A0A087XJW8_POEFO Loading...

Glutamate receptor

Receptor for glutamate that functions as a ligand-gated ion channel in the central nervous system and plays an important role in excitatory synaptic transmission. L-glutamate acts as an excitatory neurotransmitter at many synapses in the central nervous system.

AlphaFold DB , UniProt , Accession A0A087XJW8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,105 aa.

						>A0A087XJW8_POEFO|A0A087XJW8
MPALPALLLSIYVVVLLLTMAPLFFSQANTLSAVRMAAILDDQSVCGRGERLALALARENINNQMEDSAQARVEVDVYELQKDSQYDTTDTMCQILPKGVVSVIGPASSPASGSTISHICGEKEIPHVKIGPEETPKLPYLRFASVTLYPSNEDLSLAIGSILQSFGYPTASLICAKAECLLRLEELVRHFLISRETLSVRMLDESLDPTPLLKEIRDDKVATIIIDANASISYHILRKANELGMMSAFYKYILTTMDFPLLQLDDVVGDQSNIVGFSMLNISHPFYLDFIRSLNLSWKEGCNINPYPGPALSSALMFDAVHVVVSAVRELNRSQEIGVKPLSCTSPLIWQHGTSLMNYLRMVEYDGLTGHIEFNSKGQRTNYTLKILEKHPAGHKEIGTWYSNNTLAMNSTSLDLNASETLANKSLIVTTILENPYVMRKSNYQDFQGNDQYEGFCVDMLRELADILKFSFKIKLVDDGLYGAPEPNGSWTGMVGELINRKADLAVAGFTITSEREKVIDFSKPFMTLGISILYQVHLARKPGYFSFLDPFSPAVWLFMLLAYLAVSCVLFLAARLSPYEWYNPHPCLRERRDILENQYTLGNSLWFPVGGFMQQGSEIMPRALSTRCVSGVWWAFTLIIISSYTANLAAFLTVQRMEVPIESPDDLADQTNIQYGTIHGGSTMTFFMNSRYQTYQRMWNYMKSKQPSVFVKSTEEGIARVLNSKYAFLMESTMNEYYRSLNCNLTQIGGLLDTKGYGIGMPLGSPYRDEITLGILQLQESNRLEILKRRWWEGGQCPKEEDHRAKGLGMENIGGIFVVLICGLIVAVFVAIMEFVWSTRRTAETGEVSVCQEMLTEFRNAVSCKKSSRARRRRPLSSAGGGVLRHPSRLALAGPRPIRLVREMRLSNGKLYSGTGPLTGGLAGLGAGMATGPDLGPGPQRLLDDPLGVNSASSNPPAPPPMPAFEAPPAPPRSFLQSCSHVRICQECRRIQSLRPATLTPPPPPPPSSSSSASSCSRIPPSLAMSGHHHRHNPHHPLHYHHGSMSLPRLPPPPPPISTDRADSDGGTTSPLRATNRPAPPPRPPPTKAPTYPPTDLLGGHNCA
					

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	53.6	Low	54.6	Low	240 Å²	240	114.7 Å²	114.7	100%	1.182	67%	0.668	S	S	*	*				0	149.5	0	-62.7	179.6	179.6	0	0	107.8
2	P	51.6	Low	55	Low	132 Å²	132	120.1 Å²	120.1	86%	0.857	67%	0.671	S	S	*	*			cis	-83.9	-166.1	-11.7	39.1	-36	0	0	0	109.8
3	A	40.9	Very low	55.5	Low	74 Å²	74	116.4 Å²	116.4	61%	0.612	65%	0.653	S	S	*	*			cis	-132.4	166.2	-32.4	0	0	0	0	0	105.7	P5	A3-P5 WeakPolarHBondContact O-CD 3.29Å
4	L	53.8	Low	55.8	Low	145 Å²	145	113.9 Å²	113.9	76%	0.759	64%	0.642	S	S	*	*			cis	87.6	-22.8	38.7	-117.5	154.8	0	0	0	118.6
5	P	54.1	Low	56	Low	86 Å²	86	111.7 Å²	111.7	56%	0.558	63%	0.632	S	S	*	*	S	Bend	trans	-86.5	-30.2	169.4	34	-32.2	0	0	0	112.9	A3 L7 L8 L9	A3-P5 WeakPolarHBondContact O-CD 3.29Å; P5-L7 VanDerWaalsContact C-N 3.28Å; P5-L7 PolarHBondContact O-N 3.49Å; P5-L8 PolarHBondContact O-N 3.43Å; P5-L9 PolarHBondContact O-N 3.1Å; P5-L9 VanDerWaalsContact O-N 3.13Å
6	A	53.6	Low	55.8	Low	74 Å²	74	111 Å²	111	61%	0.612	63%	0.625	S	S	*	*	H	α-helix	trans	-62.7	-31.6	-174.4	0	0	0	0	0	113.8	S10	A6-S10 PolarHBondContact O-N 3.07Å; A6-S10 VanDerWaalsContact O-N 3.13Å; A6-S10 PolarHBondContact O-OG 3.14Å
7	L	56.7	Low	55.5	Low	121 Å²	121	112.1 Å²	112.1	63%	0.634	63%	0.628	S	S	*	*	H	α-helix	trans	-80.9	-28.9	-177.8	-136.1	163.8	0	0	0	112.3	P5 S10 I11	P5-L7 VanDerWaalsContact C-N 3.28Å; P5-L7 PolarHBondContact O-N 3.49Å; L7-S10 PolarHBondContact O-OG 2.83Å; L7-S10 VanDerWaalsContact O-OG 3.09Å; L7-I11 HydrophobicContact CD2-CD1 3.95Å; L7-I11 HydrophobicContact CD2-CG1 4.46Å; L7-I11 WeakPolarHBondContact O-CD1 3.47Å; L7-I11 VanDerWaalsContact O-CG1 3.29Å; L7-I11 WeakPolarHBondContact O-CG1 3.44Å; L7-I11 PolarHBondContact O-N 3.14Å
8	L	56.3	Low	55.2	Low	117 Å²	117	113.3 Å²	113.3	61%	0.613	63%	0.632	S	S	*	*	H	α-helix	trans	-72.2	-38	169.8	-79.3	165.3	0	0	0	111.2	P5 I11 Y12	P5-L8 PolarHBondContact O-N 3.43Å; L8-I11 PolarHBondContact O-N 3.33Å; L8-Y12 WeakPolarHBondContact O-CB 3.27Å; L8-Y12 PolarHBondContact O-N 3.06Å
9	L	57.8	Low	55.1	Low	118 Å²	118	112.3 Å²	112.3	62%	0.618	63%	0.629	S	S	*	*	H	α-helix	trans	-69.9	-36.4	-179	-145.1	152	0	0	0	111.9	P5 Y12 V13	P5-L9 PolarHBondContact O-N 3.1Å; P5-L9 VanDerWaalsContact O-N 3.13Å; L9-Y12 PolarHBondContact O-N 2.69Å; L9-V13 HydrophobicContact CD2-CG2 4.05Å; L9-V13 WeakPolarHBondContact O-CB 3.45Å; L9-V13 VanDerWaalsContact O-CG2 3.31Å; L9-V13 WeakPolarHBondContact O-CG2 3.49Å; L9-V13 PolarHBondContact O-N 3.13Å
10	S	58.2	Low	54.9	Low	61 Å²	61	114.3 Å²	114.3	43%	0.427	64%	0.635	S	S	.	*	H	α-helix	trans	-66.2	-42.2	172.1	62.3	0	0	0	0	112.7	A6 L7 V13 V14	A6-S10 PolarHBondContact O-N 3.07Å; A6-S10 VanDerWaalsContact O-N 3.13Å; A6-S10 PolarHBondContact O-OG 3.14Å; L7-S10 PolarHBondContact O-OG 2.83Å; L7-S10 VanDerWaalsContact O-OG 3.09Å; S10-V13 PolarHBondContact O-N 3.29Å; S10-V14 WeakPolarHBondContact O-CB 3.11Å; S10-V14 VanDerWaalsContact O-CG2 3.3Å; S10-V14 WeakPolarHBondContact O-CG2 3.47Å; S10-V14 PolarHBondContact O-N 3.06Å
11	I	64.3	Low	54.2	Low	94 Å²	94	112 Å²	112	48%	0.482	63%	0.632	S	S	.	*	H	α-helix	trans	-62.3	-44.3	175.7	-68.2	168.3	0	0	0	110.7	L7 L8 V13 V14 V15	L7-I11 HydrophobicContact CD2-CD1 3.95Å; L7-I11 HydrophobicContact CD2-CG1 4.46Å; L7-I11 WeakPolarHBondContact O-CD1 3.47Å; L7-I11 VanDerWaalsContact O-CG1 3.29Å; L7-I11 WeakPolarHBondContact O-CG1 3.44Å; L7-I11 PolarHBondContact O-N 3.14Å; L8-I11 PolarHBondContact O-N 3.33Å; I11-V13 PolarHBondContact O-N 2.78Å; I11-V14 PolarHBondContact O-N 3.31Å; I11-V15 HydrophobicContact CG2-CG2 4.43Å; I11-V15 WeakPolarHBondContact O-CG2 3.27Å; I11-V15 PolarHBondContact O-N 2.88Å
12	Y	58.9	Low	53.6	Low	179 Å²	179	105 Å²	105	70%	0.702	60%	0.604	S	S	*	*	H	α-helix	trans	-65.5	-40.1	-179.7	-144.1	-90.4	0	0	0	112.3	L8 L9 L16	L8-Y12 WeakPolarHBondContact O-CB 3.27Å; L8-Y12 PolarHBondContact O-N 3.06Å; L9-Y12 PolarHBondContact O-N 2.69Å; Y12-L16 WeakPolarHBondContact O-CB 3.37Å; Y12-L16 PolarHBondContact O-N 3.19Å
13	V	62.1	Low	53.1	Low	72 Å²	72	106.4 Å²	106.4	44%	0.436	60%	0.603	S	S	.	*	H	α-helix	trans	-67.4	-40	175.7	169.1	0	0	0	0	111.9	L9 S10 I11 L16 L17	L9-V13 HydrophobicContact CD2-CG2 4.05Å; L9-V13 WeakPolarHBondContact O-CB 3.45Å; L9-V13 VanDerWaalsContact O-CG2 3.31Å; L9-V13 WeakPolarHBondContact O-CG2 3.49Å; L9-V13 PolarHBondContact O-N 3.13Å; S10-V13 PolarHBondContact O-N 3.29Å; I11-V13 PolarHBondContact O-N 2.78Å; V13-L16 PolarHBondContact O-N 3.23Å; V13-L17 HydrophobicContact CG1-CD1 3.86Å; V13-L17 WeakPolarHBondContact O-CB 3.42Å; V13-L17 WeakPolarHBondContact O-CG 3.37Å; V13-L17 PolarHBondContact O-N 3.44Å
14	V	59	Low	52.8	Low	82 Å²	82	111.3 Å²	111.3	50%	0.497	61%	0.611	S	S	.	*	H	α-helix	trans	-66	-42	176.3	168	0	0	0	0	111.5	S10 I11 L17 L18	S10-V14 WeakPolarHBondContact O-CB 3.11Å; S10-V14 VanDerWaalsContact O-CG2 3.3Å; S10-V14 WeakPolarHBondContact O-CG2 3.47Å; S10-V14 PolarHBondContact O-N 3.06Å; I11-V14 PolarHBondContact O-N 3.31Å; V14-L17 PolarHBondContact O-N 3Å; V14-L18 HydrophobicContact CG1-CD1 3.89Å; V14-L18 WeakPolarHBondContact O-CB 3.28Å; V14-L18 WeakPolarHBondContact O-CG 3.47Å; V14-L18 PolarHBondContact O-N 3.19Å
15	V	59.5	Low	51.8	Low	80 Å²	80	112.8 Å²	112.8	49%	0.485	61%	0.612	S	S	.	*	H	α-helix	trans	-67	-39.4	176.2	172.1	0	0	0	0	111.7	I11 L18 T19	I11-V15 HydrophobicContact CG2-CG2 4.43Å; I11-V15 WeakPolarHBondContact O-CG2 3.27Å; I11-V15 PolarHBondContact O-N 2.88Å; V15-L18 PolarHBondContact O-N 2.99Å; V15-T19 WeakPolarHBondContact O-CB 3.43Å; V15-T19 WeakPolarHBondContact O-CG2 3.23Å; V15-T19 PolarHBondContact O-N 3.2Å; V15-T19 PolarHBondContact O-OG1 2.9Å
16	L	51.7	Low	50.9	Low	101 Å²	101	113.9 Å²	113.9	53%	0.529	62%	0.621	S	S	.	*	H	α-helix	trans	-66.1	-40.4	176.1	-157.8	75.4	0	0	0	112.3	Y12 V13 L18 T19 M20	Y12-L16 WeakPolarHBondContact O-CB 3.37Å; Y12-L16 PolarHBondContact O-N 3.19Å; V13-L16 PolarHBondContact O-N 3.23Å; L16-L18 VanDerWaalsContact C-N 3.34Å; L16-T19 WeakPolarHBondContact CA-OG1 3.41Å; L16-T19 PolarHBondContact O-N 3.1Å; L16-T19 PolarHBondContact O-OG1 3.39Å; L16-M20 PolarHBondContact O-N 3.39Å
17	L	51.8	Low	49.9	Very low	130 Å²	130	117.6 Å²	117.6	68%	0.681	63%	0.626	S	S	*	*	H	α-helix	trans	-68.4	-30.4	175.1	-75.7	168	0	0	0	113.1	V13 V14	V13-L17 HydrophobicContact CG1-CD1 3.86Å; V13-L17 WeakPolarHBondContact O-CB 3.42Å; V13-L17 WeakPolarHBondContact O-CG 3.37Å; V13-L17 PolarHBondContact O-N 3.44Å; V14-L17 PolarHBondContact O-N 3Å
18	L	50.5	Low	48.8	Very low	134 Å²	134	115.7 Å²	115.7	70%	0.702	63%	0.628	S	S	*	*	H	α-helix	trans	-78.8	-16.1	173.6	-77.9	167.5	0	0	0	113.9	V14 V15 L16	V14-L18 HydrophobicContact CG1-CD1 3.89Å; V14-L18 WeakPolarHBondContact O-CB 3.28Å; V14-L18 WeakPolarHBondContact O-CG 3.47Å; V14-L18 PolarHBondContact O-N 3.19Å; V15-L18 PolarHBondContact O-N 2.99Å; L16-L18 VanDerWaalsContact C-N 3.34Å
19	T	53.1	Low	48	Very low	93 Å²	93	117.1 Å²	117.1	57%	0.571	64%	0.636	S	S	*	*	H	α-helix	trans	-106.5	-14.8	-178.7	46.8	0	0	0	0	114.2	V15 L16	V15-T19 WeakPolarHBondContact O-CB 3.43Å; V15-T19 WeakPolarHBondContact O-CG2 3.23Å; V15-T19 PolarHBondContact O-N 3.2Å; V15-T19 PolarHBondContact O-OG1 2.9Å; L16-T19 WeakPolarHBondContact CA-OG1 3.41Å; L16-T19 PolarHBondContact O-N 3.1Å; L16-T19 PolarHBondContact O-OG1 3.39Å
20	M	49.8	Very low	47.2	Very low	152 Å²	152	117.7 Å²	117.7	75%	0.749	64%	0.644	S	S	*	*			trans	-109.5	26.5	173.9	-67.3	-64	-66.5	0	0	112.9	L16	L16-M20 PolarHBondContact O-N 3.39Å
21	A	41.1	Very low	46.9	Very low	68 Å²	68	117.1 Å²	117.1	56%	0.562	64%	0.636	S	S	*	*	S	Bend	trans	-64.6	126.5	158	0	0	0	0	0	108.2	L23	A21-L23 PolarHBondContact O-N 3.25Å
22	P	41.9	Very low	46.7	Very low	93 Å²	93	117.7 Å²	117.7	60%	0.604	65%	0.649	S	S	*	*			trans	-63.1	134.9	179.7	25.1	-33.7	0	0	0	110.3	F24	P22-F24 HydrophobicContact CB-CD2 3.91Å; P22-F24 HydrophobicContact CB-CE2 4.14Å; P22-F24 HydrophobicContact CG-CD2 3.66Å; P22-F24 HydrophobicContact CG-CE2 3.87Å; P22-F24 PolarHBondContact O-N 2.92Å
23	L	39.7	Very low	47.3	Very low	161 Å²	161	110.3 Å²	110.3	84%	0.843	63%	0.625	S	S	*	*			trans	-69.6	65.3	158.7	-84.6	167.4	0	0	0	109.6	A21 F25	A21-L23 PolarHBondContact O-N 3.25Å; L23-F25 PolarHBondContact O-N 2.91Å
24	F	34.5	Very low	48.4	Very low	176 Å²	176	107.4 Å²	107.4	77%	0.772	61%	0.607	S	S	*	*			trans	-60.9	96.4	143	-76.6	-67.1	0	0	0	106.3	P22 S26	P22-F24 HydrophobicContact CB-CD2 3.91Å; P22-F24 HydrophobicContact CB-CE2 4.14Å; P22-F24 HydrophobicContact CG-CD2 3.66Å; P22-F24 HydrophobicContact CG-CE2 3.87Å; P22-F24 PolarHBondContact O-N 2.92Å; F24-S26 PolarHBondContact O-N 3.47Å
25	F	34.3	Very low	49.8	Very low	177 Å²	177	107.2 Å²	107.2	78%	0.776	60%	0.598	S	S	*	*			trans	-53.1	84.9	136.6	-86.9	-96.8	0	0	0	106.7	L23 Q27	L23-F25 PolarHBondContact O-N 2.91Å; F25-Q27 PolarHBondContact O-N 3.45Å
26	S	34.1	Very low	51.4	Low	108 Å²	108	103.4 Å²	103.4	76%	0.755	58%	0.575	S	S	*	*			trans	-58.2	100.1	145.3	-178.7	0	0	0	0	103.8	F24 A28	F24-S26 PolarHBondContact O-N 3.47Å; S26-A28 PolarHBondContact O-N 3.22Å
27	Q	32.6	Very low	53.4	Low	152 Å²	152	98.7 Å²	98.7	71%	0.71	55%	0.55	S	S	*	.			trans	-51.1	121.4	165.6	-66.9	173.8	-82.3	0	0	105.3	F25 N29	F25-Q27 PolarHBondContact O-N 3.45Å; Q27-N29 PolarHBondContact O-N 3.03Å
28	A	33.6	Very low	55.4	Low	81 Å²	81	92.5 Å²	92.5	67%	0.669	52%	0.517	S	S	*	.			trans	-56.9	117.1	155	0	0	0	0	0	104	S26 T30	S26-A28 PolarHBondContact O-N 3.22Å; A28-T30 VanDerWaalsContact C-N 3.29Å; A28-T30 PolarHBondContact O-N 3Å
29	N	38.9	Very low	57.3	Low	148 Å²	148	86.1 Å²	86.1	79%	0.791	48%	0.484	S	S	*	.			trans	-62.7	97.9	-178.5	-85.1	-11.3	0	0	0	107.4	Q27 L31	Q27-N29 PolarHBondContact O-N 3.03Å; N29-L31 PolarHBondContact O-N 3.34Å; N29-L31 VanDerWaalsContact O-N 3.1Å
30	T	41.8	Very low	59	Low	129 Å²	129	82 Å²	82	79%	0.791	46%	0.459	S	S	*	.			trans	-54.2	118.9	167.9	39.3	0	0	0	0	106.3	A28 S32	A28-T30 VanDerWaalsContact C-N 3.29Å; A28-T30 PolarHBondContact O-N 3Å; T30-S32 PolarHBondContact O-N 3.12Å
31	L	51.7	Low	60.4	Low	49 Å²	49	75.3 Å²	75.3	26%	0.257	43%	0.426	S	S	.	.			trans	-68	99.2	-160	-171.4	143.3	0	0	0	109.3	N29 A33 V34 A71 I337 V339	N29-L31 PolarHBondContact O-N 3.34Å; N29-L31 VanDerWaalsContact O-N 3.1Å; L31-A33 WeakPolarHBondContact CD2-O 3.47Å; L31-V34 HydrophobicContact CD2-CB 4.35Å; L31-V34 HydrophobicContact CD2-CG2 3.48Å; L31-V34 VanDerWaalsContact CD2-CG2 3.48Å; L31-A71 HydrophobicContact CD2-CB 3.59Å; L31-A71 WeakPolarHBondContact O-CB 3.41Å; L31-I337 HydrophobicContact CD1-CB 4.39Å; L31-I337 HydrophobicContact CD1-CG2 4.27Å; L31-I337 VanDerWaalsContact CD1-O 3.31Å; L31-I337 WeakPolarHBondContact CD1-O 3.34Å; L31-V339 HydrophobicContact CD1-CG2 3.62Å
32	S	60.5	Low	61.6	Low	106 Å²	106	75.6 Å²	75.6	74%	0.741	42%	0.418	S	S	*	.			trans	-77.1	-29.4	-173.5	54.1	0	0	0	0	112.3	T30 R72	T30-S32 PolarHBondContact O-N 3.12Å; S32-R72 PolarHBondContact O-N 2.84Å; S32-R72 VanDerWaalsContact O-N 3.14Å
33	A	72.1	Confident	62.5	Low	25 Å²	25	77 Å²	77	21%	0.207	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	138.7	172	0	0	0	0	0	112.5	L31 R72 E74	L31-A33 WeakPolarHBondContact CD2-O 3.47Å; A33-R72 CarbonylContact C-O 3.29Å; A33-R72 WeakPolarHBondContact CA-O 3.37Å; A33-E74 HydrophobicContact CB-CG 4.03Å
34	V	84.6	Confident	63.4	Low	10 Å²	10	72 Å²	72	6%	0.061	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	107.1	167.9	178.6	0	0	0	0	107.6	L31 M36 A71 R72 E74 V101 V328	L31-V34 HydrophobicContact CD2-CB 4.35Å; L31-V34 HydrophobicContact CD2-CG2 3.48Å; L31-V34 VanDerWaalsContact CD2-CG2 3.48Å; V34-M36 HydrophobicContact CG1-CE 4.44Å; V34-A71 HydrophobicContact CG2-CB 3.89Å; V34-R72 PolarHBondContact N-O 3.44Å; V34-E74 PolarHBondContact O-N 3.3Å; V34-V101 HydrophobicContact CG1-CG1 4.27Å; V34-V101 HydrophobicContact CG1-CG2 3.7Å; V34-V328 HydrophobicContact CG1-CG1 4.09Å; V34-V328 HydrophobicContact CG1-CG2 4.41Å; V34-V328 HydrophobicContact CG2-CG1 3.93Å
35	R	89.1	Confident	64.2	Low	79 Å²	79	69.2 Å²	69.2	30%	0.298	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	126.2	179.6	-169	175.9	-66.3	143.5	-2.4	112.3	E74 K98 V100 V101	R35-E74 WeakPolarHBondContact CA-O 3.18Å; R35-E74 HydrophobicContact CB-CB 4.35Å; R35-E74 HydrophobicContact CG-CB 4.25Å; R35-E74 IonicContact CZ-OE2 3.2Å; R35-E74 IonicContact NE-OE2 2.84Å; R35-E74 PolarHBondContact NE-OE2 3.45Å; R35-E74 IonicContact NH2-OE2 2.7Å; R35-E74 PolarHBondContact NH2-OE2 3.29Å; R35-K98 PolarHBondContact NH1-O 2.94Å; R35-V100 HydrophobicContact CG-CG1 4.24Å; R35-V100 CarbonylContact O-C 3.54Å; R35-V100 VanDerWaalsContact O-CA 3.28Å; R35-V100 WeakPolarHBondContact O-CA 3.26Å; R35-V101 PolarHBondContact O-N 2.98Å
36	M	92	Very high	65.3	Low	0 Å²	0	62.2 Å²	62.2	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	157.5	168	-71.6	163.9	-86.8	0	0	110.1	V34 V73 E74 V75 D76 V101 V321 V324 V325	V34-M36 HydrophobicContact CG1-CE 4.44Å; M36-V73 HydrophobicContact CE-CG1 3.45Å; M36-V73 VanDerWaalsContact CE-CG1 3.45Å; M36-E74 PolarHBondContact N-O 2.99Å; M36-V75 HydrophobicContact CE-CG2 4.28Å; M36-D76 PolarHBondContact O-N 3.44Å; M36-V101 HydrophobicContact CG-CG2 3.8Å; M36-V321 HydrophobicContact CE-CG1 4.04Å; M36-V321 HydrophobicContact SD-CG1 4.48Å; M36-V324 HydrophobicContact CG-CG1 4.02Å; M36-V324 HydrophobicContact SD-CB 3.71Å; M36-V324 HydrophobicContact SD-CG1 3.46Å; M36-V324 WeakPolarHBondContact SD-CG1 3.26Å; M36-V324 HydrophobicContact SD-CG2 4.43Å; M36-V325 HydrophobicContact CE-CG2 3.75Å
37	A	93.8	Very high	66.3	Low	1 Å²	1	58.3 Å²	58.3	1%	0.008	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	140.6	163.5	0	0	0	0	0	110	D76 Y78 I95 V100 S102 V103 I104	A37-D76 CarbonylContact C-O 3.6Å; A37-D76 WeakPolarHBondContact CA-O 3.03Å; A37-Y78 HydrophobicContact CB-CD2 4.44Å; A37-Y78 HydrophobicContact CB-CE2 4.17Å; A37-I95 HydrophobicContact CB-CD1 3.94Å; A37-I95 HydrophobicContact CB-CG1 4.02Å; A37-I95 HydrophobicContact CB-CG2 3.7Å; A37-V100 HydrophobicContact CB-CG1 4.2Å; A37-S102 PolarHBondContact N-O 3.17Å; A37-S102 VanDerWaalsContact N-O 3.14Å; A37-V103 HydrophobicContact CB-CG2 4.5Å; A37-V103 CarbonylContact O-C 3.45Å; A37-V103 WeakPolarHBondContact O-CA 3.42Å; A37-I104 PolarHBondContact O-N 3.09Å
38	A	93	Very high	68	Low	0 Å²	0	58.3 Å²	58.3	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	133.1	171.6	0	0	0	0	0	109.7	L54 V75 D76 V77 Y78 I104	A38-L54 HydrophobicContact CB-CD1 3.48Å; A38-L54 VanDerWaalsContact CB-CD1 3.48Å; A38-L54 HydrophobicContact CB-CD2 4.23Å; A38-V75 HydrophobicContact CB-CG1 3.91Å; A38-D76 PolarHBondContact N-O 3.37Å; A38-V77 WeakPolarHBondContact O-CA 3.41Å; A38-Y78 PolarHBondContact O-N 3.3Å; A38-I104 HydrophobicContact CB-CB 4.27Å
39	I	91.2	Very high	70	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	118.9	-176.9	-65	172.3	0	0	0	108.1	L80 I95 V103 I104 G105 P106 I116	I39-L80 HydrophobicContact CG2-CD1 3.36Å; I39-L80 HydrophobicContact CG2-CG 3.81Å; I39-I95 HydrophobicContact CD1-CD1 3.83Å; I39-I95 HydrophobicContact CG1-CD1 4.04Å; I39-V103 HydrophobicContact CD1-CG1 3.81Å; I39-V103 HydrophobicContact CG1-CG1 4.36Å; I39-I104 PolarHBondContact N-O 3.42Å; I39-G105 CarbonylContact O-C 3.58Å; I39-P106 HydrophobicContact CG2-CG 4.46Å; I39-P106 VanDerWaalsContact O-CA 3.26Å; I39-P106 WeakPolarHBondContact O-CA 3.48Å; I39-I116 HydrophobicContact CD1-CD1 3.61Å; I39-I116 HydrophobicContact CD1-CG1 4.01Å; I39-I116 HydrophobicContact CG2-CD1 4.34Å
40	L	88.6	Confident	72.3	Confident	8 Å²	8	49 Å²	49	4%	0.042	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	147.6	178.8	-50.3	-175.1	0	0	0	110.2	E50 R51 L54 V77 Y78 E79 L80 M317	L40-E50 HydrophobicContact CD2-CB 4.02Å; L40-R51 HydrophobicContact CD1-CB 3.87Å; L40-R51 HydrophobicContact CD1-CG 4.47Å; L40-L54 HydrophobicContact CD2-CD1 4.08Å; L40-V77 HydrophobicContact CD1-CG1 3.51Å; L40-V77 HydrophobicContact CG-CG1 3.83Å; L40-Y78 PolarHBondContact N-O 3.43Å; L40-E79 HydrophobicContact CB-CG 4.36Å; L40-L80 PolarHBondContact O-N 2.99Å; L40-M317 HydrophobicContact CD2-CE 3.48Å; L40-M317 VanDerWaalsContact CD2-CE 3.48Å; L40-M317 HydrophobicContact CD2-SD 4.33Å
41	D	78.9	Confident	74.4	Confident	10 Å²	10	48 Å²	48	5%	0.053	26%	0.259	C	S	.	.			trans	-124.8	0.1	-178.1	71.3	-62.7	0	0	0	115.6	P106 A107 S108 S109	D41-P106 HydrophobicContact CB-CB 3.75Å; D41-P106 VanDerWaalsContact OD1-CB 3.27Å; D41-P106 WeakPolarHBondContact OD1-CB 3.29Å; D41-A107 PolarHBondContact OD1-N 3.31Å; D41-S108 PolarHBondContact OD1-N 2.84Å; D41-S108 WeakPolarHBondContact OD2-CA 3.28Å; D41-S108 WeakPolarHBondContact OD2-CB 3.11Å; D41-S108 PolarHBondContact OD2-N 3.11Å; D41-S109 WeakPolarHBondContact CB-OG 3.13Å; D41-S109 VanDerWaalsContact CG-OG 3.3Å; D41-S109 VanDerWaalsContact OD2-CB 3.31Å; D41-S109 WeakPolarHBondContact OD2-CB 3.4Å; D41-S109 PolarHBondContact OD2-N 3.14Å; D41-S109 PolarHBondContact OD2-OG 2.9Å
42	D	66.8	Low	76.1	Confident	74 Å²	74	47.6 Å²	47.6	40%	0.396	26%	0.257	S	S	.	.			trans	-92	129.7	164.7	-172.1	22.9	0	0	0	111.5	S44 G47	D42-S44 VanDerWaalsContact OD1-CB 3.27Å; D42-S44 WeakPolarHBondContact OD1-CB 3.38Å; D42-S44 PolarHBondContact OD1-N 3.01Å; D42-S44 PolarHBondContact OD1-OG 3.48Å; D42-S44 WeakPolarHBondContact OD2-CB 3.38Å; D42-S44 PolarHBondContact OD2-OG 2.91Å; D42-G47 WeakPolarHBondContact OD2-CA 3.39Å
43	Q	59.9	Low	77.5	Confident	122 Å²	122	42.5 Å²	42.5	57%	0.57	22%	0.222	S	C	*	.			trans	-104.1	2.7	173.4	-60.5	-170	-0	0	0	112.5	V45 L80	Q43-V45 PolarHBondContact O-N 2.74Å; Q43-L80 PolarHBondContact NE2-O 3.12Å
44	S	59.6	Low	78.4	Confident	57 Å²	57	41.5 Å²	41.5	40%	0.399	21%	0.213	S	C	.	.			trans	-63.8	131.2	-179.8	88.1	0	0	0	0	110.7	D42 C46 G47	D42-S44 VanDerWaalsContact OD1-CB 3.27Å; D42-S44 WeakPolarHBondContact OD1-CB 3.38Å; D42-S44 PolarHBondContact OD1-N 3.01Å; D42-S44 PolarHBondContact OD1-OG 3.48Å; D42-S44 WeakPolarHBondContact OD2-CB 3.38Å; D42-S44 PolarHBondContact OD2-OG 2.91Å; S44-C46 PolarHBondContact O-N 2.94Å; S44-G47 PolarHBondContact O-N 3.22Å; S44-G47 WeakPolarHBondContact OG-CA 3.35Å; S44-G47 PolarHBondContact OG-N 2.71Å
45	V	52.2	Low	78.6	Confident	117 Å²	117	42.7 Å²	42.7	71%	0.709	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-27.4	-177.1	-178.9	0	0	0	0	112	Q43	Q43-V45 PolarHBondContact O-N 2.74Å
46	C	56.2	Low	78.7	Confident	31 Å²	31	40.1 Å²	40.1	21%	0.209	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-19.8	-178.5	-164	0	0	0	0	113.6	S44 R48 W298 C302	S44-C46 PolarHBondContact O-N 2.94Å; C46-R48 PolarHBondContact O-N 3.01Å; C46-R48 VanDerWaalsContact O-N 3.13Å; C46-W298 VanDerWaalsContact SG-CE2 3.52Å; C46-W298 VanDerWaalsContact SG-CE3 3.56Å; C46-W298 WeakPolarHBondContact SG-CH2 3.44Å; C46-W298 WeakPolarHBondContact SG-CZ2 3.29Å; C46-W298 WeakPolarHBondContact SG-CZ3 3.37Å; C46-C302 WeakPolarHBondContact CA-SG 3.19Å; C46-C302 HydrophobicContact CB-CB 4.16Å; C46-C302 WeakPolarHBondContact CB-SG 3.09Å; C46-C302 WeakPolarHBondContact SG-CB 3.17Å; C46-C302 CovalentContact SG-SG 2.03Å; C46-C302 PolarHBondContact SG-SG 2.69Å
47	G	55.5	Low	78.6	Confident	26 Å²	26	40.1 Å²	40.1	27%	0.268	22%	0.216	S	C	.	.			trans	-77.7	13.7	-176.3	0	0	0	0	0	116.2	D42 S44 G49	D42-G47 WeakPolarHBondContact OD2-CA 3.39Å; S44-G47 PolarHBondContact O-N 3.22Å; S44-G47 WeakPolarHBondContact OG-CA 3.35Å; S44-G47 PolarHBondContact OG-N 2.71Å; G47-G49 PolarHBondContact O-N 3.12Å
48	R	67.3	Low	78.5	Confident	151 Å²	151	45.3 Å²	45.3	57%	0.57	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.8	8.2	-177.8	-73.2	-174.8	170.5	-179.6	0.3	115.5	C46 E50 R51 L52	C46-R48 PolarHBondContact O-N 3.01Å; C46-R48 VanDerWaalsContact O-N 3.13Å; R48-E50 VanDerWaalsContact C-N 3.32Å; R48-E50 PolarHBondContact O-N 3.23Å; R48-R51 PolarHBondContact O-N 2.98Å; R48-L52 WeakPolarHBondContact O-CB 3.3Å; R48-L52 PolarHBondContact O-N 2.72Å
49	G	77.3	Confident	78.2	Confident	17 Å²	17	50.2 Å²	50.2	18%	0.175	26%	0.258	C	S	.	.	H	α-helix	trans	-56.3	-41.4	176.6	0	0	0	0	0	113.4	G47 L52 A53	G47-G49 PolarHBondContact O-N 3.12Å; G49-L52 PolarHBondContact O-N 2.96Å; G49-A53 VanDerWaalsContact O-CB 3.27Å; G49-A53 WeakPolarHBondContact O-CB 3.39Å; G49-A53 PolarHBondContact O-N 3.3Å
50	E	85.6	Confident	78.1	Confident	16 Å²	16	51.8 Å²	51.8	8%	0.075	27%	0.267	C	S	.	.	H	α-helix	trans	-65.8	-45.6	176.9	-67	177	-166.6	0	0	111.6	L40 R48 L52 A53 L54 S313 S314 M317	L40-E50 HydrophobicContact CD2-CB 4.02Å; R48-E50 VanDerWaalsContact C-N 3.32Å; R48-E50 PolarHBondContact O-N 3.23Å; E50-L52 VanDerWaalsContact C-N 3.32Å; E50-L52 PolarHBondContact O-N 3.43Å; E50-A53 PolarHBondContact O-N 2.94Å; E50-L54 WeakPolarHBondContact O-CG 3.36Å; E50-L54 PolarHBondContact O-N 3Å; E50-S313 WeakPolarHBondContact OE1-CB 3.5Å; E50-S313 PolarHBondContact OE1-OG 3.34Å; E50-S314 PolarHBondContact N-OG 3.09Å; E50-M317 HydrophobicContact CB-CG 4.21Å; E50-M317 HydrophobicContact CG-CG 4.34Å
51	R	86.7	Confident	78	Confident	108 Å²	108	51.9 Å²	51.9	41%	0.408	27%	0.267	S	S	.	.	H	α-helix	trans	-63.8	-36.2	177.2	-171.7	169.6	176.3	149.3	3.8	112.2	L40 R48 A55 E79	L40-R51 HydrophobicContact CD1-CB 3.87Å; L40-R51 HydrophobicContact CD1-CG 4.47Å; R48-R51 PolarHBondContact O-N 2.98Å; R51-A55 PolarHBondContact O-N 3.43Å; R51-E79 IonicContact CZ-OE1 3.7Å; R51-E79 IonicContact NH1-OE1 3.69Å; R51-E79 PolarHBondContact NH1-OE1 3.48Å; R51-E79 IonicContact NH1-OE2 2.67Å
52	L	87.5	Confident	78.4	Confident	41 Å²	41	52.9 Å²	52.9	22%	0.215	27%	0.272	C	S	.	.	H	α-helix	trans	-70.7	-42.7	172.9	-171.3	72.9	0	0	0	111.4	R48 G49 E50 L54 A55 L56 L294	R48-L52 WeakPolarHBondContact O-CB 3.3Å; R48-L52 PolarHBondContact O-N 2.72Å; G49-L52 PolarHBondContact O-N 2.96Å; E50-L52 VanDerWaalsContact C-N 3.32Å; E50-L52 PolarHBondContact O-N 3.43Å; L52-L54 VanDerWaalsContact C-N 3.33Å; L52-L54 PolarHBondContact O-N 2.94Å; L52-A55 CarbonylContact O-C 3.42Å; L52-A55 WeakPolarHBondContact O-CB 3.47Å; L52-A55 PolarHBondContact O-N 3.26Å; L52-A55 VanDerWaalsContact O-N 3.08Å; L52-L56 HydrophobicContact CD2-CD1 4.15Å; L52-L56 HydrophobicContact CG-CD1 3.93Å; L52-L56 HydrophobicContact CG-CG 4.18Å; L52-L56 WeakPolarHBondContact O-CB 3.46Å; L52-L56 WeakPolarHBondContact O-CG 3.32Å; L52-L56 PolarHBondContact O-N 2.85Å; L52-L294 HydrophobicContact CB-CD2 4.43Å; L52-L294 HydrophobicContact CD2-CD2 3.88Å; L52-L294 HydrophobicContact CD2-CG 4.26Å
53	A	89.3	Confident	79.2	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-59.8	-41.8	178.8	0	0	0	0	0	112.2	G49 E50 L56 A57 F290 S314 M317 F318	G49-A53 VanDerWaalsContact O-CB 3.27Å; G49-A53 WeakPolarHBondContact O-CB 3.39Å; G49-A53 PolarHBondContact O-N 3.3Å; E50-A53 PolarHBondContact O-N 2.94Å; A53-L56 PolarHBondContact O-N 2.93Å; A53-A57 WeakPolarHBondContact O-CB 3.26Å; A53-A57 PolarHBondContact O-N 3.04Å; A53-F290 HydrophobicContact CB-CE2 3.84Å; A53-F290 HydrophobicContact CB-CZ 4.18Å; A53-S314 WeakPolarHBondContact CB-O 3.22Å; A53-M317 HydrophobicContact CB-CB 4.46Å; A53-F318 HydrophobicContact CB-CB 4.33Å
54	L	90.6	Very high	80	Confident	3 Å²	3	54.2 Å²	54.2	2%	0.016	28%	0.279	C	S	.	.	H	α-helix	trans	-62.9	-40	172.4	-68.5	172	0	0	0	112.5	A38 L40 E50 L52 R58 V75 V77 I104 M317 V321	A38-L54 HydrophobicContact CB-CD1 3.48Å; A38-L54 VanDerWaalsContact CB-CD1 3.48Å; A38-L54 HydrophobicContact CB-CD2 4.23Å; L40-L54 HydrophobicContact CD2-CD1 4.08Å; E50-L54 WeakPolarHBondContact O-CG 3.36Å; E50-L54 PolarHBondContact O-N 3Å; L52-L54 VanDerWaalsContact C-N 3.33Å; L52-L54 PolarHBondContact O-N 2.94Å; L54-R58 VanDerWaalsContact O-CB 3.28Å; L54-R58 WeakPolarHBondContact O-CB 3.13Å; L54-R58 PolarHBondContact O-N 3.3Å; L54-V75 HydrophobicContact CD2-CG1 4.36Å; L54-V77 HydrophobicContact CD1-CG2 4.08Å; L54-I104 HydrophobicContact CD2-CD1 4.33Å; L54-M317 HydrophobicContact CD1-SD 4Å; L54-M317 HydrophobicContact CD2-CB 4.06Å; L54-M317 HydrophobicContact CD2-CG 4.45Å; L54-M317 HydrophobicContact CD2-SD 3.78Å; L54-M317 HydrophobicContact CG-CB 4.19Å; L54-M317 HydrophobicContact CG-CG 4.45Å; L54-M317 HydrophobicContact CG-SD 4.09Å; L54-V321 HydrophobicContact CD2-CG2 3.54Å
55	A	89.4	Confident	80.5	Confident	35 Å²	35	53.2 Å²	53.2	29%	0.289	27%	0.269	S	S	.	.	H	α-helix	trans	-66.8	-43	176.2	0	0	0	0	0	112.2	R51 L52 R58 E59	R51-A55 PolarHBondContact O-N 3.43Å; L52-A55 CarbonylContact O-C 3.42Å; L52-A55 WeakPolarHBondContact O-CB 3.47Å; L52-A55 PolarHBondContact O-N 3.26Å; L52-A55 VanDerWaalsContact O-N 3.08Å; A55-R58 PolarHBondContact O-N 2.85Å; A55-E59 WeakPolarHBondContact O-CB 3.34Å; A55-E59 PolarHBondContact O-N 3.43Å
56	L	90.6	Very high	80.8	Confident	26 Å²	26	54.8 Å²	54.8	14%	0.136	27%	0.269	C	S	.	.	H	α-helix	trans	-64.9	-42.3	176.2	-71.2	170.8	0	0	0	111.9	L52 A53 E59 N60 F290 F318	L52-L56 HydrophobicContact CD2-CD1 4.15Å; L52-L56 HydrophobicContact CG-CD1 3.93Å; L52-L56 HydrophobicContact CG-CG 4.18Å; L52-L56 WeakPolarHBondContact O-CB 3.46Å; L52-L56 WeakPolarHBondContact O-CG 3.32Å; L52-L56 PolarHBondContact O-N 2.85Å; A53-L56 PolarHBondContact O-N 2.93Å; L56-E59 PolarHBondContact O-N 2.82Å; L56-N60 WeakPolarHBondContact O-CB 3.16Å; L56-N60 PolarHBondContact O-N 3.32Å; L56-F290 HydrophobicContact CD1-CD2 4.09Å; L56-F318 HydrophobicContact CB-CD2 4.46Å; L56-F318 HydrophobicContact CB-CE2 4.37Å
57	A	90.4	Very high	80.6	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-62.5	-47.5	174.9	0	0	0	0	0	111.1	A53 E59 N60 I61 F318 V321	A53-A57 WeakPolarHBondContact O-CB 3.26Å; A53-A57 PolarHBondContact O-N 3.04Å; A57-E59 VanDerWaalsContact C-N 3.32Å; A57-E59 PolarHBondContact O-N 2.82Å; A57-N60 PolarHBondContact O-N 3.03Å; A57-I61 WeakPolarHBondContact O-CB 3.49Å; A57-I61 WeakPolarHBondContact O-CD1 3.43Å; A57-I61 WeakPolarHBondContact O-CG1 3.36Å; A57-I61 PolarHBondContact O-N 2.97Å; A57-F318 HydrophobicContact CB-CD2 3.62Å; A57-F318 HydrophobicContact CB-CE2 3.97Å; A57-F318 HydrophobicContact CB-CG 4.13Å; A57-V321 HydrophobicContact CB-CB 3.91Å; A57-V321 HydrophobicContact CB-CG1 4.16Å; A57-V321 HydrophobicContact CB-CG2 4.29Å
58	R	90.9	Very high	80.5	Confident	109 Å²	109	62.8 Å²	62.8	41%	0.411	31%	0.308	S	S	.	.	H	α-helix	trans	-58.2	-42.1	175.7	-175.3	-161.3	66.5	172.3	1.1	112	L54 A55 N62 V73	L54-R58 VanDerWaalsContact O-CB 3.28Å; L54-R58 WeakPolarHBondContact O-CB 3.13Å; L54-R58 PolarHBondContact O-N 3.3Å; A55-R58 PolarHBondContact O-N 2.85Å; R58-N62 WeakPolarHBondContact O-CB 3.45Å; R58-N62 PolarHBondContact O-N 2.95Å; R58-N62 VanDerWaalsContact O-N 3.09Å; R58-N62 PolarHBondContact O-ND2 2.94Å; R58-V73 VanDerWaalsContact CG-O 3.3Å; R58-V73 WeakPolarHBondContact CG-O 3.44Å
59	E	88.4	Confident	79.8	Confident	104 Å²	104	61.2 Å²	61.2	49%	0.486	33%	0.327	S	S	.	.	H	α-helix	trans	-71.7	-48.6	179.3	-173.3	169	162.5	0	0	111.9	A55 L56 A57 I61 N62 N63	A55-E59 WeakPolarHBondContact O-CB 3.34Å; A55-E59 PolarHBondContact O-N 3.43Å; L56-E59 PolarHBondContact O-N 2.82Å; A57-E59 VanDerWaalsContact C-N 3.32Å; A57-E59 PolarHBondContact O-N 2.82Å; E59-I61 VanDerWaalsContact C-N 3.31Å; E59-I61 PolarHBondContact O-N 3.06Å; E59-N62 PolarHBondContact O-N 3.48Å; E59-N63 VanDerWaalsContact O-CB 3.32Å; E59-N63 WeakPolarHBondContact O-CB 3.38Å; E59-N63 PolarHBondContact O-N 3.39Å; E59-N63 PolarHBondContact O-OD1 2.89Å
60	N	87.9	Confident	79.2	Confident	33 Å²	33	64.6 Å²	64.6	18%	0.176	34%	0.338	C	S	.	.	H	α-helix	trans	-52.9	-47.7	175.3	-177.8	35	0	0	0	111.8	L56 A57 Q64 H322	L56-N60 WeakPolarHBondContact O-CB 3.16Å; L56-N60 PolarHBondContact O-N 3.32Å; A57-N60 PolarHBondContact O-N 3.03Å; N60-Q64 WeakPolarHBondContact O-CB 3.42Å; N60-Q64 VanDerWaalsContact O-CG 3.28Å; N60-Q64 WeakPolarHBondContact O-CG 3.3Å; N60-Q64 PolarHBondContact O-N 3.37Å; N60-Q64 VanDerWaalsContact O-N 3.09Å; N60-Q64 PolarHBondContact OD1-NE2 3.35Å; N60-H322 PolarHBondContact ND2-CE1 2.95Å; N60-H322 VanDerWaalsContact ND2-CE1 3.28Å; N60-H322 PolarHBondContact ND2-NE2 3.38Å; N60-H322 VanDerWaalsContact ND2-NE2 3.12Å
61	I	87	Confident	78.4	Confident	9 Å²	9	64.8 Å²	64.8	5%	0.046	34%	0.343	C	S	.	.	H	α-helix	trans	-67.3	-48.8	179.6	-67	167.7	0	0	0	111.5	A57 E59 N63 Q64 M65 V73 V321 H322 V325	A57-I61 WeakPolarHBondContact O-CB 3.49Å; A57-I61 WeakPolarHBondContact O-CD1 3.43Å; A57-I61 WeakPolarHBondContact O-CG1 3.36Å; A57-I61 PolarHBondContact O-N 2.97Å; E59-I61 VanDerWaalsContact C-N 3.31Å; E59-I61 PolarHBondContact O-N 3.06Å; I61-N63 VanDerWaalsContact C-N 3.32Å; I61-N63 PolarHBondContact O-N 3.41Å; I61-Q64 PolarHBondContact O-N 3.29Å; I61-M65 HydrophobicContact CG2-SD 3.67Å; I61-M65 VanDerWaalsContact O-CG 3.25Å; I61-M65 WeakPolarHBondContact O-CG 3.45Å; I61-M65 PolarHBondContact O-N 2.92Å; I61-M65 VanDerWaalsContact O-N 3.14Å; I61-V73 HydrophobicContact CG2-CB 4.44Å; I61-V73 HydrophobicContact CG2-CG2 3.77Å; I61-V321 HydrophobicContact CD1-CG1 3.78Å; I61-H322 WeakPolarHBondContact CG1-CE1 3.28Å; I61-V325 HydrophobicContact CD1-CB 4.36Å; I61-V325 HydrophobicContact CD1-CG2 4.09Å; I61-V325 HydrophobicContact CG2-CG1 4.03Å
62	N	87.3	Confident	78.2	Confident	31 Å²	31	67.8 Å²	67.8	17%	0.166	35%	0.354	C	S	.	.	H	α-helix	trans	-64	-37.4	-179.5	-78.7	-62.4	0	0	0	112	R58 E59 M65 E66 R72 V73	R58-N62 WeakPolarHBondContact O-CB 3.45Å; R58-N62 PolarHBondContact O-N 2.95Å; R58-N62 VanDerWaalsContact O-N 3.09Å; R58-N62 PolarHBondContact O-ND2 2.94Å; E59-N62 PolarHBondContact O-N 3.48Å; N62-M65 PolarHBondContact O-N 3.25Å; N62-E66 PolarHBondContact O-N 2.95Å; N62-R72 WeakPolarHBondContact OD1-CA 3.5Å; N62-V73 PolarHBondContact ND2-O 3.35Å; N62-V73 PolarHBondContact OD1-N 3.37Å
63	N	83.7	Confident	78.2	Confident	94 Å²	94	66 Å²	66	50%	0.503	35%	0.345	S	S	.	.	H	α-helix	trans	-66.4	-39	176.7	-65.9	-3.3	0	0	0	111.6	E59 I61 M65 E66	E59-N63 VanDerWaalsContact O-CB 3.32Å; E59-N63 WeakPolarHBondContact O-CB 3.38Å; E59-N63 PolarHBondContact O-N 3.39Å; E59-N63 PolarHBondContact O-OD1 2.89Å; I61-N63 VanDerWaalsContact C-N 3.32Å; I61-N63 PolarHBondContact O-N 3.41Å; N63-M65 PolarHBondContact O-N 3.48Å; N63-E66 PolarHBondContact O-N 3.1Å
64	Q	76.8	Confident	78.3	Confident	130 Å²	130	69.4 Å²	69.4	61%	0.607	36%	0.361	S	S	*	.	H	α-helix	trans	-67.7	-13.5	171.7	-71.9	178.8	35.6	0	0	113.7	N60 I61	N60-Q64 WeakPolarHBondContact O-CB 3.42Å; N60-Q64 VanDerWaalsContact O-CG 3.28Å; N60-Q64 WeakPolarHBondContact O-CG 3.3Å; N60-Q64 PolarHBondContact O-N 3.37Å; N60-Q64 VanDerWaalsContact O-N 3.09Å; N60-Q64 PolarHBondContact OD1-NE2 3.35Å; I61-Q64 PolarHBondContact O-N 3.29Å
65	M	69	Low	78.3	Confident	36 Å²	36	70.1 Å²	70.1	18%	0.177	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	-4.1	-178.4	-70.6	176.8	72.1	0	0	113.9	I61 N62 N63 D67 S68 Q70 A71 V73	I61-M65 HydrophobicContact CG2-SD 3.67Å; I61-M65 VanDerWaalsContact O-CG 3.25Å; I61-M65 WeakPolarHBondContact O-CG 3.45Å; I61-M65 PolarHBondContact O-N 2.92Å; I61-M65 VanDerWaalsContact O-N 3.14Å; N62-M65 PolarHBondContact O-N 3.25Å; N63-M65 PolarHBondContact O-N 3.48Å; M65-D67 PolarHBondContact O-N 2.87Å; M65-S68 PolarHBondContact O-N 3.46Å; M65-Q70 HydrophobicContact CE-CB 3.48Å; M65-Q70 VanDerWaalsContact CE-CB 3.48Å; M65-A71 WeakPolarHBondContact CE-O 3.34Å; M65-V73 HydrophobicContact SD-CG2 4.46Å
66	E	58.9	Low	78.4	Confident	151 Å²	151	70.3 Å²	70.3	71%	0.706	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-26.2	178	-62.8	-152.7	120.3	0	0	113.1	N62 N63 S68	N62-E66 PolarHBondContact O-N 2.95Å; N63-E66 PolarHBondContact O-N 3.1Å; E66-S68 PolarHBondContact O-N 2.82Å
67	D	53	Low	78.4	Confident	164 Å²	164	71.3 Å²	71.3	88%	0.877	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	6.8	172.7	-79.9	-31.7	0	0	0	114.2	M65	M65-D67 PolarHBondContact O-N 2.87Å
68	S	53.2	Low	78.4	Confident	60 Å²	60	72.7 Å²	72.7	42%	0.42	37%	0.374	S	S	.	.	S	Bend	trans	-147.6	132.5	-179	-78.7	0	0	0	0	113.4	M65 E66 Q70	M65-S68 PolarHBondContact O-N 3.46Å; E66-S68 PolarHBondContact O-N 2.82Å; S68-Q70 PolarHBondContact O-N 2.95Å
69	A	53.1	Low	78.2	Confident	119 Å²	119	72.2 Å²	72.2	98%	0.983	38%	0.376	S	S	*	.			trans	-72.6	67.9	179.4	0	0	0	0	0	112.4
70	Q	63.8	Low	78	Confident	87 Å²	87	67.4 Å²	67.4	41%	0.407	35%	0.354	S	S	.	.			trans	-123.7	165.2	-177.1	-65.7	-169.5	-17.1	0	0	111	M65 S68	M65-Q70 HydrophobicContact CE-CB 3.48Å; M65-Q70 VanDerWaalsContact CE-CB 3.48Å; S68-Q70 PolarHBondContact O-N 2.95Å
71	A	69.1	Low	77.4	Confident	21 Å²	21	71.8 Å²	71.8	17%	0.174	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-65.1	138.1	-176.1	0	0	0	0	0	112.7	L31 V34 M65	L31-A71 HydrophobicContact CD2-CB 3.59Å; L31-A71 WeakPolarHBondContact O-CB 3.41Å; V34-A71 HydrophobicContact CG2-CB 3.89Å; M65-A71 WeakPolarHBondContact CE-O 3.34Å
72	R	82.9	Confident	76.7	Confident	170 Å²	170	77.3 Å²	77.3	64%	0.642	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71	151.7	176.3	-76.3	-178.8	165.3	176.5	-6.7	111.8	S32 A33 V34 N62	S32-R72 PolarHBondContact O-N 2.84Å; S32-R72 VanDerWaalsContact O-N 3.14Å; A33-R72 CarbonylContact C-O 3.29Å; A33-R72 WeakPolarHBondContact CA-O 3.37Å; V34-R72 PolarHBondContact N-O 3.44Å; N62-R72 WeakPolarHBondContact OD1-CA 3.5Å
73	V	87.4	Confident	76.1	Confident	5 Å²	5	78.1 Å²	78.1	3%	0.03	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	125.1	179.1	178.5	0	0	0	0	111.1	M36 R58 I61 N62 M65 V75 V321 V325	M36-V73 HydrophobicContact CE-CG1 3.45Å; M36-V73 VanDerWaalsContact CE-CG1 3.45Å; R58-V73 VanDerWaalsContact CG-O 3.3Å; R58-V73 WeakPolarHBondContact CG-O 3.44Å; I61-V73 HydrophobicContact CG2-CB 4.44Å; I61-V73 HydrophobicContact CG2-CG2 3.77Å; N62-V73 PolarHBondContact ND2-O 3.35Å; N62-V73 PolarHBondContact OD1-N 3.37Å; M65-V73 HydrophobicContact SD-CG2 4.46Å; V73-V75 HydrophobicContact CG1-CG2 4.47Å; V73-V321 HydrophobicContact CG1-CG1 4.44Å; V73-V325 HydrophobicContact CG1-CG2 4.04Å; V73-V325 HydrophobicContact CG2-CG1 4.35Å; V73-V325 HydrophobicContact CG2-CG2 3.78Å
74	E	90.1	Very high	76.1	Confident	71 Å²	71	75 Å²	75	33%	0.332	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	138.5	173.3	-72.8	-177.3	177.7	0	0	110.5	A33 V34 R35 M36	A33-E74 HydrophobicContact CB-CG 4.03Å; V34-E74 PolarHBondContact O-N 3.3Å; R35-E74 WeakPolarHBondContact CA-O 3.18Å; R35-E74 HydrophobicContact CB-CB 4.35Å; R35-E74 HydrophobicContact CG-CB 4.25Å; R35-E74 IonicContact CZ-OE2 3.2Å; R35-E74 IonicContact NE-OE2 2.84Å; R35-E74 PolarHBondContact NE-OE2 3.45Å; R35-E74 IonicContact NH2-OE2 2.7Å; R35-E74 PolarHBondContact NH2-OE2 3.29Å; M36-E74 PolarHBondContact N-O 2.99Å
75	V	91.4	Very high	76.4	Confident	18 Å²	18	74.5 Å²	74.5	11%	0.109	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	111.5	173.9	-176.3	0	0	0	0	108.2	M36 A38 L54 V73 V321	M36-V75 HydrophobicContact CE-CG2 4.28Å; A38-V75 HydrophobicContact CB-CG1 3.91Å; L54-V75 HydrophobicContact CD2-CG1 4.36Å; V73-V75 HydrophobicContact CG1-CG2 4.47Å; V75-V321 HydrophobicContact CG2-CG1 4.28Å; V75-V321 HydrophobicContact CG2-CG2 4.33Å
76	D	92.1	Very high	77.3	Confident	39 Å²	39	81.2 Å²	81.2	21%	0.209	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	119.6	174.3	-82	10.6	0	0	0	109.3	M36 A37 A38 Y78 K98	M36-D76 PolarHBondContact O-N 3.44Å; A37-D76 CarbonylContact C-O 3.6Å; A37-D76 WeakPolarHBondContact CA-O 3.03Å; A38-D76 PolarHBondContact N-O 3.37Å; D76-Y78 HydrophobicContact CB-CE2 3.81Å; D76-K98 WeakPolarHBondContact OD2-CD 3.38Å; D76-K98 WeakPolarHBondContact OD2-CE 3.38Å; D76-K98 IonicContact OD2-NZ 3.9Å; D76-K98 PolarHBondContact OD2-NZ 3.05Å
77	V	90.6	Very high	78.7	Confident	47 Å²	47	76.6 Å²	76.6	29%	0.285	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	131.5	-177.8	-177.2	0	0	0	0	110.3	A38 L40 L54	A38-V77 WeakPolarHBondContact O-CA 3.41Å; L40-V77 HydrophobicContact CD1-CG1 3.51Å; L40-V77 HydrophobicContact CG-CG1 3.83Å; L54-V77 HydrophobicContact CD1-CG2 4.08Å
78	Y	89.8	Confident	80.4	Confident	28 Å²	28	68.8 Å²	68.8	11%	0.11	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	142.8	175.9	-65.1	-101.5	0	0	0	109.5	A37 A38 L40 D76 T91 I95 K98	A37-Y78 HydrophobicContact CB-CD2 4.44Å; A37-Y78 HydrophobicContact CB-CE2 4.17Å; A38-Y78 PolarHBondContact O-N 3.3Å; L40-Y78 PolarHBondContact N-O 3.43Å; D76-Y78 HydrophobicContact CB-CE2 3.81Å; Y78-T91 HydrophobicContact CD1-CG2 3.54Å; Y78-T91 HydrophobicContact CE1-CG2 4.28Å; Y78-T91 HydrophobicContact CG-CG2 3.85Å; Y78-I95 HydrophobicContact CD1-CG1 4.42Å; Y78-I95 HydrophobicContact CD2-CD1 3.94Å; Y78-I95 HydrophobicContact CD2-CG1 3.96Å; Y78-I95 HydrophobicContact CE1-CG1 3.93Å; Y78-I95 HydrophobicContact CE2-CD1 3.96Å; Y78-I95 HydrophobicContact CE2-CG1 3.45Å; Y78-I95 VanDerWaalsContact CE2-CG1 3.45Å; Y78-I95 HydrophobicContact CG-CD1 4.26Å; Y78-I95 HydrophobicContact CG-CG1 4.41Å; Y78-K98 WeakPolarHBondContact OH-CD 3.33Å; Y78-K98 WeakPolarHBondContact OH-CE 3.41Å; Y78-K98 PolarHBondContact OH-NZ 3.43Å
79	E	86.5	Confident	82.2	Confident	99 Å²	99	68.6 Å²	68.6	46%	0.463	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	122.8	-176.9	-70	167.1	179.4	0	0	108.6	L40 R51	L40-E79 HydrophobicContact CB-CG 4.36Å; R51-E79 IonicContact CZ-OE1 3.7Å; R51-E79 IonicContact NH1-OE1 3.69Å; R51-E79 PolarHBondContact NH1-OE1 3.48Å; R51-E79 IonicContact NH1-OE2 2.67Å
80	L	83.6	Confident	84	Confident	4 Å²	4	66.5 Å²	66.5	2%	0.021	32%	0.317	C	S	.	.			trans	-104.1	167.6	-177.5	-73.9	-179.2	0	0	0	112.6	I39 L40 Q43 D87 T88 T91	I39-L80 HydrophobicContact CG2-CD1 3.36Å; I39-L80 HydrophobicContact CG2-CG 3.81Å; L40-L80 PolarHBondContact O-N 2.99Å; Q43-L80 PolarHBondContact NE2-O 3.12Å; L80-D87 HydrophobicContact CD2-CB 4.05Å; L80-T88 HydrophobicContact CD1-CG2 4.26Å; L80-T88 WeakPolarHBondContact CD1-OG1 3.16Å; L80-T91 HydrophobicContact CD2-CG2 4.27Å; L80-T91 VanDerWaalsContact CD2-OG1 3.31Å; L80-T91 WeakPolarHBondContact CD2-OG1 3.44Å
81	Q	77.1	Confident	85.3	Confident	125 Å²	125	63.2 Å²	63.2	58%	0.584	30%	0.302	S	S	*	.			trans	-85.1	140.1	156.4	-69.1	-170.2	15	0	0	109.9	D83 S84	Q81-D83 PolarHBondContact O-N 3.2Å; Q81-S84 PolarHBondContact O-N 3.44Å
82	K	71.5	Confident	86.4	Confident	124 Å²	124	62.2 Å²	62.2	54%	0.539	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	127.8	-174.8	176.4	147.5	-166.9	150.1	0	112.9	S84 S108	K82-S84 PolarHBondContact O-N 3.49Å; K82-S108 WeakPolarHBondContact CE-O 3.21Å; K82-S108 PolarHBondContact NZ-O 3.21Å
83	D	74.9	Confident	86.8	Confident	48 Å²	48	56.1 Å²	56.1	26%	0.257	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	16.4	178	-67.2	-59	0	0	0	116.4	Q81 Q85 S109 A111	Q81-D83 PolarHBondContact O-N 3.2Å; D83-Q85 PolarHBondContact O-N 3.04Å; D83-Q85 VanDerWaalsContact O-N 3.15Å; D83-S109 PolarHBondContact N-OG 3.02Å; D83-S109 WeakPolarHBondContact OD1-CA 3.4Å; D83-S109 WeakPolarHBondContact OD1-CB 3.29Å; D83-A111 HydrophobicContact CB-CB 3.97Å; D83-A111 VanDerWaalsContact OD1-CB 3.29Å; D83-A111 WeakPolarHBondContact OD1-CB 3.33Å; D83-A111 PolarHBondContact OD1-N 3.1Å; D83-A111 VanDerWaalsContact OD1-N 3.11Å
84	S	83.5	Confident	87	Confident	29 Å²	29	60.9 Å²	60.9	20%	0.203	30%	0.299	C	S	.	.			trans	-77.1	99.5	178.6	-177.5	0	0	0	0	112.5	Q81 K82 Y86 D87 T88	Q81-S84 PolarHBondContact O-N 3.44Å; K82-S84 PolarHBondContact O-N 3.49Å; S84-Y86 VanDerWaalsContact C-N 3.27Å; S84-Y86 PolarHBondContact O-N 3.36Å; S84-D87 WeakPolarHBondContact CB-OD2 3.28Å; S84-D87 PolarHBondContact O-N 3.47Å; S84-D87 PolarHBondContact OG-N 3.47Å; S84-D87 PolarHBondContact OG-OD2 3.33Å; S84-T88 VanDerWaalsContact O-CB 3.31Å; S84-T88 WeakPolarHBondContact O-CB 3.19Å; S84-T88 PolarHBondContact O-N 3.21Å; S84-T88 PolarHBondContact O-OG1 2.93Å
85	Q	83.3	Confident	87.1	Confident	119 Å²	119	57.5 Å²	57.5	56%	0.556	28%	0.283	S	S	*	.	H	α-helix	trans	-60.6	-33	178.9	-65.4	-176	-2.4	0	0	113.5	D83 T89	D83-Q85 PolarHBondContact O-N 3.04Å; D83-Q85 VanDerWaalsContact O-N 3.15Å; Q85-T89 WeakPolarHBondContact O-CB 3.34Å; Q85-T89 PolarHBondContact O-N 3.19Å; Q85-T89 VanDerWaalsContact O-N 3.09Å; Q85-T89 PolarHBondContact O-OG1 3.01Å
86	Y	87.3	Confident	87	Confident	177 Å²	177	56.8 Å²	56.8	69%	0.694	28%	0.279	S	S	*	.	H	α-helix	trans	-69.4	-53.4	179.5	179	-102	0	0	0	111.2	S84 T88 T89 D90	S84-Y86 VanDerWaalsContact C-N 3.27Å; S84-Y86 PolarHBondContact O-N 3.36Å; Y86-T88 VanDerWaalsContact C-N 3.26Å; Y86-T88 PolarHBondContact O-N 2.91Å; Y86-T89 WeakPolarHBondContact O-CA 3.4Å; Y86-T89 WeakPolarHBondContact O-CB 3.45Å; Y86-T89 PolarHBondContact O-N 3.03Å; Y86-D90 PolarHBondContact O-N 3.06Å
87	D	87.4	Confident	86.9	Confident	55 Å²	55	58.4 Å²	58.4	29%	0.294	29%	0.291	S	S	.	.	H	α-helix	trans	-64.7	-34.7	-179.6	-53.8	-40.8	0	0	0	111.2	L80 S84 T89 T91	L80-D87 HydrophobicContact CD2-CB 4.05Å; S84-D87 WeakPolarHBondContact CB-OD2 3.28Å; S84-D87 PolarHBondContact O-N 3.47Å; S84-D87 PolarHBondContact OG-N 3.47Å; S84-D87 PolarHBondContact OG-OD2 3.33Å; D87-T89 VanDerWaalsContact C-N 3.32Å; D87-T89 PolarHBondContact O-N 3.21Å; D87-T91 WeakPolarHBondContact O-CB 3.19Å; D87-T91 PolarHBondContact O-N 2.98Å; D87-T91 PolarHBondContact O-OG1 3.26Å
88	T	89.6	Confident	86.8	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-59.3	-42.8	171.5	-54.7	0	0	0	0	111.6	L80 S84 Y86 M92 S112 T115 I116	L80-T88 HydrophobicContact CD1-CG2 4.26Å; L80-T88 WeakPolarHBondContact CD1-OG1 3.16Å; S84-T88 VanDerWaalsContact O-CB 3.31Å; S84-T88 WeakPolarHBondContact O-CB 3.19Å; S84-T88 PolarHBondContact O-N 3.21Å; S84-T88 PolarHBondContact O-OG1 2.93Å; Y86-T88 VanDerWaalsContact C-N 3.26Å; Y86-T88 PolarHBondContact O-N 2.91Å; T88-M92 VanDerWaalsContact O-CB 3.31Å; T88-M92 WeakPolarHBondContact O-CB 3.41Å; T88-M92 PolarHBondContact O-N 3.46Å; T88-S112 VanDerWaalsContact OG1-CB 3.27Å; T88-S112 WeakPolarHBondContact OG1-CB 3.44Å; T88-S112 PolarHBondContact OG1-OG 3.29Å; T88-T115 HydrophobicContact CG2-CG2 4.11Å; T88-I116 HydrophobicContact CG2-CD1 4.03Å; T88-I116 HydrophobicContact CG2-CG1 3.59Å
89	T	90.3	Very high	86.7	Confident	56 Å²	56	59.5 Å²	59.5	34%	0.344	30%	0.296	S	S	.	.	H	α-helix	trans	-69.1	-47.7	-179.9	-57.6	0	0	0	0	111.1	Q85 Y86 D87 M92 C93 I119	Q85-T89 WeakPolarHBondContact O-CB 3.34Å; Q85-T89 PolarHBondContact O-N 3.19Å; Q85-T89 VanDerWaalsContact O-N 3.09Å; Q85-T89 PolarHBondContact O-OG1 3.01Å; Y86-T89 WeakPolarHBondContact O-CA 3.4Å; Y86-T89 WeakPolarHBondContact O-CB 3.45Å; Y86-T89 PolarHBondContact O-N 3.03Å; D87-T89 VanDerWaalsContact C-N 3.32Å; D87-T89 PolarHBondContact O-N 3.21Å; T89-M92 PolarHBondContact O-N 2.81Å; T89-C93 PolarHBondContact O-N 3.28Å; T89-C93 PolarHBondContact O-SG 3.02Å; T89-I119 HydrophobicContact CG2-CD1 4.32Å
90	D	90.9	Very high	86.9	Confident	75 Å²	75	55.1 Å²	55.1	40%	0.401	28%	0.276	S	S	.	.	H	α-helix	trans	-62.1	-47.9	178.4	-171.4	79.3	0	0	0	111.6	Y86 M92 C93 Q94	Y86-D90 PolarHBondContact O-N 3.06Å; D90-M92 VanDerWaalsContact C-N 3.3Å; D90-M92 PolarHBondContact O-N 2.92Å; D90-C93 CarbonylContact O-C 3.3Å; D90-C93 WeakPolarHBondContact O-CA 3.19Å; D90-C93 WeakPolarHBondContact O-CB 3.38Å; D90-C93 PolarHBondContact O-N 3.34Å; D90-Q94 WeakPolarHBondContact O-CG 3.16Å; D90-Q94 PolarHBondContact O-N 3.32Å; D90-Q94 PolarHBondContact OD2-NE2 2.96Å
91	T	91.5	Very high	87.2	Confident	17 Å²	17	55 Å²	55	10%	0.104	28%	0.275	C	S	.	.	H	α-helix	trans	-56.5	-42.9	175.9	-57.9	0	0	0	0	111.4	Y78 L80 D87 C93 Q94 I95	Y78-T91 HydrophobicContact CD1-CG2 3.54Å; Y78-T91 HydrophobicContact CE1-CG2 4.28Å; Y78-T91 HydrophobicContact CG-CG2 3.85Å; L80-T91 HydrophobicContact CD2-CG2 4.27Å; L80-T91 VanDerWaalsContact CD2-OG1 3.31Å; L80-T91 WeakPolarHBondContact CD2-OG1 3.44Å; D87-T91 WeakPolarHBondContact O-CB 3.19Å; D87-T91 PolarHBondContact O-N 2.98Å; D87-T91 PolarHBondContact O-OG1 3.26Å; T91-C93 VanDerWaalsContact C-N 3.29Å; T91-C93 PolarHBondContact O-N 2.82Å; T91-Q94 CarbonylContact O-C 3.15Å; T91-Q94 WeakPolarHBondContact O-CA 3.4Å; T91-Q94 WeakPolarHBondContact O-CB 3.38Å; T91-Q94 PolarHBondContact O-N 3.13Å; T91-I95 HydrophobicContact CG2-CD1 4.06Å; T91-I95 WeakPolarHBondContact O-CG1 3.34Å; T91-I95 PolarHBondContact O-N 3.23Å
92	M	91.8	Very high	87.9	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-63.9	-35.3	175.5	-172.1	60	-177.7	0	0	112.2	T88 T89 D90 Q94 I95 L96 V103 I119 C120	T88-M92 VanDerWaalsContact O-CB 3.31Å; T88-M92 WeakPolarHBondContact O-CB 3.41Å; T88-M92 PolarHBondContact O-N 3.46Å; T89-M92 PolarHBondContact O-N 2.81Å; D90-M92 VanDerWaalsContact C-N 3.3Å; D90-M92 PolarHBondContact O-N 2.92Å; M92-Q94 VanDerWaalsContact C-N 3.31Å; M92-Q94 PolarHBondContact O-N 2.81Å; M92-I95 PolarHBondContact O-N 3.09Å; M92-I95 HydrophobicContact SD-CB 4.38Å; M92-I95 HydrophobicContact SD-CD1 4.48Å; M92-I95 HydrophobicContact SD-CG2 4.33Å; M92-L96 HydrophobicContact CE-CD2 3.85Å; M92-L96 HydrophobicContact CE-CG 4.17Å; M92-L96 WeakPolarHBondContact O-CG 3.43Å; M92-L96 PolarHBondContact O-N 3.45Å; M92-V103 HydrophobicContact CE-CG2 4.08Å; M92-V103 HydrophobicContact SD-CG2 4.17Å; M92-I119 HydrophobicContact CB-CD1 3.92Å; M92-I119 HydrophobicContact CE-CB 4.38Å; M92-I119 HydrophobicContact CE-CG2 3.91Å; M92-I119 HydrophobicContact CG-CB 3.98Å; M92-I119 HydrophobicContact CG-CD1 3.8Å; M92-I119 HydrophobicContact CG-CG1 4.5Å; M92-I119 HydrophobicContact CG-CG2 3.6Å; M92-C120 WeakPolarHBondContact CE-SG 3.36Å
93	C	91.6	Very high	88.9	Confident	43 Å²	43	43.1 Å²	43.1	29%	0.291	22%	0.221	S	C	.	.	H	α-helix	trans	-72.9	-19.1	172.7	-56.9	0	0	0	0	113.8	T89 D90 T91 P97 C344	T89-C93 PolarHBondContact O-N 3.28Å; T89-C93 PolarHBondContact O-SG 3.02Å; D90-C93 CarbonylContact O-C 3.3Å; D90-C93 WeakPolarHBondContact O-CA 3.19Å; D90-C93 WeakPolarHBondContact O-CB 3.38Å; D90-C93 PolarHBondContact O-N 3.34Å; T91-C93 VanDerWaalsContact C-N 3.29Å; T91-C93 PolarHBondContact O-N 2.82Å; C93-P97 WeakPolarHBondContact O-CD 3.36Å; C93-P97 WeakPolarHBondContact O-CG 3.36Å; C93-C344 WeakPolarHBondContact CA-SG 3.25Å; C93-C344 HydrophobicContact CB-CB 3.99Å; C93-C344 WeakPolarHBondContact CB-SG 3.27Å; C93-C344 WeakPolarHBondContact SG-CB 3.36Å; C93-C344 CovalentContact SG-SG 2.04Å; C93-C344 PolarHBondContact SG-SG 2.93Å
94	Q	91.3	Very high	89.9	Confident	104 Å²	104	40.8 Å²	40.8	49%	0.486	21%	0.209	S	C	.	.	H	α-helix	trans	-81.5	-24.4	166.1	-59.7	-179.9	31.6	0	0	113.1	D90 T91 M92	D90-Q94 WeakPolarHBondContact O-CG 3.16Å; D90-Q94 PolarHBondContact O-N 3.32Å; D90-Q94 PolarHBondContact OD2-NE2 2.96Å; T91-Q94 CarbonylContact O-C 3.15Å; T91-Q94 WeakPolarHBondContact O-CA 3.4Å; T91-Q94 WeakPolarHBondContact O-CB 3.38Å; T91-Q94 PolarHBondContact O-N 3.13Å; M92-Q94 VanDerWaalsContact C-N 3.31Å; M92-Q94 PolarHBondContact O-N 2.81Å
95	I	92.1	Very high	90.2	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-77.4	-50.3	178.3	-74.2	163.6	0	0	0	111.6	A37 I39 Y78 T91 M92 P97 K98 V100 V103	A37-I95 HydrophobicContact CB-CD1 3.94Å; A37-I95 HydrophobicContact CB-CG1 4.02Å; A37-I95 HydrophobicContact CB-CG2 3.7Å; I39-I95 HydrophobicContact CD1-CD1 3.83Å; I39-I95 HydrophobicContact CG1-CD1 4.04Å; Y78-I95 HydrophobicContact CD1-CG1 4.42Å; Y78-I95 HydrophobicContact CD2-CD1 3.94Å; Y78-I95 HydrophobicContact CD2-CG1 3.96Å; Y78-I95 HydrophobicContact CE1-CG1 3.93Å; Y78-I95 HydrophobicContact CE2-CD1 3.96Å; Y78-I95 HydrophobicContact CE2-CG1 3.45Å; Y78-I95 VanDerWaalsContact CE2-CG1 3.45Å; Y78-I95 HydrophobicContact CG-CD1 4.26Å; Y78-I95 HydrophobicContact CG-CG1 4.41Å; T91-I95 HydrophobicContact CG2-CD1 4.06Å; T91-I95 WeakPolarHBondContact O-CG1 3.34Å; T91-I95 PolarHBondContact O-N 3.23Å; M92-I95 PolarHBondContact O-N 3.09Å; M92-I95 HydrophobicContact SD-CB 4.38Å; M92-I95 HydrophobicContact SD-CD1 4.48Å; M92-I95 HydrophobicContact SD-CG2 4.33Å; I95-P97 VanDerWaalsContact C-CD 3.46Å; I95-K98 WeakPolarHBondContact O-CB 3.27Å; I95-K98 PolarHBondContact O-N 3.37Å; I95-V100 HydrophobicContact CG2-CG1 4.13Å; I95-V100 HydrophobicContact CG2-CG2 3.69Å; I95-V103 HydrophobicContact CG2-CG2 4.21Å
96	L	90.8	Very high	90.5	Very high	3 Å²	3	34.2 Å²	34.2	2%	0.016	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-52.4	-40.2	-174.5	-71	176.2	0	0	0	115	M92 K98 G99 I119 K123 I125 L342 C344	M92-L96 HydrophobicContact CE-CD2 3.85Å; M92-L96 HydrophobicContact CE-CG 4.17Å; M92-L96 WeakPolarHBondContact O-CG 3.43Å; M92-L96 PolarHBondContact O-N 3.45Å; L96-K98 VanDerWaalsContact C-N 3.26Å; L96-K98 PolarHBondContact O-N 3.33Å; L96-G99 PolarHBondContact O-N 2.86Å; L96-I119 HydrophobicContact CD1-CG2 4.21Å; L96-K123 HydrophobicContact CD1-CG 4.06Å; L96-K123 HydrophobicContact CD2-CG 4.26Å; L96-I125 HydrophobicContact CD2-CD1 3.33Å; L96-L342 CarbonylContact C-O 3.58Å; L96-L342 HydrophobicContact CB-CB 4.31Å; L96-L342 WeakPolarHBondContact CB-O 2.99Å; L96-L342 HydrophobicContact CD2-CB 4.4Å; L96-L342 PolarHBondContact O-N 3Å; L96-C344 HydrophobicContact CD1-CB 4.45Å
97	P	90.4	Very high	90.4	Very high	73 Å²	73	26.2 Å²	26.2	47%	0.474	15%	0.147	S	C	.	.	G	3₁₀ helix	trans	-70.6	-15.9	-180	-21.7	35.3	0	0	0	114.5	C93 I95 G99 P341 L342	C93-P97 WeakPolarHBondContact O-CD 3.36Å; C93-P97 WeakPolarHBondContact O-CG 3.36Å; I95-P97 VanDerWaalsContact C-CD 3.46Å; P97-G99 VanDerWaalsContact C-N 3.29Å; P97-P341 VanDerWaalsContact O-CB 3.23Å; P97-P341 WeakPolarHBondContact O-CB 3.46Å; P97-L342 WeakPolarHBondContact CA-O 3.49Å
98	K	88.4	Confident	90.1	Very high	89 Å²	89	26.8 Å²	26.8	39%	0.387	16%	0.155	S	C	.	.	G	3₁₀ helix	trans	-77.4	-14.2	178	-69.8	-170.4	176.3	174.5	0	114.1	R35 D76 Y78 I95 L96	R35-K98 PolarHBondContact NH1-O 2.94Å; D76-K98 WeakPolarHBondContact OD2-CD 3.38Å; D76-K98 WeakPolarHBondContact OD2-CE 3.38Å; D76-K98 IonicContact OD2-NZ 3.9Å; D76-K98 PolarHBondContact OD2-NZ 3.05Å; Y78-K98 WeakPolarHBondContact OH-CD 3.33Å; Y78-K98 WeakPolarHBondContact OH-CE 3.41Å; Y78-K98 PolarHBondContact OH-NZ 3.43Å; I95-K98 WeakPolarHBondContact O-CB 3.27Å; I95-K98 PolarHBondContact O-N 3.37Å; L96-K98 VanDerWaalsContact C-N 3.26Å; L96-K98 PolarHBondContact O-N 3.33Å
99	G	86.3	Confident	89.9	Confident	10 Å²	10	26.8 Å²	26.8	10%	0.103	16%	0.155	C	C	.	.			trans	67.1	90.4	-172.8	0	0	0	0	0	111.6	L96 P97 V339	L96-G99 PolarHBondContact O-N 2.86Å; P97-G99 VanDerWaalsContact C-N 3.29Å; G99-V339 VanDerWaalsContact C-CG1 3.48Å
100	V	90.6	Very high	89.4	Confident	6 Å²	6	25.1 Å²	25.1	4%	0.036	15%	0.145	C	C	.	.			trans	-113.9	144.7	177.7	-59.3	0	0	0	0	111.2	R35 A37 I95 V103	R35-V100 HydrophobicContact CG-CG1 4.24Å; R35-V100 CarbonylContact O-C 3.54Å; R35-V100 VanDerWaalsContact O-CA 3.28Å; R35-V100 WeakPolarHBondContact O-CA 3.26Å; A37-V100 HydrophobicContact CB-CG1 4.2Å; I95-V100 HydrophobicContact CG2-CG1 4.13Å; I95-V100 HydrophobicContact CG2-CG2 3.69Å; V100-V103 HydrophobicContact CG2-CG2 4.16Å
101	V	89.9	Confident	89	Confident	1 Å²	1	22.8 Å²	22.8	1%	0.006	14%	0.137	C	C	.	.	S	Bend	trans	-82.1	-23	178.1	-59	0	0	0	0	113.1	V34 R35 M36 P126 V324 V328 V339 W350 L356	V34-V101 HydrophobicContact CG1-CG1 4.27Å; V34-V101 HydrophobicContact CG1-CG2 3.7Å; R35-V101 PolarHBondContact O-N 2.98Å; M36-V101 HydrophobicContact CG-CG2 3.8Å; V101-P126 WeakPolarHBondContact O-CD 3.48Å; V101-V324 HydrophobicContact CG2-CG1 4.22Å; V101-V328 HydrophobicContact CB-CG2 4.49Å; V101-V328 HydrophobicContact CG2-CG2 4.15Å; V101-V339 HydrophobicContact CG1-CG2 3.66Å; V101-W350 HydrophobicContact CB-CH2 3.99Å; V101-W350 HydrophobicContact CG1-CH2 4.15Å; V101-W350 HydrophobicContact CG1-CZ2 4.46Å; V101-W350 WeakPolarHBondContact O-CZ3 3.46Å; V101-L356 HydrophobicContact CB-CD2 4.28Å
102	S	92	Very high	88.7	Confident	0 Å²	0	22 Å²	22	0%	0	13%	0.132	C	C	.	.			trans	-161.7	156.6	179.7	-174.3	0	0	0	0	110.3	A37 P126	A37-S102 PolarHBondContact N-O 3.17Å; A37-S102 VanDerWaalsContact N-O 3.14Å; S102-P126 VanDerWaalsContact CA-O 3.26Å; S102-P126 WeakPolarHBondContact CA-O 3.46Å; S102-P126 WeakPolarHBondContact CB-O 3.47Å; S102-P126 PolarHBondContact OG-O 2.97Å
103	V	93.9	Very high	88.4	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	130.7	169.5	-176.6	0	0	0	0	108.8	A37 I39 M92 I95 V100 I116 I125 P126 H127 V128	A37-V103 HydrophobicContact CB-CG2 4.5Å; A37-V103 CarbonylContact O-C 3.45Å; A37-V103 WeakPolarHBondContact O-CA 3.42Å; I39-V103 HydrophobicContact CD1-CG1 3.81Å; I39-V103 HydrophobicContact CG1-CG1 4.36Å; M92-V103 HydrophobicContact CE-CG2 4.08Å; M92-V103 HydrophobicContact SD-CG2 4.17Å; I95-V103 HydrophobicContact CG2-CG2 4.21Å; V100-V103 HydrophobicContact CG2-CG2 4.16Å; V103-I116 HydrophobicContact CB-CG2 4.49Å; V103-I116 HydrophobicContact CG1-CG2 3.95Å; V103-I125 HydrophobicContact CG2-CG2 4.33Å; V103-P126 PolarHBondContact N-O 3.17Å; V103-H127 WeakPolarHBondContact O-CA 3.32Å; V103-H127 PolarHBondContact O-CD2 2.71Å; V103-V128 PolarHBondContact O-N 3.17Å
104	I	94.4	Very high	88.1	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	122.4	170	-52.2	171.4	0	0	0	107.6	A37 A38 I39 L54 V128 I130 M317 A320 V321	A37-I104 PolarHBondContact O-N 3.09Å; A38-I104 HydrophobicContact CB-CB 4.27Å; I39-I104 PolarHBondContact N-O 3.42Å; L54-I104 HydrophobicContact CD2-CD1 4.33Å; I104-V128 WeakPolarHBondContact CA-O 3.48Å; I104-I130 HydrophobicContact CG2-CG2 4.43Å; I104-M317 HydrophobicContact CG2-CE 4.06Å; I104-M317 HydrophobicContact CG2-SD 3.66Å; I104-A320 HydrophobicContact CD1-CB 3.94Å; I104-A320 HydrophobicContact CG1-CB 4.35Å; I104-A320 HydrophobicContact CG2-CB 4.1Å; I104-V321 HydrophobicContact CD1-CG2 3.81Å
105	G	90	Very high	87.9	Confident	2 Å²	2	18.8 Å²	18.8	2%	0.021	12%	0.122	C	C	.	.	P	Polyproline II helix	trans	-82.1	166.8	-176.4	0	0	0	0	0	114.3	I39 H127 V128	I39-G105 CarbonylContact O-C 3.58Å; G105-H127 WeakPolarHBondContact CA-NE2 3.49Å; G105-V128 PolarHBondContact N-O 3.44Å
106	P	89.5	Confident	87.8	Confident	8 Å²	8	18.8 Å²	18.8	5%	0.052	12%	0.122	C	C	.	.	P	Polyproline II helix	trans	-65.5	159.5	178.8	27.3	-34.6	0	0	0	113	I39 D41 I116	I39-P106 HydrophobicContact CG2-CG 4.46Å; I39-P106 VanDerWaalsContact O-CA 3.26Å; I39-P106 WeakPolarHBondContact O-CA 3.48Å; D41-P106 HydrophobicContact CB-CB 3.75Å; D41-P106 VanDerWaalsContact OD1-CB 3.27Å; D41-P106 WeakPolarHBondContact OD1-CB 3.29Å; P106-I116 VanDerWaalsContact CD-CD1 3.44Å; P106-I116 HydrophobicContact CG-CD1 4.26Å
107	A	84.9	Confident	87.7	Confident	9 Å²	9	19 Å²	19	7%	0.074	12%	0.124	C	C	.	.	S	Bend	trans	-89.8	-39.7	-177.7	0	0	0	0	0	112.9	D41 I130 G131 S313	D41-A107 PolarHBondContact OD1-N 3.31Å; A107-I130 HydrophobicContact CB-CD1 3.91Å; A107-I130 HydrophobicContact CB-CG1 4.15Å; A107-G131 WeakPolarHBondContact O-CA 3.45Å; A107-S313 VanDerWaalsContact CB-CB 3.46Å
108	S	81.9	Confident	87.5	Confident	66 Å²	66	21 Å²	21	46%	0.462	13%	0.127	S	C	.	.	S	Bend	trans	-113	4.9	-168.4	-68.8	0	0	0	0	114.5	D41 K82	D41-S108 PolarHBondContact OD1-N 2.84Å; D41-S108 WeakPolarHBondContact OD2-CA 3.28Å; D41-S108 WeakPolarHBondContact OD2-CB 3.11Å; D41-S108 PolarHBondContact OD2-N 3.11Å; K82-S108 WeakPolarHBondContact CE-O 3.21Å; K82-S108 PolarHBondContact NZ-O 3.21Å
109	S	84.7	Confident	87.5	Confident	1 Å²	1	17.6 Å²	17.6	1%	0.007	11%	0.113	C	C	.	.			trans	-125	77.6	-177	-64.4	0	0	0	0	112.8	D41 D83 A111 S112 G113	D41-S109 WeakPolarHBondContact CB-OG 3.13Å; D41-S109 VanDerWaalsContact CG-OG 3.3Å; D41-S109 VanDerWaalsContact OD2-CB 3.31Å; D41-S109 WeakPolarHBondContact OD2-CB 3.4Å; D41-S109 PolarHBondContact OD2-N 3.14Å; D41-S109 PolarHBondContact OD2-OG 2.9Å; D83-S109 PolarHBondContact N-OG 3.02Å; D83-S109 WeakPolarHBondContact OD1-CA 3.4Å; D83-S109 WeakPolarHBondContact OD1-CB 3.29Å; S109-A111 VanDerWaalsContact C-N 3.26Å; S109-A111 PolarHBondContact O-N 3.45Å; S109-S112 PolarHBondContact O-N 3.42Å; S109-G113 PolarHBondContact O-N 2.84Å
110	P	80.7	Confident	87.6	Confident	20 Å²	20	17.2 Å²	17.2	13%	0.13	11%	0.108	C	C	.	.	H	α-helix	trans	-66.2	-24.1	-176.5	-24.7	39.2	0	0	0	113.9	G113 S114 P132 E134	P110-G113 PolarHBondContact O-N 3.18Å; P110-S114 PolarHBondContact O-N 2.98Å; P110-P132 HydrophobicContact CG-CG 4.3Å; P110-E134 HydrophobicContact CB-CB 3.99Å; P110-E134 HydrophobicContact CB-CG 3.93Å; P110-E134 WeakPolarHBondContact CB-OE2 3.5Å; P110-E134 HydrophobicContact CG-CB 4.47Å; P110-E134 HydrophobicContact CG-CG 3.84Å; P110-E134 WeakPolarHBondContact CG-OE2 3.4Å
111	A	81.4	Confident	87.5	Confident	27 Å²	27	17.7 Å²	17.7	22%	0.223	11%	0.114	C	C	.	.	H	α-helix	trans	-63	-49.5	173.5	0	0	0	0	0	110.4	D83 S109 G113 S114 T115	D83-A111 HydrophobicContact CB-CB 3.97Å; D83-A111 VanDerWaalsContact OD1-CB 3.29Å; D83-A111 WeakPolarHBondContact OD1-CB 3.33Å; D83-A111 PolarHBondContact OD1-N 3.1Å; D83-A111 VanDerWaalsContact OD1-N 3.11Å; S109-A111 VanDerWaalsContact C-N 3.26Å; S109-A111 PolarHBondContact O-N 3.45Å; A111-G113 VanDerWaalsContact C-N 3.35Å; A111-G113 PolarHBondContact O-N 2.96Å; A111-S114 WeakPolarHBondContact O-CB 3.45Å; A111-S114 PolarHBondContact O-N 3.28Å; A111-S114 VanDerWaalsContact O-N 3.15Å; A111-S114 PolarHBondContact O-OG 3.23Å; A111-T115 PolarHBondContact O-N 3.41Å; A111-T115 PolarHBondContact O-OG1 2.92Å
112	S	85.9	Confident	87.4	Confident	1 Å²	1	22.3 Å²	22.3	1%	0.007	14%	0.136	C	C	.	.	H	α-helix	trans	-59.5	-43.1	172.1	-65.2	0	0	0	0	111.9	T88 S109 S114 T115 I116	T88-S112 VanDerWaalsContact OG1-CB 3.27Å; T88-S112 WeakPolarHBondContact OG1-CB 3.44Å; T88-S112 PolarHBondContact OG1-OG 3.29Å; S109-S112 PolarHBondContact O-N 3.42Å; S112-S114 VanDerWaalsContact C-N 3.25Å; S112-S114 PolarHBondContact O-N 3.28Å; S112-T115 PolarHBondContact O-N 3.16Å; S112-T115 VanDerWaalsContact O-N 3.15Å; S112-I116 WeakPolarHBondContact O-CD1 3.37Å; S112-I116 VanDerWaalsContact O-CG1 3.32Å; S112-I116 WeakPolarHBondContact O-CG1 3.49Å; S112-I116 PolarHBondContact O-N 3.39Å
113	G	86.7	Confident	87.2	Confident	11 Å²	11	22.4 Å²	22.4	11%	0.113	14%	0.136	C	C	.	.	H	α-helix	trans	-58	-33.9	174.8	0	0	0	0	0	113.8	S109 P110 A111 S117 H127	S109-G113 PolarHBondContact O-N 2.84Å; P110-G113 PolarHBondContact O-N 3.18Å; A111-G113 VanDerWaalsContact C-N 3.35Å; A111-G113 PolarHBondContact O-N 2.96Å; G113-S117 WeakPolarHBondContact O-CB 3.43Å; G113-S117 PolarHBondContact O-N 2.99Å; G113-S117 VanDerWaalsContact O-N 3.09Å; G113-S117 PolarHBondContact O-OG 2.97Å; G113-H127 PolarHBondContact O-CE1 3.1Å
114	S	84.5	Confident	87	Confident	45 Å²	45	24.8 Å²	24.8	32%	0.315	15%	0.147	S	C	.	.	H	α-helix	trans	-70.1	-43.4	174.3	82.7	0	0	0	0	112.1	P110 A111 S112 S117 H118	P110-S114 PolarHBondContact O-N 2.98Å; A111-S114 WeakPolarHBondContact O-CB 3.45Å; A111-S114 PolarHBondContact O-N 3.28Å; A111-S114 VanDerWaalsContact O-N 3.15Å; A111-S114 PolarHBondContact O-OG 3.23Å; S112-S114 VanDerWaalsContact C-N 3.25Å; S112-S114 PolarHBondContact O-N 3.28Å; S114-S117 WeakPolarHBondContact O-CB 3.43Å; S114-S117 PolarHBondContact O-N 3.38Å; S114-H118 PolarHBondContact O-N 2.84Å
115	T	87.4	Confident	86.8	Confident	23 Å²	23	25 Å²	25	14%	0.141	15%	0.149	C	C	.	.	H	α-helix	trans	-62.2	-45.8	176.6	-53.4	0	0	0	0	111.6	T88 A111 S112 S117 H118 I119	T88-T115 HydrophobicContact CG2-CG2 4.11Å; A111-T115 PolarHBondContact O-N 3.41Å; A111-T115 PolarHBondContact O-OG1 2.92Å; S112-T115 PolarHBondContact O-N 3.16Å; S112-T115 VanDerWaalsContact O-N 3.15Å; T115-S117 VanDerWaalsContact C-N 3.31Å; T115-S117 PolarHBondContact O-N 3.48Å; T115-H118 PolarHBondContact O-N 3.1Å; T115-I119 HydrophobicContact CG2-CD1 4.2Å; T115-I119 PolarHBondContact O-N 2.67Å; T115-I119 VanDerWaalsContact O-N 3.16Å
116	I	89.2	Confident	86.8	Confident	0 Å²	0	25 Å²	25	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-58.9	-44.9	174.6	-63.6	157.1	0	0	0	110.1	I39 T88 V103 P106 S112 H118 I119 C120	I39-I116 HydrophobicContact CD1-CD1 3.61Å; I39-I116 HydrophobicContact CD1-CG1 4.01Å; I39-I116 HydrophobicContact CG2-CD1 4.34Å; T88-I116 HydrophobicContact CG2-CD1 4.03Å; T88-I116 HydrophobicContact CG2-CG1 3.59Å; V103-I116 HydrophobicContact CB-CG2 4.49Å; V103-I116 HydrophobicContact CG1-CG2 3.95Å; P106-I116 VanDerWaalsContact CD-CD1 3.44Å; P106-I116 HydrophobicContact CG-CD1 4.26Å; S112-I116 WeakPolarHBondContact O-CD1 3.37Å; S112-I116 VanDerWaalsContact O-CG1 3.32Å; S112-I116 WeakPolarHBondContact O-CG1 3.49Å; S112-I116 PolarHBondContact O-N 3.39Å; I116-H118 VanDerWaalsContact C-N 3.29Å; I116-H118 PolarHBondContact O-N 2.86Å; I116-I119 PolarHBondContact O-N 2.89Å; I116-C120 WeakPolarHBondContact O-CB 3.32Å; I116-C120 PolarHBondContact O-N 2.88Å; I116-C120 PolarHBondContact O-SG 3.5Å; I116-C120 VanDerWaalsContact O-SG 3.34Å
117	S	87.9	Confident	86.9	Confident	8 Å²	8	24.7 Å²	24.7	6%	0.056	15%	0.146	C	C	.	.	H	α-helix	trans	-58.8	-38.7	178.2	-57.9	0	0	0	0	113	G113 S114 T115 G121 H127 K129	G113-S117 WeakPolarHBondContact O-CB 3.43Å; G113-S117 PolarHBondContact O-N 2.99Å; G113-S117 VanDerWaalsContact O-N 3.09Å; G113-S117 PolarHBondContact O-OG 2.97Å; S114-S117 WeakPolarHBondContact O-CB 3.43Å; S114-S117 PolarHBondContact O-N 3.38Å; T115-S117 VanDerWaalsContact C-N 3.31Å; T115-S117 PolarHBondContact O-N 3.48Å; S117-G121 PolarHBondContact O-N 3.06Å; S117-H127 PolarHBondContact OG-CE1 3.32Å; S117-H127 VanDerWaalsContact OG-CE1 3.25Å; S117-H127 PolarHBondContact OG-ND1 3.46Å; S117-K129 WeakPolarHBondContact OG-CE 3.38Å
118	H	86.3	Confident	87.3	Confident	114 Å²	114	24.2 Å²	24.2	53%	0.528	14%	0.142	S	C	.	.	H	α-helix	trans	-65.8	-51.2	177.1	-173.8	-76.2	0	0	0	111.6	S114 T115 I116 G121 E122	S114-H118 PolarHBondContact O-N 2.84Å; T115-H118 PolarHBondContact O-N 3.1Å; I116-H118 VanDerWaalsContact C-N 3.29Å; I116-H118 PolarHBondContact O-N 2.86Å; H118-G121 PolarHBondContact O-N 3.38Å; H118-E122 PolarHBondContact O-N 2.9Å
119	I	88.6	Confident	87.7	Confident	18 Å²	18	22.9 Å²	22.9	9%	0.092	13%	0.128	C	C	.	.	H	α-helix	trans	-66.8	-43.5	-177.4	-57.4	167	0	0	0	110.7	T89 M92 L96 T115 I116 G121 E122 K123	T89-I119 HydrophobicContact CG2-CD1 4.32Å; M92-I119 HydrophobicContact CB-CD1 3.92Å; M92-I119 HydrophobicContact CE-CB 4.38Å; M92-I119 HydrophobicContact CE-CG2 3.91Å; M92-I119 HydrophobicContact CG-CB 3.98Å; M92-I119 HydrophobicContact CG-CD1 3.8Å; M92-I119 HydrophobicContact CG-CG1 4.5Å; M92-I119 HydrophobicContact CG-CG2 3.6Å; L96-I119 HydrophobicContact CD1-CG2 4.21Å; T115-I119 HydrophobicContact CG2-CD1 4.2Å; T115-I119 PolarHBondContact O-N 2.67Å; T115-I119 VanDerWaalsContact O-N 3.16Å; I116-I119 PolarHBondContact O-N 2.89Å; I119-G121 VanDerWaalsContact C-N 3.33Å; I119-G121 PolarHBondContact O-N 2.99Å; I119-E122 PolarHBondContact O-N 2.54Å; I119-K123 WeakPolarHBondContact O-CG 3.46Å; I119-K123 PolarHBondContact O-N 2.76Å; I119-K123 VanDerWaalsContact O-N 3.09Å
120	C	89.3	Confident	88	Confident	1 Å²	1	23 Å²	23	1%	0.007	13%	0.128	C	C	.	.	H	α-helix	trans	-59	-42.9	173.5	-76.6	0	0	0	0	112.1	M92 I116 E122 K123 E124 I125 H127	M92-C120 WeakPolarHBondContact CE-SG 3.36Å; I116-C120 WeakPolarHBondContact O-CB 3.32Å; I116-C120 PolarHBondContact O-N 2.88Å; I116-C120 PolarHBondContact O-SG 3.5Å; I116-C120 VanDerWaalsContact O-SG 3.34Å; C120-E122 VanDerWaalsContact C-N 3.33Å; C120-E122 PolarHBondContact O-N 3.41Å; C120-K123 PolarHBondContact O-N 3.42Å; C120-E124 PolarHBondContact O-N 3.19Å; C120-I125 VanDerWaalsContact CB-O 3.28Å; C120-I125 WeakPolarHBondContact CB-O 3.35Å; C120-I125 PolarHBondContact O-N 2.94Å; C120-H127 HydrophobicContact CB-CB 3.83Å
121	G	87.7	Confident	88.1	Confident	16 Å²	16	22.6 Å²	22.6	17%	0.165	13%	0.128	C	C	.	.	H	α-helix	trans	-67.9	-28.1	177.2	0	0	0	0	0	114.3	S117 H118 I119	S117-G121 PolarHBondContact O-N 3.06Å; H118-G121 PolarHBondContact O-N 3.38Å; I119-G121 VanDerWaalsContact C-N 3.33Å; I119-G121 PolarHBondContact O-N 2.99Å
122	E	87.4	Confident	88	Confident	99 Å²	99	22.6 Å²	22.6	46%	0.463	13%	0.125	S	C	.	.	H	α-helix	trans	-76.6	-35.7	174.9	-162.3	-160.3	119.3	0	0	112.5	H118 I119 C120 I349	H118-E122 PolarHBondContact O-N 2.9Å; I119-E122 PolarHBondContact O-N 2.54Å; C120-E122 VanDerWaalsContact C-N 3.33Å; C120-E122 PolarHBondContact O-N 3.41Å; E122-I349 WeakPolarHBondContact O-CG2 3.38Å
123	K	88.7	Confident	87.4	Confident	2 Å²	2	24.9 Å²	24.9	1%	0.009	14%	0.136	C	C	.	.	H	α-helix	trans	-93.9	0.1	-178.3	-53.9	-46.6	-177.8	-165.9	0	114.5	L96 I119 C120 I125 L342 C344 S346 I349 W350	L96-K123 HydrophobicContact CD1-CG 4.06Å; L96-K123 HydrophobicContact CD2-CG 4.26Å; I119-K123 WeakPolarHBondContact O-CG 3.46Å; I119-K123 PolarHBondContact O-N 2.76Å; I119-K123 VanDerWaalsContact O-N 3.09Å; C120-K123 PolarHBondContact O-N 3.42Å; K123-I125 VanDerWaalsContact C-N 3.35Å; K123-I125 HydrophobicContact CB-CD1 4.48Å; K123-I125 HydrophobicContact CB-CG1 4.26Å; K123-L342 HydrophobicContact CB-CD1 4Å; K123-C344 WeakPolarHBondContact CE-O 3.29Å; K123-C344 PolarHBondContact NZ-O 3.36Å; K123-S346 PolarHBondContact NZ-O 2.85Å; K123-I349 WeakPolarHBondContact O-CA 3.31Å; K123-W350 PolarHBondContact O-N 3.08Å
124	E	88.9	Confident	86.4	Confident	50 Å²	50	26.6 Å²	26.6	23%	0.234	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.8	41.2	-169.5	-62.6	-168.4	-154.8	0	0	113.8	C120 F143 I349 G353 T354	C120-E124 PolarHBondContact O-N 3.19Å; E124-F143 HydrophobicContact CB-CD2 4.05Å; E124-F143 HydrophobicContact CB-CE2 3.9Å; E124-F143 HydrophobicContact CB-CZ 4.42Å; E124-F143 HydrophobicContact CG-CD2 3.96Å; E124-F143 HydrophobicContact CG-CE2 4.29Å; E124-I349 HydrophobicContact CB-CB 4.44Å; E124-I349 HydrophobicContact CG-CB 4.34Å; E124-I349 HydrophobicContact CG-CG2 4.41Å; E124-I349 WeakPolarHBondContact OE1-CD1 3.37Å; E124-G353 WeakPolarHBondContact O-CA 3.42Å; E124-T354 WeakPolarHBondContact OE2-CB 3.41Å; E124-T354 PolarHBondContact OE2-OG1 2.89Å
125	I	90.5	Very high	85.2	Confident	5 Å²	5	28.1 Å²	28.1	3%	0.026	15%	0.149	C	C	.	.	P	Polyproline II helix	trans	-98.9	126.8	172.5	-61.4	-176.4	0	0	0	109.4	L96 V103 C120 K123 H127 F143 L342	L96-I125 HydrophobicContact CD2-CD1 3.33Å; V103-I125 HydrophobicContact CG2-CG2 4.33Å; C120-I125 VanDerWaalsContact CB-O 3.28Å; C120-I125 WeakPolarHBondContact CB-O 3.35Å; C120-I125 PolarHBondContact O-N 2.94Å; K123-I125 VanDerWaalsContact C-N 3.35Å; K123-I125 HydrophobicContact CB-CD1 4.48Å; K123-I125 HydrophobicContact CB-CG1 4.26Å; I125-H127 PolarHBondContact O-N 3.36Å; I125-F143 WeakPolarHBondContact O-CE1 3.36Å; I125-L342 HydrophobicContact CD1-CD1 4.37Å
126	P	91.2	Very high	83.7	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.174	C	C	.	.	P	Polyproline II helix	trans	-55.6	118.6	173.8	-28.1	35.7	0	0	0	113.8	V101 S102 V103 F143 L356 M357 L360	V101-P126 WeakPolarHBondContact O-CD 3.48Å; S102-P126 VanDerWaalsContact CA-O 3.26Å; S102-P126 WeakPolarHBondContact CA-O 3.46Å; S102-P126 WeakPolarHBondContact CB-O 3.47Å; S102-P126 PolarHBondContact OG-O 2.97Å; V103-P126 PolarHBondContact N-O 3.17Å; P126-F143 HydrophobicContact CG-CZ 4.17Å; P126-L356 HydrophobicContact CG-CB 4.26Å; P126-L356 HydrophobicContact CG-CD2 4.14Å; P126-L356 HydrophobicContact CG-CG 4.14Å; P126-M357 HydrophobicContact CB-CE 3.93Å; P126-M357 HydrophobicContact CG-CE 4.37Å; P126-L360 HydrophobicContact CB-CD1 3.39Å; P126-L360 HydrophobicContact CG-CD1 3.82Å
127	H	91.8	Very high	82.1	Confident	2 Å²	2	37.4 Å²	37.4	1%	0.009	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	125.6	169.2	178.8	-150.6	0	0	0	109.8	V103 G105 G113 S117 C120 I125 S145 V146	V103-H127 WeakPolarHBondContact O-CA 3.32Å; V103-H127 PolarHBondContact O-CD2 2.71Å; G105-H127 WeakPolarHBondContact CA-NE2 3.49Å; G113-H127 PolarHBondContact O-CE1 3.1Å; S117-H127 PolarHBondContact OG-CE1 3.32Å; S117-H127 VanDerWaalsContact OG-CE1 3.25Å; S117-H127 PolarHBondContact OG-ND1 3.46Å; C120-H127 HydrophobicContact CB-CB 3.83Å; I125-H127 PolarHBondContact O-N 3.36Å; H127-S145 WeakPolarHBondContact O-CA 3.43Å; H127-S145 WeakPolarHBondContact O-CB 3.36Å; H127-V146 PolarHBondContact O-N 2.66Å
128	V	93.1	Very high	80.5	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	119	171.6	-178.7	0	0	0	0	109.2	V103 I104 G105 V146 L148 A320 V324	V103-V128 PolarHBondContact O-N 3.17Å; I104-V128 WeakPolarHBondContact CA-O 3.48Å; G105-V128 PolarHBondContact N-O 3.44Å; V128-V146 WeakPolarHBondContact CA-O 3.37Å; V128-L148 HydrophobicContact CG1-CD1 3.63Å; V128-L148 HydrophobicContact CG1-CG 4.25Å; V128-A320 HydrophobicContact CG1-CB 3.99Å; V128-V324 HydrophobicContact CG2-CG2 3.73Å
129	K	90.5	Very high	78.8	Confident	38 Å²	38	43 Å²	43	17%	0.165	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	139.6	176.4	-69.1	172.4	171.9	167.4	0	111	S117 S145 V146 T147 L148	S117-K129 WeakPolarHBondContact OG-CE 3.38Å; K129-S145 VanDerWaalsContact CE-OG 3.24Å; K129-S145 WeakPolarHBondContact CE-OG 3.47Å; K129-S145 PolarHBondContact NZ-OG 3.42Å; K129-V146 PolarHBondContact N-O 3.28Å; K129-T147 WeakPolarHBondContact O-CA 3.48Å; K129-L148 PolarHBondContact O-N 3.34Å
130	I	89.6	Confident	76.8	Confident	3 Å²	3	51.4 Å²	51.4	2%	0.015	27%	0.268	C	S	.	.			trans	-124	-11.3	172.3	66	165.7	0	0	0	113.8	I104 A107 L148 Y149 L316 M317 A320	I104-I130 HydrophobicContact CG2-CG2 4.43Å; A107-I130 HydrophobicContact CB-CD1 3.91Å; A107-I130 HydrophobicContact CB-CG1 4.15Å; I130-L148 HydrophobicContact CG2-CD1 4.18Å; I130-Y149 VanDerWaalsContact O-CD2 3.27Å; I130-Y149 WeakPolarHBondContact O-CD2 3.3Å; I130-L316 HydrophobicContact CB-CB 3.81Å; I130-L316 HydrophobicContact CB-CD1 4.15Å; I130-L316 HydrophobicContact CD1-CB 4.48Å; I130-L316 HydrophobicContact CG2-CB 3.8Å; I130-L316 WeakPolarHBondContact O-CD1 3.26Å; I130-M317 HydrophobicContact CD1-CE 3.5Å; I130-M317 VanDerWaalsContact CD1-CE 3.5Å; I130-M317 HydrophobicContact CD1-CG 3.58Å; I130-M317 HydrophobicContact CD1-SD 3.89Å; I130-M317 HydrophobicContact CG1-CE 4.45Å; I130-A320 HydrophobicContact CG2-CB 4.44Å
131	G	83.8	Confident	75.3	Confident	11 Å²	11	54.9 Å²	54.9	11%	0.113	29%	0.286	C	S	.	.	S	Bend	trans	-90.5	169.9	173.3	0	0	0	0	0	113.7	A107	A107-G131 WeakPolarHBondContact O-CA 3.45Å
132	P	79.1	Confident	73.9	Confident	27 Å²	27	66.3 Å²	66.3	18%	0.175	32%	0.324	C	S	.	.			trans	-68.5	154.7	179.5	29.2	-35.8	0	0	0	113.5	P110 E134 Y149	P110-P132 HydrophobicContact CG-CG 4.3Å; P132-E134 PolarHBondContact O-N 2.95Å; P132-Y149 HydrophobicContact CB-CD1 4.22Å; P132-Y149 HydrophobicContact CB-CE1 3.95Å
133	E	74.1	Confident	73	Confident	50 Å²	50	62.4 Å²	62.4	23%	0.234	31%	0.306	C	S	.	.			trans	-90.4	92.2	179.4	-172.9	163.2	-128.9	0	0	110.5	K137 N152	E133-K137 VanDerWaalsContact CD-CE 3.46Å; E133-K137 VanDerWaalsContact OE1-CE 3.24Å; E133-K137 WeakPolarHBondContact OE1-CE 3.48Å; E133-K137 IonicContact OE1-NZ 2.98Å; E133-K137 WeakPolarHBondContact OE2-CE 3.32Å; E133-K137 IonicContact OE2-NZ 3.73Å; E133-K137 PolarHBondContact OE2-NZ 3.15Å; E133-N152 PolarHBondContact O-ND2 2.98Å
134	E	64.3	Low	72.2	Confident	47 Å²	47	63.7 Å²	63.7	22%	0.22	32%	0.317	C	S	.	.			trans	-80.9	-22.2	-179.3	-74.3	-175.4	161.5	0	0	114.2	P110 P132 K177 E179	P110-E134 HydrophobicContact CB-CB 3.99Å; P110-E134 HydrophobicContact CB-CG 3.93Å; P110-E134 WeakPolarHBondContact CB-OE2 3.5Å; P110-E134 HydrophobicContact CG-CB 4.47Å; P110-E134 HydrophobicContact CG-CG 3.84Å; P110-E134 WeakPolarHBondContact CG-OE2 3.4Å; P132-E134 PolarHBondContact O-N 2.95Å; E134-K177 IonicContact OE1-NZ 3.81Å; E134-K177 PolarHBondContact OE1-NZ 2.92Å; E134-E179 HydrophobicContact CG-CB 4.29Å
135	T	60.4	Low	72.1	Confident	77 Å²	77	62.3 Å²	62.3	47%	0.472	31%	0.312	S	S	.	.	S	Bend	trans	-103.1	132.3	-176	58.7	0	0	0	0	112.8
136	P	55.2	Low	72	Confident	103 Å²	103	62.1 Å²	62.1	67%	0.669	31%	0.311	S	S	*	.			trans	-61.6	143.3	172.9	26.5	-34.1	0	0	0	111.5	L138	P136-L138 PolarHBondContact O-N 3.31Å
137	K	56.2	Low	72	Confident	115 Å²	115	63 Å²	63	50%	0.5	32%	0.317	S	S	.	.			trans	-62.9	108	-167.8	-75.2	167.8	175.3	139.6	0	112.6	E133 P139 Q379	E133-K137 VanDerWaalsContact CD-CE 3.46Å; E133-K137 VanDerWaalsContact OE1-CE 3.24Å; E133-K137 WeakPolarHBondContact OE1-CE 3.48Å; E133-K137 IonicContact OE1-NZ 2.98Å; E133-K137 WeakPolarHBondContact OE2-CE 3.32Å; E133-K137 IonicContact OE2-NZ 3.73Å; E133-K137 PolarHBondContact OE2-NZ 3.15Å; K137-P139 WeakPolarHBondContact O-CD 3.18Å; K137-Q379 VanDerWaalsContact NZ-CD 3.27Å; K137-Q379 VanDerWaalsContact NZ-OE1 3.13Å
138	L	53.1	Low	72	Confident	128 Å²	128	62.9 Å²	62.9	67%	0.67	32%	0.316	S	S	*	.			trans	-60.3	115	167.8	-75.8	167.7	0	0	0	109.5	P136 Y140	P136-L138 PolarHBondContact O-N 3.31Å; L138-Y140 PolarHBondContact O-N 3.42Å
139	P	50.6	Low	71.8	Confident	110 Å²	110	64.3 Å²	64.3	71%	0.714	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	20.2	-169.7	32.5	-37.3	0	0	0	114.1	K137	K137-P139 WeakPolarHBondContact O-CD 3.18Å
140	Y	48.4	Very low	71.8	Confident	195 Å²	195	62.8 Å²	62.8	77%	0.765	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.5	-7.9	-170.2	-59	-67.9	0	0	0	114.3	L138 R142	L138-Y140 PolarHBondContact O-N 3.42Å; Y140-R142 PolarHBondContact O-N 3.01Å
141	L	57.8	Low	71.7	Confident	75 Å²	75	63.5 Å²	63.5	39%	0.393	32%	0.321	S	S	.	.			trans	-71.5	100.6	175.4	-70.6	174.5	0	0	0	110.3	F143	L141-F143 PolarHBondContact O-N 3.37Å
142	R	57.1	Low	71.8	Confident	256 Å²	256	64.3 Å²	64.3	97%	0.966	32%	0.323	S	S	*	.	S	Bend	trans	-61.2	-28.2	177.4	-67.8	-177.3	176.1	-178.6	-0.9	113.4	Y140	Y140-R142 PolarHBondContact O-N 3.01Å
143	F	68.9	Low	72.2	Confident	17 Å²	17	68.7 Å²	68.7	8%	0.075	34%	0.341	C	S	.	.	S	Bend	trans	-123	99.9	-176.3	-172.6	-83.7	0	0	0	108.4	E124 I125 P126 L141 M357	E124-F143 HydrophobicContact CB-CD2 4.05Å; E124-F143 HydrophobicContact CB-CE2 3.9Å; E124-F143 HydrophobicContact CB-CZ 4.42Å; E124-F143 HydrophobicContact CG-CD2 3.96Å; E124-F143 HydrophobicContact CG-CE2 4.29Å; I125-F143 WeakPolarHBondContact O-CE1 3.36Å; P126-F143 HydrophobicContact CG-CZ 4.17Å; L141-F143 PolarHBondContact O-N 3.37Å; F143-M357 HydrophobicContact CD1-CE 4.33Å; F143-M357 HydrophobicContact CE1-CE 3.59Å; F143-M357 HydrophobicContact CE2-CB 3.83Å; F143-M357 HydrophobicContact CE2-CG 4.21Å; F143-M357 HydrophobicContact CZ-CB 3.76Å; F143-M357 HydrophobicContact CZ-CE 3.82Å; F143-M357 HydrophobicContact CZ-CG 4.15Å
144	A	71.4	Confident	73	Confident	29 Å²	29	67.4 Å²	67.4	24%	0.24	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-85.5	134.3	-173.8	0	0	0	0	0	112.5	M357 R361	A144-M357 VanDerWaalsContact O-CE 3.25Å; A144-M357 WeakPolarHBondContact O-CE 3.49Å; A144-M357 VanDerWaalsContact O-SD 3.36Å; A144-R361 PolarHBondContact O-NH2 2.96Å
145	S	86.8	Confident	74.1	Confident	20 Å²	20	65.3 Å²	65.3	14%	0.14	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-62.2	149.7	171.6	57.3	0	0	0	0	112.5	H127 K129	H127-S145 WeakPolarHBondContact O-CA 3.43Å; H127-S145 WeakPolarHBondContact O-CB 3.36Å; K129-S145 VanDerWaalsContact CE-OG 3.24Å; K129-S145 WeakPolarHBondContact CE-OG 3.47Å; K129-S145 PolarHBondContact NZ-OG 3.42Å
146	V	89.9	Confident	75.6	Confident	1 Å²	1	61.8 Å²	61.8	1%	0.006	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	142	168.6	178.7	0	0	0	0	109.5	H127 V128 K129 M357 L360 F374 G378	H127-V146 PolarHBondContact O-N 2.66Å; V128-V146 WeakPolarHBondContact CA-O 3.37Å; K129-V146 PolarHBondContact N-O 3.28Å; V146-M357 HydrophobicContact CG2-CE 4.28Å; V146-M357 HydrophobicContact CG2-SD 3.84Å; V146-L360 HydrophobicContact CG2-CB 4.35Å; V146-F374 HydrophobicContact CG1-CD1 3.47Å; V146-F374 VanDerWaalsContact CG1-CD1 3.47Å; V146-F374 HydrophobicContact CG1-CD2 4.09Å; V146-F374 HydrophobicContact CG1-CE1 3.23Å; V146-F374 HydrophobicContact CG1-CE2 3.87Å; V146-F374 HydrophobicContact CG1-CG 3.89Å; V146-F374 HydrophobicContact CG1-CZ 3.44Å; V146-F374 VanDerWaalsContact CG1-CZ 3.44Å; V146-G378 CarbonylContact C-O 3.56Å; V146-G378 VanDerWaalsContact CA-O 3.31Å; V146-G378 WeakPolarHBondContact CA-O 3.39Å
147	T	90.3	Very high	77.2	Confident	18 Å²	18	59.3 Å²	59.3	11%	0.11	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	129.1	173.9	-179.7	0	0	0	0	112.1	K129 Y149 F374 G378 Q379 R380	K129-T147 WeakPolarHBondContact O-CA 3.48Å; T147-Y149 PolarHBondContact OG1-N 2.86Å; T147-F374 WeakPolarHBondContact O-CE1 3.47Å; T147-G378 PolarHBondContact N-O 3.05Å; T147-Q379 HydrophobicContact CG2-CB 4.24Å; T147-Q379 HydrophobicContact CG2-CG 4.16Å; T147-R380 WeakPolarHBondContact O-CB 3.4Å; T147-R380 PolarHBondContact O-N 3.35Å
148	L	91.4	Very high	78.9	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.261	C	S	.	.			trans	-90.3	-18.3	175.1	-73.9	161.5	0	0	0	113.2	V128 K129 I130 L316 A320 V323 I372 F374 R380	V128-L148 HydrophobicContact CG1-CD1 3.63Å; V128-L148 HydrophobicContact CG1-CG 4.25Å; K129-L148 PolarHBondContact O-N 3.34Å; I130-L148 HydrophobicContact CG2-CD1 4.18Å; L148-L316 HydrophobicContact CB-CD2 3.91Å; L148-A320 HydrophobicContact CD1-CB 3.59Å; L148-V323 HydrophobicContact CD2-CG2 4.41Å; L148-I372 HydrophobicContact CD2-CD1 4.04Å; L148-I372 HydrophobicContact CD2-CG1 4.14Å; L148-I372 HydrophobicContact CD2-CG2 3.68Å; L148-F374 HydrophobicContact CD2-CE1 3.99Å; L148-F374 HydrophobicContact CD2-CZ 3.65Å; L148-F374 HydrophobicContact CG-CE1 4.41Å; L148-F374 HydrophobicContact CG-CZ 4.28Å; L148-R380 WeakPolarHBondContact O-CD 3.47Å; L148-R380 PolarHBondContact O-NH1 2.93Å; L148-R380 VanDerWaalsContact O-NH1 3.09Å
149	Y	90.2	Very high	80.6	Confident	31 Å²	31	47.7 Å²	47.7	12%	0.122	23%	0.23	C	C	.	.	S	Bend	trans	-73.7	144.1	176	-162.7	-94.6	0	0	0	110.7	I130 P132 T147 L312 L316	I130-Y149 VanDerWaalsContact O-CD2 3.27Å; I130-Y149 WeakPolarHBondContact O-CD2 3.3Å; P132-Y149 HydrophobicContact CB-CD1 4.22Å; P132-Y149 HydrophobicContact CB-CE1 3.95Å; T147-Y149 PolarHBondContact OG1-N 2.86Å; Y149-L312 HydrophobicContact CD2-CD2 4.33Å; Y149-L312 HydrophobicContact CE2-CD2 3.9Å; Y149-L316 HydrophobicContact CD2-CD1 3.94Å
150	P	88.9	Confident	82.4	Confident	6 Å²	6	43 Å²	43	4%	0.039	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-49.7	150.2	172.7	-30.8	37.5	0	0	0	113.8	M257 M279 Y383 L385	P150-M257 HydrophobicContact CB-CE 4.5Å; P150-M257 HydrophobicContact CG-CE 4.22Å; P150-M279 HydrophobicContact CG-CE 3.77Å; P150-M279 HydrophobicContact CG-SD 3.79Å; P150-Y383 WeakPolarHBondContact CA-OH 3.14Å; P150-Y383 HydrophobicContact CB-CE2 3.94Å; P150-Y383 WeakPolarHBondContact CB-OH 3.05Å; P150-Y383 HydrophobicContact CG-CE2 4.01Å; P150-L385 HydrophobicContact CG-CD2 3.99Å
151	S	87.9	Confident	84.3	Confident	17 Å²	17	34.9 Å²	34.9	12%	0.119	17%	0.172	C	C	.	.	P	Polyproline II helix	trans	-80.5	152.5	177.2	86.7	0	0	0	0	112.4	E153 D154 L155 Y383	S151-E153 PolarHBondContact O-N 3.16Å; S151-D154 VanDerWaalsContact CB-OD2 3.26Å; S151-D154 WeakPolarHBondContact CB-OD2 3.35Å; S151-D154 PolarHBondContact N-OD2 2.94Å; S151-D154 PolarHBondContact O-N 2.88Å; S151-D154 PolarHBondContact OG-N 3.15Å; S151-D154 VanDerWaalsContact OG-N 3.12Å; S151-D154 PolarHBondContact OG-OD2 3.34Å; S151-L155 PolarHBondContact O-N 3.45Å; S151-Y383 PolarHBondContact N-OH 3.14Å
152	N	86.9	Confident	85.7	Confident	29 Å²	29	31.3 Å²	31.3	16%	0.155	15%	0.154	C	C	.	.	H	α-helix	trans	-59.9	-32.7	175.5	-65.2	2.4	0	0	0	112.2	E133 S156 R183	E133-N152 PolarHBondContact O-ND2 2.98Å; N152-S156 WeakPolarHBondContact O-CB 3.02Å; N152-S156 PolarHBondContact O-N 3.46Å; N152-S156 PolarHBondContact O-OG 3.42Å; N152-R183 WeakPolarHBondContact CB-O 3.34Å
153	E	87.5	Confident	87.1	Confident	119 Å²	119	19.2 Å²	19.2	56%	0.556	11%	0.108	S	C	*	.	H	α-helix	trans	-66.6	-50.6	176	-172	175.6	175.1	0	0	110.2	S151 L155 S156 L157	S151-E153 PolarHBondContact O-N 3.16Å; E153-L155 PolarHBondContact O-N 2.97Å; E153-S156 WeakPolarHBondContact O-CB 3.38Å; E153-S156 PolarHBondContact O-N 3.07Å; E153-L157 HydrophobicContact CG-CD1 4.16Å; E153-L157 WeakPolarHBondContact O-CB 3.44Å; E153-L157 VanDerWaalsContact O-CG 3.27Å; E153-L157 WeakPolarHBondContact O-CG 3.36Å; E153-L157 PolarHBondContact O-N 2.88Å
154	D	89.3	Confident	87.7	Confident	22 Å²	22	23.8 Å²	23.8	12%	0.118	13%	0.13	C	C	.	.	H	α-helix	trans	-58.8	-45.4	175.5	-63.7	-53.5	0	0	0	112.2	S151 S156 L157 A158 Y383 W401	S151-D154 VanDerWaalsContact CB-OD2 3.26Å; S151-D154 WeakPolarHBondContact CB-OD2 3.35Å; S151-D154 PolarHBondContact N-OD2 2.94Å; S151-D154 PolarHBondContact O-N 2.88Å; S151-D154 PolarHBondContact OG-N 3.15Å; S151-D154 VanDerWaalsContact OG-N 3.12Å; S151-D154 PolarHBondContact OG-OD2 3.34Å; D154-S156 PolarHBondContact O-N 3.11Å; D154-L157 PolarHBondContact O-N 3.43Å; D154-A158 WeakPolarHBondContact O-CB 3.38Å; D154-A158 PolarHBondContact O-N 3.32Å; D154-Y383 WeakPolarHBondContact CB-OH 3.26Å; D154-Y383 PolarHBondContact OD2-OH 2.9Å; D154-W401 HydrophobicContact CB-CH2 3.58Å; D154-W401 HydrophobicContact CB-CZ3 3.85Å
155	L	89	Confident	88	Confident	4 Å²	4	25 Å²	25	2%	0.021	14%	0.137	C	C	.	.	H	α-helix	trans	-62.9	-42.4	178.6	179.9	59.7	0	0	0	111.7	S151 E153 A158 I159 R183 L184 M257 F277	S151-L155 PolarHBondContact O-N 3.45Å; E153-L155 PolarHBondContact O-N 2.97Å; L155-A158 PolarHBondContact O-N 3.4Å; L155-I159 HydrophobicContact CD1-CD1 4.06Å; L155-I159 HydrophobicContact CD1-CG1 4.48Å; L155-I159 HydrophobicContact CG-CD1 4.1Å; L155-I159 WeakPolarHBondContact O-CD1 3.34Å; L155-I159 VanDerWaalsContact O-CG1 3.31Å; L155-I159 WeakPolarHBondContact O-CG1 3.24Å; L155-I159 PolarHBondContact O-N 3.48Å; L155-I159 VanDerWaalsContact O-N 3.08Å; L155-R183 HydrophobicContact CD2-CG 3.99Å; L155-L184 HydrophobicContact CG-CD2 4.43Å; L155-M257 HydrophobicContact CD1-CE 3.83Å; L155-F277 HydrophobicContact CD1-CD2 4.36Å; L155-F277 HydrophobicContact CD1-CE2 4.24Å
156	S	90.3	Very high	87.5	Confident	3 Å²	3	25 Å²	25	2%	0.021	13%	0.134	C	C	.	.	H	α-helix	trans	-61.2	-45.4	174.7	-64.8	0	0	0	0	111.7	N152 E153 D154 I159 G160 R183 L184	N152-S156 WeakPolarHBondContact O-CB 3.02Å; N152-S156 PolarHBondContact O-N 3.46Å; N152-S156 PolarHBondContact O-OG 3.42Å; E153-S156 WeakPolarHBondContact O-CB 3.38Å; E153-S156 PolarHBondContact O-N 3.07Å; D154-S156 PolarHBondContact O-N 3.11Å; S156-I159 PolarHBondContact O-N 2.9Å; S156-G160 PolarHBondContact O-N 2.83Å; S156-R183 PolarHBondContact OG-O 2.98Å; S156-L184 WeakPolarHBondContact OG-CA 3.33Å
157	L	90.2	Very high	86.5	Confident	50 Å²	50	27.7 Å²	27.7	26%	0.262	16%	0.162	S	C	.	.	H	α-helix	trans	-69.8	-34.1	179.7	-69.1	170.6	0	0	0	112.4	E153 D154 S161 E186 W401	E153-L157 HydrophobicContact CG-CD1 4.16Å; E153-L157 WeakPolarHBondContact O-CB 3.44Å; E153-L157 VanDerWaalsContact O-CG 3.27Å; E153-L157 WeakPolarHBondContact O-CG 3.36Å; E153-L157 PolarHBondContact O-N 2.88Å; D154-L157 PolarHBondContact O-N 3.43Å; L157-S161 VanDerWaalsContact O-CB 3.29Å; L157-S161 WeakPolarHBondContact O-CB 3.48Å; L157-S161 PolarHBondContact O-N 3.21Å; L157-S161 PolarHBondContact O-OG 3.43Å; L157-E186 HydrophobicContact CD2-CG 4.46Å; L157-W401 HydrophobicContact CB-CZ2 4.1Å
158	A	90.4	Very high	85.5	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-63.7	-48.2	173.1	0	0	0	0	0	111.5	D154 L155 S161 I162 F277 L385 W401	D154-A158 WeakPolarHBondContact O-CB 3.38Å; D154-A158 PolarHBondContact O-N 3.32Å; L155-A158 PolarHBondContact O-N 3.4Å; A158-S161 PolarHBondContact O-N 2.97Å; A158-I162 VanDerWaalsContact O-CG1 3.27Å; A158-I162 WeakPolarHBondContact O-CG1 3.11Å; A158-I162 PolarHBondContact O-N 3.47Å; A158-F277 HydrophobicContact CB-CE1 4.1Å; A158-F277 HydrophobicContact CB-CZ 4.47Å; A158-L385 HydrophobicContact CB-CD1 4.34Å; A158-W401 HydrophobicContact CB-CD2 3.72Å; A158-W401 HydrophobicContact CB-CE3 4.17Å; A158-W401 HydrophobicContact CB-CG 3.86Å; A158-W401 HydrophobicContact CB-CZ2 4.45Å
159	I	90.4	Very high	84.2	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63.3	-44	176.5	-63.9	161.1	0	0	0	110.7	L155 S156 S161 I162 L163 L184 L187 I225 T255 F277	L155-I159 HydrophobicContact CD1-CD1 4.06Å; L155-I159 HydrophobicContact CD1-CG1 4.48Å; L155-I159 HydrophobicContact CG-CD1 4.1Å; L155-I159 WeakPolarHBondContact O-CD1 3.34Å; L155-I159 VanDerWaalsContact O-CG1 3.31Å; L155-I159 WeakPolarHBondContact O-CG1 3.24Å; L155-I159 PolarHBondContact O-N 3.48Å; L155-I159 VanDerWaalsContact O-N 3.08Å; S156-I159 PolarHBondContact O-N 2.9Å; I159-S161 PolarHBondContact O-N 3.42Å; I159-I162 PolarHBondContact O-N 2.97Å; I159-L163 HydrophobicContact CG2-CD1 3.89Å; I159-L163 HydrophobicContact CG2-CG 4.48Å; I159-L163 WeakPolarHBondContact O-CG 3.31Å; I159-L163 PolarHBondContact O-N 2.89Å; I159-L184 HydrophobicContact CD1-CD2 3.7Å; I159-L187 HydrophobicContact CB-CD1 4.38Å; I159-L187 HydrophobicContact CB-CD2 4.19Å; I159-L187 HydrophobicContact CG2-CD1 4.04Å; I159-L187 HydrophobicContact CG2-CD2 3.63Å; I159-I225 HydrophobicContact CG2-CD1 4.16Å; I159-T255 HydrophobicContact CD1-CG2 3.69Å; I159-F277 HydrophobicContact CD1-CE2 4.46Å; I159-F277 HydrophobicContact CG1-CE2 3.87Å; I159-F277 HydrophobicContact CG1-CZ 3.7Å
160	G	88.3	Confident	83.8	Confident	10 Å²	10	33.6 Å²	33.6	10%	0.103	20%	0.199	C	C	.	.	H	α-helix	trans	-60.5	-43.4	175.5	0	0	0	0	0	113	S156 I162 L163 Q164	S156-G160 PolarHBondContact O-N 2.83Å; G160-I162 VanDerWaalsContact C-N 3.32Å; G160-I162 PolarHBondContact O-N 3.48Å; G160-L163 PolarHBondContact O-N 2.83Å; G160-Q164 WeakPolarHBondContact O-CG 3.49Å; G160-Q164 PolarHBondContact O-N 2.93Å
161	S	87.3	Confident	83.8	Confident	25 Å²	25	33.3 Å²	33.3	18%	0.175	20%	0.198	C	C	.	.	H	α-helix	trans	-60.8	-40.9	176.1	-58.5	0	0	0	0	111.7	L157 A158 I159 S165 L407	L157-S161 VanDerWaalsContact O-CB 3.29Å; L157-S161 WeakPolarHBondContact O-CB 3.48Å; L157-S161 PolarHBondContact O-N 3.21Å; L157-S161 PolarHBondContact O-OG 3.43Å; A158-S161 PolarHBondContact O-N 2.97Å; I159-S161 PolarHBondContact O-N 3.42Å; S161-S165 WeakPolarHBondContact O-CB 3.36Å; S161-S165 PolarHBondContact O-N 3.45Å; S161-L407 WeakPolarHBondContact O-CD2 3.23Å
162	I	87	Confident	84	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-64.5	-48.2	177.3	-71.6	168	0	0	0	110.6	A158 I159 G160 Q164 S165 F166 I253 F277 I387 L407	A158-I162 VanDerWaalsContact O-CG1 3.27Å; A158-I162 WeakPolarHBondContact O-CG1 3.11Å; A158-I162 PolarHBondContact O-N 3.47Å; I159-I162 PolarHBondContact O-N 2.97Å; G160-I162 VanDerWaalsContact C-N 3.32Å; G160-I162 PolarHBondContact O-N 3.48Å; I162-Q164 PolarHBondContact O-N 3.21Å; I162-S165 PolarHBondContact O-N 3.02Å; I162-S165 VanDerWaalsContact O-N 3.15Å; I162-S165 PolarHBondContact O-OG 3.31Å; I162-F166 HydrophobicContact CG2-CD2 3.91Å; I162-F166 HydrophobicContact CG2-CE2 3.36Å; I162-F166 HydrophobicContact CG2-CZ 4.14Å; I162-F166 VanDerWaalsContact O-CD2 3.26Å; I162-F166 WeakPolarHBondContact O-CD2 3.39Å; I162-F166 PolarHBondContact O-N 2.85Å; I162-I253 HydrophobicContact CG2-CD1 4.07Å; I162-F277 HydrophobicContact CD1-CE1 3.58Å; I162-F277 HydrophobicContact CD1-CZ 3.65Å; I162-I387 HydrophobicContact CD1-CD1 3.71Å; I162-I387 HydrophobicContact CD1-CG1 4.1Å; I162-I387 HydrophobicContact CD1-CG2 4.36Å; I162-I387 HydrophobicContact CG1-CD1 3.91Å; I162-L407 HydrophobicContact CG1-CD2 4.2Å
163	L	86.2	Confident	84.3	Confident	3 Å²	3	31.1 Å²	31.1	2%	0.016	19%	0.185	C	C	.	.	H	α-helix	trans	-61.2	-42.5	178.9	-68.2	164.2	0	0	0	112.3	I159 G160 F166 G167 Y168 L187 F191 T223 I225 I253	I159-L163 HydrophobicContact CG2-CD1 3.89Å; I159-L163 HydrophobicContact CG2-CG 4.48Å; I159-L163 WeakPolarHBondContact O-CG 3.31Å; I159-L163 PolarHBondContact O-N 2.89Å; G160-L163 PolarHBondContact O-N 2.83Å; L163-F166 PolarHBondContact O-N 3.47Å; L163-G167 PolarHBondContact O-N 2.93Å; L163-G167 VanDerWaalsContact O-N 3.08Å; L163-Y168 PolarHBondContact O-N 3.3Å; L163-L187 HydrophobicContact CD1-CD1 4.19Å; L163-F191 HydrophobicContact CD1-CE2 3.95Å; L163-F191 HydrophobicContact CD1-CZ 3.96Å; L163-T223 HydrophobicContact CD2-CG2 3.71Å; L163-I225 HydrophobicContact CD1-CD1 3.88Å; L163-I253 HydrophobicContact CD2-CD1 3.78Å; L163-I253 HydrophobicContact CG-CD1 4.31Å
164	Q	82.6	Confident	84.6	Confident	112 Å²	112	25.5 Å²	25.5	52%	0.523	16%	0.158	S	C	.	.	H	α-helix	trans	-63.8	-41.5	173	-72	178.1	8.7	0	0	112.2	G160 I162 F166 G167 H190	G160-Q164 WeakPolarHBondContact O-CG 3.49Å; G160-Q164 PolarHBondContact O-N 2.93Å; I162-Q164 PolarHBondContact O-N 3.21Å; Q164-F166 PolarHBondContact O-N 3.39Å; Q164-F166 VanDerWaalsContact O-N 3.15Å; Q164-G167 PolarHBondContact O-N 3.11Å; Q164-G167 VanDerWaalsContact O-N 3.11Å; Q164-H190 PolarHBondContact NE2-CE1 3.03Å; Q164-H190 PolarHBondContact NE2-NE2 2.98Å
165	S	77.9	Confident	84.8	Confident	56 Å²	56	24.5 Å²	24.5	39%	0.392	15%	0.153	S	C	.	.	H	α-helix	trans	-63.6	-19.6	-179.5	76.3	0	0	0	0	114.1	S161 I162	S161-S165 WeakPolarHBondContact O-CB 3.36Å; S161-S165 PolarHBondContact O-N 3.45Å; I162-S165 PolarHBondContact O-N 3.02Å; I162-S165 VanDerWaalsContact O-N 3.15Å; I162-S165 PolarHBondContact O-OG 3.31Å
166	F	74.8	Confident	84.7	Confident	19 Å²	19	25.2 Å²	25.2	8%	0.083	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.6	-1.5	176.1	-52.5	-42	0	0	0	114.2	I162 L163 Q164 Y168 M409 L414	I162-F166 HydrophobicContact CG2-CD2 3.91Å; I162-F166 HydrophobicContact CG2-CE2 3.36Å; I162-F166 HydrophobicContact CG2-CZ 4.14Å; I162-F166 VanDerWaalsContact O-CD2 3.26Å; I162-F166 WeakPolarHBondContact O-CD2 3.39Å; I162-F166 PolarHBondContact O-N 2.85Å; L163-F166 PolarHBondContact O-N 3.47Å; Q164-F166 PolarHBondContact O-N 3.39Å; Q164-F166 VanDerWaalsContact O-N 3.15Å; F166-Y168 HydrophobicContact CB-CD2 3.77Å; F166-Y168 HydrophobicContact CB-CE1 4.16Å; F166-Y168 HydrophobicContact CB-CE2 3.23Å; F166-Y168 HydrophobicContact CB-CG 4.4Å; F166-Y168 WeakPolarHBondContact CB-OH 3.39Å; F166-Y168 HydrophobicContact CD2-CD2 4.45Å; F166-Y168 AromaticContact CD2-CE2 3.83Å; F166-Y168 HydrophobicContact CD2-CE2 3.83Å; F166-Y168 AromaticContact CG-CE2 3.88Å; F166-Y168 HydrophobicContact CG-CE2 3.88Å; F166-Y168 WeakPolarHBondContact O-CD1 3.28Å; F166-Y168 WeakPolarHBondContact O-CE1 3.34Å; F166-Y168 PolarHBondContact O-N 2.92Å; F166-M409 HydrophobicContact CE1-CE 4.07Å; F166-M409 HydrophobicContact CZ-CE 3.81Å; F166-L414 HydrophobicContact CD1-CB 4.47Å; F166-L414 HydrophobicContact CD2-CD1 4.22Å; F166-L414 HydrophobicContact CE1-CB 3.96Å; F166-L414 HydrophobicContact CE2-CB 4.12Å; F166-L414 HydrophobicContact CE2-CD1 3.33Å; F166-L414 HydrophobicContact CE2-CG 4.33Å; F166-L414 HydrophobicContact CZ-CB 3.77Å; F166-L414 HydrophobicContact CZ-CD1 3.52Å; F166-L414 HydrophobicContact CZ-CG 4.13Å
167	G	69.3	Low	84.5	Confident	58 Å²	58	30.2 Å²	30.2	60%	0.598	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.1	32.7	173.7	0	0	0	0	0	116.3	L163 Q164 P169	L163-G167 PolarHBondContact O-N 2.93Å; L163-G167 VanDerWaalsContact O-N 3.08Å; Q164-G167 PolarHBondContact O-N 3.11Å; Q164-G167 VanDerWaalsContact O-N 3.11Å; G167-P169 WeakPolarHBondContact O-CD 3.22Å
168	Y	68.8	Low	84.1	Confident	36 Å²	36	30.7 Å²	30.7	14%	0.141	19%	0.192	C	C	.	.			trans	-88.2	115.3	-177.2	-59.1	-37.3	0	0	0	113.4	L163 F166 T170 T223 K251 D415	L163-Y168 PolarHBondContact O-N 3.3Å; F166-Y168 HydrophobicContact CB-CD2 3.77Å; F166-Y168 HydrophobicContact CB-CE1 4.16Å; F166-Y168 HydrophobicContact CB-CE2 3.23Å; F166-Y168 HydrophobicContact CB-CG 4.4Å; F166-Y168 WeakPolarHBondContact CB-OH 3.39Å; F166-Y168 HydrophobicContact CD2-CD2 4.45Å; F166-Y168 AromaticContact CD2-CE2 3.83Å; F166-Y168 HydrophobicContact CD2-CE2 3.83Å; F166-Y168 AromaticContact CG-CE2 3.88Å; F166-Y168 HydrophobicContact CG-CE2 3.88Å; F166-Y168 WeakPolarHBondContact O-CD1 3.28Å; F166-Y168 WeakPolarHBondContact O-CE1 3.34Å; F166-Y168 PolarHBondContact O-N 2.92Å; Y168-T170 VanDerWaalsContact C-N 3.35Å; Y168-T170 PolarHBondContact O-N 3.49Å; Y168-T223 HydrophobicContact CD2-CG2 4.19Å; Y168-T223 WeakPolarHBondContact CD2-OG1 3.43Å; Y168-K251 HydrophobicContact CE2-CD 3.74Å; Y168-K251 PolarHBondContact OH-NZ 3.49Å; Y168-D415 PolarHBondContact OH-OD1 3.41Å
169	P	65.6	Low	83.6	Confident	79 Å²	79	34 Å²	34	51%	0.513	21%	0.208	S	C	.	.	S	Bend	trans	-84.4	-4.1	-173.6	34.9	-37.4	0	0	0	114.5	G167 E196 T197	G167-P169 WeakPolarHBondContact O-CD 3.22Å; P169-E196 HydrophobicContact CB-CG 4.49Å; P169-E196 CarbonylContact O-C 3.57Å; P169-E196 VanDerWaalsContact O-CA 3.29Å; P169-E196 WeakPolarHBondContact O-CA 3.46Å; P169-E196 WeakPolarHBondContact O-CB 3.19Å; P169-T197 PolarHBondContact O-N 3.16Å
170	T	81.3	Confident	83.4	Confident	57 Å²	57	34.1 Å²	34.1	35%	0.35	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	135.7	-178.9	67.8	0	0	0	0	110.7	Y168 T197	Y168-T170 VanDerWaalsContact C-N 3.35Å; Y168-T170 PolarHBondContact O-N 3.49Å; T170-T197 WeakPolarHBondContact CA-O 3.42Å; T170-T197 WeakPolarHBondContact CG2-OG1 3.41Å
171	A	89.1	Confident	83.2	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.008	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	159	-179.9	0	0	0	0	0	112.4	F191 T197 L198 S199 T223 I225	A171-F191 HydrophobicContact CB-CZ 4.49Å; A171-T197 PolarHBondContact N-O 3.24Å; A171-L198 HydrophobicContact CB-CD1 3.96Å; A171-S199 PolarHBondContact O-N 3.4Å; A171-S199 PolarHBondContact O-OG 3.39Å; A171-S199 VanDerWaalsContact O-OG 3.07Å; A171-T223 CarbonylContact C-O 3.54Å; A171-T223 WeakPolarHBondContact CA-O 3.33Å; A171-T223 HydrophobicContact CB-CG2 4.45Å; A171-I225 HydrophobicContact CB-CD1 4.4Å
172	S	92.5	Very high	83	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	123.4	171.6	-154.8	0	0	0	0	110.9	S199 R201 T223 I224 I225	S172-S199 CarbonylContact C-O 3.56Å; S172-S199 WeakPolarHBondContact CA-O 3.46Å; S172-S199 VanDerWaalsContact CA-OG 3.27Å; S172-S199 WeakPolarHBondContact CA-OG 3.43Å; S172-S199 WeakPolarHBondContact CB-OG 3.19Å; S172-S199 PolarHBondContact OG-OG 2.92Å; S172-R201 WeakPolarHBondContact OG-CG 3.48Å; S172-T223 PolarHBondContact N-O 3.11Å; S172-I224 CarbonylContact O-C 3.55Å; S172-I224 WeakPolarHBondContact O-CA 3.49Å; S172-I225 PolarHBondContact O-N 3Å
173	L	93.2	Very high	82.8	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	111.6	176.1	173	61.4	0	0	0	109.6	L181 L184 L198 S199 R201 I225 D227	L173-L181 HydrophobicContact CD2-CD2 4.5Å; L173-L184 HydrophobicContact CD1-CD1 3.66Å; L173-L184 HydrophobicContact CD2-CD1 3.96Å; L173-L184 HydrophobicContact CG-CD1 4.48Å; L173-L198 HydrophobicContact CB-CD1 4.06Å; L173-S199 PolarHBondContact N-O 3.46Å; L173-R201 WeakPolarHBondContact O-CB 3.49Å; L173-R201 PolarHBondContact O-N 3.12Å; L173-R201 VanDerWaalsContact O-O 3.05Å; L173-I225 HydrophobicContact CD1-CB 3.98Å; L173-I225 HydrophobicContact CD1-CG2 3.8Å; L173-D227 HydrophobicContact CD1-CB 4.08Å
174	I	93.9	Very high	82.9	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.005	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	108.1	171.2	-57.7	178	0	0	0	108.7	R201 L203 L212 L213 I216 I224 I225 I226 D227 I236	I174-R201 CarbonylContact C-O 3.56Å; I174-R201 WeakPolarHBondContact CA-O 3.45Å; I174-L203 HydrophobicContact CG2-CD2 4.35Å; I174-L203 HydrophobicContact CG2-CG 4.41Å; I174-L212 HydrophobicContact CG1-CD2 4.47Å; I174-L212 HydrophobicContact CG2-CD2 4.02Å; I174-L213 HydrophobicContact CD1-CD2 4.19Å; I174-I216 HydrophobicContact CD1-CD1 3.66Å; I174-I216 HydrophobicContact CG1-CD1 3.72Å; I174-I224 HydrophobicContact CD1-CG2 3.6Å; I174-I224 HydrophobicContact CG1-CG2 4.06Å; I174-I225 PolarHBondContact N-O 3.24Å; I174-I226 HydrophobicContact CD1-CG1 4.45Å; I174-D227 PolarHBondContact O-N 3.04Å; I174-I236 HydrophobicContact CD1-CG2 4.32Å; I174-I236 HydrophobicContact CG2-CD1 4.14Å
175	C	92	Very high	83.2	Confident	0 Å²	0	42 Å²	42	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	125.4	174	-67.6	0	0	0	0	111	K177 C180 R201 M202 L203	C175-K177 WeakPolarHBondContact CB-O 3.42Å; C175-C180 VanDerWaalsContact CA-SG 3.57Å; C175-C180 HydrophobicContact CB-CB 3.35Å; C175-C180 WeakPolarHBondContact CB-SG 3.4Å; C175-C180 WeakPolarHBondContact SG-CB 3.33Å; C175-C180 CovalentContact SG-SG 2.04Å; C175-C180 PolarHBondContact SG-SG 3.23Å; C175-R201 PolarHBondContact N-O 3.35Å; C175-M202 HydrophobicContact CB-CG 4.16Å; C175-M202 WeakPolarHBondContact O-CA 3.38Å; C175-L203 PolarHBondContact O-N 3.15Å
176	A	88.2	Confident	83.6	Confident	19 Å²	19	42.8 Å²	42.8	16%	0.157	24%	0.239	C	C	.	.	S	Bend	trans	-80.7	-17.1	174.8	0	0	0	0	0	114.5	L203 D227 A228 I232	A176-L203 HydrophobicContact CB-CD1 4.12Å; A176-D227 PolarHBondContact N-O 3.38Å; A176-A228 HydrophobicContact CB-CB 3.63Å; A176-I232 HydrophobicContact CB-CD1 4.38Å; A176-I232 HydrophobicContact CB-CG2 4.08Å
177	K	84.5	Confident	84.3	Confident	108 Å²	108	42 Å²	42	47%	0.47	24%	0.236	S	C	.	.	S	Bend	trans	-143.5	171.4	167.9	-52.7	-176.5	-176.1	173	0	110.1	E134 C175 E179 C180	E134-K177 IonicContact OE1-NZ 3.81Å; E134-K177 PolarHBondContact OE1-NZ 2.92Å; C175-K177 WeakPolarHBondContact CB-O 3.42Å; K177-E179 WeakPolarHBondContact CB-OE2 3.31Å; K177-E179 WeakPolarHBondContact CD-OE2 3.42Å; K177-E179 PolarHBondContact O-N 2.85Å; K177-C180 WeakPolarHBondContact O-CB 3.25Å
178	A	82.1	Confident	85.2	Confident	61 Å²	61	40.7 Å²	40.7	50%	0.504	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-30.8	177.5	0	0	0	0	0	114.2	C180 L181	A178-C180 PolarHBondContact O-N 3.05Å; A178-C180 VanDerWaalsContact O-N 3.13Å; A178-L181 PolarHBondContact O-N 3.07Å; A178-L181 VanDerWaalsContact O-N 3.15Å
179	E	80.6	Confident	86	Confident	69 Å²	69	45 Å²	45	32%	0.322	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-17.6	-177	-58.8	75.4	-164.8	0	0	112.9	E134 K177 L181 L182 R183	E134-E179 HydrophobicContact CG-CB 4.29Å; K177-E179 WeakPolarHBondContact CB-OE2 3.31Å; K177-E179 WeakPolarHBondContact CD-OE2 3.42Å; K177-E179 PolarHBondContact O-N 2.85Å; E179-L181 PolarHBondContact O-N 3.46Å; E179-L181 VanDerWaalsContact O-N 3.16Å; E179-L182 WeakPolarHBondContact O-CB 3.2Å; E179-L182 PolarHBondContact O-N 2.77Å; E179-R183 PolarHBondContact O-N 3.27Å
180	C	86.5	Confident	86.9	Confident	3 Å²	3	44.6 Å²	44.6	2%	0.02	22%	0.223	C	C	.	.	H	α-helix	trans	-42.4	-43.3	165.9	171	0	0	0	0	113	C175 K177 A178 L182 R183 L184 D227	C175-C180 VanDerWaalsContact CA-SG 3.57Å; C175-C180 HydrophobicContact CB-CB 3.35Å; C175-C180 WeakPolarHBondContact CB-SG 3.4Å; C175-C180 WeakPolarHBondContact SG-CB 3.33Å; C175-C180 CovalentContact SG-SG 2.04Å; C175-C180 PolarHBondContact SG-SG 3.23Å; K177-C180 WeakPolarHBondContact O-CB 3.25Å; A178-C180 PolarHBondContact O-N 3.05Å; A178-C180 VanDerWaalsContact O-N 3.13Å; C180-L182 VanDerWaalsContact C-N 3.31Å; C180-L182 PolarHBondContact O-N 3.21Å; C180-R183 PolarHBondContact O-N 3.44Å; C180-L184 WeakPolarHBondContact O-CB 3.48Å; C180-L184 PolarHBondContact O-N 3.45Å; C180-D227 WeakPolarHBondContact CA-OD2 3.44Å; C180-D227 HydrophobicContact CB-CB 4.43Å; C180-D227 VanDerWaalsContact CB-OD2 3.31Å; C180-D227 WeakPolarHBondContact CB-OD2 3.43Å; C180-D227 VanDerWaalsContact SG-CB 3.55Å; C180-D227 PolarHBondContact SG-OD2 3.49Å
181	L	84.9	Confident	87	Confident	64 Å²	64	42.5 Å²	42.5	34%	0.335	21%	0.209	S	C	.	.	H	α-helix	trans	-73	-22.1	-178.2	-66.4	174.8	0	0	0	113.6	L173 A178 E179 E185 V188 V200	L173-L181 HydrophobicContact CD2-CD2 4.5Å; A178-L181 PolarHBondContact O-N 3.07Å; A178-L181 VanDerWaalsContact O-N 3.15Å; E179-L181 PolarHBondContact O-N 3.46Å; E179-L181 VanDerWaalsContact O-N 3.16Å; L181-E185 WeakPolarHBondContact O-CA 3.5Å; L181-E185 PolarHBondContact O-N 3.21Å; L181-V188 HydrophobicContact CD2-CG2 4.18Å; L181-V200 HydrophobicContact CD1-CG1 4.47Å; L181-V200 HydrophobicContact CD2-CG1 3.87Å; L181-V200 HydrophobicContact CD2-CG2 4.4Å
182	L	82.3	Confident	86.6	Confident	83 Å²	83	49.3 Å²	49.3	44%	0.435	25%	0.245	S	C	.	.	H	α-helix	trans	-84.9	-30.7	172.3	-58.1	175.9	0	0	0	111.3	E179 C180	E179-L182 WeakPolarHBondContact O-CB 3.2Å; E179-L182 PolarHBondContact O-N 2.77Å; C180-L182 VanDerWaalsContact C-N 3.31Å; C180-L182 PolarHBondContact O-N 3.21Å
183	R	83.4	Confident	86	Confident	47 Å²	47	55.6 Å²	55.6	18%	0.177	28%	0.277	C	S	.	.	H	α-helix	trans	-71.2	-31.7	172.2	179	158.9	64.7	-150.5	2.3	112.8	N152 L155 S156 E179 C180 D227	N152-R183 WeakPolarHBondContact CB-O 3.34Å; L155-R183 HydrophobicContact CD2-CG 3.99Å; S156-R183 PolarHBondContact OG-O 2.98Å; E179-R183 PolarHBondContact O-N 3.27Å; C180-R183 PolarHBondContact O-N 3.44Å; R183-D227 IonicContact CZ-OD1 2.65Å; R183-D227 IonicContact CZ-OD2 2.78Å; R183-D227 IonicContact NE-OD1 3.93Å; R183-D227 PolarHBondContact NE-OD1 3.37Å; R183-D227 IonicContact NE-OD2 3.71Å; R183-D227 IonicContact NH2-OD1 3.42Å; R183-D227 PolarHBondContact NH2-OD1 3.27Å; R183-D227 IonicContact NH2-OD2 3.55Å; R183-D227 PolarHBondContact NH2-OD2 3.01Å
184	L	88.2	Confident	85.1	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.2	26.1	-175.3	-59.9	175.9	0	0	0	113.1	L155 S156 I159 L173 C180 E186 L187 V188 D227 T255	L155-L184 HydrophobicContact CG-CD2 4.43Å; S156-L184 WeakPolarHBondContact OG-CA 3.33Å; I159-L184 HydrophobicContact CD1-CD2 3.7Å; L173-L184 HydrophobicContact CD1-CD1 3.66Å; L173-L184 HydrophobicContact CD2-CD1 3.96Å; L173-L184 HydrophobicContact CG-CD1 4.48Å; C180-L184 WeakPolarHBondContact O-CB 3.48Å; C180-L184 PolarHBondContact O-N 3.45Å; L184-E186 PolarHBondContact O-N 2.9Å; L184-L187 HydrophobicContact CB-CB 4.33Å; L184-L187 HydrophobicContact CB-CD2 4.48Å; L184-L187 HydrophobicContact CD1-CD2 4.47Å; L184-L187 HydrophobicContact CD2-CD2 4.38Å; L184-L187 WeakPolarHBondContact O-CB 3.44Å; L184-L187 PolarHBondContact O-N 3.34Å; L184-L187 VanDerWaalsContact O-N 3.16Å; L184-V188 WeakPolarHBondContact O-CG2 3.34Å; L184-V188 PolarHBondContact O-N 2.86Å; L184-D227 HydrophobicContact CD1-CB 4.07Å; L184-T255 HydrophobicContact CD1-CG2 4.35Å
185	E	87.8	Confident	84	Confident	121 Å²	121	69.5 Å²	69.5	57%	0.565	34%	0.336	S	S	*	.	H	α-helix	trans	-54.3	-48.6	-176.2	-173.4	-175.5	163	0	0	112	L181 L187 V188 R189	L181-E185 WeakPolarHBondContact O-CA 3.5Å; L181-E185 PolarHBondContact O-N 3.21Å; E185-L187 VanDerWaalsContact C-N 3.32Å; E185-L187 PolarHBondContact O-N 3.5Å; E185-V188 PolarHBondContact O-N 3.37Å; E185-R189 VanDerWaalsContact O-CB 3.3Å; E185-R189 WeakPolarHBondContact O-CB 3.39Å; E185-R189 PolarHBondContact O-N 2.92Å
186	E	87.4	Confident	83.4	Confident	72 Å²	72	72.7 Å²	72.7	34%	0.336	35%	0.351	S	S	.	.	H	α-helix	trans	-70.9	-28.4	-177.1	-168.8	57.9	-151.1	0	0	112.2	L157 L184 R189 H190	L157-E186 HydrophobicContact CD2-CG 4.46Å; L184-E186 PolarHBondContact O-N 2.9Å; E186-R189 PolarHBondContact O-N 3.34Å; E186-R189 WeakPolarHBondContact OE1-CD 3.41Å; E186-R189 WeakPolarHBondContact OE2-CD 3.47Å; E186-R189 IonicContact OE2-NE 3.69Å; E186-H190 WeakPolarHBondContact O-CB 3.29Å; E186-H190 PolarHBondContact O-N 3.08Å
187	L	88.8	Confident	83.1	Confident	2 Å²	2	76 Å²	76	1%	0.01	37%	0.369	C	S	.	.	H	α-helix	trans	-67.1	-47.9	172.4	-178	67.7	0	0	0	110.5	I159 L163 L184 E185 R189 H190 F191 I225	I159-L187 HydrophobicContact CB-CD1 4.38Å; I159-L187 HydrophobicContact CB-CD2 4.19Å; I159-L187 HydrophobicContact CG2-CD1 4.04Å; I159-L187 HydrophobicContact CG2-CD2 3.63Å; L163-L187 HydrophobicContact CD1-CD1 4.19Å; L184-L187 HydrophobicContact CB-CB 4.33Å; L184-L187 HydrophobicContact CB-CD2 4.48Å; L184-L187 HydrophobicContact CD1-CD2 4.47Å; L184-L187 HydrophobicContact CD2-CD2 4.38Å; L184-L187 WeakPolarHBondContact O-CB 3.44Å; L184-L187 PolarHBondContact O-N 3.34Å; L184-L187 VanDerWaalsContact O-N 3.16Å; E185-L187 VanDerWaalsContact C-N 3.32Å; E185-L187 PolarHBondContact O-N 3.5Å; L187-R189 VanDerWaalsContact C-N 3.3Å; L187-R189 PolarHBondContact O-N 3.47Å; L187-H190 WeakPolarHBondContact O-CB 3.41Å; L187-H190 PolarHBondContact O-N 3.11Å; L187-F191 HydrophobicContact CD1-CD2 4.37Å; L187-F191 HydrophobicContact CD1-CE2 3.98Å; L187-F191 HydrophobicContact CG-CD2 4.43Å; L187-F191 HydrophobicContact CG-CE2 4.36Å; L187-F191 WeakPolarHBondContact O-CD2 3.24Å; L187-F191 PolarHBondContact O-N 3.44Å; L187-I225 HydrophobicContact CD2-CD1 4.27Å
188	V	88.1	Confident	83.3	Confident	31 Å²	31	72.5 Å²	72.5	19%	0.188	36%	0.355	C	S	.	.	H	α-helix	trans	-61.7	-41.1	175.4	176	0	0	0	0	110.6	L181 L184 E185 H190 F191 L192 L198	L181-V188 HydrophobicContact CD2-CG2 4.18Å; L184-V188 WeakPolarHBondContact O-CG2 3.34Å; L184-V188 PolarHBondContact O-N 2.86Å; E185-V188 PolarHBondContact O-N 3.37Å; V188-H190 PolarHBondContact O-N 3Å; V188-F191 PolarHBondContact O-N 3.25Å; V188-L192 HydrophobicContact CG1-CD1 4.15Å; V188-L192 WeakPolarHBondContact O-CG 3.43Å; V188-L192 PolarHBondContact O-N 2.95Å; V188-L198 HydrophobicContact CG2-CD2 4.03Å
189	R	86.6	Confident	83.6	Confident	128 Å²	128	71 Å²	71	48%	0.483	34%	0.341	S	S	.	.	H	α-helix	trans	-60.4	-42	175.1	-168.6	-165.2	-174.2	85.3	3.1	112.3	E185 E186 L187 L192 I193	E185-R189 VanDerWaalsContact O-CB 3.3Å; E185-R189 WeakPolarHBondContact O-CB 3.39Å; E185-R189 PolarHBondContact O-N 2.92Å; E186-R189 PolarHBondContact O-N 3.34Å; E186-R189 WeakPolarHBondContact OE1-CD 3.41Å; E186-R189 WeakPolarHBondContact OE2-CD 3.47Å; E186-R189 IonicContact OE2-NE 3.69Å; L187-R189 VanDerWaalsContact C-N 3.3Å; L187-R189 PolarHBondContact O-N 3.47Å; R189-L192 PolarHBondContact O-N 3.45Å; R189-I193 HydrophobicContact CG-CD1 4.14Å; R189-I193 WeakPolarHBondContact O-CG1 3.5Å; R189-I193 PolarHBondContact O-N 2.74Å
190	H	83.6	Confident	84.1	Confident	70 Å²	70	70.8 Å²	70.8	32%	0.324	34%	0.344	S	S	.	.	H	α-helix	trans	-58.5	-50.1	176.3	-168	81.5	0	0	0	110.9	Q164 E186 L187 V188 L192 I193 S194	Q164-H190 PolarHBondContact NE2-CE1 3.03Å; Q164-H190 PolarHBondContact NE2-NE2 2.98Å; E186-H190 WeakPolarHBondContact O-CB 3.29Å; E186-H190 PolarHBondContact O-N 3.08Å; L187-H190 WeakPolarHBondContact O-CB 3.41Å; L187-H190 PolarHBondContact O-N 3.11Å; V188-H190 PolarHBondContact O-N 3Å; H190-L192 PolarHBondContact O-N 3.36Å; H190-I193 PolarHBondContact O-N 3.09Å; H190-I193 VanDerWaalsContact O-N 3.12Å; H190-S194 WeakPolarHBondContact O-CB 3.48Å; H190-S194 PolarHBondContact O-N 3.45Å
191	F	83.6	Confident	84.2	Confident	13 Å²	13	72.8 Å²	72.8	6%	0.057	35%	0.351	C	S	.	.	H	α-helix	trans	-61.1	-40.3	177.6	-82.6	-75.5	0	0	0	112.8	L163 A171 L187 V188 I193 S194 E196 L198	L163-F191 HydrophobicContact CD1-CE2 3.95Å; L163-F191 HydrophobicContact CD1-CZ 3.96Å; A171-F191 HydrophobicContact CB-CZ 4.49Å; L187-F191 HydrophobicContact CD1-CD2 4.37Å; L187-F191 HydrophobicContact CD1-CE2 3.98Å; L187-F191 HydrophobicContact CG-CD2 4.43Å; L187-F191 HydrophobicContact CG-CE2 4.36Å; L187-F191 WeakPolarHBondContact O-CD2 3.24Å; L187-F191 PolarHBondContact O-N 3.44Å; V188-F191 PolarHBondContact O-N 3.25Å; F191-I193 PolarHBondContact O-N 3.05Å; F191-S194 WeakPolarHBondContact CA-OG 3.48Å; F191-S194 PolarHBondContact O-N 3.49Å; F191-S194 PolarHBondContact O-OG 2.91Å; F191-E196 HydrophobicContact CD1-CB 3.75Å; F191-E196 HydrophobicContact CE1-CB 3.63Å; F191-L198 HydrophobicContact CB-CB 3.79Å; F191-L198 HydrophobicContact CB-CD2 4.31Å; F191-L198 HydrophobicContact CD1-CB 3.94Å; F191-L198 HydrophobicContact CD2-CB 3.94Å; F191-L198 HydrophobicContact CD2-CD1 4.33Å; F191-L198 HydrophobicContact CD2-CD2 3.84Å; F191-L198 HydrophobicContact CD2-CG 4.26Å; F191-L198 HydrophobicContact CE2-CD1 4.32Å; F191-L198 HydrophobicContact CG-CB 3.6Å; F191-L198 HydrophobicContact CG-CD2 4.23Å; F191-L198 HydrophobicContact CG-CG 4.41Å
192	L	81.1	Confident	84.4	Confident	144 Å²	144	74.8 Å²	74.8	75%	0.754	36%	0.36	S	S	*	.	H	α-helix	trans	-62.6	-20.8	176	-72.6	171	0	0	0	114.7	V188 R189 H190	V188-L192 HydrophobicContact CG1-CD1 4.15Å; V188-L192 WeakPolarHBondContact O-CG 3.43Å; V188-L192 PolarHBondContact O-N 2.95Å; R189-L192 PolarHBondContact O-N 3.45Å; H190-L192 PolarHBondContact O-N 3.36Å
193	I	79.3	Confident	84.7	Confident	131 Å²	131	72 Å²	72	67%	0.672	35%	0.345	S	S	*	.	H	α-helix	trans	-98	-23.5	177.7	-64	168	0	0	0	111.4	R189 H190 F191	R189-I193 HydrophobicContact CG-CD1 4.14Å; R189-I193 WeakPolarHBondContact O-CG1 3.5Å; R189-I193 PolarHBondContact O-N 2.74Å; H190-I193 PolarHBondContact O-N 3.09Å; H190-I193 VanDerWaalsContact O-N 3.12Å; F191-I193 PolarHBondContact O-N 3.05Å
194	S	74.6	Confident	84.7	Confident	40 Å²	40	74.6 Å²	74.6	28%	0.28	36%	0.363	S	S	.	.	S	Bend	trans	-73.6	-173.9	-179.5	82.3	0	0	0	0	113.8	H190 F191 E196	H190-S194 WeakPolarHBondContact O-CB 3.48Å; H190-S194 PolarHBondContact O-N 3.45Å; F191-S194 WeakPolarHBondContact CA-OG 3.48Å; F191-S194 PolarHBondContact O-N 3.49Å; F191-S194 PolarHBondContact O-OG 2.91Å; S194-E196 WeakPolarHBondContact OG-CB 3.46Å; S194-E196 PolarHBondContact OG-N 3.4Å; S194-E196 PolarHBondContact OG-O 2.98Å
195	R	70.7	Confident	84.1	Confident	254 Å²	254	83.7 Å²	83.7	96%	0.958	41%	0.406	S	S	*	.	S	Bend	trans	-104	5.5	163.7	-70.4	-175	173.8	-174.9	-1.3	113.1
196	E	79.8	Confident	83.5	Confident	67 Å²	67	81.7 Å²	81.7	31%	0.313	41%	0.405	S	S	.	.	S	Bend	trans	-92.8	152.9	-172.8	-57.9	171.1	-175	0	0	109.4	P169 F191 S194	P169-E196 HydrophobicContact CB-CG 4.49Å; P169-E196 CarbonylContact O-C 3.57Å; P169-E196 VanDerWaalsContact O-CA 3.29Å; P169-E196 WeakPolarHBondContact O-CA 3.46Å; P169-E196 WeakPolarHBondContact O-CB 3.19Å; F191-E196 HydrophobicContact CD1-CB 3.75Å; F191-E196 HydrophobicContact CE1-CB 3.63Å; S194-E196 WeakPolarHBondContact OG-CB 3.46Å; S194-E196 PolarHBondContact OG-N 3.4Å; S194-E196 PolarHBondContact OG-O 2.98Å
197	T	81.9	Confident	83	Confident	88 Å²	88	82.1 Å²	82.1	54%	0.54	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	117.5	-175.3	60.5	0	0	0	0	112.4	P169 T170 A171	P169-T197 PolarHBondContact O-N 3.16Å; T170-T197 WeakPolarHBondContact CA-O 3.42Å; T170-T197 WeakPolarHBondContact CG2-OG1 3.41Å; A171-T197 PolarHBondContact N-O 3.24Å
198	L	87.9	Confident	82.9	Confident	35 Å²	35	84.9 Å²	84.9	18%	0.183	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	116.9	168.6	-175.3	67.3	0	0	0	109.6	A171 L173 V188 F191 V200	A171-L198 HydrophobicContact CB-CD1 3.96Å; L173-L198 HydrophobicContact CB-CD1 4.06Å; V188-L198 HydrophobicContact CG2-CD2 4.03Å; F191-L198 HydrophobicContact CB-CB 3.79Å; F191-L198 HydrophobicContact CB-CD2 4.31Å; F191-L198 HydrophobicContact CD1-CB 3.94Å; F191-L198 HydrophobicContact CD2-CB 3.94Å; F191-L198 HydrophobicContact CD2-CD1 4.33Å; F191-L198 HydrophobicContact CD2-CD2 3.84Å; F191-L198 HydrophobicContact CD2-CG 4.26Å; F191-L198 HydrophobicContact CE2-CD1 4.32Å; F191-L198 HydrophobicContact CG-CB 3.6Å; F191-L198 HydrophobicContact CG-CD2 4.23Å; F191-L198 HydrophobicContact CG-CG 4.41Å; L198-V200 HydrophobicContact CD2-CG2 4.31Å; L198-V200 HydrophobicContact CG-CG2 4.38Å
199	S	88.9	Confident	82.9	Confident	29 Å²	29	83.4 Å²	83.4	20%	0.203	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	126.4	166.3	53.8	0	0	0	0	109.3	A171 S172 L173	A171-S199 PolarHBondContact O-N 3.4Å; A171-S199 PolarHBondContact O-OG 3.39Å; A171-S199 VanDerWaalsContact O-OG 3.07Å; S172-S199 CarbonylContact C-O 3.56Å; S172-S199 WeakPolarHBondContact CA-O 3.46Å; S172-S199 VanDerWaalsContact CA-OG 3.27Å; S172-S199 WeakPolarHBondContact CA-OG 3.43Å; S172-S199 WeakPolarHBondContact CB-OG 3.19Å; S172-S199 PolarHBondContact OG-OG 2.92Å; L173-S199 PolarHBondContact N-O 3.46Å
200	V	90.1	Very high	82.9	Confident	64 Å²	64	78.5 Å²	78.5	39%	0.388	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	128	176.7	173.4	0	0	0	0	108.8	L181 L198	L181-V200 HydrophobicContact CD1-CG1 4.47Å; L181-V200 HydrophobicContact CD2-CG1 3.87Å; L181-V200 HydrophobicContact CD2-CG2 4.4Å; L198-V200 HydrophobicContact CD2-CG2 4.31Å; L198-V200 HydrophobicContact CG-CG2 4.38Å
201	R	89.7	Confident	83.1	Confident	45 Å²	45	79 Å²	79	17%	0.17	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	127.4	-170.4	-65.3	-60.1	-168.5	174.8	2.2	108.3	S172 L173 I174 C175 L212 E215 I216 D219	S172-R201 WeakPolarHBondContact OG-CG 3.48Å; L173-R201 WeakPolarHBondContact O-CB 3.49Å; L173-R201 PolarHBondContact O-N 3.12Å; L173-R201 VanDerWaalsContact O-O 3.05Å; I174-R201 CarbonylContact C-O 3.56Å; I174-R201 WeakPolarHBondContact CA-O 3.45Å; C175-R201 PolarHBondContact N-O 3.35Å; R201-L212 HydrophobicContact CB-CD1 3.87Å; R201-L212 HydrophobicContact CB-CD2 4Å; R201-L212 HydrophobicContact CB-CG 4.05Å; R201-L212 HydrophobicContact CG-CD1 4.31Å; R201-E215 IonicContact CZ-OE1 2.98Å; R201-E215 IonicContact CZ-OE2 3.35Å; R201-E215 IonicContact NH1-OE1 3.21Å; R201-E215 PolarHBondContact NH1-OE1 3Å; R201-E215 IonicContact NH1-OE2 2.9Å; R201-E215 PolarHBondContact NH1-OE2 2.93Å; R201-E215 IonicContact NH2-OE1 2.91Å; R201-E215 PolarHBondContact NH2-OE1 2.91Å; R201-E215 IonicContact NH2-OE2 3.61Å; R201-I216 HydrophobicContact CB-CD1 4.48Å; R201-I216 HydrophobicContact CG-CD1 4.14Å; R201-I216 HydrophobicContact CG-CG1 4.15Å; R201-D219 IonicContact CZ-OD2 2.64Å; R201-D219 IonicContact NH2-OD2 3.89Å; R201-D219 PolarHBondContact NH2-OD2 3.29Å
202	M	89.7	Confident	83.4	Confident	106 Å²	106	79.4 Å²	79.4	52%	0.522	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	146.9	178	-63.3	-168.2	-63.3	0	0	110.6	C175	C175-M202 HydrophobicContact CB-CG 4.16Å; C175-M202 WeakPolarHBondContact O-CA 3.38Å
203	L	88.1	Confident	83.8	Confident	24 Å²	24	72.6 Å²	72.6	13%	0.126	38%	0.375	C	S	.	.			trans	-71.5	147.6	166.4	-66.6	-177.7	0	0	0	111	I174 C175 A176 L207 P209 L212 I232 I236	I174-L203 HydrophobicContact CG2-CD2 4.35Å; I174-L203 HydrophobicContact CG2-CG 4.41Å; C175-L203 PolarHBondContact O-N 3.15Å; A176-L203 HydrophobicContact CB-CD1 4.12Å; L203-L207 HydrophobicContact CD1-CD2 4.37Å; L203-P209 HydrophobicContact CD2-CB 3.9Å; L203-L212 HydrophobicContact CD2-CD2 3.95Å; L203-I232 HydrophobicContact CD1-CG2 3.67Å; L203-I236 HydrophobicContact CD1-CD1 4.31Å
204	D	82.3	Confident	84.1	Confident	103 Å²	103	70.6 Å²	70.6	55%	0.551	36%	0.362	S	S	*	.			trans	-82.1	164.9	172.5	174.8	53.4	0	0	0	111.5	S206 L207	D204-S206 PolarHBondContact O-N 3.42Å; D204-S206 VanDerWaalsContact O-N 3.1Å; D204-S206 VanDerWaalsContact OD2-CB 3.28Å; D204-S206 WeakPolarHBondContact OD2-CB 3.46Å; D204-S206 PolarHBondContact OD2-N 2.88Å; D204-S206 PolarHBondContact OD2-OG 2.86Å; D204-L207 PolarHBondContact O-N 3.42Å
205	E	76.8	Confident	84.6	Confident	191 Å²	191	73 Å²	73	89%	0.893	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-24.8	177.5	-66.2	-172.4	172.5	0	0	113	L207	E205-L207 PolarHBondContact O-N 2.96Å
206	S	75.7	Confident	85.5	Confident	78 Å²	78	60.9 Å²	60.9	55%	0.545	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-14.6	172.9	60.4	0	0	0	0	114.9	D204 D208	D204-S206 PolarHBondContact O-N 3.42Å; D204-S206 VanDerWaalsContact O-N 3.1Å; D204-S206 VanDerWaalsContact OD2-CB 3.28Å; D204-S206 WeakPolarHBondContact OD2-CB 3.46Å; D204-S206 PolarHBondContact OD2-N 2.88Å; D204-S206 PolarHBondContact OD2-OG 2.86Å; S206-D208 PolarHBondContact O-N 3.22Å
207	L	76.4	Confident	85.6	Confident	82 Å²	82	61.9 Å²	61.9	43%	0.429	32%	0.324	S	S	.	.			trans	54.2	17.4	-175.3	-61.2	176.1	0	0	0	115.3	L203 D204 E205 P209 H235	L203-L207 HydrophobicContact CD1-CD2 4.37Å; D204-L207 PolarHBondContact O-N 3.42Å; E205-L207 PolarHBondContact O-N 2.96Å; L207-P209 VanDerWaalsContact O-CD 3.27Å; L207-P209 WeakPolarHBondContact O-CD 3.32Å; L207-H235 PolarHBondContact O-ND1 3.42Å
208	D	85.3	Confident	85.6	Confident	60 Å²	60	62.6 Å²	62.6	32%	0.321	32%	0.324	S	S	.	.			trans	-85.4	112.7	172	-177.3	19.3	0	0	0	110.9	S206 T210 P211	S206-D208 PolarHBondContact O-N 3.22Å; D208-T210 VanDerWaalsContact C-N 3.26Å; D208-T210 PolarHBondContact O-N 2.98Å; D208-T210 WeakPolarHBondContact OD1-CB 3.37Å; D208-T210 PolarHBondContact OD1-N 3.05Å; D208-T210 PolarHBondContact OD1-OG1 3.15Å; D208-T210 WeakPolarHBondContact OD2-CB 3.48Å; D208-T210 PolarHBondContact OD2-OG1 3.23Å; D208-P211 WeakPolarHBondContact O-CD 3.39Å
209	P	88.4	Confident	85.2	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	34%	0.336	C	S	.	.			trans	-78.1	-7.4	175.8	35.6	-39.4	0	0	0	112.9	L203 L207 L212 L213 I236 K239	L203-P209 HydrophobicContact CD2-CB 3.9Å; L207-P209 VanDerWaalsContact O-CD 3.27Å; L207-P209 WeakPolarHBondContact O-CD 3.32Å; P209-L212 WeakPolarHBondContact O-CB 3.46Å; P209-L212 PolarHBondContact O-N 3.2Å; P209-L212 VanDerWaalsContact O-N 3.12Å; P209-L213 HydrophobicContact CB-CD1 3.86Å; P209-L213 HydrophobicContact CB-CG 4.19Å; P209-L213 HydrophobicContact CG-CD1 4.07Å; P209-L213 WeakPolarHBondContact O-CB 3.37Å; P209-L213 WeakPolarHBondContact O-CG 3.33Å; P209-L213 PolarHBondContact O-N 3.31Å; P209-I236 HydrophobicContact CB-CG1 4.13Å; P209-I236 HydrophobicContact CG-CG1 4.34Å; P209-K239 HydrophobicContact CG-CB 3.59Å; P209-K239 HydrophobicContact CG-CG 3.7Å
210	T	87.1	Confident	84.5	Confident	24 Å²	24	69 Å²	69	15%	0.147	35%	0.351	C	S	.	.	H	α-helix	trans	-53.2	-46.7	-174.8	-56	0	0	0	0	115.2	D208 K214 L243	D208-T210 VanDerWaalsContact C-N 3.26Å; D208-T210 PolarHBondContact O-N 2.98Å; D208-T210 WeakPolarHBondContact OD1-CB 3.37Å; D208-T210 PolarHBondContact OD1-N 3.05Å; D208-T210 PolarHBondContact OD1-OG1 3.15Å; D208-T210 WeakPolarHBondContact OD2-CB 3.48Å; D208-T210 PolarHBondContact OD2-OG1 3.23Å; T210-K214 HydrophobicContact CG2-CD 4.46Å; T210-K214 WeakPolarHBondContact O-CD 3.23Å; T210-K214 VanDerWaalsContact O-CG 3.32Å; T210-K214 WeakPolarHBondContact O-CG 3.2Å; T210-K214 PolarHBondContact O-N 2.93Å; T210-L243 HydrophobicContact CG2-CD1 4.41Å; T210-L243 HydrophobicContact CG2-CD2 4.49Å
211	P	88.3	Confident	84.2	Confident	82 Å²	82	66.5 Å²	66.5	53%	0.532	34%	0.336	S	S	.	.	H	α-helix	trans	-66.2	-40.5	176	25.3	-33.6	0	0	0	111.9	D208 K214 E215	D208-P211 WeakPolarHBondContact O-CD 3.39Å; P211-K214 PolarHBondContact O-N 3.48Å; P211-E215 PolarHBondContact O-N 3.47Å; P211-E215 VanDerWaalsContact O-N 3.09Å
212	L	89.2	Confident	83.8	Confident	21 Å²	21	66.2 Å²	66.2	11%	0.11	34%	0.343	C	S	.	.	H	α-helix	trans	-65.8	-44	-177.2	-159.1	67.4	0	0	0	112.1	I174 R201 L203 P209 K214 E215 I216	I174-L212 HydrophobicContact CG1-CD2 4.47Å; I174-L212 HydrophobicContact CG2-CD2 4.02Å; R201-L212 HydrophobicContact CB-CD1 3.87Å; R201-L212 HydrophobicContact CB-CD2 4Å; R201-L212 HydrophobicContact CB-CG 4.05Å; R201-L212 HydrophobicContact CG-CD1 4.31Å; L203-L212 HydrophobicContact CD2-CD2 3.95Å; P209-L212 WeakPolarHBondContact O-CB 3.46Å; P209-L212 PolarHBondContact O-N 3.2Å; P209-L212 VanDerWaalsContact O-N 3.12Å; L212-K214 VanDerWaalsContact C-N 3.34Å; L212-K214 PolarHBondContact O-N 2.04Å; L212-E215 PolarHBondContact O-N 3.18Å; L212-I216 HydrophobicContact CG-CD1 4.33Å; L212-I216 VanDerWaalsContact O-CG1 3.29Å; L212-I216 WeakPolarHBondContact O-CG1 3.36Å; L212-I216 PolarHBondContact O-N 3Å
213	L	89.5	Confident	83.7	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-65.3	-36	177.3	-73.5	169.8	0	0	0	112.2	I174 P209 R217 I236 K239 A240 L243 M245	I174-L213 HydrophobicContact CD1-CD2 4.19Å; P209-L213 HydrophobicContact CB-CD1 3.86Å; P209-L213 HydrophobicContact CB-CG 4.19Å; P209-L213 HydrophobicContact CG-CD1 4.07Å; P209-L213 WeakPolarHBondContact O-CB 3.37Å; P209-L213 WeakPolarHBondContact O-CG 3.33Å; P209-L213 PolarHBondContact O-N 3.31Å; L213-R217 VanDerWaalsContact O-CB 3.28Å; L213-R217 WeakPolarHBondContact O-CB 3.35Å; L213-R217 PolarHBondContact O-N 3.05Å; L213-I236 HydrophobicContact CD2-CG2 4.39Å; L213-K239 HydrophobicContact CD1-CB 3.84Å; L213-A240 HydrophobicContact CD1-CB 4.22Å; L213-A240 HydrophobicContact CD2-CB 4.38Å; L213-L243 HydrophobicContact CB-CD1 3.51Å; L213-L243 HydrophobicContact CD1-CD1 4.11Å; L213-L243 HydrophobicContact CG-CD1 4.48Å; L213-M245 HydrophobicContact CB-SD 3.91Å; L213-M245 HydrophobicContact CD2-CE 4.17Å; L213-M245 HydrophobicContact CD2-SD 4.28Å; L213-M245 WeakPolarHBondContact O-CE 3.28Å; L213-M245 VanDerWaalsContact O-SD 3.39Å
214	K	85.3	Confident	83.9	Confident	89 Å²	89	60.3 Å²	60.3	39%	0.387	31%	0.314	S	S	.	.	H	α-helix	trans	-62.3	-47.1	171.2	-71.6	167.2	-176.6	172.3	0	110.8	T210 P211 L212 I216 R217 D218 L243	T210-K214 HydrophobicContact CG2-CD 4.46Å; T210-K214 WeakPolarHBondContact O-CD 3.23Å; T210-K214 VanDerWaalsContact O-CG 3.32Å; T210-K214 WeakPolarHBondContact O-CG 3.2Å; T210-K214 PolarHBondContact O-N 2.93Å; P211-K214 PolarHBondContact O-N 3.48Å; L212-K214 VanDerWaalsContact C-N 3.34Å; L212-K214 PolarHBondContact O-N 2.04Å; K214-I216 PolarHBondContact O-N 3.29Å; K214-R217 WeakPolarHBondContact O-CB 3.48Å; K214-R217 PolarHBondContact O-N 2.67Å; K214-D218 WeakPolarHBondContact O-CB 3.33Å; K214-D218 PolarHBondContact O-N 3.37Å; K214-L243 HydrophobicContact CG-CD1 4.31Å; K214-L243 HydrophobicContact CG-CD2 4.18Å
215	E	86.8	Confident	84.5	Confident	91 Å²	91	55.4 Å²	55.4	43%	0.425	29%	0.288	S	S	.	.	H	α-helix	trans	-61.6	-45.5	179.4	-148.7	-173.6	154	0	0	111.9	R201 P211 L212 R217 D218 D219	R201-E215 IonicContact CZ-OE1 2.98Å; R201-E215 IonicContact CZ-OE2 3.35Å; R201-E215 IonicContact NH1-OE1 3.21Å; R201-E215 PolarHBondContact NH1-OE1 3Å; R201-E215 IonicContact NH1-OE2 2.9Å; R201-E215 PolarHBondContact NH1-OE2 2.93Å; R201-E215 IonicContact NH2-OE1 2.91Å; R201-E215 PolarHBondContact NH2-OE1 2.91Å; R201-E215 IonicContact NH2-OE2 3.61Å; P211-E215 PolarHBondContact O-N 3.47Å; P211-E215 VanDerWaalsContact O-N 3.09Å; L212-E215 PolarHBondContact O-N 3.18Å; E215-R217 VanDerWaalsContact C-N 3.31Å; E215-R217 PolarHBondContact O-N 3.11Å; E215-D218 PolarHBondContact O-N 2.96Å; E215-D219 WeakPolarHBondContact O-CB 3.49Å; E215-D219 PolarHBondContact O-N 3.48Å
216	I	88.1	Confident	85.3	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-60.5	-38.4	176	-67.8	167.9	0	0	0	112.2	I174 R201 L212 K214 K220 V221 I224 M245	I174-I216 HydrophobicContact CD1-CD1 3.66Å; I174-I216 HydrophobicContact CG1-CD1 3.72Å; R201-I216 HydrophobicContact CB-CD1 4.48Å; R201-I216 HydrophobicContact CG-CD1 4.14Å; R201-I216 HydrophobicContact CG-CG1 4.15Å; L212-I216 HydrophobicContact CG-CD1 4.33Å; L212-I216 VanDerWaalsContact O-CG1 3.29Å; L212-I216 WeakPolarHBondContact O-CG1 3.36Å; L212-I216 PolarHBondContact O-N 3Å; K214-I216 PolarHBondContact O-N 3.29Å; I216-K220 PolarHBondContact O-N 3.02Å; I216-V221 HydrophobicContact CG2-CB 4.26Å; I216-V221 PolarHBondContact O-N 2.62Å; I216-V221 VanDerWaalsContact O-N 3.13Å; I216-I224 HydrophobicContact CG2-CD1 3.8Å; I216-I224 HydrophobicContact CG2-CG1 4.04Å; I216-M245 HydrophobicContact CG2-CE 4.38Å
217	R	83.4	Confident	86.1	Confident	87 Å²	87	42.8 Å²	42.8	33%	0.328	22%	0.22	S	C	.	.	H	α-helix	trans	-69	-39.9	176.2	-176.5	-164.7	66.6	-172.7	-1.2	111.8	L213 K214 E215 K220 M245	L213-R217 VanDerWaalsContact O-CB 3.28Å; L213-R217 WeakPolarHBondContact O-CB 3.35Å; L213-R217 PolarHBondContact O-N 3.05Å; K214-R217 WeakPolarHBondContact O-CB 3.48Å; K214-R217 PolarHBondContact O-N 2.67Å; E215-R217 VanDerWaalsContact C-N 3.31Å; E215-R217 PolarHBondContact O-N 3.11Å; R217-K220 WeakPolarHBondContact O-CA 3.4Å; R217-K220 PolarHBondContact O-N 3.38Å; R217-M245 HydrophobicContact CB-CE 3.89Å; R217-M245 HydrophobicContact CB-SD 3.96Å; R217-M245 HydrophobicContact CG-CG 4.46Å; R217-M245 HydrophobicContact CG-SD 4.46Å
218	D	80.1	Confident	86.6	Confident	103 Å²	103	39.2 Å²	39.2	55%	0.551	20%	0.203	S	C	*	.	H	α-helix	trans	-77.1	-30.2	-177.6	-59.8	-7.1	0	0	0	110.7	K214 E215 K220	K214-D218 WeakPolarHBondContact O-CB 3.33Å; K214-D218 PolarHBondContact O-N 3.37Å; E215-D218 PolarHBondContact O-N 2.96Å; D218-K220 PolarHBondContact O-N 3.05Å
219	D	79.4	Confident	86.6	Confident	81 Å²	81	40.3 Å²	40.3	43%	0.433	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-12.2	162.5	-75.8	-24.9	0	0	0	113.2	R201 E215 V221	R201-D219 IonicContact CZ-OD2 2.64Å; R201-D219 IonicContact NH2-OD2 3.89Å; R201-D219 PolarHBondContact NH2-OD2 3.29Å; E215-D219 WeakPolarHBondContact O-CB 3.49Å; E215-D219 PolarHBondContact O-N 3.48Å; D219-V221 VanDerWaalsContact C-N 3.33Å; D219-V221 HydrophobicContact CB-CG2 4.06Å; D219-V221 PolarHBondContact O-N 3.4Å
220	K	75.9	Confident	86.4	Confident	117 Å²	117	41.6 Å²	41.6	51%	0.509	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.3	25.7	-179.3	-47.2	-176.4	-174	-179.7	0	115.3	I216 R217 D218 L764	I216-K220 PolarHBondContact O-N 3.02Å; R217-K220 WeakPolarHBondContact O-CA 3.4Å; R217-K220 PolarHBondContact O-N 3.38Å; D218-K220 PolarHBondContact O-N 3.05Å; K220-L764 HydrophobicContact CD-CD2 4.01Å
221	V	82.5	Confident	86.2	Confident	13 Å²	13	44.1 Å²	44.1	8%	0.079	24%	0.238	C	C	.	.			trans	-79.9	122.6	179.2	-174.7	0	0	0	0	110.6	I216 D219 Y250	I216-V221 HydrophobicContact CG2-CB 4.26Å; I216-V221 PolarHBondContact O-N 2.62Å; I216-V221 VanDerWaalsContact O-N 3.13Å; D219-V221 VanDerWaalsContact C-N 3.33Å; D219-V221 HydrophobicContact CB-CG2 4.06Å; D219-V221 PolarHBondContact O-N 3.4Å; V221-Y250 WeakPolarHBondContact O-CE1 3.24Å
222	A	81.5	Confident	86.2	Confident	38 Å²	38	42 Å²	42	31%	0.314	22%	0.222	S	C	.	.			trans	-90.1	-32	-177.5	0	0	0	0	0	113.8	Y250 K251	A222-Y250 WeakPolarHBondContact O-CA 3.4Å; A222-K251 PolarHBondContact O-N 3.46Å
223	T	88.4	Confident	86.3	Confident	6 Å²	6	41 Å²	41	4%	0.037	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	115.6	-178	-56.2	0	0	0	0	110.1	L163 Y168 A171 S172 I253	L163-T223 HydrophobicContact CD2-CG2 3.71Å; Y168-T223 HydrophobicContact CD2-CG2 4.19Å; Y168-T223 WeakPolarHBondContact CD2-OG1 3.43Å; A171-T223 CarbonylContact C-O 3.54Å; A171-T223 WeakPolarHBondContact CA-O 3.33Å; A171-T223 HydrophobicContact CB-CG2 4.45Å; S172-T223 PolarHBondContact N-O 3.11Å; T223-I253 HydrophobicContact CG2-CD1 4.46Å
224	I	92.6	Very high	86.2	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	118.2	-172.9	-57.1	174.1	0	0	0	109.1	S172 I174 I216 I226 M245 Y250 K251 Y252 I253	S172-I224 CarbonylContact O-C 3.55Å; S172-I224 WeakPolarHBondContact O-CA 3.49Å; I174-I224 HydrophobicContact CD1-CG2 3.6Å; I174-I224 HydrophobicContact CG1-CG2 4.06Å; I216-I224 HydrophobicContact CG2-CD1 3.8Å; I216-I224 HydrophobicContact CG2-CG1 4.04Å; I224-I226 HydrophobicContact CG2-CG1 4.17Å; I224-M245 HydrophobicContact CD1-CE 3.94Å; I224-Y250 HydrophobicContact CD1-CD1 4.01Å; I224-Y250 HydrophobicContact CD1-CE1 4.49Å; I224-K251 PolarHBondContact N-O 3.5Å; I224-Y252 HydrophobicContact CB-CD1 3.92Å; I224-Y252 HydrophobicContact CB-CE1 3.89Å; I224-Y252 HydrophobicContact CD1-CE1 3.73Å; I224-Y252 HydrophobicContact CG1-CE1 4.36Å; I224-Y252 HydrophobicContact CG2-CD1 4.09Å; I224-Y252 HydrophobicContact CG2-CE1 3.99Å; I224-Y252 CarbonylContact O-C 3.57Å; I224-Y252 VanDerWaalsContact O-CA 3.31Å; I224-Y252 WeakPolarHBondContact O-CA 3.25Å; I224-I253 PolarHBondContact O-N 3.4Å
225	I	93.6	Very high	86.4	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	125.6	175.7	-49.7	170	0	0	0	107.1	I159 L163 A171 S172 L173 I174 L187 I253 T255	I159-I225 HydrophobicContact CG2-CD1 4.16Å; L163-I225 HydrophobicContact CD1-CD1 3.88Å; A171-I225 HydrophobicContact CB-CD1 4.4Å; S172-I225 PolarHBondContact O-N 3Å; L173-I225 HydrophobicContact CD1-CB 3.98Å; L173-I225 HydrophobicContact CD1-CG2 3.8Å; I174-I225 PolarHBondContact N-O 3.24Å; L187-I225 HydrophobicContact CD2-CD1 4.27Å; I225-I253 CarbonylContact C-O 3.52Å; I225-I253 WeakPolarHBondContact CA-O 3.12Å; I225-I253 HydrophobicContact CG1-CB 4.48Å; I225-T255 HydrophobicContact CG2-CG2 4.02Å
226	I	93.9	Very high	86.6	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	112	180	-65.2	172.6	0	0	0	108.6	I174 I224 A228 I236 L237 Y252 I253 L254 T255	I174-I226 HydrophobicContact CD1-CG1 4.45Å; I224-I226 HydrophobicContact CG2-CG1 4.17Å; I226-A228 HydrophobicContact CG2-CB 3.86Å; I226-I236 HydrophobicContact CD1-CB 4.26Å; I226-I236 HydrophobicContact CD1-CG2 3.65Å; I226-I236 HydrophobicContact CG1-CG2 4.35Å; I226-I236 HydrophobicContact CG2-CD1 3.7Å; I226-L237 HydrophobicContact CD1-CD2 4.27Å; I226-Y252 HydrophobicContact CD1-CD1 3.74Å; I226-Y252 HydrophobicContact CD1-CE1 4.28Å; I226-I253 PolarHBondContact N-O 2.93Å; I226-L254 HydrophobicContact CB-CD2 3.83Å; I226-L254 HydrophobicContact CD1-CD2 4.34Å; I226-L254 HydrophobicContact CG2-CD2 3.84Å; I226-T255 PolarHBondContact O-N 3.05Å; I226-T255 VanDerWaalsContact O-N 3.08Å
227	D	92.1	Very high	86.7	Confident	4 Å²	4	39.6 Å²	39.6	2%	0.021	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	89.7	173.4	-170.1	77.9	0	0	0	109.7	L173 I174 A176 C180 R183 L184 T255	L173-D227 HydrophobicContact CD1-CB 4.08Å; I174-D227 PolarHBondContact O-N 3.04Å; A176-D227 PolarHBondContact N-O 3.38Å; C180-D227 WeakPolarHBondContact CA-OD2 3.44Å; C180-D227 HydrophobicContact CB-CB 4.43Å; C180-D227 VanDerWaalsContact CB-OD2 3.31Å; C180-D227 WeakPolarHBondContact CB-OD2 3.43Å; C180-D227 VanDerWaalsContact SG-CB 3.55Å; C180-D227 PolarHBondContact SG-OD2 3.49Å; R183-D227 IonicContact CZ-OD1 2.65Å; R183-D227 IonicContact CZ-OD2 2.78Å; R183-D227 IonicContact NE-OD1 3.93Å; R183-D227 PolarHBondContact NE-OD1 3.37Å; R183-D227 IonicContact NE-OD2 3.71Å; R183-D227 IonicContact NH2-OD1 3.42Å; R183-D227 PolarHBondContact NH2-OD1 3.27Å; R183-D227 IonicContact NH2-OD2 3.55Å; R183-D227 PolarHBondContact NH2-OD2 3.01Å; L184-D227 HydrophobicContact CD1-CB 4.07Å; D227-T255 WeakPolarHBondContact CA-OG1 3.49Å; D227-T255 HydrophobicContact CB-CG2 4.08Å; D227-T255 WeakPolarHBondContact OD1-CB 3.36Å; D227-T255 PolarHBondContact OD1-OG1 2.9Å
228	A	88.6	Confident	87	Confident	7 Å²	7	41.2 Å²	41.2	6%	0.058	21%	0.214	C	C	.	.	S	Bend	trans	-152	166.4	-174.1	0	0	0	0	0	110.8	A176 I226 I232 I236	A176-A228 HydrophobicContact CB-CB 3.63Å; I226-A228 HydrophobicContact CG2-CB 3.86Å; A228-I232 HydrophobicContact CB-CB 4.12Å; A228-I232 HydrophobicContact CB-CG2 3.95Å; A228-I236 HydrophobicContact CB-CD1 4.35Å
229	N	85	Confident	87.4	Confident	83 Å²	83	38.5 Å²	38.5	44%	0.444	20%	0.198	S	C	.	.			trans	-72.3	171.4	167.6	73.5	-1	0	0	0	110.8	S231 I232 S233	N229-S231 PolarHBondContact ND2-OG 3.44Å; N229-S231 PolarHBondContact O-N 3.25Å; N229-S231 PolarHBondContact OD1-N 2.96Å; N229-S231 PolarHBondContact OD1-OG 2.93Å; N229-I232 PolarHBondContact O-N 3.11Å; N229-I232 VanDerWaalsContact OD1-CB 3.23Å; N229-I232 WeakPolarHBondContact OD1-CB 3.33Å; N229-I232 VanDerWaalsContact OD1-CG1 3.23Å; N229-I232 WeakPolarHBondContact OD1-CG1 3.4Å; N229-I232 PolarHBondContact OD1-N 3.16Å; N229-S233 VanDerWaalsContact O-CB 3.26Å; N229-S233 WeakPolarHBondContact O-CB 3.28Å; N229-S233 PolarHBondContact O-N 3.11Å; N229-S233 PolarHBondContact O-OG 2.93Å
230	A	83.6	Confident	87.8	Confident	27 Å²	27	34.7 Å²	34.7	22%	0.223	18%	0.177	C	C	.	.	H	α-helix	trans	-55.7	-45.8	-178.5	0	0	0	0	0	113.3	S233 Y234 L262	A230-S233 WeakPolarHBondContact O-CB 3.46Å; A230-S233 PolarHBondContact O-N 2.87Å; A230-Y234 WeakPolarHBondContact O-CB 3.43Å; A230-Y234 PolarHBondContact O-N 2.75Å; A230-L262 HydrophobicContact CB-CD2 3.8Å; A230-L262 WeakPolarHBondContact O-CD2 3.47Å
231	S	83.4	Confident	88.3	Confident	78 Å²	78	32.7 Å²	32.7	55%	0.545	17%	0.172	S	C	.	.	H	α-helix	trans	-70.2	-39.3	-176.1	51.9	0	0	0	0	113.8	N229 H235	N229-S231 PolarHBondContact ND2-OG 3.44Å; N229-S231 PolarHBondContact O-N 3.25Å; N229-S231 PolarHBondContact OD1-N 2.96Å; N229-S231 PolarHBondContact OD1-OG 2.93Å; S231-H235 PolarHBondContact O-N 2.97Å; S231-H235 VanDerWaalsContact O-N 3.15Å
232	I	88.3	Confident	88.4	Confident	37 Å²	37	37 Å²	37	19%	0.19	19%	0.192	C	C	.	.	H	α-helix	trans	-71.8	-38.6	174.7	-64.3	168.2	0	0	0	110.2	A176 L203 A228 N229 Y234 H235 I236	A176-I232 HydrophobicContact CB-CD1 4.38Å; A176-I232 HydrophobicContact CB-CG2 4.08Å; L203-I232 HydrophobicContact CD1-CG2 3.67Å; A228-I232 HydrophobicContact CB-CB 4.12Å; A228-I232 HydrophobicContact CB-CG2 3.95Å; N229-I232 PolarHBondContact O-N 3.11Å; N229-I232 VanDerWaalsContact OD1-CB 3.23Å; N229-I232 WeakPolarHBondContact OD1-CB 3.33Å; N229-I232 VanDerWaalsContact OD1-CG1 3.23Å; N229-I232 WeakPolarHBondContact OD1-CG1 3.4Å; N229-I232 PolarHBondContact OD1-N 3.16Å; I232-Y234 VanDerWaalsContact C-N 3.33Å; I232-Y234 PolarHBondContact O-N 3.35Å; I232-H235 WeakPolarHBondContact O-CB 3.22Å; I232-H235 PolarHBondContact O-N 3.06Å; I232-H235 VanDerWaalsContact O-N 3.11Å; I232-I236 HydrophobicContact CG2-CD1 3.96Å; I232-I236 HydrophobicContact CG2-CG1 4.35Å; I232-I236 WeakPolarHBondContact O-CG1 3.37Å; I232-I236 PolarHBondContact O-N 3.07Å
233	S	90.1	Very high	88.4	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-55.8	-46.7	173.5	-62.2	0	0	0	0	112.1	N229 A230 H235 I236 L237	N229-S233 VanDerWaalsContact O-CB 3.26Å; N229-S233 WeakPolarHBondContact O-CB 3.28Å; N229-S233 PolarHBondContact O-N 3.11Å; N229-S233 PolarHBondContact O-OG 2.93Å; A230-S233 WeakPolarHBondContact O-CB 3.46Å; A230-S233 PolarHBondContact O-N 2.87Å; S233-H235 VanDerWaalsContact C-N 3.35Å; S233-H235 PolarHBondContact O-N 3Å; S233-I236 PolarHBondContact O-N 3.08Å; S233-L237 WeakPolarHBondContact O-CG 3.45Å; S233-L237 PolarHBondContact O-N 2.8Å
234	Y	88.4	Confident	87.9	Confident	81 Å²	81	39.3 Å²	39.3	32%	0.318	21%	0.211	S	C	.	.	H	α-helix	trans	-60.3	-41.5	174.7	179.2	-97.4	0	0	0	112.3	A230 I232 L237 R238 Q263 L264 V267	A230-Y234 WeakPolarHBondContact O-CB 3.43Å; A230-Y234 PolarHBondContact O-N 2.75Å; I232-Y234 VanDerWaalsContact C-N 3.33Å; I232-Y234 PolarHBondContact O-N 3.35Å; Y234-L237 PolarHBondContact O-N 3.43Å; Y234-R238 WeakPolarHBondContact O-CB 3.36Å; Y234-R238 PolarHBondContact O-N 3.27Å; Y234-Q263 WeakPolarHBondContact CE2-O 3.34Å; Y234-L264 HydrophobicContact CD2-CD2 4.26Å; Y234-V267 HydrophobicContact CD2-CG2 4.4Å; Y234-V267 HydrophobicContact CE1-CG2 4.42Å; Y234-V267 HydrophobicContact CE2-CB 4.36Å; Y234-V267 HydrophobicContact CE2-CG2 3.48Å; Y234-V267 VanDerWaalsContact CE2-CG2 3.48Å; Y234-V267 VanDerWaalsContact CZ-CG2 3.49Å; Y234-V267 VanDerWaalsContact OH-CG2 3.29Å; Y234-V267 WeakPolarHBondContact OH-CG2 3.31Å
235	H	88.8	Confident	87.4	Confident	70 Å²	70	39.4 Å²	39.4	32%	0.324	21%	0.211	S	C	.	.	H	α-helix	trans	-63.8	-41.5	175.8	-170.9	-119.6	0	0	0	112.7	L207 S231 I232 S233 R238 K239	L207-H235 PolarHBondContact O-ND1 3.42Å; S231-H235 PolarHBondContact O-N 2.97Å; S231-H235 VanDerWaalsContact O-N 3.15Å; I232-H235 WeakPolarHBondContact O-CB 3.22Å; I232-H235 PolarHBondContact O-N 3.06Å; I232-H235 VanDerWaalsContact O-N 3.11Å; S233-H235 VanDerWaalsContact C-N 3.35Å; S233-H235 PolarHBondContact O-N 3Å; H235-R238 PolarHBondContact O-N 3.03Å; H235-K239 WeakPolarHBondContact O-CG 3.07Å; H235-K239 PolarHBondContact O-N 3.22Å
236	I	91.3	Very high	86.7	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.5	-49.9	175.6	-63.4	161.4	0	0	0	110.8	I174 L203 P209 L213 I226 A228 I232 S233 R238 K239 A240	I174-I236 HydrophobicContact CD1-CG2 4.32Å; I174-I236 HydrophobicContact CG2-CD1 4.14Å; L203-I236 HydrophobicContact CD1-CD1 4.31Å; P209-I236 HydrophobicContact CB-CG1 4.13Å; P209-I236 HydrophobicContact CG-CG1 4.34Å; L213-I236 HydrophobicContact CD2-CG2 4.39Å; I226-I236 HydrophobicContact CD1-CB 4.26Å; I226-I236 HydrophobicContact CD1-CG2 3.65Å; I226-I236 HydrophobicContact CG1-CG2 4.35Å; I226-I236 HydrophobicContact CG2-CD1 3.7Å; A228-I236 HydrophobicContact CB-CD1 4.35Å; I232-I236 HydrophobicContact CG2-CD1 3.96Å; I232-I236 HydrophobicContact CG2-CG1 4.35Å; I232-I236 WeakPolarHBondContact O-CG1 3.37Å; I232-I236 PolarHBondContact O-N 3.07Å; S233-I236 PolarHBondContact O-N 3.08Å; I236-R238 VanDerWaalsContact C-N 3.31Å; I236-R238 PolarHBondContact O-N 2.94Å; I236-K239 PolarHBondContact O-N 3.38Å; I236-A240 WeakPolarHBondContact O-CB 3.18Å; I236-A240 PolarHBondContact O-N 3.47Å
237	L	90.1	Very high	85.6	Confident	0 Å²	0	42 Å²	42	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-62.4	-37.6	179.9	-68.5	169.4	0	0	0	112.3	I226 S233 Y234 A240 N241 M246 Y252 L254 L264 I274	I226-L237 HydrophobicContact CD1-CD2 4.27Å; S233-L237 WeakPolarHBondContact O-CG 3.45Å; S233-L237 PolarHBondContact O-N 2.8Å; Y234-L237 PolarHBondContact O-N 3.43Å; L237-A240 WeakPolarHBondContact O-CB 3.3Å; L237-A240 PolarHBondContact O-N 3.23Å; L237-N241 PolarHBondContact O-N 3.17Å; L237-M246 HydrophobicContact CD2-CE 3.94Å; L237-M246 HydrophobicContact CD2-SD 4.29Å; L237-Y252 HydrophobicContact CD2-CD1 3.89Å; L237-Y252 HydrophobicContact CD2-CD2 4.29Å; L237-Y252 HydrophobicContact CD2-CE1 4.29Å; L237-Y252 HydrophobicContact CD2-CG 3.88Å; L237-L254 HydrophobicContact CD1-CD1 4.24Å; L237-L264 HydrophobicContact CD1-CD1 4.39Å; L237-L264 HydrophobicContact CD1-CD2 3.72Å; L237-I274 HydrophobicContact CD1-CD1 4.22Å; L237-I274 HydrophobicContact CD2-CD1 4.04Å
238	R	88.6	Confident	84.4	Confident	121 Å²	121	43.2 Å²	43.2	46%	0.457	24%	0.239	S	C	.	.	H	α-helix	trans	-61.8	-46.6	173.4	179.6	179.7	169.6	155.8	4.3	112.3	Y234 H235 I236 A240 N241 E242 V267	Y234-R238 WeakPolarHBondContact O-CB 3.36Å; Y234-R238 PolarHBondContact O-N 3.27Å; H235-R238 PolarHBondContact O-N 3.03Å; I236-R238 VanDerWaalsContact C-N 3.31Å; I236-R238 PolarHBondContact O-N 2.94Å; R238-A240 VanDerWaalsContact C-N 3.32Å; R238-A240 PolarHBondContact O-N 2.91Å; R238-N241 PolarHBondContact O-N 3.16Å; R238-E242 IonicContact CZ-OE1 2.71Å; R238-E242 IonicContact NE-OE1 2.69Å; R238-E242 PolarHBondContact NE-OE1 2.86Å; R238-E242 IonicContact NH2-OE1 3.19Å; R238-E242 WeakPolarHBondContact O-CG 3.41Å; R238-E242 PolarHBondContact O-N 3.47Å; R238-V267 VanDerWaalsContact CA-CG1 3.43Å; R238-V267 HydrophobicContact CB-CG1 3.73Å; R238-V267 HydrophobicContact CG-CG1 4.35Å
239	K	89	Confident	83.5	Confident	46 Å²	46	45.3 Å²	45.3	20%	0.2	25%	0.247	C	C	.	.	H	α-helix	trans	-69.1	-30.6	178	-69.6	-69.9	172.3	-167.6	0	112.7	P209 L213 H235 I236 E242 L243	P209-K239 HydrophobicContact CG-CB 3.59Å; P209-K239 HydrophobicContact CG-CG 3.7Å; L213-K239 HydrophobicContact CD1-CB 3.84Å; H235-K239 WeakPolarHBondContact O-CG 3.07Å; H235-K239 PolarHBondContact O-N 3.22Å; I236-K239 PolarHBondContact O-N 3.38Å; K239-E242 WeakPolarHBondContact CD-OE2 3.35Å; K239-E242 WeakPolarHBondContact CE-OE2 3.37Å; K239-E242 IonicContact NZ-OE1 3.53Å; K239-E242 IonicContact NZ-OE2 2.72Å; K239-E242 PolarHBondContact NZ-OE2 2.9Å; K239-E242 PolarHBondContact O-N 3.31Å; K239-L243 WeakPolarHBondContact O-CB 3.34Å; K239-L243 VanDerWaalsContact O-CG 3.31Å; K239-L243 WeakPolarHBondContact O-CG 3.39Å; K239-L243 PolarHBondContact O-N 3.49Å; K239-L243 VanDerWaalsContact O-N 3.11Å
240	A	88.8	Confident	83.3	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-63.6	-39.6	169.3	0	0	0	0	0	111.9	L213 I236 L237 R238 L243 G244 M245 M246 Y252	L213-A240 HydrophobicContact CD1-CB 4.22Å; L213-A240 HydrophobicContact CD2-CB 4.38Å; I236-A240 WeakPolarHBondContact O-CB 3.18Å; I236-A240 PolarHBondContact O-N 3.47Å; L237-A240 WeakPolarHBondContact O-CB 3.3Å; L237-A240 PolarHBondContact O-N 3.23Å; R238-A240 VanDerWaalsContact C-N 3.32Å; R238-A240 PolarHBondContact O-N 2.91Å; A240-L243 CarbonylContact O-C 3.41Å; A240-L243 PolarHBondContact O-N 3.19Å; A240-G244 PolarHBondContact O-N 3.37Å; A240-M245 HydrophobicContact CB-CB 4.15Å; A240-M245 WeakPolarHBondContact O-CB 3.23Å; A240-M245 PolarHBondContact O-N 2.93Å; A240-M246 HydrophobicContact CB-CG 4.34Å; A240-M246 HydrophobicContact CB-SD 3.6Å; A240-M246 VanDerWaalsContact CB-SD 3.6Å; A240-Y252 WeakPolarHBondContact CB-OH 3.46Å
241	N	85.7	Confident	83.4	Confident	76 Å²	76	42 Å²	42	41%	0.406	22%	0.223	S	C	.	.	H	α-helix	trans	-66.4	-45.4	174.2	-165.2	27.3	0	0	0	112.2	L237 R238 L243 G244 M246 V267	L237-N241 PolarHBondContact O-N 3.17Å; R238-N241 PolarHBondContact O-N 3.16Å; N241-L243 PolarHBondContact O-N 3.3Å; N241-L243 VanDerWaalsContact O-N 3.08Å; N241-G244 PolarHBondContact O-N 3.2Å; N241-M246 HydrophobicContact CB-CB 4.43Å; N241-M246 HydrophobicContact CB-CG 3.63Å; N241-V267 PolarHBondContact ND2-O 3.5Å
242	E	84.3	Confident	83.7	Confident	104 Å²	104	38.3 Å²	38.3	49%	0.486	20%	0.197	S	C	.	.	H	α-helix	trans	-58.8	-20.6	174.3	-68.3	174	-159.1	0	0	113	R238 K239	R238-E242 IonicContact CZ-OE1 2.71Å; R238-E242 IonicContact NE-OE1 2.69Å; R238-E242 PolarHBondContact NE-OE1 2.86Å; R238-E242 IonicContact NH2-OE1 3.19Å; R238-E242 WeakPolarHBondContact O-CG 3.41Å; R238-E242 PolarHBondContact O-N 3.47Å; K239-E242 WeakPolarHBondContact CD-OE2 3.35Å; K239-E242 WeakPolarHBondContact CE-OE2 3.37Å; K239-E242 IonicContact NZ-OE1 3.53Å; K239-E242 IonicContact NZ-OE2 2.72Å; K239-E242 PolarHBondContact NZ-OE2 2.9Å; K239-E242 PolarHBondContact O-N 3.31Å
243	L	83.1	Confident	83.9	Confident	38 Å²	38	36.8 Å²	36.8	20%	0.199	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.9	2.6	175.7	-69.1	172	0	0	0	114.9	T210 L213 K214 K239 A240 N241 M245	T210-L243 HydrophobicContact CG2-CD1 4.41Å; T210-L243 HydrophobicContact CG2-CD2 4.49Å; L213-L243 HydrophobicContact CB-CD1 3.51Å; L213-L243 HydrophobicContact CD1-CD1 4.11Å; L213-L243 HydrophobicContact CG-CD1 4.48Å; K214-L243 HydrophobicContact CG-CD1 4.31Å; K214-L243 HydrophobicContact CG-CD2 4.18Å; K239-L243 WeakPolarHBondContact O-CB 3.34Å; K239-L243 VanDerWaalsContact O-CG 3.31Å; K239-L243 WeakPolarHBondContact O-CG 3.39Å; K239-L243 PolarHBondContact O-N 3.49Å; K239-L243 VanDerWaalsContact O-N 3.11Å; A240-L243 CarbonylContact O-C 3.41Å; A240-L243 PolarHBondContact O-N 3.19Å; N241-L243 PolarHBondContact O-N 3.3Å; N241-L243 VanDerWaalsContact O-N 3.08Å; L243-M245 HydrophobicContact CB-CG 4.28Å; L243-M245 HydrophobicContact CB-SD 4.22Å; L243-M245 HydrophobicContact CD1-SD 4.5Å
244	G	77.7	Confident	84.1	Confident	54 Å²	54	36.8 Å²	36.8	56%	0.557	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.4	13.7	-179.9	0	0	0	0	0	115.4	A240 N241	A240-G244 PolarHBondContact O-N 3.37Å; N241-G244 PolarHBondContact O-N 3.2Å
245	M	81.4	Confident	84.2	Confident	1 Å²	1	33 Å²	33	1%	0.005	17%	0.174	C	C	.	.			trans	-87.9	4.6	-175.3	-61.1	173.3	69.2	0	0	113.9	L213 I216 R217 I224 A240 L243 S247 Y250 Y252	L213-M245 HydrophobicContact CB-SD 3.91Å; L213-M245 HydrophobicContact CD2-CE 4.17Å; L213-M245 HydrophobicContact CD2-SD 4.28Å; L213-M245 WeakPolarHBondContact O-CE 3.28Å; L213-M245 VanDerWaalsContact O-SD 3.39Å; I216-M245 HydrophobicContact CG2-CE 4.38Å; R217-M245 HydrophobicContact CB-CE 3.89Å; R217-M245 HydrophobicContact CB-SD 3.96Å; R217-M245 HydrophobicContact CG-CG 4.46Å; R217-M245 HydrophobicContact CG-SD 4.46Å; I224-M245 HydrophobicContact CD1-CE 3.94Å; A240-M245 HydrophobicContact CB-CB 4.15Å; A240-M245 WeakPolarHBondContact O-CB 3.23Å; A240-M245 PolarHBondContact O-N 2.93Å; L243-M245 HydrophobicContact CB-CG 4.28Å; L243-M245 HydrophobicContact CB-SD 4.22Å; L243-M245 HydrophobicContact CD1-SD 4.5Å; M245-S247 VanDerWaalsContact C-N 3.35Å; M245-S247 PolarHBondContact O-N 2.7Å; M245-Y250 HydrophobicContact CB-CD2 4.24Å; M245-Y250 HydrophobicContact CB-CE2 4.18Å; M245-Y250 HydrophobicContact CB-CG 4.47Å; M245-Y250 HydrophobicContact CE-CD1 4.41Å; M245-Y250 HydrophobicContact CE-CE1 3.91Å; M245-Y250 HydrophobicContact CG-CE2 4.37Å; M245-Y250 WeakPolarHBondContact O-CB 3.43Å; M245-Y250 WeakPolarHBondContact O-CD2 3.5Å; M245-Y252 PolarHBondContact O-OH 3.21Å
246	M	79.4	Confident	84.2	Confident	15 Å²	15	30.3 Å²	30.3	7%	0.074	16%	0.163	C	C	.	.			trans	-93.6	21.7	178.2	-58.8	-49	-58.8	0	0	114.5	L237 A240 N241 Y252 V268 I274	L237-M246 HydrophobicContact CD2-CE 3.94Å; L237-M246 HydrophobicContact CD2-SD 4.29Å; A240-M246 HydrophobicContact CB-CG 4.34Å; A240-M246 HydrophobicContact CB-SD 3.6Å; A240-M246 VanDerWaalsContact CB-SD 3.6Å; N241-M246 HydrophobicContact CB-CB 4.43Å; N241-M246 HydrophobicContact CB-CG 3.63Å; M246-Y252 HydrophobicContact CE-CD2 3.78Å; M246-Y252 HydrophobicContact CE-CE2 3.63Å; M246-Y252 HydrophobicContact SD-CD2 4.2Å; M246-Y252 HydrophobicContact SD-CE2 3.47Å; M246-Y252 WeakPolarHBondContact SD-CE2 3.46Å; M246-V268 HydrophobicContact CB-CG1 4.38Å; M246-V268 HydrophobicContact CE-CG1 3.62Å; M246-V268 HydrophobicContact CE-CG2 4.2Å; M246-I274 HydrophobicContact CE-CD1 3.68Å; M246-I274 HydrophobicContact CE-CG1 4.05Å
247	S	70.1	Confident	84.1	Confident	39 Å²	39	30.5 Å²	30.5	27%	0.273	16%	0.164	S	C	.	.	S	Bend	trans	-77.3	158.9	172.3	66.2	0	0	0	0	111.9	M245 F249 Y250	M245-S247 VanDerWaalsContact C-N 3.35Å; M245-S247 PolarHBondContact O-N 2.7Å; S247-F249 PolarHBondContact O-N 2.72Å; S247-Y250 PolarHBondContact O-N 2.91Å
248	A	66.6	Low	83.9	Confident	31 Å²	31	32.7 Å²	32.7	26%	0.256	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-11.9	-178.5	0	0	0	0	0	115.8	Q271 N273	A248-Q271 WeakPolarHBondContact CA-O 3.48Å; A248-Q271 HydrophobicContact CB-CB 4.43Å; A248-Q271 WeakPolarHBondContact CB-O 3.48Å; A248-Q271 PolarHBondContact N-O 2.67Å; A248-N273 PolarHBondContact O-ND2 2.93Å
249	F	69.3	Low	83.9	Confident	51 Å²	51	26.9 Å²	26.9	22%	0.224	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-39.2	171.4	-70.7	-96.8	0	0	0	112.7	S247 P767	S247-F249 PolarHBondContact O-N 2.72Å; F249-P767 HydrophobicContact CE1-CG 4.4Å; F249-P767 HydrophobicContact CZ-CG 4.44Å
250	Y	82.1	Confident	83.8	Confident	16 Å²	16	26.3 Å²	26.3	6%	0.063	15%	0.154	C	C	.	.			trans	-87.6	137.5	-175.3	-70.3	-84.5	0	0	0	111	V221 A222 I224 M245 S247 N273	V221-Y250 WeakPolarHBondContact O-CE1 3.24Å; A222-Y250 WeakPolarHBondContact O-CA 3.4Å; I224-Y250 HydrophobicContact CD1-CD1 4.01Å; I224-Y250 HydrophobicContact CD1-CE1 4.49Å; M245-Y250 HydrophobicContact CB-CD2 4.24Å; M245-Y250 HydrophobicContact CB-CE2 4.18Å; M245-Y250 HydrophobicContact CB-CG 4.47Å; M245-Y250 HydrophobicContact CE-CD1 4.41Å; M245-Y250 HydrophobicContact CE-CE1 3.91Å; M245-Y250 HydrophobicContact CG-CE2 4.37Å; M245-Y250 WeakPolarHBondContact O-CB 3.43Å; M245-Y250 WeakPolarHBondContact O-CD2 3.5Å; S247-Y250 PolarHBondContact O-N 2.91Å; Y250-N273 WeakPolarHBondContact O-CB 3.46Å
251	K	84.6	Confident	83.5	Confident	23 Å²	23	28.1 Å²	28.1	10%	0.1	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	118.7	-177.6	-51.4	-164.3	-173.6	-165.4	0	109.3	Y168 A222 I224 N273 L414 D415	Y168-K251 HydrophobicContact CE2-CD 3.74Å; Y168-K251 PolarHBondContact OH-NZ 3.49Å; A222-K251 PolarHBondContact O-N 3.46Å; I224-K251 PolarHBondContact N-O 3.5Å; K251-N273 CarbonylContact C-O 3.58Å; K251-N273 WeakPolarHBondContact CA-O 3.42Å; K251-N273 HydrophobicContact CB-CB 4.35Å; K251-N273 HydrophobicContact CG-CB 3.95Å; K251-L414 PolarHBondContact NZ-O 2.96Å; K251-D415 IonicContact NZ-OD1 2.68Å
252	Y	90.8	Very high	83.4	Confident	2 Å²	2	25 Å²	25	1%	0.008	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	122.1	-174.9	-69.3	-84.5	0	0	0	110.5	I224 I226 L237 A240 M245 M246 N273 I274 V275	I224-Y252 HydrophobicContact CB-CD1 3.92Å; I224-Y252 HydrophobicContact CB-CE1 3.89Å; I224-Y252 HydrophobicContact CD1-CE1 3.73Å; I224-Y252 HydrophobicContact CG1-CE1 4.36Å; I224-Y252 HydrophobicContact CG2-CD1 4.09Å; I224-Y252 HydrophobicContact CG2-CE1 3.99Å; I224-Y252 CarbonylContact O-C 3.57Å; I224-Y252 VanDerWaalsContact O-CA 3.31Å; I224-Y252 WeakPolarHBondContact O-CA 3.25Å; I226-Y252 HydrophobicContact CD1-CD1 3.74Å; I226-Y252 HydrophobicContact CD1-CE1 4.28Å; L237-Y252 HydrophobicContact CD2-CD1 3.89Å; L237-Y252 HydrophobicContact CD2-CD2 4.29Å; L237-Y252 HydrophobicContact CD2-CE1 4.29Å; L237-Y252 HydrophobicContact CD2-CG 3.88Å; A240-Y252 WeakPolarHBondContact CB-OH 3.46Å; M245-Y252 PolarHBondContact O-OH 3.21Å; M246-Y252 HydrophobicContact CE-CD2 3.78Å; M246-Y252 HydrophobicContact CE-CE2 3.63Å; M246-Y252 HydrophobicContact SD-CD2 4.2Å; M246-Y252 HydrophobicContact SD-CE2 3.47Å; M246-Y252 WeakPolarHBondContact SD-CE2 3.46Å; Y252-N273 PolarHBondContact N-O 3.34Å; Y252-I274 HydrophobicContact CD2-CG1 4.39Å; Y252-V275 PolarHBondContact O-N 3.2Å
253	I	92.6	Very high	83	Confident	4 Å²	4	24.3 Å²	24.3	2%	0.021	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	113.8	175.6	-59.7	174.6	0	0	0	108.2	I162 L163 T223 I224 I225 I226 V275 F277	I162-I253 HydrophobicContact CG2-CD1 4.07Å; L163-I253 HydrophobicContact CD2-CD1 3.78Å; L163-I253 HydrophobicContact CG-CD1 4.31Å; T223-I253 HydrophobicContact CG2-CD1 4.46Å; I224-I253 PolarHBondContact O-N 3.4Å; I225-I253 CarbonylContact C-O 3.52Å; I225-I253 WeakPolarHBondContact CA-O 3.12Å; I225-I253 HydrophobicContact CG1-CB 4.48Å; I226-I253 PolarHBondContact N-O 2.93Å; I253-V275 WeakPolarHBondContact CA-O 3.45Å; I253-F277 HydrophobicContact CG2-CE2 4.44Å
254	L	93.1	Very high	82.8	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	123	-178.9	-73.8	154	0	0	0	110.3	I226 L237 T256 F259 L262 I274 V275 F277	I226-L254 HydrophobicContact CB-CD2 3.83Å; I226-L254 HydrophobicContact CD1-CD2 4.34Å; I226-L254 HydrophobicContact CG2-CD2 3.84Å; L237-L254 HydrophobicContact CD1-CD1 4.24Å; L254-T256 VanDerWaalsContact C-N 3.3Å; L254-T256 HydrophobicContact CB-CG2 4.35Å; L254-T256 PolarHBondContact O-N 3.25Å; L254-F259 HydrophobicContact CB-CD2 4.34Å; L254-F259 HydrophobicContact CD1-CD2 3.55Å; L254-F259 HydrophobicContact CD1-CE2 3.55Å; L254-L262 HydrophobicContact CD1-CD1 4.22Å; L254-I274 HydrophobicContact CD1-CG2 3.54Å; L254-V275 PolarHBondContact N-O 2.79Å; L254-F277 VanDerWaalsContact O-CD2 3.28Å; L254-F277 WeakPolarHBondContact O-CD2 3.24Å
255	T	91.1	Very high	82.5	Confident	2 Å²	2	24.9 Å²	24.9	1%	0.012	13%	0.134	C	C	.	.			trans	-79.1	-12.6	-179	72.3	0	0	0	0	113.6	I159 L184 I225 I226 D227	I159-T255 HydrophobicContact CD1-CG2 3.69Å; L184-T255 HydrophobicContact CD1-CG2 4.35Å; I225-T255 HydrophobicContact CG2-CG2 4.02Å; I226-T255 PolarHBondContact O-N 3.05Å; I226-T255 VanDerWaalsContact O-N 3.08Å; D227-T255 WeakPolarHBondContact CA-OG1 3.49Å; D227-T255 HydrophobicContact CB-CG2 4.08Å; D227-T255 WeakPolarHBondContact OD1-CB 3.36Å; D227-T255 PolarHBondContact OD1-OG1 2.9Å
256	T	89.1	Confident	81.8	Confident	14 Å²	14	32.1 Å²	32.1	9%	0.086	17%	0.173	C	C	.	.			trans	-70.7	131.6	178.4	179.3	0	0	0	0	111.9	L254 D258	L254-T256 VanDerWaalsContact C-N 3.3Å; L254-T256 HydrophobicContact CB-CG2 4.35Å; L254-T256 PolarHBondContact O-N 3.25Å; T256-D258 PolarHBondContact O-N 2.86Å; T256-D258 PolarHBondContact OG1-N 2.74Å
257	M	88.3	Confident	81.1	Confident	4 Å²	4	32 Å²	32	2%	0.02	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-12.5	175	-61.5	-72.7	163.6	0	0	113.1	P150 L155 F259 F277 L312 L385	P150-M257 HydrophobicContact CB-CE 4.5Å; P150-M257 HydrophobicContact CG-CE 4.22Å; L155-M257 HydrophobicContact CD1-CE 3.83Å; M257-F259 PolarHBondContact O-N 3.14Å; M257-F277 CarbonylContact C-O 3.41Å; M257-F277 HydrophobicContact CE-CB 4Å; M257-F277 HydrophobicContact CE-CG 4.37Å; M257-F277 HydrophobicContact SD-CB 3.54Å; M257-F277 VanDerWaalsContact SD-CB 3.54Å; M257-L312 HydrophobicContact CB-CD2 3.44Å; M257-L312 VanDerWaalsContact CB-CD2 3.44Å; M257-L312 HydrophobicContact CG-CD2 3.88Å; M257-L385 HydrophobicContact CE-CD1 4.08Å; M257-L385 HydrophobicContact CE-CD2 3.9Å; M257-L385 HydrophobicContact SD-CD2 3.95Å
258	D	87.4	Confident	80.8	Confident	45 Å²	45	30.3 Å²	30.3	24%	0.241	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	17.3	175.6	-61.6	-66.9	0	0	0	111.9	T256 P260 L261 L312	T256-D258 PolarHBondContact O-N 2.86Å; T256-D258 PolarHBondContact OG1-N 2.74Å; D258-P260 VanDerWaalsContact C-N 3.25Å; D258-L261 HydrophobicContact CB-CD1 4.02Å; D258-L261 HydrophobicContact CB-CG 4.26Å; D258-L261 WeakPolarHBondContact O-CB 3.4Å; D258-L261 PolarHBondContact O-N 3.3Å; D258-L312 PolarHBondContact OD1-N 2.91Å
259	F	88.6	Confident	80.7	Confident	0 Å²	0	31 Å²	31	0%	0	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-47.6	-38.6	172.4	179.7	-107.8	0	0	0	113.9	L254 M257 L261 L262 L264 I274 L388 K390 H395	L254-F259 HydrophobicContact CB-CD2 4.34Å; L254-F259 HydrophobicContact CD1-CD2 3.55Å; L254-F259 HydrophobicContact CD1-CE2 3.55Å; M257-F259 PolarHBondContact O-N 3.14Å; F259-L261 PolarHBondContact O-N 3.47Å; F259-L261 VanDerWaalsContact O-N 3.14Å; F259-L262 HydrophobicContact CD2-CD1 4.09Å; F259-L262 WeakPolarHBondContact O-CB 3.45Å; F259-L262 PolarHBondContact O-N 2.75Å; F259-L264 HydrophobicContact CE2-CD1 4.12Å; F259-I274 HydrophobicContact CE2-CG2 3.77Å; F259-I274 HydrophobicContact CZ-CG2 4.18Å; F259-L388 HydrophobicContact CD1-CB 3.81Å; F259-L388 HydrophobicContact CD1-CD1 4.39Å; F259-L388 HydrophobicContact CE1-CB 3.77Å; F259-L388 WeakPolarHBondContact CE1-O 3.28Å; F259-K390 HydrophobicContact CZ-CB 4.47Å; F259-H395 AromaticContact CD1-ND1 3.92Å; F259-H395 AromaticContact CE1-CE1 3.67Å; F259-H395 AromaticContact CE1-ND1 3.24Å; F259-H395 WeakPolarHBondContact CE1-ND1 3.26Å; F259-H395 AromaticContact CZ-CE1 3.7Å; F259-H395 AromaticContact CZ-ND1 3.58Å; F259-H395 PolarHBondContact O-NE2 3.33Å
260	P	85.6	Confident	80.3	Confident	33 Å²	33	34.3 Å²	34.3	21%	0.214	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-56.4	-26.4	173.9	-27.3	35.7	0	0	0	115.7	D258 L262 L388 H395	D258-P260 VanDerWaalsContact C-N 3.25Å; P260-L262 VanDerWaalsContact C-N 3.3Å; P260-L388 HydrophobicContact CG-CD1 3.81Å; P260-H395 PolarHBondContact O-CD2 3.22Å; P260-H395 PolarHBondContact O-NE2 3.04Å
261	L	83.1	Confident	79.3	Confident	38 Å²	38	40.7 Å²	40.7	20%	0.199	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-77.4	-16.5	178.7	-57.7	-172.3	0	0	0	113.2	D258 F259 Q263 G309 P310 A311	D258-L261 HydrophobicContact CB-CD1 4.02Å; D258-L261 HydrophobicContact CB-CG 4.26Å; D258-L261 WeakPolarHBondContact O-CB 3.4Å; D258-L261 PolarHBondContact O-N 3.3Å; F259-L261 PolarHBondContact O-N 3.47Å; F259-L261 VanDerWaalsContact O-N 3.14Å; L261-Q263 PolarHBondContact O-N 2.64Å; L261-Q263 VanDerWaalsContact O-N 3.12Å; L261-G309 WeakPolarHBondContact CD2-O 3.23Å; L261-P310 WeakPolarHBondContact CD2-O 3.32Å; L261-A311 HydrophobicContact CD1-CB 4.23Å
262	L	83	Confident	78.6	Confident	11 Å²	11	40 Å²	40	6%	0.058	22%	0.219	C	C	.	.			trans	-76.8	102.2	-177.6	-63.4	-179.1	0	0	0	110	A230 L254 F259 P260 L264 H395	A230-L262 HydrophobicContact CB-CD2 3.8Å; A230-L262 WeakPolarHBondContact O-CD2 3.47Å; L254-L262 HydrophobicContact CD1-CD1 4.22Å; F259-L262 HydrophobicContact CD2-CD1 4.09Å; F259-L262 WeakPolarHBondContact O-CB 3.45Å; F259-L262 PolarHBondContact O-N 2.75Å; P260-L262 VanDerWaalsContact C-N 3.3Å; L262-L264 HydrophobicContact CB-CD1 4.35Å; L262-L264 HydrophobicContact CB-CD2 4.14Å; L262-L264 HydrophobicContact CB-CG 4.02Å; L262-L264 PolarHBondContact O-N 2.71Å; L262-H395 PolarHBondContact O-CE1 2.83Å; L262-H395 PolarHBondContact O-NE2 3.24Å; L262-H395 VanDerWaalsContact O-NE2 3.1Å
263	Q	77	Confident	78.1	Confident	90 Å²	90	40.8 Å²	40.8	42%	0.421	22%	0.224	S	C	.	.			trans	-74.7	110.4	163.3	-67.6	173.6	7.2	0	0	107.5	Y234 L261	Y234-Q263 WeakPolarHBondContact CE2-O 3.34Å; L261-Q263 PolarHBondContact O-N 2.64Å; L261-Q263 VanDerWaalsContact O-N 3.12Å
264	L	77.4	Confident	77.9	Confident	2 Å²	2	40.6 Å²	40.6	1%	0.01	22%	0.223	C	C	.	.			trans	-110.2	-2.8	-172.9	-65.8	175.2	0	0	0	113.1	Y234 L237 F259 L262 D266 V267 V268 I274 K390	Y234-L264 HydrophobicContact CD2-CD2 4.26Å; L237-L264 HydrophobicContact CD1-CD1 4.39Å; L237-L264 HydrophobicContact CD1-CD2 3.72Å; F259-L264 HydrophobicContact CE2-CD1 4.12Å; L262-L264 HydrophobicContact CB-CD1 4.35Å; L262-L264 HydrophobicContact CB-CD2 4.14Å; L262-L264 HydrophobicContact CB-CG 4.02Å; L262-L264 PolarHBondContact O-N 2.71Å; L264-D266 PolarHBondContact O-N 3.47Å; L264-V267 PolarHBondContact O-N 3.29Å; L264-V267 VanDerWaalsContact O-N 3.15Å; L264-V268 HydrophobicContact CB-CG2 4.26Å; L264-V268 WeakPolarHBondContact O-CB 3.43Å; L264-V268 PolarHBondContact O-N 3.35Å; L264-I274 HydrophobicContact CD1-CD1 3.98Å; L264-I274 HydrophobicContact CD1-CG2 4.33Å; L264-K390 HydrophobicContact CB-CG 4.17Å; L264-K390 HydrophobicContact CD1-CB 4.42Å; L264-K390 HydrophobicContact CD1-CG 4.08Å
265	D	72.1	Confident	77.8	Confident	101 Å²	101	40.6 Å²	40.6	54%	0.54	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-37.7	-169.6	-52.1	-48.9	0	0	0	112.7	V267	D265-V267 PolarHBondContact O-N 2.89Å
266	D	66.8	Low	77.8	Confident	154 Å²	154	40.5 Å²	40.5	82%	0.824	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-19.6	174.7	-72.3	-25.4	0	0	0	113.6	L264	L264-D266 PolarHBondContact O-N 3.47Å
267	V	64.6	Low	77.9	Confident	11 Å²	11	39.9 Å²	39.9	7%	0.067	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.5	-24.8	-168	176.2	0	0	0	0	112.5	Y234 R238 N241 L264 D265	Y234-V267 HydrophobicContact CD2-CG2 4.4Å; Y234-V267 HydrophobicContact CE1-CG2 4.42Å; Y234-V267 HydrophobicContact CE2-CB 4.36Å; Y234-V267 HydrophobicContact CE2-CG2 3.48Å; Y234-V267 VanDerWaalsContact CE2-CG2 3.48Å; Y234-V267 VanDerWaalsContact CZ-CG2 3.49Å; Y234-V267 VanDerWaalsContact OH-CG2 3.29Å; Y234-V267 WeakPolarHBondContact OH-CG2 3.31Å; R238-V267 VanDerWaalsContact CA-CG1 3.43Å; R238-V267 HydrophobicContact CB-CG1 3.73Å; R238-V267 HydrophobicContact CG-CG1 4.35Å; N241-V267 PolarHBondContact ND2-O 3.5Å; L264-V267 PolarHBondContact O-N 3.29Å; L264-V267 VanDerWaalsContact O-N 3.15Å; D265-V267 PolarHBondContact O-N 2.89Å
268	V	64.4	Low	78.1	Confident	4 Å²	4	39.9 Å²	39.9	2%	0.024	22%	0.219	C	C	.	.	S	Bend	trans	-138.5	119.9	-164.9	-168.7	0	0	0	0	111.3	M246 L264 S272 I274 K390	M246-V268 HydrophobicContact CB-CG1 4.38Å; M246-V268 HydrophobicContact CE-CG1 3.62Å; M246-V268 HydrophobicContact CE-CG2 4.2Å; L264-V268 HydrophobicContact CB-CG2 4.26Å; L264-V268 WeakPolarHBondContact O-CB 3.43Å; L264-V268 PolarHBondContact O-N 3.35Å; V268-S272 WeakPolarHBondContact CG1-OG 3.41Å; V268-I274 HydrophobicContact CB-CD1 4.44Å; V268-I274 HydrophobicContact CG1-CD1 3.91Å; V268-I274 HydrophobicContact CG2-CD1 4.05Å; V268-K390 PolarHBondContact O-NZ 2.9Å
269	G	63.5	Low	78.3	Confident	45 Å²	45	38 Å²	38	46%	0.464	21%	0.209	S	C	.	.			trans	-63.3	171.8	176.7	0	0	0	0	0	114.5	Q271 S272 K390	G269-Q271 PolarHBondContact O-N 3.49Å; G269-Q271 VanDerWaalsContact O-N 3.13Å; G269-S272 PolarHBondContact O-OG 3.38Å; G269-K390 PolarHBondContact O-NZ 3.14Å
270	D	61.4	Low	78.4	Confident	122 Å²	122	38.3 Å²	38.3	65%	0.652	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-12.9	-169.8	-58.6	-45.7	0	0	0	115.4	P392	D270-P392 HydrophobicContact CB-CG 3.97Å; D270-P392 WeakPolarHBondContact OD1-CG 3.44Å
271	Q	61.3	Low	78.6	Confident	150 Å²	150	38.5 Å²	38.5	70%	0.701	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.7	17.7	-174.6	-60.7	-172.1	-1.7	0	0	113.6	A248 G269	A248-Q271 WeakPolarHBondContact CA-O 3.48Å; A248-Q271 HydrophobicContact CB-CB 4.43Å; A248-Q271 WeakPolarHBondContact CB-O 3.48Å; A248-Q271 PolarHBondContact N-O 2.67Å; G269-Q271 PolarHBondContact O-N 3.49Å; G269-Q271 VanDerWaalsContact O-N 3.13Å
272	S	69.9	Low	78.8	Confident	7 Å²	7	41.5 Å²	41.5	5%	0.049	23%	0.225	C	C	.	.			trans	-89.6	125.9	-175.8	63.2	0	0	0	0	113.4	V268 G269 I274	V268-S272 WeakPolarHBondContact CG1-OG 3.41Å; G269-S272 PolarHBondContact O-OG 3.38Å; S272-I274 PolarHBondContact O-N 3.13Å
273	N	80.3	Confident	79	Confident	19 Å²	19	45.7 Å²	45.7	10%	0.102	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	85.6	174.3	-75.5	-26.4	0	0	0	110.1	A248 Y250 K251 Y252 L414	A248-N273 PolarHBondContact O-ND2 2.93Å; Y250-N273 WeakPolarHBondContact O-CB 3.46Å; K251-N273 CarbonylContact C-O 3.58Å; K251-N273 WeakPolarHBondContact CA-O 3.42Å; K251-N273 HydrophobicContact CB-CB 4.35Å; K251-N273 HydrophobicContact CG-CB 3.95Å; Y252-N273 PolarHBondContact N-O 3.34Å; N273-L414 HydrophobicContact CB-CD2 3.48Å; N273-L414 VanDerWaalsContact CB-CD2 3.48Å
274	I	88.8	Confident	79.6	Confident	0 Å²	0	43 Å²	43	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	126.6	177.2	-50.7	178	0	0	0	109.9	L237 M246 Y252 L254 F259 L264 V268 S272 E389 K390	L237-I274 HydrophobicContact CD1-CD1 4.22Å; L237-I274 HydrophobicContact CD2-CD1 4.04Å; M246-I274 HydrophobicContact CE-CD1 3.68Å; M246-I274 HydrophobicContact CE-CG1 4.05Å; Y252-I274 HydrophobicContact CD2-CG1 4.39Å; L254-I274 HydrophobicContact CD1-CG2 3.54Å; F259-I274 HydrophobicContact CE2-CG2 3.77Å; F259-I274 HydrophobicContact CZ-CG2 4.18Å; L264-I274 HydrophobicContact CD1-CD1 3.98Å; L264-I274 HydrophobicContact CD1-CG2 4.33Å; V268-I274 HydrophobicContact CB-CD1 4.44Å; V268-I274 HydrophobicContact CG1-CD1 3.91Å; V268-I274 HydrophobicContact CG2-CD1 4.05Å; S272-I274 PolarHBondContact O-N 3.13Å; I274-E389 WeakPolarHBondContact O-CA 3.47Å; I274-K390 HydrophobicContact CB-CB 4.07Å; I274-K390 PolarHBondContact O-N 2.67Å
275	V	89.9	Confident	80.2	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.006	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	144.9	175.7	163.6	0	0	0	0	111.1	Y252 I253 L254 I387 L388 E389 I398 L414	Y252-V275 PolarHBondContact O-N 3.2Å; I253-V275 WeakPolarHBondContact CA-O 3.45Å; L254-V275 PolarHBondContact N-O 2.79Å; V275-I387 HydrophobicContact CG1-CG2 3.44Å; V275-I387 VanDerWaalsContact CG1-CG2 3.44Å; V275-L388 CarbonylContact C-O 3.58Å; V275-L388 WeakPolarHBondContact CA-O 3.45Å; V275-E389 HydrophobicContact CG2-CB 4.25Å; V275-E389 HydrophobicContact CG2-CG 4.29Å; V275-I398 HydrophobicContact CG2-CD1 3.65Å; V275-L414 HydrophobicContact CB-CD1 4.21Å; V275-L414 HydrophobicContact CG2-CD1 3.51Å; V275-L414 HydrophobicContact CG2-CD2 4.28Å; V275-L414 HydrophobicContact CG2-CG 3.95Å
276	G	91.5	Very high	81	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	-178.4	171.2	0	0	0	0	0	112.1	L388	G276-L388 PolarHBondContact N-O 3.19Å; G276-L388 PolarHBondContact O-N 3.06Å
277	F	91.9	Very high	82.1	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	156.5	-174.8	-59.3	-84.7	0	0	0	112.3	L155 A158 I159 I162 I253 L254 M257 L385 K386 I387	L155-F277 HydrophobicContact CD1-CD2 4.36Å; L155-F277 HydrophobicContact CD1-CE2 4.24Å; A158-F277 HydrophobicContact CB-CE1 4.1Å; A158-F277 HydrophobicContact CB-CZ 4.47Å; I159-F277 HydrophobicContact CD1-CE2 4.46Å; I159-F277 HydrophobicContact CG1-CE2 3.87Å; I159-F277 HydrophobicContact CG1-CZ 3.7Å; I162-F277 HydrophobicContact CD1-CE1 3.58Å; I162-F277 HydrophobicContact CD1-CZ 3.65Å; I253-F277 HydrophobicContact CG2-CE2 4.44Å; L254-F277 VanDerWaalsContact O-CD2 3.28Å; L254-F277 WeakPolarHBondContact O-CD2 3.24Å; M257-F277 CarbonylContact C-O 3.41Å; M257-F277 HydrophobicContact CE-CB 4Å; M257-F277 HydrophobicContact CE-CG 4.37Å; M257-F277 HydrophobicContact SD-CB 3.54Å; M257-F277 VanDerWaalsContact SD-CB 3.54Å; F277-L385 HydrophobicContact CD1-CB 4.49Å; F277-K386 CarbonylContact C-O 3.56Å; F277-K386 WeakPolarHBondContact CA-O 3.44Å; F277-I387 HydrophobicContact CD1-CG1 4.47Å; F277-I387 HydrophobicContact CE1-CG1 4.42Å
278	S	91.7	Very high	83.3	Confident	5 Å²	5	44.9 Å²	44.9	4%	0.035	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	142.6	166.5	176.7	0	0	0	0	110.8	L280 K386	S278-L280 PolarHBondContact OG-N 2.93Å; S278-K386 PolarHBondContact N-O 2.77Å; S278-K386 WeakPolarHBondContact O-CB 3.15Å; S278-K386 PolarHBondContact O-N 2.91Å
279	M	91.3	Very high	84.5	Confident	5 Å²	5	47.6 Å²	47.6	3%	0.025	27%	0.269	C	S	.	.			trans	-103.6	1.4	174.9	-154.4	-177.2	-160.8	0	0	112.5	P150 L312 T369 R380 Y383 L385	P150-M279 HydrophobicContact CG-CE 3.77Å; P150-M279 HydrophobicContact CG-SD 3.79Å; M279-L312 HydrophobicContact CB-CD1 3.91Å; M279-L312 HydrophobicContact CB-CD2 4.47Å; M279-T369 CarbonylContact O-C 3.46Å; M279-T369 VanDerWaalsContact O-CA 3.29Å; M279-T369 WeakPolarHBondContact O-CA 3.29Å; M279-R380 VanDerWaalsContact CE-NH1 3.26Å; M279-Y383 HydrophobicContact CE-CD2 3.4Å; M279-Y383 HydrophobicContact CE-CE2 3.89Å; M279-Y383 HydrophobicContact CE-CG 3.83Å; M279-L385 HydrophobicContact CB-CD2 4.48Å; M279-L385 HydrophobicContact CG-CD2 4.25Å
280	L	90.8	Very high	85.8	Confident	7 Å²	7	45.5 Å²	45.5	4%	0.037	25%	0.247	C	C	.	.			trans	-79.6	126.4	-169.5	-63.4	175.3	0	0	0	112.4	S278 I282 Y287 P310 L312 A315	S278-L280 PolarHBondContact OG-N 2.93Å; L280-I282 PolarHBondContact O-N 2.89Å; L280-Y287 HydrophobicContact CB-CE2 4.24Å; L280-P310 HydrophobicContact CD1-CB 4.38Å; L280-P310 HydrophobicContact CD1-CG 3.57Å; L280-L312 HydrophobicContact CD2-CD1 4.22Å; L280-A315 HydrophobicContact CD2-CB 3.59Å
281	N	90.1	Very high	87.1	Confident	37 Å²	37	41.5 Å²	41.5	20%	0.198	23%	0.225	C	C	.	.			trans	-90.6	86.2	179.7	-172.5	23	0	0	0	111.9	S283 H284 L368	N281-S283 PolarHBondContact O-N 3.1Å; N281-S283 VanDerWaalsContact O-N 3.09Å; N281-S283 PolarHBondContact OD1-OG 2.92Å; N281-H284 WeakPolarHBondContact O-CB 3.43Å; N281-H284 PolarHBondContact O-N 2.94Å; N281-H284 VanDerWaalsContact O-N 3.07Å; N281-L368 PolarHBondContact N-O 3.42Å
282	I	86.5	Confident	88.4	Confident	101 Å²	101	40.9 Å²	40.9	52%	0.518	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-21.2	-178.9	-56.6	171.4	0	0	0	112.8	L280 Y287	L280-I282 PolarHBondContact O-N 2.89Å; I282-Y287 HydrophobicContact CB-CD1 4.43Å; I282-Y287 HydrophobicContact CB-CE1 4.19Å; I282-Y287 HydrophobicContact CG1-CE1 4Å; I282-Y287 HydrophobicContact CG2-CD1 4.21Å; I282-Y287 HydrophobicContact CG2-CE1 4.02Å
283	S	87.8	Confident	89.3	Confident	99 Å²	99	42.2 Å²	42.2	69%	0.692	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-7.9	178.2	70.4	0	0	0	0	114.6	N281	N281-S283 PolarHBondContact O-N 3.1Å; N281-S283 VanDerWaalsContact O-N 3.09Å; N281-S283 PolarHBondContact OD1-OG 2.92Å
284	H	89.7	Confident	89.5	Confident	34 Å²	34	41.8 Å²	41.8	16%	0.157	22%	0.223	C	C	.	.	S	Bend	trans	-65.3	130.7	179.3	-179.3	-98.5	0	0	0	110.7	N281 F286 Y287 L368	N281-H284 WeakPolarHBondContact O-CB 3.43Å; N281-H284 PolarHBondContact O-N 2.94Å; N281-H284 VanDerWaalsContact O-N 3.07Å; H284-F286 VanDerWaalsContact C-N 3.3Å; H284-F286 PolarHBondContact ND1-N 3.17Å; H284-F286 PolarHBondContact O-N 3.03Å; H284-F286 VanDerWaalsContact O-N 3.13Å; H284-Y287 WeakPolarHBondContact O-CB 3.34Å; H284-Y287 PolarHBondContact O-N 2.86Å; H284-L368 HydrophobicContact CB-CD2 4.49Å; H284-L368 WeakPolarHBondContact ND1-CD2 3.39Å
285	P	89.1	Confident	89.4	Confident	115 Å²	115	44 Å²	44	75%	0.747	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-39.1	-170.8	-29.5	36	0	0	0	115	Y287	P285-Y287 VanDerWaalsContact C-N 3.29Å; P285-Y287 PolarHBondContact O-N 2.97Å
286	F	89.9	Confident	89.1	Confident	48 Å²	48	48.2 Å²	48.2	21%	0.211	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-9.8	179.7	-168.2	-111.3	0	0	0	113.7	H284 L288 D289 F290 F318	H284-F286 VanDerWaalsContact C-N 3.3Å; H284-F286 PolarHBondContact ND1-N 3.17Å; H284-F286 PolarHBondContact O-N 3.03Å; H284-F286 VanDerWaalsContact O-N 3.13Å; F286-L288 PolarHBondContact O-N 3.38Å; F286-D289 HydrophobicContact CD2-CB 4.18Å; F286-D289 HydrophobicContact CE2-CB 4.17Å; F286-D289 PolarHBondContact O-N 3.13Å; F286-D289 VanDerWaalsContact O-N 3.15Å; F286-F290 HydrophobicContact CD1-CB 3.99Å; F286-F290 HydrophobicContact CE1-CB 3.99Å; F286-F290 HydrophobicContact CE1-CD2 4.31Å; F286-F290 WeakPolarHBondContact O-CB 3.4Å; F286-F290 PolarHBondContact O-N 3.36Å; F286-F318 HydrophobicContact CD1-CE1 4.33Å; F286-F318 AromaticContact CD1-CE2 3.94Å; F286-F318 HydrophobicContact CD1-CE2 3.94Å; F286-F318 AromaticContact CD1-CZ 3.56Å; F286-F318 HydrophobicContact CD1-CZ 3.56Å; F286-F318 HydrophobicContact CE1-CD2 4.47Å; F286-F318 AromaticContact CE1-CE2 3.48Å; F286-F318 HydrophobicContact CE1-CE2 3.48Å; F286-F318 VanDerWaalsContact CE1-CE2 3.48Å; F286-F318 AromaticContact CE1-CZ 3.59Å; F286-F318 HydrophobicContact CE1-CZ 3.59Å; F286-F318 HydrophobicContact CZ-CE2 4.4Å
287	Y	90.5	Very high	88.5	Confident	25 Å²	25	50 Å²	50	10%	0.098	27%	0.269	C	S	.	.	H	α-helix	trans	-57.8	-45.1	-173.7	-174.7	-97.1	0	0	0	111.9	L280 I282 H284 P285 D289 F290 I291 L368	L280-Y287 HydrophobicContact CB-CE2 4.24Å; I282-Y287 HydrophobicContact CB-CD1 4.43Å; I282-Y287 HydrophobicContact CB-CE1 4.19Å; I282-Y287 HydrophobicContact CG1-CE1 4Å; I282-Y287 HydrophobicContact CG2-CD1 4.21Å; I282-Y287 HydrophobicContact CG2-CE1 4.02Å; H284-Y287 WeakPolarHBondContact O-CB 3.34Å; H284-Y287 PolarHBondContact O-N 2.86Å; P285-Y287 VanDerWaalsContact C-N 3.29Å; P285-Y287 PolarHBondContact O-N 2.97Å; Y287-D289 VanDerWaalsContact C-N 3.31Å; Y287-D289 PolarHBondContact O-N 3.48Å; Y287-F290 PolarHBondContact O-N 2.9Å; Y287-I291 HydrophobicContact CD1-CG1 4.01Å; Y287-I291 HydrophobicContact CE1-CD1 4.12Å; Y287-I291 HydrophobicContact CE1-CG1 3.74Å; Y287-I291 HydrophobicContact CE2-CD1 4.27Å; Y287-I291 HydrophobicContact CE2-CG1 4.4Å; Y287-I291 HydrophobicContact CG-CG1 4.45Å; Y287-I291 WeakPolarHBondContact O-CG1 3.25Å; Y287-I291 PolarHBondContact O-N 3.17Å; Y287-L368 HydrophobicContact CD2-CD2 4.2Å
288	L	89.8	Confident	87.8	Confident	118 Å²	118	52.3 Å²	52.3	62%	0.618	28%	0.278	S	S	*	.	H	α-helix	trans	-65	-32.1	-179.7	-63.7	178.2	0	0	0	113.3	F286 R292	F286-L288 PolarHBondContact O-N 3.38Å; L288-R292 WeakPolarHBondContact O-CB 3.43Å; L288-R292 PolarHBondContact O-N 2.93Å; L288-R292 VanDerWaalsContact O-N 3.09Å
289	D	89.7	Confident	87.1	Confident	62 Å²	62	57.6 Å²	57.6	33%	0.332	30%	0.3	S	S	.	.	H	α-helix	trans	-81.1	-35.7	179	-64.7	-34.7	0	0	0	111.8	F286 Y287 R292 S293	F286-D289 HydrophobicContact CD2-CB 4.18Å; F286-D289 HydrophobicContact CE2-CB 4.17Å; F286-D289 PolarHBondContact O-N 3.13Å; F286-D289 VanDerWaalsContact O-N 3.15Å; Y287-D289 VanDerWaalsContact C-N 3.31Å; Y287-D289 PolarHBondContact O-N 3.48Å; D289-R292 PolarHBondContact O-N 3.14Å; D289-R292 IonicContact OD1-CZ 3.35Å; D289-R292 IonicContact OD1-NH1 2.66Å; D289-R292 PolarHBondContact OD1-NH1 3.4Å; D289-R292 IonicContact OD1-NH2 2.67Å; D289-R292 PolarHBondContact OD1-NH2 3.02Å; D289-S293 WeakPolarHBondContact O-CB 3.31Å; D289-S293 PolarHBondContact O-N 2.8Å; D289-S293 PolarHBondContact O-OG 3.47Å
290	F	90.1	Very high	86.4	Confident	1 Å²	1	65.2 Å²	65.2	0%	0.004	34%	0.336	C	S	.	.	H	α-helix	trans	-58.5	-49.9	169.3	179.6	-105.9	0	0	0	111.2	A53 L56 F286 Y287 R292 S293 L294 P310 F318 L368	A53-F290 HydrophobicContact CB-CE2 3.84Å; A53-F290 HydrophobicContact CB-CZ 4.18Å; L56-F290 HydrophobicContact CD1-CD2 4.09Å; F286-F290 HydrophobicContact CD1-CB 3.99Å; F286-F290 HydrophobicContact CE1-CB 3.99Å; F286-F290 HydrophobicContact CE1-CD2 4.31Å; F286-F290 WeakPolarHBondContact O-CB 3.4Å; F286-F290 PolarHBondContact O-N 3.36Å; Y287-F290 PolarHBondContact O-N 2.9Å; F290-R292 PolarHBondContact O-N 3.04Å; F290-S293 PolarHBondContact O-N 2.94Å; F290-L294 HydrophobicContact CD1-CD1 3.77Å; F290-L294 HydrophobicContact CD2-CD1 4.49Å; F290-L294 HydrophobicContact CE1-CD1 3.45Å; F290-L294 VanDerWaalsContact CE1-CD1 3.45Å; F290-L294 HydrophobicContact CE2-CD1 4.22Å; F290-L294 HydrophobicContact CG-CD1 4.29Å; F290-L294 HydrophobicContact CZ-CD1 3.71Å; F290-L294 WeakPolarHBondContact O-CG 3.21Å; F290-L294 PolarHBondContact O-N 2.95Å; F290-P310 HydrophobicContact CE1-CB 4.4Å; F290-F318 HydrophobicContact CD2-CD2 4.3Å; F290-F318 HydrophobicContact CE2-CB 4.24Å; F290-F318 HydrophobicContact CE2-CD2 4.18Å; F290-F318 HydrophobicContact CE2-CG 4.38Å; F290-L368 HydrophobicContact CB-CD1 4.39Å; F290-L368 HydrophobicContact CD1-CD1 3.81Å; F290-L368 HydrophobicContact CD2-CD1 3.7Å; F290-L368 HydrophobicContact CE1-CD1 3.85Å; F290-L368 HydrophobicContact CE2-CD1 3.75Å; F290-L368 HydrophobicContact CG-CD1 3.72Å; F290-L368 HydrophobicContact CZ-CD1 3.82Å
291	I	89.4	Confident	85.2	Confident	37 Å²	37	66.9 Å²	66.9	19%	0.19	36%	0.355	C	S	.	.	H	α-helix	trans	-61.5	-42.2	176.1	-63.3	-68.7	0	0	0	111.5	Y287 S293 N295 Y307 P310	Y287-I291 HydrophobicContact CD1-CG1 4.01Å; Y287-I291 HydrophobicContact CE1-CD1 4.12Å; Y287-I291 HydrophobicContact CE1-CG1 3.74Å; Y287-I291 HydrophobicContact CE2-CD1 4.27Å; Y287-I291 HydrophobicContact CE2-CG1 4.4Å; Y287-I291 HydrophobicContact CG-CG1 4.45Å; Y287-I291 WeakPolarHBondContact O-CG1 3.25Å; Y287-I291 PolarHBondContact O-N 3.17Å; I291-S293 VanDerWaalsContact C-N 3.35Å; I291-S293 PolarHBondContact O-N 2.87Å; I291-N295 WeakPolarHBondContact O-CB 3.48Å; I291-N295 PolarHBondContact O-N 3.41Å; I291-Y307 HydrophobicContact CG2-CE1 4.47Å; I291-P310 HydrophobicContact CD1-CB 3.68Å; I291-P310 HydrophobicContact CD1-CG 3.43Å; I291-P310 VanDerWaalsContact CD1-CG 3.43Å
292	R	88.5	Confident	84.2	Confident	137 Å²	137	65.8 Å²	65.8	52%	0.517	35%	0.35	S	S	.	.	H	α-helix	trans	-62.4	-43.6	177.4	-165.1	-173.6	-51.3	116.7	18.6	111.4	L288 D289 F290 N295 L296	L288-R292 WeakPolarHBondContact O-CB 3.43Å; L288-R292 PolarHBondContact O-N 2.93Å; L288-R292 VanDerWaalsContact O-N 3.09Å; D289-R292 PolarHBondContact O-N 3.14Å; D289-R292 IonicContact OD1-CZ 3.35Å; D289-R292 IonicContact OD1-NH1 2.66Å; D289-R292 PolarHBondContact OD1-NH1 3.4Å; D289-R292 IonicContact OD1-NH2 2.67Å; D289-R292 PolarHBondContact OD1-NH2 3.02Å; F290-R292 PolarHBondContact O-N 3.04Å; R292-N295 PolarHBondContact O-N 3Å; R292-L296 HydrophobicContact CG-CD1 4.31Å; R292-L296 WeakPolarHBondContact O-CG 3.31Å; R292-L296 PolarHBondContact O-N 3.21Å
293	S	87.8	Confident	83	Confident	36 Å²	36	69.3 Å²	69.3	25%	0.252	37%	0.37	S	S	.	.	H	α-helix	trans	-64.1	-45.5	180	-56.1	0	0	0	0	111.9	D289 F290 I291 L296 S297	D289-S293 WeakPolarHBondContact O-CB 3.31Å; D289-S293 PolarHBondContact O-N 2.8Å; D289-S293 PolarHBondContact O-OG 3.47Å; F290-S293 PolarHBondContact O-N 2.94Å; I291-S293 VanDerWaalsContact C-N 3.35Å; I291-S293 PolarHBondContact O-N 2.87Å; S293-L296 PolarHBondContact O-N 2.83Å; S293-S297 PolarHBondContact O-N 3.15Å
294	L	85.3	Confident	81.7	Confident	9 Å²	9	70.1 Å²	70.1	5%	0.047	37%	0.365	C	S	.	.	H	α-helix	trans	-62.3	-43.2	174.6	-72.9	165	0	0	0	112.2	L52 F290 L296 S297 W298 Y307 P310	L52-L294 HydrophobicContact CB-CD2 4.43Å; L52-L294 HydrophobicContact CD2-CD2 3.88Å; L52-L294 HydrophobicContact CD2-CG 4.26Å; F290-L294 HydrophobicContact CD1-CD1 3.77Å; F290-L294 HydrophobicContact CD2-CD1 4.49Å; F290-L294 HydrophobicContact CE1-CD1 3.45Å; F290-L294 VanDerWaalsContact CE1-CD1 3.45Å; F290-L294 HydrophobicContact CE2-CD1 4.22Å; F290-L294 HydrophobicContact CG-CD1 4.29Å; F290-L294 HydrophobicContact CZ-CD1 3.71Å; F290-L294 WeakPolarHBondContact O-CG 3.21Å; F290-L294 PolarHBondContact O-N 2.95Å; L294-L296 PolarHBondContact O-N 3.46Å; L294-S297 PolarHBondContact O-N 3.41Å; L294-W298 VanDerWaalsContact O-CB 3.3Å; L294-W298 WeakPolarHBondContact O-CB 3.22Å; L294-W298 PolarHBondContact O-N 2.95Å; L294-Y307 HydrophobicContact CB-CE2 4.35Å; L294-Y307 VanDerWaalsContact CB-OH 3.26Å; L294-Y307 WeakPolarHBondContact CB-OH 3.44Å; L294-P310 HydrophobicContact CD1-CB 4.34Å
295	N	86.2	Confident	80.2	Confident	46 Å²	46	73.8 Å²	73.8	25%	0.246	39%	0.386	C	S	.	.	H	α-helix	trans	-64.4	-37.2	178.9	-171.8	-43.5	0	0	0	112.4	I291 R292 K299 Y307	I291-N295 WeakPolarHBondContact O-CB 3.48Å; I291-N295 PolarHBondContact O-N 3.41Å; R292-N295 PolarHBondContact O-N 3Å; N295-K299 WeakPolarHBondContact O-CG 3.38Å; N295-K299 PolarHBondContact O-N 2.82Å; N295-K299 WeakPolarHBondContact OD1-CE 3.48Å; N295-K299 PolarHBondContact OD1-NZ 3.34Å; N295-Y307 HydrophobicContact CB-CD1 3.83Å; N295-Y307 HydrophobicContact CB-CE1 4.09Å; N295-Y307 HydrophobicContact CB-CG 4.27Å
296	L	83.4	Confident	79.3	Confident	91 Å²	91	72.2 Å²	72.2	48%	0.476	38%	0.376	S	S	.	.	H	α-helix	trans	-65.6	-52.2	172.5	-72.2	167.8	0	0	0	111.2	R292 S293 L294 W298 K299 E300	R292-L296 HydrophobicContact CG-CD1 4.31Å; R292-L296 WeakPolarHBondContact O-CG 3.31Å; R292-L296 PolarHBondContact O-N 3.21Å; S293-L296 PolarHBondContact O-N 2.83Å; L294-L296 PolarHBondContact O-N 3.46Å; L296-W298 VanDerWaalsContact C-N 3.27Å; L296-W298 PolarHBondContact O-N 2.94Å; L296-K299 PolarHBondContact O-N 2.9Å; L296-K299 VanDerWaalsContact O-N 3.07Å; L296-E300 PolarHBondContact O-N 3.12Å; L296-E300 VanDerWaalsContact O-N 3.08Å
297	S	79.9	Confident	78.6	Confident	36 Å²	36	71.4 Å²	71.4	25%	0.252	37%	0.371	S	S	.	.	H	α-helix	trans	-60.7	-35.2	178.8	-173.3	0	0	0	0	112.9	S293 L294 E300 G301	S293-S297 PolarHBondContact O-N 3.15Å; L294-S297 PolarHBondContact O-N 3.41Å; S297-E300 PolarHBondContact O-N 3.48Å; S297-G301 PolarHBondContact O-N 2.93Å
298	W	76.9	Confident	77.8	Confident	49 Å²	49	72.1 Å²	72.1	19%	0.186	38%	0.379	C	S	.	.	H	α-helix	trans	-63.1	-43.4	173.5	-174.3	-82.5	0	0	0	112.2	C46 L294 L296 E300 G301 C302 I304 Y307 P308	C46-W298 VanDerWaalsContact SG-CE2 3.52Å; C46-W298 VanDerWaalsContact SG-CE3 3.56Å; C46-W298 WeakPolarHBondContact SG-CH2 3.44Å; C46-W298 WeakPolarHBondContact SG-CZ2 3.29Å; C46-W298 WeakPolarHBondContact SG-CZ3 3.37Å; L294-W298 VanDerWaalsContact O-CB 3.3Å; L294-W298 WeakPolarHBondContact O-CB 3.22Å; L294-W298 PolarHBondContact O-N 2.95Å; L296-W298 VanDerWaalsContact C-N 3.27Å; L296-W298 PolarHBondContact O-N 2.94Å; W298-E300 VanDerWaalsContact C-N 3.28Å; W298-E300 PolarHBondContact O-N 3Å; W298-G301 PolarHBondContact O-N 2.93Å; W298-C302 HydrophobicContact CD2-CB 4.38Å; W298-C302 HydrophobicContact CG-CB 4.37Å; W298-C302 WeakPolarHBondContact O-CA 3.26Å; W298-C302 WeakPolarHBondContact O-CB 3.5Å; W298-C302 PolarHBondContact O-N 3.45Å; W298-C302 PolarHBondContact O-SG 3.46Å; W298-C302 VanDerWaalsContact O-SG 3.4Å; W298-I304 PolarHBondContact NE1-O 3.05Å; W298-Y307 HydrophobicContact CB-CD2 3.76Å; W298-Y307 HydrophobicContact CB-CE2 4.32Å; W298-Y307 AromaticContact CD2-CD2 3.63Å; W298-Y307 HydrophobicContact CD2-CD2 3.63Å; W298-Y307 HydrophobicContact CD2-CE2 4.29Å; W298-Y307 AromaticContact CE3-CD2 3.92Å; W298-Y307 HydrophobicContact CE3-CD2 3.92Å; W298-Y307 HydrophobicContact CE3-CE2 4.12Å; W298-Y307 AromaticContact CG-CD2 3.57Å; W298-Y307 HydrophobicContact CG-CD2 3.57Å; W298-Y307 HydrophobicContact CG-CE2 4.4Å; W298-Y307 HydrophobicContact CG-CG 4.36Å; W298-P308 HydrophobicContact CH2-CG 3.72Å; W298-P308 HydrophobicContact CZ2-CG 3.87Å; W298-P308 HydrophobicContact CZ3-CG 4.35Å
299	K	77	Confident	77.3	Confident	116 Å²	116	67.2 Å²	67.2	50%	0.504	36%	0.357	S	S	.	.	H	α-helix	trans	-67.4	-27.8	176.8	-76	165.8	174.7	157.4	0	113.5	N295 L296	N295-K299 WeakPolarHBondContact O-CG 3.38Å; N295-K299 PolarHBondContact O-N 2.82Å; N295-K299 WeakPolarHBondContact OD1-CE 3.48Å; N295-K299 PolarHBondContact OD1-NZ 3.34Å; L296-K299 PolarHBondContact O-N 2.9Å; L296-K299 VanDerWaalsContact O-N 3.07Å
300	E	75.3	Confident	77.1	Confident	166 Å²	166	64.9 Å²	64.9	78%	0.776	35%	0.346	S	S	*	.	H	α-helix	trans	-80.2	-30.6	175	-68.7	172.7	-178.7	0	0	112.4	L296 S297 W298	L296-E300 PolarHBondContact O-N 3.12Å; L296-E300 VanDerWaalsContact O-N 3.08Å; S297-E300 PolarHBondContact O-N 3.48Å; W298-E300 VanDerWaalsContact C-N 3.28Å; W298-E300 PolarHBondContact O-N 3Å
301	G	67.3	Low	76.9	Confident	42 Å²	42	66.2 Å²	66.2	43%	0.433	36%	0.356	S	S	.	.	H	α-helix	trans	-98.3	-20	-176.9	0	0	0	0	0	116.4	S297 W298	S297-G301 PolarHBondContact O-N 2.93Å; W298-G301 PolarHBondContact O-N 2.93Å
302	C	68.6	Low	76.9	Confident	14 Å²	14	64.6 Å²	64.6	10%	0.095	35%	0.348	C	S	.	.			trans	-131.9	131.5	-165.5	-44.8	0	0	0	0	113.7	C46 W298 I304	C46-C302 WeakPolarHBondContact CA-SG 3.19Å; C46-C302 HydrophobicContact CB-CB 4.16Å; C46-C302 WeakPolarHBondContact CB-SG 3.09Å; C46-C302 WeakPolarHBondContact SG-CB 3.17Å; C46-C302 CovalentContact SG-SG 2.03Å; C46-C302 PolarHBondContact SG-SG 2.69Å; W298-C302 HydrophobicContact CD2-CB 4.38Å; W298-C302 HydrophobicContact CG-CB 4.37Å; W298-C302 WeakPolarHBondContact O-CA 3.26Å; W298-C302 WeakPolarHBondContact O-CB 3.5Å; W298-C302 PolarHBondContact O-N 3.45Å; W298-C302 PolarHBondContact O-SG 3.46Å; W298-C302 VanDerWaalsContact O-SG 3.4Å; C302-I304 PolarHBondContact O-N 2.89Å
303	N	60.1	Low	77	Confident	174 Å²	174	59 Å²	59	93%	0.93	33%	0.33	S	S	*	.	S	Bend	trans	-74.9	-0.9	170.2	-69.1	-24.7	0	0	0	113.7
304	I	61.5	Low	77.1	Confident	117 Å²	117	57.6 Å²	57.6	60%	0.6	32%	0.32	S	S	*	.			trans	-97.8	106.3	-176.3	-55.7	175.9	0	0	0	108.9	W298 C302	W298-I304 PolarHBondContact NE1-O 3.05Å; C302-I304 PolarHBondContact O-N 2.89Å
305	N	57.2	Low	77.4	Confident	110 Å²	110	57.1 Å²	57.1	59%	0.588	32%	0.318	S	S	*	.			trans	-106.5	147.3	165.7	-83.5	-60.6	0	0	0	109.5
306	P	71.4	Confident	77.7	Confident	82 Å²	82	55 Å²	55	53%	0.532	31%	0.306	S	S	.	.	S	Bend	cis	-81	166.4	-1	33.6	-35.4	0	0	0	113.6
307	Y	74.4	Confident	78.1	Confident	31 Å²	31	50.7 Å²	50.7	12%	0.122	28%	0.284	C	S	.	.			trans	-63.2	125.2	168.4	169.4	-117.5	0	0	0	110.2	I291 L294 N295 W298 G309	I291-Y307 HydrophobicContact CG2-CE1 4.47Å; L294-Y307 HydrophobicContact CB-CE2 4.35Å; L294-Y307 VanDerWaalsContact CB-OH 3.26Å; L294-Y307 WeakPolarHBondContact CB-OH 3.44Å; N295-Y307 HydrophobicContact CB-CD1 3.83Å; N295-Y307 HydrophobicContact CB-CE1 4.09Å; N295-Y307 HydrophobicContact CB-CG 4.27Å; W298-Y307 HydrophobicContact CB-CD2 3.76Å; W298-Y307 HydrophobicContact CB-CE2 4.32Å; W298-Y307 AromaticContact CD2-CD2 3.63Å; W298-Y307 HydrophobicContact CD2-CD2 3.63Å; W298-Y307 HydrophobicContact CD2-CE2 4.29Å; W298-Y307 AromaticContact CE3-CD2 3.92Å; W298-Y307 HydrophobicContact CE3-CD2 3.92Å; W298-Y307 HydrophobicContact CE3-CE2 4.12Å; W298-Y307 AromaticContact CG-CD2 3.57Å; W298-Y307 HydrophobicContact CG-CD2 3.57Å; W298-Y307 HydrophobicContact CG-CE2 4.4Å; W298-Y307 HydrophobicContact CG-CG 4.36Å; Y307-G309 WeakPolarHBondContact CE2-O 3.46Å; Y307-G309 PolarHBondContact OH-O 3.34Å
308	P	73.9	Confident	78.8	Confident	40 Å²	40	49 Å²	49	26%	0.26	27%	0.272	S	S	.	.			trans	-76.1	-25.3	-173.6	29.4	-35.6	0	0	0	113.9	W298	W298-P308 HydrophobicContact CH2-CG 3.72Å; W298-P308 HydrophobicContact CZ2-CG 3.87Å; W298-P308 HydrophobicContact CZ3-CG 4.35Å
309	G	79.6	Confident	79.6	Confident	16 Å²	16	46.7 Å²	46.7	17%	0.165	26%	0.263	C	S	.	.			trans	131.9	-176.9	-178.4	0	0	0	0	0	113.8	L261 Y307	L261-G309 WeakPolarHBondContact CD2-O 3.23Å; Y307-G309 WeakPolarHBondContact CE2-O 3.46Å; Y307-G309 PolarHBondContact OH-O 3.34Å
310	P	84.8	Confident	80.5	Confident	13 Å²	13	41.1 Å²	41.1	8%	0.084	24%	0.239	C	C	.	.			trans	-78.5	125.1	178.4	33.6	-37.1	0	0	0	111.5	L261 L280 F290 I291 L294	L261-P310 WeakPolarHBondContact CD2-O 3.32Å; L280-P310 HydrophobicContact CD1-CB 4.38Å; L280-P310 HydrophobicContact CD1-CG 3.57Å; F290-P310 HydrophobicContact CE1-CB 4.4Å; I291-P310 HydrophobicContact CD1-CB 3.68Å; I291-P310 HydrophobicContact CD1-CG 3.43Å; I291-P310 VanDerWaalsContact CD1-CG 3.43Å; L294-P310 HydrophobicContact CD1-CB 4.34Å
311	A	86.7	Confident	81.3	Confident	28 Å²	28	33.2 Å²	33.2	23%	0.231	20%	0.202	C	C	.	.			trans	-69.2	142.5	166.7	0	0	0	0	0	110.4	L261 S313 S314 A315	L261-A311 HydrophobicContact CD1-CB 4.23Å; A311-S313 PolarHBondContact O-N 3.46Å; A311-S314 WeakPolarHBondContact O-CB 3.41Å; A311-S314 PolarHBondContact O-N 3.41Å; A311-A315 PolarHBondContact O-N 2.68Å
312	L	89.9	Confident	82.5	Confident	4 Å²	4	31.9 Å²	31.9	2%	0.021	19%	0.185	C	C	.	.	H	α-helix	trans	-58.1	-38.5	178.4	174.9	61.3	0	0	0	111.2	Y149 M257 D258 M279 L280 S314 A315 L316 T369	Y149-L312 HydrophobicContact CD2-CD2 4.33Å; Y149-L312 HydrophobicContact CE2-CD2 3.9Å; M257-L312 HydrophobicContact CB-CD2 3.44Å; M257-L312 VanDerWaalsContact CB-CD2 3.44Å; M257-L312 HydrophobicContact CG-CD2 3.88Å; D258-L312 PolarHBondContact OD1-N 2.91Å; M279-L312 HydrophobicContact CB-CD1 3.91Å; M279-L312 HydrophobicContact CB-CD2 4.47Å; L280-L312 HydrophobicContact CD2-CD1 4.22Å; L312-S314 PolarHBondContact O-N 2.88Å; L312-A315 PolarHBondContact O-N 3.39Å; L312-A315 VanDerWaalsContact O-N 3.08Å; L312-L316 HydrophobicContact CD1-CD1 4.14Å; L312-L316 HydrophobicContact CD1-CD2 4.45Å; L312-L316 HydrophobicContact CD1-CG 3.95Å; L312-L316 HydrophobicContact CD2-CD1 4.1Å; L312-L316 HydrophobicContact CG-CD1 3.71Å; L312-L316 HydrophobicContact CG-CG 4.03Å; L312-L316 WeakPolarHBondContact O-CG 3.44Å; L312-L316 PolarHBondContact O-N 2.63Å; L312-T369 HydrophobicContact CD1-CG2 3.73Å
313	S	89.4	Confident	83.7	Confident	19 Å²	19	31.2 Å²	31.2	13%	0.133	18%	0.18	C	C	.	.	H	α-helix	trans	-56.8	-35.8	177.1	62.6	0	0	0	0	113.2	E50 A107 A311 L316 M317	E50-S313 WeakPolarHBondContact OE1-CB 3.5Å; E50-S313 PolarHBondContact OE1-OG 3.34Å; A107-S313 VanDerWaalsContact CB-CB 3.46Å; A311-S313 PolarHBondContact O-N 3.46Å; S313-L316 PolarHBondContact O-N 2.96Å; S313-M317 WeakPolarHBondContact O-CB 3.2Å; S313-M317 WeakPolarHBondContact O-CG 3.23Å; S313-M317 PolarHBondContact O-N 3.45Å
314	S	90	Very high	85.3	Confident	6 Å²	6	23 Å²	23	4%	0.042	14%	0.136	C	C	.	.	H	α-helix	trans	-69.2	-38.8	176.9	-59.1	0	0	0	0	111.7	E50 A53 A311 L312 F318	E50-S314 PolarHBondContact N-OG 3.09Å; A53-S314 WeakPolarHBondContact CB-O 3.22Å; A311-S314 WeakPolarHBondContact O-CB 3.41Å; A311-S314 PolarHBondContact O-N 3.41Å; L312-S314 PolarHBondContact O-N 2.88Å; S314-F318 PolarHBondContact O-N 3.03Å
315	A	91.9	Very high	86.7	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-69	-41.4	174.3	0	0	0	0	0	111.8	L280 A311 L312 F318 D319 L368 T369	L280-A315 HydrophobicContact CD2-CB 3.59Å; A311-A315 PolarHBondContact O-N 2.68Å; L312-A315 PolarHBondContact O-N 3.39Å; L312-A315 VanDerWaalsContact O-N 3.08Å; A315-F318 WeakPolarHBondContact O-CB 3.36Å; A315-F318 PolarHBondContact O-N 3.22Å; A315-D319 PolarHBondContact O-N 2.75Å; A315-L368 HydrophobicContact CB-CB 4.13Å; A315-T369 HydrophobicContact CB-CG2 3.78Å
316	L	93.1	Very high	88.3	Confident	1 Å²	1	15 Å²	15	1%	0.005	10%	0.098	C	C	.	.	H	α-helix	trans	-66.2	-36.4	176.3	-66.8	172.2	0	0	0	112.5	I130 L148 Y149 L312 S313 A320 T369	I130-L316 HydrophobicContact CB-CB 3.81Å; I130-L316 HydrophobicContact CB-CD1 4.15Å; I130-L316 HydrophobicContact CD1-CB 4.48Å; I130-L316 HydrophobicContact CG2-CB 3.8Å; I130-L316 WeakPolarHBondContact O-CD1 3.26Å; L148-L316 HydrophobicContact CB-CD2 3.91Å; Y149-L316 HydrophobicContact CD2-CD1 3.94Å; L312-L316 HydrophobicContact CD1-CD1 4.14Å; L312-L316 HydrophobicContact CD1-CD2 4.45Å; L312-L316 HydrophobicContact CD1-CG 3.95Å; L312-L316 HydrophobicContact CD2-CD1 4.1Å; L312-L316 HydrophobicContact CG-CD1 3.71Å; L312-L316 HydrophobicContact CG-CG 4.03Å; L312-L316 WeakPolarHBondContact O-CG 3.44Å; L312-L316 PolarHBondContact O-N 2.63Å; S313-L316 PolarHBondContact O-N 2.96Å; L316-A320 WeakPolarHBondContact O-CB 3.4Å; L316-A320 PolarHBondContact O-N 3.49Å; L316-T369 HydrophobicContact CD2-CG2 3.75Å; L316-T369 HydrophobicContact CG-CG2 4.14Å
317	M	92.3	Very high	89.1	Confident	0 Å²	0	11.1 Å²	11.1	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-61.5	-41.4	171.9	-84.3	-68.1	179.6	0	0	112.1	L40 E50 A53 L54 I104 I130 S313 V321	L40-M317 HydrophobicContact CD2-CE 3.48Å; L40-M317 VanDerWaalsContact CD2-CE 3.48Å; L40-M317 HydrophobicContact CD2-SD 4.33Å; E50-M317 HydrophobicContact CB-CG 4.21Å; E50-M317 HydrophobicContact CG-CG 4.34Å; A53-M317 HydrophobicContact CB-CB 4.46Å; L54-M317 HydrophobicContact CD1-SD 4Å; L54-M317 HydrophobicContact CD2-CB 4.06Å; L54-M317 HydrophobicContact CD2-CG 4.45Å; L54-M317 HydrophobicContact CD2-SD 3.78Å; L54-M317 HydrophobicContact CG-CB 4.19Å; L54-M317 HydrophobicContact CG-CG 4.45Å; L54-M317 HydrophobicContact CG-SD 4.09Å; I104-M317 HydrophobicContact CG2-CE 4.06Å; I104-M317 HydrophobicContact CG2-SD 3.66Å; I130-M317 HydrophobicContact CD1-CE 3.5Å; I130-M317 VanDerWaalsContact CD1-CE 3.5Å; I130-M317 HydrophobicContact CD1-CG 3.58Å; I130-M317 HydrophobicContact CD1-SD 3.89Å; I130-M317 HydrophobicContact CG1-CE 4.45Å; S313-M317 WeakPolarHBondContact O-CB 3.2Å; S313-M317 WeakPolarHBondContact O-CG 3.23Å; S313-M317 PolarHBondContact O-N 3.45Å; M317-V321 PolarHBondContact O-N 3.25Å
318	F	93.1	Very high	89.8	Confident	1 Å²	1	10.2 Å²	10.2	0%	0.004	7%	0.071	C	C	.	.	H	α-helix	trans	-64.4	-51.4	176	-178.3	-85.9	0	0	0	111.3	A53 L56 A57 F286 F290 S314 A315 A320 V321 H322 L368	A53-F318 HydrophobicContact CB-CB 4.33Å; L56-F318 HydrophobicContact CB-CD2 4.46Å; L56-F318 HydrophobicContact CB-CE2 4.37Å; A57-F318 HydrophobicContact CB-CD2 3.62Å; A57-F318 HydrophobicContact CB-CE2 3.97Å; A57-F318 HydrophobicContact CB-CG 4.13Å; F286-F318 HydrophobicContact CD1-CE1 4.33Å; F286-F318 AromaticContact CD1-CE2 3.94Å; F286-F318 HydrophobicContact CD1-CE2 3.94Å; F286-F318 AromaticContact CD1-CZ 3.56Å; F286-F318 HydrophobicContact CD1-CZ 3.56Å; F286-F318 HydrophobicContact CE1-CD2 4.47Å; F286-F318 AromaticContact CE1-CE2 3.48Å; F286-F318 HydrophobicContact CE1-CE2 3.48Å; F286-F318 VanDerWaalsContact CE1-CE2 3.48Å; F286-F318 AromaticContact CE1-CZ 3.59Å; F286-F318 HydrophobicContact CE1-CZ 3.59Å; F286-F318 HydrophobicContact CZ-CE2 4.4Å; F290-F318 HydrophobicContact CD2-CD2 4.3Å; F290-F318 HydrophobicContact CE2-CB 4.24Å; F290-F318 HydrophobicContact CE2-CD2 4.18Å; F290-F318 HydrophobicContact CE2-CG 4.38Å; S314-F318 PolarHBondContact O-N 3.03Å; A315-F318 WeakPolarHBondContact O-CB 3.36Å; A315-F318 PolarHBondContact O-N 3.22Å; F318-A320 VanDerWaalsContact C-N 3.3Å; F318-A320 PolarHBondContact O-N 3.23Å; F318-V321 PolarHBondContact O-N 2.65Å; F318-H322 AromaticContact CD1-CD2 3.87Å; F318-H322 AromaticContact CE1-CD2 3.51Å; F318-H322 AromaticContact CE1-NE2 3.58Å; F318-H322 AromaticContact CZ-CD2 3.85Å; F318-H322 AromaticContact CZ-NE2 3.46Å; F318-H322 WeakPolarHBondContact CZ-NE2 3.44Å; F318-H322 PolarHBondContact O-N 2.93Å; F318-L368 HydrophobicContact CB-CD1 3.96Å; F318-L368 HydrophobicContact CD1-CD1 3.39Å; F318-L368 HydrophobicContact CD1-CG 3.81Å; F318-L368 HydrophobicContact CD2-CD1 4.26Å; F318-L368 HydrophobicContact CE1-CD1 3.86Å; F318-L368 HydrophobicContact CE1-CG 4.03Å; F318-L368 HydrophobicContact CG-CD1 3.62Å; F318-L368 HydrophobicContact CZ-CD1 4.47Å
319	D	94.8	Very high	90.4	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-62	-36.3	179.9	-71.3	-11	0	0	0	111.7	A315 V321 H322 V323 G367 L368 T369 I372	A315-D319 PolarHBondContact O-N 2.75Å; D319-V321 PolarHBondContact O-N 3.35Å; D319-H322 PolarHBondContact O-N 2.79Å; D319-V323 WeakPolarHBondContact O-CG2 3.41Å; D319-V323 PolarHBondContact O-N 3.49Å; D319-G367 VanDerWaalsContact OD1-CA 3.32Å; D319-G367 WeakPolarHBondContact OD1-CA 3.26Å; D319-L368 PolarHBondContact OD1-N 2.9Å; D319-L368 PolarHBondContact OD2-N 3.22Å; D319-T369 WeakPolarHBondContact OD2-CB 3.22Å; D319-T369 WeakPolarHBondContact OD2-CG2 3.35Å; D319-T369 PolarHBondContact OD2-N 3.04Å; D319-T369 PolarHBondContact OD2-OG1 2.91Å; D319-I372 HydrophobicContact CB-CD1 3.82Å
320	A	94.6	Very high	90.7	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-59.6	-43.2	178.1	0	0	0	0	0	113.4	I104 V128 I130 L148 L316 F318 V323 V324	I104-A320 HydrophobicContact CD1-CB 3.94Å; I104-A320 HydrophobicContact CG1-CB 4.35Å; I104-A320 HydrophobicContact CG2-CB 4.1Å; V128-A320 HydrophobicContact CG1-CB 3.99Å; I130-A320 HydrophobicContact CG2-CB 4.44Å; L148-A320 HydrophobicContact CD1-CB 3.59Å; L316-A320 WeakPolarHBondContact O-CB 3.4Å; L316-A320 PolarHBondContact O-N 3.49Å; F318-A320 VanDerWaalsContact C-N 3.3Å; F318-A320 PolarHBondContact O-N 3.23Å; A320-V323 PolarHBondContact O-N 2.86Å; A320-V324 WeakPolarHBondContact O-CG2 3.46Å; A320-V324 PolarHBondContact O-N 2.81Å
321	V	93.6	Very high	90.8	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-65.5	-42.5	177.6	-179.3	0	0	0	0	110.3	M36 L54 A57 I61 V73 V75 I104 M317 F318 D319 V324 V325	M36-V321 HydrophobicContact CE-CG1 4.04Å; M36-V321 HydrophobicContact SD-CG1 4.48Å; L54-V321 HydrophobicContact CD2-CG2 3.54Å; A57-V321 HydrophobicContact CB-CB 3.91Å; A57-V321 HydrophobicContact CB-CG1 4.16Å; A57-V321 HydrophobicContact CB-CG2 4.29Å; I61-V321 HydrophobicContact CD1-CG1 3.78Å; V73-V321 HydrophobicContact CG1-CG1 4.44Å; V75-V321 HydrophobicContact CG2-CG1 4.28Å; V75-V321 HydrophobicContact CG2-CG2 4.33Å; I104-V321 HydrophobicContact CD1-CG2 3.81Å; M317-V321 PolarHBondContact O-N 3.25Å; F318-V321 PolarHBondContact O-N 2.65Å; D319-V321 PolarHBondContact O-N 3.35Å; V321-V324 PolarHBondContact O-N 2.69Å; V321-V325 HydrophobicContact CG1-CG2 4.42Å; V321-V325 WeakPolarHBondContact O-CB 3.1Å; V321-V325 VanDerWaalsContact O-CG2 3.31Å; V321-V325 WeakPolarHBondContact O-CG2 3.32Å; V321-V325 PolarHBondContact O-N 2.83Å
322	H	92.6	Very high	90.7	Very high	14 Å²	14	19 Å²	19	7%	0.065	10%	0.096	C	C	.	.	H	α-helix	trans	-62.7	-41.3	176.5	-85.1	-82.4	0	0	0	112.8	N60 I61 F318 D319 S326 Y365	N60-H322 PolarHBondContact ND2-CE1 2.95Å; N60-H322 VanDerWaalsContact ND2-CE1 3.28Å; N60-H322 PolarHBondContact ND2-NE2 3.38Å; N60-H322 VanDerWaalsContact ND2-NE2 3.12Å; I61-H322 WeakPolarHBondContact CG1-CE1 3.28Å; F318-H322 AromaticContact CD1-CD2 3.87Å; F318-H322 AromaticContact CE1-CD2 3.51Å; F318-H322 AromaticContact CE1-NE2 3.58Å; F318-H322 AromaticContact CZ-CD2 3.85Å; F318-H322 AromaticContact CZ-NE2 3.46Å; F318-H322 WeakPolarHBondContact CZ-NE2 3.44Å; F318-H322 PolarHBondContact O-N 2.93Å; D319-H322 PolarHBondContact O-N 2.79Å; H322-S326 WeakPolarHBondContact O-CB 3.07Å; H322-S326 PolarHBondContact O-N 2.95Å; H322-S326 PolarHBondContact O-OG 3.29Å; H322-Y365 HydrophobicContact CB-CD1 4.21Å; H322-Y365 HydrophobicContact CB-CE1 3.53Å; H322-Y365 HydrophobicContact CB-CE2 4.34Å; H322-Y365 AromaticContact CG-CZ 3.85Å
323	V	93.8	Very high	90.3	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-64.5	-46.1	176.4	166.7	0	0	0	0	111.7	L148 D319 A320 S326 A327 L360 V363 Y365 I372 F374	L148-V323 HydrophobicContact CD2-CG2 4.41Å; D319-V323 WeakPolarHBondContact O-CG2 3.41Å; D319-V323 PolarHBondContact O-N 3.49Å; A320-V323 PolarHBondContact O-N 2.86Å; V323-S326 PolarHBondContact O-N 2.92Å; V323-A327 PolarHBondContact O-N 3.1Å; V323-A327 VanDerWaalsContact O-N 3.08Å; V323-L360 HydrophobicContact CG1-CD2 4Å; V323-V363 HydrophobicContact CB-CG1 4.5Å; V323-V363 HydrophobicContact CG1-CB 4.36Å; V323-V363 HydrophobicContact CG1-CG1 4.19Å; V323-V363 HydrophobicContact CG1-CG2 4.48Å; V323-V363 HydrophobicContact CG2-CG1 4.28Å; V323-Y365 HydrophobicContact CG2-CD1 4.04Å; V323-I372 HydrophobicContact CG2-CD1 4.22Å; V323-I372 HydrophobicContact CG2-CG2 4.04Å; V323-F374 HydrophobicContact CG1-CE2 3.87Å; V323-F374 HydrophobicContact CG1-CZ 4.16Å
324	V	92.4	Very high	89.8	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-65.1	-44.9	179.1	175.6	0	0	0	0	111.5	M36 V101 V128 A320 V321 S326 A327 V328 L360	M36-V324 HydrophobicContact CG-CG1 4.02Å; M36-V324 HydrophobicContact SD-CB 3.71Å; M36-V324 HydrophobicContact SD-CG1 3.46Å; M36-V324 WeakPolarHBondContact SD-CG1 3.26Å; M36-V324 HydrophobicContact SD-CG2 4.43Å; V101-V324 HydrophobicContact CG2-CG1 4.22Å; V128-V324 HydrophobicContact CG2-CG2 3.73Å; A320-V324 WeakPolarHBondContact O-CG2 3.46Å; A320-V324 PolarHBondContact O-N 2.81Å; V321-V324 PolarHBondContact O-N 2.69Å; V324-S326 VanDerWaalsContact C-N 3.29Å; V324-S326 PolarHBondContact O-N 3.39Å; V324-A327 PolarHBondContact O-N 2.87Å; V324-V328 HydrophobicContact CG1-CG2 4.28Å; V324-V328 WeakPolarHBondContact O-CB 3.45Å; V324-V328 VanDerWaalsContact O-CG2 3.3Å; V324-V328 WeakPolarHBondContact O-CG2 3.31Å; V324-V328 PolarHBondContact O-N 3.44Å; V324-L360 HydrophobicContact CG2-CD2 4.22Å
325	V	90.8	Very high	89.4	Confident	20 Å²	20	33.1 Å²	33.1	12%	0.121	16%	0.159	C	C	.	.	H	α-helix	trans	-62.3	-37.9	177.3	172.8	0	0	0	0	111.4	M36 I61 V73 V321 V328 R329	M36-V325 HydrophobicContact CE-CG2 3.75Å; I61-V325 HydrophobicContact CD1-CB 4.36Å; I61-V325 HydrophobicContact CD1-CG2 4.09Å; I61-V325 HydrophobicContact CG2-CG1 4.03Å; V73-V325 HydrophobicContact CG1-CG2 4.04Å; V73-V325 HydrophobicContact CG2-CG1 4.35Å; V73-V325 HydrophobicContact CG2-CG2 3.78Å; V321-V325 HydrophobicContact CG1-CG2 4.42Å; V321-V325 WeakPolarHBondContact O-CB 3.1Å; V321-V325 VanDerWaalsContact O-CG2 3.31Å; V321-V325 WeakPolarHBondContact O-CG2 3.32Å; V321-V325 PolarHBondContact O-N 2.83Å; V325-V328 PolarHBondContact O-N 2.92Å; V325-R329 WeakPolarHBondContact O-CB 3.39Å; V325-R329 PolarHBondContact O-N 3.21Å
326	S	90.2	Very high	88.4	Confident	40 Å²	40	41.4 Å²	41.4	28%	0.28	20%	0.198	S	C	.	.	H	α-helix	trans	-63.7	-45.2	177	-59.2	0	0	0	0	112.2	H322 V323 V324 V328 R329 E330	H322-S326 WeakPolarHBondContact O-CB 3.07Å; H322-S326 PolarHBondContact O-N 2.95Å; H322-S326 PolarHBondContact O-OG 3.29Å; V323-S326 PolarHBondContact O-N 2.92Å; V324-S326 VanDerWaalsContact C-N 3.29Å; V324-S326 PolarHBondContact O-N 3.39Å; S326-V328 PolarHBondContact O-N 2.82Å; S326-R329 WeakPolarHBondContact O-CB 3.1Å; S326-R329 PolarHBondContact O-N 3.4Å; S326-E330 PolarHBondContact O-N 2.96Å
327	A	90.1	Very high	87.6	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.008	20%	0.2	C	C	.	.	H	α-helix	trans	-64.9	-39.3	175.2	0	0	0	0	0	112.9	V323 V324 R329 E330 L331 L356 L360 V363	V323-A327 PolarHBondContact O-N 3.1Å; V323-A327 VanDerWaalsContact O-N 3.08Å; V324-A327 PolarHBondContact O-N 2.87Å; A327-R329 VanDerWaalsContact C-N 3.32Å; A327-R329 PolarHBondContact O-N 2.87Å; A327-E330 PolarHBondContact O-N 2.78Å; A327-L331 WeakPolarHBondContact O-CB 3.42Å; A327-L331 PolarHBondContact O-N 3.46Å; A327-L356 HydrophobicContact CB-CD1 3.75Å; A327-L360 HydrophobicContact CB-CB 4.26Å; A327-L360 HydrophobicContact CB-CD2 3.57Å; A327-L360 HydrophobicContact CB-CG 3.57Å; A327-V363 HydrophobicContact CB-CG2 3.79Å
328	V	89.1	Confident	86.6	Confident	12 Å²	12	43.4 Å²	43.4	7%	0.073	22%	0.216	C	C	.	.	H	α-helix	trans	-63.8	-38.2	174.9	169.4	0	0	0	0	110.9	V34 V101 V324 V325 S326 N332 I337 L356	V34-V328 HydrophobicContact CG1-CG1 4.09Å; V34-V328 HydrophobicContact CG1-CG2 4.41Å; V34-V328 HydrophobicContact CG2-CG1 3.93Å; V101-V328 HydrophobicContact CB-CG2 4.49Å; V101-V328 HydrophobicContact CG2-CG2 4.15Å; V324-V328 HydrophobicContact CG1-CG2 4.28Å; V324-V328 WeakPolarHBondContact O-CB 3.45Å; V324-V328 VanDerWaalsContact O-CG2 3.3Å; V324-V328 WeakPolarHBondContact O-CG2 3.31Å; V324-V328 PolarHBondContact O-N 3.44Å; V325-V328 PolarHBondContact O-N 2.92Å; S326-V328 PolarHBondContact O-N 2.82Å; V328-N332 VanDerWaalsContact O-CB 3.22Å; V328-N332 WeakPolarHBondContact O-CB 3.38Å; V328-N332 PolarHBondContact O-N 2.86Å; V328-I337 HydrophobicContact CG1-CD1 3.87Å; V328-L356 HydrophobicContact CG2-CD1 3.84Å; V328-L356 HydrophobicContact CG2-CD2 3.82Å
329	R	85.9	Confident	85.8	Confident	122 Å²	122	45.8 Å²	45.8	46%	0.46	23%	0.23	S	C	.	.	H	α-helix	trans	-62.3	-45	177.5	-169.6	-177.6	-162.1	174.5	5.7	112.3	V325 S326 A327 N332 R333	V325-R329 WeakPolarHBondContact O-CB 3.39Å; V325-R329 PolarHBondContact O-N 3.21Å; S326-R329 WeakPolarHBondContact O-CB 3.1Å; S326-R329 PolarHBondContact O-N 3.4Å; A327-R329 VanDerWaalsContact C-N 3.32Å; A327-R329 PolarHBondContact O-N 2.87Å; R329-N332 PolarHBondContact O-N 2.96Å; R329-R333 PolarHBondContact O-N 3.2Å
330	E	86.4	Confident	85	Confident	74 Å²	74	50.7 Å²	50.7	35%	0.346	25%	0.252	S	S	.	.	H	α-helix	trans	-76.8	-31	179.5	-62.9	-44.9	115.9	0	0	113.3	S326 A327 R333 Y359	S326-E330 PolarHBondContact O-N 2.96Å; A327-E330 PolarHBondContact O-N 2.78Å; E330-R333 PolarHBondContact O-N 2.82Å; E330-R333 IonicContact OE1-CZ 3.32Å; E330-R333 IonicContact OE1-NH1 2.65Å; E330-R333 PolarHBondContact OE1-NH1 3.21Å; E330-R333 WeakPolarHBondContact OE2-CD 3.39Å; E330-R333 IonicContact OE2-NH1 2.7Å; E330-R333 PolarHBondContact OE2-NH1 2.66Å; E330-Y359 HydrophobicContact CB-CD1 3.73Å; E330-Y359 HydrophobicContact CB-CE1 3.86Å
331	L	86.1	Confident	84.5	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-65.3	-43.3	168.1	177.9	60.8	0	0	0	111.4	A327 R333 S334 Q335 I337 L356 Y359	A327-L331 WeakPolarHBondContact O-CB 3.42Å; A327-L331 PolarHBondContact O-N 3.46Å; L331-R333 PolarHBondContact O-N 3.1Å; L331-R333 VanDerWaalsContact O-N 3.15Å; L331-S334 PolarHBondContact O-N 2.82Å; L331-S334 PolarHBondContact O-OG 3.11Å; L331-Q335 HydrophobicContact CD1-CB 4.09Å; L331-Q335 HydrophobicContact CD1-CG 4.29Å; L331-Q335 PolarHBondContact O-N 2.97Å; L331-Q335 VanDerWaalsContact O-O 3.14Å; L331-I337 HydrophobicContact CB-CD1 4.01Å; L331-I337 HydrophobicContact CD2-CD1 3.8Å; L331-I337 HydrophobicContact CD2-CG1 3.97Å; L331-I337 HydrophobicContact CG-CD1 3.79Å; L331-I337 HydrophobicContact CG-CG1 3.89Å; L331-L356 HydrophobicContact CB-CD1 4.39Å; L331-L356 HydrophobicContact CD2-CB 3.78Å; L331-L356 HydrophobicContact CD2-CD1 4.09Å; L331-L356 HydrophobicContact CD2-CG 4.45Å; L331-Y359 HydrophobicContact CB-CD2 3.77Å; L331-Y359 HydrophobicContact CB-CE2 4.07Å; L331-Y359 HydrophobicContact CB-CG 4.27Å; L331-Y359 HydrophobicContact CD1-CD2 3.82Å; L331-Y359 HydrophobicContact CD1-CE2 3.63Å; L331-Y359 HydrophobicContact CG-CD2 4.33Å; L331-Y359 HydrophobicContact CG-CE2 4.45Å
332	N	83.9	Confident	84.3	Confident	86 Å²	86	55.6 Å²	55.6	46%	0.46	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-12.5	179.8	-163.4	52.9	0	0	0	113.3	V328 R329 Q335 I337	V328-N332 VanDerWaalsContact O-CB 3.22Å; V328-N332 WeakPolarHBondContact O-CB 3.38Å; V328-N332 PolarHBondContact O-N 2.86Å; R329-N332 PolarHBondContact O-N 2.96Å; N332-Q335 WeakPolarHBondContact CA-O 3.36Å; N332-I337 HydrophobicContact CB-CD1 3.85Å; N332-I337 HydrophobicContact CB-CG1 4.31Å
333	R	82.6	Confident	84	Confident	174 Å²	174	57.1 Å²	57.1	66%	0.657	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-19	169.2	-79.4	171.4	147.6	159.8	-6.4	113.6	R329 E330 L331	R329-R333 PolarHBondContact O-N 3.2Å; E330-R333 PolarHBondContact O-N 2.82Å; E330-R333 IonicContact OE1-CZ 3.32Å; E330-R333 IonicContact OE1-NH1 2.65Å; E330-R333 PolarHBondContact OE1-NH1 3.21Å; E330-R333 WeakPolarHBondContact OE2-CD 3.39Å; E330-R333 IonicContact OE2-NH1 2.7Å; E330-R333 PolarHBondContact OE2-NH1 2.66Å; L331-R333 PolarHBondContact O-N 3.1Å; L331-R333 VanDerWaalsContact O-N 3.15Å
334	S	79.6	Confident	83.7	Confident	66 Å²	66	58.7 Å²	58.7	46%	0.462	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.4	-25.7	-176.6	69	0	0	0	0	114.5	L331 Y359	L331-S334 PolarHBondContact O-N 2.82Å; L331-S334 PolarHBondContact O-OG 3.11Å; S334-Y359 WeakPolarHBondContact CB-OH 3.45Å; S334-Y359 PolarHBondContact OG-OH 3.25Å
335	Q	80.1	Confident	83.4	Confident	85 Å²	85	65 Å²	65	40%	0.397	34%	0.344	S	S	.	.	S	Bend	trans	-144.8	134.5	179.3	-60.5	-177.1	-0.9	0	0	110.4	L331 N332 I337 S355	L331-Q335 HydrophobicContact CD1-CB 4.09Å; L331-Q335 HydrophobicContact CD1-CG 4.29Å; L331-Q335 PolarHBondContact O-N 2.97Å; L331-Q335 VanDerWaalsContact O-O 3.14Å; N332-Q335 WeakPolarHBondContact CA-O 3.36Å; Q335-I337 PolarHBondContact O-N 3.45Å; Q335-S355 PolarHBondContact OE1-OG 3.24Å
336	E	71.9	Confident	83.2	Confident	174 Å²	174	65.2 Å²	65.2	81%	0.813	35%	0.347	S	S	*	.			trans	-64.5	121.4	168.9	-67.6	-174.3	169.5	0	0	109.9	G338 H352	E336-G338 PolarHBondContact O-N 3.39Å; E336-H352 PolarHBondContact O-CE1 2.87Å
337	I	75.7	Confident	82.9	Confident	11 Å²	11	69.2 Å²	69.2	6%	0.056	37%	0.372	C	S	.	.			trans	-84.9	104	-172.7	-57.4	177.3	0	0	0	110.7	L31 V328 L331 N332 Q335 V339 W350	L31-I337 HydrophobicContact CD1-CB 4.39Å; L31-I337 HydrophobicContact CD1-CG2 4.27Å; L31-I337 VanDerWaalsContact CD1-O 3.31Å; L31-I337 WeakPolarHBondContact CD1-O 3.34Å; V328-I337 HydrophobicContact CG1-CD1 3.87Å; L331-I337 HydrophobicContact CB-CD1 4.01Å; L331-I337 HydrophobicContact CD2-CD1 3.8Å; L331-I337 HydrophobicContact CD2-CG1 3.97Å; L331-I337 HydrophobicContact CG-CD1 3.79Å; L331-I337 HydrophobicContact CG-CG1 3.89Å; N332-I337 HydrophobicContact CB-CD1 3.85Å; N332-I337 HydrophobicContact CB-CG1 4.31Å; Q335-I337 PolarHBondContact O-N 3.45Å; I337-V339 HydrophobicContact CG2-CG2 4.31Å; I337-W350 HydrophobicContact CG2-CH2 4.47Å; I337-W350 HydrophobicContact CG2-CZ2 3.83Å
338	G	71.3	Confident	82.8	Confident	32 Å²	32	74.4 Å²	74.4	33%	0.33	40%	0.398	S	S	.	.			trans	-86.6	104.6	170.4	0	0	0	0	0	112.4	E336 W350 H352	E336-G338 PolarHBondContact O-N 3.39Å; G338-W350 PolarHBondContact O-NE1 3.27Å; G338-H352 PolarHBondContact N-NE2 2.98Å
339	V	75.9	Confident	82.7	Confident	50 Å²	50	77.4 Å²	77.4	30%	0.303	41%	0.413	S	S	.	.			trans	-80.1	132.6	170.5	-178	0	0	0	0	109.8	L31 G99 V101 I337 W350	L31-V339 HydrophobicContact CD1-CG2 3.62Å; G99-V339 VanDerWaalsContact C-CG1 3.48Å; V101-V339 HydrophobicContact CG1-CG2 3.66Å; I337-V339 HydrophobicContact CG2-CG2 4.31Å; V339-W350 HydrophobicContact CG2-CZ2 4.3Å
340	K	78.4	Confident	82.8	Confident	104 Å²	104	71.9 Å²	71.9	45%	0.452	39%	0.392	S	S	.	.			trans	-123.5	135.3	-179.8	-67	179.8	179.5	178	0	109.8
341	P	85	Confident	82.7	Confident	90 Å²	90	74.6 Å²	74.6	58%	0.584	41%	0.405	S	S	*	.			trans	-68.6	136.7	172.7	30.7	-34.8	0	0	0	109.6	P97	P97-P341 VanDerWaalsContact O-CB 3.23Å; P97-P341 WeakPolarHBondContact O-CB 3.46Å
342	L	87.9	Confident	82.8	Confident	13 Å²	13	76.4 Å²	76.4	7%	0.068	41%	0.414	C	S	.	.			trans	-119.4	164.8	-179.9	-63.4	-177.1	0	0	0	111	L96 P97 K123 I125 L348 W350	L96-L342 CarbonylContact C-O 3.58Å; L96-L342 HydrophobicContact CB-CB 4.31Å; L96-L342 WeakPolarHBondContact CB-O 2.99Å; L96-L342 HydrophobicContact CD2-CB 4.4Å; L96-L342 PolarHBondContact O-N 3Å; P97-L342 WeakPolarHBondContact CA-O 3.49Å; K123-L342 HydrophobicContact CB-CD1 4Å; I125-L342 HydrophobicContact CD1-CD1 4.37Å; L342-L348 HydrophobicContact CD2-CB 3.9Å; L342-W350 HydrophobicContact CD1-CB 4.25Å
343	S	88.2	Confident	82.9	Confident	46 Å²	46	72.3 Å²	72.3	32%	0.322	39%	0.392	S	S	.	.			trans	-123.1	140.7	171.1	172.1	0	0	0	0	110.6	T345 S346	S343-T345 PolarHBondContact O-N 3.19Å; S343-T345 PolarHBondContact OG-N 3.48Å; S343-T345 PolarHBondContact OG-OG1 2.84Å; S343-S346 PolarHBondContact N-OG 3.13Å; S343-S346 PolarHBondContact O-N 3.45Å; S343-S346 PolarHBondContact O-OG 3.21Å
344	C	86.1	Confident	83.1	Confident	32 Å²	32	67.1 Å²	67.1	22%	0.216	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.7	-44.7	170	-80.9	0	0	0	0	112.4	C93 L96 K123 S346	C93-C344 WeakPolarHBondContact CA-SG 3.25Å; C93-C344 HydrophobicContact CB-CB 3.99Å; C93-C344 WeakPolarHBondContact CB-SG 3.27Å; C93-C344 WeakPolarHBondContact SG-CB 3.36Å; C93-C344 CovalentContact SG-SG 2.04Å; C93-C344 PolarHBondContact SG-SG 2.93Å; L96-C344 HydrophobicContact CD1-CB 4.45Å; K123-C344 WeakPolarHBondContact CE-O 3.29Å; K123-C344 PolarHBondContact NZ-O 3.36Å; C344-S346 VanDerWaalsContact C-N 3.3Å; C344-S346 PolarHBondContact O-N 2.97Å
345	T	87.1	Confident	83.5	Confident	134 Å²	134	65.4 Å²	65.4	82%	0.822	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-8.5	-176.5	55.9	0	0	0	0	114.2	S343	S343-T345 PolarHBondContact O-N 3.19Å; S343-T345 PolarHBondContact OG-N 3.48Å; S343-T345 PolarHBondContact OG-OG1 2.84Å
346	S	86.8	Confident	83.9	Confident	24 Å²	24	61.4 Å²	61.4	17%	0.168	35%	0.349	C	S	.	.	S	Bend	trans	-93.9	140.3	-179.5	69.9	0	0	0	0	111.8	K123 S343 C344 L348	K123-S346 PolarHBondContact NZ-O 2.85Å; S343-S346 PolarHBondContact N-OG 3.13Å; S343-S346 PolarHBondContact O-N 3.45Å; S343-S346 PolarHBondContact O-OG 3.21Å; C344-S346 VanDerWaalsContact C-N 3.3Å; C344-S346 PolarHBondContact O-N 2.97Å; S346-L348 PolarHBondContact O-N 2.83Å; S346-L348 VanDerWaalsContact O-N 3.09Å
347	P	84.1	Confident	84.7	Confident	124 Å²	124	53.3 Å²	53.3	81%	0.805	31%	0.311	S	S	*	.			trans	-79.4	22.8	174	35.7	-37.5	0	0	0	112.6
348	L	86.8	Confident	85.4	Confident	109 Å²	109	56.8 Å²	56.8	57%	0.571	33%	0.33	S	S	*	.			trans	-87.9	130.2	-179.4	-65.7	174.9	0	0	0	110	L342 S346	L342-L348 HydrophobicContact CD2-CB 3.9Å; S346-L348 PolarHBondContact O-N 2.83Å; S346-L348 VanDerWaalsContact O-N 3.09Å
349	I	88.1	Confident	86.3	Confident	76 Å²	76	58.3 Å²	58.3	39%	0.39	33%	0.326	S	S	.	.			trans	-104.8	159.1	176.5	60	168	0	0	0	111	E122 K123 E124 Q351	E122-I349 WeakPolarHBondContact O-CG2 3.38Å; K123-I349 WeakPolarHBondContact O-CA 3.31Å; E124-I349 HydrophobicContact CB-CB 4.44Å; E124-I349 HydrophobicContact CG-CB 4.34Å; E124-I349 HydrophobicContact CG-CG2 4.41Å; E124-I349 WeakPolarHBondContact OE1-CD1 3.37Å; I349-Q351 PolarHBondContact O-N 2.8Å
350	W	88	Confident	86.9	Confident	5 Å²	5	55.9 Å²	55.9	2%	0.019	31%	0.311	C	S	.	.			trans	-83.5	114.4	173	-176.5	41.9	0	0	0	111.7	V101 K123 I337 G338 V339 L342 H352 G353 L356	V101-W350 HydrophobicContact CB-CH2 3.99Å; V101-W350 HydrophobicContact CG1-CH2 4.15Å; V101-W350 HydrophobicContact CG1-CZ2 4.46Å; V101-W350 WeakPolarHBondContact O-CZ3 3.46Å; K123-W350 PolarHBondContact O-N 3.08Å; I337-W350 HydrophobicContact CG2-CH2 4.47Å; I337-W350 HydrophobicContact CG2-CZ2 3.83Å; G338-W350 PolarHBondContact O-NE1 3.27Å; V339-W350 HydrophobicContact CG2-CZ2 4.3Å; L342-W350 HydrophobicContact CD1-CB 4.25Å; W350-H352 HydrophobicContact CZ2-CB 4Å; W350-H352 AromaticContact NE1-CD2 3.95Å; W350-H352 PolarHBondContact O-N 3.01Å; W350-H352 VanDerWaalsContact O-N 3.09Å; W350-G353 PolarHBondContact O-N 2.82Å; W350-L356 HydrophobicContact CH2-CD2 3.75Å; W350-L356 HydrophobicContact CZ3-CB 4.41Å; W350-L356 HydrophobicContact CZ3-CD2 3.87Å
351	Q	84.4	Confident	87.4	Confident	132 Å²	132	54 Å²	54	62%	0.617	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-19	-170.2	-63.7	176.6	-71.7	0	0	115.5	I349	I349-Q351 PolarHBondContact O-N 2.8Å
352	H	86.8	Confident	87.6	Confident	38 Å²	38	55.8 Å²	55.8	18%	0.176	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	0.2	174.8	-57.1	-88.6	0	0	0	112.9	E336 G338 W350 S355 L356	E336-H352 PolarHBondContact O-CE1 2.87Å; G338-H352 PolarHBondContact N-NE2 2.98Å; W350-H352 HydrophobicContact CZ2-CB 4Å; W350-H352 AromaticContact NE1-CD2 3.95Å; W350-H352 PolarHBondContact O-N 3.01Å; W350-H352 VanDerWaalsContact O-N 3.09Å; H352-S355 WeakPolarHBondContact O-CB 3.31Å; H352-S355 PolarHBondContact O-N 3.43Å; H352-S355 VanDerWaalsContact O-N 3.14Å; H352-L356 PolarHBondContact O-N 2.96Å
353	G	86.3	Confident	87.8	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-58.6	-52.1	-174.9	0	0	0	0	0	113.8	E124 W350 S355 L356 M357	E124-G353 WeakPolarHBondContact O-CA 3.42Å; W350-G353 PolarHBondContact O-N 2.82Å; G353-S355 VanDerWaalsContact C-N 3.3Å; G353-S355 PolarHBondContact O-N 2.61Å; G353-L356 PolarHBondContact O-N 3.13Å; G353-M357 WeakPolarHBondContact O-CB 3.18Å; G353-M357 PolarHBondContact O-N 3.36Å
354	T	86.6	Confident	88	Confident	64 Å²	64	61 Å²	61	39%	0.393	32%	0.323	S	S	.	.	H	α-helix	trans	-62.3	-34.7	174.2	-72.5	0	0	0	0	112.5	E124 N358	E124-T354 WeakPolarHBondContact OE2-CB 3.41Å; E124-T354 PolarHBondContact OE2-OG1 2.89Å; T354-N358 PolarHBondContact O-N 2.78Å; T354-N358 VanDerWaalsContact O-N 3.16Å; T354-N358 PolarHBondContact O-ND2 2.96Å
355	S	88.4	Confident	88.2	Confident	31 Å²	31	61.5 Å²	61.5	22%	0.217	32%	0.321	C	S	.	.	H	α-helix	trans	-62.8	-50.7	172.6	-56.7	0	0	0	0	111.5	Q335 H352 G353 M357 N358 Y359	Q335-S355 PolarHBondContact OE1-OG 3.24Å; H352-S355 WeakPolarHBondContact O-CB 3.31Å; H352-S355 PolarHBondContact O-N 3.43Å; H352-S355 VanDerWaalsContact O-N 3.14Å; G353-S355 VanDerWaalsContact C-N 3.3Å; G353-S355 PolarHBondContact O-N 2.61Å; S355-M357 VanDerWaalsContact C-N 3.33Å; S355-M357 PolarHBondContact O-N 3.43Å; S355-N358 PolarHBondContact O-N 2.81Å; S355-Y359 WeakPolarHBondContact O-CD2 3.49Å; S355-Y359 PolarHBondContact O-N 2.98Å; S355-Y359 VanDerWaalsContact O-N 3.13Å
356	L	89.1	Confident	88.5	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-65.5	-36	-179.3	-174.7	56.3	0	0	0	112.1	V101 P126 A327 V328 L331 W350 H352 G353 N358 Y359 L360	V101-L356 HydrophobicContact CB-CD2 4.28Å; P126-L356 HydrophobicContact CG-CB 4.26Å; P126-L356 HydrophobicContact CG-CD2 4.14Å; P126-L356 HydrophobicContact CG-CG 4.14Å; A327-L356 HydrophobicContact CB-CD1 3.75Å; V328-L356 HydrophobicContact CG2-CD1 3.84Å; V328-L356 HydrophobicContact CG2-CD2 3.82Å; L331-L356 HydrophobicContact CB-CD1 4.39Å; L331-L356 HydrophobicContact CD2-CB 3.78Å; L331-L356 HydrophobicContact CD2-CD1 4.09Å; L331-L356 HydrophobicContact CD2-CG 4.45Å; W350-L356 HydrophobicContact CH2-CD2 3.75Å; W350-L356 HydrophobicContact CZ3-CB 4.41Å; W350-L356 HydrophobicContact CZ3-CD2 3.87Å; H352-L356 PolarHBondContact O-N 2.96Å; G353-L356 PolarHBondContact O-N 3.13Å; L356-N358 VanDerWaalsContact C-N 3.31Å; L356-N358 PolarHBondContact O-N 2.85Å; L356-Y359 PolarHBondContact O-N 2.79Å; L356-L360 HydrophobicContact CG-CD1 4.19Å; L356-L360 HydrophobicContact CG-CG 4.48Å; L356-L360 WeakPolarHBondContact O-CB 3.48Å; L356-L360 WeakPolarHBondContact O-CG 3.38Å; L356-L360 PolarHBondContact O-N 2.87Å
357	M	88.9	Confident	88.7	Confident	4 Å²	4	58.8 Å²	58.8	2%	0.02	30%	0.299	C	S	.	.	H	α-helix	trans	-61.4	-37.6	173.7	179	52.3	64	0	0	112.5	P126 F143 A144 V146 G353 S355 R361	P126-M357 HydrophobicContact CB-CE 3.93Å; P126-M357 HydrophobicContact CG-CE 4.37Å; F143-M357 HydrophobicContact CD1-CE 4.33Å; F143-M357 HydrophobicContact CE1-CE 3.59Å; F143-M357 HydrophobicContact CE2-CB 3.83Å; F143-M357 HydrophobicContact CE2-CG 4.21Å; F143-M357 HydrophobicContact CZ-CB 3.76Å; F143-M357 HydrophobicContact CZ-CE 3.82Å; F143-M357 HydrophobicContact CZ-CG 4.15Å; A144-M357 VanDerWaalsContact O-CE 3.25Å; A144-M357 WeakPolarHBondContact O-CE 3.49Å; A144-M357 VanDerWaalsContact O-SD 3.36Å; V146-M357 HydrophobicContact CG2-CE 4.28Å; V146-M357 HydrophobicContact CG2-SD 3.84Å; G353-M357 WeakPolarHBondContact O-CB 3.18Å; G353-M357 PolarHBondContact O-N 3.36Å; S355-M357 VanDerWaalsContact C-N 3.33Å; S355-M357 PolarHBondContact O-N 3.43Å; M357-R361 WeakPolarHBondContact O-CG 3.31Å; M357-R361 PolarHBondContact O-N 3.01Å; M357-R361 HydrophobicContact SD-CG 4.41Å; M357-R361 PolarHBondContact SD-NE 3.23Å
358	N	88.8	Confident	89.1	Confident	84 Å²	84	52.9 Å²	52.9	45%	0.449	26%	0.261	S	S	.	.	H	α-helix	trans	-68.1	-43.7	174.5	-69.2	-28.9	0	0	0	111.5	T354 S355 L356 R361 M362	T354-N358 PolarHBondContact O-N 2.78Å; T354-N358 VanDerWaalsContact O-N 3.16Å; T354-N358 PolarHBondContact O-ND2 2.96Å; S355-N358 PolarHBondContact O-N 2.81Å; L356-N358 VanDerWaalsContact C-N 3.31Å; L356-N358 PolarHBondContact O-N 2.85Å; N358-R361 PolarHBondContact O-N 3.2Å; N358-M362 WeakPolarHBondContact O-CG 3.04Å; N358-M362 PolarHBondContact O-N 3.26Å
359	Y	90.1	Very high	89.4	Confident	64 Å²	64	47.9 Å²	47.9	25%	0.251	24%	0.235	S	C	.	.	H	α-helix	trans	-62.5	-40.6	174.5	-82.3	-77	0	0	0	112.6	E330 L331 S334 S355 L356 R361 M362 V363	E330-Y359 HydrophobicContact CB-CD1 3.73Å; E330-Y359 HydrophobicContact CB-CE1 3.86Å; L331-Y359 HydrophobicContact CB-CD2 3.77Å; L331-Y359 HydrophobicContact CB-CE2 4.07Å; L331-Y359 HydrophobicContact CB-CG 4.27Å; L331-Y359 HydrophobicContact CD1-CD2 3.82Å; L331-Y359 HydrophobicContact CD1-CE2 3.63Å; L331-Y359 HydrophobicContact CG-CD2 4.33Å; L331-Y359 HydrophobicContact CG-CE2 4.45Å; S334-Y359 WeakPolarHBondContact CB-OH 3.45Å; S334-Y359 PolarHBondContact OG-OH 3.25Å; S355-Y359 WeakPolarHBondContact O-CD2 3.49Å; S355-Y359 PolarHBondContact O-N 2.98Å; S355-Y359 VanDerWaalsContact O-N 3.13Å; L356-Y359 PolarHBondContact O-N 2.79Å; Y359-R361 VanDerWaalsContact C-N 3.29Å; Y359-R361 PolarHBondContact O-N 2.95Å; Y359-M362 HydrophobicContact CD1-CE 4Å; Y359-M362 HydrophobicContact CE1-CE 4.33Å; Y359-M362 HydrophobicContact CG-CE 4.36Å; Y359-M362 CarbonylContact O-C 3.38Å; Y359-M362 WeakPolarHBondContact O-CA 3.22Å; Y359-M362 PolarHBondContact O-N 2.63Å; Y359-V363 PolarHBondContact O-N 2.73Å
360	L	90.1	Very high	89.5	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-57.6	-38.1	175.4	-82.8	164.5	0	0	0	113	P126 V146 V323 V324 A327 L356 M362 V363 F374	P126-L360 HydrophobicContact CB-CD1 3.39Å; P126-L360 HydrophobicContact CG-CD1 3.82Å; V146-L360 HydrophobicContact CG2-CB 4.35Å; V323-L360 HydrophobicContact CG1-CD2 4Å; V324-L360 HydrophobicContact CG2-CD2 4.22Å; A327-L360 HydrophobicContact CB-CB 4.26Å; A327-L360 HydrophobicContact CB-CD2 3.57Å; A327-L360 HydrophobicContact CB-CG 3.57Å; L356-L360 HydrophobicContact CG-CD1 4.19Å; L356-L360 HydrophobicContact CG-CG 4.48Å; L356-L360 WeakPolarHBondContact O-CB 3.48Å; L356-L360 WeakPolarHBondContact O-CG 3.38Å; L356-L360 PolarHBondContact O-N 2.87Å; L360-M362 PolarHBondContact O-N 2.95Å; L360-V363 PolarHBondContact O-N 2.76Å; L360-F374 VanDerWaalsContact O-CD2 3.27Å; L360-F374 WeakPolarHBondContact O-CD2 3.46Å
361	R	89.1	Confident	89.7	Confident	63 Å²	63	47 Å²	47	24%	0.238	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-7.3	176.3	-66.2	177.7	-164	-179.1	9.2	113.9	A144 M357 N358 Y359 S376	A144-R361 PolarHBondContact O-NH2 2.96Å; M357-R361 WeakPolarHBondContact O-CG 3.31Å; M357-R361 PolarHBondContact O-N 3.01Å; M357-R361 HydrophobicContact SD-CG 4.41Å; M357-R361 PolarHBondContact SD-NE 3.23Å; N358-R361 PolarHBondContact O-N 3.2Å; Y359-R361 VanDerWaalsContact C-N 3.29Å; Y359-R361 PolarHBondContact O-N 2.95Å; R361-S376 PolarHBondContact NH1-O 3.35Å
362	M	88.7	Confident	90.2	Very high	129 Å²	129	40.7 Å²	40.7	64%	0.635	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-111.5	14.5	175.5	-59.5	-176.8	-59.6	0	0	112	N358 Y359 L360 E364	N358-M362 WeakPolarHBondContact O-CG 3.04Å; N358-M362 PolarHBondContact O-N 3.26Å; Y359-M362 HydrophobicContact CD1-CE 4Å; Y359-M362 HydrophobicContact CE1-CE 4.33Å; Y359-M362 HydrophobicContact CG-CE 4.36Å; Y359-M362 CarbonylContact O-C 3.38Å; Y359-M362 WeakPolarHBondContact O-CA 3.22Å; Y359-M362 PolarHBondContact O-N 2.63Å; L360-M362 PolarHBondContact O-N 2.95Å; M362-E364 PolarHBondContact O-N 3.11Å
363	V	90.8	Very high	90.4	Very high	10 Å²	10	41.9 Å²	41.9	6%	0.061	21%	0.207	C	C	.	.			trans	-79.4	119.2	171.7	175.7	0	0	0	0	109.4	V323 A327 Y359 L360	V323-V363 HydrophobicContact CB-CG1 4.5Å; V323-V363 HydrophobicContact CG1-CB 4.36Å; V323-V363 HydrophobicContact CG1-CG1 4.19Å; V323-V363 HydrophobicContact CG1-CG2 4.48Å; V323-V363 HydrophobicContact CG2-CG1 4.28Å; A327-V363 HydrophobicContact CB-CG2 3.79Å; Y359-V363 PolarHBondContact O-N 2.73Å; L360-V363 PolarHBondContact O-N 2.76Å
364	E	92.4	Very high	90.6	Very high	157 Å²	157	42.4 Å²	42.4	73%	0.734	21%	0.209	S	C	*	.			trans	-98.7	124.1	159.3	-67.1	170	-159.2	0	0	107.7	M362 I372	M362-E364 PolarHBondContact O-N 3.11Å; E364-I372 WeakPolarHBondContact CA-O 3.15Å
365	Y	91.8	Very high	90.6	Very high	44 Å²	44	41.5 Å²	41.5	17%	0.173	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	135	179.7	177.7	-117.4	0	0	0	112	H322 V323 I372	H322-Y365 HydrophobicContact CB-CD1 4.21Å; H322-Y365 HydrophobicContact CB-CE1 3.53Å; H322-Y365 HydrophobicContact CB-CE2 4.34Å; H322-Y365 AromaticContact CG-CZ 3.85Å; V323-Y365 HydrophobicContact CG2-CD1 4.04Å; Y365-I372 HydrophobicContact CD1-CD1 3.86Å; Y365-I372 PolarHBondContact N-O 3.05Å; Y365-I372 WeakPolarHBondContact O-CB 3.39Å; Y365-I372 PolarHBondContact O-N 3.14Å
366	D	92.3	Very high	90.4	Very high	100 Å²	100	45 Å²	45	54%	0.535	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	104.5	173.4	-69.9	-39.1	0	0	0	110.1	H371	D366-H371 WeakPolarHBondContact OD1-CA 3.24Å; D366-H371 IonicContact OD1-CE1 3.8Å; D366-H371 IonicContact OD1-CG 3.97Å; D366-H371 IonicContact OD1-ND1 2.84Å; D366-H371 PolarHBondContact OD1-ND1 3.5Å
367	G	91.5	Very high	90	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	-170.6	-175.3	0	0	0	0	0	115.2	D319 T369 G370	D319-G367 VanDerWaalsContact OD1-CA 3.32Å; D319-G367 WeakPolarHBondContact OD1-CA 3.26Å; G367-T369 PolarHBondContact O-N 3.31Å; G367-G370 PolarHBondContact N-O 2.81Å; G367-G370 PolarHBondContact O-N 2.92Å
368	L	92.1	Very high	89.7	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-22.1	171.7	-67.1	176.3	0	0	0	112.3	N281 H284 Y287 F290 A315 F318 D319	N281-L368 PolarHBondContact N-O 3.42Å; H284-L368 HydrophobicContact CB-CD2 4.49Å; H284-L368 WeakPolarHBondContact ND1-CD2 3.39Å; Y287-L368 HydrophobicContact CD2-CD2 4.2Å; F290-L368 HydrophobicContact CB-CD1 4.39Å; F290-L368 HydrophobicContact CD1-CD1 3.81Å; F290-L368 HydrophobicContact CD2-CD1 3.7Å; F290-L368 HydrophobicContact CE1-CD1 3.85Å; F290-L368 HydrophobicContact CE2-CD1 3.75Å; F290-L368 HydrophobicContact CG-CD1 3.72Å; F290-L368 HydrophobicContact CZ-CD1 3.82Å; A315-L368 HydrophobicContact CB-CB 4.13Å; F318-L368 HydrophobicContact CB-CD1 3.96Å; F318-L368 HydrophobicContact CD1-CD1 3.39Å; F318-L368 HydrophobicContact CD1-CG 3.81Å; F318-L368 HydrophobicContact CD2-CD1 4.26Å; F318-L368 HydrophobicContact CE1-CD1 3.86Å; F318-L368 HydrophobicContact CE1-CG 4.03Å; F318-L368 HydrophobicContact CG-CD1 3.62Å; F318-L368 HydrophobicContact CZ-CD1 4.47Å; D319-L368 PolarHBondContact OD1-N 2.9Å; D319-L368 PolarHBondContact OD2-N 3.22Å
369	T	92.5	Very high	89.7	Confident	4 Å²	4	48 Å²	48	3%	0.025	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	17.9	171.1	63.8	0	0	0	0	113.6	M279 L312 A315 L316 D319 G367 R380	M279-T369 CarbonylContact O-C 3.46Å; M279-T369 VanDerWaalsContact O-CA 3.29Å; M279-T369 WeakPolarHBondContact O-CA 3.29Å; L312-T369 HydrophobicContact CD1-CG2 3.73Å; A315-T369 HydrophobicContact CB-CG2 3.78Å; L316-T369 HydrophobicContact CD2-CG2 3.75Å; L316-T369 HydrophobicContact CG-CG2 4.14Å; D319-T369 WeakPolarHBondContact OD2-CB 3.22Å; D319-T369 WeakPolarHBondContact OD2-CG2 3.35Å; D319-T369 PolarHBondContact OD2-N 3.04Å; D319-T369 PolarHBondContact OD2-OG1 2.91Å; G367-T369 PolarHBondContact O-N 3.31Å; T369-R380 PolarHBondContact O-NH2 3.47Å; T369-R380 PolarHBondContact OG1-NH1 2.96Å; T369-R380 PolarHBondContact OG1-NH2 2.81Å
370	G	91.6	Very high	89.7	Confident	7 Å²	7	45.1 Å²	45.1	7%	0.072	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	80.1	-156.5	-178.3	0	0	0	0	0	113	G367	G367-G370 PolarHBondContact N-O 2.81Å; G367-G370 PolarHBondContact O-N 2.92Å
371	H	92.8	Very high	89.7	Confident	55 Å²	55	46.7 Å²	46.7	26%	0.255	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	135.9	-175.4	-164.6	65.6	0	0	0	112.5	D366 R380	D366-H371 WeakPolarHBondContact OD1-CA 3.24Å; D366-H371 IonicContact OD1-CE1 3.8Å; D366-H371 IonicContact OD1-CG 3.97Å; D366-H371 IonicContact OD1-ND1 2.84Å; D366-H371 PolarHBondContact OD1-ND1 3.5Å; H371-R380 PolarHBondContact O-NE 3.45Å; H371-R380 PolarHBondContact O-NH2 2.88Å
372	I	93.2	Very high	89.7	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	113.6	179.4	-63.9	156.5	0	0	0	108	L148 D319 V323 E364 Y365 F374 R380	L148-I372 HydrophobicContact CD2-CD1 4.04Å; L148-I372 HydrophobicContact CD2-CG1 4.14Å; L148-I372 HydrophobicContact CD2-CG2 3.68Å; D319-I372 HydrophobicContact CB-CD1 3.82Å; V323-I372 HydrophobicContact CG2-CD1 4.22Å; V323-I372 HydrophobicContact CG2-CG2 4.04Å; E364-I372 WeakPolarHBondContact CA-O 3.15Å; Y365-I372 HydrophobicContact CD1-CD1 3.86Å; Y365-I372 PolarHBondContact N-O 3.05Å; Y365-I372 WeakPolarHBondContact O-CB 3.39Å; Y365-I372 PolarHBondContact O-N 3.14Å; I372-F374 HydrophobicContact CG2-CE1 4.02Å; I372-F374 HydrophobicContact CG2-CE2 3.67Å; I372-F374 HydrophobicContact CG2-CZ 3.37Å; I372-R380 VanDerWaalsContact CG1-CZ 3.43Å; I372-R380 VanDerWaalsContact CG1-NH2 3.29Å
373	E	92.4	Very high	89.8	Confident	64 Å²	64	42.1 Å²	42.1	30%	0.299	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	152.9	171.7	-169.8	-154.1	114.3	0	0	106.8	R380 T381 N382	E373-R380 CarbonylContact O-C 3.52Å; E373-R380 VanDerWaalsContact O-CA 3.28Å; E373-R380 WeakPolarHBondContact O-CA 3.22Å; E373-T381 PolarHBondContact O-N 2.76Å; E373-T381 PolarHBondContact OE1-OG1 3.38Å; E373-N382 HydrophobicContact CB-CB 4.24Å; E373-N382 WeakPolarHBondContact OE2-CB 3.31Å; E373-N382 PolarHBondContact OE2-ND2 3.45Å
374	F	90.7	Very high	89.8	Confident	10 Å²	10	44.3 Å²	44.3	4%	0.044	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	136.5	179.2	-55.9	-72.9	0	0	0	112.8	V146 T147 L148 V323 L360 I372 Q379 R380	V146-F374 HydrophobicContact CG1-CD1 3.47Å; V146-F374 VanDerWaalsContact CG1-CD1 3.47Å; V146-F374 HydrophobicContact CG1-CD2 4.09Å; V146-F374 HydrophobicContact CG1-CE1 3.23Å; V146-F374 HydrophobicContact CG1-CE2 3.87Å; V146-F374 HydrophobicContact CG1-CG 3.89Å; V146-F374 HydrophobicContact CG1-CZ 3.44Å; V146-F374 VanDerWaalsContact CG1-CZ 3.44Å; T147-F374 WeakPolarHBondContact O-CE1 3.47Å; L148-F374 HydrophobicContact CD2-CE1 3.99Å; L148-F374 HydrophobicContact CD2-CZ 3.65Å; L148-F374 HydrophobicContact CG-CE1 4.41Å; L148-F374 HydrophobicContact CG-CZ 4.28Å; V323-F374 HydrophobicContact CG1-CE2 3.87Å; V323-F374 HydrophobicContact CG1-CZ 4.16Å; L360-F374 VanDerWaalsContact O-CD2 3.27Å; L360-F374 WeakPolarHBondContact O-CD2 3.46Å; I372-F374 HydrophobicContact CG2-CE1 4.02Å; I372-F374 HydrophobicContact CG2-CE2 3.67Å; I372-F374 HydrophobicContact CG2-CZ 3.37Å; F374-Q379 WeakPolarHBondContact CA-O 3.35Å; F374-R380 HydrophobicContact CD1-CB 4.27Å; F374-R380 HydrophobicContact CE1-CB 4.29Å
375	N	86.6	Confident	89.8	Confident	45 Å²	45	36.9 Å²	36.9	24%	0.241	20%	0.196	C	C	.	.			trans	-75.4	172.9	172.4	72.1	28.5	0	0	0	112.6	K377 G378 Q379 T381	N375-K377 PolarHBondContact O-N 2.93Å; N375-K377 WeakPolarHBondContact OD1-CA 3.42Å; N375-K377 VanDerWaalsContact OD1-CB 3.3Å; N375-K377 WeakPolarHBondContact OD1-CB 3.23Å; N375-K377 PolarHBondContact OD1-N 3.42Å; N375-G378 PolarHBondContact O-N 2.98Å; N375-G378 PolarHBondContact OD1-N 3.46Å; N375-Q379 PolarHBondContact N-O 3.22Å; N375-Q379 PolarHBondContact OD1-N 3.39Å; N375-Q379 VanDerWaalsContact OD1-N 3.13Å; N375-Q379 PolarHBondContact OD1-O 2.95Å; N375-T381 HydrophobicContact CB-CG2 3.88Å; N375-T381 PolarHBondContact N-OG1 2.64Å
376	S	83.7	Confident	89.8	Confident	104 Å²	104	36.6 Å²	36.6	73%	0.727	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-17.8	-179.1	58.9	0	0	0	0	115.3	R361	R361-S376 PolarHBondContact NH1-O 3.35Å
377	K	79.8	Confident	89.8	Confident	132 Å²	132	31.8 Å²	31.8	57%	0.574	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-7.7	175.4	-51.8	172.8	-175.1	168.7	0	113.1	N375 Q379	N375-K377 PolarHBondContact O-N 2.93Å; N375-K377 WeakPolarHBondContact OD1-CA 3.42Å; N375-K377 VanDerWaalsContact OD1-CB 3.3Å; N375-K377 WeakPolarHBondContact OD1-CB 3.23Å; N375-K377 PolarHBondContact OD1-N 3.42Å; K377-Q379 HydrophobicContact CB-CG 4.46Å
378	G	83.8	Confident	89.7	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.01	17%	0.174	C	C	.	.	S	Bend	trans	83.8	13.6	-173.6	0	0	0	0	0	114.5	V146 T147 N375	V146-G378 CarbonylContact C-O 3.56Å; V146-G378 VanDerWaalsContact CA-O 3.31Å; V146-G378 WeakPolarHBondContact CA-O 3.39Å; T147-G378 PolarHBondContact N-O 3.05Å; N375-G378 PolarHBondContact O-N 2.98Å; N375-G378 PolarHBondContact OD1-N 3.46Å
379	Q	87.4	Confident	89.4	Confident	18 Å²	18	33.3 Å²	33.3	8%	0.084	18%	0.178	C	C	.	.	B	Isolated β-bridge	trans	-91.4	139.1	174.4	-58.5	175.1	-110.3	0	0	109.9	K137 T147 F374 N375 K377	K137-Q379 VanDerWaalsContact NZ-CD 3.27Å; K137-Q379 VanDerWaalsContact NZ-OE1 3.13Å; T147-Q379 HydrophobicContact CG2-CB 4.24Å; T147-Q379 HydrophobicContact CG2-CG 4.16Å; F374-Q379 WeakPolarHBondContact CA-O 3.35Å; N375-Q379 PolarHBondContact N-O 3.22Å; N375-Q379 PolarHBondContact OD1-N 3.39Å; N375-Q379 VanDerWaalsContact OD1-N 3.13Å; N375-Q379 PolarHBondContact OD1-O 2.95Å; K377-Q379 HydrophobicContact CB-CG 4.46Å
380	R	90.1	Very high	89	Confident	4 Å²	4	33.7 Å²	33.7	2%	0.015	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	138.3	176.3	-169.3	175.1	177.8	171.3	-1.4	111.4	T147 L148 M279 T369 H371 I372 E373 F374 Y383	T147-R380 WeakPolarHBondContact O-CB 3.4Å; T147-R380 PolarHBondContact O-N 3.35Å; L148-R380 WeakPolarHBondContact O-CD 3.47Å; L148-R380 PolarHBondContact O-NH1 2.93Å; L148-R380 VanDerWaalsContact O-NH1 3.09Å; M279-R380 VanDerWaalsContact CE-NH1 3.26Å; T369-R380 PolarHBondContact O-NH2 3.47Å; T369-R380 PolarHBondContact OG1-NH1 2.96Å; T369-R380 PolarHBondContact OG1-NH2 2.81Å; H371-R380 PolarHBondContact O-NE 3.45Å; H371-R380 PolarHBondContact O-NH2 2.88Å; I372-R380 VanDerWaalsContact CG1-CZ 3.43Å; I372-R380 VanDerWaalsContact CG1-NH2 3.29Å; E373-R380 CarbonylContact O-C 3.52Å; E373-R380 VanDerWaalsContact O-CA 3.28Å; E373-R380 WeakPolarHBondContact O-CA 3.22Å; F374-R380 HydrophobicContact CD1-CB 4.27Å; F374-R380 HydrophobicContact CE1-CB 4.29Å; R380-Y383 HydrophobicContact CB-CD1 4.41Å; R380-Y383 HydrophobicContact CG-CD1 3.91Å; R380-Y383 HydrophobicContact CG-CG 4.47Å; R380-Y383 WeakPolarHBondContact O-CE1 3.27Å
381	T	89.7	Confident	88.3	Confident	33 Å²	33	37.2 Å²	37.2	20%	0.202	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	172.8	175.7	38.7	0	0	0	0	110.4	E373 N375 Y383	E373-T381 PolarHBondContact O-N 2.76Å; E373-T381 PolarHBondContact OE1-OG1 3.38Å; N375-T381 HydrophobicContact CB-CG2 3.88Å; N375-T381 PolarHBondContact N-OG1 2.64Å; T381-Y383 VanDerWaalsContact C-N 3.27Å; T381-Y383 PolarHBondContact O-N 3.42Å
382	N	89.6	Confident	87.2	Confident	93 Å²	93	38.1 Å²	38.1	50%	0.497	20%	0.204	S	C	.	.	S	Bend	trans	56.8	37.8	172.9	-161.5	12.2	0	0	0	113.9	E373 S403	E373-N382 HydrophobicContact CB-CB 4.24Å; E373-N382 WeakPolarHBondContact OE2-CB 3.31Å; E373-N382 PolarHBondContact OE2-ND2 3.45Å; N382-S403 WeakPolarHBondContact CA-OG 3.45Å; N382-S403 PolarHBondContact N-OG 2.85Å
383	Y	91.3	Very high	86.1	Confident	3 Å²	3	42.5 Å²	42.5	1%	0.012	24%	0.24	C	C	.	.			trans	-114.1	168.9	179.9	68.6	-87.2	0	0	0	111.5	P150 S151 D154 M279 R380 T381 L385 S403	P150-Y383 WeakPolarHBondContact CA-OH 3.14Å; P150-Y383 HydrophobicContact CB-CE2 3.94Å; P150-Y383 WeakPolarHBondContact CB-OH 3.05Å; P150-Y383 HydrophobicContact CG-CE2 4.01Å; S151-Y383 PolarHBondContact N-OH 3.14Å; D154-Y383 WeakPolarHBondContact CB-OH 3.26Å; D154-Y383 PolarHBondContact OD2-OH 2.9Å; M279-Y383 HydrophobicContact CE-CD2 3.4Å; M279-Y383 HydrophobicContact CE-CE2 3.89Å; M279-Y383 HydrophobicContact CE-CG 3.83Å; R380-Y383 HydrophobicContact CB-CD1 4.41Å; R380-Y383 HydrophobicContact CG-CD1 3.91Å; R380-Y383 HydrophobicContact CG-CG 4.47Å; R380-Y383 WeakPolarHBondContact O-CE1 3.27Å; T381-Y383 VanDerWaalsContact C-N 3.27Å; T381-Y383 PolarHBondContact O-N 3.42Å; Y383-L385 HydrophobicContact CD2-CD2 4.27Å; Y383-L385 HydrophobicContact CD2-CG 4.39Å; Y383-L385 HydrophobicContact CE2-CD1 4.42Å; Y383-L385 HydrophobicContact CE2-CD2 3.96Å; Y383-L385 HydrophobicContact CE2-CG 4Å; Y383-S403 PolarHBondContact N-OG 3.07Å; Y383-S403 PolarHBondContact O-N 3.46Å; Y383-S403 VanDerWaalsContact O-N 3.09Å
384	T	91.8	Very high	85.3	Confident	57 Å²	57	41 Å²	41	35%	0.35	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	147.8	178.5	56.8	0	0	0	0	111.6	W401 Y402	T384-W401 CarbonylContact C-O 3.45Å; T384-W401 VanDerWaalsContact CA-O 3.31Å; T384-W401 WeakPolarHBondContact CA-O 3.42Å; T384-Y402 HydrophobicContact CG2-CD1 3.37Å; T384-Y402 HydrophobicContact CG2-CE1 3.55Å; T384-Y402 HydrophobicContact CG2-CG 4.03Å
385	L	92.3	Very high	84.9	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	121.3	170.9	-62.4	177.8	0	0	0	108.1	P150 A158 M257 F277 M279 Y383 T400 W401	P150-L385 HydrophobicContact CG-CD2 3.99Å; A158-L385 HydrophobicContact CB-CD1 4.34Å; M257-L385 HydrophobicContact CE-CD1 4.08Å; M257-L385 HydrophobicContact CE-CD2 3.9Å; M257-L385 HydrophobicContact SD-CD2 3.95Å; F277-L385 HydrophobicContact CD1-CB 4.49Å; M279-L385 HydrophobicContact CB-CD2 4.48Å; M279-L385 HydrophobicContact CG-CD2 4.25Å; Y383-L385 HydrophobicContact CD2-CD2 4.27Å; Y383-L385 HydrophobicContact CD2-CG 4.39Å; Y383-L385 HydrophobicContact CE2-CD1 4.42Å; Y383-L385 HydrophobicContact CE2-CD2 3.96Å; Y383-L385 HydrophobicContact CE2-CG 4Å; L385-T400 WeakPolarHBondContact O-CA 3.43Å; L385-W401 HydrophobicContact CB-CB 4.47Å; L385-W401 HydrophobicContact CB-CE3 4.45Å; L385-W401 HydrophobicContact CD1-CE3 3.87Å; L385-W401 HydrophobicContact CD1-CZ3 4.21Å; L385-W401 HydrophobicContact CG-CE3 4.17Å; L385-W401 PolarHBondContact N-O 3.21Å; L385-W401 PolarHBondContact O-N 3.21Å
386	K	91.6	Very high	84.8	Confident	38 Å²	38	46.1 Å²	46.1	17%	0.165	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	132.3	173.2	-66.8	174.2	170	-74.7	0	109	F277 S278 L388 E397 T400	F277-K386 CarbonylContact C-O 3.56Å; F277-K386 WeakPolarHBondContact CA-O 3.44Å; S278-K386 PolarHBondContact N-O 2.77Å; S278-K386 WeakPolarHBondContact O-CB 3.15Å; S278-K386 PolarHBondContact O-N 2.91Å; K386-L388 HydrophobicContact CB-CD2 4.27Å; K386-E397 HydrophobicContact CB-CG 4.5Å; K386-E397 IonicContact NZ-OE1 3.98Å; K386-E397 PolarHBondContact NZ-OE1 2.71Å; K386-E397 IonicContact NZ-OE2 2.71Å; K386-E397 PolarHBondContact NZ-OE2 2.96Å; K386-T400 HydrophobicContact CG-CG2 4.38Å
387	I	91.4	Very high	85	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	120.1	175.7	-57.2	167.5	0	0	0	106.9	I162 V275 F277 I398 G399 W401 L407 M409	I162-I387 HydrophobicContact CD1-CD1 3.71Å; I162-I387 HydrophobicContact CD1-CG1 4.1Å; I162-I387 HydrophobicContact CD1-CG2 4.36Å; I162-I387 HydrophobicContact CG1-CD1 3.91Å; V275-I387 HydrophobicContact CG1-CG2 3.44Å; V275-I387 VanDerWaalsContact CG1-CG2 3.44Å; F277-I387 HydrophobicContact CD1-CG1 4.47Å; F277-I387 HydrophobicContact CE1-CG1 4.42Å; I387-I398 HydrophobicContact CB-CG1 4.3Å; I387-I398 HydrophobicContact CG2-CD1 4.01Å; I387-I398 HydrophobicContact CG2-CG1 3.81Å; I387-I398 WeakPolarHBondContact O-CG1 3.44Å; I387-I398 PolarHBondContact O-N 3.4Å; I387-G399 WeakPolarHBondContact CB-O 3.34Å; I387-G399 PolarHBondContact N-O 3.24Å; I387-W401 HydrophobicContact CD1-CB 4.46Å; I387-L407 HydrophobicContact CD1-CD1 3.36Å; I387-M409 HydrophobicContact CD1-SD 4.3Å
388	L	88.8	Confident	85.3	Confident	16 Å²	16	38.7 Å²	38.7	8%	0.084	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	142.3	-172.9	-57.4	-175.7	0	0	0	111	F259 P260 V275 G276 K386 H395 K396 E397	F259-L388 HydrophobicContact CD1-CB 3.81Å; F259-L388 HydrophobicContact CD1-CD1 4.39Å; F259-L388 HydrophobicContact CE1-CB 3.77Å; F259-L388 WeakPolarHBondContact CE1-O 3.28Å; P260-L388 HydrophobicContact CG-CD1 3.81Å; V275-L388 CarbonylContact C-O 3.58Å; V275-L388 WeakPolarHBondContact CA-O 3.45Å; G276-L388 PolarHBondContact N-O 3.19Å; G276-L388 PolarHBondContact O-N 3.06Å; K386-L388 HydrophobicContact CB-CD2 4.27Å; L388-H395 HydrophobicContact CD1-CB 4.37Å; L388-K396 CarbonylContact C-O 3.6Å; L388-K396 VanDerWaalsContact CA-O 3.3Å; L388-K396 WeakPolarHBondContact CA-O 3.22Å; L388-E397 HydrophobicContact CD2-CB 3.86Å; L388-E397 HydrophobicContact CD2-CG 4.18Å
389	E	86.7	Confident	85.5	Confident	16 Å²	16	38.7 Å²	38.7	8%	0.075	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	141.2	178.5	-168.7	171.2	-118.4	0	0	111.1	I274 V275 H391 H395 K396 I398 S413	I274-E389 WeakPolarHBondContact O-CA 3.47Å; V275-E389 HydrophobicContact CG2-CB 4.25Å; V275-E389 HydrophobicContact CG2-CG 4.29Å; E389-H391 PolarHBondContact O-N 2.79Å; E389-H395 WeakPolarHBondContact O-CA 3.36Å; E389-K396 PolarHBondContact N-O 2.69Å; E389-K396 PolarHBondContact O-N 3.16Å; E389-I398 HydrophobicContact CB-CD1 4.08Å; E389-I398 HydrophobicContact CB-CG1 4.39Å; E389-I398 HydrophobicContact CB-CG2 3.67Å; E389-I398 HydrophobicContact CG-CG2 4.5Å; E389-S413 VanDerWaalsContact CD-OG 3.24Å; E389-S413 VanDerWaalsContact OE1-CB 3.23Å; E389-S413 WeakPolarHBondContact OE1-CB 3.11Å; E389-S413 PolarHBondContact OE1-OG 2.87Å; E389-S413 VanDerWaalsContact OE2-CB 3.3Å; E389-S413 WeakPolarHBondContact OE2-CB 3.42Å; E389-S413 PolarHBondContact OE2-OG 3.35Å
390	K	83.8	Confident	85.7	Confident	12 Å²	12	38.9 Å²	38.9	5%	0.052	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	109.7	169.9	-174.7	-81.5	-166	170.3	0	109.3	F259 L264 V268 G269 I274	F259-K390 HydrophobicContact CZ-CB 4.47Å; L264-K390 HydrophobicContact CB-CG 4.17Å; L264-K390 HydrophobicContact CD1-CB 4.42Å; L264-K390 HydrophobicContact CD1-CG 4.08Å; V268-K390 PolarHBondContact O-NZ 2.9Å; G269-K390 PolarHBondContact O-NZ 3.14Å; I274-K390 HydrophobicContact CB-CB 4.07Å; I274-K390 PolarHBondContact O-N 2.67Å
391	H	76.3	Confident	85.8	Confident	80 Å²	80	38.7 Å²	38.7	37%	0.37	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	153.4	175	-170.9	-91.2	0	0	0	109.9	E389 A393 G394 K396	E389-H391 PolarHBondContact O-N 2.79Å; H391-A393 PolarHBondContact O-N 3.39Å; H391-G394 WeakPolarHBondContact CB-O 3.4Å; H391-G394 PolarHBondContact N-O 2.97Å; H391-G394 PolarHBondContact O-N 3.42Å; H391-K396 HydrophobicContact CB-CB 4.11Å
392	P	71.1	Confident	85.8	Confident	75 Å²	75	41.5 Å²	41.5	49%	0.487	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	14	177.4	-24.8	35.9	0	0	0	116.4	D270	D270-P392 HydrophobicContact CB-CG 3.97Å; D270-P392 WeakPolarHBondContact OD1-CG 3.44Å
393	A	68.8	Low	85.7	Confident	91 Å²	91	38.3 Å²	38.3	75%	0.752	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-130.2	20.1	176	0	0	0	0	0	111.8	H391	H391-A393 PolarHBondContact O-N 3.39Å
394	G	76.3	Confident	85.3	Confident	34 Å²	34	43.3 Å²	43.3	35%	0.351	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	95.8	-170.9	-170	0	0	0	0	0	113.1	H391	H391-G394 WeakPolarHBondContact CB-O 3.4Å; H391-G394 PolarHBondContact N-O 2.97Å; H391-G394 PolarHBondContact O-N 3.42Å
395	H	83.3	Confident	84.8	Confident	62 Å²	62	44.9 Å²	44.9	29%	0.287	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	131.5	-175.9	-61.8	-64.3	0	0	0	112.3	F259 P260 L262 L388 E389	F259-H395 AromaticContact CD1-ND1 3.92Å; F259-H395 AromaticContact CE1-CE1 3.67Å; F259-H395 AromaticContact CE1-ND1 3.24Å; F259-H395 WeakPolarHBondContact CE1-ND1 3.26Å; F259-H395 AromaticContact CZ-CE1 3.7Å; F259-H395 AromaticContact CZ-ND1 3.58Å; F259-H395 PolarHBondContact O-NE2 3.33Å; P260-H395 PolarHBondContact O-CD2 3.22Å; P260-H395 PolarHBondContact O-NE2 3.04Å; L262-H395 PolarHBondContact O-CE1 2.83Å; L262-H395 PolarHBondContact O-NE2 3.24Å; L262-H395 VanDerWaalsContact O-NE2 3.1Å; L388-H395 HydrophobicContact CD1-CB 4.37Å; E389-H395 WeakPolarHBondContact O-CA 3.36Å
396	K	84.1	Confident	84.5	Confident	100 Å²	100	48.1 Å²	48.1	44%	0.435	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	132.9	-177.5	-180	-172.3	170.7	-162.7	0	111	L388 E389 H391 I398	L388-K396 CarbonylContact C-O 3.6Å; L388-K396 VanDerWaalsContact CA-O 3.3Å; L388-K396 WeakPolarHBondContact CA-O 3.22Å; E389-K396 PolarHBondContact N-O 2.69Å; E389-K396 PolarHBondContact O-N 3.16Å; H391-K396 HydrophobicContact CB-CB 4.11Å; K396-I398 PolarHBondContact O-N 2.93Å
397	E	87.1	Confident	84.2	Confident	75 Å²	75	48.5 Å²	48.5	35%	0.35	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	121.6	175.2	-169	170.1	162.6	0	0	111.1	K386 L388 T400	K386-E397 HydrophobicContact CB-CG 4.5Å; K386-E397 IonicContact NZ-OE1 3.98Å; K386-E397 PolarHBondContact NZ-OE1 2.71Å; K386-E397 IonicContact NZ-OE2 2.71Å; K386-E397 PolarHBondContact NZ-OE2 2.96Å; L388-E397 HydrophobicContact CD2-CB 3.86Å; L388-E397 HydrophobicContact CD2-CG 4.18Å; E397-T400 WeakPolarHBondContact OE1-CG2 3.49Å
398	I	85.7	Confident	84	Confident	4 Å²	4	50.7 Å²	50.7	2%	0.021	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	-16	-176.7	61.9	166.6	0	0	0	113.5	V275 I387 E389 K396 M409 N410	V275-I398 HydrophobicContact CG2-CD1 3.65Å; I387-I398 HydrophobicContact CB-CG1 4.3Å; I387-I398 HydrophobicContact CG2-CD1 4.01Å; I387-I398 HydrophobicContact CG2-CG1 3.81Å; I387-I398 WeakPolarHBondContact O-CG1 3.44Å; I387-I398 PolarHBondContact O-N 3.4Å; E389-I398 HydrophobicContact CB-CD1 4.08Å; E389-I398 HydrophobicContact CB-CG1 4.39Å; E389-I398 HydrophobicContact CB-CG2 3.67Å; E389-I398 HydrophobicContact CG-CG2 4.5Å; K396-I398 PolarHBondContact O-N 2.93Å; I398-M409 HydrophobicContact CB-CE 4.1Å; I398-M409 HydrophobicContact CD1-CE 3.36Å; I398-M409 HydrophobicContact CG1-CE 3.63Å; I398-N410 WeakPolarHBondContact O-CB 3.39Å; I398-N410 PolarHBondContact O-N 3.26Å
399	G	88.4	Confident	83.5	Confident	2 Å²	2	52.1 Å²	52.1	2%	0.021	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.2	170.7	174	0	0	0	0	0	113	I387 A408	I387-G399 WeakPolarHBondContact CB-O 3.34Å; I387-G399 PolarHBondContact N-O 3.24Å; G399-A408 CarbonylContact C-O 3.58Å; G399-A408 VanDerWaalsContact CA-O 3.23Å; G399-A408 WeakPolarHBondContact CA-O 3.15Å
400	T	90.8	Very high	82.7	Confident	22 Å²	22	56.8 Å²	56.8	14%	0.135	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	130.3	173.2	49.6	0	0	0	0	110.4	L385 K386 E397 Y402 A408	L385-T400 WeakPolarHBondContact O-CA 3.43Å; K386-T400 HydrophobicContact CG-CG2 4.38Å; E397-T400 WeakPolarHBondContact OE1-CG2 3.49Å; T400-Y402 VanDerWaalsContact OG1-CE2 3.31Å; T400-Y402 WeakPolarHBondContact OG1-CE2 3.38Å; T400-Y402 PolarHBondContact OG1-OH 2.89Å; T400-A408 PolarHBondContact N-O 3.24Å; T400-A408 PolarHBondContact O-N 3.22Å
401	W	92.7	Very high	81.3	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	138.9	168.2	-175.4	90.8	0	0	0	109.3	D154 L157 A158 T384 L385 I387 L407	D154-W401 HydrophobicContact CB-CH2 3.58Å; D154-W401 HydrophobicContact CB-CZ3 3.85Å; L157-W401 HydrophobicContact CB-CZ2 4.1Å; A158-W401 HydrophobicContact CB-CD2 3.72Å; A158-W401 HydrophobicContact CB-CE3 4.17Å; A158-W401 HydrophobicContact CB-CG 3.86Å; A158-W401 HydrophobicContact CB-CZ2 4.45Å; T384-W401 CarbonylContact C-O 3.45Å; T384-W401 VanDerWaalsContact CA-O 3.31Å; T384-W401 WeakPolarHBondContact CA-O 3.42Å; L385-W401 HydrophobicContact CB-CB 4.47Å; L385-W401 HydrophobicContact CB-CE3 4.45Å; L385-W401 HydrophobicContact CD1-CE3 3.87Å; L385-W401 HydrophobicContact CD1-CZ3 4.21Å; L385-W401 HydrophobicContact CG-CE3 4.17Å; L385-W401 PolarHBondContact N-O 3.21Å; L385-W401 PolarHBondContact O-N 3.21Å; I387-W401 HydrophobicContact CD1-CB 4.46Å; W401-L407 HydrophobicContact CB-CD1 4.31Å
402	Y	91.1	Very high	79.9	Confident	91 Å²	91	59.9 Å²	59.9	36%	0.357	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	142.4	-177.6	-62.8	-103.9	0	0	0	109.6	T384 T400 N404 N405 T406 A408	T384-Y402 HydrophobicContact CG2-CD1 3.37Å; T384-Y402 HydrophobicContact CG2-CE1 3.55Å; T384-Y402 HydrophobicContact CG2-CG 4.03Å; T400-Y402 VanDerWaalsContact OG1-CE2 3.31Å; T400-Y402 WeakPolarHBondContact OG1-CE2 3.38Å; T400-Y402 PolarHBondContact OG1-OH 2.89Å; Y402-N404 WeakPolarHBondContact CB-OD1 3.37Å; Y402-N404 PolarHBondContact O-N 3.15Å; Y402-N404 PolarHBondContact O-OD1 2.96Å; Y402-N405 PolarHBondContact O-N 3.27Å; Y402-T406 PolarHBondContact N-O 3.25Å; Y402-A408 HydrophobicContact CE2-CB 3.86Å
403	S	86.3	Confident	78.8	Confident	27 Å²	27	57.7 Å²	57.7	19%	0.189	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	21.3	179.4	87.7	0	0	0	0	115.2	N382 Y383	N382-S403 WeakPolarHBondContact CA-OG 3.45Å; N382-S403 PolarHBondContact N-OG 2.85Å; Y383-S403 PolarHBondContact N-OG 3.07Å; Y383-S403 PolarHBondContact O-N 3.46Å; Y383-S403 VanDerWaalsContact O-N 3.09Å
404	N	83.8	Confident	77.8	Confident	107 Å²	107	53.5 Å²	53.5	57%	0.572	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.1	17.2	168.4	66.8	3.1	0	0	0	111.3	Y402 T406	Y402-N404 WeakPolarHBondContact CB-OD1 3.37Å; Y402-N404 PolarHBondContact O-N 3.15Å; Y402-N404 PolarHBondContact O-OD1 2.96Å; N404-T406 VanDerWaalsContact C-N 3.33Å; N404-T406 PolarHBondContact O-N 3.22Å; N404-T406 WeakPolarHBondContact OD1-CB 3.2Å; N404-T406 WeakPolarHBondContact OD1-CG2 3.33Å; N404-T406 PolarHBondContact OD1-N 2.95Å; N404-T406 VanDerWaalsContact OD1-N 3.12Å; N404-T406 PolarHBondContact OD1-OG1 3.02Å
405	N	80.7	Confident	76.2	Confident	91 Å²	91	55 Å²	55	49%	0.487	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.3	29.6	-176.2	-58.2	-16	0	0	0	114.6	Y402	Y402-N405 PolarHBondContact O-N 3.27Å
406	T	85.7	Confident	74.4	Confident	68 Å²	68	55.8 Å²	55.8	42%	0.417	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	136	170.2	64.8	0	0	0	0	111.8	Y402 N404	Y402-T406 PolarHBondContact N-O 3.25Å; N404-T406 VanDerWaalsContact C-N 3.33Å; N404-T406 PolarHBondContact O-N 3.22Å; N404-T406 WeakPolarHBondContact OD1-CB 3.2Å; N404-T406 WeakPolarHBondContact OD1-CG2 3.33Å; N404-T406 PolarHBondContact OD1-N 2.95Å; N404-T406 VanDerWaalsContact OD1-N 3.12Å; N404-T406 PolarHBondContact OD1-OG1 3.02Å
407	L	86	Confident	72.3	Confident	45 Å²	45	56.3 Å²	56.3	24%	0.236	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	108.8	175.4	174.2	55.4	0	0	0	108.9	S161 I162 I387 W401 M409	S161-L407 WeakPolarHBondContact O-CD2 3.23Å; I162-L407 HydrophobicContact CG1-CD2 4.2Å; I387-L407 HydrophobicContact CD1-CD1 3.36Å; W401-L407 HydrophobicContact CB-CD1 4.31Å; L407-M409 HydrophobicContact CD1-SD 4.33Å
408	A	86.7	Confident	70.1	Confident	46 Å²	46	55.6 Å²	55.6	38%	0.38	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	92.6	172	0	0	0	0	0	109.2	G399 T400 Y402	G399-A408 CarbonylContact C-O 3.58Å; G399-A408 VanDerWaalsContact CA-O 3.23Å; G399-A408 WeakPolarHBondContact CA-O 3.15Å; T400-A408 PolarHBondContact N-O 3.24Å; T400-A408 PolarHBondContact O-N 3.22Å; Y402-A408 HydrophobicContact CE2-CB 3.86Å
409	M	78.1	Confident	68.1	Low	47 Å²	47	58.7 Å²	58.7	23%	0.232	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	129.4	178.3	-155.9	68.6	179.7	0	0	110.7	F166 I387 I398 L407 S411	F166-M409 HydrophobicContact CE1-CE 4.07Å; F166-M409 HydrophobicContact CZ-CE 3.81Å; I387-M409 HydrophobicContact CD1-SD 4.3Å; I398-M409 HydrophobicContact CB-CE 4.1Å; I398-M409 HydrophobicContact CD1-CE 3.36Å; I398-M409 HydrophobicContact CG1-CE 3.63Å; L407-M409 HydrophobicContact CD1-SD 4.33Å; M409-S411 PolarHBondContact O-N 3.24Å
410	N	71.3	Confident	66.1	Low	114 Å²	114	67.3 Å²	67.3	61%	0.61	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-73.7	124.9	163.9	-67.6	-46.5	0	0	0	107.4	I398 T412	I398-N410 WeakPolarHBondContact O-CB 3.39Å; I398-N410 PolarHBondContact O-N 3.26Å; N410-T412 PolarHBondContact O-N 2.9Å
411	S	52.3	Low	64.5	Low	97 Å²	97	69 Å²	69	68%	0.678	39%	0.394	S	S	*	.	S	Bend	trans	-53.5	125.7	-161.2	54.9	0	0	0	0	115.1	M409 N417	M409-S411 PolarHBondContact O-N 3.24Å; S411-N417 PolarHBondContact O-ND2 2.9Å
412	T	48.1	Very low	63.2	Low	59 Å²	59	69 Å²	69	36%	0.362	39%	0.394	S	S	.	.			trans	50.8	72.2	158.6	56.2	0	0	0	0	116.1	N410 D415 N417	N410-T412 PolarHBondContact O-N 2.9Å; T412-D415 CarbonylContact C-O 3.59Å; T412-D415 VanDerWaalsContact C-O 3.3Å; T412-D415 HydrophobicContact CG2-CB 4.02Å; T412-D415 VanDerWaalsContact O-O 3.11Å; T412-N417 WeakPolarHBondContact O-CB 3.33Å; T412-N417 PolarHBondContact O-ND2 2.99Å; T412-N417 PolarHBondContact OG1-ND2 2.64Å; T412-N417 PolarHBondContact OG1-OD1 3.04Å
413	S	46.8	Very low	62	Low	29 Å²	29	66.1 Å²	66.1	20%	0.203	39%	0.389	C	S	.	.	S	Bend	trans	-91.9	-47.1	157.4	70.5	0	0	0	0	111.9	E389 D415	E389-S413 VanDerWaalsContact CD-OG 3.24Å; E389-S413 VanDerWaalsContact OE1-CB 3.23Å; E389-S413 WeakPolarHBondContact OE1-CB 3.11Å; E389-S413 PolarHBondContact OE1-OG 2.87Å; E389-S413 VanDerWaalsContact OE2-CB 3.3Å; E389-S413 WeakPolarHBondContact OE2-CB 3.42Å; E389-S413 PolarHBondContact OE2-OG 3.35Å; S413-D415 CarbonylContact C-O 3.56Å
414	L	48.9	Very low	61.5	Low	4 Å²	4	72.2 Å²	72.2	2%	0.021	42%	0.42	C	S	.	.	S	Bend	trans	-73.8	-34.8	179.3	-84.9	-172.9	0	0	0	113.8	F166 K251 N273 V275	F166-L414 HydrophobicContact CD1-CB 4.47Å; F166-L414 HydrophobicContact CD2-CD1 4.22Å; F166-L414 HydrophobicContact CE1-CB 3.96Å; F166-L414 HydrophobicContact CE2-CB 4.12Å; F166-L414 HydrophobicContact CE2-CD1 3.33Å; F166-L414 HydrophobicContact CE2-CG 4.33Å; F166-L414 HydrophobicContact CZ-CB 3.77Å; F166-L414 HydrophobicContact CZ-CD1 3.52Å; F166-L414 HydrophobicContact CZ-CG 4.13Å; K251-L414 PolarHBondContact NZ-O 2.96Å; N273-L414 HydrophobicContact CB-CD2 3.48Å; N273-L414 VanDerWaalsContact CB-CD2 3.48Å; V275-L414 HydrophobicContact CB-CD1 4.21Å; V275-L414 HydrophobicContact CG2-CD1 3.51Å; V275-L414 HydrophobicContact CG2-CD2 4.28Å; V275-L414 HydrophobicContact CG2-CG 3.95Å
415	D	43.3	Very low	61.3	Low	64 Å²	64	70.1 Å²	70.1	34%	0.342	41%	0.406	S	S	.	.	S	Bend	trans	-79.5	135.7	155.7	-84.6	-9.7	0	0	0	108.5	Y168 K251 T412 S413 N417	Y168-D415 PolarHBondContact OH-OD1 3.41Å; K251-D415 IonicContact NZ-OD1 2.68Å; T412-D415 CarbonylContact C-O 3.59Å; T412-D415 VanDerWaalsContact C-O 3.3Å; T412-D415 HydrophobicContact CG2-CB 4.02Å; T412-D415 VanDerWaalsContact O-O 3.11Å; S413-D415 CarbonylContact C-O 3.56Å; D415-N417 PolarHBondContact O-N 3.16Å
416	L	45.1	Very low	61.5	Low	80 Å²	80	69.8 Å²	69.8	42%	0.419	41%	0.41	S	S	.	.			trans	-69.9	88.1	-156.6	-70.9	152.2	0	0	0	113	A418	L416-A418 HydrophobicContact CB-CB 4.45Å; L416-A418 HydrophobicContact CD2-CB 4.03Å; L416-A418 CarbonylContact O-C 3.56Å; L416-A418 VanDerWaalsContact O-C 3.29Å; L416-A418 PolarHBondContact O-N 3.3Å
417	N	38.5	Very low	61.7	Low	111 Å²	111	66.7 Å²	66.7	59%	0.594	39%	0.391	S	S	*	.			trans	-69.4	1.3	154.8	-86.5	-13.8	0	0	0	112.6	S411 T412 D415 S419	S411-N417 PolarHBondContact O-ND2 2.9Å; T412-N417 WeakPolarHBondContact O-CB 3.33Å; T412-N417 PolarHBondContact O-ND2 2.99Å; T412-N417 PolarHBondContact OG1-ND2 2.64Å; T412-N417 PolarHBondContact OG1-OD1 3.04Å; D415-N417 PolarHBondContact O-N 3.16Å; N417-S419 PolarHBondContact O-N 2.66Å
418	A	42.4	Very low	62	Low	60 Å²	60	67.9 Å²	67.9	50%	0.496	40%	0.397	S	S	.	.	S	Bend	trans	-69.2	82.4	142.7	0	0	0	0	0	108.2	L416	L416-A418 HydrophobicContact CB-CB 4.45Å; L416-A418 HydrophobicContact CD2-CB 4.03Å; L416-A418 CarbonylContact O-C 3.56Å; L416-A418 VanDerWaalsContact O-C 3.29Å; L416-A418 PolarHBondContact O-N 3.3Å
419	S	42.6	Very low	62.5	Low	68 Å²	68	65.7 Å²	65.7	48%	0.476	38%	0.379	S	S	.	.			trans	-37.9	159.2	-168.4	50.7	0	0	0	0	117	N417 T421	N417-S419 PolarHBondContact O-N 2.66Å; S419-T421 PolarHBondContact O-N 3.21Å; S419-T421 PolarHBondContact O-OG1 2.75Å; S419-T421 VanDerWaalsContact O-OG1 3.14Å; S419-T421 PolarHBondContact OG-OG1 3.41Å
420	E	47.5	Very low	63.4	Low	183 Å²	183	63.5 Å²	63.5	86%	0.855	37%	0.368	S	S	*	.	S	Bend	trans	-57	53.6	173.8	-55.4	169.9	117	0	0	113.5	E771	E420-E771 VanDerWaalsContact C-CD 3.45Å
421	T	55.8	Low	64.5	Low	58 Å²	58	58.2 Å²	58.2	36%	0.356	34%	0.34	S	S	.	.			trans	-150.7	113.1	-169.5	55.6	0	0	0	0	108.6	S419 A423 E771	S419-T421 PolarHBondContact O-N 3.21Å; S419-T421 PolarHBondContact O-OG1 2.75Å; S419-T421 VanDerWaalsContact O-OG1 3.14Å; S419-T421 PolarHBondContact OG-OG1 3.41Å; T421-A423 PolarHBondContact O-N 3.27Å; T421-E771 VanDerWaalsContact CA-OE2 3.23Å; T421-E771 WeakPolarHBondContact CA-OE2 3.05Å; T421-E771 PolarHBondContact N-OE1 3.23Å; T421-E771 PolarHBondContact N-OE2 2.86Å
422	L	66.2	Low	66.5	Low	0 Å²	0	54.8 Å²	54.8	0%	0	31%	0.314	C	S	.	.			trans	-55.6	-10	160	-104.5	75.4	0	0	0	113.3	N424 K425 L427 L468 F470 Y768 E771 I772	L422-N424 PolarHBondContact O-N 2.85Å; L422-K425 WeakPolarHBondContact O-CB 3.03Å; L422-K425 PolarHBondContact O-N 2.96Å; L422-L427 HydrophobicContact CD2-CD1 3.67Å; L422-L427 HydrophobicContact CG-CD1 4.27Å; L422-L468 CarbonylContact C-O 3.54Å; L422-L468 HydrophobicContact CB-CB 4.06Å; L422-L468 WeakPolarHBondContact CB-O 3.42Å; L422-L468 HydrophobicContact CD2-CB 4.49Å; L422-L468 HydrophobicContact CD2-CD1 4.3Å; L422-F470 HydrophobicContact CB-CB 3.99Å; L422-F470 HydrophobicContact CB-CD1 3.99Å; L422-F470 HydrophobicContact CB-CG 4.38Å; L422-F470 HydrophobicContact CD2-CB 4.23Å; L422-F470 HydrophobicContact CD2-CD1 3.42Å; L422-F470 VanDerWaalsContact CD2-CD1 3.42Å; L422-F470 HydrophobicContact CD2-CE1 3.81Å; L422-F470 HydrophobicContact CD2-CG 3.87Å; L422-F470 HydrophobicContact CG-CB 4.4Å; L422-F470 HydrophobicContact CG-CD1 4.27Å; L422-F470 WeakPolarHBondContact O-CA 3.44Å; L422-F470 WeakPolarHBondContact O-CB 3.49Å; L422-Y768 HydrophobicContact CD1-CD1 3.44Å; L422-Y768 VanDerWaalsContact CD1-CD1 3.44Å; L422-Y768 HydrophobicContact CD1-CE1 4.2Å; L422-Y768 HydrophobicContact CD1-CG 3.94Å; L422-Y768 HydrophobicContact CG-CD1 4.25Å; L422-E771 HydrophobicContact CD1-CB 3.92Å; L422-E771 VanDerWaalsContact CD1-CD 3.42Å; L422-E771 HydrophobicContact CD1-CG 4.28Å; L422-E771 WeakPolarHBondContact CD1-OE2 3.37Å; L422-E771 PolarHBondContact N-OE2 2.99Å; L422-I772 HydrophobicContact CD2-CD1 4.19Å; L422-I772 HydrophobicContact CD2-CG1 4.04Å
423	A	66.4	Low	68.6	Low	30 Å²	30	55.7 Å²	55.7	25%	0.248	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-40.7	128.4	178.3	0	0	0	0	0	114.6	T421 K425 L468 K469	T421-A423 PolarHBondContact O-N 3.27Å; A423-K425 PolarHBondContact O-N 3.03Å; A423-L468 PolarHBondContact N-O 2.76Å; A423-L468 VanDerWaalsContact N-O 3.11Å; A423-K469 CarbonylContact C-O 3.59Å; A423-K469 WeakPolarHBondContact CA-O 3.3Å; A423-K469 HydrophobicContact CB-CB 3.92Å
424	N	74.8	Confident	70.7	Confident	155 Å²	155	55.9 Å²	55.9	83%	0.829	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.6	3.4	176.5	-54.1	-40.4	0	0	0	116.3	L422 K469	L422-N424 PolarHBondContact O-N 2.85Å; N424-K469 PolarHBondContact N-O 2.55Å
425	K	79.2	Confident	72.7	Confident	64 Å²	64	58.9 Å²	58.9	28%	0.278	33%	0.33	S	S	.	.			trans	-76.6	161.4	169.6	-63.3	175.9	-176	164.3	0	110.4	L422 A423 S471 Y768	L422-K425 WeakPolarHBondContact O-CB 3.03Å; L422-K425 PolarHBondContact O-N 2.96Å; A423-K425 PolarHBondContact O-N 3.03Å; K425-S471 PolarHBondContact O-N 3.17Å; K425-S471 PolarHBondContact O-OG 2.98Å; K425-Y768 HydrophobicContact CD-CE1 4.26Å
426	S	86.1	Confident	75	Confident	83 Å²	83	55.9 Å²	55.9	58%	0.58	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122	104.3	176.6	-178.7	0	0	0	0	109.8	S471	S426-S471 VanDerWaalsContact CA-O 3.31Å; S426-S471 WeakPolarHBondContact CA-O 3.41Å; S426-S471 WeakPolarHBondContact CA-OG 3.48Å; S426-S471 WeakPolarHBondContact CB-OG 3.23Å
427	L	90.3	Very high	77.4	Confident	3 Å²	3	52.1 Å²	52.1	2%	0.016	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	135.1	-175.1	-58.8	-177.5	0	0	0	112	L422 F470 S471 F472 K473 D504 L505 Y768	L422-L427 HydrophobicContact CD2-CD1 3.67Å; L422-L427 HydrophobicContact CG-CD1 4.27Å; L427-F470 HydrophobicContact CD1-CD2 3.99Å; L427-F470 HydrophobicContact CD1-CE2 4.42Å; L427-F470 HydrophobicContact CD1-CG 4.27Å; L427-F470 HydrophobicContact CG-CD2 4.35Å; L427-S471 PolarHBondContact N-O 3.15Å; L427-F472 CarbonylContact O-C 3.56Å; L427-F472 WeakPolarHBondContact O-CA 3.38Å; L427-K473 PolarHBondContact O-N 3.17Å; L427-D504 HydrophobicContact CB-CB 4.26Å; L427-D504 HydrophobicContact CD2-CB 4.12Å; L427-L505 HydrophobicContact CD1-CD1 3.79Å; L427-L505 HydrophobicContact CD1-CG 4.31Å; L427-Y768 HydrophobicContact CD2-CD2 4.31Å; L427-Y768 HydrophobicContact CD2-CE2 3.75Å
428	I	92.4	Very high	80.1	Confident	70 Å²	70	47 Å²	47	36%	0.359	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	114.9	172.2	-58.5	177.6	0	0	0	108.3	K475 A503 D504 L505	I428-K475 HydrophobicContact CG2-CB 4.29Å; I428-A503 HydrophobicContact CG2-CB 4.1Å; I428-D504 PolarHBondContact N-OD2 3.24Å; I428-D504 PolarHBondContact O-N 3.13Å; I428-L505 PolarHBondContact O-N 3.04Å
429	V	96.3	Very high	82.5	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.006	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	111.6	-179	-175.5	0	0	0	0	109.3	L461 F472 K473 K475 L505 V507	V429-L461 HydrophobicContact CG1-CD1 3.93Å; V429-L461 HydrophobicContact CG1-CD2 4.27Å; V429-L461 HydrophobicContact CG2-CD2 4.1Å; V429-F472 HydrophobicContact CG2-CB 3.88Å; V429-F472 HydrophobicContact CG2-CD2 4.37Å; V429-F472 HydrophobicContact CG2-CG 4.44Å; V429-K473 PolarHBondContact N-O 3.08Å; V429-K475 PolarHBondContact O-N 2.75Å; V429-L505 CarbonylContact C-O 3.59Å; V429-L505 WeakPolarHBondContact CA-O 3.39Å; V429-L505 HydrophobicContact CG1-CB 4.4Å; V429-L505 HydrophobicContact CG2-CB 4.26Å; V429-L505 HydrophobicContact CG2-CD1 4.26Å; V429-V507 HydrophobicContact CG1-CB 4.02Å; V429-V507 HydrophobicContact CG1-CG2 3.81Å
430	T	96.3	Very high	84.8	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	142.4	171.6	-166.3	0	0	0	0	111.1	K475 M494 E497 A503 L505 A506 V507	T430-K475 CarbonylContact C-O 3.54Å; T430-K475 WeakPolarHBondContact CA-O 3.04Å; T430-M494 HydrophobicContact CG2-CB 3.99Å; T430-M494 HydrophobicContact CG2-CG 3.88Å; T430-M494 HydrophobicContact CG2-SD 4.42Å; T430-E497 VanDerWaalsContact CB-OE2 3.25Å; T430-E497 WeakPolarHBondContact CB-OE2 3.17Å; T430-E497 HydrophobicContact CG2-CB 4.46Å; T430-E497 PolarHBondContact OG1-OE2 3.13Å; T430-A503 HydrophobicContact CG2-CB 3.8Å; T430-L505 PolarHBondContact N-O 3.11Å; T430-A506 HydrophobicContact CG2-CB 3.73Å; T430-A506 WeakPolarHBondContact O-CA 3.2Å; T430-V507 PolarHBondContact O-N 2.83Å; T430-V507 VanDerWaalsContact O-N 3.13Å
431	T	95.6	Very high	86.9	Confident	4 Å²	4	41 Å²	41	3%	0.025	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	170.4	-179.8	-162.1	0	0	0	0	112.1	V438 I474 K475 L476 V477 V507	T431-V438 HydrophobicContact CG2-CG1 4.08Å; T431-V438 HydrophobicContact CG2-CG2 4.36Å; T431-V438 WeakPolarHBondContact OG1-CG2 3.46Å; T431-I474 HydrophobicContact CG2-CG2 3.73Å; T431-K475 PolarHBondContact N-O 2.75Å; T431-L476 HydrophobicContact CG2-CD2 3.96Å; T431-L476 WeakPolarHBondContact O-CA 3.46Å; T431-V477 PolarHBondContact O-N 2.76Å; T431-V507 WeakPolarHBondContact CB-O 3.44Å; T431-V507 PolarHBondContact OG1-O 3.28Å
432	I	93.2	Very high	88.4	Confident	24 Å²	24	43.5 Å²	43.5	12%	0.123	24%	0.236	C	C	.	.			trans	-123.5	148.4	178.8	-172	170.2	0	0	0	109.1	E434 V477 G480 Y482 M494 A508	I432-E434 PolarHBondContact O-N 3.09Å; I432-V477 HydrophobicContact CB-CG1 4.28Å; I432-G480 VanDerWaalsContact CD1-O 3.24Å; I432-G480 WeakPolarHBondContact CD1-O 3.3Å; I432-Y482 HydrophobicContact CD1-CD2 4.29Å; I432-Y482 HydrophobicContact CD1-CE2 4.24Å; I432-Y482 HydrophobicContact CG2-CD1 4.49Å; I432-Y482 HydrophobicContact CG2-CE1 3.86Å; I432-Y482 HydrophobicContact CG2-CE2 4.49Å; I432-M494 HydrophobicContact CB-CE 4.11Å; I432-M494 HydrophobicContact CG2-CE 3.73Å; I432-M494 HydrophobicContact CG2-SD 4.48Å; I432-A508 HydrophobicContact CG2-CB 3.81Å
433	L	92.3	Very high	89.4	Confident	79 Å²	79	47.6 Å²	47.6	41%	0.414	26%	0.257	S	S	.	.			trans	-77.4	113.5	175.5	-65.7	178.4	0	0	0	110	V438 R440 Y453 L476	L433-V438 WeakPolarHBondContact CA-O 3.28Å; L433-V438 HydrophobicContact CD2-CG1 4.27Å; L433-R440 HydrophobicContact CD1-CG 4.27Å; L433-R440 HydrophobicContact CD2-CG 4Å; L433-Y453 HydrophobicContact CD2-CD1 4.2Å; L433-Y453 HydrophobicContact CD2-CE1 4.06Å; L433-L476 HydrophobicContact CD1-CD1 4.27Å; L433-L476 HydrophobicContact CD2-CD2 3.89Å; L433-L476 HydrophobicContact CG-CD1 4.32Å; L433-L476 HydrophobicContact CG-CD2 3.95Å
434	E	90.8	Very high	90.4	Very high	32 Å²	32	50 Å²	50	15%	0.15	26%	0.261	C	S	.	.	B	Isolated β-bridge	trans	-153.3	125.7	-179.9	-170.3	-179.7	-97.6	0	0	110.3	I432 Y437 V438 Y482 M735	I432-E434 PolarHBondContact O-N 3.09Å; E434-Y437 HydrophobicContact CB-CD2 4.34Å; E434-Y437 HydrophobicContact CG-CD2 4.01Å; E434-Y437 HydrophobicContact CG-CE2 4.45Å; E434-Y437 PolarHBondContact O-N 3Å; E434-Y437 WeakPolarHBondContact OE2-CD2 3.45Å; E434-Y437 WeakPolarHBondContact OE2-CE2 3.07Å; E434-V438 CarbonylContact C-O 3.59Å; E434-V438 PolarHBondContact N-O 2.96Å; E434-V438 PolarHBondContact O-N 3.01Å; E434-Y482 PolarHBondContact OE1-OH 3.35Å; E434-Y482 PolarHBondContact OE2-OH 3.48Å; E434-M735 HydrophobicContact CG-CE 3.42Å; E434-M735 VanDerWaalsContact CG-CE 3.42Å
435	N	90.8	Very high	91	Very high	68 Å²	68	49.8 Å²	49.8	36%	0.364	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	134.4	-178.3	-57.4	-5.5	0	0	0	110.4	M439 M735 Y738	N435-M439 HydrophobicContact CB-CG 4.27Å; N435-M439 HydrophobicContact CB-SD 3.86Å; N435-M439 WeakPolarHBondContact OD1-CG 3.3Å; N435-M735 WeakPolarHBondContact O-CE 3.46Å; N435-M735 VanDerWaalsContact O-SD 3.41Å; N435-Y738 HydrophobicContact CB-CE1 3.88Å
436	P	93.1	Very high	91.4	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	cis	-98.1	16.6	0	39.4	-35	0	0	0	114	M439 G455 F456 Y738 W792 W793	P436-M439 HydrophobicContact CB-CE 4.34Å; P436-G455 CarbonylContact O-C 3.55Å; P436-G455 WeakPolarHBondContact O-CA 3.31Å; P436-F456 PolarHBondContact O-N 2.93Å; P436-Y738 HydrophobicContact CB-CD2 4.14Å; P436-Y738 HydrophobicContact CB-CE2 3.69Å; P436-Y738 HydrophobicContact CG-CD2 3.74Å; P436-Y738 HydrophobicContact CG-CE2 3.84Å; P436-Y738 HydrophobicContact CG-CG 4.14Å; P436-W792 HydrophobicContact CB-CB 4.37Å; P436-W793 HydrophobicContact CG-CD2 4.19Å; P436-W793 HydrophobicContact CG-CE3 4.1Å; P436-W793 HydrophobicContact CG-CH2 3.68Å; P436-W793 HydrophobicContact CG-CZ2 3.74Å; P436-W793 HydrophobicContact CG-CZ3 3.86Å
437	Y	94.4	Very high	91.5	Very high	1 Å²	1	52.4 Å²	52.4	0%	0.004	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-53.4	-173.8	-53.9	-80.5	0	0	0	112.8	E434 G455 F456 C457 T734 M735 Y758 W793	E434-Y437 HydrophobicContact CB-CD2 4.34Å; E434-Y437 HydrophobicContact CG-CD2 4.01Å; E434-Y437 HydrophobicContact CG-CE2 4.45Å; E434-Y437 PolarHBondContact O-N 3Å; E434-Y437 WeakPolarHBondContact OE2-CD2 3.45Å; E434-Y437 WeakPolarHBondContact OE2-CE2 3.07Å; Y437-G455 CarbonylContact O-C 3.6Å; Y437-G455 VanDerWaalsContact O-C 3.26Å; Y437-G455 WeakPolarHBondContact O-CA 3.46Å; Y437-F456 PolarHBondContact O-N 2.86Å; Y437-F456 VanDerWaalsContact O-N 3.17Å; Y437-C457 WeakPolarHBondContact O-CB 3.29Å; Y437-C457 PolarHBondContact O-N 3.16Å; Y437-T734 VanDerWaalsContact OH-CB 3.28Å; Y437-T734 WeakPolarHBondContact OH-CB 3.49Å; Y437-T734 PolarHBondContact OH-OG1 3.34Å; Y437-M735 HydrophobicContact CE2-SD 4.33Å; Y437-Y758 HydrophobicContact CE1-CD2 4.24Å; Y437-Y758 AromaticContact CE1-CE2 3.73Å; Y437-Y758 HydrophobicContact CE1-CE2 3.73Å; Y437-Y758 AromaticContact CZ-CE2 3.74Å; Y437-Y758 WeakPolarHBondContact OH-CE2 3.44Å; Y437-W793 HydrophobicContact CD1-CH2 4.04Å; Y437-W793 AromaticContact CE1-CH2 3.55Å; Y437-W793 HydrophobicContact CE1-CH2 3.55Å; Y437-W793 AromaticContact CE1-CZ2 3.83Å; Y437-W793 HydrophobicContact CE1-CZ2 3.83Å; Y437-W793 AromaticContact CZ-CZ2 3.87Å
438	V	95.1	Very high	91.3	Very high	3 Å²	3	60.8 Å²	60.8	2%	0.018	30%	0.301	C	S	.	.	B	Isolated β-bridge	trans	-142.5	116.7	174.5	-176.8	0	0	0	0	109.5	T431 L433 E434 Y453 C457 V458	T431-V438 HydrophobicContact CG2-CG1 4.08Å; T431-V438 HydrophobicContact CG2-CG2 4.36Å; T431-V438 WeakPolarHBondContact OG1-CG2 3.46Å; L433-V438 WeakPolarHBondContact CA-O 3.28Å; L433-V438 HydrophobicContact CD2-CG1 4.27Å; E434-V438 CarbonylContact C-O 3.59Å; E434-V438 PolarHBondContact N-O 2.96Å; E434-V438 PolarHBondContact O-N 3.01Å; V438-Y453 HydrophobicContact CG1-CD1 4.09Å; V438-C457 HydrophobicContact CG2-CB 3.77Å; V438-V458 HydrophobicContact CB-CG2 4.42Å; V438-V458 HydrophobicContact CG1-CG2 4.07Å; V438-V458 HydrophobicContact CG2-CG2 4.05Å
439	M	92.8	Very high	91.1	Very high	30 Å²	30	59.7 Å²	59.7	15%	0.148	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	152.4	-177.3	-54.6	-172.1	-75.2	0	0	109.1	N435 P436 Y453 E454 W792	N435-M439 HydrophobicContact CB-CG 4.27Å; N435-M439 HydrophobicContact CB-SD 3.86Å; N435-M439 WeakPolarHBondContact OD1-CG 3.3Å; P436-M439 HydrophobicContact CB-CE 4.34Å; M439-Y453 WeakPolarHBondContact O-CA 3.44Å; M439-E454 HydrophobicContact CB-CG 4.43Å; M439-E454 PolarHBondContact N-O 3.38Å; M439-E454 PolarHBondContact O-N 2.88Å; M439-W792 HydrophobicContact CE-CE3 3.85Å; M439-W792 HydrophobicContact CE-CH2 4.34Å; M439-W792 HydrophobicContact CE-CZ3 3.43Å; M439-W792 VanDerWaalsContact CE-CZ3 3.43Å
440	R	92.1	Very high	90.8	Very high	116 Å²	116	61.5 Å²	61.5	44%	0.438	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	134.3	166.2	-72.4	-173.9	177.5	175.1	2.6	109.1	L433 Y453 L476	L433-R440 HydrophobicContact CD1-CG 4.27Å; L433-R440 HydrophobicContact CD2-CG 4Å; R440-Y453 HydrophobicContact CG-CD1 4.13Å; R440-Y453 HydrophobicContact CG-CE1 3.9Å; R440-L476 VanDerWaalsContact NH2-CD1 3.27Å
441	K	91.7	Very high	90.5	Very high	39 Å²	39	65.2 Å²	65.2	17%	0.17	34%	0.336	C	S	.	.			trans	-58.4	150.2	171	-69.2	179.8	-174.7	166.8	0	110.5	N443 Y444 F447 D451 Q452 E454	K441-N443 PolarHBondContact O-N 2.96Å; K441-N443 VanDerWaalsContact O-N 3.15Å; K441-Y444 WeakPolarHBondContact O-CB 3.23Å; K441-Y444 WeakPolarHBondContact O-CD1 3.37Å; K441-Y444 PolarHBondContact O-N 3.43Å; K441-Y444 VanDerWaalsContact O-N 3.11Å; K441-F447 HydrophobicContact CD-CD2 4.2Å; K441-F447 HydrophobicContact CD-CE2 4.09Å; K441-D451 VanDerWaalsContact CD-O 3.28Å; K441-D451 WeakPolarHBondContact CD-O 3.29Å; K441-D451 VanDerWaalsContact CE-O 3.22Å; K441-D451 WeakPolarHBondContact CE-O 3.43Å; K441-D451 PolarHBondContact NZ-O 2.78Å; K441-Q452 PolarHBondContact N-O 3.03Å; K441-Q452 VanDerWaalsContact N-O 3.11Å; K441-E454 HydrophobicContact CG-CB 4.27Å; K441-E454 VanDerWaalsContact CG-CD 3.49Å; K441-E454 HydrophobicContact CG-CG 3.95Å
442	S	86.3	Confident	90.4	Very high	112 Å²	112	67.5 Å²	67.5	78%	0.783	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	-39.7	172.8	58.3	0	0	0	0	112.3
443	N	88.4	Confident	90.4	Very high	85 Å²	85	67.2 Å²	67.2	46%	0.455	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	28.4	-175.9	-74.8	60	0	0	0	112.5	K441 Q445 D446 F447	K441-N443 PolarHBondContact O-N 2.96Å; K441-N443 VanDerWaalsContact O-N 3.15Å; N443-Q445 PolarHBondContact O-N 2.66Å; N443-D446 WeakPolarHBondContact CB-OD2 3.43Å; N443-D446 PolarHBondContact ND2-OD2 2.85Å; N443-D446 WeakPolarHBondContact O-CB 3.49Å; N443-D446 PolarHBondContact O-N 3.11Å; N443-F447 HydrophobicContact CB-CE2 4.17Å; N443-F447 VanDerWaalsContact O-CD2 3.3Å; N443-F447 WeakPolarHBondContact O-CD2 3.18Å
444	Y	85.6	Confident	90.5	Very high	80 Å²	80	66.8 Å²	66.8	31%	0.314	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-54.9	-21.3	-174.3	74.5	-84.5	0	0	0	114.9	K441 D446	K441-Y444 WeakPolarHBondContact O-CB 3.23Å; K441-Y444 WeakPolarHBondContact O-CD1 3.37Å; K441-Y444 PolarHBondContact O-N 3.43Å; K441-Y444 VanDerWaalsContact O-N 3.11Å; Y444-D446 VanDerWaalsContact C-N 3.34Å
445	Q	87.8	Confident	90.7	Very high	151 Å²	151	65.2 Å²	65.2	71%	0.706	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-72.5	-25.4	177.2	-60.1	-174.6	3.3	0	0	113.1	N443 F447	N443-Q445 PolarHBondContact O-N 2.66Å; Q445-F447 VanDerWaalsContact C-N 3.29Å
446	D	88.5	Confident	90.9	Very high	120 Å²	120	62 Å²	62	64%	0.642	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-79.6	-13.3	178.6	-57.1	-34.3	0	0	0	112.2	N443 Y444	N443-D446 WeakPolarHBondContact CB-OD2 3.43Å; N443-D446 PolarHBondContact ND2-OD2 2.85Å; N443-D446 WeakPolarHBondContact O-CB 3.49Å; N443-D446 PolarHBondContact O-N 3.11Å; Y444-D446 VanDerWaalsContact C-N 3.34Å
447	F	88.2	Confident	91.1	Very high	83 Å²	83	62 Å²	62	36%	0.364	32%	0.316	S	S	.	.			trans	-110.9	156.4	-176.7	-61.5	-78	0	0	0	112	K441 N443 Q445 D451 Q452	K441-F447 HydrophobicContact CD-CD2 4.2Å; K441-F447 HydrophobicContact CD-CE2 4.09Å; N443-F447 HydrophobicContact CB-CE2 4.17Å; N443-F447 VanDerWaalsContact O-CD2 3.3Å; N443-F447 WeakPolarHBondContact O-CD2 3.18Å; Q445-F447 VanDerWaalsContact C-N 3.29Å; F447-D451 HydrophobicContact CB-CB 4.48Å; F447-D451 HydrophobicContact CD1-CB 4.28Å; F447-Q452 HydrophobicContact CB-CG 4.04Å; F447-Q452 WeakPolarHBondContact O-CG 3.49Å; F447-Q452 PolarHBondContact O-NE2 3.4Å
448	Q	86.1	Confident	91.2	Very high	179 Å²	179	62 Å²	62	84%	0.836	32%	0.316	S	S	*	.			trans	-124.1	150.8	174.7	-62.8	-171.4	5.3	0	0	111
449	G	88.1	Confident	91.2	Very high	47 Å²	47	62.7 Å²	62.7	49%	0.485	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	63.6	-139.6	179.3	0	0	0	0	0	113.2	D451 Q452	G449-D451 VanDerWaalsContact C-N 3.25Å; G449-D451 PolarHBondContact O-N 2.93Å; G449-Q452 WeakPolarHBondContact O-CG 3.41Å; G449-Q452 PolarHBondContact O-N 2.91Å
450	N	90.2	Very high	91.3	Very high	38 Å²	38	61.2 Å²	61.2	20%	0.203	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-62.4	-29.7	-171.6	-61.1	-16.6	0	0	0	113.5	Q452 Y453 F472 K473 I474	N450-Q452 PolarHBondContact O-N 3.34Å; N450-Q452 VanDerWaalsContact O-N 3.16Å; N450-Y453 PolarHBondContact O-N 3.35Å; N450-F472 HydrophobicContact CB-CE2 4.46Å; N450-F472 PolarHBondContact ND2-O 3.34Å; N450-K473 WeakPolarHBondContact OD1-CA 3.2Å; N450-I474 HydrophobicContact CB-CD1 4.2Å; N450-I474 HydrophobicContact CB-CG1 4.46Å; N450-I474 PolarHBondContact OD1-N 3.32Å
451	D	89.6	Confident	91.5	Very high	79 Å²	79	56 Å²	56	42%	0.422	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-76.6	1.4	-175	-71.1	-46.3	0	0	0	114.5	K441 F447 G449 Y453 R462	K441-D451 VanDerWaalsContact CD-O 3.28Å; K441-D451 WeakPolarHBondContact CD-O 3.29Å; K441-D451 VanDerWaalsContact CE-O 3.22Å; K441-D451 WeakPolarHBondContact CE-O 3.43Å; K441-D451 PolarHBondContact NZ-O 2.78Å; F447-D451 HydrophobicContact CB-CB 4.48Å; F447-D451 HydrophobicContact CD1-CB 4.28Å; G449-D451 VanDerWaalsContact C-N 3.25Å; G449-D451 PolarHBondContact O-N 2.93Å; D451-Y453 PolarHBondContact O-N 3.25Å; D451-R462 IonicContact OD1-NH2 2.66Å; D451-R462 PolarHBondContact OD1-NH2 3.49Å
452	Q	92.6	Very high	91.7	Very high	52 Å²	52	57.4 Å²	57.4	24%	0.243	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-67	-19.7	162.8	-62.8	-176.4	-22.8	0	0	112.5	K441 F447 G449 N450	K441-Q452 PolarHBondContact N-O 3.03Å; K441-Q452 VanDerWaalsContact N-O 3.11Å; F447-Q452 HydrophobicContact CB-CG 4.04Å; F447-Q452 WeakPolarHBondContact O-CG 3.49Å; F447-Q452 PolarHBondContact O-NE2 3.4Å; G449-Q452 WeakPolarHBondContact O-CG 3.41Å; G449-Q452 PolarHBondContact O-N 2.91Å; N450-Q452 PolarHBondContact O-N 3.34Å; N450-Q452 VanDerWaalsContact O-N 3.16Å
453	Y	94.5	Very high	92.1	Very high	18 Å²	18	54.2 Å²	54.2	7%	0.071	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	152.6	-172.3	-53.9	-81.3	0	0	0	112.9	L433 V438 M439 R440 N450 D451 I474 L476	L433-Y453 HydrophobicContact CD2-CD1 4.2Å; L433-Y453 HydrophobicContact CD2-CE1 4.06Å; V438-Y453 HydrophobicContact CG1-CD1 4.09Å; M439-Y453 WeakPolarHBondContact O-CA 3.44Å; R440-Y453 HydrophobicContact CG-CD1 4.13Å; R440-Y453 HydrophobicContact CG-CE1 3.9Å; N450-Y453 PolarHBondContact O-N 3.35Å; D451-Y453 PolarHBondContact O-N 3.25Å; Y453-I474 HydrophobicContact CD2-CB 4.24Å; Y453-I474 HydrophobicContact CD2-CD1 4.1Å; Y453-I474 HydrophobicContact CD2-CG2 3.95Å; Y453-I474 HydrophobicContact CE2-CB 4.42Å; Y453-I474 HydrophobicContact CE2-CG2 4.03Å; Y453-I474 HydrophobicContact CG-CD1 4.39Å; Y453-I474 HydrophobicContact CG-CG2 4.42Å; Y453-L476 HydrophobicContact CE1-CD1 4.17Å; Y453-L476 HydrophobicContact CE1-CD2 4.05Å; Y453-L476 HydrophobicContact CE1-CG 4.26Å
454	E	94.3	Very high	92.3	Very high	69 Å²	69	50.2 Å²	50.2	32%	0.322	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	169.1	172.9	67.1	-169.3	166.1	0	0	110.8	M439 K441 W792	M439-E454 HydrophobicContact CB-CG 4.43Å; M439-E454 PolarHBondContact N-O 3.38Å; M439-E454 PolarHBondContact O-N 2.88Å; K441-E454 HydrophobicContact CG-CB 4.27Å; K441-E454 VanDerWaalsContact CG-CD 3.49Å; K441-E454 HydrophobicContact CG-CG 3.95Å; E454-W792 HydrophobicContact CB-CH2 4.15Å; E454-W792 HydrophobicContact CG-CH2 4.26Å
455	G	94.6	Very high	92.7	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.238	C	C	.	.	S	Bend	trans	126.4	173.1	-176.5	0	0	0	0	0	113	P436 Y437 C457 V458 D459 W792	P436-G455 CarbonylContact O-C 3.55Å; P436-G455 WeakPolarHBondContact O-CA 3.31Å; Y437-G455 CarbonylContact O-C 3.6Å; Y437-G455 VanDerWaalsContact O-C 3.26Å; Y437-G455 WeakPolarHBondContact O-CA 3.46Å; G455-C457 PolarHBondContact O-N 3.37Å; G455-V458 PolarHBondContact O-N 3.11Å; G455-V458 VanDerWaalsContact O-N 3.14Å; G455-D459 PolarHBondContact O-N 3.34Å; G455-W792 VanDerWaalsContact C-CE2 3.5Å; G455-W792 VanDerWaalsContact CA-CZ2 3.5Å
456	F	95.9	Very high	92.9	Very high	1 Å²	1	44.9 Å²	44.9	0%	0.004	23%	0.231	C	C	.	.	H	α-helix	trans	-55.8	-46.3	-174.4	175.3	-85.5	0	0	0	113.2	P436 Y437 V458 D459 M460 F526 M527 L788 K789 W792 W793	P436-F456 PolarHBondContact O-N 2.93Å; Y437-F456 PolarHBondContact O-N 2.86Å; Y437-F456 VanDerWaalsContact O-N 3.17Å; F456-V458 VanDerWaalsContact C-N 3.32Å; F456-V458 PolarHBondContact O-N 3.38Å; F456-D459 PolarHBondContact O-N 2.91Å; F456-M460 HydrophobicContact CE1-CB 4.5Å; F456-M460 HydrophobicContact CE1-SD 3.94Å; F456-M460 HydrophobicContact CZ-SD 4.41Å; F456-M460 VanDerWaalsContact O-CB 3.32Å; F456-M460 WeakPolarHBondContact O-CB 3.45Å; F456-M460 PolarHBondContact O-N 3.03Å; F456-F526 HydrophobicContact CD1-CE2 4.48Å; F456-F526 AromaticContact CE1-CD2 3.87Å; F456-F526 HydrophobicContact CE1-CD2 3.87Å; F456-F526 AromaticContact CE1-CE2 3.69Å; F456-F526 HydrophobicContact CE1-CE2 3.69Å; F456-F526 HydrophobicContact CZ-CD2 4.35Å; F456-M527 HydrophobicContact CD1-CE 4.42Å; F456-M527 HydrophobicContact CD2-CE 4.36Å; F456-M527 HydrophobicContact CE1-CE 3.87Å; F456-M527 HydrophobicContact CE2-CE 3.77Å; F456-M527 HydrophobicContact CZ-CE 3.51Å; F456-L788 HydrophobicContact CD2-CB 3.81Å; F456-L788 HydrophobicContact CE2-CB 3.6Å; F456-K789 HydrophobicContact CE2-CB 4.3Å; F456-W792 HydrophobicContact CB-CB 4.35Å; F456-W792 HydrophobicContact CB-CG 4.12Å; F456-W793 HydrophobicContact CB-CH2 4.3Å; F456-W793 HydrophobicContact CB-CZ3 3.87Å; F456-W793 AromaticContact CD2-CZ3 3.78Å; F456-W793 HydrophobicContact CD2-CZ3 3.78Å; F456-W793 HydrophobicContact CG-CH2 4.32Å; F456-W793 AromaticContact CG-CZ3 3.89Å; F456-W793 HydrophobicContact CG-CZ3 3.89Å
457	C	96.3	Very high	93	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-70	-31.2	-179	-73.2	0	0	0	0	112.1	Y437 V438 G455 L461 V507	Y437-C457 WeakPolarHBondContact O-CB 3.29Å; Y437-C457 PolarHBondContact O-N 3.16Å; V438-C457 HydrophobicContact CG2-CB 3.77Å; G455-C457 PolarHBondContact O-N 3.37Å; C457-L461 WeakPolarHBondContact O-CB 3.47Å; C457-L461 WeakPolarHBondContact O-CD1 3.28Å; C457-L461 WeakPolarHBondContact O-CG 3.47Å; C457-L461 PolarHBondContact O-N 3Å; C457-V507 HydrophobicContact CB-CG1 3.96Å
458	V	95.8	Very high	93.1	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.006	20%	0.204	C	C	.	.	H	α-helix	trans	-70.5	-42.2	177.4	-168.2	0	0	0	0	110.9	V438 G455 F456 L461 R462 I474	V438-V458 HydrophobicContact CB-CG2 4.42Å; V438-V458 HydrophobicContact CG1-CG2 4.07Å; V438-V458 HydrophobicContact CG2-CG2 4.05Å; G455-V458 PolarHBondContact O-N 3.11Å; G455-V458 VanDerWaalsContact O-N 3.14Å; F456-V458 VanDerWaalsContact C-N 3.32Å; F456-V458 PolarHBondContact O-N 3.38Å; V458-L461 PolarHBondContact O-N 2.92Å; V458-R462 WeakPolarHBondContact O-CG 3.49Å; V458-R462 PolarHBondContact O-N 2.92Å; V458-R462 VanDerWaalsContact O-N 3.13Å; V458-I474 HydrophobicContact CG1-CD1 4.06Å; V458-I474 HydrophobicContact CG2-CD1 4.5Å
459	D	95.9	Very high	93.2	Very high	16 Å²	16	36.4 Å²	36.4	9%	0.086	19%	0.189	C	C	.	.	H	α-helix	trans	-68.7	-41.2	174.4	-74.3	-12.7	0	0	0	112.1	G455 F456 L461 R462 E463 L788 R791 W792	G455-D459 PolarHBondContact O-N 3.34Å; F456-D459 PolarHBondContact O-N 2.91Å; D459-L461 VanDerWaalsContact C-N 3.3Å; D459-L461 PolarHBondContact O-N 3.44Å; D459-R462 WeakPolarHBondContact O-CB 3.24Å; D459-R462 PolarHBondContact O-N 3.08Å; D459-R462 VanDerWaalsContact O-N 3.15Å; D459-R462 IonicContact OD1-NH1 2.67Å; D459-R462 PolarHBondContact OD1-NH1 3.39Å; D459-E463 WeakPolarHBondContact O-CG 3.45Å; D459-E463 PolarHBondContact O-N 3.07Å; D459-L788 HydrophobicContact CB-CD1 4.3Å; D459-L788 HydrophobicContact CB-CD2 3.77Å; D459-R791 IonicContact OD1-NH1 3.6Å; D459-R791 IonicContact OD2-CZ 2.91Å; D459-R791 IonicContact OD2-NH1 3.92Å; D459-R791 PolarHBondContact OD2-NH1 3.5Å; D459-W792 WeakPolarHBondContact OD2-CZ2 3.38Å; D459-W792 PolarHBondContact OD2-NE1 3.15Å
460	M	95.8	Very high	93.3	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-61.1	-38.6	174.9	-174.7	-176.7	72.8	0	0	111.9	F456 E463 L464 V507 F526 I760 L779 L785 L788	F456-M460 HydrophobicContact CE1-CB 4.5Å; F456-M460 HydrophobicContact CE1-SD 3.94Å; F456-M460 HydrophobicContact CZ-SD 4.41Å; F456-M460 VanDerWaalsContact O-CB 3.32Å; F456-M460 WeakPolarHBondContact O-CB 3.45Å; F456-M460 PolarHBondContact O-N 3.03Å; M460-E463 PolarHBondContact O-N 3.29Å; M460-L464 HydrophobicContact CG-CD1 4.32Å; M460-L464 WeakPolarHBondContact O-CB 3.46Å; M460-L464 WeakPolarHBondContact O-CG 3.49Å; M460-L464 PolarHBondContact O-N 2.9Å; M460-V507 HydrophobicContact CE-CG1 3.74Å; M460-F526 HydrophobicContact CE-CD1 3.98Å; M460-F526 HydrophobicContact CE-CD2 4.23Å; M460-F526 HydrophobicContact CE-CE1 4Å; M460-F526 HydrophobicContact CE-CE2 4.26Å; M460-F526 HydrophobicContact CE-CG 4.1Å; M460-F526 HydrophobicContact CE-CZ 4.14Å; M460-F526 HydrophobicContact SD-CB 4.03Å; M460-F526 HydrophobicContact SD-CD1 4.21Å; M460-F526 HydrophobicContact SD-CD2 3.71Å; M460-F526 HydrophobicContact SD-CE2 4.22Å; M460-F526 HydrophobicContact SD-CG 3.72Å; M460-I760 HydrophobicContact CE-CD1 4.26Å; M460-I760 HydrophobicContact CE-CG1 4.48Å; M460-L779 HydrophobicContact CG-CD1 4.48Å; M460-L785 HydrophobicContact CG-CD2 3.97Å; M460-L785 HydrophobicContact SD-CD2 3.89Å; M460-L788 HydrophobicContact CB-CD1 4.18Å
461	L	95.3	Very high	93.4	Very high	5 Å²	5	35.7 Å²	35.7	3%	0.026	18%	0.178	C	C	.	.	H	α-helix	trans	-63.3	-40	173.1	-87.9	161.8	0	0	0	112.7	V429 C457 V458 D459 A465 F472 V507	V429-L461 HydrophobicContact CG1-CD1 3.93Å; V429-L461 HydrophobicContact CG1-CD2 4.27Å; V429-L461 HydrophobicContact CG2-CD2 4.1Å; C457-L461 WeakPolarHBondContact O-CB 3.47Å; C457-L461 WeakPolarHBondContact O-CD1 3.28Å; C457-L461 WeakPolarHBondContact O-CG 3.47Å; C457-L461 PolarHBondContact O-N 3Å; V458-L461 PolarHBondContact O-N 2.92Å; D459-L461 VanDerWaalsContact C-N 3.3Å; D459-L461 PolarHBondContact O-N 3.44Å; L461-A465 VanDerWaalsContact O-CB 3.23Å; L461-A465 WeakPolarHBondContact O-CB 3.35Å; L461-A465 PolarHBondContact O-N 3.09Å; L461-F472 HydrophobicContact CB-CE1 4.17Å; L461-F472 HydrophobicContact CB-CE2 4.12Å; L461-F472 HydrophobicContact CB-CZ 3.79Å; L461-F472 HydrophobicContact CD1-CE2 4.43Å; L461-V507 HydrophobicContact CD1-CB 4.16Å; L461-V507 HydrophobicContact CD1-CG1 4.18Å; L461-V507 HydrophobicContact CD1-CG2 4.43Å; L461-V507 HydrophobicContact CD2-CG2 4.12Å; L461-V507 HydrophobicContact CG-CG1 4.25Å; L461-V507 HydrophobicContact CG-CG2 4.42Å
462	R	95.2	Very high	93.6	Very high	69 Å²	69	33.1 Å²	33.1	26%	0.26	16%	0.163	S	C	.	.	H	α-helix	trans	-61.9	-48.2	173.9	-70.6	174	178.8	117	3	110.9	D451 V458 D459 L464 A465 D466 F472	D451-R462 IonicContact OD1-NH2 2.66Å; D451-R462 PolarHBondContact OD1-NH2 3.49Å; V458-R462 WeakPolarHBondContact O-CG 3.49Å; V458-R462 PolarHBondContact O-N 2.92Å; V458-R462 VanDerWaalsContact O-N 3.13Å; D459-R462 WeakPolarHBondContact O-CB 3.24Å; D459-R462 PolarHBondContact O-N 3.08Å; D459-R462 VanDerWaalsContact O-N 3.15Å; D459-R462 IonicContact OD1-NH1 2.67Å; D459-R462 PolarHBondContact OD1-NH1 3.39Å; R462-L464 PolarHBondContact O-N 3.11Å; R462-A465 WeakPolarHBondContact O-CB 3.31Å; R462-A465 PolarHBondContact O-N 2.92Å; R462-D466 WeakPolarHBondContact O-CB 3.42Å; R462-D466 PolarHBondContact O-N 3.37Å; R462-F472 HydrophobicContact CG-CZ 4.33Å
463	E	94.8	Very high	93.7	Very high	45 Å²	45	37.3 Å²	37.3	21%	0.21	18%	0.18	C	C	.	.	H	α-helix	trans	-63.6	-40.5	179.1	-61.3	-91.3	137.9	0	0	112.4	D459 M460 D466 I467 L779 R784 L788	D459-E463 WeakPolarHBondContact O-CG 3.45Å; D459-E463 PolarHBondContact O-N 3.07Å; M460-E463 PolarHBondContact O-N 3.29Å; E463-D466 PolarHBondContact O-N 3.02Å; E463-I467 WeakPolarHBondContact O-CG1 3.34Å; E463-I467 PolarHBondContact O-N 3.25Å; E463-L779 HydrophobicContact CB-CD1 4.21Å; E463-L779 HydrophobicContact CB-CD2 3.91Å; E463-R784 IonicContact OE1-CZ 2.62Å; E463-R784 IonicContact OE1-NE 2.95Å; E463-R784 IonicContact OE1-NH2 3.06Å; E463-R784 PolarHBondContact OE1-NH2 2.9Å; E463-R784 IonicContact OE2-CZ 3.79Å; E463-R784 VanDerWaalsContact OE2-CZ 3.23Å; E463-R784 IonicContact OE2-NE 2.68Å; E463-R784 PolarHBondContact OE2-NE 3.43Å; E463-R784 IonicContact OE2-NH2 2.93Å; E463-R784 PolarHBondContact OE2-NH2 2.84Å; E463-L788 HydrophobicContact CG-CD1 4.37Å
464	L	94	Very high	93.7	Very high	2 Å²	2	37.2 Å²	37.2	1%	0.01	18%	0.181	C	C	.	.	H	α-helix	trans	-64.5	-41.1	173.6	-75.8	172.3	0	0	0	112	M460 R462 I467 L468 F470 I760 I776 L779	M460-L464 HydrophobicContact CG-CD1 4.32Å; M460-L464 WeakPolarHBondContact O-CB 3.46Å; M460-L464 WeakPolarHBondContact O-CG 3.49Å; M460-L464 PolarHBondContact O-N 2.9Å; R462-L464 PolarHBondContact O-N 3.11Å; L464-I467 PolarHBondContact O-N 2.86Å; L464-L468 WeakPolarHBondContact O-CB 3.45Å; L464-L468 PolarHBondContact O-N 3Å; L464-F470 VanDerWaalsContact C-CE1 3.5Å; L464-F470 HydrophobicContact CB-CE1 4.14Å; L464-F470 HydrophobicContact CB-CZ 4.05Å; L464-F470 WeakPolarHBondContact O-CE1 3.16Å; L464-I760 HydrophobicContact CD1-CD1 3.67Å; L464-I776 HydrophobicContact CD1-CG1 4.41Å; L464-I776 HydrophobicContact CD2-CG1 4.26Å; L464-L779 HydrophobicContact CD2-CD1 3.58Å; L464-L779 HydrophobicContact CD2-CG 4.44Å; L464-L779 HydrophobicContact CG-CD1 3.69Å
465	A	93.4	Very high	93.6	Very high	11 Å²	11	36.6 Å²	36.6	9%	0.091	18%	0.177	C	C	.	.	H	α-helix	trans	-65	-39.5	175.4	0	0	0	0	0	112.1	L461 R462 I467 K469 F470 F472	L461-A465 VanDerWaalsContact O-CB 3.23Å; L461-A465 WeakPolarHBondContact O-CB 3.35Å; L461-A465 PolarHBondContact O-N 3.09Å; R462-A465 WeakPolarHBondContact O-CB 3.31Å; R462-A465 PolarHBondContact O-N 2.92Å; A465-I467 VanDerWaalsContact C-N 3.32Å; A465-I467 PolarHBondContact O-N 3.19Å; A465-K469 WeakPolarHBondContact O-CA 3.21Å; A465-K469 PolarHBondContact O-N 3.38Å; A465-F470 VanDerWaalsContact CA-CE1 3.49Å; A465-F470 HydrophobicContact CB-CD1 4.4Å; A465-F470 HydrophobicContact CB-CD2 4.33Å; A465-F470 HydrophobicContact CB-CE1 4.19Å; A465-F470 HydrophobicContact CB-CE2 4.1Å; A465-F470 HydrophobicContact CB-CG 4.47Å; A465-F470 HydrophobicContact CB-CZ 4.02Å; A465-F470 WeakPolarHBondContact CB-O 3.26Å; A465-F472 HydrophobicContact CB-CD1 3.88Å; A465-F472 HydrophobicContact CB-CE1 3.79Å
466	D	92.4	Very high	93.6	Very high	108 Å²	108	38.6 Å²	38.6	58%	0.578	19%	0.188	S	C	*	.	H	α-helix	trans	-69.2	-27	175.8	-82.2	-38.6	0	0	0	113.1	R462 E463 K469	R462-D466 WeakPolarHBondContact O-CB 3.42Å; R462-D466 PolarHBondContact O-N 3.37Å; E463-D466 PolarHBondContact O-N 3.02Å; D466-K469 WeakPolarHBondContact O-CD 3.38Å; D466-K469 VanDerWaalsContact O-CE 3.23Å; D466-K469 WeakPolarHBondContact O-CE 3.45Å; D466-K469 PolarHBondContact O-NZ 3.33Å
467	I	90.3	Very high	93.6	Very high	56 Å²	56	39.1 Å²	39.1	29%	0.287	19%	0.191	S	C	.	.	H	α-helix	trans	-80.4	-58.5	173	-69.5	170.4	0	0	0	110.9	E463 L464 A465 K469 Q778 L779	E463-I467 WeakPolarHBondContact O-CG1 3.34Å; E463-I467 PolarHBondContact O-N 3.25Å; L464-I467 PolarHBondContact O-N 2.86Å; A465-I467 VanDerWaalsContact C-N 3.32Å; A465-I467 PolarHBondContact O-N 3.19Å; I467-K469 VanDerWaalsContact C-N 3.34Å; I467-K469 PolarHBondContact O-N 3.49Å; I467-Q778 VanDerWaalsContact CG2-OE1 3.3Å; I467-L779 HydrophobicContact CD1-CD2 3.52Å; I467-L779 HydrophobicContact CD1-CG 3.88Å
468	L	89.7	Confident	93.2	Very high	26 Å²	26	44.1 Å²	44.1	14%	0.136	22%	0.218	C	C	.	.	H	α-helix	trans	-86.5	-1.7	-170.6	-60.6	174.8	0	0	0	113.8	L422 A423 L464 F470 I772	L422-L468 CarbonylContact C-O 3.54Å; L422-L468 HydrophobicContact CB-CB 4.06Å; L422-L468 WeakPolarHBondContact CB-O 3.42Å; L422-L468 HydrophobicContact CD2-CB 4.49Å; L422-L468 HydrophobicContact CD2-CD1 4.3Å; A423-L468 PolarHBondContact N-O 2.76Å; A423-L468 VanDerWaalsContact N-O 3.11Å; L464-L468 WeakPolarHBondContact O-CB 3.45Å; L464-L468 PolarHBondContact O-N 3Å; L468-F470 VanDerWaalsContact C-N 3.28Å; L468-F470 HydrophobicContact CB-CD1 3.82Å; L468-F470 HydrophobicContact CB-CE1 3.99Å; L468-F470 HydrophobicContact CD1-CE1 4.27Å; L468-F470 PolarHBondContact O-N 2.78Å; L468-I772 HydrophobicContact CD1-CG1 4.21Å
469	K	89.3	Confident	92.8	Very high	122 Å²	122	47.6 Å²	47.6	53%	0.53	24%	0.237	S	C	.	.			trans	61.8	17.6	174.4	-55	-53	-174.4	-170.5	0	116.7	A423 N424 A465 D466 I467	A423-K469 CarbonylContact C-O 3.59Å; A423-K469 WeakPolarHBondContact CA-O 3.3Å; A423-K469 HydrophobicContact CB-CB 3.92Å; N424-K469 PolarHBondContact N-O 2.55Å; A465-K469 WeakPolarHBondContact O-CA 3.21Å; A465-K469 PolarHBondContact O-N 3.38Å; D466-K469 WeakPolarHBondContact O-CD 3.38Å; D466-K469 VanDerWaalsContact O-CE 3.23Å; D466-K469 WeakPolarHBondContact O-CE 3.45Å; D466-K469 PolarHBondContact O-NZ 3.33Å; I467-K469 VanDerWaalsContact C-N 3.34Å; I467-K469 PolarHBondContact O-N 3.49Å
470	F	90.6	Very high	92.4	Very high	12 Å²	12	48.9 Å²	48.9	5%	0.053	25%	0.254	C	S	.	.			trans	-75.7	155.8	168.5	61.9	-77.3	0	0	0	112.1	L422 L427 L464 A465 L468 F472	L422-F470 HydrophobicContact CB-CB 3.99Å; L422-F470 HydrophobicContact CB-CD1 3.99Å; L422-F470 HydrophobicContact CB-CG 4.38Å; L422-F470 HydrophobicContact CD2-CB 4.23Å; L422-F470 HydrophobicContact CD2-CD1 3.42Å; L422-F470 VanDerWaalsContact CD2-CD1 3.42Å; L422-F470 HydrophobicContact CD2-CE1 3.81Å; L422-F470 HydrophobicContact CD2-CG 3.87Å; L422-F470 HydrophobicContact CG-CB 4.4Å; L422-F470 HydrophobicContact CG-CD1 4.27Å; L422-F470 WeakPolarHBondContact O-CA 3.44Å; L422-F470 WeakPolarHBondContact O-CB 3.49Å; L427-F470 HydrophobicContact CD1-CD2 3.99Å; L427-F470 HydrophobicContact CD1-CE2 4.42Å; L427-F470 HydrophobicContact CD1-CG 4.27Å; L427-F470 HydrophobicContact CG-CD2 4.35Å; L464-F470 VanDerWaalsContact C-CE1 3.5Å; L464-F470 HydrophobicContact CB-CE1 4.14Å; L464-F470 HydrophobicContact CB-CZ 4.05Å; L464-F470 WeakPolarHBondContact O-CE1 3.16Å; A465-F470 VanDerWaalsContact CA-CE1 3.49Å; A465-F470 HydrophobicContact CB-CD1 4.4Å; A465-F470 HydrophobicContact CB-CD2 4.33Å; A465-F470 HydrophobicContact CB-CE1 4.19Å; A465-F470 HydrophobicContact CB-CE2 4.1Å; A465-F470 HydrophobicContact CB-CG 4.47Å; A465-F470 HydrophobicContact CB-CZ 4.02Å; A465-F470 WeakPolarHBondContact CB-O 3.26Å; L468-F470 VanDerWaalsContact C-N 3.28Å; L468-F470 HydrophobicContact CB-CD1 3.82Å; L468-F470 HydrophobicContact CB-CE1 3.99Å; L468-F470 HydrophobicContact CD1-CE1 4.27Å; L468-F470 PolarHBondContact O-N 2.78Å; F470-F472 HydrophobicContact CD2-CB 4.04Å; F470-F472 HydrophobicContact CD2-CD1 4.23Å; F470-F472 HydrophobicContact CE2-CB 4Å; F470-F472 AromaticContact CE2-CD1 3.87Å; F470-F472 HydrophobicContact CE2-CD1 3.87Å; F470-F472 HydrophobicContact CE2-CG 4.28Å
471	S	91.1	Very high	92	Very high	57 Å²	57	53 Å²	53	40%	0.399	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	156.9	156.9	64.6	0	0	0	0	109.5	K425 S426 L427	K425-S471 PolarHBondContact O-N 3.17Å; K425-S471 PolarHBondContact O-OG 2.98Å; S426-S471 VanDerWaalsContact CA-O 3.31Å; S426-S471 WeakPolarHBondContact CA-O 3.41Å; S426-S471 WeakPolarHBondContact CA-OG 3.48Å; S426-S471 WeakPolarHBondContact CB-OG 3.23Å; L427-S471 PolarHBondContact N-O 3.15Å
472	F	93.7	Very high	91.7	Very high	26 Å²	26	55.2 Å²	55.2	11%	0.114	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	161.3	178.4	64.1	-89.3	0	0	0	112.5	L427 V429 N450 L461 R462 A465 F470 I474	L427-F472 CarbonylContact O-C 3.56Å; L427-F472 WeakPolarHBondContact O-CA 3.38Å; V429-F472 HydrophobicContact CG2-CB 3.88Å; V429-F472 HydrophobicContact CG2-CD2 4.37Å; V429-F472 HydrophobicContact CG2-CG 4.44Å; N450-F472 HydrophobicContact CB-CE2 4.46Å; N450-F472 PolarHBondContact ND2-O 3.34Å; L461-F472 HydrophobicContact CB-CE1 4.17Å; L461-F472 HydrophobicContact CB-CE2 4.12Å; L461-F472 HydrophobicContact CB-CZ 3.79Å; L461-F472 HydrophobicContact CD1-CE2 4.43Å; R462-F472 HydrophobicContact CG-CZ 4.33Å; A465-F472 HydrophobicContact CB-CD1 3.88Å; A465-F472 HydrophobicContact CB-CE1 3.79Å; F470-F472 HydrophobicContact CD2-CB 4.04Å; F470-F472 HydrophobicContact CD2-CD1 4.23Å; F470-F472 HydrophobicContact CE2-CB 4Å; F470-F472 AromaticContact CE2-CD1 3.87Å; F470-F472 HydrophobicContact CE2-CD1 3.87Å; F470-F472 HydrophobicContact CE2-CG 4.28Å; F472-I474 HydrophobicContact CD2-CG1 4.09Å; F472-I474 HydrophobicContact CE2-CD1 4.14Å; F472-I474 HydrophobicContact CE2-CG1 3.91Å
473	K	94.1	Very high	91.3	Very high	139 Å²	139	52.2 Å²	52.2	60%	0.604	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.5	119.8	172.5	-177.1	178	177.5	-177.8	0	109.9	L427 V429 N450 K475	L427-K473 PolarHBondContact O-N 3.17Å; V429-K473 PolarHBondContact N-O 3.08Å; N450-K473 WeakPolarHBondContact OD1-CA 3.2Å; K473-K475 PolarHBondContact O-N 2.79Å
474	I	94.9	Very high	90.8	Very high	17 Å²	17	51.6 Å²	51.6	9%	0.087	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	127.4	174.4	-61.5	175.3	0	0	0	109.3	T431 N450 Y453 V458 F472	T431-I474 HydrophobicContact CG2-CG2 3.73Å; N450-I474 HydrophobicContact CB-CD1 4.2Å; N450-I474 HydrophobicContact CB-CG1 4.46Å; N450-I474 PolarHBondContact OD1-N 3.32Å; Y453-I474 HydrophobicContact CD2-CB 4.24Å; Y453-I474 HydrophobicContact CD2-CD1 4.1Å; Y453-I474 HydrophobicContact CD2-CG2 3.95Å; Y453-I474 HydrophobicContact CE2-CB 4.42Å; Y453-I474 HydrophobicContact CE2-CG2 4.03Å; Y453-I474 HydrophobicContact CG-CD1 4.39Å; Y453-I474 HydrophobicContact CG-CG2 4.42Å; V458-I474 HydrophobicContact CG1-CD1 4.06Å; V458-I474 HydrophobicContact CG2-CD1 4.5Å; F472-I474 HydrophobicContact CD2-CG1 4.09Å; F472-I474 HydrophobicContact CE2-CD1 4.14Å; F472-I474 HydrophobicContact CE2-CG1 3.91Å
475	K	93.6	Very high	90.4	Very high	55 Å²	55	54.8 Å²	54.8	24%	0.239	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	138.4	168.1	-167	-138.5	170.9	-172.6	0	108.3	I428 V429 T430 T431 K473 D478 E497	I428-K475 HydrophobicContact CG2-CB 4.29Å; V429-K475 PolarHBondContact O-N 2.75Å; T430-K475 CarbonylContact C-O 3.54Å; T430-K475 WeakPolarHBondContact CA-O 3.04Å; T431-K475 PolarHBondContact N-O 2.75Å; K473-K475 PolarHBondContact O-N 2.79Å; K475-D478 VanDerWaalsContact CE-OD1 3.26Å; K475-D478 WeakPolarHBondContact CE-OD1 3.32Å; K475-D478 IonicContact NZ-OD1 3.81Å; K475-D478 PolarHBondContact NZ-OD1 2.84Å; K475-D478 IonicContact NZ-OD2 3.59Å; K475-D478 PolarHBondContact NZ-OD2 3.21Å; K475-E497 VanDerWaalsContact NZ-CD 3.26Å; K475-E497 IonicContact NZ-OE1 3.98Å; K475-E497 PolarHBondContact NZ-OE1 3.45Å; K475-E497 IonicContact NZ-OE2 2.72Å; K475-E497 PolarHBondContact NZ-OE2 2.88Å
476	L	94.4	Very high	89.8	Confident	42 Å²	42	58.1 Å²	58.1	22%	0.22	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	140.7	165.4	-64	176.7	0	0	0	109.2	T431 L433 R440 Y453	T431-L476 HydrophobicContact CG2-CD2 3.96Å; T431-L476 WeakPolarHBondContact O-CA 3.46Å; L433-L476 HydrophobicContact CD1-CD1 4.27Å; L433-L476 HydrophobicContact CD2-CD2 3.89Å; L433-L476 HydrophobicContact CG-CD1 4.32Å; L433-L476 HydrophobicContact CG-CD2 3.95Å; R440-L476 VanDerWaalsContact NH2-CD1 3.27Å; Y453-L476 HydrophobicContact CE1-CD1 4.17Å; Y453-L476 HydrophobicContact CE1-CD2 4.05Å; Y453-L476 HydrophobicContact CE1-CG 4.26Å
477	V	94.7	Very high	89.2	Confident	13 Å²	13	59.9 Å²	59.9	8%	0.079	33%	0.328	C	S	.	.			trans	-60.5	136.5	176.4	61.3	0	0	0	0	111.6	T431 I432 D479 G480 M494 E497	T431-V477 PolarHBondContact O-N 2.76Å; I432-V477 HydrophobicContact CB-CG1 4.28Å; V477-D479 VanDerWaalsContact C-N 3.31Å; V477-D479 WeakPolarHBondContact CG2-OD1 3.33Å; V477-D479 PolarHBondContact O-N 3.23Å; V477-G480 PolarHBondContact O-N 2.89Å; V477-M494 HydrophobicContact CB-CG 3.82Å; V477-M494 HydrophobicContact CG1-CG 4.25Å; V477-M494 HydrophobicContact CG2-CG 3.89Å; V477-E497 WeakPolarHBondContact CA-OE1 3.16Å; V477-E497 HydrophobicContact CG2-CG 4.3Å
478	D	89.4	Confident	88.6	Confident	104 Å²	104	62.5 Å²	62.5	56%	0.556	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-32.8	-168.9	-69.1	-29.2	0	0	0	114.3	K475 E497 K502	K475-D478 VanDerWaalsContact CE-OD1 3.26Å; K475-D478 WeakPolarHBondContact CE-OD1 3.32Å; K475-D478 IonicContact NZ-OD1 3.81Å; K475-D478 PolarHBondContact NZ-OD1 2.84Å; K475-D478 IonicContact NZ-OD2 3.59Å; K475-D478 PolarHBondContact NZ-OD2 3.21Å; D478-E497 PolarHBondContact N-OE1 3.46Å; D478-K502 IonicContact OD2-NZ 2.79Å; D478-K502 PolarHBondContact OD2-NZ 3.04Å
479	D	87.4	Confident	88	Confident	75 Å²	75	64.2 Å²	64.2	40%	0.401	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	-3.9	-173.4	66.3	2.4	0	0	0	114.5	V477 L481 G493	V477-D479 VanDerWaalsContact C-N 3.31Å; V477-D479 WeakPolarHBondContact CG2-OD1 3.33Å; V477-D479 PolarHBondContact O-N 3.23Å; D479-L481 VanDerWaalsContact C-N 3.35Å; D479-L481 WeakPolarHBondContact OD1-CB 3.48Å; D479-L481 PolarHBondContact OD1-N 3.2Å; D479-G493 VanDerWaalsContact OD1-CA 3.32Å; D479-G493 WeakPolarHBondContact OD1-CA 3.32Å; D479-G493 WeakPolarHBondContact OD2-CA 3.21Å; D479-G493 PolarHBondContact OD2-N 3.34Å
480	G	86.9	Confident	87.8	Confident	43 Å²	43	61 Å²	61	44%	0.443	36%	0.36	S	S	.	.	S	Bend	trans	72.4	18.1	-175.1	0	0	0	0	0	115.4	I432 V477	I432-G480 VanDerWaalsContact CD1-O 3.24Å; I432-G480 WeakPolarHBondContact CD1-O 3.3Å; V477-G480 PolarHBondContact O-N 2.89Å
481	L	87.8	Confident	87.6	Confident	87 Å²	87	62.3 Å²	62.3	46%	0.455	36%	0.364	S	S	.	.			trans	-112.5	149.5	-176.2	-60.1	177.8	0	0	0	113.9	D479 G483 G493 M494	D479-L481 VanDerWaalsContact C-N 3.35Å; D479-L481 WeakPolarHBondContact OD1-CB 3.48Å; D479-L481 PolarHBondContact OD1-N 3.2Å; L481-G483 PolarHBondContact O-N 2.87Å; L481-G493 WeakPolarHBondContact O-CA 3.26Å; L481-M494 PolarHBondContact O-N 2.7Å; L481-M494 VanDerWaalsContact O-N 3.16Å
482	Y	88.1	Confident	87.6	Confident	50 Å²	50	61 Å²	61	20%	0.196	35%	0.354	C	S	.	.			trans	-64.8	-27	168.6	-83.7	-70.7	0	0	0	113.7	I432 E434 M494 A508 G509 F510	I432-Y482 HydrophobicContact CD1-CD2 4.29Å; I432-Y482 HydrophobicContact CD1-CE2 4.24Å; I432-Y482 HydrophobicContact CG2-CD1 4.49Å; I432-Y482 HydrophobicContact CG2-CE1 3.86Å; I432-Y482 HydrophobicContact CG2-CE2 4.49Å; E434-Y482 PolarHBondContact OE1-OH 3.35Å; E434-Y482 PolarHBondContact OE2-OH 3.48Å; Y482-M494 HydrophobicContact CD1-CE 3.35Å; Y482-M494 HydrophobicContact CE1-CE 3.72Å; Y482-M494 HydrophobicContact CG-CE 4.23Å; Y482-A508 HydrophobicContact CE1-CB 4.2Å; Y482-G509 WeakPolarHBondContact CE1-O 3.47Å; Y482-F510 AromaticContact CD1-CD2 3.98Å; Y482-F510 HydrophobicContact CD1-CD2 3.98Å
483	G	87.1	Confident	87.4	Confident	6 Å²	6	60 Å²	60	6%	0.062	35%	0.351	C	S	.	.			trans	99.2	127.8	-178	0	0	0	0	0	114	L481 T492 R516	L481-G483 PolarHBondContact O-N 2.87Å; G483-T492 WeakPolarHBondContact CA-O 3.46Å; G483-R516 PolarHBondContact O-NH2 2.94Å
484	A	84.3	Confident	87.4	Confident	33 Å²	33	53.3 Å²	53.3	27%	0.273	32%	0.322	S	S	.	.			trans	-139.8	154.9	178.9	0	0	0	0	0	109.8	W491 T492	A484-W491 VanDerWaalsContact C-CE3 3.41Å; A484-T492 PolarHBondContact N-OG1 2.7Å; A484-T492 PolarHBondContact O-N 2.67Å; A484-T492 VanDerWaalsContact O-N 3.17Å; A484-T492 PolarHBondContact O-OG1 2.76Å
485	P	84.6	Confident	87.3	Confident	68 Å²	68	52.5 Å²	52.5	44%	0.442	32%	0.318	S	S	.	.	B	Isolated β-bridge	trans	-74.5	138.4	-179.6	30	-33.8	0	0	0	111.7	W491	P485-W491 HydrophobicContact CB-CD2 4.18Å; P485-W491 HydrophobicContact CB-CE3 4.47Å; P485-W491 HydrophobicContact CB-CH2 4.25Å; P485-W491 HydrophobicContact CB-CZ2 3.91Å; P485-W491 HydrophobicContact CG-CH2 4.23Å; P485-W491 HydrophobicContact CG-CZ2 4.31Å; P485-W491 HydrophobicContact CG-CZ3 4.49Å
486	E	82.3	Confident	87.1	Confident	81 Å²	81	50.1 Å²	50.1	38%	0.379	31%	0.309	S	S	.	.			trans	-94.9	158.2	174.1	-76.3	-164.9	172.4	0	0	112.5	N488 G489 S490 T492	E486-N488 WeakPolarHBondContact CB-OD1 3.46Å; E486-N488 PolarHBondContact O-N 2.91Å; E486-N488 PolarHBondContact OE2-ND2 2.88Å; E486-N488 PolarHBondContact OE2-OD1 2.81Å; E486-G489 PolarHBondContact O-N 2.75Å; E486-S490 PolarHBondContact N-O 3.47Å; E486-S490 PolarHBondContact OE2-OG 2.83Å; E486-T492 HydrophobicContact CG-CG2 4.14Å; E486-T492 WeakPolarHBondContact OE1-CG2 3.49Å
487	P	79.3	Confident	86.9	Confident	145 Å²	145	48.4 Å²	48.4	94%	0.942	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-15.9	177.6	-23.3	34.5	0	0	0	115.3	G489	P487-G489 VanDerWaalsContact C-N 3.33Å
488	N	78.2	Confident	86.7	Confident	112 Å²	112	47.8 Å²	47.8	60%	0.599	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	0	175.2	58	23.9	0	0	0	113.3	E486 S490	E486-N488 WeakPolarHBondContact CB-OD1 3.46Å; E486-N488 PolarHBondContact O-N 2.91Å; E486-N488 PolarHBondContact OE2-ND2 2.88Å; E486-N488 PolarHBondContact OE2-OD1 2.81Å; N488-S490 VanDerWaalsContact C-N 3.3Å; N488-S490 VanDerWaalsContact OD1-CB 3.23Å; N488-S490 WeakPolarHBondContact OD1-CB 3.37Å; N488-S490 PolarHBondContact OD1-N 3.42Å; N488-S490 PolarHBondContact OD1-OG 3.25Å
489	G	76.6	Confident	86.5	Confident	62 Å²	62	46.2 Å²	46.2	64%	0.639	29%	0.287	S	S	*	.	S	Bend	trans	84.6	-5.9	-176.8	0	0	0	0	0	114.9	E486 P487	E486-G489 PolarHBondContact O-N 2.75Å; P487-G489 VanDerWaalsContact C-N 3.33Å
490	S	84.3	Confident	86.3	Confident	54 Å²	54	48.1 Å²	48.1	38%	0.378	30%	0.297	S	S	.	.			trans	-79.1	176.1	173.4	83.9	0	0	0	0	112.1	E486 N488	E486-S490 PolarHBondContact N-O 3.47Å; E486-S490 PolarHBondContact OE2-OG 2.83Å; N488-S490 VanDerWaalsContact C-N 3.3Å; N488-S490 VanDerWaalsContact OD1-CB 3.23Å; N488-S490 WeakPolarHBondContact OD1-CB 3.37Å; N488-S490 PolarHBondContact OD1-N 3.42Å; N488-S490 PolarHBondContact OD1-OG 3.25Å
491	W	88	Confident	86	Confident	39 Å²	39	51.1 Å²	51.1	15%	0.148	30%	0.295	C	S	.	.	B	Isolated β-bridge	trans	-133.2	139.2	-179.7	-76.6	75.1	0	0	0	111.2	A484 P485 V495 G496 I499 E515 R516 V519	A484-W491 VanDerWaalsContact C-CE3 3.41Å; P485-W491 HydrophobicContact CB-CD2 4.18Å; P485-W491 HydrophobicContact CB-CE3 4.47Å; P485-W491 HydrophobicContact CB-CH2 4.25Å; P485-W491 HydrophobicContact CB-CZ2 3.91Å; P485-W491 HydrophobicContact CG-CH2 4.23Å; P485-W491 HydrophobicContact CG-CZ2 4.31Å; P485-W491 HydrophobicContact CG-CZ3 4.49Å; W491-V495 HydrophobicContact CB-CB 4.46Å; W491-V495 HydrophobicContact CB-CG1 4.09Å; W491-V495 HydrophobicContact CD2-CB 4.41Å; W491-V495 HydrophobicContact CD2-CG1 3.65Å; W491-V495 HydrophobicContact CE3-CB 3.8Å; W491-V495 HydrophobicContact CE3-CG1 3.41Å; W491-V495 VanDerWaalsContact CE3-CG1 3.41Å; W491-V495 HydrophobicContact CE3-CG2 4.12Å; W491-V495 HydrophobicContact CG-CG1 3.98Å; W491-V495 HydrophobicContact CZ3-CB 4.42Å; W491-V495 HydrophobicContact CZ3-CG1 4Å; W491-V495 HydrophobicContact CZ3-CG2 4.26Å; W491-G496 VanDerWaalsContact O-CA 3.23Å; W491-G496 WeakPolarHBondContact O-CA 3.43Å; W491-I499 HydrophobicContact CB-CD1 3.88Å; W491-I499 HydrophobicContact CG-CD1 3.77Å; W491-E515 HydrophobicContact CH2-CB 4.02Å; W491-R516 HydrophobicContact CH2-CG 4.15Å; W491-R516 HydrophobicContact CZ3-CG 4Å; W491-V519 HydrophobicContact CD2-CG2 4.35Å; W491-V519 HydrophobicContact CH2-CG2 4.45Å; W491-V519 HydrophobicContact CZ2-CG1 4.47Å; W491-V519 HydrophobicContact CZ2-CG2 3.87Å
492	T	89.7	Confident	85.7	Confident	29 Å²	29	52.1 Å²	52.1	18%	0.178	30%	0.296	C	S	.	.			trans	-83	175.3	172.1	47.5	0	0	0	0	112	G483 A484 E486 G496	G483-T492 WeakPolarHBondContact CA-O 3.46Å; A484-T492 PolarHBondContact N-OG1 2.7Å; A484-T492 PolarHBondContact O-N 2.67Å; A484-T492 VanDerWaalsContact O-N 3.17Å; A484-T492 PolarHBondContact O-OG1 2.76Å; E486-T492 HydrophobicContact CG-CG2 4.14Å; E486-T492 WeakPolarHBondContact OE1-CG2 3.49Å; T492-G496 PolarHBondContact O-N 3.39Å
493	G	90.9	Very high	85.7	Confident	5 Å²	5	49.8 Å²	49.8	5%	0.052	29%	0.287	C	S	.	.	H	α-helix	trans	62.2	-158.3	165.3	0	0	0	0	0	116	D479 L481 V495 G496 E497	D479-G493 VanDerWaalsContact OD1-CA 3.32Å; D479-G493 WeakPolarHBondContact OD1-CA 3.32Å; D479-G493 WeakPolarHBondContact OD2-CA 3.21Å; D479-G493 PolarHBondContact OD2-N 3.34Å; L481-G493 WeakPolarHBondContact O-CA 3.26Å; G493-V495 PolarHBondContact O-N 3.43Å; G493-G496 CarbonylContact O-C 3.5Å; G493-G496 WeakPolarHBondContact O-CA 3.34Å; G493-G496 PolarHBondContact O-N 3.46Å; G493-E497 PolarHBondContact O-N 2.98Å
494	M	93.9	Very high	85.9	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-58.1	-33.7	-179.7	-68	-176.4	-74.5	0	0	112.6	T430 I432 V477 L481 Y482 E497 L498 A506 A508 F510	T430-M494 HydrophobicContact CG2-CB 3.99Å; T430-M494 HydrophobicContact CG2-CG 3.88Å; T430-M494 HydrophobicContact CG2-SD 4.42Å; I432-M494 HydrophobicContact CB-CE 4.11Å; I432-M494 HydrophobicContact CG2-CE 3.73Å; I432-M494 HydrophobicContact CG2-SD 4.48Å; V477-M494 HydrophobicContact CB-CG 3.82Å; V477-M494 HydrophobicContact CG1-CG 4.25Å; V477-M494 HydrophobicContact CG2-CG 3.89Å; L481-M494 PolarHBondContact O-N 2.7Å; L481-M494 VanDerWaalsContact O-N 3.16Å; Y482-M494 HydrophobicContact CD1-CE 3.35Å; Y482-M494 HydrophobicContact CE1-CE 3.72Å; Y482-M494 HydrophobicContact CG-CE 4.23Å; M494-E497 PolarHBondContact O-N 2.75Å; M494-L498 WeakPolarHBondContact O-CG 3.4Å; M494-L498 PolarHBondContact O-N 3Å; M494-A506 HydrophobicContact CB-CB 4.19Å; M494-A506 HydrophobicContact SD-CB 4.47Å; M494-A508 HydrophobicContact CE-CB 3.97Å; M494-A508 HydrophobicContact SD-CB 4.32Å; M494-F510 HydrophobicContact CE-CD2 4.34Å
495	V	92.1	Very high	86.3	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-61.3	-46.8	172.4	-176.5	0	0	0	0	110.8	W491 G493 E497 L498 I499 F510 R516 V519 I520	W491-V495 HydrophobicContact CB-CB 4.46Å; W491-V495 HydrophobicContact CB-CG1 4.09Å; W491-V495 HydrophobicContact CD2-CB 4.41Å; W491-V495 HydrophobicContact CD2-CG1 3.65Å; W491-V495 HydrophobicContact CE3-CB 3.8Å; W491-V495 HydrophobicContact CE3-CG1 3.41Å; W491-V495 VanDerWaalsContact CE3-CG1 3.41Å; W491-V495 HydrophobicContact CE3-CG2 4.12Å; W491-V495 HydrophobicContact CG-CG1 3.98Å; W491-V495 HydrophobicContact CZ3-CB 4.42Å; W491-V495 HydrophobicContact CZ3-CG1 4Å; W491-V495 HydrophobicContact CZ3-CG2 4.26Å; G493-V495 PolarHBondContact O-N 3.43Å; V495-E497 VanDerWaalsContact C-N 3.35Å; V495-E497 PolarHBondContact O-N 3Å; V495-L498 PolarHBondContact O-N 3.17Å; V495-I499 HydrophobicContact CG1-CD1 3.74Å; V495-I499 HydrophobicContact CG1-CG1 4.47Å; V495-I499 VanDerWaalsContact O-CG1 3.31Å; V495-I499 WeakPolarHBondContact O-CG1 3.49Å; V495-I499 PolarHBondContact O-N 2.99Å; V495-F510 HydrophobicContact CG2-CE2 4.05Å; V495-F510 HydrophobicContact CG2-CZ 3.75Å; V495-R516 HydrophobicContact CG2-CG 3.91Å; V495-V519 HydrophobicContact CG1-CG2 3.87Å; V495-I520 HydrophobicContact CG1-CD1 4.3Å; V495-I520 HydrophobicContact CG1-CG1 4.46Å; V495-I520 HydrophobicContact CG1-CG2 4.29Å; V495-I520 HydrophobicContact CG2-CD1 4.16Å
496	G	89.4	Confident	86.9	Confident	5 Å²	5	47 Å²	47	5%	0.052	26%	0.262	C	S	.	.	H	α-helix	trans	-61.1	-39.3	174.8	0	0	0	0	0	113.2	W491 T492 G493 N500	W491-G496 VanDerWaalsContact O-CA 3.23Å; W491-G496 WeakPolarHBondContact O-CA 3.43Å; T492-G496 PolarHBondContact O-N 3.39Å; G493-G496 CarbonylContact O-C 3.5Å; G493-G496 WeakPolarHBondContact O-CA 3.34Å; G493-G496 PolarHBondContact O-N 3.46Å; G496-N500 WeakPolarHBondContact O-CB 3.33Å; G496-N500 PolarHBondContact O-N 3.49Å; G496-N500 PolarHBondContact O-ND2 2.85Å
497	E	90.8	Very high	87.6	Confident	6 Å²	6	43.2 Å²	43.2	3%	0.028	24%	0.244	C	C	.	.	H	α-helix	trans	-65.5	-39.8	176.2	-67	-163	169.4	0	0	112.9	T430 K475 V477 D478 G493 M494 V495 R501 K502	T430-E497 VanDerWaalsContact CB-OE2 3.25Å; T430-E497 WeakPolarHBondContact CB-OE2 3.17Å; T430-E497 HydrophobicContact CG2-CB 4.46Å; T430-E497 PolarHBondContact OG1-OE2 3.13Å; K475-E497 VanDerWaalsContact NZ-CD 3.26Å; K475-E497 IonicContact NZ-OE1 3.98Å; K475-E497 PolarHBondContact NZ-OE1 3.45Å; K475-E497 IonicContact NZ-OE2 2.72Å; K475-E497 PolarHBondContact NZ-OE2 2.88Å; V477-E497 WeakPolarHBondContact CA-OE1 3.16Å; V477-E497 HydrophobicContact CG2-CG 4.3Å; D478-E497 PolarHBondContact N-OE1 3.46Å; G493-E497 PolarHBondContact O-N 2.98Å; M494-E497 PolarHBondContact O-N 2.75Å; V495-E497 VanDerWaalsContact C-N 3.35Å; V495-E497 PolarHBondContact O-N 3Å; E497-R501 PolarHBondContact O-N 3.37Å; E497-R501 VanDerWaalsContact O-N 3.13Å; E497-K502 HydrophobicContact CB-CB 4.05Å; E497-K502 HydrophobicContact CG-CB 4.37Å; E497-K502 HydrophobicContact CG-CD 4.06Å; E497-K502 PolarHBondContact O-N 3.11Å
498	L	90.5	Very high	88.3	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-67.5	-43.7	175.3	-69.1	177.5	0	0	0	112.5	M494 V495 R501 A506 I520 P763	M494-L498 WeakPolarHBondContact O-CG 3.4Å; M494-L498 PolarHBondContact O-N 3Å; V495-L498 PolarHBondContact O-N 3.17Å; L498-R501 PolarHBondContact O-N 3.06Å; L498-R501 VanDerWaalsContact O-N 3.09Å; L498-A506 HydrophobicContact CD1-CB 3.7Å; L498-A506 HydrophobicContact CD2-CB 4.31Å; L498-A506 HydrophobicContact CG-CB 4.14Å; L498-I520 HydrophobicContact CB-CG2 3.74Å; L498-I520 HydrophobicContact CD1-CB 4.33Å; L498-I520 HydrophobicContact CD1-CD1 3.85Å; L498-I520 HydrophobicContact CD1-CG2 4.06Å; L498-P763 HydrophobicContact CD2-CG 4.36Å
499	I	85.3	Confident	89	Confident	70 Å²	70	31.1 Å²	31.1	36%	0.359	17%	0.172	S	C	.	.	H	α-helix	trans	-62.6	-44.2	178.2	-69.4	165.4	0	0	0	110.7	W491 V495 R501 V519 I520	W491-I499 HydrophobicContact CB-CD1 3.88Å; W491-I499 HydrophobicContact CG-CD1 3.77Å; V495-I499 HydrophobicContact CG1-CD1 3.74Å; V495-I499 HydrophobicContact CG1-CG1 4.47Å; V495-I499 VanDerWaalsContact O-CG1 3.31Å; V495-I499 WeakPolarHBondContact O-CG1 3.49Å; V495-I499 PolarHBondContact O-N 2.99Å; I499-R501 PolarHBondContact O-N 3.2Å; I499-V519 HydrophobicContact CD1-CB 3.8Å; I499-V519 HydrophobicContact CD1-CG2 3.84Å; I499-V519 HydrophobicContact CG1-CB 4.33Å; I499-I520 HydrophobicContact CG1-CG2 3.9Å
500	N	82.6	Confident	89.8	Confident	116 Å²	116	28.1 Å²	28.1	62%	0.62	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.2	6.4	176.6	-68.6	-73.7	0	0	0	113.5	G496 K502	G496-N500 WeakPolarHBondContact O-CB 3.33Å; G496-N500 PolarHBondContact O-N 3.49Å; G496-N500 PolarHBondContact O-ND2 2.85Å; N500-K502 HydrophobicContact CB-CG 4.43Å; N500-K502 PolarHBondContact O-N 3.25Å; N500-K502 VanDerWaalsContact O-N 3.11Å
501	R	79.3	Confident	90.2	Very high	105 Å²	105	25.7 Å²	25.7	40%	0.396	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.6	34.2	-177.9	-60.2	-177.2	179.4	-106.8	-1.4	114	E497 L498 I499 A503 P763	E497-R501 PolarHBondContact O-N 3.37Å; E497-R501 VanDerWaalsContact O-N 3.13Å; L498-R501 PolarHBondContact O-N 3.06Å; L498-R501 VanDerWaalsContact O-N 3.09Å; I499-R501 PolarHBondContact O-N 3.2Å; R501-A503 VanDerWaalsContact C-N 3.27Å; R501-P763 HydrophobicContact CG-CB 4.5Å
502	K	82.8	Confident	90.5	Very high	109 Å²	109	25.8 Å²	25.8	47%	0.474	13%	0.128	S	C	.	.	S	Bend	trans	-73.4	-18.8	169.5	-77	-179.1	166	-173.9	0	112.8	D478 E497 N500	D478-K502 IonicContact OD2-NZ 2.79Å; D478-K502 PolarHBondContact OD2-NZ 3.04Å; E497-K502 HydrophobicContact CB-CB 4.05Å; E497-K502 HydrophobicContact CG-CB 4.37Å; E497-K502 HydrophobicContact CG-CD 4.06Å; E497-K502 PolarHBondContact O-N 3.11Å; N500-K502 HydrophobicContact CB-CG 4.43Å; N500-K502 PolarHBondContact O-N 3.25Å; N500-K502 VanDerWaalsContact O-N 3.11Å
503	A	88.9	Confident	90.5	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.008	13%	0.127	C	C	.	.			trans	-145.7	151.7	178.2	0	0	0	0	0	110.1	I428 T430 R501	I428-A503 HydrophobicContact CG2-CB 4.1Å; T430-A503 HydrophobicContact CG2-CB 3.8Å; R501-A503 VanDerWaalsContact C-N 3.27Å
504	D	89.2	Confident	90.4	Very high	47 Å²	47	29.2 Å²	29.2	25%	0.251	15%	0.151	S	C	.	.	S	Bend	trans	-87.7	-32	179.3	-58.2	-68.5	0	0	0	112.2	L427 I428 P763	L427-D504 HydrophobicContact CB-CB 4.26Å; L427-D504 HydrophobicContact CD2-CB 4.12Å; I428-D504 PolarHBondContact N-OD2 3.24Å; I428-D504 PolarHBondContact O-N 3.13Å; D504-P763 WeakPolarHBondContact O-CD 3.4Å
505	L	94.4	Very high	90.1	Very high	2 Å²	2	32 Å²	32	1%	0.01	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	144.8	-178.1	-58	177.8	0	0	0	110.9	L427 I428 V429 T430 V507 I760 G761 M762 I772	L427-L505 HydrophobicContact CD1-CD1 3.79Å; L427-L505 HydrophobicContact CD1-CG 4.31Å; I428-L505 PolarHBondContact O-N 3.04Å; V429-L505 CarbonylContact C-O 3.59Å; V429-L505 WeakPolarHBondContact CA-O 3.39Å; V429-L505 HydrophobicContact CG1-CB 4.4Å; V429-L505 HydrophobicContact CG2-CB 4.26Å; V429-L505 HydrophobicContact CG2-CD1 4.26Å; T430-L505 PolarHBondContact N-O 3.11Å; L505-V507 HydrophobicContact CB-CG2 4.42Å; L505-I760 HydrophobicContact CB-CG2 4.34Å; L505-I760 HydrophobicContact CD2-CG2 4.04Å; L505-G761 CarbonylContact C-O 3.53Å; L505-G761 WeakPolarHBondContact CA-O 3.41Å; L505-M762 HydrophobicContact CD2-CG 3.48Å; L505-M762 VanDerWaalsContact CD2-CG 3.48Å; L505-M762 HydrophobicContact CD2-SD 4.09Å; L505-I772 HydrophobicContact CD1-CD1 3.89Å; L505-I772 HydrophobicContact CD2-CD1 3.38Å; L505-I772 HydrophobicContact CG-CD1 4.3Å
506	A	96.6	Very high	90	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	120.9	164.8	0	0	0	0	0	109.9	T430 M494 L498 F510 G761	T430-A506 HydrophobicContact CG2-CB 3.73Å; T430-A506 WeakPolarHBondContact O-CA 3.2Å; M494-A506 HydrophobicContact CB-CB 4.19Å; M494-A506 HydrophobicContact SD-CB 4.47Å; L498-A506 HydrophobicContact CD1-CB 3.7Å; L498-A506 HydrophobicContact CD2-CB 4.31Å; L498-A506 HydrophobicContact CG-CB 4.14Å; A506-F510 HydrophobicContact CB-CD1 4.33Å; A506-F510 HydrophobicContact CB-CE1 4.17Å; A506-G761 PolarHBondContact N-O 2.87Å; A506-G761 PolarHBondContact O-N 2.97Å
507	V	96.5	Very high	90.1	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.191	C	C	.	.			trans	-131.8	110.4	-178	-172.4	0	0	0	0	110.2	V429 T430 T431 C457 M460 L461 L505 I760	V429-V507 HydrophobicContact CG1-CB 4.02Å; V429-V507 HydrophobicContact CG1-CG2 3.81Å; T430-V507 PolarHBondContact O-N 2.83Å; T430-V507 VanDerWaalsContact O-N 3.13Å; T431-V507 WeakPolarHBondContact CB-O 3.44Å; T431-V507 PolarHBondContact OG1-O 3.28Å; C457-V507 HydrophobicContact CB-CG1 3.96Å; M460-V507 HydrophobicContact CE-CG1 3.74Å; L461-V507 HydrophobicContact CD1-CB 4.16Å; L461-V507 HydrophobicContact CD1-CG1 4.18Å; L461-V507 HydrophobicContact CD1-CG2 4.43Å; L461-V507 HydrophobicContact CD2-CG2 4.12Å; L461-V507 HydrophobicContact CG-CG1 4.25Å; L461-V507 HydrophobicContact CG-CG2 4.42Å; L505-V507 HydrophobicContact CB-CG2 4.42Å; V507-I760 HydrophobicContact CG1-CG1 4.49Å; V507-I760 HydrophobicContact CG2-CB 4.47Å; V507-I760 HydrophobicContact CG2-CD1 3.99Å; V507-I760 HydrophobicContact CG2-CG1 4Å; V507-I760 HydrophobicContact CG2-CG2 3.9Å
508	A	94.5	Very high	90	Very high	2 Å²	2	45 Å²	45	2%	0.017	22%	0.22	C	C	.	.	S	Bend	trans	-161.1	-164.5	179.4	0	0	0	0	0	109.6	I432 Y482 M494 F510	I432-A508 HydrophobicContact CG2-CB 3.81Å; Y482-A508 HydrophobicContact CE1-CB 4.2Å; M494-A508 HydrophobicContact CE-CB 3.97Å; M494-A508 HydrophobicContact SD-CB 4.32Å; A508-F510 HydrophobicContact CB-CB 4.48Å; A508-F510 PolarHBondContact O-N 3.12Å
509	G	92.2	Very high	89.8	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.01	23%	0.229	C	C	.	.	S	Bend	trans	-65.9	55.1	159.2	0	0	0	0	0	112.4	Y482 T511 Y758	Y482-G509 WeakPolarHBondContact CE1-O 3.47Å; G509-T511 PolarHBondContact O-N 3.07Å; G509-Y758 WeakPolarHBondContact O-CD1 3.36Å; G509-Y758 WeakPolarHBondContact O-CE1 3.29Å
510	F	93	Very high	90.2	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.212	C	C	.	.			trans	-91.9	92.1	-163.7	-166.4	-139.1	0	0	0	111.7	Y482 M494 V495 A506 A508 I512 I520 F522 Y758 G759	Y482-F510 AromaticContact CD1-CD2 3.98Å; Y482-F510 HydrophobicContact CD1-CD2 3.98Å; M494-F510 HydrophobicContact CE-CD2 4.34Å; V495-F510 HydrophobicContact CG2-CE2 4.05Å; V495-F510 HydrophobicContact CG2-CZ 3.75Å; A506-F510 HydrophobicContact CB-CD1 4.33Å; A506-F510 HydrophobicContact CB-CE1 4.17Å; A508-F510 HydrophobicContact CB-CB 4.48Å; A508-F510 PolarHBondContact O-N 3.12Å; F510-I512 PolarHBondContact O-N 3.1Å; F510-I520 HydrophobicContact CE1-CD1 3.69Å; F510-I520 HydrophobicContact CZ-CD1 3.68Å; F510-F522 HydrophobicContact CD1-CD1 4.47Å; F510-F522 AromaticContact CD1-CE1 3.51Å; F510-F522 HydrophobicContact CD1-CE1 3.51Å; F510-F522 HydrophobicContact CD1-CZ 4.12Å; F510-F522 AromaticContact CE1-CE1 3.5Å; F510-F522 HydrophobicContact CE1-CE1 3.5Å; F510-F522 VanDerWaalsContact CE1-CE1 3.5Å; F510-F522 AromaticContact CE1-CZ 3.68Å; F510-F522 HydrophobicContact CE1-CZ 3.68Å; F510-F522 HydrophobicContact CG-CE1 4.39Å; F510-F522 HydrophobicContact CZ-CE1 4.39Å; F510-F522 HydrophobicContact CZ-CZ 4.19Å; F510-Y758 WeakPolarHBondContact O-CA 3.11Å; F510-G759 PolarHBondContact O-N 2.95Å
511	T	93.7	Very high	90.6	Very high	3 Å²	3	38.9 Å²	38.9	2%	0.018	19%	0.19	C	C	.	.	B	Isolated β-bridge	trans	-57.1	123.7	-179.9	-25	0	0	0	0	111.1	G509 T513 R516 S683 E732 K756	G509-T511 PolarHBondContact O-N 3.07Å; T511-T513 HydrophobicContact CG2-CG2 4.5Å; T511-R516 PolarHBondContact O-NH1 3.49Å; T511-S683 PolarHBondContact OG1-OG 3.23Å; T511-E732 VanDerWaalsContact CG2-OE1 3.23Å; T511-E732 WeakPolarHBondContact CG2-OE1 3.46Å; T511-E732 PolarHBondContact OG1-OE1 3.3Å; T511-K756 HydrophobicContact CG2-CB 4.34Å; T511-K756 HydrophobicContact CG2-CD 3.74Å; T511-K756 HydrophobicContact CG2-CG 4.1Å
512	I	94.2	Very high	91.4	Very high	41 Å²	41	34.9 Å²	34.9	21%	0.21	18%	0.175	C	C	.	.			trans	-67.9	128.5	169	-52.2	177.3	0	0	0	108.2	F510 F522 P525 G757	F510-I512 PolarHBondContact O-N 3.1Å; I512-F522 HydrophobicContact CB-CD1 4.43Å; I512-F522 HydrophobicContact CB-CE1 4.44Å; I512-F522 HydrophobicContact CD1-CB 4.45Å; I512-F522 HydrophobicContact CD1-CD1 4.4Å; I512-F522 HydrophobicContact CG1-CD1 3.71Å; I512-F522 HydrophobicContact CG1-CE1 4Å; I512-F522 HydrophobicContact CG1-CG 4.13Å; I512-F522 HydrophobicContact CG2-CD1 4.43Å; I512-F522 HydrophobicContact CG2-CD2 4.07Å; I512-F522 HydrophobicContact CG2-CE2 4.33Å; I512-F522 HydrophobicContact CG2-CG 4.11Å; I512-P525 HydrophobicContact CD1-CB 4.02Å; I512-G757 PolarHBondContact N-O 3.47Å; I512-G757 VanDerWaalsContact N-O 3.16Å
513	T	90.7	Very high	92	Very high	27 Å²	27	30 Å²	30	17%	0.166	15%	0.154	C	C	.	.			trans	-140.8	149.7	176	74.4	0	0	0	0	111.3	T511 E515 R516 E517	T511-T513 HydrophobicContact CG2-CG2 4.5Å; T513-E515 PolarHBondContact O-N 3.38Å; T513-E515 VanDerWaalsContact O-N 3.08Å; T513-R516 PolarHBondContact O-N 3.31Å; T513-R516 WeakPolarHBondContact OG1-CG 3.36Å; T513-R516 PolarHBondContact OG1-N 3.18Å; T513-E517 WeakPolarHBondContact O-CB 3.42Å; T513-E517 PolarHBondContact O-N 3.31Å
514	S	87.8	Confident	92.3	Very high	79 Å²	79	36 Å²	36	55%	0.552	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-0.4	-179.4	59.1	0	0	0	0	115	K518	S514-K518 VanDerWaalsContact O-CD 3.29Å; S514-K518 WeakPolarHBondContact O-CD 3.42Å; S514-K518 WeakPolarHBondContact O-CE 3.13Å; S514-K518 WeakPolarHBondContact O-CG 3.16Å; S514-K518 PolarHBondContact O-NZ 3.48Å
515	E	87.4	Confident	92.6	Very high	59 Å²	59	36.1 Å²	36.1	28%	0.276	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-39.5	166.5	-64.5	178.7	148.3	0	0	110.8	W491 T513 N690	W491-E515 HydrophobicContact CH2-CB 4.02Å; T513-E515 PolarHBondContact O-N 3.38Å; T513-E515 VanDerWaalsContact O-N 3.08Å; E515-N690 PolarHBondContact OE1-ND2 3.42Å
516	R	91.1	Very high	92.6	Very high	13 Å²	13	36.6 Å²	36.6	5%	0.049	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-42.4	177	-68.1	175.7	175.4	160.2	-1.7	112	G483 W491 V495 T511 T513 K518 V519 I520 F522	G483-R516 PolarHBondContact O-NH2 2.94Å; W491-R516 HydrophobicContact CH2-CG 4.15Å; W491-R516 HydrophobicContact CZ3-CG 4Å; V495-R516 HydrophobicContact CG2-CG 3.91Å; T511-R516 PolarHBondContact O-NH1 3.49Å; T513-R516 PolarHBondContact O-N 3.31Å; T513-R516 WeakPolarHBondContact OG1-CG 3.36Å; T513-R516 PolarHBondContact OG1-N 3.18Å; R516-K518 PolarHBondContact O-N 2.88Å; R516-V519 WeakPolarHBondContact O-CG2 3.43Å; R516-V519 PolarHBondContact O-N 2.69Å; R516-I520 HydrophobicContact CB-CD1 4.25Å; R516-I520 HydrophobicContact CB-CG1 4.16Å; R516-I520 WeakPolarHBondContact O-CG1 3.39Å; R516-I520 PolarHBondContact O-N 3.13Å; R516-F522 HydrophobicContact CB-CE2 3.71Å; R516-F522 HydrophobicContact CB-CZ 3.89Å
517	E	90.1	Very high	92.5	Very high	119 Å²	119	37.5 Å²	37.5	56%	0.556	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-16.1	179.7	-168.5	175.2	-154.5	0	0	113.8	T513 I520	T513-E517 WeakPolarHBondContact O-CB 3.42Å; T513-E517 PolarHBondContact O-N 3.31Å; E517-I520 WeakPolarHBondContact CA-O 3.35Å
518	K	88.4	Confident	92.3	Very high	151 Å²	151	43 Å²	43	66%	0.657	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-17.5	173.1	-68.2	169.1	-178.2	162.2	0	114	S514 R516	S514-K518 VanDerWaalsContact O-CD 3.29Å; S514-K518 WeakPolarHBondContact O-CD 3.42Å; S514-K518 WeakPolarHBondContact O-CE 3.13Å; S514-K518 WeakPolarHBondContact O-CG 3.16Å; S514-K518 PolarHBondContact O-NZ 3.48Å; R516-K518 PolarHBondContact O-N 2.88Å
519	V	87.9	Confident	92.3	Very high	29 Å²	29	43.2 Å²	43.2	18%	0.176	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124.4	-23.8	-170.9	-63.6	0	0	0	0	113.5	W491 V495 I499 R516	W491-V519 HydrophobicContact CD2-CG2 4.35Å; W491-V519 HydrophobicContact CH2-CG2 4.45Å; W491-V519 HydrophobicContact CZ2-CG1 4.47Å; W491-V519 HydrophobicContact CZ2-CG2 3.87Å; V495-V519 HydrophobicContact CG1-CG2 3.87Å; I499-V519 HydrophobicContact CD1-CB 3.8Å; I499-V519 HydrophobicContact CD1-CG2 3.84Å; I499-V519 HydrophobicContact CG1-CB 4.33Å; R516-V519 WeakPolarHBondContact O-CG2 3.43Å; R516-V519 PolarHBondContact O-N 2.69Å
520	I	92.5	Very high	92.3	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	148.6	175.7	55.5	164.9	0	0	0	110.3	V495 L498 I499 F510 R516 E517 F522 M762	V495-I520 HydrophobicContact CG1-CD1 4.3Å; V495-I520 HydrophobicContact CG1-CG1 4.46Å; V495-I520 HydrophobicContact CG1-CG2 4.29Å; V495-I520 HydrophobicContact CG2-CD1 4.16Å; L498-I520 HydrophobicContact CB-CG2 3.74Å; L498-I520 HydrophobicContact CD1-CB 4.33Å; L498-I520 HydrophobicContact CD1-CD1 3.85Å; L498-I520 HydrophobicContact CD1-CG2 4.06Å; I499-I520 HydrophobicContact CG1-CG2 3.9Å; F510-I520 HydrophobicContact CE1-CD1 3.69Å; F510-I520 HydrophobicContact CZ-CD1 3.68Å; R516-I520 HydrophobicContact CB-CD1 4.25Å; R516-I520 HydrophobicContact CB-CG1 4.16Å; R516-I520 WeakPolarHBondContact O-CG1 3.39Å; R516-I520 PolarHBondContact O-N 3.13Å; E517-I520 WeakPolarHBondContact CA-O 3.35Å; I520-F522 HydrophobicContact CD1-CE2 3.9Å; I520-F522 HydrophobicContact CD1-CZ 3.81Å; I520-F522 HydrophobicContact CG1-CE2 3.91Å; I520-F522 HydrophobicContact CG1-CZ 4.35Å; I520-M762 WeakPolarHBondContact CA-O 3.41Å; I520-M762 VanDerWaalsContact CB-O 3.28Å; I520-M762 WeakPolarHBondContact CB-O 3.46Å
521	D	92	Very high	92.4	Very high	29 Å²	29	43.2 Å²	43.2	16%	0.155	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	157	172.1	-93.2	-59.4	0	0	0	110.9	M762 L764 G765 R769	D521-M762 HydrophobicContact CB-CB 4.21Å; D521-M762 PolarHBondContact N-O 2.87Å; D521-M762 PolarHBondContact O-N 3.33Å; D521-L764 WeakPolarHBondContact OD2-CA 3.39Å; D521-G765 PolarHBondContact OD2-N 2.95Å; D521-R769 IonicContact OD1-NH1 2.71Å
522	F	95.7	Very high	92.4	Very high	20 Å²	20	43 Å²	43	9%	0.088	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	149.3	172.8	-77.2	-88.9	0	0	0	111.9	F510 I512 R516 I520 I760	F510-F522 HydrophobicContact CD1-CD1 4.47Å; F510-F522 AromaticContact CD1-CE1 3.51Å; F510-F522 HydrophobicContact CD1-CE1 3.51Å; F510-F522 HydrophobicContact CD1-CZ 4.12Å; F510-F522 AromaticContact CE1-CE1 3.5Å; F510-F522 HydrophobicContact CE1-CE1 3.5Å; F510-F522 VanDerWaalsContact CE1-CE1 3.5Å; F510-F522 AromaticContact CE1-CZ 3.68Å; F510-F522 HydrophobicContact CE1-CZ 3.68Å; F510-F522 HydrophobicContact CG-CE1 4.39Å; F510-F522 HydrophobicContact CZ-CE1 4.39Å; F510-F522 HydrophobicContact CZ-CZ 4.19Å; I512-F522 HydrophobicContact CB-CD1 4.43Å; I512-F522 HydrophobicContact CB-CE1 4.44Å; I512-F522 HydrophobicContact CD1-CB 4.45Å; I512-F522 HydrophobicContact CD1-CD1 4.4Å; I512-F522 HydrophobicContact CG1-CD1 3.71Å; I512-F522 HydrophobicContact CG1-CE1 4Å; I512-F522 HydrophobicContact CG1-CG 4.13Å; I512-F522 HydrophobicContact CG2-CD1 4.43Å; I512-F522 HydrophobicContact CG2-CD2 4.07Å; I512-F522 HydrophobicContact CG2-CE2 4.33Å; I512-F522 HydrophobicContact CG2-CG 4.11Å; R516-F522 HydrophobicContact CB-CE2 3.71Å; R516-F522 HydrophobicContact CB-CZ 3.89Å; I520-F522 HydrophobicContact CD1-CE2 3.9Å; I520-F522 HydrophobicContact CD1-CZ 3.81Å; I520-F522 HydrophobicContact CG1-CE2 3.91Å; I520-F522 HydrophobicContact CG1-CZ 4.35Å; F522-I760 WeakPolarHBondContact CA-O 3.13Å
523	S	95.1	Very high	92.3	Very high	6 Å²	6	41.2 Å²	41.2	4%	0.042	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-69	171.9	163.1	72.8	0	0	0	0	111.6	I760 I776	S523-I760 PolarHBondContact N-O 3.39Å; S523-I760 PolarHBondContact OG-N 2.74Å; S523-I776 WeakPolarHBondContact OG-CD1 3.36Å
524	K	94.4	Very high	92.4	Very high	129 Å²	129	39.9 Å²	39.9	56%	0.561	21%	0.206	S	C	*	.	S	Bend	trans	-57.6	146.6	158	-64	-62	176.7	-162.6	0	110.4	F526 T773	K524-F526 PolarHBondContact O-N 3.31Å; K524-T773 HydrophobicContact CB-CG2 4.14Å; K524-T773 HydrophobicContact CG-CG2 3.49Å; K524-T773 VanDerWaalsContact CG-CG2 3.49Å; K524-T773 PolarHBondContact N-OG1 3.41Å
525	P	95.8	Very high	92.5	Very high	49 Å²	49	36.3 Å²	36.3	32%	0.318	18%	0.181	S	C	.	.	P	Polyproline II helix	trans	-70.2	129.3	-175.1	26.9	-33.9	0	0	0	111.3	I512 Y758	I512-P525 HydrophobicContact CD1-CB 4.02Å; P525-Y758 CarbonylContact C-O 3.58Å; P525-Y758 WeakPolarHBondContact CA-O 3.28Å; P525-Y758 WeakPolarHBondContact CB-O 3.36Å
526	F	94.8	Very high	92.6	Very high	12 Å²	12	35.9 Å²	35.9	5%	0.053	18%	0.179	C	C	.	.	S	Bend	trans	-83.9	-16.5	178.9	63.7	-99.3	0	0	0	112.9	F456 M460 K524 Y758 I760 I776 L785	F456-F526 HydrophobicContact CD1-CE2 4.48Å; F456-F526 AromaticContact CE1-CD2 3.87Å; F456-F526 HydrophobicContact CE1-CD2 3.87Å; F456-F526 AromaticContact CE1-CE2 3.69Å; F456-F526 HydrophobicContact CE1-CE2 3.69Å; F456-F526 HydrophobicContact CZ-CD2 4.35Å; M460-F526 HydrophobicContact CE-CD1 3.98Å; M460-F526 HydrophobicContact CE-CD2 4.23Å; M460-F526 HydrophobicContact CE-CE1 4Å; M460-F526 HydrophobicContact CE-CE2 4.26Å; M460-F526 HydrophobicContact CE-CG 4.1Å; M460-F526 HydrophobicContact CE-CZ 4.14Å; M460-F526 HydrophobicContact SD-CB 4.03Å; M460-F526 HydrophobicContact SD-CD1 4.21Å; M460-F526 HydrophobicContact SD-CD2 3.71Å; M460-F526 HydrophobicContact SD-CE2 4.22Å; M460-F526 HydrophobicContact SD-CG 3.72Å; K524-F526 PolarHBondContact O-N 3.31Å; F526-Y758 WeakPolarHBondContact CD1-O 3.42Å; F526-Y758 HydrophobicContact CE2-CD2 4.36Å; F526-Y758 HydrophobicContact CZ-CD2 4.33Å; F526-Y758 HydrophobicContact CZ-CG 4.29Å; F526-Y758 PolarHBondContact N-O 3.43Å; F526-I760 HydrophobicContact CD1-CG1 4.4Å; F526-I776 HydrophobicContact CB-CG2 3.85Å; F526-L785 HydrophobicContact CB-CD1 4.18Å
527	M	93.9	Very high	92	Very high	19 Å²	19	36.9 Å²	36.9	9%	0.094	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	130.2	178.2	-171.5	172.9	-69.5	0	0	109.8	F456 T734 G757 Y758 K789 W793	F456-M527 HydrophobicContact CD1-CE 4.42Å; F456-M527 HydrophobicContact CD2-CE 4.36Å; F456-M527 HydrophobicContact CE1-CE 3.87Å; F456-M527 HydrophobicContact CE2-CE 3.77Å; F456-M527 HydrophobicContact CZ-CE 3.51Å; M527-T734 HydrophobicContact CG-CG2 4.12Å; M527-T734 HydrophobicContact SD-CG2 3.51Å; M527-T734 VanDerWaalsContact SD-CG2 3.51Å; M527-G757 CarbonylContact O-C 3.52Å; M527-G757 WeakPolarHBondContact O-CA 3.46Å; M527-Y758 HydrophobicContact CB-CD2 4.42Å; M527-Y758 PolarHBondContact O-N 3.03Å; M527-Y758 HydrophobicContact SD-CD2 4.48Å; M527-K789 HydrophobicContact CE-CB 4.43Å; M527-K789 HydrophobicContact CE-CG 4.04Å; M527-W793 HydrophobicContact CE-CH2 4.23Å; M527-W793 HydrophobicContact CE-CZ3 4.44Å
528	T	93.3	Very high	90.8	Very high	116 Å²	116	35 Å²	35	71%	0.712	18%	0.177	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-97.7	145.5	175.5	48.9	0	0	0	0	111.4	K756	T528-K756 WeakPolarHBondContact CA-O 3.5Å
529	L	93.7	Very high	89.3	Confident	6 Å²	6	34.8 Å²	34.8	3%	0.031	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.2	179.7	-169.9	59.4	101.7	0	0	0	111	E732 T734 K756 Y758	L529-E732 HydrophobicContact CD1-CB 4.02Å; L529-E732 HydrophobicContact CD1-CG 3.8Å; L529-T734 HydrophobicContact CB-CG2 3.97Å; L529-T734 HydrophobicContact CD2-CG2 4.41Å; L529-K756 HydrophobicContact CD1-CB 3.69Å; L529-K756 HydrophobicContact CD1-CD 4.4Å; L529-K756 HydrophobicContact CG-CB 4.14Å; L529-K756 PolarHBondContact N-O 3.04Å; L529-K756 CarbonylContact O-C 3.56Å; L529-K756 PolarHBondContact O-N 2.99Å; L529-K756 VanDerWaalsContact O-O 3.08Å; L529-Y758 HydrophobicContact CD1-CE1 4.43Å; L529-Y758 HydrophobicContact CD2-CD1 3.61Å; L529-Y758 HydrophobicContact CD2-CD2 3.56Å; L529-Y758 HydrophobicContact CD2-CE1 3.52Å; L529-Y758 HydrophobicContact CD2-CE2 3.45Å; L529-Y758 VanDerWaalsContact CD2-CE2 3.45Å; L529-Y758 HydrophobicContact CD2-CG 3.63Å; L529-Y758 VanDerWaalsContact CD2-CZ 3.44Å
530	G	93.8	Very high	87.7	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.2	C	C	.	.			trans	-155.9	173.7	166.8	0	0	0	0	0	111.7	E732 S733 D754	G530-E732 CarbonylContact O-C 3.59Å; G530-E732 WeakPolarHBondContact O-CA 3.39Å; G530-S733 PolarHBondContact N-OG 3.45Å; G530-S733 WeakPolarHBondContact O-CB 3.27Å; G530-S733 PolarHBondContact O-N 3.31Å; G530-S733 PolarHBondContact O-OG 3.28Å; G530-D754 WeakPolarHBondContact CA-O 3.13Å; G530-D754 VanDerWaalsContact CA-OD1 3.28Å; G530-D754 WeakPolarHBondContact CA-OD1 3.46Å
531	I	93.9	Very high	86	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	134.9	167.4	-57.7	163.4	0	0	0	108.2	T684 F687 F688 L730 L752 L753 D754	I531-T684 HydrophobicContact CD1-CG2 3.83Å; I531-T684 HydrophobicContact CG1-CG2 3.93Å; I531-T684 HydrophobicContact CG2-CG2 4Å; I531-F687 HydrophobicContact CD1-CB 4.39Å; I531-F687 HydrophobicContact CD1-CD1 3.33Å; I531-F687 HydrophobicContact CD1-CD2 4.48Å; I531-F687 HydrophobicContact CD1-CE1 3.6Å; I531-F687 HydrophobicContact CD1-CG 3.83Å; I531-F687 HydrophobicContact CD1-CZ 4.27Å; I531-F688 HydrophobicContact CD1-CE2 4.25Å; I531-L730 HydrophobicContact CG2-CB 4.37Å; I531-L752 WeakPolarHBondContact O-CA 3.31Å; I531-L753 HydrophobicContact CB-CB 4.19Å; I531-L753 HydrophobicContact CG2-CD2 4.43Å; I531-L753 WeakPolarHBondContact O-CD1 3.31Å; I531-L753 PolarHBondContact O-N 2.76Å; I531-D754 VanDerWaalsContact CD1-OD2 3.29Å; I531-D754 WeakPolarHBondContact CD1-OD2 3.33Å; I531-D754 PolarHBondContact N-OD1 2.98Å
532	S	93.2	Very high	84.4	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	160.3	178.5	68.8	0	0	0	0	110.3	M731 N736	S532-M731 PolarHBondContact N-O 2.73Å; S532-M731 PolarHBondContact O-N 3.01Å; S532-M731 VanDerWaalsContact O-N 3.1Å; S532-M731 VanDerWaalsContact O-O 3.13Å; S532-M731 PolarHBondContact OG-O 2.92Å; S532-N736 WeakPolarHBondContact OG-CB 3.48Å; S532-N736 PolarHBondContact OG-ND2 3.12Å
533	I	93.1	Very high	83	Confident	2 Å²	2	55.4 Å²	55.4	1%	0.01	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	114.8	177.9	-44.6	-177.4	0	0	0	108.6	L668 A728 L730 N736 Q748 I749 L753	I533-L668 HydrophobicContact CD1-CD2 4.15Å; I533-A728 HydrophobicContact CG2-CB 3.84Å; I533-L730 HydrophobicContact CB-CD2 4.41Å; I533-L730 HydrophobicContact CG1-CD2 3.87Å; I533-L730 HydrophobicContact CG2-CD2 4.34Å; I533-N736 PolarHBondContact O-ND2 3.49Å; I533-Q748 CarbonylContact O-C 3.56Å; I533-Q748 WeakPolarHBondContact O-CA 3.19Å; I533-I749 HydrophobicContact CB-CB 4.14Å; I533-I749 WeakPolarHBondContact CB-O 3.32Å; I533-I749 HydrophobicContact CD1-CG2 4.47Å; I533-I749 HydrophobicContact CG2-CB 4.33Å; I533-I749 PolarHBondContact O-N 2.89Å; I533-L753 HydrophobicContact CD1-CD1 4.37Å; I533-L753 HydrophobicContact CG1-CD1 3.91Å
534	L	92.3	Very high	81.7	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	125.8	171.4	-176.4	76.6	0	0	0	109.6	I719 A728 F729 M731 N736 L746	L534-I719 HydrophobicContact CD2-CG1 3.88Å; L534-A728 WeakPolarHBondContact O-CA 3.35Å; L534-F729 HydrophobicContact CB-CB 4.38Å; L534-F729 WeakPolarHBondContact CB-O 3.38Å; L534-F729 HydrophobicContact CD2-CD1 4.28Å; L534-F729 PolarHBondContact N-O 3.32Å; L534-F729 PolarHBondContact O-N 2.82Å; L534-M731 HydrophobicContact CB-CG 4.16Å; L534-M731 HydrophobicContact CB-SD 4.32Å; L534-M731 HydrophobicContact CD2-CE 3.7Å; L534-M731 HydrophobicContact CD2-SD 4.08Å; L534-N736 VanDerWaalsContact CD1-OD1 3.24Å; L534-N736 WeakPolarHBondContact CD1-OD1 3.29Å; L534-L746 HydrophobicContact CD1-CB 4Å; L534-L746 HydrophobicContact CD1-CD1 4.22Å; L534-L746 HydrophobicContact CD1-CD2 4.43Å; L534-L746 HydrophobicContact CD1-CG 4.45Å; L534-L746 HydrophobicContact CD2-CD1 4.32Å; L534-L746 HydrophobicContact CD2-CD2 4.44Å; L534-L746 HydrophobicContact CG-CD2 4.37Å
535	Y	91.1	Very high	80.9	Confident	4 Å²	4	59 Å²	59	2%	0.016	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	158.4	179.7	-173.4	-105.3	0	0	0	111.8	H538 P661 I674 Y727 A728 T747 I749	Y535-H538 AromaticContact CE1-CD2 3.88Å; Y535-H538 AromaticContact CE1-CE1 3.84Å; Y535-H538 AromaticContact CE1-NE2 3.46Å; Y535-H538 WeakPolarHBondContact CE1-NE2 3.31Å; Y535-H538 AromaticContact CZ-CE1 3.96Å; Y535-H538 AromaticContact CZ-NE2 3.66Å; Y535-H538 PolarHBondContact OH-CE1 3.47Å; Y535-H538 VanDerWaalsContact OH-CE1 3.23Å; Y535-H538 PolarHBondContact OH-NE2 2.92Å; Y535-P661 HydrophobicContact CE1-CG 4.4Å; Y535-I674 HydrophobicContact CE2-CD1 4.45Å; Y535-I674 HydrophobicContact CE2-CG2 4.08Å; Y535-Y727 WeakPolarHBondContact CD2-O 3.43Å; Y535-A728 HydrophobicContact CD2-CB 4Å; Y535-T747 PolarHBondContact N-O 2.98Å; Y535-T747 PolarHBondContact O-N 2.86Å; Y535-T747 VanDerWaalsContact O-O 3.07Å; Y535-T747 PolarHBondContact O-OG1 2.86Å; Y535-I749 HydrophobicContact CD1-CD1 3.66Å; Y535-I749 HydrophobicContact CG-CD1 3.86Å
536	Q	88.4	Confident	80.1	Confident	50 Å²	50	62.9 Å²	62.9	23%	0.234	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	144.6	178.6	59.1	175.5	-26.4	0	0	112.7	H538 V722 N745 T747	Q536-H538 PolarHBondContact O-N 2.68Å; Q536-V722 HydrophobicContact CB-CG1 4.39Å; Q536-N745 CarbonylContact C-O 3.48Å; Q536-N745 WeakPolarHBondContact CA-O 3.3Å; Q536-T747 PolarHBondContact O-OG1 2.84Å
537	V	79.7	Confident	79.3	Confident	34 Å²	34	62.6 Å²	62.6	21%	0.206	31%	0.313	C	S	.	.			trans	-67	116.4	172.6	179.6	0	0	0	0	109.2	L539 N745 T747	V537-L539 HydrophobicContact CG1-CD1 3.84Å; V537-L539 PolarHBondContact O-N 2.73Å; V537-N745 PolarHBondContact N-O 2.91Å; V537-T747 WeakPolarHBondContact CA-OG1 3.48Å; V537-T747 HydrophobicContact CG2-CG2 3.74Å; V537-T747 PolarHBondContact N-OG1 2.93Å
538	H	64.1	Low	78.7	Confident	80 Å²	80	63.3 Å²	63.3	37%	0.37	32%	0.316	S	S	.	.			trans	-77	90.2	165.1	-77.4	-26.5	0	0	0	110	Y535 Q536 A540	Y535-H538 AromaticContact CE1-CD2 3.88Å; Y535-H538 AromaticContact CE1-CE1 3.84Å; Y535-H538 AromaticContact CE1-NE2 3.46Å; Y535-H538 WeakPolarHBondContact CE1-NE2 3.31Å; Y535-H538 AromaticContact CZ-CE1 3.96Å; Y535-H538 AromaticContact CZ-NE2 3.66Å; Y535-H538 PolarHBondContact OH-CE1 3.47Å; Y535-H538 VanDerWaalsContact OH-CE1 3.23Å; Y535-H538 PolarHBondContact OH-NE2 2.92Å; Q536-H538 PolarHBondContact O-N 2.68Å; H538-A540 PolarHBondContact O-N 2.9Å
539	L	56.4	Low	78.4	Confident	146 Å²	146	60.9 Å²	60.9	76%	0.764	30%	0.298	S	S	*	.			trans	-53.4	112.9	163.8	-110	69.3	0	0	0	108.5	V537 R541	V537-L539 HydrophobicContact CG1-CD1 3.84Å; V537-L539 PolarHBondContact O-N 2.73Å; L539-R541 PolarHBondContact O-N 2.9Å
540	A	54.8	Low	77.9	Confident	65 Å²	65	65.2 Å²	65.2	54%	0.537	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-52.1	130.8	177.4	0	0	0	0	0	109.7	H538 K542	H538-A540 PolarHBondContact O-N 2.9Å; A540-K542 PolarHBondContact O-N 3.4Å; A540-K542 VanDerWaalsContact O-N 3.15Å
541	R	55.7	Low	77.7	Confident	243 Å²	243	65.8 Å²	65.8	92%	0.917	33%	0.326	S	S	*	.	P	Polyproline II helix	trans	-57.2	123.3	-176.3	-175.5	178.3	-174.7	167.8	2.3	108.8	L539	L539-R541 PolarHBondContact O-N 2.9Å
542	K	59.2	Low	77.4	Confident	162 Å²	162	67 Å²	67	70%	0.704	33%	0.331	S	S	*	.	P	Polyproline II helix	trans	-46.7	133.1	-179.7	-68	-164.7	173.3	-155	0	110.5	A540 G544 E812	A540-K542 PolarHBondContact O-N 3.4Å; A540-K542 VanDerWaalsContact O-N 3.15Å; K542-G544 PolarHBondContact O-N 3.27Å; K542-E812 IonicContact NZ-OE2 3.91Å
543	P	65.9	Low	77.3	Confident	41 Å²	41	70.1 Å²	70.1	27%	0.266	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-56.4	133.6	-176.9	20.9	-31	0	0	0	110.3	N813	P543-N813 WeakPolarHBondContact CG-OD1 3.38Å
544	G	69.1	Low	77.1	Confident	45 Å²	45	75.4 Å²	75.4	46%	0.464	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-72.8	157.9	178.5	0	0	0	0	0	111.2	K542 F546 S547	K542-G544 PolarHBondContact O-N 3.27Å; G544-F546 PolarHBondContact O-N 3.15Å; G544-S547 WeakPolarHBondContact O-CB 3.49Å; G544-S547 PolarHBondContact O-N 3.4Å; G544-S547 PolarHBondContact O-OG 3.45Å
545	Y	76.2	Confident	77.1	Confident	164 Å²	164	77.9 Å²	77.9	64%	0.643	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-21.5	179.2	-70.2	-73.8	0	0	0	114.8	F548 G816	Y545-F548 WeakPolarHBondContact O-CE1 3.41Å; Y545-G816 VanDerWaalsContact O-CA 3.3Å; Y545-G816 WeakPolarHBondContact O-CA 3.47Å
546	F	79.7	Confident	77.2	Confident	132 Å²	132	80.2 Å²	80.2	58%	0.579	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	10.5	178	-65.7	-69.1	0	0	0	114.8	G544 F548 L549	G544-F546 PolarHBondContact O-N 3.15Å; F546-F548 HydrophobicContact CD1-CE1 4.13Å; F546-F548 HydrophobicContact CD1-CZ 4.18Å; F546-F548 PolarHBondContact O-N 3.08Å; F546-L549 HydrophobicContact CB-CD1 4.39Å; F546-L549 HydrophobicContact CD1-CD1 4.27Å; F546-L549 WeakPolarHBondContact O-CB 3.32Å; F546-L549 PolarHBondContact O-N 3.11Å
547	S	78.1	Confident	77.4	Confident	5 Å²	5	81.6 Å²	81.6	4%	0.035	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-7.8	-174.6	68.4	0	0	0	0	115.6	G544 L549 D550	G544-S547 WeakPolarHBondContact O-CB 3.49Å; G544-S547 PolarHBondContact O-N 3.4Å; G544-S547 PolarHBondContact O-OG 3.45Å; S547-L549 VanDerWaalsContact C-N 3.27Å; S547-D550 VanDerWaalsContact CA-OD2 3.32Å; S547-D550 WeakPolarHBondContact CA-OD2 3.33Å
548	F	81.4	Confident	77.9	Confident	34 Å²	34	85.2 Å²	85.2	15%	0.149	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-13.6	168.7	67.7	-90.8	0	0	0	113.1	Y545 F546 P551 Y645 I817 V820	Y545-F548 WeakPolarHBondContact O-CE1 3.41Å; F546-F548 HydrophobicContact CD1-CE1 4.13Å; F546-F548 HydrophobicContact CD1-CZ 4.18Å; F546-F548 PolarHBondContact O-N 3.08Å; F548-P551 WeakPolarHBondContact O-CD 3.36Å; F548-Y645 WeakPolarHBondContact O-CE2 3.03Å; F548-Y645 PolarHBondContact O-OH 3.34Å; F548-I817 HydrophobicContact CB-CD1 4.4Å; F548-I817 HydrophobicContact CB-CG1 4.42Å; F548-I817 HydrophobicContact CD1-CG1 4Å; F548-I817 HydrophobicContact CE1-CG1 4.45Å; F548-I817 HydrophobicContact CG-CG1 4.09Å; F548-V820 HydrophobicContact CZ-CG2 4.14Å
549	L	86.3	Confident	79.3	Confident	65 Å²	65	88 Å²	88	34%	0.34	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-27.1	174.2	-62.8	178.7	0	0	0	112.7	F546 S547 P551 F552 W557	F546-L549 HydrophobicContact CB-CD1 4.39Å; F546-L549 HydrophobicContact CD1-CD1 4.27Å; F546-L549 WeakPolarHBondContact O-CB 3.32Å; F546-L549 PolarHBondContact O-N 3.11Å; S547-L549 VanDerWaalsContact C-N 3.27Å; L549-P551 VanDerWaalsContact C-N 3.34Å; L549-P551 WeakPolarHBondContact O-CD 3.39Å; L549-F552 PolarHBondContact O-N 3.08Å; L549-W557 HydrophobicContact CD2-CH2 4.4Å; L549-W557 HydrophobicContact CD2-CZ2 3.9Å; L549-W557 PolarHBondContact O-NE1 3.41Å
550	D	84.4	Confident	81	Confident	97 Å²	97	81.9 Å²	81.9	52%	0.519	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-28.5	-178.2	-59.3	-10.4	0	0	0	116.1	S547 F552 F652	S547-D550 VanDerWaalsContact CA-OD2 3.32Å; S547-D550 WeakPolarHBondContact CA-OD2 3.33Å; D550-F552 PolarHBondContact O-N 2.83Å; D550-F652 HydrophobicContact CB-CZ 4.35Å
551	P	88	Confident	82.7	Confident	13 Å²	13	83.8 Å²	83.8	8%	0.084	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-15	175.8	-28.1	36.6	0	0	0	115.7	F548 L549 Y645 N648 L649	F548-P551 WeakPolarHBondContact O-CD 3.36Å; L549-P551 VanDerWaalsContact C-N 3.34Å; L549-P551 WeakPolarHBondContact O-CD 3.39Å; P551-Y645 HydrophobicContact CB-CD2 4.05Å; P551-Y645 HydrophobicContact CB-CE2 4.08Å; P551-Y645 HydrophobicContact CG-CE2 4.1Å; P551-N648 HydrophobicContact CB-CB 3.86Å; P551-N648 PolarHBondContact O-ND2 3.27Å; P551-L649 HydrophobicContact CB-CB 4.45Å; P551-L649 HydrophobicContact CG-CB 3.95Å; P551-L649 HydrophobicContact CG-CD1 3.83Å; P551-L649 HydrophobicContact CG-CG 4.48Å
552	F	89.6	Confident	84.5	Confident	26 Å²	26	77.1 Å²	77.1	11%	0.114	40%	0.404	C	S	.	.	S	Bend	trans	-132.7	139	170.5	-72.5	-29.7	0	0	0	111	L549 D550 V556 W557 I641 Y645	L549-F552 PolarHBondContact O-N 3.08Å; D550-F552 PolarHBondContact O-N 2.83Å; F552-V556 HydrophobicContact CB-CB 4.19Å; F552-V556 HydrophobicContact CB-CG1 4.1Å; F552-V556 HydrophobicContact CD1-CG1 4.31Å; F552-V556 HydrophobicContact CD2-CG1 4.17Å; F552-V556 HydrophobicContact CG-CG1 3.97Å; F552-W557 HydrophobicContact CB-CZ2 4.46Å; F552-W557 HydrophobicContact CD2-CZ2 4.18Å; F552-W557 PolarHBondContact O-NE1 2.86Å; F552-I641 HydrophobicContact CE2-CG2 3.84Å; F552-I641 HydrophobicContact CZ-CG2 4.14Å; F552-I641 WeakPolarHBondContact CZ-O 3.35Å; F552-Y645 HydrophobicContact CD2-CD2 4.11Å; F552-Y645 HydrophobicContact CE2-CD2 4.1Å; F552-Y645 HydrophobicContact CE2-CG 4.34Å
553	S	90.2	Very high	86	Confident	65 Å²	65	70.8 Å²	70.8	46%	0.455	38%	0.382	S	S	.	.			trans	-66.8	154.5	177.4	73.1	0	0	0	0	112.1	A555 V556 W557	S553-A555 PolarHBondContact O-N 2.83Å; S553-V556 WeakPolarHBondContact O-CB 3.23Å; S553-V556 PolarHBondContact O-N 3.4Å; S553-W557 PolarHBondContact O-N 3.3Å
554	P	89.3	Confident	87.3	Confident	113 Å²	113	71.4 Å²	71.4	73%	0.734	38%	0.379	S	S	*	.	H	α-helix	trans	-55.1	-28.2	178.4	-28.6	36.2	0	0	0	114.3	W557 L558	P554-W557 PolarHBondContact O-N 2.58Å; P554-L558 PolarHBondContact O-N 3.02Å
555	A	91.6	Very high	88.4	Confident	52 Å²	52	73.2 Å²	73.2	43%	0.43	38%	0.378	S	S	.	.	H	α-helix	trans	-66.1	-41.6	174.3	0	0	0	0	0	112.4	S553 L558 F559	S553-A555 PolarHBondContact O-N 2.83Å; A555-L558 PolarHBondContact O-N 3.37Å; A555-F559 WeakPolarHBondContact O-CD2 3.34Å; A555-F559 PolarHBondContact O-N 3.36Å
556	V	93.1	Very high	89.2	Confident	52 Å²	52	67.8 Å²	67.8	32%	0.315	37%	0.367	S	S	.	.	H	α-helix	trans	-63.8	-44.1	175.9	175.2	0	0	0	0	110.2	F552 S553 L558 F559 M560	F552-V556 HydrophobicContact CB-CB 4.19Å; F552-V556 HydrophobicContact CB-CG1 4.1Å; F552-V556 HydrophobicContact CD1-CG1 4.31Å; F552-V556 HydrophobicContact CD2-CG1 4.17Å; F552-V556 HydrophobicContact CG-CG1 3.97Å; S553-V556 WeakPolarHBondContact O-CB 3.23Å; S553-V556 PolarHBondContact O-N 3.4Å; V556-L558 VanDerWaalsContact C-N 3.31Å; V556-L558 PolarHBondContact O-N 3.41Å; V556-F559 PolarHBondContact O-N 2.94Å; V556-M560 HydrophobicContact CG1-CG 4.4Å; V556-M560 WeakPolarHBondContact O-CB 3.27Å; V556-M560 VanDerWaalsContact O-CG 3.31Å; V556-M560 WeakPolarHBondContact O-CG 3.48Å; V556-M560 PolarHBondContact O-N 3.07Å
557	W	91.9	Very high	89.8	Confident	80 Å²	80	63 Å²	63	30%	0.303	35%	0.348	S	S	.	.	H	α-helix	trans	-58.6	-39.7	174.6	-72.4	112.2	0	0	0	112.9	L549 F552 S553 P554 M560 L561 Y645	L549-W557 HydrophobicContact CD2-CH2 4.4Å; L549-W557 HydrophobicContact CD2-CZ2 3.9Å; L549-W557 PolarHBondContact O-NE1 3.41Å; F552-W557 HydrophobicContact CB-CZ2 4.46Å; F552-W557 HydrophobicContact CD2-CZ2 4.18Å; F552-W557 PolarHBondContact O-NE1 2.86Å; S553-W557 PolarHBondContact O-N 3.3Å; P554-W557 PolarHBondContact O-N 2.58Å; W557-M560 PolarHBondContact O-N 3.19Å; W557-L561 PolarHBondContact O-N 3.29Å; W557-L561 VanDerWaalsContact O-N 3.11Å; W557-Y645 HydrophobicContact CZ2-CE2 4.25Å
558	L	92.1	Very high	90.5	Very high	110 Å²	110	62.9 Å²	62.9	58%	0.576	35%	0.348	S	S	*	.	H	α-helix	trans	-65.9	-46.3	175.1	-171.7	157.8	0	0	0	111.9	P554 A555 V556 M560 L561 L562	P554-L558 PolarHBondContact O-N 3.02Å; A555-L558 PolarHBondContact O-N 3.37Å; V556-L558 VanDerWaalsContact C-N 3.31Å; V556-L558 PolarHBondContact O-N 3.41Å; L558-M560 VanDerWaalsContact C-N 3.31Å; L558-M560 PolarHBondContact O-N 3.47Å; L558-L561 PolarHBondContact O-N 3.11Å; L558-L562 PolarHBondContact O-N 3.47Å
559	F	93.2	Very high	90.9	Very high	139 Å²	139	64.5 Å²	64.5	61%	0.61	36%	0.363	S	S	*	.	H	α-helix	trans	-64.6	-34.5	176.6	-75.2	-60.8	0	0	0	112.6	A555 V556 L562 A563	A555-F559 WeakPolarHBondContact O-CD2 3.34Å; A555-F559 PolarHBondContact O-N 3.36Å; V556-F559 PolarHBondContact O-N 2.94Å; F559-L562 PolarHBondContact O-N 3.46Å; F559-A563 VanDerWaalsContact O-CB 3.31Å; F559-A563 WeakPolarHBondContact O-CB 3.23Å; F559-A563 PolarHBondContact O-N 2.91Å
560	M	91.1	Very high	91.1	Very high	17 Å²	17	65 Å²	65	8%	0.084	37%	0.368	C	S	.	.	H	α-helix	trans	-62.1	-44.1	172.5	-76.4	-59.3	-56.1	0	0	112.3	V556 W557 L558 A563 Y564 F613 F637 I641	V556-M560 HydrophobicContact CG1-CG 4.4Å; V556-M560 WeakPolarHBondContact O-CB 3.27Å; V556-M560 VanDerWaalsContact O-CG 3.31Å; V556-M560 WeakPolarHBondContact O-CG 3.48Å; V556-M560 PolarHBondContact O-N 3.07Å; W557-M560 PolarHBondContact O-N 3.19Å; L558-M560 VanDerWaalsContact C-N 3.31Å; L558-M560 PolarHBondContact O-N 3.47Å; M560-A563 PolarHBondContact O-N 3.29Å; M560-Y564 WeakPolarHBondContact O-CB 3.48Å; M560-Y564 PolarHBondContact O-N 2.98Å; M560-F613 HydrophobicContact CE-CD2 4.15Å; M560-F613 HydrophobicContact CE-CE2 3.63Å; M560-F613 HydrophobicContact CE-CZ 4.45Å; M560-F637 HydrophobicContact CE-CE1 3.72Å; M560-F637 HydrophobicContact CE-CZ 4.21Å; M560-F637 HydrophobicContact SD-CE1 3.64Å; M560-F637 HydrophobicContact SD-CZ 3.48Å; M560-F637 WeakPolarHBondContact SD-CZ 3.38Å; M560-I641 HydrophobicContact CE-CB 4.45Å; M560-I641 HydrophobicContact CE-CG1 4.28Å; M560-I641 HydrophobicContact CE-CG2 3.89Å; M560-I641 HydrophobicContact SD-CB 4.42Å; M560-I641 HydrophobicContact SD-CD1 3.87Å; M560-I641 HydrophobicContact SD-CG1 3.81Å; M560-I641 HydrophobicContact SD-CG2 3.89Å
561	L	91	Very high	91.3	Very high	105 Å²	105	60.4 Å²	60.4	55%	0.55	34%	0.344	S	S	.	.	H	α-helix	trans	-63	-42.5	175.3	-179.9	64.1	0	0	0	111.7	W557 L558 Y564 L565	W557-L561 PolarHBondContact O-N 3.29Å; W557-L561 VanDerWaalsContact O-N 3.11Å; L558-L561 PolarHBondContact O-N 3.11Å; L561-Y564 HydrophobicContact CD1-CD1 4.21Å; L561-Y564 PolarHBondContact O-N 3.15Å; L561-L565 WeakPolarHBondContact O-CG 3.41Å; L561-L565 PolarHBondContact O-N 3.43Å; L561-L565 VanDerWaalsContact O-N 3.09Å
562	L	92.8	Very high	91.4	Very high	102 Å²	102	62.5 Å²	62.5	53%	0.534	35%	0.352	S	S	.	.	H	α-helix	trans	-65.3	-43.1	177.5	-176.3	61.5	0	0	0	111.9	L558 F559 L565 A566	L558-L562 PolarHBondContact O-N 3.47Å; F559-L562 PolarHBondContact O-N 3.46Å; L562-L565 PolarHBondContact O-N 3.12Å; L562-A566 WeakPolarHBondContact O-CB 3.48Å; L562-A566 PolarHBondContact O-N 3.34Å
563	A	92.1	Very high	91.4	Very high	29 Å²	29	65.6 Å²	65.6	24%	0.24	37%	0.369	C	S	.	.	H	α-helix	trans	-63.1	-42.5	176.2	0	0	0	0	0	112	F559 M560 A566 V567 F637	F559-A563 VanDerWaalsContact O-CB 3.31Å; F559-A563 WeakPolarHBondContact O-CB 3.23Å; F559-A563 PolarHBondContact O-N 2.91Å; M560-A563 PolarHBondContact O-N 3.29Å; A563-A566 PolarHBondContact O-N 3.31Å; A563-V567 WeakPolarHBondContact O-CB 3.41Å; A563-V567 WeakPolarHBondContact O-CG2 3.19Å; A563-V567 PolarHBondContact O-N 3.37Å; A563-F637 HydrophobicContact CB-CE1 4.36Å; A563-F637 HydrophobicContact CB-CZ 4.46Å
564	Y	92.6	Very high	91.2	Very high	54 Å²	54	63.3 Å²	63.3	21%	0.212	35%	0.354	C	S	.	.	H	α-helix	trans	-56.8	-48.7	173.4	158.8	-105.5	0	0	0	112.2	M560 L561 S568 L606 P609 V610	M560-Y564 WeakPolarHBondContact O-CB 3.48Å; M560-Y564 PolarHBondContact O-N 2.98Å; L561-Y564 HydrophobicContact CD1-CD1 4.21Å; L561-Y564 PolarHBondContact O-N 3.15Å; Y564-S568 WeakPolarHBondContact O-CB 3.5Å; Y564-S568 PolarHBondContact O-N 3.28Å; Y564-S568 PolarHBondContact O-OG 3.02Å; Y564-L606 HydrophobicContact CE1-CD2 4.27Å; Y564-L606 WeakPolarHBondContact CE2-O 3.34Å; Y564-L606 PolarHBondContact OH-O 3.03Å; Y564-P609 HydrophobicContact CD2-CB 3.82Å; Y564-P609 HydrophobicContact CE2-CB 3.97Å; Y564-V610 HydrophobicContact CE2-CG2 3.67Å
565	L	92.7	Very high	91	Very high	84 Å²	84	58 Å²	58	44%	0.44	32%	0.319	S	S	.	.	H	α-helix	trans	-65.7	-40.9	178.2	-68.8	174	0	0	0	111.9	L561 L562 S568 C569 L606	L561-L565 WeakPolarHBondContact O-CG 3.41Å; L561-L565 PolarHBondContact O-N 3.43Å; L561-L565 VanDerWaalsContact O-N 3.09Å; L562-L565 PolarHBondContact O-N 3.12Å; L565-S568 PolarHBondContact O-N 2.86Å; L565-C569 WeakPolarHBondContact O-CB 3.26Å; L565-C569 PolarHBondContact O-N 3.09Å; L565-L606 HydrophobicContact CD2-CD2 4.09Å
566	A	92.6	Very high	90.6	Very high	50 Å²	50	59.9 Å²	59.9	41%	0.413	32%	0.315	S	S	.	.	H	α-helix	trans	-62.4	-47.2	176.9	0	0	0	0	0	112	L562 A563 C569 V570	L562-A566 WeakPolarHBondContact O-CB 3.48Å; L562-A566 PolarHBondContact O-N 3.34Å; A563-A566 PolarHBondContact O-N 3.31Å; A566-C569 WeakPolarHBondContact O-CB 3.28Å; A566-C569 PolarHBondContact O-N 3.01Å; A566-V570 WeakPolarHBondContact O-CG2 3.43Å; A566-V570 PolarHBondContact O-N 3.02Å
567	V	92.3	Very high	90.2	Very high	30 Å²	30	64.2 Å²	64.2	18%	0.182	34%	0.336	C	S	.	.	H	α-helix	trans	-65.8	-40.2	177.9	169.7	0	0	0	0	111.5	A563 C569 V570 L571 P609 V630 W634	A563-V567 WeakPolarHBondContact O-CB 3.41Å; A563-V567 WeakPolarHBondContact O-CG2 3.19Å; A563-V567 PolarHBondContact O-N 3.37Å; V567-C569 VanDerWaalsContact C-N 3.31Å; V567-C569 PolarHBondContact O-N 3.02Å; V567-V570 PolarHBondContact O-N 2.97Å; V567-L571 HydrophobicContact CG1-CD1 3.96Å; V567-L571 HydrophobicContact CG1-CG 4.36Å; V567-L571 WeakPolarHBondContact O-CB 3.5Å; V567-L571 WeakPolarHBondContact O-CG 3.35Å; V567-L571 PolarHBondContact O-N 3.5Å; V567-P609 HydrophobicContact CG1-CG 4.21Å; V567-V630 HydrophobicContact CG1-CG1 4.3Å; V567-W634 HydrophobicContact CB-CE3 4.1Å; V567-W634 HydrophobicContact CB-CZ3 4.43Å; V567-W634 HydrophobicContact CG1-CB 4.11Å; V567-W634 HydrophobicContact CG1-CD2 4Å; V567-W634 HydrophobicContact CG1-CE3 4.04Å; V567-W634 HydrophobicContact CG1-CG 4.05Å; V567-W634 HydrophobicContact CG2-CE3 3.76Å; V567-W634 HydrophobicContact CG2-CZ3 4.16Å
568	S	91.6	Very high	89.8	Confident	3 Å²	3	60.9 Å²	60.9	2%	0.021	33%	0.325	C	S	.	.	H	α-helix	trans	-58.6	-43.6	173.8	-57	0	0	0	0	111.8	Y564 L565 F572 S605	Y564-S568 WeakPolarHBondContact O-CB 3.5Å; Y564-S568 PolarHBondContact O-N 3.28Å; Y564-S568 PolarHBondContact O-OG 3.02Å; L565-S568 PolarHBondContact O-N 2.86Å; S568-F572 PolarHBondContact O-N 2.92Å; S568-S605 WeakPolarHBondContact CA-O 3.45Å; S568-S605 WeakPolarHBondContact CB-O 3.42Å; S568-S605 PolarHBondContact OG-O 3.04Å
569	C	90.9	Very high	89.1	Confident	69 Å²	69	60 Å²	60	47%	0.466	33%	0.325	S	S	.	.	H	α-helix	trans	-66.2	-48	176.6	-171.4	0	0	0	0	111.9	L565 A566 V567 L571 F572 L573	L565-C569 WeakPolarHBondContact O-CB 3.26Å; L565-C569 PolarHBondContact O-N 3.09Å; A566-C569 WeakPolarHBondContact O-CB 3.28Å; A566-C569 PolarHBondContact O-N 3.01Å; V567-C569 VanDerWaalsContact C-N 3.31Å; V567-C569 PolarHBondContact O-N 3.02Å; C569-L571 VanDerWaalsContact C-N 3.34Å; C569-L571 PolarHBondContact O-N 3.23Å; C569-F572 WeakPolarHBondContact O-CB 3.27Å; C569-F572 PolarHBondContact O-N 3.36Å; C569-F572 VanDerWaalsContact O-N 3.16Å; C569-L573 WeakPolarHBondContact O-CD1 3.44Å; C569-L573 PolarHBondContact O-N 2.96Å
570	V	90.9	Very high	88.3	Confident	75 Å²	75	62.2 Å²	62.2	46%	0.455	33%	0.331	S	S	.	.	H	α-helix	trans	-61.9	-40.1	178.3	170.6	0	0	0	0	111.4	A566 V567 A574 V630	A566-V570 WeakPolarHBondContact O-CG2 3.43Å; A566-V570 PolarHBondContact O-N 3.02Å; V567-V570 PolarHBondContact O-N 2.97Å; V570-A574 WeakPolarHBondContact O-CB 3.31Å; V570-A574 PolarHBondContact O-N 3.23Å; V570-V630 HydrophobicContact CG1-CG1 4.1Å; V570-V630 HydrophobicContact CG1-CG2 3.94Å
571	L	88.6	Confident	87.9	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-63.1	-43.7	173.2	-76.1	170.3	0	0	0	112	V567 C569 A574 A575 F608 P609 V630	V567-L571 HydrophobicContact CG1-CD1 3.96Å; V567-L571 HydrophobicContact CG1-CG 4.36Å; V567-L571 WeakPolarHBondContact O-CB 3.5Å; V567-L571 WeakPolarHBondContact O-CG 3.35Å; V567-L571 PolarHBondContact O-N 3.5Å; C569-L571 VanDerWaalsContact C-N 3.34Å; C569-L571 PolarHBondContact O-N 3.23Å; L571-A574 PolarHBondContact O-N 3.49Å; L571-A575 WeakPolarHBondContact O-CB 3.35Å; L571-A575 PolarHBondContact O-N 3.09Å; L571-F608 HydrophobicContact CD1-CD1 3.5Å; L571-F608 HydrophobicContact CD1-CE1 3.87Å; L571-P609 HydrophobicContact CD1-CG 3.85Å; L571-V630 HydrophobicContact CD2-CB 3.86Å; L571-V630 HydrophobicContact CD2-CG1 3.61Å; L571-V630 HydrophobicContact CG-CG1 3.75Å
572	F	89.6	Confident	87.4	Confident	58 Å²	58	60.7 Å²	60.7	25%	0.254	32%	0.318	S	S	.	.	H	α-helix	trans	-60.3	-48.2	176.6	-177	-105.3	0	0	0	112.1	S568 C569 R576 L602	S568-F572 PolarHBondContact O-N 2.92Å; C569-F572 WeakPolarHBondContact O-CB 3.27Å; C569-F572 PolarHBondContact O-N 3.36Å; C569-F572 VanDerWaalsContact O-N 3.16Å; F572-R576 HydrophobicContact CE2-CG 4.35Å; F572-R576 HydrophobicContact CZ-CG 4.3Å; F572-R576 WeakPolarHBondContact O-CB 3.37Å; F572-R576 WeakPolarHBondContact O-CG 3.31Å; F572-R576 PolarHBondContact O-N 3.48Å; F572-R576 VanDerWaalsContact O-N 3.14Å; F572-L602 HydrophobicContact CE2-CB 4.27Å; F572-L602 HydrophobicContact CG-CD1 4.42Å
573	L	88.3	Confident	86.4	Confident	90 Å²	90	58.6 Å²	58.6	47%	0.471	30%	0.303	S	S	.	.	H	α-helix	trans	-64.8	-48.8	176.8	-86.4	79.2	0	0	0	111.4	C569 A575 R576 L577	C569-L573 WeakPolarHBondContact O-CD1 3.44Å; C569-L573 PolarHBondContact O-N 2.96Å; L573-A575 PolarHBondContact O-N 3.46Å; L573-R576 PolarHBondContact O-N 2.96Å; L573-L577 WeakPolarHBondContact O-CB 3.29Å; L573-L577 VanDerWaalsContact O-CG 3.29Å; L573-L577 WeakPolarHBondContact O-CG 3.29Å; L573-L577 PolarHBondContact O-N 3.37Å
574	A	86.8	Confident	85.4	Confident	18 Å²	18	59.3 Å²	59.3	15%	0.149	30%	0.303	C	S	.	.	H	α-helix	trans	-59.4	-45.8	-178.5	0	0	0	0	0	111.7	V570 L571 R576 L577 S578 T627	V570-A574 WeakPolarHBondContact O-CB 3.31Å; V570-A574 PolarHBondContact O-N 3.23Å; L571-A574 PolarHBondContact O-N 3.49Å; A574-R576 VanDerWaalsContact C-N 3.34Å; A574-R576 PolarHBondContact O-N 2.81Å; A574-L577 PolarHBondContact O-N 2.66Å; A574-S578 VanDerWaalsContact O-CB 3.28Å; A574-S578 WeakPolarHBondContact O-CB 3.33Å; A574-S578 PolarHBondContact O-N 2.73Å; A574-S578 PolarHBondContact O-OG 3.35Å; A574-T627 HydrophobicContact CB-CG2 4.27Å
575	A	84.8	Confident	84.1	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-68.2	-30.6	179.2	0	0	0	0	0	113.1	L571 L573 E581 N598 Y600 T627	L571-A575 WeakPolarHBondContact O-CB 3.35Å; L571-A575 PolarHBondContact O-N 3.09Å; L573-A575 PolarHBondContact O-N 3.46Å; A575-E581 HydrophobicContact CB-CG 4.2Å; A575-N598 PolarHBondContact O-ND2 2.91Å; A575-Y600 HydrophobicContact CB-CD1 4.48Å; A575-Y600 HydrophobicContact CB-CD2 3.45Å; A575-Y600 VanDerWaalsContact CB-CD2 3.45Å; A575-Y600 HydrophobicContact CB-CE2 4.25Å; A575-Y600 HydrophobicContact CB-CG 3.59Å; A575-T627 HydrophobicContact CB-CG2 3.86Å
576	R	84	Confident	82.8	Confident	93 Å²	93	60.2 Å²	60.2	35%	0.351	31%	0.31	S	S	.	.	H	α-helix	trans	-74.4	-40.9	175.3	-71.7	-75.1	163.2	175.5	-7.9	112.1	F572 L573 A574 W582 Y600	F572-R576 HydrophobicContact CE2-CG 4.35Å; F572-R576 HydrophobicContact CZ-CG 4.3Å; F572-R576 WeakPolarHBondContact O-CB 3.37Å; F572-R576 WeakPolarHBondContact O-CG 3.31Å; F572-R576 PolarHBondContact O-N 3.48Å; F572-R576 VanDerWaalsContact O-N 3.14Å; L573-R576 PolarHBondContact O-N 2.96Å; A574-R576 VanDerWaalsContact C-N 3.34Å; A574-R576 PolarHBondContact O-N 2.81Å; R576-W582 PolarHBondContact O-NE1 3.41Å; R576-W582 VanDerWaalsContact O-NE1 3.1Å; R576-Y600 PolarHBondContact NE-O 3.34Å; R576-Y600 PolarHBondContact NH2-O 2.88Å
577	L	83.8	Confident	81.2	Confident	142 Å²	142	63.2 Å²	63.2	74%	0.743	33%	0.325	S	S	*	.	H	α-helix	trans	-76.8	-31.4	-179.4	-67.6	170.4	0	0	0	113.2	L573 A574 P579	L573-L577 WeakPolarHBondContact O-CB 3.29Å; L573-L577 VanDerWaalsContact O-CG 3.29Å; L573-L577 WeakPolarHBondContact O-CG 3.29Å; L573-L577 PolarHBondContact O-N 3.37Å; A574-L577 PolarHBondContact O-N 2.66Å; L577-P579 WeakPolarHBondContact O-CD 3.38Å
578	S	85.1	Confident	79.7	Confident	11 Å²	11	67.5 Å²	67.5	8%	0.077	36%	0.355	C	S	.	.			trans	-77	118.8	179.4	63	0	0	0	0	111.5	A574 Y580 E581	A574-S578 VanDerWaalsContact O-CB 3.28Å; A574-S578 WeakPolarHBondContact O-CB 3.33Å; A574-S578 PolarHBondContact O-N 2.73Å; A574-S578 PolarHBondContact O-OG 3.35Å; S578-Y580 PolarHBondContact O-N 2.91Å; S578-E581 PolarHBondContact O-N 3.34Å; S578-E581 WeakPolarHBondContact OG-CG 3.46Å
579	P	75.9	Confident	78.3	Confident	90 Å²	90	72.2 Å²	72.2	58%	0.584	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-65.2	-24	-179.4	26.2	-34.5	0	0	0	112.9	L577 E581 W582	L577-P579 WeakPolarHBondContact O-CD 3.38Å; P579-E581 VanDerWaalsContact C-N 3.34Å; P579-E581 PolarHBondContact O-N 3.15Å; P579-W582 PolarHBondContact O-N 3.43Å
580	Y	77.8	Confident	76.6	Confident	186 Å²	186	78.9 Å²	78.9	73%	0.729	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-76.8	-9.4	-176.3	-56.2	-72	0	0	0	115.5	S578	S578-Y580 PolarHBondContact O-N 2.91Å
581	E	81.9	Confident	74.8	Confident	3 Å²	3	84.6 Å²	84.6	1%	0.014	42%	0.417	C	S	.	.	G	3₁₀ helix	trans	-85.4	-18.4	170.2	-71.3	-62.5	171.7	0	0	113.2	A575 S578 P579 Y583 R623 A624 T627	A575-E581 HydrophobicContact CB-CG 4.2Å; S578-E581 PolarHBondContact O-N 3.34Å; S578-E581 WeakPolarHBondContact OG-CG 3.46Å; P579-E581 VanDerWaalsContact C-N 3.34Å; P579-E581 PolarHBondContact O-N 3.15Å; E581-Y583 PolarHBondContact O-N 3.14Å; E581-R623 PolarHBondContact OE1-N 2.64Å; E581-R623 WeakPolarHBondContact OE2-CB 3.38Å; E581-R623 PolarHBondContact OE2-N 2.92Å; E581-A624 HydrophobicContact CG-CB 3.84Å; E581-A624 PolarHBondContact OE1-N 3.08Å; E581-T627 HydrophobicContact CG-CG2 3.97Å; E581-T627 WeakPolarHBondContact OE1-CB 3.35Å; E581-T627 PolarHBondContact OE1-OG1 2.82Å
582	W	80	Confident	73.2	Confident	88 Å²	88	92.5 Å²	92.5	33%	0.333	45%	0.446	S	S	.	.			trans	-81.2	116.3	178.3	-66.7	87.5	0	0	0	109.2	R576 P579 L596 N598	R576-W582 PolarHBondContact O-NE1 3.41Å; R576-W582 VanDerWaalsContact O-NE1 3.1Å; P579-W582 PolarHBondContact O-N 3.43Å; W582-L596 HydrophobicContact CB-CB 4.1Å; W582-L596 HydrophobicContact CB-CD2 3.79Å; W582-L596 HydrophobicContact CE3-CB 4.11Å; W582-N598 HydrophobicContact CD2-CB 3.97Å; W582-N598 HydrophobicContact CE3-CB 3.9Å; W582-N598 HydrophobicContact CZ3-CB 4.21Å; W582-N598 PolarHBondContact NE1-ND2 2.68Å
583	Y	71.7	Confident	71.4	Confident	57 Å²	57	97.9 Å²	97.9	22%	0.224	47%	0.465	C	S	.	.	B	Isolated β-bridge	trans	-132.6	153	-177.8	75.1	-84.8	0	0	0	112.3	E581 P585 E597 Q599 R623	E581-Y583 PolarHBondContact O-N 3.14Å; Y583-P585 HydrophobicContact CE2-CB 4.24Å; Y583-E597 PolarHBondContact N-O 3.26Å; Y583-E597 PolarHBondContact O-N 3.09Å; Y583-Q599 HydrophobicContact CE1-CG 4Å; Y583-Q599 PolarHBondContact OH-NE2 2.84Å; Y583-R623 VanDerWaalsContact CD1-NH1 3.27Å
584	N	71.6	Confident	69.9	Low	45 Å²	45	100.8 Å²	100.8	24%	0.241	48%	0.481	C	S	.	.			trans	-83.7	121.5	173.2	-170.3	-50.4	0	0	0	109.4	H586 R592 R593 I595	N584-H586 PolarHBondContact O-N 2.9Å; N584-H586 PolarHBondContact OD1-N 3.25Å; N584-H586 PolarHBondContact OD1-O 2.9Å; N584-R592 PolarHBondContact ND2-O 2.91Å; N584-R593 PolarHBondContact ND2-O 3.32Å; N584-I595 PolarHBondContact ND2-O 3.41Å
585	P	64.5	Low	68.7	Low	39 Å²	39	103.2 Å²	103.2	25%	0.253	49%	0.491	S	S	.	.	S	Bend	trans	-71.2	-14.8	-177.2	30.8	-38.2	0	0	0	113.8	Y583 E597	Y583-P585 HydrophobicContact CE2-CB 4.24Å; P585-E597 HydrophobicContact CG-CG 4.24Å
586	H	66.8	Low	67.9	Low	117 Å²	117	107.5 Å²	107.5	54%	0.542	51%	0.513	S	S	.	.			trans	-131.8	67.7	-175.3	-63.9	-21.5	0	0	0	111.5	N584 C588 L589	N584-H586 PolarHBondContact O-N 2.9Å; N584-H586 PolarHBondContact OD1-N 3.25Å; N584-H586 PolarHBondContact OD1-O 2.9Å; H586-C588 PolarHBondContact O-N 2.9Å; H586-L589 HydrophobicContact CB-CD1 3.99Å; H586-L589 HydrophobicContact CB-CG 4.31Å; H586-L589 PolarHBondContact O-N 2.91Å
587	P	58.9	Low	67.3	Low	113 Å²	113	107.8 Å²	107.8	73%	0.734	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-15.6	-175.4	25	-35.5	0	0	0	114.6
588	C	61.2	Low	67.1	Low	120 Å²	120	101.8 Å²	101.8	81%	0.811	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-23	176.7	-48.9	0	0	0	0	113.8	H586 R590	H586-C588 PolarHBondContact O-N 2.9Å; C588-R590 PolarHBondContact O-N 2.87Å
589	L	60.4	Low	66.9	Low	102 Å²	102	103.8 Å²	103.8	53%	0.534	50%	0.495	S	S	.	.			trans	-91.1	85.9	-172.5	-67.8	178	0	0	0	111.5	H586 E591 R592	H586-L589 HydrophobicContact CB-CD1 3.99Å; H586-L589 HydrophobicContact CB-CG 4.31Å; H586-L589 PolarHBondContact O-N 2.91Å; L589-E591 PolarHBondContact O-N 2.92Å; L589-R592 PolarHBondContact O-N 2.77Å
590	R	56.5	Low	67.2	Low	210 Å²	210	99.5 Å²	99.5	79%	0.792	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-21.1	-168.9	-143.6	170.3	-172.5	149.6	0.3	115.6	C588	C588-R590 PolarHBondContact O-N 2.87Å
591	E	52	Low	67.5	Low	195 Å²	195	93.6 Å²	93.6	91%	0.911	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-16.4	179.9	-63.8	-177.7	132.9	0	0	114.9	L589	L589-E591 PolarHBondContact O-N 2.92Å
592	R	55.3	Low	67.6	Low	166 Å²	166	98.7 Å²	98.7	63%	0.626	48%	0.478	S	S	*	.			trans	-113.1	64.9	-179.4	-81.6	-176.2	166.3	-144.8	-1.7	111.6	N584 L589 I595	N584-R592 PolarHBondContact ND2-O 2.91Å; L589-R592 PolarHBondContact O-N 2.77Å; R592-I595 HydrophobicContact CB-CD1 4.43Å; R592-I595 HydrophobicContact CG-CD1 4.34Å
593	R	52.3	Low	67.8	Low	170 Å²	170	96.6 Å²	96.6	64%	0.642	48%	0.483	S	S	*	.			trans	-74.1	-34.8	179.4	-70.1	-178.7	170.4	-158.6	-12.2	113.3	N584 I595	N584-R593 PolarHBondContact ND2-O 3.32Å; R593-I595 VanDerWaalsContact C-N 3.29Å; R593-I595 PolarHBondContact O-N 3.13Å
594	D	57.5	Low	68.4	Low	151 Å²	151	96.9 Å²	96.9	81%	0.807	49%	0.489	S	S	*	.	S	Bend	trans	-84.5	3.9	-168.1	-47.5	-44	0	0	0	114.6	L596	D594-L596 PolarHBondContact O-N 3.07Å
595	I	61.2	Low	69.2	Low	69 Å²	69	94.8 Å²	94.8	35%	0.354	48%	0.477	S	S	.	.			trans	-91.6	97.4	172.5	-55.2	-176.8	0	0	0	108.4	N584 R592 R593 E597	N584-I595 PolarHBondContact ND2-O 3.41Å; R592-I595 HydrophobicContact CB-CD1 4.43Å; R592-I595 HydrophobicContact CG-CD1 4.34Å; R593-I595 VanDerWaalsContact C-N 3.29Å; R593-I595 PolarHBondContact O-N 3.13Å; I595-E597 HydrophobicContact CG2-CG 4.38Å
596	L	67.7	Low	70.4	Confident	90 Å²	90	95.5 Å²	95.5	47%	0.471	48%	0.479	S	S	.	.			trans	-103.2	126.3	168.2	-62.1	87.6	0	0	0	109.2	W582 D594	W582-L596 HydrophobicContact CB-CB 4.1Å; W582-L596 HydrophobicContact CB-CD2 3.79Å; W582-L596 HydrophobicContact CE3-CB 4.11Å; D594-L596 PolarHBondContact O-N 3.07Å
597	E	71.1	Confident	71.4	Confident	100 Å²	100	98.2 Å²	98.2	47%	0.467	48%	0.484	S	S	.	.	B	Isolated β-bridge	trans	-105.5	154.5	174.1	-66	-175.5	170.7	0	0	110.1	Y583 P585 I595	Y583-E597 PolarHBondContact N-O 3.26Å; Y583-E597 PolarHBondContact O-N 3.09Å; P585-E597 HydrophobicContact CG-CG 4.24Å; I595-E597 HydrophobicContact CG2-CG 4.38Å
598	N	80.4	Confident	72.8	Confident	16 Å²	16	92.8 Å²	92.8	9%	0.086	45%	0.45	C	S	.	.			trans	-135.1	121.5	-179.7	-174.3	-38.2	0	0	0	108.1	A575 W582 Y600	A575-N598 PolarHBondContact O-ND2 2.91Å; W582-N598 HydrophobicContact CD2-CB 3.97Å; W582-N598 HydrophobicContact CE3-CB 3.9Å; W582-N598 HydrophobicContact CZ3-CB 4.21Å; W582-N598 PolarHBondContact NE1-ND2 2.68Å; N598-Y600 PolarHBondContact O-N 3.43Å; N598-Y600 PolarHBondContact OD1-N 2.97Å
599	Q	79.6	Confident	74.1	Confident	52 Å²	52	87.1 Å²	87.1	24%	0.243	41%	0.411	C	S	.	.	S	Bend	trans	-67.6	-20.7	-174.5	-76	173.8	4.2	0	0	113.1	Y583 T601 N604 I620	Y583-Q599 HydrophobicContact CE1-CG 4Å; Y583-Q599 PolarHBondContact OH-NE2 2.84Å; Q599-T601 PolarHBondContact O-N 2.83Å; Q599-N604 VanDerWaalsContact O-CB 3.26Å; Q599-N604 WeakPolarHBondContact O-CB 3.4Å; Q599-N604 PolarHBondContact O-ND2 2.91Å; Q599-I620 HydrophobicContact CB-CG2 4.05Å
600	Y	82.4	Confident	75.5	Confident	0 Å²	0	83.8 Å²	83.8	0%	0	40%	0.395	C	S	.	.			trans	-84.1	81.3	177.9	-65.1	-84.5	0	0	0	110.8	A575 R576 N598 F608 I620	A575-Y600 HydrophobicContact CB-CD1 4.48Å; A575-Y600 HydrophobicContact CB-CD2 3.45Å; A575-Y600 VanDerWaalsContact CB-CD2 3.45Å; A575-Y600 HydrophobicContact CB-CE2 4.25Å; A575-Y600 HydrophobicContact CB-CG 3.59Å; R576-Y600 PolarHBondContact NE-O 3.34Å; R576-Y600 PolarHBondContact NH2-O 2.88Å; N598-Y600 PolarHBondContact O-N 3.43Å; N598-Y600 PolarHBondContact OD1-N 2.97Å; Y600-F608 HydrophobicContact CE1-CB 4.38Å; Y600-F608 HydrophobicContact CE1-CD2 4.27Å; Y600-F608 HydrophobicContact CE1-CG 4.21Å; Y600-I620 HydrophobicContact CD1-CG2 4.43Å; Y600-I620 HydrophobicContact CD2-CG2 4.48Å; Y600-I620 HydrophobicContact CE1-CG2 3.84Å; Y600-I620 HydrophobicContact CE2-CG2 3.89Å
601	T	84.3	Confident	76.9	Confident	62 Å²	62	74.1 Å²	74.1	38%	0.38	36%	0.361	S	S	.	.			trans	-76.1	163.3	154.9	72.9	0	0	0	0	109.5	Q599 G603 N604 S605	Q599-T601 PolarHBondContact O-N 2.83Å; T601-G603 VanDerWaalsContact C-N 3.3Å; T601-G603 PolarHBondContact O-N 3.02Å; T601-N604 PolarHBondContact O-N 3.15Å; T601-N604 VanDerWaalsContact O-N 3.09Å; T601-N604 VanDerWaalsContact OG1-CB 3.32Å; T601-N604 WeakPolarHBondContact OG1-CB 3.45Å; T601-N604 PolarHBondContact OG1-N 2.84Å; T601-N604 PolarHBondContact OG1-OD1 3.44Å; T601-S605 PolarHBondContact O-N 2.97Å; T601-S605 PolarHBondContact O-OG 3.33Å
602	L	83.6	Confident	78.5	Confident	111 Å²	111	65.3 Å²	65.3	58%	0.581	32%	0.322	S	S	*	.	H	α-helix	trans	-57.5	-41.7	-178.7	-176.1	64.1	0	0	0	112.7	F572 S605 L606	F572-L602 HydrophobicContact CE2-CB 4.27Å; F572-L602 HydrophobicContact CG-CD1 4.42Å; L602-S605 WeakPolarHBondContact CA-OG 3.44Å; L602-S605 PolarHBondContact O-OG 2.72Å; L602-L606 HydrophobicContact CG-CD1 4.48Å; L602-L606 WeakPolarHBondContact O-CG 3.21Å; L602-L606 PolarHBondContact O-N 2.94Å
603	G	84.1	Confident	80	Confident	44 Å²	44	61 Å²	61	45%	0.454	31%	0.308	S	S	.	.	H	α-helix	trans	-66	-42.5	174.4	0	0	0	0	0	112.5	T601 S605 L606 W607	T601-G603 VanDerWaalsContact C-N 3.3Å; T601-G603 PolarHBondContact O-N 3.02Å; G603-S605 VanDerWaalsContact C-N 3.34Å; G603-S605 PolarHBondContact O-N 3.42Å; G603-L606 PolarHBondContact O-N 2.03Å; G603-L606 VanDerWaalsContact O-N 3.17Å; G603-W607 WeakPolarHBondContact O-CB 3.27Å; G603-W607 PolarHBondContact O-N 3.07Å
604	N	85.8	Confident	81.7	Confident	63 Å²	63	58 Å²	58	34%	0.337	30%	0.302	S	S	.	.	H	α-helix	trans	-66.6	-34.4	178.4	-71.1	10.7	0	0	0	112.4	Q599 T601 L606 W607 F608 I620	Q599-N604 VanDerWaalsContact O-CB 3.26Å; Q599-N604 WeakPolarHBondContact O-CB 3.4Å; Q599-N604 PolarHBondContact O-ND2 2.91Å; T601-N604 PolarHBondContact O-N 3.15Å; T601-N604 VanDerWaalsContact O-N 3.09Å; T601-N604 VanDerWaalsContact OG1-CB 3.32Å; T601-N604 WeakPolarHBondContact OG1-CB 3.45Å; T601-N604 PolarHBondContact OG1-N 2.84Å; T601-N604 PolarHBondContact OG1-OD1 3.44Å; N604-L606 VanDerWaalsContact C-N 3.35Å; N604-W607 PolarHBondContact O-N 3.13Å; N604-F608 WeakPolarHBondContact O-CB 3.28Å; N604-F608 PolarHBondContact O-N 3.35Å; N604-I620 HydrophobicContact CB-CD1 3.68Å
605	S	86.9	Confident	83	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-73.6	-21.4	173.5	49.1	0	0	0	0	114.2	S568 T601 L602 G603 P609	S568-S605 WeakPolarHBondContact CA-O 3.45Å; S568-S605 WeakPolarHBondContact CB-O 3.42Å; S568-S605 PolarHBondContact OG-O 3.04Å; T601-S605 PolarHBondContact O-N 2.97Å; T601-S605 PolarHBondContact O-OG 3.33Å; L602-S605 WeakPolarHBondContact CA-OG 3.44Å; L602-S605 PolarHBondContact O-OG 2.72Å; G603-S605 VanDerWaalsContact C-N 3.34Å; G603-S605 PolarHBondContact O-N 3.42Å; S605-P609 WeakPolarHBondContact O-CD 3.45Å
606	L	89.6	Confident	84.1	Confident	55 Å²	55	61.5 Å²	61.5	29%	0.288	31%	0.313	S	S	.	.	H	α-helix	trans	-80.9	-39.3	168.2	-75	160.7	0	0	0	111	Y564 L565 L602 G603 N604 P609	Y564-L606 HydrophobicContact CE1-CD2 4.27Å; Y564-L606 WeakPolarHBondContact CE2-O 3.34Å; Y564-L606 PolarHBondContact OH-O 3.03Å; L565-L606 HydrophobicContact CD2-CD2 4.09Å; L602-L606 HydrophobicContact CG-CD1 4.48Å; L602-L606 WeakPolarHBondContact O-CG 3.21Å; L602-L606 PolarHBondContact O-N 2.94Å; G603-L606 PolarHBondContact O-N 2.03Å; G603-L606 VanDerWaalsContact O-N 3.17Å; N604-L606 VanDerWaalsContact C-N 3.35Å; L606-P609 WeakPolarHBondContact O-CD 3.32Å
607	W	88.3	Confident	84.7	Confident	173 Å²	173	59.2 Å²	59.2	66%	0.655	31%	0.311	S	S	*	.	H	α-helix	trans	-70.2	-35.5	-180	-166.8	-113.1	0	0	0	113.5	G603 N604 V610 G611	G603-W607 WeakPolarHBondContact O-CB 3.27Å; G603-W607 PolarHBondContact O-N 3.07Å; N604-W607 PolarHBondContact O-N 3.13Å; W607-V610 HydrophobicContact CZ3-CG1 4.48Å; W607-V610 WeakPolarHBondContact O-CB 3.34Å; W607-V610 PolarHBondContact O-N 3.49Å; W607-G611 PolarHBondContact O-N 3.4Å; W607-G611 VanDerWaalsContact O-N 3.16Å
608	F	88.3	Confident	85.1	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-57.9	-48.8	-178.7	173.9	-80.6	0	0	0	113.3	L571 Y600 N604 V610 G611 G612 S618 I620 P622 S631 W635	L571-F608 HydrophobicContact CD1-CD1 3.5Å; L571-F608 HydrophobicContact CD1-CE1 3.87Å; Y600-F608 HydrophobicContact CE1-CB 4.38Å; Y600-F608 HydrophobicContact CE1-CD2 4.27Å; Y600-F608 HydrophobicContact CE1-CG 4.21Å; N604-F608 WeakPolarHBondContact O-CB 3.28Å; N604-F608 PolarHBondContact O-N 3.35Å; F608-V610 VanDerWaalsContact C-N 3.32Å; F608-V610 PolarHBondContact O-N 3.37Å; F608-G611 PolarHBondContact O-N 3.49Å; F608-G612 PolarHBondContact O-N 3.42Å; F608-S618 WeakPolarHBondContact CD2-OG 3.32Å; F608-S618 WeakPolarHBondContact CE2-OG 3.37Å; F608-I620 HydrophobicContact CB-CD1 4.49Å; F608-I620 HydrophobicContact CD2-CB 4.2Å; F608-I620 HydrophobicContact CD2-CG2 4.36Å; F608-I620 WeakPolarHBondContact CE2-O 3.15Å; F608-P622 HydrophobicContact CZ-CG 4.42Å; F608-S631 WeakPolarHBondContact CE1-OG 3.48Å; F608-S631 WeakPolarHBondContact CZ-OG 3.48Å; F608-W635 HydrophobicContact CZ-CZ2 4.04Å
609	P	88.9	Confident	85	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-62.2	-33.3	174.9	-29.6	39.8	0	0	0	114.6	Y564 V567 L571 S605 L606 G612 F613 W634	Y564-P609 HydrophobicContact CD2-CB 3.82Å; Y564-P609 HydrophobicContact CE2-CB 3.97Å; V567-P609 HydrophobicContact CG1-CG 4.21Å; L571-P609 HydrophobicContact CD1-CG 3.85Å; S605-P609 WeakPolarHBondContact O-CD 3.45Å; L606-P609 WeakPolarHBondContact O-CD 3.32Å; P609-G612 PolarHBondContact O-N 3Å; P609-F613 PolarHBondContact O-N 2.72Å; P609-W634 HydrophobicContact CB-CZ2 3.85Å; P609-W634 PolarHBondContact O-NE1 3.26Å
610	V	89.4	Confident	85	Confident	32 Å²	32	63.9 Å²	63.9	19%	0.194	34%	0.337	C	S	.	.	H	α-helix	trans	-61.9	-44	175.4	179.3	0	0	0	0	110.9	Y564 W607 F608 G612 F613 M614	Y564-V610 HydrophobicContact CE2-CG2 3.67Å; W607-V610 HydrophobicContact CZ3-CG1 4.48Å; W607-V610 WeakPolarHBondContact O-CB 3.34Å; W607-V610 PolarHBondContact O-N 3.49Å; F608-V610 VanDerWaalsContact C-N 3.32Å; F608-V610 PolarHBondContact O-N 3.37Å; V610-G612 PolarHBondContact O-N 3.43Å; V610-F613 PolarHBondContact O-N 2.92Å; V610-F613 VanDerWaalsContact O-N 3.1Å; V610-M614 HydrophobicContact CG1-CG 4.11Å; V610-M614 HydrophobicContact CG1-SD 3.74Å; V610-M614 WeakPolarHBondContact O-CB 3.27Å; V610-M614 WeakPolarHBondContact O-CG 3.05Å; V610-M614 PolarHBondContact O-N 2.95Å
611	G	86.5	Confident	84.8	Confident	8 Å²	8	69.7 Å²	69.7	8%	0.082	37%	0.365	C	S	.	.	H	α-helix	trans	-59.1	-33.8	175.9	0	0	0	0	0	113.7	W607 F608 Q615 Q616 G617	W607-G611 PolarHBondContact O-N 3.4Å; W607-G611 VanDerWaalsContact O-N 3.16Å; F608-G611 PolarHBondContact O-N 3.49Å; G611-Q615 PolarHBondContact O-N 2.79Å; G611-Q616 PolarHBondContact O-N 3.07Å; G611-G617 VanDerWaalsContact CA-O 3.22Å; G611-G617 WeakPolarHBondContact CA-O 3.42Å; G611-G617 PolarHBondContact O-N 2.88Å
612	G	85.1	Confident	84.8	Confident	9 Å²	9	67.1 Å²	67.1	9%	0.093	35%	0.35	C	S	.	.	H	α-helix	trans	-69.5	-47.4	170.4	0	0	0	0	0	113	F608 P609 V610 M614 Q615	F608-G612 PolarHBondContact O-N 3.42Å; P609-G612 PolarHBondContact O-N 3Å; V610-G612 PolarHBondContact O-N 3.43Å; G612-M614 VanDerWaalsContact C-N 3.33Å; G612-M614 PolarHBondContact O-N 2.74Å; G612-Q615 PolarHBondContact O-N 2.87Å; G612-Q615 VanDerWaalsContact O-N 3.11Å
613	F	87.6	Confident	84.6	Confident	77 Å²	77	66.6 Å²	66.6	34%	0.338	34%	0.34	S	S	.	.	H	α-helix	trans	-66.3	-31.5	-179.6	-172	-107.5	0	0	0	113.3	M560 P609 V610 Q615 W634 T638 I641 I642	M560-F613 HydrophobicContact CE-CD2 4.15Å; M560-F613 HydrophobicContact CE-CE2 3.63Å; M560-F613 HydrophobicContact CE-CZ 4.45Å; P609-F613 PolarHBondContact O-N 2.72Å; V610-F613 PolarHBondContact O-N 2.92Å; V610-F613 VanDerWaalsContact O-N 3.1Å; F613-Q615 VanDerWaalsContact C-N 3.31Å; F613-W634 HydrophobicContact CB-CZ2 4.41Å; F613-T638 HydrophobicContact CB-CG2 4.28Å; F613-T638 HydrophobicContact CD2-CG2 4.02Å; F613-I641 HydrophobicContact CE2-CG2 4.43Å; F613-I642 HydrophobicContact CE2-CG1 4.5Å; F613-I642 WeakPolarHBondContact O-CD1 3.47Å
614	M	87.8	Confident	84.7	Confident	105 Å²	105	64.7 Å²	64.7	52%	0.517	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	1.9	174.6	-65.1	-174.1	69.1	0	0	113.8	V610 G612 Q616	V610-M614 HydrophobicContact CG1-CG 4.11Å; V610-M614 HydrophobicContact CG1-SD 3.74Å; V610-M614 WeakPolarHBondContact O-CB 3.27Å; V610-M614 WeakPolarHBondContact O-CG 3.05Å; V610-M614 PolarHBondContact O-N 2.95Å; G612-M614 VanDerWaalsContact C-N 3.33Å; G612-M614 PolarHBondContact O-N 2.74Å; M614-Q616 PolarHBondContact O-N 3.27Å
615	Q	84.4	Confident	84.7	Confident	134 Å²	134	68.2 Å²	68.2	63%	0.626	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	11.6	-176.3	-54.5	-172.9	-10	0	0	115.8	G611 G612 F613 I642	G611-Q615 PolarHBondContact O-N 2.79Å; G612-Q615 PolarHBondContact O-N 2.87Å; G612-Q615 VanDerWaalsContact O-N 3.11Å; F613-Q615 VanDerWaalsContact C-N 3.31Å; Q615-I642 HydrophobicContact CG-CD1 3.81Å
616	Q	83.9	Confident	84.8	Confident	161 Å²	161	70.8 Å²	70.8	75%	0.752	36%	0.356	S	S	*	.	S	Bend	trans	-88.9	-14.6	-179.9	-69.4	177.3	8.3	0	0	113.1	G611 M614	G611-Q616 PolarHBondContact O-N 3.07Å; M614-Q616 PolarHBondContact O-N 3.27Å
617	G	80.1	Confident	84.7	Confident	42 Å²	42	68.1 Å²	68.1	43%	0.433	34%	0.342	S	S	.	.			trans	79.9	-171.7	-175.6	0	0	0	0	0	113	G611	G611-G617 VanDerWaalsContact CA-O 3.22Å; G611-G617 WeakPolarHBondContact CA-O 3.42Å; G611-G617 PolarHBondContact O-N 2.88Å
618	S	81.2	Confident	84.8	Confident	41 Å²	41	66.1 Å²	66.1	29%	0.287	33%	0.334	S	S	.	.			trans	-139.3	141.2	-177.3	57.6	0	0	0	0	111.2	F608 I620	F608-S618 WeakPolarHBondContact CD2-OG 3.32Å; F608-S618 WeakPolarHBondContact CE2-OG 3.37Å; S618-I620 PolarHBondContact O-N 3.44Å; S618-I620 PolarHBondContact OG-O 3.27Å
619	E	76.7	Confident	84.9	Confident	205 Å²	205	69.6 Å²	69.6	96%	0.958	36%	0.358	S	S	*	.	S	Bend	trans	-66.8	-24.1	174.2	-58	-172.5	152.4	0	0	112.7
620	I	79.4	Confident	84.9	Confident	19 Å²	19	71.3 Å²	71.3	10%	0.097	37%	0.368	C	S	.	.			trans	-77.7	126.7	173.4	-56	149.2	0	0	0	108.3	Q599 Y600 N604 F608 S618	Q599-I620 HydrophobicContact CB-CG2 4.05Å; Y600-I620 HydrophobicContact CD1-CG2 4.43Å; Y600-I620 HydrophobicContact CD2-CG2 4.48Å; Y600-I620 HydrophobicContact CE1-CG2 3.84Å; Y600-I620 HydrophobicContact CE2-CG2 3.89Å; N604-I620 HydrophobicContact CB-CD1 3.68Å; F608-I620 HydrophobicContact CB-CD1 4.49Å; F608-I620 HydrophobicContact CD2-CB 4.2Å; F608-I620 HydrophobicContact CD2-CG2 4.36Å; F608-I620 WeakPolarHBondContact CE2-O 3.15Å; S618-I620 PolarHBondContact O-N 3.44Å; S618-I620 PolarHBondContact OG-O 3.27Å
621	M	79.6	Confident	84.9	Confident	122 Å²	122	69.8 Å²	69.8	60%	0.601	36%	0.359	S	S	*	.			trans	-119.5	119.5	180	178.2	173.5	59.6	0	0	110.9
622	P	83.7	Confident	85	Confident	8 Å²	8	71 Å²	71	5%	0.052	37%	0.372	C	S	.	.			trans	-65.5	135.6	179.8	26.8	-34.8	0	0	0	111.5	F608 T627 R628	F608-P622 HydrophobicContact CZ-CG 4.42Å; P622-T627 WeakPolarHBondContact CB-OG1 3.37Å; P622-R628 HydrophobicContact CB-CG 3.95Å; P622-R628 HydrophobicContact CG-CG 3.98Å; P622-R628 PolarHBondContact O-NE 3.47Å; P622-R628 PolarHBondContact O-NH2 3.47Å
623	R	79.8	Confident	85.4	Confident	101 Å²	101	75.7 Å²	75.7	38%	0.381	40%	0.398	S	S	.	.			trans	-107.8	-38.8	-177	-57.1	-175.7	179.3	-172	3.3	112.5	E581 Y583	E581-R623 PolarHBondContact OE1-N 2.64Å; E581-R623 WeakPolarHBondContact OE2-CB 3.38Å; E581-R623 PolarHBondContact OE2-N 2.92Å; Y583-R623 VanDerWaalsContact CD1-NH1 3.27Å
624	A	86.3	Confident	85.6	Confident	3 Å²	3	72.3 Å²	72.3	3%	0.025	38%	0.383	C	S	.	.	S	Bend	trans	-73.1	155.3	177.3	0	0	0	0	0	111.6	E581 S626 T627 R628	E581-A624 HydrophobicContact CG-CB 3.84Å; E581-A624 PolarHBondContact OE1-N 3.08Å; A624-S626 VanDerWaalsContact C-N 3.34Å; A624-S626 PolarHBondContact O-N 2.86Å; A624-T627 PolarHBondContact O-OG1 2.8Å; A624-R628 WeakPolarHBondContact O-CB 3.42Å; A624-R628 WeakPolarHBondContact O-CD 3.46Å; A624-R628 WeakPolarHBondContact O-CG 3.31Å; A624-R628 PolarHBondContact O-N 2.84Å; A624-R628 VanDerWaalsContact O-N 3.16Å
625	L	86.4	Confident	85.8	Confident	138 Å²	138	73.2 Å²	73.2	72%	0.723	38%	0.381	S	S	*	.	H	α-helix	trans	-66.6	-36.8	177	-173.9	61.1	0	0	0	111.8	R628 C629	L625-R628 PolarHBondContact O-N 2.78Å; L625-C629 PolarHBondContact O-N 2.83Å; L625-C629 PolarHBondContact O-SG 3.07Å
626	S	87.5	Confident	86.1	Confident	53 Å²	53	69.3 Å²	69.3	37%	0.371	37%	0.372	S	S	.	.	H	α-helix	trans	-61.2	-52.1	179.3	46.8	0	0	0	0	112.8	A624 R628 C629 V630	A624-S626 VanDerWaalsContact C-N 3.34Å; A624-S626 PolarHBondContact O-N 2.86Å; S626-R628 VanDerWaalsContact C-N 3.34Å; S626-R628 PolarHBondContact O-N 2.72Å; S626-C629 PolarHBondContact O-N 2.83Å; S626-V630 WeakPolarHBondContact O-CG2 3.11Å; S626-V630 PolarHBondContact O-N 2.91Å; S626-V630 VanDerWaalsContact O-N 3.11Å
627	T	87.6	Confident	86.5	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-65.4	-35.4	177.6	51.4	0	0	0	0	112	A574 A575 E581 P622 A624 S631	A574-T627 HydrophobicContact CB-CG2 4.27Å; A575-T627 HydrophobicContact CB-CG2 3.86Å; E581-T627 HydrophobicContact CG-CG2 3.97Å; E581-T627 WeakPolarHBondContact OE1-CB 3.35Å; E581-T627 PolarHBondContact OE1-OG1 2.82Å; P622-T627 WeakPolarHBondContact CB-OG1 3.37Å; A624-T627 PolarHBondContact O-OG1 2.8Å; T627-S631 VanDerWaalsContact O-CB 3.28Å; T627-S631 WeakPolarHBondContact O-CB 3.04Å; T627-S631 PolarHBondContact O-N 3.32Å; T627-S631 PolarHBondContact O-OG 2.83Å
628	R	90.2	Very high	87	Confident	130 Å²	130	63.4 Å²	63.4	49%	0.491	33%	0.332	S	S	.	.	H	α-helix	trans	-63.4	-44.2	172.1	-76.1	173.3	177.3	-166.8	-3.2	112.5	P622 A624 L625 S626 S631 G632	P622-R628 HydrophobicContact CB-CG 3.95Å; P622-R628 HydrophobicContact CG-CG 3.98Å; P622-R628 PolarHBondContact O-NE 3.47Å; P622-R628 PolarHBondContact O-NH2 3.47Å; A624-R628 WeakPolarHBondContact O-CB 3.42Å; A624-R628 WeakPolarHBondContact O-CD 3.46Å; A624-R628 WeakPolarHBondContact O-CG 3.31Å; A624-R628 PolarHBondContact O-N 2.84Å; A624-R628 VanDerWaalsContact O-N 3.16Å; L625-R628 PolarHBondContact O-N 2.78Å; S626-R628 VanDerWaalsContact C-N 3.34Å; S626-R628 PolarHBondContact O-N 2.72Å; R628-S631 PolarHBondContact O-N 2.86Å; R628-G632 PolarHBondContact O-N 3.08Å
629	C	90.1	Very high	87.5	Confident	74 Å²	74	66.5 Å²	66.5	50%	0.5	35%	0.345	S	S	.	.	H	α-helix	trans	-62.9	-46.3	176.9	-70	0	0	0	0	111.8	L625 S626 S631 G632 V633	L625-C629 PolarHBondContact O-N 2.83Å; L625-C629 PolarHBondContact O-SG 3.07Å; S626-C629 PolarHBondContact O-N 2.83Å; C629-S631 PolarHBondContact O-N 3.29Å; C629-G632 PolarHBondContact O-N 3.46Å; C629-V633 WeakPolarHBondContact O-CG2 3.46Å; C629-V633 PolarHBondContact O-N 3.49Å
630	V	90.7	Very high	88.2	Confident	35 Å²	35	61.7 Å²	61.7	21%	0.212	33%	0.325	C	S	.	.	H	α-helix	trans	-61.9	-43.7	176.6	177.5	0	0	0	0	111.1	V567 V570 L571 S626 V633 W634	V567-V630 HydrophobicContact CG1-CG1 4.3Å; V570-V630 HydrophobicContact CG1-CG1 4.1Å; V570-V630 HydrophobicContact CG1-CG2 3.94Å; L571-V630 HydrophobicContact CD2-CB 3.86Å; L571-V630 HydrophobicContact CD2-CG1 3.61Å; L571-V630 HydrophobicContact CG-CG1 3.75Å; S626-V630 WeakPolarHBondContact O-CG2 3.11Å; S626-V630 PolarHBondContact O-N 2.91Å; S626-V630 VanDerWaalsContact O-N 3.11Å; V630-V633 PolarHBondContact O-N 3.02Å; V630-W634 WeakPolarHBondContact O-CB 3.28Å; V630-W634 PolarHBondContact O-N 3Å
631	S	88.3	Confident	88.8	Confident	1 Å²	1	62.2 Å²	62.2	1%	0.007	33%	0.328	C	S	.	.	H	α-helix	trans	-61.7	-42.7	175.8	-57.4	0	0	0	0	112.8	F608 T627 R628 C629 W634 W635	F608-S631 WeakPolarHBondContact CE1-OG 3.48Å; F608-S631 WeakPolarHBondContact CZ-OG 3.48Å; T627-S631 VanDerWaalsContact O-CB 3.28Å; T627-S631 WeakPolarHBondContact O-CB 3.04Å; T627-S631 PolarHBondContact O-N 3.32Å; T627-S631 PolarHBondContact O-OG 2.83Å; R628-S631 PolarHBondContact O-N 2.86Å; C629-S631 PolarHBondContact O-N 3.29Å; S631-W634 PolarHBondContact O-N 3.27Å; S631-W635 PolarHBondContact O-N 2.92Å
632	G	89.8	Confident	89.4	Confident	33 Å²	33	57.9 Å²	57.9	34%	0.34	31%	0.307	S	S	.	.	H	α-helix	trans	-66.5	-40.6	179.2	0	0	0	0	0	113.1	R628 C629 W635 A636	R628-G632 PolarHBondContact O-N 3.08Å; C629-G632 PolarHBondContact O-N 3.46Å; G632-W635 PolarHBondContact O-N 2.66Å; G632-A636 WeakPolarHBondContact O-CB 3Å; G632-A636 PolarHBondContact O-N 3.35Å
633	V	92.5	Very high	89.7	Confident	107 Å²	107	60.4 Å²	60.4	65%	0.648	32%	0.324	S	S	*	.	H	α-helix	trans	-64.6	-41.7	172.9	173.1	0	0	0	0	110.8	C629 V630 A636 F637	C629-V633 WeakPolarHBondContact O-CG2 3.46Å; C629-V633 PolarHBondContact O-N 3.49Å; V630-V633 PolarHBondContact O-N 3.02Å; V633-A636 PolarHBondContact O-N 2.81Å; V633-F637 WeakPolarHBondContact O-CB 3.3Å; V633-F637 PolarHBondContact O-N 2.85Å
634	W	92.1	Very high	90.3	Very high	7 Å²	7	58.1 Å²	58.1	3%	0.027	32%	0.324	C	S	.	.	H	α-helix	trans	-60.6	-47.6	174.1	179.3	-113	0	0	0	112.1	V567 P609 F613 V630 S631 A636 F637 T638	V567-W634 HydrophobicContact CB-CE3 4.1Å; V567-W634 HydrophobicContact CB-CZ3 4.43Å; V567-W634 HydrophobicContact CG1-CB 4.11Å; V567-W634 HydrophobicContact CG1-CD2 4Å; V567-W634 HydrophobicContact CG1-CE3 4.04Å; V567-W634 HydrophobicContact CG1-CG 4.05Å; V567-W634 HydrophobicContact CG2-CE3 3.76Å; V567-W634 HydrophobicContact CG2-CZ3 4.16Å; P609-W634 HydrophobicContact CB-CZ2 3.85Å; P609-W634 PolarHBondContact O-NE1 3.26Å; F613-W634 HydrophobicContact CB-CZ2 4.41Å; V630-W634 WeakPolarHBondContact O-CB 3.28Å; V630-W634 PolarHBondContact O-N 3Å; S631-W634 PolarHBondContact O-N 3.27Å; W634-A636 PolarHBondContact O-N 3.4Å; W634-F637 AromaticContact CE3-CD1 3.82Å; W634-F637 HydrophobicContact CE3-CD1 3.82Å; W634-F637 HydrophobicContact CE3-CE1 4.41Å; W634-F637 HydrophobicContact CH2-CD1 4.46Å; W634-F637 HydrophobicContact CH2-CE1 4.44Å; W634-F637 AromaticContact CZ3-CD1 3.64Å; W634-F637 HydrophobicContact CZ3-CD1 3.64Å; W634-F637 AromaticContact CZ3-CE1 3.79Å; W634-F637 HydrophobicContact CZ3-CE1 3.79Å; W634-F637 WeakPolarHBondContact O-CB 3.5Å; W634-F637 PolarHBondContact O-N 2.84Å; W634-T638 HydrophobicContact CD2-CG2 3.83Å; W634-T638 VanDerWaalsContact CE2-CG2 3.41Å; W634-T638 HydrophobicContact CE3-CG2 4.3Å; W634-T638 HydrophobicContact CG-CG2 4.36Å; W634-T638 HydrophobicContact CH2-CG2 4.12Å; W634-T638 HydrophobicContact CZ2-CG2 3.59Å; W634-T638 HydrophobicContact CZ3-CG2 4.44Å; W634-T638 WeakPolarHBondContact O-CG2 3.49Å; W634-T638 PolarHBondContact O-N 3Å; W634-T638 PolarHBondContact O-OG1 2.93Å; W634-T638 VanDerWaalsContact O-OG1 3.11Å
635	W	90.8	Very high	90.5	Very high	123 Å²	123	60.4 Å²	60.4	47%	0.466	33%	0.332	S	S	.	.	H	α-helix	trans	-61.7	-41.1	178.9	-65.6	-24.8	0	0	0	112.8	F608 S631 G632 T638 L639	F608-W635 HydrophobicContact CZ-CZ2 4.04Å; S631-W635 PolarHBondContact O-N 2.92Å; G632-W635 PolarHBondContact O-N 2.66Å; W635-T638 WeakPolarHBondContact CA-OG1 3.32Å; W635-T638 PolarHBondContact O-OG1 2.74Å; W635-T638 VanDerWaalsContact O-OG1 3.07Å; W635-L639 WeakPolarHBondContact O-CB 3.46Å; W635-L639 PolarHBondContact O-N 2.66Å
636	A	91.8	Very high	90.7	Very high	53 Å²	53	57.6 Å²	57.6	44%	0.438	32%	0.321	S	S	.	.	H	α-helix	trans	-62.4	-44.7	174	0	0	0	0	0	111.9	G632 V633 W634 L639 I640	G632-A636 WeakPolarHBondContact O-CB 3Å; G632-A636 PolarHBondContact O-N 3.35Å; V633-A636 PolarHBondContact O-N 2.81Å; W634-A636 PolarHBondContact O-N 3.4Å; A636-L639 PolarHBondContact O-N 3.12Å; A636-I640 WeakPolarHBondContact O-CG1 3.49Å; A636-I640 PolarHBondContact O-N 3.06Å
637	F	92.1	Very high	90.7	Very high	73 Å²	73	57.8 Å²	57.8	32%	0.32	33%	0.326	S	S	.	.	H	α-helix	trans	-61.8	-48.7	175.9	175.2	-104.4	0	0	0	112.2	M560 A563 V633 W634 L639 I640 I641	M560-F637 HydrophobicContact CE-CE1 3.72Å; M560-F637 HydrophobicContact CE-CZ 4.21Å; M560-F637 HydrophobicContact SD-CE1 3.64Å; M560-F637 HydrophobicContact SD-CZ 3.48Å; M560-F637 WeakPolarHBondContact SD-CZ 3.38Å; A563-F637 HydrophobicContact CB-CE1 4.36Å; A563-F637 HydrophobicContact CB-CZ 4.46Å; V633-F637 WeakPolarHBondContact O-CB 3.3Å; V633-F637 PolarHBondContact O-N 2.85Å; W634-F637 AromaticContact CE3-CD1 3.82Å; W634-F637 HydrophobicContact CE3-CD1 3.82Å; W634-F637 HydrophobicContact CE3-CE1 4.41Å; W634-F637 HydrophobicContact CH2-CD1 4.46Å; W634-F637 HydrophobicContact CH2-CE1 4.44Å; W634-F637 AromaticContact CZ3-CD1 3.64Å; W634-F637 HydrophobicContact CZ3-CD1 3.64Å; W634-F637 AromaticContact CZ3-CE1 3.79Å; W634-F637 HydrophobicContact CZ3-CE1 3.79Å; W634-F637 WeakPolarHBondContact O-CB 3.5Å; W634-F637 PolarHBondContact O-N 2.84Å; F637-L639 VanDerWaalsContact C-N 3.32Å; F637-L639 PolarHBondContact O-N 3.46Å; F637-I640 PolarHBondContact O-N 2.77Å; F637-I641 HydrophobicContact CD1-CG1 4.49Å; F637-I641 HydrophobicContact CD2-CG1 4.33Å; F637-I641 HydrophobicContact CE1-CG1 4.17Å; F637-I641 HydrophobicContact CE2-CD1 4.15Å; F637-I641 HydrophobicContact CE2-CG1 3.99Å; F637-I641 HydrophobicContact CZ-CD1 4.19Å; F637-I641 HydrophobicContact CZ-CG1 3.91Å; F637-I641 WeakPolarHBondContact O-CG1 3.45Å; F637-I641 PolarHBondContact O-N 3.21Å
638	T	91	Very high	90.7	Very high	6 Å²	6	61.4 Å²	61.4	4%	0.037	35%	0.345	C	S	.	.	H	α-helix	trans	-64.7	-35.3	179.3	52.6	0	0	0	0	112.6	F613 W634 W635 I642	F613-T638 HydrophobicContact CB-CG2 4.28Å; F613-T638 HydrophobicContact CD2-CG2 4.02Å; W634-T638 HydrophobicContact CD2-CG2 3.83Å; W634-T638 VanDerWaalsContact CE2-CG2 3.41Å; W634-T638 HydrophobicContact CE3-CG2 4.3Å; W634-T638 HydrophobicContact CG-CG2 4.36Å; W634-T638 HydrophobicContact CH2-CG2 4.12Å; W634-T638 HydrophobicContact CZ2-CG2 3.59Å; W634-T638 HydrophobicContact CZ3-CG2 4.44Å; W634-T638 WeakPolarHBondContact O-CG2 3.49Å; W634-T638 PolarHBondContact O-N 3Å; W634-T638 PolarHBondContact O-OG1 2.93Å; W634-T638 VanDerWaalsContact O-OG1 3.11Å; W635-T638 WeakPolarHBondContact CA-OG1 3.32Å; W635-T638 PolarHBondContact O-OG1 2.74Å; W635-T638 VanDerWaalsContact O-OG1 3.07Å; T638-I642 WeakPolarHBondContact O-CB 3.48Å; T638-I642 VanDerWaalsContact O-CD1 3.27Å; T638-I642 WeakPolarHBondContact O-CD1 3.4Å; T638-I642 WeakPolarHBondContact O-CG1 3.37Å; T638-I642 PolarHBondContact O-N 3.26Å
639	L	90.4	Very high	90.3	Very high	105 Å²	105	57.1 Å²	57.1	55%	0.55	33%	0.332	S	S	.	.	H	α-helix	trans	-60.1	-51.8	175.1	-172.7	162.8	0	0	0	110.4	W635 A636 F637 I641 I642 S643	W635-L639 WeakPolarHBondContact O-CB 3.46Å; W635-L639 PolarHBondContact O-N 2.66Å; A636-L639 PolarHBondContact O-N 3.12Å; F637-L639 VanDerWaalsContact C-N 3.32Å; F637-L639 PolarHBondContact O-N 3.46Å; L639-I641 PolarHBondContact O-N 3.49Å; L639-I642 PolarHBondContact O-N 3.38Å; L639-S643 WeakPolarHBondContact O-CB 3.32Å; L639-S643 PolarHBondContact O-N 3.03Å; L639-S643 PolarHBondContact O-OG 3.34Å
640	I	92.3	Very high	89.8	Confident	105 Å²	105	56.2 Å²	56.2	54%	0.538	33%	0.33	S	S	.	.	H	α-helix	trans	-57.1	-50.7	178.9	-66.7	164.9	0	0	0	110.8	A636 F637 I642 S643 S644	A636-I640 WeakPolarHBondContact O-CG1 3.49Å; A636-I640 PolarHBondContact O-N 3.06Å; F637-I640 PolarHBondContact O-N 2.77Å; I640-I642 PolarHBondContact O-N 2.99Å; I640-S643 PolarHBondContact O-N 2.83Å; I640-S644 PolarHBondContact O-N 2.9Å; I640-S644 PolarHBondContact O-OG 2.59Å
641	I	92	Very high	89.2	Confident	30 Å²	30	57.1 Å²	57.1	15%	0.154	34%	0.341	C	S	.	.	H	α-helix	trans	-60.6	-44.5	-177.8	-66.3	-68.2	0	0	0	111.7	F552 M560 F613 F637 L639 S644 Y645	F552-I641 HydrophobicContact CE2-CG2 3.84Å; F552-I641 HydrophobicContact CZ-CG2 4.14Å; F552-I641 WeakPolarHBondContact CZ-O 3.35Å; M560-I641 HydrophobicContact CE-CB 4.45Å; M560-I641 HydrophobicContact CE-CG1 4.28Å; M560-I641 HydrophobicContact CE-CG2 3.89Å; M560-I641 HydrophobicContact SD-CB 4.42Å; M560-I641 HydrophobicContact SD-CD1 3.87Å; M560-I641 HydrophobicContact SD-CG1 3.81Å; M560-I641 HydrophobicContact SD-CG2 3.89Å; F613-I641 HydrophobicContact CE2-CG2 4.43Å; F637-I641 HydrophobicContact CD1-CG1 4.49Å; F637-I641 HydrophobicContact CD2-CG1 4.33Å; F637-I641 HydrophobicContact CE1-CG1 4.17Å; F637-I641 HydrophobicContact CE2-CD1 4.15Å; F637-I641 HydrophobicContact CE2-CG1 3.99Å; F637-I641 HydrophobicContact CZ-CD1 4.19Å; F637-I641 HydrophobicContact CZ-CG1 3.91Å; F637-I641 WeakPolarHBondContact O-CG1 3.45Å; F637-I641 PolarHBondContact O-N 3.21Å; L639-I641 PolarHBondContact O-N 3.49Å; I641-S644 PolarHBondContact O-N 3.49Å; I641-Y645 WeakPolarHBondContact O-CB 3.46Å; I641-Y645 PolarHBondContact O-N 3.25Å
642	I	91.4	Very high	88.5	Confident	31 Å²	31	61.7 Å²	61.7	16%	0.159	36%	0.361	C	S	.	.	H	α-helix	trans	-70.1	-39.5	-178.3	-61.1	160.5	0	0	0	110.6	F613 Q615 T638 L639 I640 Y645 T646	F613-I642 HydrophobicContact CE2-CG1 4.5Å; F613-I642 WeakPolarHBondContact O-CD1 3.47Å; Q615-I642 HydrophobicContact CG-CD1 3.81Å; T638-I642 WeakPolarHBondContact O-CB 3.48Å; T638-I642 VanDerWaalsContact O-CD1 3.27Å; T638-I642 WeakPolarHBondContact O-CD1 3.4Å; T638-I642 WeakPolarHBondContact O-CG1 3.37Å; T638-I642 PolarHBondContact O-N 3.26Å; L639-I642 PolarHBondContact O-N 3.38Å; I640-I642 PolarHBondContact O-N 2.99Å; I642-Y645 PolarHBondContact O-N 2.6Å; I642-T646 PolarHBondContact O-N 3.1Å; I642-T646 PolarHBondContact O-OG1 3.48Å
643	S	90.6	Very high	87.7	Confident	60 Å²	60	62.9 Å²	62.9	42%	0.42	36%	0.359	S	S	.	.	H	α-helix	trans	-59.6	-46.5	173.6	-66.6	0	0	0	0	112	L639 I640 T646 A647	L639-S643 WeakPolarHBondContact O-CB 3.32Å; L639-S643 PolarHBondContact O-N 3.03Å; L639-S643 PolarHBondContact O-OG 3.34Å; I640-S643 PolarHBondContact O-N 2.83Å; S643-T646 PolarHBondContact O-N 2.82Å; S643-T646 PolarHBondContact O-OG1 3.25Å; S643-A647 WeakPolarHBondContact O-CB 3.46Å; S643-A647 PolarHBondContact O-N 3.38Å
644	S	91.7	Very high	86.6	Confident	53 Å²	53	62.8 Å²	62.8	37%	0.371	36%	0.358	S	S	.	.	H	α-helix	trans	-62.2	-41.3	175.6	-64.9	0	0	0	0	112.6	I640 I641 A647 N648	I640-S644 PolarHBondContact O-N 2.9Å; I640-S644 PolarHBondContact O-OG 2.59Å; I641-S644 PolarHBondContact O-N 3.49Å; S644-A647 PolarHBondContact O-N 2.86Å; S644-N648 WeakPolarHBondContact O-CB 3.35Å; S644-N648 PolarHBondContact O-N 2.82Å
645	Y	91.4	Very high	85.1	Confident	51 Å²	51	66.2 Å²	66.2	20%	0.2	38%	0.38	C	S	.	.	H	α-helix	trans	-60	-48.5	174.8	174.5	-98.7	0	0	0	111.5	F548 P551 F552 W557 I641 I642 A647 N648 L649	F548-Y645 WeakPolarHBondContact O-CE2 3.03Å; F548-Y645 PolarHBondContact O-OH 3.34Å; P551-Y645 HydrophobicContact CB-CD2 4.05Å; P551-Y645 HydrophobicContact CB-CE2 4.08Å; P551-Y645 HydrophobicContact CG-CE2 4.1Å; F552-Y645 HydrophobicContact CD2-CD2 4.11Å; F552-Y645 HydrophobicContact CE2-CD2 4.1Å; F552-Y645 HydrophobicContact CE2-CG 4.34Å; W557-Y645 HydrophobicContact CZ2-CE2 4.25Å; I641-Y645 WeakPolarHBondContact O-CB 3.46Å; I641-Y645 PolarHBondContact O-N 3.25Å; I642-Y645 PolarHBondContact O-N 2.6Å; Y645-A647 VanDerWaalsContact C-N 3.32Å; Y645-A647 PolarHBondContact O-N 3.22Å; Y645-N648 PolarHBondContact O-N 3.08Å; Y645-L649 HydrophobicContact CE1-CD2 3.94Å; Y645-L649 VanDerWaalsContact O-CB 3.27Å; Y645-L649 WeakPolarHBondContact O-CB 3.42Å; Y645-L649 PolarHBondContact O-N 3.42Å
646	T	89.9	Confident	83.6	Confident	79 Å²	79	67.4 Å²	67.4	49%	0.485	39%	0.391	S	S	.	.	H	α-helix	trans	-65.2	-34.4	-180	51.8	0	0	0	0	113	I642 S643 A650	I642-T646 PolarHBondContact O-N 3.1Å; I642-T646 PolarHBondContact O-OG1 3.48Å; S643-T646 PolarHBondContact O-N 2.82Å; S643-T646 PolarHBondContact O-OG1 3.25Å; T646-A650 WeakPolarHBondContact O-CB 3.49Å; T646-A650 PolarHBondContact O-N 3.23Å; T646-A650 VanDerWaalsContact O-N 3.1Å
647	A	88.6	Confident	81.9	Confident	58 Å²	58	74.7 Å²	74.7	48%	0.479	41%	0.407	S	S	.	.	H	α-helix	trans	-68.2	-48.9	175.8	0	0	0	0	0	111.8	S643 S644 Y645 L649 A650 A651	S643-A647 WeakPolarHBondContact O-CB 3.46Å; S643-A647 PolarHBondContact O-N 3.38Å; S644-A647 PolarHBondContact O-N 2.86Å; Y645-A647 VanDerWaalsContact C-N 3.32Å; Y645-A647 PolarHBondContact O-N 3.22Å; A647-L649 PolarHBondContact O-N 3.4Å; A647-A650 PolarHBondContact O-N 2.57Å; A647-A651 PolarHBondContact O-N 2.92Å
648	N	86.4	Confident	80.2	Confident	76 Å²	76	76.3 Å²	76.3	41%	0.406	42%	0.417	S	S	.	.	H	α-helix	trans	-62.7	-42.4	178	-74.4	7.7	0	0	0	111.8	P551 S644 Y645 A650 A651 F652	P551-N648 HydrophobicContact CB-CB 3.86Å; P551-N648 PolarHBondContact O-ND2 3.27Å; S644-N648 WeakPolarHBondContact O-CB 3.35Å; S644-N648 PolarHBondContact O-N 2.82Å; Y645-N648 PolarHBondContact O-N 3.08Å; N648-A650 PolarHBondContact O-N 3.4Å; N648-A651 PolarHBondContact O-N 2.81Å; N648-F652 WeakPolarHBondContact O-CB 3.33Å; N648-F652 PolarHBondContact O-N 3.32Å
649	L	83.3	Confident	78.5	Confident	40 Å²	40	84.4 Å²	84.4	21%	0.209	45%	0.454	C	S	.	.	H	α-helix	trans	-62.5	-41.9	177.2	-179.5	62.9	0	0	0	111.7	P551 Y645 A647 F652 L653	P551-L649 HydrophobicContact CB-CB 4.45Å; P551-L649 HydrophobicContact CG-CB 3.95Å; P551-L649 HydrophobicContact CG-CD1 3.83Å; P551-L649 HydrophobicContact CG-CG 4.48Å; Y645-L649 HydrophobicContact CE1-CD2 3.94Å; Y645-L649 VanDerWaalsContact O-CB 3.27Å; Y645-L649 WeakPolarHBondContact O-CB 3.42Å; Y645-L649 PolarHBondContact O-N 3.42Å; A647-L649 PolarHBondContact O-N 3.4Å; L649-F652 PolarHBondContact O-N 3.46Å; L649-L653 HydrophobicContact CD1-CD1 3.85Å; L649-L653 HydrophobicContact CD1-CG 4.09Å; L649-L653 HydrophobicContact CG-CD1 3.9Å; L649-L653 HydrophobicContact CG-CG 4.49Å; L649-L653 WeakPolarHBondContact O-CB 3.49Å; L649-L653 VanDerWaalsContact O-CG 3.25Å; L649-L653 WeakPolarHBondContact O-CG 3.07Å; L649-L653 PolarHBondContact O-N 2.84Å
650	A	77.9	Confident	77.3	Confident	55 Å²	55	83 Å²	83	46%	0.455	45%	0.45	S	S	.	.	H	α-helix	trans	-65.1	-40.1	176.5	0	0	0	0	0	112.7	T646 A647 N648 T654	T646-A650 WeakPolarHBondContact O-CB 3.49Å; T646-A650 PolarHBondContact O-N 3.23Å; T646-A650 VanDerWaalsContact O-N 3.1Å; A647-A650 PolarHBondContact O-N 2.57Å; N648-A650 PolarHBondContact O-N 3.4Å; A650-T654 WeakPolarHBondContact O-CG2 3.27Å; A650-T654 PolarHBondContact O-N 3.29Å; A650-T654 PolarHBondContact O-OG1 3.38Å
651	A	78.5	Confident	76.2	Confident	54 Å²	54	81.3 Å²	81.3	45%	0.446	45%	0.446	S	S	.	.	H	α-helix	trans	-64.5	-46	174	0	0	0	0	0	112.2	A647 N648 L653 T654 V655	A647-A651 PolarHBondContact O-N 2.92Å; N648-A651 PolarHBondContact O-N 2.81Å; A651-L653 PolarHBondContact O-N 2.89Å; A651-T654 PolarHBondContact O-N 3.32Å; A651-T654 PolarHBondContact O-OG1 3Å; A651-T654 VanDerWaalsContact O-OG1 3.08Å; A651-V655 PolarHBondContact O-N 3.41Å
652	F	74.6	Confident	75.5	Confident	97 Å²	97	80.2 Å²	80.2	43%	0.425	44%	0.44	S	S	.	.	H	α-helix	trans	-63.3	-39.3	179.2	-171.2	-101.7	0	0	0	112.6	D550 N648 L649 T654	D550-F652 HydrophobicContact CB-CZ 4.35Å; N648-F652 WeakPolarHBondContact O-CB 3.33Å; N648-F652 PolarHBondContact O-N 3.32Å; L649-F652 PolarHBondContact O-N 3.46Å; F652-T654 VanDerWaalsContact C-N 3.31Å; F652-T654 PolarHBondContact O-N 2.87Å
653	L	73.4	Confident	74.9	Confident	57 Å²	57	86.1 Å²	86.1	30%	0.298	47%	0.467	S	S	.	.	H	α-helix	trans	-74.7	-16.5	177.4	-69.9	173.3	0	0	0	114.1	L649 A651 L809 N813	L649-L653 HydrophobicContact CD1-CD1 3.85Å; L649-L653 HydrophobicContact CD1-CG 4.09Å; L649-L653 HydrophobicContact CG-CD1 3.9Å; L649-L653 HydrophobicContact CG-CG 4.49Å; L649-L653 WeakPolarHBondContact O-CB 3.49Å; L649-L653 VanDerWaalsContact O-CG 3.25Å; L649-L653 WeakPolarHBondContact O-CG 3.07Å; L649-L653 PolarHBondContact O-N 2.84Å; A651-L653 PolarHBondContact O-N 2.89Å; L653-L809 HydrophobicContact CB-CD2 4.11Å; L653-L809 HydrophobicContact CD1-CD2 4Å; L653-L809 HydrophobicContact CD2-CD2 3.94Å; L653-L809 HydrophobicContact CG-CD2 4.25Å; L653-N813 HydrophobicContact CD2-CB 4.19Å
654	T	68.6	Low	74.7	Confident	105 Å²	105	84.9 Å²	84.9	64%	0.644	46%	0.458	S	S	*	.	H	α-helix	trans	-99.2	-18	177.8	46.2	0	0	0	0	113.6	A650 A651 F652	A650-T654 WeakPolarHBondContact O-CG2 3.27Å; A650-T654 PolarHBondContact O-N 3.29Å; A650-T654 PolarHBondContact O-OG1 3.38Å; A651-T654 PolarHBondContact O-N 3.32Å; A651-T654 PolarHBondContact O-OG1 3Å; A651-T654 VanDerWaalsContact O-OG1 3.08Å; F652-T654 VanDerWaalsContact C-N 3.31Å; F652-T654 PolarHBondContact O-N 2.87Å
655	V	60.6	Low	74.4	Confident	80 Å²	80	83.6 Å²	83.6	49%	0.485	45%	0.449	S	S	.	.			trans	-126.8	79.9	-173	-174.5	0	0	0	0	111.3	A651 R657	A651-V655 PolarHBondContact O-N 3.41Å; V655-R657 VanDerWaalsContact C-N 3.31Å; V655-R657 HydrophobicContact CG1-CG 3.76Å; V655-R657 PolarHBondContact O-N 2.91Å; V655-R657 VanDerWaalsContact O-N 3.11Å
656	Q	58.6	Low	74.2	Confident	147 Å²	147	83.8 Å²	83.8	69%	0.687	45%	0.453	S	S	*	.			trans	-78.4	82	161.5	-72.2	-174.3	-16.5	0	0	109.3
657	R	56.5	Low	74.1	Confident	206 Å²	206	83.4 Å²	83.4	78%	0.777	45%	0.448	S	S	*	.			trans	-68.1	136.3	169.3	-87.2	171.7	-176	-166.7	-0.6	109.9	V655 E659	V655-R657 VanDerWaalsContact C-N 3.31Å; V655-R657 HydrophobicContact CG1-CG 3.76Å; V655-R657 PolarHBondContact O-N 2.91Å; V655-R657 VanDerWaalsContact O-N 3.11Å; R657-E659 PolarHBondContact O-N 3.43Å
658	M	55.9	Low	74.1	Confident	107 Å²	107	80.7 Å²	80.7	53%	0.527	43%	0.426	S	S	.	.			trans	-74.7	114.6	162.5	-66.1	-173.3	-72.7	0	0	107.6	V660	M658-V660 PolarHBondContact O-N 3.22Å; M658-V660 VanDerWaalsContact O-N 3.14Å
659	E	57	Low	74.3	Confident	177 Å²	177	77.8 Å²	77.8	83%	0.827	41%	0.412	S	S	*	.			trans	-72.7	101.2	170.7	-68.8	-176.5	157.2	0	0	108.7	R657	R657-E659 PolarHBondContact O-N 3.43Å
660	V	64.6	Low	74.6	Confident	74 Å²	74	81.2 Å²	81.2	45%	0.448	43%	0.431	S	S	.	.			trans	-78.8	124.7	172.6	-162.2	0	0	0	0	107.4	M658 I662 I749	M658-V660 PolarHBondContact O-N 3.22Å; M658-V660 VanDerWaalsContact O-N 3.14Å; V660-I662 WeakPolarHBondContact CG1-O 3.45Å; V660-I662 PolarHBondContact O-N 3.26Å; V660-I749 HydrophobicContact CG1-CD1 3.97Å; V660-I749 HydrophobicContact CG1-CG1 3.96Å
661	P	68.9	Low	75.1	Confident	71 Å²	71	80.7 Å²	80.7	46%	0.461	42%	0.419	S	S	.	.	S	Bend	trans	-77.5	-3.1	-171.3	32.5	-38.6	0	0	0	114.1	Y535 I674	Y535-P661 HydrophobicContact CE1-CG 4.4Å; P661-I674 HydrophobicContact CG-CD1 4.4Å
662	I	77.8	Confident	75.5	Confident	7 Å²	7	82.8 Å²	82.8	4%	0.036	43%	0.427	C	S	.	.			trans	-151.3	129.5	-174.3	-65.5	-177.8	0	0	0	105.4	V660 S664 D667 L668 I674 I749	V660-I662 WeakPolarHBondContact CG1-O 3.45Å; V660-I662 PolarHBondContact O-N 3.26Å; I662-S664 VanDerWaalsContact CG2-O 3.25Å; I662-S664 WeakPolarHBondContact CG2-O 3.42Å; I662-D667 HydrophobicContact CG2-CB 4.16Å; I662-L668 HydrophobicContact CD1-CB 4.15Å; I662-L668 HydrophobicContact CD1-CD1 3.54Å; I662-L668 HydrophobicContact CD1-CG 4.43Å; I662-L668 HydrophobicContact CG2-CB 4.22Å; I662-I674 HydrophobicContact CD1-CD1 3.75Å; I662-I674 HydrophobicContact CG1-CD1 4.32Å; I662-I749 HydrophobicContact CB-CD1 4.46Å; I662-I749 HydrophobicContact CB-CG2 4.16Å; I662-I749 HydrophobicContact CG2-CG2 3.82Å; I662-I749 VanDerWaalsContact O-CG2 3.24Å; I662-I749 WeakPolarHBondContact O-CG2 3.18Å
663	E	79.1	Confident	76.2	Confident	154 Å²	154	83.5 Å²	83.5	72%	0.72	44%	0.435	S	S	*	.	S	Bend	trans	-110.1	-28.3	171.2	-65.3	-169.7	166.4	0	0	111.7	D667	E663-D667 PolarHBondContact N-OD2 2.98Å; E663-D667 VanDerWaalsContact N-OD2 3.1Å
664	S	84.8	Confident	77	Confident	34 Å²	34	81.4 Å²	81.4	24%	0.238	42%	0.424	C	S	.	.	S	Bend	trans	-124.1	160.4	-174	73.3	0	0	0	0	113.5	I662 D666 D667 L668	I662-S664 VanDerWaalsContact CG2-O 3.25Å; I662-S664 WeakPolarHBondContact CG2-O 3.42Å; S664-D666 PolarHBondContact O-N 2.71Å; S664-D666 PolarHBondContact OG-N 3.5Å; S664-D667 WeakPolarHBondContact CB-OD2 3.48Å; S664-D667 PolarHBondContact N-OD2 3.08Å; S664-D667 PolarHBondContact O-N 3.25Å; S664-D667 PolarHBondContact OG-N 2.87Å; S664-D667 VanDerWaalsContact OG-N 3.07Å; S664-D667 PolarHBondContact OG-OD2 2.04Å; S664-L668 PolarHBondContact O-N 2.82Å
665	P	85.8	Confident	78.2	Confident	26 Å²	26	79.1 Å²	79.1	17%	0.169	41%	0.406	C	S	.	.	H	α-helix	trans	-67.6	-21.6	170	29.7	-36.2	0	0	0	113	L668 A669 Y696 M699 L753	P665-L668 PolarHBondContact O-N 3.47Å; P665-A669 WeakPolarHBondContact O-CB 3.11Å; P665-A669 PolarHBondContact O-N 2.89Å; P665-A669 VanDerWaalsContact O-N 3.11Å; P665-Y696 HydrophobicContact CB-CE1 4.3Å; P665-Y696 HydrophobicContact CG-CE1 4.32Å; P665-M699 HydrophobicContact CB-SD 4.42Å; P665-L753 HydrophobicContact CB-CD2 3.93Å; P665-L753 HydrophobicContact CB-CG 4.28Å; P665-L753 HydrophobicContact CG-CD2 4.48Å; P665-L753 HydrophobicContact CG-CG 4.36Å
666	D	88.1	Confident	79.7	Confident	55 Å²	55	75.4 Å²	75.4	29%	0.294	38%	0.383	S	S	.	.	H	α-helix	trans	-69.2	-43.8	174.4	-65.5	-81.1	0	0	0	111.4	S664 L668 A669 D670 T695	S664-D666 PolarHBondContact O-N 2.71Å; S664-D666 PolarHBondContact OG-N 3.5Å; D666-L668 VanDerWaalsContact C-N 3.26Å; D666-L668 PolarHBondContact O-N 3.5Å; D666-A669 PolarHBondContact O-N 3.27Å; D666-D670 PolarHBondContact O-N 2.91Å; D666-T695 HydrophobicContact CB-CG2 4.48Å; D666-T695 WeakPolarHBondContact OD1-CB 3.21Å; D666-T695 VanDerWaalsContact OD1-CG2 3.24Å; D666-T695 WeakPolarHBondContact OD1-CG2 3.47Å; D666-T695 PolarHBondContact OD1-OG1 3.02Å
667	D	88.3	Confident	81.5	Confident	72 Å²	72	68.4 Å²	68.4	39%	0.385	35%	0.35	S	S	.	.	H	α-helix	trans	-55.2	-44.7	173.1	-55.8	-51.2	0	0	0	110.9	I662 E663 S664 A669 Q671	I662-D667 HydrophobicContact CG2-CB 4.16Å; E663-D667 PolarHBondContact N-OD2 2.98Å; E663-D667 VanDerWaalsContact N-OD2 3.1Å; S664-D667 WeakPolarHBondContact CB-OD2 3.48Å; S664-D667 PolarHBondContact N-OD2 3.08Å; S664-D667 PolarHBondContact O-N 3.25Å; S664-D667 PolarHBondContact OG-N 2.87Å; S664-D667 VanDerWaalsContact OG-N 3.07Å; S664-D667 PolarHBondContact OG-OD2 2.04Å; D667-A669 VanDerWaalsContact C-N 3.29Å; D667-A669 PolarHBondContact O-N 3.09Å; D667-Q671 WeakPolarHBondContact O-CG 3.15Å; D667-Q671 PolarHBondContact O-N 3.12Å
668	L	88.6	Confident	83.2	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-63.7	-33.3	178.9	-178.6	66.4	0	0	0	112.3	I533 I662 S664 P665 D666 Q671 I674 Y676 M699 A728 L730	I533-L668 HydrophobicContact CD1-CD2 4.15Å; I662-L668 HydrophobicContact CD1-CB 4.15Å; I662-L668 HydrophobicContact CD1-CD1 3.54Å; I662-L668 HydrophobicContact CD1-CG 4.43Å; I662-L668 HydrophobicContact CG2-CB 4.22Å; S664-L668 PolarHBondContact O-N 2.82Å; P665-L668 PolarHBondContact O-N 3.47Å; D666-L668 VanDerWaalsContact C-N 3.26Å; D666-L668 PolarHBondContact O-N 3.5Å; L668-Q671 PolarHBondContact O-NE2 3.28Å; L668-I674 HydrophobicContact CD1-CG2 4.17Å; L668-Y676 HydrophobicContact CD1-CD1 3.56Å; L668-Y676 HydrophobicContact CD1-CE1 4.23Å; L668-Y676 HydrophobicContact CD1-CG 4.12Å; L668-Y676 HydrophobicContact CD2-CD1 4.16Å; L668-Y676 HydrophobicContact CD2-CG 4.01Å; L668-Y676 HydrophobicContact CG-CD1 3.63Å; L668-Y676 HydrophobicContact CG-CE1 4Å; L668-Y676 HydrophobicContact CG-CG 4Å; L668-Y676 WeakPolarHBondContact O-CE1 3.17Å; L668-M699 HydrophobicContact CD2-CE 3.9Å; L668-A728 HydrophobicContact CD1-CB 4.34Å; L668-L730 HydrophobicContact CD2-CD2 4.49Å
669	A	89.8	Confident	84.9	Confident	15 Å²	15	56 Å²	56	12%	0.124	30%	0.301	C	S	.	.	H	α-helix	trans	-83	-31.2	-178.9	0	0	0	0	0	114	P665 D666 D667 T695 M699	P665-A669 WeakPolarHBondContact O-CB 3.11Å; P665-A669 PolarHBondContact O-N 2.89Å; P665-A669 VanDerWaalsContact O-N 3.11Å; D666-A669 PolarHBondContact O-N 3.27Å; D667-A669 VanDerWaalsContact C-N 3.29Å; D667-A669 PolarHBondContact O-N 3.09Å; A669-T695 HydrophobicContact CB-CG2 3.61Å; A669-M699 HydrophobicContact CB-CG 3.63Å; A669-M699 HydrophobicContact CB-SD 4.37Å
670	D	89.9	Confident	86.3	Confident	113 Å²	113	53.5 Å²	53.5	60%	0.604	29%	0.289	S	S	*	.	H	α-helix	trans	-78.3	-26.6	177.9	-76.6	12.3	0	0	0	112.1	D666 R698	D666-D670 PolarHBondContact O-N 2.91Å; D670-R698 IonicContact OD1-CZ 3.19Å; D670-R698 IonicContact OD1-NH1 3.76Å; D670-R698 PolarHBondContact OD1-NH1 3.27Å; D670-R698 IonicContact OD1-NH2 3.16Å; D670-R698 PolarHBondContact OD1-NH2 3.49Å
671	Q	87.8	Confident	86.9	Confident	43 Å²	43	52 Å²	52	20%	0.201	29%	0.289	C	S	.	.			trans	-92.4	165.2	175.6	72.9	77.9	50.6	0	0	113.5	D667 L668 I674	D667-Q671 WeakPolarHBondContact O-CG 3.15Å; D667-Q671 PolarHBondContact O-N 3.12Å; L668-Q671 PolarHBondContact O-NE2 3.28Å; Q671-I674 PolarHBondContact NE2-O 2.85Å
672	T	87.3	Confident	87.6	Confident	99 Å²	99	49.5 Å²	49.5	61%	0.607	28%	0.276	S	S	*	.			trans	-136.3	6	179.6	56.6	0	0	0	0	115.5	Y702	T672-Y702 HydrophobicContact CG2-CE2 4.2Å
673	N	88.5	Confident	88.1	Confident	111 Å²	111	49.9 Å²	49.9	59%	0.594	28%	0.279	S	S	*	.	S	Bend	trans	-81.9	-42.4	-176.1	-179.6	6.4	0	0	0	111.9	K726	N673-K726 PolarHBondContact OD1-NZ 2.94Å
674	I	90.6	Very high	88.6	Confident	13 Å²	13	43.1 Å²	43.1	7%	0.067	25%	0.249	C	C	.	.	S	Bend	trans	-88.7	124.2	168.7	-65.6	164.3	0	0	0	107.2	Y535 P661 I662 L668 Q671 K726 A728	Y535-I674 HydrophobicContact CE2-CD1 4.45Å; Y535-I674 HydrophobicContact CE2-CG2 4.08Å; P661-I674 HydrophobicContact CG-CD1 4.4Å; I662-I674 HydrophobicContact CD1-CD1 3.75Å; I662-I674 HydrophobicContact CG1-CD1 4.32Å; L668-I674 HydrophobicContact CD1-CG2 4.17Å; Q671-I674 PolarHBondContact NE2-O 2.85Å; I674-K726 HydrophobicContact CG1-CB 4.47Å; I674-A728 HydrophobicContact CG2-CB 4.04Å
675	Q	93.1	Very high	88.8	Confident	58 Å²	58	43 Å²	43	27%	0.271	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	154.8	172.4	-64.4	-179.9	15.5	0	0	110	V710 R721 K726 Y727 A728	Q675-V710 HydrophobicContact CB-CG1 4.49Å; Q675-R721 VanDerWaalsContact OE1-NH2 3.1Å; Q675-K726 PolarHBondContact N-O 2.83Å; Q675-Y727 HydrophobicContact CB-CD2 3.91Å; Q675-Y727 CarbonylContact O-C 3.58Å; Q675-Y727 VanDerWaalsContact O-CA 3.28Å; Q675-Y727 WeakPolarHBondContact O-CA 3.46Å; Q675-A728 PolarHBondContact O-N 3.3Å
676	Y	93.8	Very high	88.9	Confident	1 Å²	1	43.6 Å²	43.6	0%	0.004	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	151.8	175.1	54	-90.4	0	0	0	112.1	L668 M699 Y702 M703 V710 A728 L730	L668-Y676 HydrophobicContact CD1-CD1 3.56Å; L668-Y676 HydrophobicContact CD1-CE1 4.23Å; L668-Y676 HydrophobicContact CD1-CG 4.12Å; L668-Y676 HydrophobicContact CD2-CD1 4.16Å; L668-Y676 HydrophobicContact CD2-CG 4.01Å; L668-Y676 HydrophobicContact CG-CD1 3.63Å; L668-Y676 HydrophobicContact CG-CE1 4Å; L668-Y676 HydrophobicContact CG-CG 4Å; L668-Y676 WeakPolarHBondContact O-CE1 3.17Å; Y676-M699 HydrophobicContact CD2-CE 4.02Å; Y676-M699 HydrophobicContact CE2-CB 3.82Å; Y676-M699 HydrophobicContact CE2-CE 3.92Å; Y676-M699 HydrophobicContact CE2-CG 3.94Å; Y676-Y702 HydrophobicContact CD1-CD1 4.39Å; Y676-Y702 HydrophobicContact CD1-CE1 4.07Å; Y676-Y702 HydrophobicContact CD2-CD1 4.27Å; Y676-Y702 AromaticContact CE1-CD1 3.83Å; Y676-Y702 HydrophobicContact CE1-CD1 3.83Å; Y676-Y702 AromaticContact CE1-CE1 3.82Å; Y676-Y702 HydrophobicContact CE1-CE1 3.82Å; Y676-Y702 HydrophobicContact CE1-CG 4.27Å; Y676-Y702 AromaticContact CE2-CD1 3.68Å; Y676-Y702 HydrophobicContact CE2-CD1 3.68Å; Y676-Y702 HydrophobicContact CE2-CE1 4.28Å; Y676-Y702 HydrophobicContact CE2-CG 4.3Å; Y676-Y702 HydrophobicContact CG-CE1 4.44Å; Y676-Y702 AromaticContact CZ-CD1 3.45Å; Y676-Y702 VanDerWaalsContact CZ-CD1 3.45Å; Y676-Y702 AromaticContact CZ-CE1 3.95Å; Y676-Y702 AromaticContact CZ-CG 3.77Å; Y676-Y702 WeakPolarHBondContact OH-CB 3.47Å; Y676-M703 HydrophobicContact CD2-CG 3.87Å; Y676-M703 HydrophobicContact CD2-SD 4.08Å; Y676-M703 HydrophobicContact CE2-CG 3.9Å; Y676-M703 HydrophobicContact CE2-SD 4.44Å; Y676-V710 WeakPolarHBondContact O-CB 3.48Å; Y676-V710 VanDerWaalsContact O-CG2 3.31Å; Y676-V710 WeakPolarHBondContact O-CG2 3.13Å; Y676-A728 WeakPolarHBondContact CA-O 3.4Å; Y676-A728 WeakPolarHBondContact CB-O 3.31Å; Y676-L730 HydrophobicContact CD2-CD1 4.27Å
677	G	94.6	Very high	89.1	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.4	175.8	-173.5	0	0	0	0	0	113.6	Y727 A728 L730	G677-Y727 VanDerWaalsContact C-OH 3.28Å; G677-Y727 VanDerWaalsContact CA-OH 3.31Å; G677-Y727 WeakPolarHBondContact CA-OH 3.16Å; G677-Y727 PolarHBondContact O-OH 3.43Å; G677-A728 PolarHBondContact N-O 2.81Å; G677-L730 WeakPolarHBondContact O-CB 3.31Å; G677-L730 PolarHBondContact O-N 2.98Å
678	T	93.9	Very high	89.3	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	23%	0.227	C	C	.	.			trans	-125.1	174.5	-179.1	69.1	0	0	0	0	111.1	T684 F688 M703 F711 V712 L730	T678-T684 HydrophobicContact CG2-CG2 3.57Å; T678-F688 HydrophobicContact CG2-CD2 4.16Å; T678-F688 HydrophobicContact CG2-CE2 4.4Å; T678-M703 HydrophobicContact CG2-SD 4.28Å; T678-F711 WeakPolarHBondContact O-CA 3.36Å; T678-F711 WeakPolarHBondContact OG1-CD1 3.26Å; T678-F711 WeakPolarHBondContact OG1-CE1 3.3Å; T678-V712 PolarHBondContact O-N 3.45Å; T678-V712 VanDerWaalsContact O-N 3.13Å; T678-L730 HydrophobicContact CG2-CB 4.02Å; T678-L730 HydrophobicContact CG2-CD1 4.41Å
679	I	90.5	Very high	89.4	Confident	52 Å²	52	45.3 Å²	45.3	27%	0.267	25%	0.252	S	S	.	.	B	Isolated β-bridge	trans	-65.2	138.9	161.9	-56.9	174.9	0	0	0	108.9	V712 T715 F729	I679-V712 CarbonylContact C-O 3.26Å; I679-V712 WeakPolarHBondContact CA-O 3.28Å; I679-V712 HydrophobicContact CG1-CG2 4.35Å; I679-T715 WeakPolarHBondContact CD1-OG1 3.33Å; I679-F729 HydrophobicContact CD1-CZ 4.25Å; I679-F729 HydrophobicContact CG1-CE2 3.98Å; I679-F729 HydrophobicContact CG1-CZ 3.66Å
680	H	85.9	Confident	89.4	Confident	125 Å²	125	48.6 Å²	48.6	58%	0.579	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	128.6	175.9	-175.9	-84.5	0	0	0	111.2	G682 F711 V712	H680-G682 VanDerWaalsContact C-N 3.25Å; H680-G682 PolarHBondContact O-N 2.95Å; H680-F711 HydrophobicContact CB-CB 4.28Å; H680-V712 PolarHBondContact N-O 2.78Å
681	G	79.1	Confident	89.5	Confident	43 Å²	43	44 Å²	44	44%	0.443	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.5	1.7	-177.6	0	0	0	0	0	115.4	M685	G681-M685 PolarHBondContact N-SD 2.64Å
682	G	83.6	Confident	89.6	Confident	19 Å²	19	53.3 Å²	53.3	20%	0.196	28%	0.278	C	S	.	.	S	Bend	trans	-76.9	161.2	177.6	0	0	0	0	0	114.1	H680 T684 M685 T686	H680-G682 VanDerWaalsContact C-N 3.25Å; H680-G682 PolarHBondContact O-N 2.95Å; G682-T684 PolarHBondContact O-N 2.78Å; G682-M685 WeakPolarHBondContact O-CA 3.27Å; G682-M685 VanDerWaalsContact O-CB 3.29Å; G682-M685 WeakPolarHBondContact O-CB 2.97Å; G682-M685 PolarHBondContact O-N 3.18Å; G682-T686 PolarHBondContact O-N 2.78Å
683	S	86.4	Confident	89.9	Confident	15 Å²	15	54.6 Å²	54.6	11%	0.105	27%	0.273	C	S	.	.	H	α-helix	trans	-57.3	-31.4	176.5	54.2	0	0	0	0	113.4	T511 T686 F687	T511-S683 PolarHBondContact OG1-OG 3.23Å; S683-T686 PolarHBondContact O-OG1 2.87Å; S683-F687 VanDerWaalsContact O-CB 3.31Å; S683-F687 WeakPolarHBondContact O-CB 3.03Å; S683-F687 PolarHBondContact O-N 3.09Å
684	T	90.6	Very high	90.1	Very high	12 Å²	12	55.4 Å²	55.4	7%	0.074	27%	0.273	C	S	.	.	H	α-helix	trans	-66.2	-35.8	172.2	-52.9	0	0	0	0	112.3	I531 T678 G682 F688 L730	I531-T684 HydrophobicContact CD1-CG2 3.83Å; I531-T684 HydrophobicContact CG1-CG2 3.93Å; I531-T684 HydrophobicContact CG2-CG2 4Å; T678-T684 HydrophobicContact CG2-CG2 3.57Å; G682-T684 PolarHBondContact O-N 2.78Å; T684-F688 HydrophobicContact CG2-CD2 4.12Å; T684-F688 HydrophobicContact CG2-CE2 3.87Å; T684-F688 WeakPolarHBondContact O-CD2 3.38Å; T684-F688 PolarHBondContact O-N 3.01Å; T684-L730 HydrophobicContact CG2-CB 4.4Å
685	M	89.6	Confident	90.2	Very high	30 Å²	30	55.2 Å²	55.2	15%	0.148	27%	0.272	C	S	.	.	H	α-helix	trans	-68.8	-46.9	178.3	-171.7	-179.2	172.3	0	0	111.1	G681 G682 F687 F688 M689 W700 F711	G681-M685 PolarHBondContact N-SD 2.64Å; G682-M685 WeakPolarHBondContact O-CA 3.27Å; G682-M685 VanDerWaalsContact O-CB 3.29Å; G682-M685 WeakPolarHBondContact O-CB 2.97Å; G682-M685 PolarHBondContact O-N 3.18Å; M685-F687 VanDerWaalsContact C-N 3.33Å; M685-F687 PolarHBondContact O-N 3.48Å; M685-F688 PolarHBondContact O-N 3.27Å; M685-M689 WeakPolarHBondContact O-CB 3.3Å; M685-M689 PolarHBondContact O-N 3.44Å; M685-W700 HydrophobicContact CE-CH2 3.85Å; M685-W700 HydrophobicContact CE-CZ3 4.29Å; M685-W700 HydrophobicContact CG-CH2 4.09Å; M685-W700 HydrophobicContact CG-CZ3 3.8Å; M685-F711 HydrophobicContact CE-CD1 4.39Å; M685-F711 HydrophobicContact CE-CE1 4.1Å; M685-F711 HydrophobicContact CE-CE2 4.33Å; M685-F711 HydrophobicContact CE-CZ 4.07Å; M685-F711 HydrophobicContact CG-CD1 4.39Å; M685-F711 HydrophobicContact CG-CE1 3.9Å; M685-F711 HydrophobicContact SD-CD1 4.2Å; M685-F711 HydrophobicContact SD-CE1 4.17Å
686	T	88.2	Confident	90.2	Very high	40 Å²	40	53.7 Å²	53.7	25%	0.245	26%	0.264	C	S	.	.	H	α-helix	trans	-68.3	-32.6	177.9	59.5	0	0	0	0	112.1	G682 S683 M689 N690	G682-T686 PolarHBondContact O-N 2.78Å; S683-T686 PolarHBondContact O-OG1 2.87Å; T686-M689 PolarHBondContact O-N 2.96Å; T686-N690 WeakPolarHBondContact O-CB 3.19Å; T686-N690 PolarHBondContact O-N 3.16Å
687	F	91.5	Very high	90.3	Very high	53 Å²	53	57.1 Å²	57.1	23%	0.232	28%	0.28	C	S	.	.	H	α-helix	trans	-56.5	-50.5	170.6	171.6	-91.5	0	0	0	112.5	I531 S683 M685 S691 Y696 D754	I531-F687 HydrophobicContact CD1-CB 4.39Å; I531-F687 HydrophobicContact CD1-CD1 3.33Å; I531-F687 HydrophobicContact CD1-CD2 4.48Å; I531-F687 HydrophobicContact CD1-CE1 3.6Å; I531-F687 HydrophobicContact CD1-CG 3.83Å; I531-F687 HydrophobicContact CD1-CZ 4.27Å; S683-F687 VanDerWaalsContact O-CB 3.31Å; S683-F687 WeakPolarHBondContact O-CB 3.03Å; S683-F687 PolarHBondContact O-N 3.09Å; M685-F687 VanDerWaalsContact C-N 3.33Å; M685-F687 PolarHBondContact O-N 3.48Å; F687-S691 WeakPolarHBondContact O-CB 3.28Å; F687-S691 PolarHBondContact O-N 2.93Å; F687-S691 VanDerWaalsContact O-N 3.11Å; F687-Y696 AromaticContact CE1-CD2 3.88Å; F687-Y696 HydrophobicContact CE1-CD2 3.88Å; F687-Y696 HydrophobicContact CE1-CE2 4.02Å; F687-Y696 AromaticContact CZ-CD2 3.98Å; F687-Y696 HydrophobicContact CZ-CD2 3.98Å; F687-Y696 AromaticContact CZ-CE2 3.88Å; F687-Y696 HydrophobicContact CZ-CE2 3.88Å; F687-D754 HydrophobicContact CE2-CB 4.01Å; F687-D754 WeakPolarHBondContact CE2-OD2 3.48Å; F687-D754 HydrophobicContact CZ-CB 3.98Å
688	F	92.8	Very high	90.2	Very high	1 Å²	1	61.7 Å²	61.7	0%	0.004	30%	0.297	C	S	.	.	H	α-helix	trans	-67.2	-38.3	177.8	-78.7	-69.7	0	0	0	112	I531 T678 T684 M685 S691 Y696 M699 W700 M703 L730 L753	I531-F688 HydrophobicContact CD1-CE2 4.25Å; T678-F688 HydrophobicContact CG2-CD2 4.16Å; T678-F688 HydrophobicContact CG2-CE2 4.4Å; T684-F688 HydrophobicContact CG2-CD2 4.12Å; T684-F688 HydrophobicContact CG2-CE2 3.87Å; T684-F688 WeakPolarHBondContact O-CD2 3.38Å; T684-F688 PolarHBondContact O-N 3.01Å; M685-F688 PolarHBondContact O-N 3.27Å; F688-S691 PolarHBondContact O-N 3.44Å; F688-Y696 HydrophobicContact CD1-CG 4.28Å; F688-Y696 AromaticContact CE1-CD1 3.87Å; F688-Y696 HydrophobicContact CE1-CD1 3.87Å; F688-Y696 AromaticContact CE1-CG 3.91Å; F688-Y696 HydrophobicContact CE1-CG 3.91Å; F688-M699 HydrophobicContact CD1-CB 4.48Å; F688-M699 HydrophobicContact CE1-CB 4.48Å; F688-M699 HydrophobicContact CE1-CE 4.3Å; F688-M699 HydrophobicContact CE1-SD 4.07Å; F688-M699 HydrophobicContact CZ-CE 4.35Å; F688-W700 HydrophobicContact CB-CB 4.29Å; F688-W700 HydrophobicContact CB-CE3 3.97Å; F688-M703 HydrophobicContact CB-CE 3.88Å; F688-M703 HydrophobicContact CD1-CE 4.17Å; F688-M703 HydrophobicContact CD2-CE 3.89Å; F688-M703 HydrophobicContact CG-CE 3.71Å; F688-L730 HydrophobicContact CE2-CD1 3.87Å; F688-L730 HydrophobicContact CZ-CD1 4.05Å; F688-L753 HydrophobicContact CZ-CD2 4.09Å
689	M	90.4	Very high	90.3	Very high	109 Å²	109	61.7 Å²	61.7	54%	0.537	30%	0.297	S	S	.	.	H	α-helix	trans	-61.6	-42.3	177	179.9	164.9	156.2	0	0	113.7	M685 T686 W700	M685-M689 WeakPolarHBondContact O-CB 3.3Å; M685-M689 PolarHBondContact O-N 3.44Å; T686-M689 PolarHBondContact O-N 2.96Å; M689-W700 HydrophobicContact CB-CD2 4.05Å; M689-W700 HydrophobicContact CB-CE3 4.26Å; M689-W700 HydrophobicContact CB-CH2 3.78Å; M689-W700 HydrophobicContact CB-CZ2 3.52Å; M689-W700 HydrophobicContact CB-CZ3 4.14Å; M689-W700 HydrophobicContact CG-CH2 4.21Å; M689-W700 HydrophobicContact CG-CZ2 3.55Å; M689-W700 HydrophobicContact SD-CH2 4.12Å; M689-W700 HydrophobicContact SD-CZ2 3.68Å
690	N	89.9	Confident	90.5	Very high	83 Å²	83	60.5 Å²	60.5	44%	0.444	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	2.4	-177.5	-68.6	-18	0	0	0	113.2	E515 T686	E515-N690 PolarHBondContact OE1-ND2 3.42Å; T686-N690 WeakPolarHBondContact O-CB 3.19Å; T686-N690 PolarHBondContact O-N 3.16Å
691	S	90.9	Very high	90.9	Very high	17 Å²	17	59.2 Å²	59.2	12%	0.119	29%	0.287	C	S	.	.			trans	-67.5	143	-172.7	-160.6	0	0	0	0	112.8	F687 F688 Y693 Y696 Q697	F687-S691 WeakPolarHBondContact O-CB 3.28Å; F687-S691 PolarHBondContact O-N 2.93Å; F687-S691 VanDerWaalsContact O-N 3.11Å; F688-S691 PolarHBondContact O-N 3.44Å; S691-Y693 PolarHBondContact OG-N 3.33Å; S691-Y696 WeakPolarHBondContact OG-CB 3.25Å; S691-Q697 VanDerWaalsContact O-CG 3.28Å; S691-Q697 WeakPolarHBondContact O-CG 3.46Å; S691-Q697 PolarHBondContact O-NE2 2.8Å
692	R	91.1	Very high	91.6	Very high	239 Å²	239	58.6 Å²	58.6	90%	0.902	27%	0.271	S	S	*	.			trans	-102.5	-0	172.7	-63	-173.9	-178.9	-173.2	0.1	113.5
693	Y	92.6	Very high	92.2	Very high	126 Å²	126	57.8 Å²	57.8	49%	0.494	26%	0.263	S	S	.	.	S	Bend	trans	-87.9	131.4	179.9	-171.2	-115.3	0	0	0	111.1	S691 T695 Y696 Q697	S691-Y693 PolarHBondContact OG-N 3.33Å; Y693-T695 PolarHBondContact O-N 3.48Å; Y693-Y696 HydrophobicContact CD1-CD1 4.01Å; Y693-Y696 AromaticContact CD1-CD2 3.94Å; Y693-Y696 HydrophobicContact CD1-CD2 3.94Å; Y693-Y696 HydrophobicContact CD1-CE1 4.19Å; Y693-Y696 HydrophobicContact CD1-CE2 4.15Å; Y693-Y696 AromaticContact CD1-CG 3.87Å; Y693-Y696 HydrophobicContact CD1-CG 3.87Å; Y693-Y696 HydrophobicContact CG-CD2 4.33Å; Y693-Y696 PolarHBondContact O-N 3.3Å; Y693-Q697 PolarHBondContact O-N 3.01Å
694	Q	92.9	Very high	92.5	Very high	128 Å²	128	64.2 Å²	64.2	60%	0.598	29%	0.289	S	S	*	.	H	α-helix	trans	-58.5	-44.3	-167.4	-167.6	66.9	15	0	0	112.9	Q697 R698	Q694-Q697 PolarHBondContact O-N 3.44Å; Q694-R698 WeakPolarHBondContact O-CG 3.37Å; Q694-R698 PolarHBondContact O-N 2.78Å
695	T	92.7	Very high	92.6	Very high	8 Å²	8	68 Å²	68	5%	0.049	32%	0.315	C	S	.	.	H	α-helix	trans	-65.9	-41.7	176.6	-69.2	0	0	0	0	112.1	D666 A669 Y693 Q697 R698 M699	D666-T695 HydrophobicContact CB-CG2 4.48Å; D666-T695 WeakPolarHBondContact OD1-CB 3.21Å; D666-T695 VanDerWaalsContact OD1-CG2 3.24Å; D666-T695 WeakPolarHBondContact OD1-CG2 3.47Å; D666-T695 PolarHBondContact OD1-OG1 3.02Å; A669-T695 HydrophobicContact CB-CG2 3.61Å; Y693-T695 PolarHBondContact O-N 3.48Å; T695-Q697 VanDerWaalsContact C-N 3.29Å; T695-Q697 PolarHBondContact O-N 3.19Å; T695-R698 WeakPolarHBondContact O-CB 3.21Å; T695-R698 PolarHBondContact O-N 3.09Å; T695-R698 VanDerWaalsContact O-N 3.09Å; T695-R698 PolarHBondContact OG1-NH2 3.21Å; T695-M699 HydrophobicContact CG2-CG 4.42Å; T695-M699 HydrophobicContact CG2-SD 4.23Å; T695-M699 WeakPolarHBondContact O-CG 3.2Å; T695-M699 PolarHBondContact O-N 2.62Å
696	Y	94.4	Very high	92.7	Very high	27 Å²	27	70 Å²	70	11%	0.106	32%	0.323	C	S	.	.	H	α-helix	trans	-66.7	-31.5	178.4	-62.3	-12.4	0	0	0	112.2	P665 F687 F688 S691 Y693 M699 W700 L753	P665-Y696 HydrophobicContact CB-CE1 4.3Å; P665-Y696 HydrophobicContact CG-CE1 4.32Å; F687-Y696 AromaticContact CE1-CD2 3.88Å; F687-Y696 HydrophobicContact CE1-CD2 3.88Å; F687-Y696 HydrophobicContact CE1-CE2 4.02Å; F687-Y696 AromaticContact CZ-CD2 3.98Å; F687-Y696 HydrophobicContact CZ-CD2 3.98Å; F687-Y696 AromaticContact CZ-CE2 3.88Å; F687-Y696 HydrophobicContact CZ-CE2 3.88Å; F688-Y696 HydrophobicContact CD1-CG 4.28Å; F688-Y696 AromaticContact CE1-CD1 3.87Å; F688-Y696 HydrophobicContact CE1-CD1 3.87Å; F688-Y696 AromaticContact CE1-CG 3.91Å; F688-Y696 HydrophobicContact CE1-CG 3.91Å; S691-Y696 WeakPolarHBondContact OG-CB 3.25Å; Y693-Y696 HydrophobicContact CD1-CD1 4.01Å; Y693-Y696 AromaticContact CD1-CD2 3.94Å; Y693-Y696 HydrophobicContact CD1-CD2 3.94Å; Y693-Y696 HydrophobicContact CD1-CE1 4.19Å; Y693-Y696 HydrophobicContact CD1-CE2 4.15Å; Y693-Y696 AromaticContact CD1-CG 3.87Å; Y693-Y696 HydrophobicContact CD1-CG 3.87Å; Y693-Y696 HydrophobicContact CG-CD2 4.33Å; Y693-Y696 PolarHBondContact O-N 3.3Å; Y696-M699 HydrophobicContact CD1-SD 4.03Å; Y696-W700 WeakPolarHBondContact O-CB 3.27Å; Y696-W700 PolarHBondContact O-N 3.29Å; Y696-L753 HydrophobicContact CE1-CD2 4.08Å; Y696-L753 WeakPolarHBondContact OH-CB 3.27Å; Y696-L753 PolarHBondContact OH-O 3.14Å
697	Q	94.3	Very high	92.7	Very high	72 Å²	72	76.5 Å²	76.5	34%	0.336	35%	0.351	S	S	.	.	H	α-helix	trans	-68.5	-39.3	169.2	-69.9	-174.6	-6.7	0	0	112.8	S691 Y693 Q694 T695 W700 N701	S691-Q697 VanDerWaalsContact O-CG 3.28Å; S691-Q697 WeakPolarHBondContact O-CG 3.46Å; S691-Q697 PolarHBondContact O-NE2 2.8Å; Y693-Q697 PolarHBondContact O-N 3.01Å; Q694-Q697 PolarHBondContact O-N 3.44Å; T695-Q697 VanDerWaalsContact C-N 3.29Å; T695-Q697 PolarHBondContact O-N 3.19Å; Q697-W700 PolarHBondContact O-N 2.93Å; Q697-N701 WeakPolarHBondContact O-CB 3.42Å; Q697-N701 VanDerWaalsContact O-CG 3.26Å; Q697-N701 PolarHBondContact O-N 3.01Å; Q697-N701 PolarHBondContact O-ND2 3.24Å; Q697-N701 VanDerWaalsContact O-ND2 3.16Å
698	R	93.8	Very high	92.6	Very high	97 Å²	97	78.6 Å²	78.6	37%	0.366	37%	0.37	S	S	.	.	H	α-helix	trans	-61.6	-45.4	172.5	-67.8	-174.8	-58.7	143.5	3.2	111.1	D670 Q694 T695 N701 Y702	D670-R698 IonicContact OD1-CZ 3.19Å; D670-R698 IonicContact OD1-NH1 3.76Å; D670-R698 PolarHBondContact OD1-NH1 3.27Å; D670-R698 IonicContact OD1-NH2 3.16Å; D670-R698 PolarHBondContact OD1-NH2 3.49Å; Q694-R698 WeakPolarHBondContact O-CG 3.37Å; Q694-R698 PolarHBondContact O-N 2.78Å; T695-R698 WeakPolarHBondContact O-CB 3.21Å; T695-R698 PolarHBondContact O-N 3.09Å; T695-R698 VanDerWaalsContact O-N 3.09Å; T695-R698 PolarHBondContact OG1-NH2 3.21Å; R698-N701 PolarHBondContact O-N 3.12Å; R698-Y702 PolarHBondContact O-N 3.4Å
699	M	94.6	Very high	92.6	Very high	0 Å²	0	81.5 Å²	81.5	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-60.2	-45	174.4	-68.2	177.5	78.7	0	0	112.2	P665 L668 A669 Y676 F688 T695 Y696 Y702 M703 L730	P665-M699 HydrophobicContact CB-SD 4.42Å; L668-M699 HydrophobicContact CD2-CE 3.9Å; A669-M699 HydrophobicContact CB-CG 3.63Å; A669-M699 HydrophobicContact CB-SD 4.37Å; Y676-M699 HydrophobicContact CD2-CE 4.02Å; Y676-M699 HydrophobicContact CE2-CB 3.82Å; Y676-M699 HydrophobicContact CE2-CE 3.92Å; Y676-M699 HydrophobicContact CE2-CG 3.94Å; F688-M699 HydrophobicContact CD1-CB 4.48Å; F688-M699 HydrophobicContact CE1-CB 4.48Å; F688-M699 HydrophobicContact CE1-CE 4.3Å; F688-M699 HydrophobicContact CE1-SD 4.07Å; F688-M699 HydrophobicContact CZ-CE 4.35Å; T695-M699 HydrophobicContact CG2-CG 4.42Å; T695-M699 HydrophobicContact CG2-SD 4.23Å; T695-M699 WeakPolarHBondContact O-CG 3.2Å; T695-M699 PolarHBondContact O-N 2.62Å; Y696-M699 HydrophobicContact CD1-SD 4.03Å; M699-Y702 WeakPolarHBondContact O-CB 3.48Å; M699-Y702 PolarHBondContact O-N 3.18Å; M699-M703 HydrophobicContact CB-CE 4.35Å; M699-M703 VanDerWaalsContact O-CG 3.31Å; M699-M703 WeakPolarHBondContact O-CG 3.36Å; M699-M703 PolarHBondContact O-N 2.82Å; M699-L730 HydrophobicContact CE-CD1 3.96Å
700	W	95.1	Very high	92.8	Very high	26 Å²	26	76.3 Å²	76.3	10%	0.098	37%	0.365	C	S	.	.	H	α-helix	trans	-61.1	-45.8	175.8	177	-117.6	0	0	0	112.4	M685 F688 M689 Y696 Q697 Y702 M703 K704 F711	M685-W700 HydrophobicContact CE-CH2 3.85Å; M685-W700 HydrophobicContact CE-CZ3 4.29Å; M685-W700 HydrophobicContact CG-CH2 4.09Å; M685-W700 HydrophobicContact CG-CZ3 3.8Å; F688-W700 HydrophobicContact CB-CB 4.29Å; F688-W700 HydrophobicContact CB-CE3 3.97Å; M689-W700 HydrophobicContact CB-CD2 4.05Å; M689-W700 HydrophobicContact CB-CE3 4.26Å; M689-W700 HydrophobicContact CB-CH2 3.78Å; M689-W700 HydrophobicContact CB-CZ2 3.52Å; M689-W700 HydrophobicContact CB-CZ3 4.14Å; M689-W700 HydrophobicContact CG-CH2 4.21Å; M689-W700 HydrophobicContact CG-CZ2 3.55Å; M689-W700 HydrophobicContact SD-CH2 4.12Å; M689-W700 HydrophobicContact SD-CZ2 3.68Å; Y696-W700 WeakPolarHBondContact O-CB 3.27Å; Y696-W700 PolarHBondContact O-N 3.29Å; Q697-W700 PolarHBondContact O-N 2.93Å; W700-Y702 VanDerWaalsContact C-N 3.32Å; W700-Y702 PolarHBondContact O-N 2.88Å; W700-M703 HydrophobicContact CE3-CE 4.33Å; W700-M703 PolarHBondContact O-N 2.93Å; W700-K704 HydrophobicContact CZ2-CD 4.22Å; W700-K704 VanDerWaalsContact O-CB 3.27Å; W700-K704 WeakPolarHBondContact O-CB 3.37Å; W700-K704 PolarHBondContact O-N 2.65Å; W700-F711 HydrophobicContact CE3-CZ 4.43Å; W700-F711 HydrophobicContact CH2-CZ 4.26Å; W700-F711 HydrophobicContact CZ3-CE1 4.09Å; W700-F711 AromaticContact CZ3-CZ 3.7Å; W700-F711 HydrophobicContact CZ3-CZ 3.7Å
701	N	94.2	Very high	93	Very high	98 Å²	98	73.8 Å²	73.8	52%	0.524	35%	0.35	S	S	.	.	H	α-helix	trans	-64.6	-35.8	178.1	-71.7	-30.8	0	0	0	112.1	Q697 R698 S705	Q697-N701 WeakPolarHBondContact O-CB 3.42Å; Q697-N701 VanDerWaalsContact O-CG 3.26Å; Q697-N701 PolarHBondContact O-N 3.01Å; Q697-N701 PolarHBondContact O-ND2 3.24Å; Q697-N701 VanDerWaalsContact O-ND2 3.16Å; R698-N701 PolarHBondContact O-N 3.12Å; N701-S705 VanDerWaalsContact O-CB 3.26Å; N701-S705 WeakPolarHBondContact O-CB 3.21Å; N701-S705 PolarHBondContact O-N 2.73Å; N701-S705 VanDerWaalsContact O-N 3.11Å; N701-S705 PolarHBondContact O-OG 3.28Å
702	Y	94.4	Very high	93	Very high	30 Å²	30	73 Å²	73	12%	0.118	35%	0.345	C	S	.	.	H	α-helix	trans	-61.2	-55.4	168.4	176.3	-84.8	0	0	0	111	T672 Y676 R698 M699 W700 K704 S705 K706 V710	T672-Y702 HydrophobicContact CG2-CE2 4.2Å; Y676-Y702 HydrophobicContact CD1-CD1 4.39Å; Y676-Y702 HydrophobicContact CD1-CE1 4.07Å; Y676-Y702 HydrophobicContact CD2-CD1 4.27Å; Y676-Y702 AromaticContact CE1-CD1 3.83Å; Y676-Y702 HydrophobicContact CE1-CD1 3.83Å; Y676-Y702 AromaticContact CE1-CE1 3.82Å; Y676-Y702 HydrophobicContact CE1-CE1 3.82Å; Y676-Y702 HydrophobicContact CE1-CG 4.27Å; Y676-Y702 AromaticContact CE2-CD1 3.68Å; Y676-Y702 HydrophobicContact CE2-CD1 3.68Å; Y676-Y702 HydrophobicContact CE2-CE1 4.28Å; Y676-Y702 HydrophobicContact CE2-CG 4.3Å; Y676-Y702 HydrophobicContact CG-CE1 4.44Å; Y676-Y702 AromaticContact CZ-CD1 3.45Å; Y676-Y702 VanDerWaalsContact CZ-CD1 3.45Å; Y676-Y702 AromaticContact CZ-CE1 3.95Å; Y676-Y702 AromaticContact CZ-CG 3.77Å; Y676-Y702 WeakPolarHBondContact OH-CB 3.47Å; R698-Y702 PolarHBondContact O-N 3.4Å; M699-Y702 WeakPolarHBondContact O-CB 3.48Å; M699-Y702 PolarHBondContact O-N 3.18Å; W700-Y702 VanDerWaalsContact C-N 3.32Å; W700-Y702 PolarHBondContact O-N 2.88Å; Y702-K704 VanDerWaalsContact C-N 3.28Å; Y702-K704 PolarHBondContact O-N 3.21Å; Y702-S705 PolarHBondContact O-N 3.27Å; Y702-S705 VanDerWaalsContact O-N 3.15Å; Y702-S705 PolarHBondContact O-OG 3.32Å; Y702-K706 HydrophobicContact CE1-CB 4.47Å; Y702-K706 HydrophobicContact CE1-CG 4.41Å; Y702-K706 HydrophobicContact CE2-CD 4.38Å; Y702-K706 WeakPolarHBondContact O-CB 3.48Å; Y702-K706 PolarHBondContact O-N 3Å; Y702-V710 HydrophobicContact CE1-CG1 4.45Å
703	M	95.1	Very high	92.9	Very high	3 Å²	3	70.5 Å²	70.5	2%	0.015	34%	0.34	C	S	.	.	H	α-helix	trans	-60.6	-37	-176	-69.1	-174.5	-73.7	0	0	112.6	Y676 T678 F688 M699 W700 V710 F711 L730	Y676-M703 HydrophobicContact CD2-CG 3.87Å; Y676-M703 HydrophobicContact CD2-SD 4.08Å; Y676-M703 HydrophobicContact CE2-CG 3.9Å; Y676-M703 HydrophobicContact CE2-SD 4.44Å; T678-M703 HydrophobicContact CG2-SD 4.28Å; F688-M703 HydrophobicContact CB-CE 3.88Å; F688-M703 HydrophobicContact CD1-CE 4.17Å; F688-M703 HydrophobicContact CD2-CE 3.89Å; F688-M703 HydrophobicContact CG-CE 3.71Å; M699-M703 HydrophobicContact CB-CE 4.35Å; M699-M703 VanDerWaalsContact O-CG 3.31Å; M699-M703 WeakPolarHBondContact O-CG 3.36Å; M699-M703 PolarHBondContact O-N 2.82Å; W700-M703 HydrophobicContact CE3-CE 4.33Å; W700-M703 PolarHBondContact O-N 2.93Å; M703-V710 HydrophobicContact CB-CG2 3.79Å; M703-V710 HydrophobicContact CG-CG2 3.92Å; M703-F711 HydrophobicContact CB-CE1 4.23Å; M703-F711 HydrophobicContact CB-CE2 4.32Å; M703-F711 HydrophobicContact CB-CZ 3.71Å; M703-F711 WeakPolarHBondContact O-CE2 3.39Å; M703-F711 HydrophobicContact SD-CE1 4.46Å; M703-L730 HydrophobicContact SD-CD1 4.21Å
704	K	93.4	Very high	92.7	Very high	150 Å²	150	66.6 Å²	66.6	65%	0.652	33%	0.331	S	S	*	.	H	α-helix	trans	-74.7	-29.2	177.9	-176.3	174.1	177.2	178.8	0	114	W700 Y702	W700-K704 HydrophobicContact CZ2-CD 4.22Å; W700-K704 VanDerWaalsContact O-CB 3.27Å; W700-K704 WeakPolarHBondContact O-CB 3.37Å; W700-K704 PolarHBondContact O-N 2.65Å; Y702-K704 VanDerWaalsContact C-N 3.28Å; Y702-K704 PolarHBondContact O-N 3.21Å
705	S	93.4	Very high	92.5	Very high	91 Å²	91	61 Å²	61	64%	0.636	31%	0.306	S	S	*	.	H	α-helix	trans	-94.8	-18.8	-177.9	60.8	0	0	0	0	114.2	N701 Y702 Q707	N701-S705 VanDerWaalsContact O-CB 3.26Å; N701-S705 WeakPolarHBondContact O-CB 3.21Å; N701-S705 PolarHBondContact O-N 2.73Å; N701-S705 VanDerWaalsContact O-N 3.11Å; N701-S705 PolarHBondContact O-OG 3.28Å; Y702-S705 PolarHBondContact O-N 3.27Å; Y702-S705 VanDerWaalsContact O-N 3.15Å; Y702-S705 PolarHBondContact O-OG 3.32Å; S705-Q707 PolarHBondContact O-N 3.06Å
706	K	92	Very high	92.4	Very high	72 Å²	72	65.3 Å²	65.3	31%	0.313	33%	0.325	S	S	.	.			trans	-72.6	124.4	-175.2	-165.4	67.8	172.3	-177	0	112.2	Y702 V710	Y702-K706 HydrophobicContact CE1-CB 4.47Å; Y702-K706 HydrophobicContact CE1-CG 4.41Å; Y702-K706 HydrophobicContact CE2-CD 4.38Å; Y702-K706 WeakPolarHBondContact O-CB 3.48Å; Y702-K706 PolarHBondContact O-N 3Å; K706-V710 HydrophobicContact CB-CG1 4.06Å; K706-V710 HydrophobicContact CG-CG1 3.82Å
707	Q	88.4	Confident	92.3	Very high	177 Å²	177	68 Å²	68	83%	0.827	34%	0.339	S	S	*	.	S	Bend	trans	-114.1	144.6	161.8	-64.4	-159	13.2	0	0	110.8	S705	S705-Q707 PolarHBondContact O-N 3.06Å
708	P	88.3	Confident	92.2	Very high	97 Å²	97	64.5 Å²	64.5	63%	0.63	32%	0.323	S	S	*	.	S	Bend	cis	-61.8	160.5	-10.3	30.4	-37	0	0	0	111.9	V710	P708-V710 PolarHBondContact O-N 3.05Å
709	S	92.6	Very high	92.2	Very high	62 Å²	62	60.5 Å²	60.5	43%	0.434	31%	0.308	S	S	.	.			trans	-49.6	136	-174.8	178.3	0	0	0	0	112.3	F711 R721	S709-F711 PolarHBondContact OG-N 2.93Å; S709-F711 VanDerWaalsContact OG-N 3.08Å; S709-F711 PolarHBondContact OG-O 3.42Å; S709-R721 PolarHBondContact O-NH1 3.44Å; S709-R721 PolarHBondContact O-NH2 3.19Å
710	V	94.2	Very high	92.1	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	33%	0.326	C	S	.	.			trans	-87.8	-18.9	168.4	-65	0	0	0	0	112.8	Q675 Y676 Y702 M703 K706 P708 Y727	Q675-V710 HydrophobicContact CB-CG1 4.49Å; Y676-V710 WeakPolarHBondContact O-CB 3.48Å; Y676-V710 VanDerWaalsContact O-CG2 3.31Å; Y676-V710 WeakPolarHBondContact O-CG2 3.13Å; Y702-V710 HydrophobicContact CE1-CG1 4.45Å; M703-V710 HydrophobicContact CB-CG2 3.79Å; M703-V710 HydrophobicContact CG-CG2 3.92Å; K706-V710 HydrophobicContact CB-CG1 4.06Å; K706-V710 HydrophobicContact CG-CG1 3.82Å; P708-V710 PolarHBondContact O-N 3.05Å; V710-Y727 HydrophobicContact CB-CE2 4.42Å; V710-Y727 PolarHBondContact O-OH 2.6Å
711	F	94	Very high	92.1	Very high	29 Å²	29	63.7 Å²	63.7	13%	0.127	33%	0.33	C	S	.	.			trans	-72.9	142.5	174.6	-55.6	-73.8	0	0	0	111.4	T678 H680 M685 W700 M703 S709	T678-F711 WeakPolarHBondContact O-CA 3.36Å; T678-F711 WeakPolarHBondContact OG1-CD1 3.26Å; T678-F711 WeakPolarHBondContact OG1-CE1 3.3Å; H680-F711 HydrophobicContact CB-CB 4.28Å; M685-F711 HydrophobicContact CE-CD1 4.39Å; M685-F711 HydrophobicContact CE-CE1 4.1Å; M685-F711 HydrophobicContact CE-CE2 4.33Å; M685-F711 HydrophobicContact CE-CZ 4.07Å; M685-F711 HydrophobicContact CG-CD1 4.39Å; M685-F711 HydrophobicContact CG-CE1 3.9Å; M685-F711 HydrophobicContact SD-CD1 4.2Å; M685-F711 HydrophobicContact SD-CE1 4.17Å; W700-F711 HydrophobicContact CE3-CZ 4.43Å; W700-F711 HydrophobicContact CH2-CZ 4.26Å; W700-F711 HydrophobicContact CZ3-CE1 4.09Å; W700-F711 AromaticContact CZ3-CZ 3.7Å; W700-F711 HydrophobicContact CZ3-CZ 3.7Å; M703-F711 HydrophobicContact CB-CE1 4.23Å; M703-F711 HydrophobicContact CB-CE2 4.32Å; M703-F711 HydrophobicContact CB-CZ 3.71Å; M703-F711 WeakPolarHBondContact O-CE2 3.39Å; M703-F711 HydrophobicContact SD-CE1 4.46Å; S709-F711 PolarHBondContact OG-N 2.93Å; S709-F711 VanDerWaalsContact OG-N 3.08Å; S709-F711 PolarHBondContact OG-O 3.42Å
712	V	92.5	Very high	92	Very high	2 Å²	2	59 Å²	59	1%	0.012	31%	0.305	C	S	.	.	B	Isolated β-bridge	trans	-115.1	160.1	176.7	-65.4	0	0	0	0	111	T678 I679 H680 S714 E717 F729	T678-V712 PolarHBondContact O-N 3.45Å; T678-V712 VanDerWaalsContact O-N 3.13Å; I679-V712 CarbonylContact C-O 3.26Å; I679-V712 WeakPolarHBondContact CA-O 3.28Å; I679-V712 HydrophobicContact CG1-CG2 4.35Å; H680-V712 PolarHBondContact N-O 2.78Å; V712-S714 WeakPolarHBondContact CG2-O 3.49Å; V712-E717 HydrophobicContact CB-CB 4.26Å; V712-E717 HydrophobicContact CB-CG 4.07Å; V712-E717 HydrophobicContact CG1-CG 4.02Å; V712-F729 HydrophobicContact CG2-CD2 4.44Å; V712-F729 HydrophobicContact CG2-CE2 3.55Å; V712-F729 HydrophobicContact CG2-CZ 3.78Å
713	K	88.3	Confident	91.9	Very high	185 Å²	185	60.5 Å²	60.5	80%	0.804	32%	0.315	S	S	*	.	S	Bend	trans	-88.8	-32.4	-179.1	-62.5	-179.7	179.4	-179.6	0	113.4	E717	K713-E717 WeakPolarHBondContact CB-OE2 3.01Å; K713-E717 PolarHBondContact N-OE2 3.13Å
714	S	87.9	Confident	91.8	Very high	44 Å²	44	67.1 Å²	67.1	31%	0.308	35%	0.35	S	S	.	.	S	Bend	trans	-133.3	165.8	178.2	93.8	0	0	0	0	112.5	V712 E716 E717 G718	V712-S714 WeakPolarHBondContact CG2-O 3.49Å; S714-E716 VanDerWaalsContact C-N 3.32Å; S714-E716 WeakPolarHBondContact CB-OE2 3.47Å; S714-E716 PolarHBondContact OG-N 3.09Å; S714-E716 PolarHBondContact OG-OE2 3.49Å; S714-E717 PolarHBondContact O-N 3.16Å; S714-E717 PolarHBondContact OG-N 3.15Å; S714-G718 PolarHBondContact O-N 3.04Å
715	T	89.6	Confident	91.5	Very high	12 Å²	12	62.1 Å²	62.1	7%	0.074	33%	0.334	C	S	.	.	H	α-helix	trans	-66.1	-37.4	178.8	-47	0	0	0	0	111.3	I679 G718 I719 F729 M731 M735 Y739	I679-T715 WeakPolarHBondContact CD1-OG1 3.33Å; T715-G718 PolarHBondContact O-N 2.94Å; T715-I719 HydrophobicContact CG2-CD1 4.01Å; T715-I719 WeakPolarHBondContact O-CD1 3.12Å; T715-I719 VanDerWaalsContact O-CG1 3.29Å; T715-I719 WeakPolarHBondContact O-CG1 3.39Å; T715-I719 PolarHBondContact O-N 3.34Å; T715-F729 HydrophobicContact CG2-CE1 4.11Å; T715-F729 WeakPolarHBondContact O-CE1 3.42Å; T715-M731 HydrophobicContact CG2-CE 3.66Å; T715-M735 HydrophobicContact CG2-CE 4.26Å; T715-M735 HydrophobicContact CG2-CG 4.06Å; T715-Y739 HydrophobicContact CG2-CD2 4.28Å; T715-Y739 HydrophobicContact CG2-CE2 3.68Å
716	E	90.1	Very high	91.4	Very high	97 Å²	97	63.1 Å²	63.1	45%	0.453	33%	0.327	S	S	.	.	H	α-helix	trans	-67.4	-40.9	179.9	-55.1	65.4	-136.1	0	0	111	S714 G718 I719 A720 Y739	S714-E716 VanDerWaalsContact C-N 3.32Å; S714-E716 WeakPolarHBondContact CB-OE2 3.47Å; S714-E716 PolarHBondContact OG-N 3.09Å; S714-E716 PolarHBondContact OG-OE2 3.49Å; E716-G718 VanDerWaalsContact C-N 3.33Å; E716-G718 PolarHBondContact O-N 3.39Å; E716-I719 PolarHBondContact O-N 3.03Å; E716-A720 VanDerWaalsContact O-CB 3.31Å; E716-A720 WeakPolarHBondContact O-CB 3.29Å; E716-A720 PolarHBondContact O-N 3.07Å; E716-Y739 PolarHBondContact OE1-OH 2.86Å; E716-Y739 VanDerWaalsContact OE1-OH 3.1Å
717	E	92.4	Very high	91.4	Very high	83 Å²	83	59.7 Å²	59.7	39%	0.388	31%	0.312	S	S	.	.	H	α-helix	trans	-59.6	-44.3	171.9	-175.1	-170.8	173.3	0	0	110.9	V712 K713 S714 A720 R721	V712-E717 HydrophobicContact CB-CB 4.26Å; V712-E717 HydrophobicContact CB-CG 4.07Å; V712-E717 HydrophobicContact CG1-CG 4.02Å; K713-E717 WeakPolarHBondContact CB-OE2 3.01Å; K713-E717 PolarHBondContact N-OE2 3.13Å; S714-E717 PolarHBondContact O-N 3.16Å; S714-E717 PolarHBondContact OG-N 3.15Å; E717-A720 PolarHBondContact O-N 3.41Å; E717-R721 WeakPolarHBondContact O-CB 3.36Å; E717-R721 PolarHBondContact O-N 3.14Å
718	G	92.6	Very high	91.6	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-61.6	-46	176.2	0	0	0	0	0	113.2	S714 T715 E716 R721 V722	S714-G718 PolarHBondContact O-N 3.04Å; T715-G718 PolarHBondContact O-N 2.94Å; E716-G718 VanDerWaalsContact C-N 3.33Å; E716-G718 PolarHBondContact O-N 3.39Å; G718-R721 WeakPolarHBondContact O-CB 3.44Å; G718-R721 PolarHBondContact O-N 2.96Å; G718-V722 WeakPolarHBondContact O-CG2 3.26Å; G718-V722 PolarHBondContact O-N 3Å
719	I	93	Very high	92	Very high	12 Å²	12	46.6 Å²	46.6	6%	0.062	24%	0.243	C	C	.	.	H	α-helix	trans	-64.9	-44.1	177.8	-65.6	156.1	0	0	0	111.1	L534 T715 E716 R721 V722 L723 F729 M731 Y739 L746	L534-I719 HydrophobicContact CD2-CG1 3.88Å; T715-I719 HydrophobicContact CG2-CD1 4.01Å; T715-I719 WeakPolarHBondContact O-CD1 3.12Å; T715-I719 VanDerWaalsContact O-CG1 3.29Å; T715-I719 WeakPolarHBondContact O-CG1 3.39Å; T715-I719 PolarHBondContact O-N 3.34Å; E716-I719 PolarHBondContact O-N 3.03Å; I719-R721 PolarHBondContact O-N 3.41Å; I719-V722 PolarHBondContact O-N 3.37Å; I719-V722 VanDerWaalsContact O-N 3.17Å; I719-L723 HydrophobicContact CG2-CD1 4.12Å; I719-L723 PolarHBondContact O-N 2.88Å; I719-F729 HydrophobicContact CG1-CD1 4.5Å; I719-M731 HydrophobicContact CD1-CE 4.41Å; I719-M731 HydrophobicContact CG1-CE 4.19Å; I719-Y739 HydrophobicContact CD1-CD1 3.51Å; I719-Y739 HydrophobicContact CD1-CD2 3.44Å; I719-Y739 VanDerWaalsContact CD1-CD2 3.44Å; I719-Y739 HydrophobicContact CD1-CE1 3.69Å; I719-Y739 HydrophobicContact CD1-CE2 3.61Å; I719-Y739 HydrophobicContact CD1-CG 3.37Å; I719-Y739 HydrophobicContact CG1-CG 4.48Å; I719-L746 HydrophobicContact CG2-CD1 3.98Å
720	A	93.1	Very high	92.1	Very high	46 Å²	46	43.8 Å²	43.8	38%	0.38	22%	0.223	S	C	.	.	H	α-helix	trans	-60.2	-36.2	174.5	0	0	0	0	0	111.6	E716 E717 N724	E716-A720 VanDerWaalsContact O-CB 3.31Å; E716-A720 WeakPolarHBondContact O-CB 3.29Å; E716-A720 PolarHBondContact O-N 3.07Å; E717-A720 PolarHBondContact O-N 3.41Å; A720-N724 WeakPolarHBondContact O-CB 3.5Å; A720-N724 PolarHBondContact O-N 3.38Å; A720-N724 VanDerWaalsContact O-N 3.14Å; A720-N724 PolarHBondContact O-ND2 3.4Å
721	R	94.1	Very high	92	Very high	48 Å²	48	44.1 Å²	44.1	18%	0.181	22%	0.224	C	C	.	.	H	α-helix	trans	-68.8	-37.7	174.9	-167.8	176.9	178	158.2	-1.2	112.7	Q675 S709 E717 G718 I719 S725 Y727	Q675-R721 VanDerWaalsContact OE1-NH2 3.1Å; S709-R721 PolarHBondContact O-NH1 3.44Å; S709-R721 PolarHBondContact O-NH2 3.19Å; E717-R721 WeakPolarHBondContact O-CB 3.36Å; E717-R721 PolarHBondContact O-N 3.14Å; G718-R721 WeakPolarHBondContact O-CB 3.44Å; G718-R721 PolarHBondContact O-N 2.96Å; I719-R721 PolarHBondContact O-N 3.41Å; R721-S725 WeakPolarHBondContact O-CB 3.49Å; R721-S725 PolarHBondContact O-N 3.26Å; R721-S725 VanDerWaalsContact O-N 3.13Å; R721-S725 PolarHBondContact O-OG 3.34Å; R721-Y727 HydrophobicContact CB-CD1 3.83Å; R721-Y727 HydrophobicContact CB-CE1 4.17Å; R721-Y727 HydrophobicContact CB-CG 4.47Å; R721-Y727 HydrophobicContact CG-CD1 3.6Å; R721-Y727 HydrophobicContact CG-CD2 4.37Å; R721-Y727 HydrophobicContact CG-CE1 4.11Å; R721-Y727 HydrophobicContact CG-CG 3.75Å
722	V	93.4	Very high	91.9	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62.5	-45	173.6	173.4	0	0	0	0	111.4	Q536 G718 I719 S725 Y727 F729 L746	Q536-V722 HydrophobicContact CB-CG1 4.39Å; G718-V722 WeakPolarHBondContact O-CG2 3.26Å; G718-V722 PolarHBondContact O-N 3Å; I719-V722 PolarHBondContact O-N 3.37Å; I719-V722 VanDerWaalsContact O-N 3.17Å; V722-S725 VanDerWaalsContact O-O 3.08Å; V722-Y727 HydrophobicContact CG2-CD1 3.82Å; V722-Y727 HydrophobicContact CG2-CE1 4.33Å; V722-F729 HydrophobicContact CG2-CB 3.47Å; V722-F729 VanDerWaalsContact CG2-CB 3.47Å; V722-L746 HydrophobicContact CB-CD2 4.49Å; V722-L746 HydrophobicContact CG1-CD2 3.81Å
723	L	92	Very high	92	Very high	61 Å²	61	44.4 Å²	44.4	32%	0.319	23%	0.228	S	C	.	.	H	α-helix	trans	-72.6	-29	-176.7	-69.3	171.5	0	0	0	113.5	I719 N745 L746	I719-L723 HydrophobicContact CG2-CD1 4.12Å; I719-L723 PolarHBondContact O-N 2.88Å; L723-N745 HydrophobicContact CD2-CB 3.84Å; L723-L746 HydrophobicContact CD2-CD2 3.65Å; L723-L746 HydrophobicContact CD2-CG 4.19Å; L723-L746 HydrophobicContact CG-CD2 4.02Å
724	N	91.7	Very high	92.2	Very high	141 Å²	141	35.8 Å²	35.8	75%	0.754	19%	0.19	S	C	*	.	H	α-helix	trans	-100.6	-5.5	-176.3	-69.7	-72	0	0	0	114.4	A720	A720-N724 WeakPolarHBondContact O-CB 3.5Å; A720-N724 PolarHBondContact O-N 3.38Å; A720-N724 VanDerWaalsContact O-N 3.14Å; A720-N724 PolarHBondContact O-ND2 3.4Å
725	S	88.5	Confident	92.4	Very high	45 Å²	45	34.1 Å²	34.1	32%	0.315	18%	0.178	S	C	.	.	S	Bend	trans	-152.5	168.5	-174.2	77.6	0	0	0	0	113.6	R721 V722 Y727	R721-S725 WeakPolarHBondContact O-CB 3.49Å; R721-S725 PolarHBondContact O-N 3.26Å; R721-S725 VanDerWaalsContact O-N 3.13Å; R721-S725 PolarHBondContact O-OG 3.34Å; V722-S725 VanDerWaalsContact O-O 3.08Å; S725-Y727 PolarHBondContact O-N 3.27Å; S725-Y727 WeakPolarHBondContact OG-CB 3.46Å
726	K	89.9	Confident	92.5	Very high	112 Å²	112	33.5 Å²	33.5	49%	0.487	17%	0.174	S	C	.	.	S	Bend	trans	-75.3	70	171.2	-69.5	-177.4	173.9	-177.9	0	110.7	N673 I674 Q675	N673-K726 PolarHBondContact OD1-NZ 2.94Å; I674-K726 HydrophobicContact CG1-CB 4.47Å; Q675-K726 PolarHBondContact N-O 2.83Å
727	Y	93.1	Very high	92.5	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	131.4	-177.4	176.7	-104	0	0	0	110.3	Y535 Q675 G677 V710 R721 V722 S725 F729	Y535-Y727 WeakPolarHBondContact CD2-O 3.43Å; Q675-Y727 HydrophobicContact CB-CD2 3.91Å; Q675-Y727 CarbonylContact O-C 3.58Å; Q675-Y727 VanDerWaalsContact O-CA 3.28Å; Q675-Y727 WeakPolarHBondContact O-CA 3.46Å; G677-Y727 VanDerWaalsContact C-OH 3.28Å; G677-Y727 VanDerWaalsContact CA-OH 3.31Å; G677-Y727 WeakPolarHBondContact CA-OH 3.16Å; G677-Y727 PolarHBondContact O-OH 3.43Å; V710-Y727 HydrophobicContact CB-CE2 4.42Å; V710-Y727 PolarHBondContact O-OH 2.6Å; R721-Y727 HydrophobicContact CB-CD1 3.83Å; R721-Y727 HydrophobicContact CB-CE1 4.17Å; R721-Y727 HydrophobicContact CB-CG 4.47Å; R721-Y727 HydrophobicContact CG-CD1 3.6Å; R721-Y727 HydrophobicContact CG-CD2 4.37Å; R721-Y727 HydrophobicContact CG-CE1 4.11Å; R721-Y727 HydrophobicContact CG-CG 3.75Å; V722-Y727 HydrophobicContact CG2-CD1 3.82Å; V722-Y727 HydrophobicContact CG2-CE1 4.33Å; S725-Y727 PolarHBondContact O-N 3.27Å; S725-Y727 WeakPolarHBondContact OG-CB 3.46Å; Y727-F729 HydrophobicContact CD1-CB 4.3Å; Y727-F729 HydrophobicContact CE1-CB 3.7Å; Y727-F729 HydrophobicContact CE1-CD2 4.11Å; Y727-F729 HydrophobicContact CE1-CG 4.09Å
728	A	93.3	Very high	92.5	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	124.5	173.2	0	0	0	0	0	109.5	I533 L534 Y535 L668 I674 Q675 Y676 G677	I533-A728 HydrophobicContact CG2-CB 3.84Å; L534-A728 WeakPolarHBondContact O-CA 3.35Å; Y535-A728 HydrophobicContact CD2-CB 4Å; L668-A728 HydrophobicContact CD1-CB 4.34Å; I674-A728 HydrophobicContact CG2-CB 4.04Å; Q675-A728 PolarHBondContact O-N 3.3Å; Y676-A728 WeakPolarHBondContact CA-O 3.4Å; Y676-A728 WeakPolarHBondContact CB-O 3.31Å; G677-A728 PolarHBondContact N-O 2.81Å
729	F	95.1	Very high	92.3	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	122.5	-173.5	-174.1	-152.7	0	0	0	110.3	L534 I679 V712 T715 I719 V722 Y727 M731	L534-F729 HydrophobicContact CB-CB 4.38Å; L534-F729 WeakPolarHBondContact CB-O 3.38Å; L534-F729 HydrophobicContact CD2-CD1 4.28Å; L534-F729 PolarHBondContact N-O 3.32Å; L534-F729 PolarHBondContact O-N 2.82Å; I679-F729 HydrophobicContact CD1-CZ 4.25Å; I679-F729 HydrophobicContact CG1-CE2 3.98Å; I679-F729 HydrophobicContact CG1-CZ 3.66Å; V712-F729 HydrophobicContact CG2-CD2 4.44Å; V712-F729 HydrophobicContact CG2-CE2 3.55Å; V712-F729 HydrophobicContact CG2-CZ 3.78Å; T715-F729 HydrophobicContact CG2-CE1 4.11Å; T715-F729 WeakPolarHBondContact O-CE1 3.42Å; I719-F729 HydrophobicContact CG1-CD1 4.5Å; V722-F729 HydrophobicContact CG2-CB 3.47Å; V722-F729 VanDerWaalsContact CG2-CB 3.47Å; Y727-F729 HydrophobicContact CD1-CB 4.3Å; Y727-F729 HydrophobicContact CE1-CB 3.7Å; Y727-F729 HydrophobicContact CE1-CD2 4.11Å; Y727-F729 HydrophobicContact CE1-CG 4.09Å; F729-M731 HydrophobicContact CD1-CE 3.49Å; F729-M731 VanDerWaalsContact CD1-CE 3.49Å; F729-M731 HydrophobicContact CE1-CE 3.4Å; F729-M731 HydrophobicContact CZ-CE 4.42Å; F729-M731 PolarHBondContact O-N 3.24Å
730	L	94.9	Very high	92.1	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.01	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	105.7	-177	-62	169.3	0	0	0	109.1	I531 I533 L668 Y676 G677 T678 T684 F688 M699 M703	I531-L730 HydrophobicContact CG2-CB 4.37Å; I533-L730 HydrophobicContact CB-CD2 4.41Å; I533-L730 HydrophobicContact CG1-CD2 3.87Å; I533-L730 HydrophobicContact CG2-CD2 4.34Å; L668-L730 HydrophobicContact CD2-CD2 4.49Å; Y676-L730 HydrophobicContact CD2-CD1 4.27Å; G677-L730 WeakPolarHBondContact O-CB 3.31Å; G677-L730 PolarHBondContact O-N 2.98Å; T678-L730 HydrophobicContact CG2-CB 4.02Å; T678-L730 HydrophobicContact CG2-CD1 4.41Å; T684-L730 HydrophobicContact CG2-CB 4.4Å; F688-L730 HydrophobicContact CE2-CD1 3.87Å; F688-L730 HydrophobicContact CZ-CD1 4.05Å; M699-L730 HydrophobicContact CE-CD1 3.96Å; M703-L730 HydrophobicContact SD-CD1 4.21Å
731	M	92.5	Very high	91.8	Very high	8 Å²	8	33.2 Å²	33.2	4%	0.039	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	161.9	-174.6	62.6	155.4	58.1	0	0	112.4	S532 L534 T715 I719 F729 M735 N736	S532-M731 PolarHBondContact N-O 2.73Å; S532-M731 PolarHBondContact O-N 3.01Å; S532-M731 VanDerWaalsContact O-N 3.1Å; S532-M731 VanDerWaalsContact O-O 3.13Å; S532-M731 PolarHBondContact OG-O 2.92Å; L534-M731 HydrophobicContact CB-CG 4.16Å; L534-M731 HydrophobicContact CB-SD 4.32Å; L534-M731 HydrophobicContact CD2-CE 3.7Å; L534-M731 HydrophobicContact CD2-SD 4.08Å; T715-M731 HydrophobicContact CG2-CE 3.66Å; I719-M731 HydrophobicContact CD1-CE 4.41Å; I719-M731 HydrophobicContact CG1-CE 4.19Å; F729-M731 HydrophobicContact CD1-CE 3.49Å; F729-M731 VanDerWaalsContact CD1-CE 3.49Å; F729-M731 HydrophobicContact CE1-CE 3.4Å; F729-M731 HydrophobicContact CZ-CE 4.42Å; F729-M731 PolarHBondContact O-N 3.24Å; M731-M735 HydrophobicContact CE-CG 4.44Å; M731-M735 HydrophobicContact SD-CB 4.03Å; M731-M735 HydrophobicContact SD-CG 4.19Å; M731-N736 HydrophobicContact CG-CB 4.23Å; M731-N736 VanDerWaalsContact SD-CA 3.55Å; M731-N736 HydrophobicContact SD-CB 3.84Å; M731-N736 PolarHBondContact SD-N 3.01Å; M731-N736 VanDerWaalsContact SD-N 3.38Å
732	E	92.9	Very high	91.5	Very high	21 Å²	21	34.1 Å²	34.1	10%	0.098	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	140	177.2	-72	176.5	147.8	0	0	111.6	T511 L529 G530 T734 M735 N736 Y758	T511-E732 VanDerWaalsContact CG2-OE1 3.23Å; T511-E732 WeakPolarHBondContact CG2-OE1 3.46Å; T511-E732 PolarHBondContact OG1-OE1 3.3Å; L529-E732 HydrophobicContact CD1-CB 4.02Å; L529-E732 HydrophobicContact CD1-CG 3.8Å; G530-E732 CarbonylContact O-C 3.59Å; G530-E732 WeakPolarHBondContact O-CA 3.39Å; E732-T734 VanDerWaalsContact C-N 3.32Å; E732-T734 PolarHBondContact O-N 3.31Å; E732-M735 WeakPolarHBondContact O-CA 3.36Å; E732-M735 VanDerWaalsContact O-CB 3.3Å; E732-M735 WeakPolarHBondContact O-CB 3.3Å; E732-M735 PolarHBondContact O-N 2.83Å; E732-N736 PolarHBondContact O-N 2.89Å; E732-N736 VanDerWaalsContact O-N 3.12Å; E732-Y758 VanDerWaalsContact OE2-CE1 3.26Å; E732-Y758 WeakPolarHBondContact OE2-CE1 3.48Å; E732-Y758 PolarHBondContact OE2-OH 3.26Å
733	S	93.8	Very high	91.1	Very high	16 Å²	16	37.3 Å²	37.3	11%	0.112	19%	0.187	C	C	.	.	H	α-helix	trans	-64.4	-31.8	-165.9	57.9	0	0	0	0	114.7	G530 M735 N736 E737	G530-S733 PolarHBondContact N-OG 3.45Å; G530-S733 WeakPolarHBondContact O-CB 3.27Å; G530-S733 PolarHBondContact O-N 3.31Å; G530-S733 PolarHBondContact O-OG 3.28Å; S733-M735 VanDerWaalsContact C-N 3.28Å; S733-M735 PolarHBondContact O-N 3.48Å; S733-N736 WeakPolarHBondContact O-CB 3.48Å; S733-N736 PolarHBondContact O-N 2.57Å; S733-E737 WeakPolarHBondContact O-CB 3.31Å; S733-E737 PolarHBondContact O-N 3.14Å
734	T	92.4	Very high	90.8	Very high	3 Å²	3	37.8 Å²	37.8	2%	0.018	20%	0.195	C	C	.	.	H	α-helix	trans	-61.9	-37.4	172.8	45.3	0	0	0	0	111.6	Y437 M527 L529 E732 Y738 Y758 W793	Y437-T734 VanDerWaalsContact OH-CB 3.28Å; Y437-T734 WeakPolarHBondContact OH-CB 3.49Å; Y437-T734 PolarHBondContact OH-OG1 3.34Å; M527-T734 HydrophobicContact CG-CG2 4.12Å; M527-T734 HydrophobicContact SD-CG2 3.51Å; M527-T734 VanDerWaalsContact SD-CG2 3.51Å; L529-T734 HydrophobicContact CB-CG2 3.97Å; L529-T734 HydrophobicContact CD2-CG2 4.41Å; E732-T734 VanDerWaalsContact C-N 3.32Å; E732-T734 PolarHBondContact O-N 3.31Å; T734-Y738 PolarHBondContact O-N 2.83Å; T734-Y758 PolarHBondContact OG1-OH 2.81Å; T734-W793 PolarHBondContact O-NE1 2.89Å
735	M	91.3	Very high	90.7	Very high	9 Å²	9	36.2 Å²	36.2	4%	0.044	19%	0.187	C	C	.	.	H	α-helix	trans	-74	-38	176.8	-159.1	56.4	134.2	0	0	111.5	E434 N435 Y437 T715 M731 E732 S733 Y738 Y739	E434-M735 HydrophobicContact CG-CE 3.42Å; E434-M735 VanDerWaalsContact CG-CE 3.42Å; N435-M735 WeakPolarHBondContact O-CE 3.46Å; N435-M735 VanDerWaalsContact O-SD 3.41Å; Y437-M735 HydrophobicContact CE2-SD 4.33Å; T715-M735 HydrophobicContact CG2-CE 4.26Å; T715-M735 HydrophobicContact CG2-CG 4.06Å; M731-M735 HydrophobicContact CE-CG 4.44Å; M731-M735 HydrophobicContact SD-CB 4.03Å; M731-M735 HydrophobicContact SD-CG 4.19Å; E732-M735 WeakPolarHBondContact O-CA 3.36Å; E732-M735 VanDerWaalsContact O-CB 3.3Å; E732-M735 WeakPolarHBondContact O-CB 3.3Å; E732-M735 PolarHBondContact O-N 2.83Å; S733-M735 VanDerWaalsContact C-N 3.28Å; S733-M735 PolarHBondContact O-N 3.48Å; M735-Y738 PolarHBondContact O-N 3.02Å; M735-Y739 HydrophobicContact CE-CE2 3.95Å; M735-Y739 HydrophobicContact CG-CD2 3.89Å; M735-Y739 HydrophobicContact CG-CE2 3.83Å; M735-Y739 WeakPolarHBondContact O-CD2 3Å; M735-Y739 PolarHBondContact O-N 3.26Å; M735-Y739 HydrophobicContact SD-CD2 3.99Å; M735-Y739 HydrophobicContact SD-CE2 3.56Å; M735-Y739 VanDerWaalsContact SD-CE2 3.56Å
736	N	91.7	Very high	90.7	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-61.7	-47.5	173.2	-170.5	-25.6	0	0	0	111.2	S532 I533 L534 M731 E732 S733 Y738 Y739 R740	S532-N736 WeakPolarHBondContact OG-CB 3.48Å; S532-N736 PolarHBondContact OG-ND2 3.12Å; I533-N736 PolarHBondContact O-ND2 3.49Å; L534-N736 VanDerWaalsContact CD1-OD1 3.24Å; L534-N736 WeakPolarHBondContact CD1-OD1 3.29Å; M731-N736 HydrophobicContact CG-CB 4.23Å; M731-N736 VanDerWaalsContact SD-CA 3.55Å; M731-N736 HydrophobicContact SD-CB 3.84Å; M731-N736 PolarHBondContact SD-N 3.01Å; M731-N736 VanDerWaalsContact SD-N 3.38Å; E732-N736 PolarHBondContact O-N 2.89Å; E732-N736 VanDerWaalsContact O-N 3.12Å; S733-N736 WeakPolarHBondContact O-CB 3.48Å; S733-N736 PolarHBondContact O-N 2.57Å; N736-Y738 VanDerWaalsContact C-N 3.33Å; N736-Y738 PolarHBondContact O-N 2.9Å; N736-Y739 PolarHBondContact O-N 3.04Å; N736-R740 WeakPolarHBondContact O-CB 3.24Å; N736-R740 PolarHBondContact O-N 2.89Å
737	E	91.1	Very high	90.6	Very high	66 Å²	66	31 Å²	31	31%	0.308	16%	0.162	S	C	.	.	H	α-helix	trans	-55.9	-44.3	175.9	-170.8	-177.9	170	0	0	112.3	S733 S741 K789	S733-E737 WeakPolarHBondContact O-CB 3.31Å; S733-E737 PolarHBondContact O-N 3.14Å; E737-S741 PolarHBondContact O-N 2.96Å; E737-K789 IonicContact OE1-NZ 2.74Å; E737-K789 PolarHBondContact OE1-NZ 2.84Å; E737-K789 WeakPolarHBondContact OE2-CE 3.36Å; E737-K789 IonicContact OE2-NZ 2.7Å; E737-K789 PolarHBondContact OE2-NZ 2.93Å
738	Y	91.1	Very high	90.4	Very high	30 Å²	30	34 Å²	34	12%	0.118	18%	0.176	C	C	.	.	H	α-helix	trans	-65.1	-55	177	-179.6	-113	0	0	0	112.5	N435 P436 T734 M735 N736 R740 S741 L742	N435-Y738 HydrophobicContact CB-CE1 3.88Å; P436-Y738 HydrophobicContact CB-CD2 4.14Å; P436-Y738 HydrophobicContact CB-CE2 3.69Å; P436-Y738 HydrophobicContact CG-CD2 3.74Å; P436-Y738 HydrophobicContact CG-CE2 3.84Å; P436-Y738 HydrophobicContact CG-CG 4.14Å; T734-Y738 PolarHBondContact O-N 2.83Å; M735-Y738 PolarHBondContact O-N 3.02Å; N736-Y738 VanDerWaalsContact C-N 3.33Å; N736-Y738 PolarHBondContact O-N 2.9Å; Y738-R740 VanDerWaalsContact C-N 3.25Å; Y738-R740 PolarHBondContact O-N 2.91Å; Y738-S741 PolarHBondContact O-N 3.37Å; Y738-S741 VanDerWaalsContact O-N 3.07Å; Y738-S741 PolarHBondContact O-OG 3.19Å; Y738-S741 VanDerWaalsContact O-OG 3.08Å; Y738-L742 HydrophobicContact CD1-CD1 4.19Å; Y738-L742 HydrophobicContact CE1-CD1 3.66Å; Y738-L742 HydrophobicContact CE2-CD1 4.32Å; Y738-L742 PolarHBondContact O-N 3.02Å
739	Y	90.3	Very high	90.1	Very high	17 Å²	17	34.3 Å²	34.3	7%	0.067	18%	0.178	C	C	.	.	H	α-helix	trans	-68.1	-25.1	-176.9	-77.9	-66.1	0	0	0	113.5	T715 E716 I719 M735 N736 L742 N743	T715-Y739 HydrophobicContact CG2-CD2 4.28Å; T715-Y739 HydrophobicContact CG2-CE2 3.68Å; E716-Y739 PolarHBondContact OE1-OH 2.86Å; E716-Y739 VanDerWaalsContact OE1-OH 3.1Å; I719-Y739 HydrophobicContact CD1-CD1 3.51Å; I719-Y739 HydrophobicContact CD1-CD2 3.44Å; I719-Y739 VanDerWaalsContact CD1-CD2 3.44Å; I719-Y739 HydrophobicContact CD1-CE1 3.69Å; I719-Y739 HydrophobicContact CD1-CE2 3.61Å; I719-Y739 HydrophobicContact CD1-CG 3.37Å; I719-Y739 HydrophobicContact CG1-CG 4.48Å; M735-Y739 HydrophobicContact CE-CE2 3.95Å; M735-Y739 HydrophobicContact CG-CD2 3.89Å; M735-Y739 HydrophobicContact CG-CE2 3.83Å; M735-Y739 WeakPolarHBondContact O-CD2 3Å; M735-Y739 PolarHBondContact O-N 3.26Å; M735-Y739 HydrophobicContact SD-CD2 3.99Å; M735-Y739 HydrophobicContact SD-CE2 3.56Å; M735-Y739 VanDerWaalsContact SD-CE2 3.56Å; N736-Y739 PolarHBondContact O-N 3.04Å; Y739-L742 HydrophobicContact CD1-CD1 4.13Å; Y739-L742 HydrophobicContact CE1-CD1 4.4Å; Y739-N743 PolarHBondContact O-N 3.11Å
740	R	88.9	Confident	89.6	Confident	91 Å²	91	36 Å²	36	34%	0.343	20%	0.195	S	C	.	.	H	α-helix	trans	-70.9	-35	170	-177.8	176.3	61.9	152.2	-2.5	113.1	N736 Y738 L742 C798	N736-R740 WeakPolarHBondContact O-CB 3.24Å; N736-R740 PolarHBondContact O-N 2.89Å; Y738-R740 VanDerWaalsContact C-N 3.25Å; Y738-R740 PolarHBondContact O-N 2.91Å; R740-L742 VanDerWaalsContact C-N 3.27Å; R740-L742 PolarHBondContact O-N 3.31Å; R740-C798 PolarHBondContact O-SG 3.28Å
741	S	85.9	Confident	89.2	Confident	27 Å²	27	38.4 Å²	38.4	19%	0.189	22%	0.22	C	C	.	.	H	α-helix	trans	-72.3	-23.8	176.2	83.2	0	0	0	0	112.6	E737 Y738 W793 G796 Q797 C798	E737-S741 PolarHBondContact O-N 2.96Å; Y738-S741 PolarHBondContact O-N 3.37Å; Y738-S741 VanDerWaalsContact O-N 3.07Å; Y738-S741 PolarHBondContact O-OG 3.19Å; Y738-S741 VanDerWaalsContact O-OG 3.08Å; S741-W793 PolarHBondContact OG-O 3.46Å; S741-G796 CarbonylContact O-C 3.57Å; S741-G796 WeakPolarHBondContact O-CA 3.42Å; S741-Q797 PolarHBondContact O-N 3.31Å; S741-Q797 VanDerWaalsContact O-N 3.12Å; S741-C798 PolarHBondContact O-N 2.83Å; S741-C798 PolarHBondContact O-SG 3.27Å
742	L	87.3	Confident	89.1	Confident	67 Å²	67	42.1 Å²	42.1	35%	0.351	24%	0.24	S	C	.	.	H	α-helix	trans	-81.1	-44.5	170.4	-63.2	177.7	0	0	0	113.6	Y738 Y739 R740	Y738-L742 HydrophobicContact CD1-CD1 4.19Å; Y738-L742 HydrophobicContact CE1-CD1 3.66Å; Y738-L742 HydrophobicContact CE2-CD1 4.32Å; Y738-L742 PolarHBondContact O-N 3.02Å; Y739-L742 HydrophobicContact CD1-CD1 4.13Å; Y739-L742 HydrophobicContact CE1-CD1 4.4Å; R740-L742 VanDerWaalsContact C-N 3.27Å; R740-L742 PolarHBondContact O-N 3.31Å
743	N	86.1	Confident	89	Confident	67 Å²	67	42 Å²	42	36%	0.358	24%	0.24	S	C	.	.			trans	-122.7	101.5	-171.8	-73.3	-67.8	0	0	0	112.5	Y739 N745 L746	Y739-N743 PolarHBondContact O-N 3.11Å; N743-N745 PolarHBondContact O-N 2.9Å; N743-L746 HydrophobicContact CB-CD1 3.81Å; N743-L746 HydrophobicContact CB-CG 4.13Å; N743-L746 WeakPolarHBondContact O-CB 3.42Å; N743-L746 PolarHBondContact O-N 2.93Å
744	C	85.8	Confident	88.8	Confident	72 Å²	72	42.4 Å²	42.4	49%	0.486	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-0.3	-174.6	-27.4	0	0	0	0	114.4	L746 C798	C744-L746 VanDerWaalsContact C-N 3.29Å; C744-C798 WeakPolarHBondContact CA-SG 3.43Å; C744-C798 HydrophobicContact CB-CB 3.95Å; C744-C798 WeakPolarHBondContact CB-SG 3.17Å; C744-C798 PolarHBondContact N-SG 3.13Å; C744-C798 WeakPolarHBondContact SG-CA 3.27Å; C744-C798 WeakPolarHBondContact SG-CB 3.49Å; C744-C798 CovalentContact SG-SG 2.04Å; C744-C798 PolarHBondContact SG-SG 3.44Å
745	N	87.7	Confident	88.7	Confident	108 Å²	108	48.6 Å²	48.6	58%	0.578	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	1.5	170.5	-67.1	-19.8	0	0	0	112.5	Q536 V537 L723 N743	Q536-N745 CarbonylContact C-O 3.48Å; Q536-N745 WeakPolarHBondContact CA-O 3.3Å; V537-N745 PolarHBondContact N-O 2.91Å; L723-N745 HydrophobicContact CD2-CB 3.84Å; N743-N745 PolarHBondContact O-N 2.9Å
746	L	89.3	Confident	88.7	Confident	4 Å²	4	49.8 Å²	49.8	2%	0.021	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	147.9	179.4	-62.1	174.3	0	0	0	111.9	L534 I719 V722 L723 N743 C744	L534-L746 HydrophobicContact CD1-CB 4Å; L534-L746 HydrophobicContact CD1-CD1 4.22Å; L534-L746 HydrophobicContact CD1-CD2 4.43Å; L534-L746 HydrophobicContact CD1-CG 4.45Å; L534-L746 HydrophobicContact CD2-CD1 4.32Å; L534-L746 HydrophobicContact CD2-CD2 4.44Å; L534-L746 HydrophobicContact CG-CD2 4.37Å; I719-L746 HydrophobicContact CG2-CD1 3.98Å; V722-L746 HydrophobicContact CB-CD2 4.49Å; V722-L746 HydrophobicContact CG1-CD2 3.81Å; L723-L746 HydrophobicContact CD2-CD2 3.65Å; L723-L746 HydrophobicContact CD2-CG 4.19Å; L723-L746 HydrophobicContact CG-CD2 4.02Å; N743-L746 HydrophobicContact CB-CD1 3.81Å; N743-L746 HydrophobicContact CB-CG 4.13Å; N743-L746 WeakPolarHBondContact O-CB 3.42Å; N743-L746 PolarHBondContact O-N 2.93Å; C744-L746 VanDerWaalsContact C-N 3.29Å
747	T	87.6	Confident	88.8	Confident	43 Å²	43	50.1 Å²	50.1	26%	0.264	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	145.9	178.5	16.4	0	0	0	0	110.2	Y535 Q536 V537	Y535-T747 PolarHBondContact N-O 2.98Å; Y535-T747 PolarHBondContact O-N 2.86Å; Y535-T747 VanDerWaalsContact O-O 3.07Å; Y535-T747 PolarHBondContact O-OG1 2.86Å; Q536-T747 PolarHBondContact O-OG1 2.84Å; V537-T747 WeakPolarHBondContact CA-OG1 3.48Å; V537-T747 HydrophobicContact CG2-CG2 3.74Å; V537-T747 PolarHBondContact N-OG1 2.93Å
748	Q	89.1	Confident	89	Confident	62 Å²	62	47 Å²	47	29%	0.29	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	133.8	161.1	179.5	179.9	-33.8	0	0	108.8	I533 G750	I533-Q748 CarbonylContact O-C 3.56Å; I533-Q748 WeakPolarHBondContact O-CA 3.19Å; Q748-G750 PolarHBondContact NE2-O 3.4Å
749	I	86.3	Confident	89.2	Confident	7 Å²	7	45.6 Å²	45.6	4%	0.036	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	135.3	166.8	-68.6	-178	0	0	0	109	I533 Y535 V660 I662	I533-I749 HydrophobicContact CB-CB 4.14Å; I533-I749 WeakPolarHBondContact CB-O 3.32Å; I533-I749 HydrophobicContact CD1-CG2 4.47Å; I533-I749 HydrophobicContact CG2-CB 4.33Å; I533-I749 PolarHBondContact O-N 2.89Å; Y535-I749 HydrophobicContact CD1-CD1 3.66Å; Y535-I749 HydrophobicContact CG-CD1 3.86Å; V660-I749 HydrophobicContact CG1-CD1 3.97Å; V660-I749 HydrophobicContact CG1-CG1 3.96Å; I662-I749 HydrophobicContact CB-CD1 4.46Å; I662-I749 HydrophobicContact CB-CG2 4.16Å; I662-I749 HydrophobicContact CG2-CG2 3.82Å; I662-I749 VanDerWaalsContact O-CG2 3.24Å; I662-I749 WeakPolarHBondContact O-CG2 3.18Å
750	G	84.8	Confident	89.5	Confident	35 Å²	35	44.9 Å²	44.9	36%	0.361	27%	0.265	S	S	.	.	S	Bend	trans	68.7	-175.9	175.6	0	0	0	0	0	115	Q748	Q748-G750 PolarHBondContact NE2-O 3.4Å
751	G	87.5	Confident	89.9	Confident	53 Å²	53	40.6 Å²	40.6	55%	0.546	25%	0.248	S	C	.	.	S	Bend	trans	-80.5	-164.4	173.2	0	0	0	0	0	113.4
752	L	90.7	Very high	90.2	Very high	86 Å²	86	39.3 Å²	39.3	45%	0.45	24%	0.239	S	C	.	.			trans	-78.9	131.6	169.6	-55	178.4	0	0	0	109.5	I531 D754	I531-L752 WeakPolarHBondContact O-CA 3.31Å; L752-D754 VanDerWaalsContact C-N 3.33Å; L752-D754 WeakPolarHBondContact CB-O 3.48Å
753	L	90.4	Very high	90.3	Very high	19 Å²	19	36.5 Å²	36.5	10%	0.099	23%	0.225	C	C	.	.	S	Bend	trans	-78.1	-19.3	-179.8	-77.4	76.4	0	0	0	112.9	I531 I533 P665 F688 Y696	I531-L753 HydrophobicContact CB-CB 4.19Å; I531-L753 HydrophobicContact CG2-CD2 4.43Å; I531-L753 WeakPolarHBondContact O-CD1 3.31Å; I531-L753 PolarHBondContact O-N 2.76Å; I533-L753 HydrophobicContact CD1-CD1 4.37Å; I533-L753 HydrophobicContact CG1-CD1 3.91Å; P665-L753 HydrophobicContact CB-CD2 3.93Å; P665-L753 HydrophobicContact CB-CG 4.28Å; P665-L753 HydrophobicContact CG-CD2 4.48Å; P665-L753 HydrophobicContact CG-CG 4.36Å; F688-L753 HydrophobicContact CZ-CD2 4.09Å; Y696-L753 HydrophobicContact CE1-CD2 4.08Å; Y696-L753 WeakPolarHBondContact OH-CB 3.27Å; Y696-L753 PolarHBondContact OH-O 3.14Å
754	D	90	Very high	90	Very high	25 Å²	25	36.3 Å²	36.3	13%	0.134	22%	0.224	C	C	.	.	S	Bend	trans	-150.8	176.6	175.9	64.4	4.2	0	0	0	110.8	G530 I531 F687 L752 K756	G530-D754 WeakPolarHBondContact CA-O 3.13Å; G530-D754 VanDerWaalsContact CA-OD1 3.28Å; G530-D754 WeakPolarHBondContact CA-OD1 3.46Å; I531-D754 VanDerWaalsContact CD1-OD2 3.29Å; I531-D754 WeakPolarHBondContact CD1-OD2 3.33Å; I531-D754 PolarHBondContact N-OD1 2.98Å; F687-D754 HydrophobicContact CE2-CB 4.01Å; F687-D754 WeakPolarHBondContact CE2-OD2 3.48Å; F687-D754 HydrophobicContact CZ-CB 3.98Å; L752-D754 VanDerWaalsContact C-N 3.33Å; L752-D754 WeakPolarHBondContact CB-O 3.48Å; D754-K756 IonicContact OD1-NZ 2.75Å; D754-K756 WeakPolarHBondContact OD2-CD 3.32Å; D754-K756 WeakPolarHBondContact OD2-CE 3.47Å; D754-K756 IonicContact OD2-NZ 2.74Å; D754-K756 PolarHBondContact OD2-NZ 3.44Å
755	T	90.1	Very high	89.4	Confident	133 Å²	133	35.3 Å²	35.3	82%	0.816	23%	0.226	S	C	*	.			trans	-119.8	127.1	170.7	47.5	0	0	0	0	110
756	K	91.1	Very high	89	Confident	34 Å²	34	30.4 Å²	30.4	15%	0.148	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	172.5	-173	-85.6	167.4	168.5	152.3	0	110	T511 T528 L529 D754	T511-K756 HydrophobicContact CG2-CB 4.34Å; T511-K756 HydrophobicContact CG2-CD 3.74Å; T511-K756 HydrophobicContact CG2-CG 4.1Å; T528-K756 WeakPolarHBondContact CA-O 3.5Å; L529-K756 HydrophobicContact CD1-CB 3.69Å; L529-K756 HydrophobicContact CD1-CD 4.4Å; L529-K756 HydrophobicContact CG-CB 4.14Å; L529-K756 PolarHBondContact N-O 3.04Å; L529-K756 CarbonylContact O-C 3.56Å; L529-K756 PolarHBondContact O-N 2.99Å; L529-K756 VanDerWaalsContact O-O 3.08Å; D754-K756 IonicContact OD1-NZ 2.75Å; D754-K756 WeakPolarHBondContact OD2-CD 3.32Å; D754-K756 WeakPolarHBondContact OD2-CE 3.47Å; D754-K756 IonicContact OD2-NZ 2.74Å; D754-K756 PolarHBondContact OD2-NZ 3.44Å
757	G	93.6	Very high	88.2	Confident	7 Å²	7	33.2 Å²	33.2	7%	0.072	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	161.5	164.1	0	0	0	0	0	112.3	I512 M527	I512-G757 PolarHBondContact N-O 3.47Å; I512-G757 VanDerWaalsContact N-O 3.16Å; M527-G757 CarbonylContact O-C 3.52Å; M527-G757 WeakPolarHBondContact O-CA 3.46Å
758	Y	95.6	Very high	87.9	Confident	1 Å²	1	32.9 Å²	32.9	0%	0.004	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	135	165	-59.4	-38	0	0	0	109.7	Y437 G509 F510 P525 F526 M527 L529 E732 T734	Y437-Y758 HydrophobicContact CE1-CD2 4.24Å; Y437-Y758 AromaticContact CE1-CE2 3.73Å; Y437-Y758 HydrophobicContact CE1-CE2 3.73Å; Y437-Y758 AromaticContact CZ-CE2 3.74Å; Y437-Y758 WeakPolarHBondContact OH-CE2 3.44Å; G509-Y758 WeakPolarHBondContact O-CD1 3.36Å; G509-Y758 WeakPolarHBondContact O-CE1 3.29Å; F510-Y758 WeakPolarHBondContact O-CA 3.11Å; P525-Y758 CarbonylContact C-O 3.58Å; P525-Y758 WeakPolarHBondContact CA-O 3.28Å; P525-Y758 WeakPolarHBondContact CB-O 3.36Å; F526-Y758 WeakPolarHBondContact CD1-O 3.42Å; F526-Y758 HydrophobicContact CE2-CD2 4.36Å; F526-Y758 HydrophobicContact CZ-CD2 4.33Å; F526-Y758 HydrophobicContact CZ-CG 4.29Å; F526-Y758 PolarHBondContact N-O 3.43Å; M527-Y758 HydrophobicContact CB-CD2 4.42Å; M527-Y758 PolarHBondContact O-N 3.03Å; M527-Y758 HydrophobicContact SD-CD2 4.48Å; L529-Y758 HydrophobicContact CD1-CE1 4.43Å; L529-Y758 HydrophobicContact CD2-CD1 3.61Å; L529-Y758 HydrophobicContact CD2-CD2 3.56Å; L529-Y758 HydrophobicContact CD2-CE1 3.52Å; L529-Y758 HydrophobicContact CD2-CE2 3.45Å; L529-Y758 VanDerWaalsContact CD2-CE2 3.45Å; L529-Y758 HydrophobicContact CD2-CG 3.63Å; L529-Y758 VanDerWaalsContact CD2-CZ 3.44Å; E732-Y758 VanDerWaalsContact OE2-CE1 3.26Å; E732-Y758 WeakPolarHBondContact OE2-CE1 3.48Å; E732-Y758 PolarHBondContact OE2-OH 3.26Å; T734-Y758 PolarHBondContact OG1-OH 2.81Å
759	G	95.6	Very high	87.8	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	21%	0.214	C	C	.	.			trans	-128.4	163.2	173.9	0	0	0	0	0	110.9	F510	F510-G759 PolarHBondContact O-N 2.95Å
760	I	97.1	Very high	87.7	Confident	2 Å²	2	37.9 Å²	37.9	1%	0.01	24%	0.235	C	C	.	.			trans	-78.6	125.3	169.5	-63.2	-172.7	0	0	0	107.7	M460 L464 L505 V507 F522 S523 F526 M762 I772 I776	M460-I760 HydrophobicContact CE-CD1 4.26Å; M460-I760 HydrophobicContact CE-CG1 4.48Å; L464-I760 HydrophobicContact CD1-CD1 3.67Å; L505-I760 HydrophobicContact CB-CG2 4.34Å; L505-I760 HydrophobicContact CD2-CG2 4.04Å; V507-I760 HydrophobicContact CG1-CG1 4.49Å; V507-I760 HydrophobicContact CG2-CB 4.47Å; V507-I760 HydrophobicContact CG2-CD1 3.99Å; V507-I760 HydrophobicContact CG2-CG1 4Å; V507-I760 HydrophobicContact CG2-CG2 3.9Å; F522-I760 WeakPolarHBondContact CA-O 3.13Å; S523-I760 PolarHBondContact N-O 3.39Å; S523-I760 PolarHBondContact OG-N 2.74Å; F526-I760 HydrophobicContact CD1-CG1 4.4Å; I760-M762 WeakPolarHBondContact O-CE 3.26Å; I760-I772 HydrophobicContact CB-CG2 4.36Å; I760-I772 HydrophobicContact CD1-CG2 3.91Å; I760-I772 HydrophobicContact CG2-CG2 4.4Å; I760-I776 HydrophobicContact CD1-CD1 3.98Å; I760-I776 HydrophobicContact CG1-CD1 4.1Å
761	G	95.8	Very high	87.8	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	144.7	176.4	0	0	0	0	0	111.8	L505 A506	L505-G761 CarbonylContact C-O 3.53Å; L505-G761 WeakPolarHBondContact CA-O 3.41Å; A506-G761 PolarHBondContact N-O 2.87Å; A506-G761 PolarHBondContact O-N 2.97Å
762	M	93.6	Very high	88	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	155.9	-178.1	-81.1	161.8	-73.5	0	0	111.4	L505 I520 D521 I760 R769 I772	L505-M762 HydrophobicContact CD2-CG 3.48Å; L505-M762 VanDerWaalsContact CD2-CG 3.48Å; L505-M762 HydrophobicContact CD2-SD 4.09Å; I520-M762 WeakPolarHBondContact CA-O 3.41Å; I520-M762 VanDerWaalsContact CB-O 3.28Å; I520-M762 WeakPolarHBondContact CB-O 3.46Å; D521-M762 HydrophobicContact CB-CB 4.21Å; D521-M762 PolarHBondContact N-O 2.87Å; D521-M762 PolarHBondContact O-N 3.33Å; I760-M762 WeakPolarHBondContact O-CE 3.26Å; M762-R769 HydrophobicContact CE-CB 4.13Å; M762-R769 HydrophobicContact CE-CG 3.98Å; M762-R769 WeakPolarHBondContact SD-CA 3.42Å; M762-R769 HydrophobicContact SD-CB 4.02Å; M762-I772 HydrophobicContact SD-CD1 4.08Å
763	P	88.2	Confident	88.1	Confident	8 Å²	8	32.2 Å²	32.2	5%	0.052	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.7	142.4	168.1	-20.8	33.7	0	0	0	110.3	L498 R501 D504 G765 S766	L498-P763 HydrophobicContact CD2-CG 4.36Å; R501-P763 HydrophobicContact CG-CB 4.5Å; D504-P763 WeakPolarHBondContact O-CD 3.4Å; P763-G765 PolarHBondContact O-N 3.37Å; P763-S766 VanDerWaalsContact O-CB 3.26Å; P763-S766 WeakPolarHBondContact O-CB 3.42Å; P763-S766 PolarHBondContact O-N 3.32Å; P763-S766 VanDerWaalsContact O-N 3.11Å
764	L	81.3	Confident	88.1	Confident	63 Å²	63	36.8 Å²	36.8	33%	0.33	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	131.3	-179.7	-163.3	73.4	0	0	0	110.7	K220 D521	K220-L764 HydrophobicContact CD-CD2 4.01Å; D521-L764 WeakPolarHBondContact OD2-CA 3.39Å
765	G	72.9	Confident	88.2	Confident	51 Å²	51	35.6 Å²	35.6	53%	0.526	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.9	24.6	-172.7	0	0	0	0	0	114.3	D521 P763	D521-G765 PolarHBondContact OD2-N 2.95Å; P763-G765 PolarHBondContact O-N 3.37Å
766	S	77.8	Confident	88.5	Confident	6 Å²	6	29.3 Å²	29.3	4%	0.042	16%	0.163	C	C	.	.			trans	-70.7	123.4	178.7	-176.6	0	0	0	0	112.4	P763 Y768 R769	P763-S766 VanDerWaalsContact O-CB 3.26Å; P763-S766 WeakPolarHBondContact O-CB 3.42Å; P763-S766 PolarHBondContact O-N 3.32Å; P763-S766 VanDerWaalsContact O-N 3.11Å; S766-Y768 PolarHBondContact O-N 2.87Å; S766-Y768 PolarHBondContact OG-N 3.08Å; S766-R769 WeakPolarHBondContact O-CB 3.47Å; S766-R769 PolarHBondContact O-N 2.84Å
767	P	73.1	Confident	88.7	Confident	63 Å²	63	31.3 Å²	31.3	41%	0.409	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-25.1	174.5	28.6	-35.1	0	0	0	111.8	F249 R769	F249-P767 HydrophobicContact CE1-CG 4.4Å; F249-P767 HydrophobicContact CZ-CG 4.44Å; P767-R769 PolarHBondContact O-N 2.67Å
768	Y	82.2	Confident	88.7	Confident	35 Å²	35	35.4 Å²	35.4	14%	0.137	19%	0.192	C	C	.	.	H	α-helix	trans	-69.7	-12.4	179.6	-50.7	-37.8	0	0	0	113.4	L422 K425 L427 S766 D770 I772	L422-Y768 HydrophobicContact CD1-CD1 3.44Å; L422-Y768 VanDerWaalsContact CD1-CD1 3.44Å; L422-Y768 HydrophobicContact CD1-CE1 4.2Å; L422-Y768 HydrophobicContact CD1-CG 3.94Å; L422-Y768 HydrophobicContact CG-CD1 4.25Å; K425-Y768 HydrophobicContact CD-CE1 4.26Å; L427-Y768 HydrophobicContact CD2-CD2 4.31Å; L427-Y768 HydrophobicContact CD2-CE2 3.75Å; S766-Y768 PolarHBondContact O-N 2.87Å; S766-Y768 PolarHBondContact OG-N 3.08Å; Y768-D770 VanDerWaalsContact C-N 3.29Å; Y768-D770 PolarHBondContact O-N 3.4Å; Y768-I772 VanDerWaalsContact O-CB 3.26Å; Y768-I772 WeakPolarHBondContact O-CB 3.41Å; Y768-I772 VanDerWaalsContact O-CG1 3.26Å; Y768-I772 WeakPolarHBondContact O-CG1 3.25Å; Y768-I772 PolarHBondContact O-N 3.48Å
769	R	85.7	Confident	88.7	Confident	83 Å²	83	35.4 Å²	35.4	31%	0.313	19%	0.192	S	C	.	.	H	α-helix	trans	-56.6	-41.8	-176.5	-174.3	-163.8	66.2	-145.3	-10.9	112.9	D521 M762 S766 P767 T773	D521-R769 IonicContact OD1-NH1 2.71Å; M762-R769 HydrophobicContact CE-CB 4.13Å; M762-R769 HydrophobicContact CE-CG 3.98Å; M762-R769 WeakPolarHBondContact SD-CA 3.42Å; M762-R769 HydrophobicContact SD-CB 4.02Å; S766-R769 WeakPolarHBondContact O-CB 3.47Å; S766-R769 PolarHBondContact O-N 2.84Å; P767-R769 PolarHBondContact O-N 2.67Å; R769-T773 WeakPolarHBondContact O-CB 3.24Å; R769-T773 PolarHBondContact O-N 3.13Å; R769-T773 PolarHBondContact O-OG1 3.18Å
770	D	85.1	Confident	88.6	Confident	92 Å²	92	40.7 Å²	40.7	49%	0.492	22%	0.217	S	C	.	.	H	α-helix	trans	-86.5	-36.7	-170.9	-62.1	-22.7	0	0	0	111.3	Y768 T773 L774	Y768-D770 VanDerWaalsContact C-N 3.29Å; Y768-D770 PolarHBondContact O-N 3.4Å; D770-T773 PolarHBondContact O-N 3.35Å; D770-L774 WeakPolarHBondContact O-CB 3.48Å; D770-L774 PolarHBondContact O-N 3.32Å
771	E	86.9	Confident	88.4	Confident	33 Å²	33	49 Å²	49	15%	0.154	26%	0.256	C	S	.	.	H	α-helix	trans	-59.7	-48.7	167.3	-74.8	-171.6	-117.8	0	0	112.3	E420 T421 L422 T773 L774 G775	E420-E771 VanDerWaalsContact C-CD 3.45Å; T421-E771 VanDerWaalsContact CA-OE2 3.23Å; T421-E771 WeakPolarHBondContact CA-OE2 3.05Å; T421-E771 PolarHBondContact N-OE1 3.23Å; T421-E771 PolarHBondContact N-OE2 2.86Å; L422-E771 HydrophobicContact CD1-CB 3.92Å; L422-E771 VanDerWaalsContact CD1-CD 3.42Å; L422-E771 HydrophobicContact CD1-CG 4.28Å; L422-E771 WeakPolarHBondContact CD1-OE2 3.37Å; L422-E771 PolarHBondContact N-OE2 2.99Å; E771-T773 VanDerWaalsContact C-N 3.32Å; E771-T773 PolarHBondContact O-N 2.97Å; E771-L774 PolarHBondContact O-N 3.29Å; E771-G775 PolarHBondContact O-N 3.38Å
772	I	91.6	Very high	88.4	Confident	2 Å²	2	52.1 Å²	52.1	1%	0.01	28%	0.277	C	S	.	.	H	α-helix	trans	-67.1	-36.2	179.7	-69.5	173.3	0	0	0	111	L422 L468 L505 I760 M762 Y768 G775 I776	L422-I772 HydrophobicContact CD2-CD1 4.19Å; L422-I772 HydrophobicContact CD2-CG1 4.04Å; L468-I772 HydrophobicContact CD1-CG1 4.21Å; L505-I772 HydrophobicContact CD1-CD1 3.89Å; L505-I772 HydrophobicContact CD2-CD1 3.38Å; L505-I772 HydrophobicContact CG-CD1 4.3Å; I760-I772 HydrophobicContact CB-CG2 4.36Å; I760-I772 HydrophobicContact CD1-CG2 3.91Å; I760-I772 HydrophobicContact CG2-CG2 4.4Å; M762-I772 HydrophobicContact SD-CD1 4.08Å; Y768-I772 VanDerWaalsContact O-CB 3.26Å; Y768-I772 WeakPolarHBondContact O-CB 3.41Å; Y768-I772 VanDerWaalsContact O-CG1 3.26Å; Y768-I772 WeakPolarHBondContact O-CG1 3.25Å; Y768-I772 PolarHBondContact O-N 3.48Å; I772-G775 PolarHBondContact O-N 2.9Å; I772-I776 HydrophobicContact CG2-CD1 4.05Å; I772-I776 WeakPolarHBondContact O-CG1 3.45Å; I772-I776 PolarHBondContact O-N 3.47Å
773	T	92.5	Very high	88.4	Confident	19 Å²	19	56.2 Å²	56.2	12%	0.117	30%	0.3	C	S	.	.	H	α-helix	trans	-61.5	-45	171.9	-72.6	0	0	0	0	111.6	K524 R769 D770 E771 I776 L777	K524-T773 HydrophobicContact CB-CG2 4.14Å; K524-T773 HydrophobicContact CG-CG2 3.49Å; K524-T773 VanDerWaalsContact CG-CG2 3.49Å; K524-T773 PolarHBondContact N-OG1 3.41Å; R769-T773 WeakPolarHBondContact O-CB 3.24Å; R769-T773 PolarHBondContact O-N 3.13Å; R769-T773 PolarHBondContact O-OG1 3.18Å; D770-T773 PolarHBondContact O-N 3.35Å; E771-T773 VanDerWaalsContact C-N 3.32Å; E771-T773 PolarHBondContact O-N 2.97Å; T773-I776 PolarHBondContact O-N 3.43Å; T773-L777 HydrophobicContact CG2-CD1 4Å; T773-L777 VanDerWaalsContact O-CG 3.31Å; T773-L777 WeakPolarHBondContact O-CG 3.22Å; T773-L777 PolarHBondContact O-N 3.49Å
774	L	91.1	Very high	88.7	Confident	116 Å²	116	60.1 Å²	60.1	61%	0.607	31%	0.313	S	S	*	.	H	α-helix	trans	-63.2	-42.5	176.5	-175.5	61.4	0	0	0	111.5	D770 E771 I776 L777 Q778	D770-L774 WeakPolarHBondContact O-CB 3.48Å; D770-L774 PolarHBondContact O-N 3.32Å; E771-L774 PolarHBondContact O-N 3.29Å; L774-I776 PolarHBondContact O-N 2.57Å; L774-L777 PolarHBondContact O-N 2.87Å; L774-Q778 WeakPolarHBondContact O-CB 3.48Å; L774-Q778 PolarHBondContact O-N 2.69Å
775	G	92.5	Very high	89.3	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-60.6	-41.7	174.8	0	0	0	0	0	113.6	E771 I772 Q778 L779	E771-G775 PolarHBondContact O-N 3.38Å; I772-G775 PolarHBondContact O-N 2.9Å; G775-Q778 PolarHBondContact O-N 2.61Å; G775-L779 WeakPolarHBondContact O-CG 3.38Å; G775-L779 PolarHBondContact O-N 3.49Å
776	I	95.3	Very high	90.2	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-64.8	-44.2	174.6	-71.6	167	0	0	0	111	L464 S523 F526 I760 I772 T773 L774 Q778 L779 Q780 L785	L464-I776 HydrophobicContact CD1-CG1 4.41Å; L464-I776 HydrophobicContact CD2-CG1 4.26Å; S523-I776 WeakPolarHBondContact OG-CD1 3.36Å; F526-I776 HydrophobicContact CB-CG2 3.85Å; I760-I776 HydrophobicContact CD1-CD1 3.98Å; I760-I776 HydrophobicContact CG1-CD1 4.1Å; I772-I776 HydrophobicContact CG2-CD1 4.05Å; I772-I776 WeakPolarHBondContact O-CG1 3.45Å; I772-I776 PolarHBondContact O-N 3.47Å; T773-I776 PolarHBondContact O-N 3.43Å; L774-I776 PolarHBondContact O-N 2.57Å; I776-Q778 VanDerWaalsContact C-N 3.32Å; I776-Q778 PolarHBondContact O-N 2.79Å; I776-L779 PolarHBondContact O-N 3.31Å; I776-Q780 WeakPolarHBondContact O-CB 3.48Å; I776-Q780 PolarHBondContact O-N 2.84Å; I776-L785 HydrophobicContact CG2-CD1 4.47Å
777	L	94.4	Very high	91	Very high	77 Å²	77	62 Å²	62	40%	0.403	31%	0.308	S	S	.	.	H	α-helix	trans	-62	-40.1	176.7	-70.2	169.4	0	0	0	111.4	T773 L774 Q780 E781	T773-L777 HydrophobicContact CG2-CD1 4Å; T773-L777 VanDerWaalsContact O-CG 3.31Å; T773-L777 WeakPolarHBondContact O-CG 3.22Å; T773-L777 PolarHBondContact O-N 3.49Å; L774-L777 PolarHBondContact O-N 2.87Å; L777-Q780 WeakPolarHBondContact O-CB 3.18Å; L777-Q780 PolarHBondContact O-N 2.93Å; L777-E781 WeakPolarHBondContact O-CB 3.41Å; L777-E781 PolarHBondContact O-N 2.65Å
778	Q	94.5	Very high	92	Very high	92 Å²	92	59.6 Å²	59.6	43%	0.43	29%	0.292	S	S	.	.	H	α-helix	trans	-64.4	-40.8	174.7	-173	178.4	1.4	0	0	112.2	I467 L774 G775 I776 Q780 S782	I467-Q778 VanDerWaalsContact CG2-OE1 3.3Å; L774-Q778 WeakPolarHBondContact O-CB 3.48Å; L774-Q778 PolarHBondContact O-N 2.69Å; G775-Q778 PolarHBondContact O-N 2.61Å; I776-Q778 VanDerWaalsContact C-N 3.32Å; I776-Q778 PolarHBondContact O-N 2.79Å; Q778-Q780 VanDerWaalsContact C-N 3.27Å; Q778-Q780 PolarHBondContact O-N 3.15Å; Q778-S782 WeakPolarHBondContact O-CB 3.44Å; Q778-S782 PolarHBondContact O-N 3.01Å; Q778-S782 PolarHBondContact O-OG 3.15Å
779	L	94.9	Very high	92.5	Very high	1 Å²	1	59.9 Å²	59.9	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-67.6	-26.3	173.6	-70.9	176.9	0	0	0	113	M460 E463 L464 I467 G775 I776 N783 R784 L785	M460-L779 HydrophobicContact CG-CD1 4.48Å; E463-L779 HydrophobicContact CB-CD1 4.21Å; E463-L779 HydrophobicContact CB-CD2 3.91Å; L464-L779 HydrophobicContact CD2-CD1 3.58Å; L464-L779 HydrophobicContact CD2-CG 4.44Å; L464-L779 HydrophobicContact CG-CD1 3.69Å; I467-L779 HydrophobicContact CD1-CD2 3.52Å; I467-L779 HydrophobicContact CD1-CG 3.88Å; G775-L779 WeakPolarHBondContact O-CG 3.38Å; G775-L779 PolarHBondContact O-N 3.49Å; I776-L779 PolarHBondContact O-N 3.31Å; L779-N783 PolarHBondContact O-N 2.7Å; L779-R784 HydrophobicContact CB-CB 4.41Å; L779-R784 HydrophobicContact CD2-CB 3.75Å; L779-R784 HydrophobicContact CD2-CG 3.95Å; L779-R784 PolarHBondContact O-N 3.18Å; L779-L785 HydrophobicContact CB-CD1 4.29Å; L779-L785 HydrophobicContact CB-CD2 4Å; L779-L785 HydrophobicContact CB-CG 3.85Å; L779-L785 HydrophobicContact CD1-CD2 4.25Å; L779-L785 PolarHBondContact O-N 3.02Å
780	Q	94.1	Very high	92.7	Very high	111 Å²	111	62.2 Å²	62.2	52%	0.519	30%	0.303	S	S	.	.	H	α-helix	trans	-77.9	-45.7	174.1	-167.4	174.5	3.2	0	0	111.7	I776 L777 Q778 N783 L785	I776-Q780 WeakPolarHBondContact O-CB 3.48Å; I776-Q780 PolarHBondContact O-N 2.84Å; L777-Q780 WeakPolarHBondContact O-CB 3.18Å; L777-Q780 PolarHBondContact O-N 2.93Å; Q778-Q780 VanDerWaalsContact C-N 3.27Å; Q778-Q780 PolarHBondContact O-N 3.15Å; Q780-N783 WeakPolarHBondContact O-CA 3.48Å; Q780-N783 PolarHBondContact O-N 3.28Å; Q780-L785 HydrophobicContact CB-CD1 4.02Å
781	E	94.1	Very high	93	Very high	178 Å²	178	65.8 Å²	65.8	83%	0.832	31%	0.309	S	S	*	.	H	α-helix	trans	-64	-42.4	177.3	-176.7	175.9	-154.3	0	0	112	L777 N783	L777-E781 WeakPolarHBondContact O-CB 3.41Å; L777-E781 PolarHBondContact O-N 2.65Å; E781-N783 PolarHBondContact O-N 2.68Å
782	S	94.1	Very high	93.3	Very high	64 Å²	64	66.3 Å²	66.3	45%	0.448	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	4.3	172.4	61.2	0	0	0	0	114	Q778 R784	Q778-S782 WeakPolarHBondContact O-CB 3.44Å; Q778-S782 PolarHBondContact O-N 3.01Å; Q778-S782 PolarHBondContact O-OG 3.15Å; S782-R784 PolarHBondContact O-N 3.15Å; S782-R784 VanDerWaalsContact O-N 3.09Å; S782-R784 WeakPolarHBondContact OG-CG 3.41Å
783	N	93.3	Very high	93.2	Very high	87 Å²	87	66.6 Å²	66.6	47%	0.465	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.8	20.8	177.3	-157.5	40.4	0	0	0	115	L779 Q780 E781 E786 I787	L779-N783 PolarHBondContact O-N 2.7Å; Q780-N783 WeakPolarHBondContact O-CA 3.48Å; Q780-N783 PolarHBondContact O-N 3.28Å; E781-N783 PolarHBondContact O-N 2.68Å; N783-E786 PolarHBondContact O-N 3.31Å; N783-E786 VanDerWaalsContact OD1-CB 3.25Å; N783-E786 WeakPolarHBondContact OD1-CB 3.47Å; N783-I787 WeakPolarHBondContact O-CG1 3.34Å; N783-I787 PolarHBondContact O-N 3.25Å
784	R	94.6	Very high	92.4	Very high	89 Å²	89	70.4 Å²	70.4	34%	0.336	33%	0.327	S	S	.	.	H	α-helix	trans	-66.6	-37.7	-180	-63	-66.5	-69.2	167.7	-4.3	111.8	E463 L779 S782 E786 I787 L788	E463-R784 IonicContact OE1-CZ 2.62Å; E463-R784 IonicContact OE1-NE 2.95Å; E463-R784 IonicContact OE1-NH2 3.06Å; E463-R784 PolarHBondContact OE1-NH2 2.9Å; E463-R784 IonicContact OE2-CZ 3.79Å; E463-R784 VanDerWaalsContact OE2-CZ 3.23Å; E463-R784 IonicContact OE2-NE 2.68Å; E463-R784 PolarHBondContact OE2-NE 3.43Å; E463-R784 IonicContact OE2-NH2 2.93Å; E463-R784 PolarHBondContact OE2-NH2 2.84Å; L779-R784 HydrophobicContact CB-CB 4.41Å; L779-R784 HydrophobicContact CD2-CB 3.75Å; L779-R784 HydrophobicContact CD2-CG 3.95Å; L779-R784 PolarHBondContact O-N 3.18Å; S782-R784 PolarHBondContact O-N 3.15Å; S782-R784 VanDerWaalsContact O-N 3.09Å; S782-R784 WeakPolarHBondContact OG-CG 3.41Å; R784-E786 VanDerWaalsContact C-N 3.32Å; R784-E786 PolarHBondContact O-N 3.47Å; R784-I787 PolarHBondContact O-N 3.14Å; R784-L788 WeakPolarHBondContact O-CG 3.42Å; R784-L788 PolarHBondContact O-N 3.44Å
785	L	93.8	Very high	91.1	Very high	14 Å²	14	68.4 Å²	68.4	7%	0.073	34%	0.335	C	S	.	.	H	α-helix	trans	-60.7	-39.6	178.6	-61.1	175.7	0	0	0	112.3	M460 F526 I776 L779 Q780 L788 K789	M460-L785 HydrophobicContact CG-CD2 3.97Å; M460-L785 HydrophobicContact SD-CD2 3.89Å; F526-L785 HydrophobicContact CB-CD1 4.18Å; I776-L785 HydrophobicContact CG2-CD1 4.47Å; L779-L785 HydrophobicContact CB-CD1 4.29Å; L779-L785 HydrophobicContact CB-CD2 4Å; L779-L785 HydrophobicContact CB-CG 3.85Å; L779-L785 HydrophobicContact CD1-CD2 4.25Å; L779-L785 PolarHBondContact O-N 3.02Å; Q780-L785 HydrophobicContact CB-CD1 4.02Å; L785-L788 PolarHBondContact O-N 2.89Å; L785-K789 PolarHBondContact O-N 2.7Å
786	E	92.4	Very high	89.8	Confident	61 Å²	61	69.7 Å²	69.7	29%	0.285	35%	0.347	S	S	.	.	H	α-helix	trans	-70.5	-38.3	176.2	174.4	64	177.6	0	0	111.9	N783 R784 L788 K789 R790	N783-E786 PolarHBondContact O-N 3.31Å; N783-E786 VanDerWaalsContact OD1-CB 3.25Å; N783-E786 WeakPolarHBondContact OD1-CB 3.47Å; R784-E786 VanDerWaalsContact C-N 3.32Å; R784-E786 PolarHBondContact O-N 3.47Å; E786-L788 VanDerWaalsContact C-N 3.34Å; E786-L788 PolarHBondContact O-N 3.09Å; E786-K789 PolarHBondContact O-N 2.93Å; E786-R790 WeakPolarHBondContact O-CG 3.42Å; E786-R790 PolarHBondContact O-N 2.98Å; E786-R790 IonicContact OE1-CZ 3.74Å; E786-R790 IonicContact OE1-NE 3.23Å; E786-R790 PolarHBondContact OE1-NE 3.17Å; E786-R790 IonicContact OE1-NH2 2.93Å; E786-R790 PolarHBondContact OE1-NH2 3.05Å
787	I	94.3	Very high	88.5	Confident	86 Å²	86	78.2 Å²	78.2	44%	0.441	39%	0.387	S	S	.	.	H	α-helix	trans	-61.9	-43.7	174	-65.9	165.9	0	0	0	110.4	N783 R784 R790 R791	N783-I787 WeakPolarHBondContact O-CG1 3.34Å; N783-I787 PolarHBondContact O-N 3.25Å; R784-I787 PolarHBondContact O-N 3.14Å; I787-R790 PolarHBondContact O-N 3.35Å; I787-R791 PolarHBondContact O-N 3.06Å
788	L	94.4	Very high	87.6	Confident	11 Å²	11	75.9 Å²	75.9	6%	0.058	38%	0.377	C	S	.	.	H	α-helix	trans	-64.7	-41.7	173.5	-69.6	-179.5	0	0	0	111.9	F456 D459 M460 E463 R784 L785 E786 R790 R791 W792	F456-L788 HydrophobicContact CD2-CB 3.81Å; F456-L788 HydrophobicContact CE2-CB 3.6Å; D459-L788 HydrophobicContact CB-CD1 4.3Å; D459-L788 HydrophobicContact CB-CD2 3.77Å; M460-L788 HydrophobicContact CB-CD1 4.18Å; E463-L788 HydrophobicContact CG-CD1 4.37Å; R784-L788 WeakPolarHBondContact O-CG 3.42Å; R784-L788 PolarHBondContact O-N 3.44Å; L785-L788 PolarHBondContact O-N 2.89Å; E786-L788 VanDerWaalsContact C-N 3.34Å; E786-L788 PolarHBondContact O-N 3.09Å; L788-R790 PolarHBondContact O-N 2.67Å; L788-R791 WeakPolarHBondContact O-CB 3.46Å; L788-R791 PolarHBondContact O-N 3.3Å; L788-W792 VanDerWaalsContact O-CD1 3.24Å; L788-W792 PolarHBondContact O-N 3.5Å
789	K	92.6	Very high	86.3	Confident	41 Å²	41	77 Å²	77	18%	0.178	39%	0.392	C	S	.	.	H	α-helix	trans	-59.6	-48.7	176.6	-164.5	-155	-179.3	-154.7	0	110.3	F456 M527 E737 L785 E786 R791 W792 W793	F456-K789 HydrophobicContact CE2-CB 4.3Å; M527-K789 HydrophobicContact CE-CB 4.43Å; M527-K789 HydrophobicContact CE-CG 4.04Å; E737-K789 IonicContact OE1-NZ 2.74Å; E737-K789 PolarHBondContact OE1-NZ 2.84Å; E737-K789 WeakPolarHBondContact OE2-CE 3.36Å; E737-K789 IonicContact OE2-NZ 2.7Å; E737-K789 PolarHBondContact OE2-NZ 2.93Å; L785-K789 PolarHBondContact O-N 2.7Å; E786-K789 PolarHBondContact O-N 2.93Å; K789-R791 VanDerWaalsContact C-N 3.34Å; K789-R791 PolarHBondContact O-N 3.26Å; K789-W792 PolarHBondContact O-N 3.46Å; K789-W792 VanDerWaalsContact O-N 3.16Å; K789-W793 HydrophobicContact CG-CD2 4.05Å; K789-W793 HydrophobicContact CG-CE3 3.76Å; K789-W793 HydrophobicContact CG-CG 4.49Å; K789-W793 HydrophobicContact CG-CZ3 4.21Å; K789-W793 WeakPolarHBondContact O-CB 3.46Å; K789-W793 VanDerWaalsContact O-CE3 3.3Å; K789-W793 PolarHBondContact O-N 3.4Å
790	R	90.7	Very high	84.7	Confident	133 Å²	133	83.9 Å²	83.9	50%	0.502	42%	0.422	S	S	.	.	H	α-helix	trans	-59.8	-42.9	178.4	-69.7	-178.7	-167.9	-160.8	3.6	112.4	E786 I787 L788 W792 W793 E794	E786-R790 WeakPolarHBondContact O-CG 3.42Å; E786-R790 PolarHBondContact O-N 2.98Å; E786-R790 IonicContact OE1-CZ 3.74Å; E786-R790 IonicContact OE1-NE 3.23Å; E786-R790 PolarHBondContact OE1-NE 3.17Å; E786-R790 IonicContact OE1-NH2 2.93Å; E786-R790 PolarHBondContact OE1-NH2 3.05Å; I787-R790 PolarHBondContact O-N 3.35Å; L788-R790 PolarHBondContact O-N 2.67Å; R790-W792 VanDerWaalsContact C-N 3.27Å; R790-W792 PolarHBondContact O-N 3.28Å; R790-W793 PolarHBondContact O-N 3.27Å; R790-E794 HydrophobicContact CB-CG 4.23Å; R790-E794 WeakPolarHBondContact CB-OE2 3.18Å; R790-E794 WeakPolarHBondContact CD-OE2 3.31Å; R790-E794 HydrophobicContact CG-CG 4.31Å; R790-E794 VanDerWaalsContact CG-OE2 3.24Å; R790-E794 WeakPolarHBondContact CG-OE2 3.47Å; R790-E794 WeakPolarHBondContact O-CB 3.49Å; R790-E794 PolarHBondContact O-N 2.99Å
791	R	91.6	Very high	82.9	Confident	166 Å²	166	86.4 Å²	86.4	63%	0.626	43%	0.434	S	S	*	.	H	α-helix	trans	-53.4	-43	175.2	-174.1	-172.3	-173.6	-176.2	7.5	112.6	D459 I787 L788 K789	D459-R791 IonicContact OD1-NH1 3.6Å; D459-R791 IonicContact OD2-CZ 2.91Å; D459-R791 IonicContact OD2-NH1 3.92Å; D459-R791 PolarHBondContact OD2-NH1 3.5Å; I787-R791 PolarHBondContact O-N 3.06Å; L788-R791 WeakPolarHBondContact O-CB 3.46Å; L788-R791 PolarHBondContact O-N 3.3Å; K789-R791 VanDerWaalsContact C-N 3.34Å; K789-R791 PolarHBondContact O-N 3.26Å
792	W	91.6	Very high	80.3	Confident	45 Å²	45	86.4 Å²	86.4	17%	0.17	43%	0.434	C	S	.	.	H	α-helix	trans	-95.9	-15	-172.5	-69.1	107.8	0	0	0	114.6	P436 M439 E454 G455 F456 D459 L788 K789 R790	P436-W792 HydrophobicContact CB-CB 4.37Å; M439-W792 HydrophobicContact CE-CE3 3.85Å; M439-W792 HydrophobicContact CE-CH2 4.34Å; M439-W792 HydrophobicContact CE-CZ3 3.43Å; M439-W792 VanDerWaalsContact CE-CZ3 3.43Å; E454-W792 HydrophobicContact CB-CH2 4.15Å; E454-W792 HydrophobicContact CG-CH2 4.26Å; G455-W792 VanDerWaalsContact C-CE2 3.5Å; G455-W792 VanDerWaalsContact CA-CZ2 3.5Å; F456-W792 HydrophobicContact CB-CB 4.35Å; F456-W792 HydrophobicContact CB-CG 4.12Å; D459-W792 WeakPolarHBondContact OD2-CZ2 3.38Å; D459-W792 PolarHBondContact OD2-NE1 3.15Å; L788-W792 VanDerWaalsContact O-CD1 3.24Å; L788-W792 PolarHBondContact O-N 3.5Å; K789-W792 PolarHBondContact O-N 3.46Å; K789-W792 VanDerWaalsContact O-N 3.16Å; R790-W792 VanDerWaalsContact C-N 3.27Å; R790-W792 PolarHBondContact O-N 3.28Å
793	W	89.6	Confident	77.8	Confident	8 Å²	8	90.2 Å²	90.2	3%	0.03	45%	0.449	C	S	.	.	H	α-helix	trans	-111	-33	179.3	-84.5	-105.6	0	0	0	115.5	P436 Y437 F456 M527 T734 S741 K789 R790 G795	P436-W793 HydrophobicContact CG-CD2 4.19Å; P436-W793 HydrophobicContact CG-CE3 4.1Å; P436-W793 HydrophobicContact CG-CH2 3.68Å; P436-W793 HydrophobicContact CG-CZ2 3.74Å; P436-W793 HydrophobicContact CG-CZ3 3.86Å; Y437-W793 HydrophobicContact CD1-CH2 4.04Å; Y437-W793 AromaticContact CE1-CH2 3.55Å; Y437-W793 HydrophobicContact CE1-CH2 3.55Å; Y437-W793 AromaticContact CE1-CZ2 3.83Å; Y437-W793 HydrophobicContact CE1-CZ2 3.83Å; Y437-W793 AromaticContact CZ-CZ2 3.87Å; F456-W793 HydrophobicContact CB-CH2 4.3Å; F456-W793 HydrophobicContact CB-CZ3 3.87Å; F456-W793 AromaticContact CD2-CZ3 3.78Å; F456-W793 HydrophobicContact CD2-CZ3 3.78Å; F456-W793 HydrophobicContact CG-CH2 4.32Å; F456-W793 AromaticContact CG-CZ3 3.89Å; F456-W793 HydrophobicContact CG-CZ3 3.89Å; M527-W793 HydrophobicContact CE-CH2 4.23Å; M527-W793 HydrophobicContact CE-CZ3 4.44Å; T734-W793 PolarHBondContact O-NE1 2.89Å; S741-W793 PolarHBondContact OG-O 3.46Å; K789-W793 HydrophobicContact CG-CD2 4.05Å; K789-W793 HydrophobicContact CG-CE3 3.76Å; K789-W793 HydrophobicContact CG-CG 4.49Å; K789-W793 HydrophobicContact CG-CZ3 4.21Å; K789-W793 WeakPolarHBondContact O-CB 3.46Å; K789-W793 VanDerWaalsContact O-CE3 3.3Å; K789-W793 PolarHBondContact O-N 3.4Å; R790-W793 PolarHBondContact O-N 3.27Å; W793-G795 VanDerWaalsContact C-N 3.31Å; W793-G795 PolarHBondContact O-N 3.33Å
794	E	77.1	Confident	76	Confident	99 Å²	99	94.7 Å²	94.7	46%	0.463	47%	0.467	S	S	.	.	S	Bend	trans	-81.8	-2	-172.7	-66.4	-159.5	91	0	0	114.7	R790 G796 K800	R790-E794 HydrophobicContact CB-CG 4.23Å; R790-E794 WeakPolarHBondContact CB-OE2 3.18Å; R790-E794 WeakPolarHBondContact CD-OE2 3.31Å; R790-E794 HydrophobicContact CG-CG 4.31Å; R790-E794 VanDerWaalsContact CG-OE2 3.24Å; R790-E794 WeakPolarHBondContact CG-OE2 3.47Å; R790-E794 WeakPolarHBondContact O-CB 3.49Å; R790-E794 PolarHBondContact O-N 2.99Å; E794-G796 PolarHBondContact O-N 3.24Å; E794-G796 VanDerWaalsContact O-N 3.11Å; E794-K800 IonicContact OE1-NZ 2.68Å; E794-K800 PolarHBondContact OE1-NZ 3.46Å
795	G	63.3	Low	73.8	Confident	74 Å²	74	100.6 Å²	100.6	76%	0.763	49%	0.489	S	S	*	.			trans	-76.5	17.9	179.2	0	0	0	0	0	115.9	W793	W793-G795 VanDerWaalsContact C-N 3.31Å; W793-G795 PolarHBondContact O-N 3.33Å
796	G	64.9	Low	71.9	Confident	26 Å²	26	104.6 Å²	104.6	27%	0.268	52%	0.524	S	S	.	.			trans	-67.7	153.3	-174	0	0	0	0	0	114.6	S741 E794	S741-G796 CarbonylContact O-C 3.57Å; S741-G796 WeakPolarHBondContact O-CA 3.42Å; E794-G796 PolarHBondContact O-N 3.24Å; E794-G796 VanDerWaalsContact O-N 3.11Å
797	Q	68.1	Low	70.2	Confident	180 Å²	180	111 Å²	111	84%	0.841	55%	0.551	S	S	*	*	S	Bend	trans	-82.7	-15.5	176.7	-65.1	-175	5.9	0	0	112.9	S741	S741-Q797 PolarHBondContact O-N 3.31Å; S741-Q797 VanDerWaalsContact O-N 3.12Å
798	C	75.8	Confident	68.6	Low	28 Å²	28	110.5 Å²	110.5	19%	0.189	57%	0.567	C	S	.	*	S	Bend	trans	-74.1	136.1	-179.7	-59.9	0	0	0	0	111.7	R740 S741 C744 K800	R740-C798 PolarHBondContact O-SG 3.28Å; S741-C798 PolarHBondContact O-N 2.83Å; S741-C798 PolarHBondContact O-SG 3.27Å; C744-C798 WeakPolarHBondContact CA-SG 3.43Å; C744-C798 HydrophobicContact CB-CB 3.95Å; C744-C798 WeakPolarHBondContact CB-SG 3.17Å; C744-C798 PolarHBondContact N-SG 3.13Å; C744-C798 WeakPolarHBondContact SG-CA 3.27Å; C744-C798 WeakPolarHBondContact SG-CB 3.49Å; C744-C798 CovalentContact SG-SG 2.04Å; C744-C798 PolarHBondContact SG-SG 3.44Å; C798-K800 PolarHBondContact O-N 2.97Å
799	P	67.9	Low	67.3	Low	115 Å²	115	114.9 Å²	114.9	75%	0.747	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-60.4	134.9	169.7	27.7	-33.6	0	0	0	108.9
800	K	60.4	Low	66.2	Low	146 Å²	146	114 Å²	114	64%	0.635	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-59.9	153.3	168.5	-67.9	-174.8	172.3	-174.7	0	109.1	E794 C798 E802	E794-K800 IonicContact OE1-NZ 2.68Å; E794-K800 PolarHBondContact OE1-NZ 3.46Å; C798-K800 PolarHBondContact O-N 2.97Å; K800-E802 PolarHBondContact O-N 2.95Å
801	E	55.6	Low	65.3	Low	163 Å²	163	113.9 Å²	113.9	76%	0.762	60%	0.599	S	S	*	*			trans	-69	79.1	175.1	-67.7	-178.7	113.7	0	0	110.1
802	E	40.6	Very low	64.2	Low	179 Å²	179	110.8 Å²	110.8	84%	0.836	59%	0.592	S	S	*	*			trans	-60.5	143.2	163.2	-67.2	-165.6	155.5	0	0	109.3	K800	K800-E802 PolarHBondContact O-N 2.95Å
803	D	41.9	Very low	63.3	Low	143 Å²	143	110 Å²	110	77%	0.765	59%	0.591	S	S	*	*			trans	-42	146	-173.7	-66.2	-58.7	0	0	0	113.6	R805	D803-R805 PolarHBondContact O-N 2.82Å
804	H	54.2	Low	62.8	Low	182 Å²	182	112.3 Å²	112.3	84%	0.843	60%	0.603	S	S	*	*			trans	-65.8	58	173.1	-58.3	-44.8	0	0	0	113.3	A806	H804-A806 PolarHBondContact O-N 2.75Å
805	R	49.5	Very low	63	Low	213 Å²	213	107.9 Å²	107.9	80%	0.804	59%	0.585	S	S	*	*			trans	-59.7	128	169.4	-76.6	-177.1	167.1	-177.8	-2.5	108.8	D803 K807	D803-R805 PolarHBondContact O-N 2.82Å; R805-K807 PolarHBondContact O-N 3.06Å
806	A	52.3	Low	64.1	Low	97 Å²	97	104.5 Å²	104.5	80%	0.802	55%	0.55	S	S	*	.			trans	-55.4	109.3	179.7	0	0	0	0	0	110.7	H804	H804-A806 PolarHBondContact O-N 2.75Å
807	K	57.7	Low	65.2	Low	197 Å²	197	107.4 Å²	107.4	86%	0.857	56%	0.558	S	S	*	*			trans	-67.5	143.8	172.1	-68	177.2	-178.8	172.2	0	108.8	R805	R805-K807 PolarHBondContact O-N 3.06Å
808	G	60	Low	66.1	Low	75 Å²	75	103.8 Å²	103.8	77%	0.773	54%	0.54	S	S	*	.			trans	-58.8	145.9	176	0	0	0	0	0	111.6	G810	G808-G810 PolarHBondContact O-N 2.91Å
809	L	68.7	Low	66.7	Low	103 Å²	103	106.3 Å²	106.3	54%	0.539	55%	0.554	S	S	.	*			trans	-60.9	110.5	-177.5	-69.6	169.6	0	0	0	111.2	L653 I814	L653-L809 HydrophobicContact CB-CD2 4.11Å; L653-L809 HydrophobicContact CD1-CD2 4Å; L653-L809 HydrophobicContact CD2-CD2 3.94Å; L653-L809 HydrophobicContact CG-CD2 4.25Å; L809-I814 HydrophobicContact CB-CD1 4.01Å; L809-I814 HydrophobicContact CD1-CD1 4.45Å
810	G	67.8	Low	67.7	Low	23 Å²	23	104.6 Å²	104.6	24%	0.237	54%	0.541	C	S	.	.			trans	-71	152.6	178.6	0	0	0	0	0	113	G808 E812 N813	G808-G810 PolarHBondContact O-N 2.91Å; G810-E812 PolarHBondContact O-N 2.94Å; G810-E812 VanDerWaalsContact O-N 3.13Å; G810-N813 PolarHBondContact O-N 2.94Å
811	M	72.1	Confident	69.1	Low	129 Å²	129	102.5 Å²	102.5	64%	0.635	54%	0.537	S	S	*	.	H	α-helix	trans	-58.1	-25.4	175.3	-176.3	60.5	178	0	0	112.5	N813 I814 G815 F818	M811-N813 VanDerWaalsContact C-N 3.33Å; M811-N813 PolarHBondContact O-N 3.49Å; M811-I814 PolarHBondContact O-N 3.4Å; M811-G815 WeakPolarHBondContact O-CA 3.4Å; M811-G815 PolarHBondContact O-N 2.97Å; M811-F818 HydrophobicContact CE-CD2 3.71Å; M811-F818 HydrophobicContact CE-CE2 4.05Å; M811-F818 HydrophobicContact CE-CG 4.43Å; M811-F818 HydrophobicContact SD-CD2 4.16Å; M811-F818 HydrophobicContact SD-CE2 4Å
812	E	70	Confident	70.8	Confident	102 Å²	102	99.6 Å²	99.6	48%	0.477	53%	0.525	S	S	.	.	H	α-helix	trans	-62.9	-33.8	175.3	62.9	-148.9	141	0	0	113.4	K542 G810	K542-E812 IonicContact NZ-OE2 3.91Å; G810-E812 PolarHBondContact O-N 2.94Å; G810-E812 VanDerWaalsContact O-N 3.13Å
813	N	72.1	Confident	73.2	Confident	28 Å²	28	94.3 Å²	94.3	15%	0.15	51%	0.507	C	S	.	.	H	α-helix	trans	-80.3	-21.1	179.1	-64.8	5.8	0	0	0	113.5	P543 L653 G810 M811	P543-N813 WeakPolarHBondContact CG-OD1 3.38Å; L653-N813 HydrophobicContact CD2-CB 4.19Å; G810-N813 PolarHBondContact O-N 2.94Å; M811-N813 VanDerWaalsContact C-N 3.33Å; M811-N813 PolarHBondContact O-N 3.49Å
814	I	79.8	Confident	75.7	Confident	56 Å²	56	89.5 Å²	89.5	29%	0.287	49%	0.491	S	S	.	.	H	α-helix	trans	-111.9	-20	-171.9	-57.3	178.7	0	0	0	111.4	L809 M811 G816 I817 F818	L809-I814 HydrophobicContact CB-CD1 4.01Å; L809-I814 HydrophobicContact CD1-CD1 4.45Å; M811-I814 PolarHBondContact O-N 3.4Å; I814-G816 VanDerWaalsContact C-N 3.29Å; I814-G816 PolarHBondContact O-N 3.31Å; I814-G816 VanDerWaalsContact O-N 3.09Å; I814-I817 HydrophobicContact CG2-CD1 4.34Å; I814-I817 WeakPolarHBondContact O-CB 3.31Å; I814-I817 PolarHBondContact O-N 2.92Å; I814-F818 HydrophobicContact CG2-CD2 4.3Å; I814-F818 HydrophobicContact CG2-CE2 3.77Å
815	G	81.3	Confident	77.5	Confident	7 Å²	7	85.8 Å²	85.8	7%	0.072	48%	0.478	C	S	.	.	H	α-helix	trans	-53	-36.6	-170.2	0	0	0	0	0	115.6	M811 I817 F818 V819	M811-G815 WeakPolarHBondContact O-CA 3.4Å; M811-G815 PolarHBondContact O-N 2.97Å; G815-I817 VanDerWaalsContact C-N 3.27Å; G815-I817 PolarHBondContact O-N 3.3Å; G815-F818 PolarHBondContact O-N 2.99Å; G815-V819 PolarHBondContact O-N 3.19Å
816	G	84.9	Confident	79.6	Confident	3 Å²	3	80.8 Å²	80.8	3%	0.031	47%	0.466	C	S	.	.	H	α-helix	trans	-63.4	-29.6	177.8	0	0	0	0	0	114.4	Y545 I814 F818 V819 V820	Y545-G816 VanDerWaalsContact O-CA 3.3Å; Y545-G816 WeakPolarHBondContact O-CA 3.47Å; I814-G816 VanDerWaalsContact C-N 3.29Å; I814-G816 PolarHBondContact O-N 3.31Å; I814-G816 VanDerWaalsContact O-N 3.09Å; G816-F818 VanDerWaalsContact C-N 3.32Å; G816-F818 PolarHBondContact O-N 3.09Å; G816-V819 PolarHBondContact O-N 3.03Å; G816-V820 WeakPolarHBondContact O-CG2 3.33Å; G816-V820 PolarHBondContact O-N 3.18Å
817	I	88.1	Confident	81.5	Confident	86 Å²	86	80.6 Å²	80.6	44%	0.441	45%	0.454	S	S	.	.	H	α-helix	trans	-65.4	-39.7	177.3	-56.9	176.3	0	0	0	109.9	F548 I814 G815 V820 L821	F548-I817 HydrophobicContact CB-CD1 4.4Å; F548-I817 HydrophobicContact CB-CG1 4.42Å; F548-I817 HydrophobicContact CD1-CG1 4Å; F548-I817 HydrophobicContact CE1-CG1 4.45Å; F548-I817 HydrophobicContact CG-CG1 4.09Å; I814-I817 HydrophobicContact CG2-CD1 4.34Å; I814-I817 WeakPolarHBondContact O-CB 3.31Å; I814-I817 PolarHBondContact O-N 2.92Å; G815-I817 VanDerWaalsContact C-N 3.27Å; G815-I817 PolarHBondContact O-N 3.3Å; I817-V820 PolarHBondContact O-N 3.03Å; I817-L821 WeakPolarHBondContact O-CB 3.28Å; I817-L821 PolarHBondContact O-N 3.47Å
818	F	87.6	Confident	83.2	Confident	105 Å²	105	74 Å²	74	46%	0.461	44%	0.436	S	S	.	.	H	α-helix	trans	-66.6	-38.4	173.6	-66.6	-75.3	0	0	0	112.3	M811 I814 G815 G816 L821 I822	M811-F818 HydrophobicContact CE-CD2 3.71Å; M811-F818 HydrophobicContact CE-CE2 4.05Å; M811-F818 HydrophobicContact CE-CG 4.43Å; M811-F818 HydrophobicContact SD-CD2 4.16Å; M811-F818 HydrophobicContact SD-CE2 4Å; I814-F818 HydrophobicContact CG2-CD2 4.3Å; I814-F818 HydrophobicContact CG2-CE2 3.77Å; G815-F818 PolarHBondContact O-N 2.99Å; G816-F818 VanDerWaalsContact C-N 3.32Å; G816-F818 PolarHBondContact O-N 3.09Å; F818-L821 PolarHBondContact O-N 3.34Å; F818-I822 VanDerWaalsContact O-CG1 3.3Å; F818-I822 WeakPolarHBondContact O-CG1 3.36Å; F818-I822 PolarHBondContact O-N 2.74Å
819	V	87.8	Confident	84.6	Confident	80 Å²	80	74.7 Å²	74.7	49%	0.485	43%	0.425	S	S	.	.	H	α-helix	trans	-62.6	-46.1	175.4	176.7	0	0	0	0	111	G815 G816 L821 I822 C823	G815-V819 PolarHBondContact O-N 3.19Å; G816-V819 PolarHBondContact O-N 3.03Å; V819-L821 VanDerWaalsContact C-N 3.33Å; V819-L821 PolarHBondContact O-N 3.06Å; V819-I822 PolarHBondContact O-N 3.18Å; V819-C823 PolarHBondContact O-N 3.16Å; V819-C823 PolarHBondContact O-SG 3.03Å; V819-C823 VanDerWaalsContact O-SG 3.37Å
820	V	89.6	Confident	85.6	Confident	79 Å²	79	75.8 Å²	75.8	48%	0.479	43%	0.426	S	S	.	.	H	α-helix	trans	-60.9	-41.8	176.7	172.2	0	0	0	0	111.4	F548 G816 I817 C823 G824	F548-V820 HydrophobicContact CZ-CG2 4.14Å; G816-V820 WeakPolarHBondContact O-CG2 3.33Å; G816-V820 PolarHBondContact O-N 3.18Å; I817-V820 PolarHBondContact O-N 3.03Å; V820-C823 PolarHBondContact O-N 3.21Å; V820-G824 PolarHBondContact O-N 3.39Å
821	L	90.2	Very high	86.7	Confident	103 Å²	103	78 Å²	78	54%	0.539	43%	0.434	S	S	.	.	H	α-helix	trans	-60.5	-46.8	176.1	178.1	62.3	0	0	0	112.2	I817 F818 V819 G824 L825	I817-L821 WeakPolarHBondContact O-CB 3.28Å; I817-L821 PolarHBondContact O-N 3.47Å; F818-L821 PolarHBondContact O-N 3.34Å; V819-L821 VanDerWaalsContact C-N 3.33Å; V819-L821 PolarHBondContact O-N 3.06Å; L821-G824 PolarHBondContact O-N 3.34Å; L821-L825 HydrophobicContact CD1-CD1 4.36Å; L821-L825 HydrophobicContact CD1-CG 4.49Å; L821-L825 HydrophobicContact CG-CD1 4.3Å; L821-L825 WeakPolarHBondContact O-CG 3.12Å; L821-L825 PolarHBondContact O-N 2.88Å
822	I	91.5	Very high	87.4	Confident	101 Å²	101	74.4 Å²	74.4	52%	0.518	43%	0.426	S	S	.	.	H	α-helix	trans	-63.3	-46.1	179.1	-67.4	167.9	0	0	0	110.7	F818 V819 G824 L825 I826	F818-I822 VanDerWaalsContact O-CG1 3.3Å; F818-I822 WeakPolarHBondContact O-CG1 3.36Å; F818-I822 PolarHBondContact O-N 2.74Å; V819-I822 PolarHBondContact O-N 3.18Å; I822-G824 VanDerWaalsContact C-N 3.34Å; I822-G824 PolarHBondContact O-N 3.31Å; I822-L825 PolarHBondContact O-N 3.32Å; I822-I826 HydrophobicContact CG2-CD1 3.87Å; I822-I826 WeakPolarHBondContact O-CG1 3.34Å; I822-I826 PolarHBondContact O-N 3.1Å
823	C	91.2	Very high	88.2	Confident	68 Å²	68	73.6 Å²	73.6	46%	0.459	42%	0.424	S	S	.	.	H	α-helix	trans	-60.2	-42.7	175.8	-70.5	0	0	0	0	112.1	V819 V820 L825 I826 V827	V819-C823 PolarHBondContact O-N 3.16Å; V819-C823 PolarHBondContact O-SG 3.03Å; V819-C823 VanDerWaalsContact O-SG 3.37Å; V820-C823 PolarHBondContact O-N 3.21Å; C823-L825 PolarHBondContact O-N 3.05Å; C823-I826 PolarHBondContact O-N 2.94Å; C823-V827 WeakPolarHBondContact O-CG2 3.4Å; C823-V827 PolarHBondContact O-N 3.28Å
824	G	92.7	Very high	88.7	Confident	42 Å²	42	76.5 Å²	76.5	43%	0.433	44%	0.438	S	S	.	.	H	α-helix	trans	-61.2	-42.2	176.5	0	0	0	0	0	113	V820 L821 I822 V827 A828	V820-G824 PolarHBondContact O-N 3.39Å; L821-G824 PolarHBondContact O-N 3.34Å; I822-G824 VanDerWaalsContact C-N 3.34Å; I822-G824 PolarHBondContact O-N 3.31Å; G824-V827 PolarHBondContact O-N 2.96Å; G824-A828 WeakPolarHBondContact O-CB 3.38Å; G824-A828 PolarHBondContact O-N 3.42Å
825	L	93.3	Very high	89.1	Confident	105 Å²	105	79.9 Å²	79.9	55%	0.55	45%	0.452	S	S	.	.	H	α-helix	trans	-64.7	-42.1	175.7	-70.8	169.5	0	0	0	112.2	L821 I822 C823 A828 V829	L821-L825 HydrophobicContact CD1-CD1 4.36Å; L821-L825 HydrophobicContact CD1-CG 4.49Å; L821-L825 HydrophobicContact CG-CD1 4.3Å; L821-L825 WeakPolarHBondContact O-CG 3.12Å; L821-L825 PolarHBondContact O-N 2.88Å; I822-L825 PolarHBondContact O-N 3.32Å; C823-L825 PolarHBondContact O-N 3.05Å; L825-A828 PolarHBondContact O-N 3.21Å; L825-V829 WeakPolarHBondContact O-CG2 3.06Å; L825-V829 PolarHBondContact O-N 2.85Å
826	I	92.6	Very high	89.1	Confident	108 Å²	108	82 Å²	82	55%	0.554	46%	0.46	S	S	*	.	H	α-helix	trans	-62.5	-44.7	176.6	-67.9	165.5	0	0	0	110.7	I822 C823 V829 F830	I822-I826 HydrophobicContact CG2-CD1 3.87Å; I822-I826 WeakPolarHBondContact O-CG1 3.34Å; I822-I826 PolarHBondContact O-N 3.1Å; C823-I826 PolarHBondContact O-N 2.94Å; I826-V829 PolarHBondContact O-N 3.4Å; I826-F830 WeakPolarHBondContact O-CB 3.23Å; I826-F830 PolarHBondContact O-N 2.88Å
827	V	92.9	Very high	88.9	Confident	92 Å²	92	83.6 Å²	83.6	56%	0.558	47%	0.469	S	S	*	.	H	α-helix	trans	-64	-42.5	176.6	172.2	0	0	0	0	111.3	C823 G824 V829 F830 V831	C823-V827 WeakPolarHBondContact O-CG2 3.4Å; C823-V827 PolarHBondContact O-N 3.28Å; G824-V827 PolarHBondContact O-N 2.96Å; V827-V829 PolarHBondContact O-N 3.46Å; V827-F830 PolarHBondContact O-N 3.14Å; V827-V831 HydrophobicContact CG1-CG2 4.35Å; V827-V831 WeakPolarHBondContact O-CG2 3.1Å; V827-V831 PolarHBondContact O-N 2.9Å
828	A	92.3	Very high	88.5	Confident	58 Å²	58	88.1 Å²	88.1	48%	0.479	48%	0.48	S	S	.	.	H	α-helix	trans	-62	-42.8	177.1	0	0	0	0	0	112.4	G824 L825 V831 A832	G824-A828 WeakPolarHBondContact O-CB 3.38Å; G824-A828 PolarHBondContact O-N 3.42Å; L825-A828 PolarHBondContact O-N 3.21Å; A828-V831 PolarHBondContact O-N 3.42Å; A828-A832 WeakPolarHBondContact O-CB 3.45Å; A828-A832 PolarHBondContact O-N 3.28Å
829	V	90.6	Very high	88	Confident	90 Å²	90	86.1 Å²	86.1	55%	0.545	48%	0.479	S	S	.	.	H	α-helix	trans	-63.9	-42.8	174.1	170.1	0	0	0	0	111.2	L825 I826 V827 A832 I833	L825-V829 WeakPolarHBondContact O-CG2 3.06Å; L825-V829 PolarHBondContact O-N 2.85Å; I826-V829 PolarHBondContact O-N 3.4Å; V827-V829 PolarHBondContact O-N 3.46Å; V829-A832 PolarHBondContact O-N 3.07Å; V829-I833 HydrophobicContact CG1-CD1 3.83Å; V829-I833 VanDerWaalsContact O-CG1 3.28Å; V829-I833 WeakPolarHBondContact O-CG1 3.31Å; V829-I833 PolarHBondContact O-N 3.27Å
830	F	89.6	Confident	87.2	Confident	126 Å²	126	82.6 Å²	82.6	55%	0.553	46%	0.458	S	S	*	.	H	α-helix	trans	-62.8	-44	177	-176.9	-95.5	0	0	0	112.3	I826 V827 I833 M834	I826-F830 WeakPolarHBondContact O-CB 3.23Å; I826-F830 PolarHBondContact O-N 2.88Å; V827-F830 PolarHBondContact O-N 3.14Å; F830-I833 PolarHBondContact O-N 2.86Å; F830-M834 HydrophobicContact CD1-CG 4.07Å; F830-M834 HydrophobicContact CE1-CG 3.66Å; F830-M834 HydrophobicContact CE1-SD 4.33Å; F830-M834 HydrophobicContact CE2-CE 4.06Å; F830-M834 HydrophobicContact CZ-CE 3.99Å; F830-M834 HydrophobicContact CZ-CG 3.96Å; F830-M834 HydrophobicContact CZ-SD 4.08Å; F830-M834 WeakPolarHBondContact O-CG 3.48Å; F830-M834 PolarHBondContact O-N 3.44Å
831	V	90.5	Very high	86.2	Confident	69 Å²	69	86.2 Å²	86.2	42%	0.418	46%	0.463	S	S	.	.	H	α-helix	trans	-62.6	-44.7	175.3	171.5	0	0	0	0	110.9	V827 A828 I833 M834 E835	V827-V831 HydrophobicContact CG1-CG2 4.35Å; V827-V831 WeakPolarHBondContact O-CG2 3.1Å; V827-V831 PolarHBondContact O-N 2.9Å; A828-V831 PolarHBondContact O-N 3.42Å; V831-I833 VanDerWaalsContact C-N 3.3Å; V831-I833 PolarHBondContact O-N 3.16Å; V831-M834 PolarHBondContact O-N 3.16Å; V831-M834 VanDerWaalsContact O-N 3.1Å; V831-E835 HydrophobicContact CG1-CG 4.42Å; V831-E835 PolarHBondContact O-N 3.28Å
832	A	87.5	Confident	85.1	Confident	55 Å²	55	89.1 Å²	89.1	46%	0.455	47%	0.467	S	S	.	.	H	α-helix	trans	-61.2	-37.2	176.1	0	0	0	0	0	112.7	A828 V829 F836	A828-A832 WeakPolarHBondContact O-CB 3.45Å; A828-A832 PolarHBondContact O-N 3.28Å; V829-A832 PolarHBondContact O-N 3.07Å; A832-F836 VanDerWaalsContact O-CB 3.26Å; A832-F836 WeakPolarHBondContact O-CB 3.38Å; A832-F836 PolarHBondContact O-N 2.86Å
833	I	85.6	Confident	83.7	Confident	85 Å²	85	87.5 Å²	87.5	44%	0.436	46%	0.461	S	S	.	.	H	α-helix	trans	-66.2	-43.5	172.4	-68.2	164.9	0	0	0	110.6	V829 F830 V831 F836 V837	V829-I833 HydrophobicContact CG1-CD1 3.83Å; V829-I833 VanDerWaalsContact O-CG1 3.28Å; V829-I833 WeakPolarHBondContact O-CG1 3.31Å; V829-I833 PolarHBondContact O-N 3.27Å; F830-I833 PolarHBondContact O-N 2.86Å; V831-I833 VanDerWaalsContact C-N 3.3Å; V831-I833 PolarHBondContact O-N 3.16Å; I833-F836 PolarHBondContact O-N 2.94Å; I833-V837 HydrophobicContact CG2-CG2 4.28Å; I833-V837 WeakPolarHBondContact O-CB 3.49Å; I833-V837 VanDerWaalsContact O-CG2 3.23Å; I833-V837 WeakPolarHBondContact O-CG2 3.38Å; I833-V837 PolarHBondContact O-N 3.18Å
834	M	83.3	Confident	82.1	Confident	89 Å²	89	85 Å²	85	44%	0.438	45%	0.446	S	S	.	.	H	α-helix	trans	-63.6	-41.7	176.6	-70.8	-63.6	109	0	0	112.4	F830 V831 V837 W838	F830-M834 HydrophobicContact CD1-CG 4.07Å; F830-M834 HydrophobicContact CE1-CG 3.66Å; F830-M834 HydrophobicContact CE1-SD 4.33Å; F830-M834 HydrophobicContact CE2-CE 4.06Å; F830-M834 HydrophobicContact CZ-CE 3.99Å; F830-M834 HydrophobicContact CZ-CG 3.96Å; F830-M834 HydrophobicContact CZ-SD 4.08Å; F830-M834 WeakPolarHBondContact O-CG 3.48Å; F830-M834 PolarHBondContact O-N 3.44Å; V831-M834 PolarHBondContact O-N 3.16Å; V831-M834 VanDerWaalsContact O-N 3.1Å; M834-V837 PolarHBondContact O-N 2.04Å; M834-W838 VanDerWaalsContact O-CB 3.29Å; M834-W838 WeakPolarHBondContact O-CB 3.02Å; M834-W838 PolarHBondContact O-N 3.04Å
835	E	88.2	Confident	80.4	Confident	127 Å²	127	90.5 Å²	90.5	59%	0.593	46%	0.46	S	S	*	.	H	α-helix	trans	-63	-42.2	173.3	-73.1	-169.9	165.5	0	0	111.8	V831 W838 S839	V831-E835 HydrophobicContact CG1-CG 4.42Å; V831-E835 PolarHBondContact O-N 3.28Å; E835-W838 PolarHBondContact O-N 3.09Å; E835-S839 WeakPolarHBondContact O-CB 3.46Å; E835-S839 PolarHBondContact O-N 3.21Å
836	F	81.1	Confident	78.6	Confident	52 Å²	52	91.2 Å²	91.2	23%	0.228	47%	0.469	C	S	.	.	H	α-helix	trans	-63.3	-44.6	176.1	-177.2	-106.8	0	0	0	111.9	A832 I833 T840 M855 E858 F859	A832-F836 VanDerWaalsContact O-CB 3.26Å; A832-F836 WeakPolarHBondContact O-CB 3.38Å; A832-F836 PolarHBondContact O-N 2.86Å; I833-F836 PolarHBondContact O-N 2.94Å; F836-T840 HydrophobicContact CE1-CG2 4.45Å; F836-T840 HydrophobicContact CE2-CG2 4.3Å; F836-T840 HydrophobicContact CZ-CG2 4.21Å; F836-T840 WeakPolarHBondContact O-CB 3.47Å; F836-T840 WeakPolarHBondContact O-CG2 3.41Å; F836-T840 PolarHBondContact O-N 3.3Å; F836-T840 PolarHBondContact O-OG1 2.89Å; F836-M855 HydrophobicContact CD1-CG 4.38Å; F836-M855 HydrophobicContact CE1-CG 3.64Å; F836-M855 HydrophobicContact CZ-CG 4.43Å; F836-E858 HydrophobicContact CE2-CB 3.81Å; F836-E858 HydrophobicContact CZ-CB 3.77Å; F836-F859 HydrophobicContact CE1-CB 4.42Å; F836-F859 HydrophobicContact CZ-CB 4.17Å
837	V	81.1	Confident	76.8	Confident	36 Å²	36	87.7 Å²	87.7	22%	0.218	46%	0.459	C	S	.	.	H	α-helix	trans	-65.7	-40.7	176.3	170.6	0	0	0	0	111.6	I833 M834 T840 R841 M855	I833-V837 HydrophobicContact CG2-CG2 4.28Å; I833-V837 WeakPolarHBondContact O-CB 3.49Å; I833-V837 VanDerWaalsContact O-CG2 3.23Å; I833-V837 WeakPolarHBondContact O-CG2 3.38Å; I833-V837 PolarHBondContact O-N 3.18Å; M834-V837 PolarHBondContact O-N 2.04Å; V837-T840 WeakPolarHBondContact CA-OG1 3.48Å; V837-T840 PolarHBondContact O-OG1 2.96Å; V837-T840 VanDerWaalsContact O-OG1 3.12Å; V837-R841 WeakPolarHBondContact O-CB 3.44Å; V837-R841 WeakPolarHBondContact O-CG 3.41Å; V837-R841 PolarHBondContact O-N 2.97Å; V837-M855 HydrophobicContact CB-CE 4.3Å; V837-M855 HydrophobicContact CG1-CE 4.28Å; V837-M855 HydrophobicContact CG2-CE 3.84Å; V837-M855 HydrophobicContact CG2-SD 4.43Å
838	W	79.7	Confident	74.9	Confident	181 Å²	181	93.2 Å²	93.2	69%	0.686	48%	0.479	S	S	*	.	H	α-helix	trans	-70.1	-43.1	177.7	-170.4	10.4	0	0	0	111.6	M834 E835 R841 R842	M834-W838 VanDerWaalsContact O-CB 3.29Å; M834-W838 WeakPolarHBondContact O-CB 3.02Å; M834-W838 PolarHBondContact O-N 3.04Å; E835-W838 PolarHBondContact O-N 3.09Å; W838-R841 PolarHBondContact O-N 3.39Å; W838-R842 VanDerWaalsContact O-CB 3.29Å; W838-R842 WeakPolarHBondContact O-CB 3.49Å; W838-R842 PolarHBondContact O-N 3.48Å
839	S	77.4	Confident	73.3	Confident	62 Å²	62	94.4 Å²	94.4	43%	0.434	48%	0.48	S	S	.	.	H	α-helix	trans	-63.9	-42.5	177.4	-174	0	0	0	0	112.2	E835 T843	E835-S839 WeakPolarHBondContact O-CB 3.46Å; E835-S839 PolarHBondContact O-N 3.21Å; S839-T843 WeakPolarHBondContact O-CB 3.4Å; S839-T843 PolarHBondContact O-N 3.24Å; S839-T843 PolarHBondContact O-OG1 3.09Å
840	T	69.7	Low	71.8	Confident	7 Å²	7	93.3 Å²	93.3	4%	0.043	48%	0.477	C	S	.	.	H	α-helix	trans	-67.6	-46.1	175.5	47.3	0	0	0	0	111.9	F836 V837 R842 T843 A844 M855	F836-T840 HydrophobicContact CE1-CG2 4.45Å; F836-T840 HydrophobicContact CE2-CG2 4.3Å; F836-T840 HydrophobicContact CZ-CG2 4.21Å; F836-T840 WeakPolarHBondContact O-CB 3.47Å; F836-T840 WeakPolarHBondContact O-CG2 3.41Å; F836-T840 PolarHBondContact O-N 3.3Å; F836-T840 PolarHBondContact O-OG1 2.89Å; V837-T840 WeakPolarHBondContact CA-OG1 3.48Å; V837-T840 PolarHBondContact O-OG1 2.96Å; V837-T840 VanDerWaalsContact O-OG1 3.12Å; T840-R842 PolarHBondContact O-N 3.45Å; T840-T843 PolarHBondContact O-N 2.77Å; T840-T843 VanDerWaalsContact O-N 3.14Å; T840-A844 PolarHBondContact O-N 3.07Å; T840-M855 WeakPolarHBondContact OG1-CE 3.3Å
841	R	69.7	Low	70.4	Confident	155 Å²	155	90.2 Å²	90.2	59%	0.585	47%	0.468	S	S	*	.	H	α-helix	trans	-55	-50	173.6	-79.8	-177.8	175.4	-164.5	-0.4	112.2	V837 W838 T843 A844 E845 V851	V837-R841 WeakPolarHBondContact O-CB 3.44Å; V837-R841 WeakPolarHBondContact O-CG 3.41Å; V837-R841 PolarHBondContact O-N 2.97Å; W838-R841 PolarHBondContact O-N 3.39Å; R841-T843 PolarHBondContact O-N 3.3Å; R841-A844 PolarHBondContact O-N 2.63Å; R841-E845 WeakPolarHBondContact O-CG 3.37Å; R841-E845 PolarHBondContact O-N 3.05Å; R841-V851 HydrophobicContact CG-CG1 4.21Å
842	R	67.5	Low	69	Low	164 Å²	164	91.5 Å²	91.5	62%	0.619	48%	0.479	S	S	*	.	H	α-helix	trans	-69.1	-18.2	-179	-163.8	176	-173.3	174.9	4.4	113.6	W838 T840	W838-R842 VanDerWaalsContact O-CB 3.29Å; W838-R842 WeakPolarHBondContact O-CB 3.49Å; W838-R842 PolarHBondContact O-N 3.48Å; T840-R842 PolarHBondContact O-N 3.45Å
843	T	61.6	Low	67.9	Low	66 Å²	66	94.9 Å²	94.9	41%	0.405	49%	0.485	S	S	.	.	H	α-helix	trans	-84.7	-40.9	172.5	-55.8	0	0	0	0	110.7	S839 T840 R841 E845 T846 G847	S839-T843 WeakPolarHBondContact O-CB 3.4Å; S839-T843 PolarHBondContact O-N 3.24Å; S839-T843 PolarHBondContact O-OG1 3.09Å; T840-T843 PolarHBondContact O-N 2.77Å; T840-T843 VanDerWaalsContact O-N 3.14Å; R841-T843 PolarHBondContact O-N 3.3Å; T843-E845 VanDerWaalsContact C-N 3.31Å; T843-E845 PolarHBondContact O-N 3.4Å; T843-T846 CarbonylContact O-C 3.54Å; T843-T846 WeakPolarHBondContact O-CA 3.38Å; T843-T846 PolarHBondContact O-N 3.03Å; T843-T846 PolarHBondContact O-OG1 2.91Å; T843-G847 PolarHBondContact O-N 3.27Å
844	A	56.7	Low	67	Low	17 Å²	17	93.7 Å²	93.7	14%	0.14	48%	0.478	C	S	.	.	H	α-helix	trans	-63.5	-32.4	173.1	0	0	0	0	0	112.8	T840 R841 T846 G847 V851	T840-A844 PolarHBondContact O-N 3.07Å; R841-A844 PolarHBondContact O-N 2.63Å; A844-T846 PolarHBondContact O-N 3.05Å; A844-G847 CarbonylContact O-C 3.53Å; A844-G847 PolarHBondContact O-N 3.47Å; A844-G847 VanDerWaalsContact O-N 3.12Å; A844-V851 HydrophobicContact CB-CG2 4.05Å
845	E	58	Low	66.1	Low	157 Å²	157	92 Å²	92	73%	0.734	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-11.2	167.7	-74.2	171.6	172	0	0	113.8	R841 T843	R841-E845 WeakPolarHBondContact O-CG 3.37Å; R841-E845 PolarHBondContact O-N 3.05Å; T843-E845 VanDerWaalsContact C-N 3.31Å; T843-E845 PolarHBondContact O-N 3.4Å
846	T	55.7	Low	65	Low	119 Å²	119	91.4 Å²	91.4	73%	0.73	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.8	12	177.2	62.2	0	0	0	0	114.4	T843 A844	T843-T846 CarbonylContact O-C 3.54Å; T843-T846 WeakPolarHBondContact O-CA 3.38Å; T843-T846 PolarHBondContact O-N 3.03Å; T843-T846 PolarHBondContact O-OG1 2.91Å; A844-T846 PolarHBondContact O-N 3.05Å
847	G	54.9	Low	64.3	Low	34 Å²	34	92.1 Å²	92.1	35%	0.351	48%	0.478	S	S	.	.	S	Bend	trans	-163.5	125.2	174.3	0	0	0	0	0	112	T843 A844 V849	T843-G847 PolarHBondContact O-N 3.27Å; A844-G847 CarbonylContact O-C 3.53Å; A844-G847 PolarHBondContact O-N 3.47Å; A844-G847 VanDerWaalsContact O-N 3.12Å; G847-V849 VanDerWaalsContact C-N 3.3Å; G847-V849 PolarHBondContact O-N 3.24Å
848	E	52.8	Low	63.6	Low	209 Å²	209	93.2 Å²	93.2	98%	0.977	48%	0.481	S	S	*	.	S	Bend	trans	-69.7	72.5	-168.3	-59.9	179.5	138.3	0	0	113.8
849	V	58.2	Low	63.1	Low	82 Å²	82	90.7 Å²	90.7	50%	0.497	48%	0.475	S	S	.	.	S	Bend	trans	-140.7	153	-179.8	-160.5	0	0	0	0	110.3	G847	G847-V849 VanDerWaalsContact C-N 3.3Å; G847-V849 PolarHBondContact O-N 3.24Å
850	S	59.6	Low	62.7	Low	68 Å²	68	96.6 Å²	96.6	48%	0.476	49%	0.488	S	S	.	.			trans	-71.6	132.4	-177.3	80.1	0	0	0	0	113	C852 Q853 E854	S850-C852 PolarHBondContact O-N 2.82Å; S850-C852 VanDerWaalsContact O-N 3.13Å; S850-Q853 PolarHBondContact O-N 2.79Å; S850-E854 PolarHBondContact O-N 2.79Å
851	V	59.6	Low	62.4	Low	60 Å²	60	101 Å²	101	36%	0.364	51%	0.511	S	S	.	.	H	α-helix	trans	-55.7	-34.4	-174.4	-178.7	0	0	0	0	113	R841 A844 M855	R841-V851 HydrophobicContact CG-CG1 4.21Å; A844-V851 HydrophobicContact CB-CG2 4.05Å; V851-M855 HydrophobicContact CG1-CE 4.36Å; V851-M855 VanDerWaalsContact O-CB 3.27Å; V851-M855 WeakPolarHBondContact O-CB 3.45Å; V851-M855 PolarHBondContact O-N 3.34Å; V851-M855 VanDerWaalsContact O-N 3.12Å
852	C	60.7	Low	62.3	Low	96 Å²	96	97 Å²	97	65%	0.649	51%	0.512	S	S	*	.	H	α-helix	trans	-65.9	-39.8	-180	-170.4	0	0	0	0	112.2	S850 L856	S850-C852 PolarHBondContact O-N 2.82Å; S850-C852 VanDerWaalsContact O-N 3.13Å; C852-L856 WeakPolarHBondContact O-CB 3.35Å; C852-L856 PolarHBondContact O-N 3.09Å; C852-L856 VanDerWaalsContact O-N 3.14Å
853	Q	65.6	Low	62.3	Low	127 Å²	127	93.7 Å²	93.7	59%	0.593	51%	0.51	S	S	*	.	H	α-helix	trans	-75.3	-40.1	-177.6	-170.2	168.7	-16.2	0	0	111.9	S850 L856 T857	S850-Q853 PolarHBondContact O-N 2.79Å; Q853-L856 PolarHBondContact O-N 3.49Å; Q853-T857 WeakPolarHBondContact O-CG2 3.31Å; Q853-T857 PolarHBondContact O-N 2.78Å; Q853-T857 VanDerWaalsContact O-N 3.1Å; Q853-T857 PolarHBondContact O-OG1 3.39Å
854	E	66.5	Low	62.2	Low	60 Å²	60	93.5 Å²	93.5	28%	0.28	51%	0.511	S	S	.	.	H	α-helix	trans	-57.8	-50.1	172.9	-160.1	79	-176.6	0	0	110.3	S850 L856 T857 E858	S850-E854 PolarHBondContact O-N 2.79Å; E854-L856 PolarHBondContact O-N 2.93Å; E854-T857 PolarHBondContact O-N 2.78Å; E854-T857 PolarHBondContact O-OG1 3.02Å; E854-E858 PolarHBondContact O-N 2.93Å
855	M	63.6	Low	62.2	Low	54 Å²	54	98.6 Å²	98.6	27%	0.266	54%	0.544	S	S	.	.	H	α-helix	trans	-61.4	-40.7	-178.8	-170.3	176.3	-70	0	0	113	F836 V837 T840 V851 F859	F836-M855 HydrophobicContact CD1-CG 4.38Å; F836-M855 HydrophobicContact CE1-CG 3.64Å; F836-M855 HydrophobicContact CZ-CG 4.43Å; V837-M855 HydrophobicContact CB-CE 4.3Å; V837-M855 HydrophobicContact CG1-CE 4.28Å; V837-M855 HydrophobicContact CG2-CE 3.84Å; V837-M855 HydrophobicContact CG2-SD 4.43Å; T840-M855 WeakPolarHBondContact OG1-CE 3.3Å; V851-M855 HydrophobicContact CG1-CE 4.36Å; V851-M855 VanDerWaalsContact O-CB 3.27Å; V851-M855 WeakPolarHBondContact O-CB 3.45Å; V851-M855 PolarHBondContact O-N 3.34Å; V851-M855 VanDerWaalsContact O-N 3.12Å; M855-F859 VanDerWaalsContact O-CB 3.27Å; M855-F859 WeakPolarHBondContact O-CB 3.44Å; M855-F859 PolarHBondContact O-N 3.04Å
856	L	66.1	Low	62	Low	113 Å²	113	100.2 Å²	100.2	59%	0.592	55%	0.548	S	S	*	.	H	α-helix	trans	-70.9	-33	179.6	-146.1	160.3	0	0	0	111.7	C852 Q853 E854 R860	C852-L856 WeakPolarHBondContact O-CB 3.35Å; C852-L856 PolarHBondContact O-N 3.09Å; C852-L856 VanDerWaalsContact O-N 3.14Å; Q853-L856 PolarHBondContact O-N 3.49Å; E854-L856 PolarHBondContact O-N 2.93Å; L856-R860 VanDerWaalsContact O-CB 3.29Å; L856-R860 WeakPolarHBondContact O-CB 3.48Å; L856-R860 PolarHBondContact O-N 2.96Å
857	T	65.8	Low	61.5	Low	67 Å²	67	103.7 Å²	103.7	41%	0.411	55%	0.553	S	S	.	*	H	α-helix	trans	-73.5	-44.9	174.9	56	0	0	0	0	112.9	Q853 E854 F859 R860 N861	Q853-T857 WeakPolarHBondContact O-CG2 3.31Å; Q853-T857 PolarHBondContact O-N 2.78Å; Q853-T857 VanDerWaalsContact O-N 3.1Å; Q853-T857 PolarHBondContact O-OG1 3.39Å; E854-T857 PolarHBondContact O-N 2.78Å; E854-T857 PolarHBondContact O-OG1 3.02Å; T857-F859 VanDerWaalsContact C-N 3.35Å; T857-F859 PolarHBondContact O-N 2.99Å; T857-R860 PolarHBondContact O-N 3.46Å; T857-N861 PolarHBondContact O-N 3.28Å; T857-N861 PolarHBondContact O-ND2 3.07Å
858	E	67.1	Low	60.9	Low	59 Å²	59	108.4 Å²	108.4	28%	0.276	58%	0.581	S	S	.	*	H	α-helix	trans	-64.8	-36.5	174.1	-86.8	-68.9	90.9	0	0	112.2	F836 E854 N861 A862 R870	F836-E858 HydrophobicContact CE2-CB 3.81Å; F836-E858 HydrophobicContact CZ-CB 3.77Å; E854-E858 PolarHBondContact O-N 2.93Å; E858-N861 WeakPolarHBondContact O-CB 3.47Å; E858-N861 PolarHBondContact O-N 3.29Å; E858-N861 PolarHBondContact OE1-ND2 3.44Å; E858-N861 VanDerWaalsContact OE1-ND2 3.14Å; E858-A862 WeakPolarHBondContact O-CB 3.29Å; E858-A862 PolarHBondContact O-N 2.96Å; E858-R870 IonicContact OE2-CZ 3.06Å; E858-R870 IonicContact OE2-NH2 2.69Å; E858-R870 PolarHBondContact OE2-NH2 3.36Å
859	F	68.1	Low	60.4	Low	128 Å²	128	103.3 Å²	103.3	56%	0.561	57%	0.569	S	S	*	*	H	α-helix	trans	-64.6	-43.4	174.6	-176.3	-100.6	0	0	0	111.5	F836 M855 T857 N861 A862 V863	F836-F859 HydrophobicContact CE1-CB 4.42Å; F836-F859 HydrophobicContact CZ-CB 4.17Å; M855-F859 VanDerWaalsContact O-CB 3.27Å; M855-F859 WeakPolarHBondContact O-CB 3.44Å; M855-F859 PolarHBondContact O-N 3.04Å; T857-F859 VanDerWaalsContact C-N 3.35Å; T857-F859 PolarHBondContact O-N 2.99Å; F859-N861 VanDerWaalsContact C-N 3.28Å; F859-N861 PolarHBondContact O-N 2.71Å; F859-A862 PolarHBondContact O-N 3.36Å; F859-V863 HydrophobicContact CD1-CG2 4.33Å; F859-V863 HydrophobicContact CE1-CG2 3.94Å; F859-V863 HydrophobicContact CE2-CG2 4.29Å; F859-V863 HydrophobicContact CZ-CG2 3.92Å; F859-V863 WeakPolarHBondContact O-CG2 3.4Å; F859-V863 PolarHBondContact O-N 2.96Å
860	R	68.8	Low	59.7	Low	186 Å²	186	109 Å²	109	70%	0.702	58%	0.581	S	S	*	*	H	α-helix	trans	-62.6	-34.4	174	-173	176	-177.7	173.5	1.4	112.3	L856 T857 S864	L856-R860 VanDerWaalsContact O-CB 3.29Å; L856-R860 WeakPolarHBondContact O-CB 3.48Å; L856-R860 PolarHBondContact O-N 2.96Å; T857-R860 PolarHBondContact O-N 3.46Å; R860-S864 WeakPolarHBondContact O-CB 3.39Å; R860-S864 PolarHBondContact O-N 3.04Å; R860-S864 VanDerWaalsContact O-N 3.1Å
861	N	64.8	Low	58.6	Low	100 Å²	100	110.5 Å²	110.5	54%	0.535	60%	0.597	S	S	.	*	H	α-helix	trans	-68.9	-40.3	173.5	-68.7	-24.5	0	0	0	112	T857 E858 F859 S864	T857-N861 PolarHBondContact O-N 3.28Å; T857-N861 PolarHBondContact O-ND2 3.07Å; E858-N861 WeakPolarHBondContact O-CB 3.47Å; E858-N861 PolarHBondContact O-N 3.29Å; E858-N861 PolarHBondContact OE1-ND2 3.44Å; E858-N861 VanDerWaalsContact OE1-ND2 3.14Å; F859-N861 VanDerWaalsContact C-N 3.28Å; F859-N861 PolarHBondContact O-N 2.71Å; N861-S864 PolarHBondContact O-N 3.49Å
862	A	65.9	Low	57.5	Low	71 Å²	71	119 Å²	119	59%	0.587	62%	0.623	S	S	*	*	H	α-helix	trans	-68.4	-40.5	179.4	0	0	0	0	0	112.9	E858 F859	E858-A862 WeakPolarHBondContact O-CB 3.29Å; E858-A862 PolarHBondContact O-N 2.96Å; F859-A862 PolarHBondContact O-N 3.36Å
863	V	69.3	Low	56.4	Low	95 Å²	95	126 Å²	126	58%	0.576	64%	0.636	S	S	*	*	H	α-helix	trans	-74.1	-26.7	176	177	0	0	0	0	111.9	F859 C865	F859-V863 HydrophobicContact CD1-CG2 4.33Å; F859-V863 HydrophobicContact CE1-CG2 3.94Å; F859-V863 HydrophobicContact CE2-CG2 4.29Å; F859-V863 HydrophobicContact CZ-CG2 3.92Å; F859-V863 WeakPolarHBondContact O-CG2 3.4Å; F859-V863 PolarHBondContact O-N 2.96Å; V863-C865 PolarHBondContact O-N 2.94Å
864	S	59.4	Low	55	Low	62 Å²	62	131 Å²	131	43%	0.434	65%	0.649	S	S	.	*	S	Bend	trans	-84.3	85.3	175	179.8	0	0	0	0	111.3	R860 N861 K866	R860-S864 WeakPolarHBondContact O-CB 3.39Å; R860-S864 PolarHBondContact O-N 3.04Å; R860-S864 VanDerWaalsContact O-N 3.1Å; N861-S864 PolarHBondContact O-N 3.49Å; S864-K866 PolarHBondContact O-N 3.45Å
865	C	55.6	Low	53.4	Low	123 Å²	123	139.1 Å²	139.1	83%	0.831	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	25.5	-175.5	-52.7	0	0	0	0	117.2	V863	V863-C865 PolarHBondContact O-N 2.94Å
866	K	53.6	Low	52	Low	191 Å²	191	142.4 Å²	142.4	83%	0.83	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93	-4.6	-174	-72.9	-173.5	173.1	-178.6	0	115.5	S864	S864-K866 PolarHBondContact O-N 3.45Å
867	K	45	Very low	50.4	Low	192 Å²	192	144.8 Å²	144.8	84%	0.835	72%	0.715	S	S	*	*			trans	-144.5	126.7	174.3	-71.6	-172.9	177.7	176.7	0	112.1
868	S	42.1	Very low	48.8	Very low	134 Å²	134	147.3 Å²	147.3	94%	0.937	74%	0.736	S	S	*	*			trans	-108.3	27.5	-178.7	-160	0	0	0	0	113.5
869	S	42.2	Very low	47	Very low	102 Å²	102	150.1 Å²	150.1	71%	0.713	76%	0.762	S	S	*	*			trans	-136.6	111.6	-176	51.8	0	0	0	0	113.2	A871	S869-A871 PolarHBondContact O-N 3.13Å
870	R	44.6	Very low	45.2	Very low	202 Å²	202	148.3 Å²	148.3	76%	0.762	77%	0.77	S	S	*	*			trans	-82.9	106.3	170	-95.1	-177.4	163.8	167.2	-4.9	110.4	E858 R872	E858-R870 IonicContact OE2-CZ 3.06Å; E858-R870 IonicContact OE2-NH2 2.69Å; E858-R870 PolarHBondContact OE2-NH2 3.36Å; R870-R872 PolarHBondContact O-N 2.95Å
871	A	36.5	Very low	43.4	Very low	98 Å²	98	143.1 Å²	143.1	81%	0.81	78%	0.775	S	S	*	*			trans	-76.8	100.8	169.8	0	0	0	0	0	110.4	S869 R873	S869-A871 PolarHBondContact O-N 3.13Å; A871-R873 PolarHBondContact O-N 3.49Å
872	R	36.1	Very low	41.6	Very low	239 Å²	239	141.9 Å²	141.9	90%	0.902	79%	0.786	S	S	*	*			trans	-62.3	106.9	173.7	-172.5	-179.7	-170	178.4	5.1	109.3	R870 R874	R870-R872 PolarHBondContact O-N 2.95Å; R872-R874 PolarHBondContact O-N 3.4Å
873	R	37.4	Very low	39.9	Very low	243 Å²	243	142.5 Å²	142.5	92%	0.917	80%	0.799	S	S	*	*			trans	-52.5	112.9	174.6	-74.1	-172.6	-178.1	177.3	3.5	109.1	A871	A871-R873 PolarHBondContact O-N 3.49Å
874	R	36.1	Very low	38	Very low	232 Å²	232	144.3 Å²	144.3	88%	0.875	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-66.5	142.2	160.8	-72.4	-176.1	175.4	-176.3	-0.8	107.2	R872	R872-R874 PolarHBondContact O-N 3.4Å
875	R	34.1	Very low	36.6	Very low	230 Å²	230	147.5 Å²	147.5	87%	0.868	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-55	133.6	165.2	-72.5	-179.7	175	170.9	-3.6	108.1	L877	R875-L877 PolarHBondContact O-N 3.36Å
876	P	34.2	Very low	35.3	Very low	123 Å²	123	152.1 Å²	152.1	80%	0.799	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-58.2	129.6	161.7	-18	31.1	0	0	0	108.1
877	L	32.6	Very low	33.8	Very low	163 Å²	163	151.6 Å²	151.6	85%	0.853	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-69.9	138	152.4	-89.4	75.5	0	0	0	106.5	R875 S879	R875-L877 PolarHBondContact O-N 3.36Å; L877-S879 PolarHBondContact O-N 3.09Å
878	S	30.5	Very low	33.5	Very low	121 Å²	121	147.2 Å²	147.2	85%	0.846	81%	0.813	S	S	*	*			trans	-69.2	80.5	173.4	52.1	0	0	0	0	110.3	A880	S878-A880 PolarHBondContact O-N 3.13Å; S878-A880 VanDerWaalsContact O-N 3.07Å
879	S	30.6	Very low	32.7	Very low	117 Å²	117	145.7 Å²	145.7	82%	0.818	80%	0.802	S	S	*	*			trans	-81.8	71.3	170.4	-176.4	0	0	0	0	110	L877	L877-S879 PolarHBondContact O-N 3.09Å
880	A	30.5	Very low	31.9	Very low	90 Å²	90	151.5 Å²	151.5	74%	0.744	81%	0.809	S	S	*	*			trans	-76.1	130.8	155.6	0	0	0	0	0	108.5	S878	S878-A880 PolarHBondContact O-N 3.13Å; S878-A880 VanDerWaalsContact O-N 3.07Å
881	G	30.4	Very low	31.1	Very low	77 Å²	77	149.6 Å²	149.6	79%	0.794	81%	0.812	S	S	*	*			trans	-69.9	161.2	156.9	0	0	0	0	0	110
882	G	27.4	Very low	30.5	Very low	75 Å²	75	148.9 Å²	148.9	77%	0.773	81%	0.806	S	S	*	*			cis	-140	-179.8	4.5	0	0	0	0	0	112.4	V884	G882-V884 PolarHBondContact O-N 3.29Å
883	G	30.6	Very low	30.2	Very low	84 Å²	84	145.5 Å²	145.5	87%	0.866	81%	0.805	S	S	*	*			trans	-71.9	128.6	180	0	0	0	0	0	112.7
884	V	27.7	Very low	29.6	Very low	132 Å²	132	138.3 Å²	138.3	80%	0.8	80%	0.798	S	S	*	*			trans	-105.1	116	145.1	171.6	0	0	0	0	106.9	G882	G882-V884 PolarHBondContact O-N 3.29Å
885	L	31.7	Very low	29.2	Very low	129 Å²	129	130.9 Å²	130.9	68%	0.675	79%	0.794	S	S	*	*	S	Bend	trans	71.6	126.2	164.7	-62.7	170	0	0	0	121.4
886	R	28	Very low	29.7	Very low	220 Å²	220	126.2 Å²	126.2	83%	0.83	79%	0.794	S	S	*	*			trans	78.8	98.1	131.2	-71.2	175	-178.4	164.1	2.5	122
887	H	21.7	Very low	29.3	Very low	181 Å²	181	131.5 Å²	131.5	84%	0.838	80%	0.797	S	S	*	*				-25.8	167.5	121.3	-93.5	0.9	0	0	0	117.4
888	P	38.8	Very low	29.8	Very low	100 Å²	100	129 Å²	129	65%	0.649	79%	0.791	S	S	*	*			cis	-144.2	161.8	-10.2	37.1	-17.6	0	0	0	117.7
889	S	25.7	Very low	29.8	Very low	102 Å²	102	131 Å²	131	71%	0.713	79%	0.79	S	S	*	*			trans	57.8	155.6	136.4	76.1	0	0	0	0	125
890	R	25.1	Very low	29.6	Very low	224 Å²	224	136 Å²	136	85%	0.845	79%	0.792	S	S	*	*			trans	85	116.4	155.9	-70.9	-168.9	176	-149	-0.3	121
891	L	27.5	Very low	29.6	Very low	161 Å²	161	138.9 Å²	138.9	84%	0.843	79%	0.794	S	S	*	*				47.8	137.8	121.4	-89.7	155.4	0	0	0	123
892	A	24.6	Very low	29.4	Very low	83 Å²	83	140.6 Å²	140.6	69%	0.686	79%	0.788	S	S	*	*			trans	106.3	124.2	137.6	0	0	0	0	0	121.6
893	L	29.1	Very low	29.5	Very low	168 Å²	168	146.6 Å²	146.6	88%	0.88	79%	0.788	S	S	*	*			trans	60.3	125.7	136.2	-92.1	69.2	0	0	0	124.9
894	A	24.8	Very low	29.3	Very low	92 Å²	92	148.7 Å²	148.7	76%	0.76	78%	0.775	S	S	*	*				77.7	88.4	120.9	0	0	0	0	0	123.8
895	G	28.8	Very low	29.1	Very low	77 Å²	77	150.3 Å²	150.3	79%	0.794	78%	0.776	S	S	*	*				56.2	-168.9	128.6	0	0	0	0	0	121.3
896	P	43.1	Very low	28.9	Very low	132 Å²	132	155.2 Å²	155.2	86%	0.857	79%	0.785	S	S	*	*			cis	-120.2	-157.2	-13.5	41.2	-26.4	0	0	0	113.5
897	R	26.4	Very low	28.9	Very low	233 Å²	233	152.8 Å²	152.8	88%	0.879	79%	0.788	S	S	*	*			trans	-89.8	-162.5	179.9	-49.5	175.1	174.1	159.7	-4.6	110.7
898	P	43.5	Very low	29.2	Very low	112 Å²	112	148.3 Å²	148.3	73%	0.727	78%	0.777	S	S	*	*			cis	-146.4	-162	-0.3	28.7	0.1	0	0	0	117.4
899	I	29.2	Very low	28.8	Very low	161 Å²	161	151.6 Å²	151.6	83%	0.826	79%	0.789	S	S	*	*			trans	107.8	157	153.2	-53.7	-171.5	0	0	0	117
900	R	27.2	Very low	28.9	Very low	223 Å²	223	150.3 Å²	150.3	84%	0.842	79%	0.792	S	S	*	*			trans	-130.1	-175.9	-155.8	-70.8	171.3	154.8	-179.9	-6	112.1
901	L	29.5	Very low	29	Very low	151 Å²	151	149.2 Å²	149.2	79%	0.791	79%	0.794	S	S	*	*			trans	93.1	149.6	160.1	-85	90.5	0	0	0	117.3
902	V	26.5	Very low	29	Very low	112 Å²	112	147.4 Å²	147.4	68%	0.679	78%	0.784	S	S	*	*			cis	179.7	162.4	-34.9	121.4	0	0	0	0	109.9
903	R	29.3	Very low	29.2	Very low	201 Å²	201	152.9 Å²	152.9	76%	0.758	79%	0.788	S	S	*	*			trans	70.8	155.7	165.7	-93.3	179.5	144.9	114.1	18.7	117
904	E	27.4	Very low	29	Very low	129 Å²	129	150.6 Å²	150.6	60%	0.603	79%	0.786	S	S	*	*			cis	-146.7	-138.6	-21.7	-139.5	164.2	-156.2	0	0	108.1
905	M	24	Very low	29	Very low	166 Å²	166	148.9 Å²	148.9	82%	0.818	78%	0.777	S	S	*	*			cis	-150	-128	3.3	-150.5	179.4	-153.5	0	0	112.4
906	R	26.2	Very low	29	Very low	232 Å²	232	152.6 Å²	152.6	88%	0.875	79%	0.785	S	S	*	*			trans	-143.5	168.8	177.3	-73.2	175	163	147.8	-9.6	110.1
907	L	28.2	Very low	28.1	Very low	169 Å²	169	149.5 Å²	149.5	89%	0.885	78%	0.777	S	S	*	*			trans	-166	-179.2	130.7	-108.4	165.8	0	0	0	113
908	S	27.7	Very low	29	Very low	87 Å²	87	144 Å²	144	61%	0.608	77%	0.771	S	S	*	*			trans	-157.5	154.3	-157.4	57.1	0	0	0	0	116.5
909	N	31.9	Very low	28.4	Very low	168 Å²	168	145.8 Å²	145.8	90%	0.898	77%	0.774	S	S	*	*			trans	76.6	142.4	156.6	-59.3	-14.7	0	0	0	120.7
910	G	28.1	Very low	28.5	Very low	76 Å²	76	144.6 Å²	144.6	78%	0.784	77%	0.774	S	S	*	*			trans	-179.6	162.9	173.7	0	0	0	0	0	113.3
911	K	27.2	Very low	28.5	Very low	201 Å²	201	137.5 Å²	137.5	87%	0.874	77%	0.771	S	S	*	*			trans	-146.5	-174.4	-177.2	-62.3	-171.7	174.4	-178.2	0	110.3
912	L	26	Very low	28.5	Very low	123 Å²	123	134 Å²	134	64%	0.644	77%	0.771	S	S	*	*			cis	-162.2	-169.8	12.1	-142.4	168.1	0	0	0	109
913	Y	28.2	Very low	28.7	Very low	198 Å²	198	137.1 Å²	137.1	78%	0.776	78%	0.783	S	S	*	*			trans	75.6	134.6	171.6	-57.9	-71.1	0	0	0	116
914	S	25	Very low	28.7	Very low	119 Å²	119	132 Å²	132	83%	0.832	78%	0.784	S	S	*	*			cis	80.5	131.2	49.9	-165.6	0	0	0	0	112.7
915	G	25.2	Very low	28.9	Very low	56 Å²	56	129 Å²	129	58%	0.577	79%	0.788	S	S	*	*			cis	-179.4	-152.3	2.9	0	0	0	0	0	112
916	T	29	Very low	29.2	Very low	156 Å²	156	129.7 Å²	129.7	96%	0.957	79%	0.794	S	S	*	*			trans	77.9	150.3	173.4	74.5	0	0	0	0	120.8
917	G	24.6	Very low	29.3	Very low	67 Å²	67	122.3 Å²	122.3	69%	0.691	79%	0.79	S	S	*	*			trans	-116.8	-136.7	169.2	0	0	0	0	0	110.3
918	P	45.7	Very low	29.4	Very low	116 Å²	116	119.4 Å²	119.4	75%	0.753	79%	0.79	S	S	*	*			cis	-143	-149.6	5.3	37.3	-12.4	0	0	0	114.5
919	L	30.7	Very low	29.5	Very low	151 Å²	151	118.8 Å²	118.8	79%	0.791	80%	0.798	S	S	*	*			trans	80	149.2	167.4	-46.8	178.8	0	0	0	117.2
920	T	30.8	Very low	29.4	Very low	135 Å²	135	119.8 Å²	119.8	83%	0.828	80%	0.799	S	S	*	*			cis	-169.8	156.8	-20.5	25.8	0	0	0	0	106.5
921	G	27.9	Very low	29.5	Very low	74 Å²	74	120.2 Å²	120.2	76%	0.763	80%	0.796	S	S	*	*			cis	-154.7	176.6	-4.1	0	0	0	0	0	107.7
922	G	28.4	Very low	29.5	Very low	78 Å²	78	117.4 Å²	117.4	80%	0.804	80%	0.796	S	S	*	*				91	132.2	52.1	0	0	0	0	0	110.1
923	L	31.5	Very low	29.6	Very low	178 Å²	178	114.9 Å²	114.9	93%	0.932	80%	0.799	S	S	*	*			cis	-151.4	176.7	4.1	-87.2	164.8	0	0	0	108.1
924	A	29.7	Very low	30.6	Very low	92 Å²	92	110.8 Å²	110.8	76%	0.76	80%	0.797	S	S	*	*			cis	-128.2	-139.9	7.2	0	0	0	0	0	110.3
925	G	30.6	Very low	30.8	Very low	68 Å²	68	111.6 Å²	111.6	70%	0.701	79%	0.792	S	S	*	*			cis	112	133.7	5.6	0	0	0	0	0	112.7
926	L	30.1	Very low	31	Very low	179 Å²	179	116.6 Å²	116.6	94%	0.937	81%	0.805	S	S	*	*			cis	-137.3	159.5	1.5	-57	105.4	0	0	0	110
927	G	28.9	Very low	31	Very low	77 Å²	77	112.4 Å²	112.4	79%	0.794	79%	0.792	S	S	*	*			cis	115	135.1	7.3	0	0	0	0	0	111.6
928	A	29.9	Very low	32	Very low	108 Å²	108	115.5 Å²	115.5	89%	0.893	80%	0.8	S	S	*	*			cis	-111.6	-137.7	4.9	0	0	0	0	0	111.5
929	G	29.3	Very low	31	Very low	74 Å²	74	113.1 Å²	113.1	76%	0.763	80%	0.797	S	S	*	*			cis	158.9	168	2.2	0	0	0	0	0	110.1
930	M	30.6	Very low	32.1	Very low	189 Å²	189	111.4 Å²	111.4	93%	0.931	80%	0.795	S	S	*	*			cis	-168.8	170.6	-13.8	-164.5	164.9	-179.8	0	0	109.7
931	A	29.1	Very low	32.2	Very low	86 Å²	86	113.6 Å²	113.6	71%	0.711	80%	0.796	S	S	*	*			trans	72.3	144.5	174.6	0	0	0	0	0	117.5
932	T	28.8	Very low	32	Very low	142 Å²	142	121.5 Å²	121.5	87%	0.871	80%	0.802	S	S	*	*			cis	-156.8	156.3	-12.7	14	0	0	0	0	109.2
933	G	26.9	Very low	31.9	Very low	70 Å²	70	124.6 Å²	124.6	72%	0.722	80%	0.8	S	S	*	*			trans	-101.4	-152	173.1	0	0	0	0	0	113.3
934	P	49.3	Very low	31.7	Very low	112 Å²	112	122.4 Å²	122.4	73%	0.727	79%	0.788	S	S	*	*			cis	-144.5	-162.3	-3.4	41.3	-19.7	0	0	0	115.8
935	D	30.3	Very low	31.6	Very low	135 Å²	135	125 Å²	125	72%	0.722	79%	0.79	S	S	*	*			trans	89.2	139.3	146.3	-70.3	-11.2	0	0	0	126
936	L	29.7	Very low	31.7	Very low	162 Å²	162	128.9 Å²	128.9	85%	0.848	79%	0.794	S	S	*	*			trans	21.8	146.9	154.4	-69	79.3	0	0	0	121.1
937	G	27.8	Very low	32.5	Very low	67 Å²	67	125.1 Å²	125.1	69%	0.691	78%	0.781	S	S	*	*			cis	-177.3	-156.4	29.5	0	0	0	0	0	114.7
938	P	45.3	Very low	32.6	Very low	132 Å²	132	129.5 Å²	129.5	86%	0.857	79%	0.785	S	S	*	*			trans	-112	178.6	-152.2	42.2	-37.4	0	0	0	118.2
939	G	25.3	Very low	32.6	Very low	67 Å²	67	127.4 Å²	127.4	69%	0.691	77%	0.773	S	S	*	*			trans	-88	-145.9	161.3	0	0	0	0	0	112.6
940	P	54	Low	32.6	Very low	115 Å²	115	130.4 Å²	130.4	75%	0.747	78%	0.777	S	S	*	*			cis	-139.9	-171.9	-9.7	44.6	-26.9	0	0	0	115.2
941	Q	31.9	Very low	32.6	Very low	181 Å²	181	128 Å²	128	85%	0.846	77%	0.768	S	S	*	*			trans	58.2	134.5	153.4	-74.4	-179.9	-17.1	0	0	123.4
942	R	25.4	Very low	32.5	Very low	239 Å²	239	128.9 Å²	128.9	90%	0.902	77%	0.768	S	S	*	*			trans	163.3	164.5	142.8	-95.1	-179.9	172.4	-178.5	-1.7	110.3
943	L	24.9	Very low	32.3	Very low	143 Å²	143	127.3 Å²	127.3	75%	0.749	77%	0.77	S	S	*	*			cis	-161.3	170.9	-44	-143.6	94.2	0	0	0	108.9
944	L	27.1	Very low	32.3	Very low	133 Å²	133	129.3 Å²	129.3	70%	0.696	77%	0.773	S	S	*	*			trans	-29.4	160.6	170.5	-82.9	63	0	0	0	118.2
945	D	28.2	Very low	31.3	Very low	147 Å²	147	129.6 Å²	129.6	79%	0.786	78%	0.778	S	S	*	*			cis	-160.5	179.6	21.2	-116.5	-21.9	0	0	0	114.7
946	D	32	Very low	31.5	Very low	148 Å²	148	130.9 Å²	130.9	79%	0.791	79%	0.785	S	S	*	*			trans	-68.5	-175.9	173	-110.6	-41.2	0	0	0	114.6
947	P	48.2	Very low	32	Very low	101 Å²	101	129 Å²	129	66%	0.656	78%	0.782	S	S	*	*			cis	-155.8	175.9	31.5	46.1	-24.1	0	0	0	121.9
948	L	31.1	Very low	32.5	Very low	169 Å²	169	131.6 Å²	131.6	89%	0.885	79%	0.787	S	S	*	*			trans	60.3	140.1	149.8	-69.6	157.5	0	0	0	121.4
949	G	28.7	Very low	32.1	Very low	63 Å²	63	129.7 Å²	129.7	65%	0.649	78%	0.782	S	S	*	*			cis	163.7	174.6	-7.3	0	0	0	0	0	113.8
950	V	30.2	Very low	32.8	Very low	137 Å²	137	132.2 Å²	132.2	83%	0.83	79%	0.786	S	S	*	*			trans	75.5	132.4	162.6	-179.5	0	0	0	0	117.1
951	N	30.2	Very low	32.4	Very low	139 Å²	139	132.3 Å²	132.3	74%	0.743	79%	0.787	S	S	*	*			cis	-155.5	156.6	-2.3	-129.7	-1.3	0	0	0	115.4
952	S	26.6	Very low	33.1	Very low	104 Å²	104	129.4 Å²	129.4	73%	0.727	78%	0.784	S	S	*	*			trans	41.5	119.6	147.8	66	0	0	0	0	124
953	A	25.3	Very low	33.2	Very low	110 Å²	110	126.3 Å²	126.3	91%	0.909	78%	0.781	S	S	*	*				-170.1	163.5	123.6	0	0	0	0	0	112
954	S	27.4	Very low	33.9	Very low	112 Å²	112	124.8 Å²	124.8	78%	0.783	78%	0.78	S	S	*	*			trans	-100.2	140.7	-178.6	55.6	0	0	0	0	114.2
955	S	27.8	Very low	33.9	Very low	118 Å²	118	123 Å²	123	83%	0.825	79%	0.785	S	S	*	*			trans	178.5	155.9	141.7	38.1	0	0	0	0	112.9
956	N	34.5	Very low	34	Very low	162 Å²	162	126.2 Å²	126.2	87%	0.866	79%	0.792	S	S	*	*			trans	-94.1	145.1	173.5	-65.5	-23.5	0	0	0	111.4
957	P	39.8	Very low	33.8	Very low	121 Å²	121	128.1 Å²	128.1	79%	0.786	80%	0.796	S	S	*	*			trans	-86	163.3	153.7	-10.9	29.7	0	0	0	112.3
958	P	38.8	Very low	32.8	Very low	123 Å²	123	127.9 Å²	127.9	80%	0.799	80%	0.803	S	S	*	*			trans	-112.2	167.8	-154	41.1	-35.3	0	0	0	117
959	A	37	Very low	33	Very low	92 Å²	92	125.6 Å²	125.6	76%	0.76	80%	0.798	S	S	*	*			trans	-93.5	162.3	159.3	0	0	0	0	0	111.2
960	P	40.1	Very low	33.2	Very low	119 Å²	119	128.6 Å²	128.6	77%	0.773	81%	0.806	S	S	*	*				-151.2	-178.6	120.6	39.6	-24.4	0	0	0	113.7
961	P	45.7	Very low	33.4	Very low	117 Å²	117	126.4 Å²	126.4	76%	0.76	80%	0.802	S	S	*	*			cis	-125	171.3	-33.4	28.8	-9.7	0	0	0	113.4
962	P	45.3	Very low	33.8	Very low	120 Å²	120	125.5 Å²	125.5	78%	0.779	80%	0.804	S	S	*	*			trans	-112	176.8	-179.5	42	-34.1	0	0	0	114.4
963	M	29.1	Very low	34.5	Very low	174 Å²	174	125.6 Å²	125.6	86%	0.857	80%	0.802	S	S	*	*			trans	165.3	158.9	146.8	-88	-95.7	-76	0	0	110.5
964	P	39.7	Very low	34.6	Very low	112 Å²	112	132 Å²	132	73%	0.727	80%	0.803	S	S	*	*			cis	-124.7	-178.7	-38.4	36.7	-20.9	0	0	0	112.4
965	A	26.6	Very low	34.5	Very low	96 Å²	96	132 Å²	132	79%	0.793	80%	0.803	S	S	*	*			trans	-107.2	170.9	178.4	0	0	0	0	0	113.3
966	F	29	Very low	34.3	Very low	213 Å²	213	135.8 Å²	135.8	93%	0.934	81%	0.805	S	S	*	*			trans	-120	135.9	168.2	-117.3	-83.9	0	0	0	109.8
967	E	28.6	Very low	33.9	Very low	189 Å²	189	134.9 Å²	134.9	88%	0.883	80%	0.799	S	S	*	*			trans	-96.1	159.2	177.9	-67.6	-173.1	112.7	0	0	112.8
968	A	28.4	Very low	33.3	Very low	95 Å²	95	137.6 Å²	137.6	79%	0.785	80%	0.801	S	S	*	*			trans	-149.3	127.5	169.4	0	0	0	0	0	111.7
969	P	33.4	Very low	32.5	Very low	122 Å²	122	136.5 Å²	136.5	79%	0.792	80%	0.797	S	S	*	*			trans	-108.3	-173.2	173.2	45.3	-36.7	0	0	0	110.8
970	P	33.5	Very low	31.9	Very low	125 Å²	125	138.2 Å²	138.2	81%	0.812	80%	0.802	S	S	*	*				-127.5	171.4	-103.8	26.3	-2.3	0	0	0	116.1
971	A	33.7	Very low	31.2	Very low	91 Å²	91	137.1 Å²	137.1	75%	0.752	80%	0.797	S	S	*	*			trans	-96.4	159.9	166.7	0	0	0	0	0	110.6
972	P	39.8	Very low	30.3	Very low	121 Å²	121	140.3 Å²	140.3	79%	0.786	80%	0.801	S	S	*	*				-152.1	-151.3	71	45	-23.2	0	0	0	111.8
973	P	41	Very low	29.4	Very low	105 Å²	105	140.6 Å²	140.6	68%	0.682	80%	0.8	S	S	*	*			cis	-137.1	149.1	-9	38.3	-18.5	0	0	0	119.1
974	R	26.8	Very low	29.3	Very low	245 Å²	245	143 Å²	143	93%	0.925	80%	0.8	S	S	*	*			trans	37.4	129.9	135.5	-59.1	177.2	174.5	169.7	-1.5	122.1
975	S	25.3	Very low	28.7	Very low	112 Å²	112	144.4 Å²	144.4	78%	0.783	80%	0.8	S	S	*	*				-157.4	133.1	126.9	41.3	0	0	0	0	114.9
976	F	25.1	Very low	28.6	Very low	197 Å²	197	145 Å²	145	86%	0.864	80%	0.797	S	S	*	*			trans	43.4	122.2	153.9	-75.1	-87.1	0	0	0	125.1
977	L	24.7	Very low	28.5	Very low	144 Å²	144	143.1 Å²	143.1	75%	0.754	79%	0.791	S	S	*	*			trans	-18.2	157.7	130.4	-60.4	154.3	0	0	0	115
978	Q	28.1	Very low	28.4	Very low	177 Å²	177	141 Å²	141	83%	0.827	78%	0.781	S	S	*	*			cis	-165.5	158.1	40.2	-162.9	164.2	-41.5	0	0	112
979	S	22.3	Very low	28.3	Very low	100 Å²	100	141.4 Å²	141.4	70%	0.699	78%	0.777	S	S	*	*			trans	-85.3	142.2	172.1	177.8	0	0	0	0	112.5
980	C	23.8	Very low	28.1	Very low	129 Å²	129	146.6 Å²	146.6	87%	0.872	78%	0.781	S	S	*	*			trans	-156.5	146.3	130.8	-102.8	0	0	0	0	112
981	S	26.1	Very low	28	Very low	95 Å²	95	151.2 Å²	151.2	66%	0.664	78%	0.782	S	S	*	*			trans	-91.9	158.9	177.1	51.1	0	0	0	0	111.8
982	H	27	Very low	27.8	Very low	184 Å²	184	155 Å²	155	85%	0.852	79%	0.788	S	S	*	*				-161.4	145.9	127.8	-109.8	-76.2	0	0	0	110.7
983	V	25.2	Very low	27.2	Very low	126 Å²	126	158.4 Å²	158.4	76%	0.764	79%	0.793	S	S	*	*			trans	-134.6	159.6	-179	179.1	0	0	0	0	108.3
984	R	28	Very low	26.6	Very low	225 Å²	225	158.4 Å²	158.4	85%	0.849	80%	0.796	S	S	*	*			trans	97.2	138.7	174.6	-57.7	178.7	178.8	-171.2	-0.2	113.9
985	I	27.2	Very low	26.7	Very low	142 Å²	142	154.7 Å²	154.7	73%	0.728	79%	0.794	S	S	*	*			cis	-152.3	170.4	-3.8	-119.9	163	0	0	0	110.5
986	C	24	Very low	26.9	Very low	109 Å²	109	160.3 Å²	160.3	74%	0.736	80%	0.798	S	S	*	*			trans	-23.5	156.2	171.9	-54.6	0	0	0	0	117.8
987	Q	26.1	Very low	27.6	Very low	172 Å²	172	156.8 Å²	156.8	80%	0.804	80%	0.795	S	S	*	*				-169.4	156.6	59.2	-158.6	167.7	0.4	0	0	115.4
988	E	27.9	Very low	27.9	Very low	145 Å²	145	153.5 Å²	153.5	68%	0.678	79%	0.788	S	S	*	*			trans	49.3	115.5	159.2	-98.5	34	-112.7	0	0	125.3
989	C	25.8	Very low	28.3	Very low	104 Å²	104	150.7 Å²	150.7	70%	0.703	78%	0.783	S	S	*	*			trans	49.7	105.3	131.9	-68.2	0	0	0	0	122.4
990	R	28.6	Very low	28.6	Very low	230 Å²	230	153.6 Å²	153.6	87%	0.868	79%	0.79	S	S	*	*				-169.3	144.5	119.2	-109.6	165.4	179.2	175.8	0.8	114.2
991	R	31.9	Very low	29	Very low	223 Å²	223	153.2 Å²	153.2	84%	0.842	78%	0.784	S	S	*	*			trans	46.8	83.9	160.5	-64.9	175.9	174.3	161.6	-3.7	115
992	I	29.8	Very low	30	Very low	171 Å²	171	154.3 Å²	154.3	88%	0.877	79%	0.789	S	S	*	*				48.3	118	72.8	-55.1	-178.1	0	0	0	112.3
993	Q	27.4	Very low	31.1	Very low	191 Å²	191	150.8 Å²	150.8	89%	0.893	78%	0.782	S	S	*	*			trans	-73.3	153.6	-175.7	-69.4	159.1	-61.4	0	0	113.3
994	S	26.8	Very low	31.9	Very low	105 Å²	105	150.5 Å²	150.5	73%	0.734	78%	0.783	S	S	*	*			trans	-85	158.1	174.4	48.1	0	0	0	0	112.7
995	L	29.4	Very low	32.7	Very low	167 Å²	167	145.5 Å²	145.5	87%	0.874	78%	0.78	S	S	*	*			trans	71.1	74.4	160.2	-62.4	167	0	0	0	118.6
996	R	30.2	Very low	33.6	Very low	230 Å²	230	144.2 Å²	144.2	87%	0.868	78%	0.781	S	S	*	*				-35.9	159.9	125.4	-106.3	-176.9	-174.3	177	2.1	113.3
997	P	38.6	Very low	34.6	Very low	124 Å²	124	144.8 Å²	144.8	81%	0.805	78%	0.783	S	S	*	*				-139.9	159.7	51.7	39	-20.7	0	0	0	118.6
998	A	32	Very low	35.6	Very low	75 Å²	75	141.5 Å²	141.5	62%	0.62	78%	0.777	S	S	*	*			trans	-104.3	170.2	148	0	0	0	0	0	107
999	T	35.5	Very low	35.6	Very low	118 Å²	118	139.5 Å²	139.5	72%	0.724	78%	0.779	S	S	*	*				171.8	164.6	73.7	42.8	0	0	0	0	109.3
1000	L	29.7	Very low	35.6	Very low	160 Å²	160	139.3 Å²	139.3	84%	0.838	78%	0.779	S	S	*	*				-170.7	154.1	118.6	-100.6	163	0	0	0	112.5
1001	T	31.6	Very low	35.6	Very low	122 Å²	122	133.4 Å²	133.4	75%	0.748	77%	0.773	S	S	*	*			trans	-164.9	-173.5	-170.4	57.8	0	0	0	0	108.2
1002	P	47.1	Very low	35.4	Very low	117 Å²	117	127.7 Å²	127.7	76%	0.76	77%	0.767	S	S	*	*			cis	-124.1	-106.1	-17.7	20.4	6.6	0	0	0	115.9
1003	P	51.3	Low	35.4	Very low	110 Å²	110	124.6 Å²	124.6	71%	0.714	76%	0.76	S	S	*	*			trans	-128.2	179.3	-131.1	43.9	-23.9	0	0	0	116.6
1004	P	40.4	Very low	35.4	Very low	121 Å²	121	119.8 Å²	119.8	79%	0.786	75%	0.753	S	S	*	*				-155.2	-172.1	93.9	40	-18.3	0	0	0	116
1005	P	44.6	Very low	35.4	Very low	120 Å²	120	120.3 Å²	120.3	78%	0.779	76%	0.757	S	S	*	*			trans	-112.1	-144.7	-172.7	37.5	-21.4	0	0	0	117.2
1006	P	47.8	Very low	35.3	Very low	115 Å²	115	117.2 Å²	117.2	75%	0.747	75%	0.749	S	S	*	*				-105.4	-153.2	-120.9	42.4	-22.4	0	0	0	113.6
1007	P	44	Very low	35	Very low	120 Å²	120	111.7 Å²	111.7	78%	0.779	74%	0.744	S	S	*	*			cis	-128	-96.5	1.2	24.5	3.2	0	0	0	122.9
1008	P	46.7	Very low	34.5	Very low	104 Å²	104	110.6 Å²	110.6	68%	0.675	74%	0.74	S	S	*	*				-131.6	-178.9	-125.7	43.7	-26.2	0	0	0	120.7
1009	S	27.5	Very low	34.3	Very low	103 Å²	103	118.9 Å²	118.9	72%	0.72	76%	0.755	S	S	*	*			trans	87	128.5	143.4	62.7	0	0	0	0	125.2
1010	S	27.5	Very low	34	Very low	100 Å²	100	120.9 Å²	120.9	70%	0.699	76%	0.759	S	S	*	*			trans	63.4	121.9	134.9	64.9	0	0	0	0	126
1011	S	27.4	Very low	35.2	Very low	106 Å²	106	118.5 Å²	118.5	74%	0.741	75%	0.754	S	S	*	*				71	141.1	129	64.1	0	0	0	0	125.6
1012	S	29.1	Very low	36	Very low	103 Å²	103	118.5 Å²	118.5	72%	0.72	76%	0.756	S	S	*	*			trans	81.9	122.2	139.4	56.7	0	0	0	0	124.5
1013	S	28.6	Very low	35.1	Very low	106 Å²	106	117.8 Å²	117.8	74%	0.741	75%	0.753	S	S	*	*			trans	73.7	111.1	130.3	65.5	0	0	0	0	124.7
1014	A	27.8	Very low	34	Very low	89 Å²	89	120.6 Å²	120.6	74%	0.736	76%	0.762	S	S	*	*				82.3	143.8	116.4	0	0	0	0	0	123.8
1015	S	26.8	Very low	33.4	Very low	116 Å²	116	119.5 Å²	119.5	81%	0.811	76%	0.763	S	S	*	*			trans	69.1	152.1	156.7	71.1	0	0	0	0	119
1016	S	26.7	Very low	32.6	Very low	103 Å²	103	122.2 Å²	122.2	72%	0.72	77%	0.767	S	S	*	*			cis	-169.6	177.9	-23	53	0	0	0	0	110.5
1017	C	24.9	Very low	31.7	Very low	113 Å²	113	122.6 Å²	122.6	76%	0.764	77%	0.772	S	S	*	*			trans	70	127.8	171.9	-60.5	0	0	0	0	116.4
1018	S	27.8	Very low	30.9	Very low	102 Å²	102	119.9 Å²	119.9	71%	0.713	77%	0.767	S	S	*	*			cis	93	112.7	23.3	86.1	0	0	0	0	116.8
1019	R	27	Very low	30.1	Very low	249 Å²	249	122.9 Å²	122.9	94%	0.94	77%	0.771	S	S	*	*			trans	-169.8	166.3	134.3	-104.6	167.9	-164.9	-150.8	1.8	111.5
1020	I	28.9	Very low	30.2	Very low	159 Å²	159	125.2 Å²	125.2	82%	0.815	77%	0.77	S	S	*	*			trans	-119.6	-163	-166.3	-26.8	179.6	0	0	0	110
1021	P	55.9	Low	30.2	Very low	110 Å²	110	128.5 Å²	128.5	71%	0.714	77%	0.774	S	S	*	*				-103.1	-157.3	-129.4	39.5	-19.7	0	0	0	112.9
1022	P	48.4	Very low	30.3	Very low	122 Å²	122	134 Å²	134	79%	0.792	78%	0.779	S	S	*	*				-145.1	-178.7	75.7	37.3	-16.6	0	0	0	116.4
1023	S	28.1	Very low	30.4	Very low	102 Å²	102	138.3 Å²	138.3	71%	0.713	79%	0.787	S	S	*	*			trans	-79.7	168.3	179.8	51.8	0	0	0	0	115.1
1024	L	28.7	Very low	30.4	Very low	170 Å²	170	139.9 Å²	139.9	89%	0.89	79%	0.787	S	S	*	*				-178.6	167.2	120.3	-103.8	154.1	0	0	0	115.8
1025	A	26.9	Very low	31.3	Very low	97 Å²	97	140.7 Å²	140.7	80%	0.802	79%	0.785	S	S	*	*			trans	86.6	140.1	160	0	0	0	0	0	121
1026	M	27.6	Very low	31.4	Very low	178 Å²	178	143 Å²	143	88%	0.877	78%	0.783	S	S	*	*			trans	-134.6	172.2	177	-76.4	179.4	63.5	0	0	110.6
1027	S	28.7	Very low	31.6	Very low	122 Å²	122	146.7 Å²	146.7	85%	0.853	79%	0.788	S	S	*	*			trans	101.2	154.1	141.9	81.1	0	0	0	0	120.7
1028	G	27	Very low	32.4	Very low	64 Å²	64	146.4 Å²	146.4	66%	0.66	79%	0.785	S	S	*	*			trans	107.3	106.8	-178.8	0	0	0	0	0	112.7
1029	H	31.1	Very low	32.4	Very low	167 Å²	167	149.6 Å²	149.6	77%	0.773	79%	0.793	S	S	*	*				69	136.6	53.6	-68.8	4.5	0	0	0	113.6
1030	H	29.3	Very low	32.4	Very low	151 Å²	151	145.5 Å²	145.5	70%	0.699	78%	0.784	S	S	*	*			cis	-141.9	-167.4	3.5	-95	-37.5	0	0	0	108.7
1031	H	28.3	Very low	32.4	Very low	169 Å²	169	149 Å²	149	78%	0.782	79%	0.789	S	S	*	*			cis	-150.9	-121.4	13.5	-153.7	-8	0	0	0	113.7
1032	R	29.1	Very low	31.1	Very low	221 Å²	221	152.1 Å²	152.1	83%	0.834	79%	0.793	S	S	*	*			trans	-148.9	151.1	176.3	-83.2	178.4	167	170.4	-5.3	109.9
1033	H	30.1	Very low	30.2	Very low	195 Å²	195	155.6 Å²	155.6	90%	0.903	80%	0.799	S	S	*	*				-171.8	158.4	121.1	-111.2	-79.6	0	0	0	111.9
1034	N	28.7	Very low	30.2	Very low	139 Å²	139	154.3 Å²	154.3	74%	0.743	80%	0.801	S	S	*	*			trans	-150	143.9	-178.3	-174.1	15.2	0	0	0	108.8
1035	P	47	Very low	30.2	Very low	106 Å²	106	152 Å²	152	69%	0.688	80%	0.799	S	S	*	*			trans	-146.6	138.5	132.2	32.7	-14.8	0	0	0	116.7
1036	H	29	Very low	30.4	Very low	165 Å²	165	156.8 Å²	156.8	76%	0.764	81%	0.808	S	S	*	*			trans	43.9	104.2	145.2	-62.4	-80.7	0	0	0	122.3
1037	H	31.1	Very low	30.5	Very low	179 Å²	179	153.9 Å²	153.9	83%	0.829	81%	0.805	S	S	*	*				33.4	158.9	115.8	-80.9	-53.6	0	0	0	123.2
1038	P	42.2	Very low	30.7	Very low	107 Å²	107	155.9 Å²	155.9	70%	0.695	81%	0.805	S	S	*	*			cis	-134.1	169.7	-17	39	-23.6	0	0	0	114.2
1039	L	26.8	Very low	31.1	Very low	169 Å²	169	158.7 Å²	158.7	89%	0.885	81%	0.812	S	S	*	*			trans	-166.2	158.9	149.9	-111.4	163.6	0	0	0	112.1
1040	H	27.4	Very low	31.1	Very low	164 Å²	164	162.6 Å²	162.6	76%	0.759	82%	0.82	S	S	*	*			trans	-73.1	151	-179.8	-74.8	-107	0	0	0	112.9
1041	Y	29.4	Very low	31.5	Very low	231 Å²	231	163.1 Å²	163.1	91%	0.906	83%	0.827	S	S	*	*			trans	-146.7	151.2	141.3	-109.6	-76.3	0	0	0	112.2
1042	H	28.4	Very low	32.2	Very low	176 Å²	176	160.3 Å²	160.3	82%	0.815	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-80.2	142.9	-178.7	-75.2	-103.9	0	0	0	112.6
1043	H	29.8	Very low	32.9	Very low	196 Å²	196	155.3 Å²	155.3	91%	0.907	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-84.9	116.9	151.2	-95.2	-79.3	0	0	0	109.6
1044	G	27.1	Very low	33.3	Very low	74 Å²	74	151.5 Å²	151.5	76%	0.763	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-83.5	130.9	166.7	0	0	0	0	0	110.4
1045	S	29.1	Very low	34	Very low	121 Å²	121	150.5 Å²	150.5	85%	0.846	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-86.6	145.5	172.7	50	0	0	0	0	111.2
1046	M	30.7	Very low	33.8	Very low	199 Å²	199	150.9 Å²	150.9	98%	0.98	82%	0.816	S	S	*	*			trans	-124.9	148	162.6	-109.8	-176	170.5	0	0	109.5
1047	S	30.1	Very low	34.1	Very low	117 Å²	117	149.1 Å²	149.1	82%	0.818	82%	0.819	S	S	*	*			trans	-113.6	146.3	-154.9	43.8	0	0	0	0	113.9
1048	L	32.7	Very low	34.1	Very low	164 Å²	164	148.2 Å²	148.2	86%	0.859	82%	0.819	S	S	*	*			trans	-104.5	153.7	161.4	-80.4	164.9	0	0	0	109.6
1049	P	36.1	Very low	33.5	Very low	123 Å²	123	147.9 Å²	147.9	80%	0.799	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-73.3	146.4	-167.9	28.6	-35.4	0	0	0	113.5
1050	R	31.9	Very low	33.8	Very low	248 Å²	248	146.8 Å²	146.8	94%	0.936	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-84.3	136.2	173.3	-71.6	-177.6	173.1	-174.3	-3.1	111.3
1051	L	37.4	Very low	33.9	Very low	162 Å²	162	145.7 Å²	145.7	85%	0.848	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-77.6	153.4	160.5	-74.4	162.9	0	0	0	110.5
1052	P	41.3	Very low	34.1	Very low	111 Å²	111	145.3 Å²	145.3	72%	0.721	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-74	152.7	175.5	31.4	-35.1	0	0	0	112.2
1053	P	43.7	Very low	34.1	Very low	116 Å²	116	141.9 Å²	141.9	75%	0.753	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-76	157.1	177.7	32.5	-35.8	0	0	0	112.9
1054	P	40	Very low	34.2	Very low	114 Å²	114	139.7 Å²	139.7	74%	0.74	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-72.5	157.9	174.8	31.5	-35.9	0	0	0	112.6
1055	P	42	Very low	34.4	Very low	118 Å²	118	141.6 Å²	141.6	77%	0.766	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-70.9	153.2	175.6	30.6	-35.4	0	0	0	112.5
1056	P	43.9	Very low	34.5	Very low	115 Å²	115	143.6 Å²	143.6	75%	0.747	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-73.3	158.5	179.9	31.2	-36	0	0	0	113.1
1057	P	34	Very low	34.3	Very low	128 Å²	128	137.7 Å²	137.7	83%	0.831	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-69.5	145.8	178.7	29.7	-35.6	0	0	0	112.5
1058	I	32.2	Very low	34.2	Very low	159 Å²	159	135.6 Å²	135.6	82%	0.815	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-80	124.3	178.3	-63.3	172.5	0	0	0	109.8	T1060	I1058-T1060 PolarHBondContact O-N 3.26Å
1059	S	29.1	Very low	34	Very low	101 Å²	101	134.3 Å²	134.3	71%	0.706	80%	0.802	S	S	*	*			trans	-76.4	115.7	172	51.7	0	0	0	0	111.3	D1061	S1059-D1061 PolarHBondContact O-N 3.47Å
1060	T	33.3	Very low	33.6	Very low	145 Å²	145	135.5 Å²	135.5	89%	0.89	81%	0.807	S	S	*	*			trans	-81.6	92.2	166.6	52.2	0	0	0	0	109.5	I1058	I1058-T1060 PolarHBondContact O-N 3.26Å
1061	D	29.5	Very low	33.5	Very low	141 Å²	141	128.8 Å²	128.8	75%	0.754	80%	0.798	S	S	*	*			trans	-112.3	161.7	175.8	-139.4	-31.3	0	0	0	112.1	S1059	S1059-D1061 PolarHBondContact O-N 3.47Å
1062	R	33.7	Very low	33.9	Very low	224 Å²	224	126.9 Å²	126.9	85%	0.845	80%	0.795	S	S	*	*			trans	-72.2	146.2	-169.4	-67.8	177.5	167.6	102.9	-8.2	113.1
1063	A	29.4	Very low	33.3	Very low	103 Å²	103	129.5 Å²	129.5	85%	0.851	80%	0.803	S	S	*	*			trans	-141.5	97.8	161.4	0	0	0	0	0	109.9
1064	D	30.2	Very low	32.7	Very low	151 Å²	151	135.3 Å²	135.3	81%	0.807	81%	0.809	S	S	*	*			trans	-116.3	151.5	166.1	-94.9	-52.4	0	0	0	108.2
1065	S	32	Very low	32.1	Very low	114 Å²	114	133.5 Å²	133.5	80%	0.797	80%	0.804	S	S	*	*			trans	68.3	149.4	-176.6	-54.9	0	0	0	0	115.1
1066	D	31	Very low	31.6	Very low	163 Å²	163	133.6 Å²	133.6	87%	0.872	80%	0.803	S	S	*	*			cis	-148.8	164.2	16.8	-143.6	-27.3	0	0	0	113.5
1067	G	27.3	Very low	30.9	Very low	74 Å²	74	135.8 Å²	135.8	76%	0.763	81%	0.808	S	S	*	*			trans	120.8	126.1	160	0	0	0	0	0	118
1068	G	26.6	Very low	30.9	Very low	74 Å²	74	140.6 Å²	140.6	76%	0.763	81%	0.81	S	S	*	*			trans	140.5	31.4	161	0	0	0	0	0	119.5
1069	T	29.5	Very low	31.2	Very low	136 Å²	136	139.3 Å²	139.3	83%	0.834	81%	0.812	S	S	*	*			trans	-31.4	133.4	175.3	51.8	0	0	0	0	118.2
1070	T	28.8	Very low	31.3	Very low	148 Å²	148	138.5 Å²	138.5	91%	0.908	81%	0.811	S	S	*	*			trans	-164	147.4	130.6	8.7	0	0	0	0	112.1
1071	S	28.7	Very low	32.6	Very low	107 Å²	107	137.2 Å²	137.2	75%	0.748	81%	0.806	S	S	*	*			trans	-139.4	161.6	176.7	70.1	0	0	0	0	109.3
1072	P	45.8	Very low	34	Very low	122 Å²	122	136.2 Å²	136.2	79%	0.792	81%	0.806	S	S	*	*				-147.2	179.5	78.5	39	-20.3	0	0	0	115.6
1073	L	29.7	Very low	34.3	Very low	166 Å²	166	131.1 Å²	131.1	87%	0.869	80%	0.803	S	S	*	*			trans	-79.8	159.9	171.1	-53.4	96	0	0	0	112.1
1074	R	29.7	Very low	34.7	Very low	238 Å²	238	137.3 Å²	137.3	90%	0.898	80%	0.804	S	S	*	*				164.1	118.9	106.3	-171.6	168.5	-165.6	176.7	4.9	115.7
1075	A	28.3	Very low	35.8	Very low	76 Å²	76	135.5 Å²	135.5	63%	0.628	80%	0.8	S	S	*	*			trans	71.2	140.7	143.6	0	0	0	0	0	124.5
1076	T	30.7	Very low	36.4	Very low	120 Å²	120	135.4 Å²	135.4	74%	0.736	80%	0.797	S	S	*	*			trans	60.9	107.4	143.4	48.1	0	0	0	0	121.8
1077	N	29	Very low	37.6	Very low	161 Å²	161	132.2 Å²	132.2	86%	0.861	79%	0.785	S	S	*	*				-166.2	155.4	91.1	-96.1	-26.8	0	0	0	113.8
1078	R	35.4	Very low	37.8	Very low	229 Å²	229	134.5 Å²	134.5	86%	0.864	78%	0.784	S	S	*	*			trans	-110.8	158.5	164.1	-80.5	-174	173	-178.4	-1.7	108.8
1079	P	37.8	Very low	38	Very low	133 Å²	133	140.3 Å²	140.3	86%	0.864	79%	0.789	S	S	*	*				-134.2	-174.4	98.7	33.9	-20.4	0	0	0	113.2
1080	A	31.9	Very low	38.2	Very low	84 Å²	84	138.1 Å²	138.1	69%	0.694	78%	0.784	S	S	*	*			trans	-143.6	-163.5	-177.2	0	0	0	0	0	111
1081	P	59	Low	39	Very low	118 Å²	118	136.6 Å²	136.6	77%	0.766	78%	0.777	S	S	*	*				-114.2	-158	-119.8	41.4	-21.8	0	0	0	112.1
1082	P	58.6	Low	39.1	Very low	119 Å²	119	138.2 Å²	138.2	77%	0.773	78%	0.783	S	S	*	*			cis	-117.3	-119.2	-2.6	32.9	-7.8	0	0	0	112.7
1083	P	40.9	Very low	38.5	Very low	118 Å²	118	142.9 Å²	142.9	77%	0.766	79%	0.786	S	S	*	*			cis	-120.6	-165.8	14.3	44.5	-29.9	0	0	0	115.9
1084	R	38.2	Very low	39.1	Very low	233 Å²	233	140.2 Å²	140.2	88%	0.879	78%	0.779	S	S	*	*			trans	-158.4	179.2	170.5	-99.9	-169.1	-176.9	-167.6	3.4	106.7
1085	P	51.9	Low	39.7	Very low	113 Å²	113	134.8 Å²	134.8	73%	0.734	77%	0.774	S	S	*	*			cis	-116.5	-123.4	-12	28.1	-2.6	0	0	0	108.2
1086	P	46.3	Very low	39.9	Very low	112 Å²	112	138.1 Å²	138.1	73%	0.727	79%	0.787	S	S	*	*			cis	-124	-115.3	-25.2	27.4	-0.1	0	0	0	116
1087	P	55.1	Low	39.9	Very low	96 Å²	96	139.7 Å²	139.7	62%	0.623	79%	0.791	S	S	*	*				-143.9	179.5	-120.7	47.8	-28.1	0	0	0	120.7
1088	T	32.6	Very low	40	Very low	121 Å²	121	139.4 Å²	139.4	74%	0.742	79%	0.788	S	S	*	*			trans	72.5	139.6	161.5	69.7	0	0	0	0	117.6
1089	K	30.2	Very low	39.8	Very low	197 Å²	197	137.1 Å²	137.1	86%	0.857	79%	0.792	S	S	*	*			cis	-160.9	165.2	49.1	-79.1	-179.5	175.2	174.8	0	113.9
1090	A	32.7	Very low	39.4	Very low	90 Å²	90	134.4 Å²	134.4	74%	0.744	79%	0.788	S	S	*	*			trans	-112.4	-177.3	152.6	0	0	0	0	0	108.3
1091	P	46.1	Very low	39.3	Very low	115 Å²	115	133.8 Å²	133.8	75%	0.747	79%	0.79	S	S	*	*			cis	-133.8	-175.4	-2.5	44.2	-28.8	0	0	0	114.4
1092	T	31.5	Very low	38.1	Very low	142 Å²	142	136.4 Å²	136.4	87%	0.871	79%	0.792	S	S	*	*			trans	-163.5	149	143.4	15.3	0	0	0	0	112.7
1093	Y	32.5	Very low	36.9	Very low	220 Å²	220	137.3 Å²	137.3	86%	0.863	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-99.9	156.4	169.3	-82.3	-100.9	0	0	0	111.1
1094	P	42	Very low	36.6	Very low	110 Å²	110	137.3 Å²	137.3	71%	0.714	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-85.8	152.6	156	36	-31.9	0	0	0	111.6
1095	P	43.4	Very low	36.7	Very low	123 Å²	123	134.6 Å²	134.6	80%	0.799	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-95.5	144.4	177.3	36	-32.7	0	0	0	113.2
1096	T	32	Very low	36	Very low	147 Å²	147	135.7 Å²	135.7	90%	0.902	82%	0.824	S	S	*	*			trans	-154.4	127.3	154	11.4	0	0	0	0	108.5
1097	D	31.2	Very low	35.4	Very low	152 Å²	152	136.9 Å²	136.9	81%	0.813	83%	0.829	S	S	*	*			trans	-152.4	164.2	178.6	-153.4	-15.9	0	0	0	109.4
1098	L	30.9	Very low	34.3	Very low	155 Å²	155	139.2 Å²	139.2	81%	0.812	84%	0.84	S	S	*	*			trans	63.8	92.5	175.9	-61	171.4	0	0	0	117.9
1099	L	31.3	Very low	34.5	Very low	181 Å²	181	140.3 Å²	140.3	95%	0.948	85%	0.846	S	S	*	*				-145.2	136.6	113.8	-108.7	171.4	0	0	0	109.4
1100	G	28.7	Very low	34.7	Very low	76 Å²	76	136.8 Å²	136.8	78%	0.784	85%	0.845	S	S	*	*			trans	-81.4	155.7	-172.3	0	0	0	0	0	114.1
1101	G	29.7	Very low	34.8	Very low	71 Å²	71	139.9 Å²	139.9	73%	0.732	85%	0.852	S	S	*	*			trans	-102.4	-174	175.1	0	0	0	0	0	113.7
1102	H	33.4	Very low	34	Very low	173 Å²	173	141.6 Å²	141.6	80%	0.801	86%	0.859	S	S	*	*			trans	-165.2	140.1	163.2	-114.8	-72	0	0	0	111.7
1103	N	34.1	Very low	34.2	Very low	139 Å²	139	141.6 Å²	141.6	74%	0.743	86%	0.859	S	S	*	*			trans	68.6	149.7	156.9	-54.1	-15	0	0	0	117
1104	C	35.4	Very low	34.4	Very low	118 Å²	118	135.1 Å²	135.1	80%	0.797	86%	0.858	S	S	*	*			cis	-152.5	152.1	2.3	-135.1	0	0	0	0	111.6
1105	A	40.6	Very low	33.7	Very low	176 Å²	176	137.4 Å²	137.4	100%	1.455	87%	0.871	S	S	*	*			trans	55	0	169.4	0	0	0	0	0	116.6

Retrieved 1,105 of 1,105 residues in 1407 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).