A0A077ZGJ9_TRITR Loading...

Transmembrane protein 168

AlphaFold DB , UniProt , Accession A0A077ZGJ9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 503 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	45.8	Very low	34.3	Very low	185 Å²	185	133.7 Å²	133.7	91%	0.911	64%	0.644	S	S	*	*				0	-48.9	0	-97.3	-175.4	77	0	0	113.4	L3 T4 Q5	M1-L3 PolarHBondContact O-N 3.04Å; M1-T4 PolarHBondContact O-N 3.39Å; M1-T4 PolarHBondContact O-OG1 3.23Å; M1-Q5 PolarHBondContact O-N 3.34Å; M1-Q5 VanDerWaalsContact O-N 3.07Å
2	E	36.8	Very low	34.1	Very low	146 Å²	146	133.5 Å²	133.5	68%	0.682	64%	0.642	S	S	*	*	H	α-helix	trans	-66.7	-37.3	-173.7	-148.3	-179.6	175.3	0	0	113.9	R6	E2-R6 PolarHBondContact O-N 2.89Å
3	L	33.1	Very low	33.8	Very low	150 Å²	150	128.4 Å²	128.4	79%	0.785	62%	0.624	S	S	*	*	H	α-helix	trans	-66.4	-39.5	174.2	-100.7	150.6	0	0	0	112.8	M1 R6 A7	M1-L3 PolarHBondContact O-N 3.04Å; L3-R6 PolarHBondContact O-N 3.49Å; L3-A7 WeakPolarHBondContact O-CB 3.3Å; L3-A7 PolarHBondContact O-N 3.44Å
4	T	37.5	Very low	33.5	Very low	91 Å²	91	125.6 Å²	125.6	56%	0.558	61%	0.613	S	S	*	*	H	α-helix	trans	-67.3	-43.4	178.2	-7.7	0	0	0	0	111	M1 A7 L8	M1-T4 PolarHBondContact O-N 3.39Å; M1-T4 PolarHBondContact O-OG1 3.23Å; T4-A7 PolarHBondContact O-N 2.87Å; T4-L8 WeakPolarHBondContact O-CB 3.39Å; T4-L8 PolarHBondContact O-N 3.22Å
5	Q	34.7	Very low	33.3	Very low	130 Å²	130	124.7 Å²	124.7	61%	0.607	61%	0.612	S	S	*	*	H	α-helix	trans	-64.6	-41	173.3	-86.7	-176.8	-17.5	0	0	112.2	M1 L8 K9	M1-Q5 PolarHBondContact O-N 3.34Å; M1-Q5 VanDerWaalsContact O-N 3.07Å; Q5-L8 PolarHBondContact O-N 3.05Å; Q5-K9 VanDerWaalsContact O-CB 3.32Å; Q5-K9 WeakPolarHBondContact O-CB 3.46Å; Q5-K9 PolarHBondContact O-N 3.32Å
6	R	29.6	Very low	33.3	Very low	169 Å²	169	120.8 Å²	120.8	64%	0.638	61%	0.606	S	S	*	*	H	α-helix	trans	-62.1	-43.9	174	-84.1	-174.5	-179.2	179.1	3.2	112	E2 L3 K9 I10	E2-R6 PolarHBondContact O-N 2.89Å; L3-R6 PolarHBondContact O-N 3.49Å; R6-K9 PolarHBondContact O-N 2.83Å; R6-I10 WeakPolarHBondContact O-CB 3.48Å; R6-I10 WeakPolarHBondContact O-CD1 3.21Å; R6-I10 WeakPolarHBondContact O-CG1 3.26Å; R6-I10 PolarHBondContact O-N 2.99Å
7	A	33.4	Very low	33.1	Very low	58 Å²	58	121.2 Å²	121.2	48%	0.479	61%	0.605	S	S	.	*	H	α-helix	trans	-63.9	-42.3	177.4	0	0	0	0	0	112.2	L3 T4 K9 I10 R11	L3-A7 WeakPolarHBondContact O-CB 3.3Å; L3-A7 PolarHBondContact O-N 3.44Å; T4-A7 PolarHBondContact O-N 2.87Å; A7-K9 VanDerWaalsContact C-N 3.35Å; A7-K9 PolarHBondContact O-N 3.49Å; A7-I10 PolarHBondContact O-N 2.95Å; A7-R11 VanDerWaalsContact O-CB 3.31Å; A7-R11 WeakPolarHBondContact O-CB 3.39Å; A7-R11 PolarHBondContact O-N 3.44Å
8	L	35.8	Very low	33.2	Very low	104 Å²	104	119.8 Å²	119.8	55%	0.545	60%	0.604	S	S	.	*	H	α-helix	trans	-63.8	-39.8	175.2	-119	147.9	0	0	0	111.9	T4 Q5 R11 Q12	T4-L8 WeakPolarHBondContact O-CB 3.39Å; T4-L8 PolarHBondContact O-N 3.22Å; Q5-L8 PolarHBondContact O-N 3.05Å; L8-R11 PolarHBondContact O-N 3.35Å; L8-Q12 WeakPolarHBondContact O-CB 3.3Å; L8-Q12 WeakPolarHBondContact O-CG 3.48Å; L8-Q12 PolarHBondContact O-N 3.34Å
9	K	29.8	Very low	34.2	Very low	151 Å²	151	116.1 Å²	116.1	66%	0.657	59%	0.59	S	S	*	*	H	α-helix	trans	-69.4	-42	177.5	-143.8	174.1	-171	179.3	0	111.6	Q5 R6 A7 R11 Q12 V13	Q5-K9 VanDerWaalsContact O-CB 3.32Å; Q5-K9 WeakPolarHBondContact O-CB 3.46Å; Q5-K9 PolarHBondContact O-N 3.32Å; R6-K9 PolarHBondContact O-N 2.83Å; A7-K9 VanDerWaalsContact C-N 3.35Å; A7-K9 PolarHBondContact O-N 3.49Å; K9-R11 VanDerWaalsContact C-N 3.29Å; K9-R11 PolarHBondContact O-N 2.93Å; K9-Q12 PolarHBondContact O-N 3.25Å; K9-V13 WeakPolarHBondContact O-CB 3.47Å; K9-V13 WeakPolarHBondContact O-CG2 3.3Å; K9-V13 PolarHBondContact O-N 3.42Å
10	I	31	Very low	35	Very low	105 Å²	105	111.8 Å²	111.8	54%	0.538	57%	0.571	S	S	.	*	H	α-helix	trans	-62.4	-38.6	173.8	-67.9	163.4	0	0	0	110.4	R6 A7 V13 N14	R6-I10 WeakPolarHBondContact O-CB 3.48Å; R6-I10 WeakPolarHBondContact O-CD1 3.21Å; R6-I10 WeakPolarHBondContact O-CG1 3.26Å; R6-I10 PolarHBondContact O-N 2.99Å; A7-I10 PolarHBondContact O-N 2.95Å; I10-V13 PolarHBondContact O-N 2.74Å; I10-N14 WeakPolarHBondContact O-CB 3.37Å; I10-N14 PolarHBondContact O-N 3.22Å
11	R	30.3	Very low	35.8	Very low	182 Å²	182	113.6 Å²	113.6	69%	0.687	58%	0.575	S	S	*	*	H	α-helix	trans	-71.9	-41.5	178.7	-152.4	175.2	-165.4	177.9	4.5	112.7	A7 L8 K9 V13 N14 D15	A7-R11 VanDerWaalsContact O-CB 3.31Å; A7-R11 WeakPolarHBondContact O-CB 3.39Å; A7-R11 PolarHBondContact O-N 3.44Å; L8-R11 PolarHBondContact O-N 3.35Å; K9-R11 VanDerWaalsContact C-N 3.29Å; K9-R11 PolarHBondContact O-N 2.93Å; R11-V13 VanDerWaalsContact C-N 3.3Å; R11-V13 PolarHBondContact O-N 3.06Å; R11-N14 PolarHBondContact O-N 2.97Å; R11-D15 PolarHBondContact O-N 3.02Å
12	Q	31.9	Very low	36.1	Very low	131 Å²	131	107.2 Å²	107.2	61%	0.612	55%	0.548	S	S	*	.	H	α-helix	trans	-62.9	-36.9	173.1	-78.4	-177.9	-13	0	0	112.2	L8 K9 A16	L8-Q12 WeakPolarHBondContact O-CB 3.3Å; L8-Q12 WeakPolarHBondContact O-CG 3.48Å; L8-Q12 PolarHBondContact O-N 3.34Å; K9-Q12 PolarHBondContact O-N 3.25Å; Q12-A16 WeakPolarHBondContact O-CB 3.4Å; Q12-A16 PolarHBondContact O-N 3.28Å; Q12-A16 VanDerWaalsContact O-N 3.16Å
13	V	29.6	Very low	37.1	Very low	67 Å²	67	100.7 Å²	100.7	41%	0.406	52%	0.518	S	S	.	.	H	α-helix	trans	-68.5	-44.2	175.2	172.8	0	0	0	0	110.7	K9 I10 R11 A16 E17	K9-V13 WeakPolarHBondContact O-CB 3.47Å; K9-V13 WeakPolarHBondContact O-CG2 3.3Å; K9-V13 PolarHBondContact O-N 3.42Å; I10-V13 PolarHBondContact O-N 2.74Å; R11-V13 VanDerWaalsContact C-N 3.3Å; R11-V13 PolarHBondContact O-N 3.06Å; V13-A16 PolarHBondContact O-N 3.25Å; V13-E17 HydrophobicContact CG1-CG 4.36Å; V13-E17 WeakPolarHBondContact O-CB 3.35Å; V13-E17 WeakPolarHBondContact O-CG 3.4Å; V13-E17 PolarHBondContact O-N 2.94Å
14	N	29.4	Very low	38.4	Very low	90 Å²	90	95.5 Å²	95.5	48%	0.481	49%	0.491	S	S	.	.	H	α-helix	trans	-66.6	-41.8	178.8	-84.5	-9.5	0	0	0	113.4	I10 R11 A16 V18	I10-N14 WeakPolarHBondContact O-CB 3.37Å; I10-N14 PolarHBondContact O-N 3.22Å; R11-N14 PolarHBondContact O-N 2.97Å; N14-A16 VanDerWaalsContact C-N 3.31Å; N14-A16 PolarHBondContact O-N 3.14Å; N14-V18 WeakPolarHBondContact O-CB 3.26Å; N14-V18 WeakPolarHBondContact O-CG2 3.3Å; N14-V18 PolarHBondContact O-N 2.88Å; N14-V18 VanDerWaalsContact O-N 3.16Å
15	D	31.4	Very low	39.4	Very low	112 Å²	112	96.9 Å²	96.9	60%	0.599	49%	0.49	S	S	*	.	H	α-helix	trans	-70.3	-29.9	178.4	-73	-20.6	0	0	0	111.8	R11	R11-D15 PolarHBondContact O-N 3.02Å
16	A	32.9	Very low	40.7	Very low	61 Å²	61	91 Å²	91	50%	0.504	46%	0.463	S	S	.	.	H	α-helix	trans	-78.8	-35.5	177.2	0	0	0	0	0	113.3	Q12 V13 N14 P20	Q12-A16 WeakPolarHBondContact O-CB 3.4Å; Q12-A16 PolarHBondContact O-N 3.28Å; Q12-A16 VanDerWaalsContact O-N 3.16Å; V13-A16 PolarHBondContact O-N 3.25Å; N14-A16 VanDerWaalsContact C-N 3.31Å; N14-A16 PolarHBondContact O-N 3.14Å; A16-P20 WeakPolarHBondContact O-CD 3.22Å
17	E	29.6	Very low	42.4	Very low	128 Å²	128	83 Å²	83	60%	0.598	43%	0.433	S	S	*	.	H	α-helix	trans	-87.8	-26.3	-175.5	-72	-174.6	174.7	0	0	114.2	V13 S19 P20	V13-E17 HydrophobicContact CG1-CG 4.36Å; V13-E17 WeakPolarHBondContact O-CB 3.35Å; V13-E17 WeakPolarHBondContact O-CG 3.4Å; V13-E17 PolarHBondContact O-N 2.94Å; E17-S19 VanDerWaalsContact C-N 3.35Å; E17-S19 PolarHBondContact O-N 3Å; E17-P20 VanDerWaalsContact O-CD 3.24Å; E17-P20 WeakPolarHBondContact O-CD 3.21Å; E17-P20 WeakPolarHBondContact O-CG 3.45Å
18	V	34.4	Very low	43.9	Very low	97 Å²	97	81.8 Å²	81.8	59%	0.588	42%	0.423	S	S	*	.	H	α-helix	trans	-72.3	-27.4	179.5	175.2	0	0	0	0	112.3	N14 S22	N14-V18 WeakPolarHBondContact O-CB 3.26Å; N14-V18 WeakPolarHBondContact O-CG2 3.3Å; N14-V18 PolarHBondContact O-N 2.88Å; N14-V18 VanDerWaalsContact O-N 3.16Å; V18-S22 WeakPolarHBondContact O-CB 3.42Å; V18-S22 PolarHBondContact O-N 3.16Å; V18-S22 PolarHBondContact O-OG 3Å
19	S	52.4	Low	45.2	Very low	48 Å²	48	79.1 Å²	79.1	34%	0.336	41%	0.411	S	S	.	.	H	α-helix	trans	-73	-43.1	179	76	0	0	0	0	115.6	E17 S22 T23	E17-S19 VanDerWaalsContact C-N 3.35Å; E17-S19 PolarHBondContact O-N 3Å; S19-S22 PolarHBondContact O-OG 3.13Å; S19-S22 VanDerWaalsContact O-OG 3.06Å; S19-T23 WeakPolarHBondContact O-CB 3.46Å; S19-T23 PolarHBondContact O-N 2.94Å; S19-T23 VanDerWaalsContact O-N 3.11Å; S19-T23 PolarHBondContact O-OG1 2.83Å
20	P	50.9	Low	46.8	Very low	31 Å²	31	72 Å²	72	20%	0.201	38%	0.379	C	S	.	.	H	α-helix	trans	-70.5	-41.4	-177.8	22.9	-34	0	0	0	113.2	A16 E17 T23 L24 L68	A16-P20 WeakPolarHBondContact O-CD 3.22Å; E17-P20 VanDerWaalsContact O-CD 3.24Å; E17-P20 WeakPolarHBondContact O-CD 3.21Å; E17-P20 WeakPolarHBondContact O-CG 3.45Å; P20-T23 PolarHBondContact O-N 3.28Å; P20-L24 WeakPolarHBondContact O-CB 3.47Å; P20-L24 PolarHBondContact O-N 2.83Å; P20-L68 HydrophobicContact CB-CD1 4.26Å; P20-L68 HydrophobicContact CB-CD2 3.41Å; P20-L68 VanDerWaalsContact CB-CD2 3.41Å; P20-L68 HydrophobicContact CB-CG 4.35Å
21	F	51.3	Low	48.6	Very low	150 Å²	150	67 Å²	67	66%	0.658	35%	0.354	S	S	*	.	H	α-helix	trans	-67.8	-46.9	-178.3	-176.7	-95.4	0	0	0	111.7	T23 L24 F25	F21-T23 VanDerWaalsContact C-N 3.29Å; F21-T23 PolarHBondContact O-N 2.95Å; F21-L24 PolarHBondContact O-N 3.16Å; F21-F25 WeakPolarHBondContact O-CB 3.44Å; F21-F25 PolarHBondContact O-N 3.29Å
22	S	52.2	Low	50.5	Low	51 Å²	51	61.3 Å²	61.3	36%	0.357	34%	0.34	S	S	.	.	H	α-helix	trans	-59.1	-43.1	175.8	57.5	0	0	0	0	111.1	V18 S19 F25 V26	V18-S22 WeakPolarHBondContact O-CB 3.42Å; V18-S22 PolarHBondContact O-N 3.16Å; V18-S22 PolarHBondContact O-OG 3Å; S19-S22 PolarHBondContact O-OG 3.13Å; S19-S22 VanDerWaalsContact O-OG 3.06Å; S22-F25 PolarHBondContact O-N 2.87Å; S22-V26 WeakPolarHBondContact O-CB 3.48Å; S22-V26 WeakPolarHBondContact O-CG2 3.18Å; S22-V26 PolarHBondContact O-N 3.13Å
23	T	57.7	Low	52	Low	8 Å²	8	55.1 Å²	55.1	5%	0.049	31%	0.311	C	S	.	.	H	α-helix	trans	-68.4	-39.3	178.5	-52.7	0	0	0	0	112.8	S19 P20 F21 V26 S27 F73 L77	S19-T23 WeakPolarHBondContact O-CB 3.46Å; S19-T23 PolarHBondContact O-N 2.94Å; S19-T23 VanDerWaalsContact O-N 3.11Å; S19-T23 PolarHBondContact O-OG1 2.83Å; P20-T23 PolarHBondContact O-N 3.28Å; F21-T23 VanDerWaalsContact C-N 3.29Å; F21-T23 PolarHBondContact O-N 2.95Å; T23-V26 PolarHBondContact O-N 2.93Å; T23-S27 WeakPolarHBondContact O-CB 3.25Å; T23-S27 PolarHBondContact O-N 3.45Å; T23-S27 PolarHBondContact O-OG 2.86Å; T23-F73 HydrophobicContact CG2-CE1 4.44Å; T23-F73 HydrophobicContact CG2-CE2 3.7Å; T23-F73 HydrophobicContact CG2-CZ 3.34Å; T23-L77 HydrophobicContact CG2-CD2 3.79Å
24	L	61.3	Low	53.7	Low	42 Å²	42	52 Å²	52	22%	0.22	29%	0.292	C	S	.	.	H	α-helix	trans	-62	-48.3	174.1	-171.7	82.8	0	0	0	110.5	P20 F21 V26 S27 A28 G64 L68	P20-L24 WeakPolarHBondContact O-CB 3.47Å; P20-L24 PolarHBondContact O-N 2.83Å; F21-L24 PolarHBondContact O-N 3.16Å; L24-V26 VanDerWaalsContact C-N 3.31Å; L24-V26 PolarHBondContact O-N 3.15Å; L24-S27 PolarHBondContact O-N 3.44Å; L24-A28 VanDerWaalsContact O-CB 3.31Å; L24-A28 WeakPolarHBondContact O-CB 3.4Å; L24-A28 PolarHBondContact O-N 3.42Å; L24-G64 VanDerWaalsContact CD1-C 3.45Å; L24-L68 HydrophobicContact CB-CD1 3.6Å; L24-L68 HydrophobicContact CD1-CD1 3.55Å; L24-L68 HydrophobicContact CD2-CD1 4.39Å; L24-L68 HydrophobicContact CG-CD1 4.02Å
25	F	59	Low	55.6	Low	120 Å²	120	47.9 Å²	47.9	53%	0.526	27%	0.27	S	S	.	.	H	α-helix	trans	-58.3	-45.1	179.7	179.2	-100.3	0	0	0	111.3	F21 S22 A28 T29	F21-F25 WeakPolarHBondContact O-CB 3.44Å; F21-F25 PolarHBondContact O-N 3.29Å; S22-F25 PolarHBondContact O-N 2.87Å; F25-A28 PolarHBondContact O-N 3.25Å; F25-T29 WeakPolarHBondContact O-CB 3.48Å; F25-T29 PolarHBondContact O-N 3.33Å; F25-T29 PolarHBondContact O-OG1 2.99Å
26	V	60.7	Low	57.4	Low	7 Å²	7	44.9 Å²	44.9	4%	0.042	26%	0.257	C	S	.	.	H	α-helix	trans	-68.7	-44.5	178.4	176.8	0	0	0	0	111.2	S22 T23 L24 A28 T29 V30 F118 T122	S22-V26 WeakPolarHBondContact O-CB 3.48Å; S22-V26 WeakPolarHBondContact O-CG2 3.18Å; S22-V26 PolarHBondContact O-N 3.13Å; T23-V26 PolarHBondContact O-N 2.93Å; L24-V26 VanDerWaalsContact C-N 3.31Å; L24-V26 PolarHBondContact O-N 3.15Å; V26-A28 VanDerWaalsContact C-N 3.29Å; V26-A28 PolarHBondContact O-N 2.95Å; V26-T29 WeakPolarHBondContact O-CB 3.46Å; V26-T29 PolarHBondContact O-N 3.45Å; V26-T29 VanDerWaalsContact O-N 3.15Å; V26-V30 HydrophobicContact CG1-CG2 4.27Å; V26-V30 WeakPolarHBondContact O-CG2 3.5Å; V26-V30 PolarHBondContact O-N 3.49Å; V26-F118 HydrophobicContact CG1-CB 4.45Å; V26-T122 HydrophobicContact CB-CG2 4.07Å; V26-T122 HydrophobicContact CG1-CG2 3.92Å; V26-T122 VanDerWaalsContact CG1-OG1 3.28Å; V26-T122 WeakPolarHBondContact CG1-OG1 3.37Å; V26-T122 HydrophobicContact CG2-CG2 3.27Å
27	S	64.9	Low	58.8	Low	1 Å²	1	42.2 Å²	42.2	1%	0.007	24%	0.235	C	C	.	.	H	α-helix	trans	-58	-44	176.1	-59.5	0	0	0	0	110.9	T23 L24 V30 I31 R119	T23-S27 WeakPolarHBondContact O-CB 3.25Å; T23-S27 PolarHBondContact O-N 3.45Å; T23-S27 PolarHBondContact O-OG 2.86Å; L24-S27 PolarHBondContact O-N 3.44Å; S27-V30 PolarHBondContact O-N 3.28Å; S27-I31 WeakPolarHBondContact O-CD1 3.5Å; S27-I31 WeakPolarHBondContact O-CG1 3.47Å; S27-I31 PolarHBondContact O-N 3.39Å; S27-R119 PolarHBondContact OG-NH1 3.28Å; S27-R119 VanDerWaalsContact OG-NH1 3.16Å
28	A	66.7	Low	60.6	Low	32 Å²	32	36.1 Å²	36.1	26%	0.264	21%	0.206	S	C	.	.	H	α-helix	trans	-63.1	-43.8	175.7	0	0	0	0	0	111.6	L24 F25 V26 V30 I31 V32 L61	L24-A28 VanDerWaalsContact O-CB 3.31Å; L24-A28 WeakPolarHBondContact O-CB 3.4Å; L24-A28 PolarHBondContact O-N 3.42Å; F25-A28 PolarHBondContact O-N 3.25Å; V26-A28 VanDerWaalsContact C-N 3.29Å; V26-A28 PolarHBondContact O-N 2.95Å; A28-V30 VanDerWaalsContact C-N 3.29Å; A28-V30 PolarHBondContact O-N 2.89Å; A28-I31 PolarHBondContact O-N 3.36Å; A28-V32 WeakPolarHBondContact O-CB 3.18Å; A28-V32 WeakPolarHBondContact O-CG2 3.25Å; A28-V32 PolarHBondContact O-N 3.41Å; A28-L61 HydrophobicContact CB-CD1 4.13Å
29	T	61.3	Low	62.3	Low	48 Å²	48	34 Å²	34	29%	0.294	19%	0.191	S	C	.	.	H	α-helix	trans	-60	-40.1	176.8	-53.8	0	0	0	0	111.4	F25 V26 G33 S115	F25-T29 WeakPolarHBondContact O-CB 3.48Å; F25-T29 PolarHBondContact O-N 3.33Å; F25-T29 PolarHBondContact O-OG1 2.99Å; V26-T29 WeakPolarHBondContact O-CB 3.46Å; V26-T29 PolarHBondContact O-N 3.45Å; V26-T29 VanDerWaalsContact O-N 3.15Å; T29-G33 PolarHBondContact O-N 3.3Å; T29-S115 WeakPolarHBondContact O-CB 3.24Å
30	V	64.3	Low	62.9	Low	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-65.2	-48.5	174.6	176	0	0	0	0	112.2	V26 S27 A28 G33 T34 L84 S115 R119	V26-V30 HydrophobicContact CG1-CG2 4.27Å; V26-V30 WeakPolarHBondContact O-CG2 3.5Å; V26-V30 PolarHBondContact O-N 3.49Å; S27-V30 PolarHBondContact O-N 3.28Å; A28-V30 VanDerWaalsContact C-N 3.29Å; A28-V30 PolarHBondContact O-N 2.89Å; V30-G33 PolarHBondContact O-N 2.88Å; V30-T34 VanDerWaalsContact O-CB 3.28Å; V30-T34 WeakPolarHBondContact O-CB 3.32Å; V30-T34 PolarHBondContact O-N 3.24Å; V30-T34 PolarHBondContact O-OG1 3.48Å; V30-L84 HydrophobicContact CG1-CD1 3.7Å; V30-L84 HydrophobicContact CG1-CD2 4.01Å; V30-L84 HydrophobicContact CG1-CG 4.46Å; V30-S115 VanDerWaalsContact CG2-O 3.31Å; V30-S115 WeakPolarHBondContact CG2-O 3.17Å; V30-R119 HydrophobicContact CG2-CB 3.62Å; V30-R119 HydrophobicContact CG2-CG 4.14Å
31	I	67.9	Low	63.5	Low	1 Å²	1	32 Å²	32	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-62.6	-46.9	179.3	-64.1	161.2	0	0	0	109.9	S27 A28 T34 L35 G57 L60 L61 F76 L80 W83	S27-I31 WeakPolarHBondContact O-CD1 3.5Å; S27-I31 WeakPolarHBondContact O-CG1 3.47Å; S27-I31 PolarHBondContact O-N 3.39Å; A28-I31 PolarHBondContact O-N 3.36Å; I31-T34 PolarHBondContact O-N 3.29Å; I31-L35 HydrophobicContact CG2-CD1 3.66Å; I31-L35 HydrophobicContact CG2-CG 4.16Å; I31-L35 VanDerWaalsContact O-CB 3.3Å; I31-L35 WeakPolarHBondContact O-CB 3.2Å; I31-L35 VanDerWaalsContact O-CG 3.26Å; I31-L35 WeakPolarHBondContact O-CG 3.29Å; I31-L35 PolarHBondContact O-N 3.48Å; I31-G57 VanDerWaalsContact CG2-O 3.3Å; I31-G57 WeakPolarHBondContact CG2-O 3.39Å; I31-L60 HydrophobicContact CD1-CB 4.08Å; I31-L61 HydrophobicContact CB-CD1 3.98Å; I31-L61 HydrophobicContact CD1-CD1 4.31Å; I31-L61 HydrophobicContact CG2-CB 3.88Å; I31-L61 HydrophobicContact CG2-CD1 3.89Å; I31-L61 HydrophobicContact CG2-CG 4.4Å; I31-F76 HydrophobicContact CD1-CZ 4.22Å; I31-L80 HydrophobicContact CD1-CD1 3.72Å; I31-L80 HydrophobicContact CG1-CD1 3.32Å; I31-W83 HydrophobicContact CB-CH2 4.38Å; I31-W83 HydrophobicContact CB-CZ3 4.27Å; I31-W83 HydrophobicContact CG1-CZ3 4Å; I31-W83 HydrophobicContact CG2-CH2 3.99Å; I31-W83 HydrophobicContact CG2-CZ3 4.28Å
32	V	70.9	Confident	64.3	Low	63 Å²	63	25.2 Å²	25.2	38%	0.382	15%	0.148	S	C	.	.	H	α-helix	trans	-62.6	-49	179	171.9	0	0	0	0	110.7	A28 T34 L35 C36 L61	A28-V32 WeakPolarHBondContact O-CB 3.18Å; A28-V32 WeakPolarHBondContact O-CG2 3.25Å; A28-V32 PolarHBondContact O-N 3.41Å; V32-T34 VanDerWaalsContact C-N 3.28Å; V32-T34 PolarHBondContact O-N 3.32Å; V32-L35 PolarHBondContact O-N 3.47Å; V32-C36 WeakPolarHBondContact O-CB 3.18Å; V32-C36 PolarHBondContact O-N 2.93Å; V32-C36 PolarHBondContact O-SG 3.47Å; V32-L61 HydrophobicContact CG2-CD1 3.93Å; V32-L61 HydrophobicContact CG2-CD2 4.28Å
33	G	63.8	Low	65.1	Low	1 Å²	1	28.3 Å²	28.3	1%	0.01	16%	0.16	C	C	.	.	H	α-helix	trans	-58.9	-41.3	178.7	0	0	0	0	0	112.5	T29 V30 A37	T29-G33 PolarHBondContact O-N 3.3Å; V30-G33 PolarHBondContact O-N 2.88Å; G33-A37 PolarHBondContact O-N 2.81Å
34	T	65.8	Low	65.4	Low	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-70.3	-41.3	177.6	-51.2	0	0	0	0	112.3	V30 I31 V32 A37 L38 W83 L84 A87 L91 L112	V30-T34 VanDerWaalsContact O-CB 3.28Å; V30-T34 WeakPolarHBondContact O-CB 3.32Å; V30-T34 PolarHBondContact O-N 3.24Å; V30-T34 PolarHBondContact O-OG1 3.48Å; I31-T34 PolarHBondContact O-N 3.29Å; V32-T34 VanDerWaalsContact C-N 3.28Å; V32-T34 PolarHBondContact O-N 3.32Å; T34-A37 PolarHBondContact O-N 3.4Å; T34-L38 WeakPolarHBondContact O-CB 3.29Å; T34-L38 PolarHBondContact O-N 3.49Å; T34-W83 HydrophobicContact CG2-CH2 3.73Å; T34-W83 HydrophobicContact CG2-CZ2 4.27Å; T34-W83 HydrophobicContact CG2-CZ3 4.14Å; T34-L84 HydrophobicContact CG2-CD1 4.22Å; T34-L84 WeakPolarHBondContact OG1-CD1 3.39Å; T34-A87 HydrophobicContact CG2-CB 3.68Å; T34-L91 HydrophobicContact CG2-CD1 4.21Å; T34-L112 HydrophobicContact CG2-CD1 4.05Å
35	L	69	Low	65.7	Low	5 Å²	5	33.7 Å²	33.7	3%	0.026	18%	0.181	C	C	.	.	H	α-helix	trans	-64.5	-41.9	175	-77.3	173.9	0	0	0	111.8	I31 V32 A37 L38 I39 A54 F58 W83	I31-L35 HydrophobicContact CG2-CD1 3.66Å; I31-L35 HydrophobicContact CG2-CG 4.16Å; I31-L35 VanDerWaalsContact O-CB 3.3Å; I31-L35 WeakPolarHBondContact O-CB 3.2Å; I31-L35 VanDerWaalsContact O-CG 3.26Å; I31-L35 WeakPolarHBondContact O-CG 3.29Å; I31-L35 PolarHBondContact O-N 3.48Å; V32-L35 PolarHBondContact O-N 3.47Å; L35-A37 PolarHBondContact O-N 2.86Å; L35-L38 PolarHBondContact O-N 2.96Å; L35-L38 VanDerWaalsContact O-N 3.1Å; L35-I39 HydrophobicContact CB-CD1 4.14Å; L35-I39 WeakPolarHBondContact O-CB 3.46Å; L35-I39 WeakPolarHBondContact O-CD1 3.49Å; L35-I39 WeakPolarHBondContact O-CG1 3.48Å; L35-I39 PolarHBondContact O-N 3.38Å; L35-A54 HydrophobicContact CD2-CB 4.41Å; L35-F58 HydrophobicContact CD1-CD1 3.95Å; L35-F58 HydrophobicContact CD1-CD2 4.44Å; L35-F58 HydrophobicContact CD1-CE1 4.02Å; L35-F58 HydrophobicContact CD1-CE2 4.49Å; L35-F58 HydrophobicContact CD1-CG 4.18Å; L35-F58 HydrophobicContact CD1-CZ 4.29Å; L35-F58 HydrophobicContact CD2-CD2 4.19Å; L35-F58 HydrophobicContact CD2-CE2 4.17Å; L35-W83 HydrophobicContact CD2-CZ2 4.19Å; L35-W83 HydrophobicContact CG-CH2 4.32Å; L35-W83 HydrophobicContact CG-CZ2 4.33Å
36	C	67.9	Low	66.2	Low	49 Å²	49	35 Å²	35	33%	0.331	19%	0.189	S	C	.	.	H	α-helix	trans	-59.9	-36.4	175.3	-72.7	0	0	0	0	111.8	V32 P40 Q108 L111	V32-C36 WeakPolarHBondContact O-CB 3.18Å; V32-C36 PolarHBondContact O-N 2.93Å; V32-C36 PolarHBondContact O-SG 3.47Å; C36-P40 WeakPolarHBondContact O-CD 3.39Å; C36-Q108 PolarHBondContact O-NE2 3.3Å; C36-L111 HydrophobicContact CB-CD1 3.91Å
37	A	64	Low	66.6	Low	4 Å²	4	36.9 Å²	36.9	3%	0.033	20%	0.2	C	C	.	.	H	α-helix	trans	-71.4	-41.8	172.5	0	0	0	0	0	112.1	G33 T34 L35 V41 L91 Q108 L112	G33-A37 PolarHBondContact O-N 2.81Å; T34-A37 PolarHBondContact O-N 3.4Å; L35-A37 PolarHBondContact O-N 2.86Å; A37-V41 WeakPolarHBondContact O-CG2 3.4Å; A37-L91 HydrophobicContact CB-CD1 3.86Å; A37-L91 HydrophobicContact CB-CD2 3.88Å; A37-L91 WeakPolarHBondContact O-CD2 3.15Å; A37-Q108 HydrophobicContact CB-CB 4.39Å; A37-Q108 PolarHBondContact O-NE2 3.49Å; A37-L112 HydrophobicContact CB-CB 4.21Å; A37-L112 HydrophobicContact CB-CD1 4.15Å; A37-L112 HydrophobicContact CB-CD2 4.39Å; A37-L112 HydrophobicContact CB-CG 4.5Å
38	L	66.7	Low	66.7	Low	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-79	-41.2	-170.4	-168.9	76.6	0	0	0	113.3	T34 L35 V41 C42 A53 A54 R90 L91	T34-L38 WeakPolarHBondContact O-CB 3.29Å; T34-L38 PolarHBondContact O-N 3.49Å; L35-L38 PolarHBondContact O-N 2.96Å; L35-L38 VanDerWaalsContact O-N 3.1Å; L38-V41 CarbonylContact O-C 3.6Å; L38-V41 WeakPolarHBondContact O-CA 3.46Å; L38-V41 VanDerWaalsContact O-CB 3.26Å; L38-V41 WeakPolarHBondContact O-CB 3.28Å; L38-V41 PolarHBondContact O-N 3.02Å; L38-C42 PolarHBondContact O-N 3.13Å; L38-C42 PolarHBondContact O-SG 2.93Å; L38-A53 HydrophobicContact CD2-CB 3.6Å; L38-A54 HydrophobicContact CD2-CB 4.07Å; L38-R90 HydrophobicContact CD1-CB 4.44Å; L38-L91 HydrophobicContact CB-CD2 4.33Å; L38-L91 HydrophobicContact CD1-CD2 4.11Å; L38-L91 HydrophobicContact CD1-CG 3.86Å
39	I	70.8	Confident	66.8	Low	53 Å²	53	42.4 Å²	42.4	27%	0.272	23%	0.231	S	C	.	.	H	α-helix	trans	-56.6	-48.5	-172.7	-71.8	162.5	0	0	0	112.6	L35 V41 C42 I43 F58	L35-I39 HydrophobicContact CB-CD1 4.14Å; L35-I39 WeakPolarHBondContact O-CB 3.46Å; L35-I39 WeakPolarHBondContact O-CD1 3.49Å; L35-I39 WeakPolarHBondContact O-CG1 3.48Å; L35-I39 PolarHBondContact O-N 3.38Å; I39-V41 PolarHBondContact O-N 3.01Å; I39-C42 WeakPolarHBondContact O-CB 3.46Å; I39-C42 PolarHBondContact O-N 3.26Å; I39-C42 VanDerWaalsContact O-N 3.14Å; I39-I43 HydrophobicContact CG2-CD1 3.62Å; I39-I43 HydrophobicContact CG2-CG1 4.26Å; I39-I43 VanDerWaalsContact O-CG1 3.3Å; I39-I43 WeakPolarHBondContact O-CG1 3.22Å; I39-I43 PolarHBondContact O-N 3.18Å; I39-F58 HydrophobicContact CD1-CE2 3.89Å; I39-F58 HydrophobicContact CD1-CZ 3.6Å; I39-F58 HydrophobicContact CG1-CE2 4.35Å
40	P	63.7	Low	67.2	Low	36 Å²	36	40.1 Å²	40.1	23%	0.234	22%	0.217	C	C	.	.	H	α-helix	trans	-63.5	-31	178	-28.1	41.6	0	0	0	112.9	C36 K44 L100 Q108	C36-P40 WeakPolarHBondContact O-CD 3.39Å; P40-K44 PolarHBondContact O-N 3.27Å; P40-L100 HydrophobicContact CB-CD2 4.22Å; P40-Q108 VanDerWaalsContact CD-NE2 3.28Å
41	V	64.1	Low	67.5	Low	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-67.9	-44.4	174.3	-178.6	0	0	0	0	110.6	A37 L38 I39 K44 H45 L91 L94 I98	A37-V41 WeakPolarHBondContact O-CG2 3.4Å; L38-V41 CarbonylContact O-C 3.6Å; L38-V41 WeakPolarHBondContact O-CA 3.46Å; L38-V41 VanDerWaalsContact O-CB 3.26Å; L38-V41 WeakPolarHBondContact O-CB 3.28Å; L38-V41 PolarHBondContact O-N 3.02Å; I39-V41 PolarHBondContact O-N 3.01Å; V41-K44 PolarHBondContact O-N 3.34Å; V41-H45 PolarHBondContact O-N 3.14Å; V41-L91 HydrophobicContact CG2-CD2 4.02Å; V41-L94 HydrophobicContact CG1-CB 3.33Å; V41-L94 HydrophobicContact CG1-CD1 3.9Å; V41-L94 HydrophobicContact CG1-CG 4.26Å; V41-I98 HydrophobicContact CB-CD1 3.83Å; V41-I98 HydrophobicContact CG1-CD1 3.68Å; V41-I98 HydrophobicContact CG2-CD1 3.77Å
42	C	68.4	Low	67.8	Low	9 Å²	9	45.9 Å²	45.9	6%	0.061	25%	0.251	C	S	.	.	H	α-helix	trans	-62.9	-44.4	176	-56.2	0	0	0	0	112.4	L38 I39 K44 Q46 C50	L38-C42 PolarHBondContact O-N 3.13Å; L38-C42 PolarHBondContact O-SG 2.93Å; I39-C42 WeakPolarHBondContact O-CB 3.46Å; I39-C42 PolarHBondContact O-N 3.26Å; I39-C42 VanDerWaalsContact O-N 3.14Å; C42-K44 PolarHBondContact O-N 2.87Å; C42-Q46 VanDerWaalsContact O-CA 3.3Å; C42-Q46 WeakPolarHBondContact O-CA 3.26Å; C42-Q46 PolarHBondContact O-N 3.03Å; C42-C50 HydrophobicContact CB-CB 4.03Å; C42-C50 WeakPolarHBondContact SG-CB 3.31Å; C42-C50 PolarHBondContact SG-O 3.47Å; C42-C50 VanDerWaalsContact SG-SG 3.62Å
43	I	68.4	Low	68	Low	116 Å²	116	43 Å²	43	60%	0.595	23%	0.233	S	C	*	.	H	α-helix	trans	-61	-38.1	-179.3	-69.8	168.2	0	0	0	110.5	I39 Q46	I39-I43 HydrophobicContact CG2-CD1 3.62Å; I39-I43 HydrophobicContact CG2-CG1 4.26Å; I39-I43 VanDerWaalsContact O-CG1 3.3Å; I39-I43 WeakPolarHBondContact O-CG1 3.22Å; I39-I43 PolarHBondContact O-N 3.18Å; I43-Q46 WeakPolarHBondContact O-CG 3.44Å
44	K	64.4	Low	68.5	Low	108 Å²	108	43.4 Å²	43.4	47%	0.47	24%	0.236	S	C	.	.	H	α-helix	trans	-81	-43.7	-176.8	-168.3	170.7	178.7	174.9	0	113.8	P40 V41 C42 I98 I99	P40-K44 PolarHBondContact O-N 3.27Å; V41-K44 PolarHBondContact O-N 3.34Å; C42-K44 PolarHBondContact O-N 2.87Å; K44-I98 HydrophobicContact CB-CD1 4.35Å; K44-I98 HydrophobicContact CD-CB 4.22Å; K44-I98 HydrophobicContact CD-CD1 4.3Å; K44-I98 HydrophobicContact CD-CG1 3.93Å; K44-I98 HydrophobicContact CD-CG2 3.6Å; K44-I99 PolarHBondContact NZ-O 3.44Å
45	H	67.1	Low	69	Low	54 Å²	54	48.5 Å²	48.5	25%	0.25	26%	0.263	C	S	.	.	H	α-helix	trans	-86.5	-22.2	-177.7	-74	-61.9	0	0	0	113.5	V41 T47 L94 K97 I98	V41-H45 PolarHBondContact O-N 3.14Å; H45-T47 HydrophobicContact CB-CG2 4.25Å; H45-T47 PolarHBondContact O-N 3.1Å; H45-L94 HydrophobicContact CB-CD2 4.46Å; H45-L94 PolarHBondContact NE2-O 3.31Å; H45-L94 VanDerWaalsContact NE2-O 3.14Å; H45-K97 VanDerWaalsContact CE1-CB 3.48Å; H45-K97 WeakPolarHBondContact CE1-CB 3.39Å; H45-I98 WeakPolarHBondContact NE2-CD1 3.49Å; H45-I98 VanDerWaalsContact NE2-CG1 3.26Å; H45-I98 WeakPolarHBondContact NE2-CG1 3.11Å
46	Q	68.9	Low	69.5	Low	149 Å²	149	51.6 Å²	51.6	70%	0.696	28%	0.282	S	S	*	.			trans	47.9	26.6	-177.6	-60	-171	-6.7	0	0	114.3	C42 I43	C42-Q46 VanDerWaalsContact O-CA 3.3Å; C42-Q46 WeakPolarHBondContact O-CA 3.26Å; C42-Q46 PolarHBondContact O-N 3.03Å; I43-Q46 WeakPolarHBondContact O-CG 3.44Å
47	T	69.2	Low	69.9	Low	45 Å²	45	49.3 Å²	49.3	28%	0.276	27%	0.266	S	S	.	.			trans	-75.2	135.7	178.5	51.3	0	0	0	0	109.5	H45 D49 C50 I51	H45-T47 HydrophobicContact CB-CG2 4.25Å; H45-T47 PolarHBondContact O-N 3.1Å; T47-D49 PolarHBondContact O-N 3.38Å; T47-D49 VanDerWaalsContact O-N 3.13Å; T47-C50 WeakPolarHBondContact O-CB 3.45Å; T47-C50 PolarHBondContact O-N 3.06Å; T47-C50 WeakPolarHBondContact OG1-CB 3.19Å; T47-I51 PolarHBondContact O-N 3.29Å; T47-I51 VanDerWaalsContact O-N 3.13Å
48	P	67.8	Low	70.5	Confident	96 Å²	96	53.9 Å²	53.9	62%	0.623	29%	0.285	S	S	*	.	H	α-helix	trans	-57.2	-32.5	-177.6	21.1	-32	0	0	0	112.1	I51 S52	P48-I51 PolarHBondContact O-N 3.33Å; P48-S52 WeakPolarHBondContact O-CB 3.36Å; P48-S52 PolarHBondContact O-N 2.73Å; P48-S52 PolarHBondContact O-OG 2.74Å
49	D	68.4	Low	71	Confident	54 Å²	54	56.8 Å²	56.8	29%	0.289	31%	0.309	S	S	.	.	H	α-helix	trans	-67	-35.2	177.4	-60	-25.1	0	0	0	113.7	T47 S52 A53 R90	T47-D49 PolarHBondContact O-N 3.38Å; T47-D49 VanDerWaalsContact O-N 3.13Å; D49-S52 WeakPolarHBondContact CA-OG 3.45Å; D49-S52 PolarHBondContact O-OG 2.8Å; D49-A53 WeakPolarHBondContact O-CB 3.47Å; D49-A53 PolarHBondContact O-N 3.37Å; D49-A53 VanDerWaalsContact O-N 3.08Å; D49-R90 VanDerWaalsContact CB-NH2 3.27Å; D49-R90 IonicContact OD1-NH2 2.81Å; D49-R90 IonicContact OD2-CZ 2.73Å; D49-R90 IonicContact OD2-NH1 3.42Å; D49-R90 IonicContact OD2-NH2 2.67Å; D49-R90 PolarHBondContact OD2-NH2 3.47Å
50	C	69.5	Low	71.3	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-72.9	-44.2	175.8	-117.8	0	0	0	0	110.6	C42 T47 S52 A53 A54 L94	C42-C50 HydrophobicContact CB-CB 4.03Å; C42-C50 WeakPolarHBondContact SG-CB 3.31Å; C42-C50 PolarHBondContact SG-O 3.47Å; C42-C50 VanDerWaalsContact SG-SG 3.62Å; T47-C50 WeakPolarHBondContact O-CB 3.45Å; T47-C50 PolarHBondContact O-N 3.06Å; T47-C50 WeakPolarHBondContact OG1-CB 3.19Å; C50-S52 VanDerWaalsContact C-N 3.29Å; C50-S52 PolarHBondContact O-N 2.94Å; C50-A53 WeakPolarHBondContact O-CB 3.3Å; C50-A53 PolarHBondContact O-N 2.88Å; C50-A54 PolarHBondContact O-N 3.25Å; C50-L94 HydrophobicContact CB-CD1 4.37Å; C50-L94 WeakPolarHBondContact SG-CD1 3.3Å
51	I	72.1	Confident	71.9	Confident	75 Å²	75	55.9 Å²	55.9	39%	0.385	30%	0.303	S	S	.	.	H	α-helix	trans	-61.2	-42.9	178.1	-63.6	169.5	0	0	0	109.6	T47 P48 A54 I55	T47-I51 PolarHBondContact O-N 3.29Å; T47-I51 VanDerWaalsContact O-N 3.13Å; P48-I51 PolarHBondContact O-N 3.33Å; I51-A54 PolarHBondContact O-N 2.83Å; I51-I55 HydrophobicContact CG2-CD1 3.74Å; I51-I55 HydrophobicContact CG2-CG1 4.4Å; I51-I55 VanDerWaalsContact O-CG1 3.25Å; I51-I55 WeakPolarHBondContact O-CG1 3.47Å; I51-I55 PolarHBondContact O-N 2.79Å
52	S	72.5	Confident	72.5	Confident	47 Å²	47	63 Å²	63	33%	0.329	34%	0.338	S	S	.	.	H	α-helix	trans	-64.1	-43	176.1	71.2	0	0	0	0	112	P48 D49 C50 A54 I55 V56	P48-S52 WeakPolarHBondContact O-CB 3.36Å; P48-S52 PolarHBondContact O-N 2.73Å; P48-S52 PolarHBondContact O-OG 2.74Å; D49-S52 WeakPolarHBondContact CA-OG 3.45Å; D49-S52 PolarHBondContact O-OG 2.8Å; C50-S52 VanDerWaalsContact C-N 3.29Å; C50-S52 PolarHBondContact O-N 2.94Å; S52-A54 VanDerWaalsContact C-N 3.32Å; S52-A54 PolarHBondContact O-N 3.15Å; S52-I55 PolarHBondContact O-N 3.27Å; S52-V56 VanDerWaalsContact O-CG2 3.28Å; S52-V56 WeakPolarHBondContact O-CG2 3.39Å; S52-V56 PolarHBondContact O-N 2.9Å
53	A	74.8	Confident	72.6	Confident	1 Å²	1	63.8 Å²	63.8	1%	0.008	35%	0.348	C	S	.	.	H	α-helix	trans	-56.4	-45.3	173.1	0	0	0	0	0	111.9	L38 D49 C50 V56 G57 W83 Y86	L38-A53 HydrophobicContact CD2-CB 3.6Å; D49-A53 WeakPolarHBondContact O-CB 3.47Å; D49-A53 PolarHBondContact O-N 3.37Å; D49-A53 VanDerWaalsContact O-N 3.08Å; C50-A53 WeakPolarHBondContact O-CB 3.3Å; C50-A53 PolarHBondContact O-N 2.88Å; A53-V56 PolarHBondContact O-N 2.9Å; A53-G57 PolarHBondContact O-N 2.78Å; A53-W83 PolarHBondContact O-NE1 3.21Å; A53-Y86 HydrophobicContact CB-CD1 3.92Å; A53-Y86 HydrophobicContact CB-CE1 3.74Å
54	A	75.8	Confident	72.5	Confident	10 Å²	10	58.4 Å²	58.4	8%	0.083	32%	0.32	C	S	.	.	H	α-helix	trans	-64.7	-46.1	178.7	0	0	0	0	0	111.6	L35 L38 C50 I51 S52 V56 G57 F58	L35-A54 HydrophobicContact CD2-CB 4.41Å; L38-A54 HydrophobicContact CD2-CB 4.07Å; C50-A54 PolarHBondContact O-N 3.25Å; I51-A54 PolarHBondContact O-N 2.83Å; S52-A54 VanDerWaalsContact C-N 3.32Å; S52-A54 PolarHBondContact O-N 3.15Å; A54-V56 PolarHBondContact O-N 3.43Å; A54-G57 PolarHBondContact O-N 3.38Å; A54-G57 VanDerWaalsContact O-N 3.15Å; A54-F58 WeakPolarHBondContact O-CD2 3.44Å; A54-F58 PolarHBondContact O-N 3.42Å
55	I	76	Confident	72.6	Confident	108 Å²	108	56.4 Å²	56.4	55%	0.554	32%	0.318	S	S	*	.	H	α-helix	trans	-59.3	-46.2	177.9	-68.9	167	0	0	0	111	I51 S52 G57 F58 A59	I51-I55 HydrophobicContact CG2-CD1 3.74Å; I51-I55 HydrophobicContact CG2-CG1 4.4Å; I51-I55 VanDerWaalsContact O-CG1 3.25Å; I51-I55 WeakPolarHBondContact O-CG1 3.47Å; I51-I55 PolarHBondContact O-N 2.79Å; S52-I55 PolarHBondContact O-N 3.27Å; I55-G57 VanDerWaalsContact C-N 3.29Å; I55-G57 PolarHBondContact O-N 2.99Å; I55-F58 PolarHBondContact O-N 3.39Å; I55-A59 WeakPolarHBondContact O-CB 3.32Å; I55-A59 PolarHBondContact O-N 2.91Å
56	V	78.9	Confident	72.6	Confident	70 Å²	70	57.7 Å²	57.7	42%	0.424	33%	0.33	S	S	.	.	H	α-helix	trans	-63	-38.4	177.4	175.5	0	0	0	0	110.9	S52 A53 A54 A59 L60 W83	S52-V56 VanDerWaalsContact O-CG2 3.28Å; S52-V56 WeakPolarHBondContact O-CG2 3.39Å; S52-V56 PolarHBondContact O-N 2.9Å; A53-V56 PolarHBondContact O-N 2.9Å; A54-V56 PolarHBondContact O-N 3.43Å; V56-A59 PolarHBondContact O-N 2.72Å; V56-L60 HydrophobicContact CG1-CD1 4.21Å; V56-L60 WeakPolarHBondContact O-CG 3.41Å; V56-L60 PolarHBondContact O-N 2.92Å; V56-W83 HydrophobicContact CG1-CB 4.44Å; V56-W83 VanDerWaalsContact CG1-CD1 3.47Å; V56-W83 HydrophobicContact CG1-CG 4.14Å
57	G	76.9	Confident	72	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-61.8	-45.6	174.9	0	0	0	0	0	112.8	I31 A53 A54 I55 A59 L60 L61	I31-G57 VanDerWaalsContact CG2-O 3.3Å; I31-G57 WeakPolarHBondContact CG2-O 3.39Å; A53-G57 PolarHBondContact O-N 2.78Å; A54-G57 PolarHBondContact O-N 3.38Å; A54-G57 VanDerWaalsContact O-N 3.15Å; I55-G57 VanDerWaalsContact C-N 3.29Å; I55-G57 PolarHBondContact O-N 2.99Å; G57-A59 VanDerWaalsContact C-N 3.34Å; G57-A59 PolarHBondContact O-N 2.87Å; G57-L60 PolarHBondContact O-N 3.3Å; G57-L61 PolarHBondContact O-N 2.9Å
58	F	77.3	Confident	71.4	Confident	100 Å²	100	51.7 Å²	51.7	44%	0.439	30%	0.303	S	S	.	.	H	α-helix	trans	-63	-40.2	173.7	-78.8	-67.9	0	0	0	112.3	L35 I39 A54 I55 L60 L61 M62	L35-F58 HydrophobicContact CD1-CD1 3.95Å; L35-F58 HydrophobicContact CD1-CD2 4.44Å; L35-F58 HydrophobicContact CD1-CE1 4.02Å; L35-F58 HydrophobicContact CD1-CE2 4.49Å; L35-F58 HydrophobicContact CD1-CG 4.18Å; L35-F58 HydrophobicContact CD1-CZ 4.29Å; L35-F58 HydrophobicContact CD2-CD2 4.19Å; L35-F58 HydrophobicContact CD2-CE2 4.17Å; I39-F58 HydrophobicContact CD1-CE2 3.89Å; I39-F58 HydrophobicContact CD1-CZ 3.6Å; I39-F58 HydrophobicContact CG1-CE2 4.35Å; A54-F58 WeakPolarHBondContact O-CD2 3.44Å; A54-F58 PolarHBondContact O-N 3.42Å; I55-F58 PolarHBondContact O-N 3.39Å; F58-L60 VanDerWaalsContact C-N 3.34Å; F58-L60 PolarHBondContact O-N 3.5Å; F58-L61 WeakPolarHBondContact O-CB 3.49Å; F58-L61 PolarHBondContact O-N 3.08Å; F58-M62 WeakPolarHBondContact O-CG 3.11Å; F58-M62 PolarHBondContact O-N 3.32Å
59	A	76.7	Confident	70.9	Confident	61 Å²	61	58 Å²	58	50%	0.504	31%	0.314	S	S	.	.	H	α-helix	trans	-62.5	-40.5	175.8	0	0	0	0	0	111.8	I55 V56 G57 G63	I55-A59 WeakPolarHBondContact O-CB 3.32Å; I55-A59 PolarHBondContact O-N 2.91Å; V56-A59 PolarHBondContact O-N 2.72Å; G57-A59 VanDerWaalsContact C-N 3.34Å; G57-A59 PolarHBondContact O-N 2.87Å; A59-G63 WeakPolarHBondContact O-CA 3.28Å; A59-G63 PolarHBondContact O-N 3.3Å
60	L	76.8	Confident	70.4	Confident	21 Å²	21	60.3 Å²	60.3	11%	0.11	33%	0.326	C	S	.	.	H	α-helix	trans	-65.7	-41	173.5	-73.8	168.7	0	0	0	111.8	I31 V56 G57 F58 M62 G63 G64 F76 L80 W83	I31-L60 HydrophobicContact CD1-CB 4.08Å; V56-L60 HydrophobicContact CG1-CD1 4.21Å; V56-L60 WeakPolarHBondContact O-CG 3.41Å; V56-L60 PolarHBondContact O-N 2.92Å; G57-L60 PolarHBondContact O-N 3.3Å; F58-L60 VanDerWaalsContact C-N 3.34Å; F58-L60 PolarHBondContact O-N 3.5Å; L60-M62 VanDerWaalsContact C-N 3.34Å; L60-M62 PolarHBondContact O-N 3.1Å; L60-G63 PolarHBondContact O-N 2.88Å; L60-G64 PolarHBondContact O-N 2.79Å; L60-F76 HydrophobicContact CB-CE2 4.34Å; L60-F76 HydrophobicContact CD2-CD2 4.18Å; L60-F76 HydrophobicContact CD2-CE2 4.05Å; L60-F76 VanDerWaalsContact O-CE2 3.32Å; L60-F76 WeakPolarHBondContact O-CE2 3.45Å; L60-L80 HydrophobicContact CD1-CD1 4.46Å; L60-W83 HydrophobicContact CD1-CB 3.47Å; L60-W83 VanDerWaalsContact CD1-CB 3.47Å; L60-W83 HydrophobicContact CD1-CD2 3.83Å; L60-W83 HydrophobicContact CD1-CE3 4.13Å; L60-W83 HydrophobicContact CD1-CG 3.54Å
61	L	75.9	Confident	70	Confident	50 Å²	50	71.3 Å²	71.3	26%	0.262	37%	0.367	S	S	.	.	H	α-helix	trans	-59.9	-46.2	177.7	-166.7	70.2	0	0	0	111.4	A28 I31 V32 G57 F58 P65	A28-L61 HydrophobicContact CB-CD1 4.13Å; I31-L61 HydrophobicContact CB-CD1 3.98Å; I31-L61 HydrophobicContact CD1-CD1 4.31Å; I31-L61 HydrophobicContact CG2-CB 3.88Å; I31-L61 HydrophobicContact CG2-CD1 3.89Å; I31-L61 HydrophobicContact CG2-CG 4.4Å; V32-L61 HydrophobicContact CG2-CD1 3.93Å; V32-L61 HydrophobicContact CG2-CD2 4.28Å; G57-L61 PolarHBondContact O-N 2.9Å; F58-L61 WeakPolarHBondContact O-CB 3.49Å; F58-L61 PolarHBondContact O-N 3.08Å; L61-P65 WeakPolarHBondContact O-CD 3.37Å
62	M	76	Confident	69.2	Low	149 Å²	149	74.2 Å²	74.2	73%	0.734	37%	0.374	S	S	*	.	H	α-helix	trans	-72.3	-34.7	177.8	-67.1	-63.6	-77.4	0	0	112.4	F58 L60	F58-M62 WeakPolarHBondContact O-CG 3.11Å; F58-M62 PolarHBondContact O-N 3.32Å; L60-M62 VanDerWaalsContact C-N 3.34Å; L60-M62 PolarHBondContact O-N 3.1Å
63	G	71.3	Confident	68.7	Low	26 Å²	26	74.1 Å²	74.1	27%	0.268	37%	0.368	S	S	.	.	H	α-helix	trans	-76.3	-23.7	-179.4	0	0	0	0	0	113.9	A59 L60 V66 A67	A59-G63 WeakPolarHBondContact O-CA 3.28Å; A59-G63 PolarHBondContact O-N 3.3Å; L60-G63 PolarHBondContact O-N 2.88Å; G63-V66 WeakPolarHBondContact O-CB 3.12Å; G63-V66 PolarHBondContact O-N 2.78Å; G63-V66 VanDerWaalsContact O-N 3.1Å; G63-A67 WeakPolarHBondContact O-CB 3.31Å; G63-A67 PolarHBondContact O-N 3.01Å
64	G	66.9	Low	68	Low	2 Å²	2	77.7 Å²	77.7	2%	0.021	39%	0.393	C	S	.	.	H	α-helix	trans	-52.8	-55.6	-178.3	0	0	0	0	0	113.7	L24 L60 V66 A67 L68 F76	L24-G64 VanDerWaalsContact CD1-C 3.45Å; L60-G64 PolarHBondContact O-N 2.79Å; G64-V66 VanDerWaalsContact C-N 3.27Å; G64-V66 PolarHBondContact O-N 3.12Å; G64-A67 PolarHBondContact O-N 3.11Å; G64-L68 WeakPolarHBondContact O-CB 3.49Å; G64-L68 PolarHBondContact O-N 3.07Å; G64-F76 VanDerWaalsContact CA-CE2 3.46Å
65	P	66.8	Low	67.4	Low	66 Å²	66	81.9 Å²	81.9	43%	0.429	41%	0.413	S	S	.	.	H	α-helix	trans	-59.8	-35.4	176.5	-24.2	33.6	0	0	0	113.4	L61 R69	L61-P65 WeakPolarHBondContact O-CD 3.37Å; P65-R69 PolarHBondContact O-N 3.39Å; P65-R69 VanDerWaalsContact O-N 3.11Å
66	V	66.3	Low	66.9	Low	82 Å²	82	77.5 Å²	77.5	50%	0.497	39%	0.39	S	S	.	.	H	α-helix	trans	-70.9	-48.2	179.8	-178.5	0	0	0	0	110.8	G63 G64 L68 R69 I70	G63-V66 WeakPolarHBondContact O-CB 3.12Å; G63-V66 PolarHBondContact O-N 2.78Å; G63-V66 VanDerWaalsContact O-N 3.1Å; G64-V66 VanDerWaalsContact C-N 3.27Å; G64-V66 PolarHBondContact O-N 3.12Å; V66-L68 PolarHBondContact O-N 3.27Å; V66-R69 PolarHBondContact O-N 2.98Å; V66-R69 VanDerWaalsContact O-N 3.12Å; V66-I70 HydrophobicContact CG1-CD1 3.72Å; V66-I70 HydrophobicContact CG1-CG1 4.5Å; V66-I70 WeakPolarHBondContact O-CG1 3.48Å; V66-I70 PolarHBondContact O-N 3.06Å
67	A	56.1	Low	66.3	Low	18 Å²	18	74.9 Å²	74.9	15%	0.149	37%	0.373	C	S	.	.	H	α-helix	trans	-59.4	-36	177.5	0	0	0	0	0	111.6	G63 G64 I70 R71 Y72 F76	G63-A67 WeakPolarHBondContact O-CB 3.31Å; G63-A67 PolarHBondContact O-N 3.01Å; G64-A67 PolarHBondContact O-N 3.11Å; A67-I70 PolarHBondContact O-N 3.4Å; A67-R71 PolarHBondContact O-N 2.58Å; A67-R71 VanDerWaalsContact O-N 3.17Å; A67-Y72 PolarHBondContact O-N 2.88Å; A67-F76 HydrophobicContact CB-CB 3.74Å; A67-F76 HydrophobicContact CB-CD2 4.22Å; A67-F76 HydrophobicContact CB-CG 4.1Å
68	L	56.7	Low	65.7	Low	49 Å²	49	78.1 Å²	78.1	26%	0.257	39%	0.393	S	S	.	.	H	α-helix	trans	-66.9	-44.5	175.6	-129.1	155.2	0	0	0	112.1	P20 L24 G64 V66 I70 R71 F73	P20-L68 HydrophobicContact CB-CD1 4.26Å; P20-L68 HydrophobicContact CB-CD2 3.41Å; P20-L68 VanDerWaalsContact CB-CD2 3.41Å; P20-L68 HydrophobicContact CB-CG 4.35Å; L24-L68 HydrophobicContact CB-CD1 3.6Å; L24-L68 HydrophobicContact CD1-CD1 3.55Å; L24-L68 HydrophobicContact CD2-CD1 4.39Å; L24-L68 HydrophobicContact CG-CD1 4.02Å; G64-L68 WeakPolarHBondContact O-CB 3.49Å; G64-L68 PolarHBondContact O-N 3.07Å; V66-L68 PolarHBondContact O-N 3.27Å; L68-I70 VanDerWaalsContact C-N 3.3Å; L68-I70 PolarHBondContact O-N 3.45Å; L68-R71 PolarHBondContact O-N 3.32Å; L68-F73 HydrophobicContact CG-CD2 4.3Å
69	R	57.5	Low	65.2	Low	229 Å²	229	76 Å²	76	86%	0.864	39%	0.391	S	S	*	.	H	α-helix	trans	-60.8	-36.2	174.6	-80	-166.5	178.2	-161.8	1.4	113.3	P65 V66 R71	P65-R69 PolarHBondContact O-N 3.39Å; P65-R69 VanDerWaalsContact O-N 3.11Å; V66-R69 PolarHBondContact O-N 2.98Å; V66-R69 VanDerWaalsContact O-N 3.12Å; R69-R71 VanDerWaalsContact C-N 3.34Å
70	I	57.4	Low	64.8	Low	103 Å²	103	73 Å²	73	53%	0.528	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	7.1	-176.3	-47.3	168.7	0	0	0	111.8	V66 A67 L68 Y72	V66-I70 HydrophobicContact CG1-CD1 3.72Å; V66-I70 HydrophobicContact CG1-CG1 4.5Å; V66-I70 WeakPolarHBondContact O-CG1 3.48Å; V66-I70 PolarHBondContact O-N 3.06Å; A67-I70 PolarHBondContact O-N 3.4Å; L68-I70 VanDerWaalsContact C-N 3.3Å; L68-I70 PolarHBondContact O-N 3.45Å; I70-Y72 HydrophobicContact CB-CD2 3.91Å; I70-Y72 HydrophobicContact CB-CE2 4.45Å; I70-Y72 HydrophobicContact CG2-CD2 3.49Å; I70-Y72 VanDerWaalsContact CG2-CD2 3.49Å; I70-Y72 HydrophobicContact CG2-CE2 3.53Å; I70-Y72 PolarHBondContact O-N 3.42Å
71	R	60.7	Low	64.3	Low	230 Å²	230	72.8 Å²	72.8	87%	0.868	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.1	18.7	-178.5	-56.8	-178.8	175.9	179.6	-1.7	115.1	A67 L68 R69 F73	A67-R71 PolarHBondContact O-N 2.58Å; A67-R71 VanDerWaalsContact O-N 3.17Å; L68-R71 PolarHBondContact O-N 3.32Å; R69-R71 VanDerWaalsContact C-N 3.34Å; R71-F73 PolarHBondContact O-N 3.45Å; R71-F73 VanDerWaalsContact O-N 3.11Å
72	Y	56.7	Low	63.8	Low	137 Å²	137	71.6 Å²	71.6	54%	0.537	36%	0.363	S	S	.	.			trans	-85.3	37.7	173.4	-76.1	-69.4	0	0	0	112.8	A67 I70 S74 I75 F76	A67-Y72 PolarHBondContact O-N 2.88Å; I70-Y72 HydrophobicContact CB-CD2 3.91Å; I70-Y72 HydrophobicContact CB-CE2 4.45Å; I70-Y72 HydrophobicContact CG2-CD2 3.49Å; I70-Y72 VanDerWaalsContact CG2-CD2 3.49Å; I70-Y72 HydrophobicContact CG2-CE2 3.53Å; I70-Y72 PolarHBondContact O-N 3.42Å; Y72-S74 PolarHBondContact O-N 2.92Å; Y72-I75 HydrophobicContact CD1-CD1 3.59Å; Y72-I75 HydrophobicContact CD1-CG1 4.39Å; Y72-I75 HydrophobicContact CE1-CD1 4.12Å; Y72-I75 PolarHBondContact O-N 3.06Å; Y72-F76 PolarHBondContact O-N 3.39Å; Y72-F76 VanDerWaalsContact O-N 3.09Å
73	F	62.5	Low	63.6	Low	45 Å²	45	65 Å²	65	20%	0.197	33%	0.33	C	S	.	.	H	α-helix	trans	-62.7	-40.3	-172.3	-177.4	-108.8	0	0	0	113.4	T23 L68 R71 F76 L77	T23-F73 HydrophobicContact CG2-CE1 4.44Å; T23-F73 HydrophobicContact CG2-CE2 3.7Å; T23-F73 HydrophobicContact CG2-CZ 3.34Å; L68-F73 HydrophobicContact CG-CD2 4.3Å; R71-F73 PolarHBondContact O-N 3.45Å; R71-F73 VanDerWaalsContact O-N 3.11Å; F73-F76 PolarHBondContact O-N 3.46Å; F73-L77 HydrophobicContact CD1-CD1 3.63Å; F73-L77 HydrophobicContact CD1-CG 4.43Å; F73-L77 HydrophobicContact CE1-CD1 3.26Å; F73-L77 HydrophobicContact CE1-CG 4.26Å; F73-L77 HydrophobicContact CE2-CD1 4.24Å; F73-L77 HydrophobicContact CE2-CG 4.45Å; F73-L77 HydrophobicContact CG-CD1 4.29Å; F73-L77 HydrophobicContact CZ-CD1 3.64Å; F73-L77 HydrophobicContact CZ-CG 4.3Å; F73-L77 WeakPolarHBondContact O-CG 3.33Å; F73-L77 PolarHBondContact O-N 3.45Å
74	S	59.6	Low	63.4	Low	76 Å²	76	64.4 Å²	64.4	53%	0.531	32%	0.32	S	S	.	.	H	α-helix	trans	-63.2	-44.7	179.1	-170.4	0	0	0	0	111.6	Y72 L77 T78	Y72-S74 PolarHBondContact O-N 2.92Å; S74-L77 PolarHBondContact O-N 2.87Å; S74-T78 WeakPolarHBondContact O-CB 3.33Å; S74-T78 PolarHBondContact O-N 3.32Å; S74-T78 PolarHBondContact O-OG1 3.2Å
75	I	63.4	Low	63.2	Low	98 Å²	98	64.4 Å²	64.4	50%	0.503	32%	0.321	S	S	.	.	H	α-helix	trans	-63.1	-46.6	178.3	-58.6	-177.1	0	0	0	109.8	Y72 L77 T78 S79	Y72-I75 HydrophobicContact CD1-CD1 3.59Å; Y72-I75 HydrophobicContact CD1-CG1 4.39Å; Y72-I75 HydrophobicContact CE1-CD1 4.12Å; Y72-I75 PolarHBondContact O-N 3.06Å; I75-L77 PolarHBondContact O-N 2.78Å; I75-T78 PolarHBondContact O-N 3.17Å; I75-S79 WeakPolarHBondContact O-CB 3.16Å; I75-S79 PolarHBondContact O-N 3.05Å; I75-S79 PolarHBondContact O-OG 2.8Å; I75-S79 VanDerWaalsContact O-OG 3.1Å
76	F	65.5	Low	63	Low	16 Å²	16	63.1 Å²	63.1	7%	0.07	31%	0.307	C	S	.	.	H	α-helix	trans	-56.6	-48.5	176.9	173.3	-102.4	0	0	0	112.6	I31 L60 G64 A67 Y72 F73 T78 S79 L80	I31-F76 HydrophobicContact CD1-CZ 4.22Å; L60-F76 HydrophobicContact CB-CE2 4.34Å; L60-F76 HydrophobicContact CD2-CD2 4.18Å; L60-F76 HydrophobicContact CD2-CE2 4.05Å; L60-F76 VanDerWaalsContact O-CE2 3.32Å; L60-F76 WeakPolarHBondContact O-CE2 3.45Å; G64-F76 VanDerWaalsContact CA-CE2 3.46Å; A67-F76 HydrophobicContact CB-CB 3.74Å; A67-F76 HydrophobicContact CB-CD2 4.22Å; A67-F76 HydrophobicContact CB-CG 4.1Å; Y72-F76 PolarHBondContact O-N 3.39Å; Y72-F76 VanDerWaalsContact O-N 3.09Å; F73-F76 PolarHBondContact O-N 3.46Å; F76-T78 VanDerWaalsContact C-N 3.33Å; F76-T78 PolarHBondContact O-N 3.47Å; F76-S79 PolarHBondContact O-N 2.82Å; F76-L80 HydrophobicContact CE1-CD2 4.35Å; F76-L80 VanDerWaalsContact O-CB 3.26Å; F76-L80 WeakPolarHBondContact O-CB 3.38Å; F76-L80 PolarHBondContact O-N 2.59Å
77	L	65.1	Low	63	Low	14 Å²	14	59.2 Å²	59.2	7%	0.073	28%	0.284	C	S	.	.	H	α-helix	trans	-63.2	-40.5	178	-71	172.3	0	0	0	111.9	T23 F73 S74 I75 L80 D81 R119	T23-L77 HydrophobicContact CG2-CD2 3.79Å; F73-L77 HydrophobicContact CD1-CD1 3.63Å; F73-L77 HydrophobicContact CD1-CG 4.43Å; F73-L77 HydrophobicContact CE1-CD1 3.26Å; F73-L77 HydrophobicContact CE1-CG 4.26Å; F73-L77 HydrophobicContact CE2-CD1 4.24Å; F73-L77 HydrophobicContact CE2-CG 4.45Å; F73-L77 HydrophobicContact CG-CD1 4.29Å; F73-L77 HydrophobicContact CZ-CD1 3.64Å; F73-L77 HydrophobicContact CZ-CG 4.3Å; F73-L77 WeakPolarHBondContact O-CG 3.33Å; F73-L77 PolarHBondContact O-N 3.45Å; S74-L77 PolarHBondContact O-N 2.87Å; I75-L77 PolarHBondContact O-N 2.78Å; L77-L80 WeakPolarHBondContact O-CB 3.26Å; L77-L80 PolarHBondContact O-N 2.91Å; L77-D81 WeakPolarHBondContact O-CB 3.5Å; L77-D81 PolarHBondContact O-N 3.12Å; L77-R119 VanDerWaalsContact CD2-NH2 3.29Å
78	T	63.9	Low	63.4	Low	68 Å²	68	59 Å²	59	42%	0.417	28%	0.28	S	S	.	.	H	α-helix	trans	-63.9	-44.8	178	-48.8	0	0	0	0	110.8	S74 I75 F76 D81 A82 S146	S74-T78 WeakPolarHBondContact O-CB 3.33Å; S74-T78 PolarHBondContact O-N 3.32Å; S74-T78 PolarHBondContact O-OG1 3.2Å; I75-T78 PolarHBondContact O-N 3.17Å; F76-T78 VanDerWaalsContact C-N 3.33Å; F76-T78 PolarHBondContact O-N 3.47Å; T78-D81 PolarHBondContact O-N 3Å; T78-A82 WeakPolarHBondContact O-CB 3.25Å; T78-A82 PolarHBondContact O-N 3.3Å; T78-S146 WeakPolarHBondContact O-CB 3.5Å
79	S	67.3	Low	63.5	Low	55 Å²	55	57 Å²	57	39%	0.385	27%	0.269	S	S	.	.	H	α-helix	trans	-65.1	-39.5	175.1	-61.7	0	0	0	0	112.2	I75 F76 A82 W83	I75-S79 WeakPolarHBondContact O-CB 3.16Å; I75-S79 PolarHBondContact O-N 3.05Å; I75-S79 PolarHBondContact O-OG 2.8Å; I75-S79 VanDerWaalsContact O-OG 3.1Å; F76-S79 PolarHBondContact O-N 2.82Å; S79-A82 PolarHBondContact O-N 2.96Å; S79-W83 VanDerWaalsContact O-CB 3.28Å; S79-W83 WeakPolarHBondContact O-CB 3.21Å; S79-W83 PolarHBondContact O-N 3.14Å
80	L	69.3	Low	63.7	Low	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-61.9	-47.8	175.9	175	64	0	0	0	111.5	I31 L60 F76 L77 W83 L84	I31-L80 HydrophobicContact CD1-CD1 3.72Å; I31-L80 HydrophobicContact CG1-CD1 3.32Å; L60-L80 HydrophobicContact CD1-CD1 4.46Å; F76-L80 HydrophobicContact CE1-CD2 4.35Å; F76-L80 VanDerWaalsContact O-CB 3.26Å; F76-L80 WeakPolarHBondContact O-CB 3.38Å; F76-L80 PolarHBondContact O-N 2.59Å; L77-L80 WeakPolarHBondContact O-CB 3.26Å; L77-L80 PolarHBondContact O-N 2.91Å; L80-W83 HydrophobicContact CD1-CE3 3.96Å; L80-W83 HydrophobicContact CD1-CZ3 4.24Å; L80-W83 PolarHBondContact O-N 3.41Å; L80-L84 VanDerWaalsContact O-CB 3.25Å; L80-L84 WeakPolarHBondContact O-CB 3.41Å; L80-L84 PolarHBondContact O-N 3.15Å
81	D	65.9	Low	63.8	Low	16 Å²	16	41.8 Å²	41.8	9%	0.086	21%	0.205	C	C	.	.	H	α-helix	trans	-65.8	-40.1	-179.5	-67.7	-20.9	0	0	0	110.9	L77 T78 L84 G85 R119 M123 S146 C147	L77-D81 WeakPolarHBondContact O-CB 3.5Å; L77-D81 PolarHBondContact O-N 3.12Å; T78-D81 PolarHBondContact O-N 3Å; D81-L84 PolarHBondContact O-N 3.35Å; D81-G85 PolarHBondContact O-N 2.88Å; D81-R119 IonicContact OD1-CZ 3.94Å; D81-R119 IonicContact OD1-NE 3.5Å; D81-R119 IonicContact OD1-NH2 3.69Å; D81-R119 PolarHBondContact OD1-NH2 3.32Å; D81-R119 IonicContact OD2-NH2 3.25Å; D81-M123 WeakPolarHBondContact OD2-CE 3.44Å; D81-S146 WeakPolarHBondContact CB-OG 3.19Å; D81-C147 HydrophobicContact CB-CB 4.36Å; D81-C147 VanDerWaalsContact O-CA 3.25Å; D81-C147 WeakPolarHBondContact O-CA 3.39Å; D81-C147 WeakPolarHBondContact O-CB 3.21Å
82	A	64	Low	63.6	Low	25 Å²	25	31.3 Å²	31.3	21%	0.207	17%	0.167	C	C	.	.	H	α-helix	trans	-64.4	-44.7	174.4	0	0	0	0	0	112.3	T78 S79 L84 G85 Y86 S146 G150	T78-A82 WeakPolarHBondContact O-CB 3.25Å; T78-A82 PolarHBondContact O-N 3.3Å; S79-A82 PolarHBondContact O-N 2.96Å; A82-L84 VanDerWaalsContact C-N 3.33Å; A82-L84 PolarHBondContact O-N 2.9Å; A82-G85 PolarHBondContact O-N 3.46Å; A82-Y86 PolarHBondContact O-N 2.92Å; A82-S146 WeakPolarHBondContact CA-O 3.49Å; A82-S146 WeakPolarHBondContact CB-O 3.38Å; A82-G150 VanDerWaalsContact O-CA 3.26Å; A82-G150 WeakPolarHBondContact O-CA 3.36Å
83	W	72.3	Confident	63.6	Low	11 Å²	11	26.3 Å²	26.3	4%	0.042	15%	0.15	C	C	.	.	H	α-helix	trans	-62.6	-41.1	174.5	170.9	79.2	0	0	0	111.8	I31 T34 L35 A53 V56 L60 S79 L80 G85 Y86 A87	I31-W83 HydrophobicContact CB-CH2 4.38Å; I31-W83 HydrophobicContact CB-CZ3 4.27Å; I31-W83 HydrophobicContact CG1-CZ3 4Å; I31-W83 HydrophobicContact CG2-CH2 3.99Å; I31-W83 HydrophobicContact CG2-CZ3 4.28Å; T34-W83 HydrophobicContact CG2-CH2 3.73Å; T34-W83 HydrophobicContact CG2-CZ2 4.27Å; T34-W83 HydrophobicContact CG2-CZ3 4.14Å; L35-W83 HydrophobicContact CD2-CZ2 4.19Å; L35-W83 HydrophobicContact CG-CH2 4.32Å; L35-W83 HydrophobicContact CG-CZ2 4.33Å; A53-W83 PolarHBondContact O-NE1 3.21Å; V56-W83 HydrophobicContact CG1-CB 4.44Å; V56-W83 VanDerWaalsContact CG1-CD1 3.47Å; V56-W83 HydrophobicContact CG1-CG 4.14Å; L60-W83 HydrophobicContact CD1-CB 3.47Å; L60-W83 VanDerWaalsContact CD1-CB 3.47Å; L60-W83 HydrophobicContact CD1-CD2 3.83Å; L60-W83 HydrophobicContact CD1-CE3 4.13Å; L60-W83 HydrophobicContact CD1-CG 3.54Å; S79-W83 VanDerWaalsContact O-CB 3.28Å; S79-W83 WeakPolarHBondContact O-CB 3.21Å; S79-W83 PolarHBondContact O-N 3.14Å; L80-W83 HydrophobicContact CD1-CE3 3.96Å; L80-W83 HydrophobicContact CD1-CZ3 4.24Å; L80-W83 PolarHBondContact O-N 3.41Å; W83-G85 PolarHBondContact O-N 2.99Å; W83-Y86 PolarHBondContact O-N 2.75Å; W83-A87 HydrophobicContact CD2-CB 4.47Å; W83-A87 HydrophobicContact CZ2-CB 4.22Å; W83-A87 VanDerWaalsContact O-CB 3.3Å; W83-A87 WeakPolarHBondContact O-CB 3.36Å; W83-A87 PolarHBondContact O-N 3.36Å
84	L	68.5	Low	63.3	Low	12 Å²	12	24.5 Å²	24.5	6%	0.063	14%	0.142	C	C	.	.	H	α-helix	trans	-61.8	-44.9	177.9	-173.8	67.7	0	0	0	110.7	V30 T34 L80 D81 A82 Y86 A87 L88 L116	V30-L84 HydrophobicContact CG1-CD1 3.7Å; V30-L84 HydrophobicContact CG1-CD2 4.01Å; V30-L84 HydrophobicContact CG1-CG 4.46Å; T34-L84 HydrophobicContact CG2-CD1 4.22Å; T34-L84 WeakPolarHBondContact OG1-CD1 3.39Å; L80-L84 VanDerWaalsContact O-CB 3.25Å; L80-L84 WeakPolarHBondContact O-CB 3.41Å; L80-L84 PolarHBondContact O-N 3.15Å; D81-L84 PolarHBondContact O-N 3.35Å; A82-L84 VanDerWaalsContact C-N 3.33Å; A82-L84 PolarHBondContact O-N 2.9Å; L84-Y86 VanDerWaalsContact C-N 3.34Å; L84-Y86 PolarHBondContact O-N 3.08Å; L84-A87 PolarHBondContact O-N 3.3Å; L84-L88 HydrophobicContact CD1-CD1 4.24Å; L84-L88 HydrophobicContact CD1-CG 4.24Å; L84-L88 HydrophobicContact CG-CD1 3.87Å; L84-L88 HydrophobicContact CG-CG 4.3Å; L84-L88 VanDerWaalsContact O-CB 3.25Å; L84-L88 WeakPolarHBondContact O-CB 2.85Å; L84-L88 WeakPolarHBondContact O-CG 3.46Å; L84-L88 PolarHBondContact O-N 3.34Å; L84-L116 HydrophobicContact CD1-CD2 4.36Å; L84-L116 HydrophobicContact CD2-CD2 4Å; L84-L116 HydrophobicContact CG-CD2 4.49Å
85	G	61.3	Low	62.9	Low	3 Å²	3	21.7 Å²	21.7	3%	0.031	12%	0.121	C	C	.	.	H	α-helix	trans	-57.4	-45	173.3	0	0	0	0	0	112.5	D81 A82 W83 F89 C147	D81-G85 PolarHBondContact O-N 2.88Å; A82-G85 PolarHBondContact O-N 3.46Å; W83-G85 PolarHBondContact O-N 2.99Å; G85-F89 VanDerWaalsContact O-CB 3.24Å; G85-F89 WeakPolarHBondContact O-CB 3.37Å; G85-F89 PolarHBondContact O-N 2.88Å; G85-F89 VanDerWaalsContact O-N 3.07Å; G85-C147 VanDerWaalsContact CA-SG 3.58Å
86	Y	63.6	Low	62.2	Low	38 Å²	38	20.8 Å²	20.8	15%	0.149	12%	0.121	C	C	.	.	H	α-helix	trans	-65.2	-47.1	176.6	-175.6	-101.7	0	0	0	112.9	A53 A82 W83 L84 F89 R90 L153	A53-Y86 HydrophobicContact CB-CD1 3.92Å; A53-Y86 HydrophobicContact CB-CE1 3.74Å; A82-Y86 PolarHBondContact O-N 2.92Å; W83-Y86 PolarHBondContact O-N 2.75Å; L84-Y86 VanDerWaalsContact C-N 3.34Å; L84-Y86 PolarHBondContact O-N 3.08Å; Y86-F89 WeakPolarHBondContact O-CB 3.41Å; Y86-F89 PolarHBondContact O-N 3.31Å; Y86-R90 HydrophobicContact CD1-CG 4.46Å; Y86-R90 HydrophobicContact CE1-CG 4.13Å; Y86-R90 WeakPolarHBondContact O-CG 3.48Å; Y86-R90 PolarHBondContact O-N 3.38Å; Y86-L153 HydrophobicContact CD2-CB 4.44Å
87	A	66	Low	61.5	Low	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-67.2	-43.5	-177.8	0	0	0	0	0	111.7	T34 W83 L84 F89 R90 L91	T34-A87 HydrophobicContact CG2-CB 3.68Å; W83-A87 HydrophobicContact CD2-CB 4.47Å; W83-A87 HydrophobicContact CZ2-CB 4.22Å; W83-A87 VanDerWaalsContact O-CB 3.3Å; W83-A87 WeakPolarHBondContact O-CB 3.36Å; W83-A87 PolarHBondContact O-N 3.36Å; L84-A87 PolarHBondContact O-N 3.3Å; A87-F89 VanDerWaalsContact C-N 3.31Å; A87-F89 PolarHBondContact O-N 3.37Å; A87-R90 PolarHBondContact O-N 3.21Å; A87-L91 WeakPolarHBondContact O-CB 3.28Å; A87-L91 WeakPolarHBondContact O-CG 3.31Å; A87-L91 PolarHBondContact O-N 2.89Å
88	L	63.3	Low	60.6	Low	13 Å²	13	25.7 Å²	25.7	7%	0.068	14%	0.142	C	C	.	.	H	α-helix	trans	-60.7	-42.3	173.6	-72.5	172.3	0	0	0	111.1	L84 R90 L91 C92 L112 L116	L84-L88 HydrophobicContact CD1-CD1 4.24Å; L84-L88 HydrophobicContact CD1-CG 4.24Å; L84-L88 HydrophobicContact CG-CD1 3.87Å; L84-L88 HydrophobicContact CG-CG 4.3Å; L84-L88 VanDerWaalsContact O-CB 3.25Å; L84-L88 WeakPolarHBondContact O-CB 2.85Å; L84-L88 WeakPolarHBondContact O-CG 3.46Å; L84-L88 PolarHBondContact O-N 3.34Å; L88-R90 VanDerWaalsContact C-N 3.35Å; L88-R90 PolarHBondContact O-N 2.88Å; L88-L91 PolarHBondContact O-N 2.73Å; L88-C92 WeakPolarHBondContact O-CB 3.46Å; L88-C92 PolarHBondContact O-N 3.42Å; L88-C92 PolarHBondContact O-SG 3.25Å; L88-L112 HydrophobicContact CD2-CD1 3.94Å; L88-L112 HydrophobicContact CD2-CD2 4.07Å; L88-L112 HydrophobicContact CD2-CG 4.27Å; L88-L116 HydrophobicContact CD1-CD2 4.03Å; L88-L116 HydrophobicContact CD2-CD1 4.07Å
89	F	59.7	Low	60.2	Low	7 Å²	7	30 Å²	30	3%	0.031	16%	0.161	C	C	.	.	H	α-helix	trans	-58.5	-46	175.4	-177.4	-81	0	0	0	111.6	G85 Y86 A87 C92 D93 G154 Y155 H158 H166 W169	G85-F89 VanDerWaalsContact O-CB 3.24Å; G85-F89 WeakPolarHBondContact O-CB 3.37Å; G85-F89 PolarHBondContact O-N 2.88Å; G85-F89 VanDerWaalsContact O-N 3.07Å; Y86-F89 WeakPolarHBondContact O-CB 3.41Å; Y86-F89 PolarHBondContact O-N 3.31Å; A87-F89 VanDerWaalsContact C-N 3.31Å; A87-F89 PolarHBondContact O-N 3.37Å; F89-C92 WeakPolarHBondContact O-CB 3.44Å; F89-C92 PolarHBondContact O-N 2.87Å; F89-D93 PolarHBondContact O-N 3.24Å; F89-G154 WeakPolarHBondContact CE1-O 3.25Å; F89-Y155 VanDerWaalsContact CZ-CA 3.43Å; F89-H158 AromaticContact CE1-CD2 3.84Å; F89-H166 AromaticContact CE2-CD2 3.42Å; F89-H166 VanDerWaalsContact CE2-CD2 3.42Å; F89-H166 WeakPolarHBondContact CE2-CD2 3.44Å; F89-H166 AromaticContact CE2-NE2 3.99Å; F89-H166 AromaticContact CZ-CD2 3.61Å; F89-H166 AromaticContact CZ-NE2 3.86Å; F89-W169 HydrophobicContact CD2-CE3 4.39Å; F89-W169 AromaticContact CD2-CZ3 3.91Å; F89-W169 HydrophobicContact CD2-CZ3 3.91Å
90	R	61.4	Low	59.5	Low	9 Å²	9	28.5 Å²	28.5	3%	0.034	15%	0.149	C	C	.	.	H	α-helix	trans	-67.5	-38.8	177.8	-68.1	-53.7	-171.2	160.9	8.9	113.5	L38 D49 Y86 A87 L88 C92 D93 L94 S157	L38-R90 HydrophobicContact CD1-CB 4.44Å; D49-R90 VanDerWaalsContact CB-NH2 3.27Å; D49-R90 IonicContact OD1-NH2 2.81Å; D49-R90 IonicContact OD2-CZ 2.73Å; D49-R90 IonicContact OD2-NH1 3.42Å; D49-R90 IonicContact OD2-NH2 2.67Å; D49-R90 PolarHBondContact OD2-NH2 3.47Å; Y86-R90 HydrophobicContact CD1-CG 4.46Å; Y86-R90 HydrophobicContact CE1-CG 4.13Å; Y86-R90 WeakPolarHBondContact O-CG 3.48Å; Y86-R90 PolarHBondContact O-N 3.38Å; A87-R90 PolarHBondContact O-N 3.21Å; L88-R90 VanDerWaalsContact C-N 3.35Å; L88-R90 PolarHBondContact O-N 2.88Å; R90-C92 VanDerWaalsContact C-N 3.35Å; R90-D93 PolarHBondContact O-N 3.47Å; R90-L94 WeakPolarHBondContact O-CB 3.21Å; R90-L94 WeakPolarHBondContact O-CG 3.19Å; R90-L94 PolarHBondContact O-N 3.44Å; R90-S157 PolarHBondContact NH2-OG 2.85Å
91	L	60.4	Low	58.7	Low	4 Å²	4	31.7 Å²	31.7	2%	0.021	17%	0.169	C	C	.	.	H	α-helix	trans	-59	-47	172.3	-79.2	166.2	0	0	0	111.1	T34 A37 L38 V41 A87 L88 D93 L94 Q95 L112	T34-L91 HydrophobicContact CG2-CD1 4.21Å; A37-L91 HydrophobicContact CB-CD1 3.86Å; A37-L91 HydrophobicContact CB-CD2 3.88Å; A37-L91 WeakPolarHBondContact O-CD2 3.15Å; L38-L91 HydrophobicContact CB-CD2 4.33Å; L38-L91 HydrophobicContact CD1-CD2 4.11Å; L38-L91 HydrophobicContact CD1-CG 3.86Å; V41-L91 HydrophobicContact CG2-CD2 4.02Å; A87-L91 WeakPolarHBondContact O-CB 3.28Å; A87-L91 WeakPolarHBondContact O-CG 3.31Å; A87-L91 PolarHBondContact O-N 2.89Å; L88-L91 PolarHBondContact O-N 2.73Å; L91-D93 VanDerWaalsContact C-N 3.28Å; L91-D93 PolarHBondContact O-N 3.39Å; L91-L94 PolarHBondContact O-N 3Å; L91-Q95 WeakPolarHBondContact O-CB 3.25Å; L91-Q95 PolarHBondContact O-N 3.15Å; L91-L112 HydrophobicContact CD1-CD1 3.97Å; L91-L112 HydrophobicContact CD1-CD2 4.1Å
92	C	56.3	Low	57.8	Low	10 Å²	10	34.9 Å²	34.9	7%	0.068	19%	0.193	C	C	.	.	H	α-helix	trans	-58.7	-37.9	179.5	-70.3	0	0	0	0	113.2	L88 F89 R90 P96 A214 I217	L88-C92 WeakPolarHBondContact O-CB 3.46Å; L88-C92 PolarHBondContact O-N 3.42Å; L88-C92 PolarHBondContact O-SG 3.25Å; F89-C92 WeakPolarHBondContact O-CB 3.44Å; F89-C92 PolarHBondContact O-N 2.87Å; R90-C92 VanDerWaalsContact C-N 3.35Å; C92-P96 WeakPolarHBondContact O-CD 3.45Å; C92-A214 HydrophobicContact CB-CB 4.02Å; C92-I217 VanDerWaalsContact SG-CD1 3.52Å
93	D	55.6	Low	56.9	Low	32 Å²	32	41.6 Å²	41.6	17%	0.171	21%	0.213	C	C	.	.	H	α-helix	trans	-77.7	-39.2	-179.2	172.4	42.3	0	0	0	113.2	F89 R90 L91 K97 H158	F89-D93 PolarHBondContact O-N 3.24Å; R90-D93 PolarHBondContact O-N 3.47Å; L91-D93 VanDerWaalsContact C-N 3.28Å; L91-D93 PolarHBondContact O-N 3.39Å; D93-K97 IonicContact OD1-NZ 3.29Å; D93-K97 PolarHBondContact OD1-NZ 3.11Å; D93-H158 IonicContact OD1-CE1 3.31Å; D93-H158 IonicContact OD1-NE2 3.97Å; D93-H158 PolarHBondContact OD1-NE2 3.03Å; D93-H158 IonicContact OD2-CD2 3.52Å; D93-H158 IonicContact OD2-CE1 2.82Å; D93-H158 PolarHBondContact OD2-CE1 2.77Å; D93-H158 VanDerWaalsContact OD2-CE1 3.25Å; D93-H158 IonicContact OD2-NE2 2.72Å; D93-H158 PolarHBondContact OD2-NE2 3.38Å
94	L	57.4	Low	55.8	Low	8 Å²	8	43.5 Å²	43.5	4%	0.042	22%	0.224	C	C	.	.	H	α-helix	trans	-96.1	-26.8	-167.7	-67.7	168.7	0	0	0	113.8	V41 H45 C50 R90 L91 P96 K97	V41-L94 HydrophobicContact CG1-CB 3.33Å; V41-L94 HydrophobicContact CG1-CD1 3.9Å; V41-L94 HydrophobicContact CG1-CG 4.26Å; H45-L94 HydrophobicContact CB-CD2 4.46Å; H45-L94 PolarHBondContact NE2-O 3.31Å; H45-L94 VanDerWaalsContact NE2-O 3.14Å; C50-L94 HydrophobicContact CB-CD1 4.37Å; C50-L94 WeakPolarHBondContact SG-CD1 3.3Å; R90-L94 WeakPolarHBondContact O-CB 3.21Å; R90-L94 WeakPolarHBondContact O-CG 3.19Å; R90-L94 PolarHBondContact O-N 3.44Å; L91-L94 PolarHBondContact O-N 3Å; L94-P96 VanDerWaalsContact C-CD 3.47Å; L94-K97 WeakPolarHBondContact O-CB 3.38Å; L94-K97 PolarHBondContact O-N 3.07Å; L94-K97 VanDerWaalsContact O-N 3.13Å
95	Q	51.2	Low	55	Low	17 Å²	17	45.8 Å²	45.8	8%	0.079	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-62.5	-37.7	-178.3	-152.7	-168.2	12	0	0	113.8	L91 K97 I98 I213	L91-Q95 WeakPolarHBondContact O-CB 3.25Å; L91-Q95 PolarHBondContact O-N 3.15Å; Q95-K97 PolarHBondContact O-N 3.34Å; Q95-I98 PolarHBondContact O-N 3.4Å; Q95-I213 HydrophobicContact CB-CD1 4.03Å; Q95-I213 HydrophobicContact CG-CD1 4.23Å
96	P	48.3	Very low	54.2	Low	78 Å²	78	47 Å²	47	51%	0.506	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-58.3	-20.6	174.8	-22.4	32.1	0	0	0	114	C92 L94	C92-P96 WeakPolarHBondContact O-CD 3.45Å; L94-P96 VanDerWaalsContact C-CD 3.47Å
97	K	50	Low	53.3	Low	121 Å²	121	48.4 Å²	48.4	53%	0.526	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-91	1.7	-177.5	-58.9	169.6	-175.1	156.3	0	112.7	H45 D93 L94 Q95	H45-K97 VanDerWaalsContact CE1-CB 3.48Å; H45-K97 WeakPolarHBondContact CE1-CB 3.39Å; D93-K97 IonicContact OD1-NZ 3.29Å; D93-K97 PolarHBondContact OD1-NZ 3.11Å; L94-K97 WeakPolarHBondContact O-CB 3.38Å; L94-K97 PolarHBondContact O-N 3.07Å; L94-K97 VanDerWaalsContact O-N 3.13Å; Q95-K97 PolarHBondContact O-N 3.34Å
98	I	47.7	Very low	52.7	Low	13 Å²	13	48.8 Å²	48.8	7%	0.067	26%	0.256	C	S	.	.			trans	-119.6	114.8	-172.4	-58.9	179.8	0	0	0	111.3	V41 K44 H45 Q95 L100	V41-I98 HydrophobicContact CB-CD1 3.83Å; V41-I98 HydrophobicContact CG1-CD1 3.68Å; V41-I98 HydrophobicContact CG2-CD1 3.77Å; K44-I98 HydrophobicContact CB-CD1 4.35Å; K44-I98 HydrophobicContact CD-CB 4.22Å; K44-I98 HydrophobicContact CD-CD1 4.3Å; K44-I98 HydrophobicContact CD-CG1 3.93Å; K44-I98 HydrophobicContact CD-CG2 3.6Å; H45-I98 WeakPolarHBondContact NE2-CD1 3.49Å; H45-I98 VanDerWaalsContact NE2-CG1 3.26Å; H45-I98 WeakPolarHBondContact NE2-CG1 3.11Å; Q95-I98 PolarHBondContact O-N 3.4Å; I98-L100 HydrophobicContact CB-CD1 4.09Å; I98-L100 HydrophobicContact CG2-CB 4.4Å; I98-L100 HydrophobicContact CG2-CD1 3.29Å; I98-L100 HydrophobicContact CG2-CG 3.51Å; I98-L100 PolarHBondContact O-N 2.94Å
99	I	55.3	Low	52	Low	159 Å²	159	49.1 Å²	49.1	82%	0.815	26%	0.257	S	S	*	.			trans	-74.5	109.9	157.8	-52	170.2	0	0	0	107.5	K44	K44-I99 PolarHBondContact NZ-O 3.44Å
100	L	52.9	Low	51.2	Low	22 Å²	22	51.2 Å²	51.2	12%	0.115	28%	0.275	C	S	.	.			trans	-106.8	155.5	170.6	-86.8	129.9	0	0	0	109.2	P40 I98 S102 L104 Q105	P40-L100 HydrophobicContact CB-CD2 4.22Å; I98-L100 HydrophobicContact CB-CD1 4.09Å; I98-L100 HydrophobicContact CG2-CB 4.4Å; I98-L100 HydrophobicContact CG2-CD1 3.29Å; I98-L100 HydrophobicContact CG2-CG 3.51Å; I98-L100 PolarHBondContact O-N 2.94Å; L100-S102 PolarHBondContact O-N 3.39Å; L100-L104 HydrophobicContact CD2-CB 4.34Å; L100-L104 HydrophobicContact CD2-CD2 3.39Å; L100-L104 HydrophobicContact CD2-CG 4.15Å; L100-Q105 HydrophobicContact CB-CB 4.09Å
101	P	51	Low	50.6	Low	67 Å²	67	54.4 Å²	54.4	44%	0.435	29%	0.293	S	S	.	.			trans	-57	135.1	165.1	-17.6	29.7	0	0	0	109.7	W103 L104 Q105	P101-W103 VanDerWaalsContact C-N 3.31Å; P101-W103 PolarHBondContact O-N 2.66Å; P101-L104 HydrophobicContact CB-CB 4.38Å; P101-L104 PolarHBondContact O-N 2.84Å; P101-Q105 PolarHBondContact O-N 3.5Å
102	S	47	Very low	50.3	Low	83 Å²	83	54.6 Å²	54.6	58%	0.58	29%	0.294	S	S	*	.	H	α-helix	trans	-50.3	-49.4	-173.6	53.3	0	0	0	0	112.4	L100 L104 Q105 T106	L100-S102 PolarHBondContact O-N 3.39Å; S102-L104 VanDerWaalsContact C-N 3.33Å; S102-L104 PolarHBondContact O-N 3.4Å; S102-Q105 WeakPolarHBondContact O-CB 3.19Å; S102-Q105 PolarHBondContact O-N 2.87Å; S102-T106 PolarHBondContact O-N 2.79Å; S102-T106 PolarHBondContact O-OG1 3.21Å
103	W	45.3	Very low	50	Low	167 Å²	167	54.7 Å²	54.7	63%	0.633	29%	0.293	S	S	*	.	H	α-helix	trans	-59.2	-39	179.4	68.8	-92.4	0	0	0	113.5	P101 T106 T107	P101-W103 VanDerWaalsContact C-N 3.31Å; P101-W103 PolarHBondContact O-N 2.66Å; W103-T106 PolarHBondContact O-N 3.36Å; W103-T107 WeakPolarHBondContact O-CB 3.25Å; W103-T107 PolarHBondContact O-N 3.16Å; W103-T107 PolarHBondContact O-OG1 3.28Å
104	L	50	Low	49.4	Very low	50 Å²	50	54.7 Å²	54.7	26%	0.262	30%	0.301	S	S	.	.	H	α-helix	trans	-70.9	-42.5	-179	-162.4	77.8	0	0	0	109.3	L100 P101 S102 T106 T107 Q108	L100-L104 HydrophobicContact CD2-CB 4.34Å; L100-L104 HydrophobicContact CD2-CD2 3.39Å; L100-L104 HydrophobicContact CD2-CG 4.15Å; P101-L104 HydrophobicContact CB-CB 4.38Å; P101-L104 PolarHBondContact O-N 2.84Å; S102-L104 VanDerWaalsContact C-N 3.33Å; S102-L104 PolarHBondContact O-N 3.4Å; L104-T106 PolarHBondContact O-N 3.49Å; L104-T107 PolarHBondContact O-N 3.49Å; L104-Q108 VanDerWaalsContact O-CG 3.3Å; L104-Q108 WeakPolarHBondContact O-CG 3.26Å; L104-Q108 PolarHBondContact O-N 2.68Å
105	Q	51.6	Low	49	Very low	60 Å²	60	54.4 Å²	54.4	28%	0.28	30%	0.3	S	S	.	.	H	α-helix	trans	-60.3	-45.6	174.7	-164.5	175.3	-1.7	0	0	111	L100 P101 S102 T107 Q108 I109	L100-Q105 HydrophobicContact CB-CB 4.09Å; P101-Q105 PolarHBondContact O-N 3.5Å; S102-Q105 WeakPolarHBondContact O-CB 3.19Å; S102-Q105 PolarHBondContact O-N 2.87Å; Q105-T107 VanDerWaalsContact C-N 3.33Å; Q105-T107 PolarHBondContact O-N 2.87Å; Q105-Q108 PolarHBondContact O-N 3.09Å; Q105-I109 HydrophobicContact CG-CD1 3.86Å; Q105-I109 VanDerWaalsContact O-CB 3.25Å; Q105-I109 WeakPolarHBondContact O-CB 3.48Å; Q105-I109 WeakPolarHBondContact O-CD1 3.45Å; Q105-I109 WeakPolarHBondContact O-CG1 3.46Å; Q105-I109 PolarHBondContact O-N 3.28Å
106	T	45.1	Very low	49.1	Very low	28 Å²	28	55.4 Å²	55.4	17%	0.172	31%	0.305	C	S	.	.	H	α-helix	trans	-59	-43.1	175.4	-47	0	0	0	0	111.7	S102 W103 L104 I109 A110 W360	S102-T106 PolarHBondContact O-N 2.79Å; S102-T106 PolarHBondContact O-OG1 3.21Å; W103-T106 PolarHBondContact O-N 3.36Å; L104-T106 PolarHBondContact O-N 3.49Å; T106-I109 WeakPolarHBondContact O-CB 3.28Å; T106-I109 PolarHBondContact O-N 3.37Å; T106-A110 VanDerWaalsContact O-CB 3.29Å; T106-A110 WeakPolarHBondContact O-CB 3.38Å; T106-A110 PolarHBondContact O-N 3.31Å; T106-W360 HydrophobicContact CG2-CH2 4.24Å; T106-W360 HydrophobicContact CG2-CZ3 4.29Å
107	T	43.4	Very low	49	Very low	69 Å²	69	53.3 Å²	53.3	42%	0.423	29%	0.291	S	S	.	.	H	α-helix	trans	-67.3	-42.2	-179.7	-51.7	0	0	0	0	111.5	W103 L104 Q105 A110 L111	W103-T107 WeakPolarHBondContact O-CB 3.25Å; W103-T107 PolarHBondContact O-N 3.16Å; W103-T107 PolarHBondContact O-OG1 3.28Å; L104-T107 PolarHBondContact O-N 3.49Å; Q105-T107 VanDerWaalsContact C-N 3.33Å; Q105-T107 PolarHBondContact O-N 2.87Å; T107-A110 PolarHBondContact O-N 3.36Å; T107-L111 HydrophobicContact CG2-CD1 4.04Å; T107-L111 WeakPolarHBondContact O-CB 3.24Å; T107-L111 WeakPolarHBondContact O-CG 3.34Å; T107-L111 PolarHBondContact O-N 3.27Å
108	Q	53	Low	48.9	Very low	8 Å²	8	53.1 Å²	53.1	4%	0.037	29%	0.29	C	S	.	.	H	α-helix	trans	-61.8	-46.9	175.9	-73.5	-174.1	-46.4	0	0	112.3	C36 A37 P40 L104 Q105 L111 L112	C36-Q108 PolarHBondContact O-NE2 3.3Å; A37-Q108 HydrophobicContact CB-CB 4.39Å; A37-Q108 PolarHBondContact O-NE2 3.49Å; P40-Q108 VanDerWaalsContact CD-NE2 3.28Å; L104-Q108 VanDerWaalsContact O-CG 3.3Å; L104-Q108 WeakPolarHBondContact O-CG 3.26Å; L104-Q108 PolarHBondContact O-N 2.68Å; Q105-Q108 PolarHBondContact O-N 3.09Å; Q108-L111 PolarHBondContact O-N 3.1Å; Q108-L112 VanDerWaalsContact O-CB 3.29Å; Q108-L112 WeakPolarHBondContact O-CB 3.36Å; Q108-L112 PolarHBondContact O-N 3.48Å
109	I	49.9	Very low	49.1	Very low	20 Å²	20	52.9 Å²	52.9	10%	0.103	29%	0.288	C	S	.	.	H	α-helix	trans	-54.5	-57.9	173.5	-78.6	167	0	0	0	108.6	Q105 T106 L111 L112 Y113 L365 A368	Q105-I109 HydrophobicContact CG-CD1 3.86Å; Q105-I109 VanDerWaalsContact O-CB 3.25Å; Q105-I109 WeakPolarHBondContact O-CB 3.48Å; Q105-I109 WeakPolarHBondContact O-CD1 3.45Å; Q105-I109 WeakPolarHBondContact O-CG1 3.46Å; Q105-I109 PolarHBondContact O-N 3.28Å; T106-I109 WeakPolarHBondContact O-CB 3.28Å; T106-I109 PolarHBondContact O-N 3.37Å; I109-L111 VanDerWaalsContact C-N 3.34Å; I109-L111 PolarHBondContact O-N 3.27Å; I109-L112 PolarHBondContact O-N 2.85Å; I109-Y113 VanDerWaalsContact C-CD2 3.41Å; I109-Y113 HydrophobicContact CB-CD2 4.13Å; I109-Y113 HydrophobicContact CB-CE2 3.89Å; I109-Y113 HydrophobicContact CG1-CE2 4.16Å; I109-Y113 HydrophobicContact CG2-CD2 3.52Å; I109-Y113 HydrophobicContact CG2-CE2 3.39Å; I109-Y113 WeakPolarHBondContact O-CB 3.33Å; I109-Y113 WeakPolarHBondContact O-CD2 3.48Å; I109-Y113 PolarHBondContact O-N 2.82Å; I109-L365 HydrophobicContact CD1-CD1 3.35Å; I109-L365 HydrophobicContact CG1-CD1 3.62Å; I109-L365 HydrophobicContact CG2-CD1 4.41Å; I109-A368 HydrophobicContact CG2-CB 3.89Å
110	A	43.2	Very low	48.9	Very low	50 Å²	50	46.5 Å²	46.5	41%	0.413	26%	0.261	S	S	.	.	H	α-helix	trans	-57.9	-42.5	-177.5	0	0	0	0	0	113.2	T106 T107 G114	T106-A110 VanDerWaalsContact O-CB 3.29Å; T106-A110 WeakPolarHBondContact O-CB 3.38Å; T106-A110 PolarHBondContact O-N 3.31Å; T107-A110 PolarHBondContact O-N 3.36Å; A110-G114 WeakPolarHBondContact O-CA 3.32Å; A110-G114 PolarHBondContact O-N 3.46Å
111	L	48.9	Very low	48.5	Very low	76 Å²	76	48.5 Å²	48.5	40%	0.398	27%	0.274	S	S	.	.	H	α-helix	trans	-68.6	-47.1	178.8	-81.4	167.8	0	0	0	112.4	C36 T107 Q108 I109 Y113 S115	C36-L111 HydrophobicContact CB-CD1 3.91Å; T107-L111 HydrophobicContact CG2-CD1 4.04Å; T107-L111 WeakPolarHBondContact O-CB 3.24Å; T107-L111 WeakPolarHBondContact O-CG 3.34Å; T107-L111 PolarHBondContact O-N 3.27Å; Q108-L111 PolarHBondContact O-N 3.1Å; I109-L111 VanDerWaalsContact C-N 3.34Å; I109-L111 PolarHBondContact O-N 3.27Å; L111-Y113 VanDerWaalsContact C-N 3.33Å; L111-Y113 PolarHBondContact O-N 3.17Å; L111-S115 WeakPolarHBondContact O-CB 3.47Å; L111-S115 PolarHBondContact O-N 3.18Å; L111-S115 PolarHBondContact O-OG 3.37Å
112	L	52.2	Low	48.3	Very low	9 Å²	9	46.7 Å²	46.7	5%	0.047	26%	0.262	C	S	.	.	H	α-helix	trans	-59.4	-48.4	176.9	-173.2	74.1	0	0	0	109.8	T34 A37 L88 L91 Q108 I109 S115 L116	T34-L112 HydrophobicContact CG2-CD1 4.05Å; A37-L112 HydrophobicContact CB-CB 4.21Å; A37-L112 HydrophobicContact CB-CD1 4.15Å; A37-L112 HydrophobicContact CB-CD2 4.39Å; A37-L112 HydrophobicContact CB-CG 4.5Å; L88-L112 HydrophobicContact CD2-CD1 3.94Å; L88-L112 HydrophobicContact CD2-CD2 4.07Å; L88-L112 HydrophobicContact CD2-CG 4.27Å; L91-L112 HydrophobicContact CD1-CD1 3.97Å; L91-L112 HydrophobicContact CD1-CD2 4.1Å; Q108-L112 VanDerWaalsContact O-CB 3.29Å; Q108-L112 WeakPolarHBondContact O-CB 3.36Å; Q108-L112 PolarHBondContact O-N 3.48Å; I109-L112 PolarHBondContact O-N 2.85Å; L112-S115 PolarHBondContact O-N 2.94Å; L112-S115 PolarHBondContact O-OG 3.21Å; L112-L116 HydrophobicContact CG-CD1 4.29Å; L112-L116 WeakPolarHBondContact O-CG 3.26Å; L112-L116 PolarHBondContact O-N 3.22Å
113	Y	50.1	Low	48.3	Very low	11 Å²	11	44.8 Å²	44.8	4%	0.043	25%	0.245	C	C	.	.	H	α-helix	trans	-68.8	-48	-177.9	-69.3	-54.1	0	0	0	113.3	I109 L111 S115 L116 V117 L365 L369	I109-Y113 VanDerWaalsContact C-CD2 3.41Å; I109-Y113 HydrophobicContact CB-CD2 4.13Å; I109-Y113 HydrophobicContact CB-CE2 3.89Å; I109-Y113 HydrophobicContact CG1-CE2 4.16Å; I109-Y113 HydrophobicContact CG2-CD2 3.52Å; I109-Y113 HydrophobicContact CG2-CE2 3.39Å; I109-Y113 WeakPolarHBondContact O-CB 3.33Å; I109-Y113 WeakPolarHBondContact O-CD2 3.48Å; I109-Y113 PolarHBondContact O-N 2.82Å; L111-Y113 VanDerWaalsContact C-N 3.33Å; L111-Y113 PolarHBondContact O-N 3.17Å; Y113-S115 PolarHBondContact O-N 3.41Å; Y113-L116 PolarHBondContact O-N 3.29Å; Y113-L116 VanDerWaalsContact O-N 3.14Å; Y113-V117 WeakPolarHBondContact O-CG2 3.5Å; Y113-V117 PolarHBondContact O-N 3.44Å; Y113-L365 HydrophobicContact CE2-CD1 4.2Å; Y113-L365 WeakPolarHBondContact OH-CD1 2.94Å; Y113-L369 HydrophobicContact CE1-CD2 3.47Å; Y113-L369 VanDerWaalsContact CE1-CD2 3.47Å; Y113-L369 HydrophobicContact CE1-CG 4.22Å; Y113-L369 WeakPolarHBondContact OH-CD2 3.22Å
114	G	44.7	Very low	48.4	Very low	33 Å²	33	37.3 Å²	37.3	34%	0.34	22%	0.218	S	C	.	.	H	α-helix	trans	-54.4	-39.9	175.1	0	0	0	0	0	110.8	A110 F118	A110-G114 WeakPolarHBondContact O-CA 3.32Å; A110-G114 PolarHBondContact O-N 3.46Å; G114-F118 WeakPolarHBondContact O-CB 3.45Å; G114-F118 WeakPolarHBondContact O-CD2 3.27Å; G114-F118 PolarHBondContact O-N 2.98Å
115	S	48.1	Very low	48	Very low	2 Å²	2	38.5 Å²	38.5	1%	0.014	23%	0.231	C	C	.	.	H	α-helix	trans	-71	-39.5	179.1	85	0	0	0	0	113.7	T29 V30 L111 L112 Y113 F118 R119	T29-S115 WeakPolarHBondContact O-CB 3.24Å; V30-S115 VanDerWaalsContact CG2-O 3.31Å; V30-S115 WeakPolarHBondContact CG2-O 3.17Å; L111-S115 WeakPolarHBondContact O-CB 3.47Å; L111-S115 PolarHBondContact O-N 3.18Å; L111-S115 PolarHBondContact O-OG 3.37Å; L112-S115 PolarHBondContact O-N 2.94Å; L112-S115 PolarHBondContact O-OG 3.21Å; Y113-S115 PolarHBondContact O-N 3.41Å; S115-F118 PolarHBondContact O-N 2.94Å; S115-R119 WeakPolarHBondContact O-CB 3.3Å; S115-R119 PolarHBondContact O-N 3.35Å
116	L	52.4	Low	47.5	Very low	37 Å²	37	36.9 Å²	36.9	19%	0.194	22%	0.224	C	C	.	.	H	α-helix	trans	-66.2	-41	175	-72	171.2	0	0	0	112.2	L84 L88 L112 Y113 R119 G120	L84-L116 HydrophobicContact CD1-CD2 4.36Å; L84-L116 HydrophobicContact CD2-CD2 4Å; L84-L116 HydrophobicContact CG-CD2 4.49Å; L88-L116 HydrophobicContact CD1-CD2 4.03Å; L88-L116 HydrophobicContact CD2-CD1 4.07Å; L112-L116 HydrophobicContact CG-CD1 4.29Å; L112-L116 WeakPolarHBondContact O-CG 3.26Å; L112-L116 PolarHBondContact O-N 3.22Å; Y113-L116 PolarHBondContact O-N 3.29Å; Y113-L116 VanDerWaalsContact O-N 3.14Å; L116-R119 PolarHBondContact O-N 3.41Å; L116-G120 PolarHBondContact O-N 2.9Å
117	V	47.4	Very low	47.3	Very low	34 Å²	34	37 Å²	37	21%	0.206	22%	0.224	C	C	.	.	H	α-helix	trans	-62.2	-49	174.5	172.8	0	0	0	0	109.8	Y113 R119 G120 V121	Y113-V117 WeakPolarHBondContact O-CG2 3.5Å; Y113-V117 PolarHBondContact O-N 3.44Å; V117-R119 VanDerWaalsContact C-N 3.31Å; V117-R119 PolarHBondContact O-N 3.25Å; V117-G120 PolarHBondContact O-N 3.41Å; V117-V121 HydrophobicContact CG1-CG2 4.5Å; V117-V121 WeakPolarHBondContact O-CG2 3.46Å; V117-V121 PolarHBondContact O-N 3.36Å
118	F	47.2	Very low	46.9	Very low	117 Å²	117	34.6 Å²	34.6	51%	0.513	21%	0.207	S	C	.	.	H	α-helix	trans	-57	-43.9	175.5	-100.7	-80	0	0	0	111.9	V26 G114 S115 V121 T122	V26-F118 HydrophobicContact CG1-CB 4.45Å; G114-F118 WeakPolarHBondContact O-CB 3.45Å; G114-F118 WeakPolarHBondContact O-CD2 3.27Å; G114-F118 PolarHBondContact O-N 2.98Å; S115-F118 PolarHBondContact O-N 2.94Å; F118-V121 PolarHBondContact O-N 2.68Å; F118-T122 WeakPolarHBondContact O-CG2 3.39Å; F118-T122 PolarHBondContact O-N 2.98Å; F118-T122 PolarHBondContact O-OG1 3.35Å
119	R	52.8	Low	46	Very low	9 Å²	9	36.5 Å²	36.5	3%	0.034	22%	0.222	C	C	.	.	H	α-helix	trans	-62.8	-44.2	177.2	-171.5	56.9	172.9	-171.2	-5.3	112.6	S27 V30 L77 D81 S115 L116 V117 V121 T122 M123	S27-R119 PolarHBondContact OG-NH1 3.28Å; S27-R119 VanDerWaalsContact OG-NH1 3.16Å; V30-R119 HydrophobicContact CG2-CB 3.62Å; V30-R119 HydrophobicContact CG2-CG 4.14Å; L77-R119 VanDerWaalsContact CD2-NH2 3.29Å; D81-R119 IonicContact OD1-CZ 3.94Å; D81-R119 IonicContact OD1-NE 3.5Å; D81-R119 IonicContact OD1-NH2 3.69Å; D81-R119 PolarHBondContact OD1-NH2 3.32Å; D81-R119 IonicContact OD2-NH2 3.25Å; S115-R119 WeakPolarHBondContact O-CB 3.3Å; S115-R119 PolarHBondContact O-N 3.35Å; L116-R119 PolarHBondContact O-N 3.41Å; V117-R119 VanDerWaalsContact C-N 3.31Å; V117-R119 PolarHBondContact O-N 3.25Å; R119-V121 VanDerWaalsContact C-N 3.34Å; R119-T122 PolarHBondContact O-N 3.05Å; R119-T122 PolarHBondContact O-OG1 3.28Å; R119-T122 VanDerWaalsContact O-OG1 3.08Å; R119-M123 HydrophobicContact CG-CG 4.47Å; R119-M123 HydrophobicContact CG-SD 4.38Å; R119-M123 WeakPolarHBondContact O-CB 3.22Å; R119-M123 PolarHBondContact O-N 3.48Å
120	G	50.3	Low	45.3	Very low	24 Å²	24	41.4 Å²	41.4	25%	0.247	24%	0.239	C	C	.	.	H	α-helix	trans	-58.9	-46.1	176.4	0	0	0	0	0	111.6	L116 V117 T122 A124	L116-G120 PolarHBondContact O-N 2.9Å; V117-G120 PolarHBondContact O-N 3.41Å; G120-T122 PolarHBondContact O-N 2.91Å; G120-A124 VanDerWaalsContact O-CB 3.26Å; G120-A124 WeakPolarHBondContact O-CB 3.23Å; G120-A124 PolarHBondContact O-N 3.39Å
121	V	44.1	Very low	44.7	Very low	64 Å²	64	40 Å²	40	39%	0.388	23%	0.227	S	C	.	.	H	α-helix	trans	-64.8	-38	176.7	174.3	0	0	0	0	112	V117 F118 R119 A124 S125	V117-V121 HydrophobicContact CG1-CG2 4.5Å; V117-V121 WeakPolarHBondContact O-CG2 3.46Å; V117-V121 PolarHBondContact O-N 3.36Å; F118-V121 PolarHBondContact O-N 2.68Å; R119-V121 VanDerWaalsContact C-N 3.34Å; V121-A124 VanDerWaalsContact O-CB 3.32Å; V121-A124 WeakPolarHBondContact O-CB 3.36Å; V121-S125 PolarHBondContact O-N 3.46Å
122	T	47	Very low	44	Very low	29 Å²	29	40.2 Å²	40.2	18%	0.178	23%	0.234	C	C	.	.	H	α-helix	trans	-81.6	-34.4	-178.4	61.7	0	0	0	0	112.8	V26 F118 R119 G120 A124 S125 D126	V26-T122 HydrophobicContact CB-CG2 4.07Å; V26-T122 HydrophobicContact CG1-CG2 3.92Å; V26-T122 VanDerWaalsContact CG1-OG1 3.28Å; V26-T122 WeakPolarHBondContact CG1-OG1 3.37Å; V26-T122 HydrophobicContact CG2-CG2 3.27Å; F118-T122 WeakPolarHBondContact O-CG2 3.39Å; F118-T122 PolarHBondContact O-N 2.98Å; F118-T122 PolarHBondContact O-OG1 3.35Å; R119-T122 PolarHBondContact O-N 3.05Å; R119-T122 PolarHBondContact O-OG1 3.28Å; R119-T122 VanDerWaalsContact O-OG1 3.08Å; G120-T122 PolarHBondContact O-N 2.91Å; T122-A124 VanDerWaalsContact C-N 3.27Å; T122-S125 CarbonylContact O-C 3.48Å; T122-S125 WeakPolarHBondContact O-CA 3.36Å; T122-S125 VanDerWaalsContact O-CB 3.3Å; T122-S125 WeakPolarHBondContact O-CB 3.29Å; T122-S125 PolarHBondContact O-N 2.82Å; T122-S125 VanDerWaalsContact O-N 3.14Å; T122-D126 WeakPolarHBondContact O-CB 3.39Å; T122-D126 PolarHBondContact O-N 3.45Å
123	M	48.6	Very low	42.9	Very low	44 Å²	44	42.5 Å²	42.5	22%	0.217	25%	0.251	C	S	.	.	H	α-helix	trans	-65.2	-36.9	170.4	-83.6	-172.7	139.6	0	0	110.5	D81 R119 S125 D126 I127 W225	D81-M123 WeakPolarHBondContact OD2-CE 3.44Å; R119-M123 HydrophobicContact CG-CG 4.47Å; R119-M123 HydrophobicContact CG-SD 4.38Å; R119-M123 WeakPolarHBondContact O-CB 3.22Å; R119-M123 PolarHBondContact O-N 3.48Å; M123-S125 VanDerWaalsContact C-N 3.32Å; M123-S125 PolarHBondContact O-N 3.48Å; M123-D126 PolarHBondContact O-N 3.24Å; M123-I127 WeakPolarHBondContact O-CB 3.37Å; M123-I127 WeakPolarHBondContact O-CD1 3.16Å; M123-I127 WeakPolarHBondContact O-CG1 3.41Å; M123-I127 PolarHBondContact O-N 2.84Å; M123-W225 HydrophobicContact SD-CH2 4.4Å
124	A	46	Very low	42.1	Very low	9 Å²	9	45.1 Å²	45.1	7%	0.074	27%	0.271	C	S	.	.	H	α-helix	trans	-54.3	-51.2	167.7	0	0	0	0	0	110.8	G120 V121 T122 D126 I127 F128 L232	G120-A124 VanDerWaalsContact O-CB 3.26Å; G120-A124 WeakPolarHBondContact O-CB 3.23Å; G120-A124 PolarHBondContact O-N 3.39Å; V121-A124 VanDerWaalsContact O-CB 3.32Å; V121-A124 WeakPolarHBondContact O-CB 3.36Å; T122-A124 VanDerWaalsContact C-N 3.27Å; A124-D126 VanDerWaalsContact C-N 3.32Å; A124-D126 PolarHBondContact O-N 3.19Å; A124-I127 PolarHBondContact O-N 3.28Å; A124-F128 VanDerWaalsContact C-CD2 3.48Å; A124-F128 WeakPolarHBondContact O-CD2 3.36Å; A124-F128 VanDerWaalsContact O-CG 3.28Å; A124-F128 WeakPolarHBondContact O-CG 3.43Å; A124-F128 PolarHBondContact O-N 2.61Å; A124-L232 HydrophobicContact CB-CD1 3.21Å; A124-L232 HydrophobicContact CB-CD2 4.08Å; A124-L232 HydrophobicContact CB-CG 4.23Å
125	S	41.2	Very low	41.5	Very low	75 Å²	75	47.3 Å²	47.3	52%	0.524	29%	0.285	S	S	.	.	H	α-helix	trans	-58.1	-37.8	174.4	-167	0	0	0	0	113.9	V121 T122 M123 F128 S129	V121-S125 PolarHBondContact O-N 3.46Å; T122-S125 CarbonylContact O-C 3.48Å; T122-S125 WeakPolarHBondContact O-CA 3.36Å; T122-S125 VanDerWaalsContact O-CB 3.3Å; T122-S125 WeakPolarHBondContact O-CB 3.29Å; T122-S125 PolarHBondContact O-N 2.82Å; T122-S125 VanDerWaalsContact O-N 3.14Å; M123-S125 VanDerWaalsContact C-N 3.32Å; M123-S125 PolarHBondContact O-N 3.48Å; S125-F128 WeakPolarHBondContact O-CB 3.35Å; S125-F128 PolarHBondContact O-N 2.8Å; S125-S129 PolarHBondContact O-N 2.79Å
126	D	41.7	Very low	40.6	Very low	26 Å²	26	51.5 Å²	51.5	14%	0.139	32%	0.315	C	S	.	.	H	α-helix	trans	-79.2	-31.6	-177.7	-136.3	36.7	0	0	0	111.7	T122 M123 A124 F128 S129 R130	T122-D126 WeakPolarHBondContact O-CB 3.39Å; T122-D126 PolarHBondContact O-N 3.45Å; M123-D126 PolarHBondContact O-N 3.24Å; A124-D126 VanDerWaalsContact C-N 3.32Å; A124-D126 PolarHBondContact O-N 3.19Å; D126-F128 VanDerWaalsContact C-N 3.34Å; D126-S129 WeakPolarHBondContact CA-OG 3.25Å; D126-S129 PolarHBondContact O-N 3.01Å; D126-S129 PolarHBondContact O-OG 2.83Å; D126-S129 PolarHBondContact OD1-OG 3.2Å; D126-R130 WeakPolarHBondContact O-CB 3.49Å; D126-R130 VanDerWaalsContact O-CG 3.28Å; D126-R130 WeakPolarHBondContact O-CG 3.37Å; D126-R130 PolarHBondContact O-N 3.32Å; D126-R130 IonicContact OD2-CZ 3.7Å; D126-R130 IonicContact OD2-NE 3.98Å; D126-R130 PolarHBondContact OD2-NE 3.39Å; D126-R130 IonicContact OD2-NH2 3.73Å; D126-R130 PolarHBondContact OD2-NH2 3.23Å
127	I	40.8	Very low	39.6	Very low	32 Å²	32	54 Å²	54	16%	0.164	33%	0.328	C	S	.	.	H	α-helix	trans	-64.7	-43.7	168.1	-69.2	162.5	0	0	0	109.2	M123 A124 S129 R130 A131 K229 L233	M123-I127 WeakPolarHBondContact O-CB 3.37Å; M123-I127 WeakPolarHBondContact O-CD1 3.16Å; M123-I127 WeakPolarHBondContact O-CG1 3.41Å; M123-I127 PolarHBondContact O-N 2.84Å; A124-I127 PolarHBondContact O-N 3.28Å; I127-S129 VanDerWaalsContact C-N 3.25Å; I127-S129 PolarHBondContact O-N 3.34Å; I127-R130 PolarHBondContact O-N 2.86Å; I127-A131 WeakPolarHBondContact O-CB 3.32Å; I127-A131 PolarHBondContact O-N 3.15Å; I127-K229 HydrophobicContact CD1-CD 3.99Å; I127-K229 HydrophobicContact CD1-CG 4.39Å; I127-L233 HydrophobicContact CG2-CD2 3.94Å
128	F	35.1	Very low	39.1	Very low	17 Å²	17	53.2 Å²	53.2	8%	0.075	32%	0.323	C	S	.	.	H	α-helix	trans	-61.3	-32.5	174	-72.5	-56	0	0	0	113.2	A124 S125 D126 L232 V237	A124-F128 VanDerWaalsContact C-CD2 3.48Å; A124-F128 WeakPolarHBondContact O-CD2 3.36Å; A124-F128 VanDerWaalsContact O-CG 3.28Å; A124-F128 WeakPolarHBondContact O-CG 3.43Å; A124-F128 PolarHBondContact O-N 2.61Å; S125-F128 WeakPolarHBondContact O-CB 3.35Å; S125-F128 PolarHBondContact O-N 2.8Å; D126-F128 VanDerWaalsContact C-N 3.34Å; F128-L232 HydrophobicContact CE1-CB 4.01Å; F128-L232 WeakPolarHBondContact CE1-O 3.4Å; F128-L232 HydrophobicContact CE2-CB 4.06Å; F128-L232 HydrophobicContact CE2-CD2 3.34Å; F128-L232 HydrophobicContact CE2-CG 4.19Å; F128-L232 HydrophobicContact CZ-CB 3.54Å; F128-L232 HydrophobicContact CZ-CD2 3.31Å; F128-L232 HydrophobicContact CZ-CG 3.97Å; F128-V237 HydrophobicContact CB-CB 4.25Å; F128-V237 HydrophobicContact CB-CG2 3.87Å; F128-V237 HydrophobicContact CD1-CB 4.29Å; F128-V237 HydrophobicContact CD1-CG2 3.55Å; F128-V237 HydrophobicContact CD2-CG2 4Å; F128-V237 HydrophobicContact CE1-CG2 3.85Å; F128-V237 HydrophobicContact CE2-CG2 4.3Å; F128-V237 HydrophobicContact CG-CB 4.42Å; F128-V237 HydrophobicContact CG-CG2 3.6Å; F128-V237 HydrophobicContact CZ-CG2 4.22Å
129	S	33.9	Very low	38.5	Very low	49 Å²	49	49.4 Å²	49.4	34%	0.343	31%	0.308	S	S	.	.	H	α-helix	trans	-75.9	-36.7	177.4	78.4	0	0	0	0	112.1	S125 D126 I127	S125-S129 PolarHBondContact O-N 2.79Å; D126-S129 WeakPolarHBondContact CA-OG 3.25Å; D126-S129 PolarHBondContact O-N 3.01Å; D126-S129 PolarHBondContact O-OG 2.83Å; D126-S129 PolarHBondContact OD1-OG 3.2Å; I127-S129 VanDerWaalsContact C-N 3.25Å; I127-S129 PolarHBondContact O-N 3.34Å
130	R	34.8	Very low	37.5	Very low	122 Å²	122	52 Å²	52	46%	0.46	33%	0.331	S	S	.	.	H	α-helix	trans	-85.9	-15.3	-177.4	-66.4	-179.9	-163.1	-164.5	9.5	114.8	D126 I127 C132 S133	D126-R130 WeakPolarHBondContact O-CB 3.49Å; D126-R130 VanDerWaalsContact O-CG 3.28Å; D126-R130 WeakPolarHBondContact O-CG 3.37Å; D126-R130 PolarHBondContact O-N 3.32Å; D126-R130 IonicContact OD2-CZ 3.7Å; D126-R130 IonicContact OD2-NE 3.98Å; D126-R130 PolarHBondContact OD2-NE 3.39Å; D126-R130 IonicContact OD2-NH2 3.73Å; D126-R130 PolarHBondContact OD2-NH2 3.23Å; I127-R130 PolarHBondContact O-N 2.86Å; R130-C132 PolarHBondContact O-N 2.75Å; R130-S133 PolarHBondContact O-N 3.06Å
131	A	32.5	Very low	37	Very low	20 Å²	20	58 Å²	58	17%	0.165	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	3.4	178.5	0	0	0	0	0	115.1	I127 S133	I127-A131 WeakPolarHBondContact O-CB 3.32Å; I127-A131 PolarHBondContact O-N 3.15Å; A131-S133 PolarHBondContact O-N 3.34Å
132	C	32.5	Very low	36.9	Very low	81 Å²	81	56.3 Å²	56.3	55%	0.547	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-16.8	162.2	-79.8	0	0	0	0	115.6	R130 R238	R130-C132 PolarHBondContact O-N 2.75Å; C132-R238 WeakPolarHBondContact SG-CD 3.15Å; C132-R238 PolarHBondContact SG-NE 3.48Å; C132-R238 PolarHBondContact SG-NH1 3.39Å
133	S	29.2	Very low	36.8	Very low	57 Å²	57	55.6 Å²	55.6	40%	0.399	34%	0.339	S	S	.	.	S	Bend	trans	-116.1	140.7	178.5	65	0	0	0	0	111.7	R130 A131 A135 T138	R130-S133 PolarHBondContact O-N 3.06Å; A131-S133 PolarHBondContact O-N 3.34Å; S133-A135 PolarHBondContact O-N 2.79Å; S133-T138 PolarHBondContact O-OG1 3.46Å
134	S	33.5	Very low	36.9	Very low	67 Å²	67	54.3 Å²	54.3	47%	0.469	33%	0.334	S	S	.	.			trans	-25.7	124.5	-175.2	55.6	0	0	0	0	115	S136 I137 T138	S134-S136 PolarHBondContact O-N 3.14Å; S134-I137 PolarHBondContact O-N 3.27Å; S134-I137 WeakPolarHBondContact OG-CD1 3.33Å; S134-T138 PolarHBondContact O-N 2.99Å; S134-T138 PolarHBondContact O-OG1 3.4Å; S134-T138 VanDerWaalsContact O-OG1 3.11Å
135	A	32.2	Very low	37.3	Very low	78 Å²	78	59.7 Å²	59.7	65%	0.645	35%	0.353	S	S	*	.	H	α-helix	trans	-50.6	-23.7	-173.7	0	0	0	0	0	115.4	S133 T138 L139	S133-A135 PolarHBondContact O-N 2.79Å; A135-T138 VanDerWaalsContact CA-OG1 3.3Å; A135-T138 WeakPolarHBondContact CA-OG1 3.44Å; A135-T138 PolarHBondContact O-OG1 3.44Å; A135-L139 PolarHBondContact O-N 3.14Å
136	S	30.3	Very low	37.9	Very low	91 Å²	91	57 Å²	57	64%	0.636	33%	0.334	S	S	*	.	H	α-helix	trans	-76.4	-36.5	178	57.9	0	0	0	0	113.4	S134	S134-S136 PolarHBondContact O-N 3.14Å
137	I	31.5	Very low	38.6	Very low	89 Å²	89	56.5 Å²	56.5	46%	0.456	33%	0.332	S	S	.	.	H	α-helix	trans	-78.7	-36.9	-178.3	-60.7	179.3	0	0	0	110.1	S134 L139 Q141	S134-I137 PolarHBondContact O-N 3.27Å; S134-I137 WeakPolarHBondContact OG-CD1 3.33Å; I137-L139 VanDerWaalsContact C-N 3.32Å; I137-L139 PolarHBondContact O-N 3.43Å; I137-Q141 WeakPolarHBondContact O-CG 3.46Å; I137-Q141 PolarHBondContact O-N 2.92Å
138	T	35.3	Very low	39.1	Very low	17 Å²	17	56.8 Å²	56.8	10%	0.104	33%	0.333	C	S	.	.	H	α-helix	trans	-67.2	-30.7	177.6	27.8	0	0	0	0	112.7	S133 S134 A135 S142	S133-T138 PolarHBondContact O-OG1 3.46Å; S134-T138 PolarHBondContact O-N 2.99Å; S134-T138 PolarHBondContact O-OG1 3.4Å; S134-T138 VanDerWaalsContact O-OG1 3.11Å; A135-T138 VanDerWaalsContact CA-OG1 3.3Å; A135-T138 WeakPolarHBondContact CA-OG1 3.44Å; A135-T138 PolarHBondContact O-OG1 3.44Å; T138-S142 WeakPolarHBondContact O-CB 3.19Å; T138-S142 PolarHBondContact O-N 3.02Å; T138-S142 PolarHBondContact O-OG 2.96Å
139	L	34.4	Very low	40.1	Very low	38 Å²	38	59.3 Å²	59.3	20%	0.199	35%	0.349	C	S	.	.	H	α-helix	trans	-63	-52	178.3	-142.2	68.3	0	0	0	111.5	A135 I137 Q141 S142 V143 M180 L233	A135-L139 PolarHBondContact O-N 3.14Å; I137-L139 VanDerWaalsContact C-N 3.32Å; I137-L139 PolarHBondContact O-N 3.43Å; L139-Q141 PolarHBondContact O-N 2.97Å; L139-S142 PolarHBondContact O-N 3.09Å; L139-S142 PolarHBondContact O-OG 3.2Å; L139-S142 VanDerWaalsContact O-OG 3.09Å; L139-V143 VanDerWaalsContact O-CG2 3.32Å; L139-V143 WeakPolarHBondContact O-CG2 3.42Å; L139-V143 PolarHBondContact O-N 2.87Å; L139-M180 WeakPolarHBondContact CD2-O 3.19Å; L139-M180 WeakPolarHBondContact CG-O 3.08Å; L139-L233 HydrophobicContact CD1-CD1 3.54Å
140	A	33.4	Very low	41	Very low	64 Å²	64	57 Å²	57	53%	0.529	33%	0.333	S	S	.	.	H	α-helix	trans	-65.1	-39.2	-179.7	0	0	0	0	0	112.7	W145	A140-W145 PolarHBondContact O-NE1 3.39Å
141	Q	39.3	Very low	41.9	Very low	149 Å²	149	51.3 Å²	51.3	70%	0.696	31%	0.312	S	S	*	.	H	α-helix	trans	-75.4	-22.8	178.2	-69.7	-177.4	-6.6	0	0	113.6	I137 L139	I137-Q141 WeakPolarHBondContact O-CG 3.46Å; I137-Q141 PolarHBondContact O-N 2.92Å; L139-Q141 PolarHBondContact O-N 2.97Å
142	S	40.8	Very low	42.9	Very low	29 Å²	29	53 Å²	53	20%	0.203	32%	0.318	C	S	.	.	H	α-helix	trans	-93	-13.5	-177.6	68.7	0	0	0	0	113.8	T138 L139 K229	T138-S142 WeakPolarHBondContact O-CB 3.19Å; T138-S142 PolarHBondContact O-N 3.02Å; T138-S142 PolarHBondContact O-OG 2.96Å; L139-S142 PolarHBondContact O-N 3.09Å; L139-S142 PolarHBondContact O-OG 3.2Å; L139-S142 VanDerWaalsContact O-OG 3.09Å; S142-K229 VanDerWaalsContact CB-NZ 3.3Å; S142-K229 PolarHBondContact O-NZ 3.11Å; S142-K229 WeakPolarHBondContact OG-CE 3.4Å; S142-K229 PolarHBondContact OG-NZ 3.34Å
143	V	46.7	Very low	44.2	Very low	13 Å²	13	54 Å²	54	8%	0.079	32%	0.318	C	S	.	.	S	Bend	trans	-58.8	129.6	172.1	180	0	0	0	0	107.4	L139 W145 A177 M180	L139-V143 VanDerWaalsContact O-CG2 3.32Å; L139-V143 WeakPolarHBondContact O-CG2 3.42Å; L139-V143 PolarHBondContact O-N 2.87Å; V143-W145 HydrophobicContact CB-CD2 4.3Å; V143-W145 HydrophobicContact CB-CG 4.29Å; V143-W145 HydrophobicContact CB-CZ2 4.33Å; V143-W145 HydrophobicContact CG1-CD2 3.78Å; V143-W145 HydrophobicContact CG1-CE3 4.3Å; V143-W145 HydrophobicContact CG1-CG 4.09Å; V143-W145 HydrophobicContact CG1-CH2 4.46Å; V143-W145 HydrophobicContact CG1-CZ2 3.95Å; V143-W145 PolarHBondContact O-N 3.27Å; V143-A177 HydrophobicContact CG1-CB 3.81Å; V143-M180 HydrophobicContact CG2-CE 4.44Å
144	P	50	Low	45.6	Very low	18 Å²	18	51.3 Å²	51.3	12%	0.117	30%	0.299	C	S	.	.			trans	-76.1	55.6	-176.7	39.6	-44.1	0	0	0	110.2	S146 C147 F148 W225	P144-S146 PolarHBondContact O-N 3.49Å; P144-S146 VanDerWaalsContact O-N 3.11Å; P144-C147 HydrophobicContact CB-CB 4.04Å; P144-C147 PolarHBondContact O-N 2.85Å; P144-F148 PolarHBondContact O-N 3.4Å; P144-F148 VanDerWaalsContact O-N 3.11Å; P144-W225 HydrophobicContact CB-CH2 3.81Å; P144-W225 HydrophobicContact CB-CZ3 3.64Å; P144-W225 HydrophobicContact CG-CE3 4.13Å; P144-W225 HydrophobicContact CG-CH2 3.92Å; P144-W225 HydrophobicContact CG-CZ3 3.33Å
145	W	53.5	Low	46.5	Very low	122 Å²	122	50.2 Å²	50.2	46%	0.462	29%	0.285	S	S	.	.	H	α-helix	trans	-52.4	-36.3	-178.2	-69.4	114.6	0	0	0	111.1	A140 V143 F148 V149 A177	A140-W145 PolarHBondContact O-NE1 3.39Å; V143-W145 HydrophobicContact CB-CD2 4.3Å; V143-W145 HydrophobicContact CB-CG 4.29Å; V143-W145 HydrophobicContact CB-CZ2 4.33Å; V143-W145 HydrophobicContact CG1-CD2 3.78Å; V143-W145 HydrophobicContact CG1-CE3 4.3Å; V143-W145 HydrophobicContact CG1-CG 4.09Å; V143-W145 HydrophobicContact CG1-CH2 4.46Å; V143-W145 HydrophobicContact CG1-CZ2 3.95Å; V143-W145 PolarHBondContact O-N 3.27Å; W145-F148 PolarHBondContact O-N 2.86Å; W145-V149 WeakPolarHBondContact O-CB 3.35Å; W145-V149 WeakPolarHBondContact O-CG2 3.24Å; W145-V149 PolarHBondContact O-N 2.97Å; W145-A177 HydrophobicContact CH2-CB 3.92Å; W145-A177 HydrophobicContact CZ2-CB 4.48Å; W145-A177 HydrophobicContact CZ3-CB 4.18Å
146	S	54.3	Low	47.7	Very low	18 Å²	18	54.7 Å²	54.7	13%	0.126	29%	0.286	C	S	.	.	H	α-helix	trans	-55.5	-51.9	172.4	42.9	0	0	0	0	113.1	T78 D81 A82 P144 F148 V149 G150	T78-S146 WeakPolarHBondContact O-CB 3.5Å; D81-S146 WeakPolarHBondContact CB-OG 3.19Å; A82-S146 WeakPolarHBondContact CA-O 3.49Å; A82-S146 WeakPolarHBondContact CB-O 3.38Å; P144-S146 PolarHBondContact O-N 3.49Å; P144-S146 VanDerWaalsContact O-N 3.11Å; S146-F148 VanDerWaalsContact C-N 3.33Å; S146-F148 PolarHBondContact O-N 3.42Å; S146-V149 PolarHBondContact O-N 3.36Å; S146-G150 PolarHBondContact O-N 2.9Å
147	C	55.9	Low	48.9	Very low	16 Å²	16	52.5 Å²	52.5	11%	0.108	27%	0.27	C	S	.	.	H	α-helix	trans	-62.2	-41.4	178.4	-171.4	0	0	0	0	111.6	D81 G85 P144 G150 A151	D81-C147 HydrophobicContact CB-CB 4.36Å; D81-C147 VanDerWaalsContact O-CA 3.25Å; D81-C147 WeakPolarHBondContact O-CA 3.39Å; D81-C147 WeakPolarHBondContact O-CB 3.21Å; G85-C147 VanDerWaalsContact CA-SG 3.58Å; P144-C147 HydrophobicContact CB-CB 4.04Å; P144-C147 PolarHBondContact O-N 2.85Å; C147-G150 PolarHBondContact O-N 3.34Å; C147-A151 PolarHBondContact O-N 2.94Å
148	F	53.2	Low	50	Low	38 Å²	38	50.9 Å²	50.9	17%	0.167	26%	0.261	C	S	.	.	H	α-helix	trans	-61.5	-45.7	173.8	176.4	-102.7	0	0	0	112.4	P144 W145 S146 G150 A151 L152 M170 F173	P144-F148 PolarHBondContact O-N 3.4Å; P144-F148 VanDerWaalsContact O-N 3.11Å; W145-F148 PolarHBondContact O-N 2.86Å; S146-F148 VanDerWaalsContact C-N 3.33Å; S146-F148 PolarHBondContact O-N 3.42Å; F148-G150 VanDerWaalsContact C-N 3.31Å; F148-G150 PolarHBondContact O-N 2.74Å; F148-A151 PolarHBondContact O-N 3.08Å; F148-L152 WeakPolarHBondContact O-CB 3.4Å; F148-L152 PolarHBondContact O-N 2.89Å; F148-M170 HydrophobicContact CD1-CE 4.4Å; F148-M170 HydrophobicContact CD2-CE 3.64Å; F148-M170 HydrophobicContact CD2-SD 4.11Å; F148-M170 HydrophobicContact CE1-CE 3.99Å; F148-M170 HydrophobicContact CE2-CB 4.24Å; F148-M170 HydrophobicContact CE2-CE 3.18Å; F148-M170 HydrophobicContact CE2-SD 3.76Å; F148-M170 HydrophobicContact CG-CE 4.26Å; F148-M170 HydrophobicContact CZ-CE 3.38Å; F148-M170 HydrophobicContact CZ-SD 4.48Å; F148-F173 HydrophobicContact CD2-CB 3.54Å; F148-F173 HydrophobicContact CD2-CG 4.19Å; F148-F173 HydrophobicContact CE2-CB 3.8Å
149	V	54.7	Low	50.4	Low	69 Å²	69	54.5 Å²	54.5	42%	0.418	29%	0.285	S	S	.	.	H	α-helix	trans	-62.5	-40.1	175.8	169.4	0	0	0	0	110.6	W145 S146 L152 L153	W145-V149 WeakPolarHBondContact O-CB 3.35Å; W145-V149 WeakPolarHBondContact O-CG2 3.24Å; W145-V149 PolarHBondContact O-N 2.97Å; S146-V149 PolarHBondContact O-N 3.36Å; V149-L152 WeakPolarHBondContact O-CB 3.16Å; V149-L152 PolarHBondContact O-N 3.22Å; V149-L153 HydrophobicContact CG1-CD1 4.12Å; V149-L153 HydrophobicContact CG1-CG 4.46Å; V149-L153 VanDerWaalsContact O-CG 3.31Å; V149-L153 WeakPolarHBondContact O-CG 3.37Å; V149-L153 PolarHBondContact O-N 3.49Å
150	G	52.9	Low	50.8	Low	1 Å²	1	57 Å²	57	1%	0.01	30%	0.303	C	S	.	.	H	α-helix	trans	-59.8	-44.7	173.8	0	0	0	0	0	113.1	A82 S146 C147 F148 L153 G154	A82-G150 VanDerWaalsContact O-CA 3.26Å; A82-G150 WeakPolarHBondContact O-CA 3.36Å; S146-G150 PolarHBondContact O-N 2.9Å; C147-G150 PolarHBondContact O-N 3.34Å; F148-G150 VanDerWaalsContact C-N 3.31Å; F148-G150 PolarHBondContact O-N 2.74Å; G150-L153 PolarHBondContact O-N 2.8Å; G150-G154 PolarHBondContact O-N 3.36Å
151	A	53.8	Low	51.2	Low	2 Å²	2	61.7 Å²	61.7	2%	0.017	32%	0.319	C	S	.	.	H	α-helix	trans	-64	-40.5	173.7	0	0	0	0	0	112.2	C147 F148 G154 Y155 W169 M170	C147-A151 PolarHBondContact O-N 2.94Å; F148-A151 PolarHBondContact O-N 3.08Å; A151-G154 PolarHBondContact O-N 3.17Å; A151-Y155 PolarHBondContact O-N 3.28Å; A151-W169 HydrophobicContact CB-CZ3 3.89Å; A151-M170 HydrophobicContact CB-SD 4.19Å
152	L	54.6	Low	51.3	Low	57 Å²	57	56.4 Å²	56.4	30%	0.298	30%	0.302	S	S	.	.	H	α-helix	trans	-61.1	-44	174.7	-163.3	88.5	0	0	0	111.4	F148 V149 G154 Y155 Y156 M170	F148-L152 WeakPolarHBondContact O-CB 3.4Å; F148-L152 PolarHBondContact O-N 2.89Å; V149-L152 WeakPolarHBondContact O-CB 3.16Å; V149-L152 PolarHBondContact O-N 3.22Å; L152-G154 VanDerWaalsContact C-N 3.32Å; L152-G154 PolarHBondContact O-N 3.24Å; L152-Y155 WeakPolarHBondContact O-CB 3.22Å; L152-Y155 PolarHBondContact O-N 3.18Å; L152-Y156 HydrophobicContact CD1-CE2 4.16Å; L152-Y156 HydrophobicContact CD2-CD2 4.32Å; L152-Y156 HydrophobicContact CD2-CE2 3.82Å; L152-Y156 HydrophobicContact CG-CD2 3.95Å; L152-Y156 HydrophobicContact CG-CE2 3.67Å; L152-Y156 VanDerWaalsContact O-CD2 3.25Å; L152-Y156 WeakPolarHBondContact O-CD2 3.49Å; L152-Y156 PolarHBondContact O-N 3.19Å; L152-M170 HydrophobicContact CB-CE 3.43Å; L152-M170 VanDerWaalsContact CB-CE 3.43Å; L152-M170 HydrophobicContact CD1-CE 3.17Å; L152-M170 HydrophobicContact CG-CE 3.86Å
153	L	59.1	Low	51.5	Low	102 Å²	102	58.5 Å²	58.5	53%	0.534	31%	0.31	S	S	.	.	H	α-helix	trans	-63.1	-40.4	175.5	-72.5	168.7	0	0	0	111.3	Y86 V149 G150 Y155 Y156 S157	Y86-L153 HydrophobicContact CD2-CB 4.44Å; V149-L153 HydrophobicContact CG1-CD1 4.12Å; V149-L153 HydrophobicContact CG1-CG 4.46Å; V149-L153 VanDerWaalsContact O-CG 3.31Å; V149-L153 WeakPolarHBondContact O-CG 3.37Å; V149-L153 PolarHBondContact O-N 3.49Å; G150-L153 PolarHBondContact O-N 2.8Å; L153-Y155 VanDerWaalsContact C-N 3.29Å; L153-Y155 PolarHBondContact O-N 3.43Å; L153-Y156 PolarHBondContact O-N 3.06Å; L153-S157 PolarHBondContact O-N 2.74Å; L153-S157 PolarHBondContact O-OG 2.96Å; L153-S157 VanDerWaalsContact O-OG 3.09Å
154	G	57.7	Low	51.3	Low	0 Å²	0	61.8 Å²	61.8	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-56.7	-44.7	171.9	0	0	0	0	0	111.9	F89 G150 A151 L152 S157	F89-G154 WeakPolarHBondContact CE1-O 3.25Å; G150-G154 PolarHBondContact O-N 3.36Å; A151-G154 PolarHBondContact O-N 3.17Å; L152-G154 VanDerWaalsContact C-N 3.32Å; L152-G154 PolarHBondContact O-N 3.24Å; G154-S157 PolarHBondContact O-N 2.94Å; G154-S157 PolarHBondContact O-OG 3.43Å
155	Y	53.7	Low	51	Low	44 Å²	44	63.6 Å²	63.6	17%	0.173	35%	0.346	C	S	.	.	H	α-helix	trans	-64.5	-46.1	177.9	173.9	-100.7	0	0	0	113.9	F89 A151 L152 L153 S157 H158 I163 H166	F89-Y155 VanDerWaalsContact CZ-CA 3.43Å; A151-Y155 PolarHBondContact O-N 3.28Å; L152-Y155 WeakPolarHBondContact O-CB 3.22Å; L152-Y155 PolarHBondContact O-N 3.18Å; L153-Y155 VanDerWaalsContact C-N 3.29Å; L153-Y155 PolarHBondContact O-N 3.43Å; Y155-S157 PolarHBondContact O-N 2.72Å; Y155-H158 WeakPolarHBondContact O-CB 3.44Å; Y155-H158 PolarHBondContact O-N 3.47Å; Y155-H158 VanDerWaalsContact O-N 3.15Å; Y155-I163 WeakPolarHBondContact OH-CG1 3.31Å; Y155-I163 WeakPolarHBondContact OH-CG2 3.25Å; Y155-H166 HydrophobicContact CD2-CB 3.37Å; Y155-H166 AromaticContact CD2-CG 3.92Å; Y155-H166 HydrophobicContact CE2-CB 3.42Å; Y155-H166 VanDerWaalsContact CE2-CB 3.42Å
156	Y	57	Low	50.6	Low	172 Å²	172	59.3 Å²	59.3	68%	0.675	33%	0.331	S	S	*	.	H	α-helix	trans	-64.9	-21.3	-179.9	-84.4	-69.5	0	0	0	113.8	L152 L153 H158	L152-Y156 HydrophobicContact CD1-CE2 4.16Å; L152-Y156 HydrophobicContact CD2-CD2 4.32Å; L152-Y156 HydrophobicContact CD2-CE2 3.82Å; L152-Y156 HydrophobicContact CG-CD2 3.95Å; L152-Y156 HydrophobicContact CG-CE2 3.67Å; L152-Y156 VanDerWaalsContact O-CD2 3.25Å; L152-Y156 WeakPolarHBondContact O-CD2 3.49Å; L152-Y156 PolarHBondContact O-N 3.19Å; L153-Y156 PolarHBondContact O-N 3.06Å; Y156-H158 PolarHBondContact O-N 2.87Å
157	S	56	Low	50.3	Low	44 Å²	44	62.4 Å²	62.4	31%	0.308	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	14	175.6	52.3	0	0	0	0	114.8	R90 L153 G154 Y155	R90-S157 PolarHBondContact NH2-OG 2.85Å; L153-S157 PolarHBondContact O-N 2.74Å; L153-S157 PolarHBondContact O-OG 2.96Å; L153-S157 VanDerWaalsContact O-OG 3.09Å; G154-S157 PolarHBondContact O-N 2.94Å; G154-S157 PolarHBondContact O-OG 3.43Å; Y155-S157 PolarHBondContact O-N 2.72Å
158	H	53.4	Low	49.8	Very low	55 Å²	55	66.2 Å²	66.2	26%	0.255	37%	0.365	S	S	.	.	S	Bend	trans	-112.6	150.4	-176.1	-125.4	-53.5	0	0	0	114.1	F89 D93 Y155 Y156	F89-H158 AromaticContact CE1-CD2 3.84Å; D93-H158 IonicContact OD1-CE1 3.31Å; D93-H158 IonicContact OD1-NE2 3.97Å; D93-H158 PolarHBondContact OD1-NE2 3.03Å; D93-H158 IonicContact OD2-CD2 3.52Å; D93-H158 IonicContact OD2-CE1 2.82Å; D93-H158 PolarHBondContact OD2-CE1 2.77Å; D93-H158 VanDerWaalsContact OD2-CE1 3.25Å; D93-H158 IonicContact OD2-NE2 2.72Å; D93-H158 PolarHBondContact OD2-NE2 3.38Å; Y155-H158 WeakPolarHBondContact O-CB 3.44Å; Y155-H158 PolarHBondContact O-N 3.47Å; Y155-H158 VanDerWaalsContact O-N 3.15Å; Y156-H158 PolarHBondContact O-N 2.87Å
159	P	44.7	Very low	49.5	Very low	93 Å²	93	66 Å²	66	60%	0.604	36%	0.363	S	S	*	.			trans	-75.4	161.7	169.6	-12.5	30.6	0	0	0	113.1	N161	P159-N161 VanDerWaalsContact C-N 3.31Å; P159-N161 PolarHBondContact O-N 3.04Å
160	P	43	Very low	49.1	Very low	91 Å²	91	63.6 Å²	63.6	59%	0.591	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-69.9	0.4	-154.2	24.2	-34.5	0	0	0	118.5	I163	P160-I163 HydrophobicContact CB-CD1 4.01Å; P160-I163 WeakPolarHBondContact O-CD1 3.2Å; P160-I163 WeakPolarHBondContact O-CG1 3.26Å
161	N	42	Very low	48.8	Very low	162 Å²	162	67.8 Å²	67.8	87%	0.866	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-92.3	-1.5	-164.9	-70.2	-7.3	0	0	0	116.2	P159	P159-N161 VanDerWaalsContact C-N 3.31Å; P159-N161 PolarHBondContact O-N 3.04Å
162	A	41.1	Very low	48.4	Very low	39 Å²	39	68.7 Å²	68.7	32%	0.322	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-116.4	13.7	177.5	0	0	0	0	0	114	A164 L165 H166	A162-A164 PolarHBondContact O-N 3.48Å; A162-L165 PolarHBondContact O-N 2.96Å; A162-H166 VanDerWaalsContact CB-CE1 3.46Å; A162-H166 WeakPolarHBondContact CB-CE1 3.4Å; A162-H166 WeakPolarHBondContact CB-ND1 3.33Å; A162-H166 PolarHBondContact O-N 3.26Å; A162-H166 PolarHBondContact O-ND1 3.33Å
163	I	45.1	Very low	48	Very low	73 Å²	73	67.1 Å²	67.1	37%	0.374	37%	0.366	S	S	.	.	H	α-helix	trans	-52.2	-49	-170.6	-70.4	171.6	0	0	0	113.1	Y155 P160 L165 H166 I167	Y155-I163 WeakPolarHBondContact OH-CG1 3.31Å; Y155-I163 WeakPolarHBondContact OH-CG2 3.25Å; P160-I163 HydrophobicContact CB-CD1 4.01Å; P160-I163 WeakPolarHBondContact O-CD1 3.2Å; P160-I163 WeakPolarHBondContact O-CG1 3.26Å; I163-L165 PolarHBondContact O-N 3.5Å; I163-H166 PolarHBondContact O-N 2.92Å; I163-I167 HydrophobicContact CG2-CD1 3.46Å; I163-I167 VanDerWaalsContact CG2-CD1 3.46Å; I163-I167 HydrophobicContact CG2-CG1 4.15Å; I163-I167 VanDerWaalsContact O-CG1 3.32Å; I163-I167 WeakPolarHBondContact O-CG1 3.39Å; I163-I167 PolarHBondContact O-N 3.42Å
164	A	42.1	Very low	47.3	Very low	81 Å²	81	65.8 Å²	65.8	67%	0.669	36%	0.359	S	S	*	.	H	α-helix	trans	-63.1	-43.4	-171.7	0	0	0	0	0	113.4	A162 H166 L168	A162-A164 PolarHBondContact O-N 3.48Å; A164-H166 VanDerWaalsContact C-N 3.33Å; A164-H166 PolarHBondContact O-N 3.46Å; A164-L168 PolarHBondContact O-N 3.16Å; A164-L168 VanDerWaalsContact O-N 3.13Å
165	L	43.2	Very low	46.7	Very low	57 Å²	57	69.5 Å²	69.5	30%	0.298	38%	0.378	S	S	.	.	H	α-helix	trans	-67.4	-38.2	-179.4	-157.1	84.2	0	0	0	111.5	A162 I163 L168 W169 L207 H215	A162-L165 PolarHBondContact O-N 2.96Å; I163-L165 PolarHBondContact O-N 3.5Å; L165-L168 WeakPolarHBondContact O-CB 3.14Å; L165-L168 PolarHBondContact O-N 3.37Å; L165-W169 PolarHBondContact O-N 2.86Å; L165-W169 VanDerWaalsContact O-N 3.07Å; L165-L207 HydrophobicContact CD1-CD1 4.33Å; L165-L207 HydrophobicContact CD1-CD2 4.11Å; L165-H215 WeakPolarHBondContact CD1-NE2 3.48Å
166	H	46.2	Very low	46.3	Very low	31 Å²	31	68 Å²	68	14%	0.144	37%	0.373	C	S	.	.	H	α-helix	trans	-78.5	-34	-177.6	-67.8	86.8	0	0	0	112	F89 Y155 A162 I163 A164 L168 W169 M170	F89-H166 AromaticContact CE2-CD2 3.42Å; F89-H166 VanDerWaalsContact CE2-CD2 3.42Å; F89-H166 WeakPolarHBondContact CE2-CD2 3.44Å; F89-H166 AromaticContact CE2-NE2 3.99Å; F89-H166 AromaticContact CZ-CD2 3.61Å; F89-H166 AromaticContact CZ-NE2 3.86Å; Y155-H166 HydrophobicContact CD2-CB 3.37Å; Y155-H166 AromaticContact CD2-CG 3.92Å; Y155-H166 HydrophobicContact CE2-CB 3.42Å; Y155-H166 VanDerWaalsContact CE2-CB 3.42Å; A162-H166 VanDerWaalsContact CB-CE1 3.46Å; A162-H166 WeakPolarHBondContact CB-CE1 3.4Å; A162-H166 WeakPolarHBondContact CB-ND1 3.33Å; A162-H166 PolarHBondContact O-N 3.26Å; A162-H166 PolarHBondContact O-ND1 3.33Å; I163-H166 PolarHBondContact O-N 2.92Å; A164-H166 VanDerWaalsContact C-N 3.33Å; A164-H166 PolarHBondContact O-N 3.46Å; H166-L168 VanDerWaalsContact C-N 3.29Å; H166-L168 PolarHBondContact O-N 3.28Å; H166-W169 WeakPolarHBondContact O-CB 3.46Å; H166-W169 PolarHBondContact O-N 2.82Å; H166-M170 WeakPolarHBondContact O-CG 3.38Å; H166-M170 PolarHBondContact O-N 3.24Å
167	I	46.9	Very low	45.6	Very low	84 Å²	84	60.3 Å²	60.3	43%	0.431	35%	0.345	S	S	.	.	H	α-helix	trans	-57.7	-45.8	167.1	-71.4	173.4	0	0	0	109.5	I163 W169 M170 L171	I163-I167 HydrophobicContact CG2-CD1 3.46Å; I163-I167 VanDerWaalsContact CG2-CD1 3.46Å; I163-I167 HydrophobicContact CG2-CG1 4.15Å; I163-I167 VanDerWaalsContact O-CG1 3.32Å; I163-I167 WeakPolarHBondContact O-CG1 3.39Å; I163-I167 PolarHBondContact O-N 3.42Å; I167-W169 VanDerWaalsContact C-N 3.27Å; I167-W169 PolarHBondContact O-N 3.37Å; I167-M170 PolarHBondContact O-N 2.96Å; I167-L171 HydrophobicContact CG2-CD1 4.38Å; I167-L171 VanDerWaalsContact O-CB 3.29Å; I167-L171 WeakPolarHBondContact O-CB 3.21Å; I167-L171 PolarHBondContact O-N 3.46Å
168	L	46.4	Very low	44.9	Very low	96 Å²	96	61.8 Å²	61.8	50%	0.503	35%	0.349	S	S	.	.	H	α-helix	trans	-59.7	-39.7	177.6	-167.8	74.6	0	0	0	111.8	A164 L165 H166 L171 S172	A164-L168 PolarHBondContact O-N 3.16Å; A164-L168 VanDerWaalsContact O-N 3.13Å; L165-L168 WeakPolarHBondContact O-CB 3.14Å; L165-L168 PolarHBondContact O-N 3.37Å; H166-L168 VanDerWaalsContact C-N 3.29Å; H166-L168 PolarHBondContact O-N 3.28Å; L168-L171 PolarHBondContact O-N 2.75Å; L168-S172 WeakPolarHBondContact O-CB 3.18Å; L168-S172 PolarHBondContact O-N 3.43Å; L168-S172 PolarHBondContact O-OG 3.43Å
169	W	45	Very low	44.3	Very low	33 Å²	33	59.4 Å²	59.4	13%	0.125	34%	0.339	C	S	.	.	H	α-helix	trans	-64.2	-46	176.1	-155.6	55.5	0	0	0	112.1	F89 A151 L165 H166 I167 S172 F173 A218	F89-W169 HydrophobicContact CD2-CE3 4.39Å; F89-W169 AromaticContact CD2-CZ3 3.91Å; F89-W169 HydrophobicContact CD2-CZ3 3.91Å; A151-W169 HydrophobicContact CB-CZ3 3.89Å; L165-W169 PolarHBondContact O-N 2.86Å; L165-W169 VanDerWaalsContact O-N 3.07Å; H166-W169 WeakPolarHBondContact O-CB 3.46Å; H166-W169 PolarHBondContact O-N 2.82Å; I167-W169 VanDerWaalsContact C-N 3.27Å; I167-W169 PolarHBondContact O-N 3.37Å; W169-S172 WeakPolarHBondContact O-CB 3.42Å; W169-S172 PolarHBondContact O-N 2.84Å; W169-F173 HydrophobicContact CD2-CD2 4.3Å; W169-F173 HydrophobicContact CD2-CE2 4.04Å; W169-F173 AromaticContact CE2-CE2 3.73Å; W169-F173 HydrophobicContact CE3-CE2 4.27Å; W169-F173 HydrophobicContact CH2-CE2 4.01Å; W169-F173 AromaticContact CZ2-CE2 3.75Å; W169-F173 HydrophobicContact CZ2-CE2 3.75Å; W169-F173 HydrophobicContact CZ2-CZ 4.46Å; W169-F173 HydrophobicContact CZ3-CE2 4.24Å; W169-F173 PolarHBondContact O-N 2.98Å; W169-A218 VanDerWaalsContact CD1-CB 3.43Å
170	M	46.9	Very low	44	Very low	19 Å²	19	55.7 Å²	55.7	9%	0.094	31%	0.314	C	S	.	.	H	α-helix	trans	-66.6	-38.5	176.8	-66.7	-55.8	-83.6	0	0	112.2	F148 A151 L152 H166 I167 S172 F173 L174	F148-M170 HydrophobicContact CD1-CE 4.4Å; F148-M170 HydrophobicContact CD2-CE 3.64Å; F148-M170 HydrophobicContact CD2-SD 4.11Å; F148-M170 HydrophobicContact CE1-CE 3.99Å; F148-M170 HydrophobicContact CE2-CB 4.24Å; F148-M170 HydrophobicContact CE2-CE 3.18Å; F148-M170 HydrophobicContact CE2-SD 3.76Å; F148-M170 HydrophobicContact CG-CE 4.26Å; F148-M170 HydrophobicContact CZ-CE 3.38Å; F148-M170 HydrophobicContact CZ-SD 4.48Å; A151-M170 HydrophobicContact CB-SD 4.19Å; L152-M170 HydrophobicContact CB-CE 3.43Å; L152-M170 VanDerWaalsContact CB-CE 3.43Å; L152-M170 HydrophobicContact CD1-CE 3.17Å; L152-M170 HydrophobicContact CG-CE 3.86Å; H166-M170 WeakPolarHBondContact O-CG 3.38Å; H166-M170 PolarHBondContact O-N 3.24Å; I167-M170 PolarHBondContact O-N 2.96Å; M170-S172 VanDerWaalsContact C-N 3.28Å; M170-S172 PolarHBondContact O-N 3.2Å; M170-F173 PolarHBondContact O-N 2.85Å; M170-L174 WeakPolarHBondContact O-CB 3.44Å; M170-L174 PolarHBondContact O-N 2.93Å
171	L	46.6	Very low	43.8	Very low	89 Å²	89	54.1 Å²	54.1	47%	0.466	31%	0.308	S	S	.	.	H	α-helix	trans	-66.2	-35.5	175.1	-140.9	119.2	0	0	0	110.7	I167 L168 L174 L175	I167-L171 HydrophobicContact CG2-CD1 4.38Å; I167-L171 VanDerWaalsContact O-CB 3.29Å; I167-L171 WeakPolarHBondContact O-CB 3.21Å; I167-L171 PolarHBondContact O-N 3.46Å; L168-L171 PolarHBondContact O-N 2.75Å; L171-L174 PolarHBondContact O-N 3.38Å; L171-L175 HydrophobicContact CD2-CD1 3.96Å; L171-L175 HydrophobicContact CD2-CG 4.48Å; L171-L175 WeakPolarHBondContact O-CB 3.18Å; L171-L175 VanDerWaalsContact O-CG 3.24Å; L171-L175 WeakPolarHBondContact O-CG 3.38Å; L171-L175 PolarHBondContact O-N 3.45Å
172	S	46.2	Very low	43.6	Very low	21 Å²	21	53 Å²	53	15%	0.147	30%	0.296	C	S	.	.	H	α-helix	trans	-64.7	-47	173.3	-58.1	0	0	0	0	110.9	L168 W169 M170 L174 L175 I176	L168-S172 WeakPolarHBondContact O-CB 3.18Å; L168-S172 PolarHBondContact O-N 3.43Å; L168-S172 PolarHBondContact O-OG 3.43Å; W169-S172 WeakPolarHBondContact O-CB 3.42Å; W169-S172 PolarHBondContact O-N 2.84Å; M170-S172 VanDerWaalsContact C-N 3.28Å; M170-S172 PolarHBondContact O-N 3.2Å; S172-L174 PolarHBondContact O-N 2.93Å; S172-L175 PolarHBondContact O-N 2.94Å; S172-I176 WeakPolarHBondContact O-CB 3.46Å; S172-I176 WeakPolarHBondContact O-CD1 3.22Å; S172-I176 WeakPolarHBondContact O-CG1 2.97Å; S172-I176 PolarHBondContact O-N 3.48Å
173	F	45.7	Very low	43.7	Very low	24 Å²	24	59.6 Å²	59.6	11%	0.105	32%	0.317	C	S	.	.	H	α-helix	trans	-61.6	-41.1	173.5	-92.2	-76.9	0	0	0	113	F148 W169 M170 I176 A177 T221	F148-F173 HydrophobicContact CD2-CB 3.54Å; F148-F173 HydrophobicContact CD2-CG 4.19Å; F148-F173 HydrophobicContact CE2-CB 3.8Å; W169-F173 HydrophobicContact CD2-CD2 4.3Å; W169-F173 HydrophobicContact CD2-CE2 4.04Å; W169-F173 AromaticContact CE2-CE2 3.73Å; W169-F173 HydrophobicContact CE3-CE2 4.27Å; W169-F173 HydrophobicContact CH2-CE2 4.01Å; W169-F173 AromaticContact CZ2-CE2 3.75Å; W169-F173 HydrophobicContact CZ2-CE2 3.75Å; W169-F173 HydrophobicContact CZ2-CZ 4.46Å; W169-F173 HydrophobicContact CZ3-CE2 4.24Å; W169-F173 PolarHBondContact O-N 2.98Å; M170-F173 PolarHBondContact O-N 2.85Å; F173-I176 WeakPolarHBondContact O-CB 3.2Å; F173-I176 PolarHBondContact O-N 2.92Å; F173-A177 WeakPolarHBondContact O-CB 3.41Å; F173-A177 PolarHBondContact O-N 3.32Å; F173-T221 HydrophobicContact CE1-CG2 4.26Å; F173-T221 HydrophobicContact CZ-CG2 3.99Å
174	L	44.8	Very low	43.6	Very low	73 Å²	73	58.6 Å²	58.6	38%	0.382	32%	0.315	S	S	.	.	H	α-helix	trans	-65.1	-44.5	176.5	-178.2	67.5	0	0	0	111	M170 L171 S172 I176 A177 L178	M170-L174 WeakPolarHBondContact O-CB 3.44Å; M170-L174 PolarHBondContact O-N 2.93Å; L171-L174 PolarHBondContact O-N 3.38Å; S172-L174 PolarHBondContact O-N 2.93Å; L174-I176 PolarHBondContact O-N 3.16Å; L174-A177 PolarHBondContact O-N 3.32Å; L174-L178 HydrophobicContact CD1-CD1 4.41Å; L174-L178 HydrophobicContact CD1-CG 4.48Å; L174-L178 HydrophobicContact CD2-CD1 4.47Å; L174-L178 HydrophobicContact CG-CD1 3.93Å; L174-L178 HydrophobicContact CG-CG 4.42Å; L174-L178 VanDerWaalsContact O-CB 3.3Å; L174-L178 WeakPolarHBondContact O-CB 3.19Å; L174-L178 VanDerWaalsContact O-CG 3.27Å; L174-L178 WeakPolarHBondContact O-CG 3.34Å; L174-L178 PolarHBondContact O-N 3.39Å
175	L	45	Very low	43.3	Very low	78 Å²	78	63.7 Å²	63.7	41%	0.408	32%	0.316	S	S	.	.	H	α-helix	trans	-61	-35.3	174.5	-81.8	167.1	0	0	0	111.3	L171 S172 A179 I190	L171-L175 HydrophobicContact CD2-CD1 3.96Å; L171-L175 HydrophobicContact CD2-CG 4.48Å; L171-L175 WeakPolarHBondContact O-CB 3.18Å; L171-L175 VanDerWaalsContact O-CG 3.24Å; L171-L175 WeakPolarHBondContact O-CG 3.38Å; L171-L175 PolarHBondContact O-N 3.45Å; S172-L175 PolarHBondContact O-N 2.94Å; L175-A179 WeakPolarHBondContact O-CB 3.36Å; L175-A179 PolarHBondContact O-N 2.98Å; L175-I190 HydrophobicContact CB-CD1 4.29Å
176	I	44.4	Very low	43.1	Very low	14 Å²	14	66.6 Å²	66.6	7%	0.072	33%	0.33	C	S	.	.	H	α-helix	trans	-69.2	-46.1	173.8	-68.2	157.9	0	0	0	110.8	S172 F173 L174 L178 A179 M180 I222 L226	S172-I176 WeakPolarHBondContact O-CB 3.46Å; S172-I176 WeakPolarHBondContact O-CD1 3.22Å; S172-I176 WeakPolarHBondContact O-CG1 2.97Å; S172-I176 PolarHBondContact O-N 3.48Å; F173-I176 WeakPolarHBondContact O-CB 3.2Å; F173-I176 PolarHBondContact O-N 2.92Å; L174-I176 PolarHBondContact O-N 3.16Å; I176-L178 VanDerWaalsContact C-N 3.29Å; I176-L178 PolarHBondContact O-N 3.38Å; I176-A179 PolarHBondContact O-N 3.09Å; I176-M180 HydrophobicContact CG2-CG 4.31Å; I176-M180 VanDerWaalsContact O-CB 3.25Å; I176-M180 WeakPolarHBondContact O-CB 3.49Å; I176-M180 WeakPolarHBondContact O-CG 3.29Å; I176-M180 PolarHBondContact O-N 2.9Å; I176-I222 HydrophobicContact CD1-CB 3.82Å; I176-I222 HydrophobicContact CD1-CD1 3.91Å; I176-I222 HydrophobicContact CD1-CG1 3.36Å; I176-I222 HydrophobicContact CD1-CG2 3.41Å; I176-I222 VanDerWaalsContact CD1-CG2 3.41Å; I176-I222 HydrophobicContact CG1-CG2 4.17Å; I176-L226 HydrophobicContact CG1-CD1 4.09Å; I176-L226 HydrophobicContact CG1-CD2 4.21Å; I176-L226 HydrophobicContact CG1-CG 4.06Å; I176-L226 HydrophobicContact CG2-CD2 4.4Å; I176-L226 HydrophobicContact CG2-CG 4.41Å
177	A	42.3	Very low	43.1	Very low	10 Å²	10	65.3 Å²	65.3	8%	0.083	33%	0.325	C	S	.	.	H	α-helix	trans	-60.1	-42.5	175.9	0	0	0	0	0	111.1	V143 W145 F173 L174 A181	V143-A177 HydrophobicContact CG1-CB 3.81Å; W145-A177 HydrophobicContact CH2-CB 3.92Å; W145-A177 HydrophobicContact CZ2-CB 4.48Å; W145-A177 HydrophobicContact CZ3-CB 4.18Å; F173-A177 WeakPolarHBondContact O-CB 3.41Å; F173-A177 PolarHBondContact O-N 3.32Å; L174-A177 PolarHBondContact O-N 3.32Å; A177-A181 WeakPolarHBondContact O-CB 3.39Å; A177-A181 PolarHBondContact O-N 2.65Å
178	L	41.2	Very low	42.9	Very low	75 Å²	75	62.2 Å²	62.2	39%	0.393	31%	0.309	S	S	.	.	H	α-helix	trans	-66.9	-45.7	175	-74.3	168.2	0	0	0	111.6	L174 I176 M180 A181 F182	L174-L178 HydrophobicContact CD1-CD1 4.41Å; L174-L178 HydrophobicContact CD1-CG 4.48Å; L174-L178 HydrophobicContact CD2-CD1 4.47Å; L174-L178 HydrophobicContact CG-CD1 3.93Å; L174-L178 HydrophobicContact CG-CG 4.42Å; L174-L178 VanDerWaalsContact O-CB 3.3Å; L174-L178 WeakPolarHBondContact O-CB 3.19Å; L174-L178 VanDerWaalsContact O-CG 3.27Å; L174-L178 WeakPolarHBondContact O-CG 3.34Å; L174-L178 PolarHBondContact O-N 3.39Å; I176-L178 VanDerWaalsContact C-N 3.29Å; I176-L178 PolarHBondContact O-N 3.38Å; L178-M180 VanDerWaalsContact C-N 3.29Å; L178-M180 PolarHBondContact O-N 2.9Å; L178-A181 CarbonylContact O-C 3.49Å; L178-A181 WeakPolarHBondContact O-CA 3.28Å; L178-A181 WeakPolarHBondContact O-CB 3.01Å; L178-A181 PolarHBondContact O-N 3.11Å; L178-A181 VanDerWaalsContact O-N 3.07Å; L178-F182 HydrophobicContact CB-CD2 4.4Å; L178-F182 HydrophobicContact CD2-CD2 4.29Å; L178-F182 HydrophobicContact CD2-CE2 3.92Å; L178-F182 VanDerWaalsContact O-CB 3.31Å; L178-F182 WeakPolarHBondContact O-CB 3.3Å; L178-F182 WeakPolarHBondContact O-CD2 3.32Å; L178-F182 PolarHBondContact O-N 2.91Å
179	A	41.1	Very low	42.6	Very low	5 Å²	5	60.1 Å²	60.1	4%	0.041	31%	0.305	C	S	.	.	H	α-helix	trans	-67.6	-31.8	178.4	0	0	0	0	0	112.4	L175 I176 F182 M186 I190	L175-A179 WeakPolarHBondContact O-CB 3.36Å; L175-A179 PolarHBondContact O-N 2.98Å; I176-A179 PolarHBondContact O-N 3.09Å; A179-F182 CarbonylContact O-C 3.56Å; A179-F182 VanDerWaalsContact O-C 3.3Å; A179-F182 PolarHBondContact O-N 3.43Å; A179-M186 HydrophobicContact CB-CB 4.16Å; A179-I190 HydrophobicContact CB-CD1 3.56Å
180	M	40	Very low	42.5	Very low	15 Å²	15	60.2 Å²	60.2	7%	0.074	31%	0.308	C	S	.	.	H	α-helix	trans	-67.3	-40.3	169.1	-70.7	-119.8	-61.1	0	0	110.8	L139 V143 I176 L178 K229	L139-M180 WeakPolarHBondContact CD2-O 3.19Å; L139-M180 WeakPolarHBondContact CG-O 3.08Å; V143-M180 HydrophobicContact CG2-CE 4.44Å; I176-M180 HydrophobicContact CG2-CG 4.31Å; I176-M180 VanDerWaalsContact O-CB 3.25Å; I176-M180 WeakPolarHBondContact O-CB 3.49Å; I176-M180 WeakPolarHBondContact O-CG 3.29Å; I176-M180 PolarHBondContact O-N 2.9Å; L178-M180 VanDerWaalsContact C-N 3.29Å; L178-M180 PolarHBondContact O-N 2.9Å; M180-K229 HydrophobicContact CE-CD 3.45Å; M180-K229 VanDerWaalsContact CE-CD 3.45Å; M180-K229 HydrophobicContact CE-CG 4.31Å; M180-K229 HydrophobicContact SD-CB 4.07Å; M180-K229 HydrophobicContact SD-CD 3.71Å; M180-K229 HydrophobicContact SD-CG 3.94Å
181	A	38.5	Very low	42.6	Very low	58 Å²	58	59.8 Å²	59.8	48%	0.479	31%	0.306	S	S	.	.	H	α-helix	trans	-67.5	-34.1	173	0	0	0	0	0	113	A177 L178	A177-A181 WeakPolarHBondContact O-CB 3.39Å; A177-A181 PolarHBondContact O-N 2.65Å; L178-A181 CarbonylContact O-C 3.49Å; L178-A181 WeakPolarHBondContact O-CA 3.28Å; L178-A181 WeakPolarHBondContact O-CB 3.01Å; L178-A181 PolarHBondContact O-N 3.11Å; L178-A181 VanDerWaalsContact O-N 3.07Å
182	F	36.8	Very low	42.4	Very low	137 Å²	137	58.3 Å²	58.3	60%	0.601	30%	0.296	S	S	*	.	S	Bend	trans	-110	86.4	-174.8	-70.6	-68.8	0	0	0	111	L178 A179	L178-F182 HydrophobicContact CB-CD2 4.4Å; L178-F182 HydrophobicContact CD2-CD2 4.29Å; L178-F182 HydrophobicContact CD2-CE2 3.92Å; L178-F182 VanDerWaalsContact O-CB 3.31Å; L178-F182 WeakPolarHBondContact O-CB 3.3Å; L178-F182 WeakPolarHBondContact O-CD2 3.32Å; L178-F182 PolarHBondContact O-N 2.91Å; A179-F182 CarbonylContact O-C 3.56Å; A179-F182 VanDerWaalsContact O-C 3.3Å; A179-F182 PolarHBondContact O-N 3.43Å
183	K	42.5	Very low	42.2	Very low	178 Å²	178	61 Å²	61	77%	0.774	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	38.3	124.4	164.5	-69.6	-178.8	177.7	174.8	0	116.5	R185 M186	K183-R185 PolarHBondContact O-N 3.38Å; K183-M186 PolarHBondContact O-N 3.33Å
184	V	43.9	Very low	42.3	Very low	53 Å²	53	61.5 Å²	61.5	32%	0.321	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-22.7	-39.9	174.1	-176.2	0	0	0	0	117.2	M186 A187 I188 P230 L234	V184-M186 VanDerWaalsContact C-N 3.33Å; V184-M186 PolarHBondContact O-N 3.28Å; V184-A187 WeakPolarHBondContact O-CB 3.25Å; V184-A187 PolarHBondContact O-N 2.77Å; V184-I188 HydrophobicContact CG1-CD1 4.32Å; V184-I188 WeakPolarHBondContact O-CG1 3.08Å; V184-I188 PolarHBondContact O-N 2.84Å; V184-P230 HydrophobicContact CG1-CB 4.28Å; V184-P230 HydrophobicContact CG2-CB 4.41Å; V184-L234 HydrophobicContact CG1-CD1 4.42Å
185	R	36.5	Very low	42.3	Very low	187 Å²	187	59 Å²	59	71%	0.706	31%	0.306	S	S	*	.	H	α-helix	trans	-55.4	-38.4	177.7	-60.1	-175	-170.5	-178.7	2.9	114.2	K183 A189	K183-R185 PolarHBondContact O-N 3.38Å; R185-A189 PolarHBondContact O-N 2.89Å
186	M	37.9	Very low	42	Very low	118 Å²	118	58.9 Å²	58.9	58%	0.581	31%	0.305	S	S	*	.	H	α-helix	trans	-73.2	-36.1	178.9	-77	-62.3	-162	0	0	112.3	A179 K183 V184 I188 A189 I190	A179-M186 HydrophobicContact CB-CB 4.16Å; K183-M186 PolarHBondContact O-N 3.33Å; V184-M186 VanDerWaalsContact C-N 3.33Å; V184-M186 PolarHBondContact O-N 3.28Å; M186-I188 PolarHBondContact O-N 2.69Å; M186-A189 PolarHBondContact O-N 3.31Å; M186-I190 WeakPolarHBondContact O-CG1 3.48Å; M186-I190 PolarHBondContact O-N 3.49Å; M186-I190 VanDerWaalsContact O-N 3.12Å
187	A	46.5	Very low	41.8	Very low	5 Å²	5	62.2 Å²	62.2	4%	0.041	32%	0.317	C	S	.	.	H	α-helix	trans	-59.3	-37	175.7	0	0	0	0	0	111.6	V184 F191 L226 P230	V184-A187 WeakPolarHBondContact O-CB 3.25Å; V184-A187 PolarHBondContact O-N 2.77Å; A187-F191 WeakPolarHBondContact O-CB 3.34Å; A187-F191 PolarHBondContact O-N 3.39Å; A187-L226 HydrophobicContact CB-CD2 3.79Å; A187-P230 HydrophobicContact CB-CG 4.32Å
188	I	43.2	Very low	41.8	Very low	18 Å²	18	64.6 Å²	64.6	9%	0.092	33%	0.33	C	S	.	.	H	α-helix	trans	-63.7	-46	176.1	-63	169.8	0	0	0	111.5	V184 M186 F191 F192 I258 L259	V184-I188 HydrophobicContact CG1-CD1 4.32Å; V184-I188 WeakPolarHBondContact O-CG1 3.08Å; V184-I188 PolarHBondContact O-N 2.84Å; M186-I188 PolarHBondContact O-N 2.69Å; I188-F191 WeakPolarHBondContact O-CB 3.34Å; I188-F191 PolarHBondContact O-N 2.88Å; I188-F192 HydrophobicContact CG2-CD2 3.83Å; I188-F192 HydrophobicContact CG2-CE2 3.76Å; I188-F192 WeakPolarHBondContact O-CD2 3.29Å; I188-F192 PolarHBondContact O-N 3.17Å; I188-I258 HydrophobicContact CG2-CG2 3.69Å; I188-L259 HydrophobicContact CD1-CD1 4.46Å; I188-L259 HydrophobicContact CD1-CD2 3.69Å; I188-L259 HydrophobicContact CD1-CG 3.89Å; I188-L259 HydrophobicContact CG1-CD2 3.73Å; I188-L259 HydrophobicContact CG1-CG 4.47Å
189	A	40.2	Very low	41.6	Very low	52 Å²	52	63.2 Å²	63.2	43%	0.43	33%	0.33	S	S	.	.	H	α-helix	trans	-64.9	-41.5	-179.4	0	0	0	0	0	112	R185 M186 F191 F192 S193	R185-A189 PolarHBondContact O-N 2.89Å; M186-A189 PolarHBondContact O-N 3.31Å; A189-F191 VanDerWaalsContact C-N 3.34Å; A189-F192 PolarHBondContact O-N 2.88Å; A189-S193 WeakPolarHBondContact O-CB 3.45Å; A189-S193 PolarHBondContact O-N 2.87Å; A189-S193 PolarHBondContact O-OG 3.13Å
190	I	42.7	Very low	41.2	Very low	35 Å²	35	70.1 Å²	70.1	18%	0.179	36%	0.359	C	S	.	.	H	α-helix	trans	-65.8	-39	176.3	-63.8	172.3	0	0	0	110.6	L175 A179 M186 S193 M194 L226	L175-I190 HydrophobicContact CB-CD1 4.29Å; A179-I190 HydrophobicContact CB-CD1 3.56Å; M186-I190 WeakPolarHBondContact O-CG1 3.48Å; M186-I190 PolarHBondContact O-N 3.49Å; M186-I190 VanDerWaalsContact O-N 3.12Å; I190-S193 WeakPolarHBondContact O-CB 3.48Å; I190-S193 PolarHBondContact O-N 3.36Å; I190-M194 HydrophobicContact CG2-CG 4.41Å; I190-M194 WeakPolarHBondContact O-CB 3.36Å; I190-M194 WeakPolarHBondContact O-CG 3.4Å; I190-M194 PolarHBondContact O-N 2.78Å; I190-L226 HydrophobicContact CB-CD1 4.43Å; I190-L226 HydrophobicContact CG2-CD1 3.79Å
191	F	48.2	Very low	41.1	Very low	11 Å²	11	70.4 Å²	70.4	5%	0.048	37%	0.366	C	S	.	.	H	α-helix	trans	-59.7	-51.5	173.3	169.4	-97.7	0	0	0	112.1	A187 I188 A189 S193 M194 V195 F227 A266	A187-F191 WeakPolarHBondContact O-CB 3.34Å; A187-F191 PolarHBondContact O-N 3.39Å; I188-F191 WeakPolarHBondContact O-CB 3.34Å; I188-F191 PolarHBondContact O-N 2.88Å; A189-F191 VanDerWaalsContact C-N 3.34Å; F191-S193 PolarHBondContact O-N 3.36Å; F191-M194 PolarHBondContact O-N 2.91Å; F191-M194 VanDerWaalsContact O-N 3.11Å; F191-V195 HydrophobicContact CD1-CG2 4.23Å; F191-V195 HydrophobicContact CD2-CG2 3.8Å; F191-V195 HydrophobicContact CE1-CG2 3.88Å; F191-V195 HydrophobicContact CE2-CG2 3.42Å; F191-V195 VanDerWaalsContact CE2-CG2 3.42Å; F191-V195 HydrophobicContact CG-CG2 4.22Å; F191-V195 HydrophobicContact CZ-CG2 3.49Å; F191-V195 VanDerWaalsContact CZ-CG2 3.49Å; F191-V195 WeakPolarHBondContact O-CB 3.36Å; F191-V195 WeakPolarHBondContact O-CG2 3.32Å; F191-V195 PolarHBondContact O-N 2.79Å; F191-F227 HydrophobicContact CD1-CD2 4.23Å; F191-F227 HydrophobicContact CD1-CE2 4.01Å; F191-F227 AromaticContact CD2-CD2 3.85Å; F191-F227 HydrophobicContact CD2-CD2 3.85Å; F191-F227 HydrophobicContact CD2-CE2 4.43Å; F191-F227 HydrophobicContact CE1-CD2 4.32Å; F191-F227 HydrophobicContact CE1-CE2 4Å; F191-F227 AromaticContact CE2-CD2 3.94Å; F191-F227 HydrophobicContact CE2-CD2 3.94Å; F191-F227 HydrophobicContact CE2-CE2 4.42Å; F191-F227 AromaticContact CG-CD2 3.98Å; F191-F227 HydrophobicContact CG-CD2 3.98Å; F191-F227 HydrophobicContact CG-CE2 4.21Å; F191-F227 HydrophobicContact CZ-CD2 4.16Å; F191-F227 HydrophobicContact CZ-CE2 4.19Å; F191-A266 HydrophobicContact CE1-CB 4.23Å; F191-A266 HydrophobicContact CZ-CB 3.67Å
192	F	43.7	Very low	40.7	Very low	57 Å²	57	68.5 Å²	68.5	25%	0.25	35%	0.352	C	S	.	.	H	α-helix	trans	-59.2	-39.6	176.8	-85.9	-72.9	0	0	0	111.1	I188 A189 M194 V195 I196 I258 G262	I188-F192 HydrophobicContact CG2-CD2 3.83Å; I188-F192 HydrophobicContact CG2-CE2 3.76Å; I188-F192 WeakPolarHBondContact O-CD2 3.29Å; I188-F192 PolarHBondContact O-N 3.17Å; A189-F192 PolarHBondContact O-N 2.88Å; F192-M194 PolarHBondContact O-N 3.41Å; F192-V195 PolarHBondContact O-N 2.73Å; F192-I196 HydrophobicContact CB-CD1 4.39Å; F192-I196 WeakPolarHBondContact O-CB 3.14Å; F192-I196 WeakPolarHBondContact O-CD1 3.49Å; F192-I196 WeakPolarHBondContact O-CG1 3.23Å; F192-I196 PolarHBondContact O-N 2.95Å; F192-I258 HydrophobicContact CE2-CG2 3.66Å; F192-I258 HydrophobicContact CZ-CG2 4.21Å; F192-G262 VanDerWaalsContact CZ-CA 3.41Å
193	S	41.5	Very low	40.5	Very low	77 Å²	77	62.4 Å²	62.4	54%	0.538	33%	0.328	S	S	.	.	H	α-helix	trans	-63	-42.3	176.8	-55.9	0	0	0	0	111.6	A189 I190 F191 Y197	A189-S193 WeakPolarHBondContact O-CB 3.45Å; A189-S193 PolarHBondContact O-N 2.87Å; A189-S193 PolarHBondContact O-OG 3.13Å; I190-S193 WeakPolarHBondContact O-CB 3.48Å; I190-S193 PolarHBondContact O-N 3.36Å; F191-S193 PolarHBondContact O-N 3.36Å; S193-Y197 WeakPolarHBondContact O-CB 3.23Å; S193-Y197 PolarHBondContact O-N 2.75Å
194	M	47.7	Very low	40.1	Very low	35 Å²	35	61.7 Å²	61.7	17%	0.172	32%	0.32	C	S	.	.	H	α-helix	trans	-70.2	-43.2	177.6	-78.6	-110.9	170	0	0	113.2	I190 F191 F192 Y197 T198 L219 I222	I190-M194 HydrophobicContact CG2-CG 4.41Å; I190-M194 WeakPolarHBondContact O-CB 3.36Å; I190-M194 WeakPolarHBondContact O-CG 3.4Å; I190-M194 PolarHBondContact O-N 2.78Å; F191-M194 PolarHBondContact O-N 2.91Å; F191-M194 VanDerWaalsContact O-N 3.11Å; F192-M194 PolarHBondContact O-N 3.41Å; M194-Y197 PolarHBondContact O-N 3.1Å; M194-T198 PolarHBondContact O-N 3.35Å; M194-T198 PolarHBondContact O-OG1 3.01Å; M194-L219 HydrophobicContact SD-CD2 4.47Å; M194-I222 HydrophobicContact CE-CD1 3.49Å; M194-I222 VanDerWaalsContact CE-CD1 3.49Å; M194-I222 HydrophobicContact CE-CG2 3.81Å; M194-I222 HydrophobicContact CG-CG2 4.16Å; M194-I222 HydrophobicContact SD-CB 4.05Å; M194-I222 HydrophobicContact SD-CD1 3.92Å; M194-I222 HydrophobicContact SD-CG2 3.43Å; M194-I222 WeakPolarHBondContact SD-CG2 3.02Å
195	V	44.4	Very low	39.5	Very low	22 Å²	22	63.4 Å²	63.4	13%	0.133	34%	0.34	C	S	.	.	H	α-helix	trans	-66.8	-42.6	176.8	172.6	0	0	0	0	110.5	F191 F192 T198 A199 A266 L269	F191-V195 HydrophobicContact CD1-CG2 4.23Å; F191-V195 HydrophobicContact CD2-CG2 3.8Å; F191-V195 HydrophobicContact CE1-CG2 3.88Å; F191-V195 HydrophobicContact CE2-CG2 3.42Å; F191-V195 VanDerWaalsContact CE2-CG2 3.42Å; F191-V195 HydrophobicContact CG-CG2 4.22Å; F191-V195 HydrophobicContact CZ-CG2 3.49Å; F191-V195 VanDerWaalsContact CZ-CG2 3.49Å; F191-V195 WeakPolarHBondContact O-CB 3.36Å; F191-V195 WeakPolarHBondContact O-CG2 3.32Å; F191-V195 PolarHBondContact O-N 2.79Å; F192-V195 PolarHBondContact O-N 2.73Å; V195-T198 VanDerWaalsContact CA-OG1 3.27Å; V195-T198 WeakPolarHBondContact CA-OG1 3.31Å; V195-T198 PolarHBondContact O-N 3.45Å; V195-T198 PolarHBondContact O-OG1 3.4Å; V195-A199 WeakPolarHBondContact O-CB 3.3Å; V195-A199 PolarHBondContact O-N 3.34Å; V195-A266 HydrophobicContact CG1-CB 4.17Å; V195-A266 HydrophobicContact CG2-CB 4.45Å; V195-L269 HydrophobicContact CG1-CD1 4.26Å
196	I	39.3	Very low	39.2	Very low	75 Å²	75	61.3 Å²	61.3	39%	0.385	34%	0.342	S	S	.	.	H	α-helix	trans	-63.4	-46.9	172.9	-69.8	169.1	0	0	0	109.1	F192 T198 A199 F200	F192-I196 HydrophobicContact CB-CD1 4.39Å; F192-I196 WeakPolarHBondContact O-CB 3.14Å; F192-I196 WeakPolarHBondContact O-CD1 3.49Å; F192-I196 WeakPolarHBondContact O-CG1 3.23Å; F192-I196 PolarHBondContact O-N 2.95Å; I196-T198 PolarHBondContact O-N 2.53Å; I196-A199 PolarHBondContact O-N 3.48Å; I196-F200 HydrophobicContact CB-CD2 4.15Å; I196-F200 HydrophobicContact CB-CE2 4.46Å; I196-F200 HydrophobicContact CG1-CE2 4.38Å; I196-F200 HydrophobicContact CG2-CD2 3.51Å; I196-F200 HydrophobicContact CG2-CE2 3.93Å; I196-F200 WeakPolarHBondContact O-CB 3.28Å; I196-F200 VanDerWaalsContact O-CD2 3.3Å; I196-F200 WeakPolarHBondContact O-CD2 3.5Å; I196-F200 PolarHBondContact O-N 2.84Å
197	Y	39.4	Very low	38.8	Very low	84 Å²	84	58.4 Å²	58.4	33%	0.329	33%	0.329	S	S	.	.	H	α-helix	trans	-58.9	-36.2	178.4	-177.6	-99.2	0	0	0	112.7	S193 M194 G202	S193-Y197 WeakPolarHBondContact O-CB 3.23Å; S193-Y197 PolarHBondContact O-N 2.75Å; M194-Y197 PolarHBondContact O-N 3.1Å; Y197-G202 PolarHBondContact O-N 3.26Å
198	T	43.5	Very low	38.1	Very low	59 Å²	59	63.8 Å²	63.8	36%	0.362	37%	0.373	S	S	.	.	H	α-helix	trans	-76	-50.6	174.2	26.6	0	0	0	0	114.1	M194 V195 I196 F200 G201 L219	M194-T198 PolarHBondContact O-N 3.35Å; M194-T198 PolarHBondContact O-OG1 3.01Å; V195-T198 VanDerWaalsContact CA-OG1 3.27Å; V195-T198 WeakPolarHBondContact CA-OG1 3.31Å; V195-T198 PolarHBondContact O-N 3.45Å; V195-T198 PolarHBondContact O-OG1 3.4Å; I196-T198 PolarHBondContact O-N 2.53Å; T198-F200 PolarHBondContact O-N 2.96Å; T198-G201 PolarHBondContact O-N 2.66Å; T198-G201 VanDerWaalsContact O-N 3.11Å; T198-L219 HydrophobicContact CG2-CD1 2.98Å; T198-L219 HydrophobicContact CG2-CD2 3.18Å; T198-L219 HydrophobicContact CG2-CG 3.58Å
199	A	36	Very low	37.9	Very low	47 Å²	47	64.7 Å²	64.7	39%	0.388	39%	0.386	S	S	.	.	H	α-helix	trans	-64.3	-41.7	-175.4	0	0	0	0	0	111.5	V195 I196 G201 L269	V195-A199 WeakPolarHBondContact O-CB 3.3Å; V195-A199 PolarHBondContact O-N 3.34Å; I196-A199 PolarHBondContact O-N 3.48Å; A199-G201 PolarHBondContact O-N 2.83Å; A199-L269 HydrophobicContact CB-CB 4.33Å; A199-L269 HydrophobicContact CB-CD1 3.84Å; A199-L269 HydrophobicContact CB-CD2 4.48Å; A199-L269 HydrophobicContact CB-CG 4.47Å
200	F	33.8	Very low	37.7	Very low	150 Å²	150	68.1 Å²	68.1	66%	0.658	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	8.4	177.5	-69.2	-80	0	0	0	113.3	I196 T198 G202	I196-F200 HydrophobicContact CB-CD2 4.15Å; I196-F200 HydrophobicContact CB-CE2 4.46Å; I196-F200 HydrophobicContact CG1-CE2 4.38Å; I196-F200 HydrophobicContact CG2-CD2 3.51Å; I196-F200 HydrophobicContact CG2-CE2 3.93Å; I196-F200 WeakPolarHBondContact O-CB 3.28Å; I196-F200 VanDerWaalsContact O-CD2 3.3Å; I196-F200 WeakPolarHBondContact O-CD2 3.5Å; I196-F200 PolarHBondContact O-N 2.84Å; T198-F200 PolarHBondContact O-N 2.96Å; F200-G202 PolarHBondContact O-N 3.32Å; F200-G202 VanDerWaalsContact O-N 3.16Å
201	G	37.3	Very low	37.5	Very low	21 Å²	21	68.8 Å²	68.8	22%	0.216	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.3	32.3	177.1	0	0	0	0	0	112.3	T198 A199 G203 R204 A205	T198-G201 PolarHBondContact O-N 2.66Å; T198-G201 VanDerWaalsContact O-N 3.11Å; A199-G201 PolarHBondContact O-N 2.83Å; G201-G203 PolarHBondContact O-N 3.13Å; G201-G203 VanDerWaalsContact O-N 3.15Å; G201-R204 CarbonylContact O-C 3.51Å; G201-R204 WeakPolarHBondContact O-CA 3.43Å; G201-R204 WeakPolarHBondContact O-CB 2.94Å; G201-R204 PolarHBondContact O-N 2.68Å; G201-A205 PolarHBondContact O-N 3.06Å
202	G	28.8	Very low	37	Very low	17 Å²	17	70.8 Å²	70.8	18%	0.175	42%	0.421	C	S	.	.	H	α-helix	trans	-54.2	-32.1	171.8	0	0	0	0	0	111.2	Y197 F200 R204 A205 L206	Y197-G202 PolarHBondContact O-N 3.26Å; F200-G202 PolarHBondContact O-N 3.32Å; F200-G202 VanDerWaalsContact O-N 3.16Å; G202-R204 VanDerWaalsContact C-N 3.33Å; G202-R204 PolarHBondContact O-N 3.27Å; G202-A205 PolarHBondContact O-N 3.41Å; G202-L206 VanDerWaalsContact O-CB 3.32Å; G202-L206 WeakPolarHBondContact O-CB 3.31Å; G202-L206 PolarHBondContact O-N 2.96Å
203	G	34.3	Very low	36.8	Very low	10 Å²	10	68.8 Å²	68.8	10%	0.103	41%	0.413	C	S	.	.	H	α-helix	trans	-66	-25.8	169.1	0	0	0	0	0	115.1	G201 L207	G201-G203 PolarHBondContact O-N 3.13Å; G201-G203 VanDerWaalsContact O-N 3.15Å; G203-L207 WeakPolarHBondContact O-CB 3.48Å
204	R	33.4	Very low	36.5	Very low	162 Å²	162	66 Å²	66	61%	0.611	39%	0.394	S	S	*	.	H	α-helix	trans	-90.7	-30.8	173.2	-66.1	-170.3	174	-173.8	-2	113.2	G201 G202 L207 I211	G201-R204 CarbonylContact O-C 3.51Å; G201-R204 WeakPolarHBondContact O-CA 3.43Å; G201-R204 WeakPolarHBondContact O-CB 2.94Å; G201-R204 PolarHBondContact O-N 2.68Å; G202-R204 VanDerWaalsContact C-N 3.33Å; G202-R204 PolarHBondContact O-N 3.27Å; R204-L207 VanDerWaalsContact O-O 3.04Å; R204-I211 HydrophobicContact CG-CD1 3.72Å; R204-I211 HydrophobicContact CG-CG1 3.9Å
205	A	30.4	Very low	36.2	Very low	89 Å²	89	65.7 Å²	65.7	74%	0.736	39%	0.392	S	S	*	.	H	α-helix	trans	-79	-35	-178.6	0	0	0	0	0	112.1	G201 G202	G201-A205 PolarHBondContact O-N 3.06Å; G202-A205 PolarHBondContact O-N 3.41Å
206	L	30.7	Very low	36	Very low	144 Å²	144	65.5 Å²	65.5	75%	0.754	39%	0.39	S	S	*	.	S	Bend	trans	-90.2	-22.4	178.9	-127.1	134.2	0	0	0	113	G202	G202-L206 VanDerWaalsContact O-CB 3.32Å; G202-L206 WeakPolarHBondContact O-CB 3.31Å; G202-L206 PolarHBondContact O-N 2.96Å
207	L	30.4	Very low	36.1	Very low	57 Å²	57	62.1 Å²	62.1	30%	0.298	37%	0.373	S	S	.	.			trans	-117.9	100.5	174.9	-58.1	152.8	0	0	0	106.8	L165 G203 R204 G209 H215	L165-L207 HydrophobicContact CD1-CD1 4.33Å; L165-L207 HydrophobicContact CD1-CD2 4.11Å; G203-L207 WeakPolarHBondContact O-CB 3.48Å; R204-L207 VanDerWaalsContact O-O 3.04Å; L207-G209 PolarHBondContact O-N 2.74Å; L207-H215 VanDerWaalsContact CD1-NE2 3.32Å; L207-H215 WeakPolarHBondContact CD1-NE2 3.06Å
208	A	32.3	Very low	36.2	Very low	117 Å²	117	58.6 Å²	58.6	97%	0.967	36%	0.361	S	S	*	.	S	Bend	trans	-65.2	27.6	172.5	0	0	0	0	0	113.3
209	G	37.1	Very low	36.3	Very low	37 Å²	37	57.2 Å²	57.2	38%	0.381	35%	0.351	S	S	.	.	S	Bend	trans	-131.4	163.9	179.7	0	0	0	0	0	111.4	L207 I211	L207-G209 PolarHBondContact O-N 2.74Å; G209-I211 PolarHBondContact O-N 3.13Å
210	P	37.4	Very low	36.7	Very low	124 Å²	124	55.8 Å²	55.8	81%	0.805	34%	0.337	S	S	*	.			trans	-56.6	132.1	177.7	23.4	-32.1	0	0	0	110.2	T212	P210-T212 PolarHBondContact O-N 2.91Å
211	I	38.1	Very low	37	Very low	49 Å²	49	49.7 Å²	49.7	25%	0.251	31%	0.312	S	S	.	.			trans	-53.9	111.4	174.9	-58.7	173.4	0	0	0	107.3	R204 G209 H215 Q216	R204-I211 HydrophobicContact CG-CD1 3.72Å; R204-I211 HydrophobicContact CG-CG1 3.9Å; G209-I211 PolarHBondContact O-N 3.13Å; I211-H215 HydrophobicContact CG2-CB 3.81Å; I211-Q216 HydrophobicContact CG2-CG 4.02Å
212	T	38.4	Very low	37.3	Very low	53 Å²	53	48.8 Å²	48.8	33%	0.325	30%	0.303	S	S	.	.			trans	-71.9	150.3	-179.8	59.5	0	0	0	0	110.5	P210 A214 H215	P210-T212 PolarHBondContact O-N 2.91Å; T212-A214 PolarHBondContact O-N 3.37Å; T212-H215 WeakPolarHBondContact O-CB 3.43Å; T212-H215 PolarHBondContact O-N 2.68Å; T212-H215 PolarHBondContact OG1-CE1 3.33Å; T212-H215 PolarHBondContact OG1-ND1 3.29Å
213	I	38.2	Very low	38.1	Very low	16 Å²	16	48.4 Å²	48.4	8%	0.082	30%	0.299	C	S	.	.	H	α-helix	trans	-49.1	-32.2	177.9	-49.5	-169.2	0	0	0	112	Q95 Q216 I217 L365	Q95-I213 HydrophobicContact CB-CD1 4.03Å; Q95-I213 HydrophobicContact CG-CD1 4.23Å; I213-Q216 VanDerWaalsContact O-CB 3.32Å; I213-Q216 WeakPolarHBondContact O-CB 2.92Å; I213-Q216 PolarHBondContact O-N 2.93Å; I213-I217 HydrophobicContact CG2-CD1 3.78Å; I213-I217 HydrophobicContact CG2-CG1 4.28Å; I213-I217 WeakPolarHBondContact O-CG1 3.48Å; I213-I217 PolarHBondContact O-N 2.88Å; I213-L365 HydrophobicContact CB-CD2 3.95Å; I213-L365 HydrophobicContact CD1-CD2 3.44Å; I213-L365 VanDerWaalsContact CD1-CD2 3.44Å; I213-L365 HydrophobicContact CG1-CD2 3.3Å; I213-L365 HydrophobicContact CG2-CD2 3.82Å
214	A	35.5	Very low	38.5	Very low	17 Å²	17	48 Å²	48	14%	0.14	30%	0.295	C	S	.	.	H	α-helix	trans	-57.2	-47.3	174.2	0	0	0	0	0	113.4	C92 T212 Q216 I217 A218	C92-A214 HydrophobicContact CB-CB 4.02Å; T212-A214 PolarHBondContact O-N 3.37Å; A214-Q216 PolarHBondContact O-N 2.84Å; A214-I217 PolarHBondContact O-N 3.46Å; A214-A218 WeakPolarHBondContact O-CB 3.14Å; A214-A218 PolarHBondContact O-N 2.62Å
215	H	40.5	Very low	38.9	Very low	29 Å²	29	43.8 Å²	43.8	13%	0.134	28%	0.279	C	S	.	.	H	α-helix	trans	-62.2	-40.5	178.3	-68.6	92.6	0	0	0	111.2	L165 L207 I211 T212 A218 L219	L165-H215 WeakPolarHBondContact CD1-NE2 3.48Å; L207-H215 VanDerWaalsContact CD1-NE2 3.32Å; L207-H215 WeakPolarHBondContact CD1-NE2 3.06Å; I211-H215 HydrophobicContact CG2-CB 3.81Å; T212-H215 WeakPolarHBondContact O-CB 3.43Å; T212-H215 PolarHBondContact O-N 2.68Å; T212-H215 PolarHBondContact OG1-CE1 3.33Å; T212-H215 PolarHBondContact OG1-ND1 3.29Å; H215-A218 WeakPolarHBondContact O-CB 3.36Å; H215-A218 PolarHBondContact O-N 3.2Å; H215-L219 WeakPolarHBondContact O-CD1 3.26Å; H215-L219 PolarHBondContact O-N 3.29Å
216	Q	41.9	Very low	39.4	Very low	19 Å²	19	39.7 Å²	39.7	9%	0.089	25%	0.245	C	C	.	.	H	α-helix	trans	-67.8	-46.6	-177.9	-88	172.4	2.1	0	0	112.4	I211 I213 A214 A218 L219 V220 L365 L366 L369	I211-Q216 HydrophobicContact CG2-CG 4.02Å; I213-Q216 VanDerWaalsContact O-CB 3.32Å; I213-Q216 WeakPolarHBondContact O-CB 2.92Å; I213-Q216 PolarHBondContact O-N 2.93Å; A214-Q216 PolarHBondContact O-N 2.84Å; Q216-A218 VanDerWaalsContact C-N 3.3Å; Q216-L219 WeakPolarHBondContact O-CB 3.32Å; Q216-L219 PolarHBondContact O-N 3.41Å; Q216-L219 VanDerWaalsContact O-N 3.13Å; Q216-V220 WeakPolarHBondContact O-CG2 3.45Å; Q216-V220 PolarHBondContact O-N 3.4Å; Q216-L365 VanDerWaalsContact OE1-CD2 3.29Å; Q216-L366 HydrophobicContact CG-CD1 4.18Å; Q216-L366 VanDerWaalsContact NE2-CD1 3.27Å; Q216-L369 HydrophobicContact CB-CD1 3.23Å; Q216-L369 HydrophobicContact CB-CD2 3.97Å; Q216-L369 HydrophobicContact CB-CG 4.18Å; Q216-L369 HydrophobicContact CG-CD1 3.41Å; Q216-L369 VanDerWaalsContact CG-CD1 3.41Å
217	I	40.1	Very low	40	Very low	4 Å²	4	33.5 Å²	33.5	2%	0.021	21%	0.211	C	C	.	.	H	α-helix	trans	-65.3	-37.2	172.3	-70	173.7	0	0	0	110	C92 I213 A214 L219 V220 T221 L369	C92-I217 VanDerWaalsContact SG-CD1 3.52Å; I213-I217 HydrophobicContact CG2-CD1 3.78Å; I213-I217 HydrophobicContact CG2-CG1 4.28Å; I213-I217 WeakPolarHBondContact O-CG1 3.48Å; I213-I217 PolarHBondContact O-N 2.88Å; A214-I217 PolarHBondContact O-N 3.46Å; I217-L219 VanDerWaalsContact C-N 3.28Å; I217-L219 PolarHBondContact O-N 3.37Å; I217-V220 PolarHBondContact O-N 3.43Å; I217-T221 WeakPolarHBondContact O-CB 3.41Å; I217-T221 PolarHBondContact O-N 3.03Å; I217-T221 PolarHBondContact O-OG1 3.14Å; I217-L369 HydrophobicContact CG1-CD2 4.17Å
218	A	41.9	Very low	40.6	Very low	9 Å²	9	31.6 Å²	31.6	7%	0.074	20%	0.202	C	C	.	.	H	α-helix	trans	-51.5	-52	169	0	0	0	0	0	109.9	W169 A214 H215 Q216 V220 T221 I222	W169-A218 VanDerWaalsContact CD1-CB 3.43Å; A214-A218 WeakPolarHBondContact O-CB 3.14Å; A214-A218 PolarHBondContact O-N 2.62Å; H215-A218 WeakPolarHBondContact O-CB 3.36Å; H215-A218 PolarHBondContact O-N 3.2Å; Q216-A218 VanDerWaalsContact C-N 3.3Å; A218-V220 PolarHBondContact O-N 3.27Å; A218-T221 PolarHBondContact O-N 2.9Å; A218-I222 HydrophobicContact CB-CD1 3.97Å; A218-I222 WeakPolarHBondContact O-CA 3.3Å; A218-I222 WeakPolarHBondContact O-CB 3.45Å; A218-I222 WeakPolarHBondContact O-CD1 3.42Å; A218-I222 WeakPolarHBondContact O-CG1 3.34Å; A218-I222 PolarHBondContact O-N 3.49Å
219	L	46.3	Very low	41.1	Very low	31 Å²	31	26.5 Å²	26.5	16%	0.162	16%	0.158	C	C	.	.	H	α-helix	trans	-65.6	-36.9	-178.1	-88.1	143.1	0	0	0	114.2	M194 T198 H215 Q216 I217 G223 I373	M194-L219 HydrophobicContact SD-CD2 4.47Å; T198-L219 HydrophobicContact CG2-CD1 2.98Å; T198-L219 HydrophobicContact CG2-CD2 3.18Å; T198-L219 HydrophobicContact CG2-CG 3.58Å; H215-L219 WeakPolarHBondContact O-CD1 3.26Å; H215-L219 PolarHBondContact O-N 3.29Å; Q216-L219 WeakPolarHBondContact O-CB 3.32Å; Q216-L219 PolarHBondContact O-N 3.41Å; Q216-L219 VanDerWaalsContact O-N 3.13Å; I217-L219 VanDerWaalsContact C-N 3.28Å; I217-L219 PolarHBondContact O-N 3.37Å; L219-G223 VanDerWaalsContact O-CA 3.31Å; L219-G223 WeakPolarHBondContact O-CA 3.32Å; L219-G223 PolarHBondContact O-N 3.07Å; L219-I373 HydrophobicContact CB-CD1 4.25Å
220	V	42.8	Very low	41.3	Very low	16 Å²	16	25.5 Å²	25.5	10%	0.097	15%	0.145	C	C	.	.	H	α-helix	trans	-64.6	-48.7	173.8	177.9	0	0	0	0	110.9	Q216 I217 A218 G224 L369 I373	Q216-V220 WeakPolarHBondContact O-CG2 3.45Å; Q216-V220 PolarHBondContact O-N 3.4Å; I217-V220 PolarHBondContact O-N 3.43Å; A218-V220 PolarHBondContact O-N 3.27Å; V220-G224 VanDerWaalsContact O-CA 3.3Å; V220-G224 WeakPolarHBondContact O-CA 3.38Å; V220-G224 PolarHBondContact O-N 2.95Å; V220-L369 HydrophobicContact CG2-CB 4.04Å; V220-L369 HydrophobicContact CG2-CD2 3.44Å; V220-L369 VanDerWaalsContact CG2-CD2 3.44Å; V220-L369 HydrophobicContact CG2-CG 4.37Å; V220-I373 HydrophobicContact CB-CD1 4.47Å; V220-I373 HydrophobicContact CB-CG1 4.05Å; V220-I373 HydrophobicContact CG1-CG1 4.39Å; V220-I373 HydrophobicContact CG2-CD1 3.84Å; V220-I373 HydrophobicContact CG2-CG1 3.72Å
221	T	41.6	Very low	41.7	Very low	22 Å²	22	20.5 Å²	20.5	14%	0.135	11%	0.112	C	C	.	.	H	α-helix	trans	-66.8	-44.9	-178.9	-37.9	0	0	0	0	109.3	F173 I217 A218 W225	F173-T221 HydrophobicContact CE1-CG2 4.26Å; F173-T221 HydrophobicContact CZ-CG2 3.99Å; I217-T221 WeakPolarHBondContact O-CB 3.41Å; I217-T221 PolarHBondContact O-N 3.03Å; I217-T221 PolarHBondContact O-OG1 3.14Å; A218-T221 PolarHBondContact O-N 2.9Å; T221-W225 HydrophobicContact CG2-CD2 4.34Å; T221-W225 HydrophobicContact CG2-CG 4.31Å; T221-W225 WeakPolarHBondContact O-CA 3.3Å; T221-W225 WeakPolarHBondContact O-CB 3.43Å; T221-W225 PolarHBondContact O-N 3.5Å
222	I	42.4	Very low	41.9	Very low	2 Å²	2	18.6 Å²	18.6	1%	0.01	10%	0.102	C	C	.	.	H	α-helix	trans	-76	-51.7	-174.8	-61.4	173.7	0	0	0	111.1	I176 M194 A218 W225 L226	I176-I222 HydrophobicContact CD1-CB 3.82Å; I176-I222 HydrophobicContact CD1-CD1 3.91Å; I176-I222 HydrophobicContact CD1-CG1 3.36Å; I176-I222 HydrophobicContact CD1-CG2 3.41Å; I176-I222 VanDerWaalsContact CD1-CG2 3.41Å; I176-I222 HydrophobicContact CG1-CG2 4.17Å; M194-I222 HydrophobicContact CE-CD1 3.49Å; M194-I222 VanDerWaalsContact CE-CD1 3.49Å; M194-I222 HydrophobicContact CE-CG2 3.81Å; M194-I222 HydrophobicContact CG-CG2 4.16Å; M194-I222 HydrophobicContact SD-CB 4.05Å; M194-I222 HydrophobicContact SD-CD1 3.92Å; M194-I222 HydrophobicContact SD-CG2 3.43Å; M194-I222 WeakPolarHBondContact SD-CG2 3.02Å; A218-I222 HydrophobicContact CB-CD1 3.97Å; A218-I222 WeakPolarHBondContact O-CA 3.3Å; A218-I222 WeakPolarHBondContact O-CB 3.45Å; A218-I222 WeakPolarHBondContact O-CD1 3.42Å; A218-I222 WeakPolarHBondContact O-CG1 3.34Å; A218-I222 PolarHBondContact O-N 3.49Å; I222-W225 PolarHBondContact O-N 3.37Å; I222-L226 HydrophobicContact CG2-CD1 3.33Å; I222-L226 HydrophobicContact CG2-CG 4.18Å; I222-L226 WeakPolarHBondContact O-CB 3.44Å; I222-L226 WeakPolarHBondContact O-CG 3.5Å; I222-L226 PolarHBondContact O-N 2.77Å
223	G	45.8	Very low	42.1	Very low	9 Å²	9	18.7 Å²	18.7	9%	0.093	10%	0.1	C	C	.	.	H	α-helix	trans	-68.1	-42.5	-179.4	0	0	0	0	0	112.4	L219	L219-G223 VanDerWaalsContact O-CA 3.31Å; L219-G223 WeakPolarHBondContact O-CA 3.32Å; L219-G223 PolarHBondContact O-N 3.07Å
224	G	43.7	Very low	42.2	Very low	2 Å²	2	18.7 Å²	18.7	2%	0.021	10%	0.1	C	C	.	.	H	α-helix	trans	-59.4	-53.8	171.5	0	0	0	0	0	110.9	V220 T228	V220-G224 VanDerWaalsContact O-CA 3.3Å; V220-G224 WeakPolarHBondContact O-CA 3.38Å; V220-G224 PolarHBondContact O-N 2.95Å; G224-T228 WeakPolarHBondContact O-CB 3.21Å; G224-T228 PolarHBondContact O-N 2.97Å; G224-T228 PolarHBondContact O-OG1 3.25Å
225	W	40.9	Very low	42.4	Very low	73 Å²	73	18.5 Å²	18.5	28%	0.277	10%	0.096	S	C	.	.	H	α-helix	trans	-75.3	-39.7	-172.2	-68.2	43.1	0	0	0	114.5	M123 P144 T221 I222 F227 T228 K229	M123-W225 HydrophobicContact SD-CH2 4.4Å; P144-W225 HydrophobicContact CB-CH2 3.81Å; P144-W225 HydrophobicContact CB-CZ3 3.64Å; P144-W225 HydrophobicContact CG-CE3 4.13Å; P144-W225 HydrophobicContact CG-CH2 3.92Å; P144-W225 HydrophobicContact CG-CZ3 3.33Å; T221-W225 HydrophobicContact CG2-CD2 4.34Å; T221-W225 HydrophobicContact CG2-CG 4.31Å; T221-W225 WeakPolarHBondContact O-CA 3.3Å; T221-W225 WeakPolarHBondContact O-CB 3.43Å; T221-W225 PolarHBondContact O-N 3.5Å; I222-W225 PolarHBondContact O-N 3.37Å; W225-F227 PolarHBondContact O-N 3.2Å; W225-T228 WeakPolarHBondContact CA-OG1 3.49Å; W225-K229 WeakPolarHBondContact O-CB 3.46Å; W225-K229 PolarHBondContact O-N 2.81Å; W225-K229 VanDerWaalsContact O-N 3.15Å
226	L	41.4	Very low	42.3	Very low	4 Å²	4	18.6 Å²	18.6	2%	0.021	10%	0.097	C	C	.	.	H	α-helix	trans	-61.1	-29.5	178.6	-89.8	164.1	0	0	0	111.9	I176 A187 I190 I222 P230	I176-L226 HydrophobicContact CG1-CD1 4.09Å; I176-L226 HydrophobicContact CG1-CD2 4.21Å; I176-L226 HydrophobicContact CG1-CG 4.06Å; I176-L226 HydrophobicContact CG2-CD2 4.4Å; I176-L226 HydrophobicContact CG2-CG 4.41Å; A187-L226 HydrophobicContact CB-CD2 3.79Å; I190-L226 HydrophobicContact CB-CD1 4.43Å; I190-L226 HydrophobicContact CG2-CD1 3.79Å; I222-L226 HydrophobicContact CG2-CD1 3.33Å; I222-L226 HydrophobicContact CG2-CG 4.18Å; I222-L226 WeakPolarHBondContact O-CB 3.44Å; I222-L226 WeakPolarHBondContact O-CG 3.5Å; I222-L226 PolarHBondContact O-N 2.77Å; L226-P230 WeakPolarHBondContact O-CD 3.32Å; L226-P230 WeakPolarHBondContact O-CG 3.43Å
227	F	42.7	Very low	42	Very low	13 Å²	13	21.2 Å²	21.2	6%	0.057	12%	0.115	C	C	.	.	H	α-helix	trans	-100.1	-44.4	-176.1	-136.4	-99.4	0	0	0	112.4	F191 W225 K229 L231 L259 N263	F191-F227 HydrophobicContact CD1-CD2 4.23Å; F191-F227 HydrophobicContact CD1-CE2 4.01Å; F191-F227 AromaticContact CD2-CD2 3.85Å; F191-F227 HydrophobicContact CD2-CD2 3.85Å; F191-F227 HydrophobicContact CD2-CE2 4.43Å; F191-F227 HydrophobicContact CE1-CD2 4.32Å; F191-F227 HydrophobicContact CE1-CE2 4Å; F191-F227 AromaticContact CE2-CD2 3.94Å; F191-F227 HydrophobicContact CE2-CD2 3.94Å; F191-F227 HydrophobicContact CE2-CE2 4.42Å; F191-F227 AromaticContact CG-CD2 3.98Å; F191-F227 HydrophobicContact CG-CD2 3.98Å; F191-F227 HydrophobicContact CG-CE2 4.21Å; F191-F227 HydrophobicContact CZ-CD2 4.16Å; F191-F227 HydrophobicContact CZ-CE2 4.19Å; W225-F227 PolarHBondContact O-N 3.2Å; F227-K229 PolarHBondContact O-N 3.45Å; F227-L231 HydrophobicContact CD1-CD1 3.3Å; F227-L231 HydrophobicContact CD1-CG 4.13Å; F227-L231 HydrophobicContact CE1-CD1 3.52Å; F227-L231 HydrophobicContact CE1-CG 4.22Å; F227-L231 HydrophobicContact CG-CD1 4.37Å; F227-L231 VanDerWaalsContact O-CB 3.29Å; F227-L231 WeakPolarHBondContact O-CB 3.41Å; F227-L231 WeakPolarHBondContact O-CD1 3.31Å; F227-L231 WeakPolarHBondContact O-CG 3.46Å; F227-L231 PolarHBondContact O-N 2.94Å; F227-L259 HydrophobicContact CE1-CD2 4.44Å; F227-L259 HydrophobicContact CE2-CD2 3.88Å; F227-L259 HydrophobicContact CZ-CD2 3.59Å; F227-N263 HydrophobicContact CE1-CB 4.23Å; F227-N263 HydrophobicContact CZ-CB 4.34Å
228	T	43.6	Very low	41.7	Very low	17 Å²	17	28 Å²	28	10%	0.104	14%	0.14	C	C	.	.	H	α-helix	trans	-54.8	-56.4	175	38.1	0	0	0	0	109.6	G224 W225 L231 L232 T376 T380	G224-T228 WeakPolarHBondContact O-CB 3.21Å; G224-T228 PolarHBondContact O-N 2.97Å; G224-T228 PolarHBondContact O-OG1 3.25Å; W225-T228 WeakPolarHBondContact CA-OG1 3.49Å; T228-L231 PolarHBondContact O-N 3.43Å; T228-L232 HydrophobicContact CG2-CD1 4.26Å; T228-L232 VanDerWaalsContact O-CB 3.32Å; T228-L232 WeakPolarHBondContact O-CB 3.4Å; T228-L232 VanDerWaalsContact O-CD1 3.23Å; T228-L232 WeakPolarHBondContact O-CD1 3.36Å; T228-L232 WeakPolarHBondContact O-CG 3.21Å; T228-L232 PolarHBondContact O-N 2.8Å; T228-T376 HydrophobicContact CG2-CG2 3.58Å; T228-T380 HydrophobicContact CG2-CG2 4.06Å; T228-T380 WeakPolarHBondContact CG2-OG1 3.42Å
229	K	42.4	Very low	41.4	Very low	11 Å²	11	28.6 Å²	28.6	5%	0.048	14%	0.143	C	C	.	.	H	α-helix	trans	-67.2	-43.7	-163.6	-169	160.5	164.8	-174.3	0	114.4	I127 S142 M180 W225 F227 L232 L233	I127-K229 HydrophobicContact CD1-CD 3.99Å; I127-K229 HydrophobicContact CD1-CG 4.39Å; S142-K229 VanDerWaalsContact CB-NZ 3.3Å; S142-K229 PolarHBondContact O-NZ 3.11Å; S142-K229 WeakPolarHBondContact OG-CE 3.4Å; S142-K229 PolarHBondContact OG-NZ 3.34Å; M180-K229 HydrophobicContact CE-CD 3.45Å; M180-K229 VanDerWaalsContact CE-CD 3.45Å; M180-K229 HydrophobicContact CE-CG 4.31Å; M180-K229 HydrophobicContact SD-CB 4.07Å; M180-K229 HydrophobicContact SD-CD 3.71Å; M180-K229 HydrophobicContact SD-CG 3.94Å; W225-K229 WeakPolarHBondContact O-CB 3.46Å; W225-K229 PolarHBondContact O-N 2.81Å; W225-K229 VanDerWaalsContact O-N 3.15Å; F227-K229 PolarHBondContact O-N 3.45Å; K229-L232 PolarHBondContact O-N 2.87Å; K229-L233 HydrophobicContact CG-CD1 4.03Å; K229-L233 HydrophobicContact CG-CG 4.44Å; K229-L233 VanDerWaalsContact O-CB 3.3Å; K229-L233 WeakPolarHBondContact O-CB 3.43Å; K229-L233 WeakPolarHBondContact O-CD1 3.38Å; K229-L233 WeakPolarHBondContact O-CG 3.18Å; K229-L233 PolarHBondContact O-N 3.44Å
230	P	41.2	Very low	41	Very low	15 Å²	15	31.9 Å²	31.9	10%	0.097	16%	0.161	C	C	.	.	H	α-helix	trans	-66.6	-38.6	173.8	-22.1	35.5	0	0	0	112.9	V184 A187 L226 L233 L234	V184-P230 HydrophobicContact CG1-CB 4.28Å; V184-P230 HydrophobicContact CG2-CB 4.41Å; A187-P230 HydrophobicContact CB-CG 4.32Å; L226-P230 WeakPolarHBondContact O-CD 3.32Å; L226-P230 WeakPolarHBondContact O-CG 3.43Å; P230-L233 PolarHBondContact O-N 2.9Å; P230-L234 VanDerWaalsContact O-CB 3.27Å; P230-L234 WeakPolarHBondContact O-CB 3.31Å; P230-L234 WeakPolarHBondContact O-CD1 3.29Å; P230-L234 PolarHBondContact O-N 3.37Å
231	L	45.4	Very low	41	Very low	20 Å²	20	31.7 Å²	31.7	11%	0.105	16%	0.16	C	C	.	.	H	α-helix	trans	-61.3	-49.2	173.7	-79.4	173.3	0	0	0	110.4	F227 T228 L233 L234 F235 T380 V384	F227-L231 HydrophobicContact CD1-CD1 3.3Å; F227-L231 HydrophobicContact CD1-CG 4.13Å; F227-L231 HydrophobicContact CE1-CD1 3.52Å; F227-L231 HydrophobicContact CE1-CG 4.22Å; F227-L231 HydrophobicContact CG-CD1 4.37Å; F227-L231 VanDerWaalsContact O-CB 3.29Å; F227-L231 WeakPolarHBondContact O-CB 3.41Å; F227-L231 WeakPolarHBondContact O-CD1 3.31Å; F227-L231 WeakPolarHBondContact O-CG 3.46Å; F227-L231 PolarHBondContact O-N 2.94Å; T228-L231 PolarHBondContact O-N 3.43Å; L231-L233 VanDerWaalsContact C-N 3.33Å; L231-L233 PolarHBondContact O-N 3.11Å; L231-L234 CarbonylContact O-C 3.5Å; L231-L234 WeakPolarHBondContact O-CA 3.46Å; L231-L234 WeakPolarHBondContact O-CB 3.47Å; L231-L234 PolarHBondContact O-N 2.88Å; L231-F235 HydrophobicContact CD2-CE2 4.07Å; L231-F235 WeakPolarHBondContact O-CD2 3.47Å; L231-F235 PolarHBondContact O-N 3.38Å; L231-T380 HydrophobicContact CB-CG2 4.3Å; L231-T380 HydrophobicContact CD1-CG2 4.26Å; L231-V384 HydrophobicContact CB-CG2 4.37Å
232	L	43.9	Very low	40.9	Very low	9 Å²	9	31.9 Å²	31.9	5%	0.047	16%	0.16	C	C	.	.	H	α-helix	trans	-62.7	-42.3	179.5	-60.6	160.6	0	0	0	110.6	A124 F128 T228 K229 L234 F235 D236 T380	A124-L232 HydrophobicContact CB-CD1 3.21Å; A124-L232 HydrophobicContact CB-CD2 4.08Å; A124-L232 HydrophobicContact CB-CG 4.23Å; F128-L232 HydrophobicContact CE1-CB 4.01Å; F128-L232 WeakPolarHBondContact CE1-O 3.4Å; F128-L232 HydrophobicContact CE2-CB 4.06Å; F128-L232 HydrophobicContact CE2-CD2 3.34Å; F128-L232 HydrophobicContact CE2-CG 4.19Å; F128-L232 HydrophobicContact CZ-CB 3.54Å; F128-L232 HydrophobicContact CZ-CD2 3.31Å; F128-L232 HydrophobicContact CZ-CG 3.97Å; T228-L232 HydrophobicContact CG2-CD1 4.26Å; T228-L232 VanDerWaalsContact O-CB 3.32Å; T228-L232 WeakPolarHBondContact O-CB 3.4Å; T228-L232 VanDerWaalsContact O-CD1 3.23Å; T228-L232 WeakPolarHBondContact O-CD1 3.36Å; T228-L232 WeakPolarHBondContact O-CG 3.21Å; T228-L232 PolarHBondContact O-N 2.8Å; K229-L232 PolarHBondContact O-N 2.87Å; L232-L234 PolarHBondContact O-N 2.84Å; L232-F235 CarbonylContact O-C 3.3Å; L232-F235 PolarHBondContact O-N 3.45Å; L232-D236 PolarHBondContact O-N 2.93Å; L232-T380 HydrophobicContact CD2-CG2 3.83Å; L232-T380 HydrophobicContact CG-CG2 4.06Å
233	L	41.2	Very low	40.8	Very low	54 Å²	54	36 Å²	36	28%	0.283	18%	0.18	S	C	.	.	H	α-helix	trans	-61.3	-33.1	172.9	-74.4	166.4	0	0	0	112.7	I127 L139 K229 P230 L231 F235	I127-L233 HydrophobicContact CG2-CD2 3.94Å; L139-L233 HydrophobicContact CD1-CD1 3.54Å; K229-L233 HydrophobicContact CG-CD1 4.03Å; K229-L233 HydrophobicContact CG-CG 4.44Å; K229-L233 VanDerWaalsContact O-CB 3.3Å; K229-L233 WeakPolarHBondContact O-CB 3.43Å; K229-L233 WeakPolarHBondContact O-CD1 3.38Å; K229-L233 WeakPolarHBondContact O-CG 3.18Å; K229-L233 PolarHBondContact O-N 3.44Å; P230-L233 PolarHBondContact O-N 2.9Å; L231-L233 VanDerWaalsContact C-N 3.33Å; L231-L233 PolarHBondContact O-N 3.11Å; L233-F235 VanDerWaalsContact C-N 3.3Å
234	L	40.5	Very low	40.7	Very low	16 Å²	16	37.1 Å²	37.1	8%	0.084	18%	0.181	C	C	.	.	H	α-helix	trans	-67.1	-29.4	173.5	-102.4	152.5	0	0	0	113.1	V184 P230 L231 L232 V247 L251	V184-L234 HydrophobicContact CG1-CD1 4.42Å; P230-L234 VanDerWaalsContact O-CB 3.27Å; P230-L234 WeakPolarHBondContact O-CB 3.31Å; P230-L234 WeakPolarHBondContact O-CD1 3.29Å; P230-L234 PolarHBondContact O-N 3.37Å; L231-L234 CarbonylContact O-C 3.5Å; L231-L234 WeakPolarHBondContact O-CA 3.46Å; L231-L234 WeakPolarHBondContact O-CB 3.47Å; L231-L234 PolarHBondContact O-N 2.88Å; L232-L234 PolarHBondContact O-N 2.84Å; L234-V247 HydrophobicContact CD2-CG1 3.35Å; L234-V247 HydrophobicContact CG-CG1 4.43Å; L234-L251 HydrophobicContact CD1-CD1 4.1Å; L234-L251 HydrophobicContact CD2-CD1 3.23Å; L234-L251 HydrophobicContact CD2-CG 4Å; L234-L251 HydrophobicContact CG-CD1 4.31Å
235	F	41	Very low	40.6	Very low	14 Å²	14	38.5 Å²	38.5	6%	0.061	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.7	24.8	-171	-71.5	-69.3	0	0	0	113.8	L231 L232 L233 V237 I248 V384 L388	L231-F235 HydrophobicContact CD2-CE2 4.07Å; L231-F235 WeakPolarHBondContact O-CD2 3.47Å; L231-F235 PolarHBondContact O-N 3.38Å; L232-F235 CarbonylContact O-C 3.3Å; L232-F235 PolarHBondContact O-N 3.45Å; L233-F235 VanDerWaalsContact C-N 3.3Å; F235-V237 PolarHBondContact O-N 3.43Å; F235-V237 VanDerWaalsContact O-N 3.16Å; F235-I248 HydrophobicContact CE1-CD1 3.9Å; F235-I248 HydrophobicContact CE1-CG1 4Å; F235-I248 HydrophobicContact CZ-CG1 4.3Å; F235-V384 HydrophobicContact CB-CG2 4.39Å; F235-V384 HydrophobicContact CD1-CG1 4.27Å; F235-V384 HydrophobicContact CD2-CB 3.96Å; F235-V384 HydrophobicContact CD2-CG1 3.47Å; F235-V384 VanDerWaalsContact CD2-CG1 3.47Å; F235-V384 HydrophobicContact CD2-CG2 3.34Å; F235-V384 HydrophobicContact CE1-CG1 3.98Å; F235-V384 HydrophobicContact CE2-CB 4.13Å; F235-V384 HydrophobicContact CE2-CG1 3.16Å; F235-V384 HydrophobicContact CE2-CG2 3.87Å; F235-V384 HydrophobicContact CG-CB 4.45Å; F235-V384 HydrophobicContact CG-CG1 4.06Å; F235-V384 HydrophobicContact CG-CG2 3.96Å; F235-V384 HydrophobicContact CZ-CG1 3.44Å; F235-V384 VanDerWaalsContact CZ-CG1 3.44Å; F235-L388 HydrophobicContact CD1-CG 4.26Å; F235-L388 HydrophobicContact CE1-CD1 3.93Å; F235-L388 HydrophobicContact CE1-CD2 3.53Å; F235-L388 HydrophobicContact CE1-CG 3.48Å; F235-L388 VanDerWaalsContact CE1-CG 3.48Å; F235-L388 HydrophobicContact CZ-CD1 3.92Å; F235-L388 HydrophobicContact CZ-CD2 4.14Å; F235-L388 HydrophobicContact CZ-CG 4.01Å
236	D	38.5	Very low	40.6	Very low	30 Å²	30	35.9 Å²	35.9	16%	0.16	18%	0.18	C	C	.	.			trans	-31.7	116.3	179.4	-175.9	-2.8	0	0	0	112.7	L232 R238 T239	L232-D236 PolarHBondContact O-N 2.93Å; D236-R238 PolarHBondContact O-N 2.87Å; D236-R238 VanDerWaalsContact O-N 3.11Å; D236-R238 PolarHBondContact OD1-N 3.45Å; D236-T239 HydrophobicContact CB-CG2 3.85Å; D236-T239 PolarHBondContact O-N 2.88Å; D236-T239 PolarHBondContact O-OG1 3.5Å
237	V	35.1	Very low	40.7	Very low	74 Å²	74	38.3 Å²	38.3	45%	0.448	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-22.3	-171.4	175.8	0	0	0	0	111.8	F128 F235 R244	F128-V237 HydrophobicContact CB-CB 4.25Å; F128-V237 HydrophobicContact CB-CG2 3.87Å; F128-V237 HydrophobicContact CD1-CB 4.29Å; F128-V237 HydrophobicContact CD1-CG2 3.55Å; F128-V237 HydrophobicContact CD2-CG2 4Å; F128-V237 HydrophobicContact CE1-CG2 3.85Å; F128-V237 HydrophobicContact CE2-CG2 4.3Å; F128-V237 HydrophobicContact CG-CB 4.42Å; F128-V237 HydrophobicContact CG-CG2 3.6Å; F128-V237 HydrophobicContact CZ-CG2 4.22Å; F235-V237 PolarHBondContact O-N 3.43Å; F235-V237 VanDerWaalsContact O-N 3.16Å; V237-R244 PolarHBondContact O-NH1 2.91Å
238	R	32.4	Very low	40.8	Very low	147 Å²	147	39.1 Å²	39.1	56%	0.555	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-3.9	175.1	-68.2	-165.7	-171	-151.2	6.5	115	C132 D236 N240	C132-R238 WeakPolarHBondContact SG-CD 3.15Å; C132-R238 PolarHBondContact SG-NE 3.48Å; C132-R238 PolarHBondContact SG-NH1 3.39Å; D236-R238 PolarHBondContact O-N 2.87Å; D236-R238 VanDerWaalsContact O-N 3.11Å; D236-R238 PolarHBondContact OD1-N 3.45Å; R238-N240 PolarHBondContact O-N 3.32Å
239	T	37.3	Very low	40.7	Very low	21 Å²	21	44.5 Å²	44.5	13%	0.129	22%	0.221	C	C	.	.	S	Bend	trans	-71.7	124.8	170	52.9	0	0	0	0	109	D236 Q243 R244	D236-T239 HydrophobicContact CB-CG2 3.85Å; D236-T239 PolarHBondContact O-N 2.88Å; D236-T239 PolarHBondContact O-OG1 3.5Å; T239-Q243 VanDerWaalsContact CA-OE1 3.27Å; T239-Q243 HydrophobicContact CG2-CB 4.03Å; T239-R244 PolarHBondContact O-NH1 3.49Å; T239-R244 WeakPolarHBondContact OG1-CG 3.12Å
240	N	37.4	Very low	40.6	Very low	101 Å²	101	48.4 Å²	48.4	54%	0.54	25%	0.25	S	C	.	.			trans	-56.5	152.6	175	-63.4	-3.9	0	0	0	108	R238 L242 Q243 R244	R238-N240 PolarHBondContact O-N 3.32Å; N240-L242 CarbonylContact O-C 3.57Å; N240-L242 PolarHBondContact O-N 3.07Å; N240-Q243 WeakPolarHBondContact O-CA 3.24Å; N240-Q243 WeakPolarHBondContact O-CB 3.46Å; N240-Q243 PolarHBondContact O-N 3.31Å; N240-R244 PolarHBondContact O-N 2.96Å
241	A	42.8	Very low	40.7	Very low	11 Å²	11	49.2 Å²	49.2	9%	0.091	25%	0.253	C	S	.	.	H	α-helix	trans	-47.5	-36.4	-176	0	0	0	0	0	113.9	R244 R245 N394	A241-R244 PolarHBondContact O-N 3.38Å; A241-R245 WeakPolarHBondContact O-CB 3.18Å; A241-R245 PolarHBondContact O-N 2.98Å; A241-N394 HydrophobicContact CB-CB 3.36Å; A241-N394 WeakPolarHBondContact CB-O 3.45Å
242	L	39.1	Very low	40.6	Very low	26 Å²	26	50.9 Å²	50.9	14%	0.136	27%	0.267	C	S	.	.	H	α-helix	trans	-60.6	-47.5	171.4	-98.1	158.6	0	0	0	114.2	N240 R245 A246 C395 I430	N240-L242 CarbonylContact O-C 3.57Å; N240-L242 PolarHBondContact O-N 3.07Å; L242-R245 CarbonylContact O-C 3.36Å; L242-R245 WeakPolarHBondContact O-CB 3.32Å; L242-R245 PolarHBondContact O-N 3.43Å; L242-A246 WeakPolarHBondContact O-CB 3.33Å; L242-A246 PolarHBondContact O-N 3.29Å; L242-C395 HydrophobicContact CD1-CB 4.04Å; L242-C395 HydrophobicContact CG-CB 4.33Å; L242-I430 HydrophobicContact CD2-CG1 3.69Å
243	Q	41.3	Very low	40.8	Very low	90 Å²	90	55.4 Å²	55.4	42%	0.421	28%	0.283	S	S	.	.	H	α-helix	trans	-66	-41	177.4	-74.8	173.3	-18.9	0	0	111.1	T239 N240 R245 A246 V247	T239-Q243 VanDerWaalsContact CA-OE1 3.27Å; T239-Q243 HydrophobicContact CG2-CB 4.03Å; N240-Q243 WeakPolarHBondContact O-CA 3.24Å; N240-Q243 WeakPolarHBondContact O-CB 3.46Å; N240-Q243 PolarHBondContact O-N 3.31Å; Q243-R245 VanDerWaalsContact C-N 3.32Å; Q243-R245 PolarHBondContact O-N 2.88Å; Q243-A246 WeakPolarHBondContact O-CB 3.03Å; Q243-A246 PolarHBondContact O-N 3Å; Q243-A246 VanDerWaalsContact O-N 3.15Å; Q243-V247 WeakPolarHBondContact O-CG2 3.37Å; Q243-V247 PolarHBondContact O-N 2.9Å
244	R	44	Very low	41.1	Very low	31 Å²	31	62.3 Å²	62.3	12%	0.117	31%	0.305	C	S	.	.	H	α-helix	trans	-55.6	-49.3	171.7	-73.5	-167	-82.3	-103.7	-1.5	110.9	V237 T239 N240 A241 A246 V247 I248	V237-R244 PolarHBondContact O-NH1 2.91Å; T239-R244 PolarHBondContact O-NH1 3.49Å; T239-R244 WeakPolarHBondContact OG1-CG 3.12Å; N240-R244 PolarHBondContact O-N 2.96Å; A241-R244 PolarHBondContact O-N 3.38Å; R244-A246 PolarHBondContact O-N 3.36Å; R244-V247 PolarHBondContact O-N 3.37Å; R244-I248 WeakPolarHBondContact O-CD1 3.27Å; R244-I248 VanDerWaalsContact O-CG1 3.24Å; R244-I248 WeakPolarHBondContact O-CG1 3.37Å; R244-I248 PolarHBondContact O-N 2.96Å
245	R	41.1	Very low	41.6	Very low	32 Å²	32	62.1 Å²	62.1	12%	0.121	31%	0.305	C	S	.	.	H	α-helix	trans	-57.4	-46.7	173.8	-82.7	-179.3	172.8	178.5	0.3	112	A241 L242 Q243 V247 I248 F249 F392 C395	A241-R245 WeakPolarHBondContact O-CB 3.18Å; A241-R245 PolarHBondContact O-N 2.98Å; L242-R245 CarbonylContact O-C 3.36Å; L242-R245 WeakPolarHBondContact O-CB 3.32Å; L242-R245 PolarHBondContact O-N 3.43Å; Q243-R245 VanDerWaalsContact C-N 3.32Å; Q243-R245 PolarHBondContact O-N 2.88Å; R245-V247 VanDerWaalsContact C-N 3.3Å; R245-V247 PolarHBondContact O-N 2.88Å; R245-I248 CarbonylContact O-C 3.54Å; R245-I248 PolarHBondContact O-N 3.44Å; R245-I248 VanDerWaalsContact O-N 3.09Å; R245-F249 HydrophobicContact CB-CD2 3.98Å; R245-F249 HydrophobicContact CB-CE2 3.96Å; R245-F249 HydrophobicContact CG-CE2 4.15Å; R245-F249 WeakPolarHBondContact O-CB 3.37Å; R245-F249 WeakPolarHBondContact O-CD2 3.49Å; R245-F249 PolarHBondContact O-N 3.2Å; R245-F392 VanDerWaalsContact NH2-CA 3.3Å; R245-F392 PolarHBondContact NH2-O 3.14Å; R245-C395 PolarHBondContact NH1-O 3.24Å
246	A	41.1	Very low	42	Very low	18 Å²	18	62.9 Å²	62.9	15%	0.149	31%	0.312	C	S	.	.	H	α-helix	trans	-58.9	-40.6	179	0	0	0	0	0	111.9	L242 Q243 R244 F249 S250	L242-A246 WeakPolarHBondContact O-CB 3.33Å; L242-A246 PolarHBondContact O-N 3.29Å; Q243-A246 WeakPolarHBondContact O-CB 3.03Å; Q243-A246 PolarHBondContact O-N 3Å; Q243-A246 VanDerWaalsContact O-N 3.15Å; R244-A246 PolarHBondContact O-N 3.36Å; A246-F249 PolarHBondContact O-N 2.95Å; A246-S250 WeakPolarHBondContact O-CB 3.2Å; A246-S250 PolarHBondContact O-N 3.35Å; A246-S250 PolarHBondContact O-OG 2.89Å
247	V	43.2	Very low	42.6	Very low	54 Å²	54	63.3 Å²	63.3	33%	0.327	31%	0.314	S	S	.	.	H	α-helix	trans	-66.7	-40.7	175.4	-174	0	0	0	0	110.9	L234 Q243 R244 R245 S250 L251	L234-V247 HydrophobicContact CD2-CG1 3.35Å; L234-V247 HydrophobicContact CG-CG1 4.43Å; Q243-V247 WeakPolarHBondContact O-CG2 3.37Å; Q243-V247 PolarHBondContact O-N 2.9Å; R244-V247 PolarHBondContact O-N 3.37Å; R245-V247 VanDerWaalsContact C-N 3.3Å; R245-V247 PolarHBondContact O-N 2.88Å; V247-S250 WeakPolarHBondContact CA-OG 3.25Å; V247-S250 PolarHBondContact O-N 3.02Å; V247-S250 PolarHBondContact O-OG 3.48Å; V247-L251 WeakPolarHBondContact O-CG 3.24Å; V247-L251 PolarHBondContact O-N 3.42Å
248	I	44	Very low	43.3	Very low	30 Å²	30	62.4 Å²	62.4	15%	0.154	31%	0.306	C	S	.	.	H	α-helix	trans	-67.4	-38.6	176.3	-60.6	149.8	0	0	0	112.2	F235 R244 R245 L251 L388	F235-I248 HydrophobicContact CE1-CD1 3.9Å; F235-I248 HydrophobicContact CE1-CG1 4Å; F235-I248 HydrophobicContact CZ-CG1 4.3Å; R244-I248 WeakPolarHBondContact O-CD1 3.27Å; R244-I248 VanDerWaalsContact O-CG1 3.24Å; R244-I248 WeakPolarHBondContact O-CG1 3.37Å; R244-I248 PolarHBondContact O-N 2.96Å; R245-I248 CarbonylContact O-C 3.54Å; R245-I248 PolarHBondContact O-N 3.44Å; R245-I248 VanDerWaalsContact O-N 3.09Å; I248-L251 WeakPolarHBondContact O-CB 3.18Å; I248-L388 HydrophobicContact CD1-CD2 3.13Å; I248-L388 HydrophobicContact CD1-CG 4.47Å; I248-L388 HydrophobicContact CG1-CD2 4.13Å
249	F	41.2	Very low	44.2	Very low	131 Å²	131	56.4 Å²	56.4	58%	0.575	29%	0.285	S	S	*	.	H	α-helix	trans	-78.9	-27.8	178.9	-73.9	-60	0	0	0	112.3	R245 A246	R245-F249 HydrophobicContact CB-CD2 3.98Å; R245-F249 HydrophobicContact CB-CE2 3.96Å; R245-F249 HydrophobicContact CG-CE2 4.15Å; R245-F249 WeakPolarHBondContact O-CB 3.37Å; R245-F249 WeakPolarHBondContact O-CD2 3.49Å; R245-F249 PolarHBondContact O-N 3.2Å; A246-F249 PolarHBondContact O-N 2.95Å
250	S	40.5	Very low	45	Very low	93 Å²	93	56.9 Å²	56.9	65%	0.65	29%	0.286	S	S	*	.	H	α-helix	trans	-78.7	-24.3	172.8	63.9	0	0	0	0	112.5	A246 V247 S252	A246-S250 WeakPolarHBondContact O-CB 3.2Å; A246-S250 PolarHBondContact O-N 3.35Å; A246-S250 PolarHBondContact O-OG 2.89Å; V247-S250 WeakPolarHBondContact CA-OG 3.25Å; V247-S250 PolarHBondContact O-N 3.02Å; V247-S250 PolarHBondContact O-OG 3.48Å; S250-S252 PolarHBondContact O-N 2.87Å
251	L	44	Very low	45.8	Very low	31 Å²	31	55.7 Å²	55.7	16%	0.162	28%	0.282	C	S	.	.	S	Bend	trans	-59.2	122.6	160.5	-81.8	166.2	0	0	0	107.5	L234 V247 I248 R253 C255	L234-L251 HydrophobicContact CD1-CD1 4.1Å; L234-L251 HydrophobicContact CD2-CD1 3.23Å; L234-L251 HydrophobicContact CD2-CG 4Å; L234-L251 HydrophobicContact CG-CD1 4.31Å; V247-L251 WeakPolarHBondContact O-CG 3.24Å; V247-L251 PolarHBondContact O-N 3.42Å; I248-L251 WeakPolarHBondContact O-CB 3.18Å; L251-R253 PolarHBondContact O-N 3.31Å; L251-C255 HydrophobicContact CD2-CB 4.03Å
252	S	42.4	Very low	46.3	Very low	56 Å²	56	55.3 Å²	55.3	39%	0.392	28%	0.279	S	S	.	.			trans	-55.3	141.2	175.3	69.8	0	0	0	0	108.8	S250 W254 C255 C256	S250-S252 PolarHBondContact O-N 2.87Å; S252-W254 CarbonylContact O-C 3.55Å; S252-W254 PolarHBondContact O-N 2.95Å; S252-C255 WeakPolarHBondContact O-CA 3.43Å; S252-C255 WeakPolarHBondContact O-CB 3.09Å; S252-C255 PolarHBondContact O-N 3.11Å; S252-C255 PolarHBondContact OG-N 3.49Å; S252-C256 PolarHBondContact O-N 2.87Å
253	R	48.9	Very low	47.1	Very low	104 Å²	104	54.5 Å²	54.5	39%	0.392	28%	0.275	S	S	.	.	H	α-helix	trans	-46.4	-36.9	176.5	-165.5	176.1	-171.8	-178.6	3.3	111.8	L251 N257 S313	L251-R253 PolarHBondContact O-N 3.31Å; R253-N257 VanDerWaalsContact O-CB 3.27Å; R253-N257 WeakPolarHBondContact O-CB 3.35Å; R253-N257 PolarHBondContact O-N 3.35Å; R253-N257 PolarHBondContact O-ND2 2.88Å; R253-S313 PolarHBondContact NE-OG 2.85Å; R253-S313 PolarHBondContact NH2-OG 3.15Å
254	W	47.1	Very low	47.6	Very low	198 Å²	198	51.9 Å²	51.9	75%	0.75	26%	0.264	S	S	*	.	H	α-helix	trans	-57.9	-44.8	172.4	-110.4	83.3	0	0	0	113.9	S252 I258	S252-W254 CarbonylContact O-C 3.55Å; S252-W254 PolarHBondContact O-N 2.95Å; W254-I258 HydrophobicContact CE3-CD1 3.38Å; W254-I258 HydrophobicContact CE3-CG1 3.98Å; W254-I258 HydrophobicContact CZ3-CD1 3.69Å; W254-I258 HydrophobicContact CZ3-CG1 4.19Å; W254-I258 WeakPolarHBondContact O-CB 3.46Å; W254-I258 WeakPolarHBondContact O-CG1 3.1Å; W254-I258 PolarHBondContact O-N 3.15Å
255	C	50.7	Low	48	Very low	12 Å²	12	55 Å²	55	8%	0.081	28%	0.278	C	S	.	.	H	α-helix	trans	-69.5	-45.2	-179.1	-152	0	0	0	0	112.1	L251 S252 N257 I258 L259	L251-C255 HydrophobicContact CD2-CB 4.03Å; S252-C255 WeakPolarHBondContact O-CA 3.43Å; S252-C255 WeakPolarHBondContact O-CB 3.09Å; S252-C255 PolarHBondContact O-N 3.11Å; S252-C255 PolarHBondContact OG-N 3.49Å; C255-N257 VanDerWaalsContact C-N 3.35Å; C255-N257 PolarHBondContact O-N 2.78Å; C255-I258 PolarHBondContact O-N 3.16Å; C255-L259 WeakPolarHBondContact O-CB 3.43Å; C255-L259 WeakPolarHBondContact O-CG 3.3Å; C255-L259 PolarHBondContact O-N 2.81Å
256	C	50.9	Low	48.6	Very low	31 Å²	31	54.1 Å²	54.1	21%	0.209	28%	0.278	C	S	.	.	H	α-helix	trans	-59.4	-46.2	173	-83.9	0	0	0	0	111.5	S252 L259 F260	S252-C256 PolarHBondContact O-N 2.87Å; C256-L259 PolarHBondContact O-N 3Å; C256-F260 WeakPolarHBondContact O-CB 3.28Å; C256-F260 PolarHBondContact O-N 3.5Å
257	N	50.1	Low	49.3	Very low	38 Å²	38	53.5 Å²	53.5	20%	0.203	27%	0.272	C	S	.	.	H	α-helix	trans	-63.8	-42.4	178.6	-72.1	-13.5	0	0	0	111.8	R253 C255 F260 V261 W310	R253-N257 VanDerWaalsContact O-CB 3.27Å; R253-N257 WeakPolarHBondContact O-CB 3.35Å; R253-N257 PolarHBondContact O-N 3.35Å; R253-N257 PolarHBondContact O-ND2 2.88Å; C255-N257 VanDerWaalsContact C-N 3.35Å; C255-N257 PolarHBondContact O-N 2.78Å; N257-F260 PolarHBondContact O-N 3.45Å; N257-V261 VanDerWaalsContact O-CB 3.23Å; N257-V261 WeakPolarHBondContact O-CB 3.17Å; N257-V261 WeakPolarHBondContact O-CG2 3.25Å; N257-V261 PolarHBondContact O-N 3.24Å; N257-W310 VanDerWaalsContact ND2-CZ3 3.31Å; N257-W310 WeakPolarHBondContact ND2-CZ3 3.38Å
258	I	50.4	Low	49.8	Very low	55 Å²	55	53.3 Å²	53.3	28%	0.282	27%	0.271	S	S	.	.	H	α-helix	trans	-62.6	-45.6	175.5	-72.3	164.6	0	0	0	111	I188 F192 W254 C255 F260 G262	I188-I258 HydrophobicContact CG2-CG2 3.69Å; F192-I258 HydrophobicContact CE2-CG2 3.66Å; F192-I258 HydrophobicContact CZ-CG2 4.21Å; W254-I258 HydrophobicContact CE3-CD1 3.38Å; W254-I258 HydrophobicContact CE3-CG1 3.98Å; W254-I258 HydrophobicContact CZ3-CD1 3.69Å; W254-I258 HydrophobicContact CZ3-CG1 4.19Å; W254-I258 WeakPolarHBondContact O-CB 3.46Å; W254-I258 WeakPolarHBondContact O-CG1 3.1Å; W254-I258 PolarHBondContact O-N 3.15Å; C255-I258 PolarHBondContact O-N 3.16Å; I258-F260 VanDerWaalsContact C-N 3.27Å; I258-F260 PolarHBondContact O-N 2.94Å; I258-G262 VanDerWaalsContact O-CA 3.25Å; I258-G262 WeakPolarHBondContact O-CA 2.97Å; I258-G262 PolarHBondContact O-N 2.88Å
259	L	52.1	Low	50.2	Low	21 Å²	21	53.8 Å²	53.8	11%	0.11	27%	0.274	C	S	.	.	H	α-helix	trans	-60.3	-42.5	178.3	-76.8	169.7	0	0	0	110.6	I188 F227 C255 C256 N263	I188-L259 HydrophobicContact CD1-CD1 4.46Å; I188-L259 HydrophobicContact CD1-CD2 3.69Å; I188-L259 HydrophobicContact CD1-CG 3.89Å; I188-L259 HydrophobicContact CG1-CD2 3.73Å; I188-L259 HydrophobicContact CG1-CG 4.47Å; F227-L259 HydrophobicContact CE1-CD2 4.44Å; F227-L259 HydrophobicContact CE2-CD2 3.88Å; F227-L259 HydrophobicContact CZ-CD2 3.59Å; C255-L259 WeakPolarHBondContact O-CB 3.43Å; C255-L259 WeakPolarHBondContact O-CG 3.3Å; C255-L259 PolarHBondContact O-N 2.81Å; C256-L259 PolarHBondContact O-N 3Å; L259-N263 WeakPolarHBondContact O-CB 3.23Å; L259-N263 PolarHBondContact O-N 3.36Å
260	F	53.4	Low	50.7	Low	31 Å²	31	49.6 Å²	49.6	14%	0.136	26%	0.255	C	S	.	.	H	α-helix	trans	-70.9	-53.2	-178.2	-148.6	-95.6	0	0	0	112.7	C256 N257 I258 G262 N263 I264 Y302 Y305 F306 M385	C256-F260 WeakPolarHBondContact O-CB 3.28Å; C256-F260 PolarHBondContact O-N 3.5Å; N257-F260 PolarHBondContact O-N 3.45Å; I258-F260 VanDerWaalsContact C-N 3.27Å; I258-F260 PolarHBondContact O-N 2.94Å; F260-G262 VanDerWaalsContact C-N 3.32Å; F260-G262 PolarHBondContact O-N 2.88Å; F260-N263 PolarHBondContact O-N 2.84Å; F260-I264 HydrophobicContact CD1-CD1 3.72Å; F260-I264 HydrophobicContact CD1-CG1 4.38Å; F260-I264 HydrophobicContact CE1-CD1 3.69Å; F260-I264 HydrophobicContact CE1-CG1 4.29Å; F260-I264 WeakPolarHBondContact O-CG1 3.33Å; F260-I264 PolarHBondContact O-N 3.37Å; F260-Y302 AromaticContact CE1-CD1 3.97Å; F260-Y302 HydrophobicContact CE1-CD1 3.97Å; F260-Y302 AromaticContact CZ-CD1 3.69Å; F260-Y302 HydrophobicContact CZ-CD1 3.69Å; F260-Y302 AromaticContact CZ-CE1 3.91Å; F260-Y302 HydrophobicContact CZ-CE1 3.91Å; F260-Y305 HydrophobicContact CD2-CE1 4.22Å; F260-Y305 AromaticContact CE1-CD1 3.66Å; F260-Y305 HydrophobicContact CE1-CD1 3.66Å; F260-Y305 HydrophobicContact CE1-CE1 4.07Å; F260-Y305 AromaticContact CE2-CD1 3.73Å; F260-Y305 HydrophobicContact CE2-CD1 3.73Å; F260-Y305 AromaticContact CE2-CE1 3.29Å; F260-Y305 HydrophobicContact CE2-CE1 3.29Å; F260-Y305 AromaticContact CZ-CD1 3.07Å; F260-Y305 HydrophobicContact CZ-CD1 3.07Å; F260-Y305 AromaticContact CZ-CE1 3.2Å; F260-Y305 HydrophobicContact CZ-CE1 3.2Å; F260-Y305 HydrophobicContact CZ-CG 4.26Å; F260-F306 HydrophobicContact CD1-CB 4.41Å; F260-F306 AromaticContact CD1-CD2 3.85Å; F260-F306 HydrophobicContact CD1-CD2 3.85Å; F260-F306 HydrophobicContact CE1-CB 4.25Å; F260-F306 HydrophobicContact CE1-CD2 4.5Å; F260-M385 HydrophobicContact CE2-CE 3.69Å; F260-M385 HydrophobicContact CZ-CE 3.79Å
261	V	53.3	Low	51.2	Low	77 Å²	77	45.5 Å²	45.5	47%	0.467	23%	0.227	S	C	.	.	H	α-helix	trans	-64	-40.7	178.5	174.7	0	0	0	0	110.4	N257 N263 I264 F265 F306	N257-V261 VanDerWaalsContact O-CB 3.23Å; N257-V261 WeakPolarHBondContact O-CB 3.17Å; N257-V261 WeakPolarHBondContact O-CG2 3.25Å; N257-V261 PolarHBondContact O-N 3.24Å; V261-N263 VanDerWaalsContact C-N 3.33Å; V261-N263 PolarHBondContact O-N 3.47Å; V261-I264 PolarHBondContact O-N 2.7Å; V261-F265 VanDerWaalsContact O-CB 3.22Å; V261-F265 WeakPolarHBondContact O-CB 3.41Å; V261-F265 PolarHBondContact O-N 3.37Å; V261-F306 HydrophobicContact CG2-CE2 4.16Å
262	G	53.9	Low	51.7	Low	3 Å²	3	47.9 Å²	47.9	3%	0.031	24%	0.243	C	C	.	.	H	α-helix	trans	-62.1	-39.7	176.1	0	0	0	0	0	112.7	F192 I258 F260 F265 A266	F192-G262 VanDerWaalsContact CZ-CA 3.41Å; I258-G262 VanDerWaalsContact O-CA 3.25Å; I258-G262 WeakPolarHBondContact O-CA 2.97Å; I258-G262 PolarHBondContact O-N 2.88Å; F260-G262 VanDerWaalsContact C-N 3.32Å; F260-G262 PolarHBondContact O-N 2.88Å; G262-F265 PolarHBondContact O-N 3.45Å; G262-A266 VanDerWaalsContact O-CB 3.31Å; G262-A266 WeakPolarHBondContact O-CB 3.43Å; G262-A266 PolarHBondContact O-N 3.19Å
263	N	55.1	Low	52.2	Low	9 Å²	9	47.5 Å²	47.5	5%	0.048	24%	0.244	C	C	.	.	H	α-helix	trans	-69.7	-44.4	175.8	-168.6	29.6	0	0	0	112.1	F227 L259 F260 V261 F265 A266 V267 V377 V381	F227-N263 HydrophobicContact CE1-CB 4.23Å; F227-N263 HydrophobicContact CZ-CB 4.34Å; L259-N263 WeakPolarHBondContact O-CB 3.23Å; L259-N263 PolarHBondContact O-N 3.36Å; F260-N263 PolarHBondContact O-N 2.84Å; V261-N263 VanDerWaalsContact C-N 3.33Å; V261-N263 PolarHBondContact O-N 3.47Å; N263-F265 VanDerWaalsContact C-N 3.3Å; N263-F265 PolarHBondContact O-N 2.73Å; N263-A266 PolarHBondContact O-N 2.7Å; N263-V267 WeakPolarHBondContact O-CG2 3.12Å; N263-V267 PolarHBondContact O-N 3.23Å; N263-V377 WeakPolarHBondContact OD1-CG1 3.32Å; N263-V381 WeakPolarHBondContact ND2-CG2 2.99Å
264	I	52.3	Low	52.3	Low	35 Å²	35	43 Å²	43	18%	0.179	23%	0.227	C	C	.	.	H	α-helix	trans	-56.5	-48.3	172.6	-68.7	170.9	0	0	0	110	F260 V261 A266 V267 V268 Y302	F260-I264 HydrophobicContact CD1-CD1 3.72Å; F260-I264 HydrophobicContact CD1-CG1 4.38Å; F260-I264 HydrophobicContact CE1-CD1 3.69Å; F260-I264 HydrophobicContact CE1-CG1 4.29Å; F260-I264 WeakPolarHBondContact O-CG1 3.33Å; F260-I264 PolarHBondContact O-N 3.37Å; V261-I264 PolarHBondContact O-N 2.7Å; I264-A266 VanDerWaalsContact C-N 3.34Å; I264-A266 PolarHBondContact O-N 3.32Å; I264-V267 PolarHBondContact O-N 2.81Å; I264-V268 HydrophobicContact CG2-CG2 4.21Å; I264-V268 WeakPolarHBondContact O-CB 3.2Å; I264-V268 VanDerWaalsContact O-CG2 3.25Å; I264-V268 WeakPolarHBondContact O-CG2 3.1Å; I264-V268 PolarHBondContact O-N 3.38Å; I264-Y302 HydrophobicContact CD1-CD1 4.41Å; I264-Y302 HydrophobicContact CG1-CD1 4.01Å
265	F	53.4	Low	52.6	Low	95 Å²	95	35.3 Å²	35.3	42%	0.417	20%	0.202	S	C	.	.	H	α-helix	trans	-62.7	-41.3	-178.9	-171.1	-109.2	0	0	0	111.9	V261 G262 N263 V268 L269	V261-F265 VanDerWaalsContact O-CB 3.22Å; V261-F265 WeakPolarHBondContact O-CB 3.41Å; V261-F265 PolarHBondContact O-N 3.37Å; G262-F265 PolarHBondContact O-N 3.45Å; N263-F265 VanDerWaalsContact C-N 3.3Å; N263-F265 PolarHBondContact O-N 2.73Å; F265-V268 PolarHBondContact O-N 3.31Å; F265-L269 HydrophobicContact CD1-CD1 3.6Å; F265-L269 HydrophobicContact CD1-CG 4.22Å; F265-L269 HydrophobicContact CE1-CD1 3.2Å; F265-L269 HydrophobicContact CE1-CG 3.94Å; F265-L269 HydrophobicContact CE2-CD1 4.45Å; F265-L269 HydrophobicContact CE2-CG 4.33Å; F265-L269 HydrophobicContact CG-CD1 4.4Å; F265-L269 HydrophobicContact CZ-CD1 3.68Å; F265-L269 HydrophobicContact CZ-CD2 4.16Å; F265-L269 HydrophobicContact CZ-CG 3.98Å; F265-L269 WeakPolarHBondContact O-CB 3.48Å; F265-L269 WeakPolarHBondContact O-CG 3.34Å; F265-L269 PolarHBondContact O-N 2.78Å
266	A	53.6	Low	52.6	Low	15 Å²	15	39.8 Å²	39.8	12%	0.124	22%	0.223	C	C	.	.	H	α-helix	trans	-62.3	-47.5	175.5	0	0	0	0	0	111.7	F191 V195 G262 N263 I264 V268 F270	F191-A266 HydrophobicContact CE1-CB 4.23Å; F191-A266 HydrophobicContact CZ-CB 3.67Å; V195-A266 HydrophobicContact CG1-CB 4.17Å; V195-A266 HydrophobicContact CG2-CB 4.45Å; G262-A266 VanDerWaalsContact O-CB 3.31Å; G262-A266 WeakPolarHBondContact O-CB 3.43Å; G262-A266 PolarHBondContact O-N 3.19Å; N263-A266 PolarHBondContact O-N 2.7Å; I264-A266 VanDerWaalsContact C-N 3.34Å; I264-A266 PolarHBondContact O-N 3.32Å; A266-V268 PolarHBondContact O-N 2.94Å; A266-F270 WeakPolarHBondContact O-CB 3.37Å; A266-F270 PolarHBondContact O-N 3.22Å
267	V	54.1	Low	52.6	Low	4 Å²	4	39.8 Å²	39.8	2%	0.024	23%	0.225	C	C	.	.	H	α-helix	trans	-63.7	-40.9	177.5	175.2	0	0	0	0	111.3	N263 I264 F270 G271 W298 F351 L374	N263-V267 WeakPolarHBondContact O-CG2 3.12Å; N263-V267 PolarHBondContact O-N 3.23Å; I264-V267 PolarHBondContact O-N 2.81Å; V267-F270 PolarHBondContact O-N 2.76Å; V267-G271 PolarHBondContact O-N 3.15Å; V267-W298 HydrophobicContact CB-CH2 3.43Å; V267-W298 VanDerWaalsContact CB-CH2 3.43Å; V267-W298 HydrophobicContact CB-CZ2 3.86Å; V267-W298 HydrophobicContact CB-CZ3 4.06Å; V267-W298 HydrophobicContact CG1-CD2 4.39Å; V267-W298 HydrophobicContact CG1-CE3 4.2Å; V267-W298 HydrophobicContact CG1-CH2 3.31Å; V267-W298 HydrophobicContact CG1-CZ2 3.46Å; V267-W298 VanDerWaalsContact CG1-CZ2 3.46Å; V267-W298 HydrophobicContact CG1-CZ3 3.67Å; V267-W298 HydrophobicContact CG2-CH2 3.83Å; V267-W298 HydrophobicContact CG2-CZ2 3.86Å; V267-F351 HydrophobicContact CG1-CE1 3.93Å; V267-F351 HydrophobicContact CG1-CZ 4.38Å; V267-L374 HydrophobicContact CB-CD1 4.37Å; V267-L374 HydrophobicContact CG1-CD1 4.1Å; V267-L374 HydrophobicContact CG2-CD1 4.02Å
268	V	54.1	Low	52.5	Low	50 Å²	50	38 Å²	38	30%	0.303	22%	0.216	S	C	.	.	H	α-helix	trans	-63.6	-52.6	177.3	169.4	0	0	0	0	111.5	I264 F265 A266 F270 G271 V272 L299	I264-V268 HydrophobicContact CG2-CG2 4.21Å; I264-V268 WeakPolarHBondContact O-CB 3.2Å; I264-V268 VanDerWaalsContact O-CG2 3.25Å; I264-V268 WeakPolarHBondContact O-CG2 3.1Å; I264-V268 PolarHBondContact O-N 3.38Å; F265-V268 PolarHBondContact O-N 3.31Å; A266-V268 PolarHBondContact O-N 2.94Å; V268-F270 PolarHBondContact O-N 2.69Å; V268-G271 PolarHBondContact O-N 2.83Å; V268-V272 HydrophobicContact CG1-CG2 4.4Å; V268-V272 WeakPolarHBondContact O-CB 3.29Å; V268-V272 VanDerWaalsContact O-CG2 3.29Å; V268-V272 WeakPolarHBondContact O-CG2 2.96Å; V268-V272 PolarHBondContact O-N 2.53Å; V268-L299 HydrophobicContact CG2-CD2 3.65Å
269	L	52.2	Low	52.5	Low	41 Å²	41	39.3 Å²	39.3	22%	0.215	22%	0.221	C	C	.	.	H	α-helix	trans	-55.3	-38.7	177.9	-79.2	177.7	0	0	0	111.2	V195 A199 F265 A273	V195-L269 HydrophobicContact CG1-CD1 4.26Å; A199-L269 HydrophobicContact CB-CB 4.33Å; A199-L269 HydrophobicContact CB-CD1 3.84Å; A199-L269 HydrophobicContact CB-CD2 4.48Å; A199-L269 HydrophobicContact CB-CG 4.47Å; F265-L269 HydrophobicContact CD1-CD1 3.6Å; F265-L269 HydrophobicContact CD1-CG 4.22Å; F265-L269 HydrophobicContact CE1-CD1 3.2Å; F265-L269 HydrophobicContact CE1-CG 3.94Å; F265-L269 HydrophobicContact CE2-CD1 4.45Å; F265-L269 HydrophobicContact CE2-CG 4.33Å; F265-L269 HydrophobicContact CG-CD1 4.4Å; F265-L269 HydrophobicContact CZ-CD1 3.68Å; F265-L269 HydrophobicContact CZ-CD2 4.16Å; F265-L269 HydrophobicContact CZ-CG 3.98Å; F265-L269 WeakPolarHBondContact O-CB 3.48Å; F265-L269 WeakPolarHBondContact O-CG 3.34Å; F265-L269 PolarHBondContact O-N 2.78Å; L269-A273 WeakPolarHBondContact O-CB 2.93Å; L269-A273 PolarHBondContact O-N 3.27Å
270	F	52.3	Low	52.5	Low	43 Å²	43	46.6 Å²	46.6	19%	0.189	25%	0.252	C	S	.	.	H	α-helix	trans	-73.2	-44.2	-179.8	-159.1	-100.5	0	0	0	113.6	A266 V267 V268 V272 A273 Q274 L355 S370 I373 L374	A266-F270 WeakPolarHBondContact O-CB 3.37Å; A266-F270 PolarHBondContact O-N 3.22Å; V267-F270 PolarHBondContact O-N 2.76Å; V268-F270 PolarHBondContact O-N 2.69Å; F270-V272 VanDerWaalsContact C-N 3.28Å; F270-V272 PolarHBondContact O-N 2.97Å; F270-A273 PolarHBondContact O-N 3.46Å; F270-Q274 HydrophobicContact CD1-CG 4.23Å; F270-Q274 HydrophobicContact CE1-CG 4.46Å; F270-Q274 WeakPolarHBondContact O-CG 3.33Å; F270-Q274 PolarHBondContact O-N 2.79Å; F270-L355 HydrophobicContact CE1-CD2 4.31Å; F270-S370 VanDerWaalsContact CE1-C 3.41Å; F270-S370 WeakPolarHBondContact CE1-O 3.38Å; F270-S370 WeakPolarHBondContact CZ-O 2.72Å; F270-I373 HydrophobicContact CE2-CD1 4.49Å; F270-I373 HydrophobicContact CZ-CB 4.23Å; F270-I373 HydrophobicContact CZ-CG2 4.49Å; F270-L374 HydrophobicContact CD1-CB 4.49Å; F270-L374 HydrophobicContact CD1-CD1 3.81Å; F270-L374 HydrophobicContact CE1-CB 3.94Å; F270-L374 HydrophobicContact CE1-CD1 4.08Å; F270-L374 HydrophobicContact CG-CD1 4.41Å
271	G	51.2	Low	52.4	Low	6 Å²	6	49.8 Å²	49.8	6%	0.062	27%	0.268	C	S	.	.	H	α-helix	trans	-59.9	-40.9	173.9	0	0	0	0	0	111.4	V267 V268 Q274 T275	V267-G271 PolarHBondContact O-N 3.15Å; V268-G271 PolarHBondContact O-N 2.83Å; G271-Q274 PolarHBondContact O-N 3.45Å; G271-T275 WeakPolarHBondContact O-CB 3.28Å; G271-T275 PolarHBondContact O-N 3.47Å; G271-T275 PolarHBondContact O-OG1 2.96Å
272	V	55.3	Low	52.2	Low	82 Å²	82	48.8 Å²	48.8	50%	0.497	27%	0.273	S	S	.	.	H	α-helix	trans	-63.4	-47.3	172.7	172.5	0	0	0	0	110.6	V268 F270 Q274 T275 M276	V268-V272 HydrophobicContact CG1-CG2 4.4Å; V268-V272 WeakPolarHBondContact O-CB 3.29Å; V268-V272 VanDerWaalsContact O-CG2 3.29Å; V268-V272 WeakPolarHBondContact O-CG2 2.96Å; V268-V272 PolarHBondContact O-N 2.53Å; F270-V272 VanDerWaalsContact C-N 3.28Å; F270-V272 PolarHBondContact O-N 2.97Å; V272-Q274 VanDerWaalsContact C-N 3.34Å; V272-Q274 PolarHBondContact O-N 2.89Å; V272-T275 PolarHBondContact O-N 2.72Å; V272-M276 HydrophobicContact CG1-CG 4.27Å; V272-M276 WeakPolarHBondContact O-CB 3.32Å; V272-M276 WeakPolarHBondContact O-CG 3.01Å; V272-M276 PolarHBondContact O-N 3.34Å
273	A	51.7	Low	52	Low	48 Å²	48	51.9 Å²	51.9	40%	0.397	29%	0.287	S	S	.	.	H	α-helix	trans	-59.6	-42.1	179	0	0	0	0	0	112.5	L269 F270 A277	L269-A273 WeakPolarHBondContact O-CB 2.93Å; L269-A273 PolarHBondContact O-N 3.27Å; F270-A273 PolarHBondContact O-N 3.46Å; A273-A277 PolarHBondContact O-N 3.13Å
274	Q	52.4	Low	51.8	Low	10 Å²	10	56.1 Å²	56.1	5%	0.047	31%	0.307	C	S	.	.	H	α-helix	trans	-69.2	-45.2	176.1	-68.2	-52.6	-37.6	0	0	111.9	F270 G271 V272 M276 A277 V278 L355 N359 S370	F270-Q274 HydrophobicContact CD1-CG 4.23Å; F270-Q274 HydrophobicContact CE1-CG 4.46Å; F270-Q274 WeakPolarHBondContact O-CG 3.33Å; F270-Q274 PolarHBondContact O-N 2.79Å; G271-Q274 PolarHBondContact O-N 3.45Å; V272-Q274 VanDerWaalsContact C-N 3.34Å; V272-Q274 PolarHBondContact O-N 2.89Å; Q274-M276 VanDerWaalsContact C-N 3.25Å; Q274-M276 PolarHBondContact O-N 3.48Å; Q274-A277 WeakPolarHBondContact O-CA 3.45Å; Q274-A277 WeakPolarHBondContact O-CB 3.45Å; Q274-A277 PolarHBondContact O-N 3.35Å; Q274-V278 WeakPolarHBondContact O-CG2 3.28Å; Q274-V278 PolarHBondContact O-N 2.77Å; Q274-L355 HydrophobicContact CB-CD1 4.33Å; Q274-L355 HydrophobicContact CG-CD1 4.43Å; Q274-L355 HydrophobicContact CG-CD2 4.39Å; Q274-N359 PolarHBondContact OE1-OD1 3.33Å; Q274-S370 PolarHBondContact NE2-OG 2.67Å
275	T	51.5	Low	51.9	Low	36 Å²	36	59.5 Å²	59.5	22%	0.221	33%	0.33	C	S	.	.	H	α-helix	trans	-56.1	-44.5	176	-53	0	0	0	0	110.9	G271 V272 A277 V278 M279 F291	G271-T275 WeakPolarHBondContact O-CB 3.28Å; G271-T275 PolarHBondContact O-N 3.47Å; G271-T275 PolarHBondContact O-OG1 2.96Å; V272-T275 PolarHBondContact O-N 2.72Å; T275-A277 VanDerWaalsContact C-N 3.31Å; T275-A277 PolarHBondContact O-N 3.23Å; T275-V278 PolarHBondContact O-N 2.88Å; T275-M279 HydrophobicContact CG2-CG 4.37Å; T275-M279 HydrophobicContact CG2-SD 4.28Å; T275-M279 WeakPolarHBondContact O-CB 3.34Å; T275-M279 VanDerWaalsContact O-CG 3.3Å; T275-M279 WeakPolarHBondContact O-CG 3.42Å; T275-M279 PolarHBondContact O-N 3.48Å; T275-F291 VanDerWaalsContact OG1-CD1 3.3Å; T275-F291 WeakPolarHBondContact OG1-CD1 3.22Å; T275-F291 WeakPolarHBondContact OG1-CE1 3.3Å
276	M	51	Low	51.6	Low	105 Å²	105	57.4 Å²	57.4	52%	0.517	33%	0.325	S	S	.	.	H	α-helix	trans	-64.7	-33.1	176.8	-70.7	-62.2	-65.7	0	0	112.8	V272 Q274 K280	V272-M276 HydrophobicContact CG1-CG 4.27Å; V272-M276 WeakPolarHBondContact O-CB 3.32Å; V272-M276 WeakPolarHBondContact O-CG 3.01Å; V272-M276 PolarHBondContact O-N 3.34Å; Q274-M276 VanDerWaalsContact C-N 3.25Å; Q274-M276 PolarHBondContact O-N 3.48Å; M276-K280 PolarHBondContact O-N 3.27Å
277	A	50.8	Low	51.5	Low	31 Å²	31	56.9 Å²	56.9	26%	0.256	32%	0.32	S	S	.	.	H	α-helix	trans	-67.2	-42.8	174	0	0	0	0	0	111.6	A273 Q274 T275 K280	A273-A277 PolarHBondContact O-N 3.13Å; Q274-A277 WeakPolarHBondContact O-CA 3.45Å; Q274-A277 WeakPolarHBondContact O-CB 3.45Å; Q274-A277 PolarHBondContact O-N 3.35Å; T275-A277 VanDerWaalsContact C-N 3.31Å; T275-A277 PolarHBondContact O-N 3.23Å; A277-K280 PolarHBondContact O-N 3.31Å
278	V	48	Very low	51.5	Low	2 Å²	2	60.8 Å²	60.8	1%	0.012	34%	0.344	C	S	.	.	H	α-helix	trans	-67.8	-44.9	178.8	-173.8	0	0	0	0	111.6	Q274 T275 K280 Q281 G282 E283 A287 I358 I362	Q274-V278 WeakPolarHBondContact O-CG2 3.28Å; Q274-V278 PolarHBondContact O-N 2.77Å; T275-V278 PolarHBondContact O-N 2.88Å; V278-K280 PolarHBondContact O-N 3.22Å; V278-Q281 PolarHBondContact O-N 2.81Å; V278-G282 PolarHBondContact O-N 3.42Å; V278-E283 HydrophobicContact CG1-CB 4.09Å; V278-A287 HydrophobicContact CB-CB 4.22Å; V278-A287 HydrophobicContact CG1-CB 3.74Å; V278-I358 HydrophobicContact CB-CG2 4.24Å; V278-I358 HydrophobicContact CG1-CG2 4.11Å; V278-I358 HydrophobicContact CG2-CG2 3.1Å; V278-I362 HydrophobicContact CB-CD1 4.17Å; V278-I362 HydrophobicContact CG2-CD1 3.34Å; V278-I362 HydrophobicContact CG2-CG1 4.39Å
279	M	51.1	Low	51.6	Low	81 Å²	81	62.3 Å²	62.3	40%	0.399	36%	0.357	S	S	.	.	H	α-helix	trans	-58.4	-33.6	178.6	-73.1	-174	83.9	0	0	111.9	T275 Q281 G282 M284	T275-M279 HydrophobicContact CG2-CG 4.37Å; T275-M279 HydrophobicContact CG2-SD 4.28Å; T275-M279 WeakPolarHBondContact O-CB 3.34Å; T275-M279 VanDerWaalsContact O-CG 3.3Å; T275-M279 WeakPolarHBondContact O-CG 3.42Å; T275-M279 PolarHBondContact O-N 3.48Å; M279-Q281 VanDerWaalsContact C-N 3.27Å; M279-Q281 PolarHBondContact O-N 2.82Å; M279-G282 PolarHBondContact O-N 3.35Å; M279-M284 HydrophobicContact CB-SD 4.31Å; M279-M284 HydrophobicContact CE-CE 3.99Å; M279-M284 HydrophobicContact CE-SD 3.5Å; M279-M284 VanDerWaalsContact CE-SD 3.5Å; M279-M284 HydrophobicContact CG-SD 4.02Å
280	K	51.5	Low	51.8	Low	175 Å²	175	64.4 Å²	64.4	76%	0.761	37%	0.367	S	S	*	.	H	α-helix	trans	-68.1	-23.4	175.2	-81.2	-174.2	175.6	-173.7	0	114	M276 A277 V278	M276-K280 PolarHBondContact O-N 3.27Å; A277-K280 PolarHBondContact O-N 3.31Å; V278-K280 PolarHBondContact O-N 3.22Å
281	Q	51.4	Low	51.9	Low	98 Å²	98	63.2 Å²	63.2	46%	0.458	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	1.6	179.4	-67.6	-167.7	-9	0	0	113.7	V278 M279 E283 I362	V278-Q281 PolarHBondContact O-N 2.81Å; M279-Q281 VanDerWaalsContact C-N 3.27Å; M279-Q281 PolarHBondContact O-N 2.82Å; Q281-E283 VanDerWaalsContact C-N 3.34Å; Q281-E283 PolarHBondContact O-N 3.31Å; Q281-I362 VanDerWaalsContact CD-CG2 3.5Å; Q281-I362 VanDerWaalsContact NE2-CG2 3.26Å
282	G	50.3	Low	52.4	Low	56 Å²	56	65.1 Å²	65.1	58%	0.577	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.2	0.8	173.1	0	0	0	0	0	115.3	V278 M279 M284	V278-G282 PolarHBondContact O-N 3.42Å; M279-G282 PolarHBondContact O-N 3.35Å; G282-M284 PolarHBondContact O-N 3.27Å
283	E	49.6	Very low	52.7	Low	68 Å²	68	64.6 Å²	64.6	32%	0.318	38%	0.376	S	S	.	.			trans	-82.8	51.8	175.1	-65.2	-164.3	162.5	0	0	112.6	V278 Q281 T285 V286 A287 S361	V278-E283 HydrophobicContact CG1-CB 4.09Å; Q281-E283 VanDerWaalsContact C-N 3.34Å; Q281-E283 PolarHBondContact O-N 3.31Å; E283-T285 VanDerWaalsContact C-N 3.27Å; E283-T285 PolarHBondContact O-N 2.88Å; E283-V286 PolarHBondContact O-N 3.09Å; E283-A287 PolarHBondContact O-N 2.94Å; E283-S361 WeakPolarHBondContact OE2-CB 3.45Å; E283-S361 PolarHBondContact OE2-OG 2.93Å
284	M	50.7	Low	53.2	Low	98 Å²	98	63.6 Å²	63.6	48%	0.483	36%	0.364	S	S	.	.	H	α-helix	trans	-59.1	-36.1	-175.4	-68.6	-87.3	-102.7	0	0	112.7	M279 G282 V288	M279-M284 HydrophobicContact CB-SD 4.31Å; M279-M284 HydrophobicContact CE-CE 3.99Å; M279-M284 HydrophobicContact CE-SD 3.5Å; M279-M284 VanDerWaalsContact CE-SD 3.5Å; M279-M284 HydrophobicContact CG-SD 4.02Å; G282-M284 PolarHBondContact O-N 3.27Å; M284-V288 WeakPolarHBondContact O-CB 3.32Å; M284-V288 VanDerWaalsContact O-CG2 3.26Å; M284-V288 WeakPolarHBondContact O-CG2 3.29Å; M284-V288 PolarHBondContact O-N 3.35Å
285	T	52.8	Low	53.6	Low	105 Å²	105	63.7 Å²	63.7	64%	0.644	37%	0.368	S	S	*	.	H	α-helix	trans	-66.7	-45.7	-177.4	33	0	0	0	0	112.4	E283 S289	E283-T285 VanDerWaalsContact C-N 3.27Å; E283-T285 PolarHBondContact O-N 2.88Å; T285-S289 WeakPolarHBondContact O-CB 3.3Å; T285-S289 PolarHBondContact O-N 2.67Å; T285-S289 PolarHBondContact O-OG 2.74Å
286	V	49	Very low	54.2	Low	52 Å²	52	66.6 Å²	66.6	32%	0.315	39%	0.385	S	S	.	.	H	α-helix	trans	-68.7	-43.3	-179.6	-174	0	0	0	0	110.6	E283 I290 I358	E283-V286 PolarHBondContact O-N 3.09Å; V286-I290 HydrophobicContact CG1-CD1 4.21Å; V286-I290 PolarHBondContact O-N 3.26Å; V286-I358 HydrophobicContact CG1-CG1 3.85Å
287	A	51.3	Low	54.8	Low	4 Å²	4	65.5 Å²	65.5	3%	0.033	38%	0.381	C	S	.	.	I	π-helix	trans	-60.1	-49.2	176.1	0	0	0	0	0	112	V278 E283 F291 A292	V278-A287 HydrophobicContact CB-CB 4.22Å; V278-A287 HydrophobicContact CG1-CB 3.74Å; E283-A287 PolarHBondContact O-N 2.94Å; A287-F291 WeakPolarHBondContact O-CB 3.46Å; A287-F291 PolarHBondContact O-N 3.29Å; A287-A292 PolarHBondContact O-N 2.74Å
288	V	54.4	Low	55.5	Low	85 Å²	85	64.2 Å²	64.2	52%	0.515	37%	0.369	S	S	.	.	I	π-helix	trans	-78.2	-40.3	-174.5	177.7	0	0	0	0	111.9	M284 A292 P293	M284-V288 WeakPolarHBondContact O-CB 3.32Å; M284-V288 VanDerWaalsContact O-CG2 3.26Å; M284-V288 WeakPolarHBondContact O-CG2 3.29Å; M284-V288 PolarHBondContact O-N 3.35Å; V288-A292 WeakPolarHBondContact O-CB 3.25Å; V288-P293 VanDerWaalsContact O-CD 3.32Å; V288-P293 WeakPolarHBondContact O-CD 3.44Å
289	S	55.9	Low	56.3	Low	82 Å²	82	67.8 Å²	67.8	57%	0.573	39%	0.388	S	S	*	.	I	π-helix	trans	-78.9	-27.3	-172.8	-58.4	0	0	0	0	114.1	T285 P293	T285-S289 WeakPolarHBondContact O-CB 3.3Å; T285-S289 PolarHBondContact O-N 2.67Å; T285-S289 PolarHBondContact O-OG 2.74Å; S289-P293 WeakPolarHBondContact O-CG 3.4Å
290	I	55.2	Low	57	Low	86 Å²	86	69.7 Å²	69.7	44%	0.441	40%	0.395	S	S	.	.	I	π-helix	trans	-110.3	-50.3	-177	-55.7	-179.8	0	0	0	110.7	V286 P293 V294	V286-I290 HydrophobicContact CG1-CD1 4.21Å; V286-I290 PolarHBondContact O-N 3.26Å; I290-P293 WeakPolarHBondContact O-CD 3.43Å; I290-V294 WeakPolarHBondContact O-CG2 3.35Å; I290-V294 PolarHBondContact O-N 3.01Å
291	F	55.7	Low	57.5	Low	18 Å²	18	62.1 Å²	62.1	8%	0.079	36%	0.362	C	S	.	.	I	π-helix	trans	-73.2	-45.1	-173.1	-173.7	-104.3	0	0	0	113.4	T275 A287 V294 G295 F351 L355 I358	T275-F291 VanDerWaalsContact OG1-CD1 3.3Å; T275-F291 WeakPolarHBondContact OG1-CD1 3.22Å; T275-F291 WeakPolarHBondContact OG1-CE1 3.3Å; A287-F291 WeakPolarHBondContact O-CB 3.46Å; A287-F291 PolarHBondContact O-N 3.29Å; F291-V294 PolarHBondContact O-N 2.89Å; F291-G295 PolarHBondContact O-N 3.33Å; F291-F351 HydrophobicContact CD2-CE2 4.06Å; F291-F351 HydrophobicContact CE1-CE2 4.43Å; F291-F351 AromaticContact CE2-CD2 3.94Å; F291-F351 HydrophobicContact CE2-CD2 3.94Å; F291-F351 HydrophobicContact CE2-CE1 4.41Å; F291-F351 AromaticContact CE2-CE2 3.15Å; F291-F351 HydrophobicContact CE2-CE2 3.15Å; F291-F351 AromaticContact CE2-CZ 3.46Å; F291-F351 HydrophobicContact CE2-CZ 3.46Å; F291-F351 VanDerWaalsContact CE2-CZ 3.46Å; F291-F351 AromaticContact CZ-CE2 3.41Å; F291-F351 HydrophobicContact CZ-CE2 3.41Å; F291-F351 VanDerWaalsContact CZ-CE2 3.41Å; F291-F351 AromaticContact CZ-CZ 3.49Å; F291-F351 HydrophobicContact CZ-CZ 3.49Å; F291-F351 VanDerWaalsContact CZ-CZ 3.49Å; F291-L355 HydrophobicContact CD2-CD1 4.05Å; F291-L355 HydrophobicContact CE2-CD1 3.23Å; F291-L355 HydrophobicContact CZ-CD1 3.81Å; F291-I358 HydrophobicContact CB-CD1 3.49Å; F291-I358 VanDerWaalsContact CB-CD1 3.49Å; F291-I358 HydrophobicContact CD2-CD1 4.17Å; F291-I358 HydrophobicContact CG-CD1 4.12Å
292	A	61.4	Low	58	Low	45 Å²	45	57.9 Å²	57.9	37%	0.372	34%	0.342	S	S	.	.	H	α-helix	trans	-60.6	-45.5	-177.7	0	0	0	0	0	112.4	A287 V288 V296	A287-A292 PolarHBondContact O-N 2.74Å; V288-A292 WeakPolarHBondContact O-CB 3.25Å; A292-V296 WeakPolarHBondContact O-CB 3.34Å; A292-V296 WeakPolarHBondContact O-CG2 3.03Å; A292-V296 PolarHBondContact O-N 2.9Å
293	P	61.7	Low	58.5	Low	72 Å²	72	58.2 Å²	58.2	47%	0.468	34%	0.335	S	S	.	.	H	α-helix	trans	-62.5	-44.9	175.7	-24.5	34.6	0	0	0	113.2	V288 S289 I290 V296 L297	V288-P293 VanDerWaalsContact O-CD 3.32Å; V288-P293 WeakPolarHBondContact O-CD 3.44Å; S289-P293 WeakPolarHBondContact O-CG 3.4Å; I290-P293 WeakPolarHBondContact O-CD 3.43Å; P293-V296 PolarHBondContact O-N 3.44Å; P293-L297 WeakPolarHBondContact O-CB 3.09Å; P293-L297 PolarHBondContact O-N 2.99Å
294	V	60.7	Low	59.1	Low	27 Å²	27	57.7 Å²	57.7	16%	0.164	34%	0.335	C	S	.	.	H	α-helix	trans	-68.7	-39.7	-178.7	-179.1	0	0	0	0	110.8	I290 F291 L297 W298 L350 F351	I290-V294 WeakPolarHBondContact O-CG2 3.35Å; I290-V294 PolarHBondContact O-N 3.01Å; F291-V294 PolarHBondContact O-N 2.89Å; V294-L297 PolarHBondContact O-N 3.37Å; V294-W298 VanDerWaalsContact O-CB 3.28Å; V294-W298 WeakPolarHBondContact O-CB 3.49Å; V294-W298 PolarHBondContact O-N 3.28Å; V294-L350 HydrophobicContact CG1-CB 4.34Å; V294-F351 HydrophobicContact CG1-CB 3.93Å; V294-F351 HydrophobicContact CG1-CD2 4.12Å
295	G	61.1	Low	59.4	Low	11 Å²	11	53.3 Å²	53.3	11%	0.113	31%	0.313	C	S	.	.	H	α-helix	trans	-66.3	-39	175	0	0	0	0	0	113.3	F291 W298 L299	F291-G295 PolarHBondContact O-N 3.33Å; G295-W298 PolarHBondContact O-N 2.91Å; G295-L299 WeakPolarHBondContact O-CB 3.15Å; G295-L299 WeakPolarHBondContact O-CG 3.31Å; G295-L299 PolarHBondContact O-N 3.34Å
296	V	64.5	Low	59.7	Low	97 Å²	97	51 Å²	51	59%	0.588	29%	0.294	S	S	*	.	H	α-helix	trans	-65.9	-43	173	169.9	0	0	0	0	110.8	A292 P293 W298 L299 F300	A292-V296 WeakPolarHBondContact O-CB 3.34Å; A292-V296 WeakPolarHBondContact O-CG2 3.03Å; A292-V296 PolarHBondContact O-N 2.9Å; P293-V296 PolarHBondContact O-N 3.44Å; V296-W298 VanDerWaalsContact C-N 3.33Å; V296-W298 PolarHBondContact O-N 3.11Å; V296-L299 PolarHBondContact O-N 3.43Å; V296-F300 VanDerWaalsContact O-CB 3.31Å; V296-F300 WeakPolarHBondContact O-CB 3.21Å; V296-F300 PolarHBondContact O-N 2.93Å
297	L	64.7	Low	60.1	Low	82 Å²	82	57 Å²	57	43%	0.429	31%	0.311	S	S	.	.	H	α-helix	trans	-62	-42.6	175.7	-176.3	65.5	0	0	0	111.4	P293 V294 F300 L301 V347	P293-L297 WeakPolarHBondContact O-CB 3.09Å; P293-L297 PolarHBondContact O-N 2.99Å; V294-L297 PolarHBondContact O-N 3.37Å; L297-F300 PolarHBondContact O-N 3.23Å; L297-L301 HydrophobicContact CG-CD1 4.37Å; L297-L301 WeakPolarHBondContact O-CG 3.13Å; L297-L301 PolarHBondContact O-N 3.39Å; L297-V347 HydrophobicContact CD2-CG1 4.21Å; L297-V347 HydrophobicContact CD2-CG2 3.91Å; L297-V347 HydrophobicContact CG-CG1 4.15Å; L297-V347 HydrophobicContact CG-CG2 4.31Å
298	W	63.5	Low	60.3	Low	4 Å²	4	57 Å²	57	2%	0.015	31%	0.311	C	S	.	.	H	α-helix	trans	-59.8	-50.3	175.3	-175.1	100.1	0	0	0	111.1	V267 V294 G295 V296 F300 L301 Y302 V347 F351 E378	V267-W298 HydrophobicContact CB-CH2 3.43Å; V267-W298 VanDerWaalsContact CB-CH2 3.43Å; V267-W298 HydrophobicContact CB-CZ2 3.86Å; V267-W298 HydrophobicContact CB-CZ3 4.06Å; V267-W298 HydrophobicContact CG1-CD2 4.39Å; V267-W298 HydrophobicContact CG1-CE3 4.2Å; V267-W298 HydrophobicContact CG1-CH2 3.31Å; V267-W298 HydrophobicContact CG1-CZ2 3.46Å; V267-W298 VanDerWaalsContact CG1-CZ2 3.46Å; V267-W298 HydrophobicContact CG1-CZ3 3.67Å; V267-W298 HydrophobicContact CG2-CH2 3.83Å; V267-W298 HydrophobicContact CG2-CZ2 3.86Å; V294-W298 VanDerWaalsContact O-CB 3.28Å; V294-W298 WeakPolarHBondContact O-CB 3.49Å; V294-W298 PolarHBondContact O-N 3.28Å; G295-W298 PolarHBondContact O-N 2.91Å; V296-W298 VanDerWaalsContact C-N 3.33Å; V296-W298 PolarHBondContact O-N 3.11Å; W298-F300 VanDerWaalsContact C-N 3.32Å; W298-F300 PolarHBondContact O-N 3.49Å; W298-L301 PolarHBondContact O-N 3.28Å; W298-Y302 AromaticContact CD2-CD2 3.78Å; W298-Y302 HydrophobicContact CD2-CD2 3.78Å; W298-Y302 HydrophobicContact CD2-CE2 4.03Å; W298-Y302 AromaticContact CE2-CD2 3.5Å; W298-Y302 VanDerWaalsContact CE2-CD2 3.5Å; W298-Y302 AromaticContact CE2-CE2 3.28Å; W298-Y302 HydrophobicContact CE3-CD2 4.22Å; W298-Y302 HydrophobicContact CG-CD2 4.27Å; W298-Y302 HydrophobicContact CG-CE2 4.45Å; W298-Y302 HydrophobicContact CH2-CD1 4.34Å; W298-Y302 HydrophobicContact CH2-CD2 4.03Å; W298-Y302 HydrophobicContact CH2-CE1 4.46Å; W298-Y302 HydrophobicContact CH2-CE2 4.17Å; W298-Y302 HydrophobicContact CH2-CG 4.11Å; W298-Y302 HydrophobicContact CZ2-CD1 4.36Å; W298-Y302 AromaticContact CZ2-CD2 3.62Å; W298-Y302 HydrophobicContact CZ2-CD2 3.62Å; W298-Y302 HydrophobicContact CZ2-CE1 4.13Å; W298-Y302 AromaticContact CZ2-CE2 3.35Å; W298-Y302 HydrophobicContact CZ2-CE2 3.35Å; W298-Y302 HydrophobicContact CZ2-CG 4.12Å; W298-Y302 AromaticContact CZ2-CZ 3.62Å; W298-Y302 HydrophobicContact CZ3-CD2 4.34Å; W298-Y302 HydrophobicContact CZ3-CG 4.41Å; W298-Y302 AromaticContact NE1-CD2 3.97Å; W298-Y302 AromaticContact NE1-CE2 3.45Å; W298-Y302 WeakPolarHBondContact O-CD2 3.08Å; W298-Y302 PolarHBondContact O-N 3.43Å; W298-V347 HydrophobicContact CB-CG1 4.04Å; W298-F351 HydrophobicContact CB-CD2 4.29Å; W298-F351 AromaticContact CD1-CG 3.97Å; W298-F351 HydrophobicContact CG-CB 4.44Å; W298-F351 HydrophobicContact CG-CD2 4.44Å; W298-F351 HydrophobicContact CG-CG 4.28Å; W298-E378 PolarHBondContact NE1-OE1 2.85Å
299	L	64.9	Low	60.2	Low	77 Å²	77	55.1 Å²	55.1	40%	0.403	30%	0.298	S	S	.	.	H	α-helix	trans	-59.1	-42.5	176.2	-84.1	171.8	0	0	0	112.5	V268 G295 V296 S303	V268-L299 HydrophobicContact CG2-CD2 3.65Å; G295-L299 WeakPolarHBondContact O-CB 3.15Å; G295-L299 WeakPolarHBondContact O-CG 3.31Å; G295-L299 PolarHBondContact O-N 3.34Å; V296-L299 PolarHBondContact O-N 3.43Å; L299-S303 VanDerWaalsContact O-CB 3.32Å; L299-S303 WeakPolarHBondContact O-CB 3.18Å; L299-S303 PolarHBondContact O-N 2.83Å
300	F	66.6	Low	59.9	Low	122 Å²	122	56.7 Å²	56.7	54%	0.535	29%	0.291	S	S	.	.	H	α-helix	trans	-63	-47.7	178.7	178.8	-106.7	0	0	0	111.6	V296 L297 W298 S303 L304	V296-F300 VanDerWaalsContact O-CB 3.31Å; V296-F300 WeakPolarHBondContact O-CB 3.21Å; V296-F300 PolarHBondContact O-N 2.93Å; L297-F300 PolarHBondContact O-N 3.23Å; W298-F300 VanDerWaalsContact C-N 3.32Å; W298-F300 PolarHBondContact O-N 3.49Å; F300-S303 WeakPolarHBondContact O-CB 3.39Å; F300-S303 PolarHBondContact O-N 3.44Å; F300-L304 HydrophobicContact CD1-CD1 3.94Å; F300-L304 HydrophobicContact CE1-CD1 3.4Å; F300-L304 HydrophobicContact CE1-CG 4.18Å; F300-L304 HydrophobicContact CE2-CD1 4.42Å; F300-L304 HydrophobicContact CE2-CG 4.4Å; F300-L304 HydrophobicContact CZ-CD1 3.67Å; F300-L304 HydrophobicContact CZ-CD2 4.35Å; F300-L304 HydrophobicContact CZ-CG 4.11Å; F300-L304 WeakPolarHBondContact O-CG 3.06Å; F300-L304 PolarHBondContact O-N 2.88Å
301	L	61.5	Low	59.6	Low	16 Å²	16	55.1 Å²	55.1	8%	0.084	29%	0.288	C	S	.	.	H	α-helix	trans	-64.7	-42.1	177.9	-74.6	173.6	0	0	0	112.3	L297 W298 S303 L304 Y305 M343 V347	L297-L301 HydrophobicContact CG-CD1 4.37Å; L297-L301 WeakPolarHBondContact O-CG 3.13Å; L297-L301 PolarHBondContact O-N 3.39Å; W298-L301 PolarHBondContact O-N 3.28Å; L301-S303 VanDerWaalsContact C-N 3.3Å; L301-S303 PolarHBondContact O-N 3.48Å; L301-L304 PolarHBondContact O-N 2.82Å; L301-Y305 VanDerWaalsContact O-CB 3.3Å; L301-Y305 WeakPolarHBondContact O-CB 3.48Å; L301-Y305 PolarHBondContact O-N 3.4Å; L301-M343 HydrophobicContact CD1-CB 4.17Å; L301-M343 HydrophobicContact CD2-CB 4.35Å; L301-V347 HydrophobicContact CD1-CB 3.66Å; L301-V347 HydrophobicContact CD1-CG1 3.97Å; L301-V347 HydrophobicContact CD1-CG2 3.36Å
302	Y	62	Low	59.2	Low	8 Å²	8	56.2 Å²	56.2	3%	0.031	29%	0.294	C	S	.	.	H	α-helix	trans	-65.4	-32.7	175	-93.2	-96.5	0	0	0	112.6	F260 I264 W298 Y305 F306 C348 V381 M385	F260-Y302 AromaticContact CE1-CD1 3.97Å; F260-Y302 HydrophobicContact CE1-CD1 3.97Å; F260-Y302 AromaticContact CZ-CD1 3.69Å; F260-Y302 HydrophobicContact CZ-CD1 3.69Å; F260-Y302 AromaticContact CZ-CE1 3.91Å; F260-Y302 HydrophobicContact CZ-CE1 3.91Å; I264-Y302 HydrophobicContact CD1-CD1 4.41Å; I264-Y302 HydrophobicContact CG1-CD1 4.01Å; W298-Y302 AromaticContact CD2-CD2 3.78Å; W298-Y302 HydrophobicContact CD2-CD2 3.78Å; W298-Y302 HydrophobicContact CD2-CE2 4.03Å; W298-Y302 AromaticContact CE2-CD2 3.5Å; W298-Y302 VanDerWaalsContact CE2-CD2 3.5Å; W298-Y302 AromaticContact CE2-CE2 3.28Å; W298-Y302 HydrophobicContact CE3-CD2 4.22Å; W298-Y302 HydrophobicContact CG-CD2 4.27Å; W298-Y302 HydrophobicContact CG-CE2 4.45Å; W298-Y302 HydrophobicContact CH2-CD1 4.34Å; W298-Y302 HydrophobicContact CH2-CD2 4.03Å; W298-Y302 HydrophobicContact CH2-CE1 4.46Å; W298-Y302 HydrophobicContact CH2-CE2 4.17Å; W298-Y302 HydrophobicContact CH2-CG 4.11Å; W298-Y302 HydrophobicContact CZ2-CD1 4.36Å; W298-Y302 AromaticContact CZ2-CD2 3.62Å; W298-Y302 HydrophobicContact CZ2-CD2 3.62Å; W298-Y302 HydrophobicContact CZ2-CE1 4.13Å; W298-Y302 AromaticContact CZ2-CE2 3.35Å; W298-Y302 HydrophobicContact CZ2-CE2 3.35Å; W298-Y302 HydrophobicContact CZ2-CG 4.12Å; W298-Y302 AromaticContact CZ2-CZ 3.62Å; W298-Y302 HydrophobicContact CZ3-CD2 4.34Å; W298-Y302 HydrophobicContact CZ3-CG 4.41Å; W298-Y302 AromaticContact NE1-CD2 3.97Å; W298-Y302 AromaticContact NE1-CE2 3.45Å; W298-Y302 WeakPolarHBondContact O-CD2 3.08Å; W298-Y302 PolarHBondContact O-N 3.43Å; Y302-Y305 PolarHBondContact O-N 3.25Å; Y302-F306 WeakPolarHBondContact O-CB 3.46Å; Y302-F306 PolarHBondContact O-N 3Å; Y302-C348 PolarHBondContact OH-SG 3.45Å; Y302-V381 HydrophobicContact CE1-CG1 4.29Å; Y302-V381 WeakPolarHBondContact OH-CG1 3.34Å; Y302-M385 HydrophobicContact CE1-CE 4.22Å
303	S	61.9	Low	58.3	Low	63 Å²	63	56 Å²	56	44%	0.441	29%	0.29	S	S	.	.	H	α-helix	trans	-68.4	-44.9	173.6	-172.4	0	0	0	0	112.2	L299 F300 L301 Y305 F306 R307	L299-S303 VanDerWaalsContact O-CB 3.32Å; L299-S303 WeakPolarHBondContact O-CB 3.18Å; L299-S303 PolarHBondContact O-N 2.83Å; F300-S303 WeakPolarHBondContact O-CB 3.39Å; F300-S303 PolarHBondContact O-N 3.44Å; L301-S303 VanDerWaalsContact C-N 3.3Å; L301-S303 PolarHBondContact O-N 3.48Å; S303-Y305 VanDerWaalsContact C-N 3.28Å; S303-Y305 PolarHBondContact O-N 3.37Å; S303-F306 PolarHBondContact O-N 3.36Å; S303-R307 PolarHBondContact O-N 2.96Å
304	L	60.7	Low	57.1	Low	58 Å²	58	54.8 Å²	54.8	30%	0.304	28%	0.284	S	S	.	.	H	α-helix	trans	-59.4	-42.7	172.9	-73.4	178.9	0	0	0	111.2	F300 L301 R307 A308 V340	F300-L304 HydrophobicContact CD1-CD1 3.94Å; F300-L304 HydrophobicContact CE1-CD1 3.4Å; F300-L304 HydrophobicContact CE1-CG 4.18Å; F300-L304 HydrophobicContact CE2-CD1 4.42Å; F300-L304 HydrophobicContact CE2-CG 4.4Å; F300-L304 HydrophobicContact CZ-CD1 3.67Å; F300-L304 HydrophobicContact CZ-CD2 4.35Å; F300-L304 HydrophobicContact CZ-CG 4.11Å; F300-L304 WeakPolarHBondContact O-CG 3.06Å; F300-L304 PolarHBondContact O-N 2.88Å; L301-L304 PolarHBondContact O-N 2.82Å; L304-R307 WeakPolarHBondContact O-CB 3.42Å; L304-R307 PolarHBondContact O-N 3.27Å; L304-A308 WeakPolarHBondContact O-CB 2.89Å; L304-A308 PolarHBondContact O-N 2.82Å; L304-V340 HydrophobicContact CB-CG1 4.34Å; L304-V340 HydrophobicContact CB-CG2 4.09Å; L304-V340 HydrophobicContact CD1-CG2 4.22Å
305	Y	58.7	Low	55.9	Low	5 Å²	5	58.6 Å²	58.6	2%	0.02	31%	0.309	C	S	.	.	H	α-helix	trans	-63.1	-46.2	175.8	-177.9	-90	0	0	0	111.9	F260 L301 Y302 S303 R307 A308 L309 F337 V340 M385 F389	F260-Y305 HydrophobicContact CD2-CE1 4.22Å; F260-Y305 AromaticContact CE1-CD1 3.66Å; F260-Y305 HydrophobicContact CE1-CD1 3.66Å; F260-Y305 HydrophobicContact CE1-CE1 4.07Å; F260-Y305 AromaticContact CE2-CD1 3.73Å; F260-Y305 HydrophobicContact CE2-CD1 3.73Å; F260-Y305 AromaticContact CE2-CE1 3.29Å; F260-Y305 HydrophobicContact CE2-CE1 3.29Å; F260-Y305 AromaticContact CZ-CD1 3.07Å; F260-Y305 HydrophobicContact CZ-CD1 3.07Å; F260-Y305 AromaticContact CZ-CE1 3.2Å; F260-Y305 HydrophobicContact CZ-CE1 3.2Å; F260-Y305 HydrophobicContact CZ-CG 4.26Å; L301-Y305 VanDerWaalsContact O-CB 3.3Å; L301-Y305 WeakPolarHBondContact O-CB 3.48Å; L301-Y305 PolarHBondContact O-N 3.4Å; Y302-Y305 PolarHBondContact O-N 3.25Å; S303-Y305 VanDerWaalsContact C-N 3.28Å; S303-Y305 PolarHBondContact O-N 3.37Å; Y305-R307 VanDerWaalsContact C-N 3.29Å; Y305-R307 PolarHBondContact O-N 3Å; Y305-A308 PolarHBondContact O-N 2.81Å; Y305-A308 VanDerWaalsContact O-N 3.09Å; Y305-L309 HydrophobicContact CD1-CD1 4.05Å; Y305-L309 HydrophobicContact CE1-CD1 3.17Å; Y305-L309 HydrophobicContact CE1-CG 4.44Å; Y305-L309 HydrophobicContact CE2-CD1 3.87Å; Y305-L309 PolarHBondContact O-N 3.04Å; Y305-L309 WeakPolarHBondContact OH-CD1 3.46Å; Y305-F337 HydrophobicContact CD2-CE2 4.15Å; Y305-F337 AromaticContact CE2-CE2 3.87Å; Y305-F337 HydrophobicContact CE2-CE2 3.87Å; Y305-F337 HydrophobicContact CE2-CZ 4.19Å; Y305-V340 HydrophobicContact CD2-CG1 4.41Å; Y305-M385 HydrophobicContact CD1-CE 3.74Å; Y305-M385 HydrophobicContact CD2-CE 4.19Å; Y305-M385 HydrophobicContact CE1-CE 3.25Å; Y305-M385 HydrophobicContact CE1-SD 3.88Å; Y305-M385 HydrophobicContact CE2-CE 3.8Å; Y305-M385 HydrophobicContact CE2-SD 3.91Å; Y305-M385 HydrophobicContact CG-CE 4.14Å; Y305-M385 PolarHBondContact OH-SD 2.99Å; Y305-F389 HydrophobicContact CD2-CZ 4.23Å; Y305-F389 AromaticContact CE2-CE1 3.79Å; Y305-F389 HydrophobicContact CE2-CE1 3.79Å; Y305-F389 AromaticContact CE2-CZ 3.6Å; Y305-F389 HydrophobicContact CE2-CZ 3.6Å
306	F	57.6	Low	54.7	Low	58 Å²	58	64.1 Å²	64.1	25%	0.254	34%	0.335	S	S	.	.	H	α-helix	trans	-58.5	-42.4	175.2	180	-99.3	0	0	0	111.1	F260 V261 Y302 S303 L309 W310	F260-F306 HydrophobicContact CD1-CB 4.41Å; F260-F306 AromaticContact CD1-CD2 3.85Å; F260-F306 HydrophobicContact CD1-CD2 3.85Å; F260-F306 HydrophobicContact CE1-CB 4.25Å; F260-F306 HydrophobicContact CE1-CD2 4.5Å; V261-F306 HydrophobicContact CG2-CE2 4.16Å; Y302-F306 WeakPolarHBondContact O-CB 3.46Å; Y302-F306 PolarHBondContact O-N 3Å; S303-F306 PolarHBondContact O-N 3.36Å; F306-L309 PolarHBondContact O-N 2.93Å; F306-W310 HydrophobicContact CE1-CE3 4.01Å; F306-W310 HydrophobicContact CE2-CE3 4.22Å; F306-W310 HydrophobicContact CZ-CD2 4.45Å; F306-W310 AromaticContact CZ-CE3 3.53Å; F306-W310 HydrophobicContact CZ-CE3 3.53Å; F306-W310 AromaticContact CZ-CZ3 3.92Å; F306-W310 HydrophobicContact CZ-CZ3 3.92Å; F306-W310 WeakPolarHBondContact O-CB 3.36Å; F306-W310 PolarHBondContact O-N 2.76Å
307	R	58.3	Low	53.2	Low	177 Å²	177	66.1 Å²	66.1	67%	0.668	34%	0.338	S	S	*	.	H	α-helix	trans	-61.3	-43.6	173.2	-83.1	-174.7	173.9	-175.9	-0.5	112.3	S303 L304 Y305 W310 S311	S303-R307 PolarHBondContact O-N 2.96Å; L304-R307 WeakPolarHBondContact O-CB 3.42Å; L304-R307 PolarHBondContact O-N 3.27Å; Y305-R307 VanDerWaalsContact C-N 3.29Å; Y305-R307 PolarHBondContact O-N 3Å; R307-W310 PolarHBondContact O-N 2.79Å; R307-S311 WeakPolarHBondContact O-CB 3.43Å; R307-S311 PolarHBondContact O-N 3.5Å
308	A	54.7	Low	51.5	Low	3 Å²	3	68.3 Å²	68.3	3%	0.025	36%	0.357	C	S	.	.	H	α-helix	trans	-63.3	-47.1	179.3	0	0	0	0	0	111.2	L304 Y305 S311 L312 F337	L304-A308 WeakPolarHBondContact O-CB 2.89Å; L304-A308 PolarHBondContact O-N 2.82Å; Y305-A308 PolarHBondContact O-N 2.81Å; Y305-A308 VanDerWaalsContact O-N 3.09Å; A308-S311 PolarHBondContact O-N 3.47Å; A308-L312 WeakPolarHBondContact O-CB 3.29Å; A308-L312 WeakPolarHBondContact O-CD1 3.02Å; A308-L312 WeakPolarHBondContact O-CG 3.3Å; A308-L312 PolarHBondContact O-N 3.11Å; A308-F337 HydrophobicContact CB-CD2 3.56Å; A308-F337 HydrophobicContact CB-CE2 3.97Å
309	L	52.2	Low	50.1	Low	47 Å²	47	74.9 Å²	74.9	25%	0.246	39%	0.386	C	S	.	.	H	α-helix	trans	-65.8	-39.9	176.4	-124.7	115.5	0	0	0	112.6	Y305 F306 S311 L312 S313	Y305-L309 HydrophobicContact CD1-CD1 4.05Å; Y305-L309 HydrophobicContact CE1-CD1 3.17Å; Y305-L309 HydrophobicContact CE1-CG 4.44Å; Y305-L309 HydrophobicContact CE2-CD1 3.87Å; Y305-L309 PolarHBondContact O-N 3.04Å; Y305-L309 WeakPolarHBondContact OH-CD1 3.46Å; F306-L309 PolarHBondContact O-N 2.93Å; L309-S311 VanDerWaalsContact C-N 3.32Å; L309-S311 PolarHBondContact O-N 2.8Å; L309-L312 PolarHBondContact O-N 3.3Å; L309-S313 VanDerWaalsContact O-CB 3.3Å; L309-S313 WeakPolarHBondContact O-CB 3.3Å; L309-S313 PolarHBondContact O-N 3.14Å; L309-S313 PolarHBondContact O-OG 3.22Å
310	W	51.1	Low	48.8	Very low	114 Å²	114	79.2 Å²	79.2	43%	0.432	41%	0.409	S	S	.	.	H	α-helix	trans	-60.5	-45.8	176.1	-172.5	-86.3	0	0	0	110.6	N257 F306 R307 S313 S314	N257-W310 VanDerWaalsContact ND2-CZ3 3.31Å; N257-W310 WeakPolarHBondContact ND2-CZ3 3.38Å; F306-W310 HydrophobicContact CE1-CE3 4.01Å; F306-W310 HydrophobicContact CE2-CE3 4.22Å; F306-W310 HydrophobicContact CZ-CD2 4.45Å; F306-W310 AromaticContact CZ-CE3 3.53Å; F306-W310 HydrophobicContact CZ-CE3 3.53Å; F306-W310 AromaticContact CZ-CZ3 3.92Å; F306-W310 HydrophobicContact CZ-CZ3 3.92Å; F306-W310 WeakPolarHBondContact O-CB 3.36Å; F306-W310 PolarHBondContact O-N 2.76Å; R307-W310 PolarHBondContact O-N 2.79Å; W310-S313 WeakPolarHBondContact CA-OG 3.44Å; W310-S313 PolarHBondContact O-N 2.96Å; W310-S313 PolarHBondContact O-OG 2.98Å; W310-S314 PolarHBondContact O-N 2.87Å; W310-S314 VanDerWaalsContact O-N 3.1Å; W310-S314 PolarHBondContact O-OG 2.98Å
311	S	48.2	Very low	47.3	Very low	54 Å²	54	82.8 Å²	82.8	38%	0.378	42%	0.419	S	S	.	.	H	α-helix	trans	-63.2	-41.4	175.7	-171.7	0	0	0	0	112.4	R307 A308 L309 S313 S314 Y332	R307-S311 WeakPolarHBondContact O-CB 3.43Å; R307-S311 PolarHBondContact O-N 3.5Å; A308-S311 PolarHBondContact O-N 3.47Å; L309-S311 VanDerWaalsContact C-N 3.32Å; L309-S311 PolarHBondContact O-N 2.8Å; S311-S313 VanDerWaalsContact C-N 3.26Å; S311-S313 PolarHBondContact O-N 2.97Å; S311-S314 WeakPolarHBondContact O-CB 3.49Å; S311-S314 PolarHBondContact O-N 3.41Å; S311-Y332 WeakPolarHBondContact CB-OH 3.27Å; S311-Y332 PolarHBondContact OG-OH 3.43Å
312	L	47.2	Very low	46.2	Very low	40 Å²	40	86 Å²	86	21%	0.209	43%	0.434	C	S	.	.	H	α-helix	trans	-66.1	-29.3	174.9	-80.9	154.6	0	0	0	112.4	A308 L309 L329 F337 F392	A308-L312 WeakPolarHBondContact O-CB 3.29Å; A308-L312 WeakPolarHBondContact O-CD1 3.02Å; A308-L312 WeakPolarHBondContact O-CG 3.3Å; A308-L312 PolarHBondContact O-N 3.11Å; L309-L312 PolarHBondContact O-N 3.3Å; L312-L329 HydrophobicContact CD2-CD1 4.07Å; L312-F337 HydrophobicContact CD1-CD2 4.32Å; L312-F337 HydrophobicContact CD1-CE2 4.02Å; L312-F337 HydrophobicContact CD1-CZ 4.08Å; L312-F392 HydrophobicContact CD2-CE1 4.26Å
313	S	42	Very low	45	Very low	40 Å²	40	91.1 Å²	91.1	28%	0.28	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-10.8	177.9	77	0	0	0	0	114.1	R253 L309 W310 S311	R253-S313 PolarHBondContact NE-OG 2.85Å; R253-S313 PolarHBondContact NH2-OG 3.15Å; L309-S313 VanDerWaalsContact O-CB 3.3Å; L309-S313 WeakPolarHBondContact O-CB 3.3Å; L309-S313 PolarHBondContact O-N 3.14Å; L309-S313 PolarHBondContact O-OG 3.22Å; W310-S313 WeakPolarHBondContact CA-OG 3.44Å; W310-S313 PolarHBondContact O-N 2.96Å; W310-S313 PolarHBondContact O-OG 2.98Å; S311-S313 VanDerWaalsContact C-N 3.26Å; S311-S313 PolarHBondContact O-N 2.97Å
314	S	36.4	Very low	43.7	Very low	48 Å²	48	92 Å²	92	34%	0.336	47%	0.471	S	S	.	.	S	Bend	trans	-68.1	135.4	174.5	-68.4	0	0	0	0	108.5	W310 S311 L316	W310-S314 PolarHBondContact O-N 2.87Å; W310-S314 VanDerWaalsContact O-N 3.1Å; W310-S314 PolarHBondContact O-OG 2.98Å; S311-S314 WeakPolarHBondContact O-CB 3.49Å; S311-S314 PolarHBondContact O-N 3.41Å; S314-L316 PolarHBondContact O-N 2.78Å; S314-L316 VanDerWaalsContact O-N 3.13Å
315	P	35.3	Very low	42.6	Very low	107 Å²	107	91.2 Å²	91.2	70%	0.695	47%	0.469	S	S	*	.			trans	-54.3	125.8	175.1	22.6	-30.8	0	0	0	108	E317	P315-E317 PolarHBondContact O-N 2.9Å
316	L	36.8	Very low	41.6	Very low	126 Å²	126	94.2 Å²	94.2	66%	0.66	48%	0.483	S	S	*	.			trans	-57.3	115.9	168.4	-73.1	160	0	0	0	105.3	S314 V325	S314-L316 PolarHBondContact O-N 2.78Å; S314-L316 VanDerWaalsContact O-N 3.13Å; L316-V325 HydrophobicContact CD2-CG1 4.17Å
317	E	32.4	Very low	40.8	Very low	140 Å²	140	97.9 Å²	97.9	65%	0.654	50%	0.501	S	S	*	.			trans	-55.1	138	175.3	-74.8	171.1	137.6	0	0	108.3	P315 F319	P315-E317 PolarHBondContact O-N 2.9Å; E317-F319 HydrophobicContact CB-CD2 3.35Å; E317-F319 HydrophobicContact CB-CE2 3.21Å; E317-F319 HydrophobicContact CB-CZ 4.41Å; E317-F319 HydrophobicContact CG-CE2 4.05Å; E317-F319 WeakPolarHBondContact O-CD2 3.12Å; E317-F319 PolarHBondContact O-N 3.37Å; E317-F319 WeakPolarHBondContact OE2-CE2 3.39Å
318	P	29.4	Very low	40.1	Very low	127 Å²	127	97 Å²	97	83%	0.825	50%	0.502	S	S	*	.			trans	-64.4	108.1	-178.6	25.5	-32	0	0	0	108.1
319	F	33.1	Very low	39.5	Very low	143 Å²	143	99.3 Å²	99.3	63%	0.627	51%	0.514	S	S	*	.			trans	-134.4	125	-174.2	-87.2	-67.8	0	0	0	113.9	E317 R321	E317-F319 HydrophobicContact CB-CD2 3.35Å; E317-F319 HydrophobicContact CB-CE2 3.21Å; E317-F319 HydrophobicContact CB-CZ 4.41Å; E317-F319 HydrophobicContact CG-CE2 4.05Å; E317-F319 WeakPolarHBondContact O-CD2 3.12Å; E317-F319 PolarHBondContact O-N 3.37Å; E317-F319 WeakPolarHBondContact OE2-CE2 3.39Å; F319-R321 PolarHBondContact O-N 2.75Å
320	D	38.2	Very low	39.2	Very low	167 Å²	167	104.1 Å²	104.1	89%	0.893	53%	0.529	S	S	*	.	S	Bend	trans	-64.1	14.5	-169.7	-140.8	1.7	0	0	0	116.4
321	R	36	Very low	38.9	Very low	198 Å²	198	102.1 Å²	102.1	75%	0.747	53%	0.526	S	S	*	.			trans	-146.3	83.4	-177.5	-66	-171.2	-177.9	-178.5	0.7	112.4	F319 T323 C324	F319-R321 PolarHBondContact O-N 2.75Å; R321-T323 VanDerWaalsContact C-N 3.27Å; R321-T323 PolarHBondContact O-N 3.24Å; R321-T323 VanDerWaalsContact O-N 3.13Å; R321-C324 WeakPolarHBondContact O-CB 3.33Å; R321-C324 PolarHBondContact O-N 3.03Å
322	Q	38.7	Very low	38.7	Very low	83 Å²	83	102.4 Å²	102.4	39%	0.388	52%	0.52	S	S	.	.	H	α-helix	trans	-46.1	-38.6	179.8	-91.4	175.2	-19.6	0	0	115.3	C324 V325 E326	Q322-C324 VanDerWaalsContact C-N 3.26Å; Q322-C324 PolarHBondContact O-N 3.02Å; Q322-V325 PolarHBondContact O-N 3.41Å; Q322-E326 PolarHBondContact O-N 3.29Å
323	T	36.6	Very low	38.6	Very low	116 Å²	116	101.3 Å²	101.3	71%	0.712	51%	0.514	S	S	*	.	H	α-helix	trans	-64.9	-27.8	-178.8	43.5	0	0	0	0	113.5	R321	R321-T323 VanDerWaalsContact C-N 3.27Å; R321-T323 PolarHBondContact O-N 3.24Å; R321-T323 VanDerWaalsContact O-N 3.13Å
324	C	34.2	Very low	38.8	Very low	80 Å²	80	103.1 Å²	103.1	54%	0.541	52%	0.521	S	S	.	.	H	α-helix	trans	-76.1	-33.9	178.5	-160.1	0	0	0	0	111.5	R321 Q322 K328	R321-C324 WeakPolarHBondContact O-CB 3.33Å; R321-C324 PolarHBondContact O-N 3.03Å; Q322-C324 VanDerWaalsContact C-N 3.26Å; Q322-C324 PolarHBondContact O-N 3.02Å; C324-K328 WeakPolarHBondContact O-CB 3.29Å; C324-K328 PolarHBondContact O-N 3.2Å
325	V	37.7	Very low	39.5	Very low	43 Å²	43	109.9 Å²	109.9	26%	0.261	54%	0.539	S	S	.	.	H	α-helix	trans	-71	-45.8	-178.4	-179.9	0	0	0	0	111	L316 Q322 Q327 K328 L329	L316-V325 HydrophobicContact CD2-CG1 4.17Å; Q322-V325 PolarHBondContact O-N 3.41Å; V325-Q327 VanDerWaalsContact C-N 3.34Å; V325-Q327 PolarHBondContact O-N 3.03Å; V325-K328 PolarHBondContact O-N 3.32Å; V325-L329 VanDerWaalsContact O-CB 3.23Å; V325-L329 WeakPolarHBondContact O-CB 3.11Å; V325-L329 PolarHBondContact O-N 3.16Å
326	E	37.8	Very low	40.2	Very low	68 Å²	68	109.7 Å²	109.7	32%	0.318	53%	0.529	S	S	.	.	H	α-helix	trans	-62.6	-43.6	179.9	-164.5	179.8	-171	0	0	111.1	Q322 L329 R330	Q322-E326 PolarHBondContact O-N 3.29Å; E326-L329 PolarHBondContact O-N 3.03Å; E326-R330 WeakPolarHBondContact O-CB 3.24Å; E326-R330 PolarHBondContact O-N 3.31Å
327	Q	41.3	Very low	40.7	Very low	135 Å²	135	103.8 Å²	103.8	63%	0.631	50%	0.498	S	S	*	.	H	α-helix	trans	-68.6	-36.9	177.6	-161.5	174.1	13.5	0	0	112.1	V325 N331	V325-Q327 VanDerWaalsContact C-N 3.34Å; V325-Q327 PolarHBondContact O-N 3.03Å; Q327-N331 WeakPolarHBondContact O-CB 3.47Å; Q327-N331 PolarHBondContact O-N 3.44Å; Q327-N331 PolarHBondContact O-ND2 2.79Å
328	K	41.9	Very low	41.6	Very low	157 Å²	157	100.5 Å²	100.5	68%	0.683	49%	0.485	S	S	*	.	H	α-helix	trans	-70.6	-40.7	176.7	-165.1	175.4	-175.1	-177.5	0	111.5	C324 V325 Y332	C324-K328 WeakPolarHBondContact O-CB 3.29Å; C324-K328 PolarHBondContact O-N 3.2Å; V325-K328 PolarHBondContact O-N 3.32Å; K328-Y332 WeakPolarHBondContact O-CB 2.98Å; K328-Y332 PolarHBondContact O-N 3.42Å
329	L	43.7	Very low	42.7	Very low	53 Å²	53	97.7 Å²	97.7	28%	0.277	47%	0.467	S	S	.	.	H	α-helix	trans	-66.6	-47.5	176	-169.3	73.7	0	0	0	110.5	L312 V325 E326 Y332 V333 I396	L312-L329 HydrophobicContact CD2-CD1 4.07Å; V325-L329 VanDerWaalsContact O-CB 3.23Å; V325-L329 WeakPolarHBondContact O-CB 3.11Å; V325-L329 PolarHBondContact O-N 3.16Å; E326-L329 PolarHBondContact O-N 3.03Å; L329-Y332 WeakPolarHBondContact O-CB 3.3Å; L329-Y332 PolarHBondContact O-N 3.31Å; L329-Y332 VanDerWaalsContact O-N 3.14Å; L329-V333 HydrophobicContact CG-CG2 4.43Å; L329-V333 WeakPolarHBondContact O-CB 3.18Å; L329-V333 VanDerWaalsContact O-CG2 3.27Å; L329-V333 WeakPolarHBondContact O-CG2 3.22Å; L329-V333 PolarHBondContact O-N 2.76Å; L329-I396 HydrophobicContact CD2-CD1 3.81Å
330	R	45.5	Very low	43.6	Very low	147 Å²	147	91.4 Å²	91.4	56%	0.555	44%	0.44	S	S	*	.	H	α-helix	trans	-61.9	-47.4	175.8	-171.2	-178.7	-94.7	177.7	-3.7	111.2	E326 Y332 V333 D334	E326-R330 WeakPolarHBondContact O-CB 3.24Å; E326-R330 PolarHBondContact O-N 3.31Å; R330-Y332 PolarHBondContact O-N 2.88Å; R330-V333 PolarHBondContact O-N 3.44Å; R330-D334 WeakPolarHBondContact CG-OD2 3.11Å; R330-D334 VanDerWaalsContact O-CB 3.26Å; R330-D334 WeakPolarHBondContact O-CB 3.25Å; R330-D334 PolarHBondContact O-N 2.85Å
331	N	44.7	Very low	44.2	Very low	72 Å²	72	83.8 Å²	83.8	39%	0.385	40%	0.4	S	S	.	.	H	α-helix	trans	-60.3	-34.3	173.7	-79.5	-24.7	0	0	0	112.7	Q327 R335	Q327-N331 WeakPolarHBondContact O-CB 3.47Å; Q327-N331 PolarHBondContact O-N 3.44Å; Q327-N331 PolarHBondContact O-ND2 2.79Å; N331-R335 WeakPolarHBondContact O-CB 3.3Å; N331-R335 WeakPolarHBondContact O-CG 3.27Å; N331-R335 PolarHBondContact O-N 3.21Å; N331-R335 VanDerWaalsContact O-N 3.08Å
332	Y	43.5	Very low	45	Very low	60 Å²	60	82.1 Å²	82.1	24%	0.235	40%	0.399	C	S	.	.	H	α-helix	trans	-72.2	-47.4	178	-169.2	-95.9	0	0	0	111.3	S311 K328 L329 R330 H336 F337	S311-Y332 WeakPolarHBondContact CB-OH 3.27Å; S311-Y332 PolarHBondContact OG-OH 3.43Å; K328-Y332 WeakPolarHBondContact O-CB 2.98Å; K328-Y332 PolarHBondContact O-N 3.42Å; L329-Y332 WeakPolarHBondContact O-CB 3.3Å; L329-Y332 PolarHBondContact O-N 3.31Å; L329-Y332 VanDerWaalsContact O-N 3.14Å; R330-Y332 PolarHBondContact O-N 2.88Å; Y332-H336 HydrophobicContact CE2-CB 4.46Å; Y332-H336 WeakPolarHBondContact O-CA 3.36Å; Y332-H336 VanDerWaalsContact O-CB 3.26Å; Y332-H336 WeakPolarHBondContact O-CB 3.32Å; Y332-H336 PolarHBondContact O-N 2.75Å; Y332-F337 PolarHBondContact O-N 2.78Å
333	V	44.8	Very low	45.8	Very low	17 Å²	17	83 Å²	83	10%	0.103	40%	0.404	C	S	.	.	I	π-helix	trans	-60.2	-56.6	176.1	172.9	0	0	0	0	109.9	L329 R330 R335 F337 D338	L329-V333 HydrophobicContact CG-CG2 4.43Å; L329-V333 WeakPolarHBondContact O-CB 3.18Å; L329-V333 VanDerWaalsContact O-CG2 3.27Å; L329-V333 WeakPolarHBondContact O-CG2 3.22Å; L329-V333 PolarHBondContact O-N 2.76Å; R330-V333 PolarHBondContact O-N 3.44Å; V333-R335 PolarHBondContact O-N 3.37Å; V333-F337 HydrophobicContact CG1-CB 4.49Å; V333-F337 HydrophobicContact CG1-CD1 4.45Å; V333-F337 CarbonylContact O-C 3.41Å; V333-F337 WeakPolarHBondContact O-CA 3.45Å; V333-F337 VanDerWaalsContact O-CB 3.23Å; V333-F337 WeakPolarHBondContact O-CB 3.1Å; V333-F337 PolarHBondContact O-N 2.88Å; V333-D338 PolarHBondContact O-N 3.25Å
334	D	47.9	Very low	46.7	Very low	79 Å²	79	77.7 Å²	77.7	42%	0.422	37%	0.372	S	S	.	.	I	π-helix	trans	-63.4	-41.7	-175.9	-61.8	0.5	0	0	0	112.1	R330	R330-D334 WeakPolarHBondContact CG-OD2 3.11Å; R330-D334 VanDerWaalsContact O-CB 3.26Å; R330-D334 WeakPolarHBondContact O-CB 3.25Å; R330-D334 PolarHBondContact O-N 2.85Å
335	R	49.4	Very low	47.6	Very low	189 Å²	189	75.3 Å²	75.3	71%	0.713	36%	0.355	S	S	*	.	I	π-helix	trans	-85.2	-34.8	-176.1	-67.9	-176.5	171.5	-178	-2.2	114.4	N331 V333	N331-R335 WeakPolarHBondContact O-CB 3.3Å; N331-R335 WeakPolarHBondContact O-CG 3.27Å; N331-R335 PolarHBondContact O-N 3.21Å; N331-R335 VanDerWaalsContact O-N 3.08Å; V333-R335 PolarHBondContact O-N 3.37Å
336	H	50.3	Low	48.4	Very low	104 Å²	104	75.2 Å²	75.2	48%	0.481	36%	0.359	S	S	.	.	I	π-helix	trans	-111.2	-31	-169.8	-57.8	70	0	0	0	112.5	Y332 V340	Y332-H336 HydrophobicContact CE2-CB 4.46Å; Y332-H336 WeakPolarHBondContact O-CA 3.36Å; Y332-H336 VanDerWaalsContact O-CB 3.26Å; Y332-H336 WeakPolarHBondContact O-CB 3.32Å; Y332-H336 PolarHBondContact O-N 2.75Å; H336-V340 VanDerWaalsContact O-CG2 3.29Å; H336-V340 WeakPolarHBondContact O-CG2 3.3Å
337	F	48.4	Very low	49.5	Very low	2 Å²	2	72.4 Å²	72.4	1%	0.009	35%	0.346	C	S	.	.	I	π-helix	trans	-96.1	-49	-172.4	-160.8	-124	0	0	0	112.1	Y305 A308 L312 Y332 V333 V340 A341 F389 F392	Y305-F337 HydrophobicContact CD2-CE2 4.15Å; Y305-F337 AromaticContact CE2-CE2 3.87Å; Y305-F337 HydrophobicContact CE2-CE2 3.87Å; Y305-F337 HydrophobicContact CE2-CZ 4.19Å; A308-F337 HydrophobicContact CB-CD2 3.56Å; A308-F337 HydrophobicContact CB-CE2 3.97Å; L312-F337 HydrophobicContact CD1-CD2 4.32Å; L312-F337 HydrophobicContact CD1-CE2 4.02Å; L312-F337 HydrophobicContact CD1-CZ 4.08Å; Y332-F337 PolarHBondContact O-N 2.78Å; V333-F337 HydrophobicContact CG1-CB 4.49Å; V333-F337 HydrophobicContact CG1-CD1 4.45Å; V333-F337 CarbonylContact O-C 3.41Å; V333-F337 WeakPolarHBondContact O-CA 3.45Å; V333-F337 VanDerWaalsContact O-CB 3.23Å; V333-F337 WeakPolarHBondContact O-CB 3.1Å; V333-F337 PolarHBondContact O-N 2.88Å; F337-V340 PolarHBondContact O-N 2.95Å; F337-V340 VanDerWaalsContact O-N 3.11Å; F337-A341 WeakPolarHBondContact O-CB 3.46Å; F337-A341 PolarHBondContact O-N 3.18Å; F337-F389 AromaticContact CD1-CD1 3.92Å; F337-F389 HydrophobicContact CD1-CD1 3.92Å; F337-F389 AromaticContact CD1-CE1 3.95Å; F337-F389 HydrophobicContact CD1-CE1 3.95Å; F337-F389 HydrophobicContact CD2-CE1 4.47Å; F337-F389 AromaticContact CE1-CD1 3.28Å; F337-F389 HydrophobicContact CE1-CD1 3.28Å; F337-F389 AromaticContact CE1-CE1 3.32Å; F337-F389 HydrophobicContact CE1-CE1 3.32Å; F337-F389 AromaticContact CE2-CE1 3.89Å; F337-F389 HydrophobicContact CE2-CE1 3.89Å; F337-F389 AromaticContact CZ-CD1 3.74Å; F337-F389 HydrophobicContact CZ-CD1 3.74Å; F337-F389 AromaticContact CZ-CE1 3.3Å; F337-F389 HydrophobicContact CZ-CE1 3.3Å; F337-F389 HydrophobicContact CZ-CZ 4.49Å; F337-F392 HydrophobicContact CE1-CD2 4.19Å
338	D	50.3	Low	50.3	Low	70 Å²	70	66.1 Å²	66.1	37%	0.374	32%	0.317	S	S	.	.	H	α-helix	trans	-55.4	-45.4	-176.5	-83.3	-0.3	0	0	0	114.5	V333 V340 A341 F342	V333-D338 PolarHBondContact O-N 3.25Å; D338-V340 VanDerWaalsContact C-N 3.34Å; D338-V340 PolarHBondContact O-N 3.33Å; D338-A341 WeakPolarHBondContact O-CB 3.42Å; D338-A341 PolarHBondContact O-N 3.21Å; D338-F342 WeakPolarHBondContact O-CB 3.26Å; D338-F342 PolarHBondContact O-N 2.65Å
339	P	53.8	Low	50.9	Low	68 Å²	68	63.6 Å²	63.6	44%	0.442	31%	0.31	S	S	.	.	H	α-helix	trans	-63.9	-41.4	177.9	-20.5	32.3	0	0	0	111.9	M343	P339-M343 VanDerWaalsContact O-CB 3.24Å; P339-M343 WeakPolarHBondContact O-CB 3.45Å; P339-M343 WeakPolarHBondContact O-CG 3.46Å; P339-M343 PolarHBondContact O-N 3.49Å
340	V	50.1	Low	51.6	Low	12 Å²	12	65.7 Å²	65.7	7%	0.073	32%	0.321	C	S	.	.	H	α-helix	trans	-68.8	-40.3	179.7	180	0	0	0	0	110.2	L304 Y305 H336 F337 D338 M343 A344	L304-V340 HydrophobicContact CB-CG1 4.34Å; L304-V340 HydrophobicContact CB-CG2 4.09Å; L304-V340 HydrophobicContact CD1-CG2 4.22Å; Y305-V340 HydrophobicContact CD2-CG1 4.41Å; H336-V340 VanDerWaalsContact O-CG2 3.29Å; H336-V340 WeakPolarHBondContact O-CG2 3.3Å; F337-V340 PolarHBondContact O-N 2.95Å; F337-V340 VanDerWaalsContact O-N 3.11Å; D338-V340 VanDerWaalsContact C-N 3.34Å; D338-V340 PolarHBondContact O-N 3.33Å; V340-M343 PolarHBondContact O-N 3.48Å; V340-A344 WeakPolarHBondContact O-CB 3.29Å; V340-A344 PolarHBondContact O-N 3.11Å
341	A	51	Low	52.3	Low	7 Å²	7	59 Å²	59	6%	0.058	30%	0.296	C	S	.	.	H	α-helix	trans	-62.4	-43.4	178.5	0	0	0	0	0	112.8	F337 D338 P345 F389	F337-A341 WeakPolarHBondContact O-CB 3.46Å; F337-A341 PolarHBondContact O-N 3.18Å; D338-A341 WeakPolarHBondContact O-CB 3.42Å; D338-A341 PolarHBondContact O-N 3.21Å; A341-P345 WeakPolarHBondContact O-CD 3.36Å; A341-F389 HydrophobicContact CB-CD1 3.56Å; A341-F389 HydrophobicContact CB-CD2 3.56Å; A341-F389 HydrophobicContact CB-CE1 3.27Å; A341-F389 HydrophobicContact CB-CE2 3.28Å; A341-F389 HydrophobicContact CB-CG 3.74Å; A341-F389 HydrophobicContact CB-CZ 3.18Å; A341-F389 WeakPolarHBondContact O-CE2 3.14Å
342	F	52.9	Low	52.8	Low	163 Å²	163	56.2 Å²	56.2	72%	0.715	28%	0.282	S	S	*	.	H	α-helix	trans	-73.5	-39.7	177.6	-172.5	-96	0	0	0	112.2	D338	D338-F342 WeakPolarHBondContact O-CB 3.26Å; D338-F342 PolarHBondContact O-N 2.65Å
343	M	55.9	Low	53.2	Low	102 Å²	102	57.4 Å²	57.4	50%	0.502	30%	0.295	S	S	.	.	H	α-helix	trans	-76.9	-32.7	-177.4	-71.5	-67.5	-162.5	0	0	113.4	L301 P339 V340 A346 V347	L301-M343 HydrophobicContact CD1-CB 4.17Å; L301-M343 HydrophobicContact CD2-CB 4.35Å; P339-M343 VanDerWaalsContact O-CB 3.24Å; P339-M343 WeakPolarHBondContact O-CB 3.45Å; P339-M343 WeakPolarHBondContact O-CG 3.46Å; P339-M343 PolarHBondContact O-N 3.49Å; V340-M343 PolarHBondContact O-N 3.48Å; M343-A346 PolarHBondContact O-N 3.3Å; M343-A346 VanDerWaalsContact O-N 3.13Å; M343-V347 WeakPolarHBondContact O-CG2 3.49Å; M343-V347 PolarHBondContact O-N 3.03Å
344	A	55.4	Low	53.8	Low	4 Å²	4	57.4 Å²	57.4	3%	0.033	30%	0.296	C	S	.	.	H	α-helix	trans	-57.7	-48.1	-175.2	0	0	0	0	0	113.3	V340 A346 V347 C348	V340-A344 WeakPolarHBondContact O-CB 3.29Å; V340-A344 PolarHBondContact O-N 3.11Å; A344-A346 VanDerWaalsContact C-N 3.34Å; A344-A346 PolarHBondContact O-N 3.28Å; A344-V347 PolarHBondContact O-N 3.33Å; A344-C348 WeakPolarHBondContact O-CB 3.21Å; A344-C348 PolarHBondContact O-N 3.11Å; A344-C348 PolarHBondContact O-SG 2.91Å
345	P	53.4	Low	54.2	Low	29 Å²	29	53.8 Å²	53.8	19%	0.188	28%	0.276	C	S	.	.	H	α-helix	trans	-57.7	-43	173.4	-26.4	35.3	0	0	0	113.4	A341 C348 I349 A382	A341-P345 WeakPolarHBondContact O-CD 3.36Å; P345-C348 PolarHBondContact O-N 3.38Å; P345-I349 VanDerWaalsContact O-CG1 3.29Å; P345-I349 WeakPolarHBondContact O-CG1 3.23Å; P345-I349 PolarHBondContact O-N 3.14Å; P345-A382 HydrophobicContact CB-CB 4Å; P345-A382 HydrophobicContact CG-CB 4.3Å
346	A	55.5	Low	54.4	Low	41 Å²	41	46 Å²	46	34%	0.339	25%	0.253	S	S	.	.	H	α-helix	trans	-66.2	-41.7	-179.3	0	0	0	0	0	111.8	M343 A344 I349 L350	M343-A346 PolarHBondContact O-N 3.3Å; M343-A346 VanDerWaalsContact O-N 3.13Å; A344-A346 VanDerWaalsContact C-N 3.34Å; A344-A346 PolarHBondContact O-N 3.28Å; A346-I349 PolarHBondContact O-N 3.3Å; A346-L350 WeakPolarHBondContact O-CG 3.4Å; A346-L350 PolarHBondContact O-N 3.27Å
347	V	59.7	Low	54.6	Low	9 Å²	9	43.2 Å²	43.2	6%	0.055	25%	0.252	C	S	.	.	H	α-helix	trans	-71.7	-34	176.8	176.5	0	0	0	0	112	L297 W298 L301 M343 A344 L350 F351	L297-V347 HydrophobicContact CD2-CG1 4.21Å; L297-V347 HydrophobicContact CD2-CG2 3.91Å; L297-V347 HydrophobicContact CG-CG1 4.15Å; L297-V347 HydrophobicContact CG-CG2 4.31Å; W298-V347 HydrophobicContact CB-CG1 4.04Å; L301-V347 HydrophobicContact CD1-CB 3.66Å; L301-V347 HydrophobicContact CD1-CG1 3.97Å; L301-V347 HydrophobicContact CD1-CG2 3.36Å; M343-V347 WeakPolarHBondContact O-CG2 3.49Å; M343-V347 PolarHBondContact O-N 3.03Å; A344-V347 PolarHBondContact O-N 3.33Å; V347-L350 PolarHBondContact O-N 3.44Å; V347-F351 VanDerWaalsContact O-CB 3.29Å; V347-F351 WeakPolarHBondContact O-CB 3.26Å; V347-F351 PolarHBondContact O-N 3.41Å
348	C	57.8	Low	54.7	Low	3 Å²	3	43.5 Å²	43.5	2%	0.02	25%	0.254	C	S	.	.	H	α-helix	trans	-58.8	-51.5	168	-72.5	0	0	0	0	110.7	Y302 A344 P345 L350 F351 T352 E378	Y302-C348 PolarHBondContact OH-SG 3.45Å; A344-C348 WeakPolarHBondContact O-CB 3.21Å; A344-C348 PolarHBondContact O-N 3.11Å; A344-C348 PolarHBondContact O-SG 2.91Å; P345-C348 PolarHBondContact O-N 3.38Å; C348-L350 VanDerWaalsContact C-N 3.28Å; C348-L350 PolarHBondContact O-N 3.46Å; C348-F351 PolarHBondContact O-N 3.08Å; C348-F351 VanDerWaalsContact O-N 3.1Å; C348-T352 WeakPolarHBondContact O-CB 3.35Å; C348-T352 PolarHBondContact O-N 3.39Å; C348-E378 VanDerWaalsContact C-OE2 3.31Å; C348-E378 WeakPolarHBondContact CA-OE2 3.36Å; C348-E378 HydrophobicContact CB-CB 4.24Å; C348-E378 HydrophobicContact CB-CG 4.42Å
349	I	54.3	Low	54.8	Low	105 Å²	105	40.4 Å²	40.4	54%	0.538	24%	0.237	S	C	.	.	H	α-helix	trans	-56.6	-44.6	177.2	-67.9	164.5	0	0	0	110.7	P345 A346 V353	P345-I349 VanDerWaalsContact O-CG1 3.29Å; P345-I349 WeakPolarHBondContact O-CG1 3.23Å; P345-I349 PolarHBondContact O-N 3.14Å; A346-I349 PolarHBondContact O-N 3.3Å; I349-V353 HydrophobicContact CG2-CG2 4.26Å; I349-V353 WeakPolarHBondContact O-CB 3.35Å; I349-V353 WeakPolarHBondContact O-CG2 3.25Å; I349-V353 PolarHBondContact O-N 2.9Å
350	L	58.6	Low	54.5	Low	96 Å²	96	45.3 Å²	45.3	50%	0.503	25%	0.247	S	C	.	.	H	α-helix	trans	-63.4	-41.8	176.5	-76.7	165.9	0	0	0	112.7	V294 A346 V347 C348 V353 S354	V294-L350 HydrophobicContact CG1-CB 4.34Å; A346-L350 WeakPolarHBondContact O-CG 3.4Å; A346-L350 PolarHBondContact O-N 3.27Å; V347-L350 PolarHBondContact O-N 3.44Å; C348-L350 VanDerWaalsContact C-N 3.28Å; C348-L350 PolarHBondContact O-N 3.46Å; L350-V353 PolarHBondContact O-N 2.87Å; L350-S354 VanDerWaalsContact O-CB 3.27Å; L350-S354 WeakPolarHBondContact O-CB 3.36Å; L350-S354 PolarHBondContact O-N 2.91Å; L350-S354 PolarHBondContact O-OG 3.47Å
351	F	59.9	Low	54.4	Low	6 Å²	6	46.4 Å²	46.4	3%	0.026	26%	0.255	C	S	.	.	H	α-helix	trans	-64.3	-49.7	177.4	-176.8	-103.4	0	0	0	110.8	V267 F291 V294 W298 V347 C348 V353 S354 L355 L374 E378	V267-F351 HydrophobicContact CG1-CE1 3.93Å; V267-F351 HydrophobicContact CG1-CZ 4.38Å; F291-F351 HydrophobicContact CD2-CE2 4.06Å; F291-F351 HydrophobicContact CE1-CE2 4.43Å; F291-F351 AromaticContact CE2-CD2 3.94Å; F291-F351 HydrophobicContact CE2-CD2 3.94Å; F291-F351 HydrophobicContact CE2-CE1 4.41Å; F291-F351 AromaticContact CE2-CE2 3.15Å; F291-F351 HydrophobicContact CE2-CE2 3.15Å; F291-F351 AromaticContact CE2-CZ 3.46Å; F291-F351 HydrophobicContact CE2-CZ 3.46Å; F291-F351 VanDerWaalsContact CE2-CZ 3.46Å; F291-F351 AromaticContact CZ-CE2 3.41Å; F291-F351 HydrophobicContact CZ-CE2 3.41Å; F291-F351 VanDerWaalsContact CZ-CE2 3.41Å; F291-F351 AromaticContact CZ-CZ 3.49Å; F291-F351 HydrophobicContact CZ-CZ 3.49Å; F291-F351 VanDerWaalsContact CZ-CZ 3.49Å; V294-F351 HydrophobicContact CG1-CB 3.93Å; V294-F351 HydrophobicContact CG1-CD2 4.12Å; W298-F351 HydrophobicContact CB-CD2 4.29Å; W298-F351 AromaticContact CD1-CG 3.97Å; W298-F351 HydrophobicContact CG-CB 4.44Å; W298-F351 HydrophobicContact CG-CD2 4.44Å; W298-F351 HydrophobicContact CG-CG 4.28Å; V347-F351 VanDerWaalsContact O-CB 3.29Å; V347-F351 WeakPolarHBondContact O-CB 3.26Å; V347-F351 PolarHBondContact O-N 3.41Å; C348-F351 PolarHBondContact O-N 3.08Å; C348-F351 VanDerWaalsContact O-N 3.1Å; F351-V353 PolarHBondContact O-N 3.09Å; F351-S354 PolarHBondContact O-N 3.38Å; F351-L355 HydrophobicContact CE1-CD1 4.5Å; F351-L355 HydrophobicContact CZ-CD1 4.41Å; F351-L355 WeakPolarHBondContact O-CB 3.22Å; F351-L355 PolarHBondContact O-N 3.26Å; F351-L374 HydrophobicContact CD1-CD2 3.69Å; F351-L374 HydrophobicContact CE1-CD2 3.45Å; F351-L374 VanDerWaalsContact CE1-CD2 3.45Å; F351-E378 VanDerWaalsContact CD1-OE1 3.25Å; F351-E378 WeakPolarHBondContact CD1-OE1 3.23Å
352	T	55.1	Low	54.4	Low	14 Å²	14	46.8 Å²	46.8	9%	0.086	26%	0.256	C	S	.	.	H	α-helix	trans	-53.4	-53.8	172.1	-81.1	0	0	0	0	110.6	C348 S354 L355 A356 F371 E378	C348-T352 WeakPolarHBondContact O-CB 3.35Å; C348-T352 PolarHBondContact O-N 3.39Å; T352-S354 VanDerWaalsContact C-N 3.35Å; T352-S354 PolarHBondContact O-N 3.28Å; T352-L355 CarbonylContact O-C 3.59Å; T352-L355 WeakPolarHBondContact O-CB 3.38Å; T352-L355 PolarHBondContact O-N 2.8Å; T352-A356 PolarHBondContact O-N 3.44Å; T352-F371 HydrophobicContact CG2-CD2 4.04Å; T352-F371 HydrophobicContact CG2-CE2 3.22Å; T352-F371 HydrophobicContact CG2-CZ 3.73Å; T352-F371 WeakPolarHBondContact O-CD2 3.44Å; T352-F371 WeakPolarHBondContact O-CE2 2.98Å; T352-E378 PolarHBondContact OG1-OE2 3.35Å
353	V	53.5	Low	54.2	Low	86 Å²	86	44.8 Å²	44.8	52%	0.521	25%	0.249	S	C	.	.	H	α-helix	trans	-61.5	-40.3	-179.9	169.5	0	0	0	0	112.2	I349 L350 F351 A356 G357	I349-V353 HydrophobicContact CG2-CG2 4.26Å; I349-V353 WeakPolarHBondContact O-CB 3.35Å; I349-V353 WeakPolarHBondContact O-CG2 3.25Å; I349-V353 PolarHBondContact O-N 2.9Å; L350-V353 PolarHBondContact O-N 2.87Å; F351-V353 PolarHBondContact O-N 3.09Å; V353-A356 WeakPolarHBondContact O-CA 3.47Å; V353-A356 VanDerWaalsContact O-CB 3.25Å; V353-A356 WeakPolarHBondContact O-CB 3.48Å; V353-A356 PolarHBondContact O-N 3.31Å; V353-A356 VanDerWaalsContact O-N 3.17Å; V353-G357 PolarHBondContact O-N 2.8Å
354	S	57.5	Low	53.8	Low	17 Å²	17	43.8 Å²	43.8	12%	0.119	25%	0.246	C	C	.	.	H	α-helix	trans	-64.1	-43.1	176.7	-57.8	0	0	0	0	111	L350 F351 T352 A356 G357 I358	L350-S354 VanDerWaalsContact O-CB 3.27Å; L350-S354 WeakPolarHBondContact O-CB 3.36Å; L350-S354 PolarHBondContact O-N 2.91Å; L350-S354 PolarHBondContact O-OG 3.47Å; F351-S354 PolarHBondContact O-N 3.38Å; T352-S354 VanDerWaalsContact C-N 3.35Å; T352-S354 PolarHBondContact O-N 3.28Å; S354-A356 VanDerWaalsContact C-N 3.3Å; S354-A356 PolarHBondContact O-N 3.44Å; S354-G357 PolarHBondContact O-N 3.38Å; S354-I358 WeakPolarHBondContact O-CB 3.19Å; S354-I358 VanDerWaalsContact O-CG1 3.31Å; S354-I358 WeakPolarHBondContact O-CG1 3.24Å; S354-I358 PolarHBondContact O-N 3.33Å
355	L	55.3	Low	53.3	Low	2 Å²	2	44.6 Å²	44.6	1%	0.01	25%	0.249	C	C	.	.	H	α-helix	trans	-61.5	-41	172.5	-149.8	96.1	0	0	0	110.7	F270 Q274 F291 F351 T352 I358 N359 L374	F270-L355 HydrophobicContact CE1-CD2 4.31Å; Q274-L355 HydrophobicContact CB-CD1 4.33Å; Q274-L355 HydrophobicContact CG-CD1 4.43Å; Q274-L355 HydrophobicContact CG-CD2 4.39Å; F291-L355 HydrophobicContact CD2-CD1 4.05Å; F291-L355 HydrophobicContact CE2-CD1 3.23Å; F291-L355 HydrophobicContact CZ-CD1 3.81Å; F351-L355 HydrophobicContact CE1-CD1 4.5Å; F351-L355 HydrophobicContact CZ-CD1 4.41Å; F351-L355 WeakPolarHBondContact O-CB 3.22Å; F351-L355 PolarHBondContact O-N 3.26Å; T352-L355 CarbonylContact O-C 3.59Å; T352-L355 WeakPolarHBondContact O-CB 3.38Å; T352-L355 PolarHBondContact O-N 2.8Å; L355-I358 PolarHBondContact O-N 2.9Å; L355-N359 WeakPolarHBondContact O-CB 3.5Å; L355-N359 PolarHBondContact O-N 2.98Å; L355-N359 PolarHBondContact O-ND2 3.31Å; L355-N359 PolarHBondContact O-OD1 2.9Å; L355-L374 HydrophobicContact CD2-CD2 3.89Å
356	A	54.7	Low	52.9	Low	27 Å²	27	45.7 Å²	45.7	22%	0.223	25%	0.253	C	S	.	.	H	α-helix	trans	-59.6	-47.2	175.9	0	0	0	0	0	111.5	T352 V353 S354 I358 N359 W360 F371	T352-A356 PolarHBondContact O-N 3.44Å; V353-A356 WeakPolarHBondContact O-CA 3.47Å; V353-A356 VanDerWaalsContact O-CB 3.25Å; V353-A356 WeakPolarHBondContact O-CB 3.48Å; V353-A356 PolarHBondContact O-N 3.31Å; V353-A356 VanDerWaalsContact O-N 3.17Å; S354-A356 VanDerWaalsContact C-N 3.3Å; S354-A356 PolarHBondContact O-N 3.44Å; A356-I358 VanDerWaalsContact C-N 3.32Å; A356-I358 PolarHBondContact O-N 3.41Å; A356-N359 PolarHBondContact O-N 2.79Å; A356-W360 VanDerWaalsContact O-CB 3.24Å; A356-W360 WeakPolarHBondContact O-CB 3.46Å; A356-W360 PolarHBondContact O-N 2.84Å; A356-F371 HydrophobicContact CB-CD2 3.49Å; A356-F371 VanDerWaalsContact CB-CD2 3.49Å; A356-F371 HydrophobicContact CB-CE1 4.45Å; A356-F371 HydrophobicContact CB-CE2 3.14Å; A356-F371 HydrophobicContact CB-CG 4.27Å; A356-F371 HydrophobicContact CB-CZ 3.7Å
357	G	53.3	Low	52.4	Low	45 Å²	45	44 Å²	44	46%	0.464	24%	0.239	S	C	.	.	H	α-helix	trans	-63.1	-39.6	-179.8	0	0	0	0	0	112.3	V353 S354 W360 S361	V353-G357 PolarHBondContact O-N 2.8Å; S354-G357 PolarHBondContact O-N 3.38Å; G357-W360 WeakPolarHBondContact O-CB 3.46Å; G357-W360 PolarHBondContact O-N 3.47Å; G357-S361 PolarHBondContact O-N 3.47Å
358	I	51.3	Low	51.8	Low	7 Å²	7	44.8 Å²	44.8	4%	0.036	25%	0.247	C	C	.	.	H	α-helix	trans	-71.1	-40.7	176.2	-71.7	169.8	0	0	0	111.5	V278 V286 F291 S354 L355 A356 W360 S361 I362	V278-I358 HydrophobicContact CB-CG2 4.24Å; V278-I358 HydrophobicContact CG1-CG2 4.11Å; V278-I358 HydrophobicContact CG2-CG2 3.1Å; V286-I358 HydrophobicContact CG1-CG1 3.85Å; F291-I358 HydrophobicContact CB-CD1 3.49Å; F291-I358 VanDerWaalsContact CB-CD1 3.49Å; F291-I358 HydrophobicContact CD2-CD1 4.17Å; F291-I358 HydrophobicContact CG-CD1 4.12Å; S354-I358 WeakPolarHBondContact O-CB 3.19Å; S354-I358 VanDerWaalsContact O-CG1 3.31Å; S354-I358 WeakPolarHBondContact O-CG1 3.24Å; S354-I358 PolarHBondContact O-N 3.33Å; L355-I358 PolarHBondContact O-N 2.9Å; A356-I358 VanDerWaalsContact C-N 3.32Å; A356-I358 PolarHBondContact O-N 3.41Å; I358-W360 VanDerWaalsContact C-N 3.27Å; I358-W360 PolarHBondContact O-N 2.74Å; I358-S361 PolarHBondContact O-N 3.2Å; I358-S361 PolarHBondContact O-OG 3.23Å; I358-I362 HydrophobicContact CG2-CD1 4.33Å; I358-I362 WeakPolarHBondContact O-CG1 3.18Å; I358-I362 PolarHBondContact O-N 3.17Å
359	N	51.6	Low	51.3	Low	6 Å²	6	44.9 Å²	44.9	3%	0.032	25%	0.247	C	C	.	.	H	α-helix	trans	-69.1	-32.1	176.9	-70.4	-13.2	0	0	0	111.3	Q274 L355 A356 S361 I362 H363 S367 S370	Q274-N359 PolarHBondContact OE1-OD1 3.33Å; L355-N359 WeakPolarHBondContact O-CB 3.5Å; L355-N359 PolarHBondContact O-N 2.98Å; L355-N359 PolarHBondContact O-ND2 3.31Å; L355-N359 PolarHBondContact O-OD1 2.9Å; A356-N359 PolarHBondContact O-N 2.79Å; N359-S361 VanDerWaalsContact C-N 3.32Å; N359-S361 PolarHBondContact O-N 2.81Å; N359-I362 PolarHBondContact O-N 3.49Å; N359-H363 PolarHBondContact O-N 2.95Å; N359-S367 WeakPolarHBondContact CB-OG 3.48Å; N359-S367 VanDerWaalsContact CG-CB 3.43Å; N359-S367 PolarHBondContact ND2-O 3.3Å; N359-S367 PolarHBondContact O-OG 3.29Å; N359-S367 VanDerWaalsContact O-OG 3.05Å; N359-S367 WeakPolarHBondContact OD1-CB 3.2Å; N359-S370 PolarHBondContact ND2-OG 2.81Å; N359-S370 VanDerWaalsContact ND2-OG 3.15Å
360	W	47.9	Very low	51.1	Low	170 Å²	170	40 Å²	40	64%	0.644	22%	0.222	S	C	*	.	H	α-helix	trans	-62.4	-38.6	174.6	-173	-81.9	0	0	0	111.9	T106 A356 G357 I358 H363	T106-W360 HydrophobicContact CG2-CH2 4.24Å; T106-W360 HydrophobicContact CG2-CZ3 4.29Å; A356-W360 VanDerWaalsContact O-CB 3.24Å; A356-W360 WeakPolarHBondContact O-CB 3.46Å; A356-W360 PolarHBondContact O-N 2.84Å; G357-W360 WeakPolarHBondContact O-CB 3.46Å; G357-W360 PolarHBondContact O-N 3.47Å; I358-W360 VanDerWaalsContact C-N 3.27Å; I358-W360 PolarHBondContact O-N 2.74Å; W360-H363 PolarHBondContact O-CE1 3.33Å; W360-H363 PolarHBondContact O-N 2.92Å; W360-H363 PolarHBondContact O-ND1 3.12Å
361	S	47.9	Very low	50.7	Low	35 Å²	35	38.2 Å²	38.2	25%	0.245	21%	0.21	C	C	.	.	H	α-helix	trans	-70.8	-32.1	178.6	64.2	0	0	0	0	113.1	E283 G357 I358 N359 H363	E283-S361 WeakPolarHBondContact OE2-CB 3.45Å; E283-S361 PolarHBondContact OE2-OG 2.93Å; G357-S361 PolarHBondContact O-N 3.47Å; I358-S361 PolarHBondContact O-N 3.2Å; I358-S361 PolarHBondContact O-OG 3.23Å; N359-S361 VanDerWaalsContact C-N 3.32Å; N359-S361 PolarHBondContact O-N 2.81Å; S361-H363 VanDerWaalsContact C-N 3.3Å; S361-H363 PolarHBondContact O-N 3.05Å
362	I	51.5	Low	50.2	Low	15 Å²	15	38.1 Å²	38.1	8%	0.077	21%	0.211	C	C	.	.	H	α-helix	trans	-73.1	-22	-180	-61	170.1	0	0	0	111.9	V278 Q281 I358 N359 D364	V278-I362 HydrophobicContact CB-CD1 4.17Å; V278-I362 HydrophobicContact CG2-CD1 3.34Å; V278-I362 HydrophobicContact CG2-CG1 4.39Å; Q281-I362 VanDerWaalsContact CD-CG2 3.5Å; Q281-I362 VanDerWaalsContact NE2-CG2 3.26Å; I358-I362 HydrophobicContact CG2-CD1 4.33Å; I358-I362 WeakPolarHBondContact O-CG1 3.18Å; I358-I362 PolarHBondContact O-N 3.17Å; N359-I362 PolarHBondContact O-N 3.49Å; I362-D364 HydrophobicContact CG2-CB 3.44Å; I362-D364 VanDerWaalsContact CG2-CB 3.44Å; I362-D364 PolarHBondContact O-N 3.01Å
363	H	49.2	Very low	49.9	Very low	121 Å²	121	38.9 Å²	38.9	56%	0.56	21%	0.214	S	C	*	.			trans	51.7	11.7	-173.4	-66.6	-53.7	0	0	0	114.9	N359 W360 S361	N359-H363 PolarHBondContact O-N 2.95Å; W360-H363 PolarHBondContact O-CE1 3.33Å; W360-H363 PolarHBondContact O-N 2.92Å; W360-H363 PolarHBondContact O-ND1 3.12Å; S361-H363 VanDerWaalsContact C-N 3.3Å; S361-H363 PolarHBondContact O-N 3.05Å
364	D	46.8	Very low	49.9	Very low	82 Å²	82	35 Å²	35	44%	0.439	19%	0.19	S	C	.	.			trans	-93.4	131.8	-171.5	-156.4	-4.3	0	0	0	109.7	I362 L366 S367 A368	I362-D364 HydrophobicContact CG2-CB 3.44Å; I362-D364 VanDerWaalsContact CG2-CB 3.44Å; I362-D364 PolarHBondContact O-N 3.01Å; D364-L366 PolarHBondContact O-N 3.31Å; D364-L366 VanDerWaalsContact O-N 3.15Å; D364-S367 WeakPolarHBondContact O-CA 2.86Å; D364-S367 VanDerWaalsContact O-CB 3.26Å; D364-S367 WeakPolarHBondContact O-CB 3.31Å; D364-S367 PolarHBondContact O-N 3.23Å; D364-S367 PolarHBondContact O-OG 3.5Å; D364-A368 PolarHBondContact O-N 3.31Å
365	L	44.4	Very low	49.6	Very low	20 Å²	20	34.7 Å²	34.7	11%	0.105	19%	0.188	C	C	.	.	H	α-helix	trans	-54.5	-40.9	-174	-176.3	73.7	0	0	0	111.4	I109 Y113 I213 Q216 S367 A368 L369	I109-L365 HydrophobicContact CD1-CD1 3.35Å; I109-L365 HydrophobicContact CG1-CD1 3.62Å; I109-L365 HydrophobicContact CG2-CD1 4.41Å; Y113-L365 HydrophobicContact CE2-CD1 4.2Å; Y113-L365 WeakPolarHBondContact OH-CD1 2.94Å; I213-L365 HydrophobicContact CB-CD2 3.95Å; I213-L365 HydrophobicContact CD1-CD2 3.44Å; I213-L365 VanDerWaalsContact CD1-CD2 3.44Å; I213-L365 HydrophobicContact CG1-CD2 3.3Å; I213-L365 HydrophobicContact CG2-CD2 3.82Å; Q216-L365 VanDerWaalsContact OE1-CD2 3.29Å; L365-S367 PolarHBondContact O-N 3.33Å; L365-A368 PolarHBondContact O-N 3.49Å; L365-A368 VanDerWaalsContact O-N 3.12Å; L365-L369 HydrophobicContact CD2-CD1 4.38Å; L365-L369 HydrophobicContact CG-CD1 3.78Å; L365-L369 WeakPolarHBondContact O-CD1 3.49Å; L365-L369 WeakPolarHBondContact O-CG 3.41Å; L365-L369 PolarHBondContact O-N 3.19Å
366	L	45	Very low	49.4	Very low	52 Å²	52	35.3 Å²	35.3	27%	0.272	19%	0.192	S	C	.	.	H	α-helix	trans	-52.8	-39.5	177.2	-172	78.7	0	0	0	111.7	Q216 D364 S370	Q216-L366 HydrophobicContact CG-CD1 4.18Å; Q216-L366 VanDerWaalsContact NE2-CD1 3.27Å; D364-L366 PolarHBondContact O-N 3.31Å; D364-L366 VanDerWaalsContact O-N 3.15Å; L366-S370 VanDerWaalsContact O-CB 3.23Å; L366-S370 WeakPolarHBondContact O-CB 3.42Å; L366-S370 PolarHBondContact O-N 2.71Å
367	S	46.2	Very low	49.2	Very low	5 Å²	5	34.7 Å²	34.7	4%	0.035	19%	0.185	C	C	.	.	H	α-helix	trans	-69.4	-45.3	-179.2	82	0	0	0	0	110.8	N359 D364 L365 L369 S370 F371	N359-S367 WeakPolarHBondContact CB-OG 3.48Å; N359-S367 VanDerWaalsContact CG-CB 3.43Å; N359-S367 PolarHBondContact ND2-O 3.3Å; N359-S367 PolarHBondContact O-OG 3.29Å; N359-S367 VanDerWaalsContact O-OG 3.05Å; N359-S367 WeakPolarHBondContact OD1-CB 3.2Å; D364-S367 WeakPolarHBondContact O-CA 2.86Å; D364-S367 VanDerWaalsContact O-CB 3.26Å; D364-S367 WeakPolarHBondContact O-CB 3.31Å; D364-S367 PolarHBondContact O-N 3.23Å; D364-S367 PolarHBondContact O-OG 3.5Å; L365-S367 PolarHBondContact O-N 3.33Å; S367-L369 PolarHBondContact O-N 2.94Å; S367-S370 WeakPolarHBondContact O-CB 3.45Å; S367-S370 PolarHBondContact O-N 2.98Å; S367-S370 VanDerWaalsContact O-N 3.14Å; S367-S370 PolarHBondContact O-OG 3.03Å; S367-F371 PolarHBondContact O-N 2.77Å
368	A	46.1	Very low	49.2	Very low	27 Å²	27	32.8 Å²	32.8	22%	0.223	16%	0.164	C	C	.	.	H	α-helix	trans	-63.3	-41.9	176.8	0	0	0	0	0	112.8	I109 D364 L365 S370 F371 S372	I109-A368 HydrophobicContact CG2-CB 3.89Å; D364-A368 PolarHBondContact O-N 3.31Å; L365-A368 PolarHBondContact O-N 3.49Å; L365-A368 VanDerWaalsContact O-N 3.12Å; A368-S370 VanDerWaalsContact C-N 3.27Å; A368-S370 PolarHBondContact O-N 3.29Å; A368-F371 WeakPolarHBondContact O-CB 2.95Å; A368-F371 PolarHBondContact O-N 3.41Å; A368-S372 PolarHBondContact O-N 3.26Å; A368-S372 PolarHBondContact O-OG 3.04Å
369	L	48.1	Very low	49.2	Very low	4 Å²	4	36 Å²	36	2%	0.021	18%	0.184	C	C	.	.	H	α-helix	trans	-63.2	-38.7	174.3	-72	150.6	0	0	0	112	Y113 Q216 I217 V220 L365 S367 F371 S372 I373	Y113-L369 HydrophobicContact CE1-CD2 3.47Å; Y113-L369 VanDerWaalsContact CE1-CD2 3.47Å; Y113-L369 HydrophobicContact CE1-CG 4.22Å; Y113-L369 WeakPolarHBondContact OH-CD2 3.22Å; Q216-L369 HydrophobicContact CB-CD1 3.23Å; Q216-L369 HydrophobicContact CB-CD2 3.97Å; Q216-L369 HydrophobicContact CB-CG 4.18Å; Q216-L369 HydrophobicContact CG-CD1 3.41Å; Q216-L369 VanDerWaalsContact CG-CD1 3.41Å; I217-L369 HydrophobicContact CG1-CD2 4.17Å; V220-L369 HydrophobicContact CG2-CB 4.04Å; V220-L369 HydrophobicContact CG2-CD2 3.44Å; V220-L369 VanDerWaalsContact CG2-CD2 3.44Å; V220-L369 HydrophobicContact CG2-CG 4.37Å; L365-L369 HydrophobicContact CD2-CD1 4.38Å; L365-L369 HydrophobicContact CG-CD1 3.78Å; L365-L369 WeakPolarHBondContact O-CD1 3.49Å; L365-L369 WeakPolarHBondContact O-CG 3.41Å; L365-L369 PolarHBondContact O-N 3.19Å; S367-L369 PolarHBondContact O-N 2.94Å; L369-F371 VanDerWaalsContact C-N 3.27Å; L369-F371 PolarHBondContact O-N 2.96Å; L369-S372 PolarHBondContact O-N 3.35Å; L369-I373 PolarHBondContact O-N 3.45Å; L369-I373 VanDerWaalsContact O-N 3.09Å
370	S	48.8	Very low	49.2	Very low	4 Å²	4	36.2 Å²	36.2	3%	0.028	19%	0.185	C	C	.	.	H	α-helix	trans	-61.9	-44.7	178.9	85.6	0	0	0	0	109.9	F270 Q274 N359 L366 S367 A368 S372 I373 L374	F270-S370 VanDerWaalsContact CE1-C 3.41Å; F270-S370 WeakPolarHBondContact CE1-O 3.38Å; F270-S370 WeakPolarHBondContact CZ-O 2.72Å; Q274-S370 PolarHBondContact NE2-OG 2.67Å; N359-S370 PolarHBondContact ND2-OG 2.81Å; N359-S370 VanDerWaalsContact ND2-OG 3.15Å; L366-S370 VanDerWaalsContact O-CB 3.23Å; L366-S370 WeakPolarHBondContact O-CB 3.42Å; L366-S370 PolarHBondContact O-N 2.71Å; S367-S370 WeakPolarHBondContact O-CB 3.45Å; S367-S370 PolarHBondContact O-N 2.98Å; S367-S370 VanDerWaalsContact O-N 3.14Å; S367-S370 PolarHBondContact O-OG 3.03Å; A368-S370 VanDerWaalsContact C-N 3.27Å; A368-S370 PolarHBondContact O-N 3.29Å; S370-S372 PolarHBondContact O-N 2.89Å; S370-I373 PolarHBondContact O-N 3.07Å; S370-L374 WeakPolarHBondContact O-CB 3.46Å; S370-L374 PolarHBondContact O-N 3.41Å
371	F	50.5	Low	49.4	Very low	58 Å²	58	28.4 Å²	28.4	25%	0.254	16%	0.157	S	C	.	.	H	α-helix	trans	-58.8	-43.8	175.1	173.5	-98.1	0	0	0	112.1	T352 A356 S367 A368 L369 L374 S375	T352-F371 HydrophobicContact CG2-CD2 4.04Å; T352-F371 HydrophobicContact CG2-CE2 3.22Å; T352-F371 HydrophobicContact CG2-CZ 3.73Å; T352-F371 WeakPolarHBondContact O-CD2 3.44Å; T352-F371 WeakPolarHBondContact O-CE2 2.98Å; A356-F371 HydrophobicContact CB-CD2 3.49Å; A356-F371 VanDerWaalsContact CB-CD2 3.49Å; A356-F371 HydrophobicContact CB-CE1 4.45Å; A356-F371 HydrophobicContact CB-CE2 3.14Å; A356-F371 HydrophobicContact CB-CG 4.27Å; A356-F371 HydrophobicContact CB-CZ 3.7Å; S367-F371 PolarHBondContact O-N 2.77Å; A368-F371 WeakPolarHBondContact O-CB 2.95Å; A368-F371 PolarHBondContact O-N 3.41Å; L369-F371 VanDerWaalsContact C-N 3.27Å; L369-F371 PolarHBondContact O-N 2.96Å; F371-L374 PolarHBondContact O-N 2.89Å; F371-S375 VanDerWaalsContact O-CB 3.25Å; F371-S375 WeakPolarHBondContact O-CB 3.15Å; F371-S375 PolarHBondContact O-N 3.39Å; F371-S375 PolarHBondContact O-OG 2.85Å
372	S	49.2	Very low	49.6	Very low	4 Å²	4	27.5 Å²	27.5	3%	0.028	15%	0.151	C	C	.	.	H	α-helix	trans	-64.8	-40.4	178.8	-62.1	0	0	0	0	114.1	A368 L369 S370 S375 T376	A368-S372 PolarHBondContact O-N 3.26Å; A368-S372 PolarHBondContact O-OG 3.04Å; L369-S372 PolarHBondContact O-N 3.35Å; S370-S372 PolarHBondContact O-N 2.89Å; S372-S375 PolarHBondContact O-OG 3.14Å; S372-T376 VanDerWaalsContact O-CB 3.3Å; S372-T376 WeakPolarHBondContact O-CB 2.89Å; S372-T376 PolarHBondContact O-N 2.86Å; S372-T376 VanDerWaalsContact O-N 3.13Å; S372-T376 PolarHBondContact O-OG1 2.91Å
373	I	49	Very low	49.5	Very low	30 Å²	30	30.4 Å²	30.4	15%	0.154	16%	0.164	C	C	.	.	H	α-helix	trans	-61.2	-51.9	174.6	-72.3	156.5	0	0	0	108.9	L219 V220 F270 L369 S370 T376 V377	L219-I373 HydrophobicContact CB-CD1 4.25Å; V220-I373 HydrophobicContact CB-CD1 4.47Å; V220-I373 HydrophobicContact CB-CG1 4.05Å; V220-I373 HydrophobicContact CG1-CG1 4.39Å; V220-I373 HydrophobicContact CG2-CD1 3.84Å; V220-I373 HydrophobicContact CG2-CG1 3.72Å; F270-I373 HydrophobicContact CE2-CD1 4.49Å; F270-I373 HydrophobicContact CZ-CB 4.23Å; F270-I373 HydrophobicContact CZ-CG2 4.49Å; L369-I373 PolarHBondContact O-N 3.45Å; L369-I373 VanDerWaalsContact O-N 3.09Å; S370-I373 PolarHBondContact O-N 3.07Å; I373-T376 PolarHBondContact O-N 2.83Å; I373-V377 HydrophobicContact CG2-CG2 4.4Å; I373-V377 WeakPolarHBondContact O-CB 3.2Å; I373-V377 VanDerWaalsContact O-CG2 3.28Å; I373-V377 WeakPolarHBondContact O-CG2 3.45Å; I373-V377 PolarHBondContact O-N 3.28Å
374	L	53	Low	49.5	Very low	5 Å²	5	25 Å²	25	3%	0.026	14%	0.14	C	C	.	.	H	α-helix	trans	-65.4	-46.1	-173.4	-159.7	88	0	0	0	111.1	V267 F270 F351 L355 S370 F371 T376 V377 E378	V267-L374 HydrophobicContact CB-CD1 4.37Å; V267-L374 HydrophobicContact CG1-CD1 4.1Å; V267-L374 HydrophobicContact CG2-CD1 4.02Å; F270-L374 HydrophobicContact CD1-CB 4.49Å; F270-L374 HydrophobicContact CD1-CD1 3.81Å; F270-L374 HydrophobicContact CE1-CB 3.94Å; F270-L374 HydrophobicContact CE1-CD1 4.08Å; F270-L374 HydrophobicContact CG-CD1 4.41Å; F351-L374 HydrophobicContact CD1-CD2 3.69Å; F351-L374 HydrophobicContact CE1-CD2 3.45Å; F351-L374 VanDerWaalsContact CE1-CD2 3.45Å; L355-L374 HydrophobicContact CD2-CD2 3.89Å; S370-L374 WeakPolarHBondContact O-CB 3.46Å; S370-L374 PolarHBondContact O-N 3.41Å; F371-L374 PolarHBondContact O-N 2.89Å; L374-T376 VanDerWaalsContact C-N 3.29Å; L374-T376 PolarHBondContact O-N 2.79Å; L374-V377 PolarHBondContact O-N 3.48Å; L374-E378 HydrophobicContact CG-CG 4.34Å; L374-E378 VanDerWaalsContact O-CB 3.29Å; L374-E378 WeakPolarHBondContact O-CB 3.43Å; L374-E378 WeakPolarHBondContact O-CG 3.11Å; L374-E378 PolarHBondContact O-N 2.85Å
375	S	51.3	Low	49.7	Very low	10 Å²	10	21.3 Å²	21.3	7%	0.07	12%	0.12	C	C	.	.	H	α-helix	trans	-61.2	-39.6	178.5	71	0	0	0	0	111.5	F371 S372 V379	F371-S375 VanDerWaalsContact O-CB 3.25Å; F371-S375 WeakPolarHBondContact O-CB 3.15Å; F371-S375 PolarHBondContact O-N 3.39Å; F371-S375 PolarHBondContact O-OG 2.85Å; S372-S375 PolarHBondContact O-OG 3.14Å; S375-V379 VanDerWaalsContact O-CB 3.23Å; S375-V379 WeakPolarHBondContact O-CB 3.13Å; S375-V379 WeakPolarHBondContact O-CG2 3.16Å; S375-V379 PolarHBondContact O-N 3.48Å
376	T	52.3	Low	50	Low	15 Å²	15	24.6 Å²	24.6	9%	0.092	13%	0.134	C	C	.	.	H	α-helix	trans	-67.5	-45.7	178.9	-56.4	0	0	0	0	110.7	T228 S372 I373 L374 T380	T228-T376 HydrophobicContact CG2-CG2 3.58Å; S372-T376 VanDerWaalsContact O-CB 3.3Å; S372-T376 WeakPolarHBondContact O-CB 2.89Å; S372-T376 PolarHBondContact O-N 2.86Å; S372-T376 VanDerWaalsContact O-N 3.13Å; S372-T376 PolarHBondContact O-OG1 2.91Å; I373-T376 PolarHBondContact O-N 2.83Å; L374-T376 VanDerWaalsContact C-N 3.29Å; L374-T376 PolarHBondContact O-N 2.79Å; T376-T380 VanDerWaalsContact O-CB 3.31Å; T376-T380 WeakPolarHBondContact O-CB 3.36Å; T376-T380 PolarHBondContact O-N 2.76Å; T376-T380 PolarHBondContact O-OG1 3.48Å
377	V	50.9	Low	50.1	Low	14 Å²	14	22.7 Å²	22.7	9%	0.085	13%	0.125	C	C	.	.	H	α-helix	trans	-62.5	-47.5	176.1	172.2	0	0	0	0	110.2	N263 I373 L374 T380 V381	N263-V377 WeakPolarHBondContact OD1-CG1 3.32Å; I373-V377 HydrophobicContact CG2-CG2 4.4Å; I373-V377 WeakPolarHBondContact O-CB 3.2Å; I373-V377 VanDerWaalsContact O-CG2 3.28Å; I373-V377 WeakPolarHBondContact O-CG2 3.45Å; I373-V377 PolarHBondContact O-N 3.28Å; L374-V377 PolarHBondContact O-N 3.48Å; V377-T380 PolarHBondContact O-N 3.36Å; V377-V381 HydrophobicContact CG1-CG2 4.24Å; V377-V381 WeakPolarHBondContact O-CB 3.44Å; V377-V381 WeakPolarHBondContact O-CG2 3.27Å; V377-V381 PolarHBondContact O-N 3.49Å
378	E	53.2	Low	50.1	Low	5 Å²	5	23.4 Å²	23.4	2%	0.023	13%	0.128	C	C	.	.	H	α-helix	trans	-67.4	-44.5	-178.3	-77.1	-162.1	161.7	0	0	113.3	W298 C348 F351 T352 L374 T380 V381 A382	W298-E378 PolarHBondContact NE1-OE1 2.85Å; C348-E378 VanDerWaalsContact C-OE2 3.31Å; C348-E378 WeakPolarHBondContact CA-OE2 3.36Å; C348-E378 HydrophobicContact CB-CB 4.24Å; C348-E378 HydrophobicContact CB-CG 4.42Å; F351-E378 VanDerWaalsContact CD1-OE1 3.25Å; F351-E378 WeakPolarHBondContact CD1-OE1 3.23Å; T352-E378 PolarHBondContact OG1-OE2 3.35Å; L374-E378 HydrophobicContact CG-CG 4.34Å; L374-E378 VanDerWaalsContact O-CB 3.29Å; L374-E378 WeakPolarHBondContact O-CB 3.43Å; L374-E378 WeakPolarHBondContact O-CG 3.11Å; L374-E378 PolarHBondContact O-N 2.85Å; E378-T380 PolarHBondContact O-N 2.88Å; E378-V381 PolarHBondContact O-N 2.97Å; E378-A382 VanDerWaalsContact O-CB 3.24Å; E378-A382 WeakPolarHBondContact O-CB 3.22Å; E378-A382 PolarHBondContact O-N 2.72Å
379	V	51.3	Low	50.2	Low	75 Å²	75	23.3 Å²	23.3	46%	0.455	12%	0.123	S	C	.	.	H	α-helix	trans	-61	-39.5	175	168.7	0	0	0	0	110	S375 A382 H383	S375-V379 VanDerWaalsContact O-CB 3.23Å; S375-V379 WeakPolarHBondContact O-CB 3.13Å; S375-V379 WeakPolarHBondContact O-CG2 3.16Å; S375-V379 PolarHBondContact O-N 3.48Å; V379-A382 PolarHBondContact O-N 3.38Å; V379-H383 VanDerWaalsContact O-CB 3.23Å; V379-H383 WeakPolarHBondContact O-CB 3.14Å; V379-H383 PolarHBondContact O-N 2.82Å
380	T	50.7	Low	49.8	Very low	9 Å²	9	28.8 Å²	28.8	6%	0.055	15%	0.147	C	C	.	.	H	α-helix	trans	-66.5	-45.1	176.9	-55.7	0	0	0	0	111.2	T228 L231 L232 T376 V377 E378 H383 V384	T228-T380 HydrophobicContact CG2-CG2 4.06Å; T228-T380 WeakPolarHBondContact CG2-OG1 3.42Å; L231-T380 HydrophobicContact CB-CG2 4.3Å; L231-T380 HydrophobicContact CD1-CG2 4.26Å; L232-T380 HydrophobicContact CD2-CG2 3.83Å; L232-T380 HydrophobicContact CG-CG2 4.06Å; T376-T380 VanDerWaalsContact O-CB 3.31Å; T376-T380 WeakPolarHBondContact O-CB 3.36Å; T376-T380 PolarHBondContact O-N 2.76Å; T376-T380 PolarHBondContact O-OG1 3.48Å; V377-T380 PolarHBondContact O-N 3.36Å; E378-T380 PolarHBondContact O-N 2.88Å; T380-H383 PolarHBondContact O-N 3.35Å; T380-V384 HydrophobicContact CG2-CG2 4.25Å; T380-V384 VanDerWaalsContact O-CB 3.25Å; T380-V384 WeakPolarHBondContact O-CB 3.5Å; T380-V384 WeakPolarHBondContact O-CG2 3.27Å; T380-V384 PolarHBondContact O-N 2.94Å
381	V	52.7	Low	49.4	Very low	7 Å²	7	28.7 Å²	28.7	4%	0.042	15%	0.147	C	C	.	.	H	α-helix	trans	-62.3	-48	176.7	175.4	0	0	0	0	109.7	N263 Y302 V377 E378 H383 V384 M385	N263-V381 WeakPolarHBondContact ND2-CG2 2.99Å; Y302-V381 HydrophobicContact CE1-CG1 4.29Å; Y302-V381 WeakPolarHBondContact OH-CG1 3.34Å; V377-V381 HydrophobicContact CG1-CG2 4.24Å; V377-V381 WeakPolarHBondContact O-CB 3.44Å; V377-V381 WeakPolarHBondContact O-CG2 3.27Å; V377-V381 PolarHBondContact O-N 3.49Å; E378-V381 PolarHBondContact O-N 2.97Å; V381-H383 VanDerWaalsContact C-N 3.31Å; V381-H383 PolarHBondContact O-N 2.76Å; V381-V384 CarbonylContact O-C 3.59Å; V381-V384 WeakPolarHBondContact O-CB 3.46Å; V381-V384 PolarHBondContact O-N 3.23Å; V381-M385 HydrophobicContact CG1-CE 3.77Å; V381-M385 HydrophobicContact CG1-CG 4.02Å; V381-M385 HydrophobicContact CG1-SD 4.13Å; V381-M385 WeakPolarHBondContact O-CB 3.46Å; V381-M385 WeakPolarHBondContact O-CG 3.3Å; V381-M385 PolarHBondContact O-N 3.34Å
382	A	52.2	Low	48.8	Very low	16 Å²	16	28.1 Å²	28.1	13%	0.132	14%	0.144	C	C	.	.	H	α-helix	trans	-59	-41.2	177.1	0	0	0	0	0	112.1	P345 E378 V379 M385 H386	P345-A382 HydrophobicContact CB-CB 4Å; P345-A382 HydrophobicContact CG-CB 4.3Å; E378-A382 VanDerWaalsContact O-CB 3.24Å; E378-A382 WeakPolarHBondContact O-CB 3.22Å; E378-A382 PolarHBondContact O-N 2.72Å; V379-A382 PolarHBondContact O-N 3.38Å; A382-M385 WeakPolarHBondContact O-CB 3.43Å; A382-M385 PolarHBondContact O-N 2.95Å; A382-H386 VanDerWaalsContact O-CB 3.25Å; A382-H386 WeakPolarHBondContact O-CB 3.21Å; A382-H386 PolarHBondContact O-N 3.26Å
383	H	48.8	Very low	48.1	Very low	75 Å²	75	32.3 Å²	32.3	35%	0.347	17%	0.166	S	C	.	.	H	α-helix	trans	-67	-44.4	175.1	-174.1	73.6	0	0	0	112	V379 T380 V381 M385 H386 T387	V379-H383 VanDerWaalsContact O-CB 3.23Å; V379-H383 WeakPolarHBondContact O-CB 3.14Å; V379-H383 PolarHBondContact O-N 2.82Å; T380-H383 PolarHBondContact O-N 3.35Å; V381-H383 VanDerWaalsContact C-N 3.31Å; V381-H383 PolarHBondContact O-N 2.76Å; H383-M385 VanDerWaalsContact C-N 3.33Å; H383-H386 PolarHBondContact O-N 3.36Å; H383-T387 VanDerWaalsContact O-CB 3.28Å; H383-T387 WeakPolarHBondContact O-CB 3.23Å; H383-T387 PolarHBondContact O-N 3.09Å; H383-T387 PolarHBondContact O-OG1 2.78Å
384	V	49.3	Very low	47.5	Very low	8 Å²	8	32.8 Å²	32.8	5%	0.048	17%	0.169	C	C	.	.	H	α-helix	trans	-58.7	-46.4	173.3	161.3	0	0	0	0	110.5	L231 F235 T380 V381 T387 L388	L231-V384 HydrophobicContact CB-CG2 4.37Å; F235-V384 HydrophobicContact CB-CG2 4.39Å; F235-V384 HydrophobicContact CD1-CG1 4.27Å; F235-V384 HydrophobicContact CD2-CB 3.96Å; F235-V384 HydrophobicContact CD2-CG1 3.47Å; F235-V384 VanDerWaalsContact CD2-CG1 3.47Å; F235-V384 HydrophobicContact CD2-CG2 3.34Å; F235-V384 HydrophobicContact CE1-CG1 3.98Å; F235-V384 HydrophobicContact CE2-CB 4.13Å; F235-V384 HydrophobicContact CE2-CG1 3.16Å; F235-V384 HydrophobicContact CE2-CG2 3.87Å; F235-V384 HydrophobicContact CG-CB 4.45Å; F235-V384 HydrophobicContact CG-CG1 4.06Å; F235-V384 HydrophobicContact CG-CG2 3.96Å; F235-V384 HydrophobicContact CZ-CG1 3.44Å; F235-V384 VanDerWaalsContact CZ-CG1 3.44Å; T380-V384 HydrophobicContact CG2-CG2 4.25Å; T380-V384 VanDerWaalsContact O-CB 3.25Å; T380-V384 WeakPolarHBondContact O-CB 3.5Å; T380-V384 WeakPolarHBondContact O-CG2 3.27Å; T380-V384 PolarHBondContact O-N 2.94Å; V381-V384 CarbonylContact O-C 3.59Å; V381-V384 WeakPolarHBondContact O-CB 3.46Å; V381-V384 PolarHBondContact O-N 3.23Å; V384-T387 PolarHBondContact O-N 3.15Å; V384-L388 HydrophobicContact CG1-CD1 3.72Å; V384-L388 HydrophobicContact CG1-CG 4.35Å; V384-L388 VanDerWaalsContact O-CB 3.29Å; V384-L388 WeakPolarHBondContact O-CB 3.11Å; V384-L388 VanDerWaalsContact O-CG 3.3Å; V384-L388 WeakPolarHBondContact O-CG 3.39Å; V384-L388 PolarHBondContact O-N 3.43Å
385	M	51.3	Low	46.8	Very low	4 Å²	4	34 Å²	34	2%	0.02	18%	0.177	C	C	.	.	H	α-helix	trans	-58.1	-55.1	176	-67.9	-33.7	-155.4	0	0	109.7	F260 Y302 Y305 V381 A382 H383 T387 L388 F389	F260-M385 HydrophobicContact CE2-CE 3.69Å; F260-M385 HydrophobicContact CZ-CE 3.79Å; Y302-M385 HydrophobicContact CE1-CE 4.22Å; Y305-M385 HydrophobicContact CD1-CE 3.74Å; Y305-M385 HydrophobicContact CD2-CE 4.19Å; Y305-M385 HydrophobicContact CE1-CE 3.25Å; Y305-M385 HydrophobicContact CE1-SD 3.88Å; Y305-M385 HydrophobicContact CE2-CE 3.8Å; Y305-M385 HydrophobicContact CE2-SD 3.91Å; Y305-M385 HydrophobicContact CG-CE 4.14Å; Y305-M385 PolarHBondContact OH-SD 2.99Å; V381-M385 HydrophobicContact CG1-CE 3.77Å; V381-M385 HydrophobicContact CG1-CG 4.02Å; V381-M385 HydrophobicContact CG1-SD 4.13Å; V381-M385 WeakPolarHBondContact O-CB 3.46Å; V381-M385 WeakPolarHBondContact O-CG 3.3Å; V381-M385 PolarHBondContact O-N 3.34Å; A382-M385 WeakPolarHBondContact O-CB 3.43Å; A382-M385 PolarHBondContact O-N 2.95Å; H383-M385 VanDerWaalsContact C-N 3.33Å; M385-T387 PolarHBondContact O-N 3.47Å; M385-L388 CarbonylContact O-C 3.58Å; M385-L388 VanDerWaalsContact O-CB 3.3Å; M385-L388 WeakPolarHBondContact O-CB 3.43Å; M385-L388 PolarHBondContact O-N 3.05Å; M385-L388 VanDerWaalsContact O-N 3.14Å; M385-L388 HydrophobicContact SD-CD1 4.44Å; M385-F389 HydrophobicContact CB-CD2 4.16Å; M385-F389 HydrophobicContact CB-CE2 3.46Å; M385-F389 VanDerWaalsContact CB-CE2 3.46Å; M385-F389 HydrophobicContact CB-CZ 3.92Å; M385-F389 HydrophobicContact CG-CE2 4.41Å; M385-F389 WeakPolarHBondContact O-CB 3.42Å; M385-F389 WeakPolarHBondContact O-CD2 3.43Å; M385-F389 WeakPolarHBondContact O-CE2 3.08Å; M385-F389 WeakPolarHBondContact O-CG 3.41Å; M385-F389 PolarHBondContact O-N 2.68Å
386	H	49.3	Very low	46.1	Very low	89 Å²	89	35.6 Å²	35.6	41%	0.412	19%	0.185	S	C	.	.	H	α-helix	trans	-56.8	-37.6	178.1	176.8	-92.1	0	0	0	112.6	A382 H383 K390	A382-H386 VanDerWaalsContact O-CB 3.25Å; A382-H386 WeakPolarHBondContact O-CB 3.21Å; A382-H386 PolarHBondContact O-N 3.26Å; H383-H386 PolarHBondContact O-N 3.36Å; H386-K390 WeakPolarHBondContact CE1-CE 3.49Å; H386-K390 PolarHBondContact O-N 3.02Å
387	T	47.1	Very low	45.5	Very low	13 Å²	13	36 Å²	36	8%	0.08	19%	0.19	C	C	.	.	H	α-helix	trans	-74.8	-37.7	178.8	-53.3	0	0	0	0	112	H383 V384 M385 G391	H383-T387 VanDerWaalsContact O-CB 3.28Å; H383-T387 WeakPolarHBondContact O-CB 3.23Å; H383-T387 PolarHBondContact O-N 3.09Å; H383-T387 PolarHBondContact O-OG1 2.78Å; V384-T387 PolarHBondContact O-N 3.15Å; M385-T387 PolarHBondContact O-N 3.47Å; T387-G391 PolarHBondContact O-N 3.43Å
388	L	47.8	Very low	44.6	Very low	19 Å²	19	38.2 Å²	38.2	10%	0.099	20%	0.198	C	C	.	.	H	α-helix	trans	-58.3	-50	168.6	-83.5	164.7	0	0	0	110.4	F235 I248 V384 M385 G391 F392	F235-L388 HydrophobicContact CD1-CG 4.26Å; F235-L388 HydrophobicContact CE1-CD1 3.93Å; F235-L388 HydrophobicContact CE1-CD2 3.53Å; F235-L388 HydrophobicContact CE1-CG 3.48Å; F235-L388 VanDerWaalsContact CE1-CG 3.48Å; F235-L388 HydrophobicContact CZ-CD1 3.92Å; F235-L388 HydrophobicContact CZ-CD2 4.14Å; F235-L388 HydrophobicContact CZ-CG 4.01Å; I248-L388 HydrophobicContact CD1-CD2 3.13Å; I248-L388 HydrophobicContact CD1-CG 4.47Å; I248-L388 HydrophobicContact CG1-CD2 4.13Å; V384-L388 HydrophobicContact CG1-CD1 3.72Å; V384-L388 HydrophobicContact CG1-CG 4.35Å; V384-L388 VanDerWaalsContact O-CB 3.29Å; V384-L388 WeakPolarHBondContact O-CB 3.11Å; V384-L388 VanDerWaalsContact O-CG 3.3Å; V384-L388 WeakPolarHBondContact O-CG 3.39Å; V384-L388 PolarHBondContact O-N 3.43Å; M385-L388 CarbonylContact O-C 3.58Å; M385-L388 VanDerWaalsContact O-CB 3.3Å; M385-L388 WeakPolarHBondContact O-CB 3.43Å; M385-L388 PolarHBondContact O-N 3.05Å; M385-L388 VanDerWaalsContact O-N 3.14Å; M385-L388 HydrophobicContact SD-CD1 4.44Å; L388-G391 CarbonylContact O-C 3.56Å; L388-G391 WeakPolarHBondContact O-CA 3.49Å; L388-G391 PolarHBondContact O-N 3.02Å; L388-F392 HydrophobicContact CD2-CE2 4.39Å; L388-F392 WeakPolarHBondContact O-CD2 3.31Å; L388-F392 PolarHBondContact O-N 3.28Å
389	F	46.8	Very low	43.8	Very low	26 Å²	26	39.4 Å²	39.4	11%	0.114	21%	0.211	C	C	.	.	H	α-helix	trans	-60.8	-47.6	-179.8	-60.2	-44.5	0	0	0	111.6	Y305 F337 A341 M385 G391 F392 D393	Y305-F389 HydrophobicContact CD2-CZ 4.23Å; Y305-F389 AromaticContact CE2-CE1 3.79Å; Y305-F389 HydrophobicContact CE2-CE1 3.79Å; Y305-F389 AromaticContact CE2-CZ 3.6Å; Y305-F389 HydrophobicContact CE2-CZ 3.6Å; F337-F389 AromaticContact CD1-CD1 3.92Å; F337-F389 HydrophobicContact CD1-CD1 3.92Å; F337-F389 AromaticContact CD1-CE1 3.95Å; F337-F389 HydrophobicContact CD1-CE1 3.95Å; F337-F389 HydrophobicContact CD2-CE1 4.47Å; F337-F389 AromaticContact CE1-CD1 3.28Å; F337-F389 HydrophobicContact CE1-CD1 3.28Å; F337-F389 AromaticContact CE1-CE1 3.32Å; F337-F389 HydrophobicContact CE1-CE1 3.32Å; F337-F389 AromaticContact CE2-CE1 3.89Å; F337-F389 HydrophobicContact CE2-CE1 3.89Å; F337-F389 AromaticContact CZ-CD1 3.74Å; F337-F389 HydrophobicContact CZ-CD1 3.74Å; F337-F389 AromaticContact CZ-CE1 3.3Å; F337-F389 HydrophobicContact CZ-CE1 3.3Å; F337-F389 HydrophobicContact CZ-CZ 4.49Å; A341-F389 HydrophobicContact CB-CD1 3.56Å; A341-F389 HydrophobicContact CB-CD2 3.56Å; A341-F389 HydrophobicContact CB-CE1 3.27Å; A341-F389 HydrophobicContact CB-CE2 3.28Å; A341-F389 HydrophobicContact CB-CG 3.74Å; A341-F389 HydrophobicContact CB-CZ 3.18Å; A341-F389 WeakPolarHBondContact O-CE2 3.14Å; M385-F389 HydrophobicContact CB-CD2 4.16Å; M385-F389 HydrophobicContact CB-CE2 3.46Å; M385-F389 VanDerWaalsContact CB-CE2 3.46Å; M385-F389 HydrophobicContact CB-CZ 3.92Å; M385-F389 HydrophobicContact CG-CE2 4.41Å; M385-F389 WeakPolarHBondContact O-CB 3.42Å; M385-F389 WeakPolarHBondContact O-CD2 3.43Å; M385-F389 WeakPolarHBondContact O-CE2 3.08Å; M385-F389 WeakPolarHBondContact O-CG 3.41Å; M385-F389 PolarHBondContact O-N 2.68Å; F389-G391 PolarHBondContact O-N 3.2Å; F389-G391 VanDerWaalsContact O-N 3.15Å; F389-F392 PolarHBondContact O-N 3.28Å; F389-D393 PolarHBondContact O-N 2.94Å
390	K	40.4	Very low	42.9	Very low	118 Å²	118	40 Å²	40	51%	0.513	21%	0.212	S	C	.	.	H	α-helix	trans	-60.6	-24.2	170.5	-78.3	-169.1	172.4	-174.3	0	113.1	H386 N394	H386-K390 WeakPolarHBondContact CE1-CE 3.49Å; H386-K390 PolarHBondContact O-N 3.02Å; K390-N394 PolarHBondContact O-ND2 2.79Å
391	G	39.8	Very low	42.2	Very low	3 Å²	3	41.2 Å²	41.2	3%	0.031	22%	0.218	C	C	.	.	H	α-helix	trans	-76.5	-27.1	171.9	0	0	0	0	0	113.5	T387 L388 F389 N394	T387-G391 PolarHBondContact O-N 3.43Å; L388-G391 CarbonylContact O-C 3.56Å; L388-G391 WeakPolarHBondContact O-CA 3.49Å; L388-G391 PolarHBondContact O-N 3.02Å; F389-G391 PolarHBondContact O-N 3.2Å; F389-G391 VanDerWaalsContact O-N 3.15Å; G391-N394 PolarHBondContact O-N 2.75Å
392	F	38.5	Very low	41.1	Very low	45 Å²	45	46.3 Å²	46.3	20%	0.197	25%	0.249	C	C	.	.	H	α-helix	trans	-78.5	-32.6	-178.8	-84.2	-82.2	0	0	0	113.9	R245 L312 F337 L388 F389 N394	R245-F392 VanDerWaalsContact NH2-CA 3.3Å; R245-F392 PolarHBondContact NH2-O 3.14Å; L312-F392 HydrophobicContact CD2-CE1 4.26Å; F337-F392 HydrophobicContact CE1-CD2 4.19Å; L388-F392 HydrophobicContact CD2-CE2 4.39Å; L388-F392 WeakPolarHBondContact O-CD2 3.31Å; L388-F392 PolarHBondContact O-N 3.28Å; F389-F392 PolarHBondContact O-N 3.28Å; F392-N394 PolarHBondContact O-N 3.3Å
393	D	35.3	Very low	40.3	Very low	93 Å²	93	47.9 Å²	47.9	50%	0.497	26%	0.258	S	S	.	.	S	Bend	trans	-64.8	-15.5	172.9	-71.8	-21.1	0	0	0	113.3	F389 Y465	F389-D393 PolarHBondContact O-N 2.94Å; D393-Y465 HydrophobicContact CB-CE1 4.37Å
394	N	35.8	Very low	39.5	Very low	40 Å²	40	51.8 Å²	51.8	21%	0.214	28%	0.281	C	S	.	.	S	Bend	trans	-116	104.3	-166.3	-74	-40.5	0	0	0	111.7	A241 K390 G391 F392 Y465	A241-N394 HydrophobicContact CB-CB 3.36Å; A241-N394 WeakPolarHBondContact CB-O 3.45Å; K390-N394 PolarHBondContact O-ND2 2.79Å; G391-N394 PolarHBondContact O-N 2.75Å; F392-N394 PolarHBondContact O-N 3.3Å; N394-Y465 WeakPolarHBondContact OD1-CD1 3.32Å
395	C	39	Very low	38.8	Very low	29 Å²	29	55.3 Å²	55.3	20%	0.196	32%	0.319	C	S	.	.			trans	81	108	158.3	-150	0	0	0	0	116.1	L242 R245 D466	L242-C395 HydrophobicContact CD1-CB 4.04Å; L242-C395 HydrophobicContact CG-CB 4.33Å; R245-C395 PolarHBondContact NH1-O 3.24Å; C395-D466 PolarHBondContact SG-O 3.3Å; C395-D466 VanDerWaalsContact SG-O 3.36Å
396	I	36.2	Very low	38.1	Very low	45 Å²	45	60.2 Å²	60.2	23%	0.231	35%	0.354	C	S	.	.			trans	-112.8	125	156.8	-53.5	174.1	0	0	0	105.2	L329 F398 T467	L329-I396 HydrophobicContact CD2-CD1 3.81Å; I396-F398 HydrophobicContact CB-CE2 4.2Å; I396-F398 HydrophobicContact CG2-CD2 3.67Å; I396-F398 HydrophobicContact CG2-CE1 4.25Å; I396-F398 HydrophobicContact CG2-CE2 3.16Å; I396-F398 HydrophobicContact CG2-CG 4.41Å; I396-F398 HydrophobicContact CG2-CZ 3.49Å; I396-F398 VanDerWaalsContact CG2-CZ 3.49Å; I396-T467 WeakPolarHBondContact O-CA 3.43Å; I396-T467 WeakPolarHBondContact O-CG2 3.15Å
397	A	38.6	Very low	37.5	Very low	23 Å²	23	64.6 Å²	64.6	19%	0.19	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	123.8	172.1	0	0	0	0	0	107.2	I430	A397-I430 HydrophobicContact CB-CG2 4.14Å
398	F	32.7	Very low	37.2	Very low	61 Å²	61	68 Å²	68	27%	0.268	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	126.1	174.1	-69.7	-78.8	0	0	0	108.1	I396 F469	I396-F398 HydrophobicContact CB-CE2 4.2Å; I396-F398 HydrophobicContact CG2-CD2 3.67Å; I396-F398 HydrophobicContact CG2-CE1 4.25Å; I396-F398 HydrophobicContact CG2-CE2 3.16Å; I396-F398 HydrophobicContact CG2-CG 4.41Å; I396-F398 HydrophobicContact CG2-CZ 3.49Å; I396-F398 VanDerWaalsContact CG2-CZ 3.49Å; F398-F469 HydrophobicContact CB-CD1 4.24Å; F398-F469 HydrophobicContact CB-CE1 3.84Å; F398-F469 HydrophobicContact CB-CZ 4.36Å; F398-F469 HydrophobicContact CD2-CE1 4.28Å; F398-F469 HydrophobicContact CD2-CZ 4.01Å; F398-F469 HydrophobicContact CG-CE1 4.46Å
399	G	36.6	Very low	37	Very low	29 Å²	29	75.7 Å²	75.7	30%	0.299	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	127	165.3	0	0	0	0	0	108.7
400	L	31.5	Very low	37.1	Very low	87 Å²	87	76.7 Å²	76.7	46%	0.455	44%	0.44	S	S	.	.			trans	-126.4	122.6	171	-165.7	101.6	0	0	0	107.8	T402	L400-T402 HydrophobicContact CD2-CG2 3.82Å; L400-T402 HydrophobicContact CG-CG2 4.23Å
401	I	37	Very low	37.4	Very low	36 Å²	36	76.5 Å²	76.5	19%	0.185	45%	0.445	C	S	.	.			trans	-120.2	103	176.6	-54.8	167.2	0	0	0	107.8	P403 V435 F436 F437	I401-P403 WeakPolarHBondContact O-CD 3.44Å; I401-V435 HydrophobicContact CD1-CG1 4.05Å; I401-F436 WeakPolarHBondContact CG2-O 3.41Å; I401-F437 HydrophobicContact CD1-CD1 4.47Å; I401-F437 HydrophobicContact CD1-CE1 3.77Å; I401-F437 HydrophobicContact CD1-CE2 4.21Å; I401-F437 HydrophobicContact CD1-CZ 3.56Å
402	T	30.1	Very low	37.9	Very low	113 Å²	113	83.1 Å²	83.1	69%	0.693	48%	0.479	S	S	*	.			trans	-113.9	98	175	52.6	0	0	0	0	110	L400	L400-T402 HydrophobicContact CD2-CG2 3.82Å; L400-T402 HydrophobicContact CG-CG2 4.23Å
403	P	35.1	Very low	38.2	Very low	50 Å²	50	83.8 Å²	83.8	33%	0.325	49%	0.493	S	S	.	.			trans	-69.7	136.5	164.1	27.4	-29.2	0	0	0	109.3	I401 G405 L408 F436	I401-P403 WeakPolarHBondContact O-CD 3.44Å; P403-G405 PolarHBondContact O-N 3.28Å; P403-G405 VanDerWaalsContact O-N 3.14Å; P403-L408 HydrophobicContact CB-CD1 3.8Å; P403-L408 HydrophobicContact CB-CD2 4.04Å; P403-L408 HydrophobicContact CG-CD1 4.42Å; P403-L408 HydrophobicContact CG-CD2 4.03Å; P403-F436 HydrophobicContact CG-CB 4.16Å
404	N	31.6	Very low	38.9	Very low	157 Å²	157	79.5 Å²	79.5	84%	0.84	47%	0.471	S	S	*	.			trans	-64.2	117	-178.2	-130.2	-3.5	0	0	0	109.3	S406	N404-S406 PolarHBondContact O-N 3.03Å
405	G	34.2	Very low	39.7	Very low	82 Å²	82	82.3 Å²	82.3	85%	0.845	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	69.9	-157.1	0	0	0	0	0	116.5	P403	P403-G405 PolarHBondContact O-N 3.28Å; P403-G405 VanDerWaalsContact O-N 3.14Å
406	S	36.5	Very low	40.3	Very low	107 Å²	107	86.4 Å²	86.4	75%	0.748	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.4	-9.6	165.9	61.8	0	0	0	0	117.9	N404	N404-S406 PolarHBondContact O-N 3.03Å
407	Q	37.8	Very low	41	Very low	180 Å²	180	84.6 Å²	84.6	84%	0.841	49%	0.493	S	S	*	.	S	Bend	trans	-147.7	22.5	-175.3	-69.3	-168.8	-12.3	0	0	118.3	Q409	Q407-Q409 PolarHBondContact O-N 2.92Å
408	L	41	Very low	41.7	Very low	84 Å²	84	84 Å²	84	44%	0.44	49%	0.489	S	S	.	.			trans	-92.9	105.7	179.6	-88.8	87	0	0	0	113.6	P403	P403-L408 HydrophobicContact CB-CD1 3.8Å; P403-L408 HydrophobicContact CB-CD2 4.04Å; P403-L408 HydrophobicContact CG-CD1 4.42Å; P403-L408 HydrophobicContact CG-CD2 4.03Å
409	Q	43.2	Very low	42.7	Very low	182 Å²	182	83.8 Å²	83.8	85%	0.85	50%	0.498	S	S	*	.			trans	-83.3	119.3	148.1	-74.4	-176.9	-7.5	0	0	107.2	Q407 D411	Q407-Q409 PolarHBondContact O-N 2.92Å; Q409-D411 PolarHBondContact O-N 2.8Å
410	A	47.9	Very low	43.5	Very low	47 Å²	47	86.1 Å²	86.1	39%	0.388	50%	0.501	S	S	.	.			trans	-78.4	109.8	176.8	0	0	0	0	0	109	H415	A410-H415 WeakPolarHBondContact CB-NE2 3.33Å
411	D	48.1	Very low	44.5	Very low	113 Å²	113	82.5 Å²	82.5	60%	0.604	48%	0.482	S	S	*	.			trans	-73.7	152.3	170.3	-81.4	-16.4	0	0	0	111	Q409 A413 G414	Q409-D411 PolarHBondContact O-N 2.8Å; D411-A413 PolarHBondContact O-N 2.94Å; D411-G414 PolarHBondContact O-N 3.27Å
412	D	49.7	Very low	45.4	Very low	142 Å²	142	82.2 Å²	82.2	76%	0.759	49%	0.485	S	S	*	.	H	α-helix	trans	-49.2	-30.6	-176	-72.1	-30.6	0	0	0	114.2	H415 L416	D412-H415 PolarHBondContact O-N 3.13Å; D412-L416 PolarHBondContact O-N 3.33Å; D412-L416 VanDerWaalsContact O-N 3.15Å
413	A	44.4	Very low	46.4	Very low	59 Å²	59	81.3 Å²	81.3	49%	0.488	47%	0.471	S	S	.	.	H	α-helix	trans	-67.5	-37.9	177.8	0	0	0	0	0	113.2	D411 H415 L416 L417 P439	D411-A413 PolarHBondContact O-N 2.94Å; A413-H415 VanDerWaalsContact C-N 3.32Å; A413-L416 PolarHBondContact O-N 3.45Å; A413-L417 PolarHBondContact O-N 3.29Å; A413-L417 VanDerWaalsContact O-N 3.14Å; A413-P439 HydrophobicContact CB-CB 4.09Å
414	G	49.6	Very low	47.2	Very low	4 Å²	4	79.6 Å²	79.6	4%	0.041	46%	0.459	C	S	.	.	H	α-helix	trans	-66.3	-36.6	176.3	0	0	0	0	0	111.8	D411 L417 A418	D411-G414 PolarHBondContact O-N 3.27Å; G414-L417 PolarHBondContact O-N 3.1Å; G414-A418 WeakPolarHBondContact O-CB 3.11Å; G414-A418 PolarHBondContact O-N 3.29Å
415	H	52.7	Low	48.2	Very low	99 Å²	99	73.5 Å²	73.5	46%	0.458	43%	0.425	S	S	.	.	H	α-helix	trans	-65	-38.3	173.4	-73.8	-59.6	0	0	0	112.6	A410 D412 A413 A418 A419	A410-H415 WeakPolarHBondContact CB-NE2 3.33Å; D412-H415 PolarHBondContact O-N 3.13Å; A413-H415 VanDerWaalsContact C-N 3.32Å; H415-A418 PolarHBondContact O-N 3.19Å; H415-A419 WeakPolarHBondContact O-CB 3.36Å; H415-A419 PolarHBondContact O-N 3.31Å
416	L	51.5	Low	49	Very low	114 Å²	114	76.7 Å²	76.7	60%	0.597	42%	0.418	S	S	*	.	H	α-helix	trans	-65.2	-44.1	176.9	-157.1	98.5	0	0	0	111.6	D412 A413 A419 E420	D412-L416 PolarHBondContact O-N 3.33Å; D412-L416 VanDerWaalsContact O-N 3.15Å; A413-L416 PolarHBondContact O-N 3.45Å; L416-A419 PolarHBondContact O-N 3.45Å; L416-E420 PolarHBondContact O-N 3.34Å
417	L	51.2	Low	49.5	Very low	7 Å²	7	77.9 Å²	77.9	4%	0.037	41%	0.411	C	S	.	.	H	α-helix	trans	-64.5	-43.1	176.4	-178.7	57.1	0	0	0	111.6	A413 G414 A419 E420 L421 F437 M442 I444	A413-L417 PolarHBondContact O-N 3.29Å; A413-L417 VanDerWaalsContact O-N 3.14Å; G414-L417 PolarHBondContact O-N 3.1Å; L417-A419 VanDerWaalsContact C-N 3.31Å; L417-A419 PolarHBondContact O-N 2.7Å; L417-E420 PolarHBondContact O-N 3.06Å; L417-L421 HydrophobicContact CD1-CD1 3.71Å; L417-L421 HydrophobicContact CD1-CG 4.28Å; L417-L421 HydrophobicContact CG-CD1 3.88Å; L417-L421 WeakPolarHBondContact O-CB 3.21Å; L417-L421 PolarHBondContact O-N 3.23Å; L417-F437 HydrophobicContact CB-CD2 4.37Å; L417-F437 HydrophobicContact CD2-CB 4.1Å; L417-F437 HydrophobicContact CD2-CD1 4.05Å; L417-F437 HydrophobicContact CD2-CD2 4.34Å; L417-F437 HydrophobicContact CD2-CG 3.92Å; L417-F437 HydrophobicContact CG-CB 4.47Å; L417-F437 HydrophobicContact CG-CD1 4.5Å; L417-F437 HydrophobicContact CG-CD2 3.99Å; L417-F437 HydrophobicContact CG-CE2 4.36Å; L417-F437 HydrophobicContact CG-CG 4.08Å; L417-M442 HydrophobicContact CD2-CE 4.05Å; L417-I444 HydrophobicContact CD1-CB 4.41Å; L417-I444 HydrophobicContact CD1-CD1 4.05Å; L417-I444 HydrophobicContact CD1-CG1 3.85Å; L417-I444 HydrophobicContact CD1-CG2 4.16Å
418	A	53.8	Low	49.8	Very low	12 Å²	12	72 Å²	72	10%	0.099	38%	0.381	C	S	.	.	H	α-helix	trans	-57	-46.1	174.1	0	0	0	0	0	111.4	G414 H415 A422 V435 F437	G414-A418 WeakPolarHBondContact O-CB 3.11Å; G414-A418 PolarHBondContact O-N 3.29Å; H415-A418 PolarHBondContact O-N 3.19Å; A418-A422 WeakPolarHBondContact O-CB 3.31Å; A418-A422 PolarHBondContact O-N 3.49Å; A418-V435 HydrophobicContact CB-CB 4.16Å; A418-V435 HydrophobicContact CB-CG1 3.67Å; A418-V435 WeakPolarHBondContact CB-O 3.34Å; A418-F437 VanDerWaalsContact CA-CD2 3.48Å; A418-F437 HydrophobicContact CB-CD2 3.79Å; A418-F437 HydrophobicContact CB-CE2 4.31Å
419	A	54.2	Low	49.6	Very low	56 Å²	56	69.4 Å²	69.4	46%	0.463	38%	0.375	S	S	.	.	H	α-helix	trans	-64.8	-43.1	178.1	0	0	0	0	0	112.3	H415 L416 L417 A422 K423	H415-A419 WeakPolarHBondContact O-CB 3.36Å; H415-A419 PolarHBondContact O-N 3.31Å; L416-A419 PolarHBondContact O-N 3.45Å; L417-A419 VanDerWaalsContact C-N 3.31Å; L417-A419 PolarHBondContact O-N 2.7Å; A419-A422 PolarHBondContact O-N 2.78Å; A419-K423 WeakPolarHBondContact O-CB 3.12Å; A419-K423 PolarHBondContact O-N 3.21Å
420	E	51.6	Low	49.7	Very low	77 Å²	77	61.3 Å²	61.3	36%	0.36	34%	0.337	S	S	.	.	H	α-helix	trans	-71.2	-34.5	-178.2	-152.5	64	-158.1	0	0	111.8	L416 L417 K423 F424	L416-E420 PolarHBondContact O-N 3.34Å; L417-E420 PolarHBondContact O-N 3.06Å; E420-K423 IonicContact OE1-NZ 3.44Å; E420-K423 PolarHBondContact OE1-NZ 3.49Å; E420-K423 IonicContact OE2-NZ 2.83Å; E420-F424 VanDerWaalsContact O-CB 3.31Å; E420-F424 WeakPolarHBondContact O-CB 3.43Å; E420-F424 PolarHBondContact O-N 2.9Å
421	L	53.6	Low	49.2	Very low	12 Å²	12	65.7 Å²	65.7	6%	0.063	35%	0.349	C	S	.	.	H	α-helix	trans	-73.1	-44.6	172.2	-80.8	159.9	0	0	0	112.3	L417 K423 F424 F425 F437 L447 L451	L417-L421 HydrophobicContact CD1-CD1 3.71Å; L417-L421 HydrophobicContact CD1-CG 4.28Å; L417-L421 HydrophobicContact CG-CD1 3.88Å; L417-L421 WeakPolarHBondContact O-CB 3.21Å; L417-L421 PolarHBondContact O-N 3.23Å; L421-K423 PolarHBondContact O-N 2.97Å; L421-F424 CarbonylContact O-C 3.59Å; L421-F424 WeakPolarHBondContact O-CA 3.26Å; L421-F424 WeakPolarHBondContact O-CB 3.36Å; L421-F424 PolarHBondContact O-N 3.35Å; L421-F425 HydrophobicContact CB-CD2 4.22Å; L421-F425 HydrophobicContact CB-CE2 4.08Å; L421-F425 HydrophobicContact CD2-CE2 3.85Å; L421-F425 HydrophobicContact CD2-CZ 4.3Å; L421-F425 WeakPolarHBondContact O-CB 3.4Å; L421-F425 WeakPolarHBondContact O-CD2 3.07Å; L421-F425 WeakPolarHBondContact O-CG 3.23Å; L421-F425 PolarHBondContact O-N 3.03Å; L421-F437 HydrophobicContact CB-CE2 4.16Å; L421-F437 HydrophobicContact CB-CZ 4.45Å; L421-F437 HydrophobicContact CD1-CD2 4.28Å; L421-F437 HydrophobicContact CD1-CE1 3.88Å; L421-F437 HydrophobicContact CD1-CE2 3.32Å; L421-F437 HydrophobicContact CD1-CZ 3.15Å; L421-F437 HydrophobicContact CG-CE2 4.37Å; L421-F437 HydrophobicContact CG-CZ 4.39Å; L421-L447 HydrophobicContact CD1-CD2 3.47Å; L421-L447 VanDerWaalsContact CD1-CD2 3.47Å; L421-L447 HydrophobicContact CD2-CD2 3.74Å; L421-L447 HydrophobicContact CG-CD2 4.09Å; L421-L451 HydrophobicContact CD2-CD1 3.57Å
422	A	54.9	Low	48.8	Very low	29 Å²	29	62.2 Å²	62.2	24%	0.24	33%	0.332	C	S	.	.	H	α-helix	trans	-55.7	-42.1	172.6	0	0	0	0	0	110	A418 A419 H426	A418-A422 WeakPolarHBondContact O-CB 3.31Å; A418-A422 PolarHBondContact O-N 3.49Å; A419-A422 PolarHBondContact O-N 2.78Å; A422-H426 WeakPolarHBondContact O-CA 3.49Å; A422-H426 WeakPolarHBondContact O-CB 3.23Å; A422-H426 PolarHBondContact O-N 3.44Å
423	K	52	Low	48.1	Very low	95 Å²	95	60.2 Å²	60.2	41%	0.413	32%	0.321	S	S	.	.	H	α-helix	trans	-64.1	-44.4	172.8	-179.7	-178	169.5	-157.9	0	112.3	A419 E420 L421 H426 Q427	A419-K423 WeakPolarHBondContact O-CB 3.12Å; A419-K423 PolarHBondContact O-N 3.21Å; E420-K423 IonicContact OE1-NZ 3.44Å; E420-K423 PolarHBondContact OE1-NZ 3.49Å; E420-K423 IonicContact OE2-NZ 2.83Å; L421-K423 PolarHBondContact O-N 2.97Å; K423-H426 PolarHBondContact O-N 2.99Å; K423-Q427 VanDerWaalsContact O-CB 3.25Å; K423-Q427 WeakPolarHBondContact O-CB 3.39Å; K423-Q427 WeakPolarHBondContact O-CG 3.49Å; K423-Q427 PolarHBondContact O-N 3.16Å
424	F	50.8	Low	47.8	Very low	14 Å²	14	63.4 Å²	63.4	6%	0.061	33%	0.33	C	S	.	.	H	α-helix	trans	-60.3	-43.8	176.5	178	-84.4	0	0	0	112.6	E420 L421 R428 R448 L451 E452 F455	E420-F424 VanDerWaalsContact O-CB 3.31Å; E420-F424 WeakPolarHBondContact O-CB 3.43Å; E420-F424 PolarHBondContact O-N 2.9Å; L421-F424 CarbonylContact O-C 3.59Å; L421-F424 WeakPolarHBondContact O-CA 3.26Å; L421-F424 WeakPolarHBondContact O-CB 3.36Å; L421-F424 PolarHBondContact O-N 3.35Å; F424-R428 VanDerWaalsContact CE1-NH1 3.31Å; F424-R428 VanDerWaalsContact CE2-CZ 3.41Å; F424-R428 PolarHBondContact O-N 3.08Å; F424-R428 PolarHBondContact O-NH1 3.02Å; F424-R448 HydrophobicContact CD2-CG 4.34Å; F424-R448 HydrophobicContact CE2-CG 4.15Å; F424-L451 HydrophobicContact CD1-CD1 4.05Å; F424-L451 HydrophobicContact CE1-CB 3.6Å; F424-L451 HydrophobicContact CE1-CD1 3.73Å; F424-L451 HydrophobicContact CE1-CG 4.18Å; F424-L451 HydrophobicContact CE2-CB 4.2Å; F424-L451 HydrophobicContact CZ-CB 3.31Å; F424-L451 HydrophobicContact CZ-CD1 4.11Å; F424-L451 HydrophobicContact CZ-CG 4.32Å; F424-E452 HydrophobicContact CE2-CG 3.93Å; F424-E452 HydrophobicContact CZ-CG 4.34Å; F424-F455 HydrophobicContact CE1-CD2 4.27Å; F424-F455 AromaticContact CE1-CE2 3.88Å; F424-F455 HydrophobicContact CE1-CE2 3.88Å; F424-F455 HydrophobicContact CZ-CD2 4.26Å; F424-F455 HydrophobicContact CZ-CE2 4.32Å
425	F	52.6	Low	47.3	Very low	28 Å²	28	64.8 Å²	64.8	12%	0.123	34%	0.338	C	S	.	.	H	α-helix	trans	-72.5	-43.2	177.7	-71.5	-56.4	0	0	0	111.4	L421 Q427 R428 G429 I430 T432 L451 L470	L421-F425 HydrophobicContact CB-CD2 4.22Å; L421-F425 HydrophobicContact CB-CE2 4.08Å; L421-F425 HydrophobicContact CD2-CE2 3.85Å; L421-F425 HydrophobicContact CD2-CZ 4.3Å; L421-F425 WeakPolarHBondContact O-CB 3.4Å; L421-F425 WeakPolarHBondContact O-CD2 3.07Å; L421-F425 WeakPolarHBondContact O-CG 3.23Å; L421-F425 PolarHBondContact O-N 3.03Å; F425-Q427 PolarHBondContact O-N 2.97Å; F425-R428 CarbonylContact O-C 3.58Å; F425-R428 WeakPolarHBondContact O-CA 3.25Å; F425-R428 PolarHBondContact O-N 3.45Å; F425-G429 PolarHBondContact O-N 3.42Å; F425-I430 HydrophobicContact CB-CB 4.01Å; F425-I430 HydrophobicContact CB-CG2 4.3Å; F425-I430 HydrophobicContact CD1-CB 4.13Å; F425-I430 HydrophobicContact CD1-CD1 3.84Å; F425-I430 HydrophobicContact CD1-CG2 4.02Å; F425-I430 HydrophobicContact CE1-CD1 4.46Å; F425-I430 HydrophobicContact CG-CB 4.49Å; F425-I430 HydrophobicContact CG-CG2 4.41Å; F425-I430 PolarHBondContact O-N 3.38Å; F425-T432 HydrophobicContact CB-CG2 3.73Å; F425-T432 HydrophobicContact CD2-CG2 3.71Å; F425-T432 HydrophobicContact CG-CG2 3.88Å; F425-L451 HydrophobicContact CZ-CD1 4.27Å; F425-L470 HydrophobicContact CZ-CD2 4.38Å
426	H	51	Low	46.5	Very low	150 Å²	150	65 Å²	65	69%	0.694	34%	0.338	S	S	*	.	H	α-helix	trans	-61.2	-42.8	175.8	-172.5	74.3	0	0	0	111.8	A422 K423 R428 G429	A422-H426 WeakPolarHBondContact O-CA 3.49Å; A422-H426 WeakPolarHBondContact O-CB 3.23Å; A422-H426 PolarHBondContact O-N 3.44Å; K423-H426 PolarHBondContact O-N 2.99Å; H426-R428 PolarHBondContact O-N 2.84Å; H426-R428 VanDerWaalsContact O-N 3.16Å; H426-G429 PolarHBondContact O-N 3.45Å
427	Q	47.2	Very low	46	Very low	131 Å²	131	60.5 Å²	60.5	61%	0.612	31%	0.313	S	S	*	.	H	α-helix	trans	-59.8	-23.9	173.3	-78.3	175.8	-0.2	0	0	112.9	K423 F425	K423-Q427 VanDerWaalsContact O-CB 3.25Å; K423-Q427 WeakPolarHBondContact O-CB 3.39Å; K423-Q427 WeakPolarHBondContact O-CG 3.49Å; K423-Q427 PolarHBondContact O-N 3.16Å; F425-Q427 PolarHBondContact O-N 2.97Å
428	R	44.5	Very low	45.5	Very low	57 Å²	57	64.7 Å²	64.7	22%	0.215	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	4.2	176.1	-70.7	-176.2	174.4	76.2	-7.1	113.7	F424 F425 H426 I430	F424-R428 VanDerWaalsContact CE1-NH1 3.31Å; F424-R428 VanDerWaalsContact CE2-CZ 3.41Å; F424-R428 PolarHBondContact O-N 3.08Å; F424-R428 PolarHBondContact O-NH1 3.02Å; F425-R428 CarbonylContact O-C 3.58Å; F425-R428 WeakPolarHBondContact O-CA 3.25Å; F425-R428 PolarHBondContact O-N 3.45Å; H426-R428 PolarHBondContact O-N 2.84Å; H426-R428 VanDerWaalsContact O-N 3.16Å; R428-I430 VanDerWaalsContact C-N 3.3Å; R428-I430 HydrophobicContact CB-CD1 4.12Å; R428-I430 HydrophobicContact CB-CG1 4.35Å; R428-I430 PolarHBondContact O-N 3.08Å
429	G	38	Very low	45	Very low	29 Å²	29	66.2 Å²	66.2	30%	0.299	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.6	22.1	-179.2	0	0	0	0	0	114.5	F425 H426	F425-G429 PolarHBondContact O-N 3.42Å; H426-G429 PolarHBondContact O-N 3.45Å
430	I	43.7	Very low	44.3	Very low	12 Å²	12	70.8 Å²	70.8	6%	0.062	35%	0.353	C	S	.	.			trans	-90.8	122.6	176.9	-61.9	167.5	0	0	0	107.6	L242 A397 F425 R428 F455	L242-I430 HydrophobicContact CD2-CG1 3.69Å; A397-I430 HydrophobicContact CB-CG2 4.14Å; F425-I430 HydrophobicContact CB-CB 4.01Å; F425-I430 HydrophobicContact CB-CG2 4.3Å; F425-I430 HydrophobicContact CD1-CB 4.13Å; F425-I430 HydrophobicContact CD1-CD1 3.84Å; F425-I430 HydrophobicContact CD1-CG2 4.02Å; F425-I430 HydrophobicContact CE1-CD1 4.46Å; F425-I430 HydrophobicContact CG-CB 4.49Å; F425-I430 HydrophobicContact CG-CG2 4.41Å; F425-I430 PolarHBondContact O-N 3.38Å; R428-I430 VanDerWaalsContact C-N 3.3Å; R428-I430 HydrophobicContact CB-CD1 4.12Å; R428-I430 HydrophobicContact CB-CG1 4.35Å; R428-I430 PolarHBondContact O-N 3.08Å; I430-F455 HydrophobicContact CD1-CE1 4.14Å; I430-F455 HydrophobicContact CD1-CZ 3.59Å
431	H	39.3	Very low	44	Very low	140 Å²	140	71.5 Å²	71.5	65%	0.648	37%	0.367	S	S	*	.			trans	-79.5	127.7	176.4	-167.7	56.5	0	0	0	109.4	D433	H431-D433 IonicContact CD2-OD1 2.84Å; H431-D433 IonicContact NE2-OD1 3.51Å; H431-D433 PolarHBondContact NE2-OD1 3.35Å
432	T	37.7	Very low	43.6	Very low	39 Å²	39	72.9 Å²	72.9	24%	0.239	37%	0.373	C	S	.	.			trans	-115.7	117.8	177.4	53.4	0	0	0	0	108.2	F425	F425-T432 HydrophobicContact CB-CG2 3.73Å; F425-T432 HydrophobicContact CD2-CG2 3.71Å; F425-T432 HydrophobicContact CG-CG2 3.88Å
433	D	37	Very low	43.5	Very low	100 Å²	100	76 Å²	76	54%	0.535	39%	0.386	S	S	.	.			trans	-86.8	125.6	165	-73.5	-37.4	0	0	0	107.8	H431	H431-D433 IonicContact CD2-OD1 2.84Å; H431-D433 IonicContact NE2-OD1 3.51Å; H431-D433 PolarHBondContact NE2-OD1 3.35Å
434	D	36.7	Very low	43.4	Very low	127 Å²	127	74.8 Å²	74.8	68%	0.679	38%	0.383	S	S	*	.			trans	34	113.4	174.9	-74.3	-24.4	0	0	0	118.2	F436	D434-F436 HydrophobicContact CB-CD2 4.46Å; D434-F436 HydrophobicContact CB-CE2 4.06Å
435	V	39.7	Very low	43.5	Very low	33 Å²	33	79.4 Å²	79.4	20%	0.2	41%	0.408	C	S	.	.			trans	-113.6	102.2	-173.4	-179.4	0	0	0	0	109.7	I401 A418 F437	I401-V435 HydrophobicContact CD1-CG1 4.05Å; A418-V435 HydrophobicContact CB-CB 4.16Å; A418-V435 HydrophobicContact CB-CG1 3.67Å; A418-V435 WeakPolarHBondContact CB-O 3.34Å; V435-F437 HydrophobicContact CB-CE2 4.44Å; V435-F437 HydrophobicContact CG1-CD2 3.44Å; V435-F437 VanDerWaalsContact CG1-CD2 3.44Å; V435-F437 HydrophobicContact CG1-CE2 2.93Å; V435-F437 HydrophobicContact CG1-CZ 3.73Å
436	F	35.9	Very low	43.5	Very low	103 Å²	103	81.5 Å²	81.5	45%	0.452	42%	0.42	S	S	.	.			trans	-109.6	114.8	174.6	-69.6	-83.1	0	0	0	110.5	I401 P403 D434	I401-F436 WeakPolarHBondContact CG2-O 3.41Å; P403-F436 HydrophobicContact CG-CB 4.16Å; D434-F436 HydrophobicContact CB-CD2 4.46Å; D434-F436 HydrophobicContact CB-CE2 4.06Å
437	F	39.9	Very low	43.5	Very low	20 Å²	20	75.7 Å²	75.7	9%	0.088	40%	0.395	C	S	.	.			trans	-109.4	144	179.5	-76.2	-71.2	0	0	0	113	I401 L417 A418 L421 V435 M442 W483	I401-F437 HydrophobicContact CD1-CD1 4.47Å; I401-F437 HydrophobicContact CD1-CE1 3.77Å; I401-F437 HydrophobicContact CD1-CE2 4.21Å; I401-F437 HydrophobicContact CD1-CZ 3.56Å; L417-F437 HydrophobicContact CB-CD2 4.37Å; L417-F437 HydrophobicContact CD2-CB 4.1Å; L417-F437 HydrophobicContact CD2-CD1 4.05Å; L417-F437 HydrophobicContact CD2-CD2 4.34Å; L417-F437 HydrophobicContact CD2-CG 3.92Å; L417-F437 HydrophobicContact CG-CB 4.47Å; L417-F437 HydrophobicContact CG-CD1 4.5Å; L417-F437 HydrophobicContact CG-CD2 3.99Å; L417-F437 HydrophobicContact CG-CE2 4.36Å; L417-F437 HydrophobicContact CG-CG 4.08Å; A418-F437 VanDerWaalsContact CA-CD2 3.48Å; A418-F437 HydrophobicContact CB-CD2 3.79Å; A418-F437 HydrophobicContact CB-CE2 4.31Å; L421-F437 HydrophobicContact CB-CE2 4.16Å; L421-F437 HydrophobicContact CB-CZ 4.45Å; L421-F437 HydrophobicContact CD1-CD2 4.28Å; L421-F437 HydrophobicContact CD1-CE1 3.88Å; L421-F437 HydrophobicContact CD1-CE2 3.32Å; L421-F437 HydrophobicContact CD1-CZ 3.15Å; L421-F437 HydrophobicContact CG-CE2 4.37Å; L421-F437 HydrophobicContact CG-CZ 4.39Å; V435-F437 HydrophobicContact CB-CE2 4.44Å; V435-F437 HydrophobicContact CG1-CD2 3.44Å; V435-F437 VanDerWaalsContact CG1-CD2 3.44Å; V435-F437 HydrophobicContact CG1-CE2 2.93Å; V435-F437 HydrophobicContact CG1-CZ 3.73Å; F437-M442 HydrophobicContact CD1-CE 3.89Å; F437-M442 HydrophobicContact CE1-CE 4.06Å; F437-W483 HydrophobicContact CD1-CH2 4.35Å; F437-W483 AromaticContact CE1-CH2 3.75Å; F437-W483 HydrophobicContact CE1-CH2 3.75Å; F437-W483 HydrophobicContact CE1-CZ2 4.22Å
438	H	41.1	Very low	43.7	Very low	94 Å²	94	75.5 Å²	75.5	44%	0.435	39%	0.388	S	S	.	.			trans	-99	124.4	165.7	-166.6	48.5	0	0	0	108.9
439	P	44.1	Very low	44	Very low	45 Å²	45	78.5 Å²	78.5	29%	0.292	41%	0.405	S	S	.	.			trans	-80.7	-16.3	-166.4	28.1	-33.6	0	0	0	115.5	A413 S441	A413-P439 HydrophobicContact CB-CB 4.09Å; P439-S441 VanDerWaalsContact C-N 3.28Å; P439-S441 PolarHBondContact O-N 2.83Å
440	E	40.1	Very low	44.6	Very low	152 Å²	152	81.4 Å²	81.4	71%	0.71	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	3.6	-156.7	-66.8	-161.5	156.6	0	0	117.8
441	S	44.8	Very low	45	Very low	91 Å²	91	81.8 Å²	81.8	64%	0.636	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-148.9	9.9	175.8	64.9	0	0	0	0	117.4	P439	P439-S441 VanDerWaalsContact C-N 3.28Å; P439-S441 PolarHBondContact O-N 2.83Å
442	M	44.4	Very low	45.5	Very low	41 Å²	41	77.7 Å²	77.7	20%	0.202	39%	0.39	C	S	.	.			trans	-110.5	113.9	-179.2	-78.7	-155	-73.2	0	0	113.5	L417 F437 I444 L447 W483	L417-M442 HydrophobicContact CD2-CE 4.05Å; F437-M442 HydrophobicContact CD1-CE 3.89Å; F437-M442 HydrophobicContact CE1-CE 4.06Å; M442-I444 PolarHBondContact O-N 3.36Å; M442-L447 HydrophobicContact SD-CD1 4.12Å; M442-L447 HydrophobicContact SD-CD2 4.23Å; M442-W483 HydrophobicContact CE-CH2 4.26Å; M442-W483 HydrophobicContact CE-CZ2 3.34Å; M442-W483 HydrophobicContact SD-CZ2 4.01Å; M442-W483 PolarHBondContact SD-NE1 3.45Å; M442-W483 VanDerWaalsContact SD-NE1 3.45Å
443	D	53.3	Low	45.9	Very low	96 Å²	96	82.1 Å²	82.1	51%	0.513	41%	0.407	S	S	.	.			trans	-71.1	115.5	161.6	-176.8	1.4	0	0	0	109.8	L445 N446 L447	D443-L445 PolarHBondContact O-N 2.92Å; D443-L445 WeakPolarHBondContact OD1-CB 3.41Å; D443-L445 PolarHBondContact OD1-N 3.31Å; D443-N446 HydrophobicContact CB-CB 4.15Å; D443-N446 PolarHBondContact O-N 2.91Å; D443-N446 VanDerWaalsContact O-N 3.08Å; D443-L447 PolarHBondContact O-N 3.47Å; D443-L447 VanDerWaalsContact O-N 3.14Å
444	I	50.6	Low	46.3	Very low	68 Å²	68	80.2 Å²	80.2	35%	0.349	39%	0.394	S	S	.	.	H	α-helix	trans	-54.3	-37.7	179.4	-51.8	-167.2	0	0	0	111.2	L417 M442 R448	L417-I444 HydrophobicContact CD1-CB 4.41Å; L417-I444 HydrophobicContact CD1-CD1 4.05Å; L417-I444 HydrophobicContact CD1-CG1 3.85Å; L417-I444 HydrophobicContact CD1-CG2 4.16Å; M442-I444 PolarHBondContact O-N 3.36Å; I444-R448 VanDerWaalsContact O-CB 3.27Å; I444-R448 WeakPolarHBondContact O-CB 3.39Å; I444-R448 PolarHBondContact O-N 2.82Å
445	L	51.3	Low	46.7	Very low	112 Å²	112	77.3 Å²	77.3	59%	0.586	38%	0.376	S	S	*	.	H	α-helix	trans	-65.1	-42.2	-179.8	-76.7	161.8	0	0	0	111.1	D443 R448 Q449	D443-L445 PolarHBondContact O-N 2.92Å; D443-L445 WeakPolarHBondContact OD1-CB 3.41Å; D443-L445 PolarHBondContact OD1-N 3.31Å; L445-R448 PolarHBondContact O-N 3.31Å; L445-Q449 WeakPolarHBondContact O-CB 3.34Å; L445-Q449 WeakPolarHBondContact O-CG 3.32Å; L445-Q449 PolarHBondContact O-N 3.29Å
446	N	52.7	Low	46.9	Very low	71 Å²	71	82.7 Å²	82.7	38%	0.38	40%	0.399	S	S	.	.	H	α-helix	trans	-69	-43.3	-178.5	-156.4	-6.9	0	0	0	111	D443 R448 Q449 R450	D443-N446 HydrophobicContact CB-CB 4.15Å; D443-N446 PolarHBondContact O-N 2.91Å; D443-N446 VanDerWaalsContact O-N 3.08Å; N446-R448 PolarHBondContact O-N 3.06Å; N446-Q449 PolarHBondContact O-N 3.05Å; N446-R450 WeakPolarHBondContact O-CB 3.47Å; N446-R450 VanDerWaalsContact O-CG 3.23Å; N446-R450 WeakPolarHBondContact O-CG 3.38Å; N446-R450 PolarHBondContact O-N 3.13Å; N446-R450 PolarHBondContact OD1-NE 3.17Å
447	L	52.4	Low	46.7	Very low	29 Å²	29	80.3 Å²	80.3	15%	0.152	40%	0.395	C	S	.	.	H	α-helix	trans	-62.7	-44.6	175.6	-172.7	73.8	0	0	0	111.6	L421 M442 D443 R450 L451	L421-L447 HydrophobicContact CD1-CD2 3.47Å; L421-L447 VanDerWaalsContact CD1-CD2 3.47Å; L421-L447 HydrophobicContact CD2-CD2 3.74Å; L421-L447 HydrophobicContact CG-CD2 4.09Å; M442-L447 HydrophobicContact SD-CD1 4.12Å; M442-L447 HydrophobicContact SD-CD2 4.23Å; D443-L447 PolarHBondContact O-N 3.47Å; D443-L447 VanDerWaalsContact O-N 3.14Å; L447-R450 PolarHBondContact O-N 3.48Å; L447-L451 HydrophobicContact CG-CD1 4.17Å; L447-L451 WeakPolarHBondContact O-CB 3.33Å; L447-L451 WeakPolarHBondContact O-CG 3.03Å; L447-L451 PolarHBondContact O-N 3.01Å
448	R	50.1	Low	46.4	Very low	127 Å²	127	85.7 Å²	85.7	48%	0.479	43%	0.429	S	S	.	.	H	α-helix	trans	-61.5	-47.9	177.4	-179.6	178.7	173	178.4	-1.3	111.6	F424 I444 L445 N446 R450 L451 E452	F424-R448 HydrophobicContact CD2-CG 4.34Å; F424-R448 HydrophobicContact CE2-CG 4.15Å; I444-R448 VanDerWaalsContact O-CB 3.27Å; I444-R448 WeakPolarHBondContact O-CB 3.39Å; I444-R448 PolarHBondContact O-N 2.82Å; L445-R448 PolarHBondContact O-N 3.31Å; N446-R448 PolarHBondContact O-N 3.06Å; R448-R450 VanDerWaalsContact C-N 3.33Å; R448-R450 PolarHBondContact O-N 3.4Å; R448-L451 PolarHBondContact O-N 2.79Å; R448-E452 HydrophobicContact CG-CG 4.41Å; R448-E452 IonicContact CZ-OE1 3.48Å; R448-E452 IonicContact NE-OE1 3.96Å; R448-E452 PolarHBondContact NE-OE1 2.75Å; R448-E452 IonicContact NH2-OE1 3.5Å; R448-E452 PolarHBondContact NH2-OE1 3.38Å; R448-E452 WeakPolarHBondContact O-CB 3.46Å; R448-E452 WeakPolarHBondContact O-CG 3.4Å; R448-E452 PolarHBondContact O-N 3.04Å
449	Q	51.4	Low	46.2	Very low	120 Å²	120	83.2 Å²	83.2	56%	0.561	42%	0.421	S	S	*	.	H	α-helix	trans	-61.5	-41.3	177.4	-78.6	179.5	-3	0	0	111.8	L445 N446 E452 H453	L445-Q449 WeakPolarHBondContact O-CB 3.34Å; L445-Q449 WeakPolarHBondContact O-CG 3.32Å; L445-Q449 PolarHBondContact O-N 3.29Å; N446-Q449 PolarHBondContact O-N 3.05Å; Q449-E452 PolarHBondContact O-N 3.46Å; Q449-H453 VanDerWaalsContact O-CB 3.26Å; Q449-H453 WeakPolarHBondContact O-CB 3.49Å; Q449-H453 PolarHBondContact O-N 2.84Å
450	R	50.4	Low	45.7	Very low	89 Å²	89	91 Å²	91	34%	0.336	45%	0.453	S	S	.	.	H	α-helix	trans	-62.3	-45.2	175.8	-74.6	174.3	-176.7	-150	-5.3	111.7	N446 L447 R448 F454	N446-R450 WeakPolarHBondContact O-CB 3.47Å; N446-R450 VanDerWaalsContact O-CG 3.23Å; N446-R450 WeakPolarHBondContact O-CG 3.38Å; N446-R450 PolarHBondContact O-N 3.13Å; N446-R450 PolarHBondContact OD1-NE 3.17Å; L447-R450 PolarHBondContact O-N 3.48Å; R448-R450 VanDerWaalsContact C-N 3.33Å; R448-R450 PolarHBondContact O-N 3.4Å; R450-F454 WeakPolarHBondContact O-CB 2.98Å; R450-F454 PolarHBondContact O-N 3.35Å
451	L	51.6	Low	45.2	Very low	20 Å²	20	86.8 Å²	86.8	11%	0.105	44%	0.44	C	S	.	.	H	α-helix	trans	-64.5	-43.2	176	-69.9	169.1	0	0	0	111.3	L421 F424 F425 L447 R448 F454 F455	L421-L451 HydrophobicContact CD2-CD1 3.57Å; F424-L451 HydrophobicContact CD1-CD1 4.05Å; F424-L451 HydrophobicContact CE1-CB 3.6Å; F424-L451 HydrophobicContact CE1-CD1 3.73Å; F424-L451 HydrophobicContact CE1-CG 4.18Å; F424-L451 HydrophobicContact CE2-CB 4.2Å; F424-L451 HydrophobicContact CZ-CB 3.31Å; F424-L451 HydrophobicContact CZ-CD1 4.11Å; F424-L451 HydrophobicContact CZ-CG 4.32Å; F425-L451 HydrophobicContact CZ-CD1 4.27Å; L447-L451 HydrophobicContact CG-CD1 4.17Å; L447-L451 WeakPolarHBondContact O-CB 3.33Å; L447-L451 WeakPolarHBondContact O-CG 3.03Å; L447-L451 PolarHBondContact O-N 3.01Å; R448-L451 PolarHBondContact O-N 2.79Å; L451-F454 PolarHBondContact O-N 3.3Å; L451-F455 WeakPolarHBondContact O-CD2 3.45Å; L451-F455 PolarHBondContact O-N 2.92Å
452	E	50	Low	44.5	Very low	54 Å²	54	85.1 Å²	85.1	25%	0.252	44%	0.438	S	S	.	.	H	α-helix	trans	-59.8	-52.5	175.4	-76	174.1	178.5	0	0	111.3	F424 R448 Q449 F454 F455 E456	F424-E452 HydrophobicContact CE2-CG 3.93Å; F424-E452 HydrophobicContact CZ-CG 4.34Å; R448-E452 HydrophobicContact CG-CG 4.41Å; R448-E452 IonicContact CZ-OE1 3.48Å; R448-E452 IonicContact NE-OE1 3.96Å; R448-E452 PolarHBondContact NE-OE1 2.75Å; R448-E452 IonicContact NH2-OE1 3.5Å; R448-E452 PolarHBondContact NH2-OE1 3.38Å; R448-E452 WeakPolarHBondContact O-CB 3.46Å; R448-E452 WeakPolarHBondContact O-CG 3.4Å; R448-E452 PolarHBondContact O-N 3.04Å; Q449-E452 PolarHBondContact O-N 3.46Å; E452-F454 PolarHBondContact O-N 3.49Å; E452-F455 PolarHBondContact O-N 3.42Å; E452-E456 WeakPolarHBondContact O-CG 3.42Å; E452-E456 PolarHBondContact O-N 3.31Å
453	H	47.4	Very low	43.9	Very low	132 Å²	132	87.8 Å²	87.8	61%	0.611	47%	0.466	S	S	*	.	H	α-helix	trans	-58.5	-38.5	177.9	-169.9	62.3	0	0	0	112	Q449 E456 S457	Q449-H453 VanDerWaalsContact O-CB 3.26Å; Q449-H453 WeakPolarHBondContact O-CB 3.49Å; Q449-H453 PolarHBondContact O-N 2.84Å; H453-E456 CarbonylContact O-C 3.56Å; H453-E456 PolarHBondContact O-N 3.08Å; H453-S457 WeakPolarHBondContact O-CB 3.15Å; H453-S457 PolarHBondContact O-N 2.98Å
454	F	44.5	Very low	42.8	Very low	60 Å²	60	84.8 Å²	84.8	26%	0.263	46%	0.455	S	S	.	.	H	α-helix	trans	-65.9	-46.6	177.4	-178.5	-99	0	0	0	112.6	R450 L451 E452 E456 S457 Y468 L485	R450-F454 WeakPolarHBondContact O-CB 2.98Å; R450-F454 PolarHBondContact O-N 3.35Å; L451-F454 PolarHBondContact O-N 3.3Å; E452-F454 PolarHBondContact O-N 3.49Å; F454-E456 PolarHBondContact O-N 2.98Å; F454-S457 PolarHBondContact O-N 3.46Å; F454-S457 VanDerWaalsContact O-N 3.14Å; F454-S457 PolarHBondContact O-OG 3.14Å; F454-Y468 HydrophobicContact CE1-CD1 4.28Å; F454-Y468 HydrophobicContact CE1-CD2 4.18Å; F454-Y468 HydrophobicContact CE1-CE1 4.25Å; F454-Y468 HydrophobicContact CE1-CE2 4.1Å; F454-Y468 HydrophobicContact CE1-CG 4.23Å; F454-Y468 HydrophobicContact CE2-CE1 4.37Å; F454-Y468 AromaticContact CZ-CD1 3.72Å; F454-Y468 HydrophobicContact CZ-CD1 3.72Å; F454-Y468 HydrophobicContact CZ-CD2 4.32Å; F454-Y468 AromaticContact CZ-CE1 3.45Å; F454-Y468 HydrophobicContact CZ-CE1 3.45Å; F454-Y468 VanDerWaalsContact CZ-CE1 3.45Å; F454-Y468 HydrophobicContact CZ-CE2 4.05Å; F454-Y468 HydrophobicContact CZ-CG 4.13Å; F454-Y468 AromaticContact CZ-CZ 3.58Å; F454-L485 HydrophobicContact CD1-CD2 4.36Å; F454-L485 HydrophobicContact CD2-CD2 3.91Å; F454-L485 HydrophobicContact CE1-CD2 3.92Å; F454-L485 HydrophobicContact CE2-CD2 3.41Å; F454-L485 VanDerWaalsContact CE2-CD2 3.41Å; F454-L485 HydrophobicContact CG-CD2 4.35Å; F454-L485 HydrophobicContact CZ-CD2 3.41Å; F454-L485 VanDerWaalsContact CZ-CD2 3.41Å
455	F	46.3	Very low	42.2	Very low	66 Å²	66	87.3 Å²	87.3	29%	0.289	46%	0.461	S	S	.	.	H	α-helix	trans	-65.7	-21.8	175.4	-77.6	-67	0	0	0	113.3	F424 I430 L451 E452	F424-F455 HydrophobicContact CE1-CD2 4.27Å; F424-F455 AromaticContact CE1-CE2 3.88Å; F424-F455 HydrophobicContact CE1-CE2 3.88Å; F424-F455 HydrophobicContact CZ-CD2 4.26Å; F424-F455 HydrophobicContact CZ-CE2 4.32Å; I430-F455 HydrophobicContact CD1-CE1 4.14Å; I430-F455 HydrophobicContact CD1-CZ 3.59Å; L451-F455 WeakPolarHBondContact O-CD2 3.45Å; L451-F455 PolarHBondContact O-N 2.92Å; E452-F455 PolarHBondContact O-N 3.42Å
456	E	42.4	Very low	41.5	Very low	147 Å²	147	82.9 Å²	82.9	69%	0.687	44%	0.438	S	S	*	.	H	α-helix	trans	-89	-19.7	174.2	-69.7	177.6	-179	0	0	113.4	E452 H453 F454 V458	E452-E456 WeakPolarHBondContact O-CG 3.42Å; E452-E456 PolarHBondContact O-N 3.31Å; H453-E456 CarbonylContact O-C 3.56Å; H453-E456 PolarHBondContact O-N 3.08Å; F454-E456 PolarHBondContact O-N 2.98Å; E456-V458 PolarHBondContact O-N 2.88Å
457	S	32.8	Very low	40.9	Very low	53 Å²	53	81.2 Å²	81.2	37%	0.371	43%	0.43	S	S	.	.			trans	-67.3	126.6	-175.2	70.8	0	0	0	0	111.9	H453 F454 T459	H453-S457 WeakPolarHBondContact O-CB 3.15Å; H453-S457 PolarHBondContact O-N 2.98Å; F454-S457 PolarHBondContact O-N 3.46Å; F454-S457 VanDerWaalsContact O-N 3.14Å; F454-S457 PolarHBondContact O-OG 3.14Å; S457-T459 PolarHBondContact O-N 2.8Å
458	V	32.7	Very low	40.5	Very low	132 Å²	132	82 Å²	82	80%	0.8	43%	0.432	S	S	*	.			trans	-82.5	110.2	178.8	-176.4	0	0	0	0	108.2	E456	E456-V458 PolarHBondContact O-N 2.88Å
459	T	36.6	Very low	40.1	Very low	42 Å²	42	78 Å²	78	26%	0.258	42%	0.417	S	S	.	.			trans	-65.1	140.4	174.3	47.5	0	0	0	0	110.9	S457 S461 G462	S457-T459 PolarHBondContact O-N 2.8Å; T459-S461 CarbonylContact O-C 3.47Å; T459-S461 PolarHBondContact O-N 2.84Å; T459-S461 VanDerWaalsContact O-N 3.14Å; T459-S461 PolarHBondContact OG1-O 3.2Å; T459-G462 PolarHBondContact O-N 3.07Å
460	E	33.5	Very low	39.7	Very low	209 Å²	209	74.1 Å²	74.1	98%	0.977	40%	0.4	S	S	*	.	S	Bend	trans	-55.5	-31.1	-179.2	-70	-171.2	148.9	0	0	112.7	G462	E460-G462 PolarHBondContact O-N 3.5Å
461	S	30.8	Very low	39.3	Very low	63 Å²	63	72.7 Å²	72.7	44%	0.441	40%	0.395	S	S	.	.	S	Bend	trans	-88.5	77.6	167.5	57	0	0	0	0	109.7	T459 A463 A464	T459-S461 CarbonylContact O-C 3.47Å; T459-S461 PolarHBondContact O-N 2.84Å; T459-S461 VanDerWaalsContact O-N 3.14Å; T459-S461 PolarHBondContact OG1-O 3.2Å; S461-A463 PolarHBondContact O-N 3.45Å; S461-A464 PolarHBondContact O-N 2.94Å
462	G	30.1	Very low	38.8	Very low	56 Å²	56	75.6 Å²	75.6	58%	0.577	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-35.1	119.1	-170.6	0	0	0	0	0	115.2	T459 E460 A464	T459-G462 PolarHBondContact O-N 3.07Å; E460-G462 PolarHBondContact O-N 3.5Å; G462-A464 PolarHBondContact O-N 3.44Å
463	A	30.7	Very low	38.1	Very low	98 Å²	98	78.9 Å²	78.9	81%	0.81	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	18.1	171.6	0	0	0	0	0	117	S461	S461-A463 PolarHBondContact O-N 3.45Å
464	A	31.1	Very low	37.7	Very low	33 Å²	33	74.1 Å²	74.1	27%	0.273	41%	0.407	S	S	.	.			trans	-105.5	107.5	-174.9	0	0	0	0	0	109.7	S461 G462	S461-A464 PolarHBondContact O-N 2.94Å; G462-A464 PolarHBondContact O-N 3.44Å
465	Y	36.9	Very low	37.5	Very low	121 Å²	121	74.3 Å²	74.3	48%	0.475	42%	0.416	S	S	.	.			trans	51.1	108.8	154.3	-42	-80.8	0	0	0	117.4	D393 N394	D393-Y465 HydrophobicContact CB-CE1 4.37Å; N394-Y465 WeakPolarHBondContact OD1-CD1 3.32Å
466	D	37.6	Very low	37.2	Very low	18 Å²	18	75.4 Å²	75.4	10%	0.096	43%	0.428	C	S	.	.			trans	-151	115.9	161.4	-81.9	-41.8	0	0	0	112.7	C395 Y468 K487	C395-D466 PolarHBondContact SG-O 3.3Å; C395-D466 VanDerWaalsContact SG-O 3.36Å; D466-Y468 HydrophobicContact CB-CD1 4.19Å; D466-Y468 HydrophobicContact CB-CD2 3.94Å; D466-Y468 HydrophobicContact CB-CE1 3.51Å; D466-Y468 HydrophobicContact CB-CE2 3.25Å; D466-Y468 HydrophobicContact CB-CG 4.39Å; D466-Y468 WeakPolarHBondContact CB-OH 3.31Å; D466-Y468 VanDerWaalsContact O-CD2 3.31Å; D466-Y468 WeakPolarHBondContact O-CD2 3.27Å; D466-Y468 WeakPolarHBondContact O-CE2 3.49Å; D466-Y468 PolarHBondContact OD2-OH 2.91Å; D466-K487 WeakPolarHBondContact OD1-CD 3.12Å; D466-K487 WeakPolarHBondContact OD1-CE 3.42Å; D466-K487 WeakPolarHBondContact OD1-CG 3.39Å; D466-K487 IonicContact OD1-NZ 2.85Å; D466-K487 PolarHBondContact OD1-NZ 3.02Å; D466-K487 IonicContact OD2-NZ 3.75Å; D466-K487 PolarHBondContact OD2-NZ 2.93Å
467	T	39	Very low	36.9	Very low	36 Å²	36	72.2 Å²	72.2	22%	0.221	42%	0.419	C	S	.	.			trans	-80.6	114.9	164	-50.3	0	0	0	0	106.7	I396 F469 L488	I396-T467 WeakPolarHBondContact O-CA 3.43Å; I396-T467 WeakPolarHBondContact O-CG2 3.15Å; T467-F469 HydrophobicContact CG2-CD2 4.42Å; T467-F469 HydrophobicContact CG2-CE2 3.73Å; T467-L488 PolarHBondContact O-N 2.98Å
468	Y	45.3	Very low	37.2	Very low	47 Å²	47	73.5 Å²	73.5	18%	0.184	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	132.1	-177.4	-61.8	-74.1	0	0	0	110.9	F454 D466	F454-Y468 HydrophobicContact CE1-CD1 4.28Å; F454-Y468 HydrophobicContact CE1-CD2 4.18Å; F454-Y468 HydrophobicContact CE1-CE1 4.25Å; F454-Y468 HydrophobicContact CE1-CE2 4.1Å; F454-Y468 HydrophobicContact CE1-CG 4.23Å; F454-Y468 HydrophobicContact CE2-CE1 4.37Å; F454-Y468 AromaticContact CZ-CD1 3.72Å; F454-Y468 HydrophobicContact CZ-CD1 3.72Å; F454-Y468 HydrophobicContact CZ-CD2 4.32Å; F454-Y468 AromaticContact CZ-CE1 3.45Å; F454-Y468 HydrophobicContact CZ-CE1 3.45Å; F454-Y468 VanDerWaalsContact CZ-CE1 3.45Å; F454-Y468 HydrophobicContact CZ-CE2 4.05Å; F454-Y468 HydrophobicContact CZ-CG 4.13Å; F454-Y468 AromaticContact CZ-CZ 3.58Å; D466-Y468 HydrophobicContact CB-CD1 4.19Å; D466-Y468 HydrophobicContact CB-CD2 3.94Å; D466-Y468 HydrophobicContact CB-CE1 3.51Å; D466-Y468 HydrophobicContact CB-CE2 3.25Å; D466-Y468 HydrophobicContact CB-CG 4.39Å; D466-Y468 WeakPolarHBondContact CB-OH 3.31Å; D466-Y468 VanDerWaalsContact O-CD2 3.31Å; D466-Y468 WeakPolarHBondContact O-CD2 3.27Å; D466-Y468 WeakPolarHBondContact O-CE2 3.49Å; D466-Y468 PolarHBondContact OD2-OH 2.91Å
469	F	40.6	Very low	37.6	Very low	41 Å²	41	75.9 Å²	75.9	18%	0.18	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	118.7	170.5	-75.2	-100.7	0	0	0	108.9	F398 T467 L485 R486 L488	F398-F469 HydrophobicContact CB-CD1 4.24Å; F398-F469 HydrophobicContact CB-CE1 3.84Å; F398-F469 HydrophobicContact CB-CZ 4.36Å; F398-F469 HydrophobicContact CD2-CE1 4.28Å; F398-F469 HydrophobicContact CD2-CZ 4.01Å; F398-F469 HydrophobicContact CG-CE1 4.46Å; T467-F469 HydrophobicContact CG2-CD2 4.42Å; T467-F469 HydrophobicContact CG2-CE2 3.73Å; F469-L485 WeakPolarHBondContact O-CA 3.45Å; F469-R486 PolarHBondContact N-O 3.23Å; F469-R486 VanDerWaalsContact N-O 3.08Å; F469-R486 PolarHBondContact O-N 3.28Å; F469-L488 HydrophobicContact CD2-CD1 3.48Å; F469-L488 VanDerWaalsContact CD2-CD1 3.48Å; F469-L488 HydrophobicContact CE2-CD1 3.08Å; F469-L488 HydrophobicContact CE2-CG 4.47Å; F469-L488 HydrophobicContact CZ-CD1 3.9Å
470	L	42.7	Very low	37.8	Very low	39 Å²	39	77.8 Å²	77.8	20%	0.204	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	111.1	166.2	-174.9	72.7	0	0	0	107.3	F425 W483 L485	F425-L470 HydrophobicContact CZ-CD2 4.38Å; L470-W483 HydrophobicContact CD1-CE3 4.23Å; L470-W483 HydrophobicContact CD2-CZ3 4.46Å; L470-W483 HydrophobicContact CG-CE3 4.17Å; L470-W483 HydrophobicContact CG-CZ3 4.37Å; L470-L485 HydrophobicContact CB-CD1 3.95Å; L470-L485 HydrophobicContact CD1-CD1 3.83Å
471	Y	41.8	Very low	38.1	Very low	59 Å²	59	68.8 Å²	68.8	23%	0.231	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	141	173.8	72.5	-81.2	0	0	0	110.4	H473 M484 R486	Y471-H473 HydrophobicContact CD2-CB 3.92Å; Y471-H473 HydrophobicContact CE2-CB 3.64Å; Y471-M484 HydrophobicContact CD1-CB 4.38Å; Y471-M484 WeakPolarHBondContact CD1-O 3.32Å; Y471-M484 HydrophobicContact CE1-CB 3.74Å; Y471-M484 HydrophobicContact CE2-CB 4.1Å; Y471-M484 HydrophobicContact CE2-CE 3.85Å; Y471-M484 PolarHBondContact N-O 3.15Å; Y471-M484 VanDerWaalsContact N-O 3.17Å; Y471-M484 PolarHBondContact O-N 2.83Å; Y471-M484 VanDerWaalsContact O-O 3.12Å; Y471-M484 WeakPolarHBondContact OH-CE 3.14Å; Y471-M484 PolarHBondContact OH-SD 3.34Å; Y471-M484 VanDerWaalsContact OH-SD 3.4Å; Y471-R486 HydrophobicContact CE1-CB 4.18Å; Y471-R486 HydrophobicContact CE1-CG 4.07Å
472	Y	42.1	Very low	38.6	Very low	82 Å²	82	70.3 Å²	70.3	32%	0.322	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	126.4	169.7	177.7	-101.8	0	0	0	108.6	G481 W483	Y472-G481 WeakPolarHBondContact OH-CA 3.47Å; Y472-W483 AromaticContact CD2-CD2 3.9Å; Y472-W483 HydrophobicContact CD2-CD2 3.9Å; Y472-W483 AromaticContact CD2-CE2 3.57Å; Y472-W483 HydrophobicContact CD2-CE3 4.48Å; Y472-W483 HydrophobicContact CD2-CG 4.2Å; Y472-W483 HydrophobicContact CD2-CH2 4.46Å; Y472-W483 AromaticContact CD2-CZ2 3.87Å; Y472-W483 HydrophobicContact CD2-CZ2 3.87Å; Y472-W483 AromaticContact CD2-NE1 3.71Å; Y472-W483 HydrophobicContact CG-CH2 4.45Å; Y472-W483 HydrophobicContact CG-CZ2 4.26Å
473	H	35.4	Very low	39.2	Very low	123 Å²	123	70.1 Å²	70.1	57%	0.569	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.8	110.6	173.2	-169.8	39.9	0	0	0	110.1	Y471 E482 M484	Y471-H473 HydrophobicContact CD2-CB 3.92Å; Y471-H473 HydrophobicContact CE2-CB 3.64Å; H473-E482 PolarHBondContact N-O 2.94Å; H473-E482 PolarHBondContact O-N 3.45Å; H473-M484 HydrophobicContact CB-CE 3.52Å
474	G	38.5	Very low	39.6	Very low	32 Å²	32	66.7 Å²	66.7	33%	0.33	35%	0.352	S	S	.	.	S	Bend	trans	179.3	161.4	176.2	0	0	0	0	0	111.8
475	S	40	Very low	40.1	Very low	64 Å²	64	67 Å²	67	45%	0.448	35%	0.349	S	S	.	.			trans	-65.1	147.9	161.8	84.9	0	0	0	0	108.1	V477 T480	S475-V477 PolarHBondContact O-N 3.03Å; S475-V477 WeakPolarHBondContact OG-CB 3.35Å; S475-V477 WeakPolarHBondContact OG-CG2 3.5Å; S475-T480 PolarHBondContact OG-OG1 3.23Å
476	V	40.2	Very low	40.3	Very low	88 Å²	88	67.2 Å²	67.2	53%	0.533	35%	0.349	S	S	.	.	S	Bend	trans	-62.7	2.1	-179.8	-166.4	0	0	0	0	112.2
477	V	35.8	Very low	40.5	Very low	81 Å²	81	69.6 Å²	69.6	49%	0.491	36%	0.359	S	S	.	.	S	Bend	trans	-73	120.4	174.4	-173.2	0	0	0	0	108.9	S475 E479 T480	S475-V477 PolarHBondContact O-N 3.03Å; S475-V477 WeakPolarHBondContact OG-CB 3.35Å; S475-V477 WeakPolarHBondContact OG-CG2 3.5Å; V477-E479 PolarHBondContact O-N 2.82Å; V477-T480 PolarHBondContact O-N 2.9Å; V477-T480 PolarHBondContact O-OG1 3.32Å
478	P	40.2	Very low	40.5	Very low	80 Å²	80	71.8 Å²	71.8	52%	0.519	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-20.7	-167.3	16.3	-29.7	0	0	0	115.1
479	E	41.6	Very low	40.1	Very low	182 Å²	182	71.2 Å²	71.2	85%	0.85	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-4.6	-178.1	-61	-173.3	172.1	0	0	114.6	V477	V477-E479 PolarHBondContact O-N 2.82Å
480	T	40.1	Very low	39.9	Very low	82 Å²	82	75.4 Å²	75.4	50%	0.503	39%	0.391	S	S	.	.	S	Bend	trans	-126.1	2.6	-171.5	63.1	0	0	0	0	115.2	S475 V477	S475-T480 PolarHBondContact OG-OG1 3.23Å; V477-T480 PolarHBondContact O-N 2.9Å; V477-T480 PolarHBondContact O-OG1 3.32Å
481	G	39.3	Very low	39.7	Very low	19 Å²	19	82.2 Å²	82.2	20%	0.196	42%	0.421	C	S	.	.			trans	-90.3	119.4	-178.9	0	0	0	0	0	113.2	Y472	Y472-G481 WeakPolarHBondContact OH-CA 3.47Å
482	E	42.5	Very low	39.3	Very low	96 Å²	96	82.9 Å²	82.9	45%	0.449	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	129.3	173.2	-70.3	-174.1	177.8	0	0	110.7	H473 M484	H473-E482 PolarHBondContact N-O 2.94Å; H473-E482 PolarHBondContact O-N 3.45Å; E482-M484 PolarHBondContact O-N 3.14Å
483	W	41.2	Very low	38.7	Very low	51 Å²	51	87.3 Å²	87.3	19%	0.193	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	113.5	164.1	-73.1	91.5	0	0	0	108.2	F437 M442 L470 Y472	F437-W483 HydrophobicContact CD1-CH2 4.35Å; F437-W483 AromaticContact CE1-CH2 3.75Å; F437-W483 HydrophobicContact CE1-CH2 3.75Å; F437-W483 HydrophobicContact CE1-CZ2 4.22Å; M442-W483 HydrophobicContact CE-CH2 4.26Å; M442-W483 HydrophobicContact CE-CZ2 3.34Å; M442-W483 HydrophobicContact SD-CZ2 4.01Å; M442-W483 PolarHBondContact SD-NE1 3.45Å; M442-W483 VanDerWaalsContact SD-NE1 3.45Å; L470-W483 HydrophobicContact CD1-CE3 4.23Å; L470-W483 HydrophobicContact CD2-CZ3 4.46Å; L470-W483 HydrophobicContact CG-CE3 4.17Å; L470-W483 HydrophobicContact CG-CZ3 4.37Å; Y472-W483 AromaticContact CD2-CD2 3.9Å; Y472-W483 HydrophobicContact CD2-CD2 3.9Å; Y472-W483 AromaticContact CD2-CE2 3.57Å; Y472-W483 HydrophobicContact CD2-CE3 4.48Å; Y472-W483 HydrophobicContact CD2-CG 4.2Å; Y472-W483 HydrophobicContact CD2-CH2 4.46Å; Y472-W483 AromaticContact CD2-CZ2 3.87Å; Y472-W483 HydrophobicContact CD2-CZ2 3.87Å; Y472-W483 AromaticContact CD2-NE1 3.71Å; Y472-W483 HydrophobicContact CG-CH2 4.45Å; Y472-W483 HydrophobicContact CG-CZ2 4.26Å
484	M	40.5	Very low	38.6	Very low	26 Å²	26	85.9 Å²	85.9	13%	0.128	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	122.3	177.2	-79.4	-167.1	-85.5	0	0	110.3	Y471 H473 E482	Y471-M484 HydrophobicContact CD1-CB 4.38Å; Y471-M484 WeakPolarHBondContact CD1-O 3.32Å; Y471-M484 HydrophobicContact CE1-CB 3.74Å; Y471-M484 HydrophobicContact CE2-CB 4.1Å; Y471-M484 HydrophobicContact CE2-CE 3.85Å; Y471-M484 PolarHBondContact N-O 3.15Å; Y471-M484 VanDerWaalsContact N-O 3.17Å; Y471-M484 PolarHBondContact O-N 2.83Å; Y471-M484 VanDerWaalsContact O-O 3.12Å; Y471-M484 WeakPolarHBondContact OH-CE 3.14Å; Y471-M484 PolarHBondContact OH-SD 3.34Å; Y471-M484 VanDerWaalsContact OH-SD 3.4Å; H473-M484 HydrophobicContact CB-CE 3.52Å; E482-M484 PolarHBondContact O-N 3.14Å
485	L	40.2	Very low	38.5	Very low	41 Å²	41	87.4 Å²	87.4	22%	0.215	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	110	169.7	-168.8	75.6	0	0	0	108.2	F454 F469 L470	F454-L485 HydrophobicContact CD1-CD2 4.36Å; F454-L485 HydrophobicContact CD2-CD2 3.91Å; F454-L485 HydrophobicContact CE1-CD2 3.92Å; F454-L485 HydrophobicContact CE2-CD2 3.41Å; F454-L485 VanDerWaalsContact CE2-CD2 3.41Å; F454-L485 HydrophobicContact CG-CD2 4.35Å; F454-L485 HydrophobicContact CZ-CD2 3.41Å; F454-L485 VanDerWaalsContact CZ-CD2 3.41Å; F469-L485 WeakPolarHBondContact O-CA 3.45Å; L470-L485 HydrophobicContact CB-CD1 3.95Å; L470-L485 HydrophobicContact CD1-CD1 3.83Å
486	R	41.6	Very low	38.2	Very low	125 Å²	125	89.7 Å²	89.7	47%	0.472	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	127.1	177.7	-91.9	-174.4	175.7	178.6	0.7	111.5	F469 Y471	F469-R486 PolarHBondContact N-O 3.23Å; F469-R486 VanDerWaalsContact N-O 3.08Å; F469-R486 PolarHBondContact O-N 3.28Å; Y471-R486 HydrophobicContact CE1-CB 4.18Å; Y471-R486 HydrophobicContact CE1-CG 4.07Å
487	K	41.1	Very low	38.2	Very low	68 Å²	68	87.6 Å²	87.6	30%	0.296	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	121.8	161	169.4	168.9	174	137.9	0	108.2	D466 V495	D466-K487 WeakPolarHBondContact OD1-CD 3.12Å; D466-K487 WeakPolarHBondContact OD1-CE 3.42Å; D466-K487 WeakPolarHBondContact OD1-CG 3.39Å; D466-K487 IonicContact OD1-NZ 2.85Å; D466-K487 PolarHBondContact OD1-NZ 3.02Å; D466-K487 IonicContact OD2-NZ 3.75Å; D466-K487 PolarHBondContact OD2-NZ 2.93Å; K487-V495 HydrophobicContact CD-CG1 4.42Å
488	L	38.9	Very low	38.3	Very low	81 Å²	81	90.1 Å²	90.1	42%	0.424	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-73	129.2	173.7	-119.3	132.9	0	0	0	109.6	T467 F469 H490	T467-L488 PolarHBondContact O-N 2.98Å; F469-L488 HydrophobicContact CD2-CD1 3.48Å; F469-L488 VanDerWaalsContact CD2-CD1 3.48Å; F469-L488 HydrophobicContact CE2-CD1 3.08Å; F469-L488 HydrophobicContact CE2-CG 4.47Å; F469-L488 HydrophobicContact CZ-CD1 3.9Å; L488-H490 PolarHBondContact O-N 3.14Å
489	P	37.2	Very low	38.1	Very low	36 Å²	36	89.2 Å²	89.2	23%	0.234	49%	0.485	C	S	.	.	P	Polyproline II helix	trans	-67.8	125.8	-176	27.2	-36.9	0	0	0	112.2	Q491 K493 V495	P489-Q491 PolarHBondContact O-N 2.92Å; P489-K493 VanDerWaalsContact CB-C 3.42Å; P489-K493 WeakPolarHBondContact CB-O 3.44Å; P489-V495 HydrophobicContact CB-CG2 4.18Å
490	H	36.6	Very low	37.8	Very low	129 Å²	129	83.9 Å²	83.9	60%	0.597	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-62.9	120.6	164.6	-138.6	-34.4	0	0	0	107.9	L488	L488-H490 PolarHBondContact O-N 3.14Å
491	Q	38.3	Very low	37.4	Very low	182 Å²	182	87.3 Å²	87.3	85%	0.85	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	68.7	39.6	177.7	-53.8	-176.5	-9.3	0	0	116.6	P489 K493	P489-Q491 PolarHBondContact O-N 2.92Å; Q491-K493 PolarHBondContact O-N 2.83Å
492	G	33.1	Very low	37	Very low	73 Å²	73	92.2 Å²	92.2	75%	0.753	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	70.7	9.2	159.7	0	0	0	0	0	116.4
493	K	29.7	Very low	36.5	Very low	174 Å²	174	96.7 Å²	96.7	76%	0.757	53%	0.533	S	S	*	.			trans	-101.9	102.3	169.5	-76.9	-173.3	176.4	-179.7	0	110.2	P489 Q491 V495	P489-K493 VanDerWaalsContact CB-C 3.42Å; P489-K493 WeakPolarHBondContact CB-O 3.44Å; Q491-K493 PolarHBondContact O-N 2.83Å; K493-V495 PolarHBondContact O-N 3.42Å
494	A	34	Very low	36.2	Very low	93 Å²	93	99 Å²	99	77%	0.769	55%	0.55	S	S	*	.			trans	-42.1	119.6	178	0	0	0	0	0	112.3
495	V	36.2	Very low	36	Very low	64 Å²	64	102.8 Å²	102.8	39%	0.388	57%	0.572	S	S	.	*	P	Polyproline II helix	trans	-85	133	169.2	179.7	0	0	0	0	107	K487 P489 K493 S497	K487-V495 HydrophobicContact CD-CG1 4.42Å; P489-V495 HydrophobicContact CB-CG2 4.18Å; K493-V495 PolarHBondContact O-N 3.42Å; V495-S497 PolarHBondContact O-N 2.91Å
496	P	33.5	Very low	35.8	Very low	113 Å²	113	106.3 Å²	106.3	73%	0.734	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-59.5	134.2	179.8	21.4	-31	0	0	0	111.2
497	S	39.6	Very low	35.4	Very low	44 Å²	44	105.2 Å²	105.2	31%	0.308	60%	0.599	S	S	.	*	P	Polyproline II helix	trans	-66.2	134.4	172.8	38.1	0	0	0	0	110.1	V495 P499	V495-S497 PolarHBondContact O-N 2.91Å; S497-P499 VanDerWaalsContact O-CD 3.23Å; S497-P499 WeakPolarHBondContact O-CD 3.47Å
498	I	39	Very low	35.1	Very low	134 Å²	134	107.5 Å²	107.5	69%	0.687	62%	0.618	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-90	107.7	170.7	-57.5	172.1	0	0	0	106.4	L500	I498-L500 PolarHBondContact O-N 2.96Å
499	P	34.9	Very low	34.8	Very low	60 Å²	60	109.3 Å²	109.3	39%	0.39	63%	0.631	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-65.1	130.9	170.6	26.2	-30.6	0	0	0	108.8	S497 E501	S497-P499 VanDerWaalsContact O-CD 3.23Å; S497-P499 WeakPolarHBondContact O-CD 3.47Å; P499-E501 VanDerWaalsContact C-N 3.27Å; P499-E501 PolarHBondContact O-N 3.48Å; P499-E501 VanDerWaalsContact O-N 3.08Å
500	L	37.2	Very low	34.7	Very low	71 Å²	71	114.5 Å²	114.5	37%	0.372	66%	0.659	S	S	.	*			trans	-80.2	81.9	170.3	-73.9	164.2	0	0	0	107.3	I498 V502	I498-L500 PolarHBondContact O-N 2.96Å; L500-V502 PolarHBondContact O-N 3.37Å
501	E	30.4	Very low	34.5	Very low	153 Å²	153	113.4 Å²	113.4	72%	0.715	66%	0.664	S	S	*	*			trans	-54.7	132.4	178.6	-77.5	-177.7	167.2	0	0	110.9	P499	P499-E501 VanDerWaalsContact C-N 3.27Å; P499-E501 PolarHBondContact O-N 3.48Å; P499-E501 VanDerWaalsContact O-N 3.08Å
502	V	31.7	Very low	34.2	Very low	123 Å²	123	107.7 Å²	107.7	75%	0.745	65%	0.648	S	S	*	*			trans	-86	106.9	174.5	-177.3	0	0	0	0	106.8	L500	L500-V502 PolarHBondContact O-N 3.37Å
503	T	30.9	Very low	34.3	Very low	190 Å²	190	110.8 Å²	110.8	100%	1.166	64%	0.639	S	S	*	*			trans	-99.9	0	161.5	52.1	0	0	0	0	110.3

Retrieved 503 of 503 residues in 392 ms (Link to these results)

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