A0A3Q0KQN8_SCHMA Loading...

TLC domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KQN8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 382 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	38.2	Very low	48.7	Very low	242 Å²	242	99.9 Å²	99.9	100%	1.192	55%	0.549	S	S	*	.				0	15.3	0	-116.9	170.4	-170.9	0	0	113.7
2	V	40.7	Very low	49.2	Very low	122 Å²	122	96.4 Å²	96.4	74%	0.739	54%	0.537	S	S	*	.			trans	-97	-11.6	-176.9	178.7	0	0	0	0	113.3	G4	V2-G4 PolarHBondContact O-N 3.1Å
3	F	47.4	Very low	49.7	Very low	190 Å²	190	93.8 Å²	93.8	83%	0.833	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	2.5	-174.1	-68.8	-75.5	0	0	0	115.9
4	G	44.8	Very low	50.5	Low	53 Å²	53	89 Å²	89	55%	0.546	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-36.1	-175.3	0	0	0	0	0	114.7	V2	V2-G4 PolarHBondContact O-N 3.1Å
5	G	47.3	Very low	50.8	Low	51 Å²	51	92.5 Å²	92.5	53%	0.526	52%	0.516	S	S	.	.	H	α-helix	trans	-75	-49.2	-174.1	0	0	0	0	0	113.5	L7 E8 E9	G5-L7 PolarHBondContact O-N 3.42Å; G5-E8 PolarHBondContact O-N 3.44Å; G5-E9 PolarHBondContact O-N 3.35Å
6	D	56.3	Low	51	Low	110 Å²	110	93.8 Å²	93.8	59%	0.588	52%	0.517	S	S	*	.	H	α-helix	trans	-61.2	-29.4	-178.9	-72.2	-25.6	0	0	0	112.9	A10	D6-A10 WeakPolarHBondContact O-CB 3.38Å; D6-A10 PolarHBondContact O-N 3.43Å
7	L	51.1	Low	51.3	Low	44 Å²	44	88.9 Å²	88.9	23%	0.23	49%	0.489	C	S	.	.	H	α-helix	trans	-75.5	-39.1	-179.6	-170.3	69.7	0	0	0	112.3	G5 L11 Y153	G5-L7 PolarHBondContact O-N 3.42Å; L7-L11 HydrophobicContact CG-CD1 4.06Å; L7-L11 VanDerWaalsContact O-CB 3.28Å; L7-L11 WeakPolarHBondContact O-CB 3.47Å; L7-L11 WeakPolarHBondContact O-CD1 3.47Å; L7-L11 WeakPolarHBondContact O-CG 3.37Å; L7-L11 PolarHBondContact O-N 3.29Å; L7-Y153 HydrophobicContact CD1-CD1 4.41Å; L7-Y153 HydrophobicContact CD1-CE1 4.22Å
8	E	49.8	Very low	51.5	Low	105 Å²	105	92.8 Å²	92.8	49%	0.491	50%	0.496	S	S	.	.	H	α-helix	trans	-67.2	-39.9	176.2	-84.9	-103.4	155.7	0	0	111.1	G5 L11 S12 R18	G5-E8 PolarHBondContact O-N 3.44Å; E8-L11 PolarHBondContact O-N 3.05Å; E8-S12 PolarHBondContact O-N 2.97Å; E8-R18 IonicContact OE2-NH2 3.84Å
9	E	53.2	Low	52.1	Low	137 Å²	137	98.4 Å²	98.4	64%	0.64	51%	0.509	S	S	*	.	H	α-helix	trans	-70.6	-40.7	176.5	-162	169	-169.5	0	0	111.6	G5 L11 S12 A13	G5-E9 PolarHBondContact O-N 3.35Å; E9-L11 PolarHBondContact O-N 3.07Å; E9-S12 VanDerWaalsContact O-CB 3.31Å; E9-S12 WeakPolarHBondContact O-CB 3.34Å; E9-S12 PolarHBondContact O-N 3.28Å; E9-S12 VanDerWaalsContact O-N 3.1Å; E9-S12 PolarHBondContact O-OG 2.84Å; E9-A13 PolarHBondContact O-N 2.88Å
10	A	52.7	Low	52.7	Low	5 Å²	5	95.5 Å²	95.5	4%	0.041	50%	0.504	C	S	.	.	H	α-helix	trans	-63.1	-38.6	173	0	0	0	0	0	113.2	D6 S12 A13 F14 Y232	D6-A10 WeakPolarHBondContact O-CB 3.38Å; D6-A10 PolarHBondContact O-N 3.43Å; A10-S12 VanDerWaalsContact C-N 3.26Å; A10-S12 PolarHBondContact O-N 2.95Å; A10-A13 WeakPolarHBondContact O-CB 3.28Å; A10-A13 PolarHBondContact O-N 3.49Å; A10-F14 WeakPolarHBondContact O-CD2 3.29Å; A10-Y232 HydrophobicContact CB-CD1 3.25Å; A10-Y232 HydrophobicContact CB-CD2 4Å; A10-Y232 HydrophobicContact CB-CE1 3.52Å; A10-Y232 HydrophobicContact CB-CE2 4.25Å; A10-Y232 HydrophobicContact CB-CG 3.5Å
11	L	53.6	Low	53.9	Low	40 Å²	40	93.3 Å²	93.3	21%	0.209	50%	0.495	C	S	.	.	H	α-helix	trans	-71.7	-22.9	175	-72.9	169.3	0	0	0	112	L7 E8 E9 A13 F14 L17	L7-L11 HydrophobicContact CG-CD1 4.06Å; L7-L11 VanDerWaalsContact O-CB 3.28Å; L7-L11 WeakPolarHBondContact O-CB 3.47Å; L7-L11 WeakPolarHBondContact O-CD1 3.47Å; L7-L11 WeakPolarHBondContact O-CG 3.37Å; L7-L11 PolarHBondContact O-N 3.29Å; E8-L11 PolarHBondContact O-N 3.05Å; E9-L11 PolarHBondContact O-N 3.07Å; L11-A13 VanDerWaalsContact C-N 3.29Å; L11-F14 CarbonylContact O-C 3.48Å; L11-F14 VanDerWaalsContact O-C 3.32Å; L11-F14 PolarHBondContact O-N 3.17Å; L11-F14 VanDerWaalsContact O-N 3.17Å; L11-L17 HydrophobicContact CD2-CD1 3.9Å
12	S	55.5	Low	56	Low	58 Å²	58	88.2 Å²	88.2	41%	0.406	47%	0.467	S	S	.	.	H	α-helix	trans	-66.4	-31.3	172.9	84.4	0	0	0	0	112.4	E8 E9 A10 F14 E15	E8-S12 PolarHBondContact O-N 2.97Å; E9-S12 VanDerWaalsContact O-CB 3.31Å; E9-S12 WeakPolarHBondContact O-CB 3.34Å; E9-S12 PolarHBondContact O-N 3.28Å; E9-S12 VanDerWaalsContact O-N 3.1Å; E9-S12 PolarHBondContact O-OG 2.84Å; A10-S12 VanDerWaalsContact C-N 3.26Å; A10-S12 PolarHBondContact O-N 2.95Å; S12-F14 PolarHBondContact O-N 3.06Å; S12-E15 PolarHBondContact O-N 2.89Å
13	A	54.8	Low	58.2	Low	63 Å²	63	82.8 Å²	82.8	52%	0.521	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-18.8	173.2	0	0	0	0	0	113	E9 A10 L11	E9-A13 PolarHBondContact O-N 2.88Å; A10-A13 WeakPolarHBondContact O-CB 3.28Å; A10-A13 PolarHBondContact O-N 3.49Å; L11-A13 VanDerWaalsContact C-N 3.29Å
14	F	61.3	Low	60.2	Low	26 Å²	26	80.4 Å²	80.4	11%	0.114	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.7	62.8	173.5	-57.5	-77.5	0	0	0	109	A10 L11 S12 E16 L17 I100 I228 C229	A10-F14 WeakPolarHBondContact O-CD2 3.29Å; L11-F14 CarbonylContact O-C 3.48Å; L11-F14 VanDerWaalsContact O-C 3.32Å; L11-F14 PolarHBondContact O-N 3.17Å; L11-F14 VanDerWaalsContact O-N 3.17Å; S12-F14 PolarHBondContact O-N 3.06Å; F14-E16 PolarHBondContact O-N 3.41Å; F14-L17 HydrophobicContact CB-CB 4.1Å; F14-L17 HydrophobicContact CB-CD1 3.44Å; F14-L17 VanDerWaalsContact CB-CD1 3.44Å; F14-L17 HydrophobicContact CB-CG 3.62Å; F14-L17 HydrophobicContact CD2-CD1 4.06Å; F14-L17 HydrophobicContact CG-CD1 3.81Å; F14-L17 HydrophobicContact CG-CG 4.43Å; F14-L17 WeakPolarHBondContact O-CA 3.42Å; F14-L17 VanDerWaalsContact O-CB 3.3Å; F14-L17 WeakPolarHBondContact O-CB 3.43Å; F14-L17 PolarHBondContact O-N 3.49Å; F14-I100 HydrophobicContact CD1-CG2 3.8Å; F14-I100 HydrophobicContact CE1-CG2 3.59Å; F14-I228 HydrophobicContact CE1-CB 4.38Å; F14-I228 HydrophobicContact CE1-CG2 4.04Å; F14-I228 HydrophobicContact CE2-CG2 3.75Å; F14-I228 HydrophobicContact CZ-CB 3.83Å; F14-I228 HydrophobicContact CZ-CG2 3.28Å; F14-C229 VanDerWaalsContact CZ-SG 3.51Å
15	E	55.6	Low	62.5	Low	142 Å²	142	82 Å²	82	66%	0.664	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-51.6	-22.8	-175.3	-163.1	160.3	-169.3	0	0	113.8	S12 R18	S12-E15 PolarHBondContact O-N 2.89Å; E15-R18 PolarHBondContact O-N 3.43Å
16	E	53.4	Low	64.8	Low	113 Å²	113	79.9 Å²	79.9	53%	0.528	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-69.4	-35.2	170.6	-64.5	-168.9	156.2	0	0	114.2	F14 R18 R19	F14-E16 PolarHBondContact O-N 3.41Å; E16-R18 PolarHBondContact O-N 2.86Å; E16-R18 VanDerWaalsContact O-N 3.16Å; E16-R19 PolarHBondContact O-N 3.34Å
17	L	56.6	Low	66.7	Low	10 Å²	10	76.9 Å²	76.9	5%	0.052	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-63.5	-20.3	174.6	-65.7	-179.2	0	0	0	112.4	L11 F14 V102 R154	L11-L17 HydrophobicContact CD2-CD1 3.9Å; F14-L17 HydrophobicContact CB-CB 4.1Å; F14-L17 HydrophobicContact CB-CD1 3.44Å; F14-L17 VanDerWaalsContact CB-CD1 3.44Å; F14-L17 HydrophobicContact CB-CG 3.62Å; F14-L17 HydrophobicContact CD2-CD1 4.06Å; F14-L17 HydrophobicContact CG-CD1 3.81Å; F14-L17 HydrophobicContact CG-CG 4.43Å; F14-L17 WeakPolarHBondContact O-CA 3.42Å; F14-L17 VanDerWaalsContact O-CB 3.3Å; F14-L17 WeakPolarHBondContact O-CB 3.43Å; F14-L17 PolarHBondContact O-N 3.49Å; L17-V102 HydrophobicContact CD2-CG2 3.46Å; L17-V102 VanDerWaalsContact CD2-CG2 3.46Å; L17-R154 HydrophobicContact CD2-CB 3.85Å; L17-R154 WeakPolarHBondContact CD2-O 3.39Å; L17-R154 PolarHBondContact O-NE 2.92Å; L17-R154 PolarHBondContact O-NH2 3.39Å
18	R	54.8	Low	68.8	Low	160 Å²	160	82 Å²	82	60%	0.604	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-83.1	-21.1	-178.3	-158.8	175.8	-177	120.3	4.3	113.2	E8 E15 E16	E8-R18 IonicContact OE2-NH2 3.84Å; E15-R18 PolarHBondContact O-N 3.43Å; E16-R18 PolarHBondContact O-N 2.86Å; E16-R18 VanDerWaalsContact O-N 3.16Å
19	R	61.8	Low	71.1	Confident	199 Å²	199	80.6 Å²	80.6	75%	0.751	39%	0.385	S	S	*	.	S	Bend	trans	-79.2	-17	-174.2	-60.4	-172.9	-157	166.9	8.5	114.3	E16	E16-R19 PolarHBondContact O-N 3.34Å
20	G	66	Low	73.2	Confident	39 Å²	39	74.5 Å²	74.5	40%	0.402	36%	0.357	S	S	.	.	S	Bend	trans	-98.2	171.4	-179.9	0	0	0	0	0	114.5	K22	G20-K22 PolarHBondContact O-N 3.43Å
21	P	76.4	Confident	75.4	Confident	50 Å²	50	79.3 Å²	79.3	33%	0.325	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-52.7	140.3	173	-24.1	32.8	0	0	0	112	Y25 Y26	P21-Y25 HydrophobicContact CB-CD1 3.55Å; P21-Y25 HydrophobicContact CB-CD2 4.26Å; P21-Y25 HydrophobicContact CB-CE1 4.29Å; P21-Y25 HydrophobicContact CB-CG 3.56Å; P21-Y25 HydrophobicContact CG-CD1 4.14Å; P21-Y25 HydrophobicContact CG-CE1 4.4Å; P21-Y25 HydrophobicContact CG-CG 4.4Å; P21-Y26 HydrophobicContact CB-CE2 4.08Å; P21-Y26 WeakPolarHBondContact O-CE2 3.46Å
22	K	82.5	Confident	77.5	Confident	135 Å²	135	82 Å²	82	59%	0.587	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-61.7	159.5	177.3	-64.5	-170.5	179.1	-170.7	0	111	G20 E24 Y25	G20-K22 PolarHBondContact O-N 3.43Å; K22-E24 PolarHBondContact O-N 3.32Å; K22-E24 VanDerWaalsContact O-N 3.09Å; K22-Y25 VanDerWaalsContact O-CB 3.27Å; K22-Y25 WeakPolarHBondContact O-CB 3.48Å; K22-Y25 PolarHBondContact O-N 2.89Å
23	A	87	Confident	79.5	Confident	9 Å²	9	79.8 Å²	79.8	7%	0.074	39%	0.385	C	S	.	.	H	α-helix	trans	-53.1	-34.4	177.5	0	0	0	0	0	112.8	Y25 Y26 F27	A23-Y25 VanDerWaalsContact C-N 3.26Å; A23-Y25 PolarHBondContact O-N 3.45Å; A23-Y26 PolarHBondContact O-N 2.87Å; A23-F27 HydrophobicContact CB-CD2 4.29Å; A23-F27 HydrophobicContact CB-CE2 4.05Å; A23-F27 WeakPolarHBondContact O-CD2 3.35Å; A23-F27 PolarHBondContact O-N 3.23Å
24	E	90.2	Very high	81.6	Confident	140 Å²	140	79.6 Å²	79.6	65%	0.654	37%	0.372	S	S	*	.	H	α-helix	trans	-54.3	-39.3	174.2	-67.3	173.4	-164.1	0	0	113.4	K22 Y26 F27 K28	K22-E24 PolarHBondContact O-N 3.32Å; K22-E24 VanDerWaalsContact O-N 3.09Å; E24-Y26 VanDerWaalsContact C-N 3.32Å; E24-Y26 PolarHBondContact O-N 3.27Å; E24-F27 PolarHBondContact O-N 2.89Å; E24-K28 WeakPolarHBondContact O-CG 3.37Å; E24-K28 PolarHBondContact O-N 3.44Å; E24-K28 VanDerWaalsContact O-N 3.07Å
25	Y	92.9	Very high	83.3	Confident	87 Å²	87	79.8 Å²	79.8	34%	0.341	38%	0.382	S	S	.	.	H	α-helix	trans	-60.7	-44.4	176.1	171.4	-86.5	0	0	0	111	P21 K22 A23 K28 W29 H104	P21-Y25 HydrophobicContact CB-CD1 3.55Å; P21-Y25 HydrophobicContact CB-CD2 4.26Å; P21-Y25 HydrophobicContact CB-CE1 4.29Å; P21-Y25 HydrophobicContact CB-CG 3.56Å; P21-Y25 HydrophobicContact CG-CD1 4.14Å; P21-Y25 HydrophobicContact CG-CE1 4.4Å; P21-Y25 HydrophobicContact CG-CG 4.4Å; K22-Y25 VanDerWaalsContact O-CB 3.27Å; K22-Y25 WeakPolarHBondContact O-CB 3.48Å; K22-Y25 PolarHBondContact O-N 2.89Å; A23-Y25 VanDerWaalsContact C-N 3.26Å; A23-Y25 PolarHBondContact O-N 3.45Å; Y25-K28 WeakPolarHBondContact O-CB 3.43Å; Y25-K28 PolarHBondContact O-N 2.92Å; Y25-W29 AromaticContact CE1-CD1 3.62Å; Y25-W29 AromaticContact CE1-NE1 3.28Å; Y25-W29 VanDerWaalsContact CE1-NE1 3.28Å; Y25-W29 AromaticContact CZ-NE1 3.3Å; Y25-W29 VanDerWaalsContact CZ-NE1 3.3Å; Y25-W29 PolarHBondContact OH-NE1 3.48Å; Y25-W29 VanDerWaalsContact OH-NE1 3.13Å; Y25-H104 AromaticContact CE1-CE1 3.61Å
26	Y	94.8	Very high	85.3	Confident	5 Å²	5	76 Å²	76	2%	0.02	37%	0.37	C	S	.	.	H	α-helix	trans	-71.7	-34	179.4	-67.5	-68.7	0	0	0	112.2	P21 A23 E24 K28 W29 S30 H104 L107 M108 S111	P21-Y26 HydrophobicContact CB-CE2 4.08Å; P21-Y26 WeakPolarHBondContact O-CE2 3.46Å; A23-Y26 PolarHBondContact O-N 2.87Å; E24-Y26 VanDerWaalsContact C-N 3.32Å; E24-Y26 PolarHBondContact O-N 3.27Å; Y26-K28 VanDerWaalsContact C-N 3.3Å; Y26-K28 PolarHBondContact O-N 3.27Å; Y26-W29 WeakPolarHBondContact O-CB 3.27Å; Y26-W29 PolarHBondContact O-N 3.01Å; Y26-W29 VanDerWaalsContact O-N 3.11Å; Y26-S30 PolarHBondContact O-N 2.92Å; Y26-H104 AromaticContact CE1-ND1 3.58Å; Y26-H104 AromaticContact CZ-ND1 3.69Å; Y26-H104 PolarHBondContact OH-ND1 3.23Å; Y26-L107 HydrophobicContact CD1-CB 3.62Å; Y26-L107 HydrophobicContact CD2-CB 4.4Å; Y26-L107 HydrophobicContact CD2-CD1 4.03Å; Y26-L107 HydrophobicContact CE1-CB 3.38Å; Y26-L107 HydrophobicContact CE1-CD1 4.14Å; Y26-L107 HydrophobicContact CE1-CG 4.42Å; Y26-L107 HydrophobicContact CE2-CB 4.19Å; Y26-L107 HydrophobicContact CE2-CD1 3.45Å; Y26-L107 VanDerWaalsContact CE2-CD1 3.45Å; Y26-L107 HydrophobicContact CE2-CG 4.45Å; Y26-L107 HydrophobicContact CG-CB 4.13Å; Y26-M108 HydrophobicContact CD1-CG 4.48Å; Y26-M108 HydrophobicContact CE1-CG 4.28Å; Y26-S111 WeakPolarHBondContact CB-OG 3.34Å; Y26-S111 WeakPolarHBondContact O-CB 3.42Å; Y26-S111 PolarHBondContact O-OG 3.22Å
27	F	96	Very high	87.5	Confident	47 Å²	47	71 Å²	71	21%	0.206	35%	0.348	C	S	.	.	H	α-helix	trans	-67.4	-28.9	172.9	-73.4	-58.5	0	0	0	113.1	A23 E24 W29 S30 V31 I114 F148 V151 R152	A23-F27 HydrophobicContact CB-CD2 4.29Å; A23-F27 HydrophobicContact CB-CE2 4.05Å; A23-F27 WeakPolarHBondContact O-CD2 3.35Å; A23-F27 PolarHBondContact O-N 3.23Å; E24-F27 PolarHBondContact O-N 2.89Å; F27-W29 VanDerWaalsContact C-N 3.26Å; F27-W29 PolarHBondContact O-N 3.1Å; F27-S30 WeakPolarHBondContact O-CB 3.39Å; F27-S30 PolarHBondContact O-N 3.42Å; F27-S30 VanDerWaalsContact O-N 3.09Å; F27-V31 WeakPolarHBondContact O-CG2 3.38Å; F27-V31 PolarHBondContact O-N 3.22Å; F27-I114 HydrophobicContact CE1-CD1 4.49Å; F27-F148 AromaticContact CE1-CD2 3.6Å; F27-F148 HydrophobicContact CE1-CD2 3.6Å; F27-F148 AromaticContact CE1-CE2 3.76Å; F27-F148 HydrophobicContact CE1-CE2 3.76Å; F27-F148 AromaticContact CZ-CD2 3.77Å; F27-F148 HydrophobicContact CZ-CD2 3.77Å; F27-F148 AromaticContact CZ-CE2 3.63Å; F27-F148 HydrophobicContact CZ-CE2 3.63Å; F27-F148 HydrophobicContact CZ-CZ 4.39Å; F27-V151 HydrophobicContact CD1-CG1 4.35Å; F27-V151 HydrophobicContact CE1-CB 4.46Å; F27-V151 HydrophobicContact CE1-CG1 3.99Å; F27-V151 HydrophobicContact CE2-CG1 4.29Å; F27-V151 HydrophobicContact CZ-CB 4.38Å; F27-V151 HydrophobicContact CZ-CG1 3.95Å; F27-R152 HydrophobicContact CE2-CB 4.24Å; F27-R152 HydrophobicContact CZ-CB 3.97Å
28	K	96.8	Very high	89.4	Confident	151 Å²	151	73 Å²	73	66%	0.657	36%	0.359	S	S	*	.	H	α-helix	trans	-59.8	-37.4	169.2	-68.8	173.8	-176.6	-178	0	111.7	E24 Y25 Y26 V31 L32	E24-K28 WeakPolarHBondContact O-CG 3.37Å; E24-K28 PolarHBondContact O-N 3.44Å; E24-K28 VanDerWaalsContact O-N 3.07Å; Y25-K28 WeakPolarHBondContact O-CB 3.43Å; Y25-K28 PolarHBondContact O-N 2.92Å; Y26-K28 VanDerWaalsContact C-N 3.3Å; Y26-K28 PolarHBondContact O-N 3.27Å; K28-V31 PolarHBondContact O-N 2.91Å; K28-L32 WeakPolarHBondContact O-CB 3.39Å; K28-L32 PolarHBondContact O-N 2.93Å
29	W	97.2	Very high	91.4	Very high	76 Å²	76	68.4 Å²	68.4	29%	0.288	35%	0.348	S	S	.	.	H	α-helix	trans	-65.9	-35.4	173	-75.4	100.2	0	0	0	112.9	Y25 Y26 F27 L32 S33 M108	Y25-W29 AromaticContact CE1-CD1 3.62Å; Y25-W29 AromaticContact CE1-NE1 3.28Å; Y25-W29 VanDerWaalsContact CE1-NE1 3.28Å; Y25-W29 AromaticContact CZ-NE1 3.3Å; Y25-W29 VanDerWaalsContact CZ-NE1 3.3Å; Y25-W29 PolarHBondContact OH-NE1 3.48Å; Y25-W29 VanDerWaalsContact OH-NE1 3.13Å; Y26-W29 WeakPolarHBondContact O-CB 3.27Å; Y26-W29 PolarHBondContact O-N 3.01Å; Y26-W29 VanDerWaalsContact O-N 3.11Å; F27-W29 VanDerWaalsContact C-N 3.26Å; F27-W29 PolarHBondContact O-N 3.1Å; W29-L32 HydrophobicContact CE3-CD2 4Å; W29-L32 HydrophobicContact CZ3-CD2 4Å; W29-L32 PolarHBondContact O-N 3.48Å; W29-S33 VanDerWaalsContact O-CB 3.24Å; W29-S33 WeakPolarHBondContact O-CB 3.42Å; W29-S33 PolarHBondContact O-N 2.9Å; W29-M108 HydrophobicContact CD2-CE 3.96Å; W29-M108 HydrophobicContact CE3-CE 4.03Å; W29-M108 HydrophobicContact CH2-CE 3.62Å; W29-M108 HydrophobicContact CZ2-CE 3.52Å; W29-M108 HydrophobicContact CZ2-SD 4.47Å; W29-M108 HydrophobicContact CZ3-CE 3.87Å
30	S	97.7	Very high	93.1	Very high	9 Å²	9	60.7 Å²	60.7	6%	0.063	32%	0.321	C	S	.	.	H	α-helix	trans	-64.5	-43.6	173.4	-58.8	0	0	0	0	112.3	Y26 F27 S33 F34 S111 G115	Y26-S30 PolarHBondContact O-N 2.92Å; F27-S30 WeakPolarHBondContact O-CB 3.39Å; F27-S30 PolarHBondContact O-N 3.42Å; F27-S30 VanDerWaalsContact O-N 3.09Å; S30-S33 PolarHBondContact O-N 3.43Å; S30-F34 WeakPolarHBondContact O-CB 3.49Å; S30-F34 PolarHBondContact O-N 3.16Å; S30-S111 VanDerWaalsContact CA-O 3.24Å; S30-S111 WeakPolarHBondContact CA-O 3.5Å; S30-S111 WeakPolarHBondContact CB-O 3.43Å; S30-S111 VanDerWaalsContact OG-CA 3.29Å; S30-S111 WeakPolarHBondContact OG-CA 3.46Å; S30-S111 WeakPolarHBondContact OG-CB 3.32Å; S30-S111 PolarHBondContact OG-O 2.84Å; S30-G115 VanDerWaalsContact O-CA 3.3Å; S30-G115 WeakPolarHBondContact O-CA 3.33Å
31	V	97.9	Very high	94.5	Very high	107 Å²	107	59 Å²	59	65%	0.648	30%	0.303	S	S	*	.	H	α-helix	trans	-64.7	-44.4	176	176.2	0	0	0	0	111	F27 K28 F34 G35	F27-V31 WeakPolarHBondContact O-CG2 3.38Å; F27-V31 PolarHBondContact O-N 3.22Å; K28-V31 PolarHBondContact O-N 2.91Å; V31-F34 PolarHBondContact O-N 2.91Å; V31-G35 PolarHBondContact O-N 2.88Å
32	L	97.8	Very high	95.4	Very high	95 Å²	95	61.2 Å²	61.2	50%	0.497	31%	0.309	S	S	.	.	H	α-helix	trans	-59.9	-47.8	175.7	179.1	62	0	0	0	111.2	K28 W29 F34 G35 C36	K28-L32 WeakPolarHBondContact O-CB 3.39Å; K28-L32 PolarHBondContact O-N 2.93Å; W29-L32 HydrophobicContact CE3-CD2 4Å; W29-L32 HydrophobicContact CZ3-CD2 4Å; W29-L32 PolarHBondContact O-N 3.48Å; L32-F34 PolarHBondContact O-N 3.46Å; L32-G35 PolarHBondContact O-N 3.34Å; L32-C36 WeakPolarHBondContact O-CB 3.3Å; L32-C36 PolarHBondContact O-N 3.36Å; L32-C36 PolarHBondContact O-SG 3.13Å
33	S	98.1	Very high	96.1	Very high	13 Å²	13	59.9 Å²	59.9	9%	0.091	31%	0.307	C	S	.	.	H	α-helix	trans	-58.6	-46.1	177.1	179	0	0	0	0	111.8	W29 S30 G35 C36 C37 I112	W29-S33 VanDerWaalsContact O-CB 3.24Å; W29-S33 WeakPolarHBondContact O-CB 3.42Å; W29-S33 PolarHBondContact O-N 2.9Å; S30-S33 PolarHBondContact O-N 3.43Å; S33-G35 PolarHBondContact O-N 3.37Å; S33-C36 PolarHBondContact O-N 3.47Å; S33-C37 WeakPolarHBondContact O-CB 3.36Å; S33-C37 PolarHBondContact O-N 3.37Å; S33-C37 PolarHBondContact O-SG 3.39Å; S33-I112 WeakPolarHBondContact CB-O 3.36Å; S33-I112 PolarHBondContact OG-O 2.76Å
34	F	98.2	Very high	96.5	Very high	58 Å²	58	63 Å²	63	25%	0.254	32%	0.321	S	S	.	.	H	α-helix	trans	-58.2	-48.2	176.2	179	-99.6	0	0	0	111.8	S30 V31 L32 C37 L38 G115 L118 C119 I122	S30-F34 WeakPolarHBondContact O-CB 3.49Å; S30-F34 PolarHBondContact O-N 3.16Å; V31-F34 PolarHBondContact O-N 2.91Å; L32-F34 PolarHBondContact O-N 3.46Å; F34-C37 PolarHBondContact O-N 3.4Å; F34-L38 HydrophobicContact CD1-CD1 3.82Å; F34-L38 HydrophobicContact CE1-CD1 3.27Å; F34-L38 HydrophobicContact CE1-CG 4.2Å; F34-L38 HydrophobicContact CE2-CD1 4.37Å; F34-L38 HydrophobicContact CZ-CD1 3.59Å; F34-L38 HydrophobicContact CZ-CG 4.22Å; F34-L38 WeakPolarHBondContact O-CG 3.38Å; F34-L38 PolarHBondContact O-N 2.67Å; F34-G115 WeakPolarHBondContact CD2-O 3.49Å; F34-L118 HydrophobicContact CD2-CB 3.86Å; F34-L118 HydrophobicContact CE2-CB 4.03Å; F34-C119 HydrophobicContact CD2-CB 3.87Å; F34-C119 HydrophobicContact CE2-CB 4.06Å; F34-I122 HydrophobicContact CE2-CD1 3.96Å; F34-I122 HydrophobicContact CZ-CD1 4.01Å
35	G	98.2	Very high	96.8	Very high	30 Å²	30	56.4 Å²	56.4	31%	0.309	29%	0.291	S	S	.	.	H	α-helix	trans	-60.3	-48.3	176.6	0	0	0	0	0	112.6	V31 L32 S33 C37 L38 T39	V31-G35 PolarHBondContact O-N 2.88Å; L32-G35 PolarHBondContact O-N 3.34Å; S33-G35 PolarHBondContact O-N 3.37Å; G35-C37 PolarHBondContact O-N 2.86Å; G35-L38 PolarHBondContact O-N 3.19Å; G35-T39 PolarHBondContact O-N 3.34Å; G35-T39 PolarHBondContact O-OG1 3.04Å; G35-T39 VanDerWaalsContact O-OG1 3.04Å
36	C	98	Very high	97	Very high	62 Å²	62	53.6 Å²	53.6	42%	0.419	28%	0.284	S	S	.	.	H	α-helix	trans	-60	-43.9	176.2	-69.9	0	0	0	0	112.1	L32 S33 T39 I40	L32-C36 WeakPolarHBondContact O-CB 3.3Å; L32-C36 PolarHBondContact O-N 3.36Å; L32-C36 PolarHBondContact O-SG 3.13Å; S33-C36 PolarHBondContact O-N 3.47Å; C36-T39 PolarHBondContact O-N 2.85Å; C36-I40 VanDerWaalsContact O-CG1 3.28Å; C36-I40 WeakPolarHBondContact O-CG1 3.24Å; C36-I40 PolarHBondContact O-N 3.38Å
37	C	97.9	Very high	97	Very high	10 Å²	10	61.4 Å²	61.4	7%	0.068	31%	0.313	C	S	.	.	H	α-helix	trans	-61.1	-45.5	177.7	-70.5	0	0	0	0	111.3	S33 F34 G35 I40 H41 V72 C119	S33-C37 WeakPolarHBondContact O-CB 3.36Å; S33-C37 PolarHBondContact O-N 3.37Å; S33-C37 PolarHBondContact O-SG 3.39Å; F34-C37 PolarHBondContact O-N 3.4Å; G35-C37 PolarHBondContact O-N 2.86Å; C37-I40 PolarHBondContact O-N 2.57Å; C37-H41 VanDerWaalsContact O-CB 3.24Å; C37-H41 WeakPolarHBondContact O-CB 3.2Å; C37-H41 PolarHBondContact O-N 3.1Å; C37-V72 HydrophobicContact CB-CG1 3.83Å; C37-C119 HydrophobicContact CB-CB 3.77Å
38	L	96.9	Very high	97.1	Very high	52 Å²	52	62.2 Å²	62.2	27%	0.272	32%	0.319	S	S	.	.	H	α-helix	trans	-61.1	-45.6	175.6	-76.8	176.5	0	0	0	112.1	F34 G35 I40 H41 H42	F34-L38 HydrophobicContact CD1-CD1 3.82Å; F34-L38 HydrophobicContact CE1-CD1 3.27Å; F34-L38 HydrophobicContact CE1-CG 4.2Å; F34-L38 HydrophobicContact CE2-CD1 4.37Å; F34-L38 HydrophobicContact CZ-CD1 3.59Å; F34-L38 HydrophobicContact CZ-CG 4.22Å; F34-L38 WeakPolarHBondContact O-CG 3.38Å; F34-L38 PolarHBondContact O-N 2.67Å; G35-L38 PolarHBondContact O-N 3.19Å; L38-I40 PolarHBondContact O-N 2.97Å; L38-H41 PolarHBondContact O-N 3.47Å; L38-H42 WeakPolarHBondContact O-CB 3.41Å; L38-H42 PolarHBondContact O-N 3.48Å
39	T	97.5	Very high	97	Very high	63 Å²	63	57.4 Å²	57.4	39%	0.387	30%	0.298	S	S	.	.	H	α-helix	trans	-61.4	-43.6	177.7	-58.5	0	0	0	0	111.4	G35 C36 I43 I44	G35-T39 PolarHBondContact O-N 3.34Å; G35-T39 PolarHBondContact O-OG1 3.04Å; G35-T39 VanDerWaalsContact O-OG1 3.04Å; C36-T39 PolarHBondContact O-N 2.85Å; T39-I43 HydrophobicContact CG2-CD1 4.37Å; T39-I43 WeakPolarHBondContact O-CA 3.42Å; T39-I43 VanDerWaalsContact O-CB 3.3Å; T39-I43 WeakPolarHBondContact O-CB 3.26Å; T39-I43 PolarHBondContact O-N 3.15Å; T39-I44 HydrophobicContact CG2-CD1 3.97Å; T39-I44 HydrophobicContact CG2-CG1 4.18Å; T39-I44 PolarHBondContact O-N 3.22Å
40	I	97.5	Very high	96.9	Very high	36 Å²	36	57.2 Å²	57.2	19%	0.185	31%	0.305	C	S	.	.	I	π-helix	trans	-66.2	-46.5	177.7	-64	164.6	0	0	0	110.5	C36 C37 L38 I44 S45 V71 V72 I75	C36-I40 VanDerWaalsContact O-CG1 3.28Å; C36-I40 WeakPolarHBondContact O-CG1 3.24Å; C36-I40 PolarHBondContact O-N 3.38Å; C37-I40 PolarHBondContact O-N 2.57Å; L38-I40 PolarHBondContact O-N 2.97Å; I40-I44 HydrophobicContact CG1-CD1 4.02Å; I40-S45 WeakPolarHBondContact O-CB 3.49Å; I40-S45 PolarHBondContact O-N 2.85Å; I40-V71 HydrophobicContact CG2-CG1 4.44Å; I40-V72 HydrophobicContact CB-CG2 3.86Å; I40-V72 HydrophobicContact CG2-CG2 3.59Å; I40-I75 HydrophobicContact CD1-CD1 4.46Å; I40-I75 HydrophobicContact CG2-CD1 4.36Å
41	H	95.9	Very high	96.7	Very high	4 Å²	4	64.8 Å²	64.8	2%	0.019	33%	0.333	C	S	.	.	I	π-helix	trans	-64	-46.2	-177.2	-172.6	103.1	0	0	0	112.7	C37 L38 P46 M65 D68 S69 V72	C37-H41 VanDerWaalsContact O-CB 3.24Å; C37-H41 WeakPolarHBondContact O-CB 3.2Å; C37-H41 PolarHBondContact O-N 3.1Å; L38-H41 PolarHBondContact O-N 3.47Å; H41-P46 WeakPolarHBondContact O-CD 3.12Å; H41-P46 WeakPolarHBondContact O-CG 3.24Å; H41-M65 PolarHBondContact CE1-O 3.28Å; H41-D68 WeakPolarHBondContact O-CB 3.32Å; H41-S69 WeakPolarHBondContact ND1-CA 3.27Å; H41-S69 PolarHBondContact ND1-N 3.33Å; H41-V72 HydrophobicContact CB-CG2 3.95Å
42	H	94.8	Very high	96.5	Very high	97 Å²	97	65.8 Å²	65.8	45%	0.449	33%	0.326	S	S	.	.	I	π-helix	trans	-99.5	-18.9	-170.1	-71.4	-67.7	0	0	0	114.8	L38	L38-H42 WeakPolarHBondContact O-CB 3.41Å; L38-H42 PolarHBondContact O-N 3.48Å
43	I	96	Very high	96.2	Very high	107 Å²	107	62.9 Å²	62.9	55%	0.549	31%	0.31	S	S	.	.	I	π-helix	trans	-119.3	-65.2	-174.9	-55.8	174.7	0	0	0	110.2	T39 W47	T39-I43 HydrophobicContact CG2-CD1 4.37Å; T39-I43 WeakPolarHBondContact O-CA 3.42Å; T39-I43 VanDerWaalsContact O-CB 3.3Å; T39-I43 WeakPolarHBondContact O-CB 3.26Å; T39-I43 PolarHBondContact O-N 3.15Å; I43-W47 WeakPolarHBondContact O-CB 3.46Å; I43-W47 PolarHBondContact O-N 2.87Å
44	I	96.9	Very high	95.9	Very high	73 Å²	73	67.2 Å²	67.2	37%	0.374	33%	0.328	S	S	.	.	I	π-helix	trans	-67.8	-52.8	-167.4	-58.5	172.5	0	0	0	111.1	T39 I40 W47 I48	T39-I44 HydrophobicContact CG2-CD1 3.97Å; T39-I44 HydrophobicContact CG2-CG1 4.18Å; T39-I44 PolarHBondContact O-N 3.22Å; I40-I44 HydrophobicContact CG1-CD1 4.02Å; I44-W47 PolarHBondContact O-N 3.32Å; I44-I48 HydrophobicContact CG2-CD1 3.68Å; I44-I48 HydrophobicContact CG2-CG1 4.28Å; I44-I48 WeakPolarHBondContact O-CG1 3.19Å; I44-I48 PolarHBondContact O-N 2.8Å
45	S	96.6	Very high	95.6	Very high	3 Å²	3	67.1 Å²	67.1	2%	0.021	33%	0.33	C	S	.	.	H	α-helix	trans	-61.9	-51.1	-177.6	-177.1	0	0	0	0	111.5	I40 W47 I48 F49 D68	I40-S45 WeakPolarHBondContact O-CB 3.49Å; I40-S45 PolarHBondContact O-N 2.85Å; S45-W47 VanDerWaalsContact C-N 3.31Å; S45-W47 PolarHBondContact O-N 3.3Å; S45-I48 PolarHBondContact O-N 3.24Å; S45-F49 WeakPolarHBondContact O-CD2 2.83Å; S45-F49 PolarHBondContact O-N 3.45Å; S45-F49 VanDerWaalsContact OG-CD2 3.28Å; S45-F49 WeakPolarHBondContact OG-CD2 3.45Å; S45-F49 WeakPolarHBondContact OG-CE2 3.38Å; S45-D68 VanDerWaalsContact CB-OD1 3.22Å; S45-D68 WeakPolarHBondContact CB-OD1 3.46Å; S45-D68 PolarHBondContact OG-OD1 3.45Å
46	P	96	Very high	95.5	Very high	28 Å²	28	66 Å²	66	18%	0.182	32%	0.316	C	S	.	.	H	α-helix	trans	-56	-41.6	173.8	-27.7	34.5	0	0	0	113.8	H41 T50 D68	H41-P46 WeakPolarHBondContact O-CD 3.12Å; H41-P46 WeakPolarHBondContact O-CG 3.24Å; P46-T50 WeakPolarHBondContact O-CB 3.2Å; P46-T50 PolarHBondContact O-N 2.95Å; P46-T50 PolarHBondContact O-OG1 3.04Å; P46-D68 WeakPolarHBondContact CG-OD2 3.41Å
47	W	96.2	Very high	95.3	Very high	169 Å²	169	68.8 Å²	68.8	64%	0.64	32%	0.318	S	S	*	.	H	α-helix	trans	-63.4	-50.1	179.4	176.2	81.6	0	0	0	111.9	I43 I44 S45 R51	I43-W47 WeakPolarHBondContact O-CB 3.46Å; I43-W47 PolarHBondContact O-N 2.87Å; I44-W47 PolarHBondContact O-N 3.32Å; S45-W47 VanDerWaalsContact C-N 3.31Å; S45-W47 PolarHBondContact O-N 3.3Å; W47-R51 WeakPolarHBondContact O-CB 3.34Å; W47-R51 PolarHBondContact O-N 3.29Å
48	I	96.3	Very high	95.1	Very high	64 Å²	64	74.1 Å²	74.1	33%	0.328	35%	0.346	S	S	.	.	H	α-helix	trans	-61.4	-53.7	179.1	-65.8	176.9	0	0	0	110.4	I44 S45 R51 Y52	I44-I48 HydrophobicContact CG2-CD1 3.68Å; I44-I48 HydrophobicContact CG2-CG1 4.28Å; I44-I48 WeakPolarHBondContact O-CG1 3.19Å; I44-I48 PolarHBondContact O-N 2.8Å; S45-I48 PolarHBondContact O-N 3.24Å; I48-R51 PolarHBondContact O-N 3.02Å; I48-Y52 HydrophobicContact CG2-CD2 4.21Å; I48-Y52 WeakPolarHBondContact O-CD2 3.34Å; I48-Y52 PolarHBondContact O-N 3.38Å
49	F	95.6	Very high	94.9	Very high	49 Å²	49	72.9 Å²	72.9	22%	0.215	34%	0.339	C	S	.	.	H	α-helix	trans	-74.6	-29.3	-171.7	-69.3	-68.2	0	0	0	113.1	S45 R51 N53 Y56 W67 V71	S45-F49 WeakPolarHBondContact O-CD2 2.83Å; S45-F49 PolarHBondContact O-N 3.45Å; S45-F49 VanDerWaalsContact OG-CD2 3.28Å; S45-F49 WeakPolarHBondContact OG-CD2 3.45Å; S45-F49 WeakPolarHBondContact OG-CE2 3.38Å; F49-R51 VanDerWaalsContact C-N 3.3Å; F49-R51 PolarHBondContact O-N 3.43Å; F49-N53 HydrophobicContact CB-CB 4.34Å; F49-N53 HydrophobicContact CD1-CB 3.99Å; F49-N53 WeakPolarHBondContact O-CA 3.28Å; F49-N53 WeakPolarHBondContact O-CB 3.19Å; F49-N53 PolarHBondContact O-N 3.4Å; F49-Y56 VanDerWaalsContact C-CD1 3.48Å; F49-Y56 HydrophobicContact CB-CD1 3.57Å; F49-Y56 HydrophobicContact CB-CD2 3.79Å; F49-Y56 HydrophobicContact CB-CE1 3.94Å; F49-Y56 HydrophobicContact CB-CE2 4.14Å; F49-Y56 HydrophobicContact CB-CG 3.49Å; F49-Y56 VanDerWaalsContact CB-CG 3.49Å; F49-Y56 HydrophobicContact CG-CD2 4.43Å; F49-Y56 HydrophobicContact CG-CG 4.48Å; F49-W67 HydrophobicContact CD1-CZ2 4.13Å; F49-W67 AromaticContact CD1-NE1 3.67Å; F49-W67 AromaticContact CD2-CD1 3.86Å; F49-W67 AromaticContact CD2-NE1 3.4Å; F49-W67 AromaticContact CE1-CZ2 3.96Å; F49-W67 HydrophobicContact CE1-CZ2 3.96Å; F49-W67 AromaticContact CE1-NE1 3.61Å; F49-W67 AromaticContact CE2-NE1 3.39Å; F49-W67 AromaticContact CG-NE1 3.57Å; F49-W67 AromaticContact CZ-NE1 3.48Å; F49-V71 HydrophobicContact CE2-CG2 3.69Å; F49-V71 HydrophobicContact CZ-CG2 4.11Å
50	T	94.2	Very high	94.7	Very high	72 Å²	72	71.9 Å²	71.9	44%	0.442	33%	0.334	S	S	.	.	H	α-helix	trans	-65.2	-36.1	170.7	-56.8	0	0	0	0	111.3	P46 Y56 R57	P46-T50 WeakPolarHBondContact O-CB 3.2Å; P46-T50 PolarHBondContact O-N 2.95Å; P46-T50 PolarHBondContact O-OG1 3.04Å; T50-Y56 WeakPolarHBondContact OG1-CE1 3.44Å; T50-R57 HydrophobicContact CG2-CG 4.33Å; T50-R57 VanDerWaalsContact O-CD 3.24Å; T50-R57 WeakPolarHBondContact O-CD 3.49Å
51	R	94.2	Very high	94.5	Very high	169 Å²	169	79.1 Å²	79.1	64%	0.638	36%	0.359	S	S	*	.	H	α-helix	trans	-74.8	-43	-178.6	-170.3	66	174.9	108.7	-3.1	112.8	W47 I48 F49	W47-R51 WeakPolarHBondContact O-CB 3.34Å; W47-R51 PolarHBondContact O-N 3.29Å; I48-R51 PolarHBondContact O-N 3.02Å; F49-R51 VanDerWaalsContact C-N 3.3Å; F49-R51 PolarHBondContact O-N 3.43Å
52	Y	93	Very high	94.3	Very high	127 Å²	127	81.4 Å²	81.4	50%	0.498	38%	0.375	S	S	.	.	H	α-helix	trans	-113.2	-12.5	-166.2	-59.8	-65.3	0	0	0	115.2	I48 L340	I48-Y52 HydrophobicContact CG2-CD2 4.21Å; I48-Y52 WeakPolarHBondContact O-CD2 3.34Å; I48-Y52 PolarHBondContact O-N 3.38Å; Y52-L340 HydrophobicContact CD1-CD2 3.7Å; Y52-L340 HydrophobicContact CE1-CD1 4.47Å; Y52-L340 HydrophobicContact CE1-CD2 4.21Å
53	N	91.8	Very high	94.2	Very high	34 Å²	34	78.8 Å²	78.8	18%	0.182	36%	0.363	C	S	.	.			trans	-118.8	100	-175.8	-173.8	-19.1	0	0	0	111.6	F49 L55 Y56 R57	F49-N53 HydrophobicContact CB-CB 4.34Å; F49-N53 HydrophobicContact CD1-CB 3.99Å; F49-N53 WeakPolarHBondContact O-CA 3.28Å; F49-N53 WeakPolarHBondContact O-CB 3.19Å; F49-N53 PolarHBondContact O-N 3.4Å; N53-L55 VanDerWaalsContact C-N 3.26Å; N53-L55 PolarHBondContact O-N 3.12Å; N53-L55 WeakPolarHBondContact OD1-CB 3.42Å; N53-L55 PolarHBondContact OD1-N 3.15Å; N53-Y56 WeakPolarHBondContact O-CB 3.33Å; N53-Y56 PolarHBondContact O-N 3.29Å; N53-Y56 PolarHBondContact OD1-N 3.2Å; N53-Y56 VanDerWaalsContact OD1-N 3.07Å; N53-R57 PolarHBondContact O-N 3.2Å
54	K	92	Very high	94.1	Very high	105 Å²	105	77.4 Å²	77.4	46%	0.457	35%	0.351	S	S	.	.	H	α-helix	trans	-56.4	-39.3	177.6	-65.4	-177.7	-179.6	167.1	0	112.5	R57 N58 H344	K54-R57 PolarHBondContact O-N 3.2Å; K54-N58 PolarHBondContact O-N 3.23Å; K54-H344 VanDerWaalsContact CE-NE2 3.3Å; K54-H344 WeakPolarHBondContact CE-NE2 3.48Å; K54-H344 PolarHBondContact NZ-NE2 3.26Å
55	L	92.6	Very high	94	Very high	55 Å²	55	75.1 Å²	75.1	29%	0.288	34%	0.339	S	S	.	.	H	α-helix	trans	-64.6	-44.2	-180	-178.1	143.9	0	0	0	110.9	N53 R57 N58 L59 W67 T181 I182	N53-L55 VanDerWaalsContact C-N 3.26Å; N53-L55 PolarHBondContact O-N 3.12Å; N53-L55 WeakPolarHBondContact OD1-CB 3.42Å; N53-L55 PolarHBondContact OD1-N 3.15Å; L55-R57 VanDerWaalsContact C-N 3.32Å; L55-R57 PolarHBondContact O-N 3.25Å; L55-N58 PolarHBondContact O-N 3Å; L55-N58 VanDerWaalsContact O-N 3.11Å; L55-L59 HydrophobicContact CD2-CD1 4.14Å; L55-L59 HydrophobicContact CD2-CD2 4.36Å; L55-L59 HydrophobicContact CD2-CG 4.23Å; L55-L59 WeakPolarHBondContact O-CG 3.33Å; L55-L59 PolarHBondContact O-N 3.15Å; L55-W67 HydrophobicContact CD2-CZ3 4.1Å; L55-T181 HydrophobicContact CD2-CG2 4.37Å; L55-I182 HydrophobicContact CD1-CB 4.49Å; L55-I182 HydrophobicContact CD1-CG2 4.49Å
56	Y	94.9	Very high	93.9	Very high	6 Å²	6	75.7 Å²	75.7	2%	0.024	34%	0.341	C	S	.	.	H	α-helix	trans	-57.3	-43.2	176.9	174.3	-91.9	0	0	0	112.4	F49 T50 N53 N58 L59 R64 W67 D68	F49-Y56 VanDerWaalsContact C-CD1 3.48Å; F49-Y56 HydrophobicContact CB-CD1 3.57Å; F49-Y56 HydrophobicContact CB-CD2 3.79Å; F49-Y56 HydrophobicContact CB-CE1 3.94Å; F49-Y56 HydrophobicContact CB-CE2 4.14Å; F49-Y56 HydrophobicContact CB-CG 3.49Å; F49-Y56 VanDerWaalsContact CB-CG 3.49Å; F49-Y56 HydrophobicContact CG-CD2 4.43Å; F49-Y56 HydrophobicContact CG-CG 4.48Å; T50-Y56 WeakPolarHBondContact OG1-CE1 3.44Å; N53-Y56 WeakPolarHBondContact O-CB 3.33Å; N53-Y56 PolarHBondContact O-N 3.29Å; N53-Y56 PolarHBondContact OD1-N 3.2Å; N53-Y56 VanDerWaalsContact OD1-N 3.07Å; Y56-N58 PolarHBondContact O-N 2.61Å; Y56-L59 WeakPolarHBondContact O-CB 3.49Å; Y56-L59 PolarHBondContact O-N 2.6Å; Y56-L59 VanDerWaalsContact O-N 3.13Å; Y56-R64 HydrophobicContact CD2-CG 4.15Å; Y56-R64 HydrophobicContact CE1-CG 4.26Å; Y56-R64 HydrophobicContact CE2-CB 3.73Å; Y56-R64 HydrophobicContact CE2-CG 3.75Å; Y56-R64 WeakPolarHBondContact O-CD 3.33Å; Y56-W67 HydrophobicContact CD2-CB 4.26Å; Y56-W67 AromaticContact CD2-CD1 3.86Å; Y56-W67 HydrophobicContact CD2-CD2 4.06Å; Y56-W67 AromaticContact CD2-CG 3.82Å; Y56-W67 HydrophobicContact CD2-CG 3.82Å; Y56-W67 HydrophobicContact CE2-CB 4.14Å; Y56-W67 AromaticContact CE2-CD1 3.94Å; Y56-W67 HydrophobicContact CE2-CG 4.03Å; Y56-D68 PolarHBondContact OH-OD2 3.37Å
57	R	93.9	Very high	93.9	Very high	121 Å²	121	74.7 Å²	74.7	46%	0.457	33%	0.334	S	S	.	.	H	α-helix	trans	-59.5	-35.6	177.8	-60.3	-174.8	-48.3	-161.6	8.8	112.8	T50 N53 K54 L55 L59 R64	T50-R57 HydrophobicContact CG2-CG 4.33Å; T50-R57 VanDerWaalsContact O-CD 3.24Å; T50-R57 WeakPolarHBondContact O-CD 3.49Å; N53-R57 PolarHBondContact O-N 3.2Å; K54-R57 PolarHBondContact O-N 3.2Å; L55-R57 VanDerWaalsContact C-N 3.32Å; L55-R57 PolarHBondContact O-N 3.25Å; R57-L59 VanDerWaalsContact C-N 3.34Å; R57-R64 PolarHBondContact O-NH1 3.48Å
58	N	93.7	Very high	94	Very high	123 Å²	123	67 Å²	67	66%	0.658	31%	0.305	S	S	*	.	H	α-helix	trans	-82.5	-11.7	-177.9	-64.1	-10.4	0	0	0	112.9	K54 L55 Y56	K54-N58 PolarHBondContact O-N 3.23Å; L55-N58 PolarHBondContact O-N 3Å; L55-N58 VanDerWaalsContact O-N 3.11Å; Y56-N58 PolarHBondContact O-N 2.61Å
59	L	93.2	Very high	93.9	Very high	25 Å²	25	64.3 Å²	64.3	13%	0.131	29%	0.292	C	S	.	.	S	Bend	trans	-69.3	144.1	175.3	-69	175.4	0	0	0	110.8	L55 Y56 R57 H63 R64 W67 T181	L55-L59 HydrophobicContact CD2-CD1 4.14Å; L55-L59 HydrophobicContact CD2-CD2 4.36Å; L55-L59 HydrophobicContact CD2-CG 4.23Å; L55-L59 WeakPolarHBondContact O-CG 3.33Å; L55-L59 PolarHBondContact O-N 3.15Å; Y56-L59 WeakPolarHBondContact O-CB 3.49Å; Y56-L59 PolarHBondContact O-N 2.6Å; Y56-L59 VanDerWaalsContact O-N 3.13Å; R57-L59 VanDerWaalsContact C-N 3.34Å; L59-H63 HydrophobicContact CB-CB 4.16Å; L59-H63 HydrophobicContact CD1-CB 4.42Å; L59-H63 HydrophobicContact CD2-CB 4.37Å; L59-R64 HydrophobicContact CB-CG 3.83Å; L59-R64 PolarHBondContact O-NH1 3.11Å; L59-W67 HydrophobicContact CD1-CE3 3.89Å; L59-W67 HydrophobicContact CD1-CZ3 4.42Å; L59-T181 HydrophobicContact CD1-CG2 3.92Å; L59-T181 HydrophobicContact CD2-CG2 4.05Å
60	P	93.7	Very high	94	Very high	43 Å²	43	63.7 Å²	63.7	28%	0.279	29%	0.288	S	S	.	.			trans	-64.3	157.8	171.6	30	-36.4	0	0	0	110.8	S62 H63 R64	P60-S62 VanDerWaalsContact C-N 3.29Å; P60-S62 PolarHBondContact O-N 3.36Å; P60-S62 VanDerWaalsContact O-N 3.15Å; P60-H63 HydrophobicContact CG-CB 4.13Å; P60-H63 WeakPolarHBondContact CG-ND1 3.13Å; P60-H63 PolarHBondContact O-N 3.13Å; P60-R64 PolarHBondContact O-N 3.27Å; P60-R64 VanDerWaalsContact O-N 3.1Å
61	R	92.8	Very high	94.1	Very high	188 Å²	188	61.5 Å²	61.5	71%	0.709	28%	0.275	S	S	*	.	H	α-helix	trans	-52	-42.1	-173.1	-176.7	179	175.3	168.4	-0.3	113.7	R64 M65	R61-R64 PolarHBondContact O-N 3.07Å; R61-M65 WeakPolarHBondContact O-CG 3.37Å; R61-M65 PolarHBondContact O-N 3.31Å; R61-M65 VanDerWaalsContact O-N 3.07Å
62	S	92.2	Very high	94.3	Very high	51 Å²	51	53.7 Å²	53.7	36%	0.357	25%	0.246	S	C	.	.	H	α-helix	trans	-62.2	-44.9	179	52.5	0	0	0	0	112.6	P60 R64 M65 E66 Y127	P60-S62 VanDerWaalsContact C-N 3.29Å; P60-S62 PolarHBondContact O-N 3.36Å; P60-S62 VanDerWaalsContact O-N 3.15Å; S62-R64 VanDerWaalsContact C-N 3.32Å; S62-R64 PolarHBondContact O-N 3.2Å; S62-M65 PolarHBondContact O-N 2.95Å; S62-E66 PolarHBondContact O-N 3.27Å; S62-Y127 WeakPolarHBondContact O-CB 3.11Å
63	H	92.3	Very high	94.5	Very high	42 Å²	42	48.1 Å²	48.1	19%	0.194	23%	0.226	C	C	.	.	H	α-helix	trans	-68.9	-29.9	177.8	-75.9	124.6	0	0	0	112.8	L59 P60 E66 W67 S367	L59-H63 HydrophobicContact CB-CB 4.16Å; L59-H63 HydrophobicContact CD1-CB 4.42Å; L59-H63 HydrophobicContact CD2-CB 4.37Å; P60-H63 HydrophobicContact CG-CB 4.13Å; P60-H63 WeakPolarHBondContact CG-ND1 3.13Å; P60-H63 PolarHBondContact O-N 3.13Å; H63-E66 IonicContact CD2-OE2 3.2Å; H63-W67 WeakPolarHBondContact O-CB 3.47Å; H63-W67 PolarHBondContact O-N 2.96Å; H63-S367 PolarHBondContact CE1-OG 3.06Å; H63-S367 WeakPolarHBondContact NE2-CB 3.34Å; H63-S367 PolarHBondContact NE2-OG 3.35Å
64	R	95.1	Very high	94.7	Very high	79 Å²	79	47.6 Å²	47.6	30%	0.298	23%	0.225	S	C	.	.	H	α-helix	trans	-64.5	-46.1	171.1	-69.3	-165.5	-61.7	-116.5	9.6	111.2	Y56 R57 L59 P60 R61 S62 E66 W67 D68	Y56-R64 HydrophobicContact CD2-CG 4.15Å; Y56-R64 HydrophobicContact CE1-CG 4.26Å; Y56-R64 HydrophobicContact CE2-CB 3.73Å; Y56-R64 HydrophobicContact CE2-CG 3.75Å; Y56-R64 WeakPolarHBondContact O-CD 3.33Å; R57-R64 PolarHBondContact O-NH1 3.48Å; L59-R64 HydrophobicContact CB-CG 3.83Å; L59-R64 PolarHBondContact O-NH1 3.11Å; P60-R64 PolarHBondContact O-N 3.27Å; P60-R64 VanDerWaalsContact O-N 3.1Å; R61-R64 PolarHBondContact O-N 3.07Å; S62-R64 VanDerWaalsContact C-N 3.32Å; S62-R64 PolarHBondContact O-N 3.2Å; R64-E66 VanDerWaalsContact C-N 3.34Å; R64-E66 PolarHBondContact O-N 2.99Å; R64-W67 WeakPolarHBondContact O-CA 3.49Å; R64-W67 VanDerWaalsContact O-CB 3.27Å; R64-W67 WeakPolarHBondContact O-CB 3.5Å; R64-W67 PolarHBondContact O-N 2.64Å; R64-W67 VanDerWaalsContact O-N 3.12Å; R64-D68 VanDerWaalsContact O-CG 3.28Å; R64-D68 PolarHBondContact O-N 2.95Å
65	M	94.4	Very high	95	Very high	24 Å²	24	46.1 Å²	46.1	12%	0.118	22%	0.221	C	C	.	.	H	α-helix	trans	-62.8	-39.2	175.7	-66.6	-174.8	69.1	0	0	112.8	H41 R61 S62 D68 S69 F126 Y127	H41-M65 PolarHBondContact CE1-O 3.28Å; R61-M65 WeakPolarHBondContact O-CG 3.37Å; R61-M65 PolarHBondContact O-N 3.31Å; R61-M65 VanDerWaalsContact O-N 3.07Å; S62-M65 PolarHBondContact O-N 2.95Å; M65-D68 PolarHBondContact O-N 3.28Å; M65-S69 WeakPolarHBondContact O-CB 2.83Å; M65-S69 PolarHBondContact O-N 3.1Å; M65-F126 HydrophobicContact CE-CB 3.26Å; M65-F126 HydrophobicContact CE-CD1 4.35Å; M65-F126 HydrophobicContact CE-CD2 3.8Å; M65-F126 HydrophobicContact CE-CG 3.56Å; M65-F126 HydrophobicContact SD-CB 3.66Å; M65-F126 HydrophobicContact SD-CG 4.32Å; M65-Y127 HydrophobicContact CB-CD1 3.9Å
66	E	94.8	Very high	95.3	Very high	15 Å²	15	43.8 Å²	43.8	7%	0.07	21%	0.208	C	C	.	.	H	α-helix	trans	-64.5	-41.2	173	-169.9	-176.2	173.3	0	0	111.3	S62 H63 R64 D68 S69 R70 Y127 W177	S62-E66 PolarHBondContact O-N 3.27Å; H63-E66 IonicContact CD2-OE2 3.2Å; R64-E66 VanDerWaalsContact C-N 3.34Å; R64-E66 PolarHBondContact O-N 2.99Å; E66-D68 PolarHBondContact O-N 2.98Å; E66-S69 PolarHBondContact O-N 3.25Å; E66-R70 HydrophobicContact CG-CG 4.48Å; E66-R70 WeakPolarHBondContact O-CB 3.3Å; E66-R70 VanDerWaalsContact O-CG 3.3Å; E66-R70 WeakPolarHBondContact O-CG 3.42Å; E66-R70 PolarHBondContact O-N 3.23Å; E66-R70 IonicContact OE1-CZ 2.6Å; E66-R70 IonicContact OE1-NE 3.76Å; E66-R70 PolarHBondContact OE1-NE 2.87Å; E66-R70 IonicContact OE1-NH2 2.99Å; E66-R70 PolarHBondContact OE1-NH2 3.15Å; E66-Y127 HydrophobicContact CB-CD2 3.73Å; E66-Y127 HydrophobicContact CB-CE2 4.27Å; E66-Y127 HydrophobicContact CB-CG 4.07Å; E66-Y127 HydrophobicContact CG-CD2 3.85Å; E66-Y127 HydrophobicContact CG-CE2 4.1Å; E66-W177 HydrophobicContact CB-CH2 4.47Å; E66-W177 HydrophobicContact CB-CZ2 4.14Å; E66-W177 VanDerWaalsContact CD-CZ2 3.49Å; E66-W177 HydrophobicContact CG-CH2 4.44Å; E66-W177 HydrophobicContact CG-CZ2 3.86Å; E66-W177 PolarHBondContact OE1-NE1 3.24Å; E66-W177 WeakPolarHBondContact OE2-CZ2 3.43Å
67	W	96.1	Very high	95.4	Very high	8 Å²	8	43.5 Å²	43.5	3%	0.03	21%	0.207	C	C	.	.	H	α-helix	trans	-56.6	-50.8	175.1	-177	-69.7	0	0	0	111	F49 L55 Y56 L59 H63 R64 R70 V71 W177 F178 T181 I182	F49-W67 HydrophobicContact CD1-CZ2 4.13Å; F49-W67 AromaticContact CD1-NE1 3.67Å; F49-W67 AromaticContact CD2-CD1 3.86Å; F49-W67 AromaticContact CD2-NE1 3.4Å; F49-W67 AromaticContact CE1-CZ2 3.96Å; F49-W67 HydrophobicContact CE1-CZ2 3.96Å; F49-W67 AromaticContact CE1-NE1 3.61Å; F49-W67 AromaticContact CE2-NE1 3.39Å; F49-W67 AromaticContact CG-NE1 3.57Å; F49-W67 AromaticContact CZ-NE1 3.48Å; L55-W67 HydrophobicContact CD2-CZ3 4.1Å; Y56-W67 HydrophobicContact CD2-CB 4.26Å; Y56-W67 AromaticContact CD2-CD1 3.86Å; Y56-W67 HydrophobicContact CD2-CD2 4.06Å; Y56-W67 AromaticContact CD2-CG 3.82Å; Y56-W67 HydrophobicContact CD2-CG 3.82Å; Y56-W67 HydrophobicContact CE2-CB 4.14Å; Y56-W67 AromaticContact CE2-CD1 3.94Å; Y56-W67 HydrophobicContact CE2-CG 4.03Å; L59-W67 HydrophobicContact CD1-CE3 3.89Å; L59-W67 HydrophobicContact CD1-CZ3 4.42Å; H63-W67 WeakPolarHBondContact O-CB 3.47Å; H63-W67 PolarHBondContact O-N 2.96Å; R64-W67 WeakPolarHBondContact O-CA 3.49Å; R64-W67 VanDerWaalsContact O-CB 3.27Å; R64-W67 WeakPolarHBondContact O-CB 3.5Å; R64-W67 PolarHBondContact O-N 2.64Å; R64-W67 VanDerWaalsContact O-N 3.12Å; W67-R70 PolarHBondContact O-N 3.06Å; W67-V71 WeakPolarHBondContact O-CG2 3.47Å; W67-V71 PolarHBondContact O-N 3.05Å; W67-W177 HydrophobicContact CB-CH2 3.97Å; W67-W177 HydrophobicContact CB-CZ3 4.09Å; W67-W177 HydrophobicContact CD2-CZ3 4.15Å; W67-W177 HydrophobicContact CE3-CH2 4.08Å; W67-W177 AromaticContact CE3-CZ3 3.66Å; W67-W177 HydrophobicContact CE3-CZ3 3.66Å; W67-W177 HydrophobicContact CG-CZ3 4.38Å; W67-W177 HydrophobicContact CZ3-CZ3 4.4Å; W67-F178 AromaticContact CD2-CD1 3.87Å; W67-F178 HydrophobicContact CD2-CD1 3.87Å; W67-F178 AromaticContact CD2-CE1 3.59Å; W67-F178 HydrophobicContact CD2-CE1 3.59Å; W67-F178 AromaticContact CE2-CD1 3.86Å; W67-F178 AromaticContact CE2-CE1 3.61Å; W67-F178 AromaticContact CE3-CD1 3.9Å; W67-F178 HydrophobicContact CE3-CD1 3.9Å; W67-F178 HydrophobicContact CE3-CE1 4.07Å; W67-F178 AromaticContact CG-CE1 3.84Å; W67-F178 HydrophobicContact CG-CE1 3.84Å; W67-F178 AromaticContact CH2-CD1 3.9Å; W67-F178 HydrophobicContact CH2-CD1 3.9Å; W67-F178 HydrophobicContact CH2-CE1 4.48Å; W67-F178 AromaticContact CZ2-CD1 3.88Å; W67-F178 HydrophobicContact CZ2-CD1 3.88Å; W67-F178 HydrophobicContact CZ2-CE1 4.07Å; W67-F178 AromaticContact CZ3-CD1 3.92Å; W67-F178 HydrophobicContact CZ3-CD1 3.92Å; W67-F178 HydrophobicContact CZ3-CE1 4.49Å; W67-F178 AromaticContact NE1-CE1 3.88Å; W67-T181 HydrophobicContact CE3-CG2 3.98Å; W67-T181 HydrophobicContact CZ3-CG2 3.88Å; W67-I182 HydrophobicContact CH2-CD1 4.2Å; W67-I182 HydrophobicContact CH2-CG1 4.03Å; W67-I182 HydrophobicContact CZ3-CG1 4.32Å
68	D	96.7	Very high	95.6	Very high	6 Å²	6	41 Å²	41	3%	0.032	21%	0.205	C	C	.	.	H	α-helix	trans	-65.3	-40.4	-179.5	-60.4	-43.3	0	0	0	112	H41 S45 P46 Y56 R64 M65 E66 R70 V71 V72	H41-D68 WeakPolarHBondContact O-CB 3.32Å; S45-D68 VanDerWaalsContact CB-OD1 3.22Å; S45-D68 WeakPolarHBondContact CB-OD1 3.46Å; S45-D68 PolarHBondContact OG-OD1 3.45Å; P46-D68 WeakPolarHBondContact CG-OD2 3.41Å; Y56-D68 PolarHBondContact OH-OD2 3.37Å; R64-D68 VanDerWaalsContact O-CG 3.28Å; R64-D68 PolarHBondContact O-N 2.95Å; M65-D68 PolarHBondContact O-N 3.28Å; E66-D68 PolarHBondContact O-N 2.98Å; D68-R70 VanDerWaalsContact C-N 3.34Å; D68-R70 PolarHBondContact O-N 3.44Å; D68-V71 WeakPolarHBondContact O-CB 3.4Å; D68-V71 PolarHBondContact O-N 2.82Å; D68-V72 PolarHBondContact O-N 3.47Å; D68-V72 VanDerWaalsContact O-N 3.15Å
69	S	95.9	Very high	95.8	Very high	8 Å²	8	38.9 Å²	38.9	6%	0.056	19%	0.193	C	C	.	.	H	α-helix	trans	-58.2	-44.8	171.6	163.7	0	0	0	0	111.5	H41 M65 E66 V71 V72 S73 D120 Y127	H41-S69 WeakPolarHBondContact ND1-CA 3.27Å; H41-S69 PolarHBondContact ND1-N 3.33Å; M65-S69 WeakPolarHBondContact O-CB 2.83Å; M65-S69 PolarHBondContact O-N 3.1Å; E66-S69 PolarHBondContact O-N 3.25Å; S69-V71 VanDerWaalsContact C-N 3.29Å; S69-V71 PolarHBondContact O-N 3.02Å; S69-V72 PolarHBondContact O-N 3.21Å; S69-S73 WeakPolarHBondContact O-CB 3.32Å; S69-S73 PolarHBondContact O-N 2.94Å; S69-D120 PolarHBondContact OG-OD1 3.45Å; S69-Y127 VanDerWaalsContact CB-OH 3.28Å; S69-Y127 WeakPolarHBondContact CB-OH 3.4Å; S69-Y127 PolarHBondContact OG-OH 3.24Å
70	R	95.9	Very high	96	Very high	37 Å²	37	37.7 Å²	37.7	14%	0.14	19%	0.187	C	C	.	.	H	α-helix	trans	-67.2	-28.6	179.8	-72.9	-178.3	179.6	-74.2	-0.8	113.3	E66 W67 D68 S74 N174 W177 F178	E66-R70 HydrophobicContact CG-CG 4.48Å; E66-R70 WeakPolarHBondContact O-CB 3.3Å; E66-R70 VanDerWaalsContact O-CG 3.3Å; E66-R70 WeakPolarHBondContact O-CG 3.42Å; E66-R70 PolarHBondContact O-N 3.23Å; E66-R70 IonicContact OE1-CZ 2.6Å; E66-R70 IonicContact OE1-NE 3.76Å; E66-R70 PolarHBondContact OE1-NE 2.87Å; E66-R70 IonicContact OE1-NH2 2.99Å; E66-R70 PolarHBondContact OE1-NH2 3.15Å; W67-R70 PolarHBondContact O-N 3.06Å; D68-R70 VanDerWaalsContact C-N 3.34Å; D68-R70 PolarHBondContact O-N 3.44Å; R70-S74 WeakPolarHBondContact O-CB 3.2Å; R70-S74 PolarHBondContact O-N 3.32Å; R70-S74 PolarHBondContact O-OG 3.34Å; R70-N174 HydrophobicContact CB-CB 4.34Å; R70-N174 PolarHBondContact NH1-OD1 3.33Å; R70-N174 PolarHBondContact O-ND2 3.46Å; R70-W177 VanDerWaalsContact NE-CD1 3.33Å; R70-W177 VanDerWaalsContact NE-CD2 3.27Å; R70-F178 HydrophobicContact CB-CE1 4.28Å; R70-F178 HydrophobicContact CB-CE2 4.05Å; R70-F178 HydrophobicContact CB-CZ 3.57Å
71	V	97.3	Very high	96.2	Very high	25 Å²	25	36 Å²	36	15%	0.152	18%	0.176	C	C	.	.	H	α-helix	trans	-64.6	-51.4	171	172.5	0	0	0	0	109.8	I40 F49 W67 D68 S69 S73 S74 I75 F178	I40-V71 HydrophobicContact CG2-CG1 4.44Å; F49-V71 HydrophobicContact CE2-CG2 3.69Å; F49-V71 HydrophobicContact CZ-CG2 4.11Å; W67-V71 WeakPolarHBondContact O-CG2 3.47Å; W67-V71 PolarHBondContact O-N 3.05Å; D68-V71 WeakPolarHBondContact O-CB 3.4Å; D68-V71 PolarHBondContact O-N 2.82Å; S69-V71 VanDerWaalsContact C-N 3.29Å; S69-V71 PolarHBondContact O-N 3.02Å; V71-S73 PolarHBondContact O-N 3.07Å; V71-S74 PolarHBondContact O-N 3.36Å; V71-I75 HydrophobicContact CG1-CD1 4.03Å; V71-I75 WeakPolarHBondContact O-CG1 3.21Å; V71-I75 PolarHBondContact O-N 3.44Å; V71-I75 VanDerWaalsContact O-N 3.1Å; V71-F178 HydrophobicContact CG2-CE1 4.43Å; V71-F178 HydrophobicContact CG2-CZ 3.9Å
72	V	97.7	Very high	96.4	Very high	6 Å²	6	32 Å²	32	4%	0.036	17%	0.168	C	C	.	.	H	α-helix	trans	-58.6	-49.2	177.6	176.7	0	0	0	0	111.3	C37 I40 H41 D68 S69 S74 I75 H76 Y116	C37-V72 HydrophobicContact CB-CG1 3.83Å; I40-V72 HydrophobicContact CB-CG2 3.86Å; I40-V72 HydrophobicContact CG2-CG2 3.59Å; H41-V72 HydrophobicContact CB-CG2 3.95Å; D68-V72 PolarHBondContact O-N 3.47Å; D68-V72 VanDerWaalsContact O-N 3.15Å; S69-V72 PolarHBondContact O-N 3.21Å; V72-S74 VanDerWaalsContact C-N 3.29Å; V72-S74 PolarHBondContact O-N 3.03Å; V72-I75 PolarHBondContact O-N 3.41Å; V72-H76 WeakPolarHBondContact O-CB 3.27Å; V72-H76 PolarHBondContact O-N 3.27Å; V72-Y116 HydrophobicContact CG1-CD2 3.94Å; V72-Y116 HydrophobicContact CG1-CE2 4.09Å
73	S	97.1	Very high	96.7	Very high	10 Å²	10	31.3 Å²	31.3	7%	0.07	16%	0.16	C	C	.	.	H	α-helix	trans	-56.5	-40.8	177.8	177.8	0	0	0	0	112.2	S69 V71 A77 Y116 T170 N174	S69-S73 WeakPolarHBondContact O-CB 3.32Å; S69-S73 PolarHBondContact O-N 2.94Å; V71-S73 PolarHBondContact O-N 3.07Å; S73-A77 WeakPolarHBondContact O-CB 3.45Å; S73-A77 PolarHBondContact O-N 3.36Å; S73-Y116 VanDerWaalsContact CB-OH 3.22Å; S73-Y116 WeakPolarHBondContact CB-OH 3.28Å; S73-Y116 PolarHBondContact OG-OH 3.47Å; S73-Y116 VanDerWaalsContact OG-OH 3.11Å; S73-T170 VanDerWaalsContact OG-CG2 3.24Å; S73-T170 WeakPolarHBondContact OG-CG2 3.47Å; S73-N174 WeakPolarHBondContact CB-ND2 3.49Å; S73-N174 PolarHBondContact OG-ND2 3.35Å; S73-N174 VanDerWaalsContact OG-ND2 3.11Å
74	S	97.4	Very high	96.9	Very high	23 Å²	23	29.3 Å²	29.3	16%	0.161	15%	0.151	C	C	.	.	H	α-helix	trans	-68.6	-39.8	178.3	-56.2	0	0	0	0	112.6	R70 V71 V72 T78 N174	R70-S74 WeakPolarHBondContact O-CB 3.2Å; R70-S74 PolarHBondContact O-N 3.32Å; R70-S74 PolarHBondContact O-OG 3.34Å; V71-S74 PolarHBondContact O-N 3.36Å; V72-S74 VanDerWaalsContact C-N 3.29Å; V72-S74 PolarHBondContact O-N 3.03Å; S74-T78 WeakPolarHBondContact O-CB 3.28Å; S74-T78 PolarHBondContact O-N 3.04Å; S74-T78 VanDerWaalsContact O-N 3.1Å; S74-T78 PolarHBondContact O-OG1 3.23Å; S74-N174 PolarHBondContact N-ND2 3.34Å; S74-N174 WeakPolarHBondContact OG-CB 3.4Å; S74-N174 PolarHBondContact OG-ND2 2.93Å
75	I	97.9	Very high	97	Very high	73 Å²	73	28.8 Å²	28.8	37%	0.374	16%	0.156	S	C	.	.	H	α-helix	trans	-66.1	-51.2	176.8	-66.8	166.8	0	0	0	110	I40 V71 V72 A77 T78 I79	I40-I75 HydrophobicContact CD1-CD1 4.46Å; I40-I75 HydrophobicContact CG2-CD1 4.36Å; V71-I75 HydrophobicContact CG1-CD1 4.03Å; V71-I75 WeakPolarHBondContact O-CG1 3.21Å; V71-I75 PolarHBondContact O-N 3.44Å; V71-I75 VanDerWaalsContact O-N 3.1Å; V72-I75 PolarHBondContact O-N 3.41Å; I75-A77 PolarHBondContact O-N 2.94Å; I75-T78 PolarHBondContact O-N 3.24Å; I75-I79 HydrophobicContact CG2-CD1 3.78Å; I75-I79 WeakPolarHBondContact O-CG1 3.22Å; I75-I79 PolarHBondContact O-N 2.89Å
76	H	98.3	Very high	97.1	Very high	7 Å²	7	30.5 Å²	30.5	3%	0.032	17%	0.168	C	C	.	.	H	α-helix	trans	-53.6	-55.8	176.2	161.5	-90.2	0	0	0	110.7	V72 T78 I79 V80 S113 Y116	V72-H76 WeakPolarHBondContact O-CB 3.27Å; V72-H76 PolarHBondContact O-N 3.27Å; H76-T78 VanDerWaalsContact C-N 3.26Å; H76-T78 PolarHBondContact O-N 2.54Å; H76-I79 PolarHBondContact O-N 2.97Å; H76-I79 VanDerWaalsContact O-N 3.11Å; H76-V80 WeakPolarHBondContact NE2-CG1 3.43Å; H76-V80 WeakPolarHBondContact O-CG2 3.46Å; H76-V80 PolarHBondContact O-N 3.15Å; H76-S113 WeakPolarHBondContact NE2-CA 3.3Å; H76-S113 PolarHBondContact NE2-OG 2.91Å; H76-Y116 HydrophobicContact CB-CD1 4.37Å; H76-Y116 HydrophobicContact CB-CD2 3.95Å; H76-Y116 HydrophobicContact CB-CE2 4.4Å; H76-Y116 HydrophobicContact CB-CG 3.95Å; H76-Y116 WeakPolarHBondContact CD2-CB 3.22Å; H76-Y116 AromaticContact CD2-CD1 3.71Å; H76-Y116 AromaticContact CD2-CG 3.55Å; H76-Y116 AromaticContact CE1-CD1 3.36Å; H76-Y116 WeakPolarHBondContact CE1-CD1 3.33Å; H76-Y116 AromaticContact CE1-CE1 3.87Å; H76-Y116 AromaticContact CG-CD1 3.53Å; H76-Y116 AromaticContact CG-CD2 3.96Å; H76-Y116 AromaticContact CG-CG 3.45Å; H76-Y116 VanDerWaalsContact CG-CG 3.45Å; H76-Y116 AromaticContact ND1-CD1 3.34Å; H76-Y116 VanDerWaalsContact ND1-CD1 3.34Å; H76-Y116 WeakPolarHBondContact ND1-CD1 3.48Å; H76-Y116 AromaticContact ND1-CE1 3.6Å; H76-Y116 AromaticContact ND1-CG 3.79Å; H76-Y116 AromaticContact NE2-CD1 3.6Å; H76-Y116 AromaticContact NE2-CG 3.93Å
77	A	97.9	Very high	97.2	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-59.2	-38.2	-176.1	0	0	0	0	0	112.1	S73 I75 S81 E167 T170 P171	S73-A77 WeakPolarHBondContact O-CB 3.45Å; S73-A77 PolarHBondContact O-N 3.36Å; I75-A77 PolarHBondContact O-N 2.94Å; A77-S81 WeakPolarHBondContact O-CB 3.31Å; A77-S81 PolarHBondContact O-N 3.02Å; A77-S81 PolarHBondContact O-OG 2.81Å; A77-E167 HydrophobicContact CB-CB 4.2Å; A77-T170 HydrophobicContact CB-CG2 3.92Å; A77-P171 HydrophobicContact CB-CG 3.98Å
78	T	97.5	Very high	97.2	Very high	68 Å²	68	30.4 Å²	30.4	42%	0.417	17%	0.168	S	C	.	.	H	α-helix	trans	-64	-49.7	176.1	-57	0	0	0	0	111.3	S74 I75 H76 I82	S74-T78 WeakPolarHBondContact O-CB 3.28Å; S74-T78 PolarHBondContact O-N 3.04Å; S74-T78 VanDerWaalsContact O-N 3.1Å; S74-T78 PolarHBondContact O-OG1 3.23Å; I75-T78 PolarHBondContact O-N 3.24Å; H76-T78 VanDerWaalsContact C-N 3.26Å; H76-T78 PolarHBondContact O-N 2.54Å; T78-I82 HydrophobicContact CG2-CD1 4.2Å; T78-I82 WeakPolarHBondContact O-CG1 3.43Å; T78-I82 PolarHBondContact O-N 3.37Å
79	I	97.9	Very high	97.2	Very high	78 Å²	78	35.5 Å²	35.5	40%	0.4	20%	0.2	S	C	.	.	H	α-helix	trans	-62.5	-51.7	-179	-67.4	168.3	0	0	0	110.7	I75 H76 S81 I82 L83	I75-I79 HydrophobicContact CG2-CD1 3.78Å; I75-I79 WeakPolarHBondContact O-CG1 3.22Å; I75-I79 PolarHBondContact O-N 2.89Å; H76-I79 PolarHBondContact O-N 2.97Å; H76-I79 VanDerWaalsContact O-N 3.11Å; I79-S81 VanDerWaalsContact C-N 3.31Å; I79-S81 PolarHBondContact O-N 2.77Å; I79-I82 PolarHBondContact O-N 3.25Å; I79-L83 HydrophobicContact CG2-CD1 4.02Å; I79-L83 WeakPolarHBondContact O-CG 3.47Å; I79-L83 PolarHBondContact O-N 3.41Å
80	V	98.1	Very high	97.2	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-70	-30.4	-175.7	-57.3	0	0	0	0	112.3	H76 L83 C84 I112 L164 E167	H76-V80 WeakPolarHBondContact NE2-CG1 3.43Å; H76-V80 WeakPolarHBondContact O-CG2 3.46Å; H76-V80 PolarHBondContact O-N 3.15Å; V80-L83 PolarHBondContact O-N 3.17Å; V80-C84 WeakPolarHBondContact O-CB 3.24Å; V80-C84 PolarHBondContact O-N 3.15Å; V80-C84 PolarHBondContact O-SG 3.04Å; V80-I112 HydrophobicContact CG1-CB 4.26Å; V80-I112 HydrophobicContact CG1-CG2 3.8Å; V80-L164 HydrophobicContact CB-CD2 4.09Å; V80-L164 HydrophobicContact CB-CG 4.43Å; V80-L164 HydrophobicContact CG2-CD1 4.14Å; V80-L164 HydrophobicContact CG2-CD2 4.39Å; V80-L164 HydrophobicContact CG2-CG 4.23Å; V80-E167 HydrophobicContact CG2-CB 4.1Å; V80-E167 HydrophobicContact CG2-CG 4.26Å
81	S	97.1	Very high	97.1	Very high	8 Å²	8	39.9 Å²	39.9	6%	0.056	23%	0.229	C	C	.	.	H	α-helix	trans	-62.6	-45.4	172.9	-68	0	0	0	0	111.7	A77 I79 L83 C84 V85 L168	A77-S81 WeakPolarHBondContact O-CB 3.31Å; A77-S81 PolarHBondContact O-N 3.02Å; A77-S81 PolarHBondContact O-OG 2.81Å; I79-S81 VanDerWaalsContact C-N 3.31Å; I79-S81 PolarHBondContact O-N 2.77Å; S81-L83 VanDerWaalsContact C-N 3.34Å; S81-L83 PolarHBondContact O-N 3.38Å; S81-C84 PolarHBondContact O-N 2.99Å; S81-V85 WeakPolarHBondContact O-CB 3.41Å; S81-V85 WeakPolarHBondContact O-CG2 3.42Å; S81-V85 PolarHBondContact O-N 3.12Å; S81-L168 PolarHBondContact OG-N 2.85Å
82	I	97.4	Very high	96.9	Very high	105 Å²	105	41.2 Å²	41.2	54%	0.538	24%	0.242	S	C	.	.	H	α-helix	trans	-60.5	-46.3	175.8	-66.7	165.2	0	0	0	110	T78 I79 C84 T86	T78-I82 HydrophobicContact CG2-CD1 4.2Å; T78-I82 WeakPolarHBondContact O-CG1 3.43Å; T78-I82 PolarHBondContact O-N 3.37Å; I79-I82 PolarHBondContact O-N 3.25Å; I82-C84 PolarHBondContact O-N 3.4Å; I82-T86 VanDerWaalsContact O-CB 3.31Å; I82-T86 WeakPolarHBondContact O-CB 3.37Å; I82-T86 PolarHBondContact O-N 3.5Å; I82-T86 PolarHBondContact O-OG1 2.83Å
83	L	97.8	Very high	96.6	Very high	36 Å²	36	43.8 Å²	43.8	19%	0.188	26%	0.256	C	S	.	.	H	α-helix	trans	-63.6	-41	179.2	-68.1	173	0	0	0	112.5	I79 V80 S81 A87 A109 I112	I79-L83 HydrophobicContact CG2-CD1 4.02Å; I79-L83 WeakPolarHBondContact O-CG 3.47Å; I79-L83 PolarHBondContact O-N 3.41Å; V80-L83 PolarHBondContact O-N 3.17Å; S81-L83 VanDerWaalsContact C-N 3.34Å; S81-L83 PolarHBondContact O-N 3.38Å; L83-A87 WeakPolarHBondContact O-CB 3.4Å; L83-A87 PolarHBondContact O-N 3.24Å; L83-A109 HydrophobicContact CB-CB 3.74Å; L83-A109 HydrophobicContact CD1-CB 4.16Å; L83-I112 HydrophobicContact CD1-CD1 3.83Å
84	C	97.7	Very high	96.4	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-68.6	-43.8	179.1	-68.3	0	0	0	0	112.2	V80 S81 I82 T86 A87 L88 V161 T165	V80-C84 WeakPolarHBondContact O-CB 3.24Å; V80-C84 PolarHBondContact O-N 3.15Å; V80-C84 PolarHBondContact O-SG 3.04Å; S81-C84 PolarHBondContact O-N 2.99Å; I82-C84 PolarHBondContact O-N 3.4Å; C84-T86 VanDerWaalsContact C-N 3.34Å; C84-A87 WeakPolarHBondContact O-CB 3.24Å; C84-A87 PolarHBondContact O-N 2.85Å; C84-L88 WeakPolarHBondContact O-CG 3.27Å; C84-L88 PolarHBondContact O-N 2.68Å; C84-V161 HydrophobicContact CB-CG1 3.81Å; C84-T165 HydrophobicContact CB-CG2 4.07Å
85	V	96.2	Very high	96.2	Very high	67 Å²	67	47.4 Å²	47.4	41%	0.406	26%	0.264	S	S	.	.	H	α-helix	trans	-63	-45.1	176	172.2	0	0	0	0	110	S81 A87 L88 V89	S81-V85 WeakPolarHBondContact O-CB 3.41Å; S81-V85 WeakPolarHBondContact O-CG2 3.42Å; S81-V85 PolarHBondContact O-N 3.12Å; V85-A87 PolarHBondContact O-N 2.92Å; V85-L88 PolarHBondContact O-N 3.47Å; V85-V89 HydrophobicContact CG1-CG2 4.17Å; V85-V89 WeakPolarHBondContact O-CB 3.42Å; V85-V89 VanDerWaalsContact O-CG2 3.24Å; V85-V89 WeakPolarHBondContact O-CG2 3.5Å; V85-V89 PolarHBondContact O-N 2.96Å
86	T	96.8	Very high	95.9	Very high	61 Å²	61	52.7 Å²	52.7	37%	0.374	28%	0.281	S	S	.	.	H	α-helix	trans	-58.8	-48.4	175.7	-55.7	0	0	0	0	110.8	I82 C84 L88 V89 T90	I82-T86 VanDerWaalsContact O-CB 3.31Å; I82-T86 WeakPolarHBondContact O-CB 3.37Å; I82-T86 PolarHBondContact O-N 3.5Å; I82-T86 PolarHBondContact O-OG1 2.83Å; C84-T86 VanDerWaalsContact C-N 3.34Å; T86-L88 PolarHBondContact O-N 3.19Å; T86-V89 PolarHBondContact O-N 3.1Å; T86-T90 HydrophobicContact CG2-CG2 4.06Å; T86-T90 WeakPolarHBondContact O-CB 3.37Å; T86-T90 WeakPolarHBondContact O-CG2 3.08Å; T86-T90 PolarHBondContact O-N 3.38Å; T86-T90 PolarHBondContact O-OG1 2.86Å
87	A	96.6	Very high	95.4	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-54.2	-51.2	177.5	0	0	0	0	0	112.7	L83 C84 V85 N91 T103 S105 V161	L83-A87 WeakPolarHBondContact O-CB 3.4Å; L83-A87 PolarHBondContact O-N 3.24Å; C84-A87 WeakPolarHBondContact O-CB 3.24Å; C84-A87 PolarHBondContact O-N 2.85Å; V85-A87 PolarHBondContact O-N 2.92Å; A87-N91 WeakPolarHBondContact O-CB 3.37Å; A87-N91 PolarHBondContact O-N 3.05Å; A87-N91 PolarHBondContact O-ND2 3.19Å; A87-T103 HydrophobicContact CB-CG2 3.98Å; A87-S105 WeakPolarHBondContact CA-OG 3.29Å; A87-S105 WeakPolarHBondContact CB-OG 3.34Å; A87-V161 HydrophobicContact CB-CG1 3.89Å
88	L	96.5	Very high	95.2	Very high	20 Å²	20	56 Å²	56	11%	0.105	30%	0.3	C	S	.	.	H	α-helix	trans	-71.8	-31.3	-176.3	-68.6	169.1	0	0	0	113.2	C84 V85 T86 W95 F158 V161 T165	C84-L88 WeakPolarHBondContact O-CG 3.27Å; C84-L88 PolarHBondContact O-N 2.68Å; V85-L88 PolarHBondContact O-N 3.47Å; T86-L88 PolarHBondContact O-N 3.19Å; L88-W95 HydrophobicContact CB-CZ2 4.43Å; L88-W95 HydrophobicContact CD2-CZ2 4.24Å; L88-W95 PolarHBondContact O-NE1 2.88Å; L88-F158 HydrophobicContact CD2-CD2 4.12Å; L88-F158 HydrophobicContact CD2-CE2 4.17Å; L88-V161 HydrophobicContact CD1-CG1 4.19Å; L88-V161 HydrophobicContact CD2-CG1 4.15Å; L88-V161 HydrophobicContact CG-CG1 3.82Å; L88-T165 HydrophobicContact CD1-CG2 3.66Å
89	V	96.4	Very high	94.8	Very high	113 Å²	113	53 Å²	53	69%	0.685	28%	0.281	S	S	*	.	H	α-helix	trans	-82.4	-40.6	-179.2	172.2	0	0	0	0	111.8	V85 T86	V85-V89 HydrophobicContact CG1-CG2 4.17Å; V85-V89 WeakPolarHBondContact O-CB 3.42Å; V85-V89 VanDerWaalsContact O-CG2 3.24Å; V85-V89 WeakPolarHBondContact O-CG2 3.5Å; V85-V89 PolarHBondContact O-N 2.96Å; T86-V89 PolarHBondContact O-N 3.1Å
90	T	95.6	Very high	94.3	Very high	91 Å²	91	50.9 Å²	50.9	56%	0.558	27%	0.27	S	S	*	.	H	α-helix	trans	-91	-15.3	-172.7	71.9	0	0	0	0	114	T86	T86-T90 HydrophobicContact CG2-CG2 4.06Å; T86-T90 WeakPolarHBondContact O-CB 3.37Å; T86-T90 WeakPolarHBondContact O-CG2 3.08Å; T86-T90 PolarHBondContact O-N 3.38Å; T86-T90 PolarHBondContact O-OG1 2.86Å
91	N	93.5	Very high	93.9	Very high	46 Å²	46	50.9 Å²	50.9	25%	0.246	27%	0.27	C	S	.	.			trans	-117.6	84.5	-176.7	-54.1	-84.8	0	0	0	110.7	A87 D93 L94 T103	A87-N91 WeakPolarHBondContact O-CB 3.37Å; A87-N91 PolarHBondContact O-N 3.05Å; A87-N91 PolarHBondContact O-ND2 3.19Å; N91-D93 PolarHBondContact O-N 3.34Å; N91-D93 VanDerWaalsContact O-N 3.17Å; N91-L94 HydrophobicContact CB-CD1 4Å; N91-L94 HydrophobicContact CB-CG 4.08Å; N91-L94 PolarHBondContact O-N 3.45Å; N91-L94 VanDerWaalsContact O-N 3.17Å; N91-T103 PolarHBondContact ND2-OG1 3.33Å
92	A	93.7	Very high	93.5	Very high	53 Å²	53	53 Å²	53	44%	0.438	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-28	177.8	0	0	0	0	0	112.8	L94 W95 Y96	A92-L94 PolarHBondContact O-N 2.89Å; A92-W95 WeakPolarHBondContact O-CB 3.21Å; A92-W95 PolarHBondContact O-N 3.05Å; A92-Y96 HydrophobicContact CB-CD2 4.3Å; A92-Y96 HydrophobicContact CB-CE2 3.84Å; A92-Y96 WeakPolarHBondContact O-CD2 3.39Å; A92-Y96 PolarHBondContact O-N 3.06Å
93	D	90.8	Very high	93.3	Very high	60 Å²	60	48.2 Å²	48.2	32%	0.321	26%	0.259	S	S	.	.	H	α-helix	trans	-56.4	-31.8	177.2	-176.4	56.3	0	0	0	113.6	N91 W95 Y96 N97 G101	N91-D93 PolarHBondContact O-N 3.34Å; N91-D93 VanDerWaalsContact O-N 3.17Å; D93-W95 PolarHBondContact O-N 3.08Å; D93-Y96 PolarHBondContact O-N 3.05Å; D93-N97 PolarHBondContact O-N 3.11Å; D93-N97 PolarHBondContact OD1-ND2 3.1Å; D93-G101 VanDerWaalsContact OD2-CA 3.31Å; D93-G101 WeakPolarHBondContact OD2-CA 3.36Å
94	L	93.1	Very high	93	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-61.9	-30.3	175.2	-64	172.9	0	0	0	112.7	N91 A92 P98 G101 T103 V157 F158	N91-L94 HydrophobicContact CB-CD1 4Å; N91-L94 HydrophobicContact CB-CG 4.08Å; N91-L94 PolarHBondContact O-N 3.45Å; N91-L94 VanDerWaalsContact O-N 3.17Å; A92-L94 PolarHBondContact O-N 2.89Å; L94-P98 VanDerWaalsContact O-CA 3.3Å; L94-P98 WeakPolarHBondContact O-CA 3.48Å; L94-G101 WeakPolarHBondContact CD2-O 3.41Å; L94-T103 HydrophobicContact CD1-CG2 3.59Å; L94-T103 HydrophobicContact CD2-CG2 3.99Å; L94-T103 HydrophobicContact CG-CG2 4.25Å; L94-V157 HydrophobicContact CD2-CB 4.43Å; L94-V157 HydrophobicContact CD2-CG1 4.45Å; L94-F158 HydrophobicContact CB-CB 4.3Å; L94-F158 HydrophobicContact CB-CD2 4.07Å; L94-F158 VanDerWaalsContact O-CD2 3.26Å; L94-F158 WeakPolarHBondContact O-CD2 3.4Å; L94-F158 WeakPolarHBondContact O-CG 3.29Å
95	W	93.6	Very high	92.9	Very high	109 Å²	109	51.5 Å²	51.5	41%	0.413	28%	0.275	S	S	.	.	H	α-helix	trans	-82.5	-35.2	179.3	-64.3	94.3	0	0	0	112	L88 A92 D93 F158 Y162 M216	L88-W95 HydrophobicContact CB-CZ2 4.43Å; L88-W95 HydrophobicContact CD2-CZ2 4.24Å; L88-W95 PolarHBondContact O-NE1 2.88Å; A92-W95 WeakPolarHBondContact O-CB 3.21Å; A92-W95 PolarHBondContact O-N 3.05Å; D93-W95 PolarHBondContact O-N 3.08Å; W95-F158 AromaticContact CD2-CE2 3.83Å; W95-F158 HydrophobicContact CD2-CE2 3.83Å; W95-F158 AromaticContact CE3-CE2 3.6Å; W95-F158 HydrophobicContact CE3-CE2 3.6Å; W95-F158 AromaticContact CE3-CZ 3.99Å; W95-F158 HydrophobicContact CE3-CZ 3.99Å; W95-F158 HydrophobicContact CH2-CE2 4.09Å; W95-F158 HydrophobicContact CH2-CZ 4.42Å; W95-F158 HydrophobicContact CZ2-CE2 4.29Å; W95-F158 AromaticContact CZ3-CE2 3.74Å; W95-F158 HydrophobicContact CZ3-CE2 3.74Å; W95-F158 AromaticContact CZ3-CZ 3.86Å; W95-F158 HydrophobicContact CZ3-CZ 3.86Å; W95-Y162 HydrophobicContact CH2-CD2 4.32Å; W95-Y162 HydrophobicContact CH2-CE2 4.05Å; W95-M216 WeakPolarHBondContact O-CE 3.48Å
96	Y	91.2	Very high	92.9	Very high	184 Å²	184	48.3 Å²	48.3	72%	0.722	26%	0.256	S	S	*	.	H	α-helix	trans	-76.9	-39.5	178	-64.2	-60.6	0	0	0	112.4	A92 D93 P98	A92-Y96 HydrophobicContact CB-CD2 4.3Å; A92-Y96 HydrophobicContact CB-CE2 3.84Å; A92-Y96 WeakPolarHBondContact O-CD2 3.39Å; A92-Y96 PolarHBondContact O-N 3.06Å; D93-Y96 PolarHBondContact O-N 3.05Å; Y96-P98 WeakPolarHBondContact O-CD 3.3Å
97	N	89.2	Confident	92.8	Very high	66 Å²	66	45.4 Å²	45.4	35%	0.353	24%	0.238	S	C	.	.			trans	-123.6	57.8	-174.8	-64.6	-58.7	0	0	0	111.8	D93 A99 I100 G101	D93-N97 PolarHBondContact O-N 3.11Å; D93-N97 PolarHBondContact OD1-ND2 3.1Å; N97-A99 PolarHBondContact O-N 2.71Å; N97-I100 HydrophobicContact CB-CG1 3.93Å; N97-I100 PolarHBondContact O-N 3.32Å; N97-I100 VanDerWaalsContact O-N 3.07Å; N97-G101 WeakPolarHBondContact O-CA 3.47Å; N97-G101 PolarHBondContact O-N 3.24Å
98	P	92.3	Very high	92.8	Very high	12 Å²	12	46.8 Å²	46.8	8%	0.078	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-26.3	-173.2	23.3	-37.8	0	0	0	115.7	L94 Y96 F158 F159 M216 S220	L94-P98 VanDerWaalsContact O-CA 3.3Å; L94-P98 WeakPolarHBondContact O-CA 3.48Å; Y96-P98 WeakPolarHBondContact O-CD 3.3Å; P98-F158 HydrophobicContact CB-CB 3.97Å; P98-F158 HydrophobicContact CB-CD1 3.68Å; P98-F158 HydrophobicContact CB-CE1 4.4Å; P98-F158 HydrophobicContact CB-CG 3.88Å; P98-F159 HydrophobicContact CB-CE2 4.07Å; P98-F159 HydrophobicContact CB-CZ 4.11Å; P98-M216 HydrophobicContact CB-CE 4.34Å; P98-M216 HydrophobicContact CG-CE 4.06Å; P98-S220 WeakPolarHBondContact CG-OG 3.29Å
99	A	89.6	Confident	92.9	Very high	3 Å²	3	45.8 Å²	45.8	3%	0.025	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-34.5	178.4	0	0	0	0	0	113.5	N97 T155 C156 A225 Y226	N97-A99 PolarHBondContact O-N 2.71Å; A99-T155 PolarHBondContact O-OG1 3.49Å; A99-C156 PolarHBondContact O-N 3.07Å; A99-A225 HydrophobicContact CB-CB 4.49Å; A99-Y226 HydrophobicContact CB-CD2 4.26Å
100	I	88.4	Confident	93	Very high	34 Å²	34	40.4 Å²	40.4	17%	0.174	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124.8	-19	-169.9	59.8	170	0	0	0	114.1	F14 N97 V102 A225	F14-I100 HydrophobicContact CD1-CG2 3.8Å; F14-I100 HydrophobicContact CE1-CG2 3.59Å; N97-I100 HydrophobicContact CB-CG1 3.93Å; N97-I100 PolarHBondContact O-N 3.32Å; N97-I100 VanDerWaalsContact O-N 3.07Å; I100-V102 WeakPolarHBondContact O-CG2 3.46Å; I100-V102 PolarHBondContact O-N 3.18Å; I100-A225 HydrophobicContact CD1-CB 4.11Å; I100-A225 HydrophobicContact CG1-CB 4.33Å; I100-A225 HydrophobicContact CG2-CB 3.87Å
101	G	88	Confident	93.1	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.181	C	C	.	.			trans	-59.1	132.3	179.6	0	0	0	0	0	110.5	D93 L94 N97	D93-G101 VanDerWaalsContact OD2-CA 3.31Å; D93-G101 WeakPolarHBondContact OD2-CA 3.36Å; L94-G101 WeakPolarHBondContact CD2-O 3.41Å; N97-G101 WeakPolarHBondContact O-CA 3.47Å; N97-G101 PolarHBondContact O-N 3.24Å
102	V	90.1	Very high	93.3	Very high	52 Å²	52	35 Å²	35	32%	0.315	17%	0.174	S	C	.	.			trans	-122.2	142.3	-176.2	179.6	0	0	0	0	110	L17 I100 L107 R154 V157	L17-V102 HydrophobicContact CD2-CG2 3.46Å; L17-V102 VanDerWaalsContact CD2-CG2 3.46Å; I100-V102 WeakPolarHBondContact O-CG2 3.46Å; I100-V102 PolarHBondContact O-N 3.18Å; V102-L107 HydrophobicContact CG1-CD1 3.42Å; V102-L107 VanDerWaalsContact CG1-CD1 3.42Å; V102-L107 HydrophobicContact CG1-CG 4.18Å; V102-R154 HydrophobicContact CG2-CB 4.47Å; V102-R154 VanDerWaalsContact CG2-O 3.24Å; V102-R154 WeakPolarHBondContact CG2-O 3.4Å; V102-V157 HydrophobicContact CG2-CG2 4.23Å
103	T	92.8	Very high	93.6	Very high	6 Å²	6	32.4 Å²	32.4	4%	0.037	15%	0.154	C	C	.	.			trans	-133.3	141.8	169.9	176.7	0	0	0	0	110.1	A87 N91 L94 S105 L107 V157	A87-T103 HydrophobicContact CB-CG2 3.98Å; N91-T103 PolarHBondContact ND2-OG1 3.33Å; L94-T103 HydrophobicContact CD1-CG2 3.59Å; L94-T103 HydrophobicContact CD2-CG2 3.99Å; L94-T103 HydrophobicContact CG-CG2 4.25Å; T103-S105 PolarHBondContact OG1-OG 3.32Å; T103-L107 WeakPolarHBondContact O-CG 3.41Å; T103-L107 PolarHBondContact O-N 3.1Å; T103-V157 HydrophobicContact CG2-CG1 4Å
104	H	92.1	Very high	93.9	Very high	84 Å²	84	29.9 Å²	29.9	39%	0.389	14%	0.14	S	C	.	.	H	α-helix	trans	-65.3	-46	177.7	-176.4	65.4	0	0	0	111.8	Y25 Y26 G106 L107 M108	Y25-H104 AromaticContact CE1-CE1 3.61Å; Y26-H104 AromaticContact CE1-ND1 3.58Å; Y26-H104 AromaticContact CZ-ND1 3.69Å; Y26-H104 PolarHBondContact OH-ND1 3.23Å; H104-G106 VanDerWaalsContact C-N 3.33Å; H104-G106 PolarHBondContact O-N 3.05Å; H104-L107 PolarHBondContact O-N 3.31Å; H104-M108 PolarHBondContact NE2-SD 3.5Å; H104-M108 WeakPolarHBondContact O-CB 3.22Å; H104-M108 WeakPolarHBondContact O-CG 3.46Å; H104-M108 PolarHBondContact O-N 2.67Å
105	S	94.1	Very high	94.2	Very high	21 Å²	21	29.9 Å²	29.9	15%	0.147	14%	0.14	C	C	.	.	H	α-helix	trans	-64.2	-38.1	-179.4	53	0	0	0	0	112.1	A87 T103 A109	A87-S105 WeakPolarHBondContact CA-OG 3.29Å; A87-S105 WeakPolarHBondContact CB-OG 3.34Å; T103-S105 PolarHBondContact OG1-OG 3.32Å; S105-A109 WeakPolarHBondContact O-CB 3.43Å; S105-A109 PolarHBondContact O-N 3.02Å
106	G	96	Very high	94.4	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-67.6	-46.6	175.7	0	0	0	0	0	113	H104 M108 A109 L110	H104-G106 VanDerWaalsContact C-N 3.33Å; H104-G106 PolarHBondContact O-N 3.05Å; G106-M108 VanDerWaalsContact C-N 3.32Å; G106-M108 PolarHBondContact O-N 2.99Å; G106-A109 WeakPolarHBondContact O-CB 3.24Å; G106-A109 PolarHBondContact O-N 2.88Å; G106-L110 VanDerWaalsContact O-CG 3.3Å; G106-L110 WeakPolarHBondContact O-CG 3.48Å; G106-L110 PolarHBondContact O-N 2.83Å
107	L	96	Very high	94.7	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-62.4	-38.9	175.2	-75.8	177.5	0	0	0	112	Y26 V102 T103 H104 L110 S111 V151 R154 V157	Y26-L107 HydrophobicContact CD1-CB 3.62Å; Y26-L107 HydrophobicContact CD2-CB 4.4Å; Y26-L107 HydrophobicContact CD2-CD1 4.03Å; Y26-L107 HydrophobicContact CE1-CB 3.38Å; Y26-L107 HydrophobicContact CE1-CD1 4.14Å; Y26-L107 HydrophobicContact CE1-CG 4.42Å; Y26-L107 HydrophobicContact CE2-CB 4.19Å; Y26-L107 HydrophobicContact CE2-CD1 3.45Å; Y26-L107 VanDerWaalsContact CE2-CD1 3.45Å; Y26-L107 HydrophobicContact CE2-CG 4.45Å; Y26-L107 HydrophobicContact CG-CB 4.13Å; V102-L107 HydrophobicContact CG1-CD1 3.42Å; V102-L107 VanDerWaalsContact CG1-CD1 3.42Å; V102-L107 HydrophobicContact CG1-CG 4.18Å; T103-L107 WeakPolarHBondContact O-CG 3.41Å; T103-L107 PolarHBondContact O-N 3.1Å; H104-L107 PolarHBondContact O-N 3.31Å; L107-L110 PolarHBondContact O-N 3.19Å; L107-S111 WeakPolarHBondContact O-CB 3.49Å; L107-S111 PolarHBondContact O-N 3.06Å; L107-S111 PolarHBondContact O-OG 3.11Å; L107-V151 HydrophobicContact CD2-CG2 4.35Å; L107-R154 HydrophobicContact CD1-CG 4.22Å; L107-V157 HydrophobicContact CD2-CG1 4.35Å; L107-V157 HydrophobicContact CD2-CG2 3.74Å; L107-V157 HydrophobicContact CG-CG1 4.3Å; L107-V157 HydrophobicContact CG-CG2 4.16Å
108	M	96.6	Very high	95.1	Very high	28 Å²	28	17.2 Å²	17.2	14%	0.138	9%	0.091	C	C	.	.	H	α-helix	trans	-60.5	-46.2	171.6	-76.9	-174.4	66.6	0	0	112.2	Y26 W29 H104 G106 L110 S111 I112	Y26-M108 HydrophobicContact CD1-CG 4.48Å; Y26-M108 HydrophobicContact CE1-CG 4.28Å; W29-M108 HydrophobicContact CD2-CE 3.96Å; W29-M108 HydrophobicContact CE3-CE 4.03Å; W29-M108 HydrophobicContact CH2-CE 3.62Å; W29-M108 HydrophobicContact CZ2-CE 3.52Å; W29-M108 HydrophobicContact CZ2-SD 4.47Å; W29-M108 HydrophobicContact CZ3-CE 3.87Å; H104-M108 PolarHBondContact NE2-SD 3.5Å; H104-M108 WeakPolarHBondContact O-CB 3.22Å; H104-M108 WeakPolarHBondContact O-CG 3.46Å; H104-M108 PolarHBondContact O-N 2.67Å; G106-M108 VanDerWaalsContact C-N 3.32Å; G106-M108 PolarHBondContact O-N 2.99Å; M108-L110 VanDerWaalsContact C-N 3.33Å; M108-L110 PolarHBondContact O-N 3.15Å; M108-S111 PolarHBondContact O-N 3.45Å; M108-I112 WeakPolarHBondContact O-CB 3.32Å; M108-I112 VanDerWaalsContact O-CG1 3.26Å; M108-I112 WeakPolarHBondContact O-CG1 3.5Å; M108-I112 PolarHBondContact O-N 2.92Å
109	A	98	Very high	95.3	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-58.5	-45.8	178.7	0	0	0	0	0	111.6	L83 S105 G106 I112 S113 L164	L83-A109 HydrophobicContact CB-CB 3.74Å; L83-A109 HydrophobicContact CD1-CB 4.16Å; S105-A109 WeakPolarHBondContact O-CB 3.43Å; S105-A109 PolarHBondContact O-N 3.02Å; G106-A109 WeakPolarHBondContact O-CB 3.24Å; G106-A109 PolarHBondContact O-N 2.88Å; A109-I112 PolarHBondContact O-N 3.39Å; A109-S113 WeakPolarHBondContact O-CB 3.49Å; A109-S113 PolarHBondContact O-N 2.87Å; A109-S113 PolarHBondContact O-OG 3.47Å; A109-S113 VanDerWaalsContact O-OG 3.04Å; A109-L164 HydrophobicContact CB-CD2 3.92Å
110	L	98.2	Very high	95.5	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-64	-44.4	177.3	-63.6	176.3	0	0	0	111.9	G106 L107 M108 S113 I114 F147 V150 V151 V157 V161 L164	G106-L110 VanDerWaalsContact O-CG 3.3Å; G106-L110 WeakPolarHBondContact O-CG 3.48Å; G106-L110 PolarHBondContact O-N 2.83Å; L107-L110 PolarHBondContact O-N 3.19Å; M108-L110 VanDerWaalsContact C-N 3.33Å; M108-L110 PolarHBondContact O-N 3.15Å; L110-S113 WeakPolarHBondContact O-CB 3.44Å; L110-S113 PolarHBondContact O-N 3.35Å; L110-I114 WeakPolarHBondContact O-CG1 3.36Å; L110-I114 PolarHBondContact O-N 3.26Å; L110-F147 HydrophobicContact CD2-CD1 3.69Å; L110-F147 HydrophobicContact CD2-CD2 4.08Å; L110-F147 HydrophobicContact CD2-CE1 3.77Å; L110-F147 HydrophobicContact CD2-CE2 4.15Å; L110-F147 HydrophobicContact CD2-CG 3.86Å; L110-F147 HydrophobicContact CD2-CZ 4.01Å; L110-V150 HydrophobicContact CD1-CB 4.26Å; L110-V150 HydrophobicContact CD1-CG1 3.4Å; L110-V151 HydrophobicContact CB-CG2 3.77Å; L110-V157 HydrophobicContact CD1-CG1 4.48Å; L110-V161 HydrophobicContact CD1-CG2 4.38Å; L110-V161 HydrophobicContact CG-CG2 4.45Å; L110-L164 HydrophobicContact CD2-CB 4.32Å; L110-L164 HydrophobicContact CD2-CD2 3.96Å
111	S	98	Very high	95.8	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-61.6	-44.9	176.6	-77.1	0	0	0	0	113.1	Y26 S30 L107 M108 S113 I114 G115	Y26-S111 WeakPolarHBondContact CB-OG 3.34Å; Y26-S111 WeakPolarHBondContact O-CB 3.42Å; Y26-S111 PolarHBondContact O-OG 3.22Å; S30-S111 VanDerWaalsContact CA-O 3.24Å; S30-S111 WeakPolarHBondContact CA-O 3.5Å; S30-S111 WeakPolarHBondContact CB-O 3.43Å; S30-S111 VanDerWaalsContact OG-CA 3.29Å; S30-S111 WeakPolarHBondContact OG-CA 3.46Å; S30-S111 WeakPolarHBondContact OG-CB 3.32Å; S30-S111 PolarHBondContact OG-O 2.84Å; L107-S111 WeakPolarHBondContact O-CB 3.49Å; L107-S111 PolarHBondContact O-N 3.06Å; L107-S111 PolarHBondContact O-OG 3.11Å; M108-S111 PolarHBondContact O-N 3.45Å; S111-S113 VanDerWaalsContact C-N 3.27Å; S111-S113 PolarHBondContact O-N 3.44Å; S111-I114 PolarHBondContact O-N 3.12Å; S111-G115 PolarHBondContact O-N 3.46Å
112	I	98.3	Very high	96.1	Very high	22 Å²	22	21.5 Å²	21.5	11%	0.113	12%	0.116	C	C	.	.	H	α-helix	trans	-59.5	-42.7	175.7	-71.4	166.3	0	0	0	109.8	S33 V80 L83 M108 A109 G115 Y116	S33-I112 WeakPolarHBondContact CB-O 3.36Å; S33-I112 PolarHBondContact OG-O 2.76Å; V80-I112 HydrophobicContact CG1-CB 4.26Å; V80-I112 HydrophobicContact CG1-CG2 3.8Å; L83-I112 HydrophobicContact CD1-CD1 3.83Å; M108-I112 WeakPolarHBondContact O-CB 3.32Å; M108-I112 VanDerWaalsContact O-CG1 3.26Å; M108-I112 WeakPolarHBondContact O-CG1 3.5Å; M108-I112 PolarHBondContact O-N 2.92Å; A109-I112 PolarHBondContact O-N 3.39Å; I112-G115 PolarHBondContact O-N 3.32Å; I112-Y116 PolarHBondContact O-N 2.93Å
113	S	98.5	Very high	96.3	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-64.6	-38.5	177.6	-65.2	0	0	0	0	114.1	H76 A109 L110 S111 G115 Y116 F117 L164	H76-S113 WeakPolarHBondContact NE2-CA 3.3Å; H76-S113 PolarHBondContact NE2-OG 2.91Å; A109-S113 WeakPolarHBondContact O-CB 3.49Å; A109-S113 PolarHBondContact O-N 2.87Å; A109-S113 PolarHBondContact O-OG 3.47Å; A109-S113 VanDerWaalsContact O-OG 3.04Å; L110-S113 WeakPolarHBondContact O-CB 3.44Å; L110-S113 PolarHBondContact O-N 3.35Å; S111-S113 VanDerWaalsContact C-N 3.27Å; S111-S113 PolarHBondContact O-N 3.44Å; S113-G115 VanDerWaalsContact C-N 3.31Å; S113-G115 PolarHBondContact O-N 3.49Å; S113-Y116 PolarHBondContact O-N 3.45Å; S113-F117 WeakPolarHBondContact O-CB 3.37Å; S113-F117 WeakPolarHBondContact O-CD2 3.24Å; S113-F117 WeakPolarHBondContact O-CG 3.34Å; S113-F117 PolarHBondContact O-N 2.92Å; S113-L164 WeakPolarHBondContact OG-CD1 3.41Å; S113-L164 VanDerWaalsContact OG-CD2 3.27Å; S113-L164 WeakPolarHBondContact OG-CD2 3.21Å
114	I	98.4	Very high	96.2	Very high	7 Å²	7	19 Å²	19	4%	0.036	10%	0.101	C	C	.	.	H	α-helix	trans	-56.6	-48.5	173.2	-68.2	165.5	0	0	0	110.2	F27 L110 S111 Y116 F117 L118 F147 V151	F27-I114 HydrophobicContact CE1-CD1 4.49Å; L110-I114 WeakPolarHBondContact O-CG1 3.36Å; L110-I114 PolarHBondContact O-N 3.26Å; S111-I114 PolarHBondContact O-N 3.12Å; I114-Y116 PolarHBondContact O-N 2.89Å; I114-F117 PolarHBondContact O-N 3.42Å; I114-L118 HydrophobicContact CG2-CD1 4.13Å; I114-L118 WeakPolarHBondContact O-CG 3.34Å; I114-L118 PolarHBondContact O-N 2.96Å; I114-L118 VanDerWaalsContact O-N 3.1Å; I114-F147 HydrophobicContact CD1-CB 4.08Å; I114-F147 HydrophobicContact CG1-CB 3.77Å; I114-V151 HydrophobicContact CD1-CB 4.29Å; I114-V151 HydrophobicContact CD1-CG2 3.97Å
115	G	98.1	Very high	96.2	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-61.4	-43.4	178.6	0	0	0	0	0	112.9	S30 F34 S111 I112 S113 C119	S30-G115 VanDerWaalsContact O-CA 3.3Å; S30-G115 WeakPolarHBondContact O-CA 3.33Å; F34-G115 WeakPolarHBondContact CD2-O 3.49Å; S111-G115 PolarHBondContact O-N 3.46Å; I112-G115 PolarHBondContact O-N 3.32Å; S113-G115 VanDerWaalsContact C-N 3.31Å; S113-G115 PolarHBondContact O-N 3.49Å; G115-C119 PolarHBondContact O-N 3.26Å; G115-C119 VanDerWaalsContact O-N 3.17Å
116	Y	98.2	Very high	96.1	Very high	8 Å²	8	23.2 Å²	23.2	3%	0.031	12%	0.123	C	C	.	.	H	α-helix	trans	-63.6	-49.7	176	163.3	-107.6	0	0	0	112.3	V72 S73 H76 I112 S113 I114 L118 C119 D120	V72-Y116 HydrophobicContact CG1-CD2 3.94Å; V72-Y116 HydrophobicContact CG1-CE2 4.09Å; S73-Y116 VanDerWaalsContact CB-OH 3.22Å; S73-Y116 WeakPolarHBondContact CB-OH 3.28Å; S73-Y116 PolarHBondContact OG-OH 3.47Å; S73-Y116 VanDerWaalsContact OG-OH 3.11Å; H76-Y116 HydrophobicContact CB-CD1 4.37Å; H76-Y116 HydrophobicContact CB-CD2 3.95Å; H76-Y116 HydrophobicContact CB-CE2 4.4Å; H76-Y116 HydrophobicContact CB-CG 3.95Å; H76-Y116 WeakPolarHBondContact CD2-CB 3.22Å; H76-Y116 AromaticContact CD2-CD1 3.71Å; H76-Y116 AromaticContact CD2-CG 3.55Å; H76-Y116 AromaticContact CE1-CD1 3.36Å; H76-Y116 WeakPolarHBondContact CE1-CD1 3.33Å; H76-Y116 AromaticContact CE1-CE1 3.87Å; H76-Y116 AromaticContact CG-CD1 3.53Å; H76-Y116 AromaticContact CG-CD2 3.96Å; H76-Y116 AromaticContact CG-CG 3.45Å; H76-Y116 VanDerWaalsContact CG-CG 3.45Å; H76-Y116 AromaticContact ND1-CD1 3.34Å; H76-Y116 VanDerWaalsContact ND1-CD1 3.34Å; H76-Y116 WeakPolarHBondContact ND1-CD1 3.48Å; H76-Y116 AromaticContact ND1-CE1 3.6Å; H76-Y116 AromaticContact ND1-CG 3.79Å; H76-Y116 AromaticContact NE2-CD1 3.6Å; H76-Y116 AromaticContact NE2-CG 3.93Å; I112-Y116 PolarHBondContact O-N 2.93Å; S113-Y116 PolarHBondContact O-N 3.45Å; I114-Y116 PolarHBondContact O-N 2.89Å; Y116-L118 VanDerWaalsContact C-N 3.29Å; Y116-L118 PolarHBondContact O-N 3.25Å; Y116-C119 WeakPolarHBondContact O-CB 3.29Å; Y116-C119 PolarHBondContact O-N 3.36Å; Y116-C119 VanDerWaalsContact O-N 3.09Å; Y116-D120 HydrophobicContact CD2-CB 4.49Å; Y116-D120 HydrophobicContact CE2-CB 3.96Å; Y116-D120 WeakPolarHBondContact O-CB 3.23Å; Y116-D120 PolarHBondContact O-N 3.1Å; Y116-D120 PolarHBondContact OH-OD2 3.06Å
117	F	97.4	Very high	95.8	Very high	4 Å²	4	24.5 Å²	24.5	2%	0.018	13%	0.128	C	C	.	.	H	α-helix	trans	-61.3	-37.3	-178.1	-66	-28.1	0	0	0	112.4	S113 I114 A121 H140 A143 C144 F147	S113-F117 WeakPolarHBondContact O-CB 3.37Å; S113-F117 WeakPolarHBondContact O-CD2 3.24Å; S113-F117 WeakPolarHBondContact O-CG 3.34Å; S113-F117 PolarHBondContact O-N 2.92Å; I114-F117 PolarHBondContact O-N 3.42Å; F117-A121 WeakPolarHBondContact O-CB 3.37Å; F117-A121 PolarHBondContact O-N 3.33Å; F117-H140 HydrophobicContact CB-CB 4.45Å; F117-A143 HydrophobicContact CD2-CB 3.97Å; F117-A143 HydrophobicContact CE2-CB 3.52Å; F117-A143 HydrophobicContact CZ-CB 4.13Å; F117-C144 HydrophobicContact CB-CB 4.34Å; F117-C144 HydrophobicContact CD2-CB 4.43Å; F117-F147 HydrophobicContact CD2-CD2 4.32Å; F117-F147 AromaticContact CE2-CD2 3.65Å; F117-F147 HydrophobicContact CE2-CD2 3.65Å; F117-F147 AromaticContact CE2-CE2 3.45Å; F117-F147 HydrophobicContact CE2-CE2 3.45Å; F117-F147 VanDerWaalsContact CE2-CE2 3.45Å; F117-F147 HydrophobicContact CZ-CE2 4.02Å
118	L	97.2	Very high	95.3	Very high	80 Å²	80	27 Å²	27	42%	0.419	14%	0.137	S	C	.	.	H	α-helix	trans	-64	-46.1	173.4	-71.5	172.4	0	0	0	111.6	F34 I114 Y116 A121 I122	F34-L118 HydrophobicContact CD2-CB 3.86Å; F34-L118 HydrophobicContact CE2-CB 4.03Å; I114-L118 HydrophobicContact CG2-CD1 4.13Å; I114-L118 WeakPolarHBondContact O-CG 3.34Å; I114-L118 PolarHBondContact O-N 2.96Å; I114-L118 VanDerWaalsContact O-N 3.1Å; Y116-L118 VanDerWaalsContact C-N 3.29Å; Y116-L118 PolarHBondContact O-N 3.25Å; L118-A121 PolarHBondContact O-N 3.37Å; L118-I122 VanDerWaalsContact O-CG1 3.31Å; L118-I122 WeakPolarHBondContact O-CG1 3.37Å; L118-I122 PolarHBondContact O-N 3.44Å; L118-I122 VanDerWaalsContact O-N 3.15Å
119	C	96.8	Very high	94.9	Very high	2 Å²	2	32.9 Å²	32.9	1%	0.014	16%	0.162	C	C	.	.	H	α-helix	trans	-59.5	-49.6	176.8	-178.2	0	0	0	0	110.9	F34 C37 G115 Y116 I122 S123	F34-C119 HydrophobicContact CD2-CB 3.87Å; F34-C119 HydrophobicContact CE2-CB 4.06Å; C37-C119 HydrophobicContact CB-CB 3.77Å; G115-C119 PolarHBondContact O-N 3.26Å; G115-C119 VanDerWaalsContact O-N 3.17Å; Y116-C119 WeakPolarHBondContact O-CB 3.29Å; Y116-C119 PolarHBondContact O-N 3.36Å; Y116-C119 VanDerWaalsContact O-N 3.09Å; C119-I122 PolarHBondContact O-N 2.9Å; C119-S123 PolarHBondContact O-N 3.49Å; C119-S123 PolarHBondContact O-OG 3.3Å
120	D	95	Very high	94.5	Very high	13 Å²	13	39.1 Å²	39.1	7%	0.07	20%	0.195	C	C	.	.	H	α-helix	trans	-67.7	-38.8	-176.7	-158.2	35.8	0	0	0	111.2	S69 Y116 I122 S123 M124 Y127 H140	S69-D120 PolarHBondContact OG-OD1 3.45Å; Y116-D120 HydrophobicContact CD2-CB 4.49Å; Y116-D120 HydrophobicContact CE2-CB 3.96Å; Y116-D120 WeakPolarHBondContact O-CB 3.23Å; Y116-D120 PolarHBondContact O-N 3.1Å; Y116-D120 PolarHBondContact OH-OD2 3.06Å; D120-I122 VanDerWaalsContact C-N 3.32Å; D120-I122 PolarHBondContact O-N 3.27Å; D120-S123 PolarHBondContact O-N 2.86Å; D120-S123 VanDerWaalsContact O-N 3.16Å; D120-M124 VanDerWaalsContact O-CG 3.25Å; D120-M124 WeakPolarHBondContact O-CG 3.5Å; D120-M124 PolarHBondContact O-N 3.34Å; D120-Y127 PolarHBondContact OD1-OH 2.84Å; D120-H140 IonicContact OD2-CD2 3.9Å; D120-H140 IonicContact OD2-CE1 2.72Å; D120-H140 IonicContact OD2-NE2 3.99Å; D120-H140 PolarHBondContact OD2-NE2 3.49Å
121	A	94.6	Very high	94.1	Very high	26 Å²	26	46 Å²	46	22%	0.215	22%	0.222	C	C	.	.	H	α-helix	trans	-61.3	-37.6	175.4	0	0	0	0	0	113	F117 L118 M124 P125 H140	F117-A121 WeakPolarHBondContact O-CB 3.37Å; F117-A121 PolarHBondContact O-N 3.33Å; L118-A121 PolarHBondContact O-N 3.37Å; A121-M124 HydrophobicContact CB-CE 4.4Å; A121-P125 WeakPolarHBondContact O-CD 3.3Å; A121-H140 HydrophobicContact CB-CB 4.24Å
122	I	94.7	Very high	93.6	Very high	98 Å²	98	48.9 Å²	48.9	50%	0.503	24%	0.236	S	C	.	.	H	α-helix	trans	-71.9	-35.5	175.8	-67.8	169.4	0	0	0	111.1	F34 L118 C119 D120 P125 F126	F34-I122 HydrophobicContact CE2-CD1 3.96Å; F34-I122 HydrophobicContact CZ-CD1 4.01Å; L118-I122 VanDerWaalsContact O-CG1 3.31Å; L118-I122 WeakPolarHBondContact O-CG1 3.37Å; L118-I122 PolarHBondContact O-N 3.44Å; L118-I122 VanDerWaalsContact O-N 3.15Å; C119-I122 PolarHBondContact O-N 2.9Å; D120-I122 VanDerWaalsContact C-N 3.32Å; D120-I122 PolarHBondContact O-N 3.27Å; I122-P125 WeakPolarHBondContact O-CD 3.3Å; I122-F126 WeakPolarHBondContact O-CE2 3.24Å
123	S	92.4	Very high	93.3	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.007	24%	0.238	C	C	.	.	H	α-helix	trans	-78	-33.2	-178.2	-64.2	0	0	0	0	113.6	C119 D120 P125 F126 Y127	C119-S123 PolarHBondContact O-N 3.49Å; C119-S123 PolarHBondContact O-OG 3.3Å; D120-S123 PolarHBondContact O-N 2.86Å; D120-S123 VanDerWaalsContact O-N 3.16Å; S123-P125 VanDerWaalsContact C-CD 3.47Å; S123-F126 WeakPolarHBondContact O-CB 3.46Å; S123-F126 VanDerWaalsContact O-CD2 3.26Å; S123-F126 WeakPolarHBondContact O-CD2 3.31Å; S123-F126 PolarHBondContact O-N 3.07Å; S123-F126 VanDerWaalsContact O-N 3.12Å; S123-Y127 VanDerWaalsContact C-CE1 3.46Å; S123-Y127 WeakPolarHBondContact O-CD1 3.29Å; S123-Y127 WeakPolarHBondContact O-CE1 3.42Å
124	M	91.3	Very high	93.1	Very high	4 Å²	4	54.1 Å²	54.1	2%	0.02	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-54.4	-41.2	-173.9	-83	-170.4	-74.4	0	0	116.2	D120 A121 F126 Y127 W128 L133 F136 H140	D120-M124 VanDerWaalsContact O-CG 3.25Å; D120-M124 WeakPolarHBondContact O-CG 3.5Å; D120-M124 PolarHBondContact O-N 3.34Å; A121-M124 HydrophobicContact CB-CE 4.4Å; M124-F126 PolarHBondContact O-N 2.87Å; M124-Y127 HydrophobicContact CG-CE2 4.26Å; M124-Y127 WeakPolarHBondContact CG-OH 3.45Å; M124-Y127 PolarHBondContact O-N 3.04Å; M124-Y127 VanDerWaalsContact O-N 3.11Å; M124-W128 PolarHBondContact O-N 2.95Å; M124-L133 HydrophobicContact CB-CD1 3.9Å; M124-F136 HydrophobicContact CE-CB 4.05Å; M124-F136 HydrophobicContact SD-CB 3.45Å; M124-F136 WeakPolarHBondContact SD-CB 3.09Å; M124-F136 HydrophobicContact SD-CG 4.17Å; M124-H140 HydrophobicContact CE-CB 4.42Å; M124-H140 WeakPolarHBondContact CE-CD2 3.28Å
125	P	92.9	Very high	92.8	Very high	67 Å²	67	54.1 Å²	54.1	44%	0.435	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-56.4	-20.1	178.2	-27.5	35.1	0	0	0	115	A121 I122 S123 L133	A121-P125 WeakPolarHBondContact O-CD 3.3Å; I122-P125 WeakPolarHBondContact O-CD 3.3Å; S123-P125 VanDerWaalsContact C-CD 3.47Å; P125-L133 HydrophobicContact CB-CD2 4.42Å; P125-L133 HydrophobicContact CG-CD1 4.17Å
126	F	91	Very high	92.5	Very high	127 Å²	127	56.6 Å²	56.6	56%	0.557	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-81	-17.1	-179.4	-62.1	-76.3	0	0	0	114.1	M65 I122 S123 M124	M65-F126 HydrophobicContact CE-CB 3.26Å; M65-F126 HydrophobicContact CE-CD1 4.35Å; M65-F126 HydrophobicContact CE-CD2 3.8Å; M65-F126 HydrophobicContact CE-CG 3.56Å; M65-F126 HydrophobicContact SD-CB 3.66Å; M65-F126 HydrophobicContact SD-CG 4.32Å; I122-F126 WeakPolarHBondContact O-CE2 3.24Å; S123-F126 WeakPolarHBondContact O-CB 3.46Å; S123-F126 VanDerWaalsContact O-CD2 3.26Å; S123-F126 WeakPolarHBondContact O-CD2 3.31Å; S123-F126 PolarHBondContact O-N 3.07Å; S123-F126 VanDerWaalsContact O-N 3.12Å; M124-F126 PolarHBondContact O-N 2.87Å
127	Y	89.5	Confident	92.3	Very high	28 Å²	28	59.1 Å²	59.1	11%	0.11	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132.9	-19.5	-178.9	53.1	-87.4	0	0	0	114.8	S62 M65 E66 S69 D120 S123 M124	S62-Y127 WeakPolarHBondContact O-CB 3.11Å; M65-Y127 HydrophobicContact CB-CD1 3.9Å; E66-Y127 HydrophobicContact CB-CD2 3.73Å; E66-Y127 HydrophobicContact CB-CE2 4.27Å; E66-Y127 HydrophobicContact CB-CG 4.07Å; E66-Y127 HydrophobicContact CG-CD2 3.85Å; E66-Y127 HydrophobicContact CG-CE2 4.1Å; S69-Y127 VanDerWaalsContact CB-OH 3.28Å; S69-Y127 WeakPolarHBondContact CB-OH 3.4Å; S69-Y127 PolarHBondContact OG-OH 3.24Å; D120-Y127 PolarHBondContact OD1-OH 2.84Å; S123-Y127 VanDerWaalsContact C-CE1 3.46Å; S123-Y127 WeakPolarHBondContact O-CD1 3.29Å; S123-Y127 WeakPolarHBondContact O-CE1 3.42Å; M124-Y127 HydrophobicContact CG-CE2 4.26Å; M124-Y127 WeakPolarHBondContact CG-OH 3.45Å; M124-Y127 PolarHBondContact O-N 3.04Å; M124-Y127 VanDerWaalsContact O-N 3.11Å
128	W	86.3	Confident	92.1	Very high	51 Å²	51	63 Å²	63	19%	0.193	31%	0.308	C	S	.	.			trans	-100.2	148.2	171.7	-71.4	107.5	0	0	0	112.1	M124 Q132 L133	M124-W128 PolarHBondContact O-N 2.95Å; W128-Q132 HydrophobicContact CE3-CB 3.83Å; W128-Q132 HydrophobicContact CE3-CG 4.45Å; W128-Q132 HydrophobicContact CZ3-CB 4.2Å; W128-Q132 HydrophobicContact CZ3-CG 4.37Å; W128-L133 HydrophobicContact CB-CB 4.08Å; W128-L133 HydrophobicContact CB-CD1 4.06Å
129	K	87.7	Confident	92	Very high	153 Å²	153	60 Å²	60	67%	0.665	29%	0.292	S	S	*	.			trans	-133.8	161.8	176.7	-63	-171.1	179.1	-176	0	111.5
130	N	90.6	Very high	92	Very high	130 Å²	130	60.4 Å²	60.4	70%	0.695	29%	0.293	S	S	*	.	H	α-helix	trans	59.2	-144.9	169.9	-51.3	-30.2	0	0	0	113.1	Q132 L133 I134	N130-Q132 VanDerWaalsContact C-N 3.25Å; N130-Q132 PolarHBondContact O-N 3.31Å; N130-L133 WeakPolarHBondContact O-CB 3.13Å; N130-L133 PolarHBondContact O-N 2.97Å; N130-L133 VanDerWaalsContact O-N 3.13Å; N130-I134 PolarHBondContact O-N 2.9Å
131	Y	89.8	Confident	92	Very high	144 Å²	144	62.9 Å²	62.9	57%	0.565	31%	0.311	S	S	*	.	H	α-helix	trans	-53.7	-36.4	-176	-179	-112.9	0	0	0	114.2	I134 I135	Y131-I134 PolarHBondContact O-N 2.88Å; Y131-I135 HydrophobicContact CD1-CD1 3.57Å; Y131-I135 HydrophobicContact CD1-CG1 4.48Å; Y131-I135 HydrophobicContact CD2-CD1 4.44Å; Y131-I135 HydrophobicContact CE1-CD1 3.09Å; Y131-I135 HydrophobicContact CE1-CG1 4.1Å; Y131-I135 HydrophobicContact CE2-CD1 4.04Å; Y131-I135 HydrophobicContact CE2-CG1 4.18Å; Y131-I135 HydrophobicContact CG-CD1 4.22Å; Y131-I135 WeakPolarHBondContact O-CG1 3.33Å; Y131-I135 PolarHBondContact O-N 3.33Å; Y131-I135 VanDerWaalsContact O-N 3.11Å
132	Q	88.1	Confident	92.1	Very high	62 Å²	62	62.1 Å²	62.1	29%	0.29	31%	0.305	S	S	.	.	H	α-helix	trans	-64.8	-43.3	179.4	-65.3	-61.4	-30.1	0	0	111.7	W128 N130 I134 I135 F136	W128-Q132 HydrophobicContact CE3-CB 3.83Å; W128-Q132 HydrophobicContact CE3-CG 4.45Å; W128-Q132 HydrophobicContact CZ3-CB 4.2Å; W128-Q132 HydrophobicContact CZ3-CG 4.37Å; N130-Q132 VanDerWaalsContact C-N 3.25Å; N130-Q132 PolarHBondContact O-N 3.31Å; Q132-I134 VanDerWaalsContact C-N 3.3Å; Q132-I134 PolarHBondContact O-N 2.8Å; Q132-I135 PolarHBondContact O-N 2.86Å; Q132-F136 VanDerWaalsContact O-CD2 3.23Å; Q132-F136 WeakPolarHBondContact O-CD2 3.38Å; Q132-F136 PolarHBondContact O-N 3.01Å; Q132-F136 VanDerWaalsContact O-N 3.07Å
133	L	91.5	Very high	92.2	Very high	31 Å²	31	57.6 Å²	57.6	16%	0.162	28%	0.282	C	S	.	.	H	α-helix	trans	-58.4	-44.9	177.2	178	63.2	0	0	0	111	M124 P125 W128 N130 F136 I137	M124-L133 HydrophobicContact CB-CD1 3.9Å; P125-L133 HydrophobicContact CB-CD2 4.42Å; P125-L133 HydrophobicContact CG-CD1 4.17Å; W128-L133 HydrophobicContact CB-CB 4.08Å; W128-L133 HydrophobicContact CB-CD1 4.06Å; N130-L133 WeakPolarHBondContact O-CB 3.13Å; N130-L133 PolarHBondContact O-N 2.97Å; N130-L133 VanDerWaalsContact O-N 3.13Å; L133-F136 PolarHBondContact O-N 3.15Å; L133-I137 HydrophobicContact CD1-CD1 3.71Å; L133-I137 HydrophobicContact CD1-CG1 4.05Å; L133-I137 HydrophobicContact CD2-CD1 4.41Å; L133-I137 HydrophobicContact CG-CD1 3.73Å; L133-I137 HydrophobicContact CG-CG1 4.39Å; L133-I137 WeakPolarHBondContact O-CB 3.24Å; L133-I137 VanDerWaalsContact O-CG1 3.29Å; L133-I137 WeakPolarHBondContact O-CG1 3.22Å; L133-I137 PolarHBondContact O-N 3.38Å
134	I	93.4	Very high	92.4	Very high	100 Å²	100	58.5 Å²	58.5	51%	0.513	29%	0.289	S	S	.	.	H	α-helix	trans	-61.4	-48.2	-179.8	-61.9	172	0	0	0	110.7	N130 Y131 Q132 F136 I137 L138	N130-I134 PolarHBondContact O-N 2.9Å; Y131-I134 PolarHBondContact O-N 2.88Å; Q132-I134 VanDerWaalsContact C-N 3.3Å; Q132-I134 PolarHBondContact O-N 2.8Å; I134-F136 VanDerWaalsContact C-N 3.35Å; I134-F136 PolarHBondContact O-N 3.41Å; I134-I137 PolarHBondContact O-N 2.95Å; I134-L138 HydrophobicContact CG2-CD1 4.03Å; I134-L138 HydrophobicContact CG2-CG 4.44Å; I134-L138 WeakPolarHBondContact O-CB 3.26Å; I134-L138 WeakPolarHBondContact O-CG 3.43Å; I134-L138 PolarHBondContact O-N 2.9Å
135	I	92.7	Very high	92.7	Very high	7 Å²	7	62.3 Å²	62.3	4%	0.036	31%	0.308	C	S	.	.	H	α-helix	trans	-57.9	-48	178.8	-69.5	164.7	0	0	0	111.3	Y131 Q132 L138 H139 L250 W254	Y131-I135 HydrophobicContact CD1-CD1 3.57Å; Y131-I135 HydrophobicContact CD1-CG1 4.48Å; Y131-I135 HydrophobicContact CD2-CD1 4.44Å; Y131-I135 HydrophobicContact CE1-CD1 3.09Å; Y131-I135 HydrophobicContact CE1-CG1 4.1Å; Y131-I135 HydrophobicContact CE2-CD1 4.04Å; Y131-I135 HydrophobicContact CE2-CG1 4.18Å; Y131-I135 HydrophobicContact CG-CD1 4.22Å; Y131-I135 WeakPolarHBondContact O-CG1 3.33Å; Y131-I135 PolarHBondContact O-N 3.33Å; Y131-I135 VanDerWaalsContact O-N 3.11Å; Q132-I135 PolarHBondContact O-N 2.86Å; I135-L138 PolarHBondContact O-N 3.29Å; I135-H139 WeakPolarHBondContact O-CB 3.39Å; I135-H139 PolarHBondContact O-N 3.44Å; I135-L250 HydrophobicContact CG2-CD1 4.25Å; I135-L250 HydrophobicContact CG2-CD2 3.66Å; I135-W254 HydrophobicContact CG2-CZ2 3.68Å
136	F	91.2	Very high	92.8	Very high	53 Å²	53	59.8 Å²	59.8	23%	0.232	29%	0.293	C	S	.	.	H	α-helix	trans	-71.2	-33.8	-176.6	-78.7	-72.3	0	0	0	112.6	M124 Q132 L133 I134 H139 H140 W254	M124-F136 HydrophobicContact CE-CB 4.05Å; M124-F136 HydrophobicContact SD-CB 3.45Å; M124-F136 WeakPolarHBondContact SD-CB 3.09Å; M124-F136 HydrophobicContact SD-CG 4.17Å; Q132-F136 VanDerWaalsContact O-CD2 3.23Å; Q132-F136 WeakPolarHBondContact O-CD2 3.38Å; Q132-F136 PolarHBondContact O-N 3.01Å; Q132-F136 VanDerWaalsContact O-N 3.07Å; L133-F136 PolarHBondContact O-N 3.15Å; I134-F136 VanDerWaalsContact C-N 3.35Å; I134-F136 PolarHBondContact O-N 3.41Å; F136-H139 WeakPolarHBondContact O-CB 3.36Å; F136-H139 PolarHBondContact O-N 3.47Å; F136-H140 PolarHBondContact O-N 3.17Å; F136-W254 HydrophobicContact CD1-CZ2 4.43Å; F136-W254 HydrophobicContact CE1-CH2 4.2Å; F136-W254 AromaticContact CE1-CZ2 3.99Å; F136-W254 HydrophobicContact CE1-CZ2 3.99Å; F136-W254 HydrophobicContact CZ-CZ2 4.21Å
137	I	93.9	Very high	93.1	Very high	60 Å²	60	54.2 Å²	54.2	31%	0.308	27%	0.269	S	S	.	.	H	α-helix	trans	-62.7	-44.1	170.8	-71.5	173.9	0	0	0	110.4	L133 I134 H140 S141	L133-I137 HydrophobicContact CD1-CD1 3.71Å; L133-I137 HydrophobicContact CD1-CG1 4.05Å; L133-I137 HydrophobicContact CD2-CD1 4.41Å; L133-I137 HydrophobicContact CG-CD1 3.73Å; L133-I137 HydrophobicContact CG-CG1 4.39Å; L133-I137 WeakPolarHBondContact O-CB 3.24Å; L133-I137 VanDerWaalsContact O-CG1 3.29Å; L133-I137 WeakPolarHBondContact O-CG1 3.22Å; L133-I137 PolarHBondContact O-N 3.38Å; I134-I137 PolarHBondContact O-N 2.95Å; I137-H140 PolarHBondContact O-N 2.93Å; I137-S141 WeakPolarHBondContact O-CB 3.47Å; I137-S141 PolarHBondContact O-N 2.81Å; I137-S141 PolarHBondContact O-OG 3.24Å
138	L	94.2	Very high	93.4	Very high	87 Å²	87	57 Å²	57	46%	0.455	28%	0.282	S	S	.	.	H	α-helix	trans	-62.1	-43	176.5	-72.6	173.3	0	0	0	111.7	I134 I135 S141 A142	I134-L138 HydrophobicContact CG2-CD1 4.03Å; I134-L138 HydrophobicContact CG2-CG 4.44Å; I134-L138 WeakPolarHBondContact O-CB 3.26Å; I134-L138 WeakPolarHBondContact O-CG 3.43Å; I134-L138 PolarHBondContact O-N 2.9Å; I135-L138 PolarHBondContact O-N 3.29Å; L138-S141 PolarHBondContact O-N 2.72Å; L138-A142 VanDerWaalsContact O-CB 3.28Å; L138-A142 WeakPolarHBondContact O-CB 3.46Å; L138-A142 PolarHBondContact O-N 2.83Å
139	H	94.7	Very high	93.8	Very high	17 Å²	17	56.6 Å²	56.6	8%	0.079	28%	0.28	C	S	.	.	H	α-helix	trans	-56.7	-53.8	175.1	176.9	68.7	0	0	0	111.8	I135 F136 S141 A142 A143 L247 L250 W254	I135-H139 WeakPolarHBondContact O-CB 3.39Å; I135-H139 PolarHBondContact O-N 3.44Å; F136-H139 WeakPolarHBondContact O-CB 3.36Å; F136-H139 PolarHBondContact O-N 3.47Å; H139-S141 PolarHBondContact O-N 3.42Å; H139-A142 PolarHBondContact O-N 3.45Å; H139-A143 WeakPolarHBondContact O-CB 3.24Å; H139-A143 PolarHBondContact O-N 3.35Å; H139-L247 WeakPolarHBondContact ND1-CD2 3.36Å; H139-L250 HydrophobicContact CB-CD1 3.9Å; H139-W254 HydrophobicContact CB-CH2 4.36Å
140	H	95.8	Very high	94.1	Very high	10 Å²	10	50.1 Å²	50.1	5%	0.046	25%	0.254	C	S	.	.	H	α-helix	trans	-66.1	-38.7	-179.6	-76.8	14.4	0	0	0	112	F117 D120 A121 M124 F136 I137 C144	F117-H140 HydrophobicContact CB-CB 4.45Å; D120-H140 IonicContact OD2-CD2 3.9Å; D120-H140 IonicContact OD2-CE1 2.72Å; D120-H140 IonicContact OD2-NE2 3.99Å; D120-H140 PolarHBondContact OD2-NE2 3.49Å; A121-H140 HydrophobicContact CB-CB 4.24Å; M124-H140 HydrophobicContact CE-CB 4.42Å; M124-H140 WeakPolarHBondContact CE-CD2 3.28Å; F136-H140 PolarHBondContact O-N 3.17Å; I137-H140 PolarHBondContact O-N 2.93Å; H140-C144 WeakPolarHBondContact O-CB 3.34Å; H140-C144 PolarHBondContact O-N 2.72Å
141	S	96	Very high	94.3	Very high	64 Å²	64	44 Å²	44	45%	0.448	22%	0.221	S	C	.	.	H	α-helix	trans	-64.9	-45.9	178.5	-58.9	0	0	0	0	111.3	I137 L138 H139 L145	I137-S141 WeakPolarHBondContact O-CB 3.47Å; I137-S141 PolarHBondContact O-N 2.81Å; I137-S141 PolarHBondContact O-OG 3.24Å; L138-S141 PolarHBondContact O-N 2.72Å; H139-S141 PolarHBondContact O-N 3.42Å; S141-L145 WeakPolarHBondContact O-CB 3.35Å; S141-L145 PolarHBondContact O-N 3.35Å
142	A	96.4	Very high	94.3	Very high	10 Å²	10	41.1 Å²	41.1	8%	0.083	21%	0.209	C	C	.	.	H	α-helix	trans	-64.5	-45.8	177.9	0	0	0	0	0	111.9	L138 H139 A146 L246 L247	L138-A142 VanDerWaalsContact O-CB 3.28Å; L138-A142 WeakPolarHBondContact O-CB 3.46Å; L138-A142 PolarHBondContact O-N 2.83Å; H139-A142 PolarHBondContact O-N 3.45Å; A142-A146 WeakPolarHBondContact O-CB 3.34Å; A142-A146 PolarHBondContact O-N 3.42Å; A142-L246 HydrophobicContact CB-CD2 3.84Å; A142-L247 HydrophobicContact CB-CD2 4.47Å; A142-L247 HydrophobicContact CB-CG 4.39Å
143	A	96.9	Very high	94.4	Very high	4 Å²	4	40.7 Å²	40.7	3%	0.033	21%	0.205	C	C	.	.	H	α-helix	trans	-65.5	-45	178.3	0	0	0	0	0	111.8	F117 H139 A146 F147 L247	F117-A143 HydrophobicContact CD2-CB 3.97Å; F117-A143 HydrophobicContact CE2-CB 3.52Å; F117-A143 HydrophobicContact CZ-CB 4.13Å; H139-A143 WeakPolarHBondContact O-CB 3.24Å; H139-A143 PolarHBondContact O-N 3.35Å; A143-A146 PolarHBondContact O-N 3.41Å; A143-F147 WeakPolarHBondContact O-CB 3.45Å; A143-F147 VanDerWaalsContact O-CG 3.25Å; A143-F147 WeakPolarHBondContact O-CG 3.06Å; A143-F147 PolarHBondContact O-N 2.94Å; A143-L247 HydrophobicContact CB-CD1 4.38Å
144	C	96.8	Very high	94.4	Very high	20 Å²	20	40.3 Å²	40.3	14%	0.135	20%	0.201	C	C	.	.	H	α-helix	trans	-62.6	-43.8	177.5	-173.3	0	0	0	0	111.6	F117 H140 F148	F117-C144 HydrophobicContact CB-CB 4.34Å; F117-C144 HydrophobicContact CD2-CB 4.43Å; H140-C144 WeakPolarHBondContact O-CB 3.34Å; H140-C144 PolarHBondContact O-N 2.72Å; C144-F148 WeakPolarHBondContact O-CB 3.37Å; C144-F148 PolarHBondContact O-N 3.36Å
145	L	96.6	Very high	94.2	Very high	83 Å²	83	35.7 Å²	35.7	44%	0.435	18%	0.178	S	C	.	.	H	α-helix	trans	-62.7	-47.6	177	-177.2	66	0	0	0	111.3	S141 F147 F148 Y149 V239	S141-L145 WeakPolarHBondContact O-CB 3.35Å; S141-L145 PolarHBondContact O-N 3.35Å; L145-F147 PolarHBondContact O-N 3.37Å; L145-F148 PolarHBondContact O-N 2.82Å; L145-Y149 HydrophobicContact CD1-CD2 4.07Å; L145-Y149 HydrophobicContact CD1-CE2 3.75Å; L145-Y149 HydrophobicContact CG-CD2 4.43Å; L145-Y149 HydrophobicContact CG-CE2 4.4Å; L145-Y149 WeakPolarHBondContact O-CD2 3.33Å; L145-Y149 PolarHBondContact O-N 3.27Å; L145-Y149 VanDerWaalsContact O-N 3.14Å; L145-V239 HydrophobicContact CD2-CG1 4.38Å; L145-V239 HydrophobicContact CG-CG1 4.15Å
146	A	96.5	Very high	94.2	Very high	14 Å²	14	35.5 Å²	35.5	12%	0.116	18%	0.177	C	C	.	.	H	α-helix	trans	-58.5	-49.8	178.4	0	0	0	0	0	111.6	A142 A143 F148 Y149 V150 S243	A142-A146 WeakPolarHBondContact O-CB 3.34Å; A142-A146 PolarHBondContact O-N 3.42Å; A143-A146 PolarHBondContact O-N 3.41Å; A146-F148 PolarHBondContact O-N 2.93Å; A146-Y149 PolarHBondContact O-N 2.93Å; A146-V150 WeakPolarHBondContact O-CG2 3.47Å; A146-V150 PolarHBondContact O-N 3.19Å; A146-V150 VanDerWaalsContact O-N 3.11Å; A146-S243 WeakPolarHBondContact CB-OG 3.42Å
147	F	97.3	Very high	94.4	Very high	10 Å²	10	33 Å²	33	4%	0.044	17%	0.166	C	C	.	.	H	α-helix	trans	-68.5	-35.2	-179	-64.4	-12.1	0	0	0	112.4	L110 I114 F117 A143 L145 Y149 V150 V151 L164	L110-F147 HydrophobicContact CD2-CD1 3.69Å; L110-F147 HydrophobicContact CD2-CD2 4.08Å; L110-F147 HydrophobicContact CD2-CE1 3.77Å; L110-F147 HydrophobicContact CD2-CE2 4.15Å; L110-F147 HydrophobicContact CD2-CG 3.86Å; L110-F147 HydrophobicContact CD2-CZ 4.01Å; I114-F147 HydrophobicContact CD1-CB 4.08Å; I114-F147 HydrophobicContact CG1-CB 3.77Å; F117-F147 HydrophobicContact CD2-CD2 4.32Å; F117-F147 AromaticContact CE2-CD2 3.65Å; F117-F147 HydrophobicContact CE2-CD2 3.65Å; F117-F147 AromaticContact CE2-CE2 3.45Å; F117-F147 HydrophobicContact CE2-CE2 3.45Å; F117-F147 VanDerWaalsContact CE2-CE2 3.45Å; F117-F147 HydrophobicContact CZ-CE2 4.02Å; A143-F147 WeakPolarHBondContact O-CB 3.45Å; A143-F147 VanDerWaalsContact O-CG 3.25Å; A143-F147 WeakPolarHBondContact O-CG 3.06Å; A143-F147 PolarHBondContact O-N 2.94Å; L145-F147 PolarHBondContact O-N 3.37Å; F147-Y149 VanDerWaalsContact C-N 3.32Å; F147-Y149 PolarHBondContact O-N 3.45Å; F147-V150 PolarHBondContact O-N 2.96Å; F147-V151 WeakPolarHBondContact O-CB 3.43Å; F147-V151 WeakPolarHBondContact O-CG2 3.38Å; F147-V151 PolarHBondContact O-N 3.5Å; F147-L164 HydrophobicContact CE2-CB 4.45Å; F147-L164 HydrophobicContact CE2-CD1 3.93Å; F147-L164 HydrophobicContact CZ-CB 4Å; F147-L164 HydrophobicContact CZ-CD1 4.22Å
148	F	96	Very high	94.5	Very high	88 Å²	88	30.1 Å²	30.1	39%	0.386	15%	0.151	S	C	.	.	H	α-helix	trans	-56.6	-46.5	172.8	174.3	-92.6	0	0	0	111.3	F27 C144 L145 A146 V151 R152	F27-F148 AromaticContact CE1-CD2 3.6Å; F27-F148 HydrophobicContact CE1-CD2 3.6Å; F27-F148 AromaticContact CE1-CE2 3.76Å; F27-F148 HydrophobicContact CE1-CE2 3.76Å; F27-F148 AromaticContact CZ-CD2 3.77Å; F27-F148 HydrophobicContact CZ-CD2 3.77Å; F27-F148 AromaticContact CZ-CE2 3.63Å; F27-F148 HydrophobicContact CZ-CE2 3.63Å; F27-F148 HydrophobicContact CZ-CZ 4.39Å; C144-F148 WeakPolarHBondContact O-CB 3.37Å; C144-F148 PolarHBondContact O-N 3.36Å; L145-F148 PolarHBondContact O-N 2.82Å; A146-F148 PolarHBondContact O-N 2.93Å; F148-V151 PolarHBondContact O-N 3.41Å; F148-R152 HydrophobicContact CE1-CB 4.39Å; F148-R152 WeakPolarHBondContact O-CB 3.42Å; F148-R152 PolarHBondContact O-N 2.65Å
149	Y	93.5	Very high	94.6	Very high	42 Å²	42	26.3 Å²	26.3	17%	0.165	13%	0.131	C	C	.	.	H	α-helix	trans	-63.2	-46.5	177.2	-90	-104.4	0	0	0	111.9	L145 A146 F147 V151 R152 Y153 L235 V239	L145-Y149 HydrophobicContact CD1-CD2 4.07Å; L145-Y149 HydrophobicContact CD1-CE2 3.75Å; L145-Y149 HydrophobicContact CG-CD2 4.43Å; L145-Y149 HydrophobicContact CG-CE2 4.4Å; L145-Y149 WeakPolarHBondContact O-CD2 3.33Å; L145-Y149 PolarHBondContact O-N 3.27Å; L145-Y149 VanDerWaalsContact O-N 3.14Å; A146-Y149 PolarHBondContact O-N 2.93Å; F147-Y149 VanDerWaalsContact C-N 3.32Å; F147-Y149 PolarHBondContact O-N 3.45Å; Y149-V151 PolarHBondContact O-N 3.02Å; Y149-R152 PolarHBondContact O-N 3.38Å; Y149-Y153 AromaticContact CD1-CD2 3.94Å; Y149-Y153 HydrophobicContact CD1-CD2 3.94Å; Y149-Y153 AromaticContact CD1-CE2 3.53Å; Y149-Y153 HydrophobicContact CD1-CE2 3.53Å; Y149-Y153 AromaticContact CE1-CE2 3.84Å; Y149-Y153 HydrophobicContact CE1-CE2 3.84Å; Y149-Y153 HydrophobicContact CG-CE2 4.32Å; Y149-Y153 VanDerWaalsContact O-CD2 3.3Å; Y149-Y153 WeakPolarHBondContact O-CD2 3.26Å; Y149-Y153 PolarHBondContact O-N 2.58Å; Y149-L235 HydrophobicContact CE1-CB 4Å; Y149-V239 HydrophobicContact CD2-CG1 3.99Å; Y149-V239 HydrophobicContact CD2-CG2 4.43Å; Y149-V239 HydrophobicContact CE1-CG2 4.22Å; Y149-V239 HydrophobicContact CE2-CG1 4.39Å; Y149-V239 HydrophobicContact CE2-CG2 4.06Å; Y149-V239 HydrophobicContact CG-CG1 4.14Å
150	V	94.1	Very high	94.7	Very high	17 Å²	17	25.7 Å²	25.7	10%	0.103	13%	0.129	C	C	.	.	H	α-helix	trans	-58	-47	177.9	171.4	0	0	0	0	111.2	L110 A146 F147 R154 T155 C156 V157	L110-V150 HydrophobicContact CD1-CB 4.26Å; L110-V150 HydrophobicContact CD1-CG1 3.4Å; A146-V150 WeakPolarHBondContact O-CG2 3.47Å; A146-V150 PolarHBondContact O-N 3.19Å; A146-V150 VanDerWaalsContact O-N 3.11Å; F147-V150 PolarHBondContact O-N 2.96Å; V150-R154 WeakPolarHBondContact O-CA 3.47Å; V150-R154 PolarHBondContact O-N 3.48Å; V150-T155 WeakPolarHBondContact CG1-O 3.32Å; V150-C156 HydrophobicContact CG2-CB 4.4Å; V150-V157 HydrophobicContact CG1-CB 4.48Å; V150-V157 HydrophobicContact CG1-CG2 4.13Å
151	V	94	Very high	94.8	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-69.7	-42	179.4	173.2	0	0	0	0	111.7	F27 L107 L110 I114 F147 F148 Y149 Y153	F27-V151 HydrophobicContact CD1-CG1 4.35Å; F27-V151 HydrophobicContact CE1-CB 4.46Å; F27-V151 HydrophobicContact CE1-CG1 3.99Å; F27-V151 HydrophobicContact CE2-CG1 4.29Å; F27-V151 HydrophobicContact CZ-CB 4.38Å; F27-V151 HydrophobicContact CZ-CG1 3.95Å; L107-V151 HydrophobicContact CD2-CG2 4.35Å; L110-V151 HydrophobicContact CB-CG2 3.77Å; I114-V151 HydrophobicContact CD1-CB 4.29Å; I114-V151 HydrophobicContact CD1-CG2 3.97Å; F147-V151 WeakPolarHBondContact O-CB 3.43Å; F147-V151 WeakPolarHBondContact O-CG2 3.38Å; F147-V151 PolarHBondContact O-N 3.5Å; F148-V151 PolarHBondContact O-N 3.41Å; Y149-V151 PolarHBondContact O-N 3.02Å; V151-Y153 PolarHBondContact O-N 3.33Å
152	R	91.8	Very high	94.9	Very high	85 Å²	85	23 Å²	23	32%	0.321	11%	0.109	S	C	.	.	H	α-helix	trans	-62.4	-42	-177	177.5	57.5	-174.1	78.9	0.3	112.4	F27 F148 Y149	F27-R152 HydrophobicContact CE2-CB 4.24Å; F27-R152 HydrophobicContact CZ-CB 3.97Å; F148-R152 HydrophobicContact CE1-CB 4.39Å; F148-R152 WeakPolarHBondContact O-CB 3.42Å; F148-R152 PolarHBondContact O-N 2.65Å; Y149-R152 PolarHBondContact O-N 3.38Å
153	Y	89	Confident	94.9	Very high	52 Å²	52	23.4 Å²	23.4	20%	0.204	11%	0.108	C	C	.	.	H	α-helix	trans	-102.2	-9.2	-175.5	-63.4	-69.7	0	0	0	113.2	L7 Y149 V151 T155 I233	L7-Y153 HydrophobicContact CD1-CD1 4.41Å; L7-Y153 HydrophobicContact CD1-CE1 4.22Å; Y149-Y153 AromaticContact CD1-CD2 3.94Å; Y149-Y153 HydrophobicContact CD1-CD2 3.94Å; Y149-Y153 AromaticContact CD1-CE2 3.53Å; Y149-Y153 HydrophobicContact CD1-CE2 3.53Å; Y149-Y153 AromaticContact CE1-CE2 3.84Å; Y149-Y153 HydrophobicContact CE1-CE2 3.84Å; Y149-Y153 HydrophobicContact CG-CE2 4.32Å; Y149-Y153 VanDerWaalsContact O-CD2 3.3Å; Y149-Y153 WeakPolarHBondContact O-CD2 3.26Å; Y149-Y153 PolarHBondContact O-N 2.58Å; V151-Y153 PolarHBondContact O-N 3.33Å; Y153-T155 PolarHBondContact O-N 2.93Å; Y153-I233 HydrophobicContact CD1-CD1 3.56Å; Y153-I233 HydrophobicContact CD1-CG1 3.91Å; Y153-I233 HydrophobicContact CD1-CG2 4.5Å; Y153-I233 HydrophobicContact CD2-CD1 4.16Å; Y153-I233 HydrophobicContact CD2-CG2 3.98Å; Y153-I233 HydrophobicContact CE1-CD1 4.26Å; Y153-I233 HydrophobicContact CE1-CG1 4.11Å; Y153-I233 HydrophobicContact CE1-CG2 4.31Å; Y153-I233 HydrophobicContact CE2-CG2 3.77Å; Y153-I233 HydrophobicContact CG-CD1 3.51Å; Y153-I233 HydrophobicContact CG-CG1 4.21Å; Y153-I233 HydrophobicContact CG-CG2 4.35Å
154	R	90.7	Very high	94.9	Very high	24 Å²	24	23.3 Å²	23.3	9%	0.091	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.3	34.6	-178.4	-58.6	-168.7	-61	-81.3	4.8	113.3	L17 V102 L107 V150	L17-R154 HydrophobicContact CD2-CB 3.85Å; L17-R154 WeakPolarHBondContact CD2-O 3.39Å; L17-R154 PolarHBondContact O-NE 2.92Å; L17-R154 PolarHBondContact O-NH2 3.39Å; V102-R154 HydrophobicContact CG2-CB 4.47Å; V102-R154 VanDerWaalsContact CG2-O 3.24Å; V102-R154 WeakPolarHBondContact CG2-O 3.4Å; L107-R154 HydrophobicContact CD1-CG 4.22Å; V150-R154 WeakPolarHBondContact O-CA 3.47Å; V150-R154 PolarHBondContact O-N 3.48Å
155	T	89.7	Confident	94.9	Very high	2 Å²	2	22.7 Å²	22.7	1%	0.012	10%	0.103	C	C	.	.			trans	-123.1	158.4	178.9	173.5	0	0	0	0	109.2	A99 V150 Y153 V157 C229 I233 I236	A99-T155 PolarHBondContact O-OG1 3.49Å; V150-T155 WeakPolarHBondContact CG1-O 3.32Å; Y153-T155 PolarHBondContact O-N 2.93Å; T155-V157 PolarHBondContact O-N 3.47Å; T155-C229 PolarHBondContact OG1-SG 3.44Å; T155-I233 HydrophobicContact CG2-CD1 4.09Å; T155-I236 HydrophobicContact CG2-CD1 3.53Å
156	C	93.1	Very high	94.9	Very high	4 Å²	4	19.5 Å²	19.5	3%	0.027	9%	0.087	C	C	.	.			trans	59	29.8	-179.5	-63.5	0	0	0	0	113.1	A99 V150 F158 F159 G160	A99-C156 PolarHBondContact O-N 3.07Å; V150-C156 HydrophobicContact CG2-CB 4.4Å; C156-F158 VanDerWaalsContact C-N 3.28Å; C156-F158 PolarHBondContact O-N 3.21Å; C156-F159 HydrophobicContact CB-CD2 3.84Å; C156-F159 PolarHBondContact O-N 3.1Å; C156-F159 VanDerWaalsContact O-N 3.12Å; C156-G160 PolarHBondContact O-N 3Å; C156-G160 VanDerWaalsContact O-N 3.14Å
157	V	94.8	Very high	94.9	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-61.7	-38.9	-178.5	-178.2	0	0	0	0	110.7	L94 V102 T103 L107 L110 V150 T155 F159 G160 V161	L94-V157 HydrophobicContact CD2-CB 4.43Å; L94-V157 HydrophobicContact CD2-CG1 4.45Å; V102-V157 HydrophobicContact CG2-CG2 4.23Å; T103-V157 HydrophobicContact CG2-CG1 4Å; L107-V157 HydrophobicContact CD2-CG1 4.35Å; L107-V157 HydrophobicContact CD2-CG2 3.74Å; L107-V157 HydrophobicContact CG-CG1 4.3Å; L107-V157 HydrophobicContact CG-CG2 4.16Å; L110-V157 HydrophobicContact CD1-CG1 4.48Å; V150-V157 HydrophobicContact CG1-CB 4.48Å; V150-V157 HydrophobicContact CG1-CG2 4.13Å; T155-V157 PolarHBondContact O-N 3.47Å; V157-F159 VanDerWaalsContact C-N 3.31Å; V157-F159 PolarHBondContact O-N 3.41Å; V157-G160 PolarHBondContact O-N 3.21Å; V157-V161 HydrophobicContact CG1-CG2 3.88Å; V157-V161 WeakPolarHBondContact O-CB 3.44Å; V157-V161 VanDerWaalsContact O-CG2 3.28Å; V157-V161 WeakPolarHBondContact O-CG2 3.38Å; V157-V161 PolarHBondContact O-N 3.21Å
158	F	96.3	Very high	94.8	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-49.9	-52.9	172.3	171	-96.7	0	0	0	111.1	L88 L94 W95 P98 C156 G160 V161 Y162 M216	L88-F158 HydrophobicContact CD2-CD2 4.12Å; L88-F158 HydrophobicContact CD2-CE2 4.17Å; L94-F158 HydrophobicContact CB-CB 4.3Å; L94-F158 HydrophobicContact CB-CD2 4.07Å; L94-F158 VanDerWaalsContact O-CD2 3.26Å; L94-F158 WeakPolarHBondContact O-CD2 3.4Å; L94-F158 WeakPolarHBondContact O-CG 3.29Å; W95-F158 AromaticContact CD2-CE2 3.83Å; W95-F158 HydrophobicContact CD2-CE2 3.83Å; W95-F158 AromaticContact CE3-CE2 3.6Å; W95-F158 HydrophobicContact CE3-CE2 3.6Å; W95-F158 AromaticContact CE3-CZ 3.99Å; W95-F158 HydrophobicContact CE3-CZ 3.99Å; W95-F158 HydrophobicContact CH2-CE2 4.09Å; W95-F158 HydrophobicContact CH2-CZ 4.42Å; W95-F158 HydrophobicContact CZ2-CE2 4.29Å; W95-F158 AromaticContact CZ3-CE2 3.74Å; W95-F158 HydrophobicContact CZ3-CE2 3.74Å; W95-F158 AromaticContact CZ3-CZ 3.86Å; W95-F158 HydrophobicContact CZ3-CZ 3.86Å; P98-F158 HydrophobicContact CB-CB 3.97Å; P98-F158 HydrophobicContact CB-CD1 3.68Å; P98-F158 HydrophobicContact CB-CE1 4.4Å; P98-F158 HydrophobicContact CB-CG 3.88Å; C156-F158 VanDerWaalsContact C-N 3.28Å; C156-F158 PolarHBondContact O-N 3.21Å; F158-G160 PolarHBondContact O-N 3.36Å; F158-V161 PolarHBondContact O-N 3.05Å; F158-Y162 HydrophobicContact CE1-CD2 4.45Å; F158-Y162 HydrophobicContact CE2-CD2 4.09Å; F158-Y162 AromaticContact CZ-CD2 3.75Å; F158-Y162 HydrophobicContact CZ-CD2 3.75Å; F158-Y162 HydrophobicContact CZ-CE2 4.39Å; F158-Y162 HydrophobicContact CZ-CG 4.27Å; F158-Y162 WeakPolarHBondContact O-CB 3.32Å; F158-Y162 PolarHBondContact O-N 2.77Å; F158-M216 HydrophobicContact CE1-CB 3.8Å; F158-M216 HydrophobicContact CE1-CE 4.44Å; F158-M216 HydrophobicContact CE1-CG 4.03Å; F158-M216 HydrophobicContact CZ-CB 4.32Å; F158-M216 HydrophobicContact CZ-CE 4.33Å; F158-M216 HydrophobicContact CZ-CG 4.03Å
159	F	96.8	Very high	94.8	Very high	7 Å²	7	17 Å²	17	3%	0.031	8%	0.075	C	C	.	.	H	α-helix	trans	-64.2	-41.5	-177.7	-64.1	-69.8	0	0	0	112.7	P98 C156 V157 R163 F213 M216 A217 S220 F240	P98-F159 HydrophobicContact CB-CE2 4.07Å; P98-F159 HydrophobicContact CB-CZ 4.11Å; C156-F159 HydrophobicContact CB-CD2 3.84Å; C156-F159 PolarHBondContact O-N 3.1Å; C156-F159 VanDerWaalsContact O-N 3.12Å; V157-F159 VanDerWaalsContact C-N 3.31Å; V157-F159 PolarHBondContact O-N 3.41Å; F159-R163 WeakPolarHBondContact O-CB 3.48Å; F159-R163 PolarHBondContact O-N 2.79Å; F159-F213 HydrophobicContact CB-CE2 3.93Å; F159-F213 HydrophobicContact CB-CZ 4.33Å; F159-F213 HydrophobicContact CD1-CD2 4.09Å; F159-F213 AromaticContact CD1-CE2 3.65Å; F159-F213 HydrophobicContact CD1-CE2 3.65Å; F159-F213 AromaticContact CD1-CZ 3.99Å; F159-F213 HydrophobicContact CD1-CZ 3.99Å; F159-F213 HydrophobicContact CG-CE2 4.28Å; F159-M216 HydrophobicContact CE1-CB 4.17Å; F159-A217 HydrophobicContact CE1-CB 3.76Å; F159-A217 HydrophobicContact CZ-CB 4.14Å; F159-S220 WeakPolarHBondContact CZ-OG 3.44Å; F159-F240 HydrophobicContact CB-CE2 3.76Å; F159-F240 HydrophobicContact CB-CZ 4.49Å; F159-F240 HydrophobicContact CD1-CE2 4.07Å; F159-F240 HydrophobicContact CD1-CZ 4.01Å; F159-F240 HydrophobicContact CD2-CE2 4.09Å; F159-F240 HydrophobicContact CE1-CZ 4.42Å; F159-F240 AromaticContact CG-CE2 3.7Å; F159-F240 HydrophobicContact CG-CE2 3.7Å; F159-F240 HydrophobicContact CG-CZ 4.11Å
160	G	97.1	Very high	94.9	Very high	3 Å²	3	15.5 Å²	15.5	3%	0.031	7%	0.071	C	C	.	.	H	α-helix	trans	-59.9	-53.3	175.5	0	0	0	0	0	111.6	C156 V157 F158 R163 L164	C156-G160 PolarHBondContact O-N 3Å; C156-G160 VanDerWaalsContact O-N 3.14Å; V157-G160 PolarHBondContact O-N 3.21Å; F158-G160 PolarHBondContact O-N 3.36Å; G160-R163 PolarHBondContact O-N 2.97Å; G160-L164 WeakPolarHBondContact O-CB 3.36Å; G160-L164 PolarHBondContact O-N 3.03Å
161	V	97.5	Very high	95	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-64.3	-47.3	-177.7	174.8	0	0	0	0	111	C84 A87 L88 L110 V157 F158 R163 L164 T165	C84-V161 HydrophobicContact CB-CG1 3.81Å; A87-V161 HydrophobicContact CB-CG1 3.89Å; L88-V161 HydrophobicContact CD1-CG1 4.19Å; L88-V161 HydrophobicContact CD2-CG1 4.15Å; L88-V161 HydrophobicContact CG-CG1 3.82Å; L110-V161 HydrophobicContact CD1-CG2 4.38Å; L110-V161 HydrophobicContact CG-CG2 4.45Å; V157-V161 HydrophobicContact CG1-CG2 3.88Å; V157-V161 WeakPolarHBondContact O-CB 3.44Å; V157-V161 VanDerWaalsContact O-CG2 3.28Å; V157-V161 WeakPolarHBondContact O-CG2 3.38Å; V157-V161 PolarHBondContact O-N 3.21Å; F158-V161 PolarHBondContact O-N 3.05Å; V161-R163 VanDerWaalsContact C-N 3.27Å; V161-R163 PolarHBondContact O-N 2.9Å; V161-L164 PolarHBondContact O-N 2.9Å; V161-L164 VanDerWaalsContact O-N 3.14Å; V161-T165 WeakPolarHBondContact O-CG2 3.49Å; V161-T165 PolarHBondContact O-N 2.94Å
162	Y	97.3	Very high	95.2	Very high	19 Å²	19	19 Å²	19	8%	0.075	9%	0.087	C	C	.	.	H	α-helix	trans	-56.9	-44.6	177	-169.7	-79.7	0	0	0	110.6	W95 F158 T165 M209 P212 F213	W95-Y162 HydrophobicContact CH2-CD2 4.32Å; W95-Y162 HydrophobicContact CH2-CE2 4.05Å; F158-Y162 HydrophobicContact CE1-CD2 4.45Å; F158-Y162 HydrophobicContact CE2-CD2 4.09Å; F158-Y162 AromaticContact CZ-CD2 3.75Å; F158-Y162 HydrophobicContact CZ-CD2 3.75Å; F158-Y162 HydrophobicContact CZ-CE2 4.39Å; F158-Y162 HydrophobicContact CZ-CG 4.27Å; F158-Y162 WeakPolarHBondContact O-CB 3.32Å; F158-Y162 PolarHBondContact O-N 2.77Å; Y162-T165 WeakPolarHBondContact O-CB 3.43Å; Y162-T165 WeakPolarHBondContact O-CG2 3.47Å; Y162-T165 PolarHBondContact O-N 2.86Å; Y162-T165 PolarHBondContact O-OG1 2.94Å; Y162-M209 HydrophobicContact CD1-CE 4.29Å; Y162-M209 HydrophobicContact CD2-CE 4.45Å; Y162-M209 HydrophobicContact CE1-CB 4.05Å; Y162-M209 HydrophobicContact CE1-CE 3.64Å; Y162-M209 WeakPolarHBondContact CE1-O 3.21Å; Y162-M209 HydrophobicContact CE2-CE 3.81Å; Y162-M209 WeakPolarHBondContact OH-CE 3.46Å; Y162-M209 PolarHBondContact OH-O 3.11Å; Y162-P212 WeakPolarHBondContact OH-CG 3.49Å; Y162-F213 HydrophobicContact CD1-CB 4.09Å; Y162-F213 AromaticContact CD1-CD2 3.71Å; Y162-F213 HydrophobicContact CD1-CD2 3.71Å; Y162-F213 HydrophobicContact CD1-CG 4.39Å; Y162-F213 HydrophobicContact CE1-CB 3.81Å; Y162-F213 HydrophobicContact CE1-CD2 4.31Å; Y162-F213 HydrophobicContact CG-CD2 4.48Å
163	R	96.9	Very high	95.3	Very high	18 Å²	18	17 Å²	17	7%	0.068	9%	0.085	C	C	.	.	H	α-helix	trans	-68.3	-35.8	178	-173.7	62.2	73	142.1	-0.5	112.5	F159 G160 V161 T165 T166 F213 D248	F159-R163 WeakPolarHBondContact O-CB 3.48Å; F159-R163 PolarHBondContact O-N 2.79Å; G160-R163 PolarHBondContact O-N 2.97Å; V161-R163 VanDerWaalsContact C-N 3.27Å; V161-R163 PolarHBondContact O-N 2.9Å; R163-T165 PolarHBondContact O-N 3.24Å; R163-T166 WeakPolarHBondContact O-CB 3.35Å; R163-T166 WeakPolarHBondContact O-CG2 3.35Å; R163-T166 PolarHBondContact O-N 3.13Å; R163-T166 PolarHBondContact O-OG1 2.75Å; R163-F213 HydrophobicContact CB-CE2 4.26Å; R163-D248 IonicContact CZ-OD1 2.79Å; R163-D248 IonicContact CZ-OD2 3.34Å; R163-D248 IonicContact NH1-OD1 2.87Å; R163-D248 PolarHBondContact NH1-OD1 3.37Å; R163-D248 IonicContact NH1-OD2 3.79Å; R163-D248 IonicContact NH2-OD1 3.67Å; R163-D248 PolarHBondContact NH2-OD1 3.11Å; R163-D248 IonicContact NH2-OD2 2.77Å; R163-D248 PolarHBondContact NH2-OD2 3.2Å; R163-D248 VanDerWaalsContact NH2-OD2 3.07Å
164	L	97.3	Very high	95.7	Very high	2 Å²	2	14.7 Å²	14.7	1%	0.01	8%	0.076	C	C	.	.	H	α-helix	trans	-67.9	-18.4	177.8	-175.5	57.2	0	0	0	113.1	V80 A109 L110 S113 F147 G160 V161 T166 E167	V80-L164 HydrophobicContact CB-CD2 4.09Å; V80-L164 HydrophobicContact CB-CG 4.43Å; V80-L164 HydrophobicContact CG2-CD1 4.14Å; V80-L164 HydrophobicContact CG2-CD2 4.39Å; V80-L164 HydrophobicContact CG2-CG 4.23Å; A109-L164 HydrophobicContact CB-CD2 3.92Å; L110-L164 HydrophobicContact CD2-CB 4.32Å; L110-L164 HydrophobicContact CD2-CD2 3.96Å; S113-L164 WeakPolarHBondContact OG-CD1 3.41Å; S113-L164 VanDerWaalsContact OG-CD2 3.27Å; S113-L164 WeakPolarHBondContact OG-CD2 3.21Å; F147-L164 HydrophobicContact CE2-CB 4.45Å; F147-L164 HydrophobicContact CE2-CD1 3.93Å; F147-L164 HydrophobicContact CZ-CB 4Å; F147-L164 HydrophobicContact CZ-CD1 4.22Å; G160-L164 WeakPolarHBondContact O-CB 3.36Å; G160-L164 PolarHBondContact O-N 3.03Å; V161-L164 PolarHBondContact O-N 2.9Å; V161-L164 VanDerWaalsContact O-N 3.14Å; L164-T166 PolarHBondContact O-N 3.5Å; L164-E167 HydrophobicContact CD1-CG 3.65Å; L164-E167 WeakPolarHBondContact O-CB 3.46Å; L164-E167 PolarHBondContact O-N 3.33Å
165	T	96.7	Very high	95.9	Very high	7 Å²	7	17 Å²	17	4%	0.043	9%	0.088	C	C	.	.	G	3₁₀ helix	trans	-58.5	-18.3	171.8	67.4	0	0	0	0	113.7	C84 L88 V161 Y162 R163 E167 L168 M209	C84-T165 HydrophobicContact CB-CG2 4.07Å; L88-T165 HydrophobicContact CD1-CG2 3.66Å; V161-T165 WeakPolarHBondContact O-CG2 3.49Å; V161-T165 PolarHBondContact O-N 2.94Å; Y162-T165 WeakPolarHBondContact O-CB 3.43Å; Y162-T165 WeakPolarHBondContact O-CG2 3.47Å; Y162-T165 PolarHBondContact O-N 2.86Å; Y162-T165 PolarHBondContact O-OG1 2.94Å; R163-T165 PolarHBondContact O-N 3.24Å; T165-E167 PolarHBondContact O-N 2.89Å; T165-E167 VanDerWaalsContact O-N 3.12Å; T165-L168 VanDerWaalsContact O-CB 3.29Å; T165-L168 WeakPolarHBondContact O-CB 3.42Å; T165-L168 WeakPolarHBondContact O-CD1 3.4Å; T165-L168 WeakPolarHBondContact O-CG 3.41Å; T165-L168 PolarHBondContact O-N 2.71Å; T165-M209 WeakPolarHBondContact OG1-CE 3.21Å
166	T	96	Very high	96.1	Very high	15 Å²	15	18.7 Å²	18.7	9%	0.092	9%	0.094	C	C	.	.	G	3₁₀ helix	trans	-58.3	-21	172.8	56.8	0	0	0	0	113.7	R163 L164 L168 S169 T205 R206	R163-T166 WeakPolarHBondContact O-CB 3.35Å; R163-T166 WeakPolarHBondContact O-CG2 3.35Å; R163-T166 PolarHBondContact O-N 3.13Å; R163-T166 PolarHBondContact O-OG1 2.75Å; L164-T166 PolarHBondContact O-N 3.5Å; T166-L168 PolarHBondContact O-N 3.48Å; T166-S169 PolarHBondContact O-N 3.36Å; T166-S169 PolarHBondContact O-OG 3.43Å; T166-T205 WeakPolarHBondContact CG2-O 3.05Å; T166-R206 HydrophobicContact CG2-CB 4.39Å; T166-R206 HydrophobicContact CG2-CG 3.58Å; T166-R206 PolarHBondContact O-NE 2.77Å; T166-R206 PolarHBondContact O-NH2 3.05Å
167	E	96.6	Very high	96.2	Very high	10 Å²	10	20.3 Å²	20.3	5%	0.047	10%	0.1	C	C	.	.	G	3₁₀ helix	trans	-68.3	-14.4	173.8	-70.3	-58.6	147.6	0	0	113.9	A77 V80 L164 T165 S169 T170 P171	A77-E167 HydrophobicContact CB-CB 4.2Å; V80-E167 HydrophobicContact CG2-CB 4.1Å; V80-E167 HydrophobicContact CG2-CG 4.26Å; L164-E167 HydrophobicContact CD1-CG 3.65Å; L164-E167 WeakPolarHBondContact O-CB 3.46Å; L164-E167 PolarHBondContact O-N 3.33Å; T165-E167 PolarHBondContact O-N 2.89Å; T165-E167 VanDerWaalsContact O-N 3.12Å; E167-S169 PolarHBondContact O-N 3.12Å; E167-T170 VanDerWaalsContact O-CB 3.3Å; E167-T170 WeakPolarHBondContact O-CB 3.47Å; E167-T170 PolarHBondContact O-N 3.15Å; E167-T170 PolarHBondContact O-OG1 3.31Å; E167-T170 VanDerWaalsContact OE2-CB 3.24Å; E167-T170 WeakPolarHBondContact OE2-CB 3.44Å; E167-T170 PolarHBondContact OE2-OG1 3.06Å; E167-P171 VanDerWaalsContact O-CD 3.3Å; E167-P171 WeakPolarHBondContact O-CD 3.27Å
168	L	95.9	Very high	96.2	Very high	48 Å²	48	21.4 Å²	21.4	25%	0.251	10%	0.104	S	C	.	.	G	3₁₀ helix	trans	-56.7	-26.7	173.9	-79.8	165.9	0	0	0	113	S81 T165 T166 F172 F201 T205	S81-L168 PolarHBondContact OG-N 2.85Å; T165-L168 VanDerWaalsContact O-CB 3.29Å; T165-L168 WeakPolarHBondContact O-CB 3.42Å; T165-L168 WeakPolarHBondContact O-CD1 3.4Å; T165-L168 WeakPolarHBondContact O-CG 3.41Å; T165-L168 PolarHBondContact O-N 2.71Å; T166-L168 PolarHBondContact O-N 3.48Å; L168-F172 WeakPolarHBondContact O-CD2 3.37Å; L168-F172 WeakPolarHBondContact O-CE2 3.23Å; L168-F201 HydrophobicContact CB-CD1 4.04Å; L168-F201 HydrophobicContact CB-CE1 4.44Å; L168-T205 HydrophobicContact CB-CG2 4.25Å; L168-T205 HydrophobicContact CD1-CG2 4.17Å
169	S	95.8	Very high	96.1	Very high	1 Å²	1	24 Å²	24	1%	0.007	11%	0.114	C	C	.	.	G	3₁₀ helix	trans	-79.6	-20	177.3	58.7	0	0	0	0	113.8	T166 E167 F172 V173 R206	T166-S169 PolarHBondContact O-N 3.36Å; T166-S169 PolarHBondContact O-OG 3.43Å; E167-S169 PolarHBondContact O-N 3.12Å; S169-F172 PolarHBondContact O-N 3.12Å; S169-V173 PolarHBondContact O-N 3.39Å; S169-R206 PolarHBondContact OG-NE 2.89Å; S169-R206 VanDerWaalsContact OG-NE 3.08Å
170	T	96.2	Very high	95.9	Very high	12 Å²	12	27.2 Å²	27.2	7%	0.074	13%	0.126	C	C	.	.	H	α-helix	trans	-69.2	-42.1	-168.4	-57.9	0	0	0	0	114.1	S73 A77 E167 F172 V173 N174	S73-T170 VanDerWaalsContact OG-CG2 3.24Å; S73-T170 WeakPolarHBondContact OG-CG2 3.47Å; A77-T170 HydrophobicContact CB-CG2 3.92Å; E167-T170 VanDerWaalsContact O-CB 3.3Å; E167-T170 WeakPolarHBondContact O-CB 3.47Å; E167-T170 PolarHBondContact O-N 3.15Å; E167-T170 PolarHBondContact O-OG1 3.31Å; E167-T170 VanDerWaalsContact OE2-CB 3.24Å; E167-T170 WeakPolarHBondContact OE2-CB 3.44Å; E167-T170 PolarHBondContact OE2-OG1 3.06Å; T170-F172 PolarHBondContact O-N 3.11Å; T170-V173 VanDerWaalsContact O-CG1 3.29Å; T170-V173 WeakPolarHBondContact O-CG1 3.49Å; T170-V173 PolarHBondContact O-N 3.28Å; T170-N174 PolarHBondContact O-N 2.97Å
171	P	96.3	Very high	95.6	Very high	29 Å²	29	28.6 Å²	28.6	19%	0.188	13%	0.134	C	C	.	.	H	α-helix	trans	-57.3	-36.9	175.8	-26.3	36.1	0	0	0	112.2	A77 E167 Q175	A77-P171 HydrophobicContact CB-CG 3.98Å; E167-P171 VanDerWaalsContact O-CD 3.3Å; E167-P171 WeakPolarHBondContact O-CD 3.27Å; P171-Q175 VanDerWaalsContact O-CB 3.27Å; P171-Q175 WeakPolarHBondContact O-CB 3.35Å; P171-Q175 PolarHBondContact O-N 3.44Å
172	F	96.5	Very high	95.3	Very high	60 Å²	60	31.3 Å²	31.3	26%	0.263	15%	0.148	S	C	.	.	H	α-helix	trans	-75.3	-35	-179	-54.7	-69.4	0	0	0	112.9	L168 S169 T170 N174 R176 V194 I197 F198 F201	L168-F172 WeakPolarHBondContact O-CD2 3.37Å; L168-F172 WeakPolarHBondContact O-CE2 3.23Å; S169-F172 PolarHBondContact O-N 3.12Å; T170-F172 PolarHBondContact O-N 3.11Å; F172-N174 VanDerWaalsContact C-N 3.34Å; F172-R176 WeakPolarHBondContact O-CB 3.33Å; F172-R176 PolarHBondContact O-N 2.91Å; F172-V194 HydrophobicContact CB-CG1 4.49Å; F172-V194 WeakPolarHBondContact O-CG1 3.12Å; F172-I197 HydrophobicContact CD1-CB 4.44Å; F172-I197 HydrophobicContact CD1-CG2 3.62Å; F172-I197 HydrophobicContact CD2-CG2 4Å; F172-I197 HydrophobicContact CE1-CG2 3.62Å; F172-I197 HydrophobicContact CE2-CG2 4Å; F172-I197 HydrophobicContact CG-CG2 3.81Å; F172-I197 HydrophobicContact CZ-CG2 3.81Å; F172-F198 HydrophobicContact CB-CB 3.72Å; F172-F201 AromaticContact CD2-CD2 4Å; F172-F201 HydrophobicContact CD2-CD2 4Å; F172-F201 HydrophobicContact CD2-CE2 4.47Å; F172-F201 HydrophobicContact CD2-CG 4.39Å; F172-F201 AromaticContact CE2-CD2 3.69Å; F172-F201 HydrophobicContact CE2-CD2 3.69Å; F172-F201 AromaticContact CE2-CE2 3.73Å; F172-F201 HydrophobicContact CE2-CE2 3.73Å; F172-F201 HydrophobicContact CE2-CG 4.21Å; F172-F201 HydrophobicContact CE2-CZ 4.27Å; F172-F201 HydrophobicContact CZ-CD2 4.42Å; F172-F201 HydrophobicContact CZ-CE2 4.1Å
173	V	94.9	Very high	94.9	Very high	44 Å²	44	33.1 Å²	33.1	27%	0.267	17%	0.173	S	C	.	.	H	α-helix	trans	-66.9	-39.4	173.8	81.8	0	0	0	0	111.3	S169 T170 R176 W177 F198	S169-V173 PolarHBondContact O-N 3.39Å; T170-V173 VanDerWaalsContact O-CG1 3.29Å; T170-V173 WeakPolarHBondContact O-CG1 3.49Å; T170-V173 PolarHBondContact O-N 3.28Å; V173-R176 PolarHBondContact O-N 3.35Å; V173-W177 PolarHBondContact O-N 2.94Å; V173-F198 HydrophobicContact CB-CD2 3.6Å; V173-F198 HydrophobicContact CB-CE2 3.53Å; V173-F198 HydrophobicContact CB-CG 4.31Å; V173-F198 HydrophobicContact CB-CZ 4.19Å; V173-F198 HydrophobicContact CG2-CD2 4.07Å; V173-F198 HydrophobicContact CG2-CE1 4.28Å; V173-F198 HydrophobicContact CG2-CE2 3.66Å; V173-F198 HydrophobicContact CG2-CZ 3.78Å
174	N	96.5	Very high	94.6	Very high	4 Å²	4	35.8 Å²	35.8	2%	0.021	18%	0.184	C	C	.	.	H	α-helix	trans	-67.4	-45.2	175.9	-71.1	-21.7	0	0	0	111.1	R70 S73 S74 T170 F172 R176 W177 F178	R70-N174 HydrophobicContact CB-CB 4.34Å; R70-N174 PolarHBondContact NH1-OD1 3.33Å; R70-N174 PolarHBondContact O-ND2 3.46Å; S73-N174 WeakPolarHBondContact CB-ND2 3.49Å; S73-N174 PolarHBondContact OG-ND2 3.35Å; S73-N174 VanDerWaalsContact OG-ND2 3.11Å; S74-N174 PolarHBondContact N-ND2 3.34Å; S74-N174 WeakPolarHBondContact OG-CB 3.4Å; S74-N174 PolarHBondContact OG-ND2 2.93Å; T170-N174 PolarHBondContact O-N 2.97Å; F172-N174 VanDerWaalsContact C-N 3.34Å; N174-R176 VanDerWaalsContact C-N 3.29Å; N174-R176 PolarHBondContact O-N 3.28Å; N174-W177 WeakPolarHBondContact O-CA 3.33Å; N174-W177 WeakPolarHBondContact O-CB 3.19Å; N174-W177 PolarHBondContact O-N 3.4Å; N174-F178 HydrophobicContact CB-CE2 4.18Å; N174-F178 WeakPolarHBondContact O-CD2 3.48Å; N174-F178 PolarHBondContact O-N 3.44Å
175	Q	95.8	Very high	94.2	Very high	72 Å²	72	42.5 Å²	42.5	34%	0.336	21%	0.212	S	C	.	.	H	α-helix	trans	-58.1	-42	175.6	-172.6	61.5	47.4	0	0	112.2	P171 W177 F178 Y179 V194	P171-Q175 VanDerWaalsContact O-CB 3.27Å; P171-Q175 WeakPolarHBondContact O-CB 3.35Å; P171-Q175 PolarHBondContact O-N 3.44Å; Q175-W177 VanDerWaalsContact C-N 3.34Å; Q175-F178 PolarHBondContact O-N 2.9Å; Q175-Y179 HydrophobicContact CG-CE2 4.12Å; Q175-Y179 VanDerWaalsContact NE2-CZ 3.28Å; Q175-Y179 PolarHBondContact O-N 3.09Å; Q175-V194 HydrophobicContact CB-CG1 3.89Å; Q175-V194 HydrophobicContact CG-CG1 3.93Å; Q175-V194 HydrophobicContact CG-CG2 4.21Å
176	R	94.8	Very high	93.5	Very high	38 Å²	38	45.7 Å²	45.7	14%	0.143	23%	0.233	C	C	.	.	H	α-helix	trans	-60.2	-45	174.1	-179.3	-177.5	178.7	-88.5	-2.3	111.2	F172 V173 N174 Y179 R180 V194 T195	F172-R176 WeakPolarHBondContact O-CB 3.33Å; F172-R176 PolarHBondContact O-N 2.91Å; V173-R176 PolarHBondContact O-N 3.35Å; N174-R176 VanDerWaalsContact C-N 3.29Å; N174-R176 PolarHBondContact O-N 3.28Å; R176-Y179 PolarHBondContact O-N 3.34Å; R176-R180 WeakPolarHBondContact O-CG 3.3Å; R176-R180 PolarHBondContact O-N 3.32Å; R176-V194 HydrophobicContact CB-CG1 4.16Å; R176-T195 VanDerWaalsContact CD-OG1 3.24Å; R176-T195 WeakPolarHBondContact CD-OG1 3.32Å; R176-T195 PolarHBondContact NE-OG1 3.21Å; R176-T195 VanDerWaalsContact NE-OG1 3.1Å
177	W	94.7	Very high	92.8	Very high	38 Å²	38	49.4 Å²	49.4	14%	0.144	25%	0.253	C	S	.	.	H	α-helix	trans	-60.7	-47.7	176.9	-176.6	100.5	0	0	0	111.2	E66 W67 R70 V173 N174 Q175 Y179 R180 T181	E66-W177 HydrophobicContact CB-CH2 4.47Å; E66-W177 HydrophobicContact CB-CZ2 4.14Å; E66-W177 VanDerWaalsContact CD-CZ2 3.49Å; E66-W177 HydrophobicContact CG-CH2 4.44Å; E66-W177 HydrophobicContact CG-CZ2 3.86Å; E66-W177 PolarHBondContact OE1-NE1 3.24Å; E66-W177 WeakPolarHBondContact OE2-CZ2 3.43Å; W67-W177 HydrophobicContact CB-CH2 3.97Å; W67-W177 HydrophobicContact CB-CZ3 4.09Å; W67-W177 HydrophobicContact CD2-CZ3 4.15Å; W67-W177 HydrophobicContact CE3-CH2 4.08Å; W67-W177 AromaticContact CE3-CZ3 3.66Å; W67-W177 HydrophobicContact CE3-CZ3 3.66Å; W67-W177 HydrophobicContact CG-CZ3 4.38Å; W67-W177 HydrophobicContact CZ3-CZ3 4.4Å; R70-W177 VanDerWaalsContact NE-CD1 3.33Å; R70-W177 VanDerWaalsContact NE-CD2 3.27Å; V173-W177 PolarHBondContact O-N 2.94Å; N174-W177 WeakPolarHBondContact O-CA 3.33Å; N174-W177 WeakPolarHBondContact O-CB 3.19Å; N174-W177 PolarHBondContact O-N 3.4Å; Q175-W177 VanDerWaalsContact C-N 3.34Å; W177-Y179 VanDerWaalsContact C-N 3.33Å; W177-Y179 PolarHBondContact O-N 3.43Å; W177-R180 PolarHBondContact O-N 3.38Å; W177-T181 HydrophobicContact CH2-CG2 4Å; W177-T181 HydrophobicContact CZ2-CG2 4.46Å; W177-T181 WeakPolarHBondContact CZ2-OG1 3.46Å; W177-T181 HydrophobicContact CZ3-CG2 4.19Å; W177-T181 WeakPolarHBondContact CZ3-OG1 3.18Å; W177-T181 PolarHBondContact O-N 2.92Å; W177-T181 PolarHBondContact O-OG1 2.81Å; W177-T181 VanDerWaalsContact O-OG1 3.08Å
178	F	94.8	Very high	92.4	Very high	22 Å²	22	56.2 Å²	56.2	10%	0.096	28%	0.278	C	S	.	.	H	α-helix	trans	-56.6	-45.3	178.6	-72.3	-59	0	0	0	112.2	W67 R70 V71 N174 Q175 R180 T181 I182	W67-F178 AromaticContact CD2-CD1 3.87Å; W67-F178 HydrophobicContact CD2-CD1 3.87Å; W67-F178 AromaticContact CD2-CE1 3.59Å; W67-F178 HydrophobicContact CD2-CE1 3.59Å; W67-F178 AromaticContact CE2-CD1 3.86Å; W67-F178 AromaticContact CE2-CE1 3.61Å; W67-F178 AromaticContact CE3-CD1 3.9Å; W67-F178 HydrophobicContact CE3-CD1 3.9Å; W67-F178 HydrophobicContact CE3-CE1 4.07Å; W67-F178 AromaticContact CG-CE1 3.84Å; W67-F178 HydrophobicContact CG-CE1 3.84Å; W67-F178 AromaticContact CH2-CD1 3.9Å; W67-F178 HydrophobicContact CH2-CD1 3.9Å; W67-F178 HydrophobicContact CH2-CE1 4.48Å; W67-F178 AromaticContact CZ2-CD1 3.88Å; W67-F178 HydrophobicContact CZ2-CD1 3.88Å; W67-F178 HydrophobicContact CZ2-CE1 4.07Å; W67-F178 AromaticContact CZ3-CD1 3.92Å; W67-F178 HydrophobicContact CZ3-CD1 3.92Å; W67-F178 HydrophobicContact CZ3-CE1 4.49Å; W67-F178 AromaticContact NE1-CE1 3.88Å; R70-F178 HydrophobicContact CB-CE1 4.28Å; R70-F178 HydrophobicContact CB-CE2 4.05Å; R70-F178 HydrophobicContact CB-CZ 3.57Å; V71-F178 HydrophobicContact CG2-CE1 4.43Å; V71-F178 HydrophobicContact CG2-CZ 3.9Å; N174-F178 HydrophobicContact CB-CE2 4.18Å; N174-F178 WeakPolarHBondContact O-CD2 3.48Å; N174-F178 PolarHBondContact O-N 3.44Å; Q175-F178 PolarHBondContact O-N 2.9Å; F178-R180 VanDerWaalsContact C-N 3.3Å; F178-R180 PolarHBondContact O-N 2.96Å; F178-T181 PolarHBondContact O-N 2.62Å; F178-I182 WeakPolarHBondContact O-CB 3.45Å; F178-I182 WeakPolarHBondContact O-CD1 3.35Å; F178-I182 WeakPolarHBondContact O-CG1 3.25Å; F178-I182 PolarHBondContact O-N 2.88Å
179	Y	94	Very high	92.1	Very high	54 Å²	54	57.8 Å²	57.8	21%	0.212	28%	0.281	C	S	.	.	H	α-helix	trans	-59.4	-41.3	176.7	-73.2	-25.1	0	0	0	112.9	Q175 R176 W177 I182 G183 Y184 R190 V191 V194	Q175-Y179 HydrophobicContact CG-CE2 4.12Å; Q175-Y179 VanDerWaalsContact NE2-CZ 3.28Å; Q175-Y179 PolarHBondContact O-N 3.09Å; R176-Y179 PolarHBondContact O-N 3.34Å; W177-Y179 VanDerWaalsContact C-N 3.33Å; W177-Y179 PolarHBondContact O-N 3.43Å; Y179-I182 PolarHBondContact O-N 2.96Å; Y179-G183 PolarHBondContact O-N 3.11Å; Y179-Y184 HydrophobicContact CD1-CD2 4.49Å; Y179-Y184 VanDerWaalsContact O-CB 3.3Å; Y179-Y184 WeakPolarHBondContact O-CB 3.44Å; Y179-Y184 PolarHBondContact O-N 3.24Å; Y179-R190 HydrophobicContact CE2-CB 4.42Å; Y179-V191 HydrophobicContact CD2-CG2 4.05Å; Y179-V191 HydrophobicContact CG-CG2 4.27Å; Y179-V194 HydrophobicContact CD2-CG2 4.44Å; Y179-V194 HydrophobicContact CE2-CB 4.32Å; Y179-V194 HydrophobicContact CE2-CG2 3.7Å
180	R	91.8	Very high	91.8	Very high	75 Å²	75	65.5 Å²	65.5	28%	0.283	31%	0.309	S	S	.	.	H	α-helix	trans	-68.5	-40.4	178.6	-65.1	-173.9	76.6	-169.9	11.3	111.9	R176 W177 F178 I182 G183	R176-R180 WeakPolarHBondContact O-CG 3.3Å; R176-R180 PolarHBondContact O-N 3.32Å; W177-R180 PolarHBondContact O-N 3.38Å; F178-R180 VanDerWaalsContact C-N 3.3Å; F178-R180 PolarHBondContact O-N 2.96Å; R180-I182 VanDerWaalsContact C-N 3.29Å; R180-I182 PolarHBondContact O-N 3.43Å; R180-G183 PolarHBondContact O-N 2.97Å
181	T	91.3	Very high	91.7	Very high	32 Å²	32	65 Å²	65	20%	0.196	31%	0.306	C	S	.	.	H	α-helix	trans	-65.5	-33.2	176.9	-54.5	0	0	0	0	112	L55 L59 W67 W177 F178 G183	L55-T181 HydrophobicContact CD2-CG2 4.37Å; L59-T181 HydrophobicContact CD1-CG2 3.92Å; L59-T181 HydrophobicContact CD2-CG2 4.05Å; W67-T181 HydrophobicContact CE3-CG2 3.98Å; W67-T181 HydrophobicContact CZ3-CG2 3.88Å; W177-T181 HydrophobicContact CH2-CG2 4Å; W177-T181 HydrophobicContact CZ2-CG2 4.46Å; W177-T181 WeakPolarHBondContact CZ2-OG1 3.46Å; W177-T181 HydrophobicContact CZ3-CG2 4.19Å; W177-T181 WeakPolarHBondContact CZ3-OG1 3.18Å; W177-T181 PolarHBondContact O-N 2.92Å; W177-T181 PolarHBondContact O-OG1 2.81Å; W177-T181 VanDerWaalsContact O-OG1 3.08Å; F178-T181 PolarHBondContact O-N 2.62Å; T181-G183 PolarHBondContact O-N 2.91Å
182	I	91	Very high	91.5	Very high	57 Å²	57	63.7 Å²	63.7	29%	0.292	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-11.2	174.4	-63.7	161.8	0	0	0	112.1	L55 W67 F178 Y179 R180 Y184	L55-I182 HydrophobicContact CD1-CB 4.49Å; L55-I182 HydrophobicContact CD1-CG2 4.49Å; W67-I182 HydrophobicContact CH2-CD1 4.2Å; W67-I182 HydrophobicContact CH2-CG1 4.03Å; W67-I182 HydrophobicContact CZ3-CG1 4.32Å; F178-I182 WeakPolarHBondContact O-CB 3.45Å; F178-I182 WeakPolarHBondContact O-CD1 3.35Å; F178-I182 WeakPolarHBondContact O-CG1 3.25Å; F178-I182 PolarHBondContact O-N 2.88Å; Y179-I182 PolarHBondContact O-N 2.96Å; R180-I182 VanDerWaalsContact C-N 3.29Å; R180-I182 PolarHBondContact O-N 3.43Å; I182-Y184 HydrophobicContact CB-CD2 4.26Å; I182-Y184 HydrophobicContact CB-CE2 4.49Å; I182-Y184 HydrophobicContact CG2-CD2 4.06Å; I182-Y184 HydrophobicContact CG2-CE2 3.88Å
183	G	90.1	Very high	91.5	Very high	58 Å²	58	62.7 Å²	62.7	60%	0.598	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.8	9.9	178	0	0	0	0	0	114.6	Y179 R180 T181 K185	Y179-G183 PolarHBondContact O-N 3.11Å; R180-G183 PolarHBondContact O-N 2.97Å; T181-G183 PolarHBondContact O-N 2.91Å; G183-K185 PolarHBondContact O-N 2.97Å
184	Y	89.2	Confident	91.5	Very high	74 Å²	74	61.5 Å²	61.5	29%	0.29	29%	0.291	S	S	.	.			trans	-67.3	122.6	170.3	-73.4	-102.5	0	0	0	109.7	Y179 I182 R188 V191	Y179-Y184 HydrophobicContact CD1-CD2 4.49Å; Y179-Y184 VanDerWaalsContact O-CB 3.3Å; Y179-Y184 WeakPolarHBondContact O-CB 3.44Å; Y179-Y184 PolarHBondContact O-N 3.24Å; I182-Y184 HydrophobicContact CB-CD2 4.26Å; I182-Y184 HydrophobicContact CB-CE2 4.49Å; I182-Y184 HydrophobicContact CG2-CD2 4.06Å; I182-Y184 HydrophobicContact CG2-CE2 3.88Å; Y184-R188 HydrophobicContact CD1-CB 4.26Å; Y184-R188 HydrophobicContact CD1-CG 4.14Å; Y184-V191 HydrophobicContact CG-CG2 4.31Å
185	K	89.1	Confident	91.5	Very high	142 Å²	142	61.7 Å²	61.7	62%	0.617	29%	0.292	S	S	*	.			trans	-67	149.5	173.7	-63.9	-175.4	178.5	-176.3	0	111	G183 D187 R188	G183-K185 PolarHBondContact O-N 2.97Å; K185-D187 WeakPolarHBondContact CB-OD1 3.29Å; K185-D187 PolarHBondContact O-N 2.96Å; K185-R188 HydrophobicContact CB-CG 4.49Å; K185-R188 VanDerWaalsContact O-CB 3.27Å; K185-R188 WeakPolarHBondContact O-CB 3.39Å; K185-R188 WeakPolarHBondContact O-CG 3.24Å; K185-R188 PolarHBondContact O-N 2.84Å
186	P	82.5	Confident	91.6	Very high	74 Å²	74	60.5 Å²	60.5	48%	0.481	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-24.7	-177.8	-24.1	34.5	0	0	0	115.3	R188	P186-R188 PolarHBondContact O-N 3.04Å
187	D	82.1	Confident	91.7	Very high	93 Å²	93	61.9 Å²	61.9	50%	0.497	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-10.9	175.7	65.9	-37	0	0	0	113.1	K185 R189 L268	K185-D187 WeakPolarHBondContact CB-OD1 3.29Å; K185-D187 PolarHBondContact O-N 2.96Å; D187-R189 PolarHBondContact O-N 3.33Å; D187-L268 WeakPolarHBondContact O-CD2 3.21Å
188	R	88.1	Confident	91.8	Very high	153 Å²	153	60.7 Å²	60.7	58%	0.577	29%	0.294	S	S	*	.	S	Bend	trans	-66.7	122.9	171.6	-68.7	-70.3	-166.1	168.2	2.5	109.1	Y184 K185 P186 R190 V191 A192	Y184-R188 HydrophobicContact CD1-CB 4.26Å; Y184-R188 HydrophobicContact CD1-CG 4.14Å; K185-R188 HydrophobicContact CB-CG 4.49Å; K185-R188 VanDerWaalsContact O-CB 3.27Å; K185-R188 WeakPolarHBondContact O-CB 3.39Å; K185-R188 WeakPolarHBondContact O-CG 3.24Å; K185-R188 PolarHBondContact O-N 2.84Å; P186-R188 PolarHBondContact O-N 3.04Å; R188-R190 PolarHBondContact O-N 2.61Å; R188-V191 HydrophobicContact CB-CG2 4.13Å; R188-V191 WeakPolarHBondContact O-CA 3.35Å; R188-V191 WeakPolarHBondContact O-CB 3.32Å; R188-V191 PolarHBondContact O-N 3.3Å; R188-A192 PolarHBondContact O-N 3.04Å
189	R	88.7	Confident	91.9	Very high	82 Å²	82	60 Å²	60	31%	0.309	29%	0.292	S	S	.	.	H	α-helix	trans	-47	-40.5	180	-70.2	170.4	171.7	143	-19.6	114	D187 V191 A192 C193 D273 D277	D187-R189 PolarHBondContact O-N 3.33Å; R189-V191 PolarHBondContact O-N 3.33Å; R189-A192 WeakPolarHBondContact O-CB 3.3Å; R189-A192 PolarHBondContact O-N 3.24Å; R189-C193 PolarHBondContact O-N 3.26Å; R189-C193 PolarHBondContact O-SG 2.82Å; R189-D273 PolarHBondContact NH2-O 3.16Å; R189-D273 VanDerWaalsContact NH2-O 3.15Å; R189-D277 WeakPolarHBondContact CD-OD2 3.19Å; R189-D277 IonicContact CZ-OD1 3.02Å; R189-D277 IonicContact CZ-OD2 2.67Å; R189-D277 IonicContact NE-OD2 3.4Å; R189-D277 PolarHBondContact NE-OD2 3.48Å; R189-D277 IonicContact NH1-OD1 3.62Å; R189-D277 PolarHBondContact NH1-OD1 3.47Å; R189-D277 IonicContact NH1-OD2 2.62Å; R189-D277 PolarHBondContact NH1-OD2 3.28Å; R189-D277 IonicContact NH2-OD1 3.9Å; R189-D277 IonicContact NH2-OD2 3.39Å
190	R	89.7	Confident	92.1	Very high	162 Å²	162	61.8 Å²	61.8	61%	0.611	30%	0.304	S	S	*	.	H	α-helix	trans	-60.6	-43	176.7	-58.4	-175.2	-158.4	-179	6.8	112.7	Y179 R188 A192 V194	Y179-R190 HydrophobicContact CE2-CB 4.42Å; R188-R190 PolarHBondContact O-N 2.61Å; R190-A192 VanDerWaalsContact C-N 3.34Å; R190-V194 PolarHBondContact O-N 3.12Å; R190-V194 VanDerWaalsContact O-N 3.15Å
191	V	92.9	Very high	92.3	Very high	1 Å²	1	61.8 Å²	61.8	1%	0.006	31%	0.306	C	S	.	.	H	α-helix	trans	-67.3	-40.9	177.2	-176.6	0	0	0	0	110.1	Y179 Y184 R188 R189 T195	Y179-V191 HydrophobicContact CD2-CG2 4.05Å; Y179-V191 HydrophobicContact CG-CG2 4.27Å; Y184-V191 HydrophobicContact CG-CG2 4.31Å; R188-V191 HydrophobicContact CB-CG2 4.13Å; R188-V191 WeakPolarHBondContact O-CA 3.35Å; R188-V191 WeakPolarHBondContact O-CB 3.32Å; R188-V191 PolarHBondContact O-N 3.3Å; R189-V191 PolarHBondContact O-N 3.33Å; V191-T195 VanDerWaalsContact O-CB 3.24Å; V191-T195 WeakPolarHBondContact O-CB 3.31Å; V191-T195 PolarHBondContact O-N 3.42Å; V191-T195 PolarHBondContact O-OG1 3.18Å
192	A	94.1	Very high	92.6	Very high	2 Å²	2	60.7 Å²	60.7	2%	0.017	30%	0.299	C	S	.	.	H	α-helix	trans	-63.9	-44.9	176.9	0	0	0	0	0	112.3	R188 R189 R190 V194 T195 L196 A265 L268 L269	R188-A192 PolarHBondContact O-N 3.04Å; R189-A192 WeakPolarHBondContact O-CB 3.3Å; R189-A192 PolarHBondContact O-N 3.24Å; R190-A192 VanDerWaalsContact C-N 3.34Å; A192-V194 PolarHBondContact O-N 3.13Å; A192-T195 PolarHBondContact O-N 2.93Å; A192-L196 WeakPolarHBondContact O-CB 3.43Å; A192-L196 PolarHBondContact O-N 3.02Å; A192-A265 HydrophobicContact CB-CB 4.34Å; A192-L268 HydrophobicContact CB-CD2 3.62Å; A192-L269 HydrophobicContact CB-CD1 4.26Å; A192-L269 HydrophobicContact CB-CD2 3.98Å; A192-L269 HydrophobicContact CB-CG 3.95Å
193	C	95.1	Very high	92.9	Very high	40 Å²	40	60.6 Å²	60.6	27%	0.27	30%	0.298	S	S	.	.	H	α-helix	trans	-57	-52.5	174.9	-69.2	0	0	0	0	111.5	R189 T195 L196 I197 L269	R189-C193 PolarHBondContact O-N 3.26Å; R189-C193 PolarHBondContact O-SG 2.82Å; C193-T195 VanDerWaalsContact C-N 3.29Å; C193-T195 PolarHBondContact O-N 3.08Å; C193-L196 PolarHBondContact O-N 3.25Å; C193-I197 VanDerWaalsContact O-CG1 3.31Å; C193-I197 WeakPolarHBondContact O-CG1 3.43Å; C193-I197 PolarHBondContact O-N 2.9Å; C193-L269 VanDerWaalsContact SG-CD2 3.54Å
194	V	96.1	Very high	93.2	Very high	18 Å²	18	60.9 Å²	60.9	11%	0.109	29%	0.288	C	S	.	.	H	α-helix	trans	-63.3	-37.6	179	172.5	0	0	0	0	111.4	F172 Q175 R176 Y179 R190 A192 I197 F198	F172-V194 HydrophobicContact CB-CG1 4.49Å; F172-V194 WeakPolarHBondContact O-CG1 3.12Å; Q175-V194 HydrophobicContact CB-CG1 3.89Å; Q175-V194 HydrophobicContact CG-CG1 3.93Å; Q175-V194 HydrophobicContact CG-CG2 4.21Å; R176-V194 HydrophobicContact CB-CG1 4.16Å; Y179-V194 HydrophobicContact CD2-CG2 4.44Å; Y179-V194 HydrophobicContact CE2-CB 4.32Å; Y179-V194 HydrophobicContact CE2-CG2 3.7Å; R190-V194 PolarHBondContact O-N 3.12Å; R190-V194 VanDerWaalsContact O-N 3.15Å; A192-V194 PolarHBondContact O-N 3.13Å; V194-I197 PolarHBondContact O-N 3.43Å; V194-F198 VanDerWaalsContact O-CB 3.29Å; V194-F198 WeakPolarHBondContact O-CB 3.45Å; V194-F198 PolarHBondContact O-N 3.16Å
195	T	96	Very high	93.5	Very high	8 Å²	8	57.8 Å²	57.8	5%	0.049	28%	0.277	C	S	.	.	H	α-helix	trans	-63.7	-41.2	175.8	-59.8	0	0	0	0	111.6	R176 V191 A192 C193 A199 L261 A265	R176-T195 VanDerWaalsContact CD-OG1 3.24Å; R176-T195 WeakPolarHBondContact CD-OG1 3.32Å; R176-T195 PolarHBondContact NE-OG1 3.21Å; R176-T195 VanDerWaalsContact NE-OG1 3.1Å; V191-T195 VanDerWaalsContact O-CB 3.24Å; V191-T195 WeakPolarHBondContact O-CB 3.31Å; V191-T195 PolarHBondContact O-N 3.42Å; V191-T195 PolarHBondContact O-OG1 3.18Å; A192-T195 PolarHBondContact O-N 2.93Å; C193-T195 VanDerWaalsContact C-N 3.29Å; C193-T195 PolarHBondContact O-N 3.08Å; T195-A199 WeakPolarHBondContact O-CB 3.5Å; T195-A199 PolarHBondContact O-N 3.47Å; T195-L261 HydrophobicContact CG2-CB 4.21Å; T195-A265 HydrophobicContact CG2-CB 3.97Å
196	L	96.9	Very high	93.8	Very high	48 Å²	48	51.7 Å²	51.7	25%	0.251	25%	0.25	S	S	.	.	H	α-helix	trans	-67.4	-45.9	177.6	-179.1	60.2	0	0	0	111.1	A192 C193 F198 A199 I200 A265 A266 L269	A192-L196 WeakPolarHBondContact O-CB 3.43Å; A192-L196 PolarHBondContact O-N 3.02Å; C193-L196 PolarHBondContact O-N 3.25Å; L196-F198 PolarHBondContact O-N 3.06Å; L196-A199 PolarHBondContact O-N 2.86Å; L196-A199 VanDerWaalsContact O-N 3.17Å; L196-I200 HydrophobicContact CD1-CD1 4.16Å; L196-I200 HydrophobicContact CD1-CG1 4.34Å; L196-I200 HydrophobicContact CG-CD1 3.95Å; L196-I200 WeakPolarHBondContact O-CG1 3.44Å; L196-I200 PolarHBondContact O-N 2.95Å; L196-A265 HydrophobicContact CB-CB 4.24Å; L196-A266 HydrophobicContact CD1-CB 4.08Å; L196-L269 HydrophobicContact CB-CD1 4.08Å; L196-L269 HydrophobicContact CD2-CD1 3.67Å
197	I	97.1	Very high	94.4	Very high	66 Å²	66	50 Å²	50	34%	0.338	24%	0.237	S	C	.	.	H	α-helix	trans	-58.4	-50.3	175.9	-67.1	167.1	0	0	0	110	F172 C193 V194 A199 I200 F201	F172-I197 HydrophobicContact CD1-CB 4.44Å; F172-I197 HydrophobicContact CD1-CG2 3.62Å; F172-I197 HydrophobicContact CD2-CG2 4Å; F172-I197 HydrophobicContact CE1-CG2 3.62Å; F172-I197 HydrophobicContact CE2-CG2 4Å; F172-I197 HydrophobicContact CG-CG2 3.81Å; F172-I197 HydrophobicContact CZ-CG2 3.81Å; C193-I197 VanDerWaalsContact O-CG1 3.31Å; C193-I197 WeakPolarHBondContact O-CG1 3.43Å; C193-I197 PolarHBondContact O-N 2.9Å; V194-I197 PolarHBondContact O-N 3.43Å; I197-A199 VanDerWaalsContact C-N 3.31Å; I197-A199 PolarHBondContact O-N 3.28Å; I197-I200 PolarHBondContact O-N 3.22Å; I197-F201 HydrophobicContact CG2-CD2 3.62Å; I197-F201 HydrophobicContact CG2-CE2 3.71Å; I197-F201 WeakPolarHBondContact O-CD2 3.27Å; I197-F201 PolarHBondContact O-N 3.04Å
198	F	97.2	Very high	95	Very high	14 Å²	14	50.5 Å²	50.5	6%	0.061	24%	0.239	C	C	.	.	H	α-helix	trans	-51.6	-50.4	173.4	160.4	-111.5	0	0	0	111.6	F172 V173 V194 L196 I200 F201 F202 T258	F172-F198 HydrophobicContact CB-CB 3.72Å; V173-F198 HydrophobicContact CB-CD2 3.6Å; V173-F198 HydrophobicContact CB-CE2 3.53Å; V173-F198 HydrophobicContact CB-CG 4.31Å; V173-F198 HydrophobicContact CB-CZ 4.19Å; V173-F198 HydrophobicContact CG2-CD2 4.07Å; V173-F198 HydrophobicContact CG2-CE1 4.28Å; V173-F198 HydrophobicContact CG2-CE2 3.66Å; V173-F198 HydrophobicContact CG2-CZ 3.78Å; V194-F198 VanDerWaalsContact O-CB 3.29Å; V194-F198 WeakPolarHBondContact O-CB 3.45Å; V194-F198 PolarHBondContact O-N 3.16Å; L196-F198 PolarHBondContact O-N 3.06Å; F198-I200 PolarHBondContact O-N 3.43Å; F198-F201 PolarHBondContact O-N 3.02Å; F198-F202 HydrophobicContact CD2-CB 4.48Å; F198-F202 HydrophobicContact CE2-CB 4.06Å; F198-F202 AromaticContact CE2-CD2 3.69Å; F198-F202 HydrophobicContact CE2-CD2 3.69Å; F198-F202 HydrophobicContact CE2-CG 4.24Å; F198-F202 HydrophobicContact CZ-CB 4.32Å; F198-F202 AromaticContact CZ-CD2 3.82Å; F198-F202 HydrophobicContact CZ-CD2 3.82Å; F198-F202 HydrophobicContact CZ-CG 4.25Å; F198-F202 VanDerWaalsContact O-CB 3.23Å; F198-F202 WeakPolarHBondContact O-CB 3.41Å; F198-F202 PolarHBondContact O-N 3.37Å; F198-T258 HydrophobicContact CD1-CG2 4.38Å; F198-T258 HydrophobicContact CE1-CG2 3.74Å; F198-T258 HydrophobicContact CZ-CG2 4.09Å
199	A	97.2	Very high	95.4	Very high	7 Å²	7	45.1 Å²	45.1	6%	0.058	22%	0.221	C	C	.	.	H	α-helix	trans	-62	-42.9	-177.9	0	0	0	0	0	112	T195 L196 I197 F202 I203 T258	T195-A199 WeakPolarHBondContact O-CB 3.5Å; T195-A199 PolarHBondContact O-N 3.47Å; L196-A199 PolarHBondContact O-N 2.86Å; L196-A199 VanDerWaalsContact O-N 3.17Å; I197-A199 VanDerWaalsContact C-N 3.31Å; I197-A199 PolarHBondContact O-N 3.28Å; A199-F202 PolarHBondContact O-N 2.92Å; A199-I203 VanDerWaalsContact O-CG1 3.29Å; A199-I203 WeakPolarHBondContact O-CG1 3.45Å; A199-I203 PolarHBondContact O-N 3.3Å; A199-T258 HydrophobicContact CB-CG2 3.81Å
200	I	97.4	Very high	95.7	Very high	92 Å²	92	42.6 Å²	42.6	47%	0.472	21%	0.213	S	C	.	.	H	α-helix	trans	-60.7	-53.6	176.4	-67.9	165.6	0	0	0	110.3	L196 I197 F198 F202 I203 V204	L196-I200 HydrophobicContact CD1-CD1 4.16Å; L196-I200 HydrophobicContact CD1-CG1 4.34Å; L196-I200 HydrophobicContact CG-CD1 3.95Å; L196-I200 WeakPolarHBondContact O-CG1 3.44Å; L196-I200 PolarHBondContact O-N 2.95Å; I197-I200 PolarHBondContact O-N 3.22Å; F198-I200 PolarHBondContact O-N 3.43Å; I200-F202 VanDerWaalsContact C-N 3.3Å; I200-F202 PolarHBondContact O-N 3.45Å; I200-I203 PolarHBondContact O-N 2.99Å; I200-V204 HydrophobicContact CG2-CG2 4.31Å; I200-V204 WeakPolarHBondContact O-CB 3.39Å; I200-V204 WeakPolarHBondContact O-CG2 3.43Å; I200-V204 PolarHBondContact O-N 2.83Å
201	F	96.6	Very high	95.9	Very high	74 Å²	74	40.6 Å²	40.6	33%	0.325	21%	0.214	S	C	.	.	H	α-helix	trans	-60.3	-40.4	179.3	-85.8	-81.3	0	0	0	111.8	L168 F172 I197 F198 T205	L168-F201 HydrophobicContact CB-CD1 4.04Å; L168-F201 HydrophobicContact CB-CE1 4.44Å; F172-F201 AromaticContact CD2-CD2 4Å; F172-F201 HydrophobicContact CD2-CD2 4Å; F172-F201 HydrophobicContact CD2-CE2 4.47Å; F172-F201 HydrophobicContact CD2-CG 4.39Å; F172-F201 AromaticContact CE2-CD2 3.69Å; F172-F201 HydrophobicContact CE2-CD2 3.69Å; F172-F201 AromaticContact CE2-CE2 3.73Å; F172-F201 HydrophobicContact CE2-CE2 3.73Å; F172-F201 HydrophobicContact CE2-CG 4.21Å; F172-F201 HydrophobicContact CE2-CZ 4.27Å; F172-F201 HydrophobicContact CZ-CD2 4.42Å; F172-F201 HydrophobicContact CZ-CE2 4.1Å; I197-F201 HydrophobicContact CG2-CD2 3.62Å; I197-F201 HydrophobicContact CG2-CE2 3.71Å; I197-F201 WeakPolarHBondContact O-CD2 3.27Å; I197-F201 PolarHBondContact O-N 3.04Å; F198-F201 PolarHBondContact O-N 3.02Å; F201-T205 HydrophobicContact CD1-CG2 4.48Å; F201-T205 WeakPolarHBondContact O-CB 3.34Å; F201-T205 WeakPolarHBondContact O-CG2 3.32Å; F201-T205 PolarHBondContact O-N 3.28Å; F201-T205 PolarHBondContact O-OG1 3.42Å
202	F	96.8	Very high	96.1	Very high	10 Å²	10	43.1 Å²	43.1	4%	0.044	23%	0.231	C	C	.	.	H	α-helix	trans	-62.4	-47.8	177.6	-170.1	-80.3	0	0	0	111.5	F198 A199 I200 R206 N207 W254 A255 T258	F198-F202 HydrophobicContact CD2-CB 4.48Å; F198-F202 HydrophobicContact CE2-CB 4.06Å; F198-F202 AromaticContact CE2-CD2 3.69Å; F198-F202 HydrophobicContact CE2-CD2 3.69Å; F198-F202 HydrophobicContact CE2-CG 4.24Å; F198-F202 HydrophobicContact CZ-CB 4.32Å; F198-F202 AromaticContact CZ-CD2 3.82Å; F198-F202 HydrophobicContact CZ-CD2 3.82Å; F198-F202 HydrophobicContact CZ-CG 4.25Å; F198-F202 VanDerWaalsContact O-CB 3.23Å; F198-F202 WeakPolarHBondContact O-CB 3.41Å; F198-F202 PolarHBondContact O-N 3.37Å; A199-F202 PolarHBondContact O-N 2.92Å; I200-F202 VanDerWaalsContact C-N 3.3Å; I200-F202 PolarHBondContact O-N 3.45Å; F202-R206 VanDerWaalsContact CD2-CD 3.41Å; F202-R206 HydrophobicContact CE1-CB 4.45Å; F202-R206 WeakPolarHBondContact O-CA 3.31Å; F202-R206 WeakPolarHBondContact O-CB 3.5Å; F202-R206 PolarHBondContact O-N 3.18Å; F202-N207 PolarHBondContact O-ND2 3.19Å; F202-W254 HydrophobicContact CE1-CB 4.2Å; F202-W254 HydrophobicContact CE2-CB 4.35Å; F202-W254 HydrophobicContact CZ-CB 3.54Å; F202-W254 HydrophobicContact CZ-CE3 4.33Å; F202-A255 HydrophobicContact CE1-CB 4.15Å; F202-T258 HydrophobicContact CB-CG2 3.87Å; F202-T258 HydrophobicContact CD1-CG2 3.88Å; F202-T258 HydrophobicContact CG-CG2 3.9Å
203	I	97.3	Very high	96.2	Very high	55 Å²	55	43.1 Å²	43.1	28%	0.282	23%	0.23	S	C	.	.	H	α-helix	trans	-67.3	-45.8	-179.9	-64.2	-57.8	0	0	0	111.1	A199 I200 N207 L208 A255 C259	A199-I203 VanDerWaalsContact O-CG1 3.29Å; A199-I203 WeakPolarHBondContact O-CG1 3.45Å; A199-I203 PolarHBondContact O-N 3.3Å; I200-I203 PolarHBondContact O-N 2.99Å; I203-N207 WeakPolarHBondContact O-CA 3.35Å; I203-N207 VanDerWaalsContact O-CB 3.32Å; I203-N207 WeakPolarHBondContact O-CB 3.32Å; I203-N207 PolarHBondContact O-N 3.42Å; I203-L208 PolarHBondContact O-N 3.47Å; I203-A255 HydrophobicContact CD1-CB 4.09Å; I203-C259 WeakPolarHBondContact CD1-SG 3.45Å
204	V	96.8	Very high	96.2	Very high	63 Å²	63	45.3 Å²	45.3	38%	0.382	23%	0.233	S	C	.	.	I	π-helix	trans	-62.5	-56.1	179.2	173.3	0	0	0	0	110.8	I200 L208 M209	I200-V204 HydrophobicContact CG2-CG2 4.31Å; I200-V204 WeakPolarHBondContact O-CB 3.39Å; I200-V204 WeakPolarHBondContact O-CG2 3.43Å; I200-V204 PolarHBondContact O-N 2.83Å; V204-L208 PolarHBondContact O-N 2.95Å; V204-M209 WeakPolarHBondContact O-CB 3.21Å; V204-M209 VanDerWaalsContact O-CG 3.31Å; V204-M209 WeakPolarHBondContact O-CG 3.38Å; V204-M209 PolarHBondContact O-N 3.22Å
205	T	95.8	Very high	96.2	Very high	9 Å²	9	50.6 Å²	50.6	6%	0.055	25%	0.254	C	S	.	.	I	π-helix	trans	-77.6	-30.7	-170.7	63.9	0	0	0	0	114.1	T166 L168 F201 M209	T166-T205 WeakPolarHBondContact CG2-O 3.05Å; L168-T205 HydrophobicContact CB-CG2 4.25Å; L168-T205 HydrophobicContact CD1-CG2 4.17Å; F201-T205 HydrophobicContact CD1-CG2 4.48Å; F201-T205 WeakPolarHBondContact O-CB 3.34Å; F201-T205 WeakPolarHBondContact O-CG2 3.32Å; F201-T205 PolarHBondContact O-N 3.28Å; F201-T205 PolarHBondContact O-OG1 3.42Å; T205-M209 HydrophobicContact CG2-SD 4.19Å
206	R	95.4	Very high	96.2	Very high	15 Å²	15	51.6 Å²	51.6	6%	0.057	26%	0.259	C	S	.	.	I	π-helix	trans	-106.9	-13.1	-174.6	-62.4	167.2	176.7	-103.3	-1.9	114.8	T166 S169 F202 I210 N251	T166-R206 HydrophobicContact CG2-CB 4.39Å; T166-R206 HydrophobicContact CG2-CG 3.58Å; T166-R206 PolarHBondContact O-NE 2.77Å; T166-R206 PolarHBondContact O-NH2 3.05Å; S169-R206 PolarHBondContact OG-NE 2.89Å; S169-R206 VanDerWaalsContact OG-NE 3.08Å; F202-R206 VanDerWaalsContact CD2-CD 3.41Å; F202-R206 HydrophobicContact CE1-CB 4.45Å; F202-R206 WeakPolarHBondContact O-CA 3.31Å; F202-R206 WeakPolarHBondContact O-CB 3.5Å; F202-R206 PolarHBondContact O-N 3.18Å; R206-I210 WeakPolarHBondContact O-CD1 3.34Å; R206-I210 WeakPolarHBondContact O-CG1 3.41Å; R206-N251 HydrophobicContact CB-CB 4.15Å; R206-N251 WeakPolarHBondContact CD-OD1 3.16Å; R206-N251 PolarHBondContact NH1-OD1 3.19Å
207	N	95.1	Very high	96.1	Very high	37 Å²	37	49.8 Å²	49.8	20%	0.198	25%	0.251	C	S	.	.	I	π-helix	trans	-123.7	-48.3	-178.2	-64.1	-94.9	0	0	0	112.2	F202 I203 I210 A255	F202-N207 PolarHBondContact O-ND2 3.19Å; I203-N207 WeakPolarHBondContact O-CA 3.35Å; I203-N207 VanDerWaalsContact O-CB 3.32Å; I203-N207 WeakPolarHBondContact O-CB 3.32Å; I203-N207 PolarHBondContact O-N 3.42Å; N207-I210 WeakPolarHBondContact O-CB 3.08Å; N207-A255 WeakPolarHBondContact OD1-CB 3.2Å
208	L	95.7	Very high	95.9	Very high	104 Å²	104	55.3 Å²	55.3	55%	0.545	27%	0.269	S	S	.	.	I	π-helix	trans	-72.1	-44.1	178.8	-175.7	62	0	0	0	111.5	I203 V204 I210 L211 P212	I203-L208 PolarHBondContact O-N 3.47Å; V204-L208 PolarHBondContact O-N 2.95Å; L208-I210 PolarHBondContact O-N 2.72Å; L208-I210 VanDerWaalsContact O-N 3.15Å; L208-L211 HydrophobicContact CD1-CD1 4.42Å; L208-L211 PolarHBondContact O-N 3.11Å; L208-P212 WeakPolarHBondContact O-CD 3.28Å
209	M	95.2	Very high	95.8	Very high	41 Å²	41	58.9 Å²	58.9	20%	0.202	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-9.2	179.4	-76.8	178.6	68.3	0	0	114.3	Y162 T165 V204 T205 L211 P212 F213	Y162-M209 HydrophobicContact CD1-CE 4.29Å; Y162-M209 HydrophobicContact CD2-CE 4.45Å; Y162-M209 HydrophobicContact CE1-CB 4.05Å; Y162-M209 HydrophobicContact CE1-CE 3.64Å; Y162-M209 WeakPolarHBondContact CE1-O 3.21Å; Y162-M209 HydrophobicContact CE2-CE 3.81Å; Y162-M209 WeakPolarHBondContact OH-CE 3.46Å; Y162-M209 PolarHBondContact OH-O 3.11Å; T165-M209 WeakPolarHBondContact OG1-CE 3.21Å; V204-M209 WeakPolarHBondContact O-CB 3.21Å; V204-M209 VanDerWaalsContact O-CG 3.31Å; V204-M209 WeakPolarHBondContact O-CG 3.38Å; V204-M209 PolarHBondContact O-N 3.22Å; T205-M209 HydrophobicContact CG2-SD 4.19Å; M209-L211 VanDerWaalsContact C-N 3.26Å; M209-L211 PolarHBondContact O-N 3.43Å; M209-P212 WeakPolarHBondContact O-CG 3.42Å; M209-F213 WeakPolarHBondContact O-CB 3.45Å; M209-F213 PolarHBondContact O-N 3.03Å
210	I	94.8	Very high	95.5	Very high	28 Å²	28	58.6 Å²	58.6	14%	0.144	29%	0.286	C	S	.	.	H	α-helix	trans	-60.8	-38	170.7	-68.1	-178.9	0	0	0	110.5	R206 N207 L208 F213 W214 D248	R206-I210 WeakPolarHBondContact O-CD1 3.34Å; R206-I210 WeakPolarHBondContact O-CG1 3.41Å; N207-I210 WeakPolarHBondContact O-CB 3.08Å; L208-I210 PolarHBondContact O-N 2.72Å; L208-I210 VanDerWaalsContact O-N 3.15Å; I210-F213 WeakPolarHBondContact O-CB 3.1Å; I210-F213 PolarHBondContact O-N 3.09Å; I210-W214 VanDerWaalsContact CG2-CD1 3.41Å; I210-W214 VanDerWaalsContact O-CD1 3.25Å; I210-W214 PolarHBondContact O-N 3.09Å; I210-D248 HydrophobicContact CD1-CB 4.27Å; I210-D248 WeakPolarHBondContact CD1-OD1 3.41Å; I210-D248 WeakPolarHBondContact CG1-OD1 3.09Å
211	L	95.3	Very high	95.2	Very high	121 Å²	121	61.2 Å²	61.2	63%	0.634	29%	0.29	S	S	*	.	H	α-helix	trans	-61.9	-59.1	-177.4	-60.5	176.8	0	0	0	112.9	L208 M209 F213 W214 F215	L208-L211 HydrophobicContact CD1-CD1 4.42Å; L208-L211 PolarHBondContact O-N 3.11Å; M209-L211 VanDerWaalsContact C-N 3.26Å; M209-L211 PolarHBondContact O-N 3.43Å; L211-F213 VanDerWaalsContact C-N 3.26Å; L211-F213 PolarHBondContact O-N 3.28Å; L211-W214 PolarHBondContact O-N 3.29Å; L211-F215 WeakPolarHBondContact O-CB 3.47Å; L211-F215 PolarHBondContact O-N 3.1Å
212	P	95.5	Very high	94.9	Very high	54 Å²	54	60 Å²	60	35%	0.351	30%	0.299	S	S	.	.	H	α-helix	trans	-61.7	-31.2	175	24.1	-35.8	0	0	0	113	Y162 L208 M209 F215 M216	Y162-P212 WeakPolarHBondContact OH-CG 3.49Å; L208-P212 WeakPolarHBondContact O-CD 3.28Å; M209-P212 WeakPolarHBondContact O-CG 3.42Å; P212-F215 PolarHBondContact O-N 3.43Å; P212-M216 WeakPolarHBondContact O-CB 3.25Å; P212-M216 VanDerWaalsContact O-CG 3.27Å; P212-M216 WeakPolarHBondContact O-CG 3.37Å; P212-M216 PolarHBondContact O-N 3.47Å
213	F	96.3	Very high	94.5	Very high	2 Å²	2	61.4 Å²	61.4	1%	0.009	31%	0.31	C	S	.	.	H	α-helix	trans	-59.5	-52.5	175.8	176	-89.4	0	0	0	111.8	F159 Y162 R163 M209 I210 L211 M216 A217 F240 C244	F159-F213 HydrophobicContact CB-CE2 3.93Å; F159-F213 HydrophobicContact CB-CZ 4.33Å; F159-F213 HydrophobicContact CD1-CD2 4.09Å; F159-F213 AromaticContact CD1-CE2 3.65Å; F159-F213 HydrophobicContact CD1-CE2 3.65Å; F159-F213 AromaticContact CD1-CZ 3.99Å; F159-F213 HydrophobicContact CD1-CZ 3.99Å; F159-F213 HydrophobicContact CG-CE2 4.28Å; Y162-F213 HydrophobicContact CD1-CB 4.09Å; Y162-F213 AromaticContact CD1-CD2 3.71Å; Y162-F213 HydrophobicContact CD1-CD2 3.71Å; Y162-F213 HydrophobicContact CD1-CG 4.39Å; Y162-F213 HydrophobicContact CE1-CB 3.81Å; Y162-F213 HydrophobicContact CE1-CD2 4.31Å; Y162-F213 HydrophobicContact CG-CD2 4.48Å; R163-F213 HydrophobicContact CB-CE2 4.26Å; M209-F213 WeakPolarHBondContact O-CB 3.45Å; M209-F213 PolarHBondContact O-N 3.03Å; I210-F213 WeakPolarHBondContact O-CB 3.1Å; I210-F213 PolarHBondContact O-N 3.09Å; L211-F213 VanDerWaalsContact C-N 3.26Å; L211-F213 PolarHBondContact O-N 3.28Å; F213-M216 PolarHBondContact O-N 3.15Å; F213-A217 WeakPolarHBondContact O-CB 3.49Å; F213-A217 PolarHBondContact O-N 3.16Å; F213-F240 HydrophobicContact CE1-CE1 4.44Å; F213-F240 AromaticContact CE1-CZ 3.88Å; F213-F240 HydrophobicContact CE1-CZ 3.88Å; F213-F240 AromaticContact CZ-CE2 4Å; F213-F240 HydrophobicContact CZ-CE2 4Å; F213-F240 AromaticContact CZ-CZ 3.62Å; F213-F240 HydrophobicContact CZ-CZ 3.62Å; F213-C244 HydrophobicContact CE1-CB 4.27Å; F213-C244 HydrophobicContact CZ-CB 4.44Å
214	W	96.1	Very high	94	Very high	86 Å²	86	64.1 Å²	64.1	33%	0.326	33%	0.325	S	S	.	.	H	α-helix	trans	-72.5	-29.9	-179.6	-74.3	107	0	0	0	112.7	I210 L211 A217 Y218 F240 C244 D248	I210-W214 VanDerWaalsContact CG2-CD1 3.41Å; I210-W214 VanDerWaalsContact O-CD1 3.25Å; I210-W214 PolarHBondContact O-N 3.09Å; L211-W214 PolarHBondContact O-N 3.29Å; W214-A217 HydrophobicContact CE3-CB 4.26Å; W214-A217 PolarHBondContact O-N 3.01Å; W214-Y218 WeakPolarHBondContact O-CB 3.46Å; W214-Y218 PolarHBondContact O-N 3.17Å; W214-F240 HydrophobicContact CH2-CE1 4.4Å; W214-F240 HydrophobicContact CZ3-CE1 4.06Å; W214-C244 HydrophobicContact CH2-CB 4.08Å; W214-C244 HydrophobicContact CZ2-CB 3.91Å; W214-D248 WeakPolarHBondContact CZ2-OD2 3.36Å; W214-D248 PolarHBondContact NE1-OD2 3.32Å
215	F	95.6	Very high	93.4	Very high	128 Å²	128	62.2 Å²	62.2	56%	0.561	32%	0.316	S	S	*	.	H	α-helix	trans	-61.2	-48.4	170.3	178.7	-104.5	0	0	0	111.7	L211 P212 A217 Y218 I219	L211-F215 WeakPolarHBondContact O-CB 3.47Å; L211-F215 PolarHBondContact O-N 3.1Å; P212-F215 PolarHBondContact O-N 3.43Å; F215-A217 VanDerWaalsContact C-N 3.32Å; F215-A217 PolarHBondContact O-N 3.36Å; F215-Y218 PolarHBondContact O-N 2.85Å; F215-I219 HydrophobicContact CD1-CD1 3.9Å; F215-I219 HydrophobicContact CE1-CD1 3.34Å; F215-I219 HydrophobicContact CE2-CD1 4.09Å; F215-I219 HydrophobicContact CG-CD1 4.5Å; F215-I219 HydrophobicContact CZ-CD1 3.46Å; F215-I219 VanDerWaalsContact CZ-CD1 3.46Å; F215-I219 HydrophobicContact CZ-CG1 4.43Å; F215-I219 PolarHBondContact O-N 3.38Å
216	M	95	Very high	93	Very high	29 Å²	29	62.4 Å²	62.4	14%	0.143	32%	0.316	C	S	.	.	H	α-helix	trans	-64	-37.6	175.4	-70	-60	-68.8	0	0	111.7	W95 P98 F158 F159 P212 F213 I219 S220	W95-M216 WeakPolarHBondContact O-CE 3.48Å; P98-M216 HydrophobicContact CB-CE 4.34Å; P98-M216 HydrophobicContact CG-CE 4.06Å; F158-M216 HydrophobicContact CE1-CB 3.8Å; F158-M216 HydrophobicContact CE1-CE 4.44Å; F158-M216 HydrophobicContact CE1-CG 4.03Å; F158-M216 HydrophobicContact CZ-CB 4.32Å; F158-M216 HydrophobicContact CZ-CE 4.33Å; F158-M216 HydrophobicContact CZ-CG 4.03Å; F159-M216 HydrophobicContact CE1-CB 4.17Å; P212-M216 WeakPolarHBondContact O-CB 3.25Å; P212-M216 VanDerWaalsContact O-CG 3.27Å; P212-M216 WeakPolarHBondContact O-CG 3.37Å; P212-M216 PolarHBondContact O-N 3.47Å; F213-M216 PolarHBondContact O-N 3.15Å; M216-I219 PolarHBondContact O-N 3.49Å; M216-S220 VanDerWaalsContact O-CB 3.29Å; M216-S220 WeakPolarHBondContact O-CB 3.43Å; M216-S220 PolarHBondContact O-N 2.86Å; M216-S220 PolarHBondContact O-OG 2.89Å
217	A	95	Very high	92.7	Very high	11 Å²	11	66.8 Å²	66.8	9%	0.091	34%	0.335	C	S	.	.	H	α-helix	trans	-63	-42.3	175	0	0	0	0	0	111.8	F159 F213 W214 F215 S220 Y221 F240	F159-A217 HydrophobicContact CE1-CB 3.76Å; F159-A217 HydrophobicContact CZ-CB 4.14Å; F213-A217 WeakPolarHBondContact O-CB 3.49Å; F213-A217 PolarHBondContact O-N 3.16Å; W214-A217 HydrophobicContact CE3-CB 4.26Å; W214-A217 PolarHBondContact O-N 3.01Å; F215-A217 VanDerWaalsContact C-N 3.32Å; F215-A217 PolarHBondContact O-N 3.36Å; A217-S220 PolarHBondContact O-N 2.92Å; A217-Y221 WeakPolarHBondContact O-CB 3.47Å; A217-Y221 PolarHBondContact O-N 3Å; A217-F240 HydrophobicContact CB-CE1 4.2Å; A217-F240 HydrophobicContact CB-CZ 4.06Å
218	Y	94.5	Very high	92.2	Very high	182 Å²	182	68.2 Å²	68.2	71%	0.714	34%	0.342	S	S	*	.	H	α-helix	trans	-63.2	-46.6	177.1	176.7	-101.9	0	0	0	112.3	W214 F215 S220 Y221	W214-Y218 WeakPolarHBondContact O-CB 3.46Å; W214-Y218 PolarHBondContact O-N 3.17Å; F215-Y218 PolarHBondContact O-N 2.85Å; Y218-S220 VanDerWaalsContact C-N 3.33Å; Y218-S220 PolarHBondContact O-N 3.07Å; Y218-Y221 WeakPolarHBondContact O-CB 3.02Å; Y218-Y221 PolarHBondContact O-N 2.91Å
219	I	93.5	Very high	91.7	Very high	88 Å²	88	63.4 Å²	63.4	45%	0.451	32%	0.317	S	S	.	.	H	α-helix	trans	-61.2	-45.3	175	-67.9	172.9	0	0	0	110.5	F215 M216 Y221 G222	F215-I219 HydrophobicContact CD1-CD1 3.9Å; F215-I219 HydrophobicContact CE1-CD1 3.34Å; F215-I219 HydrophobicContact CE2-CD1 4.09Å; F215-I219 HydrophobicContact CG-CD1 4.5Å; F215-I219 HydrophobicContact CZ-CD1 3.46Å; F215-I219 VanDerWaalsContact CZ-CD1 3.46Å; F215-I219 HydrophobicContact CZ-CG1 4.43Å; F215-I219 PolarHBondContact O-N 3.38Å; M216-I219 PolarHBondContact O-N 3.49Å; I219-Y221 VanDerWaalsContact C-N 3.3Å; I219-Y221 PolarHBondContact O-N 3.32Å; I219-G222 PolarHBondContact O-N 3.28Å
220	S	92	Very high	91.3	Very high	2 Å²	2	63.2 Å²	63.2	1%	0.014	32%	0.319	C	S	.	.	H	α-helix	trans	-62.7	-38.6	-179.4	-57.5	0	0	0	0	112	P98 F159 M216 A217 Y218 G222 S223 Y226	P98-S220 WeakPolarHBondContact CG-OG 3.29Å; F159-S220 WeakPolarHBondContact CZ-OG 3.44Å; M216-S220 VanDerWaalsContact O-CB 3.29Å; M216-S220 WeakPolarHBondContact O-CB 3.43Å; M216-S220 PolarHBondContact O-N 2.86Å; M216-S220 PolarHBondContact O-OG 2.89Å; A217-S220 PolarHBondContact O-N 2.92Å; Y218-S220 VanDerWaalsContact C-N 3.33Å; Y218-S220 PolarHBondContact O-N 3.07Å; S220-G222 PolarHBondContact O-N 3.39Å; S220-S223 WeakPolarHBondContact O-CB 3.35Å; S220-S223 PolarHBondContact O-N 3Å; S220-S223 PolarHBondContact O-OG 3.39Å; S220-Y226 WeakPolarHBondContact O-CB 3.21Å
221	Y	91.1	Very high	91	Very high	146 Å²	146	71.8 Å²	71.8	57%	0.573	35%	0.349	S	S	*	.	H	α-helix	trans	-56.8	-32.6	178.4	-173.3	-95.1	0	0	0	112.6	A217 Y218 I219 Y226	A217-Y221 WeakPolarHBondContact O-CB 3.47Å; A217-Y221 PolarHBondContact O-N 3Å; Y218-Y221 WeakPolarHBondContact O-CB 3.02Å; Y218-Y221 PolarHBondContact O-N 2.91Å; I219-Y221 VanDerWaalsContact C-N 3.3Å; I219-Y221 PolarHBondContact O-N 3.32Å; Y221-Y226 HydrophobicContact CD2-CD1 4.05Å; Y221-Y226 AromaticContact CD2-CE1 3.35Å; Y221-Y226 HydrophobicContact CD2-CE1 3.35Å; Y221-Y226 AromaticContact CD2-CZ 3.96Å; Y221-Y226 AromaticContact CE2-CE1 3.87Å; Y221-Y226 HydrophobicContact CE2-CE1 3.87Å; Y221-Y226 HydrophobicContact CG-CE1 4.2Å
222	G	89	Confident	90.3	Very high	49 Å²	49	71.2 Å²	71.2	51%	0.505	34%	0.339	S	S	.	.	H	α-helix	trans	-79.2	-16.1	176.2	0	0	0	0	0	115.1	I219 S220 K227	I219-G222 PolarHBondContact O-N 3.28Å; S220-G222 PolarHBondContact O-N 3.39Å; G222-K227 WeakPolarHBondContact O-CE 3.43Å; G222-K227 PolarHBondContact O-NZ 3.39Å
223	S	88.7	Confident	90	Very high	40 Å²	40	69.5 Å²	69.5	28%	0.28	33%	0.327	S	S	.	.	S	Bend	trans	-72.1	147	-175.9	73.8	0	0	0	0	112.7	S220 A225 Y226 K227	S220-S223 WeakPolarHBondContact O-CB 3.35Å; S220-S223 PolarHBondContact O-N 3Å; S220-S223 PolarHBondContact O-OG 3.39Å; S223-A225 VanDerWaalsContact C-N 3.28Å; S223-A225 PolarHBondContact O-N 3.48Å; S223-Y226 PolarHBondContact O-N 2.91Å; S223-Y226 WeakPolarHBondContact OG-CB 3.1Å; S223-Y226 PolarHBondContact OG-N 3.12Å; S223-K227 WeakPolarHBondContact O-CG 3.18Å; S223-K227 PolarHBondContact O-N 3.04Å; S223-K227 VanDerWaalsContact O-N 3.16Å
224	D	87.4	Confident	89.5	Confident	111 Å²	111	73.9 Å²	73.9	59%	0.594	36%	0.356	S	S	*	.	H	α-helix	trans	-65.2	-35.9	177.3	-65.4	-29.4	0	0	0	111.8	Y226 K227 I228	D224-Y226 VanDerWaalsContact C-N 3.33Å; D224-Y226 PolarHBondContact O-N 3.19Å; D224-K227 PolarHBondContact O-N 3.29Å; D224-K227 IonicContact OD1-NZ 3.45Å; D224-K227 PolarHBondContact OD1-NZ 3.47Å; D224-I228 VanDerWaalsContact O-CG1 3.23Å; D224-I228 WeakPolarHBondContact O-CG1 3.48Å; D224-I228 PolarHBondContact O-N 3.11Å
225	A	85.1	Confident	89.3	Confident	23 Å²	23	74.3 Å²	74.3	19%	0.19	36%	0.364	C	S	.	.	H	α-helix	trans	-55	-46.8	173.3	0	0	0	0	0	112	A99 I100 S223 I228 C229	A99-A225 HydrophobicContact CB-CB 4.49Å; I100-A225 HydrophobicContact CD1-CB 4.11Å; I100-A225 HydrophobicContact CG1-CB 4.33Å; I100-A225 HydrophobicContact CG2-CB 3.87Å; S223-A225 VanDerWaalsContact C-N 3.28Å; S223-A225 PolarHBondContact O-N 3.48Å; A225-I228 PolarHBondContact O-N 3.19Å; A225-C229 PolarHBondContact O-N 3.29Å; A225-C229 PolarHBondContact O-SG 2.94Å
226	Y	87.3	Confident	89	Confident	14 Å²	14	68.8 Å²	68.8	6%	0.055	34%	0.34	C	S	.	.	H	α-helix	trans	-65.8	-41.8	177.6	-171.5	-89.9	0	0	0	112.3	A99 S220 Y221 S223 D224 I228 C229 T230 V237	A99-Y226 HydrophobicContact CB-CD2 4.26Å; S220-Y226 WeakPolarHBondContact O-CB 3.21Å; Y221-Y226 HydrophobicContact CD2-CD1 4.05Å; Y221-Y226 AromaticContact CD2-CE1 3.35Å; Y221-Y226 HydrophobicContact CD2-CE1 3.35Å; Y221-Y226 AromaticContact CD2-CZ 3.96Å; Y221-Y226 AromaticContact CE2-CE1 3.87Å; Y221-Y226 HydrophobicContact CE2-CE1 3.87Å; Y221-Y226 HydrophobicContact CG-CE1 4.2Å; S223-Y226 PolarHBondContact O-N 2.91Å; S223-Y226 WeakPolarHBondContact OG-CB 3.1Å; S223-Y226 PolarHBondContact OG-N 3.12Å; D224-Y226 VanDerWaalsContact C-N 3.33Å; D224-Y226 PolarHBondContact O-N 3.19Å; Y226-I228 VanDerWaalsContact C-N 3.28Å; Y226-I228 PolarHBondContact O-N 3.38Å; Y226-C229 WeakPolarHBondContact O-CB 3.42Å; Y226-C229 PolarHBondContact O-N 3.43Å; Y226-C229 VanDerWaalsContact O-N 3.13Å; Y226-T230 HydrophobicContact CD1-CG2 3.73Å; Y226-T230 HydrophobicContact CE1-CG2 3.37Å; Y226-T230 WeakPolarHBondContact O-CG2 3.36Å; Y226-T230 PolarHBondContact O-N 2.87Å; Y226-T230 PolarHBondContact O-OG1 3.43Å; Y226-V237 HydrophobicContact CE1-CG2 4.34Å
227	K	87.9	Confident	88.8	Confident	107 Å²	107	69.3 Å²	69.3	47%	0.465	34%	0.344	S	S	.	.	H	α-helix	trans	-60.4	-37.8	175.9	-64.6	172.4	-159.2	152.2	0	112.2	G222 S223 D224 T230 R231	G222-K227 WeakPolarHBondContact O-CE 3.43Å; G222-K227 PolarHBondContact O-NZ 3.39Å; S223-K227 WeakPolarHBondContact O-CG 3.18Å; S223-K227 PolarHBondContact O-N 3.04Å; S223-K227 VanDerWaalsContact O-N 3.16Å; D224-K227 PolarHBondContact O-N 3.29Å; D224-K227 IonicContact OD1-NZ 3.45Å; D224-K227 PolarHBondContact OD1-NZ 3.47Å; K227-T230 PolarHBondContact O-OG1 3.36Å; K227-R231 PolarHBondContact O-N 2.89Å; K227-R231 VanDerWaalsContact O-N 3.15Å
228	I	85.1	Confident	88.8	Confident	67 Å²	67	72 Å²	72	34%	0.344	36%	0.361	S	S	.	.	H	α-helix	trans	-65.3	-47.9	174.1	-63.4	166.4	0	0	0	109.1	F14 D224 A225 Y226 T230 R231 Y232	F14-I228 HydrophobicContact CE1-CB 4.38Å; F14-I228 HydrophobicContact CE1-CG2 4.04Å; F14-I228 HydrophobicContact CE2-CG2 3.75Å; F14-I228 HydrophobicContact CZ-CB 3.83Å; F14-I228 HydrophobicContact CZ-CG2 3.28Å; D224-I228 VanDerWaalsContact O-CG1 3.23Å; D224-I228 WeakPolarHBondContact O-CG1 3.48Å; D224-I228 PolarHBondContact O-N 3.11Å; A225-I228 PolarHBondContact O-N 3.19Å; Y226-I228 VanDerWaalsContact C-N 3.28Å; Y226-I228 PolarHBondContact O-N 3.38Å; I228-T230 VanDerWaalsContact C-N 3.34Å; I228-T230 PolarHBondContact O-N 2.97Å; I228-R231 PolarHBondContact O-N 3.17Å; I228-Y232 HydrophobicContact CG2-CD2 3.84Å; I228-Y232 HydrophobicContact CG2-CE2 3.64Å; I228-Y232 WeakPolarHBondContact O-CD2 3.45Å; I228-Y232 PolarHBondContact O-N 3.17Å
229	C	85.1	Confident	88.8	Confident	3 Å²	3	64.4 Å²	64.4	2%	0.02	33%	0.333	C	S	.	.	H	α-helix	trans	-56.9	-44	177.4	-66	0	0	0	0	112.7	F14 T155 A225 Y226 R231 Y232 I233	F14-C229 VanDerWaalsContact CZ-SG 3.51Å; T155-C229 PolarHBondContact OG1-SG 3.44Å; A225-C229 PolarHBondContact O-N 3.29Å; A225-C229 PolarHBondContact O-SG 2.94Å; Y226-C229 WeakPolarHBondContact O-CB 3.42Å; Y226-C229 PolarHBondContact O-N 3.43Å; Y226-C229 VanDerWaalsContact O-N 3.13Å; C229-R231 VanDerWaalsContact C-N 3.34Å; C229-R231 PolarHBondContact O-N 2.79Å; C229-Y232 PolarHBondContact O-N 3.14Å; C229-I233 WeakPolarHBondContact O-CA 3.27Å; C229-I233 WeakPolarHBondContact O-CB 3.43Å; C229-I233 PolarHBondContact O-N 3.36Å
230	T	87.9	Confident	88.8	Confident	37 Å²	37	61.6 Å²	61.6	23%	0.227	32%	0.318	C	S	.	.	H	α-helix	trans	-70.2	-29.8	-179.4	58.8	0	0	0	0	113.1	Y226 K227 I228 I233 P234 I236 V237	Y226-T230 HydrophobicContact CD1-CG2 3.73Å; Y226-T230 HydrophobicContact CE1-CG2 3.37Å; Y226-T230 WeakPolarHBondContact O-CG2 3.36Å; Y226-T230 PolarHBondContact O-N 2.87Å; Y226-T230 PolarHBondContact O-OG1 3.43Å; K227-T230 PolarHBondContact O-OG1 3.36Å; I228-T230 VanDerWaalsContact C-N 3.34Å; I228-T230 PolarHBondContact O-N 2.97Å; T230-I233 CarbonylContact O-C 3.32Å; T230-P234 VanDerWaalsContact O-CA 3.25Å; T230-P234 WeakPolarHBondContact O-CA 3.45Å; T230-I236 HydrophobicContact CG2-CG2 3.87Å; T230-V237 HydrophobicContact CG2-CG2 3.28Å
231	R	87.4	Confident	88.9	Confident	207 Å²	207	65 Å²	65	78%	0.781	34%	0.339	S	S	*	.	H	α-helix	trans	-65	-41.1	174.6	-172.3	176.7	-177.7	171.4	-0.1	112.1	K227 I228 C229	K227-R231 PolarHBondContact O-N 2.89Å; K227-R231 VanDerWaalsContact O-N 3.15Å; I228-R231 PolarHBondContact O-N 3.17Å; C229-R231 VanDerWaalsContact C-N 3.34Å; C229-R231 PolarHBondContact O-N 2.79Å
232	Y	81.9	Confident	89.1	Confident	110 Å²	110	64 Å²	64	43%	0.431	34%	0.343	S	S	.	.	H	α-helix	trans	-88.6	-26.6	-178.7	-67.2	-69.4	0	0	0	113.7	A10 I228 C229 P234	A10-Y232 HydrophobicContact CB-CD1 3.25Å; A10-Y232 HydrophobicContact CB-CD2 4Å; A10-Y232 HydrophobicContact CB-CE1 3.52Å; A10-Y232 HydrophobicContact CB-CE2 4.25Å; A10-Y232 HydrophobicContact CB-CG 3.5Å; I228-Y232 HydrophobicContact CG2-CD2 3.84Å; I228-Y232 HydrophobicContact CG2-CE2 3.64Å; I228-Y232 WeakPolarHBondContact O-CD2 3.45Å; I228-Y232 PolarHBondContact O-N 3.17Å; C229-Y232 PolarHBondContact O-N 3.14Å; Y232-P234 WeakPolarHBondContact O-CD 3.22Å
233	I	87.7	Confident	89.5	Confident	18 Å²	18	62 Å²	62	9%	0.092	32%	0.32	C	S	.	.			trans	-126.9	71.4	-179.1	-47.4	161.7	0	0	0	107.8	Y153 T155 C229 T230 L235 I236	Y153-I233 HydrophobicContact CD1-CD1 3.56Å; Y153-I233 HydrophobicContact CD1-CG1 3.91Å; Y153-I233 HydrophobicContact CD1-CG2 4.5Å; Y153-I233 HydrophobicContact CD2-CD1 4.16Å; Y153-I233 HydrophobicContact CD2-CG2 3.98Å; Y153-I233 HydrophobicContact CE1-CD1 4.26Å; Y153-I233 HydrophobicContact CE1-CG1 4.11Å; Y153-I233 HydrophobicContact CE1-CG2 4.31Å; Y153-I233 HydrophobicContact CE2-CG2 3.77Å; Y153-I233 HydrophobicContact CG-CD1 3.51Å; Y153-I233 HydrophobicContact CG-CG1 4.21Å; Y153-I233 HydrophobicContact CG-CG2 4.35Å; T155-I233 HydrophobicContact CG2-CD1 4.09Å; C229-I233 WeakPolarHBondContact O-CA 3.27Å; C229-I233 WeakPolarHBondContact O-CB 3.43Å; C229-I233 PolarHBondContact O-N 3.36Å; T230-I233 CarbonylContact O-C 3.32Å; I233-L235 PolarHBondContact O-N 2.72Å; I233-I236 HydrophobicContact CB-CB 4.22Å; I233-I236 HydrophobicContact CG2-CB 3.93Å; I233-I236 VanDerWaalsContact O-CB 3.3Å; I233-I236 WeakPolarHBondContact O-CB 3.29Å; I233-I236 WeakPolarHBondContact O-CG2 3.5Å; I233-I236 PolarHBondContact O-N 2.93Å
234	P	87.3	Confident	89.8	Confident	94 Å²	94	60.5 Å²	60.5	61%	0.61	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-25.8	-174	22.7	-34.1	0	0	0	113.3	T230 Y232 I236 P238	T230-P234 VanDerWaalsContact O-CA 3.25Å; T230-P234 WeakPolarHBondContact O-CA 3.45Å; Y232-P234 WeakPolarHBondContact O-CD 3.22Å; P234-I236 VanDerWaalsContact C-N 3.27Å; P234-I236 PolarHBondContact O-N 3.32Å; P234-P238 VanDerWaalsContact O-CD 3.31Å; P234-P238 WeakPolarHBondContact O-CD 3.47Å
235	L	90.9	Very high	90.2	Very high	94 Å²	94	56.4 Å²	56.4	49%	0.492	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-10.8	176.2	-65	179.9	0	0	0	114	Y149 I233 V237 P238 V239	Y149-L235 HydrophobicContact CE1-CB 4Å; I233-L235 PolarHBondContact O-N 2.72Å; L235-V237 VanDerWaalsContact C-N 3.35Å; L235-V237 PolarHBondContact O-N 3.06Å; L235-P238 HydrophobicContact CD2-CG 4.43Å; L235-P238 WeakPolarHBondContact O-CD 3.4Å; L235-P238 WeakPolarHBondContact O-CG 3.31Å; L235-V239 VanDerWaalsContact O-CB 3.28Å; L235-V239 WeakPolarHBondContact O-CB 3.26Å; L235-V239 WeakPolarHBondContact O-CG2 3.47Å; L235-V239 PolarHBondContact O-N 3.24Å
236	I	88.7	Confident	90.7	Very high	13 Å²	13	57.9 Å²	57.9	7%	0.067	30%	0.298	C	S	.	.	H	α-helix	trans	-62.7	-42	-176.9	-160.5	171.1	0	0	0	111.8	T155 T230 I233 P234 F240	T155-I236 HydrophobicContact CG2-CD1 3.53Å; T230-I236 HydrophobicContact CG2-CG2 3.87Å; I233-I236 HydrophobicContact CB-CB 4.22Å; I233-I236 HydrophobicContact CG2-CB 3.93Å; I233-I236 VanDerWaalsContact O-CB 3.3Å; I233-I236 WeakPolarHBondContact O-CB 3.29Å; I233-I236 WeakPolarHBondContact O-CG2 3.5Å; I233-I236 PolarHBondContact O-N 2.93Å; P234-I236 VanDerWaalsContact C-N 3.27Å; P234-I236 PolarHBondContact O-N 3.32Å; I236-F240 WeakPolarHBondContact O-CB 3.3Å; I236-F240 PolarHBondContact O-N 2.89Å
237	V	91.4	Very high	91.1	Very high	39 Å²	39	57.7 Å²	57.7	24%	0.236	30%	0.299	C	S	.	.	H	α-helix	trans	-65.9	-55.7	-179.4	-170.7	0	0	0	0	111.8	Y226 T230 L235 V239 F240 V241	Y226-V237 HydrophobicContact CE1-CG2 4.34Å; T230-V237 HydrophobicContact CG2-CG2 3.28Å; L235-V237 VanDerWaalsContact C-N 3.35Å; L235-V237 PolarHBondContact O-N 3.06Å; V237-V239 VanDerWaalsContact C-N 3.33Å; V237-V239 PolarHBondContact O-N 3.01Å; V237-F240 PolarHBondContact O-N 3.43Å; V237-V241 HydrophobicContact CG1-CG2 4.24Å; V237-V241 WeakPolarHBondContact O-CB 3.42Å; V237-V241 WeakPolarHBondContact O-CG2 3.44Å; V237-V241 PolarHBondContact O-N 3.29Å
238	P	94.2	Very high	91.5	Very high	69 Å²	69	53.1 Å²	53.1	45%	0.448	28%	0.279	S	S	.	.	H	α-helix	trans	-63.3	-39	-179.6	24.1	-34.2	0	0	0	112	P234 L235 L242	P234-P238 VanDerWaalsContact O-CD 3.31Å; P234-P238 WeakPolarHBondContact O-CD 3.47Å; L235-P238 HydrophobicContact CD2-CG 4.43Å; L235-P238 WeakPolarHBondContact O-CD 3.4Å; L235-P238 WeakPolarHBondContact O-CG 3.31Å; P238-L242 WeakPolarHBondContact O-CB 3.21Å; P238-L242 PolarHBondContact O-N 3.42Å
239	V	94.5	Very high	92	Very high	21 Å²	21	54.1 Å²	54.1	13%	0.127	29%	0.291	C	S	.	.	H	α-helix	trans	-63.4	-46.1	175.8	172	0	0	0	0	110.6	L145 Y149 L235 V237 S243	L145-V239 HydrophobicContact CD2-CG1 4.38Å; L145-V239 HydrophobicContact CG-CG1 4.15Å; Y149-V239 HydrophobicContact CD2-CG1 3.99Å; Y149-V239 HydrophobicContact CD2-CG2 4.43Å; Y149-V239 HydrophobicContact CE1-CG2 4.22Å; Y149-V239 HydrophobicContact CE2-CG1 4.39Å; Y149-V239 HydrophobicContact CE2-CG2 4.06Å; Y149-V239 HydrophobicContact CG-CG1 4.14Å; L235-V239 VanDerWaalsContact O-CB 3.28Å; L235-V239 WeakPolarHBondContact O-CB 3.26Å; L235-V239 WeakPolarHBondContact O-CG2 3.47Å; L235-V239 PolarHBondContact O-N 3.24Å; V237-V239 VanDerWaalsContact C-N 3.33Å; V237-V239 PolarHBondContact O-N 3.01Å; V239-S243 WeakPolarHBondContact O-CB 3.18Å; V239-S243 PolarHBondContact O-N 3.41Å; V239-S243 PolarHBondContact O-OG 2.86Å
240	F	94	Very high	92.4	Very high	29 Å²	29	55.1 Å²	55.1	13%	0.127	30%	0.296	C	S	.	.	H	α-helix	trans	-59.7	-53.9	178.1	179.5	-87.2	0	0	0	111.7	F159 F213 W214 A217 I236 V237 S243 C244	F159-F240 HydrophobicContact CB-CE2 3.76Å; F159-F240 HydrophobicContact CB-CZ 4.49Å; F159-F240 HydrophobicContact CD1-CE2 4.07Å; F159-F240 HydrophobicContact CD1-CZ 4.01Å; F159-F240 HydrophobicContact CD2-CE2 4.09Å; F159-F240 HydrophobicContact CE1-CZ 4.42Å; F159-F240 AromaticContact CG-CE2 3.7Å; F159-F240 HydrophobicContact CG-CE2 3.7Å; F159-F240 HydrophobicContact CG-CZ 4.11Å; F213-F240 HydrophobicContact CE1-CE1 4.44Å; F213-F240 AromaticContact CE1-CZ 3.88Å; F213-F240 HydrophobicContact CE1-CZ 3.88Å; F213-F240 AromaticContact CZ-CE2 4Å; F213-F240 HydrophobicContact CZ-CE2 4Å; F213-F240 AromaticContact CZ-CZ 3.62Å; F213-F240 HydrophobicContact CZ-CZ 3.62Å; W214-F240 HydrophobicContact CH2-CE1 4.4Å; W214-F240 HydrophobicContact CZ3-CE1 4.06Å; A217-F240 HydrophobicContact CB-CE1 4.2Å; A217-F240 HydrophobicContact CB-CZ 4.06Å; I236-F240 WeakPolarHBondContact O-CB 3.3Å; I236-F240 PolarHBondContact O-N 2.89Å; V237-F240 PolarHBondContact O-N 3.43Å; F240-S243 PolarHBondContact O-OG 3.44Å; F240-C244 WeakPolarHBondContact O-CB 3.39Å; F240-C244 PolarHBondContact O-N 2.89Å; F240-C244 PolarHBondContact O-SG 2.96Å
241	V	94.3	Very high	92.8	Very high	74 Å²	74	53.6 Å²	53.6	45%	0.448	29%	0.286	S	S	.	.	H	α-helix	trans	-65.4	-45.5	-176	174.4	0	0	0	0	111	V237 G245	V237-V241 HydrophobicContact CG1-CG2 4.24Å; V237-V241 WeakPolarHBondContact O-CB 3.42Å; V237-V241 WeakPolarHBondContact O-CG2 3.44Å; V237-V241 PolarHBondContact O-N 3.29Å; V241-G245 WeakPolarHBondContact O-CA 3.47Å; V241-G245 PolarHBondContact O-N 2.99Å
242	L	95.9	Very high	93.1	Very high	126 Å²	126	47.6 Å²	47.6	66%	0.66	27%	0.269	S	S	*	.	H	α-helix	trans	-67.8	-46.3	-178.3	-178.7	62.7	0	0	0	111.9	P238 L246	P238-L242 WeakPolarHBondContact O-CB 3.21Å; P238-L242 PolarHBondContact O-N 3.42Å; L242-L246 WeakPolarHBondContact O-CB 3.34Å; L242-L246 PolarHBondContact O-N 2.97Å
243	S	96.2	Very high	93.6	Very high	5 Å²	5	47 Å²	47	4%	0.035	27%	0.27	C	S	.	.	H	α-helix	trans	-66.4	-48.5	179.8	60.7	0	0	0	0	111.7	A146 V239 F240 L246 L247	A146-S243 WeakPolarHBondContact CB-OG 3.42Å; V239-S243 WeakPolarHBondContact O-CB 3.18Å; V239-S243 PolarHBondContact O-N 3.41Å; V239-S243 PolarHBondContact O-OG 2.86Å; F240-S243 PolarHBondContact O-OG 3.44Å; S243-L246 PolarHBondContact O-N 2.82Å; S243-L247 WeakPolarHBondContact O-CB 3.46Å; S243-L247 WeakPolarHBondContact O-CG 3.24Å; S243-L247 PolarHBondContact O-N 3.48Å
244	C	96	Very high	93.9	Very high	9 Å²	9	48 Å²	48	6%	0.061	27%	0.273	C	S	.	.	H	α-helix	trans	-65	-44.5	179.5	-65.4	0	0	0	0	111.4	F213 W214 F240 L247 D248	F213-C244 HydrophobicContact CE1-CB 4.27Å; F213-C244 HydrophobicContact CZ-CB 4.44Å; W214-C244 HydrophobicContact CH2-CB 4.08Å; W214-C244 HydrophobicContact CZ2-CB 3.91Å; F240-C244 WeakPolarHBondContact O-CB 3.39Å; F240-C244 PolarHBondContact O-N 2.89Å; F240-C244 PolarHBondContact O-SG 2.96Å; C244-L247 PolarHBondContact O-N 3.44Å; C244-D248 WeakPolarHBondContact O-CB 3.03Å; C244-D248 VanDerWaalsContact O-CG 3.26Å; C244-D248 PolarHBondContact O-N 2.69Å
245	G	95.5	Very high	94.3	Very high	25 Å²	25	44 Å²	44	26%	0.258	25%	0.247	S	C	.	.	H	α-helix	trans	-61.5	-44.4	177.8	0	0	0	0	0	112.7	V241 L247 D248 C249	V241-G245 WeakPolarHBondContact O-CA 3.47Å; V241-G245 PolarHBondContact O-N 2.99Å; G245-L247 PolarHBondContact O-N 3.45Å; G245-D248 PolarHBondContact O-N 3.38Å; G245-C249 PolarHBondContact O-N 3.37Å; G245-C249 PolarHBondContact O-SG 3.07Å; G245-C249 VanDerWaalsContact O-SG 3.33Å
246	L	96.3	Very high	94.4	Very high	54 Å²	54	47 Å²	47	28%	0.283	26%	0.257	S	S	.	.	H	α-helix	trans	-60.9	-46.3	175.1	-178.2	150.4	0	0	0	111.2	A142 L242 S243 D248 C249 L250	A142-L246 HydrophobicContact CB-CD2 3.84Å; L242-L246 WeakPolarHBondContact O-CB 3.34Å; L242-L246 PolarHBondContact O-N 2.97Å; S243-L246 PolarHBondContact O-N 2.82Å; L246-D248 VanDerWaalsContact C-N 3.31Å; L246-D248 PolarHBondContact O-N 2.92Å; L246-C249 PolarHBondContact O-N 3.42Å; L246-L250 HydrophobicContact CD2-CD1 3.65Å; L246-L250 HydrophobicContact CD2-CG 4.27Å; L246-L250 WeakPolarHBondContact O-CG 3.41Å; L246-L250 PolarHBondContact O-N 3.29Å
247	L	95.9	Very high	94.5	Very high	11 Å²	11	52.8 Å²	52.8	6%	0.058	28%	0.278	C	S	.	.	H	α-helix	trans	-62.8	-37.8	178.3	-69.7	172.3	0	0	0	112	H139 A142 A143 S243 C244 G245 L250 N251	H139-L247 WeakPolarHBondContact ND1-CD2 3.36Å; A142-L247 HydrophobicContact CB-CD2 4.47Å; A142-L247 HydrophobicContact CB-CG 4.39Å; A143-L247 HydrophobicContact CB-CD1 4.38Å; S243-L247 WeakPolarHBondContact O-CB 3.46Å; S243-L247 WeakPolarHBondContact O-CG 3.24Å; S243-L247 PolarHBondContact O-N 3.48Å; C244-L247 PolarHBondContact O-N 3.44Å; G245-L247 PolarHBondContact O-N 3.45Å; L247-L250 PolarHBondContact O-N 2.89Å; L247-N251 WeakPolarHBondContact O-CB 3.16Å; L247-N251 VanDerWaalsContact O-CG 3.3Å; L247-N251 PolarHBondContact O-N 3.11Å; L247-N251 PolarHBondContact O-ND2 3.13Å
248	D	96.1	Very high	94.7	Very high	11 Å²	11	51.3 Å²	51.3	6%	0.059	27%	0.269	C	S	.	.	H	α-helix	trans	-65.9	-46	176.2	-74.8	-28.1	0	0	0	111.8	R163 I210 W214 C244 G245 L246 L250 N251 I252	R163-D248 IonicContact CZ-OD1 2.79Å; R163-D248 IonicContact CZ-OD2 3.34Å; R163-D248 IonicContact NH1-OD1 2.87Å; R163-D248 PolarHBondContact NH1-OD1 3.37Å; R163-D248 IonicContact NH1-OD2 3.79Å; R163-D248 IonicContact NH2-OD1 3.67Å; R163-D248 PolarHBondContact NH2-OD1 3.11Å; R163-D248 IonicContact NH2-OD2 2.77Å; R163-D248 PolarHBondContact NH2-OD2 3.2Å; R163-D248 VanDerWaalsContact NH2-OD2 3.07Å; I210-D248 HydrophobicContact CD1-CB 4.27Å; I210-D248 WeakPolarHBondContact CD1-OD1 3.41Å; I210-D248 WeakPolarHBondContact CG1-OD1 3.09Å; W214-D248 WeakPolarHBondContact CZ2-OD2 3.36Å; W214-D248 PolarHBondContact NE1-OD2 3.32Å; C244-D248 WeakPolarHBondContact O-CB 3.03Å; C244-D248 VanDerWaalsContact O-CG 3.26Å; C244-D248 PolarHBondContact O-N 2.69Å; G245-D248 PolarHBondContact O-N 3.38Å; L246-D248 VanDerWaalsContact C-N 3.31Å; L246-D248 PolarHBondContact O-N 2.92Å; D248-L250 VanDerWaalsContact C-N 3.3Å; D248-L250 PolarHBondContact O-N 3.32Å; D248-N251 PolarHBondContact O-N 3.38Å; D248-I252 WeakPolarHBondContact O-CB 3.45Å; D248-I252 VanDerWaalsContact O-CG1 3.29Å; D248-I252 WeakPolarHBondContact O-CG1 3.36Å; D248-I252 PolarHBondContact O-N 3.48Å
249	C	95.2	Very high	94.8	Very high	87 Å²	87	51.2 Å²	51.2	59%	0.588	27%	0.269	S	S	*	.	H	α-helix	trans	-56.9	-43.7	174.5	-71.2	0	0	0	0	112	G245 L246 H253	G245-C249 PolarHBondContact O-N 3.37Å; G245-C249 PolarHBondContact O-SG 3.07Å; G245-C249 VanDerWaalsContact O-SG 3.33Å; L246-C249 PolarHBondContact O-N 3.42Å; C249-H253 WeakPolarHBondContact O-CB 3.28Å; C249-H253 PolarHBondContact O-N 3.09Å
250	L	94.1	Very high	94.8	Very high	25 Å²	25	56.6 Å²	56.6	13%	0.131	29%	0.287	C	S	.	.	H	α-helix	trans	-65.5	-44	176.7	-69.2	-178.8	0	0	0	112.3	I135 H139 L246 L247 D248 I252 H253 W254	I135-L250 HydrophobicContact CG2-CD1 4.25Å; I135-L250 HydrophobicContact CG2-CD2 3.66Å; H139-L250 HydrophobicContact CB-CD1 3.9Å; L246-L250 HydrophobicContact CD2-CD1 3.65Å; L246-L250 HydrophobicContact CD2-CG 4.27Å; L246-L250 WeakPolarHBondContact O-CG 3.41Å; L246-L250 PolarHBondContact O-N 3.29Å; L247-L250 PolarHBondContact O-N 2.89Å; D248-L250 VanDerWaalsContact C-N 3.3Å; D248-L250 PolarHBondContact O-N 3.32Å; L250-I252 PolarHBondContact O-N 3.43Å; L250-H253 WeakPolarHBondContact O-CB 3.3Å; L250-H253 PolarHBondContact O-N 3.2Å; L250-W254 HydrophobicContact CB-CE3 4.41Å; L250-W254 HydrophobicContact CB-CH2 4.24Å; L250-W254 HydrophobicContact CB-CZ3 4.15Å; L250-W254 HydrophobicContact CD1-CH2 4.44Å; L250-W254 PolarHBondContact O-N 3.45Å
251	N	94.8	Very high	94.8	Very high	4 Å²	4	56.6 Å²	56.6	2%	0.021	29%	0.289	C	S	.	.	H	α-helix	trans	-64.3	-39.2	178.8	-77.3	-40.9	0	0	0	112.1	R206 L247 D248 W254 A255	R206-N251 HydrophobicContact CB-CB 4.15Å; R206-N251 WeakPolarHBondContact CD-OD1 3.16Å; R206-N251 PolarHBondContact NH1-OD1 3.19Å; L247-N251 WeakPolarHBondContact O-CB 3.16Å; L247-N251 VanDerWaalsContact O-CG 3.3Å; L247-N251 PolarHBondContact O-N 3.11Å; L247-N251 PolarHBondContact O-ND2 3.13Å; D248-N251 PolarHBondContact O-N 3.38Å; N251-W254 PolarHBondContact O-N 3.34Å; N251-A255 WeakPolarHBondContact O-CB 3.32Å; N251-A255 PolarHBondContact O-N 3.4Å
252	I	94.8	Very high	94.8	Very high	81 Å²	81	53.4 Å²	53.4	42%	0.415	27%	0.271	S	S	.	.	H	α-helix	trans	-64.3	-46.1	174.1	-68.8	166	0	0	0	110.4	D248 L250 W254 A255 F256	D248-I252 WeakPolarHBondContact O-CB 3.45Å; D248-I252 VanDerWaalsContact O-CG1 3.29Å; D248-I252 WeakPolarHBondContact O-CG1 3.36Å; D248-I252 PolarHBondContact O-N 3.48Å; L250-I252 PolarHBondContact O-N 3.43Å; I252-W254 VanDerWaalsContact C-N 3.32Å; I252-W254 PolarHBondContact O-N 3.15Å; I252-A255 WeakPolarHBondContact O-CB 3.5Å; I252-A255 PolarHBondContact O-N 3.23Å; I252-A255 VanDerWaalsContact O-N 3.11Å; I252-F256 HydrophobicContact CG2-CE2 3.86Å; I252-F256 WeakPolarHBondContact O-CD2 3.1Å; I252-F256 PolarHBondContact O-N 2.93Å
253	H	92.7	Very high	94.8	Very high	99 Å²	99	55.1 Å²	55.1	46%	0.458	27%	0.269	S	S	.	.	H	α-helix	trans	-56	-46.9	176.2	173.3	73.7	0	0	0	111.8	C249 L250 A255	C249-H253 WeakPolarHBondContact O-CB 3.28Å; C249-H253 PolarHBondContact O-N 3.09Å; L250-H253 WeakPolarHBondContact O-CB 3.3Å; L250-H253 PolarHBondContact O-N 3.2Å; H253-A255 VanDerWaalsContact C-N 3.35Å
254	W	93.3	Very high	94.8	Very high	37 Å²	37	58.5 Å²	58.5	14%	0.14	28%	0.283	C	S	.	.	H	α-helix	trans	-69.9	-28.9	177.2	-67.1	-30.9	0	0	0	113.5	I135 F136 H139 F202 L250 N251 I252 F256 R257 T258	I135-W254 HydrophobicContact CG2-CZ2 3.68Å; F136-W254 HydrophobicContact CD1-CZ2 4.43Å; F136-W254 HydrophobicContact CE1-CH2 4.2Å; F136-W254 AromaticContact CE1-CZ2 3.99Å; F136-W254 HydrophobicContact CE1-CZ2 3.99Å; F136-W254 HydrophobicContact CZ-CZ2 4.21Å; H139-W254 HydrophobicContact CB-CH2 4.36Å; F202-W254 HydrophobicContact CE1-CB 4.2Å; F202-W254 HydrophobicContact CE2-CB 4.35Å; F202-W254 HydrophobicContact CZ-CB 3.54Å; F202-W254 HydrophobicContact CZ-CE3 4.33Å; L250-W254 HydrophobicContact CB-CE3 4.41Å; L250-W254 HydrophobicContact CB-CH2 4.24Å; L250-W254 HydrophobicContact CB-CZ3 4.15Å; L250-W254 HydrophobicContact CD1-CH2 4.44Å; L250-W254 PolarHBondContact O-N 3.45Å; N251-W254 PolarHBondContact O-N 3.34Å; I252-W254 VanDerWaalsContact C-N 3.32Å; I252-W254 PolarHBondContact O-N 3.15Å; W254-F256 VanDerWaalsContact C-N 3.34Å; W254-F256 PolarHBondContact O-N 3.46Å; W254-R257 PolarHBondContact O-N 3.26Å; W254-T258 PolarHBondContact O-N 3.04Å; W254-T258 PolarHBondContact O-OG1 3Å; W254-T258 VanDerWaalsContact O-OG1 3.11Å
255	A	95.2	Very high	94.7	Very high	10 Å²	10	58.3 Å²	58.3	8%	0.083	28%	0.283	C	S	.	.	H	α-helix	trans	-60.1	-40.9	179.8	0	0	0	0	0	112.4	F202 I203 N207 N251 I252 H253 R257 T258 C259	F202-A255 HydrophobicContact CE1-CB 4.15Å; I203-A255 HydrophobicContact CD1-CB 4.09Å; N207-A255 WeakPolarHBondContact OD1-CB 3.2Å; N251-A255 WeakPolarHBondContact O-CB 3.32Å; N251-A255 PolarHBondContact O-N 3.4Å; I252-A255 WeakPolarHBondContact O-CB 3.5Å; I252-A255 PolarHBondContact O-N 3.23Å; I252-A255 VanDerWaalsContact O-N 3.11Å; H253-A255 VanDerWaalsContact C-N 3.35Å; A255-R257 VanDerWaalsContact C-N 3.28Å; A255-R257 PolarHBondContact O-N 3.34Å; A255-T258 PolarHBondContact O-N 3.24Å; A255-T258 VanDerWaalsContact O-N 3.12Å; A255-C259 WeakPolarHBondContact O-CB 3.21Å; A255-C259 PolarHBondContact O-N 3.29Å; A255-C259 PolarHBondContact O-SG 2.73Å; A255-C259 VanDerWaalsContact O-SG 3.39Å
256	F	93.2	Very high	94.8	Very high	157 Å²	157	58.9 Å²	58.9	69%	0.689	29%	0.285	S	S	*	.	H	α-helix	trans	-55.5	-43.6	176.7	-69.9	-71.8	0	0	0	112.2	I252 W254 R260	I252-F256 HydrophobicContact CG2-CE2 3.86Å; I252-F256 WeakPolarHBondContact O-CD2 3.1Å; I252-F256 PolarHBondContact O-N 2.93Å; W254-F256 VanDerWaalsContact C-N 3.34Å; W254-F256 PolarHBondContact O-N 3.46Å; F256-R260 PolarHBondContact O-N 3.01Å
257	R	91.7	Very high	94.7	Very high	135 Å²	135	62.5 Å²	62.5	51%	0.509	30%	0.298	S	S	.	.	H	α-helix	trans	-69.5	-43.5	176.7	-172.3	178.3	-175.3	173.5	4.3	111.4	W254 A255 R260 L261	W254-R257 PolarHBondContact O-N 3.26Å; A255-R257 VanDerWaalsContact C-N 3.28Å; A255-R257 PolarHBondContact O-N 3.34Å; R257-R260 PolarHBondContact O-N 2.82Å; R257-L261 HydrophobicContact CG-CD1 4.29Å; R257-L261 WeakPolarHBondContact O-CG 3.3Å; R257-L261 PolarHBondContact O-N 3.12Å; R257-L261 VanDerWaalsContact O-N 3.09Å
258	T	94.8	Very high	94.6	Very high	8 Å²	8	64.7 Å²	64.7	5%	0.049	31%	0.31	C	S	.	.	H	α-helix	trans	-64.9	-41.1	-178.4	-61.7	0	0	0	0	112.1	F198 A199 F202 W254 A255 R260 L261 G262	F198-T258 HydrophobicContact CD1-CG2 4.38Å; F198-T258 HydrophobicContact CE1-CG2 3.74Å; F198-T258 HydrophobicContact CZ-CG2 4.09Å; A199-T258 HydrophobicContact CB-CG2 3.81Å; F202-T258 HydrophobicContact CB-CG2 3.87Å; F202-T258 HydrophobicContact CD1-CG2 3.88Å; F202-T258 HydrophobicContact CG-CG2 3.9Å; W254-T258 PolarHBondContact O-N 3.04Å; W254-T258 PolarHBondContact O-OG1 3Å; W254-T258 VanDerWaalsContact O-OG1 3.11Å; A255-T258 PolarHBondContact O-N 3.24Å; A255-T258 VanDerWaalsContact O-N 3.12Å; T258-R260 PolarHBondContact O-N 2.9Å; T258-L261 PolarHBondContact O-N 3.48Å; T258-G262 PolarHBondContact O-N 3.36Å
259	C	95.7	Very high	94.5	Very high	67 Å²	67	64.9 Å²	64.9	45%	0.453	31%	0.311	S	S	.	.	H	α-helix	trans	-58.5	-45.5	174.4	-74.6	0	0	0	0	111.8	I203 A255 L261 G262 Y263	I203-C259 WeakPolarHBondContact CD1-SG 3.45Å; A255-C259 WeakPolarHBondContact O-CB 3.21Å; A255-C259 PolarHBondContact O-N 3.29Å; A255-C259 PolarHBondContact O-SG 2.73Å; A255-C259 VanDerWaalsContact O-SG 3.39Å; C259-L261 VanDerWaalsContact C-N 3.34Å; C259-L261 PolarHBondContact O-N 2.8Å; C259-G262 PolarHBondContact O-N 3.07Å; C259-Y263 WeakPolarHBondContact O-CB 3.37Å; C259-Y263 PolarHBondContact O-N 3.4Å
260	R	95.4	Very high	94.3	Very high	135 Å²	135	71.8 Å²	71.8	51%	0.509	32%	0.324	S	S	.	.	H	α-helix	trans	-62.3	-41.6	177.4	-172.7	177.1	179.2	-174.2	-3.4	112	F256 R257 T258 K264	F256-R260 PolarHBondContact O-N 3.01Å; R257-R260 PolarHBondContact O-N 2.82Å; T258-R260 PolarHBondContact O-N 2.9Å; R260-K264 WeakPolarHBondContact O-CG 3.44Å; R260-K264 PolarHBondContact O-N 2.62Å; R260-K264 VanDerWaalsContact O-N 3.15Å
261	L	93.1	Very high	94.1	Very high	29 Å²	29	75.4 Å²	75.4	15%	0.152	35%	0.348	C	S	.	.	H	α-helix	trans	-65.7	-44.7	176.2	-70.5	173.4	0	0	0	112	T195 R257 T258 C259 K264 A265	T195-L261 HydrophobicContact CG2-CB 4.21Å; R257-L261 HydrophobicContact CG-CD1 4.29Å; R257-L261 WeakPolarHBondContact O-CG 3.3Å; R257-L261 PolarHBondContact O-N 3.12Å; R257-L261 VanDerWaalsContact O-N 3.09Å; T258-L261 PolarHBondContact O-N 3.48Å; C259-L261 VanDerWaalsContact C-N 3.34Å; C259-L261 PolarHBondContact O-N 2.8Å; L261-K264 PolarHBondContact O-N 2.86Å; L261-A265 WeakPolarHBondContact O-CB 3.35Å; L261-A265 PolarHBondContact O-N 3.31Å
262	G	95.7	Very high	93.9	Very high	7 Å²	7	75.9 Å²	75.9	7%	0.072	35%	0.352	C	S	.	.	H	α-helix	trans	-61.3	-43.8	176.7	0	0	0	0	0	112.1	T258 C259 A265 A266	T258-G262 PolarHBondContact O-N 3.36Å; C259-G262 PolarHBondContact O-N 3.07Å; G262-A265 PolarHBondContact O-N 3.07Å; G262-A266 WeakPolarHBondContact O-CB 3.29Å; G262-A266 PolarHBondContact O-N 2.93Å
263	Y	96	Very high	93.5	Very high	162 Å²	162	75.8 Å²	75.8	64%	0.635	35%	0.353	S	S	*	.	H	α-helix	trans	-61.4	-46.5	176.2	177.1	-99	0	0	0	112.4	C259 A265 A266 K267	C259-Y263 WeakPolarHBondContact O-CB 3.37Å; C259-Y263 PolarHBondContact O-N 3.4Å; Y263-A265 VanDerWaalsContact C-N 3.33Å; Y263-A265 PolarHBondContact O-N 3.44Å; Y263-A266 PolarHBondContact O-N 3.35Å; Y263-K267 WeakPolarHBondContact O-CB 3.37Å; Y263-K267 PolarHBondContact O-N 2.98Å
264	K	94.9	Very high	93.2	Very high	76 Å²	76	76.5 Å²	76.5	33%	0.33	35%	0.352	S	S	.	.	H	α-helix	trans	-58.7	-45	175.1	-76.1	-177.6	174.4	-176.8	0	111.5	R260 L261 L268 D375	R260-K264 WeakPolarHBondContact O-CG 3.44Å; R260-K264 PolarHBondContact O-N 2.62Å; R260-K264 VanDerWaalsContact O-N 3.15Å; L261-K264 PolarHBondContact O-N 2.86Å; K264-L268 WeakPolarHBondContact O-CB 3.47Å; K264-L268 PolarHBondContact O-N 3.37Å; K264-L268 VanDerWaalsContact O-N 3.12Å; K264-D375 IonicContact NZ-OD1 3.95Å; K264-D375 PolarHBondContact NZ-OD1 3.36Å; K264-D375 IonicContact NZ-OD2 2.61Å
265	A	95.2	Very high	92.8	Very high	5 Å²	5	82.3 Å²	82.3	4%	0.041	38%	0.38	C	S	.	.	H	α-helix	trans	-64.8	-43.7	178.1	0	0	0	0	0	112.1	A192 T195 L196 L261 G262 Y263 L268 L269	A192-A265 HydrophobicContact CB-CB 4.34Å; T195-A265 HydrophobicContact CG2-CB 3.97Å; L196-A265 HydrophobicContact CB-CB 4.24Å; L261-A265 WeakPolarHBondContact O-CB 3.35Å; L261-A265 PolarHBondContact O-N 3.31Å; G262-A265 PolarHBondContact O-N 3.07Å; Y263-A265 VanDerWaalsContact C-N 3.33Å; Y263-A265 PolarHBondContact O-N 3.44Å; A265-L268 PolarHBondContact O-N 3.2Å; A265-L269 WeakPolarHBondContact O-CB 2.99Å; A265-L269 WeakPolarHBondContact O-CG 3.38Å; A265-L269 PolarHBondContact O-N 3.23Å
266	A	95.8	Very high	92.3	Very high	37 Å²	37	84.1 Å²	84.1	31%	0.306	39%	0.392	S	S	.	.	H	α-helix	trans	-62.1	-46.5	176.8	0	0	0	0	0	111.7	L196 G262 Y263 L268 L269 W270	L196-A266 HydrophobicContact CD1-CB 4.08Å; G262-A266 WeakPolarHBondContact O-CB 3.29Å; G262-A266 PolarHBondContact O-N 2.93Å; Y263-A266 PolarHBondContact O-N 3.35Å; A266-L268 VanDerWaalsContact C-N 3.33Å; A266-L268 PolarHBondContact O-N 3.44Å; A266-L269 PolarHBondContact O-N 3.07Å; A266-W270 VanDerWaalsContact O-CB 3.28Å; A266-W270 WeakPolarHBondContact O-CB 3.18Å; A266-W270 PolarHBondContact O-N 2.83Å
267	K	95.1	Very high	91.9	Very high	129 Å²	129	78.5 Å²	78.5	56%	0.561	37%	0.369	S	S	*	.	H	α-helix	trans	-57.4	-46.7	177	-175.8	177	180	178.3	0	111.5	Y263 W270 T271	Y263-K267 WeakPolarHBondContact O-CB 3.37Å; Y263-K267 PolarHBondContact O-N 2.98Å; K267-W270 PolarHBondContact O-N 3.14Å; K267-T271 PolarHBondContact O-N 3.47Å; K267-T271 VanDerWaalsContact O-N 3.15Å; K267-T271 PolarHBondContact O-OG1 3.01Å
268	L	93.3	Very high	91.6	Very high	58 Å²	58	77.1 Å²	77.1	30%	0.304	37%	0.371	S	S	.	.	H	α-helix	trans	-63	-42.8	178.5	-178.2	76.4	0	0	0	112.4	D187 A192 K264 A265 A266 T271 A272	D187-L268 WeakPolarHBondContact O-CD2 3.21Å; A192-L268 HydrophobicContact CB-CD2 3.62Å; K264-L268 WeakPolarHBondContact O-CB 3.47Å; K264-L268 PolarHBondContact O-N 3.37Å; K264-L268 VanDerWaalsContact O-N 3.12Å; A265-L268 PolarHBondContact O-N 3.2Å; A266-L268 VanDerWaalsContact C-N 3.33Å; A266-L268 PolarHBondContact O-N 3.44Å; L268-T271 PolarHBondContact O-OG1 3.38Å; L268-T271 VanDerWaalsContact O-OG1 3.1Å; L268-A272 PolarHBondContact O-N 3.41Å
269	L	93.6	Very high	91.4	Very high	15 Å²	15	80.5 Å²	80.5	8%	0.079	39%	0.394	C	S	.	.	H	α-helix	trans	-71.7	-30.5	178.8	-69	170.1	0	0	0	112.6	A192 C193 L196 A265 A266 A272 W274	A192-L269 HydrophobicContact CB-CD1 4.26Å; A192-L269 HydrophobicContact CB-CD2 3.98Å; A192-L269 HydrophobicContact CB-CG 3.95Å; C193-L269 VanDerWaalsContact SG-CD2 3.54Å; L196-L269 HydrophobicContact CB-CD1 4.08Å; L196-L269 HydrophobicContact CD2-CD1 3.67Å; A265-L269 WeakPolarHBondContact O-CB 2.99Å; A265-L269 WeakPolarHBondContact O-CG 3.38Å; A265-L269 PolarHBondContact O-N 3.23Å; A266-L269 PolarHBondContact O-N 3.07Å; L269-A272 WeakPolarHBondContact O-CB 3.46Å; L269-A272 PolarHBondContact O-N 2.73Å; L269-W274 HydrophobicContact CB-CZ2 4.17Å; L269-W274 HydrophobicContact CD2-CH2 3.76Å; L269-W274 HydrophobicContact CD2-CZ2 3.6Å; L269-W274 HydrophobicContact CG-CZ2 4.43Å; L269-W274 PolarHBondContact O-NE1 2.83Å
270	W	92.2	Very high	91	Very high	231 Å²	231	83.4 Å²	83.4	88%	0.875	40%	0.399	S	S	*	.	H	α-helix	trans	-67.1	-41.2	175	-176	-94.3	0	0	0	111.8	A266 K267 A272	A266-W270 VanDerWaalsContact O-CB 3.28Å; A266-W270 WeakPolarHBondContact O-CB 3.18Å; A266-W270 PolarHBondContact O-N 2.83Å; K267-W270 PolarHBondContact O-N 3.14Å; W270-A272 PolarHBondContact O-N 3.19Å
271	T	90.6	Very high	90.6	Very high	102 Å²	102	79.8 Å²	79.8	63%	0.626	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	0.4	176.8	55.8	0	0	0	0	113.8	K267 L268	K267-T271 PolarHBondContact O-N 3.47Å; K267-T271 VanDerWaalsContact O-N 3.15Å; K267-T271 PolarHBondContact O-OG1 3.01Å; L268-T271 PolarHBondContact O-OG1 3.38Å; L268-T271 VanDerWaalsContact O-OG1 3.1Å
272	A	88.8	Confident	90.5	Very high	14 Å²	14	86.2 Å²	86.2	12%	0.116	42%	0.42	C	S	.	.			trans	-78.6	130.4	-176	0	0	0	0	0	111.7	L268 L269 W270 W274	L268-A272 PolarHBondContact O-N 3.41Å; L269-A272 WeakPolarHBondContact O-CB 3.46Å; L269-A272 PolarHBondContact O-N 2.73Å; W270-A272 PolarHBondContact O-N 3.19Å; A272-W274 PolarHBondContact O-N 3.3Å
273	D	88.2	Confident	90.3	Very high	79 Å²	79	90 Å²	90	42%	0.422	44%	0.442	S	S	.	.			trans	-72	94.5	165.1	179	3.2	0	0	0	110.5	R189 Q275 S276	R189-D273 PolarHBondContact NH2-O 3.16Å; R189-D273 VanDerWaalsContact NH2-O 3.15Å; D273-Q275 PolarHBondContact OD1-N 3.27Å; D273-Q275 VanDerWaalsContact OD1-N 3.12Å; D273-S276 PolarHBondContact OD1-N 2.89Å; D273-S276 VanDerWaalsContact OD1-N 3.15Å; D273-S276 WeakPolarHBondContact OD2-CB 3.45Å; D273-S276 PolarHBondContact OD2-OG 3.47Å
274	W	85	Confident	90	Very high	114 Å²	114	88.2 Å²	88.2	43%	0.432	44%	0.44	S	S	.	.	H	α-helix	trans	-72.1	-29.9	179.2	-71	100.1	0	0	0	113.1	L269 A272 D277 I278	L269-W274 HydrophobicContact CB-CZ2 4.17Å; L269-W274 HydrophobicContact CD2-CH2 3.76Å; L269-W274 HydrophobicContact CD2-CZ2 3.6Å; L269-W274 HydrophobicContact CG-CZ2 4.43Å; L269-W274 PolarHBondContact O-NE1 2.83Å; A272-W274 PolarHBondContact O-N 3.3Å; W274-D277 PolarHBondContact O-N 3.11Å; W274-I278 HydrophobicContact CB-CD1 4.42Å; W274-I278 WeakPolarHBondContact O-CB 3.21Å; W274-I278 WeakPolarHBondContact O-CD1 3.28Å; W274-I278 WeakPolarHBondContact O-CG1 3.19Å; W274-I278 PolarHBondContact O-N 2.99Å
275	Q	84.6	Confident	89.8	Confident	159 Å²	159	90.2 Å²	90.2	74%	0.743	45%	0.453	S	S	*	.	H	α-helix	trans	-66.4	-49	-177.1	-69.4	-177.6	-18.3	0	0	110.4	D273 D277 I278 C279	D273-Q275 PolarHBondContact OD1-N 3.27Å; D273-Q275 VanDerWaalsContact OD1-N 3.12Å; Q275-D277 PolarHBondContact O-N 3.42Å; Q275-I278 PolarHBondContact O-N 2.92Å; Q275-C279 WeakPolarHBondContact O-CB 3.31Å; Q275-C279 PolarHBondContact O-N 2.74Å; Q275-C279 PolarHBondContact O-SG 3.14Å
276	S	86.1	Confident	89.7	Confident	47 Å²	47	93.9 Å²	93.9	33%	0.329	47%	0.469	S	S	.	.	H	α-helix	trans	-58.9	-38.2	175.1	-72.5	0	0	0	0	112.2	D273 C279 K280	D273-S276 PolarHBondContact OD1-N 2.89Å; D273-S276 VanDerWaalsContact OD1-N 3.15Å; D273-S276 WeakPolarHBondContact OD2-CB 3.45Å; D273-S276 PolarHBondContact OD2-OG 3.47Å; S276-C279 PolarHBondContact O-N 3.23Å; S276-K280 WeakPolarHBondContact O-CB 3.45Å; S276-K280 VanDerWaalsContact O-CG 3.26Å; S276-K280 WeakPolarHBondContact O-CG 3.06Å; S276-K280 PolarHBondContact O-N 3.35Å
277	D	83.8	Confident	89.6	Confident	39 Å²	39	98 Å²	98	21%	0.209	48%	0.48	C	S	.	.	H	α-helix	trans	-73.1	-43.2	-178.2	-95.4	26.1	0	0	0	114	R189 W274 Q275 C279 K280 A281	R189-D277 WeakPolarHBondContact CD-OD2 3.19Å; R189-D277 IonicContact CZ-OD1 3.02Å; R189-D277 IonicContact CZ-OD2 2.67Å; R189-D277 IonicContact NE-OD2 3.4Å; R189-D277 PolarHBondContact NE-OD2 3.48Å; R189-D277 IonicContact NH1-OD1 3.62Å; R189-D277 PolarHBondContact NH1-OD1 3.47Å; R189-D277 IonicContact NH1-OD2 2.62Å; R189-D277 PolarHBondContact NH1-OD2 3.28Å; R189-D277 IonicContact NH2-OD1 3.9Å; R189-D277 IonicContact NH2-OD2 3.39Å; W274-D277 PolarHBondContact O-N 3.11Å; Q275-D277 PolarHBondContact O-N 3.42Å; D277-C279 VanDerWaalsContact C-N 3.26Å; D277-C279 PolarHBondContact O-N 3.05Å; D277-K280 PolarHBondContact O-N 2.86Å; D277-A281 VanDerWaalsContact O-CB 3.24Å; D277-A281 WeakPolarHBondContact O-CB 3.28Å; D277-A281 PolarHBondContact O-N 3.37Å
278	I	86.2	Confident	89.4	Confident	106 Å²	106	98.2 Å²	98.2	54%	0.544	48%	0.478	S	S	.	.	H	α-helix	trans	-62.2	-41.3	173.7	-67.9	165.8	0	0	0	109	W274 Q275 A281 R282	W274-I278 HydrophobicContact CB-CD1 4.42Å; W274-I278 WeakPolarHBondContact O-CB 3.21Å; W274-I278 WeakPolarHBondContact O-CD1 3.28Å; W274-I278 WeakPolarHBondContact O-CG1 3.19Å; W274-I278 PolarHBondContact O-N 2.99Å; Q275-I278 PolarHBondContact O-N 2.92Å; I278-A281 PolarHBondContact O-N 2.9Å; I278-R282 WeakPolarHBondContact O-CB 3.33Å; I278-R282 PolarHBondContact O-N 2.94Å
279	C	89.5	Confident	89.3	Confident	80 Å²	80	99.7 Å²	99.7	54%	0.541	49%	0.485	S	S	.	.	H	α-helix	trans	-62.7	-46.4	175.7	-70.7	0	0	0	0	112.3	Q275 S276 D277 R282 T283	Q275-C279 WeakPolarHBondContact O-CB 3.31Å; Q275-C279 PolarHBondContact O-N 2.74Å; Q275-C279 PolarHBondContact O-SG 3.14Å; S276-C279 PolarHBondContact O-N 3.23Å; D277-C279 VanDerWaalsContact C-N 3.26Å; D277-C279 PolarHBondContact O-N 3.05Å; C279-R282 PolarHBondContact O-N 3.34Å; C279-T283 WeakPolarHBondContact O-CB 3.12Å; C279-T283 PolarHBondContact O-N 2.83Å; C279-T283 PolarHBondContact O-OG1 3.35Å
280	K	88.5	Confident	89.2	Confident	127 Å²	127	105.7 Å²	105.7	55%	0.552	51%	0.507	S	S	*	.	H	α-helix	trans	-61.5	-49.9	175.4	-75.4	170.9	-174.2	174.8	0	110.9	S276 D277 R282 T283 H284	S276-K280 WeakPolarHBondContact O-CB 3.45Å; S276-K280 VanDerWaalsContact O-CG 3.26Å; S276-K280 WeakPolarHBondContact O-CG 3.06Å; S276-K280 PolarHBondContact O-N 3.35Å; D277-K280 PolarHBondContact O-N 2.86Å; K280-R282 VanDerWaalsContact C-N 3.33Å; K280-R282 PolarHBondContact O-N 3.33Å; K280-T283 WeakPolarHBondContact O-CB 3.47Å; K280-T283 PolarHBondContact O-N 2.66Å; K280-T283 VanDerWaalsContact O-N 3.13Å; K280-H284 PolarHBondContact O-CD2 3.25Å; K280-H284 PolarHBondContact O-N 2.94Å
281	A	87.3	Confident	89.2	Confident	60 Å²	60	98 Å²	98	50%	0.496	48%	0.483	S	S	.	.	H	α-helix	trans	-58.3	-44.4	178.8	0	0	0	0	0	111.9	D277 I278 H284 L285	D277-A281 VanDerWaalsContact O-CB 3.24Å; D277-A281 WeakPolarHBondContact O-CB 3.28Å; D277-A281 PolarHBondContact O-N 3.37Å; I278-A281 PolarHBondContact O-N 2.9Å; A281-H284 PolarHBondContact O-N 3.39Å; A281-L285 WeakPolarHBondContact O-CB 3.41Å; A281-L285 PolarHBondContact O-N 3.01Å
282	R	89.7	Confident	89.2	Confident	164 Å²	164	97.7 Å²	97.7	62%	0.619	48%	0.477	S	S	*	.	H	α-helix	trans	-62.4	-42.2	175.2	-174	173.8	-174.5	-168.6	-2.1	111.7	I278 C279 K280 L285 H286	I278-R282 WeakPolarHBondContact O-CB 3.33Å; I278-R282 PolarHBondContact O-N 2.94Å; C279-R282 PolarHBondContact O-N 3.34Å; K280-R282 VanDerWaalsContact C-N 3.33Å; K280-R282 PolarHBondContact O-N 3.33Å; R282-L285 PolarHBondContact O-N 2.92Å; R282-H286 VanDerWaalsContact CG-CE1 3.42Å; R282-H286 WeakPolarHBondContact CG-CE1 3.32Å; R282-H286 PolarHBondContact NE-CE1 3.5Å; R282-H286 WeakPolarHBondContact O-CB 3.49Å; R282-H286 PolarHBondContact O-N 3.03Å; R282-H286 PolarHBondContact O-ND1 2.82Å; R282-H286 VanDerWaalsContact O-ND1 3.1Å
283	T	91.7	Very high	89.3	Confident	87 Å²	87	102.8 Å²	102.8	53%	0.534	50%	0.498	S	S	.	.	H	α-helix	trans	-64.5	-43.6	176.8	-56	0	0	0	0	111.7	C279 K280 H286 K287	C279-T283 WeakPolarHBondContact O-CB 3.12Å; C279-T283 PolarHBondContact O-N 2.83Å; C279-T283 PolarHBondContact O-OG1 3.35Å; K280-T283 WeakPolarHBondContact O-CB 3.47Å; K280-T283 PolarHBondContact O-N 2.66Å; K280-T283 VanDerWaalsContact O-N 3.13Å; T283-H286 PolarHBondContact O-N 2.86Å; T283-K287 WeakPolarHBondContact O-CB 3.32Å; T283-K287 PolarHBondContact O-N 3.45Å
284	H	89.8	Confident	89.4	Confident	124 Å²	124	105.3 Å²	105.3	57%	0.574	51%	0.507	S	S	*	.	H	α-helix	trans	-63.3	-42.1	174.7	-80.9	-77.7	0	0	0	112	K280 A281 K287 R288	K280-H284 PolarHBondContact O-CD2 3.25Å; K280-H284 PolarHBondContact O-N 2.94Å; A281-H284 PolarHBondContact O-N 3.39Å; H284-K287 PolarHBondContact O-N 2.87Å; H284-R288 PolarHBondContact O-N 3.33Å
285	L	91.3	Very high	89.6	Confident	117 Å²	117	106.8 Å²	106.8	61%	0.613	51%	0.513	S	S	*	.	H	α-helix	trans	-63.6	-47.6	176.7	-177.2	63.6	0	0	0	111.4	A281 R282 K287 R288 L289	A281-L285 WeakPolarHBondContact O-CB 3.41Å; A281-L285 PolarHBondContact O-N 3.01Å; R282-L285 PolarHBondContact O-N 2.92Å; L285-K287 VanDerWaalsContact C-N 3.33Å; L285-K287 PolarHBondContact O-N 3.29Å; L285-R288 PolarHBondContact O-N 3.5Å; L285-L289 WeakPolarHBondContact O-CB 2.98Å; L285-L289 PolarHBondContact O-N 2.69Å
286	H	91.8	Very high	89.8	Confident	82 Å²	82	104 Å²	104	38%	0.38	51%	0.507	S	S	.	.	H	α-helix	trans	-61.3	-40.2	175.2	-70.6	137.9	0	0	0	112.2	R282 T283 L289 R290	R282-H286 VanDerWaalsContact CG-CE1 3.42Å; R282-H286 WeakPolarHBondContact CG-CE1 3.32Å; R282-H286 PolarHBondContact NE-CE1 3.5Å; R282-H286 WeakPolarHBondContact O-CB 3.49Å; R282-H286 PolarHBondContact O-N 3.03Å; R282-H286 PolarHBondContact O-ND1 2.82Å; R282-H286 VanDerWaalsContact O-ND1 3.1Å; T283-H286 PolarHBondContact O-N 2.86Å; H286-L289 PolarHBondContact O-N 3.24Å; H286-R290 WeakPolarHBondContact O-CB 3.38Å; H286-R290 WeakPolarHBondContact O-CG 3.39Å; H286-R290 PolarHBondContact O-N 2.96Å
287	K	93.7	Very high	89.9	Confident	123 Å²	123	104.4 Å²	104.4	54%	0.535	51%	0.512	S	S	.	.	H	α-helix	trans	-60.9	-46	174.7	-174	178.8	179.3	179.9	0	111.2	T283 H284 L285 R290 N291	T283-K287 WeakPolarHBondContact O-CB 3.32Å; T283-K287 PolarHBondContact O-N 3.45Å; H284-K287 PolarHBondContact O-N 2.87Å; L285-K287 VanDerWaalsContact C-N 3.33Å; L285-K287 PolarHBondContact O-N 3.29Å; K287-R290 PolarHBondContact O-N 2.98Å; K287-N291 PolarHBondContact O-N 3.49Å; K287-N291 PolarHBondContact O-OD1 3.49Å
288	R	91.5	Very high	90.1	Very high	135 Å²	135	110 Å²	110	51%	0.509	54%	0.535	S	S	.	.	H	α-helix	trans	-63.6	-44.4	176.5	-77.5	-174.7	171.8	-157.9	-0.6	112.1	H284 L285 R290 N291 L292 D346	H284-R288 PolarHBondContact O-N 3.33Å; L285-R288 PolarHBondContact O-N 3.5Å; R288-R290 PolarHBondContact O-N 2.96Å; R288-N291 PolarHBondContact O-N 2.86Å; R288-L292 WeakPolarHBondContact O-CG 3.49Å; R288-L292 PolarHBondContact O-N 3.1Å; R288-D346 IonicContact CZ-OD2 3.87Å; R288-D346 IonicContact NH2-OD2 3.07Å; R288-D346 PolarHBondContact NH2-OD2 3.21Å
289	L	91.8	Very high	90.1	Very high	89 Å²	89	111 Å²	111	47%	0.466	54%	0.535	S	S	.	.	H	α-helix	trans	-62.2	-42.9	178.2	-171	66.2	0	0	0	111.5	L285 H286 L292 Q293	L285-L289 WeakPolarHBondContact O-CB 2.98Å; L285-L289 PolarHBondContact O-N 2.69Å; H286-L289 PolarHBondContact O-N 3.24Å; L289-L292 PolarHBondContact O-N 2.6Å; L289-Q293 WeakPolarHBondContact O-CB 3.43Å; L289-Q293 WeakPolarHBondContact O-CG 3.18Å; L289-Q293 PolarHBondContact O-N 2.89Å
290	R	91.5	Very high	89.8	Confident	141 Å²	141	109.9 Å²	109.9	53%	0.532	53%	0.532	S	S	.	.	H	α-helix	trans	-60.6	-44.7	173.6	-75.5	-171.9	-63.4	-142.6	2.4	112.1	H286 K287 R288 L292 Q293 Q294	H286-R290 WeakPolarHBondContact O-CB 3.38Å; H286-R290 WeakPolarHBondContact O-CG 3.39Å; H286-R290 PolarHBondContact O-N 2.96Å; K287-R290 PolarHBondContact O-N 2.98Å; R288-R290 PolarHBondContact O-N 2.96Å; R290-L292 VanDerWaalsContact C-N 3.32Å; R290-L292 PolarHBondContact O-N 3.35Å; R290-Q293 PolarHBondContact O-N 3.17Å; R290-Q294 WeakPolarHBondContact O-CB 3.23Å; R290-Q294 WeakPolarHBondContact O-CG 3.49Å; R290-Q294 PolarHBondContact O-N 3.21Å
291	N	92.7	Very high	89.5	Confident	69 Å²	69	111.6 Å²	111.6	37%	0.369	54%	0.54	S	S	.	.	H	α-helix	trans	-63.1	-38.2	177.3	-69.5	-0	0	0	0	111.8	K287 R288 R295	K287-N291 PolarHBondContact O-N 3.49Å; K287-N291 PolarHBondContact O-OD1 3.49Å; R288-N291 PolarHBondContact O-N 2.86Å; N291-R295 VanDerWaalsContact O-CG 3.27Å; N291-R295 WeakPolarHBondContact O-CG 3.43Å; N291-R295 PolarHBondContact O-N 3.24Å
292	L	90.7	Very high	89	Confident	96 Å²	96	111.1 Å²	111.1	50%	0.503	53%	0.533	S	S	.	.	H	α-helix	trans	-67	-45.4	174.8	-70.8	170.9	0	0	0	111.5	R288 L289 R290 Q294 R295 V296	R288-L292 WeakPolarHBondContact O-CG 3.49Å; R288-L292 PolarHBondContact O-N 3.1Å; L289-L292 PolarHBondContact O-N 2.6Å; R290-L292 VanDerWaalsContact C-N 3.32Å; R290-L292 PolarHBondContact O-N 3.35Å; L292-Q294 VanDerWaalsContact C-N 3.33Å; L292-Q294 PolarHBondContact O-N 3.45Å; L292-R295 PolarHBondContact O-N 3.48Å; L292-V296 WeakPolarHBondContact O-CG2 3.36Å; L292-V296 PolarHBondContact O-N 3.03Å
293	Q	90.2	Very high	88.3	Confident	120 Å²	120	108 Å²	108	56%	0.561	53%	0.529	S	S	*	.	H	α-helix	trans	-59.4	-43.1	175.8	-75.2	175.4	-30.8	0	0	111.8	L289 R290 R295 V296 A297	L289-Q293 WeakPolarHBondContact O-CB 3.43Å; L289-Q293 WeakPolarHBondContact O-CG 3.18Å; L289-Q293 PolarHBondContact O-N 2.89Å; R290-Q293 PolarHBondContact O-N 3.17Å; Q293-R295 PolarHBondContact O-N 3.35Å; Q293-V296 PolarHBondContact O-N 2.94Å; Q293-A297 VanDerWaalsContact O-CB 3.28Å; Q293-A297 WeakPolarHBondContact O-CB 3.1Å; Q293-A297 PolarHBondContact O-N 3.36Å
294	Q	90.6	Very high	87.3	Confident	132 Å²	132	111.5 Å²	111.5	62%	0.617	54%	0.54	S	S	*	.	H	α-helix	trans	-62.4	-40.5	175.3	-75.2	176.3	-18.4	0	0	112.1	R290 L292 F298	R290-Q294 WeakPolarHBondContact O-CB 3.23Å; R290-Q294 WeakPolarHBondContact O-CG 3.49Å; R290-Q294 PolarHBondContact O-N 3.21Å; L292-Q294 VanDerWaalsContact C-N 3.33Å; L292-Q294 PolarHBondContact O-N 3.45Å; Q294-F298 VanDerWaalsContact O-CB 3.29Å; Q294-F298 WeakPolarHBondContact O-CB 3.43Å; Q294-F298 PolarHBondContact O-N 3.49Å
295	R	89.5	Confident	85.9	Confident	146 Å²	146	110.5 Å²	110.5	55%	0.551	55%	0.547	S	S	*	.	H	α-helix	trans	-66.7	-43	176.1	-73.7	173.4	-178.5	-158	-2.2	112.7	N291 L292 Q293 F298 K299	N291-R295 VanDerWaalsContact O-CG 3.27Å; N291-R295 WeakPolarHBondContact O-CG 3.43Å; N291-R295 PolarHBondContact O-N 3.24Å; L292-R295 PolarHBondContact O-N 3.48Å; Q293-R295 PolarHBondContact O-N 3.35Å; R295-F298 PolarHBondContact O-N 3.19Å; R295-K299 WeakPolarHBondContact O-CB 3.31Å; R295-K299 PolarHBondContact O-N 2.66Å
296	V	88.3	Confident	84.3	Confident	101 Å²	101	112.1 Å²	112.1	61%	0.612	56%	0.556	S	S	*	*	H	α-helix	trans	-65	-43.2	176.2	173.5	0	0	0	0	110.6	L292 Q293 F298 K299 A300	L292-V296 WeakPolarHBondContact O-CG2 3.36Å; L292-V296 PolarHBondContact O-N 3.03Å; Q293-V296 PolarHBondContact O-N 2.94Å; V296-F298 PolarHBondContact O-N 3.19Å; V296-K299 PolarHBondContact O-N 3.39Å; V296-A300 WeakPolarHBondContact O-CB 3.33Å; V296-A300 PolarHBondContact O-N 3.43Å
297	A	88.1	Confident	82.2	Confident	54 Å²	54	116.5 Å²	116.5	45%	0.446	57%	0.574	S	S	.	*	H	α-helix	trans	-64.6	-38.5	176.3	0	0	0	0	0	112.4	Q293 K301	Q293-A297 VanDerWaalsContact O-CB 3.28Å; Q293-A297 WeakPolarHBondContact O-CB 3.1Å; Q293-A297 PolarHBondContact O-N 3.36Å; A297-K301 WeakPolarHBondContact O-CG 3.37Å; A297-K301 PolarHBondContact O-N 2.95Å
298	F	86.8	Confident	79.7	Confident	157 Å²	157	116.4 Å²	116.4	69%	0.689	59%	0.586	S	S	*	*	H	α-helix	trans	-64.9	-44.7	174.4	-175.2	-96.8	0	0	0	111.6	Q294 R295 V296 K301 S302	Q294-F298 VanDerWaalsContact O-CB 3.29Å; Q294-F298 WeakPolarHBondContact O-CB 3.43Å; Q294-F298 PolarHBondContact O-N 3.49Å; R295-F298 PolarHBondContact O-N 3.19Å; V296-F298 PolarHBondContact O-N 3.19Å; F298-K301 PolarHBondContact O-N 3.19Å; F298-S302 PolarHBondContact O-N 2.94Å
299	K	86.9	Confident	77.3	Confident	126 Å²	126	117 Å²	117	55%	0.548	61%	0.605	S	S	.	*	H	α-helix	trans	-64.3	-41.6	176.3	-168	175.4	-177.7	179.5	0	112.4	R295 V296 K301 S302 D303	R295-K299 WeakPolarHBondContact O-CB 3.31Å; R295-K299 PolarHBondContact O-N 2.66Å; V296-K299 PolarHBondContact O-N 3.39Å; K299-K301 VanDerWaalsContact C-N 3.33Å; K299-K301 PolarHBondContact O-N 2.88Å; K299-S302 WeakPolarHBondContact CA-OG 3.3Å; K299-S302 PolarHBondContact O-N 3.37Å; K299-S302 PolarHBondContact O-OG 3.25Å; K299-D303 WeakPolarHBondContact O-CB 3.11Å; K299-D303 PolarHBondContact O-N 3.37Å
300	A	82.5	Confident	74.9	Confident	57 Å²	57	120.5 Å²	120.5	47%	0.471	62%	0.623	S	S	.	*	H	α-helix	trans	-62.5	-39.5	175	0	0	0	0	0	112.1	V296 M304	V296-A300 WeakPolarHBondContact O-CB 3.33Å; V296-A300 PolarHBondContact O-N 3.43Å; A300-M304 WeakPolarHBondContact O-CB 3.05Å; A300-M304 PolarHBondContact O-N 3.16Å; A300-M304 VanDerWaalsContact O-N 3.07Å
301	K	83	Confident	72.5	Confident	164 Å²	164	120 Å²	120	71%	0.713	64%	0.636	S	S	*	*	H	α-helix	trans	-67.5	-39.6	174.5	-78.1	-175.3	178.4	-174.2	0	112.8	A297 F298 K299 S305	A297-K301 WeakPolarHBondContact O-CG 3.37Å; A297-K301 PolarHBondContact O-N 2.95Å; F298-K301 PolarHBondContact O-N 3.19Å; K299-K301 VanDerWaalsContact C-N 3.33Å; K299-K301 PolarHBondContact O-N 2.88Å; K301-S305 PolarHBondContact O-N 3.34Å; K301-S305 VanDerWaalsContact O-N 3.1Å
302	S	77.5	Confident	69.9	Low	49 Å²	49	124.5 Å²	124.5	34%	0.343	66%	0.655	S	S	.	*	H	α-helix	trans	-66.1	-40	176.3	61.7	0	0	0	0	112.1	F298 K299 S305 L306	F298-S302 PolarHBondContact O-N 2.94Å; K299-S302 WeakPolarHBondContact CA-OG 3.3Å; K299-S302 PolarHBondContact O-N 3.37Å; K299-S302 PolarHBondContact O-OG 3.25Å; S302-S305 PolarHBondContact O-N 2.99Å; S302-L306 PolarHBondContact O-N 3.23Å
303	D	74.6	Confident	67.3	Low	100 Å²	100	125.7 Å²	125.7	54%	0.535	66%	0.662	S	S	.	*	H	α-helix	trans	-69.9	-33.8	179.8	-66.6	-11.7	0	0	0	111.8	K299 L306	K299-D303 WeakPolarHBondContact O-CB 3.11Å; K299-D303 PolarHBondContact O-N 3.37Å; D303-L306 PolarHBondContact O-N 3.19Å
304	M	69.9	Low	64.9	Low	159 Å²	159	127 Å²	127	78%	0.783	67%	0.668	S	S	*	*	H	α-helix	trans	-76.3	-24.6	176.6	-151.6	165.5	88.2	0	0	112.9	A300 L306	A300-M304 WeakPolarHBondContact O-CB 3.05Å; A300-M304 PolarHBondContact O-N 3.16Å; A300-M304 VanDerWaalsContact O-N 3.07Å; M304-L306 VanDerWaalsContact C-N 3.32Å
305	S	61.8	Low	62.4	Low	103 Å²	103	128.4 Å²	128.4	72%	0.72	67%	0.674	S	S	*	*	H	α-helix	trans	-78.3	-13.2	173.3	-171	0	0	0	0	113.5	K301 S302	K301-S305 PolarHBondContact O-N 3.34Å; K301-S305 VanDerWaalsContact O-N 3.1Å; S302-S305 PolarHBondContact O-N 2.99Å
306	L	56.8	Low	60	Low	152 Å²	152	125.8 Å²	125.8	80%	0.796	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100	3.4	-178	-107.3	95.4	0	0	0	114.8	S302 D303 M304	S302-L306 PolarHBondContact O-N 3.23Å; D303-L306 PolarHBondContact O-N 3.19Å; M304-L306 VanDerWaalsContact C-N 3.32Å
307	K	47.8	Very low	57.6	Low	173 Å²	173	127.8 Å²	127.8	75%	0.752	69%	0.685	S	S	*	*	S	Bend	trans	-147.3	130.1	175.1	-83.6	177.7	172.7	177.3	0	108.8
308	P	42	Very low	55.3	Low	122 Å²	122	130 Å²	130	79%	0.792	70%	0.698	S	S	*	*			cis	-130.9	144.7	-3.4	34.8	-15.7	0	0	0	115.1
309	T	39.3	Very low	53.1	Low	147 Å²	147	127.5 Å²	127.5	90%	0.902	70%	0.699	S	S	*	*			trans	-135	81	149.5	18.1	0	0	0	0	107.8
310	L	41.3	Very low	50.7	Low	162 Å²	162	129.4 Å²	129.4	85%	0.848	72%	0.715	S	S	*	*			trans	-142.5	86.2	169.7	-96.3	171.2	0	0	0	107.9
311	T	41.3	Very low	48.6	Very low	132 Å²	132	131.1 Å²	131.1	81%	0.81	72%	0.723	S	S	*	*			trans	153.7	120.6	165.5	37.6	0	0	0	0	104.4
312	E	37.9	Very low	46.7	Very low	162 Å²	162	131.4 Å²	131.4	76%	0.757	73%	0.727	S	S	*	*			cis	-166.8	150.6	25.9	-99.4	170.1	154.5	0	0	108.3
313	N	36.2	Very low	44.9	Very low	122 Å²	122	136.5 Å²	136.5	65%	0.652	75%	0.746	S	S	*	*			trans	56	113.5	141.3	-58.5	-20.1	0	0	0	121.6
314	H	40.5	Very low	43.2	Very low	147 Å²	147	138.4 Å²	138.4	68%	0.681	75%	0.754	S	S	*	*				157	134	96.9	-99.3	-63.6	0	0	0	111.4
315	Q	39.1	Very low	41.6	Very low	162 Å²	162	135.9 Å²	135.9	76%	0.757	75%	0.752	S	S	*	*			trans	49.7	130.1	139.2	-71.8	159.7	-26.9	0	0	117.8
316	S	38.4	Very low	40.7	Very low	90 Å²	90	136.7 Å²	136.7	63%	0.629	76%	0.758	S	S	*	*			cis	167.5	158.8	34.3	36.7	0	0	0	0	108.1
317	N	38.8	Very low	39.7	Very low	144 Å²	144	133 Å²	133	77%	0.77	76%	0.756	S	S	*	*			trans	69.1	103.9	154.4	-59.7	-9.6	0	0	0	117.7
318	S	39.1	Very low	39.3	Very low	101 Å²	101	131 Å²	131	71%	0.706	76%	0.761	S	S	*	*				83	131.8	73.4	75.2	0	0	0	0	114.8
319	S	40.7	Very low	39	Very low	103 Å²	103	131 Å²	131	72%	0.72	76%	0.764	S	S	*	*			trans	75.5	106	163.7	76.1	0	0	0	0	118.7
320	L	35.9	Very low	39	Very low	167 Å²	167	129 Å²	129	87%	0.874	76%	0.756	S	S	*	*				-172.7	145.6	97.4	-125.1	88.3	0	0	0	110.5
321	S	39.3	Very low	38.7	Very low	92 Å²	92	126.8 Å²	126.8	64%	0.643	75%	0.754	S	S	*	*			trans	-82.5	156.3	-169.5	37.4	0	0	0	0	115
322	E	41.7	Very low	38.4	Very low	170 Å²	170	127.6 Å²	127.6	79%	0.794	75%	0.753	S	S	*	*			trans	64.8	130.4	145.2	-76.4	177.2	179.6	0	0	117.2
323	Q	41.2	Very low	38.3	Very low	157 Å²	157	130.7 Å²	130.7	73%	0.734	76%	0.76	S	S	*	*			cis	179	151.3	48.4	-126.9	176.6	1	0	0	109.5
324	I	38.7	Very low	38.1	Very low	140 Å²	140	130.3 Å²	130.3	72%	0.718	77%	0.766	S	S	*	*			trans	88.2	101.5	144.9	-58.1	159.6	0	0	0	120.6
325	S	36.7	Very low	37.8	Very low	105 Å²	105	128.7 Å²	128.7	73%	0.734	77%	0.767	S	S	*	*				57	115.4	122.4	-160.3	0	0	0	0	122
326	S	41.6	Very low	37.5	Very low	120 Å²	120	126 Å²	126	84%	0.839	77%	0.766	S	S	*	*				142.9	135	115.1	62.6	0	0	0	0	114.3
327	G	36.8	Very low	37.3	Very low	74 Å²	74	128.9 Å²	128.9	76%	0.763	77%	0.774	S	S	*	*			trans	109.7	128.9	155.6	0	0	0	0	0	117.4
328	P	39.3	Very low	37.3	Very low	132 Å²	132	126.7 Å²	126.7	86%	0.857	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-90.3	150.2	-161	36.7	-35.2	0	0	0	114.8
329	S	35.5	Very low	37.1	Very low	121 Å²	121	129.8 Å²	129.8	85%	0.846	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-74.9	119	176	54.8	0	0	0	0	112.5
330	S	39.5	Very low	36.8	Very low	106 Å²	106	130 Å²	130	74%	0.741	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-82.1	133.3	165.6	51.4	0	0	0	0	110.9
331	S	35.4	Very low	36.7	Very low	115 Å²	115	129.4 Å²	129.4	80%	0.804	76%	0.759	S	S	*	*			trans	-93.8	103.7	167.8	47.4	0	0	0	0	109.3
332	N	35.1	Very low	36.4	Very low	149 Å²	149	127.7 Å²	127.7	80%	0.797	75%	0.747	S	S	*	*			trans	-108.2	105.4	167.3	-86.1	-18.8	0	0	0	109.4	S334	N332-S334 PolarHBondContact O-N 3.4Å
333	Y	35.3	Very low	36.1	Very low	228 Å²	228	124.6 Å²	124.6	89%	0.894	74%	0.739	S	S	*	*			trans	-74.4	108.7	157.8	-107.9	-94.7	0	0	0	107.6
334	S	32.2	Very low	35.8	Very low	113 Å²	113	119.9 Å²	119.9	79%	0.79	72%	0.717	S	S	*	*			trans	-109.9	107.3	170.7	178.9	0	0	0	0	108.8	N332	N332-S334 PolarHBondContact O-N 3.4Å
335	T	34.8	Very low	35.6	Very low	113 Å²	113	117.3 Å²	117.3	69%	0.693	71%	0.711	S	S	*	*			trans	-101.7	104.8	168.2	44.9	0	0	0	0	109.4
336	S	31.9	Very low	35.7	Very low	105 Å²	105	118 Å²	118	73%	0.734	71%	0.707	S	S	*	*			trans	54.2	74.6	137	-43.9	0	0	0	0	118.9
337	D	34	Very low	35.4	Very low	151 Å²	151	117.1 Å²	117.1	81%	0.807	69%	0.692	S	S	*	*			trans	-93.5	13.1	167.2	-92.9	-30.4	0	0	0	114.1
338	S	39.7	Very low	35.1	Very low	98 Å²	98	120 Å²	120	69%	0.685	69%	0.691	S	S	*	*			trans	-90.9	1	-168.4	53.4	0	0	0	0	116.9
339	E	35.1	Very low	34.7	Very low	166 Å²	166	122.6 Å²	122.6	78%	0.776	69%	0.688	S	S	*	*	S	Bend	trans	-100.9	-11	-178.3	-71.7	-167.5	141.8	0	0	115.2
340	L	34.3	Very low	34.5	Very low	107 Å²	107	125.4 Å²	125.4	56%	0.56	69%	0.686	S	S	*	*	S	Bend	trans	-95.1	-17	-176.4	-124.9	89	0	0	0	115.6	Y52 S342	Y52-L340 HydrophobicContact CD1-CD2 3.7Å; Y52-L340 HydrophobicContact CE1-CD1 4.47Å; Y52-L340 HydrophobicContact CE1-CD2 4.21Å; L340-S342 PolarHBondContact O-N 2.91Å
341	E	33.9	Very low	34.1	Very low	156 Å²	156	126.4 Å²	126.4	73%	0.729	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-77.7	-19.2	-174.3	-76.1	-169.2	145.1	0	0	114.5	V343 H344	E341-V343 VanDerWaalsContact C-N 3.3Å; E341-V343 PolarHBondContact O-N 3.13Å; E341-H344 PolarHBondContact O-N 3.4Å
342	S	32.6	Very low	33.8	Very low	55 Å²	55	125.2 Å²	125.2	39%	0.385	68%	0.679	S	S	.	*	G	3₁₀ helix	trans	-76.9	-13.7	-176.3	78.3	0	0	0	0	115.1	L340	L340-S342 PolarHBondContact O-N 2.91Å
343	V	34.1	Very low	33.6	Very low	105 Å²	105	124 Å²	124	64%	0.636	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-93.3	-15.4	172.9	-179.8	0	0	0	0	110.9	E341	E341-V343 VanDerWaalsContact C-N 3.3Å; E341-V343 PolarHBondContact O-N 3.13Å
344	H	35	Very low	33.5	Very low	59 Å²	59	122.2 Å²	122.2	27%	0.273	68%	0.679	S	S	.	*	G	3₁₀ helix	trans	-83.8	-22	-171.1	-125.2	-20.4	0	0	0	114.3	K54 E341 D346 L347	K54-H344 VanDerWaalsContact CE-NE2 3.3Å; K54-H344 WeakPolarHBondContact CE-NE2 3.48Å; K54-H344 PolarHBondContact NZ-NE2 3.26Å; E341-H344 PolarHBondContact O-N 3.4Å; H344-D346 VanDerWaalsContact C-N 3.27Å; H344-D346 PolarHBondContact O-N 2.93Å; H344-L347 PolarHBondContact O-N 3.28Å; H344-L347 VanDerWaalsContact O-N 3.15Å
345	S	35.5	Very low	33.3	Very low	85 Å²	85	123.8 Å²	123.8	59%	0.594	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-71.4	-12.2	-175.4	68.5	0	0	0	0	115.6
346	D	37.4	Very low	33.2	Very low	119 Å²	119	126.3 Å²	126.3	64%	0.636	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-93.6	2.8	174.9	-74.2	-25	0	0	0	112.6	R288 H344	R288-D346 IonicContact CZ-OD2 3.87Å; R288-D346 IonicContact NH2-OD2 3.07Å; R288-D346 PolarHBondContact NH2-OD2 3.21Å; H344-D346 VanDerWaalsContact C-N 3.27Å; H344-D346 PolarHBondContact O-N 2.93Å
347	L	36.6	Very low	33	Very low	102 Å²	102	128.3 Å²	128.3	53%	0.534	69%	0.689	S	S	.	*			trans	-115.3	3.2	-176.2	-78.9	164	0	0	0	114.6	H344 F349	H344-L347 PolarHBondContact O-N 3.28Å; H344-L347 VanDerWaalsContact O-N 3.15Å; L347-F349 PolarHBondContact O-N 3.35Å
348	D	29.7	Very low	32.7	Very low	136 Å²	136	128.2 Å²	128.2	73%	0.727	69%	0.689	S	S	*	*			trans	-81.5	82	173.5	-75	-29.2	0	0	0	110.6
349	F	31.1	Very low	32.2	Very low	185 Å²	185	130.8 Å²	130.8	81%	0.811	70%	0.695	S	S	*	*			trans	-85.3	110.5	163.1	-165.6	-95	0	0	0	109.4	L347 V351	L347-F349 PolarHBondContact O-N 3.35Å; F349-V351 HydrophobicContact CD1-CG2 4.49Å; F349-V351 PolarHBondContact O-N 3.41Å
350	K	31.1	Very low	31.7	Very low	181 Å²	181	127.6 Å²	127.6	79%	0.787	69%	0.691	S	S	*	*			trans	-66.2	107.2	174	-157.8	177.1	-172.4	-177.6	0	109.1	S352	K350-S352 PolarHBondContact O-N 3.49Å
351	V	31.8	Very low	31.5	Very low	127 Å²	127	129.5 Å²	129.5	77%	0.77	70%	0.701	S	S	*	*			trans	-80.3	105.5	162	177.7	0	0	0	0	106.5	F349	F349-V351 HydrophobicContact CD1-CG2 4.49Å; F349-V351 PolarHBondContact O-N 3.41Å
352	S	29.2	Very low	31.2	Very low	90 Å²	90	127.6 Å²	127.6	63%	0.629	71%	0.705	S	S	*	*			trans	-74.9	132.1	165.8	-79.3	0	0	0	0	109.1	K350	K350-S352 PolarHBondContact O-N 3.49Å
353	P	30.7	Very low	31	Very low	123 Å²	123	132 Å²	132	80%	0.799	72%	0.723	S	S	*	*			trans	-83.9	113.8	168	31.7	-24.9	0	0	0	108
354	E	32.1	Very low	30.8	Very low	191 Å²	191	136 Å²	136	89%	0.893	73%	0.728	S	S	*	*			trans	-109.4	125	163.5	-148.4	166.5	-162.2	0	0	107.5
355	N	28.9	Very low	30.6	Very low	145 Å²	145	137.1 Å²	137.1	78%	0.775	74%	0.741	S	S	*	*			trans	-57.2	131.9	-175.6	-68.6	-41.8	0	0	0	110.9
356	D	31.5	Very low	30.3	Very low	166 Å²	166	137.5 Å²	137.5	89%	0.888	74%	0.736	S	S	*	*			trans	-151.5	128.4	137.5	-95	-31.9	0	0	0	110.3
357	L	28.7	Very low	30.1	Very low	148 Å²	148	134.6 Å²	134.6	78%	0.775	73%	0.725	S	S	*	*			trans	-67.3	156.7	-179	-74.1	112.8	0	0	0	111.9
358	N	27.7	Very low	29.9	Very low	149 Å²	149	132.8 Å²	132.8	80%	0.797	72%	0.721	S	S	*	*			trans	72	86.7	160.6	-60.8	-17	0	0	0	117.7
359	N	29.1	Very low	30.1	Very low	152 Å²	152	131.7 Å²	131.7	81%	0.813	71%	0.711	S	S	*	*				-175.6	121.3	111.7	-123.9	-23.1	0	0	0	110.9	N361	N359-N361 PolarHBondContact O-N 2.84Å
360	S	25.4	Very low	30.1	Very low	99 Å²	99	126.2 Å²	126.2	69%	0.692	69%	0.691	S	S	*	*			trans	-55.2	112.5	159.4	41.9	0	0	0	0	110.4
361	N	28.3	Very low	30.4	Very low	146 Å²	146	120.5 Å²	120.5	78%	0.781	67%	0.668	S	S	*	*			trans	-172.1	141.8	149.2	-90.8	-29.2	0	0	0	111.5	N359 I363	N359-N361 PolarHBondContact O-N 2.84Å; N361-I363 PolarHBondContact O-N 3.42Å
362	S	28.1	Very low	30.6	Very low	116 Å²	116	119 Å²	119	81%	0.811	66%	0.655	S	S	*	*			trans	-48.8	112.5	-169.8	62.5	0	0	0	0	115.4	Y364	S362-Y364 PolarHBondContact O-N 3.4Å
363	I	28.1	Very low	30.7	Very low	148 Å²	148	119 Å²	119	76%	0.759	65%	0.648	S	S	*	*			trans	-91	77.3	172.4	-54.8	175.8	0	0	0	109.2	N361	N361-I363 PolarHBondContact O-N 3.42Å
364	Y	31.6	Very low	30.9	Very low	188 Å²	188	118 Å²	118	74%	0.737	64%	0.636	S	S	*	*			trans	-149.9	75.1	153.2	-79	-73.4	0	0	0	108.4	S362	S362-Y364 PolarHBondContact O-N 3.4Å
365	P	29.9	Very low	31	Very low	84 Å²	84	111.8 Å²	111.8	55%	0.545	61%	0.609	S	S	.	*			trans	-76	133	170.1	20.4	-10.1	0	0	0	109.2	S367	P365-S367 PolarHBondContact O-N 3.05Å
366	N	29.1	Very low	31.2	Very low	92 Å²	92	109.3 Å²	109.3	49%	0.492	59%	0.594	S	S	.	*			trans	-37.8	116.7	-179.3	-75.7	-39.9	0	0	0	113.2	S368 Q369	N366-S368 PolarHBondContact O-N 3.45Å; N366-Q369 PolarHBondContact ND2-OE1 2.59Å; N366-Q369 PolarHBondContact O-N 2.89Å
367	S	32.7	Very low	31.1	Very low	59 Å²	59	108.5 Å²	108.5	41%	0.413	58%	0.583	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.5	0.7	179.1	51.1	0	0	0	0	115.1	H63 P365	H63-S367 PolarHBondContact CE1-OG 3.06Å; H63-S367 WeakPolarHBondContact NE2-CB 3.34Å; H63-S367 PolarHBondContact NE2-OG 3.35Å; P365-S367 PolarHBondContact O-N 3.05Å
368	S	33.4	Very low	31.3	Very low	63 Å²	63	107.7 Å²	107.7	44%	0.441	58%	0.579	S	S	.	*	T	Hydrogen-bonded Turn	trans	-101.3	-15.7	173.1	40	0	0	0	0	113.7	N366	N366-S368 PolarHBondContact O-N 3.45Å
369	Q	32.5	Very low	31.7	Very low	113 Å²	113	104.7 Å²	104.7	53%	0.528	57%	0.566	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94.9	-34.8	177.8	-83.5	162.7	-45.6	0	0	112.8	N366 L371 I372	N366-Q369 PolarHBondContact ND2-OE1 2.59Å; N366-Q369 PolarHBondContact O-N 2.89Å; Q369-L371 PolarHBondContact O-N 2.91Å; Q369-I372 PolarHBondContact O-N 3.22Å; Q369-I372 VanDerWaalsContact O-N 3.13Å
370	N	32.2	Very low	31.9	Very low	71 Å²	71	105.5 Å²	105.5	38%	0.38	56%	0.564	S	S	.	*	H	α-helix	trans	-75.7	-6.5	178.4	-67.3	-14.4	0	0	0	114.4	I372	N370-I372 VanDerWaalsContact C-N 3.3Å
371	L	38.1	Very low	31.9	Very low	61 Å²	61	112 Å²	112	32%	0.319	57%	0.574	S	S	.	*	H	α-helix	trans	-82.8	-8.2	170.4	-73.2	179	0	0	0	113.8	Q369	Q369-L371 PolarHBondContact O-N 2.91Å
372	I	35.1	Very low	32	Very low	94 Å²	94	112.6 Å²	112.6	48%	0.482	59%	0.589	S	S	.	*	H	α-helix	trans	-108.2	-32.3	-176.2	-60	174.3	0	0	0	110.2	Q369 N370 I376	Q369-I372 PolarHBondContact O-N 3.22Å; Q369-I372 VanDerWaalsContact O-N 3.13Å; N370-I372 VanDerWaalsContact C-N 3.3Å; I372-I376 WeakPolarHBondContact O-CD1 3.25Å
373	D	31.4	Very low	32.2	Very low	91 Å²	91	112.5 Å²	112.5	49%	0.487	58%	0.578	S	S	.	*	H	α-helix	trans	-89.9	-31.4	-179.1	-78.8	-32.1	0	0	0	115.5	D375 I376 K377	D373-D375 VanDerWaalsContact C-N 3.3Å; D373-D375 PolarHBondContact O-N 3.18Å; D373-I376 PolarHBondContact O-N 2.87Å; D373-K377 PolarHBondContact O-N 3.3Å
374	D	34.3	Very low	32.4	Very low	101 Å²	101	110.6 Å²	110.6	54%	0.54	57%	0.569	S	S	.	*	H	α-helix	trans	-73.8	-21.8	179.5	-76	-24.5	0	0	0	113.1
375	D	34.8	Very low	32.5	Very low	62 Å²	62	106.3 Å²	106.3	33%	0.332	56%	0.559	S	S	.	*	H	α-helix	trans	-84.2	-10	176.4	-102.6	-39.9	0	0	0	113.3	K264 D373	K264-D375 IonicContact NZ-OD1 3.95Å; K264-D375 PolarHBondContact NZ-OD1 3.36Å; K264-D375 IonicContact NZ-OD2 2.61Å; D373-D375 VanDerWaalsContact C-N 3.3Å; D373-D375 PolarHBondContact O-N 3.18Å
376	I	32.6	Very low	32.6	Very low	92 Å²	92	107.6 Å²	107.6	47%	0.472	56%	0.56	S	S	.	*	H	α-helix	trans	-96.1	-33	175.9	-67.4	175.3	0	0	0	111	I372 D373 L378 V379	I372-I376 WeakPolarHBondContact O-CD1 3.25Å; D373-I376 PolarHBondContact O-N 2.87Å; I376-L378 VanDerWaalsContact C-N 3.34Å; I376-L378 PolarHBondContact O-N 3.02Å; I376-V379 PolarHBondContact O-N 3.15Å
377	K	29.1	Very low	32.8	Very low	150 Å²	150	108.6 Å²	108.6	65%	0.652	57%	0.565	S	S	*	*	H	α-helix	trans	-73.3	-19	178.4	-73.6	-179.6	178.8	174.6	0	114.9	D373	D373-K377 PolarHBondContact O-N 3.3Å
378	L	33.1	Very low	32.8	Very low	130 Å²	130	111.9 Å²	111.9	68%	0.681	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	-7.5	177.3	-77	166.7	0	0	0	114.5	I376	I376-L378 VanDerWaalsContact C-N 3.34Å; I376-L378 PolarHBondContact O-N 3.02Å
379	V	36.4	Very low	32.8	Very low	87 Å²	87	115.4 Å²	115.4	53%	0.527	58%	0.584	S	S	.	*	S	Bend	trans	-95	-9.3	176.3	177.9	0	0	0	0	112.1	I376	I376-V379 PolarHBondContact O-N 3.15Å
380	H	33.1	Very low	32.8	Very low	168 Å²	168	115.5 Å²	115.5	78%	0.778	59%	0.589	S	S	*	*	S	Bend	trans	-108.2	16.7	176.9	-87.2	-70.1	0	0	0	113.9
381	R	26.3	Very low	32.9	Very low	236 Å²	236	119.3 Å²	119.3	89%	0.891	61%	0.606	S	S	*	*			trans	-138.2	19.7	-177.3	-113.1	-175	-175.1	-170.2	1.5	116.1
382	S	30.2	Very low	32.4	Very low	159 Å²	159	124.5 Å²	124.5	100%	1.112	63%	0.632	S	S	*	*			trans	-140.4	0	165.9	64.6	0	0	0	0	108.2

Retrieved 382 of 382 residues in 320.3 ms (Link to these results)

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