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Glycerol-3-phosphate acyltransferase 3

Converts glycerol-3-phosphate to 1-acyl-sn-glycerol-3-phosphate (lysophosphatidic acid or LPA) by incorporating an acyl moiety at the sn-1 position of the glycerol backbone¹. Also converts LPA into 1,2-diacyl-sn-glycerol-3-phosphate (phosphatidic acid or PA) by incorporating an acyl moiety at the sn-2 position of the glycerol backbone². Protects cells against lipotoxicity³.

AlphaFold DB , UniProt , Accession Q53EU6, Species HUMAN (Homo sapiens, Human), Gene GPAT3, Length 434 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	63.6	Low	79.4	Confident	189 Å²	189	104.3 Å²	104.3	93%	0.931	60%	0.595	S	S	*	*				0	-45.7	0	-76.5	172.9	62.4	0	0	111.7	G3 A4 E5	M1-G3 PolarHBondContact O-N 2.92Å; M1-A4 PolarHBondContact O-N 3.12Å; M1-E5 PolarHBondContact O-N 3Å; M1-E5 VanDerWaalsContact O-N 3.12Å
2	E	75	Confident	79.6	Confident	169 Å²	169	101.2 Å²	101.2	79%	0.79	58%	0.584	S	S	*	*	H	α-helix	trans	-52.3	-43.8	179.9	-65.2	179.7	164.4	0	0	115	A4 E5 L6	E2-A4 VanDerWaalsContact C-N 3.31Å; E2-A4 PolarHBondContact O-N 3.37Å; E2-E5 PolarHBondContact O-N 3.26Å; E2-L6 WeakPolarHBondContact O-CB 3.42Å; E2-L6 PolarHBondContact O-N 2.87Å
3	G	75.9	Confident	79.8	Confident	56 Å²	56	99.8 Å²	99.8	58%	0.577	58%	0.578	S	S	*	*	H	α-helix	trans	-63.9	-34	178.5	0	0	0	0	0	113.8	M1 A7	M1-G3 PolarHBondContact O-N 2.92Å; G3-A7 VanDerWaalsContact O-CB 3.26Å; G3-A7 WeakPolarHBondContact O-CB 3.26Å; G3-A7 PolarHBondContact O-N 3.32Å
4	A	79.4	Confident	79.6	Confident	76 Å²	76	98.2 Å²	98.2	63%	0.628	56%	0.558	S	S	*	*	H	α-helix	trans	-74.8	-37.9	177.6	0	0	0	0	0	111.5	M1 E2 G8	M1-A4 PolarHBondContact O-N 3.12Å; E2-A4 VanDerWaalsContact C-N 3.31Å; E2-A4 PolarHBondContact O-N 3.37Å; A4-G8 PolarHBondContact O-N 3.05Å
5	E	82.6	Confident	79.4	Confident	112 Å²	112	95.8 Å²	95.8	52%	0.523	54%	0.543	S	S	.	.	H	α-helix	trans	-66.2	-43	174	-73.2	-176.6	-173.3	0	0	112.1	M1 E2 G8 K9	M1-E5 PolarHBondContact O-N 3Å; M1-E5 VanDerWaalsContact O-N 3.12Å; E2-E5 PolarHBondContact O-N 3.26Å; E5-G8 PolarHBondContact O-N 2.87Å; E5-K9 WeakPolarHBondContact O-CG 3.48Å; E5-K9 PolarHBondContact O-N 3.3Å
6	L	84.6	Confident	79.3	Confident	105 Å²	105	95.6 Å²	95.6	55%	0.55	54%	0.544	S	S	.	.	H	α-helix	trans	-63.3	-46.1	176	-178.1	63.1	0	0	0	110.9	E2 G8 K9 I10	E2-L6 WeakPolarHBondContact O-CB 3.42Å; E2-L6 PolarHBondContact O-N 2.87Å; L6-G8 VanDerWaalsContact C-N 3.3Å; L6-G8 PolarHBondContact O-N 3.09Å; L6-K9 PolarHBondContact O-N 3.41Å; L6-I10 HydrophobicContact CD1-CD1 4.16Å; L6-I10 HydrophobicContact CD1-CG1 4.42Å; L6-I10 HydrophobicContact CG-CD1 3.92Å; L6-I10 VanDerWaalsContact O-CG1 3.29Å; L6-I10 WeakPolarHBondContact O-CG1 3.44Å; L6-I10 PolarHBondContact O-N 3.44Å
7	A	80.8	Confident	79	Confident	57 Å²	57	95.2 Å²	95.2	47%	0.471	54%	0.539	S	S	.	.	H	α-helix	trans	-59.5	-41.6	174.8	0	0	0	0	0	111.7	G3 I10 L11	G3-A7 VanDerWaalsContact O-CB 3.26Å; G3-A7 WeakPolarHBondContact O-CB 3.26Å; G3-A7 PolarHBondContact O-N 3.32Å; A7-I10 PolarHBondContact O-N 3.09Å; A7-L11 VanDerWaalsContact O-CB 3.31Å; A7-L11 WeakPolarHBondContact O-CB 3.35Å; A7-L11 PolarHBondContact O-N 3.29Å
8	G	83.7	Confident	78.7	Confident	39 Å²	39	90.4 Å²	90.4	40%	0.402	51%	0.512	S	S	.	.	H	α-helix	trans	-62.5	-44	175.6	0	0	0	0	0	113	A4 E5 L6 L11 S12	A4-G8 PolarHBondContact O-N 3.05Å; E5-G8 PolarHBondContact O-N 2.87Å; L6-G8 VanDerWaalsContact C-N 3.3Å; L6-G8 PolarHBondContact O-N 3.09Å; G8-L11 PolarHBondContact O-N 3.04Å; G8-S12 VanDerWaalsContact O-CB 3.3Å; G8-S12 WeakPolarHBondContact O-CB 3.42Å; G8-S12 PolarHBondContact O-N 2.89Å
9	K	84.7	Confident	78.3	Confident	137 Å²	137	89.9 Å²	89.9	60%	0.596	51%	0.508	S	S	*	.	H	α-helix	trans	-63.4	-47.4	175.7	-75.5	176.6	-177.3	172.6	0	111.6	E5 L6 L11 S12 T13	E5-K9 WeakPolarHBondContact O-CG 3.48Å; E5-K9 PolarHBondContact O-N 3.3Å; L6-K9 PolarHBondContact O-N 3.41Å; K9-L11 VanDerWaalsContact C-N 3.34Å; K9-L11 PolarHBondContact O-N 3.47Å; K9-S12 PolarHBondContact O-N 3.27Å; K9-T13 PolarHBondContact O-N 3.47Å; K9-T13 PolarHBondContact O-OG1 3.42Å; K9-T13 VanDerWaalsContact O-OG1 3.05Å
10	I	82.9	Confident	77.9	Confident	105 Å²	105	87.7 Å²	87.7	54%	0.538	51%	0.506	S	S	.	.	H	α-helix	trans	-59	-47.2	177.6	-68.2	167.1	0	0	0	110.3	L6 A7 W14	L6-I10 HydrophobicContact CD1-CD1 4.16Å; L6-I10 HydrophobicContact CD1-CG1 4.42Å; L6-I10 HydrophobicContact CG-CD1 3.92Å; L6-I10 VanDerWaalsContact O-CG1 3.29Å; L6-I10 WeakPolarHBondContact O-CG1 3.44Å; L6-I10 PolarHBondContact O-N 3.44Å; A7-I10 PolarHBondContact O-N 3.09Å; I10-W14 WeakPolarHBondContact O-CB 3.36Å; I10-W14 PolarHBondContact O-N 2.92Å
11	L	80.7	Confident	77.5	Confident	102 Å²	102	89 Å²	89	53%	0.534	51%	0.506	S	S	.	.	H	α-helix	trans	-62.8	-43.6	178.4	-177.9	63.9	0	0	0	112	A7 G8 K9 W14 L15	A7-L11 VanDerWaalsContact O-CB 3.31Å; A7-L11 WeakPolarHBondContact O-CB 3.35Å; A7-L11 PolarHBondContact O-N 3.29Å; G8-L11 PolarHBondContact O-N 3.04Å; K9-L11 VanDerWaalsContact C-N 3.34Å; K9-L11 PolarHBondContact O-N 3.47Å; L11-W14 PolarHBondContact O-N 2.99Å; L11-L15 HydrophobicContact CD1-CD1 4.32Å; L11-L15 HydrophobicContact CD1-CG 4.37Å; L11-L15 HydrophobicContact CG-CD1 4.09Å; L11-L15 WeakPolarHBondContact O-CB 3.29Å; L11-L15 VanDerWaalsContact O-CG 3.31Å; L11-L15 WeakPolarHBondContact O-CG 3.24Å; L11-L15 PolarHBondContact O-N 3.05Å
12	S	81.7	Confident	77.9	Confident	67 Å²	67	81.6 Å²	81.6	47%	0.469	47%	0.47	S	S	.	.	H	α-helix	trans	-62.7	-50.5	178.3	177.2	0	0	0	0	111.6	G8 K9 W14 L15 T16	G8-S12 VanDerWaalsContact O-CB 3.3Å; G8-S12 WeakPolarHBondContact O-CB 3.42Å; G8-S12 PolarHBondContact O-N 2.89Å; K9-S12 PolarHBondContact O-N 3.27Å; S12-W14 VanDerWaalsContact C-N 3.3Å; S12-W14 PolarHBondContact O-N 3.28Å; S12-L15 PolarHBondContact O-N 3.45Å; S12-T16 PolarHBondContact O-N 3.04Å; S12-T16 PolarHBondContact O-OG1 3.4Å; S12-T16 VanDerWaalsContact O-OG1 3.04Å
13	T	81.8	Confident	77.8	Confident	83 Å²	83	75.9 Å²	75.9	51%	0.509	44%	0.444	S	S	.	.	H	α-helix	trans	-58.6	-44.6	176.2	-56.6	0	0	0	0	111.1	K9 L15 T16 L17	K9-T13 PolarHBondContact O-N 3.47Å; K9-T13 PolarHBondContact O-OG1 3.42Å; K9-T13 VanDerWaalsContact O-OG1 3.05Å; T13-L15 PolarHBondContact O-N 2.93Å; T13-T16 PolarHBondContact O-N 3.28Å; T13-L17 HydrophobicContact CG2-CD1 4.23Å; T13-L17 VanDerWaalsContact O-CG 3.28Å; T13-L17 WeakPolarHBondContact O-CG 3.31Å; T13-L17 PolarHBondContact O-N 2.87Å
14	W	77.7	Confident	77.8	Confident	78 Å²	78	78.3 Å²	78.3	30%	0.295	44%	0.443	S	S	.	.	H	α-helix	trans	-61.5	-44.1	178.7	-172.4	90.2	0	0	0	111.9	I10 L11 S12 L17 V18 L159 T162	I10-W14 WeakPolarHBondContact O-CB 3.36Å; I10-W14 PolarHBondContact O-N 2.92Å; L11-W14 PolarHBondContact O-N 2.99Å; S12-W14 VanDerWaalsContact C-N 3.3Å; S12-W14 PolarHBondContact O-N 3.28Å; W14-L17 PolarHBondContact O-N 3.46Å; W14-V18 HydrophobicContact CD2-CG2 4.25Å; W14-V18 HydrophobicContact CE3-CG2 4.2Å; W14-V18 HydrophobicContact CH2-CG2 3.59Å; W14-V18 HydrophobicContact CZ2-CG2 3.79Å; W14-V18 HydrophobicContact CZ3-CB 4.46Å; W14-V18 HydrophobicContact CZ3-CG2 3.85Å; W14-V18 VanDerWaalsContact O-CG2 3.31Å; W14-V18 WeakPolarHBondContact O-CG2 3.4Å; W14-V18 PolarHBondContact O-N 3.25Å; W14-L159 HydrophobicContact CH2-CD1 4.38Å; W14-L159 HydrophobicContact CZ2-CD1 3.78Å; W14-T162 HydrophobicContact CH2-CG2 3.19Å; W14-T162 WeakPolarHBondContact CH2-OG1 3.31Å; W14-T162 HydrophobicContact CZ2-CG2 4.46Å; W14-T162 HydrophobicContact CZ3-CG2 3.22Å
15	L	75.9	Confident	77.8	Confident	62 Å²	62	75 Å²	75	33%	0.325	42%	0.416	S	S	.	.	H	α-helix	trans	-64.8	-42.8	174.8	-75.1	170.7	0	0	0	112.4	L11 S12 T13 L17 V18 L19	L11-L15 HydrophobicContact CD1-CD1 4.32Å; L11-L15 HydrophobicContact CD1-CG 4.37Å; L11-L15 HydrophobicContact CG-CD1 4.09Å; L11-L15 WeakPolarHBondContact O-CB 3.29Å; L11-L15 VanDerWaalsContact O-CG 3.31Å; L11-L15 WeakPolarHBondContact O-CG 3.24Å; L11-L15 PolarHBondContact O-N 3.05Å; S12-L15 PolarHBondContact O-N 3.45Å; T13-L15 PolarHBondContact O-N 2.93Å; L15-L17 VanDerWaalsContact C-N 3.33Å; L15-L17 PolarHBondContact O-N 2.89Å; L15-V18 PolarHBondContact O-N 3.38Å; L15-L19 WeakPolarHBondContact O-CB 3.29Å; L15-L19 WeakPolarHBondContact O-CG 3.3Å; L15-L19 PolarHBondContact O-N 2.88Å
16	T	77.8	Confident	77.6	Confident	92 Å²	92	69.7 Å²	69.7	56%	0.564	39%	0.391	S	S	*	.	H	α-helix	trans	-61.7	-42.2	177.6	-57.7	0	0	0	0	111.5	S12 T13 G20	S12-T16 PolarHBondContact O-N 3.04Å; S12-T16 PolarHBondContact O-OG1 3.4Å; S12-T16 VanDerWaalsContact O-OG1 3.04Å; T13-T16 PolarHBondContact O-N 3.28Å; T16-G20 PolarHBondContact O-N 2.92Å
17	L	75.1	Confident	77.3	Confident	89 Å²	89	67.1 Å²	67.1	47%	0.466	38%	0.379	S	S	.	.	H	α-helix	trans	-61.9	-47.4	175	-69.2	173.1	0	0	0	110.9	T13 W14 L15 F21	T13-L17 HydrophobicContact CG2-CD1 4.23Å; T13-L17 VanDerWaalsContact O-CG 3.28Å; T13-L17 WeakPolarHBondContact O-CG 3.31Å; T13-L17 PolarHBondContact O-N 2.87Å; W14-L17 PolarHBondContact O-N 3.46Å; L15-L17 VanDerWaalsContact C-N 3.33Å; L15-L17 PolarHBondContact O-N 2.89Å; L17-F21 HydrophobicContact CB-CD2 4.35Å; L17-F21 HydrophobicContact CD2-CD2 3.93Å; L17-F21 HydrophobicContact CD2-CE2 3.55Å; L17-F21 VanDerWaalsContact O-CB 3.29Å; L17-F21 WeakPolarHBondContact O-CB 3.49Å; L17-F21 VanDerWaalsContact O-CD2 3.31Å; L17-F21 WeakPolarHBondContact O-CD2 3.23Å; L17-F21 PolarHBondContact O-N 3.34Å
18	V	72.1	Confident	77.4	Confident	9 Å²	9	71.4 Å²	71.4	6%	0.055	39%	0.387	C	S	.	.	H	α-helix	trans	-61.9	-46.9	178.5	167.5	0	0	0	0	111.7	W14 L15 I22 L159 L163 I166	W14-V18 HydrophobicContact CD2-CG2 4.25Å; W14-V18 HydrophobicContact CE3-CG2 4.2Å; W14-V18 HydrophobicContact CH2-CG2 3.59Å; W14-V18 HydrophobicContact CZ2-CG2 3.79Å; W14-V18 HydrophobicContact CZ3-CB 4.46Å; W14-V18 HydrophobicContact CZ3-CG2 3.85Å; W14-V18 VanDerWaalsContact O-CG2 3.31Å; W14-V18 WeakPolarHBondContact O-CG2 3.4Å; W14-V18 PolarHBondContact O-N 3.25Å; L15-V18 PolarHBondContact O-N 3.38Å; V18-I22 WeakPolarHBondContact O-CB 3.41Å; V18-I22 PolarHBondContact O-N 2.88Å; V18-L159 HydrophobicContact CG2-CD1 3.89Å; V18-L163 HydrophobicContact CG1-CD2 3.59Å; V18-L163 HydrophobicContact CG1-CG 4.49Å; V18-I166 HydrophobicContact CG1-CD1 3.84Å
19	L	71.1	Confident	76.9	Confident	82 Å²	82	71.3 Å²	71.3	43%	0.429	39%	0.387	S	S	.	.	I	π-helix	trans	-65.2	-49.4	-179.8	-70.2	169.1	0	0	0	111.4	L15 L23	L15-L19 WeakPolarHBondContact O-CB 3.29Å; L15-L19 WeakPolarHBondContact O-CG 3.3Å; L15-L19 PolarHBondContact O-N 2.88Å; L19-L23 HydrophobicContact CD2-CD1 3.6Å; L19-L23 WeakPolarHBondContact O-CB 3.26Å; L19-L23 PolarHBondContact O-N 3.45Å; L19-L23 VanDerWaalsContact O-N 3.1Å
20	G	70.7	Confident	76.6	Confident	45 Å²	45	68.7 Å²	68.7	46%	0.464	38%	0.382	S	S	.	.	I	π-helix	trans	-67	-47.2	-177.4	0	0	0	0	0	113.2	T16	T16-G20 PolarHBondContact O-N 2.92Å
21	F	70.6	Confident	76.1	Confident	114 Å²	114	66.3 Å²	66.3	50%	0.5	38%	0.375	S	S	.	.	I	π-helix	trans	-84.4	-18.6	-174.3	-71.4	-73.2	0	0	0	114	L17 P25 L32	L17-F21 HydrophobicContact CB-CD2 4.35Å; L17-F21 HydrophobicContact CD2-CD2 3.93Å; L17-F21 HydrophobicContact CD2-CE2 3.55Å; L17-F21 VanDerWaalsContact O-CB 3.29Å; L17-F21 WeakPolarHBondContact O-CB 3.49Å; L17-F21 VanDerWaalsContact O-CD2 3.31Å; L17-F21 WeakPolarHBondContact O-CD2 3.23Å; L17-F21 PolarHBondContact O-N 3.34Å; F21-P25 WeakPolarHBondContact O-CG 3.48Å; F21-L32 HydrophobicContact CB-CD1 4.02Å; F21-L32 HydrophobicContact CD1-CD1 3.56Å; F21-L32 HydrophobicContact CG-CD1 4.3Å; F21-L32 WeakPolarHBondContact O-CD1 3.41Å
22	I	70.9	Confident	75.7	Confident	35 Å²	35	65.6 Å²	65.6	18%	0.179	37%	0.371	C	S	.	.	I	π-helix	trans	-119.8	-43.9	-172.1	-52.4	178	0	0	0	112.1	V18 S26 L163 R204	V18-I22 WeakPolarHBondContact O-CB 3.41Å; V18-I22 PolarHBondContact O-N 2.88Å; I22-S26 WeakPolarHBondContact O-CB 3.37Å; I22-S26 PolarHBondContact O-N 3.47Å; I22-S26 VanDerWaalsContact O-N 3.17Å; I22-S26 PolarHBondContact O-OG 2.78Å; I22-L163 HydrophobicContact CB-CD2 4.19Å; I22-L163 HydrophobicContact CD1-CD1 3.79Å; I22-L163 HydrophobicContact CD1-CD2 3.76Å; I22-L163 HydrophobicContact CD1-CG 4.3Å; I22-L163 HydrophobicContact CG2-CD2 3.8Å; I22-R204 HydrophobicContact CG2-CB 4.49Å; I22-R204 PolarHBondContact O-NH1 3.34Å
23	L	73	Confident	75.4	Confident	48 Å²	48	63.3 Å²	63.3	25%	0.251	36%	0.358	S	S	.	.	I	π-helix	trans	-70.4	-51.1	-175.4	-160.8	152.1	0	0	0	111.2	L19 S26 V27 I166 L170 I201	L19-L23 HydrophobicContact CD2-CD1 3.6Å; L19-L23 WeakPolarHBondContact O-CB 3.26Å; L19-L23 PolarHBondContact O-N 3.45Å; L19-L23 VanDerWaalsContact O-N 3.1Å; L23-S26 WeakPolarHBondContact O-CA 3.2Å; L23-S26 VanDerWaalsContact O-CB 3.3Å; L23-S26 WeakPolarHBondContact O-CB 3.36Å; L23-S26 PolarHBondContact O-N 3.2Å; L23-V27 HydrophobicContact CD2-CG2 4.24Å; L23-V27 PolarHBondContact O-N 3.46Å; L23-V27 VanDerWaalsContact O-N 3.15Å; L23-I166 HydrophobicContact CD1-CG2 4.41Å; L23-L170 HydrophobicContact CD1-CD1 3.73Å; L23-I201 HydrophobicContact CG-CD1 4.24Å
24	L	75.3	Confident	75.2	Confident	107 Å²	107	64.3 Å²	64.3	56%	0.56	36%	0.359	S	S	*	.	H	α-helix	trans	-61.4	-45.7	-177.5	-168.2	134.5	0	0	0	112.7	S26 V27 F28	L24-S26 PolarHBondContact O-N 3.36Å; L24-V27 PolarHBondContact O-N 3.41Å; L24-F28 HydrophobicContact CD2-CD2 4.23Å; L24-F28 HydrophobicContact CD2-CE2 4.09Å; L24-F28 HydrophobicContact CG-CD2 4.42Å; L24-F28 HydrophobicContact CG-CE2 4.09Å; L24-F28 VanDerWaalsContact O-CD2 3.25Å; L24-F28 WeakPolarHBondContact O-CD2 3.21Å; L24-F28 PolarHBondContact O-N 2.85Å
25	P	80.1	Confident	75.3	Confident	8 Å²	8	63 Å²	63	5%	0.052	36%	0.362	C	S	.	.	H	α-helix	trans	-67.3	-21.5	173.2	-20.2	34.3	0	0	0	113.4	F21 G29 V30 L32 R204	F21-P25 WeakPolarHBondContact O-CG 3.48Å; P25-G29 CarbonylContact O-C 3.53Å; P25-G29 PolarHBondContact O-N 3.3Å; P25-V30 CarbonylContact C-O 3.55Å; P25-V30 WeakPolarHBondContact CB-O 3.27Å; P25-V30 PolarHBondContact O-N 2.93Å; P25-L32 HydrophobicContact CB-CD2 4.48Å; P25-L32 HydrophobicContact CB-CG 4.26Å; P25-L32 HydrophobicContact CG-CD1 3.89Å; P25-L32 HydrophobicContact CG-CD2 3.88Å; P25-L32 HydrophobicContact CG-CG 3.72Å; P25-R204 VanDerWaalsContact C-NH1 3.29Å; P25-R204 PolarHBondContact O-NH2 2.91Å; P25-R204 VanDerWaalsContact O-NH2 3.12Å
26	S	79.5	Confident	75.6	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-70.9	-40.1	177	-61.6	0	0	0	0	111.3	I22 L23 L24 F28 G29 R200 I201 R204	I22-S26 WeakPolarHBondContact O-CB 3.37Å; I22-S26 PolarHBondContact O-N 3.47Å; I22-S26 VanDerWaalsContact O-N 3.17Å; I22-S26 PolarHBondContact O-OG 2.78Å; L23-S26 WeakPolarHBondContact O-CA 3.2Å; L23-S26 VanDerWaalsContact O-CB 3.3Å; L23-S26 WeakPolarHBondContact O-CB 3.36Å; L23-S26 PolarHBondContact O-N 3.2Å; L24-S26 PolarHBondContact O-N 3.36Å; S26-F28 VanDerWaalsContact C-N 3.34Å; S26-F28 PolarHBondContact O-N 3.45Å; S26-G29 PolarHBondContact O-N 3.14Å; S26-R200 WeakPolarHBondContact O-CD 3.41Å; S26-R200 PolarHBondContact O-NH1 3.42Å; S26-I201 WeakPolarHBondContact OG-CG1 3.25Å; S26-R204 VanDerWaalsContact CA-NH1 3.27Å; S26-R204 WeakPolarHBondContact OG-CD 3.41Å; S26-R204 VanDerWaalsContact OG-CZ 3.31Å; S26-R204 PolarHBondContact OG-NH1 2.92Å
27	V	78.3	Confident	76	Confident	50 Å²	50	65.9 Å²	65.9	30%	0.303	37%	0.37	S	S	.	.	H	α-helix	trans	-57.8	-49.3	176.2	176.9	0	0	0	0	110	L23 L24 G29 T197 R200	L23-V27 HydrophobicContact CD2-CG2 4.24Å; L23-V27 PolarHBondContact O-N 3.46Å; L23-V27 VanDerWaalsContact O-N 3.15Å; L24-V27 PolarHBondContact O-N 3.41Å; V27-G29 VanDerWaalsContact C-N 3.33Å; V27-G29 PolarHBondContact O-N 3.27Å; V27-T197 HydrophobicContact CB-CG2 4.47Å; V27-T197 HydrophobicContact CG2-CG2 3.7Å; V27-R200 PolarHBondContact O-NH1 3.15Å
28	F	81.3	Confident	76.6	Confident	147 Å²	147	64.3 Å²	64.3	65%	0.645	36%	0.358	S	S	*	.	H	α-helix	trans	-82	-6.6	-179.1	-61.9	-68.3	0	0	0	114.6	L24 S26 V30	L24-F28 HydrophobicContact CD2-CD2 4.23Å; L24-F28 HydrophobicContact CD2-CE2 4.09Å; L24-F28 HydrophobicContact CG-CD2 4.42Å; L24-F28 HydrophobicContact CG-CE2 4.09Å; L24-F28 VanDerWaalsContact O-CD2 3.25Å; L24-F28 WeakPolarHBondContact O-CD2 3.21Å; L24-F28 PolarHBondContact O-N 2.85Å; S26-F28 VanDerWaalsContact C-N 3.34Å; S26-F28 PolarHBondContact O-N 3.45Å; F28-V30 HydrophobicContact CB-CG2 4.04Å; F28-V30 PolarHBondContact O-N 2.87Å
29	G	74.5	Confident	77.4	Confident	38 Å²	38	64.8 Å²	64.8	39%	0.392	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.6	16.7	-176.5	0	0	0	0	0	114.2	P25 S26 V27	P25-G29 CarbonylContact O-C 3.53Å; P25-G29 PolarHBondContact O-N 3.3Å; S26-G29 PolarHBondContact O-N 3.14Å; V27-G29 VanDerWaalsContact C-N 3.33Å; V27-G29 PolarHBondContact O-N 3.27Å
30	V	76.8	Confident	78.3	Confident	81 Å²	81	67.4 Å²	67.4	49%	0.491	37%	0.368	S	S	.	.			trans	-92	139.9	179.5	-178.9	0	0	0	0	109.6	P25 F28 R204	P25-V30 CarbonylContact C-O 3.55Å; P25-V30 WeakPolarHBondContact CB-O 3.27Å; P25-V30 PolarHBondContact O-N 2.93Å; F28-V30 HydrophobicContact CB-CG2 4.04Å; F28-V30 PolarHBondContact O-N 2.87Å; V30-R204 PolarHBondContact O-NH2 3.44Å
31	S	72.7	Confident	79.3	Confident	56 Å²	56	70.2 Å²	70.2	39%	0.392	37%	0.371	S	S	.	.			trans	-96.9	136.7	168.5	178.1	0	0	0	0	109	G33	S31-G33 PolarHBondContact O-N 3.33Å; S31-G33 PolarHBondContact OG-N 3.47Å
32	L	72.4	Confident	80.2	Confident	87 Å²	87	65.1 Å²	65.1	46%	0.455	35%	0.349	S	S	.	.			trans	-77.9	10.7	175.4	-63.7	-179.6	0	0	0	113.5	F21 P25 I34	F21-L32 HydrophobicContact CB-CD1 4.02Å; F21-L32 HydrophobicContact CD1-CD1 3.56Å; F21-L32 HydrophobicContact CG-CD1 4.3Å; F21-L32 WeakPolarHBondContact O-CD1 3.41Å; P25-L32 HydrophobicContact CB-CD2 4.48Å; P25-L32 HydrophobicContact CB-CG 4.26Å; P25-L32 HydrophobicContact CG-CD1 3.89Å; P25-L32 HydrophobicContact CG-CD2 3.88Å; P25-L32 HydrophobicContact CG-CG 3.72Å; L32-I34 HydrophobicContact CB-CD1 4.34Å; L32-I34 HydrophobicContact CB-CG1 4.3Å; L32-I34 PolarHBondContact O-N 2.99Å
33	G	75.3	Confident	81.1	Confident	18 Å²	18	65.4 Å²	65.4	19%	0.186	35%	0.352	C	S	.	.	S	Bend	trans	73.9	-12.5	-177.4	0	0	0	0	0	115.1	S31 S35 E36 I37	S31-G33 PolarHBondContact O-N 3.33Å; S31-G33 PolarHBondContact OG-N 3.47Å; G33-S35 VanDerWaalsContact C-N 3.29Å; G33-S35 PolarHBondContact O-N 2.95Å; G33-E36 WeakPolarHBondContact O-CB 3.29Å; G33-E36 PolarHBondContact O-N 2.72Å; G33-I37 PolarHBondContact O-N 3.1Å
34	I	78.4	Confident	82	Confident	104 Å²	104	70.4 Å²	70.4	53%	0.533	37%	0.372	S	S	.	.	H	α-helix	trans	-55.4	-45.7	177.6	-59.8	173.6	0	0	0	110.9	L32 E36 I37 Y38	L32-I34 HydrophobicContact CB-CD1 4.34Å; L32-I34 HydrophobicContact CB-CG1 4.3Å; L32-I34 PolarHBondContact O-N 2.99Å; I34-E36 VanDerWaalsContact C-N 3.3Å; I34-E36 PolarHBondContact O-N 2.63Å; I34-I37 PolarHBondContact O-N 3.32Å; I34-Y38 WeakPolarHBondContact O-CB 3.41Å; I34-Y38 PolarHBondContact O-N 2.9Å
35	S	79.4	Confident	82.6	Confident	51 Å²	51	67.6 Å²	67.6	36%	0.357	36%	0.359	S	S	.	.	H	α-helix	trans	-61.1	-38.2	176.8	-57.7	0	0	0	0	112	G33 Y38 M39	G33-S35 VanDerWaalsContact C-N 3.29Å; G33-S35 PolarHBondContact O-N 2.95Å; S35-Y38 PolarHBondContact O-N 2.74Å; S35-M39 WeakPolarHBondContact O-CB 3.38Å; S35-M39 WeakPolarHBondContact O-CG 3.24Å; S35-M39 PolarHBondContact O-N 3.33Å
36	E	82.5	Confident	82.9	Confident	110 Å²	110	67.2 Å²	67.2	51%	0.514	36%	0.357	S	S	.	.	H	α-helix	trans	-69.2	-40	179.7	-64.4	171.6	-158.2	0	0	111.9	G33 I34 M39 K40	G33-E36 WeakPolarHBondContact O-CB 3.29Å; G33-E36 PolarHBondContact O-N 2.72Å; I34-E36 VanDerWaalsContact C-N 3.3Å; I34-E36 PolarHBondContact O-N 2.63Å; E36-M39 PolarHBondContact O-N 2.91Å; E36-K40 WeakPolarHBondContact O-CB 3.49Å; E36-K40 VanDerWaalsContact O-CG 3.3Å; E36-K40 WeakPolarHBondContact O-CG 3.44Å; E36-K40 PolarHBondContact O-N 3.19Å
37	I	86.3	Confident	83.3	Confident	105 Å²	105	71.9 Å²	71.9	54%	0.538	38%	0.379	S	S	.	.	H	α-helix	trans	-63.4	-46.8	174.2	-64.1	170.1	0	0	0	109.8	G33 I34 M39 K40 I41	G33-I37 PolarHBondContact O-N 3.1Å; I34-I37 PolarHBondContact O-N 3.32Å; I37-M39 PolarHBondContact O-N 2.91Å; I37-K40 PolarHBondContact O-N 3.07Å; I37-I41 HydrophobicContact CG2-CD1 3.96Å; I37-I41 WeakPolarHBondContact O-CG1 3.44Å; I37-I41 PolarHBondContact O-N 3.4Å
38	Y	87.9	Confident	83.7	Confident	55 Å²	55	74.3 Å²	74.3	22%	0.216	38%	0.382	C	S	.	.	H	α-helix	trans	-56.3	-48.2	175	168.4	-106.1	0	0	0	111.7	I34 S35 K40 I41 L42 W360 A361	I34-Y38 WeakPolarHBondContact O-CB 3.41Å; I34-Y38 PolarHBondContact O-N 2.9Å; S35-Y38 PolarHBondContact O-N 2.74Å; Y38-K40 PolarHBondContact O-N 3.35Å; Y38-I41 PolarHBondContact O-N 3.22Å; Y38-L42 HydrophobicContact CE1-CD2 4.15Å; Y38-L42 VanDerWaalsContact O-CB 3.31Å; Y38-L42 WeakPolarHBondContact O-CB 3.22Å; Y38-L42 PolarHBondContact O-N 3.41Å; Y38-W360 PolarHBondContact OH-O 3.34Å; Y38-A361 HydrophobicContact CE1-CB 4.46Å
39	M	89	Confident	83.8	Confident	19 Å²	19	67.3 Å²	67.3	9%	0.094	35%	0.352	C	S	.	.	H	α-helix	trans	-62.5	-41.6	178.2	-71.4	-52	-59.7	0	0	112.2	S35 E36 I37 I41 L42 V43 F337 A361 V363	S35-M39 WeakPolarHBondContact O-CB 3.38Å; S35-M39 WeakPolarHBondContact O-CG 3.24Å; S35-M39 PolarHBondContact O-N 3.33Å; E36-M39 PolarHBondContact O-N 2.91Å; I37-M39 PolarHBondContact O-N 2.91Å; M39-I41 PolarHBondContact O-N 3.21Å; M39-L42 HydrophobicContact CE-CD2 4.27Å; M39-L42 PolarHBondContact O-N 3.47Å; M39-L42 HydrophobicContact SD-CD2 4.15Å; M39-V43 WeakPolarHBondContact O-CB 3.48Å; M39-V43 VanDerWaalsContact O-CG2 3.29Å; M39-V43 WeakPolarHBondContact O-CG2 3.43Å; M39-V43 PolarHBondContact O-N 3.42Å; M39-F337 HydrophobicContact CE-CD1 3.59Å; M39-F337 HydrophobicContact CE-CD2 4.25Å; M39-F337 HydrophobicContact CE-CE1 3.36Å; M39-F337 HydrophobicContact CE-CE2 4.04Å; M39-F337 HydrophobicContact CE-CG 4Å; M39-F337 HydrophobicContact CE-CZ 3.59Å; M39-A361 HydrophobicContact CE-CB 4.11Å; M39-A361 HydrophobicContact SD-CB 3.52Å; M39-A361 VanDerWaalsContact SD-CB 3.52Å; M39-V363 HydrophobicContact CE-CG2 3.45Å; M39-V363 VanDerWaalsContact CE-CG2 3.45Å; M39-V363 HydrophobicContact SD-CG2 4.37Å
40	K	90.1	Very high	84.2	Confident	138 Å²	138	66.6 Å²	66.6	60%	0.6	34%	0.339	S	S	*	.	H	α-helix	trans	-60.9	-43.5	175.6	-77	171.3	-179.6	173	0	112.3	E36 I37 Y38 K44	E36-K40 WeakPolarHBondContact O-CB 3.49Å; E36-K40 VanDerWaalsContact O-CG 3.3Å; E36-K40 WeakPolarHBondContact O-CG 3.44Å; E36-K40 PolarHBondContact O-N 3.19Å; I37-K40 PolarHBondContact O-N 3.07Å; Y38-K40 PolarHBondContact O-N 3.35Å; K40-K44 WeakPolarHBondContact O-CG 3.11Å; K40-K44 PolarHBondContact O-N 3.45Å
41	I	90.5	Very high	84.5	Confident	103 Å²	103	66.8 Å²	66.8	53%	0.528	34%	0.337	S	S	.	.	H	α-helix	trans	-65.2	-44.4	177	-67	167.9	0	0	0	110.2	I37 Y38 M39 K44 T45	I37-I41 HydrophobicContact CG2-CD1 3.96Å; I37-I41 WeakPolarHBondContact O-CG1 3.44Å; I37-I41 PolarHBondContact O-N 3.4Å; Y38-I41 PolarHBondContact O-N 3.22Å; M39-I41 PolarHBondContact O-N 3.21Å; I41-K44 PolarHBondContact O-N 3.31Å; I41-T45 WeakPolarHBondContact O-CB 3.31Å; I41-T45 PolarHBondContact O-N 2.87Å; I41-T45 PolarHBondContact O-OG1 2.81Å
42	L	90.5	Very high	84.8	Confident	8 Å²	8	69.7 Å²	69.7	4%	0.042	34%	0.339	C	S	.	.	H	α-helix	trans	-62	-50.3	-179.9	179	62.8	0	0	0	111.8	Y38 M39 K44 T45 L46 F337 W360	Y38-L42 HydrophobicContact CE1-CD2 4.15Å; Y38-L42 VanDerWaalsContact O-CB 3.31Å; Y38-L42 WeakPolarHBondContact O-CB 3.22Å; Y38-L42 PolarHBondContact O-N 3.41Å; M39-L42 HydrophobicContact CE-CD2 4.27Å; M39-L42 PolarHBondContact O-N 3.47Å; M39-L42 HydrophobicContact SD-CD2 4.15Å; L42-K44 PolarHBondContact O-N 3.49Å; L42-T45 WeakPolarHBondContact O-CB 3.21Å; L42-T45 PolarHBondContact O-N 2.91Å; L42-T45 VanDerWaalsContact O-N 3.09Å; L42-L46 HydrophobicContact CD1-CD1 4.22Å; L42-L46 HydrophobicContact CD1-CG 4.17Å; L42-L46 HydrophobicContact CG-CD1 4.21Å; L42-L46 HydrophobicContact CG-CG 4.47Å; L42-L46 WeakPolarHBondContact O-CG 3.17Å; L42-L46 PolarHBondContact O-N 3.1Å; L42-F337 HydrophobicContact CD2-CD1 3.56Å; L42-F337 HydrophobicContact CD2-CE1 4.01Å; L42-F337 HydrophobicContact CG-CD1 4.12Å; L42-F337 HydrophobicContact CG-CE1 4.23Å; L42-W360 HydrophobicContact CD1-CB 3.96Å; L42-W360 HydrophobicContact CD1-CD2 3.73Å; L42-W360 HydrophobicContact CD1-CE3 3.89Å; L42-W360 HydrophobicContact CD1-CG 3.8Å; L42-W360 HydrophobicContact CD1-CZ3 4.49Å; L42-W360 HydrophobicContact CD2-CB 3.56Å; L42-W360 HydrophobicContact CD2-CG 4.32Å; L42-W360 HydrophobicContact CG-CB 4.37Å
43	V	90.4	Very high	85	Confident	40 Å²	40	66 Å²	66	24%	0.242	32%	0.32	C	S	.	.	H	α-helix	trans	-55.2	-52.1	177.2	169.6	0	0	0	0	110.8	M39 T45 L46 E47 F337	M39-V43 WeakPolarHBondContact O-CB 3.48Å; M39-V43 VanDerWaalsContact O-CG2 3.29Å; M39-V43 WeakPolarHBondContact O-CG2 3.43Å; M39-V43 PolarHBondContact O-N 3.42Å; V43-T45 PolarHBondContact O-N 3.26Å; V43-L46 PolarHBondContact O-N 2.97Å; V43-L46 VanDerWaalsContact O-N 3.12Å; V43-E47 HydrophobicContact CG1-CG 4.22Å; V43-E47 WeakPolarHBondContact CG1-OE1 3.28Å; V43-E47 WeakPolarHBondContact O-CB 3.3Å; V43-E47 WeakPolarHBondContact O-CG 3.36Å; V43-E47 PolarHBondContact O-N 3.45Å; V43-F337 HydrophobicContact CG2-CE1 3.65Å; V43-F337 HydrophobicContact CG2-CZ 3.55Å
44	K	90	Very high	85.1	Confident	153 Å²	153	70.3 Å²	70.3	67%	0.665	34%	0.335	S	S	*	.	H	α-helix	trans	-57.4	-37.5	177.8	-74.5	-175.8	176.8	-172	0	112.6	K40 I41 L42 W48	K40-K44 WeakPolarHBondContact O-CG 3.11Å; K40-K44 PolarHBondContact O-N 3.45Å; I41-K44 PolarHBondContact O-N 3.31Å; L42-K44 PolarHBondContact O-N 3.49Å; K44-W48 VanDerWaalsContact O-CB 3.23Å; K44-W48 WeakPolarHBondContact O-CB 3.3Å; K44-W48 PolarHBondContact O-N 2.96Å
45	T	88.1	Confident	85	Confident	49 Å²	49	73.2 Å²	73.2	30%	0.301	34%	0.344	S	S	.	.	H	α-helix	trans	-68.6	-43.5	178.2	-55.8	0	0	0	0	111.4	I41 L42 V43 A49 L126 V144	I41-T45 WeakPolarHBondContact O-CB 3.31Å; I41-T45 PolarHBondContact O-N 2.87Å; I41-T45 PolarHBondContact O-OG1 2.81Å; L42-T45 WeakPolarHBondContact O-CB 3.21Å; L42-T45 PolarHBondContact O-N 2.91Å; L42-T45 VanDerWaalsContact O-N 3.09Å; V43-T45 PolarHBondContact O-N 3.26Å; T45-A49 WeakPolarHBondContact O-CB 3.32Å; T45-A49 PolarHBondContact O-N 3.01Å; T45-L126 HydrophobicContact CG2-CD1 4.31Å; T45-V144 HydrophobicContact CG2-CG1 4.33Å
46	L	87.8	Confident	84.5	Confident	0 Å²	0	73.3 Å²	73.3	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-68.7	-41.2	178.8	-66.5	-176.7	0	0	0	112.2	L42 V43 A49 T50 L126 Q336 F337	L42-L46 HydrophobicContact CD1-CD1 4.22Å; L42-L46 HydrophobicContact CD1-CG 4.17Å; L42-L46 HydrophobicContact CG-CD1 4.21Å; L42-L46 HydrophobicContact CG-CG 4.47Å; L42-L46 WeakPolarHBondContact O-CG 3.17Å; L42-L46 PolarHBondContact O-N 3.1Å; V43-L46 PolarHBondContact O-N 2.97Å; V43-L46 VanDerWaalsContact O-N 3.12Å; L46-A49 PolarHBondContact O-N 2.75Å; L46-T50 WeakPolarHBondContact O-CB 3.3Å; L46-T50 PolarHBondContact O-N 3.31Å; L46-T50 PolarHBondContact O-OG1 2.83Å; L46-L126 HydrophobicContact CD2-CD1 3.82Å; L46-L126 HydrophobicContact CD2-CG 3.86Å; L46-Q336 HydrophobicContact CD1-CG 4.06Å; L46-F337 HydrophobicContact CD1-CD1 4.14Å; L46-F337 HydrophobicContact CD1-CE1 4.25Å
47	E	87.4	Confident	83.6	Confident	98 Å²	98	69.7 Å²	69.7	46%	0.458	34%	0.339	S	S	.	.	H	α-helix	trans	-61	-48.8	173.5	-73.4	173.3	171.3	0	0	110.8	V43 A49 T50 I51	V43-E47 HydrophobicContact CG1-CG 4.22Å; V43-E47 WeakPolarHBondContact CG1-OE1 3.28Å; V43-E47 WeakPolarHBondContact O-CB 3.3Å; V43-E47 WeakPolarHBondContact O-CG 3.36Å; V43-E47 PolarHBondContact O-N 3.45Å; E47-A49 VanDerWaalsContact C-N 3.3Å; E47-A49 PolarHBondContact O-N 2.96Å; E47-T50 PolarHBondContact O-N 3.44Å; E47-I51 WeakPolarHBondContact O-CG1 3.2Å; E47-I51 PolarHBondContact O-N 3.06Å
48	W	87.1	Confident	82.3	Confident	101 Å²	101	69 Å²	69	38%	0.383	34%	0.341	S	S	.	.	H	α-helix	trans	-57.6	-43.3	176.1	172.6	91.6	0	0	0	112.1	K44 R52 V144	K44-W48 VanDerWaalsContact O-CB 3.23Å; K44-W48 WeakPolarHBondContact O-CB 3.3Å; K44-W48 PolarHBondContact O-N 2.96Å; W48-R52 HydrophobicContact CD2-CG 4.37Å; W48-R52 HydrophobicContact CZ2-CG 4.22Å; W48-R52 VanDerWaalsContact O-CG 3.24Å; W48-R52 WeakPolarHBondContact O-CG 3.46Å; W48-R52 PolarHBondContact O-N 3.15Å; W48-V144 HydrophobicContact CH2-CG2 4.18Å; W48-V144 HydrophobicContact CZ3-CG2 3.93Å
49	A	82.7	Confident	80.8	Confident	0 Å²	0	75 Å²	75	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-65.9	-42.1	178.4	0	0	0	0	0	111.7	T45 L46 E47 R52 I53 W124 L126	T45-A49 WeakPolarHBondContact O-CB 3.32Å; T45-A49 PolarHBondContact O-N 3.01Å; L46-A49 PolarHBondContact O-N 2.75Å; E47-A49 VanDerWaalsContact C-N 3.3Å; E47-A49 PolarHBondContact O-N 2.96Å; A49-R52 WeakPolarHBondContact O-CB 3.5Å; A49-R52 PolarHBondContact O-N 2.84Å; A49-I53 WeakPolarHBondContact O-CG1 3.44Å; A49-I53 PolarHBondContact O-N 2.89Å; A49-I53 VanDerWaalsContact O-N 3.11Å; A49-W124 HydrophobicContact CB-CE3 4.4Å; A49-L126 HydrophobicContact CB-CD2 4.46Å
50	T	82	Confident	78.9	Confident	22 Å²	22	81.5 Å²	81.5	14%	0.135	40%	0.398	C	S	.	.	H	α-helix	trans	-62.7	-50.1	178.7	-57	0	0	0	0	111.3	L46 E47 R52 I53 E54	L46-T50 WeakPolarHBondContact O-CB 3.3Å; L46-T50 PolarHBondContact O-N 3.31Å; L46-T50 PolarHBondContact O-OG1 2.83Å; E47-T50 PolarHBondContact O-N 3.44Å; T50-R52 PolarHBondContact O-N 3.03Å; T50-I53 WeakPolarHBondContact O-CB 3.26Å; T50-I53 PolarHBondContact O-N 3.4Å; T50-E54 PolarHBondContact O-N 3.4Å
51	I	82.9	Confident	77.2	Confident	85 Å²	85	76.7 Å²	76.7	44%	0.436	38%	0.383	S	S	.	.	H	α-helix	trans	-58.1	-34.5	177.2	-67.1	165.9	0	0	0	111.4	E47 K55	E47-I51 WeakPolarHBondContact O-CG1 3.2Å; E47-I51 PolarHBondContact O-N 3.06Å; I51-K55 HydrophobicContact CG2-CD 4.24Å; I51-K55 WeakPolarHBondContact O-CB 3.4Å; I51-K55 VanDerWaalsContact O-CG 3.31Å; I51-K55 WeakPolarHBondContact O-CG 3.44Å; I51-K55 PolarHBondContact O-N 3.4Å; I51-K55 VanDerWaalsContact O-N 3.09Å
52	R	79.7	Confident	75.2	Confident	117 Å²	117	75.4 Å²	75.4	44%	0.442	38%	0.376	S	S	.	.	H	α-helix	trans	-70	-38.5	178.1	-76.1	-73.6	-176.1	-178.1	-1.7	112.7	W48 A49 T50 G56 L141	W48-R52 HydrophobicContact CD2-CG 4.37Å; W48-R52 HydrophobicContact CZ2-CG 4.22Å; W48-R52 VanDerWaalsContact O-CG 3.24Å; W48-R52 WeakPolarHBondContact O-CG 3.46Å; W48-R52 PolarHBondContact O-N 3.15Å; A49-R52 WeakPolarHBondContact O-CB 3.5Å; A49-R52 PolarHBondContact O-N 2.84Å; T50-R52 PolarHBondContact O-N 3.03Å; R52-G56 PolarHBondContact O-N 2.87Å; R52-G56 VanDerWaalsContact O-N 3.14Å; R52-L141 HydrophobicContact CB-CD1 3.93Å
53	I	76.8	Confident	73.1	Confident	10 Å²	10	81.1 Å²	81.1	5%	0.051	41%	0.406	C	S	.	.	H	α-helix	trans	-64.2	-49.3	174.8	-70.5	174	0	0	0	110	A49 T50 K55 G56 T57 W124 F134 I137 L141	A49-I53 WeakPolarHBondContact O-CG1 3.44Å; A49-I53 PolarHBondContact O-N 2.89Å; A49-I53 VanDerWaalsContact O-N 3.11Å; T50-I53 WeakPolarHBondContact O-CB 3.26Å; T50-I53 PolarHBondContact O-N 3.4Å; I53-K55 VanDerWaalsContact C-N 3.28Å; I53-K55 PolarHBondContact O-N 2.89Å; I53-G56 PolarHBondContact O-N 2.98Å; I53-T57 WeakPolarHBondContact O-CB 3.41Å; I53-T57 PolarHBondContact O-N 2.89Å; I53-T57 PolarHBondContact O-OG1 3.47Å; I53-W124 HydrophobicContact CD1-CB 3.3Å; I53-W124 HydrophobicContact CD1-CD2 3.94Å; I53-W124 HydrophobicContact CD1-CE3 3.68Å; I53-W124 HydrophobicContact CD1-CG 3.86Å; I53-F134 HydrophobicContact CD1-CD1 3.84Å; I53-F134 HydrophobicContact CD1-CE1 4Å; I53-F134 HydrophobicContact CD1-CG 4.41Å; I53-F134 HydrophobicContact CG2-CD1 4.09Å; I53-F134 HydrophobicContact CG2-CE1 3.44Å; I53-F134 VanDerWaalsContact CG2-CE1 3.44Å; I53-F134 HydrophobicContact CG2-CZ 4.24Å; I53-I137 HydrophobicContact CB-CD1 4.5Å; I53-I137 HydrophobicContact CG1-CD1 4.16Å; I53-I137 HydrophobicContact CG2-CD1 3.82Å; I53-L141 HydrophobicContact CD1-CD2 3.89Å; I53-L141 HydrophobicContact CG1-CD2 3.41Å; I53-L141 VanDerWaalsContact CG1-CD2 3.41Å
54	E	76.5	Confident	70.9	Confident	108 Å²	108	86.7 Å²	86.7	51%	0.505	43%	0.427	S	S	.	.	H	α-helix	trans	-58.5	-39.4	179.2	-70.2	173.8	176.3	0	0	112.1	T50 T57	T50-E54 PolarHBondContact O-N 3.4Å; E54-T57 PolarHBondContact O-N 3.22Å
55	K	76.9	Confident	68.7	Low	165 Å²	165	85 Å²	85	72%	0.717	43%	0.425	S	S	*	.	H	α-helix	trans	-68	-31.8	174.9	-75.5	178.3	-179.7	-176.4	0	113.9	I51 I53	I51-K55 HydrophobicContact CG2-CD 4.24Å; I51-K55 WeakPolarHBondContact O-CB 3.4Å; I51-K55 VanDerWaalsContact O-CG 3.31Å; I51-K55 WeakPolarHBondContact O-CG 3.44Å; I51-K55 PolarHBondContact O-N 3.4Å; I51-K55 VanDerWaalsContact O-N 3.09Å; I53-K55 VanDerWaalsContact C-N 3.28Å; I53-K55 PolarHBondContact O-N 2.89Å
56	G	69.1	Low	66.4	Low	54 Å²	54	87.1 Å²	87.1	56%	0.557	44%	0.442	S	S	*	.	H	α-helix	trans	-83.9	-16.2	178.8	0	0	0	0	0	113.9	R52 I53	R52-G56 PolarHBondContact O-N 2.87Å; R52-G56 VanDerWaalsContact O-N 3.14Å; I53-G56 PolarHBondContact O-N 2.98Å
57	T	64.8	Low	64	Low	34 Å²	34	90.9 Å²	90.9	21%	0.209	47%	0.473	C	S	.	.	S	Bend	trans	-90.8	118.4	-176.3	-58.5	0	0	0	0	108.5	I53 E54 K59 S61 I62	I53-T57 WeakPolarHBondContact O-CB 3.41Å; I53-T57 PolarHBondContact O-N 2.89Å; I53-T57 PolarHBondContact O-OG1 3.47Å; E54-T57 PolarHBondContact O-N 3.22Å; T57-K59 PolarHBondContact O-N 3.34Å; T57-S61 WeakPolarHBondContact CG2-OG 3.35Å; T57-I62 HydrophobicContact CG2-CG1 3.85Å
58	P	58.1	Low	61.9	Low	91 Å²	91	89.5 Å²	89.5	59%	0.591	47%	0.474	S	S	*	.			trans	-54.8	135.5	177.9	-23.2	32.3	0	0	0	110.5	E60 S61	P58-E60 PolarHBondContact O-N 3.43Å; P58-S61 PolarHBondContact O-N 2.95Å; P58-S61 PolarHBondContact O-OG 2.91Å
59	K	55.5	Low	60.2	Low	181 Å²	181	91.4 Å²	91.4	79%	0.787	50%	0.496	S	S	*	.	H	α-helix	trans	-49.7	-31.2	-177.3	-77.2	-176.8	176.5	179.9	0	113.6	T57 S61 I62 L63	T57-K59 PolarHBondContact O-N 3.34Å; K59-S61 VanDerWaalsContact C-N 3.33Å; K59-S61 PolarHBondContact O-N 2.98Å; K59-I62 PolarHBondContact O-N 3.43Å; K59-L63 PolarHBondContact O-N 2.9Å; K59-L63 VanDerWaalsContact O-N 3.13Å
60	E	50.5	Low	59	Low	154 Å²	154	92.6 Å²	92.6	72%	0.72	51%	0.509	S	S	*	.	H	α-helix	trans	-62.2	-33.6	174.9	-74.9	-178.2	163.7	0	0	114	P58 K64	P58-E60 PolarHBondContact O-N 3.43Å; E60-K64 WeakPolarHBondContact O-CG 3.49Å; E60-K64 PolarHBondContact O-N 3.12Å
61	S	52.9	Low	58.2	Low	38 Å²	38	98 Å²	98	27%	0.266	54%	0.535	S	S	.	.	H	α-helix	trans	-78.5	-27.9	177.2	56.7	0	0	0	0	113.2	T57 P58 K59 K64 N65	T57-S61 WeakPolarHBondContact CG2-OG 3.35Å; P58-S61 PolarHBondContact O-N 2.95Å; P58-S61 PolarHBondContact O-OG 2.91Å; K59-S61 VanDerWaalsContact C-N 3.33Å; K59-S61 PolarHBondContact O-N 2.98Å; S61-K64 PolarHBondContact O-N 3.32Å; S61-N65 WeakPolarHBondContact O-CB 3.22Å; S61-N65 VanDerWaalsContact O-CG 3.3Å; S61-N65 PolarHBondContact O-N 3.31Å
62	I	49.5	Very low	57.7	Low	75 Å²	75	96.4 Å²	96.4	39%	0.385	53%	0.527	S	S	.	.	H	α-helix	trans	-67.1	-42.5	170.4	-57.8	177.1	0	0	0	109.9	T57 K59 N65 S66	T57-I62 HydrophobicContact CG2-CG1 3.85Å; K59-I62 PolarHBondContact O-N 3.43Å; I62-N65 PolarHBondContact O-N 3.44Å; I62-S66 WeakPolarHBondContact O-CB 3.3Å; I62-S66 PolarHBondContact O-N 3.36Å
63	L	47	Very low	57.4	Low	129 Å²	129	99.7 Å²	99.7	68%	0.675	55%	0.548	S	S	*	.	H	α-helix	trans	-63.5	-39.3	174.7	-102.6	145.2	0	0	0	112.4	K59 S66 A67	K59-L63 PolarHBondContact O-N 2.9Å; K59-L63 VanDerWaalsContact O-N 3.13Å; L63-S66 PolarHBondContact O-N 3.46Å; L63-A67 WeakPolarHBondContact O-CB 3.37Å; L63-A67 PolarHBondContact O-N 2.75Å
64	K	44.5	Very low	57.3	Low	157 Å²	157	104.3 Å²	104.3	68%	0.683	56%	0.564	S	S	*	*	H	α-helix	trans	-65	-40.3	173.6	-76.4	-178.3	179.7	178.8	0	113	E60 S61 A67 S68	E60-K64 WeakPolarHBondContact O-CG 3.49Å; E60-K64 PolarHBondContact O-N 3.12Å; S61-K64 PolarHBondContact O-N 3.32Å; K64-A67 PolarHBondContact O-N 3.37Å; K64-S68 PolarHBondContact O-N 2.91Å; K64-S68 VanDerWaalsContact O-N 3.11Å
65	N	42.9	Very low	57.1	Low	118 Å²	118	102.1 Å²	102.1	63%	0.631	56%	0.556	S	S	*	*	H	α-helix	trans	-75.9	-27.5	178.3	-69.2	-8.6	0	0	0	113.2	S61 I62 S68	S61-N65 WeakPolarHBondContact O-CB 3.22Å; S61-N65 VanDerWaalsContact O-CG 3.3Å; S61-N65 PolarHBondContact O-N 3.31Å; I62-N65 PolarHBondContact O-N 3.44Å; N65-S68 PolarHBondContact O-OG 2.94Å
66	S	39	Very low	56.9	Low	92 Å²	92	103 Å²	103	64%	0.643	56%	0.563	S	S	*	*	H	α-helix	trans	-80.6	-26.2	172.8	-173.1	0	0	0	0	112.4	I62 L63	I62-S66 WeakPolarHBondContact O-CB 3.3Å; I62-S66 PolarHBondContact O-N 3.36Å; L63-S66 PolarHBondContact O-N 3.46Å
67	A	38.9	Very low	57.1	Low	80 Å²	80	101.8 Å²	101.8	66%	0.661	55%	0.546	S	S	*	.	H	α-helix	trans	-83.4	-17	175.9	0	0	0	0	0	113.1	L63 K64 V69	L63-A67 WeakPolarHBondContact O-CB 3.37Å; L63-A67 PolarHBondContact O-N 2.75Å; K64-A67 PolarHBondContact O-N 3.37Å; A67-V69 PolarHBondContact O-N 3.46Å
68	S	42.8	Very low	57.3	Low	69 Å²	69	104.1 Å²	104.1	48%	0.483	56%	0.562	S	S	.	*			trans	-78	70.7	172.1	62.9	0	0	0	0	110.8	K64 N65 G70	K64-S68 PolarHBondContact O-N 2.91Å; K64-S68 VanDerWaalsContact O-N 3.11Å; N65-S68 PolarHBondContact O-OG 2.94Å; S68-G70 PolarHBondContact O-N 3.3Å
69	V	51.9	Low	57.9	Low	140 Å²	140	102.7 Å²	102.7	85%	0.848	55%	0.548	S	S	*	.	S	Bend	trans	-77.9	-3.7	164.5	-176.5	0	0	0	0	110.8	A67	A67-V69 PolarHBondContact O-N 3.46Å
70	G	57	Low	58.5	Low	25 Å²	25	100.5 Å²	100.5	26%	0.258	54%	0.54	S	S	.	.			trans	-161	151.1	160.7	0	0	0	0	0	111.9	S68 I72 E109	S68-G70 PolarHBondContact O-N 3.3Å; G70-I72 PolarHBondContact O-N 3.43Å; G70-E109 WeakPolarHBondContact CA-OE2 3.35Å
71	I	65.4	Low	59.5	Low	135 Å²	135	100.2 Å²	100.2	69%	0.692	54%	0.537	S	S	*	.	S	Bend	trans	-59.6	-26.6	173.5	-70.8	161.3	0	0	0	111	V108 E109	I71-V108 HydrophobicContact CB-CG1 4.36Å; I71-V108 HydrophobicContact CG2-CG1 4.47Å; I71-E109 WeakPolarHBondContact CB-OE1 3.34Å; I71-E109 HydrophobicContact CD1-CG 4.15Å; I71-E109 WeakPolarHBondContact CD1-OE1 3.36Å; I71-E109 WeakPolarHBondContact CG1-OE1 3.29Å; I71-E109 VanDerWaalsContact N-CD 3.29Å; I71-E109 PolarHBondContact N-OE1 2.85Å; I71-E109 PolarHBondContact N-OE2 3.48Å
72	I	73.1	Confident	60.2	Low	52 Å²	52	99.4 Å²	99.4	27%	0.267	53%	0.534	S	S	.	.	S	Bend	trans	-130.2	144.2	-176.7	55.9	167.2	0	0	0	112.1	G70 R74 E105 V108	G70-I72 PolarHBondContact O-N 3.43Å; I72-R74 HydrophobicContact CD1-CG 4.13Å; I72-R74 HydrophobicContact CG1-CG 4.3Å; I72-R74 PolarHBondContact O-N 2.69Å; I72-E105 HydrophobicContact CD1-CB 4.2Å; I72-E105 HydrophobicContact CD1-CG 4.04Å; I72-V108 HydrophobicContact CD1-CB 3.74Å; I72-V108 HydrophobicContact CD1-CG1 3.82Å; I72-V108 HydrophobicContact CG1-CB 4.37Å; I72-V108 HydrophobicContact CG1-CG1 3.87Å; I72-V108 HydrophobicContact CG2-CG1 4.19Å
73	Q	72.9	Confident	60.9	Low	187 Å²	187	96 Å²	96	87%	0.874	52%	0.517	S	S	*	.			trans	-80.9	113.3	165.2	-173.9	177.3	9.7	0	0	108.6
74	R	75	Confident	61.9	Low	106 Å²	106	93.2 Å²	93.2	40%	0.4	51%	0.508	S	S	.	.			trans	-82.8	136.6	178.4	-64.9	-174.3	178.6	95.7	-5.9	110.6	I72 E105 V108 E109	I72-R74 HydrophobicContact CD1-CG 4.13Å; I72-R74 HydrophobicContact CG1-CG 4.3Å; I72-R74 PolarHBondContact O-N 2.69Å; R74-E105 PolarHBondContact NE-O 3.18Å; R74-V108 PolarHBondContact NH2-O 3.43Å; R74-E109 PolarHBondContact NH2-O 2.85Å; R74-E109 VanDerWaalsContact NH2-O 3.16Å; R74-E109 IonicContact NH2-OE2 2.76Å
75	D	72	Confident	62.9	Low	62 Å²	62	88.3 Å²	88.3	33%	0.332	50%	0.502	S	S	.	.			trans	-87.3	107	169.6	179.8	-1.4	0	0	0	109.8	S77 K101 K102 E105	D75-S77 PolarHBondContact O-N 2.95Å; D75-S77 WeakPolarHBondContact OD1-CB 3.32Å; D75-S77 PolarHBondContact OD1-N 3.04Å; D75-S77 PolarHBondContact OD1-OG 3.32Å; D75-S77 PolarHBondContact OD2-OG 2.93Å; D75-K101 IonicContact OD2-NZ 2.84Å; D75-K102 PolarHBondContact O-NZ 3.33Å; D75-E105 PolarHBondContact N-OE1 3.11Å; D75-E105 VanDerWaalsContact N-OE1 3.12Å
76	E	72.2	Confident	63.8	Low	184 Å²	184	84.3 Å²	84.3	86%	0.86	48%	0.481	S	S	*	.			trans	-80.4	5.1	-179.9	-64	-174.2	173	0	0	113.6
77	S	73.5	Confident	64.9	Low	28 Å²	28	85.5 Å²	85.5	20%	0.196	47%	0.471	C	S	.	.			trans	-58.9	136.1	179.5	60	0	0	0	0	111.7	D75 M79	D75-S77 PolarHBondContact O-N 2.95Å; D75-S77 WeakPolarHBondContact OD1-CB 3.32Å; D75-S77 PolarHBondContact OD1-N 3.04Å; D75-S77 PolarHBondContact OD1-OG 3.32Å; D75-S77 PolarHBondContact OD2-OG 2.93Å; S77-M79 PolarHBondContact O-N 3.01Å
78	P	69.2	Low	66.1	Low	84 Å²	84	85.5 Å²	85.5	55%	0.545	48%	0.479	S	S	.	.			trans	-54.4	142.7	174.3	-24.7	32.7	0	0	0	110.3	E80 K81 G82	P78-E80 PolarHBondContact O-N 3.14Å; P78-E80 VanDerWaalsContact O-N 3.07Å; P78-K81 WeakPolarHBondContact O-CB 3.44Å; P78-K81 PolarHBondContact O-N 2.86Å; P78-G82 PolarHBondContact O-N 3.42Å
79	M	70.5	Confident	67.3	Low	60 Å²	60	90.6 Å²	90.6	30%	0.296	49%	0.487	S	S	.	.	H	α-helix	trans	-52	-37.6	179.5	178.8	179.7	72.7	0	0	112.2	S77 K81 G82 L83 Y98 N422	S77-M79 PolarHBondContact O-N 3.01Å; M79-K81 VanDerWaalsContact C-N 3.27Å; M79-K81 PolarHBondContact O-N 3.32Å; M79-G82 PolarHBondContact O-N 2.77Å; M79-G82 VanDerWaalsContact O-N 3.12Å; M79-L83 HydrophobicContact CG-CD1 3.61Å; M79-L83 HydrophobicContact CG-CD2 4.43Å; M79-L83 WeakPolarHBondContact O-CB 3.21Å; M79-L83 VanDerWaalsContact O-CD1 3.28Å; M79-L83 WeakPolarHBondContact O-CD1 3.37Å; M79-L83 PolarHBondContact O-N 3.45Å; M79-Y98 WeakPolarHBondContact CA-OH 3.4Å; M79-Y98 HydrophobicContact CG-CE1 4.27Å; M79-N422 HydrophobicContact CE-CB 3.58Å; M79-N422 HydrophobicContact SD-CB 3.8Å
80	E	68.1	Low	68.4	Low	135 Å²	135	91.1 Å²	91.1	63%	0.631	49%	0.486	S	S	*	.	H	α-helix	trans	-58.3	-34.4	176.7	-60.2	-175.8	158.9	0	0	114.1	P78 L83 S84	P78-E80 PolarHBondContact O-N 3.14Å; P78-E80 VanDerWaalsContact O-N 3.07Å; E80-L83 PolarHBondContact O-N 3.1Å; E80-S84 WeakPolarHBondContact O-CB 3.44Å; E80-S84 PolarHBondContact O-N 3.18Å
81	K	70.4	Confident	69.3	Low	148 Å²	148	95.1 Å²	95.1	64%	0.643	50%	0.496	S	S	*	.	H	α-helix	trans	-75.7	-35.4	177.1	-169.5	-179.4	179.9	-176.6	0	111.6	P78 M79 L83 S84	P78-K81 WeakPolarHBondContact O-CB 3.44Å; P78-K81 PolarHBondContact O-N 2.86Å; M79-K81 VanDerWaalsContact C-N 3.27Å; M79-K81 PolarHBondContact O-N 3.32Å; K81-L83 VanDerWaalsContact C-N 3.35Å; K81-S84 PolarHBondContact O-OG 3.39Å
82	G	67.6	Low	69.9	Low	21 Å²	21	93.2 Å²	93.2	22%	0.216	48%	0.484	C	S	.	.	H	α-helix	trans	-63.2	-43.8	169.1	0	0	0	0	0	111.4	P78 M79	P78-G82 PolarHBondContact O-N 3.42Å; M79-G82 PolarHBondContact O-N 2.77Å; M79-G82 VanDerWaalsContact O-N 3.12Å
83	L	66.1	Low	70.3	Confident	5 Å²	5	97.5 Å²	97.5	3%	0.026	51%	0.507	C	S	.	.	H	α-helix	trans	-75.4	-24.9	-179.6	-91.2	64.7	0	0	0	113.7	M79 E80 K81 G85 L86 R87 Y98 F99 M426	M79-L83 HydrophobicContact CG-CD1 3.61Å; M79-L83 HydrophobicContact CG-CD2 4.43Å; M79-L83 WeakPolarHBondContact O-CB 3.21Å; M79-L83 VanDerWaalsContact O-CD1 3.28Å; M79-L83 WeakPolarHBondContact O-CD1 3.37Å; M79-L83 PolarHBondContact O-N 3.45Å; E80-L83 PolarHBondContact O-N 3.1Å; K81-L83 VanDerWaalsContact C-N 3.35Å; L83-G85 PolarHBondContact O-N 3.37Å; L83-L86 WeakPolarHBondContact O-CA 3.44Å; L83-L86 WeakPolarHBondContact O-CB 3.29Å; L83-L86 PolarHBondContact O-N 2.97Å; L83-R87 WeakPolarHBondContact O-CG 3.42Å; L83-R87 PolarHBondContact O-N 3.2Å; L83-R87 VanDerWaalsContact O-N 3.07Å; L83-Y98 HydrophobicContact CD1-CD1 4.15Å; L83-Y98 HydrophobicContact CD1-CE1 3.72Å; L83-F99 HydrophobicContact CD1-CZ 4.4Å; L83-M426 HydrophobicContact CD2-CB 4.09Å; L83-M426 HydrophobicContact CG-CB 4.18Å; L83-M426 HydrophobicContact CG-CG 4.23Å
84	S	66.8	Low	70.7	Confident	69 Å²	69	91 Å²	91	48%	0.483	48%	0.482	S	S	.	.	H	α-helix	trans	-62.9	-30.8	-176.6	57	0	0	0	0	112.9	E80 K81 L86	E80-S84 WeakPolarHBondContact O-CB 3.44Å; E80-S84 PolarHBondContact O-N 3.18Å; K81-S84 PolarHBondContact O-OG 3.39Å; S84-L86 PolarHBondContact O-N 3.48Å
85	G	65.3	Low	70.8	Confident	55 Å²	55	86.9 Å²	86.9	57%	0.567	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-12.8	173.8	0	0	0	0	0	114.3	L83	L83-G85 PolarHBondContact O-N 3.37Å
86	L	62.2	Low	71.2	Confident	33 Å²	33	86.3 Å²	86.3	17%	0.173	47%	0.467	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-22.9	-177	-65.9	158.8	0	0	0	112.3	L83 S84 G88 D95 M426	L83-L86 WeakPolarHBondContact O-CA 3.44Å; L83-L86 WeakPolarHBondContact O-CB 3.29Å; L83-L86 PolarHBondContact O-N 2.97Å; S84-L86 PolarHBondContact O-N 3.48Å; L86-G88 PolarHBondContact O-N 2.96Å; L86-D95 HydrophobicContact CD2-CB 4.24Å; L86-D95 WeakPolarHBondContact CD2-OD1 3.31Å; L86-M426 HydrophobicContact CB-CG 4.02Å; L86-M426 HydrophobicContact CB-SD 4.37Å; L86-M426 HydrophobicContact CD1-CG 4.16Å; L86-M426 HydrophobicContact CD1-SD 3.49Å; L86-M426 WeakPolarHBondContact CD1-SD 3.5Å; L86-M426 HydrophobicContact CG-SD 4.36Å
87	R	61.9	Low	71.8	Confident	118 Å²	118	84.8 Å²	84.8	45%	0.445	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	124.1	-177.8	-77.7	178.5	179.7	175.4	3.4	111.7	L83	L83-R87 WeakPolarHBondContact O-CG 3.42Å; L83-R87 PolarHBondContact O-N 3.2Å; L83-R87 VanDerWaalsContact O-N 3.07Å
88	G	65.1	Low	72.1	Confident	80 Å²	80	85.2 Å²	85.2	83%	0.825	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	90	7.1	172.9	0	0	0	0	0	115.3	L86	L86-G88 PolarHBondContact O-N 2.96Å
89	R	66.9	Low	72.7	Confident	175 Å²	175	83.1 Å²	83.1	66%	0.66	44%	0.438	S	S	*	.	S	Bend	trans	-98.6	154.7	170.9	-63	-179.1	122.4	-165.7	-5.1	109.9
90	D	75.6	Confident	73.4	Confident	151 Å²	151	82.8 Å²	82.8	81%	0.807	44%	0.441	S	S	*	.	P	Polyproline II helix	trans	-59.4	146.5	166.9	-69.5	-35.1	0	0	0	109.4	E92	D90-E92 PolarHBondContact O-N 3.08Å
91	F	75.1	Confident	74.3	Confident	110 Å²	110	80.9 Å²	80.9	48%	0.482	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-56.6	125.2	178.6	169.5	-99.6	0	0	0	111.2	I427	F91-I427 HydrophobicContact CD2-CG1 4.27Å; F91-I427 HydrophobicContact CE2-CD1 4.48Å
92	E	79.5	Confident	74.9	Confident	95 Å²	95	76 Å²	76	44%	0.444	41%	0.409	S	S	.	.			trans	-111.1	142.9	170.8	-67.8	-176	-174.4	0	0	110.2	D90 S94 D95	D90-E92 PolarHBondContact O-N 3.08Å; E92-S94 VanDerWaalsContact CB-OG 3.24Å; E92-S94 WeakPolarHBondContact CB-OG 3.22Å; E92-S94 PolarHBondContact O-N 2.67Å; E92-S94 VanDerWaalsContact O-N 3.07Å; E92-S94 PolarHBondContact OE2-OG 2.95Å; E92-D95 PolarHBondContact N-OD2 3.07Å; E92-D95 VanDerWaalsContact O-CB 3.27Å; E92-D95 WeakPolarHBondContact O-CB 3.35Å; E92-D95 PolarHBondContact O-N 3Å
93	L	80.7	Confident	75.8	Confident	141 Å²	141	76.6 Å²	76.6	74%	0.738	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-59.6	-24.8	177.9	-171	65.4	0	0	0	112.6	D95 V96	L93-D95 PolarHBondContact O-N 2.81Å; L93-V96 PolarHBondContact O-N 3.17Å
94	S	82.1	Confident	76.8	Confident	50 Å²	50	81.5 Å²	81.5	35%	0.35	44%	0.441	S	S	.	.	G	3₁₀ helix	trans	-61.7	-25.7	175.1	52.8	0	0	0	0	113	E92 V96 F97	E92-S94 VanDerWaalsContact CB-OG 3.24Å; E92-S94 WeakPolarHBondContact CB-OG 3.22Å; E92-S94 PolarHBondContact O-N 2.67Å; E92-S94 VanDerWaalsContact O-N 3.07Å; E92-S94 PolarHBondContact OE2-OG 2.95Å; S94-V96 PolarHBondContact O-N 3.27Å; S94-F97 VanDerWaalsContact O-CB 3.27Å; S94-F97 WeakPolarHBondContact O-CB 3.05Å; S94-F97 WeakPolarHBondContact O-CD2 3.26Å; S94-F97 PolarHBondContact O-N 2.99Å
95	D	75.7	Confident	77.7	Confident	21 Å²	21	79.2 Å²	79.2	11%	0.112	42%	0.423	C	S	.	.	G	3₁₀ helix	trans	-62.8	-28.9	-177.4	-59	-20.3	0	0	0	112.1	L86 E92 L93 F97 Y98 M426	L86-D95 HydrophobicContact CD2-CB 4.24Å; L86-D95 WeakPolarHBondContact CD2-OD1 3.31Å; E92-D95 PolarHBondContact N-OD2 3.07Å; E92-D95 VanDerWaalsContact O-CB 3.27Å; E92-D95 WeakPolarHBondContact O-CB 3.35Å; E92-D95 PolarHBondContact O-N 3Å; L93-D95 PolarHBondContact O-N 2.81Å; D95-F97 PolarHBondContact O-N 3.24Å; D95-Y98 PolarHBondContact O-N 3.45Å; D95-M426 HydrophobicContact CB-CE 3.6Å; D95-M426 HydrophobicContact CB-SD 4.13Å
96	V	80.3	Confident	78.5	Confident	50 Å²	50	79.9 Å²	79.9	30%	0.303	42%	0.423	S	S	.	.	H	α-helix	trans	-63	-27.3	175.1	-179.7	0	0	0	0	111.7	L93 S94 Y98 F99 S100	L93-V96 PolarHBondContact O-N 3.17Å; S94-V96 PolarHBondContact O-N 3.27Å; V96-Y98 VanDerWaalsContact C-N 3.28Å; V96-Y98 PolarHBondContact O-N 2.6Å; V96-F99 PolarHBondContact O-N 3.47Å; V96-S100 WeakPolarHBondContact O-CB 3.16Å; V96-S100 PolarHBondContact O-N 3.48Å; V96-S100 PolarHBondContact O-OG 2.93Å
97	F	84.7	Confident	79.5	Confident	151 Å²	151	84.2 Å²	84.2	66%	0.662	45%	0.445	S	S	*	.	H	α-helix	trans	-66.1	-29.8	179.8	-67.4	-47	0	0	0	112.9	S94 D95 S100 K101	S94-F97 VanDerWaalsContact O-CB 3.27Å; S94-F97 WeakPolarHBondContact O-CB 3.05Å; S94-F97 WeakPolarHBondContact O-CD2 3.26Å; S94-F97 PolarHBondContact O-N 2.99Å; D95-F97 PolarHBondContact O-N 3.24Å; F97-S100 PolarHBondContact O-N 3.34Å; F97-K101 WeakPolarHBondContact O-CB 3.31Å; F97-K101 PolarHBondContact O-N 3.12Å
98	Y	81.2	Confident	80.4	Confident	37 Å²	37	80.6 Å²	80.6	15%	0.145	44%	0.436	C	S	.	.	H	α-helix	trans	-59.5	-51	174.6	175.3	-96.8	0	0	0	110.9	M79 L83 D95 V96 K101 K102	M79-Y98 WeakPolarHBondContact CA-OH 3.4Å; M79-Y98 HydrophobicContact CG-CE1 4.27Å; L83-Y98 HydrophobicContact CD1-CD1 4.15Å; L83-Y98 HydrophobicContact CD1-CE1 3.72Å; D95-Y98 PolarHBondContact O-N 3.45Å; V96-Y98 VanDerWaalsContact C-N 3.28Å; V96-Y98 PolarHBondContact O-N 2.6Å; Y98-K101 PolarHBondContact O-N 3.35Å; Y98-K102 HydrophobicContact CD1-CG 4.41Å; Y98-K102 HydrophobicContact CE1-CG 3.92Å; Y98-K102 HydrophobicContact CE2-CG 4.13Å; Y98-K102 WeakPolarHBondContact O-CB 3.29Å; Y98-K102 WeakPolarHBondContact O-CG 3.39Å; Y98-K102 PolarHBondContact O-N 3.31Å
99	F	80.6	Confident	80.9	Confident	41 Å²	41	79.2 Å²	79.2	18%	0.18	41%	0.408	C	S	.	.	H	α-helix	trans	-69.7	-36.2	179.1	-72.3	-86.4	0	0	0	112.7	L83 V96 K102 G103 Y423 M426	L83-F99 HydrophobicContact CD1-CZ 4.4Å; V96-F99 PolarHBondContact O-N 3.47Å; F99-K102 PolarHBondContact O-N 3.32Å; F99-G103 PolarHBondContact O-N 3.45Å; F99-Y423 AromaticContact CD1-CD2 3.98Å; F99-Y423 HydrophobicContact CD1-CD2 3.98Å; F99-Y423 AromaticContact CD2-CD2 3.31Å; F99-Y423 HydrophobicContact CD2-CD2 3.31Å; F99-Y423 AromaticContact CD2-CE2 3.53Å; F99-Y423 HydrophobicContact CD2-CE2 3.53Å; F99-Y423 AromaticContact CE1-CD2 3.98Å; F99-Y423 HydrophobicContact CE1-CD2 3.98Å; F99-Y423 AromaticContact CE2-CD2 3.29Å; F99-Y423 HydrophobicContact CE2-CD2 3.29Å; F99-Y423 AromaticContact CE2-CE2 3.8Å; F99-Y423 HydrophobicContact CE2-CE2 3.8Å; F99-Y423 HydrophobicContact CE2-CG 4.3Å; F99-Y423 AromaticContact CG-CD2 3.66Å; F99-Y423 HydrophobicContact CG-CD2 3.66Å; F99-Y423 HydrophobicContact CG-CE2 4.1Å; F99-Y423 AromaticContact CZ-CD2 3.64Å; F99-Y423 HydrophobicContact CZ-CD2 3.64Å; F99-Y423 HydrophobicContact CZ-CG 4.31Å; F99-M426 HydrophobicContact CD2-CE 4.27Å; F99-M426 HydrophobicContact CD2-SD 4.42Å; F99-M426 HydrophobicContact CE2-CE 3.74Å; F99-M426 HydrophobicContact CE2-SD 3.61Å
100	S	85.8	Confident	81.7	Confident	53 Å²	53	72.6 Å²	72.6	37%	0.371	39%	0.386	S	S	.	.	H	α-helix	trans	-62.2	-46.1	174.5	-54.9	0	0	0	0	110.6	V96 F97 G103 L104	V96-S100 WeakPolarHBondContact O-CB 3.16Å; V96-S100 PolarHBondContact O-N 3.48Å; V96-S100 PolarHBondContact O-OG 2.93Å; F97-S100 PolarHBondContact O-N 3.34Å; S100-G103 PolarHBondContact O-N 3.4Å; S100-L104 WeakPolarHBondContact O-CB 3.25Å; S100-L104 VanDerWaalsContact O-CG 3.23Å; S100-L104 WeakPolarHBondContact O-CG 3.05Å; S100-L104 PolarHBondContact O-N 3.49Å
101	K	86.4	Confident	82.1	Confident	94 Å²	94	70.3 Å²	70.3	41%	0.409	37%	0.371	S	S	.	.	H	α-helix	trans	-59.5	-51.7	173.9	178.9	-173.8	170.9	-171	0	110.8	D75 F97 Y98 G103 L104 E105	D75-K101 IonicContact OD2-NZ 2.84Å; F97-K101 WeakPolarHBondContact O-CB 3.31Å; F97-K101 PolarHBondContact O-N 3.12Å; Y98-K101 PolarHBondContact O-N 3.35Å; K101-G103 VanDerWaalsContact C-N 3.35Å; K101-G103 PolarHBondContact O-N 2.92Å; K101-L104 PolarHBondContact O-N 3.22Å; K101-E105 WeakPolarHBondContact CE-OE1 3.48Å; K101-E105 HydrophobicContact CG-CG 4.36Å; K101-E105 IonicContact NZ-OE1 3.73Å; K101-E105 WeakPolarHBondContact O-CB 3.37Å; K101-E105 WeakPolarHBondContact O-CG 3.34Å; K101-E105 PolarHBondContact O-N 3.43Å
102	K	84.4	Confident	82.6	Confident	46 Å²	46	66 Å²	66	20%	0.2	35%	0.353	C	S	.	.	H	α-helix	trans	-62	-40	-179.9	-73.5	-73.3	164.1	-146.6	0	112.9	D75 Y98 F99 E105 A106	D75-K102 PolarHBondContact O-NZ 3.33Å; Y98-K102 HydrophobicContact CD1-CG 4.41Å; Y98-K102 HydrophobicContact CE1-CG 3.92Å; Y98-K102 HydrophobicContact CE2-CG 4.13Å; Y98-K102 WeakPolarHBondContact O-CB 3.29Å; Y98-K102 WeakPolarHBondContact O-CG 3.39Å; Y98-K102 PolarHBondContact O-N 3.31Å; F99-K102 PolarHBondContact O-N 3.32Å; K102-E105 WeakPolarHBondContact CD-OE2 3.42Å; K102-E105 WeakPolarHBondContact CE-OE2 3.33Å; K102-E105 IonicContact NZ-OE2 3.87Å; K102-E105 PolarHBondContact NZ-OE2 2.86Å; K102-E105 PolarHBondContact O-N 3.42Å; K102-A106 WeakPolarHBondContact O-CB 3.45Å; K102-A106 PolarHBondContact O-N 3.24Å
103	G	85.9	Confident	82.9	Confident	33 Å²	33	64.7 Å²	64.7	34%	0.34	35%	0.352	S	S	.	.	H	α-helix	trans	-63.3	-43.8	174.8	0	0	0	0	0	111.8	F99 S100 K101 A106 I107	F99-G103 PolarHBondContact O-N 3.45Å; S100-G103 PolarHBondContact O-N 3.4Å; K101-G103 VanDerWaalsContact C-N 3.35Å; K101-G103 PolarHBondContact O-N 2.92Å; G103-A106 PolarHBondContact O-N 3.35Å; G103-I107 WeakPolarHBondContact O-CD1 3.49Å; G103-I107 VanDerWaalsContact O-CG1 3.24Å; G103-I107 WeakPolarHBondContact O-CG1 3.35Å; G103-I107 PolarHBondContact O-N 3.38Å; G103-I107 VanDerWaalsContact O-N 3.13Å
104	L	87.4	Confident	83.1	Confident	109 Å²	109	61.7 Å²	61.7	57%	0.571	33%	0.334	S	S	*	.	H	α-helix	trans	-64.1	-44.2	173.4	-70.7	169.5	0	0	0	111.7	S100 K101 A106 I107 V108	S100-L104 WeakPolarHBondContact O-CB 3.25Å; S100-L104 VanDerWaalsContact O-CG 3.23Å; S100-L104 WeakPolarHBondContact O-CG 3.05Å; S100-L104 PolarHBondContact O-N 3.49Å; K101-L104 PolarHBondContact O-N 3.22Å; L104-A106 PolarHBondContact O-N 3.03Å; L104-I107 PolarHBondContact O-N 3.32Å; L104-I107 VanDerWaalsContact O-N 3.16Å; L104-V108 WeakPolarHBondContact O-CB 3.37Å; L104-V108 VanDerWaalsContact O-CG2 3.27Å; L104-V108 WeakPolarHBondContact O-CG2 3.12Å; L104-V108 PolarHBondContact O-N 3.42Å
105	E	85.6	Confident	83.4	Confident	20 Å²	20	61.7 Å²	61.7	9%	0.093	33%	0.326	C	S	.	.	H	α-helix	trans	-59.2	-33.7	176.4	-74.2	178.8	158.3	0	0	112.9	I72 R74 D75 K101 K102	I72-E105 HydrophobicContact CD1-CB 4.2Å; I72-E105 HydrophobicContact CD1-CG 4.04Å; R74-E105 PolarHBondContact NE-O 3.18Å; D75-E105 PolarHBondContact N-OE1 3.11Å; D75-E105 VanDerWaalsContact N-OE1 3.12Å; K101-E105 WeakPolarHBondContact CE-OE1 3.48Å; K101-E105 HydrophobicContact CG-CG 4.36Å; K101-E105 IonicContact NZ-OE1 3.73Å; K101-E105 WeakPolarHBondContact O-CB 3.37Å; K101-E105 WeakPolarHBondContact O-CG 3.34Å; K101-E105 PolarHBondContact O-N 3.43Å; K102-E105 WeakPolarHBondContact CD-OE2 3.42Å; K102-E105 WeakPolarHBondContact CE-OE2 3.33Å; K102-E105 IonicContact NZ-OE2 3.87Å; K102-E105 PolarHBondContact NZ-OE2 2.86Å; K102-E105 PolarHBondContact O-N 3.42Å
106	A	80.8	Confident	84	Confident	70 Å²	70	61.1 Å²	61.1	58%	0.579	32%	0.323	S	S	*	.	H	α-helix	trans	-79.1	-25.4	178.4	0	0	0	0	0	113.6	K102 G103 L104 D110	K102-A106 WeakPolarHBondContact O-CB 3.45Å; K102-A106 PolarHBondContact O-N 3.24Å; G103-A106 PolarHBondContact O-N 3.35Å; L104-A106 PolarHBondContact O-N 3.03Å; A106-D110 WeakPolarHBondContact O-CB 3.46Å
107	I	83	Confident	84.3	Confident	124 Å²	124	61.2 Å²	61.2	64%	0.636	33%	0.325	S	S	*	.	H	α-helix	trans	-89.8	-42.1	179.2	-67.2	165.5	0	0	0	111	G103 L104 E109	G103-I107 WeakPolarHBondContact O-CD1 3.49Å; G103-I107 VanDerWaalsContact O-CG1 3.24Å; G103-I107 WeakPolarHBondContact O-CG1 3.35Å; G103-I107 PolarHBondContact O-N 3.38Å; G103-I107 VanDerWaalsContact O-N 3.13Å; L104-I107 PolarHBondContact O-N 3.32Å; L104-I107 VanDerWaalsContact O-N 3.16Å; I107-E109 PolarHBondContact O-N 3.41Å
108	V	82.7	Confident	84.2	Confident	42 Å²	42	55.7 Å²	55.7	26%	0.255	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	124.7	-178.2	174.3	0	0	0	0	108.8	I71 I72 R74 L104 D110	I71-V108 HydrophobicContact CB-CG1 4.36Å; I71-V108 HydrophobicContact CG2-CG1 4.47Å; I72-V108 HydrophobicContact CD1-CB 3.74Å; I72-V108 HydrophobicContact CD1-CG1 3.82Å; I72-V108 HydrophobicContact CG1-CB 4.37Å; I72-V108 HydrophobicContact CG1-CG1 3.87Å; I72-V108 HydrophobicContact CG2-CG1 4.19Å; R74-V108 PolarHBondContact NH2-O 3.43Å; L104-V108 WeakPolarHBondContact O-CB 3.37Å; L104-V108 VanDerWaalsContact O-CG2 3.27Å; L104-V108 WeakPolarHBondContact O-CG2 3.12Å; L104-V108 PolarHBondContact O-N 3.42Å; V108-D110 VanDerWaalsContact C-N 3.26Å; V108-D110 PolarHBondContact O-N 3.33Å
109	E	74.8	Confident	84.2	Confident	51 Å²	51	57.1 Å²	57.1	24%	0.238	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.7	39.3	178.4	-61.8	174.3	158.7	0	0	114	G70 I71 R74 I107	G70-E109 WeakPolarHBondContact CA-OE2 3.35Å; I71-E109 WeakPolarHBondContact CB-OE1 3.34Å; I71-E109 HydrophobicContact CD1-CG 4.15Å; I71-E109 WeakPolarHBondContact CD1-OE1 3.36Å; I71-E109 WeakPolarHBondContact CG1-OE1 3.29Å; I71-E109 VanDerWaalsContact N-CD 3.29Å; I71-E109 PolarHBondContact N-OE1 2.85Å; I71-E109 PolarHBondContact N-OE2 3.48Å; R74-E109 PolarHBondContact NH2-O 2.85Å; R74-E109 VanDerWaalsContact NH2-O 3.16Å; R74-E109 IonicContact NH2-OE2 2.76Å; I107-E109 PolarHBondContact O-N 3.41Å
110	D	83.6	Confident	83.8	Confident	36 Å²	36	63.3 Å²	63.3	19%	0.193	34%	0.343	C	S	.	.			trans	-63.4	152.4	175.1	82.7	91.2	0	0	0	112	A106 V108 V112 T113 Q114	A106-D110 WeakPolarHBondContact O-CB 3.46Å; V108-D110 VanDerWaalsContact C-N 3.26Å; V108-D110 PolarHBondContact O-N 3.33Å; D110-V112 PolarHBondContact O-N 2.93Å; D110-V112 WeakPolarHBondContact OD1-CA 3.49Å; D110-V112 WeakPolarHBondContact OD1-CB 3.28Å; D110-V112 PolarHBondContact OD1-N 3.44Å; D110-T113 PolarHBondContact OD1-N 2.9Å; D110-T113 PolarHBondContact OD1-OG1 3.43Å; D110-T113 WeakPolarHBondContact OD2-CB 3.3Å; D110-T113 PolarHBondContact OD2-OG1 3.35Å; D110-Q114 WeakPolarHBondContact O-CB 3.26Å; D110-Q114 VanDerWaalsContact O-CG 3.23Å; D110-Q114 WeakPolarHBondContact O-CG 3.1Å
111	E	83.5	Confident	83	Confident	103 Å²	103	61.6 Å²	61.6	48%	0.481	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-16.4	-174.2	-63.1	-174.4	158.5	0	0	114.2	R115 L400 W402	E111-R115 VanDerWaalsContact O-CG 3.23Å; E111-R115 WeakPolarHBondContact O-CG 3.46Å; E111-R115 PolarHBondContact O-NH1 2.91Å; E111-L400 HydrophobicContact CB-CD2 4.44Å; E111-W402 PolarHBondContact OE2-NE1 3.25Å
112	V	86.2	Confident	82.1	Confident	18 Å²	18	64 Å²	64	11%	0.109	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-59.7	-174.2	-178.8	0	0	0	0	110.7	D110 Q114 R115 F116 M313 W402 L406	D110-V112 PolarHBondContact O-N 2.93Å; D110-V112 WeakPolarHBondContact OD1-CA 3.49Å; D110-V112 WeakPolarHBondContact OD1-CB 3.28Å; D110-V112 PolarHBondContact OD1-N 3.44Å; V112-Q114 VanDerWaalsContact C-N 3.28Å; V112-Q114 PolarHBondContact O-N 2.95Å; V112-R115 WeakPolarHBondContact O-CB 3.23Å; V112-R115 PolarHBondContact O-N 2.76Å; V112-R115 VanDerWaalsContact O-N 3.08Å; V112-F116 HydrophobicContact CG1-CE2 3.97Å; V112-F116 WeakPolarHBondContact O-CD2 3.47Å; V112-M313 HydrophobicContact CG1-CE 4.18Å; V112-W402 HydrophobicContact CG2-CB 3.71Å; V112-W402 HydrophobicContact CG2-CD2 4.1Å; V112-W402 HydrophobicContact CG2-CG 3.55Å; V112-L406 HydrophobicContact CG1-CB 4.4Å
113	T	86	Confident	81.4	Confident	69 Å²	69	63.4 Å²	63.4	42%	0.423	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-63.5	-34.3	-172.7	-44.6	0	0	0	0	112	D110 R115 F116	D110-T113 PolarHBondContact OD1-N 2.9Å; D110-T113 PolarHBondContact OD1-OG1 3.43Å; D110-T113 WeakPolarHBondContact OD2-CB 3.3Å; D110-T113 PolarHBondContact OD2-OG1 3.35Å; T113-R115 PolarHBondContact O-N 3.29Å; T113-F116 PolarHBondContact O-N 3.09Å
114	Q	84.9	Confident	80.5	Confident	77 Å²	77	62.3 Å²	62.3	36%	0.36	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-59.1	-31.7	176.7	-72.6	-63.8	-16.5	0	0	112.9	D110 V112 F116 S117 N308	D110-Q114 WeakPolarHBondContact O-CB 3.26Å; D110-Q114 VanDerWaalsContact O-CG 3.23Å; D110-Q114 WeakPolarHBondContact O-CG 3.1Å; V112-Q114 VanDerWaalsContact C-N 3.28Å; V112-Q114 PolarHBondContact O-N 2.95Å; Q114-F116 PolarHBondContact O-N 2.85Å; Q114-S117 PolarHBondContact O-N 2.98Å; Q114-N308 PolarHBondContact O-ND2 3.43Å
115	R	88.9	Confident	80.1	Confident	51 Å²	51	57.1 Å²	57.1	19%	0.192	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-73.4	-10.1	178.5	-49.5	-59.6	117.3	85.5	-11.2	112.9	E111 V112 T113 I307 N308 T310 S311 M313 L400	E111-R115 VanDerWaalsContact O-CG 3.23Å; E111-R115 WeakPolarHBondContact O-CG 3.46Å; E111-R115 PolarHBondContact O-NH1 2.91Å; V112-R115 WeakPolarHBondContact O-CB 3.23Å; V112-R115 PolarHBondContact O-N 2.76Å; V112-R115 VanDerWaalsContact O-N 3.08Å; T113-R115 PolarHBondContact O-N 3.29Å; R115-I307 HydrophobicContact CB-CG2 3.83Å; R115-N308 WeakPolarHBondContact O-CB 3.45Å; R115-N308 VanDerWaalsContact O-CG 3.27Å; R115-N308 PolarHBondContact O-N 2.93Å; R115-N308 PolarHBondContact O-OD1 3.11Å; R115-T310 WeakPolarHBondContact CD-OG1 3.49Å; R115-S311 WeakPolarHBondContact CD-OG 3.46Å; R115-S311 WeakPolarHBondContact CG-OG 3Å; R115-M313 HydrophobicContact CG-SD 4.49Å; R115-L400 HydrophobicContact CG-CD1 3.68Å
116	F	88.4	Confident	79.6	Confident	8 Å²	8	56.3 Å²	56.3	4%	0.035	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-103.9	13.9	174.2	-62.8	-84.3	0	0	0	113.8	V112 T113 Q114 T305 I307 M313 F341 N343 G404 K407	V112-F116 HydrophobicContact CG1-CE2 3.97Å; V112-F116 WeakPolarHBondContact O-CD2 3.47Å; T113-F116 PolarHBondContact O-N 3.09Å; Q114-F116 PolarHBondContact O-N 2.85Å; F116-T305 HydrophobicContact CE1-CG2 3.93Å; F116-T305 HydrophobicContact CZ-CG2 4.11Å; F116-I307 HydrophobicContact CD1-CD1 4.01Å; F116-I307 HydrophobicContact CE1-CD1 3.41Å; F116-I307 VanDerWaalsContact CE1-CD1 3.41Å; F116-I307 HydrophobicContact CE2-CD1 4.08Å; F116-I307 HydrophobicContact CZ-CD1 3.44Å; F116-I307 VanDerWaalsContact CZ-CD1 3.44Å; F116-M313 HydrophobicContact CE2-CE 4.49Å; F116-F341 VanDerWaalsContact C-CE1 3.44Å; F116-F341 HydrophobicContact CB-CZ 4.47Å; F116-F341 VanDerWaalsContact O-CE1 3.27Å; F116-F341 WeakPolarHBondContact O-CE1 3.49Å; F116-F341 WeakPolarHBondContact O-CZ 3.23Å; F116-N343 PolarHBondContact O-ND2 3.02Å; F116-N343 VanDerWaalsContact O-ND2 3.11Å; F116-G404 VanDerWaalsContact CZ-O 3.3Å; F116-G404 WeakPolarHBondContact CZ-O 3.2Å; F116-K407 HydrophobicContact CB-CD 3.97Å; F116-K407 HydrophobicContact CD1-CD 3.7Å; F116-K407 HydrophobicContact CD2-CB 4.27Å; F116-K407 HydrophobicContact CD2-CD 3.81Å; F116-K407 HydrophobicContact CD2-CG 4.3Å; F116-K407 HydrophobicContact CE1-CD 4.04Å; F116-K407 HydrophobicContact CE2-CB 3.93Å; F116-K407 HydrophobicContact CE2-CD 4.18Å; F116-K407 HydrophobicContact CE2-CG 4.46Å; F116-K407 HydrophobicContact CG-CD 3.56Å; F116-K407 HydrophobicContact CZ-CB 4.14Å; F116-K407 HydrophobicContact CZ-CD 4.28Å
117	S	86	Confident	79.2	Confident	52 Å²	52	53.1 Å²	53.1	36%	0.364	28%	0.281	S	S	.	.	S	Bend	trans	-115.8	149.8	170.5	-68.8	0	0	0	0	109.4	Q114 E119 N308	Q114-S117 PolarHBondContact O-N 2.98Å; S117-E119 PolarHBondContact O-N 2.85Å; S117-N308 WeakPolarHBondContact O-CB 3.47Å; S117-N308 PolarHBondContact O-ND2 2.98Å
118	S	82.6	Confident	78.2	Confident	36 Å²	36	49.4 Å²	49.4	25%	0.252	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-57.5	140.1	174.8	-58.7	0	0	0	0	110	E120 D339	S118-E120 PolarHBondContact O-N 3.39Å; S118-D339 VanDerWaalsContact CB-OD2 3.28Å; S118-D339 WeakPolarHBondContact CB-OD2 3.25Å; S118-D339 PolarHBondContact OG-OD2 2.81Å
119	E	79.9	Confident	77.6	Confident	67 Å²	67	50.4 Å²	50.4	31%	0.313	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-59.3	130.7	173.9	-175.9	175.9	-173.9	0	0	110.3	S117 T310	S117-E119 PolarHBondContact O-N 2.85Å; E119-T310 HydrophobicContact CB-CG2 3.93Å; E119-T310 HydrophobicContact CG-CG2 3.82Å; E119-T310 WeakPolarHBondContact OE2-CG2 3.24Å
120	E	72.3	Confident	76.8	Confident	171 Å²	171	48.7 Å²	48.7	80%	0.799	26%	0.257	S	S	*	.	P	Polyproline II helix	trans	-81.2	120.2	173.5	-66.3	-166.7	169	0	0	109.4	S118	S118-E120 PolarHBondContact O-N 3.39Å
121	L	70.3	Confident	75.6	Confident	17 Å²	17	48.1 Å²	48.1	9%	0.089	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-87.3	133.2	-178.9	-60.4	170.2	0	0	0	111	S123 N125 N131 P335	L121-S123 VanDerWaalsContact C-N 3.28Å; L121-S123 WeakPolarHBondContact CB-O 3.31Å; L121-N125 WeakPolarHBondContact CD1-ND2 3.41Å; L121-N131 PolarHBondContact O-ND2 3.03Å; L121-P335 HydrophobicContact CD1-CB 4.22Å; L121-P335 WeakPolarHBondContact CD1-O 3.48Å; L121-P335 HydrophobicContact CD2-CB 3.62Å; L121-P335 HydrophobicContact CD2-CG 3.36Å; L121-P335 HydrophobicContact CG-CB 4.36Å
122	V	66.1	Low	74.2	Confident	144 Å²	144	48.4 Å²	48.4	87%	0.873	26%	0.263	S	S	*	.	S	Bend	trans	-64.7	-36.9	170.1	-176.6	0	0	0	0	110.6
123	S	70.1	Confident	72.9	Confident	33 Å²	33	54.5 Å²	54.5	23%	0.231	30%	0.295	C	S	.	.	S	Bend	trans	-92.2	146.8	178.7	59.6	0	0	0	0	112.5	L121	L121-S123 VanDerWaalsContact C-N 3.28Å; L121-S123 WeakPolarHBondContact CB-O 3.31Å
124	W	68.1	Low	71.6	Confident	11 Å²	11	52.8 Å²	52.8	4%	0.042	28%	0.281	C	S	.	.			trans	-85.2	120.8	176.6	-170.2	51.1	0	0	0	111.1	A49 I53 L126 F134 L141 W145	A49-W124 HydrophobicContact CB-CE3 4.4Å; I53-W124 HydrophobicContact CD1-CB 3.3Å; I53-W124 HydrophobicContact CD1-CD2 3.94Å; I53-W124 HydrophobicContact CD1-CE3 3.68Å; I53-W124 HydrophobicContact CD1-CG 3.86Å; W124-L126 HydrophobicContact CD2-CD2 4.18Å; W124-L126 HydrophobicContact CE3-CD2 3.54Å; W124-L126 HydrophobicContact CE3-CG 4.48Å; W124-L126 HydrophobicContact CH2-CD2 3.53Å; W124-L126 HydrophobicContact CZ2-CD2 4.11Å; W124-L126 HydrophobicContact CZ3-CD2 3.19Å; W124-L126 HydrophobicContact CZ3-CG 4.48Å; W124-F134 HydrophobicContact CB-CB 4.49Å; W124-F134 HydrophobicContact CB-CD1 4.44Å; W124-F134 HydrophobicContact CB-CD2 3.76Å; W124-F134 HydrophobicContact CB-CE2 4.03Å; W124-F134 HydrophobicContact CB-CG 3.99Å; W124-F134 AromaticContact CD1-CD2 3.54Å; W124-F134 AromaticContact CD1-CG 3.65Å; W124-F134 HydrophobicContact CD2-CB 4.23Å; W124-F134 HydrophobicContact CG-CB 3.82Å; W124-F134 AromaticContact CG-CD2 3.88Å; W124-F134 HydrophobicContact CG-CD2 3.88Å; W124-F134 AromaticContact CG-CG 3.86Å; W124-F134 HydrophobicContact CG-CG 3.86Å; W124-L141 HydrophobicContact CE3-CD2 3.96Å; W124-L141 HydrophobicContact CH2-CB 4.18Å; W124-L141 HydrophobicContact CZ3-CB 3.84Å; W124-L141 HydrophobicContact CZ3-CD2 3.61Å; W124-L141 HydrophobicContact CZ3-CG 3.77Å; W124-W145 HydrophobicContact CH2-CB 3.85Å; W124-W145 HydrophobicContact CH2-CG 4.4Å; W124-W145 HydrophobicContact CZ2-CB 4.17Å; W124-W145 AromaticContact CZ2-CD1 3.94Å; W124-W145 HydrophobicContact CZ2-CG 4.24Å
125	N	78.6	Confident	70.2	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.281	C	S	.	.			trans	-98.4	17.9	-179.7	63.1	3.2	0	0	0	113.9	L121 L127 T130 Q336 W360	L121-N125 WeakPolarHBondContact CD1-ND2 3.41Å; N125-L127 PolarHBondContact O-N 2.99Å; N125-L127 VanDerWaalsContact O-N 3.08Å; N125-L127 VanDerWaalsContact OD1-CB 3.29Å; N125-L127 WeakPolarHBondContact OD1-CB 3.29Å; N125-L127 PolarHBondContact OD1-N 3.3Å; N125-L127 PolarHBondContact OD1-O 3.37Å; N125-T130 PolarHBondContact ND2-OG1 3.11Å; N125-T130 VanDerWaalsContact ND2-OG1 3.1Å; N125-T130 PolarHBondContact OD1-OG1 3.31Å; N125-Q336 WeakPolarHBondContact CB-O 3.23Å; N125-W360 VanDerWaalsContact O-CD1 3.29Å; N125-W360 PolarHBondContact O-NE1 2.92Å
126	L	74.3	Confident	68.5	Low	3 Å²	3	59.3 Å²	59.3	2%	0.016	31%	0.307	C	S	.	.	S	Bend	trans	60.1	13.4	-173.7	-52	169.8	0	0	0	114.4	T45 L46 A49 W124 V144 W145 W360	T45-L126 HydrophobicContact CG2-CD1 4.31Å; L46-L126 HydrophobicContact CD2-CD1 3.82Å; L46-L126 HydrophobicContact CD2-CG 3.86Å; A49-L126 HydrophobicContact CB-CD2 4.46Å; W124-L126 HydrophobicContact CD2-CD2 4.18Å; W124-L126 HydrophobicContact CE3-CD2 3.54Å; W124-L126 HydrophobicContact CE3-CG 4.48Å; W124-L126 HydrophobicContact CH2-CD2 3.53Å; W124-L126 HydrophobicContact CZ2-CD2 4.11Å; W124-L126 HydrophobicContact CZ3-CD2 3.19Å; W124-L126 HydrophobicContact CZ3-CG 4.48Å; L126-V144 HydrophobicContact CD1-CG1 3.99Å; L126-V144 HydrophobicContact CD2-CG1 4.11Å; L126-W145 PolarHBondContact O-NE1 3.12Å; L126-W360 HydrophobicContact CB-CZ2 3.92Å; L126-W360 HydrophobicContact CD1-CZ2 3.85Å
127	L	73.1	Confident	67.3	Low	2 Å²	2	62.1 Å²	62.1	1%	0.01	32%	0.322	C	S	.	.			trans	-105.3	117.8	172	-55.8	175.5	0	0	0	108.8	N125 R129 T130	N125-L127 PolarHBondContact O-N 2.99Å; N125-L127 VanDerWaalsContact O-N 3.08Å; N125-L127 VanDerWaalsContact OD1-CB 3.29Å; N125-L127 WeakPolarHBondContact OD1-CB 3.29Å; N125-L127 PolarHBondContact OD1-N 3.3Å; N125-L127 PolarHBondContact OD1-O 3.37Å; L127-R129 HydrophobicContact CB-CG 4.28Å; L127-R129 PolarHBondContact O-N 3.44Å; L127-T130 PolarHBondContact O-OG1 2.82Å
128	T	61.9	Low	66.9	Low	47 Å²	47	61.9 Å²	61.9	29%	0.288	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-22.5	178	42.7	0	0	0	0	113.4	Q135 W145	T128-Q135 HydrophobicContact CG2-CG 4.12Å; T128-W145 HydrophobicContact CG2-CZ2 3.56Å
129	R	70.3	Confident	66.8	Low	63 Å²	63	66.9 Å²	66.9	24%	0.238	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-9.1	-172.8	73.3	-168.9	-178	-169	1.9	115	L127 R355 T358 S359	L127-R129 HydrophobicContact CB-CG 4.28Å; L127-R129 PolarHBondContact O-N 3.44Å; R129-R355 VanDerWaalsContact CG-NH1 3.35Å; R129-R355 PolarHBondContact NH1-O 3.03Å; R129-R355 PolarHBondContact NH2-O 2.88Å; R129-T358 PolarHBondContact NH1-OG1 2.88Å; R129-S359 PolarHBondContact NH2-OG 3.23Å
130	T	57.6	Low	67	Low	15 Å²	15	71.9 Å²	71.9	9%	0.092	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	-15.5	177.6	44.4	0	0	0	0	112.5	N125 L127 D339	N125-T130 PolarHBondContact ND2-OG1 3.11Å; N125-T130 VanDerWaalsContact ND2-OG1 3.1Å; N125-T130 PolarHBondContact OD1-OG1 3.31Å; L127-T130 PolarHBondContact O-OG1 2.82Å; T130-D339 HydrophobicContact CG2-CB 4.07Å
131	N	58.7	Low	67.4	Low	23 Å²	23	64.1 Å²	64.1	12%	0.123	32%	0.323	C	S	.	.			trans	-153.9	118.5	175.7	-164.8	-41.6	0	0	0	111	L121 N133 F134	L121-N131 PolarHBondContact O-ND2 3.03Å; N131-N133 PolarHBondContact OD1-N 3.28Å; N131-F134 HydrophobicContact CB-CD2 3.76Å; N131-F134 HydrophobicContact CB-CE2 4.32Å; N131-F134 WeakPolarHBondContact ND2-CD2 3.46Å; N131-F134 WeakPolarHBondContact ND2-CE2 3.34Å
132	V	54.3	Low	68.1	Low	110 Å²	110	65.1 Å²	65.1	67%	0.667	33%	0.33	S	S	*	.	S	Bend	trans	-78.9	-26.4	-175.1	-145.4	0	0	0	0	111.9	F134	V132-F134 VanDerWaalsContact C-N 3.32Å; V132-F134 PolarHBondContact O-N 3.41Å
133	N	59.2	Low	69.1	Low	146 Å²	146	64.2 Å²	64.2	78%	0.781	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-16	-171.1	-67.3	-31	0	0	0	113.7	N131	N131-N133 PolarHBondContact OD1-N 3.28Å
134	F	58.7	Low	69.9	Low	32 Å²	32	64.3 Å²	64.3	14%	0.14	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	2.4	-174.8	-71.8	-55.4	0	0	0	115.1	I53 W124 N131 V132 Y136 I137	I53-F134 HydrophobicContact CD1-CD1 3.84Å; I53-F134 HydrophobicContact CD1-CE1 4Å; I53-F134 HydrophobicContact CD1-CG 4.41Å; I53-F134 HydrophobicContact CG2-CD1 4.09Å; I53-F134 HydrophobicContact CG2-CE1 3.44Å; I53-F134 VanDerWaalsContact CG2-CE1 3.44Å; I53-F134 HydrophobicContact CG2-CZ 4.24Å; W124-F134 HydrophobicContact CB-CB 4.49Å; W124-F134 HydrophobicContact CB-CD1 4.44Å; W124-F134 HydrophobicContact CB-CD2 3.76Å; W124-F134 HydrophobicContact CB-CE2 4.03Å; W124-F134 HydrophobicContact CB-CG 3.99Å; W124-F134 AromaticContact CD1-CD2 3.54Å; W124-F134 AromaticContact CD1-CG 3.65Å; W124-F134 HydrophobicContact CD2-CB 4.23Å; W124-F134 HydrophobicContact CG-CB 3.82Å; W124-F134 AromaticContact CG-CD2 3.88Å; W124-F134 HydrophobicContact CG-CD2 3.88Å; W124-F134 AromaticContact CG-CG 3.86Å; W124-F134 HydrophobicContact CG-CG 3.86Å; N131-F134 HydrophobicContact CB-CD2 3.76Å; N131-F134 HydrophobicContact CB-CE2 4.32Å; N131-F134 WeakPolarHBondContact ND2-CD2 3.46Å; N131-F134 WeakPolarHBondContact ND2-CE2 3.34Å; V132-F134 VanDerWaalsContact C-N 3.32Å; V132-F134 PolarHBondContact O-N 3.41Å; F134-Y136 PolarHBondContact O-N 3.45Å; F134-I137 HydrophobicContact CD1-CD1 3.48Å; F134-I137 VanDerWaalsContact CD1-CD1 3.48Å; F134-I137 HydrophobicContact CD1-CG1 4.44Å; F134-I137 HydrophobicContact CE1-CD1 3.94Å
135	Q	53.9	Low	70.8	Confident	78 Å²	78	66.9 Å²	66.9	36%	0.364	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-22.7	-165.8	-72.9	-169.8	-8.2	0	0	114.8	T128	T128-Q135 HydrophobicContact CG2-CG 4.12Å
136	Y	54.2	Low	71.3	Confident	187 Å²	187	70 Å²	70	73%	0.733	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-149.9	54.7	-173.4	-59.2	-74	0	0	0	115.1	F134	F134-Y136 PolarHBondContact O-N 3.45Å
137	I	63	Low	72.1	Confident	68 Å²	68	74.9 Å²	74.9	35%	0.349	37%	0.371	S	S	.	.	S	Bend	trans	-78.1	-44.8	178.9	-63.4	-169.7	0	0	0	113.1	I53 F134	I53-I137 HydrophobicContact CB-CD1 4.5Å; I53-I137 HydrophobicContact CG1-CD1 4.16Å; I53-I137 HydrophobicContact CG2-CD1 3.82Å; F134-I137 HydrophobicContact CD1-CD1 3.48Å; F134-I137 VanDerWaalsContact CD1-CD1 3.48Å; F134-I137 HydrophobicContact CD1-CG1 4.44Å; F134-I137 HydrophobicContact CE1-CD1 3.94Å
138	S	77	Confident	72.9	Confident	46 Å²	46	74.9 Å²	74.9	32%	0.322	37%	0.372	S	S	.	.			trans	-154.5	149.3	179.9	72	0	0	0	0	113.1	R140 L141 T142	S138-R140 VanDerWaalsContact C-N 3.27Å; S138-R140 PolarHBondContact O-N 2.95Å; S138-L141 PolarHBondContact O-N 2.96Å; S138-L141 WeakPolarHBondContact OG-CB 3.43Å; S138-L141 VanDerWaalsContact OG-CD1 3.26Å; S138-L141 WeakPolarHBondContact OG-CD1 3Å; S138-L141 PolarHBondContact OG-N 2.89Å; S138-T142 PolarHBondContact O-N 3.08Å; S138-T142 PolarHBondContact O-OG1 3.37Å
139	L	81.5	Confident	74.3	Confident	141 Å²	141	74.5 Å²	74.5	74%	0.738	37%	0.369	S	S	*	.	H	α-helix	trans	-51.6	-43	179.5	-176.3	71	0	0	0	112.8	T142 M143	L139-T142 WeakPolarHBondContact O-CB 3.44Å; L139-T142 PolarHBondContact O-N 2.97Å; L139-M143 WeakPolarHBondContact O-CG 3.43Å; L139-M143 PolarHBondContact O-N 3.21Å
140	R	83	Confident	75.4	Confident	173 Å²	173	75.8 Å²	75.8	65%	0.653	38%	0.38	S	S	*	.	H	α-helix	trans	-64.7	-41.6	178.8	-67.6	-176.4	-177.6	179.9	1.1	112.1	S138 T142 M143 V144	S138-R140 VanDerWaalsContact C-N 3.27Å; S138-R140 PolarHBondContact O-N 2.95Å; R140-T142 VanDerWaalsContact C-N 3.34Å; R140-M143 PolarHBondContact O-N 3.34Å; R140-V144 WeakPolarHBondContact O-CG2 3.34Å; R140-V144 PolarHBondContact O-N 3.45Å; R140-V144 VanDerWaalsContact O-N 3.09Å
141	L	81.8	Confident	77	Confident	7 Å²	7	77.4 Å²	77.4	4%	0.037	39%	0.39	C	S	.	.	H	α-helix	trans	-66.7	-39.1	176.2	-93.6	69.9	0	0	0	111.1	R52 I53 W124 S138 M143 V144 W145	R52-L141 HydrophobicContact CB-CD1 3.93Å; I53-L141 HydrophobicContact CD1-CD2 3.89Å; I53-L141 HydrophobicContact CG1-CD2 3.41Å; I53-L141 VanDerWaalsContact CG1-CD2 3.41Å; W124-L141 HydrophobicContact CE3-CD2 3.96Å; W124-L141 HydrophobicContact CH2-CB 4.18Å; W124-L141 HydrophobicContact CZ3-CB 3.84Å; W124-L141 HydrophobicContact CZ3-CD2 3.61Å; W124-L141 HydrophobicContact CZ3-CG 3.77Å; S138-L141 PolarHBondContact O-N 2.96Å; S138-L141 WeakPolarHBondContact OG-CB 3.43Å; S138-L141 VanDerWaalsContact OG-CD1 3.26Å; S138-L141 WeakPolarHBondContact OG-CD1 3Å; S138-L141 PolarHBondContact OG-N 2.89Å; L141-M143 VanDerWaalsContact C-N 3.33Å; L141-M143 PolarHBondContact O-N 3Å; L141-V144 PolarHBondContact O-N 3.18Å; L141-W145 WeakPolarHBondContact O-CB 3.35Å; L141-W145 PolarHBondContact O-N 3.49Å
142	T	84.1	Confident	78.7	Confident	38 Å²	38	76.7 Å²	76.7	23%	0.233	39%	0.385	C	S	.	.	H	α-helix	trans	-60.5	-41.7	173.2	-54.1	0	0	0	0	111.3	S138 L139 R140 W145 V146	S138-T142 PolarHBondContact O-N 3.08Å; S138-T142 PolarHBondContact O-OG1 3.37Å; L139-T142 WeakPolarHBondContact O-CB 3.44Å; L139-T142 PolarHBondContact O-N 2.97Å; R140-T142 VanDerWaalsContact C-N 3.34Å; T142-W145 WeakPolarHBondContact O-CB 3.42Å; T142-W145 PolarHBondContact O-N 3.24Å; T142-V146 WeakPolarHBondContact O-CG2 3.23Å; T142-V146 PolarHBondContact O-N 2.91Å
143	M	87.4	Confident	80.5	Confident	126 Å²	126	76.8 Å²	76.8	62%	0.621	38%	0.375	S	S	*	.	H	α-helix	trans	-62.1	-45.3	175.3	-70.2	178.4	76.2	0	0	112.6	L139 R140 L141 W145 V146 L147	L139-M143 WeakPolarHBondContact O-CG 3.43Å; L139-M143 PolarHBondContact O-N 3.21Å; R140-M143 PolarHBondContact O-N 3.34Å; L141-M143 VanDerWaalsContact C-N 3.33Å; L141-M143 PolarHBondContact O-N 3Å; M143-W145 VanDerWaalsContact C-N 3.28Å; M143-W145 PolarHBondContact O-N 3.19Å; M143-V146 PolarHBondContact O-N 2.95Å; M143-L147 WeakPolarHBondContact O-CB 3.39Å; M143-L147 PolarHBondContact O-N 3.33Å
144	V	87	Confident	82.1	Confident	35 Å²	35	74 Å²	74	21%	0.212	37%	0.366	C	S	.	.	H	α-helix	trans	-63.3	-38.1	176.5	173.9	0	0	0	0	110.9	T45 W48 L126 R140 L141 L147 G148	T45-V144 HydrophobicContact CG2-CG1 4.33Å; W48-V144 HydrophobicContact CH2-CG2 4.18Å; W48-V144 HydrophobicContact CZ3-CG2 3.93Å; L126-V144 HydrophobicContact CD1-CG1 3.99Å; L126-V144 HydrophobicContact CD2-CG1 4.11Å; R140-V144 WeakPolarHBondContact O-CG2 3.34Å; R140-V144 PolarHBondContact O-N 3.45Å; R140-V144 VanDerWaalsContact O-N 3.09Å; L141-V144 PolarHBondContact O-N 3.18Å; V144-L147 PolarHBondContact O-N 3.16Å; V144-G148 PolarHBondContact O-N 2.76Å
145	W	87.2	Confident	83.6	Confident	65 Å²	65	76.7 Å²	76.7	25%	0.246	38%	0.384	C	S	.	.	H	α-helix	trans	-64.5	-47	174.5	176	79.3	0	0	0	112.7	W124 L126 T128 L141 T142 M143 L147 G148 V149	W124-W145 HydrophobicContact CH2-CB 3.85Å; W124-W145 HydrophobicContact CH2-CG 4.4Å; W124-W145 HydrophobicContact CZ2-CB 4.17Å; W124-W145 AromaticContact CZ2-CD1 3.94Å; W124-W145 HydrophobicContact CZ2-CG 4.24Å; L126-W145 PolarHBondContact O-NE1 3.12Å; T128-W145 HydrophobicContact CG2-CZ2 3.56Å; L141-W145 WeakPolarHBondContact O-CB 3.35Å; L141-W145 PolarHBondContact O-N 3.49Å; T142-W145 WeakPolarHBondContact O-CB 3.42Å; T142-W145 PolarHBondContact O-N 3.24Å; M143-W145 VanDerWaalsContact C-N 3.28Å; M143-W145 PolarHBondContact O-N 3.19Å; W145-L147 VanDerWaalsContact C-N 3.33Å; W145-L147 PolarHBondContact O-N 3.04Å; W145-G148 CarbonylContact O-C 3.6Å; W145-G148 WeakPolarHBondContact O-CA 3.19Å; W145-G148 PolarHBondContact O-N 3.17Å; W145-V149 HydrophobicContact CD2-CG2 4.06Å; W145-V149 HydrophobicContact CE3-CG2 4.35Å; W145-V149 HydrophobicContact CH2-CG2 3.92Å; W145-V149 HydrophobicContact CZ2-CG2 3.57Å; W145-V149 HydrophobicContact CZ3-CG2 4.29Å; W145-V149 WeakPolarHBondContact O-CG2 3.27Å; W145-V149 PolarHBondContact O-N 2.87Å
146	V	89.6	Confident	85.3	Confident	64 Å²	64	73.9 Å²	73.9	39%	0.388	37%	0.372	S	S	.	.	H	α-helix	trans	-59.6	-45.3	175.9	170.4	0	0	0	0	110.4	T142 M143 G148 V149 I150	T142-V146 WeakPolarHBondContact O-CG2 3.23Å; T142-V146 PolarHBondContact O-N 2.91Å; M143-V146 PolarHBondContact O-N 2.95Å; V146-G148 VanDerWaalsContact C-N 3.25Å; V146-G148 PolarHBondContact O-N 3.07Å; V146-V149 WeakPolarHBondContact O-CB 3.42Å; V146-V149 PolarHBondContact O-N 3.17Å; V146-V149 VanDerWaalsContact O-N 3.12Å; V146-I150 HydrophobicContact CG1-CD1 4.08Å; V146-I150 WeakPolarHBondContact O-CG1 3.36Å; V146-I150 PolarHBondContact O-N 2.86Å
147	L	90.6	Very high	87.2	Confident	106 Å²	106	66.4 Å²	66.4	56%	0.555	34%	0.344	S	S	*	.	H	α-helix	trans	-57.1	-42.8	173.3	178.9	62.2	0	0	0	111	M143 V144 W145 V149 I150 V151	M143-L147 WeakPolarHBondContact O-CB 3.39Å; M143-L147 PolarHBondContact O-N 3.33Å; V144-L147 PolarHBondContact O-N 3.16Å; W145-L147 VanDerWaalsContact C-N 3.33Å; W145-L147 PolarHBondContact O-N 3.04Å; L147-V149 PolarHBondContact O-N 3.2Å; L147-I150 PolarHBondContact O-N 2.93Å; L147-V151 HydrophobicContact CD1-CG2 4.39Å; L147-V151 WeakPolarHBondContact O-CG2 3.48Å; L147-V151 PolarHBondContact O-N 2.91Å
148	G	90.5	Very high	88.6	Confident	3 Å²	3	66.1 Å²	66.1	3%	0.031	35%	0.347	C	S	.	.	H	α-helix	trans	-65.3	-35.1	175.9	0	0	0	0	0	114.1	V144 W145 V146 R152	V144-G148 PolarHBondContact O-N 2.76Å; W145-G148 CarbonylContact O-C 3.6Å; W145-G148 WeakPolarHBondContact O-CA 3.19Å; W145-G148 PolarHBondContact O-N 3.17Å; V146-G148 VanDerWaalsContact C-N 3.25Å; V146-G148 PolarHBondContact O-N 3.07Å; G148-R152 VanDerWaalsContact O-CB 3.31Å; G148-R152 WeakPolarHBondContact O-CB 3.49Å; G148-R152 WeakPolarHBondContact O-CG 3.1Å; G148-R152 PolarHBondContact O-N 3.47Å; G148-R152 PolarHBondContact O-NE 3.42Å; G148-R152 VanDerWaalsContact O-NE 3.14Å
149	V	91	Very high	89.2	Confident	39 Å²	39	66.5 Å²	66.5	24%	0.236	35%	0.345	C	S	.	.	H	α-helix	trans	-61.8	-48.6	170.2	174.1	0	0	0	0	110	W145 V146 L147 V151 R152 Y153	W145-V149 HydrophobicContact CD2-CG2 4.06Å; W145-V149 HydrophobicContact CE3-CG2 4.35Å; W145-V149 HydrophobicContact CH2-CG2 3.92Å; W145-V149 HydrophobicContact CZ2-CG2 3.57Å; W145-V149 HydrophobicContact CZ3-CG2 4.29Å; W145-V149 WeakPolarHBondContact O-CG2 3.27Å; W145-V149 PolarHBondContact O-N 2.87Å; V146-V149 WeakPolarHBondContact O-CB 3.42Å; V146-V149 PolarHBondContact O-N 3.17Å; V146-V149 VanDerWaalsContact O-N 3.12Å; L147-V149 PolarHBondContact O-N 3.2Å; V149-V151 PolarHBondContact O-N 3.25Å; V149-R152 PolarHBondContact O-N 3.11Å; V149-Y153 HydrophobicContact CG1-CD2 3.88Å; V149-Y153 HydrophobicContact CG1-CE2 4.28Å; V149-Y153 WeakPolarHBondContact O-CD2 3.35Å; V149-Y153 PolarHBondContact O-N 3.39Å
150	I	93.1	Very high	89.8	Confident	90 Å²	90	59.9 Å²	59.9	46%	0.462	31%	0.31	S	S	.	.	H	α-helix	trans	-58.5	-49.6	179.2	-66.2	166.6	0	0	0	110.6	V146 L147 R152 C154	V146-I150 HydrophobicContact CG1-CD1 4.08Å; V146-I150 WeakPolarHBondContact O-CG1 3.36Å; V146-I150 PolarHBondContact O-N 2.86Å; L147-I150 PolarHBondContact O-N 2.93Å; I150-R152 PolarHBondContact O-N 2.91Å; I150-C154 WeakPolarHBondContact O-CA 3.47Å; I150-C154 WeakPolarHBondContact O-CB 3.17Å; I150-C154 PolarHBondContact O-N 3.18Å
151	V	91.8	Very high	90.2	Very high	48 Å²	48	54.9 Å²	54.9	29%	0.291	30%	0.298	S	S	.	.	I	π-helix	trans	-60.3	-45.1	178.9	171.9	0	0	0	0	111.3	L147 V149 V155 L156 W360	L147-V151 HydrophobicContact CD1-CG2 4.39Å; L147-V151 WeakPolarHBondContact O-CG2 3.48Å; L147-V151 PolarHBondContact O-N 2.91Å; V149-V151 PolarHBondContact O-N 3.25Å; V151-V155 WeakPolarHBondContact O-CB 3.46Å; V151-V155 PolarHBondContact O-N 2.96Å; V151-L156 HydrophobicContact CG1-CD1 4.26Å; V151-L156 HydrophobicContact CG1-CG 4.22Å; V151-L156 PolarHBondContact O-N 2.88Å; V151-W360 HydrophobicContact CG1-CZ3 4.4Å
152	R	93	Very high	90.6	Very high	9 Å²	9	56.4 Å²	56.4	3%	0.034	31%	0.308	C	S	.	.	I	π-helix	trans	-67.9	-42.3	-176.7	-71.5	175.6	-47.2	99.3	-1	112.9	G148 V149 I150 L156 L157 T358 W360	G148-R152 VanDerWaalsContact O-CB 3.31Å; G148-R152 WeakPolarHBondContact O-CB 3.49Å; G148-R152 WeakPolarHBondContact O-CG 3.1Å; G148-R152 PolarHBondContact O-N 3.47Å; G148-R152 PolarHBondContact O-NE 3.42Å; G148-R152 VanDerWaalsContact O-NE 3.14Å; V149-R152 PolarHBondContact O-N 3.11Å; I150-R152 PolarHBondContact O-N 2.91Å; R152-L156 HydrophobicContact CG-CD1 4.16Å; R152-L157 VanDerWaalsContact O-CB 3.27Å; R152-L157 WeakPolarHBondContact O-CB 3.2Å; R152-L157 PolarHBondContact O-N 2.91Å; R152-T358 VanDerWaalsContact CD-O 3.3Å; R152-T358 WeakPolarHBondContact CD-O 2.87Å; R152-T358 PolarHBondContact NH1-O 3.17Å; R152-W360 HydrophobicContact CG-CD2 4.35Å; R152-W360 HydrophobicContact CG-CE3 3.98Å; R152-W360 HydrophobicContact CG-CH2 4.31Å; R152-W360 HydrophobicContact CG-CZ3 3.96Å
153	Y	93.3	Very high	91	Very high	112 Å²	112	55 Å²	55	44%	0.439	30%	0.299	S	S	.	.	I	π-helix	trans	-91.5	-33.5	-173.9	-74.9	-90.2	0	0	0	113.7	V149 L157 P158 T358	V149-Y153 HydrophobicContact CG1-CD2 3.88Å; V149-Y153 HydrophobicContact CG1-CE2 4.28Å; V149-Y153 WeakPolarHBondContact O-CD2 3.35Å; V149-Y153 PolarHBondContact O-N 3.39Å; Y153-L157 HydrophobicContact CD1-CD2 4.04Å; Y153-P158 WeakPolarHBondContact O-CD 2.9Å; Y153-T358 HydrophobicContact CD1-CG2 4.12Å; Y153-T358 HydrophobicContact CE1-CG2 3.72Å; Y153-T358 HydrophobicContact CE2-CG2 4.49Å
154	C	92.4	Very high	91.2	Very high	88 Å²	88	49.5 Å²	49.5	60%	0.595	27%	0.274	S	S	*	.	I	π-helix	trans	-93.4	-24.3	-176.9	-56.1	0	0	0	0	113.1	I150	I150-C154 WeakPolarHBondContact O-CA 3.47Å; I150-C154 WeakPolarHBondContact O-CB 3.17Å; I150-C154 PolarHBondContact O-N 3.18Å
155	V	89.4	Confident	91.4	Very high	88 Å²	88	54.6 Å²	54.6	53%	0.533	29%	0.293	S	S	.	.	I	π-helix	trans	-115.1	-59	-176.7	-174.7	0	0	0	0	111.7	V151 L159	V151-V155 WeakPolarHBondContact O-CB 3.46Å; V151-V155 PolarHBondContact O-N 2.96Å; V155-L159 WeakPolarHBondContact O-CB 3.1Å; V155-L159 PolarHBondContact O-N 3.41Å
156	L	91.6	Very high	91.6	Very high	19 Å²	19	52.8 Å²	52.8	10%	0.099	29%	0.288	C	S	.	.	I	π-helix	trans	-68.5	-49.2	-174.6	-63.3	178.1	0	0	0	111.8	V151 R152 L159 R160	V151-L156 HydrophobicContact CG1-CD1 4.26Å; V151-L156 HydrophobicContact CG1-CG 4.22Å; V151-L156 PolarHBondContact O-N 2.88Å; R152-L156 HydrophobicContact CG-CD1 4.16Å; L156-L159 PolarHBondContact O-N 2.83Å; L156-R160 VanDerWaalsContact O-CB 3.27Å; L156-R160 WeakPolarHBondContact O-CB 3.17Å; L156-R160 WeakPolarHBondContact O-CG 3.27Å; L156-R160 PolarHBondContact O-N 2.71Å
157	L	93.9	Very high	91.7	Very high	30 Å²	30	49.7 Å²	49.7	16%	0.157	27%	0.27	C	S	.	.	H	α-helix	trans	-59	-50.7	-175.4	175.6	66.4	0	0	0	113.1	R152 Y153 L159 R160 V161 L354 M357 T358	R152-L157 VanDerWaalsContact O-CB 3.27Å; R152-L157 WeakPolarHBondContact O-CB 3.2Å; R152-L157 PolarHBondContact O-N 2.91Å; Y153-L157 HydrophobicContact CD1-CD2 4.04Å; L157-L159 VanDerWaalsContact C-N 3.34Å; L157-L159 PolarHBondContact O-N 2.82Å; L157-R160 PolarHBondContact O-N 3.39Å; L157-V161 HydrophobicContact CD1-CG2 3.8Å; L157-V161 HydrophobicContact CG-CG2 4.31Å; L157-V161 WeakPolarHBondContact O-CB 3.1Å; L157-V161 VanDerWaalsContact O-CG2 3.29Å; L157-V161 WeakPolarHBondContact O-CG2 3.5Å; L157-V161 PolarHBondContact O-N 3.38Å; L157-L354 HydrophobicContact CD1-CD2 4.01Å; L157-M357 HydrophobicContact CD1-CB 3.79Å; L157-T358 HydrophobicContact CB-CG2 4.32Å; L157-T358 HydrophobicContact CD1-CG2 4.08Å; L157-T358 HydrophobicContact CD2-CG2 4.09Å; L157-T358 HydrophobicContact CG-CG2 4.4Å
158	P	92.2	Very high	91.7	Very high	62 Å²	62	47.8 Å²	47.8	40%	0.403	26%	0.259	S	S	.	.	H	α-helix	trans	-60.9	-41	178.1	-25.2	36	0	0	0	113.2	Y153 T162	Y153-P158 WeakPolarHBondContact O-CD 2.9Å; P158-T162 WeakPolarHBondContact O-CB 3.24Å; P158-T162 PolarHBondContact O-N 3.26Å; P158-T162 VanDerWaalsContact O-N 3.11Å; P158-T162 PolarHBondContact O-OG1 2.68Å
159	L	89.1	Confident	91.8	Very high	53 Å²	53	49.4 Å²	49.4	28%	0.277	27%	0.27	S	S	.	.	H	α-helix	trans	-60	-48.3	175.1	175.7	64	0	0	0	111.6	W14 V18 V155 L156 L157 T162 L163	W14-L159 HydrophobicContact CH2-CD1 4.38Å; W14-L159 HydrophobicContact CZ2-CD1 3.78Å; V18-L159 HydrophobicContact CG2-CD1 3.89Å; V155-L159 WeakPolarHBondContact O-CB 3.1Å; V155-L159 PolarHBondContact O-N 3.41Å; L156-L159 PolarHBondContact O-N 2.83Å; L157-L159 VanDerWaalsContact C-N 3.34Å; L157-L159 PolarHBondContact O-N 2.82Å; L159-T162 PolarHBondContact O-N 2.59Å; L159-L163 HydrophobicContact CD1-CD1 4.13Å; L159-L163 HydrophobicContact CD1-CG 4.32Å; L159-L163 HydrophobicContact CG-CD1 4.07Å; L159-L163 WeakPolarHBondContact O-CB 3.49Å; L159-L163 WeakPolarHBondContact O-CG 3.45Å; L159-L163 PolarHBondContact O-N 3.13Å
160	R	93	Very high	91.8	Very high	3 Å²	3	50.7 Å²	50.7	1%	0.011	28%	0.275	C	S	.	.	H	α-helix	trans	-67.4	-41.5	-178.2	-71.3	-179.2	170.8	168.6	0.1	112.7	L156 L157 T162 L163 A164 A205 S207 M357 S359 W360	L156-R160 VanDerWaalsContact O-CB 3.27Å; L156-R160 WeakPolarHBondContact O-CB 3.17Å; L156-R160 WeakPolarHBondContact O-CG 3.27Å; L156-R160 PolarHBondContact O-N 2.71Å; L157-R160 PolarHBondContact O-N 3.39Å; R160-T162 VanDerWaalsContact C-N 3.28Å; R160-T162 PolarHBondContact O-N 3.33Å; R160-L163 PolarHBondContact O-N 2.96Å; R160-A164 VanDerWaalsContact O-CB 3.28Å; R160-A164 WeakPolarHBondContact O-CB 3.38Å; R160-A164 PolarHBondContact O-N 3.13Å; R160-A205 WeakPolarHBondContact CB-O 3.43Å; R160-A205 WeakPolarHBondContact CD-O 3.18Å; R160-A205 WeakPolarHBondContact CG-O 3.48Å; R160-S207 PolarHBondContact NE-OG 3.04Å; R160-S207 PolarHBondContact NH2-OG 2.75Å; R160-M357 HydrophobicContact CB-CB 4.36Å; R160-M357 HydrophobicContact CB-CG 4.31Å; R160-M357 WeakPolarHBondContact CD-O 3.07Å; R160-M357 VanDerWaalsContact NH1-C 3.29Å; R160-M357 PolarHBondContact NH1-O 3.04Å; R160-S359 PolarHBondContact NH1-O 3.36Å; R160-S359 PolarHBondContact NH2-O 2.88Å; R160-W360 PolarHBondContact NH2-O 3.21Å
161	V	92.8	Very high	91.8	Very high	67 Å²	67	47.1 Å²	47.1	41%	0.406	26%	0.257	S	S	.	.	H	α-helix	trans	-59.2	-44.2	175.1	167.1	0	0	0	0	110.2	L157 A164 F165 M357	L157-V161 HydrophobicContact CD1-CG2 3.8Å; L157-V161 HydrophobicContact CG-CG2 4.31Å; L157-V161 WeakPolarHBondContact O-CB 3.1Å; L157-V161 VanDerWaalsContact O-CG2 3.29Å; L157-V161 WeakPolarHBondContact O-CG2 3.5Å; L157-V161 PolarHBondContact O-N 3.38Å; V161-A164 PolarHBondContact O-N 3.24Å; V161-F165 WeakPolarHBondContact O-CB 3.35Å; V161-F165 PolarHBondContact O-N 2.8Å; V161-M357 HydrophobicContact CG2-SD 3.9Å
162	T	90.2	Very high	91.8	Very high	40 Å²	40	46.5 Å²	46.5	25%	0.245	25%	0.253	C	S	.	.	H	α-helix	trans	-71.6	-39.6	-178.9	-51.4	0	0	0	0	112.3	W14 P158 L159 R160 A164 F165 I166	W14-T162 HydrophobicContact CH2-CG2 3.19Å; W14-T162 WeakPolarHBondContact CH2-OG1 3.31Å; W14-T162 HydrophobicContact CZ2-CG2 4.46Å; W14-T162 HydrophobicContact CZ3-CG2 3.22Å; P158-T162 WeakPolarHBondContact O-CB 3.24Å; P158-T162 PolarHBondContact O-N 3.26Å; P158-T162 VanDerWaalsContact O-N 3.11Å; P158-T162 PolarHBondContact O-OG1 2.68Å; L159-T162 PolarHBondContact O-N 2.59Å; R160-T162 VanDerWaalsContact C-N 3.28Å; R160-T162 PolarHBondContact O-N 3.33Å; T162-A164 VanDerWaalsContact C-N 3.35Å; T162-F165 PolarHBondContact O-N 3.39Å; T162-I166 HydrophobicContact CG2-CD1 4.03Å; T162-I166 VanDerWaalsContact O-CG1 3.3Å; T162-I166 WeakPolarHBondContact O-CG1 3.26Å; T162-I166 PolarHBondContact O-N 3.19Å
163	L	91	Very high	91.8	Very high	8 Å²	8	50.9 Å²	50.9	4%	0.042	28%	0.276	C	S	.	.	H	α-helix	trans	-61.9	-42.2	172.8	-75.5	173.8	0	0	0	112.2	V18 I22 L159 R160 F165 I166 G167 I201 A205	V18-L163 HydrophobicContact CG1-CD2 3.59Å; V18-L163 HydrophobicContact CG1-CG 4.49Å; I22-L163 HydrophobicContact CB-CD2 4.19Å; I22-L163 HydrophobicContact CD1-CD1 3.79Å; I22-L163 HydrophobicContact CD1-CD2 3.76Å; I22-L163 HydrophobicContact CD1-CG 4.3Å; I22-L163 HydrophobicContact CG2-CD2 3.8Å; L159-L163 HydrophobicContact CD1-CD1 4.13Å; L159-L163 HydrophobicContact CD1-CG 4.32Å; L159-L163 HydrophobicContact CG-CD1 4.07Å; L159-L163 WeakPolarHBondContact O-CB 3.49Å; L159-L163 WeakPolarHBondContact O-CG 3.45Å; L159-L163 PolarHBondContact O-N 3.13Å; R160-L163 PolarHBondContact O-N 2.96Å; L163-F165 VanDerWaalsContact C-N 3.35Å; L163-I166 PolarHBondContact O-N 2.96Å; L163-G167 PolarHBondContact O-N 2.64Å; L163-I201 WeakPolarHBondContact O-CG2 3.41Å; L163-A205 HydrophobicContact CB-CB 3.59Å
164	A	92.2	Very high	91.8	Very high	10 Å²	10	46.1 Å²	46.1	8%	0.083	26%	0.262	C	S	.	.	H	α-helix	trans	-63.9	-42.4	176	0	0	0	0	0	111.1	R160 V161 T162 G167 I168 A205 M357	R160-A164 VanDerWaalsContact O-CB 3.28Å; R160-A164 WeakPolarHBondContact O-CB 3.38Å; R160-A164 PolarHBondContact O-N 3.13Å; V161-A164 PolarHBondContact O-N 3.24Å; T162-A164 VanDerWaalsContact C-N 3.35Å; A164-G167 PolarHBondContact O-N 2.92Å; A164-I168 WeakPolarHBondContact O-CB 2.94Å; A164-I168 WeakPolarHBondContact O-CD1 3.26Å; A164-I168 WeakPolarHBondContact O-CG1 3.16Å; A164-I168 PolarHBondContact O-N 3.44Å; A164-A205 HydrophobicContact CB-CB 4.17Å; A164-M357 HydrophobicContact CB-CE 3.59Å
165	F	92	Very high	91.8	Very high	142 Å²	142	42 Å²	42	62%	0.623	23%	0.233	S	C	*	.	H	α-helix	trans	-58.9	-51.2	174.1	-178.7	-98.9	0	0	0	111.2	V161 T162 L163 G167 I168 S169	V161-F165 WeakPolarHBondContact O-CB 3.35Å; V161-F165 PolarHBondContact O-N 2.8Å; T162-F165 PolarHBondContact O-N 3.39Å; L163-F165 VanDerWaalsContact C-N 3.35Å; F165-G167 PolarHBondContact O-N 3.15Å; F165-I168 PolarHBondContact O-N 3.24Å; F165-S169 VanDerWaalsContact O-CB 3.26Å; F165-S169 WeakPolarHBondContact O-CB 3.47Å; F165-S169 PolarHBondContact O-N 3.47Å; F165-S169 PolarHBondContact O-OG 3.35Å
166	I	90.7	Very high	91.9	Very high	27 Å²	27	39.9 Å²	39.9	14%	0.138	22%	0.221	C	C	.	.	H	α-helix	trans	-57.6	-49.6	176.6	-68.5	166.5	0	0	0	110.8	V18 L23 T162 L163 I168 S169 L170	V18-I166 HydrophobicContact CG1-CD1 3.84Å; L23-I166 HydrophobicContact CD1-CG2 4.41Å; T162-I166 HydrophobicContact CG2-CD1 4.03Å; T162-I166 VanDerWaalsContact O-CG1 3.3Å; T162-I166 WeakPolarHBondContact O-CG1 3.26Å; T162-I166 PolarHBondContact O-N 3.19Å; L163-I166 PolarHBondContact O-N 2.96Å; I166-I168 PolarHBondContact O-N 3.45Å; I166-S169 PolarHBondContact O-N 2.88Å; I166-L170 HydrophobicContact CG2-CD1 3.63Å; I166-L170 HydrophobicContact CG2-CG 4.25Å; I166-L170 VanDerWaalsContact O-CB 3.3Å; I166-L170 WeakPolarHBondContact O-CB 3.36Å; I166-L170 WeakPolarHBondContact O-CG 3.2Å; I166-L170 PolarHBondContact O-N 3.41Å
167	G	92.1	Very high	91.9	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61.2	-43.9	-178.8	0	0	0	0	0	113.1	L163 A164 F165 L171	L163-G167 PolarHBondContact O-N 2.64Å; A164-G167 PolarHBondContact O-N 2.92Å; F165-G167 PolarHBondContact O-N 3.15Å; G167-L171 WeakPolarHBondContact O-CB 3.39Å; G167-L171 PolarHBondContact O-N 3.26Å
168	I	91.5	Very high	91.9	Very high	65 Å²	65	43.6 Å²	43.6	33%	0.333	24%	0.241	S	C	.	.	H	α-helix	trans	-70.6	-43.4	178.8	-66.8	166.7	0	0	0	110.9	A164 F165 I166 L171 V172 I258	A164-I168 WeakPolarHBondContact O-CB 2.94Å; A164-I168 WeakPolarHBondContact O-CD1 3.26Å; A164-I168 WeakPolarHBondContact O-CG1 3.16Å; A164-I168 PolarHBondContact O-N 3.44Å; F165-I168 PolarHBondContact O-N 3.24Å; I166-I168 PolarHBondContact O-N 3.45Å; I168-L171 WeakPolarHBondContact O-CB 3.43Å; I168-L171 PolarHBondContact O-N 2.86Å; I168-V172 HydrophobicContact CG2-CG2 4.5Å; I168-V172 WeakPolarHBondContact O-CG2 3.43Å; I168-V172 PolarHBondContact O-N 3.39Å; I168-I258 HydrophobicContact CG2-CD1 4.23Å
169	S	91.5	Very high	91.8	Very high	38 Å²	38	41.5 Å²	41.5	27%	0.266	23%	0.23	S	C	.	.	H	α-helix	trans	-62.1	-45.1	177.3	-67.8	0	0	0	0	111.4	F165 I166 L171 V172 I173	F165-S169 VanDerWaalsContact O-CB 3.26Å; F165-S169 WeakPolarHBondContact O-CB 3.47Å; F165-S169 PolarHBondContact O-N 3.47Å; F165-S169 PolarHBondContact O-OG 3.35Å; I166-S169 PolarHBondContact O-N 2.88Å; S169-L171 VanDerWaalsContact C-N 3.31Å; S169-L171 PolarHBondContact O-N 3.04Å; S169-V172 PolarHBondContact O-N 3.37Å; S169-I173 WeakPolarHBondContact O-CB 3.32Å; S169-I173 WeakPolarHBondContact O-CD1 3.45Å; S169-I173 VanDerWaalsContact O-CG1 3.23Å; S169-I173 WeakPolarHBondContact O-CG1 3.37Å; S169-I173 PolarHBondContact O-N 2.89Å
170	L	92.1	Very high	91.9	Very high	65 Å²	65	45.7 Å²	45.7	34%	0.34	25%	0.248	S	C	.	.	H	α-helix	trans	-63.2	-36.8	174.9	-71.4	173.9	0	0	0	112.1	L23 I166 G174 C198 I201	L23-L170 HydrophobicContact CD1-CD1 3.73Å; I166-L170 HydrophobicContact CG2-CD1 3.63Å; I166-L170 HydrophobicContact CG2-CG 4.25Å; I166-L170 VanDerWaalsContact O-CB 3.3Å; I166-L170 WeakPolarHBondContact O-CB 3.36Å; I166-L170 WeakPolarHBondContact O-CG 3.2Å; I166-L170 PolarHBondContact O-N 3.41Å; L170-G174 WeakPolarHBondContact O-CA 3.41Å; L170-G174 PolarHBondContact O-N 3.13Å; L170-C198 VanDerWaalsContact C-SG 3.59Å; L170-I201 HydrophobicContact CD1-CD1 3.96Å
171	L	92.5	Very high	91.9	Very high	15 Å²	15	48.6 Å²	48.6	8%	0.079	26%	0.264	C	S	.	.	H	α-helix	trans	-62.6	-50.7	175.1	-177.5	66.2	0	0	0	110.7	G167 I168 S169 T175 V194 C198 I258 M262	G167-L171 WeakPolarHBondContact O-CB 3.39Å; G167-L171 PolarHBondContact O-N 3.26Å; I168-L171 WeakPolarHBondContact O-CB 3.43Å; I168-L171 PolarHBondContact O-N 2.86Å; S169-L171 VanDerWaalsContact C-N 3.31Å; S169-L171 PolarHBondContact O-N 3.04Å; L171-T175 HydrophobicContact CD1-CG2 3.87Å; L171-T175 HydrophobicContact CG-CG2 4.43Å; L171-T175 VanDerWaalsContact O-CB 3.29Å; L171-T175 WeakPolarHBondContact O-CB 3.31Å; L171-T175 VanDerWaalsContact O-CG2 3.24Å; L171-T175 WeakPolarHBondContact O-CG2 3.39Å; L171-T175 PolarHBondContact O-N 2.72Å; L171-T175 PolarHBondContact O-OG1 3.03Å; L171-V194 HydrophobicContact CD1-CG1 4.44Å; L171-C198 VanDerWaalsContact CA-SG 3.55Å; L171-C198 HydrophobicContact CB-CB 3.75Å; L171-C198 HydrophobicContact CD1-CB 3.95Å; L171-C198 HydrophobicContact CG-CB 4.38Å; L171-C198 PolarHBondContact N-SG 3.41Å; L171-I258 HydrophobicContact CD2-CG2 4.39Å; L171-M262 HydrophobicContact CD2-CG 4.44Å; L171-M262 HydrophobicContact CD2-SD 4.38Å
172	V	91.1	Very high	91.8	Very high	36 Å²	36	50.2 Å²	50.2	22%	0.218	28%	0.276	C	S	.	.	H	α-helix	trans	-64.1	-46.3	-177.9	172.3	0	0	0	0	111.2	I168 S169 T175 T176 I258 A261	I168-V172 HydrophobicContact CG2-CG2 4.5Å; I168-V172 WeakPolarHBondContact O-CG2 3.43Å; I168-V172 PolarHBondContact O-N 3.39Å; S169-V172 PolarHBondContact O-N 3.37Å; V172-T175 PolarHBondContact O-OG1 2.94Å; V172-T176 VanDerWaalsContact O-CB 3.24Å; V172-T176 WeakPolarHBondContact O-CB 3.45Å; V172-T176 PolarHBondContact O-N 3.01Å; V172-T176 VanDerWaalsContact O-N 3.1Å; V172-T176 PolarHBondContact O-OG1 3.06Å; V172-I258 HydrophobicContact CG2-CG1 4.38Å; V172-A261 HydrophobicContact CB-CB 4.49Å; V172-A261 HydrophobicContact CG1-CB 4.22Å; V172-A261 HydrophobicContact CG2-CB 4.42Å
173	I	92.7	Very high	91.6	Very high	100 Å²	100	55.3 Å²	55.3	51%	0.513	30%	0.301	S	S	.	.	H	α-helix	trans	-66.4	-52.1	179.2	-65.8	166.3	0	0	0	109.9	S169 T175 T176 L177	S169-I173 WeakPolarHBondContact O-CB 3.32Å; S169-I173 WeakPolarHBondContact O-CD1 3.45Å; S169-I173 VanDerWaalsContact O-CG1 3.23Å; S169-I173 WeakPolarHBondContact O-CG1 3.37Å; S169-I173 PolarHBondContact O-N 2.89Å; I173-T175 PolarHBondContact O-N 2.92Å; I173-T176 PolarHBondContact O-N 2.83Å; I173-L177 HydrophobicContact CG2-CD1 3.87Å; I173-L177 HydrophobicContact CG2-CG 4.36Å; I173-L177 WeakPolarHBondContact O-CG 3.47Å; I173-L177 PolarHBondContact O-N 3.29Å
174	G	92.9	Very high	91.5	Very high	13 Å²	13	56.9 Å²	56.9	13%	0.134	31%	0.313	C	S	.	.	H	α-helix	trans	-60.4	-46.5	-177.2	0	0	0	0	0	112.6	L170 T176 L177 V178	L170-G174 WeakPolarHBondContact O-CA 3.41Å; L170-G174 PolarHBondContact O-N 3.13Å; G174-T176 VanDerWaalsContact C-N 3.34Å; G174-T176 PolarHBondContact O-N 3.01Å; G174-L177 PolarHBondContact O-N 2.88Å; G174-V178 WeakPolarHBondContact O-CB 3.45Å; G174-V178 VanDerWaalsContact O-CG2 3.27Å; G174-V178 WeakPolarHBondContact O-CG2 3.48Å; G174-V178 PolarHBondContact O-N 3.07Å
175	T	92.5	Very high	91.4	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-67.4	-34.3	177.3	55.2	0	0	0	0	112.4	L171 V172 I173 G179 V194 A261 A265	L171-T175 HydrophobicContact CD1-CG2 3.87Å; L171-T175 HydrophobicContact CG-CG2 4.43Å; L171-T175 VanDerWaalsContact O-CB 3.29Å; L171-T175 WeakPolarHBondContact O-CB 3.31Å; L171-T175 VanDerWaalsContact O-CG2 3.24Å; L171-T175 WeakPolarHBondContact O-CG2 3.39Å; L171-T175 PolarHBondContact O-N 2.72Å; L171-T175 PolarHBondContact O-OG1 3.03Å; V172-T175 PolarHBondContact O-OG1 2.94Å; I173-T175 PolarHBondContact O-N 2.92Å; T175-G179 PolarHBondContact O-N 3.05Å; T175-V194 HydrophobicContact CG2-CG1 4.01Å; T175-A261 WeakPolarHBondContact CB-O 3.26Å; T175-A261 PolarHBondContact OG1-O 2.92Å; T175-A265 HydrophobicContact CG2-CB 3.84Å
176	T	91.5	Very high	91.4	Very high	45 Å²	45	59.3 Å²	59.3	28%	0.276	34%	0.339	S	S	.	.	H	α-helix	trans	-66	-43.2	175	-62.2	0	0	0	0	111.8	V172 I173 G174 G179 Q180	V172-T176 VanDerWaalsContact O-CB 3.24Å; V172-T176 WeakPolarHBondContact O-CB 3.45Å; V172-T176 PolarHBondContact O-N 3.01Å; V172-T176 VanDerWaalsContact O-N 3.1Å; V172-T176 PolarHBondContact O-OG1 3.06Å; I173-T176 PolarHBondContact O-N 2.83Å; G174-T176 VanDerWaalsContact C-N 3.34Å; G174-T176 PolarHBondContact O-N 3.01Å; T176-G179 PolarHBondContact O-N 2.8Å; T176-Q180 PolarHBondContact O-N 3.39Å; T176-Q180 PolarHBondContact O-NE2 3.34Å
177	L	93.4	Very high	91.4	Very high	116 Å²	116	59.1 Å²	59.1	61%	0.607	34%	0.337	S	S	*	.	H	α-helix	trans	-66.5	-49.9	177.7	-70.1	175.1	0	0	0	111.7	I173 G174 G179 Q180	I173-L177 HydrophobicContact CG2-CD1 3.87Å; I173-L177 HydrophobicContact CG2-CG 4.36Å; I173-L177 WeakPolarHBondContact O-CG 3.47Å; I173-L177 PolarHBondContact O-N 3.29Å; G174-L177 PolarHBondContact O-N 2.88Å; L177-G179 PolarHBondContact O-N 3.2Å; L177-Q180 WeakPolarHBondContact O-CB 3.45Å; L177-Q180 PolarHBondContact O-N 3.27Å; L177-Q180 VanDerWaalsContact O-N 3.09Å
178	V	93.4	Very high	91.4	Very high	11 Å²	11	62.3 Å²	62.3	7%	0.067	35%	0.354	C	S	.	.	H	α-helix	trans	-60.7	-34.4	176.5	172.9	0	0	0	0	111.1	G174 Q180 L181 K187 L190 V194 A265	G174-V178 WeakPolarHBondContact O-CB 3.45Å; G174-V178 VanDerWaalsContact O-CG2 3.27Å; G174-V178 WeakPolarHBondContact O-CG2 3.48Å; G174-V178 PolarHBondContact O-N 3.07Å; V178-Q180 PolarHBondContact O-N 2.94Å; V178-L181 VanDerWaalsContact O-CB 3.29Å; V178-L181 WeakPolarHBondContact O-CB 3.26Å; V178-L181 PolarHBondContact O-N 2.88Å; V178-K187 HydrophobicContact CG1-CG 3.96Å; V178-K187 WeakPolarHBondContact CG1-O 3.38Å; V178-L190 HydrophobicContact CG1-CB 4.18Å; V178-L190 HydrophobicContact CG2-CB 3.87Å; V178-V194 HydrophobicContact CG2-CG2 4.1Å; V178-A265 HydrophobicContact CB-CB 4.4Å; V178-A265 HydrophobicContact CG1-CB 4.26Å
179	G	90.4	Very high	91.4	Very high	17 Å²	17	66.5 Å²	66.5	18%	0.175	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-19.1	176.9	0	0	0	0	0	115.4	T175 T176 L177 L181 K264	T175-G179 PolarHBondContact O-N 3.05Å; T176-G179 PolarHBondContact O-N 2.8Å; L177-G179 PolarHBondContact O-N 3.2Å; G179-L181 VanDerWaalsContact C-N 3.27Å; G179-K264 WeakPolarHBondContact CA-O 3.27Å
180	Q	91.3	Very high	91.5	Very high	141 Å²	141	66.9 Å²	66.9	66%	0.659	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-12.4	172.5	-56.5	-50.2	-63	0	0	112.8	T176 L177 V178	T176-Q180 PolarHBondContact O-N 3.39Å; T176-Q180 PolarHBondContact O-NE2 3.34Å; L177-Q180 WeakPolarHBondContact O-CB 3.45Å; L177-Q180 PolarHBondContact O-N 3.27Å; L177-Q180 VanDerWaalsContact O-N 3.09Å; V178-Q180 PolarHBondContact O-N 2.94Å
181	L	91.6	Very high	91.6	Very high	65 Å²	65	63.9 Å²	63.9	34%	0.34	35%	0.35	S	S	.	.	S	Bend	trans	-76.7	147.9	179.1	-60.1	175.1	0	0	0	110.9	V178 G179 K187 L190	V178-L181 VanDerWaalsContact O-CB 3.29Å; V178-L181 WeakPolarHBondContact O-CB 3.26Å; V178-L181 PolarHBondContact O-N 2.88Å; G179-L181 VanDerWaalsContact C-N 3.27Å; L181-K187 HydrophobicContact CB-CB 4.21Å; L181-K187 HydrophobicContact CB-CD 4.45Å; L181-K187 HydrophobicContact CB-CG 4.2Å; L181-K187 WeakPolarHBondContact O-CD 3.25Å; L181-K187 WeakPolarHBondContact O-CE 3.35Å; L181-K187 PolarHBondContact O-NZ 3.34Å; L181-K187 VanDerWaalsContact O-NZ 3.09Å; L181-L190 HydrophobicContact CD1-CD1 3.57Å
182	P	90.4	Very high	91.6	Very high	101 Å²	101	65.4 Å²	65.4	66%	0.656	36%	0.356	S	S	*	.			trans	-65.7	151.2	173.1	28.8	-35.1	0	0	0	111.1	S184	P182-S184 PolarHBondContact O-N 3.3Å; P182-S184 PolarHBondContact O-OG 3.49Å
183	D	86.2	Confident	91.7	Very high	146 Å²	146	66.3 Å²	66.3	78%	0.781	36%	0.359	S	S	*	.	S	Bend	trans	-61.3	109.4	179.6	-71.1	-25.3	0	0	0	110.7	K187	D183-K187 WeakPolarHBondContact OD1-CD 2.92Å; D183-K187 IonicContact OD1-NZ 2.74Å; D183-K187 PolarHBondContact OD1-NZ 3.41Å
184	S	89.8	Confident	91.7	Very high	42 Å²	42	62.8 Å²	62.8	29%	0.294	34%	0.343	S	S	.	.	S	Bend	trans	-152.8	162.7	-172.1	58.1	0	0	0	0	110	P182 L186 K187 N188	P182-S184 PolarHBondContact O-N 3.3Å; P182-S184 PolarHBondContact O-OG 3.49Å; S184-L186 PolarHBondContact O-N 2.98Å; S184-K187 PolarHBondContact O-N 3.01Å; S184-K187 PolarHBondContact OG-N 3Å; S184-K187 VanDerWaalsContact OG-N 3.14Å; S184-N188 PolarHBondContact O-N 2.95Å; S184-N188 VanDerWaalsContact O-N 3.15Å; S184-N188 PolarHBondContact O-ND2 3.03Å
185	S	89.6	Confident	91.7	Very high	104 Å²	104	62.6 Å²	62.6	73%	0.727	34%	0.338	S	S	*	.	H	α-helix	trans	-57.8	-36	171.5	51.5	0	0	0	0	111.8	N188 W189	S185-N188 PolarHBondContact O-N 3.4Å; S185-W189 WeakPolarHBondContact O-CB 3.1Å; S185-W189 PolarHBondContact O-N 3.27Å
186	L	91.9	Very high	91.8	Very high	99 Å²	99	64.1 Å²	64.1	52%	0.518	35%	0.346	S	S	.	.	H	α-helix	trans	-64.8	-45.8	176.6	-179.6	62.6	0	0	0	112.2	S184 N188 W189 L190	S184-L186 PolarHBondContact O-N 2.98Å; L186-N188 VanDerWaalsContact C-N 3.31Å; L186-N188 PolarHBondContact O-N 2.86Å; L186-W189 HydrophobicContact CD1-CE3 4.1Å; L186-W189 PolarHBondContact O-N 2.94Å; L186-L190 HydrophobicContact CD1-CD1 4.14Å; L186-L190 HydrophobicContact CD1-CG 4.16Å; L186-L190 HydrophobicContact CG-CD1 4Å; L186-L190 HydrophobicContact CG-CG 4.44Å; L186-L190 WeakPolarHBondContact O-CB 3.4Å; L186-L190 WeakPolarHBondContact O-CG 3.39Å; L186-L190 PolarHBondContact O-N 3.3Å
187	K	92.3	Very high	91.8	Very high	22 Å²	22	62.7 Å²	62.7	10%	0.096	34%	0.338	C	S	.	.	H	α-helix	trans	-56.7	-46.6	174.8	178.7	-174	-174.5	170	0	111.1	V178 L181 D183 S184 L190 S191	V178-K187 HydrophobicContact CG1-CG 3.96Å; V178-K187 WeakPolarHBondContact CG1-O 3.38Å; L181-K187 HydrophobicContact CB-CB 4.21Å; L181-K187 HydrophobicContact CB-CD 4.45Å; L181-K187 HydrophobicContact CB-CG 4.2Å; L181-K187 WeakPolarHBondContact O-CD 3.25Å; L181-K187 WeakPolarHBondContact O-CE 3.35Å; L181-K187 PolarHBondContact O-NZ 3.34Å; L181-K187 VanDerWaalsContact O-NZ 3.09Å; D183-K187 WeakPolarHBondContact OD1-CD 2.92Å; D183-K187 IonicContact OD1-NZ 2.74Å; D183-K187 PolarHBondContact OD1-NZ 3.41Å; S184-K187 PolarHBondContact O-N 3.01Å; S184-K187 PolarHBondContact OG-N 3Å; S184-K187 VanDerWaalsContact OG-N 3.14Å; K187-L190 PolarHBondContact O-N 3.31Å; K187-S191 WeakPolarHBondContact O-CB 3.41Å; K187-S191 PolarHBondContact O-N 3.38Å
188	N	90.7	Very high	91.8	Very high	68 Å²	68	57.4 Å²	57.4	36%	0.364	31%	0.31	S	S	.	.	H	α-helix	trans	-62.4	-46.2	179	-70.1	-26.9	0	0	0	111.6	S184 S185 L186 S191 E192	S184-N188 PolarHBondContact O-N 2.95Å; S184-N188 VanDerWaalsContact O-N 3.15Å; S184-N188 PolarHBondContact O-ND2 3.03Å; S185-N188 PolarHBondContact O-N 3.4Å; L186-N188 VanDerWaalsContact C-N 3.31Å; L186-N188 PolarHBondContact O-N 2.86Å; N188-S191 WeakPolarHBondContact O-CB 3.47Å; N188-S191 PolarHBondContact O-N 2.99Å; N188-E192 WeakPolarHBondContact O-CG 3.37Å; N188-E192 PolarHBondContact O-N 2.95Å
189	W	92.1	Very high	91.8	Very high	152 Å²	152	57.3 Å²	57.3	58%	0.576	31%	0.31	S	S	*	.	H	α-helix	trans	-62.4	-45.7	177.6	177.4	80.8	0	0	0	112.6	S185 L186 S191 E192 L193	S185-W189 WeakPolarHBondContact O-CB 3.1Å; S185-W189 PolarHBondContact O-N 3.27Å; L186-W189 HydrophobicContact CD1-CE3 4.1Å; L186-W189 PolarHBondContact O-N 2.94Å; W189-S191 VanDerWaalsContact C-N 3.32Å; W189-S191 PolarHBondContact O-N 2.91Å; W189-E192 PolarHBondContact O-N 3.49Å; W189-L193 HydrophobicContact CH2-CD2 3.85Å; W189-L193 HydrophobicContact CZ2-CD2 4.2Å; W189-L193 HydrophobicContact CZ3-CD2 4.23Å; W189-L193 WeakPolarHBondContact O-CB 3.21Å; W189-L193 PolarHBondContact O-N 2.78Å
190	L	93.9	Very high	92	Very high	46 Å²	46	58.7 Å²	58.7	24%	0.241	31%	0.31	C	S	.	.	H	α-helix	trans	-62.9	-39.8	175.7	-75.2	172.6	0	0	0	111.8	V178 L181 L186 K187 L193 V194	V178-L190 HydrophobicContact CG1-CB 4.18Å; V178-L190 HydrophobicContact CG2-CB 3.87Å; L181-L190 HydrophobicContact CD1-CD1 3.57Å; L186-L190 HydrophobicContact CD1-CD1 4.14Å; L186-L190 HydrophobicContact CD1-CG 4.16Å; L186-L190 HydrophobicContact CG-CD1 4Å; L186-L190 HydrophobicContact CG-CG 4.44Å; L186-L190 WeakPolarHBondContact O-CB 3.4Å; L186-L190 WeakPolarHBondContact O-CG 3.39Å; L186-L190 PolarHBondContact O-N 3.3Å; K187-L190 PolarHBondContact O-N 3.31Å; L190-L193 PolarHBondContact O-N 2.8Å; L190-V194 VanDerWaalsContact O-CG2 3.32Å; L190-V194 WeakPolarHBondContact O-CG2 3.43Å; L190-V194 PolarHBondContact O-N 2.85Å
191	S	92.9	Very high	92	Very high	3 Å²	3	52.1 Å²	52.1	2%	0.021	28%	0.279	C	S	.	.	H	α-helix	trans	-61.3	-50.1	176.1	-178.9	0	0	0	0	110.9	K187 N188 W189 L193 V194 H195 A265	K187-S191 WeakPolarHBondContact O-CB 3.41Å; K187-S191 PolarHBondContact O-N 3.38Å; N188-S191 WeakPolarHBondContact O-CB 3.47Å; N188-S191 PolarHBondContact O-N 2.99Å; W189-S191 VanDerWaalsContact C-N 3.32Å; W189-S191 PolarHBondContact O-N 2.91Å; S191-L193 VanDerWaalsContact C-N 3.33Å; S191-L193 PolarHBondContact O-N 3.43Å; S191-V194 PolarHBondContact O-N 3.34Å; S191-H195 PolarHBondContact O-N 2.79Å; S191-H195 PolarHBondContact O-ND1 3.44Å; S191-H195 PolarHBondContact OG-CE1 3.3Å; S191-H195 PolarHBondContact OG-ND1 2.66Å; S191-A265 WeakPolarHBondContact CB-O 3.42Å; S191-A265 WeakPolarHBondContact OG-CB 3.25Å; S191-A265 PolarHBondContact OG-O 3.24Å
192	E	93.1	Very high	92.1	Very high	46 Å²	46	49.8 Å²	49.8	22%	0.215	27%	0.268	C	S	.	.	H	α-helix	trans	-58.5	-45.3	175.7	-71	179	-145.3	0	0	110.7	N188 W189 V194 H195 L196 K221 C243 L296	N188-E192 WeakPolarHBondContact O-CG 3.37Å; N188-E192 PolarHBondContact O-N 2.95Å; W189-E192 PolarHBondContact O-N 3.49Å; E192-V194 PolarHBondContact O-N 2.91Å; E192-H195 PolarHBondContact O-N 2.68Å; E192-L196 WeakPolarHBondContact O-CB 3.4Å; E192-L196 VanDerWaalsContact O-CG 3.23Å; E192-L196 WeakPolarHBondContact O-CG 3.36Å; E192-L196 PolarHBondContact O-N 3.26Å; E192-K221 WeakPolarHBondContact OE1-CE 3.45Å; E192-K221 IonicContact OE1-NZ 3.72Å; E192-K221 PolarHBondContact OE1-NZ 2.69Å; E192-C243 HydrophobicContact CG-CB 4.16Å; E192-L296 HydrophobicContact CG-CD1 4.5Å; E192-L296 HydrophobicContact CG-CD2 4.17Å
193	L	92.8	Very high	92.2	Very high	55 Å²	55	45.4 Å²	45.4	29%	0.288	24%	0.24	S	C	.	.	H	α-helix	trans	-59.5	-45.1	177.9	-178.1	64.8	0	0	0	112.7	W189 L190 S191 T197	W189-L193 HydrophobicContact CH2-CD2 3.85Å; W189-L193 HydrophobicContact CZ2-CD2 4.2Å; W189-L193 HydrophobicContact CZ3-CD2 4.23Å; W189-L193 WeakPolarHBondContact O-CB 3.21Å; W189-L193 PolarHBondContact O-N 2.78Å; L190-L193 PolarHBondContact O-N 2.8Å; S191-L193 VanDerWaalsContact C-N 3.33Å; S191-L193 PolarHBondContact O-N 3.43Å; L193-T197 VanDerWaalsContact O-CB 3.26Å; L193-T197 WeakPolarHBondContact O-CB 3.27Å; L193-T197 PolarHBondContact O-N 3.3Å; L193-T197 PolarHBondContact O-OG1 2.7Å
194	V	93.4	Very high	92.4	Very high	27 Å²	27	41.1 Å²	41.1	16%	0.164	21%	0.212	C	C	.	.	H	α-helix	trans	-62.8	-49.2	177.4	168.2	0	0	0	0	110.4	L171 T175 V178 L190 S191 E192 T197 C198	L171-V194 HydrophobicContact CD1-CG1 4.44Å; T175-V194 HydrophobicContact CG2-CG1 4.01Å; V178-V194 HydrophobicContact CG2-CG2 4.1Å; L190-V194 VanDerWaalsContact O-CG2 3.32Å; L190-V194 WeakPolarHBondContact O-CG2 3.43Å; L190-V194 PolarHBondContact O-N 2.85Å; S191-V194 PolarHBondContact O-N 3.34Å; E192-V194 PolarHBondContact O-N 2.91Å; V194-T197 PolarHBondContact O-N 3.14Å; V194-C198 WeakPolarHBondContact O-CB 3.15Å; V194-C198 PolarHBondContact O-N 3.28Å; V194-C198 PolarHBondContact O-SG 3.44Å
195	H	93.1	Very high	92.5	Very high	8 Å²	8	39.2 Å²	39.2	4%	0.037	20%	0.199	C	C	.	.	H	α-helix	trans	-61.2	-50.1	179.7	-73.9	95.2	0	0	0	111.5	S191 E192 T197 C198 C199 T239 H268	S191-H195 PolarHBondContact O-N 2.79Å; S191-H195 PolarHBondContact O-ND1 3.44Å; S191-H195 PolarHBondContact OG-CE1 3.3Å; S191-H195 PolarHBondContact OG-ND1 2.66Å; E192-H195 PolarHBondContact O-N 2.68Å; H195-T197 PolarHBondContact O-N 2.92Å; H195-C198 PolarHBondContact O-N 3.05Å; H195-C199 VanDerWaalsContact O-CB 3.26Å; H195-C199 WeakPolarHBondContact O-CB 3.47Å; H195-C199 PolarHBondContact O-N 2.66Å; H195-C199 PolarHBondContact O-SG 3.39Å; H195-C199 VanDerWaalsContact O-SG 3.35Å; H195-T239 HydrophobicContact CB-CG2 4.44Å; H195-H268 AromaticContact NE2-NE2 3.74Å
196	L	93.3	Very high	92.7	Very high	32 Å²	32	34.9 Å²	34.9	17%	0.168	17%	0.167	C	C	.	.	H	α-helix	trans	-55.1	-51.4	177.1	-73.6	175.6	0	0	0	111.1	E192 R200 T239	E192-L196 WeakPolarHBondContact O-CB 3.4Å; E192-L196 VanDerWaalsContact O-CG 3.23Å; E192-L196 WeakPolarHBondContact O-CG 3.36Å; E192-L196 PolarHBondContact O-N 3.26Å; L196-R200 WeakPolarHBondContact O-CB 3.16Å; L196-R200 WeakPolarHBondContact O-CD 3.3Å; L196-R200 WeakPolarHBondContact O-CG 3.31Å; L196-R200 PolarHBondContact O-N 2.82Å; L196-T239 WeakPolarHBondContact CD2-O 3.45Å
197	T	92.6	Very high	92.7	Very high	16 Å²	16	31.3 Å²	31.3	10%	0.098	15%	0.151	C	C	.	.	H	α-helix	trans	-63.1	-47.4	-176.2	-58.1	0	0	0	0	111.2	V27 L193 V194 H195 R200 I201	V27-T197 HydrophobicContact CB-CG2 4.47Å; V27-T197 HydrophobicContact CG2-CG2 3.7Å; L193-T197 VanDerWaalsContact O-CB 3.26Å; L193-T197 WeakPolarHBondContact O-CB 3.27Å; L193-T197 PolarHBondContact O-N 3.3Å; L193-T197 PolarHBondContact O-OG1 2.7Å; V194-T197 PolarHBondContact O-N 3.14Å; H195-T197 PolarHBondContact O-N 2.92Å; T197-R200 PolarHBondContact O-N 3.48Å; T197-I201 HydrophobicContact CG2-CD1 4.21Å; T197-I201 WeakPolarHBondContact O-CG1 3.21Å; T197-I201 PolarHBondContact O-N 3.06Å
198	C	93.8	Very high	92.7	Very high	5 Å²	5	31.2 Å²	31.2	3%	0.034	16%	0.156	C	C	.	.	H	α-helix	trans	-70.1	-40.9	-177	-61.3	0	0	0	0	111.9	L170 L171 V194 H195 R200 I201 C202	L170-C198 VanDerWaalsContact C-SG 3.59Å; L171-C198 VanDerWaalsContact CA-SG 3.55Å; L171-C198 HydrophobicContact CB-CB 3.75Å; L171-C198 HydrophobicContact CD1-CB 3.95Å; L171-C198 HydrophobicContact CG-CB 4.38Å; L171-C198 PolarHBondContact N-SG 3.41Å; V194-C198 WeakPolarHBondContact O-CB 3.15Å; V194-C198 PolarHBondContact O-N 3.28Å; V194-C198 PolarHBondContact O-SG 3.44Å; H195-C198 PolarHBondContact O-N 3.05Å; C198-R200 VanDerWaalsContact C-N 3.31Å; C198-R200 PolarHBondContact O-N 3.09Å; C198-I201 PolarHBondContact O-N 3.18Å; C198-C202 PolarHBondContact O-N 3.28Å; C198-C202 PolarHBondContact O-SG 2.89Å; C198-C202 VanDerWaalsContact O-SG 3.33Å
199	C	93.6	Very high	92.8	Very high	8 Å²	8	29.5 Å²	29.5	5%	0.054	15%	0.148	C	C	.	.	H	α-helix	trans	-62.7	-38.2	173.7	-72	0	0	0	0	111.6	H195 I201 C202 V203 L236 T239 T240	H195-C199 VanDerWaalsContact O-CB 3.26Å; H195-C199 WeakPolarHBondContact O-CB 3.47Å; H195-C199 PolarHBondContact O-N 2.66Å; H195-C199 PolarHBondContact O-SG 3.39Å; H195-C199 VanDerWaalsContact O-SG 3.35Å; C199-I201 PolarHBondContact O-N 3.29Å; C199-C202 PolarHBondContact O-N 2.7Å; C199-V203 WeakPolarHBondContact O-CB 3.38Å; C199-V203 WeakPolarHBondContact O-CG2 3.3Å; C199-V203 PolarHBondContact O-N 2.77Å; C199-L236 HydrophobicContact CB-CD2 4.49Å; C199-T239 HydrophobicContact CB-CG2 3.86Å; C199-T239 WeakPolarHBondContact SG-CG2 3.34Å; C199-T240 HydrophobicContact CB-CG2 4.38Å
200	R	93.3	Very high	92.9	Very high	47 Å²	47	23.5 Å²	23.5	18%	0.177	13%	0.127	C	C	.	.	H	α-helix	trans	-61.8	-42	173.4	-74.9	168.8	-177.9	167.3	1.6	112.2	S26 V27 L196 T197 C198 V203 R204 T240	S26-R200 WeakPolarHBondContact O-CD 3.41Å; S26-R200 PolarHBondContact O-NH1 3.42Å; V27-R200 PolarHBondContact O-NH1 3.15Å; L196-R200 WeakPolarHBondContact O-CB 3.16Å; L196-R200 WeakPolarHBondContact O-CD 3.3Å; L196-R200 WeakPolarHBondContact O-CG 3.31Å; L196-R200 PolarHBondContact O-N 2.82Å; T197-R200 PolarHBondContact O-N 3.48Å; C198-R200 VanDerWaalsContact C-N 3.31Å; C198-R200 PolarHBondContact O-N 3.09Å; R200-V203 PolarHBondContact O-N 3.34Å; R200-R204 WeakPolarHBondContact O-CB 2.99Å; R200-R204 WeakPolarHBondContact O-CD 3.37Å; R200-R204 WeakPolarHBondContact O-CG 3.5Å; R200-R204 PolarHBondContact O-N 2.93Å; R200-T240 HydrophobicContact CB-CG2 4.23Å; R200-T240 HydrophobicContact CG-CG2 3.67Å; R200-T240 PolarHBondContact NE-O 2.94Å; R200-T240 VanDerWaalsContact NE-O 3.11Å; R200-T240 PolarHBondContact NH2-O 2.83Å
201	I	92.1	Very high	92.9	Very high	2 Å²	2	25.5 Å²	25.5	1%	0.01	14%	0.135	C	C	.	.	H	α-helix	trans	-61.9	-46.7	174.3	-65.6	166.1	0	0	0	110.2	L23 S26 L163 L170 T197 C198 C199 V203 R204 A205	L23-I201 HydrophobicContact CG-CD1 4.24Å; S26-I201 WeakPolarHBondContact OG-CG1 3.25Å; L163-I201 WeakPolarHBondContact O-CG2 3.41Å; L170-I201 HydrophobicContact CD1-CD1 3.96Å; T197-I201 HydrophobicContact CG2-CD1 4.21Å; T197-I201 WeakPolarHBondContact O-CG1 3.21Å; T197-I201 PolarHBondContact O-N 3.06Å; C198-I201 PolarHBondContact O-N 3.18Å; C199-I201 PolarHBondContact O-N 3.29Å; I201-V203 PolarHBondContact O-N 2.87Å; I201-R204 PolarHBondContact O-N 3.48Å; I201-A205 WeakPolarHBondContact O-CB 3.33Å; I201-A205 PolarHBondContact O-N 3.38Å
202	C	93.5	Very high	93.1	Very high	17 Å²	17	27.4 Å²	27.4	12%	0.115	14%	0.142	C	C	.	.	H	α-helix	trans	-62.8	-41.4	178.6	-69	0	0	0	0	112.8	C198 C199 A205 L206 L236	C198-C202 PolarHBondContact O-N 3.28Å; C198-C202 PolarHBondContact O-SG 2.89Å; C198-C202 VanDerWaalsContact O-SG 3.33Å; C199-C202 PolarHBondContact O-N 2.7Å; C202-A205 VanDerWaalsContact O-CB 3.3Å; C202-A205 WeakPolarHBondContact O-CB 3.25Å; C202-A205 PolarHBondContact O-N 2.67Å; C202-L206 PolarHBondContact O-N 3.4Å; C202-L236 HydrophobicContact CB-CD1 4.17Å
203	V	93.5	Very high	93.3	Very high	9 Å²	9	28.2 Å²	28.2	6%	0.055	15%	0.146	C	C	.	.	H	α-helix	trans	-66.1	-41.1	175.1	168	0	0	0	0	110.7	C199 R200 I201 A205 L206 S207 G208 I210 L236 I237 T240	C199-V203 WeakPolarHBondContact O-CB 3.38Å; C199-V203 WeakPolarHBondContact O-CG2 3.3Å; C199-V203 PolarHBondContact O-N 2.77Å; R200-V203 PolarHBondContact O-N 3.34Å; I201-V203 PolarHBondContact O-N 2.87Å; V203-A205 VanDerWaalsContact C-N 3.27Å; V203-A205 PolarHBondContact O-N 2.6Å; V203-L206 CarbonylContact O-C 3.53Å; V203-L206 WeakPolarHBondContact O-CA 3.5Å; V203-L206 WeakPolarHBondContact O-CB 3.26Å; V203-L206 PolarHBondContact O-N 3.19Å; V203-S207 PolarHBondContact O-N 3.08Å; V203-G208 WeakPolarHBondContact O-CA 3.46Å; V203-G208 PolarHBondContact O-N 2.75Å; V203-I210 HydrophobicContact CG1-CD1 3.69Å; V203-I210 HydrophobicContact CG1-CG1 4.38Å; V203-I210 HydrophobicContact CG2-CD1 4.46Å; V203-L236 HydrophobicContact CG2-CB 3.96Å; V203-I237 HydrophobicContact CG2-CG1 4.43Å; V203-T240 HydrophobicContact CB-CG2 3.86Å; V203-T240 HydrophobicContact CG1-CG2 4.34Å; V203-T240 HydrophobicContact CG2-CG2 3.54Å
204	R	90.3	Very high	93.6	Very high	56 Å²	56	28.6 Å²	28.6	21%	0.211	15%	0.148	C	C	.	.	H	α-helix	trans	-63.1	-33.6	173.4	-72.7	169.5	-174.4	-163.2	0.7	112.3	I22 P25 S26 V30 R200 I201 L206 S207	I22-R204 HydrophobicContact CG2-CB 4.49Å; I22-R204 PolarHBondContact O-NH1 3.34Å; P25-R204 VanDerWaalsContact C-NH1 3.29Å; P25-R204 PolarHBondContact O-NH2 2.91Å; P25-R204 VanDerWaalsContact O-NH2 3.12Å; S26-R204 VanDerWaalsContact CA-NH1 3.27Å; S26-R204 WeakPolarHBondContact OG-CD 3.41Å; S26-R204 VanDerWaalsContact OG-CZ 3.31Å; S26-R204 PolarHBondContact OG-NH1 2.92Å; V30-R204 PolarHBondContact O-NH2 3.44Å; R200-R204 WeakPolarHBondContact O-CB 2.99Å; R200-R204 WeakPolarHBondContact O-CD 3.37Å; R200-R204 WeakPolarHBondContact O-CG 3.5Å; R200-R204 PolarHBondContact O-N 2.93Å; I201-R204 PolarHBondContact O-N 3.48Å; R204-L206 PolarHBondContact O-N 2.5Å; R204-S207 WeakPolarHBondContact O-CA 3.33Å; R204-S207 PolarHBondContact O-N 2.94Å
205	A	91.7	Very high	93.8	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.008	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-11.6	170.7	0	0	0	0	0	113.2	R160 L163 A164 I201 C202 V203	R160-A205 WeakPolarHBondContact CB-O 3.43Å; R160-A205 WeakPolarHBondContact CD-O 3.18Å; R160-A205 WeakPolarHBondContact CG-O 3.48Å; L163-A205 HydrophobicContact CB-CB 3.59Å; A164-A205 HydrophobicContact CB-CB 4.17Å; I201-A205 WeakPolarHBondContact O-CB 3.33Å; I201-A205 PolarHBondContact O-N 3.38Å; C202-A205 VanDerWaalsContact O-CB 3.3Å; C202-A205 WeakPolarHBondContact O-CB 3.25Å; C202-A205 PolarHBondContact O-N 2.67Å; V203-A205 VanDerWaalsContact C-N 3.27Å; V203-A205 PolarHBondContact O-N 2.6Å
206	L	92.6	Very high	94	Very high	13 Å²	13	37.2 Å²	37.2	7%	0.068	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.6	7.3	170.6	-60.5	179.2	0	0	0	112.3	C202 V203 R204 G208 I233 M356 M357 I362	C202-L206 PolarHBondContact O-N 3.4Å; V203-L206 CarbonylContact O-C 3.53Å; V203-L206 WeakPolarHBondContact O-CA 3.5Å; V203-L206 WeakPolarHBondContact O-CB 3.26Å; V203-L206 PolarHBondContact O-N 3.19Å; R204-L206 PolarHBondContact O-N 2.5Å; L206-G208 PolarHBondContact O-N 2.89Å; L206-I233 HydrophobicContact CD1-CG2 4.23Å; L206-M356 HydrophobicContact CD2-CB 4.06Å; L206-M357 HydrophobicContact CD2-CG 3.91Å; L206-I362 HydrophobicContact CB-CG1 4.04Å; L206-I362 PolarHBondContact O-N 3.14Å
207	S	91.9	Very high	94.2	Very high	24 Å²	24	40 Å²	40	17%	0.168	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	48	42.7	-163.7	-57.3	0	0	0	0	111.2	R160 V203 R204 T209 A361	R160-S207 PolarHBondContact NE-OG 3.04Å; R160-S207 PolarHBondContact NH2-OG 2.75Å; V203-S207 PolarHBondContact O-N 3.08Å; R204-S207 WeakPolarHBondContact O-CA 3.33Å; R204-S207 PolarHBondContact O-N 2.94Å; S207-T209 PolarHBondContact O-N 3.23Å; S207-A361 WeakPolarHBondContact O-CB 3.25Å
208	G	92.6	Very high	94.4	Very high	20 Å²	20	43 Å²	43	21%	0.206	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	120.4	-178.5	0	0	0	0	0	111.3	V203 L206 I362	V203-G208 WeakPolarHBondContact O-CA 3.46Å; V203-G208 PolarHBondContact O-N 2.75Å; L206-G208 PolarHBondContact O-N 2.89Å; G208-I362 CarbonylContact C-O 3.48Å; G208-I362 WeakPolarHBondContact CA-O 3.46Å
209	T	91.9	Very high	94.6	Very high	32 Å²	32	43.5 Å²	43.5	20%	0.196	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	113	172.2	-56.4	0	0	0	0	107.7	S207 I362 V363 C364	S207-T209 PolarHBondContact O-N 3.23Å; T209-I362 PolarHBondContact N-O 3Å; T209-V363 WeakPolarHBondContact O-CA 3.48Å; T209-C364 PolarHBondContact O-N 2.93Å; T209-C364 VanDerWaalsContact O-N 3.09Å
210	I	94.2	Very high	94.7	Very high	27 Å²	27	48.3 Å²	48.3	14%	0.138	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	123.7	-172.5	-51.2	162.4	0	0	0	108.7	V203 Y212 I237 T240 C364 V366	V203-I210 HydrophobicContact CG1-CD1 3.69Å; V203-I210 HydrophobicContact CG1-CG1 4.38Å; V203-I210 HydrophobicContact CG2-CD1 4.46Å; I210-Y212 HydrophobicContact CB-CE2 3.84Å; I210-Y212 HydrophobicContact CG2-CD1 4.19Å; I210-Y212 HydrophobicContact CG2-CD2 4.1Å; I210-Y212 HydrophobicContact CG2-CE1 3.67Å; I210-Y212 HydrophobicContact CG2-CE2 3.59Å; I210-Y212 HydrophobicContact CG2-CG 4.38Å; I210-I237 HydrophobicContact CD1-CB 4.05Å; I210-I237 HydrophobicContact CD1-CG1 4Å; I210-I237 HydrophobicContact CD1-CG2 3.79Å; I210-I237 HydrophobicContact CG1-CG1 4.48Å; I210-I237 HydrophobicContact CG1-CG2 4.1Å; I210-I237 HydrophobicContact CG2-CG2 4.05Å; I210-T240 WeakPolarHBondContact CD1-OG1 3.43Å; I210-C364 WeakPolarHBondContact CA-O 3.4Å; I210-V366 HydrophobicContact CG2-CB 4.42Å; I210-V366 HydrophobicContact CG2-CG2 3.67Å
211	H	95.2	Very high	94.8	Very high	88 Å²	88	50.3 Å²	50.3	41%	0.407	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	107.3	176.6	-60.3	-59.7	0	0	0	109.1	H213 C364 D365 V366	H211-H213 PolarHBondContact O-CD2 3.49Å; H211-C364 PolarHBondContact N-O 2.73Å; H211-D365 VanDerWaalsContact CB-OD1 3.3Å; H211-D365 WeakPolarHBondContact CB-OD1 3.4Å; H211-D365 IonicContact CG-OD1 2.76Å; H211-D365 CarbonylContact O-C 3.5Å; H211-D365 WeakPolarHBondContact O-CA 3.34Å; H211-V366 PolarHBondContact O-N 2.93Å
212	Y	96.9	Very high	94.8	Very high	43 Å²	43	50.3 Å²	50.3	17%	0.169	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	124.4	179.9	-65.2	-77.9	0	0	0	110.8	I210 I237 T240 D241 V366 Y368	I210-Y212 HydrophobicContact CB-CE2 3.84Å; I210-Y212 HydrophobicContact CG2-CD1 4.19Å; I210-Y212 HydrophobicContact CG2-CD2 4.1Å; I210-Y212 HydrophobicContact CG2-CE1 3.67Å; I210-Y212 HydrophobicContact CG2-CE2 3.59Å; I210-Y212 HydrophobicContact CG2-CG 4.38Å; Y212-I237 PolarHBondContact OH-O 3.44Å; Y212-T240 PolarHBondContact OH-OG1 3.32Å; Y212-D241 HydrophobicContact CD1-CB 3.98Å; Y212-D241 HydrophobicContact CD2-CB 4.32Å; Y212-D241 HydrophobicContact CE1-CB 3.49Å; Y212-D241 VanDerWaalsContact CE1-CB 3.49Å; Y212-D241 HydrophobicContact CE2-CB 3.85Å; Y212-D241 HydrophobicContact CG-CB 4.36Å; Y212-D241 VanDerWaalsContact CZ-CB 3.41Å; Y212-V366 WeakPolarHBondContact CA-O 3.31Å; Y212-V366 HydrophobicContact CD1-CB 3.77Å; Y212-V366 HydrophobicContact CD1-CG1 3.93Å; Y212-V366 HydrophobicContact CD1-CG2 4.36Å; Y212-V366 HydrophobicContact CE1-CB 4.03Å; Y212-V366 HydrophobicContact CE1-CG1 4.11Å; Y212-V366 HydrophobicContact CE1-CG2 4.15Å; Y212-Y368 AromaticContact CD1-CE2 3.75Å; Y212-Y368 HydrophobicContact CD1-CE2 3.75Å; Y212-Y368 AromaticContact CD1-CZ 3.9Å; Y212-Y368 WeakPolarHBondContact CD1-OH 3.41Å; Y212-Y368 WeakPolarHBondContact CE1-OH 3.48Å; Y212-Y368 HydrophobicContact CG-CE2 4.46Å
213	H	98.1	Very high	94.9	Very high	62 Å²	62	49.6 Å²	49.6	29%	0.287	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	148.8	179	-56.5	-80.4	0	0	0	110.3	H211 K215 D365 V366 W367 Y368	H211-H213 PolarHBondContact O-CD2 3.49Å; H213-K215 PolarHBondContact O-N 3.37Å; H213-D365 IonicContact CD2-OD1 3.09Å; H213-D365 IonicContact CE1-OD1 2.8Å; H213-D365 IonicContact NE2-OD1 3.39Å; H213-D365 PolarHBondContact NE2-OD1 2.69Å; H213-V366 PolarHBondContact N-O 3.08Å; H213-W367 HydrophobicContact CB-CB 4.45Å; H213-W367 HydrophobicContact CB-CG 3.88Å; H213-W367 AromaticContact CD2-CD1 3.76Å; H213-W367 AromaticContact CD2-CD2 3.86Å; H213-W367 AromaticContact CD2-CE2 3.46Å; H213-W367 VanDerWaalsContact CD2-CE2 3.46Å; H213-W367 AromaticContact CD2-CZ2 3.97Å; H213-W367 AromaticContact CD2-NE1 3.35Å; H213-W367 PolarHBondContact CD2-NE1 3.16Å; H213-W367 VanDerWaalsContact CD2-NE1 3.35Å; H213-W367 AromaticContact CG-CD1 3.59Å; H213-W367 AromaticContact CG-CE2 3.99Å; H213-W367 AromaticContact CG-NE1 3.37Å; H213-W367 AromaticContact NE2-CE2 3.93Å; H213-W367 AromaticContact NE2-CZ2 4Å; H213-W367 AromaticContact NE2-NE1 3.95Å; H213-Y368 WeakPolarHBondContact O-CD2 3.44Å; H213-Y368 PolarHBondContact O-N 3.19Å
214	N	98	Very high	95.1	Very high	64 Å²	64	49.2 Å²	49.2	34%	0.342	23%	0.232	S	C	.	.			trans	55.5	43.6	174.8	-59.3	-24.4	0	0	0	114.8	Q216 Y217 Y368	N214-Q216 VanDerWaalsContact CA-OE1 3.23Å; N214-Q216 PolarHBondContact O-N 3.33Å; N214-Q216 PolarHBondContact O-OE1 3.06Å; N214-Y217 HydrophobicContact CB-CD2 3.96Å; N214-Y217 PolarHBondContact O-N 3.15Å; N214-Y368 WeakPolarHBondContact CB-O 3.36Å; N214-Y368 WeakPolarHBondContact O-CB 3.5Å
215	K	97	Very high	95.4	Very high	92 Å²	92	46.5 Å²	46.5	40%	0.4	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-53	-21.1	-178.1	-71.6	-179.8	168.6	-158.2	0	114.9	H213 Y217 R218 D241	H213-K215 PolarHBondContact O-N 3.37Å; K215-Y217 PolarHBondContact O-N 3.14Å; K215-R218 VanDerWaalsContact CD-NH2 3.3Å; K215-R218 WeakPolarHBondContact O-CB 3.36Å; K215-R218 VanDerWaalsContact O-CD 3.27Å; K215-R218 WeakPolarHBondContact O-CD 3.45Å; K215-R218 WeakPolarHBondContact O-CG 3.4Å; K215-R218 PolarHBondContact O-N 3.13Å; K215-D241 IonicContact NZ-OD1 2.74Å; K215-D241 PolarHBondContact NZ-OD1 3.46Å
216	Q	97.6	Very high	95.7	Very high	124 Å²	124	46.5 Å²	46.5	58%	0.579	22%	0.222	S	C	*	.	G	3₁₀ helix	trans	-60.2	-26.1	172.1	67.5	-81.8	11.5	0	0	113.6	N214	N214-Q216 VanDerWaalsContact CA-OE1 3.23Å; N214-Q216 PolarHBondContact O-N 3.33Å; N214-Q216 PolarHBondContact O-OE1 3.06Å
217	Y	98.1	Very high	96	Very high	89 Å²	89	45.9 Å²	45.9	35%	0.349	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-98.2	15.8	179.3	-57.8	-50.6	0	0	0	113.9	N214 K215 M369 P370	N214-Y217 HydrophobicContact CB-CD2 3.96Å; N214-Y217 PolarHBondContact O-N 3.15Å; K215-Y217 PolarHBondContact O-N 3.14Å; Y217-M369 WeakPolarHBondContact CB-O 3.37Å; Y217-P370 HydrophobicContact CD1-CB 4.49Å; Y217-P370 HydrophobicContact CD2-CG 4.08Å; Y217-P370 HydrophobicContact CE1-CB 4.33Å; Y217-P370 HydrophobicContact CE1-CG 4.25Å; Y217-P370 HydrophobicContact CE2-CG 3.75Å; Y217-P370 HydrophobicContact CG-CG 4.5Å
218	R	97.5	Very high	96.3	Very high	81 Å²	81	44.8 Å²	44.8	31%	0.306	21%	0.211	S	C	.	.	P	Polyproline II helix	trans	-48.6	141.5	176.2	-83.7	166.4	179	172.5	-8.7	111.3	K215 Q220 D241 Y368	K215-R218 VanDerWaalsContact CD-NH2 3.3Å; K215-R218 WeakPolarHBondContact O-CB 3.36Å; K215-R218 VanDerWaalsContact O-CD 3.27Å; K215-R218 WeakPolarHBondContact O-CD 3.45Å; K215-R218 WeakPolarHBondContact O-CG 3.4Å; K215-R218 PolarHBondContact O-N 3.13Å; R218-Q220 PolarHBondContact O-N 3.39Å; R218-Q220 PolarHBondContact O-NE2 3.25Å; R218-D241 IonicContact CZ-OD1 3.66Å; R218-D241 IonicContact CZ-OD2 2.58Å; R218-D241 IonicContact NE-OD2 3.78Å; R218-D241 PolarHBondContact NE-OD2 2.85Å; R218-D241 IonicContact NH2-OD1 3.75Å; R218-D241 PolarHBondContact NH2-OD1 2.92Å; R218-D241 IonicContact NH2-OD2 2.66Å; R218-D241 PolarHBondContact NH2-OD2 2.83Å; R218-Y368 HydrophobicContact CG-CD1 4.41Å; R218-Y368 HydrophobicContact CG-CD2 3.8Å; R218-Y368 HydrophobicContact CG-CE1 4.33Å; R218-Y368 HydrophobicContact CG-CE2 3.68Å; R218-Y368 HydrophobicContact CG-CG 4.17Å
219	P	97.4	Very high	96.4	Very high	15 Å²	15	45.1 Å²	45.1	10%	0.097	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-55	130.6	176.7	-27.9	35.7	0	0	0	112.3	C225 Y244 P297 H327 V329 Y368	P219-C225 HydrophobicContact CB-CB 3.85Å; P219-C225 HydrophobicContact CG-CB 3.76Å; P219-C225 VanDerWaalsContact CG-SG 3.53Å; P219-Y244 HydrophobicContact CB-CE1 3.87Å; P219-Y244 HydrophobicContact CG-CE1 3.85Å; P219-P297 HydrophobicContact CB-CB 3.98Å; P219-P297 HydrophobicContact CB-CG 4.08Å; P219-H327 HydrophobicContact CB-CB 3.86Å; P219-H327 HydrophobicContact CG-CB 3.83Å; P219-V329 HydrophobicContact CG-CG2 4.13Å; P219-Y368 HydrophobicContact CG-CD1 4.42Å
220	Q	95.3	Very high	96.6	Very high	109 Å²	109	43.7 Å²	43.7	51%	0.509	20%	0.198	S	C	.	.	P	Polyproline II helix	trans	-98.4	155.9	-174.3	-60.6	-60.6	-38.6	0	0	111.8	R218 G223 P297 H327	R218-Q220 PolarHBondContact O-N 3.39Å; R218-Q220 PolarHBondContact O-NE2 3.25Å; Q220-G223 PolarHBondContact O-N 3.22Å; Q220-P297 WeakPolarHBondContact O-CB 3.47Å; Q220-H327 PolarHBondContact N-NE2 3.41Å
221	K	94.6	Very high	96.6	Very high	88 Å²	88	42.4 Å²	42.4	38%	0.383	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	138.9	175.5	-70.6	-174.7	171.2	-171.1	0	110.9	E192 G223 K293 K295	E192-K221 WeakPolarHBondContact OE1-CE 3.45Å; E192-K221 IonicContact OE1-NZ 3.72Å; E192-K221 PolarHBondContact OE1-NZ 2.69Å; K221-G223 PolarHBondContact O-N 3.18Å; K221-K293 VanDerWaalsContact CB-O 3.23Å; K221-K293 WeakPolarHBondContact CB-O 3.49Å; K221-K295 CarbonylContact C-O 3.56Å; K221-K295 VanDerWaalsContact CA-O 3.24Å; K221-K295 WeakPolarHBondContact CA-O 3.46Å; K221-K295 WeakPolarHBondContact CB-O 3.39Å
222	G	93.3	Very high	96.5	Very high	2 Å²	2	40.3 Å²	40.3	2%	0.021	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.8	16.2	-172.4	0	0	0	0	0	115.5	K293 K295	G222-K293 PolarHBondContact O-NZ 3.49Å; G222-K295 PolarHBondContact N-O 2.89Å
223	G	95.2	Very high	96.3	Very high	2 Å²	2	38.6 Å²	38.6	2%	0.021	18%	0.179	C	C	.	.	S	Bend	trans	-108.6	-177.9	170.3	0	0	0	0	0	112.9	Q220 K221 P297 I298	Q220-G223 PolarHBondContact O-N 3.22Å; K221-G223 PolarHBondContact O-N 3.18Å; G223-P297 VanDerWaalsContact O-CA 3.32Å; G223-P297 WeakPolarHBondContact O-CA 3.46Å; G223-I298 PolarHBondContact O-N 3.26Å
224	I	97.1	Very high	96.3	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.005	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	117.6	177.9	-57.2	172.5	0	0	0	108.6	V226 I290 I298 I300 I322 G323 T325 I326 H327	I224-V226 HydrophobicContact CG2-CG2 4.08Å; I224-I290 HydrophobicContact CD1-CD1 4.34Å; I224-I290 HydrophobicContact CD1-CG2 4.27Å; I224-I290 HydrophobicContact CG1-CG2 3.77Å; I224-I298 CarbonylContact C-O 3.5Å; I224-I298 WeakPolarHBondContact CA-O 3.02Å; I224-I300 HydrophobicContact CG2-CD1 3.82Å; I224-I300 HydrophobicContact CG2-CG1 4.15Å; I224-I322 HydrophobicContact CD1-CB 4Å; I224-I322 HydrophobicContact CD1-CD1 4.14Å; I224-I322 HydrophobicContact CD1-CG2 3.88Å; I224-G323 WeakPolarHBondContact CD1-O 3.29Å; I224-T325 PolarHBondContact N-O 3.42Å; I224-I326 HydrophobicContact CB-CD1 3.7Å; I224-I326 HydrophobicContact CD1-CD1 4.13Å; I224-I326 HydrophobicContact CG1-CD1 4.5Å; I224-I326 HydrophobicContact CG2-CD1 3.67Å; I224-I326 CarbonylContact O-C 3.59Å; I224-I326 WeakPolarHBondContact O-CA 3.48Å; I224-H327 PolarHBondContact O-N 3.36Å
225	C	98	Very high	96.1	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	123.6	170	-176.8	0	0	0	0	109.9	P219 Y244 I298 L299 I300 H327 V329	P219-C225 HydrophobicContact CB-CB 3.85Å; P219-C225 HydrophobicContact CG-CB 3.76Å; P219-C225 VanDerWaalsContact CG-SG 3.53Å; C225-Y244 HydrophobicContact CB-CD1 3.96Å; C225-Y244 HydrophobicContact CB-CE1 3.7Å; C225-I298 PolarHBondContact N-O 3.43Å; C225-L299 HydrophobicContact CB-CD1 4.02Å; C225-I300 PolarHBondContact O-N 3.04Å; C225-H327 WeakPolarHBondContact CA-O 3.31Å; C225-V329 VanDerWaalsContact SG-CG2 3.52Å
226	V	98.1	Very high	96	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	125	176.9	168.9	0	0	0	0	109.3	I224 I300 P302 F315 F320 I326 H327 P328 V329 V387 I391	I224-V226 HydrophobicContact CG2-CG2 4.08Å; V226-I300 WeakPolarHBondContact CA-O 3.45Å; V226-P302 HydrophobicContact CG1-CG 3.61Å; V226-F315 HydrophobicContact CG1-CD2 4.38Å; V226-F315 HydrophobicContact CG1-CE2 3.73Å; V226-F315 HydrophobicContact CG1-CZ 4.33Å; V226-F320 HydrophobicContact CG1-CZ 4.2Å; V226-F320 HydrophobicContact CG2-CZ 4.42Å; V226-I326 HydrophobicContact CB-CG2 3.91Å; V226-I326 HydrophobicContact CG2-CD1 3.68Å; V226-I326 HydrophobicContact CG2-CG2 3.71Å; V226-H327 PolarHBondContact N-O 3.22Å; V226-P328 CarbonylContact O-C 3.5Å; V226-P328 WeakPolarHBondContact O-CA 3.22Å; V226-V329 PolarHBondContact O-N 2.97Å; V226-V387 HydrophobicContact CB-CG1 4.43Å; V226-V387 HydrophobicContact CG1-CG1 3.98Å; V226-I391 HydrophobicContact CG1-CD1 3.99Å; V226-I391 WeakPolarHBondContact O-CD1 3.49Å
227	A	98	Very high	95.9	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	155.4	178.7	0	0	0	0	0	112.7	L238 I300 F301 V329 I331	A227-L238 HydrophobicContact CB-CD1 4.41Å; A227-I300 PolarHBondContact N-O 3.26Å; A227-F301 HydrophobicContact CB-CD1 4.14Å; A227-F301 HydrophobicContact CB-CE1 3.88Å; A227-V329 VanDerWaalsContact CA-O 3.26Å; A227-V329 WeakPolarHBondContact CA-O 3.23Å; A227-V329 HydrophobicContact CB-CB 4.17Å; A227-V329 WeakPolarHBondContact CB-O 3.45Å; A227-I331 HydrophobicContact CB-CD1 4.24Å
228	N	97.4	Very high	95.9	Very high	2 Å²	2	22 Å²	22	1%	0.011	11%	0.108	C	C	.	.			trans	-65.8	156.2	163.5	63.3	-65.3	0	0	0	110.4	N309 V312 I331 I391	N228-N309 PolarHBondContact ND2-ND2 3.43Å; N228-V312 HydrophobicContact CB-CG2 4.25Å; N228-I331 PolarHBondContact ND2-O 3.08Å; N228-I331 PolarHBondContact OD1-N 3.23Å; N228-I391 HydrophobicContact CB-CG2 4.06Å
229	H	96.4	Very high	95.8	Very high	26 Å²	26	18.5 Å²	18.5	12%	0.12	10%	0.096	C	C	.	.			trans	-128.5	118	-168.9	-161.7	32.2	0	0	0	113.5	S231 D234 F301 E303 C306 I307	H229-S231 PolarHBondContact CE1-O 3.35Å; H229-S231 VanDerWaalsContact CE1-O 3.23Å; H229-D234 WeakPolarHBondContact CA-OD2 3.35Å; H229-D234 IonicContact CE1-OD2 3.62Å; H229-D234 IonicContact CG-OD2 2.76Å; H229-D234 IonicContact ND1-OD2 2.77Å; H229-D234 PolarHBondContact ND1-OD2 2.87Å; H229-F301 HydrophobicContact CB-CB 3.79Å; H229-F301 HydrophobicContact CB-CD1 3.66Å; H229-F301 HydrophobicContact CB-CG 3.92Å; H229-F301 AromaticContact CE1-CD2 3.93Å; H229-F301 AromaticContact CG-CD1 3.65Å; H229-F301 AromaticContact CG-CG 3.6Å; H229-F301 AromaticContact ND1-CD1 3.48Å; H229-F301 WeakPolarHBondContact ND1-CD1 3.32Å; H229-F301 AromaticContact ND1-CD2 3.93Å; H229-F301 AromaticContact ND1-CE1 3.7Å; H229-F301 AromaticContact ND1-CG 3.59Å; H229-E303 PolarHBondContact N-OE2 3.46Å; H229-C306 VanDerWaalsContact CD2-SG 3.56Å; H229-C306 PolarHBondContact NE2-SG 2.83Å; H229-C306 VanDerWaalsContact NE2-SG 3.37Å; H229-C306 CarbonylContact O-C 3.6Å; H229-C306 WeakPolarHBondContact O-CA 3.2Å; H229-I307 PolarHBondContact O-N 3.19Å
230	T	96	Very high	95.6	Very high	2 Å²	2	18.4 Å²	18.4	1%	0.012	10%	0.095	C	C	.	.	S	Bend	trans	-113.3	-32.2	-179.8	-63.3	0	0	0	0	112.6	D234 C306 I307 N309 Y333 A340 F341 W342	T230-D234 PolarHBondContact N-OD2 3.47Å; T230-C306 WeakPolarHBondContact O-CB 3.39Å; T230-I307 VanDerWaalsContact CA-O 3.25Å; T230-I307 WeakPolarHBondContact CA-O 3.43Å; T230-I307 WeakPolarHBondContact CG2-O 3.32Å; T230-I307 PolarHBondContact OG1-O 3.01Å; T230-N309 HydrophobicContact CG2-CB 3.91Å; T230-N309 VanDerWaalsContact OG1-CB 3.28Å; T230-N309 WeakPolarHBondContact OG1-CB 3.4Å; T230-N309 PolarHBondContact OG1-ND2 3.27Å; T230-Y333 HydrophobicContact CG2-CD2 3.95Å; T230-Y333 HydrophobicContact CG2-CE2 3.96Å; T230-A340 HydrophobicContact CG2-CB 4.2Å; T230-F341 HydrophobicContact CG2-CB 4.27Å; T230-W342 PolarHBondContact O-N 3.19Å
231	S	94.4	Very high	95.5	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.078	C	C	.	.			trans	-164	157.4	-177.9	164.3	0	0	0	0	112.5	H229 I233 D234 A340 Y352	H229-S231 PolarHBondContact CE1-O 3.35Å; H229-S231 VanDerWaalsContact CE1-O 3.23Å; S231-I233 PolarHBondContact O-N 3.3Å; S231-I233 WeakPolarHBondContact OG-CG1 3.4Å; S231-I233 PolarHBondContact OG-N 2.9Å; S231-I233 VanDerWaalsContact OG-N 3.13Å; S231-D234 PolarHBondContact N-OD2 3.45Å; S231-D234 VanDerWaalsContact O-CB 3.25Å; S231-D234 WeakPolarHBondContact O-CB 3.3Å; S231-D234 PolarHBondContact O-N 3.48Å; S231-A340 VanDerWaalsContact CB-O 3.26Å; S231-A340 WeakPolarHBondContact CB-O 3.28Å; S231-Y352 VanDerWaalsContact CB-OH 3.25Å; S231-Y352 WeakPolarHBondContact CB-OH 3.14Å; S231-Y352 PolarHBondContact OG-OH 2.84Å
232	P	92.1	Very high	95.5	Very high	45 Å²	45	11.4 Å²	11.4	29%	0.292	7%	0.07	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-23.7	167.8	-27.8	36.3	0	0	0	114.9	D234 V235 W342 M349	P232-D234 PolarHBondContact O-N 3.3Å; P232-V235 PolarHBondContact O-N 2.91Å; P232-W342 HydrophobicContact CG-CD2 4.31Å; P232-W342 HydrophobicContact CG-CE3 3.75Å; P232-W342 HydrophobicContact CG-CZ3 4.05Å; P232-M349 HydrophobicContact CG-CE 4.16Å
233	I	93.9	Very high	95.5	Very high	6 Å²	6	11.9 Å²	11.9	3%	0.031	7%	0.073	C	C	.	.	H	α-helix	trans	-69.1	-17.3	176.6	77.8	-171.4	0	0	0	113	L206 S231 V235 L236 I237 Y333 A340 Y352 M356 I362	L206-I233 HydrophobicContact CD1-CG2 4.23Å; S231-I233 PolarHBondContact O-N 3.3Å; S231-I233 WeakPolarHBondContact OG-CG1 3.4Å; S231-I233 PolarHBondContact OG-N 2.9Å; S231-I233 VanDerWaalsContact OG-N 3.13Å; I233-V235 PolarHBondContact O-N 3.41Å; I233-V235 VanDerWaalsContact O-N 3.15Å; I233-L236 WeakPolarHBondContact O-CA 3.39Å; I233-L236 WeakPolarHBondContact O-CB 3.28Å; I233-L236 PolarHBondContact O-N 3.5Å; I233-I237 HydrophobicContact CD1-CD1 4.25Å; I233-I237 HydrophobicContact CG1-CD1 3.93Å; I233-I237 PolarHBondContact O-N 3.35Å; I233-Y333 HydrophobicContact CD1-CE1 4.18Å; I233-Y333 WeakPolarHBondContact CG1-OH 3.2Å; I233-A340 HydrophobicContact CD1-CB 4.19Å; I233-Y352 HydrophobicContact CG2-CE1 4.39Å; I233-M356 HydrophobicContact CD1-CE 3.29Å; I233-I362 HydrophobicContact CD1-CG2 4.2Å
234	D	96.5	Very high	95.5	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-53.4	-37.2	176.5	-61.1	-18.8	0	0	0	110.1	H229 T230 S231 P232 I237 L238 F301 I331 Y333	H229-D234 WeakPolarHBondContact CA-OD2 3.35Å; H229-D234 IonicContact CE1-OD2 3.62Å; H229-D234 IonicContact CG-OD2 2.76Å; H229-D234 IonicContact ND1-OD2 2.77Å; H229-D234 PolarHBondContact ND1-OD2 2.87Å; T230-D234 PolarHBondContact N-OD2 3.47Å; S231-D234 PolarHBondContact N-OD2 3.45Å; S231-D234 VanDerWaalsContact O-CB 3.25Å; S231-D234 WeakPolarHBondContact O-CB 3.3Å; S231-D234 PolarHBondContact O-N 3.48Å; P232-D234 PolarHBondContact O-N 3.3Å; D234-I237 PolarHBondContact O-N 3.33Å; D234-L238 WeakPolarHBondContact O-CG 3.48Å; D234-L238 PolarHBondContact O-N 2.9Å; D234-F301 HydrophobicContact CB-CE1 3.85Å; D234-F301 HydrophobicContact CB-CZ 3.72Å; D234-I331 HydrophobicContact CB-CD1 4.08Å; D234-Y333 WeakPolarHBondContact OD1-CE2 3.41Å; D234-Y333 PolarHBondContact OD1-OH 2.9Å
235	V	94.8	Very high	95.4	Very high	28 Å²	28	12.1 Å²	12.1	17%	0.17	7%	0.073	C	C	.	.	H	α-helix	trans	-61.5	-45.6	174.9	-179.8	0	0	0	0	111.4	P232 I233 I237 T239 M246 L299 F301	P232-V235 PolarHBondContact O-N 2.91Å; I233-V235 PolarHBondContact O-N 3.41Å; I233-V235 VanDerWaalsContact O-N 3.15Å; V235-I237 VanDerWaalsContact C-N 3.34Å; V235-T239 WeakPolarHBondContact O-CB 3.21Å; V235-T239 PolarHBondContact O-N 2.92Å; V235-T239 PolarHBondContact O-OG1 3.46Å; V235-M246 HydrophobicContact CB-CE 4.28Å; V235-M246 HydrophobicContact CB-SD 4.38Å; V235-M246 HydrophobicContact CG1-CE 3.87Å; V235-M246 HydrophobicContact CG1-CG 4.26Å; V235-M246 HydrophobicContact CG1-SD 3.45Å; V235-M246 WeakPolarHBondContact CG1-SD 3.45Å; V235-M246 HydrophobicContact CG2-CE 3.36Å; V235-M246 HydrophobicContact CG2-SD 4.03Å; V235-L299 HydrophobicContact CG2-CD2 4.28Å; V235-F301 HydrophobicContact CG2-CE2 3.76Å; V235-F301 HydrophobicContact CG2-CZ 4.13Å
236	L	94.8	Very high	95.1	Very high	48 Å²	48	13 Å²	13	25%	0.251	8%	0.078	S	C	.	.	H	α-helix	trans	-64	-43	178.9	-59.7	178.2	0	0	0	110.6	C199 C202 V203 I233 T239 T240	C199-L236 HydrophobicContact CB-CD2 4.49Å; C202-L236 HydrophobicContact CB-CD1 4.17Å; V203-L236 HydrophobicContact CG2-CB 3.96Å; I233-L236 WeakPolarHBondContact O-CA 3.39Å; I233-L236 WeakPolarHBondContact O-CB 3.28Å; I233-L236 PolarHBondContact O-N 3.5Å; L236-T239 PolarHBondContact O-N 3.12Å; L236-T240 WeakPolarHBondContact O-CG2 3.13Å; L236-T240 PolarHBondContact O-N 3.04Å; L236-T240 VanDerWaalsContact O-N 3.13Å
237	I	96	Very high	94.7	Very high	6 Å²	6	14.9 Å²	14.9	3%	0.031	9%	0.089	C	C	.	.	H	α-helix	trans	-64.9	-42.4	-179.7	-73.1	165.6	0	0	0	111.9	V203 I210 Y212 I233 D234 V235 T239 T240 Y333 V366	V203-I237 HydrophobicContact CG2-CG1 4.43Å; I210-I237 HydrophobicContact CD1-CB 4.05Å; I210-I237 HydrophobicContact CD1-CG1 4Å; I210-I237 HydrophobicContact CD1-CG2 3.79Å; I210-I237 HydrophobicContact CG1-CG1 4.48Å; I210-I237 HydrophobicContact CG1-CG2 4.1Å; I210-I237 HydrophobicContact CG2-CG2 4.05Å; Y212-I237 PolarHBondContact OH-O 3.44Å; I233-I237 HydrophobicContact CD1-CD1 4.25Å; I233-I237 HydrophobicContact CG1-CD1 3.93Å; I233-I237 PolarHBondContact O-N 3.35Å; D234-I237 PolarHBondContact O-N 3.33Å; V235-I237 VanDerWaalsContact C-N 3.34Å; I237-T239 VanDerWaalsContact C-N 3.34Å; I237-T240 PolarHBondContact O-OG1 2.89Å; I237-Y333 HydrophobicContact CD1-CE1 3.52Å; I237-Y333 WeakPolarHBondContact CD1-OH 3.25Å; I237-V366 HydrophobicContact CG2-CG2 3.93Å
238	L	97.2	Very high	94	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-68.9	-39.9	174.4	-67.3	177.6	0	0	0	110.4	A227 D234 T240 D241 G242 Y244 L299 V329 I331 V366	A227-L238 HydrophobicContact CB-CD1 4.41Å; D234-L238 WeakPolarHBondContact O-CG 3.48Å; D234-L238 PolarHBondContact O-N 2.9Å; L238-T240 PolarHBondContact O-N 3.09Å; L238-T240 VanDerWaalsContact O-N 3.13Å; L238-D241 PolarHBondContact O-N 2.84Å; L238-G242 PolarHBondContact O-N 2.84Å; L238-Y244 HydrophobicContact CB-CD2 4.18Å; L238-Y244 HydrophobicContact CB-CE2 3.56Å; L238-L299 HydrophobicContact CD1-CD1 3.58Å; L238-L299 HydrophobicContact CD1-CD2 3.81Å; L238-L299 HydrophobicContact CD1-CG 4.38Å; L238-V329 HydrophobicContact CD2-CG1 3.85Å; L238-I331 HydrophobicContact CD1-CD1 4.1Å; L238-I331 HydrophobicContact CD2-CD1 4.11Å; L238-I331 HydrophobicContact CD2-CG1 4.45Å; L238-I331 HydrophobicContact CG-CD1 4.06Å; L238-V366 HydrophobicContact CD2-CG1 3.77Å
239	T	95	Very high	93.3	Very high	9 Å²	9	18.3 Å²	18.3	6%	0.055	11%	0.11	C	C	.	.	H	α-helix	trans	-66.9	-13.8	-178.2	-52.9	0	0	0	0	113.6	H195 L196 C199 V235 L236 I237 D241 G242	H195-T239 HydrophobicContact CB-CG2 4.44Å; L196-T239 WeakPolarHBondContact CD2-O 3.45Å; C199-T239 HydrophobicContact CB-CG2 3.86Å; C199-T239 WeakPolarHBondContact SG-CG2 3.34Å; V235-T239 WeakPolarHBondContact O-CB 3.21Å; V235-T239 PolarHBondContact O-N 2.92Å; V235-T239 PolarHBondContact O-OG1 3.46Å; L236-T239 PolarHBondContact O-N 3.12Å; I237-T239 VanDerWaalsContact C-N 3.34Å; T239-D241 VanDerWaalsContact C-N 3.26Å; T239-D241 PolarHBondContact O-N 3.36Å; T239-G242 VanDerWaalsContact CA-O 3.24Å; T239-G242 WeakPolarHBondContact CA-O 3.38Å
240	T	93.3	Very high	92.7	Very high	13 Å²	13	20.2 Å²	20.2	8%	0.08	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-17.3	175.1	41.6	0	0	0	0	114.5	C199 R200 V203 I210 Y212 L236 I237 L238	C199-T240 HydrophobicContact CB-CG2 4.38Å; R200-T240 HydrophobicContact CB-CG2 4.23Å; R200-T240 HydrophobicContact CG-CG2 3.67Å; R200-T240 PolarHBondContact NE-O 2.94Å; R200-T240 VanDerWaalsContact NE-O 3.11Å; R200-T240 PolarHBondContact NH2-O 2.83Å; V203-T240 HydrophobicContact CB-CG2 3.86Å; V203-T240 HydrophobicContact CG1-CG2 4.34Å; V203-T240 HydrophobicContact CG2-CG2 3.54Å; I210-T240 WeakPolarHBondContact CD1-OG1 3.43Å; Y212-T240 PolarHBondContact OH-OG1 3.32Å; L236-T240 WeakPolarHBondContact O-CG2 3.13Å; L236-T240 PolarHBondContact O-N 3.04Å; L236-T240 VanDerWaalsContact O-N 3.13Å; I237-T240 PolarHBondContact O-OG1 2.89Å; L238-T240 PolarHBondContact O-N 3.09Å; L238-T240 VanDerWaalsContact O-N 3.13Å
241	D	94.5	Very high	91.8	Very high	28 Å²	28	24.4 Å²	24.4	15%	0.15	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.9	-25.4	-179.1	-159.3	57	0	0	0	113.9	Y212 K215 R218 L238 T239 Y368	Y212-D241 HydrophobicContact CD1-CB 3.98Å; Y212-D241 HydrophobicContact CD2-CB 4.32Å; Y212-D241 HydrophobicContact CE1-CB 3.49Å; Y212-D241 VanDerWaalsContact CE1-CB 3.49Å; Y212-D241 HydrophobicContact CE2-CB 3.85Å; Y212-D241 HydrophobicContact CG-CB 4.36Å; Y212-D241 VanDerWaalsContact CZ-CB 3.41Å; K215-D241 IonicContact NZ-OD1 2.74Å; K215-D241 PolarHBondContact NZ-OD1 3.46Å; R218-D241 IonicContact CZ-OD1 3.66Å; R218-D241 IonicContact CZ-OD2 2.58Å; R218-D241 IonicContact NE-OD2 3.78Å; R218-D241 PolarHBondContact NE-OD2 2.85Å; R218-D241 IonicContact NH2-OD1 3.75Å; R218-D241 PolarHBondContact NH2-OD1 2.92Å; R218-D241 IonicContact NH2-OD2 2.66Å; R218-D241 PolarHBondContact NH2-OD2 2.83Å; L238-D241 PolarHBondContact O-N 2.84Å; T239-D241 VanDerWaalsContact C-N 3.26Å; T239-D241 PolarHBondContact O-N 3.36Å; D241-Y368 PolarHBondContact OD2-OH 3.37Å
242	G	93	Very high	91.1	Very high	22 Å²	22	27.2 Å²	27.2	23%	0.227	17%	0.171	C	C	.	.	S	Bend	trans	-160.6	151.4	173.5	0	0	0	0	0	112.2	L238 T239 Y244	L238-G242 PolarHBondContact O-N 2.84Å; T239-G242 VanDerWaalsContact CA-O 3.24Å; T239-G242 WeakPolarHBondContact CA-O 3.38Å; G242-Y244 WeakPolarHBondContact O-CD2 3.35Å; G242-Y244 WeakPolarHBondContact O-CE2 3.46Å
243	C	94.8	Very high	90.7	Very high	11 Å²	11	27.8 Å²	27.8	7%	0.074	19%	0.185	C	C	.	.			trans	-85.5	148.8	-179.6	-68.6	0	0	0	0	112.8	E192 L296	E192-C243 HydrophobicContact CG-CB 4.16Å; C243-L296 HydrophobicContact CB-CD1 3.75Å; C243-L296 HydrophobicContact CB-CD2 3.89Å; C243-L296 HydrophobicContact CB-CG 4.47Å
244	Y	95.2	Very high	89.9	Confident	9 Å²	9	33.1 Å²	33.1	4%	0.035	21%	0.213	C	C	.	.			trans	-131.1	144.5	-178.1	-59.5	-86.7	0	0	0	111.7	P219 C225 L238 G242 H268 P297 L299	P219-Y244 HydrophobicContact CB-CE1 3.87Å; P219-Y244 HydrophobicContact CG-CE1 3.85Å; C225-Y244 HydrophobicContact CB-CD1 3.96Å; C225-Y244 HydrophobicContact CB-CE1 3.7Å; L238-Y244 HydrophobicContact CB-CD2 4.18Å; L238-Y244 HydrophobicContact CB-CE2 3.56Å; G242-Y244 WeakPolarHBondContact O-CD2 3.35Å; G242-Y244 WeakPolarHBondContact O-CE2 3.46Å; Y244-H268 PolarHBondContact O-CE1 3.31Å; Y244-H268 VanDerWaalsContact O-CE1 3.29Å; Y244-P297 WeakPolarHBondContact CA-O 3.35Å; Y244-P297 HydrophobicContact CD1-CB 4.24Å; Y244-P297 HydrophobicContact CD1-CG 3.76Å; Y244-P297 HydrophobicContact CE1-CG 4.03Å; Y244-L299 HydrophobicContact CD1-CB 3.98Å; Y244-L299 HydrophobicContact CD2-CD2 4.45Å; Y244-L299 HydrophobicContact CG-CB 3.96Å; Y244-L299 HydrophobicContact CG-CD2 4.27Å
245	A	94.5	Very high	89	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	128.2	161.6	0	0	0	0	0	108.1	L296 P297 I298 L299	A245-L296 HydrophobicContact CB-CB 4.35Å; A245-P297 PolarHBondContact N-O 2.97Å; A245-I298 WeakPolarHBondContact O-CA 3.03Å; A245-L299 PolarHBondContact O-N 3.25Å
246	M	92	Very high	88.4	Confident	19 Å²	19	36.2 Å²	36.2	9%	0.094	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	143.7	-175.8	-70.1	-55.2	-56.6	0	0	108.9	V235 H268 V269 W270 L299 F301	V235-M246 HydrophobicContact CB-CE 4.28Å; V235-M246 HydrophobicContact CB-SD 4.38Å; V235-M246 HydrophobicContact CG1-CE 3.87Å; V235-M246 HydrophobicContact CG1-CG 4.26Å; V235-M246 HydrophobicContact CG1-SD 3.45Å; V235-M246 WeakPolarHBondContact CG1-SD 3.45Å; V235-M246 HydrophobicContact CG2-CE 3.36Å; V235-M246 HydrophobicContact CG2-SD 4.03Å; M246-H268 HydrophobicContact CB-CB 4.39Å; M246-H268 WeakPolarHBondContact CB-ND1 3.5Å; M246-H268 PolarHBondContact N-ND1 2.92Å; M246-V269 PolarHBondContact O-N 3.31Å; M246-W270 HydrophobicContact CB-CH2 3.91Å; M246-W270 HydrophobicContact CB-CZ2 3.99Å; M246-L299 HydrophobicContact CE-CD2 4.28Å; M246-L299 HydrophobicContact SD-CB 4.1Å; M246-L299 HydrophobicContact SD-CD2 3.81Å; M246-L299 HydrophobicContact SD-CG 4.34Å; M246-F301 HydrophobicContact CE-CE2 4.49Å
247	V	87.9	Confident	87.7	Confident	39 Å²	39	38 Å²	38	24%	0.236	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	131	172.9	-173.6	0	0	0	0	109.2	V269 F271 L286 I298 I300	V247-V269 WeakPolarHBondContact CA-O 3.39Å; V247-V269 HydrophobicContact CG2-CB 4.38Å; V247-F271 HydrophobicContact CG1-CD2 4.19Å; V247-F271 HydrophobicContact CG1-CE2 3.81Å; V247-L286 HydrophobicContact CG1-CD2 4.22Å; V247-L286 HydrophobicContact CG2-CD2 3.67Å; V247-I298 HydrophobicContact CG2-CG2 3.17Å; V247-I300 HydrophobicContact CG2-CG1 4.46Å
248	G	84.9	Confident	87	Confident	17 Å²	17	39 Å²	39	18%	0.175	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.6	-173.7	172.7	0	0	0	0	0	113.7	V269 W270 F271	G248-V269 PolarHBondContact N-O 3.19Å; G248-W270 WeakPolarHBondContact O-CA 3.48Å; G248-F271 PolarHBondContact O-N 3.16Å
249	Q	83	Confident	86.4	Confident	57 Å²	57	39.5 Å²	39.5	27%	0.266	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	146.4	176.1	-158.6	-170.8	-79.3	0	0	110.9	H251 Q259 F271 R273 M276	Q249-H251 PolarHBondContact O-CE1 2.86Å; Q249-H251 PolarHBondContact O-N 2.84Å; Q249-H251 PolarHBondContact O-ND1 2.93Å; Q249-Q259 PolarHBondContact O-NE2 2.95Å; Q249-F271 WeakPolarHBondContact CA-O 3.29Å; Q249-R273 HydrophobicContact CG-CG 4.02Å; Q249-R273 VanDerWaalsContact NE2-NE 3.13Å; Q249-M276 HydrophobicContact CG-CG 4.27Å
250	V	82.5	Confident	85.9	Confident	66 Å²	66	45.7 Å²	45.7	40%	0.4	27%	0.266	S	S	.	.			trans	-64.7	132.2	168	-178.5	0	0	0	0	109.8	W270 F271	V250-W270 HydrophobicContact CG2-CB 3.71Å; V250-F271 PolarHBondContact N-O 3.48Å
251	H	78.1	Confident	85.4	Confident	89 Å²	89	45.3 Å²	45.3	41%	0.412	26%	0.263	S	S	.	.			trans	-112.4	156.6	176.8	-64.7	93.9	0	0	0	111.7	Q249 M255 G256 Q259	Q249-H251 PolarHBondContact O-CE1 2.86Å; Q249-H251 PolarHBondContact O-N 2.84Å; Q249-H251 PolarHBondContact O-ND1 2.93Å; H251-M255 HydrophobicContact CB-CB 4.02Å; H251-G256 WeakPolarHBondContact O-CA 3.49Å; H251-Q259 PolarHBondContact ND1-NE2 3.29Å; H251-Q259 VanDerWaalsContact ND1-NE2 3.11Å
252	G	79.8	Confident	84.9	Confident	59 Å²	59	45.3 Å²	45.3	61%	0.608	26%	0.263	S	S	*	.			trans	-86.3	-176.7	169	0	0	0	0	0	112.9	G256	G252-G256 PolarHBondContact O-N 3.2Å
253	G	82.3	Confident	84.5	Confident	57 Å²	57	47.3 Å²	47.3	59%	0.588	27%	0.271	S	S	*	.	H	α-helix	trans	63.5	-150.4	174.3	0	0	0	0	0	114.3	M255 G256 I257	G253-M255 VanDerWaalsContact C-N 3.31Å; G253-M255 PolarHBondContact O-N 2.91Å; G253-G256 PolarHBondContact O-N 2.88Å; G253-G256 VanDerWaalsContact O-N 3.1Å; G253-I257 PolarHBondContact O-N 3.36Å
254	L	76.8	Confident	83.8	Confident	119 Å²	119	51.6 Å²	51.6	62%	0.623	29%	0.288	S	S	*	.	H	α-helix	trans	-57.7	-41.5	-179.6	-179.6	62.8	0	0	0	112.3	G256 I257 I258	L254-G256 VanDerWaalsContact C-N 3.3Å; L254-G256 PolarHBondContact O-N 3.2Å; L254-I257 WeakPolarHBondContact O-CB 3.26Å; L254-I257 PolarHBondContact O-N 2.84Å; L254-I257 VanDerWaalsContact O-N 3.14Å; L254-I258 HydrophobicContact CD1-CD1 4.39Å; L254-I258 HydrophobicContact CG-CD1 4.08Å; L254-I258 WeakPolarHBondContact O-CG1 3.32Å; L254-I258 PolarHBondContact O-N 3.23Å
255	M	78.6	Confident	83.1	Confident	93 Å²	93	51.3 Å²	51.3	46%	0.458	29%	0.288	S	S	.	.	H	α-helix	trans	-60.8	-40.1	176.5	-72.8	-60.5	-70.3	0	0	111.7	H251 G253 I257 I258 Q259	H251-M255 HydrophobicContact CB-CB 4.02Å; G253-M255 VanDerWaalsContact C-N 3.31Å; G253-M255 PolarHBondContact O-N 2.91Å; M255-I257 VanDerWaalsContact C-N 3.33Å; M255-I257 PolarHBondContact O-N 3.04Å; M255-I258 PolarHBondContact O-N 2.84Å; M255-Q259 WeakPolarHBondContact O-CB 3.34Å; M255-Q259 VanDerWaalsContact O-CG 3.26Å; M255-Q259 WeakPolarHBondContact O-CG 3.33Å; M255-Q259 PolarHBondContact O-N 3.45Å
256	G	81.6	Confident	82.5	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-63.5	-36.2	175.1	0	0	0	0	0	113.5	H251 G252 G253 L254 R260	H251-G256 WeakPolarHBondContact O-CA 3.49Å; G252-G256 PolarHBondContact O-N 3.2Å; G253-G256 PolarHBondContact O-N 2.88Å; G253-G256 VanDerWaalsContact O-N 3.1Å; L254-G256 VanDerWaalsContact C-N 3.3Å; L254-G256 PolarHBondContact O-N 3.2Å; G256-R260 WeakPolarHBondContact O-CB 3.47Å; G256-R260 VanDerWaalsContact O-CG 3.3Å; G256-R260 WeakPolarHBondContact O-CG 3.28Å; G256-R260 PolarHBondContact O-N 2.97Å; G256-R260 PolarHBondContact O-NH1 3.31Å
257	I	81.1	Confident	82.1	Confident	86 Å²	86	53.4 Å²	53.4	44%	0.441	30%	0.303	S	S	.	.	H	α-helix	trans	-65.1	-47.7	175	-64.1	171.2	0	0	0	110.2	G253 L254 M255 R260 A261	G253-I257 PolarHBondContact O-N 3.36Å; L254-I257 WeakPolarHBondContact O-CB 3.26Å; L254-I257 PolarHBondContact O-N 2.84Å; L254-I257 VanDerWaalsContact O-N 3.14Å; M255-I257 VanDerWaalsContact C-N 3.33Å; M255-I257 PolarHBondContact O-N 3.04Å; I257-R260 PolarHBondContact O-N 3.02Å; I257-A261 WeakPolarHBondContact O-CB 3.43Å; I257-A261 PolarHBondContact O-N 2.78Å
258	I	81.1	Confident	82.1	Confident	26 Å²	26	52.3 Å²	52.3	13%	0.133	30%	0.295	C	S	.	.	H	α-helix	trans	-61.8	-48.2	178.8	-64.7	168.3	0	0	0	110.3	I168 L171 V172 L254 M255 R260 A261 M262	I168-I258 HydrophobicContact CG2-CD1 4.23Å; L171-I258 HydrophobicContact CD2-CG2 4.39Å; V172-I258 HydrophobicContact CG2-CG1 4.38Å; L254-I258 HydrophobicContact CD1-CD1 4.39Å; L254-I258 HydrophobicContact CG-CD1 4.08Å; L254-I258 WeakPolarHBondContact O-CG1 3.32Å; L254-I258 PolarHBondContact O-N 3.23Å; M255-I258 PolarHBondContact O-N 2.84Å; I258-R260 PolarHBondContact O-N 2.61Å; I258-A261 PolarHBondContact O-N 3.27Å; I258-M262 HydrophobicContact CG2-CG 4.33Å; I258-M262 HydrophobicContact CG2-SD 3.73Å; I258-M262 VanDerWaalsContact O-CG 3.29Å; I258-M262 WeakPolarHBondContact O-CG 3.28Å; I258-M262 PolarHBondContact O-N 3.11Å
259	Q	85.4	Confident	82.1	Confident	11 Å²	11	52.4 Å²	52.4	5%	0.051	29%	0.292	C	S	.	.	H	α-helix	trans	-56.2	-48.8	176.4	-75	179.2	-31.4	0	0	111.5	Q249 H251 M255 A261 M262 V263 W270	Q249-Q259 PolarHBondContact O-NE2 2.95Å; H251-Q259 PolarHBondContact ND1-NE2 3.29Å; H251-Q259 VanDerWaalsContact ND1-NE2 3.11Å; M255-Q259 WeakPolarHBondContact O-CB 3.34Å; M255-Q259 VanDerWaalsContact O-CG 3.26Å; M255-Q259 WeakPolarHBondContact O-CG 3.33Å; M255-Q259 PolarHBondContact O-N 3.45Å; Q259-A261 VanDerWaalsContact C-N 3.33Å; Q259-A261 PolarHBondContact O-N 2.78Å; Q259-M262 PolarHBondContact O-N 2.86Å; Q259-V263 VanDerWaalsContact O-CG2 3.22Å; Q259-V263 WeakPolarHBondContact O-CG2 3.42Å; Q259-V263 PolarHBondContact O-N 3.06Å; Q259-W270 HydrophobicContact CB-CZ2 4.35Å; Q259-W270 HydrophobicContact CG-CD2 4.39Å; Q259-W270 HydrophobicContact CG-CH2 3.97Å; Q259-W270 HydrophobicContact CG-CZ2 3.79Å; Q259-W270 HydrophobicContact CG-CZ3 4.33Å; Q259-W270 VanDerWaalsContact NE2-CE3 3.29Å
260	R	84.5	Confident	82.2	Confident	139 Å²	139	52.1 Å²	52.1	53%	0.525	29%	0.289	S	S	.	.	H	α-helix	trans	-62.7	-37.9	178.1	-77.3	-172.3	-65	-88.5	3.3	112.8	G256 I257 I258 K264	G256-R260 WeakPolarHBondContact O-CB 3.47Å; G256-R260 VanDerWaalsContact O-CG 3.3Å; G256-R260 WeakPolarHBondContact O-CG 3.28Å; G256-R260 PolarHBondContact O-N 2.97Å; G256-R260 PolarHBondContact O-NH1 3.31Å; I257-R260 PolarHBondContact O-N 3.02Å; I258-R260 PolarHBondContact O-N 2.61Å; R260-K264 WeakPolarHBondContact O-CG 3.28Å
261	A	81.6	Confident	82.3	Confident	4 Å²	4	49 Å²	49	3%	0.033	27%	0.27	C	S	.	.	H	α-helix	trans	-65.2	-47.6	176.4	0	0	0	0	0	110.9	V172 T175 I257 I258 Q259 V263 K264	V172-A261 HydrophobicContact CB-CB 4.49Å; V172-A261 HydrophobicContact CG1-CB 4.22Å; V172-A261 HydrophobicContact CG2-CB 4.42Å; T175-A261 WeakPolarHBondContact CB-O 3.26Å; T175-A261 PolarHBondContact OG1-O 2.92Å; I257-A261 WeakPolarHBondContact O-CB 3.43Å; I257-A261 PolarHBondContact O-N 2.78Å; I258-A261 PolarHBondContact O-N 3.27Å; Q259-A261 VanDerWaalsContact C-N 3.33Å; Q259-A261 PolarHBondContact O-N 2.78Å; A261-V263 PolarHBondContact O-N 2.86Å; A261-K264 WeakPolarHBondContact O-CB 3.41Å; A261-K264 PolarHBondContact O-N 3.2Å
262	M	83.9	Confident	82.5	Confident	29 Å²	29	50.3 Å²	50.3	14%	0.143	28%	0.276	C	S	.	.	H	α-helix	trans	-61.3	-41.4	179.5	-68.8	174	68.3	0	0	112.8	L171 I258 Q259 K264 A265 C266	L171-M262 HydrophobicContact CD2-CG 4.44Å; L171-M262 HydrophobicContact CD2-SD 4.38Å; I258-M262 HydrophobicContact CG2-CG 4.33Å; I258-M262 HydrophobicContact CG2-SD 3.73Å; I258-M262 VanDerWaalsContact O-CG 3.29Å; I258-M262 WeakPolarHBondContact O-CG 3.28Å; I258-M262 PolarHBondContact O-N 3.11Å; Q259-M262 PolarHBondContact O-N 2.86Å; M262-K264 PolarHBondContact O-N 3.32Å; M262-A265 PolarHBondContact O-N 2.85Å; M262-C266 PolarHBondContact O-N 3.33Å
263	V	85.4	Confident	82.4	Confident	64 Å²	64	56.5 Å²	56.5	39%	0.388	28%	0.281	S	S	.	.	H	α-helix	trans	-59.2	-31.1	178.9	171.3	0	0	0	0	112.8	Q259 A261 A265 C266 H268 W270	Q259-V263 VanDerWaalsContact O-CG2 3.22Å; Q259-V263 WeakPolarHBondContact O-CG2 3.42Å; Q259-V263 PolarHBondContact O-N 3.06Å; A261-V263 PolarHBondContact O-N 2.86Å; V263-A265 VanDerWaalsContact C-N 3.26Å; V263-A265 PolarHBondContact O-N 3.05Å; V263-C266 CarbonylContact C-O 3.53Å; V263-C266 WeakPolarHBondContact CA-O 3.49Å; V263-H268 HydrophobicContact CG2-CB 4.34Å; V263-W270 HydrophobicContact CG2-CG 4.44Å
264	K	80.6	Confident	82.3	Confident	100 Å²	100	57.3 Å²	57.3	44%	0.435	28%	0.278	S	S	.	.	H	α-helix	trans	-66.2	-32.2	178.6	-66	175	-179.9	-175.7	0	112.2	G179 R260 A261 M262	G179-K264 WeakPolarHBondContact CA-O 3.27Å; R260-K264 WeakPolarHBondContact O-CG 3.28Å; A261-K264 WeakPolarHBondContact O-CB 3.41Å; A261-K264 PolarHBondContact O-N 3.2Å; M262-K264 PolarHBondContact O-N 3.32Å
265	A	79.8	Confident	82.3	Confident	4 Å²	4	53.6 Å²	53.6	3%	0.033	26%	0.257	C	S	.	.	H	α-helix	trans	-97.2	-29.5	-176.3	0	0	0	0	0	113	T175 V178 S191 M262 V263	T175-A265 HydrophobicContact CG2-CB 3.84Å; V178-A265 HydrophobicContact CB-CB 4.4Å; V178-A265 HydrophobicContact CG1-CB 4.26Å; S191-A265 WeakPolarHBondContact CB-O 3.42Å; S191-A265 WeakPolarHBondContact OG-CB 3.25Å; S191-A265 PolarHBondContact OG-O 3.24Å; M262-A265 PolarHBondContact O-N 2.85Å; V263-A265 VanDerWaalsContact C-N 3.26Å; V263-A265 PolarHBondContact O-N 3.05Å
266	C	82	Confident	82.3	Confident	4 Å²	4	53 Å²	53	3%	0.027	25%	0.254	C	S	.	.	S	Bend	trans	-139.6	138.5	-173.9	170.4	0	0	0	0	110.2	M262 V263 H268 L296	M262-C266 PolarHBondContact O-N 3.33Å; V263-C266 CarbonylContact C-O 3.53Å; V263-C266 WeakPolarHBondContact CA-O 3.49Å; C266-H268 WeakPolarHBondContact CB-NE2 3.49Å; C266-H268 PolarHBondContact O-CD2 3.35Å; C266-H268 PolarHBondContact O-N 3.08Å; C266-H268 PolarHBondContact SG-NE2 2.86Å; C266-H268 VanDerWaalsContact SG-NE2 3.43Å; C266-L296 VanDerWaalsContact SG-CD1 3.56Å
267	P	82.4	Confident	82.1	Confident	59 Å²	59	61.6 Å²	61.6	38%	0.383	29%	0.292	S	S	.	.			trans	-74.8	65	-179.2	33.3	-37.4	0	0	0	111.9	H289	P267-H289 PolarHBondContact O-CE1 2.95Å
268	H	88.6	Confident	82.4	Confident	16 Å²	16	61.1 Å²	61.1	7%	0.074	29%	0.29	C	S	.	.			trans	-66.5	144	167.6	-59.3	-79.7	0	0	0	109.8	H195 Y244 M246 V263 C266 W270	H195-H268 AromaticContact NE2-NE2 3.74Å; Y244-H268 PolarHBondContact O-CE1 3.31Å; Y244-H268 VanDerWaalsContact O-CE1 3.29Å; M246-H268 HydrophobicContact CB-CB 4.39Å; M246-H268 WeakPolarHBondContact CB-ND1 3.5Å; M246-H268 PolarHBondContact N-ND1 2.92Å; V263-H268 HydrophobicContact CG2-CB 4.34Å; C266-H268 WeakPolarHBondContact CB-NE2 3.49Å; C266-H268 PolarHBondContact O-CD2 3.35Å; C266-H268 PolarHBondContact O-N 3.08Å; C266-H268 PolarHBondContact SG-NE2 2.86Å; C266-H268 VanDerWaalsContact SG-NE2 3.43Å; H268-W270 HydrophobicContact CB-CZ2 4.21Å
269	V	85.6	Confident	82.5	Confident	18 Å²	18	68.4 Å²	68.4	11%	0.109	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	96	-176.5	-170.3	0	0	0	0	108.9	M246 V247 G248 F271 L286	M246-V269 PolarHBondContact O-N 3.31Å; V247-V269 WeakPolarHBondContact CA-O 3.39Å; V247-V269 HydrophobicContact CG2-CB 4.38Å; G248-V269 PolarHBondContact N-O 3.19Å; V269-F271 HydrophobicContact CB-CE2 4.5Å; V269-F271 HydrophobicContact CG1-CD2 4.32Å; V269-F271 HydrophobicContact CG1-CE1 4.47Å; V269-F271 HydrophobicContact CG1-CE2 3.53Å; V269-F271 HydrophobicContact CG1-CZ 3.61Å; V269-L286 HydrophobicContact CB-CD2 4.43Å; V269-L286 HydrophobicContact CG1-CD2 4.26Å; V269-L286 HydrophobicContact CG2-CD2 4.48Å
270	W	84.7	Confident	82.7	Confident	52 Å²	52	75.6 Å²	75.6	20%	0.197	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	139.4	174.8	-54.7	101.5	0	0	0	110.9	M246 G248 V250 Q259 V263 H268	M246-W270 HydrophobicContact CB-CH2 3.91Å; M246-W270 HydrophobicContact CB-CZ2 3.99Å; G248-W270 WeakPolarHBondContact O-CA 3.48Å; V250-W270 HydrophobicContact CG2-CB 3.71Å; Q259-W270 HydrophobicContact CB-CZ2 4.35Å; Q259-W270 HydrophobicContact CG-CD2 4.39Å; Q259-W270 HydrophobicContact CG-CH2 3.97Å; Q259-W270 HydrophobicContact CG-CZ2 3.79Å; Q259-W270 HydrophobicContact CG-CZ3 4.33Å; Q259-W270 VanDerWaalsContact NE2-CE3 3.29Å; V263-W270 HydrophobicContact CG2-CG 4.44Å; H268-W270 HydrophobicContact CB-CZ2 4.21Å
271	F	83.7	Confident	82.9	Confident	0 Å²	0	71.2 Å²	71.2	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	143.4	178.4	-66.6	-84.7	0	0	0	110.4	V247 G248 Q249 V250 V269 E275 M276 V282 R285	V247-F271 HydrophobicContact CG1-CD2 4.19Å; V247-F271 HydrophobicContact CG1-CE2 3.81Å; G248-F271 PolarHBondContact O-N 3.16Å; Q249-F271 WeakPolarHBondContact CA-O 3.29Å; V250-F271 PolarHBondContact N-O 3.48Å; V269-F271 HydrophobicContact CB-CE2 4.5Å; V269-F271 HydrophobicContact CG1-CD2 4.32Å; V269-F271 HydrophobicContact CG1-CE1 4.47Å; V269-F271 HydrophobicContact CG1-CE2 3.53Å; V269-F271 HydrophobicContact CG1-CZ 3.61Å; F271-E275 HydrophobicContact CB-CB 4.32Å; F271-E275 HydrophobicContact CD1-CB 4.16Å; F271-M276 HydrophobicContact CB-CG 3.59Å; F271-M276 HydrophobicContact CB-SD 3.43Å; F271-M276 WeakPolarHBondContact CB-SD 3.49Å; F271-M276 HydrophobicContact CD2-SD 3.8Å; F271-M276 HydrophobicContact CG-SD 3.79Å; F271-V282 HydrophobicContact CD1-CG2 3.89Å; F271-V282 HydrophobicContact CE1-CB 4.11Å; F271-V282 HydrophobicContact CE1-CG1 4.4Å; F271-V282 HydrophobicContact CE1-CG2 3.71Å; F271-V282 HydrophobicContact CE2-CG1 4.03Å; F271-V282 HydrophobicContact CE2-CG2 4.37Å; F271-V282 HydrophobicContact CG-CG2 4.3Å; F271-V282 HydrophobicContact CZ-CB 4.03Å; F271-V282 HydrophobicContact CZ-CG1 3.83Å; F271-V282 HydrophobicContact CZ-CG2 3.98Å; F271-R285 HydrophobicContact CE1-CB 4.25Å; F271-R285 HydrophobicContact CE1-CG 4.35Å; F271-R285 HydrophobicContact CZ-CB 4.12Å
272	E	82.8	Confident	83.3	Confident	117 Å²	117	72.2 Å²	72.2	55%	0.547	34%	0.341	S	S	.	.			trans	-70.4	161.4	167.2	-63.1	-170.1	171.5	0	0	111.4	S274 E275 M276	E272-S274 PolarHBondContact O-N 3.06Å; E272-E275 HydrophobicContact CB-CG 4.13Å; E272-E275 PolarHBondContact N-OE2 2.81Å; E272-E275 VanDerWaalsContact N-OE2 3.07Å; E272-E275 PolarHBondContact O-N 2.66Å; E272-M276 WeakPolarHBondContact O-CG 3.43Å; E272-M276 PolarHBondContact O-N 3.09Å
273	R	78.3	Confident	83.6	Confident	188 Å²	188	71.8 Å²	71.8	71%	0.709	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-33.9	178.2	-78.5	-176.8	-166.7	-152.8	6.7	113.1	Q249	Q249-R273 HydrophobicContact CG-CG 4.02Å; Q249-R273 VanDerWaalsContact NE2-NE 3.13Å
274	S	79.7	Confident	84	Confident	75 Å²	75	74.5 Å²	74.5	52%	0.524	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-49.1	175.6	43.8	0	0	0	0	111	E272 M276 K277	E272-S274 PolarHBondContact O-N 3.06Å; S274-M276 PolarHBondContact O-N 3.22Å; S274-K277 WeakPolarHBondContact O-CB 3.27Å; S274-K277 PolarHBondContact O-N 2.58Å; S274-K277 VanDerWaalsContact O-N 3.16Å
275	E	77.6	Confident	84.5	Confident	40 Å²	40	73.7 Å²	73.7	19%	0.187	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-64.8	-36	-179.1	-62	-176.4	133.8	0	0	112.8	F271 E272 K277 D278 L281 R285	F271-E275 HydrophobicContact CB-CB 4.32Å; F271-E275 HydrophobicContact CD1-CB 4.16Å; E272-E275 HydrophobicContact CB-CG 4.13Å; E272-E275 PolarHBondContact N-OE2 2.81Å; E272-E275 VanDerWaalsContact N-OE2 3.07Å; E272-E275 PolarHBondContact O-N 2.66Å; E275-K277 PolarHBondContact O-N 3.26Å; E275-K277 VanDerWaalsContact O-N 3.07Å; E275-D278 PolarHBondContact O-N 2.75Å; E275-L281 HydrophobicContact CB-CD2 3.96Å; E275-L281 HydrophobicContact CG-CD2 3.9Å; E275-R285 VanDerWaalsContact CD-NH1 3.3Å; E275-R285 IonicContact OE1-CZ 3.29Å; E275-R285 VanDerWaalsContact OE1-CZ 3.29Å; E275-R285 IonicContact OE1-NH1 3.08Å; E275-R285 PolarHBondContact OE1-NH1 2.97Å; E275-R285 VanDerWaalsContact OE1-NH1 3.08Å; E275-R285 IonicContact OE1-NH2 2.67Å; E275-R285 PolarHBondContact OE1-NH2 3.35Å; E275-R285 IonicContact OE2-CZ 3.93Å; E275-R285 IonicContact OE2-NH1 2.96Å; E275-R285 PolarHBondContact OE2-NH1 2.74Å
276	M	77	Confident	85.2	Confident	81 Å²	81	73.8 Å²	73.8	40%	0.399	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-59.3	-19.8	175.7	-77.9	-61.2	-60	0	0	113.5	Q249 F271 E272 S274	Q249-M276 HydrophobicContact CG-CG 4.27Å; F271-M276 HydrophobicContact CB-CG 3.59Å; F271-M276 HydrophobicContact CB-SD 3.43Å; F271-M276 WeakPolarHBondContact CB-SD 3.49Å; F271-M276 HydrophobicContact CD2-SD 3.8Å; F271-M276 HydrophobicContact CG-SD 3.79Å; E272-M276 WeakPolarHBondContact O-CG 3.43Å; E272-M276 PolarHBondContact O-N 3.09Å; S274-M276 PolarHBondContact O-N 3.22Å
277	K	79.4	Confident	85.7	Confident	181 Å²	181	78.5 Å²	78.5	79%	0.787	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-80.2	-26.3	174.6	-61.2	-179.2	-179.1	-179.7	0	112.1	S274 E275 R279	S274-K277 WeakPolarHBondContact O-CB 3.27Å; S274-K277 PolarHBondContact O-N 2.58Å; S274-K277 VanDerWaalsContact O-N 3.16Å; E275-K277 PolarHBondContact O-N 3.26Å; E275-K277 VanDerWaalsContact O-N 3.07Å; K277-R279 PolarHBondContact O-N 3.49Å
278	D	85.7	Confident	86.3	Confident	75 Å²	75	80.7 Å²	80.7	40%	0.401	37%	0.366	S	S	.	.			trans	-86.5	94.7	177	-173.4	-10.1	0	0	0	110.7	E275 H280 L281 V282	E275-D278 PolarHBondContact O-N 2.75Å; D278-H280 PolarHBondContact O-N 3Å; D278-H280 WeakPolarHBondContact OD1-CB 3.41Å; D278-H280 PolarHBondContact OD1-N 3.21Å; D278-L281 HydrophobicContact CB-CB 3.96Å; D278-L281 PolarHBondContact O-N 3.44Å; D278-L281 PolarHBondContact OD1-N 2.86Å; D278-L281 VanDerWaalsContact OD1-N 3.17Å; D278-V282 WeakPolarHBondContact O-CG2 3.41Å; D278-V282 PolarHBondContact O-N 3.12Å; D278-V282 VanDerWaalsContact O-N 3.12Å
279	R	84.7	Confident	86.6	Confident	179 Å²	179	80.3 Å²	80.3	68%	0.675	36%	0.364	S	S	*	.	H	α-helix	trans	-60.2	-33.2	177.9	-65.3	-176.9	-178.9	173	1.5	112.9	K277 T283	K277-R279 PolarHBondContact O-N 3.49Å; R279-T283 WeakPolarHBondContact O-CB 3.37Å; R279-T283 PolarHBondContact O-N 2.94Å; R279-T283 PolarHBondContact O-OG1 3.31Å
280	H	88.3	Confident	87	Confident	163 Å²	163	80 Å²	80	76%	0.755	36%	0.362	S	S	*	.	H	α-helix	trans	-70.3	-42.5	-178.5	-71	86.2	0	0	0	110.6	D278 T283 K284	D278-H280 PolarHBondContact O-N 3Å; D278-H280 WeakPolarHBondContact OD1-CB 3.41Å; D278-H280 PolarHBondContact OD1-N 3.21Å; H280-T283 PolarHBondContact O-N 3.32Å; H280-K284 VanDerWaalsContact O-CB 3.23Å; H280-K284 WeakPolarHBondContact O-CB 3.44Å; H280-K284 PolarHBondContact O-N 3.09Å
281	L	88.8	Confident	87.5	Confident	46 Å²	46	81 Å²	81	24%	0.241	38%	0.382	C	S	.	.	H	α-helix	trans	-61.5	-46.1	175.1	179.7	61.8	0	0	0	111.8	E275 D278 K284 R285	E275-L281 HydrophobicContact CB-CD2 3.96Å; E275-L281 HydrophobicContact CG-CD2 3.9Å; D278-L281 HydrophobicContact CB-CB 3.96Å; D278-L281 PolarHBondContact O-N 3.44Å; D278-L281 PolarHBondContact OD1-N 2.86Å; D278-L281 VanDerWaalsContact OD1-N 3.17Å; L281-K284 PolarHBondContact O-N 3.46Å; L281-R285 HydrophobicContact CD1-CG 4.37Å; L281-R285 PolarHBondContact O-N 2.87Å
282	V	89.8	Confident	87.9	Confident	25 Å²	25	84 Å²	84	15%	0.152	40%	0.398	C	S	.	.	H	α-helix	trans	-58.7	-53.5	177.6	174	0	0	0	0	110.5	F271 D278 K284 R285 L286	F271-V282 HydrophobicContact CD1-CG2 3.89Å; F271-V282 HydrophobicContact CE1-CB 4.11Å; F271-V282 HydrophobicContact CE1-CG1 4.4Å; F271-V282 HydrophobicContact CE1-CG2 3.71Å; F271-V282 HydrophobicContact CE2-CG1 4.03Å; F271-V282 HydrophobicContact CE2-CG2 4.37Å; F271-V282 HydrophobicContact CG-CG2 4.3Å; F271-V282 HydrophobicContact CZ-CB 4.03Å; F271-V282 HydrophobicContact CZ-CG1 3.83Å; F271-V282 HydrophobicContact CZ-CG2 3.98Å; D278-V282 WeakPolarHBondContact O-CG2 3.41Å; D278-V282 PolarHBondContact O-N 3.12Å; D278-V282 VanDerWaalsContact O-N 3.12Å; V282-K284 VanDerWaalsContact C-N 3.3Å; V282-K284 PolarHBondContact O-N 3.31Å; V282-R285 PolarHBondContact O-N 3.28Å; V282-L286 HydrophobicContact CG1-CD1 3.81Å; V282-L286 HydrophobicContact CG1-CG 4.47Å; V282-L286 VanDerWaalsContact O-CG 3.25Å; V282-L286 WeakPolarHBondContact O-CG 3.13Å; V282-L286 PolarHBondContact O-N 3.16Å; V282-L286 VanDerWaalsContact O-N 3.08Å
283	T	91.2	Very high	88.4	Confident	20 Å²	20	84.4 Å²	84.4	12%	0.123	40%	0.398	C	S	.	.	H	α-helix	trans	-60.4	-39.4	179.5	-62.3	0	0	0	0	112.1	R279 H280 L286 K287	R279-T283 WeakPolarHBondContact O-CB 3.37Å; R279-T283 PolarHBondContact O-N 2.94Å; R279-T283 PolarHBondContact O-OG1 3.31Å; H280-T283 PolarHBondContact O-N 3.32Å; T283-L286 PolarHBondContact O-N 3.08Å; T283-K287 HydrophobicContact CG2-CD 4.19Å; T283-K287 WeakPolarHBondContact O-CB 3.3Å; T283-K287 WeakPolarHBondContact O-CG 3.2Å; T283-K287 PolarHBondContact O-N 3.46Å
284	K	92.5	Very high	89	Confident	122 Å²	122	83.5 Å²	83.5	53%	0.53	40%	0.399	S	S	.	.	H	α-helix	trans	-62.6	-50.9	177.5	-178.5	-179.7	173.4	-177.8	0	112	H280 L281 V282 L286 K287 E288	H280-K284 VanDerWaalsContact O-CB 3.23Å; H280-K284 WeakPolarHBondContact O-CB 3.44Å; H280-K284 PolarHBondContact O-N 3.09Å; L281-K284 PolarHBondContact O-N 3.46Å; V282-K284 VanDerWaalsContact C-N 3.3Å; V282-K284 PolarHBondContact O-N 3.31Å; K284-L286 VanDerWaalsContact C-N 3.29Å; K284-L286 PolarHBondContact O-N 3.01Å; K284-K287 WeakPolarHBondContact O-CB 3.47Å; K284-K287 PolarHBondContact O-N 2.94Å; K284-E288 WeakPolarHBondContact CE-OE1 3.42Å; K284-E288 WeakPolarHBondContact O-CG 3.3Å; K284-E288 PolarHBondContact O-N 3Å
285	R	92	Very high	89.6	Confident	82 Å²	82	83 Å²	83	31%	0.309	39%	0.387	S	S	.	.	H	α-helix	trans	-61.4	-38.8	179	-72.9	-165.5	-175.2	153.2	3.4	112.1	F271 E275 L281 V282 E288 H289	F271-R285 HydrophobicContact CE1-CB 4.25Å; F271-R285 HydrophobicContact CE1-CG 4.35Å; F271-R285 HydrophobicContact CZ-CB 4.12Å; E275-R285 VanDerWaalsContact CD-NH1 3.3Å; E275-R285 IonicContact OE1-CZ 3.29Å; E275-R285 VanDerWaalsContact OE1-CZ 3.29Å; E275-R285 IonicContact OE1-NH1 3.08Å; E275-R285 PolarHBondContact OE1-NH1 2.97Å; E275-R285 VanDerWaalsContact OE1-NH1 3.08Å; E275-R285 IonicContact OE1-NH2 2.67Å; E275-R285 PolarHBondContact OE1-NH2 3.35Å; E275-R285 IonicContact OE2-CZ 3.93Å; E275-R285 IonicContact OE2-NH1 2.96Å; E275-R285 PolarHBondContact OE2-NH1 2.74Å; L281-R285 HydrophobicContact CD1-CG 4.37Å; L281-R285 PolarHBondContact O-N 2.87Å; V282-R285 PolarHBondContact O-N 3.28Å; R285-E288 PolarHBondContact O-N 2.9Å; R285-H289 PolarHBondContact O-N 3.14Å
286	L	93.6	Very high	90.4	Very high	7 Å²	7	81.9 Å²	81.9	4%	0.037	38%	0.382	C	S	.	.	H	α-helix	trans	-67.9	-39.7	177.4	-62.6	175	0	0	0	111.5	V247 V269 V282 T283 K284 H289 I290 I298 I322	V247-L286 HydrophobicContact CG1-CD2 4.22Å; V247-L286 HydrophobicContact CG2-CD2 3.67Å; V269-L286 HydrophobicContact CB-CD2 4.43Å; V269-L286 HydrophobicContact CG1-CD2 4.26Å; V269-L286 HydrophobicContact CG2-CD2 4.48Å; V282-L286 HydrophobicContact CG1-CD1 3.81Å; V282-L286 HydrophobicContact CG1-CG 4.47Å; V282-L286 VanDerWaalsContact O-CG 3.25Å; V282-L286 WeakPolarHBondContact O-CG 3.13Å; V282-L286 PolarHBondContact O-N 3.16Å; V282-L286 VanDerWaalsContact O-N 3.08Å; T283-L286 PolarHBondContact O-N 3.08Å; K284-L286 VanDerWaalsContact C-N 3.29Å; K284-L286 PolarHBondContact O-N 3.01Å; L286-H289 PolarHBondContact O-N 3.2Å; L286-I290 WeakPolarHBondContact O-CG1 3.43Å; L286-I290 PolarHBondContact O-N 3.16Å; L286-I290 VanDerWaalsContact O-N 3.07Å; L286-I298 HydrophobicContact CB-CD1 4.32Å; L286-I298 HydrophobicContact CD2-CD1 3.8Å; L286-I298 HydrophobicContact CD2-CG2 4.27Å; L286-I322 HydrophobicContact CB-CD1 3.88Å; L286-I322 HydrophobicContact CB-CG1 4.12Å; L286-I322 HydrophobicContact CB-CG2 3.74Å; L286-I322 HydrophobicContact CD1-CD1 3.4Å; L286-I322 HydrophobicContact CD1-CG1 4.09Å; L286-I322 HydrophobicContact CG-CD1 4.24Å
287	K	94.2	Very high	91.3	Very high	102 Å²	102	78.2 Å²	78.2	44%	0.443	36%	0.364	S	S	.	.	H	α-helix	trans	-59	-47.3	172.4	-82.6	177.6	178.1	179.2	0	112.4	T283 K284 H289 I290 A291 E321 I322	T283-K287 HydrophobicContact CG2-CD 4.19Å; T283-K287 WeakPolarHBondContact O-CB 3.3Å; T283-K287 WeakPolarHBondContact O-CG 3.2Å; T283-K287 PolarHBondContact O-N 3.46Å; K284-K287 WeakPolarHBondContact O-CB 3.47Å; K284-K287 PolarHBondContact O-N 2.94Å; K287-H289 VanDerWaalsContact C-N 3.28Å; K287-H289 PolarHBondContact O-N 2.97Å; K287-I290 VanDerWaalsContact O-CG1 3.26Å; K287-I290 WeakPolarHBondContact O-CG1 3.48Å; K287-I290 PolarHBondContact O-N 3.47Å; K287-A291 WeakPolarHBondContact O-CB 3.37Å; K287-A291 PolarHBondContact O-N 2.8Å; K287-E321 WeakPolarHBondContact CE-O 3.4Å; K287-E321 PolarHBondContact NZ-O 2.93Å; K287-I322 WeakPolarHBondContact CE-O 3.37Å; K287-I322 HydrophobicContact CG-CG2 3.96Å; K287-I322 WeakPolarHBondContact CG-O 3.29Å
288	E	94.2	Very high	92.1	Very high	105 Å²	105	69.6 Å²	69.6	49%	0.491	33%	0.327	S	S	.	.	H	α-helix	trans	-62.4	-36	177.4	-71.4	169.2	-179.2	0	0	112.1	K284 R285	K284-E288 WeakPolarHBondContact CE-OE1 3.42Å; K284-E288 WeakPolarHBondContact O-CG 3.3Å; K284-E288 PolarHBondContact O-N 3Å; R285-E288 PolarHBondContact O-N 2.9Å
289	H	94.4	Very high	92.7	Very high	8 Å²	8	66 Å²	66	4%	0.037	31%	0.308	C	S	.	.	H	α-helix	trans	-67.7	-46	176.6	-175.1	104.2	0	0	0	112.5	P267 R285 L286 K287 A291 D292 L296 I298	P267-H289 PolarHBondContact O-CE1 2.95Å; R285-H289 PolarHBondContact O-N 3.14Å; L286-H289 PolarHBondContact O-N 3.2Å; K287-H289 VanDerWaalsContact C-N 3.28Å; K287-H289 PolarHBondContact O-N 2.97Å; H289-A291 VanDerWaalsContact C-N 3.29Å; H289-A291 PolarHBondContact O-N 3.1Å; H289-D292 PolarHBondContact O-N 2.84Å; H289-L296 PolarHBondContact NE2-O 2.87Å; H289-I298 HydrophobicContact CB-CD1 3.91Å; H289-I298 VanDerWaalsContact CD2-CD1 3.46Å; H289-I298 WeakPolarHBondContact CD2-CD1 3.37Å; H289-I298 WeakPolarHBondContact CD2-CG1 3.44Å
290	I	94.6	Very high	93.2	Very high	13 Å²	13	58.5 Å²	58.5	7%	0.067	28%	0.281	C	S	.	.	H	α-helix	trans	-75	-17.3	-179.5	65	166.1	0	0	0	113.9	I224 L286 K287 D292 K293 I298 I322 G323	I224-I290 HydrophobicContact CD1-CD1 4.34Å; I224-I290 HydrophobicContact CD1-CG2 4.27Å; I224-I290 HydrophobicContact CG1-CG2 3.77Å; L286-I290 WeakPolarHBondContact O-CG1 3.43Å; L286-I290 PolarHBondContact O-N 3.16Å; L286-I290 VanDerWaalsContact O-N 3.07Å; K287-I290 VanDerWaalsContact O-CG1 3.26Å; K287-I290 WeakPolarHBondContact O-CG1 3.48Å; K287-I290 PolarHBondContact O-N 3.47Å; I290-D292 VanDerWaalsContact C-N 3.27Å; I290-K293 PolarHBondContact O-NZ 3.4Å; I290-I298 HydrophobicContact CG2-CD1 3.56Å; I290-I298 HydrophobicContact CG2-CG1 4.04Å; I290-I322 HydrophobicContact CD1-CG2 3.93Å; I290-G323 VanDerWaalsContact CD1-O 3.27Å; I290-G323 WeakPolarHBondContact CD1-O 3.33Å
291	A	94.7	Very high	93.6	Very high	73 Å²	73	52.1 Å²	52.1	60%	0.603	25%	0.251	S	S	*	.	H	α-helix	trans	-65.8	-33.4	173.4	0	0	0	0	0	111.3	K287 H289 K293	K287-A291 WeakPolarHBondContact O-CB 3.37Å; K287-A291 PolarHBondContact O-N 2.8Å; H289-A291 VanDerWaalsContact C-N 3.29Å; H289-A291 PolarHBondContact O-N 3.1Å; A291-K293 PolarHBondContact O-N 2.89Å
292	D	92.8	Very high	93.9	Very high	63 Å²	63	50.1 Å²	50.1	34%	0.337	24%	0.241	S	C	.	.			trans	-82.9	101.4	173.1	-174.7	-7.3	0	0	0	111.1	H289 I290 K294 K295	H289-D292 PolarHBondContact O-N 2.84Å; I290-D292 VanDerWaalsContact C-N 3.27Å; D292-K294 PolarHBondContact O-N 3.36Å; D292-K294 VanDerWaalsContact O-N 3.09Å; D292-K294 VanDerWaalsContact OD1-CB 3.31Å; D292-K294 WeakPolarHBondContact OD1-CB 3.36Å; D292-K294 PolarHBondContact OD1-N 3.49Å; D292-K295 HydrophobicContact CB-CD 3.91Å; D292-K295 HydrophobicContact CB-CG 3.97Å; D292-K295 PolarHBondContact O-N 3.26Å; D292-K295 VanDerWaalsContact O-N 3.11Å; D292-K295 VanDerWaalsContact OD2-CE 3.31Å; D292-K295 WeakPolarHBondContact OD2-CE 3.37Å
293	K	92.5	Very high	94	Very high	125 Å²	125	49 Å²	49	54%	0.543	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-5.1	179.6	-58.1	-50.7	-175.3	-165.2	0	114.6	K221 G222 I290 A291	K221-K293 VanDerWaalsContact CB-O 3.23Å; K221-K293 WeakPolarHBondContact CB-O 3.49Å; G222-K293 PolarHBondContact O-NZ 3.49Å; I290-K293 PolarHBondContact O-NZ 3.4Å; A291-K293 PolarHBondContact O-N 2.89Å
294	K	90.7	Very high	93.8	Very high	168 Å²	168	51.2 Å²	51.2	73%	0.73	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-17.9	173.5	-58.9	179.3	-178.8	175.2	0	112.6	D292	D292-K294 PolarHBondContact O-N 3.36Å; D292-K294 VanDerWaalsContact O-N 3.09Å; D292-K294 VanDerWaalsContact OD1-CB 3.31Å; D292-K294 WeakPolarHBondContact OD1-CB 3.36Å; D292-K294 PolarHBondContact OD1-N 3.49Å
295	K	92.3	Very high	93.7	Very high	65 Å²	65	46.6 Å²	46.6	28%	0.283	24%	0.242	S	C	.	.	S	Bend	trans	-78	150.5	-179.6	-68.8	-177.9	-174.2	171.9	0	111.9	K221 G222 D292	K221-K295 CarbonylContact C-O 3.56Å; K221-K295 VanDerWaalsContact CA-O 3.24Å; K221-K295 WeakPolarHBondContact CA-O 3.46Å; K221-K295 WeakPolarHBondContact CB-O 3.39Å; G222-K295 PolarHBondContact N-O 2.89Å; D292-K295 HydrophobicContact CB-CD 3.91Å; D292-K295 HydrophobicContact CB-CG 3.97Å; D292-K295 PolarHBondContact O-N 3.26Å; D292-K295 VanDerWaalsContact O-N 3.11Å; D292-K295 VanDerWaalsContact OD2-CE 3.31Å; D292-K295 WeakPolarHBondContact OD2-CE 3.37Å
296	L	95.2	Very high	93.8	Very high	16 Å²	16	43.1 Å²	43.1	8%	0.084	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-59	147.7	176.8	-68.3	172.8	0	0	0	111.7	E192 C243 A245 C266 H289	E192-L296 HydrophobicContact CG-CD1 4.5Å; E192-L296 HydrophobicContact CG-CD2 4.17Å; C243-L296 HydrophobicContact CB-CD1 3.75Å; C243-L296 HydrophobicContact CB-CD2 3.89Å; C243-L296 HydrophobicContact CB-CG 4.47Å; A245-L296 HydrophobicContact CB-CB 4.35Å; C266-L296 VanDerWaalsContact SG-CD1 3.56Å; H289-L296 PolarHBondContact NE2-O 2.87Å
297	P	96.7	Very high	93.7	Very high	4 Å²	4	42.8 Å²	42.8	3%	0.026	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-55.7	140.5	173.9	21.7	-31.2	0	0	0	110.7	P219 Q220 G223 Y244 A245	P219-P297 HydrophobicContact CB-CB 3.98Å; P219-P297 HydrophobicContact CB-CG 4.08Å; Q220-P297 WeakPolarHBondContact O-CB 3.47Å; G223-P297 VanDerWaalsContact O-CA 3.32Å; G223-P297 WeakPolarHBondContact O-CA 3.46Å; Y244-P297 WeakPolarHBondContact CA-O 3.35Å; Y244-P297 HydrophobicContact CD1-CB 4.24Å; Y244-P297 HydrophobicContact CD1-CG 3.76Å; Y244-P297 HydrophobicContact CE1-CG 4.03Å; A245-P297 PolarHBondContact N-O 2.97Å
298	I	96.4	Very high	93.6	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	124.1	176	-56	-173.3	0	0	0	108.7	G223 I224 C225 A245 V247 L286 H289 I290 I300	G223-I298 PolarHBondContact O-N 3.26Å; I224-I298 CarbonylContact C-O 3.5Å; I224-I298 WeakPolarHBondContact CA-O 3.02Å; C225-I298 PolarHBondContact N-O 3.43Å; A245-I298 WeakPolarHBondContact O-CA 3.03Å; V247-I298 HydrophobicContact CG2-CG2 3.17Å; L286-I298 HydrophobicContact CB-CD1 4.32Å; L286-I298 HydrophobicContact CD2-CD1 3.8Å; L286-I298 HydrophobicContact CD2-CG2 4.27Å; H289-I298 HydrophobicContact CB-CD1 3.91Å; H289-I298 VanDerWaalsContact CD2-CD1 3.46Å; H289-I298 WeakPolarHBondContact CD2-CD1 3.37Å; H289-I298 WeakPolarHBondContact CD2-CG1 3.44Å; I290-I298 HydrophobicContact CG2-CD1 3.56Å; I290-I298 HydrophobicContact CG2-CG1 4.04Å; I298-I300 HydrophobicContact CG2-CD1 4.01Å; I298-I300 HydrophobicContact CG2-CG1 3.74Å
299	L	96.7	Very high	93.6	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	121	172.7	176.9	60.1	0	0	0	110.6	C225 V235 L238 Y244 A245 M246 F301	C225-L299 HydrophobicContact CB-CD1 4.02Å; V235-L299 HydrophobicContact CG2-CD2 4.28Å; L238-L299 HydrophobicContact CD1-CD1 3.58Å; L238-L299 HydrophobicContact CD1-CD2 3.81Å; L238-L299 HydrophobicContact CD1-CG 4.38Å; Y244-L299 HydrophobicContact CD1-CB 3.98Å; Y244-L299 HydrophobicContact CD2-CD2 4.45Å; Y244-L299 HydrophobicContact CG-CB 3.96Å; Y244-L299 HydrophobicContact CG-CD2 4.27Å; A245-L299 PolarHBondContact O-N 3.25Å; M246-L299 HydrophobicContact CE-CD2 4.28Å; M246-L299 HydrophobicContact SD-CB 4.1Å; M246-L299 HydrophobicContact SD-CD2 3.81Å; M246-L299 HydrophobicContact SD-CG 4.34Å; L299-F301 HydrophobicContact CD1-CE1 4.41Å; L299-F301 HydrophobicContact CD1-CE2 4.39Å; L299-F301 HydrophobicContact CD1-CZ 4.07Å; L299-F301 HydrophobicContact CD2-CE2 3.91Å; L299-F301 HydrophobicContact CD2-CZ 3.8Å; L299-F301 HydrophobicContact CG-CE2 3.9Å; L299-F301 HydrophobicContact CG-CZ 3.98Å
300	I	95.7	Very high	93.6	Very high	20 Å²	20	34.9 Å²	34.9	10%	0.103	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	137.4	179.1	-54.1	-177.7	0	0	0	110.1	I224 C225 V226 A227 V247 I298 P302 I322	I224-I300 HydrophobicContact CG2-CD1 3.82Å; I224-I300 HydrophobicContact CG2-CG1 4.15Å; C225-I300 PolarHBondContact O-N 3.04Å; V226-I300 WeakPolarHBondContact CA-O 3.45Å; A227-I300 PolarHBondContact N-O 3.26Å; V247-I300 HydrophobicContact CG2-CG1 4.46Å; I298-I300 HydrophobicContact CG2-CD1 4.01Å; I298-I300 HydrophobicContact CG2-CG1 3.74Å; I300-P302 VanDerWaalsContact O-CD 3.31Å; I300-P302 WeakPolarHBondContact O-CD 3.17Å; I300-I322 HydrophobicContact CD1-CD1 3.74Å
301	F	96	Very high	93.6	Very high	30 Å²	30	34.3 Å²	34.3	13%	0.132	19%	0.193	C	C	.	.			trans	-109.5	86.1	172.8	-64.9	-71.6	0	0	0	109.2	A227 H229 D234 V235 M246 L299 E303 G304	A227-F301 HydrophobicContact CB-CD1 4.14Å; A227-F301 HydrophobicContact CB-CE1 3.88Å; H229-F301 HydrophobicContact CB-CB 3.79Å; H229-F301 HydrophobicContact CB-CD1 3.66Å; H229-F301 HydrophobicContact CB-CG 3.92Å; H229-F301 AromaticContact CE1-CD2 3.93Å; H229-F301 AromaticContact CG-CD1 3.65Å; H229-F301 AromaticContact CG-CG 3.6Å; H229-F301 AromaticContact ND1-CD1 3.48Å; H229-F301 WeakPolarHBondContact ND1-CD1 3.32Å; H229-F301 AromaticContact ND1-CD2 3.93Å; H229-F301 AromaticContact ND1-CE1 3.7Å; H229-F301 AromaticContact ND1-CG 3.59Å; D234-F301 HydrophobicContact CB-CE1 3.85Å; D234-F301 HydrophobicContact CB-CZ 3.72Å; V235-F301 HydrophobicContact CG2-CE2 3.76Å; V235-F301 HydrophobicContact CG2-CZ 4.13Å; M246-F301 HydrophobicContact CE-CE2 4.49Å; L299-F301 HydrophobicContact CD1-CE1 4.41Å; L299-F301 HydrophobicContact CD1-CE2 4.39Å; L299-F301 HydrophobicContact CD1-CZ 4.07Å; L299-F301 HydrophobicContact CD2-CE2 3.91Å; L299-F301 HydrophobicContact CD2-CZ 3.8Å; L299-F301 HydrophobicContact CG-CE2 3.9Å; L299-F301 HydrophobicContact CG-CZ 3.98Å; F301-E303 PolarHBondContact O-N 3.45Å; F301-E303 VanDerWaalsContact O-N 3.14Å; F301-G304 PolarHBondContact O-N 3.36Å; F301-G304 VanDerWaalsContact O-N 3.13Å
302	P	95	Very high	93.6	Very high	3 Å²	3	30.8 Å²	30.8	2%	0.019	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-8.6	-167.7	29.8	-38.1	0	0	0	114.4	V226 I300 G304 F315 K316 F320	V226-P302 HydrophobicContact CG1-CG 3.61Å; I300-P302 VanDerWaalsContact O-CD 3.31Å; I300-P302 WeakPolarHBondContact O-CD 3.17Å; P302-G304 PolarHBondContact O-N 3.06Å; P302-F315 HydrophobicContact CB-CB 4Å; P302-F315 HydrophobicContact CB-CD1 4.25Å; P302-F315 HydrophobicContact CB-CD2 4.23Å; P302-F315 HydrophobicContact CB-CG 3.91Å; P302-F315 HydrophobicContact CG-CB 4.12Å; P302-F315 HydrophobicContact CG-CD1 3.67Å; P302-F315 HydrophobicContact CG-CD2 3.47Å; P302-F315 VanDerWaalsContact CG-CD2 3.47Å; P302-F315 HydrophobicContact CG-CE1 3.82Å; P302-F315 HydrophobicContact CG-CE2 3.63Å; P302-F315 HydrophobicContact CG-CG 3.48Å; P302-F315 VanDerWaalsContact CG-CG 3.48Å; P302-F315 HydrophobicContact CG-CZ 3.8Å; P302-K316 WeakPolarHBondContact O-CB 3.35Å; P302-K316 WeakPolarHBondContact O-CG 3.1Å; P302-K316 PolarHBondContact O-N 3.39Å; P302-F320 HydrophobicContact CB-CE2 3.89Å; P302-F320 HydrophobicContact CB-CZ 4.49Å; P302-F320 HydrophobicContact CG-CE2 4.23Å; P302-F320 HydrophobicContact CG-CZ 4.34Å
303	E	92.6	Very high	93.7	Very high	3 Å²	3	27.8 Å²	27.8	1%	0.014	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-28.7	169.4	-62.9	-174.9	142.8	0	0	111.7	H229 F301 T305 V312 M313 F315	H229-E303 PolarHBondContact N-OE2 3.46Å; F301-E303 PolarHBondContact O-N 3.45Å; F301-E303 VanDerWaalsContact O-N 3.14Å; E303-T305 PolarHBondContact O-N 2.77Å; E303-V312 WeakPolarHBondContact OE1-CA 3.4Å; E303-V312 WeakPolarHBondContact OE1-CG1 3.44Å; E303-M313 HydrophobicContact CG-CB 4.41Å; E303-M313 PolarHBondContact OE1-N 2.91Å; E303-F315 HydrophobicContact CG-CD1 3.88Å; E303-F315 HydrophobicContact CG-CE1 3.62Å
304	G	87.8	Confident	93.8	Very high	65 Å²	65	25.3 Å²	25.3	67%	0.67	14%	0.139	S	C	*	.	S	Bend	trans	71.2	4.1	-179.4	0	0	0	0	0	114.7	F301 P302	F301-G304 PolarHBondContact O-N 3.36Å; F301-G304 VanDerWaalsContact O-N 3.13Å; P302-G304 PolarHBondContact O-N 3.06Å
305	T	90	Very high	94.1	Very high	25 Å²	25	17.6 Å²	17.6	15%	0.153	11%	0.106	C	C	.	.	S	Bend	trans	-152.7	159.2	175.5	-175.9	0	0	0	0	109.8	F116 E303 I307	F116-T305 HydrophobicContact CE1-CG2 3.93Å; F116-T305 HydrophobicContact CZ-CG2 4.11Å; E303-T305 PolarHBondContact O-N 2.77Å; T305-I307 HydrophobicContact CG2-CD1 3.79Å; T305-I307 HydrophobicContact CG2-CG1 4.19Å
306	C	93.3	Very high	94	Very high	9 Å²	9	18.2 Å²	18.2	6%	0.061	11%	0.109	C	C	.	.			trans	-79.8	139.5	169.6	-59.4	0	0	0	0	110.9	H229 T230 F341	H229-C306 VanDerWaalsContact CD2-SG 3.56Å; H229-C306 PolarHBondContact NE2-SG 2.83Å; H229-C306 VanDerWaalsContact NE2-SG 3.37Å; H229-C306 CarbonylContact O-C 3.6Å; H229-C306 WeakPolarHBondContact O-CA 3.2Å; T230-C306 WeakPolarHBondContact O-CB 3.39Å; C306-F341 HydrophobicContact CB-CE2 4.42Å
307	I	92.3	Very high	93.8	Very high	1 Å²	1	22.1 Å²	22.1	1%	0.005	13%	0.125	C	C	.	.			trans	-129.5	153.5	-179.1	-58.3	-65	0	0	0	109.9	R115 F116 H229 T230 T305 N309 M313 F341	R115-I307 HydrophobicContact CB-CG2 3.83Å; F116-I307 HydrophobicContact CD1-CD1 4.01Å; F116-I307 HydrophobicContact CE1-CD1 3.41Å; F116-I307 VanDerWaalsContact CE1-CD1 3.41Å; F116-I307 HydrophobicContact CE2-CD1 4.08Å; F116-I307 HydrophobicContact CZ-CD1 3.44Å; F116-I307 VanDerWaalsContact CZ-CD1 3.44Å; H229-I307 PolarHBondContact O-N 3.19Å; T230-I307 VanDerWaalsContact CA-O 3.25Å; T230-I307 WeakPolarHBondContact CA-O 3.43Å; T230-I307 WeakPolarHBondContact CG2-O 3.32Å; T230-I307 PolarHBondContact OG1-O 3.01Å; T305-I307 HydrophobicContact CG2-CD1 3.79Å; T305-I307 HydrophobicContact CG2-CG1 4.19Å; I307-N309 PolarHBondContact O-N 2.99Å; I307-M313 HydrophobicContact CD1-CG 3.58Å; I307-M313 HydrophobicContact CG1-CB 4.44Å; I307-M313 HydrophobicContact CG1-CG 3.62Å; I307-M313 HydrophobicContact CG2-CG 4.32Å; I307-F341 WeakPolarHBondContact O-CD2 3.39Å
308	N	91.7	Very high	93.5	Very high	12 Å²	12	23.3 Å²	23.3	6%	0.064	14%	0.138	C	C	.	.			trans	-67.5	10.9	-172.6	73.5	-7.9	0	0	0	117.2	Q114 R115 S117 T310 F341	Q114-N308 PolarHBondContact O-ND2 3.43Å; R115-N308 WeakPolarHBondContact O-CB 3.45Å; R115-N308 VanDerWaalsContact O-CG 3.27Å; R115-N308 PolarHBondContact O-N 2.93Å; R115-N308 PolarHBondContact O-OD1 3.11Å; S117-N308 WeakPolarHBondContact O-CB 3.47Å; S117-N308 PolarHBondContact O-ND2 2.98Å; N308-T310 VanDerWaalsContact C-N 3.3Å; N308-T310 PolarHBondContact O-N 3.19Å; N308-T310 PolarHBondContact OD1-N 2.94Å; N308-T310 PolarHBondContact OD1-OG1 3.25Å; N308-F341 HydrophobicContact CB-CB 4.3Å; N308-F341 HydrophobicContact CB-CD1 3.92Å; N308-F341 HydrophobicContact CB-CD2 4.19Å; N308-F341 HydrophobicContact CB-CE1 4.31Å; N308-F341 HydrophobicContact CB-CG 3.86Å
309	N	95.4	Very high	93.2	Very high	6 Å²	6	24.3 Å²	24.3	3%	0.032	15%	0.145	C	C	.	.	S	Bend	trans	67.3	18	177.3	-155.4	-111.4	0	0	0	115.8	N228 T230 I307 I331 K332 Y333 L397	N228-N309 PolarHBondContact ND2-ND2 3.43Å; T230-N309 HydrophobicContact CG2-CB 3.91Å; T230-N309 VanDerWaalsContact OG1-CB 3.28Å; T230-N309 WeakPolarHBondContact OG1-CB 3.4Å; T230-N309 PolarHBondContact OG1-ND2 3.27Å; I307-N309 PolarHBondContact O-N 2.99Å; N309-I331 PolarHBondContact ND2-O 3.29Å; N309-K332 PolarHBondContact O-NZ 2.89Å; N309-K332 WeakPolarHBondContact OD1-CA 3.3Å; N309-K332 WeakPolarHBondContact OD1-CD 3.4Å; N309-Y333 HydrophobicContact CB-CD2 4.41Å; N309-Y333 PolarHBondContact OD1-N 3.22Å; N309-L397 WeakPolarHBondContact O-CD2 3.46Å
310	T	93.1	Very high	93	Very high	30 Å²	30	24.5 Å²	24.5	18%	0.184	15%	0.146	C	C	.	.	S	Bend	trans	-96	-20.3	170.3	69.4	0	0	0	0	112.9	R115 E119 N308 T398	R115-T310 WeakPolarHBondContact CD-OG1 3.49Å; E119-T310 HydrophobicContact CB-CG2 3.93Å; E119-T310 HydrophobicContact CG-CG2 3.82Å; E119-T310 WeakPolarHBondContact OE2-CG2 3.24Å; N308-T310 VanDerWaalsContact C-N 3.3Å; N308-T310 PolarHBondContact O-N 3.19Å; N308-T310 PolarHBondContact OD1-N 2.94Å; N308-T310 PolarHBondContact OD1-OG1 3.25Å; T310-T398 PolarHBondContact O-N 2.98Å; T310-T398 VanDerWaalsContact O-N 3.09Å
311	S	94	Very high	92.9	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.007	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	165.2	-177.4	62.2	0	0	0	0	111.9	R115 T398	R115-S311 WeakPolarHBondContact CD-OG 3.46Å; R115-S311 WeakPolarHBondContact CG-OG 3Å; S311-T398 CarbonylContact C-O 3.45Å; S311-T398 WeakPolarHBondContact CA-O 3.48Å; S311-T398 WeakPolarHBondContact CB-O 3.45Å
312	V	96.1	Very high	92.7	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	122.6	165.8	-171.8	0	0	0	0	109	N228 E303 F315 K388 I391 A392 L397 T398 L400	N228-V312 HydrophobicContact CB-CG2 4.25Å; E303-V312 WeakPolarHBondContact OE1-CA 3.4Å; E303-V312 WeakPolarHBondContact OE1-CG1 3.44Å; V312-F315 HydrophobicContact CG1-CD1 4.18Å; V312-F315 HydrophobicContact CG1-CE1 3.33Å; V312-F315 HydrophobicContact CG1-CZ 3.78Å; V312-K388 HydrophobicContact CB-CG 4.3Å; V312-K388 HydrophobicContact CG1-CD 4.36Å; V312-K388 HydrophobicContact CG1-CG 3.56Å; V312-I391 HydrophobicContact CG2-CG2 4.28Å; V312-A392 HydrophobicContact CB-CB 4.18Å; V312-A392 HydrophobicContact CG2-CB 3.83Å; V312-L397 HydrophobicContact CG2-CB 3.85Å; V312-L397 HydrophobicContact CG2-CD1 3.45Å; V312-L397 VanDerWaalsContact CG2-CD1 3.45Å; V312-L397 HydrophobicContact CG2-CG 4.28Å; V312-T398 PolarHBondContact N-O 2.86Å; V312-L400 PolarHBondContact O-N 3.24Å
313	M	94.3	Very high	92.4	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	17%	0.167	C	C	.	.	P	Polyproline II helix	trans	-81.5	171.9	179.6	-65.9	-67.1	-80.4	0	0	111.4	V112 R115 F116 E303 I307 F315 K388 L400 W402	V112-M313 HydrophobicContact CG1-CE 4.18Å; R115-M313 HydrophobicContact CG-SD 4.49Å; F116-M313 HydrophobicContact CE2-CE 4.49Å; E303-M313 HydrophobicContact CG-CB 4.41Å; E303-M313 PolarHBondContact OE1-N 2.91Å; I307-M313 HydrophobicContact CD1-CG 3.58Å; I307-M313 HydrophobicContact CG1-CB 4.44Å; I307-M313 HydrophobicContact CG1-CG 3.62Å; I307-M313 HydrophobicContact CG2-CG 4.32Å; M313-F315 WeakPolarHBondContact O-CD1 3.07Å; M313-F315 PolarHBondContact O-N 3.18Å; M313-K388 WeakPolarHBondContact O-CD 3.35Å; M313-L400 HydrophobicContact SD-CB 4.06Å; M313-L400 HydrophobicContact SD-CD1 3.66Å; M313-W402 HydrophobicContact CE-CB 3.84Å; M313-W402 WeakPolarHBondContact CE-O 3.29Å
314	M	94.5	Very high	92.3	Very high	72 Å²	72	28.9 Å²	28.9	36%	0.355	19%	0.186	S	C	.	.	P	Polyproline II helix	trans	-53.3	128.1	176	-178.6	-165.6	-77.8	0	0	111.2	P401 W402 D403	M314-P401 WeakPolarHBondContact CE-O 3.38Å; M314-W402 WeakPolarHBondContact CB-O 3.33Å; M314-W402 PolarHBondContact N-O 3.2Å; M314-D403 HydrophobicContact SD-CB 4.33Å
315	F	96.4	Very high	92.7	Very high	6 Å²	6	28 Å²	28	3%	0.026	17%	0.168	C	C	.	.	P	Polyproline II helix	trans	-79.9	132.2	172.2	-78.3	7.5	0	0	0	111.2	V226 P302 E303 V312 M313 K317 F320 A384 V387 K388 I391	V226-F315 HydrophobicContact CG1-CD2 4.38Å; V226-F315 HydrophobicContact CG1-CE2 3.73Å; V226-F315 HydrophobicContact CG1-CZ 4.33Å; P302-F315 HydrophobicContact CB-CB 4Å; P302-F315 HydrophobicContact CB-CD1 4.25Å; P302-F315 HydrophobicContact CB-CD2 4.23Å; P302-F315 HydrophobicContact CB-CG 3.91Å; P302-F315 HydrophobicContact CG-CB 4.12Å; P302-F315 HydrophobicContact CG-CD1 3.67Å; P302-F315 HydrophobicContact CG-CD2 3.47Å; P302-F315 VanDerWaalsContact CG-CD2 3.47Å; P302-F315 HydrophobicContact CG-CE1 3.82Å; P302-F315 HydrophobicContact CG-CE2 3.63Å; P302-F315 HydrophobicContact CG-CG 3.48Å; P302-F315 VanDerWaalsContact CG-CG 3.48Å; P302-F315 HydrophobicContact CG-CZ 3.8Å; E303-F315 HydrophobicContact CG-CD1 3.88Å; E303-F315 HydrophobicContact CG-CE1 3.62Å; V312-F315 HydrophobicContact CG1-CD1 4.18Å; V312-F315 HydrophobicContact CG1-CE1 3.33Å; V312-F315 HydrophobicContact CG1-CZ 3.78Å; M313-F315 WeakPolarHBondContact O-CD1 3.07Å; M313-F315 PolarHBondContact O-N 3.18Å; F315-K317 PolarHBondContact O-N 3.02Å; F315-F320 HydrophobicContact CB-CE2 3.97Å; F315-F320 HydrophobicContact CB-CZ 4.46Å; F315-F320 HydrophobicContact CD2-CE2 4.01Å; F315-F320 AromaticContact CD2-CZ 3.67Å; F315-F320 HydrophobicContact CD2-CZ 3.67Å; F315-F320 HydrophobicContact CE2-CZ 4.39Å; F315-F320 HydrophobicContact CG-CE2 4.42Å; F315-A384 HydrophobicContact CB-CB 4.18Å; F315-V387 HydrophobicContact CE2-CG1 4.24Å; F315-K388 HydrophobicContact CB-CB 4.49Å; F315-K388 HydrophobicContact CD1-CB 4.25Å; F315-K388 HydrophobicContact CD1-CD 4.36Å; F315-K388 HydrophobicContact CD1-CG 3.94Å; F315-K388 HydrophobicContact CD2-CB 3.61Å; F315-K388 HydrophobicContact CD2-CG 4.21Å; F315-K388 HydrophobicContact CE1-CB 4.43Å; F315-K388 HydrophobicContact CE1-CG 4.04Å; F315-K388 HydrophobicContact CE2-CB 3.82Å; F315-K388 HydrophobicContact CE2-CG 4.3Å; F315-K388 HydrophobicContact CG-CB 3.86Å; F315-K388 HydrophobicContact CG-CD 4.48Å; F315-K388 HydrophobicContact CG-CG 4.05Å; F315-K388 HydrophobicContact CZ-CB 4.24Å; F315-K388 HydrophobicContact CZ-CG 4.23Å; F315-I391 HydrophobicContact CE2-CD1 3.94Å; F315-I391 HydrophobicContact CZ-CD1 3.94Å
316	K	91.9	Very high	93.1	Very high	78 Å²	78	27 Å²	27	34%	0.339	16%	0.161	S	C	.	.	P	Polyproline II helix	trans	-70.5	120.3	176.8	-59.7	-68.8	175.1	161.6	0	110.3	P302 G318 S319 D403	P302-K316 WeakPolarHBondContact O-CB 3.35Å; P302-K316 WeakPolarHBondContact O-CG 3.1Å; P302-K316 PolarHBondContact O-N 3.39Å; K316-G318 PolarHBondContact O-N 2.88Å; K316-S319 PolarHBondContact O-N 2.76Å; K316-D403 VanDerWaalsContact CE-OD1 3.29Å; K316-D403 WeakPolarHBondContact CE-OD1 3.47Å; K316-D403 IonicContact NZ-OD1 3.5Å; K316-D403 PolarHBondContact NZ-OD1 3.46Å; K316-D403 IonicContact NZ-OD2 3.55Å; K316-D403 PolarHBondContact NZ-OD2 3.33Å
317	K	90.9	Very high	93.4	Very high	98 Å²	98	27.1 Å²	27.1	43%	0.426	16%	0.161	S	C	.	.	G	3₁₀ helix	trans	-53.7	-28.5	-179.7	72.5	173.7	-169.5	167.5	0	115.3	F315 S319 F320 E321 A380 V381	F315-K317 PolarHBondContact O-N 3.02Å; K317-S319 PolarHBondContact O-N 3.41Å; K317-F320 WeakPolarHBondContact O-CA 3.43Å; K317-F320 WeakPolarHBondContact O-CB 3.35Å; K317-F320 PolarHBondContact O-N 2.72Å; K317-E321 WeakPolarHBondContact CE-OE1 3.43Å; K317-E321 IonicContact NZ-OE1 2.72Å; K317-E321 PolarHBondContact O-N 3.39Å; K317-A380 HydrophobicContact CB-CB 4.5Å; K317-V381 HydrophobicContact CB-CG2 3.94Å; K317-V381 HydrophobicContact CD-CG2 3.8Å; K317-V381 HydrophobicContact CG-CG2 4.5Å
318	G	89.2	Confident	93.7	Very high	29 Å²	29	27.1 Å²	27.1	30%	0.299	16%	0.161	S	C	.	.	G	3₁₀ helix	trans	-58.3	-32.6	-177.7	0	0	0	0	0	113.2	K316 F320 E321	K316-G318 PolarHBondContact O-N 2.88Å; G318-F320 PolarHBondContact O-N 3.3Å; G318-E321 PolarHBondContact O-N 2.86Å
319	S	89.4	Confident	94	Very high	21 Å²	21	26.5 Å²	26.5	15%	0.147	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-67.4	-19.1	175.5	-47.5	0	0	0	0	113.2	K316 K317 I322	K316-S319 PolarHBondContact O-N 2.76Å; K317-S319 PolarHBondContact O-N 3.41Å; S319-I322 WeakPolarHBondContact O-CD1 3.42Å
320	F	94.4	Very high	94.1	Very high	5 Å²	5	26.2 Å²	26.2	2%	0.022	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-104.4	-6.6	-176.7	-61.6	-92.8	0	0	0	112.4	V226 P302 F315 K317 G318 I322 I326 A380 F383 A384 V387	V226-F320 HydrophobicContact CG1-CZ 4.2Å; V226-F320 HydrophobicContact CG2-CZ 4.42Å; P302-F320 HydrophobicContact CB-CE2 3.89Å; P302-F320 HydrophobicContact CB-CZ 4.49Å; P302-F320 HydrophobicContact CG-CE2 4.23Å; P302-F320 HydrophobicContact CG-CZ 4.34Å; F315-F320 HydrophobicContact CB-CE2 3.97Å; F315-F320 HydrophobicContact CB-CZ 4.46Å; F315-F320 HydrophobicContact CD2-CE2 4.01Å; F315-F320 AromaticContact CD2-CZ 3.67Å; F315-F320 HydrophobicContact CD2-CZ 3.67Å; F315-F320 HydrophobicContact CE2-CZ 4.39Å; F315-F320 HydrophobicContact CG-CE2 4.42Å; K317-F320 WeakPolarHBondContact O-CA 3.43Å; K317-F320 WeakPolarHBondContact O-CB 3.35Å; K317-F320 PolarHBondContact O-N 2.72Å; G318-F320 PolarHBondContact O-N 3.3Å; F320-I322 VanDerWaalsContact C-N 3.32Å; F320-I326 HydrophobicContact CD1-CD1 4.5Å; F320-I326 HydrophobicContact CE1-CD1 4.44Å; F320-A380 HydrophobicContact CB-CB 4.39Å; F320-F383 HydrophobicContact CB-CD1 4.14Å; F320-F383 AromaticContact CD1-CD1 3.72Å; F320-F383 HydrophobicContact CD1-CD1 3.72Å; F320-F383 AromaticContact CD1-CE1 3.92Å; F320-F383 HydrophobicContact CD1-CE1 3.92Å; F320-F383 HydrophobicContact CD1-CG 4.15Å; F320-F383 HydrophobicContact CG-CD1 4.41Å; F320-A384 HydrophobicContact CB-CB 4.43Å; F320-A384 HydrophobicContact CD1-CB 4.22Å; F320-A384 HydrophobicContact CD2-CB 3.41Å; F320-A384 VanDerWaalsContact CD2-CB 3.41Å; F320-A384 HydrophobicContact CE1-CB 4.38Å; F320-A384 HydrophobicContact CE2-CB 3.61Å; F320-A384 HydrophobicContact CG-CB 3.75Å; F320-A384 HydrophobicContact CZ-CB 4.11Å; F320-V387 HydrophobicContact CE1-CB 3.83Å; F320-V387 HydrophobicContact CE1-CG1 4.05Å; F320-V387 HydrophobicContact CE1-CG2 3.86Å; F320-V387 HydrophobicContact CZ-CB 4.26Å; F320-V387 HydrophobicContact CZ-CG1 4.27Å
321	E	93.1	Very high	94.4	Very high	70 Å²	70	24.8 Å²	24.8	33%	0.327	15%	0.147	S	C	.	.	S	Bend	trans	-81.7	-12.4	172.1	-69.5	172.6	177.7	0	0	112.6	K287 K317 G318 G323 A380	K287-E321 WeakPolarHBondContact CE-O 3.4Å; K287-E321 PolarHBondContact NZ-O 2.93Å; K317-E321 WeakPolarHBondContact CE-OE1 3.43Å; K317-E321 IonicContact NZ-OE1 2.72Å; K317-E321 PolarHBondContact O-N 3.39Å; G318-E321 PolarHBondContact O-N 2.86Å; E321-G323 VanDerWaalsContact C-N 3.26Å; E321-G323 PolarHBondContact O-N 3.33Å; E321-A380 HydrophobicContact CG-CB 3.77Å
322	I	91.5	Very high	94.6	Very high	4 Å²	4	27 Å²	27	2%	0.021	16%	0.157	C	C	.	.	S	Bend	trans	-64.2	-33.8	177.3	-51.5	167.2	0	0	0	110.6	I224 L286 K287 I290 I300 S319 F320	I224-I322 HydrophobicContact CD1-CB 4Å; I224-I322 HydrophobicContact CD1-CD1 4.14Å; I224-I322 HydrophobicContact CD1-CG2 3.88Å; L286-I322 HydrophobicContact CB-CD1 3.88Å; L286-I322 HydrophobicContact CB-CG1 4.12Å; L286-I322 HydrophobicContact CB-CG2 3.74Å; L286-I322 HydrophobicContact CD1-CD1 3.4Å; L286-I322 HydrophobicContact CD1-CG1 4.09Å; L286-I322 HydrophobicContact CG-CD1 4.24Å; K287-I322 WeakPolarHBondContact CE-O 3.37Å; K287-I322 HydrophobicContact CG-CG2 3.96Å; K287-I322 WeakPolarHBondContact CG-O 3.29Å; I290-I322 HydrophobicContact CD1-CG2 3.93Å; I300-I322 HydrophobicContact CD1-CD1 3.74Å; S319-I322 WeakPolarHBondContact O-CD1 3.42Å; F320-I322 VanDerWaalsContact C-N 3.32Å
323	G	88	Confident	94.6	Very high	35 Å²	35	27.4 Å²	27.4	36%	0.361	16%	0.159	S	C	.	.			trans	74	-173.4	-170.8	0	0	0	0	0	112.7	I224 I290 E321	I224-G323 WeakPolarHBondContact CD1-O 3.29Å; I290-G323 VanDerWaalsContact CD1-O 3.27Å; I290-G323 WeakPolarHBondContact CD1-O 3.33Å; E321-G323 VanDerWaalsContact C-N 3.26Å; E321-G323 PolarHBondContact O-N 3.33Å
324	G	91.8	Very high	94.5	Very high	39 Å²	39	30 Å²	30	40%	0.402	17%	0.173	S	C	.	.	S	Bend	trans	84.3	-168	-173.6	0	0	0	0	0	113.6
325	T	96.4	Very high	94.3	Very high	47 Å²	47	27.8 Å²	27.8	29%	0.288	16%	0.163	S	C	.	.			trans	-92.6	121.2	-176.4	-52.4	0	0	0	0	110.5	I224 P371 T373	I224-T325 PolarHBondContact N-O 3.42Å; T325-P371 HydrophobicContact CG2-CB 3.45Å; T325-P371 VanDerWaalsContact CG2-CB 3.45Å; T325-T373 HydrophobicContact CG2-CG2 4.45Å
326	I	97.9	Very high	93.9	Very high	3 Å²	3	29.7 Å²	29.7	2%	0.015	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	132.3	172.8	-63.5	-74.5	0	0	0	108.5	I224 V226 F320 P328 P371 M372 F383 V387	I224-I326 HydrophobicContact CB-CD1 3.7Å; I224-I326 HydrophobicContact CD1-CD1 4.13Å; I224-I326 HydrophobicContact CG1-CD1 4.5Å; I224-I326 HydrophobicContact CG2-CD1 3.67Å; I224-I326 CarbonylContact O-C 3.59Å; I224-I326 WeakPolarHBondContact O-CA 3.48Å; V226-I326 HydrophobicContact CB-CG2 3.91Å; V226-I326 HydrophobicContact CG2-CD1 3.68Å; V226-I326 HydrophobicContact CG2-CG2 3.71Å; F320-I326 HydrophobicContact CD1-CD1 4.5Å; F320-I326 HydrophobicContact CE1-CD1 4.44Å; I326-P328 HydrophobicContact CG2-CG 4.29Å; I326-P328 WeakPolarHBondContact O-CD 3.4Å; I326-P371 CarbonylContact O-C 3.52Å; I326-P371 VanDerWaalsContact O-CA 3.32Å; I326-P371 WeakPolarHBondContact O-CA 3.31Å; I326-M372 PolarHBondContact N-O 3.22Å; I326-M372 PolarHBondContact O-N 3.16Å; I326-F383 HydrophobicContact CB-CZ 3.98Å; I326-F383 HydrophobicContact CG1-CE1 3.75Å; I326-F383 HydrophobicContact CG1-CZ 3.58Å; I326-V387 HydrophobicContact CG2-CG1 4.06Å; I326-V387 HydrophobicContact CG2-CG2 4.24Å
327	H	98.2	Very high	93.8	Very high	12 Å²	12	26.4 Å²	26.4	6%	0.056	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	97.4	170.7	-64	-90.2	0	0	0	107.3	P219 Q220 I224 C225 V226	P219-H327 HydrophobicContact CB-CB 3.86Å; P219-H327 HydrophobicContact CG-CB 3.83Å; Q220-H327 PolarHBondContact N-NE2 3.41Å; I224-H327 PolarHBondContact O-N 3.36Å; C225-H327 WeakPolarHBondContact CA-O 3.31Å; V226-H327 PolarHBondContact N-O 3.22Å
328	P	98.4	Very high	93.7	Very high	1 Å²	1	21.9 Å²	21.9	1%	0.006	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	143.9	179.8	-8.1	23.6	0	0	0	110.4	V226 I326 M369 P370 M372 V387 I391	V226-P328 CarbonylContact O-C 3.5Å; V226-P328 WeakPolarHBondContact O-CA 3.22Å; I326-P328 HydrophobicContact CG2-CG 4.29Å; I326-P328 WeakPolarHBondContact O-CD 3.4Å; P328-M369 HydrophobicContact CB-CB 4.06Å; P328-M369 HydrophobicContact CB-CE 3.5Å; P328-M369 HydrophobicContact CB-SD 3.85Å; P328-M369 HydrophobicContact CG-CB 4.22Å; P328-M369 HydrophobicContact CG-CE 3.91Å; P328-M369 WeakPolarHBondContact O-CB 3.23Å; P328-M369 PolarHBondContact O-N 3.34Å; P328-P370 WeakPolarHBondContact CD-O 3.44Å; P328-M372 HydrophobicContact CG-CG 3.94Å; P328-M372 HydrophobicContact CG-SD 3.5Å; P328-M372 WeakPolarHBondContact CG-SD 3.42Å; P328-V387 HydrophobicContact CB-CG1 4.07Å; P328-V387 HydrophobicContact CG-CG1 4.15Å; P328-I391 HydrophobicContact CB-CD1 4Å; P328-I391 HydrophobicContact CB-CG1 3.82Å
329	V	98.7	Very high	93.8	Very high	0 Å²	0	21 Å²	21	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	124.9	178	-177.9	0	0	0	0	109.1	P219 C225 V226 A227 L238 I331 V366 W367 Y368	P219-V329 HydrophobicContact CG-CG2 4.13Å; C225-V329 VanDerWaalsContact SG-CG2 3.52Å; V226-V329 PolarHBondContact O-N 2.97Å; A227-V329 VanDerWaalsContact CA-O 3.26Å; A227-V329 WeakPolarHBondContact CA-O 3.23Å; A227-V329 HydrophobicContact CB-CB 4.17Å; A227-V329 WeakPolarHBondContact CB-O 3.45Å; L238-V329 HydrophobicContact CD2-CG1 3.85Å; V329-I331 HydrophobicContact CG1-CG1 4.36Å; V329-V366 HydrophobicContact CG1-CG1 3.63Å; V329-W367 WeakPolarHBondContact CA-O 3.29Å; V329-Y368 HydrophobicContact CG1-CD1 4.25Å; V329-Y368 HydrophobicContact CG1-CE1 4.31Å; V329-Y368 HydrophobicContact CG2-CD1 3.71Å; V329-Y368 HydrophobicContact CG2-CE1 4.12Å
330	A	98.6	Very high	94	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	129.1	172	0	0	0	0	0	109.8	V366 W367 I391 Q394	A330-V366 WeakPolarHBondContact O-CA 3.24Å; A330-W367 HydrophobicContact CB-CB 4.45Å; A330-W367 HydrophobicContact CB-CE3 4.32Å; A330-W367 PolarHBondContact N-O 2.8Å; A330-W367 PolarHBondContact O-N 2.96Å; A330-I391 HydrophobicContact CB-CG2 4.04Å; A330-Q394 HydrophobicContact CB-CB 4.17Å; A330-Q394 HydrophobicContact CB-CG 4.17Å
331	I	98.4	Very high	93.9	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	115.1	174.2	-52.3	175.7	0	0	0	108.1	A227 N228 D234 L238 N309 V329 Y333 C364 D365 V366	A227-I331 HydrophobicContact CB-CD1 4.24Å; N228-I331 PolarHBondContact ND2-O 3.08Å; N228-I331 PolarHBondContact OD1-N 3.23Å; D234-I331 HydrophobicContact CB-CD1 4.08Å; L238-I331 HydrophobicContact CD1-CD1 4.1Å; L238-I331 HydrophobicContact CD2-CD1 4.11Å; L238-I331 HydrophobicContact CD2-CG1 4.45Å; L238-I331 HydrophobicContact CG-CD1 4.06Å; N309-I331 PolarHBondContact ND2-O 3.29Å; V329-I331 HydrophobicContact CG1-CG1 4.36Å; I331-Y333 HydrophobicContact CG2-CD2 4.1Å; I331-Y333 HydrophobicContact CG2-CE2 3.66Å; I331-C364 HydrophobicContact CG2-CB 4.44Å; I331-D365 WeakPolarHBondContact CA-O 3.42Å; I331-V366 HydrophobicContact CG1-CG2 4.5Å
332	K	97.7	Very high	93.9	Very high	46 Å²	46	19.9 Å²	19.9	20%	0.2	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	118.5	171.7	-174.2	69.9	-172.7	176.6	0	109.5	N309 C364 D365 W367 G395 L397	N309-K332 PolarHBondContact O-NZ 2.89Å; N309-K332 WeakPolarHBondContact OD1-CA 3.3Å; N309-K332 WeakPolarHBondContact OD1-CD 3.4Å; K332-C364 CarbonylContact O-C 3.51Å; K332-C364 WeakPolarHBondContact O-CA 3.39Å; K332-C364 WeakPolarHBondContact O-CB 3.47Å; K332-D365 PolarHBondContact N-O 3.02Å; K332-D365 PolarHBondContact O-N 3.09Å; K332-W367 HydrophobicContact CB-CH2 4.12Å; K332-W367 HydrophobicContact CB-CZ3 3.62Å; K332-G395 WeakPolarHBondContact CD-O 3.21Å; K332-L397 HydrophobicContact CD-CD2 3.66Å
333	Y	96.3	Very high	93.8	Very high	10 Å²	10	20.7 Å²	20.7	4%	0.039	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	145.6	171.5	-72	-87.6	0	0	0	110.3	T230 I233 D234 I237 N309 I331 P335 A340 I362 C364	T230-Y333 HydrophobicContact CG2-CD2 3.95Å; T230-Y333 HydrophobicContact CG2-CE2 3.96Å; I233-Y333 HydrophobicContact CD1-CE1 4.18Å; I233-Y333 WeakPolarHBondContact CG1-OH 3.2Å; D234-Y333 WeakPolarHBondContact OD1-CE2 3.41Å; D234-Y333 PolarHBondContact OD1-OH 2.9Å; I237-Y333 HydrophobicContact CD1-CE1 3.52Å; I237-Y333 WeakPolarHBondContact CD1-OH 3.25Å; N309-Y333 HydrophobicContact CB-CD2 4.41Å; N309-Y333 PolarHBondContact OD1-N 3.22Å; I331-Y333 HydrophobicContact CG2-CD2 4.1Å; I331-Y333 HydrophobicContact CG2-CE2 3.66Å; Y333-P335 WeakPolarHBondContact O-CD 3.38Å; Y333-A340 HydrophobicContact CD1-CB 3.45Å; Y333-A340 VanDerWaalsContact CD1-CB 3.45Å; Y333-A340 HydrophobicContact CD2-CB 4.13Å; Y333-A340 HydrophobicContact CE1-CB 3.57Å; Y333-A340 HydrophobicContact CE2-CB 4.25Å; Y333-A340 HydrophobicContact CG-CB 3.72Å; Y333-I362 HydrophobicContact CD1-CG2 3.91Å; Y333-I362 HydrophobicContact CE1-CG2 3.67Å; Y333-C364 HydrophobicContact CD1-CB 3.68Å; Y333-C364 HydrophobicContact CE1-CB 4.02Å; Y333-C364 HydrophobicContact CG-CB 4.09Å
334	N	92.8	Very high	93.7	Very high	55 Å²	55	21.2 Å²	21.2	29%	0.294	12%	0.121	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	102.4	168.1	-173.3	-20.3	0	0	0	109.4	Q336 F337 V363	N334-Q336 PolarHBondContact O-N 3.46Å; N334-Q336 VanDerWaalsContact O-N 3.14Å; N334-Q336 WeakPolarHBondContact OD1-CB 3.36Å; N334-Q336 PolarHBondContact OD1-N 3.3Å; N334-F337 HydrophobicContact CB-CD2 4.14Å; N334-F337 HydrophobicContact CB-CE2 4.34Å; N334-F337 WeakPolarHBondContact ND2-CE2 2.96Å; N334-F337 PolarHBondContact O-N 3.06Å; N334-V363 HydrophobicContact CB-CB 4.25Å; N334-V363 HydrophobicContact CB-CG1 4.48Å; N334-V363 PolarHBondContact N-O 3.17Å
335	P	90.2	Very high	93.4	Very high	25 Å²	25	23.4 Å²	23.4	16%	0.162	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-13.1	-176.9	30.5	-39	0	0	0	113.5	L121 Y333 F337 G338	L121-P335 HydrophobicContact CD1-CB 4.22Å; L121-P335 WeakPolarHBondContact CD1-O 3.48Å; L121-P335 HydrophobicContact CD2-CB 3.62Å; L121-P335 HydrophobicContact CD2-CG 3.36Å; L121-P335 HydrophobicContact CG-CB 4.36Å; Y333-P335 WeakPolarHBondContact O-CD 3.38Å; P335-F337 PolarHBondContact O-N 3.02Å; P335-F337 VanDerWaalsContact O-N 3.16Å; P335-G338 PolarHBondContact O-N 2.78Å
336	Q	87.3	Confident	92.9	Very high	45 Å²	45	28.1 Å²	28.1	21%	0.21	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-29.9	177.3	-169	-176.5	17.1	0	0	112.8	L46 N125 N334	L46-Q336 HydrophobicContact CD1-CG 4.06Å; N125-Q336 WeakPolarHBondContact CB-O 3.23Å; N334-Q336 PolarHBondContact O-N 3.46Å; N334-Q336 VanDerWaalsContact O-N 3.14Å; N334-Q336 WeakPolarHBondContact OD1-CB 3.36Å; N334-Q336 PolarHBondContact OD1-N 3.3Å
337	F	89.9	Confident	92.4	Very high	9 Å²	9	30.1 Å²	30.1	4%	0.039	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-24	-178.1	-56.6	-74.6	0	0	0	113.7	M39 L42 V43 L46 N334 P335 W360 A361 V363	M39-F337 HydrophobicContact CE-CD1 3.59Å; M39-F337 HydrophobicContact CE-CD2 4.25Å; M39-F337 HydrophobicContact CE-CE1 3.36Å; M39-F337 HydrophobicContact CE-CE2 4.04Å; M39-F337 HydrophobicContact CE-CG 4Å; M39-F337 HydrophobicContact CE-CZ 3.59Å; L42-F337 HydrophobicContact CD2-CD1 3.56Å; L42-F337 HydrophobicContact CD2-CE1 4.01Å; L42-F337 HydrophobicContact CG-CD1 4.12Å; L42-F337 HydrophobicContact CG-CE1 4.23Å; V43-F337 HydrophobicContact CG2-CE1 3.65Å; V43-F337 HydrophobicContact CG2-CZ 3.55Å; L46-F337 HydrophobicContact CD1-CD1 4.14Å; L46-F337 HydrophobicContact CD1-CE1 4.25Å; N334-F337 HydrophobicContact CB-CD2 4.14Å; N334-F337 HydrophobicContact CB-CE2 4.34Å; N334-F337 WeakPolarHBondContact ND2-CE2 2.96Å; N334-F337 PolarHBondContact O-N 3.06Å; P335-F337 PolarHBondContact O-N 3.02Å; P335-F337 VanDerWaalsContact O-N 3.16Å; F337-W360 WeakPolarHBondContact O-CB 3.43Å; F337-W360 PolarHBondContact O-N 3.46Å; F337-A361 CarbonylContact C-O 3.21Å; F337-A361 HydrophobicContact CB-CB 4.07Å; F337-A361 VanDerWaalsContact CB-O 3.28Å; F337-A361 WeakPolarHBondContact CB-O 3.36Å; F337-A361 PolarHBondContact O-N 3.06Å; F337-V363 HydrophobicContact CB-CG2 4.13Å; F337-V363 HydrophobicContact CD2-CB 3.66Å; F337-V363 HydrophobicContact CD2-CG1 4.43Å; F337-V363 HydrophobicContact CD2-CG2 3.34Å; F337-V363 HydrophobicContact CE2-CB 4.06Å; F337-V363 HydrophobicContact CE2-CG1 4.34Å; F337-V363 HydrophobicContact CE2-CG2 3.77Å; F337-V363 HydrophobicContact CG-CB 4.48Å; F337-V363 HydrophobicContact CG-CG2 3.75Å
338	G	89.9	Confident	92	Very high	3 Å²	3	34.7 Å²	34.7	3%	0.031	18%	0.179	C	C	.	.			trans	175.1	138.9	-174.5	0	0	0	0	0	111.5	P335 A340 A361	P335-G338 PolarHBondContact O-N 2.78Å; G338-A340 PolarHBondContact O-N 3.34Å; G338-A361 PolarHBondContact N-O 3.36Å
339	D	90.3	Very high	91.5	Very high	11 Å²	11	37.9 Å²	37.9	6%	0.059	19%	0.194	C	C	.	.			trans	-81	107.5	174.7	171.4	22.2	0	0	0	110	S118 T130 F341 R355	S118-D339 VanDerWaalsContact CB-OD2 3.28Å; S118-D339 WeakPolarHBondContact CB-OD2 3.25Å; S118-D339 PolarHBondContact OG-OD2 2.81Å; T130-D339 HydrophobicContact CG2-CB 4.07Å; D339-F341 VanDerWaalsContact C-N 3.33Å; D339-F341 VanDerWaalsContact OD1-CB 3.28Å; D339-F341 WeakPolarHBondContact OD1-CB 3.05Å; D339-F341 PolarHBondContact OD1-N 3.27Å; D339-R355 IonicContact OD2-CZ 3.08Å; D339-R355 IonicContact OD2-NE 2.68Å; D339-R355 IonicContact OD2-NH2 2.79Å; D339-R355 PolarHBondContact OD2-NH2 3.04Å
340	A	93.7	Very high	91.1	Very high	4 Å²	4	42.7 Å²	42.7	3%	0.033	22%	0.223	C	C	.	.			trans	-77.9	-17	180	0	0	0	0	0	113.4	T230 S231 I233 Y333 G338 W342 Y352 M356	T230-A340 HydrophobicContact CG2-CB 4.2Å; S231-A340 VanDerWaalsContact CB-O 3.26Å; S231-A340 WeakPolarHBondContact CB-O 3.28Å; I233-A340 HydrophobicContact CD1-CB 4.19Å; Y333-A340 HydrophobicContact CD1-CB 3.45Å; Y333-A340 VanDerWaalsContact CD1-CB 3.45Å; Y333-A340 HydrophobicContact CD2-CB 4.13Å; Y333-A340 HydrophobicContact CE1-CB 3.57Å; Y333-A340 HydrophobicContact CE2-CB 4.25Å; Y333-A340 HydrophobicContact CG-CB 3.72Å; G338-A340 PolarHBondContact O-N 3.34Å; A340-W342 PolarHBondContact O-N 3.28Å; A340-Y352 PolarHBondContact O-OH 3.08Å; A340-M356 HydrophobicContact CB-CE 4.33Å
341	F	93.3	Very high	90.7	Very high	4 Å²	4	44.5 Å²	44.5	2%	0.018	24%	0.236	C	C	.	.			trans	-64.2	128.9	-171.1	171.5	-127.5	0	0	0	112.8	F116 T230 C306 I307 N308 D339 N343 Y352	F116-F341 VanDerWaalsContact C-CE1 3.44Å; F116-F341 HydrophobicContact CB-CZ 4.47Å; F116-F341 VanDerWaalsContact O-CE1 3.27Å; F116-F341 WeakPolarHBondContact O-CE1 3.49Å; F116-F341 WeakPolarHBondContact O-CZ 3.23Å; T230-F341 HydrophobicContact CG2-CB 4.27Å; C306-F341 HydrophobicContact CB-CE2 4.42Å; I307-F341 WeakPolarHBondContact O-CD2 3.39Å; N308-F341 HydrophobicContact CB-CB 4.3Å; N308-F341 HydrophobicContact CB-CD1 3.92Å; N308-F341 HydrophobicContact CB-CD2 4.19Å; N308-F341 HydrophobicContact CB-CE1 4.31Å; N308-F341 HydrophobicContact CB-CG 3.86Å; D339-F341 VanDerWaalsContact C-N 3.33Å; D339-F341 VanDerWaalsContact OD1-CB 3.28Å; D339-F341 WeakPolarHBondContact OD1-CB 3.05Å; D339-F341 PolarHBondContact OD1-N 3.27Å; F341-N343 HydrophobicContact CD1-CB 4.31Å; F341-N343 HydrophobicContact CE1-CB 3.69Å; F341-N343 HydrophobicContact CZ-CB 4.08Å; F341-N343 PolarHBondContact O-N 2.71Å; F341-Y352 WeakPolarHBondContact O-CE2 3.33Å
342	W	92.4	Very high	90.4	Very high	65 Å²	65	44.6 Å²	44.6	25%	0.246	24%	0.237	C	C	.	.			trans	-92.5	96.6	174.4	178.7	43.4	0	0	0	112.6	T230 P232 A340 S344 Y347 M349 Y352	T230-W342 PolarHBondContact O-N 3.19Å; P232-W342 HydrophobicContact CG-CD2 4.31Å; P232-W342 HydrophobicContact CG-CE3 3.75Å; P232-W342 HydrophobicContact CG-CZ3 4.05Å; A340-W342 PolarHBondContact O-N 3.28Å; W342-S344 PolarHBondContact O-N 2.8Å; W342-S344 VanDerWaalsContact O-N 3.15Å; W342-Y347 PolarHBondContact NE1-O 3.27Å; W342-M349 HydrophobicContact CZ2-CE 4.23Å; W342-Y352 HydrophobicContact CB-CD2 4.14Å; W342-Y352 HydrophobicContact CB-CE1 4.39Å; W342-Y352 HydrophobicContact CB-CE2 3.86Å; W342-Y352 AromaticContact CD1-CD2 3.74Å; W342-Y352 AromaticContact CD1-CG 3.59Å; W342-Y352 HydrophobicContact CG-CD1 4.43Å; W342-Y352 HydrophobicContact CG-CD2 4.28Å; W342-Y352 HydrophobicContact CG-CE2 4.45Å; W342-Y352 HydrophobicContact CG-CG 4.28Å
343	N	89.3	Confident	90.2	Very high	20 Å²	20	45.5 Å²	45.5	11%	0.107	24%	0.243	C	C	.	.			trans	-81.5	89.6	169.1	-168.6	-23	0	0	0	111.6	F116 F341 S345 K346 Y347	F116-N343 PolarHBondContact O-ND2 3.02Å; F116-N343 VanDerWaalsContact O-ND2 3.11Å; F341-N343 HydrophobicContact CD1-CB 4.31Å; F341-N343 HydrophobicContact CE1-CB 3.69Å; F341-N343 HydrophobicContact CZ-CB 4.08Å; F341-N343 PolarHBondContact O-N 2.71Å; N343-S345 PolarHBondContact O-N 3.12Å; N343-S345 VanDerWaalsContact O-N 3.16Å; N343-S345 WeakPolarHBondContact OD1-CB 3.26Å; N343-S345 PolarHBondContact OD1-N 3.4Å; N343-K346 HydrophobicContact CB-CB 4.29Å; N343-K346 PolarHBondContact O-N 3.27Å; N343-K346 VanDerWaalsContact O-N 3.08Å; N343-K346 PolarHBondContact OD1-N 3.03Å; N343-Y347 HydrophobicContact CB-CD2 4.18Å; N343-Y347 HydrophobicContact CB-CE2 4.49Å; N343-Y347 PolarHBondContact O-N 3.11Å
344	S	85.7	Confident	90	Very high	47 Å²	47	48.7 Å²	48.7	33%	0.329	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-20.6	177.4	56	0	0	0	0	115	W342 R408	W342-S344 PolarHBondContact O-N 2.8Å; W342-S344 VanDerWaalsContact O-N 3.15Å; S344-R408 PolarHBondContact OG-NH2 3.21Å
345	S	85.9	Confident	90	Very high	85 Å²	85	47 Å²	47	59%	0.594	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-24.6	176.6	-55.3	0	0	0	0	112.6	N343 K407	N343-S345 PolarHBondContact O-N 3.12Å; N343-S345 VanDerWaalsContact O-N 3.16Å; N343-S345 WeakPolarHBondContact OD1-CB 3.26Å; N343-S345 PolarHBondContact OD1-N 3.4Å; S345-K407 PolarHBondContact OG-NZ 3.39Å
346	K	85.4	Confident	90.1	Very high	146 Å²	146	45.8 Å²	45.8	64%	0.635	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.2	-31.8	-175.7	-171.1	171.6	179.7	173.2	0	113.1	N343	N343-K346 HydrophobicContact CB-CB 4.29Å; N343-K346 PolarHBondContact O-N 3.27Å; N343-K346 VanDerWaalsContact O-N 3.08Å; N343-K346 PolarHBondContact OD1-N 3.03Å
347	Y	87.3	Confident	90.4	Very high	45 Å²	45	44.7 Å²	44.7	18%	0.176	24%	0.238	C	C	.	.			trans	-129.2	128.1	-172	-54.2	-64.5	0	0	0	111.5	W342 N343 S351 R355	W342-Y347 PolarHBondContact NE1-O 3.27Å; N343-Y347 HydrophobicContact CB-CD2 4.18Å; N343-Y347 HydrophobicContact CB-CE2 4.49Å; N343-Y347 PolarHBondContact O-N 3.11Å; Y347-S351 WeakPolarHBondContact CB-OG 3.41Å; Y347-R355 PolarHBondContact OH-NH1 3.45Å
348	N	90.6	Very high	90.5	Very high	108 Å²	108	44.4 Å²	44.4	58%	0.578	24%	0.237	S	C	*	.			trans	-71.1	166.6	164.3	69.8	38.5	0	0	0	110.6	V350 S351 Y352	N348-V350 VanDerWaalsContact C-N 3.32Å; N348-V350 PolarHBondContact O-N 2.78Å; N348-V350 PolarHBondContact OD1-N 3.23Å; N348-S351 PolarHBondContact N-OG 3.34Å; N348-S351 PolarHBondContact O-N 2.89Å; N348-S351 PolarHBondContact O-OG 3.19Å; N348-S351 WeakPolarHBondContact OD1-CB 3.48Å; N348-S351 PolarHBondContact OD1-N 3.36Å; N348-S351 PolarHBondContact OD1-OG 2.96Å; N348-Y352 WeakPolarHBondContact O-CB 3.24Å; N348-Y352 PolarHBondContact O-N 3.01Å
349	M	87.3	Confident	90.7	Very high	67 Å²	67	44.3 Å²	44.3	33%	0.33	24%	0.235	S	C	.	.	H	α-helix	trans	-57.2	-41.6	-175.4	-172.6	57.8	72.9	0	0	113.2	P232 W342 Y352 L353	P232-M349 HydrophobicContact CG-CE 4.16Å; W342-M349 HydrophobicContact CZ2-CE 4.23Å; M349-Y352 PolarHBondContact O-N 3.37Å; M349-Y352 HydrophobicContact SD-CD1 4.14Å; M349-L353 HydrophobicContact CG-CD1 4.05Å; M349-L353 HydrophobicContact CG-CG 4.38Å; M349-L353 WeakPolarHBondContact O-CB 3.38Å; M349-L353 VanDerWaalsContact O-CG 3.26Å; M349-L353 WeakPolarHBondContact O-CG 3.48Å; M349-L353 PolarHBondContact O-N 3.2Å; M349-L353 HydrophobicContact SD-CD1 4.4Å; M349-L353 HydrophobicContact SD-CG 4.23Å
350	V	90.5	Very high	90.9	Very high	101 Å²	101	44.6 Å²	44.6	61%	0.612	24%	0.236	S	C	*	.	H	α-helix	trans	-66.9	-47.3	-178.5	179.1	0	0	0	0	110.8	N348 Y352 L353 L354	N348-V350 VanDerWaalsContact C-N 3.32Å; N348-V350 PolarHBondContact O-N 2.78Å; N348-V350 PolarHBondContact OD1-N 3.23Å; V350-Y352 VanDerWaalsContact C-N 3.29Å; V350-Y352 PolarHBondContact O-N 3.02Å; V350-L353 PolarHBondContact O-N 3.49Å; V350-L354 HydrophobicContact CG1-CD1 4.09Å; V350-L354 WeakPolarHBondContact O-CG 3.39Å; V350-L354 PolarHBondContact O-N 2.94Å
351	S	91.4	Very high	90.8	Very high	39 Å²	39	44.4 Å²	44.4	27%	0.273	23%	0.234	S	C	.	.	H	α-helix	trans	-62.5	-37.3	176.9	64.7	0	0	0	0	112.2	Y347 N348 R355	Y347-S351 WeakPolarHBondContact CB-OG 3.41Å; N348-S351 PolarHBondContact N-OG 3.34Å; N348-S351 PolarHBondContact O-N 2.89Å; N348-S351 PolarHBondContact O-OG 3.19Å; N348-S351 WeakPolarHBondContact OD1-CB 3.48Å; N348-S351 PolarHBondContact OD1-N 3.36Å; N348-S351 PolarHBondContact OD1-OG 2.96Å; S351-R355 VanDerWaalsContact O-CB 3.31Å; S351-R355 WeakPolarHBondContact O-CB 3.44Å; S351-R355 PolarHBondContact O-N 3.44Å
352	Y	92.2	Very high	90.9	Very high	1 Å²	1	44.5 Å²	44.5	0%	0.004	24%	0.235	C	C	.	.	H	α-helix	trans	-64.2	-49.5	173	171.5	-104.5	0	0	0	111.5	S231 I233 A340 F341 W342 N348 M349 V350 L354 R355 M356	S231-Y352 VanDerWaalsContact CB-OH 3.25Å; S231-Y352 WeakPolarHBondContact CB-OH 3.14Å; S231-Y352 PolarHBondContact OG-OH 2.84Å; I233-Y352 HydrophobicContact CG2-CE1 4.39Å; A340-Y352 PolarHBondContact O-OH 3.08Å; F341-Y352 WeakPolarHBondContact O-CE2 3.33Å; W342-Y352 HydrophobicContact CB-CD2 4.14Å; W342-Y352 HydrophobicContact CB-CE1 4.39Å; W342-Y352 HydrophobicContact CB-CE2 3.86Å; W342-Y352 AromaticContact CD1-CD2 3.74Å; W342-Y352 AromaticContact CD1-CG 3.59Å; W342-Y352 HydrophobicContact CG-CD1 4.43Å; W342-Y352 HydrophobicContact CG-CD2 4.28Å; W342-Y352 HydrophobicContact CG-CE2 4.45Å; W342-Y352 HydrophobicContact CG-CG 4.28Å; N348-Y352 WeakPolarHBondContact O-CB 3.24Å; N348-Y352 PolarHBondContact O-N 3.01Å; M349-Y352 PolarHBondContact O-N 3.37Å; M349-Y352 HydrophobicContact SD-CD1 4.14Å; V350-Y352 VanDerWaalsContact C-N 3.29Å; V350-Y352 PolarHBondContact O-N 3.02Å; Y352-L354 VanDerWaalsContact C-N 3.35Å; Y352-L354 PolarHBondContact O-N 3.46Å; Y352-R355 WeakPolarHBondContact O-CA 3.47Å; Y352-R355 WeakPolarHBondContact O-CB 3.48Å; Y352-R355 PolarHBondContact O-N 2.85Å; Y352-R355 VanDerWaalsContact O-N 3.08Å; Y352-M356 HydrophobicContact CD1-CG 4.38Å; Y352-M356 HydrophobicContact CD2-CG 4.25Å; Y352-M356 HydrophobicContact CE1-CG 3.87Å; Y352-M356 HydrophobicContact CE2-CG 3.73Å; Y352-M356 HydrophobicContact CE2-SD 3.87Å; Y352-M356 VanDerWaalsContact CZ-CG 3.48Å; Y352-M356 VanDerWaalsContact O-CG 3.3Å; Y352-M356 WeakPolarHBondContact O-CG 3.23Å; Y352-M356 PolarHBondContact O-N 2.64Å; Y352-M356 PolarHBondContact OH-SD 2.71Å
353	L	92.5	Very high	90.9	Very high	65 Å²	65	41.9 Å²	41.9	34%	0.34	23%	0.226	S	C	.	.	H	α-helix	trans	-61.4	-41.6	178.1	-71.5	173.8	0	0	0	112.1	M349 V350 R355 M356 M357	M349-L353 HydrophobicContact CG-CD1 4.05Å; M349-L353 HydrophobicContact CG-CG 4.38Å; M349-L353 WeakPolarHBondContact O-CB 3.38Å; M349-L353 VanDerWaalsContact O-CG 3.26Å; M349-L353 WeakPolarHBondContact O-CG 3.48Å; M349-L353 PolarHBondContact O-N 3.2Å; M349-L353 HydrophobicContact SD-CD1 4.4Å; M349-L353 HydrophobicContact SD-CG 4.23Å; V350-L353 PolarHBondContact O-N 3.49Å; L353-R355 VanDerWaalsContact C-N 3.32Å; L353-R355 PolarHBondContact O-N 3.38Å; L353-M356 WeakPolarHBondContact O-CB 3.4Å; L353-M356 PolarHBondContact O-N 3.44Å; L353-M357 WeakPolarHBondContact O-CB 3.11Å; L353-M357 VanDerWaalsContact O-CG 3.26Å; L353-M357 WeakPolarHBondContact O-CG 3.34Å; L353-M357 PolarHBondContact O-N 3.31Å
354	L	92.7	Very high	91.3	Very high	78 Å²	78	40.9 Å²	40.9	41%	0.408	22%	0.221	S	C	.	.	H	α-helix	trans	-63.7	-38.4	173.7	-71.2	171.7	0	0	0	111.6	L157 V350 Y352 M356 M357 T358	L157-L354 HydrophobicContact CD1-CD2 4.01Å; V350-L354 HydrophobicContact CG1-CD1 4.09Å; V350-L354 WeakPolarHBondContact O-CG 3.39Å; V350-L354 PolarHBondContact O-N 2.94Å; Y352-L354 VanDerWaalsContact C-N 3.35Å; Y352-L354 PolarHBondContact O-N 3.46Å; L354-M356 VanDerWaalsContact C-N 3.34Å; L354-M357 PolarHBondContact O-N 3.06Å; L354-T358 WeakPolarHBondContact O-CB 3.22Å; L354-T358 VanDerWaalsContact O-CG2 3.26Å; L354-T358 WeakPolarHBondContact O-CG2 3.49Å; L354-T358 PolarHBondContact O-N 3.05Å; L354-T358 PolarHBondContact O-OG1 3.09Å
355	R	91.7	Very high	91.9	Very high	18 Å²	18	40.6 Å²	40.6	7%	0.068	22%	0.215	C	C	.	.	H	α-helix	trans	-59.9	-46.6	173.6	171.5	165.8	178.8	119.5	-0.7	110.2	R129 D339 Y347 S351 Y352 L353 T358 S359	R129-R355 VanDerWaalsContact CG-NH1 3.35Å; R129-R355 PolarHBondContact NH1-O 3.03Å; R129-R355 PolarHBondContact NH2-O 2.88Å; D339-R355 IonicContact OD2-CZ 3.08Å; D339-R355 IonicContact OD2-NE 2.68Å; D339-R355 IonicContact OD2-NH2 2.79Å; D339-R355 PolarHBondContact OD2-NH2 3.04Å; Y347-R355 PolarHBondContact OH-NH1 3.45Å; S351-R355 VanDerWaalsContact O-CB 3.31Å; S351-R355 WeakPolarHBondContact O-CB 3.44Å; S351-R355 PolarHBondContact O-N 3.44Å; Y352-R355 WeakPolarHBondContact O-CA 3.47Å; Y352-R355 WeakPolarHBondContact O-CB 3.48Å; Y352-R355 PolarHBondContact O-N 2.85Å; Y352-R355 VanDerWaalsContact O-N 3.08Å; L353-R355 VanDerWaalsContact C-N 3.32Å; L353-R355 PolarHBondContact O-N 3.38Å; R355-T358 CarbonylContact O-C 3.5Å; R355-T358 PolarHBondContact O-N 2.81Å; R355-T358 PolarHBondContact O-OG1 3.47Å; R355-T358 VanDerWaalsContact O-OG1 3.06Å; R355-S359 PolarHBondContact O-N 3.07Å; R355-S359 VanDerWaalsContact O-N 3.09Å; R355-S359 PolarHBondContact O-OG 3.42Å
356	M	92.9	Very high	92.5	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62.9	-48.1	176.4	-66	-61.4	-69	0	0	112.7	L206 I233 A340 Y352 L353 L354 T358 S359 I362	L206-M356 HydrophobicContact CD2-CB 4.06Å; I233-M356 HydrophobicContact CD1-CE 3.29Å; A340-M356 HydrophobicContact CB-CE 4.33Å; Y352-M356 HydrophobicContact CD1-CG 4.38Å; Y352-M356 HydrophobicContact CD2-CG 4.25Å; Y352-M356 HydrophobicContact CE1-CG 3.87Å; Y352-M356 HydrophobicContact CE2-CG 3.73Å; Y352-M356 HydrophobicContact CE2-SD 3.87Å; Y352-M356 VanDerWaalsContact CZ-CG 3.48Å; Y352-M356 VanDerWaalsContact O-CG 3.3Å; Y352-M356 WeakPolarHBondContact O-CG 3.23Å; Y352-M356 PolarHBondContact O-N 2.64Å; Y352-M356 PolarHBondContact OH-SD 2.71Å; L353-M356 WeakPolarHBondContact O-CB 3.4Å; L353-M356 PolarHBondContact O-N 3.44Å; L354-M356 VanDerWaalsContact C-N 3.34Å; M356-T358 PolarHBondContact O-N 2.75Å; M356-S359 VanDerWaalsContact O-CB 3.25Å; M356-S359 WeakPolarHBondContact O-CB 3.23Å; M356-S359 PolarHBondContact O-N 2.86Å; M356-S359 PolarHBondContact O-OG 2.94Å; M356-I362 HydrophobicContact CE-CD1 3.17Å; M356-I362 HydrophobicContact CE-CG1 3.5Å; M356-I362 HydrophobicContact CE-CG2 4.38Å; M356-I362 HydrophobicContact SD-CD1 3.98Å
357	M	93.4	Very high	93.1	Very high	22 Å²	22	31.9 Å²	31.9	11%	0.108	17%	0.165	C	C	.	.	H	α-helix	trans	-67.7	-14.1	178.5	-69.3	178.9	-176.6	0	0	113.4	L157 R160 V161 A164 L206 L353 L354	L157-M357 HydrophobicContact CD1-CB 3.79Å; R160-M357 HydrophobicContact CB-CB 4.36Å; R160-M357 HydrophobicContact CB-CG 4.31Å; R160-M357 WeakPolarHBondContact CD-O 3.07Å; R160-M357 VanDerWaalsContact NH1-C 3.29Å; R160-M357 PolarHBondContact NH1-O 3.04Å; V161-M357 HydrophobicContact CG2-SD 3.9Å; A164-M357 HydrophobicContact CB-CE 3.59Å; L206-M357 HydrophobicContact CD2-CG 3.91Å; L353-M357 WeakPolarHBondContact O-CB 3.11Å; L353-M357 VanDerWaalsContact O-CG 3.26Å; L353-M357 WeakPolarHBondContact O-CG 3.34Å; L353-M357 PolarHBondContact O-N 3.31Å; L354-M357 PolarHBondContact O-N 3.06Å
358	T	92.9	Very high	93.7	Very high	4 Å²	4	29.7 Å²	29.7	3%	0.025	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.6	4.3	173.4	56.5	0	0	0	0	113.2	R129 R152 Y153 L157 L354 R355 M356	R129-T358 PolarHBondContact NH1-OG1 2.88Å; R152-T358 VanDerWaalsContact CD-O 3.3Å; R152-T358 WeakPolarHBondContact CD-O 2.87Å; R152-T358 PolarHBondContact NH1-O 3.17Å; Y153-T358 HydrophobicContact CD1-CG2 4.12Å; Y153-T358 HydrophobicContact CE1-CG2 3.72Å; Y153-T358 HydrophobicContact CE2-CG2 4.49Å; L157-T358 HydrophobicContact CB-CG2 4.32Å; L157-T358 HydrophobicContact CD1-CG2 4.08Å; L157-T358 HydrophobicContact CD2-CG2 4.09Å; L157-T358 HydrophobicContact CG-CG2 4.4Å; L354-T358 WeakPolarHBondContact O-CB 3.22Å; L354-T358 VanDerWaalsContact O-CG2 3.26Å; L354-T358 WeakPolarHBondContact O-CG2 3.49Å; L354-T358 PolarHBondContact O-N 3.05Å; L354-T358 PolarHBondContact O-OG1 3.09Å; R355-T358 CarbonylContact O-C 3.5Å; R355-T358 PolarHBondContact O-N 2.81Å; R355-T358 PolarHBondContact O-OG1 3.47Å; R355-T358 VanDerWaalsContact O-OG1 3.06Å; M356-T358 PolarHBondContact O-N 2.75Å
359	S	93.5	Very high	94	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.132	C	C	.	.	S	Bend	trans	-66.8	166.4	164.6	-63.6	0	0	0	0	110.4	R129 R160 R355 M356	R129-S359 PolarHBondContact NH2-OG 3.23Å; R160-S359 PolarHBondContact NH1-O 3.36Å; R160-S359 PolarHBondContact NH2-O 2.88Å; R355-S359 PolarHBondContact O-N 3.07Å; R355-S359 VanDerWaalsContact O-N 3.09Å; R355-S359 PolarHBondContact O-OG 3.42Å; M356-S359 VanDerWaalsContact O-CB 3.25Å; M356-S359 WeakPolarHBondContact O-CB 3.23Å; M356-S359 PolarHBondContact O-N 2.86Å; M356-S359 PolarHBondContact O-OG 2.94Å
360	W	93.5	Very high	94.5	Very high	18 Å²	18	25.2 Å²	25.2	7%	0.068	14%	0.138	C	C	.	.	S	Bend	trans	-72.3	-48.4	173.8	-66.2	112.1	0	0	0	112.2	Y38 L42 N125 L126 V151 R152 R160 F337	Y38-W360 PolarHBondContact OH-O 3.34Å; L42-W360 HydrophobicContact CD1-CB 3.96Å; L42-W360 HydrophobicContact CD1-CD2 3.73Å; L42-W360 HydrophobicContact CD1-CE3 3.89Å; L42-W360 HydrophobicContact CD1-CG 3.8Å; L42-W360 HydrophobicContact CD1-CZ3 4.49Å; L42-W360 HydrophobicContact CD2-CB 3.56Å; L42-W360 HydrophobicContact CD2-CG 4.32Å; L42-W360 HydrophobicContact CG-CB 4.37Å; N125-W360 VanDerWaalsContact O-CD1 3.29Å; N125-W360 PolarHBondContact O-NE1 2.92Å; L126-W360 HydrophobicContact CB-CZ2 3.92Å; L126-W360 HydrophobicContact CD1-CZ2 3.85Å; V151-W360 HydrophobicContact CG1-CZ3 4.4Å; R152-W360 HydrophobicContact CG-CD2 4.35Å; R152-W360 HydrophobicContact CG-CE3 3.98Å; R152-W360 HydrophobicContact CG-CH2 4.31Å; R152-W360 HydrophobicContact CG-CZ3 3.96Å; R160-W360 PolarHBondContact NH2-O 3.21Å; F337-W360 WeakPolarHBondContact O-CB 3.43Å; F337-W360 PolarHBondContact O-N 3.46Å
361	A	93	Very high	94.9	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.13	C	C	.	.			trans	-159.2	165.3	174.6	0	0	0	0	0	108.8	Y38 M39 S207 F337 G338 V363	Y38-A361 HydrophobicContact CE1-CB 4.46Å; M39-A361 HydrophobicContact CE-CB 4.11Å; M39-A361 HydrophobicContact SD-CB 3.52Å; M39-A361 VanDerWaalsContact SD-CB 3.52Å; S207-A361 WeakPolarHBondContact O-CB 3.25Å; F337-A361 CarbonylContact C-O 3.21Å; F337-A361 HydrophobicContact CB-CB 4.07Å; F337-A361 VanDerWaalsContact CB-O 3.28Å; F337-A361 WeakPolarHBondContact CB-O 3.36Å; F337-A361 PolarHBondContact O-N 3.06Å; G338-A361 PolarHBondContact N-O 3.36Å; A361-V363 HydrophobicContact CB-CG2 4.09Å
362	I	94	Very high	95.2	Very high	6 Å²	6	23.1 Å²	23.1	3%	0.031	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	105.7	169.2	-56.4	-56.8	0	0	0	106.7	L206 G208 T209 I233 Y333 M356	L206-I362 HydrophobicContact CB-CG1 4.04Å; L206-I362 PolarHBondContact O-N 3.14Å; G208-I362 CarbonylContact C-O 3.48Å; G208-I362 WeakPolarHBondContact CA-O 3.46Å; T209-I362 PolarHBondContact N-O 3Å; I233-I362 HydrophobicContact CD1-CG2 4.2Å; Y333-I362 HydrophobicContact CD1-CG2 3.91Å; Y333-I362 HydrophobicContact CE1-CG2 3.67Å; M356-I362 HydrophobicContact CE-CD1 3.17Å; M356-I362 HydrophobicContact CE-CG1 3.5Å; M356-I362 HydrophobicContact CE-CG2 4.38Å; M356-I362 HydrophobicContact SD-CD1 3.98Å
363	V	94.3	Very high	95.4	Very high	9 Å²	9	26.9 Å²	26.9	6%	0.055	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	132.6	-177.7	-174.9	0	0	0	0	108.3	M39 T209 N334 F337 A361	M39-V363 HydrophobicContact CE-CG2 3.45Å; M39-V363 VanDerWaalsContact CE-CG2 3.45Å; M39-V363 HydrophobicContact SD-CG2 4.37Å; T209-V363 WeakPolarHBondContact O-CA 3.48Å; N334-V363 HydrophobicContact CB-CB 4.25Å; N334-V363 HydrophobicContact CB-CG1 4.48Å; N334-V363 PolarHBondContact N-O 3.17Å; F337-V363 HydrophobicContact CB-CG2 4.13Å; F337-V363 HydrophobicContact CD2-CB 3.66Å; F337-V363 HydrophobicContact CD2-CG1 4.43Å; F337-V363 HydrophobicContact CD2-CG2 3.34Å; F337-V363 HydrophobicContact CE2-CB 4.06Å; F337-V363 HydrophobicContact CE2-CG1 4.34Å; F337-V363 HydrophobicContact CE2-CG2 3.77Å; F337-V363 HydrophobicContact CG-CB 4.48Å; F337-V363 HydrophobicContact CG-CG2 3.75Å; A361-V363 HydrophobicContact CB-CG2 4.09Å
364	C	96.6	Very high	95.6	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	155.4	176.3	59.5	0	0	0	0	112.5	T209 I210 H211 I331 K332 Y333	T209-C364 PolarHBondContact O-N 2.93Å; T209-C364 VanDerWaalsContact O-N 3.09Å; I210-C364 WeakPolarHBondContact CA-O 3.4Å; H211-C364 PolarHBondContact N-O 2.73Å; I331-C364 HydrophobicContact CG2-CB 4.44Å; K332-C364 CarbonylContact O-C 3.51Å; K332-C364 WeakPolarHBondContact O-CA 3.39Å; K332-C364 WeakPolarHBondContact O-CB 3.47Å; Y333-C364 HydrophobicContact CD1-CB 3.68Å; Y333-C364 HydrophobicContact CE1-CB 4.02Å; Y333-C364 HydrophobicContact CG-CB 4.09Å
365	D	97.9	Very high	95.7	Very high	41 Å²	41	32.4 Å²	32.4	22%	0.219	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	135.6	170.6	-68.8	-88.7	0	0	0	109	H211 H213 I331 K332 W367	H211-D365 VanDerWaalsContact CB-OD1 3.3Å; H211-D365 WeakPolarHBondContact CB-OD1 3.4Å; H211-D365 IonicContact CG-OD1 2.76Å; H211-D365 CarbonylContact O-C 3.5Å; H211-D365 WeakPolarHBondContact O-CA 3.34Å; H213-D365 IonicContact CD2-OD1 3.09Å; H213-D365 IonicContact CE1-OD1 2.8Å; H213-D365 IonicContact NE2-OD1 3.39Å; H213-D365 PolarHBondContact NE2-OD1 2.69Å; I331-D365 WeakPolarHBondContact CA-O 3.42Å; K332-D365 PolarHBondContact N-O 3.02Å; K332-D365 PolarHBondContact O-N 3.09Å; D365-W367 HydrophobicContact CB-CD2 4.44Å; D365-W367 HydrophobicContact CB-CE3 3.95Å; D365-W367 HydrophobicContact CB-CH2 3.08Å; D365-W367 HydrophobicContact CB-CZ2 3.61Å; D365-W367 HydrophobicContact CB-CZ3 3.26Å
366	V	98.6	Very high	95.8	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	110.6	179.4	177.7	0	0	0	0	107.8	I210 H211 Y212 H213 I237 L238 V329 A330 I331 Y368	I210-V366 HydrophobicContact CG2-CB 4.42Å; I210-V366 HydrophobicContact CG2-CG2 3.67Å; H211-V366 PolarHBondContact O-N 2.93Å; Y212-V366 WeakPolarHBondContact CA-O 3.31Å; Y212-V366 HydrophobicContact CD1-CB 3.77Å; Y212-V366 HydrophobicContact CD1-CG1 3.93Å; Y212-V366 HydrophobicContact CD1-CG2 4.36Å; Y212-V366 HydrophobicContact CE1-CB 4.03Å; Y212-V366 HydrophobicContact CE1-CG1 4.11Å; Y212-V366 HydrophobicContact CE1-CG2 4.15Å; H213-V366 PolarHBondContact N-O 3.08Å; I237-V366 HydrophobicContact CG2-CG2 3.93Å; L238-V366 HydrophobicContact CD2-CG1 3.77Å; V329-V366 HydrophobicContact CG1-CG1 3.63Å; A330-V366 WeakPolarHBondContact O-CA 3.24Å; I331-V366 HydrophobicContact CG1-CG2 4.5Å; V366-Y368 HydrophobicContact CG1-CE1 4.13Å; V366-Y368 HydrophobicContact CG1-CE2 4.44Å
367	W	98.7	Very high	95.8	Very high	47 Å²	47	44.9 Å²	44.9	18%	0.178	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	118.5	174.8	-65.9	-96.2	0	0	0	110.4	H213 V329 A330 K332 D365 Q394	H213-W367 HydrophobicContact CB-CB 4.45Å; H213-W367 HydrophobicContact CB-CG 3.88Å; H213-W367 AromaticContact CD2-CD1 3.76Å; H213-W367 AromaticContact CD2-CD2 3.86Å; H213-W367 AromaticContact CD2-CE2 3.46Å; H213-W367 VanDerWaalsContact CD2-CE2 3.46Å; H213-W367 AromaticContact CD2-CZ2 3.97Å; H213-W367 AromaticContact CD2-NE1 3.35Å; H213-W367 PolarHBondContact CD2-NE1 3.16Å; H213-W367 VanDerWaalsContact CD2-NE1 3.35Å; H213-W367 AromaticContact CG-CD1 3.59Å; H213-W367 AromaticContact CG-CE2 3.99Å; H213-W367 AromaticContact CG-NE1 3.37Å; H213-W367 AromaticContact NE2-CE2 3.93Å; H213-W367 AromaticContact NE2-CZ2 4Å; H213-W367 AromaticContact NE2-NE1 3.95Å; V329-W367 WeakPolarHBondContact CA-O 3.29Å; A330-W367 HydrophobicContact CB-CB 4.45Å; A330-W367 HydrophobicContact CB-CE3 4.32Å; A330-W367 PolarHBondContact N-O 2.8Å; A330-W367 PolarHBondContact O-N 2.96Å; K332-W367 HydrophobicContact CB-CH2 4.12Å; K332-W367 HydrophobicContact CB-CZ3 3.62Å; D365-W367 HydrophobicContact CB-CD2 4.44Å; D365-W367 HydrophobicContact CB-CE3 3.95Å; D365-W367 HydrophobicContact CB-CH2 3.08Å; D365-W367 HydrophobicContact CB-CZ2 3.61Å; D365-W367 HydrophobicContact CB-CZ3 3.26Å; W367-Q394 HydrophobicContact CB-CG 3.58Å; W367-Q394 HydrophobicContact CD2-CG 4.38Å; W367-Q394 HydrophobicContact CG-CG 3.82Å
368	Y	98.7	Very high	95.9	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	131.8	165.7	-58.2	-66.3	0	0	0	109.5	Y212 H213 N214 R218 P219 D241 V329 V366	Y212-Y368 AromaticContact CD1-CE2 3.75Å; Y212-Y368 HydrophobicContact CD1-CE2 3.75Å; Y212-Y368 AromaticContact CD1-CZ 3.9Å; Y212-Y368 WeakPolarHBondContact CD1-OH 3.41Å; Y212-Y368 WeakPolarHBondContact CE1-OH 3.48Å; Y212-Y368 HydrophobicContact CG-CE2 4.46Å; H213-Y368 WeakPolarHBondContact O-CD2 3.44Å; H213-Y368 PolarHBondContact O-N 3.19Å; N214-Y368 WeakPolarHBondContact CB-O 3.36Å; N214-Y368 WeakPolarHBondContact O-CB 3.5Å; R218-Y368 HydrophobicContact CG-CD1 4.41Å; R218-Y368 HydrophobicContact CG-CD2 3.8Å; R218-Y368 HydrophobicContact CG-CE1 4.33Å; R218-Y368 HydrophobicContact CG-CE2 3.68Å; R218-Y368 HydrophobicContact CG-CG 4.17Å; P219-Y368 HydrophobicContact CG-CD1 4.42Å; D241-Y368 PolarHBondContact OD2-OH 3.37Å; V329-Y368 HydrophobicContact CG1-CD1 4.25Å; V329-Y368 HydrophobicContact CG1-CE1 4.31Å; V329-Y368 HydrophobicContact CG2-CD1 3.71Å; V329-Y368 HydrophobicContact CG2-CE1 4.12Å; V366-Y368 HydrophobicContact CG1-CE1 4.13Å; V366-Y368 HydrophobicContact CG1-CE2 4.44Å
369	M	98.4	Very high	96.1	Very high	12 Å²	12	48.4 Å²	48.4	6%	0.059	26%	0.261	C	S	.	.			trans	-110.9	156.1	-177.1	-65.7	160.9	45.3	0	0	111.4	Y217 P328 A390 I391 Q394	Y217-M369 WeakPolarHBondContact CB-O 3.37Å; P328-M369 HydrophobicContact CB-CB 4.06Å; P328-M369 HydrophobicContact CB-CE 3.5Å; P328-M369 HydrophobicContact CB-SD 3.85Å; P328-M369 HydrophobicContact CG-CB 4.22Å; P328-M369 HydrophobicContact CG-CE 3.91Å; P328-M369 WeakPolarHBondContact O-CB 3.23Å; P328-M369 PolarHBondContact O-N 3.34Å; M369-A390 VanDerWaalsContact CE-C 3.41Å; M369-A390 HydrophobicContact CE-CB 3.27Å; M369-I391 HydrophobicContact CE-CG1 4.25Å; M369-I391 HydrophobicContact SD-CG1 3.97Å; M369-Q394 HydrophobicContact CG-CB 4.47Å; M369-Q394 HydrophobicContact CG-CG 4.14Å; M369-Q394 HydrophobicContact SD-CB 3.92Å; M369-Q394 HydrophobicContact SD-CG 4.16Å
370	P	98.3	Very high	96.1	Very high	68 Å²	68	49 Å²	49	44%	0.442	27%	0.265	S	S	.	.			trans	-49.3	141.2	176.2	-27	33.7	0	0	0	112.3	Y217 P328 M372	Y217-P370 HydrophobicContact CD1-CB 4.49Å; Y217-P370 HydrophobicContact CD2-CG 4.08Å; Y217-P370 HydrophobicContact CE1-CB 4.33Å; Y217-P370 HydrophobicContact CE1-CG 4.25Å; Y217-P370 HydrophobicContact CE2-CG 3.75Å; Y217-P370 HydrophobicContact CG-CG 4.5Å; P328-P370 WeakPolarHBondContact CD-O 3.44Å; P370-M372 PolarHBondContact O-N 3.28Å
371	P	98	Very high	96.2	Very high	69 Å²	69	51.2 Å²	51.2	45%	0.448	28%	0.281	S	S	.	.			trans	-60.4	139.5	178.4	24.5	-32.6	0	0	0	110.9	T325 I326	T325-P371 HydrophobicContact CG2-CB 3.45Å; T325-P371 VanDerWaalsContact CG2-CB 3.45Å; I326-P371 CarbonylContact O-C 3.52Å; I326-P371 VanDerWaalsContact O-CA 3.32Å; I326-P371 WeakPolarHBondContact O-CA 3.31Å
372	M	97.9	Very high	96.4	Very high	27 Å²	27	56 Å²	56	13%	0.133	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-119.3	135.6	179.7	-59	176.4	70.7	0	0	109.6	I326 P328 P370 F383 R386 V387 A390	I326-M372 PolarHBondContact N-O 3.22Å; I326-M372 PolarHBondContact O-N 3.16Å; P328-M372 HydrophobicContact CG-CG 3.94Å; P328-M372 HydrophobicContact CG-SD 3.5Å; P328-M372 WeakPolarHBondContact CG-SD 3.42Å; P370-M372 PolarHBondContact O-N 3.28Å; M372-F383 HydrophobicContact CB-CE2 3.95Å; M372-F383 HydrophobicContact CB-CZ 4.35Å; M372-R386 HydrophobicContact CE-CB 4.42Å; M372-R386 HydrophobicContact CE-CG 3.74Å; M372-R386 VanDerWaalsContact CE-NH1 3.33Å; M372-V387 HydrophobicContact CB-CG2 4.42Å; M372-V387 HydrophobicContact CE-CG2 3.9Å; M372-V387 HydrophobicContact SD-CG2 3.83Å; M372-A390 HydrophobicContact SD-CB 4.38Å
373	T	96.4	Very high	96.6	Very high	80 Å²	80	55.9 Å²	55.9	49%	0.491	30%	0.303	S	S	.	.			trans	-117.3	159	167.8	52.1	0	0	0	0	108.9	T325 E375 R386	T325-T373 HydrophobicContact CG2-CG2 4.45Å; T373-E375 PolarHBondContact O-N 2.77Å; T373-R386 PolarHBondContact O-NH2 2.85Å
374	R	95.4	Very high	96.7	Very high	150 Å²	150	55.5 Å²	55.5	57%	0.566	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-62	131.4	174.2	-167.1	172.9	74.2	167.8	2.1	109.8	E378 F383	R374-E378 WeakPolarHBondContact CA-OE2 3.39Å; R374-E378 WeakPolarHBondContact CD-O 3.49Å; R374-E378 HydrophobicContact CG-CB 4Å; R374-E378 HydrophobicContact CG-CG 4.38Å; R374-E378 WeakPolarHBondContact CG-O 3.34Å; R374-F383 HydrophobicContact CB-CD1 3.96Å; R374-F383 HydrophobicContact CB-CE1 4.27Å; R374-F383 HydrophobicContact CB-CG 4.29Å; R374-F383 HydrophobicContact CG-CB 4.25Å; R374-F383 HydrophobicContact CG-CD1 4.3Å; R374-F383 HydrophobicContact CG-CG 4.36Å
375	E	95.2	Very high	96.7	Very high	109 Å²	109	58.3 Å²	58.3	51%	0.509	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-78	164.8	179.1	-70.4	170.7	-162.1	0	0	111.2	T373 G377 E378 R386	T373-E375 PolarHBondContact O-N 2.77Å; E375-G377 PolarHBondContact O-N 2.79Å; E375-E378 HydrophobicContact CB-CB 4.02Å; E375-E378 PolarHBondContact N-OE2 3.39Å; E375-E378 WeakPolarHBondContact O-CB 3.46Å; E375-E378 PolarHBondContact O-N 2.85Å; E375-R386 IonicContact OE1-CZ 3.74Å; E375-R386 IonicContact OE1-NE 2.71Å; E375-R386 PolarHBondContact OE1-NE 3.3Å; E375-R386 IonicContact OE1-NH1 3.39Å; E375-R386 PolarHBondContact OE1-NH1 3.3Å; E375-R386 IonicContact OE1-NH2 3.45Å
376	E	93.6	Very high	96.7	Very high	202 Å²	202	59.4 Å²	59.4	94%	0.944	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	129.1	177	-170.1	174.5	-177.1	0	0	110.3	E378	E376-E378 PolarHBondContact O-N 3.16Å
377	G	94.5	Very high	96.7	Very high	79 Å²	79	59.4 Å²	59.4	81%	0.814	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.4	-7.6	-175.4	0	0	0	0	0	115.4	E375	E375-G377 PolarHBondContact O-N 2.79Å
378	E	95.7	Very high	96.6	Very high	21 Å²	21	57.3 Å²	57.3	10%	0.098	31%	0.309	C	S	.	.			trans	-77.2	127.8	178.6	-168.3	-175.3	-145.1	0	0	111	R374 E375 E376 Q382 F383 R386	R374-E378 WeakPolarHBondContact CA-OE2 3.39Å; R374-E378 WeakPolarHBondContact CD-O 3.49Å; R374-E378 HydrophobicContact CG-CB 4Å; R374-E378 HydrophobicContact CG-CG 4.38Å; R374-E378 WeakPolarHBondContact CG-O 3.34Å; E375-E378 HydrophobicContact CB-CB 4.02Å; E375-E378 PolarHBondContact N-OE2 3.39Å; E375-E378 WeakPolarHBondContact O-CB 3.46Å; E375-E378 PolarHBondContact O-N 2.85Å; E376-E378 PolarHBondContact O-N 3.16Å; E378-Q382 HydrophobicContact CG-CB 3.57Å; E378-F383 VanDerWaalsContact CD-CA 3.49Å; E378-F383 HydrophobicContact CG-CB 4.16Å; E378-F383 VanDerWaalsContact OE1-CA 3.23Å; E378-F383 WeakPolarHBondContact OE1-CA 3.23Å; E378-F383 PolarHBondContact OE1-N 3.13Å; E378-R386 IonicContact OE1-CZ 3.58Å; E378-R386 IonicContact OE1-NE 2.66Å; E378-R386 PolarHBondContact OE1-NE 2.99Å; E378-R386 IonicContact OE1-NH2 3.98Å; E378-R386 PolarHBondContact OE1-NH2 2.8Å; E378-R386 IonicContact OE2-CZ 2.75Å; E378-R386 IonicContact OE2-NE 3.64Å; E378-R386 IonicContact OE2-NH2 3.73Å; E378-R386 PolarHBondContact OE2-NH2 3.04Å
379	D	95.6	Very high	96.6	Very high	78 Å²	78	58.7 Å²	58.7	42%	0.417	32%	0.318	S	S	.	.			trans	-82.1	173.7	172.4	79.6	25.3	0	0	0	112.5	V381 Q382 F383	D379-V381 VanDerWaalsContact C-N 3.27Å; D379-V381 PolarHBondContact O-N 2.81Å; D379-V381 WeakPolarHBondContact OD1-CA 3.14Å; D379-V381 WeakPolarHBondContact OD1-CB 3.44Å; D379-V381 PolarHBondContact OD1-N 3.37Å; D379-Q382 WeakPolarHBondContact OD1-CG 3.37Å; D379-Q382 PolarHBondContact OD1-N 2.94Å; D379-F383 WeakPolarHBondContact O-CB 3.42Å; D379-F383 PolarHBondContact O-N 3.36Å
380	A	94.5	Very high	96.6	Very high	12 Å²	12	59.4 Å²	59.4	10%	0.099	33%	0.326	C	S	.	.	H	α-helix	trans	-67.2	-25.5	-177.8	0	0	0	0	0	113.8	K317 F320 E321 A384	K317-A380 HydrophobicContact CB-CB 4.5Å; F320-A380 HydrophobicContact CB-CB 4.39Å; E321-A380 HydrophobicContact CG-CB 3.77Å; A380-A384 VanDerWaalsContact O-CB 3.25Å; A380-A384 WeakPolarHBondContact O-CB 3.37Å; A380-A384 PolarHBondContact O-N 3.47Å
381	V	95.3	Very high	96.6	Very high	66 Å²	66	56.2 Å²	56.2	40%	0.4	31%	0.305	S	S	.	.	H	α-helix	trans	-79	-44.5	179.6	178.4	0	0	0	0	109.9	K317 D379 F383 A384 N385	K317-V381 HydrophobicContact CB-CG2 3.94Å; K317-V381 HydrophobicContact CD-CG2 3.8Å; K317-V381 HydrophobicContact CG-CG2 4.5Å; D379-V381 VanDerWaalsContact C-N 3.27Å; D379-V381 PolarHBondContact O-N 2.81Å; D379-V381 WeakPolarHBondContact OD1-CA 3.14Å; D379-V381 WeakPolarHBondContact OD1-CB 3.44Å; D379-V381 PolarHBondContact OD1-N 3.37Å; V381-F383 VanDerWaalsContact C-N 3.33Å; V381-A384 PolarHBondContact O-N 2.78Å; V381-N385 WeakPolarHBondContact O-CB 3.27Å; V381-N385 PolarHBondContact O-N 2.94Å; V381-N385 PolarHBondContact O-ND2 3.22Å
382	Q	96.9	Very high	96.6	Very high	100 Å²	100	53 Å²	53	47%	0.467	29%	0.285	S	S	.	.	H	α-helix	trans	-58.8	-46.5	173.5	-68.8	172.8	-40.1	0	0	110.5	E378 D379 A384 N385 R386	E378-Q382 HydrophobicContact CG-CB 3.57Å; D379-Q382 WeakPolarHBondContact OD1-CG 3.37Å; D379-Q382 PolarHBondContact OD1-N 2.94Å; Q382-A384 PolarHBondContact O-N 2.97Å; Q382-N385 PolarHBondContact O-N 3.24Å; Q382-R386 PolarHBondContact O-N 3.47Å
383	F	97.6	Very high	96.6	Very high	4 Å²	4	58.3 Å²	58.3	2%	0.018	31%	0.312	C	S	.	.	H	α-helix	trans	-62.3	-44	176.2	-175.9	-149.5	0	0	0	112.6	F320 I326 M372 R374 E378 D379 V381 N385 R386 V387	F320-F383 HydrophobicContact CB-CD1 4.14Å; F320-F383 AromaticContact CD1-CD1 3.72Å; F320-F383 HydrophobicContact CD1-CD1 3.72Å; F320-F383 AromaticContact CD1-CE1 3.92Å; F320-F383 HydrophobicContact CD1-CE1 3.92Å; F320-F383 HydrophobicContact CD1-CG 4.15Å; F320-F383 HydrophobicContact CG-CD1 4.41Å; I326-F383 HydrophobicContact CB-CZ 3.98Å; I326-F383 HydrophobicContact CG1-CE1 3.75Å; I326-F383 HydrophobicContact CG1-CZ 3.58Å; M372-F383 HydrophobicContact CB-CE2 3.95Å; M372-F383 HydrophobicContact CB-CZ 4.35Å; R374-F383 HydrophobicContact CB-CD1 3.96Å; R374-F383 HydrophobicContact CB-CE1 4.27Å; R374-F383 HydrophobicContact CB-CG 4.29Å; R374-F383 HydrophobicContact CG-CB 4.25Å; R374-F383 HydrophobicContact CG-CD1 4.3Å; R374-F383 HydrophobicContact CG-CG 4.36Å; E378-F383 VanDerWaalsContact CD-CA 3.49Å; E378-F383 HydrophobicContact CG-CB 4.16Å; E378-F383 VanDerWaalsContact OE1-CA 3.23Å; E378-F383 WeakPolarHBondContact OE1-CA 3.23Å; E378-F383 PolarHBondContact OE1-N 3.13Å; D379-F383 WeakPolarHBondContact O-CB 3.42Å; D379-F383 PolarHBondContact O-N 3.36Å; V381-F383 VanDerWaalsContact C-N 3.33Å; F383-N385 VanDerWaalsContact C-N 3.31Å; F383-N385 PolarHBondContact O-N 3.43Å; F383-R386 PolarHBondContact O-N 3.32Å; F383-V387 HydrophobicContact CD2-CG2 3.81Å; F383-V387 HydrophobicContact CE2-CG2 3.45Å; F383-V387 VanDerWaalsContact CE2-CG2 3.45Å; F383-V387 HydrophobicContact CZ-CG2 4.11Å; F383-V387 WeakPolarHBondContact O-CG2 3.46Å; F383-V387 PolarHBondContact O-N 3.32Å
384	A	96.9	Very high	96.7	Very high	1 Å²	1	58 Å²	58	1%	0.008	31%	0.305	C	S	.	.	H	α-helix	trans	-59.1	-43.2	175.8	0	0	0	0	0	111.9	F315 F320 A380 V381 Q382 K388	F315-A384 HydrophobicContact CB-CB 4.18Å; F320-A384 HydrophobicContact CB-CB 4.43Å; F320-A384 HydrophobicContact CD1-CB 4.22Å; F320-A384 HydrophobicContact CD2-CB 3.41Å; F320-A384 VanDerWaalsContact CD2-CB 3.41Å; F320-A384 HydrophobicContact CE1-CB 4.38Å; F320-A384 HydrophobicContact CE2-CB 3.61Å; F320-A384 HydrophobicContact CG-CB 3.75Å; F320-A384 HydrophobicContact CZ-CB 4.11Å; A380-A384 VanDerWaalsContact O-CB 3.25Å; A380-A384 WeakPolarHBondContact O-CB 3.37Å; A380-A384 PolarHBondContact O-N 3.47Å; V381-A384 PolarHBondContact O-N 2.78Å; Q382-A384 PolarHBondContact O-N 2.97Å; A384-K388 VanDerWaalsContact O-CB 3.23Å; A384-K388 WeakPolarHBondContact O-CB 3.33Å; A384-K388 PolarHBondContact O-N 2.68Å
385	N	97.1	Very high	96.8	Very high	58 Å²	58	51.2 Å²	51.2	31%	0.31	28%	0.281	S	S	.	.	H	α-helix	trans	-65.4	-44.9	177.1	-75.7	-29.8	0	0	0	111.6	V381 Q382 F383 V387 K388 S389	V381-N385 WeakPolarHBondContact O-CB 3.27Å; V381-N385 PolarHBondContact O-N 2.94Å; V381-N385 PolarHBondContact O-ND2 3.22Å; Q382-N385 PolarHBondContact O-N 3.24Å; F383-N385 VanDerWaalsContact C-N 3.31Å; F383-N385 PolarHBondContact O-N 3.43Å; N385-V387 VanDerWaalsContact C-N 3.34Å; N385-V387 PolarHBondContact O-N 3.37Å; N385-K388 WeakPolarHBondContact O-CB 3.49Å; N385-K388 PolarHBondContact O-N 3.33Å; N385-S389 WeakPolarHBondContact O-CB 3.49Å; N385-S389 PolarHBondContact O-N 3.45Å; N385-S389 PolarHBondContact O-OG 3.01Å
386	R	97.6	Very high	96.8	Very high	64 Å²	64	49.1 Å²	49.1	24%	0.242	29%	0.289	C	S	.	.	H	α-helix	trans	-59.4	-43.5	177.8	-169.6	171.9	49	102.9	2.1	112.1	M372 T373 E375 E378 Q382 F383 A390	M372-R386 HydrophobicContact CE-CB 4.42Å; M372-R386 HydrophobicContact CE-CG 3.74Å; M372-R386 VanDerWaalsContact CE-NH1 3.33Å; T373-R386 PolarHBondContact O-NH2 2.85Å; E375-R386 IonicContact OE1-CZ 3.74Å; E375-R386 IonicContact OE1-NE 2.71Å; E375-R386 PolarHBondContact OE1-NE 3.3Å; E375-R386 IonicContact OE1-NH1 3.39Å; E375-R386 PolarHBondContact OE1-NH1 3.3Å; E375-R386 IonicContact OE1-NH2 3.45Å; E378-R386 IonicContact OE1-CZ 3.58Å; E378-R386 IonicContact OE1-NE 2.66Å; E378-R386 PolarHBondContact OE1-NE 2.99Å; E378-R386 IonicContact OE1-NH2 3.98Å; E378-R386 PolarHBondContact OE1-NH2 2.8Å; E378-R386 IonicContact OE2-CZ 2.75Å; E378-R386 IonicContact OE2-NE 3.64Å; E378-R386 IonicContact OE2-NH2 3.73Å; E378-R386 PolarHBondContact OE2-NH2 3.04Å; Q382-R386 PolarHBondContact O-N 3.47Å; F383-R386 PolarHBondContact O-N 3.32Å; R386-A390 WeakPolarHBondContact O-CB 3.13Å; R386-A390 PolarHBondContact O-N 3.33Å
387	V	98.1	Very high	96.9	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-66.9	-42.5	175.4	175.8	0	0	0	0	111.5	V226 F315 F320 I326 P328 M372 F383 N385 A390 I391	V226-V387 HydrophobicContact CB-CG1 4.43Å; V226-V387 HydrophobicContact CG1-CG1 3.98Å; F315-V387 HydrophobicContact CE2-CG1 4.24Å; F320-V387 HydrophobicContact CE1-CB 3.83Å; F320-V387 HydrophobicContact CE1-CG1 4.05Å; F320-V387 HydrophobicContact CE1-CG2 3.86Å; F320-V387 HydrophobicContact CZ-CB 4.26Å; F320-V387 HydrophobicContact CZ-CG1 4.27Å; I326-V387 HydrophobicContact CG2-CG1 4.06Å; I326-V387 HydrophobicContact CG2-CG2 4.24Å; P328-V387 HydrophobicContact CB-CG1 4.07Å; P328-V387 HydrophobicContact CG-CG1 4.15Å; M372-V387 HydrophobicContact CB-CG2 4.42Å; M372-V387 HydrophobicContact CE-CG2 3.9Å; M372-V387 HydrophobicContact SD-CG2 3.83Å; F383-V387 HydrophobicContact CD2-CG2 3.81Å; F383-V387 HydrophobicContact CE2-CG2 3.45Å; F383-V387 VanDerWaalsContact CE2-CG2 3.45Å; F383-V387 HydrophobicContact CZ-CG2 4.11Å; F383-V387 WeakPolarHBondContact O-CG2 3.46Å; F383-V387 PolarHBondContact O-N 3.32Å; N385-V387 VanDerWaalsContact C-N 3.34Å; N385-V387 PolarHBondContact O-N 3.37Å; V387-A390 PolarHBondContact O-N 3.47Å; V387-I391 HydrophobicContact CG1-CD1 4.15Å; V387-I391 WeakPolarHBondContact O-CG1 3.34Å; V387-I391 PolarHBondContact O-N 2.97Å
388	K	97.8	Very high	96.9	Very high	3 Å²	3	40.4 Å²	40.4	1%	0.013	23%	0.234	C	C	.	.	H	α-helix	trans	-58.5	-50.4	175.9	-174.6	-166.9	60.1	161.3	0	111.3	V312 M313 F315 A384 N385 A390 I391 A392 E399 L400	V312-K388 HydrophobicContact CB-CG 4.3Å; V312-K388 HydrophobicContact CG1-CD 4.36Å; V312-K388 HydrophobicContact CG1-CG 3.56Å; M313-K388 WeakPolarHBondContact O-CD 3.35Å; F315-K388 HydrophobicContact CB-CB 4.49Å; F315-K388 HydrophobicContact CD1-CB 4.25Å; F315-K388 HydrophobicContact CD1-CD 4.36Å; F315-K388 HydrophobicContact CD1-CG 3.94Å; F315-K388 HydrophobicContact CD2-CB 3.61Å; F315-K388 HydrophobicContact CD2-CG 4.21Å; F315-K388 HydrophobicContact CE1-CB 4.43Å; F315-K388 HydrophobicContact CE1-CG 4.04Å; F315-K388 HydrophobicContact CE2-CB 3.82Å; F315-K388 HydrophobicContact CE2-CG 4.3Å; F315-K388 HydrophobicContact CG-CB 3.86Å; F315-K388 HydrophobicContact CG-CD 4.48Å; F315-K388 HydrophobicContact CG-CG 4.05Å; F315-K388 HydrophobicContact CZ-CB 4.24Å; F315-K388 HydrophobicContact CZ-CG 4.23Å; A384-K388 VanDerWaalsContact O-CB 3.23Å; A384-K388 WeakPolarHBondContact O-CB 3.33Å; A384-K388 PolarHBondContact O-N 2.68Å; N385-K388 WeakPolarHBondContact O-CB 3.49Å; N385-K388 PolarHBondContact O-N 3.33Å; K388-A390 VanDerWaalsContact C-N 3.32Å; K388-A390 PolarHBondContact O-N 2.85Å; K388-I391 PolarHBondContact O-N 3.32Å; K388-A392 WeakPolarHBondContact O-CB 2.92Å; K388-A392 PolarHBondContact O-N 3.11Å; K388-E399 HydrophobicContact CD-CG 4.28Å; K388-E399 VanDerWaalsContact CE-CD 3.47Å; K388-E399 VanDerWaalsContact CE-CG 3.5Å; K388-E399 WeakPolarHBondContact CE-OE1 3.43Å; K388-E399 IonicContact NZ-OE1 3.95Å; K388-E399 PolarHBondContact NZ-OE1 3.28Å; K388-L400 PolarHBondContact NZ-O 3.31Å
389	S	98.1	Very high	96.8	Very high	29 Å²	29	43.3 Å²	43.3	20%	0.203	25%	0.247	C	C	.	.	H	α-helix	trans	-60.4	-42.2	178.7	-59	0	0	0	0	111.3	N385 I391 A392 I393 E399	N385-S389 WeakPolarHBondContact O-CB 3.49Å; N385-S389 PolarHBondContact O-N 3.45Å; N385-S389 PolarHBondContact O-OG 3.01Å; S389-I391 PolarHBondContact O-N 3.48Å; S389-A392 PolarHBondContact O-N 3.49Å; S389-I393 WeakPolarHBondContact O-CB 3.2Å; S389-I393 WeakPolarHBondContact O-CD1 3.5Å; S389-I393 WeakPolarHBondContact O-CG1 3.42Å; S389-I393 PolarHBondContact O-N 3.5Å; S389-E399 WeakPolarHBondContact CB-OE2 3.46Å; S389-E399 VanDerWaalsContact OG-CD 3.25Å; S389-E399 PolarHBondContact OG-OE1 3.44Å; S389-E399 PolarHBondContact OG-OE2 2.93Å
390	A	98.3	Very high	96.7	Very high	28 Å²	28	40 Å²	40	23%	0.231	23%	0.229	C	C	.	.	H	α-helix	trans	-63.2	-40.9	178.2	0	0	0	0	0	112.2	M369 M372 R386 V387 K388 Q394	M369-A390 VanDerWaalsContact CE-C 3.41Å; M369-A390 HydrophobicContact CE-CB 3.27Å; M372-A390 HydrophobicContact SD-CB 4.38Å; R386-A390 WeakPolarHBondContact O-CB 3.13Å; R386-A390 PolarHBondContact O-N 3.33Å; V387-A390 PolarHBondContact O-N 3.47Å; K388-A390 VanDerWaalsContact C-N 3.32Å; K388-A390 PolarHBondContact O-N 2.85Å; A390-Q394 VanDerWaalsContact O-CB 3.3Å; A390-Q394 WeakPolarHBondContact O-CB 3.35Å; A390-Q394 PolarHBondContact O-N 3.27Å
391	I	98.5	Very high	96.5	Very high	0 Å²	0	43 Å²	43	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-66.1	-43.7	173.8	-71.1	172.9	0	0	0	111.2	V226 N228 V312 F315 P328 A330 M369 V387 K388 S389 Q394 G395	V226-I391 HydrophobicContact CG1-CD1 3.99Å; V226-I391 WeakPolarHBondContact O-CD1 3.49Å; N228-I391 HydrophobicContact CB-CG2 4.06Å; V312-I391 HydrophobicContact CG2-CG2 4.28Å; F315-I391 HydrophobicContact CE2-CD1 3.94Å; F315-I391 HydrophobicContact CZ-CD1 3.94Å; P328-I391 HydrophobicContact CB-CD1 4Å; P328-I391 HydrophobicContact CB-CG1 3.82Å; A330-I391 HydrophobicContact CB-CG2 4.04Å; M369-I391 HydrophobicContact CE-CG1 4.25Å; M369-I391 HydrophobicContact SD-CG1 3.97Å; V387-I391 HydrophobicContact CG1-CD1 4.15Å; V387-I391 WeakPolarHBondContact O-CG1 3.34Å; V387-I391 PolarHBondContact O-N 2.97Å; K388-I391 PolarHBondContact O-N 3.32Å; S389-I391 PolarHBondContact O-N 3.48Å; I391-Q394 PolarHBondContact O-N 2.95Å; I391-G395 PolarHBondContact O-N 3.47Å
392	A	98	Very high	96.3	Very high	2 Å²	2	45 Å²	45	2%	0.017	25%	0.248	C	C	.	.	H	α-helix	trans	-62.4	-47.7	-179.4	0	0	0	0	0	111.5	V312 K388 S389 G395 G396 L397 E399	V312-A392 HydrophobicContact CB-CB 4.18Å; V312-A392 HydrophobicContact CG2-CB 3.83Å; K388-A392 WeakPolarHBondContact O-CB 2.92Å; K388-A392 PolarHBondContact O-N 3.11Å; S389-A392 PolarHBondContact O-N 3.49Å; A392-G395 PolarHBondContact O-N 3.4Å; A392-G396 PolarHBondContact O-N 2.82Å; A392-G396 VanDerWaalsContact O-N 3.08Å; A392-L397 PolarHBondContact O-N 2.82Å; A392-E399 HydrophobicContact CB-CB 4.21Å
393	I	98.2	Very high	96	Very high	138 Å²	138	42.4 Å²	42.4	71%	0.708	24%	0.238	S	C	*	.	H	α-helix	trans	-60.6	-50.6	176.8	-68.6	165.1	0	0	0	110.5	S389 G395 G396	S389-I393 WeakPolarHBondContact O-CB 3.2Å; S389-I393 WeakPolarHBondContact O-CD1 3.5Å; S389-I393 WeakPolarHBondContact O-CG1 3.42Å; S389-I393 PolarHBondContact O-N 3.5Å; I393-G395 VanDerWaalsContact C-N 3.32Å; I393-G395 PolarHBondContact O-N 2.9Å; I393-G396 PolarHBondContact O-N 2.76Å
394	Q	98.1	Very high	95.3	Very high	75 Å²	75	42.3 Å²	42.3	35%	0.35	24%	0.238	S	C	.	.	H	α-helix	trans	-63.7	-37.2	-177.4	-176	59.8	65.4	0	0	112.6	A330 W367 M369 A390 I391 G396	A330-Q394 HydrophobicContact CB-CB 4.17Å; A330-Q394 HydrophobicContact CB-CG 4.17Å; W367-Q394 HydrophobicContact CB-CG 3.58Å; W367-Q394 HydrophobicContact CD2-CG 4.38Å; W367-Q394 HydrophobicContact CG-CG 3.82Å; M369-Q394 HydrophobicContact CG-CB 4.47Å; M369-Q394 HydrophobicContact CG-CG 4.14Å; M369-Q394 HydrophobicContact SD-CB 3.92Å; M369-Q394 HydrophobicContact SD-CG 4.16Å; A390-Q394 VanDerWaalsContact O-CB 3.3Å; A390-Q394 WeakPolarHBondContact O-CB 3.35Å; A390-Q394 PolarHBondContact O-N 3.27Å; I391-Q394 PolarHBondContact O-N 2.95Å; Q394-G396 VanDerWaalsContact C-N 3.35Å
395	G	96.5	Very high	94.7	Very high	6 Å²	6	43.9 Å²	43.9	6%	0.062	26%	0.255	C	S	.	.	H	α-helix	trans	-82.7	-5.3	178.6	0	0	0	0	0	114.8	K332 I391 A392 I393 L397	K332-G395 WeakPolarHBondContact CD-O 3.21Å; I391-G395 PolarHBondContact O-N 3.47Å; A392-G395 PolarHBondContact O-N 3.4Å; I393-G395 VanDerWaalsContact C-N 3.32Å; I393-G395 PolarHBondContact O-N 2.9Å; G395-L397 VanDerWaalsContact C-N 3.3Å; G395-L397 PolarHBondContact O-N 3.39Å
396	G	96.4	Very high	94	Very high	65 Å²	65	45.2 Å²	45.2	67%	0.67	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.2	39.4	-171.6	0	0	0	0	0	112.6	A392 I393 Q394	A392-G396 PolarHBondContact O-N 2.82Å; A392-G396 VanDerWaalsContact O-N 3.08Å; I393-G396 PolarHBondContact O-N 2.76Å; Q394-G396 VanDerWaalsContact C-N 3.35Å
397	L	96	Very high	93.2	Very high	13 Å²	13	45.5 Å²	45.5	7%	0.068	26%	0.264	C	S	.	.			trans	-107.1	144.9	-176.9	-58	174.6	0	0	0	110.2	N309 V312 K332 A392 G395 E399	N309-L397 WeakPolarHBondContact O-CD2 3.46Å; V312-L397 HydrophobicContact CG2-CB 3.85Å; V312-L397 HydrophobicContact CG2-CD1 3.45Å; V312-L397 VanDerWaalsContact CG2-CD1 3.45Å; V312-L397 HydrophobicContact CG2-CG 4.28Å; K332-L397 HydrophobicContact CD-CD2 3.66Å; A392-L397 PolarHBondContact O-N 2.82Å; G395-L397 VanDerWaalsContact C-N 3.3Å; G395-L397 PolarHBondContact O-N 3.39Å; L397-E399 PolarHBondContact O-N 2.95Å
398	T	94.1	Very high	92.3	Very high	86 Å²	86	54 Å²	54	53%	0.528	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	128.7	173.2	-53.8	0	0	0	0	110.4	T310 S311 V312 L400	T310-T398 PolarHBondContact O-N 2.98Å; T310-T398 VanDerWaalsContact O-N 3.09Å; S311-T398 CarbonylContact C-O 3.45Å; S311-T398 WeakPolarHBondContact CA-O 3.48Å; S311-T398 WeakPolarHBondContact CB-O 3.45Å; V312-T398 PolarHBondContact N-O 2.86Å; T398-L400 HydrophobicContact CG2-CD2 4.23Å
399	E	93.4	Very high	91.4	Very high	82 Å²	82	56.7 Å²	56.7	38%	0.383	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	129.5	172.5	-172.2	-176.6	158.2	0	0	110.4	K388 S389 A392 L397	K388-E399 HydrophobicContact CD-CG 4.28Å; K388-E399 VanDerWaalsContact CE-CD 3.47Å; K388-E399 VanDerWaalsContact CE-CG 3.5Å; K388-E399 WeakPolarHBondContact CE-OE1 3.43Å; K388-E399 IonicContact NZ-OE1 3.95Å; K388-E399 PolarHBondContact NZ-OE1 3.28Å; S389-E399 WeakPolarHBondContact CB-OE2 3.46Å; S389-E399 VanDerWaalsContact OG-CD 3.25Å; S389-E399 PolarHBondContact OG-OE1 3.44Å; S389-E399 PolarHBondContact OG-OE2 2.93Å; A392-E399 HydrophobicContact CB-CB 4.21Å; L397-E399 PolarHBondContact O-N 2.95Å
400	L	93.1	Very high	90.6	Very high	7 Å²	7	63.6 Å²	63.6	4%	0.037	35%	0.345	C	S	.	.			trans	-117.9	142.3	174.5	-63.8	172.3	0	0	0	111.2	E111 R115 V312 M313 K388 T398 W402	E111-L400 HydrophobicContact CB-CD2 4.44Å; R115-L400 HydrophobicContact CG-CD1 3.68Å; V312-L400 PolarHBondContact O-N 3.24Å; M313-L400 HydrophobicContact SD-CB 4.06Å; M313-L400 HydrophobicContact SD-CD1 3.66Å; K388-L400 PolarHBondContact NZ-O 3.31Å; T398-L400 HydrophobicContact CG2-CD2 4.23Å; L400-W402 PolarHBondContact O-N 3.37Å
401	P	91.5	Very high	89.9	Confident	77 Å²	77	66.3 Å²	66.3	50%	0.5	36%	0.359	S	S	.	.			trans	-81.7	-3.4	175.3	34.6	-35.8	0	0	0	112.3	M314	M314-P401 WeakPolarHBondContact CE-O 3.38Å
402	W	91.1	Very high	89.3	Confident	106 Å²	106	73.1 Å²	73.1	40%	0.402	39%	0.388	S	S	.	.			trans	-85.2	139.9	-168.9	-55.8	117.3	0	0	0	113.1	E111 V112 M313 M314 L400 L406	E111-W402 PolarHBondContact OE2-NE1 3.25Å; V112-W402 HydrophobicContact CG2-CB 3.71Å; V112-W402 HydrophobicContact CG2-CD2 4.1Å; V112-W402 HydrophobicContact CG2-CG 3.55Å; M313-W402 HydrophobicContact CE-CB 3.84Å; M313-W402 WeakPolarHBondContact CE-O 3.29Å; M314-W402 WeakPolarHBondContact CB-O 3.33Å; M314-W402 PolarHBondContact N-O 3.2Å; L400-W402 PolarHBondContact O-N 3.37Å; W402-L406 HydrophobicContact CB-CD1 4.17Å; W402-L406 HydrophobicContact CE3-CD1 3.86Å
403	D	89.3	Confident	88.9	Confident	46 Å²	46	77.2 Å²	77.2	25%	0.246	41%	0.41	C	S	.	.			trans	-75.9	124	170.4	-176.9	-14.4	0	0	0	110	M314 K316 G405 L406	M314-D403 HydrophobicContact SD-CB 4.33Å; K316-D403 VanDerWaalsContact CE-OD1 3.29Å; K316-D403 WeakPolarHBondContact CE-OD1 3.47Å; K316-D403 IonicContact NZ-OD1 3.5Å; K316-D403 PolarHBondContact NZ-OD1 3.46Å; K316-D403 IonicContact NZ-OD2 3.55Å; K316-D403 PolarHBondContact NZ-OD2 3.33Å; D403-G405 PolarHBondContact O-N 3.12Å; D403-G405 PolarHBondContact OD1-N 3.19Å; D403-L406 HydrophobicContact CB-CG 4.3Å; D403-L406 VanDerWaalsContact O-CB 3.25Å; D403-L406 WeakPolarHBondContact O-CB 3.12Å; D403-L406 VanDerWaalsContact O-CG 3.28Å; D403-L406 WeakPolarHBondContact O-CG 3.06Å; D403-L406 PolarHBondContact O-N 3.49Å
404	G	84.1	Confident	88.6	Confident	3 Å²	3	76.2 Å²	76.2	3%	0.031	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-59.5	-19.4	176.8	0	0	0	0	0	114.2	F116 L406	F116-G404 VanDerWaalsContact CZ-O 3.3Å; F116-G404 WeakPolarHBondContact CZ-O 3.2Å; G404-L406 PolarHBondContact O-N 3.07Å
405	G	82.9	Confident	88	Confident	34 Å²	34	78 Å²	78	35%	0.351	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-65.5	-19.5	171.2	0	0	0	0	0	114.4	D403 K407 R408 A409	D403-G405 PolarHBondContact O-N 3.12Å; D403-G405 PolarHBondContact OD1-N 3.19Å; G405-K407 PolarHBondContact O-N 2.98Å; G405-R408 PolarHBondContact O-N 3.14Å; G405-A409 PolarHBondContact O-N 3.46Å; G405-A409 VanDerWaalsContact O-N 3.16Å
406	L	84.1	Confident	87.6	Confident	85 Å²	85	81.5 Å²	81.5	45%	0.445	43%	0.425	S	S	.	.	G	3₁₀ helix	trans	-56.5	-33.7	178.9	-74.3	170.1	0	0	0	112.3	V112 W402 D403 G404 R408 A409	V112-L406 HydrophobicContact CG1-CB 4.4Å; W402-L406 HydrophobicContact CB-CD1 4.17Å; W402-L406 HydrophobicContact CE3-CD1 3.86Å; D403-L406 HydrophobicContact CB-CG 4.3Å; D403-L406 VanDerWaalsContact O-CB 3.25Å; D403-L406 WeakPolarHBondContact O-CB 3.12Å; D403-L406 VanDerWaalsContact O-CG 3.28Å; D403-L406 WeakPolarHBondContact O-CG 3.06Å; D403-L406 PolarHBondContact O-N 3.49Å; G404-L406 PolarHBondContact O-N 3.07Å; L406-R408 PolarHBondContact O-N 2.98Å; L406-R408 VanDerWaalsContact O-N 3.08Å; L406-A409 PolarHBondContact O-N 2.82Å
407	K	79.7	Confident	87.4	Confident	71 Å²	71	83.8 Å²	83.8	31%	0.309	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-54.2	-31	174.9	-172.9	-169.6	-174	-176.3	0	113.3	F116 S345 G405	F116-K407 HydrophobicContact CB-CD 3.97Å; F116-K407 HydrophobicContact CD1-CD 3.7Å; F116-K407 HydrophobicContact CD2-CB 4.27Å; F116-K407 HydrophobicContact CD2-CD 3.81Å; F116-K407 HydrophobicContact CD2-CG 4.3Å; F116-K407 HydrophobicContact CE1-CD 4.04Å; F116-K407 HydrophobicContact CE2-CB 3.93Å; F116-K407 HydrophobicContact CE2-CD 4.18Å; F116-K407 HydrophobicContact CE2-CG 4.46Å; F116-K407 HydrophobicContact CG-CD 3.56Å; F116-K407 HydrophobicContact CZ-CB 4.14Å; F116-K407 HydrophobicContact CZ-CD 4.28Å; S345-K407 PolarHBondContact OG-NZ 3.39Å; G405-K407 PolarHBondContact O-N 2.98Å
408	R	78.5	Confident	87	Confident	179 Å²	179	88.1 Å²	88.1	68%	0.675	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-108.8	-10.2	-173.9	-59.4	-179.6	-176.5	-176.8	0.4	113	S344 G405 L406	S344-R408 PolarHBondContact OG-NH2 3.21Å; G405-R408 PolarHBondContact O-N 3.14Å; L406-R408 PolarHBondContact O-N 2.98Å; L406-R408 VanDerWaalsContact O-N 3.08Å
409	A	79.1	Confident	86.5	Confident	58 Å²	58	89.2 Å²	89.2	48%	0.479	44%	0.438	S	S	.	.	S	Bend	trans	-82	139.9	-176.4	0	0	0	0	0	110.7	G405 L406	G405-A409 PolarHBondContact O-N 3.46Å; G405-A409 VanDerWaalsContact O-N 3.16Å; L406-A409 PolarHBondContact O-N 2.82Å
410	K	82.5	Confident	86.2	Confident	174 Å²	174	91.4 Å²	91.4	76%	0.757	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-70.3	134.2	166.7	-165.5	-179.7	-179	-171.8	0	108.2	K412	K410-K412 PolarHBondContact O-N 3.43Å
411	V	82.9	Confident	85.8	Confident	85 Å²	85	97.4 Å²	97.4	52%	0.515	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-58.2	126.8	172.9	-178.2	0	0	0	0	108.7	F415 K416	V411-F415 HydrophobicContact CG1-CB 4.05Å; V411-F415 HydrophobicContact CG1-CD2 4.46Å; V411-K416 HydrophobicContact CG1-CG 4.12Å; V411-K416 WeakPolarHBondContact O-CE 3.16Å
412	K	85.7	Confident	85.3	Confident	143 Å²	143	94.9 Å²	94.9	62%	0.622	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-60.1	141.6	176.5	-64.4	-177.1	178.8	179.1	0	109.7	K410 I414 F415	K410-K412 PolarHBondContact O-N 3.43Å; K412-I414 PolarHBondContact O-N 3.06Å; K412-F415 HydrophobicContact CB-CD2 3.79Å; K412-F415 HydrophobicContact CB-CE2 4.11Å; K412-F415 HydrophobicContact CD-CE2 4Å; K412-F415 HydrophobicContact CG-CD2 4.39Å; K412-F415 HydrophobicContact CG-CE2 4.26Å; K412-F415 PolarHBondContact O-N 2.96Å; K412-F415 VanDerWaalsContact O-N 3.12Å
413	D	90.5	Very high	84.7	Confident	88 Å²	88	93 Å²	93	47%	0.471	45%	0.449	S	S	.	.	H	α-helix	trans	-63.8	-32.3	-174.7	-61.3	-42.3	0	0	0	112.4	F415 K416 E417	D413-F415 VanDerWaalsContact C-N 3.28Å; D413-F415 PolarHBondContact O-N 3.13Å; D413-K416 WeakPolarHBondContact O-CA 3.34Å; D413-K416 WeakPolarHBondContact O-CB 3.28Å; D413-K416 PolarHBondContact O-N 2.6Å; D413-K416 IonicContact OD1-NZ 3.67Å; D413-K416 PolarHBondContact OD1-NZ 3.47Å; D413-E417 WeakPolarHBondContact O-CG 3.41Å; D413-E417 PolarHBondContact O-N 3.29Å
414	I	91.2	Very high	84.3	Confident	118 Å²	118	93.3 Å²	93.3	61%	0.605	46%	0.455	S	S	*	.	H	α-helix	trans	-52.1	-43.2	173.1	-59.5	172.4	0	0	0	112.4	K412 K416 E417 E418	K412-I414 PolarHBondContact O-N 3.06Å; I414-K416 VanDerWaalsContact C-N 3.31Å; I414-K416 PolarHBondContact O-N 3.3Å; I414-E417 PolarHBondContact O-N 3.07Å; I414-E418 WeakPolarHBondContact O-CB 3.27Å; I414-E418 PolarHBondContact O-N 2.91Å
415	F	86.6	Confident	83.9	Confident	113 Å²	113	97.7 Å²	97.7	50%	0.496	47%	0.473	S	S	.	.	H	α-helix	trans	-69.8	-31	179.7	-63.9	-52.8	0	0	0	112.2	V411 K412 D413 Q419	V411-F415 HydrophobicContact CG1-CB 4.05Å; V411-F415 HydrophobicContact CG1-CD2 4.46Å; K412-F415 HydrophobicContact CB-CD2 3.79Å; K412-F415 HydrophobicContact CB-CE2 4.11Å; K412-F415 HydrophobicContact CD-CE2 4Å; K412-F415 HydrophobicContact CG-CD2 4.39Å; K412-F415 HydrophobicContact CG-CE2 4.26Å; K412-F415 PolarHBondContact O-N 2.96Å; K412-F415 VanDerWaalsContact O-N 3.12Å; D413-F415 VanDerWaalsContact C-N 3.28Å; D413-F415 PolarHBondContact O-N 3.13Å; F415-Q419 WeakPolarHBondContact O-CG 3.24Å; F415-Q419 PolarHBondContact O-N 3.12Å
416	K	87.8	Confident	83.3	Confident	79 Å²	79	96.5 Å²	96.5	34%	0.343	46%	0.458	S	S	.	.	H	α-helix	trans	-71	-44.5	173.9	-57.6	176.3	-168.9	153.2	0	110.4	V411 D413 I414 E418 Q419 Q420	V411-K416 HydrophobicContact CG1-CG 4.12Å; V411-K416 WeakPolarHBondContact O-CE 3.16Å; D413-K416 WeakPolarHBondContact O-CA 3.34Å; D413-K416 WeakPolarHBondContact O-CB 3.28Å; D413-K416 PolarHBondContact O-N 2.6Å; D413-K416 IonicContact OD1-NZ 3.67Å; D413-K416 PolarHBondContact OD1-NZ 3.47Å; I414-K416 VanDerWaalsContact C-N 3.31Å; I414-K416 PolarHBondContact O-N 3.3Å; K416-E418 VanDerWaalsContact C-N 3.29Å; K416-E418 PolarHBondContact O-N 3.25Å; K416-Q419 PolarHBondContact O-N 2.63Å; K416-Q420 WeakPolarHBondContact O-CB 3.45Å; K416-Q420 VanDerWaalsContact O-CG 3.29Å; K416-Q420 WeakPolarHBondContact O-CG 3.4Å; K416-Q420 PolarHBondContact O-N 2.99Å
417	E	91.8	Very high	82.7	Confident	112 Å²	112	96.3 Å²	96.3	52%	0.523	46%	0.457	S	S	.	.	H	α-helix	trans	-60.5	-39.1	177.6	-71.9	169.8	-168	0	0	111.5	D413 I414 Q420 K421	D413-E417 WeakPolarHBondContact O-CG 3.41Å; D413-E417 PolarHBondContact O-N 3.29Å; I414-E417 PolarHBondContact O-N 3.07Å; E417-Q420 PolarHBondContact O-N 2.99Å; E417-K421 WeakPolarHBondContact O-CB 2.97Å; E417-K421 PolarHBondContact O-N 3.07Å
418	E	87.2	Confident	82.3	Confident	104 Å²	104	96.6 Å²	96.6	49%	0.486	47%	0.465	S	S	.	.	H	α-helix	trans	-62	-45.4	175.3	-173.8	175.8	-167.1	0	0	112	I414 K416 K421 N422	I414-E418 WeakPolarHBondContact O-CB 3.27Å; I414-E418 PolarHBondContact O-N 2.91Å; K416-E418 VanDerWaalsContact C-N 3.29Å; K416-E418 PolarHBondContact O-N 3.25Å; E418-K421 PolarHBondContact O-N 3.26Å; E418-N422 PolarHBondContact O-N 2.84Å; E418-N422 PolarHBondContact O-ND2 3.12Å
419	Q	83.8	Confident	81.4	Confident	110 Å²	110	88.9 Å²	88.9	51%	0.514	44%	0.441	S	S	.	.	H	α-helix	trans	-65.5	-40	175.2	-67	-59.7	-36	0	0	111.9	F415 K416 K421 N422 Y423	F415-Q419 WeakPolarHBondContact O-CG 3.24Å; F415-Q419 PolarHBondContact O-N 3.12Å; K416-Q419 PolarHBondContact O-N 2.63Å; Q419-K421 VanDerWaalsContact C-N 3.33Å; Q419-K421 PolarHBondContact O-N 2.87Å; Q419-N422 PolarHBondContact O-N 3.3Å; Q419-Y423 PolarHBondContact O-N 3.34Å
420	Q	86.7	Confident	80.1	Confident	128 Å²	128	93.1 Å²	93.1	60%	0.598	46%	0.455	S	S	*	.	H	α-helix	trans	-63.2	-37.8	174.3	-72.8	171.3	-13.2	0	0	112.2	K416 E417 Y423 S424	K416-Q420 WeakPolarHBondContact O-CB 3.45Å; K416-Q420 VanDerWaalsContact O-CG 3.29Å; K416-Q420 WeakPolarHBondContact O-CG 3.4Å; K416-Q420 PolarHBondContact O-N 2.99Å; E417-Q420 PolarHBondContact O-N 2.99Å; Q420-Y423 WeakPolarHBondContact O-CB 3.27Å; Q420-Y423 PolarHBondContact O-N 3.27Å; Q420-S424 PolarHBondContact O-N 3.18Å
421	K	86	Confident	78.5	Confident	133 Å²	133	87.7 Å²	87.7	58%	0.578	45%	0.449	S	S	*	.	H	α-helix	trans	-67.4	-36.4	175	-173.3	177.6	-176.4	176.6	0	111.9	E417 E418 Q419 Y423 S424 K425	E417-K421 WeakPolarHBondContact O-CB 2.97Å; E417-K421 PolarHBondContact O-N 3.07Å; E418-K421 PolarHBondContact O-N 3.26Å; Q419-K421 VanDerWaalsContact C-N 3.33Å; Q419-K421 PolarHBondContact O-N 2.87Å; K421-Y423 VanDerWaalsContact C-N 3.35Å; K421-S424 WeakPolarHBondContact CA-OG 3.49Å; K421-S424 PolarHBondContact O-N 3.47Å; K421-S424 PolarHBondContact O-OG 3.46Å; K421-K425 WeakPolarHBondContact O-CG 3.49Å; K421-K425 PolarHBondContact O-N 3.26Å; K421-K425 VanDerWaalsContact O-N 3.14Å
422	N	80.2	Confident	76.6	Confident	23 Å²	23	87.6 Å²	87.6	12%	0.123	45%	0.452	C	S	.	.	H	α-helix	trans	-68	-38.1	174.2	-70.9	-26.1	0	0	0	111.7	M79 E418 Q419	M79-N422 HydrophobicContact CE-CB 3.58Å; M79-N422 HydrophobicContact SD-CB 3.8Å; E418-N422 PolarHBondContact O-N 2.84Å; E418-N422 PolarHBondContact O-ND2 3.12Å; Q419-N422 PolarHBondContact O-N 3.3Å
423	Y	78.8	Confident	74.5	Confident	68 Å²	68	89.7 Å²	89.7	27%	0.267	47%	0.469	S	S	.	.	H	α-helix	trans	-62.9	-45.7	170.9	-174	-99.3	0	0	0	112.3	F99 Q419 Q420 K421 K425 M426 I427	F99-Y423 AromaticContact CD1-CD2 3.98Å; F99-Y423 HydrophobicContact CD1-CD2 3.98Å; F99-Y423 AromaticContact CD2-CD2 3.31Å; F99-Y423 HydrophobicContact CD2-CD2 3.31Å; F99-Y423 AromaticContact CD2-CE2 3.53Å; F99-Y423 HydrophobicContact CD2-CE2 3.53Å; F99-Y423 AromaticContact CE1-CD2 3.98Å; F99-Y423 HydrophobicContact CE1-CD2 3.98Å; F99-Y423 AromaticContact CE2-CD2 3.29Å; F99-Y423 HydrophobicContact CE2-CD2 3.29Å; F99-Y423 AromaticContact CE2-CE2 3.8Å; F99-Y423 HydrophobicContact CE2-CE2 3.8Å; F99-Y423 HydrophobicContact CE2-CG 4.3Å; F99-Y423 AromaticContact CG-CD2 3.66Å; F99-Y423 HydrophobicContact CG-CD2 3.66Å; F99-Y423 HydrophobicContact CG-CE2 4.1Å; F99-Y423 AromaticContact CZ-CD2 3.64Å; F99-Y423 HydrophobicContact CZ-CD2 3.64Å; F99-Y423 HydrophobicContact CZ-CG 4.31Å; Q419-Y423 PolarHBondContact O-N 3.34Å; Q420-Y423 WeakPolarHBondContact O-CB 3.27Å; Q420-Y423 PolarHBondContact O-N 3.27Å; K421-Y423 VanDerWaalsContact C-N 3.35Å; Y423-K425 VanDerWaalsContact C-N 3.34Å; Y423-K425 PolarHBondContact O-N 3.06Å; Y423-M426 HydrophobicContact CD2-CE 4.34Å; Y423-M426 HydrophobicContact CE2-CE 3.88Å; Y423-M426 VanDerWaalsContact O-CB 3.29Å; Y423-M426 WeakPolarHBondContact O-CB 3.36Å; Y423-M426 PolarHBondContact O-N 3.5Å; Y423-M426 VanDerWaalsContact O-N 3.07Å; Y423-I427 HydrophobicContact CD1-CD1 3.95Å; Y423-I427 HydrophobicContact CE1-CD1 3.31Å; Y423-I427 HydrophobicContact CE1-CG1 4.24Å; Y423-I427 PolarHBondContact O-N 2.83Å
424	S	79.9	Confident	71.9	Confident	52 Å²	52	94.1 Å²	94.1	36%	0.364	51%	0.507	S	S	.	.	H	α-helix	trans	-64.9	-35.8	-178.6	71.5	0	0	0	0	113.1	Q420 K421 M426 I427 V428	Q420-S424 PolarHBondContact O-N 3.18Å; K421-S424 WeakPolarHBondContact CA-OG 3.49Å; K421-S424 PolarHBondContact O-N 3.47Å; K421-S424 PolarHBondContact O-OG 3.46Å; S424-M426 PolarHBondContact O-N 2.91Å; S424-I427 PolarHBondContact O-N 2.81Å; S424-I427 VanDerWaalsContact O-N 3.12Å; S424-V428 WeakPolarHBondContact O-CG2 3.41Å; S424-V428 PolarHBondContact O-N 2.95Å
425	K	75.9	Confident	71	Confident	94 Å²	94	93 Å²	93	41%	0.409	50%	0.502	S	S	.	.	H	α-helix	trans	-58.1	-27	173.3	-75.2	172.7	-176.4	173.2	0	113.3	K421 Y423	K421-K425 WeakPolarHBondContact O-CG 3.49Å; K421-K425 PolarHBondContact O-N 3.26Å; K421-K425 VanDerWaalsContact O-N 3.14Å; Y423-K425 VanDerWaalsContact C-N 3.34Å; Y423-K425 PolarHBondContact O-N 3.06Å
426	M	70.9	Confident	70.1	Confident	9 Å²	9	91.9 Å²	91.9	4%	0.044	50%	0.502	C	S	.	.	H	α-helix	trans	-73.6	-45.4	175.5	-175	-172.2	69.2	0	0	111	L83 L86 D95 F99 Y423 S424	L83-M426 HydrophobicContact CD2-CB 4.09Å; L83-M426 HydrophobicContact CG-CB 4.18Å; L83-M426 HydrophobicContact CG-CG 4.23Å; L86-M426 HydrophobicContact CB-CG 4.02Å; L86-M426 HydrophobicContact CB-SD 4.37Å; L86-M426 HydrophobicContact CD1-CG 4.16Å; L86-M426 HydrophobicContact CD1-SD 3.49Å; L86-M426 WeakPolarHBondContact CD1-SD 3.5Å; L86-M426 HydrophobicContact CG-SD 4.36Å; D95-M426 HydrophobicContact CB-CE 3.6Å; D95-M426 HydrophobicContact CB-SD 4.13Å; F99-M426 HydrophobicContact CD2-CE 4.27Å; F99-M426 HydrophobicContact CD2-SD 4.42Å; F99-M426 HydrophobicContact CE2-CE 3.74Å; F99-M426 HydrophobicContact CE2-SD 3.61Å; Y423-M426 HydrophobicContact CD2-CE 4.34Å; Y423-M426 HydrophobicContact CE2-CE 3.88Å; Y423-M426 VanDerWaalsContact O-CB 3.29Å; Y423-M426 WeakPolarHBondContact O-CB 3.36Å; Y423-M426 PolarHBondContact O-N 3.5Å; Y423-M426 VanDerWaalsContact O-N 3.07Å; S424-M426 PolarHBondContact O-N 2.91Å
427	I	70.6	Confident	69.2	Low	82 Å²	82	92.6 Å²	92.6	42%	0.421	51%	0.511	S	S	.	.	H	α-helix	trans	-70.3	-44.8	-176.9	-63.7	178.8	0	0	0	111.9	F91 Y423 S424 G429	F91-I427 HydrophobicContact CD2-CG1 4.27Å; F91-I427 HydrophobicContact CE2-CD1 4.48Å; Y423-I427 HydrophobicContact CD1-CD1 3.95Å; Y423-I427 HydrophobicContact CE1-CD1 3.31Å; Y423-I427 HydrophobicContact CE1-CG1 4.24Å; Y423-I427 PolarHBondContact O-N 2.83Å; S424-I427 PolarHBondContact O-N 2.81Å; S424-I427 VanDerWaalsContact O-N 3.12Å; I427-G429 VanDerWaalsContact C-N 3.34Å; I427-G429 PolarHBondContact O-N 3.07Å
428	V	71.3	Confident	67.8	Low	77 Å²	77	91.5 Å²	91.5	47%	0.467	51%	0.51	S	S	.	.	H	α-helix	trans	-78.3	-22.6	-170.3	179.9	0	0	0	0	111.8	S424	S424-V428 WeakPolarHBondContact O-CG2 3.41Å; S424-V428 PolarHBondContact O-N 2.95Å
429	G	60.2	Low	66.6	Low	17 Å²	17	90.7 Å²	90.7	18%	0.175	51%	0.512	C	S	.	.	T	Hydrogen-bonded Turn	trans	60	159.1	-165.1	0	0	0	0	0	111	I427 G431	I427-G429 VanDerWaalsContact C-N 3.34Å; I427-G429 PolarHBondContact O-N 3.07Å; G429-G431 PolarHBondContact O-N 3.35Å
430	N	51.7	Low	65.5	Low	147 Å²	147	89.4 Å²	89.4	79%	0.786	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	29.5	174.1	-89.4	0.6	0	0	0	112.8
431	G	49.7	Very low	64	Low	60 Å²	60	86.6 Å²	86.6	62%	0.619	51%	0.506	S	S	*	.	S	Bend	trans	-129.7	65.6	-175.5	0	0	0	0	0	112.1	G429	G429-G431 PolarHBondContact O-N 3.35Å
432	S	42.7	Very low	62.3	Low	83 Å²	83	83.1 Å²	83.1	58%	0.58	50%	0.5	S	S	*	.			trans	161.7	74.9	152.4	45.7	0	0	0	0	111.5
433	L	41.4	Very low	60.8	Low	186 Å²	186	88.1 Å²	88.1	97%	0.974	53%	0.531	S	S	*	.			trans	-122.7	69.5	150.2	-86.5	156.4	0	0	0	105.6
434	S	36.3	Very low	59.1	Low	182 Å²	182	89.9 Å²	89.9	100%	1.273	56%	0.556	S	S	*	*			trans	-101.8	0	167.2	61.6	0	0	0	0	109.3

Retrieved 434 of 434 residues in 1247.8 ms (Link to these results)

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