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Beta-1,3-galactosyltransferase 4

Involved in GM1/GD1B/GA1 ganglioside biosynthesis.

AlphaFold DB , UniProt , Accession Q9Z0F0, Species MOUSE (Mus musculus, Mouse), Gene B3galt4, Length 371 aa.

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(Predicted Aligned Error values between residue pairs)

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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	62.6	Low	85.5	Confident	232 Å²	232	120.7 Å²	120.7	100%	1.143	60%	0.603	S	S	*	*				0	121.6	0	-75.3	176.6	156.5	0	0	108.7	L3	M1-L3 PolarHBondContact O-N 3.44Å
2	P	73.6	Confident	86	Confident	117 Å²	117	114.8 Å²	114.8	76%	0.76	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-61.6	137.5	172.8	26.3	-32.1	0	0	0	109.7	S4	P2-S4 PolarHBondContact O-N 3.3Å
3	L	75.9	Confident	86.5	Confident	79 Å²	79	111.7 Å²	111.7	41%	0.414	58%	0.577	S	S	.	*	P	Polyproline II helix	trans	-56.5	137	173.8	-74	159.6	0	0	0	109.4	M1 R7 R8 L11	M1-L3 PolarHBondContact O-N 3.44Å; L3-R7 HydrophobicContact CB-CB 4.32Å; L3-R7 HydrophobicContact CD2-CB 3.96Å; L3-R7 HydrophobicContact CD2-CG 4.5Å; L3-R8 HydrophobicContact CB-CG 3.84Å; L3-R8 PolarHBondContact O-NE 3.5Å; L3-R8 PolarHBondContact O-NH2 3.21Å; L3-L11 HydrophobicContact CD1-CD1 3.95Å
4	S	88.7	Confident	86.9	Confident	61 Å²	61	110 Å²	110	43%	0.427	57%	0.569	S	S	.	*	P	Polyproline II helix	trans	-56.6	150.9	171.7	64.6	0	0	0	0	110.2	P2 F6 R7 R8	P2-S4 PolarHBondContact O-N 3.3Å; S4-F6 PolarHBondContact O-N 3.05Å; S4-R7 PolarHBondContact O-N 3.03Å; S4-R7 PolarHBondContact OG-N 2.93Å; S4-R8 PolarHBondContact O-N 2.92Å
5	L	89.5	Confident	87	Confident	131 Å²	131	109.5 Å²	109.5	69%	0.686	57%	0.567	S	S	*	*	H	α-helix	trans	-50.8	-43	176.5	-178.7	68.7	0	0	0	110.8	R7 R8 V9	L5-R7 PolarHBondContact O-N 3.44Å; L5-R8 PolarHBondContact O-N 2.97Å; L5-V9 WeakPolarHBondContact O-CG2 3.39Å; L5-V9 PolarHBondContact O-N 3.35Å
6	F	90.5	Very high	87	Confident	156 Å²	156	110.1 Å²	110.1	68%	0.684	57%	0.57	S	S	*	*	H	α-helix	trans	-57.2	-47.4	176.1	-175.3	-98.8	0	0	0	113.1	S4 R8 V9 L10	S4-F6 PolarHBondContact O-N 3.05Å; F6-R8 VanDerWaalsContact C-N 3.33Å; F6-R8 PolarHBondContact O-N 3.46Å; F6-V9 PolarHBondContact O-N 2.91Å; F6-L10 WeakPolarHBondContact O-CB 3.29Å; F6-L10 PolarHBondContact O-N 2.94Å
7	R	90.4	Very high	86.8	Confident	158 Å²	158	108 Å²	108	60%	0.596	56%	0.563	S	S	*	*	H	α-helix	trans	-64.6	-36.6	177.2	-77.9	-176.2	-179.6	-177.2	1.1	112.3	L3 S4 L5 L11	L3-R7 HydrophobicContact CB-CB 4.32Å; L3-R7 HydrophobicContact CD2-CB 3.96Å; L3-R7 HydrophobicContact CD2-CG 4.5Å; S4-R7 PolarHBondContact O-N 3.03Å; S4-R7 PolarHBondContact OG-N 2.93Å; L5-R7 PolarHBondContact O-N 3.44Å; R7-L11 WeakPolarHBondContact O-CB 3.4Å; R7-L11 VanDerWaalsContact O-CG 3.29Å; R7-L11 WeakPolarHBondContact O-CG 3.41Å; R7-L11 PolarHBondContact O-N 3.2Å
8	R	90.9	Very high	86.5	Confident	139 Å²	139	106.8 Å²	106.8	53%	0.525	56%	0.556	S	S	.	*	H	α-helix	trans	-65	-45	175.7	-72.3	-175.7	-112.9	-176.4	-2.2	111.8	L3 S4 L5 F6 L11 A12	L3-R8 HydrophobicContact CB-CG 3.84Å; L3-R8 PolarHBondContact O-NE 3.5Å; L3-R8 PolarHBondContact O-NH2 3.21Å; S4-R8 PolarHBondContact O-N 2.92Å; L5-R8 PolarHBondContact O-N 2.97Å; F6-R8 VanDerWaalsContact C-N 3.33Å; F6-R8 PolarHBondContact O-N 3.46Å; R8-L11 PolarHBondContact O-N 2.89Å; R8-A12 WeakPolarHBondContact O-CB 3.44Å; R8-A12 PolarHBondContact O-N 2.9Å
9	V	92.1	Very high	86.2	Confident	83 Å²	83	105.3 Å²	105.3	50%	0.503	55%	0.548	S	S	.	.	H	α-helix	trans	-62.9	-45.6	176.1	173.6	0	0	0	0	110.8	L5 F6 L11 A12 V13	L5-V9 WeakPolarHBondContact O-CG2 3.39Å; L5-V9 PolarHBondContact O-N 3.35Å; F6-V9 PolarHBondContact O-N 2.91Å; V9-L11 PolarHBondContact O-N 3.36Å; V9-A12 PolarHBondContact O-N 2.87Å; V9-V13 HydrophobicContact CG1-CG2 4.41Å; V9-V13 WeakPolarHBondContact O-CG2 3.44Å; V9-V13 PolarHBondContact O-N 3.41Å
10	L	93.6	Very high	85.6	Confident	85 Å²	85	105.4 Å²	105.4	45%	0.445	54%	0.541	S	S	.	.	H	α-helix	trans	-60.4	-45	177.8	-176.6	66.9	0	0	0	112.1	F6 V13 L14	F6-L10 WeakPolarHBondContact O-CB 3.29Å; F6-L10 PolarHBondContact O-N 2.94Å; L10-V13 PolarHBondContact O-N 3.44Å; L10-L14 HydrophobicContact CG-CD1 4.13Å; L10-L14 WeakPolarHBondContact O-CB 3.33Å; L10-L14 WeakPolarHBondContact O-CG 3.22Å; L10-L14 PolarHBondContact O-N 3.45Å
11	L	93.1	Very high	84.9	Confident	87 Å²	87	102.4 Å²	102.4	46%	0.455	53%	0.528	S	S	.	.	H	α-helix	trans	-62.7	-41.5	176.3	-76.5	167.1	0	0	0	111.9	L3 R7 R8 V9 L14 L15	L3-L11 HydrophobicContact CD1-CD1 3.95Å; R7-L11 WeakPolarHBondContact O-CB 3.4Å; R7-L11 VanDerWaalsContact O-CG 3.29Å; R7-L11 WeakPolarHBondContact O-CG 3.41Å; R7-L11 PolarHBondContact O-N 3.2Å; R8-L11 PolarHBondContact O-N 2.89Å; V9-L11 PolarHBondContact O-N 3.36Å; L11-L14 PolarHBondContact O-N 2.98Å; L11-L15 WeakPolarHBondContact O-CB 3.45Å; L11-L15 PolarHBondContact O-N 3.24Å
12	A	91.4	Very high	85.3	Confident	50 Å²	50	94.8 Å²	94.8	41%	0.413	49%	0.491	S	S	.	.	H	α-helix	trans	-63.9	-43	176.4	0	0	0	0	0	111.9	R8 V9 L15 L16	R8-A12 WeakPolarHBondContact O-CB 3.44Å; R8-A12 PolarHBondContact O-N 2.9Å; V9-A12 PolarHBondContact O-N 2.87Å; A12-L15 PolarHBondContact O-N 2.83Å; A12-L16 WeakPolarHBondContact O-CB 3.28Å; A12-L16 WeakPolarHBondContact O-CG 3.47Å; A12-L16 PolarHBondContact O-N 2.85Å
13	V	91.8	Very high	85.1	Confident	74 Å²	74	96.1 Å²	96.1	45%	0.448	49%	0.485	S	S	.	.	H	α-helix	trans	-63.4	-45	175.3	172	0	0	0	0	110.9	V9 L10 L15 L16 V17	V9-V13 HydrophobicContact CG1-CG2 4.41Å; V9-V13 WeakPolarHBondContact O-CG2 3.44Å; V9-V13 PolarHBondContact O-N 3.41Å; L10-V13 PolarHBondContact O-N 3.44Å; V13-L15 PolarHBondContact O-N 3.29Å; V13-L16 PolarHBondContact O-N 3.49Å; V13-V17 HydrophobicContact CG1-CG2 4.41Å; V13-V17 VanDerWaalsContact O-CG2 3.28Å; V13-V17 WeakPolarHBondContact O-CG2 3.34Å; V13-V17 PolarHBondContact O-N 3.27Å
14	L	91.9	Very high	84.5	Confident	88 Å²	88	93 Å²	93	46%	0.461	47%	0.472	S	S	.	.	H	α-helix	trans	-61.4	-43.2	176.1	-74.6	169	0	0	0	111.8	L10 L11 V17 I18	L10-L14 HydrophobicContact CG-CD1 4.13Å; L10-L14 WeakPolarHBondContact O-CB 3.33Å; L10-L14 WeakPolarHBondContact O-CG 3.22Å; L10-L14 PolarHBondContact O-N 3.45Å; L11-L14 PolarHBondContact O-N 2.98Å; L14-V17 PolarHBondContact O-N 3.48Å; L14-I18 WeakPolarHBondContact O-CB 3.35Å; L14-I18 WeakPolarHBondContact O-CG1 3.38Å; L14-I18 PolarHBondContact O-N 3.38Å
15	L	89.3	Confident	83.1	Confident	103 Å²	103	90.3 Å²	90.3	54%	0.539	45%	0.454	S	S	.	.	H	α-helix	trans	-61	-44.6	174.5	-106.8	156.2	0	0	0	111.7	L11 A12 V13 V17 I18 I19	L11-L15 WeakPolarHBondContact O-CB 3.45Å; L11-L15 PolarHBondContact O-N 3.24Å; A12-L15 PolarHBondContact O-N 2.83Å; V13-L15 PolarHBondContact O-N 3.29Å; L15-V17 VanDerWaalsContact C-N 3.34Å; L15-V17 PolarHBondContact O-N 2.89Å; L15-I18 PolarHBondContact O-N 3.47Å; L15-I19 HydrophobicContact CD2-CD1 4.21Å; L15-I19 WeakPolarHBondContact O-CB 3.37Å; L15-I19 WeakPolarHBondContact O-CG1 3.36Å; L15-I19 PolarHBondContact O-N 3.48Å
16	L	86.3	Confident	81.8	Confident	118 Å²	118	84.7 Å²	84.7	62%	0.618	43%	0.425	S	S	*	.	H	α-helix	trans	-63.1	-40.2	175.8	-74.1	171.6	0	0	0	111.7	A12 V13 I19 W20	A12-L16 WeakPolarHBondContact O-CB 3.28Å; A12-L16 WeakPolarHBondContact O-CG 3.47Å; A12-L16 PolarHBondContact O-N 2.85Å; V13-L16 PolarHBondContact O-N 3.49Å; L16-I19 PolarHBondContact O-N 3.43Å; L16-W20 WeakPolarHBondContact O-CB 3.32Å; L16-W20 PolarHBondContact O-N 3.46Å
17	V	83.1	Confident	80.5	Confident	75 Å²	75	77.6 Å²	77.6	46%	0.455	40%	0.396	S	S	.	.	H	α-helix	trans	-64.1	-44.4	174.5	171.1	0	0	0	0	110.7	V13 L14 L15 W20 T21	V13-V17 HydrophobicContact CG1-CG2 4.41Å; V13-V17 VanDerWaalsContact O-CG2 3.28Å; V13-V17 WeakPolarHBondContact O-CG2 3.34Å; V13-V17 PolarHBondContact O-N 3.27Å; L14-V17 PolarHBondContact O-N 3.48Å; L15-V17 VanDerWaalsContact C-N 3.34Å; L15-V17 PolarHBondContact O-N 2.89Å; V17-W20 CarbonylContact O-C 3.6Å; V17-W20 PolarHBondContact O-N 2.9Å; V17-T21 HydrophobicContact CG1-CG2 4.37Å; V17-T21 VanDerWaalsContact O-CG2 3.31Å; V17-T21 WeakPolarHBondContact O-CG2 3.31Å; V17-T21 PolarHBondContact O-N 2.8Å; V17-T21 PolarHBondContact O-OG1 2.86Å; V17-T21 VanDerWaalsContact O-OG1 3.12Å
18	I	82.3	Confident	79.5	Confident	86 Å²	86	74.4 Å²	74.4	44%	0.441	39%	0.39	S	S	.	.	H	α-helix	trans	-63.3	-44.6	176.7	-69.7	163.7	0	0	0	111	L14 L15 W20 T21 L22	L14-I18 WeakPolarHBondContact O-CB 3.35Å; L14-I18 WeakPolarHBondContact O-CG1 3.38Å; L14-I18 PolarHBondContact O-N 3.38Å; L15-I18 PolarHBondContact O-N 3.47Å; I18-W20 VanDerWaalsContact C-N 3.3Å; I18-W20 PolarHBondContact O-N 3.25Å; I18-T21 WeakPolarHBondContact CA-OG1 3.39Å; I18-T21 PolarHBondContact O-N 2.8Å; I18-T21 PolarHBondContact O-OG1 3.28Å; I18-L22 HydrophobicContact CG2-CD1 3.66Å; I18-L22 HydrophobicContact CG2-CG 4.26Å; I18-L22 VanDerWaalsContact O-CB 3.31Å; I18-L22 WeakPolarHBondContact O-CB 3.45Å; I18-L22 WeakPolarHBondContact O-CG 3.27Å; I18-L22 PolarHBondContact O-N 2.91Å
19	I	80.6	Confident	78.6	Confident	79 Å²	79	68.1 Å²	68.1	41%	0.405	37%	0.368	S	S	.	.	H	α-helix	trans	-63.6	-40.5	176.4	-69.4	165.2	0	0	0	109.8	L15 L16 F23 G24	L15-I19 HydrophobicContact CD2-CD1 4.21Å; L15-I19 WeakPolarHBondContact O-CB 3.37Å; L15-I19 WeakPolarHBondContact O-CG1 3.36Å; L15-I19 PolarHBondContact O-N 3.48Å; L16-I19 PolarHBondContact O-N 3.43Å; I19-F23 HydrophobicContact CG2-CD2 4.22Å; I19-F23 CarbonylContact O-C 3.56Å; I19-F23 WeakPolarHBondContact O-CA 3.31Å; I19-F23 WeakPolarHBondContact O-CB 3.22Å; I19-F23 PolarHBondContact O-N 3.46Å; I19-G24 PolarHBondContact O-N 3.11Å
20	W	74.4	Confident	77.7	Confident	106 Å²	106	66.3 Å²	66.3	40%	0.402	35%	0.354	S	S	.	.	H	α-helix	trans	-69.6	-32.9	178	-172.4	88.8	0	0	0	113	L16 V17 I18 G24 P25	L16-W20 WeakPolarHBondContact O-CB 3.32Å; L16-W20 PolarHBondContact O-N 3.46Å; V17-W20 CarbonylContact O-C 3.6Å; V17-W20 PolarHBondContact O-N 2.9Å; I18-W20 VanDerWaalsContact C-N 3.3Å; I18-W20 PolarHBondContact O-N 3.25Å; W20-G24 CarbonylContact O-C 3.6Å; W20-G24 WeakPolarHBondContact O-CA 3.39Å; W20-G24 PolarHBondContact O-N 3.34Å; W20-P25 HydrophobicContact CZ2-CG 3.9Å
21	T	71	Confident	76.8	Confident	43 Å²	43	63.8 Å²	63.8	26%	0.264	34%	0.34	S	S	.	.	H	α-helix	trans	-76.7	-42.3	174.9	54.8	0	0	0	0	111.9	V17 I18 S26	V17-T21 HydrophobicContact CG1-CG2 4.37Å; V17-T21 VanDerWaalsContact O-CG2 3.31Å; V17-T21 WeakPolarHBondContact O-CG2 3.31Å; V17-T21 PolarHBondContact O-N 2.8Å; V17-T21 PolarHBondContact O-OG1 2.86Å; V17-T21 VanDerWaalsContact O-OG1 3.12Å; I18-T21 WeakPolarHBondContact CA-OG1 3.39Å; I18-T21 PolarHBondContact O-N 2.8Å; I18-T21 PolarHBondContact O-OG1 3.28Å; T21-S26 PolarHBondContact O-OG 3.27Å
22	L	70	Confident	76	Confident	72 Å²	72	64.3 Å²	64.3	38%	0.377	34%	0.343	S	S	.	.	H	α-helix	trans	-81.5	-34.9	-178.1	-66.2	178.7	0	0	0	113.7	I18 G29 L32	I18-L22 HydrophobicContact CG2-CD1 3.66Å; I18-L22 HydrophobicContact CG2-CG 4.26Å; I18-L22 VanDerWaalsContact O-CB 3.31Å; I18-L22 WeakPolarHBondContact O-CB 3.45Å; I18-L22 WeakPolarHBondContact O-CG 3.27Å; I18-L22 PolarHBondContact O-N 2.91Å; L22-G29 VanDerWaalsContact O-CA 3.26Å; L22-G29 WeakPolarHBondContact O-CA 3.4Å; L22-L32 HydrophobicContact CD2-CD1 4.13Å
23	F	69.2	Low	75.2	Confident	145 Å²	145	66.8 Å²	66.8	64%	0.636	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.3	-8.5	-173.9	-54	-74	0	0	0	113.2	I19 W368	I19-F23 HydrophobicContact CG2-CD2 4.22Å; I19-F23 CarbonylContact O-C 3.56Å; I19-F23 WeakPolarHBondContact O-CA 3.31Å; I19-F23 WeakPolarHBondContact O-CB 3.22Å; I19-F23 PolarHBondContact O-N 3.46Å; F23-W368 PolarHBondContact O-NE1 2.97Å
24	G	64.3	Low	74.4	Confident	13 Å²	13	63.4 Å²	63.4	13%	0.134	33%	0.328	C	S	.	.	S	Bend	trans	-90.4	-170.5	179.9	0	0	0	0	0	113.5	I19 W20 S26	I19-G24 PolarHBondContact O-N 3.11Å; W20-G24 CarbonylContact O-C 3.6Å; W20-G24 WeakPolarHBondContact O-CA 3.39Å; W20-G24 PolarHBondContact O-N 3.34Å; G24-S26 PolarHBondContact O-N 3.29Å
25	P	59.8	Low	73.5	Confident	6 Å²	6	64.2 Å²	64.2	4%	0.039	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	8.5	-167	35.5	-40.6	0	0	0	114	W20 G27 R364 F365 W368	W20-P25 HydrophobicContact CZ2-CG 3.9Å; P25-G27 PolarHBondContact O-N 3.12Å; P25-R364 HydrophobicContact CB-CB 4.01Å; P25-R364 WeakPolarHBondContact CB-O 3.43Å; P25-R364 WeakPolarHBondContact O-CB 3.14Å; P25-R364 WeakPolarHBondContact O-CG 3.2Å; P25-F365 HydrophobicContact CB-CD1 4.43Å; P25-F365 HydrophobicContact CG-CD1 4.29Å; P25-F365 HydrophobicContact CG-CE1 4.19Å; P25-W368 HydrophobicContact CB-CB 3.67Å; P25-W368 HydrophobicContact CB-CG 4.04Å
26	S	61.4	Low	72.7	Confident	13 Å²	13	62.2 Å²	62.2	9%	0.091	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-26.2	174.9	84	0	0	0	0	112.3	T21 G24 L28	T21-S26 PolarHBondContact O-OG 3.27Å; G24-S26 PolarHBondContact O-N 3.29Å; S26-L28 PolarHBondContact O-N 2.81Å; S26-L28 WeakPolarHBondContact OG-CB 3.16Å; S26-L28 PolarHBondContact OG-N 2.82Å; S26-L28 VanDerWaalsContact OG-N 3.11Å
27	G	64.3	Low	71.9	Confident	6 Å²	6	59.7 Å²	59.7	6%	0.062	31%	0.314	C	S	.	.			trans	73.9	-9.7	-172.8	0	0	0	0	0	114.4	P25 G29 E30 E31	P25-G27 PolarHBondContact O-N 3.12Å; G27-G29 VanDerWaalsContact C-N 3.34Å; G27-G29 PolarHBondContact O-N 2.67Å; G27-E30 PolarHBondContact O-N 3.34Å; G27-E31 WeakPolarHBondContact O-CG 3.18Å; G27-E31 PolarHBondContact O-N 2.82Å; G27-E31 VanDerWaalsContact O-N 3.11Å
28	L	69.5	Low	71.3	Confident	92 Å²	92	58.4 Å²	58.4	48%	0.482	31%	0.311	S	S	.	.	H	α-helix	trans	-61.1	-38.9	-174.3	-73.3	170.8	0	0	0	112.8	S26 E31 L32	S26-L28 PolarHBondContact O-N 2.81Å; S26-L28 WeakPolarHBondContact OG-CB 3.16Å; S26-L28 PolarHBondContact OG-N 2.82Å; S26-L28 VanDerWaalsContact OG-N 3.11Å; L28-E31 PolarHBondContact O-N 3.39Å; L28-L32 WeakPolarHBondContact O-CB 3.26Å; L28-L32 VanDerWaalsContact O-CG 3.24Å; L28-L32 WeakPolarHBondContact O-CG 3.44Å; L28-L32 PolarHBondContact O-N 2.87Å
29	G	71.8	Confident	70.6	Confident	6 Å²	6	59.2 Å²	59.2	6%	0.062	33%	0.325	C	S	.	.	H	α-helix	trans	-64.6	-39.4	177.3	0	0	0	0	0	113.4	L22 G27 E31 L32 L33	L22-G29 VanDerWaalsContact O-CA 3.26Å; L22-G29 WeakPolarHBondContact O-CA 3.4Å; G27-G29 VanDerWaalsContact C-N 3.34Å; G27-G29 PolarHBondContact O-N 2.67Å; G29-E31 VanDerWaalsContact C-N 3.35Å; G29-L32 PolarHBondContact O-N 3.43Å; G29-L33 WeakPolarHBondContact O-CB 3.35Å; G29-L33 WeakPolarHBondContact O-CG 3.04Å; G29-L33 PolarHBondContact O-N 2.85Å
30	E	72.2	Confident	70.5	Confident	46 Å²	46	62 Å²	62	22%	0.215	34%	0.339	C	S	.	.	H	α-helix	trans	-65	-39.8	174.4	-66.4	-169.8	-141.6	0	0	111.3	G27 L33 S34 H300 S371	G27-E30 PolarHBondContact O-N 3.34Å; E30-L33 PolarHBondContact O-N 2.04Å; E30-S34 PolarHBondContact O-N 2.75Å; E30-S34 PolarHBondContact O-OG 3.24Å; E30-H300 HydrophobicContact CB-CB 4.26Å; E30-H300 IonicContact OE2-CD2 2.91Å; E30-H300 IonicContact OE2-CE1 2.75Å; E30-H300 PolarHBondContact OE2-CE1 3.48Å; E30-H300 IonicContact OE2-CG 2.75Å; E30-H300 IonicContact OE2-ND1 3.97Å; E30-H300 PolarHBondContact OE2-ND1 3.03Å; E30-H300 IonicContact OE2-NE2 3.7Å; E30-H300 PolarHBondContact OE2-NE2 2.85Å; E30-S371 WeakPolarHBondContact OE1-CB 3.35Å; E30-S371 PolarHBondContact OE1-OG 3Å
31	E	75.9	Confident	70.9	Confident	32 Å²	32	59.1 Å²	59.1	15%	0.15	33%	0.332	C	S	.	.	H	α-helix	trans	-63.6	-44.7	174.3	-52.9	-147.7	172.7	0	0	111.7	G27 L28 G29 L33 S34 L35 R186 H300	G27-E31 WeakPolarHBondContact O-CG 3.18Å; G27-E31 PolarHBondContact O-N 2.82Å; G27-E31 VanDerWaalsContact O-N 3.11Å; L28-E31 PolarHBondContact O-N 3.39Å; G29-E31 VanDerWaalsContact C-N 3.35Å; E31-L33 PolarHBondContact O-N 3.38Å; E31-S34 WeakPolarHBondContact O-CB 3.33Å; E31-S34 PolarHBondContact O-N 3.11Å; E31-L35 WeakPolarHBondContact O-CG 3.31Å; E31-L35 PolarHBondContact O-N 2.76Å; E31-R186 IonicContact OE1-NH2 3.66Å; E31-R186 PolarHBondContact OE1-NH2 2.82Å; E31-R186 IonicContact OE2-CZ 3.42Å; E31-R186 IonicContact OE2-NH1 3.33Å; E31-R186 PolarHBondContact OE2-NH1 2.91Å; E31-R186 IonicContact OE2-NH2 3.51Å; E31-R186 PolarHBondContact OE2-NH2 3.49Å; E31-H300 VanDerWaalsContact CD-O 3.24Å; E31-H300 WeakPolarHBondContact CG-O 3.02Å
32	L	76.1	Confident	71.4	Confident	97 Å²	97	59.8 Å²	59.8	51%	0.508	34%	0.337	S	S	.	.	H	α-helix	trans	-63.9	-39.9	177	-72.4	171.5	0	0	0	111.9	L22 L28 G29 L35 S36	L22-L32 HydrophobicContact CD2-CD1 4.13Å; L28-L32 WeakPolarHBondContact O-CB 3.26Å; L28-L32 VanDerWaalsContact O-CG 3.24Å; L28-L32 WeakPolarHBondContact O-CG 3.44Å; L28-L32 PolarHBondContact O-N 2.87Å; G29-L32 PolarHBondContact O-N 3.43Å; L32-L35 PolarHBondContact O-N 3.5Å; L32-S36 PolarHBondContact O-N 2.91Å
33	L	73.2	Confident	72.2	Confident	102 Å²	102	60.6 Å²	60.6	53%	0.534	35%	0.354	S	S	.	.	H	α-helix	trans	-62.1	-46.2	174.1	-75	171.4	0	0	0	110.7	G29 E30 E31 L35 S36 L37	G29-L33 WeakPolarHBondContact O-CB 3.35Å; G29-L33 WeakPolarHBondContact O-CG 3.04Å; G29-L33 PolarHBondContact O-N 2.85Å; E30-L33 PolarHBondContact O-N 2.04Å; E31-L33 PolarHBondContact O-N 3.38Å; L33-L35 VanDerWaalsContact C-N 3.28Å; L33-L35 PolarHBondContact O-N 2.77Å; L33-S36 WeakPolarHBondContact CA-OG 3.33Å; L33-S36 PolarHBondContact O-N 3.02Å; L33-S36 PolarHBondContact O-OG 3.18Å; L33-L37 VanDerWaalsContact O-CG 3.31Å; L33-L37 WeakPolarHBondContact O-CG 3.33Å; L33-L37 PolarHBondContact O-N 3.45Å
34	S	76	Confident	73.2	Confident	3 Å²	3	57.9 Å²	57.9	2%	0.021	35%	0.351	C	S	.	.	H	α-helix	trans	-54.4	-43.8	173.6	-77.7	0	0	0	0	112.5	E30 E31 L37 A38 W225 P298 H300	E30-S34 PolarHBondContact O-N 2.75Å; E30-S34 PolarHBondContact O-OG 3.24Å; E31-S34 WeakPolarHBondContact O-CB 3.33Å; E31-S34 PolarHBondContact O-N 3.11Å; S34-L37 PolarHBondContact O-N 3.25Å; S34-A38 PolarHBondContact O-N 2.94Å; S34-W225 WeakPolarHBondContact OG-CH2 3Å; S34-W225 WeakPolarHBondContact OG-CZ2 3.33Å; S34-P298 PolarHBondContact OG-O 2.93Å; S34-H300 PolarHBondContact OG-N 2.87Å; S34-H300 VanDerWaalsContact OG-N 3.12Å
35	L	73.4	Confident	74.5	Confident	105 Å²	105	59 Å²	59	55%	0.55	36%	0.358	S	S	.	.	H	α-helix	trans	-67.2	-39.7	178.6	-68.3	169.7	0	0	0	112.2	E31 L32 L33 A38	E31-L35 WeakPolarHBondContact O-CG 3.31Å; E31-L35 PolarHBondContact O-N 2.76Å; L32-L35 PolarHBondContact O-N 3.5Å; L33-L35 VanDerWaalsContact C-N 3.28Å; L33-L35 PolarHBondContact O-N 2.77Å; L35-A38 WeakPolarHBondContact O-CB 3.46Å; L35-A38 PolarHBondContact O-N 3.17Å
36	S	71.4	Confident	76.1	Confident	61 Å²	61	62.1 Å²	62.1	43%	0.427	38%	0.381	S	S	.	.	H	α-helix	trans	-67.5	-35.4	176.6	72.1	0	0	0	0	112.7	L32 L33 A38 S39	L32-S36 PolarHBondContact O-N 2.91Å; L33-S36 WeakPolarHBondContact CA-OG 3.33Å; L33-S36 PolarHBondContact O-N 3.02Å; L33-S36 PolarHBondContact O-OG 3.18Å; S36-A38 PolarHBondContact O-N 3.44Å; S36-S39 PolarHBondContact O-N 3.04Å; S36-S39 PolarHBondContact O-OG 2.9Å
37	L	69	Low	77.6	Confident	66 Å²	66	64.6 Å²	64.6	35%	0.346	40%	0.396	S	S	.	.	H	α-helix	trans	-69.7	-20.7	178.8	-71.3	173.1	0	0	0	112.6	L33 S34 S39 L40 W225	L33-L37 VanDerWaalsContact O-CG 3.31Å; L33-L37 WeakPolarHBondContact O-CG 3.33Å; L33-L37 PolarHBondContact O-N 3.45Å; S34-L37 PolarHBondContact O-N 3.25Å; L37-S39 PolarHBondContact O-N 3.41Å; L37-L40 HydrophobicContact CD2-CD1 4.08Å; L37-L40 PolarHBondContact O-N 3.45Å; L37-W225 HydrophobicContact CD1-CE3 4.39Å; L37-W225 HydrophobicContact CD1-CH2 3.77Å; L37-W225 HydrophobicContact CD1-CZ3 3.38Å
38	A	70.8	Confident	78.9	Confident	48 Å²	48	65.2 Å²	65.2	40%	0.397	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-59.3	-28.8	174	0	0	0	0	0	112.2	S34 L35 S36 L40 L41	S34-A38 PolarHBondContact O-N 2.94Å; L35-A38 WeakPolarHBondContact O-CB 3.46Å; L35-A38 PolarHBondContact O-N 3.17Å; S36-A38 PolarHBondContact O-N 3.44Å; A38-L40 VanDerWaalsContact C-N 3.26Å; A38-L40 PolarHBondContact O-N 2.85Å; A38-L41 HydrophobicContact CB-CD1 4.28Å; A38-L41 WeakPolarHBondContact O-CB 3.5Å; A38-L41 WeakPolarHBondContact O-CD1 3.42Å; A38-L41 WeakPolarHBondContact O-CG 3.04Å; A38-L41 PolarHBondContact O-N 2.97Å
39	S	69	Low	80	Confident	103 Å²	103	64.8 Å²	64.8	72%	0.72	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-75.9	-11.9	176.5	73.7	0	0	0	0	114	S36 L37	S36-S39 PolarHBondContact O-N 3.04Å; S36-S39 PolarHBondContact O-OG 2.9Å; L37-S39 PolarHBondContact O-N 3.41Å
40	L	77.7	Confident	80.9	Confident	136 Å²	136	70.5 Å²	70.5	71%	0.712	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-101.4	9.9	177.6	-61.6	177.7	0	0	0	112.4	L37 A38	L37-L40 HydrophobicContact CD2-CD1 4.08Å; L37-L40 PolarHBondContact O-N 3.45Å; A38-L40 VanDerWaalsContact C-N 3.26Å; A38-L40 PolarHBondContact O-N 2.85Å
41	L	82	Confident	81.8	Confident	46 Å²	46	70.6 Å²	70.6	24%	0.241	44%	0.444	C	S	.	.	P	Polyproline II helix	trans	-68.8	142.3	179.7	-72.5	171.5	0	0	0	111.1	A38 R292 G295 A297	A38-L41 HydrophobicContact CB-CD1 4.28Å; A38-L41 WeakPolarHBondContact O-CB 3.5Å; A38-L41 WeakPolarHBondContact O-CD1 3.42Å; A38-L41 WeakPolarHBondContact O-CG 3.04Å; A38-L41 PolarHBondContact O-N 2.97Å; L41-R292 HydrophobicContact CD2-CG 4.33Å; L41-G295 VanDerWaalsContact CD1-O 3.23Å; L41-G295 WeakPolarHBondContact CD1-O 3.44Å; L41-A297 HydrophobicContact CD1-CB 3.85Å; L41-A297 HydrophobicContact CD2-CB 4.13Å; L41-A297 HydrophobicContact CG-CB 4.38Å
42	P	82.8	Confident	82.5	Confident	57 Å²	57	74 Å²	74	37%	0.37	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-62.3	156.7	170.4	29.6	-34.6	0	0	0	110	R292	P42-R292 HydrophobicContact CG-CG 4.32Å
43	A	86.7	Confident	83.4	Confident	89 Å²	89	71.2 Å²	71.2	74%	0.736	46%	0.462	S	S	*	.	P	Polyproline II helix	trans	-53.6	138.2	170.7	0	0	0	0	0	110.2	A45	A43-A45 PolarHBondContact O-N 3.49Å
44	P	90.6	Very high	84.4	Confident	89 Å²	89	67.9 Å²	67.9	58%	0.578	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-53.7	131.4	177.9	-25.9	33.2	0	0	0	111.5
45	A	90.9	Very high	85.3	Confident	35 Å²	35	76.8 Å²	76.8	29%	0.289	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-62.7	147.5	174.8	0	0	0	0	0	110.6	A43 R293	A43-A45 PolarHBondContact O-N 3.49Å; A45-R293 HydrophobicContact CB-CB 4.39Å; A45-R293 WeakPolarHBondContact CB-O 3.27Å; A45-R293 PolarHBondContact N-O 3.27Å
46	S	92.3	Very high	86.4	Confident	73 Å²	73	74.1 Å²	74.1	51%	0.51	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-57	148.5	168.8	63.2	0	0	0	0	110.5	G48 R276	S46-G48 PolarHBondContact O-N 2.99Å; S46-R276 PolarHBondContact OG-NH2 3.42Å
47	P	93.5	Very high	87.6	Confident	64 Å²	64	74.8 Å²	74.8	42%	0.416	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-48	141.9	172.3	-29	38.2	0	0	0	112.7	K272 R276	P47-K272 WeakPolarHBondContact CA-O 3.33Å; P47-K272 HydrophobicContact CB-CD 4.26Å; P47-K272 HydrophobicContact CB-CG 3.76Å; P47-K272 HydrophobicContact CG-CD 3.8Å; P47-K272 HydrophobicContact CG-CG 3.88Å; P47-R276 PolarHBondContact O-NE 3.45Å; P47-R276 PolarHBondContact O-NH2 2.78Å
48	G	91.7	Very high	88.8	Confident	19 Å²	19	72.7 Å²	72.7	20%	0.196	45%	0.453	C	S	.	.			trans	-89.6	174.1	170.6	0	0	0	0	0	112.3	S46 K272 S275	S46-G48 PolarHBondContact O-N 2.99Å; G48-K272 PolarHBondContact N-O 2.9Å; G48-S275 VanDerWaalsContact CA-OG 3.28Å; G48-S275 WeakPolarHBondContact CA-OG 3.34Å
49	P	94	Very high	90	Very high	83 Å²	83	72.4 Å²	72.4	54%	0.539	45%	0.448	S	S	.	.	S	Bend	trans	-59.4	156.1	168.4	27.9	-34.9	0	0	0	110.4	L51 S275	P49-L51 PolarHBondContact O-N 2.78Å; P49-S275 WeakPolarHBondContact CD-OG 3.06Å; P49-S275 VanDerWaalsContact O-CB 3.29Å; P49-S275 WeakPolarHBondContact O-CB 3.38Å; P49-S275 PolarHBondContact O-OG 3.13Å
50	P	89.7	Confident	91.2	Very high	127 Å²	127	68.9 Å²	68.9	83%	0.825	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-52.7	137	174.5	-25.5	34.4	0	0	0	111.8	A52	P50-A52 PolarHBondContact O-N 2Å
51	L	90.7	Very high	91.9	Very high	48 Å²	48	64.1 Å²	64.1	25%	0.251	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-66.1	129.4	175.4	-72.8	169.6	0	0	0	110.5	P49 L53 L149 L271 A274	P49-L51 PolarHBondContact O-N 2.78Å; L51-L53 VanDerWaalsContact C-N 3.35Å; L51-L53 HydrophobicContact CB-CD1 4.32Å; L51-L53 HydrophobicContact CB-CD2 4.16Å; L51-L53 HydrophobicContact CB-CG 3.85Å; L51-L53 HydrophobicContact CD1-CD1 4.44Å; L51-L53 HydrophobicContact CD1-CD2 4.42Å; L51-L53 PolarHBondContact O-N 3.39Å; L51-L149 HydrophobicContact CD1-CD1 4.24Å; L51-L149 HydrophobicContact CD1-CD2 4.03Å; L51-L271 HydrophobicContact CD1-CD2 4.09Å; L51-A274 HydrophobicContact CD1-CB 3.77Å; L51-A274 HydrophobicContact CD2-CB 4.09Å; L51-A274 HydrophobicContact CG-CB 4.3Å
52	A	91.2	Very high	92.4	Very high	103 Å²	103	69.3 Å²	69.3	85%	0.851	42%	0.422	S	S	*	.			trans	-77.3	85.3	168.7	0	0	0	0	0	109.7	P50	P50-A52 PolarHBondContact O-N 2Å
53	L	94.5	Very high	92.8	Very high	39 Å²	39	67.2 Å²	67.2	20%	0.204	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-93.1	147.1	179.9	-63.5	176.9	0	0	0	112.2	L51 L149 N153	L51-L53 VanDerWaalsContact C-N 3.35Å; L51-L53 HydrophobicContact CB-CD1 4.32Å; L51-L53 HydrophobicContact CB-CD2 4.16Å; L51-L53 HydrophobicContact CB-CG 3.85Å; L51-L53 HydrophobicContact CD1-CD1 4.44Å; L51-L53 HydrophobicContact CD1-CD2 4.42Å; L51-L53 PolarHBondContact O-N 3.39Å; L53-L149 HydrophobicContact CD1-CB 4.35Å; L53-L149 HydrophobicContact CD2-CB 3.61Å; L53-L149 HydrophobicContact CD2-CD1 4.18Å; L53-N153 HydrophobicContact CD1-CB 3.44Å; L53-N153 VanDerWaalsContact CD1-CB 3.44Å
54	P	94.4	Very high	92.9	Very high	32 Å²	32	63.8 Å²	63.8	21%	0.208	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-57.7	145.4	172.9	-25.7	37.1	0	0	0	111.9	F137	P54-F137 HydrophobicContact CB-CD1 4.08Å; P54-F137 HydrophobicContact CG-CB 4.29Å; P54-F137 HydrophobicContact CG-CD1 3.86Å
55	R	96	Very high	92.3	Very high	190 Å²	190	62.7 Å²	62.7	72%	0.717	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-65.3	155.9	174.1	67.3	174.4	-175.8	-177.3	2.4	110.7	S136	R55-S136 VanDerWaalsContact CG-OG 3.29Å; R55-S136 WeakPolarHBondContact CG-OG 3.37Å; R55-S136 PolarHBondContact N-OG 2.97Å; R55-S136 VanDerWaalsContact O-CB 3.25Å; R55-S136 WeakPolarHBondContact O-CB 3.43Å; R55-S136 PolarHBondContact O-N 3.12Å; R55-S136 PolarHBondContact O-OG 2.84Å; R55-S136 VanDerWaalsContact O-OG 3.13Å
56	L	96.4	Very high	91.6	Very high	48 Å²	48	63.4 Å²	63.4	25%	0.251	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	127.3	172.4	-60.1	175.1	0	0	0	109.6	Q134 A135 W154	L56-Q134 CarbonylContact C-O 3.53Å; L56-Q134 VanDerWaalsContact CA-O 3.31Å; L56-Q134 WeakPolarHBondContact CA-O 3.35Å; L56-A135 HydrophobicContact CD2-CB 3.95Å; L56-W154 HydrophobicContact CD1-CB 4.3Å; L56-W154 VanDerWaalsContact CD1-CD1 3.4Å; L56-W154 HydrophobicContact CD1-CG 4.22Å
57	L	94.8	Very high	90.8	Very high	75 Å²	75	66.6 Å²	66.6	39%	0.393	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	-42.3	171.2	-58.6	179.6	0	0	0	110.3	K113 Q134	L57-K113 HydrophobicContact CD1-CD 4.19Å; L57-K113 HydrophobicContact CD1-CG 3.8Å; L57-Q134 HydrophobicContact CB-CB 4.36Å; L57-Q134 HydrophobicContact CB-CG 4.37Å; L57-Q134 HydrophobicContact CD1-CG 4.34Å; L57-Q134 PolarHBondContact N-O 2.93Å
58	I	95.9	Very high	90.2	Very high	23 Å²	23	65.4 Å²	65.4	12%	0.118	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	109.2	172.2	-58.1	175.4	0	0	0	106.1	L122 S126 I132 Q134	I58-L122 HydrophobicContact CD1-CB 4.32Å; I58-S126 VanDerWaalsContact CG2-OG 3.28Å; I58-S126 WeakPolarHBondContact CG2-OG 3.46Å; I58-I132 HydrophobicContact CB-CG2 4.44Å; I58-I132 HydrophobicContact CD1-CG2 4.03Å; I58-I132 HydrophobicContact CG2-CG2 4.26Å; I58-I132 WeakPolarHBondContact CG2-O 3.49Å; I58-Q134 HydrophobicContact CB-CB 3.83Å; I58-Q134 HydrophobicContact CD1-CB 4.13Å; I58-Q134 HydrophobicContact CG1-CB 4Å; I58-Q134 PolarHBondContact N-O 2.99Å; I58-Q134 PolarHBondContact O-N 3.28Å
59	S	94.9	Very high	90	Very high	41 Å²	41	68 Å²	68	29%	0.287	43%	0.431	S	S	.	.			trans	-90.7	-28.6	-175.6	65	0	0	0	0	113.1	S61 L133 W154	S59-S61 PolarHBondContact O-N 3.33Å; S59-L133 VanDerWaalsContact O-CD2 3.23Å; S59-L133 WeakPolarHBondContact O-CD2 3.1Å; S59-W154 PolarHBondContact O-NE1 3.25Å
60	N	94	Very high	89.9	Confident	29 Å²	29	66.7 Å²	66.7	16%	0.155	42%	0.422	C	S	.	.			trans	43.6	41.8	-173.4	-162.8	15.5	0	0	0	113.6	H62 A63 R130 I132 L133 W154	N60-H62 PolarHBondContact O-N 2.91Å; N60-A63 WeakPolarHBondContact O-CB 2.87Å; N60-A63 PolarHBondContact O-N 3.27Å; N60-R130 PolarHBondContact ND2-O 3.18Å; N60-R130 PolarHBondContact OD1-O 2.92Å; N60-I132 WeakPolarHBondContact CB-O 3.03Å; N60-L133 HydrophobicContact CB-CD2 3.71Å; N60-W154 WeakPolarHBondContact O-CZ2 3.2Å
61	S	93.2	Very high	90.2	Very high	37 Å²	37	60.7 Å²	60.7	26%	0.259	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-17.4	-168.7	46.7	0	0	0	0	115	S59	S59-S61 PolarHBondContact O-N 3.33Å
62	H	91.4	Very high	90.4	Very high	155 Å²	155	58.7 Å²	58.7	72%	0.718	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-3.4	180	-57.7	-73	0	0	0	113.6	N60 C64 G65	N60-H62 PolarHBondContact O-N 2.91Å; H62-C64 PolarHBondContact O-N 2.95Å; H62-C64 VanDerWaalsContact O-N 3.09Å; H62-G65 PolarHBondContact O-N 3.03Å
63	A	91.2	Very high	90.7	Very high	13 Å²	13	53.8 Å²	53.8	11%	0.107	33%	0.332	C	S	.	.	S	Bend	trans	-53.6	-35.7	-174.7	0	0	0	0	0	113.8	N60 R104 Q106 L108 W154	N60-A63 WeakPolarHBondContact O-CB 2.87Å; N60-A63 PolarHBondContact O-N 3.27Å; A63-R104 PolarHBondContact O-NH2 2.98Å; A63-Q106 PolarHBondContact O-OE1 3.36Å; A63-L108 HydrophobicContact CB-CD1 4.26Å; A63-L108 HydrophobicContact CB-CD2 4.28Å; A63-W154 HydrophobicContact CB-CH2 3.83Å; A63-W154 HydrophobicContact CB-CZ2 3.97Å
64	C	89.7	Confident	90.9	Very high	17 Å²	17	51.9 Å²	51.9	12%	0.115	32%	0.322	C	S	.	.	S	Bend	trans	-100.2	-12.5	176.1	-68.8	0	0	0	0	114.3	H62 G66 Y158 C159	H62-C64 PolarHBondContact O-N 2.95Å; H62-C64 VanDerWaalsContact O-N 3.09Å; C64-G66 VanDerWaalsContact C-N 3.31Å; C64-G66 PolarHBondContact O-N 3.16Å; C64-Y158 WeakPolarHBondContact CB-O 3.47Å; C64-C159 HydrophobicContact CB-CB 3.86Å; C64-C159 WeakPolarHBondContact CB-SG 3.28Å; C64-C159 WeakPolarHBondContact SG-CB 3.3Å; C64-C159 CovalentContact SG-SG 2.02Å; C64-C159 PolarHBondContact SG-SG 2.89Å
65	G	78.6	Confident	91.1	Very high	65 Å²	65	50.4 Å²	50.4	67%	0.67	31%	0.312	S	S	*	.			trans	-86.5	27.8	-169.5	0	0	0	0	0	116.2	H62	H62-G65 PolarHBondContact O-N 3.03Å
66	G	76.3	Confident	91.2	Very high	50 Å²	50	41.5 Å²	41.5	52%	0.515	28%	0.279	S	S	.	.	S	Bend	trans	-87.3	174.1	178.6	0	0	0	0	0	113.6	C64 G68	C64-G66 VanDerWaalsContact C-N 3.31Å; C64-G66 PolarHBondContact O-N 3.16Å; G66-G68 PolarHBondContact O-N 3.02Å
67	S	74.4	Confident	91.3	Very high	141 Å²	141	39.2 Å²	39.2	99%	0.986	27%	0.267	S	S	*	.	S	Bend	trans	-71.5	-1.9	176.6	52	0	0	0	0	115
68	G	81	Confident	91.5	Very high	39 Å²	39	35.9 Å²	35.9	40%	0.402	25%	0.25	S	S	.	.	S	Bend	trans	-87.1	166.8	178.3	0	0	0	0	0	113.2	G66	G66-G68 PolarHBondContact O-N 3.02Å
69	P	88.4	Confident	91.6	Very high	73 Å²	73	35 Å²	35	47%	0.474	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-58	153	174.6	26	-34.7	0	0	0	111	R104	P69-R104 WeakPolarHBondContact O-CD 3.34Å; P69-R104 PolarHBondContact O-NH1 3.27Å
70	P	91.9	Very high	91.6	Very high	55 Å²	55	33.9 Å²	33.9	36%	0.357	24%	0.239	S	C	.	.	P	Polyproline II helix	trans	-59.6	149.6	176.7	27.4	-35.7	0	0	0	110.9	F72 M161	P70-F72 PolarHBondContact O-N 3.14Å; P70-M161 HydrophobicContact CB-CB 3.65Å; P70-M161 WeakPolarHBondContact CB-O 2.98Å; P70-M161 HydrophobicContact CG-CB 4.13Å; P70-M161 HydrophobicContact CG-CE 4.38Å
71	P	94.3	Very high	91.6	Very high	2 Å²	2	32.6 Å²	32.6	1%	0.013	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-63.9	124.9	178.5	26.3	-32.6	0	0	0	110.4	Q106 A162 R163	P71-Q106 HydrophobicContact CB-CB 4.45Å; P71-A162 HydrophobicContact CG-CB 3.98Å; P71-A162 VanDerWaalsContact O-CA 3.24Å; P71-A162 WeakPolarHBondContact O-CA 3.4Å; P71-R163 PolarHBondContact O-N 3.21Å
72	F	95.5	Very high	91.7	Very high	5 Å²	5	34.8 Å²	34.8	2%	0.022	24%	0.239	C	C	.	.	S	Bend	trans	-64.9	-45.6	171	174.8	-94	0	0	0	110.3	P70 F103 R104 R163 Y164 V180 L183 I184 E191	P70-F72 PolarHBondContact O-N 3.14Å; F72-F103 HydrophobicContact CB-CB 3.65Å; F72-F103 HydrophobicContact CB-CD1 3.82Å; F72-F103 HydrophobicContact CB-CG 4.1Å; F72-F103 HydrophobicContact CD1-CB 4.02Å; F72-F103 HydrophobicContact CD1-CD1 4.47Å; F72-F103 HydrophobicContact CD1-CG 4.27Å; F72-F103 HydrophobicContact CD2-CB 4.36Å; F72-F103 AromaticContact CD2-CD1 3.36Å; F72-F103 HydrophobicContact CD2-CD1 3.36Å; F72-F103 AromaticContact CD2-CE1 3.74Å; F72-F103 HydrophobicContact CD2-CE1 3.74Å; F72-F103 AromaticContact CD2-CG 3.95Å; F72-F103 HydrophobicContact CD2-CG 3.95Å; F72-F103 HydrophobicContact CE2-CD1 4.02Å; F72-F103 HydrophobicContact CE2-CE1 4.05Å; F72-F103 HydrophobicContact CE2-CG 4.46Å; F72-F103 HydrophobicContact CG-CB 3.76Å; F72-F103 AromaticContact CG-CD1 3.64Å; F72-F103 HydrophobicContact CG-CD1 3.64Å; F72-F103 HydrophobicContact CG-CE1 4.45Å; F72-F103 AromaticContact CG-CG 3.85Å; F72-F103 HydrophobicContact CG-CG 3.85Å; F72-R104 WeakPolarHBondContact CB-O 3.27Å; F72-R104 PolarHBondContact N-O 3.3Å; F72-R163 HydrophobicContact CD2-CB 4.45Å; F72-Y164 HydrophobicContact CD1-CD2 4.39Å; F72-Y164 HydrophobicContact CD2-CD2 4.44Å; F72-Y164 HydrophobicContact CD2-CE2 4.48Å; F72-Y164 AromaticContact CE1-CD2 3.89Å; F72-Y164 HydrophobicContact CE1-CD2 3.89Å; F72-Y164 HydrophobicContact CE1-CE2 4.25Å; F72-Y164 AromaticContact CE2-CD2 3.96Å; F72-Y164 HydrophobicContact CE2-CD2 3.96Å; F72-Y164 AromaticContact CE2-CE2 3.69Å; F72-Y164 HydrophobicContact CE2-CE2 3.69Å; F72-Y164 AromaticContact CZ-CD2 3.65Å; F72-Y164 HydrophobicContact CZ-CD2 3.65Å; F72-Y164 AromaticContact CZ-CE2 3.54Å; F72-Y164 HydrophobicContact CZ-CE2 3.54Å; F72-Y164 PolarHBondContact O-N 2.74Å; F72-V180 HydrophobicContact CD1-CG1 4.17Å; F72-V180 HydrophobicContact CD1-CG2 4.45Å; F72-V180 HydrophobicContact CE1-CB 4.48Å; F72-V180 HydrophobicContact CE1-CG1 3.93Å; F72-L183 HydrophobicContact CE1-CB 3.9Å; F72-L183 HydrophobicContact CE1-CD1 4.28Å; F72-L183 HydrophobicContact CZ-CB 3.9Å; F72-I184 HydrophobicContact CE2-CG1 4.46Å; F72-I184 HydrophobicContact CZ-CG1 3.93Å; F72-E191 WeakPolarHBondContact CE2-OE2 3.29Å
73	L	97.5	Very high	91.8	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	120.8	176.4	179	62.3	0	0	0	110.2	I75 R104 V105 Q106 Y164 L166 L179 V180 L183	L73-I75 HydrophobicContact CD2-CD1 4.21Å; L73-I75 HydrophobicContact CD2-CG1 4.09Å; L73-I75 HydrophobicContact CG-CG1 3.97Å; L73-R104 PolarHBondContact N-O 3.2Å; L73-V105 HydrophobicContact CB-CG1 4.35Å; L73-V105 HydrophobicContact CB-CG2 4.31Å; L73-V105 HydrophobicContact CD2-CG1 4.32Å; L73-V105 HydrophobicContact CG-CG1 4.4Å; L73-V105 WeakPolarHBondContact O-CA 3.13Å; L73-Q106 PolarHBondContact O-N 3.38Å; L73-Y164 WeakPolarHBondContact CA-O 3.5Å; L73-L166 HydrophobicContact CD1-CB 4.03Å; L73-L179 HydrophobicContact CD2-CD2 3.81Å; L73-L179 HydrophobicContact CD2-CG 4.23Å; L73-V180 HydrophobicContact CD2-CG2 4.02Å; L73-L183 HydrophobicContact CD1-CD1 4.02Å
74	L	98.1	Very high	92	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	123.5	167.3	-175.3	72.2	0	0	0	109.3	L76 Q106 L108 W154 V155 Y164 I165 L166	L74-L76 HydrophobicContact CD2-CD2 4.08Å; L74-L76 HydrophobicContact CG-CD2 4.3Å; L74-Q106 CarbonylContact C-O 3.09Å; L74-Q106 WeakPolarHBondContact CA-O 3.38Å; L74-Q106 HydrophobicContact CD1-CB 3.92Å; L74-Q106 HydrophobicContact CD1-CG 4.14Å; L74-L108 HydrophobicContact CD1-CD1 3.87Å; L74-L108 HydrophobicContact CD1-CG 4.14Å; L74-W154 HydrophobicContact CD2-CZ3 3.88Å; L74-V155 HydrophobicContact CD2-CB 4.43Å; L74-V155 HydrophobicContact CD2-CG1 4.24Å; L74-V155 HydrophobicContact CD2-CG2 3.46Å; L74-V155 VanDerWaalsContact CD2-CG2 3.46Å; L74-Y164 PolarHBondContact N-O 2.83Å; L74-I165 CarbonylContact O-C 3.58Å; L74-I165 VanDerWaalsContact O-CA 3.24Å; L74-I165 WeakPolarHBondContact O-CA 3.37Å; L74-L166 PolarHBondContact O-N 2.98Å
75	I	98.8	Very high	92.3	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	112.7	179	-52.1	175.2	0	0	0	108.3	L73 V77 W94 V105 Q106 T107 L108 L166 T168 V176	L73-I75 HydrophobicContact CD2-CD1 4.21Å; L73-I75 HydrophobicContact CD2-CG1 4.09Å; L73-I75 HydrophobicContact CG-CG1 3.97Å; I75-V77 HydrophobicContact CG2-CG2 4.03Å; I75-W94 HydrophobicContact CD1-CE3 4.33Å; I75-W94 HydrophobicContact CD1-CZ3 3.99Å; I75-W94 HydrophobicContact CG2-CH2 4.17Å; I75-W94 HydrophobicContact CG2-CZ3 3.88Å; I75-V105 HydrophobicContact CD1-CG1 3.93Å; I75-V105 HydrophobicContact CG1-CG1 4.33Å; I75-Q106 PolarHBondContact N-O 3.33Å; I75-T107 HydrophobicContact CB-CG2 4.31Å; I75-T107 HydrophobicContact CG2-CG2 4.44Å; I75-T107 WeakPolarHBondContact O-CA 3.18Å; I75-L108 PolarHBondContact O-N 2.86Å; I75-L166 CarbonylContact C-O 3.58Å; I75-L166 WeakPolarHBondContact CA-O 3.29Å; I75-L166 HydrophobicContact CD1-CD2 4.41Å; I75-L166 HydrophobicContact CG1-CB 4.26Å; I75-L166 HydrophobicContact CG1-CD2 4.19Å; I75-L166 HydrophobicContact CG2-CB 4.34Å; I75-L166 HydrophobicContact CG2-CD2 3.82Å; I75-L166 HydrophobicContact CG2-CG 4.2Å; I75-T168 HydrophobicContact CG2-CG2 3.85Å; I75-V176 HydrophobicContact CD1-CG2 3.79Å
76	L	98.6	Very high	93.3	Very high	3 Å²	3	37.2 Å²	37.2	2%	0.016	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	108.1	172.7	-62.4	-176.3	0	0	0	109.3	L74 L108 L133 V155 I165 L166 T168	L74-L76 HydrophobicContact CD2-CD2 4.08Å; L74-L76 HydrophobicContact CG-CD2 4.3Å; L76-L108 HydrophobicContact CD2-CB 4.18Å; L76-L133 HydrophobicContact CD2-CD1 4.22Å; L76-V155 HydrophobicContact CD1-CG2 3.8Å; L76-V155 HydrophobicContact CD2-CG2 4.4Å; L76-V155 HydrophobicContact CG-CG2 4.42Å; L76-I165 HydrophobicContact CD1-CG2 3.9Å; L76-I165 HydrophobicContact CG-CG2 4.03Å; L76-L166 PolarHBondContact N-O 2.85Å; L76-T168 PolarHBondContact O-N 3.43Å
77	V	98.7	Very high	94.3	Very high	0 Å²	0	35 Å²	35	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	109.4	178.4	-174.7	0	0	0	0	109.3	I75 T79 I90 W94 T107 L108 F109 L110 T168 D170	I75-V77 HydrophobicContact CG2-CG2 4.03Å; V77-T79 PolarHBondContact O-N 3.35Å; V77-I90 HydrophobicContact CG1-CD1 3.81Å; V77-W94 HydrophobicContact CG2-CH2 3.73Å; V77-W94 HydrophobicContact CG2-CZ3 4.44Å; V77-T107 HydrophobicContact CG2-CG2 3.73Å; V77-L108 PolarHBondContact N-O 3.47Å; V77-F109 HydrophobicContact CB-CD1 3.71Å; V77-F109 HydrophobicContact CB-CE1 4.05Å; V77-F109 HydrophobicContact CG1-CD1 3.88Å; V77-F109 HydrophobicContact CG1-CE1 4.02Å; V77-F109 HydrophobicContact CG2-CD1 4.32Å; V77-F109 HydrophobicContact CG2-CE1 4.25Å; V77-F109 WeakPolarHBondContact O-CA 3.41Å; V77-L110 PolarHBondContact O-N 3.44Å; V77-T168 CarbonylContact C-O 3.56Å; V77-T168 WeakPolarHBondContact CA-O 3.1Å; V77-T168 HydrophobicContact CB-CG2 4.41Å; V77-T168 HydrophobicContact CG2-CG2 3.91Å; V77-D170 HydrophobicContact CG1-CB 3.95Å
78	C	98.4	Very high	95.4	Very high	6 Å²	6	31.3 Å²	31.3	4%	0.041	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	115.4	171.2	-72	0	0	0	0	109.6	K147 K167 T168 D170	C78-K147 HydrophobicContact CB-CD 3.95Å; C78-K167 VanDerWaalsContact SG-CE 3.55Å; C78-T168 PolarHBondContact N-O 3.23Å; C78-D170 PolarHBondContact O-N 3.26Å
79	T	97.5	Very high	96.2	Very high	3 Å²	3	29.6 Å²	29.6	2%	0.018	16%	0.162	C	C	.	.			trans	-136.8	161.9	-177.6	-175.7	0	0	0	0	110.7	V77 R87 F109 L110 L111 K147 D170	V77-T79 PolarHBondContact O-N 3.35Å; T79-R87 HydrophobicContact CG2-CG 3.86Å; T79-F109 HydrophobicContact CG2-CB 3.92Å; T79-F109 HydrophobicContact CG2-CD1 4.04Å; T79-F109 HydrophobicContact CG2-CG 4.39Å; T79-L110 PolarHBondContact N-O 3.11Å; T79-L110 VanDerWaalsContact N-O 3.13Å; T79-L111 HydrophobicContact CG2-CD1 3.92Å; T79-L111 HydrophobicContact CG2-CD2 3.8Å; T79-L111 HydrophobicContact CG2-CG 3.59Å; T79-K147 PolarHBondContact O-NZ 2.82Å; T79-D170 VanDerWaalsContact CA-OD2 3.29Å; T79-D170 WeakPolarHBondContact CA-OD2 3.49Å; T79-D170 WeakPolarHBondContact CB-OD2 3.46Å; T79-D170 PolarHBondContact OG1-OD2 2.84Å
80	A	95.7	Very high	96.7	Very high	18 Å²	18	26.1 Å²	26.1	15%	0.149	14%	0.139	C	C	.	.			trans	-94.7	147.9	175.8	0	0	0	0	0	111.9	E82 H83 R87 D139	A80-E82 PolarHBondContact O-N 3.28Å; A80-E82 VanDerWaalsContact O-N 3.11Å; A80-H83 HydrophobicContact CB-CB 4.4Å; A80-H83 WeakPolarHBondContact O-CB 3.23Å; A80-H83 PolarHBondContact O-N 3.06Å; A80-R87 PolarHBondContact O-NH1 3.47Å; A80-D139 VanDerWaalsContact CA-OD2 3.28Å; A80-D139 WeakPolarHBondContact CA-OD2 3.3Å
81	P	95.2	Very high	97	Very high	2 Å²	2	25.2 Å²	25.2	1%	0.013	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.3	-40.2	176.2	-32.6	38.9	0	0	0	113.7	H83 R87 L111 G112 P114 A120 L122 D139	P81-H83 VanDerWaalsContact C-N 3.28Å; P81-H83 PolarHBondContact O-N 3.4Å; P81-R87 PolarHBondContact O-NH1 2.88Å; P81-R87 PolarHBondContact O-NH2 3.47Å; P81-L111 HydrophobicContact CG-CD2 4.4Å; P81-G112 WeakPolarHBondContact CG-O 3.05Å; P81-P114 HydrophobicContact CB-CB 3.85Å; P81-P114 HydrophobicContact CG-CB 4.18Å; P81-A120 HydrophobicContact CB-CB 4.05Å; P81-L122 HydrophobicContact CB-CD1 4.04Å; P81-L122 HydrophobicContact CG-CD1 4.23Å; P81-D139 VanDerWaalsContact CD-OD2 3.26Å; P81-D139 WeakPolarHBondContact CD-OD2 3.49Å; P81-D139 HydrophobicContact CG-CB 4.45Å
82	E	93.3	Very high	97.1	Very high	84 Å²	84	28.1 Å²	28.1	39%	0.393	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-15.4	-179.1	-59.2	79.6	-174.2	0	0	113.7	A80 L84	A80-E82 PolarHBondContact O-N 3.28Å; A80-E82 VanDerWaalsContact O-N 3.11Å; E82-L84 VanDerWaalsContact C-N 3.25Å; E82-L84 PolarHBondContact O-N 3.36Å
83	H	95.4	Very high	97.2	Very high	66 Å²	66	27.9 Å²	27.9	31%	0.306	15%	0.151	S	C	.	.			trans	-86	46.5	-175.9	-69.1	-175.3	0	0	0	113.6	A80 P81 N85 Q86 R87 D170	A80-H83 HydrophobicContact CB-CB 4.4Å; A80-H83 WeakPolarHBondContact O-CB 3.23Å; A80-H83 PolarHBondContact O-N 3.06Å; P81-H83 VanDerWaalsContact C-N 3.28Å; P81-H83 PolarHBondContact O-N 3.4Å; H83-N85 VanDerWaalsContact C-N 3.28Å; H83-N85 PolarHBondContact O-N 3.33Å; H83-Q86 VanDerWaalsContact C-OE1 3.3Å; H83-Q86 HydrophobicContact CB-CB 4.1Å; H83-Q86 HydrophobicContact CB-CG 4.11Å; H83-Q86 PolarHBondContact O-N 3.14Å; H83-Q86 PolarHBondContact O-OE1 3.44Å; H83-R87 VanDerWaalsContact C-NH1 3.3Å; H83-R87 PolarHBondContact O-N 2.75Å; H83-R87 VanDerWaalsContact O-N 3.14Å; H83-R87 PolarHBondContact O-NH1 3.15Å; H83-D170 WeakPolarHBondContact CB-OD2 3.5Å; H83-D170 IonicContact CE1-OD2 2.7Å; H83-D170 IonicContact CG-OD2 2.63Å; H83-D170 IonicContact ND1-OD1 3.52Å; H83-D170 IonicContact ND1-OD2 3.07Å; H83-D170 PolarHBondContact ND1-OD2 3.28Å
84	L	94.9	Very high	97.1	Very high	74 Å²	74	27.9 Å²	27.9	39%	0.387	15%	0.152	S	C	.	.	H	α-helix	trans	-59.3	-39.6	179	179	61.2	0	0	0	112.1	E82 Q86 R87 N88 E125	E82-L84 VanDerWaalsContact C-N 3.25Å; E82-L84 PolarHBondContact O-N 3.36Å; L84-Q86 PolarHBondContact O-N 2.85Å; L84-R87 PolarHBondContact O-N 2.65Å; L84-N88 WeakPolarHBondContact O-CB 3.39Å; L84-N88 VanDerWaalsContact O-CG 3.25Å; L84-N88 PolarHBondContact O-N 2.71Å; L84-N88 PolarHBondContact O-ND2 3.5Å; L84-E125 HydrophobicContact CD1-CG 4.39Å
85	N	96.7	Very high	97.1	Very high	116 Å²	116	28 Å²	28	62%	0.62	15%	0.153	S	C	*	.	H	α-helix	trans	-64.9	-38.7	-179.8	-70.9	-17.3	0	0	0	112.3	H83 N88 A89 P329	H83-N85 VanDerWaalsContact C-N 3.28Å; H83-N85 PolarHBondContact O-N 3.33Å; N85-N88 PolarHBondContact O-N 3.02Å; N85-A89 WeakPolarHBondContact O-CB 3.45Å; N85-A89 PolarHBondContact O-N 3.13Å; N85-P329 HydrophobicContact CB-CG 4.28Å
86	Q	98	Very high	97	Very high	45 Å²	45	30.3 Å²	30.3	21%	0.21	17%	0.172	C	C	.	.	H	α-helix	trans	-64.9	-48.7	176.2	-66.7	74	-6.2	0	0	110.3	H83 L84 N88 A89 I90 D170 P329	H83-Q86 VanDerWaalsContact C-OE1 3.3Å; H83-Q86 HydrophobicContact CB-CB 4.1Å; H83-Q86 HydrophobicContact CB-CG 4.11Å; H83-Q86 PolarHBondContact O-N 3.14Å; H83-Q86 PolarHBondContact O-OE1 3.44Å; L84-Q86 PolarHBondContact O-N 2.85Å; Q86-N88 VanDerWaalsContact C-N 3.31Å; Q86-N88 PolarHBondContact O-N 2.91Å; Q86-A89 PolarHBondContact O-N 2.75Å; Q86-I90 WeakPolarHBondContact O-CG1 3.24Å; Q86-I90 PolarHBondContact O-N 3.17Å; Q86-D170 HydrophobicContact CB-CB 4.06Å; Q86-P329 HydrophobicContact CG-CG 3.93Å
87	R	98	Very high	96.9	Very high	2 Å²	2	31.4 Å²	31.4	1%	0.008	18%	0.177	C	C	.	.	H	α-helix	trans	-57.4	-45.2	175.3	-66.4	-167.7	-67.4	-78.5	9.3	111.6	T79 A80 P81 H83 L84 I90 R91 F109 E125	T79-R87 HydrophobicContact CG2-CG 3.86Å; A80-R87 PolarHBondContact O-NH1 3.47Å; P81-R87 PolarHBondContact O-NH1 2.88Å; P81-R87 PolarHBondContact O-NH2 3.47Å; H83-R87 VanDerWaalsContact C-NH1 3.3Å; H83-R87 PolarHBondContact O-N 2.75Å; H83-R87 VanDerWaalsContact O-N 3.14Å; H83-R87 PolarHBondContact O-NH1 3.15Å; L84-R87 PolarHBondContact O-N 2.65Å; R87-I90 PolarHBondContact O-N 3.21Å; R87-R91 WeakPolarHBondContact O-CG 3.41Å; R87-R91 PolarHBondContact O-N 3.3Å; R87-F109 HydrophobicContact CB-CD1 4.27Å; R87-F109 HydrophobicContact CB-CE1 3.98Å; R87-F109 HydrophobicContact CB-CE2 4.36Å; R87-F109 HydrophobicContact CB-CZ 4.02Å; R87-F109 HydrophobicContact CG-CD1 3.66Å; R87-F109 HydrophobicContact CG-CD2 4.49Å; R87-F109 HydrophobicContact CG-CE1 3.84Å; R87-F109 HydrophobicContact CG-CG 4.02Å; R87-F109 HydrophobicContact CG-CZ 4.33Å; R87-E125 IonicContact CZ-OE1 3.58Å; R87-E125 IonicContact CZ-OE2 3.43Å; R87-E125 IonicContact NE-OE1 2.79Å; R87-E125 PolarHBondContact NE-OE1 2.88Å; R87-E125 IonicContact NE-OE2 2.69Å; R87-E125 PolarHBondContact NE-OE2 3.28Å; R87-E125 IonicContact NH2-OE1 3.32Å; R87-E125 IonicContact NH2-OE2 2.73Å; R87-E125 PolarHBondContact NH2-OE2 2.88Å
88	N	97.8	Very high	96.7	Very high	64 Å²	64	37.5 Å²	37.5	34%	0.342	20%	0.2	S	C	.	.	H	α-helix	trans	-65.4	-39	178.5	-71.8	-15.2	0	0	0	112.7	L84 N85 Q86 R91 A92	L84-N88 WeakPolarHBondContact O-CB 3.39Å; L84-N88 VanDerWaalsContact O-CG 3.25Å; L84-N88 PolarHBondContact O-N 2.71Å; L84-N88 PolarHBondContact O-ND2 3.5Å; N85-N88 PolarHBondContact O-N 3.02Å; Q86-N88 VanDerWaalsContact C-N 3.31Å; Q86-N88 PolarHBondContact O-N 2.91Å; N88-R91 PolarHBondContact O-N 3.11Å; N88-R91 PolarHBondContact OD1-NH1 3.18Å; N88-A92 VanDerWaalsContact O-CB 3.31Å; N88-A92 WeakPolarHBondContact O-CB 3.44Å; N88-A92 PolarHBondContact O-N 3.33Å
89	A	98.3	Very high	96.6	Very high	3 Å²	3	43.6 Å²	43.6	3%	0.025	23%	0.228	C	C	.	.	H	α-helix	trans	-64.4	-40.3	174.4	0	0	0	0	0	112.1	N85 Q86 A92 S93 P329 M332	N85-A89 WeakPolarHBondContact O-CB 3.45Å; N85-A89 PolarHBondContact O-N 3.13Å; Q86-A89 PolarHBondContact O-N 2.75Å; A89-A92 PolarHBondContact O-N 3.34Å; A89-S93 VanDerWaalsContact O-CB 3.3Å; A89-S93 WeakPolarHBondContact O-CB 3.44Å; A89-S93 PolarHBondContact O-N 3.28Å; A89-S93 PolarHBondContact O-OG 2.84Å; A89-P329 HydrophobicContact CB-CB 3.75Å; A89-M332 HydrophobicContact CB-CB 4.24Å; A89-M332 HydrophobicContact CB-CG 4.34Å
90	I	98.5	Very high	96.4	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-64.5	-46.2	174.2	-69.9	171.6	0	0	0	110.7	V77 Q86 R87 A92 S93 W94 G95 T107 F109 D170 M332	V77-I90 HydrophobicContact CG1-CD1 3.81Å; Q86-I90 WeakPolarHBondContact O-CG1 3.24Å; Q86-I90 PolarHBondContact O-N 3.17Å; R87-I90 PolarHBondContact O-N 3.21Å; I90-A92 PolarHBondContact O-N 3.43Å; I90-S93 CarbonylContact O-C 3.52Å; I90-S93 PolarHBondContact O-N 3.19Å; I90-S93 VanDerWaalsContact O-N 3.09Å; I90-S93 PolarHBondContact O-OG 3.44Å; I90-W94 HydrophobicContact CB-CZ2 4.31Å; I90-W94 HydrophobicContact CD1-CH2 4.37Å; I90-W94 HydrophobicContact CD1-CZ2 3.81Å; I90-W94 HydrophobicContact CG1-CZ2 3.74Å; I90-W94 HydrophobicContact CG2-CD2 4.38Å; I90-W94 HydrophobicContact CG2-CE3 4.41Å; I90-W94 HydrophobicContact CG2-CH2 3.69Å; I90-W94 HydrophobicContact CG2-CZ2 3.65Å; I90-W94 HydrophobicContact CG2-CZ3 4.07Å; I90-G95 VanDerWaalsContact O-CA 3.22Å; I90-G95 WeakPolarHBondContact O-CA 3.34Å; I90-G95 PolarHBondContact O-N 3.29Å; I90-T107 HydrophobicContact CG2-CG2 4.38Å; I90-F109 HydrophobicContact CB-CE1 4.07Å; I90-F109 HydrophobicContact CB-CZ 4.01Å; I90-F109 HydrophobicContact CD1-CE1 4.12Å; I90-F109 HydrophobicContact CG2-CE1 3.89Å; I90-F109 HydrophobicContact CG2-CZ 3.75Å; I90-D170 HydrophobicContact CD1-CB 4.2Å; I90-M332 HydrophobicContact CG1-CE 4.21Å
91	R	97.9	Very high	96.2	Very high	37 Å²	37	48.9 Å²	48.9	14%	0.14	25%	0.245	C	C	.	.	H	α-helix	trans	-59.4	-33.1	175.4	-73.3	178	-173.1	119.7	1.1	113	R87 N88 S93 A96 F109 E125 D131	R87-R91 WeakPolarHBondContact O-CG 3.41Å; R87-R91 PolarHBondContact O-N 3.3Å; N88-R91 PolarHBondContact O-N 3.11Å; N88-R91 PolarHBondContact OD1-NH1 3.18Å; R91-S93 VanDerWaalsContact C-N 3.33Å; R91-A96 VanDerWaalsContact O-CB 3.29Å; R91-A96 WeakPolarHBondContact O-CB 3.4Å; R91-F109 HydrophobicContact CG-CE2 3.81Å; R91-F109 HydrophobicContact CG-CZ 4Å; R91-E125 IonicContact CZ-OE1 3.87Å; R91-E125 VanDerWaalsContact CZ-OE1 3.25Å; R91-E125 IonicContact NH1-OE1 3.42Å; R91-E125 PolarHBondContact NH1-OE1 2.81Å; R91-E125 IonicContact NH2-OE1 2.72Å; R91-E125 PolarHBondContact NH2-OE1 3.42Å; R91-D131 IonicContact CZ-OD1 3.42Å; R91-D131 IonicContact CZ-OD2 3.64Å; R91-D131 IonicContact NE-OD1 3.25Å; R91-D131 IonicContact NE-OD2 2.76Å; R91-D131 PolarHBondContact NE-OD2 2.83Å; R91-D131 IonicContact NH2-OD1 2.78Å; R91-D131 PolarHBondContact NH2-OD1 3.42Å; R91-D131 IonicContact NH2-OD2 3.67Å; R91-D131 PolarHBondContact NH2-OD2 3.5Å
92	A	96.8	Very high	96.1	Very high	62 Å²	62	50.8 Å²	50.8	51%	0.512	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	0.8	179	0	0	0	0	0	113.9	N88 A89 I90	N88-A92 VanDerWaalsContact O-CB 3.31Å; N88-A92 WeakPolarHBondContact O-CB 3.44Å; N88-A92 PolarHBondContact O-N 3.33Å; A89-A92 PolarHBondContact O-N 3.34Å; I90-A92 PolarHBondContact O-N 3.43Å
93	S	96.5	Very high	96.1	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-131.6	-127.3	-175.8	63.1	0	0	0	0	112	A89 I90 R91 G95 A96 M332	A89-S93 VanDerWaalsContact O-CB 3.3Å; A89-S93 WeakPolarHBondContact O-CB 3.44Å; A89-S93 PolarHBondContact O-N 3.28Å; A89-S93 PolarHBondContact O-OG 2.84Å; I90-S93 CarbonylContact O-C 3.52Å; I90-S93 PolarHBondContact O-N 3.19Å; I90-S93 VanDerWaalsContact O-N 3.09Å; I90-S93 PolarHBondContact O-OG 3.44Å; R91-S93 VanDerWaalsContact C-N 3.33Å; S93-G95 PolarHBondContact O-N 3.16Å; S93-A96 VanDerWaalsContact O-CB 3.23Å; S93-A96 WeakPolarHBondContact O-CB 3.21Å; S93-A96 PolarHBondContact O-N 3Å; S93-A96 VanDerWaalsContact O-N 3.14Å; S93-M332 WeakPolarHBondContact OG-CG 3.11Å
94	W	96.6	Very high	96.1	Very high	1 Å²	1	47.4 Å²	47.4	0%	0.004	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-63.4	-27.2	-175.9	60.9	-100	0	0	0	112.7	I75 V77 I90 A96 I97 T107 T168 V172 Y173 V174 V176 M332 W336	I75-W94 HydrophobicContact CD1-CE3 4.33Å; I75-W94 HydrophobicContact CD1-CZ3 3.99Å; I75-W94 HydrophobicContact CG2-CH2 4.17Å; I75-W94 HydrophobicContact CG2-CZ3 3.88Å; V77-W94 HydrophobicContact CG2-CH2 3.73Å; V77-W94 HydrophobicContact CG2-CZ3 4.44Å; I90-W94 HydrophobicContact CB-CZ2 4.31Å; I90-W94 HydrophobicContact CD1-CH2 4.37Å; I90-W94 HydrophobicContact CD1-CZ2 3.81Å; I90-W94 HydrophobicContact CG1-CZ2 3.74Å; I90-W94 HydrophobicContact CG2-CD2 4.38Å; I90-W94 HydrophobicContact CG2-CE3 4.41Å; I90-W94 HydrophobicContact CG2-CH2 3.69Å; I90-W94 HydrophobicContact CG2-CZ2 3.65Å; I90-W94 HydrophobicContact CG2-CZ3 4.07Å; W94-A96 PolarHBondContact O-N 3Å; W94-I97 WeakPolarHBondContact O-CB 3.39Å; W94-I97 WeakPolarHBondContact O-CG1 3.38Å; W94-I97 PolarHBondContact O-N 2.81Å; W94-T107 HydrophobicContact CZ3-CG2 4.08Å; W94-T168 HydrophobicContact CH2-CG2 4.2Å; W94-V172 VanDerWaalsContact CZ2-O 3.29Å; W94-V172 WeakPolarHBondContact CZ2-O 3.19Å; W94-V172 PolarHBondContact NE1-O 2.8Å; W94-Y173 AromaticContact CD1-CD2 3.65Å; W94-Y173 AromaticContact CD1-CE2 3.96Å; W94-V174 WeakPolarHBondContact CB-O 3.34Å; W94-V174 HydrophobicContact CD2-CB 3.8Å; W94-V174 HydrophobicContact CD2-CG2 4.15Å; W94-V174 HydrophobicContact CE3-CB 3.82Å; W94-V174 HydrophobicContact CE3-CG2 4.12Å; W94-V174 HydrophobicContact CG-CB 4.3Å; W94-V174 HydrophobicContact CH2-CB 4.4Å; W94-V174 HydrophobicContact CH2-CG2 3.79Å; W94-V174 HydrophobicContact CZ2-CB 4.38Å; W94-V174 HydrophobicContact CZ2-CG2 3.79Å; W94-V174 HydrophobicContact CZ3-CB 4.15Å; W94-V174 HydrophobicContact CZ3-CG2 3.97Å; W94-V176 HydrophobicContact CB-CG2 4.31Å; W94-V176 HydrophobicContact CE3-CG2 4.05Å; W94-M332 VanDerWaalsContact CD1-SD 3.54Å; W94-M332 PolarHBondContact NE1-SD 2.83Å; W94-W336 HydrophobicContact CB-CE3 4.24Å; W94-W336 HydrophobicContact CB-CZ3 4.27Å
95	G	97.6	Very high	96.1	Very high	3 Å²	3	44 Å²	44	3%	0.031	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-70.5	-14.4	178.5	0	0	0	0	0	114	I90 S93 I97 R98 T107	I90-G95 VanDerWaalsContact O-CA 3.22Å; I90-G95 WeakPolarHBondContact O-CA 3.34Å; I90-G95 PolarHBondContact O-N 3.29Å; S93-G95 PolarHBondContact O-N 3.16Å; G95-I97 VanDerWaalsContact C-N 3.32Å; G95-R98 PolarHBondContact O-NH1 3.44Å; G95-T107 PolarHBondContact O-OG1 3.26Å
96	A	96.9	Very high	96.1	Very high	47 Å²	47	40 Å²	40	39%	0.388	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-73.9	-22.6	174.6	0	0	0	0	0	113	R91 S93 W94 R98	R91-A96 VanDerWaalsContact O-CB 3.29Å; R91-A96 WeakPolarHBondContact O-CB 3.4Å; S93-A96 VanDerWaalsContact O-CB 3.23Å; S93-A96 WeakPolarHBondContact O-CB 3.21Å; S93-A96 PolarHBondContact O-N 3Å; S93-A96 VanDerWaalsContact O-N 3.14Å; W94-A96 PolarHBondContact O-N 3Å; A96-R98 PolarHBondContact O-N 2.99Å
97	I	96.3	Very high	96.1	Very high	27 Å²	27	38.1 Å²	38.1	14%	0.138	20%	0.198	C	C	.	.			trans	-63.4	121.4	-174.9	-62.5	170.1	0	0	0	109.3	W94 G95 E99 A100 V176 P177 W336	W94-I97 WeakPolarHBondContact O-CB 3.39Å; W94-I97 WeakPolarHBondContact O-CG1 3.38Å; W94-I97 PolarHBondContact O-N 2.81Å; G95-I97 VanDerWaalsContact C-N 3.32Å; I97-E99 VanDerWaalsContact CG2-O 3.25Å; I97-E99 WeakPolarHBondContact CG2-O 3.4Å; I97-A100 HydrophobicContact CG2-CB 4.29Å; I97-V176 HydrophobicContact CB-CG1 4.39Å; I97-V176 HydrophobicContact CD1-CB 3.83Å; I97-V176 HydrophobicContact CD1-CG1 4.39Å; I97-V176 HydrophobicContact CD1-CG2 4.24Å; I97-V176 HydrophobicContact CG2-CG1 3.97Å; I97-P177 HydrophobicContact CD1-CG 4.41Å; I97-W336 HydrophobicContact CD1-CH2 3.73Å; I97-W336 HydrophobicContact CD1-CZ3 3.86Å; I97-W336 HydrophobicContact CG1-CH2 4.01Å
98	R	95.4	Very high	96.2	Very high	127 Å²	127	38 Å²	38	48%	0.479	20%	0.198	S	C	.	.			trans	-103.1	-18	176.9	-58.7	-52.3	-178.6	-145.1	2.4	113.7	G95 A96 V105	G95-R98 PolarHBondContact O-NH1 3.44Å; A96-R98 PolarHBondContact O-N 2.99Å; R98-V105 CarbonylContact C-O 3.48Å; R98-V105 WeakPolarHBondContact CA-O 3.17Å; R98-V105 PolarHBondContact O-N 3.4Å; R98-V105 VanDerWaalsContact O-O 3.11Å
99	E	94.7	Very high	96.2	Very high	134 Å²	134	35 Å²	35	63%	0.626	18%	0.182	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-145.7	137.5	177.7	-165.8	-169.1	125.7	0	0	109.8	I97 G102 F103	I97-E99 VanDerWaalsContact CG2-O 3.25Å; I97-E99 WeakPolarHBondContact CG2-O 3.4Å; E99-G102 WeakPolarHBondContact OE1-CA 3.43Å; E99-F103 CarbonylContact C-O 3.56Å; E99-F103 VanDerWaalsContact CA-O 3.3Å; E99-F103 WeakPolarHBondContact CA-O 3.41Å; E99-F103 WeakPolarHBondContact CG-O 3.18Å
100	A	93.9	Very high	96.2	Very high	7 Å²	7	35 Å²	35	6%	0.058	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	130	173.8	0	0	0	0	0	109.2	I97 G102 F103 V105 V176 V180	I97-A100 HydrophobicContact CG2-CB 4.29Å; A100-G102 PolarHBondContact O-N 3.48Å; A100-G102 VanDerWaalsContact O-N 3.15Å; A100-F103 PolarHBondContact N-O 3.43Å; A100-F103 WeakPolarHBondContact O-CB 3.48Å; A100-F103 PolarHBondContact O-N 3.13Å; A100-V105 HydrophobicContact CB-CG2 4.02Å; A100-V176 HydrophobicContact CB-CG1 4.12Å; A100-V180 HydrophobicContact CB-CB 4.21Å; A100-V180 HydrophobicContact CB-CG1 4.47Å; A100-V180 HydrophobicContact CB-CG2 3.89Å
101	R	92.1	Very high	96.1	Very high	125 Å²	125	35 Å²	35	47%	0.472	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.1	27.7	179.3	-51.5	-63.9	-173.2	-178.6	-0.1	114.2	F103 E178 V180 S181 I184	R101-F103 HydrophobicContact CB-CD2 4.49Å; R101-F103 WeakPolarHBondContact O-CD2 3.31Å; R101-E178 IonicContact CZ-OE1 3.94Å; R101-E178 IonicContact NH2-OE1 2.77Å; R101-E178 PolarHBondContact NH2-OE1 3.33Å; R101-V180 HydrophobicContact CB-CG1 4.03Å; R101-V180 HydrophobicContact CG-CG1 4.17Å; R101-S181 PolarHBondContact NE-OG 3.3Å; R101-I184 HydrophobicContact CB-CD1 4.14Å
102	G	91.7	Very high	96	Very high	42 Å²	42	33.2 Å²	33.2	43%	0.433	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.5	4.6	-176.1	0	0	0	0	0	114.3	E99 A100	E99-G102 WeakPolarHBondContact OE1-CA 3.43Å; A100-G102 PolarHBondContact O-N 3.48Å; A100-G102 VanDerWaalsContact O-N 3.15Å
103	F	93.7	Very high	95.9	Very high	20 Å²	20	35.1 Å²	35.1	9%	0.088	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	137	-178	-70.7	-83.5	0	0	0	111.4	F72 E99 A100 R101 V105 V180 I184	F72-F103 HydrophobicContact CB-CB 3.65Å; F72-F103 HydrophobicContact CB-CD1 3.82Å; F72-F103 HydrophobicContact CB-CG 4.1Å; F72-F103 HydrophobicContact CD1-CB 4.02Å; F72-F103 HydrophobicContact CD1-CD1 4.47Å; F72-F103 HydrophobicContact CD1-CG 4.27Å; F72-F103 HydrophobicContact CD2-CB 4.36Å; F72-F103 AromaticContact CD2-CD1 3.36Å; F72-F103 HydrophobicContact CD2-CD1 3.36Å; F72-F103 AromaticContact CD2-CE1 3.74Å; F72-F103 HydrophobicContact CD2-CE1 3.74Å; F72-F103 AromaticContact CD2-CG 3.95Å; F72-F103 HydrophobicContact CD2-CG 3.95Å; F72-F103 HydrophobicContact CE2-CD1 4.02Å; F72-F103 HydrophobicContact CE2-CE1 4.05Å; F72-F103 HydrophobicContact CE2-CG 4.46Å; F72-F103 HydrophobicContact CG-CB 3.76Å; F72-F103 AromaticContact CG-CD1 3.64Å; F72-F103 HydrophobicContact CG-CD1 3.64Å; F72-F103 HydrophobicContact CG-CE1 4.45Å; F72-F103 AromaticContact CG-CG 3.85Å; F72-F103 HydrophobicContact CG-CG 3.85Å; E99-F103 CarbonylContact C-O 3.56Å; E99-F103 VanDerWaalsContact CA-O 3.3Å; E99-F103 WeakPolarHBondContact CA-O 3.41Å; E99-F103 WeakPolarHBondContact CG-O 3.18Å; A100-F103 PolarHBondContact N-O 3.43Å; A100-F103 WeakPolarHBondContact O-CB 3.48Å; A100-F103 PolarHBondContact O-N 3.13Å; R101-F103 HydrophobicContact CB-CD2 4.49Å; R101-F103 WeakPolarHBondContact O-CD2 3.31Å; F103-V105 PolarHBondContact O-N 2.87Å; F103-V180 HydrophobicContact CB-CG1 4.23Å; F103-V180 HydrophobicContact CD2-CG1 4.19Å; F103-I184 HydrophobicContact CD2-CD1 3.61Å; F103-I184 HydrophobicContact CD2-CG1 4.14Å; F103-I184 HydrophobicContact CE2-CD1 3.34Å; F103-I184 HydrophobicContact CE2-CG1 3.69Å; F103-I184 HydrophobicContact CZ-CD1 4.33Å; F103-I184 HydrophobicContact CZ-CG1 4.22Å
104	R	95.1	Very high	95.7	Very high	60 Å²	60	36.3 Å²	36.3	23%	0.226	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	129.2	177.1	-176.8	-177.5	173.9	-167.4	-3.2	110.9	A63 P69 F72 L73	A63-R104 PolarHBondContact O-NH2 2.98Å; P69-R104 WeakPolarHBondContact O-CD 3.34Å; P69-R104 PolarHBondContact O-NH1 3.27Å; F72-R104 WeakPolarHBondContact CB-O 3.27Å; F72-R104 PolarHBondContact N-O 3.3Å; L73-R104 PolarHBondContact N-O 3.2Å
105	V	96.4	Very high	95.1	Very high	2 Å²	2	45.9 Å²	45.9	1%	0.012	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	140.2	173.8	-175.8	0	0	0	0	109.2	L73 I75 R98 A100 F103 V176 V180	L73-V105 HydrophobicContact CB-CG1 4.35Å; L73-V105 HydrophobicContact CB-CG2 4.31Å; L73-V105 HydrophobicContact CD2-CG1 4.32Å; L73-V105 HydrophobicContact CG-CG1 4.4Å; L73-V105 WeakPolarHBondContact O-CA 3.13Å; I75-V105 HydrophobicContact CD1-CG1 3.93Å; I75-V105 HydrophobicContact CG1-CG1 4.33Å; R98-V105 CarbonylContact C-O 3.48Å; R98-V105 WeakPolarHBondContact CA-O 3.17Å; R98-V105 PolarHBondContact O-N 3.4Å; R98-V105 VanDerWaalsContact O-O 3.11Å; A100-V105 HydrophobicContact CB-CG2 4.02Å; F103-V105 PolarHBondContact O-N 2.87Å; V105-V176 HydrophobicContact CB-CG1 4.3Å; V105-V176 HydrophobicContact CG1-CG1 3.82Å; V105-V176 HydrophobicContact CG2-CG1 3.9Å; V105-V180 HydrophobicContact CG2-CG2 3.93Å
106	Q	96.5	Very high	94.4	Very high	32 Å²	32	53.9 Å²	53.9	15%	0.15	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	136.8	174.9	-173.6	142.4	15.1	0	0	111.2	A63 P71 L73 L74 I75	A63-Q106 PolarHBondContact O-OE1 3.36Å; P71-Q106 HydrophobicContact CB-CB 4.45Å; L73-Q106 PolarHBondContact O-N 3.38Å; L74-Q106 CarbonylContact C-O 3.09Å; L74-Q106 WeakPolarHBondContact CA-O 3.38Å; L74-Q106 HydrophobicContact CD1-CB 3.92Å; L74-Q106 HydrophobicContact CD1-CG 4.14Å; I75-Q106 PolarHBondContact N-O 3.33Å
107	T	98.3	Very high	93	Very high	5 Å²	5	60.8 Å²	60.8	3%	0.031	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	131	178.9	-53.8	0	0	0	0	109	I75 V77 I90 W94 G95	I75-T107 HydrophobicContact CB-CG2 4.31Å; I75-T107 HydrophobicContact CG2-CG2 4.44Å; I75-T107 WeakPolarHBondContact O-CA 3.18Å; V77-T107 HydrophobicContact CG2-CG2 3.73Å; I90-T107 HydrophobicContact CG2-CG2 4.38Å; W94-T107 HydrophobicContact CZ3-CG2 4.08Å; G95-T107 PolarHBondContact O-OG1 3.26Å
108	L	98.4	Very high	91.4	Very high	0 Å²	0	68.4 Å²	68.4	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	142.6	175.8	-62	176.6	0	0	0	109.7	A63 L74 I75 L76 V77 D131 L133 W154	A63-L108 HydrophobicContact CB-CD1 4.26Å; A63-L108 HydrophobicContact CB-CD2 4.28Å; L74-L108 HydrophobicContact CD1-CD1 3.87Å; L74-L108 HydrophobicContact CD1-CG 4.14Å; I75-L108 PolarHBondContact O-N 2.86Å; L76-L108 HydrophobicContact CD2-CB 4.18Å; V77-L108 PolarHBondContact N-O 3.47Å; L108-D131 CarbonylContact C-O 3.58Å; L108-D131 VanDerWaalsContact CA-O 3.3Å; L108-D131 WeakPolarHBondContact CA-O 3.33Å; L108-D131 HydrophobicContact CD2-CB 4.24Å; L108-L133 HydrophobicContact CB-CD1 4.35Å; L108-L133 HydrophobicContact CD1-CD1 4.04Å; L108-L133 HydrophobicContact CD1-CG 4.42Å; L108-W154 HydrophobicContact CD1-CE3 4.34Å; L108-W154 HydrophobicContact CD1-CH2 3.28Å; L108-W154 HydrophobicContact CD1-CZ2 4.13Å; L108-W154 HydrophobicContact CD1-CZ3 3.41Å; L108-W154 VanDerWaalsContact CD1-CZ3 3.41Å
109	F	98.6	Very high	89.9	Confident	2 Å²	2	67.1 Å²	67.1	1%	0.009	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	129.7	176.8	-62.5	-75.5	0	0	0	110.4	V77 T79 R87 I90 R91 L111 D131 I132 L133	V77-F109 HydrophobicContact CB-CD1 3.71Å; V77-F109 HydrophobicContact CB-CE1 4.05Å; V77-F109 HydrophobicContact CG1-CD1 3.88Å; V77-F109 HydrophobicContact CG1-CE1 4.02Å; V77-F109 HydrophobicContact CG2-CD1 4.32Å; V77-F109 HydrophobicContact CG2-CE1 4.25Å; V77-F109 WeakPolarHBondContact O-CA 3.41Å; T79-F109 HydrophobicContact CG2-CB 3.92Å; T79-F109 HydrophobicContact CG2-CD1 4.04Å; T79-F109 HydrophobicContact CG2-CG 4.39Å; R87-F109 HydrophobicContact CB-CD1 4.27Å; R87-F109 HydrophobicContact CB-CE1 3.98Å; R87-F109 HydrophobicContact CB-CE2 4.36Å; R87-F109 HydrophobicContact CB-CZ 4.02Å; R87-F109 HydrophobicContact CG-CD1 3.66Å; R87-F109 HydrophobicContact CG-CD2 4.49Å; R87-F109 HydrophobicContact CG-CE1 3.84Å; R87-F109 HydrophobicContact CG-CG 4.02Å; R87-F109 HydrophobicContact CG-CZ 4.33Å; I90-F109 HydrophobicContact CB-CE1 4.07Å; I90-F109 HydrophobicContact CB-CZ 4.01Å; I90-F109 HydrophobicContact CD1-CE1 4.12Å; I90-F109 HydrophobicContact CG2-CE1 3.89Å; I90-F109 HydrophobicContact CG2-CZ 3.75Å; R91-F109 HydrophobicContact CG-CE2 3.81Å; R91-F109 HydrophobicContact CG-CZ 4Å; F109-L111 HydrophobicContact CB-CD1 3.86Å; F109-D131 HydrophobicContact CD2-CB 4.33Å; F109-D131 WeakPolarHBondContact CE2-OD2 3.29Å; F109-D131 PolarHBondContact N-O 3.46Å; F109-I132 CarbonylContact O-C 3.58Å; F109-L133 PolarHBondContact O-N 3.28Å
110	L	98.4	Very high	88.4	Confident	2 Å²	2	62.1 Å²	62.1	1%	0.01	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	119	-177.3	-176.7	61.1	0	0	0	110.4	V77 T79 L133 K147	V77-L110 PolarHBondContact O-N 3.44Å; T79-L110 PolarHBondContact N-O 3.11Å; T79-L110 VanDerWaalsContact N-O 3.13Å; L110-L133 WeakPolarHBondContact CA-O 3.07Å; L110-L133 HydrophobicContact CD1-CB 3.76Å; L110-L133 HydrophobicContact CD1-CD1 4.48Å; L110-K147 HydrophobicContact CD2-CG 3.93Å; L110-K147 VanDerWaalsContact CD2-O 3.24Å; L110-K147 WeakPolarHBondContact CD2-O 3.4Å; L110-K147 HydrophobicContact CG-CD 4.44Å; L110-K147 HydrophobicContact CG-CG 3.72Å; L110-K147 WeakPolarHBondContact O-CD 3.35Å
111	L	97.3	Very high	87.8	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	156	-170.2	-59.4	99.4	0	0	0	112.8	T79 P81 F109 L122 I132 L133 Q134 A135	T79-L111 HydrophobicContact CG2-CD1 3.92Å; T79-L111 HydrophobicContact CG2-CD2 3.8Å; T79-L111 HydrophobicContact CG2-CG 3.59Å; P81-L111 HydrophobicContact CG-CD2 4.4Å; F109-L111 HydrophobicContact CB-CD1 3.86Å; L111-L122 HydrophobicContact CD2-CD1 4.35Å; L111-L122 HydrophobicContact CD2-CD2 3.92Å; L111-I132 HydrophobicContact CD1-CB 4.43Å; L111-I132 HydrophobicContact CD1-CG1 4.25Å; L111-I132 HydrophobicContact CD1-CG2 3.72Å; L111-L133 PolarHBondContact N-O 3.03Å; L111-Q134 HydrophobicContact CB-CG 4.5Å; L111-Q134 WeakPolarHBondContact O-CA 3.33Å; L111-A135 PolarHBondContact O-N 2.94Å
112	G	95.8	Very high	87.8	Confident	0 Å²	0	61 Å²	61	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	-162.4	161.8	0	0	0	0	0	112.2	P81 Q134 F137	P81-G112 WeakPolarHBondContact CG-O 3.05Å; G112-Q134 PolarHBondContact O-NE2 3.26Å; G112-Q134 VanDerWaalsContact O-NE2 3.1Å; G112-F137 CarbonylContact C-O 3.59Å
113	K	94.2	Very high	87.7	Confident	101 Å²	101	63 Å²	63	44%	0.439	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	143	170.4	-63.9	174.5	63	-172.9	0	110.3	L57 F137 D139	L57-K113 HydrophobicContact CD1-CD 4.19Å; L57-K113 HydrophobicContact CD1-CG 3.8Å; K113-F137 WeakPolarHBondContact CB-O 3.33Å; K113-F137 PolarHBondContact N-O 2.91Å; K113-D139 WeakPolarHBondContact O-CB 3.39Å; K113-D139 PolarHBondContact O-N 2.91Å
114	P	91.7	Very high	87.6	Confident	26 Å²	26	65.3 Å²	65.3	17%	0.169	32%	0.316	C	S	.	.			trans	-62.8	153	173.2	28.5	-35.4	0	0	0	110.5	P81 R116	P81-P114 HydrophobicContact CB-CB 3.85Å; P81-P114 HydrophobicContact CG-CB 4.18Å; P114-R116 VanDerWaalsContact C-N 3.26Å; P114-R116 WeakPolarHBondContact CB-O 3.18Å; P114-R116 PolarHBondContact O-N 3.23Å
115	R	84.8	Confident	87.6	Confident	202 Å²	202	63.6 Å²	63.6	76%	0.762	31%	0.31	S	S	*	.	S	Bend	trans	-67.8	-29.3	176.7	178.8	164.7	-173	-178	3	112.2
116	R	82.1	Confident	87.5	Confident	170 Å²	170	64.3 Å²	64.3	64%	0.642	32%	0.315	S	S	*	.	S	Bend	trans	-119.6	132.4	175.7	-62.5	-173	-173.7	106.1	-4.2	108.9	P114 Q118 L119	P114-R116 VanDerWaalsContact C-N 3.26Å; P114-R116 WeakPolarHBondContact CB-O 3.18Å; P114-R116 PolarHBondContact O-N 3.23Å; R116-Q118 PolarHBondContact O-N 3.47Å; R116-Q118 VanDerWaalsContact O-N 3.15Å; R116-L119 HydrophobicContact CB-CD1 3.67Å; R116-L119 HydrophobicContact CG-CD1 4.16Å
117	Q	68.1	Low	87.4	Confident	192 Å²	192	66.2 Å²	66.2	90%	0.897	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-25.6	-175.9	-103.9	167.7	-26.8	0	0	114.3
118	Q	61.6	Low	87.3	Confident	188 Å²	188	69.6 Å²	69.6	88%	0.879	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	-1.1	-169.8	-73.5	152.7	-27.5	0	0	115.2	R116	R116-Q118 PolarHBondContact O-N 3.47Å; R116-Q118 VanDerWaalsContact O-N 3.15Å
119	L	64	Low	87.1	Confident	99 Å²	99	74 Å²	74	52%	0.518	39%	0.386	S	S	.	.	S	Bend	trans	-96.3	-17.1	-165.2	-101.3	132	0	0	0	116.4	R116	R116-L119 HydrophobicContact CB-CD1 3.67Å; R116-L119 HydrophobicContact CG-CD1 4.16Å
120	A	64	Low	87	Confident	29 Å²	29	82.6 Å²	82.6	24%	0.24	42%	0.418	C	S	.	.			trans	-146.9	113.5	-176.5	0	0	0	0	0	112.7	P81 L122	P81-A120 HydrophobicContact CB-CB 4.05Å; A120-L122 HydrophobicContact CB-CD2 4.48Å; A120-L122 HydrophobicContact CB-CG 4.06Å; A120-L122 PolarHBondContact O-N 2.98Å
121	D	82.1	Confident	86.9	Confident	102 Å²	102	83 Å²	83	55%	0.545	42%	0.42	S	S	.	.			trans	-81.1	72.1	166.3	-173.3	2.4	0	0	0	110.4	S123 S124 E125	D121-S123 PolarHBondContact O-N 3.27Å; D121-S123 WeakPolarHBondContact OD1-CB 3.46Å; D121-S123 PolarHBondContact OD1-N 2.98Å; D121-S124 VanDerWaalsContact CG-OG 3.25Å; D121-S124 PolarHBondContact O-N 3.49Å; D121-S124 PolarHBondContact OD1-N 2.69Å; D121-S124 PolarHBondContact OD1-OG 3.19Å; D121-S124 WeakPolarHBondContact OD2-CB 3.45Å; D121-S124 PolarHBondContact OD2-OG 2.7Å; D121-E125 PolarHBondContact O-N 2.83Å
122	L	90.7	Very high	86.9	Confident	6 Å²	6	83 Å²	83	3%	0.031	42%	0.42	C	S	.	.	H	α-helix	trans	-65.3	-20.5	176.4	-68.8	172.9	0	0	0	112.4	I58 P81 L111 A120 S126 I132 Q134	I58-L122 HydrophobicContact CD1-CB 4.32Å; P81-L122 HydrophobicContact CB-CD1 4.04Å; P81-L122 HydrophobicContact CG-CD1 4.23Å; L111-L122 HydrophobicContact CD2-CD1 4.35Å; L111-L122 HydrophobicContact CD2-CD2 3.92Å; A120-L122 HydrophobicContact CB-CD2 4.48Å; A120-L122 HydrophobicContact CB-CG 4.06Å; A120-L122 PolarHBondContact O-N 2.98Å; L122-S126 WeakPolarHBondContact O-CB 3.32Å; L122-S126 PolarHBondContact O-N 3.23Å; L122-I132 HydrophobicContact CD2-CD1 4.28Å; L122-Q134 VanDerWaalsContact CD1-NE2 3.29Å
123	S	90	Very high	87	Confident	86 Å²	86	83 Å²	83	60%	0.601	42%	0.421	S	S	*	.	H	α-helix	trans	-69.3	-48.5	177.9	-62.9	0	0	0	0	110.7	D121 S126 A127	D121-S123 PolarHBondContact O-N 3.27Å; D121-S123 WeakPolarHBondContact OD1-CB 3.46Å; D121-S123 PolarHBondContact OD1-N 2.98Å; S123-S126 PolarHBondContact O-N 3.31Å; S123-A127 WeakPolarHBondContact O-CB 3.49Å; S123-A127 PolarHBondContact O-N 2.91Å
124	S	92.6	Very high	87.1	Confident	68 Å²	68	79 Å²	79	48%	0.476	40%	0.403	S	S	.	.	H	α-helix	trans	-64.9	-42.1	175.4	-66.4	0	0	0	0	111.9	D121 S126 A127 A128	D121-S124 VanDerWaalsContact CG-OG 3.25Å; D121-S124 PolarHBondContact O-N 3.49Å; D121-S124 PolarHBondContact OD1-N 2.69Å; D121-S124 PolarHBondContact OD1-OG 3.19Å; D121-S124 WeakPolarHBondContact OD2-CB 3.45Å; D121-S124 PolarHBondContact OD2-OG 2.7Å; S124-S126 PolarHBondContact O-N 3.36Å; S124-A127 PolarHBondContact O-N 2.96Å; S124-A128 PolarHBondContact O-N 2.91Å
125	E	95.1	Very high	87.4	Confident	23 Å²	23	77.8 Å²	77.8	11%	0.107	40%	0.395	C	S	.	.	H	α-helix	trans	-60.6	-45.5	175.3	-169.9	-174.7	164.5	0	0	111.4	L84 R87 R91 D121 A127 A128 H129 I132	L84-E125 HydrophobicContact CD1-CG 4.39Å; R87-E125 IonicContact CZ-OE1 3.58Å; R87-E125 IonicContact CZ-OE2 3.43Å; R87-E125 IonicContact NE-OE1 2.79Å; R87-E125 PolarHBondContact NE-OE1 2.88Å; R87-E125 IonicContact NE-OE2 2.69Å; R87-E125 PolarHBondContact NE-OE2 3.28Å; R87-E125 IonicContact NH2-OE1 3.32Å; R87-E125 IonicContact NH2-OE2 2.73Å; R87-E125 PolarHBondContact NH2-OE2 2.88Å; R91-E125 IonicContact CZ-OE1 3.87Å; R91-E125 VanDerWaalsContact CZ-OE1 3.25Å; R91-E125 IonicContact NH1-OE1 3.42Å; R91-E125 PolarHBondContact NH1-OE1 2.81Å; R91-E125 IonicContact NH2-OE1 2.72Å; R91-E125 PolarHBondContact NH2-OE1 3.42Å; D121-E125 PolarHBondContact O-N 2.83Å; E125-A127 VanDerWaalsContact C-N 3.33Å; E125-A127 PolarHBondContact O-N 3.44Å; E125-A128 PolarHBondContact O-N 2.92Å; E125-H129 PolarHBondContact O-CD2 3.44Å; E125-H129 PolarHBondContact O-N 2.93Å; E125-I132 HydrophobicContact CB-CD1 3.98Å; E125-I132 HydrophobicContact CG-CD1 3.73Å
126	S	94.5	Very high	87.9	Confident	17 Å²	17	70 Å²	70	12%	0.119	37%	0.372	C	S	.	.	H	α-helix	trans	-66	-35.6	178.1	-177.8	0	0	0	0	112.3	I58 L122 S123 S124 A128 R130	I58-S126 VanDerWaalsContact CG2-OG 3.28Å; I58-S126 WeakPolarHBondContact CG2-OG 3.46Å; L122-S126 WeakPolarHBondContact O-CB 3.32Å; L122-S126 PolarHBondContact O-N 3.23Å; S123-S126 PolarHBondContact O-N 3.31Å; S124-S126 PolarHBondContact O-N 3.36Å; S126-A128 VanDerWaalsContact C-N 3.32Å; S126-R130 VanDerWaalsContact O-CA 3.27Å; S126-R130 WeakPolarHBondContact O-CA 3.46Å; S126-R130 PolarHBondContact O-N 2.76Å
127	A	93.8	Very high	88.5	Confident	72 Å²	72	62.6 Å²	62.6	60%	0.595	34%	0.344	S	S	*	.	H	α-helix	trans	-64.8	-39.2	176.3	0	0	0	0	0	111.4	S123 S124 E125	S123-A127 WeakPolarHBondContact O-CB 3.49Å; S123-A127 PolarHBondContact O-N 2.91Å; S124-A127 PolarHBondContact O-N 2.96Å; E125-A127 VanDerWaalsContact C-N 3.33Å; E125-A127 PolarHBondContact O-N 3.44Å
128	A	95.2	Very high	89.8	Confident	77 Å²	77	58.2 Å²	58.2	64%	0.636	32%	0.324	S	S	*	.	H	α-helix	trans	-72	-46.2	179.4	0	0	0	0	0	113.1	S124 E125 S126	S124-A128 PolarHBondContact O-N 2.91Å; E125-A128 PolarHBondContact O-N 2.92Å; S126-A128 VanDerWaalsContact C-N 3.32Å
129	H	95.6	Very high	91.4	Very high	91 Å²	91	50.5 Å²	50.5	42%	0.421	29%	0.288	S	S	.	.	H	α-helix	trans	-103.1	-24.3	-170.1	-64.1	-68.6	0	0	0	114.8	E125 D131	E125-H129 PolarHBondContact O-CD2 3.44Å; E125-H129 PolarHBondContact O-N 2.93Å; H129-D131 VanDerWaalsContact CB-OD1 3.3Å; H129-D131 WeakPolarHBondContact CB-OD1 3.25Å; H129-D131 PolarHBondContact O-N 3.33Å
130	R	95.4	Very high	92.9	Very high	184 Å²	184	48 Å²	48	69%	0.694	28%	0.279	S	S	*	.			trans	50.2	38.8	-178.1	-55.5	179.9	-179.9	176.9	-1.7	113.2	N60 S126	N60-R130 PolarHBondContact ND2-O 3.18Å; N60-R130 PolarHBondContact OD1-O 2.92Å; S126-R130 VanDerWaalsContact O-CA 3.27Å; S126-R130 WeakPolarHBondContact O-CA 3.46Å; S126-R130 PolarHBondContact O-N 2.76Å
131	D	96.8	Very high	94.3	Very high	10 Å²	10	50.8 Å²	50.8	5%	0.053	28%	0.284	C	S	.	.			trans	-126.1	7.5	-179	62.4	5.6	0	0	0	113	R91 L108 F109 H129	R91-D131 IonicContact CZ-OD1 3.42Å; R91-D131 IonicContact CZ-OD2 3.64Å; R91-D131 IonicContact NE-OD1 3.25Å; R91-D131 IonicContact NE-OD2 2.76Å; R91-D131 PolarHBondContact NE-OD2 2.83Å; R91-D131 IonicContact NH2-OD1 2.78Å; R91-D131 PolarHBondContact NH2-OD1 3.42Å; R91-D131 IonicContact NH2-OD2 3.67Å; R91-D131 PolarHBondContact NH2-OD2 3.5Å; L108-D131 CarbonylContact C-O 3.58Å; L108-D131 VanDerWaalsContact CA-O 3.3Å; L108-D131 WeakPolarHBondContact CA-O 3.33Å; L108-D131 HydrophobicContact CD2-CB 4.24Å; F109-D131 HydrophobicContact CD2-CB 4.33Å; F109-D131 WeakPolarHBondContact CE2-OD2 3.29Å; F109-D131 PolarHBondContact N-O 3.46Å; H129-D131 VanDerWaalsContact CB-OD1 3.3Å; H129-D131 WeakPolarHBondContact CB-OD1 3.25Å; H129-D131 PolarHBondContact O-N 3.33Å
132	I	97.6	Very high	94.9	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	135.5	-177.4	-69.9	176.8	0	0	0	111.5	I58 N60 F109 L111 L122 E125 Q134	I58-I132 HydrophobicContact CB-CG2 4.44Å; I58-I132 HydrophobicContact CD1-CG2 4.03Å; I58-I132 HydrophobicContact CG2-CG2 4.26Å; I58-I132 WeakPolarHBondContact CG2-O 3.49Å; N60-I132 WeakPolarHBondContact CB-O 3.03Å; F109-I132 CarbonylContact O-C 3.58Å; L111-I132 HydrophobicContact CD1-CB 4.43Å; L111-I132 HydrophobicContact CD1-CG1 4.25Å; L111-I132 HydrophobicContact CD1-CG2 3.72Å; L122-I132 HydrophobicContact CD2-CD1 4.28Å; E125-I132 HydrophobicContact CB-CD1 3.98Å; E125-I132 HydrophobicContact CG-CD1 3.73Å; I132-Q134 HydrophobicContact CG2-CB 4.37Å
133	L	97.7	Very high	95.2	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.005	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	120.1	164.2	-58.4	179.3	0	0	0	108	S59 N60 L76 L108 F109 L110 L111 W154	S59-L133 VanDerWaalsContact O-CD2 3.23Å; S59-L133 WeakPolarHBondContact O-CD2 3.1Å; N60-L133 HydrophobicContact CB-CD2 3.71Å; L76-L133 HydrophobicContact CD2-CD1 4.22Å; L108-L133 HydrophobicContact CB-CD1 4.35Å; L108-L133 HydrophobicContact CD1-CD1 4.04Å; L108-L133 HydrophobicContact CD1-CG 4.42Å; F109-L133 PolarHBondContact O-N 3.28Å; L110-L133 WeakPolarHBondContact CA-O 3.07Å; L110-L133 HydrophobicContact CD1-CB 3.76Å; L110-L133 HydrophobicContact CD1-CD1 4.48Å; L111-L133 PolarHBondContact N-O 3.03Å; L133-W154 HydrophobicContact CD1-CD2 3.55Å; L133-W154 HydrophobicContact CD1-CE3 3.61Å; L133-W154 HydrophobicContact CD1-CG 3.95Å; L133-W154 HydrophobicContact CD1-CH2 4.49Å; L133-W154 HydrophobicContact CD1-CZ2 4.42Å; L133-W154 HydrophobicContact CD1-CZ3 4.11Å; L133-W154 HydrophobicContact CD2-CD2 3.91Å; L133-W154 VanDerWaalsContact CD2-CE2 3.46Å; L133-W154 HydrophobicContact CD2-CG 4.21Å; L133-W154 HydrophobicContact CD2-CZ2 3.81Å; L133-W154 HydrophobicContact CG-CD2 4.4Å
134	Q	96.8	Very high	95.5	Very high	17 Å²	17	50.6 Å²	50.6	8%	0.079	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	123.6	-179.9	-167.7	-174.4	20.6	0	0	111	L56 L57 I58 L111 G112 L122 I132	L56-Q134 CarbonylContact C-O 3.53Å; L56-Q134 VanDerWaalsContact CA-O 3.31Å; L56-Q134 WeakPolarHBondContact CA-O 3.35Å; L57-Q134 HydrophobicContact CB-CB 4.36Å; L57-Q134 HydrophobicContact CB-CG 4.37Å; L57-Q134 HydrophobicContact CD1-CG 4.34Å; L57-Q134 PolarHBondContact N-O 2.93Å; I58-Q134 HydrophobicContact CB-CB 3.83Å; I58-Q134 HydrophobicContact CD1-CB 4.13Å; I58-Q134 HydrophobicContact CG1-CB 4Å; I58-Q134 PolarHBondContact N-O 2.99Å; I58-Q134 PolarHBondContact O-N 3.28Å; L111-Q134 HydrophobicContact CB-CG 4.5Å; L111-Q134 WeakPolarHBondContact O-CA 3.33Å; G112-Q134 PolarHBondContact O-NE2 3.26Å; G112-Q134 VanDerWaalsContact O-NE2 3.1Å; L122-Q134 VanDerWaalsContact CD1-NE2 3.29Å; I132-Q134 HydrophobicContact CG2-CB 4.37Å
135	A	96.8	Very high	95.7	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	150.6	177.1	0	0	0	0	0	112.3	L56 L111 F137	L56-A135 HydrophobicContact CD2-CB 3.95Å; L111-A135 PolarHBondContact O-N 2.94Å; A135-F137 VanDerWaalsContact C-N 3.25Å; A135-F137 HydrophobicContact CB-CD1 3.63Å; A135-F137 HydrophobicContact CB-CE1 3.24Å; A135-F137 HydrophobicContact CB-CZ 4.11Å; A135-F137 PolarHBondContact O-N 3.38Å
136	S	95.5	Very high	95.8	Very high	38 Å²	38	49.7 Å²	49.7	27%	0.266	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	49.6	-170.4	74.7	0	0	0	0	114.3	R55	R55-S136 VanDerWaalsContact CG-OG 3.29Å; R55-S136 WeakPolarHBondContact CG-OG 3.37Å; R55-S136 PolarHBondContact N-OG 2.97Å; R55-S136 VanDerWaalsContact O-CB 3.25Å; R55-S136 WeakPolarHBondContact O-CB 3.43Å; R55-S136 PolarHBondContact O-N 3.12Å; R55-S136 PolarHBondContact O-OG 2.84Å; R55-S136 VanDerWaalsContact O-OG 3.13Å
137	F	95.3	Very high	96	Very high	15 Å²	15	49.1 Å²	49.1	7%	0.066	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	156.3	173.3	60.8	-99.8	0	0	0	110	P54 G112 K113 A135 D139 N143 L146 K147	P54-F137 HydrophobicContact CB-CD1 4.08Å; P54-F137 HydrophobicContact CG-CB 4.29Å; P54-F137 HydrophobicContact CG-CD1 3.86Å; G112-F137 CarbonylContact C-O 3.59Å; K113-F137 WeakPolarHBondContact CB-O 3.33Å; K113-F137 PolarHBondContact N-O 2.91Å; A135-F137 VanDerWaalsContact C-N 3.25Å; A135-F137 HydrophobicContact CB-CD1 3.63Å; A135-F137 HydrophobicContact CB-CE1 3.24Å; A135-F137 HydrophobicContact CB-CZ 4.11Å; A135-F137 PolarHBondContact O-N 3.38Å; F137-D139 PolarHBondContact O-N 3.32Å; F137-N143 HydrophobicContact CD2-CB 3.94Å; F137-N143 HydrophobicContact CE2-CB 4.16Å; F137-L146 HydrophobicContact CD1-CB 4.24Å; F137-L146 HydrophobicContact CE1-CB 4.25Å; F137-K147 HydrophobicContact CE1-CB 4.33Å; F137-K147 HydrophobicContact CE2-CB 4.14Å; F137-K147 HydrophobicContact CZ-CB 3.47Å; F137-K147 VanDerWaalsContact CZ-CB 3.47Å; F137-K147 HydrophobicContact CZ-CG 3.91Å
138	Q	95.2	Very high	96.2	Very high	100 Å²	100	45.9 Å²	45.9	47%	0.467	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	128.2	176.1	-179.2	177.2	9.3	0	0	110.5	S140 N143	Q138-S140 PolarHBondContact O-N 3.04Å; Q138-N143 PolarHBondContact O-ND2 3.27Å
139	D	94.7	Very high	96.3	Very high	25 Å²	25	42.6 Å²	42.6	13%	0.134	20%	0.198	C	C	.	.			trans	-70.8	128	-178.1	-156.5	17.7	0	0	0	112.1	A80 P81 K113 F137 K147	A80-D139 VanDerWaalsContact CA-OD2 3.28Å; A80-D139 WeakPolarHBondContact CA-OD2 3.3Å; P81-D139 VanDerWaalsContact CD-OD2 3.26Å; P81-D139 WeakPolarHBondContact CD-OD2 3.49Å; P81-D139 HydrophobicContact CG-CB 4.45Å; K113-D139 WeakPolarHBondContact O-CB 3.39Å; K113-D139 PolarHBondContact O-N 2.91Å; F137-D139 PolarHBondContact O-N 3.32Å; D139-K147 WeakPolarHBondContact OD1-CE 3.4Å; D139-K147 IonicContact OD1-NZ 3.2Å; D139-K147 PolarHBondContact OD1-NZ 3.42Å; D139-K147 IonicContact OD2-NZ 3.75Å; D139-K147 PolarHBondContact OD2-NZ 3.13Å
140	S	95	Very high	96.5	Very high	47 Å²	47	38.4 Å²	38.4	33%	0.329	18%	0.179	S	C	.	.			trans	-163.9	158.2	178.4	73	0	0	0	0	110.4	Q138 R142 N143 L144	Q138-S140 PolarHBondContact O-N 3.04Å; S140-R142 PolarHBondContact O-N 2.92Å; S140-N143 PolarHBondContact O-N 2.98Å; S140-N143 PolarHBondContact OG-N 3.19Å; S140-N143 PolarHBondContact OG-ND2 2.87Å; S140-L144 PolarHBondContact O-N 3.36Å
141	Y	93.9	Very high	96.6	Very high	87 Å²	87	29.6 Å²	29.6	34%	0.341	15%	0.146	S	C	.	.	G	3₁₀ helix	trans	-55.3	-40.3	176.5	-174.3	-97.2	0	0	0	112.5	N143 L144 R236 H237	Y141-N143 PolarHBondContact O-N 3.18Å; Y141-L144 HydrophobicContact CD2-CD1 3.56Å; Y141-L144 HydrophobicContact CE2-CD1 3.71Å; Y141-L144 HydrophobicContact CG-CD1 4.22Å; Y141-L144 WeakPolarHBondContact O-CB 3.39Å; Y141-L144 WeakPolarHBondContact O-CD1 3.48Å; Y141-L144 WeakPolarHBondContact O-CG 3.48Å; Y141-L144 PolarHBondContact O-N 3.35Å; Y141-R236 HydrophobicContact CD1-CB 4.07Å; Y141-R236 HydrophobicContact CD1-CG 4.47Å; Y141-R236 HydrophobicContact CE1-CB 4Å; Y141-R236 HydrophobicContact CE1-CG 3.96Å; Y141-R236 WeakPolarHBondContact CE1-O 3.31Å; Y141-H237 PolarHBondContact OH-CD2 2.9Å; Y141-H237 VanDerWaalsContact OH-CD2 3.24Å; Y141-H237 PolarHBondContact OH-NE2 3.22Å
142	R	95.1	Very high	96.7	Very high	119 Å²	119	29.2 Å²	29.2	45%	0.449	14%	0.144	S	C	.	.	G	3₁₀ helix	trans	-70.8	-16.3	179	-65.2	-172.5	66.4	85	-2.1	113.7	S140 P281	S140-R142 PolarHBondContact O-N 2.92Å; R142-P281 HydrophobicContact CB-CB 4.36Å
143	N	96.6	Very high	96.7	Very high	43 Å²	43	32.4 Å²	32.4	23%	0.23	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-97.1	7.9	176.8	-70.9	-20.9	0	0	0	113	F137 Q138 S140 Y141 T145 L146 K147	F137-N143 HydrophobicContact CD2-CB 3.94Å; F137-N143 HydrophobicContact CE2-CB 4.16Å; Q138-N143 PolarHBondContact O-ND2 3.27Å; S140-N143 PolarHBondContact O-N 2.98Å; S140-N143 PolarHBondContact OG-N 3.19Å; S140-N143 PolarHBondContact OG-ND2 2.87Å; Y141-N143 PolarHBondContact O-N 3.18Å; N143-T145 PolarHBondContact O-N 3.14Å; N143-L146 PolarHBondContact O-N 2.8Å; N143-L146 VanDerWaalsContact O-N 3.12Å; N143-K147 PolarHBondContact O-N 2.96Å
144	L	97.1	Very high	96.7	Very high	28 Å²	28	32.4 Å²	32.4	15%	0.147	16%	0.161	C	C	.	.	H	α-helix	trans	-58.7	-36	176.4	-72.1	175.9	0	0	0	112.2	S140 Y141 L146 K147 T148 E283	S140-L144 PolarHBondContact O-N 3.36Å; Y141-L144 HydrophobicContact CD2-CD1 3.56Å; Y141-L144 HydrophobicContact CE2-CD1 3.71Å; Y141-L144 HydrophobicContact CG-CD1 4.22Å; Y141-L144 WeakPolarHBondContact O-CB 3.39Å; Y141-L144 WeakPolarHBondContact O-CD1 3.48Å; Y141-L144 WeakPolarHBondContact O-CG 3.48Å; Y141-L144 PolarHBondContact O-N 3.35Å; L144-L146 VanDerWaalsContact C-N 3.34Å; L144-L146 PolarHBondContact O-N 2.88Å; L144-K147 HydrophobicContact CD2-CD 4.21Å; L144-K147 WeakPolarHBondContact O-CA 3.29Å; L144-K147 WeakPolarHBondContact O-CB 3.25Å; L144-K147 PolarHBondContact O-N 2.84Å; L144-K147 VanDerWaalsContact O-N 3.14Å; L144-T148 PolarHBondContact O-N 3.39Å; L144-E283 HydrophobicContact CB-CB 3.77Å; L144-E283 HydrophobicContact CB-CG 4.25Å
145	T	97	Very high	96.7	Very high	13 Å²	13	31.6 Å²	31.6	8%	0.08	16%	0.157	C	C	.	.	H	α-helix	trans	-58.9	-45.4	175	-52.1	0	0	0	0	111.6	N143 K147 L149 L280 E283 F286	N143-T145 PolarHBondContact O-N 3.14Å; T145-K147 VanDerWaalsContact C-N 3.35Å; T145-L149 HydrophobicContact CG2-CD1 4.17Å; T145-L149 WeakPolarHBondContact O-CB 3.43Å; T145-L149 VanDerWaalsContact O-CG 3.32Å; T145-L149 WeakPolarHBondContact O-CG 3.49Å; T145-L149 PolarHBondContact O-N 3.16Å; T145-L280 PolarHBondContact OG1-O 2.76Å; T145-E283 WeakPolarHBondContact OG1-CA 3.35Å; T145-F286 HydrophobicContact CG2-CB 3.82Å; T145-F286 HydrophobicContact CG2-CD1 3.65Å; T145-F286 HydrophobicContact CG2-CD2 3.83Å; T145-F286 HydrophobicContact CG2-CE1 4.2Å; T145-F286 HydrophobicContact CG2-CE2 4.33Å; T145-F286 HydrophobicContact CG2-CG 3.45Å; T145-F286 VanDerWaalsContact CG2-CG 3.45Å
146	L	96.9	Very high	96.7	Very high	60 Å²	60	34.1 Å²	34.1	31%	0.314	17%	0.17	S	C	.	.	H	α-helix	trans	-65.3	-40.7	175.7	-68.2	176.5	0	0	0	111.2	F137 N143 L144 L149 S150	F137-L146 HydrophobicContact CD1-CB 4.24Å; F137-L146 HydrophobicContact CE1-CB 4.25Å; N143-L146 PolarHBondContact O-N 2.8Å; N143-L146 VanDerWaalsContact O-N 3.12Å; L144-L146 VanDerWaalsContact C-N 3.34Å; L144-L146 PolarHBondContact O-N 2.88Å; L146-L149 PolarHBondContact O-N 3.34Å; L146-S150 WeakPolarHBondContact O-CB 3.31Å; L146-S150 PolarHBondContact O-N 3.43Å; L146-S150 PolarHBondContact O-OG 3.45Å; L146-S150 VanDerWaalsContact O-OG 3.13Å
147	K	98	Very high	96.7	Very high	5 Å²	5	38.7 Å²	38.7	2%	0.022	19%	0.185	C	C	.	.	H	α-helix	trans	-56.1	-57.8	175.5	-169.9	177.8	-73.2	-173.3	0	110.6	C78 T79 L110 F137 D139 N143 L144 T145 L149 S150 G151	C78-K147 HydrophobicContact CB-CD 3.95Å; T79-K147 PolarHBondContact O-NZ 2.82Å; L110-K147 HydrophobicContact CD2-CG 3.93Å; L110-K147 VanDerWaalsContact CD2-O 3.24Å; L110-K147 WeakPolarHBondContact CD2-O 3.4Å; L110-K147 HydrophobicContact CG-CD 4.44Å; L110-K147 HydrophobicContact CG-CG 3.72Å; L110-K147 WeakPolarHBondContact O-CD 3.35Å; F137-K147 HydrophobicContact CE1-CB 4.33Å; F137-K147 HydrophobicContact CE2-CB 4.14Å; F137-K147 HydrophobicContact CZ-CB 3.47Å; F137-K147 VanDerWaalsContact CZ-CB 3.47Å; F137-K147 HydrophobicContact CZ-CG 3.91Å; D139-K147 WeakPolarHBondContact OD1-CE 3.4Å; D139-K147 IonicContact OD1-NZ 3.2Å; D139-K147 PolarHBondContact OD1-NZ 3.42Å; D139-K147 IonicContact OD2-NZ 3.75Å; D139-K147 PolarHBondContact OD2-NZ 3.13Å; N143-K147 PolarHBondContact O-N 2.96Å; L144-K147 HydrophobicContact CD2-CD 4.21Å; L144-K147 WeakPolarHBondContact O-CA 3.29Å; L144-K147 WeakPolarHBondContact O-CB 3.25Å; L144-K147 PolarHBondContact O-N 2.84Å; L144-K147 VanDerWaalsContact O-N 3.14Å; T145-K147 VanDerWaalsContact C-N 3.35Å; K147-L149 PolarHBondContact O-N 3.42Å; K147-S150 WeakPolarHBondContact O-CB 3.38Å; K147-S150 PolarHBondContact O-N 3.25Å; K147-G151 PolarHBondContact O-N 2.78Å
148	T	98.1	Very high	96.7	Very high	4 Å²	4	41.2 Å²	41.2	3%	0.025	20%	0.195	C	C	.	.	H	α-helix	trans	-57.3	-49.1	178.5	-70.7	0	0	0	0	111.6	L144 S150 G151 L152 Y260 E283 V287	L144-T148 PolarHBondContact O-N 3.39Å; T148-S150 VanDerWaalsContact C-N 3.31Å; T148-S150 PolarHBondContact O-N 2.82Å; T148-G151 CarbonylContact O-C 3.45Å; T148-G151 WeakPolarHBondContact O-CA 3.45Å; T148-G151 PolarHBondContact O-N 2.98Å; T148-L152 HydrophobicContact CG2-CD1 3.92Å; T148-L152 HydrophobicContact CG2-CG 3.97Å; T148-L152 WeakPolarHBondContact O-CG 3.4Å; T148-L152 PolarHBondContact O-N 3.06Å; T148-Y260 WeakPolarHBondContact CG2-OH 3.47Å; T148-E283 VanDerWaalsContact CB-OE1 3.25Å; T148-E283 WeakPolarHBondContact CB-OE1 3.41Å; T148-E283 HydrophobicContact CG2-CG 4.28Å; T148-E283 WeakPolarHBondContact CG2-OE1 3.34Å; T148-E283 WeakPolarHBondContact OG1-CG 3.41Å; T148-E283 PolarHBondContact OG1-OE1 3.43Å; T148-V287 HydrophobicContact CG2-CG2 4.16Å
149	L	97.9	Very high	96.7	Very high	7 Å²	7	36.6 Å²	36.6	4%	0.037	17%	0.174	C	C	.	.	H	α-helix	trans	-61.5	-38.4	-179.8	-73.1	175.7	0	0	0	112.7	L51 L53 T145 L146 K147 G151 L152 N153 L271 A274 F286	L51-L149 HydrophobicContact CD1-CD1 4.24Å; L51-L149 HydrophobicContact CD1-CD2 4.03Å; L53-L149 HydrophobicContact CD1-CB 4.35Å; L53-L149 HydrophobicContact CD2-CB 3.61Å; L53-L149 HydrophobicContact CD2-CD1 4.18Å; T145-L149 HydrophobicContact CG2-CD1 4.17Å; T145-L149 WeakPolarHBondContact O-CB 3.43Å; T145-L149 VanDerWaalsContact O-CG 3.32Å; T145-L149 WeakPolarHBondContact O-CG 3.49Å; T145-L149 PolarHBondContact O-N 3.16Å; L146-L149 PolarHBondContact O-N 3.34Å; K147-L149 PolarHBondContact O-N 3.42Å; L149-G151 VanDerWaalsContact C-N 3.34Å; L149-L152 PolarHBondContact O-N 3.28Å; L149-N153 WeakPolarHBondContact O-CB 3.21Å; L149-N153 PolarHBondContact O-N 3.26Å; L149-L271 HydrophobicContact CD2-CD2 4.26Å; L149-A274 HydrophobicContact CD2-CB 4.35Å; L149-F286 HydrophobicContact CD1-CE1 3.78Å; L149-F286 HydrophobicContact CD1-CZ 4.07Å; L149-F286 HydrophobicContact CD2-CE1 3.99Å; L149-F286 HydrophobicContact CG-CE1 4.21Å
150	S	98.1	Very high	96.7	Very high	3 Å²	3	38.8 Å²	38.8	2%	0.021	19%	0.189	C	C	.	.	H	α-helix	trans	-61.1	-42.4	172.2	-72.5	0	0	0	0	111.8	L146 K147 T148 W154	L146-S150 WeakPolarHBondContact O-CB 3.31Å; L146-S150 PolarHBondContact O-N 3.43Å; L146-S150 PolarHBondContact O-OG 3.45Å; L146-S150 VanDerWaalsContact O-OG 3.13Å; K147-S150 WeakPolarHBondContact O-CB 3.38Å; K147-S150 PolarHBondContact O-N 3.25Å; T148-S150 VanDerWaalsContact C-N 3.31Å; T148-S150 PolarHBondContact O-N 2.82Å; S150-W154 WeakPolarHBondContact O-CB 3.19Å; S150-W154 PolarHBondContact O-N 3.07Å
151	G	98.3	Very high	96.5	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-64.1	-49.9	175.3	0	0	0	0	0	112.8	K147 T148 L149 N153 W154 V155	K147-G151 PolarHBondContact O-N 2.78Å; T148-G151 CarbonylContact O-C 3.45Å; T148-G151 WeakPolarHBondContact O-CA 3.45Å; T148-G151 PolarHBondContact O-N 2.98Å; L149-G151 VanDerWaalsContact C-N 3.34Å; G151-N153 VanDerWaalsContact C-N 3.35Å; G151-N153 PolarHBondContact O-N 3.29Å; G151-W154 WeakPolarHBondContact O-CA 3.48Å; G151-W154 WeakPolarHBondContact O-CB 3.35Å; G151-W154 PolarHBondContact O-N 3.11Å; G151-W154 VanDerWaalsContact O-N 3.11Å; G151-V155 WeakPolarHBondContact O-CG2 3.32Å; G151-V155 PolarHBondContact O-N 2.78Å
152	L	98.2	Very high	96.6	Very high	2 Å²	2	39 Å²	39	1%	0.01	19%	0.19	C	C	.	.	H	α-helix	trans	-60.3	-43.9	178	-68.5	-168.7	0	0	0	112	T148 L149 W154 V155 N156 L262 V267 I270 L271	T148-L152 HydrophobicContact CG2-CD1 3.92Å; T148-L152 HydrophobicContact CG2-CG 3.97Å; T148-L152 WeakPolarHBondContact O-CG 3.4Å; T148-L152 PolarHBondContact O-N 3.06Å; L149-L152 PolarHBondContact O-N 3.28Å; L152-W154 VanDerWaalsContact C-N 3.31Å; L152-W154 PolarHBondContact O-N 3.24Å; L152-V155 PolarHBondContact O-N 3.08Å; L152-N156 WeakPolarHBondContact O-CB 3.03Å; L152-N156 PolarHBondContact O-N 3.14Å; L152-L262 HydrophobicContact CD1-CD1 4.08Å; L152-L262 HydrophobicContact CD2-CD1 4.12Å; L152-V267 HydrophobicContact CB-CG1 3.96Å; L152-V267 HydrophobicContact CD2-CG1 4.19Å; L152-V267 HydrophobicContact CD2-CG2 3.9Å; L152-V267 HydrophobicContact CG-CG1 4.49Å; L152-I270 HydrophobicContact CD1-CG2 4.41Å; L152-L271 HydrophobicContact CB-CD2 4.22Å; L152-L271 HydrophobicContact CB-CG 4.49Å
153	N	97.7	Very high	96.5	Very high	66 Å²	66	34.8 Å²	34.8	35%	0.353	17%	0.174	S	C	.	.	H	α-helix	trans	-64.1	-37.3	175.3	-177.2	64.5	0	0	0	112	L53 L149 G151 N156 K157 L271	L53-N153 HydrophobicContact CD1-CB 3.44Å; L53-N153 VanDerWaalsContact CD1-CB 3.44Å; L149-N153 WeakPolarHBondContact O-CB 3.21Å; L149-N153 PolarHBondContact O-N 3.26Å; G151-N153 VanDerWaalsContact C-N 3.35Å; G151-N153 PolarHBondContact O-N 3.29Å; N153-N156 PolarHBondContact O-N 3.44Å; N153-K157 WeakPolarHBondContact O-CB 3.19Å; N153-K157 PolarHBondContact O-N 2.97Å; N153-L271 HydrophobicContact CB-CD1 4.46Å; N153-L271 HydrophobicContact CB-CD2 4.19Å
154	W	97.9	Very high	96.6	Very high	2 Å²	2	32.9 Å²	32.9	1%	0.008	16%	0.164	C	C	.	.	H	α-helix	trans	-62.2	-46.7	173.8	179.5	90.6	0	0	0	111.8	L56 S59 N60 A63 L74 L108 L133 S150 G151 L152 N156 K157 Y158 C159	L56-W154 HydrophobicContact CD1-CB 4.3Å; L56-W154 VanDerWaalsContact CD1-CD1 3.4Å; L56-W154 HydrophobicContact CD1-CG 4.22Å; S59-W154 PolarHBondContact O-NE1 3.25Å; N60-W154 WeakPolarHBondContact O-CZ2 3.2Å; A63-W154 HydrophobicContact CB-CH2 3.83Å; A63-W154 HydrophobicContact CB-CZ2 3.97Å; L74-W154 HydrophobicContact CD2-CZ3 3.88Å; L108-W154 HydrophobicContact CD1-CE3 4.34Å; L108-W154 HydrophobicContact CD1-CH2 3.28Å; L108-W154 HydrophobicContact CD1-CZ2 4.13Å; L108-W154 HydrophobicContact CD1-CZ3 3.41Å; L108-W154 VanDerWaalsContact CD1-CZ3 3.41Å; L133-W154 HydrophobicContact CD1-CD2 3.55Å; L133-W154 HydrophobicContact CD1-CE3 3.61Å; L133-W154 HydrophobicContact CD1-CG 3.95Å; L133-W154 HydrophobicContact CD1-CH2 4.49Å; L133-W154 HydrophobicContact CD1-CZ2 4.42Å; L133-W154 HydrophobicContact CD1-CZ3 4.11Å; L133-W154 HydrophobicContact CD2-CD2 3.91Å; L133-W154 VanDerWaalsContact CD2-CE2 3.46Å; L133-W154 HydrophobicContact CD2-CG 4.21Å; L133-W154 HydrophobicContact CD2-CZ2 3.81Å; L133-W154 HydrophobicContact CG-CD2 4.4Å; S150-W154 WeakPolarHBondContact O-CB 3.19Å; S150-W154 PolarHBondContact O-N 3.07Å; G151-W154 WeakPolarHBondContact O-CA 3.48Å; G151-W154 WeakPolarHBondContact O-CB 3.35Å; G151-W154 PolarHBondContact O-N 3.11Å; G151-W154 VanDerWaalsContact O-N 3.11Å; L152-W154 VanDerWaalsContact C-N 3.31Å; L152-W154 PolarHBondContact O-N 3.24Å; W154-N156 PolarHBondContact O-N 3.4Å; W154-K157 PolarHBondContact O-N 2.89Å; W154-Y158 AromaticContact CD1-CD2 3.22Å; W154-Y158 AromaticContact CD1-CE2 3.47Å; W154-Y158 VanDerWaalsContact CD1-CE2 3.47Å; W154-Y158 HydrophobicContact CD2-CD2 4.13Å; W154-Y158 AromaticContact CE2-CD2 3.77Å; W154-Y158 AromaticContact CG-CD2 3.81Å; W154-Y158 HydrophobicContact CG-CD2 3.81Å; W154-Y158 HydrophobicContact CG-CE2 4.35Å; W154-Y158 AromaticContact NE1-CD2 3.18Å; W154-Y158 AromaticContact NE1-CE2 3.67Å; W154-Y158 AromaticContact NE1-CG 3.98Å; W154-Y158 WeakPolarHBondContact O-CD2 3.09Å; W154-Y158 PolarHBondContact O-N 3.33Å; W154-C159 WeakPolarHBondContact CH2-SG 3.47Å; W154-C159 WeakPolarHBondContact CZ3-SG 2.93Å
155	V	97.7	Very high	96.7	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-58.8	-49.5	176	176.7	0	0	0	0	110.3	L74 L76 G151 L152 K157 Y158 C159 I165 I264	L74-V155 HydrophobicContact CD2-CB 4.43Å; L74-V155 HydrophobicContact CD2-CG1 4.24Å; L74-V155 HydrophobicContact CD2-CG2 3.46Å; L74-V155 VanDerWaalsContact CD2-CG2 3.46Å; L76-V155 HydrophobicContact CD1-CG2 3.8Å; L76-V155 HydrophobicContact CD2-CG2 4.4Å; L76-V155 HydrophobicContact CG-CG2 4.42Å; G151-V155 WeakPolarHBondContact O-CG2 3.32Å; G151-V155 PolarHBondContact O-N 2.78Å; L152-V155 PolarHBondContact O-N 3.08Å; V155-K157 PolarHBondContact O-N 3.4Å; V155-Y158 PolarHBondContact O-N 3.01Å; V155-C159 HydrophobicContact CG1-CB 4.16Å; V155-C159 CarbonylContact O-C 3.51Å; V155-C159 VanDerWaalsContact O-CA 3.26Å; V155-C159 WeakPolarHBondContact O-CA 3.38Å; V155-C159 PolarHBondContact O-N 3.24Å; V155-I165 HydrophobicContact CG1-CD1 3.96Å; V155-I165 HydrophobicContact CG1-CG1 3.69Å; V155-I165 HydrophobicContact CG2-CG1 4.33Å; V155-I264 HydrophobicContact CG1-CD1 3.81Å
156	N	96.1	Very high	96.8	Very high	53 Å²	53	31 Å²	31	28%	0.283	15%	0.154	S	C	.	.	H	α-helix	trans	-58.4	-34.1	-179.8	-176.9	57.6	0	0	0	112.4	L152 N153 W154 Q268 L271	L152-N156 WeakPolarHBondContact O-CB 3.03Å; L152-N156 PolarHBondContact O-N 3.14Å; N153-N156 PolarHBondContact O-N 3.44Å; W154-N156 PolarHBondContact O-N 3.4Å; N156-Q268 WeakPolarHBondContact OD1-CG 3.35Å; N156-L271 HydrophobicContact CB-CD1 3.66Å
157	K	95.5	Very high	96.8	Very high	133 Å²	133	28.4 Å²	28.4	58%	0.578	14%	0.14	S	C	*	.	H	α-helix	trans	-81.8	-45.2	-178.7	-174.2	174.2	179.7	-172.8	0	113.7	N153 W154 V155	N153-K157 WeakPolarHBondContact O-CB 3.19Å; N153-K157 PolarHBondContact O-N 2.97Å; W154-K157 PolarHBondContact O-N 2.89Å; V155-K157 PolarHBondContact O-N 3.4Å
158	Y	95.8	Very high	96.8	Very high	68 Å²	68	28.2 Å²	28.2	27%	0.267	14%	0.139	S	C	.	.	H	α-helix	trans	-110.4	-14.6	-169	-59.6	-71.6	0	0	0	114.1	C64 W154 V155 P160	C64-Y158 WeakPolarHBondContact CB-O 3.47Å; W154-Y158 AromaticContact CD1-CD2 3.22Å; W154-Y158 AromaticContact CD1-CE2 3.47Å; W154-Y158 VanDerWaalsContact CD1-CE2 3.47Å; W154-Y158 HydrophobicContact CD2-CD2 4.13Å; W154-Y158 AromaticContact CE2-CD2 3.77Å; W154-Y158 AromaticContact CG-CD2 3.81Å; W154-Y158 HydrophobicContact CG-CD2 3.81Å; W154-Y158 HydrophobicContact CG-CE2 4.35Å; W154-Y158 AromaticContact NE1-CD2 3.18Å; W154-Y158 AromaticContact NE1-CE2 3.67Å; W154-Y158 AromaticContact NE1-CG 3.98Å; W154-Y158 WeakPolarHBondContact O-CD2 3.09Å; W154-Y158 PolarHBondContact O-N 3.33Å; V155-Y158 PolarHBondContact O-N 3.01Å; Y158-P160 VanDerWaalsContact C-CD 3.41Å
159	C	95.7	Very high	96.8	Very high	3 Å²	3	29.5 Å²	29.5	2%	0.02	15%	0.145	C	C	.	.			trans	-131.8	48.7	178.5	-52.8	0	0	0	0	112.1	C64 W154 V155 M161 A162	C64-C159 HydrophobicContact CB-CB 3.86Å; C64-C159 WeakPolarHBondContact CB-SG 3.28Å; C64-C159 WeakPolarHBondContact SG-CB 3.3Å; C64-C159 CovalentContact SG-SG 2.02Å; C64-C159 PolarHBondContact SG-SG 2.89Å; W154-C159 WeakPolarHBondContact CH2-SG 3.47Å; W154-C159 WeakPolarHBondContact CZ3-SG 2.93Å; V155-C159 HydrophobicContact CG1-CB 4.16Å; V155-C159 CarbonylContact O-C 3.51Å; V155-C159 VanDerWaalsContact O-CA 3.26Å; V155-C159 WeakPolarHBondContact O-CA 3.38Å; V155-C159 PolarHBondContact O-N 3.24Å; C159-M161 PolarHBondContact O-N 3.32Å; C159-M161 VanDerWaalsContact O-N 3.1Å; C159-A162 HydrophobicContact CB-CB 4.16Å; C159-A162 VanDerWaalsContact O-CB 3.31Å; C159-A162 WeakPolarHBondContact O-CB 3.39Å; C159-A162 PolarHBondContact O-N 3.43Å
160	P	93.4	Very high	96.8	Very high	71 Å²	71	29.9 Å²	29.9	46%	0.461	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-15.8	-175.7	29.5	-37.2	0	0	0	113.7	Y158	Y158-P160 VanDerWaalsContact C-CD 3.41Å
161	M	92.3	Very high	96.8	Very high	138 Å²	138	32 Å²	32	68%	0.68	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-2.2	176.8	-62.8	-176.4	72.2	0	0	113.4	P70 C159	P70-M161 HydrophobicContact CB-CB 3.65Å; P70-M161 WeakPolarHBondContact CB-O 2.98Å; P70-M161 HydrophobicContact CG-CB 4.13Å; P70-M161 HydrophobicContact CG-CE 4.38Å; C159-M161 PolarHBondContact O-N 3.32Å; C159-M161 VanDerWaalsContact O-N 3.1Å
162	A	94.5	Very high	96.7	Very high	1 Å²	1	32 Å²	32	1%	0.008	16%	0.159	C	C	.	.			trans	-61.7	143.2	171.6	0	0	0	0	0	109.5	P71 C159 I264	P71-A162 HydrophobicContact CG-CB 3.98Å; P71-A162 VanDerWaalsContact O-CA 3.24Å; P71-A162 WeakPolarHBondContact O-CA 3.4Å; C159-A162 HydrophobicContact CB-CB 4.16Å; C159-A162 VanDerWaalsContact O-CB 3.31Å; C159-A162 WeakPolarHBondContact O-CB 3.39Å; C159-A162 PolarHBondContact O-N 3.43Å; A162-I264 WeakPolarHBondContact O-CB 3.39Å; A162-I264 WeakPolarHBondContact O-CG2 3.48Å
163	R	94.7	Very high	96.6	Very high	30 Å²	30	32.1 Å²	32.1	11%	0.113	16%	0.159	C	C	.	.			trans	-88.7	-52	-178.8	-63.5	-172	70.7	85.7	-2.4	112.1	P71 F72 E191 V215 S263 I264	P71-R163 PolarHBondContact O-N 3.21Å; F72-R163 HydrophobicContact CD2-CB 4.45Å; R163-E191 IonicContact CZ-OE1 3.58Å; R163-E191 IonicContact CZ-OE2 2.85Å; R163-E191 IonicContact NE-OE1 3.41Å; R163-E191 PolarHBondContact NE-OE1 2.97Å; R163-E191 IonicContact NE-OE2 3.7Å; R163-E191 PolarHBondContact NE-OE2 2.77Å; R163-E191 IonicContact NH2-OE1 3.8Å; R163-E191 PolarHBondContact NH2-OE1 3.39Å; R163-E191 IonicContact NH2-OE2 3.7Å; R163-E191 PolarHBondContact NH2-OE2 2.83Å; R163-V215 HydrophobicContact CB-CG2 4.37Å; R163-V215 HydrophobicContact CG-CG2 4.27Å; R163-S263 CarbonylContact O-C 3.57Å; R163-S263 WeakPolarHBondContact O-CA 3.43Å; R163-I264 PolarHBondContact O-N 3.5Å
164	Y	97.7	Very high	96.6	Very high	4 Å²	4	29 Å²	29	2%	0.016	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	145.3	-177	-57.8	-76.1	0	0	0	111.7	F72 L73 L74 L183 E191 V215 L218 V261 L262	F72-Y164 HydrophobicContact CD1-CD2 4.39Å; F72-Y164 HydrophobicContact CD2-CD2 4.44Å; F72-Y164 HydrophobicContact CD2-CE2 4.48Å; F72-Y164 AromaticContact CE1-CD2 3.89Å; F72-Y164 HydrophobicContact CE1-CD2 3.89Å; F72-Y164 HydrophobicContact CE1-CE2 4.25Å; F72-Y164 AromaticContact CE2-CD2 3.96Å; F72-Y164 HydrophobicContact CE2-CD2 3.96Å; F72-Y164 AromaticContact CE2-CE2 3.69Å; F72-Y164 HydrophobicContact CE2-CE2 3.69Å; F72-Y164 AromaticContact CZ-CD2 3.65Å; F72-Y164 HydrophobicContact CZ-CD2 3.65Å; F72-Y164 AromaticContact CZ-CE2 3.54Å; F72-Y164 HydrophobicContact CZ-CE2 3.54Å; F72-Y164 PolarHBondContact O-N 2.74Å; L73-Y164 WeakPolarHBondContact CA-O 3.5Å; L74-Y164 PolarHBondContact N-O 2.83Å; Y164-L183 HydrophobicContact CD1-CD2 4.04Å; Y164-L183 HydrophobicContact CD2-CB 4.17Å; Y164-L183 HydrophobicContact CD2-CD1 4.12Å; Y164-L183 HydrophobicContact CE1-CD2 4.35Å; Y164-L183 HydrophobicContact CE2-CB 4.21Å; Y164-L183 HydrophobicContact CG-CD1 3.93Å; Y164-L183 HydrophobicContact CG-CD2 4.21Å; Y164-L183 HydrophobicContact CG-CG 4.45Å; Y164-E191 PolarHBondContact OH-OE1 3.22Å; Y164-V215 HydrophobicContact CE1-CG1 4.22Å; Y164-L218 HydrophobicContact CD1-CD2 3.97Å; Y164-L218 HydrophobicContact CE1-CB 4.45Å; Y164-L218 HydrophobicContact CE1-CD2 3.69Å; Y164-V261 HydrophobicContact CD1-CG1 4.22Å; Y164-V261 HydrophobicContact CG-CG1 4.47Å; Y164-L262 CarbonylContact C-O 3.53Å
165	I	98.5	Very high	96.5	Very high	2 Å²	2	29.1 Å²	29.1	1%	0.01	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	115.2	179	-59.3	82.3	0	0	0	107.7	L74 L76 V155 V261 L262 I264 V267	L74-I165 CarbonylContact O-C 3.58Å; L74-I165 VanDerWaalsContact O-CA 3.24Å; L74-I165 WeakPolarHBondContact O-CA 3.37Å; L76-I165 HydrophobicContact CD1-CG2 3.9Å; L76-I165 HydrophobicContact CG-CG2 4.03Å; V155-I165 HydrophobicContact CG1-CD1 3.96Å; V155-I165 HydrophobicContact CG1-CG1 3.69Å; V155-I165 HydrophobicContact CG2-CG1 4.33Å; I165-V261 CarbonylContact O-C 3.58Å; I165-V261 VanDerWaalsContact O-CA 3.3Å; I165-V261 WeakPolarHBondContact O-CA 3.21Å; I165-L262 PolarHBondContact N-O 2.81Å; I165-L262 PolarHBondContact O-N 3.43Å; I165-I264 HydrophobicContact CD1-CB 4.22Å; I165-I264 HydrophobicContact CD1-CD1 4.2Å; I165-V267 HydrophobicContact CD1-CG2 3.88Å; I165-V267 HydrophobicContact CG1-CG2 4.31Å
166	L	98.8	Very high	96.5	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	119.7	167	172.5	67.8	0	0	0	108.2	L73 L74 I75 L76 T168 V174 L179 V261	L73-L166 HydrophobicContact CD1-CB 4.03Å; L74-L166 PolarHBondContact O-N 2.98Å; I75-L166 CarbonylContact C-O 3.58Å; I75-L166 WeakPolarHBondContact CA-O 3.29Å; I75-L166 HydrophobicContact CD1-CD2 4.41Å; I75-L166 HydrophobicContact CG1-CB 4.26Å; I75-L166 HydrophobicContact CG1-CD2 4.19Å; I75-L166 HydrophobicContact CG2-CB 4.34Å; I75-L166 HydrophobicContact CG2-CD2 3.82Å; I75-L166 HydrophobicContact CG2-CG 4.2Å; L76-L166 PolarHBondContact N-O 2.85Å; L166-T168 HydrophobicContact CD2-CG2 4.49Å; L166-V174 HydrophobicContact CD2-CB 4.47Å; L166-V174 HydrophobicContact CD2-CG1 3.66Å; L166-V174 HydrophobicContact CD2-CG2 3.95Å; L166-L179 HydrophobicContact CB-CD2 4.48Å; L166-L179 HydrophobicContact CD1-CD2 4.45Å; L166-L179 HydrophobicContact CD2-CD2 3.7Å; L166-L179 HydrophobicContact CG-CD2 4.44Å; L166-V261 HydrophobicContact CB-CG2 4.33Å; L166-V261 HydrophobicContact CD1-CG2 3.87Å
167	K	98.6	Very high	96.4	Very high	5 Å²	5	28.6 Å²	28.6	2%	0.022	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	134.9	160.1	-177.5	-93.2	161.1	177.1	0	108	C78 D169 G257 G259 Y260 E283	C78-K167 VanDerWaalsContact SG-CE 3.55Å; K167-D169 IonicContact NZ-OD1 2.79Å; K167-D169 PolarHBondContact NZ-OD1 3.06Å; K167-D169 IonicContact NZ-OD2 2.65Å; K167-G257 PolarHBondContact NZ-O 3.09Å; K167-G259 WeakPolarHBondContact O-CA 3.42Å; K167-Y260 HydrophobicContact CB-CD2 4.29Å; K167-Y260 HydrophobicContact CB-CE1 4.2Å; K167-Y260 HydrophobicContact CB-CE2 3.73Å; K167-Y260 HydrophobicContact CD-CD1 4.34Å; K167-Y260 HydrophobicContact CD-CE1 3.63Å; K167-Y260 HydrophobicContact CG-CE1 4.28Å; K167-Y260 HydrophobicContact CG-CE2 4.49Å; K167-Y260 PolarHBondContact N-O 3.48Å; K167-Y260 PolarHBondContact O-N 3.25Å; K167-Y260 VanDerWaalsContact O-N 3.08Å; K167-E283 IonicContact NZ-OE2 2.79Å
168	T	98.4	Very high	96.3	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	164.3	177	-169.1	0	0	0	0	111	I75 L76 V77 C78 W94 L166 V172 V174 T258	I75-T168 HydrophobicContact CG2-CG2 3.85Å; L76-T168 PolarHBondContact O-N 3.43Å; V77-T168 CarbonylContact C-O 3.56Å; V77-T168 WeakPolarHBondContact CA-O 3.1Å; V77-T168 HydrophobicContact CB-CG2 4.41Å; V77-T168 HydrophobicContact CG2-CG2 3.91Å; C78-T168 PolarHBondContact N-O 3.23Å; W94-T168 HydrophobicContact CH2-CG2 4.2Å; L166-T168 HydrophobicContact CD2-CG2 4.49Å; T168-V172 VanDerWaalsContact OG1-CB 3.28Å; T168-V172 WeakPolarHBondContact OG1-CB 3.4Å; T168-V172 VanDerWaalsContact OG1-CG1 3.27Å; T168-V172 WeakPolarHBondContact OG1-CG1 3.3Å; T168-V174 HydrophobicContact CG2-CG2 4.38Å; T168-T258 PolarHBondContact OG1-O 3.01Å
169	D	97.7	Very high	96.3	Very high	31 Å²	31	21.5 Å²	21.5	17%	0.166	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	169.3	173.1	-60.1	-28.2	0	0	0	111.3	K167 D171 V172	K167-D169 IonicContact NZ-OD1 2.79Å; K167-D169 PolarHBondContact NZ-OD1 3.06Å; K167-D169 IonicContact NZ-OD2 2.65Å; D169-D171 VanDerWaalsContact C-N 3.32Å; D169-D171 WeakPolarHBondContact CB-OD1 3.29Å; D169-V172 HydrophobicContact CB-CG2 4.03Å
170	D	97.8	Very high	96.3	Very high	16 Å²	16	21.4 Å²	21.4	9%	0.086	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-3.6	-176.4	64.3	3.2	0	0	0	115.1	V77 C78 T79 H83 Q86 I90	V77-D170 HydrophobicContact CG1-CB 3.95Å; C78-D170 PolarHBondContact O-N 3.26Å; T79-D170 VanDerWaalsContact CA-OD2 3.29Å; T79-D170 WeakPolarHBondContact CA-OD2 3.49Å; T79-D170 WeakPolarHBondContact CB-OD2 3.46Å; T79-D170 PolarHBondContact OG1-OD2 2.84Å; H83-D170 WeakPolarHBondContact CB-OD2 3.5Å; H83-D170 IonicContact CE1-OD2 2.7Å; H83-D170 IonicContact CG-OD2 2.63Å; H83-D170 IonicContact ND1-OD1 3.52Å; H83-D170 IonicContact ND1-OD2 3.07Å; H83-D170 PolarHBondContact ND1-OD2 3.28Å; Q86-D170 HydrophobicContact CB-CB 4.06Å; I90-D170 HydrophobicContact CD1-CB 4.2Å
171	D	96.9	Very high	96.3	Very high	47 Å²	47	19.6 Å²	19.6	25%	0.251	10%	0.102	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107	27.2	171.5	69.5	-18.5	0	0	0	111.8	D169 H325 K326 V327	D169-D171 VanDerWaalsContact C-N 3.32Å; D169-D171 WeakPolarHBondContact CB-OD1 3.29Å; D171-H325 CarbonylContact O-C 3.49Å; D171-H325 IonicContact OD1-CD2 3.17Å; D171-H325 PolarHBondContact OD1-CD2 2.68Å; D171-H325 IonicContact OD1-NE2 3.53Å; D171-H325 IonicContact OD2-CD2 3.15Å; D171-H325 IonicContact OD2-NE2 2.75Å; D171-H325 PolarHBondContact OD2-NE2 3.19Å; D171-K326 PolarHBondContact O-N 3.25Å; D171-V327 CarbonylContact C-O 3.44Å; D171-V327 WeakPolarHBondContact CA-O 3.24Å; D171-V327 PolarHBondContact O-N 3.05Å
172	V	97.3	Very high	96.3	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	123.4	-178.6	178.4	0	0	0	0	110.7	W94 T168 D169 V174 T258 T323 S324 H325 M332	W94-V172 VanDerWaalsContact CZ2-O 3.29Å; W94-V172 WeakPolarHBondContact CZ2-O 3.19Å; W94-V172 PolarHBondContact NE1-O 2.8Å; T168-V172 VanDerWaalsContact OG1-CB 3.28Å; T168-V172 WeakPolarHBondContact OG1-CB 3.4Å; T168-V172 VanDerWaalsContact OG1-CG1 3.27Å; T168-V172 WeakPolarHBondContact OG1-CG1 3.3Å; D169-V172 HydrophobicContact CB-CG2 4.03Å; V172-V174 HydrophobicContact CG1-CG2 4.34Å; V172-T258 WeakPolarHBondContact CG2-O 3.45Å; V172-T323 HydrophobicContact CG1-CG2 4.2Å; V172-S324 CarbonylContact C-O 3.54Å; V172-S324 VanDerWaalsContact CA-O 3.28Å; V172-S324 WeakPolarHBondContact CA-O 3.31Å; V172-H325 HydrophobicContact CG2-CB 4.23Å; V172-M332 WeakPolarHBondContact O-CE 3.34Å
173	Y	96.4	Very high	96.3	Very high	4 Å²	4	13.4 Å²	13.4	2%	0.016	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	133.5	167.8	180	-89.7	0	0	0	109.8	W94 N175 Y317 T323 S324 M332 A335 W336 V339	W94-Y173 AromaticContact CD1-CD2 3.65Å; W94-Y173 AromaticContact CD1-CE2 3.96Å; Y173-N175 HydrophobicContact CE1-CB 4.25Å; Y173-Y317 AromaticContact CD1-CD1 3.88Å; Y173-Y317 HydrophobicContact CD1-CD1 3.88Å; Y173-Y317 HydrophobicContact CD1-CE1 4.34Å; Y173-Y317 HydrophobicContact CE1-CD1 4.21Å; Y173-Y317 HydrophobicContact CG-CD1 4.39Å; Y173-T323 CarbonylContact O-C 3.55Å; Y173-T323 WeakPolarHBondContact O-CA 3.41Å; Y173-S324 PolarHBondContact N-O 3.33Å; Y173-S324 PolarHBondContact O-N 3.39Å; Y173-M332 HydrophobicContact CD2-SD 3.75Å; Y173-M332 HydrophobicContact CG-SD 4.32Å; Y173-A335 HydrophobicContact CD2-CB 3.66Å; Y173-A335 HydrophobicContact CE2-CB 3.83Å; Y173-A335 HydrophobicContact CG-CB 4.18Å; Y173-W336 HydrophobicContact CE2-CB 4.33Å; Y173-W336 HydrophobicContact CE2-CE3 4.41Å; Y173-V339 WeakPolarHBondContact OH-CB 3.43Å
174	V	97.3	Very high	96.2	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	121.6	177.9	-174.7	0	0	0	0	110.2	W94 L166 T168 V172 V176 L179 L322 T323	W94-V174 WeakPolarHBondContact CB-O 3.34Å; W94-V174 HydrophobicContact CD2-CB 3.8Å; W94-V174 HydrophobicContact CD2-CG2 4.15Å; W94-V174 HydrophobicContact CE3-CB 3.82Å; W94-V174 HydrophobicContact CE3-CG2 4.12Å; W94-V174 HydrophobicContact CG-CB 4.3Å; W94-V174 HydrophobicContact CH2-CB 4.4Å; W94-V174 HydrophobicContact CH2-CG2 3.79Å; W94-V174 HydrophobicContact CZ2-CB 4.38Å; W94-V174 HydrophobicContact CZ2-CG2 3.79Å; W94-V174 HydrophobicContact CZ3-CB 4.15Å; W94-V174 HydrophobicContact CZ3-CG2 3.97Å; L166-V174 HydrophobicContact CD2-CB 4.47Å; L166-V174 HydrophobicContact CD2-CG1 3.66Å; L166-V174 HydrophobicContact CD2-CG2 3.95Å; T168-V174 HydrophobicContact CG2-CG2 4.38Å; V172-V174 HydrophobicContact CG1-CG2 4.34Å; V174-V176 VanDerWaalsContact C-N 3.31Å; V174-V176 HydrophobicContact CB-CG2 4.34Å; V174-V176 HydrophobicContact CG1-CG2 3.95Å; V174-V176 PolarHBondContact O-N 3.07Å; V174-L179 HydrophobicContact CG1-CD2 4.02Å; V174-L322 WeakPolarHBondContact CA-O 3.23Å; V174-T323 HydrophobicContact CG2-CG2 4.32Å
175	N	95.6	Very high	95.9	Very high	5 Å²	5	20.8 Å²	20.8	3%	0.027	11%	0.108	C	C	.	.			trans	-81.7	80.2	169.8	-172.3	-18.4	0	0	0	109.7	Y173 P177 E178 L179 Y317 G318 L321 L322	Y173-N175 HydrophobicContact CE1-CB 4.25Å; N175-P177 WeakPolarHBondContact OD1-CD 3.39Å; N175-E178 HydrophobicContact CB-CB 4.44Å; N175-E178 WeakPolarHBondContact ND2-CG 3.36Å; N175-E178 PolarHBondContact O-N 2.81Å; N175-E178 PolarHBondContact OD1-N 2.79Å; N175-L179 WeakPolarHBondContact O-CB 3.28Å; N175-L179 PolarHBondContact O-N 2.97Å; N175-Y317 PolarHBondContact ND2-O 2.75Å; N175-G318 PolarHBondContact ND2-O 3.04Å; N175-L321 WeakPolarHBondContact CB-O 3.5Å; N175-L322 PolarHBondContact N-O 3.06Å
176	V	96.6	Very high	95.4	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-55.1	-45.8	-174.7	176.6	0	0	0	0	113.1	I75 W94 I97 A100 V105 V174 E178 L179 V180	I75-V176 HydrophobicContact CD1-CG2 3.79Å; W94-V176 HydrophobicContact CB-CG2 4.31Å; W94-V176 HydrophobicContact CE3-CG2 4.05Å; I97-V176 HydrophobicContact CB-CG1 4.39Å; I97-V176 HydrophobicContact CD1-CB 3.83Å; I97-V176 HydrophobicContact CD1-CG1 4.39Å; I97-V176 HydrophobicContact CD1-CG2 4.24Å; I97-V176 HydrophobicContact CG2-CG1 3.97Å; A100-V176 HydrophobicContact CB-CG1 4.12Å; V105-V176 HydrophobicContact CB-CG1 4.3Å; V105-V176 HydrophobicContact CG1-CG1 3.82Å; V105-V176 HydrophobicContact CG2-CG1 3.9Å; V174-V176 VanDerWaalsContact C-N 3.31Å; V174-V176 HydrophobicContact CB-CG2 4.34Å; V174-V176 HydrophobicContact CG1-CG2 3.95Å; V174-V176 PolarHBondContact O-N 3.07Å; V176-E178 PolarHBondContact O-N 3.24Å; V176-L179 PolarHBondContact O-N 3.12Å; V176-V180 HydrophobicContact CG1-CG2 4.32Å; V176-V180 VanDerWaalsContact O-CG2 3.29Å; V176-V180 WeakPolarHBondContact O-CG2 3.41Å; V176-V180 PolarHBondContact O-N 3.36Å
177	P	94.6	Very high	94.6	Very high	42 Å²	42	24.5 Å²	24.5	27%	0.273	13%	0.125	S	C	.	.	H	α-helix	trans	-61.3	-40.7	179	-25.6	36.1	0	0	0	114.4	I97 N175 S181	I97-P177 HydrophobicContact CD1-CG 4.41Å; N175-P177 WeakPolarHBondContact OD1-CD 3.39Å; P177-S181 PolarHBondContact O-N 3.14Å; P177-S181 VanDerWaalsContact O-N 3.13Å; P177-S181 PolarHBondContact O-OG 2.93Å
178	E	93	Very high	93.2	Very high	53 Å²	53	25.5 Å²	25.5	25%	0.248	14%	0.137	C	C	.	.	H	α-helix	trans	-75.5	-33.6	178.2	-65.3	-53.5	118.1	0	0	111.5	R101 N175 V176 S181 E182 L322	R101-E178 IonicContact CZ-OE1 3.94Å; R101-E178 IonicContact NH2-OE1 2.77Å; R101-E178 PolarHBondContact NH2-OE1 3.33Å; N175-E178 HydrophobicContact CB-CB 4.44Å; N175-E178 WeakPolarHBondContact ND2-CG 3.36Å; N175-E178 PolarHBondContact O-N 2.81Å; N175-E178 PolarHBondContact OD1-N 2.79Å; V176-E178 PolarHBondContact O-N 3.24Å; E178-S181 WeakPolarHBondContact O-CB 3.39Å; E178-S181 PolarHBondContact O-N 3.09Å; E178-E182 PolarHBondContact O-N 3.34Å; E178-L322 VanDerWaalsContact C-CD2 3.44Å; E178-L322 HydrophobicContact CB-CD2 3.72Å
179	L	96.2	Very high	91.1	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-64.3	-43.9	174.6	178.2	60.8	0	0	0	111.3	L73 L166 V174 N175 V176 S181 E182 L183 V261 L322	L73-L179 HydrophobicContact CD2-CD2 3.81Å; L73-L179 HydrophobicContact CD2-CG 4.23Å; L166-L179 HydrophobicContact CB-CD2 4.48Å; L166-L179 HydrophobicContact CD1-CD2 4.45Å; L166-L179 HydrophobicContact CD2-CD2 3.7Å; L166-L179 HydrophobicContact CG-CD2 4.44Å; V174-L179 HydrophobicContact CG1-CD2 4.02Å; N175-L179 WeakPolarHBondContact O-CB 3.28Å; N175-L179 PolarHBondContact O-N 2.97Å; V176-L179 PolarHBondContact O-N 3.12Å; L179-S181 VanDerWaalsContact C-N 3.28Å; L179-S181 PolarHBondContact O-N 3.19Å; L179-E182 WeakPolarHBondContact O-CB 3.4Å; L179-E182 PolarHBondContact O-N 3.32Å; L179-L183 HydrophobicContact CD1-CD1 4.34Å; L179-L183 HydrophobicContact CD1-CG 4.36Å; L179-L183 HydrophobicContact CG-CD1 4.21Å; L179-L183 VanDerWaalsContact O-CG 3.31Å; L179-L183 WeakPolarHBondContact O-CG 3.27Å; L179-L183 PolarHBondContact O-N 2.99Å; L179-V261 HydrophobicContact CD1-CG2 4.1Å; L179-L322 HydrophobicContact CB-CD2 4.22Å; L179-L322 HydrophobicContact CD1-CB 4.48Å; L179-L322 HydrophobicContact CD1-CD1 3.91Å
180	V	95.7	Very high	89.2	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-62.1	-40.3	174.7	170.3	0	0	0	0	110.6	F72 L73 A100 R101 F103 V105 V176 E182 L183 I184	F72-V180 HydrophobicContact CD1-CG1 4.17Å; F72-V180 HydrophobicContact CD1-CG2 4.45Å; F72-V180 HydrophobicContact CE1-CB 4.48Å; F72-V180 HydrophobicContact CE1-CG1 3.93Å; L73-V180 HydrophobicContact CD2-CG2 4.02Å; A100-V180 HydrophobicContact CB-CB 4.21Å; A100-V180 HydrophobicContact CB-CG1 4.47Å; A100-V180 HydrophobicContact CB-CG2 3.89Å; R101-V180 HydrophobicContact CB-CG1 4.03Å; R101-V180 HydrophobicContact CG-CG1 4.17Å; F103-V180 HydrophobicContact CB-CG1 4.23Å; F103-V180 HydrophobicContact CD2-CG1 4.19Å; V105-V180 HydrophobicContact CG2-CG2 3.93Å; V176-V180 HydrophobicContact CG1-CG2 4.32Å; V176-V180 VanDerWaalsContact O-CG2 3.29Å; V176-V180 WeakPolarHBondContact O-CG2 3.41Å; V176-V180 PolarHBondContact O-N 3.36Å; V180-E182 PolarHBondContact O-N 3Å; V180-L183 PolarHBondContact O-N 2.67Å; V180-I184 HydrophobicContact CG1-CD1 3.77Å; V180-I184 HydrophobicContact CG1-CG1 4.36Å; V180-I184 WeakPolarHBondContact O-CD1 3.29Å; V180-I184 VanDerWaalsContact O-CG1 3.23Å; V180-I184 WeakPolarHBondContact O-CG1 3.22Å; V180-I184 PolarHBondContact O-N 3.31Å
181	S	93.4	Very high	87.3	Confident	33 Å²	33	30 Å²	30	23%	0.231	17%	0.169	C	C	.	.	H	α-helix	trans	-61.9	-42.2	176.4	-52.6	0	0	0	0	112.1	R101 P177 E178 L179 Q185	R101-S181 PolarHBondContact NE-OG 3.3Å; P177-S181 PolarHBondContact O-N 3.14Å; P177-S181 VanDerWaalsContact O-N 3.13Å; P177-S181 PolarHBondContact O-OG 2.93Å; E178-S181 WeakPolarHBondContact O-CB 3.39Å; E178-S181 PolarHBondContact O-N 3.09Å; L179-S181 VanDerWaalsContact C-N 3.28Å; L179-S181 PolarHBondContact O-N 3.19Å; S181-Q185 PolarHBondContact O-N 3.23Å; S181-Q185 VanDerWaalsContact O-N 3.14Å
182	E	92.7	Very high	85.1	Confident	10 Å²	10	34.9 Å²	34.9	5%	0.047	19%	0.191	C	C	.	.	H	α-helix	trans	-61.4	-43.9	174.7	-176.2	71.2	-162	0	0	111.9	E178 L179 V180 Q185 R186 L220 K303 L322	E178-E182 PolarHBondContact O-N 3.34Å; L179-E182 WeakPolarHBondContact O-CB 3.4Å; L179-E182 PolarHBondContact O-N 3.32Å; V180-E182 PolarHBondContact O-N 3Å; E182-Q185 PolarHBondContact O-N 2.93Å; E182-R186 WeakPolarHBondContact O-CG 3.23Å; E182-R186 PolarHBondContact O-N 2.85Å; E182-R186 IonicContact OE1-CZ 3.57Å; E182-R186 IonicContact OE1-NE 3.18Å; E182-R186 PolarHBondContact OE1-NE 2.85Å; E182-R186 IonicContact OE1-NH2 3.5Å; E182-R186 PolarHBondContact OE1-NH2 3.24Å; E182-L220 HydrophobicContact CG-CD2 4.48Å; E182-K303 IonicContact OE2-NZ 2.9Å; E182-K303 PolarHBondContact OE2-NZ 2.81Å; E182-L322 HydrophobicContact CB-CD1 4.02Å; E182-L322 HydrophobicContact CG-CD1 3.89Å
183	L	94.9	Very high	82.4	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-69.9	-38	-178.8	-66.8	172.6	0	0	0	112.5	F72 L73 Y164 L179 V180 Q185 R186 G187 L218 L220 V261	F72-L183 HydrophobicContact CE1-CB 3.9Å; F72-L183 HydrophobicContact CE1-CD1 4.28Å; F72-L183 HydrophobicContact CZ-CB 3.9Å; L73-L183 HydrophobicContact CD1-CD1 4.02Å; Y164-L183 HydrophobicContact CD1-CD2 4.04Å; Y164-L183 HydrophobicContact CD2-CB 4.17Å; Y164-L183 HydrophobicContact CD2-CD1 4.12Å; Y164-L183 HydrophobicContact CE1-CD2 4.35Å; Y164-L183 HydrophobicContact CE2-CB 4.21Å; Y164-L183 HydrophobicContact CG-CD1 3.93Å; Y164-L183 HydrophobicContact CG-CD2 4.21Å; Y164-L183 HydrophobicContact CG-CG 4.45Å; L179-L183 HydrophobicContact CD1-CD1 4.34Å; L179-L183 HydrophobicContact CD1-CG 4.36Å; L179-L183 HydrophobicContact CG-CD1 4.21Å; L179-L183 VanDerWaalsContact O-CG 3.31Å; L179-L183 WeakPolarHBondContact O-CG 3.27Å; L179-L183 PolarHBondContact O-N 2.99Å; V180-L183 PolarHBondContact O-N 2.67Å; L183-Q185 VanDerWaalsContact C-N 3.31Å; L183-Q185 PolarHBondContact O-N 3.14Å; L183-R186 PolarHBondContact O-N 3.43Å; L183-G187 PolarHBondContact O-N 3.02Å; L183-L218 HydrophobicContact CD2-CD2 3.74Å; L183-L220 HydrophobicContact CD2-CD2 4.45Å; L183-V261 HydrophobicContact CD1-CG1 4.29Å; L183-V261 HydrophobicContact CD2-CB 4.45Å; L183-V261 HydrophobicContact CD2-CG1 3.85Å
184	I	92.7	Very high	80.1	Confident	40 Å²	40	47.3 Å²	47.3	21%	0.205	24%	0.242	C	C	.	.	H	α-helix	trans	-59.1	-45.6	172.3	-67.3	159.9	0	0	0	110.1	F72 R101 F103 V180 R186 G187 E191	F72-I184 HydrophobicContact CE2-CG1 4.46Å; F72-I184 HydrophobicContact CZ-CG1 3.93Å; R101-I184 HydrophobicContact CB-CD1 4.14Å; F103-I184 HydrophobicContact CD2-CD1 3.61Å; F103-I184 HydrophobicContact CD2-CG1 4.14Å; F103-I184 HydrophobicContact CE2-CD1 3.34Å; F103-I184 HydrophobicContact CE2-CG1 3.69Å; F103-I184 HydrophobicContact CZ-CD1 4.33Å; F103-I184 HydrophobicContact CZ-CG1 4.22Å; V180-I184 HydrophobicContact CG1-CD1 3.77Å; V180-I184 HydrophobicContact CG1-CG1 4.36Å; V180-I184 WeakPolarHBondContact O-CD1 3.29Å; V180-I184 VanDerWaalsContact O-CG1 3.23Å; V180-I184 WeakPolarHBondContact O-CG1 3.22Å; V180-I184 PolarHBondContact O-N 3.31Å; I184-R186 VanDerWaalsContact C-N 3.31Å; I184-R186 PolarHBondContact O-N 3.27Å; I184-G187 PolarHBondContact O-N 2.81Å; I184-E191 HydrophobicContact CG2-CB 4.4Å
185	Q	90.1	Very high	77.6	Confident	149 Å²	149	54.1 Å²	54.1	70%	0.696	27%	0.271	S	S	*	.	H	α-helix	trans	-62	-39.2	179.4	-173	177.4	20.1	0	0	111.9	S181 E182 L183	S181-Q185 PolarHBondContact O-N 3.23Å; S181-Q185 VanDerWaalsContact O-N 3.14Å; E182-Q185 PolarHBondContact O-N 2.93Å; L183-Q185 VanDerWaalsContact C-N 3.31Å; L183-Q185 PolarHBondContact O-N 3.14Å
186	R	88.6	Confident	74.8	Confident	70 Å²	70	56 Å²	56	26%	0.264	29%	0.292	S	S	.	.	H	α-helix	trans	-77.1	-31.5	-179.4	-70.3	-179.7	-177.3	-89.4	-4.6	113.9	E31 E182 L183 I184 G188	E31-R186 IonicContact OE1-NH2 3.66Å; E31-R186 PolarHBondContact OE1-NH2 2.82Å; E31-R186 IonicContact OE2-CZ 3.42Å; E31-R186 IonicContact OE2-NH1 3.33Å; E31-R186 PolarHBondContact OE2-NH1 2.91Å; E31-R186 IonicContact OE2-NH2 3.51Å; E31-R186 PolarHBondContact OE2-NH2 3.49Å; E182-R186 WeakPolarHBondContact O-CG 3.23Å; E182-R186 PolarHBondContact O-N 2.85Å; E182-R186 IonicContact OE1-CZ 3.57Å; E182-R186 IonicContact OE1-NE 3.18Å; E182-R186 PolarHBondContact OE1-NE 2.85Å; E182-R186 IonicContact OE1-NH2 3.5Å; E182-R186 PolarHBondContact OE1-NH2 3.24Å; L183-R186 PolarHBondContact O-N 3.43Å; I184-R186 VanDerWaalsContact C-N 3.31Å; I184-R186 PolarHBondContact O-N 3.27Å; R186-G188 PolarHBondContact O-N 3.22Å
187	G	82.4	Confident	72	Confident	9 Å²	9	59.6 Å²	59.6	9%	0.093	31%	0.308	C	S	.	.	H	α-helix	trans	-73.7	-9.1	178.4	0	0	0	0	0	114.8	L183 I184 S190	L183-G187 PolarHBondContact O-N 3.02Å; I184-G187 PolarHBondContact O-N 2.81Å; G187-S190 PolarHBondContact O-OG 2.92Å
188	G	69	Low	69.5	Low	27 Å²	27	65 Å²	65	28%	0.278	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.3	-165.6	175.9	0	0	0	0	0	114.4	R186 S190 E191	R186-G188 PolarHBondContact O-N 3.22Å; G188-S190 PolarHBondContact O-N 2.92Å; G188-E191 PolarHBondContact O-N 2.86Å; G188-E191 VanDerWaalsContact O-N 3.11Å
189	P	55	Low	67	Low	111 Å²	111	66.6 Å²	66.6	72%	0.721	35%	0.352	S	S	*	.	H	α-helix	trans	-56	-26.6	-174	-26.3	34.3	0	0	0	114.6	E191 Q192 W193	P189-E191 PolarHBondContact O-N 3.07Å; P189-Q192 PolarHBondContact O-N 2.99Å; P189-Q192 VanDerWaalsContact O-N 3.14Å; P189-W193 PolarHBondContact O-N 3.41Å
190	S	57.3	Low	63.9	Low	29 Å²	29	74.5 Å²	74.5	20%	0.203	39%	0.389	C	S	.	.	H	α-helix	trans	-59.6	-30.7	179.1	78.4	0	0	0	0	113.5	G187 G188	G187-S190 PolarHBondContact O-OG 2.92Å; G188-S190 PolarHBondContact O-N 2.92Å
191	E	57.8	Low	61.1	Low	0 Å²	0	80.9 Å²	80.9	0%	0	42%	0.419	C	S	.	.	H	α-helix	trans	-78.8	-32.4	178.1	-58.2	-65.9	178.4	0	0	111.8	F72 R163 Y164 I184 G188 P189 W193	F72-E191 WeakPolarHBondContact CE2-OE2 3.29Å; R163-E191 IonicContact CZ-OE1 3.58Å; R163-E191 IonicContact CZ-OE2 2.85Å; R163-E191 IonicContact NE-OE1 3.41Å; R163-E191 PolarHBondContact NE-OE1 2.97Å; R163-E191 IonicContact NE-OE2 3.7Å; R163-E191 PolarHBondContact NE-OE2 2.77Å; R163-E191 IonicContact NH2-OE1 3.8Å; R163-E191 PolarHBondContact NH2-OE1 3.39Å; R163-E191 IonicContact NH2-OE2 3.7Å; R163-E191 PolarHBondContact NH2-OE2 2.83Å; Y164-E191 PolarHBondContact OH-OE1 3.22Å; I184-E191 HydrophobicContact CG2-CB 4.4Å; G188-E191 PolarHBondContact O-N 2.86Å; G188-E191 VanDerWaalsContact O-N 3.11Å; P189-E191 PolarHBondContact O-N 3.07Å; E191-W193 PolarHBondContact O-N 2.88Å
192	Q	50.7	Low	58.3	Low	150 Å²	150	88.2 Å²	88.2	70%	0.701	45%	0.449	S	S	*	.	H	α-helix	trans	-71.4	-24.8	178.2	-158.7	158.8	5.7	0	0	111.6	P189 K195	P189-Q192 PolarHBondContact O-N 2.99Å; P189-Q192 VanDerWaalsContact O-N 3.14Å; Q192-K195 PolarHBondContact O-N 2.87Å
193	W	40	Very low	55.2	Low	171 Å²	171	93.6 Å²	93.6	65%	0.648	48%	0.483	S	S	*	.	H	α-helix	trans	-72.3	-31	179.5	-138.6	63.9	0	0	0	113.5	P189 E191 K195 G196 K197	P189-W193 PolarHBondContact O-N 3.41Å; E191-W193 PolarHBondContact O-N 2.88Å; W193-K195 PolarHBondContact O-N 2.75Å; W193-G196 PolarHBondContact O-N 3.36Å; W193-K197 HydrophobicContact CZ3-CD 4.37Å
194	Q	48.7	Very low	52	Low	95 Å²	95	99.8 Å²	99.8	44%	0.444	52%	0.521	S	S	.	.	H	α-helix	trans	-64.4	-29.7	175.5	-71	-168.2	-30.2	0	0	112.5	G196	Q194-G196 VanDerWaalsContact C-N 3.3Å; Q194-G196 PolarHBondContact O-N 3.4Å
195	K	43.6	Very low	49.2	Very low	142 Å²	142	102.5 Å²	102.5	62%	0.617	55%	0.549	S	S	*	.	H	α-helix	trans	-71.6	-23.4	177.6	-158	176.1	-176.8	177.3	0	113.5	Q192 W193	Q192-K195 PolarHBondContact O-N 2.87Å; W193-K195 PolarHBondContact O-N 2.75Å
196	G	37.7	Very low	46.4	Very low	46 Å²	46	103.1 Å²	103.1	47%	0.474	56%	0.555	S	S	.	*	H	α-helix	trans	-85	-26.4	-175.5	0	0	0	0	0	114.7	W193 Q194	W193-G196 PolarHBondContact O-N 3.36Å; Q194-G196 VanDerWaalsContact C-N 3.3Å; Q194-G196 PolarHBondContact O-N 3.4Å
197	K	38.1	Very low	43.4	Very low	74 Å²	74	107.7 Å²	107.7	32%	0.322	58%	0.58	S	S	.	*	H	α-helix	trans	-85	-24.1	-176.2	-80.7	-164.3	166.9	-151.6	0	114.9	W193 A199 Q200 E201	W193-K197 HydrophobicContact CZ3-CD 4.37Å; K197-A199 PolarHBondContact O-N 3.05Å; K197-A199 VanDerWaalsContact O-N 3.16Å; K197-Q200 CarbonylContact O-C 3.58Å; K197-Q200 PolarHBondContact O-N 2.95Å; K197-E201 WeakPolarHBondContact CE-OE1 3.46Å; K197-E201 IonicContact NZ-OE1 3.22Å; K197-E201 PolarHBondContact NZ-OE1 3.08Å; K197-E201 IonicContact NZ-OE2 3.43Å
198	E	42.5	Very low	40.8	Very low	156 Å²	156	116.1 Å²	116.1	73%	0.729	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	-18.8	172.7	-75.2	-177.7	169.9	0	0	112.7
199	A	39	Very low	39.2	Very low	86 Å²	86	122.9 Å²	122.9	71%	0.711	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	-12.1	174.2	0	0	0	0	0	114	K197	K197-A199 PolarHBondContact O-N 3.05Å; K197-A199 VanDerWaalsContact O-N 3.16Å
200	Q	33.1	Very low	38.3	Very low	167 Å²	167	125.7 Å²	125.7	78%	0.78	64%	0.644	S	S	*	*	S	Bend	trans	-156.3	63.1	-166.3	-118.8	176.9	-25.2	0	0	112.6	K197	K197-Q200 CarbonylContact O-C 3.58Å; K197-Q200 PolarHBondContact O-N 2.95Å
201	E	36	Very low	37.5	Very low	134 Å²	134	135 Å²	135	63%	0.626	68%	0.675	S	S	*	*			trans	-153.4	71.3	164.6	-117.4	164.5	-149.9	0	0	111	K197	K197-E201 WeakPolarHBondContact CE-OE1 3.46Å; K197-E201 IonicContact NZ-OE1 3.22Å; K197-E201 PolarHBondContact NZ-OE1 3.08Å; K197-E201 IonicContact NZ-OE2 3.43Å
202	E	33.7	Very low	37.3	Very low	187 Å²	187	138 Å²	138	87%	0.874	71%	0.706	S	S	*	*	S	Bend	trans	-119.1	51.7	161.5	-160.3	171.8	-138.1	0	0	108.5
203	T	28.8	Very low	37.7	Very low	122 Å²	122	138 Å²	138	75%	0.748	71%	0.706	S	S	*	*	S	Bend	trans	-172.2	139.1	160.6	3.3	0	0	0	0	113.6
204	T	28.1	Very low	39.1	Very low	131 Å²	131	133.7 Å²	133.7	80%	0.804	71%	0.707	S	S	*	*			trans	82.9	104.1	165.6	60.9	0	0	0	0	119	I206	T204-I206 PolarHBondContact O-N 2.78Å
205	A	33.2	Very low	40.6	Very low	96 Å²	96	129.9 Å²	129.9	79%	0.793	69%	0.69	S	S	*	*			trans	-68.1	116.3	162.7	0	0	0	0	0	110.8
206	I	31	Very low	42.7	Very low	162 Å²	162	126.6 Å²	126.6	83%	0.831	68%	0.683	S	S	*	*			trans	-127.1	117.9	151.7	-64.7	-179.6	0	0	0	106.1	T204	T204-I206 PolarHBondContact O-N 2.78Å
207	H	26.4	Very low	45.3	Very low	167 Å²	167	128.8 Å²	128.8	77%	0.773	68%	0.683	S	S	*	*			trans	-60.9	154	171.5	-85.8	-116.2	0	0	0	111
208	E	28.2	Very low	48	Very low	185 Å²	185	126.2 Å²	126.2	86%	0.864	67%	0.673	S	S	*	*	S	Bend	trans	101.4	106.7	166.3	-61.9	174.4	159.1	0	0	117.5
209	E	33.9	Very low	50.6	Low	170 Å²	170	118.8 Å²	118.8	79%	0.794	64%	0.638	S	S	*	*			trans	74.5	42	141.5	-139.7	168.4	-155.9	0	0	120.3	R211	E209-R211 PolarHBondContact O-N 3.02Å
210	H	35.6	Very low	53.3	Low	169 Å²	169	114.7 Å²	114.7	78%	0.782	61%	0.605	S	S	*	*			trans	-87.9	55.2	149.7	-75.5	72.7	0	0	0	110.9	G212	H210-G212 PolarHBondContact O-N 2.84Å
211	R	41.2	Very low	56.3	Low	225 Å²	225	106.8 Å²	106.8	85%	0.849	57%	0.567	S	S	*	*			trans	-60.7	97.3	161.1	-161.2	177.6	-170.2	171	2.9	105.3	E209	E209-R211 PolarHBondContact O-N 3.02Å
212	G	54.8	Low	59.1	Low	64 Å²	64	101 Å²	101	66%	0.66	54%	0.54	S	S	*	.			trans	-40.6	135.1	-158.7	0	0	0	0	0	114.2	H210 A214	H210-G212 PolarHBondContact O-N 2.84Å; G212-A214 PolarHBondContact O-N 2.68Å; G212-A214 VanDerWaalsContact O-N 3.14Å
213	Q	57.6	Low	61.9	Low	149 Å²	149	92.5 Å²	92.5	70%	0.696	50%	0.501	S	S	*	.			trans	-42.5	121.9	177.3	-172.9	160.6	5.2	0	0	110.7	V215	Q213-V215 PolarHBondContact O-N 3.1Å
214	A	70	Confident	65	Low	81 Å²	81	89.4 Å²	89.4	67%	0.669	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-53.8	127.1	-172.4	0	0	0	0	0	110.5	G212 P216	G212-A214 PolarHBondContact O-N 2.68Å; G212-A214 VanDerWaalsContact O-N 3.14Å; A214-P216 WeakPolarHBondContact O-CD 3.41Å
215	V	81.2	Confident	68	Low	14 Å²	14	87.1 Å²	87.1	9%	0.085	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-63.9	123.1	175.3	-175.2	0	0	0	0	107.4	R163 Y164 Q213 I264 S265	R163-V215 HydrophobicContact CB-CG2 4.37Å; R163-V215 HydrophobicContact CG-CG2 4.27Å; Y164-V215 HydrophobicContact CE1-CG1 4.22Å; Q213-V215 PolarHBondContact O-N 3.1Å; V215-I264 HydrophobicContact CB-CG2 4.08Å; V215-I264 HydrophobicContact CG2-CG2 3.83Å; V215-S265 WeakPolarHBondContact O-CB 3.27Å; V215-S265 PolarHBondContact O-OG 3.33Å; V215-S265 VanDerWaalsContact O-OG 3.11Å
216	P	87.2	Confident	70.8	Confident	73 Å²	73	92.9 Å²	92.9	47%	0.474	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-55.2	144.3	177.3	-25.6	34.5	0	0	0	111.3	A214 L218 S263	A214-P216 WeakPolarHBondContact O-CD 3.41Å; P216-L218 PolarHBondContact O-N 3.17Å; P216-S263 VanDerWaalsContact O-CB 3.29Å; P216-S263 WeakPolarHBondContact O-CB 3.39Å; P216-S263 PolarHBondContact O-OG 3.28Å
217	L	92.2	Very high	73.9	Confident	92 Å²	92	87.4 Å²	87.4	48%	0.482	43%	0.43	S	S	.	.			trans	-60.1	115.2	175.9	-73.9	171.1	0	0	0	109.8	S265 A266 L269 L296	L217-S265 VanDerWaalsContact CD2-C 3.49Å; L217-A266 HydrophobicContact CD2-CB 4.14Å; L217-L269 HydrophobicContact CD1-CD2 4.35Å; L217-L269 HydrophobicContact CD2-CB 4.39Å; L217-L269 HydrophobicContact CD2-CD2 4.14Å; L217-L296 HydrophobicContact CB-CD1 4Å
218	L	94.7	Very high	77.2	Confident	21 Å²	21	87.4 Å²	87.4	11%	0.11	42%	0.423	C	S	.	.			trans	-126.1	129.8	173.5	-175.8	67	0	0	0	110	Y164 L183 P216 L220 L262 S263 A266	Y164-L218 HydrophobicContact CD1-CD2 3.97Å; Y164-L218 HydrophobicContact CE1-CB 4.45Å; Y164-L218 HydrophobicContact CE1-CD2 3.69Å; L183-L218 HydrophobicContact CD2-CD2 3.74Å; P216-L218 PolarHBondContact O-N 3.17Å; L218-L220 HydrophobicContact CD1-CB 4.16Å; L218-L220 HydrophobicContact CD2-CB 4.36Å; L218-L220 HydrophobicContact CG-CB 4.15Å; L218-L262 CarbonylContact O-C 3.54Å; L218-L262 WeakPolarHBondContact O-CA 3.28Å; L218-S263 PolarHBondContact N-OG 3.27Å; L218-S263 PolarHBondContact O-N 3.29Å; L218-S263 PolarHBondContact O-OG 2.75Å; L218-A266 VanDerWaalsContact O-CB 3.28Å; L218-A266 WeakPolarHBondContact O-CB 3.32Å
219	Y	96.7	Very high	80.5	Confident	0 Å²	0	79.4 Å²	79.4	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	100.5	163.6	178	-158.8	0	0	0	107.3	A255 Y260 V261 L262 V287 A291 P298 T299	Y219-A255 HydrophobicContact CD2-CB 4.36Å; Y219-A255 HydrophobicContact CE2-CB 3.47Å; Y219-A255 VanDerWaalsContact CE2-CB 3.47Å; Y219-A255 WeakPolarHBondContact OH-CB 3.44Å; Y219-A255 PolarHBondContact OH-N 2.81Å; Y219-Y260 HydrophobicContact CD2-CD2 4.4Å; Y219-Y260 AromaticContact CE2-CD2 3.86Å; Y219-Y260 HydrophobicContact CE2-CD2 3.86Å; Y219-Y260 AromaticContact CE2-CG 3.98Å; Y219-Y260 HydrophobicContact CE2-CG 3.98Å; Y219-V261 CarbonylContact C-O 3.4Å; Y219-V261 WeakPolarHBondContact CA-O 3.45Å; Y219-L262 HydrophobicContact CD2-CD2 3.35Å; Y219-L262 HydrophobicContact CD2-CG 4.39Å; Y219-L262 HydrophobicContact CE2-CD2 4.01Å; Y219-L262 HydrophobicContact CG-CD2 3.74Å; Y219-V287 HydrophobicContact CE1-CG1 4.44Å; Y219-V287 HydrophobicContact CE2-CG1 4.15Å; Y219-A291 HydrophobicContact CD1-CB 3.82Å; Y219-A291 HydrophobicContact CE1-CB 3.94Å; Y219-P298 HydrophobicContact CD1-CB 3.55Å; Y219-P298 HydrophobicContact CD1-CG 4.33Å; Y219-P298 HydrophobicContact CE1-CB 3.64Å; Y219-P298 HydrophobicContact CE1-CG 4.19Å; Y219-P298 HydrophobicContact CG-CB 4.04Å; Y219-P298 CarbonylContact O-C 3.59Å; Y219-P298 VanDerWaalsContact O-CA 3.29Å; Y219-P298 WeakPolarHBondContact O-CA 3.49Å; Y219-T299 PolarHBondContact O-N 2.97Å
220	L	96.3	Very high	83.5	Confident	0 Å²	0	73.7 Å²	73.7	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	133.9	-171.5	-173.2	72.2	0	0	0	110.2	E182 L183 L218 Y260 V261 T299 C301 L304	E182-L220 HydrophobicContact CG-CD2 4.48Å; L183-L220 HydrophobicContact CD2-CD2 4.45Å; L218-L220 HydrophobicContact CD1-CB 4.16Å; L218-L220 HydrophobicContact CD2-CB 4.36Å; L218-L220 HydrophobicContact CG-CB 4.15Å; L220-Y260 CarbonylContact O-C 3.59Å; L220-Y260 VanDerWaalsContact O-CA 3.28Å; L220-Y260 WeakPolarHBondContact O-CA 3.45Å; L220-Y260 WeakPolarHBondContact O-CB 3.48Å; L220-V261 HydrophobicContact CB-CB 4.21Å; L220-V261 PolarHBondContact N-O 3.49Å; L220-V261 PolarHBondContact O-N 2.93Å; L220-T299 HydrophobicContact CD1-CG2 3.99Å; L220-C301 HydrophobicContact CD1-CB 3.72Å; L220-C301 HydrophobicContact CG-CB 3.97Å; L220-L304 HydrophobicContact CG-CD1 4.24Å
221	G	96	Very high	86.3	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.6	169	-175.3	0	0	0	0	0	114.4	V223 T299 H300 C301 L304	G221-V223 PolarHBondContact O-N 2.82Å; G221-T299 PolarHBondContact N-O 3.49Å; G221-H300 CarbonylContact O-C 3.05Å; G221-H300 WeakPolarHBondContact O-CA 3.29Å; G221-C301 PolarHBondContact O-N 3.43Å; G221-L304 VanDerWaalsContact CA-CD1 3.43Å
222	R	93.7	Very high	88.9	Confident	13 Å²	13	62.7 Å²	62.7	5%	0.049	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	107.7	159.4	-172.8	70	167.8	155	-1.6	108	A255 S256 H300 L304 A367 S371	R222-A255 CarbonylContact O-C 3.46Å; R222-A255 WeakPolarHBondContact O-CA 3.4Å; R222-S256 PolarHBondContact O-N 3.37Å; R222-H300 PolarHBondContact NH1-CE1 2.82Å; R222-H300 PolarHBondContact NH1-NE2 2.89Å; R222-L304 HydrophobicContact CB-CB 4.43Å; R222-L304 WeakPolarHBondContact CB-O 3.41Å; R222-L304 WeakPolarHBondContact CD-O 3.35Å; R222-A367 PolarHBondContact NH2-O 3.27Å; R222-S371 VanDerWaalsContact CZ-OG 3.25Å; R222-S371 PolarHBondContact NH1-OG 2.87Å; R222-S371 VanDerWaalsContact NH2-N 3.2Å; R222-S371 PolarHBondContact NH2-OG 3.15Å
223	V	93.6	Very high	90.7	Very high	8 Å²	8	63.8 Å²	63.8	5%	0.048	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	130.6	-171.3	177.7	0	0	0	0	111.6	G221 W225 P253 Y254 P298 H300	G221-V223 PolarHBondContact O-N 2.82Å; V223-W225 HydrophobicContact CB-CZ2 3.98Å; V223-W225 HydrophobicContact CG1-CD2 3.77Å; V223-W225 VanDerWaalsContact CG1-CE2 3.44Å; V223-W225 HydrophobicContact CG1-CE3 4.17Å; V223-W225 HydrophobicContact CG1-CG 4.33Å; V223-W225 HydrophobicContact CG1-CH2 4Å; V223-W225 HydrophobicContact CG1-CZ2 3.59Å; V223-W225 HydrophobicContact CG1-CZ3 4.26Å; V223-P253 HydrophobicContact CG1-CB 3.79Å; V223-Y254 CarbonylContact C-O 3.51Å; V223-Y254 WeakPolarHBondContact CA-O 3.5Å; V223-P298 HydrophobicContact CG1-CG 4.06Å; V223-P298 HydrophobicContact CG2-CB 3.68Å; V223-P298 HydrophobicContact CG2-CG 3.86Å; V223-H300 HydrophobicContact CB-CB 4.25Å; V223-H300 HydrophobicContact CG2-CB 4.06Å; V223-H300 PolarHBondContact N-ND1 3.25Å
224	H	93.4	Very high	92.4	Very high	58 Å²	58	64.2 Å²	64.2	27%	0.269	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	129.6	167.5	-70.1	-65.7	0	0	0	110.3	V227 P253 Y254 S256	H224-V227 HydrophobicContact CB-CG2 3.83Å; H224-P253 WeakPolarHBondContact O-CA 3.24Å; H224-Y254 HydrophobicContact CB-CD1 4.22Å; H224-Y254 HydrophobicContact CB-CD2 4.35Å; H224-Y254 HydrophobicContact CB-CE1 3.78Å; H224-Y254 HydrophobicContact CB-CE2 3.93Å; H224-Y254 HydrophobicContact CB-CG 4.48Å; H224-Y254 AromaticContact CD2-CE2 3.55Å; H224-Y254 AromaticContact CD2-CZ 3.99Å; H224-Y254 AromaticContact CG-CZ 3.99Å; H224-Y254 PolarHBondContact N-O 3.44Å; H224-Y254 PolarHBondContact O-N 3.47Å; H224-S256 WeakPolarHBondContact NE2-CB 3.36Å; H224-S256 PolarHBondContact NE2-OG 3.22Å
225	W	91.4	Very high	93.6	Very high	83 Å²	83	61.9 Å²	61.9	31%	0.314	30%	0.3	S	S	.	.			trans	-113.5	135.8	-176.2	-56.2	99.1	0	0	0	111	S34 L37 V223 V227 P253 H300	S34-W225 WeakPolarHBondContact OG-CH2 3Å; S34-W225 WeakPolarHBondContact OG-CZ2 3.33Å; L37-W225 HydrophobicContact CD1-CE3 4.39Å; L37-W225 HydrophobicContact CD1-CH2 3.77Å; L37-W225 HydrophobicContact CD1-CZ3 3.38Å; V223-W225 HydrophobicContact CB-CZ2 3.98Å; V223-W225 HydrophobicContact CG1-CD2 3.77Å; V223-W225 VanDerWaalsContact CG1-CE2 3.44Å; V223-W225 HydrophobicContact CG1-CE3 4.17Å; V223-W225 HydrophobicContact CG1-CG 4.33Å; V223-W225 HydrophobicContact CG1-CH2 4Å; V223-W225 HydrophobicContact CG1-CZ2 3.59Å; V223-W225 HydrophobicContact CG1-CZ3 4.26Å; W225-V227 PolarHBondContact O-N 3.43Å; W225-P253 HydrophobicContact CE3-CB 3.73Å; W225-P253 HydrophobicContact CE3-CG 3.55Å; W225-P253 HydrophobicContact CH2-CB 4.42Å; W225-P253 HydrophobicContact CZ3-CB 3.65Å; W225-P253 HydrophobicContact CZ3-CG 3.47Å; W225-P253 VanDerWaalsContact CZ3-CG 3.47Å; W225-H300 HydrophobicContact CZ2-CB 4.5Å
226	R	92.2	Very high	94.2	Very high	216 Å²	216	68.7 Å²	68.7	82%	0.815	33%	0.325	S	S	*	.	S	Bend	trans	53.3	29.7	172.1	-60	-175.4	173.5	-176.6	-1.2	115	R228 P250	R226-R228 PolarHBondContact O-N 3.3Å; R226-P250 VanDerWaalsContact C-CB 3.49Å; R226-P250 HydrophobicContact CB-CB 4.38Å; R226-P250 HydrophobicContact CB-CG 4.43Å; R226-P250 WeakPolarHBondContact O-CB 3.4Å
227	V	95.5	Very high	94.5	Very high	48 Å²	48	68.5 Å²	68.5	29%	0.291	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-68.7	128.6	177	178.6	0	0	0	0	109.9	H224 W225 P250 F251 Y254	H224-V227 HydrophobicContact CB-CG2 3.83Å; W225-V227 PolarHBondContact O-N 3.43Å; V227-P250 CarbonylContact O-C 3.59Å; V227-P250 WeakPolarHBondContact O-CA 3.37Å; V227-P250 WeakPolarHBondContact O-CB 3.31Å; V227-F251 HydrophobicContact CB-CD2 4.35Å; V227-F251 HydrophobicContact CG1-CD2 4.2Å; V227-F251 WeakPolarHBondContact O-CD2 3.3Å; V227-F251 PolarHBondContact O-N 3.27Å; V227-Y254 HydrophobicContact CB-CE1 4.05Å; V227-Y254 HydrophobicContact CG2-CE1 4.14Å
228	R	96.5	Very high	94.8	Very high	167 Å²	167	66.1 Å²	66.1	63%	0.63	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-88.8	147.7	174.6	-73.6	-174.8	170.6	-129	0.6	111.3	R226 T230 P250	R226-R228 PolarHBondContact O-N 3.3Å; R228-T230 PolarHBondContact O-N 3.14Å; R228-P250 HydrophobicContact CG-CB 4.2Å
229	P	96.9	Very high	94.9	Very high	17 Å²	17	65.2 Å²	65.2	11%	0.11	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-57.4	133.8	174.7	-17.7	26.7	0	0	0	111.6	R231 V239 W244 F251	P229-R231 PolarHBondContact O-N 3.38Å; P229-V239 HydrophobicContact CB-CB 4.07Å; P229-V239 HydrophobicContact CB-CG1 4.37Å; P229-W244 HydrophobicContact CG-CB 4.28Å; P229-W244 HydrophobicContact CG-CG 3.86Å; P229-F251 HydrophobicContact CB-CE1 4.31Å; P229-F251 HydrophobicContact CB-CE2 4.19Å; P229-F251 HydrophobicContact CB-CZ 3.64Å; P229-F251 HydrophobicContact CG-CE1 3.81Å; P229-F251 HydrophobicContact CG-CE2 4.17Å; P229-F251 HydrophobicContact CG-CZ 3.59Å
230	T	96.3	Very high	94.8	Very high	50 Å²	50	66.9 Å²	66.9	31%	0.307	31%	0.311	S	S	.	.	B	Isolated β-bridge	trans	-75.8	124	171.7	-56.8	0	0	0	0	109.1	R228 H238 V239	R228-T230 PolarHBondContact O-N 3.14Å; T230-H238 WeakPolarHBondContact O-CA 3.47Å; T230-V239 PolarHBondContact O-N 2.95Å
231	R	95.7	Very high	94.8	Very high	84 Å²	84	71.1 Å²	71.1	32%	0.317	33%	0.33	S	S	.	.			trans	-96.7	-6	-179.1	-57.6	-56.1	-165.4	-173.2	4.4	114.5	P229 P233 V239 S240 E241 W244	P229-R231 PolarHBondContact O-N 3.38Å; R231-P233 WeakPolarHBondContact O-CD 3.38Å; R231-V239 WeakPolarHBondContact CD-O 3.31Å; R231-V239 PolarHBondContact NH1-O 3.1Å; R231-S240 PolarHBondContact NH1-O 3.2Å; R231-E241 IonicContact CZ-OE2 2.7Å; R231-E241 IonicContact NE-OE2 2.81Å; R231-E241 IonicContact NH1-OE2 3.74Å; R231-E241 IonicContact NH2-OE2 2.88Å; R231-E241 PolarHBondContact NH2-OE2 2.94Å; R231-W244 VanDerWaalsContact CZ-O 3.26Å; R231-W244 PolarHBondContact NH1-O 2.98Å; R231-W244 PolarHBondContact NH2-O 3.34Å
232	T	95.7	Very high	94.8	Very high	78 Å²	78	79.7 Å²	79.7	48%	0.479	37%	0.371	S	S	.	.			trans	-72.3	116.4	178.1	-52.6	0	0	0	0	110.6	E234 S235 H238	T232-E234 VanDerWaalsContact C-N 3.27Å; T232-E234 WeakPolarHBondContact CG2-OE2 3.44Å; T232-E234 PolarHBondContact O-N 3.22Å; T232-S235 VanDerWaalsContact O-CB 3.28Å; T232-S235 WeakPolarHBondContact O-CB 3.2Å; T232-S235 PolarHBondContact O-N 3.38Å; T232-H238 WeakPolarHBondContact O-CB 3.4Å
233	P	92.3	Very high	94.9	Very high	88 Å²	88	81 Å²	81	57%	0.571	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-31.8	-174	-26.9	36.4	0	0	0	115	R231 S235	R231-P233 WeakPolarHBondContact O-CD 3.38Å; P233-S235 VanDerWaalsContact C-N 3.26Å; P233-S235 PolarHBondContact O-N 3.3Å
234	E	92.6	Very high	95	Very high	158 Å²	158	81.3 Å²	81.3	74%	0.738	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-15.2	-178.7	-57	70.1	-148.5	0	0	112.4	T232 R236	T232-E234 VanDerWaalsContact C-N 3.27Å; T232-E234 WeakPolarHBondContact CG2-OE2 3.44Å; T232-E234 PolarHBondContact O-N 3.22Å; E234-R236 PolarHBondContact O-N 2.89Å
235	S	94.9	Very high	95.2	Very high	31 Å²	31	80.2 Å²	80.2	22%	0.217	38%	0.376	C	S	.	.	S	Bend	trans	-69.8	132.3	178.8	-178.8	0	0	0	0	110.4	T232 P233 H237 H238	T232-S235 VanDerWaalsContact O-CB 3.28Å; T232-S235 WeakPolarHBondContact O-CB 3.2Å; T232-S235 PolarHBondContact O-N 3.38Å; P233-S235 VanDerWaalsContact C-N 3.26Å; P233-S235 PolarHBondContact O-N 3.3Å; S235-H237 PolarHBondContact O-N 2.92Å; S235-H237 VanDerWaalsContact O-N 3.07Å; S235-H237 PolarHBondContact OG-N 3.44Å; S235-H237 VanDerWaalsContact OG-N 3.11Å; S235-H238 WeakPolarHBondContact O-CB 3.13Å; S235-H238 PolarHBondContact O-N 3.41Å
236	R	94.3	Very high	95.4	Very high	158 Å²	158	82.6 Å²	82.6	60%	0.596	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-23.6	169	75.3	-178.7	-164.4	-179	5	112.4	Y141 E234	Y141-R236 HydrophobicContact CD1-CB 4.07Å; Y141-R236 HydrophobicContact CD1-CG 4.47Å; Y141-R236 HydrophobicContact CE1-CB 4Å; Y141-R236 HydrophobicContact CE1-CG 3.96Å; Y141-R236 WeakPolarHBondContact CE1-O 3.31Å; E234-R236 PolarHBondContact O-N 2.89Å
237	H	94.8	Very high	95.5	Very high	69 Å²	69	79 Å²	79	32%	0.319	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	12.8	177.9	-49	124.5	0	0	0	113.6	Y141 S235 V239 L282	Y141-H237 PolarHBondContact OH-CD2 2.9Å; Y141-H237 VanDerWaalsContact OH-CD2 3.24Å; Y141-H237 PolarHBondContact OH-NE2 3.22Å; S235-H237 PolarHBondContact O-N 2.92Å; S235-H237 VanDerWaalsContact O-N 3.07Å; S235-H237 PolarHBondContact OG-N 3.44Å; S235-H237 VanDerWaalsContact OG-N 3.11Å; H237-V239 PolarHBondContact O-N 3.47Å; H237-L282 HydrophobicContact CB-CD2 4.19Å
238	H	96.6	Very high	95.5	Very high	42 Å²	42	82.6 Å²	82.6	19%	0.194	40%	0.396	C	S	.	.	B	Isolated β-bridge	trans	-60.1	130.6	-178.7	173.7	-118.7	0	0	0	112.9	T230 T232 S235	T230-H238 WeakPolarHBondContact O-CA 3.47Å; T232-H238 WeakPolarHBondContact O-CB 3.4Å; S235-H238 WeakPolarHBondContact O-CB 3.13Å; S235-H238 PolarHBondContact O-N 3.41Å
239	V	96.7	Very high	95.5	Very high	1 Å²	1	75.5 Å²	75.5	1%	0.006	38%	0.376	C	S	.	.			trans	-130.9	121.4	172.2	178.2	0	0	0	0	109.1	P229 T230 R231 H237 L243 W244 F251 L280 L282	P229-V239 HydrophobicContact CB-CB 4.07Å; P229-V239 HydrophobicContact CB-CG1 4.37Å; T230-V239 PolarHBondContact O-N 2.95Å; R231-V239 WeakPolarHBondContact CD-O 3.31Å; R231-V239 PolarHBondContact NH1-O 3.1Å; H237-V239 PolarHBondContact O-N 3.47Å; V239-L243 HydrophobicContact CG1-CB 4.05Å; V239-W244 HydrophobicContact CG1-CB 3.75Å; V239-F251 HydrophobicContact CG2-CZ 4.16Å; V239-L280 HydrophobicContact CG1-CD2 3.87Å; V239-L282 HydrophobicContact CG2-CD1 3.5Å; V239-L282 VanDerWaalsContact CG2-CD1 3.5Å; V239-L282 HydrophobicContact CG2-CG 3.94Å
240	S	95.9	Very high	95.5	Very high	36 Å²	36	77 Å²	77	25%	0.252	39%	0.386	S	S	.	.			trans	-68.7	156.4	-179.7	62.7	0	0	0	0	112.2	R231 E242 L243 W244	R231-S240 PolarHBondContact NH1-O 3.2Å; S240-E242 PolarHBondContact O-N 3.4Å; S240-L243 PolarHBondContact O-N 3Å; S240-L243 WeakPolarHBondContact OG-CG 3.23Å; S240-L243 PolarHBondContact OG-N 3.2Å; S240-W244 PolarHBondContact O-N 3.4Å; S240-W244 VanDerWaalsContact O-N 3.1Å
241	E	95.9	Very high	95.5	Very high	89 Å²	89	75 Å²	75	42%	0.416	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-34.6	173.8	-172.1	62.1	-158.2	0	0	112	R231 W244 P245 E246	R231-E241 IonicContact CZ-OE2 2.7Å; R231-E241 IonicContact NE-OE2 2.81Å; R231-E241 IonicContact NH1-OE2 3.74Å; R231-E241 IonicContact NH2-OE2 2.88Å; R231-E241 PolarHBondContact NH2-OE2 2.94Å; E241-W244 CarbonylContact O-C 3.13Å; E241-W244 PolarHBondContact O-N 2.95Å; E241-P245 WeakPolarHBondContact O-CA 3.49Å; E241-P245 VanDerWaalsContact O-N 3.11Å; E241-P245 WeakPolarHBondContact OE1-CA 3.22Å; E241-E246 VanDerWaalsContact OE1-CB 3.3Å; E241-E246 WeakPolarHBondContact OE1-CB 3.28Å; E241-E246 PolarHBondContact OE1-N 3.34Å
242	E	95.7	Very high	95.4	Very high	180 Å²	180	71.5 Å²	71.5	84%	0.841	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-42.7	175.6	-176.3	-176.8	-176.5	0	0	113	S240	S240-E242 PolarHBondContact O-N 3.4Å
243	L	95.8	Very high	95.3	Very high	41 Å²	41	69.7 Å²	69.7	22%	0.215	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-29.2	-179.7	-72.8	175.8	0	0	0	112.6	V239 S240 P278 P279 L280	V239-L243 HydrophobicContact CG1-CB 4.05Å; S240-L243 PolarHBondContact O-N 3Å; S240-L243 WeakPolarHBondContact OG-CG 3.23Å; S240-L243 PolarHBondContact OG-N 3.2Å; L243-P278 WeakPolarHBondContact O-CB 3.5Å; L243-P279 HydrophobicContact CD2-CG 4.04Å; L243-L280 HydrophobicContact CB-CD2 4.18Å
244	W	96.9	Very high	95.5	Very high	13 Å²	13	66.3 Å²	66.3	5%	0.049	33%	0.326	C	S	.	.	S	Bend	trans	-148.1	98.1	178.1	-165.4	-80.8	0	0	0	109.7	P229 R231 V239 S240 E241 W248 G249 F251 L280 V289	P229-W244 HydrophobicContact CG-CB 4.28Å; P229-W244 HydrophobicContact CG-CG 3.86Å; R231-W244 VanDerWaalsContact CZ-O 3.26Å; R231-W244 PolarHBondContact NH1-O 2.98Å; R231-W244 PolarHBondContact NH2-O 3.34Å; V239-W244 HydrophobicContact CG1-CB 3.75Å; S240-W244 PolarHBondContact O-N 3.4Å; S240-W244 VanDerWaalsContact O-N 3.1Å; E241-W244 CarbonylContact O-C 3.13Å; E241-W244 PolarHBondContact O-N 2.95Å; W244-W248 AromaticContact CD2-CE3 3.8Å; W244-W248 HydrophobicContact CD2-CE3 3.8Å; W244-W248 HydrophobicContact CD2-CZ3 4.39Å; W244-W248 AromaticContact CE2-CE3 3.95Å; W244-W248 AromaticContact CE3-CE3 3.83Å; W244-W248 HydrophobicContact CE3-CE3 3.83Å; W244-W248 HydrophobicContact CE3-CZ3 4Å; W244-W248 HydrophobicContact CG-CE3 4.36Å; W244-W248 HydrophobicContact CH2-CE3 4.17Å; W244-W248 HydrophobicContact CZ2-CB 4.35Å; W244-W248 HydrophobicContact CZ2-CE3 4.15Å; W244-W248 HydrophobicContact CZ3-CE3 4.01Å; W244-W248 HydrophobicContact CZ3-CZ3 4.15Å; W244-G249 PolarHBondContact NE1-O 2.99Å; W244-F251 HydrophobicContact CB-CE1 4.38Å; W244-F251 AromaticContact CD2-CD1 3.71Å; W244-F251 HydrophobicContact CD2-CD1 3.71Å; W244-F251 AromaticContact CD2-CE1 3.5Å; W244-F251 HydrophobicContact CD2-CE1 3.5Å; W244-F251 VanDerWaalsContact CD2-CE1 3.5Å; W244-F251 AromaticContact CE2-CD1 3.58Å; W244-F251 AromaticContact CE2-CE1 3.82Å; W244-F251 AromaticContact CE3-CD1 3.89Å; W244-F251 HydrophobicContact CE3-CD1 3.89Å; W244-F251 AromaticContact CE3-CE1 3.76Å; W244-F251 HydrophobicContact CE3-CE1 3.76Å; W244-F251 HydrophobicContact CG-CD1 4.38Å; W244-F251 AromaticContact CG-CE1 3.79Å; W244-F251 HydrophobicContact CG-CE1 3.79Å; W244-F251 AromaticContact CH2-CD1 3.86Å; W244-F251 HydrophobicContact CH2-CD1 3.86Å; W244-F251 AromaticContact CZ2-CD1 3.67Å; W244-F251 HydrophobicContact CZ2-CD1 3.67Å; W244-F251 HydrophobicContact CZ2-CE1 4.34Å; W244-F251 AromaticContact CZ3-CD1 3.97Å; W244-F251 HydrophobicContact CZ3-CD1 3.97Å; W244-F251 HydrophobicContact CZ3-CE1 4.29Å; W244-L280 HydrophobicContact CE3-CD1 4.18Å; W244-L280 HydrophobicContact CE3-CD2 4.47Å; W244-L280 HydrophobicContact CZ3-CD1 4.27Å; W244-V289 HydrophobicContact CH2-CG2 3.92Å; W244-V289 HydrophobicContact CZ3-CG1 4.41Å; W244-V289 HydrophobicContact CZ3-CG2 3.72Å
245	P	97.2	Very high	95.7	Very high	35 Å²	35	58.8 Å²	58.8	23%	0.227	29%	0.291	C	S	.	.			trans	-61.6	146.3	177.9	-29	38.1	0	0	0	113.4	E241 N247 W248	E241-P245 WeakPolarHBondContact O-CA 3.49Å; E241-P245 VanDerWaalsContact O-N 3.11Å; E241-P245 WeakPolarHBondContact OE1-CA 3.22Å; P245-N247 VanDerWaalsContact C-N 3.26Å; P245-N247 WeakPolarHBondContact CB-OD1 3.41Å; P245-N247 PolarHBondContact O-N 2.9Å; P245-W248 HydrophobicContact CB-CG 4.42Å; P245-W248 HydrophobicContact CG-CD2 4.45Å; P245-W248 HydrophobicContact CG-CZ2 4.46Å; P245-W248 WeakPolarHBondContact O-CB 3.48Å; P245-W248 PolarHBondContact O-N 3.45Å
246	E	94.3	Very high	95.8	Very high	133 Å²	133	57.6 Å²	57.6	62%	0.621	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-62.5	-34.6	-177	-177.7	168.9	-160	0	0	111.7	E241 W248 G249	E241-E246 VanDerWaalsContact OE1-CB 3.3Å; E241-E246 WeakPolarHBondContact OE1-CB 3.28Å; E241-E246 PolarHBondContact OE1-N 3.34Å; E246-W248 PolarHBondContact O-N 3.35Å; E246-G249 PolarHBondContact O-N 2.96Å
247	N	95.9	Very high	95.9	Very high	140 Å²	140	50.6 Å²	50.6	75%	0.749	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-67	-13.5	176.8	69.8	-14.1	0	0	0	113.7	P245 G249	P245-N247 VanDerWaalsContact C-N 3.26Å; P245-N247 WeakPolarHBondContact CB-OD1 3.41Å; P245-N247 PolarHBondContact O-N 2.9Å; N247-G249 VanDerWaalsContact C-N 3.26Å
248	W	95.6	Very high	96	Very high	124 Å²	124	47.8 Å²	47.8	47%	0.47	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-77.2	-15.8	171.2	-68.4	10.5	0	0	0	112.4	W244 P245 E246 P278	W244-W248 AromaticContact CD2-CE3 3.8Å; W244-W248 HydrophobicContact CD2-CE3 3.8Å; W244-W248 HydrophobicContact CD2-CZ3 4.39Å; W244-W248 AromaticContact CE2-CE3 3.95Å; W244-W248 AromaticContact CE3-CE3 3.83Å; W244-W248 HydrophobicContact CE3-CE3 3.83Å; W244-W248 HydrophobicContact CE3-CZ3 4Å; W244-W248 HydrophobicContact CG-CE3 4.36Å; W244-W248 HydrophobicContact CH2-CE3 4.17Å; W244-W248 HydrophobicContact CZ2-CB 4.35Å; W244-W248 HydrophobicContact CZ2-CE3 4.15Å; W244-W248 HydrophobicContact CZ3-CE3 4.01Å; W244-W248 HydrophobicContact CZ3-CZ3 4.15Å; P245-W248 HydrophobicContact CB-CG 4.42Å; P245-W248 HydrophobicContact CG-CD2 4.45Å; P245-W248 HydrophobicContact CG-CZ2 4.46Å; P245-W248 WeakPolarHBondContact O-CB 3.48Å; P245-W248 PolarHBondContact O-N 3.45Å; E246-W248 PolarHBondContact O-N 3.35Å; W248-P278 HydrophobicContact CH2-CG 4.24Å; W248-P278 HydrophobicContact CZ3-CG 3.94Å
249	G	95.7	Very high	96.1	Very high	19 Å²	19	45.8 Å²	45.8	20%	0.196	24%	0.238	C	C	.	.			trans	70.2	-151.4	179.8	0	0	0	0	0	113	W244 E246 N247	W244-G249 PolarHBondContact NE1-O 2.99Å; E246-G249 PolarHBondContact O-N 2.96Å; N247-G249 VanDerWaalsContact C-N 3.26Å
250	P	96.4	Very high	96.1	Very high	49 Å²	49	45.8 Å²	45.8	32%	0.318	24%	0.238	S	C	.	.	S	Bend	trans	-67.9	159.8	-178.4	30.4	-35.1	0	0	0	112.2	R226 V227 R228	R226-P250 VanDerWaalsContact C-CB 3.49Å; R226-P250 HydrophobicContact CB-CB 4.38Å; R226-P250 HydrophobicContact CB-CG 4.43Å; R226-P250 WeakPolarHBondContact O-CB 3.4Å; V227-P250 CarbonylContact O-C 3.59Å; V227-P250 WeakPolarHBondContact O-CA 3.37Å; V227-P250 WeakPolarHBondContact O-CB 3.31Å; R228-P250 HydrophobicContact CG-CB 4.2Å
251	F	95.8	Very high	96.3	Very high	6 Å²	6	44.1 Å²	44.1	3%	0.026	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-58.4	148.5	169.5	-59.5	-53.1	0	0	0	111	V227 P229 V239 W244 Y254 L282 V285	V227-F251 HydrophobicContact CB-CD2 4.35Å; V227-F251 HydrophobicContact CG1-CD2 4.2Å; V227-F251 WeakPolarHBondContact O-CD2 3.3Å; V227-F251 PolarHBondContact O-N 3.27Å; P229-F251 HydrophobicContact CB-CE1 4.31Å; P229-F251 HydrophobicContact CB-CE2 4.19Å; P229-F251 HydrophobicContact CB-CZ 3.64Å; P229-F251 HydrophobicContact CG-CE1 3.81Å; P229-F251 HydrophobicContact CG-CE2 4.17Å; P229-F251 HydrophobicContact CG-CZ 3.59Å; V239-F251 HydrophobicContact CG2-CZ 4.16Å; W244-F251 HydrophobicContact CB-CE1 4.38Å; W244-F251 AromaticContact CD2-CD1 3.71Å; W244-F251 HydrophobicContact CD2-CD1 3.71Å; W244-F251 AromaticContact CD2-CE1 3.5Å; W244-F251 HydrophobicContact CD2-CE1 3.5Å; W244-F251 VanDerWaalsContact CD2-CE1 3.5Å; W244-F251 AromaticContact CE2-CD1 3.58Å; W244-F251 AromaticContact CE2-CE1 3.82Å; W244-F251 AromaticContact CE3-CD1 3.89Å; W244-F251 HydrophobicContact CE3-CD1 3.89Å; W244-F251 AromaticContact CE3-CE1 3.76Å; W244-F251 HydrophobicContact CE3-CE1 3.76Å; W244-F251 HydrophobicContact CG-CD1 4.38Å; W244-F251 AromaticContact CG-CE1 3.79Å; W244-F251 HydrophobicContact CG-CE1 3.79Å; W244-F251 AromaticContact CH2-CD1 3.86Å; W244-F251 HydrophobicContact CH2-CD1 3.86Å; W244-F251 AromaticContact CZ2-CD1 3.67Å; W244-F251 HydrophobicContact CZ2-CD1 3.67Å; W244-F251 HydrophobicContact CZ2-CE1 4.34Å; W244-F251 AromaticContact CZ3-CD1 3.97Å; W244-F251 HydrophobicContact CZ3-CD1 3.97Å; W244-F251 HydrophobicContact CZ3-CE1 4.29Å; F251-Y254 HydrophobicContact CB-CD1 4.34Å; F251-Y254 HydrophobicContact CB-CE1 4.21Å; F251-Y254 HydrophobicContact CD2-CE1 4.39Å; F251-L282 HydrophobicContact CE2-CD1 4.38Å; F251-L282 HydrophobicContact CZ-CD1 4.46Å; F251-V285 HydrophobicContact CB-CG1 4.11Å; F251-V285 HydrophobicContact CD1-CG1 3.53Å; F251-V285 HydrophobicContact CD2-CG1 3.87Å; F251-V285 HydrophobicContact CD2-CG2 4.12Å; F251-V285 HydrophobicContact CE1-CG1 3.83Å; F251-V285 HydrophobicContact CE2-CG1 4.13Å; F251-V285 HydrophobicContact CE2-CG2 4.22Å; F251-V285 HydrophobicContact CG-CG1 3.56Å; F251-V285 HydrophobicContact CZ-CG1 4.11Å
252	P	94.5	Very high	96.4	Very high	12 Å²	12	39.9 Å²	39.9	8%	0.078	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-62.2	161.1	167.7	30.3	-36.4	0	0	0	110.9	Y254 V289 R292	P252-Y254 WeakPolarHBondContact O-CD1 3.47Å; P252-Y254 PolarHBondContact O-N 3.19Å; P252-V289 HydrophobicContact CG-CB 4.5Å; P252-V289 HydrophobicContact CG-CG2 3.75Å; P252-R292 HydrophobicContact CB-CB 4.32Å; P252-R292 HydrophobicContact CB-CG 4.37Å; P252-R292 HydrophobicContact CG-CB 4.47Å
253	P	94.5	Very high	96.5	Very high	39 Å²	39	31.3 Å²	31.3	25%	0.253	17%	0.166	S	C	.	.	P	Polyproline II helix	trans	-54.5	133.9	177.3	-23.7	33.7	0	0	0	111.9	V223 H224 W225 P298	V223-P253 HydrophobicContact CG1-CB 3.79Å; H224-P253 WeakPolarHBondContact O-CA 3.24Å; W225-P253 HydrophobicContact CE3-CB 3.73Å; W225-P253 HydrophobicContact CE3-CG 3.55Å; W225-P253 HydrophobicContact CH2-CB 4.42Å; W225-P253 HydrophobicContact CZ3-CB 3.65Å; W225-P253 HydrophobicContact CZ3-CG 3.47Å; W225-P253 VanDerWaalsContact CZ3-CG 3.47Å; P253-P298 HydrophobicContact CB-CG 3.99Å; P253-P298 WeakPolarHBondContact O-CG 3.37Å
254	Y	96.3	Very high	96.5	Very high	18 Å²	18	29.8 Å²	29.8	7%	0.071	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	151.8	179.9	65.6	-86.1	0	0	0	110.7	V223 H224 V227 F251 P252 D284 V285	V223-Y254 CarbonylContact C-O 3.51Å; V223-Y254 WeakPolarHBondContact CA-O 3.5Å; H224-Y254 HydrophobicContact CB-CD1 4.22Å; H224-Y254 HydrophobicContact CB-CD2 4.35Å; H224-Y254 HydrophobicContact CB-CE1 3.78Å; H224-Y254 HydrophobicContact CB-CE2 3.93Å; H224-Y254 HydrophobicContact CB-CG 4.48Å; H224-Y254 AromaticContact CD2-CE2 3.55Å; H224-Y254 AromaticContact CD2-CZ 3.99Å; H224-Y254 AromaticContact CG-CZ 3.99Å; H224-Y254 PolarHBondContact N-O 3.44Å; H224-Y254 PolarHBondContact O-N 3.47Å; V227-Y254 HydrophobicContact CB-CE1 4.05Å; V227-Y254 HydrophobicContact CG2-CE1 4.14Å; F251-Y254 HydrophobicContact CB-CD1 4.34Å; F251-Y254 HydrophobicContact CB-CE1 4.21Å; F251-Y254 HydrophobicContact CD2-CE1 4.39Å; P252-Y254 WeakPolarHBondContact O-CD1 3.47Å; P252-Y254 PolarHBondContact O-N 3.19Å; Y254-D284 HydrophobicContact CD2-CB 3.97Å; Y254-D284 HydrophobicContact CE2-CB 4.24Å; Y254-V285 HydrophobicContact CD1-CG2 4.32Å; Y254-V285 HydrophobicContact CD2-CG2 4.2Å; Y254-V285 HydrophobicContact CE1-CG2 3.93Å; Y254-V285 HydrophobicContact CE2-CG2 3.79Å; Y254-V285 HydrophobicContact CG-CG2 4.46Å
255	A	97.2	Very high	96.4	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	142.5	175.9	0	0	0	0	0	111.3	Y219 R222 Y260 D284	Y219-A255 HydrophobicContact CD2-CB 4.36Å; Y219-A255 HydrophobicContact CE2-CB 3.47Å; Y219-A255 VanDerWaalsContact CE2-CB 3.47Å; Y219-A255 WeakPolarHBondContact OH-CB 3.44Å; Y219-A255 PolarHBondContact OH-N 2.81Å; R222-A255 CarbonylContact O-C 3.46Å; R222-A255 WeakPolarHBondContact O-CA 3.4Å; A255-Y260 HydrophobicContact CB-CD1 4.38Å; A255-Y260 HydrophobicContact CB-CG 4.17Å; A255-D284 WeakPolarHBondContact O-CB 3.42Å
256	S	96.7	Very high	96.4	Very high	6 Å²	6	28.9 Å²	28.9	4%	0.042	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.1	135.4	177.8	-165.5	0	0	0	0	112.7	R222 H224 T258 G259	R222-S256 PolarHBondContact O-N 3.37Å; H224-S256 WeakPolarHBondContact NE2-CB 3.36Å; H224-S256 PolarHBondContact NE2-OG 3.22Å; S256-T258 PolarHBondContact O-N 3.02Å; S256-T258 VanDerWaalsContact O-N 3.1Å; S256-G259 PolarHBondContact O-N 2.02Å
257	G	96.2	Very high	96.6	Very high	10 Å²	10	22.5 Å²	22.5	10%	0.103	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60	-18.7	178.7	0	0	0	0	0	115.2	K167 G259 D284	K167-G257 PolarHBondContact NZ-O 3.09Å; G257-G259 VanDerWaalsContact C-N 3.26Å; G257-G259 PolarHBondContact O-N 3.22Å; G257-D284 PolarHBondContact N-OD2 2.99Å
258	T	96.5	Very high	96.6	Very high	11 Å²	11	19.7 Å²	19.7	7%	0.067	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	-30.5	179.7	66.3	0	0	0	0	112.5	T168 V172 S256 G306 H325	T168-T258 PolarHBondContact OG1-O 3.01Å; V172-T258 WeakPolarHBondContact CG2-O 3.45Å; S256-T258 PolarHBondContact O-N 3.02Å; S256-T258 VanDerWaalsContact O-N 3.1Å; T258-G306 WeakPolarHBondContact CG2-O 3.29Å; T258-G306 VanDerWaalsContact OG1-C 3.31Å; T258-G306 VanDerWaalsContact OG1-CA 3.27Å; T258-G306 WeakPolarHBondContact OG1-CA 3.19Å; T258-G306 PolarHBondContact OG1-O 2.97Å; T258-H325 HydrophobicContact CG2-CB 4.05Å
259	G	97.8	Very high	96.6	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.7	134.6	170.8	0	0	0	0	0	114	K167 S256 G257	K167-G259 WeakPolarHBondContact O-CA 3.42Å; S256-G259 PolarHBondContact O-N 2.02Å; G257-G259 VanDerWaalsContact C-N 3.26Å; G257-G259 PolarHBondContact O-N 3.22Å
260	Y	98.5	Very high	96.7	Very high	1 Å²	1	14.4 Å²	14.4	0%	0.004	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	151.8	176.7	60.9	-103.5	0	0	0	111.2	T148 K167 Y219 L220 A255 L262 E283 V287	T148-Y260 WeakPolarHBondContact CG2-OH 3.47Å; K167-Y260 HydrophobicContact CB-CD2 4.29Å; K167-Y260 HydrophobicContact CB-CE1 4.2Å; K167-Y260 HydrophobicContact CB-CE2 3.73Å; K167-Y260 HydrophobicContact CD-CD1 4.34Å; K167-Y260 HydrophobicContact CD-CE1 3.63Å; K167-Y260 HydrophobicContact CG-CE1 4.28Å; K167-Y260 HydrophobicContact CG-CE2 4.49Å; K167-Y260 PolarHBondContact N-O 3.48Å; K167-Y260 PolarHBondContact O-N 3.25Å; K167-Y260 VanDerWaalsContact O-N 3.08Å; Y219-Y260 HydrophobicContact CD2-CD2 4.4Å; Y219-Y260 AromaticContact CE2-CD2 3.86Å; Y219-Y260 HydrophobicContact CE2-CD2 3.86Å; Y219-Y260 AromaticContact CE2-CG 3.98Å; Y219-Y260 HydrophobicContact CE2-CG 3.98Å; L220-Y260 CarbonylContact O-C 3.59Å; L220-Y260 VanDerWaalsContact O-CA 3.28Å; L220-Y260 WeakPolarHBondContact O-CA 3.45Å; L220-Y260 WeakPolarHBondContact O-CB 3.48Å; A255-Y260 HydrophobicContact CB-CD1 4.38Å; A255-Y260 HydrophobicContact CB-CG 4.17Å; Y260-L262 HydrophobicContact CD2-CD1 4.37Å; Y260-L262 HydrophobicContact CD2-CG 4.04Å; Y260-L262 HydrophobicContact CE2-CD1 3.82Å; Y260-L262 HydrophobicContact CE2-CG 3.99Å; Y260-E283 PolarHBondContact OH-OE1 3.28Å; Y260-V287 HydrophobicContact CE2-CG1 4.31Å
261	V	98.6	Very high	96.7	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	134.1	178.5	-176.6	0	0	0	0	110.6	Y164 I165 L166 L179 L183 Y219 L220	Y164-V261 HydrophobicContact CD1-CG1 4.22Å; Y164-V261 HydrophobicContact CG-CG1 4.47Å; I165-V261 CarbonylContact O-C 3.58Å; I165-V261 VanDerWaalsContact O-CA 3.3Å; I165-V261 WeakPolarHBondContact O-CA 3.21Å; L166-V261 HydrophobicContact CB-CG2 4.33Å; L166-V261 HydrophobicContact CD1-CG2 3.87Å; L179-V261 HydrophobicContact CD1-CG2 4.1Å; L183-V261 HydrophobicContact CD1-CG1 4.29Å; L183-V261 HydrophobicContact CD2-CB 4.45Å; L183-V261 HydrophobicContact CD2-CG1 3.85Å; Y219-V261 CarbonylContact C-O 3.4Å; Y219-V261 WeakPolarHBondContact CA-O 3.45Å; L220-V261 HydrophobicContact CB-CB 4.21Å; L220-V261 PolarHBondContact N-O 3.49Å; L220-V261 PolarHBondContact O-N 2.93Å
262	L	98.4	Very high	96.7	Very high	1 Å²	1	18.9 Å²	18.9	1%	0.005	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	132.9	169.5	-64	172.5	0	0	0	109.5	L152 Y164 I165 L218 Y219 Y260 A266 V267 I270	L152-L262 HydrophobicContact CD1-CD1 4.08Å; L152-L262 HydrophobicContact CD2-CD1 4.12Å; Y164-L262 CarbonylContact C-O 3.53Å; I165-L262 PolarHBondContact N-O 2.81Å; I165-L262 PolarHBondContact O-N 3.43Å; L218-L262 CarbonylContact O-C 3.54Å; L218-L262 WeakPolarHBondContact O-CA 3.28Å; Y219-L262 HydrophobicContact CD2-CD2 3.35Å; Y219-L262 HydrophobicContact CD2-CG 4.39Å; Y219-L262 HydrophobicContact CE2-CD2 4.01Å; Y219-L262 HydrophobicContact CG-CD2 3.74Å; Y260-L262 HydrophobicContact CD2-CD1 4.37Å; Y260-L262 HydrophobicContact CD2-CG 4.04Å; Y260-L262 HydrophobicContact CE2-CD1 3.82Å; Y260-L262 HydrophobicContact CE2-CG 3.99Å; L262-A266 HydrophobicContact CB-CB 4.33Å; L262-A266 HydrophobicContact CD2-CB 4.11Å; L262-V267 HydrophobicContact CB-CG2 3.73Å; L262-V267 HydrophobicContact CD1-CG2 4.03Å; L262-I270 HydrophobicContact CD1-CD1 3.77Å; L262-I270 HydrophobicContact CD2-CD1 3.74Å; L262-I270 HydrophobicContact CG-CD1 4.43Å
263	S	97	Very high	96.7	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	155.3	159.2	60	0	0	0	0	110.5	R163 P216 L218 S265 A266 V267	R163-S263 CarbonylContact O-C 3.57Å; R163-S263 WeakPolarHBondContact O-CA 3.43Å; P216-S263 VanDerWaalsContact O-CB 3.29Å; P216-S263 WeakPolarHBondContact O-CB 3.39Å; P216-S263 PolarHBondContact O-OG 3.28Å; L218-S263 PolarHBondContact N-OG 3.27Å; L218-S263 PolarHBondContact O-N 3.29Å; L218-S263 PolarHBondContact O-OG 2.75Å; S263-S265 PolarHBondContact O-N 3.48Å; S263-A266 WeakPolarHBondContact O-CA 3.44Å; S263-A266 WeakPolarHBondContact O-CB 3.43Å; S263-A266 PolarHBondContact O-N 2.96Å; S263-A266 WeakPolarHBondContact OG-CB 3.39Å; S263-A266 PolarHBondContact OG-N 3.43Å; S263-V267 PolarHBondContact O-N 2.92Å
264	I	96.2	Very high	96.8	Very high	9 Å²	9	16.7 Å²	16.7	5%	0.046	9%	0.085	C	C	.	.	H	α-helix	trans	-57.4	-35.6	174.4	-172.2	60.3	0	0	0	112.9	V155 A162 R163 I165 V215 A266 V267 Q268	V155-I264 HydrophobicContact CG1-CD1 3.81Å; A162-I264 WeakPolarHBondContact O-CB 3.39Å; A162-I264 WeakPolarHBondContact O-CG2 3.48Å; R163-I264 PolarHBondContact O-N 3.5Å; I165-I264 HydrophobicContact CD1-CB 4.22Å; I165-I264 HydrophobicContact CD1-CD1 4.2Å; V215-I264 HydrophobicContact CB-CG2 4.08Å; V215-I264 HydrophobicContact CG2-CG2 3.83Å; I264-A266 VanDerWaalsContact C-N 3.34Å; I264-V267 WeakPolarHBondContact O-CB 3.17Å; I264-V267 PolarHBondContact O-N 3.4Å; I264-Q268 WeakPolarHBondContact O-CG 3.39Å; I264-Q268 PolarHBondContact O-N 2.51Å
265	S	95.6	Very high	96.8	Very high	28 Å²	28	17.6 Å²	17.6	20%	0.196	9%	0.094	C	C	.	.	H	α-helix	trans	-67.8	-34.4	175.2	-61.4	0	0	0	0	112.1	V215 L217 S263 Q268 L269	V215-S265 WeakPolarHBondContact O-CB 3.27Å; V215-S265 PolarHBondContact O-OG 3.33Å; V215-S265 VanDerWaalsContact O-OG 3.11Å; L217-S265 VanDerWaalsContact CD2-C 3.49Å; S263-S265 PolarHBondContact O-N 3.48Å; S265-Q268 PolarHBondContact O-N 2.82Å; S265-L269 WeakPolarHBondContact O-CB 3.28Å; S265-L269 PolarHBondContact O-N 3.24Å
266	A	96.8	Very high	96.6	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-68.3	-38.8	172.7	0	0	0	0	0	111.6	L217 L218 L262 S263 I264 L269 I270 L296	L217-A266 HydrophobicContact CD2-CB 4.14Å; L218-A266 VanDerWaalsContact O-CB 3.28Å; L218-A266 WeakPolarHBondContact O-CB 3.32Å; L262-A266 HydrophobicContact CB-CB 4.33Å; L262-A266 HydrophobicContact CD2-CB 4.11Å; S263-A266 WeakPolarHBondContact O-CA 3.44Å; S263-A266 WeakPolarHBondContact O-CB 3.43Å; S263-A266 PolarHBondContact O-N 2.96Å; S263-A266 WeakPolarHBondContact OG-CB 3.39Å; S263-A266 PolarHBondContact OG-N 3.43Å; I264-A266 VanDerWaalsContact C-N 3.34Å; A266-L269 PolarHBondContact O-N 2.62Å; A266-I270 WeakPolarHBondContact O-CB 3.43Å; A266-I270 WeakPolarHBondContact O-CD1 3.37Å; A266-I270 VanDerWaalsContact O-CG1 3.3Å; A266-I270 WeakPolarHBondContact O-CG1 3.41Å; A266-I270 PolarHBondContact O-N 2.85Å; A266-L296 HydrophobicContact CB-CD2 3.61Å
267	V	97.8	Very high	96.5	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-58.7	-49.5	172.8	172.8	0	0	0	0	110.9	L152 I165 L262 S263 I264 L269 I270 L271	L152-V267 HydrophobicContact CB-CG1 3.96Å; L152-V267 HydrophobicContact CD2-CG1 4.19Å; L152-V267 HydrophobicContact CD2-CG2 3.9Å; L152-V267 HydrophobicContact CG-CG1 4.49Å; I165-V267 HydrophobicContact CD1-CG2 3.88Å; I165-V267 HydrophobicContact CG1-CG2 4.31Å; L262-V267 HydrophobicContact CB-CG2 3.73Å; L262-V267 HydrophobicContact CD1-CG2 4.03Å; S263-V267 PolarHBondContact O-N 2.92Å; I264-V267 WeakPolarHBondContact O-CB 3.17Å; I264-V267 PolarHBondContact O-N 3.4Å; V267-L269 VanDerWaalsContact C-N 3.34Å; V267-L269 PolarHBondContact O-N 3.29Å; V267-I270 PolarHBondContact O-N 3.18Å; V267-L271 HydrophobicContact CG1-CD1 3.97Å; V267-L271 HydrophobicContact CG1-CG 4.49Å; V267-L271 WeakPolarHBondContact O-CG 3.41Å; V267-L271 PolarHBondContact O-N 2.96Å
268	Q	96.3	Very high	96.4	Very high	80 Å²	80	24 Å²	24	37%	0.374	12%	0.119	S	C	.	.	H	α-helix	trans	-59.2	-44.6	177.2	-75.9	170.1	-6.4	0	0	112.2	N156 I264 S265 K272	N156-Q268 WeakPolarHBondContact OD1-CG 3.35Å; I264-Q268 WeakPolarHBondContact O-CG 3.39Å; I264-Q268 PolarHBondContact O-N 2.51Å; S265-Q268 PolarHBondContact O-N 2.82Å; Q268-K272 WeakPolarHBondContact O-CB 3.45Å; Q268-K272 PolarHBondContact O-N 2.97Å; Q268-K272 VanDerWaalsContact O-N 3.1Å
269	L	95.6	Very high	96.2	Very high	33 Å²	33	28.4 Å²	28.4	17%	0.173	15%	0.148	C	C	.	.	H	α-helix	trans	-59.8	-51.1	176.8	177.3	71.5	0	0	0	111.2	L217 S265 A266 V267 L271 K272 V273 L296	L217-L269 HydrophobicContact CD1-CD2 4.35Å; L217-L269 HydrophobicContact CD2-CB 4.39Å; L217-L269 HydrophobicContact CD2-CD2 4.14Å; S265-L269 WeakPolarHBondContact O-CB 3.28Å; S265-L269 PolarHBondContact O-N 3.24Å; A266-L269 PolarHBondContact O-N 2.62Å; V267-L269 VanDerWaalsContact C-N 3.34Å; V267-L269 PolarHBondContact O-N 3.29Å; L269-L271 PolarHBondContact O-N 2.86Å; L269-K272 WeakPolarHBondContact O-CB 3.3Å; L269-K272 PolarHBondContact O-N 2.78Å; L269-K272 VanDerWaalsContact O-N 3.17Å; L269-V273 WeakPolarHBondContact O-CG2 3.26Å; L269-V273 PolarHBondContact O-N 2.98Å; L269-L296 HydrophobicContact CD2-CB 3.74Å; L269-L296 HydrophobicContact CD2-CD2 4.14Å
270	I	97.1	Very high	96.1	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-57.6	-49.7	179.8	-73.7	160.4	0	0	0	110.4	L152 L262 A266 V267 K272 V273 A274 V287 A291	L152-I270 HydrophobicContact CD1-CG2 4.41Å; L262-I270 HydrophobicContact CD1-CD1 3.77Å; L262-I270 HydrophobicContact CD2-CD1 3.74Å; L262-I270 HydrophobicContact CG-CD1 4.43Å; A266-I270 WeakPolarHBondContact O-CB 3.43Å; A266-I270 WeakPolarHBondContact O-CD1 3.37Å; A266-I270 VanDerWaalsContact O-CG1 3.3Å; A266-I270 WeakPolarHBondContact O-CG1 3.41Å; A266-I270 PolarHBondContact O-N 2.85Å; V267-I270 PolarHBondContact O-N 3.18Å; I270-K272 PolarHBondContact O-N 2.88Å; I270-V273 PolarHBondContact O-N 2.82Å; I270-A274 WeakPolarHBondContact O-CA 3.37Å; I270-A274 WeakPolarHBondContact O-CB 3.45Å; I270-A274 PolarHBondContact O-N 3.33Å; I270-V287 HydrophobicContact CD1-CG1 4.02Å; I270-A291 HydrophobicContact CG1-CB 4.4Å
271	L	97	Very high	95.9	Very high	23 Å²	23	29 Å²	29	12%	0.12	15%	0.151	C	C	.	.	H	α-helix	trans	-60.4	-33.8	179.7	-70.6	171.9	0	0	0	112.8	L51 L149 L152 N153 N156 V267 L269 V273	L51-L271 HydrophobicContact CD1-CD2 4.09Å; L149-L271 HydrophobicContact CD2-CD2 4.26Å; L152-L271 HydrophobicContact CB-CD2 4.22Å; L152-L271 HydrophobicContact CB-CG 4.49Å; N153-L271 HydrophobicContact CB-CD1 4.46Å; N153-L271 HydrophobicContact CB-CD2 4.19Å; N156-L271 HydrophobicContact CB-CD1 3.66Å; V267-L271 HydrophobicContact CG1-CD1 3.97Å; V267-L271 HydrophobicContact CG1-CG 4.49Å; V267-L271 WeakPolarHBondContact O-CG 3.41Å; V267-L271 PolarHBondContact O-N 2.96Å; L269-L271 PolarHBondContact O-N 2.86Å; L271-V273 VanDerWaalsContact C-N 3.34Å; L271-V273 PolarHBondContact O-N 3.44Å
272	K	95.9	Very high	95.9	Very high	126 Å²	126	29.4 Å²	29.4	55%	0.548	15%	0.154	S	C	.	.	H	α-helix	trans	-69.3	-29.2	179.6	-163	-177.2	-157.9	-161.9	0	113.2	P47 G48 Q268 L269 I270	P47-K272 WeakPolarHBondContact CA-O 3.33Å; P47-K272 HydrophobicContact CB-CD 4.26Å; P47-K272 HydrophobicContact CB-CG 3.76Å; P47-K272 HydrophobicContact CG-CD 3.8Å; P47-K272 HydrophobicContact CG-CG 3.88Å; G48-K272 PolarHBondContact N-O 2.9Å; Q268-K272 WeakPolarHBondContact O-CB 3.45Å; Q268-K272 PolarHBondContact O-N 2.97Å; Q268-K272 VanDerWaalsContact O-N 3.1Å; L269-K272 WeakPolarHBondContact O-CB 3.3Å; L269-K272 PolarHBondContact O-N 2.78Å; L269-K272 VanDerWaalsContact O-N 3.17Å; I270-K272 PolarHBondContact O-N 2.88Å
273	V	95.7	Very high	95.8	Very high	3 Å²	3	29.8 Å²	29.8	2%	0.018	16%	0.155	C	C	.	.	H	α-helix	trans	-114.1	-11.1	-174.4	-56.3	0	0	0	0	114.1	L269 I270 L271 S275 R276 S290 R293	L269-V273 WeakPolarHBondContact O-CG2 3.26Å; L269-V273 PolarHBondContact O-N 2.98Å; I270-V273 PolarHBondContact O-N 2.82Å; L271-V273 VanDerWaalsContact C-N 3.34Å; L271-V273 PolarHBondContact O-N 3.44Å; V273-S275 VanDerWaalsContact C-N 3.27Å; V273-S275 PolarHBondContact O-N 3.47Å; V273-R276 VanDerWaalsContact O-CB 3.29Å; V273-R276 WeakPolarHBondContact O-CB 3.42Å; V273-R276 PolarHBondContact O-N 2.75Å; V273-S290 WeakPolarHBondContact CG2-O 3.03Å; V273-R293 HydrophobicContact CG2-CB 4.37Å
274	A	96.1	Very high	95.8	Very high	1 Å²	1	31 Å²	31	1%	0.008	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-56.9	-35	-174.3	0	0	0	0	0	113.7	L51 L149 I270 R276 A277 F286	L51-A274 HydrophobicContact CD1-CB 3.77Å; L51-A274 HydrophobicContact CD2-CB 4.09Å; L51-A274 HydrophobicContact CG-CB 4.3Å; L149-A274 HydrophobicContact CD2-CB 4.35Å; I270-A274 WeakPolarHBondContact O-CA 3.37Å; I270-A274 WeakPolarHBondContact O-CB 3.45Å; I270-A274 PolarHBondContact O-N 3.33Å; A274-R276 PolarHBondContact O-N 2.79Å; A274-R276 VanDerWaalsContact O-N 3.13Å; A274-A277 WeakPolarHBondContact O-CB 3.42Å; A274-A277 PolarHBondContact O-N 2.79Å; A274-F286 HydrophobicContact CB-CE1 3.92Å; A274-F286 HydrophobicContact CB-CZ 3.96Å; A274-F286 WeakPolarHBondContact O-CZ 3.34Å
275	S	95.7	Very high	95.9	Very high	38 Å²	38	30.7 Å²	30.7	27%	0.266	16%	0.16	S	C	.	.	G	3₁₀ helix	trans	-68.6	-8.2	176.7	55.3	0	0	0	0	114.1	G48 P49 V273	G48-S275 VanDerWaalsContact CA-OG 3.28Å; G48-S275 WeakPolarHBondContact CA-OG 3.34Å; P49-S275 WeakPolarHBondContact CD-OG 3.06Å; P49-S275 VanDerWaalsContact O-CB 3.29Å; P49-S275 WeakPolarHBondContact O-CB 3.38Å; P49-S275 PolarHBondContact O-OG 3.13Å; V273-S275 VanDerWaalsContact C-N 3.27Å; V273-S275 PolarHBondContact O-N 3.47Å
276	R	93.8	Very high	96.1	Very high	119 Å²	119	29.7 Å²	29.7	45%	0.449	15%	0.153	S	C	.	.	G	3₁₀ helix	trans	-92	-10.1	171.6	-57.1	-67.2	-167	155.4	-0.7	112.8	S46 P47 V273 A274 R293	S46-R276 PolarHBondContact OG-NH2 3.42Å; P47-R276 PolarHBondContact O-NE 3.45Å; P47-R276 PolarHBondContact O-NH2 2.78Å; V273-R276 VanDerWaalsContact O-CB 3.29Å; V273-R276 WeakPolarHBondContact O-CB 3.42Å; V273-R276 PolarHBondContact O-N 2.75Å; A274-R276 PolarHBondContact O-N 2.79Å; A274-R276 VanDerWaalsContact O-N 3.13Å; R276-R293 PolarHBondContact O-NE 3.46Å; R276-R293 PolarHBondContact O-NH2 3.1Å
277	A	93.7	Very high	96.1	Very high	11 Å²	11	29.8 Å²	29.8	9%	0.091	15%	0.153	C	C	.	.	S	Bend	trans	-85.3	147.1	174.7	0	0	0	0	0	110.2	A274 F286 V289	A274-A277 WeakPolarHBondContact O-CB 3.42Å; A274-A277 PolarHBondContact O-N 2.79Å; A277-F286 HydrophobicContact CB-CD2 4.42Å; A277-F286 HydrophobicContact CB-CE2 3.88Å; A277-F286 HydrophobicContact CB-CZ 4.18Å; A277-V289 HydrophobicContact CB-CG1 3.92Å
278	P	93.9	Very high	96.1	Very high	21 Å²	21	29.8 Å²	29.8	14%	0.136	15%	0.153	C	C	.	.			trans	-56.1	143.5	168	-19.4	30.5	0	0	0	110.1	L243 W248 L280 F286	L243-P278 WeakPolarHBondContact O-CB 3.5Å; W248-P278 HydrophobicContact CH2-CG 4.24Å; W248-P278 HydrophobicContact CZ3-CG 3.94Å; P278-L280 HydrophobicContact CB-CD2 4.39Å; P278-L280 HydrophobicContact CB-CG 4.27Å; P278-L280 PolarHBondContact O-N 2.79Å; P278-F286 VanDerWaalsContact O-CD2 3.31Å; P278-F286 WeakPolarHBondContact O-CD2 3.33Å; P278-F286 WeakPolarHBondContact O-CE2 3.4Å
279	P	93.5	Very high	96.1	Very high	103 Å²	103	26.4 Å²	26.4	67%	0.669	14%	0.138	S	C	*	.			trans	-74.9	68.1	-178.4	32.3	-36.2	0	0	0	111.2	L243	L243-P279 HydrophobicContact CD2-CG 4.04Å
280	L	95.8	Very high	96.2	Very high	2 Å²	2	24.8 Å²	24.8	1%	0.01	13%	0.129	C	C	.	.			trans	-68	133.1	-176.5	-64.1	171.2	0	0	0	110.6	T145 V239 L243 W244 P278 L282 V285 F286 V289	T145-L280 PolarHBondContact OG1-O 2.76Å; V239-L280 HydrophobicContact CG1-CD2 3.87Å; L243-L280 HydrophobicContact CB-CD2 4.18Å; W244-L280 HydrophobicContact CE3-CD1 4.18Å; W244-L280 HydrophobicContact CE3-CD2 4.47Å; W244-L280 HydrophobicContact CZ3-CD1 4.27Å; P278-L280 HydrophobicContact CB-CD2 4.39Å; P278-L280 HydrophobicContact CB-CG 4.27Å; P278-L280 PolarHBondContact O-N 2.79Å; L280-L282 PolarHBondContact O-N 3Å; L280-V285 HydrophobicContact CD1-CG1 3.79Å; L280-F286 HydrophobicContact CB-CB 4.31Å; L280-F286 HydrophobicContact CB-CD2 4.35Å; L280-V289 HydrophobicContact CD1-CG2 4.15Å
281	P	93.8	Very high	96.1	Very high	11 Å²	11	24.8 Å²	24.8	7%	0.071	13%	0.129	C	C	.	.	S	Bend	trans	-79.2	11.5	175.8	36.8	-39.5	0	0	0	112.7	R142	R142-P281 HydrophobicContact CB-CB 4.36Å
282	L	97.3	Very high	96	Very high	9 Å²	9	29.5 Å²	29.5	5%	0.047	15%	0.145	C	C	.	.			trans	-110.6	104.6	174.9	-54.1	-176.6	0	0	0	107.1	H237 V239 F251 L280 D284 V285 F286	H237-L282 HydrophobicContact CB-CD2 4.19Å; V239-L282 HydrophobicContact CG2-CD1 3.5Å; V239-L282 VanDerWaalsContact CG2-CD1 3.5Å; V239-L282 HydrophobicContact CG2-CG 3.94Å; F251-L282 HydrophobicContact CE2-CD1 4.38Å; F251-L282 HydrophobicContact CZ-CD1 4.46Å; L280-L282 PolarHBondContact O-N 3Å; L282-D284 PolarHBondContact O-N 3.24Å; L282-V285 HydrophobicContact CB-CB 3.87Å; L282-V285 HydrophobicContact CB-CG2 3.78Å; L282-V285 HydrophobicContact CD1-CG2 3.91Å; L282-V285 PolarHBondContact O-N 2.72Å; L282-F286 WeakPolarHBondContact O-CB 3.44Å; L282-F286 PolarHBondContact O-N 2.57Å
283	E	97.4	Very high	96	Very high	8 Å²	8	27.6 Å²	27.6	4%	0.037	14%	0.135	C	C	.	.	H	α-helix	trans	-61.7	-45.5	-169.2	177.3	-86.5	166.5	0	0	113	L144 T145 T148 K167 Y260 F286 V287	L144-E283 HydrophobicContact CB-CB 3.77Å; L144-E283 HydrophobicContact CB-CG 4.25Å; T145-E283 WeakPolarHBondContact OG1-CA 3.35Å; T148-E283 VanDerWaalsContact CB-OE1 3.25Å; T148-E283 WeakPolarHBondContact CB-OE1 3.41Å; T148-E283 HydrophobicContact CG2-CG 4.28Å; T148-E283 WeakPolarHBondContact CG2-OE1 3.34Å; T148-E283 WeakPolarHBondContact OG1-CG 3.41Å; T148-E283 PolarHBondContact OG1-OE1 3.43Å; K167-E283 IonicContact NZ-OE2 2.79Å; Y260-E283 PolarHBondContact OH-OE1 3.28Å; E283-F286 WeakPolarHBondContact O-CB 3.38Å; E283-F286 PolarHBondContact O-N 3.42Å; E283-V287 WeakPolarHBondContact O-CG2 3.25Å; E283-V287 PolarHBondContact O-N 3.25Å
284	D	97.9	Very high	95.9	Very high	26 Å²	26	27.7 Å²	27.7	14%	0.139	14%	0.136	C	C	.	.	H	α-helix	trans	-66.5	-44	-179.8	53.7	-7.1	0	0	0	112.1	Y254 A255 G257 L282 V287 G288	Y254-D284 HydrophobicContact CD2-CB 3.97Å; Y254-D284 HydrophobicContact CE2-CB 4.24Å; A255-D284 WeakPolarHBondContact O-CB 3.42Å; G257-D284 PolarHBondContact N-OD2 2.99Å; L282-D284 PolarHBondContact O-N 3.24Å; D284-V287 PolarHBondContact O-N 3.39Å; D284-G288 PolarHBondContact O-N 3.36Å
285	V	98	Very high	95.8	Very high	2 Å²	2	28.8 Å²	28.8	1%	0.012	15%	0.148	C	C	.	.	H	α-helix	trans	-62.1	-44.3	172.4	-175.9	0	0	0	0	110.7	F251 Y254 L280 L282 V287 G288 V289	F251-V285 HydrophobicContact CB-CG1 4.11Å; F251-V285 HydrophobicContact CD1-CG1 3.53Å; F251-V285 HydrophobicContact CD2-CG1 3.87Å; F251-V285 HydrophobicContact CD2-CG2 4.12Å; F251-V285 HydrophobicContact CE1-CG1 3.83Å; F251-V285 HydrophobicContact CE2-CG1 4.13Å; F251-V285 HydrophobicContact CE2-CG2 4.22Å; F251-V285 HydrophobicContact CG-CG1 3.56Å; F251-V285 HydrophobicContact CZ-CG1 4.11Å; Y254-V285 HydrophobicContact CD1-CG2 4.32Å; Y254-V285 HydrophobicContact CD2-CG2 4.2Å; Y254-V285 HydrophobicContact CE1-CG2 3.93Å; Y254-V285 HydrophobicContact CE2-CG2 3.79Å; Y254-V285 HydrophobicContact CG-CG2 4.46Å; L280-V285 HydrophobicContact CD1-CG1 3.79Å; L282-V285 HydrophobicContact CB-CB 3.87Å; L282-V285 HydrophobicContact CB-CG2 3.78Å; L282-V285 HydrophobicContact CD1-CG2 3.91Å; L282-V285 PolarHBondContact O-N 2.72Å; V285-V287 VanDerWaalsContact C-N 3.33Å; V285-V287 PolarHBondContact O-N 3.31Å; V285-G288 PolarHBondContact O-N 3.32Å; V285-V289 HydrophobicContact CG1-CG2 4.14Å; V285-V289 WeakPolarHBondContact O-CB 3.29Å; V285-V289 VanDerWaalsContact O-CG2 3.29Å; V285-V289 WeakPolarHBondContact O-CG2 3.48Å; V285-V289 PolarHBondContact O-N 3.44Å
286	F	98.1	Very high	95.7	Very high	8 Å²	8	27.7 Å²	27.7	4%	0.035	14%	0.139	C	C	.	.	H	α-helix	trans	-59.3	-44.7	178.5	-178.3	-84.7	0	0	0	111.6	T145 L149 A274 A277 P278 L280 L282 E283 V289 S290	T145-F286 HydrophobicContact CG2-CB 3.82Å; T145-F286 HydrophobicContact CG2-CD1 3.65Å; T145-F286 HydrophobicContact CG2-CD2 3.83Å; T145-F286 HydrophobicContact CG2-CE1 4.2Å; T145-F286 HydrophobicContact CG2-CE2 4.33Å; T145-F286 HydrophobicContact CG2-CG 3.45Å; T145-F286 VanDerWaalsContact CG2-CG 3.45Å; L149-F286 HydrophobicContact CD1-CE1 3.78Å; L149-F286 HydrophobicContact CD1-CZ 4.07Å; L149-F286 HydrophobicContact CD2-CE1 3.99Å; L149-F286 HydrophobicContact CG-CE1 4.21Å; A274-F286 HydrophobicContact CB-CE1 3.92Å; A274-F286 HydrophobicContact CB-CZ 3.96Å; A274-F286 WeakPolarHBondContact O-CZ 3.34Å; A277-F286 HydrophobicContact CB-CD2 4.42Å; A277-F286 HydrophobicContact CB-CE2 3.88Å; A277-F286 HydrophobicContact CB-CZ 4.18Å; P278-F286 VanDerWaalsContact O-CD2 3.31Å; P278-F286 WeakPolarHBondContact O-CD2 3.33Å; P278-F286 WeakPolarHBondContact O-CE2 3.4Å; L280-F286 HydrophobicContact CB-CB 4.31Å; L280-F286 HydrophobicContact CB-CD2 4.35Å; L282-F286 WeakPolarHBondContact O-CB 3.44Å; L282-F286 PolarHBondContact O-N 2.57Å; E283-F286 WeakPolarHBondContact O-CB 3.38Å; E283-F286 PolarHBondContact O-N 3.42Å; F286-V289 PolarHBondContact O-N 3.06Å; F286-S290 WeakPolarHBondContact CE1-OG 3.15Å; F286-S290 VanDerWaalsContact O-CB 3.32Å; F286-S290 WeakPolarHBondContact O-CB 3.36Å; F286-S290 PolarHBondContact O-N 2.77Å; F286-S290 PolarHBondContact O-OG 2.81Å
287	V	98.3	Very high	95.6	Very high	2 Å²	2	22.9 Å²	22.9	1%	0.012	13%	0.125	C	C	.	.	H	α-helix	trans	-62.5	-45.9	176.2	171.1	0	0	0	0	110.5	T148 Y219 Y260 I270 E283 D284 V285 S290 A291	T148-V287 HydrophobicContact CG2-CG2 4.16Å; Y219-V287 HydrophobicContact CE1-CG1 4.44Å; Y219-V287 HydrophobicContact CE2-CG1 4.15Å; Y260-V287 HydrophobicContact CE2-CG1 4.31Å; I270-V287 HydrophobicContact CD1-CG1 4.02Å; E283-V287 WeakPolarHBondContact O-CG2 3.25Å; E283-V287 PolarHBondContact O-N 3.25Å; D284-V287 PolarHBondContact O-N 3.39Å; V285-V287 VanDerWaalsContact C-N 3.33Å; V285-V287 PolarHBondContact O-N 3.31Å; V287-S290 PolarHBondContact O-N 3.31Å; V287-A291 WeakPolarHBondContact O-CB 3.3Å; V287-A291 PolarHBondContact O-N 3.19Å
288	G	97.4	Very high	95.7	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-63.8	-41.7	177.4	0	0	0	0	0	114.1	D284 V285 S290 A291 R292	D284-G288 PolarHBondContact O-N 3.36Å; V285-G288 PolarHBondContact O-N 3.32Å; G288-S290 VanDerWaalsContact C-N 3.35Å; G288-A291 PolarHBondContact O-N 3.47Å; G288-R292 WeakPolarHBondContact O-CB 3.3Å; G288-R292 PolarHBondContact O-N 3.17Å
289	V	96.6	Very high	95.7	Very high	8 Å²	8	22.6 Å²	22.6	5%	0.048	12%	0.122	C	C	.	.	H	α-helix	trans	-62.6	-43.3	174	170.3	0	0	0	0	110.8	W244 P252 A277 L280 V285 F286 R292 R293	W244-V289 HydrophobicContact CH2-CG2 3.92Å; W244-V289 HydrophobicContact CZ3-CG1 4.41Å; W244-V289 HydrophobicContact CZ3-CG2 3.72Å; P252-V289 HydrophobicContact CG-CB 4.5Å; P252-V289 HydrophobicContact CG-CG2 3.75Å; A277-V289 HydrophobicContact CB-CG1 3.92Å; L280-V289 HydrophobicContact CD1-CG2 4.15Å; V285-V289 HydrophobicContact CG1-CG2 4.14Å; V285-V289 WeakPolarHBondContact O-CB 3.29Å; V285-V289 VanDerWaalsContact O-CG2 3.29Å; V285-V289 WeakPolarHBondContact O-CG2 3.48Å; V285-V289 PolarHBondContact O-N 3.44Å; F286-V289 PolarHBondContact O-N 3.06Å; V289-R292 PolarHBondContact O-N 3.29Å; V289-R293 WeakPolarHBondContact O-CG 3.13Å; V289-R293 PolarHBondContact O-N 3.26Å
290	S	97.1	Very high	95.6	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-65.3	-44.7	177.6	-60.4	0	0	0	0	111.6	V273 F286 V287 G288 R292 R293 G294	V273-S290 WeakPolarHBondContact CG2-O 3.03Å; F286-S290 WeakPolarHBondContact CE1-OG 3.15Å; F286-S290 VanDerWaalsContact O-CB 3.32Å; F286-S290 WeakPolarHBondContact O-CB 3.36Å; F286-S290 PolarHBondContact O-N 2.77Å; F286-S290 PolarHBondContact O-OG 2.81Å; V287-S290 PolarHBondContact O-N 3.31Å; G288-S290 VanDerWaalsContact C-N 3.35Å; S290-R292 PolarHBondContact O-N 3.5Å; S290-R293 PolarHBondContact O-N 3.17Å; S290-G294 PolarHBondContact O-N 3.47Å
291	A	96.3	Very high	95.4	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-58.2	-49.4	175.4	0	0	0	0	0	111	Y219 I270 V287 G288 R293 G294 G295 L296	Y219-A291 HydrophobicContact CD1-CB 3.82Å; Y219-A291 HydrophobicContact CE1-CB 3.94Å; I270-A291 HydrophobicContact CG1-CB 4.4Å; V287-A291 WeakPolarHBondContact O-CB 3.3Å; V287-A291 PolarHBondContact O-N 3.19Å; G288-A291 PolarHBondContact O-N 3.47Å; A291-R293 VanDerWaalsContact C-N 3.31Å; A291-R293 PolarHBondContact O-N 2.92Å; A291-G294 CarbonylContact O-C 3.56Å; A291-G294 WeakPolarHBondContact O-CA 3.34Å; A291-G294 PolarHBondContact O-N 2.97Å; A291-G295 PolarHBondContact O-N 2.87Å; A291-L296 CarbonylContact C-O 3.54Å; A291-L296 HydrophobicContact CB-CB 4.21Å; A291-L296 HydrophobicContact CB-CD2 4.42Å; A291-L296 HydrophobicContact CB-CG 4.36Å; A291-L296 WeakPolarHBondContact O-CB 3.35Å; A291-L296 PolarHBondContact O-N 3.47Å
292	R	95.1	Very high	95.1	Very high	121 Å²	121	17.5 Å²	17.5	46%	0.457	9%	0.088	S	C	.	.	H	α-helix	trans	-59.9	-40.8	177.4	-179.6	173.6	-180	-115.2	3.9	112.3	L41 P42 P252 G288 V289 S290 G294 G295 L296	L41-R292 HydrophobicContact CD2-CG 4.33Å; P42-R292 HydrophobicContact CG-CG 4.32Å; P252-R292 HydrophobicContact CB-CB 4.32Å; P252-R292 HydrophobicContact CB-CG 4.37Å; P252-R292 HydrophobicContact CG-CB 4.47Å; G288-R292 WeakPolarHBondContact O-CB 3.3Å; G288-R292 PolarHBondContact O-N 3.17Å; V289-R292 PolarHBondContact O-N 3.29Å; S290-R292 PolarHBondContact O-N 3.5Å; R292-G294 PolarHBondContact O-N 3.31Å; R292-G295 PolarHBondContact O-N 3.17Å; R292-L296 WeakPolarHBondContact CA-O 3.41Å; R292-L296 PolarHBondContact N-O 3.46Å
293	R	94.1	Very high	94.8	Very high	87 Å²	87	19.7 Å²	19.7	33%	0.328	10%	0.097	S	C	.	.	H	α-helix	trans	-62.4	-33.2	174.3	-77.3	-178.5	176.2	-83.7	2.7	112	A45 V273 R276 V289 S290 A291 G295	A45-R293 HydrophobicContact CB-CB 4.39Å; A45-R293 WeakPolarHBondContact CB-O 3.27Å; A45-R293 PolarHBondContact N-O 3.27Å; V273-R293 HydrophobicContact CG2-CB 4.37Å; R276-R293 PolarHBondContact O-NE 3.46Å; R276-R293 PolarHBondContact O-NH2 3.1Å; V289-R293 WeakPolarHBondContact O-CG 3.13Å; V289-R293 PolarHBondContact O-N 3.26Å; S290-R293 PolarHBondContact O-N 3.17Å; A291-R293 VanDerWaalsContact C-N 3.31Å; A291-R293 PolarHBondContact O-N 2.92Å; R293-G295 PolarHBondContact O-N 3.03Å
294	G	94.4	Very high	94.6	Very high	4 Å²	4	19.3 Å²	19.3	4%	0.041	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	0.2	172.2	0	0	0	0	0	114.8	S290 A291 R292	S290-G294 PolarHBondContact O-N 3.47Å; A291-G294 CarbonylContact O-C 3.56Å; A291-G294 WeakPolarHBondContact O-CA 3.34Å; A291-G294 PolarHBondContact O-N 2.97Å; R292-G294 PolarHBondContact O-N 3.31Å
295	G	93.1	Very high	94.3	Very high	24 Å²	24	18 Å²	18	25%	0.247	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.2	28.8	-173.3	0	0	0	0	0	113.4	L41 A291 R292 R293	L41-G295 VanDerWaalsContact CD1-O 3.23Å; L41-G295 WeakPolarHBondContact CD1-O 3.44Å; A291-G295 PolarHBondContact O-N 2.87Å; R292-G295 PolarHBondContact O-N 3.17Å; R293-G295 PolarHBondContact O-N 3.03Å
296	L	93.4	Very high	93.9	Very high	15 Å²	15	18 Å²	18	8%	0.079	9%	0.089	C	C	.	.			trans	-116.2	125.8	176.3	179	60.4	0	0	0	110.9	L217 A266 L269 A291 R292	L217-L296 HydrophobicContact CB-CD1 4Å; A266-L296 HydrophobicContact CB-CD2 3.61Å; L269-L296 HydrophobicContact CD2-CB 3.74Å; L269-L296 HydrophobicContact CD2-CD2 4.14Å; A291-L296 CarbonylContact C-O 3.54Å; A291-L296 HydrophobicContact CB-CB 4.21Å; A291-L296 HydrophobicContact CB-CD2 4.42Å; A291-L296 HydrophobicContact CB-CG 4.36Å; A291-L296 WeakPolarHBondContact O-CB 3.35Å; A291-L296 PolarHBondContact O-N 3.47Å; R292-L296 WeakPolarHBondContact CA-O 3.41Å; R292-L296 PolarHBondContact N-O 3.46Å
297	A	93.5	Very high	93.5	Very high	19 Å²	19	21 Å²	21	16%	0.157	12%	0.115	C	C	.	.	P	Polyproline II helix	trans	-97.5	146.6	170.6	0	0	0	0	0	110.7	L41	L41-A297 HydrophobicContact CD1-CB 3.85Å; L41-A297 HydrophobicContact CD2-CB 4.13Å; L41-A297 HydrophobicContact CG-CB 4.38Å
298	P	95	Very high	92.9	Very high	6 Å²	6	21.8 Å²	21.8	4%	0.039	12%	0.12	C	C	.	.	P	Polyproline II helix	trans	-70.2	142.5	168.1	31.2	-34.8	0	0	0	111.3	S34 Y219 V223 P253	S34-P298 PolarHBondContact OG-O 2.93Å; Y219-P298 HydrophobicContact CD1-CB 3.55Å; Y219-P298 HydrophobicContact CD1-CG 4.33Å; Y219-P298 HydrophobicContact CE1-CB 3.64Å; Y219-P298 HydrophobicContact CE1-CG 4.19Å; Y219-P298 HydrophobicContact CG-CB 4.04Å; Y219-P298 CarbonylContact O-C 3.59Å; Y219-P298 VanDerWaalsContact O-CA 3.29Å; Y219-P298 WeakPolarHBondContact O-CA 3.49Å; V223-P298 HydrophobicContact CG1-CG 4.06Å; V223-P298 HydrophobicContact CG2-CB 3.68Å; V223-P298 HydrophobicContact CG2-CG 3.86Å; P253-P298 HydrophobicContact CB-CG 3.99Å; P253-P298 WeakPolarHBondContact O-CG 3.37Å
299	T	93	Very high	92.4	Very high	20 Å²	20	27.4 Å²	27.4	12%	0.123	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	122.5	169.5	-56.1	0	0	0	0	109	Y219 L220 G221	Y219-T299 PolarHBondContact O-N 2.97Å; L220-T299 HydrophobicContact CD1-CG2 3.99Å; G221-T299 PolarHBondContact N-O 3.49Å
300	H	92	Very high	91.9	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.005	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	138.5	174.7	-169.8	91.9	0	0	0	110.9	E30 E31 S34 G221 R222 V223 W225	E30-H300 HydrophobicContact CB-CB 4.26Å; E30-H300 IonicContact OE2-CD2 2.91Å; E30-H300 IonicContact OE2-CE1 2.75Å; E30-H300 PolarHBondContact OE2-CE1 3.48Å; E30-H300 IonicContact OE2-CG 2.75Å; E30-H300 IonicContact OE2-ND1 3.97Å; E30-H300 PolarHBondContact OE2-ND1 3.03Å; E30-H300 IonicContact OE2-NE2 3.7Å; E30-H300 PolarHBondContact OE2-NE2 2.85Å; E31-H300 VanDerWaalsContact CD-O 3.24Å; E31-H300 WeakPolarHBondContact CG-O 3.02Å; S34-H300 PolarHBondContact OG-N 2.87Å; S34-H300 VanDerWaalsContact OG-N 3.12Å; G221-H300 CarbonylContact O-C 3.05Å; G221-H300 WeakPolarHBondContact O-CA 3.29Å; R222-H300 PolarHBondContact NH1-CE1 2.82Å; R222-H300 PolarHBondContact NH1-NE2 2.89Å; V223-H300 HydrophobicContact CB-CB 4.25Å; V223-H300 HydrophobicContact CG2-CB 4.06Å; V223-H300 PolarHBondContact N-ND1 3.25Å; W225-H300 HydrophobicContact CZ2-CB 4.5Å
301	C	91	Very high	91.3	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.159	C	C	.	.			trans	-139.9	110.3	170.3	-172.5	0	0	0	0	109.7	L220 G221 K303 L304	L220-C301 HydrophobicContact CD1-CB 3.72Å; L220-C301 HydrophobicContact CG-CB 3.97Å; G221-C301 PolarHBondContact O-N 3.43Å; C301-K303 PolarHBondContact O-N 3.5Å; C301-L304 HydrophobicContact CB-CD1 4.13Å; C301-L304 HydrophobicContact CB-CG 4.43Å; C301-L304 PolarHBondContact O-N 2.81Å; C301-L304 VanDerWaalsContact O-N 3.16Å
302	V	87.6	Confident	90.7	Very high	7 Å²	7	32.8 Å²	32.8	4%	0.042	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-20	-179.4	67.3	0	0	0	0	113	L304 F320 A367	V302-L304 VanDerWaalsContact C-N 3.3Å; V302-F320 HydrophobicContact CG1-CE2 4.44Å; V302-F320 HydrophobicContact CG1-CZ 3.95Å; V302-F320 HydrophobicContact CG2-CZ 4.43Å; V302-A367 HydrophobicContact CG2-CB 3.36Å
303	K	90.8	Very high	90.3	Very high	55 Å²	55	28.9 Å²	28.9	24%	0.239	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-18.9	178.5	-54.3	180	-176.3	174.5	0	112.9	E182 C301 F320 L321 L322	E182-K303 IonicContact OE2-NZ 2.9Å; E182-K303 PolarHBondContact OE2-NZ 2.81Å; C301-K303 PolarHBondContact O-N 3.5Å; K303-F320 VanDerWaalsContact CB-O 3.31Å; K303-F320 WeakPolarHBondContact CB-O 3.37Å; K303-F320 HydrophobicContact CG-CD2 4.37Å; K303-F320 HydrophobicContact CG-CE2 4.05Å; K303-F320 HydrophobicContact CG-CZ 4.35Å; K303-F320 WeakPolarHBondContact CG-O 3.18Å; K303-L321 WeakPolarHBondContact O-CA 3.32Å; K303-L322 HydrophobicContact CB-CB 4.4Å; K303-L322 HydrophobicContact CB-CD1 3.92Å; K303-L322 HydrophobicContact CB-CG 3.69Å; K303-L322 HydrophobicContact CD-CD1 4.25Å; K303-L322 HydrophobicContact CD-CG 4.25Å; K303-L322 PolarHBondContact O-N 3.19Å
304	L	93.5	Very high	89.8	Confident	0 Å²	0	30 Å²	30	0%	0	17%	0.169	C	C	.	.	B	Isolated β-bridge	trans	-84	115.4	167.9	-67.8	167.7	0	0	0	107.2	L220 G221 R222 C301 V302 G306 L322 T323	L220-L304 HydrophobicContact CG-CD1 4.24Å; G221-L304 VanDerWaalsContact CA-CD1 3.43Å; R222-L304 HydrophobicContact CB-CB 4.43Å; R222-L304 WeakPolarHBondContact CB-O 3.41Å; R222-L304 WeakPolarHBondContact CD-O 3.35Å; C301-L304 HydrophobicContact CB-CD1 4.13Å; C301-L304 HydrophobicContact CB-CG 4.43Å; C301-L304 PolarHBondContact O-N 2.81Å; C301-L304 VanDerWaalsContact O-N 3.16Å; V302-L304 VanDerWaalsContact C-N 3.3Å; L304-G306 PolarHBondContact O-N 3.11Å; L304-G306 VanDerWaalsContact O-N 3.14Å; L304-L322 HydrophobicContact CD2-CB 3.95Å; L304-T323 HydrophobicContact CD2-CG2 3.56Å; L304-T323 WeakPolarHBondContact CD2-OG1 3.39Å
305	A	91.3	Very high	89.4	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.17	C	C	.	.			trans	-63.3	-24.7	-168.6	0	0	0	0	0	114.6	A307 T308 Y310 T323	A305-A307 PolarHBondContact O-N 3.05Å; A305-T308 WeakPolarHBondContact O-CB 3.47Å; A305-T308 PolarHBondContact O-N 2.84Å; A305-T308 VanDerWaalsContact O-N 3.13Å; A305-T308 PolarHBondContact O-OG1 3.34Å; A305-Y310 HydrophobicContact CB-CD2 3.95Å; A305-Y310 HydrophobicContact CB-CE2 3.54Å; A305-T323 WeakPolarHBondContact CB-O 3.44Å; A305-T323 PolarHBondContact N-O 2.96Å; A305-T323 PolarHBondContact N-OG1 2.64Å
306	G	91.1	Very high	89	Confident	2 Å²	2	29.1 Å²	29.1	2%	0.021	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.3	-131.3	-167.7	0	0	0	0	0	110.6	T258 L304 H325	T258-G306 WeakPolarHBondContact CG2-O 3.29Å; T258-G306 VanDerWaalsContact OG1-C 3.31Å; T258-G306 VanDerWaalsContact OG1-CA 3.27Å; T258-G306 WeakPolarHBondContact OG1-CA 3.19Å; T258-G306 PolarHBondContact OG1-O 2.97Å; L304-G306 PolarHBondContact O-N 3.11Å; L304-G306 VanDerWaalsContact O-N 3.14Å; G306-H325 WeakPolarHBondContact O-CB 3.13Å
307	A	87.9	Confident	88.7	Confident	70 Å²	70	28.8 Å²	28.8	58%	0.579	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-3.5	176.2	0	0	0	0	0	113.9	A305 H309	A305-A307 PolarHBondContact O-N 3.05Å; A307-H309 PolarHBondContact O-N 3.24Å
308	T	87	Confident	88.4	Confident	19 Å²	19	28.2 Å²	28.2	12%	0.117	15%	0.152	C	C	.	.			trans	-68	127.6	-178.4	-57.6	0	0	0	0	110.4	A305 Y310 I366 S370	A305-T308 WeakPolarHBondContact O-CB 3.47Å; A305-T308 PolarHBondContact O-N 2.84Å; A305-T308 VanDerWaalsContact O-N 3.13Å; A305-T308 PolarHBondContact O-OG1 3.34Å; T308-Y310 HydrophobicContact CG2-CD2 4.08Å; T308-Y310 HydrophobicContact CG2-CE1 4.3Å; T308-Y310 HydrophobicContact CG2-CE2 3.46Å; T308-Y310 VanDerWaalsContact CG2-CE2 3.46Å; T308-Y310 WeakPolarHBondContact O-CD2 3.36Å; T308-I366 HydrophobicContact CG2-CG2 3.88Å; T308-S370 WeakPolarHBondContact CG2-OG 3.4Å; T308-S370 WeakPolarHBondContact OG1-CB 3.49Å; T308-S370 PolarHBondContact OG1-OG 3.44Å
309	H	86.2	Confident	87.8	Confident	118 Å²	118	32.6 Å²	32.6	55%	0.546	17%	0.17	S	C	.	.			trans	-86.8	127.2	174.9	-179.3	-90.1	0	0	0	110.4	A307	A307-H309 PolarHBondContact O-N 3.24Å
310	Y	85.5	Confident	87.5	Confident	3 Å²	3	32 Å²	32	1%	0.012	17%	0.166	C	C	.	.			trans	-112.3	134.1	174.4	-64.7	-95.9	0	0	0	108.9	A305 T308 Y317 L321 C363 I366 A367	A305-Y310 HydrophobicContact CB-CD2 3.95Å; A305-Y310 HydrophobicContact CB-CE2 3.54Å; T308-Y310 HydrophobicContact CG2-CD2 4.08Å; T308-Y310 HydrophobicContact CG2-CE1 4.3Å; T308-Y310 HydrophobicContact CG2-CE2 3.46Å; T308-Y310 VanDerWaalsContact CG2-CE2 3.46Å; T308-Y310 WeakPolarHBondContact O-CD2 3.36Å; Y310-Y317 PolarHBondContact O-OH 2.89Å; Y310-L321 HydrophobicContact CD1-CD1 4.01Å; Y310-L321 HydrophobicContact CD1-CD2 4.35Å; Y310-L321 HydrophobicContact CD2-CD1 3.78Å; Y310-L321 HydrophobicContact CD2-CD2 4.19Å; Y310-L321 HydrophobicContact CE1-CD2 4.08Å; Y310-L321 HydrophobicContact CE2-CD1 4.35Å; Y310-L321 HydrophobicContact CE2-CD2 3.92Å; Y310-L321 HydrophobicContact CG-CD1 3.58Å; Y310-L321 HydrophobicContact CG-CD2 4.41Å; Y310-C363 HydrophobicContact CD1-CB 4.39Å; Y310-C363 HydrophobicContact CE1-CB 4.37Å; Y310-I366 HydrophobicContact CD1-CB 4.11Å; Y310-I366 HydrophobicContact CD1-CD1 4.4Å; Y310-I366 HydrophobicContact CD1-CG2 3.71Å; Y310-I366 HydrophobicContact CE1-CB 3.81Å; Y310-I366 HydrophobicContact CE1-CG2 3.52Å; Y310-I366 HydrophobicContact CG-CG2 4.48Å; Y310-A367 HydrophobicContact CE1-CB 4.4Å; Y310-A367 WeakPolarHBondContact OH-CA 3.35Å; Y310-A367 WeakPolarHBondContact OH-CB 3.29Å
311	P	85.1	Confident	87.4	Confident	47 Å²	47	32 Å²	32	31%	0.305	17%	0.166	S	C	.	.			trans	-61.7	146.1	170.8	28	-33.3	0	0	0	109.7	D313 Y317	P311-D313 PolarHBondContact O-N 3.44Å; P311-Y317 WeakPolarHBondContact O-CE2 3.44Å
312	L	84.7	Confident	87.6	Confident	70 Å²	70	32.1 Å²	32.1	37%	0.366	17%	0.167	S	C	.	.			trans	-56.8	111.1	173.7	-73.1	174.8	0	0	0	109.5	Y317 E334 A335 L338	L312-Y317 HydrophobicContact CD2-CD1 4.33Å; L312-Y317 HydrophobicContact CD2-CE1 3.79Å; L312-Y317 HydrophobicContact CD2-CE2 4.21Å; L312-E334 HydrophobicContact CD1-CB 4.4Å; L312-A335 HydrophobicContact CD2-CB 3.81Å; L312-L338 HydrophobicContact CB-CD2 4.48Å
313	D	85	Confident	88	Confident	40 Å²	40	31.9 Å²	31.9	21%	0.214	17%	0.165	C	C	.	.			trans	-139.3	128.2	179.2	175.7	-79.8	0	0	0	108.9	P311 C315 C316 Y317	P311-D313 PolarHBondContact O-N 3.44Å; D313-C315 VanDerWaalsContact C-N 3.32Å; D313-C315 PolarHBondContact O-N 3.04Å; D313-C315 PolarHBondContact OD1-N 2.84Å; D313-C316 HydrophobicContact CB-CB 3.72Å; D313-C316 PolarHBondContact O-N 3.01Å; D313-C316 WeakPolarHBondContact OD1-CB 3.37Å; D313-C316 PolarHBondContact OD1-N 2.85Å; D313-Y317 WeakPolarHBondContact O-CB 3.43Å; D313-Y317 PolarHBondContact O-N 3.45Å
314	R	84.7	Confident	88.1	Confident	111 Å²	111	29.3 Å²	29.3	42%	0.419	16%	0.155	S	C	.	.	H	α-helix	trans	-59.1	-42.1	-172.4	-176.4	171	-179.9	152.9	3.1	112.7	G318 L338 F350	R314-G318 WeakPolarHBondContact O-CA 3.32Å; R314-G318 PolarHBondContact O-N 3.28Å; R314-L338 HydrophobicContact CB-CD1 3.86Å; R314-L338 HydrophobicContact CB-CD2 4.24Å; R314-L338 HydrophobicContact CB-CG 3.83Å; R314-L338 HydrophobicContact CG-CD1 4.27Å; R314-L338 HydrophobicContact CG-CG 4.19Å; R314-F350 HydrophobicContact CG-CE1 4.37Å; R314-F350 HydrophobicContact CG-CE2 4.45Å; R314-F350 HydrophobicContact CG-CZ 3.99Å; R314-F350 PolarHBondContact NE-O 3.48Å; R314-F350 WeakPolarHBondContact O-CE1 3.36Å
315	C	85.3	Confident	88.1	Confident	9 Å²	9	30.9 Å²	30.9	6%	0.061	16%	0.162	C	C	.	.	H	α-helix	trans	-81.2	-37.8	-176	-59.8	0	0	0	0	111.2	D313 K319 C351	D313-C315 VanDerWaalsContact C-N 3.32Å; D313-C315 PolarHBondContact O-N 3.04Å; D313-C315 PolarHBondContact OD1-N 2.84Å; C315-K319 WeakPolarHBondContact O-CA 3.18Å; C315-K319 WeakPolarHBondContact O-CB 3.33Å; C315-K319 PolarHBondContact O-N 2.89Å; C315-C351 WeakPolarHBondContact CA-SG 3.16Å; C315-C351 HydrophobicContact CB-CB 4.24Å; C315-C351 WeakPolarHBondContact CB-SG 3.19Å; C315-C351 WeakPolarHBondContact SG-CB 3.38Å; C315-C351 CovalentContact SG-SG 2.04Å; C315-C351 PolarHBondContact SG-SG 3.03Å
316	C	85.2	Confident	88.1	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.189	C	C	.	.	I	π-helix	trans	-60.7	-57.7	174.8	-171.4	0	0	0	0	111.7	D313 F320 L321 C363	D313-C316 HydrophobicContact CB-CB 3.72Å; D313-C316 PolarHBondContact O-N 3.01Å; D313-C316 WeakPolarHBondContact OD1-CB 3.37Å; D313-C316 PolarHBondContact OD1-N 2.85Å; C316-F320 PolarHBondContact O-N 3.46Å; C316-L321 PolarHBondContact O-N 3.27Å; C316-L321 WeakPolarHBondContact SG-CD1 3.46Å; C316-C363 HydrophobicContact CB-CB 4.08Å; C316-C363 WeakPolarHBondContact CB-SG 3.41Å; C316-C363 WeakPolarHBondContact SG-CB 3.21Å; C316-C363 CovalentContact SG-SG 2Å; C316-C363 PolarHBondContact SG-SG 3.01Å
317	Y	87.8	Confident	88.2	Confident	7 Å²	7	37.3 Å²	37.3	3%	0.027	19%	0.189	C	C	.	.	I	π-helix	trans	-67.1	-38.4	-179.8	-85.2	-116.5	0	0	0	111.6	Y173 N175 Y310 P311 L312 D313 L321 S324 A335	Y173-Y317 AromaticContact CD1-CD1 3.88Å; Y173-Y317 HydrophobicContact CD1-CD1 3.88Å; Y173-Y317 HydrophobicContact CD1-CE1 4.34Å; Y173-Y317 HydrophobicContact CE1-CD1 4.21Å; Y173-Y317 HydrophobicContact CG-CD1 4.39Å; N175-Y317 PolarHBondContact ND2-O 2.75Å; Y310-Y317 PolarHBondContact O-OH 2.89Å; P311-Y317 WeakPolarHBondContact O-CE2 3.44Å; L312-Y317 HydrophobicContact CD2-CD1 4.33Å; L312-Y317 HydrophobicContact CD2-CE1 3.79Å; L312-Y317 HydrophobicContact CD2-CE2 4.21Å; D313-Y317 WeakPolarHBondContact O-CB 3.43Å; D313-Y317 PolarHBondContact O-N 3.45Å; Y317-L321 HydrophobicContact CD2-CD1 4.13Å; Y317-L321 HydrophobicContact CE2-CD1 4.13Å; Y317-S324 VanDerWaalsContact CE1-CB 3.45Å; Y317-S324 WeakPolarHBondContact CE1-OG 3.32Å; Y317-S324 VanDerWaalsContact CZ-OG 3.3Å; Y317-S324 WeakPolarHBondContact OH-CB 3.35Å; Y317-A335 HydrophobicContact CD1-CB 4.21Å; Y317-A335 HydrophobicContact CE1-CB 4.28Å
318	G	86.2	Confident	88.6	Confident	8 Å²	8	37.2 Å²	37.2	8%	0.082	18%	0.179	C	C	.	.	I	π-helix	trans	-86.7	-19.2	-173.1	0	0	0	0	0	116.1	N175 R314	N175-G318 PolarHBondContact ND2-O 3.04Å; R314-G318 WeakPolarHBondContact O-CA 3.32Å; R314-G318 PolarHBondContact O-N 3.28Å
319	K	83.3	Confident	89	Confident	97 Å²	97	38 Å²	38	42%	0.422	19%	0.185	S	C	.	.	I	π-helix	trans	-127.2	-24	-178.7	-65.8	-164	173.3	-169.8	0	115.8	C315 F350	C315-K319 WeakPolarHBondContact O-CA 3.18Å; C315-K319 WeakPolarHBondContact O-CB 3.33Å; C315-K319 PolarHBondContact O-N 2.89Å; K319-F350 HydrophobicContact CD-CD1 4.39Å; K319-F350 HydrophobicContact CG-CD1 3.89Å; K319-F350 HydrophobicContact CG-CE1 4.07Å
320	F	85.9	Confident	89.5	Confident	7 Å²	7	39.8 Å²	39.8	3%	0.031	19%	0.187	C	C	.	.	I	π-helix	trans	-110.8	-56.2	-173.9	179.4	-105.5	0	0	0	112.5	V302 K303 C316 T360 C363 R364	V302-F320 HydrophobicContact CG1-CE2 4.44Å; V302-F320 HydrophobicContact CG1-CZ 3.95Å; V302-F320 HydrophobicContact CG2-CZ 4.43Å; K303-F320 VanDerWaalsContact CB-O 3.31Å; K303-F320 WeakPolarHBondContact CB-O 3.37Å; K303-F320 HydrophobicContact CG-CD2 4.37Å; K303-F320 HydrophobicContact CG-CE2 4.05Å; K303-F320 HydrophobicContact CG-CZ 4.35Å; K303-F320 WeakPolarHBondContact CG-O 3.18Å; C316-F320 PolarHBondContact O-N 3.46Å; F320-T360 HydrophobicContact CB-CG2 4.33Å; F320-T360 HydrophobicContact CD2-CG2 3.91Å; F320-T360 HydrophobicContact CG-CG2 4.29Å; F320-C363 HydrophobicContact CD1-CB 3.73Å; F320-C363 HydrophobicContact CE1-CB 4.19Å; F320-R364 HydrophobicContact CD2-CG 4.23Å; F320-R364 HydrophobicContact CE1-CG 4.26Å; F320-R364 HydrophobicContact CE2-CG 3.52Å; F320-R364 HydrophobicContact CZ-CG 3.54Å
321	L	91	Very high	89.9	Confident	2 Å²	2	42.2 Å²	42.2	1%	0.01	20%	0.198	C	C	.	.			trans	-74	134	-177.4	-63.6	177.1	0	0	0	110.8	N175 K303 Y310 C316 Y317 S324	N175-L321 WeakPolarHBondContact CB-O 3.5Å; K303-L321 WeakPolarHBondContact O-CA 3.32Å; Y310-L321 HydrophobicContact CD1-CD1 4.01Å; Y310-L321 HydrophobicContact CD1-CD2 4.35Å; Y310-L321 HydrophobicContact CD2-CD1 3.78Å; Y310-L321 HydrophobicContact CD2-CD2 4.19Å; Y310-L321 HydrophobicContact CE1-CD2 4.08Å; Y310-L321 HydrophobicContact CE2-CD1 4.35Å; Y310-L321 HydrophobicContact CE2-CD2 3.92Å; Y310-L321 HydrophobicContact CG-CD1 3.58Å; Y310-L321 HydrophobicContact CG-CD2 4.41Å; C316-L321 PolarHBondContact O-N 3.27Å; C316-L321 WeakPolarHBondContact SG-CD1 3.46Å; Y317-L321 HydrophobicContact CD2-CD1 4.13Å; Y317-L321 HydrophobicContact CE2-CD1 4.13Å; L321-S324 WeakPolarHBondContact CD1-OG 3.48Å
322	L	94.4	Very high	90.4	Very high	3 Å²	3	40 Å²	40	2%	0.016	18%	0.184	C	C	.	.	S	Bend	trans	-90.8	-35.4	170.8	-62.3	-178.4	0	0	0	111	V174 N175 E178 L179 E182 K303 L304	V174-L322 WeakPolarHBondContact CA-O 3.23Å; N175-L322 PolarHBondContact N-O 3.06Å; E178-L322 VanDerWaalsContact C-CD2 3.44Å; E178-L322 HydrophobicContact CB-CD2 3.72Å; L179-L322 HydrophobicContact CB-CD2 4.22Å; L179-L322 HydrophobicContact CD1-CB 4.48Å; L179-L322 HydrophobicContact CD1-CD1 3.91Å; E182-L322 HydrophobicContact CB-CD1 4.02Å; E182-L322 HydrophobicContact CG-CD1 3.89Å; K303-L322 HydrophobicContact CB-CB 4.4Å; K303-L322 HydrophobicContact CB-CD1 3.92Å; K303-L322 HydrophobicContact CB-CG 3.69Å; K303-L322 HydrophobicContact CD-CD1 4.25Å; K303-L322 HydrophobicContact CD-CG 4.25Å; K303-L322 PolarHBondContact O-N 3.19Å; L304-L322 HydrophobicContact CD2-CB 3.95Å
323	T	95.5	Very high	90.8	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.006	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	150.6	174.9	60.4	0	0	0	0	111.5	V172 Y173 V174 L304 A305	V172-T323 HydrophobicContact CG1-CG2 4.2Å; Y173-T323 CarbonylContact O-C 3.55Å; Y173-T323 WeakPolarHBondContact O-CA 3.41Å; V174-T323 HydrophobicContact CG2-CG2 4.32Å; L304-T323 HydrophobicContact CD2-CG2 3.56Å; L304-T323 WeakPolarHBondContact CD2-OG1 3.39Å; A305-T323 WeakPolarHBondContact CB-O 3.44Å; A305-T323 PolarHBondContact N-O 2.96Å; A305-T323 PolarHBondContact N-OG1 2.64Å
324	S	94	Very high	91.2	Very high	2 Å²	2	41.9 Å²	41.9	1%	0.014	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	126.1	173.1	-56.7	0	0	0	0	109.9	V172 Y173 Y317 L321 V327	V172-S324 CarbonylContact C-O 3.54Å; V172-S324 VanDerWaalsContact CA-O 3.28Å; V172-S324 WeakPolarHBondContact CA-O 3.31Å; Y173-S324 PolarHBondContact N-O 3.33Å; Y173-S324 PolarHBondContact O-N 3.39Å; Y317-S324 VanDerWaalsContact CE1-CB 3.45Å; Y317-S324 WeakPolarHBondContact CE1-OG 3.32Å; Y317-S324 VanDerWaalsContact CZ-OG 3.3Å; Y317-S324 WeakPolarHBondContact OH-CB 3.35Å; L321-S324 WeakPolarHBondContact CD1-OG 3.48Å; S324-V327 WeakPolarHBondContact O-CG2 3.34Å
325	H	93.2	Very high	91.5	Very high	32 Å²	32	36.6 Å²	36.6	15%	0.148	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	163.2	-173.9	172.5	-119.5	0	0	0	112.8	D171 V172 T258 G306	D171-H325 CarbonylContact O-C 3.49Å; D171-H325 IonicContact OD1-CD2 3.17Å; D171-H325 PolarHBondContact OD1-CD2 2.68Å; D171-H325 IonicContact OD1-NE2 3.53Å; D171-H325 IonicContact OD2-CD2 3.15Å; D171-H325 IonicContact OD2-NE2 2.75Å; D171-H325 PolarHBondContact OD2-NE2 3.19Å; V172-H325 HydrophobicContact CG2-CB 4.23Å; T258-H325 HydrophobicContact CG2-CB 4.05Å; G306-H325 WeakPolarHBondContact O-CB 3.13Å
326	K	91.8	Very high	91.9	Very high	134 Å²	134	39.5 Å²	39.5	58%	0.583	18%	0.179	S	C	*	.	S	Bend	trans	60.8	38.1	-173.2	-57.8	-174.4	177.4	178	0	113.7	D171 Q331	D171-K326 PolarHBondContact O-N 3.25Å; K326-Q331 PolarHBondContact O-OE1 2.8Å
327	V	92.7	Very high	92.1	Very high	3 Å²	3	45.2 Å²	45.2	2%	0.018	20%	0.204	C	C	.	.			trans	-96.6	104.5	176.3	-178.4	0	0	0	0	108.1	D171 S324 Q331 M332	D171-V327 CarbonylContact C-O 3.44Å; D171-V327 WeakPolarHBondContact CA-O 3.24Å; D171-V327 PolarHBondContact O-N 3.05Å; S324-V327 WeakPolarHBondContact O-CG2 3.34Å; V327-Q331 HydrophobicContact CG1-CB 3.81Å; V327-M332 HydrophobicContact CB-CE 4.16Å; V327-M332 HydrophobicContact CG1-CB 4Å; V327-M332 HydrophobicContact CG1-CE 3.95Å; V327-M332 VanDerWaalsContact CG1-N 3.31Å; V327-M332 HydrophobicContact CG1-SD 4.04Å
328	D	95.4	Very high	92.1	Very high	69 Å²	69	47.5 Å²	47.5	37%	0.369	22%	0.216	S	C	.	.			trans	-69.1	168.5	176.9	73.3	55.2	0	0	0	112.2	W330 Q331 M332	D328-W330 PolarHBondContact O-N 3.31Å; D328-W330 VanDerWaalsContact O-N 3.14Å; D328-W330 WeakPolarHBondContact OD1-CA 3.41Å; D328-W330 WeakPolarHBondContact OD1-CB 3.47Å; D328-W330 PolarHBondContact OD1-N 3.14Å; D328-Q331 PolarHBondContact O-N 3.23Å; D328-Q331 PolarHBondContact OD1-N 2.79Å; D328-Q331 VanDerWaalsContact OD2-CD 3.31Å; D328-Q331 WeakPolarHBondContact OD2-CG 3.49Å; D328-Q331 PolarHBondContact OD2-OE1 2.84Å; D328-M332 WeakPolarHBondContact O-CB 3.42Å; D328-M332 PolarHBondContact O-N 3.47Å
329	P	97.2	Very high	92.1	Very high	36 Å²	36	48 Å²	48	23%	0.234	22%	0.218	C	C	.	.	H	α-helix	trans	-54.4	-33.6	-177.3	-30.4	37.5	0	0	0	115.5	N85 Q86 A89 M332	N85-P329 HydrophobicContact CB-CG 4.28Å; Q86-P329 HydrophobicContact CG-CG 3.93Å; A89-P329 HydrophobicContact CB-CB 3.75Å; P329-M332 WeakPolarHBondContact O-CB 3.34Å
330	W	96.2	Very high	92	Very high	154 Å²	154	46 Å²	46	58%	0.583	22%	0.216	S	C	*	.	H	α-helix	trans	-78.5	-47.7	179.8	175.5	84.8	0	0	0	110.4	D328 M332 Q333 E334	D328-W330 PolarHBondContact O-N 3.31Å; D328-W330 VanDerWaalsContact O-N 3.14Å; D328-W330 WeakPolarHBondContact OD1-CA 3.41Å; D328-W330 WeakPolarHBondContact OD1-CB 3.47Å; D328-W330 PolarHBondContact OD1-N 3.14Å; W330-M332 PolarHBondContact O-N 2.94Å; W330-Q333 WeakPolarHBondContact O-CB 3.24Å; W330-Q333 PolarHBondContact O-N 3.38Å; W330-E334 HydrophobicContact CD2-CG 4.32Å; W330-E334 HydrophobicContact CE3-CG 4.44Å; W330-E334 HydrophobicContact CH2-CG 4.19Å; W330-E334 WeakPolarHBondContact CH2-OE1 3.38Å; W330-E334 WeakPolarHBondContact CH2-OE2 3.34Å; W330-E334 HydrophobicContact CZ2-CG 4.05Å; W330-E334 WeakPolarHBondContact CZ2-OE1 3.41Å; W330-E334 VanDerWaalsContact CZ3-CD 3.44Å; W330-E334 HydrophobicContact CZ3-CG 4.38Å; W330-E334 WeakPolarHBondContact CZ3-OE2 3.39Å; W330-E334 PolarHBondContact O-N 3.47Å; W330-E334 VanDerWaalsContact O-N 3.08Å
331	Q	94.2	Very high	91	Very high	54 Å²	54	46.9 Å²	46.9	25%	0.252	23%	0.228	S	C	.	.	H	α-helix	trans	-59.3	-32.3	173.6	-68.7	-178.2	-25.5	0	0	112.2	K326 V327 D328 Q333 E334 A335	K326-Q331 PolarHBondContact O-OE1 2.8Å; V327-Q331 HydrophobicContact CG1-CB 3.81Å; D328-Q331 PolarHBondContact O-N 3.23Å; D328-Q331 PolarHBondContact OD1-N 2.79Å; D328-Q331 VanDerWaalsContact OD2-CD 3.31Å; D328-Q331 WeakPolarHBondContact OD2-CG 3.49Å; D328-Q331 PolarHBondContact OD2-OE1 2.84Å; Q331-Q333 VanDerWaalsContact C-N 3.32Å; Q331-Q333 PolarHBondContact O-N 2.86Å; Q331-E334 PolarHBondContact O-N 2.7Å; Q331-A335 VanDerWaalsContact O-CB 3.3Å; Q331-A335 WeakPolarHBondContact O-CB 2.93Å; Q331-A335 PolarHBondContact O-N 3.25Å
332	M	95.2	Very high	88.7	Confident	2 Å²	2	54.4 Å²	54.4	1%	0.01	27%	0.265	C	S	.	.	H	α-helix	trans	-59.2	-44.5	175.3	-168.4	69.1	70.7	0	0	111.3	A89 I90 S93 W94 V172 Y173 V327 D328 P329 W330 W336	A89-M332 HydrophobicContact CB-CB 4.24Å; A89-M332 HydrophobicContact CB-CG 4.34Å; I90-M332 HydrophobicContact CG1-CE 4.21Å; S93-M332 WeakPolarHBondContact OG-CG 3.11Å; W94-M332 VanDerWaalsContact CD1-SD 3.54Å; W94-M332 PolarHBondContact NE1-SD 2.83Å; V172-M332 WeakPolarHBondContact O-CE 3.34Å; Y173-M332 HydrophobicContact CD2-SD 3.75Å; Y173-M332 HydrophobicContact CG-SD 4.32Å; V327-M332 HydrophobicContact CB-CE 4.16Å; V327-M332 HydrophobicContact CG1-CB 4Å; V327-M332 HydrophobicContact CG1-CE 3.95Å; V327-M332 VanDerWaalsContact CG1-N 3.31Å; V327-M332 HydrophobicContact CG1-SD 4.04Å; D328-M332 WeakPolarHBondContact O-CB 3.42Å; D328-M332 PolarHBondContact O-N 3.47Å; P329-M332 WeakPolarHBondContact O-CB 3.34Å; W330-M332 PolarHBondContact O-N 2.94Å; M332-W336 VanDerWaalsContact O-CB 3.28Å; M332-W336 WeakPolarHBondContact O-CB 3.28Å; M332-W336 PolarHBondContact O-N 2.63Å
333	Q	93.4	Very high	86.2	Confident	79 Å²	79	61.1 Å²	61.1	37%	0.369	30%	0.301	S	S	.	.	H	α-helix	trans	-69.8	-38.5	177.7	-66.4	-179.6	-0.8	0	0	111.7	W330 Q331 W336 K337	W330-Q333 WeakPolarHBondContact O-CB 3.24Å; W330-Q333 PolarHBondContact O-N 3.38Å; Q331-Q333 VanDerWaalsContact C-N 3.32Å; Q331-Q333 PolarHBondContact O-N 2.86Å; Q333-W336 PolarHBondContact O-N 3.46Å; Q333-K337 WeakPolarHBondContact O-CB 3.5Å; Q333-K337 VanDerWaalsContact O-CG 3.29Å; Q333-K337 WeakPolarHBondContact O-CG 3.3Å; Q333-K337 PolarHBondContact O-N 2.91Å
334	E	92.3	Very high	83.8	Confident	70 Å²	70	65.2 Å²	65.2	33%	0.327	34%	0.343	S	S	.	.	H	α-helix	trans	-64.3	-48.9	175.1	-69.2	-162.4	123.5	0	0	112.2	L312 W330 Q331 W336 K337 L338	L312-E334 HydrophobicContact CD1-CB 4.4Å; W330-E334 HydrophobicContact CD2-CG 4.32Å; W330-E334 HydrophobicContact CE3-CG 4.44Å; W330-E334 HydrophobicContact CH2-CG 4.19Å; W330-E334 WeakPolarHBondContact CH2-OE1 3.38Å; W330-E334 WeakPolarHBondContact CH2-OE2 3.34Å; W330-E334 HydrophobicContact CZ2-CG 4.05Å; W330-E334 WeakPolarHBondContact CZ2-OE1 3.41Å; W330-E334 VanDerWaalsContact CZ3-CD 3.44Å; W330-E334 HydrophobicContact CZ3-CG 4.38Å; W330-E334 WeakPolarHBondContact CZ3-OE2 3.39Å; W330-E334 PolarHBondContact O-N 3.47Å; W330-E334 VanDerWaalsContact O-N 3.08Å; Q331-E334 PolarHBondContact O-N 2.7Å; E334-W336 VanDerWaalsContact C-N 3.25Å; E334-W336 PolarHBondContact O-N 3.44Å; E334-K337 PolarHBondContact O-N 3.28Å; E334-L338 VanDerWaalsContact O-CB 3.25Å; E334-L338 WeakPolarHBondContact O-CB 3.37Å; E334-L338 PolarHBondContact O-N 3.43Å
335	A	91.9	Very high	81.4	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-56.7	-42.6	174.9	0	0	0	0	0	110.8	Y173 L312 Y317 Q331 L338 V339	Y173-A335 HydrophobicContact CD2-CB 3.66Å; Y173-A335 HydrophobicContact CE2-CB 3.83Å; Y173-A335 HydrophobicContact CG-CB 4.18Å; L312-A335 HydrophobicContact CD2-CB 3.81Å; Y317-A335 HydrophobicContact CD1-CB 4.21Å; Y317-A335 HydrophobicContact CE1-CB 4.28Å; Q331-A335 VanDerWaalsContact O-CB 3.3Å; Q331-A335 WeakPolarHBondContact O-CB 2.93Å; Q331-A335 PolarHBondContact O-N 3.25Å; A335-L338 PolarHBondContact O-N 2.75Å; A335-V339 WeakPolarHBondContact O-CB 3.43Å; A335-V339 WeakPolarHBondContact O-CG2 3.48Å; A335-V339 PolarHBondContact O-N 3.05Å
336	W	92.8	Very high	79.3	Confident	69 Å²	69	82.5 Å²	82.5	26%	0.261	41%	0.413	S	S	.	.	H	α-helix	trans	-63.5	-46.5	176.4	-179.7	-117.3	0	0	0	113.4	W94 I97 Y173 M332 Q333 E334 L338 V339 S340	W94-W336 HydrophobicContact CB-CE3 4.24Å; W94-W336 HydrophobicContact CB-CZ3 4.27Å; I97-W336 HydrophobicContact CD1-CH2 3.73Å; I97-W336 HydrophobicContact CD1-CZ3 3.86Å; I97-W336 HydrophobicContact CG1-CH2 4.01Å; Y173-W336 HydrophobicContact CE2-CB 4.33Å; Y173-W336 HydrophobicContact CE2-CE3 4.41Å; M332-W336 VanDerWaalsContact O-CB 3.28Å; M332-W336 WeakPolarHBondContact O-CB 3.28Å; M332-W336 PolarHBondContact O-N 2.63Å; Q333-W336 PolarHBondContact O-N 3.46Å; E334-W336 VanDerWaalsContact C-N 3.25Å; E334-W336 PolarHBondContact O-N 3.44Å; W336-L338 VanDerWaalsContact C-N 3.31Å; W336-L338 PolarHBondContact O-N 3.38Å; W336-V339 PolarHBondContact O-N 2.91Å; W336-S340 WeakPolarHBondContact CH2-OG 3.28Å; W336-S340 WeakPolarHBondContact CZ2-OG 3.26Å; W336-S340 WeakPolarHBondContact CZ3-OG 3.39Å; W336-S340 WeakPolarHBondContact O-CB 3.18Å; W336-S340 PolarHBondContact O-N 3.11Å; W336-S340 PolarHBondContact O-OG 2.73Å
337	K	90.9	Very high	77	Confident	120 Å²	120	82.7 Å²	82.7	52%	0.522	43%	0.426	S	S	.	.	H	α-helix	trans	-61.6	-41	175.4	-73.6	170.8	-176.3	173.7	0	111.5	Q333 E334 G341	Q333-K337 WeakPolarHBondContact O-CB 3.5Å; Q333-K337 VanDerWaalsContact O-CG 3.29Å; Q333-K337 WeakPolarHBondContact O-CG 3.3Å; Q333-K337 PolarHBondContact O-N 2.91Å; E334-K337 PolarHBondContact O-N 3.28Å; K337-G341 PolarHBondContact O-N 3.22Å
338	L	87	Confident	75.1	Confident	55 Å²	55	85.9 Å²	85.9	29%	0.288	45%	0.453	S	S	.	.	H	α-helix	trans	-63.1	-42.6	179.6	-171.7	67.4	0	0	0	111.9	L312 R314 E334 A335 W336	L312-L338 HydrophobicContact CB-CD2 4.48Å; R314-L338 HydrophobicContact CB-CD1 3.86Å; R314-L338 HydrophobicContact CB-CD2 4.24Å; R314-L338 HydrophobicContact CB-CG 3.83Å; R314-L338 HydrophobicContact CG-CD1 4.27Å; R314-L338 HydrophobicContact CG-CG 4.19Å; E334-L338 VanDerWaalsContact O-CB 3.25Å; E334-L338 WeakPolarHBondContact O-CB 3.37Å; E334-L338 PolarHBondContact O-N 3.43Å; A335-L338 PolarHBondContact O-N 2.75Å; W336-L338 VanDerWaalsContact C-N 3.31Å; W336-L338 PolarHBondContact O-N 3.38Å
339	V	86.3	Confident	73.2	Confident	18 Å²	18	87.6 Å²	87.6	11%	0.109	47%	0.467	C	S	.	.	H	α-helix	trans	-88.2	-31	-176.1	175.8	0	0	0	0	113.6	Y173 A335 W336 F350	Y173-V339 WeakPolarHBondContact OH-CB 3.43Å; A335-V339 WeakPolarHBondContact O-CB 3.43Å; A335-V339 WeakPolarHBondContact O-CG2 3.48Å; A335-V339 PolarHBondContact O-N 3.05Å; W336-V339 PolarHBondContact O-N 2.91Å; V339-F350 HydrophobicContact CG1-CZ 4.28Å; V339-F350 WeakPolarHBondContact O-CE2 3.28Å
340	S	81.4	Confident	71.8	Confident	55 Å²	55	88.8 Å²	88.8	39%	0.385	47%	0.469	S	S	.	.	H	α-helix	trans	-80.6	-22.9	-177.4	-55.1	0	0	0	0	112.9	W336	W336-S340 WeakPolarHBondContact CH2-OG 3.28Å; W336-S340 WeakPolarHBondContact CZ2-OG 3.26Å; W336-S340 WeakPolarHBondContact CZ3-OG 3.39Å; W336-S340 WeakPolarHBondContact O-CB 3.18Å; W336-S340 PolarHBondContact O-N 3.11Å; W336-S340 PolarHBondContact O-OG 2.73Å
341	G	63.8	Low	70.7	Confident	27 Å²	27	81.7 Å²	81.7	28%	0.278	44%	0.443	S	S	.	.			trans	73.1	139.1	-165.8	0	0	0	0	0	110.8	K337 N343	K337-G341 PolarHBondContact O-N 3.22Å; G341-N343 PolarHBondContact O-N 3.07Å
342	M	43.2	Very low	69.9	Low	160 Å²	160	81.3 Å²	81.3	79%	0.788	45%	0.446	S	S	*	.	S	Bend	trans	-71.3	113.9	164.7	-76.3	176.1	141.7	0	0	107.5
343	N	41.8	Very low	68.9	Low	144 Å²	144	91.6 Å²	91.6	77%	0.77	49%	0.485	S	S	*	.	S	Bend	trans	73.8	133.8	172.3	-57.3	-14.9	0	0	0	116.9	G341 E345	G341-N343 PolarHBondContact O-N 3.07Å; N343-E345 PolarHBondContact O-N 2.95Å
344	G	45.6	Very low	68.2	Low	86 Å²	86	92.5 Å²	92.5	89%	0.887	49%	0.492	S	S	*	.	S	Bend	trans	-69	36.3	-172.8	0	0	0	0	0	116.7
345	E	43	Very low	67.4	Low	162 Å²	162	94.8 Å²	94.8	76%	0.757	50%	0.503	S	S	*	.			trans	-109.5	84.7	172.1	-73.7	176.6	171.5	0	0	108.9	N343 T347	N343-E345 PolarHBondContact O-N 2.95Å; E345-T347 PolarHBondContact O-N 3.11Å
346	R	48.7	Very low	66.5	Low	236 Å²	236	95.2 Å²	95.2	89%	0.891	51%	0.507	S	S	*	.			trans	-73.3	70.5	173.4	-71.5	-178.3	-180	176.3	1.2	110.3
347	T	44.4	Very low	65.6	Low	137 Å²	137	97 Å²	97	84%	0.84	52%	0.517	S	S	*	.			trans	-83.9	-17.5	171.5	53.3	0	0	0	0	112.5	E345	E345-T347 PolarHBondContact O-N 3.11Å
348	A	52.3	Low	65	Low	71 Å²	71	96 Å²	96	59%	0.587	52%	0.516	S	S	*	.	S	Bend	trans	-122.8	147.1	176.7	0	0	0	0	0	112.6	F350	A348-F350 PolarHBondContact O-N 3.07Å
349	P	56.8	Low	64.4	Low	104 Å²	104	93.7 Å²	93.7	68%	0.675	51%	0.506	S	S	*	.			trans	-62.5	136.8	175.8	25.7	-33	0	0	0	111.2	C351	P349-C351 PolarHBondContact O-N 3.44Å
350	F	67.5	Low	63.7	Low	62 Å²	62	94.3 Å²	94.3	27%	0.272	51%	0.51	S	S	.	.	S	Bend	trans	-47.6	-37.3	-175.2	-178.5	-101.1	0	0	0	115	R314 K319 V339 A348	R314-F350 HydrophobicContact CG-CE1 4.37Å; R314-F350 HydrophobicContact CG-CE2 4.45Å; R314-F350 HydrophobicContact CG-CZ 3.99Å; R314-F350 PolarHBondContact NE-O 3.48Å; R314-F350 WeakPolarHBondContact O-CE1 3.36Å; K319-F350 HydrophobicContact CD-CD1 4.39Å; K319-F350 HydrophobicContact CG-CD1 3.89Å; K319-F350 HydrophobicContact CG-CE1 4.07Å; V339-F350 HydrophobicContact CG1-CZ 4.28Å; V339-F350 WeakPolarHBondContact O-CE2 3.28Å; A348-F350 PolarHBondContact O-N 3.07Å
351	C	71.9	Confident	63.5	Low	5 Å²	5	94.2 Å²	94.2	3%	0.034	51%	0.505	C	S	.	.	S	Bend	trans	-136.6	143.9	163.1	-66.1	0	0	0	0	106.8	C315 P349 Q355	C315-C351 WeakPolarHBondContact CA-SG 3.16Å; C315-C351 HydrophobicContact CB-CB 4.24Å; C315-C351 WeakPolarHBondContact CB-SG 3.19Å; C315-C351 WeakPolarHBondContact SG-CB 3.38Å; C315-C351 CovalentContact SG-SG 2.04Å; C315-C351 PolarHBondContact SG-SG 3.03Å; P349-C351 PolarHBondContact O-N 3.44Å; C351-Q355 HydrophobicContact CB-CB 4.35Å
352	S	77.8	Confident	64.3	Low	46 Å²	46	99.2 Å²	99.2	32%	0.322	52%	0.515	S	S	.	.			trans	-58.3	156.9	164.7	80.2	0	0	0	0	109.7	L354 Q355 G356	S352-L354 PolarHBondContact O-N 3.45Å; S352-Q355 PolarHBondContact O-N 3.5Å; S352-Q355 WeakPolarHBondContact OG-CB 3.47Å; S352-Q355 VanDerWaalsContact OG-CG 3.27Å; S352-Q355 WeakPolarHBondContact OG-CG 3.38Å; S352-Q355 PolarHBondContact OG-N 3.13Å; S352-Q355 VanDerWaalsContact OG-N 3.11Å; S352-Q355 PolarHBondContact OG-OE1 2.76Å; S352-G356 PolarHBondContact O-N 3.49Å
353	W	75.2	Confident	66.1	Low	218 Å²	218	91.7 Å²	91.7	83%	0.826	48%	0.478	S	S	*	.	H	α-helix	trans	-55.2	-43	179.4	175.7	82.4	0	0	0	111.7	G356 F357	W353-G356 PolarHBondContact O-N 2.67Å; W353-F357 WeakPolarHBondContact O-CB 3.49Å; W353-F357 PolarHBondContact O-N 2.95Å
354	L	77.2	Confident	67.8	Low	98 Å²	98	88.6 Å²	88.6	51%	0.513	46%	0.456	S	S	.	.	H	α-helix	trans	-67.4	-45.6	178.2	-174	65.4	0	0	0	112.5	S352 G356 F357 L358	S352-L354 PolarHBondContact O-N 3.45Å; L354-G356 VanDerWaalsContact C-N 3.33Å; L354-G356 PolarHBondContact O-N 3.42Å; L354-F357 PolarHBondContact O-N 3.41Å; L354-L358 HydrophobicContact CD1-CD1 4.13Å; L354-L358 HydrophobicContact CD1-CG 4.26Å; L354-L358 HydrophobicContact CG-CD1 4.02Å; L354-L358 HydrophobicContact CG-CG 4.48Å; L354-L358 WeakPolarHBondContact O-CB 3.28Å; L354-L358 WeakPolarHBondContact O-CG 3.32Å; L354-L358 PolarHBondContact O-N 3Å
355	Q	76.7	Confident	69.4	Low	118 Å²	118	88.3 Å²	88.3	55%	0.551	43%	0.431	S	S	*	.	H	α-helix	trans	-62.4	-42.2	176.3	-75.1	170.2	-19.6	0	0	111.4	C351 S352 G359	C351-Q355 HydrophobicContact CB-CB 4.35Å; S352-Q355 PolarHBondContact O-N 3.5Å; S352-Q355 WeakPolarHBondContact OG-CB 3.47Å; S352-Q355 VanDerWaalsContact OG-CG 3.27Å; S352-Q355 WeakPolarHBondContact OG-CG 3.38Å; S352-Q355 PolarHBondContact OG-N 3.13Å; S352-Q355 VanDerWaalsContact OG-N 3.11Å; S352-Q355 PolarHBondContact OG-OE1 2.76Å; Q355-G359 PolarHBondContact O-N 2.75Å
356	G	71.6	Confident	71.1	Confident	8 Å²	8	82.8 Å²	82.8	8%	0.082	41%	0.405	C	S	.	.	H	α-helix	trans	-62.6	-45.2	176.9	0	0	0	0	0	111.6	S352 W353 L354 T360	S352-G356 PolarHBondContact O-N 3.49Å; W353-G356 PolarHBondContact O-N 2.67Å; L354-G356 VanDerWaalsContact C-N 3.33Å; L354-G356 PolarHBondContact O-N 3.42Å; G356-T360 WeakPolarHBondContact O-CB 3.42Å; G356-T360 PolarHBondContact O-N 3.12Å; G356-T360 PolarHBondContact O-OG1 2.96Å
357	F	74.1	Confident	72.3	Confident	108 Å²	108	71.5 Å²	71.5	47%	0.474	36%	0.363	S	S	.	.	H	α-helix	trans	-62	-54.9	176.8	-179.3	-100.7	0	0	0	111.6	W353 L354 G359 T360 L361	W353-F357 WeakPolarHBondContact O-CB 3.49Å; W353-F357 PolarHBondContact O-N 2.95Å; L354-F357 PolarHBondContact O-N 3.41Å; F357-G359 PolarHBondContact O-N 3.13Å; F357-T360 PolarHBondContact O-N 2.92Å; F357-L361 HydrophobicContact CE1-CD1 3.74Å; F357-L361 HydrophobicContact CE2-CD1 4.17Å; F357-L361 HydrophobicContact CZ-CD1 3.52Å; F357-L361 WeakPolarHBondContact O-CB 3.34Å; F357-L361 PolarHBondContact O-N 2.96Å
358	L	79.1	Confident	73.6	Confident	97 Å²	97	70.1 Å²	70.1	51%	0.508	34%	0.342	S	S	.	.	H	α-helix	trans	-63.9	-42.9	-178.3	-68.8	175.9	0	0	0	112.6	L354 L361 R362	L354-L358 HydrophobicContact CD1-CD1 4.13Å; L354-L358 HydrophobicContact CD1-CG 4.26Å; L354-L358 HydrophobicContact CG-CD1 4.02Å; L354-L358 HydrophobicContact CG-CG 4.48Å; L354-L358 WeakPolarHBondContact O-CB 3.28Å; L354-L358 WeakPolarHBondContact O-CG 3.32Å; L354-L358 PolarHBondContact O-N 3Å; L358-L361 PolarHBondContact O-N 2.7Å; L358-R362 WeakPolarHBondContact O-CB 3.31Å; L358-R362 PolarHBondContact O-N 3.29Å
359	G	73.3	Confident	74.5	Confident	8 Å²	8	74.4 Å²	74.4	8%	0.082	35%	0.348	C	S	.	.	H	α-helix	trans	-64.6	-44.6	178	0	0	0	0	0	112.3	Q355 F357 L361 R362 C363	Q355-G359 PolarHBondContact O-N 2.75Å; F357-G359 PolarHBondContact O-N 3.13Å; G359-L361 PolarHBondContact O-N 3.46Å; G359-R362 PolarHBondContact O-N 3.1Å; G359-C363 PolarHBondContact O-N 3.35Å
360	T	72.2	Confident	75	Confident	30 Å²	30	71.8 Å²	71.8	18%	0.184	33%	0.332	C	S	.	.	H	α-helix	trans	-63.4	-42.8	175.5	-56.7	0	0	0	0	111.1	F320 G356 F357 C363 R364	F320-T360 HydrophobicContact CB-CG2 4.33Å; F320-T360 HydrophobicContact CD2-CG2 3.91Å; F320-T360 HydrophobicContact CG-CG2 4.29Å; G356-T360 WeakPolarHBondContact O-CB 3.42Å; G356-T360 PolarHBondContact O-N 3.12Å; G356-T360 PolarHBondContact O-OG1 2.96Å; F357-T360 PolarHBondContact O-N 2.92Å; T360-C363 PolarHBondContact O-N 2.98Å; T360-R364 HydrophobicContact CG2-CG 4.39Å; T360-R364 WeakPolarHBondContact O-CB 3.35Å; T360-R364 VanDerWaalsContact O-CG 3.31Å; T360-R364 WeakPolarHBondContact O-CG 3.16Å; T360-R364 PolarHBondContact O-N 3.46Å
361	L	78.3	Confident	74.5	Confident	53 Å²	53	73.4 Å²	73.4	28%	0.277	35%	0.351	S	S	.	.	H	α-helix	trans	-66.2	-41.8	-179.4	-166.8	139	0	0	0	111.2	F357 L358 G359 C363 R364 F365	F357-L361 HydrophobicContact CE1-CD1 3.74Å; F357-L361 HydrophobicContact CE2-CD1 4.17Å; F357-L361 HydrophobicContact CZ-CD1 3.52Å; F357-L361 WeakPolarHBondContact O-CB 3.34Å; F357-L361 PolarHBondContact O-N 2.96Å; L358-L361 PolarHBondContact O-N 2.7Å; G359-L361 PolarHBondContact O-N 3.46Å; L361-C363 PolarHBondContact O-N 2.74Å; L361-R364 PolarHBondContact O-N 3.31Å; L361-F365 HydrophobicContact CD2-CD2 3.7Å; L361-F365 HydrophobicContact CD2-CE2 3.4Å; L361-F365 HydrophobicContact CG-CD2 4.26Å; L361-F365 HydrophobicContact CG-CE2 4.06Å; L361-F365 WeakPolarHBondContact O-CD2 3.44Å; L361-F365 PolarHBondContact O-N 3.43Å
362	R	79.7	Confident	74.7	Confident	132 Å²	132	76.8 Å²	76.8	50%	0.498	37%	0.367	S	S	.	.	H	α-helix	trans	-57.8	-46.9	170.6	-178.4	-177.6	178.5	-172.2	1.9	111.7	L358 G359 F365 I366	L358-R362 WeakPolarHBondContact O-CB 3.31Å; L358-R362 PolarHBondContact O-N 3.29Å; G359-R362 PolarHBondContact O-N 3.1Å; R362-F365 WeakPolarHBondContact O-CB 3.49Å; R362-F365 PolarHBondContact O-N 2.96Å; R362-I366 HydrophobicContact CG-CD1 4.08Å; R362-I366 WeakPolarHBondContact O-CG1 3.43Å; R362-I366 PolarHBondContact O-N 3.19Å
363	C	80.4	Confident	74.5	Confident	2 Å²	2	78.4 Å²	78.4	1%	0.014	37%	0.369	C	S	.	.	H	α-helix	trans	-70.1	-37.8	-178.7	-74.9	0	0	0	0	113.3	Y310 C316 F320 G359 T360 L361 F365 I366 A367	Y310-C363 HydrophobicContact CD1-CB 4.39Å; Y310-C363 HydrophobicContact CE1-CB 4.37Å; C316-C363 HydrophobicContact CB-CB 4.08Å; C316-C363 WeakPolarHBondContact CB-SG 3.41Å; C316-C363 WeakPolarHBondContact SG-CB 3.21Å; C316-C363 CovalentContact SG-SG 2Å; C316-C363 PolarHBondContact SG-SG 3.01Å; F320-C363 HydrophobicContact CD1-CB 3.73Å; F320-C363 HydrophobicContact CE1-CB 4.19Å; G359-C363 PolarHBondContact O-N 3.35Å; T360-C363 PolarHBondContact O-N 2.98Å; L361-C363 PolarHBondContact O-N 2.74Å; C363-F365 VanDerWaalsContact C-N 3.3Å; C363-F365 PolarHBondContact O-N 3.32Å; C363-I366 PolarHBondContact O-N 3.1Å; C363-A367 WeakPolarHBondContact O-CB 3.29Å; C363-A367 PolarHBondContact O-N 3.35Å
364	R	77.7	Confident	74.5	Confident	79 Å²	79	70.7 Å²	70.7	30%	0.298	34%	0.344	S	S	.	.	H	α-helix	trans	-58.6	-42.5	169.4	-78.9	-176.2	-179.5	-165.1	-1.2	111.8	P25 F320 T360 L361 A367 W368	P25-R364 HydrophobicContact CB-CB 4.01Å; P25-R364 WeakPolarHBondContact CB-O 3.43Å; P25-R364 WeakPolarHBondContact O-CB 3.14Å; P25-R364 WeakPolarHBondContact O-CG 3.2Å; F320-R364 HydrophobicContact CD2-CG 4.23Å; F320-R364 HydrophobicContact CE1-CG 4.26Å; F320-R364 HydrophobicContact CE2-CG 3.52Å; F320-R364 HydrophobicContact CZ-CG 3.54Å; T360-R364 HydrophobicContact CG2-CG 4.39Å; T360-R364 WeakPolarHBondContact O-CB 3.35Å; T360-R364 VanDerWaalsContact O-CG 3.31Å; T360-R364 WeakPolarHBondContact O-CG 3.16Å; T360-R364 PolarHBondContact O-N 3.46Å; L361-R364 PolarHBondContact O-N 3.31Å; R364-A367 PolarHBondContact O-N 3.3Å; R364-W368 WeakPolarHBondContact O-CB 3.46Å; R364-W368 PolarHBondContact O-N 2.56Å
365	F	79.3	Confident	74.3	Confident	81 Å²	81	69.1 Å²	69.1	36%	0.355	33%	0.334	S	S	.	.	H	α-helix	trans	-63.5	-46	174.8	-87.1	-62	0	0	0	112.8	P25 L361 R362 C363 A367 W368 F369	P25-F365 HydrophobicContact CB-CD1 4.43Å; P25-F365 HydrophobicContact CG-CD1 4.29Å; P25-F365 HydrophobicContact CG-CE1 4.19Å; L361-F365 HydrophobicContact CD2-CD2 3.7Å; L361-F365 HydrophobicContact CD2-CE2 3.4Å; L361-F365 HydrophobicContact CG-CD2 4.26Å; L361-F365 HydrophobicContact CG-CE2 4.06Å; L361-F365 WeakPolarHBondContact O-CD2 3.44Å; L361-F365 PolarHBondContact O-N 3.43Å; R362-F365 WeakPolarHBondContact O-CB 3.49Å; R362-F365 PolarHBondContact O-N 2.96Å; C363-F365 VanDerWaalsContact C-N 3.3Å; C363-F365 PolarHBondContact O-N 3.32Å; F365-A367 VanDerWaalsContact C-N 3.3Å; F365-A367 PolarHBondContact O-N 2.98Å; F365-W368 PolarHBondContact O-N 3.05Å; F365-F369 HydrophobicContact CD1-CE2 4.42Å; F365-F369 VanDerWaalsContact O-CD2 3.27Å; F365-F369 WeakPolarHBondContact O-CD2 3.25Å; F365-F369 PolarHBondContact O-N 3.13Å
366	I	79.6	Confident	74.2	Confident	45 Å²	45	66 Å²	66	23%	0.231	32%	0.321	C	S	.	.	H	α-helix	trans	-60	-43.2	176.2	-67.1	166.6	0	0	0	110.7	T308 Y310 R362 C363 W368 F369 S370	T308-I366 HydrophobicContact CG2-CG2 3.88Å; Y310-I366 HydrophobicContact CD1-CB 4.11Å; Y310-I366 HydrophobicContact CD1-CD1 4.4Å; Y310-I366 HydrophobicContact CD1-CG2 3.71Å; Y310-I366 HydrophobicContact CE1-CB 3.81Å; Y310-I366 HydrophobicContact CE1-CG2 3.52Å; Y310-I366 HydrophobicContact CG-CG2 4.48Å; R362-I366 HydrophobicContact CG-CD1 4.08Å; R362-I366 WeakPolarHBondContact O-CG1 3.43Å; R362-I366 PolarHBondContact O-N 3.19Å; C363-I366 PolarHBondContact O-N 3.1Å; I366-W368 VanDerWaalsContact C-N 3.32Å; I366-W368 PolarHBondContact O-N 3.43Å; I366-F369 PolarHBondContact O-N 2.84Å; I366-S370 WeakPolarHBondContact O-CB 3.44Å; I366-S370 PolarHBondContact O-N 2.91Å; I366-S370 PolarHBondContact O-OG 3.44Å
367	A	74	Confident	74.3	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-61.2	-42.2	178.1	0	0	0	0	0	112	R222 V302 Y310 C363 R364 F365 S370 S371	R222-A367 PolarHBondContact NH2-O 3.27Å; V302-A367 HydrophobicContact CG2-CB 3.36Å; Y310-A367 HydrophobicContact CE1-CB 4.4Å; Y310-A367 WeakPolarHBondContact OH-CA 3.35Å; Y310-A367 WeakPolarHBondContact OH-CB 3.29Å; C363-A367 WeakPolarHBondContact O-CB 3.29Å; C363-A367 PolarHBondContact O-N 3.35Å; R364-A367 PolarHBondContact O-N 3.3Å; F365-A367 VanDerWaalsContact C-N 3.3Å; F365-A367 PolarHBondContact O-N 2.98Å; A367-S370 PolarHBondContact O-N 3.27Å; A367-S370 PolarHBondContact O-OG 2.78Å; A367-S371 PolarHBondContact O-N 3.36Å; A367-S371 VanDerWaalsContact O-N 3.13Å; A367-S371 PolarHBondContact O-OG 2.86Å
368	W	70.5	Confident	74.3	Confident	107 Å²	107	67.1 Å²	67.1	41%	0.405	33%	0.327	S	S	.	.	H	α-helix	trans	-69	-42.6	179.2	-177	76.7	0	0	0	113.3	F23 P25 R364 F365 I366 S370 S371	F23-W368 PolarHBondContact O-NE1 2.97Å; P25-W368 HydrophobicContact CB-CB 3.67Å; P25-W368 HydrophobicContact CB-CG 4.04Å; R364-W368 WeakPolarHBondContact O-CB 3.46Å; R364-W368 PolarHBondContact O-N 2.56Å; F365-W368 PolarHBondContact O-N 3.05Å; I366-W368 VanDerWaalsContact C-N 3.32Å; I366-W368 PolarHBondContact O-N 3.43Å; W368-S370 PolarHBondContact O-N 3.03Å; W368-S370 VanDerWaalsContact O-N 3.16Å; W368-S371 PolarHBondContact O-N 3.26Å
369	F	70.9	Confident	74	Confident	161 Å²	161	64.8 Å²	64.8	71%	0.706	31%	0.313	S	S	*	.	H	α-helix	trans	-65.5	-15.1	175.4	-85.2	-68	0	0	0	113.8	F365 I366	F365-F369 HydrophobicContact CD1-CE2 4.42Å; F365-F369 VanDerWaalsContact O-CD2 3.27Å; F365-F369 WeakPolarHBondContact O-CD2 3.25Å; F365-F369 PolarHBondContact O-N 3.13Å; I366-F369 PolarHBondContact O-N 2.84Å
370	S	68.3	Low	74	Confident	49 Å²	49	69.6 Å²	69.6	34%	0.343	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.9	2.2	-179.3	59.8	0	0	0	0	114	T308 I366 A367 W368	T308-S370 WeakPolarHBondContact CG2-OG 3.4Å; T308-S370 WeakPolarHBondContact OG1-CB 3.49Å; T308-S370 PolarHBondContact OG1-OG 3.44Å; I366-S370 WeakPolarHBondContact O-CB 3.44Å; I366-S370 PolarHBondContact O-N 2.91Å; I366-S370 PolarHBondContact O-OG 3.44Å; A367-S370 PolarHBondContact O-N 3.27Å; A367-S370 PolarHBondContact O-OG 2.78Å; W368-S370 PolarHBondContact O-N 3.03Å; W368-S370 VanDerWaalsContact O-N 3.16Å
371	S	57.7	Low	74.2	Confident	96 Å²	96	73.2 Å²	73.2	67%	0.671	35%	0.345	S	S	*	.			trans	-70.8	0	171.4	-84.9	0	0	0	0	111.9	E30 R222 A367 W368	E30-S371 WeakPolarHBondContact OE1-CB 3.35Å; E30-S371 PolarHBondContact OE1-OG 3Å; R222-S371 VanDerWaalsContact CZ-OG 3.25Å; R222-S371 PolarHBondContact NH1-OG 2.87Å; R222-S371 VanDerWaalsContact NH2-N 3.2Å; R222-S371 PolarHBondContact NH2-OG 3.15Å; A367-S371 PolarHBondContact O-N 3.36Å; A367-S371 VanDerWaalsContact O-N 3.13Å; A367-S371 PolarHBondContact O-OG 2.86Å; W368-S371 PolarHBondContact O-N 3.26Å

Retrieved 371 of 371 residues in 370 ms (Link to these results)

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