A0A077ZM46_TRITR Loading...

histidine kinase

AlphaFold DB , UniProt , Accession A0A077ZM46, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 645 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	61.6	Low	75.8	Confident	163 Å²	163	86.2 Å²	86.2	80%	0.803	53%	0.527	S	S	*	.				0	-59.5	0	-75.3	-57.3	-121.9	0	0	112.3	A3 L4 L5 L330	M1-A3 PolarHBondContact O-N 3.46Å; M1-L4 PolarHBondContact O-N 2.91Å; M1-L4 VanDerWaalsContact O-N 3.14Å; M1-L5 PolarHBondContact O-N 3.18Å; M1-L330 HydrophobicContact CE-CD2 4.22Å
2	G	71.3	Confident	76.2	Confident	55 Å²	55	82.3 Å²	82.3	57%	0.567	50%	0.503	S	S	*	.	H	α-helix	trans	-52.4	-47.9	-178.8	0	0	0	0	0	114.7	L4 L5 T6	G2-L4 VanDerWaalsContact C-N 3.32Å; G2-L4 PolarHBondContact O-N 3.28Å; G2-L5 WeakPolarHBondContact O-CB 3.33Å; G2-L5 PolarHBondContact O-N 3.07Å; G2-T6 PolarHBondContact O-N 3.14Å; G2-T6 PolarHBondContact O-OG1 2.95Å
3	A	74.8	Confident	76.5	Confident	79 Å²	79	81.4 Å²	81.4	65%	0.653	50%	0.502	S	S	*	.	H	α-helix	trans	-63	-33	180	0	0	0	0	0	114.4	M1 T6 L7	M1-A3 PolarHBondContact O-N 3.46Å; A3-T6 WeakPolarHBondContact CA-OG1 3.32Å; A3-T6 PolarHBondContact O-OG1 3.1Å; A3-L7 PolarHBondContact O-N 2.87Å
4	L	75.8	Confident	77.1	Confident	116 Å²	116	83.9 Å²	83.9	61%	0.607	51%	0.51	S	S	*	.	H	α-helix	trans	-71.4	-39.2	179.4	-168.4	118	0	0	0	110.5	M1 G2 L7 I8	M1-L4 PolarHBondContact O-N 2.91Å; M1-L4 VanDerWaalsContact O-N 3.14Å; G2-L4 VanDerWaalsContact C-N 3.32Å; G2-L4 PolarHBondContact O-N 3.28Å; L4-L7 PolarHBondContact O-N 3.41Å; L4-I8 HydrophobicContact CD2-CD1 4.01Å; L4-I8 WeakPolarHBondContact O-CG1 3.32Å; L4-I8 PolarHBondContact O-N 2.97Å
5	L	72.8	Confident	77.5	Confident	47 Å²	47	88.1 Å²	88.1	25%	0.246	52%	0.515	C	S	.	.	H	α-helix	trans	-64.7	-44.5	179.1	-169.7	107.2	0	0	0	112.2	M1 G2 L7 I8 V9 A327 L330	M1-L5 PolarHBondContact O-N 3.18Å; G2-L5 WeakPolarHBondContact O-CB 3.33Å; G2-L5 PolarHBondContact O-N 3.07Å; L5-L7 PolarHBondContact O-N 3.01Å; L5-I8 PolarHBondContact O-N 3.47Å; L5-V9 PolarHBondContact O-N 2.98Å; L5-A327 VanDerWaalsContact CD1-CA 3.42Å; L5-A327 HydrophobicContact CD1-CB 3.59Å; L5-A327 HydrophobicContact CD2-CB 3.31Å; L5-A327 HydrophobicContact CG-CB 3.87Å; L5-L330 HydrophobicContact CD1-CD1 3.9Å
6	T	78	Confident	77.7	Confident	83 Å²	83	83.3 Å²	83.3	51%	0.509	49%	0.487	S	S	.	.	H	α-helix	trans	-62.4	-34	177.7	47.7	0	0	0	0	112.3	G2 A3 S10	G2-T6 PolarHBondContact O-N 3.14Å; G2-T6 PolarHBondContact O-OG1 2.95Å; A3-T6 WeakPolarHBondContact CA-OG1 3.32Å; A3-T6 PolarHBondContact O-OG1 3.1Å; T6-S10 WeakPolarHBondContact O-CB 3.47Å; T6-S10 PolarHBondContact O-N 2.96Å; T6-S10 PolarHBondContact O-OG 2.82Å
7	L	82.1	Confident	77.9	Confident	116 Å²	116	87.9 Å²	87.9	61%	0.607	49%	0.494	S	S	*	.	H	α-helix	trans	-68.5	-42.5	179	-155.8	158.9	0	0	0	111.2	A3 L4 L5 S10 S11	A3-L7 PolarHBondContact O-N 2.87Å; L4-L7 PolarHBondContact O-N 3.41Å; L5-L7 PolarHBondContact O-N 3.01Å; L7-S10 PolarHBondContact O-N 3.36Å; L7-S11 PolarHBondContact O-N 3.29Å; L7-S11 PolarHBondContact O-OG 3.46Å; L7-S11 VanDerWaalsContact O-OG 3.09Å
8	I	77.7	Confident	78.3	Confident	87 Å²	87	89.4 Å²	89.4	45%	0.446	50%	0.496	S	S	.	.	H	α-helix	trans	-63.3	-47.4	178.9	-64.5	172.7	0	0	0	111.3	L4 L5 S10 S11 V12	L4-I8 HydrophobicContact CD2-CD1 4.01Å; L4-I8 WeakPolarHBondContact O-CG1 3.32Å; L4-I8 PolarHBondContact O-N 2.97Å; L5-I8 PolarHBondContact O-N 3.47Å; I8-S10 VanDerWaalsContact C-N 3.34Å; I8-S10 PolarHBondContact O-N 3.07Å; I8-S11 PolarHBondContact O-N 3.45Å; I8-V12 WeakPolarHBondContact O-CG2 3.42Å; I8-V12 PolarHBondContact O-N 3.32Å; I8-V12 VanDerWaalsContact O-N 3.12Å
9	V	78	Confident	78.3	Confident	58 Å²	58	87.8 Å²	87.8	35%	0.352	49%	0.485	S	S	.	.	H	α-helix	trans	-62	-43.6	-179.6	175.4	0	0	0	0	111	L5 S11 V12 S13 A323	L5-V9 PolarHBondContact O-N 2.98Å; V9-S11 PolarHBondContact O-N 3.23Å; V9-V12 PolarHBondContact O-N 2.93Å; V9-S13 PolarHBondContact O-N 3.49Å; V9-A323 HydrophobicContact CG2-CB 4.35Å
10	S	80.7	Confident	78.3	Confident	78 Å²	78	86.6 Å²	86.6	55%	0.545	48%	0.475	S	S	.	.	H	α-helix	trans	-62.7	-40.9	177.4	-65.2	0	0	0	0	112.7	T6 L7 I8 S13 L14	T6-S10 WeakPolarHBondContact O-CB 3.47Å; T6-S10 PolarHBondContact O-N 2.96Å; T6-S10 PolarHBondContact O-OG 2.82Å; L7-S10 PolarHBondContact O-N 3.36Å; I8-S10 VanDerWaalsContact C-N 3.34Å; I8-S10 PolarHBondContact O-N 3.07Å; S10-S13 PolarHBondContact O-N 3.06Å; S10-L14 WeakPolarHBondContact O-CB 3.26Å; S10-L14 PolarHBondContact O-N 3.07Å
11	S	81.2	Confident	78.4	Confident	66 Å²	66	83.8 Å²	83.8	46%	0.462	46%	0.462	S	S	.	.	H	α-helix	trans	-63.4	-42.7	177.4	-65.3	0	0	0	0	112.7	L7 I8 V9 L14 Y15	L7-S11 PolarHBondContact O-N 3.29Å; L7-S11 PolarHBondContact O-OG 3.46Å; L7-S11 VanDerWaalsContact O-OG 3.09Å; I8-S11 PolarHBondContact O-N 3.45Å; V9-S11 PolarHBondContact O-N 3.23Å; S11-L14 PolarHBondContact O-N 3.42Å; S11-Y15 PolarHBondContact O-N 2.95Å; S11-Y15 VanDerWaalsContact O-N 3.09Å
12	V	79.8	Confident	79.2	Confident	40 Å²	40	79.1 Å²	79.1	24%	0.242	45%	0.445	C	S	.	.	H	α-helix	trans	-64.2	-42.8	177	173.7	0	0	0	0	110.9	I8 V9 L14 Y15 S16 L319 I320	I8-V12 WeakPolarHBondContact O-CG2 3.42Å; I8-V12 PolarHBondContact O-N 3.32Å; I8-V12 VanDerWaalsContact O-N 3.12Å; V9-V12 PolarHBondContact O-N 2.93Å; V12-L14 VanDerWaalsContact C-N 3.35Å; V12-L14 PolarHBondContact O-N 3.44Å; V12-Y15 PolarHBondContact O-N 3.16Å; V12-S16 PolarHBondContact O-N 2.97Å; V12-S16 VanDerWaalsContact O-N 3.15Å; V12-L319 HydrophobicContact CG1-CB 3.97Å; V12-I320 HydrophobicContact CG1-CG1 4.49Å
13	S	80.1	Confident	79.3	Confident	70 Å²	70	78.3 Å²	78.3	49%	0.49	43%	0.427	S	S	.	.	H	α-helix	trans	-63.1	-40.4	177.6	-170.8	0	0	0	0	112.3	V9 S10 W17	V9-S13 PolarHBondContact O-N 3.49Å; S10-S13 PolarHBondContact O-N 3.06Å; S13-W17 PolarHBondContact O-N 3.21Å; S13-W17 VanDerWaalsContact O-N 3.16Å
14	L	85.1	Confident	79.4	Confident	117 Å²	117	78.8 Å²	78.8	61%	0.613	42%	0.417	S	S	*	.	H	α-helix	trans	-67.5	-40.4	179.8	-173.5	67.2	0	0	0	112	S10 S11 V12 W17 H18	S10-L14 WeakPolarHBondContact O-CB 3.26Å; S10-L14 PolarHBondContact O-N 3.07Å; S11-L14 PolarHBondContact O-N 3.42Å; V12-L14 VanDerWaalsContact C-N 3.35Å; V12-L14 PolarHBondContact O-N 3.44Å; L14-W17 PolarHBondContact O-N 3.02Å; L14-H18 PolarHBondContact O-N 3.35Å
15	Y	84.2	Confident	79.4	Confident	147 Å²	147	79.4 Å²	79.4	58%	0.576	41%	0.412	S	S	*	.	H	α-helix	trans	-61.6	-49.2	176.7	178.9	-98.3	0	0	0	111.7	S11 V12 W17 H18 E19	S11-Y15 PolarHBondContact O-N 2.95Å; S11-Y15 VanDerWaalsContact O-N 3.09Å; V12-Y15 PolarHBondContact O-N 3.16Å; Y15-W17 VanDerWaalsContact C-N 3.32Å; Y15-W17 PolarHBondContact O-N 3.41Å; Y15-H18 PolarHBondContact O-N 2.96Å; Y15-E19 PolarHBondContact O-N 2.91Å; Y15-E19 VanDerWaalsContact O-N 3.09Å
16	S	79.3	Confident	79.5	Confident	10 Å²	10	82.7 Å²	82.7	7%	0.07	42%	0.422	C	S	.	.	H	α-helix	trans	-58.9	-43.2	178.7	-179.6	0	0	0	0	112.2	V12 H18 E19 Q20 S316	V12-S16 PolarHBondContact O-N 2.97Å; V12-S16 VanDerWaalsContact O-N 3.15Å; S16-H18 PolarHBondContact O-N 2.97Å; S16-E19 PolarHBondContact O-N 3.3Å; S16-Q20 WeakPolarHBondContact O-CG 3.37Å; S16-Q20 PolarHBondContact O-N 3.5Å; S16-Q20 VanDerWaalsContact O-N 3.16Å; S16-S316 WeakPolarHBondContact OG-CB 3.45Å; S16-S316 PolarHBondContact OG-OG 3.03Å
17	W	81.5	Confident	79.2	Confident	162 Å²	162	79.2 Å²	79.2	61%	0.614	40%	0.401	S	S	*	.	H	α-helix	trans	-63.5	-41.1	177.1	-179.4	78.6	0	0	0	112.6	S13 L14 Y15 S21	S13-W17 PolarHBondContact O-N 3.21Å; S13-W17 VanDerWaalsContact O-N 3.16Å; L14-W17 PolarHBondContact O-N 3.02Å; Y15-W17 VanDerWaalsContact C-N 3.32Å; Y15-W17 PolarHBondContact O-N 3.41Å; W17-S21 VanDerWaalsContact O-CB 3.23Å; W17-S21 WeakPolarHBondContact O-CB 3.47Å; W17-S21 PolarHBondContact O-N 3.38Å
18	H	85.3	Confident	78.7	Confident	115 Å²	115	78.5 Å²	78.5	53%	0.532	40%	0.397	S	S	.	.	H	α-helix	trans	-63.6	-44.6	178.9	-174.5	76.7	0	0	0	112.1	L14 Y15 S16 S21 S22	L14-H18 PolarHBondContact O-N 3.35Å; Y15-H18 PolarHBondContact O-N 2.96Å; S16-H18 PolarHBondContact O-N 2.97Å; H18-S21 PolarHBondContact O-N 2.94Å; H18-S22 PolarHBondContact O-N 3.42Å
19	E	78.4	Confident	78.6	Confident	59 Å²	59	80 Å²	80	28%	0.276	41%	0.406	S	S	.	.	H	α-helix	trans	-65.3	-45.2	-179	-165.8	172.4	-169.7	0	0	111.8	Y15 S16 S21 S22 Q23 I312	Y15-E19 PolarHBondContact O-N 2.91Å; Y15-E19 VanDerWaalsContact O-N 3.09Å; S16-E19 PolarHBondContact O-N 3.3Å; E19-S21 PolarHBondContact O-N 3.33Å; E19-S22 PolarHBondContact O-N 2.93Å; E19-Q23 PolarHBondContact O-N 3.33Å; E19-I312 HydrophobicContact CG-CD1 4.19Å; E19-I312 HydrophobicContact CG-CG2 4.28Å
20	Q	77.3	Confident	78.2	Confident	63 Å²	63	80.6 Å²	80.6	29%	0.294	41%	0.405	S	S	.	.	H	α-helix	trans	-62.5	-42.8	175.3	-70.8	179.4	-8.1	0	0	112.2	S16 S22 Q23 I24 I312	S16-Q20 WeakPolarHBondContact O-CG 3.37Å; S16-Q20 PolarHBondContact O-N 3.5Å; S16-Q20 VanDerWaalsContact O-N 3.16Å; Q20-S22 VanDerWaalsContact C-N 3.33Å; Q20-S22 PolarHBondContact O-N 3.26Å; Q20-Q23 PolarHBondContact O-N 2.92Å; Q20-I24 WeakPolarHBondContact O-CG1 3.23Å; Q20-I24 PolarHBondContact O-N 3.42Å; Q20-I24 VanDerWaalsContact O-N 3.13Å; Q20-I312 HydrophobicContact CG-CG2 4.17Å
21	S	80.9	Confident	77.7	Confident	28 Å²	28	77.7 Å²	77.7	20%	0.196	38%	0.382	C	S	.	.	H	α-helix	trans	-65.6	-34.3	179.2	-177.8	0	0	0	0	112.9	W17 H18 E19 R25	W17-S21 VanDerWaalsContact O-CB 3.23Å; W17-S21 WeakPolarHBondContact O-CB 3.47Å; W17-S21 PolarHBondContact O-N 3.38Å; H18-S21 PolarHBondContact O-N 2.94Å; E19-S21 PolarHBondContact O-N 3.33Å; S21-R25 PolarHBondContact O-N 2.87Å; S21-R25 PolarHBondContact O-NE 3.4Å; S21-R25 PolarHBondContact OG-NH2 3.05Å
22	S	77.9	Confident	77.5	Confident	65 Å²	65	79.8 Å²	79.8	46%	0.455	38%	0.383	S	S	.	.	H	α-helix	trans	-64.6	-45.2	175.6	-173	0	0	0	0	111.7	H18 E19 Q20 R25 Y26	H18-S22 PolarHBondContact O-N 3.42Å; E19-S22 PolarHBondContact O-N 2.93Å; Q20-S22 VanDerWaalsContact C-N 3.33Å; Q20-S22 PolarHBondContact O-N 3.26Å; S22-R25 PolarHBondContact O-N 3.43Å; S22-Y26 PolarHBondContact O-N 2.82Å
23	Q	75	Confident	77.4	Confident	38 Å²	38	80.6 Å²	80.6	18%	0.178	39%	0.389	C	S	.	.	H	α-helix	trans	-69.3	-37	-179.6	-67.6	-155.7	-17.2	0	0	113.9	E19 Q20 Y26 S27 M309 I312	E19-Q23 PolarHBondContact O-N 3.33Å; Q20-Q23 PolarHBondContact O-N 2.92Å; Q23-Y26 PolarHBondContact O-N 3.16Å; Q23-S27 PolarHBondContact O-N 3.2Å; Q23-S27 VanDerWaalsContact O-N 3.07Å; Q23-M309 HydrophobicContact CB-SD 4.26Å; Q23-M309 PolarHBondContact OE1-SD 3.38Å; Q23-M309 VanDerWaalsContact OE1-SD 3.34Å; Q23-I312 HydrophobicContact CG-CD1 4.29Å
24	I	76	Confident	77.1	Confident	89 Å²	89	80.5 Å²	80.5	46%	0.456	38%	0.378	S	S	.	.	H	α-helix	trans	-64.1	-42.9	176.2	-68.3	168.4	0	0	0	110.6	Q20 S27 L28	Q20-I24 WeakPolarHBondContact O-CG1 3.23Å; Q20-I24 PolarHBondContact O-N 3.42Å; Q20-I24 VanDerWaalsContact O-N 3.13Å; I24-S27 WeakPolarHBondContact O-CB 3.36Å; I24-S27 PolarHBondContact O-N 3.02Å; I24-L28 HydrophobicContact CG2-CD1 3.92Å; I24-L28 WeakPolarHBondContact O-CG 3.32Å; I24-L28 PolarHBondContact O-N 3.36Å
25	R	76.3	Confident	76.7	Confident	129 Å²	129	77.6 Å²	77.6	49%	0.487	36%	0.363	S	S	.	.	H	α-helix	trans	-61.7	-45.1	175	-91.2	178.3	-69.9	-150	0.3	112.3	S21 S22 S27 L28 D29	S21-R25 PolarHBondContact O-N 2.87Å; S21-R25 PolarHBondContact O-NE 3.4Å; S21-R25 PolarHBondContact OG-NH2 3.05Å; S22-R25 PolarHBondContact O-N 3.43Å; R25-S27 VanDerWaalsContact C-N 3.25Å; R25-S27 PolarHBondContact O-N 2.92Å; R25-L28 PolarHBondContact O-N 2.74Å; R25-D29 WeakPolarHBondContact O-CB 3.14Å; R25-D29 PolarHBondContact O-N 2.89Å
26	Y	75.3	Confident	76.6	Confident	116 Å²	116	76.1 Å²	76.1	46%	0.455	36%	0.361	S	S	.	.	H	α-helix	trans	-55.3	-42.1	175.3	180	-97.5	0	0	0	112.4	S22 Q23 E30 Y31	S22-Y26 PolarHBondContact O-N 2.82Å; Q23-Y26 PolarHBondContact O-N 3.16Å; Y26-E30 HydrophobicContact CE2-CB 4.39Å; Y26-E30 WeakPolarHBondContact CE2-OE2 3.48Å; Y26-E30 WeakPolarHBondContact O-CB 3.5Å; Y26-E30 PolarHBondContact O-N 2.9Å; Y26-E30 VanDerWaalsContact O-N 3.14Å; Y26-Y31 PolarHBondContact O-N 3.43Å
27	S	70.4	Confident	76.7	Confident	11 Å²	11	76.4 Å²	76.4	8%	0.077	36%	0.363	C	S	.	.	I	π-helix	trans	-64.7	-47.1	177.5	-176.6	0	0	0	0	112.5	Q23 I24 R25 Y31 F32	Q23-S27 PolarHBondContact O-N 3.2Å; Q23-S27 VanDerWaalsContact O-N 3.07Å; I24-S27 WeakPolarHBondContact O-CB 3.36Å; I24-S27 PolarHBondContact O-N 3.02Å; R25-S27 VanDerWaalsContact C-N 3.25Å; R25-S27 PolarHBondContact O-N 2.92Å; S27-Y31 WeakPolarHBondContact O-CB 3.41Å; S27-Y31 PolarHBondContact O-N 3.3Å; S27-F32 VanDerWaalsContact O-CD2 3.26Å; S27-F32 WeakPolarHBondContact O-CD2 3.25Å; S27-F32 PolarHBondContact O-N 2.87Å; S27-F32 VanDerWaalsContact O-N 3.07Å; S27-F32 VanDerWaalsContact OG-CE2 3.3Å; S27-F32 WeakPolarHBondContact OG-CE2 3.35Å
28	L	73.3	Confident	76.5	Confident	100 Å²	100	68.9 Å²	68.9	52%	0.524	34%	0.336	S	S	.	.	I	π-helix	trans	-70.3	-41.8	-177.8	-71.5	172	0	0	0	113.1	I24 R25 F32 P33	I24-L28 HydrophobicContact CG2-CD1 3.92Å; I24-L28 WeakPolarHBondContact O-CG 3.32Å; I24-L28 PolarHBondContact O-N 3.36Å; R25-L28 PolarHBondContact O-N 2.74Å; L28-F32 HydrophobicContact CD2-CD2 4.23Å; L28-F32 HydrophobicContact CD2-CE2 4.45Å; L28-P33 WeakPolarHBondContact O-CD 3.32Å
29	D	73.7	Confident	76.4	Confident	120 Å²	120	70.1 Å²	70.1	64%	0.642	34%	0.339	S	S	*	.	I	π-helix	trans	-86.1	-32.7	-171	-66	-26.2	0	0	0	112.8	R25	R25-D29 WeakPolarHBondContact O-CB 3.14Å; R25-D29 PolarHBondContact O-N 2.89Å
30	E	69.7	Low	76.8	Confident	70 Å²	70	70.3 Å²	70.3	33%	0.327	34%	0.342	S	S	.	.	I	π-helix	trans	-114.9	-41.7	-172.3	-165.5	173.9	166.9	0	0	113.3	Y26 R34	Y26-E30 HydrophobicContact CE2-CB 4.39Å; Y26-E30 WeakPolarHBondContact CE2-OE2 3.48Å; Y26-E30 WeakPolarHBondContact O-CB 3.5Å; Y26-E30 PolarHBondContact O-N 2.9Å; Y26-E30 VanDerWaalsContact O-N 3.14Å; E30-R34 VanDerWaalsContact CG-CZ 3.46Å; E30-R34 WeakPolarHBondContact O-CD 3.42Å; E30-R34 VanDerWaalsContact O-CG 3.24Å; E30-R34 WeakPolarHBondContact O-CG 3.46Å; E30-R34 IonicContact OE1-CZ 3.08Å; E30-R34 IonicContact OE1-NH1 3.2Å; E30-R34 PolarHBondContact OE1-NH1 2.99Å; E30-R34 IonicContact OE1-NH2 2.64Å; E30-R34 PolarHBondContact OE1-NH2 3.49Å
31	Y	71.9	Confident	77.2	Confident	17 Å²	17	67.4 Å²	67.4	7%	0.067	33%	0.329	C	S	.	.	I	π-helix	trans	-80.7	-55.2	-171.1	-173.8	-103.2	0	0	0	113.1	Y26 S27 R34 I35 T298 Q301 M302	Y26-Y31 PolarHBondContact O-N 3.43Å; S27-Y31 WeakPolarHBondContact O-CB 3.41Å; S27-Y31 PolarHBondContact O-N 3.3Å; Y31-R34 WeakPolarHBondContact O-CB 3.45Å; Y31-R34 PolarHBondContact O-N 3.24Å; Y31-I35 HydrophobicContact CD1-CD1 3.98Å; Y31-I35 HydrophobicContact CE1-CD1 3.28Å; Y31-I35 HydrophobicContact CE1-CG1 4.19Å; Y31-I35 HydrophobicContact CE2-CD1 4.16Å; Y31-I35 PolarHBondContact O-N 2.95Å; Y31-I35 VanDerWaalsContact O-N 3.16Å; Y31-I35 WeakPolarHBondContact OH-CD1 3.38Å; Y31-T298 HydrophobicContact CE2-CG2 4.37Å; Y31-T298 PolarHBondContact OH-O 3.49Å; Y31-Q301 HydrophobicContact CE2-CB 3.79Å; Y31-M302 HydrophobicContact CE1-SD 3.53Å; Y31-M302 VanDerWaalsContact CE1-SD 3.53Å; Y31-M302 WeakPolarHBondContact OH-CA 3.49Å; Y31-M302 WeakPolarHBondContact OH-CB 3.36Å; Y31-M302 PolarHBondContact OH-N 3.42Å
32	F	76.6	Confident	77.4	Confident	110 Å²	110	69.1 Å²	69.1	48%	0.482	33%	0.334	S	S	.	.	H	α-helix	trans	-59.7	-44.9	-178	-80.1	-69.2	0	0	0	113.8	S27 L28 R34 I35 H36	S27-F32 VanDerWaalsContact O-CD2 3.26Å; S27-F32 WeakPolarHBondContact O-CD2 3.25Å; S27-F32 PolarHBondContact O-N 2.87Å; S27-F32 VanDerWaalsContact O-N 3.07Å; S27-F32 VanDerWaalsContact OG-CE2 3.3Å; S27-F32 WeakPolarHBondContact OG-CE2 3.35Å; L28-F32 HydrophobicContact CD2-CD2 4.23Å; L28-F32 HydrophobicContact CD2-CE2 4.45Å; F32-R34 VanDerWaalsContact C-N 3.28Å; F32-R34 PolarHBondContact O-N 3.29Å; F32-I35 PolarHBondContact O-N 3.49Å; F32-H36 WeakPolarHBondContact O-CB 3.39Å; F32-H36 PolarHBondContact O-N 3.32Å
33	P	77.3	Confident	77.8	Confident	57 Å²	57	67.8 Å²	67.8	37%	0.37	33%	0.33	S	S	.	.	H	α-helix	trans	-61.5	-35	177.1	-25.5	36.6	0	0	0	113.2	L28 S37	L28-P33 WeakPolarHBondContact O-CD 3.32Å; P33-S37 WeakPolarHBondContact O-CB 3.43Å; P33-S37 PolarHBondContact O-N 3.49Å; P33-S37 PolarHBondContact O-OG 3.42Å
34	R	74.8	Confident	78.5	Confident	67 Å²	67	67.2 Å²	67.2	25%	0.253	33%	0.328	S	S	.	.	H	α-helix	trans	-66.1	-46.7	177.2	-81.9	179.1	-179.1	163	11.7	112.4	E30 Y31 F32 H36 S37 A38 G84	E30-R34 VanDerWaalsContact CG-CZ 3.46Å; E30-R34 WeakPolarHBondContact O-CD 3.42Å; E30-R34 VanDerWaalsContact O-CG 3.24Å; E30-R34 WeakPolarHBondContact O-CG 3.46Å; E30-R34 IonicContact OE1-CZ 3.08Å; E30-R34 IonicContact OE1-NH1 3.2Å; E30-R34 PolarHBondContact OE1-NH1 2.99Å; E30-R34 IonicContact OE1-NH2 2.64Å; E30-R34 PolarHBondContact OE1-NH2 3.49Å; Y31-R34 WeakPolarHBondContact O-CB 3.45Å; Y31-R34 PolarHBondContact O-N 3.24Å; F32-R34 VanDerWaalsContact C-N 3.28Å; F32-R34 PolarHBondContact O-N 3.29Å; R34-H36 VanDerWaalsContact C-N 3.33Å; R34-H36 PolarHBondContact O-N 3.48Å; R34-S37 PolarHBondContact O-N 3.13Å; R34-A38 PolarHBondContact O-N 3.05Å; R34-G84 VanDerWaalsContact CG-O 3.26Å; R34-G84 WeakPolarHBondContact CG-O 3.44Å
35	I	76.5	Confident	79	Confident	57 Å²	57	63.4 Å²	63.4	29%	0.292	31%	0.309	S	S	.	.	H	α-helix	trans	-60.6	-47.3	175.9	-63.2	-165	0	0	0	110.7	Y31 F32 S37 A38 F39 T298	Y31-I35 HydrophobicContact CD1-CD1 3.98Å; Y31-I35 HydrophobicContact CE1-CD1 3.28Å; Y31-I35 HydrophobicContact CE1-CG1 4.19Å; Y31-I35 HydrophobicContact CE2-CD1 4.16Å; Y31-I35 PolarHBondContact O-N 2.95Å; Y31-I35 VanDerWaalsContact O-N 3.16Å; Y31-I35 WeakPolarHBondContact OH-CD1 3.38Å; F32-I35 PolarHBondContact O-N 3.49Å; I35-S37 VanDerWaalsContact C-N 3.28Å; I35-S37 PolarHBondContact O-N 3.05Å; I35-A38 PolarHBondContact O-N 3.06Å; I35-A38 VanDerWaalsContact O-N 3.15Å; I35-F39 PolarHBondContact O-N 3.46Å; I35-T298 HydrophobicContact CD1-CG2 3.36Å; I35-T298 HydrophobicContact CG1-CG2 3.45Å; I35-T298 VanDerWaalsContact CG1-CG2 3.45Å
36	H	80.9	Confident	79.6	Confident	115 Å²	115	61.4 Å²	61.4	53%	0.532	31%	0.308	S	S	.	.	H	α-helix	trans	-59.7	-43	-179.5	-172.6	61.7	0	0	0	111.2	F32 R34 F39 L40	F32-H36 WeakPolarHBondContact O-CB 3.39Å; F32-H36 PolarHBondContact O-N 3.32Å; R34-H36 VanDerWaalsContact C-N 3.33Å; R34-H36 PolarHBondContact O-N 3.48Å; H36-F39 PolarHBondContact O-N 2.98Å; H36-L40 WeakPolarHBondContact O-CG 3.48Å; H36-L40 PolarHBondContact O-N 3.15Å; H36-L40 VanDerWaalsContact O-N 3.09Å
37	S	81.1	Confident	80.3	Confident	16 Å²	16	59.7 Å²	59.7	11%	0.112	31%	0.306	C	S	.	.	H	α-helix	trans	-62	-44	174.8	-56.3	0	0	0	0	112	P33 R34 I35 L40 I41	P33-S37 WeakPolarHBondContact O-CB 3.43Å; P33-S37 PolarHBondContact O-N 3.49Å; P33-S37 PolarHBondContact O-OG 3.42Å; R34-S37 PolarHBondContact O-N 3.13Å; I35-S37 VanDerWaalsContact C-N 3.28Å; I35-S37 PolarHBondContact O-N 3.05Å; S37-L40 PolarHBondContact O-N 3.4Å; S37-I41 WeakPolarHBondContact O-CD1 3.27Å; S37-I41 WeakPolarHBondContact O-CG1 3.41Å; S37-I41 PolarHBondContact O-N 3.33Å
38	A	78.4	Confident	81.3	Confident	5 Å²	5	59.2 Å²	59.2	4%	0.041	30%	0.303	C	S	.	.	H	α-helix	trans	-62	-43.4	178.1	0	0	0	0	0	112.5	R34 I35 I41 E42 Q294	R34-A38 PolarHBondContact O-N 3.05Å; I35-A38 PolarHBondContact O-N 3.06Å; I35-A38 VanDerWaalsContact O-N 3.15Å; A38-I41 PolarHBondContact O-N 3.12Å; A38-E42 PolarHBondContact O-N 3.32Å; A38-Q294 HydrophobicContact CB-CG 4.34Å
39	F	82.2	Confident	82	Confident	140 Å²	140	56.3 Å²	56.3	61%	0.614	29%	0.289	S	S	*	.	H	α-helix	trans	-64.2	-41.5	177.5	-174.2	-98.9	0	0	0	112.4	I35 H36 I41 E42 G43	I35-F39 PolarHBondContact O-N 3.46Å; H36-F39 PolarHBondContact O-N 2.98Å; F39-I41 VanDerWaalsContact C-N 3.32Å; F39-I41 PolarHBondContact O-N 2.98Å; F39-E42 PolarHBondContact O-N 3.18Å; F39-G43 PolarHBondContact O-N 3.37Å; F39-G43 VanDerWaalsContact O-N 3.07Å
40	L	86.3	Confident	82.7	Confident	64 Å²	64	55.3 Å²	55.3	34%	0.335	28%	0.283	S	S	.	.	H	α-helix	trans	-67	-33.5	175.3	-69.1	177	0	0	0	112.5	H36 S37 N44 L81	H36-L40 WeakPolarHBondContact O-CG 3.48Å; H36-L40 PolarHBondContact O-N 3.15Å; H36-L40 VanDerWaalsContact O-N 3.09Å; S37-L40 PolarHBondContact O-N 3.4Å; L40-N44 PolarHBondContact O-N 3.05Å; L40-N44 VanDerWaalsContact O-N 3.15Å; L40-N44 PolarHBondContact O-ND2 3.47Å; L40-L81 HydrophobicContact CB-CD1 3.6Å; L40-L81 HydrophobicContact CB-CD2 4.07Å; L40-L81 HydrophobicContact CB-CG 4.45Å; L40-L81 HydrophobicContact CD1-CD2 3.75Å
41	I	86.5	Confident	83.8	Confident	2 Å²	2	53 Å²	53	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-66.8	-44.8	174.5	-70.4	164.8	0	0	0	110.4	S37 A38 F39 G43 N44 L45 I78 L81 L85 L93 F287 L291	S37-I41 WeakPolarHBondContact O-CD1 3.27Å; S37-I41 WeakPolarHBondContact O-CG1 3.41Å; S37-I41 PolarHBondContact O-N 3.33Å; A38-I41 PolarHBondContact O-N 3.12Å; F39-I41 VanDerWaalsContact C-N 3.32Å; F39-I41 PolarHBondContact O-N 2.98Å; I41-G43 VanDerWaalsContact C-N 3.34Å; I41-G43 PolarHBondContact O-N 3.06Å; I41-N44 PolarHBondContact O-N 3.49Å; I41-L45 PolarHBondContact O-N 2.89Å; I41-I78 HydrophobicContact CG1-CG2 4.42Å; I41-I78 HydrophobicContact CG2-CG1 4.49Å; I41-I78 HydrophobicContact CG2-CG2 3.91Å; I41-L81 HydrophobicContact CD1-CB 4.08Å; I41-L81 HydrophobicContact CG1-CB 3.64Å; I41-L81 HydrophobicContact CG1-CD1 4.15Å; I41-L85 HydrophobicContact CD1-CD1 3.67Å; I41-L85 HydrophobicContact CD1-CG 4.17Å; I41-L93 HydrophobicContact CD1-CD2 4.16Å; I41-F287 HydrophobicContact CG2-CE1 4.28Å; I41-F287 HydrophobicContact CG2-CZ 4.4Å; I41-L291 HydrophobicContact CG2-CD2 4.02Å
42	E	85.1	Confident	84.6	Confident	64 Å²	64	52.5 Å²	52.5	30%	0.299	27%	0.271	S	S	.	.	H	α-helix	trans	-58	-45.9	176.4	-176.8	179.2	-177	0	0	111.6	A38 F39 N44 L45 N46 L291	A38-E42 PolarHBondContact O-N 3.32Å; F39-E42 PolarHBondContact O-N 3.18Å; E42-N44 PolarHBondContact O-N 3.27Å; E42-L45 PolarHBondContact O-N 3.35Å; E42-N46 PolarHBondContact O-N 3.25Å; E42-N46 VanDerWaalsContact O-N 3.09Å; E42-L291 HydrophobicContact CB-CD1 4.19Å; E42-L291 HydrophobicContact CG-CD1 4.31Å
43	G	87.4	Confident	85.2	Confident	36 Å²	36	50.4 Å²	50.4	37%	0.371	27%	0.265	S	S	.	.	H	α-helix	trans	-59.3	-43.6	176	0	0	0	0	0	113.3	F39 I41 L47	F39-G43 PolarHBondContact O-N 3.37Å; F39-G43 VanDerWaalsContact O-N 3.07Å; I41-G43 VanDerWaalsContact C-N 3.34Å; I41-G43 PolarHBondContact O-N 3.06Å; G43-L47 PolarHBondContact O-N 3.04Å
44	N	89.8	Confident	85.8	Confident	26 Å²	26	52.8 Å²	52.8	14%	0.139	27%	0.271	C	S	.	.	H	α-helix	trans	-70.6	-32.1	176.8	-80.5	-86	0	0	0	112.7	L40 I41 E42 L47 V48 H74 I78	L40-N44 PolarHBondContact O-N 3.05Å; L40-N44 VanDerWaalsContact O-N 3.15Å; L40-N44 PolarHBondContact O-ND2 3.47Å; I41-N44 PolarHBondContact O-N 3.49Å; E42-N44 PolarHBondContact O-N 3.27Å; N44-L47 PolarHBondContact O-N 3.29Å; N44-V48 WeakPolarHBondContact O-CG2 3.21Å; N44-V48 PolarHBondContact O-N 3.44Å; N44-H74 PolarHBondContact OD1-ND1 3.25Å; N44-H74 VanDerWaalsContact OD1-ND1 3.1Å; N44-I78 HydrophobicContact CB-CD1 3.93Å; N44-I78 HydrophobicContact CB-CG1 3.54Å
45	L	86.5	Confident	86.6	Confident	10 Å²	10	49.6 Å²	49.6	5%	0.052	26%	0.259	C	S	.	.	H	α-helix	trans	-63.4	-45	175.5	178.2	67.5	0	0	0	111.2	I41 E42 L47 V48 V49 F287 L291	I41-L45 PolarHBondContact O-N 2.89Å; E42-L45 PolarHBondContact O-N 3.35Å; L45-L47 VanDerWaalsContact C-N 3.25Å; L45-L47 PolarHBondContact O-N 3.13Å; L45-V48 WeakPolarHBondContact O-CB 3.44Å; L45-V48 PolarHBondContact O-N 3Å; L45-V49 HydrophobicContact CD1-CG2 4.44Å; L45-V49 HydrophobicContact CG-CG2 4.37Å; L45-V49 WeakPolarHBondContact O-CG2 3.47Å; L45-V49 PolarHBondContact O-N 3.3Å; L45-F287 HydrophobicContact CB-CD1 4.48Å; L45-F287 HydrophobicContact CB-CE1 4.07Å; L45-F287 HydrophobicContact CB-CZ 4.48Å; L45-F287 HydrophobicContact CD1-CB 4.2Å; L45-F287 HydrophobicContact CD1-CD1 3.49Å; L45-F287 VanDerWaalsContact CD1-CD1 3.49Å; L45-F287 HydrophobicContact CD1-CD2 3.63Å; L45-F287 HydrophobicContact CD1-CE1 3.64Å; L45-F287 HydrophobicContact CD1-CE2 3.81Å; L45-F287 HydrophobicContact CD1-CG 3.49Å; L45-F287 VanDerWaalsContact CD1-CG 3.49Å; L45-F287 HydrophobicContact CD1-CZ 3.8Å; L45-F287 HydrophobicContact CD2-CB 4.38Å; L45-F287 HydrophobicContact CD2-CD1 3.25Å; L45-F287 HydrophobicContact CD2-CE1 3.65Å; L45-F287 HydrophobicContact CD2-CG 3.94Å; L45-F287 HydrophobicContact CG-CD1 3.89Å; L45-F287 HydrophobicContact CG-CE1 3.97Å; L45-F287 HydrophobicContact CG-CG 4.33Å; L45-L291 HydrophobicContact CB-CD1 4.26Å; L45-L291 HydrophobicContact CD2-CD1 3.3Å; L45-L291 HydrophobicContact CD2-CG 4.43Å; L45-L291 HydrophobicContact CG-CD1 4.41Å
46	N	87.7	Confident	87.1	Confident	87 Å²	87	48.9 Å²	48.9	47%	0.465	26%	0.255	S	S	.	.	H	α-helix	trans	-58.2	-42.1	179.4	-70.1	-24.3	0	0	0	110.9	E42 V48 V49 D50	E42-N46 PolarHBondContact O-N 3.25Å; E42-N46 VanDerWaalsContact O-N 3.09Å; N46-V48 PolarHBondContact O-N 3.47Å; N46-V49 PolarHBondContact O-N 3.45Å; N46-D50 PolarHBondContact O-N 2.96Å
47	L	91.2	Very high	87.4	Confident	79 Å²	79	51 Å²	51	41%	0.414	27%	0.266	S	S	.	.	H	α-helix	trans	-62.4	-40.5	173.8	-66.5	173.2	0	0	0	112.9	G43 N44 L45 V49 D50 Q51 H74	G43-L47 PolarHBondContact O-N 3.04Å; N44-L47 PolarHBondContact O-N 3.29Å; L45-L47 VanDerWaalsContact C-N 3.25Å; L45-L47 PolarHBondContact O-N 3.13Å; L47-V49 VanDerWaalsContact C-N 3.34Å; L47-V49 PolarHBondContact O-N 3.49Å; L47-D50 PolarHBondContact O-N 2.79Å; L47-Q51 WeakPolarHBondContact O-CB 3.48Å; L47-Q51 VanDerWaalsContact O-CG 3.29Å; L47-Q51 WeakPolarHBondContact O-CG 3.25Å; L47-Q51 PolarHBondContact O-N 3.33Å; L47-H74 VanDerWaalsContact CD1-CE1 3.49Å; L47-H74 WeakPolarHBondContact CD1-CE1 3.34Å
48	V	90.3	Very high	87.8	Confident	2 Å²	2	50.8 Å²	50.8	1%	0.012	27%	0.265	C	S	.	.	H	α-helix	trans	-61.7	-42.4	175.5	166.3	0	0	0	0	111.2	N44 L45 N46 L52 I71 H74 L75 I78	N44-V48 WeakPolarHBondContact O-CG2 3.21Å; N44-V48 PolarHBondContact O-N 3.44Å; L45-V48 WeakPolarHBondContact O-CB 3.44Å; L45-V48 PolarHBondContact O-N 3Å; N46-V48 PolarHBondContact O-N 3.47Å; V48-L52 HydrophobicContact CG1-CD1 3.76Å; V48-L52 VanDerWaalsContact O-CB 3.28Å; V48-L52 WeakPolarHBondContact O-CB 3.34Å; V48-L52 PolarHBondContact O-N 2.86Å; V48-I71 HydrophobicContact CG1-CG2 4.32Å; V48-H74 HydrophobicContact CG2-CB 3.42Å; V48-H74 VanDerWaalsContact CG2-CB 3.42Å; V48-L75 HydrophobicContact CG1-CD2 4.28Å; V48-L75 HydrophobicContact CG2-CD2 4.29Å; V48-L75 HydrophobicContact CG2-CG 4.42Å; V48-I78 HydrophobicContact CG2-CD1 4.3Å
49	V	87.6	Confident	88.1	Confident	39 Å²	39	55.1 Å²	55.1	24%	0.236	29%	0.292	C	S	.	.	H	α-helix	trans	-62	-48	177.7	172.4	0	0	0	0	110.6	L45 N46 L47 L52 N53 L284	L45-V49 HydrophobicContact CD1-CG2 4.44Å; L45-V49 HydrophobicContact CG-CG2 4.37Å; L45-V49 WeakPolarHBondContact O-CG2 3.47Å; L45-V49 PolarHBondContact O-N 3.3Å; N46-V49 PolarHBondContact O-N 3.45Å; L47-V49 VanDerWaalsContact C-N 3.34Å; L47-V49 PolarHBondContact O-N 3.49Å; V49-L52 PolarHBondContact O-N 3.13Å; V49-N53 PolarHBondContact O-N 2.93Å; V49-N53 VanDerWaalsContact O-N 3.11Å; V49-N53 PolarHBondContact O-ND2 3.06Å; V49-L284 HydrophobicContact CG1-CD1 4.37Å; V49-L284 HydrophobicContact CG2-CD1 4.15Å; V49-L284 HydrophobicContact CG2-CD2 3.8Å; V49-L284 HydrophobicContact CG2-CG 4.5Å
50	D	88.9	Confident	88.2	Confident	98 Å²	98	51.9 Å²	51.9	52%	0.524	28%	0.281	S	S	.	.	H	α-helix	trans	-62.5	-47.3	-179.7	-69.9	-19.4	0	0	0	111.4	N46 L47 L52 N53 E54	N46-D50 PolarHBondContact O-N 2.96Å; L47-D50 PolarHBondContact O-N 2.79Å; D50-L52 PolarHBondContact O-N 3.15Å; D50-N53 WeakPolarHBondContact O-CB 3.42Å; D50-N53 PolarHBondContact O-N 3.28Å; D50-N53 VanDerWaalsContact O-N 3.17Å; D50-E54 PolarHBondContact O-N 3.13Å
51	Q	92.3	Very high	88.3	Confident	22 Å²	22	51.7 Å²	51.7	10%	0.103	28%	0.283	C	S	.	.	H	α-helix	trans	-67	-33.5	178.3	-71	169.9	-6.2	0	0	112.9	L47 N53 E54 F55 I71 H74	L47-Q51 WeakPolarHBondContact O-CB 3.48Å; L47-Q51 VanDerWaalsContact O-CG 3.29Å; L47-Q51 WeakPolarHBondContact O-CG 3.25Å; L47-Q51 PolarHBondContact O-N 3.33Å; Q51-N53 VanDerWaalsContact C-N 3.31Å; Q51-E54 PolarHBondContact O-N 2.9Å; Q51-F55 VanDerWaalsContact O-CB 3.24Å; Q51-F55 WeakPolarHBondContact O-CB 3.42Å; Q51-F55 PolarHBondContact O-N 3.29Å; Q51-I71 HydrophobicContact CB-CD1 4.14Å; Q51-I71 HydrophobicContact CB-CG1 3.57Å; Q51-H74 PolarHBondContact NE2-CD2 3.06Å; Q51-H74 PolarHBondContact NE2-NE2 3.4Å; Q51-H74 VanDerWaalsContact NE2-NE2 3.13Å; Q51-H74 PolarHBondContact OE1-CD2 2.97Å
52	L	90	Very high	88.4	Confident	6 Å²	6	56.7 Å²	56.7	3%	0.031	31%	0.314	C	S	.	.	H	α-helix	trans	-63.7	-36.5	172.7	-98.6	156.1	0	0	0	112	V48 V49 D50 L56 I71 L107 L284	V48-L52 HydrophobicContact CG1-CD1 3.76Å; V48-L52 VanDerWaalsContact O-CB 3.28Å; V48-L52 WeakPolarHBondContact O-CB 3.34Å; V48-L52 PolarHBondContact O-N 2.86Å; V49-L52 PolarHBondContact O-N 3.13Å; D50-L52 PolarHBondContact O-N 3.15Å; L52-L56 PolarHBondContact O-N 3.19Å; L52-I71 HydrophobicContact CG-CD1 4.17Å; L52-L107 HydrophobicContact CD2-CD1 3.52Å; L52-L284 HydrophobicContact CD1-CD2 4.21Å
53	N	88.1	Confident	88.7	Confident	66 Å²	66	55.5 Å²	55.5	35%	0.353	31%	0.311	S	S	.	.	H	α-helix	trans	-68.3	-43	174.8	-71	-31.9	0	0	0	111.3	V49 D50 Q51 F55 L56 R280	V49-N53 PolarHBondContact O-N 2.93Å; V49-N53 VanDerWaalsContact O-N 3.11Å; V49-N53 PolarHBondContact O-ND2 3.06Å; D50-N53 WeakPolarHBondContact O-CB 3.42Å; D50-N53 PolarHBondContact O-N 3.28Å; D50-N53 VanDerWaalsContact O-N 3.17Å; Q51-N53 VanDerWaalsContact C-N 3.31Å; N53-F55 VanDerWaalsContact C-N 3.31Å; N53-F55 PolarHBondContact O-N 2.88Å; N53-L56 PolarHBondContact O-N 3.13Å; N53-R280 PolarHBondContact OD1-NH1 3.26Å
54	E	90.7	Very high	88.9	Confident	107 Å²	107	54.3 Å²	54.3	50%	0.5	30%	0.295	S	S	.	.	H	α-helix	trans	-64.4	-36.4	175.1	-161.6	-178.4	170	0	0	111.7	D50 Q51 L56 Q57 A58 L67	D50-E54 PolarHBondContact O-N 3.13Å; Q51-E54 PolarHBondContact O-N 2.9Å; E54-L56 VanDerWaalsContact C-N 3.33Å; E54-L56 PolarHBondContact O-N 3.48Å; E54-Q57 CarbonylContact O-C 3.51Å; E54-Q57 WeakPolarHBondContact O-CA 3.41Å; E54-Q57 PolarHBondContact O-N 2.8Å; E54-A58 PolarHBondContact O-N 3.26Å; E54-A58 VanDerWaalsContact O-N 3.12Å; E54-L67 HydrophobicContact CB-CD1 4.05Å; E54-L67 HydrophobicContact CB-CD2 4.11Å; E54-L67 HydrophobicContact CG-CD1 3.79Å; E54-L67 HydrophobicContact CG-CD2 4.1Å; E54-L67 WeakPolarHBondContact OE2-CD2 3.47Å
55	F	91.9	Very high	89.1	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-60.2	-39.8	179.8	-175.2	-105.9	0	0	0	112.7	Q51 N53 Q57 A58 R64 L67 R68 I71 L104 L107 D108 L111	Q51-F55 VanDerWaalsContact O-CB 3.24Å; Q51-F55 WeakPolarHBondContact O-CB 3.42Å; Q51-F55 PolarHBondContact O-N 3.29Å; N53-F55 VanDerWaalsContact C-N 3.31Å; N53-F55 PolarHBondContact O-N 2.88Å; F55-Q57 PolarHBondContact O-N 3.3Å; F55-A58 WeakPolarHBondContact O-CB 3.22Å; F55-A58 PolarHBondContact O-N 3.44Å; F55-R64 HydrophobicContact CD2-CG 4.08Å; F55-R64 HydrophobicContact CE2-CB 4.33Å; F55-R64 HydrophobicContact CE2-CG 3.29Å; F55-R64 VanDerWaalsContact CE2-O 3.24Å; F55-R64 WeakPolarHBondContact CE2-O 3.34Å; F55-R64 HydrophobicContact CZ-CG 3.61Å; F55-L67 HydrophobicContact CB-CB 4.38Å; F55-L67 HydrophobicContact CB-CD1 4.48Å; F55-L67 HydrophobicContact CD2-CB 3.78Å; F55-R68 HydrophobicContact CE2-CB 3.84Å; F55-R68 HydrophobicContact CZ-CB 4.48Å; F55-I71 HydrophobicContact CB-CD1 4.07Å; F55-I71 HydrophobicContact CD2-CD1 4.42Å; F55-I71 HydrophobicContact CG-CD1 4.27Å; F55-L104 HydrophobicContact CD1-CD1 4.33Å; F55-L104 HydrophobicContact CE1-CD1 4.06Å; F55-L104 HydrophobicContact CZ-CD1 4.17Å; F55-L107 HydrophobicContact CD1-CB 4.29Å; F55-L107 HydrophobicContact CE1-CB 3.86Å; F55-D108 HydrophobicContact CE1-CB 4.37Å; F55-D108 HydrophobicContact CZ-CB 3.84Å; F55-L111 HydrophobicContact CD1-CD1 3.56Å; F55-L111 HydrophobicContact CE1-CD1 3.42Å; F55-L111 VanDerWaalsContact CE1-CD1 3.42Å; F55-L111 HydrophobicContact CG-CD1 4.28Å; F55-L111 HydrophobicContact CZ-CD1 4.01Å; F55-L111 VanDerWaalsContact O-CD1 3.25Å; F55-L111 WeakPolarHBondContact O-CD1 3.23Å
56	L	86.4	Confident	89.4	Confident	42 Å²	42	61.7 Å²	61.7	22%	0.22	33%	0.331	C	S	.	.	H	α-helix	trans	-65.8	-25.9	174.9	-77	174.6	0	0	0	113.5	L52 N53 E54 L107 L273 R280	L52-L56 PolarHBondContact O-N 3.19Å; N53-L56 PolarHBondContact O-N 3.13Å; E54-L56 VanDerWaalsContact C-N 3.33Å; E54-L56 PolarHBondContact O-N 3.48Å; L56-L107 HydrophobicContact CD2-CD2 3.7Å; L56-L273 HydrophobicContact CD2-CD1 3.86Å; L56-R280 VanDerWaalsContact CD1-CZ 3.46Å
57	Q	86.9	Confident	89.7	Confident	161 Å²	161	57.7 Å²	57.7	75%	0.752	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	9.3	-178.9	-60.9	-176.9	3.4	0	0	112.5	E54 F55	E54-Q57 CarbonylContact O-C 3.51Å; E54-Q57 WeakPolarHBondContact O-CA 3.41Å; E54-Q57 PolarHBondContact O-N 2.8Å; F55-Q57 PolarHBondContact O-N 3.3Å
58	A	88.9	Confident	89.8	Confident	10 Å²	10	58.5 Å²	58.5	8%	0.083	31%	0.307	C	S	.	.			trans	-54.3	127.3	-178.8	0	0	0	0	0	110.2	E54 F55 V63 R64 F115	E54-A58 PolarHBondContact O-N 3.26Å; E54-A58 VanDerWaalsContact O-N 3.12Å; F55-A58 WeakPolarHBondContact O-CB 3.22Å; F55-A58 PolarHBondContact O-N 3.44Å; A58-V63 HydrophobicContact CB-CB 4.46Å; A58-V63 HydrophobicContact CB-CG1 4.21Å; A58-R64 HydrophobicContact CB-CB 4.04Å; A58-F115 VanDerWaalsContact O-CZ 3.22Å; A58-F115 WeakPolarHBondContact O-CZ 3.49Å
59	P	84.6	Confident	90	Very high	96 Å²	96	62 Å²	62	62%	0.623	33%	0.328	S	S	*	.	S	Bend	trans	-78	-22.2	-176.5	28.6	-35.4	0	0	0	113	V63	P59-V63 HydrophobicContact CG-CB 4.36Å; P59-V63 HydrophobicContact CG-CG2 4.04Å
60	N	85.1	Confident	90.3	Very high	72 Å²	72	62.9 Å²	62.9	39%	0.385	33%	0.33	S	S	.	.	S	Bend	trans	-155.7	171.6	-176	60.7	51.3	0	0	0	111.9	T62 V63 R64	N60-T62 VanDerWaalsContact C-N 3.3Å; N60-T62 PolarHBondContact O-N 3Å; N60-T62 WeakPolarHBondContact OD1-CB 3.42Å; N60-T62 PolarHBondContact OD1-N 3.33Å; N60-T62 VanDerWaalsContact OD1-N 3.12Å; N60-V63 PolarHBondContact O-N 2.97Å; N60-V63 PolarHBondContact OD1-N 2.99Å; N60-R64 PolarHBondContact O-N 2.81Å; N60-R64 VanDerWaalsContact O-N 3.13Å
61	T	87.7	Confident	90.6	Very high	61 Å²	61	58.2 Å²	58.2	37%	0.374	31%	0.305	S	S	.	.	H	α-helix	trans	-59.2	-35.1	-179.3	-57.7	0	0	0	0	113.4	R64 L65	T61-R64 PolarHBondContact O-N 2.86Å; T61-L65 HydrophobicContact CG2-CD1 4.08Å; T61-L65 HydrophobicContact CG2-CG 4.41Å; T61-L65 WeakPolarHBondContact O-CG 3.44Å; T61-L65 PolarHBondContact O-N 2.74Å
62	T	89.5	Confident	90.7	Very high	106 Å²	106	59.9 Å²	59.9	65%	0.65	31%	0.314	S	S	*	.	H	α-helix	trans	-65.3	-49.2	-179.4	-53.1	0	0	0	0	111.6	N60 R64 L65 Q66	N60-T62 VanDerWaalsContact C-N 3.3Å; N60-T62 PolarHBondContact O-N 3Å; N60-T62 WeakPolarHBondContact OD1-CB 3.42Å; N60-T62 PolarHBondContact OD1-N 3.33Å; N60-T62 VanDerWaalsContact OD1-N 3.12Å; T62-R64 VanDerWaalsContact C-N 3.34Å; T62-R64 PolarHBondContact O-N 3.25Å; T62-L65 PolarHBondContact O-N 3.09Å; T62-Q66 PolarHBondContact O-N 3.31Å
63	V	91.3	Very high	90.9	Very high	39 Å²	39	64.7 Å²	64.7	24%	0.236	34%	0.336	C	S	.	.	H	α-helix	trans	-64.4	-40.7	178.1	176.7	0	0	0	0	110.7	A58 P59 N60 L65 Q66 L67	A58-V63 HydrophobicContact CB-CB 4.46Å; A58-V63 HydrophobicContact CB-CG1 4.21Å; P59-V63 HydrophobicContact CG-CB 4.36Å; P59-V63 HydrophobicContact CG-CG2 4.04Å; N60-V63 PolarHBondContact O-N 2.97Å; N60-V63 PolarHBondContact OD1-N 2.99Å; V63-L65 PolarHBondContact O-N 2.97Å; V63-Q66 PolarHBondContact O-N 3.17Å; V63-L67 HydrophobicContact CG1-CD1 3.7Å; V63-L67 HydrophobicContact CG1-CG 4.34Å; V63-L67 WeakPolarHBondContact O-CB 3.4Å; V63-L67 WeakPolarHBondContact O-CG 3.14Å; V63-L67 PolarHBondContact O-N 3.42Å
64	R	92.5	Very high	91.1	Very high	12 Å²	12	63.2 Å²	63.2	5%	0.045	33%	0.327	C	S	.	.	H	α-helix	trans	-55.3	-51.5	174	-170.3	-173.3	82.6	-130.3	0.3	111.2	F55 A58 N60 T61 T62 Q66 L67 R68 D108	F55-R64 HydrophobicContact CD2-CG 4.08Å; F55-R64 HydrophobicContact CE2-CB 4.33Å; F55-R64 HydrophobicContact CE2-CG 3.29Å; F55-R64 VanDerWaalsContact CE2-O 3.24Å; F55-R64 WeakPolarHBondContact CE2-O 3.34Å; F55-R64 HydrophobicContact CZ-CG 3.61Å; A58-R64 HydrophobicContact CB-CB 4.04Å; N60-R64 PolarHBondContact O-N 2.81Å; N60-R64 VanDerWaalsContact O-N 3.13Å; T61-R64 PolarHBondContact O-N 2.86Å; T62-R64 VanDerWaalsContact C-N 3.34Å; T62-R64 PolarHBondContact O-N 3.25Å; R64-Q66 VanDerWaalsContact C-N 3.35Å; R64-Q66 PolarHBondContact O-N 3.01Å; R64-L67 PolarHBondContact O-N 3.43Å; R64-R68 WeakPolarHBondContact O-CB 3.46Å; R64-R68 PolarHBondContact O-N 3.46Å; R64-D108 WeakPolarHBondContact CD-OD1 3.31Å; R64-D108 IonicContact CZ-OD1 2.68Å; R64-D108 IonicContact NE-OD1 2.74Å; R64-D108 PolarHBondContact NE-OD1 2.8Å; R64-D108 IonicContact NH2-OD1 3.28Å
65	L	92.6	Very high	91.3	Very high	77 Å²	77	58.2 Å²	58.2	40%	0.403	30%	0.304	S	S	.	.	H	α-helix	trans	-62.7	-40.3	-179.1	-72.5	172.8	0	0	0	112.4	T61 T62 V63 R68 T69	T61-L65 HydrophobicContact CG2-CD1 4.08Å; T61-L65 HydrophobicContact CG2-CG 4.41Å; T61-L65 WeakPolarHBondContact O-CG 3.44Å; T61-L65 PolarHBondContact O-N 2.74Å; T62-L65 PolarHBondContact O-N 3.09Å; V63-L65 PolarHBondContact O-N 2.97Å; L65-R68 PolarHBondContact O-N 2.79Å; L65-T69 PolarHBondContact O-N 3.22Å; L65-T69 VanDerWaalsContact O-N 3.09Å; L65-T69 PolarHBondContact O-OG1 2.97Å
66	Q	93.3	Very high	91.3	Very high	114 Å²	114	61.2 Å²	61.2	53%	0.533	32%	0.32	S	S	.	.	H	α-helix	trans	-61.8	-50.4	176.7	-179.7	179.5	-28.1	0	0	111.9	T62 V63 R64 R68 T69 Q70	T62-Q66 PolarHBondContact O-N 3.31Å; V63-Q66 PolarHBondContact O-N 3.17Å; R64-Q66 VanDerWaalsContact C-N 3.35Å; R64-Q66 PolarHBondContact O-N 3.01Å; Q66-R68 VanDerWaalsContact C-N 3.34Å; Q66-R68 PolarHBondContact O-N 3.34Å; Q66-T69 PolarHBondContact O-N 3.19Å; Q66-Q70 WeakPolarHBondContact O-CG 3.22Å; Q66-Q70 PolarHBondContact O-N 2.92Å
67	L	93.5	Very high	91.6	Very high	3 Å²	3	60.8 Å²	60.8	2%	0.016	32%	0.319	C	S	.	.	H	α-helix	trans	-63.1	-40.3	179.2	-74.4	167.4	0	0	0	111.6	E54 F55 V63 R64 T69 Q70 I71	E54-L67 HydrophobicContact CB-CD1 4.05Å; E54-L67 HydrophobicContact CB-CD2 4.11Å; E54-L67 HydrophobicContact CG-CD1 3.79Å; E54-L67 HydrophobicContact CG-CD2 4.1Å; E54-L67 WeakPolarHBondContact OE2-CD2 3.47Å; F55-L67 HydrophobicContact CB-CB 4.38Å; F55-L67 HydrophobicContact CB-CD1 4.48Å; F55-L67 HydrophobicContact CD2-CB 3.78Å; V63-L67 HydrophobicContact CG1-CD1 3.7Å; V63-L67 HydrophobicContact CG1-CG 4.34Å; V63-L67 WeakPolarHBondContact O-CB 3.4Å; V63-L67 WeakPolarHBondContact O-CG 3.14Å; V63-L67 PolarHBondContact O-N 3.42Å; R64-L67 PolarHBondContact O-N 3.43Å; L67-T69 VanDerWaalsContact C-N 3.31Å; L67-T69 PolarHBondContact O-N 3.23Å; L67-Q70 PolarHBondContact O-N 2.91Å; L67-I71 WeakPolarHBondContact O-CD1 3.48Å; L67-I71 VanDerWaalsContact O-CG1 3.26Å; L67-I71 WeakPolarHBondContact O-CG1 3.18Å; L67-I71 PolarHBondContact O-N 3.32Å
68	R	94	Very high	91.8	Very high	95 Å²	95	53.1 Å²	53.1	36%	0.358	28%	0.283	S	S	.	.	H	α-helix	trans	-55.5	-46.7	173	-179.7	178.6	172.8	-126.2	-0.7	111.6	F55 R64 L65 Q66 I72 L104 D108	F55-R68 HydrophobicContact CE2-CB 3.84Å; F55-R68 HydrophobicContact CZ-CB 4.48Å; R64-R68 WeakPolarHBondContact O-CB 3.46Å; R64-R68 PolarHBondContact O-N 3.46Å; L65-R68 PolarHBondContact O-N 2.79Å; Q66-R68 VanDerWaalsContact C-N 3.34Å; Q66-R68 PolarHBondContact O-N 3.34Å; R68-I72 HydrophobicContact CG-CD1 4.01Å; R68-I72 VanDerWaalsContact O-CG1 3.28Å; R68-I72 WeakPolarHBondContact O-CG1 3.49Å; R68-I72 PolarHBondContact O-N 3.16Å; R68-I72 VanDerWaalsContact O-N 3.11Å; R68-L104 HydrophobicContact CG-CD2 4.2Å; R68-L104 HydrophobicContact CG-CG 4.46Å; R68-D108 IonicContact CZ-OD2 3.42Å; R68-D108 IonicContact NE-OD2 2.8Å
69	T	94.3	Very high	91.9	Very high	75 Å²	75	56.1 Å²	56.1	46%	0.46	30%	0.296	S	S	.	.	H	α-helix	trans	-63.4	-42.7	178.7	-61.8	0	0	0	0	111.8	L65 Q66 L67 I72 Q73	L65-T69 PolarHBondContact O-N 3.22Å; L65-T69 VanDerWaalsContact O-N 3.09Å; L65-T69 PolarHBondContact O-OG1 2.97Å; Q66-T69 PolarHBondContact O-N 3.19Å; L67-T69 VanDerWaalsContact C-N 3.31Å; L67-T69 PolarHBondContact O-N 3.23Å; T69-I72 PolarHBondContact O-N 3.35Å; T69-Q73 WeakPolarHBondContact O-CG 3.4Å; T69-Q73 PolarHBondContact O-N 3.46Å
70	Q	94.3	Very high	92.2	Very high	58 Å²	58	59 Å²	59	27%	0.271	29%	0.294	S	S	.	.	H	α-helix	trans	-62.9	-47	177.9	-70.1	176.5	-18.7	0	0	111.9	Q66 L67 I72 Q73 H74	Q66-Q70 WeakPolarHBondContact O-CG 3.22Å; Q66-Q70 PolarHBondContact O-N 2.92Å; L67-Q70 PolarHBondContact O-N 2.91Å; Q70-I72 VanDerWaalsContact C-N 3.31Å; Q70-I72 PolarHBondContact O-N 3.05Å; Q70-Q73 WeakPolarHBondContact O-CB 3.45Å; Q70-Q73 PolarHBondContact O-N 3.37Å; Q70-Q73 VanDerWaalsContact O-N 3.1Å; Q70-H74 PolarHBondContact O-CD2 2.86Å; Q70-H74 PolarHBondContact O-N 2.77Å
71	I	93.9	Very high	92.3	Very high	1 Å²	1	57.3 Å²	57.3	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-58.4	-45.3	178.3	-65.5	161.6	0	0	0	110.4	V48 Q51 L52 F55 L67 Q73 H74 L75 L104	V48-I71 HydrophobicContact CG1-CG2 4.32Å; Q51-I71 HydrophobicContact CB-CD1 4.14Å; Q51-I71 HydrophobicContact CB-CG1 3.57Å; L52-I71 HydrophobicContact CG-CD1 4.17Å; F55-I71 HydrophobicContact CB-CD1 4.07Å; F55-I71 HydrophobicContact CD2-CD1 4.42Å; F55-I71 HydrophobicContact CG-CD1 4.27Å; L67-I71 WeakPolarHBondContact O-CD1 3.48Å; L67-I71 VanDerWaalsContact O-CG1 3.26Å; L67-I71 WeakPolarHBondContact O-CG1 3.18Å; L67-I71 PolarHBondContact O-N 3.32Å; I71-Q73 VanDerWaalsContact C-N 3.34Å; I71-Q73 PolarHBondContact O-N 3.43Å; I71-H74 PolarHBondContact O-N 3.05Å; I71-L75 HydrophobicContact CG2-CD1 4.03Å; I71-L75 HydrophobicContact CG2-CG 4.37Å; I71-L75 VanDerWaalsContact O-CG 3.32Å; I71-L75 WeakPolarHBondContact O-CG 3.48Å; I71-L75 PolarHBondContact O-N 3.07Å; I71-L104 HydrophobicContact CB-CD2 4.15Å; I71-L104 HydrophobicContact CD1-CD1 3.86Å; I71-L104 HydrophobicContact CG2-CD1 4.29Å; I71-L104 HydrophobicContact CG2-CD2 3.83Å
72	I	94.5	Very high	92.3	Very high	56 Å²	56	54.4 Å²	54.4	29%	0.287	27%	0.267	S	S	.	.	H	α-helix	trans	-59.9	-43.8	177.1	-68.5	168.2	0	0	0	111.1	R68 T69 Q70 H74 L75 D76 L104	R68-I72 HydrophobicContact CG-CD1 4.01Å; R68-I72 VanDerWaalsContact O-CG1 3.28Å; R68-I72 WeakPolarHBondContact O-CG1 3.49Å; R68-I72 PolarHBondContact O-N 3.16Å; R68-I72 VanDerWaalsContact O-N 3.11Å; T69-I72 PolarHBondContact O-N 3.35Å; Q70-I72 VanDerWaalsContact C-N 3.31Å; Q70-I72 PolarHBondContact O-N 3.05Å; I72-H74 VanDerWaalsContact C-N 3.34Å; I72-H74 PolarHBondContact O-N 3.08Å; I72-L75 PolarHBondContact O-N 3.43Å; I72-D76 WeakPolarHBondContact O-CB 3.15Å; I72-D76 VanDerWaalsContact O-CG 3.24Å; I72-D76 PolarHBondContact O-N 2.93Å; I72-L104 HydrophobicContact CD1-CD2 4.16Å; I72-L104 HydrophobicContact CG1-CD2 3.6Å
73	Q	94.6	Very high	91.9	Very high	108 Å²	108	57.7 Å²	57.7	51%	0.505	27%	0.267	S	S	.	.	H	α-helix	trans	-61.8	-38.9	178.5	-72.9	172.1	-6.9	0	0	113	T69 Q70 I71 T77	T69-Q73 WeakPolarHBondContact O-CG 3.4Å; T69-Q73 PolarHBondContact O-N 3.46Å; Q70-Q73 WeakPolarHBondContact O-CB 3.45Å; Q70-Q73 PolarHBondContact O-N 3.37Å; Q70-Q73 VanDerWaalsContact O-N 3.1Å; I71-Q73 VanDerWaalsContact C-N 3.34Å; I71-Q73 PolarHBondContact O-N 3.43Å; Q73-T77 WeakPolarHBondContact O-CB 3.29Å; Q73-T77 PolarHBondContact O-N 3.35Å; Q73-T77 PolarHBondContact O-OG1 3.39Å
74	H	93.3	Very high	91.2	Very high	35 Å²	35	57.4 Å²	57.4	16%	0.162	27%	0.272	C	S	.	.	H	α-helix	trans	-70.7	-40.3	175.5	-71	-67.4	0	0	0	112	N44 L47 V48 Q51 Q70 I71 I72 D76 T77 I78	N44-H74 PolarHBondContact OD1-ND1 3.25Å; N44-H74 VanDerWaalsContact OD1-ND1 3.1Å; L47-H74 VanDerWaalsContact CD1-CE1 3.49Å; L47-H74 WeakPolarHBondContact CD1-CE1 3.34Å; V48-H74 HydrophobicContact CG2-CB 3.42Å; V48-H74 VanDerWaalsContact CG2-CB 3.42Å; Q51-H74 PolarHBondContact NE2-CD2 3.06Å; Q51-H74 PolarHBondContact NE2-NE2 3.4Å; Q51-H74 VanDerWaalsContact NE2-NE2 3.13Å; Q51-H74 PolarHBondContact OE1-CD2 2.97Å; Q70-H74 PolarHBondContact O-CD2 2.86Å; Q70-H74 PolarHBondContact O-N 2.77Å; I71-H74 PolarHBondContact O-N 3.05Å; I72-H74 VanDerWaalsContact C-N 3.34Å; I72-H74 PolarHBondContact O-N 3.08Å; H74-D76 VanDerWaalsContact C-N 3.32Å; H74-D76 PolarHBondContact O-N 3.45Å; H74-T77 WeakPolarHBondContact O-CB 3.44Å; H74-T77 PolarHBondContact O-N 3.47Å; H74-T77 VanDerWaalsContact O-N 3.14Å; H74-I78 WeakPolarHBondContact O-CG1 3.48Å; H74-I78 PolarHBondContact O-N 3.01Å
75	L	93.3	Very high	90.5	Very high	1 Å²	1	57.6 Å²	57.6	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-60	-41.5	172.8	-68.4	174.8	0	0	0	111.8	V48 I71 I72 T77 I78 E79 L97 R101	V48-L75 HydrophobicContact CG1-CD2 4.28Å; V48-L75 HydrophobicContact CG2-CD2 4.29Å; V48-L75 HydrophobicContact CG2-CG 4.42Å; I71-L75 HydrophobicContact CG2-CD1 4.03Å; I71-L75 HydrophobicContact CG2-CG 4.37Å; I71-L75 VanDerWaalsContact O-CG 3.32Å; I71-L75 WeakPolarHBondContact O-CG 3.48Å; I71-L75 PolarHBondContact O-N 3.07Å; I72-L75 PolarHBondContact O-N 3.43Å; L75-T77 VanDerWaalsContact C-N 3.31Å; L75-T77 PolarHBondContact O-N 2.53Å; L75-I78 PolarHBondContact O-N 2.82Å; L75-E79 PolarHBondContact O-N 3.42Å; L75-L97 HydrophobicContact CB-CD2 4.32Å; L75-L97 HydrophobicContact CD2-CD2 3.7Å; L75-R101 HydrophobicContact CD1-CG 3.94Å
76	D	93.4	Very high	89.8	Confident	64 Å²	64	55.3 Å²	55.3	34%	0.342	26%	0.264	S	S	.	.	H	α-helix	trans	-66.4	-33.7	175.4	-69.1	-13.2	0	0	0	112.1	I72 H74 E79 R80 R101	I72-D76 WeakPolarHBondContact O-CB 3.15Å; I72-D76 VanDerWaalsContact O-CG 3.24Å; I72-D76 PolarHBondContact O-N 2.93Å; H74-D76 VanDerWaalsContact C-N 3.32Å; H74-D76 PolarHBondContact O-N 3.45Å; D76-E79 PolarHBondContact O-N 3.49Å; D76-R80 WeakPolarHBondContact O-CG 3.47Å; D76-R80 PolarHBondContact O-N 3.01Å; D76-R101 IonicContact OD1-CZ 3.06Å; D76-R101 IonicContact OD1-NE 2.68Å; D76-R101 IonicContact OD1-NH2 3.62Å; D76-R101 PolarHBondContact OD1-NH2 2.68Å
77	T	92.7	Very high	89.3	Confident	33 Å²	33	54.4 Å²	54.4	20%	0.202	27%	0.271	C	S	.	.	H	α-helix	trans	-69.1	-43.6	175.5	-61.2	0	0	0	0	111.1	Q73 H74 L75 E79 R80 L81	Q73-T77 WeakPolarHBondContact O-CB 3.29Å; Q73-T77 PolarHBondContact O-N 3.35Å; Q73-T77 PolarHBondContact O-OG1 3.39Å; H74-T77 WeakPolarHBondContact O-CB 3.44Å; H74-T77 PolarHBondContact O-N 3.47Å; H74-T77 VanDerWaalsContact O-N 3.14Å; L75-T77 VanDerWaalsContact C-N 3.31Å; L75-T77 PolarHBondContact O-N 2.53Å; T77-E79 VanDerWaalsContact C-N 3.31Å; T77-E79 PolarHBondContact O-N 2.89Å; T77-R80 PolarHBondContact O-N 2.78Å; T77-R80 PolarHBondContact OG1-NH2 2.87Å; T77-L81 HydrophobicContact CG2-CD1 4.08Å; T77-L81 VanDerWaalsContact O-CG 3.3Å; T77-L81 WeakPolarHBondContact O-CG 3.41Å; T77-L81 PolarHBondContact O-N 3.14Å
78	I	90.7	Very high	88.8	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-58.7	-44.3	171.9	-67.9	166.1	0	0	0	110.5	I41 N44 V48 H74 L75 R80 L81 S82 L93 L97 F287	I41-I78 HydrophobicContact CG1-CG2 4.42Å; I41-I78 HydrophobicContact CG2-CG1 4.49Å; I41-I78 HydrophobicContact CG2-CG2 3.91Å; N44-I78 HydrophobicContact CB-CD1 3.93Å; N44-I78 HydrophobicContact CB-CG1 3.54Å; V48-I78 HydrophobicContact CG2-CD1 4.3Å; H74-I78 WeakPolarHBondContact O-CG1 3.48Å; H74-I78 PolarHBondContact O-N 3.01Å; L75-I78 PolarHBondContact O-N 2.82Å; I78-R80 VanDerWaalsContact C-N 3.32Å; I78-R80 PolarHBondContact O-N 2.8Å; I78-L81 PolarHBondContact O-N 2.78Å; I78-S82 PolarHBondContact O-N 3.19Å; I78-L93 HydrophobicContact CG2-CD1 4.35Å; I78-L93 HydrophobicContact CG2-CD2 3.91Å; I78-L93 HydrophobicContact CG2-CG 4.36Å; I78-L97 HydrophobicContact CB-CD2 4.15Å; I78-L97 HydrophobicContact CG2-CD1 4.19Å; I78-L97 HydrophobicContact CG2-CD2 3.8Å; I78-L97 HydrophobicContact CG2-CG 4.38Å; I78-F287 HydrophobicContact CD1-CZ 4.14Å; I78-F287 HydrophobicContact CG2-CZ 4.04Å
79	E	91.2	Very high	88.1	Confident	73 Å²	73	59.7 Å²	59.7	34%	0.341	29%	0.292	S	S	.	.	H	α-helix	trans	-61.3	-40	177.5	-166.9	176	157.4	0	0	112.1	L75 D76 T77 S82 L97 R101	L75-E79 PolarHBondContact O-N 3.42Å; D76-E79 PolarHBondContact O-N 3.49Å; T77-E79 VanDerWaalsContact C-N 3.31Å; T77-E79 PolarHBondContact O-N 2.89Å; E79-S82 WeakPolarHBondContact O-CB 3.47Å; E79-S82 PolarHBondContact O-N 3.22Å; E79-S82 PolarHBondContact O-OG 3.33Å; E79-L97 HydrophobicContact CB-CD1 3.8Å; E79-L97 HydrophobicContact CG-CD1 4.11Å; E79-R101 IonicContact OE2-CZ 2.7Å; E79-R101 VanDerWaalsContact OE2-CZ 3.23Å; E79-R101 IonicContact OE2-NH1 3.33Å; E79-R101 PolarHBondContact OE2-NH1 3.05Å; E79-R101 IonicContact OE2-NH2 3.71Å; E79-R101 PolarHBondContact OE2-NH2 3.23Å
80	R	90.8	Very high	87.7	Confident	155 Å²	155	60.9 Å²	60.9	59%	0.585	29%	0.288	S	S	*	.	H	α-helix	trans	-65.9	-43.4	175.5	-74.6	-176.7	-65.9	164	1.5	112.2	D76 T77 I78 S82 R83	D76-R80 WeakPolarHBondContact O-CG 3.47Å; D76-R80 PolarHBondContact O-N 3.01Å; T77-R80 PolarHBondContact O-N 2.78Å; T77-R80 PolarHBondContact OG1-NH2 2.87Å; I78-R80 VanDerWaalsContact C-N 3.32Å; I78-R80 PolarHBondContact O-N 2.8Å; R80-S82 VanDerWaalsContact C-N 3.28Å; R80-S82 PolarHBondContact O-N 3.11Å; R80-R83 WeakPolarHBondContact O-CB 3.34Å; R80-R83 WeakPolarHBondContact O-CG 3.34Å; R80-R83 PolarHBondContact O-N 3Å
81	L	87.9	Confident	87.3	Confident	38 Å²	38	64.7 Å²	64.7	20%	0.199	31%	0.306	C	S	.	.	H	α-helix	trans	-66.4	-30.8	178	-68.1	168.1	0	0	0	112.2	L40 I41 T77 I78 R83 G84	L40-L81 HydrophobicContact CB-CD1 3.6Å; L40-L81 HydrophobicContact CB-CD2 4.07Å; L40-L81 HydrophobicContact CB-CG 4.45Å; L40-L81 HydrophobicContact CD1-CD2 3.75Å; I41-L81 HydrophobicContact CD1-CB 4.08Å; I41-L81 HydrophobicContact CG1-CB 3.64Å; I41-L81 HydrophobicContact CG1-CD1 4.15Å; T77-L81 HydrophobicContact CG2-CD1 4.08Å; T77-L81 VanDerWaalsContact O-CG 3.3Å; T77-L81 WeakPolarHBondContact O-CG 3.41Å; T77-L81 PolarHBondContact O-N 3.14Å; I78-L81 PolarHBondContact O-N 2.78Å; L81-R83 PolarHBondContact O-N 3.38Å; L81-G84 PolarHBondContact O-N 3.37Å
82	S	85.9	Confident	86.9	Confident	0 Å²	0	69 Å²	69	0%	0	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-56.8	-20.4	175.9	83.7	0	0	0	0	114.2	I78 E79 R80 G84 L85	I78-S82 PolarHBondContact O-N 3.19Å; E79-S82 WeakPolarHBondContact O-CB 3.47Å; E79-S82 PolarHBondContact O-N 3.22Å; E79-S82 PolarHBondContact O-OG 3.33Å; R80-S82 VanDerWaalsContact C-N 3.28Å; R80-S82 PolarHBondContact O-N 3.11Å; S82-G84 PolarHBondContact O-N 2.75Å; S82-L85 WeakPolarHBondContact O-CB 3.29Å; S82-L85 PolarHBondContact O-N 2.71Å; S82-L85 VanDerWaalsContact O-N 3.07Å
83	R	83	Confident	86.6	Confident	175 Å²	175	66.4 Å²	66.4	66%	0.66	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-62.8	-24.2	176.8	-64	-177.9	-180	-178.1	0.9	112.9	R80 L81	R80-R83 WeakPolarHBondContact O-CB 3.34Å; R80-R83 WeakPolarHBondContact O-CG 3.34Å; R80-R83 PolarHBondContact O-N 3Å; L81-R83 PolarHBondContact O-N 3.38Å
84	G	76.4	Confident	86.3	Confident	32 Å²	32	64 Å²	64	33%	0.33	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-82.1	-11.5	175.2	0	0	0	0	0	114.4	R34 L81 S82	R34-G84 VanDerWaalsContact CG-O 3.26Å; R34-G84 WeakPolarHBondContact CG-O 3.44Å; L81-G84 PolarHBondContact O-N 3.37Å; S82-G84 PolarHBondContact O-N 2.75Å
85	L	77.4	Confident	86.2	Confident	16 Å²	16	66 Å²	66	8%	0.084	32%	0.32	C	S	.	.	S	Bend	trans	-83.5	166.7	178.5	-58.7	-179.6	0	0	0	111.6	I41 S82 E89 L93	I41-L85 HydrophobicContact CD1-CD1 3.67Å; I41-L85 HydrophobicContact CD1-CG 4.17Å; S82-L85 WeakPolarHBondContact O-CB 3.29Å; S82-L85 PolarHBondContact O-N 2.71Å; S82-L85 VanDerWaalsContact O-N 3.07Å; L85-E89 HydrophobicContact CB-CB 4.08Å; L85-E89 HydrophobicContact CD1-CB 4.4Å; L85-L93 HydrophobicContact CD1-CD2 4.14Å
86	S	77.5	Confident	85.9	Confident	29 Å²	29	66.6 Å²	66.6	20%	0.203	32%	0.323	C	S	.	.			trans	-63.3	159.5	173.8	72.3	0	0	0	0	111.5	R88 E89 R90	S86-R88 PolarHBondContact O-N 3.06Å; S86-E89 VanDerWaalsContact CB-OE2 3.24Å; S86-E89 WeakPolarHBondContact CB-OE2 3.38Å; S86-E89 PolarHBondContact N-OE2 3.02Å; S86-E89 PolarHBondContact O-N 3.12Å; S86-E89 WeakPolarHBondContact OG-CG 3.41Å; S86-E89 PolarHBondContact OG-N 3.35Å; S86-E89 PolarHBondContact OG-OE2 2.97Å; S86-R90 VanDerWaalsContact O-CB 3.27Å; S86-R90 WeakPolarHBondContact O-CB 3.49Å; S86-R90 PolarHBondContact O-N 3.15Å
87	S	82.6	Confident	85.8	Confident	96 Å²	96	63.6 Å²	63.6	67%	0.671	31%	0.307	S	S	*	.	H	α-helix	trans	-56.3	-38.5	-179.8	54.8	0	0	0	0	113	Q91	S87-Q91 WeakPolarHBondContact O-CG 3.18Å; S87-Q91 PolarHBondContact O-N 3.34Å
88	R	83.2	Confident	85.7	Confident	179 Å²	179	68.1 Å²	68.1	68%	0.675	33%	0.325	S	S	*	.	H	α-helix	trans	-69	-46.7	179.4	-174.6	178.8	-179.1	169.2	1	112.1	S86 R90 Q91 Q92	S86-R88 PolarHBondContact O-N 3.06Å; R88-R90 VanDerWaalsContact C-N 3.33Å; R88-Q91 PolarHBondContact O-N 3.31Å; R88-Q92 WeakPolarHBondContact O-CG 3.44Å; R88-Q92 PolarHBondContact O-N 2.96Å; R88-Q92 VanDerWaalsContact O-N 3.11Å
89	E	79.9	Confident	85.7	Confident	30 Å²	30	70.4 Å²	70.4	14%	0.14	34%	0.338	C	S	.	.	H	α-helix	trans	-66	-41.2	179.3	-65.3	157.9	162.5	0	0	110.5	L85 S86 Q91 Q92 L93 Q294	L85-E89 HydrophobicContact CB-CB 4.08Å; L85-E89 HydrophobicContact CD1-CB 4.4Å; S86-E89 VanDerWaalsContact CB-OE2 3.24Å; S86-E89 WeakPolarHBondContact CB-OE2 3.38Å; S86-E89 PolarHBondContact N-OE2 3.02Å; S86-E89 PolarHBondContact O-N 3.12Å; S86-E89 WeakPolarHBondContact OG-CG 3.41Å; S86-E89 PolarHBondContact OG-N 3.35Å; S86-E89 PolarHBondContact OG-OE2 2.97Å; E89-Q91 VanDerWaalsContact C-N 3.34Å; E89-Q91 PolarHBondContact O-N 2.91Å; E89-Q92 PolarHBondContact O-N 3.49Å; E89-L93 WeakPolarHBondContact O-CB 3.25Å; E89-L93 PolarHBondContact O-N 3.28Å; E89-Q294 VanDerWaalsContact CD-CD 3.47Å; E89-Q294 VanDerWaalsContact CG-OE1 3.25Å; E89-Q294 VanDerWaalsContact OE1-CD 3.24Å; E89-Q294 PolarHBondContact OE1-NE2 3.5Å; E89-Q294 PolarHBondContact OE1-OE1 3.47Å; E89-Q294 PolarHBondContact OE2-NE2 3.25Å
90	R	85.2	Confident	85.7	Confident	99 Å²	99	67.3 Å²	67.3	37%	0.374	32%	0.324	S	S	.	.	H	α-helix	trans	-59.7	-43.7	174.1	-174.4	173.1	178.1	-177.7	-6	111.7	S86 R88 L93 T94	S86-R90 VanDerWaalsContact O-CB 3.27Å; S86-R90 WeakPolarHBondContact O-CB 3.49Å; S86-R90 PolarHBondContact O-N 3.15Å; R88-R90 VanDerWaalsContact C-N 3.33Å; R90-L93 PolarHBondContact O-N 3.17Å; R90-T94 WeakPolarHBondContact O-CB 3.45Å; R90-T94 PolarHBondContact O-N 3.36Å; R90-T94 PolarHBondContact O-OG1 3.3Å
91	Q	86.6	Confident	85.8	Confident	139 Å²	139	63.7 Å²	63.7	65%	0.65	31%	0.311	S	S	*	.	H	α-helix	trans	-60.5	-45.5	175.8	-80.6	176.5	-21.4	0	0	112.3	S87 R88 E89 T94 V95	S87-Q91 WeakPolarHBondContact O-CG 3.18Å; S87-Q91 PolarHBondContact O-N 3.34Å; R88-Q91 PolarHBondContact O-N 3.31Å; E89-Q91 VanDerWaalsContact C-N 3.34Å; E89-Q91 PolarHBondContact O-N 2.91Å; Q91-T94 PolarHBondContact O-N 2.87Å; Q91-V95 WeakPolarHBondContact O-CG2 3.21Å; Q91-V95 PolarHBondContact O-N 3.15Å
92	Q	85.5	Confident	85.9	Confident	91 Å²	91	65.9 Å²	65.9	43%	0.425	33%	0.329	S	S	.	.	H	α-helix	trans	-64.8	-43.4	178.3	-68.6	178.2	-33.7	0	0	111.8	R88 E89 T94 V95 I96 L290	R88-Q92 WeakPolarHBondContact O-CG 3.44Å; R88-Q92 PolarHBondContact O-N 2.96Å; R88-Q92 VanDerWaalsContact O-N 3.11Å; E89-Q92 PolarHBondContact O-N 3.49Å; Q92-T94 VanDerWaalsContact C-N 3.34Å; Q92-T94 PolarHBondContact O-N 2.94Å; Q92-V95 PolarHBondContact O-N 2.87Å; Q92-I96 WeakPolarHBondContact O-CG1 3.4Å; Q92-I96 PolarHBondContact O-N 2.92Å; Q92-I96 VanDerWaalsContact O-N 3.15Å; Q92-L290 HydrophobicContact CB-CD1 3.47Å; Q92-L290 VanDerWaalsContact CB-CD1 3.47Å; Q92-L290 HydrophobicContact CG-CD1 4.5Å
93	L	87.3	Confident	86.2	Confident	2 Å²	2	66.3 Å²	66.3	1%	0.01	33%	0.331	C	S	.	.	H	α-helix	trans	-64.6	-38.5	177.7	-169.2	68.7	0	0	0	111.8	I41 I78 L85 E89 R90 V95 I96 L97 F287 L290	I41-L93 HydrophobicContact CD1-CD2 4.16Å; I78-L93 HydrophobicContact CG2-CD1 4.35Å; I78-L93 HydrophobicContact CG2-CD2 3.91Å; I78-L93 HydrophobicContact CG2-CG 4.36Å; L85-L93 HydrophobicContact CD1-CD2 4.14Å; E89-L93 WeakPolarHBondContact O-CB 3.25Å; E89-L93 PolarHBondContact O-N 3.28Å; R90-L93 PolarHBondContact O-N 3.17Å; L93-V95 VanDerWaalsContact C-N 3.31Å; L93-V95 PolarHBondContact O-N 2.97Å; L93-I96 PolarHBondContact O-N 3.26Å; L93-L97 HydrophobicContact CG-CD1 4.15Å; L93-L97 HydrophobicContact CG-CG 4.32Å; L93-L97 WeakPolarHBondContact O-CB 3.36Å; L93-L97 VanDerWaalsContact O-CG 3.27Å; L93-L97 WeakPolarHBondContact O-CG 3.47Å; L93-L97 PolarHBondContact O-N 3.43Å; L93-F287 HydrophobicContact CD1-CE1 3.98Å; L93-F287 HydrophobicContact CD1-CE2 4.07Å; L93-F287 HydrophobicContact CD1-CZ 3.57Å; L93-L290 HydrophobicContact CD1-CD2 4.47Å
94	T	89.6	Confident	86.6	Confident	57 Å²	57	58.3 Å²	58.3	35%	0.35	30%	0.302	S	S	.	.	H	α-helix	trans	-58.1	-42.6	174.5	-62.7	0	0	0	0	111.8	R90 Q91 Q92 L97 Q98	R90-T94 WeakPolarHBondContact O-CB 3.45Å; R90-T94 PolarHBondContact O-N 3.36Å; R90-T94 PolarHBondContact O-OG1 3.3Å; Q91-T94 PolarHBondContact O-N 2.87Å; Q92-T94 VanDerWaalsContact C-N 3.34Å; Q92-T94 PolarHBondContact O-N 2.94Å; T94-L97 PolarHBondContact O-N 3.09Å; T94-Q98 WeakPolarHBondContact O-CB 3.26Å; T94-Q98 PolarHBondContact O-N 3.07Å
95	V	89.2	Confident	87.4	Confident	77 Å²	77	60.3 Å²	60.3	47%	0.467	31%	0.31	S	S	.	.	H	α-helix	trans	-62.6	-46	176.5	175.2	0	0	0	0	110.6	Q91 Q92 L93 L97 Q98 D99	Q91-V95 WeakPolarHBondContact O-CG2 3.21Å; Q91-V95 PolarHBondContact O-N 3.15Å; Q92-V95 PolarHBondContact O-N 2.87Å; L93-V95 VanDerWaalsContact C-N 3.31Å; L93-V95 PolarHBondContact O-N 2.97Å; V95-L97 VanDerWaalsContact C-N 3.35Å; V95-L97 PolarHBondContact O-N 2.9Å; V95-Q98 WeakPolarHBondContact O-CB 3.47Å; V95-Q98 PolarHBondContact O-N 3.39Å; V95-D99 PolarHBondContact O-N 3.41Å
96	I	88.6	Confident	88	Confident	13 Å²	13	61.2 Å²	61.2	7%	0.067	32%	0.324	C	S	.	.	H	α-helix	trans	-65.6	-38.3	179.3	-62.2	177.8	0	0	0	111.6	Q92 L93 D99 S100 F287 L290	Q92-I96 WeakPolarHBondContact O-CG1 3.4Å; Q92-I96 PolarHBondContact O-N 2.92Å; Q92-I96 VanDerWaalsContact O-N 3.15Å; L93-I96 PolarHBondContact O-N 3.26Å; I96-D99 PolarHBondContact O-N 3.43Å; I96-S100 WeakPolarHBondContact O-CB 3.37Å; I96-S100 PolarHBondContact O-N 3.49Å; I96-S100 PolarHBondContact O-OG 3.31Å; I96-F287 HydrophobicContact CB-CD2 4.44Å; I96-F287 HydrophobicContact CG2-CB 3.86Å; I96-F287 HydrophobicContact CG2-CD2 3.23Å; I96-F287 HydrophobicContact CG2-CE2 3.96Å; I96-F287 HydrophobicContact CG2-CG 3.77Å; I96-L290 HydrophobicContact CD1-CB 3.99Å; I96-L290 HydrophobicContact CD1-CD1 3.63Å; I96-L290 HydrophobicContact CD1-CG 4.38Å
97	L	90.7	Very high	88.7	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.005	32%	0.315	C	S	.	.	H	α-helix	trans	-64.8	-40.6	175.2	-74.2	171.6	0	0	0	111.6	L75 I78 E79 L93 T94 V95 S100 R101 F287	L75-L97 HydrophobicContact CB-CD2 4.32Å; L75-L97 HydrophobicContact CD2-CD2 3.7Å; I78-L97 HydrophobicContact CB-CD2 4.15Å; I78-L97 HydrophobicContact CG2-CD1 4.19Å; I78-L97 HydrophobicContact CG2-CD2 3.8Å; I78-L97 HydrophobicContact CG2-CG 4.38Å; E79-L97 HydrophobicContact CB-CD1 3.8Å; E79-L97 HydrophobicContact CG-CD1 4.11Å; L93-L97 HydrophobicContact CG-CD1 4.15Å; L93-L97 HydrophobicContact CG-CG 4.32Å; L93-L97 WeakPolarHBondContact O-CB 3.36Å; L93-L97 VanDerWaalsContact O-CG 3.27Å; L93-L97 WeakPolarHBondContact O-CG 3.47Å; L93-L97 PolarHBondContact O-N 3.43Å; T94-L97 PolarHBondContact O-N 3.09Å; V95-L97 VanDerWaalsContact C-N 3.35Å; V95-L97 PolarHBondContact O-N 2.9Å; L97-S100 PolarHBondContact O-N 3.44Å; L97-R101 WeakPolarHBondContact O-CG 3.46Å; L97-R101 PolarHBondContact O-N 2.93Å; L97-F287 HydrophobicContact CD2-CE2 4.3Å
98	Q	91.6	Very high	89.1	Confident	128 Å²	128	56.4 Å²	56.4	60%	0.598	29%	0.289	S	S	*	.	H	α-helix	trans	-62.6	-45.1	174.2	-177.7	176.1	-18.4	0	0	111.2	T94 V95 S100 R101 S102	T94-Q98 WeakPolarHBondContact O-CB 3.26Å; T94-Q98 PolarHBondContact O-N 3.07Å; V95-Q98 WeakPolarHBondContact O-CB 3.47Å; V95-Q98 PolarHBondContact O-N 3.39Å; Q98-S100 VanDerWaalsContact C-N 3.32Å; Q98-S100 PolarHBondContact O-N 3.49Å; Q98-R101 PolarHBondContact O-N 3.47Å; Q98-S102 WeakPolarHBondContact O-CB 3.18Å; Q98-S102 PolarHBondContact O-N 2.93Å
99	D	90.1	Very high	89.5	Confident	48 Å²	48	56.6 Å²	56.6	26%	0.257	29%	0.289	S	S	.	.	H	α-helix	trans	-62	-40	175.2	-72.4	-6.9	0	0	0	111.6	V95 I96 S102 L103 T283 R286	V95-D99 PolarHBondContact O-N 3.41Å; I96-D99 PolarHBondContact O-N 3.43Å; D99-S102 WeakPolarHBondContact O-CB 3.21Å; D99-S102 PolarHBondContact O-N 3.43Å; D99-L103 VanDerWaalsContact O-CB 3.29Å; D99-L103 WeakPolarHBondContact O-CB 3.48Å; D99-L103 PolarHBondContact O-N 2.89Å; D99-T283 HydrophobicContact CB-CG2 4.14Å; D99-R286 IonicContact OD2-CZ 3.31Å; D99-R286 IonicContact OD2-NH1 2.67Å; D99-R286 PolarHBondContact OD2-NH1 3.18Å; D99-R286 IonicContact OD2-NH2 2.71Å; D99-R286 PolarHBondContact OD2-NH2 3.38Å
100	S	90.4	Very high	90	Very high	9 Å²	9	55.4 Å²	55.4	6%	0.063	29%	0.285	C	S	.	.	H	α-helix	trans	-66	-38.7	177.7	-57.5	0	0	0	0	112.1	I96 L97 Q98 L104	I96-S100 WeakPolarHBondContact O-CB 3.37Å; I96-S100 PolarHBondContact O-N 3.49Å; I96-S100 PolarHBondContact O-OG 3.31Å; L97-S100 PolarHBondContact O-N 3.44Å; Q98-S100 VanDerWaalsContact C-N 3.32Å; Q98-S100 PolarHBondContact O-N 3.49Å; S100-L104 WeakPolarHBondContact O-CB 3.47Å; S100-L104 PolarHBondContact O-N 3.41Å
101	R	92.4	Very high	90.3	Very high	79 Å²	79	51.1 Å²	51.1	30%	0.298	27%	0.269	S	S	.	.	H	α-helix	trans	-68	-40.4	173.4	-72.7	-179.9	178.9	121.8	-3.8	111.9	L75 D76 E79 L97 Q98 L104 S105	L75-R101 HydrophobicContact CD1-CG 3.94Å; D76-R101 IonicContact OD1-CZ 3.06Å; D76-R101 IonicContact OD1-NE 2.68Å; D76-R101 IonicContact OD1-NH2 3.62Å; D76-R101 PolarHBondContact OD1-NH2 2.68Å; E79-R101 IonicContact OE2-CZ 2.7Å; E79-R101 VanDerWaalsContact OE2-CZ 3.23Å; E79-R101 IonicContact OE2-NH1 3.33Å; E79-R101 PolarHBondContact OE2-NH1 3.05Å; E79-R101 IonicContact OE2-NH2 3.71Å; E79-R101 PolarHBondContact OE2-NH2 3.23Å; L97-R101 WeakPolarHBondContact O-CG 3.46Å; L97-R101 PolarHBondContact O-N 2.93Å; Q98-R101 PolarHBondContact O-N 3.47Å; R101-L104 PolarHBondContact O-N 3.34Å; R101-S105 PolarHBondContact O-N 3.07Å
102	S	91.8	Very high	90.5	Very high	84 Å²	84	50 Å²	50	59%	0.587	26%	0.26	S	S	*	.	H	α-helix	trans	-61.7	-45.7	174.6	-173.7	0	0	0	0	111.2	Q98 D99 S105 G106	Q98-S102 WeakPolarHBondContact O-CB 3.18Å; Q98-S102 PolarHBondContact O-N 2.93Å; D99-S102 WeakPolarHBondContact O-CB 3.21Å; D99-S102 PolarHBondContact O-N 3.43Å; S102-S105 WeakPolarHBondContact O-CB 3.36Å; S102-S105 PolarHBondContact O-N 3.3Å; S102-G106 PolarHBondContact O-N 3.38Å
103	L	90.7	Very high	90.7	Very high	9 Å²	9	48.4 Å²	48.4	5%	0.047	25%	0.254	C	S	.	.	H	α-helix	trans	-57.9	-49	174.3	172.8	70.7	0	0	0	111.9	D99 S105 G106 L107 A276 T279 R280 T283	D99-L103 VanDerWaalsContact O-CB 3.29Å; D99-L103 WeakPolarHBondContact O-CB 3.48Å; D99-L103 PolarHBondContact O-N 2.89Å; L103-S105 VanDerWaalsContact C-N 3.28Å; L103-S105 PolarHBondContact O-N 2.94Å; L103-G106 PolarHBondContact O-N 2.76Å; L103-G106 VanDerWaalsContact O-N 3.16Å; L103-L107 HydrophobicContact CD1-CD1 4.06Å; L103-L107 HydrophobicContact CD1-CG 4.22Å; L103-L107 HydrophobicContact CG-CD1 3.92Å; L103-L107 HydrophobicContact CG-CG 4.46Å; L103-L107 WeakPolarHBondContact O-CB 3.23Å; L103-L107 WeakPolarHBondContact O-CG 3.46Å; L103-L107 PolarHBondContact O-N 3.2Å; L103-A276 WeakPolarHBondContact CD1-O 3.39Å; L103-T279 HydrophobicContact CD1-CG2 3.91Å; L103-R280 HydrophobicContact CD1-CB 3.85Å; L103-R280 VanDerWaalsContact CD2-CA 3.48Å; L103-R280 HydrophobicContact CD2-CB 3.75Å; L103-R280 HydrophobicContact CD2-CG 4.09Å; L103-R280 HydrophobicContact CG-CB 4.29Å; L103-T283 HydrophobicContact CD2-CG2 4.36Å
104	L	93.1	Very high	90.7	Very high	6 Å²	6	48.9 Å²	48.9	3%	0.031	26%	0.256	C	S	.	.	H	α-helix	trans	-59.1	-41.5	178.2	179.9	64	0	0	0	111.5	F55 R68 I71 I72 S100 R101 L107 D108	F55-L104 HydrophobicContact CD1-CD1 4.33Å; F55-L104 HydrophobicContact CE1-CD1 4.06Å; F55-L104 HydrophobicContact CZ-CD1 4.17Å; R68-L104 HydrophobicContact CG-CD2 4.2Å; R68-L104 HydrophobicContact CG-CG 4.46Å; I71-L104 HydrophobicContact CB-CD2 4.15Å; I71-L104 HydrophobicContact CD1-CD1 3.86Å; I71-L104 HydrophobicContact CG2-CD1 4.29Å; I71-L104 HydrophobicContact CG2-CD2 3.83Å; I72-L104 HydrophobicContact CD1-CD2 4.16Å; I72-L104 HydrophobicContact CG1-CD2 3.6Å; S100-L104 WeakPolarHBondContact O-CB 3.47Å; S100-L104 PolarHBondContact O-N 3.41Å; R101-L104 PolarHBondContact O-N 3.34Å; L104-L107 PolarHBondContact O-N 2.98Å; L104-D108 VanDerWaalsContact O-CB 3.27Å; L104-D108 WeakPolarHBondContact O-CB 3.49Å; L104-D108 PolarHBondContact O-N 3.41Å
105	S	91.8	Very high	90.7	Very high	74 Å²	74	47.8 Å²	47.8	52%	0.517	25%	0.247	S	C	.	.	H	α-helix	trans	-63.6	-42.7	175.3	-172.3	0	0	0	0	112.2	R101 S102 L103 D108 R109	R101-S105 PolarHBondContact O-N 3.07Å; S102-S105 WeakPolarHBondContact O-CB 3.36Å; S102-S105 PolarHBondContact O-N 3.3Å; L103-S105 VanDerWaalsContact C-N 3.28Å; L103-S105 PolarHBondContact O-N 2.94Å; S105-D108 PolarHBondContact O-N 2.74Å; S105-R109 WeakPolarHBondContact O-CB 3.43Å; S105-R109 PolarHBondContact O-N 2.98Å
106	G	90.7	Very high	90.8	Very high	36 Å²	36	47.5 Å²	47.5	37%	0.371	24%	0.242	S	C	.	.	H	α-helix	trans	-62.2	-46.1	175.5	0	0	0	0	0	112.6	S102 L103 R109 A110	S102-G106 PolarHBondContact O-N 3.38Å; L103-G106 PolarHBondContact O-N 2.76Å; L103-G106 VanDerWaalsContact O-N 3.16Å; G106-R109 PolarHBondContact O-N 2.99Å; G106-A110 WeakPolarHBondContact O-CB 3.49Å; G106-A110 PolarHBondContact O-N 3.43Å
107	L	91.5	Very high	90.8	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-63.5	-44.6	175.5	-74.8	170.5	0	0	0	112	L52 F55 L56 L103 L104 R109 A110 L111 A276 R280	L52-L107 HydrophobicContact CD2-CD1 3.52Å; F55-L107 HydrophobicContact CD1-CB 4.29Å; F55-L107 HydrophobicContact CE1-CB 3.86Å; L56-L107 HydrophobicContact CD2-CD2 3.7Å; L103-L107 HydrophobicContact CD1-CD1 4.06Å; L103-L107 HydrophobicContact CD1-CG 4.22Å; L103-L107 HydrophobicContact CG-CD1 3.92Å; L103-L107 HydrophobicContact CG-CG 4.46Å; L103-L107 WeakPolarHBondContact O-CB 3.23Å; L103-L107 WeakPolarHBondContact O-CG 3.46Å; L103-L107 PolarHBondContact O-N 3.2Å; L104-L107 PolarHBondContact O-N 2.98Å; L107-R109 VanDerWaalsContact C-N 3.31Å; L107-R109 PolarHBondContact O-N 3.18Å; L107-A110 PolarHBondContact O-N 2.83Å; L107-L111 WeakPolarHBondContact O-CB 3.46Å; L107-L111 WeakPolarHBondContact O-CG 3.39Å; L107-L111 PolarHBondContact O-N 3.38Å; L107-A276 HydrophobicContact CD2-CB 3.51Å; L107-A276 HydrophobicContact CG-CB 4.05Å; L107-R280 HydrophobicContact CD1-CB 4.5Å
108	D	92.2	Very high	90.7	Very high	24 Å²	24	54 Å²	54	13%	0.128	27%	0.267	C	S	.	.	H	α-helix	trans	-59.9	-42.8	177.8	-173.6	47.6	0	0	0	111.2	F55 R64 R68 L104 S105 Y112	F55-D108 HydrophobicContact CE1-CB 4.37Å; F55-D108 HydrophobicContact CZ-CB 3.84Å; R64-D108 WeakPolarHBondContact CD-OD1 3.31Å; R64-D108 IonicContact CZ-OD1 2.68Å; R64-D108 IonicContact NE-OD1 2.74Å; R64-D108 PolarHBondContact NE-OD1 2.8Å; R64-D108 IonicContact NH2-OD1 3.28Å; R68-D108 IonicContact CZ-OD2 3.42Å; R68-D108 IonicContact NE-OD2 2.8Å; L104-D108 VanDerWaalsContact O-CB 3.27Å; L104-D108 WeakPolarHBondContact O-CB 3.49Å; L104-D108 PolarHBondContact O-N 3.41Å; S105-D108 PolarHBondContact O-N 2.74Å; D108-Y112 WeakPolarHBondContact O-CB 3.42Å; D108-Y112 PolarHBondContact O-N 3.28Å
109	R	91.3	Very high	90.6	Very high	182 Å²	182	54.3 Å²	54.3	69%	0.687	27%	0.268	S	S	*	.	H	α-helix	trans	-66	-44.1	175.7	-173	175.7	-177.2	171.1	-0.2	112.3	S105 G106 L107 Y112 N113	S105-R109 WeakPolarHBondContact O-CB 3.43Å; S105-R109 PolarHBondContact O-N 2.98Å; G106-R109 PolarHBondContact O-N 2.99Å; L107-R109 VanDerWaalsContact C-N 3.31Å; L107-R109 PolarHBondContact O-N 3.18Å; R109-Y112 PolarHBondContact O-N 3.01Å; R109-N113 WeakPolarHBondContact O-CB 3.49Å; R109-N113 VanDerWaalsContact O-CG 3.27Å; R109-N113 PolarHBondContact O-N 3.46Å
110	A	90.2	Very high	90.6	Very high	6 Å²	6	55.1 Å²	55.1	5%	0.05	27%	0.269	C	S	.	.	H	α-helix	trans	-63.4	-46.2	178.7	0	0	0	0	0	111.6	G106 L107 N113 M114 L273	G106-A110 WeakPolarHBondContact O-CB 3.49Å; G106-A110 PolarHBondContact O-N 3.43Å; L107-A110 PolarHBondContact O-N 2.83Å; A110-N113 PolarHBondContact O-N 3.32Å; A110-M114 WeakPolarHBondContact O-CB 3.33Å; A110-M114 PolarHBondContact O-N 3.4Å; A110-L273 HydrophobicContact CB-CB 4.3Å; A110-L273 HydrophobicContact CB-CD1 4.11Å
111	L	90.5	Very high	90.7	Very high	8 Å²	8	54.8 Å²	54.8	4%	0.042	27%	0.267	C	S	.	.	H	α-helix	trans	-64.9	-43	176.2	-72.4	173.2	0	0	0	112	F55 L107 N113 M114 F115 L273	F55-L111 HydrophobicContact CD1-CD1 3.56Å; F55-L111 HydrophobicContact CE1-CD1 3.42Å; F55-L111 VanDerWaalsContact CE1-CD1 3.42Å; F55-L111 HydrophobicContact CG-CD1 4.28Å; F55-L111 HydrophobicContact CZ-CD1 4.01Å; F55-L111 VanDerWaalsContact O-CD1 3.25Å; F55-L111 WeakPolarHBondContact O-CD1 3.23Å; L107-L111 WeakPolarHBondContact O-CB 3.46Å; L107-L111 WeakPolarHBondContact O-CG 3.39Å; L107-L111 PolarHBondContact O-N 3.38Å; L111-N113 PolarHBondContact O-N 3.03Å; L111-M114 WeakPolarHBondContact O-CB 3.37Å; L111-M114 PolarHBondContact O-N 3Å; L111-F115 HydrophobicContact CB-CE2 4.23Å; L111-F115 WeakPolarHBondContact O-CD2 3.48Å; L111-F115 PolarHBondContact O-N 3.47Å; L111-L273 HydrophobicContact CD2-CD1 3.7Å; L111-L273 HydrophobicContact CD2-CD2 4.28Å; L111-L273 HydrophobicContact CG-CD1 3.99Å
112	Y	90.8	Very high	90.6	Very high	116 Å²	116	54.4 Å²	54.4	46%	0.455	28%	0.276	S	S	.	.	H	α-helix	trans	-57.2	-48.3	175.4	175.9	-102.5	0	0	0	112	D108 R109 M114 F115 L116	D108-Y112 WeakPolarHBondContact O-CB 3.42Å; D108-Y112 PolarHBondContact O-N 3.28Å; R109-Y112 PolarHBondContact O-N 3.01Å; Y112-M114 VanDerWaalsContact C-N 3.32Å; Y112-M114 PolarHBondContact O-N 3.26Å; Y112-F115 PolarHBondContact O-N 2.96Å; Y112-L116 PolarHBondContact O-N 3.5Å
113	N	89.8	Confident	90.5	Very high	58 Å²	58	57 Å²	57	31%	0.31	28%	0.279	S	S	.	.	H	α-helix	trans	-61.5	-41.5	176.7	-71.8	-8.3	0	0	0	111.6	R109 A110 L111 F115 L116 L117 A269	R109-N113 WeakPolarHBondContact O-CB 3.49Å; R109-N113 VanDerWaalsContact O-CG 3.27Å; R109-N113 PolarHBondContact O-N 3.46Å; A110-N113 PolarHBondContact O-N 3.32Å; L111-N113 PolarHBondContact O-N 3.03Å; N113-F115 PolarHBondContact O-N 3.2Å; N113-L116 PolarHBondContact O-N 2.92Å; N113-L117 WeakPolarHBondContact O-CB 3.43Å; N113-L117 WeakPolarHBondContact O-CD1 3.35Å; N113-L117 WeakPolarHBondContact O-CG 3.48Å; N113-L117 PolarHBondContact O-N 3.36Å; N113-A269 HydrophobicContact CB-CB 4.42Å
114	M	89	Confident	90.6	Very high	11 Å²	11	57.7 Å²	57.7	5%	0.054	28%	0.283	C	S	.	.	H	α-helix	trans	-61.5	-41.8	176.2	-175.6	57.8	64.5	0	0	112.2	A110 L111 Y112 L117 R118 Y266 A269 Q270	A110-M114 WeakPolarHBondContact O-CB 3.33Å; A110-M114 PolarHBondContact O-N 3.4Å; L111-M114 WeakPolarHBondContact O-CB 3.37Å; L111-M114 PolarHBondContact O-N 3Å; Y112-M114 VanDerWaalsContact C-N 3.32Å; Y112-M114 PolarHBondContact O-N 3.26Å; M114-L117 PolarHBondContact O-N 3.45Å; M114-R118 WeakPolarHBondContact O-CB 3.37Å; M114-R118 VanDerWaalsContact O-CG 3.3Å; M114-R118 WeakPolarHBondContact O-CG 3.4Å; M114-R118 PolarHBondContact O-N 3.05Å; M114-R118 HydrophobicContact SD-CG 4.49Å; M114-Y266 HydrophobicContact SD-CE2 4.16Å; M114-A269 HydrophobicContact CE-CB 4.09Å; M114-Q270 VanDerWaalsContact CE-CA 3.5Å; M114-Q270 HydrophobicContact CE-CB 3.94Å
115	F	89.5	Confident	90.6	Very high	35 Å²	35	58.5 Å²	58.5	15%	0.154	29%	0.289	C	S	.	.	H	α-helix	trans	-63	-46.8	174.8	-72.2	-58.5	0	0	0	112.1	A58 L111 Y112 N113 L117 R118 E119	A58-F115 VanDerWaalsContact O-CZ 3.22Å; A58-F115 WeakPolarHBondContact O-CZ 3.49Å; L111-F115 HydrophobicContact CB-CE2 4.23Å; L111-F115 WeakPolarHBondContact O-CD2 3.48Å; L111-F115 PolarHBondContact O-N 3.47Å; Y112-F115 PolarHBondContact O-N 2.96Å; N113-F115 PolarHBondContact O-N 3.2Å; F115-L117 VanDerWaalsContact C-N 3.28Å; F115-L117 PolarHBondContact O-N 2.9Å; F115-R118 PolarHBondContact O-N 3.08Å; F115-E119 PolarHBondContact O-N 3.16Å
116	L	90	Very high	90.7	Very high	70 Å²	70	57.8 Å²	57.8	37%	0.366	29%	0.287	S	S	.	.	H	α-helix	trans	-59.9	-39.9	177.7	-174.8	70.9	0	0	0	111.7	Y112 N113 E119 K120	Y112-L116 PolarHBondContact O-N 3.5Å; N113-L116 PolarHBondContact O-N 2.92Å; L116-E119 WeakPolarHBondContact O-CB 3.47Å; L116-E119 PolarHBondContact O-N 3.28Å; L116-K120 PolarHBondContact O-N 3.03Å
117	L	89.7	Confident	90.8	Very high	9 Å²	9	61.1 Å²	61.1	5%	0.047	29%	0.289	C	S	.	.	H	α-helix	trans	-73.4	-35.6	179.4	-76.8	159.5	0	0	0	112.8	N113 M114 F115 E119 K120 V121 T262 E265 Y266 A269	N113-L117 WeakPolarHBondContact O-CB 3.43Å; N113-L117 WeakPolarHBondContact O-CD1 3.35Å; N113-L117 WeakPolarHBondContact O-CG 3.48Å; N113-L117 PolarHBondContact O-N 3.36Å; M114-L117 PolarHBondContact O-N 3.45Å; F115-L117 VanDerWaalsContact C-N 3.28Å; F115-L117 PolarHBondContact O-N 2.9Å; L117-E119 VanDerWaalsContact C-N 3.26Å; L117-E119 PolarHBondContact O-N 3.42Å; L117-K120 HydrophobicContact CD2-CD 4.23Å; L117-K120 PolarHBondContact O-N 3.32Å; L117-V121 WeakPolarHBondContact O-CB 3.38Å; L117-V121 WeakPolarHBondContact O-CG2 3.41Å; L117-V121 PolarHBondContact O-N 2.82Å; L117-T262 HydrophobicContact CD2-CG2 4.48Å; L117-E265 HydrophobicContact CD1-CB 4.12Å; L117-E265 WeakPolarHBondContact CD1-O 3.47Å; L117-E265 HydrophobicContact CD2-CB 3.47Å; L117-E265 VanDerWaalsContact CD2-CB 3.47Å; L117-E265 HydrophobicContact CG-CB 4.43Å; L117-Y266 HydrophobicContact CB-CD2 4.02Å; L117-A269 HydrophobicContact CD1-CB 3.35Å
118	R	88.8	Confident	90.9	Very high	143 Å²	143	61.1 Å²	61.1	54%	0.54	29%	0.289	S	S	.	.	H	α-helix	trans	-61.2	-37.9	170.1	-76	177	-178.6	-161.6	0	111.7	M114 F115 S122 Y266	M114-R118 WeakPolarHBondContact O-CB 3.37Å; M114-R118 VanDerWaalsContact O-CG 3.3Å; M114-R118 WeakPolarHBondContact O-CG 3.4Å; M114-R118 PolarHBondContact O-N 3.05Å; M114-R118 HydrophobicContact SD-CG 4.49Å; F115-R118 PolarHBondContact O-N 3.08Å; R118-S122 WeakPolarHBondContact O-CB 3.44Å; R118-S122 PolarHBondContact O-N 3.13Å; R118-Y266 HydrophobicContact CG-CE2 4.28Å
119	E	88.9	Confident	91	Very high	133 Å²	133	63.1 Å²	63.1	62%	0.621	30%	0.3	S	S	*	.	H	α-helix	trans	-64.5	-49.9	173.8	-171.6	175.1	-171.3	0	0	111.4	F115 L116 L117 V121 S122 E123	F115-E119 PolarHBondContact O-N 3.16Å; L116-E119 WeakPolarHBondContact O-CB 3.47Å; L116-E119 PolarHBondContact O-N 3.28Å; L117-E119 VanDerWaalsContact C-N 3.26Å; L117-E119 PolarHBondContact O-N 3.42Å; E119-V121 VanDerWaalsContact C-N 3.34Å; E119-V121 PolarHBondContact O-N 3.12Å; E119-S122 CarbonylContact O-C 3.54Å; E119-S122 WeakPolarHBondContact O-CA 3.27Å; E119-S122 WeakPolarHBondContact O-CB 3.41Å; E119-S122 PolarHBondContact O-N 3.41Å; E119-E123 PolarHBondContact O-N 3.29Å
120	K	90.7	Very high	91.2	Very high	66 Å²	66	60.6 Å²	60.6	29%	0.287	29%	0.29	S	S	.	.	H	α-helix	trans	-56.4	-43.6	174.2	-72.6	-172.9	-177.5	-176.8	0	112.9	L116 L117 S122 E123 L124 T262 E265	L116-K120 PolarHBondContact O-N 3.03Å; L117-K120 HydrophobicContact CD2-CD 4.23Å; L117-K120 PolarHBondContact O-N 3.32Å; K120-S122 VanDerWaalsContact C-N 3.29Å; K120-S122 PolarHBondContact O-N 3.34Å; K120-E123 WeakPolarHBondContact O-CB 3.44Å; K120-E123 PolarHBondContact O-N 2.74Å; K120-L124 WeakPolarHBondContact O-CG 3.2Å; K120-L124 PolarHBondContact O-N 3.17Å; K120-T262 HydrophobicContact CB-CG2 4.18Å; K120-E265 IonicContact NZ-OE1 3.38Å; K120-E265 IonicContact NZ-OE2 3.44Å; K120-E265 PolarHBondContact NZ-OE2 3.46Å
121	V	90.7	Very high	91.4	Very high	1 Å²	1	60.4 Å²	60.4	1%	0.006	29%	0.288	C	S	.	.	H	α-helix	trans	-63.3	-37.6	176.5	163.6	0	0	0	0	111.1	L117 E119 S125 L199 K203 T262 Y266	L117-V121 WeakPolarHBondContact O-CB 3.38Å; L117-V121 WeakPolarHBondContact O-CG2 3.41Å; L117-V121 PolarHBondContact O-N 2.82Å; E119-V121 VanDerWaalsContact C-N 3.34Å; E119-V121 PolarHBondContact O-N 3.12Å; V121-S125 WeakPolarHBondContact O-CB 3.26Å; V121-S125 PolarHBondContact O-N 3.18Å; V121-L199 HydrophobicContact CG1-CD2 4.25Å; V121-K203 HydrophobicContact CG1-CD 4.29Å; V121-K203 VanDerWaalsContact CG1-CE 3.41Å; V121-K203 HydrophobicContact CG1-CG 3.93Å; V121-T262 HydrophobicContact CG2-CG2 3.82Å; V121-Y266 HydrophobicContact CG2-CD2 3.95Å; V121-Y266 HydrophobicContact CG2-CE2 4.3Å
122	S	90.4	Very high	91.7	Very high	71 Å²	71	61.9 Å²	61.9	50%	0.497	30%	0.295	S	S	.	.	H	α-helix	trans	-66.6	-39.2	173.9	-165.5	0	0	0	0	112.1	R118 E119 K120 S125 A126	R118-S122 WeakPolarHBondContact O-CB 3.44Å; R118-S122 PolarHBondContact O-N 3.13Å; E119-S122 CarbonylContact O-C 3.54Å; E119-S122 WeakPolarHBondContact O-CA 3.27Å; E119-S122 WeakPolarHBondContact O-CB 3.41Å; E119-S122 PolarHBondContact O-N 3.41Å; K120-S122 VanDerWaalsContact C-N 3.29Å; K120-S122 PolarHBondContact O-N 3.34Å; S122-S125 PolarHBondContact O-N 3.1Å; S122-A126 PolarHBondContact O-N 3.43Å
123	E	91.5	Very high	91.9	Very high	138 Å²	138	61.2 Å²	61.2	65%	0.645	30%	0.299	S	S	*	.	H	α-helix	trans	-64.2	-45.6	175.7	-174	-175.8	176.9	0	0	111.7	E119 K120 S125 A126 R127	E119-E123 PolarHBondContact O-N 3.29Å; K120-E123 WeakPolarHBondContact O-CB 3.44Å; K120-E123 PolarHBondContact O-N 2.74Å; E123-S125 PolarHBondContact O-N 2.86Å; E123-A126 PolarHBondContact O-N 3.07Å; E123-R127 PolarHBondContact O-N 2.94Å
124	L	92.4	Very high	92.1	Very high	24 Å²	24	61.1 Å²	61.1	13%	0.126	30%	0.298	C	S	.	.	H	α-helix	trans	-60.4	-44.4	174.9	-73	175.7	0	0	0	111.8	K120 A126 R127 I128 L199 M259 T262	K120-L124 WeakPolarHBondContact O-CG 3.2Å; K120-L124 PolarHBondContact O-N 3.17Å; L124-A126 VanDerWaalsContact C-N 3.34Å; L124-A126 PolarHBondContact O-N 3.22Å; L124-R127 PolarHBondContact O-N 2.88Å; L124-I128 WeakPolarHBondContact O-CD1 3.4Å; L124-I128 WeakPolarHBondContact O-CG1 3.3Å; L124-I128 PolarHBondContact O-N 3.21Å; L124-L199 HydrophobicContact CB-CD1 4.09Å; L124-L199 HydrophobicContact CD1-CD2 4.42Å; L124-M259 HydrophobicContact CD1-CB 4.42Å; L124-T262 HydrophobicContact CD1-CG2 3.91Å
125	S	92.5	Very high	92.4	Very high	24 Å²	24	60.6 Å²	60.6	17%	0.168	30%	0.296	C	S	.	.	H	α-helix	trans	-57.1	-48.3	175.5	-166.9	0	0	0	0	110.9	V121 S122 E123 R127 I128 D129	V121-S125 WeakPolarHBondContact O-CB 3.26Å; V121-S125 PolarHBondContact O-N 3.18Å; S122-S125 PolarHBondContact O-N 3.1Å; E123-S125 PolarHBondContact O-N 2.86Å; S125-R127 VanDerWaalsContact C-N 3.31Å; S125-R127 PolarHBondContact O-N 3.36Å; S125-I128 PolarHBondContact O-N 3.04Å; S125-D129 VanDerWaalsContact O-CG 3.26Å; S125-D129 PolarHBondContact O-N 3Å
126	A	93.3	Very high	92.6	Very high	58 Å²	58	61.1 Å²	61.1	48%	0.479	30%	0.302	S	S	.	.	H	α-helix	trans	-63.9	-34.9	178.2	0	0	0	0	0	112.6	S122 E123 L124 W130	S122-A126 PolarHBondContact O-N 3.43Å; E123-A126 PolarHBondContact O-N 3.07Å; L124-A126 VanDerWaalsContact C-N 3.34Å; L124-A126 PolarHBondContact O-N 3.22Å; A126-W130 WeakPolarHBondContact O-CB 3.1Å; A126-W130 PolarHBondContact O-N 3.24Å
127	R	94.2	Very high	92.8	Very high	107 Å²	107	61.2 Å²	61.2	40%	0.404	31%	0.305	S	S	.	.	H	α-helix	trans	-69.7	-39.2	176.8	-176	61.5	-179.3	-175.3	5.2	112.5	E123 L124 S125 W130 L131 E248 M252	E123-R127 PolarHBondContact O-N 2.94Å; L124-R127 PolarHBondContact O-N 2.88Å; S125-R127 VanDerWaalsContact C-N 3.31Å; S125-R127 PolarHBondContact O-N 3.36Å; R127-W130 PolarHBondContact O-N 2.72Å; R127-L131 HydrophobicContact CG-CD1 4.29Å; R127-L131 PolarHBondContact O-N 3.23Å; R127-E248 IonicContact NH2-OE2 3.38Å; R127-E248 PolarHBondContact NH2-OE2 3.4Å; R127-E248 VanDerWaalsContact NH2-OE2 3.08Å; R127-M252 HydrophobicContact CB-SD 4.31Å; R127-M252 HydrophobicContact CG-SD 3.74Å
128	I	93.6	Very high	92.9	Very high	0 Å²	0	64 Å²	64	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-62.3	-47.5	173.7	-68	157.4	0	0	0	109.9	L124 S125 W130 L131 H132 V192 L195 R196 L199 L249 M252 M259	L124-I128 WeakPolarHBondContact O-CD1 3.4Å; L124-I128 WeakPolarHBondContact O-CG1 3.3Å; L124-I128 PolarHBondContact O-N 3.21Å; S125-I128 PolarHBondContact O-N 3.04Å; I128-W130 VanDerWaalsContact C-N 3.29Å; I128-W130 PolarHBondContact O-N 2.92Å; I128-L131 PolarHBondContact O-N 2.89Å; I128-H132 WeakPolarHBondContact O-CB 3.29Å; I128-H132 PolarHBondContact O-N 3.46Å; I128-V192 HydrophobicContact CG2-CG1 4.03Å; I128-V192 HydrophobicContact CG2-CG2 4.38Å; I128-L195 HydrophobicContact CD1-CB 3.8Å; I128-L195 HydrophobicContact CD1-CD1 4.37Å; I128-L195 HydrophobicContact CG1-CB 4.43Å; I128-L195 HydrophobicContact CG1-CD1 4.2Å; I128-R196 HydrophobicContact CG2-CG 4.32Å; I128-L199 HydrophobicContact CD1-CD1 3.53Å; I128-L199 HydrophobicContact CD1-CG 4.49Å; I128-L249 HydrophobicContact CG2-CD2 4.47Å; I128-M252 HydrophobicContact CG1-CE 3.71Å; I128-M252 HydrophobicContact CG1-SD 4.07Å; I128-M259 HydrophobicContact CD1-CE 3.79Å
129	D	94.1	Very high	93.1	Very high	66 Å²	66	58.2 Å²	58.2	35%	0.353	30%	0.298	S	S	.	.	H	α-helix	trans	-60.7	-39.9	178.7	-66.1	-28.6	0	0	0	111.7	S125 D133 R196	S125-D129 VanDerWaalsContact O-CG 3.26Å; S125-D129 PolarHBondContact O-N 3Å; D129-D133 PolarHBondContact O-N 3.42Å; D129-D133 VanDerWaalsContact O-N 3.12Å; D129-R196 IonicContact OD1-CZ 3.49Å; D129-R196 VanDerWaalsContact OD1-CZ 3.31Å; D129-R196 IonicContact OD1-NE 2.79Å; D129-R196 PolarHBondContact OD1-NE 3.48Å; D129-R196 IonicContact OD1-NH2 3.13Å; D129-R196 PolarHBondContact OD1-NH2 3.19Å
130	W	95.5	Very high	93.3	Very high	129 Å²	129	56.1 Å²	56.1	49%	0.489	29%	0.291	S	S	.	.	H	α-helix	trans	-66.2	-43.7	176.1	-177.6	81.2	0	0	0	113	A126 R127 I128 H132 D133 D134	A126-W130 WeakPolarHBondContact O-CB 3.1Å; A126-W130 PolarHBondContact O-N 3.24Å; R127-W130 PolarHBondContact O-N 2.72Å; I128-W130 VanDerWaalsContact C-N 3.29Å; I128-W130 PolarHBondContact O-N 2.92Å; W130-H132 VanDerWaalsContact C-N 3.34Å; W130-D133 PolarHBondContact O-N 3.43Å; W130-D134 WeakPolarHBondContact O-CB 3.39Å; W130-D134 PolarHBondContact O-N 2.8Å
131	L	94.5	Very high	93.3	Very high	2 Å²	2	55.7 Å²	55.7	1%	0.01	30%	0.296	C	S	.	.	H	α-helix	trans	-66.3	-36.5	177.8	-78.5	166.7	0	0	0	112.4	R127 I128 D134 F135 T245 E248 L249 M252	R127-L131 HydrophobicContact CG-CD1 4.29Å; R127-L131 PolarHBondContact O-N 3.23Å; I128-L131 PolarHBondContact O-N 2.89Å; L131-D134 PolarHBondContact O-N 3.36Å; L131-F135 WeakPolarHBondContact O-CB 3.42Å; L131-F135 PolarHBondContact O-N 2.81Å; L131-T245 HydrophobicContact CB-CG2 4.18Å; L131-T245 HydrophobicContact CD2-CG2 3.98Å; L131-T245 WeakPolarHBondContact O-CG2 3.28Å; L131-E248 HydrophobicContact CD1-CB 4.12Å; L131-E248 HydrophobicContact CD2-CB 4.2Å; L131-E248 WeakPolarHBondContact CD2-OE2 3.41Å; L131-L249 HydrophobicContact CB-CD2 4.04Å; L131-L249 HydrophobicContact CB-CG 4.23Å; L131-L249 HydrophobicContact CD1-CD2 4.35Å; L131-L249 HydrophobicContact CD1-CG 4.41Å; L131-M252 HydrophobicContact CD1-CE 3.21Å; L131-M252 HydrophobicContact CD1-SD 4Å; L131-M252 HydrophobicContact CG-CE 4.5Å
132	H	95.4	Very high	93.4	Very high	39 Å²	39	56.5 Å²	56.5	18%	0.181	30%	0.301	C	S	.	.	H	α-helix	trans	-63.9	-41.8	174.6	179.7	64.5	0	0	0	112.3	I128 W130 T136 E188 V192	I128-H132 WeakPolarHBondContact O-CB 3.29Å; I128-H132 PolarHBondContact O-N 3.46Å; W130-H132 VanDerWaalsContact C-N 3.34Å; H132-T136 WeakPolarHBondContact O-CB 3.37Å; H132-T136 PolarHBondContact O-N 3.5Å; H132-T136 PolarHBondContact O-OG1 2.83Å; H132-E188 WeakPolarHBondContact CA-OE1 3.34Å; H132-E188 IonicContact CE1-OE1 3.02Å; H132-E188 IonicContact CE1-OE2 3.92Å; H132-E188 IonicContact CG-OE1 3.73Å; H132-E188 IonicContact ND1-OE1 3.77Å; H132-E188 PolarHBondContact ND1-OE1 3.05Å; H132-E188 IonicContact ND1-OE2 3.98Å; H132-E188 PolarHBondContact ND1-OE2 3Å; H132-V192 HydrophobicContact CB-CG1 4.35Å; H132-V192 HydrophobicContact CB-CG2 4.05Å
133	D	95.1	Very high	93.3	Very high	102 Å²	102	54.4 Å²	54.4	55%	0.545	29%	0.285	S	S	.	.	H	α-helix	trans	-65.6	-41.8	176.3	-169.5	58.7	0	0	0	112	D129 W130 T136 T137	D129-D133 PolarHBondContact O-N 3.42Å; D129-D133 VanDerWaalsContact O-N 3.12Å; W130-D133 PolarHBondContact O-N 3.43Å; D133-T136 PolarHBondContact O-N 2.89Å; D133-T137 WeakPolarHBondContact O-CB 3.4Å; D133-T137 PolarHBondContact O-N 3.17Å; D133-T137 PolarHBondContact O-OG1 2.9Å
134	D	94.1	Very high	93.3	Very high	55 Å²	55	54.3 Å²	54.3	29%	0.294	28%	0.284	S	S	.	.	H	α-helix	trans	-62.2	-48.9	174.9	-171.4	72.1	0	0	0	111.6	W130 L131 T136 T137 E138	W130-D134 WeakPolarHBondContact O-CB 3.39Å; W130-D134 PolarHBondContact O-N 2.8Å; L131-D134 PolarHBondContact O-N 3.36Å; D134-T136 VanDerWaalsContact C-N 3.32Å; D134-T136 PolarHBondContact O-N 3.5Å; D134-T137 PolarHBondContact O-N 3.21Å; D134-T137 VanDerWaalsContact O-N 3.17Å; D134-E138 PolarHBondContact O-N 2.94Å
135	F	95.2	Very high	93.2	Very high	1 Å²	1	57.7 Å²	57.7	0%	0.004	30%	0.303	C	S	.	.	H	α-helix	trans	-56.8	-46.2	174.9	-175.2	-88.2	0	0	0	111.9	L131 T137 E138 L139 L184 A185 E188 L242 T245 I246	L131-F135 WeakPolarHBondContact O-CB 3.42Å; L131-F135 PolarHBondContact O-N 2.81Å; F135-T137 VanDerWaalsContact C-N 3.3Å; F135-T137 PolarHBondContact O-N 3.4Å; F135-E138 PolarHBondContact O-N 2.98Å; F135-L139 HydrophobicContact CD1-CB 4.49Å; F135-L139 HydrophobicContact CE1-CB 4.35Å; F135-L139 HydrophobicContact CE1-CD2 4.14Å; F135-L139 WeakPolarHBondContact O-CB 3.46Å; F135-L139 PolarHBondContact O-N 3.44Å; F135-L184 HydrophobicContact CZ-CB 4.26Å; F135-A185 HydrophobicContact CE1-CB 4.06Å; F135-A185 HydrophobicContact CZ-CB 4.47Å; F135-E188 HydrophobicContact CB-CG 4.23Å; F135-E188 HydrophobicContact CD1-CB 4.09Å; F135-E188 HydrophobicContact CD1-CG 3.67Å; F135-E188 HydrophobicContact CD2-CB 4.24Å; F135-E188 HydrophobicContact CD2-CG 3.77Å; F135-E188 HydrophobicContact CE1-CB 3.78Å; F135-E188 HydrophobicContact CE1-CG 3.91Å; F135-E188 HydrophobicContact CE2-CB 3.91Å; F135-E188 HydrophobicContact CE2-CG 3.98Å; F135-E188 HydrophobicContact CG-CB 4.33Å; F135-E188 HydrophobicContact CG-CG 3.61Å; F135-E188 HydrophobicContact CZ-CB 3.67Å; F135-E188 HydrophobicContact CZ-CG 4.05Å; F135-L242 HydrophobicContact CD1-CD2 4.44Å; F135-L242 HydrophobicContact CD2-CB 4.33Å; F135-L242 HydrophobicContact CD2-CD2 3.7Å; F135-L242 HydrophobicContact CE1-CD2 4.37Å; F135-L242 HydrophobicContact CE2-CB 3.78Å; F135-L242 HydrophobicContact CE2-CD2 3.65Å; F135-L242 HydrophobicContact CE2-CG 4.24Å; F135-L242 HydrophobicContact CG-CD2 4.11Å; F135-L242 HydrophobicContact CZ-CB 4.46Å; F135-L242 HydrophobicContact CZ-CD2 4Å; F135-T245 HydrophobicContact CB-CG2 3.79Å; F135-T245 HydrophobicContact CD2-CG2 4.16Å; F135-T245 HydrophobicContact CG-CG2 4.47Å; F135-I246 HydrophobicContact CD2-CG1 4.36Å; F135-I246 HydrophobicContact CE2-CD1 3.79Å; F135-I246 HydrophobicContact CE2-CG1 3.81Å; F135-I246 HydrophobicContact CZ-CD1 4.31Å
136	T	94.3	Very high	93.1	Very high	46 Å²	46	57.2 Å²	57.2	28%	0.282	30%	0.297	S	S	.	.	H	α-helix	trans	-63.6	-37.4	-179.6	-61.1	0	0	0	0	111.5	H132 D133 D134 N140	H132-T136 WeakPolarHBondContact O-CB 3.37Å; H132-T136 PolarHBondContact O-N 3.5Å; H132-T136 PolarHBondContact O-OG1 2.83Å; D133-T136 PolarHBondContact O-N 2.89Å; D134-T136 VanDerWaalsContact C-N 3.32Å; D134-T136 PolarHBondContact O-N 3.5Å; T136-N140 WeakPolarHBondContact O-CB 3.34Å; T136-N140 PolarHBondContact O-N 3.48Å; T136-N140 PolarHBondContact O-ND2 2.97Å
137	T	93.7	Very high	92.9	Very high	71 Å²	71	58.3 Å²	58.3	44%	0.436	30%	0.298	S	S	.	.	H	α-helix	trans	-67.3	-47.1	177.7	-61.3	0	0	0	0	112	D133 D134 F135 N140 S141	D133-T137 WeakPolarHBondContact O-CB 3.4Å; D133-T137 PolarHBondContact O-N 3.17Å; D133-T137 PolarHBondContact O-OG1 2.9Å; D134-T137 PolarHBondContact O-N 3.21Å; D134-T137 VanDerWaalsContact O-N 3.17Å; F135-T137 VanDerWaalsContact C-N 3.3Å; F135-T137 PolarHBondContact O-N 3.4Å; T137-N140 PolarHBondContact O-N 3.02Å; T137-S141 PolarHBondContact O-N 3.03Å; T137-S141 VanDerWaalsContact O-N 3.13Å; T137-S141 PolarHBondContact O-OG 3.35Å
138	E	92.4	Very high	92.7	Very high	67 Å²	67	61.4 Å²	61.4	31%	0.313	31%	0.31	S	S	.	.	H	α-helix	trans	-63.5	-41.9	175.7	-71.4	-68.4	130.2	0	0	111.4	D134 F135 N140 S141 L142 T241 L242	D134-E138 PolarHBondContact O-N 2.94Å; F135-E138 PolarHBondContact O-N 2.98Å; E138-N140 PolarHBondContact O-N 2.64Å; E138-S141 PolarHBondContact O-N 3.45Å; E138-L142 WeakPolarHBondContact O-CB 3.4Å; E138-L142 PolarHBondContact O-N 2.99Å; E138-T241 WeakPolarHBondContact OE2-CB 3.44Å; E138-T241 PolarHBondContact OE2-OG1 3.14Å; E138-L242 HydrophobicContact CB-CD2 3.65Å; E138-L242 HydrophobicContact CB-CG 4.49Å
139	L	93.2	Very high	92.6	Very high	22 Å²	22	64.2 Å²	64.2	12%	0.115	32%	0.323	C	S	.	.	H	α-helix	trans	-60.5	-47.2	177.4	176.6	68.8	0	0	0	111.4	F135 S141 L142 V143 V181 A185 L242	F135-L139 HydrophobicContact CD1-CB 4.49Å; F135-L139 HydrophobicContact CE1-CB 4.35Å; F135-L139 HydrophobicContact CE1-CD2 4.14Å; F135-L139 WeakPolarHBondContact O-CB 3.46Å; F135-L139 PolarHBondContact O-N 3.44Å; L139-S141 VanDerWaalsContact C-N 3.3Å; L139-S141 PolarHBondContact O-N 3.36Å; L139-L142 PolarHBondContact O-N 2.98Å; L139-V143 HydrophobicContact CD1-CG2 4.17Å; L139-V143 HydrophobicContact CG-CG2 4.32Å; L139-V143 WeakPolarHBondContact O-CB 3.43Å; L139-V143 WeakPolarHBondContact O-CG2 3.24Å; L139-V143 PolarHBondContact O-N 3.36Å; L139-V181 HydrophobicContact CD1-CG1 3.31Å; L139-A185 HydrophobicContact CD1-CB 4.23Å; L139-A185 HydrophobicContact CD2-CB 3.66Å; L139-L242 HydrophobicContact CB-CD2 4.18Å; L139-L242 HydrophobicContact CD1-CD1 4.34Å
140	N	92.6	Very high	92.3	Very high	89 Å²	89	63.2 Å²	63.2	48%	0.476	32%	0.316	S	S	.	.	H	α-helix	trans	-61.4	-41.1	178.8	-77.7	-34.3	0	0	0	111.6	T136 T137 E138 V143 Q144	T136-N140 WeakPolarHBondContact O-CB 3.34Å; T136-N140 PolarHBondContact O-N 3.48Å; T136-N140 PolarHBondContact O-ND2 2.97Å; T137-N140 PolarHBondContact O-N 3.02Å; E138-N140 PolarHBondContact O-N 2.64Å; N140-V143 PolarHBondContact O-N 2.93Å; N140-Q144 WeakPolarHBondContact O-CG 3.06Å; N140-Q144 PolarHBondContact O-N 2.93Å
141	S	91.6	Very high	92	Very high	57 Å²	57	58.5 Å²	58.5	40%	0.399	31%	0.308	S	S	.	.	H	α-helix	trans	-62.5	-46.3	176.5	-57.2	0	0	0	0	111.1	T137 E138 L139 V143 Q144 D145	T137-S141 PolarHBondContact O-N 3.03Å; T137-S141 VanDerWaalsContact O-N 3.13Å; T137-S141 PolarHBondContact O-OG 3.35Å; E138-S141 PolarHBondContact O-N 3.45Å; L139-S141 VanDerWaalsContact C-N 3.3Å; L139-S141 PolarHBondContact O-N 3.36Å; S141-V143 PolarHBondContact O-N 3.43Å; S141-Q144 WeakPolarHBondContact O-CB 3.41Å; S141-Q144 PolarHBondContact O-N 3.22Å; S141-D145 PolarHBondContact O-N 2.75Å
142	L	91.1	Very high	91.7	Very high	19 Å²	19	60.5 Å²	60.5	10%	0.099	32%	0.32	C	S	.	.	H	α-helix	trans	-65.5	-39.4	178.8	-159.7	89.2	0	0	0	112.9	E138 L139 Q144 D145 F146 V181 G238 T239 L242	E138-L142 WeakPolarHBondContact O-CB 3.4Å; E138-L142 PolarHBondContact O-N 2.99Å; L139-L142 PolarHBondContact O-N 2.98Å; L142-Q144 VanDerWaalsContact C-N 3.32Å; L142-Q144 PolarHBondContact O-N 3.44Å; L142-D145 WeakPolarHBondContact O-CB 3.23Å; L142-D145 PolarHBondContact O-N 2.81Å; L142-F146 HydrophobicContact CD2-CD2 4.38Å; L142-F146 HydrophobicContact CD2-CE2 3.41Å; L142-F146 VanDerWaalsContact CD2-CE2 3.41Å; L142-F146 HydrophobicContact CD2-CZ 3.71Å; L142-F146 HydrophobicContact CG-CD2 4.3Å; L142-F146 HydrophobicContact CG-CE2 3.69Å; L142-F146 HydrophobicContact CG-CZ 3.97Å; L142-F146 VanDerWaalsContact O-CD2 3.22Å; L142-F146 WeakPolarHBondContact O-CD2 3.41Å; L142-F146 WeakPolarHBondContact O-CG 3.19Å; L142-F146 PolarHBondContact O-N 3.3Å; L142-V181 HydrophobicContact CD2-CB 4.11Å; L142-V181 HydrophobicContact CD2-CG1 3.7Å; L142-V181 HydrophobicContact CD2-CG2 3.37Å; L142-G238 WeakPolarHBondContact CD1-O 3.38Å; L142-T239 HydrophobicContact CD2-CG2 4.14Å; L142-L242 HydrophobicContact CD2-CD1 4Å
143	V	90.3	Very high	91.4	Very high	26 Å²	26	59.4 Å²	59.4	16%	0.158	32%	0.315	C	S	.	.	H	α-helix	trans	-64.9	-37.6	176.6	170.6	0	0	0	0	110.9	L139 N140 S141 F146 T147	L139-V143 HydrophobicContact CD1-CG2 4.17Å; L139-V143 HydrophobicContact CG-CG2 4.32Å; L139-V143 WeakPolarHBondContact O-CB 3.43Å; L139-V143 WeakPolarHBondContact O-CG2 3.24Å; L139-V143 PolarHBondContact O-N 3.36Å; N140-V143 PolarHBondContact O-N 2.93Å; S141-V143 PolarHBondContact O-N 3.43Å; V143-F146 PolarHBondContact O-N 3.28Å; V143-T147 WeakPolarHBondContact O-CB 3.3Å; V143-T147 PolarHBondContact O-N 3.26Å; V143-T147 PolarHBondContact O-OG1 3.41Å
144	Q	91.3	Very high	91	Very high	137 Å²	137	59.4 Å²	59.4	64%	0.64	32%	0.315	S	S	*	.	H	α-helix	trans	-63	-44	172.6	-73.7	177.5	11.6	0	0	111.4	N140 S141 L142 F146 T147 W148	N140-Q144 WeakPolarHBondContact O-CG 3.06Å; N140-Q144 PolarHBondContact O-N 2.93Å; S141-Q144 WeakPolarHBondContact O-CB 3.41Å; S141-Q144 PolarHBondContact O-N 3.22Å; L142-Q144 VanDerWaalsContact C-N 3.32Å; L142-Q144 PolarHBondContact O-N 3.44Å; Q144-F146 PolarHBondContact O-N 2.88Å; Q144-T147 WeakPolarHBondContact O-CB 3.45Å; Q144-T147 PolarHBondContact O-N 3.32Å; Q144-W148 WeakPolarHBondContact O-CB 3.46Å; Q144-W148 PolarHBondContact O-N 2.88Å
145	D	90.2	Very high	90.6	Very high	95 Å²	95	62.3 Å²	62.3	51%	0.508	33%	0.331	S	S	.	.	H	α-helix	trans	-61	-44.2	176.7	-77.9	-9.8	0	0	0	112.2	S141 L142 T147 W148 Q149	S141-D145 PolarHBondContact O-N 2.75Å; L142-D145 WeakPolarHBondContact O-CB 3.23Å; L142-D145 PolarHBondContact O-N 2.81Å; D145-T147 PolarHBondContact O-N 3.17Å; D145-W148 PolarHBondContact O-N 2.99Å; D145-Q149 WeakPolarHBondContact O-CG 3.36Å; D145-Q149 PolarHBondContact O-N 3.38Å
146	F	89.2	Confident	90.2	Very high	13 Å²	13	65.6 Å²	65.6	6%	0.057	35%	0.346	C	S	.	.	H	α-helix	trans	-63.4	-41.6	174.8	-67.9	-46	0	0	0	112.6	L142 V143 Q144 W148 Q149 Q150 V174 E177 Q178 V181	L142-F146 HydrophobicContact CD2-CD2 4.38Å; L142-F146 HydrophobicContact CD2-CE2 3.41Å; L142-F146 VanDerWaalsContact CD2-CE2 3.41Å; L142-F146 HydrophobicContact CD2-CZ 3.71Å; L142-F146 HydrophobicContact CG-CD2 4.3Å; L142-F146 HydrophobicContact CG-CE2 3.69Å; L142-F146 HydrophobicContact CG-CZ 3.97Å; L142-F146 VanDerWaalsContact O-CD2 3.22Å; L142-F146 WeakPolarHBondContact O-CD2 3.41Å; L142-F146 WeakPolarHBondContact O-CG 3.19Å; L142-F146 PolarHBondContact O-N 3.3Å; V143-F146 PolarHBondContact O-N 3.28Å; Q144-F146 PolarHBondContact O-N 2.88Å; F146-W148 VanDerWaalsContact C-N 3.28Å; F146-W148 PolarHBondContact O-N 3.09Å; F146-Q149 PolarHBondContact O-N 3.41Å; F146-Q150 WeakPolarHBondContact O-CB 3.49Å; F146-Q150 WeakPolarHBondContact O-CG 3.47Å; F146-Q150 PolarHBondContact O-N 2.97Å; F146-V174 HydrophobicContact CB-CG1 4.34Å; F146-V174 HydrophobicContact CD1-CG1 4.02Å; F146-E177 HydrophobicContact CD1-CB 4.39Å; F146-E177 HydrophobicContact CE1-CB 3.6Å; F146-E177 HydrophobicContact CZ-CB 3.85Å; F146-Q178 HydrophobicContact CD2-CB 4.14Å; F146-Q178 HydrophobicContact CD2-CG 4.34Å; F146-Q178 HydrophobicContact CG-CB 4.4Å; F146-V181 HydrophobicContact CE2-CB 4.06Å; F146-V181 HydrophobicContact CE2-CG1 4.31Å; F146-V181 HydrophobicContact CE2-CG2 3.75Å; F146-V181 HydrophobicContact CZ-CG2 4Å
147	T	89.9	Confident	89.7	Confident	81 Å²	81	65.4 Å²	65.4	50%	0.497	34%	0.343	S	S	.	.	H	α-helix	trans	-60.7	-42.2	177.1	-56.8	0	0	0	0	110.3	V143 Q144 D145 G151	V143-T147 WeakPolarHBondContact O-CB 3.3Å; V143-T147 PolarHBondContact O-N 3.26Å; V143-T147 PolarHBondContact O-OG1 3.41Å; Q144-T147 WeakPolarHBondContact O-CB 3.45Å; Q144-T147 PolarHBondContact O-N 3.32Å; D145-T147 PolarHBondContact O-N 3.17Å; T147-G151 PolarHBondContact O-N 2.95Å
148	W	90.7	Very high	89.3	Confident	173 Å²	173	65.8 Å²	65.8	66%	0.655	35%	0.353	S	S	*	.	H	α-helix	trans	-66.4	-43.2	176	178.6	84.9	0	0	0	112.8	Q144 D145 F146 G151 T152	Q144-W148 WeakPolarHBondContact O-CB 3.46Å; Q144-W148 PolarHBondContact O-N 2.88Å; D145-W148 PolarHBondContact O-N 2.99Å; F146-W148 VanDerWaalsContact C-N 3.28Å; F146-W148 PolarHBondContact O-N 3.09Å; W148-G151 PolarHBondContact O-N 3.4Å; W148-T152 PolarHBondContact O-N 2.94Å; W148-T152 PolarHBondContact O-OG1 3.4Å
149	Q	89.6	Confident	88.9	Confident	58 Å²	58	65.4 Å²	65.4	27%	0.271	36%	0.358	S	S	.	.	H	α-helix	trans	-63.4	-43.1	176.4	-73.7	-176.5	10.8	0	0	111.9	D145 F146 T152 L153 V174	D145-Q149 WeakPolarHBondContact O-CG 3.36Å; D145-Q149 PolarHBondContact O-N 3.38Å; F146-Q149 PolarHBondContact O-N 3.41Å; Q149-T152 PolarHBondContact O-N 3.49Å; Q149-L153 WeakPolarHBondContact O-CB 3.4Å; Q149-L153 VanDerWaalsContact O-CG 3.25Å; Q149-L153 WeakPolarHBondContact O-CG 3.49Å; Q149-L153 PolarHBondContact O-N 2.97Å; Q149-V174 HydrophobicContact CB-CG1 4.21Å; Q149-V174 HydrophobicContact CB-CG2 4.37Å
150	Q	88	Confident	87.9	Confident	46 Å²	46	75 Å²	75	22%	0.215	39%	0.392	C	S	.	.	H	α-helix	trans	-61.1	-45	174.8	-74.8	179.4	-4	0	0	111.5	F146 T152 L153 L154 V174	F146-Q150 WeakPolarHBondContact O-CB 3.49Å; F146-Q150 WeakPolarHBondContact O-CG 3.47Å; F146-Q150 PolarHBondContact O-N 2.97Å; Q150-T152 PolarHBondContact O-N 2.83Å; Q150-L153 PolarHBondContact O-N 2.99Å; Q150-L154 WeakPolarHBondContact O-CB 3.46Å; Q150-L154 VanDerWaalsContact O-CG 3.26Å; Q150-L154 WeakPolarHBondContact O-CG 3.46Å; Q150-L154 PolarHBondContact O-N 3.32Å; Q150-V174 HydrophobicContact CG-CB 4.47Å; Q150-V174 HydrophobicContact CG-CG1 3.67Å
151	G	89.2	Confident	86.5	Confident	30 Å²	30	77.6 Å²	77.6	31%	0.309	40%	0.402	S	S	.	.	H	α-helix	trans	-58.3	-47.9	175.4	0	0	0	0	0	112.3	T147 W148 L153 L154 D155	T147-G151 PolarHBondContact O-N 2.95Å; W148-G151 PolarHBondContact O-N 3.4Å; G151-L153 PolarHBondContact O-N 3.12Å; G151-L154 PolarHBondContact O-N 3.12Å; G151-D155 PolarHBondContact O-N 3.29Å
152	T	89.2	Confident	85.6	Confident	44 Å²	44	77.3 Å²	77.3	27%	0.27	41%	0.408	S	S	.	.	H	α-helix	trans	-62.1	-40.8	179	-55.7	0	0	0	0	112.2	W148 Q149 Q150 D155 Q156	W148-T152 PolarHBondContact O-N 2.94Å; W148-T152 PolarHBondContact O-OG1 3.4Å; Q149-T152 PolarHBondContact O-N 3.49Å; Q150-T152 PolarHBondContact O-N 2.83Å; T152-D155 PolarHBondContact O-N 3.38Å; T152-Q156 WeakPolarHBondContact O-CG 3.33Å; T152-Q156 PolarHBondContact O-N 3.04Å; T152-Q156 VanDerWaalsContact O-N 3.07Å
153	L	88.1	Confident	85.2	Confident	15 Å²	15	81 Å²	81	8%	0.079	43%	0.428	C	S	.	.	H	α-helix	trans	-68.4	-38.6	177	-71.7	166.4	0	0	0	112	Q149 Q150 G151 Q156 I157 Y167 R170 V174	Q149-L153 WeakPolarHBondContact O-CB 3.4Å; Q149-L153 VanDerWaalsContact O-CG 3.25Å; Q149-L153 WeakPolarHBondContact O-CG 3.49Å; Q149-L153 PolarHBondContact O-N 2.97Å; Q150-L153 PolarHBondContact O-N 2.99Å; G151-L153 PolarHBondContact O-N 3.12Å; L153-Q156 PolarHBondContact O-N 3.47Å; L153-I157 WeakPolarHBondContact O-CD1 3.46Å; L153-I157 VanDerWaalsContact O-CG1 3.23Å; L153-I157 WeakPolarHBondContact O-CG1 3.32Å; L153-I157 PolarHBondContact O-N 3.47Å; L153-Y167 HydrophobicContact CD2-CD1 4.08Å; L153-R170 HydrophobicContact CD1-CB 4.24Å; L153-R170 HydrophobicContact CD1-CG 3.79Å; L153-R170 HydrophobicContact CD2-CB 3.99Å; L153-R170 HydrophobicContact CD2-CG 3.84Å; L153-R170 HydrophobicContact CG-CG 4.47Å; L153-V174 HydrophobicContact CD1-CG2 3.93Å
154	L	86.5	Confident	84.8	Confident	103 Å²	103	83 Å²	83	54%	0.539	44%	0.44	S	S	.	.	H	α-helix	trans	-63.7	-41.1	174.7	-73.6	169.3	0	0	0	111.5	Q150 G151 I157 A158	Q150-L154 WeakPolarHBondContact O-CB 3.46Å; Q150-L154 VanDerWaalsContact O-CG 3.26Å; Q150-L154 WeakPolarHBondContact O-CG 3.46Å; Q150-L154 PolarHBondContact O-N 3.32Å; G151-L154 PolarHBondContact O-N 3.12Å; L154-I157 PolarHBondContact O-N 3.13Å; L154-A158 WeakPolarHBondContact O-CB 3.43Å; L154-A158 PolarHBondContact O-N 3.38Å
155	D	86.7	Confident	84.5	Confident	116 Å²	116	79.7 Å²	79.7	62%	0.62	44%	0.436	S	S	*	.	H	α-helix	trans	-64.5	-38.4	175.6	-72.5	-20.2	0	0	0	112.2	G151 T152 A158 S159	G151-D155 PolarHBondContact O-N 3.29Å; T152-D155 PolarHBondContact O-N 3.38Å; D155-A158 PolarHBondContact O-N 3.37Å; D155-S159 VanDerWaalsContact O-CB 3.32Å; D155-S159 WeakPolarHBondContact O-CB 3.1Å; D155-S159 PolarHBondContact O-N 3.36Å; D155-S159 PolarHBondContact O-OG 3.42Å
156	Q	86.6	Confident	84.4	Confident	69 Å²	69	81 Å²	81	32%	0.322	44%	0.44	S	S	.	.	H	α-helix	trans	-66.8	-40	174.2	-74.1	175.6	-6.8	0	0	112.4	T152 L153 S159 Y167	T152-Q156 WeakPolarHBondContact O-CG 3.33Å; T152-Q156 PolarHBondContact O-N 3.04Å; T152-Q156 VanDerWaalsContact O-N 3.07Å; L153-Q156 PolarHBondContact O-N 3.47Å; Q156-S159 WeakPolarHBondContact CA-OG 3.18Å; Q156-S159 PolarHBondContact O-OG 2.89Å; Q156-S159 VanDerWaalsContact O-OG 3.1Å; Q156-Y167 HydrophobicContact CB-CD1 4.1Å; Q156-Y167 HydrophobicContact CB-CD2 4.2Å; Q156-Y167 HydrophobicContact CB-CE1 4.03Å; Q156-Y167 HydrophobicContact CB-CE2 4.12Å; Q156-Y167 HydrophobicContact CB-CG 4.21Å; Q156-Y167 HydrophobicContact CG-CE1 4.35Å
157	I	84.2	Confident	84.3	Confident	43 Å²	43	82.6 Å²	82.6	22%	0.221	45%	0.446	C	S	.	.	H	α-helix	trans	-64.1	-43.9	173.8	-69.1	164.3	0	0	0	110.5	L153 L154 R160 T164 Y167	L153-I157 WeakPolarHBondContact O-CD1 3.46Å; L153-I157 VanDerWaalsContact O-CG1 3.23Å; L153-I157 WeakPolarHBondContact O-CG1 3.32Å; L153-I157 PolarHBondContact O-N 3.47Å; L154-I157 PolarHBondContact O-N 3.13Å; I157-R160 PolarHBondContact O-N 3.49Å; I157-T164 HydrophobicContact CG2-CG2 4.22Å; I157-Y167 HydrophobicContact CG1-CG 4.37Å
158	A	85.3	Confident	84.1	Confident	79 Å²	79	82.6 Å²	82.6	65%	0.653	44%	0.442	S	S	*	.	H	α-helix	trans	-67.8	-38.6	-179.1	0	0	0	0	0	112.7	L154 D155 R160	L154-A158 WeakPolarHBondContact O-CB 3.43Å; L154-A158 PolarHBondContact O-N 3.38Å; D155-A158 PolarHBondContact O-N 3.37Å; A158-R160 PolarHBondContact O-N 2.99Å
159	S	83.6	Confident	84.1	Confident	59 Å²	59	80.7 Å²	80.7	41%	0.413	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-7.8	-179.5	60	0	0	0	0	114.4	D155 Q156 Q161	D155-S159 VanDerWaalsContact O-CB 3.32Å; D155-S159 WeakPolarHBondContact O-CB 3.1Å; D155-S159 PolarHBondContact O-N 3.36Å; D155-S159 PolarHBondContact O-OG 3.42Å; Q156-S159 WeakPolarHBondContact CA-OG 3.18Å; Q156-S159 PolarHBondContact O-OG 2.89Å; Q156-S159 VanDerWaalsContact O-OG 3.1Å; S159-Q161 PolarHBondContact O-N 3.26Å
160	R	72.2	Confident	84	Confident	222 Å²	222	82.1 Å²	82.1	84%	0.838	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	22.1	-174.5	-61.2	-175.8	178.5	174.9	-0	113.7	I157 A158	I157-R160 PolarHBondContact O-N 3.49Å; A158-R160 PolarHBondContact O-N 2.99Å
161	Q	64.3	Low	83.9	Confident	144 Å²	144	81.2 Å²	81.2	67%	0.673	44%	0.44	S	S	*	.			trans	-91.8	103.1	176.9	-71.5	-173.5	-6.4	0	0	108.8	S159 Y167	S159-Q161 PolarHBondContact O-N 3.26Å; Q161-Y167 WeakPolarHBondContact O-CE2 3.31Å; Q161-Y167 PolarHBondContact O-OH 2.86Å; Q161-Y167 VanDerWaalsContact O-OH 3.06Å
162	G	72.4	Confident	83.9	Confident	52 Å²	52	87.1 Å²	87.1	54%	0.536	45%	0.453	S	S	.	.	S	Bend	trans	107.2	-173.3	176.8	0	0	0	0	0	114.7	T164	G162-T164 PolarHBondContact O-N 3.22Å
163	D	81.4	Confident	83.8	Confident	95 Å²	95	88.2 Å²	88.2	51%	0.508	46%	0.455	S	S	.	.			trans	-76.5	101.2	-178.8	-175.3	-3.2	0	0	0	110.6	A165 Q166 Y167	D163-A165 PolarHBondContact O-N 3Å; D163-A165 VanDerWaalsContact O-N 3.14Å; D163-A165 VanDerWaalsContact OD1-CB 3.32Å; D163-A165 WeakPolarHBondContact OD1-CB 3.47Å; D163-A165 PolarHBondContact OD1-N 3.41Å; D163-Q166 HydrophobicContact CB-CB 3.91Å; D163-Q166 WeakPolarHBondContact O-CA 3.27Å; D163-Q166 WeakPolarHBondContact O-CB 3.43Å; D163-Q166 PolarHBondContact O-N 3.46Å; D163-Y167 WeakPolarHBondContact O-CD2 3.03Å; D163-Y167 PolarHBondContact O-N 3.45Å; D163-Y167 VanDerWaalsContact O-N 3.16Å
164	T	82.9	Confident	83.7	Confident	69 Å²	69	87.5 Å²	87.5	42%	0.423	45%	0.451	S	S	.	.	H	α-helix	trans	-55.3	-32	178.4	-45.6	0	0	0	0	112.5	I157 G162 Q166 Y167 L168	I157-T164 HydrophobicContact CG2-CG2 4.22Å; G162-T164 PolarHBondContact O-N 3.22Å; T164-Q166 VanDerWaalsContact C-N 3.34Å; T164-Y167 PolarHBondContact O-N 3.34Å; T164-L168 WeakPolarHBondContact O-CB 3.44Å; T164-L168 PolarHBondContact O-N 3.03Å
165	A	84.7	Confident	83.8	Confident	67 Å²	67	87.8 Å²	87.8	55%	0.554	45%	0.45	S	S	*	.	H	α-helix	trans	-68	-36.7	177.5	0	0	0	0	0	111.5	D163 K169	D163-A165 PolarHBondContact O-N 3Å; D163-A165 VanDerWaalsContact O-N 3.14Å; D163-A165 VanDerWaalsContact OD1-CB 3.32Å; D163-A165 WeakPolarHBondContact OD1-CB 3.47Å; D163-A165 PolarHBondContact OD1-N 3.41Å; A165-K169 WeakPolarHBondContact O-CB 3.45Å; A165-K169 PolarHBondContact O-N 3.19Å
166	Q	87.6	Confident	83.8	Confident	124 Å²	124	86.3 Å²	86.3	58%	0.579	44%	0.442	S	S	*	.	H	α-helix	trans	-65.9	-45.3	175.3	-172.5	-179.1	0.2	0	0	111.6	D163 T164 K169 R170	D163-Q166 HydrophobicContact CB-CB 3.91Å; D163-Q166 WeakPolarHBondContact O-CA 3.27Å; D163-Q166 WeakPolarHBondContact O-CB 3.43Å; D163-Q166 PolarHBondContact O-N 3.46Å; T164-Q166 VanDerWaalsContact C-N 3.34Å; Q166-K169 WeakPolarHBondContact O-CB 3.43Å; Q166-K169 PolarHBondContact O-N 3.22Å; Q166-R170 PolarHBondContact O-N 3.41Å
167	Y	87.2	Confident	83.7	Confident	46 Å²	46	84 Å²	84	18%	0.18	43%	0.431	C	S	.	.	H	α-helix	trans	-66.2	-39.6	177.8	-60.3	-54	0	0	0	112.7	L153 Q156 I157 Q161 D163 T164 K169 R170 S171	L153-Y167 HydrophobicContact CD2-CD1 4.08Å; Q156-Y167 HydrophobicContact CB-CD1 4.1Å; Q156-Y167 HydrophobicContact CB-CD2 4.2Å; Q156-Y167 HydrophobicContact CB-CE1 4.03Å; Q156-Y167 HydrophobicContact CB-CE2 4.12Å; Q156-Y167 HydrophobicContact CB-CG 4.21Å; Q156-Y167 HydrophobicContact CG-CE1 4.35Å; I157-Y167 HydrophobicContact CG1-CG 4.37Å; Q161-Y167 WeakPolarHBondContact O-CE2 3.31Å; Q161-Y167 PolarHBondContact O-OH 2.86Å; Q161-Y167 VanDerWaalsContact O-OH 3.06Å; D163-Y167 WeakPolarHBondContact O-CD2 3.03Å; D163-Y167 PolarHBondContact O-N 3.45Å; D163-Y167 VanDerWaalsContact O-N 3.16Å; T164-Y167 PolarHBondContact O-N 3.34Å; Y167-K169 VanDerWaalsContact C-N 3.31Å; Y167-K169 PolarHBondContact O-N 3.33Å; Y167-R170 PolarHBondContact O-N 2.77Å; Y167-S171 WeakPolarHBondContact O-CB 3.39Å; Y167-S171 PolarHBondContact O-N 2.95Å
168	L	86.6	Confident	83.9	Confident	81 Å²	81	83.6 Å²	83.6	42%	0.424	43%	0.428	S	S	.	.	H	α-helix	trans	-62.9	-39.9	175.1	-163.7	91	0	0	0	111.3	T164 S171 R172	T164-L168 WeakPolarHBondContact O-CB 3.44Å; T164-L168 PolarHBondContact O-N 3.03Å; L168-S171 PolarHBondContact O-N 2.86Å; L168-R172 WeakPolarHBondContact O-CG 3.29Å; L168-R172 PolarHBondContact O-N 3.13Å; L168-R172 VanDerWaalsContact O-N 3.07Å
169	K	89.1	Confident	84	Confident	133 Å²	133	85.9 Å²	85.9	58%	0.578	43%	0.425	S	S	*	.	H	α-helix	trans	-61.5	-49.1	174.3	-173.5	-173.3	175.2	-166.7	0	110.8	A165 Q166 Y167 S171 R172 E173	A165-K169 WeakPolarHBondContact O-CB 3.45Å; A165-K169 PolarHBondContact O-N 3.19Å; Q166-K169 WeakPolarHBondContact O-CB 3.43Å; Q166-K169 PolarHBondContact O-N 3.22Å; Y167-K169 VanDerWaalsContact C-N 3.31Å; Y167-K169 PolarHBondContact O-N 3.33Å; K169-S171 VanDerWaalsContact C-N 3.33Å; K169-S171 PolarHBondContact O-N 3.31Å; K169-R172 PolarHBondContact O-N 2.87Å; K169-E173 VanDerWaalsContact CE-OE1 3.25Å; K169-E173 WeakPolarHBondContact CE-OE1 3.31Å; K169-E173 IonicContact NZ-OE1 3.62Å; K169-E173 WeakPolarHBondContact O-CG 3.3Å; K169-E173 PolarHBondContact O-N 3.23Å
170	R	87.5	Confident	84.1	Confident	88 Å²	88	85.5 Å²	85.5	33%	0.332	42%	0.417	S	S	.	.	H	α-helix	trans	-63.5	-37	178.2	-172.3	61.9	-173.7	147.3	11.2	112.4	L153 Q166 Y167 R172 E173 V174 E177	L153-R170 HydrophobicContact CD1-CB 4.24Å; L153-R170 HydrophobicContact CD1-CG 3.79Å; L153-R170 HydrophobicContact CD2-CB 3.99Å; L153-R170 HydrophobicContact CD2-CG 3.84Å; L153-R170 HydrophobicContact CG-CG 4.47Å; Q166-R170 PolarHBondContact O-N 3.41Å; Y167-R170 PolarHBondContact O-N 2.77Å; R170-R172 PolarHBondContact O-N 2.96Å; R170-E173 WeakPolarHBondContact CD-OE2 3.38Å; R170-E173 IonicContact CZ-OE2 2.7Å; R170-E173 IonicContact NH1-OE2 3.38Å; R170-E173 PolarHBondContact NH1-OE2 3.01Å; R170-E173 WeakPolarHBondContact O-CB 3.47Å; R170-E173 PolarHBondContact O-N 3.34Å; R170-V174 WeakPolarHBondContact O-CG2 3.47Å; R170-V174 PolarHBondContact O-N 2.95Å; R170-E177 IonicContact CZ-OE1 3.72Å; R170-E177 IonicContact NH1-OE1 2.66Å; R170-E177 PolarHBondContact NH1-OE1 3.43Å; R170-E177 VanDerWaalsContact NH1-OE1 3.13Å; R170-E177 IonicContact NH2-OE1 3.16Å; R170-E177 PolarHBondContact NH2-OE1 3.4Å; R170-E177 IonicContact NH2-OE2 2.69Å
171	S	87.8	Confident	84.8	Confident	27 Å²	27	74.9 Å²	74.9	19%	0.189	38%	0.377	C	S	.	.	H	α-helix	trans	-62.7	-41.2	175.2	172.9	0	0	0	0	111.8	Y167 L168 K169 V174 Q175	Y167-S171 WeakPolarHBondContact O-CB 3.39Å; Y167-S171 PolarHBondContact O-N 2.95Å; L168-S171 PolarHBondContact O-N 2.86Å; K169-S171 VanDerWaalsContact C-N 3.33Å; K169-S171 PolarHBondContact O-N 3.31Å; S171-V174 PolarHBondContact O-N 3.18Å; S171-Q175 WeakPolarHBondContact O-CB 3.36Å; S171-Q175 PolarHBondContact O-N 3.06Å
172	R	87.4	Confident	86.1	Confident	154 Å²	154	73.8 Å²	73.8	58%	0.581	37%	0.368	S	S	*	.	H	α-helix	trans	-65.8	-37.7	172.6	-71	178.3	-174.7	174.4	1.6	112.4	L168 K169 R170 Q175 N176	L168-R172 WeakPolarHBondContact O-CG 3.29Å; L168-R172 PolarHBondContact O-N 3.13Å; L168-R172 VanDerWaalsContact O-N 3.07Å; K169-R172 PolarHBondContact O-N 2.87Å; R170-R172 PolarHBondContact O-N 2.96Å; R172-Q175 PolarHBondContact O-N 3.31Å; R172-N176 WeakPolarHBondContact O-CB 3.43Å; R172-N176 PolarHBondContact O-N 3.45Å; R172-N176 PolarHBondContact O-ND2 2.99Å
173	E	87.2	Confident	86.8	Confident	66 Å²	66	72.9 Å²	72.9	31%	0.308	35%	0.352	S	S	.	.	H	α-helix	trans	-60.3	-51.6	173.5	-69.9	167.2	-169.7	0	0	110.6	K169 R170 Q175 N176 E177	K169-E173 VanDerWaalsContact CE-OE1 3.25Å; K169-E173 WeakPolarHBondContact CE-OE1 3.31Å; K169-E173 IonicContact NZ-OE1 3.62Å; K169-E173 WeakPolarHBondContact O-CG 3.3Å; K169-E173 PolarHBondContact O-N 3.23Å; R170-E173 WeakPolarHBondContact CD-OE2 3.38Å; R170-E173 IonicContact CZ-OE2 2.7Å; R170-E173 IonicContact NH1-OE2 3.38Å; R170-E173 PolarHBondContact NH1-OE2 3.01Å; R170-E173 WeakPolarHBondContact O-CB 3.47Å; R170-E173 PolarHBondContact O-N 3.34Å; E173-Q175 VanDerWaalsContact C-N 3.3Å; E173-Q175 PolarHBondContact O-N 3.49Å; E173-N176 WeakPolarHBondContact O-CB 3.49Å; E173-N176 PolarHBondContact O-N 3.44Å; E173-N176 VanDerWaalsContact O-N 3.16Å; E173-E177 VanDerWaalsContact O-CG 3.27Å; E173-E177 WeakPolarHBondContact O-CG 3.33Å; E173-E177 PolarHBondContact O-N 3.48Å
174	V	86.7	Confident	87.2	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-61.3	-36.4	177.4	176.9	0	0	0	0	112.1	F146 Q149 Q150 L153 R170 S171 E177 Q178	F146-V174 HydrophobicContact CB-CG1 4.34Å; F146-V174 HydrophobicContact CD1-CG1 4.02Å; Q149-V174 HydrophobicContact CB-CG1 4.21Å; Q149-V174 HydrophobicContact CB-CG2 4.37Å; Q150-V174 HydrophobicContact CG-CB 4.47Å; Q150-V174 HydrophobicContact CG-CG1 3.67Å; L153-V174 HydrophobicContact CD1-CG2 3.93Å; R170-V174 WeakPolarHBondContact O-CG2 3.47Å; R170-V174 PolarHBondContact O-N 2.95Å; S171-V174 PolarHBondContact O-N 3.18Å; V174-E177 WeakPolarHBondContact O-CB 3.38Å; V174-E177 PolarHBondContact O-N 2.81Å; V174-Q178 PolarHBondContact O-N 3.42Å
175	Q	88.5	Confident	87.7	Confident	109 Å²	109	65.5 Å²	65.5	51%	0.509	31%	0.311	S	S	.	.	H	α-helix	trans	-66.5	-44	175.2	-175.4	-178.6	2.7	0	0	112.2	S171 R172 E173 E177 Q178 Q179	S171-Q175 WeakPolarHBondContact O-CB 3.36Å; S171-Q175 PolarHBondContact O-N 3.06Å; R172-Q175 PolarHBondContact O-N 3.31Å; E173-Q175 VanDerWaalsContact C-N 3.3Å; E173-Q175 PolarHBondContact O-N 3.49Å; Q175-E177 PolarHBondContact O-N 3.32Å; Q175-Q178 PolarHBondContact O-N 2.99Å; Q175-Q179 PolarHBondContact O-N 3.3Å
176	N	85.9	Confident	88	Confident	86 Å²	86	70.3 Å²	70.3	46%	0.46	31%	0.314	S	S	.	.	H	α-helix	trans	-62	-36.2	172.6	-69	-19.7	0	0	0	110.3	R172 E173 Q179 Q180	R172-N176 WeakPolarHBondContact O-CB 3.43Å; R172-N176 PolarHBondContact O-N 3.45Å; R172-N176 PolarHBondContact O-ND2 2.99Å; E173-N176 WeakPolarHBondContact O-CB 3.49Å; E173-N176 PolarHBondContact O-N 3.44Å; E173-N176 VanDerWaalsContact O-N 3.16Å; N176-Q179 PolarHBondContact O-N 3.41Å; N176-Q180 WeakPolarHBondContact O-CG 3.42Å; N176-Q180 PolarHBondContact O-N 3.17Å; N176-Q180 VanDerWaalsContact O-N 3.15Å
177	E	85.5	Confident	88.2	Confident	20 Å²	20	64.9 Å²	64.9	9%	0.093	29%	0.289	C	S	.	.	H	α-helix	trans	-59.7	-50.5	176	-69.1	168.1	-161	0	0	112.9	F146 R170 E173 V174 Q175 Q179 Q180 V181 W236	F146-E177 HydrophobicContact CD1-CB 4.39Å; F146-E177 HydrophobicContact CE1-CB 3.6Å; F146-E177 HydrophobicContact CZ-CB 3.85Å; R170-E177 IonicContact CZ-OE1 3.72Å; R170-E177 IonicContact NH1-OE1 2.66Å; R170-E177 PolarHBondContact NH1-OE1 3.43Å; R170-E177 VanDerWaalsContact NH1-OE1 3.13Å; R170-E177 IonicContact NH2-OE1 3.16Å; R170-E177 PolarHBondContact NH2-OE1 3.4Å; R170-E177 IonicContact NH2-OE2 2.69Å; E173-E177 VanDerWaalsContact O-CG 3.27Å; E173-E177 WeakPolarHBondContact O-CG 3.33Å; E173-E177 PolarHBondContact O-N 3.48Å; V174-E177 WeakPolarHBondContact O-CB 3.38Å; V174-E177 PolarHBondContact O-N 2.81Å; Q175-E177 PolarHBondContact O-N 3.32Å; E177-Q179 PolarHBondContact O-N 3.47Å; E177-Q180 PolarHBondContact O-N 3.11Å; E177-V181 WeakPolarHBondContact O-CG2 3.22Å; E177-V181 PolarHBondContact O-N 2.91Å; E177-W236 HydrophobicContact CB-CE3 3.99Å; E177-W236 HydrophobicContact CB-CH2 3.77Å; E177-W236 HydrophobicContact CB-CZ2 4.29Å; E177-W236 HydrophobicContact CB-CZ3 3.63Å; E177-W236 HydrophobicContact CG-CD2 3.72Å; E177-W236 HydrophobicContact CG-CE3 3.64Å; E177-W236 HydrophobicContact CG-CH2 3.35Å; E177-W236 HydrophobicContact CG-CZ2 3.34Å; E177-W236 HydrophobicContact CG-CZ3 3.51Å
178	Q	88.7	Confident	88.5	Confident	35 Å²	35	62.7 Å²	62.7	16%	0.164	28%	0.281	C	S	.	.	H	α-helix	trans	-59.9	-41.8	175.4	-172.5	-179.4	16.6	0	0	112.8	F146 V174 Q175 Q180 V181 Y182	F146-Q178 HydrophobicContact CD2-CB 4.14Å; F146-Q178 HydrophobicContact CD2-CG 4.34Å; F146-Q178 HydrophobicContact CG-CB 4.4Å; V174-Q178 PolarHBondContact O-N 3.42Å; Q175-Q178 PolarHBondContact O-N 2.99Å; Q178-Q180 PolarHBondContact O-N 2.93Å; Q178-V181 PolarHBondContact O-N 3.47Å; Q178-Y182 HydrophobicContact CG-CD2 3.98Å; Q178-Y182 HydrophobicContact CG-CE2 3.58Å; Q178-Y182 VanDerWaalsContact O-CD2 3.23Å; Q178-Y182 WeakPolarHBondContact O-CD2 3.35Å; Q178-Y182 PolarHBondContact O-N 3.03Å
179	Q	87.9	Confident	88.9	Confident	126 Å²	126	62.1 Å²	62.1	59%	0.589	28%	0.278	S	S	*	.	H	α-helix	trans	-64.9	-39.5	-179.1	-177.1	177.6	-15.5	0	0	112.7	Q175 N176 E177 V181 Y182 T183	Q175-Q179 PolarHBondContact O-N 3.3Å; N176-Q179 PolarHBondContact O-N 3.41Å; E177-Q179 PolarHBondContact O-N 3.47Å; Q179-V181 VanDerWaalsContact C-N 3.34Å; Q179-Y182 PolarHBondContact O-N 2.82Å; Q179-T183 PolarHBondContact O-N 3.46Å; Q179-T183 VanDerWaalsContact O-N 3.12Å; Q179-T183 PolarHBondContact O-OG1 3.26Å
180	Q	85	Confident	89.1	Confident	51 Å²	51	60 Å²	60	24%	0.238	27%	0.271	C	S	.	.	H	α-helix	trans	-70.3	-34.1	178	-65.1	-179.1	10.1	0	0	111.5	N176 E177 Q178 T183 L184 M232 L233 W236	N176-Q180 WeakPolarHBondContact O-CG 3.42Å; N176-Q180 PolarHBondContact O-N 3.17Å; N176-Q180 VanDerWaalsContact O-N 3.15Å; E177-Q180 PolarHBondContact O-N 3.11Å; Q178-Q180 PolarHBondContact O-N 2.93Å; Q180-T183 WeakPolarHBondContact O-CA 3.44Å; Q180-T183 WeakPolarHBondContact O-CB 3.26Å; Q180-T183 PolarHBondContact O-N 2.88Å; Q180-L184 PolarHBondContact O-N 3.44Å; Q180-M232 PolarHBondContact OE1-O 3.35Å; Q180-L233 HydrophobicContact CB-CD1 4.48Å; Q180-L233 HydrophobicContact CB-CD2 3.67Å; Q180-L233 HydrophobicContact CB-CG 4.27Å; Q180-L233 HydrophobicContact CG-CD2 4.5Å; Q180-W236 HydrophobicContact CB-CH2 4.35Å; Q180-W236 HydrophobicContact CB-CZ3 3.92Å; Q180-W236 HydrophobicContact CG-CH2 4.1Å; Q180-W236 HydrophobicContact CG-CZ3 4.17Å
181	V	87.7	Confident	89.4	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-65.5	-40.6	174.1	163.9	0	0	0	0	112.1	L139 L142 F146 E177 Q178 Q179 T183 L184 A185 T239 L242	L139-V181 HydrophobicContact CD1-CG1 3.31Å; L142-V181 HydrophobicContact CD2-CB 4.11Å; L142-V181 HydrophobicContact CD2-CG1 3.7Å; L142-V181 HydrophobicContact CD2-CG2 3.37Å; F146-V181 HydrophobicContact CE2-CB 4.06Å; F146-V181 HydrophobicContact CE2-CG1 4.31Å; F146-V181 HydrophobicContact CE2-CG2 3.75Å; F146-V181 HydrophobicContact CZ-CG2 4Å; E177-V181 WeakPolarHBondContact O-CG2 3.22Å; E177-V181 PolarHBondContact O-N 2.91Å; Q178-V181 PolarHBondContact O-N 3.47Å; Q179-V181 VanDerWaalsContact C-N 3.34Å; V181-T183 PolarHBondContact O-N 2.92Å; V181-L184 WeakPolarHBondContact O-CB 3.49Å; V181-L184 PolarHBondContact O-N 2.86Å; V181-L184 VanDerWaalsContact O-N 3.15Å; V181-A185 PolarHBondContact O-N 3.42Å; V181-T239 HydrophobicContact CG2-CG2 3.65Å; V181-L242 HydrophobicContact CG1-CD1 4.22Å
182	Y	89.7	Confident	89.7	Confident	121 Å²	121	54.6 Å²	54.6	48%	0.475	25%	0.246	S	C	.	.	H	α-helix	trans	-63.5	-28.8	170.6	-76.6	-59.3	0	0	0	112.7	Q178 Q179 A185 R186	Q178-Y182 HydrophobicContact CG-CD2 3.98Å; Q178-Y182 HydrophobicContact CG-CE2 3.58Å; Q178-Y182 VanDerWaalsContact O-CD2 3.23Å; Q178-Y182 WeakPolarHBondContact O-CD2 3.35Å; Q178-Y182 PolarHBondContact O-N 3.03Å; Q179-Y182 PolarHBondContact O-N 2.82Å; Y182-A185 PolarHBondContact O-N 2.95Å; Y182-R186 PolarHBondContact O-N 2.77Å
183	T	88.5	Confident	90	Very high	33 Å²	33	51.1 Å²	51.1	20%	0.202	24%	0.239	C	C	.	.	H	α-helix	trans	-67.7	-41.8	173.1	-55.5	0	0	0	0	111	Q179 Q180 V181 R186 I187	Q179-T183 PolarHBondContact O-N 3.46Å; Q179-T183 VanDerWaalsContact O-N 3.12Å; Q179-T183 PolarHBondContact O-OG1 3.26Å; Q180-T183 WeakPolarHBondContact O-CA 3.44Å; Q180-T183 WeakPolarHBondContact O-CB 3.26Å; Q180-T183 PolarHBondContact O-N 2.88Å; V181-T183 PolarHBondContact O-N 2.92Å; T183-R186 PolarHBondContact O-N 2.84Å; T183-I187 HydrophobicContact CG2-CD1 4.17Å; T183-I187 WeakPolarHBondContact O-CG1 3.34Å; T183-I187 PolarHBondContact O-N 3.01Å
184	L	89.6	Confident	90.2	Very high	1 Å²	1	50 Å²	50	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-59.2	-45.2	171.3	-70.2	-172.4	0	0	0	111.7	F135 Q180 V181 R186 I187 E188 I230 L233 L242 R243 I246	F135-L184 HydrophobicContact CZ-CB 4.26Å; Q180-L184 PolarHBondContact O-N 3.44Å; V181-L184 WeakPolarHBondContact O-CB 3.49Å; V181-L184 PolarHBondContact O-N 2.86Å; V181-L184 VanDerWaalsContact O-N 3.15Å; L184-R186 VanDerWaalsContact C-N 3.28Å; L184-R186 PolarHBondContact O-N 2.94Å; L184-I187 PolarHBondContact O-N 3.46Å; L184-I187 VanDerWaalsContact O-N 3.13Å; L184-E188 WeakPolarHBondContact O-CB 3.25Å; L184-E188 PolarHBondContact O-N 3.27Å; L184-I230 HydrophobicContact CD2-CG1 3.94Å; L184-L233 HydrophobicContact CD1-CD1 3.5Å; L184-L233 VanDerWaalsContact CD1-CD1 3.5Å; L184-L233 HydrophobicContact CD2-CD1 3.67Å; L184-L233 HydrophobicContact CG-CD1 3.51Å; L184-L242 HydrophobicContact CD1-CB 4.03Å; L184-L242 HydrophobicContact CD1-CD1 4.44Å; L184-R243 HydrophobicContact CD1-CG 4.25Å; L184-I246 HydrophobicContact CB-CD1 3.92Å; L184-I246 HydrophobicContact CD2-CD1 3.75Å; L184-I246 HydrophobicContact CG-CD1 4.27Å
185	A	92.5	Very high	90.5	Very high	8 Å²	8	50 Å²	50	7%	0.066	24%	0.235	C	C	.	.	H	α-helix	trans	-60.4	-37.5	178.3	0	0	0	0	0	112.6	F135 L139 V181 Y182 N189	F135-A185 HydrophobicContact CE1-CB 4.06Å; F135-A185 HydrophobicContact CZ-CB 4.47Å; L139-A185 HydrophobicContact CD1-CB 4.23Å; L139-A185 HydrophobicContact CD2-CB 3.66Å; V181-A185 PolarHBondContact O-N 3.42Å; Y182-A185 PolarHBondContact O-N 2.95Å; A185-N189 PolarHBondContact O-N 3.48Å; A185-N189 PolarHBondContact O-ND2 3.39Å
186	R	92.4	Very high	90.7	Very high	167 Å²	167	48.3 Å²	48.3	63%	0.63	22%	0.224	S	C	*	.	H	α-helix	trans	-66.8	-41.9	174.5	-174	-178.3	65.4	-171.2	-2.1	112.3	Y182 T183 L184 E188 Q190	Y182-R186 PolarHBondContact O-N 2.77Å; T183-R186 PolarHBondContact O-N 2.84Å; L184-R186 VanDerWaalsContact C-N 3.28Å; L184-R186 PolarHBondContact O-N 2.94Å; R186-E188 VanDerWaalsContact C-N 3.35Å; R186-Q190 PolarHBondContact O-N 3.42Å; R186-Q190 VanDerWaalsContact O-N 3.13Å
187	I	90.9	Very high	90.9	Very high	10 Å²	10	48.7 Å²	48.7	5%	0.051	23%	0.226	C	C	.	.	H	α-helix	trans	-63.4	-44.6	177.8	-68.3	164.1	0	0	0	109.9	T183 L184 Q190 I191 A226 N229	T183-I187 HydrophobicContact CG2-CD1 4.17Å; T183-I187 WeakPolarHBondContact O-CG1 3.34Å; T183-I187 PolarHBondContact O-N 3.01Å; L184-I187 PolarHBondContact O-N 3.46Å; L184-I187 VanDerWaalsContact O-N 3.13Å; I187-Q190 PolarHBondContact O-N 3.32Å; I187-I191 HydrophobicContact CG2-CD1 3.77Å; I187-I191 HydrophobicContact CG2-CG1 4.49Å; I187-I191 WeakPolarHBondContact O-CD1 3.42Å; I187-I191 VanDerWaalsContact O-CG1 3.26Å; I187-I191 WeakPolarHBondContact O-CG1 3.36Å; I187-I191 PolarHBondContact O-N 3.33Å; I187-A226 HydrophobicContact CG2-CB 3.9Å; I187-N229 HydrophobicContact CD1-CB 3.62Å; I187-N229 WeakPolarHBondContact CD1-ND2 3.37Å
188	E	94.3	Very high	91	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-60.9	-49.3	178.3	-176.1	-86.1	167.4	0	0	112.2	H132 F135 L184 R186 Q190 I191 V192 I246 L249	H132-E188 WeakPolarHBondContact CA-OE1 3.34Å; H132-E188 IonicContact CE1-OE1 3.02Å; H132-E188 IonicContact CE1-OE2 3.92Å; H132-E188 IonicContact CG-OE1 3.73Å; H132-E188 IonicContact ND1-OE1 3.77Å; H132-E188 PolarHBondContact ND1-OE1 3.05Å; H132-E188 IonicContact ND1-OE2 3.98Å; H132-E188 PolarHBondContact ND1-OE2 3Å; F135-E188 HydrophobicContact CB-CG 4.23Å; F135-E188 HydrophobicContact CD1-CB 4.09Å; F135-E188 HydrophobicContact CD1-CG 3.67Å; F135-E188 HydrophobicContact CD2-CB 4.24Å; F135-E188 HydrophobicContact CD2-CG 3.77Å; F135-E188 HydrophobicContact CE1-CB 3.78Å; F135-E188 HydrophobicContact CE1-CG 3.91Å; F135-E188 HydrophobicContact CE2-CB 3.91Å; F135-E188 HydrophobicContact CE2-CG 3.98Å; F135-E188 HydrophobicContact CG-CB 4.33Å; F135-E188 HydrophobicContact CG-CG 3.61Å; F135-E188 HydrophobicContact CZ-CB 3.67Å; F135-E188 HydrophobicContact CZ-CG 4.05Å; L184-E188 WeakPolarHBondContact O-CB 3.25Å; L184-E188 PolarHBondContact O-N 3.27Å; R186-E188 VanDerWaalsContact C-N 3.35Å; E188-Q190 VanDerWaalsContact C-N 3.28Å; E188-Q190 PolarHBondContact O-N 3.1Å; E188-I191 WeakPolarHBondContact O-CB 3Å; E188-I191 PolarHBondContact O-N 2.95Å; E188-V192 PolarHBondContact O-N 3.26Å; E188-V192 WeakPolarHBondContact OE1-CG2 3.48Å; E188-I246 HydrophobicContact CB-CD1 4.38Å; E188-I246 HydrophobicContact CB-CG1 4.09Å; E188-I246 HydrophobicContact CG-CG1 4.47Å; E188-L249 HydrophobicContact CG-CD1 3.68Å
189	N	94	Very high	90.9	Very high	69 Å²	69	48 Å²	48	37%	0.369	22%	0.221	S	C	.	.	H	α-helix	trans	-58.9	-42	178.1	-80.1	-70	0	0	0	111.5	A185 I191 V192 D193	A185-N189 PolarHBondContact O-N 3.48Å; A185-N189 PolarHBondContact O-ND2 3.39Å; N189-I191 VanDerWaalsContact C-N 3.34Å; N189-I191 PolarHBondContact O-N 3.5Å; N189-V192 PolarHBondContact O-N 2.9Å; N189-D193 WeakPolarHBondContact O-CB 3.42Å; N189-D193 VanDerWaalsContact O-CG 3.32Å; N189-D193 PolarHBondContact O-N 3.21Å
190	Q	93.6	Very high	90.9	Very high	89 Å²	89	46.1 Å²	46.1	42%	0.416	22%	0.215	S	C	.	.	H	α-helix	trans	-59.5	-45.2	175.3	-176.6	-177.6	-18.3	0	0	111.5	R186 I187 E188 D194 Y218 L222	R186-Q190 PolarHBondContact O-N 3.42Å; R186-Q190 VanDerWaalsContact O-N 3.13Å; I187-Q190 PolarHBondContact O-N 3.32Å; E188-Q190 VanDerWaalsContact C-N 3.28Å; E188-Q190 PolarHBondContact O-N 3.1Å; Q190-D194 WeakPolarHBondContact O-CB 3.4Å; Q190-D194 PolarHBondContact O-N 3.01Å; Q190-Y218 PolarHBondContact NE2-OH 3.16Å; Q190-L222 HydrophobicContact CG-CD1 4.39Å
191	I	93.2	Very high	90.9	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-61.9	-46.9	178.1	-65.9	160.5	0	0	0	111.1	I187 E188 N189 D194 L195 F219 L222 I246 L249 L250	I187-I191 HydrophobicContact CG2-CD1 3.77Å; I187-I191 HydrophobicContact CG2-CG1 4.49Å; I187-I191 WeakPolarHBondContact O-CD1 3.42Å; I187-I191 VanDerWaalsContact O-CG1 3.26Å; I187-I191 WeakPolarHBondContact O-CG1 3.36Å; I187-I191 PolarHBondContact O-N 3.33Å; E188-I191 WeakPolarHBondContact O-CB 3Å; E188-I191 PolarHBondContact O-N 2.95Å; N189-I191 VanDerWaalsContact C-N 3.34Å; N189-I191 PolarHBondContact O-N 3.5Å; I191-D194 PolarHBondContact O-N 3.48Å; I191-L195 HydrophobicContact CG2-CD1 3.71Å; I191-L195 HydrophobicContact CG2-CG 4.21Å; I191-L195 WeakPolarHBondContact O-CB 3.48Å; I191-L195 WeakPolarHBondContact O-CG 3.41Å; I191-L195 PolarHBondContact O-N 2.95Å; I191-F219 HydrophobicContact CG2-CE1 4.31Å; I191-L222 HydrophobicContact CD1-CD2 3.8Å; I191-L222 HydrophobicContact CG1-CD1 4.25Å; I191-L222 HydrophobicContact CG1-CD2 3.3Å; I191-L222 HydrophobicContact CG1-CG 4.44Å; I191-I246 HydrophobicContact CD1-CG2 3.92Å; I191-L249 HydrophobicContact CG2-CB 3.72Å; I191-L250 HydrophobicContact CD1-CD1 4.37Å; I191-L250 HydrophobicContact CD1-CD2 3.74Å; I191-L250 HydrophobicContact CD1-CG 3.83Å; I191-L250 HydrophobicContact CG1-CD2 4.06Å
192	V	94.6	Very high	90.8	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-63.4	-45.7	-178.6	168	0	0	0	0	111.3	I128 H132 E188 N189 L195 R196 L249	I128-V192 HydrophobicContact CG2-CG1 4.03Å; I128-V192 HydrophobicContact CG2-CG2 4.38Å; H132-V192 HydrophobicContact CB-CG1 4.35Å; H132-V192 HydrophobicContact CB-CG2 4.05Å; E188-V192 PolarHBondContact O-N 3.26Å; E188-V192 WeakPolarHBondContact OE1-CG2 3.48Å; N189-V192 PolarHBondContact O-N 2.9Å; V192-L195 PolarHBondContact O-N 3.5Å; V192-R196 HydrophobicContact CG1-CG 4.4Å; V192-R196 WeakPolarHBondContact O-CB 3.34Å; V192-R196 WeakPolarHBondContact O-CG 3.4Å; V192-R196 PolarHBondContact O-N 3.13Å; V192-L249 HydrophobicContact CG2-CD1 4.03Å; V192-L249 HydrophobicContact CG2-CD2 3.85Å
193	D	93.7	Very high	90.4	Very high	82 Å²	82	46.2 Å²	46.2	44%	0.439	22%	0.218	S	C	.	.	H	α-helix	trans	-61.4	-47.6	178	-73.4	-18.4	0	0	0	110.8	N189 L195 R196 D197	N189-D193 WeakPolarHBondContact O-CB 3.42Å; N189-D193 VanDerWaalsContact O-CG 3.32Å; N189-D193 PolarHBondContact O-N 3.21Å; D193-L195 PolarHBondContact O-N 3.03Å; D193-R196 PolarHBondContact O-N 3.38Å; D193-D197 WeakPolarHBondContact O-CB 3.48Å; D193-D197 PolarHBondContact O-N 3.49Å
194	D	91.6	Very high	89.9	Confident	41 Å²	41	47.4 Å²	47.4	22%	0.219	23%	0.228	C	C	.	.	H	α-helix	trans	-62.1	-40.6	178.3	-71.3	-31.4	0	0	0	112.5	Q190 I191 R198 Y218 F219 L222	Q190-D194 WeakPolarHBondContact O-CB 3.4Å; Q190-D194 PolarHBondContact O-N 3.01Å; I191-D194 PolarHBondContact O-N 3.48Å; D194-R198 WeakPolarHBondContact O-CB 3.42Å; D194-R198 PolarHBondContact O-N 3.16Å; D194-R198 VanDerWaalsContact O-N 3.09Å; D194-Y218 HydrophobicContact CB-CE1 4.11Å; D194-Y218 VanDerWaalsContact CG-OH 3.29Å; D194-Y218 PolarHBondContact OD1-OH 2.93Å; D194-Y218 WeakPolarHBondContact OD2-CE1 3.38Å; D194-Y218 VanDerWaalsContact OD2-CZ 3.24Å; D194-Y218 PolarHBondContact OD2-OH 3.46Å; D194-F219 HydrophobicContact CB-CZ 3.97Å; D194-L222 WeakPolarHBondContact OD2-CD1 3.28Å
195	L	92.1	Very high	88.9	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-66.5	-43.5	176.4	-72.6	172.1	0	0	0	111.6	I128 I191 V192 D193 R198 L199 F219 L249 M252 M259	I128-L195 HydrophobicContact CD1-CB 3.8Å; I128-L195 HydrophobicContact CD1-CD1 4.37Å; I128-L195 HydrophobicContact CG1-CB 4.43Å; I128-L195 HydrophobicContact CG1-CD1 4.2Å; I191-L195 HydrophobicContact CG2-CD1 3.71Å; I191-L195 HydrophobicContact CG2-CG 4.21Å; I191-L195 WeakPolarHBondContact O-CB 3.48Å; I191-L195 WeakPolarHBondContact O-CG 3.41Å; I191-L195 PolarHBondContact O-N 2.95Å; V192-L195 PolarHBondContact O-N 3.5Å; D193-L195 PolarHBondContact O-N 3.03Å; L195-R198 PolarHBondContact O-N 3.47Å; L195-L199 WeakPolarHBondContact O-CG 3.32Å; L195-L199 PolarHBondContact O-N 2.79Å; L195-F219 HydrophobicContact CD2-CD1 4.43Å; L195-F219 HydrophobicContact CD2-CE1 3.46Å; L195-F219 VanDerWaalsContact CD2-CE1 3.46Å; L195-F219 HydrophobicContact CD2-CE2 4.29Å; L195-F219 HydrophobicContact CD2-CZ 3.38Å; L195-F219 HydrophobicContact CG-CE1 3.72Å; L195-F219 HydrophobicContact CG-CZ 3.69Å; L195-L249 HydrophobicContact CD1-CD2 4.1Å; L195-M252 HydrophobicContact CD1-CE 4.45Å; L195-M259 HydrophobicContact CB-CE 4.1Å; L195-M259 HydrophobicContact CD2-CE 3.55Å; L195-M259 HydrophobicContact CD2-SD 3.68Å; L195-M259 HydrophobicContact CG-CE 4.39Å
196	R	92.9	Very high	87.3	Confident	75 Å²	75	58.9 Å²	58.9	28%	0.283	28%	0.279	S	S	.	.	H	α-helix	trans	-64	-45.6	178.1	-79.7	177.3	172.2	154.1	1	111.4	I128 D129 V192 D193 R198 L199 N200	I128-R196 HydrophobicContact CG2-CG 4.32Å; D129-R196 IonicContact OD1-CZ 3.49Å; D129-R196 VanDerWaalsContact OD1-CZ 3.31Å; D129-R196 IonicContact OD1-NE 2.79Å; D129-R196 PolarHBondContact OD1-NE 3.48Å; D129-R196 IonicContact OD1-NH2 3.13Å; D129-R196 PolarHBondContact OD1-NH2 3.19Å; V192-R196 HydrophobicContact CG1-CG 4.4Å; V192-R196 WeakPolarHBondContact O-CB 3.34Å; V192-R196 WeakPolarHBondContact O-CG 3.4Å; V192-R196 PolarHBondContact O-N 3.13Å; D193-R196 PolarHBondContact O-N 3.38Å; R196-R198 VanDerWaalsContact C-N 3.31Å; R196-R198 PolarHBondContact O-N 3.37Å; R196-L199 PolarHBondContact O-N 3.05Å; R196-N200 WeakPolarHBondContact O-CB 3.43Å; R196-N200 VanDerWaalsContact O-CG 3.32Å; R196-N200 PolarHBondContact O-N 3.22Å; R196-N200 PolarHBondContact O-ND2 3.05Å
197	D	89.8	Confident	85.5	Confident	93 Å²	93	54.8 Å²	54.8	50%	0.497	27%	0.269	S	S	.	.	H	α-helix	trans	-60	-44	177.9	-79.7	-10.5	0	0	0	110.7	D193 L199 N200 E201	D193-D197 WeakPolarHBondContact O-CB 3.48Å; D193-D197 PolarHBondContact O-N 3.49Å; D197-L199 PolarHBondContact O-N 3.38Å; D197-N200 PolarHBondContact O-N 3.09Å; D197-N200 VanDerWaalsContact O-N 3.15Å; D197-E201 WeakPolarHBondContact O-CG 3.26Å; D197-E201 PolarHBondContact O-N 3.47Å
198	R	87.8	Confident	83.8	Confident	41 Å²	41	61 Å²	61	16%	0.155	30%	0.302	C	S	.	.	H	α-helix	trans	-65.2	-37.8	178.1	-157.5	61.4	165.1	171.1	0.5	113.5	D194 L195 R196 E201 L202 Q211 M259 M263	D194-R198 WeakPolarHBondContact O-CB 3.42Å; D194-R198 PolarHBondContact O-N 3.16Å; D194-R198 VanDerWaalsContact O-N 3.09Å; L195-R198 PolarHBondContact O-N 3.47Å; R196-R198 VanDerWaalsContact C-N 3.31Å; R196-R198 PolarHBondContact O-N 3.37Å; R198-E201 VanDerWaalsContact CD-OE2 3.26Å; R198-E201 WeakPolarHBondContact CD-OE2 3.49Å; R198-E201 IonicContact CZ-OE2 3.96Å; R198-E201 IonicContact NE-OE2 3.71Å; R198-E201 IonicContact NH1-OE2 2.85Å; R198-E201 PolarHBondContact NH1-OE2 3.05Å; R198-L202 WeakPolarHBondContact O-CG 3.48Å; R198-L202 PolarHBondContact O-N 3.5Å; R198-Q211 PolarHBondContact NH2-O 3.43Å; R198-M259 HydrophobicContact CB-SD 4.48Å; R198-M263 HydrophobicContact CG-CE 3.76Å; R198-M263 HydrophobicContact CG-SD 4.06Å; R198-M263 VanDerWaalsContact NE-CE 3.28Å
199	L	88.2	Confident	82.1	Confident	1 Å²	1	65.6 Å²	65.6	1%	0.005	33%	0.327	C	S	.	.	H	α-helix	trans	-67.8	-34.9	173.5	-72.5	-176.7	0	0	0	112.5	V121 L124 I128 L195 R196 D197 L202 K203 M259	V121-L199 HydrophobicContact CG1-CD2 4.25Å; L124-L199 HydrophobicContact CB-CD1 4.09Å; L124-L199 HydrophobicContact CD1-CD2 4.42Å; I128-L199 HydrophobicContact CD1-CD1 3.53Å; I128-L199 HydrophobicContact CD1-CG 4.49Å; L195-L199 WeakPolarHBondContact O-CG 3.32Å; L195-L199 PolarHBondContact O-N 2.79Å; R196-L199 PolarHBondContact O-N 3.05Å; D197-L199 PolarHBondContact O-N 3.38Å; L199-L202 HydrophobicContact CD2-CD1 3.96Å; L199-K203 WeakPolarHBondContact O-CG 3.46Å; L199-K203 PolarHBondContact O-N 3.42Å; L199-K203 VanDerWaalsContact O-N 3.12Å; L199-M259 HydrophobicContact CD1-CE 3.86Å; L199-M259 HydrophobicContact CD2-CE 3.68Å; L199-M259 HydrophobicContact CD2-CG 4.36Å; L199-M259 HydrophobicContact CD2-SD 4.31Å; L199-M259 HydrophobicContact CG-CE 3.54Å; L199-M259 HydrophobicContact CG-SD 4.46Å
200	N	87.3	Confident	80.7	Confident	85 Å²	85	62.9 Å²	62.9	46%	0.455	31%	0.313	S	S	.	.	H	α-helix	trans	-71.1	-37.9	176.6	-74.1	-28	0	0	0	111.9	R196 D197 K203 S204	R196-N200 WeakPolarHBondContact O-CB 3.43Å; R196-N200 VanDerWaalsContact O-CG 3.32Å; R196-N200 PolarHBondContact O-N 3.22Å; R196-N200 PolarHBondContact O-ND2 3.05Å; D197-N200 PolarHBondContact O-N 3.09Å; D197-N200 VanDerWaalsContact O-N 3.15Å; N200-K203 PolarHBondContact O-N 3.34Å; N200-S204 WeakPolarHBondContact O-CB 3.5Å; N200-S204 PolarHBondContact O-N 3.11Å
201	E	85.5	Confident	79.7	Confident	78 Å²	78	62.9 Å²	62.9	36%	0.364	31%	0.313	S	S	.	.	H	α-helix	trans	-58.4	-47.9	172	-75.5	176.6	173.2	0	0	111.2	D197 R198 K203 S204 G205	D197-E201 WeakPolarHBondContact O-CG 3.26Å; D197-E201 PolarHBondContact O-N 3.47Å; R198-E201 VanDerWaalsContact CD-OE2 3.26Å; R198-E201 WeakPolarHBondContact CD-OE2 3.49Å; R198-E201 IonicContact CZ-OE2 3.96Å; R198-E201 IonicContact NE-OE2 3.71Å; R198-E201 IonicContact NH1-OE2 2.85Å; R198-E201 PolarHBondContact NH1-OE2 3.05Å; E201-K203 PolarHBondContact O-N 2.92Å; E201-S204 PolarHBondContact O-N 3.09Å; E201-S204 VanDerWaalsContact O-N 3.16Å; E201-S204 PolarHBondContact O-OG 2.95Å; E201-G205 PolarHBondContact O-N 3.39Å
202	L	84.3	Confident	79.1	Confident	1 Å²	1	63.7 Å²	63.7	1%	0.005	32%	0.317	C	S	.	.	H	α-helix	trans	-55.2	-48.8	174	-72	162.6	0	0	0	111.8	R198 L199 S204 G205 I210 M263 Y266	R198-L202 WeakPolarHBondContact O-CG 3.48Å; R198-L202 PolarHBondContact O-N 3.5Å; L199-L202 HydrophobicContact CD2-CD1 3.96Å; L202-S204 VanDerWaalsContact C-N 3.28Å; L202-S204 PolarHBondContact O-N 3.2Å; L202-G205 PolarHBondContact O-N 3.25Å; L202-I210 HydrophobicContact CD2-CD1 3.54Å; L202-I210 HydrophobicContact CD2-CG2 4.37Å; L202-I210 HydrophobicContact CG-CD1 4.23Å; L202-M263 HydrophobicContact CD1-CB 4.46Å; L202-M263 HydrophobicContact CD1-CG 3.47Å; L202-M263 VanDerWaalsContact CD1-CG 3.47Å; L202-M263 HydrophobicContact CD2-CB 4.27Å; L202-M263 HydrophobicContact CD2-CG 4.01Å; L202-M263 HydrophobicContact CG-CG 4.23Å; L202-Y266 HydrophobicContact CB-CD1 4.42Å; L202-Y266 HydrophobicContact CD2-CD1 4.07Å; L202-Y266 HydrophobicContact CD2-CG 4.26Å; L202-Y266 WeakPolarHBondContact O-CE1 3.37Å; L202-Y266 PolarHBondContact O-OH 3.21Å
203	K	82.3	Confident	78.6	Confident	96 Å²	96	69.2 Å²	69.2	42%	0.417	34%	0.343	S	S	.	.	H	α-helix	trans	-63.2	-33.8	179.4	-72.3	173.8	-173.5	170.8	0	112.8	V121 L199 N200 E201 G205	V121-K203 HydrophobicContact CG1-CD 4.29Å; V121-K203 VanDerWaalsContact CG1-CE 3.41Å; V121-K203 HydrophobicContact CG1-CG 3.93Å; L199-K203 WeakPolarHBondContact O-CG 3.46Å; L199-K203 PolarHBondContact O-N 3.42Å; L199-K203 VanDerWaalsContact O-N 3.12Å; N200-K203 PolarHBondContact O-N 3.34Å; E201-K203 PolarHBondContact O-N 2.92Å; K203-G205 PolarHBondContact O-N 3.11Å
204	S	77.6	Confident	78.2	Confident	57 Å²	57	68.2 Å²	68.2	40%	0.399	34%	0.34	S	S	.	.	H	α-helix	trans	-72.9	-18.7	-177.5	76.8	0	0	0	0	113.1	N200 E201 L202 R206	N200-S204 WeakPolarHBondContact O-CB 3.5Å; N200-S204 PolarHBondContact O-N 3.11Å; E201-S204 PolarHBondContact O-N 3.09Å; E201-S204 VanDerWaalsContact O-N 3.16Å; E201-S204 PolarHBondContact O-OG 2.95Å; L202-S204 VanDerWaalsContact C-N 3.28Å; L202-S204 PolarHBondContact O-N 3.2Å; S204-R206 PolarHBondContact O-N 2.88Å; S204-R206 VanDerWaalsContact O-N 3.13Å; S204-R206 WeakPolarHBondContact OG-CB 3.39Å; S204-R206 PolarHBondContact OG-N 3.03Å
205	G	69.3	Low	77.9	Confident	30 Å²	30	66.6 Å²	66.6	31%	0.309	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	59	19.9	-177.1	0	0	0	0	0	113.4	E201 L202 K203	E201-G205 PolarHBondContact O-N 3.39Å; L202-G205 PolarHBondContact O-N 3.25Å; K203-G205 PolarHBondContact O-N 3.11Å
206	R	57.2	Low	77.7	Confident	220 Å²	220	67.5 Å²	67.5	83%	0.83	34%	0.336	S	S	*	.			trans	-83.9	-6.3	-168.6	-80	-178.4	-179.9	168.6	1.2	115	S204	S204-R206 PolarHBondContact O-N 2.88Å; S204-R206 VanDerWaalsContact O-N 3.13Å; S204-R206 WeakPolarHBondContact OG-CB 3.39Å; S204-R206 PolarHBondContact OG-N 3.03Å
207	D	55.3	Low	77.5	Confident	82 Å²	82	70.3 Å²	70.3	44%	0.439	35%	0.346	S	S	.	.			trans	-133.1	109.1	-174.5	-137.8	-14.9	0	0	0	111.1	D209 I210	D207-D209 PolarHBondContact O-N 3.38Å; D207-I210 HydrophobicContact CB-CG1 4.05Å; D207-I210 WeakPolarHBondContact O-CG1 3.24Å
208	D	55.2	Low	77.5	Confident	139 Å²	139	70.3 Å²	70.3	74%	0.743	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-14.2	171.8	-84.2	-13.1	0	0	0	111.6
209	D	58.9	Low	77.7	Confident	98 Å²	98	68.5 Å²	68.5	52%	0.524	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119	47.6	-176.4	-156.1	23.7	0	0	0	111.8	D207 Q211	D207-D209 PolarHBondContact O-N 3.38Å; D209-Q211 PolarHBondContact O-N 3.45Å; D209-Q211 WeakPolarHBondContact OD1-CG 3.24Å; D209-Q211 PolarHBondContact OD2-NE2 3.31Å
210	I	64.8	Low	77.8	Confident	13 Å²	13	73.9 Å²	73.9	7%	0.067	36%	0.359	C	S	.	.			trans	-63.3	89.7	165.3	-62.2	177.9	0	0	0	108.1	L202 D207 V212 M263 V267	L202-I210 HydrophobicContact CD2-CD1 3.54Å; L202-I210 HydrophobicContact CD2-CG2 4.37Å; L202-I210 HydrophobicContact CG-CD1 4.23Å; D207-I210 HydrophobicContact CB-CG1 4.05Å; D207-I210 WeakPolarHBondContact O-CG1 3.24Å; I210-V212 PolarHBondContact O-N 2.72Å; I210-M263 HydrophobicContact CG2-CE 3.4Å; I210-M263 VanDerWaalsContact CG2-CE 3.4Å; I210-V267 HydrophobicContact CB-CG2 3.92Å; I210-V267 HydrophobicContact CD1-CG2 4.19Å; I210-V267 HydrophobicContact CG2-CG2 4.29Å
211	Q	72.2	Confident	77.9	Confident	89 Å²	89	74.4 Å²	74.4	42%	0.416	36%	0.362	S	S	.	.			trans	-74.3	91.5	176.2	-68.2	179.4	10.4	0	0	108.4	R198 D209 E213 T214 H215	R198-Q211 PolarHBondContact NH2-O 3.43Å; D209-Q211 PolarHBondContact O-N 3.45Å; D209-Q211 WeakPolarHBondContact OD1-CG 3.24Å; D209-Q211 PolarHBondContact OD2-NE2 3.31Å; Q211-E213 PolarHBondContact O-N 3.32Å; Q211-T214 WeakPolarHBondContact CB-OG1 3.38Å; Q211-T214 WeakPolarHBondContact O-CB 3.34Å; Q211-T214 PolarHBondContact O-N 2.83Å; Q211-T214 PolarHBondContact OE1-OG1 2.82Å; Q211-H215 PolarHBondContact O-N 3.04Å
212	V	81.2	Confident	78.1	Confident	16 Å²	16	71.3 Å²	71.3	10%	0.097	35%	0.347	C	S	.	.	H	α-helix	trans	-54.4	-33.6	172.8	-177.4	0	0	0	0	110.6	I210 H215 L216 P260 M263 R264	I210-V212 PolarHBondContact O-N 2.72Å; V212-H215 WeakPolarHBondContact O-CB 3.2Å; V212-H215 PolarHBondContact O-N 3.5Å; V212-L216 HydrophobicContact CG1-CD1 4.26Å; V212-L216 HydrophobicContact CG1-CG 4.46Å; V212-L216 WeakPolarHBondContact O-CG 3.4Å; V212-L216 PolarHBondContact O-N 2.9Å; V212-P260 HydrophobicContact CG1-CB 4.17Å; V212-M263 HydrophobicContact CG2-CB 3.96Å; V212-M263 HydrophobicContact CG2-CE 4.4Å; V212-R264 HydrophobicContact CB-CG 4.3Å; V212-R264 HydrophobicContact CG1-CG 4.1Å; V212-R264 HydrophobicContact CG2-CG 3.87Å
213	E	83.5	Confident	78.5	Confident	117 Å²	117	74.1 Å²	74.1	55%	0.547	36%	0.359	S	S	.	.	H	α-helix	trans	-64.3	-39.3	175.6	-171.1	60.6	-158.7	0	0	112.8	Q211 L216 R217	Q211-E213 PolarHBondContact O-N 3.32Å; E213-L216 PolarHBondContact O-N 3.01Å; E213-R217 WeakPolarHBondContact O-CB 3.45Å; E213-R217 PolarHBondContact O-N 3.46Å
214	T	84.9	Confident	78.9	Confident	60 Å²	60	75.6 Å²	75.6	37%	0.368	37%	0.366	S	S	.	.	H	α-helix	trans	-70	-37.8	176.6	-61.7	0	0	0	0	110.9	Q211 Y218	Q211-T214 WeakPolarHBondContact CB-OG1 3.38Å; Q211-T214 WeakPolarHBondContact O-CB 3.34Å; Q211-T214 PolarHBondContact O-N 2.83Å; Q211-T214 PolarHBondContact OE1-OG1 2.82Å; T214-Y218 VanDerWaalsContact O-CB 3.31Å; T214-Y218 WeakPolarHBondContact O-CB 3.5Å; T214-Y218 PolarHBondContact O-N 2.92Å
215	H	85.6	Confident	79.4	Confident	7 Å²	7	76.5 Å²	76.5	3%	0.032	37%	0.369	C	S	.	.	H	α-helix	trans	-61	-51	171.2	171.8	81.7	0	0	0	111.8	Q211 V212 R217 Y218 F219 G253 M263	Q211-H215 PolarHBondContact O-N 3.04Å; V212-H215 WeakPolarHBondContact O-CB 3.2Å; V212-H215 PolarHBondContact O-N 3.5Å; H215-R217 PolarHBondContact O-N 3.42Å; H215-Y218 WeakPolarHBondContact O-CB 3.37Å; H215-Y218 PolarHBondContact O-N 3.2Å; H215-F219 AromaticContact CE1-CD2 3.28Å; H215-F219 WeakPolarHBondContact CE1-CD2 3.37Å; H215-F219 AromaticContact CE1-CE2 3.1Å; H215-F219 WeakPolarHBondContact CE1-CE2 3.48Å; H215-F219 AromaticContact CE1-CZ 3.96Å; H215-F219 AromaticContact ND1-CD2 3.4Å; H215-F219 WeakPolarHBondContact ND1-CD2 3.41Å; H215-F219 AromaticContact ND1-CE2 3.3Å; H215-F219 VanDerWaalsContact ND1-CE2 3.3Å; H215-F219 WeakPolarHBondContact ND1-CE2 3.28Å; H215-F219 AromaticContact NE2-CD2 3.85Å; H215-F219 WeakPolarHBondContact O-CD2 3.47Å; H215-F219 PolarHBondContact O-N 3.04Å; H215-G253 PolarHBondContact NE2-O 3.33Å; H215-M263 HydrophobicContact CB-CE 4.01Å; H215-M263 HydrophobicContact CB-SD 4.45Å
216	L	88.5	Confident	80.3	Confident	20 Å²	20	75.1 Å²	75.1	11%	0.105	36%	0.355	C	S	.	.	H	α-helix	trans	-57.3	-48.4	178.2	-76.9	170.6	0	0	0	111.6	V212 E213 Y218 F219 E220 P260	V212-L216 HydrophobicContact CG1-CD1 4.26Å; V212-L216 HydrophobicContact CG1-CG 4.46Å; V212-L216 WeakPolarHBondContact O-CG 3.4Å; V212-L216 PolarHBondContact O-N 2.9Å; E213-L216 PolarHBondContact O-N 3.01Å; L216-Y218 VanDerWaalsContact C-N 3.31Å; L216-Y218 PolarHBondContact O-N 3.11Å; L216-F219 PolarHBondContact O-N 2.76Å; L216-E220 WeakPolarHBondContact O-CB 3.44Å; L216-E220 VanDerWaalsContact O-CG 3.29Å; L216-E220 WeakPolarHBondContact O-CG 3.47Å; L216-E220 PolarHBondContact O-N 3.49Å; L216-P260 HydrophobicContact CD2-CB 3.92Å; L216-P260 HydrophobicContact CD2-CG 3.58Å; L216-P260 HydrophobicContact CG-CB 4.39Å; L216-P260 HydrophobicContact CG-CG 4.43Å
217	R	88.4	Confident	81.8	Confident	133 Å²	133	66.7 Å²	66.7	50%	0.502	33%	0.326	S	S	.	.	H	α-helix	trans	-61.7	-39.2	178.5	-168.9	-176.6	-54.6	152.9	9.4	112.5	E213 H215 N221	E213-R217 WeakPolarHBondContact O-CB 3.45Å; E213-R217 PolarHBondContact O-N 3.46Å; H215-R217 PolarHBondContact O-N 3.42Å; R217-N221 WeakPolarHBondContact O-CB 3.29Å; R217-N221 VanDerWaalsContact O-CG 3.26Å; R217-N221 PolarHBondContact O-N 3.42Å; R217-N221 VanDerWaalsContact O-N 3.11Å; R217-N221 PolarHBondContact O-ND2 2.91Å
218	Y	89.5	Confident	83.3	Confident	94 Å²	94	67.7 Å²	67.7	37%	0.369	33%	0.328	S	S	.	.	H	α-helix	trans	-63.6	-50.2	176.3	176.6	-98.9	0	0	0	111.2	Q190 D194 T214 H215 L216 E220 N221 L222	Q190-Y218 PolarHBondContact NE2-OH 3.16Å; D194-Y218 HydrophobicContact CB-CE1 4.11Å; D194-Y218 VanDerWaalsContact CG-OH 3.29Å; D194-Y218 PolarHBondContact OD1-OH 2.93Å; D194-Y218 WeakPolarHBondContact OD2-CE1 3.38Å; D194-Y218 VanDerWaalsContact OD2-CZ 3.24Å; D194-Y218 PolarHBondContact OD2-OH 3.46Å; T214-Y218 VanDerWaalsContact O-CB 3.31Å; T214-Y218 WeakPolarHBondContact O-CB 3.5Å; T214-Y218 PolarHBondContact O-N 2.92Å; H215-Y218 WeakPolarHBondContact O-CB 3.37Å; H215-Y218 PolarHBondContact O-N 3.2Å; L216-Y218 VanDerWaalsContact C-N 3.31Å; L216-Y218 PolarHBondContact O-N 3.11Å; Y218-E220 PolarHBondContact O-N 3.34Å; Y218-N221 WeakPolarHBondContact O-CB 3.44Å; Y218-N221 PolarHBondContact O-N 3.18Å; Y218-L222 HydrophobicContact CE1-CD1 3.81Å; Y218-L222 WeakPolarHBondContact O-CB 3.26Å; Y218-L222 PolarHBondContact O-N 3.17Å
219	F	91	Very high	84.8	Confident	3 Å²	3	63.1 Å²	63.1	1%	0.013	30%	0.304	C	S	.	.	H	α-helix	trans	-68.3	-33.5	179.8	-86.6	-89.8	0	0	0	113	I191 D194 L195 H215 L216 L222 K223 I254	I191-F219 HydrophobicContact CG2-CE1 4.31Å; D194-F219 HydrophobicContact CB-CZ 3.97Å; L195-F219 HydrophobicContact CD2-CD1 4.43Å; L195-F219 HydrophobicContact CD2-CE1 3.46Å; L195-F219 VanDerWaalsContact CD2-CE1 3.46Å; L195-F219 HydrophobicContact CD2-CE2 4.29Å; L195-F219 HydrophobicContact CD2-CZ 3.38Å; L195-F219 HydrophobicContact CG-CE1 3.72Å; L195-F219 HydrophobicContact CG-CZ 3.69Å; H215-F219 AromaticContact CE1-CD2 3.28Å; H215-F219 WeakPolarHBondContact CE1-CD2 3.37Å; H215-F219 AromaticContact CE1-CE2 3.1Å; H215-F219 WeakPolarHBondContact CE1-CE2 3.48Å; H215-F219 AromaticContact CE1-CZ 3.96Å; H215-F219 AromaticContact ND1-CD2 3.4Å; H215-F219 WeakPolarHBondContact ND1-CD2 3.41Å; H215-F219 AromaticContact ND1-CE2 3.3Å; H215-F219 VanDerWaalsContact ND1-CE2 3.3Å; H215-F219 WeakPolarHBondContact ND1-CE2 3.28Å; H215-F219 AromaticContact NE2-CD2 3.85Å; H215-F219 WeakPolarHBondContact O-CD2 3.47Å; H215-F219 PolarHBondContact O-N 3.04Å; L216-F219 PolarHBondContact O-N 2.76Å; F219-L222 PolarHBondContact O-N 3.25Å; F219-K223 WeakPolarHBondContact O-CB 3.41Å; F219-K223 PolarHBondContact O-N 3.15Å; F219-I254 HydrophobicContact CB-CD1 4.27Å; F219-I254 HydrophobicContact CB-CG1 3.67Å
220	E	90.5	Very high	86.1	Confident	113 Å²	113	59.1 Å²	59.1	53%	0.528	28%	0.282	S	S	.	.	H	α-helix	trans	-62.5	-41.6	171.1	-77.1	176	176.9	0	0	112	L216 Y218 K224 I254	L216-E220 WeakPolarHBondContact O-CB 3.44Å; L216-E220 VanDerWaalsContact O-CG 3.29Å; L216-E220 WeakPolarHBondContact O-CG 3.47Å; L216-E220 PolarHBondContact O-N 3.49Å; Y218-E220 PolarHBondContact O-N 3.34Å; E220-K224 PolarHBondContact O-N 2.71Å; E220-I254 HydrophobicContact CG-CG2 4.48Å
221	N	90.3	Very high	87	Confident	97 Å²	97	67 Å²	67	52%	0.519	31%	0.311	S	S	.	.	H	α-helix	trans	-65.6	-43.1	174.2	-74.2	-29.2	0	0	0	111.4	R217 Y218 K224 T225	R217-N221 WeakPolarHBondContact O-CB 3.29Å; R217-N221 VanDerWaalsContact O-CG 3.26Å; R217-N221 PolarHBondContact O-N 3.42Å; R217-N221 VanDerWaalsContact O-N 3.11Å; R217-N221 PolarHBondContact O-ND2 2.91Å; Y218-N221 WeakPolarHBondContact O-CB 3.44Å; Y218-N221 PolarHBondContact O-N 3.18Å; N221-K224 WeakPolarHBondContact O-CB 3.39Å; N221-K224 PolarHBondContact O-N 3.05Å; N221-T225 PolarHBondContact O-N 2.88Å; N221-T225 PolarHBondContact O-OG1 3.43Å
222	L	90.6	Very high	87.4	Confident	13 Å²	13	68.6 Å²	68.6	7%	0.068	32%	0.32	C	S	.	.	H	α-helix	trans	-63.3	-44.5	177.9	-160.6	161.8	0	0	0	110.6	Q190 I191 D194 Y218 F219 K224 T225 A226 L250	Q190-L222 HydrophobicContact CG-CD1 4.39Å; I191-L222 HydrophobicContact CD1-CD2 3.8Å; I191-L222 HydrophobicContact CG1-CD1 4.25Å; I191-L222 HydrophobicContact CG1-CD2 3.3Å; I191-L222 HydrophobicContact CG1-CG 4.44Å; D194-L222 WeakPolarHBondContact OD2-CD1 3.28Å; Y218-L222 HydrophobicContact CE1-CD1 3.81Å; Y218-L222 WeakPolarHBondContact O-CB 3.26Å; Y218-L222 PolarHBondContact O-N 3.17Å; F219-L222 PolarHBondContact O-N 3.25Å; L222-K224 VanDerWaalsContact C-N 3.32Å; L222-K224 PolarHBondContact O-N 3.15Å; L222-T225 PolarHBondContact O-N 3.42Å; L222-T225 VanDerWaalsContact O-N 3.14Å; L222-A226 WeakPolarHBondContact O-CB 3.49Å; L222-A226 PolarHBondContact O-N 3.1Å; L222-L250 HydrophobicContact CD2-CD2 3.59Å
223	K	91.4	Very high	87.3	Confident	59 Å²	59	68 Å²	68	26%	0.257	32%	0.316	S	S	.	.	H	α-helix	trans	-56.7	-44.7	172.7	179.4	177.5	-164.2	-36.7	0	111.6	F219 T225 A226 D227 L250 I254	F219-K223 WeakPolarHBondContact O-CB 3.41Å; F219-K223 PolarHBondContact O-N 3.15Å; K223-T225 VanDerWaalsContact C-N 3.33Å; K223-T225 PolarHBondContact O-N 3.41Å; K223-A226 PolarHBondContact O-N 3.1Å; K223-D227 IonicContact NZ-OD1 3.75Å; K223-D227 PolarHBondContact NZ-OD1 3.26Å; K223-D227 IonicContact NZ-OD2 3.8Å; K223-D227 PolarHBondContact NZ-OD2 3.29Å; K223-D227 WeakPolarHBondContact O-CB 3.47Å; K223-D227 PolarHBondContact O-N 2.87Å; K223-L250 HydrophobicContact CB-CD1 4.23Å; K223-L250 HydrophobicContact CB-CD2 4.07Å; K223-L250 HydrophobicContact CG-CD1 4.13Å; K223-I254 HydrophobicContact CB-CD1 3.64Å; K223-I254 HydrophobicContact CD-CD1 3.69Å; K223-I254 HydrophobicContact CG-CD1 4.21Å
224	K	90.5	Very high	87.1	Confident	127 Å²	127	66.9 Å²	66.9	55%	0.552	31%	0.314	S	S	*	.	H	α-helix	trans	-58.9	-44.7	176.7	-175.6	-176.2	174	-172.9	0	111.7	E220 N221 L222 E228	E220-K224 PolarHBondContact O-N 2.71Å; N221-K224 WeakPolarHBondContact O-CB 3.39Å; N221-K224 PolarHBondContact O-N 3.05Å; L222-K224 VanDerWaalsContact C-N 3.32Å; L222-K224 PolarHBondContact O-N 3.15Å; K224-E228 WeakPolarHBondContact CE-OE1 3.35Å; K224-E228 WeakPolarHBondContact O-CG 3.44Å; K224-E228 PolarHBondContact O-N 2.96Å; K224-E228 VanDerWaalsContact O-N 3.09Å
225	T	88	Confident	86.8	Confident	76 Å²	76	71 Å²	71	47%	0.466	33%	0.334	S	S	.	.	H	α-helix	trans	-65.6	-37.9	175.7	-59.6	0	0	0	0	112.2	N221 L222 K223 N229	N221-T225 PolarHBondContact O-N 2.88Å; N221-T225 PolarHBondContact O-OG1 3.43Å; L222-T225 PolarHBondContact O-N 3.42Å; L222-T225 VanDerWaalsContact O-N 3.14Å; K223-T225 VanDerWaalsContact C-N 3.33Å; K223-T225 PolarHBondContact O-N 3.41Å; T225-N229 PolarHBondContact O-N 3.04Å; T225-N229 PolarHBondContact O-ND2 3.07Å
226	A	88.7	Confident	86.5	Confident	1 Å²	1	73.3 Å²	73.3	1%	0.008	34%	0.342	C	S	.	.	H	α-helix	trans	-65.7	-49.7	175.3	0	0	0	0	0	111.1	I187 L222 K223 E228 N229 I230 I246 L250	I187-A226 HydrophobicContact CG2-CB 3.9Å; L222-A226 WeakPolarHBondContact O-CB 3.49Å; L222-A226 PolarHBondContact O-N 3.1Å; K223-A226 PolarHBondContact O-N 3.1Å; A226-E228 PolarHBondContact O-N 3.35Å; A226-N229 PolarHBondContact O-N 3.09Å; A226-I230 HydrophobicContact CB-CD1 4.29Å; A226-I230 WeakPolarHBondContact O-CB 3.29Å; A226-I230 WeakPolarHBondContact O-CG1 3.48Å; A226-I230 PolarHBondContact O-N 3.38Å; A226-I246 HydrophobicContact CB-CG2 4.37Å; A226-L250 HydrophobicContact CB-CD1 3.73Å
227	D	89.4	Confident	86.1	Confident	44 Å²	44	77.2 Å²	77.2	24%	0.235	37%	0.369	C	S	.	.	H	α-helix	trans	-54.9	-39.7	177.1	-71.5	-8	0	0	0	111.5	K223 I230 R231	K223-D227 IonicContact NZ-OD1 3.75Å; K223-D227 PolarHBondContact NZ-OD1 3.26Å; K223-D227 IonicContact NZ-OD2 3.8Å; K223-D227 PolarHBondContact NZ-OD2 3.29Å; K223-D227 WeakPolarHBondContact O-CB 3.47Å; K223-D227 PolarHBondContact O-N 2.87Å; D227-I230 PolarHBondContact O-N 3.48Å; D227-R231 WeakPolarHBondContact O-CB 3.47Å; D227-R231 VanDerWaalsContact O-CG 3.23Å; D227-R231 WeakPolarHBondContact O-CG 3.27Å; D227-R231 PolarHBondContact O-N 2.97Å
228	E	87.3	Confident	85.8	Confident	103 Å²	103	72.9 Å²	72.9	48%	0.481	37%	0.366	S	S	.	.	H	α-helix	trans	-63.2	-39.2	176.1	-76.4	171.5	-170.8	0	0	112.7	K224 A226	K224-E228 WeakPolarHBondContact CE-OE1 3.35Å; K224-E228 WeakPolarHBondContact O-CG 3.44Å; K224-E228 PolarHBondContact O-N 2.96Å; K224-E228 VanDerWaalsContact O-N 3.09Å; A226-E228 PolarHBondContact O-N 3.35Å
229	N	85.2	Confident	85.7	Confident	43 Å²	43	68.5 Å²	68.5	23%	0.23	35%	0.349	C	S	.	.	H	α-helix	trans	-78.1	-35.9	176.6	-70.3	-66.3	0	0	0	112.4	I187 T225 A226 M232	I187-N229 HydrophobicContact CD1-CB 3.62Å; I187-N229 WeakPolarHBondContact CD1-ND2 3.37Å; T225-N229 PolarHBondContact O-N 3.04Å; T225-N229 PolarHBondContact O-ND2 3.07Å; A226-N229 PolarHBondContact O-N 3.09Å; N229-M232 WeakPolarHBondContact O-CB 3.39Å; N229-M232 PolarHBondContact O-N 3.39Å
230	I	86.6	Confident	85.5	Confident	14 Å²	14	72.5 Å²	72.5	7%	0.072	37%	0.37	C	S	.	.	H	α-helix	trans	-65.3	-39.7	178.1	-73	171.1	0	0	0	110.8	L184 A226 D227 M232 L233 R243 I246	L184-I230 HydrophobicContact CD2-CG1 3.94Å; A226-I230 HydrophobicContact CB-CD1 4.29Å; A226-I230 WeakPolarHBondContact O-CB 3.29Å; A226-I230 WeakPolarHBondContact O-CG1 3.48Å; A226-I230 PolarHBondContact O-N 3.38Å; D227-I230 PolarHBondContact O-N 3.48Å; I230-M232 PolarHBondContact O-N 3.43Å; I230-L233 WeakPolarHBondContact O-CA 3.48Å; I230-L233 VanDerWaalsContact O-CB 3.29Å; I230-L233 WeakPolarHBondContact O-CB 3.49Å; I230-L233 PolarHBondContact O-N 2.94Å; I230-R243 HydrophobicContact CG1-CG 4.38Å; I230-R243 HydrophobicContact CG2-CB 4.39Å; I230-R243 HydrophobicContact CG2-CG 4.01Å; I230-I246 HydrophobicContact CD1-CG2 3.9Å
231	R	84.5	Confident	85.6	Confident	178 Å²	178	69.6 Å²	69.6	67%	0.672	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-60.1	-26.6	176.2	-77.5	173.8	-167.4	-152.5	4.3	113.8	D227 L233	D227-R231 WeakPolarHBondContact O-CB 3.47Å; D227-R231 VanDerWaalsContact O-CG 3.23Å; D227-R231 WeakPolarHBondContact O-CG 3.27Å; D227-R231 PolarHBondContact O-N 2.97Å; R231-L233 PolarHBondContact O-N 3.24Å
232	M	79.4	Confident	85.7	Confident	123 Å²	123	65 Å²	65	61%	0.606	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-68.8	-13.3	175	-59.3	-170.9	179.5	0	0	112.6	Q180 N229 I230	Q180-M232 PolarHBondContact OE1-O 3.35Å; N229-M232 WeakPolarHBondContact O-CB 3.39Å; N229-M232 PolarHBondContact O-N 3.39Å; I230-M232 PolarHBondContact O-N 3.43Å
233	L	80.1	Confident	85.7	Confident	2 Å²	2	66 Å²	66	1%	0.01	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-110.6	1.1	-174.6	-68.1	164	0	0	0	113.6	Q180 L184 I230 R231 D235 W236 T239 R243	Q180-L233 HydrophobicContact CB-CD1 4.48Å; Q180-L233 HydrophobicContact CB-CD2 3.67Å; Q180-L233 HydrophobicContact CB-CG 4.27Å; Q180-L233 HydrophobicContact CG-CD2 4.5Å; L184-L233 HydrophobicContact CD1-CD1 3.5Å; L184-L233 VanDerWaalsContact CD1-CD1 3.5Å; L184-L233 HydrophobicContact CD2-CD1 3.67Å; L184-L233 HydrophobicContact CG-CD1 3.51Å; I230-L233 WeakPolarHBondContact O-CA 3.48Å; I230-L233 VanDerWaalsContact O-CB 3.29Å; I230-L233 WeakPolarHBondContact O-CB 3.49Å; I230-L233 PolarHBondContact O-N 2.94Å; R231-L233 PolarHBondContact O-N 3.24Å; L233-D235 PolarHBondContact O-N 3.45Å; L233-D235 VanDerWaalsContact O-N 3.13Å; L233-W236 HydrophobicContact CD2-CD2 4.09Å; L233-W236 HydrophobicContact CD2-CE3 3.16Å; L233-W236 HydrophobicContact CD2-CH2 4.3Å; L233-W236 HydrophobicContact CD2-CZ3 3.23Å; L233-W236 PolarHBondContact O-N 3.44Å; L233-T239 HydrophobicContact CD2-CG2 4.13Å; L233-R243 PolarHBondContact O-NH1 2.98Å
234	D	79.1	Confident	85.7	Confident	95 Å²	95	68.3 Å²	68.3	51%	0.508	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-33.1	-175.4	-77.9	-18.7	0	0	0	112.3	W236	D234-W236 PolarHBondContact O-N 2.89Å
235	D	77.7	Confident	85.8	Confident	147 Å²	147	62.5 Å²	62.5	79%	0.786	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-4.9	179.6	-68.3	-31	0	0	0	113.9	L233 P237	L233-D235 PolarHBondContact O-N 3.45Å; L233-D235 VanDerWaalsContact O-N 3.13Å; D235-P237 WeakPolarHBondContact O-CD 3.32Å
236	W	79.3	Confident	86.1	Confident	54 Å²	54	58.9 Å²	58.9	21%	0.205	30%	0.303	C	S	.	.			trans	-115.9	101.5	-171.1	-61.3	-6.6	0	0	0	113	E177 Q180 L233 D234 G238 T239 R243	E177-W236 HydrophobicContact CB-CE3 3.99Å; E177-W236 HydrophobicContact CB-CH2 3.77Å; E177-W236 HydrophobicContact CB-CZ2 4.29Å; E177-W236 HydrophobicContact CB-CZ3 3.63Å; E177-W236 HydrophobicContact CG-CD2 3.72Å; E177-W236 HydrophobicContact CG-CE3 3.64Å; E177-W236 HydrophobicContact CG-CH2 3.35Å; E177-W236 HydrophobicContact CG-CZ2 3.34Å; E177-W236 HydrophobicContact CG-CZ3 3.51Å; Q180-W236 HydrophobicContact CB-CH2 4.35Å; Q180-W236 HydrophobicContact CB-CZ3 3.92Å; Q180-W236 HydrophobicContact CG-CH2 4.1Å; Q180-W236 HydrophobicContact CG-CZ3 4.17Å; L233-W236 HydrophobicContact CD2-CD2 4.09Å; L233-W236 HydrophobicContact CD2-CE3 3.16Å; L233-W236 HydrophobicContact CD2-CH2 4.3Å; L233-W236 HydrophobicContact CD2-CZ3 3.23Å; L233-W236 PolarHBondContact O-N 3.44Å; D234-W236 PolarHBondContact O-N 2.89Å; W236-G238 PolarHBondContact O-N 3.46Å; W236-T239 PolarHBondContact O-N 2.82Å; W236-T239 PolarHBondContact O-OG1 3.31Å; W236-T239 VanDerWaalsContact O-OG1 3.05Å; W236-R243 PolarHBondContact O-NH1 3.49Å; W236-R243 VanDerWaalsContact O-NH1 3.08Å
237	P	81.6	Confident	86.2	Confident	102 Å²	102	61.7 Å²	61.7	66%	0.662	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-60.6	-29	-177	-24.7	33.8	0	0	0	114.5	D235 T239 I240	D235-P237 WeakPolarHBondContact O-CD 3.32Å; P237-T239 PolarHBondContact O-N 3.36Å; P237-T239 VanDerWaalsContact O-N 3.16Å; P237-I240 HydrophobicContact CB-CD1 4.16Å; P237-I240 WeakPolarHBondContact O-CB 3.32Å; P237-I240 VanDerWaalsContact O-CD1 3.29Å; P237-I240 WeakPolarHBondContact O-CD1 3.5Å; P237-I240 WeakPolarHBondContact O-CG1 3.44Å; P237-I240 PolarHBondContact O-N 3.4Å
238	G	81.3	Confident	86.4	Confident	43 Å²	43	62.1 Å²	62.1	44%	0.443	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-63.6	-19.2	-179.3	0	0	0	0	0	114.1	L142 W236	L142-G238 WeakPolarHBondContact CD1-O 3.38Å; W236-G238 PolarHBondContact O-N 3.46Å
239	T	86.6	Confident	86.7	Confident	2 Å²	2	57.2 Å²	57.2	1%	0.012	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-97.1	4.5	-179.3	62.4	0	0	0	0	113.8	L142 V181 L233 W236 P237 T241 L242 R243	L142-T239 HydrophobicContact CD2-CG2 4.14Å; V181-T239 HydrophobicContact CG2-CG2 3.65Å; L233-T239 HydrophobicContact CD2-CG2 4.13Å; W236-T239 PolarHBondContact O-N 2.82Å; W236-T239 PolarHBondContact O-OG1 3.31Å; W236-T239 VanDerWaalsContact O-OG1 3.05Å; P237-T239 PolarHBondContact O-N 3.36Å; P237-T239 VanDerWaalsContact O-N 3.16Å; T239-T241 VanDerWaalsContact C-N 3.34Å; T239-T241 PolarHBondContact O-N 2.93Å; T239-L242 PolarHBondContact O-N 2.93Å; T239-R243 WeakPolarHBondContact O-CB 3.34Å; T239-R243 VanDerWaalsContact O-CG 3.25Å; T239-R243 WeakPolarHBondContact O-CG 3.39Å; T239-R243 PolarHBondContact O-N 3.13Å; T239-R243 PolarHBondContact OG1-NH1 2.93Å
240	I	88.5	Confident	87	Confident	86 Å²	86	55.2 Å²	55.2	44%	0.441	28%	0.284	S	S	.	.	H	α-helix	trans	-56.3	-46.8	-177.2	-70.1	166.5	0	0	0	111.6	P237 R243 Q244	P237-I240 HydrophobicContact CB-CD1 4.16Å; P237-I240 WeakPolarHBondContact O-CB 3.32Å; P237-I240 VanDerWaalsContact O-CD1 3.29Å; P237-I240 WeakPolarHBondContact O-CD1 3.5Å; P237-I240 WeakPolarHBondContact O-CG1 3.44Å; P237-I240 PolarHBondContact O-N 3.4Å; I240-R243 PolarHBondContact O-N 3.24Å; I240-Q244 WeakPolarHBondContact O-CB 3.41Å; I240-Q244 PolarHBondContact O-N 3.32Å
241	T	90.8	Very high	87.3	Confident	52 Å²	52	57.5 Å²	57.5	32%	0.319	30%	0.297	S	S	.	.	H	α-helix	trans	-64.8	-48	-179	51.3	0	0	0	0	111.3	E138 T239 R243 Q244 T245	E138-T241 WeakPolarHBondContact OE2-CB 3.44Å; E138-T241 PolarHBondContact OE2-OG1 3.14Å; T239-T241 VanDerWaalsContact C-N 3.34Å; T239-T241 PolarHBondContact O-N 2.93Å; T241-R243 VanDerWaalsContact C-N 3.35Å; T241-R243 PolarHBondContact O-N 3.02Å; T241-Q244 WeakPolarHBondContact O-CB 3.27Å; T241-Q244 PolarHBondContact O-N 3.45Å; T241-Q244 VanDerWaalsContact O-N 3.17Å; T241-T245 PolarHBondContact O-N 2.9Å; T241-T245 PolarHBondContact O-OG1 3.21Å
242	L	92.7	Very high	87.6	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-58.1	-43.2	176	-61.8	-178.8	0	0	0	113	F135 E138 L139 L142 V181 L184 T239 T245 I246	F135-L242 HydrophobicContact CD1-CD2 4.44Å; F135-L242 HydrophobicContact CD2-CB 4.33Å; F135-L242 HydrophobicContact CD2-CD2 3.7Å; F135-L242 HydrophobicContact CE1-CD2 4.37Å; F135-L242 HydrophobicContact CE2-CB 3.78Å; F135-L242 HydrophobicContact CE2-CD2 3.65Å; F135-L242 HydrophobicContact CE2-CG 4.24Å; F135-L242 HydrophobicContact CG-CD2 4.11Å; F135-L242 HydrophobicContact CZ-CB 4.46Å; F135-L242 HydrophobicContact CZ-CD2 4Å; E138-L242 HydrophobicContact CB-CD2 3.65Å; E138-L242 HydrophobicContact CB-CG 4.49Å; L139-L242 HydrophobicContact CB-CD2 4.18Å; L139-L242 HydrophobicContact CD1-CD1 4.34Å; L142-L242 HydrophobicContact CD2-CD1 4Å; V181-L242 HydrophobicContact CG1-CD1 4.22Å; L184-L242 HydrophobicContact CD1-CB 4.03Å; L184-L242 HydrophobicContact CD1-CD1 4.44Å; T239-L242 PolarHBondContact O-N 2.93Å; L242-T245 PolarHBondContact O-N 3.26Å; L242-I246 WeakPolarHBondContact O-CG1 3.37Å; L242-I246 PolarHBondContact O-N 3.46Å; L242-I246 VanDerWaalsContact O-N 3.07Å
243	R	90.7	Very high	88.1	Confident	36 Å²	36	43.4 Å²	43.4	14%	0.136	24%	0.237	C	C	.	.	H	α-helix	trans	-65.1	-42.2	177.3	-67.9	178.9	-29	-134.1	14.3	110.9	L184 I230 L233 W236 T239 I240 T241 T245 I246 D247	L184-R243 HydrophobicContact CD1-CG 4.25Å; I230-R243 HydrophobicContact CG1-CG 4.38Å; I230-R243 HydrophobicContact CG2-CB 4.39Å; I230-R243 HydrophobicContact CG2-CG 4.01Å; L233-R243 PolarHBondContact O-NH1 2.98Å; W236-R243 PolarHBondContact O-NH1 3.49Å; W236-R243 VanDerWaalsContact O-NH1 3.08Å; T239-R243 WeakPolarHBondContact O-CB 3.34Å; T239-R243 VanDerWaalsContact O-CG 3.25Å; T239-R243 WeakPolarHBondContact O-CG 3.39Å; T239-R243 PolarHBondContact O-N 3.13Å; T239-R243 PolarHBondContact OG1-NH1 2.93Å; I240-R243 PolarHBondContact O-N 3.24Å; T241-R243 VanDerWaalsContact C-N 3.35Å; T241-R243 PolarHBondContact O-N 3.02Å; R243-T245 PolarHBondContact O-N 3.01Å; R243-I246 PolarHBondContact O-N 2.99Å; R243-D247 PolarHBondContact O-N 3.15Å
244	Q	91.5	Very high	88.5	Confident	107 Å²	107	44.8 Å²	44.8	50%	0.5	24%	0.244	S	C	.	.	H	α-helix	trans	-62.3	-41.8	176.4	-175	-179.6	-22.7	0	0	112.1	I240 T241 D247 E248	I240-Q244 WeakPolarHBondContact O-CB 3.41Å; I240-Q244 PolarHBondContact O-N 3.32Å; T241-Q244 WeakPolarHBondContact O-CB 3.27Å; T241-Q244 PolarHBondContact O-N 3.45Å; T241-Q244 VanDerWaalsContact O-N 3.17Å; Q244-D247 PolarHBondContact O-N 3.47Å; Q244-E248 PolarHBondContact NE2-OE1 2.92Å; Q244-E248 PolarHBondContact O-N 3Å
245	T	93.6	Very high	88.9	Confident	5 Å²	5	43 Å²	43	3%	0.031	24%	0.237	C	C	.	.	H	α-helix	trans	-66.6	-38.9	177.8	-55.4	0	0	0	0	112	L131 F135 T241 L242 R243 E248 L249	L131-T245 HydrophobicContact CB-CG2 4.18Å; L131-T245 HydrophobicContact CD2-CG2 3.98Å; L131-T245 WeakPolarHBondContact O-CG2 3.28Å; F135-T245 HydrophobicContact CB-CG2 3.79Å; F135-T245 HydrophobicContact CD2-CG2 4.16Å; F135-T245 HydrophobicContact CG-CG2 4.47Å; T241-T245 PolarHBondContact O-N 2.9Å; T241-T245 PolarHBondContact O-OG1 3.21Å; L242-T245 PolarHBondContact O-N 3.26Å; R243-T245 PolarHBondContact O-N 3.01Å; T245-E248 PolarHBondContact O-N 2.7Å; T245-L249 HydrophobicContact CG2-CD1 4.29Å; T245-L249 WeakPolarHBondContact O-CB 3.41Å; T245-L249 WeakPolarHBondContact O-CG 3.47Å; T245-L249 PolarHBondContact O-N 3.47Å
246	I	93.1	Very high	89	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-62.5	-44.2	172.1	-71.9	169.5	0	0	0	111	F135 L184 E188 I191 A226 I230 L242 R243 E248 L249 L250	F135-I246 HydrophobicContact CD2-CG1 4.36Å; F135-I246 HydrophobicContact CE2-CD1 3.79Å; F135-I246 HydrophobicContact CE2-CG1 3.81Å; F135-I246 HydrophobicContact CZ-CD1 4.31Å; L184-I246 HydrophobicContact CB-CD1 3.92Å; L184-I246 HydrophobicContact CD2-CD1 3.75Å; L184-I246 HydrophobicContact CG-CD1 4.27Å; E188-I246 HydrophobicContact CB-CD1 4.38Å; E188-I246 HydrophobicContact CB-CG1 4.09Å; E188-I246 HydrophobicContact CG-CG1 4.47Å; I191-I246 HydrophobicContact CD1-CG2 3.92Å; A226-I246 HydrophobicContact CB-CG2 4.37Å; I230-I246 HydrophobicContact CD1-CG2 3.9Å; L242-I246 WeakPolarHBondContact O-CG1 3.37Å; L242-I246 PolarHBondContact O-N 3.46Å; L242-I246 VanDerWaalsContact O-N 3.07Å; R243-I246 PolarHBondContact O-N 2.99Å; I246-E248 VanDerWaalsContact C-N 3.34Å; I246-E248 PolarHBondContact O-N 3.2Å; I246-L249 PolarHBondContact O-N 3.26Å; I246-L250 HydrophobicContact CG2-CD1 3.68Å; I246-L250 HydrophobicContact CG2-CG 4.29Å; I246-L250 WeakPolarHBondContact O-CB 3.39Å; I246-L250 VanDerWaalsContact O-CG 3.27Å; I246-L250 WeakPolarHBondContact O-CG 3.3Å; I246-L250 PolarHBondContact O-N 3.41Å
247	D	91.9	Very high	89.1	Confident	60 Å²	60	46.9 Å²	46.9	32%	0.321	25%	0.254	S	S	.	.	H	α-helix	trans	-60.6	-42.1	175	-78	-27.2	0	0	0	111.5	R243 Q244 L249 L250 D251	R243-D247 PolarHBondContact O-N 3.15Å; Q244-D247 PolarHBondContact O-N 3.47Å; D247-L249 PolarHBondContact O-N 3.48Å; D247-L250 PolarHBondContact O-N 3.01Å; D247-D251 VanDerWaalsContact O-CB 3.24Å; D247-D251 WeakPolarHBondContact O-CB 3.5Å; D247-D251 VanDerWaalsContact O-CG 3.31Å; D247-D251 PolarHBondContact O-N 2.83Å
248	E	92.7	Very high	89.4	Confident	53 Å²	53	45.2 Å²	45.2	25%	0.248	24%	0.237	C	C	.	.	H	α-helix	trans	-63.7	-40.3	176.2	-77.3	-168.7	-153.2	0	0	112.9	R127 L131 Q244 T245 I246 M252	R127-E248 IonicContact NH2-OE2 3.38Å; R127-E248 PolarHBondContact NH2-OE2 3.4Å; R127-E248 VanDerWaalsContact NH2-OE2 3.08Å; L131-E248 HydrophobicContact CD1-CB 4.12Å; L131-E248 HydrophobicContact CD2-CB 4.2Å; L131-E248 WeakPolarHBondContact CD2-OE2 3.41Å; Q244-E248 PolarHBondContact NE2-OE1 2.92Å; Q244-E248 PolarHBondContact O-N 3Å; T245-E248 PolarHBondContact O-N 2.7Å; I246-E248 VanDerWaalsContact C-N 3.34Å; I246-E248 PolarHBondContact O-N 3.2Å; E248-M252 WeakPolarHBondContact O-CG 3.38Å; E248-M252 PolarHBondContact O-N 2.99Å
249	L	93.7	Very high	89.8	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-65.1	-46.7	175.2	-76.6	164.2	0	0	0	111.8	I128 L131 E188 I191 V192 L195 T245 I246 D247 D251 M252 G253	I128-L249 HydrophobicContact CG2-CD2 4.47Å; L131-L249 HydrophobicContact CB-CD2 4.04Å; L131-L249 HydrophobicContact CB-CG 4.23Å; L131-L249 HydrophobicContact CD1-CD2 4.35Å; L131-L249 HydrophobicContact CD1-CG 4.41Å; E188-L249 HydrophobicContact CG-CD1 3.68Å; I191-L249 HydrophobicContact CG2-CB 3.72Å; V192-L249 HydrophobicContact CG2-CD1 4.03Å; V192-L249 HydrophobicContact CG2-CD2 3.85Å; L195-L249 HydrophobicContact CD1-CD2 4.1Å; T245-L249 HydrophobicContact CG2-CD1 4.29Å; T245-L249 WeakPolarHBondContact O-CB 3.41Å; T245-L249 WeakPolarHBondContact O-CG 3.47Å; T245-L249 PolarHBondContact O-N 3.47Å; I246-L249 PolarHBondContact O-N 3.26Å; D247-L249 PolarHBondContact O-N 3.48Å; L249-D251 VanDerWaalsContact C-N 3.34Å; L249-D251 PolarHBondContact O-N 3.32Å; L249-M252 HydrophobicContact CB-CE 4.47Å; L249-M252 HydrophobicContact CD2-CE 3.55Å; L249-M252 HydrophobicContact CG-CE 4.25Å; L249-M252 WeakPolarHBondContact O-CB 3.39Å; L249-M252 PolarHBondContact O-N 3.17Å; L249-G253 PolarHBondContact O-N 2.98Å
250	L	92	Very high	89.8	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-62.3	-42.7	175	-71.7	167.3	0	0	0	111.3	I191 L222 K223 A226 I246 D247 M252 G253 I254	I191-L250 HydrophobicContact CD1-CD1 4.37Å; I191-L250 HydrophobicContact CD1-CD2 3.74Å; I191-L250 HydrophobicContact CD1-CG 3.83Å; I191-L250 HydrophobicContact CG1-CD2 4.06Å; L222-L250 HydrophobicContact CD2-CD2 3.59Å; K223-L250 HydrophobicContact CB-CD1 4.23Å; K223-L250 HydrophobicContact CB-CD2 4.07Å; K223-L250 HydrophobicContact CG-CD1 4.13Å; A226-L250 HydrophobicContact CB-CD1 3.73Å; I246-L250 HydrophobicContact CG2-CD1 3.68Å; I246-L250 HydrophobicContact CG2-CG 4.29Å; I246-L250 WeakPolarHBondContact O-CB 3.39Å; I246-L250 VanDerWaalsContact O-CG 3.27Å; I246-L250 WeakPolarHBondContact O-CG 3.3Å; I246-L250 PolarHBondContact O-N 3.41Å; D247-L250 PolarHBondContact O-N 3.01Å; L250-M252 PolarHBondContact O-N 3.46Å; L250-G253 PolarHBondContact O-N 3.38Å; L250-I254 HydrophobicContact CB-CD1 4.48Å; L250-I254 WeakPolarHBondContact O-CG1 3.45Å; L250-I254 PolarHBondContact O-N 3.5Å
251	D	92.3	Very high	89.9	Confident	62 Å²	62	41 Å²	41	33%	0.332	21%	0.205	S	C	.	.	H	α-helix	trans	-60.7	-34.9	176.2	-85.7	-6	0	0	0	111.5	D247 L249 G253 I254 V255	D247-D251 VanDerWaalsContact O-CB 3.24Å; D247-D251 WeakPolarHBondContact O-CB 3.5Å; D247-D251 VanDerWaalsContact O-CG 3.31Å; D247-D251 PolarHBondContact O-N 2.83Å; L249-D251 VanDerWaalsContact C-N 3.34Å; L249-D251 PolarHBondContact O-N 3.32Å; D251-G253 VanDerWaalsContact C-N 3.3Å; D251-G253 PolarHBondContact O-N 2.94Å; D251-I254 PolarHBondContact O-N 3.02Å; D251-V255 HydrophobicContact CB-CG2 3.79Å; D251-V255 WeakPolarHBondContact O-CB 3.41Å; D251-V255 VanDerWaalsContact O-CG2 3.3Å; D251-V255 WeakPolarHBondContact O-CG2 3.43Å; D251-V255 PolarHBondContact O-N 3.44Å
252	M	91.2	Very high	89.8	Confident	5 Å²	5	39 Å²	39	3%	0.025	19%	0.193	C	C	.	.	H	α-helix	trans	-59.9	-38.4	173.8	-76.4	-169.9	-65.6	0	0	113.1	R127 I128 L131 L195 E248 L249 L250 K258 M259	R127-M252 HydrophobicContact CB-SD 4.31Å; R127-M252 HydrophobicContact CG-SD 3.74Å; I128-M252 HydrophobicContact CG1-CE 3.71Å; I128-M252 HydrophobicContact CG1-SD 4.07Å; L131-M252 HydrophobicContact CD1-CE 3.21Å; L131-M252 HydrophobicContact CD1-SD 4Å; L131-M252 HydrophobicContact CG-CE 4.5Å; L195-M252 HydrophobicContact CD1-CE 4.45Å; E248-M252 WeakPolarHBondContact O-CG 3.38Å; E248-M252 PolarHBondContact O-N 2.99Å; L249-M252 HydrophobicContact CB-CE 4.47Å; L249-M252 HydrophobicContact CD2-CE 3.55Å; L249-M252 HydrophobicContact CG-CE 4.25Å; L249-M252 WeakPolarHBondContact O-CB 3.39Å; L249-M252 PolarHBondContact O-N 3.17Å; L250-M252 PolarHBondContact O-N 3.46Å; M252-K258 HydrophobicContact CB-CD 4.35Å; M252-K258 HydrophobicContact CG-CD 3.94Å; M252-M259 WeakPolarHBondContact O-CB 3.21Å; M252-M259 PolarHBondContact O-N 3.14Å; M252-M259 VanDerWaalsContact O-N 3.1Å
253	G	89.5	Confident	89.6	Confident	0 Å²	0	39 Å²	39	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-80.4	-21.6	177.5	0	0	0	0	0	115	H215 L249 L250 D251 P260	H215-G253 PolarHBondContact NE2-O 3.33Å; L249-G253 PolarHBondContact O-N 2.98Å; L250-G253 PolarHBondContact O-N 3.38Å; D251-G253 VanDerWaalsContact C-N 3.3Å; D251-G253 PolarHBondContact O-N 2.94Å; G253-P260 VanDerWaalsContact O-CG 3.23Å; G253-P260 WeakPolarHBondContact O-CG 3.48Å
254	I	89.2	Confident	89.5	Confident	32 Å²	32	41.6 Å²	41.6	16%	0.164	20%	0.203	C	C	.	.	H	α-helix	trans	-110.7	-42.1	-171	-60.6	167.9	0	0	0	112.8	F219 E220 K223 L250 D251 K256	F219-I254 HydrophobicContact CB-CD1 4.27Å; F219-I254 HydrophobicContact CB-CG1 3.67Å; E220-I254 HydrophobicContact CG-CG2 4.48Å; K223-I254 HydrophobicContact CB-CD1 3.64Å; K223-I254 HydrophobicContact CD-CD1 3.69Å; K223-I254 HydrophobicContact CG-CD1 4.21Å; L250-I254 HydrophobicContact CB-CD1 4.48Å; L250-I254 WeakPolarHBondContact O-CG1 3.45Å; L250-I254 PolarHBondContact O-N 3.5Å; D251-I254 PolarHBondContact O-N 3.02Å; I254-K256 PolarHBondContact O-N 3.15Å
255	V	87.7	Confident	89.4	Confident	57 Å²	57	40.6 Å²	40.6	35%	0.345	20%	0.198	S	C	.	.	S	Bend	trans	-67.1	123.3	-173.2	176.3	0	0	0	0	109.5	D251 N257 K258 P260	D251-V255 HydrophobicContact CB-CG2 3.79Å; D251-V255 WeakPolarHBondContact O-CB 3.41Å; D251-V255 VanDerWaalsContact O-CG2 3.3Å; D251-V255 WeakPolarHBondContact O-CG2 3.43Å; D251-V255 PolarHBondContact O-N 3.44Å; V255-N257 VanDerWaalsContact C-N 3.31Å; V255-N257 PolarHBondContact O-N 3.43Å; V255-N257 VanDerWaalsContact O-N 3.14Å; V255-K258 HydrophobicContact CB-CD 4.23Å; V255-K258 HydrophobicContact CB-CG 4.29Å; V255-K258 HydrophobicContact CG1-CG 4.4Å; V255-K258 PolarHBondContact O-N 3.4Å; V255-P260 WeakPolarHBondContact O-CD 3.46Å
256	K	78.4	Confident	89.2	Confident	143 Å²	143	40.8 Å²	40.8	62%	0.622	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-44.8	-53.7	-173.3	-69.1	-174.4	178.4	-178.8	0	112.5	I254 K258 D261	I254-K256 PolarHBondContact O-N 3.15Å; K256-K258 PolarHBondContact O-N 2.89Å; K256-D261 WeakPolarHBondContact O-CB 3.43Å; K256-D261 PolarHBondContact O-N 2.95Å
257	N	83.1	Confident	88.8	Confident	139 Å²	139	43 Å²	43	74%	0.743	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70	7.5	-175.1	-63.2	-3.6	0	0	0	115.7	V255 D261	V255-N257 VanDerWaalsContact C-N 3.31Å; V255-N257 PolarHBondContact O-N 3.43Å; V255-N257 VanDerWaalsContact O-N 3.14Å; N257-D261 WeakPolarHBondContact CA-OD2 3.3Å; N257-D261 PolarHBondContact N-OD2 2.92Å; N257-D261 PolarHBondContact OD1-OD2 3.27Å
258	K	86.4	Confident	88.6	Confident	68 Å²	68	43 Å²	43	30%	0.296	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.4	-119.3	178.7	-62.3	-172.6	179.4	178.1	0	110.5	M252 V255 K256 T262	M252-K258 HydrophobicContact CB-CD 4.35Å; M252-K258 HydrophobicContact CG-CD 3.94Å; V255-K258 HydrophobicContact CB-CD 4.23Å; V255-K258 HydrophobicContact CB-CG 4.29Å; V255-K258 HydrophobicContact CG1-CG 4.4Å; V255-K258 PolarHBondContact O-N 3.4Å; K256-K258 PolarHBondContact O-N 2.89Å; K258-T262 WeakPolarHBondContact O-CB 3.38Å; K258-T262 PolarHBondContact O-N 2.69Å; K258-T262 PolarHBondContact O-OG1 3.16Å
259	M	89.2	Confident	88.4	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-64.9	-43.8	-177.7	-170.5	176.3	-71.6	0	0	113.1	L124 I128 L195 R198 L199 M252 D261 T262 M263	L124-M259 HydrophobicContact CD1-CB 4.42Å; I128-M259 HydrophobicContact CD1-CE 3.79Å; L195-M259 HydrophobicContact CB-CE 4.1Å; L195-M259 HydrophobicContact CD2-CE 3.55Å; L195-M259 HydrophobicContact CD2-SD 3.68Å; L195-M259 HydrophobicContact CG-CE 4.39Å; R198-M259 HydrophobicContact CB-SD 4.48Å; L199-M259 HydrophobicContact CD1-CE 3.86Å; L199-M259 HydrophobicContact CD2-CE 3.68Å; L199-M259 HydrophobicContact CD2-CG 4.36Å; L199-M259 HydrophobicContact CD2-SD 4.31Å; L199-M259 HydrophobicContact CG-CE 3.54Å; L199-M259 HydrophobicContact CG-SD 4.46Å; M252-M259 WeakPolarHBondContact O-CB 3.21Å; M252-M259 PolarHBondContact O-N 3.14Å; M252-M259 VanDerWaalsContact O-N 3.1Å; M259-D261 PolarHBondContact O-N 3.36Å; M259-T262 PolarHBondContact O-N 2.98Å; M259-M263 HydrophobicContact CG-CG 4.1Å; M259-M263 HydrophobicContact CG-SD 3.91Å; M259-M263 WeakPolarHBondContact O-CB 3.37Å; M259-M263 VanDerWaalsContact O-CG 3.27Å; M259-M263 WeakPolarHBondContact O-CG 3.43Å; M259-M263 PolarHBondContact O-N 2.93Å; M259-M263 HydrophobicContact SD-SD 4.47Å
260	P	88.6	Confident	88.1	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-60.3	-43.3	-177.7	-27.2	36.4	0	0	0	114.8	V212 L216 G253 V255 M263 R264	V212-P260 HydrophobicContact CG1-CB 4.17Å; L216-P260 HydrophobicContact CD2-CB 3.92Å; L216-P260 HydrophobicContact CD2-CG 3.58Å; L216-P260 HydrophobicContact CG-CB 4.39Å; L216-P260 HydrophobicContact CG-CG 4.43Å; G253-P260 VanDerWaalsContact O-CG 3.23Å; G253-P260 WeakPolarHBondContact O-CG 3.48Å; V255-P260 WeakPolarHBondContact O-CD 3.46Å; P260-M263 PolarHBondContact O-N 3.34Å; P260-R264 WeakPolarHBondContact O-CG 3.19Å; P260-R264 PolarHBondContact O-N 3.38Å
261	D	88.7	Confident	87.8	Confident	40 Å²	40	49 Å²	49	21%	0.214	25%	0.247	C	C	.	.	H	α-helix	trans	-69.8	-39.7	174.6	-77.1	-22.5	0	0	0	111.4	K256 N257 M259 M263 R264 E265	K256-D261 WeakPolarHBondContact O-CB 3.43Å; K256-D261 PolarHBondContact O-N 2.95Å; N257-D261 WeakPolarHBondContact CA-OD2 3.3Å; N257-D261 PolarHBondContact N-OD2 2.92Å; N257-D261 PolarHBondContact OD1-OD2 3.27Å; M259-D261 PolarHBondContact O-N 3.36Å; D261-M263 VanDerWaalsContact C-N 3.28Å; D261-M263 PolarHBondContact O-N 3.32Å; D261-R264 PolarHBondContact O-N 3.21Å; D261-R264 IonicContact OD1-CZ 3.79Å; D261-R264 IonicContact OD1-NE 2.74Å; D261-R264 PolarHBondContact OD1-NE 3.43Å; D261-R264 IonicContact OD1-NH2 3.46Å; D261-R264 PolarHBondContact OD1-NH2 2.97Å; D261-E265 WeakPolarHBondContact O-CB 3.46Å; D261-E265 VanDerWaalsContact O-CG 3.31Å; D261-E265 WeakPolarHBondContact O-CG 3.36Å; D261-E265 PolarHBondContact O-N 2.83Å
262	T	89.1	Confident	87.6	Confident	12 Å²	12	48 Å²	48	7%	0.074	25%	0.248	C	C	.	.	H	α-helix	trans	-60.1	-40.4	175.3	-56.3	0	0	0	0	111.1	L117 K120 V121 L124 K258 M259 E265 Y266	L117-T262 HydrophobicContact CD2-CG2 4.48Å; K120-T262 HydrophobicContact CB-CG2 4.18Å; V121-T262 HydrophobicContact CG2-CG2 3.82Å; L124-T262 HydrophobicContact CD1-CG2 3.91Å; K258-T262 WeakPolarHBondContact O-CB 3.38Å; K258-T262 PolarHBondContact O-N 2.69Å; K258-T262 PolarHBondContact O-OG1 3.16Å; M259-T262 PolarHBondContact O-N 2.98Å; T262-E265 PolarHBondContact O-N 2.69Å; T262-Y266 WeakPolarHBondContact O-CB 3.24Å; T262-Y266 PolarHBondContact O-N 2.93Å
263	M	88.5	Confident	87.4	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-62	-48.6	173.3	-73.4	173.7	72.3	0	0	111.9	R198 L202 I210 V212 H215 M259 P260 D261 E265 Y266 V267	R198-M263 HydrophobicContact CG-CE 3.76Å; R198-M263 HydrophobicContact CG-SD 4.06Å; R198-M263 VanDerWaalsContact NE-CE 3.28Å; L202-M263 HydrophobicContact CD1-CB 4.46Å; L202-M263 HydrophobicContact CD1-CG 3.47Å; L202-M263 VanDerWaalsContact CD1-CG 3.47Å; L202-M263 HydrophobicContact CD2-CB 4.27Å; L202-M263 HydrophobicContact CD2-CG 4.01Å; L202-M263 HydrophobicContact CG-CG 4.23Å; I210-M263 HydrophobicContact CG2-CE 3.4Å; I210-M263 VanDerWaalsContact CG2-CE 3.4Å; V212-M263 HydrophobicContact CG2-CB 3.96Å; V212-M263 HydrophobicContact CG2-CE 4.4Å; H215-M263 HydrophobicContact CB-CE 4.01Å; H215-M263 HydrophobicContact CB-SD 4.45Å; M259-M263 HydrophobicContact CG-CG 4.1Å; M259-M263 HydrophobicContact CG-SD 3.91Å; M259-M263 WeakPolarHBondContact O-CB 3.37Å; M259-M263 VanDerWaalsContact O-CG 3.27Å; M259-M263 WeakPolarHBondContact O-CG 3.43Å; M259-M263 PolarHBondContact O-N 2.93Å; M259-M263 HydrophobicContact SD-SD 4.47Å; P260-M263 PolarHBondContact O-N 3.34Å; D261-M263 VanDerWaalsContact C-N 3.28Å; D261-M263 PolarHBondContact O-N 3.32Å; M263-E265 PolarHBondContact O-N 3.26Å; M263-Y266 PolarHBondContact O-N 2.9Å; M263-V267 VanDerWaalsContact O-CG2 3.31Å; M263-V267 WeakPolarHBondContact O-CG2 3.5Å; M263-V267 PolarHBondContact O-N 2.95Å
264	R	88.1	Confident	87.3	Confident	89 Å²	89	52.8 Å²	52.8	34%	0.336	27%	0.271	S	S	.	.	H	α-helix	trans	-58.7	-47.2	176.9	-77.6	-173.7	-84.8	-96.8	1.2	111.7	V212 P260 D261 A268	V212-R264 HydrophobicContact CB-CG 4.3Å; V212-R264 HydrophobicContact CG1-CG 4.1Å; V212-R264 HydrophobicContact CG2-CG 3.87Å; P260-R264 WeakPolarHBondContact O-CG 3.19Å; P260-R264 PolarHBondContact O-N 3.38Å; D261-R264 PolarHBondContact O-N 3.21Å; D261-R264 IonicContact OD1-CZ 3.79Å; D261-R264 IonicContact OD1-NE 2.74Å; D261-R264 PolarHBondContact OD1-NE 3.43Å; D261-R264 IonicContact OD1-NH2 3.46Å; D261-R264 PolarHBondContact OD1-NH2 2.97Å; R264-A268 VanDerWaalsContact O-CB 3.26Å; R264-A268 WeakPolarHBondContact O-CB 3.36Å; R264-A268 PolarHBondContact O-N 2.85Å
265	E	89.7	Confident	87.2	Confident	86 Å²	86	54.8 Å²	54.8	40%	0.402	28%	0.282	S	S	.	.	H	α-helix	trans	-64.9	-40.5	178.9	-71	178.9	-178	0	0	111.4	L117 K120 D261 T262 M263 A268 A269	L117-E265 HydrophobicContact CD1-CB 4.12Å; L117-E265 WeakPolarHBondContact CD1-O 3.47Å; L117-E265 HydrophobicContact CD2-CB 3.47Å; L117-E265 VanDerWaalsContact CD2-CB 3.47Å; L117-E265 HydrophobicContact CG-CB 4.43Å; K120-E265 IonicContact NZ-OE1 3.38Å; K120-E265 IonicContact NZ-OE2 3.44Å; K120-E265 PolarHBondContact NZ-OE2 3.46Å; D261-E265 WeakPolarHBondContact O-CB 3.46Å; D261-E265 VanDerWaalsContact O-CG 3.31Å; D261-E265 WeakPolarHBondContact O-CG 3.36Å; D261-E265 PolarHBondContact O-N 2.83Å; T262-E265 PolarHBondContact O-N 2.69Å; M263-E265 PolarHBondContact O-N 3.26Å; E265-A268 PolarHBondContact O-N 3.41Å; E265-A269 VanDerWaalsContact O-CB 3.29Å; E265-A269 WeakPolarHBondContact O-CB 3.47Å; E265-A269 PolarHBondContact O-N 3.27Å
266	Y	89.4	Confident	87.2	Confident	10 Å²	10	52.7 Å²	52.7	4%	0.039	27%	0.271	C	S	.	.	H	α-helix	trans	-62.2	-50.9	177.5	-164.1	-80.5	0	0	0	111.7	M114 L117 R118 V121 L202 T262 M263 A268 A269 Q270	M114-Y266 HydrophobicContact SD-CE2 4.16Å; L117-Y266 HydrophobicContact CB-CD2 4.02Å; R118-Y266 HydrophobicContact CG-CE2 4.28Å; V121-Y266 HydrophobicContact CG2-CD2 3.95Å; V121-Y266 HydrophobicContact CG2-CE2 4.3Å; L202-Y266 HydrophobicContact CB-CD1 4.42Å; L202-Y266 HydrophobicContact CD2-CD1 4.07Å; L202-Y266 HydrophobicContact CD2-CG 4.26Å; L202-Y266 WeakPolarHBondContact O-CE1 3.37Å; L202-Y266 PolarHBondContact O-OH 3.21Å; T262-Y266 WeakPolarHBondContact O-CB 3.24Å; T262-Y266 PolarHBondContact O-N 2.93Å; M263-Y266 PolarHBondContact O-N 2.9Å; Y266-A268 VanDerWaalsContact C-N 3.33Å; Y266-A268 PolarHBondContact O-N 2.88Å; Y266-A269 PolarHBondContact O-N 3.32Å; Y266-Q270 WeakPolarHBondContact O-CB 3.17Å; Y266-Q270 PolarHBondContact O-N 2.82Å
267	V	85.8	Confident	87.5	Confident	47 Å²	47	47.3 Å²	47.3	29%	0.285	25%	0.251	S	S	.	.	H	α-helix	trans	-61	-42.7	176.7	173.9	0	0	0	0	110.8	I210 M263 A269 Q270 K271	I210-V267 HydrophobicContact CB-CG2 3.92Å; I210-V267 HydrophobicContact CD1-CG2 4.19Å; I210-V267 HydrophobicContact CG2-CG2 4.29Å; M263-V267 VanDerWaalsContact O-CG2 3.31Å; M263-V267 WeakPolarHBondContact O-CG2 3.5Å; M263-V267 PolarHBondContact O-N 2.95Å; V267-A269 PolarHBondContact O-N 2.66Å; V267-Q270 PolarHBondContact O-N 2.89Å; V267-K271 WeakPolarHBondContact O-CB 3.45Å; V267-K271 PolarHBondContact O-N 3.25Å
268	A	87.6	Confident	87.8	Confident	60 Å²	60	48 Å²	48	50%	0.496	24%	0.243	S	C	.	.	H	α-helix	trans	-64.2	-39.3	176.7	0	0	0	0	0	112.6	R264 E265 Y266 A272	R264-A268 VanDerWaalsContact O-CB 3.26Å; R264-A268 WeakPolarHBondContact O-CB 3.36Å; R264-A268 PolarHBondContact O-N 2.85Å; E265-A268 PolarHBondContact O-N 3.41Å; Y266-A268 VanDerWaalsContact C-N 3.33Å; Y266-A268 PolarHBondContact O-N 2.88Å; A268-A272 WeakPolarHBondContact O-CB 3.5Å; A268-A272 PolarHBondContact O-N 2.87Å
269	A	88.2	Confident	87.8	Confident	7 Å²	7	48.3 Å²	48.3	6%	0.058	25%	0.251	C	S	.	.	H	α-helix	trans	-70.4	-37.3	177.3	0	0	0	0	0	112.4	N113 M114 L117 E265 Y266 V267 A272 L273	N113-A269 HydrophobicContact CB-CB 4.42Å; M114-A269 HydrophobicContact CE-CB 4.09Å; L117-A269 HydrophobicContact CD1-CB 3.35Å; E265-A269 VanDerWaalsContact O-CB 3.29Å; E265-A269 WeakPolarHBondContact O-CB 3.47Å; E265-A269 PolarHBondContact O-N 3.27Å; Y266-A269 PolarHBondContact O-N 3.32Å; V267-A269 PolarHBondContact O-N 2.66Å; A269-A272 PolarHBondContact O-N 3.11Å; A269-L273 WeakPolarHBondContact O-CB 3.49Å; A269-L273 PolarHBondContact O-N 2.89Å
270	Q	86.8	Confident	87.7	Confident	36 Å²	36	49.7 Å²	49.7	17%	0.168	26%	0.256	C	S	.	.	H	α-helix	trans	-61.9	-49.3	173.2	-178	176	-19.1	0	0	110.7	M114 Y266 V267 A272 L273 E274	M114-Q270 VanDerWaalsContact CE-CA 3.5Å; M114-Q270 HydrophobicContact CE-CB 3.94Å; Y266-Q270 WeakPolarHBondContact O-CB 3.17Å; Y266-Q270 PolarHBondContact O-N 2.82Å; V267-Q270 PolarHBondContact O-N 2.89Å; Q270-A272 VanDerWaalsContact C-N 3.33Å; Q270-A272 PolarHBondContact O-N 2.89Å; Q270-L273 WeakPolarHBondContact O-CB 3.3Å; Q270-L273 PolarHBondContact O-N 3.45Å; Q270-L273 VanDerWaalsContact O-N 3.09Å; Q270-E274 PolarHBondContact NE2-OE1 3.47Å; Q270-E274 PolarHBondContact O-N 2.95Å
271	K	86.8	Confident	87.6	Confident	134 Å²	134	55.7 Å²	55.7	58%	0.583	28%	0.284	S	S	*	.	H	α-helix	trans	-59.2	-42.3	175.4	-173.1	173.5	-176.7	171.9	0	112.5	V267 L273 E274 D275	V267-K271 WeakPolarHBondContact O-CB 3.45Å; V267-K271 PolarHBondContact O-N 3.25Å; K271-L273 VanDerWaalsContact C-N 3.3Å; K271-L273 PolarHBondContact O-N 3.41Å; K271-E274 PolarHBondContact O-N 3.49Å; K271-D275 WeakPolarHBondContact O-CB 3.34Å; K271-D275 PolarHBondContact O-N 2.71Å
272	A	87.8	Confident	87.6	Confident	42 Å²	42	58.1 Å²	58.1	35%	0.347	30%	0.3	S	S	.	.	H	α-helix	trans	-63	-36	176	0	0	0	0	0	112.6	A268 A269 Q270 A276	A268-A272 WeakPolarHBondContact O-CB 3.5Å; A268-A272 PolarHBondContact O-N 2.87Å; A269-A272 PolarHBondContact O-N 3.11Å; Q270-A272 VanDerWaalsContact C-N 3.33Å; Q270-A272 PolarHBondContact O-N 2.89Å; A272-A276 VanDerWaalsContact O-CB 3.26Å; A272-A276 WeakPolarHBondContact O-CB 3.37Å; A272-A276 PolarHBondContact O-N 2.89Å
273	L	87.5	Confident	87.4	Confident	38 Å²	38	57.7 Å²	57.7	20%	0.199	30%	0.298	C	S	.	.	H	α-helix	trans	-68.8	-40.3	175	-175.7	62.4	0	0	0	111.7	L56 A110 L111 A269 Q270 K271 A276 S277	L56-L273 HydrophobicContact CD2-CD1 3.86Å; A110-L273 HydrophobicContact CB-CB 4.3Å; A110-L273 HydrophobicContact CB-CD1 4.11Å; L111-L273 HydrophobicContact CD2-CD1 3.7Å; L111-L273 HydrophobicContact CD2-CD2 4.28Å; L111-L273 HydrophobicContact CG-CD1 3.99Å; A269-L273 WeakPolarHBondContact O-CB 3.49Å; A269-L273 PolarHBondContact O-N 2.89Å; Q270-L273 WeakPolarHBondContact O-CB 3.3Å; Q270-L273 PolarHBondContact O-N 3.45Å; Q270-L273 VanDerWaalsContact O-N 3.09Å; K271-L273 VanDerWaalsContact C-N 3.3Å; K271-L273 PolarHBondContact O-N 3.41Å; L273-A276 PolarHBondContact O-N 3.34Å; L273-S277 WeakPolarHBondContact O-CB 3.49Å; L273-S277 PolarHBondContact O-N 3.01Å
274	E	87.2	Confident	87.3	Confident	67 Å²	67	59.1 Å²	59.1	31%	0.313	31%	0.305	S	S	.	.	H	α-helix	trans	-64.5	-46	174.3	-73.1	173.2	-161.6	0	0	112.3	Q270 K271 A276 S277 R278	Q270-E274 PolarHBondContact NE2-OE1 3.47Å; Q270-E274 PolarHBondContact O-N 2.95Å; K271-E274 PolarHBondContact O-N 3.49Å; E274-A276 VanDerWaalsContact C-N 3.32Å; E274-A276 PolarHBondContact O-N 3.37Å; E274-S277 WeakPolarHBondContact O-CB 3.39Å; E274-S277 PolarHBondContact O-N 3.31Å; E274-S277 VanDerWaalsContact O-N 3.13Å; E274-R278 WeakPolarHBondContact O-CG 3.26Å; E274-R278 PolarHBondContact O-N 2.59Å
275	D	87.4	Confident	87.2	Confident	74 Å²	74	56.3 Å²	56.3	40%	0.396	30%	0.304	S	S	.	.	H	α-helix	trans	-61.9	-40.9	176.7	-75.7	-23.9	0	0	0	111.3	K271 R278 T279	K271-D275 WeakPolarHBondContact O-CB 3.34Å; K271-D275 PolarHBondContact O-N 2.71Å; D275-R278 PolarHBondContact O-N 3.43Å; D275-T279 WeakPolarHBondContact O-CB 3.32Å; D275-T279 PolarHBondContact O-N 3.2Å; D275-T279 PolarHBondContact O-OG1 2.96Å
276	A	86.6	Confident	87	Confident	13 Å²	13	56.5 Å²	56.5	11%	0.107	30%	0.301	C	S	.	.	H	α-helix	trans	-66	-38.1	173.9	0	0	0	0	0	111.8	L103 L107 A272 L273 E274 T279 R280	L103-A276 WeakPolarHBondContact CD1-O 3.39Å; L107-A276 HydrophobicContact CD2-CB 3.51Å; L107-A276 HydrophobicContact CG-CB 4.05Å; A272-A276 VanDerWaalsContact O-CB 3.26Å; A272-A276 WeakPolarHBondContact O-CB 3.37Å; A272-A276 PolarHBondContact O-N 2.89Å; L273-A276 PolarHBondContact O-N 3.34Å; E274-A276 VanDerWaalsContact C-N 3.32Å; E274-A276 PolarHBondContact O-N 3.37Å; A276-T279 PolarHBondContact O-N 2.73Å; A276-R280 PolarHBondContact O-N 3.05Å
277	S	85.9	Confident	86.7	Confident	30 Å²	30	56.1 Å²	56.1	21%	0.21	30%	0.299	C	S	.	.	H	α-helix	trans	-65.4	-39.1	174.9	-171	0	0	0	0	112.7	L273 E274 R280 E281	L273-S277 WeakPolarHBondContact O-CB 3.49Å; L273-S277 PolarHBondContact O-N 3.01Å; E274-S277 WeakPolarHBondContact O-CB 3.39Å; E274-S277 PolarHBondContact O-N 3.31Å; E274-S277 VanDerWaalsContact O-N 3.13Å; S277-R280 WeakPolarHBondContact O-CB 3.35Å; S277-R280 PolarHBondContact O-N 3.45Å; S277-R280 PolarHBondContact OG-NH2 3.37Å; S277-E281 PolarHBondContact O-N 3.46Å
278	R	87.5	Confident	86.5	Confident	155 Å²	155	61.7 Å²	61.7	59%	0.585	32%	0.315	S	S	*	.	H	α-helix	trans	-65.1	-43.1	172.4	-70.5	177	-173.6	-177.8	4.5	111.7	E274 D275 R280 E281 V282	E274-R278 WeakPolarHBondContact O-CG 3.26Å; E274-R278 PolarHBondContact O-N 2.59Å; D275-R278 PolarHBondContact O-N 3.43Å; R278-R280 PolarHBondContact O-N 3.45Å; R278-E281 PolarHBondContact O-N 3.02Å; R278-V282 PolarHBondContact O-N 3.07Å
279	T	87.3	Confident	86.4	Confident	73 Å²	73	64.5 Å²	64.5	45%	0.448	32%	0.32	S	S	.	.	H	α-helix	trans	-61.4	-34.5	176.4	-54.4	0	0	0	0	111.5	L103 D275 A276 V282 T283	L103-T279 HydrophobicContact CD1-CG2 3.91Å; D275-T279 WeakPolarHBondContact O-CB 3.32Å; D275-T279 PolarHBondContact O-N 3.2Å; D275-T279 PolarHBondContact O-OG1 2.96Å; A276-T279 PolarHBondContact O-N 2.73Å; T279-V282 PolarHBondContact O-N 2.96Å; T279-T283 WeakPolarHBondContact O-CB 3.24Å; T279-T283 PolarHBondContact O-N 3.43Å; T279-T283 PolarHBondContact O-OG1 2.88Å
280	R	87.5	Confident	86.1	Confident	30 Å²	30	65.3 Å²	65.3	11%	0.113	32%	0.323	C	S	.	.	H	α-helix	trans	-61.3	-49	173.5	172.4	-163.1	64.7	146.5	2.7	111.9	N53 L56 L103 L107 A276 S277 R278 V282 T283 L284	N53-R280 PolarHBondContact OD1-NH1 3.26Å; L56-R280 VanDerWaalsContact CD1-CZ 3.46Å; L103-R280 HydrophobicContact CD1-CB 3.85Å; L103-R280 VanDerWaalsContact CD2-CA 3.48Å; L103-R280 HydrophobicContact CD2-CB 3.75Å; L103-R280 HydrophobicContact CD2-CG 4.09Å; L103-R280 HydrophobicContact CG-CB 4.29Å; L107-R280 HydrophobicContact CD1-CB 4.5Å; A276-R280 PolarHBondContact O-N 3.05Å; S277-R280 WeakPolarHBondContact O-CB 3.35Å; S277-R280 PolarHBondContact O-N 3.45Å; S277-R280 PolarHBondContact OG-NH2 3.37Å; R278-R280 PolarHBondContact O-N 3.45Å; R280-V282 VanDerWaalsContact C-N 3.31Å; R280-V282 PolarHBondContact O-N 3.29Å; R280-T283 PolarHBondContact O-N 3.07Å; R280-L284 HydrophobicContact CG-CD1 3.83Å; R280-L284 HydrophobicContact CG-CG 4.3Å; R280-L284 WeakPolarHBondContact O-CB 3.44Å; R280-L284 WeakPolarHBondContact O-CG 3.29Å; R280-L284 PolarHBondContact O-N 3.25Å
281	E	86.3	Confident	85.6	Confident	126 Å²	126	64.2 Å²	64.2	59%	0.589	32%	0.318	S	S	*	.	H	α-helix	trans	-59.1	-43.3	179.1	-70.4	179	179.9	0	0	111.8	S277 R278 G285	S277-E281 PolarHBondContact O-N 3.46Å; R278-E281 PolarHBondContact O-N 3.02Å; E281-G285 PolarHBondContact O-N 3.27Å
282	V	88.7	Confident	85.3	Confident	92 Å²	92	62.9 Å²	62.9	56%	0.558	31%	0.314	S	S	*	.	H	α-helix	trans	-64.5	-43	176.6	176.1	0	0	0	0	111.9	R278 T279 R280 G285 R286	R278-V282 PolarHBondContact O-N 3.07Å; T279-V282 PolarHBondContact O-N 2.96Å; R280-V282 VanDerWaalsContact C-N 3.31Å; R280-V282 PolarHBondContact O-N 3.29Å; V282-G285 PolarHBondContact O-N 3.23Å; V282-R286 WeakPolarHBondContact O-CG 3.26Å; V282-R286 PolarHBondContact O-N 3.33Å
283	T	85.7	Confident	84.8	Confident	3 Å²	3	64 Å²	64	2%	0.018	32%	0.324	C	S	.	.	H	α-helix	trans	-69.7	-44	-177.6	-56.5	0	0	0	0	111.6	D99 L103 T279 R280 G285 R286 F287	D99-T283 HydrophobicContact CB-CG2 4.14Å; L103-T283 HydrophobicContact CD2-CG2 4.36Å; T279-T283 WeakPolarHBondContact O-CB 3.24Å; T279-T283 PolarHBondContact O-N 3.43Å; T279-T283 PolarHBondContact O-OG1 2.88Å; R280-T283 PolarHBondContact O-N 3.07Å; T283-G285 VanDerWaalsContact C-N 3.34Å; T283-R286 PolarHBondContact O-N 2.98Å; T283-F287 PolarHBondContact O-N 2.95Å
284	L	84.6	Confident	84.1	Confident	29 Å²	29	63 Å²	63	15%	0.152	32%	0.317	C	S	.	.	H	α-helix	trans	-65.5	-38.1	175.1	-67.4	180	0	0	0	111.7	V49 L52 R280 R286 F287 R288	V49-L284 HydrophobicContact CG1-CD1 4.37Å; V49-L284 HydrophobicContact CG2-CD1 4.15Å; V49-L284 HydrophobicContact CG2-CD2 3.8Å; V49-L284 HydrophobicContact CG2-CG 4.5Å; L52-L284 HydrophobicContact CD1-CD2 4.21Å; R280-L284 HydrophobicContact CG-CD1 3.83Å; R280-L284 HydrophobicContact CG-CG 4.3Å; R280-L284 WeakPolarHBondContact O-CB 3.44Å; R280-L284 WeakPolarHBondContact O-CG 3.29Å; R280-L284 PolarHBondContact O-N 3.25Å; L284-R286 PolarHBondContact O-N 3.4Å; L284-F287 PolarHBondContact O-N 2.76Å; L284-R288 PolarHBondContact O-N 3.41Å
285	G	86	Confident	83.2	Confident	31 Å²	31	63 Å²	63	32%	0.32	32%	0.32	S	S	.	.	H	α-helix	trans	-59.6	-44.9	173.5	0	0	0	0	0	112.7	E281 V282 T283 F287 R288 M289	E281-G285 PolarHBondContact O-N 3.27Å; V282-G285 PolarHBondContact O-N 3.23Å; T283-G285 VanDerWaalsContact C-N 3.34Å; G285-F287 PolarHBondContact O-N 3.03Å; G285-R288 PolarHBondContact O-N 3.3Å; G285-M289 WeakPolarHBondContact O-CG 3.43Å; G285-M289 PolarHBondContact O-N 3Å
286	R	85.8	Confident	82.4	Confident	90 Å²	90	61.2 Å²	61.2	34%	0.34	32%	0.319	S	S	.	.	H	α-helix	trans	-62.4	-41.3	174.6	-75	-172.6	-67.1	148.6	1.4	112.6	D99 V282 T283 L284 M289 L290	D99-R286 IonicContact OD2-CZ 3.31Å; D99-R286 IonicContact OD2-NH1 2.67Å; D99-R286 PolarHBondContact OD2-NH1 3.18Å; D99-R286 IonicContact OD2-NH2 2.71Å; D99-R286 PolarHBondContact OD2-NH2 3.38Å; V282-R286 WeakPolarHBondContact O-CG 3.26Å; V282-R286 PolarHBondContact O-N 3.33Å; T283-R286 PolarHBondContact O-N 2.98Å; L284-R286 PolarHBondContact O-N 3.4Å; R286-M289 HydrophobicContact CG-CE 4.08Å; R286-L290 PolarHBondContact O-N 3.03Å
287	F	83.5	Confident	81.6	Confident	1 Å²	1	62.3 Å²	62.3	0%	0.004	33%	0.325	C	S	.	.	H	α-helix	trans	-60.5	-49.5	176.6	-154.4	-54.8	0	0	0	110.9	I41 L45 I78 L93 I96 L97 T283 L284 G285 M289 L290 L291	I41-F287 HydrophobicContact CG2-CE1 4.28Å; I41-F287 HydrophobicContact CG2-CZ 4.4Å; L45-F287 HydrophobicContact CB-CD1 4.48Å; L45-F287 HydrophobicContact CB-CE1 4.07Å; L45-F287 HydrophobicContact CB-CZ 4.48Å; L45-F287 HydrophobicContact CD1-CB 4.2Å; L45-F287 HydrophobicContact CD1-CD1 3.49Å; L45-F287 VanDerWaalsContact CD1-CD1 3.49Å; L45-F287 HydrophobicContact CD1-CD2 3.63Å; L45-F287 HydrophobicContact CD1-CE1 3.64Å; L45-F287 HydrophobicContact CD1-CE2 3.81Å; L45-F287 HydrophobicContact CD1-CG 3.49Å; L45-F287 VanDerWaalsContact CD1-CG 3.49Å; L45-F287 HydrophobicContact CD1-CZ 3.8Å; L45-F287 HydrophobicContact CD2-CB 4.38Å; L45-F287 HydrophobicContact CD2-CD1 3.25Å; L45-F287 HydrophobicContact CD2-CE1 3.65Å; L45-F287 HydrophobicContact CD2-CG 3.94Å; L45-F287 HydrophobicContact CG-CD1 3.89Å; L45-F287 HydrophobicContact CG-CE1 3.97Å; L45-F287 HydrophobicContact CG-CG 4.33Å; I78-F287 HydrophobicContact CD1-CZ 4.14Å; I78-F287 HydrophobicContact CG2-CZ 4.04Å; L93-F287 HydrophobicContact CD1-CE1 3.98Å; L93-F287 HydrophobicContact CD1-CE2 4.07Å; L93-F287 HydrophobicContact CD1-CZ 3.57Å; I96-F287 HydrophobicContact CB-CD2 4.44Å; I96-F287 HydrophobicContact CG2-CB 3.86Å; I96-F287 HydrophobicContact CG2-CD2 3.23Å; I96-F287 HydrophobicContact CG2-CE2 3.96Å; I96-F287 HydrophobicContact CG2-CG 3.77Å; L97-F287 HydrophobicContact CD2-CE2 4.3Å; T283-F287 PolarHBondContact O-N 2.95Å; L284-F287 PolarHBondContact O-N 2.76Å; G285-F287 PolarHBondContact O-N 3.03Å; F287-M289 PolarHBondContact O-N 3.21Å; F287-L290 PolarHBondContact O-N 3.28Å; F287-L291 HydrophobicContact CD1-CD1 4.11Å; F287-L291 HydrophobicContact CD1-CG 4.18Å; F287-L291 HydrophobicContact CE1-CD1 4.03Å; F287-L291 HydrophobicContact CE1-CG 4.11Å; F287-L291 PolarHBondContact O-N 3.07Å; F287-L291 VanDerWaalsContact O-N 3.11Å
288	R	82.8	Confident	80.8	Confident	165 Å²	165	61.7 Å²	61.7	62%	0.623	32%	0.32	S	S	*	.	H	α-helix	trans	-61.6	-43.4	-179.7	-171.4	175.7	178.5	155.6	6.7	112.6	L284 G285 L290 L291 E292	L284-R288 PolarHBondContact O-N 3.41Å; G285-R288 PolarHBondContact O-N 3.3Å; R288-L290 VanDerWaalsContact C-N 3.28Å; R288-L290 PolarHBondContact O-N 3.26Å; R288-L291 PolarHBondContact O-N 2.86Å; R288-E292 WeakPolarHBondContact CG-OE1 3.49Å; R288-E292 IonicContact NE-OE1 3.57Å; R288-E292 PolarHBondContact NE-OE1 2.96Å; R288-E292 VanDerWaalsContact NE-OE1 3.1Å; R288-E292 WeakPolarHBondContact O-CG 3.35Å; R288-E292 PolarHBondContact O-N 3.14Å
289	M	84.9	Confident	80	Confident	119 Å²	119	59.9 Å²	59.9	59%	0.586	32%	0.318	S	S	*	.	H	α-helix	trans	-59.2	-38.3	175.6	-74.4	-171.9	-66.5	0	0	112.5	G285 R286 F287 A293	G285-M289 WeakPolarHBondContact O-CG 3.43Å; G285-M289 PolarHBondContact O-N 3Å; R286-M289 HydrophobicContact CG-CE 4.08Å; F287-M289 PolarHBondContact O-N 3.21Å; M289-A293 WeakPolarHBondContact O-CB 3.27Å; M289-A293 PolarHBondContact O-N 3.06Å
290	L	81.2	Confident	79.3	Confident	23 Å²	23	62.3 Å²	62.3	12%	0.12	33%	0.325	C	S	.	.	H	α-helix	trans	-67.1	-42.7	177.2	-171.8	146.4	0	0	0	111.5	Q92 L93 I96 R286 F287 R288 A293 Q294	Q92-L290 HydrophobicContact CB-CD1 3.47Å; Q92-L290 VanDerWaalsContact CB-CD1 3.47Å; Q92-L290 HydrophobicContact CG-CD1 4.5Å; L93-L290 HydrophobicContact CD1-CD2 4.47Å; I96-L290 HydrophobicContact CD1-CB 3.99Å; I96-L290 HydrophobicContact CD1-CD1 3.63Å; I96-L290 HydrophobicContact CD1-CG 4.38Å; R286-L290 PolarHBondContact O-N 3.03Å; F287-L290 PolarHBondContact O-N 3.28Å; R288-L290 VanDerWaalsContact C-N 3.28Å; R288-L290 PolarHBondContact O-N 3.26Å; L290-A293 PolarHBondContact O-N 2.7Å; L290-Q294 WeakPolarHBondContact O-CB 3.44Å; L290-Q294 PolarHBondContact O-N 3.02Å
291	L	77.2	Confident	78.5	Confident	13 Å²	13	64.4 Å²	64.4	7%	0.068	34%	0.336	C	S	.	.	H	α-helix	trans	-63.5	-42.4	175.3	-80.1	-179.5	0	0	0	112.6	I41 E42 L45 F287 R288 A293 Q294 L295	I41-L291 HydrophobicContact CG2-CD2 4.02Å; E42-L291 HydrophobicContact CB-CD1 4.19Å; E42-L291 HydrophobicContact CG-CD1 4.31Å; L45-L291 HydrophobicContact CB-CD1 4.26Å; L45-L291 HydrophobicContact CD2-CD1 3.3Å; L45-L291 HydrophobicContact CD2-CG 4.43Å; L45-L291 HydrophobicContact CG-CD1 4.41Å; F287-L291 HydrophobicContact CD1-CD1 4.11Å; F287-L291 HydrophobicContact CD1-CG 4.18Å; F287-L291 HydrophobicContact CE1-CD1 4.03Å; F287-L291 HydrophobicContact CE1-CG 4.11Å; F287-L291 PolarHBondContact O-N 3.07Å; F287-L291 VanDerWaalsContact O-N 3.11Å; R288-L291 PolarHBondContact O-N 2.86Å; L291-A293 PolarHBondContact O-N 3.45Å; L291-Q294 WeakPolarHBondContact O-CB 3.36Å; L291-Q294 PolarHBondContact O-N 2.92Å; L291-L295 WeakPolarHBondContact O-CG 3.41Å; L291-L295 PolarHBondContact O-N 3.49Å
292	E	79	Confident	77.8	Confident	107 Å²	107	61.6 Å²	61.6	50%	0.5	32%	0.323	S	S	.	.	H	α-helix	trans	-64.5	-40.5	177.7	-73.8	174.9	-171.2	0	0	111.4	R288 Q294 L295 G296	R288-E292 WeakPolarHBondContact CG-OE1 3.49Å; R288-E292 IonicContact NE-OE1 3.57Å; R288-E292 PolarHBondContact NE-OE1 2.96Å; R288-E292 VanDerWaalsContact NE-OE1 3.1Å; R288-E292 WeakPolarHBondContact O-CG 3.35Å; R288-E292 PolarHBondContact O-N 3.14Å; E292-Q294 VanDerWaalsContact C-N 3.32Å; E292-Q294 PolarHBondContact O-N 3.34Å; E292-L295 PolarHBondContact O-N 3.13Å; E292-G296 PolarHBondContact O-N 3.38Å
293	A	77.5	Confident	77.3	Confident	66 Å²	66	61.9 Å²	61.9	55%	0.545	32%	0.318	S	S	.	.	H	α-helix	trans	-63.4	-37.9	173.6	0	0	0	0	0	112.4	M289 L290 L291 S297	M289-A293 WeakPolarHBondContact O-CB 3.27Å; M289-A293 PolarHBondContact O-N 3.06Å; L290-A293 PolarHBondContact O-N 2.7Å; L291-A293 PolarHBondContact O-N 3.45Å; A293-S297 WeakPolarHBondContact O-CB 3.34Å; A293-S297 PolarHBondContact O-N 2.93Å; A293-S297 PolarHBondContact O-OG 3.26Å
294	Q	72.8	Confident	76.9	Confident	15 Å²	15	66 Å²	66	7%	0.07	34%	0.339	C	S	.	.	H	α-helix	trans	-66.4	-48.1	177.1	-168.8	76.8	11.1	0	0	112	A38 E89 L290 L291 E292 G296 S297 T298	A38-Q294 HydrophobicContact CB-CG 4.34Å; E89-Q294 VanDerWaalsContact CD-CD 3.47Å; E89-Q294 VanDerWaalsContact CG-OE1 3.25Å; E89-Q294 VanDerWaalsContact OE1-CD 3.24Å; E89-Q294 PolarHBondContact OE1-NE2 3.5Å; E89-Q294 PolarHBondContact OE1-OE1 3.47Å; E89-Q294 PolarHBondContact OE2-NE2 3.25Å; L290-Q294 WeakPolarHBondContact O-CB 3.44Å; L290-Q294 PolarHBondContact O-N 3.02Å; L291-Q294 WeakPolarHBondContact O-CB 3.36Å; L291-Q294 PolarHBondContact O-N 2.92Å; E292-Q294 VanDerWaalsContact C-N 3.32Å; E292-Q294 PolarHBondContact O-N 3.34Å; Q294-G296 VanDerWaalsContact C-N 3.33Å; Q294-S297 PolarHBondContact O-N 3.46Å; Q294-S297 PolarHBondContact O-OG 2.88Å; Q294-T298 VanDerWaalsContact O-CB 3.3Å; Q294-T298 WeakPolarHBondContact O-CB 3.32Å; Q294-T298 PolarHBondContact O-N 3.29Å; Q294-T298 PolarHBondContact O-OG1 2.89Å
295	L	68.8	Low	76.6	Confident	69 Å²	69	66.9 Å²	66.9	36%	0.361	34%	0.341	S	S	.	.	H	α-helix	trans	-66.4	-38.2	178.6	-72	167.6	0	0	0	111	L291 E292 T298 H299	L291-L295 WeakPolarHBondContact O-CG 3.41Å; L291-L295 PolarHBondContact O-N 3.49Å; E292-L295 PolarHBondContact O-N 3.13Å; L295-T298 PolarHBondContact O-N 3.25Å; L295-H299 PolarHBondContact O-N 3.16Å
296	G	70.2	Confident	76.2	Confident	36 Å²	36	69.5 Å²	69.5	37%	0.371	35%	0.348	S	S	.	.	H	α-helix	trans	-63.1	-47.2	174.9	0	0	0	0	0	113.1	E292 Q294 T298 H299 Q300	E292-G296 PolarHBondContact O-N 3.38Å; Q294-G296 VanDerWaalsContact C-N 3.33Å; G296-T298 VanDerWaalsContact C-N 3.32Å; G296-T298 PolarHBondContact O-N 3.41Å; G296-H299 PolarHBondContact O-N 3.49Å; G296-Q300 PolarHBondContact O-N 3Å; G296-Q300 VanDerWaalsContact O-N 3.17Å
297	S	70.9	Confident	76.1	Confident	36 Å²	36	70.9 Å²	70.9	25%	0.252	36%	0.358	S	S	.	.	H	α-helix	trans	-65.9	-36.9	177.8	74.9	0	0	0	0	111.8	A293 Q294 H299 Q300 Q301	A293-S297 WeakPolarHBondContact O-CB 3.34Å; A293-S297 PolarHBondContact O-N 2.93Å; A293-S297 PolarHBondContact O-OG 3.26Å; Q294-S297 PolarHBondContact O-N 3.46Å; Q294-S297 PolarHBondContact O-OG 2.88Å; S297-H299 PolarHBondContact O-N 3.46Å; S297-Q300 PolarHBondContact O-N 3.49Å; S297-Q301 WeakPolarHBondContact O-CG 3.37Å; S297-Q301 PolarHBondContact O-N 3.39Å
298	T	69.1	Low	75.9	Confident	17 Å²	17	78.1 Å²	78.1	10%	0.104	39%	0.385	C	S	.	.	H	α-helix	trans	-62	-42.7	175.7	-61.6	0	0	0	0	111.6	Y31 I35 Q294 L295 G296 Q301 M302	Y31-T298 HydrophobicContact CE2-CG2 4.37Å; Y31-T298 PolarHBondContact OH-O 3.49Å; I35-T298 HydrophobicContact CD1-CG2 3.36Å; I35-T298 HydrophobicContact CG1-CG2 3.45Å; I35-T298 VanDerWaalsContact CG1-CG2 3.45Å; Q294-T298 VanDerWaalsContact O-CB 3.3Å; Q294-T298 WeakPolarHBondContact O-CB 3.32Å; Q294-T298 PolarHBondContact O-N 3.29Å; Q294-T298 PolarHBondContact O-OG1 2.89Å; L295-T298 PolarHBondContact O-N 3.25Å; G296-T298 VanDerWaalsContact C-N 3.32Å; G296-T298 PolarHBondContact O-N 3.41Å; T298-Q301 PolarHBondContact O-N 2.9Å; T298-M302 PolarHBondContact O-N 3.02Å
299	H	69.9	Low	75.8	Confident	116 Å²	116	72.5 Å²	72.5	54%	0.537	37%	0.367	S	S	.	.	H	α-helix	trans	-63.9	-43	177.1	-168.4	78.8	0	0	0	111.7	L295 G296 S297 M302 Q303	L295-H299 PolarHBondContact O-N 3.16Å; G296-H299 PolarHBondContact O-N 3.49Å; S297-H299 PolarHBondContact O-N 3.46Å; H299-M302 WeakPolarHBondContact O-CB 3.49Å; H299-M302 PolarHBondContact O-N 3.36Å; H299-Q303 PolarHBondContact CD2-NE2 3.43Å; H299-Q303 PolarHBondContact NE2-NE2 3.35Å; H299-Q303 PolarHBondContact O-N 3.28Å; H299-Q303 VanDerWaalsContact O-N 3.13Å
300	Q	73.7	Confident	75.7	Confident	125 Å²	125	72.1 Å²	72.1	58%	0.584	36%	0.364	S	S	*	.	H	α-helix	trans	-63.5	-41.4	174.7	-72.1	-177.8	-27.5	0	0	112.3	G296 S297 M302 Q303 M304	G296-Q300 PolarHBondContact O-N 3Å; G296-Q300 VanDerWaalsContact O-N 3.17Å; S297-Q300 PolarHBondContact O-N 3.49Å; Q300-M302 VanDerWaalsContact C-N 3.3Å; Q300-M302 PolarHBondContact O-N 3.36Å; Q300-Q303 PolarHBondContact O-N 3.07Å; Q300-M304 WeakPolarHBondContact O-CG 3.03Å; Q300-M304 PolarHBondContact O-N 3.04Å
301	Q	70.7	Confident	75.7	Confident	74 Å²	74	77 Å²	77	35%	0.346	39%	0.386	S	S	.	.	H	α-helix	trans	-60.9	-38.4	174.5	-75	178	3.2	0	0	111.9	Y31 S297 T298 M304 F305	Y31-Q301 HydrophobicContact CE2-CB 3.79Å; S297-Q301 WeakPolarHBondContact O-CG 3.37Å; S297-Q301 PolarHBondContact O-N 3.39Å; T298-Q301 PolarHBondContact O-N 2.9Å; Q301-M304 HydrophobicContact CG-CE 4.22Å; Q301-M304 PolarHBondContact O-N 2.99Å; Q301-F305 WeakPolarHBondContact O-CB 3.36Å; Q301-F305 PolarHBondContact O-N 3.09Å
302	M	71.1	Confident	75.8	Confident	66 Å²	66	77.2 Å²	77.2	33%	0.325	39%	0.387	S	S	.	.	H	α-helix	trans	-61.6	-45.5	175.1	-162.9	58	-174	0	0	111.9	Y31 T298 H299 Q300 F305 N306	Y31-M302 HydrophobicContact CE1-SD 3.53Å; Y31-M302 VanDerWaalsContact CE1-SD 3.53Å; Y31-M302 WeakPolarHBondContact OH-CA 3.49Å; Y31-M302 WeakPolarHBondContact OH-CB 3.36Å; Y31-M302 PolarHBondContact OH-N 3.42Å; T298-M302 PolarHBondContact O-N 3.02Å; H299-M302 WeakPolarHBondContact O-CB 3.49Å; H299-M302 PolarHBondContact O-N 3.36Å; Q300-M302 VanDerWaalsContact C-N 3.3Å; Q300-M302 PolarHBondContact O-N 3.36Å; M302-F305 PolarHBondContact O-N 3.17Å; M302-N306 PolarHBondContact O-N 3.44Å
303	Q	78	Confident	75.8	Confident	98 Å²	98	75.9 Å²	75.9	46%	0.458	39%	0.386	S	S	.	.	H	α-helix	trans	-65.7	-43.6	-179.7	-69.5	-177.8	-7.2	0	0	111.4	H299 Q300 F305 N306 Q307	H299-Q303 PolarHBondContact CD2-NE2 3.43Å; H299-Q303 PolarHBondContact NE2-NE2 3.35Å; H299-Q303 PolarHBondContact O-N 3.28Å; H299-Q303 VanDerWaalsContact O-N 3.13Å; Q300-Q303 PolarHBondContact O-N 3.07Å; Q303-F305 VanDerWaalsContact C-N 3.33Å; Q303-F305 PolarHBondContact O-N 3.25Å; Q303-N306 PolarHBondContact O-N 3.08Å; Q303-Q307 WeakPolarHBondContact O-CB 3.16Å; Q303-Q307 WeakPolarHBondContact O-CG 3.49Å; Q303-Q307 PolarHBondContact O-N 3.01Å
304	M	78.3	Confident	76.1	Confident	91 Å²	91	80.9 Å²	80.9	45%	0.448	39%	0.391	S	S	.	.	H	α-helix	trans	-62.1	-40.1	174.5	-73.3	-170.1	-69.2	0	0	112	Q300 Q301 Q307 R308	Q300-M304 WeakPolarHBondContact O-CG 3.03Å; Q300-M304 PolarHBondContact O-N 3.04Å; Q301-M304 HydrophobicContact CG-CE 4.22Å; Q301-M304 PolarHBondContact O-N 2.99Å; M304-Q307 PolarHBondContact O-N 3.09Å; M304-R308 WeakPolarHBondContact O-CB 3.14Å; M304-R308 WeakPolarHBondContact O-CG 3.46Å; M304-R308 PolarHBondContact O-N 2.91Å
305	F	76.4	Confident	76.5	Confident	47 Å²	47	84.5 Å²	84.5	21%	0.206	41%	0.414	C	S	.	.	H	α-helix	trans	-60.9	-50	174.9	172.3	-99	0	0	0	111.3	Q301 M302 Q303 Q307 R308 M309	Q301-F305 WeakPolarHBondContact O-CB 3.36Å; Q301-F305 PolarHBondContact O-N 3.09Å; M302-F305 PolarHBondContact O-N 3.17Å; Q303-F305 VanDerWaalsContact C-N 3.33Å; Q303-F305 PolarHBondContact O-N 3.25Å; F305-Q307 VanDerWaalsContact C-N 3.34Å; F305-Q307 PolarHBondContact O-N 3.41Å; F305-R308 PolarHBondContact O-N 3.49Å; F305-M309 HydrophobicContact CD2-CG 4.44Å; F305-M309 HydrophobicContact CE1-CG 4Å; F305-M309 HydrophobicContact CE2-CG 3.93Å; F305-M309 HydrophobicContact CZ-CG 3.68Å; F305-M309 WeakPolarHBondContact O-CB 3.36Å; F305-M309 PolarHBondContact O-N 3.14Å
306	N	78.8	Confident	77	Confident	85 Å²	85	81.6 Å²	81.6	46%	0.455	40%	0.399	S	S	.	.	H	α-helix	trans	-59.8	-43.6	178.7	-75.8	-14.4	0	0	0	111.9	M302 Q303 M309 E310	M302-N306 PolarHBondContact O-N 3.44Å; Q303-N306 PolarHBondContact O-N 3.08Å; N306-M309 PolarHBondContact O-N 3.48Å; N306-E310 WeakPolarHBondContact O-CB 3.48Å; N306-E310 PolarHBondContact O-N 3.34Å
307	Q	83.2	Confident	77.5	Confident	120 Å²	120	81.4 Å²	81.4	56%	0.561	40%	0.397	S	S	*	.	H	α-helix	trans	-64.1	-42.8	177.1	-74.3	177.5	-10.7	0	0	112.5	Q303 M304 F305 E310 Q311	Q303-Q307 WeakPolarHBondContact O-CB 3.16Å; Q303-Q307 WeakPolarHBondContact O-CG 3.49Å; Q303-Q307 PolarHBondContact O-N 3.01Å; M304-Q307 PolarHBondContact O-N 3.09Å; F305-Q307 VanDerWaalsContact C-N 3.34Å; F305-Q307 PolarHBondContact O-N 3.41Å; Q307-E310 PolarHBondContact O-N 3.22Å; Q307-Q311 WeakPolarHBondContact O-CG 3.33Å; Q307-Q311 PolarHBondContact O-N 3.41Å
308	R	80.4	Confident	78.2	Confident	152 Å²	152	81.2 Å²	81.2	57%	0.574	40%	0.401	S	S	*	.	H	α-helix	trans	-65.4	-41.8	177	-76.5	-178.9	179.4	-174.2	1.2	111.8	M304 F305 E310 Q311 I312	M304-R308 WeakPolarHBondContact O-CB 3.14Å; M304-R308 WeakPolarHBondContact O-CG 3.46Å; M304-R308 PolarHBondContact O-N 2.91Å; F305-R308 PolarHBondContact O-N 3.49Å; R308-E310 VanDerWaalsContact C-N 3.35Å; R308-Q311 PolarHBondContact O-N 3.33Å; R308-I312 WeakPolarHBondContact O-CG1 3.42Å; R308-I312 PolarHBondContact O-N 3.16Å
309	M	80	Confident	78.8	Confident	47 Å²	47	84.4 Å²	84.4	23%	0.232	42%	0.417	C	S	.	.	H	α-helix	trans	-60.2	-45.3	174.6	-88.7	-60.8	-67.3	0	0	111.3	Q23 F305 N306 Q311 I312 V313	Q23-M309 HydrophobicContact CB-SD 4.26Å; Q23-M309 PolarHBondContact OE1-SD 3.38Å; Q23-M309 VanDerWaalsContact OE1-SD 3.34Å; F305-M309 HydrophobicContact CD2-CG 4.44Å; F305-M309 HydrophobicContact CE1-CG 4Å; F305-M309 HydrophobicContact CE2-CG 3.93Å; F305-M309 HydrophobicContact CZ-CG 3.68Å; F305-M309 WeakPolarHBondContact O-CB 3.36Å; F305-M309 PolarHBondContact O-N 3.14Å; N306-M309 PolarHBondContact O-N 3.48Å; M309-Q311 PolarHBondContact O-N 3.05Å; M309-I312 PolarHBondContact O-N 3.18Å; M309-V313 VanDerWaalsContact O-CG2 3.29Å; M309-V313 WeakPolarHBondContact O-CG2 3.36Å; M309-V313 PolarHBondContact O-N 3.47Å
310	E	82.2	Confident	79.3	Confident	111 Å²	111	82.7 Å²	82.7	52%	0.519	41%	0.411	S	S	.	.	H	α-helix	trans	-62.9	-42.1	177.8	-161.5	-168	154.4	0	0	112	N306 Q307 R308 R314	N306-E310 WeakPolarHBondContact O-CB 3.48Å; N306-E310 PolarHBondContact O-N 3.34Å; Q307-E310 PolarHBondContact O-N 3.22Å; R308-E310 VanDerWaalsContact C-N 3.35Å; E310-R314 WeakPolarHBondContact O-CB 3.5Å; E310-R314 PolarHBondContact O-N 3.38Å; E310-R314 IonicContact OE1-CZ 3.85Å; E310-R314 IonicContact OE1-NH2 2.76Å; E310-R314 PolarHBondContact OE1-NH2 3.43Å
311	Q	82.1	Confident	79.8	Confident	127 Å²	127	82.9 Å²	82.9	59%	0.593	42%	0.415	S	S	*	.	H	α-helix	trans	-61.7	-47.2	176	-76.6	178.4	-13.5	0	0	112.1	Q307 R308 M309 V313 R314 V315	Q307-Q311 WeakPolarHBondContact O-CG 3.33Å; Q307-Q311 PolarHBondContact O-N 3.41Å; R308-Q311 PolarHBondContact O-N 3.33Å; M309-Q311 PolarHBondContact O-N 3.05Å; Q311-V313 PolarHBondContact O-N 3.2Å; Q311-R314 PolarHBondContact O-N 3.05Å; Q311-V315 WeakPolarHBondContact O-CB 3.23Å; Q311-V315 WeakPolarHBondContact O-CG2 3.43Å; Q311-V315 PolarHBondContact O-N 3.09Å
312	I	79.4	Confident	80.6	Confident	17 Å²	17	84.1 Å²	84.1	9%	0.087	43%	0.427	C	S	.	.	H	α-helix	trans	-64.9	-41.4	-179	-74.5	163.4	0	0	0	111.5	E19 Q20 Q23 R308 M309 R314 S316	E19-I312 HydrophobicContact CG-CD1 4.19Å; E19-I312 HydrophobicContact CG-CG2 4.28Å; Q20-I312 HydrophobicContact CG-CG2 4.17Å; Q23-I312 HydrophobicContact CG-CD1 4.29Å; R308-I312 WeakPolarHBondContact O-CG1 3.42Å; R308-I312 PolarHBondContact O-N 3.16Å; M309-I312 PolarHBondContact O-N 3.18Å; I312-R314 VanDerWaalsContact C-N 3.34Å; I312-R314 PolarHBondContact O-N 3.15Å; I312-S316 WeakPolarHBondContact O-CB 3.49Å; I312-S316 PolarHBondContact O-N 3.1Å; I312-S316 PolarHBondContact O-OG 3.49Å
313	V	79	Confident	81.1	Confident	78 Å²	78	81.7 Å²	81.7	47%	0.473	42%	0.418	S	S	.	.	H	α-helix	trans	-61.8	-44	175.4	171.2	0	0	0	0	110.7	M309 Q311 G317	M309-V313 VanDerWaalsContact O-CG2 3.29Å; M309-V313 WeakPolarHBondContact O-CG2 3.36Å; M309-V313 PolarHBondContact O-N 3.47Å; Q311-V313 PolarHBondContact O-N 3.2Å; V313-G317 PolarHBondContact O-N 3.08Å
314	R	83.7	Confident	81.3	Confident	172 Å²	172	80.4 Å²	80.4	65%	0.649	42%	0.417	S	S	*	.	H	α-helix	trans	-65.9	-45.2	179.6	-164.9	-175.5	-60.6	-179.4	0.9	112.4	E310 Q311 I312 G318	E310-R314 WeakPolarHBondContact O-CB 3.5Å; E310-R314 PolarHBondContact O-N 3.38Å; E310-R314 IonicContact OE1-CZ 3.85Å; E310-R314 IonicContact OE1-NH2 2.76Å; E310-R314 PolarHBondContact OE1-NH2 3.43Å; Q311-R314 PolarHBondContact O-N 3.05Å; I312-R314 VanDerWaalsContact C-N 3.34Å; I312-R314 PolarHBondContact O-N 3.15Å; R314-G318 PolarHBondContact O-N 3.39Å
315	V	81.6	Confident	81.7	Confident	91 Å²	91	79 Å²	79	55%	0.552	42%	0.42	S	S	*	.	H	α-helix	trans	-66	-46.5	178.5	171.8	0	0	0	0	110.9	Q311 G317 G318 L319	Q311-V315 WeakPolarHBondContact O-CB 3.23Å; Q311-V315 WeakPolarHBondContact O-CG2 3.43Å; Q311-V315 PolarHBondContact O-N 3.09Å; V315-G317 PolarHBondContact O-N 2.98Å; V315-G318 PolarHBondContact O-N 3.47Å; V315-L319 HydrophobicContact CG1-CD1 4.23Å; V315-L319 PolarHBondContact O-N 3.48Å
316	S	77.7	Confident	82.1	Confident	7 Å²	7	81.3 Å²	81.3	5%	0.049	43%	0.434	C	S	.	.	H	α-helix	trans	-59.3	-45.7	176.4	-69.6	0	0	0	0	111.9	S16 I312 G318 L319 I320	S16-S316 WeakPolarHBondContact OG-CB 3.45Å; S16-S316 PolarHBondContact OG-OG 3.03Å; I312-S316 WeakPolarHBondContact O-CB 3.49Å; I312-S316 PolarHBondContact O-N 3.1Å; I312-S316 PolarHBondContact O-OG 3.49Å; S316-G318 VanDerWaalsContact C-N 3.34Å; S316-G318 PolarHBondContact O-N 3.37Å; S316-L319 PolarHBondContact O-N 3.38Å; S316-I320 WeakPolarHBondContact O-CG1 3.45Å; S316-I320 PolarHBondContact O-N 3.49Å; S316-I320 VanDerWaalsContact O-N 3.14Å
317	G	81.3	Confident	82.3	Confident	32 Å²	32	78.1 Å²	78.1	33%	0.33	42%	0.419	S	S	.	.	H	α-helix	trans	-61.7	-40.5	177.2	0	0	0	0	0	112.8	V313 V315 I320 L321	V313-G317 PolarHBondContact O-N 3.08Å; V315-G317 PolarHBondContact O-N 2.98Å; G317-I320 PolarHBondContact O-N 3.31Å; G317-L321 PolarHBondContact O-N 3.39Å; G317-L321 VanDerWaalsContact O-N 3.17Å
318	G	84.7	Confident	82.5	Confident	33 Å²	33	78.3 Å²	78.3	34%	0.34	42%	0.424	S	S	.	.	H	α-helix	trans	-62.5	-45.6	175.1	0	0	0	0	0	113.2	R314 V315 S316 I320 L321 V322	R314-G318 PolarHBondContact O-N 3.39Å; V315-G318 PolarHBondContact O-N 3.47Å; S316-G318 VanDerWaalsContact C-N 3.34Å; S316-G318 PolarHBondContact O-N 3.37Å; G318-I320 VanDerWaalsContact C-N 3.35Å; G318-I320 PolarHBondContact O-N 3.34Å; G318-L321 PolarHBondContact O-N 3.47Å; G318-V322 WeakPolarHBondContact O-CG2 3.45Å; G318-V322 PolarHBondContact O-N 3.09Å; G318-V322 VanDerWaalsContact O-N 3.09Å
319	L	83.1	Confident	82.8	Confident	84 Å²	84	76 Å²	76	44%	0.44	42%	0.422	S	S	.	.	H	α-helix	trans	-61.3	-41.6	178.4	-75.4	170.5	0	0	0	112.4	V12 V315 S316 V322 A323	V12-L319 HydrophobicContact CG1-CB 3.97Å; V315-L319 HydrophobicContact CG1-CD1 4.23Å; V315-L319 PolarHBondContact O-N 3.48Å; S316-L319 PolarHBondContact O-N 3.38Å; L319-V322 PolarHBondContact O-N 3.43Å; L319-A323 PolarHBondContact O-N 3.11Å; L319-A323 VanDerWaalsContact O-N 3.08Å
320	I	80.7	Confident	83.1	Confident	79 Å²	79	76.9 Å²	76.9	41%	0.405	43%	0.427	S	S	.	.	H	α-helix	trans	-63.5	-47.5	178.2	-66.9	167.2	0	0	0	110.6	V12 S316 G317 G318 V322 A323 T324	V12-I320 HydrophobicContact CG1-CG1 4.49Å; S316-I320 WeakPolarHBondContact O-CG1 3.45Å; S316-I320 PolarHBondContact O-N 3.49Å; S316-I320 VanDerWaalsContact O-N 3.14Å; G317-I320 PolarHBondContact O-N 3.31Å; G318-I320 VanDerWaalsContact C-N 3.35Å; G318-I320 PolarHBondContact O-N 3.34Å; I320-V322 PolarHBondContact O-N 3.2Å; I320-A323 PolarHBondContact O-N 3.45Å; I320-T324 PolarHBondContact O-N 3.46Å; I320-T324 PolarHBondContact O-OG1 3.17Å; I320-T324 VanDerWaalsContact O-OG1 3.07Å
321	L	84.5	Confident	83.1	Confident	129 Å²	129	74.5 Å²	74.5	68%	0.675	43%	0.427	S	S	*	.	H	α-helix	trans	-59.5	-43.4	178.9	-77	171.3	0	0	0	112.5	G317 G318 T324 A325	G317-L321 PolarHBondContact O-N 3.39Å; G317-L321 VanDerWaalsContact O-N 3.17Å; G318-L321 PolarHBondContact O-N 3.47Å; L321-T324 PolarHBondContact O-N 3.12Å; L321-A325 WeakPolarHBondContact O-CB 3.45Å; L321-A325 PolarHBondContact O-N 3.29Å
322	V	85.6	Confident	83.3	Confident	100 Å²	100	76.6 Å²	76.6	61%	0.606	43%	0.429	S	S	*	.	H	α-helix	trans	-63.1	-43.8	178.1	171.7	0	0	0	0	111.1	G318 L319 I320 T324 A325 L326	G318-V322 WeakPolarHBondContact O-CG2 3.45Å; G318-V322 PolarHBondContact O-N 3.09Å; G318-V322 VanDerWaalsContact O-N 3.09Å; L319-V322 PolarHBondContact O-N 3.43Å; I320-V322 PolarHBondContact O-N 3.2Å; V322-T324 PolarHBondContact O-N 2.98Å; V322-A325 PolarHBondContact O-N 3.48Å; V322-L326 WeakPolarHBondContact O-CB 3.42Å; V322-L326 PolarHBondContact O-N 2.94Å; V322-L326 VanDerWaalsContact O-N 3.08Å
323	A	81.6	Confident	83.6	Confident	16 Å²	16	78.8 Å²	78.8	13%	0.132	44%	0.443	C	S	.	.	H	α-helix	trans	-63.3	-41.6	178.7	0	0	0	0	0	112.3	V9 L319 I320 A327	V9-A323 HydrophobicContact CG2-CB 4.35Å; L319-A323 PolarHBondContact O-N 3.11Å; L319-A323 VanDerWaalsContact O-N 3.08Å; I320-A323 PolarHBondContact O-N 3.45Å; A323-A327 PolarHBondContact O-N 3.05Å
324	T	82.4	Confident	83.8	Confident	70 Å²	70	80.4 Å²	80.4	43%	0.429	44%	0.444	S	S	.	.	H	α-helix	trans	-67	-41.2	177.2	-50.6	0	0	0	0	112.4	I320 L321 V322 A327 L328	I320-T324 PolarHBondContact O-N 3.46Å; I320-T324 PolarHBondContact O-OG1 3.17Å; I320-T324 VanDerWaalsContact O-OG1 3.07Å; L321-T324 PolarHBondContact O-N 3.12Å; V322-T324 PolarHBondContact O-N 2.98Å; T324-A327 WeakPolarHBondContact O-CB 3.38Å; T324-A327 PolarHBondContact O-N 3.42Å; T324-L328 PolarHBondContact O-N 3.41Å
325	A	86.8	Confident	83.9	Confident	61 Å²	61	76.9 Å²	76.9	50%	0.504	44%	0.438	S	S	.	.	H	α-helix	trans	-63.7	-43.4	178.1	0	0	0	0	0	112	L321 V322 A327 L328 L329	L321-A325 WeakPolarHBondContact O-CB 3.45Å; L321-A325 PolarHBondContact O-N 3.29Å; V322-A325 PolarHBondContact O-N 3.48Å; A325-A327 VanDerWaalsContact C-N 3.28Å; A325-A327 PolarHBondContact O-N 3.3Å; A325-L328 PolarHBondContact O-N 3Å; A325-L329 WeakPolarHBondContact O-CB 3.37Å; A325-L329 PolarHBondContact O-N 3.03Å; A325-L329 VanDerWaalsContact O-N 3.1Å
326	L	85.8	Confident	84	Confident	97 Å²	97	77.2 Å²	77.2	51%	0.508	43%	0.434	S	S	.	.	H	α-helix	trans	-61.7	-37.6	177.5	-172.5	68.5	0	0	0	112	V322 L329 L330	V322-L326 WeakPolarHBondContact O-CB 3.42Å; V322-L326 PolarHBondContact O-N 2.94Å; V322-L326 VanDerWaalsContact O-N 3.08Å; L326-L329 PolarHBondContact O-N 3.02Å; L326-L330 HydrophobicContact CG-CD1 4.25Å; L326-L330 WeakPolarHBondContact O-CG 3.42Å; L326-L330 PolarHBondContact O-N 2.87Å
327	A	82.8	Confident	84.2	Confident	18 Å²	18	85.4 Å²	85.4	15%	0.149	47%	0.465	C	S	.	.	H	α-helix	trans	-62.2	-48.5	177	0	0	0	0	0	114	L5 A323 T324 A325 L329 L330 A331	L5-A327 VanDerWaalsContact CD1-CA 3.42Å; L5-A327 HydrophobicContact CD1-CB 3.59Å; L5-A327 HydrophobicContact CD2-CB 3.31Å; L5-A327 HydrophobicContact CG-CB 3.87Å; A323-A327 PolarHBondContact O-N 3.05Å; T324-A327 WeakPolarHBondContact O-CB 3.38Å; T324-A327 PolarHBondContact O-N 3.42Å; A325-A327 VanDerWaalsContact C-N 3.28Å; A325-A327 PolarHBondContact O-N 3.3Å; A327-L329 VanDerWaalsContact C-N 3.32Å; A327-L329 PolarHBondContact O-N 2.99Å; A327-L330 PolarHBondContact O-N 3.08Å; A327-A331 PolarHBondContact O-N 3.45Å; A327-A331 VanDerWaalsContact O-N 3.11Å
328	L	86.8	Confident	84.1	Confident	124 Å²	124	88.2 Å²	88.2	65%	0.649	47%	0.468	S	S	*	.	H	α-helix	trans	-64.6	-39.9	179	-68.7	173.4	0	0	0	111.3	T324 A325 A331 W332	T324-L328 PolarHBondContact O-N 3.41Å; A325-L328 PolarHBondContact O-N 3Å; L328-A331 PolarHBondContact O-N 3.19Å; L328-W332 WeakPolarHBondContact O-CB 3.45Å; L328-W332 PolarHBondContact O-N 3.25Å
329	L	87.6	Confident	83.9	Confident	102 Å²	102	90 Å²	90	53%	0.534	47%	0.469	S	S	.	.	H	α-helix	trans	-63	-46.6	177.7	-172.5	146.4	0	0	0	111.7	A325 L326 A327 A331 W332 V333	A325-L329 WeakPolarHBondContact O-CB 3.37Å; A325-L329 PolarHBondContact O-N 3.03Å; A325-L329 VanDerWaalsContact O-N 3.1Å; L326-L329 PolarHBondContact O-N 3.02Å; A327-L329 VanDerWaalsContact C-N 3.32Å; A327-L329 PolarHBondContact O-N 2.99Å; L329-A331 PolarHBondContact O-N 3.35Å; L329-W332 PolarHBondContact O-N 3.24Å; L329-V333 HydrophobicContact CD2-CG2 4.09Å; L329-V333 VanDerWaalsContact O-CG2 3.31Å; L329-V333 WeakPolarHBondContact O-CG2 3.31Å; L329-V333 PolarHBondContact O-N 3.48Å
330	L	85.8	Confident	83.7	Confident	67 Å²	67	93.6 Å²	93.6	35%	0.351	48%	0.477	S	S	.	.	H	α-helix	trans	-62	-41.3	177.7	-79	167.7	0	0	0	112.5	M1 L5 L326 A327 F334	M1-L330 HydrophobicContact CE-CD2 4.22Å; L5-L330 HydrophobicContact CD1-CD1 3.9Å; L326-L330 HydrophobicContact CG-CD1 4.25Å; L326-L330 WeakPolarHBondContact O-CG 3.42Å; L326-L330 PolarHBondContact O-N 2.87Å; A327-L330 PolarHBondContact O-N 3.08Å; L330-F334 WeakPolarHBondContact O-CB 3.45Å; L330-F334 PolarHBondContact O-N 3.35Å
331	A	82.2	Confident	83.5	Confident	61 Å²	61	92.8 Å²	92.8	50%	0.504	48%	0.478	S	S	.	.	H	α-helix	trans	-63.6	-43.4	176.9	0	0	0	0	0	111.8	A327 L328 L329 N335	A327-A331 PolarHBondContact O-N 3.45Å; A327-A331 VanDerWaalsContact O-N 3.11Å; L328-A331 PolarHBondContact O-N 3.19Å; L329-A331 PolarHBondContact O-N 3.35Å; A331-N335 WeakPolarHBondContact O-CB 3.49Å; A331-N335 PolarHBondContact O-N 3.33Å; A331-N335 VanDerWaalsContact O-N 3.08Å
332	W	86.9	Confident	83	Confident	171 Å²	171	93.6 Å²	93.6	65%	0.648	47%	0.472	S	S	*	.	H	α-helix	trans	-63.4	-47	177.5	180	82.8	0	0	0	112.1	L328 L329 F334 N335 H336	L328-W332 WeakPolarHBondContact O-CB 3.45Å; L328-W332 PolarHBondContact O-N 3.25Å; L329-W332 PolarHBondContact O-N 3.24Å; W332-F334 PolarHBondContact O-N 3.33Å; W332-N335 PolarHBondContact O-N 3.39Å; W332-H336 WeakPolarHBondContact O-CB 3.2Å; W332-H336 PolarHBondContact O-N 3.47Å
333	V	85.5	Confident	82.8	Confident	63 Å²	63	93.1 Å²	93.1	38%	0.382	47%	0.466	S	S	.	.	H	α-helix	trans	-60.6	-46.5	177.7	171.2	0	0	0	0	111.1	L329 N335 Y337	L329-V333 HydrophobicContact CD2-CG2 4.09Å; L329-V333 VanDerWaalsContact O-CG2 3.31Å; L329-V333 WeakPolarHBondContact O-CG2 3.31Å; L329-V333 PolarHBondContact O-N 3.48Å; V333-N335 PolarHBondContact O-N 3.26Å; V333-Y337 WeakPolarHBondContact O-CB 3.41Å; V333-Y337 PolarHBondContact O-N 2.58Å
334	F	83.7	Confident	82.8	Confident	111 Å²	111	96.5 Å²	96.5	49%	0.487	48%	0.484	S	S	.	.	I	π-helix	trans	-61.9	-45.6	-179.5	-176.1	-103.2	0	0	0	112.1	L330 W332 F338 I339	L330-F334 WeakPolarHBondContact O-CB 3.45Å; L330-F334 PolarHBondContact O-N 3.35Å; W332-F334 PolarHBondContact O-N 3.33Å; F334-F338 HydrophobicContact CD2-CB 4.28Å; F334-F338 HydrophobicContact CE2-CB 4.28Å; F334-F338 HydrophobicContact CE2-CD1 4.29Å; F334-F338 HydrophobicContact CE2-CG 4.26Å; F334-F338 HydrophobicContact CZ-CD1 4.36Å; F334-F338 WeakPolarHBondContact O-CB 3.45Å; F334-F338 PolarHBondContact O-N 3.05Å; F334-I339 HydrophobicContact CE1-CD1 4.18Å
335	N	83.8	Confident	82.7	Confident	98 Å²	98	99.8 Å²	99.8	52%	0.524	49%	0.493	S	S	.	.	I	π-helix	trans	-65.6	-49.2	179.8	-174.9	26.6	0	0	0	112.1	A331 W332 V333 I339 R340	A331-N335 WeakPolarHBondContact O-CB 3.49Å; A331-N335 PolarHBondContact O-N 3.33Å; A331-N335 VanDerWaalsContact O-N 3.08Å; W332-N335 PolarHBondContact O-N 3.39Å; V333-N335 PolarHBondContact O-N 3.26Å; N335-I339 PolarHBondContact O-N 3.14Å; N335-R340 PolarHBondContact O-N 2.91Å
336	H	83.7	Confident	82.5	Confident	99 Å²	99	99.1 Å²	99.1	46%	0.458	48%	0.477	S	S	.	.	I	π-helix	trans	-69.8	-47.3	-175.3	-169.9	83.1	0	0	0	111.9	W332	W332-H336 WeakPolarHBondContact O-CB 3.2Å; W332-H336 PolarHBondContact O-N 3.47Å
337	Y	82.9	Confident	82.4	Confident	179 Å²	179	100.6 Å²	100.6	70%	0.702	48%	0.48	S	S	*	.	I	π-helix	trans	-83.1	-38.6	-171.1	-158.9	-97	0	0	0	112.5	V333 S341	V333-Y337 WeakPolarHBondContact O-CB 3.41Å; V333-Y337 PolarHBondContact O-N 2.58Å; Y337-S341 WeakPolarHBondContact O-CB 3.19Å; Y337-S341 PolarHBondContact O-OG 3.3Å
338	F	78.9	Confident	82.5	Confident	91 Å²	91	102.4 Å²	102.4	40%	0.399	50%	0.495	S	S	.	.	I	π-helix	trans	-91.2	-53.5	-173.3	-160.7	-94.9	0	0	0	112.7	F334 R342	F334-F338 HydrophobicContact CD2-CB 4.28Å; F334-F338 HydrophobicContact CE2-CB 4.28Å; F334-F338 HydrophobicContact CE2-CD1 4.29Å; F334-F338 HydrophobicContact CE2-CG 4.26Å; F334-F338 HydrophobicContact CZ-CD1 4.36Å; F334-F338 WeakPolarHBondContact O-CB 3.45Å; F334-F338 PolarHBondContact O-N 3.05Å; F338-R342 WeakPolarHBondContact O-CB 3.14Å; F338-R342 PolarHBondContact O-N 3.41Å
339	I	80.3	Confident	82.3	Confident	69 Å²	69	100.5 Å²	100.5	35%	0.354	49%	0.485	S	S	.	.	I	π-helix	trans	-75.9	-55.2	-170.5	-61.2	176.8	0	0	0	111.1	F334 N335 L343 V344	F334-I339 HydrophobicContact CE1-CD1 4.18Å; N335-I339 PolarHBondContact O-N 3.14Å; I339-L343 PolarHBondContact O-N 3.38Å; I339-V344 HydrophobicContact CG2-CG2 4.49Å
340	R	79.5	Confident	82.2	Confident	161 Å²	161	96.7 Å²	96.7	61%	0.608	47%	0.465	S	S	*	.	I	π-helix	trans	-69.5	-39.7	-172.2	-168.7	176.5	-178.3	178.3	-0.1	112.7	N335	N335-R340 PolarHBondContact O-N 2.91Å
341	S	75.9	Confident	82.2	Confident	62 Å²	62	98.1 Å²	98.1	43%	0.434	47%	0.473	S	S	.	.	I	π-helix	trans	-74.4	-38.5	-177	87.3	0	0	0	0	112.2	Y337	Y337-S341 WeakPolarHBondContact O-CB 3.19Å; Y337-S341 PolarHBondContact O-OG 3.3Å
342	R	75.2	Confident	82.4	Confident	145 Å²	145	100.9 Å²	100.9	55%	0.547	48%	0.475	S	S	.	.	I	π-helix	trans	-98.6	-35.2	-164.7	-156.7	175.4	-179.3	176.4	0.9	114.3	F338 R346	F338-R342 WeakPolarHBondContact O-CB 3.14Å; F338-R342 PolarHBondContact O-N 3.41Å; R342-R346 WeakPolarHBondContact O-CD 3.36Å
343	L	79.7	Confident	82.2	Confident	91 Å²	91	93 Å²	93	48%	0.476	45%	0.447	S	S	.	.	I	π-helix	trans	-103.7	-56.1	-173.8	-92.7	154.3	0	0	0	112.3	I339 K345 R346 F347 L374	I339-L343 PolarHBondContact O-N 3.38Å; L343-K345 PolarHBondContact O-N 3.43Å; L343-R346 PolarHBondContact O-N 3.44Å; L343-F347 PolarHBondContact O-N 3.4Å; L343-F347 VanDerWaalsContact O-N 3.12Å; L343-L374 HydrophobicContact CD2-CD1 4.29Å
344	V	82.4	Confident	82.2	Confident	86 Å²	86	93.1 Å²	93.1	52%	0.521	45%	0.447	S	S	.	.	I	π-helix	trans	-62.1	-46.1	-169	179.6	0	0	0	0	112.3	I339 R346 A348	I339-V344 HydrophobicContact CG2-CG2 4.49Å; V344-R346 PolarHBondContact O-N 3.18Å; V344-A348 PolarHBondContact O-N 3.21Å
345	K	81	Confident	82.3	Confident	140 Å²	140	91.8 Å²	91.8	61%	0.609	45%	0.448	S	S	*	.	H	α-helix	trans	-63.1	-40.2	-179.2	-72.9	-174.1	177.4	-175.9	0	112.9	L343 L349	L343-K345 PolarHBondContact O-N 3.43Å; K345-L349 PolarHBondContact O-N 3.42Å
346	R	81	Confident	82.2	Confident	46 Å²	46	91.6 Å²	91.6	17%	0.174	44%	0.444	C	S	.	.	H	α-helix	trans	-72.8	-37.9	-177.2	-74.1	175.4	61.5	-140.3	-4.7	112	R342 L343 V344 L350 Y369 D372	R342-R346 WeakPolarHBondContact O-CD 3.36Å; L343-R346 PolarHBondContact O-N 3.44Å; V344-R346 PolarHBondContact O-N 3.18Å; R346-L350 PolarHBondContact O-N 3.43Å; R346-Y369 PolarHBondContact NE-O 3.43Å; R346-Y369 PolarHBondContact NH2-O 3.23Å; R346-D372 IonicContact CZ-OD1 2.75Å; R346-D372 IonicContact CZ-OD2 2.97Å; R346-D372 IonicContact NH1-OD1 3.68Å; R346-D372 IonicContact NH1-OD2 3.92Å; R346-D372 PolarHBondContact NH1-OD2 3.22Å; R346-D372 VanDerWaalsContact NH2-CG 3.3Å; R346-D372 IonicContact NH2-OD1 2.77Å; R346-D372 PolarHBondContact NH2-OD1 3.33Å; R346-D372 IonicContact NH2-OD2 3.83Å; R346-D372 PolarHBondContact NH2-OD2 3.32Å; R346-D372 VanDerWaalsContact NH2-OD2 3.16Å
347	F	84.5	Confident	82.2	Confident	128 Å²	128	89.1 Å²	89.1	56%	0.561	43%	0.434	S	S	*	.	H	α-helix	trans	-65.2	-44.9	176.3	-172.1	-95.6	0	0	0	112.3	L343 L349 L350 N351 L374	L343-F347 PolarHBondContact O-N 3.4Å; L343-F347 VanDerWaalsContact O-N 3.12Å; F347-L349 PolarHBondContact O-N 3.12Å; F347-L350 PolarHBondContact O-N 2.69Å; F347-N351 PolarHBondContact O-N 3.1Å; F347-N351 VanDerWaalsContact O-N 3.1Å; F347-L374 HydrophobicContact CD2-CD2 3.95Å
348	A	85	Confident	82.1	Confident	57 Å²	57	83.9 Å²	83.9	47%	0.471	43%	0.434	S	S	.	.	H	α-helix	trans	-60.6	-42	-179.3	0	0	0	0	0	112.8	V344 Q352	V344-A348 PolarHBondContact O-N 3.21Å; A348-Q352 PolarHBondContact O-N 3.29Å
349	L	83.5	Confident	82.3	Confident	84 Å²	84	86.6 Å²	86.6	44%	0.44	45%	0.452	S	S	.	.	H	α-helix	trans	-65.4	-42.5	178.3	-73.8	168.6	0	0	0	112.7	K345 F347 Q352 A353 P367	K345-L349 PolarHBondContact O-N 3.42Å; F347-L349 PolarHBondContact O-N 3.12Å; L349-Q352 PolarHBondContact O-N 3.45Å; L349-A353 PolarHBondContact O-N 3.29Å; L349-P367 HydrophobicContact CB-CG 4.46Å
350	L	83.9	Confident	82.1	Confident	22 Å²	22	86 Å²	86	12%	0.115	46%	0.463	C	S	.	.	H	α-helix	trans	-65.2	-42.4	179.4	-176.8	61.6	0	0	0	111.6	R346 F347 Q352 A353 V354 I366 L374 I377 A378 L381	R346-L350 PolarHBondContact O-N 3.43Å; F347-L350 PolarHBondContact O-N 2.69Å; L350-Q352 VanDerWaalsContact C-N 3.33Å; L350-Q352 PolarHBondContact O-N 3.46Å; L350-A353 PolarHBondContact O-N 2.99Å; L350-V354 WeakPolarHBondContact O-CG2 3.43Å; L350-V354 PolarHBondContact O-N 3.29Å; L350-I366 HydrophobicContact CD1-CG2 4.39Å; L350-L374 HydrophobicContact CD2-CD2 3.93Å; L350-I377 HydrophobicContact CD1-CG2 4.42Å; L350-I377 HydrophobicContact CD2-CB 4.18Å; L350-I377 HydrophobicContact CD2-CG2 3.84Å; L350-A378 HydrophobicContact CD1-CB 3.93Å; L350-L381 HydrophobicContact CD1-CD2 4.5Å
351	N	86.3	Confident	81.9	Confident	96 Å²	96	79.7 Å²	79.7	51%	0.513	45%	0.448	S	S	.	.	H	α-helix	trans	-61.1	-41.7	178.2	-169.3	45.4	0	0	0	111.9	F347 A353 V354 V355	F347-N351 PolarHBondContact O-N 3.1Å; F347-N351 VanDerWaalsContact O-N 3.1Å; N351-A353 PolarHBondContact O-N 3.41Å; N351-V354 PolarHBondContact O-N 3.37Å; N351-V355 WeakPolarHBondContact O-CG2 3.32Å; N351-V355 PolarHBondContact O-N 3.36Å
352	Q	86.1	Confident	81.5	Confident	120 Å²	120	79.8 Å²	79.8	56%	0.561	45%	0.446	S	S	*	.	H	α-helix	trans	-64.2	-38.8	178.1	-171.1	173.4	-4.1	0	0	112.5	A348 L349 L350 Q356	A348-Q352 PolarHBondContact O-N 3.29Å; L349-Q352 PolarHBondContact O-N 3.45Å; L350-Q352 VanDerWaalsContact C-N 3.33Å; L350-Q352 PolarHBondContact O-N 3.46Å; Q352-Q356 PolarHBondContact O-N 3.31Å
353	A	83.7	Confident	81.4	Confident	5 Å²	5	81.4 Å²	81.4	4%	0.041	46%	0.46	C	S	.	.	H	α-helix	trans	-69.3	-37.2	179.7	0	0	0	0	0	113	L349 L350 N351 Q356 I357 T364 I366	L349-A353 PolarHBondContact O-N 3.29Å; L350-A353 PolarHBondContact O-N 2.99Å; N351-A353 PolarHBondContact O-N 3.41Å; A353-Q356 PolarHBondContact O-N 3.18Å; A353-I357 WeakPolarHBondContact O-CG1 3.44Å; A353-I357 PolarHBondContact O-N 3.38Å; A353-T364 HydrophobicContact CB-CG2 4Å; A353-I366 HydrophobicContact CB-CB 4.5Å; A353-I366 HydrophobicContact CB-CG1 3.81Å
354	V	84.3	Confident	81	Confident	66 Å²	66	77.7 Å²	77.7	40%	0.4	44%	0.441	S	S	.	.	H	α-helix	trans	-63.8	-43.2	176.4	173	0	0	0	0	111.3	L350 N351 Q356 I357 G358 L381	L350-V354 WeakPolarHBondContact O-CG2 3.43Å; L350-V354 PolarHBondContact O-N 3.29Å; N351-V354 PolarHBondContact O-N 3.37Å; V354-Q356 VanDerWaalsContact C-N 3.34Å; V354-Q356 PolarHBondContact O-N 3.28Å; V354-I357 PolarHBondContact O-N 3.19Å; V354-G358 PolarHBondContact O-N 2.83Å; V354-G358 VanDerWaalsContact O-N 3.16Å; V354-L381 HydrophobicContact CG2-CD2 3.6Å
355	V	85.6	Confident	80.7	Confident	83 Å²	83	79.6 Å²	79.6	50%	0.503	45%	0.453	S	S	.	.	H	α-helix	trans	-61.8	-40.6	179.1	172.2	0	0	0	0	111.7	N351 G358 L359	N351-V355 WeakPolarHBondContact O-CG2 3.32Å; N351-V355 PolarHBondContact O-N 3.36Å; V355-G358 PolarHBondContact O-N 3.43Å; V355-L359 HydrophobicContact CG1-CD1 4.28Å; V355-L359 PolarHBondContact O-N 3.43Å
356	Q	83.2	Confident	80.6	Confident	94 Å²	94	73.1 Å²	73.1	44%	0.439	43%	0.425	S	S	.	.	H	α-helix	trans	-67.7	-36.7	179.7	-71.2	-171	-27.5	0	0	113	Q352 A353 V354 L359 G361 T364	Q352-Q356 PolarHBondContact O-N 3.31Å; A353-Q356 PolarHBondContact O-N 3.18Å; V354-Q356 VanDerWaalsContact C-N 3.34Å; V354-Q356 PolarHBondContact O-N 3.28Å; Q356-L359 PolarHBondContact O-N 3.23Å; Q356-G361 VanDerWaalsContact O-CA 3.32Å; Q356-G361 WeakPolarHBondContact O-CA 3.45Å; Q356-G361 PolarHBondContact O-N 3.48Å; Q356-T364 HydrophobicContact CB-CG2 3.84Å; Q356-T364 WeakPolarHBondContact CB-OG1 3.2Å
357	I	82.7	Confident	80.3	Confident	46 Å²	46	73 Å²	73	24%	0.236	43%	0.43	C	S	.	.	H	α-helix	trans	-66.5	-40.3	176.3	-66.7	168.2	0	0	0	111.1	A353 V354 L359 G360 T364 I366 L381 L385	A353-I357 WeakPolarHBondContact O-CG1 3.44Å; A353-I357 PolarHBondContact O-N 3.38Å; V354-I357 PolarHBondContact O-N 3.19Å; I357-L359 PolarHBondContact O-N 3.08Å; I357-G360 PolarHBondContact O-N 3.49Å; I357-G360 VanDerWaalsContact O-N 3.15Å; I357-T364 HydrophobicContact CG1-CG2 4.4Å; I357-I366 HydrophobicContact CD1-CD1 3.64Å; I357-I366 HydrophobicContact CD1-CG1 4.2Å; I357-L381 HydrophobicContact CD1-CD1 4.47Å; I357-L381 HydrophobicContact CD1-CD2 3.96Å; I357-L381 HydrophobicContact CD1-CG 3.97Å; I357-L385 HydrophobicContact CD1-CD1 4.4Å; I357-L385 HydrophobicContact CD1-CD2 4.12Å; I357-L385 HydrophobicContact CG1-CD1 4.15Å; I357-L385 HydrophobicContact CG1-CD2 4.26Å; I357-L385 HydrophobicContact CG2-CD1 4.33Å
358	G	80.6	Confident	79.9	Confident	70 Å²	70	69.3 Å²	69.3	72%	0.722	42%	0.418	S	S	*	.	H	α-helix	trans	-63.2	-25.3	177.7	0	0	0	0	0	114.3	V354 V355 G360	V354-G358 PolarHBondContact O-N 2.83Å; V354-G358 VanDerWaalsContact O-N 3.16Å; V355-G358 PolarHBondContact O-N 3.43Å; G358-G360 VanDerWaalsContact C-N 3.32Å
359	L	83	Confident	79.5	Confident	148 Å²	148	73.9 Å²	73.9	78%	0.775	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	10.8	177.7	-67.5	171.5	0	0	0	113.6	V355 Q356 I357 G361	V355-L359 HydrophobicContact CG1-CD1 4.28Å; V355-L359 PolarHBondContact O-N 3.43Å; Q356-L359 PolarHBondContact O-N 3.23Å; I357-L359 PolarHBondContact O-N 3.08Å; L359-G361 VanDerWaalsContact C-N 3.34Å
360	G	76.3	Confident	78.9	Confident	56 Å²	56	71.8 Å²	71.8	58%	0.577	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.5	11.6	-177.3	0	0	0	0	0	114.1	I357 G358 T362	I357-G360 PolarHBondContact O-N 3.49Å; I357-G360 VanDerWaalsContact O-N 3.15Å; G358-G360 VanDerWaalsContact C-N 3.32Å; G360-T362 VanDerWaalsContact C-N 3.33Å; G360-T362 PolarHBondContact O-N 3.17Å
361	G	75.5	Confident	78.7	Confident	29 Å²	29	79.3 Å²	79.3	30%	0.299	46%	0.464	S	S	.	.			trans	-71.8	83.1	174.9	0	0	0	0	0	111.8	Q356 L359 E363 T364	Q356-G361 VanDerWaalsContact O-CA 3.32Å; Q356-G361 WeakPolarHBondContact O-CA 3.45Å; Q356-G361 PolarHBondContact O-N 3.48Å; L359-G361 VanDerWaalsContact C-N 3.34Å; G361-E363 PolarHBondContact O-N 2.62Å; G361-T364 PolarHBondContact O-N 2.66Å; G361-T364 PolarHBondContact O-OG1 3.26Å
362	T	68.8	Low	78.5	Confident	63 Å²	63	77.1 Å²	77.1	39%	0.387	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-7.1	-179.8	48.7	0	0	0	0	114.5	G360 N389	G360-T362 VanDerWaalsContact C-N 3.33Å; G360-T362 PolarHBondContact O-N 3.17Å; T362-N389 VanDerWaalsContact CB-OD1 3.25Å; T362-N389 WeakPolarHBondContact CB-OD1 3.25Å; T362-N389 WeakPolarHBondContact CG2-OD1 3.21Å; T362-N389 PolarHBondContact O-ND2 3.2Å
363	E	71.9	Confident	78.3	Confident	180 Å²	180	77.5 Å²	77.5	84%	0.841	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	9.9	-178.3	-60.6	-166.4	169.6	0	0	114.1	G361 T365	G361-E363 PolarHBondContact O-N 2.62Å; E363-T365 PolarHBondContact O-N 3.16Å
364	T	71.5	Confident	78.3	Confident	12 Å²	12	78.7 Å²	78.7	7%	0.074	46%	0.459	C	S	.	.			trans	-69.2	125	-175	-51.6	0	0	0	0	112.2	A353 Q356 I357 G361 L385	A353-T364 HydrophobicContact CB-CG2 4Å; Q356-T364 HydrophobicContact CB-CG2 3.84Å; Q356-T364 WeakPolarHBondContact CB-OG1 3.2Å; I357-T364 HydrophobicContact CG1-CG2 4.4Å; G361-T364 PolarHBondContact O-N 2.66Å; G361-T364 PolarHBondContact O-OG1 3.26Å; T364-L385 WeakPolarHBondContact O-CD2 3.47Å
365	T	76.5	Confident	78.2	Confident	126 Å²	126	75.8 Å²	75.8	77%	0.773	44%	0.442	S	S	*	.			trans	-89.2	121.4	173.9	57.5	0	0	0	0	111.1	E363 P367	E363-T365 PolarHBondContact O-N 3.16Å; T365-P367 WeakPolarHBondContact O-CD 3.44Å
366	I	78.4	Confident	78.2	Confident	4 Å²	4	80.5 Å²	80.5	2%	0.021	45%	0.451	C	S	.	.			trans	-101.5	108.4	178.7	-58.8	150.1	0	0	0	109.4	L350 A353 I357 A378 L381 R382	L350-I366 HydrophobicContact CD1-CG2 4.39Å; A353-I366 HydrophobicContact CB-CB 4.5Å; A353-I366 HydrophobicContact CB-CG1 3.81Å; I357-I366 HydrophobicContact CD1-CD1 3.64Å; I357-I366 HydrophobicContact CD1-CG1 4.2Å; I366-A378 HydrophobicContact CG2-CB 4Å; I366-A378 WeakPolarHBondContact CG2-O 3.17Å; I366-L381 VanDerWaalsContact CD1-C 3.46Å; I366-L381 HydrophobicContact CD1-CB 3.78Å; I366-L381 HydrophobicContact CD1-CD2 3.53Å; I366-L381 HydrophobicContact CD1-CG 3.51Å; I366-L381 HydrophobicContact CG1-CD2 3.93Å; I366-L381 HydrophobicContact CG1-CG 4.44Å; I366-L381 HydrophobicContact CG2-CD2 4.35Å; I366-R382 HydrophobicContact CB-CB 4.36Å; I366-R382 HydrophobicContact CD1-CB 4.23Å; I366-R382 VanDerWaalsContact O-CZ 3.25Å; I366-R382 PolarHBondContact O-NE 3.4Å; I366-R382 PolarHBondContact O-NH2 3.07Å
367	P	74.5	Confident	78.4	Confident	44 Å²	44	80.3 Å²	80.3	29%	0.286	45%	0.452	S	S	.	.			trans	-72.9	127.6	175.2	26.4	-30.8	0	0	0	111.5	L349 T365 Y369	L349-P367 HydrophobicContact CB-CG 4.46Å; T365-P367 WeakPolarHBondContact O-CD 3.44Å; P367-Y369 HydrophobicContact CB-CD2 4.06Å; P367-Y369 HydrophobicContact CB-CE2 3.51Å; P367-Y369 HydrophobicContact CG-CE2 4.5Å
368	V	75.9	Confident	78.5	Confident	51 Å²	51	78.3 Å²	78.3	31%	0.309	44%	0.443	S	S	.	.			trans	-107.4	109.3	-179.8	-173.9	0	0	0	0	108.3	G375 A378	V368-G375 WeakPolarHBondContact CG1-O 3.36Å; V368-A378 HydrophobicContact CB-CB 4.23Å; V368-A378 HydrophobicContact CG1-CB 4.23Å; V368-A378 HydrophobicContact CG2-CB 3.91Å
369	Y	77	Confident	78.8	Confident	152 Å²	152	76.4 Å²	76.4	60%	0.596	42%	0.422	S	S	*	.			trans	-130	142.7	176.5	-60.7	-66.7	0	0	0	109.8	R346 P367 G375	R346-Y369 PolarHBondContact NE-O 3.43Å; R346-Y369 PolarHBondContact NH2-O 3.23Å; P367-Y369 HydrophobicContact CB-CD2 4.06Å; P367-Y369 HydrophobicContact CB-CE2 3.51Å; P367-Y369 HydrophobicContact CG-CE2 4.5Å; Y369-G375 VanDerWaalsContact O-CA 3.27Å; Y369-G375 WeakPolarHBondContact O-CA 3.27Å
370	G	71.8	Confident	79	Confident	41 Å²	41	75.2 Å²	75.2	42%	0.423	42%	0.416	S	S	.	.			trans	84.8	155	175	0	0	0	0	0	115.1	G375	G370-G375 WeakPolarHBondContact O-CA 3.44Å
371	N	79.9	Confident	79.5	Confident	180 Å²	180	74.7 Å²	74.7	96%	0.963	40%	0.4	S	S	*	.	S	Bend	trans	-102.7	16	174.4	-71.5	-5.8	0	0	0	112.3
372	D	81.8	Confident	80	Confident	50 Å²	50	79.7 Å²	79.7	27%	0.267	41%	0.41	S	S	.	.	S	Bend	trans	-86.4	-174.3	173.6	60.7	16.3	0	0	0	110.4	R346 L374 G375 R376	R346-D372 IonicContact CZ-OD1 2.75Å; R346-D372 IonicContact CZ-OD2 2.97Å; R346-D372 IonicContact NH1-OD1 3.68Å; R346-D372 IonicContact NH1-OD2 3.92Å; R346-D372 PolarHBondContact NH1-OD2 3.22Å; R346-D372 VanDerWaalsContact NH2-CG 3.3Å; R346-D372 IonicContact NH2-OD1 2.77Å; R346-D372 PolarHBondContact NH2-OD1 3.33Å; R346-D372 IonicContact NH2-OD2 3.83Å; R346-D372 PolarHBondContact NH2-OD2 3.32Å; R346-D372 VanDerWaalsContact NH2-OD2 3.16Å; D372-L374 PolarHBondContact O-N 2.71Å; D372-L374 PolarHBondContact OD1-N 2.97Å; D372-G375 PolarHBondContact O-N 2.93Å; D372-G375 PolarHBondContact OD1-N 3.15Å; D372-G375 VanDerWaalsContact OD1-N 3.08Å; D372-R376 PolarHBondContact O-N 3.16Å
373	E	81.5	Confident	80.8	Confident	128 Å²	128	82.3 Å²	82.3	60%	0.598	42%	0.418	S	S	*	.	H	α-helix	trans	-58.7	-35	-178.7	-65.1	73.7	-162.6	0	0	112.1	I377	E373-I377 WeakPolarHBondContact O-CD1 3.22Å; E373-I377 VanDerWaalsContact O-CG1 3.22Å; E373-I377 WeakPolarHBondContact O-CG1 3.32Å; E373-I377 PolarHBondContact O-N 3.21Å
374	L	82.7	Confident	81.5	Confident	30 Å²	30	76.9 Å²	76.9	16%	0.157	40%	0.397	C	S	.	.	H	α-helix	trans	-70.3	-40.4	179.3	-75.4	164.1	0	0	0	112.2	L343 F347 L350 D372 I377 A378	L343-L374 HydrophobicContact CD2-CD1 4.29Å; F347-L374 HydrophobicContact CD2-CD2 3.95Å; L350-L374 HydrophobicContact CD2-CD2 3.93Å; D372-L374 PolarHBondContact O-N 2.71Å; D372-L374 PolarHBondContact OD1-N 2.97Å; L374-I377 PolarHBondContact O-N 3.35Å; L374-A378 PolarHBondContact O-N 3.27Å
375	G	83.6	Confident	82.1	Confident	4 Å²	4	77.3 Å²	77.3	4%	0.041	40%	0.398	C	S	.	.	H	α-helix	trans	-66.5	-41.8	178.2	0	0	0	0	0	112.9	V368 Y369 G370 D372 I377 A378 G379	V368-G375 WeakPolarHBondContact CG1-O 3.36Å; Y369-G375 VanDerWaalsContact O-CA 3.27Å; Y369-G375 WeakPolarHBondContact O-CA 3.27Å; G370-G375 WeakPolarHBondContact O-CA 3.44Å; D372-G375 PolarHBondContact O-N 2.93Å; D372-G375 PolarHBondContact OD1-N 3.15Å; D372-G375 VanDerWaalsContact OD1-N 3.08Å; G375-I377 VanDerWaalsContact C-N 3.32Å; G375-I377 PolarHBondContact O-N 3.22Å; G375-A378 PolarHBondContact O-N 3.39Å; G375-G379 PolarHBondContact O-N 3.4Å; G375-G379 VanDerWaalsContact O-N 3.07Å
376	R	85.9	Confident	82.5	Confident	182 Å²	182	73.2 Å²	73.2	69%	0.687	38%	0.381	S	S	*	.	H	α-helix	trans	-61.3	-40.5	177.2	-171.2	172.5	64	-144.7	-2.5	112.2	D372 G379 L380	D372-R376 PolarHBondContact O-N 3.16Å; R376-G379 PolarHBondContact O-N 2.95Å; R376-L380 PolarHBondContact O-N 3.26Å
377	I	86.6	Confident	82.8	Confident	91 Å²	91	78.1 Å²	78.1	47%	0.467	40%	0.404	S	S	.	.	H	α-helix	trans	-64.6	-45.7	177.5	-65.6	164.5	0	0	0	110.9	L350 E373 L374 G375 G379 L380 L381	L350-I377 HydrophobicContact CD1-CG2 4.42Å; L350-I377 HydrophobicContact CD2-CB 4.18Å; L350-I377 HydrophobicContact CD2-CG2 3.84Å; E373-I377 WeakPolarHBondContact O-CD1 3.22Å; E373-I377 VanDerWaalsContact O-CG1 3.22Å; E373-I377 WeakPolarHBondContact O-CG1 3.32Å; E373-I377 PolarHBondContact O-N 3.21Å; L374-I377 PolarHBondContact O-N 3.35Å; G375-I377 VanDerWaalsContact C-N 3.32Å; G375-I377 PolarHBondContact O-N 3.22Å; I377-G379 VanDerWaalsContact C-N 3.32Å; I377-G379 PolarHBondContact O-N 3.29Å; I377-L380 PolarHBondContact O-N 3.47Å; I377-L381 PolarHBondContact O-N 3.3Å
378	A	85.8	Confident	83.2	Confident	4 Å²	4	80.7 Å²	80.7	3%	0.033	42%	0.415	C	S	.	.	H	α-helix	trans	-60.6	-40.2	178.7	0	0	0	0	0	112.4	L350 I366 V368 L374 G375 R382	L350-A378 HydrophobicContact CD1-CB 3.93Å; I366-A378 HydrophobicContact CG2-CB 4Å; I366-A378 WeakPolarHBondContact CG2-O 3.17Å; V368-A378 HydrophobicContact CB-CB 4.23Å; V368-A378 HydrophobicContact CG1-CB 4.23Å; V368-A378 HydrophobicContact CG2-CB 3.91Å; L374-A378 PolarHBondContact O-N 3.27Å; G375-A378 PolarHBondContact O-N 3.39Å; A378-R382 PolarHBondContact O-N 3.32Å
379	G	87	Confident	83.5	Confident	29 Å²	29	80.9 Å²	80.9	30%	0.299	41%	0.414	S	S	.	.	H	α-helix	trans	-64.9	-45.5	-179.5	0	0	0	0	0	113.5	G375 R376 I377 R382 H383	G375-G379 PolarHBondContact O-N 3.4Å; G375-G379 VanDerWaalsContact O-N 3.07Å; R376-G379 PolarHBondContact O-N 2.95Å; I377-G379 VanDerWaalsContact C-N 3.32Å; I377-G379 PolarHBondContact O-N 3.29Å; G379-R382 PolarHBondContact O-N 3.31Å; G379-H383 PolarHBondContact O-N 3.45Å
380	L	87.3	Confident	83.9	Confident	123 Å²	123	77.5 Å²	77.5	64%	0.644	41%	0.409	S	S	*	.	H	α-helix	trans	-61.4	-45.9	177.7	-175.2	65.8	0	0	0	111.3	R376 I377 R382 H383 T384	R376-L380 PolarHBondContact O-N 3.26Å; I377-L380 PolarHBondContact O-N 3.47Å; L380-R382 VanDerWaalsContact C-N 3.31Å; L380-R382 PolarHBondContact O-N 3.25Å; L380-H383 PolarHBondContact O-N 3.45Å; L380-T384 PolarHBondContact O-N 3.19Å; L380-T384 PolarHBondContact O-OG1 3.17Å
381	L	86.5	Confident	84.3	Confident	45 Å²	45	81.8 Å²	81.8	24%	0.236	42%	0.418	C	S	.	.	H	α-helix	trans	-61.1	-38.7	-178.6	-163.5	77	0	0	0	112.2	L350 V354 I357 I366 I377 L385	L350-L381 HydrophobicContact CD1-CD2 4.5Å; V354-L381 HydrophobicContact CG2-CD2 3.6Å; I357-L381 HydrophobicContact CD1-CD1 4.47Å; I357-L381 HydrophobicContact CD1-CD2 3.96Å; I357-L381 HydrophobicContact CD1-CG 3.97Å; I366-L381 VanDerWaalsContact CD1-C 3.46Å; I366-L381 HydrophobicContact CD1-CB 3.78Å; I366-L381 HydrophobicContact CD1-CD2 3.53Å; I366-L381 HydrophobicContact CD1-CG 3.51Å; I366-L381 HydrophobicContact CG1-CD2 3.93Å; I366-L381 HydrophobicContact CG1-CG 4.44Å; I366-L381 HydrophobicContact CG2-CD2 4.35Å; I377-L381 PolarHBondContact O-N 3.3Å; L381-L385 PolarHBondContact O-N 3.32Å
382	R	85.8	Confident	84.4	Confident	134 Å²	134	78.9 Å²	78.9	51%	0.506	40%	0.397	S	S	.	.	H	α-helix	trans	-64.9	-43	178.1	-173.8	-169.1	-70.8	-170.1	-4.2	112	I366 A378 G379 L380 L385 G386	I366-R382 HydrophobicContact CB-CB 4.36Å; I366-R382 HydrophobicContact CD1-CB 4.23Å; I366-R382 VanDerWaalsContact O-CZ 3.25Å; I366-R382 PolarHBondContact O-NE 3.4Å; I366-R382 PolarHBondContact O-NH2 3.07Å; A378-R382 PolarHBondContact O-N 3.32Å; G379-R382 PolarHBondContact O-N 3.31Å; L380-R382 VanDerWaalsContact C-N 3.31Å; L380-R382 PolarHBondContact O-N 3.25Å; R382-L385 PolarHBondContact O-N 3.23Å; R382-G386 PolarHBondContact O-N 3.34Å
383	H	85.8	Confident	84.4	Confident	119 Å²	119	83.4 Å²	83.4	55%	0.551	42%	0.416	S	S	*	.	H	α-helix	trans	-63.9	-44.5	-178.5	-175.2	68.6	0	0	0	111.7	G379 L380 L385 G386 Q387	G379-H383 PolarHBondContact O-N 3.45Å; L380-H383 PolarHBondContact O-N 3.45Å; H383-L385 PolarHBondContact O-N 3.24Å; H383-G386 PolarHBondContact O-N 3.47Å; H383-Q387 PolarHBondContact NE2-NE2 3.46Å; H383-Q387 VanDerWaalsContact NE2-NE2 3.18Å; H383-Q387 PolarHBondContact O-N 3.46Å
384	T	85.5	Confident	84.4	Confident	66 Å²	66	83.7 Å²	83.7	41%	0.405	42%	0.418	S	S	.	.	H	α-helix	trans	-62.2	-40.6	178.7	-51.7	0	0	0	0	112.4	L380 G386 Q387 L388	L380-T384 PolarHBondContact O-N 3.19Å; L380-T384 PolarHBondContact O-OG1 3.17Å; T384-G386 VanDerWaalsContact C-N 3.34Å; T384-G386 PolarHBondContact O-N 3.4Å; T384-Q387 PolarHBondContact O-N 3.46Å; T384-L388 HydrophobicContact CG2-CD1 4.39Å; T384-L388 WeakPolarHBondContact O-CG 3.43Å; T384-L388 PolarHBondContact O-N 3.44Å
385	L	84.7	Confident	84.4	Confident	20 Å²	20	87.6 Å²	87.6	11%	0.105	44%	0.438	C	S	.	.	H	α-helix	trans	-63	-39.8	178.4	-171.8	65.6	0	0	0	112.3	I357 T364 L381 R382 H383 L388 N389	I357-L385 HydrophobicContact CD1-CD1 4.4Å; I357-L385 HydrophobicContact CD1-CD2 4.12Å; I357-L385 HydrophobicContact CG1-CD1 4.15Å; I357-L385 HydrophobicContact CG1-CD2 4.26Å; I357-L385 HydrophobicContact CG2-CD1 4.33Å; T364-L385 WeakPolarHBondContact O-CD2 3.47Å; L381-L385 PolarHBondContact O-N 3.32Å; R382-L385 PolarHBondContact O-N 3.23Å; H383-L385 PolarHBondContact O-N 3.24Å; L385-L388 PolarHBondContact O-N 3.43Å; L385-N389 PolarHBondContact O-N 3.47Å
386	G	84.3	Confident	84.3	Confident	40 Å²	40	92.7 Å²	92.7	41%	0.412	46%	0.461	S	S	.	.	H	α-helix	trans	-65.5	-39.5	180	0	0	0	0	0	113.8	R382 H383 T384	R382-G386 PolarHBondContact O-N 3.34Å; H383-G386 PolarHBondContact O-N 3.47Å; T384-G386 VanDerWaalsContact C-N 3.34Å; T384-G386 PolarHBondContact O-N 3.4Å
387	Q	84.2	Confident	84.1	Confident	107 Å²	107	89.7 Å²	89.7	50%	0.5	46%	0.455	S	S	.	.	H	α-helix	trans	-66.9	-37.6	179.4	-72.1	-178	-29.2	0	0	112.6	H383 T384 Q391	H383-Q387 PolarHBondContact NE2-NE2 3.46Å; H383-Q387 VanDerWaalsContact NE2-NE2 3.18Å; H383-Q387 PolarHBondContact O-N 3.46Å; T384-Q387 PolarHBondContact O-N 3.46Å; Q387-Q391 PolarHBondContact O-N 3.47Å
388	L	84.2	Confident	83.9	Confident	99 Å²	99	91 Å²	91	52%	0.518	46%	0.459	S	S	.	.	H	α-helix	trans	-65.4	-39.9	-179.8	-72.2	169	0	0	0	112.7	T384 L385 K392	T384-L388 HydrophobicContact CG2-CD1 4.39Å; T384-L388 WeakPolarHBondContact O-CG 3.43Å; T384-L388 PolarHBondContact O-N 3.44Å; L385-L388 PolarHBondContact O-N 3.43Å; L388-K392 PolarHBondContact O-N 3.49Å
389	N	82.6	Confident	83.7	Confident	55 Å²	55	95 Å²	95	29%	0.294	48%	0.479	S	S	.	.	H	α-helix	trans	-66.1	-39.8	-178.9	-81.7	-11.7	0	0	0	113.3	T362 L385 K392 Q393	T362-N389 VanDerWaalsContact CB-OD1 3.25Å; T362-N389 WeakPolarHBondContact CB-OD1 3.25Å; T362-N389 WeakPolarHBondContact CG2-OD1 3.21Å; T362-N389 PolarHBondContact O-ND2 3.2Å; L385-N389 PolarHBondContact O-N 3.47Å; N389-K392 PolarHBondContact O-N 3.31Å; N389-Q393 PolarHBondContact O-N 3.34Å
390	V	83.9	Confident	83.5	Confident	80 Å²	80	97.6 Å²	97.6	49%	0.485	49%	0.489	S	S	.	.	H	α-helix	trans	-67.3	-42.8	-179	174.7	0	0	0	0	111.5	K392 Q393 Q394	V390-K392 VanDerWaalsContact C-N 3.32Å; V390-K392 PolarHBondContact O-N 3.44Å; V390-Q393 PolarHBondContact O-N 3.18Å; V390-Q394 PolarHBondContact O-N 3.49Å
391	Q	81.5	Confident	83.2	Confident	131 Å²	131	96 Å²	96	61%	0.612	48%	0.481	S	S	*	.	H	α-helix	trans	-64.3	-37.2	179.7	-72.6	-178	-20.5	0	0	112.3	Q387 L395	Q387-Q391 PolarHBondContact O-N 3.47Å; Q391-L395 PolarHBondContact O-N 3.48Å
392	K	81.7	Confident	82.6	Confident	119 Å²	119	102.5 Å²	102.5	52%	0.517	50%	0.502	S	S	.	.	H	α-helix	trans	-61.7	-47.8	178.9	-174.9	-176.8	172.7	-174.5	0	112.3	L388 N389 V390 Q394 L395 E396	L388-K392 PolarHBondContact O-N 3.49Å; N389-K392 PolarHBondContact O-N 3.31Å; V390-K392 VanDerWaalsContact C-N 3.32Å; V390-K392 PolarHBondContact O-N 3.44Å; K392-Q394 PolarHBondContact O-N 3.45Å; K392-L395 PolarHBondContact O-N 3.46Å; K392-E396 WeakPolarHBondContact CE-OE1 3.39Å; K392-E396 PolarHBondContact O-N 3.1Å
393	Q	80.7	Confident	82.3	Confident	145 Å²	145	103.5 Å²	103.5	68%	0.678	51%	0.51	S	S	*	.	H	α-helix	trans	-66.2	-37.3	-175.6	-76.4	-178.1	-34.5	0	0	113.5	N389 V390	N389-Q393 PolarHBondContact O-N 3.34Å; V390-Q393 PolarHBondContact O-N 3.18Å
394	Q	82.3	Confident	81.9	Confident	134 Å²	134	102.9 Å²	102.9	63%	0.626	52%	0.515	S	S	*	.	H	α-helix	trans	-67.3	-38.6	-179.3	-70.8	178.3	-22.1	0	0	112.2	V390 K392 E398	V390-Q394 PolarHBondContact O-N 3.49Å; K392-Q394 PolarHBondContact O-N 3.45Å; Q394-E398 PolarHBondContact O-N 3.29Å
395	L	82.9	Confident	81.5	Confident	112 Å²	112	105.8 Å²	105.8	59%	0.586	53%	0.527	S	S	*	.	H	α-helix	trans	-68.4	-38.4	-177.4	-147.7	90.6	0	0	0	112.5	Q391 K392 Q397 I399	Q391-L395 PolarHBondContact O-N 3.48Å; K392-L395 PolarHBondContact O-N 3.46Å; L395-Q397 PolarHBondContact O-N 3.11Å; L395-I399 HydrophobicContact CD2-CD1 4.48Å; L395-I399 WeakPolarHBondContact O-CG1 3.49Å
396	E	81.5	Confident	81	Confident	112 Å²	112	110.3 Å²	110.3	52%	0.523	55%	0.547	S	S	.	.	H	α-helix	trans	-66.3	-36.6	-177.6	-73.9	176.9	172.2	0	0	112.3	K392 T400	K392-E396 WeakPolarHBondContact CE-OE1 3.39Å; K392-E396 PolarHBondContact O-N 3.1Å; E396-T400 PolarHBondContact O-OG1 3.48Å; E396-T400 VanDerWaalsContact O-OG1 3.1Å
397	Q	80.9	Confident	80.5	Confident	118 Å²	118	111.7 Å²	111.7	55%	0.551	56%	0.555	S	S	*	*	H	α-helix	trans	-71.1	-46.3	180	-169.5	66.3	27.5	0	0	112.2	L395 I399 T400 D401	L395-Q397 PolarHBondContact O-N 3.11Å; Q397-I399 VanDerWaalsContact C-N 3.29Å; Q397-I399 PolarHBondContact O-N 3.49Å; Q397-T400 PolarHBondContact O-N 3.5Å; Q397-T400 VanDerWaalsContact O-N 3.11Å; Q397-D401 PolarHBondContact O-N 3.47Å
398	E	83.2	Confident	80	Confident	119 Å²	119	112.6 Å²	112.6	56%	0.556	56%	0.563	S	S	*	*	H	α-helix	trans	-65.6	-31.6	-173.4	-158.8	178.5	-174.9	0	0	113	Q394 T400	Q394-E398 PolarHBondContact O-N 3.29Å; E398-T400 VanDerWaalsContact C-N 3.33Å
399	I	82.3	Confident	79.6	Confident	88 Å²	88	113.7 Å²	113.7	45%	0.451	57%	0.569	S	S	.	*	H	α-helix	trans	-68.3	-34.8	176.5	-69.2	171.3	0	0	0	111.6	L395 Q397	L395-I399 HydrophobicContact CD2-CD1 4.48Å; L395-I399 WeakPolarHBondContact O-CG1 3.49Å; Q397-I399 VanDerWaalsContact C-N 3.29Å; Q397-I399 PolarHBondContact O-N 3.49Å
400	T	81.2	Confident	79.1	Confident	83 Å²	83	118.8 Å²	118.8	51%	0.509	58%	0.584	S	S	.	*	H	α-helix	trans	-72.1	-45.3	-174.3	-57.4	0	0	0	0	111	E396 Q397 E398 R402 K403	E396-T400 PolarHBondContact O-OG1 3.48Å; E396-T400 VanDerWaalsContact O-OG1 3.1Å; Q397-T400 PolarHBondContact O-N 3.5Å; Q397-T400 VanDerWaalsContact O-N 3.11Å; E398-T400 VanDerWaalsContact C-N 3.33Å; T400-R402 PolarHBondContact O-N 3.46Å; T400-K403 PolarHBondContact O-N 3.46Å
401	D	80.8	Confident	78.3	Confident	89 Å²	89	118.2 Å²	118.2	48%	0.476	59%	0.588	S	S	.	*	H	α-helix	trans	-68.3	-36.6	-175.3	-66.6	-22.8	0	0	0	113	Q397 K403	Q397-D401 PolarHBondContact O-N 3.47Å; D401-K403 PolarHBondContact O-N 3.49Å
402	R	75.7	Confident	77.6	Confident	182 Å²	182	115.7 Å²	115.7	69%	0.687	58%	0.581	S	S	*	*	H	α-helix	trans	-63.8	-37.4	179.8	-82	-170.9	178.4	-171.1	3.7	113.7	T400 V404	T400-R402 PolarHBondContact O-N 3.46Å; R402-V404 VanDerWaalsContact C-N 3.31Å; R402-V404 PolarHBondContact O-N 3.41Å
403	K	78.4	Confident	77	Confident	155 Å²	155	116.3 Å²	116.3	67%	0.674	59%	0.586	S	S	*	*	H	α-helix	trans	-66.8	-32.6	-175.3	-76.5	-177.5	175.6	179.1	0	113	T400 D401	T400-K403 PolarHBondContact O-N 3.46Å; D401-K403 PolarHBondContact O-N 3.49Å
404	V	77.5	Confident	76.3	Confident	106 Å²	106	114.9 Å²	114.9	64%	0.642	58%	0.583	S	S	*	*	H	α-helix	trans	-72.3	-41.7	-178	177.3	0	0	0	0	111.3	R402 E406	R402-V404 VanDerWaalsContact C-N 3.31Å; R402-V404 PolarHBondContact O-N 3.41Å; V404-E406 PolarHBondContact O-N 3.41Å
405	I	77.7	Confident	75.4	Confident	128 Å²	128	115.3 Å²	115.3	66%	0.656	59%	0.585	S	S	*	*	H	α-helix	trans	-69.1	-36.3	-174.9	-63.5	171.8	0	0	0	112.3	A407	I405-A407 PolarHBondContact O-N 3.46Å
406	E	74.4	Confident	74.6	Confident	114 Å²	114	116 Å²	116	53%	0.533	59%	0.588	S	S	.	*	H	α-helix	trans	-70.6	-30.8	-175.5	-159.4	-175.4	161.3	0	0	113.4	V404 R410	V404-E406 PolarHBondContact O-N 3.41Å; E406-R410 IonicContact OE1-CZ 3.1Å; E406-R410 IonicContact OE1-NH2 3.54Å; E406-R410 PolarHBondContact OE1-NH2 3.47Å
407	A	73.4	Confident	73.6	Confident	70 Å²	70	115.3 Å²	115.3	58%	0.579	59%	0.588	S	S	*	*	H	α-helix	trans	-70.9	-39.4	-177.9	0	0	0	0	0	112.8	I405	I405-A407 PolarHBondContact O-N 3.46Å
408	D	72.5	Confident	72.6	Confident	126 Å²	126	114 Å²	114	67%	0.674	58%	0.582	S	S	*	*	H	α-helix	trans	-69.6	-40	-175.4	-162.9	41.5	0	0	0	112.3	R410 A411 T412	D408-R410 VanDerWaalsContact C-N 3.34Å; D408-R410 PolarHBondContact O-N 3.25Å; D408-A411 PolarHBondContact O-N 3.39Å; D408-T412 PolarHBondContact O-OG1 3.44Å
409	L	75.7	Confident	71.3	Confident	121 Å²	121	113.1 Å²	113.1	63%	0.634	58%	0.584	S	S	*	*	H	α-helix	trans	-63	-35.4	-177.5	-175.1	64.7	0	0	0	113.7
410	R	71.9	Confident	69.9	Low	162 Å²	162	111.6 Å²	111.6	61%	0.611	59%	0.585	S	S	*	*	H	α-helix	trans	-70.1	-36.9	-177.4	-69.6	-174.2	-172.3	-178.3	6	112.3	E406 D408 T412 Q413	E406-R410 IonicContact OE1-CZ 3.1Å; E406-R410 IonicContact OE1-NH2 3.54Å; E406-R410 PolarHBondContact OE1-NH2 3.47Å; D408-R410 VanDerWaalsContact C-N 3.34Å; D408-R410 PolarHBondContact O-N 3.25Å; R410-T412 PolarHBondContact O-N 2.79Å; R410-Q413 PolarHBondContact O-N 3.41Å
411	A	68.6	Low	68.6	Low	68 Å²	68	112.4 Å²	112.4	56%	0.562	58%	0.582	S	S	*	*	H	α-helix	trans	-65.9	-37.2	-176.3	0	0	0	0	0	112.8	D408 Q413	D408-A411 PolarHBondContact O-N 3.39Å; A411-Q413 PolarHBondContact O-N 3.5Å
412	T	66.7	Low	67.4	Low	79 Å²	79	114.4 Å²	114.4	49%	0.485	59%	0.592	S	S	.	*	H	α-helix	trans	-72.3	-26.9	-176.7	-16.3	0	0	0	0	113.4	D408 R410	D408-T412 PolarHBondContact O-OG1 3.44Å; R410-T412 PolarHBondContact O-N 2.79Å
413	Q	67.9	Low	66.3	Low	131 Å²	131	109 Å²	109	61%	0.612	59%	0.585	S	S	*	*	H	α-helix	trans	-71.4	-41.1	-178.4	-103.8	-176	-13.7	0	0	113.3	R410 A411 E415 L416	R410-Q413 PolarHBondContact O-N 3.41Å; A411-Q413 PolarHBondContact O-N 3.5Å; Q413-E415 VanDerWaalsContact C-N 3.33Å; Q413-E415 PolarHBondContact O-N 3.32Å; Q413-L416 PolarHBondContact O-N 3.22Å
414	D	66	Low	65.2	Low	116 Å²	116	103.3 Å²	103.3	62%	0.62	56%	0.564	S	S	*	*	H	α-helix	trans	-66.9	-33.1	-175.3	-77.5	-23	0	0	0	112.9
415	E	64	Low	64.1	Low	143 Å²	143	100.2 Å²	100.2	67%	0.668	55%	0.545	S	S	*	.	H	α-helix	trans	-66.9	-37.9	179.7	-168	176.2	-177	0	0	112.4	Q413 T419	Q413-E415 VanDerWaalsContact C-N 3.33Å; Q413-E415 PolarHBondContact O-N 3.32Å; E415-T419 PolarHBondContact O-OG1 3.35Å
416	L	66.7	Low	63.1	Low	125 Å²	125	96.7 Å²	96.7	65%	0.654	54%	0.54	S	S	*	.	H	α-helix	trans	-67.4	-38.1	-179.3	-70.7	171.4	0	0	0	112.8	Q413 Q418 T419 A420	Q413-L416 PolarHBondContact O-N 3.22Å; L416-Q418 PolarHBondContact O-N 3.45Å; L416-T419 PolarHBondContact O-N 3.2Å; L416-A420 PolarHBondContact O-N 3.2Å
417	I	60.6	Low	62.1	Low	99 Å²	99	98.9 Å²	98.9	51%	0.508	55%	0.55	S	S	.	*	H	α-helix	trans	-65.2	-37.8	-178.4	-67.2	174.2	0	0	0	111.8	A420 K421	I417-A420 PolarHBondContact O-N 3.44Å; I417-K421 PolarHBondContact O-N 3.36Å
418	Q	59.4	Low	61.2	Low	91 Å²	91	96.4 Å²	96.4	43%	0.425	53%	0.528	S	S	.	.	H	α-helix	trans	-66.1	-42.2	-179.9	-79.2	-67.1	-21	0	0	112.6	L416 A420 K421 L422	L416-Q418 PolarHBondContact O-N 3.45Å; Q418-A420 VanDerWaalsContact C-N 3.27Å; Q418-A420 PolarHBondContact O-N 3.31Å; Q418-K421 PolarHBondContact O-N 3.46Å; Q418-L422 PolarHBondContact O-N 3.5Å
419	T	55.9	Low	60.4	Low	99 Å²	99	95 Å²	95	61%	0.607	52%	0.519	S	S	*	.	H	α-helix	trans	-62.5	-37.4	-179.2	-54.2	0	0	0	0	111.4	E415 L416	E415-T419 PolarHBondContact O-OG1 3.35Å; L416-T419 PolarHBondContact O-N 3.2Å
420	A	52.6	Low	59.5	Low	57 Å²	57	94.7 Å²	94.7	47%	0.471	52%	0.522	S	S	.	.	H	α-helix	trans	-65.1	-39.4	176.2	0	0	0	0	0	113.4	L416 I417 Q418 L422 V424	L416-A420 PolarHBondContact O-N 3.2Å; I417-A420 PolarHBondContact O-N 3.44Å; Q418-A420 VanDerWaalsContact C-N 3.27Å; Q418-A420 PolarHBondContact O-N 3.31Å; A420-L422 VanDerWaalsContact C-N 3.34Å; A420-L422 PolarHBondContact O-N 3.28Å; A420-V424 WeakPolarHBondContact O-CB 3.28Å; A420-V424 VanDerWaalsContact O-CG2 3.28Å; A420-V424 WeakPolarHBondContact O-CG2 3.27Å; A420-V424 PolarHBondContact O-N 3.41Å
421	K	54.3	Low	58.8	Low	100 Å²	100	90.8 Å²	90.8	44%	0.435	52%	0.516	S	S	.	.	H	α-helix	trans	-62.6	-37.4	-179.6	-76	-178.4	177.2	179.5	0	113.1	I417 Q418 V424 V425	I417-K421 PolarHBondContact O-N 3.36Å; Q418-K421 PolarHBondContact O-N 3.46Å; K421-V424 WeakPolarHBondContact O-CB 3.45Å; K421-V425 PolarHBondContact O-N 3.03Å
422	L	55.4	Low	58.4	Low	131 Å²	131	88.1 Å²	88.1	69%	0.686	49%	0.492	S	S	*	.	H	α-helix	trans	-73.6	-39.7	-178.2	-72.4	168.9	0	0	0	112.8	Q418 A420 V424 V425 G426	Q418-L422 PolarHBondContact O-N 3.5Å; A420-L422 VanDerWaalsContact C-N 3.34Å; A420-L422 PolarHBondContact O-N 3.28Å; L422-V424 VanDerWaalsContact C-N 3.26Å; L422-V424 PolarHBondContact O-N 3.18Å; L422-V425 PolarHBondContact O-N 2.92Å; L422-G426 PolarHBondContact O-N 2.85Å
423	A	52.3	Low	58.2	Low	67 Å²	67	86.7 Å²	86.7	55%	0.554	49%	0.489	S	S	*	.	H	α-helix	trans	-61	-39.3	177	0	0	0	0	0	112	G426 Q427	A423-G426 PolarHBondContact O-N 3.45Å; A423-Q427 PolarHBondContact O-N 3.33Å
424	V	55.6	Low	57.6	Low	36 Å²	36	86 Å²	86	22%	0.218	49%	0.485	C	S	.	.	H	α-helix	trans	-58.8	-46.4	178.5	146.4	0	0	0	0	111.7	A420 K421 L422 G426 Q427 T428 F486 P593 F594	A420-V424 WeakPolarHBondContact O-CB 3.28Å; A420-V424 VanDerWaalsContact O-CG2 3.28Å; A420-V424 WeakPolarHBondContact O-CG2 3.27Å; A420-V424 PolarHBondContact O-N 3.41Å; K421-V424 WeakPolarHBondContact O-CB 3.45Å; L422-V424 VanDerWaalsContact C-N 3.26Å; L422-V424 PolarHBondContact O-N 3.18Å; V424-G426 PolarHBondContact O-N 2.94Å; V424-Q427 PolarHBondContact O-N 3.23Å; V424-T428 PolarHBondContact O-OG1 3.44Å; V424-T428 VanDerWaalsContact O-OG1 3.12Å; V424-F486 HydrophobicContact CG1-CE1 4.3Å; V424-F486 HydrophobicContact CG1-CZ 4.11Å; V424-P593 HydrophobicContact CG1-CB 4.43Å; V424-F594 VanDerWaalsContact C-CZ 3.47Å; V424-F594 HydrophobicContact CB-CE2 3.44Å; V424-F594 VanDerWaalsContact CB-CE2 3.44Å; V424-F594 HydrophobicContact CB-CZ 3.79Å; V424-F594 HydrophobicContact CG1-CD2 4.16Å; V424-F594 HydrophobicContact CG1-CE1 4.1Å; V424-F594 HydrophobicContact CG1-CE2 3.1Å; V424-F594 HydrophobicContact CG1-CZ 3.04Å; V424-F594 HydrophobicContact CG2-CD2 4.32Å; V424-F594 HydrophobicContact CG2-CE2 3.63Å; V424-F594 HydrophobicContact CG2-CZ 4.43Å; V424-F594 VanDerWaalsContact O-CE2 3.27Å; V424-F594 WeakPolarHBondContact O-CE2 3.48Å; V424-F594 WeakPolarHBondContact O-CZ 3.28Å
425	V	53.8	Low	57.5	Low	42 Å²	42	81.7 Å²	81.7	26%	0.255	46%	0.461	S	S	.	.	H	α-helix	trans	-61.9	-40.4	177.3	173.2	0	0	0	0	112.3	K421 L422 Q427 T428 M429 F486	K421-V425 PolarHBondContact O-N 3.03Å; L422-V425 PolarHBondContact O-N 2.92Å; V425-Q427 VanDerWaalsContact C-N 3.3Å; V425-Q427 PolarHBondContact O-N 3.43Å; V425-T428 PolarHBondContact O-N 3.19Å; V425-T428 PolarHBondContact O-OG1 3.39Å; V425-M429 HydrophobicContact CG1-CE 4.21Å; V425-F486 HydrophobicContact CG2-CD1 3.97Å; V425-F486 HydrophobicContact CG2-CE1 3.68Å
426	G	56.5	Low	57.7	Low	53 Å²	53	77.5 Å²	77.5	55%	0.546	44%	0.443	S	S	.	.	H	α-helix	trans	-62	-38	-179.4	0	0	0	0	0	113	L422 A423 V424 T428	L422-G426 PolarHBondContact O-N 2.85Å; A423-G426 PolarHBondContact O-N 3.45Å; V424-G426 PolarHBondContact O-N 2.94Å; G426-T428 PolarHBondContact O-N 3.3Å
427	Q	53.6	Low	57.8	Low	160 Å²	160	75.5 Å²	75.5	75%	0.748	43%	0.433	S	S	*	.	H	α-helix	trans	-76.7	-20.4	-175	-161.7	142.1	-23.5	0	0	114	A423 V424 V425	A423-Q427 PolarHBondContact O-N 3.33Å; V424-Q427 PolarHBondContact O-N 3.23Å; V425-Q427 VanDerWaalsContact C-N 3.3Å; V425-Q427 PolarHBondContact O-N 3.43Å
428	T	55.2	Low	57.8	Low	18 Å²	18	75 Å²	75	11%	0.11	43%	0.428	C	S	.	.	H	α-helix	trans	-95	-8.3	-176.1	35.6	0	0	0	0	115.8	V424 V425 G426 T430 T431 L432 F594 L602	V424-T428 PolarHBondContact O-OG1 3.44Å; V424-T428 VanDerWaalsContact O-OG1 3.12Å; V425-T428 PolarHBondContact O-N 3.19Å; V425-T428 PolarHBondContact O-OG1 3.39Å; G426-T428 PolarHBondContact O-N 3.3Å; T428-T430 VanDerWaalsContact C-N 3.31Å; T428-T430 PolarHBondContact O-N 3.47Å; T428-T431 PolarHBondContact O-N 3.36Å; T428-L432 WeakPolarHBondContact O-CB 3.41Å; T428-L432 WeakPolarHBondContact O-CG 3.29Å; T428-L432 PolarHBondContact O-N 3.38Å; T428-F594 HydrophobicContact CG2-CD1 3.36Å; T428-F594 HydrophobicContact CG2-CD2 4.4Å; T428-F594 HydrophobicContact CG2-CE1 3.07Å; T428-F594 HydrophobicContact CG2-CE2 4.06Å; T428-F594 HydrophobicContact CG2-CG 4.03Å; T428-F594 HydrophobicContact CG2-CZ 3.42Å; T428-F594 VanDerWaalsContact CG2-CZ 3.42Å; T428-F594 WeakPolarHBondContact OG1-CZ 3.46Å; T428-L602 HydrophobicContact CG2-CD2 4.48Å
429	M	56.5	Low	58.5	Low	98 Å²	98	71.1 Å²	71.1	48%	0.483	41%	0.411	S	S	.	.	H	α-helix	trans	-62.2	-35.7	177.6	-72.9	-66.1	-172.7	0	0	113.2	V425 A433	V425-M429 HydrophobicContact CG1-CE 4.21Å; M429-A433 PolarHBondContact O-N 3.41Å
430	T	56.7	Low	59.3	Low	114 Å²	114	70 Å²	70	70%	0.699	40%	0.401	S	S	*	.	H	α-helix	trans	-68.5	-43.2	179.9	-51.9	0	0	0	0	112.1	T428 A433 H434	T428-T430 VanDerWaalsContact C-N 3.31Å; T428-T430 PolarHBondContact O-N 3.47Å; T430-A433 PolarHBondContact O-N 3.03Å; T430-H434 PolarHBondContact O-N 3.3Å
431	T	56.3	Low	60.5	Low	79 Å²	79	72.7 Å²	72.7	49%	0.485	41%	0.407	S	S	.	.	H	α-helix	trans	-67.7	-39.2	177.3	-50.3	0	0	0	0	111.2	T428 H434 E435	T428-T431 PolarHBondContact O-N 3.36Å; T431-H434 WeakPolarHBondContact O-CB 3.37Å; T431-H434 PolarHBondContact O-N 2.85Å; T431-H434 VanDerWaalsContact O-N 3.11Å; T431-E435 PolarHBondContact O-N 3.41Å
432	L	60	Low	61.5	Low	12 Å²	12	69.5 Å²	69.5	6%	0.063	40%	0.399	C	S	.	.	H	α-helix	trans	-61.5	-43.8	175.2	-85.4	168.4	0	0	0	112.9	T428 H434 E435 I436 I479 L483 L602	T428-L432 WeakPolarHBondContact O-CB 3.41Å; T428-L432 WeakPolarHBondContact O-CG 3.29Å; T428-L432 PolarHBondContact O-N 3.38Å; L432-H434 PolarHBondContact O-N 3.37Å; L432-E435 PolarHBondContact O-N 3.49Å; L432-I436 WeakPolarHBondContact O-CG1 3.42Å; L432-I436 PolarHBondContact O-N 3.14Å; L432-I479 HydrophobicContact CD2-CG2 4.26Å; L432-L483 HydrophobicContact CD1-CD1 3.72Å; L432-L602 HydrophobicContact CD1-CD1 4.46Å; L432-L602 HydrophobicContact CD1-CD2 4.09Å; L432-L602 HydrophobicContact CD2-CD1 3.61Å; L432-L602 HydrophobicContact CD2-CD2 3.66Å; L432-L602 HydrophobicContact CD2-CG 3.97Å; L432-L602 HydrophobicContact CG-CD1 4.3Å; L432-L602 HydrophobicContact CG-CD2 3.58Å; L432-L602 HydrophobicContact CG-CG 4.43Å
433	A	62.1	Low	62.8	Low	50 Å²	50	64.7 Å²	64.7	41%	0.413	38%	0.375	S	S	.	.	H	α-helix	trans	-58.4	-36.1	174.7	0	0	0	0	0	111.2	M429 T430 N437	M429-A433 PolarHBondContact O-N 3.41Å; T430-A433 PolarHBondContact O-N 3.03Å; A433-N437 VanDerWaalsContact O-CG 3.28Å; A433-N437 PolarHBondContact O-N 3.34Å; A433-N437 PolarHBondContact O-ND2 2.88Å
434	H	57.1	Low	64	Low	117 Å²	117	65 Å²	65	54%	0.542	37%	0.372	S	S	.	.	H	α-helix	trans	-71.7	-44.4	177.7	-157.9	66.3	0	0	0	112.9	T430 T431 L432 I436 N437 Q438	T430-H434 PolarHBondContact O-N 3.3Å; T431-H434 WeakPolarHBondContact O-CB 3.37Å; T431-H434 PolarHBondContact O-N 2.85Å; T431-H434 VanDerWaalsContact O-N 3.11Å; L432-H434 PolarHBondContact O-N 3.37Å; H434-I436 PolarHBondContact O-N 3.45Å; H434-N437 PolarHBondContact O-N 2.99Å; H434-N437 VanDerWaalsContact O-N 3.17Å; H434-Q438 PolarHBondContact O-N 3.02Å
435	E	63.3	Low	65.1	Low	25 Å²	25	68.7 Å²	68.7	12%	0.117	39%	0.389	C	S	.	.	H	α-helix	trans	-65.7	-25.2	177.2	-74.3	-160	173.6	0	0	113.4	T431 L432 P439 V600 G601	T431-E435 PolarHBondContact O-N 3.41Å; L432-E435 PolarHBondContact O-N 3.49Å; E435-P439 WeakPolarHBondContact O-CD 3.43Å; E435-P439 WeakPolarHBondContact O-CG 3.29Å; E435-V600 HydrophobicContact CG-CG1 4.31Å; E435-G601 PolarHBondContact OE1-N 2.88Å
436	I	67.1	Low	66.7	Low	55 Å²	55	70 Å²	70	28%	0.282	39%	0.39	S	S	.	.	H	α-helix	trans	-77.2	-37.1	173.1	-69.2	170	0	0	0	111.2	L432 H434 Q438 P439 L440 I479	L432-I436 WeakPolarHBondContact O-CG1 3.42Å; L432-I436 PolarHBondContact O-N 3.14Å; H434-I436 PolarHBondContact O-N 3.45Å; I436-Q438 PolarHBondContact O-N 3.38Å; I436-P439 VanDerWaalsContact O-CD 3.26Å; I436-P439 WeakPolarHBondContact O-CD 3.37Å; I436-P439 VanDerWaalsContact O-CG 3.28Å; I436-P439 WeakPolarHBondContact O-CG 3.36Å; I436-L440 HydrophobicContact CG2-CD1 3.94Å; I436-L440 PolarHBondContact O-N 2.86Å; I436-I479 HydrophobicContact CD1-CG2 4.44Å; I436-I479 HydrophobicContact CG1-CG2 4.13Å
437	N	69.6	Low	68	Low	83 Å²	83	71.6 Å²	71.6	44%	0.444	39%	0.385	S	S	.	.	H	α-helix	trans	-68.4	-31.8	-179	-78.3	-32.8	0	0	0	113.4	A433 H434 L440 N441	A433-N437 VanDerWaalsContact O-CG 3.28Å; A433-N437 PolarHBondContact O-N 3.34Å; A433-N437 PolarHBondContact O-ND2 2.88Å; H434-N437 PolarHBondContact O-N 2.99Å; H434-N437 VanDerWaalsContact O-N 3.17Å; N437-L440 WeakPolarHBondContact O-CB 2.98Å; N437-L440 PolarHBondContact O-N 3.32Å; N437-N441 PolarHBondContact O-N 2.73Å
438	Q	61.7	Low	69.4	Low	89 Å²	89	68.8 Å²	68.8	42%	0.416	37%	0.371	S	S	.	.	H	α-helix	trans	-61.5	-53.5	178.7	-70	179	7.2	0	0	114.5	H434 I436 L440 N441 A442	H434-Q438 PolarHBondContact O-N 3.02Å; I436-Q438 PolarHBondContact O-N 3.38Å; Q438-L440 VanDerWaalsContact C-N 3.26Å; Q438-L440 PolarHBondContact O-N 3.24Å; Q438-N441 PolarHBondContact O-N 3.04Å; Q438-A442 PolarHBondContact O-N 3.4Å; Q438-A442 VanDerWaalsContact O-N 3.13Å
439	P	72.4	Confident	70.8	Confident	9 Å²	9	69.9 Å²	69.9	6%	0.058	38%	0.377	C	S	.	.	H	α-helix	trans	-61.8	-35.4	174.6	21.6	-29.7	0	0	0	111.5	E435 I436 N441 A442 L443 V472 I476	E435-P439 WeakPolarHBondContact O-CD 3.43Å; E435-P439 WeakPolarHBondContact O-CG 3.29Å; I436-P439 VanDerWaalsContact O-CD 3.26Å; I436-P439 WeakPolarHBondContact O-CD 3.37Å; I436-P439 VanDerWaalsContact O-CG 3.28Å; I436-P439 WeakPolarHBondContact O-CG 3.36Å; P439-N441 VanDerWaalsContact C-N 3.3Å; P439-N441 PolarHBondContact O-N 3.43Å; P439-A442 PolarHBondContact O-N 2.93Å; P439-L443 WeakPolarHBondContact O-CB 3.45Å; P439-L443 PolarHBondContact O-N 3.21Å; P439-V472 HydrophobicContact CB-CG1 3.54Å; P439-V472 WeakPolarHBondContact O-CG1 3.41Å; P439-I476 HydrophobicContact CB-CD1 4.34Å; P439-I476 HydrophobicContact CB-CG1 4.06Å; P439-I476 HydrophobicContact CG-CD1 4.43Å; P439-I476 HydrophobicContact CG-CG1 3.94Å
440	L	73.7	Confident	72.2	Confident	74 Å²	74	65.4 Å²	65.4	39%	0.387	36%	0.356	S	S	.	.	H	α-helix	trans	-57.4	-39.9	174.1	-99.3	152.5	0	0	0	113.4	I436 N437 Q438 S444 I476	I436-L440 HydrophobicContact CG2-CD1 3.94Å; I436-L440 PolarHBondContact O-N 2.86Å; N437-L440 WeakPolarHBondContact O-CB 2.98Å; N437-L440 PolarHBondContact O-N 3.32Å; Q438-L440 VanDerWaalsContact C-N 3.26Å; Q438-L440 PolarHBondContact O-N 3.24Å; L440-S444 PolarHBondContact O-N 3.03Å; L440-S444 VanDerWaalsContact O-N 3.12Å; L440-S444 PolarHBondContact O-OG 3.35Å; L440-I476 HydrophobicContact CG-CD1 4.48Å
441	N	77	Confident	73.3	Confident	114 Å²	114	66.9 Å²	66.9	61%	0.61	35%	0.348	S	S	*	.	H	α-helix	trans	-70.5	-42.1	175.3	-71.4	-20.4	0	0	0	112.4	N437 Q438 P439 L443 S444 M445	N437-N441 PolarHBondContact O-N 2.73Å; Q438-N441 PolarHBondContact O-N 3.04Å; P439-N441 VanDerWaalsContact C-N 3.3Å; P439-N441 PolarHBondContact O-N 3.43Å; N441-L443 VanDerWaalsContact C-N 3.31Å; N441-L443 PolarHBondContact O-N 3.18Å; N441-S444 WeakPolarHBondContact O-CB 3.45Å; N441-S444 PolarHBondContact O-N 3.33Å; N441-S444 VanDerWaalsContact O-N 3.15Å; N441-M445 PolarHBondContact O-N 3.33Å
442	A	75.1	Confident	74.7	Confident	33 Å²	33	69.9 Å²	69.9	27%	0.273	35%	0.351	S	S	.	.	H	α-helix	trans	-61.7	-41.7	176.2	0	0	0	0	0	111.5	Q438 P439 S444 M445 Y446 V472	Q438-A442 PolarHBondContact O-N 3.4Å; Q438-A442 VanDerWaalsContact O-N 3.13Å; P439-A442 PolarHBondContact O-N 2.93Å; A442-S444 VanDerWaalsContact C-N 3.31Å; A442-S444 PolarHBondContact O-N 3.39Å; A442-M445 PolarHBondContact O-N 3.01Å; A442-Y446 HydrophobicContact CB-CE2 4.21Å; A442-Y446 WeakPolarHBondContact O-CD2 3.03Å; A442-Y446 PolarHBondContact O-N 3.49Å; A442-V472 HydrophobicContact CB-CG2 4.41Å
443	L	84.3	Confident	75.9	Confident	31 Å²	31	69.5 Å²	69.5	16%	0.162	35%	0.349	C	S	.	.	H	α-helix	trans	-55.6	-48.1	172.3	-179.1	61	0	0	0	110.6	P439 N441 M445 Y446 L447 A469 V472 I473	P439-L443 WeakPolarHBondContact O-CB 3.45Å; P439-L443 PolarHBondContact O-N 3.21Å; N441-L443 VanDerWaalsContact C-N 3.31Å; N441-L443 PolarHBondContact O-N 3.18Å; L443-M445 PolarHBondContact O-N 3.18Å; L443-Y446 PolarHBondContact O-N 2.83Å; L443-L447 HydrophobicContact CD1-CD1 4.25Å; L443-L447 HydrophobicContact CD1-CG 4.48Å; L443-L447 HydrophobicContact CG-CD1 4.14Å; L443-L447 WeakPolarHBondContact O-CB 3.27Å; L443-L447 VanDerWaalsContact O-CG 3.22Å; L443-L447 WeakPolarHBondContact O-CG 3.48Å; L443-L447 PolarHBondContact O-N 3.33Å; L443-A469 HydrophobicContact CD1-CB 3.63Å; L443-V472 HydrophobicContact CB-CG1 3.96Å; L443-I473 HydrophobicContact CD1-CG1 4.46Å; L443-I473 HydrophobicContact CD2-CG1 4.48Å
444	S	75.8	Confident	76.8	Confident	72 Å²	72	72.3 Å²	72.3	50%	0.503	36%	0.356	S	S	.	.	H	α-helix	trans	-61.1	-40.5	178	-60	0	0	0	0	112.8	L440 N441 A442 F448	L440-S444 PolarHBondContact O-N 3.03Å; L440-S444 VanDerWaalsContact O-N 3.12Å; L440-S444 PolarHBondContact O-OG 3.35Å; N441-S444 WeakPolarHBondContact O-CB 3.45Å; N441-S444 PolarHBondContact O-N 3.33Å; N441-S444 VanDerWaalsContact O-N 3.15Å; A442-S444 VanDerWaalsContact C-N 3.31Å; A442-S444 PolarHBondContact O-N 3.39Å; S444-F448 WeakPolarHBondContact O-CB 3.34Å; S444-F448 PolarHBondContact O-N 3.47Å
445	M	79	Confident	78.2	Confident	115 Å²	115	73.2 Å²	73.2	57%	0.567	36%	0.361	S	S	*	.	H	α-helix	trans	-68.8	-43.2	178.6	-174.1	64	68.8	0	0	112.8	N441 A442 L443 L447 F448 T449	N441-M445 PolarHBondContact O-N 3.33Å; A442-M445 PolarHBondContact O-N 3.01Å; L443-M445 PolarHBondContact O-N 3.18Å; M445-L447 VanDerWaalsContact C-N 3.33Å; M445-F448 PolarHBondContact O-N 3.38Å; M445-T449 WeakPolarHBondContact O-CB 3.36Å; M445-T449 PolarHBondContact O-N 3.39Å; M445-T449 PolarHBondContact O-OG1 3.29Å
446	Y	87.1	Confident	78.9	Confident	70 Å²	70	76.9 Å²	76.9	28%	0.275	38%	0.378	S	S	.	.	H	α-helix	trans	-63.3	-42.4	176.6	-66.4	-39.4	0	0	0	110.9	A442 L443 F448 T449 A450 M465 K468 V472	A442-Y446 HydrophobicContact CB-CE2 4.21Å; A442-Y446 WeakPolarHBondContact O-CD2 3.03Å; A442-Y446 PolarHBondContact O-N 3.49Å; L443-Y446 PolarHBondContact O-N 2.83Å; Y446-F448 PolarHBondContact O-N 3.36Å; Y446-T449 PolarHBondContact O-N 3.28Å; Y446-A450 VanDerWaalsContact O-CB 3.32Å; Y446-A450 WeakPolarHBondContact O-CB 3.35Å; Y446-A450 PolarHBondContact O-N 3.32Å; Y446-M465 HydrophobicContact CD1-SD 4.04Å; Y446-M465 WeakPolarHBondContact O-CB 3.34Å; Y446-K468 HydrophobicContact CD1-CB 3.9Å; Y446-K468 HydrophobicContact CD1-CD 3.87Å; Y446-K468 HydrophobicContact CD2-CB 3.65Å; Y446-K468 HydrophobicContact CE1-CB 4.01Å; Y446-K468 HydrophobicContact CE1-CD 3.49Å; Y446-K468 VanDerWaalsContact CE1-CD 3.49Å; Y446-K468 HydrophobicContact CE1-CG 4.36Å; Y446-K468 HydrophobicContact CE2-CB 3.73Å; Y446-K468 HydrophobicContact CG-CB 3.74Å; Y446-V472 HydrophobicContact CD2-CG2 4.06Å; Y446-V472 HydrophobicContact CE2-CG2 3.8Å
447	L	84.6	Confident	79.8	Confident	86 Å²	86	80.1 Å²	80.1	45%	0.45	40%	0.4	S	S	.	.	H	α-helix	trans	-61.7	-42.1	173.6	-67.9	172.1	0	0	0	112.2	L443 M445 R451 L466 A469	L443-L447 HydrophobicContact CD1-CD1 4.25Å; L443-L447 HydrophobicContact CD1-CG 4.48Å; L443-L447 HydrophobicContact CG-CD1 4.14Å; L443-L447 WeakPolarHBondContact O-CB 3.27Å; L443-L447 VanDerWaalsContact O-CG 3.22Å; L443-L447 WeakPolarHBondContact O-CG 3.48Å; L443-L447 PolarHBondContact O-N 3.33Å; M445-L447 VanDerWaalsContact C-N 3.33Å; L447-R451 PolarHBondContact O-N 2.98Å; L447-L466 HydrophobicContact CD2-CD2 4.31Å; L447-A469 HydrophobicContact CD2-CB 4.38Å
448	F	84.1	Confident	80.5	Confident	101 Å²	101	80 Å²	80	44%	0.443	40%	0.397	S	S	.	.	H	α-helix	trans	-63.9	-42.9	175.7	178.4	-92.2	0	0	0	112.8	S444 M445 Y446 R451 R452	S444-F448 WeakPolarHBondContact O-CB 3.34Å; S444-F448 PolarHBondContact O-N 3.47Å; M445-F448 PolarHBondContact O-N 3.38Å; Y446-F448 PolarHBondContact O-N 3.36Å; F448-R451 VanDerWaalsContact CD2-NH2 3.33Å; F448-R451 VanDerWaalsContact CE2-NH2 3.29Å; F448-R451 WeakPolarHBondContact O-CB 3.35Å; F448-R451 PolarHBondContact O-N 2.9Å; F448-R452 PolarHBondContact O-N 3.06Å
449	T	83.1	Confident	81.3	Confident	40 Å²	40	81 Å²	81	25%	0.245	41%	0.41	C	S	.	.	H	α-helix	trans	-70.6	-37.7	-179.5	-51.7	0	0	0	0	111.3	M445 Y446 R451 R452 A453 M465	M445-T449 WeakPolarHBondContact O-CB 3.36Å; M445-T449 PolarHBondContact O-N 3.39Å; M445-T449 PolarHBondContact O-OG1 3.29Å; Y446-T449 PolarHBondContact O-N 3.28Å; T449-R451 VanDerWaalsContact C-N 3.31Å; T449-R451 PolarHBondContact O-N 3.43Å; T449-R452 PolarHBondContact O-N 3.31Å; T449-A453 WeakPolarHBondContact O-CB 3.45Å; T449-A453 PolarHBondContact O-N 3.42Å; T449-M465 HydrophobicContact CG2-CG 3.71Å; T449-M465 HydrophobicContact CG2-SD 3.72Å
450	A	86.4	Confident	81.7	Confident	4 Å²	4	88.9 Å²	88.9	3%	0.033	45%	0.445	C	S	.	.	H	α-helix	trans	-57.1	-46.6	170.6	0	0	0	0	0	110.6	Y446 R452 A453 I454 M465 L466	Y446-A450 VanDerWaalsContact O-CB 3.32Å; Y446-A450 WeakPolarHBondContact O-CB 3.35Å; Y446-A450 PolarHBondContact O-N 3.32Å; A450-R452 PolarHBondContact O-N 3.37Å; A450-A453 PolarHBondContact O-N 3.44Å; A450-I454 VanDerWaalsContact O-CG1 3.25Å; A450-I454 WeakPolarHBondContact O-CG1 3.07Å; A450-I454 PolarHBondContact O-N 3.12Å; A450-M465 HydrophobicContact CB-CB 3.67Å; A450-L466 HydrophobicContact CB-CD2 4.33Å; A450-L466 HydrophobicContact CB-CG 4.21Å
451	R	80.7	Confident	81.8	Confident	145 Å²	145	89.5 Å²	89.5	55%	0.547	45%	0.446	S	S	.	.	H	α-helix	trans	-59.3	-45.6	177.5	-171.2	178.6	69.2	-173	1	112.4	L447 F448 T449 I454 E455	L447-R451 PolarHBondContact O-N 2.98Å; F448-R451 VanDerWaalsContact CD2-NH2 3.33Å; F448-R451 VanDerWaalsContact CE2-NH2 3.29Å; F448-R451 WeakPolarHBondContact O-CB 3.35Å; F448-R451 PolarHBondContact O-N 2.9Å; T449-R451 VanDerWaalsContact C-N 3.31Å; T449-R451 PolarHBondContact O-N 3.43Å; R451-I454 WeakPolarHBondContact O-CB 3.45Å; R451-I454 PolarHBondContact O-N 3.46Å; R451-E455 WeakPolarHBondContact O-CG 3.43Å; R451-E455 PolarHBondContact O-N 3.07Å
452	R	83.8	Confident	81.9	Confident	143 Å²	143	84.3 Å²	84.3	54%	0.54	42%	0.42	S	S	.	.	H	α-helix	trans	-66.6	-38.3	178.7	-163.4	-175.9	-168.2	-171.1	3.6	112.9	F448 T449 A450 I454 E455 Q456	F448-R452 PolarHBondContact O-N 3.06Å; T449-R452 PolarHBondContact O-N 3.31Å; A450-R452 PolarHBondContact O-N 3.37Å; R452-I454 VanDerWaalsContact C-N 3.3Å; R452-I454 PolarHBondContact O-N 2.81Å; R452-E455 WeakPolarHBondContact O-CB 3.24Å; R452-E455 PolarHBondContact O-N 3.46Å; R452-Q456 WeakPolarHBondContact O-CG 3.43Å; R452-Q456 PolarHBondContact O-N 2.95Å
453	A	85.3	Confident	82.3	Confident	3 Å²	3	86.8 Å²	86.8	3%	0.025	44%	0.435	C	S	.	.	H	α-helix	trans	-64.1	-37	175.3	0	0	0	0	0	111.5	T449 A450 Q456 T457 Q458 Q461 A462	T449-A453 WeakPolarHBondContact O-CB 3.45Å; T449-A453 PolarHBondContact O-N 3.42Å; A450-A453 PolarHBondContact O-N 3.44Å; A453-Q456 PolarHBondContact O-N 3.14Å; A453-T457 PolarHBondContact O-N 3Å; A453-Q458 HydrophobicContact CB-CB 4.33Å; A453-Q458 WeakPolarHBondContact O-CA 3.38Å; A453-Q458 PolarHBondContact O-N 3.46Å; A453-Q461 HydrophobicContact CB-CB 3.95Å; A453-Q461 HydrophobicContact CB-CG 4.07Å; A453-A462 HydrophobicContact CB-CB 4Å
454	I	82.5	Confident	82.2	Confident	110 Å²	110	90.5 Å²	90.5	56%	0.564	45%	0.453	S	S	*	.	H	α-helix	trans	-62.1	-46.1	171.4	-65.7	163.5	0	0	0	110.6	A450 R451 R452 Q456 T457 A462	A450-I454 VanDerWaalsContact O-CG1 3.25Å; A450-I454 WeakPolarHBondContact O-CG1 3.07Å; A450-I454 PolarHBondContact O-N 3.12Å; R451-I454 WeakPolarHBondContact O-CB 3.45Å; R451-I454 PolarHBondContact O-N 3.46Å; R452-I454 VanDerWaalsContact C-N 3.3Å; R452-I454 PolarHBondContact O-N 2.81Å; I454-Q456 VanDerWaalsContact C-N 3.29Å; I454-Q456 PolarHBondContact O-N 2.83Å; I454-T457 PolarHBondContact O-N 3.08Å; I454-T457 VanDerWaalsContact O-N 3.13Å; I454-A462 HydrophobicContact CD1-CB 4.32Å; I454-A462 HydrophobicContact CG1-CB 3.62Å
455	E	84.8	Confident	82.6	Confident	136 Å²	136	87.8 Å²	87.8	64%	0.636	43%	0.432	S	S	*	.	H	α-helix	trans	-61.1	-33.3	177.8	-70.6	166.8	-174.3	0	0	113.2	R451 R452 T457	R451-E455 WeakPolarHBondContact O-CG 3.43Å; R451-E455 PolarHBondContact O-N 3.07Å; R452-E455 WeakPolarHBondContact O-CB 3.24Å; R452-E455 PolarHBondContact O-N 3.46Å; E455-T457 VanDerWaalsContact C-N 3.3Å
456	Q	79.9	Confident	82.9	Confident	101 Å²	101	86.4 Å²	86.4	47%	0.472	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	7.3	178.7	-66.8	-178.6	-5.6	0	0	113.6	R452 A453 I454 Q458	R452-Q456 WeakPolarHBondContact O-CG 3.43Å; R452-Q456 PolarHBondContact O-N 2.95Å; A453-Q456 PolarHBondContact O-N 3.14Å; I454-Q456 VanDerWaalsContact C-N 3.29Å; I454-Q456 PolarHBondContact O-N 2.83Å; Q456-Q458 HydrophobicContact CB-CG 4.07Å; Q456-Q458 PolarHBondContact O-N 3.41Å
457	T	84.2	Confident	82.6	Confident	124 Å²	124	85 Å²	85	76%	0.761	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.5	30.9	-176.4	-39.6	0	0	0	0	112.7	A453 I454 E455	A453-T457 PolarHBondContact O-N 3Å; I454-T457 PolarHBondContact O-N 3.08Å; I454-T457 VanDerWaalsContact O-N 3.13Å; E455-T457 VanDerWaalsContact C-N 3.3Å
458	Q	84.6	Confident	82.4	Confident	79 Å²	79	85.2 Å²	85.2	37%	0.369	43%	0.431	S	S	.	.			trans	-100.4	69.9	177.2	-66	175.4	-23.5	0	0	110.8	A453 Q456 E460 Q461 A462	A453-Q458 HydrophobicContact CB-CB 4.33Å; A453-Q458 WeakPolarHBondContact O-CA 3.38Å; A453-Q458 PolarHBondContact O-N 3.46Å; Q456-Q458 HydrophobicContact CB-CG 4.07Å; Q456-Q458 PolarHBondContact O-N 3.41Å; Q458-E460 VanDerWaalsContact C-N 3.33Å; Q458-E460 PolarHBondContact O-N 3.24Å; Q458-Q461 HydrophobicContact CB-CB 4.2Å; Q458-Q461 PolarHBondContact O-N 3.43Å; Q458-A462 PolarHBondContact O-N 3.32Å
459	T	79.9	Confident	82.2	Confident	111 Å²	111	80.8 Å²	80.8	68%	0.681	41%	0.413	S	S	*	.	H	α-helix	trans	-57.3	-39.6	-172.6	-48.1	0	0	0	0	114.1	Q461 A462 S463	T459-Q461 VanDerWaalsContact C-N 3.32Å; T459-Q461 PolarHBondContact O-N 3.44Å; T459-A462 WeakPolarHBondContact O-CB 3.33Å; T459-A462 PolarHBondContact O-N 2.87Å; T459-S463 PolarHBondContact O-N 3.28Å; T459-S463 VanDerWaalsContact O-N 3.08Å
460	E	80.8	Confident	82.1	Confident	174 Å²	174	85.8 Å²	85.8	81%	0.813	43%	0.433	S	S	*	.	H	α-helix	trans	-63.9	-40.1	-178.2	-151.8	178.9	-158.9	0	0	111.5	Q458 S463 M464	Q458-E460 VanDerWaalsContact C-N 3.33Å; Q458-E460 PolarHBondContact O-N 3.24Å; E460-S463 PolarHBondContact O-N 2.76Å; E460-M464 PolarHBondContact O-N 2.91Å; E460-M464 VanDerWaalsContact O-N 3.1Å
461	Q	73.9	Confident	81.5	Confident	87 Å²	87	88.2 Å²	88.2	41%	0.407	46%	0.458	S	S	.	.	H	α-helix	trans	-69.6	-35.1	177.3	-168.9	156.3	8.8	0	0	111.8	A453 Q458 T459 M464 M465	A453-Q461 HydrophobicContact CB-CB 3.95Å; A453-Q461 HydrophobicContact CB-CG 4.07Å; Q458-Q461 HydrophobicContact CB-CB 4.2Å; Q458-Q461 PolarHBondContact O-N 3.43Å; T459-Q461 VanDerWaalsContact C-N 3.32Å; T459-Q461 PolarHBondContact O-N 3.44Å; Q461-M464 PolarHBondContact O-N 2.74Å; Q461-M465 WeakPolarHBondContact O-CG 3.17Å; Q461-M465 PolarHBondContact O-N 3.47Å; Q461-M465 VanDerWaalsContact O-N 3.12Å
462	A	80.4	Confident	81.4	Confident	6 Å²	6	82 Å²	82	5%	0.05	44%	0.437	C	S	.	.	H	α-helix	trans	-63	-47.6	173.8	0	0	0	0	0	112.3	A453 I454 Q458 T459 M464 M465 L466	A453-A462 HydrophobicContact CB-CB 4Å; I454-A462 HydrophobicContact CD1-CB 4.32Å; I454-A462 HydrophobicContact CG1-CB 3.62Å; Q458-A462 PolarHBondContact O-N 3.32Å; T459-A462 WeakPolarHBondContact O-CB 3.33Å; T459-A462 PolarHBondContact O-N 2.87Å; A462-M464 VanDerWaalsContact C-N 3.31Å; A462-M464 PolarHBondContact O-N 2.89Å; A462-M465 PolarHBondContact O-N 3.32Å; A462-L466 PolarHBondContact O-N 3.12Å
463	S	83.2	Confident	81.1	Confident	84 Å²	84	80 Å²	80	59%	0.587	44%	0.436	S	S	*	.	H	α-helix	trans	-61.2	-40.5	177.9	-167.4	0	0	0	0	111.9	T459 E460 M465 L466 G467	T459-S463 PolarHBondContact O-N 3.28Å; T459-S463 VanDerWaalsContact O-N 3.08Å; E460-S463 PolarHBondContact O-N 2.76Å; S463-M465 VanDerWaalsContact C-N 3.34Å; S463-M465 PolarHBondContact O-N 3.09Å; S463-L466 PolarHBondContact O-N 3.4Å; S463-G467 PolarHBondContact O-N 3.38Å
464	M	83.3	Confident	80.4	Confident	110 Å²	110	82.3 Å²	82.3	54%	0.542	46%	0.459	S	S	.	.	H	α-helix	trans	-61.1	-41.9	176.1	-173.1	-168.7	-63.1	0	0	111.9	E460 Q461 A462 K468	E460-M464 PolarHBondContact O-N 2.91Å; E460-M464 VanDerWaalsContact O-N 3.1Å; Q461-M464 PolarHBondContact O-N 2.74Å; A462-M464 VanDerWaalsContact C-N 3.31Å; A462-M464 PolarHBondContact O-N 2.89Å; M464-K468 WeakPolarHBondContact O-CG 3.46Å; M464-K468 PolarHBondContact O-N 2.68Å
465	M	83.4	Confident	79.6	Confident	14 Å²	14	83.5 Å²	83.5	7%	0.069	46%	0.457	C	S	.	.	H	α-helix	trans	-69	-36.6	178.5	-67.6	-54.7	114.1	0	0	112.6	Y446 T449 A450 Q461 A462 S463 K468 A469	Y446-M465 HydrophobicContact CD1-SD 4.04Å; Y446-M465 WeakPolarHBondContact O-CB 3.34Å; T449-M465 HydrophobicContact CG2-CG 3.71Å; T449-M465 HydrophobicContact CG2-SD 3.72Å; A450-M465 HydrophobicContact CB-CB 3.67Å; Q461-M465 WeakPolarHBondContact O-CG 3.17Å; Q461-M465 PolarHBondContact O-N 3.47Å; Q461-M465 VanDerWaalsContact O-N 3.12Å; A462-M465 PolarHBondContact O-N 3.32Å; S463-M465 VanDerWaalsContact C-N 3.34Å; S463-M465 PolarHBondContact O-N 3.09Å; M465-K468 HydrophobicContact CE-CD 4.19Å; M465-K468 WeakPolarHBondContact O-CB 3.43Å; M465-K468 PolarHBondContact O-N 3.42Å; M465-K468 HydrophobicContact SD-CD 4.3Å; M465-A469 PolarHBondContact O-N 3.28Å; M465-A469 VanDerWaalsContact O-N 3.13Å
466	L	84.2	Confident	78.9	Confident	86 Å²	86	78.8 Å²	78.8	45%	0.45	44%	0.436	S	S	.	.	H	α-helix	trans	-65.4	-42.1	174.5	-71.4	171.3	0	0	0	112.2	L447 A450 A462 S463 K468 A469 E470	L447-L466 HydrophobicContact CD2-CD2 4.31Å; A450-L466 HydrophobicContact CB-CD2 4.33Å; A450-L466 HydrophobicContact CB-CG 4.21Å; A462-L466 PolarHBondContact O-N 3.12Å; S463-L466 PolarHBondContact O-N 3.4Å; L466-K468 PolarHBondContact O-N 3.2Å; L466-A469 VanDerWaalsContact O-CB 3.32Å; L466-A469 WeakPolarHBondContact O-CB 3.39Å; L466-A469 PolarHBondContact O-N 3.02Å; L466-E470 PolarHBondContact O-N 3.47Å
467	G	81.4	Confident	78.4	Confident	41 Å²	41	77.4 Å²	77.4	42%	0.423	43%	0.432	S	S	.	.	H	α-helix	trans	-60.7	-34.2	173.6	0	0	0	0	0	112.9	S463 G471	S463-G467 PolarHBondContact O-N 3.38Å; G467-G471 PolarHBondContact O-N 3.09Å
468	K	80.4	Confident	77.3	Confident	91 Å²	91	74 Å²	74	40%	0.396	42%	0.415	S	S	.	.	H	α-helix	trans	-66.4	-34.9	172.3	-69.7	-177.7	-176.1	-175.6	0	112.6	Y446 M464 M465 L466 V472	Y446-K468 HydrophobicContact CD1-CB 3.9Å; Y446-K468 HydrophobicContact CD1-CD 3.87Å; Y446-K468 HydrophobicContact CD2-CB 3.65Å; Y446-K468 HydrophobicContact CE1-CB 4.01Å; Y446-K468 HydrophobicContact CE1-CD 3.49Å; Y446-K468 VanDerWaalsContact CE1-CD 3.49Å; Y446-K468 HydrophobicContact CE1-CG 4.36Å; Y446-K468 HydrophobicContact CE2-CB 3.73Å; Y446-K468 HydrophobicContact CG-CB 3.74Å; M464-K468 WeakPolarHBondContact O-CG 3.46Å; M464-K468 PolarHBondContact O-N 2.68Å; M465-K468 HydrophobicContact CE-CD 4.19Å; M465-K468 WeakPolarHBondContact O-CB 3.43Å; M465-K468 PolarHBondContact O-N 3.42Å; M465-K468 HydrophobicContact SD-CD 4.3Å; L466-K468 PolarHBondContact O-N 3.2Å; K468-V472 WeakPolarHBondContact O-CG2 3.27Å; K468-V472 PolarHBondContact O-N 3.21Å
469	A	81.3	Confident	76.2	Confident	7 Å²	7	71.6 Å²	71.6	6%	0.058	41%	0.405	C	S	.	.	H	α-helix	trans	-65.1	-43	177.3	0	0	0	0	0	112.6	L443 L447 M465 L466 G471 V472 I473	L443-A469 HydrophobicContact CD1-CB 3.63Å; L447-A469 HydrophobicContact CD2-CB 4.38Å; M465-A469 PolarHBondContact O-N 3.28Å; M465-A469 VanDerWaalsContact O-N 3.13Å; L466-A469 VanDerWaalsContact O-CB 3.32Å; L466-A469 WeakPolarHBondContact O-CB 3.39Å; L466-A469 PolarHBondContact O-N 3.02Å; A469-G471 VanDerWaalsContact C-N 3.34Å; A469-G471 PolarHBondContact O-N 2.73Å; A469-V472 WeakPolarHBondContact O-CB 3.42Å; A469-V472 PolarHBondContact O-N 2.74Å; A469-I473 PolarHBondContact O-N 3.02Å
470	E	79.2	Confident	75.5	Confident	146 Å²	146	70.3 Å²	70.3	68%	0.682	39%	0.393	S	S	*	.	H	α-helix	trans	-61.6	-40.8	177.1	-69.6	-178.8	155.7	0	0	112.4	L466 V472 I473 G474	L466-E470 PolarHBondContact O-N 3.47Å; E470-V472 PolarHBondContact O-N 3.37Å; E470-I473 PolarHBondContact O-N 3.06Å; E470-G474 PolarHBondContact O-N 3.38Å
471	G	75.5	Confident	74.7	Confident	54 Å²	54	70 Å²	70	56%	0.557	38%	0.384	S	S	*	.	H	α-helix	trans	-60	-32.9	175.8	0	0	0	0	0	113.5	G467 A469	G467-G471 PolarHBondContact O-N 3.09Å; A469-G471 VanDerWaalsContact C-N 3.34Å; A469-G471 PolarHBondContact O-N 2.73Å
472	V	77	Confident	73.8	Confident	16 Å²	16	68.8 Å²	68.8	10%	0.097	39%	0.386	C	S	.	.	H	α-helix	trans	-71.2	-36	177.8	174.6	0	0	0	0	112	P439 A442 L443 Y446 K468 A469 E470 R475 I476	P439-V472 HydrophobicContact CB-CG1 3.54Å; P439-V472 WeakPolarHBondContact O-CG1 3.41Å; A442-V472 HydrophobicContact CB-CG2 4.41Å; L443-V472 HydrophobicContact CB-CG1 3.96Å; Y446-V472 HydrophobicContact CD2-CG2 4.06Å; Y446-V472 HydrophobicContact CE2-CG2 3.8Å; K468-V472 WeakPolarHBondContact O-CG2 3.27Å; K468-V472 PolarHBondContact O-N 3.21Å; A469-V472 WeakPolarHBondContact O-CB 3.42Å; A469-V472 PolarHBondContact O-N 2.74Å; E470-V472 PolarHBondContact O-N 3.37Å; V472-R475 WeakPolarHBondContact O-CB 3.43Å; V472-R475 PolarHBondContact O-N 2.77Å; V472-I476 PolarHBondContact O-N 3.49Å
473	I	77.8	Confident	72.9	Confident	101 Å²	101	71.8 Å²	71.8	52%	0.518	40%	0.401	S	S	.	.	H	α-helix	trans	-63.9	-44.8	178.1	-66.8	171.9	0	0	0	111	L443 A469 E470 R475 I476 D477	L443-I473 HydrophobicContact CD1-CG1 4.46Å; L443-I473 HydrophobicContact CD2-CG1 4.48Å; A469-I473 PolarHBondContact O-N 3.02Å; E470-I473 PolarHBondContact O-N 3.06Å; I473-R475 PolarHBondContact O-N 3.42Å; I473-I476 PolarHBondContact O-N 3.4Å; I473-I476 VanDerWaalsContact O-N 3.08Å; I473-D477 PolarHBondContact O-N 3.17Å
474	G	70.2	Confident	71.8	Confident	50 Å²	50	77.2 Å²	77.2	52%	0.515	41%	0.408	S	S	.	.	H	α-helix	trans	-59.5	-29.1	176.4	0	0	0	0	0	113.5	E470 A478	E470-G474 PolarHBondContact O-N 3.38Å; G474-A478 PolarHBondContact O-N 3.49Å
475	R	66.9	Low	70.7	Confident	135 Å²	135	76.7 Å²	76.7	51%	0.509	40%	0.404	S	S	.	.	H	α-helix	trans	-70.7	-36.3	176	-166.9	173.5	174.6	178	-1.7	112.4	V472 I473 I479	V472-R475 WeakPolarHBondContact O-CB 3.43Å; V472-R475 PolarHBondContact O-N 2.77Å; I473-R475 PolarHBondContact O-N 3.42Å; R475-I479 WeakPolarHBondContact O-CG1 3.48Å; R475-I479 PolarHBondContact O-N 2.96Å
476	I	70.8	Confident	69.3	Low	38 Å²	38	78.8 Å²	78.8	20%	0.195	41%	0.413	C	S	.	.	H	α-helix	trans	-67.3	-43.6	178.7	-66.5	173.3	0	0	0	111.1	P439 L440 V472 I473 A478 I479 I480	P439-I476 HydrophobicContact CB-CD1 4.34Å; P439-I476 HydrophobicContact CB-CG1 4.06Å; P439-I476 HydrophobicContact CG-CD1 4.43Å; P439-I476 HydrophobicContact CG-CG1 3.94Å; L440-I476 HydrophobicContact CG-CD1 4.48Å; V472-I476 PolarHBondContact O-N 3.49Å; I473-I476 PolarHBondContact O-N 3.4Å; I473-I476 VanDerWaalsContact O-N 3.08Å; I476-A478 VanDerWaalsContact C-N 3.33Å; I476-A478 PolarHBondContact O-N 2.94Å; I476-I479 WeakPolarHBondContact O-CB 3.38Å; I476-I479 PolarHBondContact O-N 3.26Å; I476-I480 HydrophobicContact CG2-CD1 4.37Å; I476-I480 PolarHBondContact O-N 3.19Å
477	D	67.7	Low	67.9	Low	72 Å²	72	79.7 Å²	79.7	39%	0.385	42%	0.423	S	S	.	.	H	α-helix	trans	-65.2	-35.8	-178.5	-170.2	40.6	0	0	0	112.6	I473 I479 I480 R481	I473-D477 PolarHBondContact O-N 3.17Å; D477-I479 VanDerWaalsContact C-N 3.32Å; D477-I479 PolarHBondContact O-N 2.9Å; D477-I480 PolarHBondContact O-N 3.5Å; D477-R481 PolarHBondContact O-N 3.07Å; D477-R481 IonicContact OD2-CZ 3.72Å; D477-R481 IonicContact OD2-NE 3.97Å; D477-R481 PolarHBondContact OD2-NE 2.88Å; D477-R481 IonicContact OD2-NH2 2.69Å; D477-R481 PolarHBondContact OD2-NH2 3.32Å
478	A	61.5	Low	66.5	Low	51 Å²	51	88.9 Å²	88.9	42%	0.421	44%	0.444	S	S	.	.	H	α-helix	trans	-61.6	-37.8	174.2	0	0	0	0	0	112.9	G474 I476 I480 S482	G474-A478 PolarHBondContact O-N 3.49Å; I476-A478 VanDerWaalsContact C-N 3.33Å; I476-A478 PolarHBondContact O-N 2.94Å; A478-I480 VanDerWaalsContact C-N 3.35Å; A478-S482 PolarHBondContact O-N 2.79Å
479	I	62.2	Low	65	Low	29 Å²	29	95 Å²	95	15%	0.149	47%	0.465	C	S	.	.	H	α-helix	trans	-63.6	-41.8	177.8	-65.6	167.2	0	0	0	110.5	L432 I436 R475 I476 D477 L483	L432-I479 HydrophobicContact CD2-CG2 4.26Å; I436-I479 HydrophobicContact CD1-CG2 4.44Å; I436-I479 HydrophobicContact CG1-CG2 4.13Å; R475-I479 WeakPolarHBondContact O-CG1 3.48Å; R475-I479 PolarHBondContact O-N 2.96Å; I476-I479 WeakPolarHBondContact O-CB 3.38Å; I476-I479 PolarHBondContact O-N 3.26Å; D477-I479 VanDerWaalsContact C-N 3.32Å; D477-I479 PolarHBondContact O-N 2.9Å; I479-L483 PolarHBondContact O-N 3.26Å
480	I	65.6	Low	63.5	Low	85 Å²	85	96.9 Å²	96.9	44%	0.436	48%	0.481	S	S	.	.	H	α-helix	trans	-69.1	-41.1	-176.6	-65	173.5	0	0	0	112.3	I476 D477 A478 S482 L483 R484	I476-I480 HydrophobicContact CG2-CD1 4.37Å; I476-I480 PolarHBondContact O-N 3.19Å; D477-I480 PolarHBondContact O-N 3.5Å; A478-I480 VanDerWaalsContact C-N 3.35Å; I480-S482 VanDerWaalsContact C-N 3.34Å; I480-S482 PolarHBondContact O-N 3.29Å; I480-L483 WeakPolarHBondContact O-CB 3.5Å; I480-L483 PolarHBondContact O-N 2.96Å; I480-R484 PolarHBondContact O-N 3.46Å
481	R	62.4	Low	62.2	Low	166 Å²	166	98.2 Å²	98.2	63%	0.626	49%	0.487	S	S	*	.	H	α-helix	trans	-64.1	-40	179.8	-66.5	-173	-138.9	163.7	2.5	112.5	D477 L483 R484 Q485	D477-R481 PolarHBondContact O-N 3.07Å; D477-R481 IonicContact OD2-CZ 3.72Å; D477-R481 IonicContact OD2-NE 3.97Å; D477-R481 PolarHBondContact OD2-NE 2.88Å; D477-R481 IonicContact OD2-NH2 2.69Å; D477-R481 PolarHBondContact OD2-NH2 3.32Å; R481-L483 PolarHBondContact O-N 2.67Å; R481-R484 PolarHBondContact O-N 3.33Å; R481-Q485 PolarHBondContact O-N 3.26Å
482	S	55.5	Low	61	Low	62 Å²	62	104.2 Å²	104.2	43%	0.434	51%	0.505	S	S	.	.	H	α-helix	trans	-57.2	-38.5	175.9	-173	0	0	0	0	111.9	A478 I480	A478-S482 PolarHBondContact O-N 2.79Å; I480-S482 VanDerWaalsContact C-N 3.34Å; I480-S482 PolarHBondContact O-N 3.29Å
483	L	61	Low	59.9	Low	70 Å²	70	112.3 Å²	112.3	37%	0.366	54%	0.542	S	S	.	.	H	α-helix	trans	-66	-42	179.3	-169.4	67.6	0	0	0	113.2	L432 I479 I480 R481 Q485 F486	L432-L483 HydrophobicContact CD1-CD1 3.72Å; I479-L483 PolarHBondContact O-N 3.26Å; I480-L483 WeakPolarHBondContact O-CB 3.5Å; I480-L483 PolarHBondContact O-N 2.96Å; R481-L483 PolarHBondContact O-N 2.67Å; L483-Q485 VanDerWaalsContact C-N 3.34Å; L483-Q485 PolarHBondContact O-N 3Å; L483-F486 PolarHBondContact O-N 3.36Å
484	R	61.7	Low	58.9	Low	198 Å²	198	111.7 Å²	111.7	75%	0.747	54%	0.543	S	S	*	.	H	α-helix	trans	-66.1	-36.4	-178.8	-73.6	-179.9	85.3	-176.9	6.5	112.3	I480 R481 F486 T487	I480-R484 PolarHBondContact O-N 3.46Å; R481-R484 PolarHBondContact O-N 3.33Å; R484-F486 PolarHBondContact O-N 3.29Å; R484-T487 PolarHBondContact O-N 3.42Å; R484-T487 PolarHBondContact O-OG1 3.46Å; R484-T487 VanDerWaalsContact O-OG1 3.04Å
485	Q	59.5	Low	58.6	Low	98 Å²	98	113.2 Å²	113.2	46%	0.458	55%	0.546	S	S	.	.	H	α-helix	trans	-68.3	-23.2	-179.1	-162.6	165.3	21.2	0	0	112.9	R481 L483 T487 Q541	R481-Q485 PolarHBondContact O-N 3.26Å; L483-Q485 VanDerWaalsContact C-N 3.34Å; L483-Q485 PolarHBondContact O-N 3Å; Q485-T487 VanDerWaalsContact C-N 3.31Å; Q485-T487 PolarHBondContact O-N 3.16Å; Q485-Q541 VanDerWaalsContact CD-NE2 3.32Å; Q485-Q541 VanDerWaalsContact NE2-NE2 3.13Å
486	F	53.5	Low	59.2	Low	59 Å²	59	108.8 Å²	108.8	26%	0.259	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-10.6	-179.2	-162.4	-119.9	0	0	0	114.7	V424 V425 L483 R484 I604 I608	V424-F486 HydrophobicContact CG1-CE1 4.3Å; V424-F486 HydrophobicContact CG1-CZ 4.11Å; V425-F486 HydrophobicContact CG2-CD1 3.97Å; V425-F486 HydrophobicContact CG2-CE1 3.68Å; L483-F486 PolarHBondContact O-N 3.36Å; R484-F486 PolarHBondContact O-N 3.29Å; F486-I604 HydrophobicContact CD2-CG2 3.57Å; F486-I604 HydrophobicContact CE1-CD1 4.48Å; F486-I604 HydrophobicContact CE2-CB 4.47Å; F486-I604 HydrophobicContact CE2-CG2 3.05Å; F486-I604 HydrophobicContact CZ-CD1 4.43Å; F486-I604 HydrophobicContact CZ-CG2 3.61Å; F486-I608 HydrophobicContact CD2-CD1 3.78Å; F486-I608 HydrophobicContact CD2-CG1 4.05Å; F486-I608 HydrophobicContact CE2-CD1 4.29Å; F486-I608 HydrophobicContact CE2-CG1 4.15Å
487	T	55.6	Low	59.8	Low	105 Å²	105	112.9 Å²	112.9	64%	0.644	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.9	0.4	-170.1	56.8	0	0	0	0	115.6	R484 Q485	R484-T487 PolarHBondContact O-N 3.42Å; R484-T487 PolarHBondContact O-OG1 3.46Å; R484-T487 VanDerWaalsContact O-OG1 3.04Å; Q485-T487 VanDerWaalsContact C-N 3.31Å; Q485-T487 PolarHBondContact O-N 3.16Å
488	R	50.8	Low	60.6	Low	233 Å²	233	112.3 Å²	112.3	88%	0.879	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-95.1	132	-172.7	-156.4	175	-177.4	-167.9	-1	113.3
489	R	48.4	Very low	61.8	Low	219 Å²	219	109.9 Å²	109.9	83%	0.826	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-80.7	133.2	175.2	-157.4	178.6	-171	-179.4	3.2	110
490	A	51	Low	63.1	Low	48 Å²	48	111.2 Å²	111.2	40%	0.397	54%	0.543	S	S	.	.	P	Polyproline II helix	trans	-93.9	129.6	172.7	0	0	0	0	0	110.1
491	E	51.7	Low	64.3	Low	173 Å²	173	107.1 Å²	107.1	81%	0.808	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-72	135.6	173.1	-76.1	170	166.7	0	0	110.3	E493	E491-E493 VanDerWaalsContact C-N 3.29Å; E491-E493 PolarHBondContact O-N 3.4Å
492	L	50.3	Low	65.6	Low	180 Å²	180	100.7 Å²	100.7	94%	0.942	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	9.8	-162.8	-84.5	150.5	0	0	0	115.7
493	E	53	Low	67.1	Low	187 Å²	187	103.3 Å²	103.3	87%	0.874	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.1	13.4	-171.3	-68.3	-168.8	161.2	0	0	115.9	E491 S495	E491-E493 VanDerWaalsContact C-N 3.29Å; E491-E493 PolarHBondContact O-N 3.4Å; E493-S495 PolarHBondContact O-N 3.5Å
494	T	57.6	Low	68.5	Low	87 Å²	87	100.6 Å²	100.6	53%	0.534	50%	0.495	S	S	.	.			trans	-71.9	115.8	174.7	-34.4	0	0	0	0	110.8
495	S	64.5	Low	69.9	Low	82 Å²	82	91.1 Å²	91.1	57%	0.573	46%	0.459	S	S	*	.			trans	-60.9	139	174.8	-57	0	0	0	0	111.2	E493 H497	E493-S495 PolarHBondContact O-N 3.5Å; S495-H497 PolarHBondContact O-CD2 2.93Å; S495-H497 PolarHBondContact O-NE2 3.38Å
496	L	78.8	Confident	71.3	Confident	43 Å²	43	89.9 Å²	89.9	23%	0.225	46%	0.461	C	S	.	.			trans	-79.9	133.1	175.4	-59.4	172	0	0	0	109.1	S533 M616 K617	L496-S533 VanDerWaalsContact CB-OG 3.28Å; L496-S533 WeakPolarHBondContact CB-OG 3.24Å; L496-M616 HydrophobicContact CD2-CB 4.26Å; L496-M616 HydrophobicContact CD2-CG 4.19Å; L496-K617 HydrophobicContact CD1-CB 4.47Å; L496-K617 HydrophobicContact CD1-CD 4.03Å; L496-K617 HydrophobicContact CD1-CG 4.09Å
497	H	82.6	Confident	72.7	Confident	124 Å²	124	88.7 Å²	88.7	57%	0.574	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.9	171.5	-177.9	-59.9	-69.2	0	0	0	111.1	S495 V499 S533 G534	S495-H497 PolarHBondContact O-CD2 2.93Å; S495-H497 PolarHBondContact O-NE2 3.38Å; H497-V499 PolarHBondContact O-N 2.75Å; H497-S533 CarbonylContact O-C 3.6Å; H497-S533 WeakPolarHBondContact O-CA 3.42Å; H497-G534 PolarHBondContact N-O 2.84Å; H497-G534 PolarHBondContact O-N 2.84Å
498	A	86.2	Confident	74.2	Confident	59 Å²	59	83.7 Å²	83.7	49%	0.488	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	117.6	175.9	0	0	0	0	0	110.5	T531 T639	A498-T531 HydrophobicContact CB-CG2 3.75Å; A498-T639 HydrophobicContact CB-CG2 4.46Å
499	V	86.9	Confident	76.1	Confident	1 Å²	1	74.3 Å²	74.3	1%	0.006	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	126	179.8	178.2	0	0	0	0	109.9	H497 L501 M504 T531 V532 E536 T539	H497-V499 PolarHBondContact O-N 2.75Å; V499-L501 PolarHBondContact O-N 3.19Å; V499-M504 HydrophobicContact CG1-CG 3.52Å; V499-M504 HydrophobicContact CG1-SD 4.32Å; V499-T531 WeakPolarHBondContact O-CA 3.48Å; V499-T531 WeakPolarHBondContact O-CG2 3.3Å; V499-V532 HydrophobicContact CB-CG2 4.25Å; V499-V532 PolarHBondContact N-O 2.69Å; V499-V532 PolarHBondContact O-N 3.49Å; V499-V532 VanDerWaalsContact O-N 3.07Å; V499-E536 HydrophobicContact CG1-CG 4.42Å; V499-E536 HydrophobicContact CG2-CG 4.11Å; V499-T539 HydrophobicContact CG1-CG2 4.38Å
500	D	89.4	Confident	77.7	Confident	56 Å²	56	69.2 Å²	69.2	30%	0.299	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	112.7	173.3	-175.9	-16.6	0	0	0	110.6	A502 Q503 M504	D500-A502 PolarHBondContact O-N 3.29Å; D500-A502 WeakPolarHBondContact OD1-CB 3.42Å; D500-A502 PolarHBondContact OD1-N 2.81Å; D500-Q503 HydrophobicContact CB-CB 4.25Å; D500-M504 WeakPolarHBondContact O-CG 3.26Å; D500-M504 PolarHBondContact O-N 3.09Å
501	L	90.5	Very high	79	Confident	0 Å²	0	72.4 Å²	72.4	0%	0	39%	0.392	C	S	.	.	H	α-helix	trans	-66.3	-35.2	-177.9	-67.7	171.5	0	0	0	113.2	V499 Q503 M504 F505 A530 V532 T539 W564 L571 I573	V499-L501 PolarHBondContact O-N 3.19Å; L501-Q503 VanDerWaalsContact C-N 3.35Å; L501-Q503 PolarHBondContact O-N 3.05Å; L501-M504 PolarHBondContact O-N 3.45Å; L501-F505 VanDerWaalsContact O-CD2 3.26Å; L501-F505 WeakPolarHBondContact O-CD2 3.32Å; L501-F505 PolarHBondContact O-N 3.04Å; L501-A530 WeakPolarHBondContact CB-O 3.49Å; L501-A530 HydrophobicContact CD1-CB 3.87Å; L501-A530 WeakPolarHBondContact CG-O 3.32Å; L501-A530 PolarHBondContact N-O 2.82Å; L501-A530 VanDerWaalsContact N-O 3.07Å; L501-V532 HydrophobicContact CD1-CG1 3.75Å; L501-V532 HydrophobicContact CD1-CG2 4.46Å; L501-V532 HydrophobicContact CD2-CG2 3.79Å; L501-V532 HydrophobicContact CG-CG1 4.24Å; L501-V532 HydrophobicContact CG-CG2 4.07Å; L501-T539 HydrophobicContact CD2-CG2 4.42Å; L501-W564 HydrophobicContact CB-CE3 4.32Å; L501-W564 HydrophobicContact CB-CH2 4.1Å; L501-W564 HydrophobicContact CB-CZ3 3.55Å; L501-W564 HydrophobicContact CD1-CE3 3.91Å; L501-W564 HydrophobicContact CD1-CZ3 3.98Å; L501-W564 HydrophobicContact CG-CZ3 4.41Å; L501-L571 HydrophobicContact CD1-CD2 3.51Å; L501-I573 HydrophobicContact CD1-CD1 3.4Å; L501-I573 HydrophobicContact CD1-CG1 4Å; L501-I573 HydrophobicContact CD2-CD1 3.54Å; L501-I573 HydrophobicContact CG-CD1 4.09Å
502	A	88.8	Confident	80.5	Confident	30 Å²	30	64.9 Å²	64.9	25%	0.248	36%	0.357	C	S	.	.	H	α-helix	trans	-65.3	-42.3	-177.8	0	0	0	0	0	111	D500 F505 S506	D500-A502 PolarHBondContact O-N 3.29Å; D500-A502 WeakPolarHBondContact OD1-CB 3.42Å; D500-A502 PolarHBondContact OD1-N 2.81Å; A502-F505 PolarHBondContact O-N 3.11Å; A502-S506 PolarHBondContact O-N 3.46Å; A502-S506 VanDerWaalsContact O-N 3.14Å
503	Q	87.7	Confident	81.9	Confident	118 Å²	118	56.9 Å²	56.9	55%	0.551	32%	0.317	S	S	*	.	H	α-helix	trans	-63.3	-43.1	174.2	-170.8	180	10.3	0	0	111.6	D500 L501 F505 S506 A507	D500-Q503 HydrophobicContact CB-CB 4.25Å; L501-Q503 VanDerWaalsContact C-N 3.35Å; L501-Q503 PolarHBondContact O-N 3.05Å; Q503-F505 PolarHBondContact O-N 3.27Å; Q503-S506 PolarHBondContact O-N 3.28Å; Q503-A507 WeakPolarHBondContact O-CB 3.33Å; Q503-A507 PolarHBondContact O-N 3.26Å
504	M	89.7	Confident	83.1	Confident	12 Å²	12	56 Å²	56	6%	0.059	32%	0.315	C	S	.	.	H	α-helix	trans	-64.7	-39.5	179.4	-69.6	-60.4	103.5	0	0	112.9	V499 D500 L501 A508 E536 T539 Q540 L543	V499-M504 HydrophobicContact CG1-CG 3.52Å; V499-M504 HydrophobicContact CG1-SD 4.32Å; D500-M504 WeakPolarHBondContact O-CG 3.26Å; D500-M504 PolarHBondContact O-N 3.09Å; L501-M504 PolarHBondContact O-N 3.45Å; M504-A508 WeakPolarHBondContact O-CB 3.38Å; M504-A508 PolarHBondContact O-N 3.06Å; M504-E536 HydrophobicContact SD-CB 4.22Å; M504-T539 HydrophobicContact CB-CG2 4.37Å; M504-T539 HydrophobicContact CG-CG2 4.23Å; M504-Q540 HydrophobicContact SD-CB 4.37Å; M504-L543 HydrophobicContact CB-CD1 3.67Å
505	F	91.4	Very high	84.1	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-64.1	-42.3	173.7	-89.1	-75.9	0	0	0	112.2	L501 A502 Q503 A508 W509 L525 L543 L547 V562 W564 I573 I575	L501-F505 VanDerWaalsContact O-CD2 3.26Å; L501-F505 WeakPolarHBondContact O-CD2 3.32Å; L501-F505 PolarHBondContact O-N 3.04Å; A502-F505 PolarHBondContact O-N 3.11Å; Q503-F505 PolarHBondContact O-N 3.27Å; F505-A508 PolarHBondContact O-N 2.94Å; F505-W509 WeakPolarHBondContact O-CB 3.39Å; F505-W509 PolarHBondContact O-N 3.01Å; F505-L525 HydrophobicContact CB-CD1 4.22Å; F505-L525 HydrophobicContact CB-CD2 3.81Å; F505-L525 HydrophobicContact CD1-CD2 4.15Å; F505-L525 HydrophobicContact CD2-CD2 4.23Å; F505-L525 HydrophobicContact CG-CD2 3.81Å; F505-L543 HydrophobicContact CD1-CD1 4.27Å; F505-L543 HydrophobicContact CD1-CD2 4.29Å; F505-L543 HydrophobicContact CD2-CD1 4.13Å; F505-L543 HydrophobicContact CE1-CD1 4.46Å; F505-L543 HydrophobicContact CE1-CD2 3.68Å; F505-L543 HydrophobicContact CE2-CD1 4.31Å; F505-L543 HydrophobicContact CE2-CD2 3.97Å; F505-L543 HydrophobicContact CG-CD1 4.09Å; F505-L543 HydrophobicContact CZ-CD1 4.48Å; F505-L543 HydrophobicContact CZ-CD2 3.5Å; F505-L547 HydrophobicContact CD1-CD1 4.39Å; F505-L547 HydrophobicContact CE1-CD2 4.5Å; F505-V562 HydrophobicContact CD1-CG2 3.96Å; F505-V562 HydrophobicContact CD2-CG1 4.44Å; F505-V562 HydrophobicContact CE1-CB 4.47Å; F505-V562 HydrophobicContact CE1-CG1 4.14Å; F505-V562 HydrophobicContact CE1-CG2 3.48Å; F505-V562 VanDerWaalsContact CE1-CG2 3.48Å; F505-V562 HydrophobicContact CE2-CG1 3.74Å; F505-V562 HydrophobicContact CZ-CB 4.36Å; F505-V562 HydrophobicContact CZ-CG1 3.56Å; F505-V562 HydrophobicContact CZ-CG2 3.81Å; F505-W564 HydrophobicContact CD2-CH2 4.31Å; F505-W564 HydrophobicContact CD2-CZ3 4.01Å; F505-W564 AromaticContact CE2-CZ3 3.84Å; F505-W564 HydrophobicContact CE2-CZ3 3.84Å; F505-I573 HydrophobicContact CE2-CG2 4.03Å; F505-I573 HydrophobicContact CZ-CG2 3.94Å; F505-I575 HydrophobicContact CE1-CD1 4Å; F505-I575 HydrophobicContact CE1-CG1 4.21Å; F505-I575 HydrophobicContact CZ-CD1 3.78Å; F505-I575 HydrophobicContact CZ-CG1 3.93Å
506	S	87.8	Confident	85.1	Confident	71 Å²	71	54 Å²	54	50%	0.497	29%	0.285	S	S	.	.	H	α-helix	trans	-62.5	-46	176.9	179.8	0	0	0	0	111.9	A502 Q503 A508 W509 E510	A502-S506 PolarHBondContact O-N 3.46Å; A502-S506 VanDerWaalsContact O-N 3.14Å; Q503-S506 PolarHBondContact O-N 3.28Å; S506-A508 PolarHBondContact O-N 2.82Å; S506-W509 PolarHBondContact O-N 2.92Å; S506-E510 PolarHBondContact O-N 3.22Å
507	A	83.5	Confident	85.5	Confident	34 Å²	34	59.4 Å²	59.4	28%	0.281	30%	0.303	S	S	.	.	H	α-helix	trans	-63	-42.1	177.2	0	0	0	0	0	112.3	Q503 W509 L511	Q503-A507 WeakPolarHBondContact O-CB 3.33Å; Q503-A507 PolarHBondContact O-N 3.26Å; A507-W509 VanDerWaalsContact C-N 3.32Å; A507-W509 PolarHBondContact O-N 3.17Å; A507-L511 WeakPolarHBondContact O-CG 3.25Å; A507-L511 PolarHBondContact O-N 3.04Å
508	A	87.4	Confident	85.5	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-65.5	-34.4	176	0	0	0	0	0	112.5	M504 F505 S506 L543 V544 L547	M504-A508 WeakPolarHBondContact O-CB 3.38Å; M504-A508 PolarHBondContact O-N 3.06Å; F505-A508 PolarHBondContact O-N 2.94Å; S506-A508 PolarHBondContact O-N 2.82Å; A508-L543 HydrophobicContact CB-CB 3.77Å; A508-V544 HydrophobicContact CB-CG2 3.8Å; A508-L547 HydrophobicContact CB-CD1 3.86Å
509	W	89.9	Confident	85.5	Confident	36 Å²	36	56.5 Å²	56.5	14%	0.136	29%	0.288	C	S	.	.	H	α-helix	trans	-68.9	-46.5	177.4	-167.2	-114.6	0	0	0	112.5	F505 S506 A507 L511 L512 A513 H516 A521 L523 L547 L551 I560	F505-W509 WeakPolarHBondContact O-CB 3.39Å; F505-W509 PolarHBondContact O-N 3.01Å; S506-W509 PolarHBondContact O-N 2.92Å; A507-W509 VanDerWaalsContact C-N 3.32Å; A507-W509 PolarHBondContact O-N 3.17Å; W509-L511 VanDerWaalsContact C-N 3.3Å; W509-L511 PolarHBondContact O-N 3.49Å; W509-L512 CarbonylContact O-C 3.42Å; W509-L512 WeakPolarHBondContact O-CA 3.49Å; W509-L512 WeakPolarHBondContact O-CB 3.3Å; W509-L512 PolarHBondContact O-N 2.83Å; W509-A513 PolarHBondContact O-N 3.37Å; W509-H516 AromaticContact CD1-CD2 3.95Å; W509-H516 AromaticContact CD1-NE2 3.63Å; W509-H516 AromaticContact CD2-CD2 3.69Å; W509-H516 AromaticContact CE2-CD2 3.46Å; W509-H516 VanDerWaalsContact CE2-CD2 3.46Å; W509-H516 AromaticContact CE2-CG 3.71Å; W509-H516 AromaticContact CE2-NE2 3.82Å; W509-H516 HydrophobicContact CH2-CB 3.6Å; W509-H516 HydrophobicContact CZ2-CB 3.55Å; W509-H516 AromaticContact CZ2-CD2 3.86Å; W509-H516 AromaticContact CZ2-CG 3.63Å; W509-H516 HydrophobicContact CZ3-CB 4.17Å; W509-H516 AromaticContact NE1-CD2 3.61Å; W509-H516 AromaticContact NE1-CE1 3.73Å; W509-H516 AromaticContact NE1-NE2 3.44Å; W509-H516 PolarHBondContact NE1-NE2 3.4Å; W509-H516 PolarHBondContact O-CD2 3.37Å; W509-H516 PolarHBondContact O-NE2 3.48Å; W509-A521 HydrophobicContact CH2-CB 3.95Å; W509-A521 HydrophobicContact CZ2-CB 4.29Å; W509-L523 HydrophobicContact CB-CD2 3.91Å; W509-L523 HydrophobicContact CD2-CB 3.85Å; W509-L523 HydrophobicContact CD2-CD2 3.92Å; W509-L523 HydrophobicContact CD2-CG 4.47Å; W509-L523 HydrophobicContact CE3-CB 4.08Å; W509-L523 HydrophobicContact CE3-CD2 4.09Å; W509-L523 HydrophobicContact CG-CB 4.4Å; W509-L523 HydrophobicContact CG-CD2 3.87Å; W509-L523 HydrophobicContact CH2-CB 4.15Å; W509-L523 HydrophobicContact CZ2-CB 3.94Å; W509-L523 HydrophobicContact CZ3-CB 4.24Å; W509-L547 HydrophobicContact CE3-CD1 4.35Å; W509-L551 HydrophobicContact CH2-CD2 4.09Å; W509-L551 HydrophobicContact CZ3-CD1 4.37Å; W509-L551 HydrophobicContact CZ3-CD2 4.29Å; W509-I560 HydrophobicContact CH2-CD1 4.35Å; W509-I560 HydrophobicContact CZ3-CD1 3.93Å
510	E	82.7	Confident	85.6	Confident	113 Å²	113	63.5 Å²	63.5	53%	0.528	32%	0.32	S	S	.	.	H	α-helix	trans	-60.8	-37.5	176.2	-83.4	-64.6	156	0	0	112.6	S506 L512 A513 R517	S506-E510 PolarHBondContact O-N 3.22Å; E510-L512 PolarHBondContact O-N 3.03Å; E510-L512 VanDerWaalsContact O-N 3.12Å; E510-A513 WeakPolarHBondContact O-CB 3.44Å; E510-A513 PolarHBondContact O-N 3.12Å; E510-R517 IonicContact OE2-NH2 3.55Å
511	L	78.6	Confident	85.7	Confident	115 Å²	115	61.5 Å²	61.5	60%	0.602	31%	0.311	S	S	*	.	H	α-helix	trans	-59.9	-22.8	172.6	-74.9	-179.8	0	0	0	113.2	A507 W509 Q540 V544	A507-L511 WeakPolarHBondContact O-CG 3.25Å; A507-L511 PolarHBondContact O-N 3.04Å; W509-L511 VanDerWaalsContact C-N 3.3Å; W509-L511 PolarHBondContact O-N 3.49Å; L511-Q540 HydrophobicContact CD1-CG 4.4Å; L511-V544 HydrophobicContact CB-CG2 4.46Å; L511-V544 HydrophobicContact CD1-CG2 3.93Å
512	L	82.9	Confident	85.8	Confident	14 Å²	14	65.1 Å²	65.1	7%	0.073	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	13.7	178.3	-65.8	171.3	0	0	0	113.1	W509 E510 M514 R515 H516 V544 L547 A548 L551	W509-L512 CarbonylContact O-C 3.42Å; W509-L512 WeakPolarHBondContact O-CA 3.49Å; W509-L512 WeakPolarHBondContact O-CB 3.3Å; W509-L512 PolarHBondContact O-N 2.83Å; E510-L512 PolarHBondContact O-N 3.03Å; E510-L512 VanDerWaalsContact O-N 3.12Å; L512-M514 VanDerWaalsContact C-N 3.28Å; L512-M514 PolarHBondContact O-N 3.49Å; L512-M514 VanDerWaalsContact O-N 3.16Å; L512-R515 WeakPolarHBondContact O-CA 3.19Å; L512-R515 PolarHBondContact O-N 3.42Å; L512-H516 PolarHBondContact O-CD2 3.23Å; L512-H516 VanDerWaalsContact O-CD2 3.25Å; L512-H516 PolarHBondContact O-N 2.82Å; L512-V544 HydrophobicContact CD2-CG1 4.35Å; L512-L547 HydrophobicContact CD1-CB 3.54Å; L512-L547 HydrophobicContact CD1-CD1 4.42Å; L512-A548 HydrophobicContact CD2-CB 4.17Å; L512-L551 HydrophobicContact CB-CD1 4.26Å; L512-L551 HydrophobicContact CD1-CD1 4.15Å
513	A	79.3	Confident	86.1	Confident	12 Å²	12	65.2 Å²	65.2	10%	0.099	33%	0.33	C	S	.	.	H	α-helix	trans	-49.6	-43	-178.7	0	0	0	0	0	114.6	W509 E510 R515 H516 R517	W509-A513 PolarHBondContact O-N 3.37Å; E510-A513 WeakPolarHBondContact O-CB 3.44Å; E510-A513 PolarHBondContact O-N 3.12Å; A513-R515 PolarHBondContact O-N 3.14Å; A513-H516 VanDerWaalsContact CA-NE2 3.34Å; A513-H516 WeakPolarHBondContact CA-NE2 3.47Å; A513-R517 VanDerWaalsContact O-CB 3.3Å; A513-R517 WeakPolarHBondContact O-CB 3.36Å; A513-R517 WeakPolarHBondContact O-CG 3.4Å; A513-R517 PolarHBondContact O-N 2.94Å
514	M	79.1	Confident	86.3	Confident	169 Å²	169	62.6 Å²	62.6	83%	0.833	32%	0.322	S	S	*	.	H	α-helix	trans	-70.1	-18.1	179.3	-66.9	-64.9	-73.7	0	0	113.5	L512 P518	L512-M514 VanDerWaalsContact C-N 3.28Å; L512-M514 PolarHBondContact O-N 3.49Å; L512-M514 VanDerWaalsContact O-N 3.16Å; M514-P518 WeakPolarHBondContact O-CD 3.37Å; M514-P518 WeakPolarHBondContact O-CG 3.14Å
515	R	78.9	Confident	86.4	Confident	111 Å²	111	65.1 Å²	65.1	42%	0.419	34%	0.335	S	S	.	.	H	α-helix	trans	-97.3	-44.8	178	-72.2	-170.7	152.3	-143.5	-10	112.1	L512 A513 L519 L551 D552	L512-R515 WeakPolarHBondContact O-CA 3.19Å; L512-R515 PolarHBondContact O-N 3.42Å; A513-R515 PolarHBondContact O-N 3.14Å; R515-L519 WeakPolarHBondContact O-CD1 3.21Å; R515-L519 VanDerWaalsContact O-CG 3.31Å; R515-L519 WeakPolarHBondContact O-CG 3.45Å; R515-L551 HydrophobicContact CB-CD1 4.05Å; R515-D552 IonicContact CZ-OD1 2.76Å; R515-D552 IonicContact NH1-OD1 3.88Å; R515-D552 PolarHBondContact NH1-OD1 2.75Å; R515-D552 IonicContact NH1-OD2 2.71Å; R515-D552 IonicContact NH2-OD1 3.05Å
516	H	84	Confident	86.2	Confident	16 Å²	16	66.6 Å²	66.6	7%	0.074	35%	0.345	C	S	.	.	H	α-helix	trans	-78.6	-30.9	-174	74.6	59.1	0	0	0	113	W509 L512 A513 L519 Q520 A521 L551	W509-H516 AromaticContact CD1-CD2 3.95Å; W509-H516 AromaticContact CD1-NE2 3.63Å; W509-H516 AromaticContact CD2-CD2 3.69Å; W509-H516 AromaticContact CE2-CD2 3.46Å; W509-H516 VanDerWaalsContact CE2-CD2 3.46Å; W509-H516 AromaticContact CE2-CG 3.71Å; W509-H516 AromaticContact CE2-NE2 3.82Å; W509-H516 HydrophobicContact CH2-CB 3.6Å; W509-H516 HydrophobicContact CZ2-CB 3.55Å; W509-H516 AromaticContact CZ2-CD2 3.86Å; W509-H516 AromaticContact CZ2-CG 3.63Å; W509-H516 HydrophobicContact CZ3-CB 4.17Å; W509-H516 AromaticContact NE1-CD2 3.61Å; W509-H516 AromaticContact NE1-CE1 3.73Å; W509-H516 AromaticContact NE1-NE2 3.44Å; W509-H516 PolarHBondContact NE1-NE2 3.4Å; W509-H516 PolarHBondContact O-CD2 3.37Å; W509-H516 PolarHBondContact O-NE2 3.48Å; L512-H516 PolarHBondContact O-CD2 3.23Å; L512-H516 VanDerWaalsContact O-CD2 3.25Å; L512-H516 PolarHBondContact O-N 2.82Å; A513-H516 VanDerWaalsContact CA-NE2 3.34Å; A513-H516 WeakPolarHBondContact CA-NE2 3.47Å; H516-L519 PolarHBondContact O-N 3.2Å; H516-Q520 PolarHBondContact O-N 3.08Å; H516-A521 HydrophobicContact CB-CB 4.02Å; H516-A521 PolarHBondContact O-N 3.36Å; H516-L551 HydrophobicContact CB-CD1 4.11Å; H516-L551 HydrophobicContact CB-CD2 4.18Å
517	R	87.6	Confident	85.9	Confident	157 Å²	157	72.9 Å²	72.9	59%	0.592	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-47.5	-177.3	-68.4	178	-172	165.6	4.9	112.8	E510 A513 L519 Q520	E510-R517 IonicContact OE2-NH2 3.55Å; A513-R517 VanDerWaalsContact O-CB 3.3Å; A513-R517 WeakPolarHBondContact O-CB 3.36Å; A513-R517 WeakPolarHBondContact O-CG 3.4Å; A513-R517 PolarHBondContact O-N 2.94Å; R517-L519 PolarHBondContact O-N 2.7Å; R517-Q520 PolarHBondContact O-N 2.86Å; R517-Q520 VanDerWaalsContact O-N 3.14Å
518	P	83.5	Confident	85.4	Confident	85 Å²	85	73.7 Å²	73.7	55%	0.552	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-32.5	176.6	-23.3	34.9	0	0	0	113.2	M514 Q520 Q556	M514-P518 WeakPolarHBondContact O-CD 3.37Å; M514-P518 WeakPolarHBondContact O-CG 3.14Å; P518-Q520 PolarHBondContact O-N 2.84Å; P518-Q556 PolarHBondContact O-NE2 3.26Å; P518-Q556 PolarHBondContact O-OE1 3.46Å
519	L	85.2	Confident	85	Confident	37 Å²	37	79.2 Å²	79.2	19%	0.194	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-6.1	179.4	-63.2	177.4	0	0	0	113.4	R515 H516 R517 A521 L551 G557	R515-L519 WeakPolarHBondContact O-CD1 3.21Å; R515-L519 VanDerWaalsContact O-CG 3.31Å; R515-L519 WeakPolarHBondContact O-CG 3.45Å; H516-L519 PolarHBondContact O-N 3.2Å; R517-L519 PolarHBondContact O-N 2.7Å; L519-A521 HydrophobicContact CB-CB 4.16Å; L519-A521 PolarHBondContact O-N 2.99Å; L519-L551 HydrophobicContact CD1-CB 4.3Å; L519-L551 HydrophobicContact CD1-CD2 4.16Å; L519-G557 PolarHBondContact O-N 2.81Å
520	Q	89.6	Confident	84.7	Confident	148 Å²	148	78.1 Å²	78.1	69%	0.692	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	36.2	-169	-58.5	178.4	7.3	0	0	111.9	H516 R517 P518	H516-Q520 PolarHBondContact O-N 3.08Å; R517-Q520 PolarHBondContact O-N 2.86Å; R517-Q520 VanDerWaalsContact O-N 3.14Å; P518-Q520 PolarHBondContact O-N 2.84Å
521	A	91	Very high	84.9	Confident	13 Å²	13	75.8 Å²	75.8	11%	0.107	40%	0.404	C	S	.	.			trans	-75.9	145.5	-174	0	0	0	0	0	111.2	W509 H516 L519 L551 A558	W509-A521 HydrophobicContact CH2-CB 3.95Å; W509-A521 HydrophobicContact CZ2-CB 4.29Å; H516-A521 HydrophobicContact CB-CB 4.02Å; H516-A521 PolarHBondContact O-N 3.36Å; L519-A521 HydrophobicContact CB-CB 4.16Å; L519-A521 PolarHBondContact O-N 2.99Å; A521-L551 HydrophobicContact CB-CD2 3.59Å; A521-A558 CarbonylContact C-O 3.5Å; A521-A558 WeakPolarHBondContact CA-O 3.36Å; A521-A558 HydrophobicContact CB-CB 3.8Å
522	T	93.4	Very high	85.5	Confident	76 Å²	76	70.3 Å²	70.3	47%	0.466	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	131	-178.4	-56.3	0	0	0	0	110.2	V524 A558 I560	T522-V524 HydrophobicContact CG2-CG2 4.23Å; T522-A558 PolarHBondContact N-O 3.27Å; T522-I560 PolarHBondContact O-N 2.84Å
523	L	93.7	Very high	85.7	Confident	32 Å²	32	70.9 Å²	70.9	17%	0.168	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	122.2	171.5	-179.9	66.1	0	0	0	109.1	W509 L525 L547 I560 V562	W509-L523 HydrophobicContact CB-CD2 3.91Å; W509-L523 HydrophobicContact CD2-CB 3.85Å; W509-L523 HydrophobicContact CD2-CD2 3.92Å; W509-L523 HydrophobicContact CD2-CG 4.47Å; W509-L523 HydrophobicContact CE3-CB 4.08Å; W509-L523 HydrophobicContact CE3-CD2 4.09Å; W509-L523 HydrophobicContact CG-CB 4.4Å; W509-L523 HydrophobicContact CG-CD2 3.87Å; W509-L523 HydrophobicContact CH2-CB 4.15Å; W509-L523 HydrophobicContact CZ2-CB 3.94Å; W509-L523 HydrophobicContact CZ3-CB 4.24Å; L523-L525 HydrophobicContact CD1-CD2 4.46Å; L523-L525 HydrophobicContact CD2-CD2 4.24Å; L523-L525 HydrophobicContact CD2-CG 4.4Å; L523-L525 HydrophobicContact CG-CD2 4.22Å; L523-L525 HydrophobicContact CG-CG 4.33Å; L523-L547 HydrophobicContact CD1-CD2 4.08Å; L523-I560 HydrophobicContact CD1-CB 4.1Å; L523-I560 HydrophobicContact CD1-CG2 4Å; L523-V562 HydrophobicContact CD1-CG2 3.99Å
524	V	93.2	Very high	86	Confident	64 Å²	64	70.3 Å²	70.3	39%	0.388	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	112.8	178	-176.3	0	0	0	0	108.6	T522 V559 I560 V562	T522-V524 HydrophobicContact CG2-CG2 4.23Å; V524-V559 HydrophobicContact CG2-CG1 4.31Å; V524-I560 PolarHBondContact N-O 3.39Å; V524-V562 PolarHBondContact O-N 3Å
525	L	91.7	Very high	86.2	Confident	65 Å²	65	63.9 Å²	63.9	34%	0.34	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-98.9	149.6	175.2	-62.4	177.1	0	0	0	110.5	F505 L523 V562	F505-L525 HydrophobicContact CB-CD1 4.22Å; F505-L525 HydrophobicContact CB-CD2 3.81Å; F505-L525 HydrophobicContact CD1-CD2 4.15Å; F505-L525 HydrophobicContact CD2-CD2 4.23Å; F505-L525 HydrophobicContact CG-CD2 3.81Å; L523-L525 HydrophobicContact CD1-CD2 4.46Å; L523-L525 HydrophobicContact CD2-CD2 4.24Å; L523-L525 HydrophobicContact CD2-CG 4.4Å; L523-L525 HydrophobicContact CG-CD2 4.22Å; L523-L525 HydrophobicContact CG-CG 4.33Å; L525-V562 HydrophobicContact CD2-CB 3.89Å; L525-V562 HydrophobicContact CD2-CG1 4.35Å; L525-V562 HydrophobicContact CD2-CG2 3.8Å
526	P	87.8	Confident	86.4	Confident	30 Å²	30	63.9 Å²	63.9	20%	0.195	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-69.7	159.4	176	-13.9	29.1	0	0	0	111.9	G528 V562 W564	P526-G528 PolarHBondContact O-N 3.34Å; P526-V562 VanDerWaalsContact CD-O 3.31Å; P526-V562 WeakPolarHBondContact CD-O 3.46Å; P526-V562 WeakPolarHBondContact CG-O 3.2Å; P526-W564 HydrophobicContact CB-CZ2 4.4Å; P526-W564 HydrophobicContact CG-CD2 4Å; P526-W564 VanDerWaalsContact CG-CE2 3.43Å; P526-W564 HydrophobicContact CG-CG 4.1Å; P526-W564 HydrophobicContact CG-CZ2 3.92Å
527	Q	79.8	Confident	86.2	Confident	203 Å²	203	67.8 Å²	67.8	95%	0.949	37%	0.374	S	S	*	.	S	Bend	trans	-73.3	118.6	166.5	-64.7	-174.4	-4.5	0	0	109.5
528	G	73.6	Confident	85.8	Confident	51 Å²	51	62 Å²	62	53%	0.526	35%	0.352	S	S	.	.	S	Bend	trans	129.9	150.2	177.7	0	0	0	0	0	113.1	P526	P526-G528 PolarHBondContact O-N 3.34Å
529	T	78.3	Confident	86	Confident	116 Å²	116	58 Å²	58	71%	0.712	33%	0.326	S	S	*	.			trans	-92.8	140.6	172.9	52	0	0	0	0	109.7
530	A	84.1	Confident	85.9	Confident	13 Å²	13	59 Å²	59	11%	0.107	33%	0.33	C	S	.	.			trans	-134.2	126.2	177.2	0	0	0	0	0	110	L501 W564 L571	L501-A530 WeakPolarHBondContact CB-O 3.49Å; L501-A530 HydrophobicContact CD1-CB 3.87Å; L501-A530 WeakPolarHBondContact CG-O 3.32Å; L501-A530 PolarHBondContact N-O 2.82Å; L501-A530 VanDerWaalsContact N-O 3.07Å; A530-W564 HydrophobicContact CB-CD2 4.12Å; A530-W564 HydrophobicContact CB-CE3 4.26Å; A530-W564 HydrophobicContact CB-CG 4.42Å; A530-L571 HydrophobicContact CB-CD2 3.76Å
531	T	88.1	Confident	85.5	Confident	65 Å²	65	53.5 Å²	53.5	40%	0.399	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	132.9	-176.8	-39	0	0	0	0	109.8	A498 V499	A498-T531 HydrophobicContact CB-CG2 3.75Å; V499-T531 WeakPolarHBondContact O-CA 3.48Å; V499-T531 WeakPolarHBondContact O-CG2 3.3Å
532	V	89.9	Confident	85.3	Confident	0 Å²	0	53 Å²	53	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	156.2	-177.9	-64.8	0	0	0	0	111.4	V499 L501 G534 L571 F636	V499-V532 HydrophobicContact CB-CG2 4.25Å; V499-V532 PolarHBondContact N-O 2.69Å; V499-V532 PolarHBondContact O-N 3.49Å; V499-V532 VanDerWaalsContact O-N 3.07Å; L501-V532 HydrophobicContact CD1-CG1 3.75Å; L501-V532 HydrophobicContact CD1-CG2 4.46Å; L501-V532 HydrophobicContact CD2-CG2 3.79Å; L501-V532 HydrophobicContact CG-CG1 4.24Å; L501-V532 HydrophobicContact CG-CG2 4.07Å; V532-G534 PolarHBondContact O-N 2.98Å; V532-L571 HydrophobicContact CG1-CB 4.21Å; V532-L571 HydrophobicContact CG1-CD2 3.51Å; V532-L571 HydrophobicContact CG1-CG 4.48Å; V532-F636 HydrophobicContact CB-CB 3.6Å; V532-F636 HydrophobicContact CB-CD1 4.12Å; V532-F636 HydrophobicContact CB-CG 3.91Å; V532-F636 HydrophobicContact CG1-CB 3.52Å; V532-F636 HydrophobicContact CG1-CD2 4.35Å; V532-F636 HydrophobicContact CG1-CG 3.96Å; V532-F636 HydrophobicContact CG2-CB 4.22Å; V532-F636 HydrophobicContact CG2-CD1 3.84Å; V532-F636 HydrophobicContact CG2-CD2 4.48Å; V532-F636 HydrophobicContact CG2-CE1 4.3Å; V532-F636 HydrophobicContact CG2-CG 3.94Å
533	S	88.2	Confident	85.1	Confident	25 Å²	25	49.4 Å²	49.4	18%	0.175	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	115.5	169.7	-171.5	0	0	0	0	109.2	L496 H497 R637 T639	L496-S533 VanDerWaalsContact CB-OG 3.28Å; L496-S533 WeakPolarHBondContact CB-OG 3.24Å; H497-S533 CarbonylContact O-C 3.6Å; H497-S533 WeakPolarHBondContact O-CA 3.42Å; S533-R637 PolarHBondContact N-O 3.31Å; S533-T639 PolarHBondContact N-OG1 3.33Å
534	G	84.6	Confident	84.6	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167	-171.7	-173.1	0	0	0	0	0	114.5	H497 V532	H497-G534 PolarHBondContact N-O 2.84Å; H497-G534 PolarHBondContact O-N 2.84Å; V532-G534 PolarHBondContact O-N 2.98Å
535	D	83.8	Confident	84.2	Confident	35 Å²	35	48 Å²	48	19%	0.187	27%	0.27	C	S	.	.			trans	-118.6	125.3	171.6	171.7	-177.4	0	0	0	107.5	V537 R538 T539 M616	D535-V537 VanDerWaalsContact C-N 3.27Å; D535-V537 PolarHBondContact O-N 3.37Å; D535-V537 PolarHBondContact OD2-N 3.07Å; D535-R538 HydrophobicContact CB-CB 4.14Å; D535-R538 HydrophobicContact CB-CG 4.1Å; D535-R538 PolarHBondContact O-N 3.17Å; D535-R538 WeakPolarHBondContact OD1-CD 3.17Å; D535-R538 VanDerWaalsContact OD1-CG 3.29Å; D535-R538 WeakPolarHBondContact OD1-CG 3.42Å; D535-R538 IonicContact OD1-CZ 2.76Å; D535-R538 IonicContact OD1-NE 3.18Å; D535-R538 PolarHBondContact OD1-NE 3.49Å; D535-R538 IonicContact OD1-NH2 3.89Å; D535-T539 VanDerWaalsContact O-CB 3.29Å; D535-T539 WeakPolarHBondContact O-CB 3.36Å; D535-T539 PolarHBondContact O-N 2.99Å; D535-T539 PolarHBondContact O-OG1 2.94Å; D535-M616 HydrophobicContact CB-SD 4.47Å
536	E	83.5	Confident	84.1	Confident	110 Å²	110	45.2 Å²	45.2	51%	0.514	26%	0.255	S	S	.	.	H	α-helix	trans	-54.3	-43.8	-177.6	-67.2	-175.7	170.3	0	0	111.8	V499 M504 T539 Q540	V499-E536 HydrophobicContact CG1-CG 4.42Å; V499-E536 HydrophobicContact CG2-CG 4.11Å; M504-E536 HydrophobicContact SD-CB 4.22Å; E536-T539 PolarHBondContact O-N 2.8Å; E536-Q540 WeakPolarHBondContact O-CB 3.1Å; E536-Q540 PolarHBondContact O-N 2.89Å
537	V	78.4	Confident	84.2	Confident	99 Å²	99	43.8 Å²	43.8	60%	0.6	25%	0.246	S	C	*	.	H	α-helix	trans	-67.7	-45.7	-176.1	178.7	0	0	0	0	110.8	D535 Q541	D535-V537 VanDerWaalsContact C-N 3.27Å; D535-V537 PolarHBondContact O-N 3.37Å; D535-V537 PolarHBondContact OD2-N 3.07Å; V537-Q541 WeakPolarHBondContact O-CB 3.31Å; V537-Q541 PolarHBondContact O-N 2.71Å
538	R	80.3	Confident	84.4	Confident	34 Å²	34	34.8 Å²	34.8	13%	0.128	21%	0.206	C	C	.	.	H	α-helix	trans	-67.5	-39.7	179.1	-63.8	178.8	-155.4	-168	-0.6	110.9	D535 Q541 V542 L612 M616	D535-R538 HydrophobicContact CB-CB 4.14Å; D535-R538 HydrophobicContact CB-CG 4.1Å; D535-R538 PolarHBondContact O-N 3.17Å; D535-R538 WeakPolarHBondContact OD1-CD 3.17Å; D535-R538 VanDerWaalsContact OD1-CG 3.29Å; D535-R538 WeakPolarHBondContact OD1-CG 3.42Å; D535-R538 IonicContact OD1-CZ 2.76Å; D535-R538 IonicContact OD1-NE 3.18Å; D535-R538 PolarHBondContact OD1-NE 3.49Å; D535-R538 IonicContact OD1-NH2 3.89Å; R538-Q541 PolarHBondContact O-N 3.28Å; R538-V542 WeakPolarHBondContact O-CG2 3.48Å; R538-V542 PolarHBondContact O-N 3.22Å; R538-L612 HydrophobicContact CB-CD2 4.23Å; R538-L612 HydrophobicContact CG-CD2 3.94Å; R538-M616 HydrophobicContact CB-CE 4.23Å; R538-M616 HydrophobicContact CB-SD 3.79Å
539	T	87	Confident	84.9	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.006	19%	0.193	C	C	.	.	H	α-helix	trans	-63.5	-50.2	177.7	-55.6	0	0	0	0	110.5	V499 L501 M504 D535 E536 Q541 V542 L543 F636	V499-T539 HydrophobicContact CG1-CG2 4.38Å; L501-T539 HydrophobicContact CD2-CG2 4.42Å; M504-T539 HydrophobicContact CB-CG2 4.37Å; M504-T539 HydrophobicContact CG-CG2 4.23Å; D535-T539 VanDerWaalsContact O-CB 3.29Å; D535-T539 WeakPolarHBondContact O-CB 3.36Å; D535-T539 PolarHBondContact O-N 2.99Å; D535-T539 PolarHBondContact O-OG1 2.94Å; E536-T539 PolarHBondContact O-N 2.8Å; T539-Q541 VanDerWaalsContact C-N 3.28Å; T539-Q541 PolarHBondContact O-N 2.97Å; T539-V542 PolarHBondContact O-N 3.46Å; T539-V542 VanDerWaalsContact O-N 3.14Å; T539-L543 HydrophobicContact CG2-CD1 4.36Å; T539-L543 WeakPolarHBondContact O-CG 3.31Å; T539-L543 PolarHBondContact O-N 3.33Å; T539-F636 HydrophobicContact CG2-CZ 4.32Å
540	Q	84.6	Confident	85.3	Confident	58 Å²	58	29.2 Å²	29.2	27%	0.271	16%	0.161	S	C	.	.	H	α-helix	trans	-58.2	-39.9	176.8	-171.1	178.8	12.6	0	0	111.9	M504 L511 E536 L543 V544	M504-Q540 HydrophobicContact SD-CB 4.37Å; L511-Q540 HydrophobicContact CD1-CG 4.4Å; E536-Q540 WeakPolarHBondContact O-CB 3.1Å; E536-Q540 PolarHBondContact O-N 2.89Å; Q540-L543 PolarHBondContact O-N 2.88Å; Q540-V544 HydrophobicContact CG-CG2 4.45Å; Q540-V544 WeakPolarHBondContact O-CG2 3.35Å; Q540-V544 PolarHBondContact O-N 3.3Å
541	Q	79.9	Confident	85.4	Confident	34 Å²	34	28.8 Å²	28.8	16%	0.159	16%	0.156	C	C	.	.	H	α-helix	trans	-63.2	-44.1	175.7	178.3	173.5	-13.2	0	0	112.6	Q485 V537 R538 T539 L543 N545 L612	Q485-Q541 VanDerWaalsContact CD-NE2 3.32Å; Q485-Q541 VanDerWaalsContact NE2-NE2 3.13Å; V537-Q541 WeakPolarHBondContact O-CB 3.31Å; V537-Q541 PolarHBondContact O-N 2.71Å; R538-Q541 PolarHBondContact O-N 3.28Å; T539-Q541 VanDerWaalsContact C-N 3.28Å; T539-Q541 PolarHBondContact O-N 2.97Å; Q541-L543 VanDerWaalsContact C-N 3.33Å; Q541-L543 PolarHBondContact O-N 3.21Å; Q541-N545 WeakPolarHBondContact O-CB 3.33Å; Q541-N545 PolarHBondContact O-N 3.37Å; Q541-N545 VanDerWaalsContact O-N 3.16Å; Q541-L612 HydrophobicContact CB-CD1 4.16Å; Q541-L612 HydrophobicContact CG-CD1 3.79Å
542	V	86.8	Confident	85	Confident	1 Å²	1	29.4 Å²	29.4	1%	0.006	16%	0.157	C	C	.	.	H	α-helix	trans	-59	-47	174.4	171.1	0	0	0	0	110.1	R538 T539 N545 V546 C609 L612 M613 M616 L634	R538-V542 WeakPolarHBondContact O-CG2 3.48Å; R538-V542 PolarHBondContact O-N 3.22Å; T539-V542 PolarHBondContact O-N 3.46Å; T539-V542 VanDerWaalsContact O-N 3.14Å; V542-N545 PolarHBondContact O-N 3.38Å; V542-V546 HydrophobicContact CG1-CG2 4.4Å; V542-V546 VanDerWaalsContact O-CG2 3.3Å; V542-V546 WeakPolarHBondContact O-CG2 3.37Å; V542-V546 PolarHBondContact O-N 3.21Å; V542-C609 HydrophobicContact CG1-CB 4.15Å; V542-C609 HydrophobicContact CG2-CB 4.22Å; V542-L612 HydrophobicContact CG2-CB 3.81Å; V542-L612 HydrophobicContact CG2-CD1 3.95Å; V542-M613 HydrophobicContact CG1-SD 4.42Å; V542-M613 HydrophobicContact CG2-SD 4.47Å; V542-M616 HydrophobicContact CG2-CE 4.48Å; V542-L634 HydrophobicContact CG1-CD1 3.7Å; V542-L634 HydrophobicContact CG1-CD2 3.87Å; V542-L634 HydrophobicContact CG1-CG 4.46Å
543	L	89.9	Confident	84.7	Confident	2 Å²	2	31.8 Å²	31.8	1%	0.01	17%	0.172	C	C	.	.	H	α-helix	trans	-65.2	-46.3	-178.4	-65	-176.6	0	0	0	112.8	M504 F505 A508 T539 Q540 Q541 N545 V546 L547 I575 L634	M504-L543 HydrophobicContact CB-CD1 3.67Å; F505-L543 HydrophobicContact CD1-CD1 4.27Å; F505-L543 HydrophobicContact CD1-CD2 4.29Å; F505-L543 HydrophobicContact CD2-CD1 4.13Å; F505-L543 HydrophobicContact CE1-CD1 4.46Å; F505-L543 HydrophobicContact CE1-CD2 3.68Å; F505-L543 HydrophobicContact CE2-CD1 4.31Å; F505-L543 HydrophobicContact CE2-CD2 3.97Å; F505-L543 HydrophobicContact CG-CD1 4.09Å; F505-L543 HydrophobicContact CZ-CD1 4.48Å; F505-L543 HydrophobicContact CZ-CD2 3.5Å; A508-L543 HydrophobicContact CB-CB 3.77Å; T539-L543 HydrophobicContact CG2-CD1 4.36Å; T539-L543 WeakPolarHBondContact O-CG 3.31Å; T539-L543 PolarHBondContact O-N 3.33Å; Q540-L543 PolarHBondContact O-N 2.88Å; Q541-L543 VanDerWaalsContact C-N 3.33Å; Q541-L543 PolarHBondContact O-N 3.21Å; L543-N545 VanDerWaalsContact C-N 3.29Å; L543-N545 PolarHBondContact O-N 2.93Å; L543-V546 PolarHBondContact O-N 3.14Å; L543-L547 VanDerWaalsContact O-CB 3.31Å; L543-L547 WeakPolarHBondContact O-CB 3.26Å; L543-L547 WeakPolarHBondContact O-CG 2.89Å; L543-L547 PolarHBondContact O-N 3.18Å; L543-I575 HydrophobicContact CD2-CD1 4.1Å; L543-L634 HydrophobicContact CD2-CD1 4.04Å
544	V	84	Confident	84.4	Confident	33 Å²	33	31.8 Å²	31.8	20%	0.2	17%	0.171	C	C	.	.	H	α-helix	trans	-58.7	-42.9	177.4	169.9	0	0	0	0	110.8	A508 L511 L512 Q540 A548	A508-V544 HydrophobicContact CB-CG2 3.8Å; L511-V544 HydrophobicContact CB-CG2 4.46Å; L511-V544 HydrophobicContact CD1-CG2 3.93Å; L512-V544 HydrophobicContact CD2-CG1 4.35Å; Q540-V544 HydrophobicContact CG-CG2 4.45Å; Q540-V544 WeakPolarHBondContact O-CG2 3.35Å; Q540-V544 PolarHBondContact O-N 3.3Å; V544-A548 WeakPolarHBondContact O-CB 3.28Å; V544-A548 PolarHBondContact O-N 2.9Å
545	N	83.4	Confident	84.1	Confident	34 Å²	34	33.1 Å²	33.1	18%	0.182	19%	0.186	C	C	.	.	H	α-helix	trans	-65.9	-43.2	178.4	-81.5	-8	0	0	0	112.6	Q541 V542 L543 N549	Q541-N545 WeakPolarHBondContact O-CB 3.33Å; Q541-N545 PolarHBondContact O-N 3.37Å; Q541-N545 VanDerWaalsContact O-N 3.16Å; V542-N545 PolarHBondContact O-N 3.38Å; L543-N545 VanDerWaalsContact C-N 3.29Å; L543-N545 PolarHBondContact O-N 2.93Å; N545-N549 VanDerWaalsContact O-CB 3.31Å; N545-N549 WeakPolarHBondContact O-CB 3.41Å; N545-N549 VanDerWaalsContact O-CG 3.25Å; N545-N549 PolarHBondContact O-N 3.32Å; N545-N549 PolarHBondContact O-ND2 2.85Å
546	V	89.9	Confident	84.1	Confident	5 Å²	5	37.3 Å²	37.3	3%	0.03	20%	0.204	C	C	.	.	H	α-helix	trans	-68	-45.1	179	175.5	0	0	0	0	110.9	V542 L543 N549 A550 I575 V632	V542-V546 HydrophobicContact CG1-CG2 4.4Å; V542-V546 VanDerWaalsContact O-CG2 3.3Å; V542-V546 WeakPolarHBondContact O-CG2 3.37Å; V542-V546 PolarHBondContact O-N 3.21Å; L543-V546 PolarHBondContact O-N 3.14Å; V546-N549 WeakPolarHBondContact O-CB 3.38Å; V546-N549 PolarHBondContact O-N 3.44Å; V546-A550 PolarHBondContact O-N 3.32Å; V546-I575 HydrophobicContact CB-CD1 4.31Å; V546-I575 HydrophobicContact CG1-CB 4.06Å; V546-I575 HydrophobicContact CG1-CD1 3.71Å; V546-I575 HydrophobicContact CG1-CG2 3.85Å; V546-V632 HydrophobicContact CG1-CB 3.95Å; V546-V632 HydrophobicContact CG1-CG1 4.3Å; V546-V632 HydrophobicContact CG1-CG2 4Å; V546-V632 HydrophobicContact CG2-CG1 4.09Å
547	L	89.5	Confident	84.3	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-66.1	-41.8	178.2	-66.9	174.1	0	0	0	112.1	F505 A508 W509 L512 L523 L543 N549 A550 L551 I560 I575	F505-L547 HydrophobicContact CD1-CD1 4.39Å; F505-L547 HydrophobicContact CE1-CD2 4.5Å; A508-L547 HydrophobicContact CB-CD1 3.86Å; W509-L547 HydrophobicContact CE3-CD1 4.35Å; L512-L547 HydrophobicContact CD1-CB 3.54Å; L512-L547 HydrophobicContact CD1-CD1 4.42Å; L523-L547 HydrophobicContact CD1-CD2 4.08Å; L543-L547 VanDerWaalsContact O-CB 3.31Å; L543-L547 WeakPolarHBondContact O-CB 3.26Å; L543-L547 WeakPolarHBondContact O-CG 2.89Å; L543-L547 PolarHBondContact O-N 3.18Å; L547-N549 VanDerWaalsContact C-N 3.31Å; L547-N549 PolarHBondContact O-N 3.41Å; L547-A550 PolarHBondContact O-N 2.91Å; L547-L551 WeakPolarHBondContact O-CG 3.34Å; L547-L551 PolarHBondContact O-N 3.16Å; L547-I560 HydrophobicContact CD2-CD1 4.13Å; L547-I560 HydrophobicContact CD2-CG2 3.83Å; L547-I575 HydrophobicContact CD2-CG2 4.46Å
548	A	84.2	Confident	84.7	Confident	14 Å²	14	29 Å²	29	12%	0.116	17%	0.168	C	C	.	.	H	α-helix	trans	-62.6	-39.8	174.2	0	0	0	0	0	111.4	L512 V544 A550 L551 D552	L512-A548 HydrophobicContact CD2-CB 4.17Å; V544-A548 WeakPolarHBondContact O-CB 3.28Å; V544-A548 PolarHBondContact O-N 2.9Å; A548-A550 VanDerWaalsContact C-N 3.35Å; A548-A550 PolarHBondContact O-N 3.25Å; A548-L551 PolarHBondContact O-N 3.37Å; A548-D552 PolarHBondContact O-N 3.19Å
549	N	83.8	Confident	85.4	Confident	47 Å²	47	29.9 Å²	29.9	25%	0.251	18%	0.177	S	C	.	.	H	α-helix	trans	-62.3	-41.1	174.9	-82.4	-23.9	0	0	0	112.4	N545 V546 L547 V553 K598	N545-N549 VanDerWaalsContact O-CB 3.31Å; N545-N549 WeakPolarHBondContact O-CB 3.41Å; N545-N549 VanDerWaalsContact O-CG 3.25Å; N545-N549 PolarHBondContact O-N 3.32Å; N545-N549 PolarHBondContact O-ND2 2.85Å; V546-N549 WeakPolarHBondContact O-CB 3.38Å; V546-N549 PolarHBondContact O-N 3.44Å; L547-N549 VanDerWaalsContact C-N 3.31Å; L547-N549 PolarHBondContact O-N 3.41Å; N549-V553 WeakPolarHBondContact O-CG2 3.31Å; N549-V553 PolarHBondContact O-N 3.17Å; N549-K598 PolarHBondContact OD1-NZ 3.19Å
550	A	87.3	Confident	85.7	Confident	4 Å²	4	29.9 Å²	29.9	3%	0.033	18%	0.177	C	C	.	.	H	α-helix	trans	-65.8	-44.2	175.7	0	0	0	0	0	112.3	V546 L547 A548 D552 V553 C554 I560 D577	V546-A550 PolarHBondContact O-N 3.32Å; L547-A550 PolarHBondContact O-N 2.91Å; A548-A550 VanDerWaalsContact C-N 3.35Å; A548-A550 PolarHBondContact O-N 3.25Å; A550-D552 VanDerWaalsContact C-N 3.34Å; A550-D552 PolarHBondContact O-N 3.36Å; A550-V553 PolarHBondContact O-N 3.41Å; A550-C554 WeakPolarHBondContact O-CB 3.3Å; A550-C554 PolarHBondContact O-N 2.88Å; A550-C554 PolarHBondContact O-SG 2.86Å; A550-I560 HydrophobicContact CB-CD1 3.63Å; A550-I560 HydrophobicContact CB-CG1 3.86Å; A550-D577 HydrophobicContact CB-CB 3.88Å
551	L	86.1	Confident	86.1	Confident	3 Å²	3	30.3 Å²	30.3	2%	0.016	18%	0.184	C	C	.	.	H	α-helix	trans	-60.9	-40.4	177.2	-71.7	173.9	0	0	0	112.6	W509 L512 R515 H516 L519 A521 L547 A548 V553 G555 A558 I560	W509-L551 HydrophobicContact CH2-CD2 4.09Å; W509-L551 HydrophobicContact CZ3-CD1 4.37Å; W509-L551 HydrophobicContact CZ3-CD2 4.29Å; L512-L551 HydrophobicContact CB-CD1 4.26Å; L512-L551 HydrophobicContact CD1-CD1 4.15Å; R515-L551 HydrophobicContact CB-CD1 4.05Å; H516-L551 HydrophobicContact CB-CD1 4.11Å; H516-L551 HydrophobicContact CB-CD2 4.18Å; L519-L551 HydrophobicContact CD1-CB 4.3Å; L519-L551 HydrophobicContact CD1-CD2 4.16Å; A521-L551 HydrophobicContact CB-CD2 3.59Å; L547-L551 WeakPolarHBondContact O-CG 3.34Å; L547-L551 PolarHBondContact O-N 3.16Å; A548-L551 PolarHBondContact O-N 3.37Å; L551-V553 PolarHBondContact O-N 3.44Å; L551-G555 PolarHBondContact O-N 3.21Å; L551-A558 HydrophobicContact CD2-CB 4.18Å; L551-I560 HydrophobicContact CD2-CD1 4.09Å; L551-I560 HydrophobicContact CG-CD1 4.11Å
552	D	80.4	Confident	86.8	Confident	79 Å²	79	28.9 Å²	28.9	42%	0.422	18%	0.177	S	C	.	.	H	α-helix	trans	-64	-27.4	179	-72.1	-16.9	0	0	0	112.8	R515 A548 A550 K598	R515-D552 IonicContact CZ-OD1 2.76Å; R515-D552 IonicContact NH1-OD1 3.88Å; R515-D552 PolarHBondContact NH1-OD1 2.75Å; R515-D552 IonicContact NH1-OD2 2.71Å; R515-D552 IonicContact NH2-OD1 3.05Å; A548-D552 PolarHBondContact O-N 3.19Å; A550-D552 VanDerWaalsContact C-N 3.34Å; A550-D552 PolarHBondContact O-N 3.36Å; D552-K598 HydrophobicContact CB-CD 4.41Å; D552-K598 VanDerWaalsContact CB-NZ 3.25Å; D552-K598 IonicContact OD2-NZ 3.8Å; D552-K598 PolarHBondContact OD2-NZ 3.28Å
553	V	83	Confident	87	Confident	50 Å²	50	33.2 Å²	33.2	30%	0.303	20%	0.2	S	C	.	.	H	α-helix	trans	-98.9	-30	-172.4	173.5	0	0	0	0	112.3	N549 A550 L551 P580	N549-V553 WeakPolarHBondContact O-CG2 3.31Å; N549-V553 PolarHBondContact O-N 3.17Å; A550-V553 PolarHBondContact O-N 3.41Å; L551-V553 PolarHBondContact O-N 3.44Å; V553-P580 VanDerWaalsContact CG1-CD 3.49Å; V553-P580 HydrophobicContact CG1-CG 3.76Å
554	C	82.2	Confident	87.1	Confident	24 Å²	24	35 Å²	35	16%	0.162	21%	0.207	C	C	.	.	H	α-helix	trans	-83.7	-30	-178.3	-63.6	0	0	0	0	114.2	A550 A558 D577 N578 G579	A550-C554 WeakPolarHBondContact O-CB 3.3Å; A550-C554 PolarHBondContact O-N 2.88Å; A550-C554 PolarHBondContact O-SG 2.86Å; C554-A558 HydrophobicContact CB-CB 3.35Å; C554-D577 VanDerWaalsContact SG-CB 3.54Å; C554-N578 WeakPolarHBondContact CB-OD1 3.47Å; C554-N578 PolarHBondContact SG-OD1 2.97Å; C554-G579 PolarHBondContact SG-N 2.89Å; C554-G579 VanDerWaalsContact SG-N 3.39Å
555	G	77.7	Confident	87.3	Confident	29 Å²	29	38.8 Å²	38.8	30%	0.299	22%	0.222	S	C	.	.			trans	66.9	-143.3	-177.3	0	0	0	0	0	113.7	L551 A558	L551-G555 PolarHBondContact O-N 3.21Å; G555-A558 WeakPolarHBondContact O-CB 3.37Å; G555-A558 PolarHBondContact O-N 2.94Å
556	Q	84.4	Confident	87.6	Confident	122 Å²	122	43.2 Å²	43.2	57%	0.57	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.2	133.8	-176.4	-159.8	73.7	16.2	0	0	110.9	P518	P518-Q556 PolarHBondContact O-NE2 3.26Å; P518-Q556 PolarHBondContact O-OE1 3.46Å
557	G	86.9	Confident	87.3	Confident	35 Å²	35	48.3 Å²	48.3	36%	0.361	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.5	28.2	-176.3	0	0	0	0	0	113.2	L519 V559 N578	L519-G557 PolarHBondContact O-N 2.81Å; G557-V559 PolarHBondContact O-N 3.2Å; G557-N578 PolarHBondContact O-ND2 2.86Å
558	A	88.5	Confident	87	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	30%	0.3	C	S	.	.			trans	-57.9	128.4	177.3	0	0	0	0	0	111.4	A521 T522 L551 C554 G555	A521-A558 CarbonylContact C-O 3.5Å; A521-A558 WeakPolarHBondContact CA-O 3.36Å; A521-A558 HydrophobicContact CB-CB 3.8Å; T522-A558 PolarHBondContact N-O 3.27Å; L551-A558 HydrophobicContact CD2-CB 4.18Å; C554-A558 HydrophobicContact CB-CB 3.35Å; G555-A558 WeakPolarHBondContact O-CB 3.37Å; G555-A558 PolarHBondContact O-N 2.94Å
559	V	93.2	Very high	87.1	Confident	53 Å²	53	58.7 Å²	58.7	32%	0.321	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	112.8	175.5	-178.1	0	0	0	0	107.8	V524 G557 N578	V524-V559 HydrophobicContact CG2-CG1 4.31Å; G557-V559 PolarHBondContact O-N 3.2Å; V559-N578 HydrophobicContact CB-CB 4.49Å; V559-N578 PolarHBondContact N-ND2 3.47Å; V559-N578 PolarHBondContact N-OD1 3.3Å; V559-N578 PolarHBondContact O-N 3.42Å; V559-N578 PolarHBondContact O-OD1 3.01Å
560	I	93.9	Very high	87.4	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	118.2	177.4	-58.2	168.6	0	0	0	107.4	W509 T522 L523 V524 L547 A550 L551 I575 G576	W509-I560 HydrophobicContact CH2-CD1 4.35Å; W509-I560 HydrophobicContact CZ3-CD1 3.93Å; T522-I560 PolarHBondContact O-N 2.84Å; L523-I560 HydrophobicContact CD1-CB 4.1Å; L523-I560 HydrophobicContact CD1-CG2 4Å; V524-I560 PolarHBondContact N-O 3.39Å; L547-I560 HydrophobicContact CD2-CD1 4.13Å; L547-I560 HydrophobicContact CD2-CG2 3.83Å; A550-I560 HydrophobicContact CB-CD1 3.63Å; A550-I560 HydrophobicContact CB-CG1 3.86Å; L551-I560 HydrophobicContact CD2-CD1 4.09Å; L551-I560 HydrophobicContact CG-CD1 4.11Å; I560-I575 HydrophobicContact CG2-CG2 3.79Å; I560-G576 CarbonylContact C-O 3.57Å; I560-G576 WeakPolarHBondContact CA-O 3.45Å
561	T	94.1	Very high	87.5	Confident	68 Å²	68	58 Å²	58	42%	0.417	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	121.7	-178.5	-54.7	0	0	0	0	109.3	G576	T561-G576 PolarHBondContact N-O 3.34Å; T561-G576 PolarHBondContact O-N 2.96Å
562	V	93.9	Very high	87.9	Confident	3 Å²	3	58.2 Å²	58.2	2%	0.018	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	140.3	174.1	-176.7	0	0	0	0	108.5	F505 L523 V524 L525 P526 W564 I573 F574 I575	F505-V562 HydrophobicContact CD1-CG2 3.96Å; F505-V562 HydrophobicContact CD2-CG1 4.44Å; F505-V562 HydrophobicContact CE1-CB 4.47Å; F505-V562 HydrophobicContact CE1-CG1 4.14Å; F505-V562 HydrophobicContact CE1-CG2 3.48Å; F505-V562 VanDerWaalsContact CE1-CG2 3.48Å; F505-V562 HydrophobicContact CE2-CG1 3.74Å; F505-V562 HydrophobicContact CZ-CB 4.36Å; F505-V562 HydrophobicContact CZ-CG1 3.56Å; F505-V562 HydrophobicContact CZ-CG2 3.81Å; L523-V562 HydrophobicContact CD1-CG2 3.99Å; V524-V562 PolarHBondContact O-N 3Å; L525-V562 HydrophobicContact CD2-CB 3.89Å; L525-V562 HydrophobicContact CD2-CG1 4.35Å; L525-V562 HydrophobicContact CD2-CG2 3.8Å; P526-V562 VanDerWaalsContact CD-O 3.31Å; P526-V562 WeakPolarHBondContact CD-O 3.46Å; P526-V562 WeakPolarHBondContact CG-O 3.2Å; V562-W564 HydrophobicContact CG1-CE3 4.33Å; V562-W564 HydrophobicContact CG1-CZ3 4.21Å; V562-I573 HydrophobicContact CG1-CG2 3.82Å; V562-F574 CarbonylContact C-O 3.54Å; V562-F574 VanDerWaalsContact CA-O 3.25Å; V562-F574 WeakPolarHBondContact CA-O 3.41Å; V562-I575 HydrophobicContact CG2-CG1 4.49Å
563	N	92	Very high	88.5	Confident	93 Å²	93	54.4 Å²	54.4	50%	0.497	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	154.6	169.3	-153.6	-3.8	0	0	0	110.8	I573 F574	N563-I573 CarbonylContact O-C 3.58Å; N563-I573 WeakPolarHBondContact O-CA 3.3Å; N563-F574 HydrophobicContact CB-CB 4.38Å; N563-F574 PolarHBondContact N-O 3.18Å; N563-F574 PolarHBondContact O-N 3.5Å
564	W	90.5	Very high	89	Confident	39 Å²	39	54.6 Å²	54.6	15%	0.148	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	137.1	175.8	8.3	71.7	0	0	0	111.1	L501 F505 P526 A530 V562 L571 N572 I573	L501-W564 HydrophobicContact CB-CE3 4.32Å; L501-W564 HydrophobicContact CB-CH2 4.1Å; L501-W564 HydrophobicContact CB-CZ3 3.55Å; L501-W564 HydrophobicContact CD1-CE3 3.91Å; L501-W564 HydrophobicContact CD1-CZ3 3.98Å; L501-W564 HydrophobicContact CG-CZ3 4.41Å; F505-W564 HydrophobicContact CD2-CH2 4.31Å; F505-W564 HydrophobicContact CD2-CZ3 4.01Å; F505-W564 AromaticContact CE2-CZ3 3.84Å; F505-W564 HydrophobicContact CE2-CZ3 3.84Å; P526-W564 HydrophobicContact CB-CZ2 4.4Å; P526-W564 HydrophobicContact CG-CD2 4Å; P526-W564 VanDerWaalsContact CG-CE2 3.43Å; P526-W564 HydrophobicContact CG-CG 4.1Å; P526-W564 HydrophobicContact CG-CZ2 3.92Å; A530-W564 HydrophobicContact CB-CD2 4.12Å; A530-W564 HydrophobicContact CB-CE3 4.26Å; A530-W564 HydrophobicContact CB-CG 4.42Å; V562-W564 HydrophobicContact CG1-CE3 4.33Å; V562-W564 HydrophobicContact CG1-CZ3 4.21Å; W564-L571 HydrophobicContact CB-CD1 4.13Å; W564-N572 CarbonylContact C-O 3.46Å; W564-N572 VanDerWaalsContact CA-O 3.3Å; W564-N572 WeakPolarHBondContact CA-O 3.25Å; W564-I573 HydrophobicContact CE3-CG1 4.42Å; W564-I573 HydrophobicContact CE3-CG2 4.2Å
565	Q	89.2	Confident	89.6	Confident	112 Å²	112	53.6 Å²	53.6	52%	0.523	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	121.9	176.4	-166.6	-178.2	13.2	0	0	109.7	N572 F574	Q565-N572 PolarHBondContact N-O 2.85Å; Q565-N572 PolarHBondContact O-N 3.47Å; Q565-F574 HydrophobicContact CB-CD2 4.47Å; Q565-F574 HydrophobicContact CB-CE2 3.57Å; Q565-F574 HydrophobicContact CB-CZ 4.34Å
566	M	88.4	Confident	90.3	Very high	128 Å²	128	52.6 Å²	52.6	63%	0.631	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.5	132.4	173.5	-165.4	176.4	-73.6	0	0	110.1	L571 L638	M566-L571 HydrophobicContact CB-CD1 4.43Å; M566-L638 HydrophobicContact CE-CD1 4.02Å; M566-L638 HydrophobicContact CE-CD2 4.08Å; M566-L638 HydrophobicContact CG-CD1 3.92Å; M566-L638 HydrophobicContact SD-CD1 3.91Å
567	Q	84.8	Confident	90.7	Very high	111 Å²	111	47.7 Å²	47.7	52%	0.519	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	91.8	176.9	-168.5	176.8	11.3	0	0	108.9	K569 T570 N572	Q567-K569 PolarHBondContact O-N 3.5Å; Q567-T570 CarbonylContact C-O 3.59Å; Q567-T570 PolarHBondContact N-O 3.15Å; Q567-T570 PolarHBondContact O-N 3.04Å; Q567-T570 VanDerWaalsContact O-N 3.08Å; Q567-T570 PolarHBondContact O-OG1 3.12Å; Q567-N572 PolarHBondContact OE1-ND2 2.84Å
568	G	83.5	Confident	91	Very high	67 Å²	67	49.4 Å²	49.4	69%	0.691	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.4	-119.4	-176.6	0	0	0	0	0	111.8	T570	G568-T570 VanDerWaalsContact C-N 3.27Å; G568-T570 PolarHBondContact O-N 2.98Å
569	K	86	Confident	90.8	Very high	166 Å²	166	49.7 Å²	49.7	72%	0.722	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	11.1	178	-63.1	-167	174.2	-160.4	0	114.1	Q567 L638	Q567-K569 PolarHBondContact O-N 3.5Å; K569-L638 PolarHBondContact O-N 3.03Å
570	T	88.7	Confident	90.5	Very high	28 Å²	28	52.8 Å²	52.8	17%	0.172	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	151.6	-175.9	63.3	0	0	0	0	111.4	Q567 G568 Q635 F636	Q567-T570 CarbonylContact C-O 3.59Å; Q567-T570 PolarHBondContact N-O 3.15Å; Q567-T570 PolarHBondContact O-N 3.04Å; Q567-T570 VanDerWaalsContact O-N 3.08Å; Q567-T570 PolarHBondContact O-OG1 3.12Å; G568-T570 VanDerWaalsContact C-N 3.27Å; G568-T570 PolarHBondContact O-N 2.98Å; T570-Q635 HydrophobicContact CG2-CG 4.23Å; T570-F636 CarbonylContact C-O 3.51Å; T570-F636 WeakPolarHBondContact CA-O 3.48Å; T570-F636 WeakPolarHBondContact CB-O 3.49Å
571	L	90.8	Very high	90.1	Very high	8 Å²	8	53.3 Å²	53.3	4%	0.042	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	121	174.5	-174.8	75.6	0	0	0	109	L501 A530 V532 W564 M566 I573 Q635 F636 L638	L501-L571 HydrophobicContact CD1-CD2 3.51Å; A530-L571 HydrophobicContact CB-CD2 3.76Å; V532-L571 HydrophobicContact CG1-CB 4.21Å; V532-L571 HydrophobicContact CG1-CD2 3.51Å; V532-L571 HydrophobicContact CG1-CG 4.48Å; W564-L571 HydrophobicContact CB-CD1 4.13Å; M566-L571 HydrophobicContact CB-CD1 4.43Å; L571-I573 HydrophobicContact CD2-CG1 4.48Å; L571-Q635 CarbonylContact O-C 3.55Å; L571-Q635 WeakPolarHBondContact O-CA 3.43Å; L571-F636 PolarHBondContact N-O 3.43Å; L571-F636 PolarHBondContact O-N 3.23Å; L571-L638 HydrophobicContact CB-CD2 4.17Å
572	N	93.1	Very high	89.8	Confident	7 Å²	7	52.3 Å²	52.3	4%	0.037	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	123.9	174.7	-62	-31.5	0	0	0	109.6	W564 Q565 Q567 F574 V633 L634 Q635	W564-N572 CarbonylContact C-O 3.46Å; W564-N572 VanDerWaalsContact CA-O 3.3Å; W564-N572 WeakPolarHBondContact CA-O 3.25Å; Q565-N572 PolarHBondContact N-O 2.85Å; Q565-N572 PolarHBondContact O-N 3.47Å; Q567-N572 PolarHBondContact OE1-ND2 2.84Å; N572-F574 HydrophobicContact CB-CE2 3.68Å; N572-F574 HydrophobicContact CB-CZ 3.89Å; N572-V633 HydrophobicContact CB-CG1 4.09Å; N572-L634 CarbonylContact C-O 3.47Å; N572-L634 WeakPolarHBondContact CA-O 3.25Å; N572-Q635 WeakPolarHBondContact OD1-CB 3.47Å; N572-Q635 WeakPolarHBondContact OD1-CG 3.33Å; N572-Q635 PolarHBondContact OD1-NE2 3.2Å
573	I	93.6	Very high	89.2	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	118.2	175.9	-48.9	173.4	0	0	0	107.8	L501 F505 V562 N563 W564 L571 I575 V633 L634 F636	L501-I573 HydrophobicContact CD1-CD1 3.4Å; L501-I573 HydrophobicContact CD1-CG1 4Å; L501-I573 HydrophobicContact CD2-CD1 3.54Å; L501-I573 HydrophobicContact CG-CD1 4.09Å; F505-I573 HydrophobicContact CE2-CG2 4.03Å; F505-I573 HydrophobicContact CZ-CG2 3.94Å; V562-I573 HydrophobicContact CG1-CG2 3.82Å; N563-I573 CarbonylContact O-C 3.58Å; N563-I573 WeakPolarHBondContact O-CA 3.3Å; W564-I573 HydrophobicContact CE3-CG1 4.42Å; W564-I573 HydrophobicContact CE3-CG2 4.2Å; L571-I573 HydrophobicContact CD2-CG1 4.48Å; I573-I575 HydrophobicContact CG2-CG1 4.17Å; I573-V633 CarbonylContact O-C 3.49Å; I573-V633 VanDerWaalsContact O-CA 3.25Å; I573-V633 WeakPolarHBondContact O-CA 3.31Å; I573-L634 HydrophobicContact CB-CB 4.22Å; I573-L634 PolarHBondContact N-O 3.47Å; I573-L634 PolarHBondContact O-N 3.2Å; I573-F636 HydrophobicContact CD1-CD2 3.71Å; I573-F636 HydrophobicContact CD1-CE2 3.6Å; I573-F636 HydrophobicContact CG1-CD2 4.38Å
574	F	94	Very high	88.7	Confident	53 Å²	53	57.6 Å²	57.6	23%	0.232	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	119	178	-58.3	-95.5	0	0	0	108.5	V562 N563 Q565 N572 V633	V562-F574 CarbonylContact C-O 3.54Å; V562-F574 VanDerWaalsContact CA-O 3.25Å; V562-F574 WeakPolarHBondContact CA-O 3.41Å; N563-F574 HydrophobicContact CB-CB 4.38Å; N563-F574 PolarHBondContact N-O 3.18Å; N563-F574 PolarHBondContact O-N 3.5Å; Q565-F574 HydrophobicContact CB-CD2 4.47Å; Q565-F574 HydrophobicContact CB-CE2 3.57Å; Q565-F574 HydrophobicContact CB-CZ 4.34Å; N572-F574 HydrophobicContact CB-CE2 3.68Å; N572-F574 HydrophobicContact CB-CZ 3.89Å; F574-V633 HydrophobicContact CD1-CB 4.48Å; F574-V633 HydrophobicContact CD1-CG1 4.19Å; F574-V633 HydrophobicContact CD1-CG2 3.61Å; F574-V633 HydrophobicContact CE1-CG1 3.94Å; F574-V633 HydrophobicContact CE1-CG2 3.78Å; F574-V633 HydrophobicContact CZ-CG1 4.25Å
575	I	94.7	Very high	88.2	Confident	4 Å²	4	60.4 Å²	60.4	2%	0.021	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	95.2	176.2	-54.1	167.3	0	0	0	106.3	F505 L543 V546 L547 I560 V562 I573 C631 V632 L634	F505-I575 HydrophobicContact CE1-CD1 4Å; F505-I575 HydrophobicContact CE1-CG1 4.21Å; F505-I575 HydrophobicContact CZ-CD1 3.78Å; F505-I575 HydrophobicContact CZ-CG1 3.93Å; L543-I575 HydrophobicContact CD2-CD1 4.1Å; V546-I575 HydrophobicContact CB-CD1 4.31Å; V546-I575 HydrophobicContact CG1-CB 4.06Å; V546-I575 HydrophobicContact CG1-CD1 3.71Å; V546-I575 HydrophobicContact CG1-CG2 3.85Å; L547-I575 HydrophobicContact CD2-CG2 4.46Å; I560-I575 HydrophobicContact CG2-CG2 3.79Å; V562-I575 HydrophobicContact CG2-CG1 4.49Å; I573-I575 HydrophobicContact CG2-CG1 4.17Å; I575-C631 WeakPolarHBondContact O-CA 3.41Å; I575-V632 PolarHBondContact N-O 3.13Å; I575-V632 PolarHBondContact O-N 3.08Å; I575-L634 HydrophobicContact CD1-CD1 3.78Å; I575-L634 HydrophobicContact CD1-CG 4.35Å
576	G	93.3	Very high	87.8	Confident	8 Å²	8	57.5 Å²	57.5	8%	0.082	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	142.6	178.9	0	0	0	0	0	111.5	I560 T561 A630	I560-G576 CarbonylContact C-O 3.57Å; I560-G576 WeakPolarHBondContact CA-O 3.45Å; T561-G576 PolarHBondContact N-O 3.34Å; T561-G576 PolarHBondContact O-N 2.96Å; G576-A630 WeakPolarHBondContact CA-O 3.32Å
577	D	92	Very high	87.4	Confident	18 Å²	18	55.2 Å²	55.2	10%	0.096	32%	0.317	C	S	.	.			trans	-113.8	173.4	174.2	71.4	49.3	0	0	0	111.6	A550 C554 G579 N629 A630	A550-D577 HydrophobicContact CB-CB 3.88Å; C554-D577 VanDerWaalsContact SG-CB 3.54Å; D577-G579 WeakPolarHBondContact OD1-CA 3.36Å; D577-G579 PolarHBondContact OD1-N 3.2Å; D577-N629 WeakPolarHBondContact O-CB 3.48Å; D577-A630 PolarHBondContact N-O 3.34Å; D577-A630 PolarHBondContact OD1-N 3.39Å; D577-A630 WeakPolarHBondContact OD2-CB 3.46Å
578	N	92.1	Very high	87.2	Confident	71 Å²	71	54.9 Å²	54.9	38%	0.38	33%	0.325	S	S	.	.	S	Bend	trans	-105.4	24	175.4	68.2	-29.1	0	0	0	113	C554 G557 V559 N629	C554-N578 WeakPolarHBondContact CB-OD1 3.47Å; C554-N578 PolarHBondContact SG-OD1 2.97Å; G557-N578 PolarHBondContact O-ND2 2.86Å; V559-N578 HydrophobicContact CB-CB 4.49Å; V559-N578 PolarHBondContact N-ND2 3.47Å; V559-N578 PolarHBondContact N-OD1 3.3Å; V559-N578 PolarHBondContact O-N 3.42Å; V559-N578 PolarHBondContact O-OD1 3.01Å; N578-N629 VanDerWaalsContact C-ND2 3.34Å
579	G	86.2	Confident	87	Confident	6 Å²	6	53.6 Å²	53.6	6%	0.062	31%	0.305	C	S	.	.	S	Bend	trans	-90.4	-177.5	-178.9	0	0	0	0	0	114.2	C554 D577 G581 N629	C554-G579 PolarHBondContact SG-N 2.89Å; C554-G579 VanDerWaalsContact SG-N 3.39Å; D577-G579 WeakPolarHBondContact OD1-CA 3.36Å; D577-G579 PolarHBondContact OD1-N 3.2Å; G579-G581 PolarHBondContact O-N 3.16Å; G579-N629 WeakPolarHBondContact O-CB 3.35Å; G579-N629 PolarHBondContact O-ND2 2.89Å
580	P	84.9	Confident	86.8	Confident	118 Å²	118	46.2 Å²	46.2	77%	0.766	27%	0.274	S	S	*	.	S	Bend	trans	-61.7	-6.7	-174	22.4	-37.4	0	0	0	117.4	V553	V553-P580 VanDerWaalsContact CG1-CD 3.49Å; V553-P580 HydrophobicContact CG1-CG 3.76Å
581	G	87.4	Confident	86.4	Confident	11 Å²	11	47.7 Å²	47.7	11%	0.113	28%	0.28	C	S	.	.			trans	88.7	-174.8	-176.4	0	0	0	0	0	114.5	G579 R628	G579-G581 PolarHBondContact O-N 3.16Å; G581-R628 WeakPolarHBondContact CA-O 3.44Å
582	W	87.1	Confident	85.5	Confident	48 Å²	48	53.2 Å²	53.2	18%	0.182	30%	0.304	C	S	.	.			trans	-80.1	132	177.9	-55.8	115.3	0	0	0	111.1	E584 L587 L590 L606 L622 A623 A630 V632	W582-E584 PolarHBondContact O-N 3.24Å; W582-L587 HydrophobicContact CB-CD2 3.6Å; W582-L587 HydrophobicContact CB-CG 4.37Å; W582-L587 HydrophobicContact CG-CD2 4.05Å; W582-L590 HydrophobicContact CB-CD1 3.97Å; W582-L590 HydrophobicContact CD2-CD1 3.95Å; W582-L590 HydrophobicContact CE3-CD1 3.6Å; W582-L590 HydrophobicContact CG-CD1 4.13Å; W582-L590 HydrophobicContact CZ3-CD1 4.42Å; W582-L606 HydrophobicContact CH2-CD1 4.32Å; W582-L606 HydrophobicContact CZ3-CD1 4.15Å; W582-L622 HydrophobicContact CH2-CD2 3.8Å; W582-L622 HydrophobicContact CZ2-CB 4.38Å; W582-L622 HydrophobicContact CZ2-CD2 3.65Å; W582-L622 HydrophobicContact CZ2-CG 4.47Å; W582-L622 HydrophobicContact CZ3-CD2 4.48Å; W582-A623 PolarHBondContact NE1-O 3.27Å; W582-A630 HydrophobicContact CD2-CB 3.8Å; W582-A630 HydrophobicContact CE3-CB 4.17Å; W582-A630 HydrophobicContact CG-CB 4.32Å; W582-A630 HydrophobicContact CH2-CB 4.07Å; W582-A630 HydrophobicContact CZ2-CB 3.68Å; W582-A630 HydrophobicContact CZ3-CB 4.3Å; W582-V632 HydrophobicContact CH2-CG2 3.75Å; W582-V632 HydrophobicContact CZ2-CG2 3.81Å
583	P	81.4	Confident	84.1	Confident	46 Å²	46	55.8 Å²	55.8	30%	0.299	32%	0.321	S	S	.	.			trans	-66.3	119.2	172.6	20.2	-25.8	0	0	0	111	A585 L586 L587	P583-A585 PolarHBondContact O-N 3.29Å; P583-A585 VanDerWaalsContact O-N 3.14Å; P583-L586 HydrophobicContact CB-CD1 4.42Å; P583-L586 HydrophobicContact CG-CB 4.18Å; P583-L586 HydrophobicContact CG-CD1 3.83Å; P583-L586 HydrophobicContact CG-CG 4.34Å; P583-L586 PolarHBondContact O-N 3.43Å; P583-L587 PolarHBondContact O-N 3.2Å
584	E	80.7	Confident	82.7	Confident	161 Å²	161	58.9 Å²	58.9	75%	0.752	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-52	-40.5	-174.5	-74	-175.1	175	0	0	113	W582 L586 L587	W582-E584 PolarHBondContact O-N 3.24Å; E584-L586 PolarHBondContact O-N 3.03Å; E584-L587 PolarHBondContact O-N 2.99Å
585	A	80.6	Confident	81.3	Confident	98 Å²	98	57.5 Å²	57.5	81%	0.81	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-63.3	-23.2	-179.8	0	0	0	0	0	114	P583	P583-A585 PolarHBondContact O-N 3.29Å; P583-A585 VanDerWaalsContact O-N 3.14Å
586	L	79.6	Confident	79.9	Confident	50 Å²	50	60 Å²	60	26%	0.262	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-102.6	-13.1	-176.9	-64	174.4	0	0	0	113.2	P583 E584 P588 S589 L590 T595	P583-L586 HydrophobicContact CB-CD1 4.42Å; P583-L586 HydrophobicContact CG-CB 4.18Å; P583-L586 HydrophobicContact CG-CD1 3.83Å; P583-L586 HydrophobicContact CG-CG 4.34Å; P583-L586 PolarHBondContact O-N 3.43Å; E584-L586 PolarHBondContact O-N 3.03Å; L586-P588 VanDerWaalsContact C-N 3.35Å; L586-P588 VanDerWaalsContact O-N 3.12Å; L586-S589 CarbonylContact O-C 3.46Å; L586-S589 WeakPolarHBondContact O-CA 3.14Å; L586-S589 PolarHBondContact O-N 3.32Å; L586-L590 HydrophobicContact CB-CD2 3.85Å; L586-L590 HydrophobicContact CB-CG 4.03Å; L586-L590 WeakPolarHBondContact O-CG 3.36Å; L586-L590 PolarHBondContact O-N 3.22Å; L586-T595 HydrophobicContact CB-CG2 4.21Å; L586-T595 HydrophobicContact CD2-CG2 3.95Å; L586-T595 HydrophobicContact CG-CG2 4.48Å
587	L	80.7	Confident	78.7	Confident	81 Å²	81	63.1 Å²	63.1	42%	0.424	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-43.8	-46.5	-175.8	-79.8	170.7	0	0	0	115	W582 P583 E584 S589 L590	W582-L587 HydrophobicContact CB-CD2 3.6Å; W582-L587 HydrophobicContact CB-CG 4.37Å; W582-L587 HydrophobicContact CG-CD2 4.05Å; P583-L587 PolarHBondContact O-N 3.2Å; E584-L587 PolarHBondContact O-N 2.99Å; L587-S589 PolarHBondContact O-N 2.84Å; L587-L590 HydrophobicContact CD2-CD1 4.12Å
588	P	80.4	Confident	77.3	Confident	104 Å²	104	64.9 Å²	64.9	68%	0.675	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-15.3	-179.1	-18	32.3	0	0	0	114.3	L586	L586-P588 VanDerWaalsContact C-N 3.35Å; L586-P588 VanDerWaalsContact O-N 3.12Å
589	S	79.9	Confident	75.5	Confident	40 Å²	40	71.1 Å²	71.1	28%	0.28	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120	-10	-171.7	-61.2	0	0	0	0	113	L586 L587 L591 K592 T595	L586-S589 CarbonylContact O-C 3.46Å; L586-S589 WeakPolarHBondContact O-CA 3.14Å; L586-S589 PolarHBondContact O-N 3.32Å; L587-S589 PolarHBondContact O-N 2.84Å; S589-L591 PolarHBondContact O-N 3.01Å; S589-K592 WeakPolarHBondContact O-CA 3.47Å; S589-K592 VanDerWaalsContact O-CB 3.24Å; S589-K592 WeakPolarHBondContact O-CB 3.36Å; S589-K592 PolarHBondContact O-N 3.41Å; S589-T595 WeakPolarHBondContact O-CB 3.46Å; S589-T595 PolarHBondContact O-OG1 3.37Å
590	L	80.7	Confident	73.7	Confident	11 Å²	11	73.2 Å²	73.2	6%	0.058	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-27.3	-174	-80.2	173.8	0	0	0	114.8	W582 L586 L587 T595 L622	W582-L590 HydrophobicContact CB-CD1 3.97Å; W582-L590 HydrophobicContact CD2-CD1 3.95Å; W582-L590 HydrophobicContact CE3-CD1 3.6Å; W582-L590 HydrophobicContact CG-CD1 4.13Å; W582-L590 HydrophobicContact CZ3-CD1 4.42Å; L586-L590 HydrophobicContact CB-CD2 3.85Å; L586-L590 HydrophobicContact CB-CG 4.03Å; L586-L590 WeakPolarHBondContact O-CG 3.36Å; L586-L590 PolarHBondContact O-N 3.22Å; L587-L590 HydrophobicContact CD2-CD1 4.12Å; L590-T595 HydrophobicContact CD2-CG2 4.32Å; L590-L622 HydrophobicContact CB-CD1 3.5Å; L590-L622 VanDerWaalsContact CB-CD1 3.5Å; L590-L622 HydrophobicContact CD1-CD1 3.81Å; L590-L622 HydrophobicContact CG-CD1 4.31Å
591	L	81.5	Confident	72.2	Confident	58 Å²	58	68.7 Å²	68.7	30%	0.304	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-9.6	175.9	-62.8	-173.8	0	0	0	113.8	S589 L606 S607 V610 L620 L622	S589-L591 PolarHBondContact O-N 3.01Å; L591-L606 HydrophobicContact CD2-CB 4.16Å; L591-S607 WeakPolarHBondContact O-CB 3.44Å; L591-V610 HydrophobicContact CB-CG2 4.15Å; L591-V610 HydrophobicContact CD1-CG2 4.16Å; L591-V610 HydrophobicContact CD2-CG2 3.95Å; L591-V610 HydrophobicContact CG-CG2 4.31Å; L591-L620 HydrophobicContact CD1-CD2 4.19Å; L591-L620 HydrophobicContact CD2-CD2 3.4Å; L591-L620 VanDerWaalsContact CD2-CD2 3.4Å; L591-L620 HydrophobicContact CG-CD2 4.46Å; L591-L622 HydrophobicContact CD1-CG 4.38Å; L591-L622 HydrophobicContact CD2-CD1 3.87Å; L591-L622 HydrophobicContact CD2-CD2 3.86Å; L591-L622 HydrophobicContact CD2-CG 3.84Å; L591-L622 HydrophobicContact CG-CD1 3.95Å; L591-L622 HydrophobicContact CG-CG 4.12Å
592	K	72.6	Confident	70.6	Confident	124 Å²	124	69.8 Å²	69.8	54%	0.539	39%	0.39	S	S	.	.	S	Bend	trans	-78.8	140.1	174.9	-60.6	-178.9	-179	172.7	0	109.6	S589 T595	S589-K592 WeakPolarHBondContact O-CA 3.47Å; S589-K592 VanDerWaalsContact O-CB 3.24Å; S589-K592 WeakPolarHBondContact O-CB 3.36Å; S589-K592 PolarHBondContact O-N 3.41Å; K592-T595 WeakPolarHBondContact O-CB 3.39Å; K592-T595 PolarHBondContact O-N 3.13Å; K592-T595 PolarHBondContact O-OG1 3.43Å
593	P	63.3	Low	69.6	Low	62 Å²	62	68.4 Å²	68.4	40%	0.403	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.3	143.8	172.9	-24.4	32.3	0	0	0	111.9	V424 T595	V424-P593 HydrophobicContact CG1-CB 4.43Å; P593-T595 VanDerWaalsContact C-N 3.28Å; P593-T595 PolarHBondContact O-N 3.46Å
594	F	63	Low	68.9	Low	64 Å²	64	66.9 Å²	66.9	28%	0.281	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.7	17.1	178.5	-46.8	-48.3	0	0	0	116.6	V424 T428 G603 I604	V424-F594 VanDerWaalsContact C-CZ 3.47Å; V424-F594 HydrophobicContact CB-CE2 3.44Å; V424-F594 VanDerWaalsContact CB-CE2 3.44Å; V424-F594 HydrophobicContact CB-CZ 3.79Å; V424-F594 HydrophobicContact CG1-CD2 4.16Å; V424-F594 HydrophobicContact CG1-CE1 4.1Å; V424-F594 HydrophobicContact CG1-CE2 3.1Å; V424-F594 HydrophobicContact CG1-CZ 3.04Å; V424-F594 HydrophobicContact CG2-CD2 4.32Å; V424-F594 HydrophobicContact CG2-CE2 3.63Å; V424-F594 HydrophobicContact CG2-CZ 4.43Å; V424-F594 VanDerWaalsContact O-CE2 3.27Å; V424-F594 WeakPolarHBondContact O-CE2 3.48Å; V424-F594 WeakPolarHBondContact O-CZ 3.28Å; T428-F594 HydrophobicContact CG2-CD1 3.36Å; T428-F594 HydrophobicContact CG2-CD2 4.4Å; T428-F594 HydrophobicContact CG2-CE1 3.07Å; T428-F594 HydrophobicContact CG2-CE2 4.06Å; T428-F594 HydrophobicContact CG2-CG 4.03Å; T428-F594 HydrophobicContact CG2-CZ 3.42Å; T428-F594 VanDerWaalsContact CG2-CZ 3.42Å; T428-F594 WeakPolarHBondContact OG1-CZ 3.46Å; F594-G603 PolarHBondContact N-O 3.27Å; F594-I604 HydrophobicContact CD1-CD1 4.47Å; F594-I604 HydrophobicContact CD1-CG1 4.15Å; F594-I604 HydrophobicContact CE1-CD1 3.98Å; F594-I604 HydrophobicContact CE1-CG1 4.11Å
595	T	65.6	Low	68.3	Low	25 Å²	25	60.2 Å²	60.2	15%	0.153	35%	0.354	C	S	.	.			trans	-94.3	116.2	170.2	-51.6	0	0	0	0	109.2	L586 S589 L590 K592 P593 G603	L586-T595 HydrophobicContact CB-CG2 4.21Å; L586-T595 HydrophobicContact CD2-CG2 3.95Å; L586-T595 HydrophobicContact CG-CG2 4.48Å; S589-T595 WeakPolarHBondContact O-CB 3.46Å; S589-T595 PolarHBondContact O-OG1 3.37Å; L590-T595 HydrophobicContact CD2-CG2 4.32Å; K592-T595 WeakPolarHBondContact O-CB 3.39Å; K592-T595 PolarHBondContact O-N 3.13Å; K592-T595 PolarHBondContact O-OG1 3.43Å; P593-T595 VanDerWaalsContact C-N 3.28Å; P593-T595 PolarHBondContact O-N 3.46Å; T595-G603 PolarHBondContact N-O 3.07Å; T595-G603 WeakPolarHBondContact O-CA 3.36Å
596	T	65	Low	68.3	Low	55 Å²	55	56.4 Å²	56.4	34%	0.337	32%	0.32	S	S	.	.			trans	-138	145.3	-179.4	-171.3	0	0	0	0	110.5	K598 G601	T596-K598 PolarHBondContact OG1-N 3.34Å; T596-G601 VanDerWaalsContact CB-O 3.3Å; T596-G601 WeakPolarHBondContact CB-O 3.47Å; T596-G601 VanDerWaalsContact CG2-O 3.31Å; T596-G601 WeakPolarHBondContact CG2-O 3.4Å; T596-G601 PolarHBondContact OG1-O 2.96Å
597	S	68.6	Low	68.2	Low	74 Å²	74	54.8 Å²	54.8	52%	0.517	31%	0.313	S	S	.	.			trans	-110	3.2	170.6	64.8	0	0	0	0	112.7
598	K	61.5	Low	67.7	Low	56 Å²	56	52.5 Å²	52.5	24%	0.243	30%	0.3	C	S	.	.	S	Bend	trans	-92.4	141.3	-176.3	-64.1	176.6	177.5	174.5	0	109.7	N549 D552 T596 V600	N549-K598 PolarHBondContact OD1-NZ 3.19Å; D552-K598 HydrophobicContact CB-CD 4.41Å; D552-K598 VanDerWaalsContact CB-NZ 3.25Å; D552-K598 IonicContact OD2-NZ 3.8Å; D552-K598 PolarHBondContact OD2-NZ 3.28Å; T596-K598 PolarHBondContact OG1-N 3.34Å; K598-V600 PolarHBondContact O-N 3.47Å
599	E	54	Low	67.9	Low	202 Å²	202	47.5 Å²	47.5	94%	0.944	27%	0.268	S	S	*	.	S	Bend	trans	-61.3	-23.4	175.1	-69.3	-172.7	159.7	0	0	113
600	V	48.7	Very low	68	Low	49 Å²	49	47 Å²	47	30%	0.297	26%	0.263	S	S	.	.	S	Bend	trans	-140.2	121.8	173.3	-177.9	0	0	0	0	108.2	E435 K598	E435-V600 HydrophobicContact CG-CG1 4.31Å; K598-V600 PolarHBondContact O-N 3.47Å
601	G	53.9	Low	67.8	Low	24 Å²	24	48.1 Å²	48.1	25%	0.247	27%	0.272	C	S	.	.			trans	144.2	129.6	179.5	0	0	0	0	0	115	E435 T596 G603	E435-G601 PolarHBondContact OE1-N 2.88Å; T596-G601 VanDerWaalsContact CB-O 3.3Å; T596-G601 WeakPolarHBondContact CB-O 3.47Å; T596-G601 VanDerWaalsContact CG2-O 3.31Å; T596-G601 WeakPolarHBondContact CG2-O 3.4Å; T596-G601 PolarHBondContact OG1-O 2.96Å; G601-G603 VanDerWaalsContact C-N 3.3Å; G601-G603 PolarHBondContact O-N 3.47Å; G601-G603 VanDerWaalsContact O-N 3.09Å
602	L	55	Low	67.8	Low	33 Å²	33	46.2 Å²	46.2	17%	0.173	26%	0.262	C	S	.	.			trans	-68.4	-5.3	-168.1	-69.1	156.3	0	0	0	118	T428 L432 I604	T428-L602 HydrophobicContact CG2-CD2 4.48Å; L432-L602 HydrophobicContact CD1-CD1 4.46Å; L432-L602 HydrophobicContact CD1-CD2 4.09Å; L432-L602 HydrophobicContact CD2-CD1 3.61Å; L432-L602 HydrophobicContact CD2-CD2 3.66Å; L432-L602 HydrophobicContact CD2-CG 3.97Å; L432-L602 HydrophobicContact CG-CD1 4.3Å; L432-L602 HydrophobicContact CG-CD2 3.58Å; L432-L602 HydrophobicContact CG-CG 4.43Å; L602-I604 VanDerWaalsContact C-N 3.27Å; L602-I604 HydrophobicContact CB-CD1 3.64Å; L602-I604 HydrophobicContact CB-CG1 3.51Å; L602-I604 HydrophobicContact CD1-CD1 4Å; L602-I604 HydrophobicContact CG-CD1 4.3Å; L602-I604 VanDerWaalsContact O-CG1 3.27Å; L602-I604 WeakPolarHBondContact O-CG1 3.26Å; L602-I604 PolarHBondContact O-N 3.04Å
603	G	64.8	Low	68.5	Low	19 Å²	19	40.3 Å²	40.3	20%	0.196	24%	0.236	C	C	.	.	S	Bend	trans	64.9	25.4	179.5	0	0	0	0	0	115.5	F594 T595 G601	F594-G603 PolarHBondContact N-O 3.27Å; T595-G603 PolarHBondContact N-O 3.07Å; T595-G603 WeakPolarHBondContact O-CA 3.36Å; G601-G603 VanDerWaalsContact C-N 3.3Å; G601-G603 PolarHBondContact O-N 3.47Å; G601-G603 VanDerWaalsContact O-N 3.09Å
604	I	66.6	Low	69.5	Low	15 Å²	15	43.4 Å²	43.4	8%	0.077	25%	0.245	C	C	.	.			trans	-102.6	-25.9	-175.1	-37	-178.6	0	0	0	112.1	F486 F594 L602 L606 S607 I608	F486-I604 HydrophobicContact CD2-CG2 3.57Å; F486-I604 HydrophobicContact CE1-CD1 4.48Å; F486-I604 HydrophobicContact CE2-CB 4.47Å; F486-I604 HydrophobicContact CE2-CG2 3.05Å; F486-I604 HydrophobicContact CZ-CD1 4.43Å; F486-I604 HydrophobicContact CZ-CG2 3.61Å; F594-I604 HydrophobicContact CD1-CD1 4.47Å; F594-I604 HydrophobicContact CD1-CG1 4.15Å; F594-I604 HydrophobicContact CE1-CD1 3.98Å; F594-I604 HydrophobicContact CE1-CG1 4.11Å; L602-I604 VanDerWaalsContact C-N 3.27Å; L602-I604 HydrophobicContact CB-CD1 3.64Å; L602-I604 HydrophobicContact CB-CG1 3.51Å; L602-I604 HydrophobicContact CD1-CD1 4Å; L602-I604 HydrophobicContact CG-CD1 4.3Å; L602-I604 VanDerWaalsContact O-CG1 3.27Å; L602-I604 WeakPolarHBondContact O-CG1 3.26Å; L602-I604 PolarHBondContact O-N 3.04Å; I604-L606 PolarHBondContact O-N 3.41Å; I604-S607 PolarHBondContact O-N 3.45Å; I604-S607 VanDerWaalsContact O-N 3.09Å; I604-S607 PolarHBondContact O-OG 3.39Å; I604-I608 HydrophobicContact CB-CD1 4.4Å; I604-I608 HydrophobicContact CG2-CD1 3.83Å; I604-I608 HydrophobicContact CG2-CG1 3.95Å; I604-I608 PolarHBondContact O-N 3.24Å; I604-I608 VanDerWaalsContact O-N 3.12Å
605	G	69.6	Low	70.4	Confident	20 Å²	20	44 Å²	44	21%	0.206	25%	0.249	C	C	.	.	H	α-helix	trans	-52.3	-47.7	-169	0	0	0	0	0	114.1	C609	G605-C609 PolarHBondContact O-N 3.07Å; G605-C609 PolarHBondContact O-SG 3.42Å
606	L	79.9	Confident	71.3	Confident	19 Å²	19	42.9 Å²	42.9	10%	0.099	24%	0.242	C	C	.	.	H	α-helix	trans	-71.6	-37.1	179.8	-74.2	169.9	0	0	0	113.2	W582 L591 I604 I608 C609 V610 L622 V632	W582-L606 HydrophobicContact CH2-CD1 4.32Å; W582-L606 HydrophobicContact CZ3-CD1 4.15Å; L591-L606 HydrophobicContact CD2-CB 4.16Å; I604-L606 PolarHBondContact O-N 3.41Å; L606-I608 VanDerWaalsContact C-N 3.29Å; L606-I608 PolarHBondContact O-N 2.56Å; L606-C609 WeakPolarHBondContact O-CB 3.2Å; L606-C609 PolarHBondContact O-N 2.96Å; L606-C609 VanDerWaalsContact O-N 3.09Å; L606-V610 PolarHBondContact O-N 2.94Å; L606-L622 HydrophobicContact CD1-CD2 4.42Å; L606-V632 HydrophobicContact CD2-CG2 4.33Å
607	S	76.9	Confident	72.2	Confident	16 Å²	16	46.4 Å²	46.4	11%	0.112	25%	0.253	C	S	.	.	H	α-helix	trans	-64.4	-34.1	178.1	69.6	0	0	0	0	112.8	L591 I604 V610 S611	L591-S607 WeakPolarHBondContact O-CB 3.44Å; I604-S607 PolarHBondContact O-N 3.45Å; I604-S607 VanDerWaalsContact O-N 3.09Å; I604-S607 PolarHBondContact O-OG 3.39Å; S607-V610 PolarHBondContact O-N 3.22Å; S607-S611 PolarHBondContact O-N 3.38Å
608	I	69.6	Low	73.1	Confident	32 Å²	32	43.5 Å²	43.5	16%	0.164	23%	0.234	C	C	.	.	H	α-helix	trans	-65.7	-43	172.3	-64.9	167.1	0	0	0	109.7	F486 I604 L606 V610 S611 L612	F486-I608 HydrophobicContact CD2-CD1 3.78Å; F486-I608 HydrophobicContact CD2-CG1 4.05Å; F486-I608 HydrophobicContact CE2-CD1 4.29Å; F486-I608 HydrophobicContact CE2-CG1 4.15Å; I604-I608 HydrophobicContact CB-CD1 4.4Å; I604-I608 HydrophobicContact CG2-CD1 3.83Å; I604-I608 HydrophobicContact CG2-CG1 3.95Å; I604-I608 PolarHBondContact O-N 3.24Å; I604-I608 VanDerWaalsContact O-N 3.12Å; L606-I608 VanDerWaalsContact C-N 3.29Å; L606-I608 PolarHBondContact O-N 2.56Å; I608-V610 VanDerWaalsContact C-N 3.33Å; I608-V610 PolarHBondContact O-N 3.06Å; I608-S611 PolarHBondContact O-N 3.14Å; I608-L612 HydrophobicContact CG2-CD1 3.87Å; I608-L612 HydrophobicContact CG2-CG 4.26Å; I608-L612 WeakPolarHBondContact O-CG 3.37Å; I608-L612 PolarHBondContact O-N 3.32Å
609	C	84.7	Confident	74.5	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-61.2	-40.4	178.4	-62.4	0	0	0	0	112.2	V542 G605 L606 S611 L612 M613 L620	V542-C609 HydrophobicContact CG1-CB 4.15Å; V542-C609 HydrophobicContact CG2-CB 4.22Å; G605-C609 PolarHBondContact O-N 3.07Å; G605-C609 PolarHBondContact O-SG 3.42Å; L606-C609 WeakPolarHBondContact O-CB 3.2Å; L606-C609 PolarHBondContact O-N 2.96Å; L606-C609 VanDerWaalsContact O-N 3.09Å; C609-S611 PolarHBondContact O-N 3.39Å; C609-L612 PolarHBondContact O-N 3.05Å; C609-M613 WeakPolarHBondContact O-CB 3.19Å; C609-M613 VanDerWaalsContact O-CG 3.24Å; C609-M613 WeakPolarHBondContact O-CG 3.31Å; C609-M613 PolarHBondContact O-N 3.28Å; C609-L620 HydrophobicContact CB-CD1 3.33Å
610	V	82.7	Confident	76.3	Confident	29 Å²	29	35.3 Å²	35.3	18%	0.176	20%	0.197	C	C	.	.	H	α-helix	trans	-57	-50.8	174.9	175.4	0	0	0	0	111	L591 L606 S607 I608 L612 M613 E614 L620	L591-V610 HydrophobicContact CB-CG2 4.15Å; L591-V610 HydrophobicContact CD1-CG2 4.16Å; L591-V610 HydrophobicContact CD2-CG2 3.95Å; L591-V610 HydrophobicContact CG-CG2 4.31Å; L606-V610 PolarHBondContact O-N 2.94Å; S607-V610 PolarHBondContact O-N 3.22Å; I608-V610 VanDerWaalsContact C-N 3.33Å; I608-V610 PolarHBondContact O-N 3.06Å; V610-L612 VanDerWaalsContact C-N 3.34Å; V610-L612 PolarHBondContact O-N 3.35Å; V610-M613 PolarHBondContact O-N 3.46Å; V610-E614 WeakPolarHBondContact O-CG 3.32Å; V610-E614 PolarHBondContact O-N 2.71Å; V610-L620 HydrophobicContact CG2-CB 4.17Å; V610-L620 HydrophobicContact CG2-CD2 4.06Å
611	S	76.7	Confident	78.3	Confident	34 Å²	34	38 Å²	38	24%	0.238	20%	0.202	C	C	.	.	H	α-helix	trans	-64	-37.8	-178.9	-173.4	0	0	0	0	112.8	S607 I608 C609 Q615	S607-S611 PolarHBondContact O-N 3.38Å; I608-S611 PolarHBondContact O-N 3.14Å; C609-S611 PolarHBondContact O-N 3.39Å; S611-Q615 VanDerWaalsContact O-CG 3.27Å; S611-Q615 WeakPolarHBondContact O-CG 3.48Å; S611-Q615 PolarHBondContact O-N 3.12Å
612	L	80.5	Confident	80.1	Confident	19 Å²	19	38.9 Å²	38.9	10%	0.099	20%	0.201	C	C	.	.	H	α-helix	trans	-67.6	-39.5	176	-68.7	176.5	0	0	0	111.7	R538 Q541 V542 I608 C609 V610 Q615 M616	R538-L612 HydrophobicContact CB-CD2 4.23Å; R538-L612 HydrophobicContact CG-CD2 3.94Å; Q541-L612 HydrophobicContact CB-CD1 4.16Å; Q541-L612 HydrophobicContact CG-CD1 3.79Å; V542-L612 HydrophobicContact CG2-CB 3.81Å; V542-L612 HydrophobicContact CG2-CD1 3.95Å; I608-L612 HydrophobicContact CG2-CD1 3.87Å; I608-L612 HydrophobicContact CG2-CG 4.26Å; I608-L612 WeakPolarHBondContact O-CG 3.37Å; I608-L612 PolarHBondContact O-N 3.32Å; C609-L612 PolarHBondContact O-N 3.05Å; V610-L612 VanDerWaalsContact C-N 3.34Å; V610-L612 PolarHBondContact O-N 3.35Å; L612-Q615 PolarHBondContact O-N 3.41Å; L612-M616 WeakPolarHBondContact O-CE 3.3Å; L612-M616 WeakPolarHBondContact O-CG 3.42Å; L612-M616 PolarHBondContact O-N 3.06Å
613	M	88.5	Confident	81.7	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-64.5	-44.9	176.5	-72.9	-58.2	-63.2	0	0	111.8	V542 C609 V610 Q615 M616 K617 G618 E619 L620 L634 Q635 F636	V542-M613 HydrophobicContact CG1-SD 4.42Å; V542-M613 HydrophobicContact CG2-SD 4.47Å; C609-M613 WeakPolarHBondContact O-CB 3.19Å; C609-M613 VanDerWaalsContact O-CG 3.24Å; C609-M613 WeakPolarHBondContact O-CG 3.31Å; C609-M613 PolarHBondContact O-N 3.28Å; V610-M613 PolarHBondContact O-N 3.46Å; M613-Q615 VanDerWaalsContact C-N 3.31Å; M613-Q615 PolarHBondContact O-N 3.19Å; M613-M616 CarbonylContact O-C 3.48Å; M613-M616 WeakPolarHBondContact O-CA 3.18Å; M613-M616 PolarHBondContact O-N 3.38Å; M613-M616 HydrophobicContact SD-CE 3.67Å; M613-K617 PolarHBondContact O-N 2.92Å; M613-G618 CarbonylContact C-O 3.5Å; M613-G618 CarbonylContact O-C 3.43Å; M613-G618 WeakPolarHBondContact O-CA 3.32Å; M613-G618 PolarHBondContact O-N 3.05Å; M613-E619 WeakPolarHBondContact CE-O 3.48Å; M613-L620 HydrophobicContact CB-CB 4.45Å; M613-L620 HydrophobicContact CG-CB 4.1Å; M613-L634 HydrophobicContact CE-CB 4.04Å; M613-L634 HydrophobicContact CG-CD2 4.37Å; M613-L634 HydrophobicContact SD-CB 4.48Å; M613-L634 HydrophobicContact SD-CD2 4.36Å; M613-Q635 WeakPolarHBondContact CE-O 3.22Å; M613-F636 HydrophobicContact CE-CD1 4.07Å; M613-F636 HydrophobicContact CE-CD2 3.85Å; M613-F636 HydrophobicContact CE-CE1 3.83Å; M613-F636 HydrophobicContact CE-CE2 3.58Å; M613-F636 HydrophobicContact CE-CG 4.09Å; M613-F636 HydrophobicContact CE-CZ 3.58Å; M613-F636 HydrophobicContact SD-CE1 3.84Å; M613-F636 HydrophobicContact SD-CE2 3.94Å; M613-F636 HydrophobicContact SD-CZ 3.43Å; M613-F636 WeakPolarHBondContact SD-CZ 3.47Å
614	E	84.8	Confident	82.9	Confident	126 Å²	126	41.4 Å²	41.4	59%	0.589	22%	0.22	S	C	*	.	H	α-helix	trans	-59.4	-41.7	176.7	-73.1	173.3	166	0	0	112.1	V610 M616 K617	V610-E614 WeakPolarHBondContact O-CG 3.32Å; V610-E614 PolarHBondContact O-N 2.71Å; E614-M616 PolarHBondContact O-N 3.19Å; E614-K617 PolarHBondContact O-N 2.77Å; E614-K617 WeakPolarHBondContact O-CA 2.96Å
615	Q	79.9	Confident	83.8	Confident	78 Å²	78	42.5 Å²	42.5	36%	0.364	23%	0.228	S	C	.	.	H	α-helix	trans	-64	-28.9	175.8	-71.8	172.9	9.2	0	0	112.8	S611 L612 M613 K617	S611-Q615 VanDerWaalsContact O-CG 3.27Å; S611-Q615 WeakPolarHBondContact O-CG 3.48Å; S611-Q615 PolarHBondContact O-N 3.12Å; L612-Q615 PolarHBondContact O-N 3.41Å; M613-Q615 VanDerWaalsContact C-N 3.31Å; M613-Q615 PolarHBondContact O-N 3.19Å; Q615-K617 PolarHBondContact O-N 3.26Å
616	M	84.9	Confident	84.5	Confident	1 Å²	1	51 Å²	51	1%	0.005	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	13.6	173	-63.5	-176.6	-65.7	0	0	112.7	L496 D535 R538 V542 L612 M613 E614 G618 F636	L496-M616 HydrophobicContact CD2-CB 4.26Å; L496-M616 HydrophobicContact CD2-CG 4.19Å; D535-M616 HydrophobicContact CB-SD 4.47Å; R538-M616 HydrophobicContact CB-CE 4.23Å; R538-M616 HydrophobicContact CB-SD 3.79Å; V542-M616 HydrophobicContact CG2-CE 4.48Å; L612-M616 WeakPolarHBondContact O-CE 3.3Å; L612-M616 WeakPolarHBondContact O-CG 3.42Å; L612-M616 PolarHBondContact O-N 3.06Å; M613-M616 CarbonylContact O-C 3.48Å; M613-M616 WeakPolarHBondContact O-CA 3.18Å; M613-M616 PolarHBondContact O-N 3.38Å; M613-M616 HydrophobicContact SD-CE 3.67Å; E614-M616 PolarHBondContact O-N 3.19Å; M616-G618 PolarHBondContact O-N 3.46Å; M616-F636 HydrophobicContact CE-CE1 3.74Å; M616-F636 HydrophobicContact CE-CZ 4.21Å; M616-F636 HydrophobicContact SD-CE1 4.15Å
617	K	84.6	Confident	84.7	Confident	129 Å²	129	55.2 Å²	55.2	56%	0.561	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	27.4	-175.4	-55.2	178.8	-178.8	175	0	113.2	L496 M613 E614 Q615 R637	L496-K617 HydrophobicContact CD1-CB 4.47Å; L496-K617 HydrophobicContact CD1-CD 4.03Å; L496-K617 HydrophobicContact CD1-CG 4.09Å; M613-K617 PolarHBondContact O-N 2.92Å; E614-K617 PolarHBondContact O-N 2.77Å; E614-K617 WeakPolarHBondContact O-CA 2.96Å; Q615-K617 PolarHBondContact O-N 3.26Å; K617-R637 PolarHBondContact O-NE 3.49Å
618	G	87.4	Confident	85.1	Confident	12 Å²	12	64 Å²	64	12%	0.124	32%	0.322	C	S	.	.			trans	-110.7	-173	176.3	0	0	0	0	0	112.4	M613 M616 Q635	M613-G618 CarbonylContact C-O 3.5Å; M613-G618 CarbonylContact O-C 3.43Å; M613-G618 WeakPolarHBondContact O-CA 3.32Å; M613-G618 PolarHBondContact O-N 3.05Å; M616-G618 PolarHBondContact O-N 3.46Å; G618-Q635 CarbonylContact C-O 3.42Å; G618-Q635 WeakPolarHBondContact CA-O 3.5Å
619	E	90.9	Very high	86.1	Confident	77 Å²	77	63.9 Å²	63.9	36%	0.36	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	147.6	-177.4	-162.7	-176.8	153.7	0	0	110.6	M613 R621 Q635	M613-E619 WeakPolarHBondContact CE-O 3.48Å; E619-R621 PolarHBondContact OE2-NH2 3.06Å; E619-R621 IonicContact OE2-NH2 2.69Å; E619-R621 PolarHBondContact OE2-NE 3.34Å; E619-R621 IonicContact OE2-NE 3.79Å; E619-R621 IonicContact OE2-CZ 2.71Å; E619-R621 PolarHBondContact OE1-NH2 3.47Å; E619-R621 PolarHBondContact OE1-NE 3.29Å; E619-R621 IonicContact OE1-NE 2.69Å; E619-R621 IonicContact OE1-CZ 2.83Å; E619-R621 HydrophobicContact CG-CG 4.31Å; E619-R621 VanDerWaalsContact CD-NH2 3.33Å; E619-R621 IonicContact OE1-NH2 3.23Å; E619-Q635 HydrophobicContact CB-CB 4.1Å; E619-Q635 PolarHBondContact N-O 3.45Å; E619-Q635 PolarHBondContact O-N 3.1Å
620	L	91.5	Very high	86.3	Confident	9 Å²	9	64 Å²	64	5%	0.047	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	127.9	170.2	-175.5	154.5	0	0	0	109.2	L591 C609 V610 M613 L622 V632 V633 L634	L591-L620 HydrophobicContact CD1-CD2 4.19Å; L591-L620 HydrophobicContact CD2-CD2 3.4Å; L591-L620 VanDerWaalsContact CD2-CD2 3.4Å; L591-L620 HydrophobicContact CG-CD2 4.46Å; C609-L620 HydrophobicContact CB-CD1 3.33Å; V610-L620 HydrophobicContact CG2-CB 4.17Å; V610-L620 HydrophobicContact CG2-CD2 4.06Å; M613-L620 HydrophobicContact CB-CB 4.45Å; M613-L620 HydrophobicContact CG-CB 4.1Å; L620-L622 HydrophobicContact CD2-CD2 4.2Å; L620-V632 HydrophobicContact CD1-CG1 4.12Å; L620-V632 HydrophobicContact CD2-CG1 4.28Å; L620-V632 HydrophobicContact CG-CG1 4.03Å; L620-V633 CarbonylContact C-O 3.51Å; L620-V633 WeakPolarHBondContact CA-O 3.44Å; L620-L634 HydrophobicContact CB-CD2 4.25Å; L620-L634 HydrophobicContact CD1-CD2 3.6Å; L620-L634 HydrophobicContact CG-CD2 3.79Å
621	R	91.2	Very high	86.8	Confident	105 Å²	105	63.1 Å²	63.1	40%	0.396	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	157.4	176.5	-56.7	178	177.5	160.5	5	110.7	E619 V633	E619-R621 PolarHBondContact OE2-NH2 3.06Å; E619-R621 IonicContact OE2-NH2 2.69Å; E619-R621 PolarHBondContact OE2-NE 3.34Å; E619-R621 IonicContact OE2-NE 3.79Å; E619-R621 IonicContact OE2-CZ 2.71Å; E619-R621 PolarHBondContact OE1-NH2 3.47Å; E619-R621 PolarHBondContact OE1-NE 3.29Å; E619-R621 IonicContact OE1-NE 2.69Å; E619-R621 IonicContact OE1-CZ 2.83Å; E619-R621 HydrophobicContact CG-CG 4.31Å; E619-R621 VanDerWaalsContact CD-NH2 3.33Å; E619-R621 IonicContact OE1-NH2 3.23Å; R621-V633 HydrophobicContact CB-CB 4.2Å; R621-V633 PolarHBondContact N-O 3.27Å; R621-V633 PolarHBondContact O-N 3.43Å
622	L	90.4	Very high	87.6	Confident	43 Å²	43	61.9 Å²	61.9	23%	0.225	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	135.9	172.3	-55	179.4	0	0	0	108.7	W582 L590 L591 L606 L620 V632	W582-L622 HydrophobicContact CH2-CD2 3.8Å; W582-L622 HydrophobicContact CZ2-CB 4.38Å; W582-L622 HydrophobicContact CZ2-CD2 3.65Å; W582-L622 HydrophobicContact CZ2-CG 4.47Å; W582-L622 HydrophobicContact CZ3-CD2 4.48Å; L590-L622 HydrophobicContact CB-CD1 3.5Å; L590-L622 VanDerWaalsContact CB-CD1 3.5Å; L590-L622 HydrophobicContact CD1-CD1 3.81Å; L590-L622 HydrophobicContact CG-CD1 4.31Å; L591-L622 HydrophobicContact CD1-CG 4.38Å; L591-L622 HydrophobicContact CD2-CD1 3.87Å; L591-L622 HydrophobicContact CD2-CD2 3.86Å; L591-L622 HydrophobicContact CD2-CG 3.84Å; L591-L622 HydrophobicContact CG-CD1 3.95Å; L591-L622 HydrophobicContact CG-CG 4.12Å; L606-L622 HydrophobicContact CD1-CD2 4.42Å; L620-L622 HydrophobicContact CD2-CD2 4.2Å; L622-V632 HydrophobicContact CD2-CG2 4.26Å
623	A	90.3	Very high	88.3	Confident	34 Å²	34	61.5 Å²	61.5	28%	0.281	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	170.1	176.6	0	0	0	0	0	109.2	W582 C631 V633	W582-A623 PolarHBondContact NE1-O 3.27Å; A623-C631 PolarHBondContact O-N 3.24Å; A623-C631 WeakPolarHBondContact O-CB 3.45Å; A623-C631 PolarHBondContact N-O 3.2Å; A623-C631 WeakPolarHBondContact O-CA 3.49Å; A623-C631 HydrophobicContact CB-CB 4.16Å; A623-C631 CarbonylContact C-O 3.47Å; A623-C631 CarbonylContact O-C 3.59Å; A623-V633 HydrophobicContact CB-CG2 3.74Å
624	S	89.1	Confident	88.6	Confident	72 Å²	72	61.5 Å²	61.5	50%	0.503	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	147.3	170.4	-59.1	0	0	0	0	109.7	N629	S624-N629 CarbonylContact C-O 3.58Å; S624-N629 VanDerWaalsContact CA-O 3.26Å; S624-N629 WeakPolarHBondContact CA-O 3.47Å
625	T	86.3	Confident	89	Confident	38 Å²	38	57 Å²	57	23%	0.233	29%	0.286	C	S	.	.			trans	-67.9	167.1	169.9	67.5	0	0	0	0	110.2	T627 R628 N629 C631	T625-T627 PolarHBondContact O-N 3.33Å; T625-T627 VanDerWaalsContact O-N 3.16Å; T625-T627 PolarHBondContact OG1-OG1 2.95Å; T625-T627 VanDerWaalsContact OG1-OG1 3.07Å; T625-R628 WeakPolarHBondContact O-CA 3.46Å; T625-R628 PolarHBondContact O-N 3.03Å; T625-N629 VanDerWaalsContact OG1-OD1 3.06Å; T625-N629 PolarHBondContact OG1-OD1 2.84Å; T625-N629 PolarHBondContact OG1-N 2.87Å; T625-N629 WeakPolarHBondContact OG1-CA 3.48Å; T625-N629 PolarHBondContact N-O 2.87Å; T625-N629 HydrophobicContact CG2-CB 4.2Å; T625-N629 WeakPolarHBondContact OG1-CB 3.43Å; T625-C631 HydrophobicContact CG2-CB 4.21Å
626	M	83.3	Confident	89.6	Confident	198 Å²	198	53.4 Å²	53.4	98%	0.975	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-25.9	176.7	-65.2	-63.7	170.9	0	0	112.8	R628	M626-R628 VanDerWaalsContact C-N 3.29Å
627	T	85.4	Confident	89.6	Confident	108 Å²	108	59.6 Å²	59.6	66%	0.663	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	11.9	175.2	42.3	0	0	0	0	113.2	T625 N629	T625-T627 PolarHBondContact O-N 3.33Å; T625-T627 VanDerWaalsContact O-N 3.16Å; T625-T627 PolarHBondContact OG1-OG1 2.95Å; T625-T627 VanDerWaalsContact OG1-OG1 3.07Å; T627-N629 VanDerWaalsContact C-N 3.28Å; T627-N629 VanDerWaalsContact CB-OD1 3.3Å; T627-N629 WeakPolarHBondContact CB-OD1 3.42Å; T627-N629 PolarHBondContact O-N 3.34Å; T627-N629 PolarHBondContact OG1-OD1 3.13Å
628	R	84.8	Confident	89.3	Confident	199 Å²	199	56.1 Å²	56.1	75%	0.751	28%	0.28	S	S	*	.	S	Bend	trans	65.7	15.4	-179.6	-57.8	-174.4	175.2	-163.8	-1.6	115.9	G581 T625 M626	G581-R628 WeakPolarHBondContact CA-O 3.44Å; T625-R628 WeakPolarHBondContact O-CA 3.46Å; T625-R628 PolarHBondContact O-N 3.03Å; M626-R628 VanDerWaalsContact C-N 3.29Å
629	N	89.4	Confident	88.5	Confident	30 Å²	30	57.7 Å²	57.7	16%	0.16	29%	0.287	C	S	.	.			trans	-74	166.7	170.7	-43.7	94.8	0	0	0	110.8	D577 N578 G579 S624 T625 T627	D577-N629 WeakPolarHBondContact O-CB 3.48Å; N578-N629 VanDerWaalsContact C-ND2 3.34Å; G579-N629 WeakPolarHBondContact O-CB 3.35Å; G579-N629 PolarHBondContact O-ND2 2.89Å; S624-N629 CarbonylContact C-O 3.58Å; S624-N629 VanDerWaalsContact CA-O 3.26Å; S624-N629 WeakPolarHBondContact CA-O 3.47Å; T625-N629 VanDerWaalsContact OG1-OD1 3.06Å; T625-N629 PolarHBondContact OG1-OD1 2.84Å; T625-N629 PolarHBondContact OG1-N 2.87Å; T625-N629 WeakPolarHBondContact OG1-CA 3.48Å; T625-N629 PolarHBondContact N-O 2.87Å; T625-N629 HydrophobicContact CG2-CB 4.2Å; T625-N629 WeakPolarHBondContact OG1-CB 3.43Å; T627-N629 VanDerWaalsContact C-N 3.28Å; T627-N629 VanDerWaalsContact CB-OD1 3.3Å; T627-N629 WeakPolarHBondContact CB-OD1 3.42Å; T627-N629 PolarHBondContact O-N 3.34Å; T627-N629 PolarHBondContact OG1-OD1 3.13Å
630	A	90.5	Very high	86.9	Confident	4 Å²	4	60.5 Å²	60.5	3%	0.033	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	141.4	-176.4	0	0	0	0	0	110.3	G576 D577 W582	G576-A630 WeakPolarHBondContact CA-O 3.32Å; D577-A630 PolarHBondContact N-O 3.34Å; D577-A630 PolarHBondContact OD1-N 3.39Å; D577-A630 WeakPolarHBondContact OD2-CB 3.46Å; W582-A630 HydrophobicContact CD2-CB 3.8Å; W582-A630 HydrophobicContact CE3-CB 4.17Å; W582-A630 HydrophobicContact CG-CB 4.32Å; W582-A630 HydrophobicContact CH2-CB 4.07Å; W582-A630 HydrophobicContact CZ2-CB 3.68Å; W582-A630 HydrophobicContact CZ3-CB 4.3Å
631	C	93.2	Very high	85	Confident	9 Å²	9	65.9 Å²	65.9	6%	0.061	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	126.5	176.2	179.5	0	0	0	0	109.8	I575 A623 T625	I575-C631 WeakPolarHBondContact O-CA 3.41Å; A623-C631 PolarHBondContact O-N 3.24Å; A623-C631 WeakPolarHBondContact O-CB 3.45Å; A623-C631 PolarHBondContact N-O 3.2Å; A623-C631 WeakPolarHBondContact O-CA 3.49Å; A623-C631 HydrophobicContact CB-CB 4.16Å; A623-C631 CarbonylContact C-O 3.47Å; A623-C631 CarbonylContact O-C 3.59Å; T625-C631 HydrophobicContact CG2-CB 4.21Å
632	V	93.8	Very high	82.6	Confident	9 Å²	9	69.6 Å²	69.6	6%	0.055	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	129.5	172.4	179.6	0	0	0	0	108.3	V546 I575 W582 L606 L620 L622 L634	V546-V632 HydrophobicContact CG1-CB 3.95Å; V546-V632 HydrophobicContact CG1-CG1 4.3Å; V546-V632 HydrophobicContact CG1-CG2 4Å; V546-V632 HydrophobicContact CG2-CG1 4.09Å; I575-V632 PolarHBondContact N-O 3.13Å; I575-V632 PolarHBondContact O-N 3.08Å; W582-V632 HydrophobicContact CH2-CG2 3.75Å; W582-V632 HydrophobicContact CZ2-CG2 3.81Å; L606-V632 HydrophobicContact CD2-CG2 4.33Å; L620-V632 HydrophobicContact CD1-CG1 4.12Å; L620-V632 HydrophobicContact CD2-CG1 4.28Å; L620-V632 HydrophobicContact CG-CG1 4.03Å; L622-V632 HydrophobicContact CD2-CG2 4.26Å; V632-L634 HydrophobicContact CG1-CD2 3.89Å; V632-L634 HydrophobicContact CG1-CG 4.43Å
633	V	94.3	Very high	80	Confident	11 Å²	11	74.7 Å²	74.7	7%	0.067	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	116.6	178.3	-171.3	0	0	0	0	109.1	N572 I573 F574 L620 R621 A623	N572-V633 HydrophobicContact CB-CG1 4.09Å; I573-V633 CarbonylContact O-C 3.49Å; I573-V633 VanDerWaalsContact O-CA 3.25Å; I573-V633 WeakPolarHBondContact O-CA 3.31Å; F574-V633 HydrophobicContact CD1-CB 4.48Å; F574-V633 HydrophobicContact CD1-CG1 4.19Å; F574-V633 HydrophobicContact CD1-CG2 3.61Å; F574-V633 HydrophobicContact CE1-CG1 3.94Å; F574-V633 HydrophobicContact CE1-CG2 3.78Å; F574-V633 HydrophobicContact CZ-CG1 4.25Å; L620-V633 CarbonylContact C-O 3.51Å; L620-V633 WeakPolarHBondContact CA-O 3.44Å; R621-V633 HydrophobicContact CB-CB 4.2Å; R621-V633 PolarHBondContact N-O 3.27Å; R621-V633 PolarHBondContact O-N 3.43Å; A623-V633 HydrophobicContact CB-CG2 3.74Å
634	L	94.9	Very high	77.8	Confident	0 Å²	0	76 Å²	76	0%	0	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	117.9	174.8	-51.3	176.7	0	0	0	108.9	V542 L543 N572 I573 I575 M613 L620 V632 F636	V542-L634 HydrophobicContact CG1-CD1 3.7Å; V542-L634 HydrophobicContact CG1-CD2 3.87Å; V542-L634 HydrophobicContact CG1-CG 4.46Å; L543-L634 HydrophobicContact CD2-CD1 4.04Å; N572-L634 CarbonylContact C-O 3.47Å; N572-L634 WeakPolarHBondContact CA-O 3.25Å; I573-L634 HydrophobicContact CB-CB 4.22Å; I573-L634 PolarHBondContact N-O 3.47Å; I573-L634 PolarHBondContact O-N 3.2Å; I575-L634 HydrophobicContact CD1-CD1 3.78Å; I575-L634 HydrophobicContact CD1-CG 4.35Å; M613-L634 HydrophobicContact CE-CB 4.04Å; M613-L634 HydrophobicContact CG-CD2 4.37Å; M613-L634 HydrophobicContact SD-CB 4.48Å; M613-L634 HydrophobicContact SD-CD2 4.36Å; L620-L634 HydrophobicContact CB-CD2 4.25Å; L620-L634 HydrophobicContact CD1-CD2 3.6Å; L620-L634 HydrophobicContact CG-CD2 3.79Å; V632-L634 HydrophobicContact CG1-CD2 3.89Å; V632-L634 HydrophobicContact CG1-CG 4.43Å; L634-F636 HydrophobicContact CB-CD2 4.33Å; L634-F636 HydrophobicContact CB-CE2 3.77Å; L634-F636 HydrophobicContact CD1-CE2 4.41Å
635	Q	93.2	Very high	75	Confident	31 Å²	31	85.2 Å²	85.2	15%	0.145	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	123.2	175.9	-179.5	172.7	93.3	0	0	110.1	T570 L571 N572 M613 G618 E619	T570-Q635 HydrophobicContact CG2-CG 4.23Å; L571-Q635 CarbonylContact O-C 3.55Å; L571-Q635 WeakPolarHBondContact O-CA 3.43Å; N572-Q635 WeakPolarHBondContact OD1-CB 3.47Å; N572-Q635 WeakPolarHBondContact OD1-CG 3.33Å; N572-Q635 PolarHBondContact OD1-NE2 3.2Å; M613-Q635 WeakPolarHBondContact CE-O 3.22Å; G618-Q635 CarbonylContact C-O 3.42Å; G618-Q635 WeakPolarHBondContact CA-O 3.5Å; E619-Q635 HydrophobicContact CB-CB 4.1Å; E619-Q635 PolarHBondContact N-O 3.45Å; E619-Q635 PolarHBondContact O-N 3.1Å
636	F	91.7	Very high	74.4	Confident	2 Å²	2	87.6 Å²	87.6	1%	0.009	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	160.9	173	-69.5	-93.7	0	0	0	111	V532 T539 T570 L571 I573 M613 M616 L634	V532-F636 HydrophobicContact CB-CB 3.6Å; V532-F636 HydrophobicContact CB-CD1 4.12Å; V532-F636 HydrophobicContact CB-CG 3.91Å; V532-F636 HydrophobicContact CG1-CB 3.52Å; V532-F636 HydrophobicContact CG1-CD2 4.35Å; V532-F636 HydrophobicContact CG1-CG 3.96Å; V532-F636 HydrophobicContact CG2-CB 4.22Å; V532-F636 HydrophobicContact CG2-CD1 3.84Å; V532-F636 HydrophobicContact CG2-CD2 4.48Å; V532-F636 HydrophobicContact CG2-CE1 4.3Å; V532-F636 HydrophobicContact CG2-CG 3.94Å; T539-F636 HydrophobicContact CG2-CZ 4.32Å; T570-F636 CarbonylContact C-O 3.51Å; T570-F636 WeakPolarHBondContact CA-O 3.48Å; T570-F636 WeakPolarHBondContact CB-O 3.49Å; L571-F636 PolarHBondContact N-O 3.43Å; L571-F636 PolarHBondContact O-N 3.23Å; I573-F636 HydrophobicContact CD1-CD2 3.71Å; I573-F636 HydrophobicContact CD1-CE2 3.6Å; I573-F636 HydrophobicContact CG1-CD2 4.38Å; M613-F636 HydrophobicContact CE-CD1 4.07Å; M613-F636 HydrophobicContact CE-CD2 3.85Å; M613-F636 HydrophobicContact CE-CE1 3.83Å; M613-F636 HydrophobicContact CE-CE2 3.58Å; M613-F636 HydrophobicContact CE-CG 4.09Å; M613-F636 HydrophobicContact CE-CZ 3.58Å; M613-F636 HydrophobicContact SD-CE1 3.84Å; M613-F636 HydrophobicContact SD-CE2 3.94Å; M613-F636 HydrophobicContact SD-CZ 3.43Å; M613-F636 WeakPolarHBondContact SD-CZ 3.47Å; M616-F636 HydrophobicContact CE-CE1 3.74Å; M616-F636 HydrophobicContact CE-CZ 4.21Å; M616-F636 HydrophobicContact SD-CE1 4.15Å; L634-F636 HydrophobicContact CB-CD2 4.33Å; L634-F636 HydrophobicContact CB-CE2 3.77Å; L634-F636 HydrophobicContact CD1-CE2 4.41Å
637	R	84.6	Confident	73.9	Confident	132 Å²	132	81.8 Å²	81.8	50%	0.498	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	142.5	167.2	-66.3	-175.3	-174.2	-166.9	-1.5	110.4	S533 K617	S533-R637 PolarHBondContact N-O 3.31Å; K617-R637 PolarHBondContact O-NE 3.49Å
638	L	80.2	Confident	73.3	Confident	56 Å²	56	80.3 Å²	80.3	29%	0.293	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-71.5	146.1	171.1	-69.2	167.6	0	0	0	110.3	M566 K569 L571	M566-L638 HydrophobicContact CE-CD1 4.02Å; M566-L638 HydrophobicContact CE-CD2 4.08Å; M566-L638 HydrophobicContact CG-CD1 3.92Å; M566-L638 HydrophobicContact SD-CD1 3.91Å; K569-L638 PolarHBondContact O-N 3.03Å; L571-L638 HydrophobicContact CB-CD2 4.17Å
639	T	69.8	Low	72.6	Confident	44 Å²	44	73.4 Å²	73.4	27%	0.27	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-83.4	128.1	170.1	-47.5	0	0	0	0	108.7	A498 S533 V641	A498-T639 HydrophobicContact CB-CG2 4.46Å; S533-T639 PolarHBondContact N-OG1 3.33Å; T639-V641 PolarHBondContact O-N 3.4Å; T639-V641 VanDerWaalsContact O-N 3.14Å
640	D	57.4	Low	71.6	Confident	137 Å²	137	76.1 Å²	76.1	73%	0.733	39%	0.389	S	S	*	.			trans	-74.9	100.1	173.2	-100.5	-29.5	0	0	0	109.1	E642	D640-E642 VanDerWaalsContact C-N 3.29Å; D640-E642 PolarHBondContact O-N 2.84Å
641	V	51.3	Low	70.3	Confident	121 Å²	121	80.9 Å²	80.9	73%	0.733	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	81.1	173	-176.7	0	0	0	0	109	T639	T639-V641 PolarHBondContact O-N 3.4Å; T639-V641 VanDerWaalsContact O-N 3.14Å
642	E	40.1	Very low	68.7	Low	184 Å²	184	86 Å²	86	86%	0.86	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.5	-28	140.9	-112.1	-174.7	-179.2	0	0	109.5	D640 A644	D640-E642 VanDerWaalsContact C-N 3.29Å; D640-E642 PolarHBondContact O-N 2.84Å; E642-A644 VanDerWaalsContact C-N 3.29Å; E642-A644 PolarHBondContact O-N 3.29Å
643	D	36.8	Very low	66.7	Low	149 Å²	149	91.9 Å²	91.9	80%	0.797	47%	0.467	S	S	*	.	S	Bend	trans	-88.5	70.9	151.2	-74.3	-27.2	0	0	0	108.4
644	A	42.9	Very low	64.5	Low	62 Å²	62	98.7 Å²	98.7	51%	0.512	50%	0.501	S	S	.	.				154.6	128.8	105.8	0	0	0	0	0	111.8	E642	E642-A644 VanDerWaalsContact C-N 3.29Å; E642-A644 PolarHBondContact O-N 3.29Å
645	K	30.5	Very low	61.7	Low	266 Å²	266	107.6 Å²	107.6	100%	1.157	55%	0.546	S	S	*	.			cis	47.6	0	2.6	-96.9	-167.4	172.8	-175.7	0	119.1

Retrieved 645 of 645 residues in 775.3 ms (Link to these results)

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