A0A5K4F5K3_SCHMA Loading...

Protein lifeguard 4

AlphaFold DB , UniProt , Accession A0A5K4F5K3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 258 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	48.3	Very low	62.9	Low	230 Å²	230	120 Å²	120	100%	1.133	62%	0.619	S	S	*	*				0	94.3	0	-158.9	164.3	-174.9	0	0	105.8
2	V	53	Low	63.6	Low	121 Å²	121	124.6 Å²	124.6	73%	0.733	62%	0.623	S	S	*	*			trans	-67.6	126.1	177	179.5	0	0	0	0	106.3	I4	V2-I4 PolarHBondContact O-N 2.97Å
3	P	53.4	Low	64.2	Low	67 Å²	67	120.8 Å²	120.8	44%	0.435	61%	0.61	S	S	.	*			trans	-64.9	125.3	-168.3	23.3	-30.6	0	0	0	109.9	V5 E6	P3-V5 PolarHBondContact O-N 2.97Å; P3-E6 HydrophobicContact CG-CB 4.3Å; P3-E6 HydrophobicContact CG-CG 4.36Å; P3-E6 PolarHBondContact O-N 3.1Å
4	I	61.7	Low	64.8	Low	142 Å²	142	118.4 Å²	118.4	73%	0.728	60%	0.599	S	S	*	*	H	α-helix	trans	-50.2	-27.9	177.7	-65.6	166.4	0	0	0	111.7	V2 N7 A8	V2-I4 PolarHBondContact O-N 2.97Å; I4-N7 PolarHBondContact O-N 3.29Å; I4-A8 PolarHBondContact O-N 2.91Å
5	V	60.6	Low	65.2	Low	105 Å²	105	116.5 Å²	116.5	64%	0.636	60%	0.596	S	S	*	*	H	α-helix	trans	-63.9	-43	177.3	-174.9	0	0	0	0	112.6	P3 N7 A8 E9	P3-V5 PolarHBondContact O-N 2.97Å; V5-N7 VanDerWaalsContact C-N 3.32Å; V5-N7 PolarHBondContact O-N 3.35Å; V5-A8 PolarHBondContact O-N 3.12Å; V5-E9 PolarHBondContact O-N 3.44Å
6	E	60.6	Low	65.4	Low	108 Å²	108	116.9 Å²	116.9	51%	0.505	60%	0.597	S	S	.	*	H	α-helix	trans	-64.6	-38.7	178.3	-98.6	-179.7	154.6	0	0	111.3	P3 E9 W10	P3-E6 HydrophobicContact CG-CB 4.3Å; P3-E6 HydrophobicContact CG-CG 4.36Å; P3-E6 PolarHBondContact O-N 3.1Å; E6-E9 PolarHBondContact O-N 3.3Å; E6-W10 PolarHBondContact O-N 2.72Å
7	N	70	Confident	65.6	Low	102 Å²	102	117.8 Å²	117.8	55%	0.545	60%	0.595	S	S	.	*	H	α-helix	trans	-67.8	-38.9	-178.8	-155	40.7	0	0	0	111.8	I4 V5 W10 E11	I4-N7 PolarHBondContact O-N 3.29Å; V5-N7 VanDerWaalsContact C-N 3.32Å; V5-N7 PolarHBondContact O-N 3.35Å; N7-W10 PolarHBondContact O-N 3.01Å; N7-E11 PolarHBondContact O-N 3.27Å
8	A	71.8	Confident	65.5	Low	46 Å²	46	117.7 Å²	117.7	38%	0.38	59%	0.592	S	S	.	*	H	α-helix	trans	-67.6	-35.5	176.9	0	0	0	0	0	112.9	I4 V5 R12	I4-A8 PolarHBondContact O-N 2.91Å; V5-A8 PolarHBondContact O-N 3.12Å; A8-R12 PolarHBondContact O-N 3.14Å
9	E	71.2	Confident	65.6	Low	106 Å²	106	114.9 Å²	114.9	50%	0.495	58%	0.582	S	S	.	*	H	α-helix	trans	-68.6	-43.5	173.1	-75.1	-166.9	154.8	0	0	112.1	V5 E6 E11 R12 V13	V5-E9 PolarHBondContact O-N 3.44Å; E6-E9 PolarHBondContact O-N 3.3Å; E9-E11 VanDerWaalsContact C-N 3.34Å; E9-E11 PolarHBondContact O-N 3.41Å; E9-R12 PolarHBondContact O-N 3.4Å; E9-V13 WeakPolarHBondContact O-CG2 3.46Å; E9-V13 PolarHBondContact O-N 3.25Å
10	W	67	Low	65.6	Low	168 Å²	168	112.8 Å²	112.8	64%	0.636	57%	0.572	S	S	*	*	H	α-helix	trans	-59.2	-42.5	174.9	-93.9	93.1	0	0	0	112.6	E6 N7 V13 N14	E6-W10 PolarHBondContact O-N 2.72Å; N7-W10 PolarHBondContact O-N 3.01Å; W10-V13 PolarHBondContact O-N 3Å; W10-N14 WeakPolarHBondContact O-CB 3.5Å; W10-N14 PolarHBondContact O-N 3.26Å
11	E	74	Confident	65.3	Low	125 Å²	125	116.5 Å²	116.5	58%	0.584	58%	0.579	S	S	*	*	H	α-helix	trans	-62.7	-47.3	174	-79.8	-174.5	168.1	0	0	111.8	N7 E9 V13 N14 V15	N7-E11 PolarHBondContact O-N 3.27Å; E9-E11 VanDerWaalsContact C-N 3.34Å; E9-E11 PolarHBondContact O-N 3.41Å; E11-V13 VanDerWaalsContact C-N 3.35Å; E11-V13 PolarHBondContact O-N 3.03Å; E11-N14 PolarHBondContact O-N 3.09Å; E11-V15 VanDerWaalsContact O-CG2 3.29Å; E11-V15 WeakPolarHBondContact O-CG2 3.43Å; E11-V15 PolarHBondContact O-N 3.3Å
12	R	71.8	Confident	65.5	Low	175 Å²	175	110.3 Å²	110.3	66%	0.66	55%	0.55	S	S	*	*	H	α-helix	trans	-59.7	-42.9	177.5	-80	-163.6	-65.8	-179.7	0.4	112.4	A8 E9 V15 M16	A8-R12 PolarHBondContact O-N 3.14Å; E9-R12 PolarHBondContact O-N 3.4Å; R12-V15 PolarHBondContact O-N 2.84Å; R12-M16 WeakPolarHBondContact O-CB 3.32Å; R12-M16 PolarHBondContact O-N 3.3Å
13	V	71.2	Confident	65.8	Low	75 Å²	75	112.4 Å²	112.4	46%	0.455	55%	0.545	S	S	.	.	H	α-helix	trans	-65.7	-40.1	178.6	173.5	0	0	0	0	111.3	E9 W10 E11 M16 K17	E9-V13 WeakPolarHBondContact O-CG2 3.46Å; E9-V13 PolarHBondContact O-N 3.25Å; W10-V13 PolarHBondContact O-N 3Å; E11-V13 VanDerWaalsContact C-N 3.35Å; E11-V13 PolarHBondContact O-N 3.03Å; V13-M16 PolarHBondContact O-N 2.9Å; V13-K17 HydrophobicContact CG1-CD 4.41Å; V13-K17 WeakPolarHBondContact O-CB 3.39Å; V13-K17 WeakPolarHBondContact O-CG 3.34Å; V13-K17 PolarHBondContact O-N 3.28Å
14	N	73	Confident	65.8	Low	87 Å²	87	114.1 Å²	114.1	47%	0.465	55%	0.554	S	S	.	*	H	α-helix	trans	-67.8	-41.8	176.8	-84.7	-19.9	0	0	0	112.4	W10 E11 K17 H18	W10-N14 WeakPolarHBondContact O-CB 3.5Å; W10-N14 PolarHBondContact O-N 3.26Å; E11-N14 PolarHBondContact O-N 3.09Å; N14-K17 PolarHBondContact O-N 3.34Å; N14-H18 WeakPolarHBondContact O-CB 3.16Å; N14-H18 PolarHBondContact O-N 2.92Å
15	V	71	Confident	65.4	Low	91 Å²	91	111.5 Å²	111.5	55%	0.552	54%	0.544	S	S	*	.	H	α-helix	trans	-62.1	-45.5	174.5	173.8	0	0	0	0	110.3	E11 R12 K17 H18 V19	E11-V15 VanDerWaalsContact O-CG2 3.29Å; E11-V15 WeakPolarHBondContact O-CG2 3.43Å; E11-V15 PolarHBondContact O-N 3.3Å; R12-V15 PolarHBondContact O-N 2.84Å; V15-K17 PolarHBondContact O-N 2.94Å; V15-H18 PolarHBondContact O-N 3.12Å; V15-H18 VanDerWaalsContact O-N 3.12Å; V15-V19 HydrophobicContact CG1-CG2 4.27Å; V15-V19 WeakPolarHBondContact O-CG2 3.32Å; V15-V19 PolarHBondContact O-N 3.45Å
16	M	68.3	Low	65	Low	123 Å²	123	109.8 Å²	109.8	61%	0.606	54%	0.537	S	S	*	.	H	α-helix	trans	-60.1	-47	178	-158.9	80.3	179.4	0	0	111.5	R12 V13 H18 V19 D20	R12-M16 WeakPolarHBondContact O-CB 3.32Å; R12-M16 PolarHBondContact O-N 3.3Å; V13-M16 PolarHBondContact O-N 2.9Å; M16-H18 VanDerWaalsContact C-N 3.27Å; M16-H18 PolarHBondContact O-N 3.22Å; M16-V19 PolarHBondContact O-N 2.9Å; M16-D20 WeakPolarHBondContact O-CB 3.45Å; M16-D20 PolarHBondContact O-N 2.81Å
17	K	67.8	Low	64.9	Low	131 Å²	131	108.3 Å²	108.3	57%	0.57	54%	0.535	S	S	*	.	H	α-helix	trans	-59.4	-36.4	174.5	-79.1	179	-179.7	173.3	0	112.6	V13 N14 V15 R21	V13-K17 HydrophobicContact CG1-CD 4.41Å; V13-K17 WeakPolarHBondContact O-CB 3.39Å; V13-K17 WeakPolarHBondContact O-CG 3.34Å; V13-K17 PolarHBondContact O-N 3.28Å; N14-K17 PolarHBondContact O-N 3.34Å; V15-K17 PolarHBondContact O-N 2.94Å; K17-R21 PolarHBondContact O-N 2.05Å
18	H	64.4	Low	64.1	Low	116 Å²	116	108.7 Å²	108.7	54%	0.537	53%	0.53	S	S	.	.	H	α-helix	trans	-71.9	-42.6	178.8	-155.9	76.2	0	0	0	111.8	N14 V15 M16 R21 L22	N14-H18 WeakPolarHBondContact O-CB 3.16Å; N14-H18 PolarHBondContact O-N 2.92Å; V15-H18 PolarHBondContact O-N 3.12Å; V15-H18 VanDerWaalsContact O-N 3.12Å; M16-H18 VanDerWaalsContact C-N 3.27Å; M16-H18 PolarHBondContact O-N 3.22Å; H18-R21 PolarHBondContact O-N 2.75Å; H18-L22 WeakPolarHBondContact O-CG 3.04Å; H18-L22 PolarHBondContact O-N 3.01Å
19	V	68	Low	63.2	Low	66 Å²	66	110.5 Å²	110.5	40%	0.4	54%	0.536	S	S	.	.	H	α-helix	trans	-62.9	-42.6	174.7	173.4	0	0	0	0	111.1	V15 M16 L22 R23	V15-V19 HydrophobicContact CG1-CG2 4.27Å; V15-V19 WeakPolarHBondContact O-CG2 3.32Å; V15-V19 PolarHBondContact O-N 3.45Å; M16-V19 PolarHBondContact O-N 2.9Å; V19-L22 PolarHBondContact O-N 2.79Å; V19-R23 WeakPolarHBondContact O-CB 3.09Å; V19-R23 PolarHBondContact O-N 3.02Å
20	D	66	Low	62.4	Low	72 Å²	72	111.1 Å²	111.1	39%	0.385	54%	0.539	S	S	.	.	H	α-helix	trans	-64.3	-42	176	-75.3	-26.1	0	0	0	111.5	M16 R23 V24	M16-D20 WeakPolarHBondContact O-CB 3.45Å; M16-D20 PolarHBondContact O-N 2.81Å; D20-R23 PolarHBondContact O-N 3.03Å; D20-V24 VanDerWaalsContact O-CG2 3.29Å; D20-V24 WeakPolarHBondContact O-CG2 3.43Å; D20-V24 PolarHBondContact O-N 3.46Å
21	R	57.8	Low	61.9	Low	190 Å²	190	104.7 Å²	104.7	72%	0.717	52%	0.518	S	S	*	.	H	α-helix	trans	-59.8	-46.3	172.1	-86.2	-170.6	-169.9	174.9	4.5	112.1	K17 H18 R23 V24 V25	K17-R21 PolarHBondContact O-N 2.05Å; H18-R21 PolarHBondContact O-N 2.75Å; R21-R23 VanDerWaalsContact C-N 3.31Å; R21-R23 PolarHBondContact O-N 2.99Å; R21-V24 PolarHBondContact O-N 3.24Å; R21-V25 WeakPolarHBondContact O-CB 3.4Å; R21-V25 VanDerWaalsContact O-CG2 3.28Å; R21-V25 WeakPolarHBondContact O-CG2 3.29Å; R21-V25 PolarHBondContact O-N 3.45Å
22	L	54.3	Low	60.8	Low	101 Å²	101	100.8 Å²	100.8	53%	0.529	50%	0.503	S	S	.	.	H	α-helix	trans	-61.7	-40.2	178	-76.7	166.9	0	0	0	111.4	H18 V19 V25 S26	H18-L22 WeakPolarHBondContact O-CG 3.04Å; H18-L22 PolarHBondContact O-N 3.01Å; V19-L22 PolarHBondContact O-N 2.79Å; L22-V25 PolarHBondContact O-N 3.26Å; L22-S26 VanDerWaalsContact O-CB 3.24Å; L22-S26 WeakPolarHBondContact O-CB 3.24Å; L22-S26 PolarHBondContact O-N 3.08Å
23	R	58	Low	59.8	Low	165 Å²	165	97.9 Å²	97.9	62%	0.623	50%	0.5	S	S	*	.	H	α-helix	trans	-63.4	-44.3	175.5	-172.1	-177.2	-67.6	174.1	-0.4	111.6	V19 D20 R21 S26 T27	V19-R23 WeakPolarHBondContact O-CB 3.09Å; V19-R23 PolarHBondContact O-N 3.02Å; D20-R23 PolarHBondContact O-N 3.03Å; R21-R23 VanDerWaalsContact C-N 3.31Å; R21-R23 PolarHBondContact O-N 2.99Å; R23-S26 PolarHBondContact O-N 2.97Å; R23-T27 WeakPolarHBondContact O-CB 3.31Å; R23-T27 PolarHBondContact O-N 2.82Å; R23-T27 PolarHBondContact O-OG1 3.41Å
24	V	54.5	Low	59.2	Low	103 Å²	103	98.6 Å²	98.6	62%	0.624	50%	0.5	S	S	*	.	H	α-helix	trans	-63.3	-44.5	176.7	172.8	0	0	0	0	111	D20 R21 Y28	D20-V24 VanDerWaalsContact O-CG2 3.29Å; D20-V24 WeakPolarHBondContact O-CG2 3.43Å; D20-V24 PolarHBondContact O-N 3.46Å; R21-V24 PolarHBondContact O-N 3.24Å; V24-Y28 VanDerWaalsContact O-CB 3.3Å; V24-Y28 WeakPolarHBondContact O-CB 3.28Å; V24-Y28 PolarHBondContact O-N 3.23Å
25	V	53	Low	58.2	Low	87 Å²	87	95 Å²	95	53%	0.527	48%	0.481	S	S	.	.	H	α-helix	trans	-65	-42.8	177.1	172.5	0	0	0	0	111.5	R21 L22 Y28 T29	R21-V25 WeakPolarHBondContact O-CB 3.4Å; R21-V25 VanDerWaalsContact O-CG2 3.28Å; R21-V25 WeakPolarHBondContact O-CG2 3.29Å; R21-V25 PolarHBondContact O-N 3.45Å; L22-V25 PolarHBondContact O-N 3.26Å; V25-Y28 PolarHBondContact O-N 3.36Å; V25-T29 WeakPolarHBondContact O-CB 3.42Å; V25-T29 PolarHBondContact O-N 3.34Å; V25-T29 PolarHBondContact O-OG1 3.36Å
26	S	52.3	Low	57.3	Low	69 Å²	69	93.3 Å²	93.3	48%	0.483	47%	0.471	S	S	.	.	H	α-helix	trans	-62	-49.3	177	-173.6	0	0	0	0	111.5	L22 R23 Y28 T29 E30	L22-S26 VanDerWaalsContact O-CB 3.24Å; L22-S26 WeakPolarHBondContact O-CB 3.24Å; L22-S26 PolarHBondContact O-N 3.08Å; R23-S26 PolarHBondContact O-N 2.97Å; S26-Y28 VanDerWaalsContact C-N 3.29Å; S26-Y28 PolarHBondContact O-N 2.92Å; S26-T29 PolarHBondContact O-N 3.5Å; S26-E30 PolarHBondContact O-N 2.93Å
27	T	57.7	Low	56.8	Low	76 Å²	76	90.9 Å²	90.9	47%	0.466	46%	0.463	S	S	.	.	H	α-helix	trans	-61	-40.1	178.3	-49	0	0	0	0	111.2	R23 T31	R23-T27 WeakPolarHBondContact O-CB 3.31Å; R23-T27 PolarHBondContact O-N 2.82Å; R23-T27 PolarHBondContact O-OG1 3.41Å; T27-T31 WeakPolarHBondContact O-CB 3.39Å; T27-T31 PolarHBondContact O-N 3.19Å; T27-T31 PolarHBondContact O-OG1 2.87Å
28	Y	53.7	Low	56.4	Low	111 Å²	111	88.5 Å²	88.5	44%	0.435	46%	0.455	S	S	.	.	H	α-helix	trans	-62.9	-43.2	174.1	-178.1	-99.8	0	0	0	111.7	V24 V25 S26 T31 V32 P94	V24-Y28 VanDerWaalsContact O-CB 3.3Å; V24-Y28 WeakPolarHBondContact O-CB 3.28Å; V24-Y28 PolarHBondContact O-N 3.23Å; V25-Y28 PolarHBondContact O-N 3.36Å; S26-Y28 VanDerWaalsContact C-N 3.29Å; S26-Y28 PolarHBondContact O-N 2.92Å; Y28-T31 WeakPolarHBondContact O-CB 3.47Å; Y28-T31 PolarHBondContact O-N 3.43Å; Y28-V32 HydrophobicContact CD1-CG2 4.17Å; Y28-V32 HydrophobicContact CE1-CG2 3.8Å; Y28-V32 HydrophobicContact CE2-CG2 4.16Å; Y28-V32 WeakPolarHBondContact O-CB 3.36Å; Y28-V32 VanDerWaalsContact O-CG2 3.22Å; Y28-V32 WeakPolarHBondContact O-CG2 3.25Å; Y28-V32 PolarHBondContact O-N 3.39Å; Y28-P94 HydrophobicContact CE2-CG 3.81Å
29	T	52.8	Low	56	Low	83 Å²	83	84.5 Å²	84.5	51%	0.509	44%	0.437	S	S	.	.	H	α-helix	trans	-67.1	-46.4	-178.6	-54.6	0	0	0	0	111.5	V25 S26 T31 V32 L33	V25-T29 WeakPolarHBondContact O-CB 3.42Å; V25-T29 PolarHBondContact O-N 3.34Å; V25-T29 PolarHBondContact O-OG1 3.36Å; S26-T29 PolarHBondContact O-N 3.5Å; T29-T31 VanDerWaalsContact C-N 3.31Å; T29-T31 PolarHBondContact O-N 3.46Å; T29-V32 PolarHBondContact O-N 2.98Å; T29-L33 WeakPolarHBondContact O-CB 3.49Å; T29-L33 PolarHBondContact O-N 2.66Å
30	E	54.1	Low	55.3	Low	120 Å²	120	85.7 Å²	85.7	56%	0.561	44%	0.44	S	S	*	.	H	α-helix	trans	-60.5	-42.8	175.8	-172.4	-179.1	176.8	0	0	111.3	S26 L33 I34	S26-E30 PolarHBondContact O-N 2.93Å; E30-L33 WeakPolarHBondContact O-CB 3.43Å; E30-L33 PolarHBondContact O-N 2.9Å; E30-I34 HydrophobicContact CG-CD1 4.3Å; E30-I34 WeakPolarHBondContact O-CG1 3.48Å; E30-I34 PolarHBondContact O-N 3Å
31	T	55.4	Low	55.1	Low	32 Å²	32	87.3 Å²	87.3	20%	0.196	45%	0.448	C	S	.	.	H	α-helix	trans	-61.6	-48.3	176.4	-66.9	0	0	0	0	112.2	T27 Y28 T29 L33 I34 L35 Y93	T27-T31 WeakPolarHBondContact O-CB 3.39Å; T27-T31 PolarHBondContact O-N 3.19Å; T27-T31 PolarHBondContact O-OG1 2.87Å; Y28-T31 WeakPolarHBondContact O-CB 3.47Å; Y28-T31 PolarHBondContact O-N 3.43Å; T29-T31 VanDerWaalsContact C-N 3.31Å; T29-T31 PolarHBondContact O-N 3.46Å; T31-L33 VanDerWaalsContact C-N 3.27Å; T31-L33 PolarHBondContact O-N 2.83Å; T31-I34 PolarHBondContact O-N 2.83Å; T31-L35 HydrophobicContact CG2-CD1 3.91Å; T31-L35 WeakPolarHBondContact O-CG 3.5Å; T31-L35 PolarHBondContact O-N 3.43Å; T31-L35 VanDerWaalsContact O-N 3.08Å; T31-Y93 HydrophobicContact CG2-CD1 3.53Å; T31-Y93 HydrophobicContact CG2-CE1 3.11Å
32	V	51.6	Low	55.3	Low	44 Å²	44	80.8 Å²	80.8	27%	0.267	43%	0.427	S	S	.	.	H	α-helix	trans	-61.5	-40.3	177.9	170.4	0	0	0	0	109.9	Y28 T29 L35 V36 V97	Y28-V32 HydrophobicContact CD1-CG2 4.17Å; Y28-V32 HydrophobicContact CE1-CG2 3.8Å; Y28-V32 HydrophobicContact CE2-CG2 4.16Å; Y28-V32 WeakPolarHBondContact O-CB 3.36Å; Y28-V32 VanDerWaalsContact O-CG2 3.22Å; Y28-V32 WeakPolarHBondContact O-CG2 3.25Å; Y28-V32 PolarHBondContact O-N 3.39Å; T29-V32 PolarHBondContact O-N 2.98Å; V32-L35 PolarHBondContact O-N 3.23Å; V32-V36 HydrophobicContact CG1-CG2 4.33Å; V32-V36 VanDerWaalsContact O-CG2 3.26Å; V32-V36 WeakPolarHBondContact O-CG2 3.46Å; V32-V36 PolarHBondContact O-N 2.86Å; V32-V97 HydrophobicContact CG2-CG2 4.1Å
33	L	50.5	Low	55.2	Low	113 Å²	113	77.5 Å²	77.5	59%	0.592	41%	0.411	S	S	*	.	H	α-helix	trans	-61.6	-48.1	176.7	-173.3	70.4	0	0	0	112.1	T29 E30 T31 L35 V36 V37	T29-L33 WeakPolarHBondContact O-CB 3.49Å; T29-L33 PolarHBondContact O-N 2.66Å; E30-L33 WeakPolarHBondContact O-CB 3.43Å; E30-L33 PolarHBondContact O-N 2.9Å; T31-L33 VanDerWaalsContact C-N 3.27Å; T31-L33 PolarHBondContact O-N 2.83Å; L33-L35 VanDerWaalsContact C-N 3.28Å; L33-L35 PolarHBondContact O-N 2.87Å; L33-V36 PolarHBondContact O-N 3.49Å; L33-V37 WeakPolarHBondContact O-CG2 3.41Å; L33-V37 PolarHBondContact O-N 2.95Å
34	I	58.2	Low	55.1	Low	90 Å²	90	74.1 Å²	74.1	46%	0.462	41%	0.405	S	S	.	.	H	α-helix	trans	-57.4	-43.9	177	-68.7	165.3	0	0	0	110.6	E30 T31 V37 I38	E30-I34 HydrophobicContact CG-CD1 4.3Å; E30-I34 WeakPolarHBondContact O-CG1 3.48Å; E30-I34 PolarHBondContact O-N 3Å; T31-I34 PolarHBondContact O-N 2.83Å; I34-V37 PolarHBondContact O-N 3.2Å; I34-I38 HydrophobicContact CG2-CD1 3.88Å; I34-I38 WeakPolarHBondContact O-CG1 2.94Å; I34-I38 PolarHBondContact O-N 2.95Å
35	L	53.8	Low	55.7	Low	12 Å²	12	75.5 Å²	75.5	6%	0.063	40%	0.403	C	S	.	.	H	α-helix	trans	-67.4	-39.4	-179.9	-71.6	164	0	0	0	111.9	T31 V32 L33 V37 I38 Q39 Y93 V97 I101	T31-L35 HydrophobicContact CG2-CD1 3.91Å; T31-L35 WeakPolarHBondContact O-CG 3.5Å; T31-L35 PolarHBondContact O-N 3.43Å; T31-L35 VanDerWaalsContact O-N 3.08Å; V32-L35 PolarHBondContact O-N 3.23Å; L33-L35 VanDerWaalsContact C-N 3.28Å; L33-L35 PolarHBondContact O-N 2.87Å; L35-V37 VanDerWaalsContact C-N 3.33Å; L35-V37 PolarHBondContact O-N 3.39Å; L35-I38 PolarHBondContact O-N 3.38Å; L35-Q39 VanDerWaalsContact O-CB 3.24Å; L35-Q39 WeakPolarHBondContact O-CB 3.41Å; L35-Q39 PolarHBondContact O-N 2.96Å; L35-Y93 HydrophobicContact CD1-CD1 4.06Å; L35-Y93 HydrophobicContact CD1-CE1 4.16Å; L35-Y93 HydrophobicContact CD1-CG 4.25Å; L35-V97 HydrophobicContact CB-CG1 4.05Å; L35-V97 HydrophobicContact CD1-CB 4.5Å; L35-V97 HydrophobicContact CD1-CG1 3.42Å; L35-V97 VanDerWaalsContact CD1-CG1 3.42Å; L35-V97 HydrophobicContact CG-CG1 4.29Å; L35-I101 HydrophobicContact CB-CD1 4.29Å; L35-I101 HydrophobicContact CD2-CD1 3.84Å; L35-I101 HydrophobicContact CG-CD1 4.48Å
36	V	51.3	Low	56	Low	55 Å²	55	71.8 Å²	71.8	33%	0.333	38%	0.38	S	S	.	.	H	α-helix	trans	-62.3	-40.3	172.7	170.2	0	0	0	0	111.1	V32 L33 Q39 I40	V32-V36 HydrophobicContact CG1-CG2 4.33Å; V32-V36 VanDerWaalsContact O-CG2 3.26Å; V32-V36 WeakPolarHBondContact O-CG2 3.46Å; V32-V36 PolarHBondContact O-N 2.86Å; L33-V36 PolarHBondContact O-N 3.49Å; V36-Q39 WeakPolarHBondContact O-CB 3.16Å; V36-Q39 PolarHBondContact O-N 3.12Å; V36-I40 HydrophobicContact CG1-CD1 3.88Å; V36-I40 HydrophobicContact CG1-CG1 4.48Å; V36-I40 VanDerWaalsContact O-CG1 3.26Å; V36-I40 WeakPolarHBondContact O-CG1 3.32Å; V36-I40 PolarHBondContact O-N 3.08Å
37	V	57.8	Low	56	Low	72 Å²	72	71.5 Å²	71.5	44%	0.436	37%	0.372	S	S	.	.	H	α-helix	trans	-64.6	-48.4	176.3	172.1	0	0	0	0	111.2	L33 I34 L35 Q39 I40 L41	L33-V37 WeakPolarHBondContact O-CG2 3.41Å; L33-V37 PolarHBondContact O-N 2.95Å; I34-V37 PolarHBondContact O-N 3.2Å; L35-V37 VanDerWaalsContact C-N 3.33Å; L35-V37 PolarHBondContact O-N 3.39Å; V37-Q39 VanDerWaalsContact C-N 3.26Å; V37-Q39 PolarHBondContact O-N 3.29Å; V37-I40 PolarHBondContact O-N 2.89Å; V37-L41 HydrophobicContact CG1-CD1 4.21Å; V37-L41 WeakPolarHBondContact O-CG 3.46Å; V37-L41 PolarHBondContact O-N 2.99Å
38	I	58.8	Low	56	Low	81 Å²	81	73.5 Å²	73.5	42%	0.415	38%	0.378	S	S	.	.	H	α-helix	trans	-57.3	-43.2	175.7	-69.2	168	0	0	0	110.5	I34 L35 L41 I42	I34-I38 HydrophobicContact CG2-CD1 3.88Å; I34-I38 WeakPolarHBondContact O-CG1 2.94Å; I34-I38 PolarHBondContact O-N 2.95Å; L35-I38 PolarHBondContact O-N 3.38Å; I38-L41 PolarHBondContact O-N 3.46Å; I38-I42 HydrophobicContact CG2-CD1 3.75Å; I38-I42 HydrophobicContact CG2-CG1 4.38Å; I38-I42 WeakPolarHBondContact O-CG1 3.23Å; I38-I42 PolarHBondContact O-N 3.39Å
39	Q	57.2	Low	56.5	Low	32 Å²	32	70.8 Å²	70.8	15%	0.15	37%	0.371	C	S	.	.	H	α-helix	trans	-60.7	-46.4	176.9	166.3	-179.3	-34.8	0	0	112.4	L35 V36 V37 L41 I42 T43 S104	L35-Q39 VanDerWaalsContact O-CB 3.24Å; L35-Q39 WeakPolarHBondContact O-CB 3.41Å; L35-Q39 PolarHBondContact O-N 2.96Å; V36-Q39 WeakPolarHBondContact O-CB 3.16Å; V36-Q39 PolarHBondContact O-N 3.12Å; V37-Q39 VanDerWaalsContact C-N 3.26Å; V37-Q39 PolarHBondContact O-N 3.29Å; Q39-L41 VanDerWaalsContact C-N 3.28Å; Q39-L41 PolarHBondContact O-N 2.76Å; Q39-I42 PolarHBondContact O-N 3.09Å; Q39-T43 WeakPolarHBondContact O-CB 3.39Å; Q39-T43 PolarHBondContact O-N 3.41Å; Q39-T43 PolarHBondContact O-OG1 3.4Å; Q39-S104 WeakPolarHBondContact CG-OG 3.4Å; Q39-S104 PolarHBondContact NE2-OG 3.44Å; Q39-S104 PolarHBondContact OE1-OG 3.27Å
40	I	53.6	Low	56.8	Low	91 Å²	91	67 Å²	67	47%	0.467	35%	0.348	S	S	.	.	H	α-helix	trans	-59.9	-43.3	176.9	-70.7	164.5	0	0	0	109.7	V36 V37 T43 L44	V36-I40 HydrophobicContact CG1-CD1 3.88Å; V36-I40 HydrophobicContact CG1-CG1 4.48Å; V36-I40 VanDerWaalsContact O-CG1 3.26Å; V36-I40 WeakPolarHBondContact O-CG1 3.32Å; V36-I40 PolarHBondContact O-N 3.08Å; V37-I40 PolarHBondContact O-N 2.89Å; I40-T43 PolarHBondContact O-N 3.41Å; I40-L44 HydrophobicContact CG2-CD1 3.83Å; I40-L44 HydrophobicContact CG2-CG 4.34Å; I40-L44 WeakPolarHBondContact O-CB 3.24Å; I40-L44 VanDerWaalsContact O-CG 3.27Å; I40-L44 WeakPolarHBondContact O-CG 3.32Å; I40-L44 PolarHBondContact O-N 2.93Å
41	L	61.1	Low	56.9	Low	106 Å²	106	64 Å²	64	56%	0.555	34%	0.34	S	S	*	.	H	α-helix	trans	-62.8	-46	177.8	-68.8	172.2	0	0	0	112.6	V37 I38 Q39 T43 L44 F45	V37-L41 HydrophobicContact CG1-CD1 4.21Å; V37-L41 WeakPolarHBondContact O-CG 3.46Å; V37-L41 PolarHBondContact O-N 2.99Å; I38-L41 PolarHBondContact O-N 3.46Å; Q39-L41 VanDerWaalsContact C-N 3.28Å; Q39-L41 PolarHBondContact O-N 2.76Å; L41-T43 VanDerWaalsContact C-N 3.33Å; L41-T43 PolarHBondContact O-N 2.68Å; L41-L44 PolarHBondContact O-N 3.38Å; L41-F45 WeakPolarHBondContact O-CB 3.5Å; L41-F45 PolarHBondContact O-N 2.8Å
42	I	61.3	Low	57.2	Low	53 Å²	53	67.4 Å²	67.4	27%	0.272	36%	0.355	S	S	.	.	H	α-helix	trans	-62.1	-43.6	176.5	-67.7	168	0	0	0	110.4	I38 Q39 F45 I46 I105	I38-I42 HydrophobicContact CG2-CD1 3.75Å; I38-I42 HydrophobicContact CG2-CG1 4.38Å; I38-I42 WeakPolarHBondContact O-CG1 3.23Å; I38-I42 PolarHBondContact O-N 3.39Å; Q39-I42 PolarHBondContact O-N 3.09Å; I42-F45 PolarHBondContact O-N 3.38Å; I42-I46 HydrophobicContact CG2-CD1 3.79Å; I42-I46 HydrophobicContact CG2-CG1 4.39Å; I42-I46 VanDerWaalsContact O-CG1 3.31Å; I42-I46 WeakPolarHBondContact O-CG1 3.33Å; I42-I46 PolarHBondContact O-N 3.38Å; I42-I105 HydrophobicContact CG2-CD1 4.38Å; I42-I105 HydrophobicContact CG2-CG1 4.02Å
43	T	53.3	Low	57.5	Low	32 Å²	32	67.2 Å²	67.2	20%	0.196	35%	0.352	C	S	.	.	H	α-helix	trans	-60.6	-49.1	178.7	-59.5	0	0	0	0	111	Q39 I40 L41 F45 I46 I47 A108	Q39-T43 WeakPolarHBondContact O-CB 3.39Å; Q39-T43 PolarHBondContact O-N 3.41Å; Q39-T43 PolarHBondContact O-OG1 3.4Å; I40-T43 PolarHBondContact O-N 3.41Å; L41-T43 VanDerWaalsContact C-N 3.33Å; L41-T43 PolarHBondContact O-N 2.68Å; T43-F45 VanDerWaalsContact C-N 3.32Å; T43-F45 PolarHBondContact O-N 3.43Å; T43-I46 PolarHBondContact O-N 3.39Å; T43-I47 HydrophobicContact CG2-CD1 3.93Å; T43-I47 VanDerWaalsContact O-CG1 3.29Å; T43-I47 WeakPolarHBondContact O-CG1 3.36Å; T43-I47 PolarHBondContact O-N 2.94Å; T43-A108 HydrophobicContact CG2-CB 3.73Å
44	L	56.2	Low	57.6	Low	94 Å²	94	62.8 Å²	62.8	49%	0.492	34%	0.335	S	S	.	.	H	α-helix	trans	-60.9	-42.1	176.4	-72.6	172	0	0	0	111.3	I40 L41 I47 M48	I40-L44 HydrophobicContact CG2-CD1 3.83Å; I40-L44 HydrophobicContact CG2-CG 4.34Å; I40-L44 WeakPolarHBondContact O-CB 3.24Å; I40-L44 VanDerWaalsContact O-CG 3.27Å; I40-L44 WeakPolarHBondContact O-CG 3.32Å; I40-L44 PolarHBondContact O-N 2.93Å; L41-L44 PolarHBondContact O-N 3.38Å; L44-I47 PolarHBondContact O-N 2.86Å; L44-M48 WeakPolarHBondContact O-CB 3.43Å; L44-M48 VanDerWaalsContact O-CG 3.23Å; L44-M48 WeakPolarHBondContact O-CG 3.2Å; L44-M48 PolarHBondContact O-N 2.81Å
45	F	65.2	Low	57.6	Low	133 Å²	133	63 Å²	63	58%	0.583	34%	0.337	S	S	*	.	H	α-helix	trans	-61.7	-45.2	177.2	-175.6	-99.7	0	0	0	112.1	L41 I42 T43 I47 M48 L49	L41-F45 WeakPolarHBondContact O-CB 3.5Å; L41-F45 PolarHBondContact O-N 2.8Å; I42-F45 PolarHBondContact O-N 3.38Å; T43-F45 VanDerWaalsContact C-N 3.32Å; T43-F45 PolarHBondContact O-N 3.43Å; F45-I47 VanDerWaalsContact C-N 3.35Å; F45-I47 PolarHBondContact O-N 3.27Å; F45-M48 PolarHBondContact O-N 3.47Å; F45-L49 HydrophobicContact CE1-CD1 4.35Å; F45-L49 HydrophobicContact CZ-CD1 4.12Å; F45-L49 WeakPolarHBondContact O-CB 3.42Å; F45-L49 PolarHBondContact O-N 3.38Å
46	I	60.1	Low	57.7	Low	8 Å²	8	68 Å²	68	4%	0.041	36%	0.36	C	S	.	.	H	α-helix	trans	-61.6	-43.6	176.9	-69.6	168.5	0	0	0	110.9	I42 T43 L49 S50 I105 A108 I109 A112	I42-I46 HydrophobicContact CG2-CD1 3.79Å; I42-I46 HydrophobicContact CG2-CG1 4.39Å; I42-I46 VanDerWaalsContact O-CG1 3.31Å; I42-I46 WeakPolarHBondContact O-CG1 3.33Å; I42-I46 PolarHBondContact O-N 3.38Å; T43-I46 PolarHBondContact O-N 3.39Å; I46-L49 PolarHBondContact O-N 2.9Å; I46-S50 VanDerWaalsContact O-CB 3.32Å; I46-S50 WeakPolarHBondContact O-CB 3.31Å; I46-S50 PolarHBondContact O-N 2.86Å; I46-S50 PolarHBondContact O-OG 3.37Å; I46-I105 HydrophobicContact CD1-CG2 4.1Å; I46-A108 HydrophobicContact CB-CB 4.3Å; I46-A108 HydrophobicContact CD1-CB 4.15Å; I46-A108 HydrophobicContact CG2-CB 4.18Å; I46-I109 HydrophobicContact CD1-CG1 4.39Å; I46-I109 HydrophobicContact CG2-CG1 4.18Å; I46-A112 HydrophobicContact CG2-CB 4.09Å
47	I	53.2	Low	57.8	Low	64 Å²	64	67.9 Å²	67.9	33%	0.328	36%	0.355	S	S	.	.	H	α-helix	trans	-63.1	-46.5	177.8	-68.4	167.1	0	0	0	110.5	T43 L44 F45 S50 S51	T43-I47 HydrophobicContact CG2-CD1 3.93Å; T43-I47 VanDerWaalsContact O-CG1 3.29Å; T43-I47 WeakPolarHBondContact O-CG1 3.36Å; T43-I47 PolarHBondContact O-N 2.94Å; L44-I47 PolarHBondContact O-N 2.86Å; F45-I47 VanDerWaalsContact C-N 3.35Å; F45-I47 PolarHBondContact O-N 3.27Å; I47-S50 PolarHBondContact O-N 2.9Å; I47-S51 WeakPolarHBondContact O-CB 3.23Å; I47-S51 PolarHBondContact O-N 2.97Å
48	M	56.8	Low	57.5	Low	118 Å²	118	72.6 Å²	72.6	58%	0.581	37%	0.365	S	S	*	.	H	α-helix	trans	-61.4	-48.1	177.7	-73.4	-65	-67.5	0	0	111.6	L44 F45 S50 S51 I52	L44-M48 WeakPolarHBondContact O-CB 3.43Å; L44-M48 VanDerWaalsContact O-CG 3.23Å; L44-M48 WeakPolarHBondContact O-CG 3.2Å; L44-M48 PolarHBondContact O-N 2.81Å; F45-M48 PolarHBondContact O-N 3.47Å; M48-S50 VanDerWaalsContact C-N 3.3Å; M48-S50 PolarHBondContact O-N 3.32Å; M48-S51 PolarHBondContact O-N 3.4Å; M48-I52 WeakPolarHBondContact O-CG1 3.13Å; M48-I52 PolarHBondContact O-N 2.86Å
49	L	63.6	Low	57.1	Low	54 Å²	54	75 Å²	75	28%	0.283	38%	0.378	S	S	.	.	H	α-helix	trans	-60.1	-43	178.9	-158.2	86.7	0	0	0	111.1	F45 I46 I52 I53 L74	F45-L49 HydrophobicContact CE1-CD1 4.35Å; F45-L49 HydrophobicContact CZ-CD1 4.12Å; F45-L49 WeakPolarHBondContact O-CB 3.42Å; F45-L49 PolarHBondContact O-N 3.38Å; I46-L49 PolarHBondContact O-N 2.9Å; L49-I52 PolarHBondContact O-N 3.32Å; L49-I53 HydrophobicContact CD2-CD1 4.32Å; L49-I53 HydrophobicContact CG-CD1 4.31Å; L49-I53 WeakPolarHBondContact O-CB 3.16Å; L49-I53 VanDerWaalsContact O-CG1 3.25Å; L49-I53 WeakPolarHBondContact O-CG1 3.34Å; L49-I53 PolarHBondContact O-N 3.08Å; L49-L74 HydrophobicContact CD2-CD1 3.56Å; L49-L74 HydrophobicContact CD2-CD2 3.96Å; L49-L74 HydrophobicContact CD2-CG 4.42Å
50	S	59.6	Low	56.7	Low	4 Å²	4	76.8 Å²	76.8	3%	0.028	39%	0.389	C	S	.	.	H	α-helix	trans	-70.4	-32.2	179.3	-54.7	0	0	0	0	112.5	I46 I47 M48 G54 A112	I46-S50 VanDerWaalsContact O-CB 3.32Å; I46-S50 WeakPolarHBondContact O-CB 3.31Å; I46-S50 PolarHBondContact O-N 2.86Å; I46-S50 PolarHBondContact O-OG 3.37Å; I47-S50 PolarHBondContact O-N 2.9Å; M48-S50 VanDerWaalsContact C-N 3.3Å; M48-S50 PolarHBondContact O-N 3.32Å; S50-G54 PolarHBondContact O-N 3.44Å; S50-A112 WeakPolarHBondContact OG-CB 3.47Å
51	S	57.4	Low	56.5	Low	56 Å²	56	78.7 Å²	78.7	39%	0.392	41%	0.41	S	S	.	.	H	α-helix	trans	-67.6	-39	171.9	-174.4	0	0	0	0	111.9	I47 M48 G54 N55	I47-S51 WeakPolarHBondContact O-CB 3.23Å; I47-S51 PolarHBondContact O-N 2.97Å; M48-S51 PolarHBondContact O-N 3.4Å; S51-G54 PolarHBondContact O-N 3.48Å; S51-N55 WeakPolarHBondContact O-CB 3.34Å; S51-N55 PolarHBondContact O-N 3.48Å
52	I	61.1	Low	55.9	Low	103 Å²	103	78.1 Å²	78.1	53%	0.528	41%	0.405	S	S	.	.	H	α-helix	trans	-63.9	-47.8	175.2	-67.3	164.3	0	0	0	109.8	M48 L49 N55 H56	M48-I52 WeakPolarHBondContact O-CG1 3.13Å; M48-I52 PolarHBondContact O-N 2.86Å; L49-I52 PolarHBondContact O-N 3.32Å; I52-N55 PolarHBondContact O-N 3.44Å; I52-H56 WeakPolarHBondContact O-CB 3.26Å; I52-H56 PolarHBondContact O-N 3.24Å
53	I	58.5	Low	55.3	Low	40 Å²	40	79.3 Å²	79.3	21%	0.205	42%	0.416	C	S	.	.	H	α-helix	trans	-56.7	-52.9	174.4	-70.7	167.1	0	0	0	109.4	L49 N55 H56 F57	L49-I53 HydrophobicContact CD2-CD1 4.32Å; L49-I53 HydrophobicContact CG-CD1 4.31Å; L49-I53 WeakPolarHBondContact O-CB 3.16Å; L49-I53 VanDerWaalsContact O-CG1 3.25Å; L49-I53 WeakPolarHBondContact O-CG1 3.34Å; L49-I53 PolarHBondContact O-N 3.08Å; I53-N55 VanDerWaalsContact C-N 3.31Å; I53-N55 PolarHBondContact O-N 3.37Å; I53-H56 PolarHBondContact O-N 2.9Å; I53-F57 HydrophobicContact CG2-CD2 3.66Å; I53-F57 HydrophobicContact CG2-CE2 3.82Å; I53-F57 WeakPolarHBondContact O-CD2 3.24Å; I53-F57 PolarHBondContact O-N 3.32Å
54	G	52.5	Low	55.2	Low	21 Å²	21	81.3 Å²	81.3	22%	0.216	43%	0.425	C	S	.	.	H	α-helix	trans	-54.7	-43.3	179.5	0	0	0	0	0	113.2	S50 S51 R58	S50-G54 PolarHBondContact O-N 3.44Å; S51-G54 PolarHBondContact O-N 3.48Å; G54-R58 WeakPolarHBondContact O-CB 3.49Å; G54-R58 PolarHBondContact O-N 3.47Å; G54-R58 VanDerWaalsContact O-N 3.14Å
55	N	56.7	Low	54.6	Low	94 Å²	94	80.6 Å²	80.6	50%	0.503	43%	0.426	S	S	.	.	H	α-helix	trans	-69.4	-46.8	177.1	-76.3	-9.1	0	0	0	112.4	S51 I52 I53 F57 R58	S51-N55 WeakPolarHBondContact O-CB 3.34Å; S51-N55 PolarHBondContact O-N 3.48Å; I52-N55 PolarHBondContact O-N 3.44Å; I53-N55 VanDerWaalsContact C-N 3.31Å; I53-N55 PolarHBondContact O-N 3.37Å; N55-F57 PolarHBondContact O-N 3.34Å; N55-R58 WeakPolarHBondContact O-CB 3.08Å; N55-R58 PolarHBondContact O-N 3.24Å; N55-R58 VanDerWaalsContact O-N 3.09Å
56	H	57.5	Low	53.8	Low	118 Å²	118	76.9 Å²	76.9	55%	0.546	42%	0.416	S	S	.	.	H	α-helix	trans	-63.3	-30.8	-177.4	-166.4	-63.4	0	0	0	112.3	I52 I53	I52-H56 WeakPolarHBondContact O-CB 3.26Å; I52-H56 PolarHBondContact O-N 3.24Å; I53-H56 PolarHBondContact O-N 2.9Å
57	F	53.2	Low	53.5	Low	52 Å²	52	77.5 Å²	77.5	23%	0.228	42%	0.419	C	S	.	.	H	α-helix	trans	-90.8	-9.9	176.7	-72.7	-74.4	0	0	0	113.9	I53 N55 Q62 I67	I53-F57 HydrophobicContact CG2-CD2 3.66Å; I53-F57 HydrophobicContact CG2-CE2 3.82Å; I53-F57 WeakPolarHBondContact O-CD2 3.24Å; I53-F57 PolarHBondContact O-N 3.32Å; N55-F57 PolarHBondContact O-N 3.34Å; F57-Q62 HydrophobicContact CD1-CB 4.35Å; F57-I67 HydrophobicContact CB-CD1 3.69Å; F57-I67 HydrophobicContact CB-CG1 3.85Å; F57-I67 HydrophobicContact CD1-CD1 4.22Å; F57-I67 HydrophobicContact CD1-CG1 3.64Å; F57-I67 HydrophobicContact CD2-CG1 3.92Å; F57-I67 HydrophobicContact CE1-CG1 4.11Å; F57-I67 HydrophobicContact CE2-CG1 4.41Å; F57-I67 HydrophobicContact CG-CD1 3.97Å; F57-I67 HydrophobicContact CG-CG1 3.54Å; F57-I67 HydrophobicContact CZ-CG1 4.49Å
58	R	49.8	Very low	53.4	Low	171 Å²	171	75.6 Å²	75.6	65%	0.645	41%	0.41	S	S	*	.	H	α-helix	trans	-69.6	-37.5	172.9	-163.6	179.7	74.2	178.5	2.5	111.7	G54 N55	G54-R58 WeakPolarHBondContact O-CB 3.49Å; G54-R58 PolarHBondContact O-N 3.47Å; G54-R58 VanDerWaalsContact O-N 3.14Å; N55-R58 WeakPolarHBondContact O-CB 3.08Å; N55-R58 PolarHBondContact O-N 3.24Å; N55-R58 VanDerWaalsContact O-N 3.09Å
59	D	52	Low	52.8	Low	130 Å²	130	72.3 Å²	72.3	70%	0.695	40%	0.402	S	S	*	.	H	α-helix	trans	-84.2	-23.8	-177.3	-72	-11.7	0	0	0	112.8
60	N	48.9	Very low	52.4	Low	70 Å²	70	71.5 Å²	71.5	37%	0.374	41%	0.406	S	S	.	.	S	Bend	trans	-97.2	121.4	177.3	-76.9	-31.8	0	0	0	109.9	Q62	N60-Q62 HydrophobicContact CB-CB 4.32Å; N60-Q62 HydrophobicContact CB-CG 4.05Å; N60-Q62 PolarHBondContact O-N 2.74Å
61	S	49.7	Very low	52.4	Low	131 Å²	131	71.9 Å²	71.9	92%	0.916	41%	0.408	S	S	*	.			trans	-64.9	30.7	167.9	67.9	0	0	0	0	113.2
62	Q	48.1	Very low	52.2	Low	95 Å²	95	73 Å²	73	44%	0.444	41%	0.406	S	S	.	.			trans	-68.3	145.2	178.9	-84.4	-178	-3.8	0	0	109.7	F57 N60 I64	F57-Q62 HydrophobicContact CD1-CB 4.35Å; N60-Q62 HydrophobicContact CB-CB 4.32Å; N60-Q62 HydrophobicContact CB-CG 4.05Å; N60-Q62 PolarHBondContact O-N 2.74Å; Q62-I64 PolarHBondContact O-N 3.01Å
63	P	47.5	Very low	51.8	Low	78 Å²	78	73.8 Å²	73.8	51%	0.506	41%	0.41	S	S	.	.			trans	-67	130.9	-171.1	30.3	-36.3	0	0	0	109.1	P65 S66	P63-P65 HydrophobicContact CB-CG 3.69Å; P63-P65 HydrophobicContact CG-CG 4.17Å; P63-P65 VanDerWaalsContact O-CD 3.32Å; P63-P65 WeakPolarHBondContact O-CD 3.27Å; P63-S66 PolarHBondContact O-N 2.87Å
64	I	51.9	Low	51.9	Low	74 Å²	74	73.6 Å²	73.6	38%	0.379	41%	0.409	S	S	.	.	H	α-helix	trans	-28.3	-42.5	168.2	-62.6	168	0	0	0	114.1	Q62 S66 I67 V68 Y122	Q62-I64 PolarHBondContact O-N 3.01Å; I64-S66 VanDerWaalsContact C-N 3.33Å; I64-S66 PolarHBondContact O-N 3.47Å; I64-I67 PolarHBondContact O-N 3.4Å; I64-V68 HydrophobicContact CG2-CG2 4.23Å; I64-V68 WeakPolarHBondContact O-CG2 3.42Å; I64-V68 PolarHBondContact O-N 3.33Å; I64-V68 VanDerWaalsContact O-N 3.12Å; I64-Y122 HydrophobicContact CD1-CE2 4.32Å; I64-Y122 HydrophobicContact CG2-CE1 4.49Å; I64-Y122 HydrophobicContact CG2-CE2 4.17Å
65	P	44.1	Very low	52.3	Low	79 Å²	79	73.1 Å²	73.1	51%	0.513	40%	0.402	S	S	.	.	H	α-helix	trans	-55.2	-34.2	174.8	16.7	-33.5	0	0	0	116.2	P63 V68 A69	P63-P65 HydrophobicContact CB-CG 3.69Å; P63-P65 HydrophobicContact CG-CG 4.17Å; P63-P65 VanDerWaalsContact O-CD 3.32Å; P63-P65 WeakPolarHBondContact O-CD 3.27Å; P65-V68 PolarHBondContact O-N 3.08Å; P65-A69 VanDerWaalsContact O-CB 3.29Å; P65-A69 WeakPolarHBondContact O-CB 3.29Å; P65-A69 PolarHBondContact O-N 2.91Å
66	S	47.9	Very low	52	Low	55 Å²	55	71.3 Å²	71.3	39%	0.385	40%	0.4	S	S	.	.	H	α-helix	trans	-68.8	-37.5	179	-67.3	0	0	0	0	112.2	P63 I64 A69 G70	P63-S66 PolarHBondContact O-N 2.87Å; I64-S66 VanDerWaalsContact C-N 3.33Å; I64-S66 PolarHBondContact O-N 3.47Å; S66-A69 PolarHBondContact O-N 2.85Å; S66-G70 PolarHBondContact O-N 2.88Å
67	I	53	Low	52.1	Low	21 Å²	21	72 Å²	72	11%	0.108	40%	0.402	C	S	.	.	H	α-helix	trans	-64.5	-47.7	173.9	-60.3	167.7	0	0	0	109.4	F57 I64 A69 G70 L71	F57-I67 HydrophobicContact CB-CD1 3.69Å; F57-I67 HydrophobicContact CB-CG1 3.85Å; F57-I67 HydrophobicContact CD1-CD1 4.22Å; F57-I67 HydrophobicContact CD1-CG1 3.64Å; F57-I67 HydrophobicContact CD2-CG1 3.92Å; F57-I67 HydrophobicContact CE1-CG1 4.11Å; F57-I67 HydrophobicContact CE2-CG1 4.41Å; F57-I67 HydrophobicContact CG-CD1 3.97Å; F57-I67 HydrophobicContact CG-CG1 3.54Å; F57-I67 HydrophobicContact CZ-CG1 4.49Å; I64-I67 PolarHBondContact O-N 3.4Å; I67-A69 VanDerWaalsContact C-N 3.32Å; I67-A69 PolarHBondContact O-N 3.17Å; I67-G70 PolarHBondContact O-N 3.45Å; I67-L71 VanDerWaalsContact O-CB 3.28Å; I67-L71 WeakPolarHBondContact O-CB 3.48Å; I67-L71 PolarHBondContact O-N 2.88Å
68	V	51.1	Low	52.6	Low	23 Å²	23	70.5 Å²	70.5	14%	0.139	40%	0.397	C	S	.	.	H	α-helix	trans	-60.3	-44.1	178.8	175.3	0	0	0	0	110.2	I64 P65 L71 F72	I64-V68 HydrophobicContact CG2-CG2 4.23Å; I64-V68 WeakPolarHBondContact O-CG2 3.42Å; I64-V68 PolarHBondContact O-N 3.33Å; I64-V68 VanDerWaalsContact O-N 3.12Å; P65-V68 PolarHBondContact O-N 3.08Å; V68-L71 PolarHBondContact O-N 2.94Å; V68-F72 HydrophobicContact CG1-CD2 3.76Å; V68-F72 HydrophobicContact CG1-CE2 3.89Å; V68-F72 WeakPolarHBondContact O-CD2 3.23Å; V68-F72 PolarHBondContact O-N 3.13Å
69	A	45.7	Very low	53.1	Low	50 Å²	50	64.3 Å²	64.3	41%	0.413	38%	0.376	S	S	.	.	H	α-helix	trans	-63.8	-46.9	177.9	0	0	0	0	0	112.5	P65 S66 I67 L71 F72 I73	P65-A69 VanDerWaalsContact O-CB 3.29Å; P65-A69 WeakPolarHBondContact O-CB 3.29Å; P65-A69 PolarHBondContact O-N 2.91Å; S66-A69 PolarHBondContact O-N 2.85Å; I67-A69 VanDerWaalsContact C-N 3.32Å; I67-A69 PolarHBondContact O-N 3.17Å; A69-L71 VanDerWaalsContact C-N 3.26Å; A69-L71 PolarHBondContact O-N 2.66Å; A69-F72 PolarHBondContact O-N 2.91Å; A69-I73 WeakPolarHBondContact O-CG1 3.33Å; A69-I73 PolarHBondContact O-N 3.3Å
70	G	55.4	Low	53.1	Low	36 Å²	36	60.7 Å²	60.7	37%	0.371	36%	0.364	S	S	.	.	H	α-helix	trans	-59.9	-38.9	175.9	0	0	0	0	0	112.2	S66 I67 I73 L74	S66-G70 PolarHBondContact O-N 2.88Å; I67-G70 PolarHBondContact O-N 3.45Å; G70-I73 PolarHBondContact O-N 3.47Å; G70-L74 WeakPolarHBondContact O-CB 3.24Å; G70-L74 PolarHBondContact O-N 3.36Å
71	L	59.1	Low	53.6	Low	13 Å²	13	60.1 Å²	60.1	7%	0.068	36%	0.363	C	S	.	.	H	α-helix	trans	-68.7	-39.2	176.7	-154.9	122	0	0	0	111.9	I67 V68 A69 L74 I75 V113 I116 I126	I67-L71 VanDerWaalsContact O-CB 3.28Å; I67-L71 WeakPolarHBondContact O-CB 3.48Å; I67-L71 PolarHBondContact O-N 2.88Å; V68-L71 PolarHBondContact O-N 2.94Å; A69-L71 VanDerWaalsContact C-N 3.26Å; A69-L71 PolarHBondContact O-N 2.66Å; L71-L74 PolarHBondContact O-N 3.14Å; L71-I75 HydrophobicContact CD2-CD1 3.67Å; L71-I75 HydrophobicContact CG-CD1 4.49Å; L71-I75 WeakPolarHBondContact O-CB 3.42Å; L71-I75 WeakPolarHBondContact O-CG1 3.33Å; L71-I75 PolarHBondContact O-N 3.03Å; L71-V113 HydrophobicContact CD1-CG2 3.87Å; L71-V113 HydrophobicContact CD2-CG2 3.53Å; L71-V113 HydrophobicContact CG-CG2 4.23Å; L71-I116 HydrophobicContact CD1-CD1 3.68Å; L71-I126 HydrophobicContact CD2-CG2 4.02Å
72	F	51.8	Low	54.1	Low	80 Å²	80	54.4 Å²	54.4	35%	0.351	32%	0.322	S	S	.	.	H	α-helix	trans	-63.5	-42.3	172.7	-99.9	-82.4	0	0	0	112.4	V68 A69 I75 A76 I129	V68-F72 HydrophobicContact CG1-CD2 3.76Å; V68-F72 HydrophobicContact CG1-CE2 3.89Å; V68-F72 WeakPolarHBondContact O-CD2 3.23Å; V68-F72 PolarHBondContact O-N 3.13Å; A69-F72 PolarHBondContact O-N 2.91Å; F72-I75 PolarHBondContact O-N 3.41Å; F72-A76 WeakPolarHBondContact O-CB 3.48Å; F72-A76 PolarHBondContact O-N 3.4Å; F72-I129 HydrophobicContact CE2-CD1 4.34Å; F72-I129 HydrophobicContact CZ-CD1 3.8Å
73	I	53.8	Low	54.4	Low	119 Å²	119	52.9 Å²	52.9	61%	0.61	32%	0.319	S	S	*	.	H	α-helix	trans	-63.2	-44.1	175.9	-67.5	166.1	0	0	0	110.1	A69 G70 A76 F77	A69-I73 WeakPolarHBondContact O-CG1 3.33Å; A69-I73 PolarHBondContact O-N 3.3Å; G70-I73 PolarHBondContact O-N 3.47Å; I73-A76 PolarHBondContact O-N 2.84Å; I73-F77 WeakPolarHBondContact O-CB 3.19Å; I73-F77 PolarHBondContact O-N 3.5Å
74	L	60.8	Low	54.9	Low	35 Å²	35	54.2 Å²	54.2	18%	0.183	33%	0.326	C	S	.	.	H	α-helix	trans	-60.5	-46.7	176.5	-177.5	66.8	0	0	0	111.3	L49 G70 L71 F77 V78	L49-L74 HydrophobicContact CD2-CD1 3.56Å; L49-L74 HydrophobicContact CD2-CD2 3.96Å; L49-L74 HydrophobicContact CD2-CG 4.42Å; G70-L74 WeakPolarHBondContact O-CB 3.24Å; G70-L74 PolarHBondContact O-N 3.36Å; L71-L74 PolarHBondContact O-N 3.14Å; L74-F77 PolarHBondContact O-N 3.4Å; L74-V78 WeakPolarHBondContact O-CB 3.47Å; L74-V78 VanDerWaalsContact O-CG2 3.23Å; L74-V78 WeakPolarHBondContact O-CG2 3.29Å; L74-V78 PolarHBondContact O-N 2.93Å
75	I	60.1	Low	55.3	Low	11 Å²	11	54.4 Å²	54.4	6%	0.056	33%	0.327	C	S	.	.	H	α-helix	trans	-60.6	-46.6	176.7	-72	168.1	0	0	0	110.7	L71 F72 F77 V78 I79 I109 L133	L71-I75 HydrophobicContact CD2-CD1 3.67Å; L71-I75 HydrophobicContact CG-CD1 4.49Å; L71-I75 WeakPolarHBondContact O-CB 3.42Å; L71-I75 WeakPolarHBondContact O-CG1 3.33Å; L71-I75 PolarHBondContact O-N 3.03Å; F72-I75 PolarHBondContact O-N 3.41Å; I75-F77 VanDerWaalsContact C-N 3.34Å; I75-F77 PolarHBondContact O-N 2.76Å; I75-V78 PolarHBondContact O-N 3.42Å; I75-I79 HydrophobicContact CG2-CD1 3.74Å; I75-I79 HydrophobicContact CG2-CG1 4.45Å; I75-I79 VanDerWaalsContact O-CG1 3.26Å; I75-I79 WeakPolarHBondContact O-CG1 3.48Å; I75-I79 PolarHBondContact O-N 2.85Å; I75-I109 HydrophobicContact CD1-CG2 4.12Å; I75-I109 HydrophobicContact CG1-CD1 4.47Å; I75-I109 HydrophobicContact CG1-CG2 3.97Å; I75-L133 HydrophobicContact CG2-CD1 3.43Å; I75-L133 VanDerWaalsContact CG2-CD1 3.43Å
76	A	50.9	Low	56.1	Low	57 Å²	57	51 Å²	51	47%	0.471	31%	0.305	S	S	.	.	H	α-helix	trans	-62.1	-41.9	178.8	0	0	0	0	0	111.9	F72 I73 I79 A80	F72-A76 WeakPolarHBondContact O-CB 3.48Å; F72-A76 PolarHBondContact O-N 3.4Å; I73-A76 PolarHBondContact O-N 2.84Å; A76-I79 PolarHBondContact O-N 3.4Å; A76-A80 WeakPolarHBondContact O-CB 3.3Å; A76-A80 PolarHBondContact O-N 2.83Å
77	F	60.2	Low	56.7	Low	133 Å²	133	54.7 Å²	54.7	58%	0.583	31%	0.314	S	S	*	.	H	α-helix	trans	-62.6	-46.6	174.8	179.4	-101.1	0	0	0	111.6	I73 L74 I75 I79 A80 V81	I73-F77 WeakPolarHBondContact O-CB 3.19Å; I73-F77 PolarHBondContact O-N 3.5Å; L74-F77 PolarHBondContact O-N 3.4Å; I75-F77 VanDerWaalsContact C-N 3.34Å; I75-F77 PolarHBondContact O-N 2.76Å; F77-I79 VanDerWaalsContact C-N 3.3Å; F77-I79 PolarHBondContact O-N 3.47Å; F77-A80 PolarHBondContact O-N 3.41Å; F77-V81 HydrophobicContact CD1-CG2 4.22Å; F77-V81 HydrophobicContact CD2-CG2 4.47Å; F77-V81 HydrophobicContact CE1-CG2 3.8Å; F77-V81 HydrophobicContact CE2-CG2 4.06Å; F77-V81 HydrophobicContact CZ-CG2 3.71Å; F77-V81 WeakPolarHBondContact O-CG2 3.35Å; F77-V81 PolarHBondContact O-N 2.79Å
78	V	63.8	Low	57.2	Low	20 Å²	20	61.4 Å²	61.4	12%	0.121	34%	0.343	C	S	.	.	H	α-helix	trans	-60.3	-41.3	176.9	170.1	0	0	0	0	111	L74 I75 L82 I105 I109	L74-V78 WeakPolarHBondContact O-CB 3.47Å; L74-V78 VanDerWaalsContact O-CG2 3.23Å; L74-V78 WeakPolarHBondContact O-CG2 3.29Å; L74-V78 PolarHBondContact O-N 2.93Å; I75-V78 PolarHBondContact O-N 3.42Å; V78-L82 HydrophobicContact CG1-CD1 4.03Å; V78-L82 VanDerWaalsContact O-CB 3.24Å; V78-L82 WeakPolarHBondContact O-CB 3.36Å; V78-L82 PolarHBondContact O-N 3.35Å; V78-I105 HydrophobicContact CG1-CG2 3.35Å; V78-I109 HydrophobicContact CB-CD1 4.46Å; V78-I109 HydrophobicContact CG1-CD1 4.01Å
79	I	58.3	Low	57.8	Low	40 Å²	40	61.7 Å²	61.7	21%	0.205	34%	0.343	C	S	.	.	H	α-helix	trans	-64.3	-44.3	175.2	-69.5	165.8	0	0	0	111.3	I75 A76 F77 L82 V83 F106 L133	I75-I79 HydrophobicContact CG2-CD1 3.74Å; I75-I79 HydrophobicContact CG2-CG1 4.45Å; I75-I79 VanDerWaalsContact O-CG1 3.26Å; I75-I79 WeakPolarHBondContact O-CG1 3.48Å; I75-I79 PolarHBondContact O-N 2.85Å; A76-I79 PolarHBondContact O-N 3.4Å; F77-I79 VanDerWaalsContact C-N 3.3Å; F77-I79 PolarHBondContact O-N 3.47Å; I79-L82 CarbonylContact O-C 3.6Å; I79-L82 WeakPolarHBondContact O-CA 3.23Å; I79-L82 VanDerWaalsContact O-CB 3.31Å; I79-L82 WeakPolarHBondContact O-CB 3.44Å; I79-L82 PolarHBondContact O-N 3.46Å; I79-V83 HydrophobicContact CG2-CG2 4.4Å; I79-V83 WeakPolarHBondContact O-CG2 3.26Å; I79-V83 PolarHBondContact O-N 2.88Å; I79-F106 HydrophobicContact CG1-CZ 4.16Å; I79-L133 HydrophobicContact CD1-CB 4.41Å; I79-L133 HydrophobicContact CD1-CD1 3.97Å; I79-L133 HydrophobicContact CD1-CD2 3.68Å; I79-L133 HydrophobicContact CD1-CG 4.22Å
80	A	52.7	Low	58.4	Low	54 Å²	54	60.6 Å²	60.6	45%	0.446	33%	0.332	S	S	.	.	H	α-helix	trans	-62.7	-46.1	179.3	0	0	0	0	0	111.5	A76 F77 L82 V83 V84	A76-A80 WeakPolarHBondContact O-CB 3.3Å; A76-A80 PolarHBondContact O-N 2.83Å; F77-A80 PolarHBondContact O-N 3.41Å; A80-L82 VanDerWaalsContact C-N 3.29Å; A80-L82 PolarHBondContact O-N 2.9Å; A80-V83 PolarHBondContact O-N 3.28Å; A80-V84 WeakPolarHBondContact O-CG2 3.47Å; A80-V84 PolarHBondContact O-N 3.19Å; A80-V84 VanDerWaalsContact O-N 3.13Å
81	V	60.5	Low	58.7	Low	58 Å²	58	66.2 Å²	66.2	35%	0.352	35%	0.349	S	S	.	.	H	α-helix	trans	-60.5	-42.2	173.8	171.1	0	0	0	0	110.5	F77 V84 L85	F77-V81 HydrophobicContact CD1-CG2 4.22Å; F77-V81 HydrophobicContact CD2-CG2 4.47Å; F77-V81 HydrophobicContact CE1-CG2 3.8Å; F77-V81 HydrophobicContact CE2-CG2 4.06Å; F77-V81 HydrophobicContact CZ-CG2 3.71Å; F77-V81 WeakPolarHBondContact O-CG2 3.35Å; F77-V81 PolarHBondContact O-N 2.79Å; V81-V84 PolarHBondContact O-N 3.4Å; V81-L85 HydrophobicContact CG1-CD1 3.55Å; V81-L85 HydrophobicContact CG1-CG 4.14Å; V81-L85 VanDerWaalsContact O-CB 3.28Å; V81-L85 WeakPolarHBondContact O-CB 3.35Å; V81-L85 WeakPolarHBondContact O-CG 3.5Å; V81-L85 PolarHBondContact O-N 2.9Å
82	L	58.7	Low	58.8	Low	11 Å²	11	73.2 Å²	73.2	6%	0.058	38%	0.379	C	S	.	.	H	α-helix	trans	-57.8	-53.8	173.6	-98.4	161.5	0	0	0	110.9	V78 I79 A80 V84 L85 V86 I102 I105 F106	V78-L82 HydrophobicContact CG1-CD1 4.03Å; V78-L82 VanDerWaalsContact O-CB 3.24Å; V78-L82 WeakPolarHBondContact O-CB 3.36Å; V78-L82 PolarHBondContact O-N 3.35Å; I79-L82 CarbonylContact O-C 3.6Å; I79-L82 WeakPolarHBondContact O-CA 3.23Å; I79-L82 VanDerWaalsContact O-CB 3.31Å; I79-L82 WeakPolarHBondContact O-CB 3.44Å; I79-L82 PolarHBondContact O-N 3.46Å; A80-L82 VanDerWaalsContact C-N 3.29Å; A80-L82 PolarHBondContact O-N 2.9Å; L82-V84 VanDerWaalsContact C-N 3.26Å; L82-V84 PolarHBondContact O-N 2.87Å; L82-L85 PolarHBondContact O-N 2.97Å; L82-V86 HydrophobicContact CD2-CG2 3.79Å; L82-V86 WeakPolarHBondContact O-CA 3.34Å; L82-V86 WeakPolarHBondContact O-CB 3.41Å; L82-V86 WeakPolarHBondContact O-CG2 3.34Å; L82-V86 PolarHBondContact O-N 3.27Å; L82-I102 HydrophobicContact CD2-CG1 3.7Å; L82-I105 HydrophobicContact CD1-CB 4.42Å; L82-I105 HydrophobicContact CD1-CD1 4.08Å; L82-I105 HydrophobicContact CD1-CG2 3.97Å; L82-I105 HydrophobicContact CD2-CD1 3.91Å; L82-I105 HydrophobicContact CG-CD1 4.02Å; L82-F106 HydrophobicContact CD1-CE2 4.21Å
83	V	54.1	Low	59.1	Low	63 Å²	63	72.3 Å²	72.3	38%	0.382	37%	0.373	S	S	.	.	H	α-helix	trans	-55.9	-42.4	-178.8	171.7	0	0	0	0	111.8	I79 A80 K87 I140	I79-V83 HydrophobicContact CG2-CG2 4.4Å; I79-V83 WeakPolarHBondContact O-CG2 3.26Å; I79-V83 PolarHBondContact O-N 2.88Å; A80-V83 PolarHBondContact O-N 3.28Å; V83-K87 WeakPolarHBondContact O-CB 3.48Å; V83-K87 PolarHBondContact O-N 3.36Å; V83-K87 VanDerWaalsContact O-N 3.09Å; V83-I140 HydrophobicContact CG2-CD1 4.21Å
84	V	58.7	Low	59.2	Low	106 Å²	106	69.1 Å²	69.1	64%	0.642	36%	0.36	S	S	*	.	H	α-helix	trans	-67.7	-48.6	178.1	175.6	0	0	0	0	111.7	A80 V81 L82 K88	A80-V84 WeakPolarHBondContact O-CG2 3.47Å; A80-V84 PolarHBondContact O-N 3.19Å; A80-V84 VanDerWaalsContact O-N 3.13Å; V81-V84 PolarHBondContact O-N 3.4Å; L82-V84 VanDerWaalsContact C-N 3.26Å; L82-V84 PolarHBondContact O-N 2.87Å; V84-K88 PolarHBondContact O-N 3.41Å
85	L	61.3	Low	59	Low	79 Å²	79	68.3 Å²	68.3	41%	0.414	36%	0.356	S	S	.	.	H	α-helix	trans	-64.1	-46.9	178.9	-77.8	174.2	0	0	0	111.1	V81 L82 K87 K88 I89	V81-L85 HydrophobicContact CG1-CD1 3.55Å; V81-L85 HydrophobicContact CG1-CG 4.14Å; V81-L85 VanDerWaalsContact O-CB 3.28Å; V81-L85 WeakPolarHBondContact O-CB 3.35Å; V81-L85 WeakPolarHBondContact O-CG 3.5Å; V81-L85 PolarHBondContact O-N 2.9Å; L82-L85 PolarHBondContact O-N 2.97Å; L85-K87 VanDerWaalsContact C-N 3.34Å; L85-K87 PolarHBondContact O-N 3.21Å; L85-K88 CarbonylContact O-C 3.54Å; L85-K88 PolarHBondContact O-N 3Å; L85-K88 VanDerWaalsContact O-N 3.13Å; L85-I89 HydrophobicContact CB-CD1 4.1Å; L85-I89 WeakPolarHBondContact O-CB 3.31Å; L85-I89 WeakPolarHBondContact O-CG1 3.38Å; L85-I89 PolarHBondContact O-N 2.87Å
86	V	60.5	Low	58.6	Low	8 Å²	8	70.4 Å²	70.4	5%	0.048	37%	0.368	C	S	.	.	H	α-helix	trans	-56	-48	179.5	159.2	0	0	0	0	110.3	L82 K88 I89 S90 M98 I102 I144	L82-V86 HydrophobicContact CD2-CG2 3.79Å; L82-V86 WeakPolarHBondContact O-CA 3.34Å; L82-V86 WeakPolarHBondContact O-CB 3.41Å; L82-V86 WeakPolarHBondContact O-CG2 3.34Å; L82-V86 PolarHBondContact O-N 3.27Å; V86-K88 VanDerWaalsContact C-N 3.31Å; V86-K88 PolarHBondContact O-N 3.48Å; V86-I89 PolarHBondContact O-N 3.28Å; V86-S90 WeakPolarHBondContact O-CB 3.35Å; V86-S90 PolarHBondContact O-N 2.93Å; V86-S90 PolarHBondContact O-OG 2.87Å; V86-M98 HydrophobicContact CB-CE 3.79Å; V86-M98 HydrophobicContact CB-SD 3.81Å; V86-M98 HydrophobicContact CG1-CE 3.25Å; V86-M98 HydrophobicContact CG1-SD 3.69Å; V86-M98 HydrophobicContact CG2-CE 3.43Å; V86-M98 VanDerWaalsContact CG2-CE 3.43Å; V86-M98 HydrophobicContact CG2-SD 3.65Å; V86-I102 HydrophobicContact CG2-CD1 4.08Å; V86-I102 HydrophobicContact CG2-CG1 4.28Å; V86-I144 HydrophobicContact CG1-CD1 3.79Å
87	K	60.1	Low	58.9	Low	131 Å²	131	68.4 Å²	68.4	57%	0.57	35%	0.349	S	S	*	.	H	α-helix	trans	-57.8	-45.8	177.7	-175.3	175.8	179.5	177.1	0	111.5	V83 L85 S90	V83-K87 WeakPolarHBondContact O-CB 3.48Å; V83-K87 PolarHBondContact O-N 3.36Å; V83-K87 VanDerWaalsContact O-N 3.09Å; L85-K87 VanDerWaalsContact C-N 3.34Å; L85-K87 PolarHBondContact O-N 3.21Å; K87-S90 PolarHBondContact O-OG 3.46Å
88	K	64.4	Low	58.9	Low	163 Å²	163	62.3 Å²	62.3	71%	0.709	32%	0.323	S	S	*	.	H	α-helix	trans	-71.5	-34.2	-179.5	-164.8	170.8	-175	176.3	0	113	V84 L85 V86	V84-K88 PolarHBondContact O-N 3.41Å; L85-K88 CarbonylContact O-C 3.54Å; L85-K88 PolarHBondContact O-N 3Å; L85-K88 VanDerWaalsContact O-N 3.13Å; V86-K88 VanDerWaalsContact C-N 3.31Å; V86-K88 PolarHBondContact O-N 3.48Å
89	I	62.1	Low	58.7	Low	29 Å²	29	62.7 Å²	62.7	15%	0.149	32%	0.323	C	S	.	.	H	α-helix	trans	-76.6	-39.4	179	-71.7	171.4	0	0	0	109.9	L85 V86 E91 K92 Y93 M98	L85-I89 HydrophobicContact CB-CD1 4.1Å; L85-I89 WeakPolarHBondContact O-CB 3.31Å; L85-I89 WeakPolarHBondContact O-CG1 3.38Å; L85-I89 PolarHBondContact O-N 2.87Å; V86-I89 PolarHBondContact O-N 3.28Å; I89-E91 VanDerWaalsContact C-N 3.25Å; I89-E91 PolarHBondContact O-N 3.06Å; I89-K92 PolarHBondContact O-N 3.4Å; I89-Y93 HydrophobicContact CB-CD2 3.98Å; I89-Y93 HydrophobicContact CG1-CD2 4.32Å; I89-Y93 HydrophobicContact CG1-CE2 4.41Å; I89-Y93 HydrophobicContact CG2-CD2 3.41Å; I89-Y93 VanDerWaalsContact CG2-CD2 3.41Å; I89-Y93 HydrophobicContact CG2-CE2 4.24Å; I89-Y93 HydrophobicContact CG2-CG 4.13Å; I89-Y93 WeakPolarHBondContact O-CB 3.37Å; I89-Y93 VanDerWaalsContact O-CD2 3.23Å; I89-Y93 WeakPolarHBondContact O-CD2 3.44Å; I89-Y93 PolarHBondContact O-N 2.91Å; I89-M98 HydrophobicContact CB-SD 4.21Å; I89-M98 HydrophobicContact CG2-CG 3.83Å; I89-M98 HydrophobicContact CG2-SD 3.8Å
90	S	59.4	Low	58.7	Low	26 Å²	26	64.1 Å²	64.1	18%	0.182	33%	0.333	C	S	.	.	H	α-helix	trans	-65.5	-27.4	-176.9	59.7	0	0	0	0	113.5	V86 K87 K92 I144	V86-S90 WeakPolarHBondContact O-CB 3.35Å; V86-S90 PolarHBondContact O-N 2.93Å; V86-S90 PolarHBondContact O-OG 2.87Å; K87-S90 PolarHBondContact O-OG 3.46Å; S90-K92 PolarHBondContact O-N 3.1Å; S90-I144 WeakPolarHBondContact OG-CG2 3.48Å
91	E	61.4	Low	59.1	Low	155 Å²	155	62.5 Å²	62.5	72%	0.724	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-29.7	173.6	-71.8	173.7	-170.4	0	0	111.9	I89	I89-E91 VanDerWaalsContact C-N 3.25Å; I89-E91 PolarHBondContact O-N 3.06Å
92	K	60.5	Low	59.3	Low	160 Å²	160	59.9 Å²	59.9	70%	0.696	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	-29.7	-172.6	-169.7	173.6	-179.9	-176.5	0	114	I89 S90	I89-K92 PolarHBondContact O-N 3.4Å; S90-K92 PolarHBondContact O-N 3.1Å
93	Y	58.3	Low	59.4	Low	60 Å²	60	60.7 Å²	60.7	24%	0.235	30%	0.303	C	S	.	.	S	Bend	trans	-119.7	148.6	-167.3	-59.1	-67.8	0	0	0	112.3	T31 L35 I89	T31-Y93 HydrophobicContact CG2-CD1 3.53Å; T31-Y93 HydrophobicContact CG2-CE1 3.11Å; L35-Y93 HydrophobicContact CD1-CD1 4.06Å; L35-Y93 HydrophobicContact CD1-CE1 4.16Å; L35-Y93 HydrophobicContact CD1-CG 4.25Å; I89-Y93 HydrophobicContact CB-CD2 3.98Å; I89-Y93 HydrophobicContact CG1-CD2 4.32Å; I89-Y93 HydrophobicContact CG1-CE2 4.41Å; I89-Y93 HydrophobicContact CG2-CD2 3.41Å; I89-Y93 VanDerWaalsContact CG2-CD2 3.41Å; I89-Y93 HydrophobicContact CG2-CE2 4.24Å; I89-Y93 HydrophobicContact CG2-CG 4.13Å; I89-Y93 WeakPolarHBondContact O-CB 3.37Å; I89-Y93 VanDerWaalsContact O-CD2 3.23Å; I89-Y93 WeakPolarHBondContact O-CD2 3.44Å; I89-Y93 PolarHBondContact O-N 2.91Å
94	P	56.2	Low	59.8	Low	53 Å²	53	58.2 Å²	58.2	34%	0.344	29%	0.289	S	S	.	.			trans	-67.9	144.5	176.7	23.7	-27	0	0	0	111.4	Y28 N96 V97	Y28-P94 HydrophobicContact CE2-CG 3.81Å; P94-N96 PolarHBondContact O-N 3.3Å; P94-V97 HydrophobicContact CG-CG2 4.14Å; P94-V97 PolarHBondContact O-N 3.37Å
95	L	56.1	Low	60	Low	18 Å²	18	53.6 Å²	53.6	9%	0.094	26%	0.26	C	S	.	.	H	α-helix	trans	-45.2	-34	178.7	-160.1	85.2	0	0	0	114.2	V97 M98 F99 G141 K145 I213	L95-V97 VanDerWaalsContact C-N 3.3Å; L95-V97 PolarHBondContact O-N 2.91Å; L95-M98 CarbonylContact O-C 3.59Å; L95-M98 WeakPolarHBondContact O-CB 3.45Å; L95-M98 PolarHBondContact O-N 3.48Å; L95-F99 WeakPolarHBondContact O-CB 3.45Å; L95-F99 PolarHBondContact O-N 2.91Å; L95-G141 WeakPolarHBondContact CD1-O 3.13Å; L95-K145 HydrophobicContact CB-CD 3.65Å; L95-K145 HydrophobicContact CD1-CB 3.79Å; L95-K145 HydrophobicContact CD1-CD 3.68Å; L95-K145 HydrophobicContact CD1-CG 4.38Å; L95-K145 HydrophobicContact CD2-CD 4.44Å; L95-K145 HydrophobicContact CG-CD 4.12Å; L95-I213 HydrophobicContact CD1-CG2 4.23Å; L95-I213 HydrophobicContact CD2-CB 4.17Å; L95-I213 HydrophobicContact CD2-CG2 3.45Å; L95-I213 VanDerWaalsContact CD2-CG2 3.45Å; L95-I213 WeakPolarHBondContact CD2-O 3.39Å; L95-I213 HydrophobicContact CG-CG2 4.49Å
96	N	53.5	Low	60.2	Low	55 Å²	55	50 Å²	50	29%	0.294	24%	0.242	S	C	.	.	H	α-helix	trans	-60.5	-40.5	-178.6	-63.7	7.7	0	0	0	111.9	P94 F99 V100 Y218	P94-N96 PolarHBondContact O-N 3.3Å; N96-F99 WeakPolarHBondContact O-CB 3.49Å; N96-F99 PolarHBondContact O-N 3.35Å; N96-V100 WeakPolarHBondContact O-CG2 3.27Å; N96-V100 PolarHBondContact O-N 2.98Å; N96-Y218 PolarHBondContact ND2-OH 3.27Å
97	V	56.6	Low	60.2	Low	14 Å²	14	50.8 Å²	50.8	9%	0.085	25%	0.245	C	C	.	.	H	α-helix	trans	-73.2	-42.6	-179.3	-174.3	0	0	0	0	110.2	V32 L35 P94 L95 F99 V100 I101	V32-V97 HydrophobicContact CG2-CG2 4.1Å; L35-V97 HydrophobicContact CB-CG1 4.05Å; L35-V97 HydrophobicContact CD1-CB 4.5Å; L35-V97 HydrophobicContact CD1-CG1 3.42Å; L35-V97 VanDerWaalsContact CD1-CG1 3.42Å; L35-V97 HydrophobicContact CG-CG1 4.29Å; P94-V97 HydrophobicContact CG-CG2 4.14Å; P94-V97 PolarHBondContact O-N 3.37Å; L95-V97 VanDerWaalsContact C-N 3.3Å; L95-V97 PolarHBondContact O-N 2.91Å; V97-F99 VanDerWaalsContact C-N 3.27Å; V97-F99 PolarHBondContact O-N 3.36Å; V97-V100 PolarHBondContact O-N 3.29Å; V97-V100 VanDerWaalsContact O-N 3.14Å; V97-I101 HydrophobicContact CG1-CD1 4.17Å; V97-I101 WeakPolarHBondContact O-CG1 3.33Å; V97-I101 PolarHBondContact O-N 2.86Å
98	M	59.1	Low	60.1	Low	6 Å²	6	44.7 Å²	44.7	3%	0.03	22%	0.219	C	C	.	.	H	α-helix	trans	-48.8	-46.5	169.2	-101.8	-70	-40.2	0	0	112.6	V86 I89 L95 I101 I102	V86-M98 HydrophobicContact CB-CE 3.79Å; V86-M98 HydrophobicContact CB-SD 3.81Å; V86-M98 HydrophobicContact CG1-CE 3.25Å; V86-M98 HydrophobicContact CG1-SD 3.69Å; V86-M98 HydrophobicContact CG2-CE 3.43Å; V86-M98 VanDerWaalsContact CG2-CE 3.43Å; V86-M98 HydrophobicContact CG2-SD 3.65Å; I89-M98 HydrophobicContact CB-SD 4.21Å; I89-M98 HydrophobicContact CG2-CG 3.83Å; I89-M98 HydrophobicContact CG2-SD 3.8Å; L95-M98 CarbonylContact O-C 3.59Å; L95-M98 WeakPolarHBondContact O-CB 3.45Å; L95-M98 PolarHBondContact O-N 3.48Å; M98-I101 PolarHBondContact O-N 3.47Å; M98-I102 HydrophobicContact CE-CD1 3.46Å; M98-I102 VanDerWaalsContact CE-CD1 3.46Å; M98-I102 HydrophobicContact CE-CG1 4.31Å; M98-I102 WeakPolarHBondContact O-CG1 3.49Å; M98-I102 PolarHBondContact O-N 3.09Å
99	F	60.7	Low	59.9	Low	28 Å²	28	37.3 Å²	37.3	12%	0.123	19%	0.187	C	C	.	.	H	α-helix	trans	-62.7	-45.3	177	176.4	-83.1	0	0	0	112.2	L95 N96 V97 I101 I102 Y103 F134 L138 Y218 A222	L95-F99 WeakPolarHBondContact O-CB 3.45Å; L95-F99 PolarHBondContact O-N 2.91Å; N96-F99 WeakPolarHBondContact O-CB 3.49Å; N96-F99 PolarHBondContact O-N 3.35Å; V97-F99 VanDerWaalsContact C-N 3.27Å; V97-F99 PolarHBondContact O-N 3.36Å; F99-I101 VanDerWaalsContact C-N 3.32Å; F99-I101 PolarHBondContact O-N 3.41Å; F99-I102 PolarHBondContact O-N 3.36Å; F99-Y103 VanDerWaalsContact O-CB 3.25Å; F99-Y103 WeakPolarHBondContact O-CB 3.47Å; F99-Y103 PolarHBondContact O-N 2.89Å; F99-F134 HydrophobicContact CE2-CZ 4.46Å; F99-F134 HydrophobicContact CZ-CZ 4.44Å; F99-L138 HydrophobicContact CD2-CD2 3.19Å; F99-L138 HydrophobicContact CD2-CG 4.45Å; F99-L138 HydrophobicContact CE2-CD1 3.9Å; F99-L138 HydrophobicContact CE2-CD2 3.37Å; F99-L138 HydrophobicContact CE2-CG 4.27Å; F99-L138 HydrophobicContact CG-CD2 4.16Å; F99-L138 HydrophobicContact CZ-CD2 4.45Å; F99-Y218 VanDerWaalsContact CZ-O 3.24Å; F99-Y218 WeakPolarHBondContact CZ-O 3.37Å; F99-A222 HydrophobicContact CE1-CB 4.36Å; F99-A222 HydrophobicContact CE2-CB 3.84Å; F99-A222 HydrophobicContact CZ-CB 3.3Å
100	V	57	Low	59.7	Low	69 Å²	69	36.3 Å²	36.3	42%	0.418	18%	0.183	S	C	.	.	H	α-helix	trans	-63.9	-39.3	180	177.1	0	0	0	0	111.1	N96 V97 S104	N96-V100 WeakPolarHBondContact O-CG2 3.27Å; N96-V100 PolarHBondContact O-N 2.98Å; V97-V100 PolarHBondContact O-N 3.29Å; V97-V100 VanDerWaalsContact O-N 3.14Å; V100-S104 VanDerWaalsContact O-CB 3.3Å; V100-S104 WeakPolarHBondContact O-CB 3.31Å; V100-S104 PolarHBondContact O-N 2.9Å; V100-S104 PolarHBondContact O-OG 2.98Å
101	I	61.9	Low	59.6	Low	20 Å²	20	39.1 Å²	39.1	10%	0.103	19%	0.194	C	C	.	.	H	α-helix	trans	-67.1	-47.3	177.6	-64.4	165.4	0	0	0	111.1	L35 V97 M98 F99 S104 I105	L35-I101 HydrophobicContact CB-CD1 4.29Å; L35-I101 HydrophobicContact CD2-CD1 3.84Å; L35-I101 HydrophobicContact CG-CD1 4.48Å; V97-I101 HydrophobicContact CG1-CD1 4.17Å; V97-I101 WeakPolarHBondContact O-CG1 3.33Å; V97-I101 PolarHBondContact O-N 2.86Å; M98-I101 PolarHBondContact O-N 3.47Å; F99-I101 VanDerWaalsContact C-N 3.32Å; F99-I101 PolarHBondContact O-N 3.41Å; I101-S104 WeakPolarHBondContact CA-OG 3.41Å; I101-S104 PolarHBondContact O-OG 3.18Å; I101-I105 HydrophobicContact CG2-CD1 3.88Å; I101-I105 VanDerWaalsContact O-CG1 3.3Å; I101-I105 WeakPolarHBondContact O-CG1 3.43Å; I101-I105 PolarHBondContact O-N 2.93Å; I101-I105 VanDerWaalsContact O-N 3.13Å
102	I	63.9	Low	59.4	Low	4 Å²	4	31.8 Å²	31.8	2%	0.021	16%	0.161	C	C	.	.	H	α-helix	trans	-59.3	-52	176.9	-74.3	170.2	0	0	0	110	L82 V86 M98 F99 S104 I105 F106 F134 A137	L82-I102 HydrophobicContact CD2-CG1 3.7Å; V86-I102 HydrophobicContact CG2-CD1 4.08Å; V86-I102 HydrophobicContact CG2-CG1 4.28Å; M98-I102 HydrophobicContact CE-CD1 3.46Å; M98-I102 VanDerWaalsContact CE-CD1 3.46Å; M98-I102 HydrophobicContact CE-CG1 4.31Å; M98-I102 WeakPolarHBondContact O-CG1 3.49Å; M98-I102 PolarHBondContact O-N 3.09Å; F99-I102 PolarHBondContact O-N 3.36Å; I102-S104 VanDerWaalsContact C-N 3.35Å; I102-S104 PolarHBondContact O-N 3.42Å; I102-I105 PolarHBondContact O-N 2.82Å; I102-F106 HydrophobicContact CG2-CD2 3.78Å; I102-F106 HydrophobicContact CG2-CE2 3.88Å; I102-F106 VanDerWaalsContact O-CD2 3.25Å; I102-F106 WeakPolarHBondContact O-CD2 3.26Å; I102-F106 PolarHBondContact O-N 2.93Å; I102-F106 VanDerWaalsContact O-N 3.11Å; I102-F134 HydrophobicContact CG2-CD2 3.94Å; I102-F134 HydrophobicContact CG2-CE2 3.97Å; I102-A137 HydrophobicContact CD1-CB 4.13Å; I102-A137 HydrophobicContact CG1-CB 4.39Å; I102-A137 HydrophobicContact CG2-CB 3.34Å
103	Y	62.6	Low	59.3	Low	27 Å²	27	24.4 Å²	24.4	11%	0.106	13%	0.129	C	C	.	.	H	α-helix	trans	-56.1	-49	-178.5	176.3	-104.8	0	0	0	112	F99 I105 F106 M107 F134 L225 Y226	F99-Y103 VanDerWaalsContact O-CB 3.25Å; F99-Y103 WeakPolarHBondContact O-CB 3.47Å; F99-Y103 PolarHBondContact O-N 2.89Å; Y103-I105 PolarHBondContact O-N 3.42Å; Y103-F106 PolarHBondContact O-N 3.23Å; Y103-M107 HydrophobicContact CD1-CG 4.04Å; Y103-M107 HydrophobicContact CD2-CG 4.07Å; Y103-M107 HydrophobicContact CE1-CE 4.36Å; Y103-M107 HydrophobicContact CE1-CG 3.64Å; Y103-M107 HydrophobicContact CE1-SD 4.3Å; Y103-M107 HydrophobicContact CE2-CG 3.68Å; Y103-M107 HydrophobicContact CE2-SD 3.87Å; Y103-M107 HydrophobicContact CG-CG 4.23Å; Y103-M107 VanDerWaalsContact CZ-CG 3.42Å; Y103-M107 VanDerWaalsContact CZ-SD 3.57Å; Y103-M107 VanDerWaalsContact O-CB 3.31Å; Y103-M107 WeakPolarHBondContact O-CB 3.2Å; Y103-M107 WeakPolarHBondContact O-CG 3.44Å; Y103-M107 PolarHBondContact O-N 3.32Å; Y103-M107 VanDerWaalsContact OH-CE 3.26Å; Y103-M107 WeakPolarHBondContact OH-CE 3.19Å; Y103-M107 PolarHBondContact OH-SD 2.81Å; Y103-F134 HydrophobicContact CD2-CD2 4.33Å; Y103-F134 HydrophobicContact CD2-CE1 4.03Å; Y103-F134 AromaticContact CD2-CE2 3.64Å; Y103-F134 HydrophobicContact CD2-CE2 3.64Å; Y103-F134 AromaticContact CD2-CZ 3.46Å; Y103-F134 HydrophobicContact CD2-CZ 3.46Å; Y103-F134 VanDerWaalsContact CD2-CZ 3.46Å; Y103-F134 HydrophobicContact CE2-CZ 4.43Å; Y103-F134 HydrophobicContact CG-CE2 4.1Å; Y103-F134 HydrophobicContact CG-CZ 4.17Å; Y103-L225 HydrophobicContact CE1-CB 4.17Å; Y103-L225 HydrophobicContact CE1-CD1 4.46Å; Y103-L225 HydrophobicContact CE2-CB 4.24Å; Y103-L225 VanDerWaalsContact OH-CB 3.3Å; Y103-L225 WeakPolarHBondContact OH-CB 3.37Å; Y103-L225 PolarHBondContact OH-O 3.48Å; Y103-Y226 HydrophobicContact CE2-CD2 4.34Å; Y103-Y226 PolarHBondContact OH-N 3.34Å
104	S	60.9	Low	59.1	Low	12 Å²	12	23.2 Å²	23.2	8%	0.084	12%	0.124	C	C	.	.	H	α-helix	trans	-63.3	-37.6	-179.4	55.5	0	0	0	0	113.8	Q39 V100 I101 I102 M107 A108	Q39-S104 WeakPolarHBondContact CG-OG 3.4Å; Q39-S104 PolarHBondContact NE2-OG 3.44Å; Q39-S104 PolarHBondContact OE1-OG 3.27Å; V100-S104 VanDerWaalsContact O-CB 3.3Å; V100-S104 WeakPolarHBondContact O-CB 3.31Å; V100-S104 PolarHBondContact O-N 2.9Å; V100-S104 PolarHBondContact O-OG 2.98Å; I101-S104 WeakPolarHBondContact CA-OG 3.41Å; I101-S104 PolarHBondContact O-OG 3.18Å; I102-S104 VanDerWaalsContact C-N 3.35Å; I102-S104 PolarHBondContact O-N 3.42Å; S104-M107 WeakPolarHBondContact O-CB 3.26Å; S104-M107 PolarHBondContact O-N 2.82Å; S104-A108 WeakPolarHBondContact O-CB 3.41Å; S104-A108 PolarHBondContact O-N 3.11Å
105	I	63.8	Low	59	Low	8 Å²	8	24.5 Å²	24.5	4%	0.041	13%	0.134	C	C	.	.	H	α-helix	trans	-64.8	-47.6	175.9	-69.9	168.3	0	0	0	110.6	I42 I46 V78 L82 I101 I102 Y103 M107 A108 I109	I42-I105 HydrophobicContact CG2-CD1 4.38Å; I42-I105 HydrophobicContact CG2-CG1 4.02Å; I46-I105 HydrophobicContact CD1-CG2 4.1Å; V78-I105 HydrophobicContact CG1-CG2 3.35Å; L82-I105 HydrophobicContact CD1-CB 4.42Å; L82-I105 HydrophobicContact CD1-CD1 4.08Å; L82-I105 HydrophobicContact CD1-CG2 3.97Å; L82-I105 HydrophobicContact CD2-CD1 3.91Å; L82-I105 HydrophobicContact CG-CD1 4.02Å; I101-I105 HydrophobicContact CG2-CD1 3.88Å; I101-I105 VanDerWaalsContact O-CG1 3.3Å; I101-I105 WeakPolarHBondContact O-CG1 3.43Å; I101-I105 PolarHBondContact O-N 2.93Å; I101-I105 VanDerWaalsContact O-N 3.13Å; I102-I105 PolarHBondContact O-N 2.82Å; Y103-I105 PolarHBondContact O-N 3.42Å; I105-M107 VanDerWaalsContact C-N 3.28Å; I105-M107 PolarHBondContact O-N 2.74Å; I105-A108 WeakPolarHBondContact O-CB 3.44Å; I105-A108 PolarHBondContact O-N 3.39Å; I105-I109 HydrophobicContact CG2-CD1 4.14Å; I105-I109 WeakPolarHBondContact O-CG1 3.47Å; I105-I109 PolarHBondContact O-N 2.84Å
106	F	65	Low	58.9	Low	4 Å²	4	24.2 Å²	24.2	2%	0.018	13%	0.133	C	C	.	.	H	α-helix	trans	-63.5	-37.2	177.2	-81.4	-72.6	0	0	0	112.1	I79 L82 I102 Y103 I109 A110 S130 L133 F134 A137	I79-F106 HydrophobicContact CG1-CZ 4.16Å; L82-F106 HydrophobicContact CD1-CE2 4.21Å; I102-F106 HydrophobicContact CG2-CD2 3.78Å; I102-F106 HydrophobicContact CG2-CE2 3.88Å; I102-F106 VanDerWaalsContact O-CD2 3.25Å; I102-F106 WeakPolarHBondContact O-CD2 3.26Å; I102-F106 PolarHBondContact O-N 2.93Å; I102-F106 VanDerWaalsContact O-N 3.11Å; Y103-F106 PolarHBondContact O-N 3.23Å; F106-I109 PolarHBondContact O-N 3Å; F106-A110 WeakPolarHBondContact O-CB 3.27Å; F106-A110 PolarHBondContact O-N 3.43Å; F106-S130 PolarHBondContact O-OG 3Å; F106-L133 HydrophobicContact CD1-CB 4.13Å; F106-L133 HydrophobicContact CE1-CB 3.25Å; F106-L133 HydrophobicContact CE1-CD1 4.28Å; F106-L133 HydrophobicContact CE1-CG 4.4Å; F106-L133 HydrophobicContact CZ-CB 3.71Å; F106-L133 WeakPolarHBondContact CZ-O 3.46Å; F106-F134 HydrophobicContact CB-CB 4.06Å; F106-F134 HydrophobicContact CB-CD2 4.11Å; F106-F134 HydrophobicContact CB-CG 4.43Å; F106-F134 HydrophobicContact CD1-CB 4.26Å; F106-F134 HydrophobicContact CD2-CB 4.04Å; F106-F134 AromaticContact CD2-CD2 3.85Å; F106-F134 HydrophobicContact CD2-CD2 3.85Å; F106-F134 HydrophobicContact CD2-CG 4.47Å; F106-F134 HydrophobicContact CG-CB 3.83Å; F106-F134 HydrophobicContact CG-CD2 4.18Å; F106-F134 HydrophobicContact CG-CG 4.5Å; F106-A137 HydrophobicContact CD2-CB 4.47Å; F106-A137 HydrophobicContact CE2-CB 3.56Å; F106-A137 HydrophobicContact CZ-CB 4.2Å
107	M	60.1	Low	58.9	Low	24 Å²	24	29.5 Å²	29.5	12%	0.118	16%	0.155	C	C	.	.	H	α-helix	trans	-64.2	-40.6	173.3	-73.1	-72.9	-67	0	0	112.5	Y103 S104 I105 A110 M111 Y226 F229	Y103-M107 HydrophobicContact CD1-CG 4.04Å; Y103-M107 HydrophobicContact CD2-CG 4.07Å; Y103-M107 HydrophobicContact CE1-CE 4.36Å; Y103-M107 HydrophobicContact CE1-CG 3.64Å; Y103-M107 HydrophobicContact CE1-SD 4.3Å; Y103-M107 HydrophobicContact CE2-CG 3.68Å; Y103-M107 HydrophobicContact CE2-SD 3.87Å; Y103-M107 HydrophobicContact CG-CG 4.23Å; Y103-M107 VanDerWaalsContact CZ-CG 3.42Å; Y103-M107 VanDerWaalsContact CZ-SD 3.57Å; Y103-M107 VanDerWaalsContact O-CB 3.31Å; Y103-M107 WeakPolarHBondContact O-CB 3.2Å; Y103-M107 WeakPolarHBondContact O-CG 3.44Å; Y103-M107 PolarHBondContact O-N 3.32Å; Y103-M107 VanDerWaalsContact OH-CE 3.26Å; Y103-M107 WeakPolarHBondContact OH-CE 3.19Å; Y103-M107 PolarHBondContact OH-SD 2.81Å; S104-M107 WeakPolarHBondContact O-CB 3.26Å; S104-M107 PolarHBondContact O-N 2.82Å; I105-M107 VanDerWaalsContact C-N 3.28Å; I105-M107 PolarHBondContact O-N 2.74Å; M107-A110 PolarHBondContact O-N 3.29Å; M107-M111 WeakPolarHBondContact O-CB 3.28Å; M107-M111 PolarHBondContact O-N 2.83Å; M107-Y226 HydrophobicContact SD-CD2 4Å; M107-Y226 HydrophobicContact SD-CE2 4.42Å; M107-F229 HydrophobicContact CE-CB 3.6Å; M107-F229 HydrophobicContact CE-CD1 3.35Å; M107-F229 HydrophobicContact CE-CD2 3.28Å; M107-F229 HydrophobicContact CE-CE1 3.79Å; M107-F229 HydrophobicContact CE-CE2 3.72Å; M107-F229 HydrophobicContact CE-CG 3.08Å; M107-F229 HydrophobicContact CE-CZ 3.95Å; M107-F229 HydrophobicContact SD-CB 4.28Å; M107-F229 HydrophobicContact SD-CD1 3.71Å; M107-F229 HydrophobicContact SD-CE1 4.22Å; M107-F229 HydrophobicContact SD-CG 3.96Å
108	A	58	Low	58.7	Low	3 Å²	3	29.3 Å²	29.3	3%	0.025	15%	0.154	C	C	.	.	H	α-helix	trans	-59.9	-47.8	174.3	0	0	0	0	0	110.4	T43 I46 S104 I105 A110 M111 A112	T43-A108 HydrophobicContact CG2-CB 3.73Å; I46-A108 HydrophobicContact CB-CB 4.3Å; I46-A108 HydrophobicContact CD1-CB 4.15Å; I46-A108 HydrophobicContact CG2-CB 4.18Å; S104-A108 WeakPolarHBondContact O-CB 3.41Å; S104-A108 PolarHBondContact O-N 3.11Å; I105-A108 WeakPolarHBondContact O-CB 3.44Å; I105-A108 PolarHBondContact O-N 3.39Å; A108-A110 PolarHBondContact O-N 3.43Å; A108-M111 WeakPolarHBondContact O-CB 3.27Å; A108-M111 PolarHBondContact O-N 2.85Å; A108-A112 VanDerWaalsContact O-CB 3.26Å; A108-A112 WeakPolarHBondContact O-CB 3.39Å; A108-A112 PolarHBondContact O-N 3.25Å
109	I	61.9	Low	58.4	Low	9 Å²	9	30.2 Å²	30.2	5%	0.046	16%	0.16	C	C	.	.	H	α-helix	trans	-60	-47.1	177.1	-66	166.2	0	0	0	110.6	I46 I75 V78 I105 F106 M111 A112 V113	I46-I109 HydrophobicContact CD1-CG1 4.39Å; I46-I109 HydrophobicContact CG2-CG1 4.18Å; I75-I109 HydrophobicContact CD1-CG2 4.12Å; I75-I109 HydrophobicContact CG1-CD1 4.47Å; I75-I109 HydrophobicContact CG1-CG2 3.97Å; V78-I109 HydrophobicContact CB-CD1 4.46Å; V78-I109 HydrophobicContact CG1-CD1 4.01Å; I105-I109 HydrophobicContact CG2-CD1 4.14Å; I105-I109 WeakPolarHBondContact O-CG1 3.47Å; I105-I109 PolarHBondContact O-N 2.84Å; F106-I109 PolarHBondContact O-N 3Å; I109-M111 VanDerWaalsContact C-N 3.33Å; I109-M111 PolarHBondContact O-N 2.91Å; I109-A112 PolarHBondContact O-N 3.28Å; I109-V113 HydrophobicContact CG2-CG2 4.31Å; I109-V113 WeakPolarHBondContact O-CB 3.4Å; I109-V113 VanDerWaalsContact O-CG2 3.24Å; I109-V113 WeakPolarHBondContact O-CG2 3.26Å; I109-V113 PolarHBondContact O-N 2.92Å
110	A	57.9	Low	58.2	Low	7 Å²	7	31.1 Å²	31.1	6%	0.058	17%	0.166	C	C	.	.	H	α-helix	trans	-59.7	-42.6	178.5	0	0	0	0	0	112.1	F106 M107 A108 W114	F106-A110 WeakPolarHBondContact O-CB 3.27Å; F106-A110 PolarHBondContact O-N 3.43Å; M107-A110 PolarHBondContact O-N 3.29Å; A108-A110 PolarHBondContact O-N 3.43Å; A110-W114 WeakPolarHBondContact O-CB 3.33Å; A110-W114 PolarHBondContact O-N 2.86Å; A110-W114 VanDerWaalsContact O-N 3.08Å
111	M	57.1	Low	57.9	Low	85 Å²	85	29.5 Å²	29.5	42%	0.419	16%	0.155	S	C	.	.	H	α-helix	trans	-61	-46.6	173.1	-86.3	-67.6	-90.9	0	0	112.4	M107 A108 I109 V113 W114 S115 F229 L233	M107-M111 WeakPolarHBondContact O-CB 3.28Å; M107-M111 PolarHBondContact O-N 2.83Å; A108-M111 WeakPolarHBondContact O-CB 3.27Å; A108-M111 PolarHBondContact O-N 2.85Å; I109-M111 VanDerWaalsContact C-N 3.33Å; I109-M111 PolarHBondContact O-N 2.91Å; M111-V113 VanDerWaalsContact C-N 3.32Å; M111-V113 PolarHBondContact O-N 3.45Å; M111-W114 PolarHBondContact O-N 3.41Å; M111-W114 VanDerWaalsContact O-N 3.13Å; M111-S115 PolarHBondContact O-N 3.28Å; M111-S115 VanDerWaalsContact O-N 3.09Å; M111-F229 HydrophobicContact CG-CE1 4.32Å; M111-F229 HydrophobicContact CG-CE2 4.26Å; M111-F229 HydrophobicContact CG-CZ 3.49Å; M111-F229 VanDerWaalsContact CG-CZ 3.49Å; M111-F229 HydrophobicContact SD-CE1 4.49Å; M111-F229 HydrophobicContact SD-CE2 4.13Å; M111-F229 HydrophobicContact SD-CZ 3.47Å; M111-F229 WeakPolarHBondContact SD-CZ 3.2Å; M111-L233 HydrophobicContact SD-CD1 3.75Å
112	A	55.8	Low	57.6	Low	2 Å²	2	31.1 Å²	31.1	2%	0.017	16%	0.16	C	C	.	.	H	α-helix	trans	-69.6	-32.7	-174.9	0	0	0	0	0	112	I46 S50 A108 I109 S115 I116	I46-A112 HydrophobicContact CG2-CB 4.09Å; S50-A112 WeakPolarHBondContact OG-CB 3.47Å; A108-A112 VanDerWaalsContact O-CB 3.26Å; A108-A112 WeakPolarHBondContact O-CB 3.39Å; A108-A112 PolarHBondContact O-N 3.25Å; I109-A112 PolarHBondContact O-N 3.28Å; A112-S115 PolarHBondContact O-OG 3.33Å; A112-I116 WeakPolarHBondContact O-CG1 3.26Å
113	V	58.2	Low	57.3	Low	5 Å²	5	31.9 Å²	31.9	3%	0.03	16%	0.163	C	C	.	.	H	α-helix	trans	-67.8	-40.4	170.1	169.4	0	0	0	0	111	L71 I109 M111 S115 I116 I126	L71-V113 HydrophobicContact CD1-CG2 3.87Å; L71-V113 HydrophobicContact CD2-CG2 3.53Å; L71-V113 HydrophobicContact CG-CG2 4.23Å; I109-V113 HydrophobicContact CG2-CG2 4.31Å; I109-V113 WeakPolarHBondContact O-CB 3.4Å; I109-V113 VanDerWaalsContact O-CG2 3.24Å; I109-V113 WeakPolarHBondContact O-CG2 3.26Å; I109-V113 PolarHBondContact O-N 2.92Å; M111-V113 VanDerWaalsContact C-N 3.32Å; M111-V113 PolarHBondContact O-N 3.45Å; V113-S115 VanDerWaalsContact C-N 3.28Å; V113-S115 PolarHBondContact O-N 3.21Å; V113-I116 WeakPolarHBondContact O-CB 3.31Å; V113-I116 PolarHBondContact O-N 2.84Å; V113-I116 VanDerWaalsContact O-N 3.12Å; V113-I126 HydrophobicContact CB-CG2 4.06Å; V113-I126 HydrophobicContact CG1-CB 3.77Å; V113-I126 HydrophobicContact CG1-CD1 3.59Å; V113-I126 HydrophobicContact CG1-CG1 4.28Å; V113-I126 HydrophobicContact CG1-CG2 3.5Å; V113-I126 VanDerWaalsContact CG1-CG2 3.5Å; V113-I126 HydrophobicContact CG2-CG2 3.6Å
114	W	55.1	Low	56.9	Low	35 Å²	35	34.2 Å²	34.2	13%	0.133	18%	0.177	C	C	.	.	H	α-helix	trans	-69.2	-28.6	-175.6	-162.7	-86.5	0	0	0	112.9	A110 M111 I116 K123 L233 T237 I239	A110-W114 WeakPolarHBondContact O-CB 3.33Å; A110-W114 PolarHBondContact O-N 2.86Å; A110-W114 VanDerWaalsContact O-N 3.08Å; M111-W114 PolarHBondContact O-N 3.41Å; M111-W114 VanDerWaalsContact O-N 3.13Å; W114-I116 PolarHBondContact O-N 2.82Å; W114-K123 HydrophobicContact CD2-CD 4.05Å; W114-K123 HydrophobicContact CE3-CB 4.01Å; W114-K123 HydrophobicContact CE3-CD 4.11Å; W114-K123 HydrophobicContact CZ3-CB 3.9Å; W114-K123 HydrophobicContact CZ3-CD 4.38Å; W114-K123 PolarHBondContact O-NZ 3.42Å; W114-L233 HydrophobicContact CB-CD1 4.46Å; W114-L233 HydrophobicContact CB-CD2 4Å; W114-L233 HydrophobicContact CD2-CD2 3.34Å; W114-L233 HydrophobicContact CD2-CG 3.85Å; W114-L233 HydrophobicContact CE3-CD2 3.45Å; W114-L233 VanDerWaalsContact CE3-CD2 3.45Å; W114-L233 HydrophobicContact CE3-CG 4.37Å; W114-L233 HydrophobicContact CG-CD1 4.1Å; W114-L233 HydrophobicContact CG-CD2 3.58Å; W114-L233 HydrophobicContact CG-CG 3.92Å; W114-L233 HydrophobicContact CZ2-CD2 4.44Å; W114-L233 HydrophobicContact CZ2-CG 4.47Å; W114-L233 HydrophobicContact CZ3-CD2 4.05Å; W114-T237 VanDerWaalsContact CZ2-OG1 3.24Å; W114-T237 WeakPolarHBondContact CZ2-OG1 3.5Å; W114-T237 PolarHBondContact NE1-OG1 3.13Å; W114-I239 HydrophobicContact CH2-CD1 4.32Å; W114-I239 HydrophobicContact CZ2-CD1 4.43Å; W114-I239 HydrophobicContact CZ2-CG1 4.26Å
115	S	53.2	Low	56.5	Low	80 Å²	80	34.6 Å²	34.6	56%	0.559	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-16.4	173.8	64	0	0	0	0	113.3	M111 A112 V113	M111-S115 PolarHBondContact O-N 3.28Å; M111-S115 VanDerWaalsContact O-N 3.09Å; A112-S115 PolarHBondContact O-OG 3.33Å; V113-S115 VanDerWaalsContact C-N 3.28Å; V113-S115 PolarHBondContact O-N 3.21Å
116	I	55.2	Low	56.2	Low	12 Å²	12	35 Å²	35	6%	0.062	18%	0.183	C	C	.	.	S	Bend	trans	-75.3	137.9	175.1	-49.7	174.5	0	0	0	109	L71 A112 V113 W114 L118 K123	L71-I116 HydrophobicContact CD1-CD1 3.68Å; A112-I116 WeakPolarHBondContact O-CG1 3.26Å; V113-I116 WeakPolarHBondContact O-CB 3.31Å; V113-I116 PolarHBondContact O-N 2.84Å; V113-I116 VanDerWaalsContact O-N 3.12Å; W114-I116 PolarHBondContact O-N 2.82Å; I116-L118 HydrophobicContact CB-CD1 4.26Å; I116-L118 HydrophobicContact CB-CG 4.17Å; I116-L118 HydrophobicContact CG2-CD1 4.16Å; I116-L118 HydrophobicContact CG2-CD2 4.45Å; I116-L118 HydrophobicContact CG2-CG 3.74Å; I116-L118 PolarHBondContact O-N 3.21Å; I116-K123 WeakPolarHBondContact O-CE 3.24Å; I116-K123 PolarHBondContact O-NZ 2.83Å
117	E	53.1	Low	55.9	Low	165 Å²	165	36.2 Å²	36.2	77%	0.771	19%	0.189	S	C	*	.			trans	-73.3	52.7	174	-69.2	-172.8	157.8	0	0	112.2
118	L	51.9	Low	55.8	Low	11 Å²	11	35.6 Å²	35.6	6%	0.058	19%	0.189	C	C	.	.			trans	-81.5	149.8	171	-70	169.9	0	0	0	110.4	I116 I120 K123 I126	I116-L118 HydrophobicContact CB-CD1 4.26Å; I116-L118 HydrophobicContact CB-CG 4.17Å; I116-L118 HydrophobicContact CG2-CD1 4.16Å; I116-L118 HydrophobicContact CG2-CD2 4.45Å; I116-L118 HydrophobicContact CG2-CG 3.74Å; I116-L118 PolarHBondContact O-N 3.21Å; L118-I120 PolarHBondContact O-N 3.46Å; L118-K123 HydrophobicContact CB-CG 4.08Å; L118-K123 WeakPolarHBondContact O-CE 3.13Å; L118-I126 HydrophobicContact CD1-CD1 3.65Å
119	C	52.2	Low	55.8	Low	24 Å²	24	36.5 Å²	36.5	16%	0.162	19%	0.193	C	C	.	.			trans	-53.3	142.7	169.3	-164.9	0	0	0	0	109.7	L121 Y122 K123 C249	C119-L121 PolarHBondContact O-N 2.82Å; C119-Y122 HydrophobicContact CB-CD2 3.67Å; C119-Y122 HydrophobicContact CB-CE2 4.16Å; C119-Y122 WeakPolarHBondContact O-CA 3.41Å; C119-Y122 WeakPolarHBondContact O-CB 3.34Å; C119-Y122 PolarHBondContact O-N 3.41Å; C119-K123 PolarHBondContact O-N 3.38Å; C119-K123 VanDerWaalsContact O-N 3.08Å; C119-C249 HydrophobicContact CB-CB 4.42Å; C119-C249 WeakPolarHBondContact CB-SG 3.44Å; C119-C249 WeakPolarHBondContact SG-CB 3.29Å; C119-C249 CovalentContact SG-SG 2.05Å; C119-C249 PolarHBondContact SG-SG 3.39Å
120	I	56.6	Low	55.6	Low	47 Å²	47	36.2 Å²	36.2	24%	0.241	19%	0.192	C	C	.	.	H	α-helix	trans	-54.5	-30	-176.7	-166.1	148.4	0	0	0	113.2	L118 K123 L124 I239	L118-I120 PolarHBondContact O-N 3.46Å; I120-K123 PolarHBondContact O-N 3.46Å; I120-L124 WeakPolarHBondContact O-CB 3.37Å; I120-L124 PolarHBondContact O-N 3.48Å; I120-I239 HydrophobicContact CD1-CB 4.39Å; I120-I239 HydrophobicContact CD1-CD1 4.43Å; I120-I239 HydrophobicContact CD1-CG1 4.12Å; I120-I239 HydrophobicContact CD1-CG2 3.78Å
121	L	52.5	Low	55.5	Low	36 Å²	36	37.7 Å²	37.7	19%	0.188	20%	0.198	C	C	.	.	H	α-helix	trans	-61.6	-45.7	175.1	-166.8	155.5	0	0	0	111.8	C119 L124 A125 K180 I184	C119-L121 PolarHBondContact O-N 2.82Å; L121-L124 PolarHBondContact O-N 2.88Å; L121-A125 PolarHBondContact O-N 3.04Å; L121-A125 VanDerWaalsContact O-N 3.08Å; L121-K180 HydrophobicContact CD1-CB 4.14Å; L121-K180 HydrophobicContact CD1-CD 4.15Å; L121-K180 HydrophobicContact CD1-CG 4.29Å; L121-I184 HydrophobicContact CD1-CD1 3.58Å; L121-I184 HydrophobicContact CD1-CG1 4.21Å; L121-I184 HydrophobicContact CG-CD1 3.92Å; L121-I184 HydrophobicContact CG-CG1 4.25Å
122	Y	54.8	Low	55.6	Low	53 Å²	53	34.1 Å²	34.1	21%	0.208	18%	0.181	C	C	.	.	H	α-helix	trans	-68.4	-38.4	175.1	-65.4	-64.5	0	0	0	111.3	I64 C119 L124 A125 I126 F171	I64-Y122 HydrophobicContact CD1-CE2 4.32Å; I64-Y122 HydrophobicContact CG2-CE1 4.49Å; I64-Y122 HydrophobicContact CG2-CE2 4.17Å; C119-Y122 HydrophobicContact CB-CD2 3.67Å; C119-Y122 HydrophobicContact CB-CE2 4.16Å; C119-Y122 WeakPolarHBondContact O-CA 3.41Å; C119-Y122 WeakPolarHBondContact O-CB 3.34Å; C119-Y122 PolarHBondContact O-N 3.41Å; Y122-L124 VanDerWaalsContact C-N 3.34Å; Y122-L124 PolarHBondContact O-N 3.39Å; Y122-A125 PolarHBondContact O-N 3.42Å; Y122-I126 WeakPolarHBondContact O-CD1 3.25Å; Y122-I126 VanDerWaalsContact O-CG1 3.23Å; Y122-I126 WeakPolarHBondContact O-CG1 3.49Å; Y122-I126 PolarHBondContact O-N 3.44Å; Y122-F171 HydrophobicContact CD1-CE2 4.3Å; Y122-F171 AromaticContact CE1-CE2 3.77Å; Y122-F171 HydrophobicContact CE1-CE2 3.77Å
123	K	58	Low	55.7	Low	20 Å²	20	34.7 Å²	34.7	9%	0.087	18%	0.184	C	C	.	.	H	α-helix	trans	-58.6	-46.2	175.2	-64.6	-168.8	177	-162.4	0	111.7	W114 I116 L118 C119 I120 I126 F127	W114-K123 HydrophobicContact CD2-CD 4.05Å; W114-K123 HydrophobicContact CE3-CB 4.01Å; W114-K123 HydrophobicContact CE3-CD 4.11Å; W114-K123 HydrophobicContact CZ3-CB 3.9Å; W114-K123 HydrophobicContact CZ3-CD 4.38Å; W114-K123 PolarHBondContact O-NZ 3.42Å; I116-K123 WeakPolarHBondContact O-CE 3.24Å; I116-K123 PolarHBondContact O-NZ 2.83Å; L118-K123 HydrophobicContact CB-CG 4.08Å; L118-K123 WeakPolarHBondContact O-CE 3.13Å; C119-K123 PolarHBondContact O-N 3.38Å; C119-K123 VanDerWaalsContact O-N 3.08Å; I120-K123 PolarHBondContact O-N 3.46Å; K123-I126 PolarHBondContact O-N 3.22Å; K123-F127 VanDerWaalsContact O-CB 3.27Å; K123-F127 WeakPolarHBondContact O-CB 3.16Å; K123-F127 PolarHBondContact O-N 2.97Å
124	L	53.4	Low	55.9	Low	76 Å²	76	34.7 Å²	34.7	40%	0.398	18%	0.184	S	C	.	.	H	α-helix	trans	-65.7	-41	179	-170.5	69.9	0	0	0	112.1	I120 L121 Y122 F127 G128 I184 V188	I120-L124 WeakPolarHBondContact O-CB 3.37Å; I120-L124 PolarHBondContact O-N 3.48Å; L121-L124 PolarHBondContact O-N 2.88Å; Y122-L124 VanDerWaalsContact C-N 3.34Å; Y122-L124 PolarHBondContact O-N 3.39Å; L124-F127 WeakPolarHBondContact O-CB 3.27Å; L124-F127 PolarHBondContact O-N 2.96Å; L124-G128 PolarHBondContact O-N 3.31Å; L124-I184 HydrophobicContact CD2-CG2 3.9Å; L124-V188 HydrophobicContact CD2-CG2 4.11Å
125	A	53.2	Low	56.1	Low	21 Å²	21	33.6 Å²	33.6	17%	0.174	18%	0.181	C	C	.	.	H	α-helix	trans	-63.1	-45.5	177.7	0	0	0	0	0	111.9	L121 Y122 F127 G128 I129 Y187	L121-A125 PolarHBondContact O-N 3.04Å; L121-A125 VanDerWaalsContact O-N 3.08Å; Y122-A125 PolarHBondContact O-N 3.42Å; A125-F127 VanDerWaalsContact C-N 3.34Å; A125-G128 PolarHBondContact O-N 3.37Å; A125-I129 WeakPolarHBondContact O-CD1 3.35Å; A125-I129 WeakPolarHBondContact O-CG1 3.31Å; A125-I129 PolarHBondContact O-N 3.45Å; A125-Y187 HydrophobicContact CB-CE1 4.28Å; A125-Y187 PolarHBondContact O-OH 3.34Å
126	I	57.9	Low	56.4	Low	15 Å²	15	30 Å²	30	8%	0.077	16%	0.155	C	C	.	.	H	α-helix	trans	-66.6	-38.6	177.5	-60.5	162.7	0	0	0	110.7	L71 V113 L118 Y122 K123 G128 I129 S130	L71-I126 HydrophobicContact CD2-CG2 4.02Å; V113-I126 HydrophobicContact CB-CG2 4.06Å; V113-I126 HydrophobicContact CG1-CB 3.77Å; V113-I126 HydrophobicContact CG1-CD1 3.59Å; V113-I126 HydrophobicContact CG1-CG1 4.28Å; V113-I126 HydrophobicContact CG1-CG2 3.5Å; V113-I126 VanDerWaalsContact CG1-CG2 3.5Å; V113-I126 HydrophobicContact CG2-CG2 3.6Å; L118-I126 HydrophobicContact CD1-CD1 3.65Å; Y122-I126 WeakPolarHBondContact O-CD1 3.25Å; Y122-I126 VanDerWaalsContact O-CG1 3.23Å; Y122-I126 WeakPolarHBondContact O-CG1 3.49Å; Y122-I126 PolarHBondContact O-N 3.44Å; K123-I126 PolarHBondContact O-N 3.22Å; I126-G128 VanDerWaalsContact C-N 3.34Å; I126-G128 PolarHBondContact O-N 3.22Å; I126-I129 PolarHBondContact O-N 3.4Å; I126-S130 PolarHBondContact O-N 3.42Å
127	F	58.6	Low	56.7	Low	31 Å²	31	30 Å²	30	14%	0.136	16%	0.157	C	C	.	.	H	α-helix	trans	-59.8	-43.8	173.6	-174.9	-97.9	0	0	0	112.1	K123 L124 A125 I129 S130 L131 Y226 S230	K123-F127 VanDerWaalsContact O-CB 3.27Å; K123-F127 WeakPolarHBondContact O-CB 3.16Å; K123-F127 PolarHBondContact O-N 2.97Å; L124-F127 WeakPolarHBondContact O-CB 3.27Å; L124-F127 PolarHBondContact O-N 2.96Å; A125-F127 VanDerWaalsContact C-N 3.34Å; F127-I129 VanDerWaalsContact C-N 3.35Å; F127-I129 PolarHBondContact O-N 2.92Å; F127-S130 PolarHBondContact O-N 3.26Å; F127-L131 PolarHBondContact O-N 3.39Å; F127-Y226 HydrophobicContact CD1-CE1 4.45Å; F127-Y226 WeakPolarHBondContact CD2-OH 3.34Å; F127-Y226 AromaticContact CE1-CE1 3.45Å; F127-Y226 HydrophobicContact CE1-CE1 3.45Å; F127-Y226 VanDerWaalsContact CE1-CE1 3.45Å; F127-Y226 AromaticContact CE1-CZ 3.85Å; F127-Y226 AromaticContact CE2-CE1 3.83Å; F127-Y226 HydrophobicContact CE2-CE1 3.83Å; F127-Y226 HydrophobicContact CE2-CE2 4.29Å; F127-Y226 AromaticContact CE2-CZ 3.52Å; F127-Y226 WeakPolarHBondContact CE2-OH 3.24Å; F127-Y226 AromaticContact CZ-CD1 3.99Å; F127-Y226 HydrophobicContact CZ-CD1 3.99Å; F127-Y226 AromaticContact CZ-CE1 3.07Å; F127-Y226 HydrophobicContact CZ-CE1 3.07Å; F127-Y226 HydrophobicContact CZ-CE2 4.31Å; F127-Y226 AromaticContact CZ-CZ 3.28Å; F127-Y226 WeakPolarHBondContact CZ-OH 3.41Å; F127-Y226 PolarHBondContact O-OH 2.99Å; F127-Y226 VanDerWaalsContact O-OH 3.09Å; F127-S230 WeakPolarHBondContact CE1-OG 3.24Å; F127-S230 WeakPolarHBondContact CZ-OG 3.5Å
128	G	56.5	Low	56.9	Low	11 Å²	11	23.4 Å²	23.4	11%	0.113	13%	0.127	C	C	.	.	H	α-helix	trans	-62	-40.5	174.3	0	0	0	0	0	112.8	L124 A125 I126 L131 V132	L124-G128 PolarHBondContact O-N 3.31Å; A125-G128 PolarHBondContact O-N 3.37Å; I126-G128 VanDerWaalsContact C-N 3.34Å; I126-G128 PolarHBondContact O-N 3.22Å; G128-L131 PolarHBondContact O-N 3.32Å; G128-V132 WeakPolarHBondContact O-CG2 3.08Å; G128-V132 PolarHBondContact O-N 3.42Å
129	I	58.1	Low	57.1	Low	21 Å²	21	23.2 Å²	23.2	11%	0.108	13%	0.126	C	C	.	.	H	α-helix	trans	-62.9	-44.4	174.9	-68.3	159.1	0	0	0	110.5	F72 A125 I126 F127 L131 V132 L133 A167 Y187	F72-I129 HydrophobicContact CE2-CD1 4.34Å; F72-I129 HydrophobicContact CZ-CD1 3.8Å; A125-I129 WeakPolarHBondContact O-CD1 3.35Å; A125-I129 WeakPolarHBondContact O-CG1 3.31Å; A125-I129 PolarHBondContact O-N 3.45Å; I126-I129 PolarHBondContact O-N 3.4Å; F127-I129 VanDerWaalsContact C-N 3.35Å; F127-I129 PolarHBondContact O-N 2.92Å; I129-L131 VanDerWaalsContact C-N 3.34Å; I129-L131 PolarHBondContact O-N 3.11Å; I129-V132 PolarHBondContact O-N 3.13Å; I129-L133 HydrophobicContact CG2-CD1 3.62Å; I129-L133 HydrophobicContact CG2-CG 4.19Å; I129-L133 VanDerWaalsContact O-CG 3.26Å; I129-L133 WeakPolarHBondContact O-CG 3.31Å; I129-L133 PolarHBondContact O-N 3.19Å; I129-A167 HydrophobicContact CD1-CB 4.34Å; I129-A167 HydrophobicContact CG1-CB 4.09Å; I129-Y187 VanDerWaalsContact CG1-OH 3.3Å; I129-Y187 WeakPolarHBondContact CG1-OH 3.5Å
130	S	58.7	Low	57.4	Low	4 Å²	4	23.4 Å²	23.4	3%	0.028	13%	0.125	C	C	.	.	H	α-helix	trans	-60.4	-42.6	178.6	-170	0	0	0	0	112.2	F106 I126 F127 V132 L133 F134	F106-S130 PolarHBondContact O-OG 3Å; I126-S130 PolarHBondContact O-N 3.42Å; F127-S130 PolarHBondContact O-N 3.26Å; S130-V132 VanDerWaalsContact C-N 3.32Å; S130-V132 PolarHBondContact O-N 2.88Å; S130-L133 PolarHBondContact O-N 3.35Å; S130-F134 VanDerWaalsContact O-CB 3.27Å; S130-F134 WeakPolarHBondContact O-CB 3.34Å; S130-F134 PolarHBondContact O-N 2.91Å
131	L	56.4	Low	57.3	Low	38 Å²	38	21.3 Å²	21.3	20%	0.199	12%	0.115	C	C	.	.	H	α-helix	trans	-57.9	-46.4	175.8	-179.9	87.4	0	0	0	111.4	F127 G128 I129 F134 T135 F195 Y226	F127-L131 PolarHBondContact O-N 3.39Å; G128-L131 PolarHBondContact O-N 3.32Å; I129-L131 VanDerWaalsContact C-N 3.34Å; I129-L131 PolarHBondContact O-N 3.11Å; L131-F134 WeakPolarHBondContact O-CB 3.3Å; L131-F134 PolarHBondContact O-N 2.77Å; L131-T135 PolarHBondContact O-N 2.83Å; L131-T135 PolarHBondContact O-OG1 2.94Å; L131-F195 HydrophobicContact CD2-CD2 4.48Å; L131-Y226 HydrophobicContact CB-CE1 4.03Å; L131-Y226 HydrophobicContact CD1-CD1 3.37Å; L131-Y226 HydrophobicContact CD1-CE1 3.18Å; L131-Y226 HydrophobicContact CD1-CE2 4.49Å; L131-Y226 HydrophobicContact CD1-CG 4.12Å; L131-Y226 HydrophobicContact CG-CE1 4.18Å; L131-Y226 PolarHBondContact N-OH 3.38Å
132	V	58.4	Low	57.4	Low	10 Å²	10	19.7 Å²	19.7	6%	0.061	11%	0.107	C	C	.	.	H	α-helix	trans	-64.6	-48.5	-177.8	166.7	0	0	0	0	110.8	G128 I129 S130 F134 T135 F136 S163 Q191	G128-V132 WeakPolarHBondContact O-CG2 3.08Å; G128-V132 PolarHBondContact O-N 3.42Å; I129-V132 PolarHBondContact O-N 3.13Å; S130-V132 VanDerWaalsContact C-N 3.32Å; S130-V132 PolarHBondContact O-N 2.88Å; V132-F134 VanDerWaalsContact C-N 3.3Å; V132-F134 PolarHBondContact O-N 3.37Å; V132-T135 WeakPolarHBondContact O-CB 3.17Å; V132-T135 PolarHBondContact O-N 3.29Å; V132-T135 VanDerWaalsContact O-N 3.15Å; V132-F136 HydrophobicContact CG1-CD2 3.68Å; V132-F136 HydrophobicContact CG1-CE2 3.32Å; V132-F136 HydrophobicContact CG1-CZ 4.44Å; V132-F136 WeakPolarHBondContact O-CD2 3.26Å; V132-F136 PolarHBondContact O-N 3.32Å; V132-S163 VanDerWaalsContact CG1-CB 3.41Å; V132-S163 WeakPolarHBondContact CG1-OG 3.4Å; V132-Q191 VanDerWaalsContact CG2-OE1 3.27Å
133	L	57.2	Low	57.5	Low	13 Å²	13	17.2 Å²	17.2	7%	0.068	10%	0.097	C	C	.	.	H	α-helix	trans	-63.2	-37.9	177.8	-64.6	169.6	0	0	0	112	I75 I79 F106 I129 S130 F136 A137 L160	I75-L133 HydrophobicContact CG2-CD1 3.43Å; I75-L133 VanDerWaalsContact CG2-CD1 3.43Å; I79-L133 HydrophobicContact CD1-CB 4.41Å; I79-L133 HydrophobicContact CD1-CD1 3.97Å; I79-L133 HydrophobicContact CD1-CD2 3.68Å; I79-L133 HydrophobicContact CD1-CG 4.22Å; F106-L133 HydrophobicContact CD1-CB 4.13Å; F106-L133 HydrophobicContact CE1-CB 3.25Å; F106-L133 HydrophobicContact CE1-CD1 4.28Å; F106-L133 HydrophobicContact CE1-CG 4.4Å; F106-L133 HydrophobicContact CZ-CB 3.71Å; F106-L133 WeakPolarHBondContact CZ-O 3.46Å; I129-L133 HydrophobicContact CG2-CD1 3.62Å; I129-L133 HydrophobicContact CG2-CG 4.19Å; I129-L133 VanDerWaalsContact O-CG 3.26Å; I129-L133 WeakPolarHBondContact O-CG 3.31Å; I129-L133 PolarHBondContact O-N 3.19Å; S130-L133 PolarHBondContact O-N 3.35Å; L133-F136 WeakPolarHBondContact O-CB 3.13Å; L133-F136 PolarHBondContact O-N 2.96Å; L133-A137 PolarHBondContact O-N 3.42Å; L133-L160 HydrophobicContact CD2-CD1 3.79Å
134	F	63	Low	57.2	Low	6 Å²	6	17.8 Å²	17.8	3%	0.026	10%	0.101	C	C	.	.	H	α-helix	trans	-59	-49.7	172.3	173.7	-112.1	0	0	0	110.9	F99 I102 Y103 F106 S130 L131 V132 F136 A137 L138 A222	F99-F134 HydrophobicContact CE2-CZ 4.46Å; F99-F134 HydrophobicContact CZ-CZ 4.44Å; I102-F134 HydrophobicContact CG2-CD2 3.94Å; I102-F134 HydrophobicContact CG2-CE2 3.97Å; Y103-F134 HydrophobicContact CD2-CD2 4.33Å; Y103-F134 HydrophobicContact CD2-CE1 4.03Å; Y103-F134 AromaticContact CD2-CE2 3.64Å; Y103-F134 HydrophobicContact CD2-CE2 3.64Å; Y103-F134 AromaticContact CD2-CZ 3.46Å; Y103-F134 HydrophobicContact CD2-CZ 3.46Å; Y103-F134 VanDerWaalsContact CD2-CZ 3.46Å; Y103-F134 HydrophobicContact CE2-CZ 4.43Å; Y103-F134 HydrophobicContact CG-CE2 4.1Å; Y103-F134 HydrophobicContact CG-CZ 4.17Å; F106-F134 HydrophobicContact CB-CB 4.06Å; F106-F134 HydrophobicContact CB-CD2 4.11Å; F106-F134 HydrophobicContact CB-CG 4.43Å; F106-F134 HydrophobicContact CD1-CB 4.26Å; F106-F134 HydrophobicContact CD2-CB 4.04Å; F106-F134 AromaticContact CD2-CD2 3.85Å; F106-F134 HydrophobicContact CD2-CD2 3.85Å; F106-F134 HydrophobicContact CD2-CG 4.47Å; F106-F134 HydrophobicContact CG-CB 3.83Å; F106-F134 HydrophobicContact CG-CD2 4.18Å; F106-F134 HydrophobicContact CG-CG 4.5Å; S130-F134 VanDerWaalsContact O-CB 3.27Å; S130-F134 WeakPolarHBondContact O-CB 3.34Å; S130-F134 PolarHBondContact O-N 2.91Å; L131-F134 WeakPolarHBondContact O-CB 3.3Å; L131-F134 PolarHBondContact O-N 2.77Å; V132-F134 VanDerWaalsContact C-N 3.3Å; V132-F134 PolarHBondContact O-N 3.37Å; F134-F136 VanDerWaalsContact C-N 3.26Å; F134-F136 PolarHBondContact O-N 3.2Å; F134-A137 PolarHBondContact O-N 2.94Å; F134-A137 VanDerWaalsContact O-N 3.16Å; F134-L138 HydrophobicContact CD1-CD1 4.32Å; F134-L138 HydrophobicContact CE1-CD1 3.63Å; F134-L138 HydrophobicContact CE1-CG 4.15Å; F134-L138 HydrophobicContact CE2-CD1 4.34Å; F134-L138 HydrophobicContact CE2-CD2 3.83Å; F134-L138 HydrophobicContact CE2-CG 4.02Å; F134-L138 HydrophobicContact CZ-CD1 3.62Å; F134-L138 HydrophobicContact CZ-CD2 3.76Å; F134-L138 HydrophobicContact CZ-CG 3.8Å; F134-L138 WeakPolarHBondContact O-CG 3.21Å; F134-L138 PolarHBondContact O-N 2.89Å; F134-A222 HydrophobicContact CE1-CB 3.62Å; F134-A222 HydrophobicContact CZ-CB 3.77Å
135	T	59.1	Low	57.2	Low	12 Å²	12	18.5 Å²	18.5	7%	0.074	10%	0.1	C	C	.	.	H	α-helix	trans	-58.9	-40.1	178.1	-46.5	0	0	0	0	111	L131 V132 L138 L139 F195 T198	L131-T135 PolarHBondContact O-N 2.83Å; L131-T135 PolarHBondContact O-OG1 2.94Å; V132-T135 WeakPolarHBondContact O-CB 3.17Å; V132-T135 PolarHBondContact O-N 3.29Å; V132-T135 VanDerWaalsContact O-N 3.15Å; T135-L138 WeakPolarHBondContact O-CB 3.49Å; T135-L138 PolarHBondContact O-N 3.34Å; T135-L139 HydrophobicContact CG2-CD1 4.31Å; T135-L139 WeakPolarHBondContact O-CD1 3.41Å; T135-L139 PolarHBondContact O-N 3.14Å; T135-F195 HydrophobicContact CG2-CD2 3.98Å; T135-F195 HydrophobicContact CG2-CE2 3.92Å; T135-F195 WeakPolarHBondContact OG1-CD2 3.4Å; T135-T198 HydrophobicContact CG2-CG2 3.37Å
136	F	60.4	Low	57.4	Low	4 Å²	4	17.7 Å²	17.7	2%	0.018	9%	0.094	C	C	.	.	H	α-helix	trans	-62.8	-48	173.7	-78.3	-55.9	0	0	0	113.8	V132 L133 F134 L138 L139 I140 L156 L159 L160 S163	V132-F136 HydrophobicContact CG1-CD2 3.68Å; V132-F136 HydrophobicContact CG1-CE2 3.32Å; V132-F136 HydrophobicContact CG1-CZ 4.44Å; V132-F136 WeakPolarHBondContact O-CD2 3.26Å; V132-F136 PolarHBondContact O-N 3.32Å; L133-F136 WeakPolarHBondContact O-CB 3.13Å; L133-F136 PolarHBondContact O-N 2.96Å; F134-F136 VanDerWaalsContact C-N 3.26Å; F134-F136 PolarHBondContact O-N 3.2Å; F136-L138 PolarHBondContact O-N 3.39Å; F136-L139 HydrophobicContact CD1-CD1 4.43Å; F136-L139 PolarHBondContact O-N 3.29Å; F136-L139 VanDerWaalsContact O-N 3.08Å; F136-I140 WeakPolarHBondContact O-CG1 3.43Å; F136-I140 PolarHBondContact O-N 2.81Å; F136-L156 HydrophobicContact CD1-CD1 3.93Å; F136-L156 HydrophobicContact CD1-CD2 4.37Å; F136-L156 HydrophobicContact CD1-CG 3.73Å; F136-L156 HydrophobicContact CE1-CG 4.39Å; F136-L156 WeakPolarHBondContact O-CD1 3.24Å; F136-L159 HydrophobicContact CD1-CB 4.49Å; F136-L159 HydrophobicContact CE1-CB 3.24Å; F136-L159 HydrophobicContact CE1-CD1 4.3Å; F136-L159 HydrophobicContact CE1-CG 4.38Å; F136-L159 HydrophobicContact CZ-CB 3.44Å; F136-L159 VanDerWaalsContact CZ-CB 3.44Å; F136-L159 VanDerWaalsContact CZ-O 3.27Å; F136-L159 WeakPolarHBondContact CZ-O 3.43Å; F136-L160 HydrophobicContact CB-CD1 4.08Å; F136-L160 HydrophobicContact CD1-CB 4.3Å; F136-L160 HydrophobicContact CD2-CB 4.16Å; F136-L160 HydrophobicContact CD2-CD1 3.64Å; F136-L160 HydrophobicContact CD2-CG 4.39Å; F136-L160 HydrophobicContact CE1-CB 4.31Å; F136-L160 VanDerWaalsContact CE2-CA 3.49Å; F136-L160 HydrophobicContact CE2-CB 4.1Å; F136-L160 HydrophobicContact CE2-CD1 4.31Å; F136-L160 HydrophobicContact CG-CB 4.27Å; F136-L160 HydrophobicContact CG-CD1 3.84Å; F136-L160 VanDerWaalsContact CZ-CA 3.49Å; F136-L160 HydrophobicContact CZ-CB 4.23Å; F136-S163 WeakPolarHBondContact CE2-OG 3.22Å
137	A	60	Low	57.4	Low	12 Å²	12	23.6 Å²	23.6	10%	0.099	13%	0.126	C	C	.	.	H	α-helix	trans	-59.4	-33.9	178.3	0	0	0	0	0	111.6	I102 F106 L133 F134 I140 G141	I102-A137 HydrophobicContact CD1-CB 4.13Å; I102-A137 HydrophobicContact CG1-CB 4.39Å; I102-A137 HydrophobicContact CG2-CB 3.34Å; F106-A137 HydrophobicContact CD2-CB 4.47Å; F106-A137 HydrophobicContact CE2-CB 3.56Å; F106-A137 HydrophobicContact CZ-CB 4.2Å; L133-A137 PolarHBondContact O-N 3.42Å; F134-A137 PolarHBondContact O-N 2.94Å; F134-A137 VanDerWaalsContact O-N 3.16Å; A137-I140 PolarHBondContact O-N 2.79Å; A137-G141 PolarHBondContact O-N 3.21Å
138	L	57.9	Low	57.2	Low	27 Å²	27	23.9 Å²	23.9	14%	0.141	13%	0.131	C	C	.	.	H	α-helix	trans	-61.3	-48.9	172.2	-65.5	-173.7	0	0	0	112.8	F99 F134 T135 F136 G141 A142 A222	F99-L138 HydrophobicContact CD2-CD2 3.19Å; F99-L138 HydrophobicContact CD2-CG 4.45Å; F99-L138 HydrophobicContact CE2-CD1 3.9Å; F99-L138 HydrophobicContact CE2-CD2 3.37Å; F99-L138 HydrophobicContact CE2-CG 4.27Å; F99-L138 HydrophobicContact CG-CD2 4.16Å; F99-L138 HydrophobicContact CZ-CD2 4.45Å; F134-L138 HydrophobicContact CD1-CD1 4.32Å; F134-L138 HydrophobicContact CE1-CD1 3.63Å; F134-L138 HydrophobicContact CE1-CG 4.15Å; F134-L138 HydrophobicContact CE2-CD1 4.34Å; F134-L138 HydrophobicContact CE2-CD2 3.83Å; F134-L138 HydrophobicContact CE2-CG 4.02Å; F134-L138 HydrophobicContact CZ-CD1 3.62Å; F134-L138 HydrophobicContact CZ-CD2 3.76Å; F134-L138 HydrophobicContact CZ-CG 3.8Å; F134-L138 WeakPolarHBondContact O-CG 3.21Å; F134-L138 PolarHBondContact O-N 2.89Å; T135-L138 WeakPolarHBondContact O-CB 3.49Å; T135-L138 PolarHBondContact O-N 3.34Å; F136-L138 PolarHBondContact O-N 3.39Å; L138-G141 PolarHBondContact O-N 2.84Å; L138-A142 WeakPolarHBondContact O-CB 3.3Å; L138-A142 PolarHBondContact O-N 2.88Å; L138-A222 HydrophobicContact CD1-CB 4.28Å
139	L	57.2	Low	57	Low	6 Å²	6	25.4 Å²	25.4	3%	0.031	14%	0.138	C	C	.	.	H	α-helix	trans	-67.7	-35.3	178.5	-71.6	127.8	0	0	0	112.4	T135 F136 A142 A143 L152 L156 T198	T135-L139 HydrophobicContact CG2-CD1 4.31Å; T135-L139 WeakPolarHBondContact O-CD1 3.41Å; T135-L139 PolarHBondContact O-N 3.14Å; F136-L139 HydrophobicContact CD1-CD1 4.43Å; F136-L139 PolarHBondContact O-N 3.29Å; F136-L139 VanDerWaalsContact O-N 3.08Å; L139-A142 WeakPolarHBondContact O-CB 3.26Å; L139-A142 PolarHBondContact O-N 2.87Å; L139-A143 VanDerWaalsContact O-CB 3.3Å; L139-A143 WeakPolarHBondContact O-CB 3.3Å; L139-A143 PolarHBondContact O-N 3.23Å; L139-L152 HydrophobicContact CB-CD2 4.43Å; L139-L156 HydrophobicContact CB-CD1 3.09Å; L139-L156 HydrophobicContact CD1-CD1 4.14Å; L139-L156 HydrophobicContact CG-CD1 4.17Å; L139-T198 HydrophobicContact CD1-CG2 3.03Å; L139-T198 HydrophobicContact CD2-CG2 4.27Å; L139-T198 HydrophobicContact CG-CG2 4.13Å
140	I	57.2	Low	56.8	Low	29 Å²	29	30.6 Å²	30.6	15%	0.149	17%	0.166	C	C	.	.	H	α-helix	trans	-59.1	-51.1	173.1	-68.8	168.5	0	0	0	109.3	V83 F136 A137 A142 A143 I144 L156	V83-I140 HydrophobicContact CG2-CD1 4.21Å; F136-I140 WeakPolarHBondContact O-CG1 3.43Å; F136-I140 PolarHBondContact O-N 2.81Å; A137-I140 PolarHBondContact O-N 2.79Å; I140-A142 PolarHBondContact O-N 2.89Å; I140-A143 WeakPolarHBondContact O-CB 3.36Å; I140-A143 PolarHBondContact O-N 3.34Å; I140-I144 HydrophobicContact CG2-CD1 3.56Å; I140-I144 HydrophobicContact CG2-CG1 4.29Å; I140-I144 VanDerWaalsContact O-CG1 3.31Å; I140-I144 WeakPolarHBondContact O-CG1 3.47Å; I140-I144 PolarHBondContact O-N 3.39Å; I140-L156 HydrophobicContact CD1-CD2 3.57Å; I140-L156 HydrophobicContact CG1-CD1 3.76Å; I140-L156 HydrophobicContact CG1-CD2 3.14Å; I140-L156 HydrophobicContact CG1-CG 4.03Å
141	G	55.5	Low	56.5	Low	3 Å²	3	37.7 Å²	37.7	3%	0.031	20%	0.199	C	C	.	.	H	α-helix	trans	-57.1	-41.7	177.4	0	0	0	0	0	111.4	L95 A137 L138 K145	L95-G141 WeakPolarHBondContact CD1-O 3.13Å; A137-G141 PolarHBondContact O-N 3.21Å; L138-G141 PolarHBondContact O-N 2.84Å; G141-K145 PolarHBondContact O-N 3.19Å
142	A	55	Low	56.2	Low	2 Å²	2	36 Å²	36	2%	0.017	19%	0.19	C	C	.	.	H	α-helix	trans	-64.8	-42.5	177.2	0	0	0	0	0	113.1	L138 L139 I140 K145 A146 I213 L214	L138-A142 WeakPolarHBondContact O-CB 3.3Å; L138-A142 PolarHBondContact O-N 2.88Å; L139-A142 WeakPolarHBondContact O-CB 3.26Å; L139-A142 PolarHBondContact O-N 2.87Å; I140-A142 PolarHBondContact O-N 2.89Å; A142-K145 PolarHBondContact O-N 3.32Å; A142-A146 WeakPolarHBondContact O-CB 3.39Å; A142-A146 PolarHBondContact O-N 3.44Å; A142-I213 HydrophobicContact CB-CG2 3.39Å; A142-L214 HydrophobicContact CB-CD1 3.6Å
143	A	55.2	Low	56	Low	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-61.1	-49.9	178.4	0	0	0	0	0	112.9	L139 I140 K145 A146 D147 S148 L152	L139-A143 VanDerWaalsContact O-CB 3.3Å; L139-A143 WeakPolarHBondContact O-CB 3.3Å; L139-A143 PolarHBondContact O-N 3.23Å; I140-A143 WeakPolarHBondContact O-CB 3.36Å; I140-A143 PolarHBondContact O-N 3.34Å; A143-K145 VanDerWaalsContact C-N 3.28Å; A143-K145 PolarHBondContact O-N 3.22Å; A143-A146 PolarHBondContact O-N 2.77Å; A143-A146 VanDerWaalsContact O-N 3.16Å; A143-D147 PolarHBondContact O-N 3.24Å; A143-S148 PolarHBondContact O-N 3.08Å; A143-L152 HydrophobicContact CB-CB 3.77Å; A143-L152 HydrophobicContact CB-CD1 3.79Å; A143-L152 HydrophobicContact CB-CD2 3.36Å; A143-L152 HydrophobicContact CB-CG 3.77Å
144	I	53.5	Low	55.7	Low	32 Å²	32	42.9 Å²	42.9	16%	0.164	23%	0.226	C	C	.	.	H	α-helix	trans	-61.5	-43.2	-177.7	-65.9	167.2	0	0	0	109.2	V86 S90 I140 A146 D147	V86-I144 HydrophobicContact CG1-CD1 3.79Å; S90-I144 WeakPolarHBondContact OG-CG2 3.48Å; I140-I144 HydrophobicContact CG2-CD1 3.56Å; I140-I144 HydrophobicContact CG2-CG1 4.29Å; I140-I144 VanDerWaalsContact O-CG1 3.31Å; I140-I144 WeakPolarHBondContact O-CG1 3.47Å; I140-I144 PolarHBondContact O-N 3.39Å; I144-A146 PolarHBondContact O-N 2.95Å; I144-D147 PolarHBondContact O-N 2.69Å
145	K	53.2	Low	55.4	Low	91 Å²	91	45.5 Å²	45.5	40%	0.396	24%	0.24	S	C	.	.	H	α-helix	trans	-69.8	-31.7	177.6	-175.6	171	178.9	-166.5	0	113.5	L95 G141 A142 A143 D147 I213	L95-K145 HydrophobicContact CB-CD 3.65Å; L95-K145 HydrophobicContact CD1-CB 3.79Å; L95-K145 HydrophobicContact CD1-CD 3.68Å; L95-K145 HydrophobicContact CD1-CG 4.38Å; L95-K145 HydrophobicContact CD2-CD 4.44Å; L95-K145 HydrophobicContact CG-CD 4.12Å; G141-K145 PolarHBondContact O-N 3.19Å; A142-K145 PolarHBondContact O-N 3.32Å; A143-K145 VanDerWaalsContact C-N 3.28Å; A143-K145 PolarHBondContact O-N 3.22Å; K145-D147 PolarHBondContact O-N 2.88Å; K145-I213 HydrophobicContact CB-CD1 4.08Å; K145-I213 HydrophobicContact CD-CD1 4.24Å; K145-I213 HydrophobicContact CD-CG1 4.11Å; K145-I213 HydrophobicContact CG-CD1 3.87Å; K145-I213 HydrophobicContact CG-CG1 4.3Å
146	A	57	Low	55.1	Low	4 Å²	4	45.2 Å²	45.2	3%	0.033	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-1.3	177.1	0	0	0	0	0	112.5	A142 A143 I144 S148 R210 I213	A142-A146 WeakPolarHBondContact O-CB 3.39Å; A142-A146 PolarHBondContact O-N 3.44Å; A143-A146 PolarHBondContact O-N 2.77Å; A143-A146 VanDerWaalsContact O-N 3.16Å; I144-A146 PolarHBondContact O-N 2.95Å; A146-S148 WeakPolarHBondContact CB-OG 3.26Å; A146-S148 PolarHBondContact O-N 3.22Å; A146-R210 VanDerWaalsContact C-NH1 3.34Å; A146-R210 PolarHBondContact O-NH1 3.09Å; A146-I213 HydrophobicContact CB-CD1 3.83Å
147	D	57.4	Low	55	Low	140 Å²	140	49 Å²	49	75%	0.749	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	17	-173.7	-141.2	12.3	0	0	0	112.5	A143 I144 K145 V149	A143-D147 PolarHBondContact O-N 3.24Å; I144-D147 PolarHBondContact O-N 2.69Å; K145-D147 PolarHBondContact O-N 2.88Å; D147-V149 PolarHBondContact O-N 3.35Å
148	S	53.8	Low	54.6	Low	36 Å²	36	51.6 Å²	51.6	25%	0.252	28%	0.275	S	S	.	.			trans	-93.6	33.8	178.4	63.8	0	0	0	0	109.9	A143 A146 D150 L152	A143-S148 PolarHBondContact O-N 3.08Å; A146-S148 WeakPolarHBondContact CB-OG 3.26Å; A146-S148 PolarHBondContact O-N 3.22Å; S148-D150 VanDerWaalsContact C-N 3.34Å; S148-D150 PolarHBondContact O-N 3.49Å; S148-L152 VanDerWaalsContact O-CB 3.22Å; S148-L152 WeakPolarHBondContact O-CB 3.32Å; S148-L152 PolarHBondContact O-N 2.64Å; S148-L152 VanDerWaalsContact O-N 3.09Å
149	V	53.1	Low	54.5	Low	43 Å²	43	51 Å²	51	26%	0.261	27%	0.271	S	S	.	.	H	α-helix	trans	-57.8	-47	-162.7	-173.9	0	0	0	0	110.3	D147 I153	D147-V149 PolarHBondContact O-N 3.35Å; V149-I153 HydrophobicContact CG1-CD1 3.32Å; V149-I153 HydrophobicContact CG1-CG1 4.07Å; V149-I153 WeakPolarHBondContact O-CB 3.44Å; V149-I153 WeakPolarHBondContact O-CG1 3.21Å; V149-I153 PolarHBondContact O-N 2.84Å
150	D	53.6	Low	54.6	Low	131 Å²	131	53 Å²	53	70%	0.701	28%	0.282	S	S	*	.	H	α-helix	trans	-68.1	-48.2	-168.7	-61.8	-27.6	0	0	0	113.5	S148	S148-D150 VanDerWaalsContact C-N 3.34Å; S148-D150 PolarHBondContact O-N 3.49Å
151	H	52.4	Low	54.6	Low	152 Å²	152	55.4 Å²	55.4	70%	0.704	30%	0.298	S	S	*	.	H	α-helix	trans	-78.7	-37.8	-179.5	-69.5	-49.2	0	0	0	112.4	N154 I155	H151-N154 PolarHBondContact O-N 2.92Å; H151-I155 VanDerWaalsContact O-CG1 3.32Å; H151-I155 WeakPolarHBondContact O-CG1 3.34Å; H151-I155 PolarHBondContact O-N 2.89Å
152	L	50.9	Low	54.6	Low	4 Å²	4	59.3 Å²	59.3	2%	0.021	32%	0.318	C	S	.	.	H	α-helix	trans	-75.3	-37.2	-175.8	-156.7	160.9	0	0	0	111.2	L139 A143 S148 N154 I155 L156 T205	L139-L152 HydrophobicContact CB-CD2 4.43Å; A143-L152 HydrophobicContact CB-CB 3.77Å; A143-L152 HydrophobicContact CB-CD1 3.79Å; A143-L152 HydrophobicContact CB-CD2 3.36Å; A143-L152 HydrophobicContact CB-CG 3.77Å; S148-L152 VanDerWaalsContact O-CB 3.22Å; S148-L152 WeakPolarHBondContact O-CB 3.32Å; S148-L152 PolarHBondContact O-N 2.64Å; S148-L152 VanDerWaalsContact O-N 3.09Å; L152-N154 VanDerWaalsContact C-N 3.3Å; L152-N154 PolarHBondContact O-N 3.24Å; L152-I155 PolarHBondContact O-N 3.31Å; L152-L156 HydrophobicContact CD2-CB 4.18Å; L152-L156 HydrophobicContact CD2-CD1 4.27Å; L152-L156 WeakPolarHBondContact O-CB 3.24Å; L152-L156 PolarHBondContact O-N 3.29Å; L152-T205 HydrophobicContact CB-CG2 4.14Å; L152-T205 HydrophobicContact CD1-CG2 3.52Å; L152-T205 HydrophobicContact CG-CG2 3.78Å
153	I	53.4	Low	54.7	Low	58 Å²	58	59.4 Å²	59.4	30%	0.297	32%	0.318	S	S	.	.	H	α-helix	trans	-58	-44.5	171.8	-73.5	-177.1	0	0	0	110.5	V149 L156 I157	V149-I153 HydrophobicContact CG1-CD1 3.32Å; V149-I153 HydrophobicContact CG1-CG1 4.07Å; V149-I153 WeakPolarHBondContact O-CB 3.44Å; V149-I153 WeakPolarHBondContact O-CG1 3.21Å; V149-I153 PolarHBondContact O-N 2.84Å; I153-L156 PolarHBondContact O-N 3.42Å; I153-I157 HydrophobicContact CG2-CD1 3.4Å; I153-I157 HydrophobicContact CG2-CG1 4.03Å; I153-I157 WeakPolarHBondContact O-CB 3.27Å; I153-I157 WeakPolarHBondContact O-CG1 3.47Å; I153-I157 PolarHBondContact O-N 3.15Å
154	N	52	Low	54.9	Low	108 Å²	108	62.2 Å²	62.2	58%	0.578	34%	0.335	S	S	*	.	H	α-helix	trans	-66.1	-46.2	179.9	-83.5	-3.6	0	0	0	112.7	H151 L152 L156 I157 S158	H151-N154 PolarHBondContact O-N 2.92Å; L152-N154 VanDerWaalsContact C-N 3.3Å; L152-N154 PolarHBondContact O-N 3.24Å; N154-L156 PolarHBondContact O-N 3.4Å; N154-I157 PolarHBondContact O-N 2.75Å; N154-S158 VanDerWaalsContact O-CB 3.32Å; N154-S158 WeakPolarHBondContact O-CB 3.48Å; N154-S158 PolarHBondContact O-N 3.03Å; N154-S158 PolarHBondContact O-OG 3.16Å
155	I	54.7	Low	55	Low	62 Å²	62	64.2 Å²	64.2	32%	0.318	35%	0.348	S	S	.	.	H	α-helix	trans	-58.3	-43.1	175.5	-68.5	166.9	0	0	0	109.7	H151 L152 S158 L159 I201	H151-I155 VanDerWaalsContact O-CG1 3.32Å; H151-I155 WeakPolarHBondContact O-CG1 3.34Å; H151-I155 PolarHBondContact O-N 2.89Å; L152-I155 PolarHBondContact O-N 3.31Å; I155-S158 PolarHBondContact O-N 2.74Å; I155-S158 PolarHBondContact O-OG 2.96Å; I155-L159 HydrophobicContact CG2-CD1 3.87Å; I155-L159 WeakPolarHBondContact O-CB 3.44Å; I155-L159 WeakPolarHBondContact O-CG 3.41Å; I155-L159 PolarHBondContact O-N 3Å; I155-I201 HydrophobicContact CG2-CG2 3.79Å
156	L	54.8	Low	55	Low	6 Å²	6	61.7 Å²	61.7	3%	0.031	34%	0.339	C	S	.	.	H	α-helix	trans	-69.2	-46.2	-178.4	-176.9	125.7	0	0	0	113.5	F136 L139 I140 L152 I153 N154 S158 L159 L160	F136-L156 HydrophobicContact CD1-CD1 3.93Å; F136-L156 HydrophobicContact CD1-CD2 4.37Å; F136-L156 HydrophobicContact CD1-CG 3.73Å; F136-L156 HydrophobicContact CE1-CG 4.39Å; F136-L156 WeakPolarHBondContact O-CD1 3.24Å; L139-L156 HydrophobicContact CB-CD1 3.09Å; L139-L156 HydrophobicContact CD1-CD1 4.14Å; L139-L156 HydrophobicContact CG-CD1 4.17Å; I140-L156 HydrophobicContact CD1-CD2 3.57Å; I140-L156 HydrophobicContact CG1-CD1 3.76Å; I140-L156 HydrophobicContact CG1-CD2 3.14Å; I140-L156 HydrophobicContact CG1-CG 4.03Å; L152-L156 HydrophobicContact CD2-CB 4.18Å; L152-L156 HydrophobicContact CD2-CD1 4.27Å; L152-L156 WeakPolarHBondContact O-CB 3.24Å; L152-L156 PolarHBondContact O-N 3.29Å; I153-L156 PolarHBondContact O-N 3.42Å; N154-L156 PolarHBondContact O-N 3.4Å; L156-S158 PolarHBondContact O-N 3.22Å; L156-L159 PolarHBondContact O-N 2.91Å; L156-L160 WeakPolarHBondContact O-CB 3.02Å; L156-L160 PolarHBondContact O-N 3.04Å
157	I	57.2	Low	54.8	Low	82 Å²	82	61.8 Å²	61.8	42%	0.421	34%	0.34	S	S	.	.	H	α-helix	trans	-58	-43.1	173.7	-72.1	172.6	0	0	0	108.8	I153 N154 L159 L160 V161	I153-I157 HydrophobicContact CG2-CD1 3.4Å; I153-I157 HydrophobicContact CG2-CG1 4.03Å; I153-I157 WeakPolarHBondContact O-CB 3.27Å; I153-I157 WeakPolarHBondContact O-CG1 3.47Å; I153-I157 PolarHBondContact O-N 3.15Å; N154-I157 PolarHBondContact O-N 2.75Å; I157-L159 VanDerWaalsContact C-N 3.34Å; I157-L159 PolarHBondContact O-N 2.93Å; I157-L160 PolarHBondContact O-N 3.4Å; I157-V161 HydrophobicContact CG2-CG2 4.21Å; I157-V161 WeakPolarHBondContact O-CB 3.41Å; I157-V161 VanDerWaalsContact O-CG2 3.26Å; I157-V161 WeakPolarHBondContact O-CG2 3.41Å; I157-V161 PolarHBondContact O-N 2.89Å
158	S	51.5	Low	54.7	Low	68 Å²	68	58.8 Å²	58.8	48%	0.476	33%	0.326	S	S	.	.	H	α-helix	trans	-62.7	-41.6	179.3	75.3	0	0	0	0	112.3	N154 I155 L156 L162	N154-S158 VanDerWaalsContact O-CB 3.32Å; N154-S158 WeakPolarHBondContact O-CB 3.48Å; N154-S158 PolarHBondContact O-N 3.03Å; N154-S158 PolarHBondContact O-OG 3.16Å; I155-S158 PolarHBondContact O-N 2.74Å; I155-S158 PolarHBondContact O-OG 2.96Å; L156-S158 PolarHBondContact O-N 3.22Å; S158-L162 VanDerWaalsContact O-CB 3.24Å; S158-L162 WeakPolarHBondContact O-CB 3.08Å; S158-L162 PolarHBondContact O-N 3.27Å
159	L	56.6	Low	54.7	Low	13 Å²	13	60.6 Å²	60.6	7%	0.068	34%	0.336	C	S	.	.	H	α-helix	trans	-67.3	-38.5	175.4	-78.4	161.8	0	0	0	111.5	F136 I155 L156 I157 L162 S163 F194 I197 I201	F136-L159 HydrophobicContact CD1-CB 4.49Å; F136-L159 HydrophobicContact CE1-CB 3.24Å; F136-L159 HydrophobicContact CE1-CD1 4.3Å; F136-L159 HydrophobicContact CE1-CG 4.38Å; F136-L159 HydrophobicContact CZ-CB 3.44Å; F136-L159 VanDerWaalsContact CZ-CB 3.44Å; F136-L159 VanDerWaalsContact CZ-O 3.27Å; F136-L159 WeakPolarHBondContact CZ-O 3.43Å; I155-L159 HydrophobicContact CG2-CD1 3.87Å; I155-L159 WeakPolarHBondContact O-CB 3.44Å; I155-L159 WeakPolarHBondContact O-CG 3.41Å; I155-L159 PolarHBondContact O-N 3Å; L156-L159 PolarHBondContact O-N 2.91Å; I157-L159 VanDerWaalsContact C-N 3.34Å; I157-L159 PolarHBondContact O-N 2.93Å; L159-L162 PolarHBondContact O-N 2.92Å; L159-S163 WeakPolarHBondContact O-CB 3.05Å; L159-S163 PolarHBondContact O-N 3.5Å; L159-F194 HydrophobicContact CD2-CD1 4.48Å; L159-F194 HydrophobicContact CD2-CE1 4.22Å; L159-I197 HydrophobicContact CD2-CG2 4.42Å; L159-I201 HydrophobicContact CD1-CD1 3.72Å; L159-I201 HydrophobicContact CD1-CG2 4.44Å; L159-I201 HydrophobicContact CD2-CD1 3.98Å; L159-I201 HydrophobicContact CG-CD1 4.29Å
160	L	58.4	Low	54.5	Low	49 Å²	49	59.1 Å²	59.1	26%	0.257	33%	0.329	S	S	.	.	H	α-helix	trans	-64.6	-47.6	176.9	-178.8	106.6	0	0	0	110.8	L133 F136 L156 I157 L162 S163 V164	L133-L160 HydrophobicContact CD2-CD1 3.79Å; F136-L160 HydrophobicContact CB-CD1 4.08Å; F136-L160 HydrophobicContact CD1-CB 4.3Å; F136-L160 HydrophobicContact CD2-CB 4.16Å; F136-L160 HydrophobicContact CD2-CD1 3.64Å; F136-L160 HydrophobicContact CD2-CG 4.39Å; F136-L160 HydrophobicContact CE1-CB 4.31Å; F136-L160 VanDerWaalsContact CE2-CA 3.49Å; F136-L160 HydrophobicContact CE2-CB 4.1Å; F136-L160 HydrophobicContact CE2-CD1 4.31Å; F136-L160 HydrophobicContact CG-CB 4.27Å; F136-L160 HydrophobicContact CG-CD1 3.84Å; F136-L160 VanDerWaalsContact CZ-CA 3.49Å; F136-L160 HydrophobicContact CZ-CB 4.23Å; L156-L160 WeakPolarHBondContact O-CB 3.02Å; L156-L160 PolarHBondContact O-N 3.04Å; I157-L160 PolarHBondContact O-N 3.4Å; L160-L162 VanDerWaalsContact C-N 3.28Å; L160-L162 PolarHBondContact O-N 2.82Å; L160-S163 PolarHBondContact O-N 3.44Å; L160-S163 PolarHBondContact O-OG 3.05Å; L160-V164 WeakPolarHBondContact O-CB 3.15Å; L160-V164 VanDerWaalsContact O-CG2 3.27Å; L160-V164 WeakPolarHBondContact O-CG2 3.47Å; L160-V164 PolarHBondContact O-N 3.45Å
161	V	58.1	Low	54.4	Low	79 Å²	79	56.9 Å²	56.9	48%	0.479	31%	0.313	S	S	.	.	H	α-helix	trans	-58.1	-46.5	174.5	171.4	0	0	0	0	109.4	I157 S163 V164 V165	I157-V161 HydrophobicContact CG2-CG2 4.21Å; I157-V161 WeakPolarHBondContact O-CB 3.41Å; I157-V161 VanDerWaalsContact O-CG2 3.26Å; I157-V161 WeakPolarHBondContact O-CG2 3.41Å; I157-V161 PolarHBondContact O-N 2.89Å; V161-S163 PolarHBondContact O-N 3.33Å; V161-V164 PolarHBondContact O-N 3.08Å; V161-V165 HydrophobicContact CG1-CG2 4.25Å; V161-V165 WeakPolarHBondContact O-CB 3.4Å; V161-V165 WeakPolarHBondContact O-CG2 3.48Å; V161-V165 PolarHBondContact O-N 3.35Å
162	L	55.4	Low	54.3	Low	86 Å²	86	52.7 Å²	52.7	45%	0.45	30%	0.298	S	S	.	.	H	α-helix	trans	-63.1	-40.9	180	-170.4	61.3	0	0	0	112.2	S158 L159 L160 V165 I166 F194	S158-L162 VanDerWaalsContact O-CB 3.24Å; S158-L162 WeakPolarHBondContact O-CB 3.08Å; S158-L162 PolarHBondContact O-N 3.27Å; L159-L162 PolarHBondContact O-N 2.92Å; L160-L162 VanDerWaalsContact C-N 3.28Å; L160-L162 PolarHBondContact O-N 2.82Å; L162-V165 PolarHBondContact O-N 2.96Å; L162-I166 HydrophobicContact CD1-CD1 4.48Å; L162-I166 HydrophobicContact CG-CD1 4.15Å; L162-I166 WeakPolarHBondContact O-CB 3.49Å; L162-I166 WeakPolarHBondContact O-CD1 3.32Å; L162-I166 VanDerWaalsContact O-CG1 3.26Å; L162-I166 WeakPolarHBondContact O-CG1 3.19Å; L162-I166 PolarHBondContact O-N 2.91Å; L162-F194 HydrophobicContact CB-CE1 4.15Å; L162-F194 HydrophobicContact CB-CZ 4.27Å; L162-F194 HydrophobicContact CD2-CE1 3.73Å; L162-F194 HydrophobicContact CD2-CZ 3.38Å; L162-F194 HydrophobicContact CG-CE1 3.86Å; L162-F194 HydrophobicContact CG-CZ 3.48Å; L162-F194 VanDerWaalsContact CG-CZ 3.48Å
163	S	57.1	Low	54.1	Low	4 Å²	4	55.9 Å²	55.9	3%	0.028	32%	0.315	C	S	.	.	H	α-helix	trans	-68.1	-38.8	177.4	82.5	0	0	0	0	112.5	V132 F136 L159 L160 V161 I166 A167	V132-S163 VanDerWaalsContact CG1-CB 3.41Å; V132-S163 WeakPolarHBondContact CG1-OG 3.4Å; F136-S163 WeakPolarHBondContact CE2-OG 3.22Å; L159-S163 WeakPolarHBondContact O-CB 3.05Å; L159-S163 PolarHBondContact O-N 3.5Å; L160-S163 PolarHBondContact O-N 3.44Å; L160-S163 PolarHBondContact O-OG 3.05Å; V161-S163 PolarHBondContact O-N 3.33Å; S163-I166 PolarHBondContact O-N 3.23Å; S163-A167 WeakPolarHBondContact O-CB 3.49Å; S163-A167 PolarHBondContact O-N 2.82Å
164	V	58.7	Low	53.8	Low	58 Å²	58	54.3 Å²	54.3	35%	0.352	31%	0.309	S	S	.	.	H	α-helix	trans	-65.9	-44.1	175.4	171.4	0	0	0	0	109.8	L160 V161 I166 A167 V168	L160-V164 WeakPolarHBondContact O-CB 3.15Å; L160-V164 VanDerWaalsContact O-CG2 3.27Å; L160-V164 WeakPolarHBondContact O-CG2 3.47Å; L160-V164 PolarHBondContact O-N 3.45Å; V161-V164 PolarHBondContact O-N 3.08Å; V164-I166 VanDerWaalsContact C-N 3.3Å; V164-I166 PolarHBondContact O-N 3.36Å; V164-A167 WeakPolarHBondContact O-CB 3.41Å; V164-A167 PolarHBondContact O-N 3.41Å; V164-A167 VanDerWaalsContact O-N 3.14Å; V164-V168 HydrophobicContact CG1-CG2 4.3Å; V164-V168 WeakPolarHBondContact O-CB 3.35Å; V164-V168 VanDerWaalsContact O-CG2 3.29Å; V164-V168 WeakPolarHBondContact O-CG2 3.42Å; V164-V168 PolarHBondContact O-N 3.36Å
165	V	55.1	Low	53.7	Low	74 Å²	74	53.7 Å²	53.7	45%	0.448	31%	0.309	S	S	.	.	H	α-helix	trans	-58.1	-45.2	175.5	168.7	0	0	0	0	110.3	V161 L162 V168 V169	V161-V165 HydrophobicContact CG1-CG2 4.25Å; V161-V165 WeakPolarHBondContact O-CB 3.4Å; V161-V165 WeakPolarHBondContact O-CG2 3.48Å; V161-V165 PolarHBondContact O-N 3.35Å; L162-V165 PolarHBondContact O-N 2.96Å; V165-V168 PolarHBondContact O-N 2.64Å; V165-V169 HydrophobicContact CG1-CG2 4.25Å; V165-V169 WeakPolarHBondContact O-CB 3.37Å; V165-V169 WeakPolarHBondContact O-CG2 3.35Å; V165-V169 PolarHBondContact O-N 3.37Å
166	I	54.5	Low	53.3	Low	38 Å²	38	56.8 Å²	56.8	20%	0.195	33%	0.326	C	S	.	.	H	α-helix	trans	-64.9	-40.6	176.3	-72.3	163.4	0	0	0	111.6	L162 S163 V164 V168 V169 G170 V190 F194	L162-I166 HydrophobicContact CD1-CD1 4.48Å; L162-I166 HydrophobicContact CG-CD1 4.15Å; L162-I166 WeakPolarHBondContact O-CB 3.49Å; L162-I166 WeakPolarHBondContact O-CD1 3.32Å; L162-I166 VanDerWaalsContact O-CG1 3.26Å; L162-I166 WeakPolarHBondContact O-CG1 3.19Å; L162-I166 PolarHBondContact O-N 2.91Å; S163-I166 PolarHBondContact O-N 3.23Å; V164-I166 VanDerWaalsContact C-N 3.3Å; V164-I166 PolarHBondContact O-N 3.36Å; I166-V168 VanDerWaalsContact C-N 3.33Å; I166-V168 PolarHBondContact O-N 2.74Å; I166-V169 PolarHBondContact O-N 3.41Å; I166-G170 PolarHBondContact O-N 3.04Å; I166-V190 HydrophobicContact CB-CG1 4.49Å; I166-V190 HydrophobicContact CD1-CG1 3.81Å; I166-V190 HydrophobicContact CG1-CG1 4.42Å; I166-V190 HydrophobicContact CG2-CB 4.21Å; I166-V190 HydrophobicContact CG2-CG1 3.46Å; I166-V190 VanDerWaalsContact CG2-CG1 3.46Å; I166-F194 HydrophobicContact CD1-CD2 3.89Å; I166-F194 HydrophobicContact CD1-CE1 4.31Å; I166-F194 HydrophobicContact CD1-CE2 3.01Å; I166-F194 HydrophobicContact CD1-CZ 3.29Å
167	A	51.2	Low	52.8	Low	7 Å²	7	63 Å²	63	6%	0.058	35%	0.352	C	S	.	.	H	α-helix	trans	-61.8	-44.4	177.1	0	0	0	0	0	111	I129 S163 V164 G170 F171 Y187	I129-A167 HydrophobicContact CD1-CB 4.34Å; I129-A167 HydrophobicContact CG1-CB 4.09Å; S163-A167 WeakPolarHBondContact O-CB 3.49Å; S163-A167 PolarHBondContact O-N 2.82Å; V164-A167 WeakPolarHBondContact O-CB 3.41Å; V164-A167 PolarHBondContact O-N 3.41Å; V164-A167 VanDerWaalsContact O-N 3.14Å; A167-G170 PolarHBondContact O-N 3.4Å; A167-F171 VanDerWaalsContact O-CB 3.31Å; A167-F171 WeakPolarHBondContact O-CB 3.12Å; A167-F171 PolarHBondContact O-N 3.44Å; A167-Y187 HydrophobicContact CB-CE2 4.4Å
168	V	56.9	Low	52.4	Low	76 Å²	76	67.7 Å²	67.7	46%	0.461	37%	0.37	S	S	.	.	H	α-helix	trans	-65.3	-47.8	176.1	172.7	0	0	0	0	110.8	V164 V165 I166 G170 F171 V172	V164-V168 HydrophobicContact CG1-CG2 4.3Å; V164-V168 WeakPolarHBondContact O-CB 3.35Å; V164-V168 VanDerWaalsContact O-CG2 3.29Å; V164-V168 WeakPolarHBondContact O-CG2 3.42Å; V164-V168 PolarHBondContact O-N 3.36Å; V165-V168 PolarHBondContact O-N 2.64Å; I166-V168 VanDerWaalsContact C-N 3.33Å; I166-V168 PolarHBondContact O-N 2.74Å; V168-G170 VanDerWaalsContact C-N 3.32Å; V168-G170 PolarHBondContact O-N 3.23Å; V168-F171 WeakPolarHBondContact O-CB 3.42Å; V168-F171 PolarHBondContact O-N 2.73Å; V168-V172 HydrophobicContact CG1-CG2 4.31Å; V168-V172 WeakPolarHBondContact O-CB 3.18Å; V168-V172 VanDerWaalsContact O-CG2 3.23Å; V168-V172 WeakPolarHBondContact O-CG2 3.27Å; V168-V172 PolarHBondContact O-N 2.64Å
169	V	52.1	Low	52.2	Low	75 Å²	75	73.8 Å²	73.8	46%	0.455	38%	0.382	S	S	.	.	H	α-helix	trans	-61.6	-42.6	177.6	169.8	0	0	0	0	110.6	V165 I166 V172 L173	V165-V169 HydrophobicContact CG1-CG2 4.25Å; V165-V169 WeakPolarHBondContact O-CB 3.37Å; V165-V169 WeakPolarHBondContact O-CG2 3.35Å; V165-V169 PolarHBondContact O-N 3.37Å; I166-V169 PolarHBondContact O-N 3.41Å; V169-V172 PolarHBondContact O-N 3.32Å; V169-L173 HydrophobicContact CG1-CD1 3.86Å; V169-L173 HydrophobicContact CG1-CG 4.32Å; V169-L173 WeakPolarHBondContact O-CB 3.44Å; V169-L173 VanDerWaalsContact O-CG 3.24Å; V169-L173 WeakPolarHBondContact O-CG 3.25Å; V169-L173 PolarHBondContact O-N 3.4Å
170	G	48.9	Very low	51.7	Low	11 Å²	11	77.8 Å²	77.8	11%	0.113	40%	0.399	C	S	.	.	H	α-helix	trans	-63.7	-42.5	176.4	0	0	0	0	0	112.4	I166 A167 V168 L173 S174	I166-G170 PolarHBondContact O-N 3.04Å; A167-G170 PolarHBondContact O-N 3.4Å; V168-G170 VanDerWaalsContact C-N 3.32Å; V168-G170 PolarHBondContact O-N 3.23Å; G170-L173 PolarHBondContact O-N 3.38Å; G170-S174 WeakPolarHBondContact O-CB 3.12Å; G170-S174 PolarHBondContact O-N 3.35Å
171	F	52.2	Low	51.3	Low	84 Å²	84	83.2 Å²	83.2	37%	0.368	42%	0.421	S	S	.	.	H	α-helix	trans	-61.4	-51.1	173	-179	-94.1	0	0	0	111.1	Y122 A167 V168 L173 S174 V175	Y122-F171 HydrophobicContact CD1-CE2 4.3Å; Y122-F171 AromaticContact CE1-CE2 3.77Å; Y122-F171 HydrophobicContact CE1-CE2 3.77Å; A167-F171 VanDerWaalsContact O-CB 3.31Å; A167-F171 WeakPolarHBondContact O-CB 3.12Å; A167-F171 PolarHBondContact O-N 3.44Å; V168-F171 WeakPolarHBondContact O-CB 3.42Å; V168-F171 PolarHBondContact O-N 2.73Å; F171-L173 VanDerWaalsContact C-N 3.32Å; F171-L173 PolarHBondContact O-N 3.13Å; F171-S174 WeakPolarHBondContact O-CA 3.2Å; F171-S174 WeakPolarHBondContact O-CB 3.11Å; F171-S174 PolarHBondContact O-N 3.34Å; F171-S174 PolarHBondContact O-OG 2.91Å; F171-V175 HydrophobicContact CD1-CG2 4.23Å; F171-V175 HydrophobicContact CE1-CG2 3.88Å; F171-V175 HydrophobicContact CZ-CG2 4.12Å; F171-V175 WeakPolarHBondContact O-CG2 3.04Å; F171-V175 PolarHBondContact O-N 3.42Å
172	V	51.1	Low	50.7	Low	65 Å²	65	82.9 Å²	82.9	39%	0.394	42%	0.421	S	S	.	.	H	α-helix	trans	-58.3	-44.6	178.2	169.3	0	0	0	0	110.6	V168 V169 S174 V175 L176	V168-V172 HydrophobicContact CG1-CG2 4.31Å; V168-V172 WeakPolarHBondContact O-CB 3.18Å; V168-V172 VanDerWaalsContact O-CG2 3.23Å; V168-V172 WeakPolarHBondContact O-CG2 3.27Å; V168-V172 PolarHBondContact O-N 2.64Å; V169-V172 PolarHBondContact O-N 3.32Å; V172-S174 VanDerWaalsContact C-N 3.31Å; V172-S174 PolarHBondContact O-N 2.92Å; V172-V175 PolarHBondContact O-N 2.85Å; V172-L176 HydrophobicContact CG1-CD1 3.47Å; V172-L176 VanDerWaalsContact CG1-CD1 3.47Å; V172-L176 HydrophobicContact CG1-CG 4.06Å; V172-L176 VanDerWaalsContact O-CB 3.31Å; V172-L176 WeakPolarHBondContact O-CB 3.39Å; V172-L176 VanDerWaalsContact O-CG 3.24Å; V172-L176 WeakPolarHBondContact O-CG 3.31Å; V172-L176 PolarHBondContact O-N 3.34Å
173	L	45.9	Very low	50.3	Low	70 Å²	70	79.6 Å²	79.6	37%	0.366	40%	0.404	S	S	.	.	H	α-helix	trans	-63.7	-35.4	175.1	-74.2	171.3	0	0	0	112.4	V169 G170 F171 V175 L176 K177 T183	V169-L173 HydrophobicContact CG1-CD1 3.86Å; V169-L173 HydrophobicContact CG1-CG 4.32Å; V169-L173 WeakPolarHBondContact O-CB 3.44Å; V169-L173 VanDerWaalsContact O-CG 3.24Å; V169-L173 WeakPolarHBondContact O-CG 3.25Å; V169-L173 PolarHBondContact O-N 3.4Å; G170-L173 PolarHBondContact O-N 3.38Å; F171-L173 VanDerWaalsContact C-N 3.32Å; F171-L173 PolarHBondContact O-N 3.13Å; L173-V175 VanDerWaalsContact C-N 3.29Å; L173-L176 PolarHBondContact O-N 2.97Å; L173-K177 PolarHBondContact O-N 3.17Å; L173-T183 HydrophobicContact CB-CG2 3.56Å
174	S	46.6	Very low	49.9	Very low	26 Å²	26	81.4 Å²	81.4	18%	0.182	41%	0.413	C	S	.	.	H	α-helix	trans	-68.6	-31.5	177.5	80.2	0	0	0	0	112.2	G170 F171 V172	G170-S174 WeakPolarHBondContact O-CB 3.12Å; G170-S174 PolarHBondContact O-N 3.35Å; F171-S174 WeakPolarHBondContact O-CA 3.2Å; F171-S174 WeakPolarHBondContact O-CB 3.11Å; F171-S174 PolarHBondContact O-N 3.34Å; F171-S174 PolarHBondContact O-OG 2.91Å; V172-S174 VanDerWaalsContact C-N 3.31Å; V172-S174 PolarHBondContact O-N 2.92Å
175	V	50	Low	49.3	Very low	94 Å²	94	81 Å²	81	57%	0.57	42%	0.42	S	S	*	.	H	α-helix	trans	-77.6	-44.3	174.8	175.1	0	0	0	0	110.8	F171 V172 L173	F171-V175 HydrophobicContact CD1-CG2 4.23Å; F171-V175 HydrophobicContact CE1-CG2 3.88Å; F171-V175 HydrophobicContact CZ-CG2 4.12Å; F171-V175 WeakPolarHBondContact O-CG2 3.04Å; F171-V175 PolarHBondContact O-N 3.42Å; V172-V175 PolarHBondContact O-N 2.85Å; L173-V175 VanDerWaalsContact C-N 3.29Å
176	L	47.3	Very low	49	Very low	128 Å²	128	81.8 Å²	81.8	67%	0.67	43%	0.425	S	S	*	.	H	α-helix	trans	-73	-41.9	-174.5	-74	175.3	0	0	0	113.4	V172 L173	V172-L176 HydrophobicContact CG1-CD1 3.47Å; V172-L176 VanDerWaalsContact CG1-CD1 3.47Å; V172-L176 HydrophobicContact CG1-CG 4.06Å; V172-L176 VanDerWaalsContact O-CB 3.31Å; V172-L176 WeakPolarHBondContact O-CB 3.39Å; V172-L176 VanDerWaalsContact O-CG 3.24Å; V172-L176 WeakPolarHBondContact O-CG 3.31Å; V172-L176 PolarHBondContact O-N 3.34Å; L173-L176 PolarHBondContact O-N 2.97Å
177	K	43.7	Very low	48.8	Very low	135 Å²	135	81.2 Å²	81.2	59%	0.587	42%	0.42	S	S	*	.			trans	-96.1	116.9	-179.2	-82.1	-173.4	174.9	179	0	110.3	L173 R179	L173-K177 PolarHBondContact O-N 3.17Å; K177-R179 CarbonylContact O-C 3.47Å; K177-R179 PolarHBondContact O-N 3.32Å
178	K	49.6	Very low	48.9	Very low	181 Å²	181	83.6 Å²	83.6	79%	0.787	43%	0.434	S	S	*	.	S	Bend	trans	-49.9	-15.9	169.8	-68.6	-174.3	179.3	-176.9	0	114.2	K180	K178-K180 PolarHBondContact O-N 2.98Å
179	R	46.4	Very low	48.6	Very low	196 Å²	196	81.8 Å²	81.8	74%	0.74	43%	0.431	S	S	*	.			trans	-86.1	88.6	173.6	-70.7	-162.8	-172.9	-166.5	3.8	111.4	K177 F181 P182 T183	K177-R179 CarbonylContact O-C 3.47Å; K177-R179 PolarHBondContact O-N 3.32Å; R179-F181 PolarHBondContact O-N 3.45Å; R179-P182 HydrophobicContact CB-CG 3.85Å; R179-P182 WeakPolarHBondContact O-CD 3.37Å; R179-T183 PolarHBondContact O-OG1 2.79Å
180	K	47	Very low	48.6	Very low	98 Å²	98	80 Å²	80	43%	0.426	42%	0.42	S	S	.	.	H	α-helix	trans	-58.5	-42.3	178.4	-65.4	-179.1	179.4	178.5	0	113.3	L121 K178 I184 C249	L121-K180 HydrophobicContact CD1-CB 4.14Å; L121-K180 HydrophobicContact CD1-CD 4.15Å; L121-K180 HydrophobicContact CD1-CG 4.29Å; K178-K180 PolarHBondContact O-N 2.98Å; K180-I184 WeakPolarHBondContact O-CD1 3.13Å; K180-I184 WeakPolarHBondContact O-CG1 3.48Å; K180-I184 PolarHBondContact O-N 3.22Å; K180-C249 PolarHBondContact NZ-O 3.4Å
181	F	48.8	Very low	48.7	Very low	162 Å²	162	79.8 Å²	79.8	71%	0.711	42%	0.416	S	S	*	.	H	α-helix	trans	-64.4	-53.8	-170.4	-70.4	-80.4	0	0	0	116.6	R179 T183 I184 G185	R179-F181 PolarHBondContact O-N 3.45Å; F181-T183 VanDerWaalsContact C-N 3.31Å; F181-T183 PolarHBondContact O-N 3.24Å; F181-I184 PolarHBondContact O-N 2.81Å; F181-G185 PolarHBondContact O-N 3.24Å
182	P	45.8	Very low	48.9	Very low	73 Å²	73	80.3 Å²	80.3	47%	0.474	42%	0.422	S	S	.	.	H	α-helix	trans	-65.7	-34.6	-175.9	23.3	-32.9	0	0	0	112.4	R179 I184 G185 V186	R179-P182 HydrophobicContact CB-CG 3.85Å; R179-P182 WeakPolarHBondContact O-CD 3.37Å; P182-I184 VanDerWaalsContact C-N 3.27Å; P182-I184 PolarHBondContact O-N 3.28Å; P182-G185 PolarHBondContact O-N 2.73Å; P182-V186 WeakPolarHBondContact O-CG2 3.44Å; P182-V186 PolarHBondContact O-N 2.9Å; P182-V186 VanDerWaalsContact O-N 3.1Å
183	T	46.9	Very low	49	Very low	16 Å²	16	81.9 Å²	81.9	10%	0.098	43%	0.427	C	S	.	.	H	α-helix	trans	-64.2	-34.6	178.6	-41.8	0	0	0	0	111.9	L173 R179 F181 Y187	L173-T183 HydrophobicContact CB-CG2 3.56Å; R179-T183 PolarHBondContact O-OG1 2.79Å; F181-T183 VanDerWaalsContact C-N 3.31Å; F181-T183 PolarHBondContact O-N 3.24Å; T183-Y187 PolarHBondContact O-N 3.24Å
184	I	48.4	Very low	49.4	Very low	43 Å²	43	79.4 Å²	79.4	22%	0.221	41%	0.414	C	S	.	.	H	α-helix	trans	-71	-42.7	176.9	-61.7	158.4	0	0	0	111.1	L121 L124 K180 F181 P182 V186 Y187 V188	L121-I184 HydrophobicContact CD1-CD1 3.58Å; L121-I184 HydrophobicContact CD1-CG1 4.21Å; L121-I184 HydrophobicContact CG-CD1 3.92Å; L121-I184 HydrophobicContact CG-CG1 4.25Å; L124-I184 HydrophobicContact CD2-CG2 3.9Å; K180-I184 WeakPolarHBondContact O-CD1 3.13Å; K180-I184 WeakPolarHBondContact O-CG1 3.48Å; K180-I184 PolarHBondContact O-N 3.22Å; F181-I184 PolarHBondContact O-N 2.81Å; P182-I184 VanDerWaalsContact C-N 3.27Å; P182-I184 PolarHBondContact O-N 3.28Å; I184-V186 VanDerWaalsContact C-N 3.27Å; I184-V186 PolarHBondContact O-N 3.31Å; I184-Y187 WeakPolarHBondContact O-CA 3.46Å; I184-Y187 WeakPolarHBondContact O-CB 3.33Å; I184-Y187 PolarHBondContact O-N 3Å; I184-V188 HydrophobicContact CG2-CG2 4.3Å; I184-V188 WeakPolarHBondContact O-CG2 3.3Å; I184-V188 PolarHBondContact O-N 2.82Å
185	G	48.2	Very low	49.8	Very low	48 Å²	48	80.3 Å²	80.3	50%	0.495	42%	0.415	S	S	.	.	H	α-helix	trans	-59	-41.7	176.7	0	0	0	0	0	111.8	F181 P182 G189	F181-G185 PolarHBondContact O-N 3.24Å; P182-G185 PolarHBondContact O-N 2.73Å; G185-G189 PolarHBondContact O-N 3.18Å
186	V	48.4	Very low	50.1	Low	92 Å²	92	79.6 Å²	79.6	56%	0.558	41%	0.407	S	S	*	.	H	α-helix	trans	-63.6	-43.5	172.2	176.5	0	0	0	0	110.7	P182 I184 G189 V190	P182-V186 WeakPolarHBondContact O-CG2 3.44Å; P182-V186 PolarHBondContact O-N 2.9Å; P182-V186 VanDerWaalsContact O-N 3.1Å; I184-V186 VanDerWaalsContact C-N 3.27Å; I184-V186 PolarHBondContact O-N 3.31Å; V186-G189 PolarHBondContact O-N 3.19Å; V186-V190 HydrophobicContact CG1-CG2 4Å; V186-V190 WeakPolarHBondContact O-CB 3.4Å; V186-V190 WeakPolarHBondContact O-CG2 3.5Å; V186-V190 PolarHBondContact O-N 3.01Å
187	Y	49.4	Very low	50.4	Low	25 Å²	25	76.6 Å²	76.6	10%	0.098	39%	0.391	C	S	.	.	H	α-helix	trans	-58.2	-54	178	-163.9	-90.8	0	0	0	112.1	A125 I129 A167 T183 I184 G189 V190 Q191	A125-Y187 HydrophobicContact CB-CE1 4.28Å; A125-Y187 PolarHBondContact O-OH 3.34Å; I129-Y187 VanDerWaalsContact CG1-OH 3.3Å; I129-Y187 WeakPolarHBondContact CG1-OH 3.5Å; A167-Y187 HydrophobicContact CB-CE2 4.4Å; T183-Y187 PolarHBondContact O-N 3.24Å; I184-Y187 WeakPolarHBondContact O-CA 3.46Å; I184-Y187 WeakPolarHBondContact O-CB 3.33Å; I184-Y187 PolarHBondContact O-N 3Å; Y187-G189 VanDerWaalsContact C-N 3.34Å; Y187-G189 PolarHBondContact O-N 3.14Å; Y187-V190 PolarHBondContact O-N 3.21Å; Y187-Q191 HydrophobicContact CD1-CG 4.12Å; Y187-Q191 HydrophobicContact CE1-CG 4.04Å; Y187-Q191 VanDerWaalsContact O-CG 3.24Å; Y187-Q191 WeakPolarHBondContact O-CG 3.41Å; Y187-Q191 PolarHBondContact O-N 3.29Å
188	V	52.6	Low	50.7	Low	57 Å²	57	70.5 Å²	70.5	35%	0.345	37%	0.365	S	S	.	.	H	α-helix	trans	-61.9	-44.1	179.4	176.4	0	0	0	0	110.6	L124 I184 Q191 I192	L124-V188 HydrophobicContact CD2-CG2 4.11Å; I184-V188 HydrophobicContact CG2-CG2 4.3Å; I184-V188 WeakPolarHBondContact O-CG2 3.3Å; I184-V188 PolarHBondContact O-N 2.82Å; V188-Q191 PolarHBondContact O-N 2.91Å; V188-I192 HydrophobicContact CG1-CD1 3.81Å; V188-I192 HydrophobicContact CG1-CG1 4.45Å; V188-I192 VanDerWaalsContact O-CG1 3.31Å; V188-I192 WeakPolarHBondContact O-CG1 3.18Å; V188-I192 PolarHBondContact O-N 3.33Å
189	G	51.1	Low	50.9	Low	38 Å²	38	64.8 Å²	64.8	39%	0.392	34%	0.342	S	S	.	.	H	α-helix	trans	-61.8	-44.1	178.7	0	0	0	0	0	112.8	G185 V186 Y187 I192 L193	G185-G189 PolarHBondContact O-N 3.18Å; V186-G189 PolarHBondContact O-N 3.19Å; Y187-G189 VanDerWaalsContact C-N 3.34Å; Y187-G189 PolarHBondContact O-N 3.14Å; G189-I192 PolarHBondContact O-N 3.43Å; G189-L193 WeakPolarHBondContact O-CB 3.41Å; G189-L193 PolarHBondContact O-N 3.42Å
190	V	52	Low	51.2	Low	37 Å²	37	61.5 Å²	61.5	22%	0.224	33%	0.334	C	S	.	.	H	α-helix	trans	-66	-41.2	177.3	178.5	0	0	0	0	110.5	I166 V186 Y187 I192 L193 F194	I166-V190 HydrophobicContact CB-CG1 4.49Å; I166-V190 HydrophobicContact CD1-CG1 3.81Å; I166-V190 HydrophobicContact CG1-CG1 4.42Å; I166-V190 HydrophobicContact CG2-CB 4.21Å; I166-V190 HydrophobicContact CG2-CG1 3.46Å; I166-V190 VanDerWaalsContact CG2-CG1 3.46Å; V186-V190 HydrophobicContact CG1-CG2 4Å; V186-V190 WeakPolarHBondContact O-CB 3.4Å; V186-V190 WeakPolarHBondContact O-CG2 3.5Å; V186-V190 PolarHBondContact O-N 3.01Å; Y187-V190 PolarHBondContact O-N 3.21Å; V190-I192 PolarHBondContact O-N 3.33Å; V190-L193 PolarHBondContact O-N 3.37Å; V190-F194 HydrophobicContact CG1-CD2 3.7Å; V190-F194 HydrophobicContact CG1-CE2 3.88Å; V190-F194 WeakPolarHBondContact O-CD2 3.36Å; V190-F194 PolarHBondContact O-N 2.98Å
191	Q	51.4	Low	51.4	Low	7 Å²	7	58.8 Å²	58.8	3%	0.033	32%	0.323	C	S	.	.	H	α-helix	trans	-64.5	-40	177.3	-62.5	-64.5	41.6	0	0	112.6	V132 Y187 V188 L193 F194 F195	V132-Q191 VanDerWaalsContact CG2-OE1 3.27Å; Y187-Q191 HydrophobicContact CD1-CG 4.12Å; Y187-Q191 HydrophobicContact CE1-CG 4.04Å; Y187-Q191 VanDerWaalsContact O-CG 3.24Å; Y187-Q191 WeakPolarHBondContact O-CG 3.41Å; Y187-Q191 PolarHBondContact O-N 3.29Å; V188-Q191 PolarHBondContact O-N 2.91Å; Q191-L193 VanDerWaalsContact C-N 3.35Å; Q191-F194 PolarHBondContact O-N 2.89Å; Q191-F195 WeakPolarHBondContact O-CB 3.42Å; Q191-F195 PolarHBondContact O-N 3.27Å
192	I	55.6	Low	51.2	Low	96 Å²	96	51.3 Å²	51.3	49%	0.492	29%	0.291	S	S	.	.	H	α-helix	trans	-63.1	-43	173.4	-67.6	167.5	0	0	0	110.6	V188 G189 V190 F195 I196	V188-I192 HydrophobicContact CG1-CD1 3.81Å; V188-I192 HydrophobicContact CG1-CG1 4.45Å; V188-I192 VanDerWaalsContact O-CG1 3.31Å; V188-I192 WeakPolarHBondContact O-CG1 3.18Å; V188-I192 PolarHBondContact O-N 3.33Å; G189-I192 PolarHBondContact O-N 3.43Å; V190-I192 PolarHBondContact O-N 3.33Å; I192-F195 WeakPolarHBondContact O-CB 3.27Å; I192-F195 PolarHBondContact O-N 2.72Å; I192-I196 HydrophobicContact CG2-CD1 4.17Å; I192-I196 WeakPolarHBondContact O-CG1 3.37Å; I192-I196 PolarHBondContact O-N 3.42Å
193	L	55.1	Low	51.3	Low	97 Å²	97	53 Å²	53	51%	0.508	29%	0.293	S	S	.	.	H	α-helix	trans	-63.5	-43.5	178.1	-173.9	67.3	0	0	0	111.5	G189 V190 Q191 F195 I196 I197	G189-L193 WeakPolarHBondContact O-CB 3.41Å; G189-L193 PolarHBondContact O-N 3.42Å; V190-L193 PolarHBondContact O-N 3.37Å; Q191-L193 VanDerWaalsContact C-N 3.35Å; L193-F195 VanDerWaalsContact C-N 3.27Å; L193-F195 PolarHBondContact O-N 3.44Å; L193-I196 PolarHBondContact O-N 3.04Å; L193-I197 HydrophobicContact CG-CD1 4.05Å; L193-I197 VanDerWaalsContact O-CG1 3.32Å; L193-I197 WeakPolarHBondContact O-CG1 3.1Å; L193-I197 PolarHBondContact O-N 3.47Å
194	F	52.6	Low	51.1	Low	18 Å²	18	60.4 Å²	60.4	8%	0.079	32%	0.324	C	S	.	.	H	α-helix	trans	-57.7	-43.2	173.2	-98.7	-94.1	0	0	0	111.6	L159 L162 I166 V190 Q191 I196 I197 T198	L159-F194 HydrophobicContact CD2-CD1 4.48Å; L159-F194 HydrophobicContact CD2-CE1 4.22Å; L162-F194 HydrophobicContact CB-CE1 4.15Å; L162-F194 HydrophobicContact CB-CZ 4.27Å; L162-F194 HydrophobicContact CD2-CE1 3.73Å; L162-F194 HydrophobicContact CD2-CZ 3.38Å; L162-F194 HydrophobicContact CG-CE1 3.86Å; L162-F194 HydrophobicContact CG-CZ 3.48Å; L162-F194 VanDerWaalsContact CG-CZ 3.48Å; I166-F194 HydrophobicContact CD1-CD2 3.89Å; I166-F194 HydrophobicContact CD1-CE1 4.31Å; I166-F194 HydrophobicContact CD1-CE2 3.01Å; I166-F194 HydrophobicContact CD1-CZ 3.29Å; V190-F194 HydrophobicContact CG1-CD2 3.7Å; V190-F194 HydrophobicContact CG1-CE2 3.88Å; V190-F194 WeakPolarHBondContact O-CD2 3.36Å; V190-F194 PolarHBondContact O-N 2.98Å; Q191-F194 PolarHBondContact O-N 2.89Å; F194-I196 PolarHBondContact O-N 3.19Å; F194-I197 PolarHBondContact O-N 3.35Å; F194-T198 WeakPolarHBondContact O-CB 3.38Å; F194-T198 PolarHBondContact O-N 2.79Å; F194-T198 PolarHBondContact O-OG1 2.8Å
195	F	56.2	Low	50.7	Low	46 Å²	46	60.5 Å²	60.5	20%	0.202	33%	0.326	C	S	.	.	H	α-helix	trans	-60	-46.2	177.7	-173.7	-103.9	0	0	0	111.9	L131 T135 Q191 I192 L193 T198 I199 I223	L131-F195 HydrophobicContact CD2-CD2 4.48Å; T135-F195 HydrophobicContact CG2-CD2 3.98Å; T135-F195 HydrophobicContact CG2-CE2 3.92Å; T135-F195 WeakPolarHBondContact OG1-CD2 3.4Å; Q191-F195 WeakPolarHBondContact O-CB 3.42Å; Q191-F195 PolarHBondContact O-N 3.27Å; I192-F195 WeakPolarHBondContact O-CB 3.27Å; I192-F195 PolarHBondContact O-N 2.72Å; L193-F195 VanDerWaalsContact C-N 3.27Å; L193-F195 PolarHBondContact O-N 3.44Å; F195-T198 WeakPolarHBondContact O-CB 3.48Å; F195-T198 PolarHBondContact O-N 2.89Å; F195-I199 HydrophobicContact CD1-CD1 3.92Å; F195-I199 HydrophobicContact CE1-CD1 3.36Å; F195-I199 HydrophobicContact CE1-CG1 4.27Å; F195-I199 HydrophobicContact CZ-CD1 3.77Å; F195-I199 HydrophobicContact CZ-CG1 4.32Å; F195-I199 WeakPolarHBondContact O-CG1 3.35Å; F195-I199 PolarHBondContact O-N 3.09Å; F195-I223 HydrophobicContact CE1-CD1 3.7Å; F195-I223 HydrophobicContact CE1-CG1 3.93Å; F195-I223 HydrophobicContact CE2-CG1 4.49Å; F195-I223 HydrophobicContact CZ-CD1 3.51Å; F195-I223 HydrophobicContact CZ-CG1 3.43Å; F195-I223 VanDerWaalsContact CZ-CG1 3.43Å
196	I	56.2	Low	50.5	Low	78 Å²	78	58.9 Å²	58.9	40%	0.4	31%	0.307	S	S	.	.	H	α-helix	trans	-61.4	-49.8	176.1	-66.2	169.7	0	0	0	110.7	I192 L193 F194 T198 I199 F200	I192-I196 HydrophobicContact CG2-CD1 4.17Å; I192-I196 WeakPolarHBondContact O-CG1 3.37Å; I192-I196 PolarHBondContact O-N 3.42Å; L193-I196 PolarHBondContact O-N 3.04Å; F194-I196 PolarHBondContact O-N 3.19Å; I196-T198 PolarHBondContact O-N 3.32Å; I196-I199 PolarHBondContact O-N 3.27Å; I196-F200 HydrophobicContact CG2-CD2 3.78Å; I196-F200 HydrophobicContact CG2-CE2 3.84Å; I196-F200 WeakPolarHBondContact O-CD2 3.35Å; I196-F200 PolarHBondContact O-N 3.49Å
197	I	52.7	Low	50	Low	66 Å²	66	56 Å²	56	34%	0.338	30%	0.296	S	S	.	.	H	α-helix	trans	-56.2	-40.5	177.8	-70.5	167.8	0	0	0	110.4	L159 L193 F194 F200 I201	L159-I197 HydrophobicContact CD2-CG2 4.42Å; L193-I197 HydrophobicContact CG-CD1 4.05Å; L193-I197 VanDerWaalsContact O-CG1 3.32Å; L193-I197 WeakPolarHBondContact O-CG1 3.1Å; L193-I197 PolarHBondContact O-N 3.47Å; F194-I197 PolarHBondContact O-N 3.35Å; I197-F200 WeakPolarHBondContact O-CB 3.12Å; I197-F200 PolarHBondContact O-N 2.76Å; I197-I201 HydrophobicContact CG2-CD1 3.62Å; I197-I201 HydrophobicContact CG2-CG1 4.22Å; I197-I201 WeakPolarHBondContact O-CB 3.46Å; I197-I201 WeakPolarHBondContact O-CG1 3.26Å; I197-I201 PolarHBondContact O-N 2.93Å
198	T	51.5	Low	49.7	Very low	6 Å²	6	63.7 Å²	63.7	4%	0.037	33%	0.33	C	S	.	.	H	α-helix	trans	-67	-41.5	-178.3	-61.9	0	0	0	0	112.3	T135 L139 F194 F195 I196 F200 I201 S202	T135-T198 HydrophobicContact CG2-CG2 3.37Å; L139-T198 HydrophobicContact CD1-CG2 3.03Å; L139-T198 HydrophobicContact CD2-CG2 4.27Å; L139-T198 HydrophobicContact CG-CG2 4.13Å; F194-T198 WeakPolarHBondContact O-CB 3.38Å; F194-T198 PolarHBondContact O-N 2.79Å; F194-T198 PolarHBondContact O-OG1 2.8Å; F195-T198 WeakPolarHBondContact O-CB 3.48Å; F195-T198 PolarHBondContact O-N 2.89Å; I196-T198 PolarHBondContact O-N 3.32Å; T198-F200 VanDerWaalsContact C-N 3.33Å; T198-I201 PolarHBondContact O-N 3.26Å; T198-S202 WeakPolarHBondContact O-CB 3.19Å; T198-S202 PolarHBondContact O-N 3.23Å
199	I	52.8	Low	49.2	Very low	62 Å²	62	66.3 Å²	66.3	32%	0.318	35%	0.351	S	S	.	.	H	α-helix	trans	-59.3	-46.5	170.9	-69.6	172	0	0	0	110.2	F195 I196 S202 H203 I223	F195-I199 HydrophobicContact CD1-CD1 3.92Å; F195-I199 HydrophobicContact CE1-CD1 3.36Å; F195-I199 HydrophobicContact CE1-CG1 4.27Å; F195-I199 HydrophobicContact CZ-CD1 3.77Å; F195-I199 HydrophobicContact CZ-CG1 4.32Å; F195-I199 WeakPolarHBondContact O-CG1 3.35Å; F195-I199 PolarHBondContact O-N 3.09Å; I196-I199 PolarHBondContact O-N 3.27Å; I199-S202 WeakPolarHBondContact O-CB 3.18Å; I199-S202 PolarHBondContact O-N 3.16Å; I199-H203 WeakPolarHBondContact O-CB 3.22Å; I199-H203 PolarHBondContact O-N 2.84Å; I199-I223 HydrophobicContact CD1-CD1 4.29Å
200	F	53.4	Low	48.7	Very low	127 Å²	127	70.2 Å²	70.2	56%	0.557	35%	0.354	S	S	*	.	H	α-helix	trans	-61.5	-46.7	179.3	-92.8	-78.3	0	0	0	112.4	I196 I197 T198 S202 H203 F204	I196-F200 HydrophobicContact CG2-CD2 3.78Å; I196-F200 HydrophobicContact CG2-CE2 3.84Å; I196-F200 WeakPolarHBondContact O-CD2 3.35Å; I196-F200 PolarHBondContact O-N 3.49Å; I197-F200 WeakPolarHBondContact O-CB 3.12Å; I197-F200 PolarHBondContact O-N 2.76Å; T198-F200 VanDerWaalsContact C-N 3.33Å; F200-S202 VanDerWaalsContact C-N 3.32Å; F200-S202 PolarHBondContact O-N 2.98Å; F200-H203 WeakPolarHBondContact O-CB 3.24Å; F200-H203 PolarHBondContact O-N 2.97Å; F200-H203 VanDerWaalsContact O-N 3.09Å; F200-F204 WeakPolarHBondContact O-CD2 3.4Å; F200-F204 PolarHBondContact O-N 3.4Å
201	I	50.2	Low	48	Very low	41 Å²	41	73.4 Å²	73.4	21%	0.21	36%	0.362	C	S	.	.	H	α-helix	trans	-60.9	-46.1	177	-71.6	172.8	0	0	0	109.4	I155 L159 I197 T198 H203 F204 T205	I155-I201 HydrophobicContact CG2-CG2 3.79Å; L159-I201 HydrophobicContact CD1-CD1 3.72Å; L159-I201 HydrophobicContact CD1-CG2 4.44Å; L159-I201 HydrophobicContact CD2-CD1 3.98Å; L159-I201 HydrophobicContact CG-CD1 4.29Å; I197-I201 HydrophobicContact CG2-CD1 3.62Å; I197-I201 HydrophobicContact CG2-CG1 4.22Å; I197-I201 WeakPolarHBondContact O-CB 3.46Å; I197-I201 WeakPolarHBondContact O-CG1 3.26Å; I197-I201 PolarHBondContact O-N 2.93Å; T198-I201 PolarHBondContact O-N 3.26Å; I201-H203 PolarHBondContact O-N 3.48Å; I201-F204 PolarHBondContact O-N 3.26Å; I201-T205 PolarHBondContact O-N 3.49Å; I201-T205 PolarHBondContact O-OG1 3.3Å
202	S	45.7	Very low	47.4	Very low	5 Å²	5	79 Å²	79	4%	0.035	39%	0.391	C	S	.	.	H	α-helix	trans	-56.9	-37	175.7	-169.4	0	0	0	0	112.6	T198 I199 F200 V206 L214	T198-S202 WeakPolarHBondContact O-CB 3.19Å; T198-S202 PolarHBondContact O-N 3.23Å; I199-S202 WeakPolarHBondContact O-CB 3.18Å; I199-S202 PolarHBondContact O-N 3.16Å; F200-S202 VanDerWaalsContact C-N 3.32Å; F200-S202 PolarHBondContact O-N 2.98Å; S202-V206 WeakPolarHBondContact O-CG2 3.41Å; S202-V206 PolarHBondContact O-N 2.91Å; S202-L214 WeakPolarHBondContact OG-CD1 3.48Å; S202-L214 WeakPolarHBondContact OG-CD2 3.42Å
203	H	46.8	Very low	46.8	Very low	109 Å²	109	75 Å²	75	51%	0.505	37%	0.371	S	S	.	.	H	α-helix	trans	-70.4	-35.7	177.7	-162	-37.9	0	0	0	112	I199 F200 I201 Y211	I199-H203 WeakPolarHBondContact O-CB 3.22Å; I199-H203 PolarHBondContact O-N 2.84Å; F200-H203 WeakPolarHBondContact O-CB 3.24Å; F200-H203 PolarHBondContact O-N 2.97Å; F200-H203 VanDerWaalsContact O-N 3.09Å; I201-H203 PolarHBondContact O-N 3.48Å; H203-Y211 AromaticContact CE1-CE1 3.63Å; H203-Y211 AromaticContact CE1-CZ 3.72Å; H203-Y211 PolarHBondContact CE1-OH 3.47Å; H203-Y211 AromaticContact NE2-CE1 3.83Å
204	F	42.9	Very low	46.1	Very low	171 Å²	171	72.4 Å²	72.4	75%	0.75	36%	0.357	S	S	*	.	H	α-helix	trans	-74.5	-44.8	176.1	-93.7	-81.1	0	0	0	112.7	F200 I201	F200-F204 WeakPolarHBondContact O-CD2 3.4Å; F200-F204 PolarHBondContact O-N 3.4Å; I201-F204 PolarHBondContact O-N 3.26Å
205	T	41	Very low	45.4	Very low	44 Å²	44	76.7 Å²	76.7	27%	0.27	37%	0.374	S	S	.	.	H	α-helix	trans	-74.2	-31.3	-169.6	-41.3	0	0	0	0	113.2	L152 I201 G207	L152-T205 HydrophobicContact CB-CG2 4.14Å; L152-T205 HydrophobicContact CD1-CG2 3.52Å; L152-T205 HydrophobicContact CG-CG2 3.78Å; I201-T205 PolarHBondContact O-N 3.49Å; I201-T205 PolarHBondContact O-OG1 3.3Å; T205-G207 VanDerWaalsContact C-N 3.34Å
206	V	42.7	Very low	44.6	Very low	15 Å²	15	78.2 Å²	78.2	9%	0.091	39%	0.388	C	S	.	.	S	Bend	trans	-87.5	-8.8	-176.9	-175.3	0	0	0	0	112.1	S202 R210 I213	S202-V206 WeakPolarHBondContact O-CG2 3.41Å; S202-V206 PolarHBondContact O-N 2.91Å; V206-R210 HydrophobicContact CG1-CB 3.54Å; V206-R210 WeakPolarHBondContact CG1-O 3.21Å; V206-R210 WeakPolarHBondContact O-CB 2.99Å; V206-I213 HydrophobicContact CG1-CB 4.43Å
207	G	38.6	Very low	43.9	Very low	32 Å²	32	79 Å²	79	33%	0.33	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.9	158.5	173.4	0	0	0	0	0	114	T205 S209 R210	T205-G207 VanDerWaalsContact C-N 3.34Å; G207-S209 PolarHBondContact O-N 2.81Å; G207-R210 PolarHBondContact O-N 3.02Å
208	K	42.6	Very low	43.6	Very low	185 Å²	185	79.7 Å²	79.7	80%	0.804	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-13.4	-175.5	-123.6	179.9	-177.2	-178.8	0	114.8	Y211	K208-Y211 HydrophobicContact CB-CE2 4.27Å; K208-Y211 HydrophobicContact CG-CE2 3.91Å; K208-Y211 WeakPolarHBondContact O-CD2 3.5Å; K208-Y211 WeakPolarHBondContact O-CE2 3.42Å
209	S	42.2	Very low	43.3	Very low	113 Å²	113	80.6 Å²	80.6	79%	0.79	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.8	-10.9	-176.6	65.6	0	0	0	0	114.4	G207	G207-S209 PolarHBondContact O-N 2.81Å
210	R	40.7	Very low	42.9	Very low	120 Å²	120	82 Å²	82	45%	0.453	41%	0.407	S	S	.	.			trans	-117.5	30.9	-178.9	-57.1	-179.4	175.9	-171.8	-1.4	113.7	A146 V206 G207 L212 I213	A146-R210 VanDerWaalsContact C-NH1 3.34Å; A146-R210 PolarHBondContact O-NH1 3.09Å; V206-R210 HydrophobicContact CG1-CB 3.54Å; V206-R210 WeakPolarHBondContact CG1-O 3.21Å; V206-R210 WeakPolarHBondContact O-CB 2.99Å; G207-R210 PolarHBondContact O-N 3.02Å; R210-L212 PolarHBondContact O-N 3.2Å; R210-I213 PolarHBondContact O-N 3.45Å
211	Y	38.2	Very low	42.4	Very low	104 Å²	104	77.7 Å²	77.7	41%	0.408	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.6	-10.9	164.6	-76.6	-77.5	0	0	0	114.8	H203 K208 I213 L214 Y215	H203-Y211 AromaticContact CE1-CE1 3.63Å; H203-Y211 AromaticContact CE1-CZ 3.72Å; H203-Y211 PolarHBondContact CE1-OH 3.47Å; H203-Y211 AromaticContact NE2-CE1 3.83Å; K208-Y211 HydrophobicContact CB-CE2 4.27Å; K208-Y211 HydrophobicContact CG-CE2 3.91Å; K208-Y211 WeakPolarHBondContact O-CD2 3.5Å; K208-Y211 WeakPolarHBondContact O-CE2 3.42Å; Y211-I213 VanDerWaalsContact C-N 3.26Å; Y211-I213 PolarHBondContact O-N 2.94Å; Y211-L214 CarbonylContact O-C 3.38Å; Y211-Y215 PolarHBondContact O-N 3.09Å
212	L	37.7	Very low	42.3	Very low	123 Å²	123	75.9 Å²	75.9	64%	0.644	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-20.1	177.3	-135.1	108.3	0	0	0	114.2	R210	R210-L212 PolarHBondContact O-N 3.2Å
213	I	42.3	Very low	42.4	Very low	13 Å²	13	78 Å²	78	7%	0.067	40%	0.396	C	S	.	.	S	Bend	trans	-92.1	-48.7	-172.4	-62.7	178.9	0	0	0	111.5	L95 A142 K145 A146 V206 R210 Y211	L95-I213 HydrophobicContact CD1-CG2 4.23Å; L95-I213 HydrophobicContact CD2-CB 4.17Å; L95-I213 HydrophobicContact CD2-CG2 3.45Å; L95-I213 VanDerWaalsContact CD2-CG2 3.45Å; L95-I213 WeakPolarHBondContact CD2-O 3.39Å; L95-I213 HydrophobicContact CG-CG2 4.49Å; A142-I213 HydrophobicContact CB-CG2 3.39Å; K145-I213 HydrophobicContact CB-CD1 4.08Å; K145-I213 HydrophobicContact CD-CD1 4.24Å; K145-I213 HydrophobicContact CD-CG1 4.11Å; K145-I213 HydrophobicContact CG-CD1 3.87Å; K145-I213 HydrophobicContact CG-CG1 4.3Å; A146-I213 HydrophobicContact CB-CD1 3.83Å; V206-I213 HydrophobicContact CG1-CB 4.43Å; R210-I213 PolarHBondContact O-N 3.45Å; Y211-I213 VanDerWaalsContact C-N 3.26Å; Y211-I213 PolarHBondContact O-N 2.94Å
214	L	40.3	Very low	42.3	Very low	42 Å²	42	77.1 Å²	77.1	22%	0.22	39%	0.394	C	S	.	.	S	Bend	trans	-102.4	81.5	159.4	-93.2	86.1	0	0	0	107.2	A142 S202 Y211 P216	A142-L214 HydrophobicContact CB-CD1 3.6Å; S202-L214 WeakPolarHBondContact OG-CD1 3.48Å; S202-L214 WeakPolarHBondContact OG-CD2 3.42Å; Y211-L214 CarbonylContact O-C 3.38Å; L214-P216 WeakPolarHBondContact O-CD 3.32Å
215	Y	38.8	Very low	42.5	Very low	108 Å²	108	73.3 Å²	73.3	42%	0.424	38%	0.381	S	S	.	.			trans	-55.1	127.3	156.4	-125.4	-93.8	0	0	0	105.6	Y211 D217 Y218 S219	Y211-Y215 PolarHBondContact O-N 3.09Å; Y215-D217 HydrophobicContact CD1-CB 3.88Å; Y215-D217 WeakPolarHBondContact CD1-OD2 3.22Å; Y215-D217 WeakPolarHBondContact CE1-OD2 3.17Å; Y215-D217 PolarHBondContact O-N 2.8Å; Y215-Y218 HydrophobicContact CD2-CE2 4.4Å; Y215-Y218 HydrophobicContact CG-CD2 4.33Å; Y215-Y218 HydrophobicContact CG-CE2 4.19Å; Y215-Y218 PolarHBondContact O-N 3.44Å; Y215-S219 PolarHBondContact O-N 2.95Å
216	P	39.8	Very low	42.9	Very low	78 Å²	78	71.7 Å²	71.7	51%	0.506	37%	0.37	S	S	.	.	H	α-helix	trans	-48.2	-36	173.6	15.7	-27.6	0	0	0	109.4	L214 Y218 S219 L220	L214-P216 WeakPolarHBondContact O-CD 3.32Å; P216-Y218 PolarHBondContact O-N 3.01Å; P216-S219 PolarHBondContact O-N 2.96Å; P216-S219 PolarHBondContact O-OG 3.28Å; P216-L220 WeakPolarHBondContact O-CA 3.39Å; P216-L220 WeakPolarHBondContact O-CB 3.49Å; P216-L220 PolarHBondContact O-N 3.36Å
217	D	41.9	Very low	43	Very low	96 Å²	96	74.8 Å²	74.8	51%	0.513	39%	0.389	S	S	.	.	H	α-helix	trans	-58.3	-36.7	173.3	-56.9	-17.8	0	0	0	115.1	Y215 A221	Y215-D217 HydrophobicContact CD1-CB 3.88Å; Y215-D217 WeakPolarHBondContact CD1-OD2 3.22Å; Y215-D217 WeakPolarHBondContact CE1-OD2 3.17Å; Y215-D217 PolarHBondContact O-N 2.8Å; D217-A221 WeakPolarHBondContact O-CA 3.2Å; D217-A221 WeakPolarHBondContact O-CB 3.16Å; D217-A221 PolarHBondContact O-N 2.82Å
218	Y	44.8	Very low	43.2	Very low	80 Å²	80	77.5 Å²	77.5	31%	0.314	40%	0.399	S	S	.	.	H	α-helix	trans	-75.4	-44.7	177.5	-68.3	-62.7	0	0	0	111.5	N96 F99 Y215 P216 L220 A221 A222	N96-Y218 PolarHBondContact ND2-OH 3.27Å; F99-Y218 VanDerWaalsContact CZ-O 3.24Å; F99-Y218 WeakPolarHBondContact CZ-O 3.37Å; Y215-Y218 HydrophobicContact CD2-CE2 4.4Å; Y215-Y218 HydrophobicContact CG-CD2 4.33Å; Y215-Y218 HydrophobicContact CG-CE2 4.19Å; Y215-Y218 PolarHBondContact O-N 3.44Å; P216-Y218 PolarHBondContact O-N 3.01Å; Y218-L220 VanDerWaalsContact C-N 3.3Å; Y218-L220 PolarHBondContact O-N 3.28Å; Y218-A221 PolarHBondContact O-N 3.04Å; Y218-A222 WeakPolarHBondContact O-CB 3.5Å; Y218-A222 PolarHBondContact O-N 2.71Å
219	S	46.5	Very low	43.3	Very low	24 Å²	24	70.3 Å²	70.3	17%	0.168	37%	0.368	C	S	.	.	H	α-helix	trans	-62.6	-42.5	175.5	65.7	0	0	0	0	110.8	Y215 P216 A222 I223	Y215-S219 PolarHBondContact O-N 2.95Å; P216-S219 PolarHBondContact O-N 2.96Å; P216-S219 PolarHBondContact O-OG 3.28Å; S219-A222 VanDerWaalsContact O-CB 3.27Å; S219-A222 WeakPolarHBondContact O-CB 3.06Å; S219-A222 PolarHBondContact O-N 2.96Å; S219-I223 WeakPolarHBondContact O-CB 3.33Å; S219-I223 WeakPolarHBondContact O-CD1 3.3Å; S219-I223 WeakPolarHBondContact O-CG1 3.47Å; S219-I223 PolarHBondContact O-N 3.39Å
220	L	43.4	Very low	43.5	Very low	93 Å²	93	67 Å²	67	49%	0.487	35%	0.345	S	S	.	.	H	α-helix	trans	-64.5	-42.1	174	-166.1	95.8	0	0	0	111.1	P216 Y218 I223 I224	P216-L220 WeakPolarHBondContact O-CA 3.39Å; P216-L220 WeakPolarHBondContact O-CB 3.49Å; P216-L220 PolarHBondContact O-N 3.36Å; Y218-L220 VanDerWaalsContact C-N 3.3Å; Y218-L220 PolarHBondContact O-N 3.28Å; L220-I223 CarbonylContact O-C 3.56Å; L220-I223 WeakPolarHBondContact O-CB 3.4Å; L220-I223 PolarHBondContact O-N 3.35Å; L220-I224 HydrophobicContact CD2-CD1 3.74Å; L220-I224 HydrophobicContact CG-CD1 3.86Å; L220-I224 HydrophobicContact CG-CG1 4.4Å; L220-I224 WeakPolarHBondContact O-CB 3.42Å; L220-I224 WeakPolarHBondContact O-CG1 3.23Å; L220-I224 PolarHBondContact O-N 3.37Å
221	A	43.9	Very low	43.4	Very low	36 Å²	36	64.1 Å²	64.1	30%	0.298	34%	0.343	S	S	.	.	H	α-helix	trans	-65.6	-40.6	176	0	0	0	0	0	111.2	D217 Y218 I223 I224 L225	D217-A221 WeakPolarHBondContact O-CA 3.2Å; D217-A221 WeakPolarHBondContact O-CB 3.16Å; D217-A221 PolarHBondContact O-N 2.82Å; Y218-A221 PolarHBondContact O-N 3.04Å; A221-I223 VanDerWaalsContact C-N 3.31Å; A221-I223 PolarHBondContact O-N 2.88Å; A221-I224 PolarHBondContact O-N 2.92Å; A221-L225 WeakPolarHBondContact O-CB 3.19Å; A221-L225 WeakPolarHBondContact O-CG 3.46Å; A221-L225 PolarHBondContact O-N 2.92Å
222	A	48	Very low	43.4	Very low	2 Å²	2	61.6 Å²	61.6	2%	0.017	34%	0.341	C	S	.	.	H	α-helix	trans	-54.8	-50	169.7	0	0	0	0	0	110.6	F99 F134 L138 Y218 S219 Y226	F99-A222 HydrophobicContact CE1-CB 4.36Å; F99-A222 HydrophobicContact CE2-CB 3.84Å; F99-A222 HydrophobicContact CZ-CB 3.3Å; F134-A222 HydrophobicContact CE1-CB 3.62Å; F134-A222 HydrophobicContact CZ-CB 3.77Å; L138-A222 HydrophobicContact CD1-CB 4.28Å; Y218-A222 WeakPolarHBondContact O-CB 3.5Å; Y218-A222 PolarHBondContact O-N 2.71Å; S219-A222 VanDerWaalsContact O-CB 3.27Å; S219-A222 WeakPolarHBondContact O-CB 3.06Å; S219-A222 PolarHBondContact O-N 2.96Å; A222-Y226 WeakPolarHBondContact O-CB 3Å; A222-Y226 PolarHBondContact O-N 3.06Å
223	I	47.5	Very low	43.5	Very low	51 Å²	51	56.4 Å²	56.4	26%	0.262	31%	0.313	S	S	.	.	H	α-helix	trans	-61.6	-49.1	179.7	-68.7	160.4	0	0	0	110.2	F195 I199 S219 L220 A221 Y226 T227	F195-I223 HydrophobicContact CE1-CD1 3.7Å; F195-I223 HydrophobicContact CE1-CG1 3.93Å; F195-I223 HydrophobicContact CE2-CG1 4.49Å; F195-I223 HydrophobicContact CZ-CD1 3.51Å; F195-I223 HydrophobicContact CZ-CG1 3.43Å; F195-I223 VanDerWaalsContact CZ-CG1 3.43Å; I199-I223 HydrophobicContact CD1-CD1 4.29Å; S219-I223 WeakPolarHBondContact O-CB 3.33Å; S219-I223 WeakPolarHBondContact O-CD1 3.3Å; S219-I223 WeakPolarHBondContact O-CG1 3.47Å; S219-I223 PolarHBondContact O-N 3.39Å; L220-I223 CarbonylContact O-C 3.56Å; L220-I223 WeakPolarHBondContact O-CB 3.4Å; L220-I223 PolarHBondContact O-N 3.35Å; A221-I223 VanDerWaalsContact C-N 3.31Å; A221-I223 PolarHBondContact O-N 2.88Å; I223-Y226 PolarHBondContact O-N 2.71Å; I223-T227 WeakPolarHBondContact O-CB 3.46Å; I223-T227 PolarHBondContact O-N 3.36Å; I223-T227 PolarHBondContact O-OG1 3.42Å
224	I	45.7	Very low	43.2	Very low	90 Å²	90	58.3 Å²	58.3	46%	0.462	33%	0.328	S	S	.	.	H	α-helix	trans	-62.6	-50.6	-178.6	-70.8	166	0	0	0	109.3	L220 A221 Y226 T227 V228	L220-I224 HydrophobicContact CD2-CD1 3.74Å; L220-I224 HydrophobicContact CG-CD1 3.86Å; L220-I224 HydrophobicContact CG-CG1 4.4Å; L220-I224 WeakPolarHBondContact O-CB 3.42Å; L220-I224 WeakPolarHBondContact O-CG1 3.23Å; L220-I224 PolarHBondContact O-N 3.37Å; A221-I224 PolarHBondContact O-N 2.92Å; I224-Y226 VanDerWaalsContact C-N 3.33Å; I224-Y226 PolarHBondContact O-N 2.89Å; I224-T227 PolarHBondContact O-N 2.55Å; I224-V228 HydrophobicContact CG2-CG2 4.07Å; I224-V228 VanDerWaalsContact O-CB 3.27Å; I224-V228 WeakPolarHBondContact O-CB 3.5Å; I224-V228 WeakPolarHBondContact O-CG2 3.44Å; I224-V228 PolarHBondContact O-N 3.18Å
225	L	46.3	Very low	42.9	Very low	91 Å²	91	61.9 Å²	61.9	48%	0.476	35%	0.351	S	S	.	.	H	α-helix	trans	-59.4	-44.9	178	-82.4	161.2	0	0	0	111	Y103 A221 F229	Y103-L225 HydrophobicContact CE1-CB 4.17Å; Y103-L225 HydrophobicContact CE1-CD1 4.46Å; Y103-L225 HydrophobicContact CE2-CB 4.24Å; Y103-L225 VanDerWaalsContact OH-CB 3.3Å; Y103-L225 WeakPolarHBondContact OH-CB 3.37Å; Y103-L225 PolarHBondContact OH-O 3.48Å; A221-L225 WeakPolarHBondContact O-CB 3.19Å; A221-L225 WeakPolarHBondContact O-CG 3.46Å; A221-L225 PolarHBondContact O-N 2.92Å; L225-F229 WeakPolarHBondContact O-CB 3.36Å; L225-F229 PolarHBondContact O-N 2.8Å
226	Y	48.4	Very low	42.6	Very low	9 Å²	9	63.6 Å²	63.6	4%	0.035	37%	0.368	C	S	.	.	H	α-helix	trans	-66.5	-38.2	177.2	-165.9	-93.6	0	0	0	112.8	Y103 M107 F127 L131 A222 I223 I224 F229 S230	Y103-Y226 HydrophobicContact CE2-CD2 4.34Å; Y103-Y226 PolarHBondContact OH-N 3.34Å; M107-Y226 HydrophobicContact SD-CD2 4Å; M107-Y226 HydrophobicContact SD-CE2 4.42Å; F127-Y226 HydrophobicContact CD1-CE1 4.45Å; F127-Y226 WeakPolarHBondContact CD2-OH 3.34Å; F127-Y226 AromaticContact CE1-CE1 3.45Å; F127-Y226 HydrophobicContact CE1-CE1 3.45Å; F127-Y226 VanDerWaalsContact CE1-CE1 3.45Å; F127-Y226 AromaticContact CE1-CZ 3.85Å; F127-Y226 AromaticContact CE2-CE1 3.83Å; F127-Y226 HydrophobicContact CE2-CE1 3.83Å; F127-Y226 HydrophobicContact CE2-CE2 4.29Å; F127-Y226 AromaticContact CE2-CZ 3.52Å; F127-Y226 WeakPolarHBondContact CE2-OH 3.24Å; F127-Y226 AromaticContact CZ-CD1 3.99Å; F127-Y226 HydrophobicContact CZ-CD1 3.99Å; F127-Y226 AromaticContact CZ-CE1 3.07Å; F127-Y226 HydrophobicContact CZ-CE1 3.07Å; F127-Y226 HydrophobicContact CZ-CE2 4.31Å; F127-Y226 AromaticContact CZ-CZ 3.28Å; F127-Y226 WeakPolarHBondContact CZ-OH 3.41Å; F127-Y226 PolarHBondContact O-OH 2.99Å; F127-Y226 VanDerWaalsContact O-OH 3.09Å; L131-Y226 HydrophobicContact CB-CE1 4.03Å; L131-Y226 HydrophobicContact CD1-CD1 3.37Å; L131-Y226 HydrophobicContact CD1-CE1 3.18Å; L131-Y226 HydrophobicContact CD1-CE2 4.49Å; L131-Y226 HydrophobicContact CD1-CG 4.12Å; L131-Y226 HydrophobicContact CG-CE1 4.18Å; L131-Y226 PolarHBondContact N-OH 3.38Å; A222-Y226 WeakPolarHBondContact O-CB 3Å; A222-Y226 PolarHBondContact O-N 3.06Å; I223-Y226 PolarHBondContact O-N 2.71Å; I224-Y226 VanDerWaalsContact C-N 3.33Å; I224-Y226 PolarHBondContact O-N 2.89Å; Y226-F229 PolarHBondContact O-N 2.82Å; Y226-S230 WeakPolarHBondContact O-CB 3.42Å; Y226-S230 PolarHBondContact O-N 3.41Å
227	T	45.1	Very low	42.5	Very low	80 Å²	80	62 Å²	62	49%	0.491	36%	0.357	S	S	.	.	H	α-helix	trans	-73.3	-46.5	-179.6	-54.8	0	0	0	0	111.3	I223 I224 F229 S230 S231	I223-T227 WeakPolarHBondContact O-CB 3.46Å; I223-T227 PolarHBondContact O-N 3.36Å; I223-T227 PolarHBondContact O-OG1 3.42Å; I224-T227 PolarHBondContact O-N 2.55Å; T227-F229 PolarHBondContact O-N 3.14Å; T227-S230 PolarHBondContact O-N 3.29Å; T227-S231 WeakPolarHBondContact O-CB 3.38Å; T227-S231 PolarHBondContact O-N 2.7Å; T227-S231 PolarHBondContact O-OG 3.43Å; T227-S231 VanDerWaalsContact O-OG 3.14Å
228	V	43.1	Very low	42.1	Very low	89 Å²	89	58.6 Å²	58.6	54%	0.539	34%	0.344	S	S	.	.	H	α-helix	trans	-57.6	-37.8	171.9	171.1	0	0	0	0	109.9	I224 S231 S232	I224-V228 HydrophobicContact CG2-CG2 4.07Å; I224-V228 VanDerWaalsContact O-CB 3.27Å; I224-V228 WeakPolarHBondContact O-CB 3.5Å; I224-V228 WeakPolarHBondContact O-CG2 3.44Å; I224-V228 PolarHBondContact O-N 3.18Å; V228-S231 WeakPolarHBondContact CA-OG 3.29Å; V228-S231 PolarHBondContact O-OG 2.81Å; V228-S232 VanDerWaalsContact O-CB 3.26Å; V228-S232 WeakPolarHBondContact O-CB 3.15Å; V228-S232 PolarHBondContact O-N 2.94Å; V228-S232 PolarHBondContact O-OG 2.85Å
229	F	45.6	Very low	41.8	Very low	35 Å²	35	56.8 Å²	56.8	15%	0.154	34%	0.339	C	S	.	.	H	α-helix	trans	-70	-48.5	175.8	-175.6	-101.6	0	0	0	112.6	M107 M111 L225 Y226 T227 S231 S232 L233	M107-F229 HydrophobicContact CE-CB 3.6Å; M107-F229 HydrophobicContact CE-CD1 3.35Å; M107-F229 HydrophobicContact CE-CD2 3.28Å; M107-F229 HydrophobicContact CE-CE1 3.79Å; M107-F229 HydrophobicContact CE-CE2 3.72Å; M107-F229 HydrophobicContact CE-CG 3.08Å; M107-F229 HydrophobicContact CE-CZ 3.95Å; M107-F229 HydrophobicContact SD-CB 4.28Å; M107-F229 HydrophobicContact SD-CD1 3.71Å; M107-F229 HydrophobicContact SD-CE1 4.22Å; M107-F229 HydrophobicContact SD-CG 3.96Å; M111-F229 HydrophobicContact CG-CE1 4.32Å; M111-F229 HydrophobicContact CG-CE2 4.26Å; M111-F229 HydrophobicContact CG-CZ 3.49Å; M111-F229 VanDerWaalsContact CG-CZ 3.49Å; M111-F229 HydrophobicContact SD-CE1 4.49Å; M111-F229 HydrophobicContact SD-CE2 4.13Å; M111-F229 HydrophobicContact SD-CZ 3.47Å; M111-F229 WeakPolarHBondContact SD-CZ 3.2Å; L225-F229 WeakPolarHBondContact O-CB 3.36Å; L225-F229 PolarHBondContact O-N 2.8Å; Y226-F229 PolarHBondContact O-N 2.82Å; T227-F229 PolarHBondContact O-N 3.14Å; F229-S231 PolarHBondContact O-N 3.37Å; F229-S232 WeakPolarHBondContact CA-OG 3.32Å; F229-S232 PolarHBondContact O-N 3.28Å; F229-S232 VanDerWaalsContact O-N 3.11Å; F229-S232 PolarHBondContact O-OG 3.45Å; F229-L233 HydrophobicContact CE1-CD1 4.37Å; F229-L233 HydrophobicContact CE1-CD2 4.3Å; F229-L233 HydrophobicContact CZ-CD1 4.05Å; F229-L233 WeakPolarHBondContact O-CB 3.39Å; F229-L233 PolarHBondContact O-N 3.41Å
230	S	45.3	Very low	41.1	Very low	43 Å²	43	66.8 Å²	66.8	30%	0.301	37%	0.373	S	S	.	.	H	α-helix	trans	-54.5	-40.9	175.5	-165.5	0	0	0	0	111.8	F127 Y226 T227 S234	F127-S230 WeakPolarHBondContact CE1-OG 3.24Å; F127-S230 WeakPolarHBondContact CZ-OG 3.5Å; Y226-S230 WeakPolarHBondContact O-CB 3.42Å; Y226-S230 PolarHBondContact O-N 3.41Å; T227-S230 PolarHBondContact O-N 3.29Å; S230-S234 VanDerWaalsContact O-CB 3.27Å; S230-S234 WeakPolarHBondContact O-CB 3.28Å; S230-S234 PolarHBondContact O-N 3.04Å
231	S	39.7	Very low	40.7	Very low	60 Å²	60	70.4 Å²	70.4	42%	0.42	39%	0.385	S	S	.	.	H	α-helix	trans	-72.1	-43.7	177.1	63.9	0	0	0	0	111.2	T227 V228 F229 L233 S234 V235	T227-S231 WeakPolarHBondContact O-CB 3.38Å; T227-S231 PolarHBondContact O-N 2.7Å; T227-S231 PolarHBondContact O-OG 3.43Å; T227-S231 VanDerWaalsContact O-OG 3.14Å; V228-S231 WeakPolarHBondContact CA-OG 3.29Å; V228-S231 PolarHBondContact O-OG 2.81Å; F229-S231 PolarHBondContact O-N 3.37Å; S231-L233 VanDerWaalsContact C-N 3.26Å; S231-L233 PolarHBondContact O-N 2.9Å; S231-S234 WeakPolarHBondContact O-CB 3.02Å; S231-S234 PolarHBondContact O-N 3.32Å; S231-V235 VanDerWaalsContact O-CG2 3.26Å; S231-V235 WeakPolarHBondContact O-CG2 3.05Å; S231-V235 PolarHBondContact O-N 2.88Å
232	S	38.1	Very low	40.5	Very low	51 Å²	51	70.5 Å²	70.5	36%	0.357	38%	0.382	S	S	.	.	H	α-helix	trans	-57.7	-40.9	174.6	77.4	0	0	0	0	111.6	V228 F229 V235 N236	V228-S232 VanDerWaalsContact O-CB 3.26Å; V228-S232 WeakPolarHBondContact O-CB 3.15Å; V228-S232 PolarHBondContact O-N 2.94Å; V228-S232 PolarHBondContact O-OG 2.85Å; F229-S232 WeakPolarHBondContact CA-OG 3.32Å; F229-S232 PolarHBondContact O-N 3.28Å; F229-S232 VanDerWaalsContact O-N 3.11Å; F229-S232 PolarHBondContact O-OG 3.45Å; S232-V235 PolarHBondContact O-N 3.29Å; S232-N236 VanDerWaalsContact O-CB 3.31Å; S232-N236 WeakPolarHBondContact O-CB 3.48Å; S232-N236 PolarHBondContact O-N 3.31Å
233	L	39.3	Very low	39.9	Very low	13 Å²	13	78.2 Å²	78.2	7%	0.068	41%	0.412	C	S	.	.	H	α-helix	trans	-69.3	-42.9	179.2	-160.4	76.9	0	0	0	111.3	M111 W114 F229 S231 V235 N236 T237	M111-L233 HydrophobicContact SD-CD1 3.75Å; W114-L233 HydrophobicContact CB-CD1 4.46Å; W114-L233 HydrophobicContact CB-CD2 4Å; W114-L233 HydrophobicContact CD2-CD2 3.34Å; W114-L233 HydrophobicContact CD2-CG 3.85Å; W114-L233 HydrophobicContact CE3-CD2 3.45Å; W114-L233 VanDerWaalsContact CE3-CD2 3.45Å; W114-L233 HydrophobicContact CE3-CG 4.37Å; W114-L233 HydrophobicContact CG-CD1 4.1Å; W114-L233 HydrophobicContact CG-CD2 3.58Å; W114-L233 HydrophobicContact CG-CG 3.92Å; W114-L233 HydrophobicContact CZ2-CD2 4.44Å; W114-L233 HydrophobicContact CZ2-CG 4.47Å; W114-L233 HydrophobicContact CZ3-CD2 4.05Å; F229-L233 HydrophobicContact CE1-CD1 4.37Å; F229-L233 HydrophobicContact CE1-CD2 4.3Å; F229-L233 HydrophobicContact CZ-CD1 4.05Å; F229-L233 WeakPolarHBondContact O-CB 3.39Å; F229-L233 PolarHBondContact O-N 3.41Å; S231-L233 VanDerWaalsContact C-N 3.26Å; S231-L233 PolarHBondContact O-N 2.9Å; L233-V235 VanDerWaalsContact C-N 3.28Å; L233-V235 PolarHBondContact O-N 3.25Å; L233-N236 PolarHBondContact O-N 2.96Å; L233-T237 HydrophobicContact CD1-CG2 4.39Å; L233-T237 HydrophobicContact CG-CG2 4.46Å; L233-T237 WeakPolarHBondContact O-CB 3.38Å; L233-T237 PolarHBondContact O-N 2.89Å; L233-T237 PolarHBondContact O-OG1 3.28Å
234	S	36.7	Very low	39.3	Very low	54 Å²	54	82.5 Å²	82.5	38%	0.378	44%	0.435	S	S	.	.	H	α-helix	trans	-57.2	-41.6	174.3	173.8	0	0	0	0	112	S230 S231 I239	S230-S234 VanDerWaalsContact O-CB 3.27Å; S230-S234 WeakPolarHBondContact O-CB 3.28Å; S230-S234 PolarHBondContact O-N 3.04Å; S231-S234 WeakPolarHBondContact O-CB 3.02Å; S231-S234 PolarHBondContact O-N 3.32Å; S234-I239 WeakPolarHBondContact OG-CD1 3.48Å
235	V	32.9	Very low	39	Very low	116 Å²	116	87.7 Å²	87.7	70%	0.703	46%	0.455	S	S	*	.	H	α-helix	trans	-75	-50	178.6	176.7	0	0	0	0	111.3	S231 S232 L233 T237 G238	S231-V235 VanDerWaalsContact O-CG2 3.26Å; S231-V235 WeakPolarHBondContact O-CG2 3.05Å; S231-V235 PolarHBondContact O-N 2.88Å; S232-V235 PolarHBondContact O-N 3.29Å; L233-V235 VanDerWaalsContact C-N 3.28Å; L233-V235 PolarHBondContact O-N 3.25Å; V235-T237 PolarHBondContact O-N 2.87Å; V235-G238 PolarHBondContact O-N 2.97Å
236	N	31.9	Very low	38.8	Very low	145 Å²	145	85.9 Å²	85.9	78%	0.775	45%	0.447	S	S	*	.	H	α-helix	trans	-70.5	-31.2	-171.9	-118.8	-10.4	0	0	0	113.3	S232 L233 G238	S232-N236 VanDerWaalsContact O-CB 3.31Å; S232-N236 WeakPolarHBondContact O-CB 3.48Å; S232-N236 PolarHBondContact O-N 3.31Å; L233-N236 PolarHBondContact O-N 2.96Å; N236-G238 PolarHBondContact O-N 3.42Å
237	T	38.4	Very low	38.3	Very low	45 Å²	45	88 Å²	88	28%	0.276	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	6.2	-175.9	61.2	0	0	0	0	113.8	W114 L233 V235 I239	W114-T237 VanDerWaalsContact CZ2-OG1 3.24Å; W114-T237 WeakPolarHBondContact CZ2-OG1 3.5Å; W114-T237 PolarHBondContact NE1-OG1 3.13Å; L233-T237 HydrophobicContact CD1-CG2 4.39Å; L233-T237 HydrophobicContact CG-CG2 4.46Å; L233-T237 WeakPolarHBondContact O-CB 3.38Å; L233-T237 PolarHBondContact O-N 2.89Å; L233-T237 PolarHBondContact O-OG1 3.28Å; V235-T237 PolarHBondContact O-N 2.87Å; T237-I239 PolarHBondContact O-N 3.32Å
238	G	34.5	Very low	38.1	Very low	24 Å²	24	89.7 Å²	89.7	25%	0.247	48%	0.478	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.9	60.6	178.4	0	0	0	0	0	109.4	V235 N236 W240 K241 V242	V235-G238 PolarHBondContact O-N 2.97Å; N236-G238 PolarHBondContact O-N 3.42Å; G238-W240 CarbonylContact O-C 3.58Å; G238-W240 PolarHBondContact O-N 3.47Å; G238-K241 WeakPolarHBondContact O-CA 3.42Å; G238-K241 PolarHBondContact O-N 2.92Å; G238-V242 PolarHBondContact O-N 3.48Å; G238-V242 VanDerWaalsContact O-N 3.08Å
239	I	36.6	Very low	38	Very low	41 Å²	41	87.1 Å²	87.1	21%	0.21	46%	0.464	C	S	.	.	H	α-helix	trans	-44	-34.1	171.9	-74.8	-176.1	0	0	0	110.7	W114 I120 S234 T237 V242 Y243	W114-I239 HydrophobicContact CH2-CD1 4.32Å; W114-I239 HydrophobicContact CZ2-CD1 4.43Å; W114-I239 HydrophobicContact CZ2-CG1 4.26Å; I120-I239 HydrophobicContact CD1-CB 4.39Å; I120-I239 HydrophobicContact CD1-CD1 4.43Å; I120-I239 HydrophobicContact CD1-CG1 4.12Å; I120-I239 HydrophobicContact CD1-CG2 3.78Å; S234-I239 WeakPolarHBondContact OG-CD1 3.48Å; T237-I239 PolarHBondContact O-N 3.32Å; I239-V242 PolarHBondContact O-N 3.12Å; I239-Y243 PolarHBondContact O-N 2.89Å
240	W	33.1	Very low	37.5	Very low	234 Å²	234	88.2 Å²	88.2	89%	0.886	48%	0.476	S	S	*	.	H	α-helix	trans	-60.8	-37.7	171.4	-70.1	99	0	0	0	115.7	G238	G238-W240 CarbonylContact O-C 3.58Å; G238-W240 PolarHBondContact O-N 3.47Å
241	K	34	Very low	37	Very low	170 Å²	170	93 Å²	93	74%	0.739	50%	0.497	S	S	*	.	H	α-helix	trans	-80.3	-32.3	174.9	-82.1	-176	176.5	176.3	0	113.1	G238 Y243 N244 K245	G238-K241 WeakPolarHBondContact O-CA 3.42Å; G238-K241 PolarHBondContact O-N 2.92Å; K241-Y243 VanDerWaalsContact C-N 3.29Å; K241-Y243 PolarHBondContact O-N 3.39Å; K241-N244 PolarHBondContact O-N 2.92Å; K241-K245 PolarHBondContact O-N 3.49Å
242	V	40.7	Very low	36.3	Very low	37 Å²	37	97.6 Å²	97.6	22%	0.224	51%	0.511	C	S	.	.	H	α-helix	trans	-64.8	-36.4	176.4	179.3	0	0	0	0	110.9	G238 I239 N244 K245 T246	G238-V242 PolarHBondContact O-N 3.48Å; G238-V242 VanDerWaalsContact O-N 3.08Å; I239-V242 PolarHBondContact O-N 3.12Å; V242-N244 PolarHBondContact O-N 2.95Å; V242-K245 PolarHBondContact O-N 3.45Å; V242-T246 WeakPolarHBondContact CG1-OG1 3.43Å; V242-T246 PolarHBondContact O-N 3.24Å; V242-T246 PolarHBondContact O-OG1 3.06Å
243	Y	35.2	Very low	36	Very low	165 Å²	165	102 Å²	102	65%	0.647	52%	0.524	S	S	*	.	H	α-helix	trans	-51.2	-29.8	170.2	-109.8	-83.5	0	0	0	113	I239 K241	I239-Y243 PolarHBondContact O-N 2.89Å; K241-Y243 VanDerWaalsContact C-N 3.29Å; K241-Y243 PolarHBondContact O-N 3.39Å
244	N	35.5	Very low	35.2	Very low	141 Å²	141	109.7 Å²	109.7	75%	0.754	56%	0.56	S	S	*	*	H	α-helix	trans	-96.2	-32.8	-177.1	-143.3	3.1	0	0	0	113.5	K241 V242	K241-N244 PolarHBondContact O-N 2.92Å; V242-N244 PolarHBondContact O-N 2.95Å
245	K	39.4	Very low	34.8	Very low	199 Å²	199	114.5 Å²	114.5	87%	0.865	58%	0.58	S	S	*	*	H	α-helix	trans	-79.9	-36.5	178	-93.1	-168.3	174.5	-172.2	0	113.7	K241 V242 G247	K241-K245 PolarHBondContact O-N 3.49Å; V242-K245 PolarHBondContact O-N 3.45Å; K245-G247 PolarHBondContact O-N 3.25Å
246	T	40.3	Very low	34.6	Very low	52 Å²	52	115.6 Å²	115.6	32%	0.319	58%	0.583	S	S	.	*			trans	-83.8	55	169.7	33.6	0	0	0	0	110.8	V242 N248 C249	V242-T246 WeakPolarHBondContact CG1-OG1 3.43Å; V242-T246 PolarHBondContact O-N 3.24Å; V242-T246 PolarHBondContact O-OG1 3.06Å; T246-N248 PolarHBondContact O-N 3.01Å; T246-C249 PolarHBondContact O-N 3.01Å
247	G	39.5	Very low	34.2	Very low	54 Å²	54	114.1 Å²	114.1	56%	0.557	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59	-9.4	170.9	0	0	0	0	0	113.8	K245	K245-G247 PolarHBondContact O-N 3.25Å
248	N	39.9	Very low	33.9	Very low	115 Å²	115	124.7 Å²	124.7	62%	0.615	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.5	34.3	-178.4	-85.5	-12	0	0	0	114.5	T246 S250	T246-N248 PolarHBondContact O-N 3.01Å; N248-S250 CarbonylContact O-C 3.56Å; N248-S250 PolarHBondContact O-N 3.44Å; N248-S250 PolarHBondContact OD1-OG 2.96Å
249	C	42.3	Very low	33.9	Very low	36 Å²	36	129.7 Å²	129.7	24%	0.243	65%	0.649	C	S	.	*			trans	-69.9	-0.6	154.5	-68	0	0	0	0	112.1	C119 K180 T246 I251	C119-C249 HydrophobicContact CB-CB 4.42Å; C119-C249 WeakPolarHBondContact CB-SG 3.44Å; C119-C249 WeakPolarHBondContact SG-CB 3.29Å; C119-C249 CovalentContact SG-SG 2.05Å; C119-C249 PolarHBondContact SG-SG 3.39Å; K180-C249 PolarHBondContact NZ-O 3.4Å; T246-C249 PolarHBondContact O-N 3.01Å; C249-I251 PolarHBondContact O-N 3.18Å
250	S	33.4	Very low	33.7	Very low	58 Å²	58	134.4 Å²	134.4	41%	0.406	67%	0.672	S	S	.	*	S	Bend	trans	-72	100.1	148.2	50.5	0	0	0	0	108.6	N248 Q252	N248-S250 CarbonylContact O-C 3.56Å; N248-S250 PolarHBondContact O-N 3.44Å; N248-S250 PolarHBondContact OD1-OG 2.96Å; S250-Q252 PolarHBondContact O-N 3.21Å
251	I	35	Very low	33.7	Very low	144 Å²	144	128.8 Å²	128.8	74%	0.738	66%	0.66	S	S	*	*			trans	-50.9	108.6	142.4	-65.8	168.6	0	0	0	103.7	C249 F253	C249-I251 PolarHBondContact O-N 3.18Å; I251-F253 WeakPolarHBondContact O-CD2 3.32Å; I251-F253 PolarHBondContact O-N 3.44Å; I251-F253 VanDerWaalsContact O-N 3.1Å
252	Q	25.4	Very low	33.7	Very low	156 Å²	156	126.4 Å²	126.4	73%	0.729	66%	0.655	S	S	*	*			trans	-57.6	118.5	-179.9	-82.1	-171.5	-32.5	0	0	107	S250 E254	S250-Q252 PolarHBondContact O-N 3.21Å; Q252-E254 PolarHBondContact O-N 3.41Å
253	F	31.8	Very low	33.3	Very low	143 Å²	143	132 Å²	132	63%	0.627	68%	0.682	S	S	*	*			trans	-74.8	113.6	173.4	-76.9	-90	0	0	0	107.4	I251 L255	I251-F253 WeakPolarHBondContact O-CD2 3.32Å; I251-F253 PolarHBondContact O-N 3.44Å; I251-F253 VanDerWaalsContact O-N 3.1Å; F253-L255 VanDerWaalsContact C-N 3.26Å; F253-L255 PolarHBondContact O-N 2.96Å; F253-L255 VanDerWaalsContact O-N 3.12Å
254	E	22.3	Very low	33.2	Very low	174 Å²	174	129.8 Å²	129.8	81%	0.813	68%	0.684	S	S	*	*			trans	-68.1	98	146.8	-136.3	167	-165.3	0	0	105.2	Q252 N256	Q252-E254 PolarHBondContact O-N 3.41Å; E254-N256 PolarHBondContact O-N 2.95Å
255	L	27.9	Very low	33	Very low	155 Å²	155	129 Å²	129	81%	0.812	68%	0.679	S	S	*	*			trans	-67.1	91.3	164.4	-87	153.1	0	0	0	105.8	F253 S257	F253-L255 VanDerWaalsContact C-N 3.26Å; F253-L255 PolarHBondContact O-N 2.96Å; F253-L255 VanDerWaalsContact O-N 3.12Å; L255-S257 VanDerWaalsContact C-N 3.32Å; L255-S257 PolarHBondContact O-N 3.25Å
256	N	28.8	Very low	32.5	Very low	140 Å²	140	123.6 Å²	123.6	75%	0.749	67%	0.665	S	S	*	*			trans	-62.3	104.8	159.3	-79	-3.5	0	0	0	106.3	E254 E258	E254-N256 PolarHBondContact O-N 2.95Å; N256-E258 PolarHBondContact O-N 3.43Å
257	S	24.4	Very low	31.8	Very low	114 Å²	114	129.6 Å²	129.6	80%	0.797	69%	0.694	S	S	*	*			trans	-70.5	104.7	167.2	55.1	0	0	0	0	108.3	L255	L255-S257 VanDerWaalsContact C-N 3.32Å; L255-S257 PolarHBondContact O-N 3.25Å
258	E	31.4	Very low	31.1	Very low	266 Å²	266	136.5 Å²	136.5	100%	1.243	71%	0.707	S	S	*	*			trans	-134.8	0	149.6	-79.9	-172.1	164.4	0	0	108.4	N256	N256-E258 PolarHBondContact O-N 3.43Å

Retrieved 258 of 258 residues in 403.2 ms (Link to these results)

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