175.1	172	0	110.1
408	I	27.9	Very low	26.2	Very low	132 Å²	132	140.9 Å²	140.9	68%	0.677	82%	0.817	S	S	*	*			trans	-128.3	129.3	-149.8	-71.9	177.1	0	0	0	112
409	L	24.3	Very low	26.3	Very low	152 Å²	152	139.2 Å²	139.2	80%	0.796	81%	0.812	S	S	*	*			trans	61.9	153.2	176.1	-88.5	74.6	0	0	0	115.8
410	T	23.7	Very low	27.3	Very low	131 Å²	131	139.6 Å²	139.6	80%	0.804	82%	0.815	S	S	*	*			cis	-124.7	148.2	15.7	48.6	0	0	0	0	114.2
411	P	25.8	Very low	28.4	Very low	116 Å²	116	140.1 Å²	140.1	75%	0.753	79%	0.792	S	S	*	*			trans	-108.3	115.5	178.5	36.2	-26.2	0	0	0	114
412	E	22.7	Very low	30	Very low	188 Å²	188	140.6 Å²	140.6	88%	0.879	78%	0.775	S	S	*	*			trans	-159.1	72.4	164.6	-154.7	166.3	-129.3	0	0	114.3
413	L	25.5	Very low	31.8	Very low	178 Å²	178	140 Å²	140	93%	0.932	76%	0.759	S	S	*	*			trans	-167.1	95.5	148.5	-136.8	76.3	0	0	0	111.3
414	S	21.6	Very low	33.8	Very low	119 Å²	119	138.1 Å²	138.1	83%	0.832	74%	0.738	S	S	*	*			trans	-150.2	37.2	-179.2	55.7	0	0	0	0	114.5
415	Q	23.7	Very low	35.7	Very low	191 Å²	191	137.1 Å²	137.1	89%	0.893	73%	0.726	S	S	*	*			trans	-138.2	96.2	167.1	-71.7	-166.4	-4.2	0	0	111.8
416	L	25.9	Very low	37.8	Very low	171 Å²	171	132.4 Å²	132.4	90%	0.895	69%	0.693	S	S	*	*			trans	-159	128.2	156.1	-117.1	164.9	0	0	0	108.1	Q418	L416-Q418 PolarHBondContact O-N 3.45Å
417	Q	28.1	Very low	39.6	Very low	186 Å²	186	129.7 Å²	129.7	87%	0.869	68%	0.68	S	S	*	*			trans	-71	130.4	-176.1	-66.5	166.6	-79.6	0	0	110.4	G419	Q417-G419 VanDerWaalsContact C-N 3.3Å; Q417-G419 PolarHBondContact O-N 3.42Å
418	Q	30.4	Very low	40.8	Very low	202 Å²	202	122.9 Å²	122.9	94%	0.944	66%	0.657	S	S	*	*			trans	-75.4	86.1	165.2	-71.5	174.8	-61.7	0	0	108.8	L416	L416-Q418 PolarHBondContact O-N 3.45Å
419	G	35.9	Very low	42.7	Very low	45 Å²	45	124.2 Å²	124.2	46%	0.464	67%	0.665	S	S	.	*			trans	-85.2	149	155.2	0	0	0	0	0	109.5	Q417 F421	Q417-G419 VanDerWaalsContact C-N 3.3Å; Q417-G419 PolarHBondContact O-N 3.42Å; G419-F421 VanDerWaalsContact O-CD2 3.23Å; G419-F421 WeakPolarHBondContact O-CD2 3.47Å; G419-F421 PolarHBondContact O-N 2.93Å; G419-F421 VanDerWaalsContact O-N 3.09Å
420	D	50.7	Low	45	Very low	142 Å²	142	120.6 Å²	120.6	76%	0.759	64%	0.644	S	S	*	*			trans	-64.2	109.6	-172.8	-59.6	-67	0	0	0	112.4	P360	P360-D420 WeakPolarHBondContact CD-O 3.16Å; P360-D420 VanDerWaalsContact CG-O 3.22Å; P360-D420 WeakPolarHBondContact CG-O 3.29Å
421	F	49.8	Very low	47.6	Very low	99 Å²	99	116.4 Å²	116.4	43%	0.434	61%	0.614	S	S	.	*	P	Polyproline II helix	trans	-91.1	127.1	168.5	-74.6	-93.7	0	0	0	109.6	L357 I358 R359 G419 S423	L357-F421 HydrophobicContact CB-CB 4.15Å; L357-F421 HydrophobicContact CB-CD1 4.08Å; L357-F421 HydrophobicContact CB-CG 4.41Å; L357-F421 HydrophobicContact CD2-CB 4.05Å; I358-F421 WeakPolarHBondContact O-CA 3.41Å; R359-F421 HydrophobicContact CG-CD1 4Å; R359-F421 HydrophobicContact CG-CE1 3.59Å; R359-F421 HydrophobicContact CG-CZ 4.23Å; G419-F421 VanDerWaalsContact O-CD2 3.23Å; G419-F421 WeakPolarHBondContact O-CD2 3.47Å; G419-F421 PolarHBondContact O-N 2.93Å; G419-F421 VanDerWaalsContact O-N 3.09Å; F421-S423 PolarHBondContact O-N 3.44Å
422	I	58.1	Low	50	Low	88 Å²	88	114.6 Å²	114.6	45%	0.451	60%	0.601	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-73.9	122.8	174.5	-59.1	174.6	0	0	0	108.4	L357 I358 P360	L357-I422 WeakPolarHBondContact CA-O 3.32Å; I358-I422 PolarHBondContact N-O 3.19Å; I358-I422 PolarHBondContact O-N 2.72Å; P360-I422 HydrophobicContact CG-CD1 4.39Å; P360-I422 HydrophobicContact CG-CG1 4.36Å
423	S	60.4	Low	52.6	Low	63 Å²	63	109.4 Å²	109.4	44%	0.441	58%	0.579	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.9	116.6	175.7	-176.5	0	0	0	0	110.3	R355 W356 F421	R355-S423 WeakPolarHBondContact CD-OG 3.49Å; R355-S423 PolarHBondContact NH1-OG 2.81Å; W356-S423 WeakPolarHBondContact O-CA 3.16Å; F421-S423 PolarHBondContact O-N 3.44Å
424	E	67.8	Low	55.1	Low	71 Å²	71	103.9 Å²	103.9	33%	0.332	55%	0.552	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-122.4	111.5	179.2	-173.3	177.6	-177.4	0	0	109.4	W356 I358 K452	W356-E424 HydrophobicContact CB-CB 4.29Å; W356-E424 WeakPolarHBondContact CB-O 3.45Å; W356-E424 PolarHBondContact N-O 3.02Å; W356-E424 PolarHBondContact O-N 3.04Å; W356-E424 VanDerWaalsContact O-N 3.08Å; I358-E424 WeakPolarHBondContact CD1-OE2 3.39Å; E424-K452 IonicContact OE1-NZ 2.84Å; E424-K452 PolarHBondContact OE1-NZ 2.95Å; E424-K452 IonicContact OE2-NZ 3.16Å; E424-K452 PolarHBondContact OE2-NZ 3.37Å
425	D	66.6	Low	57.7	Low	105 Å²	105	103.8 Å²	103.8	56%	0.561	54%	0.537	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.1	137.8	178.9	-66.9	-31.3	0	0	0	110.6	R355 Q427	R355-D425 WeakPolarHBondContact CD-OD1 3.47Å; R355-D425 VanDerWaalsContact CG-OD1 3.25Å; R355-D425 WeakPolarHBondContact CG-OD1 3.36Å; D425-Q427 PolarHBondContact O-N 3.34Å
426	V	71.6	Confident	60.4	Low	14 Å²	14	100.6 Å²	100.6	9%	0.085	52%	0.522	C	S	.	.	P	Polyproline II helix	trans	-73.7	124.5	-177.3	-179.6	0	0	0	0	110	W354 H430 Y431 L444	W354-V426 HydrophobicContact CB-CB 3.95Å; W354-V426 HydrophobicContact CB-CG2 3.69Å; W354-V426 WeakPolarHBondContact O-CB 3.48Å; W354-V426 WeakPolarHBondContact O-CG2 3.49Å; W354-V426 PolarHBondContact O-N 2.83Å; V426-H430 HydrophobicContact CG1-CB 3.9Å; V426-Y431 HydrophobicContact CB-CD1 4.43Å; V426-Y431 HydrophobicContact CG1-CD1 4.04Å; V426-Y431 WeakPolarHBondContact O-CE1 3.37Å; V426-L444 HydrophobicContact CG1-CD1 3.76Å
427	Q	63.5	Low	62.9	Low	114 Å²	114	101.2 Å²	101.2	53%	0.533	52%	0.518	S	S	.	.	P	Polyproline II helix	trans	-61.4	140.1	179.6	-69	-170.1	-6.7	0	0	112.3	D425 L429 H430	D425-Q427 PolarHBondContact O-N 3.34Å; Q427-L429 PolarHBondContact O-N 2.8Å; Q427-H430 PolarHBondContact O-N 2.78Å
428	P	53.3	Low	65.4	Low	73 Å²	73	98 Å²	98	47%	0.474	51%	0.507	S	S	.	.	G	3₁₀ helix	trans	-53.4	-28.9	-176.3	-30.8	36.4	0	0	0	116.7	H430 Y431	P428-H430 PolarHBondContact O-N 2.89Å; P428-Y431 PolarHBondContact O-N 2.89Å; P428-Y431 VanDerWaalsContact O-O 3.13Å
429	L	68	Low	67.9	Low	161 Å²	161	92.2 Å²	92.2	84%	0.843	48%	0.479	S	S	*	.	G	3₁₀ helix	trans	-65.4	-21.1	178	-77.9	88.7	0	0	0	113.7	Q427	Q427-L429 PolarHBondContact O-N 2.8Å
430	H	71.8	Confident	70	Confident	76 Å²	76	90.2 Å²	90.2	35%	0.352	46%	0.458	S	S	.	.	G	3₁₀ helix	trans	-87.5	-6.5	-178.4	-64.5	99.1	0	0	0	113.4	V426 Q427 P428 L444 I445	V426-H430 HydrophobicContact CG1-CB 3.9Å; Q427-H430 PolarHBondContact O-N 2.78Å; P428-H430 PolarHBondContact O-N 2.89Å; H430-L444 HydrophobicContact CB-CD1 3.84Å; H430-L444 WeakPolarHBondContact O-CA 3.42Å; H430-L444 VanDerWaalsContact O-CD1 3.24Å; H430-L444 WeakPolarHBondContact O-CD1 3.31Å; H430-I445 CarbonylContact O-C 3.41Å; H430-I445 PolarHBondContact O-N 3.17Å; H430-I445 VanDerWaalsContact O-O 3.11Å
431	Y	78	Confident	71.7	Confident	42 Å²	42	83.9 Å²	83.9	17%	0.165	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	149.8	-175.2	75.1	-106.6	0	0	0	113.8	V426 P428 N442 T443	V426-Y431 HydrophobicContact CB-CD1 4.43Å; V426-Y431 HydrophobicContact CG1-CD1 4.04Å; V426-Y431 WeakPolarHBondContact O-CE1 3.37Å; P428-Y431 PolarHBondContact O-N 2.89Å; P428-Y431 VanDerWaalsContact O-O 3.13Å; Y431-N442 WeakPolarHBondContact CB-OD1 3.24Å; Y431-N442 WeakPolarHBondContact CD2-ND2 3.48Å; Y431-N442 WeakPolarHBondContact CD2-OD1 3.47Å; Y431-T443 CarbonylContact C-O 3.59Å; Y431-T443 WeakPolarHBondContact CA-O 3.4Å
432	T	76.8	Confident	73.5	Confident	79 Å²	79	79.2 Å²	79.2	49%	0.485	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	112.6	-178.1	42.7	0	0	0	0	109.6	N442 T443	T432-N442 WeakPolarHBondContact O-CA 3.38Å; T432-T443 PolarHBondContact N-O 3.21Å; T432-T443 PolarHBondContact O-N 2.8Å; T432-T443 PolarHBondContact OG1-O 2.89Å; T432-T443 VanDerWaalsContact OG1-O 3.08Å
433	L	76.9	Confident	74.8	Confident	79 Å²	79	75.6 Å²	75.6	41%	0.414	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	114.4	176.5	-169.7	70.3	0	0	0	109.2	L352 L440 V441 N442	L352-L433 HydrophobicContact CB-CD1 3.77Å; L433-L440 HydrophobicContact CD1-CD2 3.85Å; L433-L440 HydrophobicContact CD2-CD2 4.47Å; L433-L440 HydrophobicContact CG-CD2 4.13Å; L433-V441 WeakPolarHBondContact CA-O 3.37Å; L433-N442 HydrophobicContact CD1-CB 3.84Å
434	T	79.2	Confident	76	Confident	61 Å²	61	72.6 Å²	72.6	37%	0.374	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	155	178.6	58.4	0	0	0	0	111.1	V441	T434-V441 PolarHBondContact N-O 2.9Å; T434-V441 PolarHBondContact O-N 2.68Å
435	K	75.9	Confident	76.8	Confident	118 Å²	118	71.5 Å²	71.5	51%	0.513	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	109.7	167.7	-179.9	-177	169.4	174.7	0	108.5	L349 K437 Q439	L349-K435 HydrophobicContact CD1-CD 4.15Å; L349-K435 HydrophobicContact CD2-CB 4.19Å; L349-K435 HydrophobicContact CD2-CD 4.15Å; L349-K435 HydrophobicContact CD2-CG 4.35Å; L349-K435 HydrophobicContact CG-CD 4.42Å; K435-K437 WeakPolarHBondContact CE-O 3.23Å; K435-Q439 WeakPolarHBondContact CA-O 3.37Å
436	E	80.3	Confident	77.4	Confident	123 Å²	123	67.1 Å²	67.1	58%	0.575	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.2	108.8	173.5	-67.6	-167.5	173.7	0	0	109.5	D438 Q439 V441	E436-D438 PolarHBondContact O-N 2.61Å; E436-Q439 PolarHBondContact N-O 2.89Å; E436-Q439 PolarHBondContact O-N 2.84Å; E436-V441 HydrophobicContact CB-CG2 3.88Å; E436-V441 HydrophobicContact CG-CG2 3.86Å
437	K	78.5	Confident	77.6	Confident	185 Å²	185	73 Å²	73	80%	0.804	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	-109.1	-175.7	-56.8	172.5	-175.9	172.4	0	110.9	K435	K435-K437 WeakPolarHBondContact CE-O 3.23Å
438	D	79.7	Confident	78.3	Confident	119 Å²	119	76.5 Å²	76.5	64%	0.636	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.8	31	-178.8	-56.9	-56.5	0	0	0	112.3	P345 E436	P345-D438 WeakPolarHBondContact CD-O 3.38Å; E436-D438 PolarHBondContact O-N 2.61Å
439	Q	83.7	Confident	79.6	Confident	80 Å²	80	73 Å²	73	37%	0.374	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	141.2	175.9	-56.2	-163.8	-24.3	0	0	112	V341 S342 S343 K435 E436	V341-Q439 HydrophobicContact CG1-CB 4.46Å; S342-Q439 CarbonylContact O-C 3.5Å; S342-Q439 WeakPolarHBondContact O-CA 3.08Å; S343-Q439 PolarHBondContact OG-NE2 3.1Å; K435-Q439 WeakPolarHBondContact CA-O 3.37Å; E436-Q439 PolarHBondContact N-O 2.89Å; E436-Q439 PolarHBondContact O-N 2.84Å
440	L	80	Confident	80.3	Confident	2 Å²	2	68.2 Å²	68.2	1%	0.01	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	119.4	162.3	-102	168.6	0	0	0	107.2	P316 V341 S342 P345 L349 G350 L352 L433	P316-L440 HydrophobicContact CB-CD1 4.4Å; V341-L440 CarbonylContact C-O 3.58Å; V341-L440 WeakPolarHBondContact CA-O 3.46Å; S342-L440 PolarHBondContact N-O 3.5Å; S342-L440 PolarHBondContact O-N 2.9Å; P345-L440 HydrophobicContact CB-CB 4.11Å; P345-L440 HydrophobicContact CB-CD1 4.06Å; P345-L440 HydrophobicContact CB-CG 3.65Å; P345-L440 WeakPolarHBondContact O-CD1 3.38Å; L349-L440 HydrophobicContact CD2-CD1 4.28Å; L349-L440 HydrophobicContact CD2-CD2 3.63Å; L349-L440 HydrophobicContact CD2-CG 3.77Å; G350-L440 WeakPolarHBondContact O-CD1 3.18Å; L352-L440 HydrophobicContact CD2-CB 4.3Å; L352-L440 WeakPolarHBondContact CD2-O 3.33Å; L433-L440 HydrophobicContact CD1-CD2 3.85Å; L433-L440 HydrophobicContact CD2-CD2 4.47Å; L433-L440 HydrophobicContact CG-CD2 4.13Å
441	V	86.5	Confident	80.4	Confident	10 Å²	10	71.2 Å²	71.2	6%	0.061	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	126.7	175.9	-169.5	0	0	0	0	107.7	V339 V341 L433 T434 E436	V339-V441 HydrophobicContact CG1-CG1 3.84Å; V341-V441 HydrophobicContact CG1-CB 4.1Å; V341-V441 HydrophobicContact CG1-CG1 4.09Å; V341-V441 HydrophobicContact CG1-CG2 3.76Å; L433-V441 WeakPolarHBondContact CA-O 3.37Å; T434-V441 PolarHBondContact N-O 2.9Å; T434-V441 PolarHBondContact O-N 2.68Å; E436-V441 HydrophobicContact CB-CG2 3.88Å; E436-V441 HydrophobicContact CG-CG2 3.86Å
442	N	86.5	Confident	80.4	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	110.8	165.2	-169	-27.6	0	0	0	109.2	C340 L352 W354 Y431 T432 L433	C340-N442 PolarHBondContact N-O 3.02Å; C340-N442 PolarHBondContact O-N 2.84Å; L352-N442 HydrophobicContact CB-CB 4.22Å; L352-N442 HydrophobicContact CD2-CB 3.83Å; L352-N442 HydrophobicContact CG-CB 4Å; L352-N442 PolarHBondContact O-ND2 3.4Å; W354-N442 VanDerWaalsContact CD1-CG 3.44Å; W354-N442 VanDerWaalsContact CD1-OD1 3.31Å; W354-N442 PolarHBondContact NE1-OD1 3.48Å; Y431-N442 WeakPolarHBondContact CB-OD1 3.24Å; Y431-N442 WeakPolarHBondContact CD2-ND2 3.48Å; Y431-N442 WeakPolarHBondContact CD2-OD1 3.47Å; T432-N442 WeakPolarHBondContact O-CA 3.38Å; L433-N442 HydrophobicContact CD1-CB 3.84Å
443	T	85.6	Confident	80.6	Confident	13 Å²	13	71.1 Å²	71.1	8%	0.08	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	106.4	173.2	-63.6	0	0	0	0	109.8	R337 A338 V339 Y431 T432 I445	R337-T443 HydrophobicContact CG-CG2 4.14Å; A338-T443 CarbonylContact O-C 3.09Å; A338-T443 WeakPolarHBondContact O-CA 3.48Å; V339-T443 HydrophobicContact CG2-CG2 4.19Å; Y431-T443 CarbonylContact C-O 3.59Å; Y431-T443 WeakPolarHBondContact CA-O 3.4Å; T432-T443 PolarHBondContact N-O 3.21Å; T432-T443 PolarHBondContact O-N 2.8Å; T432-T443 PolarHBondContact OG1-O 2.89Å; T432-T443 VanDerWaalsContact OG1-O 3.08Å; T443-I445 HydrophobicContact CG2-CD1 4.12Å; T443-I445 HydrophobicContact CG2-CG1 4.05Å
444	L	86.5	Confident	80.8	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	130.2	166.2	167.5	57.9	0	0	0	109.7	L336 R337 A338 W354 V426 H430 I446 L458	L336-L444 HydrophobicContact CD2-CD2 4.08Å; L336-L444 HydrophobicContact CD2-CG 4.1Å; R337-L444 CarbonylContact C-O 3.39Å; R337-L444 WeakPolarHBondContact CA-O 3.35Å; A338-L444 HydrophobicContact CB-CB 4.31Å; A338-L444 HydrophobicContact CB-CD2 4.47Å; A338-L444 PolarHBondContact N-O 2.68Å; A338-L444 PolarHBondContact O-N 3.37Å; W354-L444 HydrophobicContact CB-CD2 4.39Å; W354-L444 HydrophobicContact CD2-CB 4.11Å; W354-L444 HydrophobicContact CD2-CD2 4.03Å; W354-L444 HydrophobicContact CE3-CD2 4.3Å; W354-L444 HydrophobicContact CG-CB 4.16Å; W354-L444 HydrophobicContact CG-CD2 4.11Å; W354-L444 HydrophobicContact CZ2-CB 4.09Å; V426-L444 HydrophobicContact CG1-CD1 3.76Å; H430-L444 HydrophobicContact CB-CD1 3.84Å; H430-L444 WeakPolarHBondContact O-CA 3.42Å; H430-L444 VanDerWaalsContact O-CD1 3.24Å; H430-L444 WeakPolarHBondContact O-CD1 3.31Å; L444-I446 HydrophobicContact CD1-CD1 4.32Å; L444-I446 HydrophobicContact CD1-CG1 3.73Å; L444-I446 HydrophobicContact CG-CG1 4.33Å; L444-L458 HydrophobicContact CD2-CD1 3.77Å; L444-L458 HydrophobicContact CD2-CD2 3.84Å; L444-L458 HydrophobicContact CD2-CG 4.44Å
445	I	83.8	Confident	80.9	Confident	47 Å²	47	64.8 Å²	64.8	24%	0.241	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	113.2	169.6	-70.5	167	0	0	0	108.5	Q335 L336 R337 H430 T443	Q335-I445 HydrophobicContact CG-CG2 4.09Å; Q335-I445 VanDerWaalsContact NE2-CG2 3.27Å; L336-I445 WeakPolarHBondContact O-CA 3.38Å; R337-I445 HydrophobicContact CB-CG1 4.35Å; R337-I445 HydrophobicContact CG-CG1 3.95Å; H430-I445 CarbonylContact O-C 3.41Å; H430-I445 PolarHBondContact O-N 3.17Å; H430-I445 VanDerWaalsContact O-O 3.11Å; T443-I445 HydrophobicContact CG2-CD1 4.12Å; T443-I445 HydrophobicContact CG2-CG1 4.05Å
446	I	80.4	Confident	81.2	Confident	13 Å²	13	59.2 Å²	59.2	7%	0.067	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	110.4	163.8	-57.9	-177	0	0	0	106.5	Q335 L336 W356 L444 R448 V449	Q335-I446 WeakPolarHBondContact CA-O 3.45Å; L336-I446 HydrophobicContact CB-CB 4.42Å; L336-I446 PolarHBondContact N-O 3.37Å; L336-I446 PolarHBondContact O-N 3.23Å; W356-I446 HydrophobicContact CZ2-CD1 3.7Å; L444-I446 HydrophobicContact CD1-CD1 4.32Å; L444-I446 HydrophobicContact CD1-CG1 3.73Å; L444-I446 HydrophobicContact CG-CG1 4.33Å; I446-R448 PolarHBondContact O-N 2.88Å; I446-V449 HydrophobicContact CB-CG2 4.22Å; I446-V449 HydrophobicContact CD1-CG2 4.46Å; I446-V449 HydrophobicContact CG2-CG2 4.05Å
447	Q	75.1	Confident	81.4	Confident	137 Å²	137	57.3 Å²	57.3	64%	0.64	26%	0.259	S	S	*	.	S	Bend	trans	-55.5	-34	-173.4	-73	-71.4	-7.7	0	0	113.6
448	R	78.5	Confident	81.8	Confident	189 Å²	189	48.5 Å²	48.5	71%	0.713	22%	0.221	S	C	*	.	S	Bend	trans	-141.3	106.5	172.9	-71	-174.9	165.4	159.7	-4	109.1	I446 T450	I446-R448 PolarHBondContact O-N 2.88Å; R448-T450 PolarHBondContact O-N 2.76Å
449	V	79.5	Confident	82.1	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	19%	0.192	C	C	.	.			trans	-74.2	123.6	165.1	144.1	0	0	0	0	108.4	G333 E334 L336 I446 Y453 V478	G333-V449 PolarHBondContact N-O 2.98Å; E334-V449 PolarHBondContact O-N 3.49Å; L336-V449 HydrophobicContact CB-CB 4.12Å; L336-V449 HydrophobicContact CB-CG2 3.41Å; L336-V449 VanDerWaalsContact CB-CG2 3.41Å; L336-V449 HydrophobicContact CD1-CG2 3.84Å; L336-V449 HydrophobicContact CG-CG2 4.2Å; I446-V449 HydrophobicContact CB-CG2 4.22Å; I446-V449 HydrophobicContact CD1-CG2 4.46Å; I446-V449 HydrophobicContact CG2-CG2 4.05Å; V449-Y453 HydrophobicContact CG2-CD2 4.27Å; V449-V478 HydrophobicContact CG1-CG1 4.33Å; V449-V478 HydrophobicContact CG1-CG2 3.38Å
450	T	82.2	Confident	82.3	Confident	60 Å²	60	39.3 Å²	39.3	37%	0.368	17%	0.174	S	C	.	.			trans	-102.6	168.4	179.2	66.5	0	0	0	0	111.4	D332 R448 K452 Y453	D332-T450 VanDerWaalsContact OD1-CA 3.24Å; D332-T450 WeakPolarHBondContact OD1-CA 3.49Å; R448-T450 PolarHBondContact O-N 2.76Å; T450-K452 PolarHBondContact O-N 3.16Å; T450-Y453 PolarHBondContact O-N 2.7Å
451	R	75.5	Confident	82.5	Confident	139 Å²	139	42.2 Å²	42.2	53%	0.525	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-49.1	-19.2	171.7	69.4	179.4	-172	-107.3	1.7	116	D332 Y453 H454 H480	D332-R451 PolarHBondContact OD1-N 2.79Å; R451-Y453 PolarHBondContact O-N 2.95Å; R451-H454 WeakPolarHBondContact O-CB 3.47Å; R451-H454 PolarHBondContact O-N 2.78Å; R451-H480 HydrophobicContact CB-CB 4.27Å
452	K	77	Confident	81.9	Confident	81 Å²	81	41.7 Å²	41.7	35%	0.352	18%	0.184	S	C	.	.	G	3₁₀ helix	trans	-53.8	-36	171	-176.9	-168	168.5	-164.3	0	112	E424 T450	E424-K452 IonicContact OE1-NZ 2.84Å; E424-K452 PolarHBondContact OE1-NZ 2.95Å; E424-K452 IonicContact OE2-NZ 3.16Å; E424-K452 PolarHBondContact OE2-NZ 3.37Å; T450-K452 PolarHBondContact O-N 3.16Å
453	Y	81	Confident	81	Confident	38 Å²	38	42 Å²	42	15%	0.149	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-94.5	10.3	-175.1	-55.8	-77.1	0	0	0	113.5	W356 I358 V449 T450 R451 A455 A456	W356-Y453 AromaticContact CD2-CD1 3.99Å; W356-Y453 HydrophobicContact CD2-CD1 3.99Å; W356-Y453 HydrophobicContact CD2-CE1 4.23Å; W356-Y453 AromaticContact CE2-CD1 3.8Å; W356-Y453 AromaticContact CE2-CE1 3.87Å; W356-Y453 HydrophobicContact CE3-CD1 4.13Å; W356-Y453 AromaticContact CH2-CD1 3.91Å; W356-Y453 HydrophobicContact CH2-CD1 3.91Å; W356-Y453 HydrophobicContact CH2-CG 4.25Å; W356-Y453 AromaticContact CZ2-CD1 3.79Å; W356-Y453 HydrophobicContact CZ2-CD1 3.79Å; W356-Y453 HydrophobicContact CZ2-CE1 4.16Å; W356-Y453 HydrophobicContact CZ2-CG 4.34Å; W356-Y453 HydrophobicContact CZ3-CD1 4.09Å; W356-Y453 AromaticContact NE1-CE1 3.95Å; I358-Y453 HydrophobicContact CD1-CE1 4.47Å; V449-Y453 HydrophobicContact CG2-CD2 4.27Å; T450-Y453 PolarHBondContact O-N 2.7Å; R451-Y453 PolarHBondContact O-N 2.95Å; Y453-A455 PolarHBondContact O-N 3.11Å; Y453-A456 PolarHBondContact O-N 2.8Å
454	H	81.7	Confident	80.1	Confident	2 Å²	2	41.4 Å²	41.4	1%	0.009	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	124.2	174.7	-179.7	95.1	0	0	0	110.5	Q362 R451 A456 V478 Y525 E561	Q362-H454 PolarHBondContact NE2-O 2.88Å; Q362-H454 PolarHBondContact OE1-O 3.04Å; R451-H454 WeakPolarHBondContact O-CB 3.47Å; R451-H454 PolarHBondContact O-N 2.78Å; H454-A456 PolarHBondContact O-N 3.48Å; H454-V478 HydrophobicContact CB-CB 4.2Å; H454-V478 HydrophobicContact CB-CG2 4.46Å; H454-V478 PolarHBondContact ND1-N 3.03Å; H454-V478 PolarHBondContact ND1-O 3.19Å; H454-Y525 AromaticContact CE1-CD1 3.52Å; H454-Y525 AromaticContact CE1-CD2 3.7Å; H454-Y525 AromaticContact CE1-CE1 3.87Å; H454-Y525 AromaticContact CE1-CG 3.42Å; H454-Y525 VanDerWaalsContact CE1-CG 3.42Å; H454-E561 IonicContact NE2-OE2 3.56Å
455	A	80.6	Confident	79	Confident	5 Å²	5	42.3 Å²	42.3	4%	0.041	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	24.6	179	0	0	0	0	0	115.4	R359 Y453 I476 F477 E561	R359-A455 PolarHBondContact NH2-O 3.04Å; Y453-A455 PolarHBondContact O-N 3.11Å; A455-I476 WeakPolarHBondContact CA-O 3.45Å; A455-I476 PolarHBondContact N-O 3.16Å; A455-F477 HydrophobicContact CB-CD1 3.89Å; A455-F477 HydrophobicContact CB-CE1 3.75Å; A455-E561 WeakPolarHBondContact CB-OE2 3.3Å
456	A	82.2	Confident	77.9	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	149.7	171.7	0	0	0	0	0	111.4	W356 I358 Y453 H454 I476	W356-A456 HydrophobicContact CE3-CB 3.81Å; W356-A456 HydrophobicContact CZ3-CB 3.89Å; I358-A456 HydrophobicContact CG1-CB 4.21Å; Y453-A456 PolarHBondContact O-N 2.8Å; H454-A456 PolarHBondContact O-N 3.48Å; A456-I476 PolarHBondContact N-O 2.84Å; A456-I476 PolarHBondContact O-N 2.78Å
457	K	84.2	Confident	76.6	Confident	84 Å²	84	40 Å²	40	37%	0.365	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	131.4	175.5	-105	-172.1	177.9	-169.8	0	111	W356 L357 I474	W356-K457 CarbonylContact C-O 3.58Å; W356-K457 VanDerWaalsContact CA-O 3.31Å; W356-K457 WeakPolarHBondContact CA-O 3.16Å; L357-K457 HydrophobicContact CB-CB 4Å; L357-K457 PolarHBondContact N-O 2.94Å; L357-K457 PolarHBondContact O-N 2.94Å; K457-I474 CarbonylContact C-O 3.59Å; K457-I474 WeakPolarHBondContact CA-O 3.4Å
458	L	88.2	Confident	75.4	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	122.6	172.7	177.9	64.6	0	0	0	109.2	L336 A338 W354 W356 L444 S473 I474 I476	L336-L458 HydrophobicContact CD2-CD2 4.46Å; A338-L458 HydrophobicContact CB-CD2 3.95Å; W354-L458 HydrophobicContact CB-CD1 4.49Å; W354-L458 HydrophobicContact CD2-CD1 4.45Å; W354-L458 HydrophobicContact CE3-CD1 3.68Å; W354-L458 HydrophobicContact CE3-CD2 3.92Å; W354-L458 HydrophobicContact CE3-CG 3.64Å; W354-L458 HydrophobicContact CH2-CD2 4.44Å; W354-L458 HydrophobicContact CZ3-CD1 4.28Å; W354-L458 HydrophobicContact CZ3-CD2 3.68Å; W354-L458 HydrophobicContact CZ3-CG 3.72Å; W356-L458 HydrophobicContact CD2-CD1 4.11Å; W356-L458 HydrophobicContact CE3-CB 4.05Å; W356-L458 HydrophobicContact CE3-CD1 4.42Å; W356-L458 HydrophobicContact CH2-CB 4.19Å; W356-L458 HydrophobicContact CH2-CD1 4.43Å; W356-L458 HydrophobicContact CZ2-CD1 4.08Å; W356-L458 HydrophobicContact CZ3-CB 3.85Å; L444-L458 HydrophobicContact CD2-CD1 3.77Å; L444-L458 HydrophobicContact CD2-CD2 3.84Å; L444-L458 HydrophobicContact CD2-CG 4.44Å; L458-S473 CarbonylContact O-C 3.59Å; L458-S473 VanDerWaalsContact O-CA 3.27Å; L458-S473 WeakPolarHBondContact O-CA 3.44Å; L458-I474 HydrophobicContact CB-CG1 4.15Å; L458-I474 HydrophobicContact CD2-CD1 4.38Å; L458-I474 PolarHBondContact N-O 3.13Å; L458-I474 PolarHBondContact O-N 2.81Å; L458-I476 HydrophobicContact CB-CG1 4.14Å
459	I	86.6	Confident	74.3	Confident	6 Å²	6	28.6 Å²	28.6	3%	0.031	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	138.4	-178.2	-59.3	176.2	0	0	0	109.4	W354 R355 L357 Q471 T472	W354-I459 VanDerWaalsContact CA-O 3.32Å; W354-I459 WeakPolarHBondContact CA-O 3.21Å; R355-I459 HydrophobicContact CB-CB 4.44Å; R355-I459 PolarHBondContact N-O 3.19Å; R355-I459 PolarHBondContact O-N 3.39Å; L357-I459 HydrophobicContact CD1-CD1 3.74Å; L357-I459 HydrophobicContact CG-CD1 3.9Å; I459-Q471 HydrophobicContact CG2-CB 4.18Å; I459-T472 CarbonylContact C-O 3.54Å; I459-T472 WeakPolarHBondContact CA-O 3.36Å
460	C	86.2	Confident	73.8	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	134.9	162	178	0	0	0	0	110.4	I321 C340 L352 F353 W354 Q471 T472	I321-C460 HydrophobicContact CD1-CB 4.03Å; I321-C460 HydrophobicContact CG1-CB 3.82Å; C340-C460 HydrophobicContact CB-CB 3.75Å; C340-C460 WeakPolarHBondContact CB-SG 3.42Å; C340-C460 WeakPolarHBondContact SG-CB 3.43Å; C340-C460 CovalentContact SG-SG 2.03Å; C340-C460 PolarHBondContact SG-SG 3.26Å; L352-C460 VanDerWaalsContact CD1-SG 3.56Å; F353-C460 CarbonylContact O-C 3.49Å; F353-C460 VanDerWaalsContact O-CA 3.28Å; F353-C460 WeakPolarHBondContact O-CA 3.39Å; W354-C460 HydrophobicContact CD2-CB 4.48Å; W354-C460 HydrophobicContact CE3-CB 3.97Å; W354-C460 HydrophobicContact CH2-CB 4.4Å; W354-C460 HydrophobicContact CZ3-CB 3.92Å; C460-Q471 CarbonylContact O-C 3.59Å; C460-Q471 VanDerWaalsContact O-CA 3.3Å; C460-Q471 WeakPolarHBondContact O-CA 3.43Å; C460-T472 HydrophobicContact CB-CG2 3.97Å; C460-T472 PolarHBondContact N-O 3.14Å; C460-T472 PolarHBondContact O-N 2.83Å
461	E	84.1	Confident	73.7	Confident	62 Å²	62	36 Å²	36	29%	0.29	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	141.8	-171.5	-177.3	179.3	130.1	0	0	111.7	L352 F353 H470	L352-E461 CarbonylContact C-O 3.58Å; L352-E461 WeakPolarHBondContact CA-O 3.45Å; F353-E461 PolarHBondContact N-O 2.92Å; F353-E461 PolarHBondContact O-N 3.49Å; E461-H470 WeakPolarHBondContact CA-O 3.26Å
462	T	75	Confident	74	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	128.5	169.5	53.9	0	0	0	0	112.1	P316 P319 G351 L352 S468 A469 H470	P316-T462 HydrophobicContact CB-CG2 4.31Å; P316-T462 HydrophobicContact CG-CG2 4.27Å; P319-T462 HydrophobicContact CB-CG2 4.06Å; P319-T462 HydrophobicContact CG-CG2 4.11Å; G351-T462 WeakPolarHBondContact O-CA 3.45Å; L352-T462 HydrophobicContact CD1-CG2 3.65Å; T462-S468 PolarHBondContact OG1-O 3.14Å; T462-A469 WeakPolarHBondContact O-CA 3.3Å; T462-H470 PolarHBondContact N-O 2.82Å; T462-H470 PolarHBondContact OG1-N 3.4Å; T462-H470 PolarHBondContact OG1-O 3.26Å
463	G	67.4	Low	74.4	Confident	6 Å²	6	30.3 Å²	30.3	6%	0.062	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	147.1	170.3	0	0	0	0	0	112.2	G350 G351	G350-G463 WeakPolarHBondContact CA-O 3.2Å; G351-G463 PolarHBondContact N-O 2.61Å; G351-G463 PolarHBondContact O-N 3.33Å
464	H	66.5	Low	74.6	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.164	C	C	.	.			trans	-156.9	147.5	-179.4	-165.3	-109.9	0	0	0	112	H313 T314 P316 K347 P348 V466 G467	H313-H464 WeakPolarHBondContact CB-CE1 3.48Å; H313-H464 AromaticContact CG-CE1 3.58Å; H313-H464 AromaticContact ND1-CE1 3.65Å; T314-H464 PolarHBondContact N-CE1 2.81Å; T314-H464 PolarHBondContact O-CE1 2.84Å; T314-H464 PolarHBondContact O-NE2 2.82Å; P316-H464 VanDerWaalsContact CD-CB 3.46Å; P316-H464 VanDerWaalsContact CD-CD2 3.49Å; P316-H464 WeakPolarHBondContact CD-CD2 3.31Å; P316-H464 VanDerWaalsContact CD-CG 3.43Å; P316-H464 HydrophobicContact CG-CB 4.08Å; K347-H464 PolarHBondContact N-NE2 2.94Å; K347-H464 VanDerWaalsContact N-NE2 3.18Å; K347-H464 PolarHBondContact O-CE1 2.77Å; K347-H464 PolarHBondContact O-NE2 3.17Å; P348-H464 VanDerWaalsContact C-NE2 3.27Å; P348-H464 PolarHBondContact O-NE2 3.08Å; H464-V466 VanDerWaalsContact CE1-CG2 3.44Å; H464-V466 WeakPolarHBondContact CE1-CG2 2.96Å; H464-V466 VanDerWaalsContact ND1-CG2 3.32Å; H464-V466 WeakPolarHBondContact ND1-CG2 3.29Å; H464-V466 PolarHBondContact O-N 2.88Å; H464-V466 VanDerWaalsContact O-N 3.08Å; H464-G467 PolarHBondContact O-N 2.83Å
465	P	63	Low	74.7	Confident	20 Å²	20	30 Å²	30	13%	0.13	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-21.4	-171.7	-24.7	33.6	0	0	0	116.3	Y385 S387 A390	Y385-P465 HydrophobicContact CD1-CB 3.75Å; Y385-P465 HydrophobicContact CD1-CG 3.69Å; Y385-P465 HydrophobicContact CE1-CB 4.37Å; Y385-P465 HydrophobicContact CE1-CG 3.81Å; Y385-P465 HydrophobicContact CG-CB 4.22Å; S387-P465 VanDerWaalsContact CB-O 3.22Å; S387-P465 WeakPolarHBondContact CB-O 3.47Å; S387-P465 PolarHBondContact OG-O 3.47Å; A390-P465 WeakPolarHBondContact CB-O 3.38Å
466	V	60.6	Low	74.9	Confident	2 Å²	2	29.7 Å²	29.7	1%	0.012	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.3	12.6	177.6	-70.8	0	0	0	0	113.9	I193 H313 E389 R393 H464	I193-V466 HydrophobicContact CG2-CG1 3.48Å; I193-V466 VanDerWaalsContact CG2-CG1 3.48Å; H313-V466 HydrophobicContact CB-CG1 4.06Å; H313-V466 HydrophobicContact CB-CG2 3.76Å; E389-V466 HydrophobicContact CB-CG1 4.4Å; R393-V466 PolarHBondContact NH1-O 2.8Å; H464-V466 VanDerWaalsContact CE1-CG2 3.44Å; H464-V466 WeakPolarHBondContact CE1-CG2 2.96Å; H464-V466 VanDerWaalsContact ND1-CG2 3.32Å; H464-V466 WeakPolarHBondContact ND1-CG2 3.29Å; H464-V466 PolarHBondContact O-N 2.88Å; H464-V466 VanDerWaalsContact O-N 3.08Å
467	G	53.3	Low	75	Confident	9 Å²	9	31.8 Å²	31.8	9%	0.093	18%	0.177	C	C	.	.			trans	78.4	93.4	165	0	0	0	0	0	115.9	R393 H464	R393-G467 PolarHBondContact NH1-O 3.3Å; H464-G467 PolarHBondContact O-N 2.83Å
468	S	50.3	Low	74.8	Confident	20 Å²	20	27.8 Å²	27.8	14%	0.14	16%	0.159	C	C	.	.			trans	-150.1	77.9	169	62.4	0	0	0	0	111.2	P315 T462 H470	P315-S468 WeakPolarHBondContact CB-OG 3.15Å; T462-S468 PolarHBondContact OG1-O 3.14Å; S468-H470 PolarHBondContact O-N 3.24Å
469	A	55.5	Low	74.4	Confident	67 Å²	67	32.6 Å²	32.6	55%	0.554	18%	0.18	S	C	*	.			trans	-80.9	98.4	179.7	0	0	0	0	0	111.1	T462	T462-A469 WeakPolarHBondContact O-CA 3.3Å
470	H	67.8	Low	74	Confident	90 Å²	90	33 Å²	33	42%	0.417	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	141.9	166	-62.8	-52.9	0	0	0	108.9	P318 P319 E461 T462 S468	P318-H470 HydrophobicContact CB-CB 4.03Å; P319-H470 VanDerWaalsContact CD-CB 3.4Å; P319-H470 HydrophobicContact CG-CB 4.38Å; P319-H470 WeakPolarHBondContact CG-O 3.44Å; E461-H470 WeakPolarHBondContact CA-O 3.26Å; T462-H470 PolarHBondContact N-O 2.82Å; T462-H470 PolarHBondContact OG1-N 3.4Å; T462-H470 PolarHBondContact OG1-O 3.26Å; S468-H470 PolarHBondContact O-N 3.24Å
471	Q	81	Confident	73.5	Confident	126 Å²	126	34.7 Å²	34.7	59%	0.589	20%	0.196	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-135	155.3	-179.6	63.1	170.3	-9.6	0	0	111.9	I459 C460	I459-Q471 HydrophobicContact CG2-CB 4.18Å; C460-Q471 CarbonylContact O-C 3.59Å; C460-Q471 VanDerWaalsContact O-CA 3.3Å; C460-Q471 WeakPolarHBondContact O-CA 3.43Å
472	T	81.4	Confident	73	Confident	48 Å²	48	31.9 Å²	31.9	29%	0.294	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	154.3	173.6	-174.4	0	0	0	0	109.7	P319 I321 I459 C460	P319-T472 HydrophobicContact CB-CG2 4.09Å; P319-T472 HydrophobicContact CG-CG2 4.11Å; P319-T472 WeakPolarHBondContact O-CG2 2.97Å; I321-T472 HydrophobicContact CD1-CG2 3.97Å; I321-T472 HydrophobicContact CG1-CG2 3.81Å; I459-T472 CarbonylContact C-O 3.54Å; I459-T472 WeakPolarHBondContact CA-O 3.36Å; C460-T472 HydrophobicContact CB-CG2 3.97Å; C460-T472 PolarHBondContact N-O 3.14Å; C460-T472 PolarHBondContact O-N 2.83Å
473	S	86.1	Confident	72.9	Confident	51 Å²	51	34.6 Å²	34.6	36%	0.357	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	144.9	-173.3	74.4	0	0	0	0	114.2	L458	L458-S473 CarbonylContact O-C 3.59Å; L458-S473 VanDerWaalsContact O-CA 3.27Å; L458-S473 WeakPolarHBondContact O-CA 3.44Å
474	I	85	Confident	73.5	Confident	10 Å²	10	38.4 Å²	38.4	5%	0.051	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	155.9	168.8	59.2	173	0	0	0	110.5	I321 P324 K457 L458 I476	I321-I474 HydrophobicContact CD1-CG1 4.2Å; I321-I474 HydrophobicContact CD1-CG2 4.2Å; I321-I474 HydrophobicContact CG2-CD1 4.27Å; P324-I474 HydrophobicContact CG-CD1 3.56Å; K457-I474 CarbonylContact C-O 3.59Å; K457-I474 WeakPolarHBondContact CA-O 3.4Å; L458-I474 HydrophobicContact CB-CG1 4.15Å; L458-I474 HydrophobicContact CD2-CD1 4.38Å; L458-I474 PolarHBondContact N-O 3.13Å; L458-I474 PolarHBondContact O-N 2.81Å; I474-I476 HydrophobicContact CD1-CD1 3.62Å; I474-I476 HydrophobicContact CG1-CD1 4Å
475	T	83.9	Confident	74	Confident	23 Å²	23	39 Å²	39	14%	0.141	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	132	169.3	-51.2	0	0	0	0	109.9	N327 H328 F477	N327-T475 VanDerWaalsContact CA-O 3.25Å; N327-T475 WeakPolarHBondContact CA-O 3.21Å; N327-T475 WeakPolarHBondContact CB-O 3.42Å; N327-T475 PolarHBondContact OD1-N 2.78Å; H328-T475 PolarHBondContact N-O 3.39Å; T475-F477 HydrophobicContact CG2-CD2 4.35Å; T475-F477 HydrophobicContact CG2-CE1 4.39Å; T475-F477 HydrophobicContact CG2-CE2 3.69Å; T475-F477 HydrophobicContact CG2-CZ 3.72Å
476	I	84.1	Confident	75	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	132.6	178.4	-54.8	-55.1	0	0	0	108.7	Y330 L336 W356 A455 A456 L458 I474	Y330-I476 HydrophobicContact CD2-CG2 3.85Å; Y330-I476 HydrophobicContact CE2-CD1 4.22Å; Y330-I476 HydrophobicContact CE2-CG2 4.11Å; L336-I476 HydrophobicContact CD1-CD1 3.86Å; L336-I476 HydrophobicContact CD1-CG1 3.96Å; L336-I476 HydrophobicContact CD1-CG2 3.86Å; W356-I476 HydrophobicContact CH2-CB 4.29Å; W356-I476 HydrophobicContact CH2-CG1 3.77Å; W356-I476 HydrophobicContact CZ3-CB 4.14Å; W356-I476 HydrophobicContact CZ3-CG1 3.74Å; A455-I476 WeakPolarHBondContact CA-O 3.45Å; A455-I476 PolarHBondContact N-O 3.16Å; A456-I476 PolarHBondContact N-O 2.84Å; A456-I476 PolarHBondContact O-N 2.78Å; L458-I476 HydrophobicContact CB-CG1 4.14Å; I474-I476 HydrophobicContact CD1-CD1 3.62Å; I474-I476 HydrophobicContact CG1-CD1 4Å
477	F	83.8	Confident	76.1	Confident	43 Å²	43	42 Å²	42	19%	0.189	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	147	172.7	-64	-89.3	0	0	0	109.7	N327 H328 V329 Y330 A455 T475 E561	N327-F477 HydrophobicContact CB-CE2 4.2Å; H328-F477 PolarHBondContact O-N 3.2Å; V329-F477 WeakPolarHBondContact CA-O 3.22Å; V329-F477 HydrophobicContact CB-CB 4.44Å; V329-F477 HydrophobicContact CG1-CB 4.26Å; V329-F477 HydrophobicContact CG2-CB 4.11Å; Y330-F477 PolarHBondContact N-O 3.12Å; A455-F477 HydrophobicContact CB-CD1 3.89Å; A455-F477 HydrophobicContact CB-CE1 3.75Å; T475-F477 HydrophobicContact CG2-CD2 4.35Å; T475-F477 HydrophobicContact CG2-CE1 4.39Å; T475-F477 HydrophobicContact CG2-CE2 3.69Å; T475-F477 HydrophobicContact CG2-CZ 3.72Å; F477-E561 WeakPolarHBondContact CE1-OE2 3.43Å
478	V	80.6	Confident	77.5	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	117.9	-178.6	-171.8	0	0	0	0	109.4	Y330 D332 V449 H454 H480	Y330-V478 CarbonylContact O-C 3.59Å; Y330-V478 WeakPolarHBondContact O-CA 3.18Å; D332-V478 HydrophobicContact CB-CG1 4.1Å; V449-V478 HydrophobicContact CG1-CG1 4.33Å; V449-V478 HydrophobicContact CG1-CG2 3.38Å; H454-V478 HydrophobicContact CB-CB 4.2Å; H454-V478 HydrophobicContact CB-CG2 4.46Å; H454-V478 PolarHBondContact ND1-N 3.03Å; H454-V478 PolarHBondContact ND1-O 3.19Å; V478-H480 PolarHBondContact O-N 2.75Å
479	K	79.6	Confident	78.9	Confident	101 Å²	101	44.4 Å²	44.4	44%	0.439	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	112.6	168.4	-83.1	173.7	177.2	174.1	0	108.9	V329 Y330 L331 D332 Y525	V329-K479 HydrophobicContact CG1-CD 3.95Å; V329-K479 HydrophobicContact CG1-CG 3.77Å; Y330-K479 PolarHBondContact O-N 3.24Å; L331-K479 HydrophobicContact CD2-CB 4.03Å; L331-K479 HydrophobicContact CD2-CD 4.28Å; D332-K479 PolarHBondContact N-O 2.91Å; K479-Y525 HydrophobicContact CG-CD1 3.84Å; K479-Y525 HydrophobicContact CG-CE1 4.25Å
480	H	78.7	Confident	79.9	Confident	16 Å²	16	46 Å²	46	7%	0.074	26%	0.256	C	S	.	.			trans	-123.3	139.7	174.2	63.6	91.9	0	0	0	110.3	D332 R451 V478 Y525	D332-H480 HydrophobicContact CB-CB 3.86Å; D332-H480 WeakPolarHBondContact OD2-CB 3.42Å; R451-H480 HydrophobicContact CB-CB 4.27Å; V478-H480 PolarHBondContact O-N 2.75Å; H480-Y525 PolarHBondContact O-N 3.01Å
481	A	75	Confident	79.6	Confident	35 Å²	35	45.1 Å²	45.1	29%	0.289	26%	0.257	S	S	.	.			trans	-65.7	165.7	167.6	0	0	0	0	0	110.4	A483 I594	A481-A483 PolarHBondContact O-N 2.94Å; A481-I594 HydrophobicContact CB-CD1 4.05Å
482	P	75.1	Confident	78.6	Confident	2 Å²	2	41.7 Å²	41.7	1%	0.013	26%	0.256	C	S	.	.			trans	-61.8	125.1	171	23.1	-30.7	0	0	0	109.5	N484 A522 Y524 V586 I594	P482-N484 PolarHBondContact O-N 3.45Å; P482-N484 VanDerWaalsContact O-N 3.09Å; P482-A522 HydrophobicContact CB-CB 4.27Å; P482-A522 WeakPolarHBondContact CB-O 3.5Å; P482-Y524 HydrophobicContact CB-CD1 4.16Å; P482-Y524 HydrophobicContact CG-CD1 4.33Å; P482-V586 HydrophobicContact CG-CG1 4.27Å; P482-I594 HydrophobicContact CG-CD1 3.79Å; P482-I594 WeakPolarHBondContact O-CD1 3.35Å
483	A	72.8	Confident	77.6	Confident	58 Å²	58	42.6 Å²	42.6	48%	0.479	26%	0.264	S	S	.	.	S	Bend	trans	-59.9	-26.5	-170.8	0	0	0	0	0	114.5	A481 A522	A481-A483 PolarHBondContact O-N 2.94Å; A483-A522 HydrophobicContact CB-CB 4.28Å
484	N	78.6	Confident	76.9	Confident	86 Å²	86	41.4 Å²	41.4	46%	0.46	25%	0.254	S	S	.	.			trans	-153.6	172.8	170.2	65.1	24.5	0	0	0	111.6	P482 A522	P482-N484 PolarHBondContact O-N 3.45Å; P482-N484 VanDerWaalsContact O-N 3.09Å; N484-A522 PolarHBondContact O-N 2.77Å
485	V	78.4	Confident	75.8	Confident	12 Å²	12	42.5 Å²	42.5	7%	0.073	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	124.5	173.6	175.4	0	0	0	0	107.1	I487 C519 K520 C584 V586 I594	V485-I487 HydrophobicContact CG1-CG1 4.48Å; V485-C519 WeakPolarHBondContact CG1-SG 3.38Å; V485-K520 CarbonylContact C-O 3.13Å; V485-K520 WeakPolarHBondContact CA-O 3.39Å; V485-C584 HydrophobicContact CG1-CB 3.83Å; V485-C584 VanDerWaalsContact CG1-SG 3.59Å; V485-V586 HydrophobicContact CB-CG2 4.21Å; V485-V586 HydrophobicContact CG1-CG2 3.67Å; V485-V586 HydrophobicContact CG2-CB 3.69Å; V485-V586 HydrophobicContact CG2-CG1 4.33Å; V485-V586 HydrophobicContact CG2-CG2 3.43Å; V485-V586 VanDerWaalsContact CG2-CG2 3.43Å; V485-I594 HydrophobicContact CB-CG2 3.98Å; V485-I594 HydrophobicContact CG2-CB 3.93Å; V485-I594 HydrophobicContact CG2-CG2 3.49Å; V485-I594 VanDerWaalsContact CG2-CG2 3.49Å
486	T	83.4	Confident	74.6	Confident	72 Å²	72	43.7 Å²	43.7	44%	0.442	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	142.4	-172.6	55.7	0	0	0	0	110.9	C519 K520	T486-C519 CarbonylContact O-C 3.59Å; T486-C519 WeakPolarHBondContact O-CA 3.4Å; T486-K520 PolarHBondContact N-O 2.9Å; T486-K520 PolarHBondContact O-N 2.02Å; T486-K520 PolarHBondContact OG1-O 2.84Å
487	I	83	Confident	73.4	Confident	13 Å²	13	45 Å²	45	7%	0.067	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	128.8	-167.6	-52.8	153.5	0	0	0	108.9	V485 I518 C519 C584 S596 Y1505	V485-I487 HydrophobicContact CG1-CG1 4.48Å; I487-I518 CarbonylContact C-O 3.56Å; I487-I518 WeakPolarHBondContact CA-O 3.49Å; I487-I518 VanDerWaalsContact CG2-O 3.24Å; I487-I518 WeakPolarHBondContact CG2-O 3.31Å; I487-C519 HydrophobicContact CG1-CB 4.04Å; I487-C584 HydrophobicContact CD1-CB 3.59Å; I487-C584 HydrophobicContact CG1-CB 4.02Å; I487-S596 VanDerWaalsContact CD1-OG 3.25Å; I487-S596 WeakPolarHBondContact CD1-OG 3.41Å; I487-Y1505 HydrophobicContact CB-CD1 4.48Å; I487-Y1505 HydrophobicContact CB-CE1 4.21Å; I487-Y1505 HydrophobicContact CD1-CD1 3.6Å; I487-Y1505 HydrophobicContact CD1-CE1 3.54Å; I487-Y1505 HydrophobicContact CG1-CD1 4.16Å; I487-Y1505 HydrophobicContact CG1-CE1 3.69Å; I487-Y1505 HydrophobicContact CG2-CD1 3.7Å; I487-Y1505 HydrophobicContact CG2-CE1 3.45Å; I487-Y1505 VanDerWaalsContact CG2-CE1 3.45Å
488	S	83.8	Confident	72.1	Confident	58 Å²	58	48 Å²	48	41%	0.406	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	167.8	-173.1	57.4	0	0	0	0	111.7	F517 I518	S488-F517 CarbonylContact O-C 3.55Å; S488-F517 VanDerWaalsContact O-CA 3.31Å; S488-F517 WeakPolarHBondContact O-CA 3.26Å; S488-I518 PolarHBondContact N-O 2.85Å; S488-I518 PolarHBondContact O-N 2.62Å
489	V	78.3	Confident	70.7	Confident	22 Å²	22	52 Å²	52	13%	0.133	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	145.5	177.6	157.6	0	0	0	0	109.1	T491 I494 K515 T516 F517	V489-T491 WeakPolarHBondContact CG1-O 3.28Å; V489-I494 HydrophobicContact CB-CD1 4.18Å; V489-I494 HydrophobicContact CB-CG1 3.99Å; V489-I494 HydrophobicContact CG2-CD1 3.63Å; V489-I494 HydrophobicContact CG2-CG1 3.8Å; V489-K515 HydrophobicContact CG1-CB 4.47Å; V489-K515 HydrophobicContact CG1-CD 4.19Å; V489-T516 WeakPolarHBondContact CA-O 3.34Å; V489-T516 WeakPolarHBondContact CB-O 3.49Å; V489-T516 WeakPolarHBondContact CG1-O 3.38Å; V489-T516 WeakPolarHBondContact CG2-O 3.45Å; V489-F517 HydrophobicContact CG2-CD1 3.29Å; V489-F517 HydrophobicContact CG2-CD2 4.39Å; V489-F517 HydrophobicContact CG2-CE1 3.33Å; V489-F517 HydrophobicContact CG2-CE2 4.42Å; V489-F517 HydrophobicContact CG2-CG 3.85Å; V489-F517 HydrophobicContact CG2-CZ 3.93Å
490	E	77.1	Confident	69.1	Low	99 Å²	99	51.4 Å²	51.4	46%	0.463	33%	0.333	S	S	.	.	S	Bend	trans	-80	-23.3	178.7	-64.5	-178.6	160.9	0	0	113.2	T516 I518 R568	E490-T516 VanDerWaalsContact CD-CG2 3.42Å; E490-T516 HydrophobicContact CG-CG2 3.89Å; E490-T516 PolarHBondContact N-O 2.98Å; E490-T516 VanDerWaalsContact N-O 3.13Å; E490-T516 WeakPolarHBondContact OE2-CB 3.42Å; E490-T516 WeakPolarHBondContact OE2-CG2 3.32Å; E490-T516 PolarHBondContact OE2-OG1 2.83Å; E490-I518 HydrophobicContact CG-CD1 3.71Å; E490-I518 HydrophobicContact CG-CG1 4.32Å; E490-R568 IonicContact OE1-NH1 3.41Å; E490-R568 PolarHBondContact OE1-NH1 3.14Å
491	T	60.9	Low	67.4	Low	72 Å²	72	54.4 Å²	54.4	44%	0.442	37%	0.368	S	S	.	.	S	Bend	trans	-132.7	93.3	-173	47	0	0	0	0	113.1	V489 K515	V489-T491 WeakPolarHBondContact CG1-O 3.28Å; T491-K515 WeakPolarHBondContact O-CD 3.35Å; T491-K515 PolarHBondContact O-NZ 2.9Å
492	G	61.5	Low	66	Low	55 Å²	55	60.5 Å²	60.5	57%	0.567	38%	0.384	S	S	*	.	S	Bend	trans	100.5	171.2	-176.1	0	0	0	0	0	112.8
493	S	60.4	Low	65	Low	67 Å²	67	65.4 Å²	65.4	47%	0.469	41%	0.407	S	S	.	.			trans	-86.2	158.4	176.7	50.1	0	0	0	0	112.4	D495	S493-D495 WeakPolarHBondContact CB-OD1 3.4Å; S493-D495 WeakPolarHBondContact CB-OD2 3.43Å; S493-D495 PolarHBondContact OG-OD1 3.5Å; S493-D495 PolarHBondContact OG-OD2 3.16Å
494	I	70.5	Confident	64.6	Low	26 Å²	26	64.2 Å²	64.2	13%	0.133	39%	0.391	C	S	.	.			trans	-120.4	120.6	155.6	-7.2	172.1	0	0	0	104.7	V489 K505 V506 A507	V489-I494 HydrophobicContact CB-CD1 4.18Å; V489-I494 HydrophobicContact CB-CG1 3.99Å; V489-I494 HydrophobicContact CG2-CD1 3.63Å; V489-I494 HydrophobicContact CG2-CG1 3.8Å; I494-K505 HydrophobicContact CB-CD 3.55Å; I494-K505 HydrophobicContact CD1-CD 4.47Å; I494-K505 HydrophobicContact CG2-CB 3.7Å; I494-K505 HydrophobicContact CG2-CD 3.62Å; I494-K505 HydrophobicContact CG2-CG 4.2Å; I494-V506 WeakPolarHBondContact CG2-O 3.16Å; I494-A507 HydrophobicContact CG2-CB 4.29Å
495	D	62.1	Low	64.3	Low	33 Å²	33	61.3 Å²	61.3	18%	0.176	38%	0.375	C	S	.	.			trans	-106	-134	-160.1	-70.3	-59.6	0	0	0	112.5	S493 K505 N1509 P1510 V1511 N1512 R1515	S493-D495 WeakPolarHBondContact CB-OD1 3.4Å; S493-D495 WeakPolarHBondContact CB-OD2 3.43Å; S493-D495 PolarHBondContact OG-OD1 3.5Å; S493-D495 PolarHBondContact OG-OD2 3.16Å; D495-K505 WeakPolarHBondContact O-CE 3.39Å; D495-N1509 CarbonylContact C-O 3.59Å; D495-N1509 PolarHBondContact N-O 3.29Å; D495-N1509 CarbonylContact O-C 3.57Å; D495-P1510 VanDerWaalsContact C-CA 3.48Å; D495-P1510 VanDerWaalsContact CB-CA 3.46Å; D495-P1510 HydrophobicContact CB-CB 3.77Å; D495-P1510 HydrophobicContact CB-CG 4.39Å; D495-V1511 HydrophobicContact CB-CG1 4.23Å; D495-N1512 VanDerWaalsContact CB-ND2 3.33Å; D495-N1512 WeakPolarHBondContact CB-ND2 3.14Å; D495-N1512 PolarHBondContact OD1-ND2 2.72Å; D495-N1512 PolarHBondContact OD2-ND2 3.09Å; D495-R1515 IonicContact OD1-NH1 2.7Å; D495-R1515 PolarHBondContact OD1-NH1 2.73Å
496	D	59.4	Low	64.2	Low	48 Å²	48	60.8 Å²	60.8	26%	0.257	37%	0.371	S	S	.	.			trans	-147.9	72.7	168.6	-119.3	-58.4	0	0	0	123.5	H498 H503 A1508 N1509 P1510 V1511	D496-H498 PolarHBondContact O-CE1 2.96Å; D496-H498 PolarHBondContact O-ND1 3.18Å; D496-H498 IonicContact OD1-CE1 3.12Å; D496-H498 PolarHBondContact OD1-CE1 2.93Å; D496-H498 IonicContact OD1-ND1 2.75Å; D496-H503 IonicContact OD1-ND1 2.73Å; D496-H503 PolarHBondContact OD1-ND1 2.85Å; D496-A1508 VanDerWaalsContact OD1-C 3.28Å; D496-A1508 VanDerWaalsContact OD1-CB 3.24Å; D496-A1508 WeakPolarHBondContact OD1-CB 3.46Å; D496-A1508 VanDerWaalsContact OD1-O 3.06Å; D496-A1508 WeakPolarHBondContact OD2-CB 3.15Å; D496-A1508 VanDerWaalsContact OD2-O 3.08Å; D496-N1509 VanDerWaalsContact CA-CB 3.49Å; D496-N1509 HydrophobicContact CB-CB 4.48Å; D496-N1509 VanDerWaalsContact N-C 3.33Å; D496-N1509 PolarHBondContact N-O 3.1Å; D496-N1509 PolarHBondContact OD1-ND2 2.69Å; D496-P1510 VanDerWaalsContact N-C 3.26Å; D496-V1511 VanDerWaalsContact C-CA 3.49Å; D496-V1511 VanDerWaalsContact C-CB 3.47Å; D496-V1511 HydrophobicContact CB-CB 3.81Å; D496-V1511 HydrophobicContact CB-CG1 4.21Å; D496-V1511 HydrophobicContact CB-CG2 4.48Å; D496-V1511 VanDerWaalsContact O-CB 3.27Å; D496-V1511 WeakPolarHBondContact O-CB 3.37Å; D496-V1511 WeakPolarHBondContact O-CG2 3.26Å
497	D	58.9	Low	63.8	Low	27 Å²	27	57.7 Å²	57.7	14%	0.144	35%	0.353	C	S	.	.			trans	-72	98.3	167.8	157.3	40.6	0	0	0	117.7	T499 V506 R599 N1509 P1510	D497-T499 VanDerWaalsContact C-N 3.3Å; D497-T499 VanDerWaalsContact CG-OG1 3.31Å; D497-T499 PolarHBondContact O-N 2.87Å; D497-T499 VanDerWaalsContact OD1-CG2 3.25Å; D497-T499 WeakPolarHBondContact OD1-CG2 3.4Å; D497-T499 PolarHBondContact OD1-N 3.44Å; D497-T499 PolarHBondContact OD1-OG1 3.27Å; D497-T499 PolarHBondContact OD2-OG1 2.7Å; D497-V506 HydrophobicContact CB-CG2 4.46Å; D497-V506 VanDerWaalsContact OD2-CG2 3.31Å; D497-V506 WeakPolarHBondContact OD2-CG2 3.29Å; D497-R599 IonicContact OD2-NH2 2.82Å; D497-R599 PolarHBondContact OD2-NH2 2.95Å; D497-N1509 VanDerWaalsContact C-CG 3.42Å; D497-N1509 HydrophobicContact CB-CB 3.84Å; D497-N1509 WeakPolarHBondContact O-CB 3.4Å; D497-N1509 PolarHBondContact O-OD1 3.5Å; D497-P1510 VanDerWaalsContact CA-O 3.25Å; D497-P1510 WeakPolarHBondContact CA-O 3.46Å; D497-P1510 HydrophobicContact CB-CB 4.39Å; D497-P1510 WeakPolarHBondContact CB-O 3Å; D497-P1510 PolarHBondContact N-O 2.93Å
498	H	56.4	Low	63.4	Low	105 Å²	105	62.7 Å²	62.7	49%	0.486	37%	0.372	S	S	.	.			trans	-84.5	48.1	-170	-60.3	31.2	0	0	0	115.4	D496 G500 H503 N1509	D496-H498 PolarHBondContact O-CE1 2.96Å; D496-H498 PolarHBondContact O-ND1 3.18Å; D496-H498 IonicContact OD1-CE1 3.12Å; D496-H498 PolarHBondContact OD1-CE1 2.93Å; D496-H498 IonicContact OD1-ND1 2.75Å; H498-G500 PolarHBondContact O-N 3.08Å; H498-H503 AromaticContact CD2-CE1 3.48Å; H498-H503 PolarHBondContact CD2-CE1 3.15Å; H498-H503 VanDerWaalsContact CD2-CE1 3.48Å; H498-H503 AromaticContact CD2-NE2 3.79Å; H498-H503 AromaticContact CE1-CE1 3.64Å; H498-H503 AromaticContact CE1-ND1 3.8Å; H498-H503 AromaticContact NE2-CE1 3.03Å; H498-H503 PolarHBondContact NE2-CE1 2.89Å; H498-H503 AromaticContact NE2-ND1 3.64Å; H498-H503 AromaticContact NE2-NE2 3.77Å; H498-N1509 PolarHBondContact ND1-ND2 3.23Å
499	T	50.5	Low	62.7	Low	86 Å²	86	61 Å²	61	53%	0.528	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-69.3	125.4	-178.4	33.1	0	0	0	0	113.3	D497	D497-T499 VanDerWaalsContact C-N 3.3Å; D497-T499 VanDerWaalsContact CG-OG1 3.31Å; D497-T499 PolarHBondContact O-N 2.87Å; D497-T499 VanDerWaalsContact OD1-CG2 3.25Å; D497-T499 WeakPolarHBondContact OD1-CG2 3.4Å; D497-T499 PolarHBondContact OD1-N 3.44Å; D497-T499 PolarHBondContact OD1-OG1 3.27Å; D497-T499 PolarHBondContact OD2-OG1 2.7Å
500	G	45.5	Very low	62.3	Low	87 Å²	87	70.7 Å²	70.7	90%	0.897	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	80.5	12.1	176.4	0	0	0	0	0	116.1	H498	H498-G500 PolarHBondContact O-N 3.08Å
501	G	43.2	Very low	61.8	Low	79 Å²	79	69.4 Å²	69.4	81%	0.814	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	77.7	21.1	174.8	0	0	0	0	0	114.6
502	R	46.2	Very low	62.1	Low	163 Å²	163	68.8 Å²	68.8	62%	0.615	41%	0.41	S	S	*	.	S	Bend	trans	-132	158.8	176.9	-154	-178.2	-167.3	-167	13	109.8	E504 N1509	R502-E504 WeakPolarHBondContact CD-OE1 3.34Å; R502-E504 HydrophobicContact CG-CG 4.41Å; R502-E504 IonicContact CZ-OE1 2.82Å; R502-E504 IonicContact NE-OE1 2.73Å; R502-E504 IonicContact NH1-OE1 3.89Å; R502-E504 PolarHBondContact NH1-OE1 2.8Å; R502-N1509 PolarHBondContact O-OD1 3.07Å
503	H	54.5	Low	62.6	Low	106 Å²	106	70 Å²	70	49%	0.491	40%	0.401	S	S	.	.			trans	-103.5	107.9	178.2	-74.3	-107.3	0	0	0	112	D496 H498 S1507 A1508 N1509	D496-H503 IonicContact OD1-ND1 2.73Å; D496-H503 PolarHBondContact OD1-ND1 2.85Å; H498-H503 AromaticContact CD2-CE1 3.48Å; H498-H503 PolarHBondContact CD2-CE1 3.15Å; H498-H503 VanDerWaalsContact CD2-CE1 3.48Å; H498-H503 AromaticContact CD2-NE2 3.79Å; H498-H503 AromaticContact CE1-CE1 3.64Å; H498-H503 AromaticContact CE1-ND1 3.8Å; H498-H503 AromaticContact NE2-CE1 3.03Å; H498-H503 PolarHBondContact NE2-CE1 2.89Å; H498-H503 AromaticContact NE2-ND1 3.64Å; H498-H503 AromaticContact NE2-NE2 3.77Å; H503-S1507 CarbonylContact C-O 3.36Å; H503-A1508 HydrophobicContact CB-CB 3.64Å; H503-N1509 VanDerWaalsContact CA-ND2 3.27Å; H503-N1509 WeakPolarHBondContact CA-ND2 3.35Å; H503-N1509 VanDerWaalsContact CA-OD1 3.27Å; H503-N1509 WeakPolarHBondContact CA-OD1 3.35Å; H503-N1509 WeakPolarHBondContact CB-ND2 2.98Å; H503-N1509 PolarHBondContact ND1-ND2 2.88Å; H503-N1509 VanDerWaalsContact ND1-ND2 3.19Å
504	E	63.8	Low	63.4	Low	33 Å²	33	72.5 Å²	72.5	15%	0.154	41%	0.406	C	S	.	.			trans	-140.3	103.9	-173.7	-57	-166.1	159.3	0	0	115.4	R502 V506 R597 S1507 N1509	R502-E504 WeakPolarHBondContact CD-OE1 3.34Å; R502-E504 HydrophobicContact CG-CG 4.41Å; R502-E504 IonicContact CZ-OE1 2.82Å; R502-E504 IonicContact NE-OE1 2.73Å; R502-E504 IonicContact NH1-OE1 3.89Å; R502-E504 PolarHBondContact NH1-OE1 2.8Å; E504-V506 PolarHBondContact O-N 2.75Å; E504-R597 CarbonylContact C-O 3.49Å; E504-R597 WeakPolarHBondContact CA-O 3.28Å; E504-R597 HydrophobicContact CG-CG 4.5Å; E504-S1507 CarbonylContact C-O 3.47Å; E504-S1507 WeakPolarHBondContact CA-O 3.36Å; E504-S1507 PolarHBondContact N-O 2.87Å; E504-N1509 VanDerWaalsContact C-CA 3.48Å; E504-N1509 VanDerWaalsContact N-CG 3.25Å; E504-N1509 PolarHBondContact N-OD1 2.88Å; E504-N1509 WeakPolarHBondContact O-CA 3.38Å; E504-N1509 PolarHBondContact O-N 3.43Å
505	K	72.7	Confident	63.8	Low	25 Å²	25	72.2 Å²	72.2	11%	0.109	40%	0.404	C	S	.	.			trans	-61.2	78.5	-169.8	-66.2	-113.7	166.6	76	0	116.1	I494 D495 A507 R597 V598 R599 S1506 S1507 A1508 N1509	I494-K505 HydrophobicContact CB-CD 3.55Å; I494-K505 HydrophobicContact CD1-CD 4.47Å; I494-K505 HydrophobicContact CG2-CB 3.7Å; I494-K505 HydrophobicContact CG2-CD 3.62Å; I494-K505 HydrophobicContact CG2-CG 4.2Å; D495-K505 WeakPolarHBondContact O-CE 3.39Å; K505-A507 PolarHBondContact O-N 3.25Å; K505-R597 PolarHBondContact N-O 3.03Å; K505-V598 VanDerWaalsContact C-CA 3.49Å; K505-V598 HydrophobicContact CB-CB 4.35Å; K505-V598 HydrophobicContact CB-CG2 3.66Å; K505-V598 CarbonylContact O-C 3.05Å; K505-V598 WeakPolarHBondContact O-CA 3.42Å; K505-V598 WeakPolarHBondContact O-CB 3.38Å; K505-V598 WeakPolarHBondContact O-CG1 3.31Å; K505-V598 VanDerWaalsContact O-CG2 3.26Å; K505-V598 WeakPolarHBondContact O-CG2 3.36Å; K505-R599 VanDerWaalsContact C-N 3.33Å; K505-R599 PolarHBondContact O-N 3.35Å; K505-S1506 WeakPolarHBondContact CB-O 3.31Å; K505-S1506 WeakPolarHBondContact CG-O 3.13Å; K505-S1506 PolarHBondContact N-O 2.92Å; K505-S1507 PolarHBondContact N-O 3.27Å; K505-S1507 PolarHBondContact NZ-OG 3.22Å; K505-A1508 WeakPolarHBondContact CD-O 3.34Å; K505-A1508 WeakPolarHBondContact CE-O 3.21Å; K505-N1509 WeakPolarHBondContact CA-O 3.43Å
506	V	77.2	Confident	64.8	Low	0 Å²	0	71.3 Å²	71.3	0%	0	40%	0.4	C	S	.	.	B	Isolated β-bridge	trans	-43.5	134.7	159.1	-148.7	0	0	0	0	110.9	I494 D497 E504 Y508 R599 L600 D601 P1510	I494-V506 WeakPolarHBondContact CG2-O 3.16Å; D497-V506 HydrophobicContact CB-CG2 4.46Å; D497-V506 VanDerWaalsContact OD2-CG2 3.31Å; D497-V506 WeakPolarHBondContact OD2-CG2 3.29Å; E504-V506 PolarHBondContact O-N 2.75Å; V506-Y508 HydrophobicContact CB-CD1 4.34Å; V506-Y508 HydrophobicContact CB-CE1 4.24Å; V506-Y508 HydrophobicContact CG1-CD1 3.86Å; V506-Y508 HydrophobicContact CG1-CE1 3.99Å; V506-R599 CarbonylContact C-O 3.57Å; V506-R599 VanDerWaalsContact CA-O 3.23Å; V506-R599 WeakPolarHBondContact CA-O 3.2Å; V506-R599 HydrophobicContact CB-CB 4.15Å; V506-R599 HydrophobicContact CG1-CB 4.13Å; V506-R599 HydrophobicContact CG2-CB 4.02Å; V506-R599 VanDerWaalsContact CG2-CZ 3.5Å; V506-R599 VanDerWaalsContact CG2-NH2 3.29Å; V506-L600 VanDerWaalsContact CG1-CA 3.43Å; V506-D601 HydrophobicContact CG1-CB 4.01Å; V506-P1510 VanDerWaalsContact C-CG 3.5Å; V506-P1510 HydrophobicContact CB-CG 3.58Å; V506-P1510 HydrophobicContact CG2-CG 4.19Å; V506-P1510 VanDerWaalsContact O-CD 3.24Å; V506-P1510 WeakPolarHBondContact O-CD 3.28Å; V506-P1510 WeakPolarHBondContact O-CG 3.39Å
507	A	74.5	Confident	66.1	Low	7 Å²	7	69.4 Å²	69.4	6%	0.058	39%	0.389	C	S	.	.			trans	-105.4	95.2	161.8	0	0	0	0	0	105.6	I494 K505 A509 V598 R599 L600	I494-A507 HydrophobicContact CG2-CB 4.29Å; K505-A507 PolarHBondContact O-N 3.25Å; A507-A509 PolarHBondContact O-N 3.27Å; A507-V598 HydrophobicContact CB-CG1 4.35Å; A507-R599 PolarHBondContact N-O 3.11Å; A507-L600 HydrophobicContact CB-CD2 4.13Å; A507-L600 WeakPolarHBondContact O-CD2 3.19Å
508	Y	74.7	Confident	67.5	Low	118 Å²	118	69.1 Å²	69.1	46%	0.463	39%	0.388	S	S	.	.			trans	-57.2	129.8	179.9	-68.5	-41.9	0	0	0	110	V506 D601 P1510	V506-Y508 HydrophobicContact CB-CD1 4.34Å; V506-Y508 HydrophobicContact CB-CE1 4.24Å; V506-Y508 HydrophobicContact CG1-CD1 3.86Å; V506-Y508 HydrophobicContact CG1-CE1 3.99Å; Y508-D601 HydrophobicContact CD1-CB 4.37Å; Y508-D601 HydrophobicContact CE1-CB 4.18Å; Y508-P1510 HydrophobicContact CD2-CB 3.74Å; Y508-P1510 HydrophobicContact CD2-CG 4.13Å; Y508-P1510 HydrophobicContact CE1-CB 4.49Å; Y508-P1510 HydrophobicContact CE2-CB 3.31Å; Y508-P1510 HydrophobicContact CE2-CG 4.03Å; Y508-P1510 HydrophobicContact CG-CB 4.49Å; Y508-P1510 HydrophobicContact CG-CG 4.44Å
509	A	69.5	Low	69	Low	23 Å²	23	64.1 Å²	64.1	19%	0.19	37%	0.365	C	S	.	.			trans	-141.5	138.4	177.1	0	0	0	0	0	108.2	A507 E513 V573	A507-A509 PolarHBondContact O-N 3.27Å; A509-E513 HydrophobicContact CB-CB 4.3Å; A509-V573 HydrophobicContact CB-CB 4.23Å; A509-V573 HydrophobicContact CB-CG1 3.89Å; A509-V573 HydrophobicContact CB-CG2 4.45Å
510	R	68.6	Low	70.7	Confident	226 Å²	226	64 Å²	64	85%	0.853	36%	0.356	S	S	*	.			trans	-77.4	150.5	159	-64.6	178.6	-177.1	171.4	1.4	107.4	G512	R510-G512 PolarHBondContact O-N 3.45Å
511	A	66.8	Low	72.7	Confident	71 Å²	71	60.2 Å²	60.2	59%	0.587	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.8	113	178.2	0	0	0	0	0	112.3	P575	A511-P575 HydrophobicContact CB-CB 4.07Å; A511-P575 HydrophobicContact CB-CG 4.08Å
512	G	67.4	Low	74.5	Confident	60 Å²	60	57.1 Å²	57.1	62%	0.619	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	120.8	6.4	174.6	0	0	0	0	0	118.3	R510 V573	R510-G512 PolarHBondContact O-N 3.45Å; G512-V573 CarbonylContact C-O 3.54Å; G512-V573 WeakPolarHBondContact CA-O 3.38Å; G512-V573 PolarHBondContact N-O 2.99Å
513	E	72.9	Confident	76.2	Confident	79 Å²	79	52.6 Å²	52.6	37%	0.369	27%	0.274	S	S	.	.			trans	-93.6	162.2	-170.5	-146.3	-176.6	132.3	0	0	115.4	A509 K515 T572 V573	A509-E513 HydrophobicContact CB-CB 4.3Å; E513-K515 WeakPolarHBondContact OE1-CE 3.37Å; E513-K515 IonicContact OE1-NZ 3.1Å; E513-K515 PolarHBondContact OE1-NZ 2.83Å; E513-T572 CarbonylContact O-C 3.54Å; E513-T572 WeakPolarHBondContact O-CA 3.06Å; E513-T572 WeakPolarHBondContact O-CG2 3.22Å; E513-V573 PolarHBondContact N-O 3.24Å; E513-V573 PolarHBondContact O-N 3.03Å
514	M	75.4	Confident	77.5	Confident	120 Å²	120	47.9 Å²	47.9	59%	0.591	25%	0.252	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.4	141	-177.2	-173.9	-170.9	-69.9	0	0	113.2	I571 T572	M514-I571 WeakPolarHBondContact CA-O 3.34Å; M514-I571 WeakPolarHBondContact CG-O 3.32Å; M514-T572 HydrophobicContact CB-CG2 4.26Å; M514-T572 WeakPolarHBondContact CE-OG1 3.33Å
515	K	79.1	Confident	78.3	Confident	21 Å²	21	49.4 Å²	49.4	9%	0.091	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	142.6	-172.3	-56.1	-63.9	-165.9	-171.8	0	114.1	V489 T491 E513 F517 Q570 I571	V489-K515 HydrophobicContact CG1-CB 4.47Å; V489-K515 HydrophobicContact CG1-CD 4.19Å; T491-K515 WeakPolarHBondContact O-CD 3.35Å; T491-K515 PolarHBondContact O-NZ 2.9Å; E513-K515 WeakPolarHBondContact OE1-CE 3.37Å; E513-K515 IonicContact OE1-NZ 3.1Å; E513-K515 PolarHBondContact OE1-NZ 2.83Å; K515-F517 HydrophobicContact CB-CE2 3.85Å; K515-F517 HydrophobicContact CB-CZ 4.31Å; K515-Q570 CarbonylContact O-C 3.5Å; K515-Q570 WeakPolarHBondContact O-CA 3.34Å; K515-I571 PolarHBondContact N-O 2.87Å; K515-I571 PolarHBondContact O-N 2.79Å
516	T	83.9	Confident	78.5	Confident	13 Å²	13	49.8 Å²	49.8	8%	0.08	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	146.2	162.3	-43.8	0	0	0	0	110.4	V489 E490 I569 Q570	V489-T516 WeakPolarHBondContact CA-O 3.34Å; V489-T516 WeakPolarHBondContact CB-O 3.49Å; V489-T516 WeakPolarHBondContact CG1-O 3.38Å; V489-T516 WeakPolarHBondContact CG2-O 3.45Å; E490-T516 VanDerWaalsContact CD-CG2 3.42Å; E490-T516 HydrophobicContact CG-CG2 3.89Å; E490-T516 PolarHBondContact N-O 2.98Å; E490-T516 VanDerWaalsContact N-O 3.13Å; E490-T516 WeakPolarHBondContact OE2-CB 3.42Å; E490-T516 WeakPolarHBondContact OE2-CG2 3.32Å; E490-T516 PolarHBondContact OE2-OG1 2.83Å; T516-I569 CarbonylContact C-O 3.6Å; T516-I569 WeakPolarHBondContact CA-O 3.43Å; T516-I569 WeakPolarHBondContact CG2-O 3.49Å; T516-Q570 HydrophobicContact CG2-CG 3.67Å; T516-Q570 PolarHBondContact OG1-NE2 3.48Å
517	F	86.4	Confident	78.2	Confident	9 Å²	9	56.7 Å²	56.7	4%	0.039	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	150.8	172.5	-62.4	-102	0	0	0	112.6	S488 V489 K515 W532 R568 I569 I571 I582 V598	S488-F517 CarbonylContact O-C 3.55Å; S488-F517 VanDerWaalsContact O-CA 3.31Å; S488-F517 WeakPolarHBondContact O-CA 3.26Å; V489-F517 HydrophobicContact CG2-CD1 3.29Å; V489-F517 HydrophobicContact CG2-CD2 4.39Å; V489-F517 HydrophobicContact CG2-CE1 3.33Å; V489-F517 HydrophobicContact CG2-CE2 4.42Å; V489-F517 HydrophobicContact CG2-CG 3.85Å; V489-F517 HydrophobicContact CG2-CZ 3.93Å; K515-F517 HydrophobicContact CB-CE2 3.85Å; K515-F517 HydrophobicContact CB-CZ 4.31Å; F517-W532 HydrophobicContact CB-CH2 3.72Å; F517-W532 HydrophobicContact CB-CZ3 3.5Å; F517-W532 HydrophobicContact CG-CZ3 4.49Å; F517-R568 CarbonylContact O-C 3.52Å; F517-R568 WeakPolarHBondContact O-CA 3.39Å; F517-I569 HydrophobicContact CB-CG1 3.99Å; F517-I569 HydrophobicContact CD2-CG1 4.49Å; F517-I569 PolarHBondContact N-O 2.84Å; F517-I569 PolarHBondContact O-N 3.14Å; F517-I571 HydrophobicContact CE2-CB 4.49Å; F517-I571 HydrophobicContact CE2-CD1 4.35Å; F517-I582 HydrophobicContact CD1-CD1 3.79Å; F517-I582 HydrophobicContact CD2-CD1 4.22Å; F517-I582 HydrophobicContact CE1-CD1 3.62Å; F517-I582 HydrophobicContact CE2-CD1 4.07Å; F517-I582 HydrophobicContact CG-CD1 4.1Å; F517-I582 HydrophobicContact CZ-CD1 3.78Å; F517-V598 HydrophobicContact CE1-CG2 4.49Å
518	I	87.8	Confident	78.3	Confident	21 Å²	21	56.9 Å²	56.9	11%	0.108	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	142.3	-177.5	-57	159	0	0	0	109.9	I487 S488 E490 S567 R568	I487-I518 CarbonylContact C-O 3.56Å; I487-I518 WeakPolarHBondContact CA-O 3.49Å; I487-I518 VanDerWaalsContact CG2-O 3.24Å; I487-I518 WeakPolarHBondContact CG2-O 3.31Å; S488-I518 PolarHBondContact N-O 2.85Å; S488-I518 PolarHBondContact O-N 2.62Å; E490-I518 HydrophobicContact CG-CD1 3.71Å; E490-I518 HydrophobicContact CG-CG1 4.32Å; I518-S567 CarbonylContact C-O 3.44Å; I518-R568 HydrophobicContact CB-CG 4.27Å; I518-R568 VanDerWaalsContact CD1-NH1 3.27Å; I518-R568 HydrophobicContact CG1-CG 3.94Å; I518-R568 HydrophobicContact CG2-CG 4.07Å
519	C	87.8	Confident	78.6	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	143.1	173.2	-179.8	0	0	0	0	113.7	V485 T486 I487 W532 E566 S567 C584 Y1505	V485-C519 WeakPolarHBondContact CG1-SG 3.38Å; T486-C519 CarbonylContact O-C 3.59Å; T486-C519 WeakPolarHBondContact O-CA 3.4Å; I487-C519 HydrophobicContact CG1-CB 4.04Å; C519-W532 HydrophobicContact CB-CH2 4.25Å; C519-W532 HydrophobicContact CB-CZ2 3.92Å; C519-E566 CarbonylContact O-C 3.47Å; C519-E566 VanDerWaalsContact O-CA 3.25Å; C519-E566 WeakPolarHBondContact O-CA 3.22Å; C519-E566 VanDerWaalsContact O-CG 3.32Å; C519-E566 WeakPolarHBondContact O-CG 3.37Å; C519-S567 PolarHBondContact N-O 2.82Å; C519-S567 PolarHBondContact O-N 2.81Å; C519-C584 HydrophobicContact CB-CB 3.94Å; C519-C584 WeakPolarHBondContact CB-SG 3.46Å; C519-C584 WeakPolarHBondContact SG-CB 3.39Å; C519-C584 CovalentContact SG-SG 2.03Å; C519-C584 PolarHBondContact SG-SG 3.08Å; C519-Y1505 HydrophobicContact CB-CE1 4.09Å; C519-Y1505 WeakPolarHBondContact CB-OH 3.41Å
520	K	87.7	Confident	79.3	Confident	82 Å²	82	54.3 Å²	54.3	36%	0.357	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	147.4	-178.7	-161.9	-168	-168.2	87.2	0	112.7	V485 T486 Q565 E566	V485-K520 CarbonylContact C-O 3.13Å; V485-K520 WeakPolarHBondContact CA-O 3.39Å; T486-K520 PolarHBondContact N-O 2.9Å; T486-K520 PolarHBondContact O-N 2.02Å; T486-K520 PolarHBondContact OG1-O 2.84Å; K520-Q565 CarbonylContact C-O 3.51Å; K520-Q565 WeakPolarHBondContact CA-O 3.28Å; K520-E566 HydrophobicContact CB-CG 4.29Å; K520-E566 HydrophobicContact CG-CB 4.22Å; K520-E566 HydrophobicContact CG-CG 4.23Å; K520-E566 IonicContact NZ-OE2 2.62Å; K520-E566 PolarHBondContact NZ-OE2 3.02Å
521	T	86.5	Confident	79.9	Confident	8 Å²	8	48 Å²	48	5%	0.049	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	154.8	177.5	84.3	0	0	0	0	113.2	I530 Q565 V586	T521-I530 HydrophobicContact CG2-CD1 4.07Å; T521-I530 HydrophobicContact CG2-CG1 4.48Å; T521-Q565 HydrophobicContact CG2-CB 3.92Å; T521-Q565 PolarHBondContact N-O 2.82Å; T521-Q565 PolarHBondContact OG1-N 3.07Å; T521-V586 HydrophobicContact CG2-CG1 3.88Å; T521-V586 HydrophobicContact CG2-CG2 4.07Å
522	A	81.7	Confident	80.7	Confident	14 Å²	14	44.8 Å²	44.8	12%	0.116	25%	0.247	C	C	.	.			trans	-70.5	172.1	162.5	0	0	0	0	0	113	P482 A483 N484	P482-A522 HydrophobicContact CB-CB 4.27Å; P482-A522 WeakPolarHBondContact CB-O 3.5Å; A483-A522 HydrophobicContact CB-CB 4.28Å; N484-A522 PolarHBondContact O-N 2.77Å
523	P	81.2	Confident	81.4	Confident	68 Å²	68	42.1 Å²	42.1	44%	0.442	22%	0.218	S	C	.	.			trans	-63.2	143	170.2	-25.1	36.4	0	0	0	114.6	T557 F563	P523-T557 HydrophobicContact CB-CG2 4.31Å; P523-T557 HydrophobicContact CG-CG2 4.43Å; P523-F563 CarbonylContact C-O 3.46Å; P523-F563 WeakPolarHBondContact CA-O 3.46Å
524	Y	83.1	Confident	81.8	Confident	7 Å²	7	40.5 Å²	40.5	3%	0.027	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-146.4	160.2	-178.2	69.8	-95.8	0	0	0	113.9	P482 A528 F563 Q565	P482-Y524 HydrophobicContact CB-CD1 4.16Å; P482-Y524 HydrophobicContact CG-CD1 4.33Å; Y524-A528 HydrophobicContact CD1-CB 4.24Å; Y524-A528 HydrophobicContact CD2-CB 4.48Å; Y524-A528 HydrophobicContact CE1-CB 3.67Å; Y524-A528 HydrophobicContact CE2-CB 3.98Å; Y524-F563 HydrophobicContact CD1-CB 4.49Å; Y524-F563 WeakPolarHBondContact CD1-O 3.23Å; Y524-F563 HydrophobicContact CD2-CB 4.4Å; Y524-F563 HydrophobicContact CE1-CB 4.05Å; Y524-F563 WeakPolarHBondContact CE1-O 3.23Å; Y524-F563 HydrophobicContact CE2-CB 3.91Å; Y524-F563 PolarHBondContact N-O 2.74Å; Y524-F563 PolarHBondContact O-N 2.68Å; Y524-Q565 HydrophobicContact CE1-CG 4.39Å
525	Y	79.5	Confident	81.9	Confident	66 Å²	66	36.5 Å²	36.5	26%	0.259	19%	0.19	S	C	.	.	S	Bend	trans	-120.1	99	171.8	-173.4	-116.6	0	0	0	111.5	H454 K479 H480 E561	H454-Y525 AromaticContact CE1-CD1 3.52Å; H454-Y525 AromaticContact CE1-CD2 3.7Å; H454-Y525 AromaticContact CE1-CE1 3.87Å; H454-Y525 AromaticContact CE1-CG 3.42Å; H454-Y525 VanDerWaalsContact CE1-CG 3.42Å; K479-Y525 HydrophobicContact CG-CD1 3.84Å; K479-Y525 HydrophobicContact CG-CE1 4.25Å; H480-Y525 PolarHBondContact O-N 3.01Å; Y525-E561 WeakPolarHBondContact CD2-O 3.44Å; Y525-E561 WeakPolarHBondContact CE2-O 3.18Å
526	G	76.5	Confident	81.4	Confident	32 Å²	32	38 Å²	38	33%	0.33	21%	0.207	S	C	.	.	S	Bend	trans	157.1	-132	-175.2	0	0	0	0	0	112.6
527	Q	71.9	Confident	80.4	Confident	146 Å²	146	39.4 Å²	39.4	68%	0.682	22%	0.219	S	C	*	.			trans	-130	151.5	171.7	-62.2	178.4	-16.9	0	0	109.4	S588 V589	Q527-S588 WeakPolarHBondContact O-CA 3.42Å; Q527-S588 PolarHBondContact O-OG 2.81Å; Q527-V589 HydrophobicContact CB-CG2 3.75Å; Q527-V589 HydrophobicContact CG-CG2 4.3Å
528	A	75.6	Confident	78.9	Confident	10 Å²	10	43.1 Å²	43.1	8%	0.083	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	155.6	176.5	0	0	0	0	0	111.8	Y524 Q565 V586 W587	Y524-A528 HydrophobicContact CD1-CB 4.24Å; Y524-A528 HydrophobicContact CD2-CB 4.48Å; Y524-A528 HydrophobicContact CE1-CB 3.67Å; Y524-A528 HydrophobicContact CE2-CB 3.98Å; A528-Q565 PolarHBondContact O-NE2 3.18Å; A528-Q565 PolarHBondContact O-OE1 2.02Å; A528-V586 HydrophobicContact CB-CG1 4.19Å; A528-W587 CarbonylContact C-O 3.57Å; A528-W587 VanDerWaalsContact CA-O 3.25Å; A528-W587 WeakPolarHBondContact CA-O 3.41Å
529	T	81.5	Confident	76.9	Confident	72 Å²	72	46 Å²	46	44%	0.442	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	145.6	175.9	58.7	0	0	0	0	112.8	V586 W587	T529-V586 VanDerWaalsContact O-CA 3.25Å; T529-V586 WeakPolarHBondContact O-CA 3.32Å; T529-W587 PolarHBondContact N-O 2.73Å; T529-W587 VanDerWaalsContact N-O 3.13Å; T529-W587 PolarHBondContact O-N 2.62Å
530	I	84.1	Confident	74.6	Confident	16 Å²	16	50.5 Å²	50.5	8%	0.082	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	148.8	-174.5	-50.7	-175.7	0	0	0	112.9	T521 Q565 C584 L585 V586	T521-I530 HydrophobicContact CG2-CD1 4.07Å; T521-I530 HydrophobicContact CG2-CG1 4.48Å; I530-Q565 HydrophobicContact CD1-CB 3.77Å; I530-Q565 HydrophobicContact CG1-CB 4.38Å; I530-C584 VanDerWaalsContact CG2-SG 3.53Å; I530-L585 WeakPolarHBondContact CA-O 3.45Å; I530-V586 HydrophobicContact CG1-CG2 4.11Å
531	K	82	Confident	72.7	Confident	93 Å²	93	54.6 Å²	54.6	40%	0.404	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	168.7	176.9	-59.8	-176.9	179	176.3	0	114.2	L585	K531-L585 PolarHBondContact N-O 3Å
532	W	82.8	Confident	70.7	Confident	3 Å²	3	60.4 Å²	60.4	1%	0.011	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-142.5	164.9	177.6	-59	78.5	0	0	0	114.2	F517 C519 Q547 L548 S567 I569 Y1505	F517-W532 HydrophobicContact CB-CH2 3.72Å; F517-W532 HydrophobicContact CB-CZ3 3.5Å; F517-W532 HydrophobicContact CG-CZ3 4.49Å; C519-W532 HydrophobicContact CB-CH2 4.25Å; C519-W532 HydrophobicContact CB-CZ2 3.92Å; W532-Q547 WeakPolarHBondContact O-CG 3.43Å; W532-L548 CarbonylContact C-O 3.52Å; W532-L548 HydrophobicContact CB-CB 3.78Å; W532-L548 WeakPolarHBondContact CB-O 3.07Å; W532-L548 PolarHBondContact O-N 3.23Å; W532-L548 VanDerWaalsContact O-O 3.06Å; W532-S567 PolarHBondContact NE1-OG 3.07Å; W532-I569 HydrophobicContact CB-CG2 4.17Å; W532-I569 HydrophobicContact CD2-CB 4.29Å; W532-I569 HydrophobicContact CD2-CD1 4.06Å; W532-I569 HydrophobicContact CD2-CG1 3.96Å; W532-I569 HydrophobicContact CD2-CG2 3.45Å; W532-I569 VanDerWaalsContact CD2-CG2 3.45Å; W532-I569 HydrophobicContact CE3-CB 4.1Å; W532-I569 HydrophobicContact CE3-CD1 3.19Å; W532-I569 HydrophobicContact CE3-CG1 3.28Å; W532-I569 HydrophobicContact CE3-CG2 3.74Å; W532-I569 HydrophobicContact CG-CG2 3.69Å; W532-I569 HydrophobicContact CH2-CG1 4.11Å; W532-I569 HydrophobicContact CZ3-CB 4.48Å; W532-I569 HydrophobicContact CZ3-CD1 3.66Å; W532-I569 HydrophobicContact CZ3-CG1 3.42Å; W532-I569 VanDerWaalsContact CZ3-CG1 3.42Å; W532-I569 HydrophobicContact CZ3-CG2 4.48Å; W532-Y1505 HydrophobicContact CB-CE2 3.9Å; W532-Y1505 AromaticContact CD2-CD2 3.96Å; W532-Y1505 HydrophobicContact CD2-CD2 3.96Å; W532-Y1505 AromaticContact CD2-CE2 3.07Å; W532-Y1505 HydrophobicContact CD2-CE2 3.07Å; W532-Y1505 AromaticContact CD2-CZ 3.39Å; W532-Y1505 VanDerWaalsContact CD2-OH 3.25Å; W532-Y1505 AromaticContact CE2-CE2 3.83Å; W532-Y1505 AromaticContact CE2-CZ 3.63Å; W532-Y1505 HydrophobicContact CE3-CD1 4.5Å; W532-Y1505 AromaticContact CE3-CD2 3.25Å; W532-Y1505 HydrophobicContact CE3-CD2 3.25Å; W532-Y1505 AromaticContact CE3-CE1 3.96Å; W532-Y1505 HydrophobicContact CE3-CE1 3.96Å; W532-Y1505 AromaticContact CE3-CE2 2.79Å; W532-Y1505 HydrophobicContact CE3-CE2 2.79Å; W532-Y1505 HydrophobicContact CE3-CG 4.26Å; W532-Y1505 AromaticContact CE3-CZ 3.18Å; W532-Y1505 HydrophobicContact CG-CD2 4.46Å; W532-Y1505 AromaticContact CG-CE2 3.53Å; W532-Y1505 HydrophobicContact CG-CE2 3.53Å; W532-Y1505 AromaticContact CH2-CE1 3.7Å; W532-Y1505 HydrophobicContact CH2-CE1 3.7Å; W532-Y1505 AromaticContact CH2-CE2 3.98Å; W532-Y1505 HydrophobicContact CH2-CE2 3.98Å; W532-Y1505 AromaticContact CH2-CZ 3.39Å; W532-Y1505 VanDerWaalsContact CH2-OH 3.31Å; W532-Y1505 WeakPolarHBondContact CH2-OH 3.32Å; W532-Y1505 HydrophobicContact CZ2-CE1 4.35Å; W532-Y1505 HydrophobicContact CZ2-CE2 4.25Å; W532-Y1505 AromaticContact CZ2-CZ 3.67Å; W532-Y1505 WeakPolarHBondContact CZ2-OH 3.39Å; W532-Y1505 HydrophobicContact CZ3-CD1 4.09Å; W532-Y1505 AromaticContact CZ3-CD2 3.63Å; W532-Y1505 HydrophobicContact CZ3-CD2 3.63Å; W532-Y1505 AromaticContact CZ3-CE1 3.47Å; W532-Y1505 HydrophobicContact CZ3-CE1 3.47Å; W532-Y1505 VanDerWaalsContact CZ3-CE1 3.47Å; W532-Y1505 AromaticContact CZ3-CE2 3.26Å; W532-Y1505 HydrophobicContact CZ3-CE2 3.26Å; W532-Y1505 HydrophobicContact CZ3-CG 4.22Å; W532-Y1505 AromaticContact CZ3-CZ 3.13Å
533	L	82	Confident	68.9	Low	4 Å²	4	63.7 Å²	63.7	2%	0.021	39%	0.389	C	S	.	.			trans	-155.6	-164.7	174	-57.7	-176	0	0	0	111	Q535 P545 K546 Q547 L548 I582 I1503 V1504	L533-Q535 HydrophobicContact CD1-CG 4.28Å; L533-P545 HydrophobicContact CD1-CB 3.52Å; L533-P545 HydrophobicContact CD1-CG 3.42Å; L533-P545 VanDerWaalsContact CD1-CG 3.42Å; L533-K546 CarbonylContact C-O 3.6Å; L533-K546 WeakPolarHBondContact CA-O 3.22Å; L533-K546 VanDerWaalsContact CB-O 3.3Å; L533-K546 WeakPolarHBondContact CB-O 3.5Å; L533-Q547 HydrophobicContact CD2-CB 3.56Å; L533-Q547 HydrophobicContact CD2-CG 3.91Å; L533-L548 WeakPolarHBondContact O-CD1 3.2Å; L533-I582 CarbonylContact C-O 3.55Å; L533-I582 VanDerWaalsContact CA-O 3.28Å; L533-I582 WeakPolarHBondContact CA-O 3.14Å; L533-I582 PolarHBondContact N-O 3Å; L533-I582 WeakPolarHBondContact O-CG2 3.31Å; L533-I1503 WeakPolarHBondContact CD1-O 3.02Å; L533-I1503 VanDerWaalsContact CG-O 3.28Å; L533-I1503 WeakPolarHBondContact CG-O 3.34Å; L533-V1504 HydrophobicContact CB-CB 3.99Å; L533-V1504 HydrophobicContact CB-CG1 3.35Å; L533-V1504 HydrophobicContact CD1-CB 3.98Å; L533-V1504 HydrophobicContact CD1-CG1 4.15Å; L533-V1504 HydrophobicContact CD2-CG1 4.5Å; L533-V1504 HydrophobicContact CG-CB 3.7Å; L533-V1504 HydrophobicContact CG-CG1 3.31Å; L533-V1504 HydrophobicContact CG-CG2 4.44Å
534	F	82.1	Confident	67.4	Low	45 Å²	45	65.3 Å²	65.3	20%	0.197	40%	0.402	C	S	.	.			trans	-140.1	147.4	149.4	178.9	-91.8	0	0	0	111.8	A536 P545 K546 I571 Y581 I582	F534-A536 HydrophobicContact CE1-CB 4.07Å; F534-P545 WeakPolarHBondContact O-CB 3.42Å; F534-K546 PolarHBondContact N-O 2.84Å; F534-K546 PolarHBondContact O-N 3.2Å; F534-I571 HydrophobicContact CD2-CD1 4.04Å; F534-I571 HydrophobicContact CE2-CG2 4.44Å; F534-Y581 CarbonylContact C-O 3.51Å; F534-I582 HydrophobicContact CB-CG2 3.84Å; F534-I582 HydrophobicContact CD2-CG2 3.51Å; F534-I582 HydrophobicContact CG-CG2 4.08Å
535	Q	76.4	Confident	66.2	Low	36 Å²	36	66.6 Å²	66.6	17%	0.168	41%	0.411	C	S	.	.	B	Isolated β-bridge	trans	-130	115.3	-179.8	-52.4	-160.6	-55	0	0	110.9	L533 P545 S580 Y581 I1503 V1504	L533-Q535 HydrophobicContact CD1-CG 4.28Å; Q535-P545 HydrophobicContact CB-CB 4.43Å; Q535-P545 HydrophobicContact CG-CB 3.9Å; Q535-S580 CarbonylContact O-C 3.15Å; Q535-S580 WeakPolarHBondContact O-CA 3.28Å; Q535-S580 WeakPolarHBondContact O-CB 3.33Å; Q535-Y581 WeakPolarHBondContact CA-O 3.4Å; Q535-Y581 WeakPolarHBondContact CB-O 3.48Å; Q535-Y581 PolarHBondContact N-O 3.26Å; Q535-Y581 PolarHBondContact O-N 2.92Å; Q535-I1503 VanDerWaalsContact NE2-CA 3.28Å; Q535-V1504 VanDerWaalsContact CD-O 3.23Å; Q535-V1504 WeakPolarHBondContact CG-O 3.25Å; Q535-V1504 PolarHBondContact OE1-O 3.33Å; Q535-V1504 VanDerWaalsContact OE1-O 3.04Å
536	A	68	Low	65.7	Low	54 Å²	54	70.2 Å²	70.2	45%	0.446	43%	0.428	S	S	.	.			trans	-87	150.7	-179	0	0	0	0	0	113.6	F534	F534-A536 HydrophobicContact CE1-CB 4.07Å
537	A	62.7	Low	65.5	Low	41 Å²	41	72 Å²	72	34%	0.339	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	151.4	175.8	0	0	0	0	0	114	T539 D578 R579 S580	A537-T539 PolarHBondContact O-N 2.89Å; A537-D578 WeakPolarHBondContact CB-O 3.04Å; A537-R579 HydrophobicContact CB-CB 4.3Å; A537-S580 PolarHBondContact N-OG 3.06Å; A537-S580 VanDerWaalsContact N-OG 3.1Å
538	G	55.7	Low	65.4	Low	88 Å²	88	66.8 Å²	66.8	91%	0.907	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.5	-0.8	164.4	0	0	0	0	0	118.2
539	T	46.5	Very low	64.8	Low	82 Å²	82	72.1 Å²	72.1	50%	0.503	44%	0.436	S	S	.	.			trans	-89.8	129.5	-178.7	49.5	0	0	0	0	113.5	A537 I541 T543	A537-T539 PolarHBondContact O-N 2.89Å; T539-I541 PolarHBondContact O-N 2.88Å; T539-T543 WeakPolarHBondContact CB-OG1 3.28Å; T539-T543 PolarHBondContact OG1-OG1 2.78Å
540	S	40	Very low	64.3	Low	93 Å²	93	72.1 Å²	72.1	65%	0.65	43%	0.433	S	S	*	.			trans	-88.6	99	-178.4	176.8	0	0	0	0	112.7	T542	S540-T542 PolarHBondContact O-N 2.83Å; S540-T542 PolarHBondContact O-OG1 2.86Å
541	I	46.2	Very low	63.8	Low	168 Å²	168	80 Å²	80	86%	0.862	47%	0.467	S	S	*	.	S	Bend	trans	65.5	-24.9	159.5	-59.1	176.5	0	0	0	117	T539	T539-I541 PolarHBondContact O-N 2.88Å
542	T	44.7	Very low	63.6	Low	130 Å²	130	77.9 Å²	77.9	80%	0.798	46%	0.464	S	S	*	.			trans	-99.4	-9.6	-164.7	51.6	0	0	0	0	116.2	S540	S540-T542 PolarHBondContact O-N 2.83Å; S540-T542 PolarHBondContact O-OG1 2.86Å
543	T	44.7	Very low	63.7	Low	83 Å²	83	81.2 Å²	81.2	51%	0.509	48%	0.484	S	S	.	.	S	Bend	trans	-100	107	175.4	39.4	0	0	0	0	110.9	T539	T539-T543 WeakPolarHBondContact CB-OG1 3.28Å; T539-T543 PolarHBondContact OG1-OG1 2.78Å
544	S	49.2	Very low	63.7	Low	103 Å²	103	84.4 Å²	84.4	72%	0.72	50%	0.504	S	S	*	.			trans	-59.2	123.7	170.1	54.4	0	0	0	0	109.4
545	P	58.4	Low	63.7	Low	33 Å²	33	87 Å²	87	21%	0.214	51%	0.513	C	S	.	.			trans	-72.6	150.9	-174.7	33.1	-37.8	0	0	0	110.7	L533 F534 Q535 Q547 G1502	L533-P545 HydrophobicContact CD1-CB 3.52Å; L533-P545 HydrophobicContact CD1-CG 3.42Å; L533-P545 VanDerWaalsContact CD1-CG 3.42Å; F534-P545 WeakPolarHBondContact O-CB 3.42Å; Q535-P545 HydrophobicContact CB-CB 4.43Å; Q535-P545 HydrophobicContact CG-CB 3.9Å; P545-Q547 PolarHBondContact O-N 2.83Å; P545-G1502 WeakPolarHBondContact CD-O 3.1Å; P545-G1502 VanDerWaalsContact CG-C 3.47Å; P545-G1502 WeakPolarHBondContact CG-O 2.97Å
546	K	68.8	Low	63.8	Low	143 Å²	143	91 Å²	91	62%	0.622	53%	0.529	S	S	*	.			trans	-89.9	108	-152.8	177.7	-169.6	173.9	-174.9	0	112.8	L533 F534 L548	L533-K546 CarbonylContact C-O 3.6Å; L533-K546 WeakPolarHBondContact CA-O 3.22Å; L533-K546 VanDerWaalsContact CB-O 3.3Å; L533-K546 WeakPolarHBondContact CB-O 3.5Å; F534-K546 PolarHBondContact N-O 2.84Å; F534-K546 PolarHBondContact O-N 3.2Å; K546-L548 PolarHBondContact O-N 2.81Å
547	Q	71.2	Confident	64.1	Low	69 Å²	69	89.5 Å²	89.5	32%	0.322	52%	0.515	S	S	.	.			trans	-62.5	137.3	-178.8	-161.3	-170.7	-8.2	0	0	112.7	W532 L533 P545 V549	W532-Q547 WeakPolarHBondContact O-CG 3.43Å; L533-Q547 HydrophobicContact CD2-CB 3.56Å; L533-Q547 HydrophobicContact CD2-CG 3.91Å; P545-Q547 PolarHBondContact O-N 2.83Å; Q547-V549 HydrophobicContact CG-CG2 4.35Å
548	L	71.4	Confident	64.3	Low	36 Å²	36	94.3 Å²	94.3	19%	0.188	54%	0.543	C	S	.	.	B	Isolated β-bridge	trans	-112.2	141.1	169.6	-56.1	179.8	0	0	0	108	W532 L533 K546 I569 I571	W532-L548 CarbonylContact C-O 3.52Å; W532-L548 HydrophobicContact CB-CB 3.78Å; W532-L548 WeakPolarHBondContact CB-O 3.07Å; W532-L548 PolarHBondContact O-N 3.23Å; W532-L548 VanDerWaalsContact O-O 3.06Å; L533-L548 WeakPolarHBondContact O-CD1 3.2Å; K546-L548 PolarHBondContact O-N 2.81Å; L548-I569 HydrophobicContact CB-CG2 4.19Å; L548-I569 HydrophobicContact CD1-CD1 3.43Å; L548-I569 VanDerWaalsContact CD1-CD1 3.43Å; L548-I571 HydrophobicContact CD1-CD1 4.41Å
549	V	62.3	Low	64.8	Low	122 Å²	122	92 Å²	92	74%	0.739	51%	0.51	S	S	*	.			trans	-127.3	121.1	-167.7	-178.2	0	0	0	0	109.9	Q547	Q547-V549 HydrophobicContact CG-CG2 4.35Å
550	D	71.6	Confident	65.8	Low	72 Å²	72	89.9 Å²	89.9	39%	0.385	50%	0.504	S	S	.	.			trans	-141.9	167.2	174.4	176.5	47.6	0	0	0	109.8	S567 R568	D550-S567 WeakPolarHBondContact OD2-CA 3.49Å; D550-S567 WeakPolarHBondContact OD2-CB 3.38Å; D550-S567 PolarHBondContact OD2-OG 2.64Å; D550-R568 VanDerWaalsContact CB-O 3.31Å; D550-R568 WeakPolarHBondContact CB-O 3.24Å; D550-R568 PolarHBondContact OD2-N 2.88Å
551	K	73.2	Confident	67.4	Low	183 Å²	183	87.6 Å²	87.6	80%	0.796	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-99.6	117.6	-173.7	-66.2	178.5	-179.5	175.3	0	112.3
552	S	78.8	Confident	68.9	Low	48 Å²	48	80 Å²	80	34%	0.336	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-78	129.1	172.6	60.3	0	0	0	0	113.3	E566	S552-E566 VanDerWaalsContact CA-O 3.28Å; S552-E566 WeakPolarHBondContact CA-O 3.46Å
553	V	83.2	Confident	70.7	Confident	73 Å²	73	76.8 Å²	76.8	44%	0.442	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	144	172	-172	0	0	0	0	110	Y555 Q565 E566	V553-Y555 HydrophobicContact CB-CE2 3.93Å; V553-Y555 HydrophobicContact CG1-CD2 4.44Å; V553-Y555 HydrophobicContact CG1-CE1 4.18Å; V553-Y555 HydrophobicContact CG1-CE2 3.68Å; V553-Y555 WeakPolarHBondContact CG1-OH 3.38Å; V553-Q565 WeakPolarHBondContact O-CA 3.27Å; V553-Q565 WeakPolarHBondContact O-CB 3.1Å; V553-E566 PolarHBondContact N-O 2.88Å; V553-E566 PolarHBondContact O-N 2.91Å
554	T	83.4	Confident	72.8	Confident	70 Å²	70	76.1 Å²	76.1	43%	0.429	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	140.5	176.8	-50.2	0	0	0	0	111.4	Y564 Q565	T554-Y564 CarbonylContact C-O 3.57Å; T554-Y564 WeakPolarHBondContact CA-O 3.35Å; T554-Q565 HydrophobicContact CG2-CG 3.95Å; T554-Q565 WeakPolarHBondContact OG1-CG 3.35Å; T554-Q565 PolarHBondContact OG1-NE2 2.89Å
555	Y	82.1	Confident	74.5	Confident	99 Å²	99	71.6 Å²	71.6	39%	0.388	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	157.5	-178.6	-57.6	-90	0	0	0	110.7	V553 F563 Y564	V553-Y555 HydrophobicContact CB-CE2 3.93Å; V553-Y555 HydrophobicContact CG1-CD2 4.44Å; V553-Y555 HydrophobicContact CG1-CE1 4.18Å; V553-Y555 HydrophobicContact CG1-CE2 3.68Å; V553-Y555 WeakPolarHBondContact CG1-OH 3.38Å; Y555-F563 CarbonylContact O-C 3.58Å; Y555-F563 WeakPolarHBondContact O-CA 3.31Å; Y555-F563 WeakPolarHBondContact O-CB 3.36Å; Y555-Y564 VanDerWaalsContact CB-CE1 3.48Å; Y555-Y564 VanDerWaalsContact CB-CZ 3.41Å; Y555-Y564 AromaticContact CD2-CD2 3.83Å; Y555-Y564 HydrophobicContact CD2-CD2 3.83Å; Y555-Y564 AromaticContact CD2-CE2 3.33Å; Y555-Y564 HydrophobicContact CD2-CE2 3.33Å; Y555-Y564 AromaticContact CD2-CZ 3.79Å; Y555-Y564 HydrophobicContact CE2-CE2 4.07Å; Y555-Y564 HydrophobicContact CG-CD2 4.35Å; Y555-Y564 HydrophobicContact CG-CE1 4.21Å; Y555-Y564 AromaticContact CG-CE2 3.68Å; Y555-Y564 HydrophobicContact CG-CE2 3.68Å; Y555-Y564 AromaticContact CG-CZ 3.6Å; Y555-Y564 PolarHBondContact N-O 2.81Å; Y555-Y564 PolarHBondContact O-N 3.27Å
556	K	77.3	Confident	75.9	Confident	120 Å²	120	72 Å²	72	52%	0.522	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	141.7	176.3	-159.5	177.6	-174.6	-166.8	0	110.1	G560 S562 F563	K556-G560 WeakPolarHBondContact CE-O 3.44Å; K556-G560 PolarHBondContact NZ-O 3.43Å; K556-S562 WeakPolarHBondContact CG-O 3.03Å; K556-F563 HydrophobicContact CB-CD1 4.12Å; K556-F563 HydrophobicContact CB-CE1 4.3Å; K556-F563 HydrophobicContact CD-CD1 4.41Å; K556-F563 HydrophobicContact CD-CE1 3.8Å; K556-F563 HydrophobicContact CD-CZ 4.24Å; K556-F563 HydrophobicContact CG-CD1 3.81Å; K556-F563 HydrophobicContact CG-CE1 3.71Å; K556-F563 HydrophobicContact CG-CZ 4.34Å
557	T	74.7	Confident	76.7	Confident	24 Å²	24	65.4 Å²	65.4	15%	0.147	35%	0.348	C	S	.	.			trans	-83.3	162.7	-175.2	42.5	0	0	0	0	113.5	P523 D559 G560 S562 Y564	P523-T557 HydrophobicContact CB-CG2 4.31Å; P523-T557 HydrophobicContact CG-CG2 4.43Å; T557-D559 WeakPolarHBondContact CB-OD1 3.38Å; T557-D559 PolarHBondContact O-N 2.84Å; T557-D559 PolarHBondContact OG1-OD1 2.93Å; T557-G560 PolarHBondContact O-N 3.28Å; T557-G560 VanDerWaalsContact O-N 3.15Å; T557-S562 PolarHBondContact N-O 2.97Å; T557-S562 VanDerWaalsContact OG1-CA 3.23Å; T557-S562 WeakPolarHBondContact OG1-CA 3.46Å; T557-S562 WeakPolarHBondContact OG1-CB 3Å; T557-S562 PolarHBondContact OG1-N 3.24Å; T557-S562 PolarHBondContact OG1-O 2.85Å; T557-Y564 HydrophobicContact CG2-CD1 4.23Å
558	P	67.2	Low	77.5	Confident	142 Å²	142	67.3 Å²	67.3	92%	0.922	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-20	-176.2	-22.7	35.1	0	0	0	115.2	G560	P558-G560 PolarHBondContact O-N 2.88Å
559	D	66.8	Low	78.1	Confident	39 Å²	39	66.6 Å²	66.6	21%	0.209	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-18.6	172.9	64.6	-7.4	0	0	0	113.2	T557 E561 S562	T557-D559 WeakPolarHBondContact CB-OD1 3.38Å; T557-D559 PolarHBondContact O-N 2.84Å; T557-D559 PolarHBondContact OG1-OD1 2.93Å; D559-E561 PolarHBondContact O-N 3.22Å; D559-E561 PolarHBondContact OD1-N 2.83Å; D559-S562 PolarHBondContact OD1-N 2.85Å; D559-S562 WeakPolarHBondContact OD2-CB 3.32Å; D559-S562 PolarHBondContact OD2-N 2.79Å; D559-S562 PolarHBondContact OD2-OG 2.72Å
560	G	66.7	Low	79	Confident	38 Å²	38	67.5 Å²	67.5	39%	0.392	34%	0.344	S	S	.	.	S	Bend	trans	76.2	2.3	-173.9	0	0	0	0	0	114	K556 T557 P558	K556-G560 WeakPolarHBondContact CE-O 3.44Å; K556-G560 PolarHBondContact NZ-O 3.43Å; T557-G560 PolarHBondContact O-N 3.28Å; T557-G560 VanDerWaalsContact O-N 3.15Å; P558-G560 PolarHBondContact O-N 2.88Å
561	E	73.1	Confident	79.4	Confident	45 Å²	45	65.5 Å²	65.5	21%	0.21	33%	0.333	C	S	.	.	S	Bend	trans	-121.1	-27.1	-169.3	-64.4	-175.3	-129.8	0	0	113	R359 H454 A455 F477 Y525 D559	R359-E561 IonicContact CZ-OE1 3.47Å; R359-E561 IonicContact NH1-OE1 2.88Å; R359-E561 PolarHBondContact NH1-OE1 3.16Å; R359-E561 IonicContact NH2-OE1 3.36Å; R359-E561 PolarHBondContact NH2-OE1 2.95Å; R359-E561 IonicContact NH2-OE2 3.95Å; H454-E561 IonicContact NE2-OE2 3.56Å; A455-E561 WeakPolarHBondContact CB-OE2 3.3Å; F477-E561 WeakPolarHBondContact CE1-OE2 3.43Å; Y525-E561 WeakPolarHBondContact CD2-O 3.44Å; Y525-E561 WeakPolarHBondContact CE2-O 3.18Å; D559-E561 PolarHBondContact O-N 3.22Å; D559-E561 PolarHBondContact OD1-N 2.83Å
562	S	77.8	Confident	79.7	Confident	9 Å²	9	60.4 Å²	60.4	6%	0.063	32%	0.317	C	S	.	.			trans	-113.6	176.1	-177.2	-38.2	0	0	0	0	116.1	K556 T557 D559	K556-S562 WeakPolarHBondContact CG-O 3.03Å; T557-S562 PolarHBondContact N-O 2.97Å; T557-S562 VanDerWaalsContact OG1-CA 3.23Å; T557-S562 WeakPolarHBondContact OG1-CA 3.46Å; T557-S562 WeakPolarHBondContact OG1-CB 3Å; T557-S562 PolarHBondContact OG1-N 3.24Å; T557-S562 PolarHBondContact OG1-O 2.85Å; D559-S562 PolarHBondContact OD1-N 2.85Å; D559-S562 WeakPolarHBondContact OD2-CB 3.32Å; D559-S562 PolarHBondContact OD2-N 2.79Å; D559-S562 PolarHBondContact OD2-OG 2.72Å
563	F	83.9	Confident	79.5	Confident	61 Å²	61	58.7 Å²	58.7	27%	0.268	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	160.5	-171	-54.4	-94.9	0	0	0	115.3	P523 Y524 Y555 K556	P523-F563 CarbonylContact C-O 3.46Å; P523-F563 WeakPolarHBondContact CA-O 3.46Å; Y524-F563 HydrophobicContact CD1-CB 4.49Å; Y524-F563 WeakPolarHBondContact CD1-O 3.23Å; Y524-F563 HydrophobicContact CD2-CB 4.4Å; Y524-F563 HydrophobicContact CE1-CB 4.05Å; Y524-F563 WeakPolarHBondContact CE1-O 3.23Å; Y524-F563 HydrophobicContact CE2-CB 3.91Å; Y524-F563 PolarHBondContact N-O 2.74Å; Y524-F563 PolarHBondContact O-N 2.68Å; Y555-F563 CarbonylContact O-C 3.58Å; Y555-F563 WeakPolarHBondContact O-CA 3.31Å; Y555-F563 WeakPolarHBondContact O-CB 3.36Å; K556-F563 HydrophobicContact CB-CD1 4.12Å; K556-F563 HydrophobicContact CB-CE1 4.3Å; K556-F563 HydrophobicContact CD-CD1 4.41Å; K556-F563 HydrophobicContact CD-CE1 3.8Å; K556-F563 HydrophobicContact CD-CZ 4.24Å; K556-F563 HydrophobicContact CG-CD1 3.81Å; K556-F563 HydrophobicContact CG-CE1 3.71Å; K556-F563 HydrophobicContact CG-CZ 4.34Å
564	Y	87.4	Confident	78.9	Confident	70 Å²	70	62.3 Å²	62.3	28%	0.275	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	168	173.3	73.5	-94.4	0	0	0	115.4	T554 Y555 T557	T554-Y564 CarbonylContact C-O 3.57Å; T554-Y564 WeakPolarHBondContact CA-O 3.35Å; Y555-Y564 VanDerWaalsContact CB-CE1 3.48Å; Y555-Y564 VanDerWaalsContact CB-CZ 3.41Å; Y555-Y564 AromaticContact CD2-CD2 3.83Å; Y555-Y564 HydrophobicContact CD2-CD2 3.83Å; Y555-Y564 AromaticContact CD2-CE2 3.33Å; Y555-Y564 HydrophobicContact CD2-CE2 3.33Å; Y555-Y564 AromaticContact CD2-CZ 3.79Å; Y555-Y564 HydrophobicContact CE2-CE2 4.07Å; Y555-Y564 HydrophobicContact CG-CD2 4.35Å; Y555-Y564 HydrophobicContact CG-CE1 4.21Å; Y555-Y564 AromaticContact CG-CE2 3.68Å; Y555-Y564 HydrophobicContact CG-CE2 3.68Å; Y555-Y564 AromaticContact CG-CZ 3.6Å; Y555-Y564 PolarHBondContact N-O 2.81Å; Y555-Y564 PolarHBondContact O-N 3.27Å; T557-Y564 HydrophobicContact CG2-CD1 4.23Å
565	Q	86.1	Confident	78.1	Confident	8 Å²	8	62.9 Å²	62.9	4%	0.037	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	163.9	-172.8	-64.1	178.4	-24.5	0	0	118.1	K520 T521 Y524 A528 I530 V553 T554	K520-Q565 CarbonylContact C-O 3.51Å; K520-Q565 WeakPolarHBondContact CA-O 3.28Å; T521-Q565 HydrophobicContact CG2-CB 3.92Å; T521-Q565 PolarHBondContact N-O 2.82Å; T521-Q565 PolarHBondContact OG1-N 3.07Å; Y524-Q565 HydrophobicContact CE1-CG 4.39Å; A528-Q565 PolarHBondContact O-NE2 3.18Å; A528-Q565 PolarHBondContact O-OE1 2.02Å; I530-Q565 HydrophobicContact CD1-CB 3.77Å; I530-Q565 HydrophobicContact CG1-CB 4.38Å; V553-Q565 WeakPolarHBondContact O-CA 3.27Å; V553-Q565 WeakPolarHBondContact O-CB 3.1Å; T554-Q565 HydrophobicContact CG2-CG 3.95Å; T554-Q565 WeakPolarHBondContact OG1-CG 3.35Å; T554-Q565 PolarHBondContact OG1-NE2 2.89Å
566	E	87	Confident	77.5	Confident	40 Å²	40	63.9 Å²	63.9	19%	0.187	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	152.8	178.6	-168.1	175.7	138.2	0	0	115.9	C519 K520 S552 V553 R568	C519-E566 CarbonylContact O-C 3.47Å; C519-E566 VanDerWaalsContact O-CA 3.25Å; C519-E566 WeakPolarHBondContact O-CA 3.22Å; C519-E566 VanDerWaalsContact O-CG 3.32Å; C519-E566 WeakPolarHBondContact O-CG 3.37Å; K520-E566 HydrophobicContact CB-CG 4.29Å; K520-E566 HydrophobicContact CG-CB 4.22Å; K520-E566 HydrophobicContact CG-CG 4.23Å; K520-E566 IonicContact NZ-OE2 2.62Å; K520-E566 PolarHBondContact NZ-OE2 3.02Å; S552-E566 VanDerWaalsContact CA-O 3.28Å; S552-E566 WeakPolarHBondContact CA-O 3.46Å; V553-E566 PolarHBondContact N-O 2.88Å; V553-E566 PolarHBondContact O-N 2.91Å; E566-R568 IonicContact OE1-CZ 3.2Å; E566-R568 IonicContact OE1-NE 2.65Å; E566-R568 IonicContact OE1-NH2 3.64Å; E566-R568 PolarHBondContact OE1-NH2 2.86Å
567	S	86	Confident	77.2	Confident	6 Å²	6	59.4 Å²	59.4	4%	0.042	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.7	167.7	179.8	175.4	0	0	0	0	115.6	I518 C519 W532 D550	I518-S567 CarbonylContact C-O 3.44Å; C519-S567 PolarHBondContact N-O 2.82Å; C519-S567 PolarHBondContact O-N 2.81Å; W532-S567 PolarHBondContact NE1-OG 3.07Å; D550-S567 WeakPolarHBondContact OD2-CA 3.49Å; D550-S567 WeakPolarHBondContact OD2-CB 3.38Å; D550-S567 PolarHBondContact OD2-OG 2.64Å
568	R	87.7	Confident	77	Confident	108 Å²	108	60.5 Å²	60.5	41%	0.408	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	156.7	-171.1	-50.3	-171.4	174.1	-134.3	-7.5	118.7	E490 F517 I518 D550 E566	E490-R568 IonicContact OE1-NH1 3.41Å; E490-R568 PolarHBondContact OE1-NH1 3.14Å; F517-R568 CarbonylContact O-C 3.52Å; F517-R568 WeakPolarHBondContact O-CA 3.39Å; I518-R568 HydrophobicContact CB-CG 4.27Å; I518-R568 VanDerWaalsContact CD1-NH1 3.27Å; I518-R568 HydrophobicContact CG1-CG 3.94Å; I518-R568 HydrophobicContact CG2-CG 4.07Å; D550-R568 VanDerWaalsContact CB-O 3.31Å; D550-R568 WeakPolarHBondContact CB-O 3.24Å; D550-R568 PolarHBondContact OD2-N 2.88Å; E566-R568 IonicContact OE1-CZ 3.2Å; E566-R568 IonicContact OE1-NE 2.65Å; E566-R568 IonicContact OE1-NH2 3.64Å; E566-R568 PolarHBondContact OE1-NH2 2.86Å
569	I	84.1	Confident	77.3	Confident	22 Å²	22	59.6 Å²	59.6	11%	0.113	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	176.7	174.2	69.2	164.5	0	0	0	116.7	T516 F517 W532 L548 I571	T516-I569 CarbonylContact C-O 3.6Å; T516-I569 WeakPolarHBondContact CA-O 3.43Å; T516-I569 WeakPolarHBondContact CG2-O 3.49Å; F517-I569 HydrophobicContact CB-CG1 3.99Å; F517-I569 HydrophobicContact CD2-CG1 4.49Å; F517-I569 PolarHBondContact N-O 2.84Å; F517-I569 PolarHBondContact O-N 3.14Å; W532-I569 HydrophobicContact CB-CG2 4.17Å; W532-I569 HydrophobicContact CD2-CB 4.29Å; W532-I569 HydrophobicContact CD2-CD1 4.06Å; W532-I569 HydrophobicContact CD2-CG1 3.96Å; W532-I569 HydrophobicContact CD2-CG2 3.45Å; W532-I569 VanDerWaalsContact CD2-CG2 3.45Å; W532-I569 HydrophobicContact CE3-CB 4.1Å; W532-I569 HydrophobicContact CE3-CD1 3.19Å; W532-I569 HydrophobicContact CE3-CG1 3.28Å; W532-I569 HydrophobicContact CE3-CG2 3.74Å; W532-I569 HydrophobicContact CG-CG2 3.69Å; W532-I569 HydrophobicContact CH2-CG1 4.11Å; W532-I569 HydrophobicContact CZ3-CB 4.48Å; W532-I569 HydrophobicContact CZ3-CD1 3.66Å; W532-I569 HydrophobicContact CZ3-CG1 3.42Å; W532-I569 VanDerWaalsContact CZ3-CG1 3.42Å; W532-I569 HydrophobicContact CZ3-CG2 4.48Å; L548-I569 HydrophobicContact CB-CG2 4.19Å; L548-I569 HydrophobicContact CD1-CD1 3.43Å; L548-I569 VanDerWaalsContact CD1-CD1 3.43Å; I569-I571 HydrophobicContact CD1-CD1 3.92Å; I569-I571 HydrophobicContact CD1-CG1 4.3Å
570	Q	81.6	Confident	77.9	Confident	140 Å²	140	57.8 Å²	57.8	65%	0.654	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.3	148.2	174.6	-68.1	-177	-37.4	0	0	116.4	K515 T516	K515-Q570 CarbonylContact O-C 3.5Å; K515-Q570 WeakPolarHBondContact O-CA 3.34Å; T516-Q570 HydrophobicContact CG2-CG 3.67Å; T516-Q570 PolarHBondContact OG1-NE2 3.48Å
571	I	79.2	Confident	78.8	Confident	30 Å²	30	58.5 Å²	58.5	15%	0.154	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	158.6	-173.1	-61	179.5	0	0	0	113.3	M514 K515 F517 F534 L548 I569 I582	M514-I571 WeakPolarHBondContact CA-O 3.34Å; M514-I571 WeakPolarHBondContact CG-O 3.32Å; K515-I571 PolarHBondContact N-O 2.87Å; K515-I571 PolarHBondContact O-N 2.79Å; F517-I571 HydrophobicContact CE2-CB 4.49Å; F517-I571 HydrophobicContact CE2-CD1 4.35Å; F534-I571 HydrophobicContact CD2-CD1 4.04Å; F534-I571 HydrophobicContact CE2-CG2 4.44Å; L548-I571 HydrophobicContact CD1-CD1 4.41Å; I569-I571 HydrophobicContact CD1-CD1 3.92Å; I569-I571 HydrophobicContact CD1-CG1 4.3Å; I571-I582 HydrophobicContact CD1-CG2 3.65Å
572	T	78.8	Confident	79.3	Confident	76 Å²	76	56.6 Å²	56.6	47%	0.466	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	146.4	172.6	-46	0	0	0	0	111.6	E513 M514	E513-T572 CarbonylContact O-C 3.54Å; E513-T572 WeakPolarHBondContact O-CA 3.06Å; E513-T572 WeakPolarHBondContact O-CG2 3.22Å; M514-T572 HydrophobicContact CB-CG2 4.26Å; M514-T572 WeakPolarHBondContact CE-OG1 3.33Å
573	V	74.5	Confident	79.7	Confident	13 Å²	13	56.2 Å²	56.2	8%	0.079	26%	0.259	C	S	.	.			trans	-120.8	142.8	-164.2	-176.4	0	0	0	0	113.7	A509 G512 E513 D577 L600	A509-V573 HydrophobicContact CB-CB 4.23Å; A509-V573 HydrophobicContact CB-CG1 3.89Å; A509-V573 HydrophobicContact CB-CG2 4.45Å; G512-V573 CarbonylContact C-O 3.54Å; G512-V573 WeakPolarHBondContact CA-O 3.38Å; G512-V573 PolarHBondContact N-O 2.99Å; E513-V573 PolarHBondContact N-O 3.24Å; E513-V573 PolarHBondContact O-N 3.03Å; V573-D577 HydrophobicContact CG1-CB 4.38Å; V573-L600 HydrophobicContact CG1-CD1 3.94Å; V573-L600 HydrophobicContact CG1-CD2 4.4Å; V573-L600 HydrophobicContact CG2-CD1 4.45Å; V573-L600 HydrophobicContact CG2-CD2 4.39Å
574	R	72.2	Confident	79.8	Confident	148 Å²	148	53.3 Å²	53.3	56%	0.558	25%	0.246	S	C	*	.			trans	-133.8	167	-175.7	-49.9	-175.9	-177.3	-177.9	1.4	112.1	E576 D577	R574-E576 HydrophobicContact CB-CG 4.2Å; R574-E576 VanDerWaalsContact CB-OE2 3.3Å; R574-E576 WeakPolarHBondContact CB-OE2 3.42Å; R574-E576 VanDerWaalsContact CD-CD 3.49Å; R574-E576 WeakPolarHBondContact CD-OE1 3.41Å; R574-E576 IonicContact CZ-OE1 3.79Å; R574-E576 IonicContact NE-OE1 3.84Å; R574-E576 IonicContact NH1-OE1 2.91Å; R574-E576 PolarHBondContact NH1-OE1 2.87Å; R574-E576 PolarHBondContact O-N 3.02Å; R574-D577 VanDerWaalsContact CB-OD2 3.26Å; R574-D577 WeakPolarHBondContact CB-OD2 3.42Å; R574-D577 WeakPolarHBondContact CG-OD2 3.44Å; R574-D577 PolarHBondContact N-OD2 3.35Å; R574-D577 WeakPolarHBondContact O-CB 3.42Å; R574-D577 PolarHBondContact O-N 3.13Å; R574-D577 VanDerWaalsContact O-N 3.09Å
575	P	66.8	Low	79.7	Confident	83 Å²	83	50.5 Å²	50.5	54%	0.539	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-68.3	-23.9	178	27.4	-30.6	0	0	0	112.8	A511 D577	A511-P575 HydrophobicContact CB-CB 4.07Å; A511-P575 HydrophobicContact CB-CG 4.08Å; P575-D577 VanDerWaalsContact C-N 3.29Å
576	E	68.8	Low	79.6	Confident	120 Å²	120	50.1 Å²	50.1	56%	0.561	23%	0.234	S	C	*	.	G	3₁₀ helix	trans	-75.5	-9.9	171.2	67.4	-94.4	-150.2	0	0	114.7	R574 D578	R574-E576 HydrophobicContact CB-CG 4.2Å; R574-E576 VanDerWaalsContact CB-OE2 3.3Å; R574-E576 WeakPolarHBondContact CB-OE2 3.42Å; R574-E576 VanDerWaalsContact CD-CD 3.49Å; R574-E576 WeakPolarHBondContact CD-OE1 3.41Å; R574-E576 IonicContact CZ-OE1 3.79Å; R574-E576 IonicContact NE-OE1 3.84Å; R574-E576 IonicContact NH1-OE1 2.91Å; R574-E576 PolarHBondContact NH1-OE1 2.87Å; R574-E576 PolarHBondContact O-N 3.02Å; E576-D578 VanDerWaalsContact C-N 3.31Å
577	D	71	Confident	79.2	Confident	26 Å²	26	52.2 Å²	52.2	14%	0.139	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-86.5	-0.3	176.7	-63	-51.9	0	0	0	113	V573 R574 P575 R579 S580 L600	V573-D577 HydrophobicContact CG1-CB 4.38Å; R574-D577 VanDerWaalsContact CB-OD2 3.26Å; R574-D577 WeakPolarHBondContact CB-OD2 3.42Å; R574-D577 WeakPolarHBondContact CG-OD2 3.44Å; R574-D577 PolarHBondContact N-OD2 3.35Å; R574-D577 WeakPolarHBondContact O-CB 3.42Å; R574-D577 PolarHBondContact O-N 3.13Å; R574-D577 VanDerWaalsContact O-N 3.09Å; P575-D577 VanDerWaalsContact C-N 3.29Å; D577-R579 PolarHBondContact O-N 2.82Å; D577-S580 VanDerWaalsContact O-CB 3.27Å; D577-S580 WeakPolarHBondContact O-CB 3.27Å; D577-S580 PolarHBondContact O-N 2.79Å; D577-S580 PolarHBondContact O-OG 2.96Å; D577-L600 HydrophobicContact CB-CD1 3.88Å; D577-L600 WeakPolarHBondContact O-CD1 3.37Å
578	D	69.7	Low	78.5	Confident	46 Å²	46	52.5 Å²	52.5	25%	0.246	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-45.2	124	-179.2	-174.3	29.3	0	0	0	111.7	A537 E576 D601	A537-D578 WeakPolarHBondContact CB-O 3.04Å; E576-D578 VanDerWaalsContact C-N 3.31Å; D578-D601 WeakPolarHBondContact OD1-CA 3.45Å; D578-D601 PolarHBondContact OD1-N 2.74Å
579	R	74.1	Confident	77.4	Confident	123 Å²	123	51.9 Å²	51.9	46%	0.464	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.5	37.1	180	-45	177.5	-178.5	-154	-18.6	117.8	A537 D577 Y581 R599 L600 D601	A537-R579 HydrophobicContact CB-CB 4.3Å; D577-R579 PolarHBondContact O-N 2.82Å; R579-Y581 WeakPolarHBondContact O-CE2 3.47Å; R579-R599 HydrophobicContact CB-CG 4.34Å; R579-L600 WeakPolarHBondContact CA-O 3.4Å; R579-L600 PolarHBondContact N-O 2.73Å; R579-D601 IonicContact CZ-OD1 2.66Å; R579-D601 IonicContact NE-OD1 3.19Å; R579-D601 IonicContact NH2-OD1 3.67Å; R579-D601 PolarHBondContact NH2-OD1 2.86Å
580	S	80.1	Confident	76.2	Confident	2 Å²	2	54.3 Å²	54.3	1%	0.014	28%	0.281	C	S	.	.			trans	-104.3	157.3	-179.5	-57.3	0	0	0	0	116.4	Q535 A537 D577 V598 R599	Q535-S580 CarbonylContact O-C 3.15Å; Q535-S580 WeakPolarHBondContact O-CA 3.28Å; Q535-S580 WeakPolarHBondContact O-CB 3.33Å; A537-S580 PolarHBondContact N-OG 3.06Å; A537-S580 VanDerWaalsContact N-OG 3.1Å; D577-S580 VanDerWaalsContact O-CB 3.27Å; D577-S580 WeakPolarHBondContact O-CB 3.27Å; D577-S580 PolarHBondContact O-N 2.79Å; D577-S580 PolarHBondContact O-OG 2.96Å; S580-V598 VanDerWaalsContact O-O 3.12Å; S580-R599 CarbonylContact O-C 3.59Å; S580-R599 VanDerWaalsContact O-CA 3.25Å; S580-R599 WeakPolarHBondContact O-CA 3.37Å
581	Y	83.9	Confident	74.9	Confident	53 Å²	53	54 Å²	54	21%	0.208	28%	0.284	C	S	.	.	B	Isolated β-bridge	trans	-137.9	169.2	-165.3	-43.6	-108	0	0	0	116.4	F534 Q535 R579 R597 V598 R599 V1504	F534-Y581 CarbonylContact C-O 3.51Å; Q535-Y581 WeakPolarHBondContact CA-O 3.4Å; Q535-Y581 WeakPolarHBondContact CB-O 3.48Å; Q535-Y581 PolarHBondContact N-O 3.26Å; Q535-Y581 PolarHBondContact O-N 2.92Å; R579-Y581 WeakPolarHBondContact O-CE2 3.47Å; Y581-R597 HydrophobicContact CD1-CG 3.38Å; Y581-R597 HydrophobicContact CE1-CG 3.95Å; Y581-R597 HydrophobicContact CG-CG 4.32Å; Y581-V598 WeakPolarHBondContact CA-O 3.37Å; Y581-V598 WeakPolarHBondContact CB-O 3.44Å; Y581-V598 WeakPolarHBondContact CD1-O 3Å; Y581-R599 HydrophobicContact CD1-CB 4.49Å; Y581-R599 HydrophobicContact CE1-CB 4.07Å; Y581-R599 HydrophobicContact CE1-CG 3.99Å; Y581-R599 WeakPolarHBondContact OH-CD 3.41Å; Y581-V1504 CarbonylContact C-O 3.58Å
582	I	85	Confident	73.7	Confident	5 Å²	5	54.6 Å²	54.6	3%	0.026	29%	0.293	C	S	.	.			trans	-138.5	0	-167.5	32.5	146.7	0	0	0	134.2	F517 L533 F534 I571 V598 V1504 Y1505	F517-I582 HydrophobicContact CD1-CD1 3.79Å; F517-I582 HydrophobicContact CD2-CD1 4.22Å; F517-I582 HydrophobicContact CE1-CD1 3.62Å; F517-I582 HydrophobicContact CE2-CD1 4.07Å; F517-I582 HydrophobicContact CG-CD1 4.1Å; F517-I582 HydrophobicContact CZ-CD1 3.78Å; L533-I582 CarbonylContact C-O 3.55Å; L533-I582 VanDerWaalsContact CA-O 3.28Å; L533-I582 WeakPolarHBondContact CA-O 3.14Å; L533-I582 PolarHBondContact N-O 3Å; L533-I582 WeakPolarHBondContact O-CG2 3.31Å; F534-I582 HydrophobicContact CB-CG2 3.84Å; F534-I582 HydrophobicContact CD2-CG2 3.51Å; F534-I582 HydrophobicContact CG-CG2 4.08Å; I571-I582 HydrophobicContact CD1-CG2 3.65Å; I582-V598 HydrophobicContact CD1-CB 4.49Å; I582-V598 HydrophobicContact CD1-CG1 4.47Å; I582-V598 HydrophobicContact CD1-CG2 4.42Å; I582-V598 HydrophobicContact CG1-CB 4.2Å; I582-V598 HydrophobicContact CG1-CG1 4.36Å; I582-V1504 VanDerWaalsContact C-CA 3.46Å; I582-V1504 VanDerWaalsContact C-CB 3.49Å; I582-V1504 CarbonylContact C-O 3.6Å; I582-V1504 WeakPolarHBondContact CA-O 3.21Å; I582-V1504 PolarHBondContact N-O 2.89Å; I582-V1504 WeakPolarHBondContact O-CG1 3.27Å; I582-Y1505 VanDerWaalsContact C-CG 3.47Å; I582-Y1505 VanDerWaalsContact CA-CA 3.47Å; I582-Y1505 VanDerWaalsContact CB-CB 3.41Å; I582-Y1505 HydrophobicContact CB-CD2 4.18Å; I582-Y1505 HydrophobicContact CB-CG 4.19Å; I582-Y1505 HydrophobicContact CD1-CG 4.28Å; I582-Y1505 HydrophobicContact CG1-CG 4.31Å; I582-Y1505 PolarHBondContact N-O 2.82Å; I582-Y1505 WeakPolarHBondContact O-CD2 3.47Å
583	D	86.4	Confident	73.2	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.284	C	S	.	.				0	132.5	0	-48.1	-36.2	0	0	0	115.9	L585 R593 D595 S596 R597 V1504 Y1505	D583-L585 HydrophobicContact CB-CD2 3.7Å; D583-L585 PolarHBondContact O-N 2.86Å; D583-L585 WeakPolarHBondContact OD2-CD2 3.32Å; D583-R593 IonicContact OD2-CZ 2.59Å; D583-R593 IonicContact OD2-NH1 2.73Å; D583-R593 IonicContact OD2-NH2 2.67Å; D583-R593 PolarHBondContact OD2-NH2 2.82Å; D583-D595 HydrophobicContact CB-CB 4.44Å; D583-S596 VanDerWaalsContact CG-O 3.3Å; D583-R597 IonicContact OD1-CZ 2.81Å; D583-R597 IonicContact OD1-NE 2.68Å; D583-R597 PolarHBondContact OD1-NE 2.87Å; D583-R597 IonicContact OD1-NH2 2.63Å; D583-R597 PolarHBondContact OD1-NH2 2.87Å; D583-R597 IonicContact OD2-NH2 3.55Å; D583-R597 PolarHBondContact OD2-NH2 2.81Å; D583-V1504 VanDerWaalsContact CA-CG1 3.45Å; D583-V1504 HydrophobicContact CB-CB 3.4Å; D583-V1504 HydrophobicContact CB-CG1 4.14Å; D583-V1504 HydrophobicContact CB-CG2 3.37Å; D583-V1504 WeakPolarHBondContact O-CG1 3.36Å; D583-V1504 WeakPolarHBondContact O-CG2 3.33Å; D583-V1504 VanDerWaalsContact OD2-CA 3.24Å; D583-V1504 WeakPolarHBondContact OD2-CA 3.32Å; D583-Y1505 HydrophobicContact CB-CG 4.4Å; D583-Y1505 VanDerWaalsContact CB-N 3.27Å; D583-Y1505 VanDerWaalsContact O-CE2 3.26Å; D583-Y1505 WeakPolarHBondContact O-CE2 3.37Å; D583-Y1505 WeakPolarHBondContact OD1-CA 3.35Å; D583-Y1505 PolarHBondContact OD1-N 2.97Å
584	C	86.4	Confident	73	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.29	C	S	.	.			trans	-73.7	85.6	166.6	-154.8	0	0	0	0	107	V485 I487 C519 I530 V586 D595 Y1505	V485-C584 HydrophobicContact CG1-CB 3.83Å; V485-C584 VanDerWaalsContact CG1-SG 3.59Å; I487-C584 HydrophobicContact CD1-CB 3.59Å; I487-C584 HydrophobicContact CG1-CB 4.02Å; C519-C584 HydrophobicContact CB-CB 3.94Å; C519-C584 WeakPolarHBondContact CB-SG 3.46Å; C519-C584 WeakPolarHBondContact SG-CB 3.39Å; C519-C584 CovalentContact SG-SG 2.03Å; C519-C584 PolarHBondContact SG-SG 3.08Å; I530-C584 VanDerWaalsContact CG2-SG 3.53Å; C584-V586 PolarHBondContact O-N 3.17Å; C584-D595 WeakPolarHBondContact O-CA 3.24Å; C584-Y1505 WeakPolarHBondContact CA-OH 3.39Å; C584-Y1505 HydrophobicContact CB-CD1 4.05Å; C584-Y1505 HydrophobicContact CB-CE1 3.31Å; C584-Y1505 HydrophobicContact CB-CE2 4.16Å; C584-Y1505 WeakPolarHBondContact CB-OH 3.41Å; C584-Y1505 VanDerWaalsContact N-CD2 3.32Å; C584-Y1505 PolarHBondContact SG-OH 2.78Å
585	L	84.9	Confident	73.2	Confident	11 Å²	11	51.6 Å²	51.6	6%	0.058	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	111.1	164.5	-56.4	-157	0	0	0	107.4	I530 K531 D583 W587 R593 D595 I1503 V1504	I530-L585 WeakPolarHBondContact CA-O 3.45Å; K531-L585 PolarHBondContact N-O 3Å; D583-L585 HydrophobicContact CB-CD2 3.7Å; D583-L585 PolarHBondContact O-N 2.86Å; D583-L585 WeakPolarHBondContact OD2-CD2 3.32Å; L585-W587 VanDerWaalsContact CB-NE1 3.31Å; L585-W587 HydrophobicContact CD1-CZ2 3.67Å; L585-W587 VanDerWaalsContact CD1-NE1 3.32Å; L585-R593 HydrophobicContact CD1-CG 4.41Å; L585-R593 HydrophobicContact CD2-CG 4.02Å; L585-D595 HydrophobicContact CD2-CB 3.57Å; L585-I1503 HydrophobicContact CD1-CG2 3.77Å; L585-I1503 HydrophobicContact CD2-CG2 4.43Å; L585-I1503 HydrophobicContact CG-CG2 4.49Å; L585-V1504 HydrophobicContact CD1-CG2 3.96Å; L585-V1504 HydrophobicContact CD2-CG2 3.62Å; L585-V1504 HydrophobicContact CG-CG2 3.42Å; L585-V1504 VanDerWaalsContact CG-CG2 3.42Å
586	V	83.1	Confident	73.9	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	110.6	164.4	-172.1	0	0	0	0	107.7	P482 V485 T521 A528 T529 I530 C584 R593 I594	P482-V586 HydrophobicContact CG-CG1 4.27Å; V485-V586 HydrophobicContact CB-CG2 4.21Å; V485-V586 HydrophobicContact CG1-CG2 3.67Å; V485-V586 HydrophobicContact CG2-CB 3.69Å; V485-V586 HydrophobicContact CG2-CG1 4.33Å; V485-V586 HydrophobicContact CG2-CG2 3.43Å; V485-V586 VanDerWaalsContact CG2-CG2 3.43Å; T521-V586 HydrophobicContact CG2-CG1 3.88Å; T521-V586 HydrophobicContact CG2-CG2 4.07Å; A528-V586 HydrophobicContact CB-CG1 4.19Å; T529-V586 VanDerWaalsContact O-CA 3.25Å; T529-V586 WeakPolarHBondContact O-CA 3.32Å; I530-V586 HydrophobicContact CG1-CG2 4.11Å; C584-V586 PolarHBondContact O-N 3.17Å; V586-R593 WeakPolarHBondContact O-CA 3.31Å; V586-I594 PolarHBondContact N-O 2.88Å; V586-I594 PolarHBondContact O-N 2.8Å
587	W	78.7	Confident	74.5	Confident	84 Å²	84	44.7 Å²	44.7	32%	0.318	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	122.3	179.3	-68	84.1	0	0	0	109.6	A528 T529 L585 D591 R593	A528-W587 CarbonylContact C-O 3.57Å; A528-W587 VanDerWaalsContact CA-O 3.25Å; A528-W587 WeakPolarHBondContact CA-O 3.41Å; T529-W587 PolarHBondContact N-O 2.73Å; T529-W587 VanDerWaalsContact N-O 3.13Å; T529-W587 PolarHBondContact O-N 2.62Å; L585-W587 VanDerWaalsContact CB-NE1 3.31Å; L585-W587 HydrophobicContact CD1-CZ2 3.67Å; L585-W587 VanDerWaalsContact CD1-NE1 3.32Å; W587-D591 HydrophobicContact CE3-CB 4.46Å; W587-D591 HydrophobicContact CZ3-CB 4.15Å; W587-R593 HydrophobicContact CD2-CB 4.19Å; W587-R593 HydrophobicContact CE3-CB 4.04Å; W587-R593 HydrophobicContact CH2-CB 3.97Å; W587-R593 HydrophobicContact CH2-CG 4.5Å; W587-R593 HydrophobicContact CZ2-CB 4.13Å; W587-R593 HydrophobicContact CZ2-CG 4.26Å; W587-R593 HydrophobicContact CZ3-CB 3.93Å
588	S	72.6	Confident	75.1	Confident	12 Å²	12	43.6 Å²	43.6	8%	0.084	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	170.5	171.3	-159.7	0	0	0	0	112.4	Q527 G590 D591 A592	Q527-S588 WeakPolarHBondContact O-CA 3.42Å; Q527-S588 PolarHBondContact O-OG 2.81Å; S588-G590 PolarHBondContact O-N 2.8Å; S588-D591 PolarHBondContact O-N 3.36Å; S588-A592 PolarHBondContact N-O 3.02Å
589	V	64.3	Low	75.7	Confident	95 Å²	95	42.3 Å²	42.3	58%	0.576	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.3	120.7	-176.7	-175.9	0	0	0	0	110.2	Q527	Q527-V589 HydrophobicContact CB-CG2 3.75Å; Q527-V589 HydrophobicContact CG-CG2 4.3Å
590	G	57.8	Low	75.6	Confident	74 Å²	74	37.3 Å²	37.3	76%	0.763	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	104.7	19.4	-173.6	0	0	0	0	0	114.5	S588 A592	S588-G590 PolarHBondContact O-N 2.8Å; G590-A592 PolarHBondContact O-N 2.73Å; G590-A592 VanDerWaalsContact O-N 3.07Å
591	D	55.7	Low	75.4	Confident	133 Å²	133	39.1 Å²	39.1	71%	0.711	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.3	23.3	-179.1	-69.5	-21.5	0	0	0	115	W587 S588 R593	W587-D591 HydrophobicContact CE3-CB 4.46Å; W587-D591 HydrophobicContact CZ3-CB 4.15Å; S588-D591 PolarHBondContact O-N 3.36Å; D591-R593 PolarHBondContact O-N 3.02Å
592	A	53.3	Low	74.8	Confident	42 Å²	42	41.8 Å²	41.8	35%	0.347	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	84.5	164.3	0	0	0	0	0	109.6	S588 G590 I594	S588-A592 PolarHBondContact N-O 3.02Å; G590-A592 PolarHBondContact O-N 2.73Å; G590-A592 VanDerWaalsContact O-N 3.07Å; A592-I594 PolarHBondContact O-N 3.09Å
593	R	68.1	Low	74.1	Confident	72 Å²	72	46.1 Å²	46.1	27%	0.272	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	116.2	162.6	169	-169.6	149	136.5	8.6	108.2	D583 L585 V586 W587 D591 D595	D583-R593 IonicContact OD2-CZ 2.59Å; D583-R593 IonicContact OD2-NH1 2.73Å; D583-R593 IonicContact OD2-NH2 2.67Å; D583-R593 PolarHBondContact OD2-NH2 2.82Å; L585-R593 HydrophobicContact CD1-CG 4.41Å; L585-R593 HydrophobicContact CD2-CG 4.02Å; V586-R593 WeakPolarHBondContact O-CA 3.31Å; W587-R593 HydrophobicContact CD2-CB 4.19Å; W587-R593 HydrophobicContact CE3-CB 4.04Å; W587-R593 HydrophobicContact CH2-CB 3.97Å; W587-R593 HydrophobicContact CH2-CG 4.5Å; W587-R593 HydrophobicContact CZ2-CB 4.13Å; W587-R593 HydrophobicContact CZ2-CG 4.26Å; W587-R593 HydrophobicContact CZ3-CB 3.93Å; D591-R593 PolarHBondContact O-N 3.02Å; R593-D595 HydrophobicContact CG-CB 4.31Å; R593-D595 IonicContact CZ-OD1 3.75Å; R593-D595 IonicContact CZ-OD2 3.61Å; R593-D595 IonicContact NE-OD1 3.27Å; R593-D595 PolarHBondContact NE-OD1 2.81Å; R593-D595 IonicContact NE-OD2 3.21Å; R593-D595 IonicContact NH2-OD1 3.24Å; R593-D595 PolarHBondContact NH2-OD1 2.73Å; R593-D595 IonicContact NH2-OD2 2.72Å; R593-D595 PolarHBondContact NH2-OD2 3.23Å
594	I	70.2	Confident	73.2	Confident	40 Å²	40	51 Å²	51	21%	0.205	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	123.4	167.5	-59.8	151.2	0	0	0	107.2	A481 P482 V485 V586 A592	A481-I594 HydrophobicContact CB-CD1 4.05Å; P482-I594 HydrophobicContact CG-CD1 3.79Å; P482-I594 WeakPolarHBondContact O-CD1 3.35Å; V485-I594 HydrophobicContact CB-CG2 3.98Å; V485-I594 HydrophobicContact CG2-CB 3.93Å; V485-I594 HydrophobicContact CG2-CG2 3.49Å; V485-I594 VanDerWaalsContact CG2-CG2 3.49Å; V586-I594 PolarHBondContact N-O 2.88Å; V586-I594 PolarHBondContact O-N 2.8Å; A592-I594 PolarHBondContact O-N 3.09Å
595	D	76.7	Confident	71.8	Confident	62 Å²	62	54.5 Å²	54.5	33%	0.332	30%	0.301	S	S	.	.			trans	-147.9	-161.6	-175.8	76.6	-85.1	0	0	0	113.1	D583 C584 L585 R593	D583-D595 HydrophobicContact CB-CB 4.44Å; C584-D595 WeakPolarHBondContact O-CA 3.24Å; L585-D595 HydrophobicContact CD2-CB 3.57Å; R593-D595 HydrophobicContact CG-CB 4.31Å; R593-D595 IonicContact CZ-OD1 3.75Å; R593-D595 IonicContact CZ-OD2 3.61Å; R593-D595 IonicContact NE-OD1 3.27Å; R593-D595 PolarHBondContact NE-OD1 2.81Å; R593-D595 IonicContact NE-OD2 3.21Å; R593-D595 IonicContact NH2-OD1 3.24Å; R593-D595 PolarHBondContact NH2-OD1 2.73Å; R593-D595 IonicContact NH2-OD2 2.72Å; R593-D595 PolarHBondContact NH2-OD2 3.23Å
596	S	80.7	Confident	71.1	Confident	10 Å²	10	55.4 Å²	55.4	7%	0.07	31%	0.307	C	S	.	.			trans	174.6	135.7	-142.4	-122.3	0	0	0	0	108.8	I487 D583 Y1505 S1506 S1507	I487-S596 VanDerWaalsContact CD1-OG 3.25Å; I487-S596 WeakPolarHBondContact CD1-OG 3.41Å; D583-S596 VanDerWaalsContact CG-O 3.3Å; S596-Y1505 CarbonylContact O-C 3.52Å; S596-Y1505 VanDerWaalsContact O-CA 3.23Å; S596-Y1505 WeakPolarHBondContact O-CA 3.33Å; S596-S1506 VanDerWaalsContact C-CA 3.43Å; S596-S1506 PolarHBondContact O-N 3.39Å; S596-S1507 VanDerWaalsContact CB-N 3.27Å; S596-S1507 VanDerWaalsContact OG-CA 3.31Å; S596-S1507 WeakPolarHBondContact OG-CA 3.33Å; S596-S1507 WeakPolarHBondContact OG-CB 3.3Å; S596-S1507 PolarHBondContact OG-N 3.16Å
597	R	82.3	Confident	70.9	Confident	49 Å²	49	58.9 Å²	58.9	19%	0.185	33%	0.326	C	S	.	.			trans	-141.9	124.1	-170.2	-178	153.4	-71.6	-95.4	-19.2	120.2	E504 K505 Y581 D583 V1504 Y1505 S1506	E504-R597 CarbonylContact C-O 3.49Å; E504-R597 WeakPolarHBondContact CA-O 3.28Å; E504-R597 HydrophobicContact CG-CG 4.5Å; K505-R597 PolarHBondContact N-O 3.03Å; Y581-R597 HydrophobicContact CD1-CG 3.38Å; Y581-R597 HydrophobicContact CE1-CG 3.95Å; Y581-R597 HydrophobicContact CG-CG 4.32Å; D583-R597 IonicContact OD1-CZ 2.81Å; D583-R597 IonicContact OD1-NE 2.68Å; D583-R597 PolarHBondContact OD1-NE 2.87Å; D583-R597 IonicContact OD1-NH2 2.63Å; D583-R597 PolarHBondContact OD1-NH2 2.87Å; D583-R597 IonicContact OD2-NH2 3.55Å; D583-R597 PolarHBondContact OD2-NH2 2.81Å; R597-V1504 PolarHBondContact NH2-O 2.68Å; R597-Y1505 CarbonylContact C-O 3.54Å; R597-Y1505 VanDerWaalsContact C-O 3.29Å; R597-Y1505 WeakPolarHBondContact CA-O 3.46Å; R597-S1506 VanDerWaalsContact C-C 3.41Å; R597-S1506 CarbonylContact C-O 3.54Å; R597-S1506 VanDerWaalsContact CA-N 3.28Å; R597-S1506 WeakPolarHBondContact CA-O 3.29Å; R597-S1506 VanDerWaalsContact N-N 3.16Å; R597-S1506 PolarHBondContact N-O 2.04Å; R597-S1506 VanDerWaalsContact N-O 3.15Å
598	V	82.4	Confident	71	Confident	3 Å²	3	60 Å²	60	2%	0.018	34%	0.337	C	S	.	.			trans	-110.8	150.9	-167.1	158.2	0	0	0	0	112.1	K505 A507 F517 S580 Y581 I582 Y1505 S1506	K505-V598 VanDerWaalsContact C-CA 3.49Å; K505-V598 HydrophobicContact CB-CB 4.35Å; K505-V598 HydrophobicContact CB-CG2 3.66Å; K505-V598 CarbonylContact O-C 3.05Å; K505-V598 WeakPolarHBondContact O-CA 3.42Å; K505-V598 WeakPolarHBondContact O-CB 3.38Å; K505-V598 WeakPolarHBondContact O-CG1 3.31Å; K505-V598 VanDerWaalsContact O-CG2 3.26Å; K505-V598 WeakPolarHBondContact O-CG2 3.36Å; A507-V598 HydrophobicContact CB-CG1 4.35Å; F517-V598 HydrophobicContact CE1-CG2 4.49Å; S580-V598 VanDerWaalsContact O-O 3.12Å; Y581-V598 WeakPolarHBondContact CA-O 3.37Å; Y581-V598 WeakPolarHBondContact CB-O 3.44Å; Y581-V598 WeakPolarHBondContact CD1-O 3Å; I582-V598 HydrophobicContact CD1-CB 4.49Å; I582-V598 HydrophobicContact CD1-CG1 4.47Å; I582-V598 HydrophobicContact CD1-CG2 4.42Å; I582-V598 HydrophobicContact CG1-CB 4.2Å; I582-V598 HydrophobicContact CG1-CG1 4.36Å; V598-Y1505 VanDerWaalsContact CA-O 3.23Å; V598-Y1505 WeakPolarHBondContact CA-O 3.28Å; V598-Y1505 WeakPolarHBondContact CB-O 3.17Å; V598-Y1505 VanDerWaalsContact CG2-O 3.28Å; V598-Y1505 WeakPolarHBondContact CG2-O 3.18Å; V598-Y1505 PolarHBondContact N-O 2.99Å; V598-S1506 WeakPolarHBondContact CG2-O 3.48Å; V598-S1506 WeakPolarHBondContact CG2-OG 3.45Å; V598-S1506 PolarHBondContact N-O 3.03Å; V598-S1506 VanDerWaalsContact N-O 3.13Å
599	R	82.2	Confident	71.7	Confident	19 Å²	19	60.4 Å²	60.4	7%	0.072	34%	0.34	C	S	.	.	B	Isolated β-bridge	trans	-132.4	-174.4	-178.8	-159	171.1	64.8	72.8	-8.4	113	D497 K505 V506 A507 R579 S580 Y581 D601	D497-R599 IonicContact OD2-NH2 2.82Å; D497-R599 PolarHBondContact OD2-NH2 2.95Å; K505-R599 VanDerWaalsContact C-N 3.33Å; K505-R599 PolarHBondContact O-N 3.35Å; V506-R599 CarbonylContact C-O 3.57Å; V506-R599 VanDerWaalsContact CA-O 3.23Å; V506-R599 WeakPolarHBondContact CA-O 3.2Å; V506-R599 HydrophobicContact CB-CB 4.15Å; V506-R599 HydrophobicContact CG1-CB 4.13Å; V506-R599 HydrophobicContact CG2-CB 4.02Å; V506-R599 VanDerWaalsContact CG2-CZ 3.5Å; V506-R599 VanDerWaalsContact CG2-NH2 3.29Å; A507-R599 PolarHBondContact N-O 3.11Å; R579-R599 HydrophobicContact CB-CG 4.34Å; S580-R599 CarbonylContact O-C 3.59Å; S580-R599 VanDerWaalsContact O-CA 3.25Å; S580-R599 WeakPolarHBondContact O-CA 3.37Å; Y581-R599 HydrophobicContact CD1-CB 4.49Å; Y581-R599 HydrophobicContact CE1-CB 4.07Å; Y581-R599 HydrophobicContact CE1-CG 3.99Å; Y581-R599 WeakPolarHBondContact OH-CD 3.41Å; R599-D601 IonicContact CZ-OD2 3.02Å; R599-D601 VanDerWaalsContact CZ-OD2 3.24Å; R599-D601 IonicContact NH1-OD1 3.63Å; R599-D601 IonicContact NH1-OD2 2.8Å; R599-D601 PolarHBondContact NH1-OD2 3.08Å; R599-D601 IonicContact NH2-OD2 3.88Å; R599-D601 PolarHBondContact NH2-OD2 3.43Å
600	L	73.8	Confident	72.7	Confident	17 Å²	17	63.2 Å²	63.2	9%	0.089	34%	0.344	C	S	.	.			trans	-142.2	156.1	171.7	-54.4	170.6	0	0	0	109.5	V506 A507 V573 D577 R579	V506-L600 VanDerWaalsContact CG1-CA 3.43Å; A507-L600 HydrophobicContact CB-CD2 4.13Å; A507-L600 WeakPolarHBondContact O-CD2 3.19Å; V573-L600 HydrophobicContact CG1-CD1 3.94Å; V573-L600 HydrophobicContact CG1-CD2 4.4Å; V573-L600 HydrophobicContact CG2-CD1 4.45Å; V573-L600 HydrophobicContact CG2-CD2 4.39Å; D577-L600 HydrophobicContact CB-CD1 3.88Å; D577-L600 WeakPolarHBondContact O-CD1 3.37Å; R579-L600 WeakPolarHBondContact CA-O 3.4Å; R579-L600 PolarHBondContact N-O 2.73Å
601	D	74.5	Confident	74.2	Confident	40 Å²	40	61.2 Å²	61.2	21%	0.214	32%	0.315	C	S	.	.			trans	-164.2	168.3	-170.9	-138.7	-16	0	0	0	123.5	V506 Y508 D578 R579 R599	V506-D601 HydrophobicContact CG1-CB 4.01Å; Y508-D601 HydrophobicContact CD1-CB 4.37Å; Y508-D601 HydrophobicContact CE1-CB 4.18Å; D578-D601 WeakPolarHBondContact OD1-CA 3.45Å; D578-D601 PolarHBondContact OD1-N 2.74Å; R579-D601 IonicContact CZ-OD1 2.66Å; R579-D601 IonicContact NE-OD1 3.19Å; R579-D601 IonicContact NH2-OD1 3.67Å; R579-D601 PolarHBondContact NH2-OD1 2.86Å; R599-D601 IonicContact CZ-OD2 3.02Å; R599-D601 VanDerWaalsContact CZ-OD2 3.24Å; R599-D601 IonicContact NH1-OD1 3.63Å; R599-D601 IonicContact NH1-OD2 2.8Å; R599-D601 PolarHBondContact NH1-OD2 3.08Å; R599-D601 IonicContact NH2-OD2 3.88Å; R599-D601 PolarHBondContact NH2-OD2 3.43Å
602	I	71.2	Confident	75.6	Confident	109 Å²	109	59 Å²	59	56%	0.559	31%	0.307	S	S	*	.			trans	-156.3	174.5	-175.3	-6.2	174.4	0	0	0	121.2
603	I	71.3	Confident	76.9	Confident	97 Å²	97	59.7 Å²	59.7	50%	0.497	32%	0.318	S	S	.	.			trans	-153.8	164.6	-168.3	64	167.3	0	0	0	122.7	N636 P637 T687	I603-N636 CarbonylContact C-O 3.47Å; I603-P637 HydrophobicContact CG2-CG 4.24Å; I603-T687 WeakPolarHBondContact CD1-OG1 3.45Å
604	H	66.6	Low	77.7	Confident	102 Å²	102	58.1 Å²	58.1	47%	0.472	31%	0.313	S	S	.	.	B	Isolated β-bridge	trans	-175.5	0	173.5	70.3	87.6	0	0	0	119.7	N636 N686 A688	H604-N636 CarbonylContact C-O 3.42Å; H604-N636 WeakPolarHBondContact CA-O 3.12Å; H604-N636 PolarHBondContact CD2-ND2 3.28Å; H604-N636 VanDerWaalsContact CD2-ND2 3.28Å; H604-N636 PolarHBondContact N-O 2.99Å; H604-N636 PolarHBondContact NE2-ND2 3.09Å; H604-N636 CarbonylContact O-C 3.52Å; H604-N636 PolarHBondContact O-N 2.8Å; H604-N636 VanDerWaalsContact O-N 3.14Å; H604-N686 PolarHBondContact O-ND2 2.91Å; H604-A688 VanDerWaalsContact CA-CB 3.47Å
605	P	57.9	Low	78.1	Confident	73 Å²	73	64.6 Å²	64.6	47%	0.474	34%	0.339	S	S	.	.				0	0	0	40.8	-39.7	0	0	0	127.2	G635 N686 A688 T689	P605-G635 WeakPolarHBondContact O-CA 3.32Å; P605-N686 WeakPolarHBondContact CA-ND2 3.29Å; P605-N686 WeakPolarHBondContact CA-OD1 3.24Å; P605-A688 HydrophobicContact CB-CB 4.07Å; P605-A688 HydrophobicContact CG-CB 4.39Å; P605-T689 HydrophobicContact CB-CG2 3.97Å
606	P	69.1	Low	78.4	Confident	30 Å²	30	65.2 Å²	65.2	20%	0.195	35%	0.348	C	S	.	.				0	-167.2	0	49.4	-31.1	0	0	0	126.1	G634 P639 N686 T689	P606-G634 WeakPolarHBondContact CA-O 3.15Å; P606-G634 WeakPolarHBondContact CB-O 3.42Å; P606-P639 HydrophobicContact CB-CB 3.63Å; P606-P639 HydrophobicContact CB-CG 3.9Å; P606-P639 HydrophobicContact CG-CB 4.26Å; P606-N686 HydrophobicContact CG-CB 3.96Å; P606-T689 HydrophobicContact CG-CG2 3.98Å
607	D	79	Confident	78.2	Confident	73 Å²	73	66.8 Å²	66.8	39%	0.39	37%	0.366	S	S	.	.			trans	-124.8	-158.1	-171.4	-34.8	-53.5	0	0	0	123.1	T632 T633 A684	D607-T632 PolarHBondContact O-OG1 2.86Å; D607-T633 WeakPolarHBondContact CA-O 3.45Å; D607-T633 WeakPolarHBondContact CB-O 3.43Å; D607-T633 WeakPolarHBondContact CB-OG1 3.4Å; D607-T633 VanDerWaalsContact CG-O 3.26Å; D607-T633 PolarHBondContact N-O 2.87Å; D607-T633 VanDerWaalsContact N-O 3.07Å; D607-T633 VanDerWaalsContact OD2-C 3.25Å; D607-T633 WeakPolarHBondContact OD2-CB 3.49Å; D607-T633 PolarHBondContact OD2-OG1 3.43Å; D607-A684 VanDerWaalsContact O-CB 3.29Å; D607-A684 WeakPolarHBondContact O-CB 3.5Å
608	I	82.4	Confident	78.3	Confident	107 Å²	107	70.6 Å²	70.6	55%	0.549	39%	0.386	S	S	.	.			trans	-125.4	0	-152.4	-42.9	177	0	0	0	122.6	T632 I694	I608-T632 WeakPolarHBondContact CA-OG1 3.35Å; I608-T632 PolarHBondContact N-OG1 2.61Å; I608-T632 WeakPolarHBondContact O-CA 3.11Å; I608-T632 WeakPolarHBondContact O-CB 3.29Å; I608-T632 PolarHBondContact O-OG1 3.08Å; I608-I694 HydrophobicContact CB-CG2 4.4Å; I608-I694 HydrophobicContact CD1-CD1 4.47Å; I608-I694 HydrophobicContact CD1-CG2 4.44Å; I608-I694 HydrophobicContact CG1-CD1 3.76Å; I608-I694 HydrophobicContact CG1-CG2 4.13Å; I608-I694 HydrophobicContact CG2-CB 4.42Å; I608-I694 HydrophobicContact CG2-CG2 3.69Å
609	P	85.8	Confident	78.3	Confident	22 Å²	22	74.5 Å²	74.5	14%	0.143	41%	0.412	C	S	.	.				0	-173.8	0	42.2	-26.8	0	0	0	128.1	T631 L641 I694	P609-T631 WeakPolarHBondContact CA-O 3.49Å; P609-T631 VanDerWaalsContact CB-O 3.28Å; P609-T631 WeakPolarHBondContact CB-O 3.26Å; P609-L641 HydrophobicContact CB-CD2 3.97Å; P609-L641 HydrophobicContact CG-CD2 4.41Å; P609-I694 WeakPolarHBondContact CD-O 3.41Å
610	K	86.4	Confident	78.4	Confident	153 Å²	153	75.1 Å²	75.1	67%	0.665	42%	0.417	S	S	*	.			trans	-164.6	161.9	-177.3	172.8	173.6	177.1	177.1	0	118.3	C630 T631	K610-C630 WeakPolarHBondContact O-CA 3.32Å; K610-C630 VanDerWaalsContact O-CB 3.28Å; K610-C630 WeakPolarHBondContact O-CB 3.08Å; K610-C630 PolarHBondContact O-SG 3.17Å; K610-T631 PolarHBondContact O-N 2.85Å
611	I	89	Confident	78.7	Confident	32 Å²	32	77.7 Å²	77.7	16%	0.164	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	159.1	-170.8	-83.4	170.7	0	0	0	121.9	T629 C630 W643 H681 C682	I611-T629 CarbonylContact C-O 3.6Å; I611-T629 WeakPolarHBondContact CA-O 3.27Å; I611-C630 HydrophobicContact CG1-CB 4.01Å; I611-W643 HydrophobicContact CB-CH2 4.3Å; I611-W643 HydrophobicContact CD1-CD2 4.48Å; I611-W643 HydrophobicContact CD1-CE3 3.76Å; I611-W643 HydrophobicContact CD1-CH2 3.73Å; I611-W643 HydrophobicContact CD1-CZ2 4.43Å; I611-W643 HydrophobicContact CD1-CZ3 3.34Å; I611-W643 HydrophobicContact CG1-CE3 4.38Å; I611-W643 HydrophobicContact CG1-CH2 3.54Å; I611-W643 HydrophobicContact CG1-CZ2 4.03Å; I611-W643 HydrophobicContact CG1-CZ3 3.74Å; I611-W643 HydrophobicContact CG2-CH2 3.98Å; I611-W643 HydrophobicContact CG2-CZ3 4.23Å; I611-H681 HydrophobicContact CD1-CB 4.24Å; I611-C682 HydrophobicContact CD1-CB 3.59Å; I611-C682 HydrophobicContact CG1-CB 3.91Å
612	T	85.4	Confident	78.8	Confident	87 Å²	87	77.3 Å²	77.3	53%	0.534	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	160.3	161.9	53.5	0	0	0	0	115.7	L628 T629	T612-L628 CarbonylContact O-C 3.6Å; T612-L628 VanDerWaalsContact O-CA 3.28Å; T612-L628 WeakPolarHBondContact O-CA 3.4Å; T612-L628 WeakPolarHBondContact O-CB 3.41Å; T612-T629 PolarHBondContact N-O 2.95Å; T612-T629 PolarHBondContact O-N 2.73Å
613	G	80.2	Confident	78.8	Confident	57 Å²	57	75.4 Å²	75.4	59%	0.588	43%	0.429	S	S	*	.			trans	158.1	-41	156.2	0	0	0	0	0	122.5
614	Y	85.4	Confident	79.1	Confident	39 Å²	39	75.7 Å²	75.7	15%	0.153	43%	0.428	C	S	.	.			trans	-139.8	173.6	-167.1	161.6	-97.3	0	0	0	112.9	G617 Q618 L626 I699 T700 L701	Y614-G617 PolarHBondContact OH-N 3.26Å; Y614-Q618 HydrophobicContact CE2-CB 4.46Å; Y614-Q618 PolarHBondContact OH-N 3.33Å; Y614-Q618 PolarHBondContact OH-O 2.85Å; Y614-L626 HydrophobicContact CD2-CD1 3.9Å; Y614-L626 HydrophobicContact CD2-CD2 3.78Å; Y614-L626 HydrophobicContact CD2-CG 4.45Å; Y614-L626 HydrophobicContact CE2-CD2 4.09Å; Y614-L626 HydrophobicContact CG-CD1 4.5Å; Y614-L626 HydrophobicContact CG-CD2 4.11Å; Y614-I699 HydrophobicContact CD1-CD1 4.26Å; Y614-T700 WeakPolarHBondContact CE1-O 3.23Å; Y614-L701 HydrophobicContact CD1-CD2 4.04Å; Y614-L701 HydrophobicContact CE1-CD2 3.5Å; Y614-L701 HydrophobicContact CE1-CG 4.44Å; Y614-L701 HydrophobicContact CE2-CD2 4.17Å
615	K	78.1	Confident	79.7	Confident	176 Å²	176	76.3 Å²	76.3	77%	0.765	43%	0.434	S	S	*	.			trans	-124.2	125	175.9	-65.6	-176.8	-179.7	-179.5	0	111.4
616	S	82.3	Confident	80.8	Confident	74 Å²	74	74.7 Å²	74.7	52%	0.517	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	139.6	-171.5	-61.7	0	0	0	0	115.9	T700	S616-T700 WeakPolarHBondContact CA-O 3.21Å; S616-T700 WeakPolarHBondContact CB-O 3.38Å; S616-T700 PolarHBondContact OG-N 3.4Å
617	G	77.6	Confident	81.5	Confident	43 Å²	43	76.5 Å²	76.5	44%	0.443	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.4	-7.5	160.9	0	0	0	0	0	117.7	Y614 T700 N702	Y614-G617 PolarHBondContact OH-N 3.26Å; G617-T700 PolarHBondContact N-O 2.83Å; G617-N702 PolarHBondContact O-ND2 3.26Å
618	Q	83.5	Confident	81.8	Confident	130 Å²	130	73.2 Å²	73.2	61%	0.607	41%	0.409	S	S	*	.			trans	-71.9	131.3	-179.8	-175.1	176.3	-25.4	0	0	111.6	Y614	Y614-Q618 HydrophobicContact CE2-CB 4.46Å; Y614-Q618 PolarHBondContact OH-N 3.33Å; Y614-Q618 PolarHBondContact OH-O 2.85Å
619	P	83.2	Confident	81.9	Confident	85 Å²	85	70 Å²	70	55%	0.552	40%	0.395	S	S	*	.			trans	-73	142	-178.4	29.6	-35.4	0	0	0	112.6
620	V	83.5	Confident	81.9	Confident	32 Å²	32	69 Å²	69	19%	0.194	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	147.7	179.6	-167.5	0	0	0	0	110.1	H624 P671 N702 V703 L704	V620-H624 HydrophobicContact CG1-CB 3.76Å; V620-P671 HydrophobicContact CB-CG 4.36Å; V620-P671 HydrophobicContact CG1-CG 4Å; V620-N702 PolarHBondContact N-O 2.87Å; V620-V703 VanDerWaalsContact O-CA 3.28Å; V620-V703 WeakPolarHBondContact O-CA 3.25Å; V620-L704 PolarHBondContact O-N 3.25Å; V620-L704 VanDerWaalsContact O-N 3.1Å
621	N	80.2	Confident	81.9	Confident	70 Å²	70	64.1 Å²	64.1	37%	0.374	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	146.6	170.6	-68.7	-9.5	0	0	0	110.2	A623 H624	N621-A623 PolarHBondContact O-N 2.8Å; N621-H624 PolarHBondContact ND2-CE1 2.93Å; N621-H624 PolarHBondContact ND2-NE2 2.89Å; N621-H624 PolarHBondContact O-N 2.89Å
622	M	76.4	Confident	81.6	Confident	32 Å²	32	62.9 Å²	62.9	16%	0.158	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.5	141.5	162.1	172	179.5	-87.9	0	0	109.9	P671 K673 V703 L704 F705	M622-P671 VanDerWaalsContact CA-O 3.32Å; M622-P671 WeakPolarHBondContact CA-O 3.31Å; M622-K673 HydrophobicContact CE-CB 3.7Å; M622-K673 HydrophobicContact CE-CG 3.98Å; M622-V703 HydrophobicContact CB-CG1 4.26Å; M622-L704 WeakPolarHBondContact CB-O 3.38Å; M622-L704 PolarHBondContact N-O 3.22Å; M622-F705 HydrophobicContact CB-CB 4.12Å; M622-F705 HydrophobicContact CE-CB 3.64Å; M622-F705 HydrophobicContact CE-CG 4.44Å; M622-F705 HydrophobicContact SD-CB 3.91Å
623	A	72.8	Confident	81.4	Confident	69 Å²	69	61.2 Å²	61.2	57%	0.57	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.9	8	-177.7	0	0	0	0	0	117.8	N621 V670 P671	N621-A623 PolarHBondContact O-N 2.8Å; A623-V670 VanDerWaalsContact CA-CG1 3.46Å; A623-V670 HydrophobicContact CB-CG1 4.44Å; A623-P671 PolarHBondContact N-O 2.98Å; A623-P671 VanDerWaalsContact N-O 3.13Å
624	H	76.7	Confident	81.3	Confident	104 Å²	104	59.1 Å²	59.1	48%	0.481	33%	0.334	S	S	.	.			trans	-100.2	109.9	176.1	-76.6	-145.9	0	0	0	113.6	V620 N621 P671	V620-H624 HydrophobicContact CG1-CB 3.76Å; N621-H624 PolarHBondContact ND2-CE1 2.93Å; N621-H624 PolarHBondContact ND2-NE2 2.89Å; N621-H624 PolarHBondContact O-N 2.89Å; H624-P671 WeakPolarHBondContact O-CD 3.36Å
625	L	80	Confident	80.7	Confident	114 Å²	114	58.5 Å²	58.5	60%	0.597	34%	0.339	S	S	*	.			trans	-54.4	142.9	-172.1	-176.3	67.1	0	0	0	117.4	K668 V670	L625-K668 HydrophobicContact CD1-CB 4.24Å; L625-V670 HydrophobicContact CB-CG2 4.48Å; L625-V670 HydrophobicContact CD1-CG2 3.7Å
626	L	80.5	Confident	80.3	Confident	39 Å²	39	53.5 Å²	53.5	20%	0.204	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	155.7	175.5	-177.8	63	0	0	0	111.6	Y614 K668 L669 L701	Y614-L626 HydrophobicContact CD2-CD1 3.9Å; Y614-L626 HydrophobicContact CD2-CD2 3.78Å; Y614-L626 HydrophobicContact CD2-CG 4.45Å; Y614-L626 HydrophobicContact CE2-CD2 4.09Å; Y614-L626 HydrophobicContact CG-CD1 4.5Å; Y614-L626 HydrophobicContact CG-CD2 4.11Å; L626-K668 CarbonylContact O-C 3.52Å; L626-K668 WeakPolarHBondContact O-CA 2.99Å; L626-L669 HydrophobicContact CB-CD1 4.14Å; L626-L669 HydrophobicContact CB-CG 4.11Å; L626-L669 HydrophobicContact CD2-CD1 4.21Å; L626-L669 HydrophobicContact CD2-CD2 4.39Å; L626-L669 HydrophobicContact CD2-CG 4.41Å; L626-L669 HydrophobicContact CG-CG 4.47Å; L626-L669 PolarHBondContact N-O 3.15Å; L626-L669 PolarHBondContact O-N 2.97Å; L626-L669 VanDerWaalsContact O-O 3.13Å; L626-L701 HydrophobicContact CD2-CD2 3.57Å
627	E	83.7	Confident	79.2	Confident	69 Å²	69	52.5 Å²	52.5	32%	0.322	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	140.7	-172.3	-177.1	173.7	174.7	0	0	115.6	K666 L667 K668	E627-K666 WeakPolarHBondContact OE1-CD 3.43Å; E627-K666 IonicContact OE1-NZ 3.37Å; E627-K666 PolarHBondContact OE1-NZ 2.78Å; E627-L667 CarbonylContact C-O 3.55Å; E627-L667 WeakPolarHBondContact CA-O 3.04Å; E627-K668 HydrophobicContact CB-CG 4.07Å; E627-K668 HydrophobicContact CG-CG 3.79Å; E627-K668 WeakPolarHBondContact OE2-CE 3.41Å; E627-K668 IonicContact OE2-NZ 2.65Å
628	L	84.6	Confident	78.9	Confident	3 Å²	3	54.5 Å²	54.5	2%	0.016	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	168.9	-177	-43.2	171.2	0	0	0	112.4	T612 W643 K666 L667 L669 Y680 I699	T612-L628 CarbonylContact O-C 3.6Å; T612-L628 VanDerWaalsContact O-CA 3.28Å; T612-L628 WeakPolarHBondContact O-CA 3.4Å; T612-L628 WeakPolarHBondContact O-CB 3.41Å; L628-W643 HydrophobicContact CB-CH2 3.45Å; L628-W643 VanDerWaalsContact CB-CH2 3.45Å; L628-W643 HydrophobicContact CB-CZ2 3.95Å; L628-W643 HydrophobicContact CB-CZ3 4.13Å; L628-W643 HydrophobicContact CD1-CH2 4.17Å; L628-W643 HydrophobicContact CD1-CZ3 3.97Å; L628-W643 HydrophobicContact CG-CH2 4.45Å; L628-K666 WeakPolarHBondContact O-CA 3.35Å; L628-L667 HydrophobicContact CB-CB 4.19Å; L628-L667 HydrophobicContact CB-CG 4.45Å; L628-L667 HydrophobicContact CD1-CD2 3.81Å; L628-L667 HydrophobicContact CD1-CG 4.04Å; L628-L667 HydrophobicContact CG-CG 4.5Å; L628-L667 PolarHBondContact N-O 3.33Å; L628-L667 PolarHBondContact O-N 2.59Å; L628-L669 HydrophobicContact CD1-CD2 4.02Å; L628-Y680 HydrophobicContact CD1-CD1 4.5Å; L628-I699 HydrophobicContact CD1-CD1 4Å; L628-I699 HydrophobicContact CD2-CD1 3.72Å
629	T	85.2	Confident	78.5	Confident	39 Å²	39	48.5 Å²	48.5	24%	0.239	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	141.3	-173.6	-60.5	0	0	0	0	117.6	I611 T612 W643 K666	I611-T629 CarbonylContact C-O 3.6Å; I611-T629 WeakPolarHBondContact CA-O 3.27Å; T612-T629 PolarHBondContact N-O 2.95Å; T612-T629 PolarHBondContact O-N 2.73Å; T629-W643 VanDerWaalsContact C-CZ2 3.5Å; T629-K666 HydrophobicContact CG2-CG 4.09Å; T629-K666 WeakPolarHBondContact OG1-CE 3.36Å
630	C	85.4	Confident	78.3	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.007	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	161.3	-176.3	178.6	0	0	0	0	117	K610 I611 W643 T664 I665 C682	K610-C630 WeakPolarHBondContact O-CA 3.32Å; K610-C630 VanDerWaalsContact O-CB 3.28Å; K610-C630 WeakPolarHBondContact O-CB 3.08Å; K610-C630 PolarHBondContact O-SG 3.17Å; I611-C630 HydrophobicContact CG1-CB 4.01Å; C630-W643 HydrophobicContact CB-CZ2 3.8Å; C630-T664 CarbonylContact O-C 3.58Å; C630-I665 WeakPolarHBondContact CA-O 3.31Å; C630-I665 HydrophobicContact CB-CG2 3.79Å; C630-I665 PolarHBondContact N-O 3.37Å; C630-I665 PolarHBondContact O-N 3.42Å; C630-C682 HydrophobicContact CB-CB 3.91Å; C630-C682 WeakPolarHBondContact CB-SG 3.22Å; C630-C682 WeakPolarHBondContact SG-CB 3.45Å; C630-C682 CovalentContact SG-SG 2.05Å; C630-C682 PolarHBondContact SG-SG 3.33Å
631	T	87	Confident	78.3	Confident	52 Å²	52	46.7 Å²	46.7	32%	0.319	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	145.2	-168.8	65.6	0	0	0	0	118.7	P609 K610 T663 T664	P609-T631 WeakPolarHBondContact CA-O 3.49Å; P609-T631 VanDerWaalsContact CB-O 3.28Å; P609-T631 WeakPolarHBondContact CB-O 3.26Å; K610-T631 PolarHBondContact O-N 2.85Å; T631-T663 CarbonylContact C-O 3.53Å; T631-T664 HydrophobicContact CG2-CG2 3.94Å; T631-T664 WeakPolarHBondContact CG2-OG1 3.06Å
632	T	82.2	Confident	78.6	Confident	6 Å²	6	44.4 Å²	44.4	4%	0.037	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	-165.7	174.6	-165.9	0	0	0	0	116	D607 I608 L641 Q662 T663 A684	D607-T632 PolarHBondContact O-OG1 2.86Å; I608-T632 WeakPolarHBondContact CA-OG1 3.35Å; I608-T632 PolarHBondContact N-OG1 2.61Å; I608-T632 WeakPolarHBondContact O-CA 3.11Å; I608-T632 WeakPolarHBondContact O-CB 3.29Å; I608-T632 PolarHBondContact O-OG1 3.08Å; T632-L641 HydrophobicContact CG2-CD1 3.74Å; T632-L641 HydrophobicContact CG2-CD2 3.56Å; T632-L641 HydrophobicContact CG2-CG 3.41Å; T632-L641 VanDerWaalsContact CG2-CG 3.41Å; T632-Q662 CarbonylContact O-C 3.52Å; T632-Q662 WeakPolarHBondContact O-CA 3.41Å; T632-Q662 WeakPolarHBondContact O-CG 3.48Å; T632-T663 HydrophobicContact CG2-CG2 4.36Å; T632-T663 PolarHBondContact N-O 2.59Å; T632-T663 PolarHBondContact O-N 2.87Å; T632-A684 HydrophobicContact CG2-CB 4.16Å
633	T	81.8	Confident	79.1	Confident	52 Å²	52	42.9 Å²	42.9	32%	0.319	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	151.7	176	45.8	0	0	0	0	118.6	D607 K661 Q662	D607-T633 WeakPolarHBondContact CA-O 3.45Å; D607-T633 WeakPolarHBondContact CB-O 3.43Å; D607-T633 WeakPolarHBondContact CB-OG1 3.4Å; D607-T633 VanDerWaalsContact CG-O 3.26Å; D607-T633 PolarHBondContact N-O 2.87Å; D607-T633 VanDerWaalsContact N-O 3.07Å; D607-T633 VanDerWaalsContact OD2-C 3.25Å; D607-T633 WeakPolarHBondContact OD2-CB 3.49Å; D607-T633 PolarHBondContact OD2-OG1 3.43Å; T633-K661 CarbonylContact C-O 3.58Å; T633-K661 WeakPolarHBondContact CA-O 3.47Å; T633-K661 VanDerWaalsContact CB-O 3.3Å; T633-K661 WeakPolarHBondContact CB-O 3.23Å; T633-K661 WeakPolarHBondContact CG2-O 3.07Å; T633-Q662 HydrophobicContact CG2-CB 3.93Å; T633-Q662 HydrophobicContact CG2-CG 4.02Å
634	G	77.6	Confident	79.6	Confident	13 Å²	13	40.5 Å²	40.5	13%	0.134	22%	0.223	C	C	.	.			trans	76.3	134	147.4	0	0	0	0	0	121.9	P606 P639 K661	P606-G634 WeakPolarHBondContact CA-O 3.15Å; P606-G634 WeakPolarHBondContact CB-O 3.42Å; G634-P639 WeakPolarHBondContact O-CD 3.35Å; G634-P639 WeakPolarHBondContact O-CG 3.41Å; G634-K661 PolarHBondContact N-O 3Å
635	G	72.2	Confident	80	Confident	25 Å²	25	37.5 Å²	37.5	26%	0.258	21%	0.209	S	C	.	.			trans	162.4	179.6	167.9	0	0	0	0	0	118	P605 P637 L638	P605-G635 WeakPolarHBondContact O-CA 3.32Å; G635-P637 CarbonylContact C-O 3.52Å; G635-L638 WeakPolarHBondContact O-CD2 3.24Å; G635-L638 WeakPolarHBondContact O-CG 3.3Å
636	N	69.2	Low	80	Confident	71 Å²	71	35.4 Å²	35.4	38%	0.38	20%	0.198	S	C	.	.	B	Isolated β-bridge	trans	-158.3	98.6	168.1	172.9	35.6	0	0	0	115	I603 H604	I603-N636 CarbonylContact C-O 3.47Å; H604-N636 CarbonylContact C-O 3.42Å; H604-N636 WeakPolarHBondContact CA-O 3.12Å; H604-N636 PolarHBondContact CD2-ND2 3.28Å; H604-N636 VanDerWaalsContact CD2-ND2 3.28Å; H604-N636 PolarHBondContact N-O 2.99Å; H604-N636 PolarHBondContact NE2-ND2 3.09Å; H604-N636 CarbonylContact O-C 3.52Å; H604-N636 PolarHBondContact O-N 2.8Å; H604-N636 VanDerWaalsContact O-N 3.14Å
637	P	61.1	Low	79.8	Confident	53 Å²	53	41.9 Å²	41.9	34%	0.344	23%	0.225	S	C	.	.	S	Bend	cis	-59.2	144.5	2.9	22.5	-33	0	0	0	109.9	I603 G635 N686 T687	I603-P637 HydrophobicContact CG2-CG 4.24Å; G635-P637 CarbonylContact C-O 3.52Å; P637-N686 PolarHBondContact O-ND2 2.97Å; P637-T687 HydrophobicContact CG-CG2 4.24Å
638	L	70.4	Confident	79.4	Confident	85 Å²	85	43.7 Å²	43.7	45%	0.445	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-58.4	154.1	-177.6	-74.7	153.1	0	0	0	110.9	G635 I658	G635-L638 WeakPolarHBondContact O-CD2 3.24Å; G635-L638 WeakPolarHBondContact O-CG 3.3Å; L638-I658 HydrophobicContact CB-CD1 3.93Å; L638-I658 HydrophobicContact CD1-CD1 3.82Å; L638-I658 HydrophobicContact CG-CD1 4.33Å
639	P	75.3	Confident	79.1	Confident	4 Å²	4	46.8 Å²	46.8	3%	0.026	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-62.8	140.4	-173.1	16.2	-27.3	0	0	0	112.5	P606 G634 R685	P606-P639 HydrophobicContact CB-CB 3.63Å; P606-P639 HydrophobicContact CB-CG 3.9Å; P606-P639 HydrophobicContact CG-CB 4.26Å; G634-P639 WeakPolarHBondContact O-CD 3.35Å; G634-P639 WeakPolarHBondContact O-CG 3.41Å; P639-R685 VanDerWaalsContact CA-O 3.31Å; P639-R685 WeakPolarHBondContact CA-O 3.38Å
640	E	79.5	Confident	78.7	Confident	71 Å²	71	46 Å²	46	33%	0.332	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	134.1	162.1	-166.1	174.3	179.2	0	0	108.8	Q642 A684 R685 W693	E640-Q642 PolarHBondContact OE1-NE2 2.79Å; E640-A684 WeakPolarHBondContact O-CA 3.04Å; E640-A684 WeakPolarHBondContact O-CB 3.28Å; E640-R685 HydrophobicContact CB-CG 4.15Å; E640-R685 PolarHBondContact N-O 3.36Å; E640-R685 PolarHBondContact O-N 3.38Å; E640-R685 VanDerWaalsContact O-N 3.16Å; E640-R685 IonicContact OE1-NH2 2.68Å; E640-R685 PolarHBondContact OE1-NH2 3.39Å; E640-R685 IonicContact OE2-CZ 3.16Å; E640-R685 IonicContact OE2-NE 2.74Å; E640-R685 PolarHBondContact OE2-NE 3.46Å; E640-R685 IonicContact OE2-NH2 2.72Å; E640-R685 PolarHBondContact OE2-NH2 3.38Å; E640-W693 HydrophobicContact CB-CH2 4.38Å; E640-W693 HydrophobicContact CG-CH2 3.95Å
641	L	82.8	Confident	77.7	Confident	9 Å²	9	47.8 Å²	47.8	5%	0.047	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	139.2	164.8	-102.8	-174	0	0	0	108	P609 T632 P656 T663 I665 S683 A684	P609-L641 HydrophobicContact CB-CD2 3.97Å; P609-L641 HydrophobicContact CG-CD2 4.41Å; T632-L641 HydrophobicContact CG2-CD1 3.74Å; T632-L641 HydrophobicContact CG2-CD2 3.56Å; T632-L641 HydrophobicContact CG2-CG 3.41Å; T632-L641 VanDerWaalsContact CG2-CG 3.41Å; L641-P656 HydrophobicContact CB-CB 4.29Å; L641-T663 HydrophobicContact CB-CG2 4.4Å; L641-T663 HydrophobicContact CD1-CG2 3.9Å; L641-T663 HydrophobicContact CG-CG2 4.09Å; L641-I665 HydrophobicContact CB-CB 4.13Å; L641-I665 HydrophobicContact CB-CD1 4.3Å; L641-I665 HydrophobicContact CB-CG2 3.93Å; L641-I665 HydrophobicContact CD1-CB 4.02Å; L641-I665 HydrophobicContact CD1-CG2 3.72Å; L641-I665 HydrophobicContact CD2-CG2 4.45Å; L641-I665 HydrophobicContact CG-CG2 4.26Å; L641-I665 VanDerWaalsContact O-CD1 3.29Å; L641-I665 WeakPolarHBondContact O-CD1 3.41Å; L641-S683 WeakPolarHBondContact CA-O 3.06Å; L641-S683 WeakPolarHBondContact CD2-O 3.49Å; L641-A684 HydrophobicContact CD2-CB 4.06Å
642	Q	85.5	Confident	76.3	Confident	22 Å²	22	45.6 Å²	45.6	10%	0.103	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	143.9	-174.4	-171.3	147.6	86.1	0	0	110.9	E640 F644 P649 C682 S683 W693	E640-Q642 PolarHBondContact OE1-NE2 2.79Å; Q642-F644 HydrophobicContact CB-CE2 3.97Å; Q642-F644 HydrophobicContact CB-CZ 4.49Å; Q642-F644 HydrophobicContact CG-CE2 3.96Å; Q642-F644 HydrophobicContact CG-CZ 4.24Å; Q642-P649 HydrophobicContact CG-CB 3.58Å; Q642-C682 CarbonylContact O-C 3.37Å; Q642-C682 WeakPolarHBondContact O-CA 3.16Å; Q642-C682 PolarHBondContact O-SG 3.44Å; Q642-C682 VanDerWaalsContact O-SG 3.34Å; Q642-S683 PolarHBondContact N-O 2.84Å; Q642-S683 PolarHBondContact O-N 3.45Å; Q642-W693 HydrophobicContact CB-CH2 3.63Å; Q642-W693 HydrophobicContact CB-CZ3 3.78Å; Q642-W693 HydrophobicContact CG-CH2 4.22Å
643	W	86.8	Confident	74.7	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	172.1	168.2	-83.6	80.4	0	0	0	109.8	I611 L628 T629 C630 P649 I650 I665 L667 H681 C682	I611-W643 HydrophobicContact CB-CH2 4.3Å; I611-W643 HydrophobicContact CD1-CD2 4.48Å; I611-W643 HydrophobicContact CD1-CE3 3.76Å; I611-W643 HydrophobicContact CD1-CH2 3.73Å; I611-W643 HydrophobicContact CD1-CZ2 4.43Å; I611-W643 HydrophobicContact CD1-CZ3 3.34Å; I611-W643 HydrophobicContact CG1-CE3 4.38Å; I611-W643 HydrophobicContact CG1-CH2 3.54Å; I611-W643 HydrophobicContact CG1-CZ2 4.03Å; I611-W643 HydrophobicContact CG1-CZ3 3.74Å; I611-W643 HydrophobicContact CG2-CH2 3.98Å; I611-W643 HydrophobicContact CG2-CZ3 4.23Å; L628-W643 HydrophobicContact CB-CH2 3.45Å; L628-W643 VanDerWaalsContact CB-CH2 3.45Å; L628-W643 HydrophobicContact CB-CZ2 3.95Å; L628-W643 HydrophobicContact CB-CZ3 4.13Å; L628-W643 HydrophobicContact CD1-CH2 4.17Å; L628-W643 HydrophobicContact CD1-CZ3 3.97Å; L628-W643 HydrophobicContact CG-CH2 4.45Å; T629-W643 VanDerWaalsContact C-CZ2 3.5Å; C630-W643 HydrophobicContact CB-CZ2 3.8Å; W643-P649 CarbonylContact O-C 3.6Å; W643-P649 VanDerWaalsContact O-CA 3.23Å; W643-P649 WeakPolarHBondContact O-CA 3.49Å; W643-I650 HydrophobicContact CB-CB 3.75Å; W643-I650 HydrophobicContact CB-CD1 4.04Å; W643-I650 HydrophobicContact CB-CG1 4.49Å; W643-I650 HydrophobicContact CB-CG2 4.28Å; W643-I650 PolarHBondContact N-O 2.63Å; W643-I650 PolarHBondContact O-N 3.4Å; W643-I665 PolarHBondContact NE1-O 2.86Å; W643-L667 HydrophobicContact CB-CD2 4.24Å; W643-L667 HydrophobicContact CD2-CB 3.81Å; W643-L667 HydrophobicContact CD2-CD2 3.64Å; W643-L667 HydrophobicContact CD2-CG 4.4Å; W643-L667 HydrophobicContact CE3-CB 4.32Å; W643-L667 HydrophobicContact CE3-CD2 3.48Å; W643-L667 VanDerWaalsContact CE3-CD2 3.48Å; W643-L667 HydrophobicContact CG-CB 4.11Å; W643-L667 HydrophobicContact CG-CD2 4.01Å; W643-L667 HydrophobicContact CH2-CB 4.43Å; W643-L667 HydrophobicContact CZ2-CB 3.94Å; W643-L667 HydrophobicContact CZ3-CD2 3.98Å; W643-H681 CarbonylContact C-O 3.57Å; W643-H681 VanDerWaalsContact CA-O 3.23Å; W643-H681 WeakPolarHBondContact CA-O 3.13Å; W643-C682 HydrophobicContact CD2-CB 4.22Å; W643-C682 HydrophobicContact CG-CB 4.35Å
644	F	84.6	Confident	73.6	Confident	18 Å²	18	51.1 Å²	51.1	8%	0.079	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	131.6	-176.9	-72	-102.1	0	0	0	112	Q642 N648 P649 I650 Y680 H681 S683	Q642-F644 HydrophobicContact CB-CE2 3.97Å; Q642-F644 HydrophobicContact CB-CZ 4.49Å; Q642-F644 HydrophobicContact CG-CE2 3.96Å; Q642-F644 HydrophobicContact CG-CZ 4.24Å; F644-N648 CarbonylContact C-O 3.07Å; F644-N648 VanDerWaalsContact CA-O 3.26Å; F644-N648 WeakPolarHBondContact CA-O 3.37Å; F644-P649 HydrophobicContact CD1-CB 4.05Å; F644-P649 HydrophobicContact CE1-CB 3.73Å; F644-P649 HydrophobicContact CE1-CG 4.14Å; F644-P649 HydrophobicContact CZ-CB 3.96Å; F644-I650 WeakPolarHBondContact O-CD1 3.49Å; F644-Y680 CarbonylContact O-C 3.29Å; F644-Y680 WeakPolarHBondContact O-CA 3.33Å; F644-H681 WeakPolarHBondContact CB-NE2 3.26Å; F644-H681 AromaticContact CG-CD2 3.95Å; F644-H681 AromaticContact CG-NE2 3.75Å; F644-H681 PolarHBondContact N-O 2.71Å; F644-H681 PolarHBondContact O-N 3.1Å; F644-S683 WeakPolarHBondContact CD2-OG 3.47Å; F644-S683 WeakPolarHBondContact CE2-OG 3.49Å
645	K	85.3	Confident	72.7	Confident	42 Å²	42	57.4 Å²	57.4	18%	0.183	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	116.1	177.5	-179.8	179.9	178.2	-173	0	108.7	K647 N648 I650 E674 D675 A678 Q679 Y680	K645-K647 PolarHBondContact O-N 3.17Å; K645-K647 VanDerWaalsContact O-N 3.13Å; K645-N648 PolarHBondContact N-O 3.33Å; K645-N648 WeakPolarHBondContact O-CB 3.29Å; K645-N648 PolarHBondContact O-N 3.44Å; K645-N648 PolarHBondContact O-ND2 3.37Å; K645-I650 HydrophobicContact CB-CD1 3.63Å; K645-I650 HydrophobicContact CB-CG1 3.38Å; K645-I650 VanDerWaalsContact N-CG1 3.3Å; K645-E674 VanDerWaalsContact NZ-C 3.33Å; K645-E674 PolarHBondContact NZ-O 3.46Å; K645-D675 WeakPolarHBondContact CE-OD1 3.26Å; K645-D675 IonicContact NZ-OD1 2.95Å; K645-D675 PolarHBondContact NZ-OD1 3.26Å; K645-A678 HydrophobicContact CD-CB 4.19Å; K645-A678 HydrophobicContact CG-CB 4.02Å; K645-Q679 CarbonylContact C-O 3.53Å; K645-Q679 WeakPolarHBondContact CA-O 3.48Å; K645-Y680 HydrophobicContact CB-CE1 4.48Å; K645-Y680 HydrophobicContact CG-CE1 4.43Å; K645-Y680 HydrophobicContact CG-CE2 4.29Å
646	D	80.1	Confident	72.3	Confident	70 Å²	70	58 Å²	58	37%	0.374	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.9	37.6	-176.5	-58	-61.2	0	0	0	112.5	N648 A678 Q679	D646-N648 VanDerWaalsContact C-N 3.33Å; D646-N648 PolarHBondContact O-ND2 3.24Å; D646-A678 WeakPolarHBondContact OD2-CA 3.24Å; D646-A678 WeakPolarHBondContact OD2-CB 3.26Å; D646-Q679 PolarHBondContact N-O 2.66Å; D646-Q679 WeakPolarHBondContact OD1-CB 3.5Å; D646-Q679 PolarHBondContact OD1-N 3.09Å; D646-Q679 PolarHBondContact OD2-N 2.94Å
647	K	75.6	Confident	72.4	Confident	174 Å²	174	59.1 Å²	59.1	76%	0.757	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.6	7.7	-174	-46.5	174.6	-178.5	-178.2	0	116.6	K645	K645-K647 PolarHBondContact O-N 3.17Å; K645-K647 VanDerWaalsContact O-N 3.13Å
648	N	76.3	Confident	72.6	Confident	107 Å²	107	60 Å²	60	57%	0.572	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.4	130.8	172.2	-48.3	-79.9	0	0	0	109.7	F644 K645 D646 I650	F644-N648 CarbonylContact C-O 3.07Å; F644-N648 VanDerWaalsContact CA-O 3.26Å; F644-N648 WeakPolarHBondContact CA-O 3.37Å; K645-N648 PolarHBondContact N-O 3.33Å; K645-N648 WeakPolarHBondContact O-CB 3.29Å; K645-N648 PolarHBondContact O-N 3.44Å; K645-N648 PolarHBondContact O-ND2 3.37Å; D646-N648 VanDerWaalsContact C-N 3.33Å; D646-N648 PolarHBondContact O-ND2 3.24Å; N648-I650 PolarHBondContact O-N 3.02Å
649	P	77.6	Confident	72.4	Confident	68 Å²	68	61.9 Å²	61.9	44%	0.442	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	121.9	-174.3	18.5	-29.9	0	0	0	114.3	Q642 W643 F644	Q642-P649 HydrophobicContact CG-CB 3.58Å; W643-P649 CarbonylContact O-C 3.6Å; W643-P649 VanDerWaalsContact O-CA 3.23Å; W643-P649 WeakPolarHBondContact O-CA 3.49Å; F644-P649 HydrophobicContact CD1-CB 4.05Å; F644-P649 HydrophobicContact CE1-CB 3.73Å; F644-P649 HydrophobicContact CE1-CG 4.14Å; F644-P649 HydrophobicContact CZ-CB 3.96Å
650	I	76.9	Confident	72	Confident	22 Å²	22	65.1 Å²	65.1	11%	0.113	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	148.2	168.8	-59.4	154.2	0	0	0	110.1	W643 F644 K645 N648 L667 Y680	W643-I650 HydrophobicContact CB-CB 3.75Å; W643-I650 HydrophobicContact CB-CD1 4.04Å; W643-I650 HydrophobicContact CB-CG1 4.49Å; W643-I650 HydrophobicContact CB-CG2 4.28Å; W643-I650 PolarHBondContact N-O 2.63Å; W643-I650 PolarHBondContact O-N 3.4Å; F644-I650 WeakPolarHBondContact O-CD1 3.49Å; K645-I650 HydrophobicContact CB-CD1 3.63Å; K645-I650 HydrophobicContact CB-CG1 3.38Å; K645-I650 VanDerWaalsContact N-CG1 3.3Å; N648-I650 PolarHBondContact O-N 3.02Å; I650-L667 HydrophobicContact CD1-CD2 3.87Å; I650-L667 HydrophobicContact CG2-CD1 4.02Å; I650-L667 HydrophobicContact CG2-CD2 4.28Å; I650-Y680 HydrophobicContact CD1-CD1 3.21Å; I650-Y680 HydrophobicContact CD1-CE1 3.52Å; I650-Y680 HydrophobicContact CD1-CG 4.17Å; I650-Y680 HydrophobicContact CG1-CD1 4.49Å; I650-Y680 HydrophobicContact CG1-CE1 4.43Å
651	T	64.6	Low	71.4	Confident	40 Å²	40	69.9 Å²	69.9	25%	0.245	37%	0.372	C	S	.	.			trans	-134.4	152.9	161.8	9.9	0	0	0	0	109.7	I1748 H1749 S1750	T651-I1748 VanDerWaalsContact CB-C 3.45Å; T651-I1748 WeakPolarHBondContact OG1-CA 3.45Å; T651-I1748 PolarHBondContact OG1-N 3.36Å; T651-I1748 PolarHBondContact OG1-O 3.3Å; T651-I1748 VanDerWaalsContact OG1-O 3.13Å; T651-H1749 CarbonylContact C-O 3.6Å; T651-H1749 PolarHBondContact OG1-N 2.74Å; T651-S1750 VanDerWaalsContact CB-N 3.33Å; T651-S1750 VanDerWaalsContact CG2-N 3.27Å
652	N	56.8	Low	70.9	Confident	5 Å²	5	74 Å²	74	3%	0.027	39%	0.392	C	S	.	.			trans	-150.5	132.2	-166.8	29.1	-124.5	0	0	0	110.5	V654 K666 L667 H1749 S1750 P1751	N652-V654 PolarHBondContact O-N 2.97Å; N652-K666 PolarHBondContact ND2-O 3.48Å; N652-K666 VanDerWaalsContact ND2-O 3.12Å; N652-L667 HydrophobicContact CB-CD1 3.58Å; N652-L667 WeakPolarHBondContact OD1-CA 3.38Å; N652-L667 VanDerWaalsContact OD1-CB 3.26Å; N652-L667 WeakPolarHBondContact OD1-CB 3.42Å; N652-L667 WeakPolarHBondContact OD1-CD1 3.49Å; N652-H1749 CarbonylContact C-O 2.69Å; N652-H1749 WeakPolarHBondContact CA-O 3.03Å; N652-H1749 PolarHBondContact N-O 2.91Å; N652-S1750 PolarHBondContact ND2-O 2.94Å; N652-S1750 CarbonylContact O-C 2.91Å; N652-S1750 WeakPolarHBondContact O-CA 3.33Å; N652-S1750 PolarHBondContact O-N 2.98Å; N652-S1750 VanDerWaalsContact O-O 3.05Å; N652-P1751 CarbonylContact C-O 3.59Å; N652-P1751 WeakPolarHBondContact ND2-CA 3.26Å; N652-P1751 CarbonylContact O-C 3.58Å; N652-P1751 WeakPolarHBondContact O-CA 3.38Å
653	N	49.9	Very low	70.6	Confident	108 Å²	108	73 Å²	73	58%	0.578	39%	0.387	S	S	*	.	S	Bend	trans	-59.3	7.2	-134.2	-32.5	117.8	0	0	0	131.8	H1749 P1751 T1752	N653-H1749 WeakPolarHBondContact CA-O 3.46Å; N653-H1749 PolarHBondContact N-O 3.5Å; N653-P1751 CarbonylContact C-O 3.58Å; N653-P1751 WeakPolarHBondContact CA-O 2.94Å; N653-P1751 PolarHBondContact N-O 3.41Å; N653-T1752 HydrophobicContact CB-CG2 3.76Å
654	V	58.5	Low	70.5	Confident	66 Å²	66	74.3 Å²	74.3	40%	0.4	40%	0.395	S	S	.	.	S	Bend	trans	-140.3	-111.6	177.7	-164.6	0	0	0	0	120	N652 S1750 P1751 T1752	N652-V654 PolarHBondContact O-N 2.97Å; V654-S1750 VanDerWaalsContact N-CA 3.33Å; V654-S1750 CarbonylContact O-C 3.44Å; V654-S1750 WeakPolarHBondContact O-CA 3.2Å; V654-S1750 WeakPolarHBondContact O-CB 3.19Å; V654-P1751 VanDerWaalsContact N-CA 3.25Å; V654-P1751 PolarHBondContact N-O 3.44Å; V654-P1751 WeakPolarHBondContact O-CD 3.21Å; V654-T1752 HydrophobicContact CG2-CG2 3.96Å
655	E	57.9	Low	70.6	Confident	146 Å²	146	73.5 Å²	73.5	68%	0.682	39%	0.391	S	S	*	.			trans	-134.1	137.6	-170.5	-80.1	156.3	-138.7	0	0	117.9	I657 P1751	E655-I657 PolarHBondContact O-N 3.18Å; E655-P1751 VanDerWaalsContact CA-CG 3.46Å; E655-P1751 WeakPolarHBondContact O-CG 3.35Å
656	P	64.2	Low	70.4	Confident	36 Å²	36	75.5 Å²	75.5	23%	0.234	40%	0.4	C	S	.	.			trans	-68.3	121.5	176.7	30	-34.4	0	0	0	110.4	L641 I658 T663 T664 I665	L641-P656 HydrophobicContact CB-CB 4.29Å; P656-I658 VanDerWaalsContact O-CG1 3.28Å; P656-I658 WeakPolarHBondContact O-CG1 3.48Å; P656-I658 PolarHBondContact O-N 2.88Å; P656-T663 HydrophobicContact CB-CG2 3.84Å; P656-T663 HydrophobicContact CG-CG2 4.21Å; P656-T664 CarbonylContact C-O 3.56Å; P656-T664 VanDerWaalsContact CA-O 3.24Å; P656-T664 WeakPolarHBondContact CA-O 3.45Å; P656-I665 HydrophobicContact CB-CB 4.14Å; P656-I665 HydrophobicContact CB-CG1 4.5Å
657	I	72.1	Confident	70.6	Confident	95 Å²	95	72.3 Å²	72.3	49%	0.487	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	113.2	-172	-53.3	173.6	0	0	0	109.8	E655 I659 T663 T664	E655-I657 PolarHBondContact O-N 3.18Å; I657-I659 HydrophobicContact CG2-CD1 4.26Å; I657-I659 HydrophobicContact CG2-CG1 3.99Å; I657-T663 CarbonylContact O-C 3.56Å; I657-T663 WeakPolarHBondContact O-CA 3.47Å; I657-T664 PolarHBondContact N-O 3.18Å; I657-T664 PolarHBondContact O-N 3.48Å
658	I	63.3	Low	70.8	Confident	72 Å²	72	66.4 Å²	66.4	37%	0.369	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	105.7	179.2	-46.8	-170.3	0	0	0	110.9	L638 P656 Q662 T663	L638-I658 HydrophobicContact CB-CD1 3.93Å; L638-I658 HydrophobicContact CD1-CD1 3.82Å; L638-I658 HydrophobicContact CG-CD1 4.33Å; P656-I658 VanDerWaalsContact O-CG1 3.28Å; P656-I658 WeakPolarHBondContact O-CG1 3.48Å; P656-I658 PolarHBondContact O-N 2.88Å; I658-Q662 CarbonylContact C-O 3.49Å; I658-Q662 WeakPolarHBondContact CA-O 3.36Å; I658-T663 HydrophobicContact CD1-CG2 4.45Å; I658-T663 HydrophobicContact CG1-CG2 4.15Å
659	I	66.4	Low	71	Confident	124 Å²	124	62 Å²	62	64%	0.636	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.6	94.5	176.1	-54.7	-178.1	0	0	0	108.7	I657 K661 Q662	I657-I659 HydrophobicContact CG2-CD1 4.26Å; I657-I659 HydrophobicContact CG2-CG1 3.99Å; I659-K661 PolarHBondContact O-N 2.87Å; I659-Q662 PolarHBondContact N-O 2.93Å; I659-Q662 PolarHBondContact O-N 3.25Å
660	G	66.7	Low	71.2	Confident	73 Å²	73	61.7 Å²	61.7	75%	0.753	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.1	-90.2	179	0	0	0	0	0	112.5
661	K	67	Low	71.4	Confident	170 Å²	170	60.7 Å²	60.7	74%	0.739	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.6	-5.5	171.8	-70	-169.9	177.3	-173	0	113.5	T633 G634 I659	T633-K661 CarbonylContact C-O 3.58Å; T633-K661 WeakPolarHBondContact CA-O 3.47Å; T633-K661 VanDerWaalsContact CB-O 3.3Å; T633-K661 WeakPolarHBondContact CB-O 3.23Å; T633-K661 WeakPolarHBondContact CG2-O 3.07Å; G634-K661 PolarHBondContact N-O 3Å; I659-K661 PolarHBondContact O-N 2.87Å
662	Q	73.9	Confident	72.3	Confident	97 Å²	97	62.4 Å²	62.4	45%	0.453	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	133.5	-174.3	-168.8	179	-2.4	0	0	111.6	T632 T633 I658 I659	T632-Q662 CarbonylContact O-C 3.52Å; T632-Q662 WeakPolarHBondContact O-CA 3.41Å; T632-Q662 WeakPolarHBondContact O-CG 3.48Å; T633-Q662 HydrophobicContact CG2-CB 3.93Å; T633-Q662 HydrophobicContact CG2-CG 4.02Å; I658-Q662 CarbonylContact C-O 3.49Å; I658-Q662 WeakPolarHBondContact CA-O 3.36Å; I659-Q662 PolarHBondContact N-O 2.93Å; I659-Q662 PolarHBondContact O-N 3.25Å
663	T	79.3	Confident	73.5	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	140.6	-173.9	-57.2	0	0	0	0	109.4	T631 T632 L641 P656 I657 I658	T631-T663 CarbonylContact C-O 3.53Å; T632-T663 HydrophobicContact CG2-CG2 4.36Å; T632-T663 PolarHBondContact N-O 2.59Å; T632-T663 PolarHBondContact O-N 2.87Å; L641-T663 HydrophobicContact CB-CG2 4.4Å; L641-T663 HydrophobicContact CD1-CG2 3.9Å; L641-T663 HydrophobicContact CG-CG2 4.09Å; P656-T663 HydrophobicContact CB-CG2 3.84Å; P656-T663 HydrophobicContact CG-CG2 4.21Å; I657-T663 CarbonylContact O-C 3.56Å; I657-T663 WeakPolarHBondContact O-CA 3.47Å; I658-T663 HydrophobicContact CD1-CG2 4.45Å; I658-T663 HydrophobicContact CG1-CG2 4.15Å
664	T	84.2	Confident	74.7	Confident	27 Å²	27	62.4 Å²	62.4	17%	0.166	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	124.5	-168.6	-76.9	0	0	0	0	114.8	C630 T631 P656 I657	C630-T664 CarbonylContact O-C 3.58Å; T631-T664 HydrophobicContact CG2-CG2 3.94Å; T631-T664 WeakPolarHBondContact CG2-OG1 3.06Å; P656-T664 CarbonylContact C-O 3.56Å; P656-T664 VanDerWaalsContact CA-O 3.24Å; P656-T664 WeakPolarHBondContact CA-O 3.45Å; I657-T664 PolarHBondContact N-O 3.18Å; I657-T664 PolarHBondContact O-N 3.48Å
665	I	85.7	Confident	75.8	Confident	2 Å²	2	60 Å²	60	1%	0.01	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	123.3	-168.6	-166	166.9	0	0	0	113.7	C630 L641 W643 P656 P1751	C630-I665 WeakPolarHBondContact CA-O 3.31Å; C630-I665 HydrophobicContact CB-CG2 3.79Å; C630-I665 PolarHBondContact N-O 3.37Å; C630-I665 PolarHBondContact O-N 3.42Å; L641-I665 HydrophobicContact CB-CB 4.13Å; L641-I665 HydrophobicContact CB-CD1 4.3Å; L641-I665 HydrophobicContact CB-CG2 3.93Å; L641-I665 HydrophobicContact CD1-CB 4.02Å; L641-I665 HydrophobicContact CD1-CG2 3.72Å; L641-I665 HydrophobicContact CD2-CG2 4.45Å; L641-I665 HydrophobicContact CG-CG2 4.26Å; L641-I665 VanDerWaalsContact O-CD1 3.29Å; L641-I665 WeakPolarHBondContact O-CD1 3.41Å; W643-I665 PolarHBondContact NE1-O 2.86Å; P656-I665 HydrophobicContact CB-CB 4.14Å; P656-I665 HydrophobicContact CB-CG1 4.5Å; I665-P1751 HydrophobicContact CD1-CG 4.49Å; I665-P1751 HydrophobicContact CG1-CB 3.82Å; I665-P1751 HydrophobicContact CG1-CG 3.86Å
666	K	82.5	Confident	77.1	Confident	84 Å²	84	55.1 Å²	55.1	37%	0.365	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	154.9	171.6	-71.3	-165.3	152.2	-159.4	0	112	E627 L628 T629 N652 P1751	E627-K666 WeakPolarHBondContact OE1-CD 3.43Å; E627-K666 IonicContact OE1-NZ 3.37Å; E627-K666 PolarHBondContact OE1-NZ 2.78Å; L628-K666 WeakPolarHBondContact O-CA 3.35Å; T629-K666 HydrophobicContact CG2-CG 4.09Å; T629-K666 WeakPolarHBondContact OG1-CE 3.36Å; N652-K666 PolarHBondContact ND2-O 3.48Å; N652-K666 VanDerWaalsContact ND2-O 3.12Å; K666-P1751 WeakPolarHBondContact O-CB 3.3Å
667	L	83.1	Confident	77.9	Confident	3 Å²	3	55.7 Å²	55.7	2%	0.016	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	101.3	173.1	162.7	51.7	0	0	0	109.5	E627 L628 W643 I650 N652 L669 Y680	E627-L667 CarbonylContact C-O 3.55Å; E627-L667 WeakPolarHBondContact CA-O 3.04Å; L628-L667 HydrophobicContact CB-CB 4.19Å; L628-L667 HydrophobicContact CB-CG 4.45Å; L628-L667 HydrophobicContact CD1-CD2 3.81Å; L628-L667 HydrophobicContact CD1-CG 4.04Å; L628-L667 HydrophobicContact CG-CG 4.5Å; L628-L667 PolarHBondContact N-O 3.33Å; L628-L667 PolarHBondContact O-N 2.59Å; W643-L667 HydrophobicContact CB-CD2 4.24Å; W643-L667 HydrophobicContact CD2-CB 3.81Å; W643-L667 HydrophobicContact CD2-CD2 3.64Å; W643-L667 HydrophobicContact CD2-CG 4.4Å; W643-L667 HydrophobicContact CE3-CB 4.32Å; W643-L667 HydrophobicContact CE3-CD2 3.48Å; W643-L667 VanDerWaalsContact CE3-CD2 3.48Å; W643-L667 HydrophobicContact CG-CB 4.11Å; W643-L667 HydrophobicContact CG-CD2 4.01Å; W643-L667 HydrophobicContact CH2-CB 4.43Å; W643-L667 HydrophobicContact CZ2-CB 3.94Å; W643-L667 HydrophobicContact CZ3-CD2 3.98Å; I650-L667 HydrophobicContact CD1-CD2 3.87Å; I650-L667 HydrophobicContact CG2-CD1 4.02Å; I650-L667 HydrophobicContact CG2-CD2 4.28Å; N652-L667 HydrophobicContact CB-CD1 3.58Å; N652-L667 WeakPolarHBondContact OD1-CA 3.38Å; N652-L667 VanDerWaalsContact OD1-CB 3.26Å; N652-L667 WeakPolarHBondContact OD1-CB 3.42Å; N652-L667 WeakPolarHBondContact OD1-CD1 3.49Å; L667-L669 HydrophobicContact CD1-CB 3.91Å; L667-L669 HydrophobicContact CG-CD2 4.45Å; L667-Y680 HydrophobicContact CD2-CD1 3.71Å; L667-Y680 HydrophobicContact CD2-CE1 4.18Å
668	K	79.7	Confident	78.4	Confident	50 Å²	50	51.4 Å²	51.4	22%	0.217	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	117.9	164.4	-79.5	-176.9	171.5	-177.9	0	108.1	L625 L626 E627 P1753	L625-K668 HydrophobicContact CD1-CB 4.24Å; L626-K668 CarbonylContact O-C 3.52Å; L626-K668 WeakPolarHBondContact O-CA 2.99Å; E627-K668 HydrophobicContact CB-CG 4.07Å; E627-K668 HydrophobicContact CG-CG 3.79Å; E627-K668 WeakPolarHBondContact OE2-CE 3.41Å; E627-K668 IonicContact OE2-NZ 2.65Å; K668-P1753 HydrophobicContact CD-CG 4Å
669	L	81.1	Confident	79.5	Confident	13 Å²	13	52.8 Å²	52.8	7%	0.068	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	137.4	179.6	75.2	92.9	0	0	0	110	L626 L628 L667 P671 Y680 L701	L626-L669 HydrophobicContact CB-CD1 4.14Å; L626-L669 HydrophobicContact CB-CG 4.11Å; L626-L669 HydrophobicContact CD2-CD1 4.21Å; L626-L669 HydrophobicContact CD2-CD2 4.39Å; L626-L669 HydrophobicContact CD2-CG 4.41Å; L626-L669 HydrophobicContact CG-CG 4.47Å; L626-L669 PolarHBondContact N-O 3.15Å; L626-L669 PolarHBondContact O-N 2.97Å; L626-L669 VanDerWaalsContact O-O 3.13Å; L628-L669 HydrophobicContact CD1-CD2 4.02Å; L667-L669 HydrophobicContact CD1-CB 3.91Å; L667-L669 HydrophobicContact CG-CD2 4.45Å; L669-P671 HydrophobicContact CD1-CB 4.5Å; L669-P671 HydrophobicContact CD1-CG 3.81Å; L669-Y680 HydrophobicContact CD2-CD1 4.42Å; L669-Y680 HydrophobicContact CD2-CE1 3.95Å; L669-L701 HydrophobicContact CD1-CD1 3.83Å; L669-L701 HydrophobicContact CD2-CD1 4.07Å
670	V	82.4	Confident	80.6	Confident	63 Å²	63	47.1 Å²	47.1	38%	0.382	26%	0.257	S	S	.	.			trans	-107.4	108	171.7	175.8	0	0	0	0	105.2	A623 L625 Q672	A623-V670 VanDerWaalsContact CA-CG1 3.46Å; A623-V670 HydrophobicContact CB-CG1 4.44Å; L625-V670 HydrophobicContact CB-CG2 4.48Å; L625-V670 HydrophobicContact CD1-CG2 3.7Å; V670-Q672 PolarHBondContact O-N 2.67Å; V670-Q672 VanDerWaalsContact O-N 3.14Å; V670-Q672 PolarHBondContact O-NE2 3.47Å
671	P	81.1	Confident	81.6	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.006	23%	0.226	C	C	.	.			trans	-54.5	120.7	-171.3	-26.3	35.3	0	0	0	111.5	V620 M622 A623 H624 L669 D675 V703	V620-P671 HydrophobicContact CB-CG 4.36Å; V620-P671 HydrophobicContact CG1-CG 4Å; M622-P671 VanDerWaalsContact CA-O 3.32Å; M622-P671 WeakPolarHBondContact CA-O 3.31Å; A623-P671 PolarHBondContact N-O 2.98Å; A623-P671 VanDerWaalsContact N-O 3.13Å; H624-P671 WeakPolarHBondContact O-CD 3.36Å; L669-P671 HydrophobicContact CD1-CB 4.5Å; L669-P671 HydrophobicContact CD1-CG 3.81Å; P671-D675 WeakPolarHBondContact CA-OD2 3.16Å; P671-V703 HydrophobicContact CB-CG1 3.98Å; P671-V703 HydrophobicContact CB-CG2 3.74Å
672	Q	82.9	Confident	82.7	Confident	75 Å²	75	36.7 Å²	36.7	35%	0.35	19%	0.191	S	C	.	.			trans	-95.9	173	168.5	-56	-51.8	-57.4	0	0	109.5	V670 E674 D675	V670-Q672 PolarHBondContact O-N 2.67Å; V670-Q672 VanDerWaalsContact O-N 3.14Å; V670-Q672 PolarHBondContact O-NE2 3.47Å; Q672-E674 WeakPolarHBondContact CB-OE2 3.4Å; Q672-E674 PolarHBondContact O-N 2.92Å; Q672-D675 PolarHBondContact N-OD2 2.96Å; Q672-D675 PolarHBondContact O-N 2.94Å; Q672-D675 VanDerWaalsContact O-N 3.11Å
673	K	81	Confident	83.3	Confident	20 Å²	20	32 Å²	32	9%	0.087	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-58.2	-40.5	176.1	59.5	178.5	-168.2	-177	0	109.8	M622 D675 N676 F705 S796	M622-K673 HydrophobicContact CE-CB 3.7Å; M622-K673 HydrophobicContact CE-CG 3.98Å; K673-D675 PolarHBondContact O-N 2.84Å; K673-N676 WeakPolarHBondContact O-CB 3.24Å; K673-N676 PolarHBondContact O-N 2.91Å; K673-F705 HydrophobicContact CB-CB 4.05Å; K673-F705 HydrophobicContact CB-CD1 3.41Å; K673-F705 VanDerWaalsContact CB-CD1 3.41Å; K673-F705 HydrophobicContact CB-CD2 3.6Å; K673-F705 HydrophobicContact CB-CE1 3.63Å; K673-F705 HydrophobicContact CB-CE2 3.8Å; K673-F705 HydrophobicContact CB-CG 3.41Å; K673-F705 VanDerWaalsContact CB-CG 3.41Å; K673-F705 HydrophobicContact CB-CZ 3.82Å; K673-F705 HydrophobicContact CD-CD2 4.13Å; K673-F705 HydrophobicContact CD-CE2 4.22Å; K673-F705 HydrophobicContact CG-CD2 4.47Å; K673-S796 WeakPolarHBondContact CG-OG 3.26Å; K673-S796 WeakPolarHBondContact O-CB 3.16Å; K673-S796 PolarHBondContact O-OG 2.93Å
674	E	76.6	Confident	83.6	Confident	94 Å²	94	32 Å²	32	44%	0.439	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	-62.5	-13.6	179.8	-64.3	77.1	-169	0	0	114.1	K645 Q672 S796	K645-E674 VanDerWaalsContact NZ-C 3.33Å; K645-E674 PolarHBondContact NZ-O 3.46Å; Q672-E674 WeakPolarHBondContact CB-OE2 3.4Å; Q672-E674 PolarHBondContact O-N 2.92Å; E674-S796 WeakPolarHBondContact CA-OG 3.36Å; E674-S796 PolarHBondContact N-OG 2.95Å
675	D	81.4	Confident	83.6	Confident	16 Å²	16	34.1 Å²	34.1	9%	0.086	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-86.7	-8.2	177.3	-60.2	-34.2	0	0	0	112.6	K645 P671 Q672 K673 G677 A678 Y680 L701 V703	K645-D675 WeakPolarHBondContact CE-OD1 3.26Å; K645-D675 IonicContact NZ-OD1 2.95Å; K645-D675 PolarHBondContact NZ-OD1 3.26Å; P671-D675 WeakPolarHBondContact CA-OD2 3.16Å; Q672-D675 PolarHBondContact N-OD2 2.96Å; Q672-D675 PolarHBondContact O-N 2.94Å; Q672-D675 VanDerWaalsContact O-N 3.11Å; K673-D675 PolarHBondContact O-N 2.84Å; D675-G677 PolarHBondContact O-N 2.91Å; D675-A678 PolarHBondContact O-N 2.93Å; D675-Y680 PolarHBondContact OD1-OH 3.41Å; D675-L701 HydrophobicContact CB-CD1 3.96Å; D675-L701 VanDerWaalsContact O-CB 3.26Å; D675-L701 WeakPolarHBondContact O-CB 3.21Å; D675-V703 HydrophobicContact CB-CG2 4.13Å
676	N	84	Confident	83.2	Confident	43 Å²	43	34.5 Å²	34.5	23%	0.23	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	97.7	178.6	-166.5	27.9	0	0	0	111.7	K673 N702 V703 S796	K673-N676 WeakPolarHBondContact O-CB 3.24Å; K673-N676 PolarHBondContact O-N 2.91Å; N676-N702 WeakPolarHBondContact OD1-CA 3.46Å; N676-N702 PolarHBondContact OD1-OD1 3.42Å; N676-V703 HydrophobicContact CB-CB 4.13Å; N676-V703 HydrophobicContact CB-CG2 4.34Å; N676-V703 PolarHBondContact OD1-N 3.03Å; N676-S796 WeakPolarHBondContact CB-O 3.25Å; N676-S796 PolarHBondContact ND2-O 3.01Å
677	G	81.9	Confident	82.5	Confident	48 Å²	48	33.5 Å²	33.5	50%	0.495	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	103.6	0.4	179.5	0	0	0	0	0	116.9	D675 T700 L701	D675-G677 PolarHBondContact O-N 2.91Å; G677-T700 VanDerWaalsContact O-CG2 3.27Å; G677-T700 WeakPolarHBondContact O-CG2 3.34Å; G677-L701 VanDerWaalsContact CA-O 3.31Å; G677-L701 WeakPolarHBondContact CA-O 3.46Å; G677-L701 PolarHBondContact N-O 2.74Å
678	A	83.4	Confident	81.7	Confident	4 Å²	4	35.2 Å²	35.2	3%	0.033	19%	0.192	C	C	.	.			trans	-88.1	148.1	-166.6	0	0	0	0	0	116.1	K645 D646 D675 Y680 T700 L701	K645-A678 HydrophobicContact CD-CB 4.19Å; K645-A678 HydrophobicContact CG-CB 4.02Å; D646-A678 WeakPolarHBondContact OD2-CA 3.24Å; D646-A678 WeakPolarHBondContact OD2-CB 3.26Å; D675-A678 PolarHBondContact O-N 2.93Å; A678-Y680 HydrophobicContact CB-CE2 3.94Å; A678-Y680 WeakPolarHBondContact O-CD2 3.34Å; A678-Y680 WeakPolarHBondContact O-CE2 3.22Å; A678-T700 VanDerWaalsContact O-CA 3.23Å; A678-T700 WeakPolarHBondContact O-CA 3.36Å; A678-L701 PolarHBondContact O-N 2.66Å
679	Q	85	Confident	81	Confident	101 Å²	101	34.9 Å²	34.9	47%	0.472	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	147.8	-177.3	-54.8	-166.3	-8.6	0	0	115.4	K645 D646 I699 T700	K645-Q679 CarbonylContact C-O 3.53Å; K645-Q679 WeakPolarHBondContact CA-O 3.48Å; D646-Q679 PolarHBondContact N-O 2.66Å; D646-Q679 WeakPolarHBondContact OD1-CB 3.5Å; D646-Q679 PolarHBondContact OD1-N 3.09Å; D646-Q679 PolarHBondContact OD2-N 2.94Å; Q679-I699 CarbonylContact C-O 3.54Å; Q679-I699 WeakPolarHBondContact CA-O 3.31Å; Q679-T700 HydrophobicContact CG-CG2 4.26Å
680	Y	89	Confident	80.2	Confident	5 Å²	5	41.2 Å²	41.2	2%	0.02	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	118.2	-168.1	-71.9	-107.1	0	0	0	118.1	L628 F644 K645 I650 L667 L669 D675 A678 A698 I699 L701	L628-Y680 HydrophobicContact CD1-CD1 4.5Å; F644-Y680 CarbonylContact O-C 3.29Å; F644-Y680 WeakPolarHBondContact O-CA 3.33Å; K645-Y680 HydrophobicContact CB-CE1 4.48Å; K645-Y680 HydrophobicContact CG-CE1 4.43Å; K645-Y680 HydrophobicContact CG-CE2 4.29Å; I650-Y680 HydrophobicContact CD1-CD1 3.21Å; I650-Y680 HydrophobicContact CD1-CE1 3.52Å; I650-Y680 HydrophobicContact CD1-CG 4.17Å; I650-Y680 HydrophobicContact CG1-CD1 4.49Å; I650-Y680 HydrophobicContact CG1-CE1 4.43Å; L667-Y680 HydrophobicContact CD2-CD1 3.71Å; L667-Y680 HydrophobicContact CD2-CE1 4.18Å; L669-Y680 HydrophobicContact CD2-CD1 4.42Å; L669-Y680 HydrophobicContact CD2-CE1 3.95Å; D675-Y680 PolarHBondContact OD1-OH 3.41Å; A678-Y680 HydrophobicContact CB-CE2 3.94Å; A678-Y680 WeakPolarHBondContact O-CD2 3.34Å; A678-Y680 WeakPolarHBondContact O-CE2 3.22Å; Y680-A698 WeakPolarHBondContact O-CA 3.44Å; Y680-I699 PolarHBondContact N-O 2.9Å; Y680-I699 PolarHBondContact O-N 2.78Å; Y680-L701 HydrophobicContact CD2-CD1 4.33Å; Y680-L701 HydrophobicContact CE2-CD1 3.46Å; Y680-L701 VanDerWaalsContact CE2-CD1 3.46Å; Y680-L701 HydrophobicContact CE2-CG 3.97Å; Y680-L701 WeakPolarHBondContact OH-CD1 3.33Å
681	H	88.8	Confident	79.3	Confident	24 Å²	24	42.5 Å²	42.5	11%	0.111	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	-165.1	175.4	65.5	-87.9	0	0	0	116.8	I611 W643 F644 S696 E697 A698	I611-H681 HydrophobicContact CD1-CB 4.24Å; W643-H681 CarbonylContact C-O 3.57Å; W643-H681 VanDerWaalsContact CA-O 3.23Å; W643-H681 WeakPolarHBondContact CA-O 3.13Å; F644-H681 WeakPolarHBondContact CB-NE2 3.26Å; F644-H681 AromaticContact CG-CD2 3.95Å; F644-H681 AromaticContact CG-NE2 3.75Å; F644-H681 PolarHBondContact N-O 2.71Å; F644-H681 PolarHBondContact O-N 3.1Å; H681-S696 WeakPolarHBondContact CB-O 3.48Å; H681-E697 WeakPolarHBondContact CA-O 3.37Å; H681-E697 WeakPolarHBondContact CB-O 3.12Å; H681-A698 HydrophobicContact CB-CB 4.14Å
682	C	88.9	Confident	79	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	146.9	-170.1	178.2	0	0	0	0	117.2	I611 C630 Q642 W643 D695 S696	I611-C682 HydrophobicContact CD1-CB 3.59Å; I611-C682 HydrophobicContact CG1-CB 3.91Å; C630-C682 HydrophobicContact CB-CB 3.91Å; C630-C682 WeakPolarHBondContact CB-SG 3.22Å; C630-C682 WeakPolarHBondContact SG-CB 3.45Å; C630-C682 CovalentContact SG-SG 2.05Å; C630-C682 PolarHBondContact SG-SG 3.33Å; Q642-C682 CarbonylContact O-C 3.37Å; Q642-C682 WeakPolarHBondContact O-CA 3.16Å; Q642-C682 PolarHBondContact O-SG 3.44Å; Q642-C682 VanDerWaalsContact O-SG 3.34Å; W643-C682 HydrophobicContact CD2-CB 4.22Å; W643-C682 HydrophobicContact CG-CB 4.35Å; C682-D695 CarbonylContact O-C 3.6Å; C682-D695 VanDerWaalsContact O-C 3.31Å; C682-D695 WeakPolarHBondContact O-CA 3.35Å; C682-S696 WeakPolarHBondContact CA-OG 3.45Å; C682-S696 WeakPolarHBondContact CB-OG 3.29Å; C682-S696 PolarHBondContact N-OG 3.47Å; C682-S696 WeakPolarHBondContact O-CB 3.49Å; C682-S696 PolarHBondContact O-N 2.95Å; C682-S696 PolarHBondContact O-OG 3.34Å
683	S	87.8	Confident	78.9	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	172.8	-172.6	-41.2	0	0	0	0	117.9	L641 Q642 F644 I694 D695	L641-S683 WeakPolarHBondContact CA-O 3.06Å; L641-S683 WeakPolarHBondContact CD2-O 3.49Å; Q642-S683 PolarHBondContact N-O 2.84Å; Q642-S683 PolarHBondContact O-N 3.45Å; F644-S683 WeakPolarHBondContact CD2-OG 3.47Å; F644-S683 WeakPolarHBondContact CE2-OG 3.49Å; S683-I694 CarbonylContact C-O 3.6Å; S683-I694 WeakPolarHBondContact CA-O 3.34Å; S683-I694 WeakPolarHBondContact CB-O 3.05Å; S683-D695 WeakPolarHBondContact CB-OD1 3.41Å; S683-D695 WeakPolarHBondContact OG-CA 3.46Å; S683-D695 PolarHBondContact OG-OD1 3.13Å
684	A	86.2	Confident	79	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	153.9	-178.6	0	0	0	0	0	119.5	D607 T632 E640 L641 W693 I694	D607-A684 VanDerWaalsContact O-CB 3.29Å; D607-A684 WeakPolarHBondContact O-CB 3.5Å; T632-A684 HydrophobicContact CG2-CB 4.16Å; E640-A684 WeakPolarHBondContact O-CA 3.04Å; E640-A684 WeakPolarHBondContact O-CB 3.28Å; L641-A684 HydrophobicContact CD2-CB 4.06Å; A684-W693 WeakPolarHBondContact O-CA 3.49Å; A684-I694 PolarHBondContact N-O 3.23Å; A684-I694 VanDerWaalsContact N-O 3.08Å; A684-I694 PolarHBondContact O-N 3.12Å
685	R	83.5	Confident	79.4	Confident	71 Å²	71	52.7 Å²	52.7	27%	0.268	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.4	178.6	176.8	70.9	163.7	179.4	-156.3	-10.6	117.7	P639 E640 E692 W693	P639-R685 VanDerWaalsContact CA-O 3.31Å; P639-R685 WeakPolarHBondContact CA-O 3.38Å; E640-R685 HydrophobicContact CB-CG 4.15Å; E640-R685 PolarHBondContact N-O 3.36Å; E640-R685 PolarHBondContact O-N 3.38Å; E640-R685 VanDerWaalsContact O-N 3.16Å; E640-R685 IonicContact OE1-NH2 2.68Å; E640-R685 PolarHBondContact OE1-NH2 3.39Å; E640-R685 IonicContact OE2-CZ 3.16Å; E640-R685 IonicContact OE2-NE 2.74Å; E640-R685 PolarHBondContact OE2-NE 3.46Å; E640-R685 IonicContact OE2-NH2 2.72Å; E640-R685 PolarHBondContact OE2-NH2 3.38Å; R685-E692 WeakPolarHBondContact CB-O 3.44Å; R685-W693 HydrophobicContact CB-CD2 3.91Å; R685-W693 HydrophobicContact CB-CE3 3.86Å; R685-W693 HydrophobicContact CB-CG 4.34Å; R685-W693 HydrophobicContact CB-CZ3 4.28Å; R685-W693 VanDerWaalsContact CD-CE2 3.43Å; R685-W693 HydrophobicContact CG-CD2 3.79Å; R685-W693 HydrophobicContact CG-CE3 3.77Å; R685-W693 HydrophobicContact CG-CH2 3.78Å; R685-W693 HydrophobicContact CG-CZ2 3.83Å; R685-W693 HydrophobicContact CG-CZ3 3.76Å; R685-W693 VanDerWaalsContact NE-CZ2 3.27Å
686	N	78	Confident	79.6	Confident	9 Å²	9	53.4 Å²	53.4	5%	0.048	29%	0.288	C	S	.	.			trans	-159.1	-174.9	155.3	93	-0.8	0	0	0	117.8	H604 P605 P606 P637 A688 T689	H604-N686 PolarHBondContact O-ND2 2.91Å; P605-N686 WeakPolarHBondContact CA-ND2 3.29Å; P605-N686 WeakPolarHBondContact CA-OD1 3.24Å; P606-N686 HydrophobicContact CG-CB 3.96Å; P637-N686 PolarHBondContact O-ND2 2.97Å; N686-A688 VanDerWaalsContact C-N 3.34Å; N686-A688 PolarHBondContact O-N 3.11Å; N686-A688 PolarHBondContact OD1-N 2.67Å; N686-T689 PolarHBondContact O-N 3.34Å; N686-T689 PolarHBondContact O-OG1 3.31Å
687	T	67.6	Low	79.6	Confident	64 Å²	64	59.5 Å²	59.5	39%	0.393	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-11.4	-173.6	58.9	0	0	0	0	117.8	I603 P637	I603-T687 WeakPolarHBondContact CD1-OG1 3.45Å; P637-T687 HydrophobicContact CG-CG2 4.24Å
688	A	65.2	Low	79.7	Confident	39 Å²	39	59.7 Å²	59.7	32%	0.322	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.4	3.6	179.4	0	0	0	0	0	113.7	H604 P605 N686	H604-A688 VanDerWaalsContact CA-CB 3.47Å; P605-A688 HydrophobicContact CB-CB 4.07Å; P605-A688 HydrophobicContact CG-CB 4.39Å; N686-A688 VanDerWaalsContact C-N 3.34Å; N686-A688 PolarHBondContact O-N 3.11Å; N686-A688 PolarHBondContact OD1-N 2.67Å
689	T	65.4	Low	79.9	Confident	42 Å²	42	61.2 Å²	61.2	26%	0.258	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	6.4	162.5	65.7	0	0	0	0	112.4	P605 P606 N686 N691 E692	P605-T689 HydrophobicContact CB-CG2 3.97Å; P606-T689 HydrophobicContact CG-CG2 3.98Å; N686-T689 PolarHBondContact O-N 3.34Å; N686-T689 PolarHBondContact O-OG1 3.31Å; T689-N691 PolarHBondContact O-N 3.44Å; T689-N691 PolarHBondContact OG1-N 2.89Å; T689-E692 PolarHBondContact OG1-N 2.85Å
690	N	63.6	Low	80	Confident	146 Å²	146	58.3 Å²	58.3	78%	0.781	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	23.4	-161.5	-55.2	-41.4	0	0	0	113.5
691	N	63.7	Low	79.9	Confident	91 Å²	91	58.5 Å²	58.5	49%	0.487	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.4	22.4	170.4	-45.3	-58.9	0	0	0	118.4	T689	T689-N691 PolarHBondContact O-N 3.44Å; T689-N691 PolarHBondContact OG1-N 2.89Å
692	E	74.9	Confident	79.8	Confident	154 Å²	154	59.9 Å²	59.9	72%	0.72	32%	0.318	S	S	*	.			trans	-79.3	153.8	175.8	-60.4	-173	157.6	0	0	114.2	R685 T689	R685-E692 WeakPolarHBondContact CB-O 3.44Å; T689-E692 PolarHBondContact OG1-N 2.85Å
693	W	80.7	Confident	79.7	Confident	80 Å²	80	59.9 Å²	59.9	30%	0.303	32%	0.318	S	S	.	.			trans	-118.2	164.6	-169.9	-75.7	108.5	0	0	0	114.9	E640 Q642 A684 R685	E640-W693 HydrophobicContact CB-CH2 4.38Å; E640-W693 HydrophobicContact CG-CH2 3.95Å; Q642-W693 HydrophobicContact CB-CH2 3.63Å; Q642-W693 HydrophobicContact CB-CZ3 3.78Å; Q642-W693 HydrophobicContact CG-CH2 4.22Å; A684-W693 WeakPolarHBondContact O-CA 3.49Å; R685-W693 HydrophobicContact CB-CD2 3.91Å; R685-W693 HydrophobicContact CB-CE3 3.86Å; R685-W693 HydrophobicContact CB-CG 4.34Å; R685-W693 HydrophobicContact CB-CZ3 4.28Å; R685-W693 VanDerWaalsContact CD-CE2 3.43Å; R685-W693 HydrophobicContact CG-CD2 3.79Å; R685-W693 HydrophobicContact CG-CE3 3.77Å; R685-W693 HydrophobicContact CG-CH2 3.78Å; R685-W693 HydrophobicContact CG-CZ2 3.83Å; R685-W693 HydrophobicContact CG-CZ3 3.76Å; R685-W693 VanDerWaalsContact NE-CZ2 3.27Å
694	I	82.9	Confident	79.7	Confident	69 Å²	69	62.9 Å²	62.9	35%	0.354	33%	0.334	S	S	.	.	B	Isolated β-bridge	trans	-148.4	123.5	-176.8	-33.6	175.4	0	0	0	113.3	I608 P609 S683 A684	I608-I694 HydrophobicContact CB-CG2 4.4Å; I608-I694 HydrophobicContact CD1-CD1 4.47Å; I608-I694 HydrophobicContact CD1-CG2 4.44Å; I608-I694 HydrophobicContact CG1-CD1 3.76Å; I608-I694 HydrophobicContact CG1-CG2 4.13Å; I608-I694 HydrophobicContact CG2-CB 4.42Å; I608-I694 HydrophobicContact CG2-CG2 3.69Å; P609-I694 WeakPolarHBondContact CD-O 3.41Å; S683-I694 CarbonylContact C-O 3.6Å; S683-I694 WeakPolarHBondContact CA-O 3.34Å; S683-I694 WeakPolarHBondContact CB-O 3.05Å; A684-I694 PolarHBondContact N-O 3.23Å; A684-I694 VanDerWaalsContact N-O 3.08Å; A684-I694 PolarHBondContact O-N 3.12Å
695	D	85.2	Confident	79.8	Confident	100 Å²	100	62.9 Å²	62.9	54%	0.535	33%	0.334	S	S	.	.			trans	-112.9	-175.1	-155.1	-49.5	-29.3	0	0	0	120.2	C682 S683	C682-D695 CarbonylContact O-C 3.6Å; C682-D695 VanDerWaalsContact O-C 3.31Å; C682-D695 WeakPolarHBondContact O-CA 3.35Å; S683-D695 WeakPolarHBondContact CB-OD1 3.41Å; S683-D695 WeakPolarHBondContact OG-CA 3.46Å; S683-D695 PolarHBondContact OG-OD1 3.13Å
696	S	87	Confident	79.9	Confident	32 Å²	32	60.6 Å²	60.6	22%	0.224	33%	0.328	C	S	.	.			trans	-152.2	-170.5	-179.8	66.2	0	0	0	0	117.2	H681 C682	H681-S696 WeakPolarHBondContact CB-O 3.48Å; C682-S696 WeakPolarHBondContact CA-OG 3.45Å; C682-S696 WeakPolarHBondContact CB-OG 3.29Å; C682-S696 PolarHBondContact N-OG 3.47Å; C682-S696 WeakPolarHBondContact O-CB 3.49Å; C682-S696 PolarHBondContact O-N 2.95Å; C682-S696 PolarHBondContact O-OG 3.34Å
697	E	83.4	Confident	80.2	Confident	170 Å²	170	60.3 Å²	60.3	79%	0.794	33%	0.327	S	S	*	.			trans	-90	166.4	-170.4	-58.5	-179.3	158.1	0	0	116.8	H681	H681-E697 WeakPolarHBondContact CA-O 3.37Å; H681-E697 WeakPolarHBondContact CB-O 3.12Å
698	A	84.1	Confident	80.8	Confident	52 Å²	52	62.3 Å²	62.3	43%	0.43	33%	0.332	S	S	.	.			trans	-133.5	160	-163	0	0	0	0	0	121.5	Y680 H681	Y680-A698 WeakPolarHBondContact O-CA 3.44Å; H681-A698 HydrophobicContact CB-CB 4.14Å
699	I	87.6	Confident	81.7	Confident	36 Å²	36	68.7 Å²	68.7	19%	0.185	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	160.5	-175.4	63.2	179.6	0	0	0	115.9	Y614 L628 Q679 Y680	Y614-I699 HydrophobicContact CD1-CD1 4.26Å; L628-I699 HydrophobicContact CD1-CD1 4Å; L628-I699 HydrophobicContact CD2-CD1 3.72Å; Q679-I699 CarbonylContact C-O 3.54Å; Q679-I699 WeakPolarHBondContact CA-O 3.31Å; Y680-I699 PolarHBondContact N-O 2.9Å; Y680-I699 PolarHBondContact O-N 2.78Å
700	T	87.5	Confident	82.6	Confident	40 Å²	40	67 Å²	67	25%	0.245	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	136.2	-161.5	-37.6	0	0	0	0	120.9	Y614 S616 G617 G677 A678 Q679	Y614-T700 WeakPolarHBondContact CE1-O 3.23Å; S616-T700 WeakPolarHBondContact CA-O 3.21Å; S616-T700 WeakPolarHBondContact CB-O 3.38Å; S616-T700 PolarHBondContact OG-N 3.4Å; G617-T700 PolarHBondContact N-O 2.83Å; G677-T700 VanDerWaalsContact O-CG2 3.27Å; G677-T700 WeakPolarHBondContact O-CG2 3.34Å; A678-T700 VanDerWaalsContact O-CA 3.23Å; A678-T700 WeakPolarHBondContact O-CA 3.36Å; Q679-T700 HydrophobicContact CG-CG2 4.26Å
701	L	86.4	Confident	83.7	Confident	10 Å²	10	61.2 Å²	61.2	5%	0.052	31%	0.308	C	S	.	.			trans	-106.6	175	-169.1	-64.9	176	0	0	0	119.2	Y614 L626 L669 D675 G677 A678 Y680	Y614-L701 HydrophobicContact CD1-CD2 4.04Å; Y614-L701 HydrophobicContact CE1-CD2 3.5Å; Y614-L701 HydrophobicContact CE1-CG 4.44Å; Y614-L701 HydrophobicContact CE2-CD2 4.17Å; L626-L701 HydrophobicContact CD2-CD2 3.57Å; L669-L701 HydrophobicContact CD1-CD1 3.83Å; L669-L701 HydrophobicContact CD2-CD1 4.07Å; D675-L701 HydrophobicContact CB-CD1 3.96Å; D675-L701 VanDerWaalsContact O-CB 3.26Å; D675-L701 WeakPolarHBondContact O-CB 3.21Å; G677-L701 VanDerWaalsContact CA-O 3.31Å; G677-L701 WeakPolarHBondContact CA-O 3.46Å; G677-L701 PolarHBondContact N-O 2.74Å; A678-L701 PolarHBondContact O-N 2.66Å; Y680-L701 HydrophobicContact CD2-CD1 4.33Å; Y680-L701 HydrophobicContact CE2-CD1 3.46Å; Y680-L701 VanDerWaalsContact CE2-CD1 3.46Å; Y680-L701 HydrophobicContact CE2-CG 3.97Å; Y680-L701 WeakPolarHBondContact OH-CD1 3.33Å
702	N	87.2	Confident	84.7	Confident	52 Å²	52	57.5 Å²	57.5	28%	0.278	29%	0.288	S	S	.	.			trans	-155.1	130.2	-179.6	175.5	0.8	0	0	0	113.2	G617 V620 N676	G617-N702 PolarHBondContact O-ND2 3.26Å; V620-N702 PolarHBondContact N-O 2.87Å; N676-N702 WeakPolarHBondContact OD1-CA 3.46Å; N676-N702 PolarHBondContact OD1-OD1 3.42Å
703	V	86.5	Confident	85.1	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.006	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	142.8	-166	-163.4	0	0	0	0	117.7	V620 M622 P671 D675 N676 N736	V620-V703 VanDerWaalsContact O-CA 3.28Å; V620-V703 WeakPolarHBondContact O-CA 3.25Å; M622-V703 HydrophobicContact CB-CG1 4.26Å; P671-V703 HydrophobicContact CB-CG1 3.98Å; P671-V703 HydrophobicContact CB-CG2 3.74Å; D675-V703 HydrophobicContact CB-CG2 4.13Å; N676-V703 HydrophobicContact CB-CB 4.13Å; N676-V703 HydrophobicContact CB-CG2 4.34Å; N676-V703 PolarHBondContact OD1-N 3.03Å; V703-N736 PolarHBondContact O-ND2 3.09Å
704	L	88	Confident	84.8	Confident	63 Å²	63	54.5 Å²	54.5	33%	0.33	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	144.4	173	-53.9	-177.5	0	0	0	113.8	V620 M622 N736	V620-L704 PolarHBondContact O-N 3.25Å; V620-L704 VanDerWaalsContact O-N 3.1Å; M622-L704 WeakPolarHBondContact CB-O 3.38Å; M622-L704 PolarHBondContact N-O 3.22Å; L704-N736 WeakPolarHBondContact CD2-ND2 3.36Å
705	F	87.6	Confident	83.6	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.293	C	S	.	.	B	Isolated β-bridge	trans	-164.9	154.6	-171.7	53.7	-90.3	0	0	0	116.8	M622 K673 S734 N736 S796	M622-F705 HydrophobicContact CB-CB 4.12Å; M622-F705 HydrophobicContact CE-CB 3.64Å; M622-F705 HydrophobicContact CE-CG 4.44Å; M622-F705 HydrophobicContact SD-CB 3.91Å; K673-F705 HydrophobicContact CB-CB 4.05Å; K673-F705 HydrophobicContact CB-CD1 3.41Å; K673-F705 VanDerWaalsContact CB-CD1 3.41Å; K673-F705 HydrophobicContact CB-CD2 3.6Å; K673-F705 HydrophobicContact CB-CE1 3.63Å; K673-F705 HydrophobicContact CB-CE2 3.8Å; K673-F705 HydrophobicContact CB-CG 3.41Å; K673-F705 VanDerWaalsContact CB-CG 3.41Å; K673-F705 HydrophobicContact CB-CZ 3.82Å; K673-F705 HydrophobicContact CD-CD2 4.13Å; K673-F705 HydrophobicContact CD-CE2 4.22Å; K673-F705 HydrophobicContact CG-CD2 4.47Å; F705-S734 WeakPolarHBondContact CE2-O 3.36Å; F705-N736 HydrophobicContact CD1-CB 3.84Å; F705-N736 HydrophobicContact CD2-CB 4.36Å; F705-N736 HydrophobicContact CE1-CB 3.6Å; F705-N736 HydrophobicContact CE2-CB 4.15Å; F705-N736 HydrophobicContact CG-CB 4.22Å; F705-N736 HydrophobicContact CZ-CB 3.76Å; F705-N736 PolarHBondContact N-O 2.91Å; F705-N736 VanDerWaalsContact N-O 3.12Å; F705-N736 CarbonylContact O-C 3.41Å; F705-N736 PolarHBondContact O-N 3.42Å; F705-S796 WeakPolarHBondContact CE1-O 3.32Å; F705-S796 WeakPolarHBondContact CZ-O 3.26Å
706	P	85.2	Confident	82.2	Confident	23 Å²	23	50.8 Å²	50.8	15%	0.149	28%	0.282	C	S	.	.			trans	-87.3	170.9	174	35.8	-32.4	0	0	0	113.2	Y827 W832	P706-Y827 HydrophobicContact CB-CD1 4.43Å; P706-Y827 HydrophobicContact CB-CD2 3.69Å; P706-Y827 HydrophobicContact CB-CE2 4.09Å; P706-Y827 HydrophobicContact CB-CG 3.88Å; P706-Y827 HydrophobicContact CG-CD1 4.23Å; P706-Y827 HydrophobicContact CG-CD2 4.15Å; P706-Y827 HydrophobicContact CG-CE1 4.26Å; P706-Y827 HydrophobicContact CG-CE2 4.19Å; P706-Y827 HydrophobicContact CG-CG 4.17Å; P706-W832 HydrophobicContact CB-CH2 3.98Å; P706-W832 HydrophobicContact CB-CZ2 4.07Å
707	P	84.4	Confident	80.8	Confident	2 Å²	2	54.7 Å²	54.7	1%	0.013	30%	0.295	C	S	.	.			trans	-68.8	154.5	169.9	31.9	-36.6	0	0	0	110.8	D733 A739 W832	P707-D733 HydrophobicContact CB-CB 4.07Å; P707-A739 HydrophobicContact CG-CB 4.1Å; P707-W832 HydrophobicContact CG-CD2 4.02Å; P707-W832 HydrophobicContact CG-CE3 3.81Å; P707-W832 HydrophobicContact CG-CH2 3.9Å; P707-W832 HydrophobicContact CG-CZ2 4.06Å; P707-W832 HydrophobicContact CG-CZ3 3.76Å; P707-W832 VanDerWaalsContact O-CE2 3.27Å; P707-W832 VanDerWaalsContact O-CZ2 3.24Å; P707-W832 WeakPolarHBondContact O-CZ2 3.49Å; P707-W832 PolarHBondContact O-NE1 3.15Å
708	Q	81.3	Confident	79.8	Confident	107 Å²	107	50.6 Å²	50.6	50%	0.5	29%	0.285	S	S	.	.			trans	-102.6	-34.4	179.1	-75.2	174.6	-21.8	0	0	112.8
709	R	82.9	Confident	79.4	Confident	172 Å²	172	50.6 Å²	50.6	65%	0.649	28%	0.28	S	S	*	.			trans	-138.9	153.8	178.9	-174.4	174.5	-61.5	172.7	4	111.7	D733	R709-D733 WeakPolarHBondContact CB-OD2 3.38Å; R709-D733 PolarHBondContact N-OD2 3.19Å; R709-D733 PolarHBondContact O-N 2.92Å
710	V	85.4	Confident	79.2	Confident	6 Å²	6	49.5 Å²	49.5	4%	0.036	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	135.3	156.6	172.5	0	0	0	0	106.9	C730 Q731 A732 A822 W832 D834	V710-C730 WeakPolarHBondContact CG1-SG 3.27Å; V710-Q731 CarbonylContact C-O 3.38Å; V710-Q731 WeakPolarHBondContact CA-O 3.46Å; V710-A732 HydrophobicContact CG2-CB 4.19Å; V710-A822 HydrophobicContact CG2-CB 3.39Å; V710-W832 HydrophobicContact CB-CB 4.32Å; V710-W832 HydrophobicContact CG2-CB 3.57Å; V710-D834 WeakPolarHBondContact O-CB 3.24Å
711	S	85.7	Confident	79.1	Confident	25 Å²	25	52.7 Å²	52.7	18%	0.175	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	135.1	-179.5	55.6	0	0	0	0	112.8	C730 Q731 D834	S711-C730 WeakPolarHBondContact O-CA 3.22Å; S711-Q731 PolarHBondContact N-O 3.5Å; S711-Q731 PolarHBondContact O-N 3.37Å; S711-D834 WeakPolarHBondContact CA-OD2 3.49Å
712	L	86.1	Confident	79	Confident	14 Å²	14	54.2 Å²	54.2	7%	0.073	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	106.1	171.5	-74.9	178	0	0	0	111.2	I728 C730 W743 C820 D834 L836	L712-I728 HydrophobicContact CD2-CG2 3.9Å; L712-C730 HydrophobicContact CD2-CB 3.91Å; L712-W743 HydrophobicContact CD2-CE3 4.4Å; L712-W743 HydrophobicContact CD2-CH2 3.51Å; L712-W743 HydrophobicContact CD2-CZ3 3.4Å; L712-C820 HydrophobicContact CD1-CB 4.47Å; L712-C820 HydrophobicContact CD2-CB 3.55Å; L712-C820 HydrophobicContact CG-CB 4.16Å; L712-D834 HydrophobicContact CD1-CB 4.3Å; L712-D834 WeakPolarHBondContact CD1-O 3.15Å; L712-D834 HydrophobicContact CG-CB 4.07Å; L712-D834 PolarHBondContact N-OD2 2.79Å; L712-L836 HydrophobicContact CD1-CB 4.07Å
713	N	81.3	Confident	78.8	Confident	95 Å²	95	53.1 Å²	53.1	51%	0.508	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	117	171.2	-67.9	-32.9	0	0	0	109.6	N729	N713-N729 PolarHBondContact N-O 3.09Å; N713-N729 PolarHBondContact O-N 2.86Å
714	F	75.6	Confident	78.7	Confident	76 Å²	76	56.5 Å²	56.5	33%	0.333	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	135.9	171.6	48.7	-85.6	0	0	0	110.7	G716 L726 E727 L836	F714-G716 PolarHBondContact O-N 3.18Å; F714-L726 HydrophobicContact CB-CD1 4.22Å; F714-E727 WeakPolarHBondContact CA-O 3.28Å; F714-L836 HydrophobicContact CB-CD2 4.07Å; F714-L836 HydrophobicContact CD1-CD1 3.55Å; F714-L836 HydrophobicContact CD1-CD2 4.01Å; F714-L836 HydrophobicContact CD1-CG 4.42Å; F714-L836 HydrophobicContact CE1-CD1 3.69Å; F714-L836 HydrophobicContact CG-CD1 4.36Å; F714-L836 HydrophobicContact CG-CD2 4.27Å
715	G	57.3	Low	78.4	Confident	61 Å²	61	57.7 Å²	57.7	63%	0.629	32%	0.318	S	S	*	.	S	Bend	trans	-72.7	47.1	-168	0	0	0	0	0	116.6	E727	G715-E727 PolarHBondContact N-O 2.72Å; G715-E727 VanDerWaalsContact N-O 3.09Å
716	G	56.4	Low	78.2	Confident	30 Å²	30	58.2 Å²	58.2	31%	0.309	32%	0.321	S	S	.	.	S	Bend	trans	103.4	133.9	174.9	0	0	0	0	0	114.6	F714	F714-G716 PolarHBondContact O-N 3.18Å
717	K	58.3	Low	78.3	Confident	113 Å²	113	59.8 Å²	59.8	49%	0.491	33%	0.327	S	S	.	.			trans	64	122.9	-171.8	-48.9	176.4	-165.1	158.5	0	113	V719 E724 F1707	K717-V719 WeakPolarHBondContact CB-O 3.1Å; K717-V719 PolarHBondContact O-N 3.39Å; K717-E724 IonicContact NZ-OE1 3.87Å; K717-E724 PolarHBondContact NZ-OE1 2.79Å; K717-F1707 HydrophobicContact CG-CZ 4.38Å
718	S	60.7	Low	78.4	Confident	84 Å²	84	59.7 Å²	59.7	59%	0.587	33%	0.326	S	S	*	.	S	Bend	trans	-76	2.6	167.5	50.9	0	0	0	0	113.3	N839	S718-N839 WeakPolarHBondContact O-CB 3.04Å
719	V	76.9	Confident	78.8	Confident	53 Å²	53	56.2 Å²	56.2	32%	0.321	31%	0.311	S	S	.	.	S	Bend	trans	-135.5	119.1	-177.4	-173.8	0	0	0	0	107.9	K717 T841	K717-V719 WeakPolarHBondContact CB-O 3.1Å; K717-V719 PolarHBondContact O-N 3.39Å; V719-T841 HydrophobicContact CG1-CG2 3.44Å; V719-T841 VanDerWaalsContact CG1-CG2 3.44Å
720	V	83.4	Confident	79.1	Confident	12 Å²	12	48.1 Å²	48.1	7%	0.073	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	136.6	-171.1	-178.7	0	0	0	0	109.6	E724 L726 P809 N839 I840 T841	V720-E724 HydrophobicContact CG1-CB 3.82Å; V720-E724 HydrophobicContact CG1-CG 4.3Å; V720-L726 HydrophobicContact CG2-CD1 4.04Å; V720-L726 HydrophobicContact CG2-CD2 4.36Å; V720-P809 HydrophobicContact CG1-CG 3.93Å; V720-N839 PolarHBondContact N-O 2.88Å; V720-N839 VanDerWaalsContact N-O 3.09Å; V720-I840 CarbonylContact O-C 2.63Å; V720-I840 WeakPolarHBondContact O-CA 3.2Å; V720-I840 WeakPolarHBondContact O-CG2 3.2Å; V720-T841 PolarHBondContact O-N 2.7Å
721	Q	85.3	Confident	79.4	Confident	108 Å²	108	49.8 Å²	49.8	51%	0.505	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	138.1	177.3	-169.5	172.9	-19.3	0	0	110.5	G723 E724	Q721-G723 PolarHBondContact O-N 2.72Å; Q721-E724 HydrophobicContact CB-CB 4.41Å; Q721-E724 PolarHBondContact N-OE2 3.29Å; Q721-E724 WeakPolarHBondContact O-CB 3.25Å; Q721-E724 PolarHBondContact O-N 2.81Å
722	S	84.5	Confident	79.5	Confident	41 Å²	41	48.6 Å²	48.6	29%	0.287	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	111.5	179.3	169.7	0	0	0	0	111.7	W811 T841	S722-W811 PolarHBondContact OG-N 3.14Å; S722-T841 WeakPolarHBondContact CB-O 3.35Å; S722-T841 PolarHBondContact N-O 2.86Å
723	G	82.6	Confident	79.5	Confident	29 Å²	29	49.9 Å²	49.9	30%	0.299	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	104.1	-7.1	-176.8	0	0	0	0	0	115.4	Q721 R808 P809	Q721-G723 PolarHBondContact O-N 2.72Å; G723-R808 VanDerWaalsContact O-CZ 3.32Å; G723-R808 PolarHBondContact O-NE 3.06Å; G723-R808 PolarHBondContact O-NH2 3.44Å; G723-P809 PolarHBondContact N-O 2.95Å
724	E	83.3	Confident	79.8	Confident	72 Å²	72	45.6 Å²	45.6	34%	0.336	26%	0.264	S	S	.	.			trans	-68.4	159	165.7	-163.9	172.9	-161.4	0	0	109.6	K717 V720 Q721 P809	K717-E724 IonicContact NZ-OE1 3.87Å; K717-E724 PolarHBondContact NZ-OE1 2.79Å; V720-E724 HydrophobicContact CG1-CB 3.82Å; V720-E724 HydrophobicContact CG1-CG 4.3Å; Q721-E724 HydrophobicContact CB-CB 4.41Å; Q721-E724 PolarHBondContact N-OE2 3.29Å; Q721-E724 WeakPolarHBondContact O-CB 3.25Å; Q721-E724 PolarHBondContact O-N 2.81Å; E724-P809 WeakPolarHBondContact O-CD 3.47Å
725	Q	82.3	Confident	80.4	Confident	88 Å²	88	42 Å²	42	41%	0.411	25%	0.248	S	C	.	.			trans	-103.2	130.7	179.1	179	168	-38.7	0	0	109.6	W806	Q725-W806 HydrophobicContact CG-CE3 4.12Å
726	L	83.9	Confident	81.8	Confident	12 Å²	12	41 Å²	41	6%	0.063	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	127.9	-176.3	177.8	61.7	0	0	0	110	F714 V720 I728 L807 P809 L838	F714-L726 HydrophobicContact CB-CD1 4.22Å; V720-L726 HydrophobicContact CG2-CD1 4.04Å; V720-L726 HydrophobicContact CG2-CD2 4.36Å; L726-I728 HydrophobicContact CD2-CD1 4.01Å; L726-I728 HydrophobicContact CD2-CG1 3.97Å; L726-I728 HydrophobicContact CG-CD1 4.37Å; L726-I728 HydrophobicContact CG-CG1 3.84Å; L726-L807 PolarHBondContact N-O 3.21Å; L726-L807 PolarHBondContact O-N 3.09Å; L726-P809 HydrophobicContact CB-CG 4.44Å; L726-L838 HydrophobicContact CD2-CD2 3.87Å
727	E	86.4	Confident	83	Confident	55 Å²	55	42 Å²	42	26%	0.257	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	130	167.6	-164.1	-172.9	157.7	0	0	109.3	F714 G715 N729 H804 W806	F714-E727 WeakPolarHBondContact CA-O 3.28Å; G715-E727 PolarHBondContact N-O 2.72Å; G715-E727 VanDerWaalsContact N-O 3.09Å; E727-N729 WeakPolarHBondContact CG-OD1 3.41Å; E727-N729 PolarHBondContact OE1-ND2 3.26Å; E727-N729 PolarHBondContact OE1-OD1 3.48Å; E727-N729 VanDerWaalsContact OE1-OD1 3.1Å; E727-H804 IonicContact OE1-CE1 2.7Å; E727-H804 IonicContact OE1-ND1 3.41Å; E727-H804 PolarHBondContact OE1-ND1 3.02Å; E727-W806 HydrophobicContact CB-CD2 4.45Å; E727-W806 HydrophobicContact CB-CE3 3.88Å; E727-W806 HydrophobicContact CB-CH2 3.9Å; E727-W806 HydrophobicContact CB-CZ2 4.43Å; E727-W806 HydrophobicContact CB-CZ3 3.6Å; E727-W806 HydrophobicContact CG-CD2 4.12Å; E727-W806 HydrophobicContact CG-CE3 4.02Å; E727-W806 HydrophobicContact CG-CH2 3.67Å; E727-W806 HydrophobicContact CG-CZ2 3.72Å; E727-W806 HydrophobicContact CG-CZ3 3.83Å; E727-W806 WeakPolarHBondContact OE2-CH2 3.47Å
728	I	87.2	Confident	84.3	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	120.8	177.5	-42.8	172.6	0	0	0	108.3	L712 L726 W743 L805 L807 I818 L836	L712-I728 HydrophobicContact CD2-CG2 3.9Å; L726-I728 HydrophobicContact CD2-CD1 4.01Å; L726-I728 HydrophobicContact CD2-CG1 3.97Å; L726-I728 HydrophobicContact CG-CD1 4.37Å; L726-I728 HydrophobicContact CG-CG1 3.84Å; I728-W743 HydrophobicContact CB-CH2 4.04Å; I728-W743 HydrophobicContact CB-CZ3 4.21Å; I728-W743 HydrophobicContact CG2-CH2 3.84Å; I728-W743 HydrophobicContact CG2-CZ3 3.88Å; I728-W743 WeakPolarHBondContact O-CH2 3.48Å; I728-L805 PolarHBondContact N-O 3.41Å; I728-L805 PolarHBondContact O-N 3.05Å; I728-L807 HydrophobicContact CD1-CD1 3.82Å; I728-I818 HydrophobicContact CD1-CB 4.3Å; I728-I818 HydrophobicContact CD1-CG1 4.07Å; I728-I818 HydrophobicContact CD1-CG2 4.05Å; I728-L836 HydrophobicContact CD1-CD2 3.97Å; I728-L836 HydrophobicContact CG1-CD2 4.18Å; I728-L836 HydrophobicContact CG2-CD2 4.06Å
729	N	89.2	Confident	85.5	Confident	34 Å²	34	34.8 Å²	34.8	18%	0.182	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	126.8	-172.1	-62.2	-15.9	0	0	0	109.5	N713 E727 H804	N713-N729 PolarHBondContact N-O 3.09Å; N713-N729 PolarHBondContact O-N 2.86Å; E727-N729 WeakPolarHBondContact CG-OD1 3.41Å; E727-N729 PolarHBondContact OE1-ND2 3.26Å; E727-N729 PolarHBondContact OE1-OD1 3.48Å; E727-N729 VanDerWaalsContact OE1-OD1 3.1Å; N729-H804 VanDerWaalsContact CG-CE1 3.48Å; N729-H804 PolarHBondContact ND2-CE1 3.42Å; N729-H804 PolarHBondContact ND2-ND1 3.07Å; N729-H804 PolarHBondContact OD1-ND1 2.81Å
730	C	89.4	Confident	86	Confident	2 Å²	2	37.1 Å²	37.1	1%	0.014	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	127.7	-177.9	-172.8	0	0	0	0	110	V710 S711 L712 I741 W743 R802 S803 C820	V710-C730 WeakPolarHBondContact CG1-SG 3.27Å; S711-C730 WeakPolarHBondContact O-CA 3.22Å; L712-C730 HydrophobicContact CD2-CB 3.91Å; C730-I741 HydrophobicContact CB-CG2 4.41Å; C730-W743 HydrophobicContact CB-CH2 3.66Å; C730-W743 HydrophobicContact CB-CZ2 3.38Å; C730-W743 HydrophobicContact CB-CZ3 4.5Å; C730-R802 CarbonylContact O-C 3.53Å; C730-R802 VanDerWaalsContact O-CA 3.27Å; C730-R802 WeakPolarHBondContact O-CA 3.43Å; C730-S803 PolarHBondContact N-O 3.4Å; C730-S803 PolarHBondContact O-N 3.12Å; C730-C820 HydrophobicContact CB-CB 3.8Å; C730-C820 WeakPolarHBondContact CB-SG 3.32Å; C730-C820 WeakPolarHBondContact SG-CB 3.41Å; C730-C820 CovalentContact SG-SG 2.03Å; C730-C820 PolarHBondContact SG-SG 2.84Å
731	Q	90.7	Very high	86.3	Confident	42 Å²	42	37.1 Å²	37.1	20%	0.196	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	129.9	175.2	-175.8	-179.7	-88.9	0	0	110	V710 S711 L800 A801 R802	V710-Q731 CarbonylContact C-O 3.38Å; V710-Q731 WeakPolarHBondContact CA-O 3.46Å; S711-Q731 PolarHBondContact N-O 3.5Å; S711-Q731 PolarHBondContact O-N 3.37Å; Q731-L800 HydrophobicContact CG-CD2 4.37Å; Q731-A801 WeakPolarHBondContact CA-O 3.3Å; Q731-R802 HydrophobicContact CB-CG 4.03Å; Q731-R802 HydrophobicContact CG-CG 3.82Å
732	A	88.2	Confident	86.4	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	139.8	164.4	0	0	0	0	0	109.7	V710 A739 I741 L800 A801 A822	V710-A732 HydrophobicContact CG2-CB 4.19Å; A732-A739 HydrophobicContact CB-CB 4.36Å; A732-I741 HydrophobicContact CB-CD1 4.1Å; A732-I741 HydrophobicContact CB-CG1 4.33Å; A732-L800 WeakPolarHBondContact O-CD2 3.22Å; A732-A801 HydrophobicContact CB-CB 4.37Å; A732-A801 PolarHBondContact N-O 2.85Å; A732-A801 PolarHBondContact O-N 3.33Å; A732-A822 HydrophobicContact CB-CB 4.2Å
733	D	87.3	Confident	86.7	Confident	41 Å²	41	33.7 Å²	33.7	22%	0.219	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	161.2	179.5	-85.5	-22.4	0	0	0	114.1	P707 R709 S735	P707-D733 HydrophobicContact CB-CB 4.07Å; R709-D733 WeakPolarHBondContact CB-OD2 3.38Å; R709-D733 PolarHBondContact N-OD2 3.19Å; R709-D733 PolarHBondContact O-N 2.92Å; D733-S735 PolarHBondContact O-N 2.87Å
734	S	87.3	Confident	87	Confident	5 Å²	5	34.8 Å²	34.8	4%	0.035	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54	129.7	174	-171.2	0	0	0	0	111	F705 G794 A795 G798 L799	F705-S734 WeakPolarHBondContact CE2-O 3.36Å; S734-G794 WeakPolarHBondContact OG-CA 3.17Å; S734-A795 WeakPolarHBondContact CB-O 3.36Å; S734-A795 PolarHBondContact OG-N 3.25Å; S734-A795 PolarHBondContact OG-O 3.43Å; S734-G798 VanDerWaalsContact OG-C 3.27Å; S734-G798 WeakPolarHBondContact OG-CA 3.37Å; S734-L799 WeakPolarHBondContact CA-O 3.1Å
735	S	87.8	Confident	87.4	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	147.5	-178.1	46.5	0	0	0	0	111.5	D733 P737 V738 A739 L799	D733-S735 PolarHBondContact O-N 2.87Å; S735-P737 CarbonylContact C-O 3.59Å; S735-P737 VanDerWaalsContact C-O 3.28Å; S735-P737 VanDerWaalsContact CB-O 3.3Å; S735-P737 WeakPolarHBondContact CB-O 3.44Å; S735-P737 CarbonylContact O-C 2.53Å; S735-P737 PolarHBondContact OG-O 2.71Å; S735-V738 WeakPolarHBondContact OG-CA 3.34Å; S735-A739 PolarHBondContact OG-N 2.73Å; S735-L799 PolarHBondContact N-O 3.19Å; S735-L799 PolarHBondContact O-N 3.02Å; S735-L799 PolarHBondContact OG-O 2.98Å
736	N	86.2	Confident	87.6	Confident	41 Å²	41	29.8 Å²	29.8	22%	0.219	16%	0.16	C	C	.	.	B	Isolated β-bridge	trans	-128.8	91.3	-176.9	-175.1	13.2	0	0	0	109.3	V703 L704 F705	V703-N736 PolarHBondContact O-ND2 3.09Å; L704-N736 WeakPolarHBondContact CD2-ND2 3.36Å; F705-N736 HydrophobicContact CD1-CB 3.84Å; F705-N736 HydrophobicContact CD2-CB 4.36Å; F705-N736 HydrophobicContact CE1-CB 3.6Å; F705-N736 HydrophobicContact CE2-CB 4.15Å; F705-N736 HydrophobicContact CG-CB 4.22Å; F705-N736 HydrophobicContact CZ-CB 3.76Å; F705-N736 PolarHBondContact N-O 2.91Å; F705-N736 VanDerWaalsContact N-O 3.12Å; F705-N736 CarbonylContact O-C 3.41Å; F705-N736 PolarHBondContact O-N 3.42Å
737	P	81.2	Confident	87.7	Confident	50 Å²	50	30.3 Å²	30.3	33%	0.325	16%	0.162	S	C	.	.	S	Bend	cis	-84.1	176.7	3.5	36	-37.4	0	0	0	114.5	S735 N824 P825 V826	S735-P737 CarbonylContact C-O 3.59Å; S735-P737 VanDerWaalsContact C-O 3.28Å; S735-P737 VanDerWaalsContact CB-O 3.3Å; S735-P737 WeakPolarHBondContact CB-O 3.44Å; S735-P737 CarbonylContact O-C 2.53Å; S735-P737 PolarHBondContact OG-O 2.71Å; P737-N824 PolarHBondContact O-ND2 3.17Å; P737-P825 HydrophobicContact CG-CG 4.23Å; P737-V826 HydrophobicContact CG-CB 4.35Å; P737-V826 HydrophobicContact CG-CG2 3.47Å; P737-V826 VanDerWaalsContact CG-CG2 3.47Å
738	V	87.1	Confident	87.5	Confident	38 Å²	38	30.1 Å²	30.1	23%	0.23	17%	0.166	C	C	.	.			trans	-66.4	156.3	-171.5	72.5	0	0	0	0	115.7	S735 P791 L799 A801 P825	S735-V738 WeakPolarHBondContact OG-CA 3.34Å; V738-P791 HydrophobicContact CG1-CG 4.4Å; V738-P791 HydrophobicContact CG2-CB 4.09Å; V738-P791 HydrophobicContact CG2-CG 4.12Å; V738-L799 HydrophobicContact CB-CB 3.85Å; V738-L799 HydrophobicContact CB-CD1 4.29Å; V738-L799 HydrophobicContact CG2-CB 3.91Å; V738-A801 HydrophobicContact CG2-CB 4.05Å; V738-P825 WeakPolarHBondContact O-CD 3.32Å
739	A	85.6	Confident	87.1	Confident	7 Å²	7	30.3 Å²	30.3	6%	0.058	17%	0.168	C	C	.	.			trans	-100.2	167.1	178.4	0	0	0	0	0	115	P707 A732 S735 A801 E823	P707-A739 HydrophobicContact CG-CB 4.1Å; A732-A739 HydrophobicContact CB-CB 4.36Å; S735-A739 PolarHBondContact OG-N 2.73Å; A739-A801 VanDerWaalsContact O-CB 3.3Å; A739-A801 WeakPolarHBondContact O-CB 3.44Å; A739-E823 CarbonylContact C-O 3.46Å; A739-E823 WeakPolarHBondContact CA-O 3.38Å; A739-E823 VanDerWaalsContact CB-O 3.26Å; A739-E823 WeakPolarHBondContact CB-O 3.34Å
740	V	87.6	Confident	86.5	Confident	102 Å²	102	32.2 Å²	32.2	62%	0.618	18%	0.182	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-119.9	148.4	-177.9	-178.3	0	0	0	0	110.7	A822 E823	V740-A822 CarbonylContact O-C 3.16Å; V740-A822 WeakPolarHBondContact O-CA 3.32Å; V740-A822 WeakPolarHBondContact O-CB 3.04Å; V740-E823 PolarHBondContact N-O 2.98Å; V740-E823 PolarHBondContact O-N 2.94Å
741	I	88.9	Confident	86.1	Confident	12 Å²	12	32.1 Å²	32.1	6%	0.062	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	147.3	-169.3	-64.4	174	0	0	0	113.3	C730 A732 A801 C820 Q821 A822	C730-I741 HydrophobicContact CB-CG2 4.41Å; A732-I741 HydrophobicContact CB-CD1 4.1Å; A732-I741 HydrophobicContact CB-CG1 4.33Å; I741-A801 HydrophobicContact CD1-CB 4.03Å; I741-C820 WeakPolarHBondContact CG2-SG 3.26Å; I741-Q821 CarbonylContact C-O 3.56Å; I741-Q821 WeakPolarHBondContact CA-O 3.46Å; I741-A822 HydrophobicContact CG1-CB 4.04Å
742	T	88.5	Confident	85.4	Confident	70 Å²	70	31.8 Å²	31.8	43%	0.429	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	166.4	171.7	48	0	0	0	0	114	C820 Q821	T742-C820 WeakPolarHBondContact O-CA 3.47Å; T742-Q821 PolarHBondContact N-O 3.3Å; T742-Q821 PolarHBondContact O-N 3.39Å; T742-Q821 WeakPolarHBondContact OG1-CG 3.27Å; T742-Q821 PolarHBondContact OG1-NE2 2.56Å
743	W	90.6	Very high	84.6	Confident	7 Å²	7	34 Å²	34	3%	0.027	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	148.8	-167.1	-68.1	91.8	0	0	0	116.5	L712 I728 C730 L784 S803 L805 I818 E819 C820	L712-W743 HydrophobicContact CD2-CE3 4.4Å; L712-W743 HydrophobicContact CD2-CH2 3.51Å; L712-W743 HydrophobicContact CD2-CZ3 3.4Å; I728-W743 HydrophobicContact CB-CH2 4.04Å; I728-W743 HydrophobicContact CB-CZ3 4.21Å; I728-W743 HydrophobicContact CG2-CH2 3.84Å; I728-W743 HydrophobicContact CG2-CZ3 3.88Å; I728-W743 WeakPolarHBondContact O-CH2 3.48Å; C730-W743 HydrophobicContact CB-CH2 3.66Å; C730-W743 HydrophobicContact CB-CZ2 3.38Å; C730-W743 HydrophobicContact CB-CZ3 4.5Å; W743-L784 HydrophobicContact CB-CB 4.09Å; W743-L784 PolarHBondContact O-N 3.35Å; W743-S803 PolarHBondContact NE1-OG 3.08Å; W743-L805 HydrophobicContact CD2-CB 3.93Å; W743-L805 HydrophobicContact CD2-CD2 3.86Å; W743-L805 HydrophobicContact CD2-CG 4.45Å; W743-L805 HydrophobicContact CE3-CB 4.02Å; W743-L805 HydrophobicContact CE3-CD2 3.42Å; W743-L805 VanDerWaalsContact CE3-CD2 3.42Å; W743-L805 HydrophobicContact CE3-CG 4.34Å; W743-L805 HydrophobicContact CG-CD2 4.42Å; W743-L805 HydrophobicContact CH2-CB 3.75Å; W743-L805 HydrophobicContact CH2-CD2 4.41Å; W743-L805 HydrophobicContact CZ2-CB 3.65Å; W743-L805 HydrophobicContact CZ3-CB 3.93Å; W743-L805 HydrophobicContact CZ3-CD2 3.72Å; W743-L805 HydrophobicContact CZ3-CG 4.48Å; W743-I818 HydrophobicContact CE3-CG2 4.06Å; W743-I818 HydrophobicContact CZ3-CG2 4.08Å; W743-E819 CarbonylContact C-O 3.54Å; W743-E819 WeakPolarHBondContact CA-O 3.22Å; W743-C820 HydrophobicContact CD2-CB 4.17Å; W743-C820 HydrophobicContact CE3-CB 3.86Å; W743-C820 HydrophobicContact CH2-CB 4.44Å; W743-C820 HydrophobicContact CZ3-CB 4.02Å
744	R	89.4	Confident	83.8	Confident	53 Å²	53	33.4 Å²	33.4	20%	0.2	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	160.9	-179.6	-74.3	-177.9	-175.3	130.3	6.2	114.6	Y746 L781 E783 I818 E819	R744-Y746 HydrophobicContact CB-CE2 4.33Å; R744-L781 HydrophobicContact CB-CD1 3.87Å; R744-L781 HydrophobicContact CG-CD1 3.97Å; R744-E783 HydrophobicContact CG-CG 4.22Å; R744-E783 IonicContact CZ-OE1 3.5Å; R744-E783 IonicContact NE-OE1 2.67Å; R744-E783 PolarHBondContact NE-OE1 2.82Å; R744-E783 IonicContact NH2-OE1 2.74Å; R744-E783 PolarHBondContact NH2-OE1 3.49Å; R744-I818 WeakPolarHBondContact O-CA 3.22Å; R744-E819 HydrophobicContact CB-CB 4.17Å; R744-E819 WeakPolarHBondContact CD-OE2 3.37Å; R744-E819 PolarHBondContact N-O 2.78Å; R744-E819 IonicContact NH1-OE2 2.75Å; R744-E819 PolarHBondContact NH1-OE2 3.19Å; R744-E819 PolarHBondContact O-N 2.98Å
745	H	89.7	Confident	83	Confident	8 Å²	8	36.5 Å²	36.5	4%	0.037	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	127.9	177.9	171.7	-161.2	0	0	0	111.5	L781 L782 L784 D816 F817 I818	H745-L781 CarbonylContact O-C 3.6Å; H745-L781 WeakPolarHBondContact O-CA 3.44Å; H745-L782 HydrophobicContact CB-CB 4.49Å; H745-L782 PolarHBondContact N-O 3.18Å; H745-L782 PolarHBondContact O-N 3.39Å; H745-L784 HydrophobicContact CB-CD1 3.75Å; H745-L784 HydrophobicContact CB-CG 4.12Å; H745-D816 IonicContact NE2-OD2 3.43Å; H745-F817 CarbonylContact C-O 3.55Å; H745-F817 WeakPolarHBondContact CA-O 3.32Å; H745-I818 HydrophobicContact CB-CD1 3.66Å
746	Y	88	Confident	82.1	Confident	47 Å²	47	40.8 Å²	40.8	18%	0.184	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	112.2	-179.7	-63.4	-92.2	0	0	0	111.4	R744 C748 C779 L781 D816 F817 E819	R744-Y746 HydrophobicContact CB-CE2 4.33Å; Y746-C748 PolarHBondContact O-N 3.31Å; Y746-C779 HydrophobicContact CD1-CB 4.24Å; Y746-L781 HydrophobicContact CD1-CD1 4.18Å; Y746-L781 HydrophobicContact CE1-CB 4.5Å; Y746-L781 HydrophobicContact CE1-CD1 3.88Å; Y746-L781 HydrophobicContact CE2-CD1 4.3Å; Y746-D816 WeakPolarHBondContact O-CB 3.39Å; Y746-F817 HydrophobicContact CD2-CB 4.46Å; Y746-F817 PolarHBondContact N-O 2.81Å; Y746-F817 PolarHBondContact O-N 2.99Å; Y746-E819 HydrophobicContact CE2-CB 3.94Å; Y746-E819 PolarHBondContact OH-OE2 3.15Å
747	Q	85.8	Confident	81.1	Confident	23 Å²	23	46.4 Å²	46.4	11%	0.107	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	100.6	176.7	-67.4	-174.3	-27.3	0	0	110.7	K780 D816	Q747-K780 HydrophobicContact CB-CB 4.16Å; Q747-K780 WeakPolarHBondContact CB-O 3.41Å; Q747-K780 PolarHBondContact N-O 2.74Å; Q747-K780 PolarHBondContact O-N 3.44Å; Q747-K780 VanDerWaalsContact O-N 3.09Å; Q747-D816 WeakPolarHBondContact CA-OD1 3.24Å
748	C	81.3	Confident	80.1	Confident	51 Å²	51	46.3 Å²	46.3	35%	0.345	24%	0.235	S	C	.	.			trans	-166.7	15.4	177	49.2	0	0	0	0	116.3	Y746 C779 D816	Y746-C748 PolarHBondContact O-N 3.31Å; C748-C779 HydrophobicContact CB-CB 3.68Å; C748-C779 WeakPolarHBondContact CB-SG 3.47Å; C748-C779 WeakPolarHBondContact SG-CB 3.09Å; C748-C779 CovalentContact SG-SG 2.04Å; C748-C779 PolarHBondContact SG-SG 2.74Å; C748-D816 PolarHBondContact N-OD1 3.09Å
749	G	79.2	Confident	78.7	Confident	4 Å²	4	47.8 Å²	47.8	4%	0.041	24%	0.241	C	C	.	.	S	Bend	trans	-64.6	163.5	172.4	0	0	0	0	0	113.2	A751 H752 A753 D816	G749-A751 PolarHBondContact O-N 2.82Å; G749-H752 WeakPolarHBondContact O-CB 3.45Å; G749-H752 PolarHBondContact O-N 3.06Å; G749-A753 PolarHBondContact O-N 2.85Å; G749-A753 VanDerWaalsContact O-N 3.15Å; G749-D816 PolarHBondContact N-OD1 3.12Å
750	P	76.5	Confident	77.4	Confident	73 Å²	73	52.6 Å²	52.6	47%	0.474	27%	0.265	S	S	.	.	H	α-helix	trans	-59.6	-31.8	-177.6	-24.1	35.9	0	0	0	113.2	H752 A753 F754	P750-H752 VanDerWaalsContact C-N 3.31Å; P750-H752 PolarHBondContact O-N 3.49Å; P750-A753 PolarHBondContact O-N 3.46Å; P750-F754 VanDerWaalsContact O-CB 3.25Å; P750-F754 WeakPolarHBondContact O-CB 3.45Å; P750-F754 PolarHBondContact O-N 2.83Å
751	A	80.5	Confident	75.7	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-61.8	-37.9	173.8	0	0	0	0	0	112.7	G749 Y755 W811 H814 Y870	G749-A751 PolarHBondContact O-N 2.82Å; A751-Y755 WeakPolarHBondContact O-CB 3.41Å; A751-Y755 PolarHBondContact O-N 3.48Å; A751-W811 HydrophobicContact CB-CE3 4.22Å; A751-W811 HydrophobicContact CB-CZ3 4.35Å; A751-W811 VanDerWaalsContact CB-O 3.26Å; A751-W811 WeakPolarHBondContact CB-O 3.34Å; A751-H814 HydrophobicContact CB-CB 3.93Å; A751-Y870 HydrophobicContact CB-CE1 3.6Å; A751-Y870 PolarHBondContact N-OH 2.89Å
752	H	77.8	Confident	73.8	Confident	35 Å²	35	57.7 Å²	57.7	16%	0.162	28%	0.282	C	S	.	.	H	α-helix	trans	-69.7	-41.6	176.5	-151.2	112.5	0	0	0	111.1	G749 P750 Y755 R756 R812 D816	G749-H752 WeakPolarHBondContact O-CB 3.45Å; G749-H752 PolarHBondContact O-N 3.06Å; P750-H752 VanDerWaalsContact C-N 3.31Å; P750-H752 PolarHBondContact O-N 3.49Å; H752-Y755 PolarHBondContact O-N 3.29Å; H752-R756 WeakPolarHBondContact O-CB 3.44Å; H752-R756 PolarHBondContact O-N 2.9Å; H752-R812 PolarHBondContact N-O 3.17Å; H752-D816 IonicContact ND1-OD2 2.61Å
753	A	70.6	Confident	71.8	Confident	48 Å²	48	60.8 Å²	60.8	40%	0.397	29%	0.292	S	S	.	.	H	α-helix	trans	-64.8	-40.7	175	0	0	0	0	0	112.4	G749 P750 R756 R757	G749-A753 PolarHBondContact O-N 2.85Å; G749-A753 VanDerWaalsContact O-N 3.15Å; P750-A753 PolarHBondContact O-N 3.46Å; A753-R756 PolarHBondContact O-N 3.36Å; A753-R757 WeakPolarHBondContact O-CG 3.45Å; A753-R757 PolarHBondContact O-N 3.39Å
754	F	71.1	Confident	69.5	Low	27 Å²	27	69.4 Å²	69.4	12%	0.118	33%	0.329	C	S	.	.	H	α-helix	trans	-61	-49.8	174	-177	-100.9	0	0	0	111.2	P750 R756 R757 W811 Q845 Y847 G868 Y870	P750-F754 VanDerWaalsContact O-CB 3.25Å; P750-F754 WeakPolarHBondContact O-CB 3.45Å; P750-F754 PolarHBondContact O-N 2.83Å; F754-R756 PolarHBondContact O-N 2.95Å; F754-R757 PolarHBondContact O-N 3.05Å; F754-W811 HydrophobicContact CD1-CH2 4.11Å; F754-W811 HydrophobicContact CD1-CZ3 4.02Å; F754-W811 HydrophobicContact CE1-CH2 4.42Å; F754-Q845 HydrophobicContact CE1-CB 4.31Å; F754-Y847 HydrophobicContact CD1-CD2 4.4Å; F754-Y847 HydrophobicContact CD2-CD2 4.5Å; F754-Y847 HydrophobicContact CE1-CD2 4.04Å; F754-Y847 HydrophobicContact CE2-CD2 4.14Å; F754-Y847 HydrophobicContact CE2-CG 4.06Å; F754-Y847 AromaticContact CZ-CD2 3.93Å; F754-Y847 HydrophobicContact CZ-CD2 3.93Å; F754-Y847 AromaticContact CZ-CG 3.96Å; F754-Y847 HydrophobicContact CZ-CG 3.96Å; F754-G868 WeakPolarHBondContact CE2-O 3.45Å; F754-Y870 HydrophobicContact CD1-CD1 4.14Å; F754-Y870 HydrophobicContact CD1-CG 4.35Å; F754-Y870 HydrophobicContact CD2-CG 4.42Å; F754-Y870 HydrophobicContact CE1-CD1 4.29Å; F754-Y870 HydrophobicContact CE1-CG 4.29Å; F754-Y870 HydrophobicContact CE2-CG 4.37Å; F754-Y870 HydrophobicContact CG-CD1 4.45Å; F754-Y870 HydrophobicContact CG-CG 4.39Å; F754-Y870 HydrophobicContact CZ-CG 4.28Å
755	Y	70.9	Confident	66.9	Low	70 Å²	70	76.2 Å²	76.2	28%	0.275	36%	0.36	S	S	.	.	H	α-helix	trans	-65.4	-37.2	177.4	-176.9	-110.8	0	0	0	113.3	A751 H752 R757 H758 L759 W811 R812	A751-Y755 WeakPolarHBondContact O-CB 3.41Å; A751-Y755 PolarHBondContact O-N 3.48Å; H752-Y755 PolarHBondContact O-N 3.29Å; Y755-R757 VanDerWaalsContact C-N 3.32Å; Y755-R757 PolarHBondContact O-N 3.02Å; Y755-H758 WeakPolarHBondContact O-CB 3.38Å; Y755-H758 PolarHBondContact O-N 3.05Å; Y755-L759 HydrophobicContact CD1-CD1 4.39Å; Y755-L759 HydrophobicContact CE1-CD1 3.89Å; Y755-L759 HydrophobicContact CE1-CG 4.44Å; Y755-W811 HydrophobicContact CD2-CH2 4.23Å; Y755-W811 HydrophobicContact CD2-CZ2 4.43Å; Y755-R812 HydrophobicContact CD2-CG 4.44Å; Y755-R812 HydrophobicContact CG-CG 4.18Å; Y755-R812 VanDerWaalsContact CZ-NH1 3.32Å; Y755-R812 PolarHBondContact OH-NH1 3.28Å
756	R	68.6	Low	64	Low	90 Å²	90	82.6 Å²	82.6	34%	0.34	39%	0.394	S	S	.	.	H	α-helix	trans	-62.1	-36.3	177.2	177.7	173.5	-85.1	-170.3	-6.6	112.5	H752 A753 F754 H758 L759 L760 E777	H752-R756 WeakPolarHBondContact O-CB 3.44Å; H752-R756 PolarHBondContact O-N 2.9Å; A753-R756 PolarHBondContact O-N 3.36Å; F754-R756 PolarHBondContact O-N 2.95Å; R756-H758 PolarHBondContact O-N 3.1Å; R756-L759 PolarHBondContact O-N 2.71Å; R756-L760 HydrophobicContact CG-CD1 4.42Å; R756-L760 PolarHBondContact O-N 3.17Å; R756-E777 IonicContact CZ-OE1 3.61Å; R756-E777 VanDerWaalsContact CZ-OE1 3.3Å; R756-E777 IonicContact CZ-OE2 2.98Å; R756-E777 IonicContact NH1-OE1 2.76Å; R756-E777 PolarHBondContact NH1-OE1 2.8Å; R756-E777 VanDerWaalsContact NH1-OE1 3.1Å; R756-E777 IonicContact NH1-OE2 3.26Å; R756-E777 PolarHBondContact NH1-OE2 2.9Å; R756-E777 IonicContact NH2-OE1 3.82Å; R756-E777 PolarHBondContact NH2-OE1 2.6Å; R756-E777 IonicContact NH2-OE2 3.9Å; R756-E777 PolarHBondContact NH2-OE2 2.71Å
757	R	64.1	Low	61.5	Low	160 Å²	160	86.6 Å²	86.6	60%	0.604	43%	0.425	S	S	*	.	H	α-helix	trans	-59.4	-34.5	173.4	-68.4	170.3	-176.1	167.1	1.9	111.8	A753 F754 Y755 L760 Q761 Y847	A753-R757 WeakPolarHBondContact O-CG 3.45Å; A753-R757 PolarHBondContact O-N 3.39Å; F754-R757 PolarHBondContact O-N 3.05Å; Y755-R757 VanDerWaalsContact C-N 3.32Å; Y755-R757 PolarHBondContact O-N 3.02Å; R757-L760 PolarHBondContact O-N 2.75Å; R757-Q761 PolarHBondContact O-N 2.88Å; R757-Q761 VanDerWaalsContact O-N 3.13Å; R757-Y847 HydrophobicContact CB-CE2 4.38Å; R757-Y847 WeakPolarHBondContact CB-OH 3Å; R757-Y847 PolarHBondContact O-OH 3.32Å; R757-Y847 VanDerWaalsContact O-OH 3.11Å
758	H	59.7	Low	58.8	Low	48 Å²	48	94.1 Å²	94.1	22%	0.222	46%	0.458	C	S	.	.	H	α-helix	trans	-61.5	-49.4	-179.1	-156.2	62.1	0	0	0	112.3	Y755 R756 L760 Q761 Q762 Y847	Y755-H758 WeakPolarHBondContact O-CB 3.38Å; Y755-H758 PolarHBondContact O-N 3.05Å; R756-H758 PolarHBondContact O-N 3.1Å; H758-L760 VanDerWaalsContact C-N 3.3Å; H758-L760 PolarHBondContact O-N 3.33Å; H758-Q761 PolarHBondContact O-N 2.94Å; H758-Q761 VanDerWaalsContact O-N 3.12Å; H758-Q762 PolarHBondContact CD2-NE2 2.88Å; H758-Q762 PolarHBondContact NE2-NE2 2.94Å; H758-Q762 PolarHBondContact O-N 3Å; H758-Y847 VanDerWaalsContact CA-OH 3.26Å; H758-Y847 WeakPolarHBondContact CA-OH 3.02Å; H758-Y847 HydrophobicContact CB-CE2 3.73Å; H758-Y847 PolarHBondContact N-OH 3.13Å; H758-Y847 VanDerWaalsContact N-OH 3.1Å; H758-Y847 AromaticContact ND1-CE2 3.56Å
759	L	58.5	Low	56.2	Low	68 Å²	68	96.4 Å²	96.4	36%	0.356	48%	0.475	S	S	.	.	H	α-helix	trans	-61.6	-39.9	-178.7	-65.7	168.2	0	0	0	111.3	Y755 R756 Q761 Q762 Q763	Y755-L759 HydrophobicContact CD1-CD1 4.39Å; Y755-L759 HydrophobicContact CE1-CD1 3.89Å; Y755-L759 HydrophobicContact CE1-CG 4.44Å; R756-L759 PolarHBondContact O-N 2.71Å; L759-Q761 VanDerWaalsContact C-N 3.33Å; L759-Q761 PolarHBondContact O-N 2.83Å; L759-Q762 PolarHBondContact O-N 2.81Å; L759-Q763 WeakPolarHBondContact O-CB 3.17Å; L759-Q763 VanDerWaalsContact O-CG 3.26Å; L759-Q763 WeakPolarHBondContact O-CG 3.04Å; L759-Q763 PolarHBondContact O-N 3.09Å
760	L	57.4	Low	53.9	Low	109 Å²	109	101.9 Å²	101.9	57%	0.571	51%	0.512	S	S	*	.	H	α-helix	trans	-67.6	-29.3	176.9	-65.5	171.1	0	0	0	113.2	R756 R757 H758	R756-L760 HydrophobicContact CG-CD1 4.42Å; R756-L760 PolarHBondContact O-N 3.17Å; R757-L760 PolarHBondContact O-N 2.75Å; H758-L760 VanDerWaalsContact C-N 3.3Å; H758-L760 PolarHBondContact O-N 3.33Å
761	Q	52.5	Low	51.6	Low	119 Å²	119	104.4 Å²	104.4	56%	0.556	53%	0.532	S	S	*	.	H	α-helix	trans	-77.9	-42.1	173.4	-75.3	-178	-21.1	0	0	112	R757 H758 L759 Q763 K764 Y847	R757-Q761 PolarHBondContact O-N 2.88Å; R757-Q761 VanDerWaalsContact O-N 3.13Å; H758-Q761 PolarHBondContact O-N 2.94Å; H758-Q761 VanDerWaalsContact O-N 3.12Å; L759-Q761 VanDerWaalsContact C-N 3.33Å; L759-Q761 PolarHBondContact O-N 2.83Å; Q761-Q763 PolarHBondContact O-N 2.86Å; Q761-K764 PolarHBondContact O-N 3.03Å; Q761-Y847 VanDerWaalsContact CD-OH 3.23Å; Q761-Y847 VanDerWaalsContact OE1-CE1 3.24Å; Q761-Y847 VanDerWaalsContact OE1-CZ 3.3Å; Q761-Y847 PolarHBondContact OE1-OH 2.86Å
762	Q	48.6	Very low	49.1	Very low	101 Å²	101	109.2 Å²	109.2	47%	0.472	57%	0.565	S	S	.	*	H	α-helix	trans	-66.7	-36	177.7	-69.3	-168.5	-8.3	0	0	113.1	H758 L759 K764	H758-Q762 PolarHBondContact CD2-NE2 2.88Å; H758-Q762 PolarHBondContact NE2-NE2 2.94Å; H758-Q762 PolarHBondContact O-N 3Å; L759-Q762 PolarHBondContact O-N 2.81Å; Q762-K764 PolarHBondContact O-N 3.4Å; Q762-K764 VanDerWaalsContact O-N 3.17Å
763	Q	47.9	Very low	46.7	Very low	136 Å²	136	113.3 Å²	113.3	64%	0.636	59%	0.593	S	S	*	*	G	3₁₀ helix	trans	-67	-13.7	-179.3	-76.6	175.6	-4.5	0	0	114.4	L759 Q761 K765 L766	L759-Q763 WeakPolarHBondContact O-CB 3.17Å; L759-Q763 VanDerWaalsContact O-CG 3.26Å; L759-Q763 WeakPolarHBondContact O-CG 3.04Å; L759-Q763 PolarHBondContact O-N 3.09Å; Q761-Q763 PolarHBondContact O-N 2.86Å; Q763-K765 PolarHBondContact O-N 2.8Å; Q763-L766 PolarHBondContact O-N 3.4Å
764	K	42.2	Very low	44.8	Very low	187 Å²	187	118 Å²	118	81%	0.813	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-65.6	-2.2	176.9	-77.2	-169.9	173.2	-173.5	0	115.3	Q761 Q762	Q761-K764 PolarHBondContact O-N 3.03Å; Q762-K764 PolarHBondContact O-N 3.4Å; Q762-K764 VanDerWaalsContact O-N 3.17Å
765	K	33.1	Very low	42.9	Very low	197 Å²	197	126.2 Å²	126.2	86%	0.857	65%	0.65	S	S	*	*	G	3₁₀ helix	trans	-97.7	5	176.2	-78.5	-175.6	175.6	175.8	0	115.7	Q763	Q763-K765 PolarHBondContact O-N 2.8Å
766	L	30.2	Very low	41.1	Very low	142 Å²	142	126.1 Å²	126.1	74%	0.743	67%	0.671	S	S	*	*			trans	-126.2	133	172.3	-102.1	85.6	0	0	0	113.6	Q763	Q763-L766 PolarHBondContact O-N 3.4Å
767	P	35.2	Very low	40.1	Very low	130 Å²	130	128.4 Å²	128.4	84%	0.844	69%	0.685	S	S	*	*			trans	-98.1	95.9	177.5	35.3	-31.5	0	0	0	113.4
768	K	28.6	Very low	39.6	Very low	181 Å²	181	129.9 Å²	129.9	79%	0.787	70%	0.696	S	S	*	*			trans	-146.5	109.2	169	-75.1	-165.6	179.8	-178.8	0	109.2
769	S	27.4	Very low	40	Very low	100 Å²	100	130.6 Å²	130.6	70%	0.699	71%	0.705	S	S	*	*				85.4	86.1	76.8	74.9	0	0	0	0	114.6
770	S	30.2	Very low	41	Very low	119 Å²	119	132.8 Å²	132.8	83%	0.832	71%	0.712	S	S	*	*			trans	41.4	105.1	149.6	61.3	0	0	0	0	120.9
771	S	28.6	Very low	42.2	Very low	126 Å²	126	131.3 Å²	131.3	88%	0.881	70%	0.704	S	S	*	*				-160.5	164.6	128.5	61.8	0	0	0	0	111
772	S	28	Very low	43.7	Very low	101 Å²	101	129.6 Å²	129.6	71%	0.706	70%	0.698	S	S	*	*			trans	-88.9	147.8	-177.7	52.9	0	0	0	0	113.6
773	T	27.6	Very low	45.5	Very low	121 Å²	121	130.9 Å²	130.9	74%	0.742	71%	0.705	S	S	*	*				178.7	146.8	111.7	32.3	0	0	0	0	113.3
774	N	30	Very low	47.3	Very low	146 Å²	146	126.4 Å²	126.4	78%	0.781	69%	0.685	S	S	*	*			trans	49.7	112.6	150.4	-58.4	-1.1	0	0	0	120.4
775	E	32.1	Very low	49.2	Very low	199 Å²	199	126.9 Å²	126.9	93%	0.93	69%	0.687	S	S	*	*	S	Bend	trans	-64.1	153.1	155.2	-60.4	168.1	118.3	0	0	111.1
776	G	33.5	Very low	51.6	Low	69 Å²	69	118.5 Å²	118.5	71%	0.711	66%	0.656	S	S	*	*			trans	89.1	49.8	171.8	0	0	0	0	0	116.2	K778	G776-K778 PolarHBondContact O-N 2.79Å
777	E	47.1	Very low	54.3	Low	138 Å²	138	114.9 Å²	114.9	65%	0.645	64%	0.643	S	S	*	*			trans	-59.5	104.6	167.5	-83.3	-168.9	89.1	0	0	111.7	R756	R756-E777 IonicContact CZ-OE1 3.61Å; R756-E777 VanDerWaalsContact CZ-OE1 3.3Å; R756-E777 IonicContact CZ-OE2 2.98Å; R756-E777 IonicContact NH1-OE1 2.76Å; R756-E777 PolarHBondContact NH1-OE1 2.8Å; R756-E777 VanDerWaalsContact NH1-OE1 3.1Å; R756-E777 IonicContact NH1-OE2 3.26Å; R756-E777 PolarHBondContact NH1-OE2 2.9Å; R756-E777 IonicContact NH2-OE1 3.82Å; R756-E777 PolarHBondContact NH2-OE1 2.6Å; R756-E777 IonicContact NH2-OE2 3.9Å; R756-E777 PolarHBondContact NH2-OE2 2.71Å
778	K	54.2	Low	56.6	Low	191 Å²	191	114 Å²	114	83%	0.83	63%	0.631	S	S	*	*			trans	-66.3	165.4	165.3	-61.7	174.8	-178.1	176.6	0	110.2	G776 K780	G776-K778 PolarHBondContact O-N 2.79Å; K778-K780 PolarHBondContact O-N 3.42Å
779	C	66.4	Low	59.4	Low	62 Å²	62	109.5 Å²	109.5	42%	0.419	61%	0.613	S	S	.	*			trans	-43.7	129.7	174.5	-65.2	0	0	0	0	111.9	Y746 C748 L781	Y746-C779 HydrophobicContact CD1-CB 4.24Å; C748-C779 HydrophobicContact CB-CB 3.68Å; C748-C779 WeakPolarHBondContact CB-SG 3.47Å; C748-C779 WeakPolarHBondContact SG-CB 3.09Å; C748-C779 CovalentContact SG-SG 2.04Å; C748-C779 PolarHBondContact SG-SG 2.74Å; C779-L781 PolarHBondContact O-N 3.44Å; C779-L781 VanDerWaalsContact O-N 3.12Å
780	K	80.6	Confident	62.1	Low	114 Å²	114	110.3 Å²	110.3	50%	0.496	61%	0.614	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-75	107.9	178.2	174.7	-176.8	170	-159.5	0	108.8	Q747 K778	Q747-K780 HydrophobicContact CB-CB 4.16Å; Q747-K780 WeakPolarHBondContact CB-O 3.41Å; Q747-K780 PolarHBondContact N-O 2.74Å; Q747-K780 PolarHBondContact O-N 3.44Å; Q747-K780 VanDerWaalsContact O-N 3.09Å; K778-K780 PolarHBondContact O-N 3.42Å
781	L	82.6	Confident	64.5	Low	78 Å²	78	108 Å²	108	41%	0.408	60%	0.595	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-78.9	140.8	176	174.8	61.3	0	0	0	110.8	R744 H745 Y746 C779	R744-L781 HydrophobicContact CB-CD1 3.87Å; R744-L781 HydrophobicContact CG-CD1 3.97Å; H745-L781 CarbonylContact O-C 3.6Å; H745-L781 WeakPolarHBondContact O-CA 3.44Å; Y746-L781 HydrophobicContact CD1-CD1 4.18Å; Y746-L781 HydrophobicContact CE1-CB 4.5Å; Y746-L781 HydrophobicContact CE1-CD1 3.88Å; Y746-L781 HydrophobicContact CE2-CD1 4.3Å; C779-L781 PolarHBondContact O-N 3.44Å; C779-L781 VanDerWaalsContact O-N 3.12Å
782	L	84.5	Confident	67.2	Low	83 Å²	83	104.4 Å²	104.4	44%	0.435	57%	0.569	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-134	125.3	168.4	-170.7	73.6	0	0	0	108.1	H745 L784	H745-L782 HydrophobicContact CB-CB 4.49Å; H745-L782 PolarHBondContact N-O 3.18Å; H745-L782 PolarHBondContact O-N 3.39Å; L782-L784 HydrophobicContact CD2-CD2 4.1Å; L782-L784 HydrophobicContact CG-CD2 4.46Å
783	E	85	Confident	69.7	Low	129 Å²	129	104.9 Å²	104.9	60%	0.603	57%	0.569	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-80	144.6	172.3	-56.1	-153.3	128	0	0	110	R744	R744-E783 HydrophobicContact CG-CG 4.22Å; R744-E783 IonicContact CZ-OE1 3.5Å; R744-E783 IonicContact NE-OE1 2.67Å; R744-E783 PolarHBondContact NE-OE1 2.82Å; R744-E783 IonicContact NH2-OE1 2.74Å; R744-E783 PolarHBondContact NH2-OE1 3.49Å
784	L	86.1	Confident	71.9	Confident	41 Å²	41	100 Å²	100	22%	0.215	54%	0.543	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	150.9	-175.1	-64.7	-179.1	0	0	0	110.4	W743 H745 L782 L805 L807 I818	W743-L784 HydrophobicContact CB-CB 4.09Å; W743-L784 PolarHBondContact O-N 3.35Å; H745-L784 HydrophobicContact CB-CD1 3.75Å; H745-L784 HydrophobicContact CB-CG 4.12Å; L782-L784 HydrophobicContact CD2-CD2 4.1Å; L782-L784 HydrophobicContact CG-CD2 4.46Å; L784-L805 HydrophobicContact CB-CD1 4.15Å; L784-L805 HydrophobicContact CD1-CD1 4.22Å; L784-L805 HydrophobicContact CD1-CD2 3.75Å; L784-L807 HydrophobicContact CD1-CD2 4.1Å; L784-I818 HydrophobicContact CD1-CD1 4.41Å
785	K	81.2	Confident	73.9	Confident	198 Å²	198	96 Å²	96	86%	0.861	53%	0.53	S	S	*	.			trans	-105.4	114	177.2	-170.5	173.3	-177.4	179.2	0	109.9
786	G	83.7	Confident	76.1	Confident	20 Å²	20	87.6 Å²	87.6	21%	0.206	49%	0.493	C	S	.	.			trans	-87	-173.4	169.6	0	0	0	0	0	112.7	H804	G786-H804 CarbonylContact C-O 3.49Å; G786-H804 WeakPolarHBondContact CA-O 3.46Å
787	S	87	Confident	77.9	Confident	67 Å²	67	87.3 Å²	87.3	47%	0.469	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	119.2	171.4	56.5	0	0	0	0	110.5	S803 H804	S787-S803 CarbonylContact O-C 3.6Å; S787-S803 WeakPolarHBondContact O-CA 3.43Å; S787-H804 PolarHBondContact N-O 3.24Å; S787-H804 PolarHBondContact O-N 2.66Å
788	D	84.6	Confident	79.6	Confident	111 Å²	111	80.9 Å²	80.9	59%	0.594	46%	0.461	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.9	142.7	-172.1	-47.6	-46.6	0	0	0	112.4	R802 S803	D788-R802 WeakPolarHBondContact CA-O 3.41Å; D788-S803 WeakPolarHBondContact OD1-CB 3.35Å; D788-S803 PolarHBondContact OD1-OG 2.61Å
789	E	86.3	Confident	81.1	Confident	86 Å²	86	75 Å²	75	40%	0.402	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-91.9	161.4	177.9	-57.5	-159.5	122.4	0	0	112.8	R802 H804	E789-R802 HydrophobicContact CB-CB 4.07Å; E789-R802 HydrophobicContact CG-CB 3.95Å; E789-R802 PolarHBondContact N-O 3.2Å; E789-R802 WeakPolarHBondContact OE2-CD 3.34Å; E789-R802 IonicContact OE2-NE 2.89Å; E789-R802 IonicContact OE2-NH1 3.74Å; E789-R802 PolarHBondContact OE2-NH1 2.81Å; E789-H804 IonicContact OE1-NE2 3.72Å
790	T	84.6	Confident	82.1	Confident	118 Å²	118	73.3 Å²	73.3	72%	0.724	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-65.8	137.5	169.8	50.9	0	0	0	0	111.6	V792	T790-V792 WeakPolarHBondContact O-CG2 3.12Å; T790-V792 PolarHBondContact O-N 2.77Å
791	P	80.7	Confident	82.5	Confident	69 Å²	69	68.4 Å²	68.4	45%	0.448	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-52.4	131.3	178	-31.7	37.7	0	0	0	114.7	V738 L799 L800	V738-P791 HydrophobicContact CG1-CG 4.4Å; V738-P791 HydrophobicContact CG2-CB 4.09Å; V738-P791 HydrophobicContact CG2-CG 4.12Å; P791-L799 HydrophobicContact CB-CB 4.32Å; P791-L799 HydrophobicContact CB-CD1 4.3Å; P791-L799 HydrophobicContact CB-CD2 4.42Å; P791-L800 WeakPolarHBondContact CA-O 3.37Å
792	V	84.8	Confident	82.8	Confident	52 Å²	52	68.8 Å²	68.8	32%	0.315	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	138.5	-175.7	-175.7	0	0	0	0	109.9	T790 G794 L799 L800	T790-V792 WeakPolarHBondContact O-CG2 3.12Å; T790-V792 PolarHBondContact O-N 2.77Å; V792-G794 PolarHBondContact O-N 3.3Å; V792-L799 CarbonylContact O-C 3.37Å; V792-L799 WeakPolarHBondContact O-CA 3.36Å; V792-L800 HydrophobicContact CB-CB 4.43Å; V792-L800 PolarHBondContact N-O 2.57Å; V792-L800 PolarHBondContact O-N 2.89Å
793	P	81.2	Confident	83.1	Confident	110 Å²	110	64.8 Å²	64.8	71%	0.714	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-51.1	122.4	171	-28	36.4	0	0	0	112
794	G	73	Confident	83.3	Confident	19 Å²	19	60.5 Å²	60.5	20%	0.196	36%	0.361	C	S	.	.			trans	-110.3	-176.6	-175.7	0	0	0	0	0	113.4	S734 V792 G798	S734-G794 WeakPolarHBondContact OG-CA 3.17Å; V792-G794 PolarHBondContact O-N 3.3Å; G794-G798 PolarHBondContact N-O 2.73Å
795	A	73.7	Confident	83.4	Confident	62 Å²	62	59 Å²	59	51%	0.512	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-52.3	150.7	170.7	0	0	0	0	0	111.2	S734 G797 G798	S734-A795 WeakPolarHBondContact CB-O 3.36Å; S734-A795 PolarHBondContact OG-N 3.25Å; S734-A795 PolarHBondContact OG-O 3.43Å; A795-G797 PolarHBondContact O-N 2.73Å; A795-G798 PolarHBondContact O-N 2.17Å
796	S	76.4	Confident	83.6	Confident	23 Å²	23	56.3 Å²	56.3	16%	0.161	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	62.2	22	174.4	-59.3	0	0	0	0	115.5	K673 E674 N676 F705 G798	K673-S796 WeakPolarHBondContact CG-OG 3.26Å; K673-S796 WeakPolarHBondContact O-CB 3.16Å; K673-S796 PolarHBondContact O-OG 2.93Å; E674-S796 WeakPolarHBondContact CA-OG 3.36Å; E674-S796 PolarHBondContact N-OG 2.95Å; N676-S796 WeakPolarHBondContact CB-O 3.25Å; N676-S796 PolarHBondContact ND2-O 3.01Å; F705-S796 WeakPolarHBondContact CE1-O 3.32Å; F705-S796 WeakPolarHBondContact CZ-O 3.26Å; S796-G798 PolarHBondContact O-N 3.24Å
797	G	72.6	Confident	83.7	Confident	62 Å²	62	57 Å²	57	64%	0.639	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	69.8	12.7	180	0	0	0	0	0	114.8	A795	A795-G797 PolarHBondContact O-N 2.73Å
798	G	82.6	Confident	83.6	Confident	4 Å²	4	61.5 Å²	61.5	4%	0.041	34%	0.343	C	S	.	.			trans	-87.2	-166.7	172.4	0	0	0	0	0	112.8	S734 G794 A795 S796	S734-G798 VanDerWaalsContact OG-C 3.27Å; S734-G798 WeakPolarHBondContact OG-CA 3.37Å; G794-G798 PolarHBondContact N-O 2.73Å; A795-G798 PolarHBondContact O-N 2.17Å; S796-G798 PolarHBondContact O-N 3.24Å
799	L	86.4	Confident	83.7	Confident	68 Å²	68	56.3 Å²	56.3	36%	0.356	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	134.1	179.5	-68.6	172.7	0	0	0	111.4	S734 S735 V738 P791 V792	S734-L799 WeakPolarHBondContact CA-O 3.1Å; S735-L799 PolarHBondContact N-O 3.19Å; S735-L799 PolarHBondContact O-N 3.02Å; S735-L799 PolarHBondContact OG-O 2.98Å; V738-L799 HydrophobicContact CB-CB 3.85Å; V738-L799 HydrophobicContact CB-CD1 4.29Å; V738-L799 HydrophobicContact CG2-CB 3.91Å; P791-L799 HydrophobicContact CB-CB 4.32Å; P791-L799 HydrophobicContact CB-CD1 4.3Å; P791-L799 HydrophobicContact CB-CD2 4.42Å; V792-L799 CarbonylContact O-C 3.37Å; V792-L799 WeakPolarHBondContact O-CA 3.36Å
800	L	87.2	Confident	83.7	Confident	25 Å²	25	54.2 Å²	54.2	13%	0.131	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	151.4	171.8	-69	153.6	0	0	0	110.5	Q731 A732 P791 V792	Q731-L800 HydrophobicContact CG-CD2 4.37Å; A732-L800 WeakPolarHBondContact O-CD2 3.22Å; P791-L800 WeakPolarHBondContact CA-O 3.37Å; V792-L800 HydrophobicContact CB-CB 4.43Å; V792-L800 PolarHBondContact N-O 2.57Å; V792-L800 PolarHBondContact O-N 2.89Å
801	A	88.4	Confident	83.8	Confident	11 Å²	11	50.9 Å²	50.9	9%	0.091	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	148.7	168.9	0	0	0	0	0	110.9	Q731 A732 V738 A739 I741	Q731-A801 WeakPolarHBondContact CA-O 3.3Å; A732-A801 HydrophobicContact CB-CB 4.37Å; A732-A801 PolarHBondContact N-O 2.85Å; A732-A801 PolarHBondContact O-N 3.33Å; V738-A801 HydrophobicContact CG2-CB 4.05Å; A739-A801 VanDerWaalsContact O-CB 3.3Å; A739-A801 WeakPolarHBondContact O-CB 3.44Å; I741-A801 HydrophobicContact CD1-CB 4.03Å
802	R	89.9	Confident	83.9	Confident	86 Å²	86	51.7 Å²	51.7	33%	0.325	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	153	-177	-74.8	171.7	178.8	163.3	2	112.6	C730 Q731 D788 E789	C730-R802 CarbonylContact O-C 3.53Å; C730-R802 VanDerWaalsContact O-CA 3.27Å; C730-R802 WeakPolarHBondContact O-CA 3.43Å; Q731-R802 HydrophobicContact CB-CG 4.03Å; Q731-R802 HydrophobicContact CG-CG 3.82Å; D788-R802 WeakPolarHBondContact CA-O 3.41Å; E789-R802 HydrophobicContact CB-CB 4.07Å; E789-R802 HydrophobicContact CG-CB 3.95Å; E789-R802 PolarHBondContact N-O 3.2Å; E789-R802 WeakPolarHBondContact OE2-CD 3.34Å; E789-R802 IonicContact OE2-NE 2.89Å; E789-R802 IonicContact OE2-NH1 3.74Å; E789-R802 PolarHBondContact OE2-NH1 2.81Å
803	S	89.9	Confident	84.1	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	145.3	176	-167.7	0	0	0	0	110.7	C730 W743 S787 D788	C730-S803 PolarHBondContact N-O 3.4Å; C730-S803 PolarHBondContact O-N 3.12Å; W743-S803 PolarHBondContact NE1-OG 3.08Å; S787-S803 CarbonylContact O-C 3.6Å; S787-S803 WeakPolarHBondContact O-CA 3.43Å; D788-S803 WeakPolarHBondContact OD1-CB 3.35Å; D788-S803 PolarHBondContact OD1-OG 2.61Å
804	H	89.5	Confident	84.4	Confident	39 Å²	39	48.1 Å²	48.1	18%	0.181	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	144	-178.2	-66.2	-118.6	0	0	0	111.2	E727 N729 G786 S787 E789	E727-H804 IonicContact OE1-CE1 2.7Å; E727-H804 IonicContact OE1-ND1 3.41Å; E727-H804 PolarHBondContact OE1-ND1 3.02Å; N729-H804 VanDerWaalsContact CG-CE1 3.48Å; N729-H804 PolarHBondContact ND2-CE1 3.42Å; N729-H804 PolarHBondContact ND2-ND1 3.07Å; N729-H804 PolarHBondContact OD1-ND1 2.81Å; G786-H804 CarbonylContact C-O 3.49Å; G786-H804 WeakPolarHBondContact CA-O 3.46Å; S787-H804 PolarHBondContact N-O 3.24Å; S787-H804 PolarHBondContact O-N 2.66Å; E789-H804 IonicContact OE1-NE2 3.72Å
805	L	88.6	Confident	85	Confident	9 Å²	9	50 Å²	50	5%	0.047	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	130.5	179.1	175.7	66.7	0	0	0	111	I728 W743 L784 L807 I818	I728-L805 PolarHBondContact N-O 3.41Å; I728-L805 PolarHBondContact O-N 3.05Å; W743-L805 HydrophobicContact CD2-CB 3.93Å; W743-L805 HydrophobicContact CD2-CD2 3.86Å; W743-L805 HydrophobicContact CD2-CG 4.45Å; W743-L805 HydrophobicContact CE3-CB 4.02Å; W743-L805 HydrophobicContact CE3-CD2 3.42Å; W743-L805 VanDerWaalsContact CE3-CD2 3.42Å; W743-L805 HydrophobicContact CE3-CG 4.34Å; W743-L805 HydrophobicContact CG-CD2 4.42Å; W743-L805 HydrophobicContact CH2-CB 3.75Å; W743-L805 HydrophobicContact CH2-CD2 4.41Å; W743-L805 HydrophobicContact CZ2-CB 3.65Å; W743-L805 HydrophobicContact CZ3-CB 3.93Å; W743-L805 HydrophobicContact CZ3-CD2 3.72Å; W743-L805 HydrophobicContact CZ3-CG 4.48Å; L784-L805 HydrophobicContact CB-CD1 4.15Å; L784-L805 HydrophobicContact CD1-CD1 4.22Å; L784-L805 HydrophobicContact CD1-CD2 3.75Å; L805-L807 HydrophobicContact CD2-CD1 4.22Å; L805-L807 HydrophobicContact CD2-CG 4.32Å; L805-L807 HydrophobicContact CG-CG 4.25Å; L805-I818 HydrophobicContact CD2-CG2 3.92Å
806	W	85.5	Confident	85.7	Confident	141 Å²	141	47 Å²	47	53%	0.534	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	125.8	178	-65.5	91.7	0	0	0	111.1	Q725 E727	Q725-W806 HydrophobicContact CG-CE3 4.12Å; E727-W806 HydrophobicContact CB-CD2 4.45Å; E727-W806 HydrophobicContact CB-CE3 3.88Å; E727-W806 HydrophobicContact CB-CH2 3.9Å; E727-W806 HydrophobicContact CB-CZ2 4.43Å; E727-W806 HydrophobicContact CB-CZ3 3.6Å; E727-W806 HydrophobicContact CG-CD2 4.12Å; E727-W806 HydrophobicContact CG-CE3 4.02Å; E727-W806 HydrophobicContact CG-CH2 3.67Å; E727-W806 HydrophobicContact CG-CZ2 3.72Å; E727-W806 HydrophobicContact CG-CZ3 3.83Å; E727-W806 WeakPolarHBondContact OE2-CH2 3.47Å
807	L	85	Confident	86.3	Confident	34 Å²	34	49.3 Å²	49.3	18%	0.178	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	150.8	177.8	-69.7	178.4	0	0	0	111.6	L726 I728 L784 L805 P809 I818	L726-L807 PolarHBondContact N-O 3.21Å; L726-L807 PolarHBondContact O-N 3.09Å; I728-L807 HydrophobicContact CD1-CD1 3.82Å; L784-L807 HydrophobicContact CD1-CD2 4.1Å; L805-L807 HydrophobicContact CD2-CD1 4.22Å; L805-L807 HydrophobicContact CD2-CG 4.32Å; L805-L807 HydrophobicContact CG-CG 4.25Å; L807-P809 WeakPolarHBondContact O-CD 3.49Å; L807-I818 HydrophobicContact CD1-CD1 3.52Å; L807-I818 HydrophobicContact CD1-CG1 3.78Å
808	R	85.6	Confident	87.1	Confident	163 Å²	163	46.4 Å²	46.4	62%	0.615	20%	0.201	S	C	*	.			trans	-120.2	81	172	-163.6	171.5	-173	165.2	4.1	110.5	G723	G723-R808 VanDerWaalsContact O-CZ 3.32Å; G723-R808 PolarHBondContact O-NE 3.06Å; G723-R808 PolarHBondContact O-NH2 3.44Å
809	P	85.1	Confident	87.4	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.013	20%	0.2	C	C	.	.			trans	-64.6	147.3	-173	23.2	-33.5	0	0	0	114	V720 G723 E724 L726 L807 Y813 I840	V720-P809 HydrophobicContact CG1-CG 3.93Å; G723-P809 PolarHBondContact N-O 2.95Å; E724-P809 WeakPolarHBondContact O-CD 3.47Å; L726-P809 HydrophobicContact CB-CG 4.44Å; L807-P809 WeakPolarHBondContact O-CD 3.49Å; P809-Y813 HydrophobicContact CB-CD2 4.15Å; P809-I840 HydrophobicContact CB-CD1 3.63Å; P809-I840 HydrophobicContact CB-CG1 4.24Å
810	T	87.4	Confident	87.6	Confident	41 Å²	41	43.2 Å²	43.2	25%	0.252	18%	0.184	S	C	.	.			trans	-116.2	161.1	169.9	71.5	0	0	0	0	109.4	R812 Y813 I840	T810-R812 PolarHBondContact O-N 3.32Å; T810-Y813 PolarHBondContact O-N 3.11Å; T810-I840 WeakPolarHBondContact O-CD1 3.29Å
811	W	85.7	Confident	87.6	Confident	49 Å²	49	43.4 Å²	43.4	19%	0.186	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-47.7	-31.6	179.6	74	-104.9	0	0	0	114.5	S722 A751 F754 Y755 Y813 H814 F842 Q845 Y870	S722-W811 PolarHBondContact OG-N 3.14Å; A751-W811 HydrophobicContact CB-CE3 4.22Å; A751-W811 HydrophobicContact CB-CZ3 4.35Å; A751-W811 VanDerWaalsContact CB-O 3.26Å; A751-W811 WeakPolarHBondContact CB-O 3.34Å; F754-W811 HydrophobicContact CD1-CH2 4.11Å; F754-W811 HydrophobicContact CD1-CZ3 4.02Å; F754-W811 HydrophobicContact CE1-CH2 4.42Å; Y755-W811 HydrophobicContact CD2-CH2 4.23Å; Y755-W811 HydrophobicContact CD2-CZ2 4.43Å; W811-Y813 PolarHBondContact O-N 2.66Å; W811-H814 VanDerWaalsContact O-CB 3.3Å; W811-H814 WeakPolarHBondContact O-CB 3.37Å; W811-H814 PolarHBondContact O-N 3.22Å; W811-H814 VanDerWaalsContact O-N 3.09Å; W811-F842 HydrophobicContact CB-CB 3.72Å; W811-F842 HydrophobicContact CB-CD1 3.63Å; W811-F842 HydrophobicContact CB-CD2 3.99Å; W811-F842 HydrophobicContact CB-CE1 4.25Å; W811-F842 HydrophobicContact CB-CG 3.51Å; W811-F842 HydrophobicContact CG-CG 4.47Å; W811-Q845 HydrophobicContact CD2-CG 4.29Å; W811-Q845 HydrophobicContact CZ2-CG 4.44Å; W811-Y870 HydrophobicContact CZ3-CD1 4.42Å
812	R	84.5	Confident	87.5	Confident	86 Å²	86	43 Å²	43	33%	0.325	18%	0.18	S	C	.	.	G	3₁₀ helix	trans	-63.4	-18.2	177.7	-68.2	-177.9	-67.7	-176.7	-3.3	114.5	H752 Y755 T810 H814	H752-R812 PolarHBondContact N-O 3.17Å; Y755-R812 HydrophobicContact CD2-CG 4.44Å; Y755-R812 HydrophobicContact CG-CG 4.18Å; Y755-R812 VanDerWaalsContact CZ-NH1 3.32Å; Y755-R812 PolarHBondContact OH-NH1 3.28Å; T810-R812 PolarHBondContact O-N 3.32Å; R812-H814 VanDerWaalsContact C-N 3.35Å
813	Y	87.7	Confident	87.2	Confident	69 Å²	69	43.3 Å²	43.3	27%	0.271	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	-92.4	8.3	176.6	-53.7	-17.3	0	0	0	112.7	P809 T810 W811 M815 D816	P809-Y813 HydrophobicContact CB-CD2 4.15Å; T810-Y813 PolarHBondContact O-N 3.11Å; W811-Y813 PolarHBondContact O-N 2.66Å; Y813-M815 PolarHBondContact O-N 2.85Å; Y813-D816 WeakPolarHBondContact CA-OD2 3.43Å; Y813-D816 WeakPolarHBondContact O-CB 3.42Å; Y813-D816 PolarHBondContact O-N 3.25Å
814	H	87.6	Confident	87	Confident	18 Å²	18	43.3 Å²	43.3	8%	0.083	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	121.3	-177.4	179.5	33.1	0	0	0	110.7	A751 W811 R812 D816 L838 N839 I840 F842 Y870 N872	A751-H814 HydrophobicContact CB-CB 3.93Å; W811-H814 VanDerWaalsContact O-CB 3.3Å; W811-H814 WeakPolarHBondContact O-CB 3.37Å; W811-H814 PolarHBondContact O-N 3.22Å; W811-H814 VanDerWaalsContact O-N 3.09Å; R812-H814 VanDerWaalsContact C-N 3.35Å; H814-D816 VanDerWaalsContact C-N 3.3Å; H814-L838 PolarHBondContact ND1-O 2.91Å; H814-N839 PolarHBondContact CE1-OD1 2.93Å; H814-I840 HydrophobicContact CB-CB 4.22Å; H814-I840 HydrophobicContact CB-CD1 4.5Å; H814-I840 PolarHBondContact ND1-N 2.89Å; H814-F842 HydrophobicContact CB-CE1 4.03Å; H814-F842 AromaticContact CD2-CE1 3.64Å; H814-Y870 PolarHBondContact CD2-OH 2.04Å; H814-Y870 VanDerWaalsContact CD2-OH 3.3Å; H814-N872 PolarHBondContact CE1-ND2 2.84Å; H814-N872 PolarHBondContact NE2-ND2 2.87Å
815	M	86.6	Confident	86.4	Confident	57 Å²	57	46.1 Å²	46.1	28%	0.281	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.5	15.6	-170.9	-45.3	-66.8	-87.3	0	0	115.5	Y813 Q837 L838	Y813-M815 PolarHBondContact O-N 2.85Å; M815-Q837 HydrophobicContact CB-CG 4.29Å; M815-Q837 VanDerWaalsContact CE-CD 3.48Å; M815-Q837 HydrophobicContact CE-CG 4.32Å; M815-Q837 VanDerWaalsContact CE-OE1 3.32Å; M815-Q837 HydrophobicContact SD-CG 4.09Å; M815-L838 PolarHBondContact N-O 2.83Å
816	D	88.5	Confident	86	Confident	0 Å²	0	50 Å²	50	0%	0	23%	0.231	C	C	.	.			trans	-65.9	159	158.7	-76.3	-16.1	0	0	0	109.7	H745 Y746 Q747 C748 G749 H752 Y813 H814 L838	H745-D816 IonicContact NE2-OD2 3.43Å; Y746-D816 WeakPolarHBondContact O-CB 3.39Å; Q747-D816 WeakPolarHBondContact CA-OD1 3.24Å; C748-D816 PolarHBondContact N-OD1 3.09Å; G749-D816 PolarHBondContact N-OD1 3.12Å; H752-D816 IonicContact ND1-OD2 2.61Å; Y813-D816 WeakPolarHBondContact CA-OD2 3.43Å; Y813-D816 WeakPolarHBondContact O-CB 3.42Å; Y813-D816 PolarHBondContact O-N 3.25Å; H814-D816 VanDerWaalsContact C-N 3.3Å; D816-L838 HydrophobicContact CB-CD1 4.48Å; D816-L838 PolarHBondContact O-N 2.9Å
817	F	88	Confident	85.4	Confident	72 Å²	72	47.9 Å²	47.9	32%	0.316	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	139.5	-177.4	-60.9	-91.5	0	0	0	112.4	H745 Y746 L836 Q837	H745-F817 CarbonylContact C-O 3.55Å; H745-F817 WeakPolarHBondContact CA-O 3.32Å; Y746-F817 HydrophobicContact CD2-CB 4.46Å; Y746-F817 PolarHBondContact N-O 2.81Å; Y746-F817 PolarHBondContact O-N 2.99Å; F817-L836 CarbonylContact C-O 3.35Å; F817-L836 WeakPolarHBondContact CA-O 3.43Å; F817-Q837 HydrophobicContact CD1-CB 3.84Å; F817-Q837 HydrophobicContact CD1-CG 4.11Å; F817-Q837 HydrophobicContact CE1-CB 3.8Å; F817-Q837 HydrophobicContact CE1-CG 3.85Å; F817-Q837 HydrophobicContact CZ-CG 4.33Å
818	I	89	Confident	84.2	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	138.1	166.3	-54.8	-58	0	0	0	108.4	I728 W743 R744 H745 L784 L805 L807 R835 L836 L838	I728-I818 HydrophobicContact CD1-CB 4.3Å; I728-I818 HydrophobicContact CD1-CG1 4.07Å; I728-I818 HydrophobicContact CD1-CG2 4.05Å; W743-I818 HydrophobicContact CE3-CG2 4.06Å; W743-I818 HydrophobicContact CZ3-CG2 4.08Å; R744-I818 WeakPolarHBondContact O-CA 3.22Å; H745-I818 HydrophobicContact CB-CD1 3.66Å; L784-I818 HydrophobicContact CD1-CD1 4.41Å; L805-I818 HydrophobicContact CD2-CG2 3.92Å; L807-I818 HydrophobicContact CD1-CD1 3.52Å; L807-I818 HydrophobicContact CD1-CG1 3.78Å; I818-R835 CarbonylContact O-C 3.56Å; I818-R835 VanDerWaalsContact O-CA 3.28Å; I818-R835 WeakPolarHBondContact O-CA 3.12Å; I818-L836 PolarHBondContact N-O 3.21Å; I818-L836 PolarHBondContact O-N 3.48Å; I818-L838 HydrophobicContact CD1-CD1 4.43Å; I818-L838 HydrophobicContact CG1-CD1 4.22Å; I818-L838 HydrophobicContact CG1-CD2 4.22Å; I818-L838 HydrophobicContact CG1-CG 4.33Å
819	E	89.2	Confident	82.8	Confident	6 Å²	6	43.7 Å²	43.7	3%	0.028	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	141.9	179.7	173.9	178.8	-89	0	0	110.2	W743 R744 Y746 H833 D834 R835	W743-E819 CarbonylContact C-O 3.54Å; W743-E819 WeakPolarHBondContact CA-O 3.22Å; R744-E819 HydrophobicContact CB-CB 4.17Å; R744-E819 WeakPolarHBondContact CD-OE2 3.37Å; R744-E819 PolarHBondContact N-O 2.78Å; R744-E819 IonicContact NH1-OE2 2.75Å; R744-E819 PolarHBondContact NH1-OE2 3.19Å; R744-E819 PolarHBondContact O-N 2.98Å; Y746-E819 HydrophobicContact CE2-CB 3.94Å; Y746-E819 PolarHBondContact OH-OE2 3.15Å; E819-H833 HydrophobicContact CG-CB 4.49Å; E819-D834 WeakPolarHBondContact CA-O 3.14Å; E819-R835 HydrophobicContact CB-CG 4.07Å; E819-R835 HydrophobicContact CG-CG 4.17Å; E819-R835 IonicContact OE1-CZ 2.73Å; E819-R835 IonicContact OE1-NE 3.74Å; E819-R835 PolarHBondContact OE1-NE 3.18Å; E819-R835 IonicContact OE1-NH2 2.71Å; E819-R835 PolarHBondContact OE1-NH2 2.96Å
820	C	90.3	Very high	81.4	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	143.4	165.1	178.2	0	0	0	0	109.3	L712 C730 I741 T742 W743 H833 D834	L712-C820 HydrophobicContact CD1-CB 4.47Å; L712-C820 HydrophobicContact CD2-CB 3.55Å; L712-C820 HydrophobicContact CG-CB 4.16Å; C730-C820 HydrophobicContact CB-CB 3.8Å; C730-C820 WeakPolarHBondContact CB-SG 3.32Å; C730-C820 WeakPolarHBondContact SG-CB 3.41Å; C730-C820 CovalentContact SG-SG 2.03Å; C730-C820 PolarHBondContact SG-SG 2.84Å; I741-C820 WeakPolarHBondContact CG2-SG 3.26Å; T742-C820 WeakPolarHBondContact O-CA 3.47Å; W743-C820 HydrophobicContact CD2-CB 4.17Å; W743-C820 HydrophobicContact CE3-CB 3.86Å; W743-C820 HydrophobicContact CH2-CB 4.44Å; W743-C820 HydrophobicContact CZ3-CB 4.02Å; C820-H833 CarbonylContact O-C 3.41Å; C820-H833 WeakPolarHBondContact O-CA 3.18Å; C820-H833 WeakPolarHBondContact O-CB 3.2Å; C820-D834 PolarHBondContact N-O 3.06Å; C820-D834 PolarHBondContact O-N 2.75Å
821	Q	88.1	Confident	80.2	Confident	28 Å²	28	49.7 Å²	49.7	13%	0.131	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	151.8	-178.1	70.5	179.7	-2.7	0	0	111.7	I741 T742 I831 W832 H833	I741-Q821 CarbonylContact C-O 3.56Å; I741-Q821 WeakPolarHBondContact CA-O 3.46Å; T742-Q821 PolarHBondContact N-O 3.3Å; T742-Q821 PolarHBondContact O-N 3.39Å; T742-Q821 WeakPolarHBondContact OG1-CG 3.27Å; T742-Q821 PolarHBondContact OG1-NE2 2.56Å; Q821-I831 HydrophobicContact CB-CG2 3.68Å; Q821-I831 HydrophobicContact CG-CG2 4.27Å; Q821-W832 CarbonylContact C-O 3.42Å; Q821-W832 VanDerWaalsContact CA-O 3.24Å; Q821-W832 WeakPolarHBondContact CA-O 3.21Å; Q821-H833 HydrophobicContact CB-CB 4.02Å
822	A	87	Confident	79.9	Confident	3 Å²	3	49.6 Å²	49.6	3%	0.025	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	160.1	178.4	0	0	0	0	0	114.6	V710 A732 V740 I741 W832	V710-A822 HydrophobicContact CG2-CB 3.39Å; A732-A822 HydrophobicContact CB-CB 4.2Å; V740-A822 CarbonylContact O-C 3.16Å; V740-A822 WeakPolarHBondContact O-CA 3.32Å; V740-A822 WeakPolarHBondContact O-CB 3.04Å; I741-A822 HydrophobicContact CG1-CB 4.04Å; A822-W832 PolarHBondContact N-O 3.33Å; A822-W832 PolarHBondContact O-N 2.87Å
823	E	83.1	Confident	80	Confident	92 Å²	92	50.3 Å²	50.3	43%	0.43	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	150.2	-174.3	-176	171.8	-163.8	0	0	112.1	A739 V740 P829	A739-E823 CarbonylContact C-O 3.46Å; A739-E823 WeakPolarHBondContact CA-O 3.38Å; A739-E823 VanDerWaalsContact CB-O 3.26Å; A739-E823 WeakPolarHBondContact CB-O 3.34Å; V740-E823 PolarHBondContact N-O 2.98Å; V740-E823 PolarHBondContact O-N 2.94Å; E823-P829 WeakPolarHBondContact OE1-CD 3.13Å
824	N	84.9	Confident	79.9	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.005	27%	0.266	C	S	.	.			trans	-118.6	132.3	-179.1	-176	-80.8	0	0	0	112.5	P737 V826 Y827 G828 W832	P737-N824 PolarHBondContact O-ND2 3.17Å; N824-V826 PolarHBondContact O-N 3.09Å; N824-V826 PolarHBondContact OD1-N 3.47Å; N824-Y827 PolarHBondContact OD1-N 3.45Å; N824-G828 WeakPolarHBondContact O-CA 3.39Å; N824-G828 PolarHBondContact O-N 3.3Å; N824-W832 HydrophobicContact CB-CH2 4.06Å; N824-W832 HydrophobicContact CB-CZ3 3.86Å
825	P	78.1	Confident	79.9	Confident	97 Å²	97	55 Å²	55	63%	0.63	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-13.7	-169.8	30.5	-36.9	0	0	0	115.7	P737 V738	P737-P825 HydrophobicContact CG-CG 4.23Å; V738-P825 WeakPolarHBondContact O-CD 3.32Å
826	V	79.3	Confident	79.8	Confident	92 Å²	92	53.5 Å²	53.5	56%	0.558	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-32.2	177.8	169.6	0	0	0	0	112.1	P737 N824	P737-V826 HydrophobicContact CG-CB 4.35Å; P737-V826 HydrophobicContact CG-CG2 3.47Å; P737-V826 VanDerWaalsContact CG-CG2 3.47Å; N824-V826 PolarHBondContact O-N 3.09Å; N824-V826 PolarHBondContact OD1-N 3.47Å
827	Y	72.9	Confident	79.7	Confident	95 Å²	95	57.4 Å²	57.4	37%	0.373	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-16.1	-176.7	-71.3	-95	0	0	0	113.7	P706 N824	P706-Y827 HydrophobicContact CB-CD1 4.43Å; P706-Y827 HydrophobicContact CB-CD2 3.69Å; P706-Y827 HydrophobicContact CB-CE2 4.09Å; P706-Y827 HydrophobicContact CB-CG 3.88Å; P706-Y827 HydrophobicContact CG-CD1 4.23Å; P706-Y827 HydrophobicContact CG-CD2 4.15Å; P706-Y827 HydrophobicContact CG-CE1 4.26Å; P706-Y827 HydrophobicContact CG-CE2 4.19Å; P706-Y827 HydrophobicContact CG-CG 4.17Å; N824-Y827 PolarHBondContact OD1-N 3.45Å
828	G	59.3	Low	79.6	Confident	24 Å²	24	54.3 Å²	54.3	25%	0.247	28%	0.283	C	S	.	.			trans	69.9	-173.9	-174.9	0	0	0	0	0	113.1	N824 P830	N824-G828 WeakPolarHBondContact O-CA 3.39Å; N824-G828 PolarHBondContact O-N 3.3Å; G828-P830 WeakPolarHBondContact O-CD 3.45Å
829	P	56.4	Low	79.5	Confident	86 Å²	86	57 Å²	57	56%	0.558	30%	0.298	S	S	*	.			trans	-75.5	111.9	177.1	29	-31.2	0	0	0	110	E823 I831	E823-P829 WeakPolarHBondContact OE1-CD 3.13Å; P829-I831 HydrophobicContact CB-CG1 3.74Å
830	P	56.1	Low	79.5	Confident	83 Å²	83	56.8 Å²	56.8	54%	0.539	30%	0.297	S	S	.	.				-82.7	122.6	88.2	21.7	-34.2	0	0	0	111.3	G828 W832	G828-P830 WeakPolarHBondContact O-CD 3.45Å; P830-W832 HydrophobicContact CG-CH2 4.3Å; P830-W832 HydrophobicContact CG-CZ2 4.22Å; P830-W832 VanDerWaalsContact O-CZ3 3.29Å; P830-W832 WeakPolarHBondContact O-CZ3 3.23Å; P830-W832 PolarHBondContact O-N 3.44Å
831	I	62.3	Low	79.5	Confident	86 Å²	86	57.6 Å²	57.6	44%	0.441	30%	0.302	S	S	.	.			trans	-78	108	175.4	-57.2	177.8	0	0	0	108.1	Q821 P829	Q821-I831 HydrophobicContact CB-CG2 3.68Å; Q821-I831 HydrophobicContact CG-CG2 4.27Å; P829-I831 HydrophobicContact CB-CG1 3.74Å
832	W	79.8	Confident	79.5	Confident	46 Å²	46	56.7 Å²	56.7	17%	0.174	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	133.1	170.9	-62.4	-92.2	0	0	0	109	P706 P707 V710 Q821 A822 N824 P830	P706-W832 HydrophobicContact CB-CH2 3.98Å; P706-W832 HydrophobicContact CB-CZ2 4.07Å; P707-W832 HydrophobicContact CG-CD2 4.02Å; P707-W832 HydrophobicContact CG-CE3 3.81Å; P707-W832 HydrophobicContact CG-CH2 3.9Å; P707-W832 HydrophobicContact CG-CZ2 4.06Å; P707-W832 HydrophobicContact CG-CZ3 3.76Å; P707-W832 VanDerWaalsContact O-CE2 3.27Å; P707-W832 VanDerWaalsContact O-CZ2 3.24Å; P707-W832 WeakPolarHBondContact O-CZ2 3.49Å; P707-W832 PolarHBondContact O-NE1 3.15Å; V710-W832 HydrophobicContact CB-CB 4.32Å; V710-W832 HydrophobicContact CG2-CB 3.57Å; Q821-W832 CarbonylContact C-O 3.42Å; Q821-W832 VanDerWaalsContact CA-O 3.24Å; Q821-W832 WeakPolarHBondContact CA-O 3.21Å; A822-W832 PolarHBondContact N-O 3.33Å; A822-W832 PolarHBondContact O-N 2.87Å; N824-W832 HydrophobicContact CB-CH2 4.06Å; N824-W832 HydrophobicContact CB-CZ3 3.86Å; P830-W832 HydrophobicContact CG-CH2 4.3Å; P830-W832 HydrophobicContact CG-CZ2 4.22Å; P830-W832 VanDerWaalsContact O-CZ3 3.29Å; P830-W832 WeakPolarHBondContact O-CZ3 3.23Å; P830-W832 PolarHBondContact O-N 3.44Å
833	H	86.2	Confident	79.6	Confident	102 Å²	102	57.5 Å²	57.5	47%	0.472	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	159	178.8	71.3	69.1	0	0	0	112.6	E819 C820 Q821	E819-H833 HydrophobicContact CG-CB 4.49Å; C820-H833 CarbonylContact O-C 3.41Å; C820-H833 WeakPolarHBondContact O-CA 3.18Å; C820-H833 WeakPolarHBondContact O-CB 3.2Å; Q821-H833 HydrophobicContact CB-CB 4.02Å
834	D	85.6	Confident	79.8	Confident	55 Å²	55	53.1 Å²	53.1	29%	0.294	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	156.9	175.3	-169.1	12.5	0	0	0	110.5	V710 S711 L712 E819 C820	V710-D834 WeakPolarHBondContact O-CB 3.24Å; S711-D834 WeakPolarHBondContact CA-OD2 3.49Å; L712-D834 HydrophobicContact CD1-CB 4.3Å; L712-D834 WeakPolarHBondContact CD1-O 3.15Å; L712-D834 HydrophobicContact CG-CB 4.07Å; L712-D834 PolarHBondContact N-OD2 2.79Å; E819-D834 WeakPolarHBondContact CA-O 3.14Å; C820-D834 PolarHBondContact N-O 3.06Å; C820-D834 PolarHBondContact O-N 2.75Å
835	R	86.6	Confident	79.8	Confident	129 Å²	129	55.7 Å²	55.7	49%	0.487	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	123.8	-171.2	-67.1	-174.7	177	165.8	2.1	113.7	I818 E819	I818-R835 CarbonylContact O-C 3.56Å; I818-R835 VanDerWaalsContact O-CA 3.28Å; I818-R835 WeakPolarHBondContact O-CA 3.12Å; E819-R835 HydrophobicContact CB-CG 4.07Å; E819-R835 HydrophobicContact CG-CG 4.17Å; E819-R835 IonicContact OE1-CZ 2.73Å; E819-R835 IonicContact OE1-NE 3.74Å; E819-R835 PolarHBondContact OE1-NE 3.18Å; E819-R835 IonicContact OE1-NH2 2.71Å; E819-R835 PolarHBondContact OE1-NH2 2.96Å
836	L	85	Confident	79.6	Confident	26 Å²	26	52.9 Å²	52.9	14%	0.136	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	127.5	171.8	179.6	61.3	0	0	0	110.7	L712 F714 I728 F817 I818 L838	L712-L836 HydrophobicContact CD1-CB 4.07Å; F714-L836 HydrophobicContact CB-CD2 4.07Å; F714-L836 HydrophobicContact CD1-CD1 3.55Å; F714-L836 HydrophobicContact CD1-CD2 4.01Å; F714-L836 HydrophobicContact CD1-CG 4.42Å; F714-L836 HydrophobicContact CE1-CD1 3.69Å; F714-L836 HydrophobicContact CG-CD1 4.36Å; F714-L836 HydrophobicContact CG-CD2 4.27Å; I728-L836 HydrophobicContact CD1-CD2 3.97Å; I728-L836 HydrophobicContact CG1-CD2 4.18Å; I728-L836 HydrophobicContact CG2-CD2 4.06Å; F817-L836 CarbonylContact C-O 3.35Å; F817-L836 WeakPolarHBondContact CA-O 3.43Å; I818-L836 PolarHBondContact N-O 3.21Å; I818-L836 PolarHBondContact O-N 3.48Å; L836-L838 HydrophobicContact CD2-CD2 4.42Å
837	Q	86.6	Confident	78.8	Confident	83 Å²	83	50.2 Å²	50.2	39%	0.388	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	131.1	170	-172.8	168.9	48.8	0	0	110.9	M815 F817 N839	M815-Q837 HydrophobicContact CB-CG 4.29Å; M815-Q837 VanDerWaalsContact CE-CD 3.48Å; M815-Q837 HydrophobicContact CE-CG 4.32Å; M815-Q837 VanDerWaalsContact CE-OE1 3.32Å; M815-Q837 HydrophobicContact SD-CG 4.09Å; F817-Q837 HydrophobicContact CD1-CB 3.84Å; F817-Q837 HydrophobicContact CD1-CG 4.11Å; F817-Q837 HydrophobicContact CE1-CB 3.8Å; F817-Q837 HydrophobicContact CE1-CG 3.85Å; F817-Q837 HydrophobicContact CZ-CG 4.33Å; Q837-N839 PolarHBondContact O-N 2.91Å
838	L	85.6	Confident	77.9	Confident	7 Å²	7	46.8 Å²	46.8	4%	0.037	25%	0.247	C	C	.	.			trans	-84.4	98.3	-172.4	-61.9	178.9	0	0	0	112.8	L726 H814 M815 D816 I818 L836 I840	L726-L838 HydrophobicContact CD2-CD2 3.87Å; H814-L838 PolarHBondContact ND1-O 2.91Å; M815-L838 PolarHBondContact N-O 2.83Å; D816-L838 HydrophobicContact CB-CD1 4.48Å; D816-L838 PolarHBondContact O-N 2.9Å; I818-L838 HydrophobicContact CD1-CD1 4.43Å; I818-L838 HydrophobicContact CG1-CD1 4.22Å; I818-L838 HydrophobicContact CG1-CD2 4.22Å; I818-L838 HydrophobicContact CG1-CG 4.33Å; L836-L838 HydrophobicContact CD2-CD2 4.42Å; L838-I840 HydrophobicContact CB-CD1 4.1Å; L838-I840 HydrophobicContact CB-CG1 4.26Å
839	N	87.7	Confident	77.6	Confident	57 Å²	57	46 Å²	46	31%	0.305	24%	0.237	S	C	.	.			trans	-83.8	114.6	168	-167	-1	0	0	0	110.1	S718 V720 H814 Q837 N872	S718-N839 WeakPolarHBondContact O-CB 3.04Å; V720-N839 PolarHBondContact N-O 2.88Å; V720-N839 VanDerWaalsContact N-O 3.09Å; H814-N839 PolarHBondContact CE1-OD1 2.93Å; Q837-N839 PolarHBondContact O-N 2.91Å; N839-N872 PolarHBondContact OD1-ND2 3.33Å
840	I	87.9	Confident	77.4	Confident	1 Å²	1	47 Å²	47	1%	0.005	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	128.2	-171.2	-58.9	165.5	0	0	0	109.3	V720 P809 T810 H814 L838 F842 N872	V720-I840 CarbonylContact O-C 2.63Å; V720-I840 WeakPolarHBondContact O-CA 3.2Å; V720-I840 WeakPolarHBondContact O-CG2 3.2Å; P809-I840 HydrophobicContact CB-CD1 3.63Å; P809-I840 HydrophobicContact CB-CG1 4.24Å; T810-I840 WeakPolarHBondContact O-CD1 3.29Å; H814-I840 HydrophobicContact CB-CB 4.22Å; H814-I840 HydrophobicContact CB-CD1 4.5Å; H814-I840 PolarHBondContact ND1-N 2.89Å; L838-I840 HydrophobicContact CB-CD1 4.1Å; L838-I840 HydrophobicContact CB-CG1 4.26Å; I840-F842 WeakPolarHBondContact O-CD1 2.9Å; I840-F842 VanDerWaalsContact O-CE1 3.28Å; I840-F842 WeakPolarHBondContact O-CE1 3.34Å; I840-N872 PolarHBondContact O-ND2 3.2Å
841	T	90	Very high	77.2	Confident	16 Å²	16	48 Å²	48	10%	0.098	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	144.2	176	54.3	0	0	0	0	112.9	V719 V720 S722 N872 Q931	V719-T841 HydrophobicContact CG1-CG2 3.44Å; V719-T841 VanDerWaalsContact CG1-CG2 3.44Å; V720-T841 PolarHBondContact O-N 2.7Å; S722-T841 WeakPolarHBondContact CB-O 3.35Å; S722-T841 PolarHBondContact N-O 2.86Å; T841-N872 CarbonylContact C-O 3.34Å; T841-N872 WeakPolarHBondContact CA-O 3.39Å; T841-N872 VanDerWaalsContact CB-O 3.31Å; T841-N872 WeakPolarHBondContact CB-O 3.07Å; T841-Q931 PolarHBondContact OG1-OE1 2.93Å
842	F	90	Very high	76.6	Confident	10 Å²	10	50.6 Å²	50.6	4%	0.044	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	156.6	-174.8	52.3	-85.4	0	0	0	111.4	W811 H814 I840 Q845 Y870 N872 N929	W811-F842 HydrophobicContact CB-CB 3.72Å; W811-F842 HydrophobicContact CB-CD1 3.63Å; W811-F842 HydrophobicContact CB-CD2 3.99Å; W811-F842 HydrophobicContact CB-CE1 4.25Å; W811-F842 HydrophobicContact CB-CG 3.51Å; W811-F842 HydrophobicContact CG-CG 4.47Å; H814-F842 HydrophobicContact CB-CE1 4.03Å; H814-F842 AromaticContact CD2-CE1 3.64Å; I840-F842 WeakPolarHBondContact O-CD1 2.9Å; I840-F842 VanDerWaalsContact O-CE1 3.28Å; I840-F842 WeakPolarHBondContact O-CE1 3.34Å; F842-Q845 HydrophobicContact CD2-CG 4.05Å; F842-Q845 HydrophobicContact CE2-CG 4.26Å; F842-Y870 HydrophobicContact CE1-CE1 4.46Å; F842-Y870 AromaticContact CE2-CD1 3.75Å; F842-Y870 HydrophobicContact CE2-CD1 3.75Å; F842-Y870 AromaticContact CE2-CE1 3.99Å; F842-Y870 HydrophobicContact CE2-CE1 3.99Å; F842-Y870 AromaticContact CZ-CD1 3.72Å; F842-Y870 HydrophobicContact CZ-CD1 3.72Å; F842-Y870 AromaticContact CZ-CE1 3.47Å; F842-Y870 HydrophobicContact CZ-CE1 3.47Å; F842-Y870 VanDerWaalsContact CZ-CE1 3.47Å; F842-N872 HydrophobicContact CD1-CB 4.09Å; F842-N872 HydrophobicContact CE1-CB 3.53Å; F842-N872 HydrophobicContact CZ-CB 3.85Å; F842-N872 PolarHBondContact N-O 2.99Å; F842-N929 PolarHBondContact O-ND2 3.07Å
843	A	87.9	Confident	75.5	Confident	19 Å²	19	51 Å²	51	16%	0.157	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	153.9	175	0	0	0	0	0	112.1	Q845 H932	A843-Q845 PolarHBondContact O-N 3.27Å; A843-Q845 PolarHBondContact O-NE2 2.96Å; A843-H932 HydrophobicContact CB-CB 3.61Å
844	P	87.3	Confident	74.5	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.006	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.3	123.8	-176.8	-24.6	35.6	0	0	0	113.1	A871 V875 V927 N929 S934	P844-A871 HydrophobicContact CB-CB 4.04Å; P844-A871 HydrophobicContact CG-CB 4.09Å; P844-V875 HydrophobicContact CB-CG2 4.43Å; P844-V875 HydrophobicContact CG-CG2 4.32Å; P844-V927 HydrophobicContact CB-CB 4.2Å; P844-V927 HydrophobicContact CB-CG1 3.64Å; P844-V927 HydrophobicContact CG-CB 4.41Å; P844-V927 HydrophobicContact CG-CG1 3.75Å; P844-N929 HydrophobicContact CG-CB 4.27Å; P844-S934 WeakPolarHBondContact O-CB 3.21Å; P844-S934 PolarHBondContact O-OG 3.29Å
845	Q	84.4	Confident	73.9	Confident	55 Å²	55	52.2 Å²	52.2	26%	0.257	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	125.2	177.2	-56.4	-59.4	-78.3	0	0	109.9	F754 W811 F842 A843 Y870	F754-Q845 HydrophobicContact CE1-CB 4.31Å; W811-Q845 HydrophobicContact CD2-CG 4.29Å; W811-Q845 HydrophobicContact CZ2-CG 4.44Å; F842-Q845 HydrophobicContact CD2-CG 4.05Å; F842-Q845 HydrophobicContact CE2-CG 4.26Å; A843-Q845 PolarHBondContact O-N 3.27Å; A843-Q845 PolarHBondContact O-NE2 2.96Å; Q845-Y870 PolarHBondContact N-O 3.04Å; Q845-Y870 PolarHBondContact O-N 2.95Å
846	F	74.2	Confident	73.6	Confident	38 Å²	38	50.3 Å²	50.3	17%	0.167	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-81.3	144.6	173.1	-62.8	-79.1	0	0	0	111.6	L849 L869 V925 V927 S934 N936	F846-L849 HydrophobicContact CD1-CD1 4.1Å; F846-L869 HydrophobicContact CD1-CD2 3.44Å; F846-L869 VanDerWaalsContact CD1-CD2 3.44Å; F846-L869 HydrophobicContact CE1-CD2 3.58Å; F846-L869 HydrophobicContact CG-CD2 4.36Å; F846-V925 HydrophobicContact CD1-CG1 4.21Å; F846-V925 HydrophobicContact CE1-CG1 3.38Å; F846-V925 HydrophobicContact CZ-CG1 3.83Å; F846-V927 HydrophobicContact CE1-CB 4.38Å; F846-V927 HydrophobicContact CE1-CG2 3.55Å; F846-V927 HydrophobicContact CZ-CB 4.11Å; F846-V927 HydrophobicContact CZ-CG2 3.66Å; F846-S934 WeakPolarHBondContact CZ-O 3.49Å; F846-N936 WeakPolarHBondContact CB-ND2 3.35Å; F846-N936 HydrophobicContact CD1-CB 4.07Å; F846-N936 HydrophobicContact CD2-CB 3.74Å; F846-N936 HydrophobicContact CE1-CB 4.09Å; F846-N936 HydrophobicContact CE2-CB 3.75Å; F846-N936 HydrophobicContact CG-CB 3.9Å; F846-N936 WeakPolarHBondContact CG-ND2 3.04Å; F846-N936 HydrophobicContact CZ-CB 3.93Å
847	Y	63.3	Low	73.5	Confident	36 Å²	36	49.6 Å²	49.6	14%	0.141	26%	0.259	C	S	.	.	S	Bend	trans	-140.9	120.2	175.9	-171.6	-71.8	0	0	0	111.2	F754 R757 H758 Q761	F754-Y847 HydrophobicContact CD1-CD2 4.4Å; F754-Y847 HydrophobicContact CD2-CD2 4.5Å; F754-Y847 HydrophobicContact CE1-CD2 4.04Å; F754-Y847 HydrophobicContact CE2-CD2 4.14Å; F754-Y847 HydrophobicContact CE2-CG 4.06Å; F754-Y847 AromaticContact CZ-CD2 3.93Å; F754-Y847 HydrophobicContact CZ-CD2 3.93Å; F754-Y847 AromaticContact CZ-CG 3.96Å; F754-Y847 HydrophobicContact CZ-CG 3.96Å; R757-Y847 HydrophobicContact CB-CE2 4.38Å; R757-Y847 WeakPolarHBondContact CB-OH 3Å; R757-Y847 PolarHBondContact O-OH 3.32Å; R757-Y847 VanDerWaalsContact O-OH 3.11Å; H758-Y847 VanDerWaalsContact CA-OH 3.26Å; H758-Y847 WeakPolarHBondContact CA-OH 3.02Å; H758-Y847 HydrophobicContact CB-CE2 3.73Å; H758-Y847 PolarHBondContact N-OH 3.13Å; H758-Y847 VanDerWaalsContact N-OH 3.1Å; H758-Y847 AromaticContact ND1-CE2 3.56Å; Q761-Y847 VanDerWaalsContact CD-OH 3.23Å; Q761-Y847 VanDerWaalsContact OE1-CE1 3.24Å; Q761-Y847 VanDerWaalsContact OE1-CZ 3.3Å; Q761-Y847 PolarHBondContact OE1-OH 2.86Å
848	G	52.9	Low	73.3	Confident	22 Å²	22	51.8 Å²	51.8	23%	0.227	26%	0.263	C	S	.	.	S	Bend	trans	86.3	6.6	-172.5	0	0	0	0	0	113.9	R855	G848-R855 PolarHBondContact O-NH2 2.83Å
849	L	54.1	Low	73.3	Confident	9 Å²	9	54 Å²	54	5%	0.047	27%	0.274	C	S	.	.			trans	-112.2	110.7	156.1	-72.1	172.5	0	0	0	107.3	F846 F867 V925 N936 F938	F846-L849 HydrophobicContact CD1-CD1 4.1Å; L849-F867 HydrophobicContact CD1-CB 3.85Å; L849-F867 HydrophobicContact CD1-CD1 3.63Å; L849-F867 HydrophobicContact CD1-CE1 4.25Å; L849-F867 HydrophobicContact CD1-CG 3.74Å; L849-F867 HydrophobicContact CD2-CD1 3.55Å; L849-F867 HydrophobicContact CD2-CE1 3.59Å; L849-F867 HydrophobicContact CD2-CG 4.48Å; L849-F867 HydrophobicContact CG-CB 4.2Å; L849-F867 HydrophobicContact CG-CD1 3.44Å; L849-F867 VanDerWaalsContact CG-CD1 3.44Å; L849-F867 HydrophobicContact CG-CE1 4.04Å; L849-F867 HydrophobicContact CG-CG 4.04Å; L849-V925 HydrophobicContact CD1-CG1 3.88Å; L849-N936 HydrophobicContact CB-CB 4.36Å; L849-N936 WeakPolarHBondContact CB-ND2 3.49Å; L849-N936 HydrophobicContact CD1-CB 4.31Å; L849-N936 PolarHBondContact O-ND2 2.93Å; L849-F938 HydrophobicContact CD2-CB 3.75Å; L849-F938 HydrophobicContact CD2-CD1 3.39Å; L849-F938 HydrophobicContact CD2-CE1 4.14Å; L849-F938 HydrophobicContact CD2-CG 3.73Å
850	Q	52.5	Low	73	Confident	106 Å²	106	53.8 Å²	53.8	50%	0.495	29%	0.285	S	S	.	.			trans	-107.8	151.5	161.2	-59.3	-163.3	-70	0	0	107.9	D852 D853	Q850-D852 PolarHBondContact O-N 2.8Å; Q850-D853 HydrophobicContact CB-CB 4.37Å; Q850-D853 VanDerWaalsContact O-CB 3.26Å; Q850-D853 WeakPolarHBondContact O-CB 3.12Å; Q850-D853 PolarHBondContact O-N 2.87Å
851	V	51.9	Low	72.6	Confident	104 Å²	104	57.7 Å²	57.7	63%	0.63	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	137.2	163.6	-175.8	0	0	0	0	107.5	D853	V851-D853 VanDerWaalsContact C-N 3.3Å; V851-D853 PolarHBondContact O-N 3Å
852	D	49.5	Very low	72.2	Confident	141 Å²	141	60.4 Å²	60.4	75%	0.754	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.7	12.1	-172.2	-47.5	-40.6	0	0	0	116.5	Q850	Q850-D852 PolarHBondContact O-N 2.8Å
853	D	56.4	Low	71.8	Confident	55 Å²	55	62 Å²	62	29%	0.294	33%	0.33	S	S	.	.			trans	-75.7	123.8	169.5	-165.9	27.8	0	0	0	111	Q850 V851 R855 F939	Q850-D853 HydrophobicContact CB-CB 4.37Å; Q850-D853 VanDerWaalsContact O-CB 3.26Å; Q850-D853 WeakPolarHBondContact O-CB 3.12Å; Q850-D853 PolarHBondContact O-N 2.87Å; V851-D853 VanDerWaalsContact C-N 3.3Å; V851-D853 PolarHBondContact O-N 3Å; D853-R855 IonicContact OD2-CZ 3.9Å; D853-R855 IonicContact OD2-NE 3.66Å; D853-R855 PolarHBondContact OD2-NE 3.3Å; D853-R855 VanDerWaalsContact OD2-NE 3.17Å; D853-R855 IonicContact OD2-NH2 3.88Å; D853-F939 PolarHBondContact O-N 2.86Å
854	H	65.1	Low	71.5	Confident	111 Å²	111	66 Å²	66	51%	0.514	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	110	-177.1	-77.3	-81.9	0	0	0	110.6	F939	H854-F939 AromaticContact CE1-CD1 3.94Å; H854-F939 AromaticContact CE1-CG 3.84Å; H854-F939 AromaticContact ND1-CD1 3.44Å; H854-F939 WeakPolarHBondContact ND1-CD1 3.24Å; H854-F939 AromaticContact ND1-CG 3.65Å
855	R	73.1	Confident	71	Confident	71 Å²	71	67 Å²	67	27%	0.268	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	115.3	173.6	-63	-46.4	-168.9	104.9	-1.2	110	G848 D853 F938 F939 N941	G848-R855 PolarHBondContact O-NH2 2.83Å; D853-R855 IonicContact OD2-CZ 3.9Å; D853-R855 IonicContact OD2-NE 3.66Å; D853-R855 PolarHBondContact OD2-NE 3.3Å; D853-R855 VanDerWaalsContact OD2-NE 3.17Å; D853-R855 IonicContact OD2-NH2 3.88Å; R855-F938 HydrophobicContact CB-CD2 3.94Å; R855-F938 HydrophobicContact CB-CE2 3.85Å; R855-F938 HydrophobicContact CG-CD2 3.69Å; R855-F938 HydrophobicContact CG-CE2 3.86Å; R855-F939 PolarHBondContact N-O 3.26Å; R855-N941 PolarHBondContact O-N 2.91Å
856	V	80.2	Confident	70.5	Confident	89 Å²	89	69.8 Å²	69.8	54%	0.539	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	125.4	-178.4	-176	0	0	0	0	109.3	N941 T943	V856-N941 WeakPolarHBondContact CA-O 3.44Å; V856-N941 HydrophobicContact CG2-CB 4.42Å; V856-T943 HydrophobicContact CG1-CG2 3.67Å
857	I	83.2	Confident	70.3	Confident	11 Å²	11	68.2 Å²	68.2	6%	0.056	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	147.4	-179.4	-68.5	-176.6	0	0	0	108.1	E861 T863 L865 L912 L940 N941 V942 T943	I857-E861 HydrophobicContact CG2-CB 3.9Å; I857-E861 HydrophobicContact CG2-CG 4.26Å; I857-T863 HydrophobicContact CD1-CG2 3.85Å; I857-L865 HydrophobicContact CD1-CD1 4.24Å; I857-L865 HydrophobicContact CD1-CD2 4.48Å; I857-L912 HydrophobicContact CD1-CD1 4.39Å; I857-L912 HydrophobicContact CD1-CD2 3.82Å; I857-L940 HydrophobicContact CB-CD1 4.21Å; I857-L940 HydrophobicContact CD1-CD1 3.81Å; I857-L940 HydrophobicContact CG1-CD1 4.12Å; I857-N941 PolarHBondContact N-O 3.04Å; I857-V942 CarbonylContact O-C 3.58Å; I857-V942 VanDerWaalsContact O-CA 3.31Å; I857-V942 WeakPolarHBondContact O-CA 3.44Å; I857-T943 PolarHBondContact O-N 2.85Å; I857-T943 PolarHBondContact O-OG1 2.9Å
858	R	82.8	Confident	70.5	Confident	128 Å²	128	68 Å²	68	48%	0.483	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	145.1	-177.8	-171.2	176.1	176.6	174.6	-0.8	112	G860 E861 T943	R858-G860 PolarHBondContact O-N 3.21Å; R858-E861 HydrophobicContact CB-CB 4.35Å; R858-E861 WeakPolarHBondContact CB-OE2 3.44Å; R858-E861 PolarHBondContact N-OE2 2.98Å; R858-E861 WeakPolarHBondContact O-CB 3.44Å; R858-E861 PolarHBondContact O-N 3.12Å; R858-T943 CarbonylContact C-O 3.47Å
859	E	85.1	Confident	71.7	Confident	55 Å²	55	69.2 Å²	69.2	26%	0.257	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	126.1	171.3	-175.2	159.4	-111.9	0	0	110.6	I915 R917 V942 T943 Y944	E859-I915 CarbonylContact C-O 3.58Å; E859-I915 WeakPolarHBondContact CA-O 3.18Å; E859-R917 WeakPolarHBondContact OE1-CB 3.43Å; E859-R917 WeakPolarHBondContact OE1-CG 2.92Å; E859-R917 IonicContact OE1-CZ 3.19Å; E859-R917 PolarHBondContact OE1-N 2.72Å; E859-R917 IonicContact OE1-NE 2.74Å; E859-R917 PolarHBondContact OE1-NE 3.39Å; E859-R917 IonicContact OE1-NH2 2.75Å; E859-R917 IonicContact OE2-CZ 2.69Å; E859-R917 IonicContact OE2-NE 3.97Å; E859-R917 PolarHBondContact OE2-NE 2.69Å; E859-R917 IonicContact OE2-NH2 3.66Å; E859-R917 PolarHBondContact OE2-NH2 3.09Å; E859-V942 HydrophobicContact CB-CG1 4.06Å; E859-T943 PolarHBondContact N-O 2.91Å; E859-Y944 VanDerWaalsContact OE2-CB 3.24Å; E859-Y944 WeakPolarHBondContact OE2-CB 3.12Å
860	G	81.4	Confident	73.1	Confident	52 Å²	52	70.8 Å²	70.8	54%	0.536	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.9	-9.2	-172.5	0	0	0	0	0	115.6	R858 I915	R858-G860 PolarHBondContact O-N 3.21Å; G860-I915 PolarHBondContact N-O 3.17Å
861	E	78.3	Confident	74.8	Confident	83 Å²	83	66.8 Å²	66.8	39%	0.388	36%	0.36	S	S	.	.			trans	-72.4	145.4	-178.1	-165.8	171.6	177.7	0	0	112.4	I857 R858 K914 I915	I857-E861 HydrophobicContact CG2-CB 3.9Å; I857-E861 HydrophobicContact CG2-CG 4.26Å; R858-E861 HydrophobicContact CB-CB 4.35Å; R858-E861 WeakPolarHBondContact CB-OE2 3.44Å; R858-E861 PolarHBondContact N-OE2 2.98Å; R858-E861 WeakPolarHBondContact O-CB 3.44Å; R858-E861 PolarHBondContact O-N 3.12Å; E861-K914 PolarHBondContact O-N 3.06Å; E861-I915 PolarHBondContact O-N 3.36Å
862	T	83.1	Confident	76.5	Confident	73 Å²	73	63.1 Å²	63.1	45%	0.448	34%	0.337	S	S	.	.			trans	-121.3	128.3	171.6	-76.5	0	0	0	0	108.4	L912 H913 K914	T862-L912 CarbonylContact C-O 3.38Å; T862-L912 WeakPolarHBondContact CA-O 3.44Å; T862-L912 WeakPolarHBondContact CG2-O 3.49Å; T862-H913 WeakPolarHBondContact CG2-ND1 3.29Å; T862-H913 WeakPolarHBondContact OG1-CA 3.39Å; T862-K914 PolarHBondContact OG1-N 2.98Å
863	T	80.2	Confident	78.2	Confident	44 Å²	44	58 Å²	58	27%	0.27	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	165	-176.2	-168.7	0	0	0	0	111.8	I857 L912	I857-T863 HydrophobicContact CD1-CG2 3.85Å; T863-L912 HydrophobicContact CG2-CB 4.2Å; T863-L912 HydrophobicContact CG2-CD1 4.2Å; T863-L912 PolarHBondContact N-O 2.93Å; T863-L912 WeakPolarHBondContact O-CA 3.1Å; T863-L912 WeakPolarHBondContact O-CB 3.23Å; T863-L912 PolarHBondContact O-N 3.37Å
864	H	82.2	Confident	79.6	Confident	101 Å²	101	60.2 Å²	60.2	47%	0.468	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	129.8	172	-49.5	-73.2	0	0	0	109.3	L910 S911	H864-L910 WeakPolarHBondContact CA-O 3.26Å; H864-S911 PolarHBondContact CE1-OG 3.22Å; H864-S911 VanDerWaalsContact CE1-OG 3.22Å; H864-S911 PolarHBondContact ND1-OG 3.2Å
865	L	77.6	Confident	80.5	Confident	23 Å²	23	56.5 Å²	56.5	12%	0.12	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	113.8	175.7	-61.6	175.5	0	0	0	110	I857 F867 L910 L912 F938	I857-L865 HydrophobicContact CD1-CD1 4.24Å; I857-L865 HydrophobicContact CD1-CD2 4.48Å; L865-F867 HydrophobicContact CB-CD2 4.48Å; L865-F867 HydrophobicContact CB-CE1 3.93Å; L865-F867 HydrophobicContact CB-CE2 3.57Å; L865-F867 HydrophobicContact CB-CZ 3.28Å; L865-F867 HydrophobicContact CD1-CE1 4.28Å; L865-F867 HydrophobicContact CD1-CZ 3.77Å; L865-F867 HydrophobicContact CG-CZ 4.16Å; L865-F867 WeakPolarHBondContact O-CD2 3.2Å; L865-F867 VanDerWaalsContact O-CE2 3.23Å; L865-F867 WeakPolarHBondContact O-CE2 3.33Å; L865-L910 HydrophobicContact CB-CB 4.42Å; L865-L910 PolarHBondContact N-O 2.82Å; L865-L910 PolarHBondContact O-N 2.98Å; L865-L910 VanDerWaalsContact O-N 3.16Å; L865-L912 HydrophobicContact CB-CD1 4.45Å; L865-L912 HydrophobicContact CD1-CD1 3.75Å; L865-L912 HydrophobicContact CG-CD1 3.69Å; L865-F938 HydrophobicContact CD1-CZ 4.22Å
866	D	73.5	Confident	80.9	Confident	114 Å²	114	57.6 Å²	57.6	61%	0.61	33%	0.329	S	S	*	.			trans	-88.9	137.1	162.7	178.2	9.6	0	0	0	109.2	G868 L909	D866-G868 PolarHBondContact OD1-N 2.84Å; D866-L909 HydrophobicContact CB-CD2 3.82Å
867	F	71	Confident	81.1	Confident	5 Å²	5	56 Å²	56	2%	0.022	32%	0.321	C	S	.	.			trans	-116.8	16.2	-176.9	-56.3	-77	0	0	0	113.4	L849 L865 L869 W880 L910 F938	L849-F867 HydrophobicContact CD1-CB 3.85Å; L849-F867 HydrophobicContact CD1-CD1 3.63Å; L849-F867 HydrophobicContact CD1-CE1 4.25Å; L849-F867 HydrophobicContact CD1-CG 3.74Å; L849-F867 HydrophobicContact CD2-CD1 3.55Å; L849-F867 HydrophobicContact CD2-CE1 3.59Å; L849-F867 HydrophobicContact CD2-CG 4.48Å; L849-F867 HydrophobicContact CG-CB 4.2Å; L849-F867 HydrophobicContact CG-CD1 3.44Å; L849-F867 VanDerWaalsContact CG-CD1 3.44Å; L849-F867 HydrophobicContact CG-CE1 4.04Å; L849-F867 HydrophobicContact CG-CG 4.04Å; L865-F867 HydrophobicContact CB-CD2 4.48Å; L865-F867 HydrophobicContact CB-CE1 3.93Å; L865-F867 HydrophobicContact CB-CE2 3.57Å; L865-F867 HydrophobicContact CB-CZ 3.28Å; L865-F867 HydrophobicContact CD1-CE1 4.28Å; L865-F867 HydrophobicContact CD1-CZ 3.77Å; L865-F867 HydrophobicContact CG-CZ 4.16Å; L865-F867 WeakPolarHBondContact O-CD2 3.2Å; L865-F867 VanDerWaalsContact O-CE2 3.23Å; L865-F867 WeakPolarHBondContact O-CE2 3.33Å; F867-L869 PolarHBondContact O-N 2.81Å; F867-W880 AromaticContact CD2-CH2 3.53Å; F867-W880 HydrophobicContact CD2-CH2 3.53Å; F867-W880 AromaticContact CD2-CZ2 3.67Å; F867-W880 HydrophobicContact CD2-CZ2 3.67Å; F867-W880 AromaticContact CE2-CH2 3.17Å; F867-W880 HydrophobicContact CE2-CH2 3.17Å; F867-W880 AromaticContact CE2-CZ2 3.52Å; F867-W880 HydrophobicContact CE2-CZ2 3.52Å; F867-W880 HydrophobicContact CE2-CZ3 4.22Å; F867-W880 HydrophobicContact CG-CH2 4.42Å; F867-W880 AromaticContact CZ-CH2 3.81Å; F867-W880 HydrophobicContact CZ-CH2 3.81Å; F867-L910 HydrophobicContact CE2-CB 3.74Å; F867-L910 HydrophobicContact CZ-CB 4.25Å; F867-L910 HydrophobicContact CZ-CD2 4.46Å; F867-F938 HydrophobicContact CE1-CE1 4.03Å; F867-F938 HydrophobicContact CE1-CZ 4.34Å; F867-F938 AromaticContact CZ-CE1 3.76Å; F867-F938 HydrophobicContact CZ-CE1 3.76Å; F867-F938 AromaticContact CZ-CZ 3.97Å; F867-F938 HydrophobicContact CZ-CZ 3.97Å
868	G	66.2	Low	81.4	Confident	30 Å²	30	56 Å²	56	31%	0.309	32%	0.322	S	S	.	.			trans	61.4	40.4	161.1	0	0	0	0	0	114.3	F754 D866 Y870	F754-G868 WeakPolarHBondContact CE2-O 3.45Å; D866-G868 PolarHBondContact OD1-N 2.84Å; G868-Y870 PolarHBondContact O-N 3.47Å
869	L	77.4	Confident	81.6	Confident	49 Å²	49	51.4 Å²	51.4	26%	0.257	31%	0.31	S	S	.	.			trans	-61.2	129.9	-175.8	-61.6	173.3	0	0	0	111.5	F846 F867 V875 V927	F846-L869 HydrophobicContact CD1-CD2 3.44Å; F846-L869 VanDerWaalsContact CD1-CD2 3.44Å; F846-L869 HydrophobicContact CE1-CD2 3.58Å; F846-L869 HydrophobicContact CG-CD2 4.36Å; F867-L869 PolarHBondContact O-N 2.81Å; L869-V875 HydrophobicContact CD1-CG2 4.44Å; L869-V927 HydrophobicContact CD1-CG1 4.03Å; L869-V927 HydrophobicContact CD1-CG2 4.03Å; L869-V927 HydrophobicContact CD2-CG2 4.05Å
870	Y	84.6	Confident	81.7	Confident	42 Å²	42	49 Å²	49	17%	0.165	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	118.8	173.8	-170.6	-114.7	0	0	0	110.3	A751 F754 W811 H814 F842 Q845 G868	A751-Y870 HydrophobicContact CB-CE1 3.6Å; A751-Y870 PolarHBondContact N-OH 2.89Å; F754-Y870 HydrophobicContact CD1-CD1 4.14Å; F754-Y870 HydrophobicContact CD1-CG 4.35Å; F754-Y870 HydrophobicContact CD2-CG 4.42Å; F754-Y870 HydrophobicContact CE1-CD1 4.29Å; F754-Y870 HydrophobicContact CE1-CG 4.29Å; F754-Y870 HydrophobicContact CE2-CG 4.37Å; F754-Y870 HydrophobicContact CG-CD1 4.45Å; F754-Y870 HydrophobicContact CG-CG 4.39Å; F754-Y870 HydrophobicContact CZ-CG 4.28Å; W811-Y870 HydrophobicContact CZ3-CD1 4.42Å; H814-Y870 PolarHBondContact CD2-OH 2.04Å; H814-Y870 VanDerWaalsContact CD2-OH 3.3Å; F842-Y870 HydrophobicContact CE1-CE1 4.46Å; F842-Y870 AromaticContact CE2-CD1 3.75Å; F842-Y870 HydrophobicContact CE2-CD1 3.75Å; F842-Y870 AromaticContact CE2-CE1 3.99Å; F842-Y870 HydrophobicContact CE2-CE1 3.99Å; F842-Y870 AromaticContact CZ-CD1 3.72Å; F842-Y870 HydrophobicContact CZ-CD1 3.72Å; F842-Y870 AromaticContact CZ-CE1 3.47Å; F842-Y870 HydrophobicContact CZ-CE1 3.47Å; F842-Y870 VanDerWaalsContact CZ-CE1 3.47Å; Q845-Y870 PolarHBondContact N-O 3.04Å; Q845-Y870 PolarHBondContact O-N 2.95Å; G868-Y870 PolarHBondContact O-N 3.47Å
871	A	87.5	Confident	82.1	Confident	21 Å²	21	48.6 Å²	48.6	17%	0.174	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	149.2	-172.7	0	0	0	0	0	111	P844 P873 V875	P844-A871 HydrophobicContact CB-CB 4.04Å; P844-A871 HydrophobicContact CG-CB 4.09Å; A871-P873 CarbonylContact C-O 3.32Å; A871-V875 HydrophobicContact CB-CG2 4.14Å
872	N	87.6	Confident	82.5	Confident	27 Å²	27	47.7 Å²	47.7	14%	0.144	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	119.2	166.9	-174.2	27.6	0	0	0	110	H814 N839 I840 T841 F842	H814-N872 PolarHBondContact CE1-ND2 2.84Å; H814-N872 PolarHBondContact NE2-ND2 2.87Å; N839-N872 PolarHBondContact OD1-ND2 3.33Å; I840-N872 PolarHBondContact O-ND2 3.2Å; T841-N872 CarbonylContact C-O 3.34Å; T841-N872 WeakPolarHBondContact CA-O 3.39Å; T841-N872 VanDerWaalsContact CB-O 3.31Å; T841-N872 WeakPolarHBondContact CB-O 3.07Å; F842-N872 HydrophobicContact CD1-CB 4.09Å; F842-N872 HydrophobicContact CE1-CB 3.53Å; F842-N872 HydrophobicContact CZ-CB 3.85Å; F842-N872 PolarHBondContact N-O 2.99Å
873	P	86.3	Confident	82.2	Confident	35 Å²	35	49.6 Å²	49.6	23%	0.227	28%	0.282	C	S	.	.	S	Bend	cis	-64.9	172.2	-3.4	29.8	-34.5	0	0	0	112.4	A871 N929 S930	A871-P873 CarbonylContact C-O 3.32Å; P873-N929 PolarHBondContact O-ND2 2.78Å; P873-S930 WeakPolarHBondContact CG-OG 3.17Å
874	P	84.5	Confident	82	Confident	100 Å²	100	53.9 Å²	53.9	65%	0.649	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-52	158.6	176	-28.5	36.6	0	0	0	114	T876 N929	P874-T876 PolarHBondContact O-N 2.86Å; P874-N929 WeakPolarHBondContact O-CB 3.34Å
875	V	84	Confident	82.1	Confident	34 Å²	34	56.4 Å²	56.4	21%	0.206	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-60.1	132.4	178.1	172.8	0	0	0	0	110.6	P844 L869 A871 S877 V878 V906 V927 S928	P844-V875 HydrophobicContact CB-CG2 4.43Å; P844-V875 HydrophobicContact CG-CG2 4.32Å; L869-V875 HydrophobicContact CD1-CG2 4.44Å; A871-V875 HydrophobicContact CB-CG2 4.14Å; V875-S877 WeakPolarHBondContact CG1-O 3.24Å; V875-V878 HydrophobicContact CG1-CG2 3.61Å; V875-V906 HydrophobicContact CG1-CG2 4.44Å; V875-V927 HydrophobicContact CB-CG1 4.22Å; V875-V927 HydrophobicContact CG1-CG1 3.56Å; V875-V927 HydrophobicContact CG2-CG1 3.55Å; V875-S928 WeakPolarHBondContact CA-O 3.18Å
876	T	83.2	Confident	82.5	Confident	93 Å²	93	60.2 Å²	60.2	57%	0.571	34%	0.335	S	S	*	.			trans	-104	-21.2	179.3	51.8	0	0	0	0	113.5	P874 S928 N929	P874-T876 PolarHBondContact O-N 2.86Å; T876-S928 PolarHBondContact N-O 2.9Å; T876-S928 PolarHBondContact OG1-O 2.84Å; T876-S928 PolarHBondContact OG1-OG 3.4Å; T876-N929 WeakPolarHBondContact OG1-CA 3.49Å
877	S	84.4	Confident	83.1	Confident	55 Å²	55	55.9 Å²	55.9	39%	0.385	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	149.7	168.4	66.4	0	0	0	0	112.1	V875 V927 S928	V875-S877 WeakPolarHBondContact CG1-O 3.24Å; S877-V927 WeakPolarHBondContact O-CA 3.17Å; S877-S928 PolarHBondContact N-O 3.46Å; S877-S928 PolarHBondContact O-N 3.01Å; S877-S928 PolarHBondContact OG-OG 3.45Å
878	V	88	Confident	83.7	Confident	11 Å²	11	59.2 Å²	59.2	7%	0.067	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	141.6	167.5	-172.6	0	0	0	0	108.6	V875 V906 G907 E908 V925 I926 V927	V875-V878 HydrophobicContact CG1-CG2 3.61Å; V878-V906 HydrophobicContact CG2-CG2 4.1Å; V878-V906 PolarHBondContact N-O 3.27Å; V878-G907 WeakPolarHBondContact CG1-O 3.02Å; V878-E908 HydrophobicContact CG2-CB 4.36Å; V878-V925 HydrophobicContact CG1-CG2 3.79Å; V878-I926 CarbonylContact C-O 3.5Å; V878-I926 WeakPolarHBondContact CA-O 3.42Å; V878-V927 HydrophobicContact CG1-CG2 4.24Å; V878-V927 HydrophobicContact CG2-CG1 4.34Å; V878-V927 HydrophobicContact CG2-CG2 4.45Å
879	S	86.9	Confident	84.6	Confident	33 Å²	33	63.4 Å²	63.4	23%	0.231	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	138	171.8	49.7	0	0	0	0	111	F881 I926	S879-F881 WeakPolarHBondContact OG-CE2 3.28Å; S879-I926 PolarHBondContact N-O 2.95Å; S879-I926 PolarHBondContact O-N 2.9Å
880	W	88.8	Confident	84.6	Confident	4 Å²	4	64.3 Å²	64.3	2%	0.015	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	133.5	-174.3	-76.8	100.2	0	0	0	110.7	F867 L886 L887 A902 G907 L910 V925 F938	F867-W880 AromaticContact CD2-CH2 3.53Å; F867-W880 HydrophobicContact CD2-CH2 3.53Å; F867-W880 AromaticContact CD2-CZ2 3.67Å; F867-W880 HydrophobicContact CD2-CZ2 3.67Å; F867-W880 AromaticContact CE2-CH2 3.17Å; F867-W880 HydrophobicContact CE2-CH2 3.17Å; F867-W880 AromaticContact CE2-CZ2 3.52Å; F867-W880 HydrophobicContact CE2-CZ2 3.52Å; F867-W880 HydrophobicContact CE2-CZ3 4.22Å; F867-W880 HydrophobicContact CG-CH2 4.42Å; F867-W880 AromaticContact CZ-CH2 3.81Å; F867-W880 HydrophobicContact CZ-CH2 3.81Å; W880-L886 CarbonylContact O-C 3.6Å; W880-L886 WeakPolarHBondContact O-CA 3.3Å; W880-L887 HydrophobicContact CB-CB 4.15Å; W880-L887 HydrophobicContact CB-CD1 3.98Å; W880-L887 HydrophobicContact CB-CG 4.27Å; W880-L887 PolarHBondContact O-N 3.44Å; W880-A902 HydrophobicContact CG-CB 4.46Å; W880-G907 VanDerWaalsContact CD1-O 3.31Å; W880-G907 PolarHBondContact NE1-O 2.98Å; W880-L910 HydrophobicContact CB-CD1 4.47Å; W880-L910 HydrophobicContact CD2-CB 4.45Å; W880-L910 HydrophobicContact CD2-CD1 3.73Å; W880-L910 HydrophobicContact CE3-CD1 3.82Å; W880-L910 HydrophobicContact CE3-CD2 4.25Å; W880-L910 HydrophobicContact CE3-CG 4.46Å; W880-L910 HydrophobicContact CG-CD1 4.02Å; W880-L910 HydrophobicContact CH2-CB 4.11Å; W880-L910 HydrophobicContact CH2-CD2 4.44Å; W880-L910 HydrophobicContact CZ2-CB 3.94Å; W880-L910 HydrophobicContact CZ3-CB 4.4Å; W880-L910 HydrophobicContact CZ3-CD1 4.35Å; W880-L910 HydrophobicContact CZ3-CD2 4.03Å; W880-V925 HydrophobicContact CD2-CB 4.14Å; W880-V925 HydrophobicContact CD2-CG2 3.97Å; W880-V925 HydrophobicContact CE3-CB 3.8Å; W880-V925 HydrophobicContact CE3-CG2 4.16Å; W880-V925 HydrophobicContact CH2-CB 3.61Å; W880-V925 HydrophobicContact CH2-CG1 4.18Å; W880-V925 HydrophobicContact CH2-CG2 3.8Å; W880-V925 HydrophobicContact CZ2-CB 3.98Å; W880-V925 HydrophobicContact CZ2-CG2 3.62Å; W880-V925 HydrophobicContact CZ3-CB 3.53Å; W880-V925 HydrophobicContact CZ3-CG1 4.33Å; W880-V925 HydrophobicContact CZ3-CG2 4.09Å; W880-F938 HydrophobicContact CH2-CE1 4.42Å; W880-F938 AromaticContact CZ3-CE1 3.95Å; W880-F938 HydrophobicContact CZ3-CE1 3.95Å
881	F	88.8	Confident	84	Confident	44 Å²	44	64.4 Å²	64.4	19%	0.193	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	139.3	-178.2	-58.7	-98.7	0	0	0	110.3	S879 Q885 L886 Y923 T924 I926	S879-F881 WeakPolarHBondContact OG-CE2 3.28Å; F881-Q885 CarbonylContact C-O 3.55Å; F881-Q885 VanDerWaalsContact CA-O 3.27Å; F881-Q885 WeakPolarHBondContact CA-O 3.05Å; F881-L886 HydrophobicContact CD1-CB 4.28Å; F881-L886 HydrophobicContact CD1-CD1 4.31Å; F881-L886 HydrophobicContact CE1-CB 4.13Å; F881-L886 HydrophobicContact CE1-CD1 3.81Å; F881-L886 HydrophobicContact CE2-CD1 4.15Å; F881-L886 HydrophobicContact CZ-CD1 3.72Å; F881-Y923 CarbonylContact O-C 3.41Å; F881-Y923 WeakPolarHBondContact O-CA 3.34Å; F881-T924 PolarHBondContact N-O 2.85Å; F881-T924 PolarHBondContact O-N 3.16Å; F881-I926 HydrophobicContact CD2-CD1 4.09Å; F881-I926 HydrophobicContact CD2-CG1 4.24Å; F881-I926 HydrophobicContact CE2-CB 4.31Å; F881-I926 HydrophobicContact CE2-CD1 3.5Å; F881-I926 VanDerWaalsContact CE2-CD1 3.5Å; F881-I926 HydrophobicContact CE2-CG1 3.9Å; F881-I926 HydrophobicContact CZ-CD1 4.09Å
882	R	86.6	Confident	83.1	Confident	64 Å²	64	73.4 Å²	73.4	24%	0.242	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	117.9	169.7	-175	-170.7	-173.6	-137.2	-14.4	107.6	D884 Q885 L887 E918 N919 M920 Y923	R882-D884 VanDerWaalsContact C-N 3.27Å; R882-D884 PolarHBondContact O-N 2.77Å; R882-Q885 PolarHBondContact N-O 2.84Å; R882-Q885 PolarHBondContact O-N 3.45Å; R882-L887 HydrophobicContact CB-CD2 3.81Å; R882-L887 HydrophobicContact CB-CG 4.4Å; R882-E918 PolarHBondContact NH1-O 3.06Å; R882-E918 PolarHBondContact NH2-O 2.71Å; R882-N919 PolarHBondContact NE-O 2.88Å; R882-N919 PolarHBondContact NH2-O 2.88Å; R882-N919 VanDerWaalsContact NH2-O 3.12Å; R882-M920 PolarHBondContact NH2-O 2.95Å; R882-Y923 HydrophobicContact CB-CD1 4.25Å; R882-Y923 HydrophobicContact CB-CE1 4.02Å; R882-Y923 VanDerWaalsContact CD-OH 3.32Å; R882-Y923 WeakPolarHBondContact CD-OH 3.35Å; R882-Y923 HydrophobicContact CG-CD1 4.43Å; R882-Y923 HydrophobicContact CG-CE1 4Å; R882-Y923 HydrophobicContact CG-CE2 4.11Å; R882-Y923 PolarHBondContact NE-OH 3.37Å
883	N	76.8	Confident	81.9	Confident	113 Å²	113	79.8 Å²	79.8	60%	0.604	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.4	50.8	-172.9	-54.7	-20.1	0	0	0	112.1	Q885 N922	N883-Q885 PolarHBondContact O-N 2.77Å; N883-N922 PolarHBondContact N-O 3.36Å
884	D	76.8	Confident	80.4	Confident	134 Å²	134	83.3 Å²	83.3	72%	0.717	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	61	0.5	-176.5	-56.8	-49.3	0	0	0	117.1	R882	R882-D884 VanDerWaalsContact C-N 3.27Å; R882-D884 PolarHBondContact O-N 2.77Å
885	Q	83	Confident	78.8	Confident	153 Å²	153	85 Å²	85	72%	0.715	44%	0.442	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.7	127.8	170.7	-172.1	173.5	-1	0	0	111.2	F881 R882 N883	F881-Q885 CarbonylContact C-O 3.55Å; F881-Q885 VanDerWaalsContact CA-O 3.27Å; F881-Q885 WeakPolarHBondContact CA-O 3.05Å; R882-Q885 PolarHBondContact N-O 2.84Å; R882-Q885 PolarHBondContact O-N 3.45Å; N883-Q885 PolarHBondContact O-N 2.77Å
886	L	87.4	Confident	77.5	Confident	103 Å²	103	88.9 Å²	88.9	54%	0.539	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	132.7	177.5	-173.4	76.2	0	0	0	111.3	W880 F881	W880-L886 CarbonylContact O-C 3.6Å; W880-L886 WeakPolarHBondContact O-CA 3.3Å; F881-L886 HydrophobicContact CD1-CB 4.28Å; F881-L886 HydrophobicContact CD1-CD1 4.31Å; F881-L886 HydrophobicContact CE1-CB 4.13Å; F881-L886 HydrophobicContact CE1-CD1 3.81Å; F881-L886 HydrophobicContact CE2-CD1 4.15Å; F881-L886 HydrophobicContact CZ-CD1 3.72Å
887	L	86.4	Confident	76.6	Confident	24 Å²	24	87.9 Å²	87.9	13%	0.126	45%	0.451	C	S	.	.	P	Polyproline II helix	trans	-80.6	144.5	175.4	-64.2	-175.9	0	0	0	112	W880 R882 V900 L910 Y923	W880-L887 HydrophobicContact CB-CB 4.15Å; W880-L887 HydrophobicContact CB-CD1 3.98Å; W880-L887 HydrophobicContact CB-CG 4.27Å; W880-L887 PolarHBondContact O-N 3.44Å; R882-L887 HydrophobicContact CB-CD2 3.81Å; R882-L887 HydrophobicContact CB-CG 4.4Å; L887-V900 HydrophobicContact CD1-CG1 4.02Å; L887-L910 HydrophobicContact CD1-CD1 3.82Å; L887-Y923 HydrophobicContact CD1-CD1 3.98Å; L887-Y923 HydrophobicContact CD1-CE1 3.79Å
888	P	83.8	Confident	75.9	Confident	75 Å²	75	90.7 Å²	90.7	49%	0.487	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-70.9	153.9	173	30.6	-34.5	0	0	0	112	F901 A902	P888-F901 HydrophobicContact CG-CD1 3.91Å; P888-F901 HydrophobicContact CG-CE1 4.18Å; P888-F901 WeakPolarHBondContact O-CA 3.32Å; P888-A902 PolarHBondContact O-N 2.75Å
889	F	83.8	Confident	75.7	Confident	118 Å²	118	90.5 Å²	90.5	52%	0.518	46%	0.459	S	S	.	.	B	Isolated β-bridge	trans	-70.2	154.2	166.6	-90.6	-95.5	0	0	0	111.7	P891 A902	F889-P891 WeakPolarHBondContact O-CD 3.38Å; F889-A902 CarbonylContact C-O 3.53Å; F889-A902 VanDerWaalsContact CA-O 3.3Å; F889-A902 WeakPolarHBondContact CA-O 3.27Å; F889-A902 HydrophobicContact CD1-CB 4.33Å; F889-A902 HydrophobicContact CD2-CB 4.38Å; F889-A902 HydrophobicContact CE1-CB 4.43Å; F889-A902 HydrophobicContact CE2-CB 4.47Å; F889-A902 HydrophobicContact CG-CB 4.32Å; F889-A902 HydrophobicContact CZ-CB 4.5Å
890	E	78.1	Confident	75.7	Confident	68 Å²	68	89.5 Å²	89.5	32%	0.318	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-63.3	119.3	-177.8	-169.4	163.7	170.4	0	0	112.3	F901 A902 A903 S911 H913	E890-F901 HydrophobicContact CB-CB 4.18Å; E890-A902 PolarHBondContact N-O 2.73Å; E890-A903 HydrophobicContact CB-CB 4.29Å; E890-A903 WeakPolarHBondContact OE2-CB 3.36Å; E890-S911 WeakPolarHBondContact OE2-CB 3.41Å; E890-S911 PolarHBondContact OE2-OG 2.97Å; E890-H913 IonicContact OE1-CD2 3.25Å; E890-H913 IonicContact OE1-CE1 3.38Å; E890-H913 IonicContact OE1-NE2 2.72Å; E890-H913 PolarHBondContact OE1-NE2 2.7Å; E890-H913 IonicContact OE2-NE2 3.61Å
891	P	72.3	Confident	75.7	Confident	43 Å²	43	90.3 Å²	90.3	28%	0.279	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-79.6	160.3	-177.9	31.9	-36.7	0	0	0	113.5	F889 W897 F901	F889-P891 WeakPolarHBondContact O-CD 3.38Å; P891-W897 HydrophobicContact CB-CH2 3.86Å; P891-W897 HydrophobicContact CB-CZ2 3.68Å; P891-W897 HydrophobicContact CB-CZ3 4.43Å; P891-W897 HydrophobicContact CG-CD2 3.54Å; P891-W897 HydrophobicContact CG-CE3 3.65Å; P891-W897 HydrophobicContact CG-CG 4.4Å; P891-W897 HydrophobicContact CG-CH2 3.46Å; P891-W897 VanDerWaalsContact CG-CH2 3.46Å; P891-W897 HydrophobicContact CG-CZ2 3.33Å; P891-W897 HydrophobicContact CG-CZ3 3.6Å; P891-F901 HydrophobicContact CG-CE1 4.37Å
892	K	66.9	Low	75.6	Confident	210 Å²	210	88.3 Å²	88.3	91%	0.913	45%	0.447	S	S	*	.	S	Bend	trans	-88.5	-9.1	-161.2	-63.9	-173.8	177.7	-177.4	0	117.6
893	E	64.1	Low	75.4	Confident	162 Å²	162	85.7 Å²	85.7	76%	0.757	44%	0.439	S	S	*	.			trans	-112.3	98.4	-173	-65.5	-174.7	148.7	0	0	110.8	D895 W897	E893-D895 PolarHBondContact O-N 2.7Å; E893-W897 VanDerWaalsContact O-CE2 3.29Å; E893-W897 WeakPolarHBondContact O-CZ2 3.43Å; E893-W897 PolarHBondContact O-NE1 3.38Å
894	T	54.9	Low	75.4	Confident	108 Å²	108	82.5 Å²	82.5	66%	0.663	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-65.4	-25.4	-151.9	44.1	0	0	0	0	118.9	T896 W897	T894-T896 PolarHBondContact O-N 3.32Å; T894-W897 VanDerWaalsContact O-CD1 3.3Å
895	D	50.5	Low	75.3	Confident	137 Å²	137	81.2 Å²	81.2	73%	0.733	43%	0.434	S	S	*	.	G	3₁₀ helix	trans	-78.6	-15.7	-150	-71.4	6	0	0	0	115.8	E893	E893-D895 PolarHBondContact O-N 2.7Å
896	T	55.9	Low	75.1	Confident	114 Å²	114	76.5 Å²	76.5	70%	0.699	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-115.5	-1	-169.7	53	0	0	0	0	115.9	T894	T894-T896 PolarHBondContact O-N 3.32Å
897	W	63.5	Low	74.5	Confident	73 Å²	73	71.6 Å²	71.6	28%	0.277	39%	0.39	S	S	.	.			trans	-70.1	137.6	-171.2	-53.9	110.6	0	0	0	114.4	P891 E893 T894 F901 H913 K914	P891-W897 HydrophobicContact CB-CH2 3.86Å; P891-W897 HydrophobicContact CB-CZ2 3.68Å; P891-W897 HydrophobicContact CB-CZ3 4.43Å; P891-W897 HydrophobicContact CG-CD2 3.54Å; P891-W897 HydrophobicContact CG-CE3 3.65Å; P891-W897 HydrophobicContact CG-CG 4.4Å; P891-W897 HydrophobicContact CG-CH2 3.46Å; P891-W897 VanDerWaalsContact CG-CH2 3.46Å; P891-W897 HydrophobicContact CG-CZ2 3.33Å; P891-W897 HydrophobicContact CG-CZ3 3.6Å; E893-W897 VanDerWaalsContact O-CE2 3.29Å; E893-W897 WeakPolarHBondContact O-CZ2 3.43Å; E893-W897 PolarHBondContact O-NE1 3.38Å; T894-W897 VanDerWaalsContact O-CD1 3.3Å; W897-F901 HydrophobicContact CB-CE2 4.39Å; W897-F901 HydrophobicContact CE3-CE1 4.35Å; W897-F901 HydrophobicContact CE3-CZ 4.01Å; W897-H913 HydrophobicContact CB-CB 4.31Å; W897-K914 WeakPolarHBondContact O-CD 3.19Å
898	Q	71.4	Confident	74.2	Confident	113 Å²	113	73 Å²	73	53%	0.528	40%	0.396	S	S	.	.			trans	-144.5	133.4	168.3	178.7	163.9	41.5	0	0	108.2	H913 K914	Q898-H913 CarbonylContact C-O 3.54Å; Q898-H913 WeakPolarHBondContact CA-O 3.5Å; Q898-K914 HydrophobicContact CB-CB 4.45Å; Q898-K914 HydrophobicContact CG-CB 4.31Å; Q898-K914 WeakPolarHBondContact CG-O 3.5Å; Q898-K914 PolarHBondContact NE2-O 3.25Å
899	G	83.9	Confident	74.1	Confident	8 Å²	8	71.9 Å²	71.9	8%	0.082	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	124	-159.9	-178.7	0	0	0	0	0	113.8	H913 I915	G899-H913 PolarHBondContact N-O 3.33Å; G899-H913 PolarHBondContact O-N 3.05Å; G899-I915 VanDerWaalsContact O-CD1 3.29Å; G899-I915 WeakPolarHBondContact O-CD1 3.49Å
900	V	86.7	Confident	74.2	Confident	12 Å²	12	66.2 Å²	66.2	7%	0.073	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	131.4	-173.6	-175.3	0	0	0	0	110.9	L887 L910 S911 L912 I915 N919 Y923 L940	L887-V900 HydrophobicContact CD1-CG1 4.02Å; V900-L910 HydrophobicContact CG1-CD1 3.42Å; V900-L910 VanDerWaalsContact CG1-CD1 3.42Å; V900-L910 HydrophobicContact CG1-CD2 3.97Å; V900-L910 HydrophobicContact CG1-CG 3.59Å; V900-S911 CarbonylContact C-O 3.52Å; V900-S911 WeakPolarHBondContact CA-O 3.35Å; V900-L912 HydrophobicContact CG1-CG 4.22Å; V900-L912 HydrophobicContact CG2-CD2 3.9Å; V900-L912 HydrophobicContact CG2-CG 4.08Å; V900-I915 HydrophobicContact CG2-CD1 3.53Å; V900-N919 HydrophobicContact CG2-CB 4.45Å; V900-Y923 HydrophobicContact CB-CE1 3.97Å; V900-Y923 HydrophobicContact CG1-CD1 4.4Å; V900-Y923 HydrophobicContact CG1-CE1 3.64Å; V900-Y923 HydrophobicContact CG2-CE1 4.25Å; V900-Y923 WeakPolarHBondContact CG2-OH 3.49Å; V900-L940 HydrophobicContact CG2-CD2 4.4Å
901	F	88.5	Confident	74.6	Confident	20 Å²	20	63 Å²	63	9%	0.088	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	154.1	-170.3	-56.6	-94.4	0	0	0	111.3	P888 E890 P891 W897 S911	P888-F901 HydrophobicContact CG-CD1 3.91Å; P888-F901 HydrophobicContact CG-CE1 4.18Å; P888-F901 WeakPolarHBondContact O-CA 3.32Å; E890-F901 HydrophobicContact CB-CB 4.18Å; P891-F901 HydrophobicContact CG-CE1 4.37Å; W897-F901 HydrophobicContact CB-CE2 4.39Å; W897-F901 HydrophobicContact CE3-CE1 4.35Å; W897-F901 HydrophobicContact CE3-CZ 4.01Å; F901-S911 PolarHBondContact N-O 3.3Å; F901-S911 PolarHBondContact O-N 2.67Å
902	A	87.1	Confident	75.4	Confident	3 Å²	3	61 Å²	61	3%	0.025	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	134.9	167.7	0	0	0	0	0	110.3	W880 P888 F889 E890	W880-A902 HydrophobicContact CG-CB 4.46Å; P888-A902 PolarHBondContact O-N 2.75Å; F889-A902 CarbonylContact C-O 3.53Å; F889-A902 VanDerWaalsContact CA-O 3.3Å; F889-A902 WeakPolarHBondContact CA-O 3.27Å; F889-A902 HydrophobicContact CD1-CB 4.33Å; F889-A902 HydrophobicContact CD2-CB 4.38Å; F889-A902 HydrophobicContact CE1-CB 4.43Å; F889-A902 HydrophobicContact CE2-CB 4.47Å; F889-A902 HydrophobicContact CG-CB 4.32Å; F889-A902 HydrophobicContact CZ-CB 4.5Å; E890-A902 PolarHBondContact N-O 2.73Å
903	A	82.5	Confident	76.2	Confident	9 Å²	9	52.4 Å²	52.4	7%	0.074	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	170.8	-176.9	0	0	0	0	0	112.6	E890 G907 E908 L909	E890-A903 HydrophobicContact CB-CB 4.29Å; E890-A903 WeakPolarHBondContact OE2-CB 3.36Å; A903-G907 CarbonylContact O-C 3.43Å; A903-G907 VanDerWaalsContact O-CA 3.27Å; A903-G907 WeakPolarHBondContact O-CA 3.49Å; A903-E908 PolarHBondContact O-N 2.9Å; A903-E908 VanDerWaalsContact O-N 3.16Å; A903-L909 HydrophobicContact CB-CB 4.28Å; A903-L909 PolarHBondContact N-O 3.1Å; A903-L909 PolarHBondContact O-N 2.87Å
904	G	76.9	Confident	77.1	Confident	46 Å²	46	49.3 Å²	49.3	47%	0.474	28%	0.279	S	S	.	.	S	Bend	trans	94.4	-172.1	-171.1	0	0	0	0	0	113	E908	G904-E908 VanDerWaalsContact C-OE2 3.27Å; G904-E908 WeakPolarHBondContact CA-OE2 3.2Å
905	S	74.5	Confident	78.5	Confident	106 Å²	106	44.2 Å²	44.2	74%	0.741	25%	0.248	S	C	*	.	S	Bend	trans	-75.8	-28.3	-174.2	61.5	0	0	0	0	114.4	E908	S905-E908 VanDerWaalsContact N-CD 3.25Å; S905-E908 PolarHBondContact N-OE1 3Å; S905-E908 PolarHBondContact N-OE2 3.03Å; S905-E908 PolarHBondContact OG-OE1 2.84Å
906	V	77	Confident	80.3	Confident	54 Å²	54	39 Å²	39	33%	0.327	22%	0.22	S	C	.	.	S	Bend	trans	-131.1	3.4	-179.9	-63.2	0	0	0	0	113.1	V875 V878 E908	V875-V906 HydrophobicContact CG1-CG2 4.44Å; V878-V906 HydrophobicContact CG2-CG2 4.1Å; V878-V906 PolarHBondContact N-O 3.27Å; V906-E908 HydrophobicContact CG2-CB 4.12Å; V906-E908 VanDerWaalsContact CG2-OE2 3.31Å; V906-E908 WeakPolarHBondContact CG2-OE2 3.38Å; V906-E908 PolarHBondContact N-OE2 3.39Å
907	G	75.2	Confident	81.8	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.201	C	C	.	.	S	Bend	trans	96	16.7	-176.8	0	0	0	0	0	114	V878 W880 A903 L909	V878-G907 WeakPolarHBondContact CG1-O 3.02Å; W880-G907 VanDerWaalsContact CD1-O 3.31Å; W880-G907 PolarHBondContact NE1-O 2.98Å; A903-G907 CarbonylContact O-C 3.43Å; A903-G907 VanDerWaalsContact O-CA 3.27Å; A903-G907 WeakPolarHBondContact O-CA 3.49Å; G907-L909 VanDerWaalsContact C-N 3.29Å; G907-L909 PolarHBondContact O-N 2.89Å
908	E	79.8	Confident	82.8	Confident	54 Å²	54	40.7 Å²	40.7	25%	0.252	22%	0.22	S	C	.	.			trans	-66.4	-19.8	-173	66.6	-83.2	-153	0	0	115.4	V878 A903 G904 S905 V906	V878-E908 HydrophobicContact CG2-CB 4.36Å; A903-E908 PolarHBondContact O-N 2.9Å; A903-E908 VanDerWaalsContact O-N 3.16Å; G904-E908 VanDerWaalsContact C-OE2 3.27Å; G904-E908 WeakPolarHBondContact CA-OE2 3.2Å; S905-E908 VanDerWaalsContact N-CD 3.25Å; S905-E908 PolarHBondContact N-OE1 3Å; S905-E908 PolarHBondContact N-OE2 3.03Å; S905-E908 PolarHBondContact OG-OE1 2.84Å; V906-E908 HydrophobicContact CG2-CB 4.12Å; V906-E908 VanDerWaalsContact CG2-OE2 3.31Å; V906-E908 WeakPolarHBondContact CG2-OE2 3.38Å; V906-E908 PolarHBondContact N-OE2 3.39Å
909	L	82.6	Confident	83.6	Confident	51 Å²	51	36.1 Å²	36.1	27%	0.267	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	144.9	176.5	-58.6	179.1	0	0	0	111.1	D866 A903 G907	D866-L909 HydrophobicContact CB-CD2 3.82Å; A903-L909 HydrophobicContact CB-CB 4.28Å; A903-L909 PolarHBondContact N-O 3.1Å; A903-L909 PolarHBondContact O-N 2.87Å; G907-L909 VanDerWaalsContact C-N 3.29Å; G907-L909 PolarHBondContact O-N 2.89Å
910	L	86.4	Confident	83.7	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	116.9	164.4	-168.8	67.9	0	0	0	108.8	H864 L865 F867 W880 L887 V900 L912 Y923 F938	H864-L910 WeakPolarHBondContact CA-O 3.26Å; L865-L910 HydrophobicContact CB-CB 4.42Å; L865-L910 PolarHBondContact N-O 2.82Å; L865-L910 PolarHBondContact O-N 2.98Å; L865-L910 VanDerWaalsContact O-N 3.16Å; F867-L910 HydrophobicContact CE2-CB 3.74Å; F867-L910 HydrophobicContact CZ-CB 4.25Å; F867-L910 HydrophobicContact CZ-CD2 4.46Å; W880-L910 HydrophobicContact CB-CD1 4.47Å; W880-L910 HydrophobicContact CD2-CB 4.45Å; W880-L910 HydrophobicContact CD2-CD1 3.73Å; W880-L910 HydrophobicContact CE3-CD1 3.82Å; W880-L910 HydrophobicContact CE3-CD2 4.25Å; W880-L910 HydrophobicContact CE3-CG 4.46Å; W880-L910 HydrophobicContact CG-CD1 4.02Å; W880-L910 HydrophobicContact CH2-CB 4.11Å; W880-L910 HydrophobicContact CH2-CD2 4.44Å; W880-L910 HydrophobicContact CZ2-CB 3.94Å; W880-L910 HydrophobicContact CZ3-CB 4.4Å; W880-L910 HydrophobicContact CZ3-CD1 4.35Å; W880-L910 HydrophobicContact CZ3-CD2 4.03Å; L887-L910 HydrophobicContact CD1-CD1 3.82Å; V900-L910 HydrophobicContact CG1-CD1 3.42Å; V900-L910 VanDerWaalsContact CG1-CD1 3.42Å; V900-L910 HydrophobicContact CG1-CD2 3.97Å; V900-L910 HydrophobicContact CG1-CG 3.59Å; L910-L912 HydrophobicContact CG-CD1 4.36Å; L910-L912 WeakPolarHBondContact O-CD1 3.47Å; L910-Y923 HydrophobicContact CD2-CD1 4.02Å; L910-Y923 HydrophobicContact CD2-CG 4.48Å; L910-F938 HydrophobicContact CD2-CE1 4.2Å; L910-F938 HydrophobicContact CD2-CZ 3.8Å
911	S	86.4	Confident	83.7	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	128.1	-176.5	-162.6	0	0	0	0	110.3	H864 E890 V900 F901 H913	H864-S911 PolarHBondContact CE1-OG 3.22Å; H864-S911 VanDerWaalsContact CE1-OG 3.22Å; H864-S911 PolarHBondContact ND1-OG 3.2Å; E890-S911 WeakPolarHBondContact OE2-CB 3.41Å; E890-S911 PolarHBondContact OE2-OG 2.97Å; V900-S911 CarbonylContact C-O 3.52Å; V900-S911 WeakPolarHBondContact CA-O 3.35Å; F901-S911 PolarHBondContact N-O 3.3Å; F901-S911 PolarHBondContact O-N 2.67Å; S911-H913 PolarHBondContact OG-NE2 2.67Å
912	L	87.6	Confident	83.6	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	119.5	-174.2	-69	105.6	0	0	0	109.3	I857 T862 T863 L865 V900 L910 I915 L940	I857-L912 HydrophobicContact CD1-CD1 4.39Å; I857-L912 HydrophobicContact CD1-CD2 3.82Å; T862-L912 CarbonylContact C-O 3.38Å; T862-L912 WeakPolarHBondContact CA-O 3.44Å; T862-L912 WeakPolarHBondContact CG2-O 3.49Å; T863-L912 HydrophobicContact CG2-CB 4.2Å; T863-L912 HydrophobicContact CG2-CD1 4.2Å; T863-L912 PolarHBondContact N-O 2.93Å; T863-L912 WeakPolarHBondContact O-CA 3.1Å; T863-L912 WeakPolarHBondContact O-CB 3.23Å; T863-L912 PolarHBondContact O-N 3.37Å; L865-L912 HydrophobicContact CB-CD1 4.45Å; L865-L912 HydrophobicContact CD1-CD1 3.75Å; L865-L912 HydrophobicContact CG-CD1 3.69Å; V900-L912 HydrophobicContact CG1-CG 4.22Å; V900-L912 HydrophobicContact CG2-CD2 3.9Å; V900-L912 HydrophobicContact CG2-CG 4.08Å; L910-L912 HydrophobicContact CG-CD1 4.36Å; L910-L912 WeakPolarHBondContact O-CD1 3.47Å; L912-I915 HydrophobicContact CB-CD1 3.73Å; L912-I915 HydrophobicContact CB-CG1 3.68Å; L912-I915 HydrophobicContact CD2-CD1 3.86Å; L912-I915 HydrophobicContact CD2-CG1 3.87Å; L912-I915 HydrophobicContact CG-CD1 4.18Å; L912-I915 HydrophobicContact CG-CG1 4.35Å; L912-L940 HydrophobicContact CD2-CD1 4.2Å; L912-L940 HydrophobicContact CD2-CD2 3.78Å
913	H	84.6	Confident	83.6	Confident	31 Å²	31	40.1 Å²	40.1	14%	0.144	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	122.8	-177	-74.7	-63.1	0	0	0	111.6	T862 E890 W897 Q898 G899 S911 I915	T862-H913 WeakPolarHBondContact CG2-ND1 3.29Å; T862-H913 WeakPolarHBondContact OG1-CA 3.39Å; E890-H913 IonicContact OE1-CD2 3.25Å; E890-H913 IonicContact OE1-CE1 3.38Å; E890-H913 IonicContact OE1-NE2 2.72Å; E890-H913 PolarHBondContact OE1-NE2 2.7Å; E890-H913 IonicContact OE2-NE2 3.61Å; W897-H913 HydrophobicContact CB-CB 4.31Å; Q898-H913 CarbonylContact C-O 3.54Å; Q898-H913 WeakPolarHBondContact CA-O 3.5Å; G899-H913 PolarHBondContact N-O 3.33Å; G899-H913 PolarHBondContact O-N 3.05Å; S911-H913 PolarHBondContact OG-NE2 2.67Å; H913-I915 VanDerWaalsContact C-N 3.28Å; H913-I915 PolarHBondContact O-N 2.91Å
914	K	82.4	Confident	83.9	Confident	97 Å²	97	40.4 Å²	40.4	42%	0.422	22%	0.221	S	C	.	.	S	Bend	trans	47.8	46.7	173.5	-59.4	176.5	-170.8	154	0	113	E861 T862 W897 Q898 N916	E861-K914 PolarHBondContact O-N 3.06Å; T862-K914 PolarHBondContact OG1-N 2.98Å; W897-K914 WeakPolarHBondContact O-CD 3.19Å; Q898-K914 HydrophobicContact CB-CB 4.45Å; Q898-K914 HydrophobicContact CG-CB 4.31Å; Q898-K914 WeakPolarHBondContact CG-O 3.5Å; Q898-K914 PolarHBondContact NE2-O 3.25Å; K914-N916 PolarHBondContact O-N 2.82Å
915	I	85.9	Confident	84.4	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.199	C	C	.	.			trans	-58.8	133.4	-163	-66.7	-58.7	0	0	0	113.2	E859 G860 E861 G899 V900 L912 H913 N919 V942	E859-I915 CarbonylContact C-O 3.58Å; E859-I915 WeakPolarHBondContact CA-O 3.18Å; G860-I915 PolarHBondContact N-O 3.17Å; E861-I915 PolarHBondContact O-N 3.36Å; G899-I915 VanDerWaalsContact O-CD1 3.29Å; G899-I915 WeakPolarHBondContact O-CD1 3.49Å; V900-I915 HydrophobicContact CG2-CD1 3.53Å; L912-I915 HydrophobicContact CB-CD1 3.73Å; L912-I915 HydrophobicContact CB-CG1 3.68Å; L912-I915 HydrophobicContact CD2-CD1 3.86Å; L912-I915 HydrophobicContact CD2-CG1 3.87Å; L912-I915 HydrophobicContact CG-CD1 4.18Å; L912-I915 HydrophobicContact CG-CG1 4.35Å; H913-I915 VanDerWaalsContact C-N 3.28Å; H913-I915 PolarHBondContact O-N 2.91Å; I915-N919 WeakPolarHBondContact CA-OD1 3.28Å; I915-N919 HydrophobicContact CD1-CB 4.48Å; I915-N919 WeakPolarHBondContact CD1-OD1 3.2Å; I915-N919 HydrophobicContact CG2-CB 4.03Å; I915-V942 HydrophobicContact CG2-CB 4.43Å; I915-V942 HydrophobicContact CG2-CG1 3.95Å; I915-V942 HydrophobicContact CG2-CG2 3.55Å
916	N	88.2	Confident	85.1	Confident	27 Å²	27	34.2 Å²	34.2	14%	0.144	17%	0.169	C	C	.	.			trans	-107.2	163.2	176.5	78.9	5	0	0	0	111.7	K914 E918 N919	K914-N916 PolarHBondContact O-N 2.82Å; N916-E918 PolarHBondContact ND2-OE2 2.69Å; N916-E918 PolarHBondContact O-N 3.02Å; N916-E918 VanDerWaalsContact O-N 3.13Å; N916-E918 WeakPolarHBondContact OD1-CA 3.39Å; N916-E918 VanDerWaalsContact OD1-CB 3.27Å; N916-E918 WeakPolarHBondContact OD1-CB 3.49Å; N916-E918 PolarHBondContact OD1-N 2.96Å; N916-N919 PolarHBondContact N-OD1 2.86Å; N916-N919 WeakPolarHBondContact O-CB 3.44Å; N916-N919 PolarHBondContact O-N 2.79Å; N916-N919 PolarHBondContact OD1-N 2.85Å; N916-N919 PolarHBondContact OD1-ND2 2.03Å; N916-N919 VanDerWaalsContact OD1-ND2 3.09Å; N916-N919 PolarHBondContact OD1-OD1 2.81Å
917	R	86.7	Confident	85.6	Confident	79 Å²	79	31.7 Å²	31.7	30%	0.298	15%	0.153	S	C	.	.	G	3₁₀ helix	trans	-55.2	-25.4	174.8	62.1	-171.7	66.1	-162.1	-0.4	114.8	E859 N919 M920 Y944 D971	E859-R917 WeakPolarHBondContact OE1-CB 3.43Å; E859-R917 WeakPolarHBondContact OE1-CG 2.92Å; E859-R917 IonicContact OE1-CZ 3.19Å; E859-R917 PolarHBondContact OE1-N 2.72Å; E859-R917 IonicContact OE1-NE 2.74Å; E859-R917 PolarHBondContact OE1-NE 3.39Å; E859-R917 IonicContact OE1-NH2 2.75Å; E859-R917 IonicContact OE2-CZ 2.69Å; E859-R917 IonicContact OE2-NE 3.97Å; E859-R917 PolarHBondContact OE2-NE 2.69Å; E859-R917 IonicContact OE2-NH2 3.66Å; E859-R917 PolarHBondContact OE2-NH2 3.09Å; R917-N919 PolarHBondContact O-N 3.38Å; R917-M920 VanDerWaalsContact O-CB 3.32Å; R917-M920 WeakPolarHBondContact O-CB 3.19Å; R917-M920 PolarHBondContact O-N 3.23Å; R917-Y944 HydrophobicContact CB-CD1 3.96Å; R917-Y944 HydrophobicContact CB-CE1 3.97Å; R917-Y944 VanDerWaalsContact NH1-CE2 3.34Å; R917-Y944 VanDerWaalsContact NH2-CD2 3.29Å; R917-D971 IonicContact CZ-OD2 2.71Å; R917-D971 IonicContact NH1-OD2 3.86Å; R917-D971 PolarHBondContact NH1-OD2 3.5Å
918	E	85.4	Confident	86.3	Confident	144 Å²	144	32.8 Å²	32.8	67%	0.673	16%	0.161	S	C	*	.	G	3₁₀ helix	trans	-74.2	-12.3	176.1	-46.2	177.2	137.2	0	0	113.1	R882 N916	R882-E918 PolarHBondContact NH1-O 3.06Å; R882-E918 PolarHBondContact NH2-O 2.71Å; N916-E918 PolarHBondContact ND2-OE2 2.69Å; N916-E918 PolarHBondContact O-N 3.02Å; N916-E918 VanDerWaalsContact O-N 3.13Å; N916-E918 WeakPolarHBondContact OD1-CA 3.39Å; N916-E918 VanDerWaalsContact OD1-CB 3.27Å; N916-E918 WeakPolarHBondContact OD1-CB 3.49Å; N916-E918 PolarHBondContact OD1-N 2.96Å
919	N	87.6	Confident	86.7	Confident	17 Å²	17	30.7 Å²	30.7	9%	0.091	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-83.1	-14.2	174.9	-53.6	149.6	0	0	0	112.9	R882 V900 I915 N916 R917 Y923	R882-N919 PolarHBondContact NE-O 2.88Å; R882-N919 PolarHBondContact NH2-O 2.88Å; R882-N919 VanDerWaalsContact NH2-O 3.12Å; V900-N919 HydrophobicContact CG2-CB 4.45Å; I915-N919 WeakPolarHBondContact CA-OD1 3.28Å; I915-N919 HydrophobicContact CD1-CB 4.48Å; I915-N919 WeakPolarHBondContact CD1-OD1 3.2Å; I915-N919 HydrophobicContact CG2-CB 4.03Å; N916-N919 PolarHBondContact N-OD1 2.86Å; N916-N919 WeakPolarHBondContact O-CB 3.44Å; N916-N919 PolarHBondContact O-N 2.79Å; N916-N919 PolarHBondContact OD1-N 2.85Å; N916-N919 PolarHBondContact OD1-ND2 2.03Å; N916-N919 VanDerWaalsContact OD1-ND2 3.09Å; N916-N919 PolarHBondContact OD1-OD1 2.81Å; R917-N919 PolarHBondContact O-N 3.38Å; N919-Y923 WeakPolarHBondContact O-CE2 3.35Å; N919-Y923 PolarHBondContact O-OH 3.3Å; N919-Y923 VanDerWaalsContact O-OH 3.04Å
920	M	86.6	Confident	86.8	Confident	37 Å²	37	32.2 Å²	32.2	18%	0.182	17%	0.166	C	C	.	.			trans	-52.8	143.2	174.9	174.8	165.6	49.9	0	0	112.4	R882 R917 F939 L940 V942 F1029	R882-M920 PolarHBondContact NH2-O 2.95Å; R917-M920 VanDerWaalsContact O-CB 3.32Å; R917-M920 WeakPolarHBondContact O-CB 3.19Å; R917-M920 PolarHBondContact O-N 3.23Å; M920-F939 HydrophobicContact CG-CE1 3.81Å; M920-F939 HydrophobicContact CG-CZ 3.65Å; M920-F939 HydrophobicContact SD-CE1 4.22Å; M920-F939 HydrophobicContact SD-CZ 4.15Å; M920-L940 WeakPolarHBondContact CA-O 3.4Å; M920-L940 WeakPolarHBondContact CG-O 3.13Å; M920-V942 HydrophobicContact CB-CB 4.47Å; M920-V942 HydrophobicContact CB-CG2 4.17Å; M920-F1029 HydrophobicContact CE-CE1 4.3Å; M920-F1029 HydrophobicContact CE-CE2 3.78Å; M920-F1029 HydrophobicContact CE-CZ 3.47Å; M920-F1029 VanDerWaalsContact CE-CZ 3.47Å; M920-F1029 HydrophobicContact SD-CE1 4.38Å; M920-F1029 HydrophobicContact SD-CZ 3.76Å
921	G	85.9	Confident	86.7	Confident	10 Å²	10	35.1 Å²	35.1	10%	0.103	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	147.9	-168.9	177.7	0	0	0	0	0	114.8	L940	G921-L940 PolarHBondContact N-O 3.09Å; G921-L940 VanDerWaalsContact N-O 3.09Å; G921-L940 PolarHBondContact O-N 2.78Å
922	N	86.3	Confident	86.6	Confident	79 Å²	79	41.5 Å²	41.5	42%	0.422	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	130.7	178.9	-77.4	-18.5	0	0	0	111.6	N883 T937 F938 F939	N883-N922 PolarHBondContact N-O 3.36Å; N922-T937 HydrophobicContact CB-CG2 4.37Å; N922-F938 WeakPolarHBondContact CA-O 3.19Å; N922-F939 WeakPolarHBondContact OD1-CD2 3.24Å
923	Y	88.1	Confident	86.6	Confident	2 Å²	2	45.8 Å²	45.8	1%	0.008	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	123	175.8	-75	-101.2	0	0	0	109.3	F881 R882 L887 V900 L910 N919 T937 F938 L940	F881-Y923 CarbonylContact O-C 3.41Å; F881-Y923 WeakPolarHBondContact O-CA 3.34Å; R882-Y923 HydrophobicContact CB-CD1 4.25Å; R882-Y923 HydrophobicContact CB-CE1 4.02Å; R882-Y923 VanDerWaalsContact CD-OH 3.32Å; R882-Y923 WeakPolarHBondContact CD-OH 3.35Å; R882-Y923 HydrophobicContact CG-CD1 4.43Å; R882-Y923 HydrophobicContact CG-CE1 4Å; R882-Y923 HydrophobicContact CG-CE2 4.11Å; R882-Y923 PolarHBondContact NE-OH 3.37Å; L887-Y923 HydrophobicContact CD1-CD1 3.98Å; L887-Y923 HydrophobicContact CD1-CE1 3.79Å; V900-Y923 HydrophobicContact CB-CE1 3.97Å; V900-Y923 HydrophobicContact CG1-CD1 4.4Å; V900-Y923 HydrophobicContact CG1-CE1 3.64Å; V900-Y923 HydrophobicContact CG2-CE1 4.25Å; V900-Y923 WeakPolarHBondContact CG2-OH 3.49Å; L910-Y923 HydrophobicContact CD2-CD1 4.02Å; L910-Y923 HydrophobicContact CD2-CG 4.48Å; N919-Y923 WeakPolarHBondContact O-CE2 3.35Å; N919-Y923 PolarHBondContact O-OH 3.3Å; N919-Y923 VanDerWaalsContact O-OH 3.04Å; Y923-T937 WeakPolarHBondContact O-CA 3.15Å; Y923-F938 HydrophobicContact CG-CZ 4.37Å; Y923-F938 PolarHBondContact N-O 3.26Å; Y923-F938 PolarHBondContact O-N 3.32Å; Y923-L940 HydrophobicContact CD2-CB 3.73Å; Y923-L940 HydrophobicContact CD2-CD2 4.32Å; Y923-L940 HydrophobicContact CE2-CB 3.71Å; Y923-L940 HydrophobicContact CE2-CD2 3.62Å; Y923-L940 HydrophobicContact CE2-CG 4.29Å
924	T	87.6	Confident	86.7	Confident	14 Å²	14	45.5 Å²	45.5	9%	0.086	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	131.6	179.3	-63.9	0	0	0	0	109.4	F881 R935 N936 T937	F881-T924 PolarHBondContact N-O 2.85Å; F881-T924 PolarHBondContact O-N 3.16Å; T924-R935 HydrophobicContact CG2-CG 3.84Å; T924-N936 CarbonylContact C-O 3.5Å; T924-N936 VanDerWaalsContact CA-O 3.32Å; T924-N936 WeakPolarHBondContact CA-O 3.43Å; T924-T937 WeakPolarHBondContact OG1-CG2 3.22Å; T924-T937 PolarHBondContact OG1-OG1 3.42Å
925	V	87.3	Confident	86.9	Confident	4 Å²	4	47.7 Å²	47.7	2%	0.024	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	140.5	171.9	65	0	0	0	0	110.1	F846 L849 V878 W880 V927 R935 N936	F846-V925 HydrophobicContact CD1-CG1 4.21Å; F846-V925 HydrophobicContact CE1-CG1 3.38Å; F846-V925 HydrophobicContact CZ-CG1 3.83Å; L849-V925 HydrophobicContact CD1-CG1 3.88Å; V878-V925 HydrophobicContact CG1-CG2 3.79Å; W880-V925 HydrophobicContact CD2-CB 4.14Å; W880-V925 HydrophobicContact CD2-CG2 3.97Å; W880-V925 HydrophobicContact CE3-CB 3.8Å; W880-V925 HydrophobicContact CE3-CG2 4.16Å; W880-V925 HydrophobicContact CH2-CB 3.61Å; W880-V925 HydrophobicContact CH2-CG1 4.18Å; W880-V925 HydrophobicContact CH2-CG2 3.8Å; W880-V925 HydrophobicContact CZ2-CB 3.98Å; W880-V925 HydrophobicContact CZ2-CG2 3.62Å; W880-V925 HydrophobicContact CZ3-CB 3.53Å; W880-V925 HydrophobicContact CZ3-CG1 4.33Å; W880-V925 HydrophobicContact CZ3-CG2 4.09Å; V925-V927 HydrophobicContact CG2-CG2 3.79Å; V925-R935 WeakPolarHBondContact O-CA 3.27Å; V925-N936 HydrophobicContact CG1-CB 4.02Å; V925-N936 PolarHBondContact N-O 2.86Å; V925-N936 PolarHBondContact O-N 2.89Å
926	I	89.1	Confident	86.7	Confident	19 Å²	19	48.6 Å²	48.6	10%	0.097	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	125.5	170.5	-58.9	-179.8	0	0	0	107.3	V878 S879 F881 E933 R935	V878-I926 CarbonylContact C-O 3.5Å; V878-I926 WeakPolarHBondContact CA-O 3.42Å; S879-I926 PolarHBondContact N-O 2.95Å; S879-I926 PolarHBondContact O-N 2.9Å; F881-I926 HydrophobicContact CD2-CD1 4.09Å; F881-I926 HydrophobicContact CD2-CG1 4.24Å; F881-I926 HydrophobicContact CE2-CB 4.31Å; F881-I926 HydrophobicContact CE2-CD1 3.5Å; F881-I926 VanDerWaalsContact CE2-CD1 3.5Å; F881-I926 HydrophobicContact CE2-CG1 3.9Å; F881-I926 HydrophobicContact CZ-CD1 4.09Å; I926-E933 HydrophobicContact CG2-CG 3.43Å; I926-E933 VanDerWaalsContact CG2-CG 3.43Å; I926-E933 WeakPolarHBondContact CG2-OE1 3.2Å; I926-R935 HydrophobicContact CG1-CG 4.25Å
927	V	89.1	Confident	86.5	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	134	-177.2	-174.8	0	0	0	0	107.9	P844 F846 L869 V875 S877 V878 V925 E933 S934	P844-V927 HydrophobicContact CB-CB 4.2Å; P844-V927 HydrophobicContact CB-CG1 3.64Å; P844-V927 HydrophobicContact CG-CB 4.41Å; P844-V927 HydrophobicContact CG-CG1 3.75Å; F846-V927 HydrophobicContact CE1-CB 4.38Å; F846-V927 HydrophobicContact CE1-CG2 3.55Å; F846-V927 HydrophobicContact CZ-CB 4.11Å; F846-V927 HydrophobicContact CZ-CG2 3.66Å; L869-V927 HydrophobicContact CD1-CG1 4.03Å; L869-V927 HydrophobicContact CD1-CG2 4.03Å; L869-V927 HydrophobicContact CD2-CG2 4.05Å; V875-V927 HydrophobicContact CB-CG1 4.22Å; V875-V927 HydrophobicContact CG1-CG1 3.56Å; V875-V927 HydrophobicContact CG2-CG1 3.55Å; S877-V927 WeakPolarHBondContact O-CA 3.17Å; V878-V927 HydrophobicContact CG1-CG2 4.24Å; V878-V927 HydrophobicContact CG2-CG1 4.34Å; V878-V927 HydrophobicContact CG2-CG2 4.45Å; V925-V927 HydrophobicContact CG2-CG2 3.79Å; V927-E933 CarbonylContact O-C 3.38Å; V927-S934 PolarHBondContact N-O 2.82Å; V927-S934 PolarHBondContact O-N 2.86Å
928	S	88.8	Confident	86.3	Confident	24 Å²	24	45.7 Å²	45.7	17%	0.168	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	151.6	175.4	80.4	0	0	0	0	112.9	V875 T876 S877	V875-S928 WeakPolarHBondContact CA-O 3.18Å; T876-S928 PolarHBondContact N-O 2.9Å; T876-S928 PolarHBondContact OG1-O 2.84Å; T876-S928 PolarHBondContact OG1-OG 3.4Å; S877-S928 PolarHBondContact N-O 3.46Å; S877-S928 PolarHBondContact O-N 3.01Å; S877-S928 PolarHBondContact OG-OG 3.45Å
929	N	88.5	Confident	86.2	Confident	9 Å²	9	40.9 Å²	40.9	5%	0.048	21%	0.21	C	C	.	.			trans	-131.1	-176.2	156.9	72.9	0.5	0	0	0	108.9	F842 P844 P873 P874 T876 Q931 H932	F842-N929 PolarHBondContact O-ND2 3.07Å; P844-N929 HydrophobicContact CG-CB 4.27Å; P873-N929 PolarHBondContact O-ND2 2.78Å; P874-N929 WeakPolarHBondContact O-CB 3.34Å; T876-N929 WeakPolarHBondContact OG1-CA 3.49Å; N929-Q931 PolarHBondContact O-N 2.82Å; N929-Q931 VanDerWaalsContact OD1-CB 3.31Å; N929-Q931 WeakPolarHBondContact OD1-CB 3.45Å; N929-Q931 PolarHBondContact OD1-N 2.85Å; N929-H932 PolarHBondContact N-O 2.81Å; N929-H932 PolarHBondContact O-N 2.78Å; N929-H932 PolarHBondContact OD1-N 3.1Å
930	S	84.5	Confident	86.2	Confident	83 Å²	83	40 Å²	40	58%	0.58	21%	0.206	S	C	*	.	S	Bend	trans	-68	8.2	179.8	67.5	0	0	0	0	115.5	P873	P873-S930 WeakPolarHBondContact CG-OG 3.17Å
931	Q	84.3	Confident	86.1	Confident	62 Å²	62	39.7 Å²	39.7	29%	0.29	20%	0.204	S	C	.	.	S	Bend	trans	-106.2	-49.4	176	-52.8	-66.6	-92.7	0	0	111.5	T841 N929	T841-Q931 PolarHBondContact OG1-OE1 2.93Å; N929-Q931 PolarHBondContact O-N 2.82Å; N929-Q931 VanDerWaalsContact OD1-CB 3.31Å; N929-Q931 WeakPolarHBondContact OD1-CB 3.45Å; N929-Q931 PolarHBondContact OD1-N 2.85Å
932	H	84.7	Confident	86.2	Confident	133 Å²	133	39.2 Å²	39.2	62%	0.616	20%	0.199	S	C	*	.			trans	-163.4	166	176	-152.7	48.3	0	0	0	112.7	A843 N929	A843-H932 HydrophobicContact CB-CB 3.61Å; N929-H932 PolarHBondContact N-O 2.81Å; N929-H932 PolarHBondContact O-N 2.78Å; N929-H932 PolarHBondContact OD1-N 3.1Å
933	E	86.8	Confident	86.4	Confident	91 Å²	91	36.2 Å²	36.2	43%	0.425	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	154.5	160.1	-172.3	-178.8	129.6	0	0	109.9	I926 V927 R935	I926-E933 HydrophobicContact CG2-CG 3.43Å; I926-E933 VanDerWaalsContact CG2-CG 3.43Å; I926-E933 WeakPolarHBondContact CG2-OE1 3.2Å; V927-E933 CarbonylContact O-C 3.38Å; E933-R935 IonicContact OE1-NH2 3.41Å
934	S	86.9	Confident	86.5	Confident	24 Å²	24	36.5 Å²	36.5	17%	0.168	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	133.4	169	-67.6	0	0	0	0	109.2	P844 F846 V927	P844-S934 WeakPolarHBondContact O-CB 3.21Å; P844-S934 PolarHBondContact O-OG 3.29Å; F846-S934 WeakPolarHBondContact CZ-O 3.49Å; V927-S934 PolarHBondContact N-O 2.82Å; V927-S934 PolarHBondContact O-N 2.86Å
935	R	86.5	Confident	86.6	Confident	144 Å²	144	38.2 Å²	38.2	54%	0.543	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	145.2	-174.3	179.8	-177.7	-63	-125.2	0.6	111	T924 V925 I926 E933	T924-R935 HydrophobicContact CG2-CG 3.84Å; V925-R935 WeakPolarHBondContact O-CA 3.27Å; I926-R935 HydrophobicContact CG1-CG 4.25Å; E933-R935 IonicContact OE1-NH2 3.41Å
936	N	83	Confident	86.7	Confident	19 Å²	19	38.4 Å²	38.4	10%	0.102	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	156.1	171.7	-149.8	-24.1	0	0	0	111.5	F846 L849 T924 V925	F846-N936 WeakPolarHBondContact CB-ND2 3.35Å; F846-N936 HydrophobicContact CD1-CB 4.07Å; F846-N936 HydrophobicContact CD2-CB 3.74Å; F846-N936 HydrophobicContact CE1-CB 4.09Å; F846-N936 HydrophobicContact CE2-CB 3.75Å; F846-N936 HydrophobicContact CG-CB 3.9Å; F846-N936 WeakPolarHBondContact CG-ND2 3.04Å; F846-N936 HydrophobicContact CZ-CB 3.93Å; L849-N936 HydrophobicContact CB-CB 4.36Å; L849-N936 WeakPolarHBondContact CB-ND2 3.49Å; L849-N936 HydrophobicContact CD1-CB 4.31Å; L849-N936 PolarHBondContact O-ND2 2.93Å; T924-N936 CarbonylContact C-O 3.5Å; T924-N936 VanDerWaalsContact CA-O 3.32Å; T924-N936 WeakPolarHBondContact CA-O 3.43Å; V925-N936 HydrophobicContact CG1-CB 4.02Å; V925-N936 PolarHBondContact N-O 2.86Å; V925-N936 PolarHBondContact O-N 2.89Å
937	T	82.5	Confident	86.9	Confident	42 Å²	42	39.8 Å²	39.8	26%	0.258	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	136.1	-174.8	-57.3	0	0	0	0	110.9	N922 Y923 T924	N922-T937 HydrophobicContact CB-CG2 4.37Å; Y923-T937 WeakPolarHBondContact O-CA 3.15Å; T924-T937 WeakPolarHBondContact OG1-CG2 3.22Å; T924-T937 PolarHBondContact OG1-OG1 3.42Å
938	F	82.8	Confident	87	Confident	3 Å²	3	41.1 Å²	41.1	1%	0.013	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	163.6	176	77.2	-86.8	0	0	0	112.2	L849 R855 L865 F867 W880 L910 N922 Y923 L940	L849-F938 HydrophobicContact CD2-CB 3.75Å; L849-F938 HydrophobicContact CD2-CD1 3.39Å; L849-F938 HydrophobicContact CD2-CE1 4.14Å; L849-F938 HydrophobicContact CD2-CG 3.73Å; R855-F938 HydrophobicContact CB-CD2 3.94Å; R855-F938 HydrophobicContact CB-CE2 3.85Å; R855-F938 HydrophobicContact CG-CD2 3.69Å; R855-F938 HydrophobicContact CG-CE2 3.86Å; L865-F938 HydrophobicContact CD1-CZ 4.22Å; F867-F938 HydrophobicContact CE1-CE1 4.03Å; F867-F938 HydrophobicContact CE1-CZ 4.34Å; F867-F938 AromaticContact CZ-CE1 3.76Å; F867-F938 HydrophobicContact CZ-CE1 3.76Å; F867-F938 AromaticContact CZ-CZ 3.97Å; F867-F938 HydrophobicContact CZ-CZ 3.97Å; W880-F938 HydrophobicContact CH2-CE1 4.42Å; W880-F938 AromaticContact CZ3-CE1 3.95Å; W880-F938 HydrophobicContact CZ3-CE1 3.95Å; L910-F938 HydrophobicContact CD2-CE1 4.2Å; L910-F938 HydrophobicContact CD2-CZ 3.8Å; N922-F938 WeakPolarHBondContact CA-O 3.19Å; Y923-F938 HydrophobicContact CG-CZ 4.37Å; Y923-F938 PolarHBondContact N-O 3.26Å; Y923-F938 PolarHBondContact O-N 3.32Å; F938-L940 HydrophobicContact CE2-CB 4.14Å
939	F	83.4	Confident	87	Confident	42 Å²	42	43.2 Å²	43.2	18%	0.184	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	121.1	175.8	-172.6	-77.6	0	0	0	110.8	D853 H854 R855 M920 N922 N941	D853-F939 PolarHBondContact O-N 2.86Å; H854-F939 AromaticContact CE1-CD1 3.94Å; H854-F939 AromaticContact CE1-CG 3.84Å; H854-F939 AromaticContact ND1-CD1 3.44Å; H854-F939 WeakPolarHBondContact ND1-CD1 3.24Å; H854-F939 AromaticContact ND1-CG 3.65Å; R855-F939 PolarHBondContact N-O 3.26Å; M920-F939 HydrophobicContact CG-CE1 3.81Å; M920-F939 HydrophobicContact CG-CZ 3.65Å; M920-F939 HydrophobicContact SD-CE1 4.22Å; M920-F939 HydrophobicContact SD-CZ 4.15Å; N922-F939 WeakPolarHBondContact OD1-CD2 3.24Å; F939-N941 HydrophobicContact CD1-CB 4.03Å; F939-N941 HydrophobicContact CE1-CB 3.93Å
940	L	86.6	Confident	86.9	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	113.9	169.8	176.7	61.1	0	0	0	109.6	I857 V900 L912 M920 G921 Y923 F938 V942	I857-L940 HydrophobicContact CB-CD1 4.21Å; I857-L940 HydrophobicContact CD1-CD1 3.81Å; I857-L940 HydrophobicContact CG1-CD1 4.12Å; V900-L940 HydrophobicContact CG2-CD2 4.4Å; L912-L940 HydrophobicContact CD2-CD1 4.2Å; L912-L940 HydrophobicContact CD2-CD2 3.78Å; M920-L940 WeakPolarHBondContact CA-O 3.4Å; M920-L940 WeakPolarHBondContact CG-O 3.13Å; G921-L940 PolarHBondContact N-O 3.09Å; G921-L940 VanDerWaalsContact N-O 3.09Å; G921-L940 PolarHBondContact O-N 2.78Å; Y923-L940 HydrophobicContact CD2-CB 3.73Å; Y923-L940 HydrophobicContact CD2-CD2 4.32Å; Y923-L940 HydrophobicContact CE2-CB 3.71Å; Y923-L940 HydrophobicContact CE2-CD2 3.62Å; Y923-L940 HydrophobicContact CE2-CG 4.29Å; F938-L940 HydrophobicContact CE2-CB 4.14Å; L940-V942 HydrophobicContact CG-CG2 4.28Å
941	N	85.8	Confident	87	Confident	29 Å²	29	49.2 Å²	49.2	16%	0.155	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	114.7	177.1	-177.4	29.7	0	0	0	110.4	R855 V856 I857 F939 N973	R855-N941 PolarHBondContact O-N 2.91Å; V856-N941 WeakPolarHBondContact CA-O 3.44Å; V856-N941 HydrophobicContact CG2-CB 4.42Å; I857-N941 PolarHBondContact N-O 3.04Å; F939-N941 HydrophobicContact CD1-CB 4.03Å; F939-N941 HydrophobicContact CE1-CB 3.93Å; N941-N973 PolarHBondContact OD1-ND2 2.69Å
942	V	88.6	Confident	87	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	110.2	-178.5	-176	0	0	0	0	110	I857 E859 I915 M920 L940 N973	I857-V942 CarbonylContact O-C 3.58Å; I857-V942 VanDerWaalsContact O-CA 3.31Å; I857-V942 WeakPolarHBondContact O-CA 3.44Å; E859-V942 HydrophobicContact CB-CG1 4.06Å; I915-V942 HydrophobicContact CG2-CB 4.43Å; I915-V942 HydrophobicContact CG2-CG1 3.95Å; I915-V942 HydrophobicContact CG2-CG2 3.55Å; M920-V942 HydrophobicContact CB-CB 4.47Å; M920-V942 HydrophobicContact CB-CG2 4.17Å; L940-V942 HydrophobicContact CG-CG2 4.28Å; V942-N973 PolarHBondContact O-ND2 3.32Å
943	T	89.1	Confident	87.1	Confident	16 Å²	16	50.4 Å²	50.4	10%	0.098	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	141.2	-178.9	51.7	0	0	0	0	112	V856 I857 R858 E859 N973 I1056	V856-T943 HydrophobicContact CG1-CG2 3.67Å; I857-T943 PolarHBondContact O-N 2.85Å; I857-T943 PolarHBondContact O-OG1 2.9Å; R858-T943 CarbonylContact C-O 3.47Å; E859-T943 PolarHBondContact N-O 2.91Å; T943-N973 CarbonylContact C-O 3.54Å; T943-N973 VanDerWaalsContact CA-O 3.26Å; T943-N973 WeakPolarHBondContact CA-O 3.41Å; T943-N973 WeakPolarHBondContact CB-O 3.11Å; T943-I1056 HydrophobicContact CG2-CD1 4.44Å
944	Y	89.9	Confident	87.2	Confident	9 Å²	9	49.4 Å²	49.4	4%	0.035	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	152.1	-170.3	56.1	-106.6	0	0	0	112.3	E859 R917 D971 A972 N973 F1029 N1054	E859-Y944 VanDerWaalsContact OE2-CB 3.24Å; E859-Y944 WeakPolarHBondContact OE2-CB 3.12Å; R917-Y944 HydrophobicContact CB-CD1 3.96Å; R917-Y944 HydrophobicContact CB-CE1 3.97Å; R917-Y944 VanDerWaalsContact NH1-CE2 3.34Å; R917-Y944 VanDerWaalsContact NH2-CD2 3.29Å; Y944-D971 WeakPolarHBondContact CE2-OD1 3.16Å; Y944-D971 WeakPolarHBondContact CE2-OD2 3.18Å; Y944-D971 PolarHBondContact OH-OD1 2.84Å; Y944-D971 PolarHBondContact OH-OD2 2.98Å; Y944-A972 VanDerWaalsContact CE2-C 3.42Å; Y944-N973 HydrophobicContact CD1-CB 3.64Å; Y944-N973 HydrophobicContact CD2-CB 4.31Å; Y944-N973 HydrophobicContact CE1-CB 3.49Å; Y944-N973 VanDerWaalsContact CE1-CB 3.49Å; Y944-N973 HydrophobicContact CE2-CB 4.19Å; Y944-N973 HydrophobicContact CG-CB 4.07Å; Y944-N973 PolarHBondContact N-O 2.71Å; Y944-N973 PolarHBondContact O-N 2.88Å; Y944-N973 VanDerWaalsContact O-O 3.12Å; Y944-F1029 WeakPolarHBondContact OH-CB 3.23Å; Y944-N1054 PolarHBondContact O-ND2 2.94Å
945	P	89.7	Confident	87.2	Confident	50 Å²	50	53.2 Å²	53.2	33%	0.325	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	149.7	-179	27.3	-37.2	0	0	0	112.5	I1056	P945-I1056 VanDerWaalsContact CA-O 3.24Å; P945-I1056 WeakPolarHBondContact CA-O 3.32Å; P945-I1056 HydrophobicContact CB-CG2 4.49Å; P945-I1056 WeakPolarHBondContact CB-O 3.46Å
946	A	90.4	Very high	87.3	Confident	7 Å²	7	48.3 Å²	48.3	6%	0.058	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	136.7	174.7	0	0	0	0	0	111.7	D971 A972 V1052 N1054 V1060	A946-D971 WeakPolarHBondContact CA-O 3.21Å; A946-A972 HydrophobicContact CB-CB 3.95Å; A946-V1052 HydrophobicContact CB-CG1 3.93Å; A946-N1054 HydrophobicContact CB-CB 4.38Å; A946-N1054 PolarHBondContact N-OD1 2.88Å; A946-V1060 WeakPolarHBondContact O-CG2 3.49Å
947	S	92.1	Very high	87.4	Confident	48 Å²	48	52 Å²	52	34%	0.336	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	136.1	-179.2	62.9	0	0	0	0	111.4	A970 D971	S947-A970 CarbonylContact O-C 3.5Å; S947-A970 WeakPolarHBondContact O-CA 3.48Å; S947-A970 VanDerWaalsContact O-CB 3.23Å; S947-A970 WeakPolarHBondContact O-CB 3.41Å; S947-D971 PolarHBondContact N-O 3.5Å; S947-D971 PolarHBondContact O-N 2.89Å; S947-D971 PolarHBondContact OG-O 2.82Å
948	I	92.2	Very high	87.3	Confident	28 Å²	28	52.3 Å²	52.3	14%	0.144	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	130.7	-177.5	-74.1	155.9	0	0	0	110.8	L952 V1052 V1060 K1062	I948-L952 HydrophobicContact CB-CD2 4.4Å; I948-L952 HydrophobicContact CD1-CD2 4.03Å; I948-L952 HydrophobicContact CG2-CD2 4.37Å; I948-V1052 HydrophobicContact CD1-CG2 4.32Å; I948-V1052 HydrophobicContact CG1-CG2 3.94Å; I948-V1060 HydrophobicContact CD1-CB 3.9Å; I948-V1060 HydrophobicContact CD1-CG2 3.72Å; I948-V1060 HydrophobicContact CG1-CB 4.43Å; I948-V1060 HydrophobicContact CG1-CG2 3.76Å; I948-K1062 HydrophobicContact CD1-CB 4.01Å; I948-K1062 HydrophobicContact CG2-CB 4.39Å; I948-K1062 HydrophobicContact CG2-CD 4.41Å
949	V	89.5	Confident	86.7	Confident	68 Å²	68	56.6 Å²	56.6	41%	0.412	32%	0.316	S	S	.	.			trans	-94.9	101.1	175.9	179.9	0	0	0	0	109.1	K969 D971	V949-K969 HydrophobicContact CB-CB 4.05Å; V949-K969 PolarHBondContact N-O 2.86Å; V949-D971 HydrophobicContact CG2-CB 4.42Å
950	G	86.4	Confident	86.3	Confident	62 Å²	62	59.3 Å²	59.3	64%	0.639	33%	0.332	S	S	*	.	S	Bend	trans	131.7	-158	175.8	0	0	0	0	0	113.5
951	K	85.2	Confident	85.7	Confident	157 Å²	157	65.9 Å²	65.9	68%	0.683	36%	0.361	S	S	*	.			trans	-76.4	143.6	174.7	-65.3	179.5	-179.4	175.6	0	110.9	K1062	K951-K1062 WeakPolarHBondContact O-CD 3.33Å; K951-K1062 VanDerWaalsContact O-CE 3.27Å; K951-K1062 WeakPolarHBondContact O-CE 3.33Å
952	L	85.6	Confident	85.4	Confident	108 Å²	108	69.6 Å²	69.6	57%	0.565	38%	0.381	S	S	*	.	S	Bend	trans	-75.8	-23.4	176.4	-67.6	172.3	0	0	0	113.4	I948 K1062 T1063	I948-L952 HydrophobicContact CB-CD2 4.4Å; I948-L952 HydrophobicContact CD1-CD2 4.03Å; I948-L952 HydrophobicContact CG2-CD2 4.37Å; L952-K1062 CarbonylContact O-C 3.55Å; L952-K1062 WeakPolarHBondContact O-CA 3.42Å; L952-T1063 PolarHBondContact O-N 2.99Å
953	E	86.4	Confident	85.4	Confident	112 Å²	112	75 Å²	75	52%	0.523	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	141.7	171.1	-59.4	-150.1	123	0	0	111.1	T1063	E953-T1063 WeakPolarHBondContact CA-O 3.41Å
954	E	88.8	Confident	85.4	Confident	70 Å²	70	74.3 Å²	74.3	33%	0.327	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	136	-177.5	-169.9	155.1	-131.1	0	0	111.8	I956 K1062 T1063 F1064 N1065	E954-I956 HydrophobicContact CG-CD1 4.06Å; E954-K1062 VanDerWaalsContact OE2-CE 3.32Å; E954-K1062 WeakPolarHBondContact OE2-CE 3.44Å; E954-K1062 IonicContact OE2-NZ 2.77Å; E954-K1062 PolarHBondContact OE2-NZ 3.25Å; E954-T1063 PolarHBondContact N-O 3.04Å; E954-F1064 HydrophobicContact CB-CD1 4.08Å; E954-F1064 HydrophobicContact CB-CE1 4.43Å; E954-F1064 CarbonylContact O-C 3.56Å; E954-F1064 VanDerWaalsContact O-CA 3.27Å; E954-F1064 WeakPolarHBondContact O-CA 3.35Å; E954-N1065 PolarHBondContact O-N 2.97Å
955	N	87.4	Confident	85.5	Confident	104 Å²	104	75.7 Å²	75.7	56%	0.556	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.1	123.1	178.3	-68.1	-4.2	0	0	0	109.5	N1065 L1067	N955-N1065 WeakPolarHBondContact OD1-CB 3.28Å; N955-N1065 PolarHBondContact OD1-ND2 3.41Å; N955-L1067 HydrophobicContact CB-CD1 4.47Å
956	I	87.9	Confident	85.6	Confident	41 Å²	41	73.3 Å²	73.3	21%	0.21	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	97.2	-179.6	-58.9	-61.6	0	0	0	108.5	E954 L966 F1064 N1065 L1066 L1067	E954-I956 HydrophobicContact CG-CD1 4.06Å; I956-L966 HydrophobicContact CB-CD2 4.08Å; I956-L966 HydrophobicContact CG1-CD2 3.74Å; I956-L966 HydrophobicContact CG2-CD2 4.18Å; I956-F1064 HydrophobicContact CG1-CD1 4.36Å; I956-N1065 PolarHBondContact N-O 3.37Å; I956-L1066 HydrophobicContact CB-CD1 4.41Å; I956-L1066 HydrophobicContact CG2-CD1 4.09Å; I956-L1067 PolarHBondContact O-N 3.06Å
957	T	84.6	Confident	85.7	Confident	95 Å²	95	76.9 Å²	76.9	58%	0.583	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85	123.7	172.1	50.1	0	0	0	0	110.4	L1067	T957-L1067 CarbonylContact C-O 3.48Å; T957-L1067 WeakPolarHBondContact CA-O 3.38Å; T957-L1067 HydrophobicContact CG2-CB 4.05Å; T957-L1067 HydrophobicContact CG2-CD1 3.73Å
958	Q	81.2	Confident	85.9	Confident	50 Å²	50	74.6 Å²	74.6	23%	0.234	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	130.1	178.7	-177.2	61.8	-44.4	0	0	111.7	N960 Y963 L1040 L1067 Y1068	Q958-N960 WeakPolarHBondContact CG-O 3.18Å; Q958-Y963 PolarHBondContact NE2-O 2.88Å; Q958-L1040 HydrophobicContact CB-CD1 4.12Å; Q958-L1040 HydrophobicContact CG-CD1 3.56Å; Q958-L1067 PolarHBondContact N-O 2.89Å; Q958-Y1068 WeakPolarHBondContact O-CA 3.04Å; Q958-Y1068 WeakPolarHBondContact O-CD2 3.48Å
959	T	70.8	Confident	86	Confident	93 Å²	93	77.3 Å²	77.3	57%	0.571	41%	0.409	S	S	*	.			trans	-102.9	-31.2	-178.5	52.5	0	0	0	0	112.8
960	N	73.7	Confident	86.1	Confident	98 Å²	98	74.1 Å²	74.1	52%	0.524	39%	0.39	S	S	.	.	S	Bend	trans	-74.7	143.9	174.8	-79.9	-5.7	0	0	0	111.6	Q958 D962	Q958-N960 WeakPolarHBondContact CG-O 3.18Å; N960-D962 VanDerWaalsContact C-N 3.33Å; N960-D962 PolarHBondContact O-N 3.29Å
961	K	73.8	Confident	86.4	Confident	139 Å²	139	72.4 Å²	72.4	60%	0.604	37%	0.366	S	S	*	.	S	Bend	trans	-77.9	-14	-179.4	-74.5	178.1	175.6	178.1	0	114.2	Q1039 L1040 Y1068	K961-Q1039 CarbonylContact O-C 3.58Å; K961-Q1039 WeakPolarHBondContact O-CA 3.47Å; K961-L1040 PolarHBondContact O-N 2.86Å; K961-Y1068 WeakPolarHBondContact CE-OH 3.34Å; K961-Y1068 HydrophobicContact CG-CE2 4.1Å; K961-Y1068 VanDerWaalsContact CG-OH 3.31Å; K961-Y1068 WeakPolarHBondContact CG-OH 3.31Å
962	D	80.9	Confident	86.7	Confident	107 Å²	107	64.9 Å²	64.9	57%	0.572	33%	0.333	S	S	*	.	S	Bend	trans	-69	-53.1	-164.8	-56.3	-54.6	0	0	0	113.2	N960 Y1038 Q1039	N960-D962 VanDerWaalsContact C-N 3.33Å; N960-D962 PolarHBondContact O-N 3.29Å; D962-Y1038 WeakPolarHBondContact O-CA 3.45Å; D962-Q1039 PolarHBondContact O-N 2.71Å
963	Y	87	Confident	86.9	Confident	112 Å²	112	60.3 Å²	60.3	44%	0.439	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.9	162	175.6	67.7	-80.6	0	0	0	113.3	Q958 Y1036 I1037 Y1038	Q958-Y963 PolarHBondContact NE2-O 2.88Å; Y963-Y1036 HydrophobicContact CD2-CD1 4.19Å; Y963-I1037 CarbonylContact C-O 2.84Å; Y963-I1037 WeakPolarHBondContact CA-O 3.5Å; Y963-I1037 WeakPolarHBondContact CB-O 3.41Å; Y963-Y1038 HydrophobicContact CG-CD1 4.4Å; Y963-Y1038 HydrophobicContact CG-CE1 4.37Å
964	A	90.4	Very high	87	Confident	3 Å²	3	57.2 Å²	57.2	3%	0.025	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	160.8	156.9	0	0	0	0	0	110.1	Y1036 I1037 L1040 L1066	A964-Y1036 WeakPolarHBondContact O-CA 3.11Å; A964-I1037 PolarHBondContact N-O 2.8Å; A964-I1037 PolarHBondContact O-N 2.84Å; A964-L1040 HydrophobicContact CB-CD1 4.06Å; A964-L1040 HydrophobicContact CB-CD2 4.29Å; A964-L1066 HydrophobicContact CB-CD1 3.6Å
965	A	90.7	Very high	87	Confident	37 Å²	37	54.5 Å²	54.5	31%	0.306	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	135.2	175	0	0	0	0	0	109.8	T1034 F1035 Y1036	A965-T1034 HydrophobicContact CB-CG2 4.1Å; A965-F1035 CarbonylContact C-O 3.58Å; A965-F1035 WeakPolarHBondContact CA-O 3.11Å; A965-Y1036 HydrophobicContact CB-CD1 3.78Å; A965-Y1036 HydrophobicContact CB-CE1 3.77Å
966	L	93.4	Very high	87	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	118	180	-43.6	179.5	0	0	0	109.2	I956 W983 T1034 F1035 I1037 Y1048 F1064	I956-L966 HydrophobicContact CB-CD2 4.08Å; I956-L966 HydrophobicContact CG1-CD2 3.74Å; I956-L966 HydrophobicContact CG2-CD2 4.18Å; L966-W983 HydrophobicContact CB-CH2 3.66Å; L966-W983 HydrophobicContact CB-CZ3 3.8Å; L966-W983 HydrophobicContact CD1-CZ3 3.89Å; L966-W983 HydrophobicContact CG-CZ3 4.5Å; L966-W983 WeakPolarHBondContact O-CH2 3.3Å; L966-T1034 CarbonylContact O-C 3.59Å; L966-T1034 WeakPolarHBondContact O-CA 3.17Å; L966-F1035 HydrophobicContact CB-CB 4.27Å; L966-F1035 HydrophobicContact CD1-CD1 3.86Å; L966-F1035 HydrophobicContact CG-CD1 4.37Å; L966-F1035 PolarHBondContact N-O 2.88Å; L966-F1035 PolarHBondContact O-N 2.82Å; L966-I1037 HydrophobicContact CD1-CD1 4.33Å; L966-Y1048 HydrophobicContact CD1-CD2 4.45Å; L966-Y1048 HydrophobicContact CD1-CG 4.03Å; L966-F1064 HydrophobicContact CB-CD1 3.88Å; L966-F1064 HydrophobicContact CB-CD2 4.39Å; L966-F1064 HydrophobicContact CB-CE1 3.92Å; L966-F1064 HydrophobicContact CB-CE2 4.45Å; L966-F1064 HydrophobicContact CB-CG 4.11Å; L966-F1064 HydrophobicContact CB-CZ 4.2Å; L966-F1064 HydrophobicContact CD1-CB 3.97Å; L966-F1064 HydrophobicContact CD1-CD2 4.37Å; L966-F1064 HydrophobicContact CD1-CG 4.1Å; L966-F1064 HydrophobicContact CD2-CB 4.22Å; L966-F1064 HydrophobicContact CD2-CD1 4.24Å; L966-F1064 HydrophobicContact CD2-CG 4.4Å; L966-F1064 HydrophobicContact CG-CD1 4.47Å; L966-F1064 HydrophobicContact CG-CG 4.44Å
967	D	92.7	Very high	86.8	Confident	83 Å²	83	52 Å²	52	44%	0.444	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	121.8	-176.6	-86.1	-22.7	0	0	0	112.9	T1034 K1062 F1064	D967-T1034 VanDerWaalsContact OD1-CB 3.31Å; D967-T1034 WeakPolarHBondContact OD1-CB 3.19Å; D967-T1034 WeakPolarHBondContact OD1-CG2 3.48Å; D967-T1034 PolarHBondContact OD1-OG1 3.16Å; D967-K1062 PolarHBondContact O-NZ 2.77Å; D967-F1064 VanDerWaalsContact O-CZ 3.28Å; D967-F1064 WeakPolarHBondContact O-CZ 3.34Å
968	C	94.5	Very high	86.7	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	129	175.9	-165.9	0	0	0	0	109.7	F981 W983 S1032 S1033 C1050 F1064	C968-F981 HydrophobicContact CB-CE1 4.31Å; C968-W983 HydrophobicContact CB-CH2 3.88Å; C968-W983 HydrophobicContact CB-CZ2 3.57Å; C968-S1032 CarbonylContact O-C 3.58Å; C968-S1032 VanDerWaalsContact O-CA 3.26Å; C968-S1032 WeakPolarHBondContact O-CA 3.49Å; C968-S1033 PolarHBondContact N-O 2.75Å; C968-S1033 PolarHBondContact O-N 2.95Å; C968-C1050 HydrophobicContact CB-CB 3.68Å; C968-C1050 WeakPolarHBondContact CB-SG 3.44Å; C968-C1050 WeakPolarHBondContact SG-CB 3.15Å; C968-C1050 CovalentContact SG-SG 2.04Å; C968-C1050 PolarHBondContact SG-SG 2.73Å; C968-F1064 HydrophobicContact CB-CZ 4.36Å
969	K	94.2	Very high	86.7	Confident	85 Å²	85	59.7 Å²	59.7	37%	0.37	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	146.2	-178.6	-60.8	-168.5	-177.4	-170.4	0	110.2	V949	V949-K969 HydrophobicContact CB-CB 4.05Å; V949-K969 PolarHBondContact N-O 2.86Å
970	A	93.3	Very high	87.4	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.008	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	154.2	-179.6	0	0	0	0	0	113.5	S947 F981 Q1030 I1031 V1052	S947-A970 CarbonylContact O-C 3.5Å; S947-A970 WeakPolarHBondContact O-CA 3.48Å; S947-A970 VanDerWaalsContact O-CB 3.23Å; S947-A970 WeakPolarHBondContact O-CB 3.41Å; A970-F981 HydrophobicContact CB-CE1 4.29Å; A970-F981 HydrophobicContact CB-CZ 4.1Å; A970-Q1030 WeakPolarHBondContact O-CA 3.34Å; A970-I1031 HydrophobicContact CB-CG1 4.15Å; A970-I1031 PolarHBondContact N-O 3.29Å; A970-I1031 WeakPolarHBondContact O-CG1 3.05Å; A970-I1031 PolarHBondContact O-N 3.09Å; A970-I1031 VanDerWaalsContact O-O 3.14Å; A970-V1052 HydrophobicContact CB-CG1 3.7Å
971	D	92.7	Very high	88.3	Confident	25 Å²	25	50.9 Å²	50.9	13%	0.134	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	131.6	168	166.3	53.1	0	0	0	109.5	R917 Y944 A946 S947 V949 F1029	R917-D971 IonicContact CZ-OD2 2.71Å; R917-D971 IonicContact NH1-OD2 3.86Å; R917-D971 PolarHBondContact NH1-OD2 3.5Å; Y944-D971 WeakPolarHBondContact CE2-OD1 3.16Å; Y944-D971 WeakPolarHBondContact CE2-OD2 3.18Å; Y944-D971 PolarHBondContact OH-OD1 2.84Å; Y944-D971 PolarHBondContact OH-OD2 2.98Å; A946-D971 WeakPolarHBondContact CA-O 3.21Å; S947-D971 PolarHBondContact N-O 3.5Å; S947-D971 PolarHBondContact O-N 2.89Å; S947-D971 PolarHBondContact OG-O 2.82Å; V949-D971 HydrophobicContact CG2-CB 4.42Å; D971-F1029 WeakPolarHBondContact OD1-CB 3.19Å
972	A	90.6	Very high	89.2	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	148.6	-174	0	0	0	0	0	112.6	Y944 A946 P974 A975 F1029 I1031 N1054	Y944-A972 VanDerWaalsContact CE2-C 3.42Å; A946-A972 HydrophobicContact CB-CB 3.95Å; A972-P974 WeakPolarHBondContact CB-O 3.21Å; A972-A975 WeakPolarHBondContact O-CB 3.41Å; A972-F1029 PolarHBondContact N-O 3.49Å; A972-F1029 WeakPolarHBondContact O-CA 3.44Å; A972-I1031 HydrophobicContact CB-CD1 4.4Å; A972-N1054 HydrophobicContact CB-CB 4.26Å
973	N	90.2	Very high	89.7	Confident	12 Å²	12	40.2 Å²	40.2	6%	0.064	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	108.8	164.4	-172.8	17.9	0	0	0	110.2	N941 V942 T943 Y944 F1029 N1054	N941-N973 PolarHBondContact OD1-ND2 2.69Å; V942-N973 PolarHBondContact O-ND2 3.32Å; T943-N973 CarbonylContact C-O 3.54Å; T943-N973 VanDerWaalsContact CA-O 3.26Å; T943-N973 WeakPolarHBondContact CA-O 3.41Å; T943-N973 WeakPolarHBondContact CB-O 3.11Å; Y944-N973 HydrophobicContact CD1-CB 3.64Å; Y944-N973 HydrophobicContact CD2-CB 4.31Å; Y944-N973 HydrophobicContact CE1-CB 3.49Å; Y944-N973 VanDerWaalsContact CE1-CB 3.49Å; Y944-N973 HydrophobicContact CE2-CB 4.19Å; Y944-N973 HydrophobicContact CG-CB 4.07Å; Y944-N973 PolarHBondContact N-O 2.71Å; Y944-N973 PolarHBondContact O-N 2.88Å; Y944-N973 VanDerWaalsContact O-O 3.12Å; N973-F1029 HydrophobicContact CB-CD1 3.79Å; N973-F1029 HydrophobicContact CB-CE1 4.07Å; N973-N1054 PolarHBondContact O-ND2 2.92Å
974	P	89	Confident	90	Very high	47 Å²	47	36.8 Å²	36.8	31%	0.305	19%	0.185	S	C	.	.	S	Bend	cis	-72.3	152.3	8	30.8	-36.2	0	0	0	113.4	A972 I976 N1054	A972-P974 WeakPolarHBondContact CB-O 3.21Å; P974-I976 HydrophobicContact CB-CD1 4.34Å; P974-I976 HydrophobicContact CB-CG1 4.34Å; P974-N1054 VanDerWaalsContact O-CB 3.29Å; P974-N1054 WeakPolarHBondContact O-CB 3.1Å; P974-N1054 PolarHBondContact O-ND2 2.85Å
975	A	88.3	Confident	89.9	Confident	12 Å²	12	39.3 Å²	39.3	10%	0.099	19%	0.194	C	C	.	.			trans	-111.2	98.3	177.2	0	0	0	0	0	110	A972 K1028 I1031	A972-A975 WeakPolarHBondContact O-CB 3.41Å; A975-K1028 WeakPolarHBondContact CB-O 3.37Å; A975-I1031 HydrophobicContact CB-CG2 3.63Å
976	I	87.1	Confident	89.6	Confident	80 Å²	80	41.1 Å²	41.1	41%	0.41	19%	0.193	S	C	.	.			trans	-130.2	87.8	-176.4	-53.5	179	0	0	0	108.8	P974 D978 R979 T980	P974-I976 HydrophobicContact CB-CD1 4.34Å; P974-I976 HydrophobicContact CB-CG1 4.34Å; I976-D978 VanDerWaalsContact C-N 3.35Å; I976-D978 PolarHBondContact O-N 2.7Å; I976-R979 HydrophobicContact CG2-CB 4.13Å; I976-R979 HydrophobicContact CG2-CG 4.1Å; I976-R979 PolarHBondContact O-N 2.69Å; I976-T980 WeakPolarHBondContact O-CB 3.37Å; I976-T980 PolarHBondContact O-N 3.48Å; I976-T980 VanDerWaalsContact O-N 3.16Å; I976-T980 PolarHBondContact O-OG1 3.32Å
977	P	83.4	Confident	88.8	Confident	14 Å²	14	44 Å²	44	9%	0.091	21%	0.206	C	C	.	.	H	α-helix	trans	-50.6	-49.2	-168.5	-23.9	27.4	0	0	0	113.9	R979 T980 F981 C1009 C1023 Q1025 I1031	P977-R979 PolarHBondContact O-N 2.73Å; P977-T980 PolarHBondContact O-N 2.71Å; P977-F981 PolarHBondContact O-N 2.72Å; P977-C1009 PolarHBondContact O-SG 3.28Å; P977-C1023 HydrophobicContact CB-CB 3.96Å; P977-Q1025 HydrophobicContact CG-CB 3.82Å; P977-I1031 HydrophobicContact CG-CB 4.07Å; P977-I1031 HydrophobicContact CG-CG2 3.72Å
978	D	82.2	Confident	87.5	Confident	94 Å²	94	42 Å²	42	50%	0.503	20%	0.197	S	C	.	.	H	α-helix	trans	-63.9	-12.6	-176.6	-73	-39.8	0	0	0	115.2	I976 C1009 N1010	I976-D978 VanDerWaalsContact C-N 3.35Å; I976-D978 PolarHBondContact O-N 2.7Å; D978-C1009 HydrophobicContact CB-CB 4.38Å; D978-C1009 WeakPolarHBondContact OD1-CB 3.39Å; D978-N1010 PolarHBondContact OD1-ND2 3.27Å
979	R	80.8	Confident	85.8	Confident	211 Å²	211	42.8 Å²	42.8	80%	0.796	20%	0.202	S	C	*	.	H	α-helix	trans	-115	-5.8	176.2	-64.6	-170.6	-178.5	-167.1	0.7	113.5	I976 P977	I976-R979 HydrophobicContact CG2-CB 4.13Å; I976-R979 HydrophobicContact CG2-CG 4.1Å; I976-R979 PolarHBondContact O-N 2.69Å; P977-R979 PolarHBondContact O-N 2.73Å
980	T	87.3	Confident	83.6	Confident	6 Å²	6	47.9 Å²	47.9	4%	0.037	22%	0.224	C	C	.	.	H	α-helix	trans	-111.3	-21.3	-168.4	-70.4	0	0	0	0	113.9	I976 P977 I1031 V1052 S1053 N1054	I976-T980 WeakPolarHBondContact O-CB 3.37Å; I976-T980 PolarHBondContact O-N 3.48Å; I976-T980 VanDerWaalsContact O-N 3.16Å; I976-T980 PolarHBondContact O-OG1 3.32Å; P977-T980 PolarHBondContact O-N 2.71Å; T980-I1031 HydrophobicContact CG2-CD1 3.37Å; T980-V1052 HydrophobicContact CG2-CG1 3.53Å; T980-V1052 VanDerWaalsContact O-CA 3.25Å; T980-V1052 WeakPolarHBondContact O-CA 3.49Å; T980-S1053 VanDerWaalsContact CA-O 3.23Å; T980-S1053 WeakPolarHBondContact CA-O 3.05Å; T980-S1053 WeakPolarHBondContact CB-O 3.25Å; T980-S1053 WeakPolarHBondContact CG2-O 3.28Å; T980-S1053 PolarHBondContact O-N 2.7Å; T980-S1053 PolarHBondContact OG1-O 3.08Å; T980-S1053 VanDerWaalsContact OG1-O 3.09Å; T980-N1054 HydrophobicContact CG2-CB 4.42Å
981	F	92.4	Very high	81.4	Confident	1 Å²	1	50.2 Å²	50.2	0%	0.004	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	127	173.3	-65.8	-76.1	0	0	0	112.7	C968 A970 P977 I1031 V1052	C968-F981 HydrophobicContact CB-CE1 4.31Å; A970-F981 HydrophobicContact CB-CE1 4.29Å; A970-F981 HydrophobicContact CB-CZ 4.1Å; P977-F981 PolarHBondContact O-N 2.72Å; F981-I1031 HydrophobicContact CE2-CB 3.91Å; F981-I1031 HydrophobicContact CE2-CD1 3.78Å; F981-I1031 HydrophobicContact CE2-CG1 3.73Å; F981-I1031 HydrophobicContact CZ-CB 4.36Å; F981-I1031 HydrophobicContact CZ-CD1 4.1Å; F981-I1031 HydrophobicContact CZ-CG1 3.84Å; F981-V1052 HydrophobicContact CD1-CG1 4.23Å; F981-V1052 HydrophobicContact CD1-CG2 3.88Å; F981-V1052 HydrophobicContact CE1-CG1 3.96Å; F981-V1052 HydrophobicContact CE1-CG2 3.75Å; F981-V1052 HydrophobicContact CZ-CG1 4.49Å
982	T	91.9	Very high	79.3	Confident	20 Å²	20	51.6 Å²	51.6	12%	0.123	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	127.9	170.5	-50.9	0	0	0	0	109.4	Y984 P1006 Y1008 E1051	T982-Y984 HydrophobicContact CG2-CD2 4.38Å; T982-Y984 HydrophobicContact CG2-CE1 4.22Å; T982-Y984 HydrophobicContact CG2-CE2 3.64Å; T982-P1006 HydrophobicContact CG2-CB 3.44Å; T982-P1006 VanDerWaalsContact CG2-CB 3.44Å; T982-Y1008 HydrophobicContact CG2-CD1 4.14Å; T982-Y1008 HydrophobicContact CG2-CE1 3.82Å; T982-E1051 PolarHBondContact N-O 3.01Å; T982-E1051 PolarHBondContact O-N 2.95Å
983	W	92.4	Very high	77.6	Confident	1 Å²	1	54 Å²	54	0%	0.004	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	139.8	178.1	-71.2	87	0	0	0	112	L966 C968 I1007 S1033 F1035 V1049 C1050 F1064	L966-W983 HydrophobicContact CB-CH2 3.66Å; L966-W983 HydrophobicContact CB-CZ3 3.8Å; L966-W983 HydrophobicContact CD1-CZ3 3.89Å; L966-W983 HydrophobicContact CG-CZ3 4.5Å; L966-W983 WeakPolarHBondContact O-CH2 3.3Å; C968-W983 HydrophobicContact CB-CH2 3.88Å; C968-W983 HydrophobicContact CB-CZ2 3.57Å; W983-I1007 HydrophobicContact CB-CB 4.25Å; W983-I1007 PolarHBondContact N-O 3.12Å; W983-I1007 PolarHBondContact O-N 2.97Å; W983-S1033 PolarHBondContact NE1-OG 2.89Å; W983-F1035 HydrophobicContact CB-CD2 4.05Å; W983-F1035 HydrophobicContact CB-CE2 4.2Å; W983-F1035 HydrophobicContact CD2-CB 3.63Å; W983-F1035 HydrophobicContact CD2-CD2 4.13Å; W983-F1035 AromaticContact CD2-CG 3.97Å; W983-F1035 HydrophobicContact CD2-CG 3.97Å; W983-F1035 HydrophobicContact CE3-CB 3.74Å; W983-F1035 HydrophobicContact CE3-CD1 4.36Å; W983-F1035 AromaticContact CE3-CG 4Å; W983-F1035 HydrophobicContact CE3-CG 4Å; W983-F1035 HydrophobicContact CG-CB 4.25Å; W983-F1035 AromaticContact CG-CD2 3.92Å; W983-F1035 HydrophobicContact CG-CD2 3.92Å; W983-F1035 HydrophobicContact CG-CG 4.25Å; W983-F1035 HydrophobicContact CH2-CB 3.78Å; W983-F1035 HydrophobicContact CZ2-CB 3.69Å; W983-F1035 HydrophobicContact CZ3-CB 3.81Å; W983-F1035 HydrophobicContact CZ3-CG 4.43Å; W983-V1049 CarbonylContact C-O 3.55Å; W983-V1049 WeakPolarHBondContact CA-O 3.49Å; W983-C1050 HydrophobicContact CD2-CB 4.07Å; W983-C1050 HydrophobicContact CE3-CB 3.92Å; W983-C1050 HydrophobicContact CH2-CB 3.81Å; W983-C1050 HydrophobicContact CZ2-CB 3.93Å; W983-C1050 HydrophobicContact CZ3-CB 3.79Å; W983-F1064 HydrophobicContact CH2-CD2 4.14Å; W983-F1064 AromaticContact CH2-CE2 3.43Å; W983-F1064 HydrophobicContact CH2-CE2 3.43Å; W983-F1064 VanDerWaalsContact CH2-CE2 3.43Å; W983-F1064 AromaticContact CH2-CZ 3.73Å; W983-F1064 HydrophobicContact CH2-CZ 3.73Å; W983-F1064 AromaticContact CZ3-CD2 3.68Å; W983-F1064 HydrophobicContact CZ3-CD2 3.68Å; W983-F1064 AromaticContact CZ3-CE2 3.41Å; W983-F1064 HydrophobicContact CZ3-CE2 3.41Å; W983-F1064 VanDerWaalsContact CZ3-CE2 3.41Å; W983-F1064 HydrophobicContact CZ3-CZ 4.14Å
984	Y	92	Very high	76.1	Confident	40 Å²	40	57.2 Å²	57.2	16%	0.157	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	156.7	176.6	-54.4	-94	0	0	0	110.8	T982 L1003 P1006 Y1048 V1049 E1051	T982-Y984 HydrophobicContact CG2-CD2 4.38Å; T982-Y984 HydrophobicContact CG2-CE1 4.22Å; T982-Y984 HydrophobicContact CG2-CE2 3.64Å; Y984-L1003 HydrophobicContact CD1-CB 4.29Å; Y984-L1003 HydrophobicContact CG-CD2 4.14Å; Y984-P1006 HydrophobicContact CD1-CB 4.33Å; Y984-P1006 HydrophobicContact CE1-CB 3.75Å; Y984-Y1048 CarbonylContact O-C 3.46Å; Y984-Y1048 WeakPolarHBondContact O-CA 3.24Å; Y984-V1049 PolarHBondContact N-O 2.7Å; Y984-V1049 PolarHBondContact O-N 3.39Å; Y984-E1051 HydrophobicContact CD2-CB 4.28Å; Y984-E1051 HydrophobicContact CE2-CB 3.72Å; Y984-E1051 HydrophobicContact CE2-CG 4.38Å; Y984-E1051 VanDerWaalsContact CE2-OE1 3.32Å; Y984-E1051 WeakPolarHBondContact CE2-OE1 3.44Å; Y984-E1051 PolarHBondContact OH-OE1 2.95Å
985	R	88.4	Confident	74.7	Confident	57 Å²	57	55.5 Å²	55.5	22%	0.215	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	136.7	170.5	176.4	-175.5	162.3	157.9	-1.3	109.7	S1004 D1043 D1044 Y1048	R985-S1004 PolarHBondContact N-OG 3.47Å; R985-S1004 WeakPolarHBondContact O-CB 3.45Å; R985-S1004 PolarHBondContact O-N 3.44Å; R985-D1043 VanDerWaalsContact CZ-O 3.26Å; R985-D1043 PolarHBondContact NH1-O 3.33Å; R985-D1043 PolarHBondContact NH2-O 2.85Å; R985-D1044 IonicContact NH1-OD1 2.78Å; R985-Y1048 HydrophobicContact CB-CD1 3.79Å; R985-Y1048 HydrophobicContact CB-CE1 3.75Å; R985-Y1048 HydrophobicContact CG-CD1 3.96Å; R985-Y1048 HydrophobicContact CG-CE1 3.57Å; R985-Y1048 PolarHBondContact NH1-OH 2.59Å
986	Y	84.5	Confident	73.1	Confident	74 Å²	74	55.6 Å²	55.6	29%	0.29	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	133.4	168.2	-75.4	-77.1	0	0	0	111.6	L1001 Q1002 L1003 K1047 V1049	Y986-L1001 HydrophobicContact CD1-CB 3.97Å; Y986-L1001 HydrophobicContact CG-CB 4.49Å; Y986-Q1002 CarbonylContact C-O 3.41Å; Y986-Q1002 WeakPolarHBondContact CA-O 3.48Å; Y986-L1003 HydrophobicContact CD1-CD2 4.26Å; Y986-L1003 HydrophobicContact CD1-CG 4.42Å; Y986-L1003 HydrophobicContact CE1-CD2 3.84Å; Y986-L1003 HydrophobicContact CE1-CG 3.95Å; Y986-L1003 HydrophobicContact CE2-CD2 4.23Å; Y986-K1047 HydrophobicContact CD2-CB 3.88Å; Y986-K1047 HydrophobicContact CD2-CD 3.99Å; Y986-K1047 HydrophobicContact CD2-CG 3.74Å; Y986-K1047 HydrophobicContact CE2-CD 4.02Å; Y986-K1047 HydrophobicContact CE2-CG 4.08Å; Y986-K1047 PolarHBondContact N-O 2.9Å; Y986-V1049 HydrophobicContact CD2-CG2 4.11Å; Y986-V1049 HydrophobicContact CE2-CG2 3.45Å; Y986-V1049 VanDerWaalsContact CE2-CG2 3.45Å
987	F	76.8	Confident	71.7	Confident	61 Å²	61	54.5 Å²	54.5	27%	0.268	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	152.4	178.8	79.4	-74.1	0	0	0	111.9	Q1002 L1003	F987-Q1002 HydrophobicContact CD1-CB 4.44Å; F987-Q1002 WeakPolarHBondContact CD1-O 3.36Å; F987-Q1002 HydrophobicContact CE1-CB 3.92Å; F987-Q1002 HydrophobicContact CZ-CB 4.25Å; F987-Q1002 PolarHBondContact N-O 2.84Å; F987-Q1002 PolarHBondContact O-N 2.85Å; F987-L1003 WeakPolarHBondContact CE1-O 3.48Å
988	P	64.5	Low	70.3	Confident	41 Å²	41	57.1 Å²	57.1	27%	0.266	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-74.8	147.6	176.2	30.3	-34.4	0	0	0	111.7	V996 L1001	P988-V996 HydrophobicContact CB-CB 4.26Å; P988-V996 HydrophobicContact CB-CG2 4.14Å; P988-L1001 HydrophobicContact CB-CD2 4.23Å
989	P	58.8	Low	68.7	Low	16 Å²	16	56.9 Å²	56.9	10%	0.104	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-63.5	147.4	-174.9	-19.3	30.8	0	0	0	113.7	G991 W992 Q1002	P989-G991 PolarHBondContact O-N 3.34Å; P989-W992 HydrophobicContact CB-CG 4.25Å; P989-W992 WeakPolarHBondContact O-CB 3.34Å; P989-W992 PolarHBondContact O-N 2.87Å; P989-W992 VanDerWaalsContact O-N 3.13Å; P989-Q1002 HydrophobicContact CG-CG 4.15Å
990	K	49.7	Very low	67.4	Low	192 Å²	192	47.8 Å²	47.8	84%	0.835	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	121.7	-178.1	-77.5	173.9	179	161.7	0	111.8
991	G	45.7	Very low	66.3	Low	51 Å²	51	48.6 Å²	48.6	53%	0.526	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.8	1	178.4	0	0	0	0	0	115.4	P989 R1193	P989-G991 PolarHBondContact O-N 3.34Å; G991-R1193 PolarHBondContact O-NH2 3.17Å
992	W	48.4	Very low	65.2	Low	53 Å²	53	53.4 Å²	53.4	20%	0.201	29%	0.291	C	S	.	.			trans	-92.7	157.2	172.9	-68.2	67.3	0	0	0	111.1	P989 V996 R1242 E1246	P989-W992 HydrophobicContact CB-CG 4.25Å; P989-W992 WeakPolarHBondContact O-CB 3.34Å; P989-W992 PolarHBondContact O-N 2.87Å; P989-W992 VanDerWaalsContact O-N 3.13Å; W992-V996 HydrophobicContact CB-CG2 4.3Å; W992-R1242 HydrophobicContact CH2-CB 4.31Å; W992-R1242 HydrophobicContact CH2-CG 4.26Å; W992-R1242 HydrophobicContact CZ3-CB 3.78Å; W992-R1242 HydrophobicContact CZ3-CG 3.7Å; W992-E1246 WeakPolarHBondContact CZ2-OE1 3.45Å
993	T	55.5	Low	64.5	Low	50 Å²	50	56 Å²	56	31%	0.307	30%	0.304	S	S	.	.			trans	-79.1	168.2	175.2	48.8	0	0	0	0	111.2	E995 V996	T993-E995 VanDerWaalsContact C-N 3.27Å; T993-E995 WeakPolarHBondContact CB-OE1 3.45Å; T993-E995 WeakPolarHBondContact CB-OE2 3.41Å; T993-E995 PolarHBondContact O-N 2.94Å; T993-E995 PolarHBondContact OG1-OE2 3.32Å; T993-V996 WeakPolarHBondContact O-CG2 3.09Å
994	E	58.5	Low	63.9	Low	80 Å²	80	57.3 Å²	57.3	37%	0.374	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-9.1	-167.1	-59	-169.7	158.4	0	0	114.5	V996 I1075 R1098 R1142	E994-V996 PolarHBondContact O-N 3.24Å; E994-I1075 HydrophobicContact CB-CD1 4.16Å; E994-R1098 IonicContact OE1-NH1 3Å; E994-R1098 PolarHBondContact OE1-NH1 2.61Å; E994-R1098 WeakPolarHBondContact OE2-CD 3.5Å; E994-R1098 IonicContact OE2-CZ 3.33Å; E994-R1098 IonicContact OE2-NE 3.92Å; E994-R1098 IonicContact OE2-NH1 3.9Å; E994-R1098 PolarHBondContact OE2-NH1 3.35Å; E994-R1142 PolarHBondContact O-NH2 3.3Å
995	E	60.2	Low	63.3	Low	11 Å²	11	63.2 Å²	63.2	5%	0.051	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	10.1	-173	-39.4	85.8	-147.7	0	0	115	T993 D997 I1075 L1077 Y1096 N1243	T993-E995 VanDerWaalsContact C-N 3.27Å; T993-E995 WeakPolarHBondContact CB-OE1 3.45Å; T993-E995 WeakPolarHBondContact CB-OE2 3.41Å; T993-E995 PolarHBondContact O-N 2.94Å; T993-E995 PolarHBondContact OG1-OE2 3.32Å; E995-D997 PolarHBondContact O-N 3.24Å; E995-I1075 HydrophobicContact CG-CD1 3.96Å; E995-I1075 HydrophobicContact CG-CG2 4.47Å; E995-I1075 VanDerWaalsContact OE1-CG2 3.23Å; E995-I1075 WeakPolarHBondContact OE1-CG2 3.42Å; E995-L1077 VanDerWaalsContact CD-CD1 3.49Å; E995-L1077 HydrophobicContact CG-CD1 3.72Å; E995-L1077 HydrophobicContact CG-CG 4.45Å; E995-Y1096 HydrophobicContact CB-CD1 3.64Å; E995-Y1096 HydrophobicContact CB-CE1 3.74Å; E995-Y1096 HydrophobicContact CB-CG 4.07Å; E995-Y1096 HydrophobicContact CG-CD1 3.98Å; E995-Y1096 HydrophobicContact CG-CD2 4.38Å; E995-Y1096 HydrophobicContact CG-CE1 4.46Å; E995-Y1096 HydrophobicContact CG-CG 3.9Å; E995-N1243 PolarHBondContact OE2-ND2 2.55Å
996	V	55.4	Low	63.1	Low	14 Å²	14	62.4 Å²	62.4	9%	0.085	35%	0.345	C	S	.	.			trans	-62.3	119.6	-177	180	0	0	0	0	110.8	P988 W992 T993 E994 A1000 L1001 R1142	P988-V996 HydrophobicContact CB-CB 4.26Å; P988-V996 HydrophobicContact CB-CG2 4.14Å; W992-V996 HydrophobicContact CB-CG2 4.3Å; T993-V996 WeakPolarHBondContact O-CG2 3.09Å; E994-V996 PolarHBondContact O-N 3.24Å; V996-A1000 HydrophobicContact CG1-CB 3.47Å; V996-A1000 VanDerWaalsContact CG1-CB 3.47Å; V996-L1001 HydrophobicContact CB-CD2 4.42Å; V996-L1001 HydrophobicContact CG1-CD2 4.26Å; V996-R1142 PolarHBondContact O-NE 3.11Å
997	D	56.7	Low	63.2	Low	58 Å²	58	60.7 Å²	60.7	31%	0.31	34%	0.34	S	S	.	.			trans	-61.1	153.4	172.4	-72.7	-42.8	0	0	0	111.5	E995 G999 A1000 I1141	E995-D997 PolarHBondContact O-N 3.24Å; D997-G999 VanDerWaalsContact C-N 3.26Å; D997-G999 PolarHBondContact O-N 3.23Å; D997-G999 VanDerWaalsContact O-N 3.07Å; D997-A1000 PolarHBondContact O-N 2.79Å; D997-I1141 HydrophobicContact CB-CG2 4.5Å; D997-I1141 WeakPolarHBondContact OD1-CG2 3.41Å
998	E	54.4	Low	63.6	Low	68 Å²	68	62.3 Å²	62.3	32%	0.318	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-53.1	-38.7	-170.2	-70.7	-154.1	139.2	0	0	114.5	A1000 L1001 K1047 R1142	E998-A1000 PolarHBondContact O-N 3.18Å; E998-L1001 HydrophobicContact CB-CD1 4.4Å; E998-L1001 HydrophobicContact CG-CD1 4.27Å; E998-L1001 WeakPolarHBondContact O-CB 3.37Å; E998-L1001 PolarHBondContact O-N 2.83Å; E998-L1001 VanDerWaalsContact O-N 3.08Å; E998-K1047 VanDerWaalsContact OE1-CE 3.29Å; E998-K1047 WeakPolarHBondContact OE1-CE 3.37Å; E998-K1047 IonicContact OE1-NZ 3.61Å; E998-K1047 PolarHBondContact OE1-NZ 2.93Å; E998-K1047 IonicContact OE2-NZ 2.7Å; E998-K1047 PolarHBondContact OE2-NZ 2.75Å; E998-R1142 HydrophobicContact CG-CB 3.77Å
999	G	48	Very low	64.5	Low	89 Å²	89	60.9 Å²	60.9	92%	0.918	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-66	-1	179.5	0	0	0	0	0	115.7	D997	D997-G999 VanDerWaalsContact C-N 3.26Å; D997-G999 PolarHBondContact O-N 3.23Å; D997-G999 VanDerWaalsContact O-N 3.07Å
1000	A	54	Low	64.9	Low	21 Å²	21	64.3 Å²	64.3	17%	0.174	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-124.6	9.2	174.2	0	0	0	0	0	113.5	V996 D997 E998	V996-A1000 HydrophobicContact CG1-CB 3.47Å; V996-A1000 VanDerWaalsContact CG1-CB 3.47Å; D997-A1000 PolarHBondContact O-N 2.79Å; E998-A1000 PolarHBondContact O-N 3.18Å
1001	L	65.1	Low	65.3	Low	23 Å²	23	60.9 Å²	60.9	12%	0.12	34%	0.34	C	S	.	.			trans	-73.8	150.5	166.5	-59.7	174.3	0	0	0	110.5	Y986 P988 V996 E998	Y986-L1001 HydrophobicContact CD1-CB 3.97Å; Y986-L1001 HydrophobicContact CG-CB 4.49Å; P988-L1001 HydrophobicContact CB-CD2 4.23Å; V996-L1001 HydrophobicContact CB-CD2 4.42Å; V996-L1001 HydrophobicContact CG1-CD2 4.26Å; E998-L1001 HydrophobicContact CB-CD1 4.4Å; E998-L1001 HydrophobicContact CG-CD1 4.27Å; E998-L1001 WeakPolarHBondContact O-CB 3.37Å; E998-L1001 PolarHBondContact O-N 2.83Å; E998-L1001 VanDerWaalsContact O-N 3.08Å
1002	Q	68.5	Low	65.5	Low	101 Å²	101	62 Å²	62	47%	0.472	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	151.5	176.4	-70.1	176.9	-25.9	0	0	110.3	Y986 F987 P989	Y986-Q1002 CarbonylContact C-O 3.41Å; Y986-Q1002 WeakPolarHBondContact CA-O 3.48Å; F987-Q1002 HydrophobicContact CD1-CB 4.44Å; F987-Q1002 WeakPolarHBondContact CD1-O 3.36Å; F987-Q1002 HydrophobicContact CE1-CB 3.92Å; F987-Q1002 HydrophobicContact CZ-CB 4.25Å; F987-Q1002 PolarHBondContact N-O 2.84Å; F987-Q1002 PolarHBondContact O-N 2.85Å; P989-Q1002 HydrophobicContact CG-CG 4.15Å
1003	L	76	Confident	65.1	Low	76 Å²	76	67.4 Å²	67.4	40%	0.398	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	135.7	170.2	-71.6	158	0	0	0	109.2	Y984 Y986 F987 V1049	Y984-L1003 HydrophobicContact CD1-CB 4.29Å; Y984-L1003 HydrophobicContact CG-CD2 4.14Å; Y986-L1003 HydrophobicContact CD1-CD2 4.26Å; Y986-L1003 HydrophobicContact CD1-CG 4.42Å; Y986-L1003 HydrophobicContact CE1-CD2 3.84Å; Y986-L1003 HydrophobicContact CE1-CG 3.95Å; Y986-L1003 HydrophobicContact CE2-CD2 4.23Å; F987-L1003 WeakPolarHBondContact CE1-O 3.48Å; L1003-V1049 HydrophobicContact CD2-CG2 4.44Å
1004	S	81.2	Confident	64.5	Low	27 Å²	27	71.8 Å²	71.8	19%	0.189	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-60.2	169	175.8	67.5	0	0	0	0	112.7	R985	R985-S1004 PolarHBondContact N-OG 3.47Å; R985-S1004 WeakPolarHBondContact O-CB 3.45Å; R985-S1004 PolarHBondContact O-N 3.44Å
1005	E	78.4	Confident	63.8	Low	165 Å²	165	73 Å²	73	77%	0.771	40%	0.397	S	S	*	.	S	Bend	trans	-50.5	140.2	156.7	-69.4	165.8	-147	0	0	109.6
1006	P	85.7	Confident	63.4	Low	40 Å²	40	81.9 Å²	81.9	26%	0.26	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-69.3	136.4	-175.5	25.2	-33.5	0	0	0	112.2	T982 Y984 Y1008	T982-P1006 HydrophobicContact CG2-CB 3.44Å; T982-P1006 VanDerWaalsContact CG2-CB 3.44Å; Y984-P1006 HydrophobicContact CD1-CB 4.33Å; Y984-P1006 HydrophobicContact CE1-CB 3.75Å; P1006-Y1008 HydrophobicContact CB-CE1 4.28Å; P1006-Y1008 HydrophobicContact CB-CE2 3.88Å; P1006-Y1008 HydrophobicContact CG-CE2 3.72Å; P1006-Y1008 VanDerWaalsContact CG-OH 3.28Å; P1006-Y1008 WeakPolarHBondContact CG-OH 3.31Å
1007	I	86.2	Confident	63.9	Low	38 Å²	38	82.4 Å²	82.4	20%	0.195	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	108.6	177.9	-46.9	170.3	0	0	0	108.8	W983 M1019 F1035	W983-I1007 HydrophobicContact CB-CB 4.25Å; W983-I1007 PolarHBondContact N-O 3.12Å; W983-I1007 PolarHBondContact O-N 2.97Å; I1007-M1019 HydrophobicContact CD1-SD 4.38Å; I1007-F1035 HydrophobicContact CB-CE2 4.29Å; I1007-F1035 HydrophobicContact CD1-CE2 3.72Å; I1007-F1035 HydrophobicContact CD1-CZ 3.65Å; I1007-F1035 HydrophobicContact CG2-CE2 4.05Å
1008	Y	84.8	Confident	65.1	Low	94 Å²	94	83.7 Å²	83.7	37%	0.369	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	157.9	-175.4	-58.7	-78.8	0	0	0	113.2	T982 P1006 N1010 Q1011	T982-Y1008 HydrophobicContact CG2-CD1 4.14Å; T982-Y1008 HydrophobicContact CG2-CE1 3.82Å; P1006-Y1008 HydrophobicContact CB-CE1 4.28Å; P1006-Y1008 HydrophobicContact CB-CE2 3.88Å; P1006-Y1008 HydrophobicContact CG-CE2 3.72Å; P1006-Y1008 VanDerWaalsContact CG-OH 3.28Å; P1006-Y1008 WeakPolarHBondContact CG-OH 3.31Å; Y1008-N1010 PolarHBondContact O-N 3.37Å; Y1008-Q1011 PolarHBondContact O-N 2.8Å
1009	C	82.4	Confident	66.6	Low	11 Å²	11	82.3 Å²	82.3	7%	0.074	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-42	134	169.4	-65.4	0	0	0	0	113.4	P977 D978 Q1011 C1023	P977-C1009 PolarHBondContact O-SG 3.28Å; D978-C1009 HydrophobicContact CB-CB 4.38Å; D978-C1009 WeakPolarHBondContact OD1-CB 3.39Å; C1009-Q1011 PolarHBondContact O-N 2.89Å; C1009-C1023 VanDerWaalsContact CA-SG 3.51Å; C1009-C1023 HydrophobicContact CB-CB 3.66Å; C1009-C1023 WeakPolarHBondContact CB-SG 3.41Å; C1009-C1023 WeakPolarHBondContact SG-CB 3.19Å; C1009-C1023 CovalentContact SG-SG 2.02Å; C1009-C1023 PolarHBondContact SG-SG 2.98Å
1010	N	68.6	Low	68.4	Low	89 Å²	89	79.1 Å²	79.1	48%	0.476	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.1	2.9	169.7	-66.2	-52.6	0	0	0	116.1	D978 Y1008 S1012 A1021	D978-N1010 PolarHBondContact OD1-ND2 3.27Å; Y1008-N1010 PolarHBondContact O-N 3.37Å; N1010-S1012 PolarHBondContact O-N 3.34Å; N1010-A1021 PolarHBondContact N-O 3.46Å
1011	Q	58.4	Low	70	Confident	120 Å²	120	78.1 Å²	78.1	56%	0.561	39%	0.389	S	S	*	.			trans	-73.8	112.2	169.5	-67.4	-166.6	7.2	0	0	110.4	Y1008 C1009	Y1008-Q1011 PolarHBondContact O-N 2.8Å; C1009-Q1011 PolarHBondContact O-N 2.89Å
1012	S	49.8	Very low	71.1	Confident	75 Å²	75	80 Å²	80	52%	0.524	40%	0.397	S	S	.	.			trans	-126.9	115.1	174.7	48.6	0	0	0	0	110.7	N1010	N1010-S1012 PolarHBondContact O-N 3.34Å
1013	Q	38.2	Very low	72.2	Confident	166 Å²	166	75.8 Å²	75.8	78%	0.776	38%	0.379	S	S	*	.			trans	-88.2	107.3	170.4	-70.6	-158	14.2	0	0	110.7
1014	I	43.3	Very low	72.8	Confident	142 Å²	142	76.5 Å²	76.5	73%	0.728	38%	0.379	S	S	*	.	S	Bend	trans	70.7	166.5	165.1	-54.5	168.2	0	0	0	113.3	K1016 P1017	I1014-K1016 PolarHBondContact O-N 2.83Å; I1014-P1017 WeakPolarHBondContact O-CD 3.27Å
1015	D	44	Very low	73	Confident	106 Å²	106	80.2 Å²	80.2	57%	0.567	39%	0.394	S	S	*	.	S	Bend	trans	-52.1	105.4	-175.4	-70.9	-44.3	0	0	0	112.8	M1	M1-D1015 VanDerWaalsContact CE-OD2 3.25Å; M1-D1015 WeakPolarHBondContact CE-OD2 3.3Å
1016	K	52.8	Low	73.2	Confident	196 Å²	196	77.1 Å²	77.1	85%	0.852	38%	0.379	S	S	*	.	S	Bend	trans	58.6	82.6	-173.5	-62.7	-171.2	177.1	-171.7	0	113.2	I1014	I1014-K1016 PolarHBondContact O-N 2.83Å
1017	P	65.6	Low	73.1	Confident	26 Å²	26	80.1 Å²	80.1	17%	0.169	39%	0.393	C	S	.	.			trans	-64.4	150.7	167.7	31.9	-36.2	0	0	0	109.9	I1014 M1019 L1020 Y1038	I1014-P1017 WeakPolarHBondContact O-CD 3.27Å; P1017-M1019 WeakPolarHBondContact CB-O 3.34Å; P1017-M1019 WeakPolarHBondContact CG-O 3.31Å; P1017-M1019 PolarHBondContact O-N 2.82Å; P1017-L1020 HydrophobicContact CG-CB 4.38Å; P1017-L1020 HydrophobicContact CG-CD1 4.49Å; P1017-Y1038 WeakPolarHBondContact O-CD2 3.2Å
1018	K	82	Confident	73	Confident	84 Å²	84	84.1 Å²	84.1	37%	0.365	41%	0.409	S	S	.	.	S	Bend	trans	-63.5	-28.1	177.8	-158.8	-172.6	-175.9	-166.3	0	112.4	I1037 Y1038 Q1039 T1041 D1044	K1018-I1037 CarbonylContact O-C 3.05Å; K1018-I1037 WeakPolarHBondContact O-CA 3.19Å; K1018-Y1038 WeakPolarHBondContact CE-O 3.43Å; K1018-Y1038 WeakPolarHBondContact CG-O 3.31Å; K1018-Y1038 PolarHBondContact O-N 3.32Å; K1018-Q1039 WeakPolarHBondContact CE-O 3.4Å; K1018-T1041 PolarHBondContact NZ-OG1 2.97Å; K1018-D1044 WeakPolarHBondContact CE-OD1 3.47Å; K1018-D1044 WeakPolarHBondContact CE-OD2 3.38Å; K1018-D1044 IonicContact NZ-OD1 2.68Å; K1018-D1044 PolarHBondContact NZ-OD1 2.87Å; K1018-D1044 IonicContact NZ-OD2 3.74Å; K1018-D1044 PolarHBondContact NZ-OD2 2.8Å
1019	M	85.4	Confident	73.1	Confident	40 Å²	40	81.2 Å²	81.2	20%	0.197	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	141	179.3	-70.5	178.2	169.4	0	0	110.2	I1007 P1017 F1035 Y1036 I1037 Y1048	I1007-M1019 HydrophobicContact CD1-SD 4.38Å; P1017-M1019 WeakPolarHBondContact CB-O 3.34Å; P1017-M1019 WeakPolarHBondContact CG-O 3.31Å; P1017-M1019 PolarHBondContact O-N 2.82Å; M1019-F1035 HydrophobicContact CB-CE1 4.49Å; M1019-F1035 HydrophobicContact CB-CE2 4.09Å; M1019-F1035 HydrophobicContact CB-CZ 3.69Å; M1019-F1035 HydrophobicContact CG-CE1 4.29Å; M1019-F1035 HydrophobicContact CG-CZ 3.86Å; M1019-F1035 HydrophobicContact SD-CE1 4.28Å; M1019-F1035 HydrophobicContact SD-CZ 3.81Å; M1019-Y1036 CarbonylContact C-O 3.54Å; M1019-Y1036 VanDerWaalsContact CA-O 3.31Å; M1019-Y1036 WeakPolarHBondContact CA-O 3.45Å; M1019-I1037 HydrophobicContact CE-CD1 4.42Å; M1019-I1037 HydrophobicContact CE-CG1 4.21Å; M1019-I1037 HydrophobicContact CE-CG2 3.9Å; M1019-I1037 HydrophobicContact CG-CG1 4.23Å; M1019-I1037 HydrophobicContact CG-CG2 4.29Å; M1019-Y1048 HydrophobicContact CE-CE1 3.73Å; M1019-Y1048 WeakPolarHBondContact CE-OH 3.38Å
1020	L	85.8	Confident	73.5	Confident	22 Å²	22	84.8 Å²	84.8	12%	0.115	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	116.1	-175.7	177.9	64.5	0	0	0	111.6	P1017 Q1022 F1035 Y1036 Y1038	P1017-L1020 HydrophobicContact CG-CB 4.38Å; P1017-L1020 HydrophobicContact CG-CD1 4.49Å; L1020-Q1022 HydrophobicContact CD2-CG 4.15Å; L1020-Q1022 HydrophobicContact CG-CG 4.12Å; L1020-F1035 WeakPolarHBondContact O-CA 3.44Å; L1020-Y1036 PolarHBondContact N-O 2.85Å; L1020-Y1036 PolarHBondContact O-N 3.19Å; L1020-Y1038 HydrophobicContact CB-CE2 4.28Å; L1020-Y1038 HydrophobicContact CD2-CE2 4.44Å
1021	A	88.3	Confident	74.6	Confident	0 Å²	0	80.6 Å²	80.6	0%	0	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	119	166.4	0	0	0	0	0	110.3	N1010 F1035	N1010-A1021 PolarHBondContact N-O 3.46Å; A1021-F1035 HydrophobicContact CB-CD2 4.11Å
1022	Q	88.3	Confident	76.3	Confident	61 Å²	61	75.1 Å²	75.1	29%	0.285	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	147.6	165.4	-63.1	-170.7	-20.6	0	0	109.2	L1020 F1024 S1033 T1034 Y1036	L1020-Q1022 HydrophobicContact CD2-CG 4.15Å; L1020-Q1022 HydrophobicContact CG-CG 4.12Å; Q1022-F1024 HydrophobicContact CB-CE2 3.84Å; Q1022-F1024 HydrophobicContact CB-CZ 3.65Å; Q1022-S1033 CarbonylContact O-C 3.58Å; Q1022-S1033 WeakPolarHBondContact O-CA 3.01Å; Q1022-S1033 WeakPolarHBondContact O-CB 3.42Å; Q1022-S1033 PolarHBondContact O-OG 2.72Å; Q1022-T1034 PolarHBondContact N-O 2.85Å; Q1022-T1034 PolarHBondContact O-N 3.2Å; Q1022-Y1036 HydrophobicContact CB-CE2 4.42Å; Q1022-Y1036 HydrophobicContact CG-CD2 4.31Å; Q1022-Y1036 HydrophobicContact CG-CE2 4.12Å
1023	C	90.8	Very high	78.4	Confident	14 Å²	14	71.6 Å²	71.6	10%	0.095	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	138.2	-176	-62	0	0	0	0	110.8	P977 C1009 S1032 S1033	P977-C1023 HydrophobicContact CB-CB 3.96Å; C1009-C1023 VanDerWaalsContact CA-SG 3.51Å; C1009-C1023 HydrophobicContact CB-CB 3.66Å; C1009-C1023 WeakPolarHBondContact CB-SG 3.41Å; C1009-C1023 WeakPolarHBondContact SG-CB 3.19Å; C1009-C1023 CovalentContact SG-SG 2.02Å; C1009-C1023 PolarHBondContact SG-SG 2.98Å; C1023-S1032 CarbonylContact C-O 3.28Å; C1023-S1032 WeakPolarHBondContact CA-O 2.94Å; C1023-S1033 VanDerWaalsContact SG-CB 3.58Å; C1023-S1033 PolarHBondContact SG-OG 3.26Å
1024	F	88.9	Confident	81	Confident	90 Å²	90	64.2 Å²	64.2	40%	0.395	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	137.8	-170.2	-44.7	-85	0	0	0	110.7	Q1022 S1032	Q1022-F1024 HydrophobicContact CB-CE2 3.84Å; Q1022-F1024 HydrophobicContact CB-CZ 3.65Å; F1024-S1032 PolarHBondContact N-O 2.82Å; F1024-S1032 PolarHBondContact O-N 3.35Å; F1024-S1032 PolarHBondContact O-OG 3.34Å
1025	Q	86	Confident	83.3	Confident	106 Å²	106	57.5 Å²	57.5	50%	0.495	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	125.4	165	-173.2	158.3	12.2	0	0	108.6	P977 D1027 K1028 I1031	P977-Q1025 HydrophobicContact CG-CB 3.82Å; Q1025-D1027 WeakPolarHBondContact CG-O 3.46Å; Q1025-D1027 PolarHBondContact NE2-O 3.22Å; Q1025-K1028 PolarHBondContact NE2-O 2.59Å; Q1025-I1031 HydrophobicContact CG-CG2 4.3Å
1026	Q	82.5	Confident	85.5	Confident	100 Å²	100	55 Å²	55	47%	0.467	26%	0.256	S	S	.	.			trans	-96	-33.9	-179.9	-61.4	-169.7	5.8	0	0	111.4	Q1030 S1032	Q1026-Q1030 HydrophobicContact CB-CB 4.4Å; Q1026-Q1030 PolarHBondContact N-O 2.76Å; Q1026-S1032 PolarHBondContact NE2-OG 3.33Å
1027	D	83.9	Confident	87.3	Confident	103 Å²	103	45.6 Å²	45.6	55%	0.551	22%	0.216	S	C	*	.	S	Bend	trans	-150	178.3	176.4	-170	13.4	0	0	0	109.7	Q1025 F1029 Q1030	Q1025-D1027 WeakPolarHBondContact CG-O 3.46Å; Q1025-D1027 PolarHBondContact NE2-O 3.22Å; D1027-F1029 PolarHBondContact O-N 2.94Å; D1027-Q1030 HydrophobicContact CB-CB 4.17Å; D1027-Q1030 PolarHBondContact N-O 2.81Å; D1027-Q1030 VanDerWaalsContact N-O 3.11Å
1028	K	82.5	Confident	88.3	Confident	121 Å²	121	47.7 Å²	47.7	53%	0.526	22%	0.221	S	C	.	.	S	Bend	trans	-51.3	-30.6	177.9	-172.2	175.9	176.7	-178.2	0	113.5	A975 Q1025	A975-K1028 WeakPolarHBondContact CB-O 3.37Å; Q1025-K1028 PolarHBondContact NE2-O 2.59Å
1029	F	88	Confident	88.6	Confident	34 Å²	34	51 Å²	51	15%	0.149	24%	0.238	C	C	.	.	S	Bend	trans	-122.3	-20.7	-180	-50.5	-65	0	0	0	114.6	M920 Y944 D971 A972 N973 D1027	M920-F1029 HydrophobicContact CE-CE1 4.3Å; M920-F1029 HydrophobicContact CE-CE2 3.78Å; M920-F1029 HydrophobicContact CE-CZ 3.47Å; M920-F1029 VanDerWaalsContact CE-CZ 3.47Å; M920-F1029 HydrophobicContact SD-CE1 4.38Å; M920-F1029 HydrophobicContact SD-CZ 3.76Å; Y944-F1029 WeakPolarHBondContact OH-CB 3.23Å; D971-F1029 WeakPolarHBondContact OD1-CB 3.19Å; A972-F1029 PolarHBondContact N-O 3.49Å; A972-F1029 WeakPolarHBondContact O-CA 3.44Å; N973-F1029 HydrophobicContact CB-CD1 3.79Å; N973-F1029 HydrophobicContact CB-CE1 4.07Å; D1027-F1029 PolarHBondContact O-N 2.94Å
1030	Q	90.3	Very high	88.7	Confident	85 Å²	85	49.4 Å²	49.4	40%	0.397	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	130.5	178.2	-67.8	-165.7	2.6	0	0	112.6	A970 Q1026 D1027	A970-Q1030 WeakPolarHBondContact O-CA 3.34Å; Q1026-Q1030 HydrophobicContact CB-CB 4.4Å; Q1026-Q1030 PolarHBondContact N-O 2.76Å; D1027-Q1030 HydrophobicContact CB-CB 4.17Å; D1027-Q1030 PolarHBondContact N-O 2.81Å; D1027-Q1030 VanDerWaalsContact N-O 3.11Å
1031	I	92.9	Very high	88.8	Confident	2 Å²	2	51.1 Å²	51.1	1%	0.01	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	157.4	-175.9	58.8	171.7	0	0	0	110.4	A970 A972 A975 P977 T980 F981 Q1025	A970-I1031 HydrophobicContact CB-CG1 4.15Å; A970-I1031 PolarHBondContact N-O 3.29Å; A970-I1031 WeakPolarHBondContact O-CG1 3.05Å; A970-I1031 PolarHBondContact O-N 3.09Å; A970-I1031 VanDerWaalsContact O-O 3.14Å; A972-I1031 HydrophobicContact CB-CD1 4.4Å; A975-I1031 HydrophobicContact CB-CG2 3.63Å; P977-I1031 HydrophobicContact CG-CB 4.07Å; P977-I1031 HydrophobicContact CG-CG2 3.72Å; T980-I1031 HydrophobicContact CG2-CD1 3.37Å; F981-I1031 HydrophobicContact CE2-CB 3.91Å; F981-I1031 HydrophobicContact CE2-CD1 3.78Å; F981-I1031 HydrophobicContact CE2-CG1 3.73Å; F981-I1031 HydrophobicContact CZ-CB 4.36Å; F981-I1031 HydrophobicContact CZ-CD1 4.1Å; F981-I1031 HydrophobicContact CZ-CG1 3.84Å; Q1025-I1031 HydrophobicContact CG-CG2 4.3Å
1032	S	93.8	Very high	88.7	Confident	5 Å²	5	53.6 Å²	53.6	4%	0.035	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	155.6	-177.2	56.5	0	0	0	0	112.7	C968 C1023 F1024 Q1026	C968-S1032 CarbonylContact O-C 3.58Å; C968-S1032 VanDerWaalsContact O-CA 3.26Å; C968-S1032 WeakPolarHBondContact O-CA 3.49Å; C1023-S1032 CarbonylContact C-O 3.28Å; C1023-S1032 WeakPolarHBondContact CA-O 2.94Å; F1024-S1032 PolarHBondContact N-O 2.82Å; F1024-S1032 PolarHBondContact O-N 3.35Å; F1024-S1032 PolarHBondContact O-OG 3.34Å; Q1026-S1032 PolarHBondContact NE2-OG 3.33Å
1033	S	93.2	Very high	88.5	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	138.6	169.6	-178.8	0	0	0	0	111	C968 W983 Q1022 C1023	C968-S1033 PolarHBondContact N-O 2.75Å; C968-S1033 PolarHBondContact O-N 2.95Å; W983-S1033 PolarHBondContact NE1-OG 2.89Å; Q1022-S1033 CarbonylContact O-C 3.58Å; Q1022-S1033 WeakPolarHBondContact O-CA 3.01Å; Q1022-S1033 WeakPolarHBondContact O-CB 3.42Å; Q1022-S1033 PolarHBondContact O-OG 2.72Å; C1023-S1033 VanDerWaalsContact SG-CB 3.58Å; C1023-S1033 PolarHBondContact SG-OG 3.26Å
1034	T	92.2	Very high	88.4	Confident	12 Å²	12	54 Å²	54	7%	0.074	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	122.8	174.3	-52.9	0	0	0	0	108.8	A965 L966 D967 Q1022 Y1036	A965-T1034 HydrophobicContact CB-CG2 4.1Å; L966-T1034 CarbonylContact O-C 3.59Å; L966-T1034 WeakPolarHBondContact O-CA 3.17Å; D967-T1034 VanDerWaalsContact OD1-CB 3.31Å; D967-T1034 WeakPolarHBondContact OD1-CB 3.19Å; D967-T1034 WeakPolarHBondContact OD1-CG2 3.48Å; D967-T1034 PolarHBondContact OD1-OG1 3.16Å; Q1022-T1034 PolarHBondContact N-O 2.85Å; Q1022-T1034 PolarHBondContact O-N 3.2Å; T1034-Y1036 HydrophobicContact CG2-CD2 4.14Å; T1034-Y1036 HydrophobicContact CG2-CE1 4Å; T1034-Y1036 HydrophobicContact CG2-CE2 3.55Å; T1034-Y1036 VanDerWaalsContact CG2-CZ 3.47Å
1035	F	92	Very high	88.4	Confident	0 Å²	0	50 Å²	50	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	111.6	176.9	-174.2	-106.7	0	0	0	110.8	A965 L966 W983 I1007 M1019 L1020 A1021 I1037 Y1048	A965-F1035 CarbonylContact C-O 3.58Å; A965-F1035 WeakPolarHBondContact CA-O 3.11Å; L966-F1035 HydrophobicContact CB-CB 4.27Å; L966-F1035 HydrophobicContact CD1-CD1 3.86Å; L966-F1035 HydrophobicContact CG-CD1 4.37Å; L966-F1035 PolarHBondContact N-O 2.88Å; L966-F1035 PolarHBondContact O-N 2.82Å; W983-F1035 HydrophobicContact CB-CD2 4.05Å; W983-F1035 HydrophobicContact CB-CE2 4.2Å; W983-F1035 HydrophobicContact CD2-CB 3.63Å; W983-F1035 HydrophobicContact CD2-CD2 4.13Å; W983-F1035 AromaticContact CD2-CG 3.97Å; W983-F1035 HydrophobicContact CD2-CG 3.97Å; W983-F1035 HydrophobicContact CE3-CB 3.74Å; W983-F1035 HydrophobicContact CE3-CD1 4.36Å; W983-F1035 AromaticContact CE3-CG 4Å; W983-F1035 HydrophobicContact CE3-CG 4Å; W983-F1035 HydrophobicContact CG-CB 4.25Å; W983-F1035 AromaticContact CG-CD2 3.92Å; W983-F1035 HydrophobicContact CG-CD2 3.92Å; W983-F1035 HydrophobicContact CG-CG 4.25Å; W983-F1035 HydrophobicContact CH2-CB 3.78Å; W983-F1035 HydrophobicContact CZ2-CB 3.69Å; W983-F1035 HydrophobicContact CZ3-CB 3.81Å; W983-F1035 HydrophobicContact CZ3-CG 4.43Å; I1007-F1035 HydrophobicContact CB-CE2 4.29Å; I1007-F1035 HydrophobicContact CD1-CE2 3.72Å; I1007-F1035 HydrophobicContact CD1-CZ 3.65Å; I1007-F1035 HydrophobicContact CG2-CE2 4.05Å; M1019-F1035 HydrophobicContact CB-CE1 4.49Å; M1019-F1035 HydrophobicContact CB-CE2 4.09Å; M1019-F1035 HydrophobicContact CB-CZ 3.69Å; M1019-F1035 HydrophobicContact CG-CE1 4.29Å; M1019-F1035 HydrophobicContact CG-CZ 3.86Å; M1019-F1035 HydrophobicContact SD-CE1 4.28Å; M1019-F1035 HydrophobicContact SD-CZ 3.81Å; L1020-F1035 WeakPolarHBondContact O-CA 3.44Å; A1021-F1035 HydrophobicContact CB-CD2 4.11Å; F1035-I1037 HydrophobicContact CD1-CD1 3.94Å; F1035-I1037 HydrophobicContact CD1-CG1 3.71Å; F1035-I1037 HydrophobicContact CE1-CD1 3.72Å; F1035-I1037 HydrophobicContact CE1-CG1 3.45Å; F1035-I1037 VanDerWaalsContact CE1-CG1 3.45Å; F1035-I1037 HydrophobicContact CZ-CG1 4.42Å; F1035-Y1048 AromaticContact CE1-CD1 3.87Å; F1035-Y1048 HydrophobicContact CE1-CD1 3.87Å; F1035-Y1048 AromaticContact CE1-CE1 3.96Å; F1035-Y1048 HydrophobicContact CE1-CE1 3.96Å
1036	Y	90.3	Very high	88.5	Confident	53 Å²	53	45.2 Å²	45.2	21%	0.208	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	137.2	177.5	-63	-84.9	0	0	0	111.1	Y963 A964 A965 M1019 L1020 Q1022 T1034	Y963-Y1036 HydrophobicContact CD2-CD1 4.19Å; A964-Y1036 WeakPolarHBondContact O-CA 3.11Å; A965-Y1036 HydrophobicContact CB-CD1 3.78Å; A965-Y1036 HydrophobicContact CB-CE1 3.77Å; M1019-Y1036 CarbonylContact C-O 3.54Å; M1019-Y1036 VanDerWaalsContact CA-O 3.31Å; M1019-Y1036 WeakPolarHBondContact CA-O 3.45Å; L1020-Y1036 PolarHBondContact N-O 2.85Å; L1020-Y1036 PolarHBondContact O-N 3.19Å; Q1022-Y1036 HydrophobicContact CB-CE2 4.42Å; Q1022-Y1036 HydrophobicContact CG-CD2 4.31Å; Q1022-Y1036 HydrophobicContact CG-CE2 4.12Å; T1034-Y1036 HydrophobicContact CG2-CD2 4.14Å; T1034-Y1036 HydrophobicContact CG2-CE1 4Å; T1034-Y1036 HydrophobicContact CG2-CE2 3.55Å; T1034-Y1036 VanDerWaalsContact CG2-CZ 3.47Å
1037	I	90.7	Very high	88.8	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	107.4	174.5	-55	163.3	0	0	0	107.2	Y963 A964 L966 K1018 M1019 F1035 L1040 D1044 Y1048 L1066	Y963-I1037 CarbonylContact C-O 2.84Å; Y963-I1037 WeakPolarHBondContact CA-O 3.5Å; Y963-I1037 WeakPolarHBondContact CB-O 3.41Å; A964-I1037 PolarHBondContact N-O 2.8Å; A964-I1037 PolarHBondContact O-N 2.84Å; L966-I1037 HydrophobicContact CD1-CD1 4.33Å; K1018-I1037 CarbonylContact O-C 3.05Å; K1018-I1037 WeakPolarHBondContact O-CA 3.19Å; M1019-I1037 HydrophobicContact CE-CD1 4.42Å; M1019-I1037 HydrophobicContact CE-CG1 4.21Å; M1019-I1037 HydrophobicContact CE-CG2 3.9Å; M1019-I1037 HydrophobicContact CG-CG1 4.23Å; M1019-I1037 HydrophobicContact CG-CG2 4.29Å; F1035-I1037 HydrophobicContact CD1-CD1 3.94Å; F1035-I1037 HydrophobicContact CD1-CG1 3.71Å; F1035-I1037 HydrophobicContact CE1-CD1 3.72Å; F1035-I1037 HydrophobicContact CE1-CG1 3.45Å; F1035-I1037 VanDerWaalsContact CE1-CG1 3.45Å; F1035-I1037 HydrophobicContact CZ-CG1 4.42Å; I1037-L1040 HydrophobicContact CB-CD2 4.29Å; I1037-L1040 HydrophobicContact CG2-CD2 3.8Å; I1037-D1044 HydrophobicContact CG2-CB 4.42Å; I1037-Y1048 HydrophobicContact CD1-CD1 4.35Å; I1037-Y1048 HydrophobicContact CD1-CE1 3.84Å; I1037-Y1048 HydrophobicContact CD1-CE2 4.18Å; I1037-L1066 HydrophobicContact CD1-CD2 3.58Å
1038	Y	87.4	Confident	89.3	Confident	70 Å²	70	37.3 Å²	37.3	28%	0.275	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	153.9	-177.1	-60.3	-79.7	0	0	0	112	D962 Y963 P1017 K1018 L1020	D962-Y1038 WeakPolarHBondContact O-CA 3.45Å; Y963-Y1038 HydrophobicContact CG-CD1 4.4Å; Y963-Y1038 HydrophobicContact CG-CE1 4.37Å; P1017-Y1038 WeakPolarHBondContact O-CD2 3.2Å; K1018-Y1038 WeakPolarHBondContact CE-O 3.43Å; K1018-Y1038 WeakPolarHBondContact CG-O 3.31Å; K1018-Y1038 PolarHBondContact O-N 3.32Å; L1020-Y1038 HydrophobicContact CB-CE2 4.28Å; L1020-Y1038 HydrophobicContact CD2-CE2 4.44Å
1039	Q	87.5	Confident	89.8	Confident	153 Å²	153	31.8 Å²	31.8	72%	0.715	15%	0.154	S	C	*	.	S	Bend	trans	55	67.5	176.7	-60.7	-176	-21.4	0	0	112.2	K961 D962 K1018	K961-Q1039 CarbonylContact O-C 3.58Å; K961-Q1039 WeakPolarHBondContact O-CA 3.47Å; D962-Q1039 PolarHBondContact O-N 2.71Å; K1018-Q1039 WeakPolarHBondContact CE-O 3.4Å
1040	L	87.9	Confident	90.1	Very high	7 Å²	7	30.2 Å²	30.2	4%	0.037	15%	0.146	C	C	.	.			trans	-66.1	137.8	-175	-68.4	170.6	0	0	0	112.4	Q958 K961 A964 I1037 D1044 L1066 Y1068	Q958-L1040 HydrophobicContact CB-CD1 4.12Å; Q958-L1040 HydrophobicContact CG-CD1 3.56Å; K961-L1040 PolarHBondContact O-N 2.86Å; A964-L1040 HydrophobicContact CB-CD1 4.06Å; A964-L1040 HydrophobicContact CB-CD2 4.29Å; I1037-L1040 HydrophobicContact CB-CD2 4.29Å; I1037-L1040 HydrophobicContact CG2-CD2 3.8Å; L1040-D1044 HydrophobicContact CD2-CB 4.07Å; L1040-L1066 HydrophobicContact CD2-CD2 4.04Å; L1040-Y1068 HydrophobicContact CB-CD1 4.44Å; L1040-Y1068 HydrophobicContact CB-CD2 3.96Å; L1040-Y1068 HydrophobicContact CB-CE2 4.32Å; L1040-Y1068 HydrophobicContact CB-CG 4.08Å; L1040-Y1068 HydrophobicContact CD1-CD2 4.17Å
1041	T	88.5	Confident	90.3	Very high	57 Å²	57	27.4 Å²	27.4	35%	0.35	13%	0.133	S	C	.	.			trans	-135.5	165.2	-178.9	58.3	0	0	0	0	110.3	K1018 D1043 D1044	K1018-T1041 PolarHBondContact NZ-OG1 2.97Å; T1041-D1043 PolarHBondContact O-N 3.25Å; T1041-D1043 VanDerWaalsContact O-N 3.07Å; T1041-D1044 PolarHBondContact N-OD2 2.98Å; T1041-D1044 PolarHBondContact O-N 3.5Å; T1041-D1044 PolarHBondContact OG1-OD2 3.4Å
1042	E	86	Confident	90.4	Very high	52 Å²	52	27.3 Å²	27.3	24%	0.243	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-25.4	174	61	-177.1	171	0	0	113.1	F1070 K1073 R1098	E1042-F1070 HydrophobicContact CB-CB 4.08Å; E1042-F1070 HydrophobicContact CB-CD1 3.87Å; E1042-F1070 HydrophobicContact CB-CD2 3.67Å; E1042-F1070 HydrophobicContact CB-CE1 4.2Å; E1042-F1070 HydrophobicContact CB-CE2 4Å; E1042-F1070 HydrophobicContact CB-CG 3.61Å; E1042-F1070 HydrophobicContact CB-CZ 4.26Å; E1042-K1073 VanDerWaalsContact CD-NZ 3.26Å; E1042-K1073 IonicContact OE1-NZ 3.47Å; E1042-K1073 PolarHBondContact OE1-NZ 3.1Å; E1042-K1073 IonicContact OE2-NZ 2.72Å; E1042-K1073 PolarHBondContact OE2-NZ 2.96Å; E1042-R1098 VanDerWaalsContact C-NH2 3.29Å; E1042-R1098 PolarHBondContact O-NH2 2.81Å
1043	D	83.2	Confident	90.3	Very high	80 Å²	80	28.8 Å²	28.8	43%	0.428	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	0.1	177.5	-68.2	-37.5	0	0	0	114.9	R985 T1041 R1098	R985-D1043 VanDerWaalsContact CZ-O 3.26Å; R985-D1043 PolarHBondContact NH1-O 3.33Å; R985-D1043 PolarHBondContact NH2-O 2.85Å; T1041-D1043 PolarHBondContact O-N 3.25Å; T1041-D1043 VanDerWaalsContact O-N 3.07Å; D1043-R1098 IonicContact OD1-CZ 2.6Å; D1043-R1098 VanDerWaalsContact OD1-CZ 3.27Å; D1043-R1098 IonicContact OD1-NH1 3.87Å; D1043-R1098 PolarHBondContact OD1-NH1 3.43Å; D1043-R1098 IonicContact OD1-NH2 2.73Å; D1043-R1098 PolarHBondContact OD1-NH2 2.82Å
1044	D	87.9	Confident	90.2	Very high	5 Å²	5	29.7 Å²	29.7	3%	0.027	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-20.2	171.1	-59.2	-60	0	0	0	113	R985 K1018 I1037 L1040 T1041 G1046 Y1048 L1066	R985-D1044 IonicContact NH1-OD1 2.78Å; K1018-D1044 WeakPolarHBondContact CE-OD1 3.47Å; K1018-D1044 WeakPolarHBondContact CE-OD2 3.38Å; K1018-D1044 IonicContact NZ-OD1 2.68Å; K1018-D1044 PolarHBondContact NZ-OD1 2.87Å; K1018-D1044 IonicContact NZ-OD2 3.74Å; K1018-D1044 PolarHBondContact NZ-OD2 2.8Å; I1037-D1044 HydrophobicContact CG2-CB 4.42Å; L1040-D1044 HydrophobicContact CD2-CB 4.07Å; T1041-D1044 PolarHBondContact N-OD2 2.98Å; T1041-D1044 PolarHBondContact O-N 3.5Å; T1041-D1044 PolarHBondContact OG1-OD2 3.4Å; D1044-G1046 PolarHBondContact O-N 2.95Å; D1044-Y1048 WeakPolarHBondContact O-CE2 3.34Å; D1044-Y1048 PolarHBondContact O-OH 3.43Å; D1044-L1066 HydrophobicContact CB-CD2 4.36Å
1045	V	89.2	Confident	89.7	Confident	6 Å²	6	32.4 Å²	32.4	4%	0.036	18%	0.179	C	C	.	.			trans	-59.5	129.2	176.6	-177.1	0	0	0	0	109.9	L1066 Y1068 F1070 P1143	V1045-L1066 WeakPolarHBondContact CG1-O 3.47Å; V1045-Y1068 WeakPolarHBondContact CG2-O 3.49Å; V1045-F1070 HydrophobicContact CB-CE1 4.46Å; V1045-F1070 HydrophobicContact CG2-CD1 4.32Å; V1045-F1070 HydrophobicContact CG2-CE1 4.01Å; V1045-P1143 HydrophobicContact CG1-CB 3.99Å
1046	G	88.2	Confident	89.1	Confident	5 Å²	5	33.9 Å²	33.9	5%	0.052	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	159.3	-174.4	-172.8	0	0	0	0	0	114.1	D1044 L1066	D1044-G1046 PolarHBondContact O-N 2.95Å; G1046-L1066 PolarHBondContact N-O 3.21Å; G1046-L1066 PolarHBondContact O-N 3.44Å
1047	K	90.2	Very high	88.6	Confident	36 Å²	36	33.1 Å²	33.1	16%	0.157	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	128	-178.5	-172.1	173.6	-82.7	172.9	0	110.3	Y986 E998 T1063 F1064 N1065	Y986-K1047 HydrophobicContact CD2-CB 3.88Å; Y986-K1047 HydrophobicContact CD2-CD 3.99Å; Y986-K1047 HydrophobicContact CD2-CG 3.74Å; Y986-K1047 HydrophobicContact CE2-CD 4.02Å; Y986-K1047 HydrophobicContact CE2-CG 4.08Å; Y986-K1047 PolarHBondContact N-O 2.9Å; E998-K1047 VanDerWaalsContact OE1-CE 3.29Å; E998-K1047 WeakPolarHBondContact OE1-CE 3.37Å; E998-K1047 IonicContact OE1-NZ 3.61Å; E998-K1047 PolarHBondContact OE1-NZ 2.93Å; E998-K1047 IonicContact OE2-NZ 2.7Å; E998-K1047 PolarHBondContact OE2-NZ 2.75Å; K1047-T1063 HydrophobicContact CD-CG2 3.64Å; K1047-T1063 HydrophobicContact CG-CG2 3.42Å; K1047-T1063 VanDerWaalsContact CG-CG2 3.42Å; K1047-F1064 CarbonylContact C-O 3.47Å; K1047-F1064 WeakPolarHBondContact CA-O 3.49Å; K1047-N1065 WeakPolarHBondContact CE-OD1 3.14Å
1048	Y	93.1	Very high	88.3	Confident	1 Å²	1	40.9 Å²	40.9	0%	0.004	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	153.5	179.6	-65.8	-99.2	0	0	0	109.5	L966 Y984 R985 M1019 F1035 I1037 D1044 T1063 F1064 L1066	L966-Y1048 HydrophobicContact CD1-CD2 4.45Å; L966-Y1048 HydrophobicContact CD1-CG 4.03Å; Y984-Y1048 CarbonylContact O-C 3.46Å; Y984-Y1048 WeakPolarHBondContact O-CA 3.24Å; R985-Y1048 HydrophobicContact CB-CD1 3.79Å; R985-Y1048 HydrophobicContact CB-CE1 3.75Å; R985-Y1048 HydrophobicContact CG-CD1 3.96Å; R985-Y1048 HydrophobicContact CG-CE1 3.57Å; R985-Y1048 PolarHBondContact NH1-OH 2.59Å; M1019-Y1048 HydrophobicContact CE-CE1 3.73Å; M1019-Y1048 WeakPolarHBondContact CE-OH 3.38Å; F1035-Y1048 AromaticContact CE1-CD1 3.87Å; F1035-Y1048 HydrophobicContact CE1-CD1 3.87Å; F1035-Y1048 AromaticContact CE1-CE1 3.96Å; F1035-Y1048 HydrophobicContact CE1-CE1 3.96Å; I1037-Y1048 HydrophobicContact CD1-CD1 4.35Å; I1037-Y1048 HydrophobicContact CD1-CE1 3.84Å; I1037-Y1048 HydrophobicContact CD1-CE2 4.18Å; D1044-Y1048 WeakPolarHBondContact O-CE2 3.34Å; D1044-Y1048 PolarHBondContact O-OH 3.43Å; Y1048-T1063 CarbonylContact O-C 3.5Å; Y1048-T1063 WeakPolarHBondContact O-CA 3.04Å; Y1048-F1064 PolarHBondContact N-O 3.17Å; Y1048-F1064 PolarHBondContact O-N 3.48Å; Y1048-L1066 HydrophobicContact CD2-CB 4.03Å; Y1048-L1066 HydrophobicContact CE2-CB 3.8Å; Y1048-L1066 HydrophobicContact CE2-CD2 3.92Å
1049	V	93.8	Very high	88.3	Confident	5 Å²	5	40.1 Å²	40.1	3%	0.03	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	128.6	-178.5	-177.7	0	0	0	0	109.8	W983 Y984 Y986 L1003 K1061 K1062	W983-V1049 CarbonylContact C-O 3.55Å; W983-V1049 WeakPolarHBondContact CA-O 3.49Å; Y984-V1049 PolarHBondContact N-O 2.7Å; Y984-V1049 PolarHBondContact O-N 3.39Å; Y986-V1049 HydrophobicContact CD2-CG2 4.11Å; Y986-V1049 HydrophobicContact CE2-CG2 3.45Å; Y986-V1049 VanDerWaalsContact CE2-CG2 3.45Å; L1003-V1049 HydrophobicContact CD2-CG2 4.44Å; V1049-K1061 HydrophobicContact CG1-CB 3.94Å; V1049-K1061 HydrophobicContact CG1-CD 4.26Å; V1049-K1062 CarbonylContact C-O 3.6Å; V1049-K1062 WeakPolarHBondContact CA-O 3.4Å
1050	C	94.5	Very high	88.5	Confident	0 Å²	0	35 Å²	35	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	118.8	160.9	171.6	0	0	0	0	108.2	C968 W983 K1061 K1062 F1064	C968-C1050 HydrophobicContact CB-CB 3.68Å; C968-C1050 WeakPolarHBondContact CB-SG 3.44Å; C968-C1050 WeakPolarHBondContact SG-CB 3.15Å; C968-C1050 CovalentContact SG-SG 2.04Å; C968-C1050 PolarHBondContact SG-SG 2.73Å; W983-C1050 HydrophobicContact CD2-CB 4.07Å; W983-C1050 HydrophobicContact CE3-CB 3.92Å; W983-C1050 HydrophobicContact CH2-CB 3.81Å; W983-C1050 HydrophobicContact CZ2-CB 3.93Å; W983-C1050 HydrophobicContact CZ3-CB 3.79Å; C1050-K1061 CarbonylContact O-C 3.5Å; C1050-K1061 VanDerWaalsContact O-CA 3.31Å; C1050-K1061 WeakPolarHBondContact O-CA 3.43Å; C1050-K1062 HydrophobicContact CB-CB 4.39Å; C1050-K1062 PolarHBondContact N-O 2.74Å; C1050-K1062 PolarHBondContact O-N 2.03Å; C1050-F1064 HydrophobicContact CB-CE2 3.95Å
1051	E	94.2	Very high	88.8	Confident	26 Å²	26	39.5 Å²	39.5	12%	0.121	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	138.9	170	-179.7	173.4	77	0	0	109.5	T982 Y984 P1059 K1061	T982-E1051 PolarHBondContact N-O 3.01Å; T982-E1051 PolarHBondContact O-N 2.95Å; Y984-E1051 HydrophobicContact CD2-CB 4.28Å; Y984-E1051 HydrophobicContact CE2-CB 3.72Å; Y984-E1051 HydrophobicContact CE2-CG 4.38Å; Y984-E1051 VanDerWaalsContact CE2-OE1 3.32Å; Y984-E1051 WeakPolarHBondContact CE2-OE1 3.44Å; Y984-E1051 PolarHBondContact OH-OE1 2.95Å; E1051-P1059 HydrophobicContact CG-CB 3.94Å; E1051-K1061 HydrophobicContact CB-CG 4.43Å; E1051-K1061 HydrophobicContact CG-CD 4.47Å; E1051-K1061 HydrophobicContact CG-CG 4.32Å; E1051-K1061 WeakPolarHBondContact OE2-CE 3.46Å; E1051-K1061 IonicContact OE2-NZ 2.68Å; E1051-K1061 PolarHBondContact OE2-NZ 2.94Å
1052	V	94.2	Very high	89.1	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	120.7	-177.4	-161.3	0	0	0	0	110.1	A946 I948 A970 T980 F981 V1060	A946-V1052 HydrophobicContact CB-CG1 3.93Å; I948-V1052 HydrophobicContact CD1-CG2 4.32Å; I948-V1052 HydrophobicContact CG1-CG2 3.94Å; A970-V1052 HydrophobicContact CB-CG1 3.7Å; T980-V1052 HydrophobicContact CG2-CG1 3.53Å; T980-V1052 VanDerWaalsContact O-CA 3.25Å; T980-V1052 WeakPolarHBondContact O-CA 3.49Å; F981-V1052 HydrophobicContact CD1-CG1 4.23Å; F981-V1052 HydrophobicContact CD1-CG2 3.88Å; F981-V1052 HydrophobicContact CE1-CG1 3.96Å; F981-V1052 HydrophobicContact CE1-CG2 3.75Å; F981-V1052 HydrophobicContact CZ-CG1 4.49Å; V1052-V1060 HydrophobicContact CB-CG2 3.88Å; V1052-V1060 HydrophobicContact CG2-CG2 4.46Å; V1052-V1060 PolarHBondContact N-O 3.4Å; V1052-V1060 PolarHBondContact O-N 2.75Å
1053	S	92.9	Very high	89.4	Confident	37 Å²	37	36 Å²	36	26%	0.259	21%	0.214	S	C	.	.			trans	-147.3	128.7	174.2	179.8	0	0	0	0	112	T980 G1055	T980-S1053 VanDerWaalsContact CA-O 3.23Å; T980-S1053 WeakPolarHBondContact CA-O 3.05Å; T980-S1053 WeakPolarHBondContact CB-O 3.25Å; T980-S1053 WeakPolarHBondContact CG2-O 3.28Å; T980-S1053 PolarHBondContact O-N 2.7Å; T980-S1053 PolarHBondContact OG1-O 3.08Å; T980-S1053 VanDerWaalsContact OG1-O 3.09Å; S1053-G1055 PolarHBondContact OG-N 2.85Å
1054	N	90	Very high	89.9	Confident	18 Å²	18	32.1 Å²	32.1	10%	0.096	19%	0.193	C	C	.	.			trans	-99.9	15.9	171	68.1	-21.1	0	0	0	112.9	Y944 A946 A972 N973 P974 T980 I1056	Y944-N1054 PolarHBondContact O-ND2 2.94Å; A946-N1054 HydrophobicContact CB-CB 4.38Å; A946-N1054 PolarHBondContact N-OD1 2.88Å; A972-N1054 HydrophobicContact CB-CB 4.26Å; N973-N1054 PolarHBondContact O-ND2 2.92Å; P974-N1054 VanDerWaalsContact O-CB 3.29Å; P974-N1054 WeakPolarHBondContact O-CB 3.1Å; P974-N1054 PolarHBondContact O-ND2 2.85Å; T980-N1054 HydrophobicContact CG2-CB 4.42Å; N1054-I1056 VanDerWaalsContact C-N 3.26Å; N1054-I1056 PolarHBondContact O-N 2.87Å; N1054-I1056 PolarHBondContact OD1-N 3.33Å; N1054-I1056 PolarHBondContact OD1-O 2.98Å
1055	G	82.7	Confident	90.1	Very high	70 Å²	70	32.8 Å²	32.8	72%	0.722	20%	0.197	S	C	*	.	S	Bend	trans	75.5	10	-175.5	0	0	0	0	0	114.4	S1053	S1053-G1055 PolarHBondContact OG-N 2.85Å
1056	I	79.2	Confident	90.2	Very high	30 Å²	30	32.5 Å²	32.5	15%	0.154	20%	0.195	C	C	.	.	S	Bend	trans	-123.5	118.6	176.7	-56.8	-177.6	0	0	0	108.2	T943 P945 N1054	T943-I1056 HydrophobicContact CG2-CD1 4.44Å; P945-I1056 VanDerWaalsContact CA-O 3.24Å; P945-I1056 WeakPolarHBondContact CA-O 3.32Å; P945-I1056 HydrophobicContact CB-CG2 4.49Å; P945-I1056 WeakPolarHBondContact CB-O 3.46Å; N1054-I1056 VanDerWaalsContact C-N 3.26Å; N1054-I1056 PolarHBondContact O-N 2.87Å; N1054-I1056 PolarHBondContact OD1-N 3.33Å; N1054-I1056 PolarHBondContact OD1-O 2.98Å
1057	G	79.8	Confident	90.4	Very high	37 Å²	37	33.3 Å²	33.3	38%	0.381	20%	0.198	S	C	.	.	S	Bend	trans	76	-170	-175.6	0	0	0	0	0	113.7
1058	E	83	Confident	90.4	Very high	164 Å²	164	32.6 Å²	32.6	77%	0.766	20%	0.195	S	C	*	.	S	Bend	trans	-78.2	144.3	-179.3	-65.6	-58.2	142.5	0	0	112.1	V1060	E1058-V1060 PolarHBondContact O-N 2.83Å
1059	P	88.2	Confident	90.2	Very high	53 Å²	53	35 Å²	35	34%	0.344	21%	0.206	S	C	.	.	P	Polyproline II helix	trans	-63.2	124.6	174.3	-21	32.9	0	0	0	112.6	E1051	E1051-P1059 HydrophobicContact CG-CB 3.94Å
1060	V	92.5	Very high	90.1	Very high	46 Å²	46	35.2 Å²	35.2	28%	0.279	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	145.3	177.7	-62.3	0	0	0	0	110.8	A946 I948 V1052 E1058	A946-V1060 WeakPolarHBondContact O-CG2 3.49Å; I948-V1060 HydrophobicContact CD1-CB 3.9Å; I948-V1060 HydrophobicContact CD1-CG2 3.72Å; I948-V1060 HydrophobicContact CG1-CB 4.43Å; I948-V1060 HydrophobicContact CG1-CG2 3.76Å; V1052-V1060 HydrophobicContact CB-CG2 3.88Å; V1052-V1060 HydrophobicContact CG2-CG2 4.46Å; V1052-V1060 PolarHBondContact N-O 3.4Å; V1052-V1060 PolarHBondContact O-N 2.75Å; E1058-V1060 PolarHBondContact O-N 2.83Å
1061	K	93.6	Very high	90	Very high	101 Å²	101	38.2 Å²	38.2	44%	0.439	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	136.1	-170.7	-46.7	-164.5	-164.8	-153.8	0	112.7	V1049 C1050 E1051	V1049-K1061 HydrophobicContact CG1-CB 3.94Å; V1049-K1061 HydrophobicContact CG1-CD 4.26Å; C1050-K1061 CarbonylContact O-C 3.5Å; C1050-K1061 VanDerWaalsContact O-CA 3.31Å; C1050-K1061 WeakPolarHBondContact O-CA 3.43Å; E1051-K1061 HydrophobicContact CB-CG 4.43Å; E1051-K1061 HydrophobicContact CG-CD 4.47Å; E1051-K1061 HydrophobicContact CG-CG 4.32Å; E1051-K1061 WeakPolarHBondContact OE2-CE 3.46Å; E1051-K1061 IonicContact OE2-NZ 2.68Å; E1051-K1061 PolarHBondContact OE2-NZ 2.94Å
1062	K	94.5	Very high	90	Very high	11 Å²	11	37.4 Å²	37.4	5%	0.048	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	128.3	171.6	-178.8	178.1	173.9	-171.4	0	109.8	I948 K951 L952 E954 D967 V1049 C1050 F1064	I948-K1062 HydrophobicContact CD1-CB 4.01Å; I948-K1062 HydrophobicContact CG2-CB 4.39Å; I948-K1062 HydrophobicContact CG2-CD 4.41Å; K951-K1062 WeakPolarHBondContact O-CD 3.33Å; K951-K1062 VanDerWaalsContact O-CE 3.27Å; K951-K1062 WeakPolarHBondContact O-CE 3.33Å; L952-K1062 CarbonylContact O-C 3.55Å; L952-K1062 WeakPolarHBondContact O-CA 3.42Å; E954-K1062 VanDerWaalsContact OE2-CE 3.32Å; E954-K1062 WeakPolarHBondContact OE2-CE 3.44Å; E954-K1062 IonicContact OE2-NZ 2.77Å; E954-K1062 PolarHBondContact OE2-NZ 3.25Å; D967-K1062 PolarHBondContact O-NZ 2.77Å; V1049-K1062 CarbonylContact C-O 3.6Å; V1049-K1062 WeakPolarHBondContact CA-O 3.4Å; C1050-K1062 HydrophobicContact CB-CB 4.39Å; C1050-K1062 PolarHBondContact N-O 2.74Å; C1050-K1062 PolarHBondContact O-N 2.03Å; K1062-F1064 HydrophobicContact CB-CE2 4.31Å; K1062-F1064 HydrophobicContact CD-CE1 4.17Å; K1062-F1064 HydrophobicContact CD-CE2 3.93Å; K1062-F1064 HydrophobicContact CD-CZ 3.51Å; K1062-F1064 VanDerWaalsContact CE-CE1 3.44Å; K1062-F1064 HydrophobicContact CG-CD2 4.49Å; K1062-F1064 HydrophobicContact CG-CE2 3.83Å; K1062-F1064 HydrophobicContact CG-CZ 3.94Å
1063	T	93.3	Very high	89.8	Confident	24 Å²	24	42.2 Å²	42.2	15%	0.147	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	140.9	-178.2	-54.3	0	0	0	0	111.1	L952 E953 E954 K1047 Y1048	L952-T1063 PolarHBondContact O-N 2.99Å; E953-T1063 WeakPolarHBondContact CA-O 3.41Å; E954-T1063 PolarHBondContact N-O 3.04Å; K1047-T1063 HydrophobicContact CD-CG2 3.64Å; K1047-T1063 HydrophobicContact CG-CG2 3.42Å; K1047-T1063 VanDerWaalsContact CG-CG2 3.42Å; Y1048-T1063 CarbonylContact O-C 3.5Å; Y1048-T1063 WeakPolarHBondContact O-CA 3.04Å
1064	F	93.6	Very high	89.7	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	128.9	175	-58	-99.8	0	0	0	110.6	E954 I956 L966 D967 C968 W983 K1047 Y1048 C1050 K1062	E954-F1064 HydrophobicContact CB-CD1 4.08Å; E954-F1064 HydrophobicContact CB-CE1 4.43Å; E954-F1064 CarbonylContact O-C 3.56Å; E954-F1064 VanDerWaalsContact O-CA 3.27Å; E954-F1064 WeakPolarHBondContact O-CA 3.35Å; I956-F1064 HydrophobicContact CG1-CD1 4.36Å; L966-F1064 HydrophobicContact CB-CD1 3.88Å; L966-F1064 HydrophobicContact CB-CD2 4.39Å; L966-F1064 HydrophobicContact CB-CE1 3.92Å; L966-F1064 HydrophobicContact CB-CE2 4.45Å; L966-F1064 HydrophobicContact CB-CG 4.11Å; L966-F1064 HydrophobicContact CB-CZ 4.2Å; L966-F1064 HydrophobicContact CD1-CB 3.97Å; L966-F1064 HydrophobicContact CD1-CD2 4.37Å; L966-F1064 HydrophobicContact CD1-CG 4.1Å; L966-F1064 HydrophobicContact CD2-CB 4.22Å; L966-F1064 HydrophobicContact CD2-CD1 4.24Å; L966-F1064 HydrophobicContact CD2-CG 4.4Å; L966-F1064 HydrophobicContact CG-CD1 4.47Å; L966-F1064 HydrophobicContact CG-CG 4.44Å; D967-F1064 VanDerWaalsContact O-CZ 3.28Å; D967-F1064 WeakPolarHBondContact O-CZ 3.34Å; C968-F1064 HydrophobicContact CB-CZ 4.36Å; W983-F1064 HydrophobicContact CH2-CD2 4.14Å; W983-F1064 AromaticContact CH2-CE2 3.43Å; W983-F1064 HydrophobicContact CH2-CE2 3.43Å; W983-F1064 VanDerWaalsContact CH2-CE2 3.43Å; W983-F1064 AromaticContact CH2-CZ 3.73Å; W983-F1064 HydrophobicContact CH2-CZ 3.73Å; W983-F1064 AromaticContact CZ3-CD2 3.68Å; W983-F1064 HydrophobicContact CZ3-CD2 3.68Å; W983-F1064 AromaticContact CZ3-CE2 3.41Å; W983-F1064 HydrophobicContact CZ3-CE2 3.41Å; W983-F1064 VanDerWaalsContact CZ3-CE2 3.41Å; W983-F1064 HydrophobicContact CZ3-CZ 4.14Å; K1047-F1064 CarbonylContact C-O 3.47Å; K1047-F1064 WeakPolarHBondContact CA-O 3.49Å; Y1048-F1064 PolarHBondContact N-O 3.17Å; Y1048-F1064 PolarHBondContact O-N 3.48Å; C1050-F1064 HydrophobicContact CB-CE2 3.95Å; K1062-F1064 HydrophobicContact CB-CE2 4.31Å; K1062-F1064 HydrophobicContact CD-CE1 4.17Å; K1062-F1064 HydrophobicContact CD-CE2 3.93Å; K1062-F1064 HydrophobicContact CD-CZ 3.51Å; K1062-F1064 VanDerWaalsContact CE-CE1 3.44Å; K1062-F1064 HydrophobicContact CG-CD2 4.49Å; K1062-F1064 HydrophobicContact CG-CE2 3.83Å; K1062-F1064 HydrophobicContact CG-CZ 3.94Å
1065	N	91.3	Very high	89.5	Confident	19 Å²	19	42.1 Å²	42.1	10%	0.102	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	107.8	170.2	-61.6	-55.4	0	0	0	108.8	E954 N955 I956 K1047 P1143	E954-N1065 PolarHBondContact O-N 2.97Å; N955-N1065 WeakPolarHBondContact OD1-CB 3.28Å; N955-N1065 PolarHBondContact OD1-ND2 3.41Å; I956-N1065 PolarHBondContact N-O 3.37Å; K1047-N1065 WeakPolarHBondContact CE-OD1 3.14Å; N1065-P1143 HydrophobicContact CB-CG 3.8Å
1066	L	92.4	Very high	89.4	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	123.2	175.2	179.7	64.4	0	0	0	109.7	I956 A964 I1037 L1040 D1044 V1045 G1046 Y1048	I956-L1066 HydrophobicContact CB-CD1 4.41Å; I956-L1066 HydrophobicContact CG2-CD1 4.09Å; A964-L1066 HydrophobicContact CB-CD1 3.6Å; I1037-L1066 HydrophobicContact CD1-CD2 3.58Å; L1040-L1066 HydrophobicContact CD2-CD2 4.04Å; D1044-L1066 HydrophobicContact CB-CD2 4.36Å; V1045-L1066 WeakPolarHBondContact CG1-O 3.47Å; G1046-L1066 PolarHBondContact N-O 3.21Å; G1046-L1066 PolarHBondContact O-N 3.44Å; Y1048-L1066 HydrophobicContact CD2-CB 4.03Å; Y1048-L1066 HydrophobicContact CE2-CB 3.8Å; Y1048-L1066 HydrophobicContact CE2-CD2 3.92Å
1067	L	90.6	Very high	89.3	Confident	22 Å²	22	44.5 Å²	44.5	12%	0.115	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	118.4	-179	-57	165.8	0	0	0	108.1	N955 I956 T957 Q958 E1100 P1143	N955-L1067 HydrophobicContact CB-CD1 4.47Å; I956-L1067 PolarHBondContact O-N 3.06Å; T957-L1067 CarbonylContact C-O 3.48Å; T957-L1067 WeakPolarHBondContact CA-O 3.38Å; T957-L1067 HydrophobicContact CG2-CB 4.05Å; T957-L1067 HydrophobicContact CG2-CD1 3.73Å; Q958-L1067 PolarHBondContact N-O 2.89Å; L1067-E1100 HydrophobicContact CB-CG 4.25Å; L1067-E1100 VanDerWaalsContact CD2-OE2 3.26Å; L1067-E1100 WeakPolarHBondContact CD2-OE2 3.33Å; L1067-P1143 HydrophobicContact CD2-CB 3.72Å; L1067-P1143 HydrophobicContact CD2-CG 4.36Å
1068	Y	90.4	Very high	89.3	Confident	20 Å²	20	45.1 Å²	45.1	8%	0.078	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	131.2	178.3	165.7	-100.1	0	0	0	108.5	Q958 K961 L1040 V1045 F1070 E1100	Q958-Y1068 WeakPolarHBondContact O-CA 3.04Å; Q958-Y1068 WeakPolarHBondContact O-CD2 3.48Å; K961-Y1068 WeakPolarHBondContact CE-OH 3.34Å; K961-Y1068 HydrophobicContact CG-CE2 4.1Å; K961-Y1068 VanDerWaalsContact CG-OH 3.31Å; K961-Y1068 WeakPolarHBondContact CG-OH 3.31Å; L1040-Y1068 HydrophobicContact CB-CD1 4.44Å; L1040-Y1068 HydrophobicContact CB-CD2 3.96Å; L1040-Y1068 HydrophobicContact CB-CE2 4.32Å; L1040-Y1068 HydrophobicContact CB-CG 4.08Å; L1040-Y1068 HydrophobicContact CD1-CD2 4.17Å; V1045-Y1068 WeakPolarHBondContact CG2-O 3.49Å; Y1068-F1070 WeakPolarHBondContact O-CD1 3.12Å; Y1068-E1100 VanDerWaalsContact O-CB 3.29Å; Y1068-E1100 WeakPolarHBondContact O-CB 3.26Å; Y1068-E1100 WeakPolarHBondContact O-CG 3.47Å
1069	H	90.1	Very high	89.1	Confident	52 Å²	52	38.3 Å²	38.3	24%	0.241	20%	0.196	C	C	.	.			trans	-76.4	133.1	-167.8	-65.3	-180	0	0	0	114	E1100 Q1171	H1069-E1100 CarbonylContact C-O 2.76Å; H1069-E1100 WeakPolarHBondContact CA-O 3.19Å; H1069-Q1171 HydrophobicContact CB-CG 4.43Å
1070	F	91	Very high	89	Confident	9 Å²	9	37.6 Å²	37.6	4%	0.039	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	155.3	176.1	69	-85	0	0	0	112.1	E1042 V1045 Y1068 R1098 T1099 E1100 N1169	E1042-F1070 HydrophobicContact CB-CB 4.08Å; E1042-F1070 HydrophobicContact CB-CD1 3.87Å; E1042-F1070 HydrophobicContact CB-CD2 3.67Å; E1042-F1070 HydrophobicContact CB-CE1 4.2Å; E1042-F1070 HydrophobicContact CB-CE2 4Å; E1042-F1070 HydrophobicContact CB-CG 3.61Å; E1042-F1070 HydrophobicContact CB-CZ 4.26Å; V1045-F1070 HydrophobicContact CB-CE1 4.46Å; V1045-F1070 HydrophobicContact CG2-CD1 4.32Å; V1045-F1070 HydrophobicContact CG2-CE1 4.01Å; Y1068-F1070 WeakPolarHBondContact O-CD1 3.12Å; F1070-R1098 VanDerWaalsContact CE2-C 3.45Å; F1070-R1098 HydrophobicContact CE2-CB 3.9Å; F1070-R1098 HydrophobicContact CZ-CB 4.04Å; F1070-T1099 VanDerWaalsContact CE2-N 3.33Å; F1070-E1100 HydrophobicContact CD1-CB 3.8Å; F1070-E1100 HydrophobicContact CE1-CB 3.67Å; F1070-E1100 PolarHBondContact N-O 2.79Å; F1070-E1100 PolarHBondContact O-N 2.81Å; F1070-N1169 PolarHBondContact O-ND2 3.45Å
1071	P	92.2	Very high	88.7	Confident	63 Å²	63	37.7 Å²	37.7	41%	0.409	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	162.1	-177	28.4	-36.4	0	0	0	114	Q1171	P1071-Q1171 HydrophobicContact CB-CB 4.02Å
1072	P	93.5	Very high	88.6	Confident	10 Å²	10	36.5 Å²	36.5	7%	0.065	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	138.7	-174.9	-17	33.6	0	0	0	112.9	I1097 R1098 A1167 N1169 G1172 A1174	P1072-I1097 HydrophobicContact CB-CG2 3.94Å; P1072-R1098 CarbonylContact C-O 3.53Å; P1072-R1098 WeakPolarHBondContact CA-O 3.31Å; P1072-A1167 HydrophobicContact CB-CB 4.24Å; P1072-N1169 WeakPolarHBondContact CD-OD1 3.48Å; P1072-N1169 HydrophobicContact CG-CB 4.09Å; P1072-G1172 VanDerWaalsContact CD-C 3.4Å; P1072-G1172 WeakPolarHBondContact CD-O 3.26Å; P1072-G1172 WeakPolarHBondContact CG-O 3.13Å; P1072-A1174 HydrophobicContact CB-CB 4.48Å; P1072-A1174 WeakPolarHBondContact O-CB 3.22Å
1073	K	91.8	Very high	88.4	Confident	100 Å²	100	36.3 Å²	36.3	44%	0.435	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	95.8	-173.5	-152.1	177.8	-169.8	-177.6	0	107.7	E1042 R1098	E1042-K1073 VanDerWaalsContact CD-NZ 3.26Å; E1042-K1073 IonicContact OE1-NZ 3.47Å; E1042-K1073 PolarHBondContact OE1-NZ 3.1Å; E1042-K1073 IonicContact OE2-NZ 2.72Å; E1042-K1073 PolarHBondContact OE2-NZ 2.96Å; K1073-R1098 HydrophobicContact CB-CB 4.39Å; K1073-R1098 PolarHBondContact N-O 2.85Å; K1073-R1098 PolarHBondContact O-N 2.69Å
1074	I	89.9	Confident	88.2	Confident	21 Å²	21	35.5 Å²	35.5	11%	0.108	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	126.1	-177.5	-53.1	180	0	0	0	109.2	Q1076 C1095 Y1096 I1097 A1167 A1174 L1176	I1074-Q1076 PolarHBondContact O-N 3.41Å; I1074-C1095 HydrophobicContact CG2-CB 4.26Å; I1074-Y1096 CarbonylContact C-O 3.58Å; I1074-Y1096 WeakPolarHBondContact CA-O 3.4Å; I1074-Y1096 WeakPolarHBondContact CG2-O 3.36Å; I1074-I1097 HydrophobicContact CG1-CG1 3.98Å; I1074-I1097 HydrophobicContact CG1-CG2 4.25Å; I1074-A1167 HydrophobicContact CD1-CB 4.07Å; I1074-A1167 HydrophobicContact CG1-CB 4.31Å; I1074-A1174 HydrophobicContact CD1-CB 4.2Å; I1074-A1174 HydrophobicContact CG1-CB 3.96Å; I1074-L1176 HydrophobicContact CB-CB 4.38Å; I1074-L1176 HydrophobicContact CD1-CB 4.21Å; I1074-L1176 HydrophobicContact CG2-CB 3.75Å; I1074-L1176 HydrophobicContact CG2-CD2 3.71Å; I1074-L1176 HydrophobicContact CG2-CG 4.39Å
1075	I	85.3	Confident	87.9	Confident	33 Å²	33	35.7 Å²	35.7	17%	0.169	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	116.3	-176.3	-44.7	169.5	0	0	0	109	E994 E995 L1077 Y1096 R1098 L1145	E994-I1075 HydrophobicContact CB-CD1 4.16Å; E995-I1075 HydrophobicContact CG-CD1 3.96Å; E995-I1075 HydrophobicContact CG-CG2 4.47Å; E995-I1075 VanDerWaalsContact OE1-CG2 3.23Å; E995-I1075 WeakPolarHBondContact OE1-CG2 3.42Å; I1075-L1077 PolarHBondContact O-N 3.44Å; I1075-Y1096 PolarHBondContact N-O 3.39Å; I1075-R1098 HydrophobicContact CD1-CG 4.24Å; I1075-L1145 HydrophobicContact CD1-CD1 3.95Å
1076	Q	82.1	Confident	87.6	Confident	141 Å²	141	38.5 Å²	38.5	66%	0.659	19%	0.193	S	C	*	.			trans	-84.7	97.4	-174.3	-63.3	-168.2	-13.7	0	0	111.4	I1074 L1176	I1074-Q1076 PolarHBondContact O-N 3.41Å; Q1076-L1176 HydrophobicContact CG-CD1 3.97Å; Q1076-L1176 HydrophobicContact CG-CD2 4.44Å
1077	L	76.6	Confident	87.1	Confident	9 Å²	9	44.8 Å²	44.8	5%	0.047	22%	0.223	C	C	.	.			trans	-101.1	125.1	176.9	-78.6	170.5	0	0	0	111.9	E995 I1075 R1079 Y1080 T1081 Y1096 N1243	E995-L1077 VanDerWaalsContact CD-CD1 3.49Å; E995-L1077 HydrophobicContact CG-CD1 3.72Å; E995-L1077 HydrophobicContact CG-CG 4.45Å; I1075-L1077 PolarHBondContact O-N 3.44Å; L1077-R1079 PolarHBondContact O-N 3.21Å; L1077-R1079 VanDerWaalsContact O-N 3.15Å; L1077-Y1080 HydrophobicContact CB-CD2 3.94Å; L1077-Y1080 HydrophobicContact CD1-CD2 3.45Å; L1077-Y1080 VanDerWaalsContact CD1-CD2 3.45Å; L1077-Y1080 HydrophobicContact CD1-CE2 3.51Å; L1077-Y1080 HydrophobicContact CG-CD2 4.4Å; L1077-Y1080 PolarHBondContact O-N 2.95Å; L1077-T1081 WeakPolarHBondContact O-CG2 3.37Å; L1077-T1081 PolarHBondContact O-N 3.34Å; L1077-Y1096 HydrophobicContact CD1-CD2 4.45Å; L1077-N1243 WeakPolarHBondContact CD1-ND2 3.49Å
1078	P	79.4	Confident	86.8	Confident	49 Å²	49	47.5 Å²	47.5	32%	0.318	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-50.2	-41.8	175.8	-32.1	38.6	0	0	0	113.8	Y1080 T1081 I1190	P1078-Y1080 PolarHBondContact O-N 2.94Å; P1078-Y1080 VanDerWaalsContact O-N 3.17Å; P1078-T1081 PolarHBondContact O-N 2.65Å; P1078-T1081 PolarHBondContact O-OG1 2.83Å; P1078-I1190 HydrophobicContact CB-CD1 3.49Å; P1078-I1190 VanDerWaalsContact CB-CD1 3.49Å; P1078-I1190 HydrophobicContact CG-CD1 3.59Å
1079	R	79.7	Confident	86.6	Confident	22 Å²	22	48.2 Å²	48.2	8%	0.083	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-57.3	-28.8	177	-172.3	173.8	-173.3	-164.1	2.4	114	L1077 G1209 D1211 D1240	L1077-R1079 PolarHBondContact O-N 3.21Å; L1077-R1079 VanDerWaalsContact O-N 3.15Å; R1079-G1209 WeakPolarHBondContact CG-O 3.47Å; R1079-D1211 IonicContact CZ-OD2 3.7Å; R1079-D1211 IonicContact NE-OD2 3.72Å; R1079-D1211 PolarHBondContact NE-OD2 3.13Å; R1079-D1211 VanDerWaalsContact NE-OD2 3.12Å; R1079-D1211 IonicContact NH2-OD2 3.86Å; R1079-D1211 PolarHBondContact NH2-OD2 3.01Å; R1079-D1240 IonicContact CZ-OD1 3.72Å; R1079-D1240 IonicContact NH1-OD1 2.79Å; R1079-D1240 PolarHBondContact NH1-OD1 2.84Å; R1079-D1240 VanDerWaalsContact NH1-OD1 3.16Å; R1079-D1240 IonicContact NH2-OD1 3.25Å; R1079-D1240 PolarHBondContact NH2-OD1 3.24Å
1080	Y	84.7	Confident	86.5	Confident	38 Å²	38	49.8 Å²	49.8	15%	0.149	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-112.8	-4.8	-176.9	-52.6	-46	0	0	0	114.6	L1077 P1078 K1082 T1094 Y1096 I1178	L1077-Y1080 HydrophobicContact CB-CD2 3.94Å; L1077-Y1080 HydrophobicContact CD1-CD2 3.45Å; L1077-Y1080 VanDerWaalsContact CD1-CD2 3.45Å; L1077-Y1080 HydrophobicContact CD1-CE2 3.51Å; L1077-Y1080 HydrophobicContact CG-CD2 4.4Å; L1077-Y1080 PolarHBondContact O-N 2.95Å; P1078-Y1080 PolarHBondContact O-N 2.94Å; P1078-Y1080 VanDerWaalsContact O-N 3.17Å; Y1080-K1082 PolarHBondContact O-N 3.24Å; Y1080-T1094 HydrophobicContact CD2-CG2 4.33Å; Y1080-T1094 HydrophobicContact CE2-CG2 4.44Å; Y1080-T1094 HydrophobicContact CG-CG2 4.4Å; Y1080-Y1096 HydrophobicContact CD2-CD2 4.16Å; Y1080-Y1096 HydrophobicContact CD2-CE2 4.04Å; Y1080-Y1096 HydrophobicContact CE2-CD2 4.04Å; Y1080-Y1096 AromaticContact CE2-CE2 3.5Å; Y1080-Y1096 HydrophobicContact CE2-CE2 3.5Å; Y1080-I1178 WeakPolarHBondContact O-CD1 3.39Å; Y1080-I1178 WeakPolarHBondContact O-CG1 2.98Å; Y1080-I1178 VanDerWaalsContact O-CG2 3.31Å; Y1080-I1178 WeakPolarHBondContact O-CG2 3.32Å
1081	T	87	Confident	86.5	Confident	47 Å²	47	50 Å²	50	29%	0.288	26%	0.26	S	S	.	.	S	Bend	trans	-68.4	-11.2	166.3	56.9	0	0	0	0	113.5	L1077 P1078 L1176 I1178 H1179	L1077-T1081 WeakPolarHBondContact O-CG2 3.37Å; L1077-T1081 PolarHBondContact O-N 3.34Å; P1078-T1081 PolarHBondContact O-N 2.65Å; P1078-T1081 PolarHBondContact O-OG1 2.83Å; T1081-L1176 HydrophobicContact CG2-CD1 4.42Å; T1081-I1178 WeakPolarHBondContact O-CA 3.49Å; T1081-H1179 PolarHBondContact O-N 3.46Å; T1081-H1179 VanDerWaalsContact O-N 3.08Å
1082	K	90.3	Very high	86.4	Confident	76 Å²	76	52.3 Å²	52.3	33%	0.33	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	151.5	176.8	-65.9	170.5	-178.2	167.2	0	109.2	Y1080 H1179 D1187 F1210	Y1080-K1082 PolarHBondContact O-N 3.24Å; K1082-H1179 WeakPolarHBondContact CA-O 3.4Å; K1082-D1187 IonicContact NZ-OD1 3.46Å; K1082-D1187 PolarHBondContact NZ-OD1 2.8Å; K1082-D1187 IonicContact NZ-OD2 2.75Å; K1082-D1187 PolarHBondContact NZ-OD2 2.97Å; K1082-F1210 HydrophobicContact CB-CB 4.13Å; K1082-F1210 HydrophobicContact CB-CD1 3.72Å; K1082-F1210 HydrophobicContact CB-CD2 3.6Å; K1082-F1210 HydrophobicContact CB-CE1 3.91Å; K1082-F1210 HydrophobicContact CB-CE2 3.83Å; K1082-F1210 HydrophobicContact CB-CG 3.54Å; K1082-F1210 HydrophobicContact CB-CZ 3.96Å; K1082-F1210 HydrophobicContact CD-CB 3.86Å; K1082-F1210 HydrophobicContact CD-CD1 3.49Å; K1082-F1210 VanDerWaalsContact CD-CD1 3.49Å; K1082-F1210 HydrophobicContact CD-CE1 4.16Å; K1082-F1210 HydrophobicContact CD-CG 3.77Å; K1082-F1210 HydrophobicContact CG-CD1 4.27Å; K1082-F1210 HydrophobicContact CG-CG 4.31Å
1083	A	90.6	Very high	86.3	Confident	7 Å²	7	51.9 Å²	51.9	6%	0.058	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	150.7	168.4	0	0	0	0	0	109.6	V1091 L1093 I1178 H1179 L1180 S1181	A1083-V1091 HydrophobicContact CB-CG1 3.99Å; A1083-L1093 HydrophobicContact CB-CD2 3.68Å; A1083-I1178 HydrophobicContact CB-CG2 4.21Å; A1083-H1179 PolarHBondContact N-O 3.22Å; A1083-L1180 HydrophobicContact CB-CD1 3.73Å; A1083-L1180 WeakPolarHBondContact O-CA 3.24Å; A1083-S1181 PolarHBondContact O-N 3.27Å; A1083-S1181 PolarHBondContact O-OG 3.03Å
1084	A	90.5	Very high	86.2	Confident	7 Å²	7	47.5 Å²	47.5	6%	0.058	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	164.7	169.6	0	0	0	0	0	112.1	V1091 S1181 F1210 G1213	A1084-V1091 WeakPolarHBondContact O-CG2 3.5Å; A1084-S1181 WeakPolarHBondContact CA-O 3.4Å; A1084-S1181 VanDerWaalsContact CB-O 3.3Å; A1084-S1181 WeakPolarHBondContact CB-O 3.38Å; A1084-F1210 HydrophobicContact CB-CZ 3.7Å; A1084-G1213 WeakPolarHBondContact O-CA 3.23Å
1085	G	85.9	Confident	86.3	Confident	5 Å²	5	46.6 Å²	46.6	5%	0.052	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.4	178.3	171.7	0	0	0	0	0	112.5	S1181 T1183	G1085-S1181 PolarHBondContact N-O 2.78Å; G1085-T1183 PolarHBondContact O-N 3.2Å
1086	E	85	Confident	86.5	Confident	77 Å²	77	45.6 Å²	45.6	36%	0.36	23%	0.229	S	C	.	.			trans	-88.3	165.5	176.7	-57.3	-152.2	-173	0	0	111.5	S1088 S1089 T1183 K1268	E1086-S1088 PolarHBondContact O-N 2.69Å; E1086-S1089 PolarHBondContact N-OG 2.87Å; E1086-S1089 VanDerWaalsContact N-OG 3.07Å; E1086-S1089 VanDerWaalsContact O-CB 3.3Å; E1086-S1089 WeakPolarHBondContact O-CB 3.32Å; E1086-S1089 PolarHBondContact O-N 2.92Å; E1086-S1089 VanDerWaalsContact O-N 3.14Å; E1086-S1089 PolarHBondContact O-OG 2.99Å; E1086-T1183 HydrophobicContact CG-CG2 3.63Å; E1086-K1268 VanDerWaalsContact OE1-CD 3.32Å; E1086-K1268 WeakPolarHBondContact OE1-CD 3.05Å; E1086-K1268 IonicContact OE1-NZ 2.71Å; E1086-K1268 PolarHBondContact OE1-NZ 3.32Å; E1086-K1268 IonicContact OE2-NZ 2.61Å; E1086-K1268 PolarHBondContact OE2-NZ 2.9Å
1087	Q	82.4	Confident	86.9	Confident	132 Å²	132	38.9 Å²	38.9	62%	0.617	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.3	140.3	173.9	-72.3	-172.5	-12.6	0	0	110.7	S1089 I1155	Q1087-S1089 PolarHBondContact O-N 3.27Å; Q1087-S1089 VanDerWaalsContact O-N 3.14Å; Q1087-I1155 CarbonylContact C-O 3.5Å; Q1087-I1155 VanDerWaalsContact CA-O 3.29Å; Q1087-I1155 WeakPolarHBondContact CA-O 3.27Å
1088	S	83.8	Confident	87.6	Confident	80 Å²	80	39.3 Å²	39.3	56%	0.559	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.7	11.9	-172.8	-61.1	0	0	0	0	116.3	E1086 D1154 I1155	E1086-S1088 PolarHBondContact O-N 2.69Å; S1088-D1154 VanDerWaalsContact CA-OD1 3.28Å; S1088-D1154 WeakPolarHBondContact CA-OD1 3.3Å; S1088-D1154 VanDerWaalsContact CB-OD1 3.24Å; S1088-D1154 WeakPolarHBondContact CB-OD1 3.28Å; S1088-D1154 PolarHBondContact OG-OD1 3.47Å; S1088-I1155 PolarHBondContact N-O 2.93Å
1089	S	86.7	Confident	88.2	Confident	35 Å²	35	37 Å²	37	25%	0.245	18%	0.183	C	C	.	.			trans	-79.4	166.9	168.6	72.7	0	0	0	0	112.6	E1086 Q1087 D1154 I1155	E1086-S1089 PolarHBondContact N-OG 2.87Å; E1086-S1089 VanDerWaalsContact N-OG 3.07Å; E1086-S1089 VanDerWaalsContact O-CB 3.3Å; E1086-S1089 WeakPolarHBondContact O-CB 3.32Å; E1086-S1089 PolarHBondContact O-N 2.92Å; E1086-S1089 VanDerWaalsContact O-N 3.14Å; E1086-S1089 PolarHBondContact O-OG 2.99Å; Q1087-S1089 PolarHBondContact O-N 3.27Å; Q1087-S1089 VanDerWaalsContact O-N 3.14Å; S1089-D1154 PolarHBondContact O-N 2.89Å; S1089-I1155 PolarHBondContact O-N 3.21Å; S1089-I1155 VanDerWaalsContact O-N 3.13Å
1090	K	88.8	Confident	88.7	Confident	85 Å²	85	36.4 Å²	36.4	37%	0.37	18%	0.182	S	C	.	.			trans	-102.2	125.4	167.5	176.7	172.1	-159.7	158	0	109	W1092 E1135 V1152 N1153	K1090-W1092 HydrophobicContact CD-CZ2 4.11Å; K1090-E1135 WeakPolarHBondContact CE-OE2 3.41Å; K1090-E1135 IonicContact NZ-OE2 3.99Å; K1090-E1135 PolarHBondContact NZ-OE2 3.03Å; K1090-V1152 WeakPolarHBondContact CA-O 3.17Å; K1090-N1153 WeakPolarHBondContact CD-OD1 3.4Å; K1090-N1153 WeakPolarHBondContact CE-OD1 3.44Å; K1090-N1153 WeakPolarHBondContact CG-OD1 3.33Å; K1090-N1153 PolarHBondContact NZ-OD1 2.94Å
1091	V	89.8	Confident	88.9	Confident	12 Å²	12	36.1 Å²	36.1	7%	0.073	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	144.9	178.9	175	0	0	0	0	111.1	A1083 A1084 A1151 V1152 I1155 L1180	A1083-V1091 HydrophobicContact CB-CG1 3.99Å; A1084-V1091 WeakPolarHBondContact O-CG2 3.5Å; V1091-A1151 CarbonylContact O-C 3.51Å; V1091-A1151 WeakPolarHBondContact O-CA 3.49Å; V1091-V1152 PolarHBondContact N-O 2.71Å; V1091-V1152 PolarHBondContact O-N 3.46Å; V1091-I1155 HydrophobicContact CB-CD1 3.71Å; V1091-I1155 HydrophobicContact CG2-CD1 3.44Å; V1091-I1155 VanDerWaalsContact CG2-CD1 3.44Å; V1091-I1155 HydrophobicContact CG2-CG1 4.43Å; V1091-L1180 HydrophobicContact CB-CD1 4.47Å; V1091-L1180 HydrophobicContact CG1-CD1 3.82Å
1092	W	90.1	Very high	89	Confident	113 Å²	113	37.6 Å²	37.6	43%	0.428	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	104.4	-177.6	-63.1	95.8	0	0	0	111.5	K1090 Y1137 Q1149 A1151	K1090-W1092 HydrophobicContact CD-CZ2 4.11Å; W1092-Y1137 HydrophobicContact CH2-CD2 4.35Å; W1092-Y1137 AromaticContact CH2-CE2 3.81Å; W1092-Y1137 HydrophobicContact CH2-CE2 3.81Å; W1092-Y1137 AromaticContact CZ3-CD2 3.68Å; W1092-Y1137 HydrophobicContact CZ3-CD2 3.68Å; W1092-Y1137 AromaticContact CZ3-CE2 3.52Å; W1092-Y1137 HydrophobicContact CZ3-CE2 3.52Å; W1092-Q1149 HydrophobicContact CE3-CB 4.2Å; W1092-A1151 HydrophobicContact CD2-CB 4.23Å; W1092-A1151 HydrophobicContact CE3-CB 3.76Å; W1092-A1151 HydrophobicContact CH2-CB 3.99Å; W1092-A1151 HydrophobicContact CZ2-CB 4.42Å; W1092-A1151 HydrophobicContact CZ3-CB 3.64Å
1093	L	92.1	Very high	89.1	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	134.2	163.5	-61.3	161.1	0	0	0	107.7	A1083 W1107 Q1149 L1150 V1152 Y1163 I1178	A1083-L1093 HydrophobicContact CB-CD2 3.68Å; L1093-W1107 HydrophobicContact CB-CH2 3.81Å; L1093-W1107 HydrophobicContact CB-CZ3 3.73Å; L1093-W1107 HydrophobicContact CD1-CZ3 4.38Å; L1093-Q1149 CarbonylContact O-C 3.52Å; L1093-Q1149 VanDerWaalsContact O-CA 3.23Å; L1093-Q1149 WeakPolarHBondContact O-CA 3.39Å; L1093-L1150 HydrophobicContact CB-CB 4.19Å; L1093-L1150 HydrophobicContact CD1-CB 4.33Å; L1093-L1150 HydrophobicContact CD1-CD2 3.8Å; L1093-L1150 HydrophobicContact CD1-CG 4.05Å; L1093-L1150 PolarHBondContact N-O 2.74Å; L1093-L1150 PolarHBondContact O-N 2.73Å; L1093-V1152 HydrophobicContact CD1-CG2 3.88Å; L1093-Y1163 HydrophobicContact CD1-CD1 3.44Å; L1093-Y1163 VanDerWaalsContact CD1-CD1 3.44Å; L1093-Y1163 HydrophobicContact CD1-CD2 4.08Å; L1093-Y1163 HydrophobicContact CD1-CE1 3.92Å; L1093-Y1163 HydrophobicContact CD1-CG 3.53Å; L1093-Y1163 HydrophobicContact CD2-CG 4.42Å; L1093-I1178 HydrophobicContact CB-CD1 4.27Å; L1093-I1178 HydrophobicContact CD2-CB 4.03Å; L1093-I1178 HydrophobicContact CD2-CD1 4.46Å; L1093-I1178 HydrophobicContact CD2-CG2 3.5Å; L1093-I1178 VanDerWaalsContact CD2-CG2 3.5Å
1094	T	90	Very high	89.2	Confident	8 Å²	8	41.4 Å²	41.4	5%	0.049	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	138.3	-171.7	-60.7	0	0	0	0	111.4	Y1080 Y1096 K1147 Q1149 I1178	Y1080-T1094 HydrophobicContact CD2-CG2 4.33Å; Y1080-T1094 HydrophobicContact CE2-CG2 4.44Å; Y1080-T1094 HydrophobicContact CG-CG2 4.4Å; T1094-Y1096 HydrophobicContact CG2-CD2 4.09Å; T1094-Y1096 HydrophobicContact CG2-CE2 3.71Å; T1094-K1147 HydrophobicContact CG2-CG 4.26Å; T1094-Q1149 HydrophobicContact CG2-CG 4.11Å; T1094-Q1149 PolarHBondContact OG1-NE2 2.93Å; T1094-I1178 WeakPolarHBondContact O-CD1 3.4Å
1095	C	90.9	Very high	89.2	Confident	2 Å²	2	42.6 Å²	42.6	1%	0.014	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	137.5	173.6	-84.3	0	0	0	0	110.3	I1074 I1097 K1147 A1148 C1165	I1074-C1095 HydrophobicContact CG2-CB 4.26Å; C1095-I1097 HydrophobicContact CB-CD1 4.28Å; C1095-K1147 CarbonylContact O-C 3.59Å; C1095-K1147 WeakPolarHBondContact O-CA 2.89Å; C1095-A1148 HydrophobicContact CB-CB 4.43Å; C1095-A1148 PolarHBondContact N-O 3.26Å; C1095-A1148 PolarHBondContact O-N 2.74Å; C1095-C1165 HydrophobicContact CB-CB 3.99Å; C1095-C1165 WeakPolarHBondContact SG-CB 3.42Å
1096	Y	89.5	Confident	89.4	Confident	12 Å²	12	44.6 Å²	44.6	5%	0.047	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	130.8	171.6	-74.2	-104.5	0	0	0	108.6	E995 I1074 I1075 L1077 Y1080 T1094 I1141 Y1146 K1147	E995-Y1096 HydrophobicContact CB-CD1 3.64Å; E995-Y1096 HydrophobicContact CB-CE1 3.74Å; E995-Y1096 HydrophobicContact CB-CG 4.07Å; E995-Y1096 HydrophobicContact CG-CD1 3.98Å; E995-Y1096 HydrophobicContact CG-CD2 4.38Å; E995-Y1096 HydrophobicContact CG-CE1 4.46Å; E995-Y1096 HydrophobicContact CG-CG 3.9Å; I1074-Y1096 CarbonylContact C-O 3.58Å; I1074-Y1096 WeakPolarHBondContact CA-O 3.4Å; I1074-Y1096 WeakPolarHBondContact CG2-O 3.36Å; I1075-Y1096 PolarHBondContact N-O 3.39Å; L1077-Y1096 HydrophobicContact CD1-CD2 4.45Å; Y1080-Y1096 HydrophobicContact CD2-CD2 4.16Å; Y1080-Y1096 HydrophobicContact CD2-CE2 4.04Å; Y1080-Y1096 HydrophobicContact CE2-CD2 4.04Å; Y1080-Y1096 AromaticContact CE2-CE2 3.5Å; Y1080-Y1096 HydrophobicContact CE2-CE2 3.5Å; T1094-Y1096 HydrophobicContact CG2-CD2 4.09Å; T1094-Y1096 HydrophobicContact CG2-CE2 3.71Å; Y1096-I1141 HydrophobicContact CD1-CD1 3.89Å; Y1096-I1141 HydrophobicContact CE1-CD1 3.51Å; Y1096-Y1146 CarbonylContact C-O 3.58Å; Y1096-Y1146 WeakPolarHBondContact CA-O 3.19Å; Y1096-K1147 HydrophobicContact CD1-CB 4.19Å; Y1096-K1147 HydrophobicContact CE1-CB 4.15Å; Y1096-K1147 HydrophobicContact CE1-CD 3.94Å; Y1096-K1147 HydrophobicContact CE1-CG 4.23Å; Y1096-K1147 HydrophobicContact CE2-CD 4.18Å; Y1096-K1147 HydrophobicContact CE2-CG 4.26Å; Y1096-K1147 WeakPolarHBondContact OH-CE 3.33Å; Y1096-K1147 PolarHBondContact OH-NZ 3.17Å
1097	I	91.1	Very high	89.8	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	119.1	-173.4	-48	93.8	0	0	0	108.5	P1072 I1074 C1095 T1099 I1105 Y1146 A1148 A1167	P1072-I1097 HydrophobicContact CB-CG2 3.94Å; I1074-I1097 HydrophobicContact CG1-CG1 3.98Å; I1074-I1097 HydrophobicContact CG1-CG2 4.25Å; C1095-I1097 HydrophobicContact CB-CD1 4.28Å; I1097-T1099 HydrophobicContact CB-CG2 4.31Å; I1097-T1099 HydrophobicContact CG2-CG2 3.74Å; I1097-I1105 HydrophobicContact CD1-CD1 4.01Å; I1097-I1105 HydrophobicContact CG1-CD1 4.45Å; I1097-Y1146 PolarHBondContact N-O 3.39Å; I1097-Y1146 PolarHBondContact O-N 2.96Å; I1097-A1148 HydrophobicContact CD1-CB 3.65Å; I1097-A1167 HydrophobicContact CG1-CB 4.02Å; I1097-A1167 HydrophobicContact CG2-CB 3.98Å
1098	R	91	Very high	90.2	Very high	17 Å²	17	35.8 Å²	35.8	6%	0.064	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	128.5	160.7	-77.7	-177	68.7	-171.6	-2.6	109.2	E994 E1042 D1043 F1070 P1072 K1073 I1075 G1144 L1145	E994-R1098 IonicContact OE1-NH1 3Å; E994-R1098 PolarHBondContact OE1-NH1 2.61Å; E994-R1098 WeakPolarHBondContact OE2-CD 3.5Å; E994-R1098 IonicContact OE2-CZ 3.33Å; E994-R1098 IonicContact OE2-NE 3.92Å; E994-R1098 IonicContact OE2-NH1 3.9Å; E994-R1098 PolarHBondContact OE2-NH1 3.35Å; E1042-R1098 VanDerWaalsContact C-NH2 3.29Å; E1042-R1098 PolarHBondContact O-NH2 2.81Å; D1043-R1098 IonicContact OD1-CZ 2.6Å; D1043-R1098 VanDerWaalsContact OD1-CZ 3.27Å; D1043-R1098 IonicContact OD1-NH1 3.87Å; D1043-R1098 PolarHBondContact OD1-NH1 3.43Å; D1043-R1098 IonicContact OD1-NH2 2.73Å; D1043-R1098 PolarHBondContact OD1-NH2 2.82Å; F1070-R1098 VanDerWaalsContact CE2-C 3.45Å; F1070-R1098 HydrophobicContact CE2-CB 3.9Å; F1070-R1098 HydrophobicContact CZ-CB 4.04Å; P1072-R1098 CarbonylContact C-O 3.53Å; P1072-R1098 WeakPolarHBondContact CA-O 3.31Å; K1073-R1098 HydrophobicContact CB-CB 4.39Å; K1073-R1098 PolarHBondContact N-O 2.85Å; K1073-R1098 PolarHBondContact O-N 2.69Å; I1075-R1098 HydrophobicContact CD1-CG 4.24Å; R1098-G1144 WeakPolarHBondContact CA-O 3.37Å; R1098-L1145 HydrophobicContact CG-CD1 3.85Å
1099	T	91.7	Very high	90.5	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.9	147.8	-172.8	172.3	0	0	0	0	109.1	F1070 I1097 P1101 P1103 G1144 Y1146 N1169	F1070-T1099 VanDerWaalsContact CE2-N 3.33Å; I1097-T1099 HydrophobicContact CB-CG2 4.31Å; I1097-T1099 HydrophobicContact CG2-CG2 3.74Å; T1099-P1101 PolarHBondContact OG1-O 2.86Å; T1099-P1103 HydrophobicContact CG2-CB 3.99Å; T1099-P1103 HydrophobicContact CG2-CG 3.7Å; T1099-G1144 PolarHBondContact N-O 3.33Å; T1099-G1144 VanDerWaalsContact N-O 3.09Å; T1099-G1144 CarbonylContact O-C 3.55Å; T1099-G1144 WeakPolarHBondContact O-CA 3.31Å; T1099-Y1146 HydrophobicContact CG2-CD2 3.48Å; T1099-Y1146 VanDerWaalsContact CG2-CD2 3.48Å; T1099-Y1146 HydrophobicContact CG2-CE2 3.87Å; T1099-Y1146 HydrophobicContact CG2-CG 4.36Å; T1099-Y1146 WeakPolarHBondContact O-CE2 3.37Å; T1099-N1169 PolarHBondContact OG1-ND2 3.26Å
1100	E	90.7	Very high	90.5	Very high	11 Å²	11	36.1 Å²	36.1	5%	0.051	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	127.2	167.7	-168.1	67.7	-122.2	0	0	108.6	L1067 Y1068 H1069 F1070 G1144 N1169	L1067-E1100 HydrophobicContact CB-CG 4.25Å; L1067-E1100 VanDerWaalsContact CD2-OE2 3.26Å; L1067-E1100 WeakPolarHBondContact CD2-OE2 3.33Å; Y1068-E1100 VanDerWaalsContact O-CB 3.29Å; Y1068-E1100 WeakPolarHBondContact O-CB 3.26Å; Y1068-E1100 WeakPolarHBondContact O-CG 3.47Å; H1069-E1100 CarbonylContact C-O 2.76Å; H1069-E1100 WeakPolarHBondContact CA-O 3.19Å; F1070-E1100 HydrophobicContact CD1-CB 3.8Å; F1070-E1100 HydrophobicContact CE1-CB 3.67Å; F1070-E1100 PolarHBondContact N-O 2.79Å; F1070-E1100 PolarHBondContact O-N 2.81Å; E1100-G1144 WeakPolarHBondContact OE2-CA 3.43Å; E1100-G1144 PolarHBondContact OE2-N 3.21Å; E1100-N1169 PolarHBondContact O-ND2 2.88Å
1101	P	90	Very high	90.2	Very high	31 Å²	31	38.5 Å²	38.5	20%	0.201	20%	0.195	C	C	.	.	S	Bend	cis	-70.5	178.7	0.4	32.4	-37.8	0	0	0	113.7	T1099 N1169	T1099-P1101 PolarHBondContact OG1-O 2.86Å; P1101-N1169 PolarHBondContact O-ND2 2.78Å
1102	T	89.1	Confident	89.9	Confident	79 Å²	79	45.8 Å²	45.8	49%	0.485	23%	0.226	S	C	.	.			trans	-38.1	130.3	172.6	-55.9	0	0	0	0	113	L1138 Y1146	T1102-L1138 HydrophobicContact CG2-CD2 4.07Å; T1102-Y1146 WeakPolarHBondContact CA-OH 3.42Å; T1102-Y1146 HydrophobicContact CG2-CD1 4.37Å; T1102-Y1146 HydrophobicContact CG2-CE1 3.72Å; T1102-Y1146 PolarHBondContact N-OH 2.9Å; T1102-Y1146 PolarHBondContact OG1-OH 2.87Å
1103	P	92.1	Very high	89.8	Confident	7 Å²	7	46 Å²	46	5%	0.045	24%	0.235	C	C	.	.			trans	-82.8	151.3	-177.2	35.5	-35.5	0	0	0	112.1	T1099 I1105 L1138 Y1146 A1167 A1168	T1099-P1103 HydrophobicContact CG2-CB 3.99Å; T1099-P1103 HydrophobicContact CG2-CG 3.7Å; P1103-I1105 HydrophobicContact CB-CD1 4.04Å; P1103-I1105 HydrophobicContact CG-CD1 3.86Å; P1103-I1105 HydrophobicContact CG-CG1 4.41Å; P1103-L1138 HydrophobicContact CG-CD1 4.33Å; P1103-L1138 HydrophobicContact CG-CD2 4.28Å; P1103-L1138 WeakPolarHBondContact O-CD2 3.21Å; P1103-Y1146 HydrophobicContact CG-CG 4.36Å; P1103-A1167 HydrophobicContact CB-CB 4.46Å; P1103-A1168 CarbonylContact C-O 3.55Å; P1103-A1168 WeakPolarHBondContact CA-O 3.16Å
1104	Q	91.1	Very high	89.4	Confident	156 Å²	156	46.4 Å²	46.4	73%	0.729	24%	0.237	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-79.8	137.5	153.5	-64.3	-174	-3.9	0	0	108.8	A1167 A1168	Q1104-A1167 WeakPolarHBondContact O-CA 3.28Å; Q1104-A1168 PolarHBondContact N-O 3.19Å; Q1104-A1168 PolarHBondContact O-N 3.23Å
1105	I	91.5	Very high	88.5	Confident	31 Å²	31	51.1 Å²	51.1	16%	0.159	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	127	179.7	-56.1	-62	0	0	0	109.8	I1097 P1103 L1138 A1148 Q1166 A1167	I1097-I1105 HydrophobicContact CD1-CD1 4.01Å; I1097-I1105 HydrophobicContact CG1-CD1 4.45Å; P1103-I1105 HydrophobicContact CB-CD1 4.04Å; P1103-I1105 HydrophobicContact CG-CD1 3.86Å; P1103-I1105 HydrophobicContact CG-CG1 4.41Å; I1105-L1138 HydrophobicContact CD1-CD1 4.48Å; I1105-L1138 HydrophobicContact CG1-CD1 3.99Å; I1105-L1138 HydrophobicContact CG1-CD2 4.27Å; I1105-A1148 HydrophobicContact CD1-CB 4.08Å; I1105-A1148 HydrophobicContact CG1-CB 4.01Å; I1105-A1148 HydrophobicContact CG2-CB 3.98Å; I1105-Q1166 WeakPolarHBondContact CA-O 3.45Å; I1105-A1167 HydrophobicContact CD1-CB 3.58Å
1106	V	91	Very high	87.4	Confident	47 Å²	47	53 Å²	53	29%	0.285	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	137.7	171.8	176.7	0	0	0	0	108.6	L1113 Q1166	V1106-L1113 HydrophobicContact CG1-CD1 4.15Å; V1106-L1113 HydrophobicContact CG1-CD2 3.83Å; V1106-L1113 HydrophobicContact CG1-CG 3.71Å; V1106-Q1166 HydrophobicContact CB-CB 4.34Å; V1106-Q1166 PolarHBondContact N-O 2.88Å; V1106-Q1166 PolarHBondContact O-N 3.4Å
1107	W	91.8	Very high	85.7	Confident	5 Å²	5	57 Å²	57	2%	0.019	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	133.2	172.6	-71.4	91.4	0	0	0	110.6	L1093 I1114 M1116 A1148 L1150 S1164 C1165 I1178	L1093-W1107 HydrophobicContact CB-CH2 3.81Å; L1093-W1107 HydrophobicContact CB-CZ3 3.73Å; L1093-W1107 HydrophobicContact CD1-CZ3 4.38Å; W1107-I1114 HydrophobicContact CB-CD1 4.03Å; W1107-I1114 WeakPolarHBondContact O-CB 3.44Å; W1107-I1114 PolarHBondContact O-N 3.08Å; W1107-M1116 HydrophobicContact CB-CE 3.98Å; W1107-M1116 HydrophobicContact CG-CE 4.4Å; W1107-A1148 HydrophobicContact CZ2-CB 4.31Å; W1107-L1150 HydrophobicContact CB-CD2 3.82Å; W1107-L1150 HydrophobicContact CD2-CB 3.58Å; W1107-L1150 HydrophobicContact CD2-CD2 3.74Å; W1107-L1150 HydrophobicContact CD2-CG 4.29Å; W1107-L1150 VanDerWaalsContact CE2-CB 3.47Å; W1107-L1150 HydrophobicContact CE3-CB 3.94Å; W1107-L1150 HydrophobicContact CE3-CD2 3.81Å; W1107-L1150 HydrophobicContact CG-CB 4.04Å; W1107-L1150 HydrophobicContact CG-CD2 3.76Å; W1107-L1150 HydrophobicContact CG-CG 4.44Å; W1107-L1150 HydrophobicContact CH2-CB 4.09Å; W1107-L1150 HydrophobicContact CZ2-CB 3.75Å; W1107-L1150 HydrophobicContact CZ3-CB 4.18Å; W1107-S1164 WeakPolarHBondContact CA-O 2.83Å; W1107-C1165 HydrophobicContact CD2-CB 4.3Å; W1107-C1165 HydrophobicContact CE3-CB 3.99Å; W1107-C1165 HydrophobicContact CH2-CB 3.75Å; W1107-C1165 HydrophobicContact CZ2-CB 4.05Å; W1107-C1165 HydrophobicContact CZ3-CB 3.72Å; W1107-I1178 HydrophobicContact CH2-CD1 4.18Å; W1107-I1178 HydrophobicContact CZ3-CD1 4.08Å
1108	L	91.5	Very high	83.3	Confident	20 Å²	20	62.5 Å²	62.5	11%	0.105	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	146.5	178.8	-60.8	149.6	0	0	0	108.8	K1112 L1113 Y1163 S1164 Q1166	L1108-K1112 CarbonylContact C-O 3.3Å; L1108-K1112 VanDerWaalsContact CA-O 3.26Å; L1108-K1112 WeakPolarHBondContact CA-O 3.34Å; L1108-L1113 HydrophobicContact CD2-CB 4.41Å; L1108-Y1163 CarbonylContact O-C 3.53Å; L1108-Y1163 WeakPolarHBondContact O-CA 3.11Å; L1108-S1164 PolarHBondContact N-O 2.78Å; L1108-S1164 PolarHBondContact O-N 3.35Å; L1108-Q1166 HydrophobicContact CD1-CB 4.44Å
1109	K	90.7	Very high	80.6	Confident	32 Å²	32	69 Å²	69	14%	0.139	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	127	162.8	-170.7	-166.7	-168.6	-77.5	0	108.1	N1111 K1112 I1114 Y1158 D1159 F1160 Y1163	K1109-N1111 PolarHBondContact O-N 2.99Å; K1109-K1112 PolarHBondContact N-O 2.82Å; K1109-K1112 PolarHBondContact O-N 2.8Å; K1109-I1114 HydrophobicContact CB-CD1 4.07Å; K1109-I1114 HydrophobicContact CB-CG1 4Å; K1109-Y1158 PolarHBondContact NZ-O 3.41Å; K1109-D1159 WeakPolarHBondContact CE-O 3.25Å; K1109-F1160 PolarHBondContact NZ-O 3.49Å; K1109-Y1163 HydrophobicContact CB-CD1 4.08Å; K1109-Y1163 HydrophobicContact CB-CE1 3.9Å; K1109-Y1163 HydrophobicContact CD-CE1 4.1Å; K1109-Y1163 HydrophobicContact CD-CE2 4.16Å; K1109-Y1163 WeakPolarHBondContact CD-OH 3.39Å; K1109-Y1163 WeakPolarHBondContact CE-OH 3.16Å; K1109-Y1163 HydrophobicContact CG-CD1 4.22Å; K1109-Y1163 HydrophobicContact CG-CD2 4.32Å; K1109-Y1163 HydrophobicContact CG-CE1 3.84Å; K1109-Y1163 HydrophobicContact CG-CE2 3.93Å; K1109-Y1163 HydrophobicContact CG-CG 4.44Å
1110	D	85.1	Confident	77.6	Confident	89 Å²	89	75.9 Å²	75.9	48%	0.476	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.3	45	179.7	-47.9	-48.3	0	0	0	111.9	K1112 S1162	D1110-K1112 PolarHBondContact O-N 2.85Å; D1110-S1162 PolarHBondContact N-O 2.98Å; D1110-S1162 PolarHBondContact OD1-N 2.91Å
1111	N	83.5	Confident	74.7	Confident	136 Å²	136	84.3 Å²	84.3	73%	0.727	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	16.5	-173	-67.9	-15.9	0	0	0	116.7	K1109	K1109-N1111 PolarHBondContact O-N 2.99Å
1112	K	84.4	Confident	71.9	Confident	164 Å²	164	87.6 Å²	87.6	71%	0.713	47%	0.466	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107	136.6	171	-66.7	178.2	-178.3	175.2	0	110.9	L1108 K1109 D1110 I1114	L1108-K1112 CarbonylContact C-O 3.3Å; L1108-K1112 VanDerWaalsContact CA-O 3.26Å; L1108-K1112 WeakPolarHBondContact CA-O 3.34Å; K1109-K1112 PolarHBondContact N-O 2.82Å; K1109-K1112 PolarHBondContact O-N 2.8Å; D1110-K1112 PolarHBondContact O-N 2.85Å; K1112-I1114 PolarHBondContact O-N 2.87Å
1113	L	86.6	Confident	69	Low	118 Å²	118	93 Å²	93	62%	0.618	48%	0.483	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.3	122.9	179.2	-142.5	161.6	0	0	0	109.2	V1106 L1108 P1115	V1106-L1113 HydrophobicContact CG1-CD1 4.15Å; V1106-L1113 HydrophobicContact CG1-CD2 3.83Å; V1106-L1113 HydrophobicContact CG1-CG 3.71Å; L1108-L1113 HydrophobicContact CD2-CB 4.41Å; L1113-P1115 WeakPolarHBondContact O-CD 3.44Å
1114	I	85.2	Confident	66.1	Low	9 Å²	9	99.9 Å²	99.9	5%	0.046	52%	0.519	C	S	.	.			trans	-70.8	123	178.5	-62	178.2	0	0	0	107.8	W1107 K1109 K1112 M1116 Y1134 L1150 Y1163	W1107-I1114 HydrophobicContact CB-CD1 4.03Å; W1107-I1114 WeakPolarHBondContact O-CB 3.44Å; W1107-I1114 PolarHBondContact O-N 3.08Å; K1109-I1114 HydrophobicContact CB-CD1 4.07Å; K1109-I1114 HydrophobicContact CB-CG1 4Å; K1112-I1114 PolarHBondContact O-N 2.87Å; I1114-M1116 HydrophobicContact CB-CE 4Å; I1114-M1116 HydrophobicContact CG2-CE 3.65Å; I1114-M1116 HydrophobicContact CG2-SD 4.5Å; I1114-M1116 PolarHBondContact O-N 3.28Å; I1114-Y1134 HydrophobicContact CD1-CE1 4.46Å; I1114-Y1134 HydrophobicContact CG2-CD1 4.25Å; I1114-Y1134 HydrophobicContact CG2-CD2 3.47Å; I1114-Y1134 VanDerWaalsContact CG2-CD2 3.47Å; I1114-Y1134 HydrophobicContact CG2-CE2 3.83Å; I1114-Y1134 HydrophobicContact CG2-CG 3.7Å; I1114-L1150 HydrophobicContact CD1-CD2 3.63Å; I1114-Y1163 HydrophobicContact CD1-CD1 3.71Å; I1114-Y1163 HydrophobicContact CD1-CE1 3.65Å
1115	P	70.7	Confident	63.1	Low	107 Å²	107	97.1 Å²	97.1	70%	0.695	52%	0.517	S	S	*	.			trans	-66.5	100.3	171.8	-15.5	30.6	0	0	0	108.4	L1113	L1113-P1115 WeakPolarHBondContact O-CD 3.44Å
1116	M	68.3	Low	60.4	Low	43 Å²	43	102.7 Å²	102.7	21%	0.212	55%	0.547	C	S	.	.			trans	-71.1	128.9	161.9	-64.3	-59	155.2	0	0	107	W1107 I1114 T1118 N1136 L1150	W1107-M1116 HydrophobicContact CB-CE 3.98Å; W1107-M1116 HydrophobicContact CG-CE 4.4Å; I1114-M1116 HydrophobicContact CB-CE 4Å; I1114-M1116 HydrophobicContact CG2-CE 3.65Å; I1114-M1116 HydrophobicContact CG2-SD 4.5Å; I1114-M1116 PolarHBondContact O-N 3.28Å; M1116-T1118 PolarHBondContact O-N 3.4Å; M1116-N1136 HydrophobicContact CE-CB 4.22Å; M1116-N1136 HydrophobicContact SD-CB 3.95Å; M1116-L1150 HydrophobicContact CE-CD1 3.66Å; M1116-L1150 HydrophobicContact CE-CD2 4.28Å; M1116-L1150 HydrophobicContact SD-CD1 4.44Å
1117	D	53.8	Low	57.8	Low	96 Å²	96	105 Å²	105	51%	0.513	57%	0.566	S	S	.	*			trans	-65.4	82	172.6	-70.8	-38.7	0	0	0	109.5	K1132	D1117-K1132 HydrophobicContact CB-CD 4.02Å; D1117-K1132 VanDerWaalsContact CB-NZ 3.34Å; D1117-K1132 PolarHBondContact O-NZ 3.29Å
1118	T	39.7	Very low	55.2	Low	114 Å²	114	114 Å²	114	70%	0.699	61%	0.605	S	S	*	*			trans	-49.2	139.4	158.1	45.4	0	0	0	0	107.8	M1116 I1120	M1116-T1118 PolarHBondContact O-N 3.4Å; T1118-I1120 PolarHBondContact O-N 3.3Å
1119	L	33.5	Very low	52.7	Low	154 Å²	154	120.4 Å²	120.4	81%	0.806	64%	0.639	S	S	*	*			trans	-71.5	81	-177.3	-74.4	164	0	0	0	110	Q1121	L1119-Q1121 PolarHBondContact O-N 3.41Å
1120	I	30.4	Very low	50.6	Low	144 Å²	144	121.6 Å²	121.6	74%	0.738	66%	0.661	S	S	*	*			trans	-49.7	128.5	157.8	-63.4	177.3	0	0	0	106	T1118 S1122	T1118-I1120 PolarHBondContact O-N 3.3Å; I1120-S1122 PolarHBondContact O-N 2.83Å
1121	Q	29.5	Very low	49.3	Very low	188 Å²	188	123.7 Å²	123.7	88%	0.879	67%	0.671	S	S	*	*			trans	-75.7	59.9	-172.1	-63.4	179	-0.2	0	0	111.5	L1119 K1123	L1119-Q1121 PolarHBondContact O-N 3.41Å; Q1121-K1123 VanDerWaalsContact C-N 3.26Å; Q1121-K1123 PolarHBondContact O-N 2.83Å
1122	S	30.1	Very low	48.7	Very low	100 Å²	100	120.8 Å²	120.8	70%	0.699	65%	0.652	S	S	*	*			trans	-78	71.8	-178.2	-171.7	0	0	0	0	111.2	I1120 N1124	I1120-S1122 PolarHBondContact O-N 2.83Å; S1122-N1124 VanDerWaalsContact C-N 3.29Å; S1122-N1124 PolarHBondContact O-N 3.14Å
1123	K	29.2	Very low	48.7	Very low	194 Å²	194	115.9 Å²	115.9	84%	0.843	63%	0.63	S	S	*	*			trans	-64.5	92	156.1	-75.6	-176.6	176.9	179.1	0	108.5	Q1121	Q1121-K1123 VanDerWaalsContact C-N 3.26Å; Q1121-K1123 PolarHBondContact O-N 2.83Å
1124	N	30	Very low	48.7	Very low	150 Å²	150	112.2 Å²	112.2	80%	0.802	61%	0.609	S	S	*	*			trans	176.1	149.9	145.1	-88.8	-19.1	0	0	0	112.5	S1122	S1122-N1124 VanDerWaalsContact C-N 3.29Å; S1122-N1124 PolarHBondContact O-N 3.14Å
1125	S	29.5	Very low	48.8	Very low	98 Å²	98	114.1 Å²	114.1	69%	0.685	62%	0.617	S	S	*	*			trans	33.5	125.4	160.7	-89.3	0	0	0	0	122.8
1126	D	33.7	Very low	49.6	Very low	148 Å²	148	113 Å²	113	79%	0.791	61%	0.606	S	S	*	*				57.9	60.9	128	-56.1	-64.9	0	0	0	118.9
1127	S	36.6	Very low	50.6	Low	96 Å²	96	115.7 Å²	115.7	67%	0.671	61%	0.614	S	S	*	*			trans	-120.7	89.5	153.2	-166.9	0	0	0	0	111.3
1128	K	37.6	Very low	52.3	Low	193 Å²	193	114.6 Å²	114.6	84%	0.839	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	126.9	163.5	-71	178.3	179.5	173.9	0	108.3
1129	N	38.8	Very low	54.6	Low	155 Å²	155	112.7 Å²	112.7	83%	0.829	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	66.5	34.6	172.7	-56.7	1.5	0	0	0	116.7	I1131	N1129-I1131 VanDerWaalsContact C-N 3.32Å; N1129-I1131 PolarHBondContact O-N 3.13Å
1130	G	45.8	Very low	57.1	Low	58 Å²	58	110.1 Å²	110.1	60%	0.598	58%	0.576	S	S	*	*			trans	-70.3	78.8	165.8	0	0	0	0	0	113.1	K1132	G1130-K1132 PolarHBondContact O-N 3.05Å
1131	I	57.8	Low	59.5	Low	133 Å²	133	104.3 Å²	104.3	68%	0.682	55%	0.546	S	S	*	.			trans	-69.5	116.9	172.5	-59	176.5	0	0	0	108.6	N1129 N1153	N1129-I1131 VanDerWaalsContact C-N 3.32Å; N1129-I1131 PolarHBondContact O-N 3.13Å; I1131-N1153 HydrophobicContact CG2-CB 3.89Å
1132	K	71.4	Confident	62	Low	75 Å²	75	96.6 Å²	96.6	33%	0.326	51%	0.509	S	S	.	.			trans	-60.1	137	176	-74.5	-169	172	-173.5	0	110.6	D1117 G1130 Y1134 E1135 N1153	D1117-K1132 HydrophobicContact CB-CD 4.02Å; D1117-K1132 VanDerWaalsContact CB-NZ 3.34Å; D1117-K1132 PolarHBondContact O-NZ 3.29Å; G1130-K1132 PolarHBondContact O-N 3.05Å; K1132-Y1134 VanDerWaalsContact C-N 3.28Å; K1132-Y1134 PolarHBondContact O-N 2.94Å; K1132-E1135 HydrophobicContact CB-CG 4.1Å; K1132-N1153 WeakPolarHBondContact O-CB 3.5Å; K1132-N1153 PolarHBondContact O-ND2 2.84Å
1133	K	85	Confident	64.6	Low	60 Å²	60	92 Å²	92	26%	0.261	48%	0.477	S	S	.	.	S	Bend	trans	-64.2	-36	179.3	-179.6	57.9	-179.7	174.5	0	112.3	N1153 D1154 D1159	K1133-N1153 VanDerWaalsContact CD-O 3.29Å; K1133-N1153 WeakPolarHBondContact CD-O 3.23Å; K1133-N1153 WeakPolarHBondContact CE-O 3.45Å; K1133-N1153 PolarHBondContact NZ-O 2.9Å; K1133-N1153 PolarHBondContact O-N 2.87Å; K1133-D1154 PolarHBondContact NZ-O 3.09Å; K1133-D1159 WeakPolarHBondContact CE-OD1 3.24Å; K1133-D1159 IonicContact NZ-OD1 2.69Å; K1133-D1159 PolarHBondContact NZ-OD1 2.86Å; K1133-D1159 VanDerWaalsContact NZ-OD1 3.16Å; K1133-D1159 IonicContact NZ-OD2 3.13Å; K1133-D1159 PolarHBondContact NZ-OD2 3.27Å
1134	Y	86.9	Confident	67.3	Low	42 Å²	42	82.9 Å²	82.9	17%	0.165	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	135.4	-178	-64	-64.4	0	0	0	110.5	I1114 K1132 L1150 A1151 V1152 Y1163	I1114-Y1134 HydrophobicContact CD1-CE1 4.46Å; I1114-Y1134 HydrophobicContact CG2-CD1 4.25Å; I1114-Y1134 HydrophobicContact CG2-CD2 3.47Å; I1114-Y1134 VanDerWaalsContact CG2-CD2 3.47Å; I1114-Y1134 HydrophobicContact CG2-CE2 3.83Å; I1114-Y1134 HydrophobicContact CG2-CG 3.7Å; K1132-Y1134 VanDerWaalsContact C-N 3.28Å; K1132-Y1134 PolarHBondContact O-N 2.94Å; Y1134-L1150 HydrophobicContact CD1-CD1 4.07Å; Y1134-L1150 HydrophobicContact CD1-CD2 4.47Å; Y1134-L1150 HydrophobicContact CG-CD1 4.49Å; Y1134-A1151 WeakPolarHBondContact CA-O 3.46Å; Y1134-V1152 HydrophobicContact CD1-CG1 4.41Å; Y1134-V1152 HydrophobicContact CD1-CG2 4.09Å; Y1134-V1152 HydrophobicContact CE1-CB 4.43Å; Y1134-V1152 HydrophobicContact CE1-CG1 3.93Å; Y1134-V1152 HydrophobicContact CE1-CG2 3.93Å; Y1134-Y1163 HydrophobicContact CE1-CE1 4.12Å; Y1134-Y1163 PolarHBondContact OH-OH 3.27Å
1135	E	86.8	Confident	70.1	Confident	49 Å²	49	75.7 Å²	75.7	23%	0.229	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	118.6	176.5	-61.8	169.6	129.7	0	0	109.1	K1090 K1132 Y1137 L1150 A1151 N1153	K1090-E1135 WeakPolarHBondContact CE-OE2 3.41Å; K1090-E1135 IonicContact NZ-OE2 3.99Å; K1090-E1135 PolarHBondContact NZ-OE2 3.03Å; K1132-E1135 HydrophobicContact CB-CG 4.1Å; E1135-Y1137 HydrophobicContact CB-CE2 3.68Å; E1135-L1150 WeakPolarHBondContact O-CA 3.35Å; E1135-A1151 HydrophobicContact CB-CB 4.1Å; E1135-A1151 PolarHBondContact N-O 2.81Å; E1135-A1151 VanDerWaalsContact N-O 3.08Å; E1135-A1151 PolarHBondContact O-N 2.82Å; E1135-N1153 PolarHBondContact OE2-ND2 2.88Å
1136	N	87.4	Confident	72.9	Confident	84 Å²	84	71.5 Å²	71.5	45%	0.449	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	142.8	179.3	67.2	-38.7	0	0	0	112.2	M1116 Q1149	M1116-N1136 HydrophobicContact CE-CB 4.22Å; M1116-N1136 HydrophobicContact SD-CB 3.95Å; N1136-Q1149 WeakPolarHBondContact CA-O 3.48Å
1137	Y	89.3	Confident	75.5	Confident	98 Å²	98	66.2 Å²	66.2	38%	0.384	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	141.9	179.7	-56.6	-94.3	0	0	0	109.7	W1092 E1135 A1148 Q1149 A1151	W1092-Y1137 HydrophobicContact CH2-CD2 4.35Å; W1092-Y1137 AromaticContact CH2-CE2 3.81Å; W1092-Y1137 HydrophobicContact CH2-CE2 3.81Å; W1092-Y1137 AromaticContact CZ3-CD2 3.68Å; W1092-Y1137 HydrophobicContact CZ3-CD2 3.68Å; W1092-Y1137 AromaticContact CZ3-CE2 3.52Å; W1092-Y1137 HydrophobicContact CZ3-CE2 3.52Å; E1135-Y1137 HydrophobicContact CB-CE2 3.68Å; Y1137-A1148 CarbonylContact O-C 3.53Å; Y1137-A1148 WeakPolarHBondContact O-CA 3.43Å; Y1137-Q1149 PolarHBondContact N-O 2.87Å; Y1137-Q1149 PolarHBondContact O-N 3.02Å; Y1137-A1151 HydrophobicContact CE2-CB 4.32Å
1138	L	90.4	Very high	78.1	Confident	73 Å²	73	61.7 Å²	61.7	38%	0.382	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	115.9	170.3	179	60.2	0	0	0	108.3	T1102 P1103 I1105 Y1146 A1148	T1102-L1138 HydrophobicContact CG2-CD2 4.07Å; P1103-L1138 HydrophobicContact CG-CD1 4.33Å; P1103-L1138 HydrophobicContact CG-CD2 4.28Å; P1103-L1138 WeakPolarHBondContact O-CD2 3.21Å; I1105-L1138 HydrophobicContact CD1-CD1 4.48Å; I1105-L1138 HydrophobicContact CG1-CD1 3.99Å; I1105-L1138 HydrophobicContact CG1-CD2 4.27Å; L1138-Y1146 HydrophobicContact CD1-CD1 4.27Å; L1138-Y1146 HydrophobicContact CD1-CG 4.48Å; L1138-Y1146 HydrophobicContact CG-CD1 4.45Å; L1138-A1148 HydrophobicContact CD1-CB 4.41Å
1139	I	86.5	Confident	80.7	Confident	75 Å²	75	53.9 Å²	53.9	39%	0.385	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	118.9	-176.4	-56.9	168.6	0	0	0	107.3	I1141 Y1146 K1147	I1139-I1141 HydrophobicContact CG2-CG1 4.46Å; I1139-Y1146 CarbonylContact O-C 3.59Å; I1139-Y1146 WeakPolarHBondContact O-CA 3.27Å; I1139-K1147 HydrophobicContact CB-CB 4.31Å; I1139-K1147 HydrophobicContact CD1-CD 4.41Å; I1139-K1147 PolarHBondContact N-O 3.28Å; I1139-K1147 PolarHBondContact O-N 3.23Å
1140	H	86	Confident	83.2	Confident	100 Å²	100	46.5 Å²	46.5	46%	0.463	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	119.5	166.8	171.4	-108.6	0	0	0	108.2	R1142 Y1146	H1140-R1142 PolarHBondContact NE2-O 2.96Å; H1140-Y1146 HydrophobicContact CB-CD1 3.94Å; H1140-Y1146 HydrophobicContact CB-CE1 3.86Å; H1140-Y1146 AromaticContact CD2-CE1 3.6Å; H1140-Y1146 AromaticContact CD2-CZ 3.65Å
1141	I	82.3	Confident	85.3	Confident	21 Å²	21	43.8 Å²	43.8	11%	0.108	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	-53	-178.5	-66.9	173	0	0	0	109.6	D997 Y1096 I1139 L1145 K1147	D997-I1141 HydrophobicContact CB-CG2 4.5Å; D997-I1141 WeakPolarHBondContact OD1-CG2 3.41Å; Y1096-I1141 HydrophobicContact CD1-CD1 3.89Å; Y1096-I1141 HydrophobicContact CE1-CD1 3.51Å; I1139-I1141 HydrophobicContact CG2-CG1 4.46Å; I1141-L1145 HydrophobicContact CB-CD2 4.38Å; I1141-L1145 HydrophobicContact CB-CG 4.44Å; I1141-L1145 HydrophobicContact CD1-CD2 4.35Å; I1141-L1145 HydrophobicContact CD1-CG 4.45Å; I1141-L1145 HydrophobicContact CG2-CD2 4.28Å; I1141-L1145 PolarHBondContact N-O 2.88Å; I1141-K1147 HydrophobicContact CD1-CB 3.69Å; I1141-K1147 HydrophobicContact CD1-CD 4.3Å; I1141-K1147 HydrophobicContact CG1-CB 4.26Å
1142	R	81.1	Confident	86.9	Confident	26 Å²	26	37.4 Å²	37.4	10%	0.098	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	161.4	-176.6	60.9	-175	179.2	78.5	-2.9	108.6	E994 V996 E998 H1140 G1144 L1145	E994-R1142 PolarHBondContact O-NH2 3.3Å; V996-R1142 PolarHBondContact O-NE 3.11Å; E998-R1142 HydrophobicContact CG-CB 3.77Å; H1140-R1142 PolarHBondContact NE2-O 2.96Å; R1142-G1144 PolarHBondContact O-N 3.04Å; R1142-L1145 HydrophobicContact CG-CB 3.81Å; R1142-L1145 HydrophobicContact CG-CD2 4.08Å; R1142-L1145 PolarHBondContact N-O 3.29Å; R1142-L1145 PolarHBondContact O-N 3.3Å; R1142-L1145 VanDerWaalsContact O-O 3.09Å
1143	P	84.1	Confident	87.7	Confident	4 Å²	4	34.4 Å²	34.4	3%	0.026	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-42.8	129	176.6	-33.4	38.3	0	0	0	112.4	V1045 N1065 L1067 L1145	V1045-P1143 HydrophobicContact CG1-CB 3.99Å; N1065-P1143 HydrophobicContact CB-CG 3.8Å; L1067-P1143 HydrophobicContact CD2-CB 3.72Å; L1067-P1143 HydrophobicContact CD2-CG 4.36Å; P1143-L1145 VanDerWaalsContact C-N 3.3Å; P1143-L1145 PolarHBondContact O-N 3.37Å
1144	G	86.1	Confident	87.8	Confident	2 Å²	2	34.3 Å²	34.3	2%	0.021	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.7	4.7	-177.7	0	0	0	0	0	117.5	R1098 T1099 E1100 R1142	R1098-G1144 WeakPolarHBondContact CA-O 3.37Å; T1099-G1144 PolarHBondContact N-O 3.33Å; T1099-G1144 VanDerWaalsContact N-O 3.09Å; T1099-G1144 CarbonylContact O-C 3.55Å; T1099-G1144 WeakPolarHBondContact O-CA 3.31Å; E1100-G1144 WeakPolarHBondContact OE2-CA 3.43Å; E1100-G1144 PolarHBondContact OE2-N 3.21Å; R1142-G1144 PolarHBondContact O-N 3.04Å
1145	L	88.2	Confident	87.9	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	124.5	-179.8	179.9	68.5	0	0	0	113.1	I1075 R1098 I1141 R1142 P1143	I1075-L1145 HydrophobicContact CD1-CD1 3.95Å; R1098-L1145 HydrophobicContact CG-CD1 3.85Å; I1141-L1145 HydrophobicContact CB-CD2 4.38Å; I1141-L1145 HydrophobicContact CB-CG 4.44Å; I1141-L1145 HydrophobicContact CD1-CD2 4.35Å; I1141-L1145 HydrophobicContact CD1-CG 4.45Å; I1141-L1145 HydrophobicContact CG2-CD2 4.28Å; I1141-L1145 PolarHBondContact N-O 2.88Å; R1142-L1145 HydrophobicContact CG-CB 3.81Å; R1142-L1145 HydrophobicContact CG-CD2 4.08Å; R1142-L1145 PolarHBondContact N-O 3.29Å; R1142-L1145 PolarHBondContact O-N 3.3Å; R1142-L1145 VanDerWaalsContact O-O 3.09Å; P1143-L1145 VanDerWaalsContact C-N 3.3Å; P1143-L1145 PolarHBondContact O-N 3.37Å
1146	Y	89.4	Confident	88	Confident	9 Å²	9	35.5 Å²	35.5	4%	0.035	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	152.3	-178.3	-59.4	-103.5	0	0	0	111.3	Y1096 I1097 T1099 T1102 P1103 L1138 I1139 H1140	Y1096-Y1146 CarbonylContact C-O 3.58Å; Y1096-Y1146 WeakPolarHBondContact CA-O 3.19Å; I1097-Y1146 PolarHBondContact N-O 3.39Å; I1097-Y1146 PolarHBondContact O-N 2.96Å; T1099-Y1146 HydrophobicContact CG2-CD2 3.48Å; T1099-Y1146 VanDerWaalsContact CG2-CD2 3.48Å; T1099-Y1146 HydrophobicContact CG2-CE2 3.87Å; T1099-Y1146 HydrophobicContact CG2-CG 4.36Å; T1099-Y1146 WeakPolarHBondContact O-CE2 3.37Å; T1102-Y1146 WeakPolarHBondContact CA-OH 3.42Å; T1102-Y1146 HydrophobicContact CG2-CD1 4.37Å; T1102-Y1146 HydrophobicContact CG2-CE1 3.72Å; T1102-Y1146 PolarHBondContact N-OH 2.9Å; T1102-Y1146 PolarHBondContact OG1-OH 2.87Å; P1103-Y1146 HydrophobicContact CG-CG 4.36Å; L1138-Y1146 HydrophobicContact CD1-CD1 4.27Å; L1138-Y1146 HydrophobicContact CD1-CG 4.48Å; L1138-Y1146 HydrophobicContact CG-CD1 4.45Å; I1139-Y1146 CarbonylContact O-C 3.59Å; I1139-Y1146 WeakPolarHBondContact O-CA 3.27Å; H1140-Y1146 HydrophobicContact CB-CD1 3.94Å; H1140-Y1146 HydrophobicContact CB-CE1 3.86Å; H1140-Y1146 AromaticContact CD2-CE1 3.6Å; H1140-Y1146 AromaticContact CD2-CZ 3.65Å
1147	K	89.1	Confident	87.8	Confident	38 Å²	38	39.3 Å²	39.3	17%	0.165	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	110.2	174.9	172.2	179.5	-176.6	163.6	0	109.2	T1094 C1095 Y1096 I1139 I1141 Q1149	T1094-K1147 HydrophobicContact CG2-CG 4.26Å; C1095-K1147 CarbonylContact O-C 3.59Å; C1095-K1147 WeakPolarHBondContact O-CA 2.89Å; Y1096-K1147 HydrophobicContact CD1-CB 4.19Å; Y1096-K1147 HydrophobicContact CE1-CB 4.15Å; Y1096-K1147 HydrophobicContact CE1-CD 3.94Å; Y1096-K1147 HydrophobicContact CE1-CG 4.23Å; Y1096-K1147 HydrophobicContact CE2-CD 4.18Å; Y1096-K1147 HydrophobicContact CE2-CG 4.26Å; Y1096-K1147 WeakPolarHBondContact OH-CE 3.33Å; Y1096-K1147 PolarHBondContact OH-NZ 3.17Å; I1139-K1147 HydrophobicContact CB-CB 4.31Å; I1139-K1147 HydrophobicContact CD1-CD 4.41Å; I1139-K1147 PolarHBondContact N-O 3.28Å; I1139-K1147 PolarHBondContact O-N 3.23Å; I1141-K1147 HydrophobicContact CD1-CB 3.69Å; I1141-K1147 HydrophobicContact CD1-CD 4.3Å; I1141-K1147 HydrophobicContact CG1-CB 4.26Å; K1147-Q1149 HydrophobicContact CG-CG 4.07Å
1148	A	91.2	Very high	87.6	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	137	170.8	0	0	0	0	0	109.7	C1095 I1097 I1105 W1107 Y1137 L1138	C1095-A1148 HydrophobicContact CB-CB 4.43Å; C1095-A1148 PolarHBondContact N-O 3.26Å; C1095-A1148 PolarHBondContact O-N 2.74Å; I1097-A1148 HydrophobicContact CD1-CB 3.65Å; I1105-A1148 HydrophobicContact CD1-CB 4.08Å; I1105-A1148 HydrophobicContact CG1-CB 4.01Å; I1105-A1148 HydrophobicContact CG2-CB 3.98Å; W1107-A1148 HydrophobicContact CZ2-CB 4.31Å; Y1137-A1148 CarbonylContact O-C 3.53Å; Y1137-A1148 WeakPolarHBondContact O-CA 3.43Å; L1138-A1148 HydrophobicContact CD1-CB 4.41Å
1149	Q	90.8	Very high	87.6	Confident	30 Å²	30	38.6 Å²	38.6	14%	0.14	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	146.3	172.5	-57.5	-168.1	-89.8	0	0	111.2	W1092 L1093 T1094 N1136 Y1137 K1147	W1092-Q1149 HydrophobicContact CE3-CB 4.2Å; L1093-Q1149 CarbonylContact O-C 3.52Å; L1093-Q1149 VanDerWaalsContact O-CA 3.23Å; L1093-Q1149 WeakPolarHBondContact O-CA 3.39Å; T1094-Q1149 HydrophobicContact CG2-CG 4.11Å; T1094-Q1149 PolarHBondContact OG1-NE2 2.93Å; N1136-Q1149 WeakPolarHBondContact CA-O 3.48Å; Y1137-Q1149 PolarHBondContact N-O 2.87Å; Y1137-Q1149 PolarHBondContact O-N 3.02Å; K1147-Q1149 HydrophobicContact CG-CG 4.07Å
1150	L	92	Very high	87.8	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	115.6	168.7	167.8	60.1	0	0	0	108.7	L1093 W1107 I1114 M1116 Y1134 E1135 V1152 Y1163	L1093-L1150 HydrophobicContact CB-CB 4.19Å; L1093-L1150 HydrophobicContact CD1-CB 4.33Å; L1093-L1150 HydrophobicContact CD1-CD2 3.8Å; L1093-L1150 HydrophobicContact CD1-CG 4.05Å; L1093-L1150 PolarHBondContact N-O 2.74Å; L1093-L1150 PolarHBondContact O-N 2.73Å; W1107-L1150 HydrophobicContact CB-CD2 3.82Å; W1107-L1150 HydrophobicContact CD2-CB 3.58Å; W1107-L1150 HydrophobicContact CD2-CD2 3.74Å; W1107-L1150 HydrophobicContact CD2-CG 4.29Å; W1107-L1150 VanDerWaalsContact CE2-CB 3.47Å; W1107-L1150 HydrophobicContact CE3-CB 3.94Å; W1107-L1150 HydrophobicContact CE3-CD2 3.81Å; W1107-L1150 HydrophobicContact CG-CB 4.04Å; W1107-L1150 HydrophobicContact CG-CD2 3.76Å; W1107-L1150 HydrophobicContact CG-CG 4.44Å; W1107-L1150 HydrophobicContact CH2-CB 4.09Å; W1107-L1150 HydrophobicContact CZ2-CB 3.75Å; W1107-L1150 HydrophobicContact CZ3-CB 4.18Å; I1114-L1150 HydrophobicContact CD1-CD2 3.63Å; M1116-L1150 HydrophobicContact CE-CD1 3.66Å; M1116-L1150 HydrophobicContact CE-CD2 4.28Å; M1116-L1150 HydrophobicContact SD-CD1 4.44Å; Y1134-L1150 HydrophobicContact CD1-CD1 4.07Å; Y1134-L1150 HydrophobicContact CD1-CD2 4.47Å; Y1134-L1150 HydrophobicContact CG-CD1 4.49Å; E1135-L1150 WeakPolarHBondContact O-CA 3.35Å; L1150-V1152 HydrophobicContact CG-CG2 4.39Å; L1150-Y1163 HydrophobicContact CD2-CD1 4.13Å; L1150-Y1163 HydrophobicContact CD2-CE1 4.34Å
1151	A	90.4	Very high	88	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	128.5	167.8	0	0	0	0	0	110.4	V1091 W1092 Y1134 E1135 Y1137	V1091-A1151 CarbonylContact O-C 3.51Å; V1091-A1151 WeakPolarHBondContact O-CA 3.49Å; W1092-A1151 HydrophobicContact CD2-CB 4.23Å; W1092-A1151 HydrophobicContact CE3-CB 3.76Å; W1092-A1151 HydrophobicContact CH2-CB 3.99Å; W1092-A1151 HydrophobicContact CZ2-CB 4.42Å; W1092-A1151 HydrophobicContact CZ3-CB 3.64Å; Y1134-A1151 WeakPolarHBondContact CA-O 3.46Å; E1135-A1151 HydrophobicContact CB-CB 4.1Å; E1135-A1151 PolarHBondContact N-O 2.81Å; E1135-A1151 VanDerWaalsContact N-O 3.08Å; E1135-A1151 PolarHBondContact O-N 2.82Å; Y1137-A1151 HydrophobicContact CE2-CB 4.32Å
1152	V	91	Very high	88.5	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	112	168.8	-173.3	0	0	0	0	107.7	K1090 V1091 L1093 Y1134 L1150 I1155 D1159 Y1163 L1180	K1090-V1152 WeakPolarHBondContact CA-O 3.17Å; V1091-V1152 PolarHBondContact N-O 2.71Å; V1091-V1152 PolarHBondContact O-N 3.46Å; L1093-V1152 HydrophobicContact CD1-CG2 3.88Å; Y1134-V1152 HydrophobicContact CD1-CG1 4.41Å; Y1134-V1152 HydrophobicContact CD1-CG2 4.09Å; Y1134-V1152 HydrophobicContact CE1-CB 4.43Å; Y1134-V1152 HydrophobicContact CE1-CG1 3.93Å; Y1134-V1152 HydrophobicContact CE1-CG2 3.93Å; L1150-V1152 HydrophobicContact CG-CG2 4.39Å; V1152-I1155 HydrophobicContact CB-CG1 4.43Å; V1152-I1155 HydrophobicContact CG1-CG1 3.98Å; V1152-D1159 HydrophobicContact CG1-CB 4.49Å; V1152-Y1163 HydrophobicContact CG2-CE1 4.36Å; V1152-L1180 HydrophobicContact CG2-CD2 4.43Å
1153	N	88.1	Confident	89.1	Confident	12 Å²	12	32.9 Å²	32.9	6%	0.064	15%	0.15	C	C	.	.			trans	-91.2	154.9	-179	-66.8	-47.6	0	0	0	111.2	K1090 I1131 K1132 K1133 E1135	K1090-N1153 WeakPolarHBondContact CD-OD1 3.4Å; K1090-N1153 WeakPolarHBondContact CE-OD1 3.44Å; K1090-N1153 WeakPolarHBondContact CG-OD1 3.33Å; K1090-N1153 PolarHBondContact NZ-OD1 2.94Å; I1131-N1153 HydrophobicContact CG2-CB 3.89Å; K1132-N1153 WeakPolarHBondContact O-CB 3.5Å; K1132-N1153 PolarHBondContact O-ND2 2.84Å; K1133-N1153 VanDerWaalsContact CD-O 3.29Å; K1133-N1153 WeakPolarHBondContact CD-O 3.23Å; K1133-N1153 WeakPolarHBondContact CE-O 3.45Å; K1133-N1153 PolarHBondContact NZ-O 2.9Å; K1133-N1153 PolarHBondContact O-N 2.87Å; E1135-N1153 PolarHBondContact OE2-ND2 2.88Å
1154	D	86.4	Confident	89.6	Confident	58 Å²	58	32.9 Å²	32.9	31%	0.31	15%	0.15	S	C	.	.	S	Bend	trans	42.9	65.3	-176.6	-175.7	48.5	0	0	0	113.9	S1088 S1089 K1133 R1156	S1088-D1154 VanDerWaalsContact CA-OD1 3.28Å; S1088-D1154 WeakPolarHBondContact CA-OD1 3.3Å; S1088-D1154 VanDerWaalsContact CB-OD1 3.24Å; S1088-D1154 WeakPolarHBondContact CB-OD1 3.28Å; S1088-D1154 PolarHBondContact OG-OD1 3.47Å; S1089-D1154 PolarHBondContact O-N 2.89Å; K1133-D1154 PolarHBondContact NZ-O 3.09Å; D1154-R1156 PolarHBondContact O-N 2.67Å; D1154-R1156 IonicContact OD1-NE 2.74Å; D1154-R1156 IonicContact OD1-NH2 3.7Å; D1154-R1156 IonicContact OD2-CZ 2.75Å; D1154-R1156 IonicContact OD2-NE 2.69Å; D1154-R1156 PolarHBondContact OD2-NE 2.84Å; D1154-R1156 IonicContact OD2-NH2 3.45Å; D1154-R1156 PolarHBondContact OD2-NH2 2.99Å
1155	I	88.3	Confident	89.9	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	15%	0.149	C	C	.	.			trans	-60.8	134.9	-178.7	-86.1	-164.3	0	0	0	112.9	Q1087 S1088 S1089 V1091 V1152 F1160 L1180	Q1087-I1155 CarbonylContact C-O 3.5Å; Q1087-I1155 VanDerWaalsContact CA-O 3.29Å; Q1087-I1155 WeakPolarHBondContact CA-O 3.27Å; S1088-I1155 PolarHBondContact N-O 2.93Å; S1089-I1155 PolarHBondContact O-N 3.21Å; S1089-I1155 VanDerWaalsContact O-N 3.13Å; V1091-I1155 HydrophobicContact CB-CD1 3.71Å; V1091-I1155 HydrophobicContact CG2-CD1 3.44Å; V1091-I1155 VanDerWaalsContact CG2-CD1 3.44Å; V1091-I1155 HydrophobicContact CG2-CG1 4.43Å; V1152-I1155 HydrophobicContact CB-CG1 4.43Å; V1152-I1155 HydrophobicContact CG1-CG1 3.98Å; I1155-F1160 HydrophobicContact CG2-CE1 3.66Å; I1155-F1160 HydrophobicContact CG2-CZ 4.16Å; I1155-L1180 HydrophobicContact CD1-CD1 3.98Å; I1155-L1180 HydrophobicContact CD1-CD2 3.95Å; I1155-L1180 HydrophobicContact CD1-CG 4.35Å
1156	R	88.9	Confident	90.1	Very high	115 Å²	115	35.3 Å²	35.3	43%	0.434	16%	0.161	S	C	.	.			trans	-132.9	167.9	173	-53	-156.8	-176.8	-141.3	-7	110.8	D1154 Y1158 D1159	D1154-R1156 PolarHBondContact O-N 2.67Å; D1154-R1156 IonicContact OD1-NE 2.74Å; D1154-R1156 IonicContact OD1-NH2 3.7Å; D1154-R1156 IonicContact OD2-CZ 2.75Å; D1154-R1156 IonicContact OD2-NE 2.69Å; D1154-R1156 PolarHBondContact OD2-NE 2.84Å; D1154-R1156 IonicContact OD2-NH2 3.45Å; D1154-R1156 PolarHBondContact OD2-NH2 2.99Å; R1156-Y1158 HydrophobicContact CB-CD1 4.07Å; R1156-Y1158 HydrophobicContact CB-CE1 3.64Å; R1156-Y1158 HydrophobicContact CB-CE2 4.22Å; R1156-Y1158 WeakPolarHBondContact CD-OH 3.16Å; R1156-Y1158 HydrophobicContact CG-CE1 4.23Å; R1156-Y1158 PolarHBondContact O-N 2.81Å; R1156-D1159 PolarHBondContact N-OD2 2.77Å; R1156-D1159 WeakPolarHBondContact O-CB 3.34Å; R1156-D1159 PolarHBondContact O-N 3.18Å
1157	K	83.4	Confident	90.3	Very high	164 Å²	164	34.9 Å²	34.9	71%	0.713	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-22	-176.2	-97	-171.9	174.2	-174.9	0	115.4	F1160	K1157-F1160 HydrophobicContact CG-CD2 4.36Å; K1157-F1160 HydrophobicContact CG-CE2 4.03Å
1158	Y	86.1	Confident	90.5	Very high	152 Å²	152	34.6 Å²	34.6	60%	0.596	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-12.3	177.8	57	-110.4	0	0	0	113.8	K1109 R1156 F1160	K1109-Y1158 PolarHBondContact NZ-O 3.41Å; R1156-Y1158 HydrophobicContact CB-CD1 4.07Å; R1156-Y1158 HydrophobicContact CB-CE1 3.64Å; R1156-Y1158 HydrophobicContact CB-CE2 4.22Å; R1156-Y1158 WeakPolarHBondContact CD-OH 3.16Å; R1156-Y1158 HydrophobicContact CG-CE1 4.23Å; R1156-Y1158 PolarHBondContact O-N 2.81Å; Y1158-F1160 VanDerWaalsContact C-N 3.34Å
1159	D	89.5	Confident	90.4	Very high	4 Å²	4	35.8 Å²	35.8	2%	0.021	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-26.4	173.4	-59.7	-55.8	0	0	0	110.8	K1109 K1133 V1152 R1156 Y1163	K1109-D1159 WeakPolarHBondContact CE-O 3.25Å; K1133-D1159 WeakPolarHBondContact CE-OD1 3.24Å; K1133-D1159 IonicContact NZ-OD1 2.69Å; K1133-D1159 PolarHBondContact NZ-OD1 2.86Å; K1133-D1159 VanDerWaalsContact NZ-OD1 3.16Å; K1133-D1159 IonicContact NZ-OD2 3.13Å; K1133-D1159 PolarHBondContact NZ-OD2 3.27Å; V1152-D1159 HydrophobicContact CG1-CB 4.49Å; R1156-D1159 PolarHBondContact N-OD2 2.77Å; R1156-D1159 WeakPolarHBondContact O-CB 3.34Å; R1156-D1159 PolarHBondContact O-N 3.18Å; D1159-Y1163 VanDerWaalsContact O-CE2 3.29Å; D1159-Y1163 WeakPolarHBondContact O-CE2 3.38Å; D1159-Y1163 PolarHBondContact O-OH 3.2Å
1160	F	90.5	Very high	90.3	Very high	56 Å²	56	41.5 Å²	41.5	25%	0.246	20%	0.201	C	C	.	.			trans	-56.6	147.9	171.6	-54.9	-28.7	0	0	0	111.4	K1109 I1155 K1157 Y1158 L1180 S1181	K1109-F1160 PolarHBondContact NZ-O 3.49Å; I1155-F1160 HydrophobicContact CG2-CE1 3.66Å; I1155-F1160 HydrophobicContact CG2-CZ 4.16Å; K1157-F1160 HydrophobicContact CG-CD2 4.36Å; K1157-F1160 HydrophobicContact CG-CE2 4.03Å; Y1158-F1160 VanDerWaalsContact C-N 3.34Å; F1160-L1180 VanDerWaalsContact CA-O 3.26Å; F1160-L1180 WeakPolarHBondContact CA-O 3.35Å; F1160-L1180 WeakPolarHBondContact CB-O 3.45Å; F1160-L1180 HydrophobicContact CD1-CG 4.36Å; F1160-S1181 WeakPolarHBondContact CE1-O 3.35Å
1161	G	90.7	Very high	90.1	Very high	16 Å²	16	46.8 Å²	46.8	17%	0.165	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	140.9	-169.7	-171.3	0	0	0	0	0	112.1	L1180	G1161-L1180 PolarHBondContact N-O 3.13Å; G1161-L1180 PolarHBondContact O-N 2.86Å
1162	S	92.7	Very high	90.1	Very high	30 Å²	30	48.2 Å²	48.2	21%	0.21	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	123.1	179.4	-78.8	0	0	0	0	111.2	D1110 E1177 H1179	D1110-S1162 PolarHBondContact N-O 2.98Å; D1110-S1162 PolarHBondContact OD1-N 2.91Å; S1162-E1177 WeakPolarHBondContact CB-OE1 3.39Å; S1162-E1177 PolarHBondContact OG-OE1 3.48Å; S1162-H1179 PolarHBondContact OG-ND1 2.84Å
1163	Y	94.7	Very high	90.2	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	160.8	169	-72	-104.2	0	0	0	109.3	L1093 L1108 K1109 I1114 Y1134 L1150 V1152 D1159 E1177 I1178 L1180	L1093-Y1163 HydrophobicContact CD1-CD1 3.44Å; L1093-Y1163 VanDerWaalsContact CD1-CD1 3.44Å; L1093-Y1163 HydrophobicContact CD1-CD2 4.08Å; L1093-Y1163 HydrophobicContact CD1-CE1 3.92Å; L1093-Y1163 HydrophobicContact CD1-CG 3.53Å; L1093-Y1163 HydrophobicContact CD2-CG 4.42Å; L1108-Y1163 CarbonylContact O-C 3.53Å; L1108-Y1163 WeakPolarHBondContact O-CA 3.11Å; K1109-Y1163 HydrophobicContact CB-CD1 4.08Å; K1109-Y1163 HydrophobicContact CB-CE1 3.9Å; K1109-Y1163 HydrophobicContact CD-CE1 4.1Å; K1109-Y1163 HydrophobicContact CD-CE2 4.16Å; K1109-Y1163 WeakPolarHBondContact CD-OH 3.39Å; K1109-Y1163 WeakPolarHBondContact CE-OH 3.16Å; K1109-Y1163 HydrophobicContact CG-CD1 4.22Å; K1109-Y1163 HydrophobicContact CG-CD2 4.32Å; K1109-Y1163 HydrophobicContact CG-CE1 3.84Å; K1109-Y1163 HydrophobicContact CG-CE2 3.93Å; K1109-Y1163 HydrophobicContact CG-CG 4.44Å; I1114-Y1163 HydrophobicContact CD1-CD1 3.71Å; I1114-Y1163 HydrophobicContact CD1-CE1 3.65Å; Y1134-Y1163 HydrophobicContact CE1-CE1 4.12Å; Y1134-Y1163 PolarHBondContact OH-OH 3.27Å; L1150-Y1163 HydrophobicContact CD2-CD1 4.13Å; L1150-Y1163 HydrophobicContact CD2-CE1 4.34Å; V1152-Y1163 HydrophobicContact CG2-CE1 4.36Å; D1159-Y1163 VanDerWaalsContact O-CE2 3.29Å; D1159-Y1163 WeakPolarHBondContact O-CE2 3.38Å; D1159-Y1163 PolarHBondContact O-OH 3.2Å; Y1163-E1177 CarbonylContact O-C 3.54Å; Y1163-E1177 WeakPolarHBondContact O-CA 3.33Å; Y1163-E1177 WeakPolarHBondContact O-CG 3.34Å; Y1163-I1178 PolarHBondContact N-O 3.23Å; Y1163-I1178 PolarHBondContact O-N 3.04Å; Y1163-L1180 HydrophobicContact CD2-CB 3.76Å; Y1163-L1180 HydrophobicContact CD2-CD2 4.2Å; Y1163-L1180 HydrophobicContact CE2-CB 3.73Å; Y1163-L1180 HydrophobicContact CE2-CD2 3.46Å; Y1163-L1180 VanDerWaalsContact CE2-CD2 3.46Å; Y1163-L1180 HydrophobicContact CE2-CG 4.23Å
1164	S	93.5	Very high	90.4	Very high	5 Å²	5	54.9 Å²	54.9	4%	0.035	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	138.3	166.5	-76	0	0	0	0	111.4	W1107 L1108 Q1175 L1176 E1177	W1107-S1164 WeakPolarHBondContact CA-O 2.83Å; L1108-S1164 PolarHBondContact N-O 2.78Å; L1108-S1164 PolarHBondContact O-N 3.35Å; S1164-Q1175 PolarHBondContact OG-NE2 2.89Å; S1164-L1176 CarbonylContact C-O 3.55Å; S1164-L1176 VanDerWaalsContact CA-O 3.25Å; S1164-L1176 WeakPolarHBondContact CA-O 3.21Å; S1164-E1177 WeakPolarHBondContact OG-CA 3.16Å
1165	C	93.3	Very high	90.7	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	119.2	166.3	-176.2	0	0	0	0	108	C1095 W1107 Q1175 L1176	C1095-C1165 HydrophobicContact CB-CB 3.99Å; C1095-C1165 WeakPolarHBondContact SG-CB 3.42Å; W1107-C1165 HydrophobicContact CD2-CB 4.3Å; W1107-C1165 HydrophobicContact CE3-CB 3.99Å; W1107-C1165 HydrophobicContact CH2-CB 3.75Å; W1107-C1165 HydrophobicContact CZ2-CB 4.05Å; W1107-C1165 HydrophobicContact CZ3-CB 3.72Å; C1165-Q1175 CarbonylContact O-C 3.44Å; C1165-Q1175 VanDerWaalsContact O-CA 3.31Å; C1165-Q1175 WeakPolarHBondContact O-CA 3.21Å; C1165-L1176 PolarHBondContact N-O 2.76Å; C1165-L1176 PolarHBondContact O-N 3.18Å
1166	Q	93.1	Very high	90.8	Very high	52 Å²	52	57.4 Å²	57.4	24%	0.243	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	126.7	171.6	-176.3	-177.4	8.9	0	0	107.9	I1105 V1106 L1108 E1173 A1174	I1105-Q1166 WeakPolarHBondContact CA-O 3.45Å; V1106-Q1166 HydrophobicContact CB-CB 4.34Å; V1106-Q1166 PolarHBondContact N-O 2.88Å; V1106-Q1166 PolarHBondContact O-N 3.4Å; L1108-Q1166 HydrophobicContact CD1-CB 4.44Å; Q1166-E1173 PolarHBondContact NE2-OE2 2.69Å; Q1166-A1174 CarbonylContact C-O 3.51Å; Q1166-A1174 WeakPolarHBondContact CA-O 3.12Å
1167	A	93.3	Very high	91	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	124.9	-179.4	0	0	0	0	0	109.7	P1072 I1074 I1097 P1103 Q1104 I1105 E1173 A1174	P1072-A1167 HydrophobicContact CB-CB 4.24Å; I1074-A1167 HydrophobicContact CD1-CB 4.07Å; I1074-A1167 HydrophobicContact CG1-CB 4.31Å; I1097-A1167 HydrophobicContact CG1-CB 4.02Å; I1097-A1167 HydrophobicContact CG2-CB 3.98Å; P1103-A1167 HydrophobicContact CB-CB 4.46Å; Q1104-A1167 WeakPolarHBondContact O-CA 3.28Å; I1105-A1167 HydrophobicContact CD1-CB 3.58Å; A1167-E1173 CarbonylContact O-C 3.58Å; A1167-E1173 VanDerWaalsContact O-CA 3.28Å; A1167-E1173 WeakPolarHBondContact O-CA 3.39Å; A1167-A1174 PolarHBondContact N-O 3.46Å; A1167-A1174 PolarHBondContact O-N 3.45Å
1168	A	91.8	Very high	91.4	Very high	33 Å²	33	49.4 Å²	49.4	27%	0.273	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	142.8	-177.9	0	0	0	0	0	111.2	P1103 Q1104 G1172 E1173	P1103-A1168 CarbonylContact C-O 3.55Å; P1103-A1168 WeakPolarHBondContact CA-O 3.16Å; Q1104-A1168 PolarHBondContact N-O 3.19Å; Q1104-A1168 PolarHBondContact O-N 3.23Å; A1168-G1172 WeakPolarHBondContact CA-O 3.07Å; A1168-E1173 HydrophobicContact CB-CB 4.06Å
1169	N	90.8	Very high	91.7	Very high	25 Å²	25	46.8 Å²	46.8	13%	0.134	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	-174.9	168.7	83.1	-5.8	0	0	0	110.3	F1070 P1072 T1099 E1100 P1101 Q1171 G1172	F1070-N1169 PolarHBondContact O-ND2 3.45Å; P1072-N1169 WeakPolarHBondContact CD-OD1 3.48Å; P1072-N1169 HydrophobicContact CG-CB 4.09Å; T1099-N1169 PolarHBondContact OG1-ND2 3.26Å; E1100-N1169 PolarHBondContact O-ND2 2.88Å; P1101-N1169 PolarHBondContact O-ND2 2.78Å; N1169-Q1171 PolarHBondContact O-N 2.91Å; N1169-Q1171 WeakPolarHBondContact OD1-CA 3.47Å; N1169-Q1171 WeakPolarHBondContact OD1-CB 3.23Å; N1169-Q1171 PolarHBondContact OD1-N 2.96Å; N1169-G1172 PolarHBondContact N-O 3.5Å; N1169-G1172 PolarHBondContact O-N 3.22Å; N1169-G1172 PolarHBondContact OD1-N 3.02Å
1170	L	88	Confident	91.8	Very high	150 Å²	150	46.6 Å²	46.6	79%	0.785	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66	0.4	-179.1	-62.7	177.2	0	0	0	114.9
1171	Q	88.2	Confident	91.8	Very high	111 Å²	111	45.4 Å²	45.4	52%	0.519	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.2	-15	-178.2	-56.6	-65.6	-88.4	0	0	113.3	H1069 P1071 N1169	H1069-Q1171 HydrophobicContact CB-CG 4.43Å; P1071-Q1171 HydrophobicContact CB-CB 4.02Å; N1169-Q1171 PolarHBondContact O-N 2.91Å; N1169-Q1171 WeakPolarHBondContact OD1-CA 3.47Å; N1169-Q1171 WeakPolarHBondContact OD1-CB 3.23Å; N1169-Q1171 PolarHBondContact OD1-N 2.96Å
1172	G	90.1	Very high	91.7	Very high	30 Å²	30	46.1 Å²	46.1	31%	0.309	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	164.7	-168.6	178.7	0	0	0	0	0	114.1	P1072 A1168 N1169	P1072-G1172 VanDerWaalsContact CD-C 3.4Å; P1072-G1172 WeakPolarHBondContact CD-O 3.26Å; P1072-G1172 WeakPolarHBondContact CG-O 3.13Å; A1168-G1172 WeakPolarHBondContact CA-O 3.07Å; N1169-G1172 PolarHBondContact N-O 3.5Å; N1169-G1172 PolarHBondContact O-N 3.22Å; N1169-G1172 PolarHBondContact OD1-N 3.02Å
1173	E	92.5	Very high	91.5	Very high	127 Å²	127	45.9 Å²	45.9	59%	0.593	25%	0.251	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.8	160.4	176.8	67.7	174.1	160.3	0	0	112.9	Q1166 A1167 A1168	Q1166-E1173 PolarHBondContact NE2-OE2 2.69Å; A1167-E1173 CarbonylContact O-C 3.58Å; A1167-E1173 VanDerWaalsContact O-CA 3.28Å; A1167-E1173 WeakPolarHBondContact O-CA 3.39Å; A1168-E1173 HydrophobicContact CB-CB 4.06Å
1174	A	93	Very high	91.3	Very high	25 Å²	25	47.7 Å²	47.7	21%	0.207	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	156.5	170.2	0	0	0	0	0	111	P1072 I1074 Q1166 A1167	P1072-A1174 HydrophobicContact CB-CB 4.48Å; P1072-A1174 WeakPolarHBondContact O-CB 3.22Å; I1074-A1174 HydrophobicContact CD1-CB 4.2Å; I1074-A1174 HydrophobicContact CG1-CB 3.96Å; Q1166-A1174 CarbonylContact C-O 3.51Å; Q1166-A1174 WeakPolarHBondContact CA-O 3.12Å; A1167-A1174 PolarHBondContact N-O 3.46Å; A1167-A1174 PolarHBondContact O-N 3.45Å
1175	Q	92.3	Very high	91.1	Very high	97 Å²	97	50.6 Å²	50.6	45%	0.453	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	144.7	178.6	-176.5	178.7	-21.3	0	0	111.3	S1164 C1165	S1164-Q1175 PolarHBondContact OG-NE2 2.89Å; C1165-Q1175 CarbonylContact O-C 3.44Å; C1165-Q1175 VanDerWaalsContact O-CA 3.31Å; C1165-Q1175 WeakPolarHBondContact O-CA 3.21Å
1176	L	90.9	Very high	91	Very high	13 Å²	13	50.8 Å²	50.8	7%	0.068	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	128.1	169.3	178.2	55.7	0	0	0	110.4	I1074 Q1076 T1081 S1164 C1165	I1074-L1176 HydrophobicContact CB-CB 4.38Å; I1074-L1176 HydrophobicContact CD1-CB 4.21Å; I1074-L1176 HydrophobicContact CG2-CB 3.75Å; I1074-L1176 HydrophobicContact CG2-CD2 3.71Å; I1074-L1176 HydrophobicContact CG2-CG 4.39Å; Q1076-L1176 HydrophobicContact CG-CD1 3.97Å; Q1076-L1176 HydrophobicContact CG-CD2 4.44Å; T1081-L1176 HydrophobicContact CG2-CD1 4.42Å; S1164-L1176 CarbonylContact C-O 3.55Å; S1164-L1176 VanDerWaalsContact CA-O 3.25Å; S1164-L1176 WeakPolarHBondContact CA-O 3.21Å; C1165-L1176 PolarHBondContact N-O 2.76Å; C1165-L1176 PolarHBondContact O-N 3.18Å
1177	E	91.8	Very high	90.9	Very high	112 Å²	112	50.4 Å²	50.4	52%	0.523	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	139.7	171.8	-167.8	-179.9	174.1	0	0	111.1	S1162 Y1163 S1164	S1162-E1177 WeakPolarHBondContact CB-OE1 3.39Å; S1162-E1177 PolarHBondContact OG-OE1 3.48Å; Y1163-E1177 CarbonylContact O-C 3.54Å; Y1163-E1177 WeakPolarHBondContact O-CA 3.33Å; Y1163-E1177 WeakPolarHBondContact O-CG 3.34Å; S1164-E1177 WeakPolarHBondContact OG-CA 3.16Å
1178	I	92.6	Very high	90.8	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	123.5	174.2	-53.6	179.1	0	0	0	108.7	Y1080 T1081 A1083 L1093 T1094 W1107 Y1163	Y1080-I1178 WeakPolarHBondContact O-CD1 3.39Å; Y1080-I1178 WeakPolarHBondContact O-CG1 2.98Å; Y1080-I1178 VanDerWaalsContact O-CG2 3.31Å; Y1080-I1178 WeakPolarHBondContact O-CG2 3.32Å; T1081-I1178 WeakPolarHBondContact O-CA 3.49Å; A1083-I1178 HydrophobicContact CB-CG2 4.21Å; L1093-I1178 HydrophobicContact CB-CD1 4.27Å; L1093-I1178 HydrophobicContact CD2-CB 4.03Å; L1093-I1178 HydrophobicContact CD2-CD1 4.46Å; L1093-I1178 HydrophobicContact CD2-CG2 3.5Å; L1093-I1178 VanDerWaalsContact CD2-CG2 3.5Å; T1094-I1178 WeakPolarHBondContact O-CD1 3.4Å; W1107-I1178 HydrophobicContact CH2-CD1 4.18Å; W1107-I1178 HydrophobicContact CZ3-CD1 4.08Å; Y1163-I1178 PolarHBondContact N-O 3.23Å; Y1163-I1178 PolarHBondContact O-N 3.04Å
1179	H	91.9	Very high	90.8	Very high	96 Å²	96	52 Å²	52	44%	0.444	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	120.5	179.7	-163.4	72.3	0	0	0	111.7	T1081 K1082 A1083 S1162	T1081-H1179 PolarHBondContact O-N 3.46Å; T1081-H1179 VanDerWaalsContact O-N 3.08Å; K1082-H1179 WeakPolarHBondContact CA-O 3.4Å; A1083-H1179 PolarHBondContact N-O 3.22Å; S1162-H1179 PolarHBondContact OG-ND1 2.84Å
1180	L	92.1	Very high	90.6	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	124.7	179.1	-177.7	61.6	0	0	0	111	A1083 V1091 V1152 I1155 F1160 G1161 Y1163	A1083-L1180 HydrophobicContact CB-CD1 3.73Å; A1083-L1180 WeakPolarHBondContact O-CA 3.24Å; V1091-L1180 HydrophobicContact CB-CD1 4.47Å; V1091-L1180 HydrophobicContact CG1-CD1 3.82Å; V1152-L1180 HydrophobicContact CG2-CD2 4.43Å; I1155-L1180 HydrophobicContact CD1-CD1 3.98Å; I1155-L1180 HydrophobicContact CD1-CD2 3.95Å; I1155-L1180 HydrophobicContact CD1-CG 4.35Å; F1160-L1180 VanDerWaalsContact CA-O 3.26Å; F1160-L1180 WeakPolarHBondContact CA-O 3.35Å; F1160-L1180 WeakPolarHBondContact CB-O 3.45Å; F1160-L1180 HydrophobicContact CD1-CG 4.36Å; G1161-L1180 PolarHBondContact N-O 3.13Å; G1161-L1180 PolarHBondContact O-N 2.86Å; Y1163-L1180 HydrophobicContact CD2-CB 3.76Å; Y1163-L1180 HydrophobicContact CD2-CD2 4.2Å; Y1163-L1180 HydrophobicContact CE2-CB 3.73Å; Y1163-L1180 HydrophobicContact CE2-CD2 3.46Å; Y1163-L1180 VanDerWaalsContact CE2-CD2 3.46Å; Y1163-L1180 HydrophobicContact CE2-CG 4.23Å
1181	S	91.5	Very high	90.4	Very high	32 Å²	32	51.5 Å²	51.5	22%	0.224	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	-179.5	-174	61.8	0	0	0	0	113.1	A1083 A1084 G1085 F1160	A1083-S1181 PolarHBondContact O-N 3.27Å; A1083-S1181 PolarHBondContact O-OG 3.03Å; A1084-S1181 WeakPolarHBondContact CA-O 3.4Å; A1084-S1181 VanDerWaalsContact CB-O 3.3Å; A1084-S1181 WeakPolarHBondContact CB-O 3.38Å; G1085-S1181 PolarHBondContact N-O 2.78Å; F1160-S1181 WeakPolarHBondContact CE1-O 3.35Å
1182	G	87.8	Confident	90.4	Very high	31 Å²	31	47.5 Å²	47.5	32%	0.32	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	156.2	168.8	0	0	0	0	0	111.3
1183	T	88.9	Confident	90.2	Very high	24 Å²	24	50.4 Å²	50.4	15%	0.147	27%	0.269	C	S	.	.			trans	-50.5	140.2	-178.6	57.4	0	0	0	0	113.3	G1085 E1086 G1212 L1214 H1269	G1085-T1183 PolarHBondContact O-N 3.2Å; E1086-T1183 HydrophobicContact CG-CG2 3.63Å; T1183-G1212 WeakPolarHBondContact CA-O 3.43Å; T1183-L1214 HydrophobicContact CG2-CD1 4.22Å; T1183-L1214 HydrophobicContact CG2-CD2 4.2Å; T1183-L1214 HydrophobicContact CG2-CG 3.88Å; T1183-H1269 WeakPolarHBondContact CB-NE2 3.29Å; T1183-H1269 PolarHBondContact O-CE1 3.16Å; T1183-H1269 PolarHBondContact O-NE2 2.95Å; T1183-H1269 VanDerWaalsContact O-NE2 3.13Å; T1183-H1269 PolarHBondContact OG1-NE2 3.08Å
1184	S	89.9	Confident	90	Very high	39 Å²	39	47.1 Å²	47.1	27%	0.273	26%	0.255	S	S	.	.			trans	-135.3	-179.8	-177	66.9	0	0	0	0	112.4	G1212 N1266 H1269	S1184-G1212 PolarHBondContact N-O 2.88Å; S1184-N1266 PolarHBondContact O-ND2 2.95Å; S1184-H1269 VanDerWaalsContact C-CD2 3.44Å; S1184-H1269 VanDerWaalsContact C-CG 3.44Å; S1184-H1269 PolarHBondContact O-CD2 3.25Å
1185	T	88.7	Confident	89.3	Confident	65 Å²	65	48.4 Å²	48.4	40%	0.399	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-58.7	149.6	157.2	45.6	0	0	0	0	110.2	H1269	T1185-H1269 HydrophobicContact CG2-CB 3.76Å; T1185-H1269 WeakPolarHBondContact CG2-O 3.47Å
1186	P	92.3	Very high	88.7	Confident	4 Å²	4	45.4 Å²	45.4	3%	0.026	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-66.7	159.4	172	-16.3	30.6	0	0	0	112.5	F1210 Q1216 N1266	P1186-F1210 CarbonylContact C-O 3.54Å; P1186-F1210 WeakPolarHBondContact CA-O 3.12Å; P1186-Q1216 HydrophobicContact CG-CB 4.31Å; P1186-N1266 HydrophobicContact CG-CB 4.02Å
1187	D	91.6	Very high	88.2	Confident	44 Å²	44	44.9 Å²	44.9	24%	0.235	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-69	146.8	169.3	-80.9	-10.7	0	0	0	111.1	K1082 F1210 S1264	K1082-D1187 IonicContact NZ-OD1 3.46Å; K1082-D1187 PolarHBondContact NZ-OD1 2.8Å; K1082-D1187 IonicContact NZ-OD2 2.75Å; K1082-D1187 PolarHBondContact NZ-OD2 2.97Å; D1187-F1210 HydrophobicContact CB-CB 4.35Å; D1187-F1210 PolarHBondContact N-O 2.89Å; D1187-F1210 WeakPolarHBondContact OD2-CB 3.44Å; D1187-S1264 PolarHBondContact O-OG 3.35Å
1188	V	90.6	Very high	87.8	Confident	60 Å²	60	41.8 Å²	41.8	36%	0.364	23%	0.232	S	C	.	.	P	Polyproline II helix	trans	-59.9	133.5	174.1	-175.8	0	0	0	0	110	A1273 T1275	V1188-A1273 HydrophobicContact CG2-CB 4.03Å; V1188-T1275 HydrophobicContact CG1-CG2 3.86Å
1189	P	90.6	Very high	87.3	Confident	7 Å²	7	43.2 Å²	43.2	5%	0.045	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-61.8	146.8	-177.5	-27.5	39.3	0	0	0	113.8	W1206 F1218 V1262 T1275	P1189-W1206 HydrophobicContact CB-CB 4.27Å; P1189-W1206 HydrophobicContact CB-CG 4.11Å; P1189-F1218 HydrophobicContact CB-CD1 4.45Å; P1189-F1218 HydrophobicContact CB-CE1 4.35Å; P1189-F1218 HydrophobicContact CG-CD1 3.61Å; P1189-F1218 HydrophobicContact CG-CE1 3.71Å; P1189-V1262 HydrophobicContact CB-CG1 3.71Å; P1189-V1262 HydrophobicContact CG-CG1 3.56Å; P1189-T1275 HydrophobicContact CB-CG2 4.34Å; P1189-T1275 WeakPolarHBondContact O-CG2 3.49Å
1190	I	86.9	Confident	87	Confident	60 Å²	60	40.3 Å²	40.3	31%	0.308	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	159.4	-165.4	-24.6	175.2	0	0	0	110.1	P1078 F1192 T1207	P1078-I1190 HydrophobicContact CB-CD1 3.49Å; P1078-I1190 VanDerWaalsContact CB-CD1 3.49Å; P1078-I1190 HydrophobicContact CG-CD1 3.59Å; I1190-F1192 PolarHBondContact O-N 3.44Å; I1190-T1207 PolarHBondContact N-O 3.31Å; I1190-T1207 PolarHBondContact O-N 3.46Å
1191	N	83.6	Confident	86.8	Confident	105 Å²	105	41.3 Å²	41.3	56%	0.561	24%	0.238	S	C	*	.	E	Extended strand (participates in β ladder)	trans	51.4	33.3	177.8	-76.2	-36.5	0	0	0	114.3	R1193	N1191-R1193 WeakPolarHBondContact O-CB 3.37Å; N1191-R1193 WeakPolarHBondContact O-CD 3.32Å; N1191-R1193 VanDerWaalsContact O-CG 3.29Å; N1191-R1193 WeakPolarHBondContact O-CG 3.13Å; N1191-R1193 PolarHBondContact O-N 2.81Å
1192	F	88.9	Confident	86.7	Confident	26 Å²	26	39.8 Å²	39.8	11%	0.114	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	122.6	176.8	-175.3	-129.7	0	0	0	109.7	I1190 V1204 A1205 W1206 V1260 V1262 T1275 I1278	I1190-F1192 PolarHBondContact O-N 3.44Å; F1192-V1204 HydrophobicContact CE2-CB 3.79Å; F1192-V1204 HydrophobicContact CE2-CG1 4.32Å; F1192-V1204 HydrophobicContact CE2-CG2 4.04Å; F1192-V1204 HydrophobicContact CZ-CB 4.24Å; F1192-V1204 HydrophobicContact CZ-CG1 4.29Å; F1192-V1204 HydrophobicContact CZ-CG2 4.42Å; F1192-A1205 CarbonylContact C-O 3.5Å; F1192-A1205 WeakPolarHBondContact CA-O 2.72Å; F1192-W1206 HydrophobicContact CB-CB 4.4Å; F1192-W1206 HydrophobicContact CD2-CB 4.17Å; F1192-W1206 AromaticContact CD2-CE3 3.87Å; F1192-W1206 HydrophobicContact CD2-CE3 3.87Å; F1192-W1206 AromaticContact CE2-CE3 3.85Å; F1192-W1206 HydrophobicContact CE2-CE3 3.85Å; F1192-W1206 HydrophobicContact CE2-CZ3 4.26Å; F1192-V1260 HydrophobicContact CE1-CG1 4.35Å; F1192-V1260 HydrophobicContact CZ-CB 4.43Å; F1192-V1260 HydrophobicContact CZ-CG1 3.81Å; F1192-V1262 HydrophobicContact CD2-CB 4.36Å; F1192-V1262 HydrophobicContact CE2-CB 4.18Å; F1192-V1262 HydrophobicContact CE2-CG2 3.95Å; F1192-V1262 HydrophobicContact CZ-CB 4.41Å; F1192-V1262 HydrophobicContact CZ-CG2 4.27Å; F1192-T1275 HydrophobicContact CB-CG2 4.19Å; F1192-T1275 WeakPolarHBondContact CD1-OG1 3.34Å; F1192-I1278 HydrophobicContact CB-CD1 4.31Å; F1192-I1278 HydrophobicContact CD1-CD1 3.28Å; F1192-I1278 HydrophobicContact CD1-CG1 3.68Å; F1192-I1278 HydrophobicContact CE1-CD1 3.69Å; F1192-I1278 HydrophobicContact CE1-CG1 3.89Å; F1192-I1278 HydrophobicContact CG-CD1 3.92Å; F1192-I1278 VanDerWaalsContact O-CD1 3.25Å; F1192-I1278 WeakPolarHBondContact O-CD1 3.34Å
1193	R	86.5	Confident	86.8	Confident	91 Å²	91	40.4 Å²	40.4	34%	0.343	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	152.7	-165.4	65.1	-165.4	-177.6	-169.7	3.4	112.6	G991 N1191 V1204 A1205	G991-R1193 PolarHBondContact O-NH2 3.17Å; N1191-R1193 WeakPolarHBondContact O-CB 3.37Å; N1191-R1193 WeakPolarHBondContact O-CD 3.32Å; N1191-R1193 VanDerWaalsContact O-CG 3.29Å; N1191-R1193 WeakPolarHBondContact O-CG 3.13Å; N1191-R1193 PolarHBondContact O-N 2.81Å; R1193-V1204 CarbonylContact O-C 3.38Å; R1193-V1204 WeakPolarHBondContact O-CA 2.75Å; R1193-A1205 HydrophobicContact CG-CB 4.5Å; R1193-A1205 PolarHBondContact N-O 2.92Å; R1193-A1205 PolarHBondContact O-N 2.96Å
1194	L	87.2	Confident	86.8	Confident	59 Å²	59	39.3 Å²	39.3	31%	0.309	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	116.2	172.8	-175.1	77	0	0	0	110.5	N1196 A1197 L1202 V1204 L1280	L1194-N1196 VanDerWaalsContact CD1-O 3.25Å; L1194-N1196 WeakPolarHBondContact CD1-O 3.48Å; L1194-A1197 HydrophobicContact CD2-CB 4.24Å; L1194-L1202 HydrophobicContact CD1-CB 4.35Å; L1194-L1202 HydrophobicContact CD1-CD2 3.9Å; L1194-V1204 HydrophobicContact CD1-CG1 4.14Å; L1194-L1280 HydrophobicContact CB-CD2 3.91Å; L1194-L1280 HydrophobicContact CD1-CD1 4.17Å; L1194-L1280 HydrophobicContact CD1-CD2 4.2Å; L1194-L1280 HydrophobicContact CD2-CD2 4.26Å; L1194-L1280 HydrophobicContact CG-CD2 4.35Å
1195	L	78.9	Confident	86.7	Confident	52 Å²	52	37.5 Å²	37.5	27%	0.272	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	-52.5	169.3	-65.1	-176.2	0	0	0	110.7	K235 H1203 A1205 E1246	K235-L1195 WeakPolarHBondContact CE-O 3.19Å; K235-L1195 PolarHBondContact NZ-O 2.9Å; L1195-H1203 PolarHBondContact N-O 3.12Å; L1195-A1205 HydrophobicContact CD1-CB 3.65Å; L1195-A1205 HydrophobicContact CD2-CB 4.12Å; L1195-A1205 HydrophobicContact CG-CB 3.68Å; L1195-E1246 HydrophobicContact CD1-CB 4.46Å; L1195-E1246 HydrophobicContact CD1-CG 4.03Å; L1195-E1246 WeakPolarHBondContact CD1-OE1 3.35Å
1196	N	80.2	Confident	86.7	Confident	33 Å²	33	34.5 Å²	34.5	18%	0.176	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	159.3	179.8	-164.7	29.6	0	0	0	111.8	K235 L1194 H1203	K235-N1196 VanDerWaalsContact CG-OD1 3.26Å; K235-N1196 WeakPolarHBondContact CG-OD1 3.36Å; L1194-N1196 VanDerWaalsContact CD1-O 3.25Å; L1194-N1196 WeakPolarHBondContact CD1-O 3.48Å; N1196-H1203 HydrophobicContact CB-CB 4.15Å; N1196-H1203 PolarHBondContact N-O 2.78Å; N1196-H1203 VanDerWaalsContact N-O 3.14Å; N1196-H1203 WeakPolarHBondContact O-CA 3.5Å; N1196-H1203 WeakPolarHBondContact O-CB 3.16Å; N1196-H1203 PolarHBondContact O-N 2.92Å
1197	A	79.7	Confident	86.2	Confident	2 Å²	2	35.3 Å²	35.3	2%	0.017	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	152	169.6	0	0	0	0	0	109.3	L1194 L1202 L1283	L1194-A1197 HydrophobicContact CD2-CB 4.24Å; A1197-L1202 HydrophobicContact CB-CD2 3.73Å; A1197-L1283 HydrophobicContact CB-CD2 3.96Å; A1197-L1283 HydrophobicContact CB-CG 4.24Å; A1197-L1283 WeakPolarHBondContact O-CD1 3.17Å
1198	T	84.4	Confident	85.9	Confident	47 Å²	47	33.3 Å²	33.3	29%	0.288	18%	0.178	S	C	.	.			trans	-128.2	-174.7	168	76.2	0	0	0	0	109.5	S1200 T1201 L1283	T1198-S1200 PolarHBondContact O-N 2.74Å; T1198-S1200 PolarHBondContact OG1-N 2.92Å; T1198-T1201 WeakPolarHBondContact CG2-OG1 3.41Å; T1198-T1201 PolarHBondContact N-O 3.34Å; T1198-T1201 WeakPolarHBondContact OG1-CB 3.35Å; T1198-T1201 PolarHBondContact OG1-N 3.24Å; T1198-T1201 PolarHBondContact OG1-OG1 2.75Å; T1198-L1283 VanDerWaalsContact C-CG 3.48Å; T1198-L1283 WeakPolarHBondContact O-CG 3.39Å; T1198-L1283 PolarHBondContact O-N 2.75Å
1199	S	82	Confident	85.7	Confident	31 Å²	31	30.4 Å²	30.4	22%	0.217	16%	0.161	C	C	.	.	S	Bend	trans	-72.6	-14.3	179.2	60.8	0	0	0	0	114.6	P1254 L1283 S1284 L1285	S1199-P1254 VanDerWaalsContact O-CA 3.31Å; S1199-P1254 WeakPolarHBondContact O-CA 3.36Å; S1199-P1254 VanDerWaalsContact O-CB 3.28Å; S1199-P1254 WeakPolarHBondContact O-CB 3.28Å; S1199-L1283 WeakPolarHBondContact CA-O 3.25Å; S1199-S1284 WeakPolarHBondContact CB-O 3.26Å; S1199-L1285 VanDerWaalsContact CB-CD1 3.47Å; S1199-L1285 WeakPolarHBondContact OG-CD1 3.47Å
1200	S	83.8	Confident	85.6	Confident	35 Å²	35	30.5 Å²	30.5	25%	0.245	16%	0.161	C	C	.	.	S	Bend	trans	-136	1	177.9	65.1	0	0	0	0	114.3	T1198 G1251 L1252	T1198-S1200 PolarHBondContact O-N 2.74Å; T1198-S1200 PolarHBondContact OG1-N 2.92Å; S1200-G1251 PolarHBondContact O-N 2.78Å; S1200-L1252 WeakPolarHBondContact O-CB 3.01Å; S1200-L1252 PolarHBondContact O-N 3.42Å
1201	T	88.6	Confident	85.7	Confident	20 Å²	20	28.8 Å²	28.8	12%	0.123	15%	0.152	C	C	.	.			trans	-136.5	154.2	-177.6	79.8	0	0	0	0	113.9	T1198 I1248 I1249 T1250	T1198-T1201 WeakPolarHBondContact CG2-OG1 3.41Å; T1198-T1201 PolarHBondContact N-O 3.34Å; T1198-T1201 WeakPolarHBondContact OG1-CB 3.35Å; T1198-T1201 PolarHBondContact OG1-N 3.24Å; T1198-T1201 PolarHBondContact OG1-OG1 2.75Å; T1201-I1248 HydrophobicContact CG2-CG2 4.35Å; T1201-I1249 CarbonylContact C-O 3.57Å; T1201-I1249 WeakPolarHBondContact CA-O 3.07Å; T1201-I1249 VanDerWaalsContact CB-O 3.23Å; T1201-I1249 WeakPolarHBondContact CB-O 3.47Å; T1201-T1250 HydrophobicContact CG2-CG2 3.95Å
1202	L	89	Confident	85.9	Confident	1 Å²	1	23.8 Å²	23.8	1%	0.005	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	116.9	168.9	-68.9	172	0	0	0	108.7	L1194 A1197 I1249 L1252 V1260 L1280 T1282	L1194-L1202 HydrophobicContact CD1-CB 4.35Å; L1194-L1202 HydrophobicContact CD1-CD2 3.9Å; A1197-L1202 HydrophobicContact CB-CD2 3.73Å; L1202-I1249 HydrophobicContact CB-CB 4.42Å; L1202-I1249 PolarHBondContact N-O 3.19Å; L1202-I1249 PolarHBondContact O-N 2.72Å; L1202-L1252 HydrophobicContact CB-CD1 3.99Å; L1202-L1252 HydrophobicContact CD1-CD1 3.63Å; L1202-L1252 HydrophobicContact CG-CD1 3.52Å; L1202-V1260 HydrophobicContact CD1-CG2 4.07Å; L1202-L1280 HydrophobicContact CD1-CB 3.66Å; L1202-L1280 HydrophobicContact CD1-CD1 4.29Å; L1202-L1280 HydrophobicContact CD2-CB 4.19Å; L1202-T1282 HydrophobicContact CD2-CG2 4.34Å; L1202-T1282 HydrophobicContact CG-CG2 4.16Å
1203	H	89.9	Confident	85.7	Confident	44 Å²	44	23.6 Å²	23.6	20%	0.204	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	105.5	173.7	-170.6	-169.4	0	0	0	109.2	L1195 N1196 E1246 Y1247 I1248	L1195-H1203 PolarHBondContact N-O 3.12Å; N1196-H1203 HydrophobicContact CB-CB 4.15Å; N1196-H1203 PolarHBondContact N-O 2.78Å; N1196-H1203 VanDerWaalsContact N-O 3.14Å; N1196-H1203 WeakPolarHBondContact O-CA 3.5Å; N1196-H1203 WeakPolarHBondContact O-CB 3.16Å; N1196-H1203 PolarHBondContact O-N 2.92Å; H1203-E1246 IonicContact CE1-OE2 3.67Å; H1203-E1246 IonicContact NE2-OE2 2.8Å; H1203-Y1247 PolarHBondContact CD2-O 3.25Å; H1203-I1248 HydrophobicContact CB-CG1 4.17Å
1204	V	90.1	Very high	85.7	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	154.2	-178.3	-71.1	0	0	0	0	110.8	F1192 R1193 L1194 W1206 E1246 Y1247 I1249 L1280	F1192-V1204 HydrophobicContact CE2-CB 3.79Å; F1192-V1204 HydrophobicContact CE2-CG1 4.32Å; F1192-V1204 HydrophobicContact CE2-CG2 4.04Å; F1192-V1204 HydrophobicContact CZ-CB 4.24Å; F1192-V1204 HydrophobicContact CZ-CG1 4.29Å; F1192-V1204 HydrophobicContact CZ-CG2 4.42Å; R1193-V1204 CarbonylContact O-C 3.38Å; R1193-V1204 WeakPolarHBondContact O-CA 2.75Å; L1194-V1204 HydrophobicContact CD1-CG1 4.14Å; V1204-W1206 HydrophobicContact CG2-CZ3 4.17Å; V1204-E1246 WeakPolarHBondContact O-CA 3.39Å; V1204-Y1247 WeakPolarHBondContact CG2-O 2.82Å; V1204-Y1247 PolarHBondContact N-O 2.91Å; V1204-Y1247 PolarHBondContact O-N 3.07Å; V1204-I1249 HydrophobicContact CG2-CD1 4.27Å; V1204-I1249 HydrophobicContact CG2-CG1 4.39Å; V1204-L1280 HydrophobicContact CG1-CD1 3.57Å
1205	A	86.6	Confident	85.6	Confident	2 Å²	2	22.2 Å²	22.2	2%	0.017	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	158.3	176.8	0	0	0	0	0	111.6	F1192 R1193 L1195 V1245 E1246	F1192-A1205 CarbonylContact C-O 3.5Å; F1192-A1205 WeakPolarHBondContact CA-O 2.72Å; R1193-A1205 HydrophobicContact CG-CB 4.5Å; R1193-A1205 PolarHBondContact N-O 2.92Å; R1193-A1205 PolarHBondContact O-N 2.96Å; L1195-A1205 HydrophobicContact CD1-CB 3.65Å; L1195-A1205 HydrophobicContact CD2-CB 4.12Å; L1195-A1205 HydrophobicContact CG-CB 3.68Å; A1205-V1245 CarbonylContact C-O 3.51Å; A1205-V1245 WeakPolarHBondContact CA-O 3.48Å; A1205-V1245 WeakPolarHBondContact CB-O 3.05Å; A1205-E1246 HydrophobicContact CB-CB 4.36Å; A1205-E1246 HydrophobicContact CB-CG 3.93Å
1206	W	88.7	Confident	86	Confident	2 Å²	2	19.8 Å²	19.8	1%	0.008	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	162	175.4	52.7	97.2	0	0	0	111	P1189 F1192 V1204 F1218 V1220 V1236 G1244 V1245 V1262	P1189-W1206 HydrophobicContact CB-CB 4.27Å; P1189-W1206 HydrophobicContact CB-CG 4.11Å; F1192-W1206 HydrophobicContact CB-CB 4.4Å; F1192-W1206 HydrophobicContact CD2-CB 4.17Å; F1192-W1206 AromaticContact CD2-CE3 3.87Å; F1192-W1206 HydrophobicContact CD2-CE3 3.87Å; F1192-W1206 AromaticContact CE2-CE3 3.85Å; F1192-W1206 HydrophobicContact CE2-CE3 3.85Å; F1192-W1206 HydrophobicContact CE2-CZ3 4.26Å; V1204-W1206 HydrophobicContact CG2-CZ3 4.17Å; W1206-F1218 AromaticContact CE2-CG 3.9Å; W1206-F1218 HydrophobicContact CZ2-CB 3.7Å; W1206-F1218 HydrophobicContact CZ2-CD2 4.1Å; W1206-F1218 AromaticContact CZ2-CG 3.89Å; W1206-F1218 HydrophobicContact CZ2-CG 3.89Å; W1206-F1218 AromaticContact NE1-CD1 3.39Å; W1206-F1218 AromaticContact NE1-CD2 3.55Å; W1206-F1218 AromaticContact NE1-CE1 3.63Å; W1206-F1218 AromaticContact NE1-CE2 3.77Å; W1206-F1218 AromaticContact NE1-CG 3.35Å; W1206-F1218 AromaticContact NE1-CZ 3.82Å; W1206-V1220 HydrophobicContact CH2-CG2 3.65Å; W1206-V1220 HydrophobicContact CZ3-CG2 4.16Å; W1206-V1236 HydrophobicContact CH2-CG1 4.38Å; W1206-V1236 HydrophobicContact CH2-CG2 4.36Å; W1206-V1236 HydrophobicContact CZ2-CB 4.38Å; W1206-V1236 HydrophobicContact CZ2-CG1 4.25Å; W1206-G1244 WeakPolarHBondContact O-CA 3.29Å; W1206-V1245 HydrophobicContact CD2-CB 4.44Å; W1206-V1245 HydrophobicContact CD2-CG1 4.5Å; W1206-V1245 HydrophobicContact CH2-CG1 4.13Å; W1206-V1245 HydrophobicContact CZ2-CB 4.2Å; W1206-V1245 HydrophobicContact CZ2-CG1 3.45Å; W1206-V1245 VanDerWaalsContact CZ2-CG1 3.45Å; W1206-V1245 PolarHBondContact N-O 3.26Å; W1206-V1245 PolarHBondContact O-N 3.4Å; W1206-V1262 HydrophobicContact CD2-CG1 4.1Å; W1206-V1262 HydrophobicContact CD2-CG2 4.4Å; W1206-V1262 HydrophobicContact CE3-CG2 4.07Å; W1206-V1262 HydrophobicContact CG-CG1 4.32Å; W1206-V1262 HydrophobicContact CH2-CG2 4Å; W1206-V1262 HydrophobicContact CZ2-CG2 4.31Å; W1206-V1262 HydrophobicContact CZ3-CG2 3.87Å
1207	T	82.1	Confident	86.5	Confident	20 Å²	20	20.9 Å²	20.9	12%	0.123	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	134.5	167.3	-50.7	0	0	0	0	109	I1190 N1243	I1190-T1207 PolarHBondContact N-O 3.31Å; I1190-T1207 PolarHBondContact O-N 3.46Å; T1207-N1243 CarbonylContact C-O 3.58Å; T1207-N1243 WeakPolarHBondContact CA-O 2.95Å
1208	Q	85.4	Confident	87.1	Confident	2 Å²	2	20.8 Å²	20.8	1%	0.009	14%	0.136	C	C	.	.			trans	-66	132.1	176.9	-60.5	-164.3	77.8	0	0	110.9	Q1216 F1218 N1239 R1242 N1243 V1245	Q1208-Q1216 VanDerWaalsContact OE1-NE2 3.15Å; Q1208-F1218 HydrophobicContact CB-CZ 4.16Å; Q1208-F1218 HydrophobicContact CG-CE2 4.07Å; Q1208-F1218 HydrophobicContact CG-CZ 3.7Å; Q1208-N1239 PolarHBondContact NE2-O 3.34Å; Q1208-R1242 PolarHBondContact NE2-O 2.9Å; Q1208-N1243 PolarHBondContact N-O 3.03Å; Q1208-V1245 HydrophobicContact CG-CG2 3.59Å
1209	G	86.5	Confident	87.5	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	13%	0.131	C	C	.	.			trans	-78.6	-173.7	167.5	0	0	0	0	0	111.9	R1079	R1079-G1209 WeakPolarHBondContact CG-O 3.47Å
1210	F	89.3	Confident	88	Confident	8 Å²	8	19 Å²	19	4%	0.035	12%	0.121	C	C	.	.			trans	-64.7	132.8	165.2	172	-120.3	0	0	0	110.7	K1082 A1084 P1186 D1187 G1212	K1082-F1210 HydrophobicContact CB-CB 4.13Å; K1082-F1210 HydrophobicContact CB-CD1 3.72Å; K1082-F1210 HydrophobicContact CB-CD2 3.6Å; K1082-F1210 HydrophobicContact CB-CE1 3.91Å; K1082-F1210 HydrophobicContact CB-CE2 3.83Å; K1082-F1210 HydrophobicContact CB-CG 3.54Å; K1082-F1210 HydrophobicContact CB-CZ 3.96Å; K1082-F1210 HydrophobicContact CD-CB 3.86Å; K1082-F1210 HydrophobicContact CD-CD1 3.49Å; K1082-F1210 VanDerWaalsContact CD-CD1 3.49Å; K1082-F1210 HydrophobicContact CD-CE1 4.16Å; K1082-F1210 HydrophobicContact CD-CG 3.77Å; K1082-F1210 HydrophobicContact CG-CD1 4.27Å; K1082-F1210 HydrophobicContact CG-CG 4.31Å; A1084-F1210 HydrophobicContact CB-CZ 3.7Å; P1186-F1210 CarbonylContact C-O 3.54Å; P1186-F1210 WeakPolarHBondContact CA-O 3.12Å; D1187-F1210 HydrophobicContact CB-CB 4.35Å; D1187-F1210 PolarHBondContact N-O 2.89Å; D1187-F1210 WeakPolarHBondContact OD2-CB 3.44Å; F1210-G1212 VanDerWaalsContact C-N 3.3Å; F1210-G1212 VanDerWaalsContact CE1-CA 3.49Å; F1210-G1212 PolarHBondContact O-N 2.69Å
1211	D	88.3	Confident	88.4	Confident	25 Å²	25	19.9 Å²	19.9	13%	0.134	12%	0.119	C	C	.	.			trans	-82.8	-1.7	-171.7	49	40.4	0	0	0	114.5	R1079 G1213 L1214 Q1216 N1266	R1079-D1211 IonicContact CZ-OD2 3.7Å; R1079-D1211 IonicContact NE-OD2 3.72Å; R1079-D1211 PolarHBondContact NE-OD2 3.13Å; R1079-D1211 VanDerWaalsContact NE-OD2 3.12Å; R1079-D1211 IonicContact NH2-OD2 3.86Å; R1079-D1211 PolarHBondContact NH2-OD2 3.01Å; D1211-G1213 VanDerWaalsContact C-N 3.31Å; D1211-G1213 PolarHBondContact OD1-N 3.24Å; D1211-L1214 WeakPolarHBondContact CB-O 3.39Å; D1211-Q1216 HydrophobicContact CB-CB 3.87Å; D1211-Q1216 HydrophobicContact CB-CG 3.78Å; D1211-N1266 PolarHBondContact O-ND2 3.47Å; D1211-N1266 VanDerWaalsContact O-ND2 3.08Å
1212	G	87.3	Confident	88.7	Confident	0 Å²	0	20 Å²	20	0%	0	12%	0.117	C	C	.	.			trans	79.3	11.4	-177.2	0	0	0	0	0	113.7	T1183 S1184 F1210	T1183-G1212 WeakPolarHBondContact CA-O 3.43Å; S1184-G1212 PolarHBondContact N-O 2.88Å; F1210-G1212 VanDerWaalsContact C-N 3.3Å; F1210-G1212 VanDerWaalsContact CE1-CA 3.49Å; F1210-G1212 PolarHBondContact O-N 2.69Å
1213	G	85.1	Confident	88.8	Confident	21 Å²	21	23.3 Å²	23.3	22%	0.216	13%	0.129	C	C	.	.	S	Bend	trans	79.8	18.4	-178.8	0	0	0	0	0	114.5	A1084 D1211	A1084-G1213 WeakPolarHBondContact O-CA 3.23Å; D1211-G1213 VanDerWaalsContact C-N 3.31Å; D1211-G1213 PolarHBondContact OD1-N 3.24Å
1214	L	85.7	Confident	88.7	Confident	39 Å²	39	23.4 Å²	23.4	20%	0.204	13%	0.13	C	C	.	.	S	Bend	trans	-141.5	157.9	175.6	-68.5	174.1	0	0	0	108.5	T1183 D1211 Q1216 N1266 K1268	T1183-L1214 HydrophobicContact CG2-CD1 4.22Å; T1183-L1214 HydrophobicContact CG2-CD2 4.2Å; T1183-L1214 HydrophobicContact CG2-CG 3.88Å; D1211-L1214 WeakPolarHBondContact CB-O 3.39Å; L1214-Q1216 PolarHBondContact O-N 2.72Å; L1214-N1266 HydrophobicContact CB-CB 4.02Å; L1214-K1268 HydrophobicContact CD1-CB 3.44Å; L1214-K1268 VanDerWaalsContact CD1-CB 3.44Å; L1214-K1268 HydrophobicContact CD1-CD 4.01Å; L1214-K1268 HydrophobicContact CD1-CG 4.36Å
1215	A	85.6	Confident	88.5	Confident	82 Å²	82	26 Å²	26	68%	0.678	15%	0.146	S	C	*	.			trans	-57.7	122.7	176.6	0	0	0	0	0	110.9	N1266	A1215-N1266 WeakPolarHBondContact O-CB 3.28Å
1216	Q	87.3	Confident	88.1	Confident	2 Å²	2	29.5 Å²	29.5	1%	0.009	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	147.1	179.2	71.8	-177	-18.3	0	0	112	P1186 Q1208 D1211 L1214 F1218 S1238 M1265	P1186-Q1216 HydrophobicContact CG-CB 4.31Å; Q1208-Q1216 VanDerWaalsContact OE1-NE2 3.15Å; D1211-Q1216 HydrophobicContact CB-CB 3.87Å; D1211-Q1216 HydrophobicContact CB-CG 3.78Å; L1214-Q1216 PolarHBondContact O-N 2.72Å; Q1216-F1218 HydrophobicContact CG-CE2 4.43Å; Q1216-F1218 HydrophobicContact CG-CZ 4.07Å; Q1216-S1238 VanDerWaalsContact O-CB 3.28Å; Q1216-S1238 WeakPolarHBondContact O-CB 3.07Å; Q1216-S1238 PolarHBondContact O-OG 2.75Å; Q1216-M1265 CarbonylContact C-O 3.59Å; Q1216-M1265 WeakPolarHBondContact CA-O 3.48Å
1217	T	90.8	Very high	87.4	Confident	55 Å²	55	31 Å²	31	34%	0.337	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	166.3	159.9	57.1	0	0	0	0	109	S1264 M1265	T1217-S1264 CarbonylContact O-C 3.28Å; T1217-S1264 WeakPolarHBondContact O-CA 3.4Å; T1217-M1265 PolarHBondContact N-O 2.69Å; T1217-M1265 PolarHBondContact O-N 3.48Å; T1217-M1265 WeakPolarHBondContact OG1-CG 3.22Å
1218	F	93.2	Very high	87.2	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	145.4	175	-55.7	-79.3	0	0	0	109.7	P1189 W1206 Q1208 Q1216 D1235 V1236 V1245 N1263	P1189-F1218 HydrophobicContact CB-CD1 4.45Å; P1189-F1218 HydrophobicContact CB-CE1 4.35Å; P1189-F1218 HydrophobicContact CG-CD1 3.61Å; P1189-F1218 HydrophobicContact CG-CE1 3.71Å; W1206-F1218 AromaticContact CE2-CG 3.9Å; W1206-F1218 HydrophobicContact CZ2-CB 3.7Å; W1206-F1218 HydrophobicContact CZ2-CD2 4.1Å; W1206-F1218 AromaticContact CZ2-CG 3.89Å; W1206-F1218 HydrophobicContact CZ2-CG 3.89Å; W1206-F1218 AromaticContact NE1-CD1 3.39Å; W1206-F1218 AromaticContact NE1-CD2 3.55Å; W1206-F1218 AromaticContact NE1-CE1 3.63Å; W1206-F1218 AromaticContact NE1-CE2 3.77Å; W1206-F1218 AromaticContact NE1-CG 3.35Å; W1206-F1218 AromaticContact NE1-CZ 3.82Å; Q1208-F1218 HydrophobicContact CB-CZ 4.16Å; Q1208-F1218 HydrophobicContact CG-CE2 4.07Å; Q1208-F1218 HydrophobicContact CG-CZ 3.7Å; Q1216-F1218 HydrophobicContact CG-CE2 4.43Å; Q1216-F1218 HydrophobicContact CG-CZ 4.07Å; F1218-D1235 CarbonylContact O-C 3.56Å; F1218-D1235 WeakPolarHBondContact O-CA 3.13Å; F1218-V1236 HydrophobicContact CB-CB 4.38Å; F1218-V1236 PolarHBondContact N-O 2.05Å; F1218-V1236 PolarHBondContact O-N 3.14Å; F1218-V1245 HydrophobicContact CD2-CG1 4.32Å; F1218-V1245 HydrophobicContact CD2-CG2 4.5Å; F1218-V1245 HydrophobicContact CE2-CG2 3.94Å; F1218-N1263 CarbonylContact C-O 3.57Å; F1218-N1263 WeakPolarHBondContact CA-O 3.24Å; F1218-N1263 WeakPolarHBondContact CB-O 3.46Å
1219	Q	91.3	Very high	86.2	Confident	40 Å²	40	41.1 Å²	41.1	19%	0.187	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	113.8	170.8	178.2	174.3	99.1	0	0	109.8	Y1233 A1234 D1235 V1262 N1263 M1265 Y1274	Q1219-Y1233 HydrophobicContact CG-CD1 3.93Å; Q1219-Y1233 VanDerWaalsContact OE1-CD1 3.3Å; Q1219-A1234 WeakPolarHBondContact CA-O 3.26Å; Q1219-D1235 WeakPolarHBondContact CB-OD1 3.23Å; Q1219-D1235 WeakPolarHBondContact CG-OD1 3.13Å; Q1219-D1235 PolarHBondContact NE2-OD1 3.15Å; Q1219-V1262 WeakPolarHBondContact O-CA 3.35Å; Q1219-N1263 WeakPolarHBondContact CB-OD1 3.35Å; Q1219-N1263 PolarHBondContact N-O 2.69Å; Q1219-N1263 PolarHBondContact O-N 3.22Å; Q1219-N1263 VanDerWaalsContact O-N 3.1Å; Q1219-N1263 PolarHBondContact O-OD1 3.21Å; Q1219-M1265 HydrophobicContact CB-CE 3.68Å; Q1219-Y1274 PolarHBondContact OE1-OH 3.5Å
1220	V	93.3	Very high	85.9	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	125.6	173.3	-173	0	0	0	0	107.4	W1206 W1222 Y1233 A1234 V1236 Y1247 I1249 V1260 V1262	W1206-V1220 HydrophobicContact CH2-CG2 3.65Å; W1206-V1220 HydrophobicContact CZ3-CG2 4.16Å; V1220-W1222 HydrophobicContact CG1-CE3 4.14Å; V1220-W1222 HydrophobicContact CG1-CZ3 4.46Å; V1220-Y1233 CarbonylContact O-C 3.46Å; V1220-Y1233 VanDerWaalsContact O-CA 3.28Å; V1220-Y1233 WeakPolarHBondContact O-CA 3.35Å; V1220-A1234 PolarHBondContact N-O 3.11Å; V1220-A1234 PolarHBondContact O-N 3.01Å; V1220-V1236 HydrophobicContact CG2-CG2 3.77Å; V1220-Y1247 HydrophobicContact CB-CD1 4.4Å; V1220-Y1247 HydrophobicContact CG1-CD1 4.35Å; V1220-Y1247 HydrophobicContact CG2-CD1 3.84Å; V1220-Y1247 HydrophobicContact CG2-CE1 4.36Å; V1220-Y1247 HydrophobicContact CG2-CG 4.16Å; V1220-I1249 HydrophobicContact CG1-CD1 3.82Å; V1220-I1249 HydrophobicContact CG1-CG1 4.12Å; V1220-V1260 HydrophobicContact CG1-CG1 4.12Å; V1220-V1262 HydrophobicContact CB-CG2 4.02Å; V1220-V1262 HydrophobicContact CG1-CG2 4.15Å; V1220-V1262 HydrophobicContact CG2-CG2 3.62Å
1221	R	92.6	Very high	85.8	Confident	54 Å²	54	51.3 Å²	51.3	20%	0.204	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	142	169.9	75	173.9	177.5	-173.3	-1.3	111.7	Y1231 K1232 Y1233 V1260 S1261 Y1274	R1221-Y1231 HydrophobicContact CB-CD1 4.14Å; R1221-Y1231 HydrophobicContact CB-CG 4.47Å; R1221-Y1231 HydrophobicContact CG-CD1 3.96Å; R1221-Y1231 HydrophobicContact CG-CE1 4.31Å; R1221-K1232 CarbonylContact C-O 3.59Å; R1221-K1232 VanDerWaalsContact CA-O 3.23Å; R1221-K1232 WeakPolarHBondContact CA-O 3.19Å; R1221-Y1233 HydrophobicContact CB-CD1 3.65Å; R1221-Y1233 HydrophobicContact CB-CE1 3.69Å; R1221-Y1233 HydrophobicContact CB-CG 4.48Å; R1221-V1260 WeakPolarHBondContact O-CA 3.21Å; R1221-S1261 WeakPolarHBondContact CG-OG 3.06Å; R1221-S1261 PolarHBondContact N-O 3.03Å; R1221-S1261 PolarHBondContact NE-OG 3.18Å; R1221-S1261 PolarHBondContact NH2-OG 3.14Å; R1221-S1261 PolarHBondContact O-N 3.41Å; R1221-Y1274 HydrophobicContact CB-CE1 3.99Å; R1221-Y1274 HydrophobicContact CG-CD1 3.79Å; R1221-Y1274 HydrophobicContact CG-CE1 3.48Å; R1221-Y1274 VanDerWaalsContact CG-CE1 3.48Å; R1221-Y1274 VanDerWaalsContact CZ-CD2 3.47Å
1222	W	93.8	Very high	85.8	Confident	22 Å²	22	56 Å²	56	8%	0.083	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	147.9	175.7	66.6	106.7	0	0	0	113.5	V1220 K1232 Y1233 A1234 I1249 L1252 I1259 V1260	V1220-W1222 HydrophobicContact CG1-CE3 4.14Å; V1220-W1222 HydrophobicContact CG1-CZ3 4.46Å; W1222-K1232 HydrophobicContact CD2-CB 3.84Å; W1222-K1232 VanDerWaalsContact CE2-CB 3.49Å; W1222-K1232 HydrophobicContact CE3-CB 4.28Å; W1222-K1232 HydrophobicContact CG-CB 4.38Å; W1222-K1232 HydrophobicContact CH2-CB 4.08Å; W1222-K1232 HydrophobicContact CZ2-CB 3.63Å; W1222-K1232 HydrophobicContact CZ2-CD 4.02Å; W1222-K1232 HydrophobicContact CZ2-CG 4.49Å; W1222-K1232 HydrophobicContact CZ3-CB 4.39Å; W1222-K1232 PolarHBondContact N-O 3.25Å; W1222-K1232 PolarHBondContact O-N 3.45Å; W1222-Y1233 VanDerWaalsContact CZ3-C 3.49Å; W1222-A1234 HydrophobicContact CH2-CB 3.87Å; W1222-A1234 HydrophobicContact CZ3-CB 3.73Å; W1222-I1249 HydrophobicContact CD2-CG2 3.69Å; W1222-I1249 VanDerWaalsContact CE2-CG2 3.44Å; W1222-I1249 HydrophobicContact CE3-CG2 4.2Å; W1222-I1249 HydrophobicContact CG-CG2 4.04Å; W1222-I1249 HydrophobicContact CH2-CG2 4.33Å; W1222-I1249 HydrophobicContact CZ2-CG2 3.8Å; W1222-I1249 HydrophobicContact CZ3-CG2 4.49Å; W1222-L1252 VanDerWaalsContact CD1-CD2 3.4Å; W1222-L1252 HydrophobicContact CG-CD2 4.5Å; W1222-I1259 VanDerWaalsContact CA-O 3.23Å; W1222-I1259 WeakPolarHBondContact CA-O 3.21Å; W1222-V1260 HydrophobicContact CB-CG1 4.37Å; W1222-V1260 HydrophobicContact CB-CG2 3.98Å
1223	R	91	Very high	85.9	Confident	71 Å²	71	61.6 Å²	61.6	27%	0.268	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	155.1	168.6	76.4	-179.1	-179.9	105.3	4.4	111.6	S1227 Y1231 Y1258 I1259	R1223-S1227 PolarHBondContact NH1-O 3.5Å; R1223-Y1231 HydrophobicContact CB-CD1 3.84Å; R1223-Y1231 HydrophobicContact CB-CE1 4.05Å; R1223-Y1231 HydrophobicContact CB-CG 4.35Å; R1223-Y1231 VanDerWaalsContact CD-CZ 3.49Å; R1223-Y1231 HydrophobicContact CG-CD1 3.88Å; R1223-Y1231 HydrophobicContact CG-CE1 3.55Å; R1223-Y1231 PolarHBondContact NE-OH 3.26Å; R1223-Y1258 VanDerWaalsContact C-CD1 3.44Å; R1223-Y1258 CarbonylContact O-C 3.58Å; R1223-Y1258 VanDerWaalsContact O-CA 3.31Å; R1223-Y1258 WeakPolarHBondContact O-CA 2.99Å; R1223-Y1258 WeakPolarHBondContact O-CD1 3.34Å; R1223-I1259 PolarHBondContact N-O 2.72Å; R1223-I1259 PolarHBondContact O-N 3.3Å
1224	E	89.6	Confident	86.1	Confident	46 Å²	46	61.3 Å²	61.3	22%	0.215	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	132.3	176.6	-168.4	175.5	157.1	0	0	110.5	G1226 S1227 K1253 Y1258	E1224-G1226 PolarHBondContact O-N 2.72Å; E1224-S1227 WeakPolarHBondContact O-CB 3.16Å; E1224-S1227 PolarHBondContact O-N 2.93Å; E1224-S1227 VanDerWaalsContact O-N 3.11Å; E1224-K1253 WeakPolarHBondContact OE1-CD 3.16Å; E1224-K1253 IonicContact OE1-NZ 2.86Å; E1224-K1253 PolarHBondContact OE1-NZ 3.09Å; E1224-K1253 WeakPolarHBondContact OE2-CD 3.13Å; E1224-K1253 VanDerWaalsContact OE2-CE 3.25Å; E1224-K1253 WeakPolarHBondContact OE2-CE 3.15Å; E1224-K1253 IonicContact OE2-NZ 2.71Å; E1224-K1253 PolarHBondContact OE2-NZ 2.81Å; E1224-Y1258 HydrophobicContact CB-CD1 4.23Å; E1224-Y1258 HydrophobicContact CB-CE1 3.71Å; E1224-Y1258 HydrophobicContact CG-CE1 4.3Å
1225	V	85.1	Confident	86.2	Confident	55 Å²	55	64.5 Å²	64.5	33%	0.333	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	132.3	-179.9	175.4	0	0	0	0	109.5	S1227 E1257 I1259	V1225-S1227 PolarHBondContact O-N 3.4Å; V1225-E1257 HydrophobicContact CB-CB 4.09Å; V1225-E1257 WeakPolarHBondContact CB-O 3.27Å; V1225-E1257 HydrophobicContact CG2-CB 3.98Å; V1225-E1257 HydrophobicContact CG2-CG 3.99Å; V1225-E1257 WeakPolarHBondContact CG2-O 3.1Å; V1225-E1257 PolarHBondContact N-O 2.75Å; V1225-I1259 HydrophobicContact CG2-CD1 4.17Å; V1225-I1259 HydrophobicContact CG2-CG1 3.93Å
1226	G	77.2	Confident	86.4	Confident	75 Å²	75	61.5 Å²	61.5	77%	0.773	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.2	-10.7	-173.9	0	0	0	0	0	115	E1224	E1224-G1226 PolarHBondContact O-N 2.72Å
1227	S	75.3	Confident	86.3	Confident	35 Å²	35	64.7 Å²	64.7	25%	0.245	35%	0.353	C	S	.	.			trans	-78.8	140.5	176.4	-174.4	0	0	0	0	112.6	R1223 E1224 V1225 S1229	R1223-S1227 PolarHBondContact NH1-O 3.5Å; E1224-S1227 WeakPolarHBondContact O-CB 3.16Å; E1224-S1227 PolarHBondContact O-N 2.93Å; E1224-S1227 VanDerWaalsContact O-N 3.11Å; V1225-S1227 PolarHBondContact O-N 3.4Å; S1227-S1229 WeakPolarHBondContact CB-OG 3.36Å; S1227-S1229 VanDerWaalsContact OG-CB 3.28Å; S1227-S1229 WeakPolarHBondContact OG-CB 3.45Å; S1227-S1229 PolarHBondContact OG-N 2.56Å; S1227-S1229 VanDerWaalsContact OG-N 3.07Å; S1227-S1229 PolarHBondContact OG-OG 3.26Å
1228	I	77.1	Confident	85.9	Confident	176 Å²	176	63.4 Å²	63.4	90%	0.903	35%	0.346	S	S	*	.			trans	-78.2	-10.8	170.9	-43.3	177.3	0	0	0	110.9	L1230	I1228-L1230 PolarHBondContact O-N 2.77Å
1229	S	65.9	Low	84.8	Confident	58 Å²	58	66.5 Å²	66.5	41%	0.406	36%	0.363	S	S	.	.	S	Bend	trans	-58	137	178.3	62.7	0	0	0	0	112.4	S1227	S1227-S1229 WeakPolarHBondContact CB-OG 3.36Å; S1227-S1229 VanDerWaalsContact OG-CB 3.28Å; S1227-S1229 WeakPolarHBondContact OG-CB 3.45Å; S1227-S1229 PolarHBondContact OG-N 2.56Å; S1227-S1229 VanDerWaalsContact OG-N 3.07Å; S1227-S1229 PolarHBondContact OG-OG 3.26Å
1230	L	79.2	Confident	83.6	Confident	161 Å²	161	69.1 Å²	69.1	84%	0.843	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-50.6	154.2	167.7	-68.6	167.8	0	0	0	111.6	I1228	I1228-L1230 PolarHBondContact O-N 2.77Å
1231	Y	87.7	Confident	81.9	Confident	61 Å²	61	75.4 Å²	75.4	24%	0.239	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-59.1	139.9	170.8	-74.8	-84.9	0	0	0	110.6	R1221 R1223 Y1233 I1259	R1221-Y1231 HydrophobicContact CB-CD1 4.14Å; R1221-Y1231 HydrophobicContact CB-CG 4.47Å; R1221-Y1231 HydrophobicContact CG-CD1 3.96Å; R1221-Y1231 HydrophobicContact CG-CE1 4.31Å; R1223-Y1231 HydrophobicContact CB-CD1 3.84Å; R1223-Y1231 HydrophobicContact CB-CE1 4.05Å; R1223-Y1231 HydrophobicContact CB-CG 4.35Å; R1223-Y1231 VanDerWaalsContact CD-CZ 3.49Å; R1223-Y1231 HydrophobicContact CG-CD1 3.88Å; R1223-Y1231 HydrophobicContact CG-CE1 3.55Å; R1223-Y1231 PolarHBondContact NE-OH 3.26Å; Y1231-Y1233 WeakPolarHBondContact O-CD2 3.05Å; Y1231-Y1233 WeakPolarHBondContact O-CE2 3.24Å; Y1231-I1259 HydrophobicContact CE1-CG2 4.1Å
1232	K	87.2	Confident	80.4	Confident	122 Å²	122	77.5 Å²	77.5	53%	0.53	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	151.7	158.3	-68.8	-175.6	176.2	-173.9	0	108.6	R1221 W1222	R1221-K1232 CarbonylContact C-O 3.59Å; R1221-K1232 VanDerWaalsContact CA-O 3.23Å; R1221-K1232 WeakPolarHBondContact CA-O 3.19Å; W1222-K1232 HydrophobicContact CD2-CB 3.84Å; W1222-K1232 VanDerWaalsContact CE2-CB 3.49Å; W1222-K1232 HydrophobicContact CE3-CB 4.28Å; W1222-K1232 HydrophobicContact CG-CB 4.38Å; W1222-K1232 HydrophobicContact CH2-CB 4.08Å; W1222-K1232 HydrophobicContact CZ2-CB 3.63Å; W1222-K1232 HydrophobicContact CZ2-CD 4.02Å; W1222-K1232 HydrophobicContact CZ2-CG 4.49Å; W1222-K1232 HydrophobicContact CZ3-CB 4.39Å; W1222-K1232 PolarHBondContact N-O 3.25Å; W1222-K1232 PolarHBondContact O-N 3.45Å
1233	Y	91	Very high	79.2	Confident	119 Å²	119	77.1 Å²	77.1	47%	0.467	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	150.3	-176.5	-61	-92.5	0	0	0	110.2	Q1219 V1220 R1221 W1222 Y1231 Y1274	Q1219-Y1233 HydrophobicContact CG-CD1 3.93Å; Q1219-Y1233 VanDerWaalsContact OE1-CD1 3.3Å; V1220-Y1233 CarbonylContact O-C 3.46Å; V1220-Y1233 VanDerWaalsContact O-CA 3.28Å; V1220-Y1233 WeakPolarHBondContact O-CA 3.35Å; R1221-Y1233 HydrophobicContact CB-CD1 3.65Å; R1221-Y1233 HydrophobicContact CB-CE1 3.69Å; R1221-Y1233 HydrophobicContact CB-CG 4.48Å; W1222-Y1233 VanDerWaalsContact CZ3-C 3.49Å; Y1231-Y1233 WeakPolarHBondContact O-CD2 3.05Å; Y1231-Y1233 WeakPolarHBondContact O-CE2 3.24Å; Y1233-Y1274 WeakPolarHBondContact CE1-OH 3.28Å
1234	A	88.5	Confident	78.4	Confident	15 Å²	15	74.5 Å²	74.5	12%	0.124	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	131.6	167.8	0	0	0	0	0	109.8	Q1219 V1220 W1222 Y1247	Q1219-A1234 WeakPolarHBondContact CA-O 3.26Å; V1220-A1234 PolarHBondContact N-O 3.11Å; V1220-A1234 PolarHBondContact O-N 3.01Å; W1222-A1234 HydrophobicContact CH2-CB 3.87Å; W1222-A1234 HydrophobicContact CZ3-CB 3.73Å; A1234-Y1247 HydrophobicContact CB-CE1 4.11Å; A1234-Y1247 VanDerWaalsContact CB-OH 3.22Å; A1234-Y1247 WeakPolarHBondContact CB-OH 3.48Å
1235	D	88.2	Confident	78.1	Confident	105 Å²	105	72.7 Å²	72.7	56%	0.561	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.4	140.7	176	-54.9	-48.8	0	0	0	110.3	F1218 Q1219	F1218-D1235 CarbonylContact O-C 3.56Å; F1218-D1235 WeakPolarHBondContact O-CA 3.13Å; Q1219-D1235 WeakPolarHBondContact CB-OD1 3.23Å; Q1219-D1235 WeakPolarHBondContact CG-OD1 3.13Å; Q1219-D1235 PolarHBondContact NE2-OD1 3.15Å
1236	V	88.9	Confident	78.2	Confident	19 Å²	19	73.9 Å²	73.9	12%	0.115	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	127.7	-173	-175.5	0	0	0	0	108.2	W1206 F1218 V1220 V1245 Y1247	W1206-V1236 HydrophobicContact CH2-CG1 4.38Å; W1206-V1236 HydrophobicContact CH2-CG2 4.36Å; W1206-V1236 HydrophobicContact CZ2-CB 4.38Å; W1206-V1236 HydrophobicContact CZ2-CG1 4.25Å; F1218-V1236 HydrophobicContact CB-CB 4.38Å; F1218-V1236 PolarHBondContact N-O 2.05Å; F1218-V1236 PolarHBondContact O-N 3.14Å; V1220-V1236 HydrophobicContact CG2-CG2 3.77Å; V1236-V1245 HydrophobicContact CG1-CG1 3.91Å; V1236-Y1247 HydrophobicContact CG1-CD2 4.32Å; V1236-Y1247 HydrophobicContact CG2-CD1 4.49Å; V1236-Y1247 HydrophobicContact CG2-CD2 3.41Å; V1236-Y1247 VanDerWaalsContact CG2-CD2 3.41Å; V1236-Y1247 HydrophobicContact CG2-CE2 3.8Å; V1236-Y1247 HydrophobicContact CG2-CG 3.81Å
1237	A	84.8	Confident	78.8	Confident	70 Å²	70	73.2 Å²	73.2	58%	0.579	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.3	155.1	179	0	0	0	0	0	112.2
1238	S	82.3	Confident	79.5	Confident	28 Å²	28	75.5 Å²	75.5	20%	0.196	39%	0.391	C	S	.	.			trans	-63	161.5	160.4	57.5	0	0	0	0	111.1	Q1216	Q1216-S1238 VanDerWaalsContact O-CB 3.28Å; Q1216-S1238 WeakPolarHBondContact O-CB 3.07Å; Q1216-S1238 PolarHBondContact O-OG 2.75Å
1239	N	70.6	Confident	80.1	Confident	65 Å²	65	67.1 Å²	67.1	35%	0.348	35%	0.348	S	S	.	.			trans	-121.7	104.6	165	-168.8	-38.8	0	0	0	108.4	Q1208 N1241 R1242	Q1208-N1239 PolarHBondContact NE2-O 3.34Å; N1239-N1241 PolarHBondContact O-N 3.39Å; N1239-N1241 PolarHBondContact OD1-N 2.7Å; N1239-R1242 HydrophobicContact CB-CB 4.08Å; N1239-R1242 PolarHBondContact O-N 2.89Å; N1239-R1242 VanDerWaalsContact O-N 3.14Å; N1239-R1242 PolarHBondContact OD1-N 3.03Å
1240	D	66.4	Low	81.1	Confident	94 Å²	94	67 Å²	67	50%	0.503	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-18.6	-172.9	-72.9	-46.4	0	0	0	114.1	R1079	R1079-D1240 IonicContact CZ-OD1 3.72Å; R1079-D1240 IonicContact NH1-OD1 2.79Å; R1079-D1240 PolarHBondContact NH1-OD1 2.84Å; R1079-D1240 VanDerWaalsContact NH1-OD1 3.16Å; R1079-D1240 IonicContact NH2-OD1 3.25Å; R1079-D1240 PolarHBondContact NH2-OD1 3.24Å
1241	N	56.8	Low	81.2	Confident	133 Å²	133	62 Å²	62	71%	0.711	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-1.6	176.7	-59	-12.4	0	0	0	112.8	N1239	N1239-N1241 PolarHBondContact O-N 3.39Å; N1239-N1241 PolarHBondContact OD1-N 2.7Å
1242	R	62.4	Low	81.3	Confident	98 Å²	98	59.6 Å²	59.6	37%	0.37	32%	0.324	S	S	.	.			trans	-147.6	116	-168.3	-81.1	-175.7	172.4	-147.3	4.6	113.3	W992 Q1208 N1239 G1244	W992-R1242 HydrophobicContact CH2-CB 4.31Å; W992-R1242 HydrophobicContact CH2-CG 4.26Å; W992-R1242 HydrophobicContact CZ3-CB 3.78Å; W992-R1242 HydrophobicContact CZ3-CG 3.7Å; Q1208-R1242 PolarHBondContact NE2-O 2.9Å; N1239-R1242 HydrophobicContact CB-CB 4.08Å; N1239-R1242 PolarHBondContact O-N 2.89Å; N1239-R1242 VanDerWaalsContact O-N 3.14Å; N1239-R1242 PolarHBondContact OD1-N 3.03Å; R1242-G1244 PolarHBondContact O-N 2.77Å
1243	N	68	Low	81	Confident	14 Å²	14	58.9 Å²	58.9	8%	0.075	32%	0.321	C	S	.	.	S	Bend	trans	-66.4	-18.4	177.5	-72.2	-42.6	0	0	0	114.5	E995 L1077 T1207 Q1208	E995-N1243 PolarHBondContact OE2-ND2 2.55Å; L1077-N1243 WeakPolarHBondContact CD1-ND2 3.49Å; T1207-N1243 CarbonylContact C-O 3.58Å; T1207-N1243 WeakPolarHBondContact CA-O 2.95Å; Q1208-N1243 PolarHBondContact N-O 3.03Å
1244	G	74.5	Confident	80.7	Confident	16 Å²	16	55.1 Å²	55.1	17%	0.165	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	133.5	170.8	0	0	0	0	0	112.3	W1206 R1242	W1206-G1244 WeakPolarHBondContact O-CA 3.29Å; R1242-G1244 PolarHBondContact O-N 2.77Å
1245	V	82.4	Confident	80.4	Confident	8 Å²	8	55 Å²	55	5%	0.048	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	138.5	170.2	174.8	0	0	0	0	108.7	A1205 W1206 Q1208 F1218 V1236	A1205-V1245 CarbonylContact C-O 3.51Å; A1205-V1245 WeakPolarHBondContact CA-O 3.48Å; A1205-V1245 WeakPolarHBondContact CB-O 3.05Å; W1206-V1245 HydrophobicContact CD2-CB 4.44Å; W1206-V1245 HydrophobicContact CD2-CG1 4.5Å; W1206-V1245 HydrophobicContact CH2-CG1 4.13Å; W1206-V1245 HydrophobicContact CZ2-CB 4.2Å; W1206-V1245 HydrophobicContact CZ2-CG1 3.45Å; W1206-V1245 VanDerWaalsContact CZ2-CG1 3.45Å; W1206-V1245 PolarHBondContact N-O 3.26Å; W1206-V1245 PolarHBondContact O-N 3.4Å; Q1208-V1245 HydrophobicContact CG-CG2 3.59Å; F1218-V1245 HydrophobicContact CD2-CG1 4.32Å; F1218-V1245 HydrophobicContact CD2-CG2 4.5Å; F1218-V1245 HydrophobicContact CE2-CG2 3.94Å; V1236-V1245 HydrophobicContact CG1-CG1 3.91Å
1246	E	86.9	Confident	80.5	Confident	80 Å²	80	51.1 Å²	51.1	37%	0.374	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	141.7	-174.6	-50.7	-170.3	156.8	0	0	109.5	W992 L1195 H1203 V1204 A1205	W992-E1246 WeakPolarHBondContact CZ2-OE1 3.45Å; L1195-E1246 HydrophobicContact CD1-CB 4.46Å; L1195-E1246 HydrophobicContact CD1-CG 4.03Å; L1195-E1246 WeakPolarHBondContact CD1-OE1 3.35Å; H1203-E1246 IonicContact CE1-OE2 3.67Å; H1203-E1246 IonicContact NE2-OE2 2.8Å; V1204-E1246 WeakPolarHBondContact O-CA 3.39Å; A1205-E1246 HydrophobicContact CB-CB 4.36Å; A1205-E1246 HydrophobicContact CB-CG 3.93Å
1247	Y	90.5	Very high	80.5	Confident	61 Å²	61	52.9 Å²	52.9	24%	0.239	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	136.2	180	-174.8	-101.9	0	0	0	112.5	H1203 V1204 V1220 A1234 V1236 I1249	H1203-Y1247 PolarHBondContact CD2-O 3.25Å; V1204-Y1247 WeakPolarHBondContact CG2-O 2.82Å; V1204-Y1247 PolarHBondContact N-O 2.91Å; V1204-Y1247 PolarHBondContact O-N 3.07Å; V1220-Y1247 HydrophobicContact CB-CD1 4.4Å; V1220-Y1247 HydrophobicContact CG1-CD1 4.35Å; V1220-Y1247 HydrophobicContact CG2-CD1 3.84Å; V1220-Y1247 HydrophobicContact CG2-CE1 4.36Å; V1220-Y1247 HydrophobicContact CG2-CG 4.16Å; A1234-Y1247 HydrophobicContact CB-CE1 4.11Å; A1234-Y1247 VanDerWaalsContact CB-OH 3.22Å; A1234-Y1247 WeakPolarHBondContact CB-OH 3.48Å; V1236-Y1247 HydrophobicContact CG1-CD2 4.32Å; V1236-Y1247 HydrophobicContact CG2-CD1 4.49Å; V1236-Y1247 HydrophobicContact CG2-CD2 3.41Å; V1236-Y1247 VanDerWaalsContact CG2-CD2 3.41Å; V1236-Y1247 HydrophobicContact CG2-CE2 3.8Å; V1236-Y1247 HydrophobicContact CG2-CG 3.81Å; Y1247-I1249 HydrophobicContact CD1-CG1 3.78Å; Y1247-I1249 HydrophobicContact CE1-CB 4.4Å; Y1247-I1249 HydrophobicContact CE1-CG1 3.82Å
1248	I	89.7	Confident	80.9	Confident	83 Å²	83	50.2 Å²	50.2	43%	0.426	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	104.7	177.9	-55.2	174.7	0	0	0	108.8	T1201 H1203 T1250	T1201-I1248 HydrophobicContact CG2-CG2 4.35Å; H1203-I1248 HydrophobicContact CB-CG1 4.17Å; I1248-T1250 HydrophobicContact CG2-CG2 3.96Å; I1248-T1250 PolarHBondContact O-N 2.88Å
1249	I	89.4	Confident	81.3	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	124.9	169.8	-51.4	172.9	0	0	0	107.6	T1201 L1202 V1204 V1220 W1222 Y1247 L1252 V1260	T1201-I1249 CarbonylContact C-O 3.57Å; T1201-I1249 WeakPolarHBondContact CA-O 3.07Å; T1201-I1249 VanDerWaalsContact CB-O 3.23Å; T1201-I1249 WeakPolarHBondContact CB-O 3.47Å; L1202-I1249 HydrophobicContact CB-CB 4.42Å; L1202-I1249 PolarHBondContact N-O 3.19Å; L1202-I1249 PolarHBondContact O-N 2.72Å; V1204-I1249 HydrophobicContact CG2-CD1 4.27Å; V1204-I1249 HydrophobicContact CG2-CG1 4.39Å; V1220-I1249 HydrophobicContact CG1-CD1 3.82Å; V1220-I1249 HydrophobicContact CG1-CG1 4.12Å; W1222-I1249 HydrophobicContact CD2-CG2 3.69Å; W1222-I1249 VanDerWaalsContact CE2-CG2 3.44Å; W1222-I1249 HydrophobicContact CE3-CG2 4.2Å; W1222-I1249 HydrophobicContact CG-CG2 4.04Å; W1222-I1249 HydrophobicContact CH2-CG2 4.33Å; W1222-I1249 HydrophobicContact CZ2-CG2 3.8Å; W1222-I1249 HydrophobicContact CZ3-CG2 4.49Å; Y1247-I1249 HydrophobicContact CD1-CG1 3.78Å; Y1247-I1249 HydrophobicContact CE1-CB 4.4Å; Y1247-I1249 HydrophobicContact CE1-CG1 3.82Å; I1249-L1252 HydrophobicContact CB-CD1 4.3Å; I1249-L1252 HydrophobicContact CG2-CD1 3.99Å; I1249-L1252 HydrophobicContact CG2-CD2 3.84Å; I1249-L1252 HydrophobicContact CG2-CG 4.06Å; I1249-V1260 HydrophobicContact CD1-CB 4.5Å; I1249-V1260 HydrophobicContact CD1-CG1 3.5Å; I1249-V1260 HydrophobicContact CD1-CG2 4.12Å
1250	T	87.5	Confident	82.4	Confident	54 Å²	54	46.5 Å²	46.5	33%	0.331	25%	0.252	S	S	.	.			trans	-116.5	170.8	-178.3	62.8	0	0	0	0	112.4	T1201 I1248 L1252 P1296	T1201-T1250 HydrophobicContact CG2-CG2 3.95Å; I1248-T1250 HydrophobicContact CG2-CG2 3.96Å; I1248-T1250 PolarHBondContact O-N 2.88Å; T1250-L1252 VanDerWaalsContact C-N 3.31Å; T1250-L1252 PolarHBondContact O-N 3.21Å; T1250-P1296 HydrophobicContact CG2-CG 4.25Å
1251	G	82.4	Confident	83.7	Confident	57 Å²	57	42 Å²	42	59%	0.588	23%	0.229	S	C	*	.	S	Bend	trans	66.7	31.1	175.6	0	0	0	0	0	113.8	S1200	S1200-G1251 PolarHBondContact O-N 2.78Å
1252	L	88.5	Confident	85.5	Confident	11 Å²	11	35.7 Å²	35.7	6%	0.058	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-85.8	152.6	175.9	-60	175.1	0	0	0	110.8	S1200 L1202 W1222 I1249 T1250 Y1258 T1282	S1200-L1252 WeakPolarHBondContact O-CB 3.01Å; S1200-L1252 PolarHBondContact O-N 3.42Å; L1202-L1252 HydrophobicContact CB-CD1 3.99Å; L1202-L1252 HydrophobicContact CD1-CD1 3.63Å; L1202-L1252 HydrophobicContact CG-CD1 3.52Å; W1222-L1252 VanDerWaalsContact CD1-CD2 3.4Å; W1222-L1252 HydrophobicContact CG-CD2 4.5Å; I1249-L1252 HydrophobicContact CB-CD1 4.3Å; I1249-L1252 HydrophobicContact CG2-CD1 3.99Å; I1249-L1252 HydrophobicContact CG2-CD2 3.84Å; I1249-L1252 HydrophobicContact CG2-CG 4.06Å; T1250-L1252 VanDerWaalsContact C-N 3.31Å; T1250-L1252 PolarHBondContact O-N 3.21Å; L1252-Y1258 HydrophobicContact CB-CE2 3.88Å; L1252-Y1258 HydrophobicContact CD1-CD2 4.47Å; L1252-Y1258 HydrophobicContact CD2-CD1 4.04Å; L1252-Y1258 HydrophobicContact CD2-CD2 4.28Å; L1252-Y1258 HydrophobicContact CD2-CE1 3.86Å; L1252-Y1258 HydrophobicContact CD2-CE2 4.06Å; L1252-Y1258 HydrophobicContact CD2-CG 4.29Å; L1252-Y1258 HydrophobicContact CG-CE2 4.41Å; L1252-T1282 HydrophobicContact CB-CG2 3.67Å; L1252-T1282 HydrophobicContact CD1-CG2 3.7Å; L1252-T1282 HydrophobicContact CG-CG2 4.35Å
1253	K	81.9	Confident	87	Confident	107 Å²	107	31.2 Å²	31.2	47%	0.465	18%	0.178	S	C	.	.	P	Polyproline II helix	trans	-69.9	156.4	167.4	-68.2	-178.5	-173.5	159.2	0	110.3	E1224 S1256 Y1258 T1282	E1224-K1253 WeakPolarHBondContact OE1-CD 3.16Å; E1224-K1253 IonicContact OE1-NZ 2.86Å; E1224-K1253 PolarHBondContact OE1-NZ 3.09Å; E1224-K1253 WeakPolarHBondContact OE2-CD 3.13Å; E1224-K1253 VanDerWaalsContact OE2-CE 3.25Å; E1224-K1253 WeakPolarHBondContact OE2-CE 3.15Å; E1224-K1253 IonicContact OE2-NZ 2.71Å; E1224-K1253 PolarHBondContact OE2-NZ 2.81Å; K1253-S1256 VanDerWaalsContact CB-OG 3.32Å; K1253-S1256 WeakPolarHBondContact CB-OG 3.27Å; K1253-Y1258 WeakPolarHBondContact CB-OH 3.49Å; K1253-Y1258 PolarHBondContact N-OH 2.76Å; K1253-T1282 WeakPolarHBondContact O-CB 3.2Å; K1253-T1282 WeakPolarHBondContact O-CG2 3.14Å; K1253-T1282 PolarHBondContact O-OG1 3.07Å
1254	P	84.3	Confident	88.1	Confident	39 Å²	39	30.6 Å²	30.6	25%	0.253	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	153.3	-178	-0.6	22.5	0	0	0	112.2	S1199 S1256 T1282 L1283 L1285	S1199-P1254 VanDerWaalsContact O-CA 3.31Å; S1199-P1254 WeakPolarHBondContact O-CA 3.36Å; S1199-P1254 VanDerWaalsContact O-CB 3.28Å; S1199-P1254 WeakPolarHBondContact O-CB 3.28Å; P1254-S1256 PolarHBondContact O-N 3.32Å; P1254-S1256 PolarHBondContact O-OG 2.92Å; P1254-T1282 WeakPolarHBondContact CA-OG1 3.13Å; P1254-L1283 CarbonylContact C-O 3.5Å; P1254-L1283 VanDerWaalsContact CA-O 3.24Å; P1254-L1283 WeakPolarHBondContact CA-O 3.22Å; P1254-L1283 WeakPolarHBondContact CB-O 3.32Å; P1254-L1285 HydrophobicContact CB-CB 3.54Å; P1254-L1285 HydrophobicContact CB-CD1 3.95Å; P1254-L1285 HydrophobicContact CB-CD2 4.39Å; P1254-L1285 HydrophobicContact CB-CG 4.11Å; P1254-L1285 HydrophobicContact CG-CB 3.54Å; P1254-L1285 HydrophobicContact CG-CD1 3.67Å; P1254-L1285 HydrophobicContact CG-CD2 3.45Å; P1254-L1285 VanDerWaalsContact CG-CD2 3.45Å; P1254-L1285 HydrophobicContact CG-CG 3.7Å
1255	G	82.8	Confident	88.9	Confident	13 Å²	13	31.9 Å²	31.9	13%	0.134	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.8	6.8	179	0	0	0	0	0	113.5	R1281 T1282 L1283 S1284	G1255-R1281 PolarHBondContact O-NE 3.3Å; G1255-T1282 WeakPolarHBondContact CA-O 3.25Å; G1255-T1282 PolarHBondContact N-OG1 2.92Å; G1255-T1282 VanDerWaalsContact N-OG1 3.14Å; G1255-L1283 VanDerWaalsContact N-C 3.33Å; G1255-L1283 PolarHBondContact N-O 2.99Å; G1255-S1284 WeakPolarHBondContact CA-OG 3.41Å
1256	S	88.5	Confident	89.2	Confident	24 Å²	24	31.8 Å²	31.8	17%	0.168	18%	0.176	C	C	.	.			trans	-100.8	136.9	-164.2	-64.7	0	0	0	0	107.6	K1253 P1254 Y1258 R1281 T1282	K1253-S1256 VanDerWaalsContact CB-OG 3.32Å; K1253-S1256 WeakPolarHBondContact CB-OG 3.27Å; P1254-S1256 PolarHBondContact O-N 3.32Å; P1254-S1256 PolarHBondContact O-OG 2.92Å; S1256-Y1258 WeakPolarHBondContact O-CD2 3.5Å; S1256-R1281 WeakPolarHBondContact O-CA 3.39Å; S1256-T1282 PolarHBondContact N-OG1 3.07Å; S1256-T1282 VanDerWaalsContact N-OG1 3.09Å; S1256-T1282 PolarHBondContact O-N 2.9Å; S1256-T1282 PolarHBondContact O-OG1 2.69Å; S1256-T1282 VanDerWaalsContact O-OG1 3.13Å
1257	E	90.3	Very high	89.1	Confident	56 Å²	56	33.5 Å²	33.5	26%	0.262	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	129.4	-176.8	-156.1	176.2	128.6	0	0	109	V1225 H1279 R1281	V1225-E1257 HydrophobicContact CB-CB 4.09Å; V1225-E1257 WeakPolarHBondContact CB-O 3.27Å; V1225-E1257 HydrophobicContact CG2-CB 3.98Å; V1225-E1257 HydrophobicContact CG2-CG 3.99Å; V1225-E1257 WeakPolarHBondContact CG2-O 3.1Å; V1225-E1257 PolarHBondContact N-O 2.75Å; E1257-H1279 IonicContact OE1-CE1 3.49Å; E1257-H1279 IonicContact OE1-CG 3.36Å; E1257-H1279 IonicContact OE1-ND1 3.56Å; E1257-H1279 PolarHBondContact OE1-ND1 2.98Å; E1257-R1281 HydrophobicContact CB-CG 4.34Å; E1257-R1281 IonicContact OE2-CZ 3.89Å; E1257-R1281 IonicContact OE2-NH1 3.13Å; E1257-R1281 PolarHBondContact OE2-NH1 2.95Å
1258	Y	92.2	Very high	88.8	Confident	13 Å²	13	35.9 Å²	35.9	5%	0.051	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	130.1	179.8	-75	-85.1	0	0	0	109.8	R1223 E1224 L1252 K1253 S1256 L1280 T1282	R1223-Y1258 VanDerWaalsContact C-CD1 3.44Å; R1223-Y1258 CarbonylContact O-C 3.58Å; R1223-Y1258 VanDerWaalsContact O-CA 3.31Å; R1223-Y1258 WeakPolarHBondContact O-CA 2.99Å; R1223-Y1258 WeakPolarHBondContact O-CD1 3.34Å; E1224-Y1258 HydrophobicContact CB-CD1 4.23Å; E1224-Y1258 HydrophobicContact CB-CE1 3.71Å; E1224-Y1258 HydrophobicContact CG-CE1 4.3Å; L1252-Y1258 HydrophobicContact CB-CE2 3.88Å; L1252-Y1258 HydrophobicContact CD1-CD2 4.47Å; L1252-Y1258 HydrophobicContact CD2-CD1 4.04Å; L1252-Y1258 HydrophobicContact CD2-CD2 4.28Å; L1252-Y1258 HydrophobicContact CD2-CE1 3.86Å; L1252-Y1258 HydrophobicContact CD2-CE2 4.06Å; L1252-Y1258 HydrophobicContact CD2-CG 4.29Å; L1252-Y1258 HydrophobicContact CG-CE2 4.41Å; K1253-Y1258 WeakPolarHBondContact CB-OH 3.49Å; K1253-Y1258 PolarHBondContact N-OH 2.76Å; S1256-Y1258 WeakPolarHBondContact O-CD2 3.5Å; Y1258-L1280 PolarHBondContact N-O 3.13Å; Y1258-L1280 PolarHBondContact O-N 2.87Å; Y1258-T1282 HydrophobicContact CD2-CG2 4.16Å; Y1258-T1282 HydrophobicContact CE2-CG2 4.16Å
1259	I	91.4	Very high	88.5	Confident	16 Å²	16	35.5 Å²	35.5	8%	0.082	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	121.6	159.2	-80.5	158.7	0	0	0	106.6	W1222 R1223 V1225 Y1231 P1277 H1279	W1222-I1259 VanDerWaalsContact CA-O 3.23Å; W1222-I1259 WeakPolarHBondContact CA-O 3.21Å; R1223-I1259 PolarHBondContact N-O 2.72Å; R1223-I1259 PolarHBondContact O-N 3.3Å; V1225-I1259 HydrophobicContact CG2-CD1 4.17Å; V1225-I1259 HydrophobicContact CG2-CG1 3.93Å; Y1231-I1259 HydrophobicContact CE1-CG2 4.1Å; I1259-P1277 HydrophobicContact CG2-CB 3.64Å; I1259-H1279 WeakPolarHBondContact CG1-NE2 3.2Å
1260	V	93.9	Very high	88.2	Confident	0 Å²	0	37 Å²	37	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	136.8	173.4	-168.6	0	0	0	0	108.9	F1192 L1202 V1220 R1221 W1222 I1249 I1278 L1280	F1192-V1260 HydrophobicContact CE1-CG1 4.35Å; F1192-V1260 HydrophobicContact CZ-CB 4.43Å; F1192-V1260 HydrophobicContact CZ-CG1 3.81Å; L1202-V1260 HydrophobicContact CD1-CG2 4.07Å; V1220-V1260 HydrophobicContact CG1-CG1 4.12Å; R1221-V1260 WeakPolarHBondContact O-CA 3.21Å; W1222-V1260 HydrophobicContact CB-CG1 4.37Å; W1222-V1260 HydrophobicContact CB-CG2 3.98Å; I1249-V1260 HydrophobicContact CD1-CB 4.5Å; I1249-V1260 HydrophobicContact CD1-CG1 3.5Å; I1249-V1260 HydrophobicContact CD1-CG2 4.12Å; V1260-I1278 PolarHBondContact N-O 3.25Å; V1260-I1278 PolarHBondContact O-N 2.89Å; V1260-L1280 HydrophobicContact CB-CD1 3.99Å; V1260-L1280 HydrophobicContact CG2-CB 4.31Å; V1260-L1280 HydrophobicContact CG2-CD1 3.88Å; V1260-L1280 HydrophobicContact CG2-CG 4.43Å
1261	S	92.8	Very high	88.2	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	160.4	171.6	37.6	0	0	0	0	109.9	R1221 T1275	R1221-S1261 WeakPolarHBondContact CG-OG 3.06Å; R1221-S1261 PolarHBondContact N-O 3.03Å; R1221-S1261 PolarHBondContact NE-OG 3.18Å; R1221-S1261 PolarHBondContact NH2-OG 3.14Å; R1221-S1261 PolarHBondContact O-N 3.41Å; S1261-T1275 VanDerWaalsContact CB-O 3.31Å; S1261-T1275 WeakPolarHBondContact CB-O 3.23Å
1262	V	94.7	Very high	88.7	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	140.7	-174.2	136.8	0	0	0	0	108.5	P1189 F1192 W1206 Q1219 V1220 Y1274 T1275	P1189-V1262 HydrophobicContact CB-CG1 3.71Å; P1189-V1262 HydrophobicContact CG-CG1 3.56Å; F1192-V1262 HydrophobicContact CD2-CB 4.36Å; F1192-V1262 HydrophobicContact CE2-CB 4.18Å; F1192-V1262 HydrophobicContact CE2-CG2 3.95Å; F1192-V1262 HydrophobicContact CZ-CB 4.41Å; F1192-V1262 HydrophobicContact CZ-CG2 4.27Å; W1206-V1262 HydrophobicContact CD2-CG1 4.1Å; W1206-V1262 HydrophobicContact CD2-CG2 4.4Å; W1206-V1262 HydrophobicContact CE3-CG2 4.07Å; W1206-V1262 HydrophobicContact CG-CG1 4.32Å; W1206-V1262 HydrophobicContact CH2-CG2 4Å; W1206-V1262 HydrophobicContact CZ2-CG2 4.31Å; W1206-V1262 HydrophobicContact CZ3-CG2 3.87Å; Q1219-V1262 WeakPolarHBondContact O-CA 3.35Å; V1220-V1262 HydrophobicContact CB-CG2 4.02Å; V1220-V1262 HydrophobicContact CG1-CG2 4.15Å; V1220-V1262 HydrophobicContact CG2-CG2 3.62Å; V1262-Y1274 CarbonylContact O-C 3.51Å; V1262-Y1274 WeakPolarHBondContact O-CA 3.34Å; V1262-T1275 HydrophobicContact CG1-CG2 4.5Å; V1262-T1275 PolarHBondContact N-OG1 3.05Å; V1262-T1275 WeakPolarHBondContact O-CG2 3.4Å; V1262-T1275 PolarHBondContact O-N 2.88Å; V1262-T1275 PolarHBondContact O-OG1 2.89Å
1263	N	93.5	Very high	88.8	Confident	4 Å²	4	37.6 Å²	37.6	2%	0.021	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	170.9	162.6	70.2	-11	0	0	0	110.3	F1218 Q1219 A1271 S1272 A1273 Y1274	F1218-N1263 CarbonylContact C-O 3.57Å; F1218-N1263 WeakPolarHBondContact CA-O 3.24Å; F1218-N1263 WeakPolarHBondContact CB-O 3.46Å; Q1219-N1263 WeakPolarHBondContact CB-OD1 3.35Å; Q1219-N1263 PolarHBondContact N-O 2.69Å; Q1219-N1263 PolarHBondContact O-N 3.22Å; Q1219-N1263 VanDerWaalsContact O-N 3.1Å; Q1219-N1263 PolarHBondContact O-OD1 3.21Å; N1263-A1271 WeakPolarHBondContact ND2-CB 3.45Å; N1263-S1272 WeakPolarHBondContact CB-O 3.27Å; N1263-S1272 WeakPolarHBondContact CB-OG 3.2Å; N1263-S1272 PolarHBondContact ND2-O 2.73Å; N1263-S1272 VanDerWaalsContact ND2-O 3.1Å; N1263-A1273 WeakPolarHBondContact CB-O 3.43Å; N1263-Y1274 HydrophobicContact CB-CD1 3.77Å; N1263-Y1274 HydrophobicContact CB-CD2 4.24Å; N1263-Y1274 HydrophobicContact CB-CE1 3.96Å; N1263-Y1274 HydrophobicContact CB-CE2 4.41Å; N1263-Y1274 HydrophobicContact CB-CG 3.92Å; N1263-Y1274 WeakPolarHBondContact ND2-CE2 3.29Å
1264	S	92.6	Very high	89.3	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	154.6	170.9	43.5	0	0	0	0	108.9	D1187 T1217 A1271 S1272	D1187-S1264 PolarHBondContact O-OG 3.35Å; T1217-S1264 CarbonylContact O-C 3.28Å; T1217-S1264 WeakPolarHBondContact O-CA 3.4Å; S1264-A1271 CarbonylContact O-C 3.58Å; S1264-A1271 VanDerWaalsContact O-CA 3.31Å; S1264-A1271 WeakPolarHBondContact O-CA 3.16Å; S1264-S1272 PolarHBondContact N-OG 3.29Å; S1264-S1272 VanDerWaalsContact N-OG 3.11Å; S1264-S1272 PolarHBondContact O-N 3.43Å; S1264-S1272 PolarHBondContact O-OG 2.71Å; S1264-S1272 WeakPolarHBondContact OG-CB 3.44Å; S1264-S1272 PolarHBondContact OG-OG 2.82Å; S1264-S1272 VanDerWaalsContact OG-OG 3.07Å
1265	M	90.5	Very high	89.7	Confident	43 Å²	43	33.9 Å²	33.9	21%	0.212	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	155.4	172.2	74.6	174.3	95.3	0	0	111	Q1216 T1217 Q1219 G1270 A1271	Q1216-M1265 CarbonylContact C-O 3.59Å; Q1216-M1265 WeakPolarHBondContact CA-O 3.48Å; T1217-M1265 PolarHBondContact N-O 2.69Å; T1217-M1265 PolarHBondContact O-N 3.48Å; T1217-M1265 WeakPolarHBondContact OG1-CG 3.22Å; Q1219-M1265 HydrophobicContact CB-CE 3.68Å; M1265-G1270 VanDerWaalsContact CA-O 3.24Å; M1265-G1270 WeakPolarHBondContact CA-O 3.37Å; M1265-G1270 WeakPolarHBondContact CB-O 3.47Å; M1265-A1271 HydrophobicContact CB-CB 3.66Å
1266	N	88.6	Confident	89.8	Confident	7 Å²	7	40.1 Å²	40.1	4%	0.037	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	163	165.3	69.2	36	0	0	0	111.3	S1184 P1186 D1211 L1214 A1215 K1268 H1269 G1270	S1184-N1266 PolarHBondContact O-ND2 2.95Å; P1186-N1266 HydrophobicContact CG-CB 4.02Å; D1211-N1266 PolarHBondContact O-ND2 3.47Å; D1211-N1266 VanDerWaalsContact O-ND2 3.08Å; L1214-N1266 HydrophobicContact CB-CB 4.02Å; A1215-N1266 WeakPolarHBondContact O-CB 3.28Å; N1266-K1268 PolarHBondContact O-N 3.19Å; N1266-K1268 PolarHBondContact OD1-N 2.76Å; N1266-H1269 PolarHBondContact OD1-N 2.8Å; N1266-G1270 PolarHBondContact N-O 2.75Å; N1266-G1270 PolarHBondContact O-N 3.26Å; N1266-G1270 VanDerWaalsContact O-N 3.16Å
1267	S	85	Confident	89.8	Confident	116 Å²	116	42.1 Å²	42.1	81%	0.811	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-12.6	-168.6	55.4	0	0	0	0	115.8
1268	K	84	Confident	89.7	Confident	111 Å²	111	41.8 Å²	41.8	48%	0.483	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.3	-39.5	-171.4	-166.8	175.7	-168	176.7	0	114.1	E1086 L1214 N1266	E1086-K1268 VanDerWaalsContact OE1-CD 3.32Å; E1086-K1268 WeakPolarHBondContact OE1-CD 3.05Å; E1086-K1268 IonicContact OE1-NZ 2.71Å; E1086-K1268 PolarHBondContact OE1-NZ 3.32Å; E1086-K1268 IonicContact OE2-NZ 2.61Å; E1086-K1268 PolarHBondContact OE2-NZ 2.9Å; L1214-K1268 HydrophobicContact CD1-CB 3.44Å; L1214-K1268 VanDerWaalsContact CD1-CB 3.44Å; L1214-K1268 HydrophobicContact CD1-CD 4.01Å; L1214-K1268 HydrophobicContact CD1-CG 4.36Å; N1266-K1268 PolarHBondContact O-N 3.19Å; N1266-K1268 PolarHBondContact OD1-N 2.76Å
1269	H	84.6	Confident	89.6	Confident	74 Å²	74	46 Å²	46	34%	0.343	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-5.7	-176.4	-59.2	-82.9	0	0	0	112.9	T1183 S1184 T1185 N1266	T1183-H1269 WeakPolarHBondContact CB-NE2 3.29Å; T1183-H1269 PolarHBondContact O-CE1 3.16Å; T1183-H1269 PolarHBondContact O-NE2 2.95Å; T1183-H1269 VanDerWaalsContact O-NE2 3.13Å; T1183-H1269 PolarHBondContact OG1-NE2 3.08Å; S1184-H1269 VanDerWaalsContact C-CD2 3.44Å; S1184-H1269 VanDerWaalsContact C-CG 3.44Å; S1184-H1269 PolarHBondContact O-CD2 3.25Å; T1185-H1269 HydrophobicContact CG2-CB 3.76Å; T1185-H1269 WeakPolarHBondContact CG2-O 3.47Å; N1266-H1269 PolarHBondContact OD1-N 2.8Å
1270	G	82.6	Confident	89.5	Confident	33 Å²	33	45.8 Å²	45.8	34%	0.34	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	79.6	-149.2	179.7	0	0	0	0	0	112.3	M1265 N1266	M1265-G1270 VanDerWaalsContact CA-O 3.24Å; M1265-G1270 WeakPolarHBondContact CA-O 3.37Å; M1265-G1270 WeakPolarHBondContact CB-O 3.47Å; N1266-G1270 PolarHBondContact N-O 2.75Å; N1266-G1270 PolarHBondContact O-N 3.26Å; N1266-G1270 VanDerWaalsContact O-N 3.16Å
1271	A	87.2	Confident	89.1	Confident	51 Å²	51	52.3 Å²	52.3	42%	0.421	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	143.9	-165.8	0	0	0	0	0	114	N1263 S1264 M1265	N1263-A1271 WeakPolarHBondContact ND2-CB 3.45Å; S1264-A1271 CarbonylContact O-C 3.58Å; S1264-A1271 VanDerWaalsContact O-CA 3.31Å; S1264-A1271 WeakPolarHBondContact O-CA 3.16Å; M1265-A1271 HydrophobicContact CB-CB 3.66Å
1272	S	92.5	Very high	88.8	Confident	13 Å²	13	52.3 Å²	52.3	9%	0.091	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-67.8	169.3	172.9	80.5	0	0	0	0	111.6	N1263 S1264	N1263-S1272 WeakPolarHBondContact CB-O 3.27Å; N1263-S1272 WeakPolarHBondContact CB-OG 3.2Å; N1263-S1272 PolarHBondContact ND2-O 2.73Å; N1263-S1272 VanDerWaalsContact ND2-O 3.1Å; S1264-S1272 PolarHBondContact N-OG 3.29Å; S1264-S1272 VanDerWaalsContact N-OG 3.11Å; S1264-S1272 PolarHBondContact O-N 3.43Å; S1264-S1272 PolarHBondContact O-OG 2.71Å; S1264-S1272 WeakPolarHBondContact OG-CB 3.44Å; S1264-S1272 PolarHBondContact OG-OG 2.82Å; S1264-S1272 VanDerWaalsContact OG-OG 3.07Å
1273	A	90.8	Very high	88.1	Confident	69 Å²	69	52.9 Å²	52.9	57%	0.57	30%	0.295	S	S	*	.	P	Polyproline II helix	trans	-56.5	151.5	159.5	0	0	0	0	0	110.6	V1188 N1263	V1188-A1273 HydrophobicContact CG2-CB 4.03Å; N1263-A1273 WeakPolarHBondContact CB-O 3.43Å
1274	Y	92.3	Very high	87.1	Confident	55 Å²	55	53.5 Å²	53.5	22%	0.216	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-76.2	148.6	173	-75.3	-91.2	0	0	0	111.1	Q1219 R1221 Y1233 V1262 N1263	Q1219-Y1274 PolarHBondContact OE1-OH 3.5Å; R1221-Y1274 HydrophobicContact CB-CE1 3.99Å; R1221-Y1274 HydrophobicContact CG-CD1 3.79Å; R1221-Y1274 HydrophobicContact CG-CE1 3.48Å; R1221-Y1274 VanDerWaalsContact CG-CE1 3.48Å; R1221-Y1274 VanDerWaalsContact CZ-CD2 3.47Å; Y1233-Y1274 WeakPolarHBondContact CE1-OH 3.28Å; V1262-Y1274 CarbonylContact O-C 3.51Å; V1262-Y1274 WeakPolarHBondContact O-CA 3.34Å; N1263-Y1274 HydrophobicContact CB-CD1 3.77Å; N1263-Y1274 HydrophobicContact CB-CD2 4.24Å; N1263-Y1274 HydrophobicContact CB-CE1 3.96Å; N1263-Y1274 HydrophobicContact CB-CE2 4.41Å; N1263-Y1274 HydrophobicContact CB-CG 3.92Å; N1263-Y1274 WeakPolarHBondContact ND2-CE2 3.29Å
1275	T	92.4	Very high	85.2	Confident	13 Å²	13	55.1 Å²	55.1	8%	0.08	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-55.1	154.5	166.5	52.1	0	0	0	0	111.6	V1188 P1189 F1192 S1261 V1262	V1188-T1275 HydrophobicContact CG1-CG2 3.86Å; P1189-T1275 HydrophobicContact CB-CG2 4.34Å; P1189-T1275 WeakPolarHBondContact O-CG2 3.49Å; F1192-T1275 HydrophobicContact CB-CG2 4.19Å; F1192-T1275 WeakPolarHBondContact CD1-OG1 3.34Å; S1261-T1275 VanDerWaalsContact CB-O 3.31Å; S1261-T1275 WeakPolarHBondContact CB-O 3.23Å; V1262-T1275 HydrophobicContact CG1-CG2 4.5Å; V1262-T1275 PolarHBondContact N-OG1 3.05Å; V1262-T1275 WeakPolarHBondContact O-CG2 3.4Å; V1262-T1275 PolarHBondContact O-N 2.88Å; V1262-T1275 PolarHBondContact O-OG1 2.89Å
1276	D	86.5	Confident	83	Confident	145 Å²	145	55.6 Å²	55.6	78%	0.775	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-51.6	126.6	171.6	-72.3	-50.7	0	0	0	110.1	I1278	D1276-I1278 PolarHBondContact O-N 2.72Å; D1276-I1278 VanDerWaalsContact O-N 3.13Å
1277	P	87.1	Confident	80.6	Confident	66 Å²	66	59.5 Å²	59.5	43%	0.429	33%	0.332	S	S	.	.			trans	-67.6	113.7	-170.8	23.8	-32.4	0	0	0	111.4	I1259	I1259-P1277 HydrophobicContact CG2-CB 3.64Å
1278	I	88.7	Confident	78.1	Confident	49 Å²	49	62.6 Å²	62.6	25%	0.251	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	126.9	175.1	-43.8	-179.7	0	0	0	108.6	F1192 V1260 D1276 L1280	F1192-I1278 HydrophobicContact CB-CD1 4.31Å; F1192-I1278 HydrophobicContact CD1-CD1 3.28Å; F1192-I1278 HydrophobicContact CD1-CG1 3.68Å; F1192-I1278 HydrophobicContact CE1-CD1 3.69Å; F1192-I1278 HydrophobicContact CE1-CG1 3.89Å; F1192-I1278 HydrophobicContact CG-CD1 3.92Å; F1192-I1278 VanDerWaalsContact O-CD1 3.25Å; F1192-I1278 WeakPolarHBondContact O-CD1 3.34Å; V1260-I1278 PolarHBondContact N-O 3.25Å; V1260-I1278 PolarHBondContact O-N 2.89Å; D1276-I1278 PolarHBondContact O-N 2.72Å; D1276-I1278 VanDerWaalsContact O-N 3.13Å; I1278-L1280 HydrophobicContact CB-CD1 4.48Å; I1278-L1280 HydrophobicContact CB-CD2 4.27Å; I1278-L1280 HydrophobicContact CB-CG 4.08Å; I1278-L1280 HydrophobicContact CG2-CD2 3.51Å; I1278-L1280 HydrophobicContact CG2-CG 3.83Å; I1278-L1280 PolarHBondContact O-N 3.03Å
1279	H	90.7	Very high	75.5	Confident	100 Å²	100	59.2 Å²	59.2	46%	0.463	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	107.4	167.8	-79.6	-122.5	0	0	0	109.1	E1257 I1259	E1257-H1279 IonicContact OE1-CE1 3.49Å; E1257-H1279 IonicContact OE1-CG 3.36Å; E1257-H1279 IonicContact OE1-ND1 3.56Å; E1257-H1279 PolarHBondContact OE1-ND1 2.98Å; I1259-H1279 WeakPolarHBondContact CG1-NE2 3.2Å
1280	L	87.9	Confident	72.9	Confident	12 Å²	12	55.7 Å²	55.7	6%	0.063	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	116.5	-176.7	-64	178.7	0	0	0	109.3	L1194 L1202 V1204 Y1258 V1260 I1278	L1194-L1280 HydrophobicContact CB-CD2 3.91Å; L1194-L1280 HydrophobicContact CD1-CD1 4.17Å; L1194-L1280 HydrophobicContact CD1-CD2 4.2Å; L1194-L1280 HydrophobicContact CD2-CD2 4.26Å; L1194-L1280 HydrophobicContact CG-CD2 4.35Å; L1202-L1280 HydrophobicContact CD1-CB 3.66Å; L1202-L1280 HydrophobicContact CD1-CD1 4.29Å; L1202-L1280 HydrophobicContact CD2-CB 4.19Å; V1204-L1280 HydrophobicContact CG1-CD1 3.57Å; Y1258-L1280 PolarHBondContact N-O 3.13Å; Y1258-L1280 PolarHBondContact O-N 2.87Å; V1260-L1280 HydrophobicContact CB-CD1 3.99Å; V1260-L1280 HydrophobicContact CG2-CB 4.31Å; V1260-L1280 HydrophobicContact CG2-CD1 3.88Å; V1260-L1280 HydrophobicContact CG2-CG 4.43Å; I1278-L1280 HydrophobicContact CB-CD1 4.48Å; I1278-L1280 HydrophobicContact CB-CD2 4.27Å; I1278-L1280 HydrophobicContact CB-CG 4.08Å; I1278-L1280 HydrophobicContact CG2-CD2 3.51Å; I1278-L1280 HydrophobicContact CG2-CG 3.83Å; I1278-L1280 PolarHBondContact O-N 3.03Å
1281	R	85.1	Confident	70.3	Confident	138 Å²	138	59.2 Å²	59.2	52%	0.521	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	128.6	175.1	-147.6	-178.8	-156.3	98.3	9.6	109.7	G1255 S1256 E1257	G1255-R1281 PolarHBondContact O-NE 3.3Å; S1256-R1281 WeakPolarHBondContact O-CA 3.39Å; E1257-R1281 HydrophobicContact CB-CG 4.34Å; E1257-R1281 IonicContact OE2-CZ 3.89Å; E1257-R1281 IonicContact OE2-NH1 3.13Å; E1257-R1281 PolarHBondContact OE2-NH1 2.95Å
1282	T	86.6	Confident	67.4	Low	0 Å²	0	65 Å²	65	0%	0	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-64.3	158.5	163.5	46.9	0	0	0	0	110	L1202 L1252 K1253 P1254 G1255 S1256 Y1258	L1202-T1282 HydrophobicContact CD2-CG2 4.34Å; L1202-T1282 HydrophobicContact CG-CG2 4.16Å; L1252-T1282 HydrophobicContact CB-CG2 3.67Å; L1252-T1282 HydrophobicContact CD1-CG2 3.7Å; L1252-T1282 HydrophobicContact CG-CG2 4.35Å; K1253-T1282 WeakPolarHBondContact O-CB 3.2Å; K1253-T1282 WeakPolarHBondContact O-CG2 3.14Å; K1253-T1282 PolarHBondContact O-OG1 3.07Å; P1254-T1282 WeakPolarHBondContact CA-OG1 3.13Å; G1255-T1282 WeakPolarHBondContact CA-O 3.25Å; G1255-T1282 PolarHBondContact N-OG1 2.92Å; G1255-T1282 VanDerWaalsContact N-OG1 3.14Å; S1256-T1282 PolarHBondContact N-OG1 3.07Å; S1256-T1282 VanDerWaalsContact N-OG1 3.09Å; S1256-T1282 PolarHBondContact O-N 2.9Å; S1256-T1282 PolarHBondContact O-OG1 2.69Å; S1256-T1282 VanDerWaalsContact O-OG1 3.13Å; Y1258-T1282 HydrophobicContact CD2-CG2 4.16Å; Y1258-T1282 HydrophobicContact CE2-CG2 4.16Å
1283	L	80.2	Confident	64.5	Low	11 Å²	11	67.7 Å²	67.7	6%	0.058	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-66.9	151.1	167.4	-45.3	-173	0	0	0	108.3	T234 K235 T236 P237 A1197 T1198 S1199 P1254 G1255	T234-L1283 WeakPolarHBondContact O-CD1 2.99Å; K235-L1283 VanDerWaalsContact C-CD2 3.42Å; K235-L1283 WeakPolarHBondContact O-CD2 3.25Å; T236-L1283 WeakPolarHBondContact O-CD1 3.43Å; P237-L1283 HydrophobicContact CG-CD2 4.01Å; A1197-L1283 HydrophobicContact CB-CD2 3.96Å; A1197-L1283 HydrophobicContact CB-CG 4.24Å; A1197-L1283 WeakPolarHBondContact O-CD1 3.17Å; T1198-L1283 VanDerWaalsContact C-CG 3.48Å; T1198-L1283 WeakPolarHBondContact O-CG 3.39Å; T1198-L1283 PolarHBondContact O-N 2.75Å; S1199-L1283 WeakPolarHBondContact CA-O 3.25Å; P1254-L1283 CarbonylContact C-O 3.5Å; P1254-L1283 VanDerWaalsContact CA-O 3.24Å; P1254-L1283 WeakPolarHBondContact CA-O 3.22Å; P1254-L1283 WeakPolarHBondContact CB-O 3.32Å; G1255-L1283 VanDerWaalsContact N-C 3.33Å; G1255-L1283 PolarHBondContact N-O 2.99Å
1284	S	73.1	Confident	61.4	Low	17 Å²	17	72.8 Å²	72.8	12%	0.119	35%	0.35	C	S	.	.			trans	-68.2	178.6	171.1	-67.5	0	0	0	0	110.7	M238 S1199 G1255	M238-S1284 CarbonylContact O-C 3.55Å; M238-S1284 WeakPolarHBondContact O-CA 3.15Å; M238-S1284 WeakPolarHBondContact O-CB 3.31Å; M238-S1284 VanDerWaalsContact O-O 3.09Å; S1199-S1284 WeakPolarHBondContact CB-O 3.26Å; G1255-S1284 WeakPolarHBondContact CA-OG 3.41Å
1285	L	52.8	Low	58.1	Low	34 Å²	34	75.4 Å²	75.4	18%	0.178	37%	0.374	C	S	.	.			trans	-118.2	90.2	-171.3	-145	64.4	0	0	0	109.8	M238 S239 N241 D242 S1199 P1254	M238-L1285 PolarHBondContact O-N 3.48Å; S239-L1285 CarbonylContact O-C 3.53Å; N241-L1285 PolarHBondContact N-O 2.75Å; D242-L1285 HydrophobicContact CB-CB 3.7Å; D242-L1285 HydrophobicContact CB-CD1 4.48Å; D242-L1285 HydrophobicContact CB-CD2 3.21Å; D242-L1285 HydrophobicContact CB-CG 3.19Å; D242-L1285 PolarHBondContact N-O 3.35Å; S1199-L1285 VanDerWaalsContact CB-CD1 3.47Å; S1199-L1285 WeakPolarHBondContact OG-CD1 3.47Å; P1254-L1285 HydrophobicContact CB-CB 3.54Å; P1254-L1285 HydrophobicContact CB-CD1 3.95Å; P1254-L1285 HydrophobicContact CB-CD2 4.39Å; P1254-L1285 HydrophobicContact CB-CG 4.11Å; P1254-L1285 HydrophobicContact CG-CB 3.54Å; P1254-L1285 HydrophobicContact CG-CD1 3.67Å; P1254-L1285 HydrophobicContact CG-CD2 3.45Å; P1254-L1285 VanDerWaalsContact CG-CD2 3.45Å; P1254-L1285 HydrophobicContact CG-CG 3.7Å
1286	D	44.4	Very low	55.1	Low	53 Å²	53	78.3 Å²	78.3	28%	0.283	39%	0.393	S	S	.	.			trans	-40.1	146	-144.1	-135.7	-25.4	0	0	0	118.2	M238 S239 Y1288 N1289	M238-D1286 WeakPolarHBondContact CA-OD2 3.12Å; M238-D1286 HydrophobicContact CB-CB 3.76Å; M238-D1286 VanDerWaalsContact CB-CG 3.42Å; M238-D1286 WeakPolarHBondContact CB-OD2 3.46Å; M238-D1286 HydrophobicContact CE-CB 4.1Å; M238-D1286 VanDerWaalsContact CG-OD2 3.29Å; M238-D1286 WeakPolarHBondContact CG-OD2 3.3Å; M238-D1286 WeakPolarHBondContact O-CA 3.42Å; M238-D1286 PolarHBondContact O-N 3.07Å; S239-D1286 PolarHBondContact N-OD1 3.48Å; S239-D1286 CarbonylContact O-C 3.58Å; S239-D1286 WeakPolarHBondContact O-CA 3.41Å; S239-D1286 PolarHBondContact O-N 2.75Å; S239-D1286 PolarHBondContact OG-OD1 2.66Å; D1286-Y1288 PolarHBondContact O-N 3.15Å; D1286-N1289 VanDerWaalsContact O-CA 3.3Å; D1286-N1289 WeakPolarHBondContact O-CA 3.2Å; D1286-N1289 PolarHBondContact O-N 2.94Å
1287	L	37.5	Very low	52.2	Low	90 Å²	90	79.4 Å²	79.4	47%	0.471	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	26.6	172.9	-113.7	165.5	0	0	0	111.7	S239 N241	S239-L1287 PolarHBondContact O-N 2.69Å; S239-L1287 WeakPolarHBondContact OG-CB 3.15Å; N241-L1287 HydrophobicContact CB-CD1 4.38Å; N241-L1287 HydrophobicContact CB-CD2 3.38Å; N241-L1287 HydrophobicContact CB-CG 3.51Å
1288	Y	33.4	Very low	49.3	Very low	180 Å²	180	80.3 Å²	80.3	71%	0.706	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.4	26.3	146.9	-128.2	-134.5	0	0	0	112.9	K245 D1286	K245-Y1288 WeakPolarHBondContact CB-O 3.4Å; K245-Y1288 HydrophobicContact CD-CD1 4.49Å; K245-Y1288 PolarHBondContact NZ-O 2.85Å; D1286-Y1288 PolarHBondContact O-N 3.15Å
1289	N	29.8	Very low	46.5	Very low	40 Å²	40	84.8 Å²	84.8	21%	0.214	44%	0.436	C	S	.	.			trans	61.6	175.8	154.5	65.3	-50.2	0	0	0	119	N241 A244 K245 M246 D1286	N241-N1289 VanDerWaalsContact O-CA 3.26Å; N241-N1289 WeakPolarHBondContact O-CA 3.19Å; N241-N1289 WeakPolarHBondContact O-CB 3.45Å; A244-N1289 VanDerWaalsContact C-ND2 3.28Å; A244-N1289 VanDerWaalsContact CA-ND2 3.29Å; A244-N1289 WeakPolarHBondContact CA-ND2 3.25Å; A244-N1289 WeakPolarHBondContact CB-ND2 3.31Å; A244-N1289 PolarHBondContact N-ND2 2.74Å; K245-N1289 CarbonylContact C-O 2.92Å; K245-N1289 VanDerWaalsContact C-O 3.31Å; K245-N1289 WeakPolarHBondContact CA-O 3.39Å; K245-N1289 HydrophobicContact CB-CB 4.42Å; K245-N1289 WeakPolarHBondContact CB-O 3.45Å; K245-N1289 WeakPolarHBondContact CB-OD1 3.01Å; K245-N1289 PolarHBondContact NZ-OD1 2.6Å; M246-N1289 PolarHBondContact N-O 2.96Å; D1286-N1289 VanDerWaalsContact O-CA 3.3Å; D1286-N1289 WeakPolarHBondContact O-CA 3.2Å; D1286-N1289 PolarHBondContact O-N 2.94Å
1290	G	29.6	Very low	43.5	Very low	0 Å²	0	83.5 Å²	83.5	0%	0	44%	0.438	C	S	.	.			trans	-141.4	-117.2	-166.1	0	0	0	0	0	120.7	D242 V243 A244 K245 N248	D242-G1290 CarbonylContact O-C 3.37Å; D242-G1290 VanDerWaalsContact O-CA 3.25Å; D242-G1290 WeakPolarHBondContact O-CA 3.18Å; D242-G1290 WeakPolarHBondContact OD1-CA 3.05Å; D242-G1290 WeakPolarHBondContact OD2-CA 3.44Å; D242-G1290 PolarHBondContact OD2-N 3.03Å; V243-G1290 CarbonylContact C-O 3.58Å; V243-G1290 VanDerWaalsContact C-O 3.28Å; V243-G1290 CarbonylContact O-C 3.58Å; A244-G1290 CarbonylContact C-O 3.44Å; A244-G1290 WeakPolarHBondContact CA-O 3.48Å; A244-G1290 PolarHBondContact N-O 2.75Å; K245-G1290 CarbonylContact C-O 3.53Å; K245-G1290 VanDerWaalsContact C-O 3.3Å; K245-G1290 VanDerWaalsContact CA-O 3.25Å; K245-G1290 WeakPolarHBondContact CA-O 3.46Å; K245-G1290 PolarHBondContact N-O 2.6Å; N248-G1290 VanDerWaalsContact CB-O 3.3Å; N248-G1290 WeakPolarHBondContact CB-O 3.19Å; N248-G1290 PolarHBondContact N-O 2.97Å
1291	R	28.7	Very low	40.5	Very low	108 Å²	108	86.9 Å²	86.9	41%	0.408	48%	0.476	S	S	.	.	S	Bend	trans	127.1	52.7	-169.8	-165.5	-171.7	-163.1	-172	2.4	115.5	D242 V243 N247 N248	D242-R1291 PolarHBondContact O-N 2.75Å; V243-R1291 WeakPolarHBondContact O-CA 3.13Å; V243-R1291 WeakPolarHBondContact O-CB 3.46Å; V243-R1291 PolarHBondContact O-N 2.89Å; N247-R1291 HydrophobicContact CB-CB 4.13Å; N247-R1291 WeakPolarHBondContact CB-O 3.42Å; N248-R1291 HydrophobicContact CB-CB 4.05Å; N248-R1291 WeakPolarHBondContact OD1-CD 3.34Å; N248-R1291 VanDerWaalsContact OD1-CZ 3.3Å; N248-R1291 PolarHBondContact OD1-NE 2.95Å; N248-R1291 PolarHBondContact OD1-NH1 2.94Å
1292	E	24.9	Very low	37.8	Very low	171 Å²	171	87.1 Å²	87.1	80%	0.799	48%	0.478	S	S	*	.			trans	62.9	110.3	176.2	-60.5	-176.5	133.7	0	0	117.9	N247	N247-E1292 VanDerWaalsContact CG-C 3.49Å
1293	P	31.6	Very low	35.1	Very low	71 Å²	71	89.8 Å²	89.8	46%	0.461	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-82.4	127.8	168.2	29.5	-25.2	0	0	0	110.6	N247	N247-P1293 VanDerWaalsContact ND2-CD 3.35Å; N247-P1293 WeakPolarHBondContact ND2-CD 3.13Å; N247-P1293 WeakPolarHBondContact OD1-CA 3.14Å
1294	M	26.1	Very low	32.9	Very low	175 Å²	175	96.4 Å²	96.4	86%	0.862	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-58.2	147.6	163.7	-76.9	-177.3	165.9	0	0	109.9
1295	P	24	Very low	31.3	Very low	110 Å²	110	101.5 Å²	101.5	71%	0.714	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-58	140.7	176.9	-20.7	31.8	0	0	0	110.2	L1297	P1295-L1297 PolarHBondContact O-N 3.32Å; P1295-L1297 VanDerWaalsContact O-N 3.16Å
1296	P	27.5	Very low	30.5	Very low	74 Å²	74	101.8 Å²	101.8	48%	0.481	56%	0.559	S	S	.	*	P	Polyproline II helix	trans	-57.5	124.9	162.2	26.6	-32.3	0	0	0	107.1	T1250 S1298	T1250-P1296 HydrophobicContact CG2-CG 4.25Å; P1296-S1298 PolarHBondContact O-N 2.86Å
1297	L	26.8	Very low	30.5	Very low	169 Å²	169	101.7 Å²	101.7	89%	0.885	57%	0.566	S	S	*	*			trans	-59.3	112.3	164.4	-103.1	91.6	0	0	0	106.1	P1295 T1299	P1295-L1297 PolarHBondContact O-N 3.32Å; P1295-L1297 VanDerWaalsContact O-N 3.16Å; L1297-T1299 PolarHBondContact O-N 3.45Å
1298	S	26.9	Very low	31.1	Very low	84 Å²	84	103.4 Å²	103.4	59%	0.587	58%	0.575	S	S	*	*			trans	-64.8	106.2	177.2	50.1	0	0	0	0	108.3	P1296 S1300	P1296-S1298 PolarHBondContact O-N 2.86Å; S1298-S1300 PolarHBondContact O-N 2.84Å; S1298-S1300 PolarHBondContact O-OG 3.49Å
1299	T	28.8	Very low	31.8	Very low	144 Å²	144	99.8 Å²	99.8	88%	0.883	57%	0.567	S	S	*	*			trans	-69.1	56.8	149	55	0	0	0	0	108.9	L1297	L1297-T1299 PolarHBondContact O-N 3.45Å
1300	S	27	Very low	33.4	Very low	73 Å²	73	102 Å²	102	51%	0.51	58%	0.578	S	S	.	*			trans	-52.1	133.8	149	47	0	0	0	0	106.7	S1298 Y1302	S1298-S1300 PolarHBondContact O-N 2.84Å; S1298-S1300 PolarHBondContact O-OG 3.49Å; S1300-Y1302 VanDerWaalsContact C-N 3.35Å; S1300-Y1302 PolarHBondContact O-N 2.89Å
1301	G	26.8	Very low	35.1	Very low	83 Å²	83	107 Å²	107	86%	0.856	60%	0.604	S	S	*	*			trans	-57.3	100	173.4	0	0	0	0	0	109.4	S1303	G1301-S1303 PolarHBondContact O-N 2.85Å
1302	Y	28	Very low	37.2	Very low	143 Å²	143	105.3 Å²	105.3	56%	0.561	61%	0.606	S	S	*	*			trans	-81.1	106.6	173.9	-150	-122.8	0	0	0	105	S1300 N1306 I1310	S1300-Y1302 VanDerWaalsContact C-N 3.35Å; S1300-Y1302 PolarHBondContact O-N 2.89Å; Y1302-N1306 HydrophobicContact CD1-CB 3.62Å; Y1302-N1306 HydrophobicContact CE1-CB 3.2Å; Y1302-N1306 HydrophobicContact CG-CB 4.48Å; Y1302-I1310 HydrophobicContact CD1-CD1 3.92Å; Y1302-I1310 HydrophobicContact CE1-CD1 3.53Å; Y1302-I1310 HydrophobicContact CE1-CG1 4.06Å
1303	S	29.9	Very low	39.3	Very low	55 Å²	55	99.8 Å²	99.8	39%	0.385	59%	0.586	S	S	.	*			trans	-60.8	149.6	-173.5	62.9	0	0	0	0	111	G1301 D1305 N1306	G1301-S1303 PolarHBondContact O-N 2.85Å; S1303-D1305 WeakPolarHBondContact CB-OD2 3.47Å; S1303-D1305 PolarHBondContact O-N 2.87Å; S1303-D1305 PolarHBondContact OG-OD2 2.88Å; S1303-N1306 PolarHBondContact O-N 2.85Å
1304	D	33.6	Very low	41.3	Very low	151 Å²	151	99.3 Å²	99.3	81%	0.807	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.5	-17.1	-174.1	-66	-69.5	0	0	0	113.6	N1306 A1307	D1304-N1306 PolarHBondContact O-N 3.07Å; D1304-N1306 VanDerWaalsContact O-N 3.15Å; D1304-A1307 WeakPolarHBondContact O-CB 3.02Å; D1304-A1307 PolarHBondContact O-N 3.01Å
1305	D	39	Very low	43.8	Very low	124 Å²	124	95 Å²	95	66%	0.663	57%	0.574	S	S	*	*	H	α-helix	trans	-52.3	-32.3	170.2	-45.8	-70	0	0	0	113.1	S1303	S1303-D1305 WeakPolarHBondContact CB-OD2 3.47Å; S1303-D1305 PolarHBondContact O-N 2.87Å; S1303-D1305 PolarHBondContact OG-OD2 2.88Å
1306	N	35.7	Very low	46.5	Very low	39 Å²	39	93.6 Å²	93.6	21%	0.209	56%	0.563	C	S	.	*	H	α-helix	trans	-93.7	-4.6	-175.2	-66.1	-70.6	0	0	0	114.3	Y1302 S1303 D1304 L1308 L1309 I1310	Y1302-N1306 HydrophobicContact CD1-CB 3.62Å; Y1302-N1306 HydrophobicContact CE1-CB 3.2Å; Y1302-N1306 HydrophobicContact CG-CB 4.48Å; S1303-N1306 PolarHBondContact O-N 2.85Å; D1304-N1306 PolarHBondContact O-N 3.07Å; D1304-N1306 VanDerWaalsContact O-N 3.15Å; N1306-L1308 PolarHBondContact O-N 3.21Å; N1306-L1309 CarbonylContact O-C 3.59Å; N1306-L1309 PolarHBondContact O-N 2.65Å; N1306-L1309 VanDerWaalsContact O-N 3.12Å; N1306-I1310 PolarHBondContact O-N 3.29Å
1307	A	45.2	Very low	49.1	Very low	52 Å²	52	96.5 Å²	96.5	43%	0.43	57%	0.568	S	S	.	*	H	α-helix	trans	-59.4	-39.8	170.9	0	0	0	0	0	110.5	D1304 I1310 I1311	D1304-A1307 WeakPolarHBondContact O-CB 3.02Å; D1304-A1307 PolarHBondContact O-N 3.01Å; A1307-I1310 PolarHBondContact O-N 3.21Å; A1307-I1311 WeakPolarHBondContact O-CB 3.18Å; A1307-I1311 VanDerWaalsContact O-CG1 3.29Å; A1307-I1311 WeakPolarHBondContact O-CG1 3.31Å; A1307-I1311 PolarHBondContact O-N 3.38Å
1308	L	48.9	Very low	51.6	Low	125 Å²	125	90.1 Å²	90.1	65%	0.654	54%	0.544	S	S	*	.	H	α-helix	trans	-64.6	-40.4	173.5	-163.6	77.3	0	0	0	111.9	N1306 I1311 V1312	N1306-L1308 PolarHBondContact O-N 3.21Å; L1308-I1311 PolarHBondContact O-N 3.43Å; L1308-V1312 HydrophobicContact CG-CG2 4.46Å; L1308-V1312 VanDerWaalsContact O-CB 3.25Å; L1308-V1312 WeakPolarHBondContact O-CB 3.24Å; L1308-V1312 WeakPolarHBondContact O-CG2 2.84Å; L1308-V1312 PolarHBondContact O-N 3.04Å
1309	L	50	Low	54.5	Low	104 Å²	104	92.5 Å²	92.5	55%	0.545	54%	0.544	S	S	.	.	H	α-helix	trans	-74.2	-29.6	178.8	-82.6	170.5	0	0	0	113.4	N1306 S1313	N1306-L1309 CarbonylContact O-C 3.59Å; N1306-L1309 PolarHBondContact O-N 2.65Å; N1306-L1309 VanDerWaalsContact O-N 3.12Å; L1309-S1313 WeakPolarHBondContact O-CB 3.05Å; L1309-S1313 PolarHBondContact O-N 2.98Å; L1309-S1313 PolarHBondContact O-OG 3.49Å
1310	I	61.8	Low	57.2	Low	87 Å²	87	88.5 Å²	88.5	45%	0.446	52%	0.519	S	S	.	.	H	α-helix	trans	-70.5	-44.2	168.8	-72.1	178	0	0	0	110	Y1302 N1306 A1307 S1313 A1314	Y1302-I1310 HydrophobicContact CD1-CD1 3.92Å; Y1302-I1310 HydrophobicContact CE1-CD1 3.53Å; Y1302-I1310 HydrophobicContact CE1-CG1 4.06Å; N1306-I1310 PolarHBondContact O-N 3.29Å; A1307-I1310 PolarHBondContact O-N 3.21Å; I1310-S1313 WeakPolarHBondContact CA-OG 3.25Å; I1310-S1313 PolarHBondContact O-N 2.91Å; I1310-S1313 PolarHBondContact O-OG 2.7Å; I1310-A1314 WeakPolarHBondContact O-CB 3.36Å; I1310-A1314 PolarHBondContact O-N 3.42Å
1311	I	66.4	Low	59.8	Low	106 Å²	106	89.3 Å²	89.3	54%	0.544	52%	0.517	S	S	.	.	H	α-helix	trans	-64.3	-44.3	176.2	-68.9	166.3	0	0	0	110.7	A1307 L1308 A1314 C1315	A1307-I1311 WeakPolarHBondContact O-CB 3.18Å; A1307-I1311 VanDerWaalsContact O-CG1 3.29Å; A1307-I1311 WeakPolarHBondContact O-CG1 3.31Å; A1307-I1311 PolarHBondContact O-N 3.38Å; L1308-I1311 PolarHBondContact O-N 3.43Å; I1311-A1314 PolarHBondContact O-N 3.37Å; I1311-C1315 WeakPolarHBondContact O-CB 3.29Å; I1311-C1315 PolarHBondContact O-N 3.26Å; I1311-C1315 PolarHBondContact O-SG 3.26Å
1312	V	71.5	Confident	62.5	Low	72 Å²	72	89.9 Å²	89.9	44%	0.436	50%	0.499	S	S	.	.	H	α-helix	trans	-65.9	-42.6	176.4	169	0	0	0	0	111.1	L1308 C1315 V1316	L1308-V1312 HydrophobicContact CG-CG2 4.46Å; L1308-V1312 VanDerWaalsContact O-CB 3.25Å; L1308-V1312 WeakPolarHBondContact O-CB 3.24Å; L1308-V1312 WeakPolarHBondContact O-CG2 2.84Å; L1308-V1312 PolarHBondContact O-N 3.04Å; V1312-C1315 PolarHBondContact O-N 3.47Å; V1312-V1316 HydrophobicContact CG1-CG2 4.31Å; V1312-V1316 VanDerWaalsContact O-CB 3.27Å; V1312-V1316 WeakPolarHBondContact O-CB 3.33Å; V1312-V1316 WeakPolarHBondContact O-CG2 3.44Å; V1312-V1316 PolarHBondContact O-N 3.26Å
1313	S	69.3	Low	65.3	Low	55 Å²	55	86.5 Å²	86.5	39%	0.385	49%	0.491	S	S	.	.	H	α-helix	trans	-73.6	-27.7	177	63.9	0	0	0	0	113.3	L1309 I1310 F1317	L1309-S1313 WeakPolarHBondContact O-CB 3.05Å; L1309-S1313 PolarHBondContact O-N 2.98Å; L1309-S1313 PolarHBondContact O-OG 3.49Å; I1310-S1313 WeakPolarHBondContact CA-OG 3.25Å; I1310-S1313 PolarHBondContact O-N 2.91Å; I1310-S1313 PolarHBondContact O-OG 2.7Å; S1313-F1317 VanDerWaalsContact O-CB 3.24Å; S1313-F1317 WeakPolarHBondContact O-CB 3.4Å; S1313-F1317 WeakPolarHBondContact O-CD2 3.24Å; S1313-F1317 PolarHBondContact O-N 3.36Å
1314	A	74.9	Confident	67.9	Low	60 Å²	60	88.2 Å²	88.2	50%	0.496	50%	0.495	S	S	.	.	H	α-helix	trans	-77.4	-31.9	171.7	0	0	0	0	0	111.8	I1310 I1311 G1318	I1310-A1314 WeakPolarHBondContact O-CB 3.36Å; I1310-A1314 PolarHBondContact O-N 3.42Å; I1311-A1314 PolarHBondContact O-N 3.37Å; A1314-G1318 VanDerWaalsContact O-CA 3.28Å; A1314-G1318 WeakPolarHBondContact O-CA 3.05Å; A1314-G1318 PolarHBondContact O-N 2.88Å
1315	C	77.8	Confident	70	Confident	85 Å²	85	84.9 Å²	84.9	57%	0.574	48%	0.477	S	S	*	.	H	α-helix	trans	-70.7	-37.2	167.3	-76.8	0	0	0	0	111.5	I1311 V1312 F1319	I1311-C1315 WeakPolarHBondContact O-CB 3.29Å; I1311-C1315 PolarHBondContact O-N 3.26Å; I1311-C1315 PolarHBondContact O-SG 3.26Å; V1312-C1315 PolarHBondContact O-N 3.47Å; C1315-F1319 WeakPolarHBondContact O-CB 3.14Å; C1315-F1319 PolarHBondContact O-N 2.82Å
1316	V	81.8	Confident	72.2	Confident	80 Å²	80	82.6 Å²	82.6	49%	0.485	46%	0.464	S	S	.	.	H	α-helix	trans	-74.5	-43.4	176	167.4	0	0	0	0	111.1	V1312 G1318 F1319 V1320	V1312-V1316 HydrophobicContact CG1-CG2 4.31Å; V1312-V1316 VanDerWaalsContact O-CB 3.27Å; V1312-V1316 WeakPolarHBondContact O-CB 3.33Å; V1312-V1316 WeakPolarHBondContact O-CG2 3.44Å; V1312-V1316 PolarHBondContact O-N 3.26Å; V1316-G1318 VanDerWaalsContact C-N 3.33Å; V1316-F1319 CarbonylContact O-C 3.43Å; V1316-F1319 PolarHBondContact O-N 2.72Å; V1316-V1320 HydrophobicContact CG1-CG2 4.28Å; V1316-V1320 WeakPolarHBondContact O-CB 3.43Å; V1316-V1320 WeakPolarHBondContact O-CG2 3.47Å; V1316-V1320 PolarHBondContact O-N 2.66Å
1317	F	80.3	Confident	74.6	Confident	135 Å²	135	85.7 Å²	85.7	59%	0.592	48%	0.479	S	S	*	.	H	α-helix	trans	-65.6	-37.1	169.6	-96.8	-86.3	0	0	0	111.2	S1313 V1320 I1321	S1313-F1317 VanDerWaalsContact O-CB 3.24Å; S1313-F1317 WeakPolarHBondContact O-CB 3.4Å; S1313-F1317 WeakPolarHBondContact O-CD2 3.24Å; S1313-F1317 PolarHBondContact O-N 3.36Å; F1317-V1320 PolarHBondContact O-N 2.83Å; F1317-I1321 HydrophobicContact CD1-CD1 4.37Å; F1317-I1321 WeakPolarHBondContact O-CA 3.06Å; F1317-I1321 WeakPolarHBondContact O-CB 2.75Å; F1317-I1321 WeakPolarHBondContact O-CD1 3.42Å; F1317-I1321 WeakPolarHBondContact O-CG1 3.12Å; F1317-I1321 PolarHBondContact O-N 2.87Å
1318	G	80.7	Confident	76.4	Confident	36 Å²	36	86.2 Å²	86.2	37%	0.371	48%	0.477	S	S	.	.	H	α-helix	trans	-61.3	-44.7	172.1	0	0	0	0	0	111.5	A1314 V1316 L1322	A1314-G1318 VanDerWaalsContact O-CA 3.28Å; A1314-G1318 WeakPolarHBondContact O-CA 3.05Å; A1314-G1318 PolarHBondContact O-N 2.88Å; V1316-G1318 VanDerWaalsContact C-N 3.33Å; G1318-L1322 WeakPolarHBondContact O-CB 3.47Å; G1318-L1322 PolarHBondContact O-N 3.13Å
1319	F	86.5	Confident	77.9	Confident	133 Å²	133	84.6 Å²	84.6	58%	0.583	47%	0.468	S	S	*	.	H	α-helix	trans	-73	-30.6	176.9	-162.7	-97.5	0	0	0	112.5	C1315 V1316 L1323	C1315-F1319 WeakPolarHBondContact O-CB 3.14Å; C1315-F1319 PolarHBondContact O-N 2.82Å; V1316-F1319 CarbonylContact O-C 3.43Å; V1316-F1319 PolarHBondContact O-N 2.72Å; F1319-L1323 HydrophobicContact CD1-CD1 3.65Å; F1319-L1323 HydrophobicContact CD1-CG 4.1Å; F1319-L1323 HydrophobicContact CE1-CD1 3.69Å; F1319-L1323 HydrophobicContact CE1-CG 4.08Å; F1319-L1323 WeakPolarHBondContact O-CA 3.23Å; F1319-L1323 WeakPolarHBondContact O-CB 3.23Å; F1319-L1323 WeakPolarHBondContact O-CG 3.32Å; F1319-L1323 PolarHBondContact O-N 2.52Å
1320	V	86.7	Confident	79.4	Confident	60 Å²	60	84.2 Å²	84.2	36%	0.364	47%	0.466	S	S	.	.	H	α-helix	trans	-76.9	-37.3	174	165.5	0	0	0	0	111	V1316 F1317 L1323 I1324	V1316-V1320 HydrophobicContact CG1-CG2 4.28Å; V1316-V1320 WeakPolarHBondContact O-CB 3.43Å; V1316-V1320 WeakPolarHBondContact O-CG2 3.47Å; V1316-V1320 PolarHBondContact O-N 2.66Å; F1317-V1320 PolarHBondContact O-N 2.83Å; V1320-L1323 CarbonylContact O-C 3.55Å; V1320-L1323 PolarHBondContact O-N 3.26Å; V1320-I1324 HydrophobicContact CG1-CD1 3.77Å; V1320-I1324 HydrophobicContact CG1-CG1 4.43Å; V1320-I1324 VanDerWaalsContact O-CB 3.23Å; V1320-I1324 WeakPolarHBondContact O-CB 3.15Å; V1320-I1324 WeakPolarHBondContact O-CD1 3.31Å; V1320-I1324 WeakPolarHBondContact O-CG1 3.35Å; V1320-I1324 PolarHBondContact O-N 3.31Å
1321	I	81.1	Confident	80.3	Confident	91 Å²	91	85.6 Å²	85.6	47%	0.467	47%	0.469	S	S	.	.	H	α-helix	trans	-72.2	-34.2	171.9	-70.9	166.8	0	0	0	109.9	F1317 N1325	F1317-I1321 HydrophobicContact CD1-CD1 4.37Å; F1317-I1321 WeakPolarHBondContact O-CA 3.06Å; F1317-I1321 WeakPolarHBondContact O-CB 2.75Å; F1317-I1321 WeakPolarHBondContact O-CD1 3.42Å; F1317-I1321 WeakPolarHBondContact O-CG1 3.12Å; F1317-I1321 PolarHBondContact O-N 2.87Å; I1321-N1325 WeakPolarHBondContact CG2-ND2 3.26Å; I1321-N1325 WeakPolarHBondContact O-CB 3.17Å; I1321-N1325 PolarHBondContact O-N 3.32Å; I1321-N1325 PolarHBondContact O-ND2 2.65Å
1322	L	83.2	Confident	80.8	Confident	94 Å²	94	84.8 Å²	84.8	49%	0.492	47%	0.465	S	S	.	.	H	α-helix	trans	-73	-35.9	172.2	-173.6	147.5	0	0	0	111.1	G1318 I1326	G1318-L1322 WeakPolarHBondContact O-CB 3.47Å; G1318-L1322 PolarHBondContact O-N 3.13Å; L1322-I1326 HydrophobicContact CD2-CD1 3.56Å; L1322-I1326 HydrophobicContact CD2-CG1 4.32Å; L1322-I1326 HydrophobicContact CG-CD1 4.45Å; L1322-I1326 WeakPolarHBondContact O-CB 3.28Å; L1322-I1326 VanDerWaalsContact O-CG1 3.23Å; L1322-I1326 WeakPolarHBondContact O-CG1 2.99Å; L1322-I1326 PolarHBondContact O-N 3.45Å
1323	L	86.2	Confident	80.9	Confident	73 Å²	73	85.2 Å²	85.2	38%	0.382	46%	0.464	S	S	.	.	H	α-helix	trans	-67.5	-41.3	169.1	-84.2	170.1	0	0	0	111.6	F1319 V1320 I1326 I1327	F1319-L1323 HydrophobicContact CD1-CD1 3.65Å; F1319-L1323 HydrophobicContact CD1-CG 4.1Å; F1319-L1323 HydrophobicContact CE1-CD1 3.69Å; F1319-L1323 HydrophobicContact CE1-CG 4.08Å; F1319-L1323 WeakPolarHBondContact O-CA 3.23Å; F1319-L1323 WeakPolarHBondContact O-CB 3.23Å; F1319-L1323 WeakPolarHBondContact O-CG 3.32Å; F1319-L1323 PolarHBondContact O-N 2.52Å; V1320-L1323 CarbonylContact O-C 3.55Å; V1320-L1323 PolarHBondContact O-N 3.26Å; L1323-I1326 CarbonylContact O-C 3.37Å; L1323-I1326 PolarHBondContact O-N 3.2Å; L1323-I1327 VanDerWaalsContact O-CB 3.24Å; L1323-I1327 WeakPolarHBondContact O-CB 3.12Å; L1323-I1327 WeakPolarHBondContact O-CD1 3.47Å; L1323-I1327 WeakPolarHBondContact O-CG1 3.38Å; L1323-I1327 PolarHBondContact O-N 2.03Å
1324	I	85.1	Confident	80.8	Confident	90 Å²	90	89.7 Å²	89.7	46%	0.462	48%	0.476	S	S	.	.	H	α-helix	trans	-67.5	-42	175.9	-74.2	164.7	0	0	0	109.5	V1320 I1327 V1328	V1320-I1324 HydrophobicContact CG1-CD1 3.77Å; V1320-I1324 HydrophobicContact CG1-CG1 4.43Å; V1320-I1324 VanDerWaalsContact O-CB 3.23Å; V1320-I1324 WeakPolarHBondContact O-CB 3.15Å; V1320-I1324 WeakPolarHBondContact O-CD1 3.31Å; V1320-I1324 WeakPolarHBondContact O-CG1 3.35Å; V1320-I1324 PolarHBondContact O-N 3.31Å; I1324-I1327 CarbonylContact O-C 3.4Å; I1324-I1327 PolarHBondContact O-N 2.94Å; I1324-V1328 HydrophobicContact CG2-CG2 4.29Å; I1324-V1328 VanDerWaalsContact O-CB 3.24Å; I1324-V1328 WeakPolarHBondContact O-CB 3.39Å; I1324-V1328 WeakPolarHBondContact O-CG2 3.1Å; I1324-V1328 PolarHBondContact O-N 2.82Å
1325	N	77.4	Confident	80.5	Confident	82 Å²	82	93.6 Å²	93.6	44%	0.439	48%	0.478	S	S	.	.	H	α-helix	trans	-68.4	-33.8	173	-80.5	-64.4	0	0	0	111.9	I1321 V1328 I1329	I1321-N1325 WeakPolarHBondContact CG2-ND2 3.26Å; I1321-N1325 WeakPolarHBondContact O-CB 3.17Å; I1321-N1325 PolarHBondContact O-N 3.32Å; I1321-N1325 PolarHBondContact O-ND2 2.65Å; N1325-V1328 PolarHBondContact O-N 2.7Å; N1325-I1329 WeakPolarHBondContact O-CA 3.12Å; N1325-I1329 WeakPolarHBondContact O-CB 3.08Å; N1325-I1329 WeakPolarHBondContact O-CD1 3.07Å; N1325-I1329 WeakPolarHBondContact O-CG1 3.1Å; N1325-I1329 PolarHBondContact O-N 3.25Å
1326	I	85.6	Confident	79.4	Confident	75 Å²	75	98.8 Å²	98.8	39%	0.385	49%	0.486	S	S	.	.	H	α-helix	trans	-68.5	-38.8	170.2	-78.7	177.5	0	0	0	110.7	L1322 L1323 I1329 I1330	L1322-I1326 HydrophobicContact CD2-CD1 3.56Å; L1322-I1326 HydrophobicContact CD2-CG1 4.32Å; L1322-I1326 HydrophobicContact CG-CD1 4.45Å; L1322-I1326 WeakPolarHBondContact O-CB 3.28Å; L1322-I1326 VanDerWaalsContact O-CG1 3.23Å; L1322-I1326 WeakPolarHBondContact O-CG1 2.99Å; L1322-I1326 PolarHBondContact O-N 3.45Å; L1323-I1326 CarbonylContact O-C 3.37Å; L1323-I1326 PolarHBondContact O-N 3.2Å; I1326-I1329 PolarHBondContact O-N 2.98Å; I1326-I1330 HydrophobicContact CG2-CD1 3.58Å; I1326-I1330 HydrophobicContact CG2-CG1 4.26Å; I1326-I1330 WeakPolarHBondContact O-CA 3.26Å; I1326-I1330 WeakPolarHBondContact O-CB 3.1Å; I1326-I1330 WeakPolarHBondContact O-CG1 2.99Å; I1326-I1330 PolarHBondContact O-N 2.88Å
1327	I	86.9	Confident	78.1	Confident	104 Å²	104	103.2 Å²	103.2	53%	0.533	49%	0.494	S	S	.	.	H	α-helix	trans	-69.5	-35.4	175.9	-73.5	162.3	0	0	0	110.3	L1323 I1324 F1331	L1323-I1327 VanDerWaalsContact O-CB 3.24Å; L1323-I1327 WeakPolarHBondContact O-CB 3.12Å; L1323-I1327 WeakPolarHBondContact O-CD1 3.47Å; L1323-I1327 WeakPolarHBondContact O-CG1 3.38Å; L1323-I1327 PolarHBondContact O-N 2.03Å; I1324-I1327 CarbonylContact O-C 3.4Å; I1324-I1327 PolarHBondContact O-N 2.94Å; I1327-F1331 WeakPolarHBondContact O-CA 3.48Å; I1327-F1331 WeakPolarHBondContact O-CB 3.24Å; I1327-F1331 PolarHBondContact O-N 3.14Å
1328	V	82.5	Confident	76.4	Confident	64 Å²	64	102.2 Å²	102.2	39%	0.388	49%	0.491	S	S	.	.	H	α-helix	trans	-76.7	-37.6	175.5	168.2	0	0	0	0	111	I1324 N1325 F1331 L1332	I1324-V1328 HydrophobicContact CG2-CG2 4.29Å; I1324-V1328 VanDerWaalsContact O-CB 3.24Å; I1324-V1328 WeakPolarHBondContact O-CB 3.39Å; I1324-V1328 WeakPolarHBondContact O-CG2 3.1Å; I1324-V1328 PolarHBondContact O-N 2.82Å; N1325-V1328 PolarHBondContact O-N 2.7Å; V1328-F1331 CarbonylContact O-C 3.45Å; V1328-F1331 PolarHBondContact O-N 3.02Å; V1328-L1332 HydrophobicContact CG1-CD1 3.83Å; V1328-L1332 HydrophobicContact CG1-CG 4.27Å; V1328-L1332 WeakPolarHBondContact O-CB 3.39Å; V1328-L1332 WeakPolarHBondContact O-CG 3.25Å; V1328-L1332 PolarHBondContact O-N 2.91Å
1329	I	81.4	Confident	74.7	Confident	91 Å²	91	109.5 Å²	109.5	47%	0.467	51%	0.507	S	S	.	.	H	α-helix	trans	-70.1	-40.3	172.4	-72.5	165.1	0	0	0	109.9	N1325 I1326 L1332 I1333	N1325-I1329 WeakPolarHBondContact O-CA 3.12Å; N1325-I1329 WeakPolarHBondContact O-CB 3.08Å; N1325-I1329 WeakPolarHBondContact O-CD1 3.07Å; N1325-I1329 WeakPolarHBondContact O-CG1 3.1Å; N1325-I1329 PolarHBondContact O-N 3.25Å; I1326-I1329 PolarHBondContact O-N 2.98Å; I1329-L1332 PolarHBondContact O-N 2.82Å; I1329-I1333 HydrophobicContact CG2-CD1 3.65Å; I1329-I1333 HydrophobicContact CG2-CG1 4.3Å; I1329-I1333 WeakPolarHBondContact O-CB 2.95Å; I1329-I1333 WeakPolarHBondContact O-CG1 3.23Å; I1329-I1333 PolarHBondContact O-N 3.31Å
1330	I	80.9	Confident	72.6	Confident	96 Å²	96	108.8 Å²	108.8	49%	0.492	51%	0.509	S	S	.	.	H	α-helix	trans	-64.6	-40.8	169.8	-73	169.6	0	0	0	109.7	I1326 K1334	I1326-I1330 HydrophobicContact CG2-CD1 3.58Å; I1326-I1330 HydrophobicContact CG2-CG1 4.26Å; I1326-I1330 WeakPolarHBondContact O-CA 3.26Å; I1326-I1330 WeakPolarHBondContact O-CB 3.1Å; I1326-I1330 WeakPolarHBondContact O-CG1 2.99Å; I1326-I1330 PolarHBondContact O-N 2.88Å; I1330-K1334 WeakPolarHBondContact O-CA 3.5Å; I1330-K1334 WeakPolarHBondContact O-CB 2.99Å; I1330-K1334 PolarHBondContact O-N 2.73Å
1331	F	81.2	Confident	70.4	Confident	116 Å²	116	112.8 Å²	112.8	51%	0.509	53%	0.526	S	S	.	.	H	α-helix	trans	-69.3	-34.7	177	-177.9	-100.6	0	0	0	111.8	I1327 V1328 K1334 R1335	I1327-F1331 WeakPolarHBondContact O-CA 3.48Å; I1327-F1331 WeakPolarHBondContact O-CB 3.24Å; I1327-F1331 PolarHBondContact O-N 3.14Å; V1328-F1331 CarbonylContact O-C 3.45Å; V1328-F1331 PolarHBondContact O-N 3.02Å; F1331-K1334 CarbonylContact O-C 3.5Å; F1331-R1335 WeakPolarHBondContact O-CA 3.34Å; F1331-R1335 WeakPolarHBondContact O-CB 3.4Å; F1331-R1335 PolarHBondContact O-N 2.73Å
1332	L	75.3	Confident	68.4	Low	89 Å²	89	115 Å²	115	47%	0.466	54%	0.536	S	S	.	.	H	α-helix	trans	-76.3	-39.5	175.5	-73.9	170.9	0	0	0	111.3	V1328 I1329 K1334 R1335 R1336	V1328-L1332 HydrophobicContact CG1-CD1 3.83Å; V1328-L1332 HydrophobicContact CG1-CG 4.27Å; V1328-L1332 WeakPolarHBondContact O-CB 3.39Å; V1328-L1332 WeakPolarHBondContact O-CG 3.25Å; V1328-L1332 PolarHBondContact O-N 2.91Å; I1329-L1332 PolarHBondContact O-N 2.82Å; L1332-K1334 VanDerWaalsContact C-N 3.34Å; L1332-R1335 PolarHBondContact O-N 2.6Å; L1332-R1336 WeakPolarHBondContact O-CA 3.18Å; L1332-R1336 WeakPolarHBondContact O-CB 3.32Å; L1332-R1336 PolarHBondContact O-N 3.2Å
1333	I	74.4	Confident	66	Low	81 Å²	81	121.6 Å²	121.6	42%	0.415	55%	0.554	S	S	.	*	H	α-helix	trans	-65.2	-39.4	169.9	-71.1	170	0	0	0	109.8	I1329 R1337	I1329-I1333 HydrophobicContact CG2-CD1 3.65Å; I1329-I1333 HydrophobicContact CG2-CG1 4.3Å; I1329-I1333 WeakPolarHBondContact O-CB 2.95Å; I1329-I1333 WeakPolarHBondContact O-CG1 3.23Å; I1329-I1333 PolarHBondContact O-N 3.31Å; I1333-R1337 HydrophobicContact CG2-CG 4.32Å; I1333-R1337 WeakPolarHBondContact O-CA 2.76Å; I1333-R1337 WeakPolarHBondContact O-CB 3.48Å; I1333-R1337 WeakPolarHBondContact O-CG 3.33Å; I1333-R1337 PolarHBondContact O-N 2.84Å
1334	K	67.3	Low	63.4	Low	148 Å²	148	128.7 Å²	128.7	64%	0.643	58%	0.576	S	S	*	*	H	α-helix	trans	-69.3	-38.3	175.1	-170.7	172	-175.5	176	0	110.9	I1330 F1331 L1332 H1338	I1330-K1334 WeakPolarHBondContact O-CA 3.5Å; I1330-K1334 WeakPolarHBondContact O-CB 2.99Å; I1330-K1334 PolarHBondContact O-N 2.73Å; F1331-K1334 CarbonylContact O-C 3.5Å; L1332-K1334 VanDerWaalsContact C-N 3.34Å; K1334-H1338 WeakPolarHBondContact O-CA 3.15Å; K1334-H1338 WeakPolarHBondContact O-CB 3.43Å; K1334-H1338 PolarHBondContact O-N 2.96Å
1335	R	67.8	Low	61.1	Low	143 Å²	143	135.4 Å²	135.4	54%	0.54	60%	0.595	S	S	.	*	H	α-helix	trans	-74.5	-31.9	176	-170.6	176	-171.6	-173.3	3.6	112.5	F1331 L1332 R1339	F1331-R1335 WeakPolarHBondContact O-CA 3.34Å; F1331-R1335 WeakPolarHBondContact O-CB 3.4Å; F1331-R1335 PolarHBondContact O-N 2.73Å; L1332-R1335 PolarHBondContact O-N 2.6Å; R1335-R1339 WeakPolarHBondContact O-CB 3.4Å; R1335-R1339 PolarHBondContact O-N 3.03Å
1336	R	55.2	Low	58.9	Low	193 Å²	193	140.4 Å²	140.4	73%	0.728	62%	0.616	S	S	*	*	H	α-helix	trans	-78.4	-39.1	173.9	-160.8	172.4	-167	174.1	3.1	110.9	L1332 N1340	L1332-R1336 WeakPolarHBondContact O-CA 3.18Å; L1332-R1336 WeakPolarHBondContact O-CB 3.32Å; L1332-R1336 PolarHBondContact O-N 3.2Å; R1336-N1340 WeakPolarHBondContact O-CB 3.41Å; R1336-N1340 PolarHBondContact O-N 3.01Å; R1336-N1340 PolarHBondContact O-OD1 3.03Å
1337	R	53.5	Low	56.1	Low	174 Å²	174	148.2 Å²	148.2	66%	0.657	64%	0.642	S	S	*	*	H	α-helix	trans	-65.4	-38	166.7	-74.3	177.9	178.3	-174.7	-0.5	111.7	I1333 N1340 M1341	I1333-R1337 HydrophobicContact CG2-CG 4.32Å; I1333-R1337 WeakPolarHBondContact O-CA 2.76Å; I1333-R1337 WeakPolarHBondContact O-CB 3.48Å; I1333-R1337 WeakPolarHBondContact O-CG 3.33Å; I1333-R1337 PolarHBondContact O-N 2.84Å; R1337-N1340 CarbonylContact O-C 3.6Å; R1337-N1340 PolarHBondContact O-N 3.31Å; R1337-M1341 VanDerWaalsContact O-CB 3.31Å; R1337-M1341 WeakPolarHBondContact O-CB 3.31Å; R1337-M1341 WeakPolarHBondContact O-CG 3.42Å; R1337-M1341 PolarHBondContact O-N 2.8Å
1338	H	45.4	Very low	53.2	Low	114 Å²	114	151.5 Å²	151.5	53%	0.528	65%	0.653	S	S	.	*	H	α-helix	trans	-69	-41	175.3	-167.9	-86	0	0	0	111.8	K1334 N1340 M1341 M1342	K1334-H1338 WeakPolarHBondContact O-CA 3.15Å; K1334-H1338 WeakPolarHBondContact O-CB 3.43Å; K1334-H1338 PolarHBondContact O-N 2.96Å; H1338-N1340 VanDerWaalsContact C-N 3.31Å; H1338-N1340 PolarHBondContact O-N 3.23Å; H1338-M1341 PolarHBondContact O-N 2.69Å; H1338-M1342 WeakPolarHBondContact O-CB 3.46Å; H1338-M1342 VanDerWaalsContact O-CG 3.28Å; H1338-M1342 WeakPolarHBondContact O-CG 2.89Å; H1338-M1342 PolarHBondContact O-N 3.04Å
1339	R	46.2	Very low	50.7	Low	189 Å²	189	154.2 Å²	154.2	71%	0.713	68%	0.675	S	S	*	*	H	α-helix	trans	-63.4	-33.9	169.6	-85.8	-174.6	161.7	-179	-6.7	112.7	R1335	R1335-R1339 WeakPolarHBondContact O-CB 3.4Å; R1335-R1339 PolarHBondContact O-N 3.03Å
1340	N	40.6	Very low	48.3	Very low	117 Å²	117	155.1 Å²	155.1	63%	0.626	68%	0.681	S	S	*	*	H	α-helix	trans	-80.1	-32.1	176.6	-70.1	7.8	0	0	0	113.3	R1336 R1337 H1338 R1343	R1336-N1340 WeakPolarHBondContact O-CB 3.41Å; R1336-N1340 PolarHBondContact O-N 3.01Å; R1336-N1340 PolarHBondContact O-OD1 3.03Å; R1337-N1340 CarbonylContact O-C 3.6Å; R1337-N1340 PolarHBondContact O-N 3.31Å; H1338-N1340 VanDerWaalsContact C-N 3.31Å; H1338-N1340 PolarHBondContact O-N 3.23Å; N1340-R1343 PolarHBondContact O-N 2.87Å
1341	M	41.8	Very low	45.8	Very low	144 Å²	144	159 Å²	159	71%	0.709	70%	0.697	S	S	*	*	H	α-helix	trans	-73.1	-33.7	174.5	-85.1	178.2	148.6	0	0	112.1	R1337 H1338 R1343 R1344	R1337-M1341 VanDerWaalsContact O-CB 3.31Å; R1337-M1341 WeakPolarHBondContact O-CB 3.31Å; R1337-M1341 WeakPolarHBondContact O-CG 3.42Å; R1337-M1341 PolarHBondContact O-N 2.8Å; H1338-M1341 PolarHBondContact O-N 2.69Å; M1341-R1343 PolarHBondContact O-N 2.87Å; M1341-R1344 CarbonylContact O-C 3.57Å; M1341-R1344 PolarHBondContact O-N 2.9Å
1342	M	38	Very low	43.4	Very low	139 Å²	139	156.9 Å²	156.9	69%	0.685	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.2	-3.7	173	-72.1	-67	-175.5	0	0	114.2	H1338	H1338-M1342 WeakPolarHBondContact O-CB 3.46Å; H1338-M1342 VanDerWaalsContact O-CG 3.28Å; H1338-M1342 WeakPolarHBondContact O-CG 2.89Å; H1338-M1342 PolarHBondContact O-N 3.04Å
1343	R	33	Very low	41.1	Very low	231 Å²	231	159.3 Å²	159.3	87%	0.872	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.3	5.6	168.1	-77.8	-172.2	169.5	-171.7	-3.8	114.8	N1340 M1341	N1340-R1343 PolarHBondContact O-N 2.87Å; M1341-R1343 PolarHBondContact O-N 2.87Å
1344	R	32.2	Very low	39	Very low	222 Å²	222	161.2 Å²	161.2	84%	0.838	74%	0.741	S	S	*	*	S	Bend	trans	-131	103	162	-76.8	-171.9	174.5	-179	-2	109.1	M1341	M1341-R1344 CarbonylContact O-C 3.57Å; M1341-R1344 PolarHBondContact O-N 2.9Å
1345	R	36.4	Very low	37.1	Very low	231 Å²	231	161.8 Å²	161.8	87%	0.872	75%	0.748	S	S	*	*			trans	-62.2	161.8	178.8	-63.5	172.1	174.4	164.1	-4.4	110.7
1346	Q	32.4	Very low	35.1	Very low	188 Å²	188	160.1 Å²	160.1	88%	0.879	75%	0.754	S	S	*	*	S	Bend	trans	82.4	120.9	171.7	-55.7	159.7	-92.6	0	0	118
1347	Y	26.7	Very low	34	Very low	238 Å²	238	158.5 Å²	158.5	93%	0.933	76%	0.76	S	S	*	*			trans	63.6	166.6	155.2	-108.3	-108.9	0	0	0	120.9
1348	K	24.4	Very low	32.8	Very low	173 Å²	173	153.3 Å²	153.3	75%	0.752	76%	0.76	S	S	*	*			trans	-144.9	144.1	-156	-171.4	-172.6	175.3	-161	0	113.6	D1350	K1348-D1350 IonicContact NZ-OD2 3.43Å
1349	S	30.5	Very low	32.2	Very low	121 Å²	121	155.2 Å²	155.2	85%	0.846	78%	0.78	S	S	*	*			trans	-151.4	172.4	165.6	-170	0	0	0	0	110.4
1350	D	30.6	Very low	31.4	Very low	110 Å²	110	149.8 Å²	149.8	59%	0.588	78%	0.775	S	S	*	*			trans	-138	-52.8	-145.9	-134.1	-105.1	0	0	0	119.3	K1348	K1348-D1350 IonicContact NZ-OD2 3.43Å
1351	Q	29.7	Very low	30.8	Very low	179 Å²	179	152.2 Å²	152.2	84%	0.836	79%	0.787	S	S	*	*			trans	-140	156.4	-158.9	-66.9	155.7	37.7	0	0	114.2
1352	G	29.8	Very low	30.2	Very low	71 Å²	71	151.1 Å²	151.1	73%	0.732	79%	0.789	S	S	*	*			cis	173	173.4	-6.2	0	0	0	0	0	113.9
1353	V	27.9	Very low	29.9	Very low	140 Å²	140	151.8 Å²	151.8	85%	0.848	79%	0.79	S	S	*	*			trans	83.9	110.1	161.8	-174.5	0	0	0	0	122
1354	T	29.4	Very low	29.9	Very low	121 Å²	121	147 Å²	147	74%	0.742	78%	0.777	S	S	*	*			trans	32.2	141.9	148	66.9	0	0	0	0	128.4
1355	M	27	Very low	29.9	Very low	160 Å²	160	141 Å²	141	79%	0.788	76%	0.762	S	S	*	*			trans	92.4	138.9	140.1	-71.2	-122.3	82	0	0	123.8
1356	T	27.2	Very low	29.7	Very low	108 Å²	108	137.6 Å²	137.6	66%	0.663	76%	0.755	S	S	*	*			trans	68.1	134.2	152.6	42.8	0	0	0	0	124.2
1357	N	30.6	Very low	29.6	Very low	159 Å²	159	134.8 Å²	134.8	85%	0.85	75%	0.751	S	S	*	*			trans	-4.6	150.4	145	-43.1	-12.7	0	0	0	118.4
1358	G	29.1	Very low	29.7	Very low	64 Å²	64	128.3 Å²	128.3	66%	0.66	74%	0.741	S	S	*	*			cis	147.4	160.6	0.4	0	0	0	0	0	112.1
1359	V	31.8	Very low	30	Very low	155 Å²	155	125.5 Å²	125.5	94%	0.939	74%	0.739	S	S	*	*			trans	70.4	149.9	177.7	-172.4	0	0	0	0	114.8
1360	A	30.1	Very low	29.9	Very low	75 Å²	75	125.7 Å²	125.7	62%	0.62	73%	0.73	S	S	*	*			cis	-169.9	177.4	-42.5	0	0	0	0	0	108.4
1361	L	28.7	Very low	29.9	Very low	168 Å²	168	127 Å²	127	88%	0.88	74%	0.735	S	S	*	*			trans	70.3	126.9	169.2	-53.8	170	0	0	0	114.1
1362	T	29.3	Very low	29.9	Very low	121 Å²	121	126.1 Å²	126.1	74%	0.742	73%	0.728	S	S	*	*			cis	-145.1	-170.8	7.6	61.1	0	0	0	0	109.5
1363	H	31	Very low	29.9	Very low	153 Å²	153	126.8 Å²	126.8	71%	0.708	72%	0.721	S	S	*	*			cis	-155.6	-164.2	-1.3	-146.8	-140.1	0	0	0	113.7
1364	H	33.6	Very low	29.8	Very low	131 Å²	131	127.8 Å²	127.8	61%	0.606	72%	0.716	S	S	*	*			trans	-45.2	160.4	170.2	-75.4	-3.5	0	0	0	119.9
1365	N	32.2	Very low	29.6	Very low	95 Å²	95	128.1 Å²	128.1	51%	0.508	71%	0.713	S	S	.	*			cis	-160.2	140.9	-10.3	-112.2	1.7	0	0	0	111.7
1366	Q	32.5	Very low	29.5	Very low	159 Å²	159	127.6 Å²	127.6	74%	0.743	71%	0.708	S	S	*	*				65.1	147.2	94.2	-67.4	-179.8	-3.7	0	0	115.6
1367	T	30	Very low	29.4	Very low	129 Å²	129	127.2 Å²	127.2	79%	0.791	71%	0.71	S	S	*	*			cis	-141	168.2	12.6	26.3	0	0	0	0	109.6
1368	S	28.5	Very low	29.1	Very low	103 Å²	103	124 Å²	124	72%	0.72	70%	0.7	S	S	*	*			cis	-156.1	137.5	-8.9	171	0	0	0	0	110.1
1369	T	29.6	Very low	29.1	Very low	114 Å²	114	130 Å²	130	70%	0.699	71%	0.708	S	S	*	*			trans	-24.6	135	168.1	46.3	0	0	0	0	118.3
1370	D	30.4	Very low	28.9	Very low	124 Å²	124	128.8 Å²	128.8	66%	0.663	70%	0.695	S	S	*	*				74.2	124.6	70.7	-82.5	-52.6	0	0	0	113.5
1371	M	29.1	Very low	28.7	Very low	139 Å²	139	132.3 Å²	132.3	69%	0.685	70%	0.704	S	S	*	*			cis	72.6	126.4	35.3	-138.5	-157.6	-18.5	0	0	111.7
1372	K	30.4	Very low	28.9	Very low	160 Å²	160	130.2 Å²	130.2	70%	0.696	69%	0.689	S	S	*	*				-176.2	173.7	60.1	-99.3	-161.8	175.5	66.8	0	108.4
1373	S	28.8	Very low	28.9	Very low	84 Å²	84	128.1 Å²	128.1	59%	0.587	67%	0.674	S	S	*	*			cis	-173.8	162.8	-18.4	58.2	0	0	0	0	106.4
1374	H	25.7	Very low	28.7	Very low	162 Å²	162	126.9 Å²	126.9	75%	0.75	67%	0.672	S	S	*	*				49.4	142.2	55.9	-69.6	-82.5	0	0	0	114.2
1375	L	26	Very low	28.3	Very low	127 Å²	127	128 Å²	128	67%	0.665	68%	0.682	S	S	*	*			cis	-162.4	-165.7	-21.2	-124.2	-175.9	0	0	0	109.1
1376	Q	24.8	Very low	28.8	Very low	149 Å²	149	133.1 Å²	133.1	70%	0.696	70%	0.701	S	S	*	*			trans	-19.3	141.3	155.3	-80.7	155.6	-48.2	0	0	117.2
1377	S	24.7	Very low	28.6	Very low	100 Å²	100	131 Å²	131	70%	0.699	69%	0.692	S	S	*	*				67.5	153.6	76.4	107.7	0	0	0	0	113.4
1378	S	25.4	Very low	28.4	Very low	91 Å²	91	130.1 Å²	130.1	64%	0.636	68%	0.683	S	S	*	*			cis	-171.7	155.1	-0.6	29.3	0	0	0	0	110.3
1379	F	28.3	Very low	28.3	Very low	190 Å²	190	129.2 Å²	129.2	83%	0.833	67%	0.673	S	S	*	*			trans	-152.8	122.2	165.8	-84.5	-87	0	0	0	107.5
1380	I	27.2	Very low	28.3	Very low	131 Å²	131	130 Å²	130	67%	0.672	67%	0.673	S	S	*	*				81.2	119	77.2	-82.3	165.2	0	0	0	110.7
1381	D	27.4	Very low	28.4	Very low	149 Å²	149	132 Å²	132	80%	0.797	68%	0.682	S	S	*	*			cis	-137.8	-134.3	10.8	-65.9	-53.7	0	0	0	115.4
1382	Q	31.7	Very low	28.2	Very low	123 Å²	123	130.1 Å²	130.1	58%	0.575	68%	0.682	S	S	*	*			trans	-137.1	176.8	-164	-76.2	-178.4	-58.5	0	0	116.2	M1387	Q1382-M1387 HydrophobicContact CG-CB 4.44Å
1383	N	29.6	Very low	28.2	Very low	78 Å²	78	128.8 Å²	128.8	42%	0.417	69%	0.688	S	S	.	*			trans	68.2	142.3	177.2	-73.5	52.6	0	0	0	117	D1388	N1383-D1388 PolarHBondContact ND2-OD1 2.58Å
1384	D	26.3	Very low	28.2	Very low	127 Å²	127	130 Å²	130	68%	0.679	69%	0.692	S	S	*	*	S	Bend	cis	-116.6	163.5	5.3	-71.4	-45.2	0	0	0	113.9
1385	N	25	Very low	28.3	Very low	153 Å²	153	126.7 Å²	126.7	82%	0.818	69%	0.686	S	S	*	*	S	Bend	trans	65.6	104.4	174.4	-63.7	-69.9	0	0	0	114.7
1386	F	43.9	Very low	28.5	Very low	203 Å²	203	125.8 Å²	125.8	89%	0.89	68%	0.681	S	S	*	*	S	Bend	trans	66.4	130.2	-146.7	-95.5	-107.9	0	0	0	111.8
1387	M	28.4	Very low	28.6	Very low	116 Å²	116	124.3 Å²	124.3	57%	0.571	69%	0.686	S	S	*	*			trans	73.4	131.2	-171.7	-63.9	-75.4	100.1	0	0	116.2	Q1382	Q1382-M1387 HydrophobicContact CG-CB 4.44Å
1388	D	25.8	Very low	29.1	Very low	110 Å²	110	125.6 Å²	125.6	59%	0.588	69%	0.693	S	S	*	*			trans	-178	143.5	177.9	-103.4	-43.4	0	0	0	105.4	N1383	N1383-D1388 PolarHBondContact ND2-OD1 2.58Å
1389	T	26.1	Very low	29.3	Very low	84 Å²	84	128.8 Å²	128.8	52%	0.515	70%	0.697	S	S	.	*			cis	-152.9	-171.5	-16.5	-24.1	0	0	0	0	107.3
1390	D	29.2	Very low	29.7	Very low	131 Å²	131	123.6 Å²	123.6	70%	0.701	68%	0.683	S	S	*	*			trans	20	115.4	160.2	-58.9	-15.1	0	0	0	120.6
1391	I	32.1	Very low	29.8	Very low	164 Å²	164	124 Å²	124	84%	0.841	69%	0.687	S	S	*	*				99.9	145.4	51.5	-72.9	168.1	0	0	0	112.9
1392	S	26.1	Very low	29.7	Very low	100 Å²	100	125.4 Å²	125.4	70%	0.699	69%	0.685	S	S	*	*			trans	-103.9	145.2	-157.7	57.7	0	0	0	0	116
1393	T	30.7	Very low	29.4	Very low	133 Å²	133	127.9 Å²	127.9	82%	0.816	70%	0.697	S	S	*	*				-157.8	116.6	127.6	14.9	0	0	0	0	113.7
1394	T	27.4	Very low	29.1	Very low	108 Å²	108	133.7 Å²	133.7	66%	0.663	72%	0.719	S	S	*	*			trans	47.2	113.4	145.5	53.2	0	0	0	0	123.5
1395	C	29.3	Very low	29	Very low	93 Å²	93	136 Å²	136	63%	0.628	73%	0.73	S	S	*	*				60	142.8	128.9	-64.3	0	0	0	0	121.6
1396	I	28.4	Very low	29	Very low	109 Å²	109	132.4 Å²	132.4	56%	0.559	72%	0.722	S	S	*	*			cis	-156.2	143	10.1	-123.3	160.1	0	0	0	112.4	Q1446	I1396-Q1446 HydrophobicContact CD1-CG 4.48Å
1397	C	28.7	Very low	28	Very low	118 Å²	118	127.8 Å²	127.8	80%	0.797	72%	0.715	S	S	*	*			trans	55.3	156.2	160.4	-62.7	0	0	0	0	122
1398	C	34.6	Very low	27.8	Very low	127 Å²	127	127.9 Å²	127.9	86%	0.858	73%	0.727	S	S	*	*			trans	-130	157.4	-153.1	-45.1	0	0	0	0	116.3
1399	H	28.2	Very low	27.7	Very low	157 Å²	157	126 Å²	126	73%	0.727	73%	0.733	S	S	*	*			trans	-136.7	-173.7	147.7	-143.1	34.8	0	0	0	109.5
1400	P	37.4	Very low	27.5	Very low	81 Å²	81	132.9 Å²	132.9	53%	0.526	75%	0.751	S	S	.	*				-129.2	-169.3	-112.4	43.4	-26.4	0	0	0	116.2
1401	N	28.7	Very low	27.3	Very low	141 Å²	141	133.1 Å²	133.1	75%	0.754	76%	0.757	S	S	*	*			trans	68.8	113	155	-84.7	-33	0	0	0	117.7
1402	K	26.3	Very low	26.8	Very low	177 Å²	177	133.3 Å²	133.3	77%	0.77	75%	0.752	S	S	*	*				-176.1	149.1	58.2	-107.6	159.6	-177.7	176.8	0	114
1403	Q	24.7	Very low	26.7	Very low	175 Å²	175	132.5 Å²	132.5	82%	0.818	75%	0.751	S	S	*	*			trans	64.2	137.5	149	-68.8	-174.2	-15.8	0	0	122.6
1404	K	23.9	Very low	26.3	Very low	200 Å²	200	131.9 Å²	131.9	87%	0.87	74%	0.743	S	S	*	*			trans	75.4	87.6	169.3	-63.8	-174.2	177.4	-179.9	0	118.3
1405	L	25.2	Very low	26.2	Very low	175 Å²	175	132.7 Å²	132.7	92%	0.916	75%	0.753	S	S	*	*			trans	-152.3	142.6	148.5	-146.4	73.2	0	0	0	113.5
1406	A	23.8	Very low	26	Very low	78 Å²	78	138 Å²	138	65%	0.645	76%	0.761	S	S	*	*			trans	29.9	155.8	149.9	0	0	0	0	0	125.7
1407	S	23.2	Very low	26	Very low	107 Å²	107	136.6 Å²	136.6	75%	0.748	77%	0.773	S	S	*	*			trans	69.3	105.6	146.6	55.3	0	0	0	0	121.1	G1409	S1407-G1409 PolarHBondContact O-N 3.09Å
1408	S	23.2	Very low	25.9	Very low	117 Å²	117	137 Å²	137	82%	0.818	77%	0.768	S	S	*	*				27.4	95.5	114.8	-166.4	0	0	0	0	116.9
1409	G	24.4	Very low	25.6	Very low	70 Å²	70	140.4 Å²	140.4	72%	0.722	77%	0.769	S	S	*	*			trans	-112.6	117.8	159.7	0	0	0	0	0	109.8	S1407 V1411	S1407-G1409 PolarHBondContact O-N 3.09Å; G1409-V1411 PolarHBondContact O-N 3.28Å
1410	Y	23.1	Very low	25.5	Very low	229 Å²	229	136.5 Å²	136.5	90%	0.898	76%	0.759	S	S	*	*			trans	-69.1	121	168.6	-111.6	-100.1	0	0	0	108.9	K1412	Y1410-K1412 PolarHBondContact O-N 3.47Å
1411	V	23.6	Very low	25.1	Very low	137 Å²	137	140 Å²	140	83%	0.83	76%	0.762	S	S	*	*			trans	-76.8	102.5	169.6	178.4	0	0	0	0	108.1	G1409	G1409-V1411 PolarHBondContact O-N 3.28Å
1412	K	23	Very low	25	Very low	168 Å²	168	136.5 Å²	136.5	73%	0.73	75%	0.745	S	S	*	*			trans	-83.8	122.2	160.7	-165.1	-176.8	-175.3	-105.2	0	107.8	Y1410 D1414	Y1410-K1412 PolarHBondContact O-N 3.47Å; K1412-D1414 IonicContact NZ-OD2 3.65Å; K1412-D1414 PolarHBondContact NZ-OD2 2.79Å
1413	A	22.2	Very low	25.2	Very low	83 Å²	83	134 Å²	134	69%	0.686	74%	0.736	S	S	*	*			trans	-73.5	131	169.6	0	0	0	0	0	109.7
1414	D	24	Very low	25.4	Very low	120 Å²	120	128.8 Å²	128.8	64%	0.642	73%	0.729	S	S	*	*			trans	-165.7	84.7	154.9	-88.4	-45	0	0	0	107.7	K1412 Y1416	K1412-D1414 IonicContact NZ-OD2 3.65Å; K1412-D1414 PolarHBondContact NZ-OD2 2.79Å; D1414-Y1416 PolarHBondContact O-N 2.8Å
1415	S	24.7	Very low	25.9	Very low	125 Å²	125	128 Å²	128	87%	0.874	72%	0.722	S	S	*	*			trans	-93.2	83.4	-178.9	176.1	0	0	0	0	111.3	G1417	S1415-G1417 PolarHBondContact O-N 3.22Å
1416	Y	25.3	Very low	26.2	Very low	204 Å²	204	123 Å²	123	80%	0.8	71%	0.706	S	S	*	*			trans	-70.6	111.6	167.6	-99.1	-88.4	0	0	0	110.9	D1414 N1418	D1414-Y1416 PolarHBondContact O-N 2.8Å; Y1416-N1418 PolarHBondContact O-N 2.83Å
1417	G	28.7	Very low	26.7	Very low	79 Å²	79	124.9 Å²	124.9	81%	0.814	71%	0.712	S	S	*	*			trans	-71	89.7	169.2	0	0	0	0	0	110.9	S1415	S1415-G1417 PolarHBondContact O-N 3.22Å
1418	N	26.6	Very low	27	Very low	126 Å²	126	126.9 Å²	126.9	67%	0.674	71%	0.709	S	S	*	*			trans	-63	147.7	176.4	-79.1	-46.7	0	0	0	112.5	Y1416	Y1416-N1418 PolarHBondContact O-N 2.83Å
1419	F	26.9	Very low	27.4	Very low	200 Å²	200	126.9 Å²	126.9	88%	0.877	70%	0.7	S	S	*	*				-137.7	120.3	127.6	-110.9	-75.9	0	0	0	110.6
1420	S	26.2	Very low	27.7	Very low	75 Å²	75	130.6 Å²	130.6	52%	0.524	70%	0.702	S	S	.	*			trans	-115.6	165.2	175.1	62	0	0	0	0	109.9
1421	R	30.2	Very low	28.1	Very low	155 Å²	155	124.7 Å²	124.7	59%	0.585	69%	0.693	S	S	*	*			trans	-166.9	128.2	145.4	-113.7	-173	-174.4	-154.9	4.1	109.6	S1762 S1763	R1421-S1762 CarbonylContact O-C 3.31Å; R1421-S1763 WeakPolarHBondContact CB-OG 3.28Å; R1421-S1763 CarbonylContact O-C 3.55Å; R1421-S1763 WeakPolarHBondContact O-CA 3.3Å; R1421-S1763 WeakPolarHBondContact O-CB 3.44Å; R1421-S1763 PolarHBondContact O-OG 3.13Å
1422	T	26.1	Very low	28.6	Very low	67 Å²	67	123.9 Å²	123.9	41%	0.411	69%	0.69	S	S	.	*			trans	-105.1	176.5	-174.8	36.5	0	0	0	0	112.6	S1762 Y1764	T1422-S1762 CarbonylContact C-O 3.54Å; T1422-Y1764 WeakPolarHBondContact CG2-O 3.44Å
1423	H	29.4	Very low	29.2	Very low	123 Å²	123	119.7 Å²	119.7	57%	0.569	68%	0.682	S	S	*	*			trans	84.2	157.8	162	-46.7	-64.5	0	0	0	117	Y1425	H1423-Y1425 HydrophobicContact CB-CE1 4.1Å; H1423-Y1425 HydrophobicContact CB-CE2 3.91Å; H1423-Y1425 WeakPolarHBondContact CB-OH 3.16Å; H1423-Y1425 AromaticContact CG-CZ 3.92Å
1424	G	30	Very low	29.7	Very low	66 Å²	66	123.8 Å²	123.8	68%	0.68	69%	0.687	S	S	*	*			cis	-174.7	-168.9	-0.2	0	0	0	0	0	109.9
1425	Y	34	Very low	30.1	Very low	183 Å²	183	121.8 Å²	121.8	72%	0.718	68%	0.682	S	S	*	*			cis	-153.8	149.3	0.5	-77.6	-75.6	0	0	0	108.4	H1423	H1423-Y1425 HydrophobicContact CB-CE1 4.1Å; H1423-Y1425 HydrophobicContact CB-CE2 3.91Å; H1423-Y1425 WeakPolarHBondContact CB-OH 3.16Å; H1423-Y1425 AromaticContact CG-CZ 3.92Å
1426	A	32.7	Very low	30.7	Very low	71 Å²	71	122 Å²	122	59%	0.587	68%	0.68	S	S	*	*				38.6	134	98.3	0	0	0	0	0	117.3
1427	P	33.9	Very low	31.2	Very low	117 Å²	117	120.9 Å²	120.9	76%	0.76	68%	0.682	S	S	*	*				-125.4	154.6	97.6	5.2	16.9	0	0	0	113.3
1428	H	29.8	Very low	31.7	Very low	150 Å²	150	127.7 Å²	127.7	69%	0.694	69%	0.685	S	S	*	*			cis	78.9	145.9	44.1	-69.5	-69.4	0	0	0	114.6
1429	D	30.9	Very low	32.3	Very low	117 Å²	117	128.7 Å²	128.7	63%	0.626	69%	0.689	S	S	*	*			cis	-154.1	158.8	-5.3	-114.8	-12.5	0	0	0	108.7
1430	I	31.4	Very low	32.4	Very low	148 Å²	148	123.5 Å²	123.5	76%	0.759	68%	0.675	S	S	*	*			cis	86.4	153.9	10.9	-56.3	168.8	0	0	0	115.7
1431	C	30.4	Very low	32.2	Very low	104 Å²	104	126.2 Å²	126.2	70%	0.703	69%	0.689	S	S	*	*			trans	75.7	175.8	177	-97.9	0	0	0	0	116.9
1432	P	35.2	Very low	31.9	Very low	121 Å²	121	126.6 Å²	126.6	79%	0.786	70%	0.702	S	S	*	*			cis	-137	-167.3	18.6	32.8	-8.7	0	0	0	117.7
1433	S	34.1	Very low	32	Very low	80 Å²	80	129.1 Å²	129.1	56%	0.559	72%	0.717	S	S	*	*				-179.8	173.3	-62.5	60.5	0	0	0	0	114
1434	Q	33.1	Very low	32	Very low	169 Å²	169	129.2 Å²	129.2	79%	0.79	72%	0.722	S	S	*	*			trans	99.3	146.7	158.6	-58.8	173.9	18.1	0	0	123
1435	C	33.2	Very low	32	Very low	78 Å²	78	132.6 Å²	132.6	53%	0.527	72%	0.72	S	S	.	*			trans	-154.7	169.8	-168.1	-51.6	0	0	0	0	116.9	L1449	C1435-L1449 PolarHBondContact SG-N 3.2Å; C1435-L1449 VanDerWaalsContact SG-N 3.43Å
1436	P	36.5	Very low	31.7	Very low	130 Å²	130	130.9 Å²	130.9	84%	0.844	72%	0.719	S	S	*	*			trans	-128	-170.3	-170.2	44	-29.5	0	0	0	119.4
1437	Q	36.4	Very low	31.7	Very low	180 Å²	180	130.8 Å²	130.8	84%	0.841	73%	0.725	S	S	*	*			trans	-145	138	172.6	-73.5	-173.1	-39.5	0	0	114.1
1438	Y	39.8	Very low	31.6	Very low	222 Å²	222	133.6 Å²	133.6	87%	0.871	73%	0.727	S	S	*	*			trans	-178.3	171.4	155.9	-129.6	-94.1	0	0	0	113.6
1439	I	37.6	Very low	31.8	Very low	146 Å²	146	131.8 Å²	131.8	75%	0.749	72%	0.722	S	S	*	*			trans	-145.6	115.1	155.5	-64.9	-176.7	0	0	0	107
1440	P	29	Very low	31.7	Very low	92 Å²	92	133.8 Å²	133.8	60%	0.597	73%	0.73	S	S	*	*				-146.7	164	85.7	41.9	-26.1	0	0	0	116.8	D1442	P1440-D1442 PolarHBondContact O-N 2.65Å
1441	T	23.1	Very low	31.6	Very low	132 Å²	132	132.7 Å²	132.7	81%	0.81	73%	0.725	S	S	*	*			trans	18.7	87	157.2	58.4	0	0	0	0	119.7
1442	D	23.1	Very low	31.8	Very low	163 Å²	163	135.9 Å²	135.9	87%	0.872	73%	0.729	S	S	*	*				-167.1	164.7	117.3	-114.3	-27.1	0	0	0	112.5	P1440	P1440-D1442 PolarHBondContact O-N 2.65Å
1443	V	28.1	Very low	31.4	Very low	119 Å²	119	137.1 Å²	137.1	72%	0.721	73%	0.729	S	S	*	*			trans	-58.8	131.7	-157.5	177.5	0	0	0	0	120.5
1444	D	29	Very low	31.3	Very low	126 Å²	126	139.8 Å²	139.8	67%	0.674	74%	0.736	S	S	*	*			trans	66.7	126.5	146.4	-73	16.9	0	0	0	129
1445	Q	30.5	Very low	31.1	Very low	137 Å²	137	137.8 Å²	137.8	64%	0.64	74%	0.735	S	S	*	*			trans	85.2	112.4	136.7	-67.7	178.4	49	0	0	126.9
1446	Q	29	Very low	30.9	Very low	146 Å²	146	138 Å²	138	68%	0.682	74%	0.738	S	S	*	*			trans	66	121.7	141.8	-55.4	-171.1	13.7	0	0	126.5	I1396	I1396-Q1446 HydrophobicContact CD1-CG 4.48Å
1447	G	31.5	Very low	30.5	Very low	69 Å²	69	137 Å²	137	71%	0.711	73%	0.734	S	S	*	*			trans	146.1	130.6	143.6	0	0	0	0	0	124.1
1448	H	32.5	Very low	30.1	Very low	177 Å²	177	135.9 Å²	135.9	82%	0.819	73%	0.734	S	S	*	*			trans	78.3	-177.5	153.3	-86.1	-61.1	0	0	0	126.9
1449	L	32.7	Very low	29.8	Very low	111 Å²	111	129.7 Å²	129.7	58%	0.581	72%	0.721	S	S	*	*			trans	-135.1	149.9	-143	-100.9	86.4	0	0	0	121.3	C1435	C1435-L1449 PolarHBondContact SG-N 3.2Å; C1435-L1449 VanDerWaalsContact SG-N 3.43Å
1450	M	30.5	Very low	29.2	Very low	159 Å²	159	129.3 Å²	129.3	78%	0.783	72%	0.721	S	S	*	*			trans	66.9	118	140.6	-81.3	-170.2	179.1	0	0	129
1451	N	29	Very low	29.2	Very low	125 Å²	125	133.7 Å²	133.7	67%	0.668	73%	0.73	S	S	*	*				81.8	123.8	123.5	-79.1	6.9	0	0	0	130.2
1452	H	33.4	Very low	29.4	Very low	171 Å²	171	133.6 Å²	133.6	79%	0.792	73%	0.725	S	S	*	*			trans	76.3	138.8	137.8	-77.6	-58.1	0	0	0	127
1453	N	28.5	Very low	29.7	Very low	147 Å²	147	132.8 Å²	132.8	79%	0.786	72%	0.716	S	S	*	*			trans	-159.7	-168.6	154.9	-138.2	-28.1	0	0	0	113.3
1454	I	31.5	Very low	29.8	Very low	137 Å²	137	134.2 Å²	134.2	70%	0.703	72%	0.718	S	S	*	*			trans	-125.1	166.9	-143.7	-60.6	160.9	0	0	0	117.9
1455	T	29.3	Very low	29.6	Very low	126 Å²	126	134.3 Å²	134.3	77%	0.773	72%	0.724	S	S	*	*			trans	104.2	110	148	12.3	0	0	0	0	126
1456	S	28.3	Very low	29.4	Very low	83 Å²	83	132.3 Å²	132.3	58%	0.58	73%	0.725	S	S	*	*			trans	42.8	120.4	131.4	70.2	0	0	0	0	128.4
1457	S	28.3	Very low	29.3	Very low	109 Å²	109	132.1 Å²	132.1	76%	0.762	73%	0.729	S	S	*	*				75.6	115	120.9	70.1	0	0	0	0	126.2
1458	N	27.4	Very low	29.1	Very low	156 Å²	156	136.3 Å²	136.3	83%	0.834	73%	0.73	S	S	*	*			trans	70.3	155.4	142.3	-118.7	35.4	0	0	0	119.9
1459	P	33.4	Very low	28.8	Very low	93 Å²	93	135.6 Å²	135.6	60%	0.604	73%	0.729	S	S	*	*				-127.2	167.1	-79.7	39.2	-26.5	0	0	0	115.6
1460	D	25.6	Very low	28.5	Very low	138 Å²	138	135.6 Å²	135.6	74%	0.738	73%	0.733	S	S	*	*			trans	70.6	117.7	153.3	-73.7	-19.2	0	0	0	122.8
1461	F	29.6	Very low	28.2	Very low	183 Å²	183	134 Å²	134	80%	0.803	73%	0.732	S	S	*	*			trans	57.9	85.1	153.8	-69	-85.8	0	0	0	121.2
1462	N	27.4	Very low	28.1	Very low	131 Å²	131	133.2 Å²	133.2	70%	0.701	74%	0.737	S	S	*	*				23.2	135.9	125.1	-67	-6.4	0	0	0	119.7
1463	H	29.4	Very low	27.8	Very low	146 Å²	146	135.9 Å²	135.9	68%	0.676	74%	0.742	S	S	*	*			cis	-166.3	144.5	13.3	-109.6	-41.4	0	0	0	111.4
1464	L	28.3	Very low	28.1	Very low	148 Å²	148	134.6 Å²	134.6	78%	0.775	74%	0.741	S	S	*	*			trans	64.2	143.8	151.5	-56.5	164.3	0	0	0	117
1465	T	26.4	Very low	27.9	Very low	129 Å²	129	133.3 Å²	133.3	79%	0.791	74%	0.74	S	S	*	*			cis	-162.7	167.2	15.1	-11.6	0	0	0	0	112.3
1466	S	25.3	Very low	27.7	Very low	95 Å²	95	137 Å²	137	66%	0.664	74%	0.739	S	S	*	*			trans	93.7	93.2	147.8	-156.9	0	0	0	0	121.9
1467	N	26.8	Very low	27.6	Very low	141 Å²	141	139.2 Å²	139.2	75%	0.754	74%	0.74	S	S	*	*				87.9	139	121.2	-71.1	-5	0	0	0	125.7
1468	Q	28.5	Very low	27.6	Very low	158 Å²	158	140.6 Å²	140.6	74%	0.738	74%	0.739	S	S	*	*			trans	79	109.9	152.9	-73.4	171.3	-1.6	0	0	118.4
1469	M	26.3	Very low	27.6	Very low	162 Å²	162	139.1 Å²	139.1	80%	0.798	74%	0.735	S	S	*	*				91.1	141.8	73.5	-80.9	-173.8	-179.3	0	0	111.4
1470	T	26.3	Very low	27.3	Very low	110 Å²	110	139.6 Å²	139.6	68%	0.675	74%	0.741	S	S	*	*			cis	-163.6	152.3	4.6	8.1	0	0	0	0	112.4
1471	T	24.1	Very low	27.5	Very low	125 Å²	125	138.8 Å²	138.8	77%	0.767	74%	0.743	S	S	*	*			trans	22.8	148.4	144.1	62.5	0	0	0	0	121.7
1472	S	26.8	Very low	27.8	Very low	110 Å²	110	137.5 Å²	137.5	77%	0.769	75%	0.745	S	S	*	*				-175	158.3	55.9	51.9	0	0	0	0	115.8
1473	Y	26.8	Very low	28.2	Very low	227 Å²	227	135.7 Å²	135.7	89%	0.89	74%	0.74	S	S	*	*			trans	-90	157.7	163.6	-77.1	-97	0	0	0	112.3
1474	P	34.3	Very low	28.1	Very low	119 Å²	119	137.8 Å²	137.8	77%	0.773	74%	0.744	S	S	*	*				-148.8	170.4	117.3	28.7	-8.5	0	0	0	115.1
1475	V	27.9	Very low	28.1	Very low	111 Å²	111	139 Å²	139	67%	0.673	74%	0.739	S	S	*	*			cis	-169.4	124.3	-37.8	117	0	0	0	0	110.6
1476	R	24.6	Very low	28.1	Very low	202 Å²	202	138 Å²	138	76%	0.762	73%	0.729	S	S	*	*			trans	62.6	176.5	153.4	-53.1	-179.6	-172.3	173.1	0.5	118.3
1477	H	26.7	Very low	28.1	Very low	130 Å²	130	140.1 Å²	140.1	60%	0.602	73%	0.733	S	S	*	*			cis	-161.6	152.6	21.4	-131.2	-43.6	0	0	0	114.9
1478	L	27.4	Very low	28.1	Very low	139 Å²	139	139.9 Å²	139.9	73%	0.728	74%	0.736	S	S	*	*			trans	71.2	148.8	157.5	-51.9	168	0	0	0	117.2
1479	T	27	Very low	28	Very low	124 Å²	124	139.2 Å²	139.2	76%	0.761	74%	0.737	S	S	*	*			cis	-161.9	154.2	-10.7	11.9	0	0	0	0	111.4
1480	S	27.9	Very low	27.8	Very low	104 Å²	104	137.6 Å²	137.6	73%	0.727	73%	0.732	S	S	*	*			trans	-104.3	169.7	143.9	66.9	0	0	0	0	109
1481	P	30.1	Very low	27.7	Very low	121 Å²	121	142.4 Å²	142.4	79%	0.786	74%	0.739	S	S	*	*				-152.4	173	87.4	40.1	-21.4	0	0	0	116.6
1482	N	34.5	Very low	28.3	Very low	155 Å²	155	141.7 Å²	141.7	83%	0.829	74%	0.737	S	S	*	*			trans	-109.7	152.2	165.9	-174.1	29	0	0	0	109.4
1483	P	36.5	Very low	28.2	Very low	94 Å²	94	145.1 Å²	145.1	61%	0.61	74%	0.743	S	S	*	*			trans	-135.6	122.4	175.5	35.8	-17.9	0	0	0	119.1
1484	Y	28.3	Very low	28.3	Very low	189 Å²	189	139.9 Å²	139.9	74%	0.741	73%	0.734	S	S	*	*			trans	64.4	158.1	141.9	-69.7	-110.8	0	0	0	118.8
1485	Y	28.1	Very low	27.7	Very low	175 Å²	175	144.1 Å²	144.1	69%	0.686	74%	0.735	S	S	*	*			cis	-173.7	169.2	-21.3	-112.1	-157.9	0	0	0	107.9
1486	N	25	Very low	27.5	Very low	106 Å²	106	146.6 Å²	146.6	57%	0.567	74%	0.739	S	S	*	*			cis	-171.1	157.6	-34.8	-109.8	19	0	0	0	111.4
1487	N	25.8	Very low	27.5	Very low	141 Å²	141	140.3 Å²	140.3	75%	0.754	74%	0.737	S	S	*	*			trans	72.6	156	149.7	-68	-7.7	0	0	0	124.7
1488	T	27.5	Very low	27.3	Very low	135 Å²	135	138.9 Å²	138.9	83%	0.828	74%	0.742	S	S	*	*			trans	112.6	143.4	141.8	-11.5	0	0	0	0	119.7
1489	L	25.2	Very low	27.2	Very low	144 Å²	144	138 Å²	138	75%	0.754	74%	0.742	S	S	*	*			trans	-104.3	171.8	-162.5	-63	79.8	0	0	0	115.4
1490	N	22.6	Very low	27	Very low	128 Å²	128	139.5 Å²	139.5	68%	0.684	74%	0.741	S	S	*	*			trans	92.6	111.4	144.9	-67.3	-24.1	0	0	0	121.7
1491	Y	24.2	Very low	26.8	Very low	211 Å²	211	138.2 Å²	138.2	83%	0.827	73%	0.725	S	S	*	*				29.8	153.9	124.5	-66.9	-79.9	0	0	0	122
1492	P	36.1	Very low	26.7	Very low	111 Å²	111	134.6 Å²	134.6	72%	0.721	71%	0.71	S	S	*	*			cis	-142.7	176.2	-48.1	38.3	-20	0	0	0	113.7
1493	M	26.6	Very low	26.3	Very low	182 Å²	182	131.5 Å²	131.5	90%	0.897	69%	0.693	S	S	*	*			trans	-153.1	158.1	161.1	-121.2	180	-175.7	0	0	116.8
1494	T	27.9	Very low	25.7	Very low	116 Å²	116	127.3 Å²	127.3	71%	0.712	67%	0.665	S	S	*	*			trans	-25.3	140.2	172.8	47.9	0	0	0	0	118.4
1495	R	21.8	Very low	25.6	Very low	208 Å²	208	118.3 Å²	118.3	79%	0.785	63%	0.63	S	S	*	*			cis	98.2	119.7	26.5	-165.5	-163.9	-151.9	-137.2	15.5	115
1496	H	24	Very low	25.4	Very low	163 Å²	163	110 Å²	110	76%	0.755	60%	0.597	S	S	*	*			trans	113	137.2	163.3	-77.3	-74.1	0	0	0	118.6
1497	G	24.5	Very low	25.5	Very low	70 Å²	70	106.8 Å²	106.8	72%	0.722	58%	0.584	S	S	*	*			trans	87.5	126.1	166.4	0	0	0	0	0	115.7
1498	S	22.4	Very low	25.4	Very low	101 Å²	101	100.8 Å²	100.8	71%	0.706	55%	0.553	S	S	*	*			cis	143	140.5	-16.6	56.5	0	0	0	0	108
1499	T	24.6	Very low	26.2	Very low	120 Å²	120	94.4 Å²	94.4	74%	0.736	51%	0.514	S	S	*	.			trans	62.7	144.8	167.6	58.5	0	0	0	0	117.6
1500	E	24	Very low	26.4	Very low	155 Å²	155	87.9 Å²	87.9	72%	0.724	48%	0.48	S	S	*	.			cis	-159.6	145.1	-9.8	-114.3	175.9	173	0	0	112.5
1501	L	23.6	Very low	26.7	Very low	77 Å²	77	85.5 Å²	85.5	40%	0.403	47%	0.47	S	S	.	.			trans	59.5	79.3	144.3	-58.4	155.9	0	0	0	123.1
1502	G	26.6	Very low	26.8	Very low	46 Å²	46	78 Å²	78	47%	0.474	45%	0.445	S	S	.	.			trans	99.6	163.1	146	0	0	0	0	0	120.1	P545	P545-G1502 WeakPolarHBondContact CD-O 3.1Å; P545-G1502 VanDerWaalsContact CG-C 3.47Å; P545-G1502 WeakPolarHBondContact CG-O 2.97Å
1503	I	26.6	Very low	26.5	Very low	90 Å²	90	81.2 Å²	81.2	46%	0.462	45%	0.45	S	S	.	.			cis	68	0	-9	-99.4	161.7	0	0	0	117.1	L533 Q535 L585	L533-I1503 WeakPolarHBondContact CD1-O 3.02Å; L533-I1503 VanDerWaalsContact CG-O 3.28Å; L533-I1503 WeakPolarHBondContact CG-O 3.34Å; Q535-I1503 VanDerWaalsContact NE2-CA 3.28Å; L585-I1503 HydrophobicContact CD1-CG2 3.77Å; L585-I1503 HydrophobicContact CD2-CG2 4.43Å; L585-I1503 HydrophobicContact CG-CG2 4.49Å
1504	V	24.8	Very low	26.6	Very low	5 Å²	5	77.1 Å²	77.1	3%	0.03	43%	0.431	C	S	.	.				0	0	0	133.1	0	0	0	0	119.2	L533 Q535 Y581 I582 D583 L585 R597	L533-V1504 HydrophobicContact CB-CB 3.99Å; L533-V1504 HydrophobicContact CB-CG1 3.35Å; L533-V1504 HydrophobicContact CD1-CB 3.98Å; L533-V1504 HydrophobicContact CD1-CG1 4.15Å; L533-V1504 HydrophobicContact CD2-CG1 4.5Å; L533-V1504 HydrophobicContact CG-CB 3.7Å; L533-V1504 HydrophobicContact CG-CG1 3.31Å; L533-V1504 HydrophobicContact CG-CG2 4.44Å; Q535-V1504 VanDerWaalsContact CD-O 3.23Å; Q535-V1504 WeakPolarHBondContact CG-O 3.25Å; Q535-V1504 PolarHBondContact OE1-O 3.33Å; Q535-V1504 VanDerWaalsContact OE1-O 3.04Å; Y581-V1504 CarbonylContact C-O 3.58Å; I582-V1504 VanDerWaalsContact C-CA 3.46Å; I582-V1504 VanDerWaalsContact C-CB 3.49Å; I582-V1504 CarbonylContact C-O 3.6Å; I582-V1504 WeakPolarHBondContact CA-O 3.21Å; I582-V1504 PolarHBondContact N-O 2.89Å; I582-V1504 WeakPolarHBondContact O-CG1 3.27Å; D583-V1504 VanDerWaalsContact CA-CG1 3.45Å; D583-V1504 HydrophobicContact CB-CB 3.4Å; D583-V1504 HydrophobicContact CB-CG1 4.14Å; D583-V1504 HydrophobicContact CB-CG2 3.37Å; D583-V1504 WeakPolarHBondContact O-CG1 3.36Å; D583-V1504 WeakPolarHBondContact O-CG2 3.33Å; D583-V1504 VanDerWaalsContact OD2-CA 3.24Å; D583-V1504 WeakPolarHBondContact OD2-CA 3.32Å; L585-V1504 HydrophobicContact CD1-CG2 3.96Å; L585-V1504 HydrophobicContact CD2-CG2 3.62Å; L585-V1504 HydrophobicContact CG-CG2 3.42Å; L585-V1504 VanDerWaalsContact CG-CG2 3.42Å; R597-V1504 PolarHBondContact NH2-O 2.68Å
1505	Y	25	Very low	26.5	Very low	0 Å²	0	78.3 Å²	78.3	0%	0	42%	0.423	C	S	.	.				0	149.7	0	-109.1	-86.7	0	0	0	126	I487 C519 W532 I582 D583 C584 S596 R597 V598	I487-Y1505 HydrophobicContact CB-CD1 4.48Å; I487-Y1505 HydrophobicContact CB-CE1 4.21Å; I487-Y1505 HydrophobicContact CD1-CD1 3.6Å; I487-Y1505 HydrophobicContact CD1-CE1 3.54Å; I487-Y1505 HydrophobicContact CG1-CD1 4.16Å; I487-Y1505 HydrophobicContact CG1-CE1 3.69Å; I487-Y1505 HydrophobicContact CG2-CD1 3.7Å; I487-Y1505 HydrophobicContact CG2-CE1 3.45Å; I487-Y1505 VanDerWaalsContact CG2-CE1 3.45Å; C519-Y1505 HydrophobicContact CB-CE1 4.09Å; C519-Y1505 WeakPolarHBondContact CB-OH 3.41Å; W532-Y1505 HydrophobicContact CB-CE2 3.9Å; W532-Y1505 AromaticContact CD2-CD2 3.96Å; W532-Y1505 HydrophobicContact CD2-CD2 3.96Å; W532-Y1505 AromaticContact CD2-CE2 3.07Å; W532-Y1505 HydrophobicContact CD2-CE2 3.07Å; W532-Y1505 AromaticContact CD2-CZ 3.39Å; W532-Y1505 VanDerWaalsContact CD2-OH 3.25Å; W532-Y1505 AromaticContact CE2-CE2 3.83Å; W532-Y1505 AromaticContact CE2-CZ 3.63Å; W532-Y1505 HydrophobicContact CE3-CD1 4.5Å; W532-Y1505 AromaticContact CE3-CD2 3.25Å; W532-Y1505 HydrophobicContact CE3-CD2 3.25Å; W532-Y1505 AromaticContact CE3-CE1 3.96Å; W532-Y1505 HydrophobicContact CE3-CE1 3.96Å; W532-Y1505 AromaticContact CE3-CE2 2.79Å; W532-Y1505 HydrophobicContact CE3-CE2 2.79Å; W532-Y1505 HydrophobicContact CE3-CG 4.26Å; W532-Y1505 AromaticContact CE3-CZ 3.18Å; W532-Y1505 HydrophobicContact CG-CD2 4.46Å; W532-Y1505 AromaticContact CG-CE2 3.53Å; W532-Y1505 HydrophobicContact CG-CE2 3.53Å; W532-Y1505 AromaticContact CH2-CE1 3.7Å; W532-Y1505 HydrophobicContact CH2-CE1 3.7Å; W532-Y1505 AromaticContact CH2-CE2 3.98Å; W532-Y1505 HydrophobicContact CH2-CE2 3.98Å; W532-Y1505 AromaticContact CH2-CZ 3.39Å; W532-Y1505 VanDerWaalsContact CH2-OH 3.31Å; W532-Y1505 WeakPolarHBondContact CH2-OH 3.32Å; W532-Y1505 HydrophobicContact CZ2-CE1 4.35Å; W532-Y1505 HydrophobicContact CZ2-CE2 4.25Å; W532-Y1505 AromaticContact CZ2-CZ 3.67Å; W532-Y1505 WeakPolarHBondContact CZ2-OH 3.39Å; W532-Y1505 HydrophobicContact CZ3-CD1 4.09Å; W532-Y1505 AromaticContact CZ3-CD2 3.63Å; W532-Y1505 HydrophobicContact CZ3-CD2 3.63Å; W532-Y1505 AromaticContact CZ3-CE1 3.47Å; W532-Y1505 HydrophobicContact CZ3-CE1 3.47Å; W532-Y1505 VanDerWaalsContact CZ3-CE1 3.47Å; W532-Y1505 AromaticContact CZ3-CE2 3.26Å; W532-Y1505 HydrophobicContact CZ3-CE2 3.26Å; W532-Y1505 HydrophobicContact CZ3-CG 4.22Å; W532-Y1505 AromaticContact CZ3-CZ 3.13Å; I582-Y1505 VanDerWaalsContact C-CG 3.47Å; I582-Y1505 VanDerWaalsContact CA-CA 3.47Å; I582-Y1505 VanDerWaalsContact CB-CB 3.41Å; I582-Y1505 HydrophobicContact CB-CD2 4.18Å; I582-Y1505 HydrophobicContact CB-CG 4.19Å; I582-Y1505 HydrophobicContact CD1-CG 4.28Å; I582-Y1505 HydrophobicContact CG1-CG 4.31Å; I582-Y1505 PolarHBondContact N-O 2.82Å; I582-Y1505 WeakPolarHBondContact O-CD2 3.47Å; D583-Y1505 HydrophobicContact CB-CG 4.4Å; D583-Y1505 VanDerWaalsContact CB-N 3.27Å; D583-Y1505 VanDerWaalsContact O-CE2 3.26Å; D583-Y1505 WeakPolarHBondContact O-CE2 3.37Å; D583-Y1505 WeakPolarHBondContact OD1-CA 3.35Å; D583-Y1505 PolarHBondContact OD1-N 2.97Å; C584-Y1505 WeakPolarHBondContact CA-OH 3.39Å; C584-Y1505 HydrophobicContact CB-CD1 4.05Å; C584-Y1505 HydrophobicContact CB-CE1 3.31Å; C584-Y1505 HydrophobicContact CB-CE2 4.16Å; C584-Y1505 WeakPolarHBondContact CB-OH 3.41Å; C584-Y1505 VanDerWaalsContact N-CD2 3.32Å; C584-Y1505 PolarHBondContact SG-OH 2.78Å; S596-Y1505 CarbonylContact O-C 3.52Å; S596-Y1505 VanDerWaalsContact O-CA 3.23Å; S596-Y1505 WeakPolarHBondContact O-CA 3.33Å; R597-Y1505 CarbonylContact C-O 3.54Å; R597-Y1505 VanDerWaalsContact C-O 3.29Å; R597-Y1505 WeakPolarHBondContact CA-O 3.46Å; V598-Y1505 VanDerWaalsContact CA-O 3.23Å; V598-Y1505 WeakPolarHBondContact CA-O 3.28Å; V598-Y1505 WeakPolarHBondContact CB-O 3.17Å; V598-Y1505 VanDerWaalsContact CG2-O 3.28Å; V598-Y1505 WeakPolarHBondContact CG2-O 3.18Å; V598-Y1505 PolarHBondContact N-O 2.99Å
1506	S	25	Very low	26.8	Very low	0 Å²	0	74.3 Å²	74.3	0%	0	41%	0.412	C	S	.	.			trans	79.1	114.6	161.2	3.3	0	0	0	0	124.7	K505 S596 R597 V598	K505-S1506 WeakPolarHBondContact CB-O 3.31Å; K505-S1506 WeakPolarHBondContact CG-O 3.13Å; K505-S1506 PolarHBondContact N-O 2.92Å; S596-S1506 VanDerWaalsContact C-CA 3.43Å; S596-S1506 PolarHBondContact O-N 3.39Å; R597-S1506 VanDerWaalsContact C-C 3.41Å; R597-S1506 CarbonylContact C-O 3.54Å; R597-S1506 VanDerWaalsContact CA-N 3.28Å; R597-S1506 WeakPolarHBondContact CA-O 3.29Å; R597-S1506 VanDerWaalsContact N-N 3.16Å; R597-S1506 PolarHBondContact N-O 2.04Å; R597-S1506 VanDerWaalsContact N-O 3.15Å; V598-S1506 WeakPolarHBondContact CG2-O 3.48Å; V598-S1506 WeakPolarHBondContact CG2-OG 3.45Å; V598-S1506 PolarHBondContact N-O 3.03Å; V598-S1506 VanDerWaalsContact N-O 3.13Å
1507	S	26.1	Very low	26.8	Very low	40 Å²	40	73.5 Å²	73.5	28%	0.28	41%	0.409	S	S	.	.			trans	-35	-113.7	-161.9	57.7	0	0	0	0	122.1	H503 E504 K505 S596	H503-S1507 CarbonylContact C-O 3.36Å; E504-S1507 CarbonylContact C-O 3.47Å; E504-S1507 WeakPolarHBondContact CA-O 3.36Å; E504-S1507 PolarHBondContact N-O 2.87Å; K505-S1507 PolarHBondContact N-O 3.27Å; K505-S1507 PolarHBondContact NZ-OG 3.22Å; S596-S1507 VanDerWaalsContact CB-N 3.27Å; S596-S1507 VanDerWaalsContact OG-CA 3.31Å; S596-S1507 WeakPolarHBondContact OG-CA 3.33Å; S596-S1507 WeakPolarHBondContact OG-CB 3.3Å; S596-S1507 PolarHBondContact OG-N 3.16Å
1508	A	25.1	Very low	27	Very low	14 Å²	14	76.9 Å²	76.9	12%	0.116	41%	0.406	C	S	.	.	S	Bend	trans	-102.3	99.9	-158.5	0	0	0	0	0	117.2	D496 H503 K505	D496-A1508 VanDerWaalsContact OD1-C 3.28Å; D496-A1508 VanDerWaalsContact OD1-CB 3.24Å; D496-A1508 WeakPolarHBondContact OD1-CB 3.46Å; D496-A1508 VanDerWaalsContact OD1-O 3.06Å; D496-A1508 WeakPolarHBondContact OD2-CB 3.15Å; D496-A1508 VanDerWaalsContact OD2-O 3.08Å; H503-A1508 HydrophobicContact CB-CB 3.64Å; K505-A1508 WeakPolarHBondContact CD-O 3.34Å; K505-A1508 WeakPolarHBondContact CE-O 3.21Å
1509	N	42.6	Very low	27.2	Very low	2 Å²	2	74.1 Å²	74.1	1%	0.011	39%	0.393	C	S	.	.			trans	50.4	-177.1	160.7	-30.1	-80.7	0	0	0	125.6	D495 D496 D497 H498 R502 H503 E504 K505	D495-N1509 CarbonylContact C-O 3.59Å; D495-N1509 PolarHBondContact N-O 3.29Å; D495-N1509 CarbonylContact O-C 3.57Å; D496-N1509 VanDerWaalsContact CA-CB 3.49Å; D496-N1509 HydrophobicContact CB-CB 4.48Å; D496-N1509 VanDerWaalsContact N-C 3.33Å; D496-N1509 PolarHBondContact N-O 3.1Å; D496-N1509 PolarHBondContact OD1-ND2 2.69Å; D497-N1509 VanDerWaalsContact C-CG 3.42Å; D497-N1509 HydrophobicContact CB-CB 3.84Å; D497-N1509 WeakPolarHBondContact O-CB 3.4Å; D497-N1509 PolarHBondContact O-OD1 3.5Å; H498-N1509 PolarHBondContact ND1-ND2 3.23Å; R502-N1509 PolarHBondContact O-OD1 3.07Å; H503-N1509 VanDerWaalsContact CA-ND2 3.27Å; H503-N1509 WeakPolarHBondContact CA-ND2 3.35Å; H503-N1509 VanDerWaalsContact CA-OD1 3.27Å; H503-N1509 WeakPolarHBondContact CA-OD1 3.35Å; H503-N1509 WeakPolarHBondContact CB-ND2 2.98Å; H503-N1509 PolarHBondContact ND1-ND2 2.88Å; H503-N1509 VanDerWaalsContact ND1-ND2 3.19Å; E504-N1509 VanDerWaalsContact C-CA 3.48Å; E504-N1509 VanDerWaalsContact N-CG 3.25Å; E504-N1509 PolarHBondContact N-OD1 2.88Å; E504-N1509 WeakPolarHBondContact O-CA 3.38Å; E504-N1509 PolarHBondContact O-N 3.43Å; K505-N1509 WeakPolarHBondContact CA-O 3.43Å
1510	P	29.7	Very low	27.3	Very low	6 Å²	6	72.2 Å²	72.2	4%	0.039	39%	0.385	C	S	.	.			trans	-113.5	114.4	146.8	-29.9	45.3	0	0	0	125	D495 D496 D497 V506 Y508	D495-P1510 VanDerWaalsContact C-CA 3.48Å; D495-P1510 VanDerWaalsContact CB-CA 3.46Å; D495-P1510 HydrophobicContact CB-CB 3.77Å; D495-P1510 HydrophobicContact CB-CG 4.39Å; D496-P1510 VanDerWaalsContact N-C 3.26Å; D497-P1510 VanDerWaalsContact CA-O 3.25Å; D497-P1510 WeakPolarHBondContact CA-O 3.46Å; D497-P1510 HydrophobicContact CB-CB 4.39Å; D497-P1510 WeakPolarHBondContact CB-O 3Å; D497-P1510 PolarHBondContact N-O 2.93Å; V506-P1510 VanDerWaalsContact C-CG 3.5Å; V506-P1510 HydrophobicContact CB-CG 3.58Å; V506-P1510 HydrophobicContact CG2-CG 4.19Å; V506-P1510 VanDerWaalsContact O-CD 3.24Å; V506-P1510 WeakPolarHBondContact O-CD 3.28Å; V506-P1510 WeakPolarHBondContact O-CG 3.39Å; Y508-P1510 HydrophobicContact CD2-CB 3.74Å; Y508-P1510 HydrophobicContact CD2-CG 4.13Å; Y508-P1510 HydrophobicContact CE1-CB 4.49Å; Y508-P1510 HydrophobicContact CE2-CB 3.31Å; Y508-P1510 HydrophobicContact CE2-CG 4.03Å; Y508-P1510 HydrophobicContact CG-CB 4.49Å; Y508-P1510 HydrophobicContact CG-CG 4.44Å
1511	V	29.5	Very low	27.4	Very low	79 Å²	79	71 Å²	71	48%	0.479	38%	0.382	S	S	.	.			trans	-90.5	-160	-177.9	80.9	0	0	0	0	106.3	D495 D496	D495-V1511 HydrophobicContact CB-CG1 4.23Å; D496-V1511 VanDerWaalsContact C-CA 3.49Å; D496-V1511 VanDerWaalsContact C-CB 3.47Å; D496-V1511 HydrophobicContact CB-CB 3.81Å; D496-V1511 HydrophobicContact CB-CG1 4.21Å; D496-V1511 HydrophobicContact CB-CG2 4.48Å; D496-V1511 VanDerWaalsContact O-CB 3.27Å; D496-V1511 WeakPolarHBondContact O-CB 3.37Å; D496-V1511 WeakPolarHBondContact O-CG2 3.26Å
1512	N	27.1	Very low	27.4	Very low	54 Å²	54	72.1 Å²	72.1	29%	0.289	38%	0.384	S	S	.	.			trans	75	150.8	-176.5	-43.4	-79.1	0	0	0	109.1	D495 L1514 R1515	D495-N1512 VanDerWaalsContact CB-ND2 3.33Å; D495-N1512 WeakPolarHBondContact CB-ND2 3.14Å; D495-N1512 PolarHBondContact OD1-ND2 2.72Å; D495-N1512 PolarHBondContact OD2-ND2 3.09Å; N1512-L1514 HydrophobicContact CB-CD2 3.72Å; N1512-L1514 HydrophobicContact CB-CG 4.13Å; N1512-R1515 PolarHBondContact ND2-NH1 3.36Å; N1512-R1515 VanDerWaalsContact OD1-CD 3.29Å; N1512-R1515 WeakPolarHBondContact OD1-CD 3.31Å; N1512-R1515 PolarHBondContact OD1-NH1 2.88Å
1513	Q	28.7	Very low	27.4	Very low	178 Å²	178	78.1 Å²	78.1	83%	0.832	40%	0.399	S	S	*	.	S	Bend	cis	-134.3	152.3	37.8	-61	-148.9	-18.4	0	0	114
1514	L	29.6	Very low	27.4	Very low	96 Å²	96	77.9 Å²	77.9	50%	0.503	41%	0.405	S	S	.	.			cis	-158.9	150.9	-22.5	-92.3	171.1	0	0	0	102.9	N1512	N1512-L1514 HydrophobicContact CB-CD2 3.72Å; N1512-L1514 HydrophobicContact CB-CG 4.13Å
1515	R	24.6	Very low	27.5	Very low	140 Å²	140	82.8 Å²	82.8	53%	0.528	44%	0.436	S	S	.	.			cis	76.1	148	35.3	-166.9	-173.2	173.7	-169.3	-5	113.2	D495 N1512	D495-R1515 IonicContact OD1-NH1 2.7Å; D495-R1515 PolarHBondContact OD1-NH1 2.73Å; N1512-R1515 PolarHBondContact ND2-NH1 3.36Å; N1512-R1515 VanDerWaalsContact OD1-CD 3.29Å; N1512-R1515 WeakPolarHBondContact OD1-CD 3.31Å; N1512-R1515 PolarHBondContact OD1-NH1 2.88Å
1516	H	27.6	Very low	27.6	Very low	124 Å²	124	92.4 Å²	92.4	57%	0.574	47%	0.472	S	S	*	.			trans	77.5	129.3	179.3	-54.3	-57.8	0	0	0	116.2
1517	E	24.7	Very low	27.7	Very low	146 Å²	146	101.4 Å²	101.4	68%	0.682	51%	0.507	S	S	*	.			cis	85.9	118.4	27.7	-61.6	176.8	124.4	0	0	115.9
1518	H	28.7	Very low	27.8	Very low	142 Å²	142	102.4 Å²	102.4	66%	0.657	52%	0.524	S	S	*	.			trans	-157.3	142	146.9	-88.5	-74	0	0	0	108.8	N1738	H1518-N1738 CarbonylContact O-C 3.52Å; H1518-N1738 VanDerWaalsContact O-CA 3.29Å; H1518-N1738 WeakPolarHBondContact O-CA 3.48Å
1519	G	26.7	Very low	27.8	Very low	43 Å²	43	109.1 Å²	109.1	44%	0.443	55%	0.553	S	S	.	*			cis	137	86.7	-18.3	0	0	0	0	0	117.1
1520	S	26.8	Very low	27.1	Very low	80 Å²	80	116.4 Å²	116.4	56%	0.559	59%	0.586	S	S	*	*			trans	67	170.6	146.8	-133.9	0	0	0	0	118.6
1521	I	26.3	Very low	26.8	Very low	129 Å²	129	121.6 Å²	121.6	66%	0.662	62%	0.618	S	S	*	*			cis	-123	-109.6	1.8	-35.8	168.1	0	0	0	112.3
1522	K	23.7	Very low	26.9	Very low	101 Å²	101	122.8 Å²	122.8	44%	0.439	63%	0.628	S	S	.	*			cis	-164.1	120.2	-3.7	-141.4	138.9	-174.6	160.3	0	112.4	L1734 Y1735	K1522-L1734 PolarHBondContact NZ-O 2.89Å; K1522-Y1735 PolarHBondContact NZ-O 3.03Å
1523	H	25.6	Very low	26.7	Very low	172 Å²	172	132.1 Å²	132.1	80%	0.796	66%	0.659	S	S	*	*			trans	66.2	162.6	167.3	-68.7	-68.8	0	0	0	121.8
1524	S	27.6	Very low	26.6	Very low	85 Å²	85	132.6 Å²	132.6	59%	0.594	66%	0.661	S	S	*	*				-169.9	-156.5	-60.6	49.2	0	0	0	0	108.3
1525	T	27	Very low	26.4	Very low	108 Å²	108	134.1 Å²	134.1	66%	0.663	68%	0.676	S	S	*	*			cis	-173.6	163	16.2	-19.5	0	0	0	0	111.6
1526	R	26.3	Very low	26.4	Very low	202 Å²	202	134.5 Å²	134.5	76%	0.762	69%	0.689	S	S	*	*			trans	71.9	152.3	161.4	-60.9	173.7	-171.3	-147.5	1.3	117.9
1527	Y	27.5	Very low	26.2	Very low	189 Å²	189	137.5 Å²	137.5	74%	0.741	70%	0.703	S	S	*	*			cis	-159.5	158.5	-17.5	-100.3	-47.8	0	0	0	106
1528	G	28.1	Very low	26.1	Very low	61 Å²	61	135.5 Å²	135.5	63%	0.629	71%	0.706	S	S	*	*			cis	156.5	139.2	-8.1	0	0	0	0	0	113.4
1529	Q	26.1	Very low	25.7	Very low	155 Å²	155	139.3 Å²	139.3	72%	0.724	71%	0.714	S	S	*	*			trans	72.7	153.1	151	-66.3	170.9	-25.8	0	0	119.2
1530	H	27.8	Very low	25.5	Very low	154 Å²	154	145.7 Å²	145.7	71%	0.713	73%	0.726	S	S	*	*			cis	-148	170.9	-3.9	-121.3	-44.7	0	0	0	114.1
1531	T	22.8	Very low	25.4	Very low	115 Å²	115	150.7 Å²	150.7	71%	0.706	73%	0.734	S	S	*	*			trans	-99.4	-170.3	-174.7	46.1	0	0	0	0	112.4
1532	P	31.6	Very low	25.4	Very low	105 Å²	105	147.7 Å²	147.7	68%	0.682	74%	0.735	S	S	*	*				-137.4	170.2	-50.7	37.7	-21.7	0	0	0	114.3
1533	R	23.9	Very low	25.3	Very low	250 Å²	250	148.3 Å²	148.3	94%	0.943	75%	0.747	S	S	*	*			trans	169.3	163.3	134.2	-96.5	169.2	173.9	167.5	-1.2	114.9
1534	Q	24.8	Very low	25.4	Very low	187 Å²	187	147.5 Å²	147.5	87%	0.874	75%	0.748	S	S	*	*			trans	-85.9	177.7	174.5	-67.8	174.8	-45.7	0	0	111.3
1535	P	27	Very low	25.4	Very low	128 Å²	128	151 Å²	151	83%	0.831	76%	0.755	S	S	*	*			cis	-142.7	-156.4	18.9	45.1	-23.5	0	0	0	116.7
1536	N	24	Very low	25.3	Very low	148 Å²	148	152.5 Å²	152.5	79%	0.791	76%	0.759	S	S	*	*			trans	-72.7	160.4	-178.6	-84.4	-30.6	0	0	0	115.6
1537	Q	22.6	Very low	25.3	Very low	187 Å²	187	149.4 Å²	149.4	87%	0.874	76%	0.757	S	S	*	*			trans	68.2	148.5	165.7	-68.8	175.1	6.3	0	0	116.2
1538	S	22.3	Very low	25.1	Very low	105 Å²	105	145.2 Å²	145.2	73%	0.734	76%	0.755	S	S	*	*			cis	-165.1	-177.2	-16.8	60.2	0	0	0	0	111.4
1539	R	20.7	Very low	25	Very low	222 Å²	222	147 Å²	147	84%	0.838	76%	0.758	S	S	*	*			trans	-18.7	156.3	158.9	-78.8	-179.2	171	172.8	-1.3	118.4
1540	Y	22.8	Very low	25	Very low	176 Å²	176	148.6 Å²	148.6	69%	0.69	76%	0.759	S	S	*	*			cis	171.7	172.6	-20.4	-135.7	-83.9	0	0	0	108.2
1541	Y	24.6	Very low	24.8	Very low	185 Å²	185	151 Å²	151	73%	0.725	76%	0.762	S	S	*	*			trans	77.9	153.6	149.8	-74.7	-54.5	0	0	0	123.1	T1543	Y1541-T1543 HydrophobicContact CD1-CG2 4.43Å
1542	G	25.9	Very low	24.8	Very low	66 Å²	66	154.8 Å²	154.8	68%	0.68	77%	0.768	S	S	*	*			trans	165.3	27.3	176.2	0	0	0	0	0	113.7
1543	T	23.3	Very low	24.5	Very low	114 Å²	114	157.3 Å²	157.3	70%	0.699	78%	0.775	S	S	*	*				68.9	113.8	108.7	56.8	0	0	0	0	118.1	Y1541	Y1541-T1543 HydrophobicContact CD1-CG2 4.43Å
1544	L	26.6	Very low	24.5	Very low	156 Å²	156	150.9 Å²	150.9	82%	0.817	76%	0.763	S	S	*	*			trans	-169.8	131	136.6	-104.6	165.1	0	0	0	111.7
1545	Q	26.9	Very low	24.4	Very low	159 Å²	159	148.9 Å²	148.9	74%	0.743	76%	0.759	S	S	*	*			trans	60.7	116	159.8	-66.1	-179.2	14.2	0	0	119.2
1546	N	25.4	Very low	24.3	Very low	139 Å²	139	149.5 Å²	149.5	74%	0.743	76%	0.755	S	S	*	*				82.5	141.8	95.5	-72.7	-16.8	0	0	0	114.2
1547	L	25.7	Very low	24.3	Very low	136 Å²	136	150.4 Å²	150.4	71%	0.712	75%	0.754	S	S	*	*			cis	-152.5	150.7	8.7	-159.1	79.5	0	0	0	111.2
1548	S	24.6	Very low	24.4	Very low	102 Å²	102	149.3 Å²	149.3	71%	0.713	75%	0.747	S	S	*	*			trans	59.8	153.2	153.7	44.3	0	0	0	0	120.9
1549	S	25.5	Very low	24.5	Very low	99 Å²	99	150.6 Å²	150.6	69%	0.692	74%	0.744	S	S	*	*			cis	-169.3	151	-16.8	47.5	0	0	0	0	112.5
1550	Y	26.2	Very low	24.8	Very low	187 Å²	187	147.3 Å²	147.3	73%	0.733	74%	0.742	S	S	*	*			trans	55.1	118.7	144.3	-82	-115.9	0	0	0	121
1551	R	24.5	Very low	25	Very low	205 Å²	205	145 Å²	145	77%	0.774	74%	0.741	S	S	*	*				66.2	106.5	91	-76.8	-162.8	-174.8	173.3	1.9	117.2
1552	K	22.1	Very low	25.3	Very low	194 Å²	194	142.6 Å²	142.6	84%	0.843	74%	0.741	S	S	*	*				29.5	110.2	109	-159.4	-173.5	-170.3	-179.2	0	117.2
1553	I	25.5	Very low	25.3	Very low	159 Å²	159	147.4 Å²	147.4	82%	0.815	74%	0.743	S	S	*	*			trans	168.3	144.3	130.4	-86.3	156.9	0	0	0	111.2
1554	T	23	Very low	25.3	Very low	115 Å²	115	149 Å²	149	71%	0.706	74%	0.744	S	S	*	*			trans	-57	143.4	-173.3	55.5	0	0	0	0	118.5
1555	N	23.7	Very low	25.2	Very low	145 Å²	145	148.9 Å²	148.9	78%	0.775	74%	0.737	S	S	*	*				174.3	168.4	106.8	-99	13.4	0	0	0	113.7
1556	D	23.9	Very low	25.1	Very low	140 Å²	140	146.9 Å²	146.9	75%	0.749	73%	0.732	S	S	*	*			trans	-56.6	156.2	-177.1	-43.2	-70.2	0	0	0	114.2
1557	Q	24.4	Very low	25	Very low	167 Å²	167	146.3 Å²	146.3	78%	0.78	74%	0.737	S	S	*	*				-174.1	152.8	79.5	-90.7	-168.7	-29.2	0	0	113.8
1558	F	24.8	Very low	25	Very low	164 Å²	164	144.1 Å²	144.1	72%	0.719	74%	0.738	S	S	*	*			trans	59.4	121.2	148.7	-78.6	-119.1	0	0	0	118.5
1559	I	23.8	Very low	25	Very low	133 Å²	133	146.7 Å²	146.7	68%	0.682	74%	0.739	S	S	*	*				74.1	144	72.3	-68.1	169.6	0	0	0	112
1560	I	27.5	Very low	25.2	Very low	153 Å²	153	149.1 Å²	149.1	79%	0.785	74%	0.744	S	S	*	*			trans	81.5	126.8	-162	-51.5	167.3	0	0	0	109.6
1561	D	28.2	Very low	25.3	Very low	127 Å²	127	147 Å²	147	68%	0.679	74%	0.741	S	S	*	*			cis	-140.6	-179.5	12.8	-138.9	-32.7	0	0	0	114.7
1562	N	30	Very low	25.3	Very low	134 Å²	134	143 Å²	143	72%	0.717	74%	0.739	S	S	*	*			trans	-43.5	137.5	170.3	-66.4	-77.9	0	0	0	113.2
1563	K	25.2	Very low	25.7	Very low	168 Å²	168	140.7 Å²	140.7	73%	0.73	74%	0.735	S	S	*	*			cis	71	110.8	47	-154.5	-173	-174.2	-178.1	0	114.3
1564	M	23.9	Very low	25.9	Very low	147 Å²	147	140.2 Å²	140.2	72%	0.724	73%	0.732	S	S	*	*			trans	75.4	135.1	150.2	-86.3	176.3	167.9	0	0	118
1565	K	25.3	Very low	26.1	Very low	154 Å²	154	139.5 Å²	139.5	67%	0.67	73%	0.732	S	S	*	*				63.2	148.2	90	-86.3	171.3	138	-70.2	0	112.7
1566	D	23.6	Very low	26.3	Very low	117 Å²	117	137 Å²	137	63%	0.626	73%	0.726	S	S	*	*			cis	-158	-157	20.4	-115.6	-32.4	0	0	0	110.2
1567	C	24.3	Very low	26.6	Very low	126 Å²	126	136.9 Å²	136.9	85%	0.851	73%	0.73	S	S	*	*			trans	102.3	151.5	154.3	-62.5	0	0	0	0	118.5
1568	A	24.9	Very low	26.8	Very low	90 Å²	90	133.1 Å²	133.1	74%	0.744	73%	0.727	S	S	*	*			cis	-171.7	175	-25.7	0	0	0	0	0	107.4
1569	Q	26	Very low	26.8	Very low	157 Å²	157	130 Å²	130	73%	0.734	73%	0.726	S	S	*	*			cis	-155.7	161.3	-1.6	-157.1	-147.6	71	0	0	108.9
1570	L	28.1	Very low	27	Very low	150 Å²	150	130.2 Å²	130.2	79%	0.785	73%	0.727	S	S	*	*			trans	-146.9	95.7	153.6	-112.6	168.8	0	0	0	110.7
1571	Q	28.8	Very low	26.9	Very low	142 Å²	142	129 Å²	129	66%	0.664	72%	0.722	S	S	*	*			trans	38.8	137.1	130.9	-59	-177.2	-27.1	0	0	120.1
1572	T	25.5	Very low	26.7	Very low	122 Å²	122	129.1 Å²	129.1	75%	0.748	72%	0.723	S	S	*	*			cis	-167.2	179.5	-1.6	14.2	0	0	0	0	110.1
1573	I	29.1	Very low	26.4	Very low	145 Å²	145	127.7 Å²	127.7	74%	0.744	72%	0.723	S	S	*	*			trans	104	111.1	159.6	-57.4	-178.2	0	0	0	118
1574	I	29.3	Very low	26.3	Very low	148 Å²	148	125.6 Å²	125.6	76%	0.759	72%	0.724	S	S	*	*			trans	58.9	100.4	149.2	-64.4	172.8	0	0	0	117.7
1575	S	27.7	Very low	26.1	Very low	101 Å²	101	124.4 Å²	124.4	71%	0.706	73%	0.726	S	S	*	*				77.9	141.8	72.3	76.7	0	0	0	0	115.5
1576	S	29	Very low	25.9	Very low	92 Å²	92	122.9 Å²	122.9	64%	0.643	73%	0.729	S	S	*	*			cis	-175.7	160.9	-1	41.5	0	0	0	0	112.7
1577	T	28.9	Very low	25.8	Very low	138 Å²	138	124 Å²	124	85%	0.847	74%	0.735	S	S	*	*			trans	62.2	164.3	156.3	47.3	0	0	0	0	118.8
1578	A	29.8	Very low	25.9	Very low	87 Å²	87	123.3 Å²	123.3	72%	0.719	73%	0.731	S	S	*	*			cis	179.1	164.5	-26.7	0	0	0	0	0	108.5
1579	S	24.4	Very low	25.9	Very low	98 Å²	98	126.3 Å²	126.3	69%	0.685	74%	0.735	S	S	*	*			cis	-177.5	169.8	-27.2	59.7	0	0	0	0	111.1
1580	I	26.8	Very low	25.9	Very low	139 Å²	139	123.6 Å²	123.6	71%	0.713	73%	0.733	S	S	*	*			trans	82.4	112.9	149.6	-77	167.2	0	0	0	121
1581	N	25.2	Very low	25.8	Very low	126 Å²	126	124.5 Å²	124.5	67%	0.674	74%	0.737	S	S	*	*			trans	80.8	121.9	135.2	-63.7	11	0	0	0	126.5
1582	N	25.4	Very low	25.6	Very low	131 Å²	131	120.6 Å²	120.6	70%	0.701	73%	0.734	S	S	*	*				77.7	95.4	123.9	-64.1	8.8	0	0	0	124.2
1583	S	23.2	Very low	25.5	Very low	103 Å²	103	122.4 Å²	122.4	72%	0.72	74%	0.739	S	S	*	*				71.4	150.5	112.5	74	0	0	0	0	123.8
1584	V	22.2	Very low	25.2	Very low	124 Å²	124	120.9 Å²	120.9	75%	0.752	74%	0.736	S	S	*	*			trans	89.2	100.4	160.3	-172.9	0	0	0	0	118.4
1585	T	21	Very low	25	Very low	123 Å²	123	121.4 Å²	121.4	76%	0.755	74%	0.739	S	S	*	*			trans	19.7	146.8	142.9	63.7	0	0	0	0	124.1
1586	V	21.6	Very low	25	Very low	121 Å²	121	122 Å²	122	73%	0.733	74%	0.738	S	S	*	*			trans	126.9	114.9	141.3	177.2	0	0	0	0	115.9
1587	D	21.4	Very low	24.7	Very low	142 Å²	142	124.8 Å²	124.8	76%	0.759	75%	0.746	S	S	*	*			trans	45	144	145.5	-57.2	-8	0	0	0	126.8
1588	S	24.5	Very low	24.7	Very low	110 Å²	110	125.1 Å²	125.1	77%	0.769	74%	0.742	S	S	*	*			trans	82.2	98	138	64.1	0	0	0	0	121.7
1589	N	25.8	Very low	24.4	Very low	154 Å²	154	125.7 Å²	125.7	82%	0.824	74%	0.741	S	S	*	*				32.8	135.3	119.1	-74.6	-6.6	0	0	0	122.3
1590	S	25.4	Very low	24.5	Very low	99 Å²	99	128.4 Å²	128.4	69%	0.692	75%	0.746	S	S	*	*				92.7	121.7	128.5	68.1	0	0	0	0	122
1591	I	26.3	Very low	24.3	Very low	170 Å²	170	128.2 Å²	128.2	87%	0.872	75%	0.747	S	S	*	*			trans	71.9	134.3	147	-59.8	159.8	0	0	0	116
1592	G	24.1	Very low	24.2	Very low	59 Å²	59	126.6 Å²	126.6	61%	0.608	75%	0.746	S	S	*	*			cis	169.7	-143.4	0.5	0	0	0	0	0	111.1
1593	L	24.7	Very low	24.2	Very low	161 Å²	161	125 Å²	125	84%	0.843	75%	0.745	S	S	*	*			trans	84.4	130.5	178.7	-57.1	176.6	0	0	0	116.3
1594	T	21.9	Very low	24.4	Very low	112 Å²	112	125.9 Å²	125.9	69%	0.687	75%	0.745	S	S	*	*			cis	-169.2	174	-21.2	6.6	0	0	0	0	111
1595	I	25.9	Very low	24.6	Very low	159 Å²	159	127.9 Å²	127.9	82%	0.815	75%	0.746	S	S	*	*			trans	58.5	144.3	165.9	28.6	167.6	0	0	0	117.9
1596	V	27.8	Very low	24.9	Very low	114 Å²	114	127.8 Å²	127.8	69%	0.691	74%	0.741	S	S	*	*			cis	-127.9	144.2	1.1	-172.9	0	0	0	0	109.7	N1598	V1596-N1598 HydrophobicContact CG1-CB 4.26Å
1597	N	23.2	Very low	25.2	Very low	151 Å²	151	128.3 Å²	128.3	81%	0.807	74%	0.744	S	S	*	*			trans	-114.3	127.2	157.1	-174.4	20.6	0	0	0	107.5
1598	N	27.5	Very low	25.4	Very low	144 Å²	144	127 Å²	127	77%	0.77	74%	0.741	S	S	*	*			trans	-154.2	125.5	171.4	-116.4	0.9	0	0	0	111	V1596	V1596-N1598 HydrophobicContact CG1-CB 4.26Å
1599	S	24.9	Very low	26	Very low	100 Å²	100	126.5 Å²	126.5	70%	0.699	74%	0.735	S	S	*	*			trans	-91.8	-157.2	167.4	52.1	0	0	0	0	109.9
1600	I	26.3	Very low	26	Very low	154 Å²	154	124.8 Å²	124.8	79%	0.79	73%	0.726	S	S	*	*			trans	86.2	136.3	168.5	-58.3	168.9	0	0	0	115.5
1601	D	21.7	Very low	25.9	Very low	135 Å²	135	127.7 Å²	127.7	72%	0.722	73%	0.729	S	S	*	*			cis	-171.8	162.2	-29.8	-159.8	-2.9	0	0	0	108.9
1602	S	23.3	Very low	25.9	Very low	93 Å²	93	125.4 Å²	125.4	65%	0.65	72%	0.723	S	S	*	*			trans	69.7	161.5	148	88.7	0	0	0	0	118.2
1603	S	24.5	Very low	25.8	Very low	98 Å²	98	126.4 Å²	126.4	69%	0.685	73%	0.726	S	S	*	*			cis	-172.1	-164.1	-25.8	55.1	0	0	0	0	110.7
1604	V	28.4	Very low	25.9	Very low	120 Å²	120	125.9 Å²	125.9	73%	0.727	72%	0.724	S	S	*	*			trans	87.4	90	172.1	-169.3	0	0	0	0	114
1605	H	26.2	Very low	25.9	Very low	166 Å²	166	125.7 Å²	125.7	77%	0.769	73%	0.727	S	S	*	*				65.4	132.6	85.5	-76.5	-73.4	0	0	0	114.3
1606	N	27	Very low	25.7	Very low	122 Å²	122	122.6 Å²	122.6	65%	0.652	72%	0.719	S	S	*	*			cis	-137.4	-155.9	13.1	-133.1	2.8	0	0	0	111
1607	V	28.4	Very low	25.5	Very low	131 Å²	131	122.5 Å²	122.5	79%	0.794	72%	0.719	S	S	*	*			cis	-147.6	-177.8	21.7	-140.6	0	0	0	0	111.7
1608	V	26.1	Very low	25.5	Very low	115 Å²	115	123.5 Å²	123.5	70%	0.697	72%	0.719	S	S	*	*			trans	-156.6	168	-160.4	177.2	0	0	0	0	108
1609	P	36.5	Very low	25.5	Very low	100 Å²	100	123.6 Å²	123.6	65%	0.649	72%	0.718	S	S	*	*			cis	-125.7	178.1	-27.8	33.1	-15.1	0	0	0	114.9
1610	N	26.8	Very low	25.4	Very low	118 Å²	118	125.9 Å²	125.9	63%	0.631	72%	0.721	S	S	*	*				163.6	135.1	118	-93.9	-15.3	0	0	0	113.2
1611	Q	23.4	Very low	25.2	Very low	159 Å²	159	123 Å²	123	74%	0.743	72%	0.715	S	S	*	*				59	136.9	98.7	-58.9	179.9	6.9	0	0	114.5
1612	T	26	Very low	25.5	Very low	123 Å²	123	123.5 Å²	123.5	76%	0.755	72%	0.723	S	S	*	*			cis	-158.6	143.7	10.8	1.5	0	0	0	0	108.6
1613	A	22	Very low	25.7	Very low	80 Å²	80	122.4 Å²	122.4	66%	0.661	73%	0.726	S	S	*	*				70.8	154.2	103.9	0	0	0	0	0	118.6
1614	D	26.4	Very low	25.8	Very low	150 Å²	150	123.7 Å²	123.7	80%	0.802	73%	0.725	S	S	*	*			trans	65.7	131.3	173.1	-56.2	-24.2	0	0	0	117.4
1615	S	22.3	Very low	25.8	Very low	108 Å²	108	122.6 Å²	122.6	76%	0.755	73%	0.729	S	S	*	*				75.3	138.9	64.9	115.5	0	0	0	0	113.1
1616	S	22	Very low	25.8	Very low	94 Å²	94	118.5 Å²	118.5	66%	0.657	72%	0.724	S	S	*	*			cis	-162.9	167.6	8.5	49.5	0	0	0	0	113.1
1617	T	23.5	Very low	25.8	Very low	111 Å²	111	122.6 Å²	122.6	68%	0.681	74%	0.736	S	S	*	*			trans	39.8	128.2	147.5	52.5	0	0	0	0	123.9
1618	E	22	Very low	25.8	Very low	173 Å²	173	120.4 Å²	120.4	81%	0.808	73%	0.727	S	S	*	*			trans	69.3	161.7	137.2	-64.9	-179.4	-176.7	0	0	118.5
1619	I	27.3	Very low	26	Very low	146 Å²	146	123 Å²	123	75%	0.749	73%	0.731	S	S	*	*			cis	-145	-176.9	11.2	-140	152.6	0	0	0	113.2
1620	L	23.4	Very low	25.5	Very low	147 Å²	147	123.1 Å²	123.1	77%	0.77	73%	0.725	S	S	*	*			trans	-62.4	140	-166.3	-75	145.1	0	0	0	121.1
1621	S	23.3	Very low	25.4	Very low	93 Å²	93	125.8 Å²	125.8	65%	0.65	73%	0.731	S	S	*	*				86.9	140.3	123.4	71.9	0	0	0	0	125.1
1622	T	27.8	Very low	25.6	Very low	146 Å²	146	128.1 Å²	128.1	90%	0.896	73%	0.733	S	S	*	*			trans	61.9	146.6	156.6	50.8	0	0	0	0	119.8
1623	G	25.8	Very low	25.5	Very low	70 Å²	70	129 Å²	129	72%	0.722	73%	0.727	S	S	*	*			cis	179.4	136.8	-6.7	0	0	0	0	0	112.8
1624	L	28	Very low	25.8	Very low	125 Å²	125	128.5 Å²	128.5	65%	0.654	72%	0.718	S	S	*	*			trans	15.5	121.7	172.9	-78.6	79.2	0	0	0	121.6
1625	A	28	Very low	25.8	Very low	98 Å²	98	128 Å²	128	81%	0.81	71%	0.711	S	S	*	*				55.7	156.6	122.4	0	0	0	0	0	120.8
1626	A	26.7	Very low	26.2	Very low	80 Å²	80	131.3 Å²	131.3	66%	0.661	71%	0.712	S	S	*	*			cis	-156	-176	15.1	0	0	0	0	0	113.2
1627	F	26.7	Very low	26.6	Very low	207 Å²	207	132.2 Å²	132.2	91%	0.908	71%	0.71	S	S	*	*			trans	77.5	150.7	166	-79.9	-77.9	0	0	0	120.3
1628	S	28.9	Very low	26.9	Very low	86 Å²	86	132.7 Å²	132.7	60%	0.601	71%	0.708	S	S	*	*			trans	-122.1	161.2	-168.4	57.8	0	0	0	0	110.9
1629	Q	29.3	Very low	27.4	Very low	170 Å²	170	131.5 Å²	131.5	79%	0.794	71%	0.707	S	S	*	*				-165.9	133.2	126.1	-79.3	-125.8	9.7	0	0	107.3
1630	I	26.8	Very low	27.6	Very low	102 Å²	102	130.7 Å²	130.7	52%	0.523	70%	0.703	S	S	.	*			cis	94.6	118.2	43.9	-73.4	170.8	0	0	0	112.5
1631	K	24.4	Very low	27.8	Very low	174 Å²	174	129.1 Å²	129.1	76%	0.757	70%	0.704	S	S	*	*			trans	66.5	168	165.6	-68.6	160.2	-167.4	165.2	0	114.5
1632	R	27.2	Very low	27.9	Very low	208 Å²	208	131 Å²	131	79%	0.785	70%	0.703	S	S	*	*			cis	-127.8	146.2	10.2	-109.1	108	-170.5	-83.4	7.2	109.3
1633	K	23.8	Very low	27.7	Very low	142 Å²	142	132.7 Å²	132.7	62%	0.617	69%	0.693	S	S	*	*				62.4	148.2	79.3	-91.8	-176.7	128.7	-80.9	0	113.8	E1635	K1633-E1635 VanDerWaalsContact NZ-CD 3.26Å; K1633-E1635 IonicContact NZ-OE1 3.14Å; K1633-E1635 PolarHBondContact NZ-OE1 2.89Å; K1633-E1635 IonicContact NZ-OE2 2.87Å; K1633-E1635 PolarHBondContact NZ-OE2 3.04Å; K1633-E1635 VanDerWaalsContact NZ-OE2 3.15Å
1634	S	28	Very low	27.9	Very low	69 Å²	69	135.1 Å²	135.1	48%	0.483	69%	0.689	S	S	.	*			cis	174.4	178	-16.4	44.2	0	0	0	0	111.2
1635	E	26.2	Very low	28	Very low	139 Å²	139	135.1 Å²	135.1	65%	0.65	69%	0.69	S	S	*	*			trans	79.3	165.1	150.6	-72.6	136.5	-166.3	0	0	119.3	K1633	K1633-E1635 VanDerWaalsContact NZ-CD 3.26Å; K1633-E1635 IonicContact NZ-OE1 3.14Å; K1633-E1635 PolarHBondContact NZ-OE1 2.89Å; K1633-E1635 IonicContact NZ-OE2 2.87Å; K1633-E1635 PolarHBondContact NZ-OE2 3.04Å; K1633-E1635 VanDerWaalsContact NZ-OE2 3.15Å
1636	F	31.1	Very low	28	Very low	178 Å²	178	136.1 Å²	136.1	78%	0.781	68%	0.681	S	S	*	*			trans	76.2	124.4	178.8	-67.9	-96.7	0	0	0	117.7
1637	N	30.8	Very low	28.2	Very low	113 Å²	113	138.8 Å²	138.8	60%	0.604	69%	0.689	S	S	*	*			cis	-160.1	148	-11.8	-137.8	21.7	0	0	0	116.5
1638	N	28.8	Very low	28.2	Very low	120 Å²	120	135.3 Å²	135.3	64%	0.642	68%	0.68	S	S	*	*			trans	27.2	125.2	146.1	-61	-7.2	0	0	0	123
1639	N	33.5	Very low	28.2	Very low	149 Å²	149	134.1 Å²	134.1	80%	0.797	68%	0.682	S	S	*	*			trans	157.7	153.5	131.4	-82.3	-12.4	0	0	0	110.3
1640	I	32.5	Very low	28.1	Very low	129 Å²	129	133.5 Å²	133.5	66%	0.662	68%	0.677	S	S	*	*			cis	-159.6	144.2	-15.3	-113.2	165.7	0	0	0	108.7
1641	S	27.3	Very low	28.3	Very low	114 Å²	114	136 Å²	136	80%	0.797	68%	0.684	S	S	*	*			trans	58.8	-151.4	161	76.6	0	0	0	0	119.4
1642	E	23.6	Very low	28.3	Very low	131 Å²	131	133.7 Å²	133.7	61%	0.612	68%	0.68	S	S	*	*	S	Bend	trans	-72.9	168.1	-170.2	-47.2	177.5	127.3	0	0	114.1
1643	R	25.5	Very low	28.6	Very low	183 Å²	183	128.8 Å²	128.8	69%	0.691	67%	0.673	S	S	*	*			trans	64.3	135.3	136.5	-83.6	173.4	-178.8	134	1.9	121
1644	N	28.2	Very low	28.9	Very low	120 Å²	120	128.1 Å²	128.1	64%	0.642	68%	0.676	S	S	*	*				74.7	114.7	129.9	-64.7	3.4	0	0	0	122
1645	N	30.1	Very low	29.1	Very low	125 Å²	125	130.4 Å²	130.4	67%	0.668	68%	0.683	S	S	*	*				92.9	119.9	116.3	-67.5	2.3	0	0	0	122.7
1646	L	28.3	Very low	29.4	Very low	120 Å²	120	130.5 Å²	130.5	63%	0.628	69%	0.687	S	S	*	*				45.2	141.1	125.8	-74	106.3	0	0	0	121.5
1647	T	30.8	Very low	29.7	Very low	136 Å²	136	128.1 Å²	128.1	83%	0.834	69%	0.689	S	S	*	*	S	Bend		-100.8	148.9	120	48.3	0	0	0	0	110.4
1648	N	27.2	Very low	29.6	Very low	133 Å²	133	125.9 Å²	125.9	71%	0.711	69%	0.693	S	S	*	*			trans	-64.2	154.4	-172.2	-55	-60.8	0	0	0	113.1	F1650	N1648-F1650 HydrophobicContact CB-CD2 4.17Å; N1648-F1650 HydrophobicContact CB-CE2 4.45Å
1649	G	29	Very low	29.7	Very low	62 Å²	62	129.6 Å²	129.6	64%	0.639	71%	0.706	S	S	*	*			cis	-176.5	-171.7	4.5	0	0	0	0	0	111.8
1650	F	27.8	Very low	29.4	Very low	157 Å²	157	129.8 Å²	129.8	69%	0.689	71%	0.707	S	S	*	*			cis	-162.8	129.5	-1.1	-143.2	-120.6	0	0	0	109.6	N1648	N1648-F1650 HydrophobicContact CB-CD2 4.17Å; N1648-F1650 HydrophobicContact CB-CE2 4.45Å
1651	F	29.7	Very low	29.8	Very low	153 Å²	153	128.6 Å²	128.6	67%	0.671	71%	0.71	S	S	*	*			trans	69.2	124.7	161.4	-78.7	-120	0	0	0	117.8
1652	N	25.4	Very low	30.1	Very low	126 Å²	126	128.9 Å²	128.9	67%	0.674	71%	0.709	S	S	*	*				79.7	144.6	66.5	-66.4	-31	0	0	0	112.2
1653	T	32.4	Very low	30.2	Very low	106 Å²	106	130.1 Å²	130.1	65%	0.65	72%	0.719	S	S	*	*			cis	-154.3	145.4	40.5	48.7	0	0	0	0	115.6
1654	N	31.2	Very low	30.1	Very low	127 Å²	127	127.3 Å²	127.3	68%	0.679	72%	0.722	S	S	*	*			trans	66.7	146.9	134.1	-59.5	7.9	0	0	0	120.4
1655	N	31.8	Very low	29.8	Very low	118 Å²	118	125.8 Å²	125.8	63%	0.631	72%	0.72	S	S	*	*			cis	-164.3	142.4	-2.1	-111.8	-3.6	0	0	0	114
1656	I	33.6	Very low	29.6	Very low	141 Å²	141	127.3 Å²	127.3	72%	0.723	73%	0.727	S	S	*	*			trans	64.4	129.3	137	-62.7	167.3	0	0	0	119.8
1657	P	35.8	Very low	29.4	Very low	127 Å²	127	126.9 Å²	126.9	83%	0.825	73%	0.725	S	S	*	*			cis	-110.3	-154.7	-20.1	39.6	-23.1	0	0	0	110.3
1658	G	30	Very low	29.3	Very low	66 Å²	66	126.4 Å²	126.4	68%	0.68	72%	0.722	S	S	*	*			cis	115.3	143.4	0.7	0	0	0	0	0	113.3
1659	E	30.2	Very low	29.1	Very low	199 Å²	199	125.6 Å²	125.6	93%	0.93	72%	0.722	S	S	*	*			cis	-162.7	168.9	-1.7	-159.5	155.4	-125	0	0	112.9
1660	N	27.6	Very low	29.1	Very low	152 Å²	152	126.4 Å²	126.4	81%	0.813	72%	0.718	S	S	*	*			trans	-134.8	155	-171.3	-109.4	-28.4	0	0	0	114.1
1661	S	40.2	Very low	29.1	Very low	104 Å²	104	127.5 Å²	127.5	73%	0.727	72%	0.723	S	S	*	*			trans	-0.3	142.3	164.2	57.4	0	0	0	0	121.9
1662	P	32.9	Very low	29.2	Very low	120 Å²	120	125.5 Å²	125.5	78%	0.779	73%	0.725	S	S	*	*				-147.2	152.4	119	37.9	-23	0	0	0	117.9
1663	I	26.5	Very low	29.1	Very low	157 Å²	157	126.7 Å²	126.7	81%	0.805	73%	0.731	S	S	*	*			trans	21.4	130.1	138	-59	178.8	0	0	0	120.3
1664	V	23.2	Very low	28.7	Very low	125 Å²	125	129.1 Å²	129.1	76%	0.758	74%	0.735	S	S	*	*			trans	87	97.8	156.2	164.1	0	0	0	0	120.4
1665	S	22.7	Very low	28.4	Very low	87 Å²	87	130.8 Å²	130.8	61%	0.608	74%	0.736	S	S	*	*			trans	66.2	134.3	130.8	82.6	0	0	0	0	124.1
1666	I	25.1	Very low	28	Very low	157 Å²	157	131.9 Å²	131.9	81%	0.805	74%	0.742	S	S	*	*			trans	66.8	125.8	142.1	-64.6	163.1	0	0	0	115.3
1667	N	24.4	Very low	27.5	Very low	111 Å²	111	129.1 Å²	129.1	59%	0.594	74%	0.736	S	S	*	*			cis	-145.5	-164.6	0.4	-147.4	-2.8	0	0	0	106.5
1668	V	27.9	Very low	27	Very low	126 Å²	126	131.3 Å²	131.3	76%	0.764	74%	0.735	S	S	*	*	S	Bend	cis	-144.1	148.7	13	-177.9	0	0	0	0	105.2
1669	T	24.2	Very low	26.7	Very low	116 Å²	116	133.1 Å²	133.1	71%	0.712	74%	0.737	S	S	*	*	S	Bend	cis	-110.6	132.5	10.9	47.6	0	0	0	0	113.6
1670	S	27.8	Very low	26.5	Very low	79 Å²	79	131 Å²	131	55%	0.552	73%	0.729	S	S	*	*			trans	22.1	145.1	136.4	58.5	0	0	0	0	121.5
1671	F	28.4	Very low	26.3	Very low	181 Å²	181	131.4 Å²	131.4	79%	0.794	73%	0.726	S	S	*	*			cis	-173.5	148.4	-11.2	-108.7	-61.9	0	0	0	106.1
1672	P	32.2	Very low	25.7	Very low	111 Å²	111	135.2 Å²	135.2	72%	0.721	74%	0.737	S	S	*	*			trans	-90.4	120.5	152	32.7	-26.6	0	0	0	109.7
1673	D	23.5	Very low	25.4	Very low	151 Å²	151	132.4 Å²	132.4	81%	0.807	73%	0.73	S	S	*	*			trans	-174	131.9	135.8	-105.8	-24.9	0	0	0	113.5
1674	H	23.7	Very low	25.4	Very low	157 Å²	157	130.3 Å²	130.3	73%	0.727	73%	0.73	S	S	*	*				47.9	143.4	128.3	-114.9	-1	0	0	0	123.9
1675	F	24.9	Very low	25.7	Very low	161 Å²	161	130.6 Å²	130.6	71%	0.706	73%	0.727	S	S	*	*			trans	74.3	129.8	164.8	-74.9	-81.3	0	0	0	120.8
1676	N	23.3	Very low	26	Very low	141 Å²	141	133.1 Å²	133.1	75%	0.754	73%	0.733	S	S	*	*			trans	35.1	146.4	130.6	-69.4	8.9	0	0	0	121.7
1677	S	22.9	Very low	26	Very low	84 Å²	84	130.5 Å²	130.5	59%	0.587	72%	0.724	S	S	*	*			cis	-178.6	153.3	-8.7	48.9	0	0	0	0	110.5
1678	Q	24.4	Very low	26.2	Very low	172 Å²	172	130.9 Å²	130.9	80%	0.804	73%	0.731	S	S	*	*			trans	61.4	135.6	156.5	-68.2	173.3	-30.2	0	0	120
1679	S	24.6	Very low	26.2	Very low	105 Å²	105	133.5 Å²	133.5	73%	0.734	73%	0.732	S	S	*	*			trans	66.6	153	143.9	65.6	0	0	0	0	119.5
1680	M	25.2	Very low	26.2	Very low	154 Å²	154	132.8 Å²	132.8	76%	0.759	73%	0.732	S	S	*	*			cis	-153.9	144	-11.4	-119	156.5	69.3	0	0	111.7
1681	E	23.6	Very low	26.2	Very low	160 Å²	160	138.9 Å²	138.9	75%	0.748	74%	0.744	S	S	*	*			trans	28.2	122.4	137.6	-59.4	179	136.8	0	0	122.6
1682	L	28.2	Very low	26.3	Very low	185 Å²	185	135.8 Å²	135.8	97%	0.969	75%	0.745	S	S	*	*			trans	-169.4	150.4	130.1	-124	70.3	0	0	0	107
1683	G	26.9	Very low	26.3	Very low	61 Å²	61	134.9 Å²	134.9	63%	0.629	75%	0.747	S	S	*	*			cis	165.3	105.9	-7.8	0	0	0	0	0	111.4
1684	S	25.6	Very low	26.8	Very low	113 Å²	113	133 Å²	133	79%	0.79	74%	0.743	S	S	*	*			trans	53.5	164.2	159.2	79.6	0	0	0	0	119.3
1685	D	29.7	Very low	27.1	Very low	130 Å²	130	135.6 Å²	135.6	70%	0.695	75%	0.752	S	S	*	*			cis	-142.1	158.8	30.8	-85.9	-27.5	0	0	0	115.9
1686	L	28.4	Very low	27.2	Very low	141 Å²	141	134.5 Å²	134.5	74%	0.738	75%	0.754	S	S	*	*			trans	16.9	147.2	141.7	-67.8	88	0	0	0	121.6
1687	T	26.2	Very low	27.5	Very low	102 Å²	102	136.9 Å²	136.9	63%	0.626	75%	0.753	S	S	*	*			cis	-163.1	168.8	-3.7	14.3	0	0	0	0	111.7
1688	T	28.2	Very low	27.7	Very low	119 Å²	119	139.5 Å²	139.5	73%	0.73	76%	0.761	S	S	*	*			trans	127.4	-168.2	152.6	67.4	0	0	0	0	115.5
1689	F	28	Very low	27.9	Very low	181 Å²	181	139.2 Å²	139.2	79%	0.794	76%	0.763	S	S	*	*			trans	-158.2	160.3	-140.5	-54.1	-58.6	0	0	0	109
1690	S	25.2	Very low	27.9	Very low	101 Å²	101	137.7 Å²	137.7	71%	0.706	76%	0.764	S	S	*	*			cis	-169.4	-167.4	-6.7	47.7	0	0	0	0	106.4
1691	Y	28.1	Very low	28.7	Very low	207 Å²	207	135.7 Å²	135.7	81%	0.812	76%	0.762	S	S	*	*			cis	-156.5	145.3	8.5	-145.1	-71.2	0	0	0	107.6
1692	S	30.1	Very low	28.8	Very low	115 Å²	115	133 Å²	133	80%	0.804	76%	0.761	S	S	*	*			trans	62.9	156	172.9	74.6	0	0	0	0	118.2
1693	A	30.8	Very low	28.7	Very low	92 Å²	92	129.4 Å²	129.4	76%	0.76	75%	0.751	S	S	*	*			cis	-161.9	132.8	-34	0	0	0	0	0	108.2
1694	P	35.2	Very low	28.6	Very low	111 Å²	111	132.9 Å²	132.9	72%	0.721	76%	0.76	S	S	*	*			trans	-105.6	159.4	-166.5	38.7	-35.2	0	0	0	116.1
1695	F	29.2	Very low	29	Very low	213 Å²	213	132.9 Å²	132.9	93%	0.934	76%	0.757	S	S	*	*			trans	-131.4	145.7	157.5	-94.5	-86.4	0	0	0	109.5
1696	N	28.5	Very low	28.8	Very low	137 Å²	137	134.2 Å²	134.2	73%	0.733	76%	0.762	S	S	*	*			trans	-131.9	163.2	-165	-92.3	16.1	0	0	0	111.8
1697	Y	28.7	Very low	28.6	Very low	191 Å²	191	133.4 Å²	133.4	75%	0.749	75%	0.753	S	S	*	*			cis	-168.1	178.5	-29.3	-136.4	-107.3	0	0	0	107.4
1698	N	27	Very low	28.7	Very low	140 Å²	140	136.1 Å²	136.1	75%	0.749	76%	0.763	S	S	*	*			trans	-40.4	164.3	-173.9	-54.1	-18.7	0	0	0	122.4
1699	I	28.3	Very low	28.7	Very low	166 Å²	166	135.6 Å²	135.6	85%	0.851	76%	0.764	S	S	*	*			trans	-57	158.3	166.2	-68.4	168.3	0	0	0	112.1
1700	G	25.6	Very low	28.7	Very low	72 Å²	72	135 Å²	135	74%	0.742	77%	0.769	S	S	*	*			cis	127.6	-167	17.3	0	0	0	0	0	109.5
1701	P	41.2	Very low	28.6	Very low	112 Å²	112	136.4 Å²	136.4	73%	0.727	77%	0.768	S	S	*	*			cis	-130.8	-174.6	-7.5	42.9	-26	0	0	0	115.3
1702	S	25.9	Very low	28.7	Very low	104 Å²	104	131.3 Å²	131.3	73%	0.727	76%	0.76	S	S	*	*			trans	55.3	125.7	157.7	59	0	0	0	0	120.3
1703	C	26.1	Very low	28.5	Very low	110 Å²	110	127.3 Å²	127.3	74%	0.743	73%	0.732	S	S	*	*				-177.4	150.8	64.2	-123.8	0	0	0	0	115.2
1704	T	24.7	Very low	28.4	Very low	134 Å²	134	125.3 Å²	125.3	82%	0.822	72%	0.716	S	S	*	*			trans	67.7	154.2	155.7	46.1	0	0	0	0	122.2
1705	P	33.1	Very low	28.1	Very low	112 Å²	112	125.1 Å²	125.1	73%	0.727	72%	0.717	S	S	*	*			trans	-133.6	179	-154.9	43.9	-27.5	0	0	0	116.8
1706	I	26.3	Very low	28.2	Very low	159 Å²	159	121.8 Å²	121.8	82%	0.815	71%	0.709	S	S	*	*			trans	-168.4	155.3	137.2	-103.7	160.1	0	0	0	112.9
1707	F	24.6	Very low	28.2	Very low	124 Å²	124	119.8 Å²	119.8	54%	0.544	71%	0.706	S	S	.	*			trans	-16.4	145.6	176.6	-72.8	-105	0	0	0	123	K717	K717-F1707 HydrophobicContact CG-CZ 4.38Å
1708	L	28.1	Very low	28.4	Very low	159 Å²	159	117.4 Å²	117.4	83%	0.832	71%	0.705	S	S	*	*			trans	47.4	162.2	137	-63.2	176.7	0	0	0	120.8
1709	S	28.2	Very low	28.5	Very low	107 Å²	107	117.1 Å²	117.1	75%	0.748	70%	0.703	S	S	*	*			trans	70.2	61.6	-179.4	-162	0	0	0	0	115.2	D1711	S1709-D1711 PolarHBondContact O-N 2.78Å
1710	L	27.9	Very low	28.5	Very low	170 Å²	170	116.7 Å²	116.7	89%	0.89	70%	0.699	S	S	*	*			trans	-83.4	84.6	156.9	-91.5	169.5	0	0	0	110
1711	D	24.1	Very low	28.7	Very low	129 Å²	129	117 Å²	117	69%	0.69	69%	0.69	S	S	*	*			trans	-164.8	97.7	147.9	-122.1	2.4	0	0	0	107.7	S1709 M1741	S1709-D1711 PolarHBondContact O-N 2.78Å; D1711-M1741 HydrophobicContact CB-CE 3.96Å; D1711-M1741 VanDerWaalsContact O-CE 3.32Å; D1711-M1741 WeakPolarHBondContact O-CE 3.36Å
1712	P	28.9	Very low	28.2	Very low	101 Å²	101	118.6 Å²	118.6	66%	0.656	69%	0.693	S	S	*	*			trans	-126.3	108.8	-171.7	36.3	-20.4	0	0	0	114.5
1713	S	26	Very low	28.4	Very low	30 Å²	30	118 Å²	118	21%	0.21	69%	0.688	C	S	.	*			trans	-172	161.7	153.1	47.5	0	0	0	0	109	E1740 M1741 S1742	S1713-E1740 VanDerWaalsContact CB-CD 3.48Å; S1713-E1740 WeakPolarHBondContact OG-CB 3.43Å; S1713-E1740 WeakPolarHBondContact OG-CG 3.21Å; S1713-M1741 WeakPolarHBondContact O-CG 3.37Å; S1713-M1741 WeakPolarHBondContact OG-CB 3.44Å; S1713-M1741 PolarHBondContact OG-SD 2.81Å; S1713-S1742 PolarHBondContact O-OG 2.78Å
1714	A	29.4	Very low	28.8	Very low	51 Å²	51	119.9 Å²	119.9	42%	0.421	69%	0.69	S	S	.	*			cis	-137	-161.1	10.9	0	0	0	0	0	112.6	E1740	A1714-E1740 HydrophobicContact CB-CB 4.07Å
1715	S	29	Very low	29	Very low	107 Å²	107	121.6 Å²	121.6	75%	0.748	69%	0.691	S	S	*	*			trans	84.9	140.2	163.3	91.4	0	0	0	0	117.1
1716	N	30.7	Very low	28.6	Very low	143 Å²	143	123 Å²	123	77%	0.765	69%	0.692	S	S	*	*			cis	-161.9	141.3	-10.5	-127.8	-14.1	0	0	0	116.3
1717	S	29.5	Very low	28.6	Very low	95 Å²	95	120.2 Å²	120.2	66%	0.664	69%	0.686	S	S	*	*			trans	65.4	163	138.1	76	0	0	0	0	119.3
1718	L	31.2	Very low	28.7	Very low	141 Å²	141	119.7 Å²	119.7	74%	0.738	69%	0.693	S	S	*	*			cis	-134.3	141.3	8.6	-78.3	168.7	0	0	0	109.1
1719	L	30.3	Very low	28.8	Very low	134 Å²	134	119.5 Å²	119.5	70%	0.702	69%	0.688	S	S	*	*				55.2	142.2	88.5	-58.3	-175.6	0	0	0	114.9
1720	M	28	Very low	28.7	Very low	156 Å²	156	119.7 Å²	119.7	77%	0.768	68%	0.681	S	S	*	*			cis	-165.3	167.9	12.1	-115.4	155.8	171.7	0	0	108
1721	S	28.7	Very low	28.8	Very low	79 Å²	79	116.9 Å²	116.9	55%	0.552	67%	0.666	S	S	*	*			cis	176.9	178.8	-22.7	54.7	0	0	0	0	111.1
1722	N	32.4	Very low	29	Very low	146 Å²	146	116.6 Å²	116.6	78%	0.781	67%	0.665	S	S	*	*			trans	80.7	153.7	151.3	-65.5	-19.7	0	0	0	121.9
1723	S	29.3	Very low	29	Very low	90 Å²	90	119.8 Å²	119.8	63%	0.629	67%	0.668	S	S	*	*			cis	-176.2	-175.2	-28.6	60.3	0	0	0	0	111.5
1724	L	33.6	Very low	29	Very low	150 Å²	150	123.5 Å²	123.5	79%	0.785	69%	0.685	S	S	*	*			trans	84.1	145.8	169.4	-59.8	166.3	0	0	0	117.3
1725	M	30.4	Very low	28.8	Very low	171 Å²	171	128.5 Å²	128.5	84%	0.842	69%	0.694	S	S	*	*			cis	-167.5	-173.5	-21.9	-140.3	176.8	-167.8	0	0	108.9
1726	N	25	Very low	28.5	Very low	140 Å²	140	129.1 Å²	129.1	75%	0.749	69%	0.685	S	S	*	*				-144.8	-175.7	-94.9	-170.5	17.3	0	0	0	110.3
1727	C	25.2	Very low	28.3	Very low	101 Å²	101	125.7 Å²	125.7	68%	0.682	67%	0.67	S	S	*	*			trans	78	141.6	172.1	-56.5	0	0	0	0	115.9
1728	T	27.5	Very low	28	Very low	114 Å²	114	125.5 Å²	125.5	70%	0.699	66%	0.661	S	S	*	*			cis	-163.1	150.5	-13.3	17.5	0	0	0	0	106.2
1729	Q	29.4	Very low	27.9	Very low	154 Å²	154	127.3 Å²	127.3	72%	0.72	66%	0.658	S	S	*	*			cis	-139.2	-155	1.7	-140.5	155.9	-111.6	0	0	106.2
1730	D	27.3	Very low	27.6	Very low	112 Å²	112	125.3 Å²	125.3	60%	0.599	65%	0.645	S	S	*	*			cis	-159.7	165.3	5.3	-126.7	-41.6	0	0	0	106.3
1731	N	28.6	Very low	27.5	Very low	111 Å²	111	121.9 Å²	121.9	59%	0.594	63%	0.628	S	S	*	*			cis	-143.4	-82.5	4.2	179.2	-108.5	0	0	0	111.6
1732	N	28.5	Very low	27.4	Very low	122 Å²	122	122.3 Å²	122.3	65%	0.652	63%	0.631	S	S	*	*			trans	-122.9	121.3	-179.7	-76.3	-56.7	0	0	0	110
1733	K	28.9	Very low	27.1	Very low	169 Å²	169	121.5 Å²	121.5	74%	0.735	63%	0.631	S	S	*	*			cis	95.3	139.1	46.2	-82.8	-174.7	-179.7	178.3	0	112.3
1734	L	25.3	Very low	27	Very low	107 Å²	107	123 Å²	123	56%	0.56	64%	0.636	S	S	*	*			cis	-161.8	154.6	-27	-147.7	73.6	0	0	0	108.7	K1522	K1522-L1734 PolarHBondContact NZ-O 2.89Å
1735	Y	25.9	Very low	26.9	Very low	156 Å²	156	120.8 Å²	120.8	61%	0.612	63%	0.631	S	S	*	*			trans	50.4	151.9	146.3	-68.9	-177.8	0	0	0	121.9	K1522	K1522-Y1735 PolarHBondContact NZ-O 3.03Å
1736	E	23.4	Very low	26.7	Very low	120 Å²	120	119.3 Å²	119.3	56%	0.561	63%	0.626	S	S	*	*			cis	86.4	146.1	30.9	-68.7	-173.9	134.4	0	0	115.1
1737	V	25.4	Very low	26.8	Very low	72 Å²	72	118.8 Å²	118.8	44%	0.436	62%	0.621	S	S	.	*			cis	-171.4	149.1	-26.4	77.5	0	0	0	0	110.1
1738	N	24.1	Very low	27.1	Very low	90 Å²	90	119 Å²	119	48%	0.481	61%	0.614	S	S	.	*			trans	61.3	163.9	157.5	-69.6	-14.4	0	0	0	119.6	H1518	H1518-N1738 CarbonylContact O-C 3.52Å; H1518-N1738 VanDerWaalsContact O-CA 3.29Å; H1518-N1738 WeakPolarHBondContact O-CA 3.48Å
1739	R	27.8	Very low	27	Very low	180 Å²	180	118.7 Å²	118.7	68%	0.679	60%	0.604	S	S	*	*			cis	-164.3	157.4	-9.1	-114.7	174.5	172.5	-134.5	-4.4	111.6
1740	E	25.1	Very low	27.3	Very low	92 Å²	92	114.1 Å²	114.1	43%	0.43	59%	0.589	S	S	.	*			trans	68.1	92.4	139.2	-64.2	171.1	178	0	0	125.3	S1713 A1714	S1713-E1740 VanDerWaalsContact CB-CD 3.48Å; S1713-E1740 WeakPolarHBondContact OG-CB 3.43Å; S1713-E1740 WeakPolarHBondContact OG-CG 3.21Å; A1714-E1740 HydrophobicContact CB-CB 4.07Å
1741	M	26.8	Very low	27.7	Very low	84 Å²	84	109 Å²	109	41%	0.414	56%	0.562	S	S	.	*				76.9	124.7	102.9	-166.3	163.9	168.7	0	0	126.7	D1711 S1713	D1711-M1741 HydrophobicContact CB-CE 3.96Å; D1711-M1741 VanDerWaalsContact O-CE 3.32Å; D1711-M1741 WeakPolarHBondContact O-CE 3.36Å; S1713-M1741 WeakPolarHBondContact O-CG 3.37Å; S1713-M1741 WeakPolarHBondContact OG-CB 3.44Å; S1713-M1741 PolarHBondContact OG-SD 2.81Å
1742	S	25.4	Very low	27.7	Very low	88 Å²	88	106 Å²	106	62%	0.615	55%	0.548	S	S	*	.			trans	71.2	153.6	152.3	79.9	0	0	0	0	119.7	S1713	S1713-S1742 PolarHBondContact O-OG 2.78Å
1743	V	27	Very low	28.1	Very low	129 Å²	129	103.5 Å²	103.5	78%	0.782	54%	0.538	S	S	*	.			cis	-134.5	167.9	10.6	179.9	0	0	0	0	111.5
1744	T	26.2	Very low	28.1	Very low	120 Å²	120	101.6 Å²	101.6	74%	0.736	54%	0.541	S	S	*	.			trans	-82.7	-169.2	180	54.2	0	0	0	0	114
1745	P	31.3	Very low	28.2	Very low	104 Å²	104	104 Å²	104	68%	0.675	55%	0.549	S	S	*	.			cis	-146.3	163.8	7	40.9	-18.9	0	0	0	121.8
1746	L	26.9	Very low	28.2	Very low	141 Å²	141	101.8 Å²	101.8	74%	0.738	55%	0.552	S	S	*	*			trans	38.1	156.6	136	-70.6	76.9	0	0	0	123.3
1747	M	27.9	Very low	28.3	Very low	129 Å²	129	101.9 Å²	101.9	64%	0.635	56%	0.556	S	S	*	*			cis	-168.4	141.5	-10.5	-104.4	-171.4	-177.5	0	0	111.2
1748	I	29.7	Very low	28.3	Very low	105 Å²	105	105.3 Å²	105.3	54%	0.538	57%	0.567	S	S	.	*				87.3	144.5	79.3	-60.6	-179	0	0	0	117.6	T651	T651-I1748 VanDerWaalsContact CB-C 3.45Å; T651-I1748 WeakPolarHBondContact OG1-CA 3.45Å; T651-I1748 PolarHBondContact OG1-N 3.36Å; T651-I1748 PolarHBondContact OG1-O 3.3Å; T651-I1748 VanDerWaalsContact OG1-O 3.13Å
1749	H	26.7	Very low	28.3	Very low	107 Å²	107	106.7 Å²	106.7	50%	0.495	58%	0.579	S	S	.	*			trans	112.7	46.9	157.7	-59.1	-74	0	0	0	125	T651 N652 N653	T651-H1749 CarbonylContact C-O 3.6Å; T651-H1749 PolarHBondContact OG1-N 2.74Å; N652-H1749 CarbonylContact C-O 2.69Å; N652-H1749 WeakPolarHBondContact CA-O 3.03Å; N652-H1749 PolarHBondContact N-O 2.91Å; N653-H1749 WeakPolarHBondContact CA-O 3.46Å; N653-H1749 PolarHBondContact N-O 3.5Å
1750	S	35.6	Very low	28.2	Very low	58 Å²	58	105.1 Å²	105.1	41%	0.406	58%	0.583	S	S	.	*			trans	123.1	0	135.6	21.3	0	0	0	0	121.8	T651 N652 V654	T651-S1750 VanDerWaalsContact CB-N 3.33Å; T651-S1750 VanDerWaalsContact CG2-N 3.27Å; N652-S1750 PolarHBondContact ND2-O 2.94Å; N652-S1750 CarbonylContact O-C 2.91Å; N652-S1750 WeakPolarHBondContact O-CA 3.33Å; N652-S1750 PolarHBondContact O-N 2.98Å; N652-S1750 VanDerWaalsContact O-O 3.05Å; V654-S1750 VanDerWaalsContact N-CA 3.33Å; V654-S1750 CarbonylContact O-C 3.44Å; V654-S1750 WeakPolarHBondContact O-CA 3.2Å; V654-S1750 WeakPolarHBondContact O-CB 3.19Å
1751	P	35.8	Very low	28.2	Very low	5 Å²	5	105.5 Å²	105.5	3%	0.032	59%	0.592	C	S	.	*				0	-100.9	0	35.4	-43.6	0	0	0	128.4	N652 N653 V654 E655 I665 K666	N652-P1751 CarbonylContact C-O 3.59Å; N652-P1751 WeakPolarHBondContact ND2-CA 3.26Å; N652-P1751 CarbonylContact O-C 3.58Å; N652-P1751 WeakPolarHBondContact O-CA 3.38Å; N653-P1751 CarbonylContact C-O 3.58Å; N653-P1751 WeakPolarHBondContact CA-O 2.94Å; N653-P1751 PolarHBondContact N-O 3.41Å; V654-P1751 VanDerWaalsContact N-CA 3.25Å; V654-P1751 PolarHBondContact N-O 3.44Å; V654-P1751 WeakPolarHBondContact O-CD 3.21Å; E655-P1751 VanDerWaalsContact CA-CG 3.46Å; E655-P1751 WeakPolarHBondContact O-CG 3.35Å; I665-P1751 HydrophobicContact CD1-CG 4.49Å; I665-P1751 HydrophobicContact CG1-CB 3.82Å; I665-P1751 HydrophobicContact CG1-CG 3.86Å; K666-P1751 WeakPolarHBondContact O-CB 3.3Å
1752	T	28.8	Very low	28	Very low	47 Å²	47	103.6 Å²	103.6	29%	0.288	59%	0.586	S	S	.	*			trans	-175.5	-125.9	170.2	34	0	0	0	0	122.8	N653 V654	N653-T1752 HydrophobicContact CB-CG2 3.76Å; V654-T1752 HydrophobicContact CG2-CG2 3.96Å
1753	P	35.7	Very low	28	Very low	70 Å²	70	102.9 Å²	102.9	46%	0.455	58%	0.582	S	S	.	*				-141	177.3	-123.1	45.6	-27.1	0	0	0	121.2	K668	K668-P1753 HydrophobicContact CD-CG 4Å
1754	V	29.3	Very low	28.1	Very low	130 Å²	130	104.1 Å²	104.1	79%	0.788	57%	0.573	S	S	*	*			trans	178.4	127.3	145.6	147.9	0	0	0	0	112.4
1755	H	27.5	Very low	28	Very low	157 Å²	157	104.6 Å²	104.6	73%	0.727	58%	0.576	S	S	*	*			cis	89.1	140.9	42.7	-86.6	-41.3	0	0	0	115.4
1756	T	26.3	Very low	27.9	Very low	110 Å²	110	104.2 Å²	104.2	68%	0.675	57%	0.573	S	S	*	*			cis	-152.8	-179.2	4.5	-16.6	0	0	0	0	107.7
1757	D	24.4	Very low	27.8	Very low	122 Å²	122	103.9 Å²	103.9	65%	0.652	58%	0.577	S	S	*	*			cis	-164	-171.4	-2	-145.3	-3.1	0	0	0	106.9
1758	Q	25.7	Very low	27.6	Very low	144 Å²	144	105.6 Å²	105.6	67%	0.673	58%	0.583	S	S	*	*			cis	-162.6	-171	-7.3	-153.1	179	97.9	0	0	108.1
1759	V	24.7	Very low	27.3	Very low	119 Å²	119	107.6 Å²	107.6	72%	0.721	59%	0.59	S	S	*	*			trans	75.3	147.6	149.1	152.5	0	0	0	0	119.3
1760	L	25.5	Very low	27.6	Very low	146 Å²	146	113.3 Å²	113.3	76%	0.764	62%	0.622	S	S	*	*			cis	-168.5	168.4	-42.5	-124.3	-176.5	0	0	0	111.7
1761	V	25.9	Very low	27.2	Very low	101 Å²	101	116.1 Å²	116.1	61%	0.612	63%	0.632	S	S	*	*			trans	61.5	103.5	167	-172.1	0	0	0	0	120.6
1762	S	22.8	Very low	26.8	Very low	43 Å²	43	121.9 Å²	121.9	30%	0.301	66%	0.664	S	S	.	*			trans	95.1	92.9	145.2	78.9	0	0	0	0	123.3	R1421 T1422	R1421-S1762 CarbonylContact O-C 3.31Å; T1422-S1762 CarbonylContact C-O 3.54Å
1763	S	25.4	Very low	26.7	Very low	74 Å²	74	126.1 Å²	126.1	52%	0.517	69%	0.685	S	S	.	*				60.3	165.9	124	48.3	0	0	0	0	124.6	R1421	R1421-S1763 WeakPolarHBondContact CB-OG 3.28Å; R1421-S1763 CarbonylContact O-C 3.55Å; R1421-S1763 WeakPolarHBondContact O-CA 3.3Å; R1421-S1763 WeakPolarHBondContact O-CB 3.44Å; R1421-S1763 PolarHBondContact O-OG 3.13Å
1764	Y	27.3	Very low	26.1	Very low	154 Å²	154	129.4 Å²	129.4	60%	0.604	70%	0.698	S	S	*	*			trans	14.4	127.1	172.6	-70.1	-76.8	0	0	0	119.1	T1422	T1422-Y1764 WeakPolarHBondContact CG2-O 3.44Å
1765	V	25.8	Very low	25.9	Very low	131 Å²	131	129.3 Å²	129.3	79%	0.794	69%	0.693	S	S	*	*				-143.7	146	53.8	160.2	0	0	0	0	112.6
1766	P	28.5	Very low	25.8	Very low	96 Å²	96	127.5 Å²	127.5	62%	0.623	69%	0.691	S	S	*	*			trans	-94.8	162.7	175.1	38.2	-36.7	0	0	0	114.2
1767	V	25	Very low	25.8	Very low	133 Å²	133	128.7 Å²	128.7	81%	0.806	69%	0.692	S	S	*	*			trans	-171.5	149.5	139	131.8	0	0	0	0	109.8
1768	Q	23.9	Very low	25.9	Very low	166 Å²	166	129.2 Å²	129.2	78%	0.776	70%	0.695	S	S	*	*			trans	69.6	139.9	-173.7	-50.1	-159	-55.9	0	0	115.5
1769	H	23.1	Very low	25.9	Very low	146 Å²	146	128 Å²	128	68%	0.676	70%	0.697	S	S	*	*			cis	-158.6	133.5	-21.4	-118.8	-62.2	0	0	0	109.2
1770	I	33.3	Very low	26	Very low	227 Å²	227	128.8 Å²	128.8	100%	1.164	69%	0.694	S	S	*	*				-131.6	0	121.4	-59.2	-171.9	0	0	0	104.1

Retrieved 1,770 of 1,770 residues in 2655.4 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).