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Aquaporin-3

Aquaglyceroporin that may modulate the water content and osmolytes during anhydrobiosis.

AlphaFold DB , UniProt , Accession A0A061ADS9, Species CAEEL (Caenorhabditis elegans), Gene aqp-3, Length 322 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	59.5	Low	83.9	Confident	235 Å²	235	140.5 Å²	140.5	100%	1.158	66%	0.661	S	S	*	*				0	108.3	0	-160.5	167.7	-176.6	0	0	106.9	Y3	M1-Y3 PolarHBondContact O-N 3.11Å
2	M	67.6	Low	84.4	Confident	185 Å²	185	138.2 Å²	138.2	91%	0.911	67%	0.667	S	S	*	*			trans	-80	113.8	-175.9	-167	173.2	161.4	0	0	107.9	I4	M2-I4 PolarHBondContact O-N 2.9Å
3	Y	78	Confident	85	Confident	225 Å²	225	139.5 Å²	139.5	88%	0.882	67%	0.668	S	S	*	*			trans	-59.2	124.7	177.4	-75.9	-87.8	0	0	0	109.4	M1 N5	M1-Y3 PolarHBondContact O-N 3.11Å; Y3-N5 PolarHBondContact O-N 3.4Å
4	I	81.4	Confident	85.4	Confident	114 Å²	114	140.4 Å²	140.4	59%	0.585	67%	0.667	S	S	*	*			trans	-76.2	111.7	175.7	-64.9	173	0	0	0	107.7	M2 H6	M2-I4 PolarHBondContact O-N 2.9Å; I4-H6 PolarHBondContact O-N 2.84Å; I4-H6 VanDerWaalsContact O-N 3.11Å
5	N	90.6	Very high	85.8	Confident	90 Å²	90	135.6 Å²	135.6	48%	0.481	66%	0.661	S	S	.	*			trans	-72.1	103.1	170.3	-175.4	-26.9	0	0	0	109.2	Y3 V7 E8 R9	Y3-N5 PolarHBondContact O-N 3.4Å; N5-V7 PolarHBondContact O-N 3.25Å; N5-V7 WeakPolarHBondContact OD1-CA 3.35Å; N5-V7 VanDerWaalsContact OD1-CB 3.32Å; N5-V7 WeakPolarHBondContact OD1-CB 3.48Å; N5-V7 PolarHBondContact OD1-N 3.27Å; N5-E8 HydrophobicContact CB-CB 4.23Å; N5-E8 HydrophobicContact CB-CG 4.35Å; N5-E8 PolarHBondContact O-N 3.07Å; N5-E8 PolarHBondContact OD1-N 3.08Å; N5-R9 PolarHBondContact O-N 3.45Å; N5-R9 VanDerWaalsContact O-N 3.11Å
6	H	90.9	Very high	86.3	Confident	132 Å²	132	131.4 Å²	131.4	61%	0.611	64%	0.641	S	S	*	*	H	α-helix	trans	-59.9	-32.1	179.9	-68.3	-74.9	0	0	0	112.8	I4 R9 L10	I4-H6 PolarHBondContact O-N 2.84Å; I4-H6 VanDerWaalsContact O-N 3.11Å; H6-R9 PolarHBondContact O-N 3.11Å; H6-L10 WeakPolarHBondContact O-CB 3.32Å; H6-L10 VanDerWaalsContact O-CG 3.28Å; H6-L10 WeakPolarHBondContact O-CG 3.06Å; H6-L10 PolarHBondContact O-N 3.48Å; H6-L10 VanDerWaalsContact O-N 3.08Å
7	V	90.7	Very high	86.6	Confident	103 Å²	103	128.2 Å²	128.2	62%	0.624	65%	0.65	S	S	*	*	H	α-helix	trans	-67.2	-50.4	179	-179.5	0	0	0	0	110.4	N5 R9 L10 K11	N5-V7 PolarHBondContact O-N 3.25Å; N5-V7 WeakPolarHBondContact OD1-CA 3.35Å; N5-V7 VanDerWaalsContact OD1-CB 3.32Å; N5-V7 WeakPolarHBondContact OD1-CB 3.48Å; N5-V7 PolarHBondContact OD1-N 3.27Å; V7-R9 PolarHBondContact O-N 2.89Å; V7-L10 PolarHBondContact O-N 3.18Å; V7-L10 VanDerWaalsContact O-N 3.07Å; V7-K11 PolarHBondContact O-N 3.29Å
8	E	90.5	Very high	87.2	Confident	101 Å²	101	125.9 Å²	125.9	47%	0.472	64%	0.64	S	S	.	*	H	α-helix	trans	-63.8	-31.8	178.2	-70.4	-58.7	143.5	0	0	112	N5 K11 P12	N5-E8 HydrophobicContact CB-CB 4.23Å; N5-E8 HydrophobicContact CB-CG 4.35Å; N5-E8 PolarHBondContact O-N 3.07Å; N5-E8 PolarHBondContact OD1-N 3.08Å; E8-K11 IonicContact OE1-NZ 3.48Å; E8-K11 WeakPolarHBondContact OE2-CD 3.28Å; E8-K11 IonicContact OE2-NZ 3.94Å; E8-K11 PolarHBondContact OE2-NZ 3.31Å; E8-P12 WeakPolarHBondContact O-CD 3.5Å
9	R	91.3	Very high	87.7	Confident	165 Å²	165	124.1 Å²	124.1	62%	0.623	63%	0.629	S	S	*	*	H	α-helix	trans	-67.2	-34.5	173.6	-173.1	178.6	179.3	-171.3	-0	113.1	N5 H6 V7	N5-R9 PolarHBondContact O-N 3.45Å; N5-R9 VanDerWaalsContact O-N 3.11Å; H6-R9 PolarHBondContact O-N 3.11Å; V7-R9 PolarHBondContact O-N 2.89Å
10	L	92.5	Very high	88.1	Confident	82 Å²	82	120.5 Å²	120.5	43%	0.429	61%	0.611	S	S	.	*	H	α-helix	trans	-87	-23.3	-179	-69.3	-179.7	0	0	0	112.9	H6 V7 K13 F14	H6-L10 WeakPolarHBondContact O-CB 3.32Å; H6-L10 VanDerWaalsContact O-CG 3.28Å; H6-L10 WeakPolarHBondContact O-CG 3.06Å; H6-L10 PolarHBondContact O-N 3.48Å; H6-L10 VanDerWaalsContact O-N 3.08Å; V7-L10 PolarHBondContact O-N 3.18Å; V7-L10 VanDerWaalsContact O-N 3.07Å; L10-K13 HydrophobicContact CD2-CD 4.43Å; L10-K13 WeakPolarHBondContact O-CA 3.37Å; L10-K13 WeakPolarHBondContact O-CB 3.35Å; L10-K13 PolarHBondContact O-N 3.35Å; L10-F14 HydrophobicContact CB-CD2 4.08Å; L10-F14 HydrophobicContact CB-CE2 4.3Å; L10-F14 HydrophobicContact CD2-CE2 4.16Å; L10-F14 PolarHBondContact O-N 2.95Å
11	K	90.3	Very high	88.6	Confident	114 Å²	114	118.8 Å²	118.8	50%	0.496	60%	0.602	S	S	.	*	H	α-helix	trans	-50.6	-47.5	-177.5	179	-178.6	-177.9	179.6	0	113.9	V7 E8 K13 F14 A15	V7-K11 PolarHBondContact O-N 3.29Å; E8-K11 IonicContact OE1-NZ 3.48Å; E8-K11 WeakPolarHBondContact OE2-CD 3.28Å; E8-K11 IonicContact OE2-NZ 3.94Å; E8-K11 PolarHBondContact OE2-NZ 3.31Å; K11-K13 PolarHBondContact O-N 3.29Å; K11-K13 VanDerWaalsContact O-N 3.11Å; K11-F14 PolarHBondContact O-N 3.11Å; K11-A15 HydrophobicContact CG-CB 4.31Å; K11-A15 WeakPolarHBondContact O-CB 3.18Å; K11-A15 PolarHBondContact O-N 3.27Å
12	P	89.6	Confident	90.4	Very high	112 Å²	112	112.3 Å²	112.3	73%	0.727	57%	0.565	S	S	*	*	H	α-helix	trans	-62.2	-21.7	178	-21.9	33.2	0	0	0	114.2	E8	E8-P12 WeakPolarHBondContact O-CD 3.5Å
13	K	91.7	Very high	91.8	Very high	156 Å²	156	103.5 Å²	103.5	68%	0.678	52%	0.522	S	S	*	.	H	α-helix	trans	-86.5	-30.3	-178.3	-59	-174.6	176.1	-171.9	0	113.3	L10 K11	L10-K13 HydrophobicContact CD2-CD 4.43Å; L10-K13 WeakPolarHBondContact O-CA 3.37Å; L10-K13 WeakPolarHBondContact O-CB 3.35Å; L10-K13 PolarHBondContact O-N 3.35Å; K11-K13 PolarHBondContact O-N 3.29Å; K11-K13 VanDerWaalsContact O-N 3.11Å
14	F	91.6	Very high	92.8	Very high	151 Å²	151	95.3 Å²	95.3	66%	0.662	49%	0.491	S	S	*	.	H	α-helix	trans	-117.7	-11.4	-172.9	-64.7	-72	0	0	0	114	L10 K11 I16	L10-F14 HydrophobicContact CB-CD2 4.08Å; L10-F14 HydrophobicContact CB-CE2 4.3Å; L10-F14 HydrophobicContact CD2-CE2 4.16Å; L10-F14 PolarHBondContact O-N 2.95Å; K11-F14 PolarHBondContact O-N 3.11Å; F14-I16 PolarHBondContact O-N 3.28Å
15	A	90.6	Very high	93.6	Very high	69 Å²	69	93.8 Å²	93.8	57%	0.57	48%	0.483	S	S	*	.			trans	-64.3	123.2	178.2	0	0	0	0	0	110.5	K11	K11-A15 HydrophobicContact CG-CB 4.31Å; K11-A15 WeakPolarHBondContact O-CB 3.18Å; K11-A15 PolarHBondContact O-N 3.27Å
16	I	94.1	Very high	94	Very high	68 Å²	68	90 Å²	90	35%	0.349	47%	0.465	S	S	.	.			trans	-85.2	129.8	176.6	-65.9	158.4	0	0	0	108.2	F14 N18 I21 R22 L25	F14-I16 PolarHBondContact O-N 3.28Å; I16-N18 HydrophobicContact CG2-CB 4.32Å; I16-I21 HydrophobicContact CD1-CG2 4.06Å; I16-I21 HydrophobicContact CG2-CB 3.93Å; I16-I21 HydrophobicContact CG2-CG2 3.85Å; I16-R22 HydrophobicContact CB-CG 4.04Å; I16-R22 HydrophobicContact CG2-CG 4.04Å; I16-R22 WeakPolarHBondContact O-CD 3.23Å; I16-R22 WeakPolarHBondContact O-CG 3.44Å; I16-L25 HydrophobicContact CD1-CD1 3.3Å
17	G	91.9	Very high	94.4	Very high	77 Å²	77	83.7 Å²	83.7	79%	0.794	44%	0.436	S	S	*	.			trans	-82.1	-32	176.7	0	0	0	0	0	113.8	E19	G17-E19 PolarHBondContact O-N 3.02Å
18	N	96.7	Very high	94.8	Very high	87 Å²	87	80.5 Å²	80.5	47%	0.465	42%	0.415	S	S	.	.			trans	-69.1	119.8	-177.5	-175.2	-69.7	0	0	0	111.1	I16 L20 I21 R22	I16-N18 HydrophobicContact CG2-CB 4.32Å; N18-L20 PolarHBondContact O-N 3.01Å; N18-L20 WeakPolarHBondContact OD1-CB 3.32Å; N18-L20 PolarHBondContact OD1-N 3.47Å; N18-I21 HydrophobicContact CB-CB 4.22Å; N18-I21 HydrophobicContact CB-CD1 3.9Å; N18-I21 HydrophobicContact CB-CG1 4.04Å; N18-I21 PolarHBondContact O-N 3.07Å; N18-I21 PolarHBondContact OD1-N 3.27Å; N18-R22 WeakPolarHBondContact O-CG 3.47Å; N18-R22 PolarHBondContact O-N 3.38Å
19	E	96.1	Very high	95.2	Very high	92 Å²	92	81.9 Å²	81.9	43%	0.43	42%	0.419	S	S	.	.	H	α-helix	trans	-65.9	-37.7	-174	-172.8	-107.2	144.6	0	0	113	G17 R22 A23 R99	G17-E19 PolarHBondContact O-N 3.02Å; E19-R22 PolarHBondContact O-N 3.39Å; E19-A23 WeakPolarHBondContact O-CB 3.42Å; E19-A23 PolarHBondContact O-N 3.12Å; E19-R99 IonicContact OE1-CZ 3.79Å; E19-R99 IonicContact OE1-NH1 2.76Å; E19-R99 PolarHBondContact OE1-NH1 3.37Å; E19-R99 IonicContact OE1-NH2 2.71Å; E19-R99 PolarHBondContact OE1-NH2 3.46Å; E19-R99 IonicContact OE2-CZ 3.85Å; E19-R99 IonicContact OE2-NH2 3.14Å; E19-R99 PolarHBondContact OE2-NH2 2.91Å
20	L	97.1	Very high	95.5	Very high	52 Å²	52	74.2 Å²	74.2	27%	0.272	39%	0.391	S	S	.	.	H	α-helix	trans	-68.8	-38.8	177.8	-172.2	61.1	0	0	0	112.3	N18 A23 F24 I98 R99 V102	N18-L20 PolarHBondContact O-N 3.01Å; N18-L20 WeakPolarHBondContact OD1-CB 3.32Å; N18-L20 PolarHBondContact OD1-N 3.47Å; L20-A23 PolarHBondContact O-N 3.43Å; L20-F24 WeakPolarHBondContact O-CB 3.29Å; L20-F24 PolarHBondContact O-N 3.48Å; L20-I98 HydrophobicContact CD2-CG2 4.3Å; L20-R99 HydrophobicContact CD1-CB 4.42Å; L20-R99 HydrophobicContact CD1-CG 4.33Å; L20-V102 HydrophobicContact CD1-CB 4.09Å; L20-V102 HydrophobicContact CD1-CG1 3.87Å; L20-V102 HydrophobicContact CD1-CG2 4.22Å; L20-V102 HydrophobicContact CD2-CG2 4.17Å; L20-V102 HydrophobicContact CG-CG1 4.17Å; L20-V102 HydrophobicContact CG-CG2 4.33Å
21	I	97.6	Very high	95.8	Very high	84 Å²	84	70.3 Å²	70.3	43%	0.431	37%	0.371	S	S	.	.	H	α-helix	trans	-66.3	-42.5	175.1	-61.7	177.6	0	0	0	110.3	I16 N18 A23 F24 L25	I16-I21 HydrophobicContact CD1-CG2 4.06Å; I16-I21 HydrophobicContact CG2-CB 3.93Å; I16-I21 HydrophobicContact CG2-CG2 3.85Å; N18-I21 HydrophobicContact CB-CB 4.22Å; N18-I21 HydrophobicContact CB-CD1 3.9Å; N18-I21 HydrophobicContact CB-CG1 4.04Å; N18-I21 PolarHBondContact O-N 3.07Å; N18-I21 PolarHBondContact OD1-N 3.27Å; I21-A23 VanDerWaalsContact C-N 3.31Å; I21-A23 PolarHBondContact O-N 2.67Å; I21-F24 WeakPolarHBondContact O-CB 3.44Å; I21-F24 PolarHBondContact O-N 3.2Å; I21-L25 HydrophobicContact CG2-CD1 4.42Å; I21-L25 WeakPolarHBondContact O-CG 3.43Å; I21-L25 PolarHBondContact O-N 3.46Å
22	R	97.6	Very high	96.2	Very high	99 Å²	99	65.3 Å²	65.3	37%	0.374	35%	0.352	S	S	.	.	H	α-helix	trans	-59.9	-44.2	174.6	-69.3	171.4	66.1	-143.3	-6.8	111.3	I16 N18 E19 L25 A26 I76	I16-R22 HydrophobicContact CB-CG 4.04Å; I16-R22 HydrophobicContact CG2-CG 4.04Å; I16-R22 WeakPolarHBondContact O-CD 3.23Å; I16-R22 WeakPolarHBondContact O-CG 3.44Å; N18-R22 WeakPolarHBondContact O-CG 3.47Å; N18-R22 PolarHBondContact O-N 3.38Å; E19-R22 PolarHBondContact O-N 3.39Å; R22-L25 PolarHBondContact O-N 2.87Å; R22-A26 WeakPolarHBondContact O-CB 3.48Å; R22-A26 PolarHBondContact O-N 3.1Å; R22-I76 HydrophobicContact CB-CG2 3.82Å; R22-I76 WeakPolarHBondContact O-CG2 3.12Å
23	A	98	Very high	96.7	Very high	0 Å²	0	63 Å²	63	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-65.2	-41	178.2	0	0	0	0	0	112.1	E19 L20 I21 L25 A26 E27 Y103	E19-A23 WeakPolarHBondContact O-CB 3.42Å; E19-A23 PolarHBondContact O-N 3.12Å; L20-A23 PolarHBondContact O-N 3.43Å; I21-A23 VanDerWaalsContact C-N 3.31Å; I21-A23 PolarHBondContact O-N 2.67Å; A23-L25 PolarHBondContact O-N 3.36Å; A23-A26 PolarHBondContact O-N 3.46Å; A23-E27 WeakPolarHBondContact O-CB 3.45Å; A23-E27 WeakPolarHBondContact O-CG 3.4Å; A23-E27 PolarHBondContact O-N 2.99Å; A23-Y103 HydrophobicContact CB-CE1 3.64Å
24	F	98.7	Very high	97	Very high	54 Å²	54	55.9 Å²	55.9	24%	0.237	30%	0.3	C	S	.	.	H	α-helix	trans	-56.1	-49.5	172	175.2	-89.1	0	0	0	111.6	L20 I21 A26 E27 L28 V102 V105 A106 I109	L20-F24 WeakPolarHBondContact O-CB 3.29Å; L20-F24 PolarHBondContact O-N 3.48Å; I21-F24 WeakPolarHBondContact O-CB 3.44Å; I21-F24 PolarHBondContact O-N 3.2Å; F24-A26 VanDerWaalsContact C-N 3.33Å; F24-A26 PolarHBondContact O-N 3.36Å; F24-E27 PolarHBondContact O-N 3.33Å; F24-L28 HydrophobicContact CE1-CD1 3.73Å; F24-L28 HydrophobicContact CZ-CD1 4Å; F24-L28 VanDerWaalsContact O-CB 3.25Å; F24-L28 WeakPolarHBondContact O-CB 3.44Å; F24-L28 PolarHBondContact O-N 2.76Å; F24-V102 HydrophobicContact CB-CG1 3.85Å; F24-V102 HydrophobicContact CD2-CG1 3.81Å; F24-V102 HydrophobicContact CG-CG1 4.32Å; F24-V105 HydrophobicContact CE2-CG1 4.25Å; F24-A106 HydrophobicContact CD2-CB 3.51Å; F24-A106 HydrophobicContact CE2-CB 3.73Å; F24-A106 HydrophobicContact CG-CB 4.09Å; F24-A106 HydrophobicContact CZ-CB 4.46Å; F24-A106 WeakPolarHBondContact O-CB 3.13Å; F24-I109 HydrophobicContact CZ-CD1 4.1Å
25	L	98.4	Very high	97.4	Very high	81 Å²	81	48.7 Å²	48.7	42%	0.424	27%	0.268	S	S	.	.	H	α-helix	trans	-64.6	-38.4	179.2	-69.2	175.6	0	0	0	112.3	I16 I21 R22 A23 F29	I16-L25 HydrophobicContact CD1-CD1 3.3Å; I21-L25 HydrophobicContact CG2-CD1 4.42Å; I21-L25 WeakPolarHBondContact O-CG 3.43Å; I21-L25 PolarHBondContact O-N 3.46Å; R22-L25 PolarHBondContact O-N 2.87Å; A23-L25 PolarHBondContact O-N 3.36Å; L25-F29 VanDerWaalsContact O-CB 3.29Å; L25-F29 WeakPolarHBondContact O-CB 3.49Å; L25-F29 PolarHBondContact O-N 2.7Å
26	A	98.5	Very high	97.8	Very high	11 Å²	11	49 Å²	49	9%	0.091	26%	0.257	C	S	.	.	H	α-helix	trans	-65.4	-47.6	177	0	0	0	0	0	111.8	R22 A23 F24 F29 C30 I76	R22-A26 WeakPolarHBondContact O-CB 3.48Å; R22-A26 PolarHBondContact O-N 3.1Å; A23-A26 PolarHBondContact O-N 3.46Å; F24-A26 VanDerWaalsContact C-N 3.33Å; F24-A26 PolarHBondContact O-N 3.36Å; A26-F29 PolarHBondContact O-N 3.18Å; A26-C30 WeakPolarHBondContact O-CB 3.49Å; A26-C30 PolarHBondContact O-N 2.92Å; A26-C30 PolarHBondContact O-SG 3.38Å; A26-I76 HydrophobicContact CB-CB 3.86Å; A26-I76 HydrophobicContact CB-CD1 4.37Å; A26-I76 HydrophobicContact CB-CG2 3.75Å
27	E	98.8	Very high	98	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-62.9	-43.9	176	-71.5	-64.6	126.4	0	0	111.5	A23 F24 T31 S77 A79 H80 L81 Y103 A106 Q107	A23-E27 WeakPolarHBondContact O-CB 3.45Å; A23-E27 WeakPolarHBondContact O-CG 3.4Å; A23-E27 PolarHBondContact O-N 2.99Å; F24-E27 PolarHBondContact O-N 3.33Å; E27-T31 WeakPolarHBondContact O-CB 3.47Å; E27-T31 PolarHBondContact O-N 2.71Å; E27-T31 PolarHBondContact O-OG1 2.87Å; E27-S77 VanDerWaalsContact OE1-CB 3.27Å; E27-S77 WeakPolarHBondContact OE1-CB 3.5Å; E27-S77 PolarHBondContact OE1-OG 3.21Å; E27-A79 WeakPolarHBondContact OE1-CA 3.19Å; E27-H80 PolarHBondContact OE1-N 2.95Å; E27-L81 WeakPolarHBondContact OE2-CA 3.49Å; E27-L81 PolarHBondContact OE2-N 3.35Å; E27-Y103 HydrophobicContact CG-CD1 4.06Å; E27-Y103 HydrophobicContact CG-CD2 3.78Å; E27-Y103 HydrophobicContact CG-CE1 4.25Å; E27-Y103 HydrophobicContact CG-CE2 3.98Å; E27-Y103 HydrophobicContact CG-CG 3.83Å; E27-A106 HydrophobicContact CB-CB 3.74Å; E27-Q107 HydrophobicContact CB-CG 4.3Å; E27-Q107 WeakPolarHBondContact OE2-CG 3.43Å; E27-Q107 PolarHBondContact OE2-NE2 3.35Å
28	L	98.8	Very high	98.3	Very high	36 Å²	36	42.6 Å²	42.6	19%	0.188	21%	0.208	C	C	.	.	H	α-helix	trans	-58.9	-53.7	176.5	-177.8	161.2	0	0	0	111.1	F24 G32 A106 I109 G110 L113	F24-L28 HydrophobicContact CE1-CD1 3.73Å; F24-L28 HydrophobicContact CZ-CD1 4Å; F24-L28 VanDerWaalsContact O-CB 3.25Å; F24-L28 WeakPolarHBondContact O-CB 3.44Å; F24-L28 PolarHBondContact O-N 2.76Å; L28-G32 PolarHBondContact O-N 2.71Å; L28-A106 WeakPolarHBondContact CA-O 3.42Å; L28-A106 HydrophobicContact CB-CB 4.21Å; L28-I109 HydrophobicContact CD1-CB 4.26Å; L28-I109 HydrophobicContact CD1-CG2 3.72Å; L28-I109 HydrophobicContact CG-CG2 4.17Å; L28-G110 WeakPolarHBondContact O-CA 3.49Å; L28-L113 HydrophobicContact CD2-CD1 4.34Å
29	F	98.8	Very high	98.4	Very high	129 Å²	129	38.5 Å²	38.5	57%	0.566	19%	0.186	S	C	*	.	H	α-helix	trans	-67.6	-45.6	-176	-176.7	-94.5	0	0	0	111.9	L25 A26 G32 F33 M72	L25-F29 VanDerWaalsContact O-CB 3.29Å; L25-F29 WeakPolarHBondContact O-CB 3.49Å; L25-F29 PolarHBondContact O-N 2.7Å; A26-F29 PolarHBondContact O-N 3.18Å; F29-G32 PolarHBondContact O-N 3.5Å; F29-F33 WeakPolarHBondContact O-CB 3.43Å; F29-F33 PolarHBondContact O-N 3.29Å; F29-M72 HydrophobicContact CE1-CE 4.32Å; F29-M72 HydrophobicContact CE1-SD 4.15Å
30	C	98.9	Very high	98.6	Very high	4 Å²	4	35.1 Å²	35.1	3%	0.027	17%	0.172	C	C	.	.	H	α-helix	trans	-73.2	-33.8	-175.9	-63.1	0	0	0	0	112.2	A26 F33 L34 A69 L81	A26-C30 WeakPolarHBondContact O-CB 3.49Å; A26-C30 PolarHBondContact O-N 2.92Å; A26-C30 PolarHBondContact O-SG 3.38Å; C30-F33 PolarHBondContact O-N 2.96Å; C30-L34 WeakPolarHBondContact O-CB 3.35Å; C30-L34 PolarHBondContact O-N 2.94Å; C30-A69 HydrophobicContact CB-CB 4.41Å; C30-L81 HydrophobicContact CB-CD1 4Å; C30-L81 HydrophobicContact CB-CD2 3.35Å; C30-L81 HydrophobicContact CB-CG 4.34Å
31	T	98.9	Very high	98.6	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-69.8	-38.5	171.1	-60.9	0	0	0	0	111.2	E27 L34 V35 L81 Q107 A111 A215	E27-T31 WeakPolarHBondContact O-CB 3.47Å; E27-T31 PolarHBondContact O-N 2.71Å; E27-T31 PolarHBondContact O-OG1 2.87Å; T31-L34 WeakPolarHBondContact O-CB 3.47Å; T31-L34 PolarHBondContact O-N 3.25Å; T31-V35 HydrophobicContact CG2-CG2 4.42Å; T31-V35 WeakPolarHBondContact O-CG2 3.35Å; T31-V35 PolarHBondContact O-N 3.47Å; T31-L81 VanDerWaalsContact OG1-CA 3.25Å; T31-L81 WeakPolarHBondContact OG1-CA 3.37Å; T31-L81 PolarHBondContact OG1-O 3.2Å; T31-Q107 HydrophobicContact CG2-CB 4.15Å; T31-Q107 WeakPolarHBondContact CG2-O 3.2Å; T31-Q107 WeakPolarHBondContact OG1-CG 3.49Å; T31-A111 HydrophobicContact CG2-CB 3.95Å; T31-A215 HydrophobicContact CG2-CB 4.5Å
32	G	98.9	Very high	98.6	Very high	10 Å²	10	30.6 Å²	30.6	10%	0.103	15%	0.15	C	C	.	.	H	α-helix	trans	-62	-42.1	172.6	0	0	0	0	0	112.8	L28 F29 V35 F36 G110 G114	L28-G32 PolarHBondContact O-N 2.71Å; F29-G32 PolarHBondContact O-N 3.5Å; G32-V35 PolarHBondContact O-N 3.42Å; G32-F36 WeakPolarHBondContact O-CB 3.33Å; G32-F36 PolarHBondContact O-N 3.46Å; G32-G110 VanDerWaalsContact CA-C 3.41Å; G32-G110 WeakPolarHBondContact CA-O 3.27Å; G32-G114 WeakPolarHBondContact O-CA 3.18Å
33	F	98.9	Very high	98.7	Very high	63 Å²	63	25.9 Å²	25.9	28%	0.276	13%	0.132	S	C	.	.	H	α-helix	trans	-62.2	-43.8	172.9	-179.4	-88.8	0	0	0	112	F29 C30 G37 V65 L68 A69 M72	F29-F33 WeakPolarHBondContact O-CB 3.43Å; F29-F33 PolarHBondContact O-N 3.29Å; C30-F33 PolarHBondContact O-N 2.96Å; F33-G37 PolarHBondContact O-N 3.03Å; F33-V65 HydrophobicContact CD1-CG1 3.91Å; F33-V65 HydrophobicContact CE1-CG1 3.75Å; F33-V65 WeakPolarHBondContact O-CG1 3.38Å; F33-L68 HydrophobicContact CE1-CB 3.84Å; F33-L68 HydrophobicContact CZ-CB 4.21Å; F33-L68 HydrophobicContact CZ-CD1 4.32Å; F33-A69 HydrophobicContact CD1-CB 4.02Å; F33-M72 HydrophobicContact CB-CE 4.09Å; F33-M72 HydrophobicContact CD1-CE 3.55Å; F33-M72 HydrophobicContact CD2-CE 3.87Å; F33-M72 HydrophobicContact CE1-CE 3.87Å; F33-M72 HydrophobicContact CE2-CE 4.16Å; F33-M72 HydrophobicContact CG-CE 3.55Å; F33-M72 HydrophobicContact CZ-CE 4.16Å
34	L	98.9	Very high	98.7	Very high	6 Å²	6	29.9 Å²	29.9	3%	0.031	15%	0.151	C	C	.	.	H	α-helix	trans	-56.9	-51.5	176.1	173.4	61.3	0	0	0	111.8	C30 T31 G38 W62 V65 L66 A69 L81	C30-L34 WeakPolarHBondContact O-CB 3.35Å; C30-L34 PolarHBondContact O-N 2.94Å; T31-L34 WeakPolarHBondContact O-CB 3.47Å; T31-L34 PolarHBondContact O-N 3.25Å; L34-G38 PolarHBondContact O-N 3.02Å; L34-W62 HydrophobicContact CD1-CE3 4.13Å; L34-W62 HydrophobicContact CD1-CZ3 4.22Å; L34-W62 HydrophobicContact CG-CZ3 4.31Å; L34-V65 HydrophobicContact CD1-CG1 4.29Å; L34-L66 HydrophobicContact CD1-CB 3.86Å; L34-L66 HydrophobicContact CD1-CD1 4.06Å; L34-L66 HydrophobicContact CD2-CD1 3.98Å; L34-A69 HydrophobicContact CB-CB 4.37Å; L34-L81 HydrophobicContact CD2-CB 4.24Å
35	V	98.9	Very high	98.6	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-69.6	-45.1	-178.4	173.9	0	0	0	0	111	T31 G32 G37 G38 E39 A111 A115 R216 P220	T31-V35 HydrophobicContact CG2-CG2 4.42Å; T31-V35 WeakPolarHBondContact O-CG2 3.35Å; T31-V35 PolarHBondContact O-N 3.47Å; G32-V35 PolarHBondContact O-N 3.42Å; V35-G37 PolarHBondContact O-N 3.08Å; V35-G38 PolarHBondContact O-N 3.35Å; V35-E39 HydrophobicContact CG1-CG 3.97Å; V35-E39 WeakPolarHBondContact CG1-OE1 3.25Å; V35-E39 VanDerWaalsContact O-CB 3.24Å; V35-E39 WeakPolarHBondContact O-CB 3.33Å; V35-E39 VanDerWaalsContact O-CG 3.27Å; V35-E39 WeakPolarHBondContact O-CG 3.46Å; V35-E39 PolarHBondContact O-N 2.97Å; V35-A111 HydrophobicContact CB-CB 4.4Å; V35-A111 WeakPolarHBondContact CG1-O 3.06Å; V35-A111 HydrophobicContact CG2-CB 3.67Å; V35-A115 HydrophobicContact CG1-CB 4.38Å; V35-R216 HydrophobicContact CG2-CB 4.29Å; V35-R216 HydrophobicContact CG2-CG 4.38Å; V35-P220 HydrophobicContact CG1-CG 3.96Å
36	F	98.9	Very high	98.6	Very high	75 Å²	75	27.4 Å²	27.4	33%	0.329	14%	0.138	S	C	.	.	H	α-helix	trans	-54.8	-53.6	175.8	174.9	-99	0	0	0	111.7	G32 C40 V118 V121	G32-F36 WeakPolarHBondContact O-CB 3.33Å; G32-F36 PolarHBondContact O-N 3.46Å; F36-C40 WeakPolarHBondContact O-CB 3.38Å; F36-C40 PolarHBondContact O-N 3.09Å; F36-C40 PolarHBondContact O-SG 2.98Å; F36-V118 HydrophobicContact CD2-CG2 3.76Å; F36-V118 HydrophobicContact CE2-CG2 4.32Å; F36-V118 HydrophobicContact CG-CG2 4.36Å; F36-V118 VanDerWaalsContact O-CG2 3.23Å; F36-V118 WeakPolarHBondContact O-CG2 3.46Å; F36-V121 HydrophobicContact CE2-CG2 3.97Å; F36-V121 HydrophobicContact CZ-CG2 4.16Å
37	G	98.8	Very high	98.6	Very high	12 Å²	12	28.3 Å²	28.3	12%	0.124	14%	0.141	C	C	.	.	H	α-helix	trans	-65	-46.9	-178.3	0	0	0	0	0	112.1	F33 V35 C40 V41	F33-G37 PolarHBondContact O-N 3.03Å; V35-G37 PolarHBondContact O-N 3.08Å; G37-C40 WeakPolarHBondContact O-CB 3.39Å; G37-C40 PolarHBondContact O-N 2.92Å; G37-V41 WeakPolarHBondContact O-CG2 3.17Å; G37-V41 PolarHBondContact O-N 3.42Å
38	G	98.7	Very high	98.5	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-63.5	-43.4	-180	0	0	0	0	0	113.4	L34 V35 V41 N42 W62	L34-G38 PolarHBondContact O-N 3.02Å; V35-G38 PolarHBondContact O-N 3.35Å; G38-V41 WeakPolarHBondContact O-CB 3.45Å; G38-V41 PolarHBondContact O-N 3.4Å; G38-N42 PolarHBondContact O-N 3.48Å; G38-N42 VanDerWaalsContact O-N 3.09Å; G38-N42 PolarHBondContact O-OD1 3.45Å; G38-W62 VanDerWaalsContact CA-CZ2 3.42Å; G38-W62 PolarHBondContact O-NE1 3.37Å; G38-W62 VanDerWaalsContact O-NE1 3.16Å
39	E	98.9	Very high	98.3	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-72.1	-28.5	177.2	-66.6	-178.6	176.8	0	0	112.6	V35 V41 N42 A43 W62 A115 V118 I145 F146 P220	V35-E39 HydrophobicContact CG1-CG 3.97Å; V35-E39 WeakPolarHBondContact CG1-OE1 3.25Å; V35-E39 VanDerWaalsContact O-CB 3.24Å; V35-E39 WeakPolarHBondContact O-CB 3.33Å; V35-E39 VanDerWaalsContact O-CG 3.27Å; V35-E39 WeakPolarHBondContact O-CG 3.46Å; V35-E39 PolarHBondContact O-N 2.97Å; E39-V41 VanDerWaalsContact C-N 3.27Å; E39-V41 PolarHBondContact O-N 3.16Å; E39-N42 CarbonylContact O-C 3.54Å; E39-N42 WeakPolarHBondContact O-CB 3.46Å; E39-N42 PolarHBondContact O-N 3Å; E39-A43 WeakPolarHBondContact O-CB 3.29Å; E39-A43 PolarHBondContact O-N 3.31Å; E39-W62 HydrophobicContact CG-CH2 4.37Å; E39-W62 HydrophobicContact CG-CZ2 4.28Å; E39-A115 WeakPolarHBondContact OE2-CA 3.36Å; E39-A115 VanDerWaalsContact OE2-CB 3.32Å; E39-A115 WeakPolarHBondContact OE2-CB 3.5Å; E39-V118 HydrophobicContact CB-CB 4.25Å; E39-V118 HydrophobicContact CB-CG1 4.12Å; E39-V118 HydrophobicContact CB-CG2 3.64Å; E39-I145 WeakPolarHBondContact CG-O 3.4Å; E39-F146 WeakPolarHBondContact OE1-CA 3.35Å; E39-F146 VanDerWaalsContact OE2-CD1 3.28Å; E39-F146 WeakPolarHBondContact OE2-CD1 3.48Å; E39-P220 VanDerWaalsContact OE1-CB 3.24Å; E39-P220 WeakPolarHBondContact OE1-CB 3.34Å; E39-P220 WeakPolarHBondContact OE1-CG 3.39Å
40	C	98.7	Very high	98.1	Very high	21 Å²	21	28.9 Å²	28.9	14%	0.142	15%	0.15	C	C	.	.	H	α-helix	trans	-60	-39.7	168.3	-73.9	0	0	0	0	111.4	F36 G37 N42 A43 Q44 Y122	F36-C40 WeakPolarHBondContact O-CB 3.38Å; F36-C40 PolarHBondContact O-N 3.09Å; F36-C40 PolarHBondContact O-SG 2.98Å; G37-C40 WeakPolarHBondContact O-CB 3.39Å; G37-C40 PolarHBondContact O-N 2.92Å; C40-N42 VanDerWaalsContact C-N 3.35Å; C40-A43 PolarHBondContact O-N 3.34Å; C40-Q44 WeakPolarHBondContact O-CB 3.48Å; C40-Q44 PolarHBondContact O-N 3.09Å; C40-Y122 HydrophobicContact CB-CE2 4.14Å
41	V	98.3	Very high	98	Very high	27 Å²	27	36.9 Å²	36.9	16%	0.164	19%	0.185	C	C	.	.	H	α-helix	trans	-65.8	-40.1	175.7	-177.9	0	0	0	0	110.6	G37 G38 E39 Q44 Y45 N53 I58	G37-V41 WeakPolarHBondContact O-CG2 3.17Å; G37-V41 PolarHBondContact O-N 3.42Å; G38-V41 WeakPolarHBondContact O-CB 3.45Å; G38-V41 PolarHBondContact O-N 3.4Å; E39-V41 VanDerWaalsContact C-N 3.27Å; E39-V41 PolarHBondContact O-N 3.16Å; V41-Q44 PolarHBondContact O-N 3.46Å; V41-Y45 PolarHBondContact O-N 3.33Å; V41-Y45 VanDerWaalsContact O-N 3.15Å; V41-N53 VanDerWaalsContact CG1-ND2 3.35Å; V41-N53 WeakPolarHBondContact CG1-ND2 3.35Å; V41-I58 HydrophobicContact CG1-CB 4.41Å; V41-I58 HydrophobicContact CG1-CG1 4.37Å
42	N	98.4	Very high	97.8	Very high	14 Å²	14	42.5 Å²	42.5	8%	0.075	22%	0.215	C	C	.	.	H	α-helix	trans	-63.4	-46.1	173.6	-61.1	-12.9	0	0	0	111.6	G38 E39 C40 Q44 Y45 V46 W62 I145	G38-N42 PolarHBondContact O-N 3.48Å; G38-N42 VanDerWaalsContact O-N 3.09Å; G38-N42 PolarHBondContact O-OD1 3.45Å; E39-N42 CarbonylContact O-C 3.54Å; E39-N42 WeakPolarHBondContact O-CB 3.46Å; E39-N42 PolarHBondContact O-N 3Å; C40-N42 VanDerWaalsContact C-N 3.35Å; N42-Q44 VanDerWaalsContact C-N 3.31Å; N42-Q44 PolarHBondContact O-N 2.97Å; N42-Y45 WeakPolarHBondContact O-CB 3.42Å; N42-Y45 PolarHBondContact O-N 3.3Å; N42-Y45 VanDerWaalsContact O-N 3.13Å; N42-V46 WeakPolarHBondContact O-CG2 3.29Å; N42-V46 PolarHBondContact O-N 3.38Å; N42-W62 PolarHBondContact OD1-NE1 3.03Å; N42-I145 HydrophobicContact CB-CG2 4.39Å; N42-I145 WeakPolarHBondContact CB-O 3.45Å; N42-I145 PolarHBondContact ND2-O 3.19Å
43	A	98.4	Very high	97.6	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-59.6	-43.5	179.3	0	0	0	0	0	110.9	E39 C40 Y45 V46 L47 V118 Y122 I145	E39-A43 WeakPolarHBondContact O-CB 3.29Å; E39-A43 PolarHBondContact O-N 3.31Å; C40-A43 PolarHBondContact O-N 3.34Å; A43-Y45 VanDerWaalsContact C-N 3.32Å; A43-Y45 PolarHBondContact O-N 3.46Å; A43-V46 PolarHBondContact O-N 3.28Å; A43-L47 HydrophobicContact CB-CD1 4.08Å; A43-L47 WeakPolarHBondContact O-CB 3.35Å; A43-L47 WeakPolarHBondContact O-CG 3.35Å; A43-L47 PolarHBondContact O-N 3.01Å; A43-V118 HydrophobicContact CB-CG1 4.24Å; A43-Y122 HydrophobicContact CB-CD1 3.98Å; A43-Y122 HydrophobicContact CB-CD2 3.78Å; A43-Y122 HydrophobicContact CB-CE1 4.03Å; A43-Y122 HydrophobicContact CB-CE2 3.84Å; A43-Y122 HydrophobicContact CB-CG 3.85Å; A43-I145 HydrophobicContact CB-CD1 4.17Å; A43-I145 HydrophobicContact CB-CG2 3.77Å
44	Q	97.7	Very high	97.3	Very high	84 Å²	84	45.8 Å²	45.8	39%	0.393	23%	0.229	S	C	.	.	H	α-helix	trans	-60.6	-41.3	175.7	-168.7	173.9	108.4	0	0	112.1	C40 V41 N42 S48 N52	C40-Q44 WeakPolarHBondContact O-CB 3.48Å; C40-Q44 PolarHBondContact O-N 3.09Å; V41-Q44 PolarHBondContact O-N 3.46Å; N42-Q44 VanDerWaalsContact C-N 3.31Å; N42-Q44 PolarHBondContact O-N 2.97Å; Q44-S48 WeakPolarHBondContact O-CB 3.16Å; Q44-S48 PolarHBondContact O-N 2.94Å; Q44-S48 PolarHBondContact O-OG 3.23Å; Q44-N52 HydrophobicContact CG-CB 4.16Å
45	Y	97.7	Very high	97	Very high	59 Å²	59	51 Å²	51	23%	0.231	25%	0.248	C	C	.	.	H	α-helix	trans	-66.5	-54.6	175.7	175	-105.1	0	0	0	112.4	V41 N42 A43 S48 Q49 G50 N53 W55 I58	V41-Y45 PolarHBondContact O-N 3.33Å; V41-Y45 VanDerWaalsContact O-N 3.15Å; N42-Y45 WeakPolarHBondContact O-CB 3.42Å; N42-Y45 PolarHBondContact O-N 3.3Å; N42-Y45 VanDerWaalsContact O-N 3.13Å; A43-Y45 VanDerWaalsContact C-N 3.32Å; A43-Y45 PolarHBondContact O-N 3.46Å; Y45-S48 PolarHBondContact O-OG 3.5Å; Y45-Q49 PolarHBondContact O-N 2.86Å; Y45-Q49 VanDerWaalsContact O-N 3.15Å; Y45-G50 PolarHBondContact O-N 3.32Å; Y45-N53 VanDerWaalsContact CD2-O 3.29Å; Y45-N53 WeakPolarHBondContact CD2-O 3.27Å; Y45-W55 PolarHBondContact OH-NE1 3.18Å; Y45-I58 HydrophobicContact CD1-CD1 3.59Å; Y45-I58 HydrophobicContact CD2-CD1 3.95Å; Y45-I58 HydrophobicContact CD2-CG1 4.49Å; Y45-I58 HydrophobicContact CE1-CD1 4.1Å; Y45-I58 HydrophobicContact CE2-CD1 4.44Å; Y45-I58 HydrophobicContact CG-CD1 3.5Å; Y45-I58 VanDerWaalsContact CG-CD1 3.5Å; Y45-I58 HydrophobicContact CG-CG1 4.19Å
46	V	97.7	Very high	96.8	Very high	25 Å²	25	56.1 Å²	56.1	15%	0.152	28%	0.275	C	S	.	.	H	α-helix	trans	-63.7	-52.8	-174.7	172.8	0	0	0	0	111	N42 A43 S48 Q49 F129 T142 I145	N42-V46 WeakPolarHBondContact O-CG2 3.29Å; N42-V46 PolarHBondContact O-N 3.38Å; A43-V46 PolarHBondContact O-N 3.28Å; V46-S48 VanDerWaalsContact C-N 3.29Å; V46-S48 PolarHBondContact O-N 3.27Å; V46-Q49 PolarHBondContact O-N 3.49Å; V46-F129 HydrophobicContact CG1-CE1 4.4Å; V46-F129 HydrophobicContact CG1-CZ 4.38Å; V46-F129 WeakPolarHBondContact O-CE2 3.42Å; V46-T142 HydrophobicContact CG1-CG2 4.35Å; V46-I145 HydrophobicContact CB-CD1 4.2Å; V46-I145 HydrophobicContact CB-CG1 3.83Å; V46-I145 HydrophobicContact CG1-CD1 4.14Å; V46-I145 HydrophobicContact CG1-CG1 3.98Å; V46-I145 HydrophobicContact CG2-CG1 3.93Å
47	L	97.7	Very high	96.7	Very high	30 Å²	30	53.6 Å²	53.6	16%	0.157	27%	0.27	C	S	.	.	H	α-helix	trans	-71.9	-25	-172.8	-58.3	170.5	0	0	0	112.4	A43 Q49 Y122 A125 I126 F129 T142 I145	A43-L47 HydrophobicContact CB-CD1 4.08Å; A43-L47 WeakPolarHBondContact O-CB 3.35Å; A43-L47 WeakPolarHBondContact O-CG 3.35Å; A43-L47 PolarHBondContact O-N 3.01Å; L47-Q49 VanDerWaalsContact C-N 3.34Å; L47-Y122 HydrophobicContact CD1-CD1 3.53Å; L47-Y122 HydrophobicContact CD1-CE1 4.32Å; L47-Y122 HydrophobicContact CD1-CG 4.08Å; L47-A125 HydrophobicContact CD1-CB 3.89Å; L47-I126 HydrophobicContact CD1-CG1 4Å; L47-I126 HydrophobicContact CD2-CG1 4.07Å; L47-F129 HydrophobicContact CD2-CB 3.7Å; L47-F129 HydrophobicContact CD2-CD1 4.29Å; L47-F129 HydrophobicContact CD2-CD2 4.24Å; L47-F129 HydrophobicContact CD2-CG 3.84Å; L47-T142 HydrophobicContact CD2-CG2 4.07Å; L47-I145 HydrophobicContact CD1-CD1 4.23Å; L47-I145 HydrophobicContact CD2-CD1 4.02Å; L47-I145 HydrophobicContact CG-CD1 3.96Å
48	S	96.9	Very high	96.6	Very high	18 Å²	18	53.2 Å²	53.2	13%	0.126	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-3.8	171.8	75	0	0	0	0	113.7	Q44 Y45 V46 G50 K51 N52	Q44-S48 WeakPolarHBondContact O-CB 3.16Å; Q44-S48 PolarHBondContact O-N 2.94Å; Q44-S48 PolarHBondContact O-OG 3.23Å; Y45-S48 PolarHBondContact O-OG 3.5Å; V46-S48 VanDerWaalsContact C-N 3.29Å; V46-S48 PolarHBondContact O-N 3.27Å; S48-G50 VanDerWaalsContact C-N 3.25Å; S48-G50 PolarHBondContact O-N 3.03Å; S48-K51 WeakPolarHBondContact O-CB 3.23Å; S48-K51 VanDerWaalsContact O-CG 3.29Å; S48-K51 WeakPolarHBondContact O-CG 3.33Å; S48-K51 PolarHBondContact O-N 2.86Å; S48-K51 VanDerWaalsContact O-N 3.15Å; S48-K51 PolarHBondContact OG-N 3.24Å; S48-N52 PolarHBondContact OG-N 3.42Å; S48-N52 VanDerWaalsContact OG-N 3.15Å
49	Q	95.6	Very high	96.6	Very high	142 Å²	142	53.2 Å²	53.2	66%	0.664	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	43.5	-173.2	-54.7	176.8	37.6	0	0	111.9	Y45 V46 L47 K51 F129	Y45-Q49 PolarHBondContact O-N 2.86Å; Y45-Q49 VanDerWaalsContact O-N 3.15Å; V46-Q49 PolarHBondContact O-N 3.49Å; L47-Q49 VanDerWaalsContact C-N 3.34Å; Q49-K51 VanDerWaalsContact C-N 3.28Å; Q49-K51 PolarHBondContact O-N 3.49Å; Q49-F129 HydrophobicContact CG-CE2 3.67Å; Q49-F129 HydrophobicContact CG-CZ 4.33Å
50	G	95.4	Very high	96.6	Very high	16 Å²	16	56.1 Å²	56.1	17%	0.165	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.3	2.6	-179.6	0	0	0	0	0	115.7	Y45 S48 N53	Y45-G50 PolarHBondContact O-N 3.32Å; S48-G50 VanDerWaalsContact C-N 3.25Å; S48-G50 PolarHBondContact O-N 3.03Å; G50-N53 CarbonylContact C-O 3.55Å; G50-N53 VanDerWaalsContact CA-O 3.3Å; G50-N53 WeakPolarHBondContact CA-O 3.37Å
51	K	96.4	Very high	96.5	Very high	173 Å²	173	55.7 Å²	55.7	75%	0.752	28%	0.282	S	S	*	.	S	Bend	trans	-72.3	-32.7	-178.7	-67.8	176	-177.1	175	0	113.7	S48 Q49	S48-K51 WeakPolarHBondContact O-CB 3.23Å; S48-K51 VanDerWaalsContact O-CG 3.29Å; S48-K51 WeakPolarHBondContact O-CG 3.33Å; S48-K51 PolarHBondContact O-N 2.86Å; S48-K51 VanDerWaalsContact O-N 3.15Å; S48-K51 PolarHBondContact OG-N 3.24Å; Q49-K51 VanDerWaalsContact C-N 3.28Å; Q49-K51 PolarHBondContact O-N 3.49Å
52	N	94.9	Very high	96.6	Very high	118 Å²	118	54.6 Å²	54.6	63%	0.631	28%	0.275	S	S	*	.	S	Bend	trans	-103.5	-9.7	-176.1	-65.8	-10.9	0	0	0	112.9	Q44 S48	Q44-N52 HydrophobicContact CG-CB 4.16Å; S48-N52 PolarHBondContact OG-N 3.42Å; S48-N52 VanDerWaalsContact OG-N 3.15Å
53	N	93.8	Very high	96.6	Very high	27 Å²	27	54 Å²	54	14%	0.144	27%	0.272	C	S	.	.			trans	-157.5	157.9	-177.4	-161.2	7.9	0	0	0	110.7	V41 Y45 G50 G57	V41-N53 VanDerWaalsContact CG1-ND2 3.35Å; V41-N53 WeakPolarHBondContact CG1-ND2 3.35Å; Y45-N53 VanDerWaalsContact CD2-O 3.29Å; Y45-N53 WeakPolarHBondContact CD2-O 3.27Å; G50-N53 CarbonylContact C-O 3.55Å; G50-N53 VanDerWaalsContact CA-O 3.3Å; G50-N53 WeakPolarHBondContact CA-O 3.37Å; N53-G57 VanDerWaalsContact OD1-CA 3.26Å; N53-G57 WeakPolarHBondContact OD1-CA 3.35Å
54	E	93.7	Very high	96.6	Very high	115 Å²	115	58.5 Å²	58.5	54%	0.537	30%	0.296	S	S	.	.			trans	-128.6	169.9	177.6	-75.1	-69.2	179.9	0	0	110.5	I56 G57 I58	E54-I56 HydrophobicContact CB-CG2 4.28Å; E54-I56 PolarHBondContact O-N 2.89Å; E54-I56 VanDerWaalsContact O-N 3.13Å; E54-G57 WeakPolarHBondContact O-CA 3.34Å; E54-G57 PolarHBondContact O-N 3.45Å; E54-I58 PolarHBondContact O-N 3.29Å
55	W	90.9	Very high	96.6	Very high	114 Å²	114	55.4 Å²	55.4	43%	0.432	28%	0.283	S	S	.	.	H	α-helix	trans	-55.1	-34.1	-178.9	-93.3	109	0	0	0	114.4	Y45 G57 I58 S59 A205 Y210	Y45-W55 PolarHBondContact OH-NE1 3.18Å; W55-G57 VanDerWaalsContact C-N 3.33Å; W55-I58 HydrophobicContact CD2-CD1 4.04Å; W55-I58 HydrophobicContact CE3-CB 4.21Å; W55-I58 HydrophobicContact CE3-CD1 3.79Å; W55-I58 HydrophobicContact CE3-CG2 4.32Å; W55-I58 HydrophobicContact CH2-CD1 4.46Å; W55-I58 HydrophobicContact CZ3-CD1 4Å; W55-I58 HydrophobicContact CZ3-CG2 4.17Å; W55-I58 PolarHBondContact O-N 3.44Å; W55-S59 PolarHBondContact O-N 3.39Å; W55-S59 PolarHBondContact O-OG 3.29Å; W55-A205 HydrophobicContact CE3-CB 3.97Å; W55-A205 HydrophobicContact CH2-CB 4.36Å; W55-A205 HydrophobicContact CZ3-CB 3.71Å; W55-Y210 HydrophobicContact CZ3-CE1 4.38Å
56	I	95.1	Very high	96.7	Very high	108 Å²	108	53.5 Å²	53.5	55%	0.554	28%	0.276	S	S	*	.	H	α-helix	trans	-63.7	-40	173.5	-172.5	167.6	0	0	0	111.6	E54 S59 V60 M202	E54-I56 HydrophobicContact CB-CG2 4.28Å; E54-I56 PolarHBondContact O-N 2.89Å; E54-I56 VanDerWaalsContact O-N 3.13Å; I56-S59 PolarHBondContact O-N 3.43Å; I56-V60 HydrophobicContact CG1-CG2 4.26Å; I56-V60 WeakPolarHBondContact O-CB 3.43Å; I56-V60 WeakPolarHBondContact O-CG2 3.3Å; I56-V60 PolarHBondContact O-N 2.92Å; I56-M202 HydrophobicContact CD1-SD 4.24Å; I56-M202 HydrophobicContact CG1-CG 4.5Å; I56-M202 HydrophobicContact CG1-SD 3.98Å
57	G	96.7	Very high	96.8	Very high	22 Å²	22	54.9 Å²	54.9	23%	0.227	28%	0.282	C	S	.	.	H	α-helix	trans	-72	-30.6	177.2	0	0	0	0	0	112.6	N53 E54 W55 G61	N53-G57 VanDerWaalsContact OD1-CA 3.26Å; N53-G57 WeakPolarHBondContact OD1-CA 3.35Å; E54-G57 WeakPolarHBondContact O-CA 3.34Å; E54-G57 PolarHBondContact O-N 3.45Å; W55-G57 VanDerWaalsContact C-N 3.33Å; G57-G61 WeakPolarHBondContact O-CA 3.41Å; G57-G61 PolarHBondContact O-N 2.89Å
58	I	97.4	Very high	96.8	Very high	4 Å²	4	57.1 Å²	57.1	2%	0.021	29%	0.294	C	S	.	.	H	α-helix	trans	-58.9	-53.9	166.1	-59	175.9	0	0	0	110.2	V41 Y45 E54 W55 G61 W62	V41-I58 HydrophobicContact CG1-CB 4.41Å; V41-I58 HydrophobicContact CG1-CG1 4.37Å; Y45-I58 HydrophobicContact CD1-CD1 3.59Å; Y45-I58 HydrophobicContact CD2-CD1 3.95Å; Y45-I58 HydrophobicContact CD2-CG1 4.49Å; Y45-I58 HydrophobicContact CE1-CD1 4.1Å; Y45-I58 HydrophobicContact CE2-CD1 4.44Å; Y45-I58 HydrophobicContact CG-CD1 3.5Å; Y45-I58 VanDerWaalsContact CG-CD1 3.5Å; Y45-I58 HydrophobicContact CG-CG1 4.19Å; E54-I58 PolarHBondContact O-N 3.29Å; W55-I58 HydrophobicContact CD2-CD1 4.04Å; W55-I58 HydrophobicContact CE3-CB 4.21Å; W55-I58 HydrophobicContact CE3-CD1 3.79Å; W55-I58 HydrophobicContact CE3-CG2 4.32Å; W55-I58 HydrophobicContact CH2-CD1 4.46Å; W55-I58 HydrophobicContact CZ3-CD1 4Å; W55-I58 HydrophobicContact CZ3-CG2 4.17Å; W55-I58 PolarHBondContact O-N 3.44Å; I58-G61 PolarHBondContact O-N 2.73Å; I58-W62 VanDerWaalsContact O-CD1 3.27Å; I58-W62 PolarHBondContact O-N 2.87Å
59	S	97.8	Very high	96.9	Very high	1 Å²	1	56.3 Å²	56.3	1%	0.007	29%	0.288	C	S	.	.	H	α-helix	trans	-61.5	-50.6	-175.2	-54.5	0	0	0	0	112	W55 I56 G63 A198 G201 M202	W55-S59 PolarHBondContact O-N 3.39Å; W55-S59 PolarHBondContact O-OG 3.29Å; I56-S59 PolarHBondContact O-N 3.43Å; S59-G63 PolarHBondContact O-N 2.61Å; S59-G63 VanDerWaalsContact O-N 3.13Å; S59-A198 WeakPolarHBondContact O-CA 3.37Å; S59-G201 WeakPolarHBondContact OG-CA 3.25Å; S59-G201 PolarHBondContact OG-O 3.27Å; S59-M202 PolarHBondContact OG-N 3.5Å
60	V	98.4	Very high	97	Very high	60 Å²	60	49.9 Å²	49.9	36%	0.364	26%	0.258	S	S	.	.	H	α-helix	trans	-64.2	-41.5	177.1	172.8	0	0	0	0	111	I56 G63 L64	I56-V60 HydrophobicContact CG1-CG2 4.26Å; I56-V60 WeakPolarHBondContact O-CB 3.43Å; I56-V60 WeakPolarHBondContact O-CG2 3.3Å; I56-V60 PolarHBondContact O-N 2.92Å; V60-G63 PolarHBondContact O-N 3.03Å; V60-L64 HydrophobicContact CG1-CD1 3.89Å; V60-L64 HydrophobicContact CG1-CG 4.14Å; V60-L64 WeakPolarHBondContact O-CG 3.46Å; V60-L64 PolarHBondContact O-N 3.08Å
61	G	98.5	Very high	97.2	Very high	12 Å²	12	54.1 Å²	54.1	12%	0.124	28%	0.276	C	S	.	.	H	α-helix	trans	-58.5	-50.6	178.1	0	0	0	0	0	112.5	G57 I58 G63 L64 V65	G57-G61 WeakPolarHBondContact O-CA 3.41Å; G57-G61 PolarHBondContact O-N 2.89Å; I58-G61 PolarHBondContact O-N 2.73Å; G61-G63 VanDerWaalsContact C-N 3.31Å; G61-G63 PolarHBondContact O-N 3.12Å; G61-L64 PolarHBondContact O-N 3.26Å; G61-V65 VanDerWaalsContact O-CG2 3.27Å; G61-V65 WeakPolarHBondContact O-CG2 3.08Å; G61-V65 PolarHBondContact O-N 3.35Å
62	W	98.6	Very high	97.2	Very high	4 Å²	4	49.7 Å²	49.7	2%	0.015	26%	0.259	C	S	.	.	H	α-helix	trans	-57.7	-42.7	174.5	-86	92.3	0	0	0	112.1	L34 G38 E39 N42 I58 V65 L66 L197 R216	L34-W62 HydrophobicContact CD1-CE3 4.13Å; L34-W62 HydrophobicContact CD1-CZ3 4.22Å; L34-W62 HydrophobicContact CG-CZ3 4.31Å; G38-W62 VanDerWaalsContact CA-CZ2 3.42Å; G38-W62 PolarHBondContact O-NE1 3.37Å; G38-W62 VanDerWaalsContact O-NE1 3.16Å; E39-W62 HydrophobicContact CG-CH2 4.37Å; E39-W62 HydrophobicContact CG-CZ2 4.28Å; N42-W62 PolarHBondContact OD1-NE1 3.03Å; I58-W62 VanDerWaalsContact O-CD1 3.27Å; I58-W62 PolarHBondContact O-N 2.87Å; W62-V65 PolarHBondContact O-N 3.19Å; W62-L66 PolarHBondContact O-N 2.96Å; W62-L197 HydrophobicContact CB-CD2 4.07Å; W62-L197 WeakPolarHBondContact O-CD2 3.3Å; W62-R216 HydrophobicContact CH2-CG 3.79Å; W62-R216 HydrophobicContact CZ3-CG 3.83Å
63	G	98.8	Very high	97.3	Very high	2 Å²	2	44.1 Å²	44.1	2%	0.021	23%	0.229	C	C	.	.	H	α-helix	trans	-61.8	-44.5	176.4	0	0	0	0	0	113.9	S59 V60 G61 L66 M67 G194	S59-G63 PolarHBondContact O-N 2.61Å; S59-G63 VanDerWaalsContact O-N 3.13Å; V60-G63 PolarHBondContact O-N 3.03Å; G61-G63 VanDerWaalsContact C-N 3.31Å; G61-G63 PolarHBondContact O-N 3.12Å; G63-L66 PolarHBondContact O-N 3.2Å; G63-M67 PolarHBondContact O-N 3.02Å; G63-G194 WeakPolarHBondContact CA-O 3.43Å; G63-G194 WeakPolarHBondContact O-CA 3.48Å
64	L	98.8	Very high	97.4	Very high	95 Å²	95	45 Å²	45	50%	0.497	24%	0.238	S	C	.	.	H	α-helix	trans	-65.3	-40.8	177.7	-70.6	175.4	0	0	0	112	V60 G61 M67 L68	V60-L64 HydrophobicContact CG1-CD1 3.89Å; V60-L64 HydrophobicContact CG1-CG 4.14Å; V60-L64 WeakPolarHBondContact O-CG 3.46Å; V60-L64 PolarHBondContact O-N 3.08Å; G61-L64 PolarHBondContact O-N 3.26Å; L64-M67 HydrophobicContact CD2-CE 3.86Å; L64-M67 WeakPolarHBondContact O-CB 3.13Å; L64-M67 PolarHBondContact O-N 3.32Å; L64-L68 WeakPolarHBondContact O-CG 3.3Å; L64-L68 PolarHBondContact O-N 3.49Å; L64-L68 VanDerWaalsContact O-N 3.15Å
65	V	98.8	Very high	97.5	Very high	19 Å²	19	49.2 Å²	49.2	12%	0.115	26%	0.255	C	S	.	.	H	α-helix	trans	-64.7	-43.3	176.1	179.3	0	0	0	0	110.2	F33 L34 G61 W62 M67 L68 A69	F33-V65 HydrophobicContact CD1-CG1 3.91Å; F33-V65 HydrophobicContact CE1-CG1 3.75Å; F33-V65 WeakPolarHBondContact O-CG1 3.38Å; L34-V65 HydrophobicContact CD1-CG1 4.29Å; G61-V65 VanDerWaalsContact O-CG2 3.27Å; G61-V65 WeakPolarHBondContact O-CG2 3.08Å; G61-V65 PolarHBondContact O-N 3.35Å; W62-V65 PolarHBondContact O-N 3.19Å; V65-M67 PolarHBondContact O-N 3.14Å; V65-L68 PolarHBondContact O-N 2.92Å; V65-A69 WeakPolarHBondContact O-CB 3.49Å; V65-A69 PolarHBondContact O-N 2.93Å
66	L	98.8	Very high	97.7	Very high	19 Å²	19	46.8 Å²	46.8	10%	0.099	25%	0.249	C	C	.	.	H	α-helix	trans	-61.8	-43.4	176	-179.2	63.1	0	0	0	112	L34 W62 G63 L68 A69 V70 L81 I193 L197	L34-L66 HydrophobicContact CD1-CB 3.86Å; L34-L66 HydrophobicContact CD1-CD1 4.06Å; L34-L66 HydrophobicContact CD2-CD1 3.98Å; W62-L66 PolarHBondContact O-N 2.96Å; G63-L66 PolarHBondContact O-N 3.2Å; L66-L68 VanDerWaalsContact C-N 3.29Å; L66-L68 PolarHBondContact O-N 3.38Å; L66-A69 PolarHBondContact O-N 2.75Å; L66-V70 HydrophobicContact CD1-CG2 3.88Å; L66-V70 HydrophobicContact CG-CG2 4.17Å; L66-V70 WeakPolarHBondContact O-CG2 3.32Å; L66-V70 PolarHBondContact O-N 3.41Å; L66-L81 HydrophobicContact CD1-CD1 4.11Å; L66-I193 HydrophobicContact CD2-CG2 3.63Å; L66-I193 HydrophobicContact CG-CG2 4.06Å; L66-L197 HydrophobicContact CB-CD2 3.71Å; L66-L197 HydrophobicContact CD2-CB 3.79Å; L66-L197 HydrophobicContact CD2-CD2 3.64Å; L66-L197 HydrophobicContact CD2-CG 4.23Å; L66-L197 HydrophobicContact CG-CD2 4.26Å
67	M	98.8	Very high	97.8	Very high	54 Å²	54	42 Å²	42	27%	0.266	23%	0.226	S	C	.	.	H	α-helix	trans	-53.3	-48.4	175.5	173.4	-178.2	72.3	0	0	111.3	G63 L64 V65 V70 L71 P190 A191	G63-M67 PolarHBondContact O-N 3.02Å; L64-M67 HydrophobicContact CD2-CE 3.86Å; L64-M67 WeakPolarHBondContact O-CB 3.13Å; L64-M67 PolarHBondContact O-N 3.32Å; V65-M67 PolarHBondContact O-N 3.14Å; M67-V70 PolarHBondContact O-N 3.17Å; M67-L71 WeakPolarHBondContact O-CB 3.34Å; M67-L71 PolarHBondContact O-N 3.44Å; M67-P190 WeakPolarHBondContact CA-O 3.31Å; M67-P190 HydrophobicContact CG-CB 4.35Å; M67-A191 HydrophobicContact SD-CB 4.03Å
68	L	98.8	Very high	97.8	Very high	77 Å²	77	43 Å²	43	40%	0.403	24%	0.236	S	C	.	.	H	α-helix	trans	-67.6	-40	178.9	-66.8	176.4	0	0	0	112.1	F33 L64 V65 L66 V70 L71 M72	F33-L68 HydrophobicContact CE1-CB 3.84Å; F33-L68 HydrophobicContact CZ-CB 4.21Å; F33-L68 HydrophobicContact CZ-CD1 4.32Å; L64-L68 WeakPolarHBondContact O-CG 3.3Å; L64-L68 PolarHBondContact O-N 3.49Å; L64-L68 VanDerWaalsContact O-N 3.15Å; V65-L68 PolarHBondContact O-N 2.92Å; L66-L68 VanDerWaalsContact C-N 3.29Å; L66-L68 PolarHBondContact O-N 3.38Å; L68-V70 PolarHBondContact O-N 3.02Å; L68-L71 HydrophobicContact CD2-CD2 4.49Å; L68-L71 WeakPolarHBondContact O-CB 3.49Å; L68-L71 PolarHBondContact O-N 2.76Å; L68-M72 WeakPolarHBondContact O-CG 3.04Å; L68-M72 PolarHBondContact O-N 2.95Å
69	A	98.7	Very high	97.8	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-61.3	-43.9	176.8	0	0	0	0	0	111.9	C30 F33 L34 V65 L66 M72 G73 L81	C30-A69 HydrophobicContact CB-CB 4.41Å; F33-A69 HydrophobicContact CD1-CB 4.02Å; L34-A69 HydrophobicContact CB-CB 4.37Å; V65-A69 WeakPolarHBondContact O-CB 3.49Å; V65-A69 PolarHBondContact O-N 2.93Å; L66-A69 PolarHBondContact O-N 2.75Å; A69-M72 PolarHBondContact O-N 3.39Å; A69-G73 PolarHBondContact O-N 2.98Å; A69-L81 HydrophobicContact CB-CD1 3.48Å; A69-L81 VanDerWaalsContact CB-CD1 3.48Å
70	V	98.7	Very high	97.9	Very high	8 Å²	8	44.2 Å²	44.2	5%	0.048	24%	0.243	C	C	.	.	H	α-helix	trans	-67.4	-40.7	176.1	176	0	0	0	0	111.1	L66 M67 L68 M72 G73 S74 A79 L81 P190 I193	L66-V70 HydrophobicContact CD1-CG2 3.88Å; L66-V70 HydrophobicContact CG-CG2 4.17Å; L66-V70 WeakPolarHBondContact O-CG2 3.32Å; L66-V70 PolarHBondContact O-N 3.41Å; M67-V70 PolarHBondContact O-N 3.17Å; L68-V70 PolarHBondContact O-N 3.02Å; V70-M72 VanDerWaalsContact C-N 3.27Å; V70-M72 PolarHBondContact O-N 2.85Å; V70-G73 PolarHBondContact O-N 3.41Å; V70-S74 WeakPolarHBondContact O-CB 3.31Å; V70-S74 PolarHBondContact O-N 3.27Å; V70-S74 PolarHBondContact O-OG 3.48Å; V70-A79 HydrophobicContact CB-CB 4.24Å; V70-A79 HydrophobicContact CG1-CB 4.2Å; V70-A79 HydrophobicContact CG2-CB 4.21Å; V70-L81 HydrophobicContact CG2-CD1 4.34Å; V70-P190 HydrophobicContact CB-CB 4.15Å; V70-P190 HydrophobicContact CG1-CB 3.94Å; V70-P190 HydrophobicContact CG1-CG 4.04Å; V70-I193 HydrophobicContact CG1-CD1 4.15Å; V70-I193 HydrophobicContact CG2-CG2 4.13Å
71	L	98.2	Very high	97.9	Very high	104 Å²	104	41.5 Å²	41.5	55%	0.545	23%	0.227	S	C	.	.	H	α-helix	trans	-58.1	-40.5	175.3	-177.2	65.7	0	0	0	111.8	M67 L68 P190	M67-L71 WeakPolarHBondContact O-CB 3.34Å; M67-L71 PolarHBondContact O-N 3.44Å; L68-L71 HydrophobicContact CD2-CD2 4.49Å; L68-L71 WeakPolarHBondContact O-CB 3.49Å; L68-L71 PolarHBondContact O-N 2.76Å; L71-P190 HydrophobicContact CB-CB 4.25Å; L71-P190 HydrophobicContact CB-CG 4.43Å; L71-P190 HydrophobicContact CD1-CG 4.33Å
72	M	97.6	Very high	97.9	Very high	81 Å²	81	41.2 Å²	41.2	40%	0.399	22%	0.222	S	C	.	.	H	α-helix	trans	-71	-46.1	177.6	-69.9	-173.2	-65.2	0	0	113.1	F29 F33 L68 A69 V70	F29-M72 HydrophobicContact CE1-CE 4.32Å; F29-M72 HydrophobicContact CE1-SD 4.15Å; F33-M72 HydrophobicContact CB-CE 4.09Å; F33-M72 HydrophobicContact CD1-CE 3.55Å; F33-M72 HydrophobicContact CD2-CE 3.87Å; F33-M72 HydrophobicContact CE1-CE 3.87Å; F33-M72 HydrophobicContact CE2-CE 4.16Å; F33-M72 HydrophobicContact CG-CE 3.55Å; F33-M72 HydrophobicContact CZ-CE 4.16Å; L68-M72 WeakPolarHBondContact O-CG 3.04Å; L68-M72 PolarHBondContact O-N 2.95Å; A69-M72 PolarHBondContact O-N 3.39Å; V70-M72 VanDerWaalsContact C-N 3.27Å; V70-M72 PolarHBondContact O-N 2.85Å
73	G	96.9	Very high	97.9	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-93.1	-20.5	-168.3	0	0	0	0	0	116.2	A69 V70 K75 I76 S77	A69-G73 PolarHBondContact O-N 2.98Å; V70-G73 PolarHBondContact O-N 3.41Å; G73-K75 VanDerWaalsContact C-N 3.33Å; G73-K75 PolarHBondContact O-N 2.87Å; G73-I76 PolarHBondContact O-N 3.49Å; G73-S77 PolarHBondContact O-N 2.98Å; G73-S77 VanDerWaalsContact O-N 3.08Å
74	S	95.6	Very high	97.9	Very high	47 Å²	47	41.3 Å²	41.3	33%	0.329	22%	0.223	S	C	.	.	H	α-helix	trans	-57.1	-39.7	-166.8	51	0	0	0	0	114.1	V70 I76 G78	V70-S74 WeakPolarHBondContact O-CB 3.31Å; V70-S74 PolarHBondContact O-N 3.27Å; V70-S74 PolarHBondContact O-OG 3.48Å; S74-I76 VanDerWaalsContact C-N 3.26Å; S74-I76 PolarHBondContact O-N 3.46Å; S74-G78 VanDerWaalsContact O-CA 3.29Å; S74-G78 WeakPolarHBondContact O-CA 3.46Å; S74-G78 PolarHBondContact O-N 3.37Å; S74-G78 VanDerWaalsContact O-N 3.12Å
75	K	95.1	Very high	97.9	Very high	203 Å²	203	37.4 Å²	37.4	88%	0.883	20%	0.203	S	C	*	.	H	α-helix	trans	-75	-8.7	179.3	-67	-169.7	177.9	-177	0	114.7	G73	G73-K75 VanDerWaalsContact C-N 3.33Å; G73-K75 PolarHBondContact O-N 2.87Å
76	I	96.5	Very high	98	Very high	62 Å²	62	36.5 Å²	36.5	32%	0.318	20%	0.197	S	C	.	.	H	α-helix	trans	-108.7	-57.7	-177	-54.2	176.9	0	0	0	110.6	R22 A26 G73 S74	R22-I76 HydrophobicContact CB-CG2 3.82Å; R22-I76 WeakPolarHBondContact O-CG2 3.12Å; A26-I76 HydrophobicContact CB-CB 3.86Å; A26-I76 HydrophobicContact CB-CD1 4.37Å; A26-I76 HydrophobicContact CB-CG2 3.75Å; G73-I76 PolarHBondContact O-N 3.49Å; S74-I76 VanDerWaalsContact C-N 3.26Å; S74-I76 PolarHBondContact O-N 3.46Å
77	S	96.9	Very high	98	Very high	8 Å²	8	38.7 Å²	38.7	6%	0.056	21%	0.206	C	C	.	.	H	α-helix	trans	-108.7	-11.6	-176.2	62.9	0	0	0	0	113.9	E27 G73 A79 Y103	E27-S77 VanDerWaalsContact OE1-CB 3.27Å; E27-S77 WeakPolarHBondContact OE1-CB 3.5Å; E27-S77 PolarHBondContact OE1-OG 3.21Å; G73-S77 PolarHBondContact O-N 2.98Å; G73-S77 VanDerWaalsContact O-N 3.08Å; S77-A79 VanDerWaalsContact C-N 3.28Å; S77-A79 PolarHBondContact OG-N 2.82Å; S77-Y103 WeakPolarHBondContact CA-OH 3.36Å; S77-Y103 WeakPolarHBondContact CB-OH 3.26Å; S77-Y103 WeakPolarHBondContact O-CE2 3.44Å; S77-Y103 PolarHBondContact O-OH 3.33Å
78	G	96.6	Very high	97.9	Very high	44 Å²	44	36.1 Å²	36.1	45%	0.454	19%	0.194	S	C	.	.			trans	86.4	-3.7	-161.9	0	0	0	0	0	113.5	S74	S74-G78 VanDerWaalsContact O-CA 3.29Å; S74-G78 WeakPolarHBondContact O-CA 3.46Å; S74-G78 PolarHBondContact O-N 3.37Å; S74-G78 VanDerWaalsContact O-N 3.12Å
79	A	98.1	Very high	97.9	Very high	10 Å²	10	33.4 Å²	33.4	8%	0.083	18%	0.179	C	C	.	.			trans	48.6	62.8	-177.3	0	0	0	0	0	113.1	E27 V70 S77 L81	E27-A79 WeakPolarHBondContact OE1-CA 3.19Å; V70-A79 HydrophobicContact CB-CB 4.24Å; V70-A79 HydrophobicContact CG1-CB 4.2Å; V70-A79 HydrophobicContact CG2-CB 4.21Å; S77-A79 VanDerWaalsContact C-N 3.28Å; S77-A79 PolarHBondContact OG-N 2.82Å; A79-L81 HydrophobicContact CB-CD1 4.35Å; A79-L81 HydrophobicContact CB-CD2 4.3Å; A79-L81 HydrophobicContact CB-CG 4.17Å
80	H	98.8	Very high	97.9	Very high	20 Å²	20	35.2 Å²	35.2	9%	0.093	19%	0.189	C	C	.	.			trans	-69.4	-45.8	177	-71.6	-163.9	0	0	0	110.8	E27 N82 V85 S86 Y103	E27-H80 PolarHBondContact OE1-N 2.95Å; H80-N82 WeakPolarHBondContact O-CB 3.26Å; H80-N82 PolarHBondContact O-N 3.07Å; H80-V85 HydrophobicContact CB-CG1 4.13Å; H80-S86 VanDerWaalsContact CB-OG 3.27Å; H80-S86 WeakPolarHBondContact CB-OG 3.41Å; H80-S86 VanDerWaalsContact ND1-CA 3.31Å; H80-S86 WeakPolarHBondContact ND1-CA 3.43Å; H80-S86 WeakPolarHBondContact ND1-CB 3.48Å; H80-S86 PolarHBondContact ND1-OG 2.97Å; H80-Y103 HydrophobicContact CB-CD2 4.04Å; H80-Y103 HydrophobicContact CB-CE2 4.35Å; H80-Y103 AromaticContact CE1-CE2 3.94Å; H80-Y103 AromaticContact CG-CD2 3.8Å; H80-Y103 AromaticContact CG-CE2 3.8Å; H80-Y103 AromaticContact ND1-CD2 3.5Å; H80-Y103 AromaticContact ND1-CE2 3.65Å
81	L	98.8	Very high	97.9	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.01	20%	0.202	C	C	.	.			trans	54.3	8.5	174.7	-43.1	-174.6	0	0	0	115.5	E27 C30 T31 L34 L66 A69 V70 A79 N213	E27-L81 WeakPolarHBondContact OE2-CA 3.49Å; E27-L81 PolarHBondContact OE2-N 3.35Å; C30-L81 HydrophobicContact CB-CD1 4Å; C30-L81 HydrophobicContact CB-CD2 3.35Å; C30-L81 HydrophobicContact CB-CG 4.34Å; T31-L81 VanDerWaalsContact OG1-CA 3.25Å; T31-L81 WeakPolarHBondContact OG1-CA 3.37Å; T31-L81 PolarHBondContact OG1-O 3.2Å; L34-L81 HydrophobicContact CD2-CB 4.24Å; L66-L81 HydrophobicContact CD1-CD1 4.11Å; A69-L81 HydrophobicContact CB-CD1 3.48Å; A69-L81 VanDerWaalsContact CB-CD1 3.48Å; V70-L81 HydrophobicContact CG2-CD1 4.34Å; A79-L81 HydrophobicContact CB-CD1 4.35Å; A79-L81 HydrophobicContact CB-CD2 4.3Å; A79-L81 HydrophobicContact CB-CG 4.17Å; L81-N213 PolarHBondContact O-ND2 3.34Å
82	N	98.9	Very high	97.9	Very high	7 Å²	7	34.1 Å²	34.1	4%	0.037	18%	0.184	C	C	.	.	S	Bend	trans	-154.1	122.8	-167.9	-178.2	-15.2	0	0	0	108.7	H80 A84 V85 S86 Q107 I212 N213 P214	H80-N82 WeakPolarHBondContact O-CB 3.26Å; H80-N82 PolarHBondContact O-N 3.07Å; N82-A84 VanDerWaalsContact C-N 3.26Å; N82-A84 PolarHBondContact O-N 3Å; N82-A84 WeakPolarHBondContact OD1-CB 3.42Å; N82-A84 PolarHBondContact OD1-N 2.93Å; N82-V85 HydrophobicContact CB-CB 3.99Å; N82-V85 HydrophobicContact CB-CG2 3.75Å; N82-V85 PolarHBondContact O-N 2.93Å; N82-S86 PolarHBondContact O-N 3.5Å; N82-S86 PolarHBondContact O-OG 3.48Å; N82-S86 VanDerWaalsContact O-OG 3.06Å; N82-Q107 VanDerWaalsContact C-OE1 3.31Å; N82-I212 PolarHBondContact ND2-O 3Å; N82-N213 HydrophobicContact CB-CB 4.28Å; N82-N213 WeakPolarHBondContact CB-ND2 3.46Å; N82-N213 VanDerWaalsContact CG-CG 3.43Å; N82-N213 WeakPolarHBondContact ND2-CB 3.29Å; N82-N213 WeakPolarHBondContact OD1-CA 3.25Å; N82-P214 VanDerWaalsContact OD1-CD 3.28Å; N82-P214 WeakPolarHBondContact OD1-CD 3.45Å
83	P	98.9	Very high	97.9	Very high	8 Å²	8	33.3 Å²	33.3	5%	0.052	20%	0.196	C	C	.	.	H	α-helix	trans	-57.9	-35.3	175.4	-29.2	36.6	0	0	0	113.6	S86 F87 Q107 N213 P214 A215 M250	P83-S86 PolarHBondContact O-N 2.92Å; P83-F87 VanDerWaalsContact O-CB 3.26Å; P83-F87 WeakPolarHBondContact O-CB 3.36Å; P83-F87 PolarHBondContact O-N 3.32Å; P83-Q107 VanDerWaalsContact CG-OE1 3.26Å; P83-N213 WeakPolarHBondContact CD-OD1 3.18Å; P83-P214 HydrophobicContact CB-CB 4.09Å; P83-P214 HydrophobicContact CB-CG 4.15Å; P83-P214 HydrophobicContact CG-CB 4.02Å; P83-P214 HydrophobicContact CG-CG 4.5Å; P83-A215 HydrophobicContact CG-CB 3.82Å; P83-M250 HydrophobicContact CB-SD 4.1Å
84	A	98.9	Very high	97.9	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-67.6	-37.9	177.5	0	0	0	0	0	112.4	N82 F87 F88 T167 P249 M250	N82-A84 VanDerWaalsContact C-N 3.26Å; N82-A84 PolarHBondContact O-N 3Å; N82-A84 WeakPolarHBondContact OD1-CB 3.42Å; N82-A84 PolarHBondContact OD1-N 2.93Å; A84-F87 PolarHBondContact O-N 3.17Å; A84-F88 PolarHBondContact O-N 2.77Å; A84-T167 HydrophobicContact CB-CG2 3.99Å; A84-P249 HydrophobicContact CB-CB 4.11Å; A84-P249 WeakPolarHBondContact CB-O 3.19Å; A84-M250 VanDerWaalsContact CA-SD 3.59Å; A84-M250 HydrophobicContact CB-SD 4.14Å
85	V	98.9	Very high	98	Very high	12 Å²	12	37.1 Å²	37.1	7%	0.073	21%	0.207	C	C	.	.	H	α-helix	trans	-64.3	-46.9	173.2	173.3	0	0	0	0	110.2	H80 N82 F87 F88 Q89	H80-V85 HydrophobicContact CB-CG1 4.13Å; N82-V85 HydrophobicContact CB-CB 3.99Å; N82-V85 HydrophobicContact CB-CG2 3.75Å; N82-V85 PolarHBondContact O-N 2.93Å; V85-F87 VanDerWaalsContact C-N 3.25Å; V85-F87 PolarHBondContact O-N 3.47Å; V85-F88 VanDerWaalsContact CA-CD1 3.48Å; V85-F88 VanDerWaalsContact CA-CE1 3.47Å; V85-F88 HydrophobicContact CB-CD1 4.42Å; V85-F88 HydrophobicContact CB-CE1 3.93Å; V85-F88 HydrophobicContact CG1-CE1 3.69Å; V85-F88 HydrophobicContact CG1-CZ 4.04Å; V85-F88 HydrophobicContact CG2-CE1 4.09Å; V85-F88 VanDerWaalsContact O-CD1 3.27Å; V85-F88 WeakPolarHBondContact O-CD1 3.27Å; V85-F88 WeakPolarHBondContact O-CE1 3.19Å; V85-F88 PolarHBondContact O-N 3.41Å; V85-Q89 WeakPolarHBondContact O-CG 3.37Å; V85-Q89 PolarHBondContact O-N 2.77Å; V85-Q89 VanDerWaalsContact O-N 3.17Å
86	S	98.9	Very high	98.2	Very high	0 Å²	0	32 Å²	32	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-61.3	-37.5	177.5	-52.2	0	0	0	0	112	H80 N82 P83 Q89 L90 I95 Q107	H80-S86 VanDerWaalsContact CB-OG 3.27Å; H80-S86 WeakPolarHBondContact CB-OG 3.41Å; H80-S86 VanDerWaalsContact ND1-CA 3.31Å; H80-S86 WeakPolarHBondContact ND1-CA 3.43Å; H80-S86 WeakPolarHBondContact ND1-CB 3.48Å; H80-S86 PolarHBondContact ND1-OG 2.97Å; N82-S86 PolarHBondContact O-N 3.5Å; N82-S86 PolarHBondContact O-OG 3.48Å; N82-S86 VanDerWaalsContact O-OG 3.06Å; P83-S86 PolarHBondContact O-N 2.92Å; S86-Q89 PolarHBondContact O-N 3.33Å; S86-L90 PolarHBondContact O-N 3.02Å; S86-I95 VanDerWaalsContact O-CD1 3.3Å; S86-I95 WeakPolarHBondContact O-CD1 3.49Å; S86-Q107 PolarHBondContact OG-NE2 3.36Å; S86-Q107 VanDerWaalsContact OG-NE2 3.08Å
87	F	98.9	Very high	98.3	Very high	65 Å²	65	34 Å²	34	29%	0.285	20%	0.2	S	C	.	.	H	α-helix	trans	-70.4	-43.8	-178.8	-169.6	-120.7	0	0	0	112.6	P83 A84 V85 Q89 L90 T91 F100 M250 V254	P83-F87 VanDerWaalsContact O-CB 3.26Å; P83-F87 WeakPolarHBondContact O-CB 3.36Å; P83-F87 PolarHBondContact O-N 3.32Å; A84-F87 PolarHBondContact O-N 3.17Å; V85-F87 VanDerWaalsContact C-N 3.25Å; V85-F87 PolarHBondContact O-N 3.47Å; F87-Q89 VanDerWaalsContact C-N 3.28Å; F87-Q89 PolarHBondContact O-N 3.39Å; F87-L90 HydrophobicContact CD2-CD2 4.19Å; F87-L90 HydrophobicContact CE2-CD2 4.35Å; F87-L90 VanDerWaalsContact O-CB 3.32Å; F87-L90 WeakPolarHBondContact O-CB 3.21Å; F87-L90 PolarHBondContact O-N 2.99Å; F87-L90 VanDerWaalsContact O-N 3.16Å; F87-T91 WeakPolarHBondContact O-CG2 3.07Å; F87-T91 PolarHBondContact O-N 3.16Å; F87-F100 HydrophobicContact CB-CD2 4.42Å; F87-F100 HydrophobicContact CB-CE2 3.82Å; F87-F100 HydrophobicContact CB-CZ 4.41Å; F87-F100 HydrophobicContact CD2-CE1 4.36Å; F87-F100 HydrophobicContact CD2-CE2 4.01Å; F87-F100 AromaticContact CD2-CZ 3.9Å; F87-F100 HydrophobicContact CD2-CZ 3.9Å; F87-F100 HydrophobicContact CG-CE2 4.38Å; F87-M250 HydrophobicContact CB-CE 3.45Å; F87-M250 VanDerWaalsContact CB-CE 3.45Å; F87-M250 HydrophobicContact CB-SD 4.01Å; F87-M250 HydrophobicContact CD1-CB 4.18Å; F87-M250 HydrophobicContact CD1-CE 3.76Å; F87-M250 HydrophobicContact CD2-CE 3.79Å; F87-M250 HydrophobicContact CE1-CE 4.44Å; F87-M250 HydrophobicContact CE2-CE 4.48Å; F87-M250 HydrophobicContact CG-CE 3.39Å; F87-M250 HydrophobicContact CG-SD 4.38Å; F87-V254 HydrophobicContact CD1-CG2 3.54Å; F87-V254 HydrophobicContact CE1-CG2 3.68Å
88	F	98.4	Very high	98.3	Very high	0 Å²	0	39 Å²	39	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-64.7	-37.8	175.9	84.7	-113.5	0	0	0	111.1	A84 V85 L90 T91 Q92 C171 V174 V254 A257	A84-F88 PolarHBondContact O-N 2.77Å; V85-F88 VanDerWaalsContact CA-CD1 3.48Å; V85-F88 VanDerWaalsContact CA-CE1 3.47Å; V85-F88 HydrophobicContact CB-CD1 4.42Å; V85-F88 HydrophobicContact CB-CE1 3.93Å; V85-F88 HydrophobicContact CG1-CE1 3.69Å; V85-F88 HydrophobicContact CG1-CZ 4.04Å; V85-F88 HydrophobicContact CG2-CE1 4.09Å; V85-F88 VanDerWaalsContact O-CD1 3.27Å; V85-F88 WeakPolarHBondContact O-CD1 3.27Å; V85-F88 WeakPolarHBondContact O-CE1 3.19Å; V85-F88 PolarHBondContact O-N 3.41Å; F88-L90 VanDerWaalsContact C-N 3.26Å; F88-L90 PolarHBondContact O-N 3.35Å; F88-T91 PolarHBondContact O-N 3.49Å; F88-T91 PolarHBondContact O-OG1 2.85Å; F88-Q92 PolarHBondContact O-N 3.33Å; F88-C171 HydrophobicContact CD1-CB 3.71Å; F88-C171 HydrophobicContact CE1-CB 3.78Å; F88-V174 HydrophobicContact CE1-CG1 4.45Å; F88-V174 HydrophobicContact CZ-CG1 4.03Å; F88-V254 HydrophobicContact CB-CG2 4.37Å; F88-A257 HydrophobicContact CB-CB 3.86Å; F88-A257 HydrophobicContact CD1-CB 4.19Å; F88-A257 HydrophobicContact CD2-CB 3.34Å; F88-A257 HydrophobicContact CE2-CB 3.91Å; F88-A257 HydrophobicContact CG-CB 3.55Å
89	Q	98.7	Very high	98.4	Very high	21 Å²	21	38.8 Å²	38.8	10%	0.098	21%	0.211	C	C	.	.	H	α-helix	trans	-62.4	-35.7	176.1	-66.1	-76.3	40.5	0	0	111.5	V85 S86 F87 Q92 G93 K94 I95	V85-Q89 WeakPolarHBondContact O-CG 3.37Å; V85-Q89 PolarHBondContact O-N 2.77Å; V85-Q89 VanDerWaalsContact O-N 3.17Å; S86-Q89 PolarHBondContact O-N 3.33Å; F87-Q89 VanDerWaalsContact C-N 3.28Å; F87-Q89 PolarHBondContact O-N 3.39Å; Q89-Q92 PolarHBondContact O-N 2.88Å; Q89-G93 PolarHBondContact O-N 2.83Å; Q89-K94 HydrophobicContact CB-CB 4.33Å; Q89-K94 PolarHBondContact O-N 3.47Å; Q89-I95 HydrophobicContact CB-CD1 4.48Å; Q89-I95 HydrophobicContact CB-CG1 4.13Å; Q89-I95 PolarHBondContact O-N 3.4Å
90	L	98.7	Very high	98.5	Very high	38 Å²	38	39.4 Å²	39.4	20%	0.199	21%	0.212	C	C	.	.	H	α-helix	trans	-62	-47	170.7	172.8	65.1	0	0	0	110.8	S86 F87 F88 Q92 G93 I95 L97 F100	S86-L90 PolarHBondContact O-N 3.02Å; F87-L90 HydrophobicContact CD2-CD2 4.19Å; F87-L90 HydrophobicContact CE2-CD2 4.35Å; F87-L90 VanDerWaalsContact O-CB 3.32Å; F87-L90 WeakPolarHBondContact O-CB 3.21Å; F87-L90 PolarHBondContact O-N 2.99Å; F87-L90 VanDerWaalsContact O-N 3.16Å; F88-L90 VanDerWaalsContact C-N 3.26Å; F88-L90 PolarHBondContact O-N 3.35Å; L90-Q92 VanDerWaalsContact C-N 3.28Å; L90-Q92 PolarHBondContact O-N 3.02Å; L90-G93 PolarHBondContact O-N 3.36Å; L90-I95 HydrophobicContact CB-CD1 4.43Å; L90-I95 HydrophobicContact CB-CG1 3.99Å; L90-I95 VanDerWaalsContact CD1-O 3.3Å; L90-I95 WeakPolarHBondContact CD1-O 3.44Å; L90-L97 HydrophobicContact CD1-CB 4.44Å; L90-L97 HydrophobicContact CD2-CD1 4.06Å; L90-F100 HydrophobicContact CB-CB 4.47Å; L90-F100 HydrophobicContact CD2-CB 4.02Å; L90-F100 HydrophobicContact CD2-CD1 3.98Å; L90-F100 HydrophobicContact CD2-CG 3.93Å
91	T	98.6	Very high	98.5	Very high	54 Å²	54	42.9 Å²	42.9	33%	0.331	23%	0.231	S	C	.	.	H	α-helix	trans	-63.9	-32.9	179.7	66.3	0	0	0	0	113.1	F87 F88 G93 V254 W258	F87-T91 WeakPolarHBondContact O-CG2 3.07Å; F87-T91 PolarHBondContact O-N 3.16Å; F88-T91 PolarHBondContact O-N 3.49Å; F88-T91 PolarHBondContact O-OG1 2.85Å; T91-G93 PolarHBondContact O-N 3.3Å; T91-V254 HydrophobicContact CG2-CG1 4.44Å; T91-V254 HydrophobicContact CG2-CG2 3.9Å; T91-W258 WeakPolarHBondContact O-CZ2 3.41Å; T91-W258 PolarHBondContact OG1-NE1 3.26Å
92	Q	98	Very high	98.4	Very high	35 Å²	35	44.4 Å²	44.4	16%	0.164	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82	2.7	175.7	-67.9	-172.2	-36	0	0	113	F88 Q89 L90 K94 W258 E261	F88-Q92 PolarHBondContact O-N 3.33Å; Q89-Q92 PolarHBondContact O-N 2.88Å; L90-Q92 VanDerWaalsContact C-N 3.28Å; L90-Q92 PolarHBondContact O-N 3.02Å; Q92-K94 VanDerWaalsContact C-N 3.25Å; Q92-K94 HydrophobicContact CB-CG 4.12Å; Q92-K94 PolarHBondContact O-N 3.42Å; Q92-W258 HydrophobicContact CG-CZ2 4.11Å; Q92-E261 PolarHBondContact NE2-OE1 2.91Å; Q92-E261 VanDerWaalsContact NE2-OE1 3.13Å
93	G	97.5	Very high	98.4	Very high	63 Å²	63	44.2 Å²	44.2	65%	0.649	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.2	11.4	-179.9	0	0	0	0	0	115.1	Q89 L90 T91	Q89-G93 PolarHBondContact O-N 2.83Å; L90-G93 PolarHBondContact O-N 3.36Å; T91-G93 PolarHBondContact O-N 3.3Å
94	K	96.7	Very high	98.4	Very high	107 Å²	107	44.7 Å²	44.7	47%	0.465	24%	0.243	S	C	.	.	S	Bend	trans	-77.5	-21.9	179.5	-52.1	-152.6	-167.6	125.1	0	112.8	Q89 Q92	Q89-K94 HydrophobicContact CB-CB 4.33Å; Q89-K94 PolarHBondContact O-N 3.47Å; Q92-K94 VanDerWaalsContact C-N 3.25Å; Q92-K94 HydrophobicContact CB-CG 4.12Å; Q92-K94 PolarHBondContact O-N 3.42Å
95	I	98.1	Very high	98.4	Very high	21 Å²	21	48.5 Å²	48.5	11%	0.108	27%	0.266	C	S	.	.	S	Bend	trans	-135.1	157.3	169.6	66.3	166.8	0	0	0	110.8	S86 Q89 L90 R99 F100	S86-I95 VanDerWaalsContact O-CD1 3.3Å; S86-I95 WeakPolarHBondContact O-CD1 3.49Å; Q89-I95 HydrophobicContact CB-CD1 4.48Å; Q89-I95 HydrophobicContact CB-CG1 4.13Å; Q89-I95 PolarHBondContact O-N 3.4Å; L90-I95 HydrophobicContact CB-CD1 4.43Å; L90-I95 HydrophobicContact CB-CG1 3.99Å; L90-I95 VanDerWaalsContact CD1-O 3.3Å; L90-I95 WeakPolarHBondContact CD1-O 3.44Å; I95-R99 HydrophobicContact CB-CB 4.42Å; I95-R99 HydrophobicContact CB-CG 4.4Å; I95-F100 HydrophobicContact CD1-CB 3.88Å
96	N	98.2	Very high	98.4	Very high	95 Å²	95	47.9 Å²	47.9	51%	0.508	26%	0.263	S	S	.	.			trans	-90.4	167.4	173.7	69	37.3	0	0	0	112.4	I98 R99 F100	N96-I98 VanDerWaalsContact C-N 3.31Å; N96-I98 PolarHBondContact O-N 3.03Å; N96-I98 PolarHBondContact OD1-N 2.84Å; N96-R99 PolarHBondContact O-N 3.41Å; N96-R99 WeakPolarHBondContact OD1-CB 3.23Å; N96-R99 PolarHBondContact OD1-N 2.84Å; N96-F100 PolarHBondContact O-N 2.72Å
97	L	98.4	Very high	98.4	Very high	104 Å²	104	47.9 Å²	47.9	55%	0.545	26%	0.263	S	S	.	.	H	α-helix	trans	-58.8	-40	-177.2	179.6	62.3	0	0	0	112.9	L90 R99 F100 L101	L90-L97 HydrophobicContact CD1-CB 4.44Å; L90-L97 HydrophobicContact CD2-CD1 4.06Å; L97-R99 PolarHBondContact O-N 3.47Å; L97-F100 HydrophobicContact CD1-CD1 4.11Å; L97-F100 WeakPolarHBondContact O-CB 3.32Å; L97-F100 PolarHBondContact O-N 3.13Å; L97-L101 HydrophobicContact CD1-CG 4.37Å; L97-L101 HydrophobicContact CG-CD1 4.32Å; L97-L101 WeakPolarHBondContact O-CG 3.46Å; L97-L101 PolarHBondContact O-N 3.08Å
98	I	98.4	Very high	98.4	Very high	113 Å²	113	46.7 Å²	46.7	58%	0.579	26%	0.259	S	S	*	.	H	α-helix	trans	-63	-46.5	-179.7	-63.3	174.4	0	0	0	110	L20 N96 F100 L101 V102	L20-I98 HydrophobicContact CD2-CG2 4.3Å; N96-I98 VanDerWaalsContact C-N 3.31Å; N96-I98 PolarHBondContact O-N 3.03Å; N96-I98 PolarHBondContact OD1-N 2.84Å; I98-F100 VanDerWaalsContact C-N 3.33Å; I98-F100 PolarHBondContact O-N 3.39Å; I98-L101 PolarHBondContact O-N 2.79Å; I98-V102 HydrophobicContact CG2-CG2 4.46Å; I98-V102 WeakPolarHBondContact O-CG2 3.5Å; I98-V102 PolarHBondContact O-N 2.85Å
99	R	98.5	Very high	98.5	Very high	40 Å²	40	50 Å²	50	15%	0.151	28%	0.276	C	S	.	.	H	α-helix	trans	-61.6	-43	177.1	-175.8	175.5	-64.5	-104.7	0.2	111.4	E19 L20 I95 N96 L97 L101 V102 Y103	E19-R99 IonicContact OE1-CZ 3.79Å; E19-R99 IonicContact OE1-NH1 2.76Å; E19-R99 PolarHBondContact OE1-NH1 3.37Å; E19-R99 IonicContact OE1-NH2 2.71Å; E19-R99 PolarHBondContact OE1-NH2 3.46Å; E19-R99 IonicContact OE2-CZ 3.85Å; E19-R99 IonicContact OE2-NH2 3.14Å; E19-R99 PolarHBondContact OE2-NH2 2.91Å; L20-R99 HydrophobicContact CD1-CB 4.42Å; L20-R99 HydrophobicContact CD1-CG 4.33Å; I95-R99 HydrophobicContact CB-CB 4.42Å; I95-R99 HydrophobicContact CB-CG 4.4Å; N96-R99 PolarHBondContact O-N 3.41Å; N96-R99 WeakPolarHBondContact OD1-CB 3.23Å; N96-R99 PolarHBondContact OD1-N 2.84Å; L97-R99 PolarHBondContact O-N 3.47Å; R99-L101 PolarHBondContact O-N 3.03Å; R99-V102 PolarHBondContact O-N 3.48Å; R99-Y103 HydrophobicContact CG-CD1 3.74Å; R99-Y103 HydrophobicContact CG-CE1 3.37Å; R99-Y103 HydrophobicContact CG-CE2 4.39Å; R99-Y103 HydrophobicContact CG-CG 4.38Å; R99-Y103 PolarHBondContact NH1-OH 2.99Å; R99-Y103 WeakPolarHBondContact O-CB 3.43Å; R99-Y103 WeakPolarHBondContact O-CD1 3.43Å; R99-Y103 PolarHBondContact O-N 2.94Å
100	F	98.7	Very high	98.5	Very high	23 Å²	23	49.1 Å²	49.1	10%	0.101	27%	0.272	C	S	.	.	H	α-helix	trans	-55.8	-49.3	175	164.7	-105.9	0	0	0	111.9	F87 L90 I95 N96 L97 I98 V102 Y103 A104 M250	F87-F100 HydrophobicContact CB-CD2 4.42Å; F87-F100 HydrophobicContact CB-CE2 3.82Å; F87-F100 HydrophobicContact CB-CZ 4.41Å; F87-F100 HydrophobicContact CD2-CE1 4.36Å; F87-F100 HydrophobicContact CD2-CE2 4.01Å; F87-F100 AromaticContact CD2-CZ 3.9Å; F87-F100 HydrophobicContact CD2-CZ 3.9Å; F87-F100 HydrophobicContact CG-CE2 4.38Å; L90-F100 HydrophobicContact CB-CB 4.47Å; L90-F100 HydrophobicContact CD2-CB 4.02Å; L90-F100 HydrophobicContact CD2-CD1 3.98Å; L90-F100 HydrophobicContact CD2-CG 3.93Å; I95-F100 HydrophobicContact CD1-CB 3.88Å; N96-F100 PolarHBondContact O-N 2.72Å; L97-F100 HydrophobicContact CD1-CD1 4.11Å; L97-F100 WeakPolarHBondContact O-CB 3.32Å; L97-F100 PolarHBondContact O-N 3.13Å; I98-F100 VanDerWaalsContact C-N 3.33Å; I98-F100 PolarHBondContact O-N 3.39Å; F100-V102 PolarHBondContact O-N 2.81Å; F100-Y103 PolarHBondContact O-N 2.83Å; F100-A104 WeakPolarHBondContact O-CB 3.45Å; F100-A104 PolarHBondContact O-N 2.99Å; F100-M250 HydrophobicContact CE2-CE 4.17Å; F100-M250 HydrophobicContact CZ-CE 3.86Å
101	L	98.6	Very high	98.5	Very high	93 Å²	93	47.3 Å²	47.3	49%	0.487	26%	0.263	S	S	.	.	H	α-helix	trans	-63.5	-43	179.5	-66.5	175	0	0	0	111.9	L97 I98 R99 Y103 A104 V105	L97-L101 HydrophobicContact CD1-CG 4.37Å; L97-L101 HydrophobicContact CG-CD1 4.32Å; L97-L101 WeakPolarHBondContact O-CG 3.46Å; L97-L101 PolarHBondContact O-N 3.08Å; I98-L101 PolarHBondContact O-N 2.79Å; R99-L101 PolarHBondContact O-N 3.03Å; L101-Y103 VanDerWaalsContact C-N 3.32Å; L101-Y103 PolarHBondContact O-N 3.06Å; L101-A104 PolarHBondContact O-N 3.46Å; L101-V105 WeakPolarHBondContact O-CG2 3.32Å; L101-V105 PolarHBondContact O-N 3.47Å
102	V	98.6	Very high	98.5	Very high	34 Å²	34	47.5 Å²	47.5	21%	0.206	26%	0.259	C	S	.	.	H	α-helix	trans	-60.5	-43	175.8	169.5	0	0	0	0	111.1	L20 F24 I98 R99 F100 V105 A106	L20-V102 HydrophobicContact CD1-CB 4.09Å; L20-V102 HydrophobicContact CD1-CG1 3.87Å; L20-V102 HydrophobicContact CD1-CG2 4.22Å; L20-V102 HydrophobicContact CD2-CG2 4.17Å; L20-V102 HydrophobicContact CG-CG1 4.17Å; L20-V102 HydrophobicContact CG-CG2 4.33Å; F24-V102 HydrophobicContact CB-CG1 3.85Å; F24-V102 HydrophobicContact CD2-CG1 3.81Å; F24-V102 HydrophobicContact CG-CG1 4.32Å; I98-V102 HydrophobicContact CG2-CG2 4.46Å; I98-V102 WeakPolarHBondContact O-CG2 3.5Å; I98-V102 PolarHBondContact O-N 2.85Å; R99-V102 PolarHBondContact O-N 3.48Å; F100-V102 PolarHBondContact O-N 2.81Å; V102-V105 PolarHBondContact O-N 3.43Å; V102-A106 WeakPolarHBondContact O-CB 3.38Å; V102-A106 PolarHBondContact O-N 2.91Å
103	Y	98.8	Very high	98.6	Very high	2 Å²	2	49.9 Å²	49.9	1%	0.008	27%	0.273	C	S	.	.	H	α-helix	trans	-65.7	-47.4	178.4	-81.4	31.4	0	0	0	110.8	A23 E27 S77 H80 R99 F100 L101 V105 A106 Q107	A23-Y103 HydrophobicContact CB-CE1 3.64Å; E27-Y103 HydrophobicContact CG-CD1 4.06Å; E27-Y103 HydrophobicContact CG-CD2 3.78Å; E27-Y103 HydrophobicContact CG-CE1 4.25Å; E27-Y103 HydrophobicContact CG-CE2 3.98Å; E27-Y103 HydrophobicContact CG-CG 3.83Å; S77-Y103 WeakPolarHBondContact CA-OH 3.36Å; S77-Y103 WeakPolarHBondContact CB-OH 3.26Å; S77-Y103 WeakPolarHBondContact O-CE2 3.44Å; S77-Y103 PolarHBondContact O-OH 3.33Å; H80-Y103 HydrophobicContact CB-CD2 4.04Å; H80-Y103 HydrophobicContact CB-CE2 4.35Å; H80-Y103 AromaticContact CE1-CE2 3.94Å; H80-Y103 AromaticContact CG-CD2 3.8Å; H80-Y103 AromaticContact CG-CE2 3.8Å; H80-Y103 AromaticContact ND1-CD2 3.5Å; H80-Y103 AromaticContact ND1-CE2 3.65Å; R99-Y103 HydrophobicContact CG-CD1 3.74Å; R99-Y103 HydrophobicContact CG-CE1 3.37Å; R99-Y103 HydrophobicContact CG-CE2 4.39Å; R99-Y103 HydrophobicContact CG-CG 4.38Å; R99-Y103 PolarHBondContact NH1-OH 2.99Å; R99-Y103 WeakPolarHBondContact O-CB 3.43Å; R99-Y103 WeakPolarHBondContact O-CD1 3.43Å; R99-Y103 PolarHBondContact O-N 2.94Å; F100-Y103 PolarHBondContact O-N 2.83Å; L101-Y103 VanDerWaalsContact C-N 3.32Å; L101-Y103 PolarHBondContact O-N 3.06Å; Y103-V105 VanDerWaalsContact C-N 3.3Å; Y103-V105 PolarHBondContact O-N 2.87Å; Y103-A106 WeakPolarHBondContact O-CB 3.44Å; Y103-A106 PolarHBondContact O-N 3.18Å; Y103-Q107 VanDerWaalsContact O-CB 3.31Å; Y103-Q107 WeakPolarHBondContact O-CB 3.45Å; Y103-Q107 WeakPolarHBondContact O-CG 3.5Å; Y103-Q107 PolarHBondContact O-N 3.48Å; Y103-Q107 PolarHBondContact O-OE1 2.98Å
104	A	98.8	Very high	98.6	Very high	18 Å²	18	47.1 Å²	47.1	15%	0.149	24%	0.244	C	C	.	.	H	α-helix	trans	-58.6	-41.5	178.8	0	0	0	0	0	111.9	F100 L101 N108	F100-A104 WeakPolarHBondContact O-CB 3.45Å; F100-A104 PolarHBondContact O-N 2.99Å; L101-A104 PolarHBondContact O-N 3.46Å; A104-N108 PolarHBondContact O-N 2.93Å; A104-N108 VanDerWaalsContact O-N 3.17Å; A104-N108 PolarHBondContact O-ND2 2.9Å
105	V	98.8	Very high	98.7	Very high	80 Å²	80	42 Å²	42	49%	0.485	22%	0.222	S	C	.	.	H	α-helix	trans	-66.2	-48.5	175.1	173.2	0	0	0	0	111.1	F24 L101 V102 Y103 Q107 N108 I109	F24-V105 HydrophobicContact CE2-CG1 4.25Å; L101-V105 WeakPolarHBondContact O-CG2 3.32Å; L101-V105 PolarHBondContact O-N 3.47Å; V102-V105 PolarHBondContact O-N 3.43Å; Y103-V105 VanDerWaalsContact C-N 3.3Å; Y103-V105 PolarHBondContact O-N 2.87Å; V105-Q107 VanDerWaalsContact C-N 3.34Å; V105-Q107 PolarHBondContact O-N 3.11Å; V105-N108 PolarHBondContact O-N 3.29Å; V105-I109 HydrophobicContact CG1-CD1 3.72Å; V105-I109 HydrophobicContact CG1-CG1 4.45Å; V105-I109 WeakPolarHBondContact O-CG1 3.38Å; V105-I109 PolarHBondContact O-N 3.29Å
106	A	98.9	Very high	98.8	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-56.1	-48.6	178.5	0	0	0	0	0	112	F24 E27 L28 V102 Y103 N108 I109 G110	F24-A106 HydrophobicContact CD2-CB 3.51Å; F24-A106 HydrophobicContact CE2-CB 3.73Å; F24-A106 HydrophobicContact CG-CB 4.09Å; F24-A106 HydrophobicContact CZ-CB 4.46Å; F24-A106 WeakPolarHBondContact O-CB 3.13Å; E27-A106 HydrophobicContact CB-CB 3.74Å; L28-A106 WeakPolarHBondContact CA-O 3.42Å; L28-A106 HydrophobicContact CB-CB 4.21Å; V102-A106 WeakPolarHBondContact O-CB 3.38Å; V102-A106 PolarHBondContact O-N 2.91Å; Y103-A106 WeakPolarHBondContact O-CB 3.44Å; Y103-A106 PolarHBondContact O-N 3.18Å; A106-N108 PolarHBondContact O-N 2.88Å; A106-I109 PolarHBondContact O-N 3.28Å; A106-G110 PolarHBondContact O-N 3Å
107	Q	98.9	Very high	98.8	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-60.8	-44.5	-179	-70.1	156.7	-1	0	0	111.3	E27 T31 N82 P83 S86 Y103 V105 G110 A111 A215	E27-Q107 HydrophobicContact CB-CG 4.3Å; E27-Q107 WeakPolarHBondContact OE2-CG 3.43Å; E27-Q107 PolarHBondContact OE2-NE2 3.35Å; T31-Q107 HydrophobicContact CG2-CB 4.15Å; T31-Q107 WeakPolarHBondContact CG2-O 3.2Å; T31-Q107 WeakPolarHBondContact OG1-CG 3.49Å; N82-Q107 VanDerWaalsContact C-OE1 3.31Å; P83-Q107 VanDerWaalsContact CG-OE1 3.26Å; S86-Q107 PolarHBondContact OG-NE2 3.36Å; S86-Q107 VanDerWaalsContact OG-NE2 3.08Å; Y103-Q107 VanDerWaalsContact O-CB 3.31Å; Y103-Q107 WeakPolarHBondContact O-CB 3.45Å; Y103-Q107 WeakPolarHBondContact O-CG 3.5Å; Y103-Q107 PolarHBondContact O-N 3.48Å; Y103-Q107 PolarHBondContact O-OE1 2.98Å; V105-Q107 VanDerWaalsContact C-N 3.34Å; V105-Q107 PolarHBondContact O-N 3.11Å; Q107-G110 PolarHBondContact O-N 3.23Å; Q107-A111 VanDerWaalsContact O-CB 3.26Å; Q107-A111 WeakPolarHBondContact O-CB 3.35Å; Q107-A111 PolarHBondContact O-N 2.98Å; Q107-A215 HydrophobicContact CB-CB 3.75Å
108	N	98.9	Very high	98.8	Very high	40 Å²	40	37.2 Å²	37.2	21%	0.214	20%	0.196	C	C	.	.	H	α-helix	trans	-67.2	-41.7	178.1	-80.5	-74.3	0	0	0	112.3	A104 V105 A106 G110 A111 F112 F218 A219	A104-N108 PolarHBondContact O-N 2.93Å; A104-N108 VanDerWaalsContact O-N 3.17Å; A104-N108 PolarHBondContact O-ND2 2.9Å; V105-N108 PolarHBondContact O-N 3.29Å; A106-N108 PolarHBondContact O-N 2.88Å; N108-G110 VanDerWaalsContact C-N 3.34Å; N108-A111 PolarHBondContact O-N 3.5Å; N108-F112 WeakPolarHBondContact O-CB 3.35Å; N108-F112 PolarHBondContact O-N 3.48Å; N108-F218 WeakPolarHBondContact OD1-CD1 3.18Å; N108-A219 HydrophobicContact CB-CB 4.32Å; N108-A219 WeakPolarHBondContact O-CB 3.39Å
109	I	98.9	Very high	98.8	Very high	70 Å²	70	33 Å²	33	36%	0.359	17%	0.174	S	C	.	.	H	α-helix	trans	-62.1	-46.5	174.7	-65.4	168	0	0	0	110	F24 L28 V105 A106 F112 L113	F24-I109 HydrophobicContact CZ-CD1 4.1Å; L28-I109 HydrophobicContact CD1-CB 4.26Å; L28-I109 HydrophobicContact CD1-CG2 3.72Å; L28-I109 HydrophobicContact CG-CG2 4.17Å; V105-I109 HydrophobicContact CG1-CD1 3.72Å; V105-I109 HydrophobicContact CG1-CG1 4.45Å; V105-I109 WeakPolarHBondContact O-CG1 3.38Å; V105-I109 PolarHBondContact O-N 3.29Å; A106-I109 PolarHBondContact O-N 3.28Å; I109-F112 PolarHBondContact O-N 3.29Å; I109-L113 HydrophobicContact CG2-CD1 4.06Å; I109-L113 WeakPolarHBondContact O-CG 3.31Å; I109-L113 PolarHBondContact O-N 2.9Å
110	G	98.9	Very high	98.8	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.01	19%	0.19	C	C	.	.	H	α-helix	trans	-55.9	-54.2	176.5	0	0	0	0	0	112	L28 G32 A106 Q107 N108 F112 L113 G114	L28-G110 WeakPolarHBondContact O-CA 3.49Å; G32-G110 VanDerWaalsContact CA-C 3.41Å; G32-G110 WeakPolarHBondContact CA-O 3.27Å; A106-G110 PolarHBondContact O-N 3Å; Q107-G110 PolarHBondContact O-N 3.23Å; N108-G110 VanDerWaalsContact C-N 3.34Å; G110-F112 VanDerWaalsContact C-N 3.34Å; G110-F112 PolarHBondContact O-N 3.22Å; G110-L113 PolarHBondContact O-N 3.34Å; G110-L113 VanDerWaalsContact O-N 3.13Å; G110-G114 PolarHBondContact O-N 3.47Å
111	A	98.9	Very high	98.8	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-57.5	-43.3	179	0	0	0	0	0	112.7	T31 V35 Q107 N108 L113 G114 A115 A215 A219	T31-A111 HydrophobicContact CG2-CB 3.95Å; V35-A111 HydrophobicContact CB-CB 4.4Å; V35-A111 WeakPolarHBondContact CG1-O 3.06Å; V35-A111 HydrophobicContact CG2-CB 3.67Å; Q107-A111 VanDerWaalsContact O-CB 3.26Å; Q107-A111 WeakPolarHBondContact O-CB 3.35Å; Q107-A111 PolarHBondContact O-N 2.98Å; N108-A111 PolarHBondContact O-N 3.5Å; A111-L113 PolarHBondContact O-N 3.46Å; A111-G114 PolarHBondContact O-N 3.15Å; A111-A115 PolarHBondContact O-N 3.47Å; A111-A215 HydrophobicContact CB-CB 4.43Å; A111-A215 WeakPolarHBondContact CB-O 3.37Å; A111-A219 HydrophobicContact CB-CB 3.68Å
112	F	98.9	Very high	98.8	Very high	58 Å²	58	35.8 Å²	35.8	25%	0.254	20%	0.198	S	C	.	.	H	α-helix	trans	-58.9	-46.5	174.6	-177.5	-82.8	0	0	0	111.8	N108 I109 G110 G114 A115 F116 A219 L222 F223	N108-F112 WeakPolarHBondContact O-CB 3.35Å; N108-F112 PolarHBondContact O-N 3.48Å; I109-F112 PolarHBondContact O-N 3.29Å; G110-F112 VanDerWaalsContact C-N 3.34Å; G110-F112 PolarHBondContact O-N 3.22Å; F112-G114 VanDerWaalsContact C-N 3.33Å; F112-A115 PolarHBondContact O-N 3.34Å; F112-F116 PolarHBondContact O-N 3.38Å; F112-A219 HydrophobicContact CB-CB 4.09Å; F112-L222 HydrophobicContact CD2-CB 4.33Å; F112-L222 HydrophobicContact CD2-CD2 4.31Å; F112-L222 HydrophobicContact CD2-CG 4.28Å; F112-L222 HydrophobicContact CE2-CB 4.45Å; F112-L222 HydrophobicContact CE2-CD2 4.4Å; F112-L222 HydrophobicContact CE2-CG 4.1Å; F112-F223 HydrophobicContact CD2-CB 3.85Å; F112-F223 HydrophobicContact CE1-CD2 4.33Å; F112-F223 VanDerWaalsContact CE2-CA 3.49Å; F112-F223 HydrophobicContact CE2-CB 3.78Å; F112-F223 HydrophobicContact CE2-CD2 4.27Å; F112-F223 HydrophobicContact CG-CB 4.5Å; F112-F223 HydrophobicContact CZ-CB 4.36Å; F112-F223 HydrophobicContact CZ-CD2 4.01Å
113	L	98.9	Very high	98.8	Very high	86 Å²	86	39.1 Å²	39.1	45%	0.45	21%	0.208	S	C	.	.	H	α-helix	trans	-67.1	-34.6	178.7	-67.5	175	0	0	0	112.3	L28 I109 G110 A111 F116 G117	L28-L113 HydrophobicContact CD2-CD1 4.34Å; I109-L113 HydrophobicContact CG2-CD1 4.06Å; I109-L113 WeakPolarHBondContact O-CG 3.31Å; I109-L113 PolarHBondContact O-N 2.9Å; G110-L113 PolarHBondContact O-N 3.34Å; G110-L113 VanDerWaalsContact O-N 3.13Å; A111-L113 PolarHBondContact O-N 3.46Å; L113-F116 PolarHBondContact O-N 2.83Å; L113-G117 PolarHBondContact O-N 3.01Å
114	G	98.9	Very high	98.8	Very high	4 Å²	4	44.8 Å²	44.8	4%	0.041	24%	0.238	C	C	.	.	H	α-helix	trans	-60.9	-47.7	173.2	0	0	0	0	0	111.8	G32 G110 A111 F112 G117 V118	G32-G114 WeakPolarHBondContact O-CA 3.18Å; G110-G114 PolarHBondContact O-N 3.47Å; A111-G114 PolarHBondContact O-N 3.15Å; F112-G114 VanDerWaalsContact C-N 3.33Å; G114-G117 WeakPolarHBondContact O-CA 3.44Å; G114-G117 PolarHBondContact O-N 3.02Å; G114-G117 VanDerWaalsContact O-N 3.15Å; G114-V118 WeakPolarHBondContact O-CG2 3.14Å; G114-V118 PolarHBondContact O-N 2.83Å
115	A	98.9	Very high	98.7	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-63.6	-42.9	176.8	0	0	0	0	0	113.1	V35 E39 A111 F112 G117 V118 F119 F146 P220 F223	V35-A115 HydrophobicContact CG1-CB 4.38Å; E39-A115 WeakPolarHBondContact OE2-CA 3.36Å; E39-A115 VanDerWaalsContact OE2-CB 3.32Å; E39-A115 WeakPolarHBondContact OE2-CB 3.5Å; A111-A115 PolarHBondContact O-N 3.47Å; F112-A115 PolarHBondContact O-N 3.34Å; A115-G117 VanDerWaalsContact C-N 3.28Å; A115-G117 PolarHBondContact O-N 3.37Å; A115-V118 PolarHBondContact O-N 3.18Å; A115-F119 PolarHBondContact O-N 3.3Å; A115-F146 HydrophobicContact CB-CD1 4.01Å; A115-F146 WeakPolarHBondContact O-CE1 3.47Å; A115-P220 HydrophobicContact CB-CB 3.96Å; A115-P220 HydrophobicContact CB-CG 4.15Å; A115-F223 HydrophobicContact CB-CB 4.08Å; A115-F223 HydrophobicContact CB-CD1 3.83Å; A115-F223 HydrophobicContact CB-CG 4Å
116	F	98.9	Very high	98.7	Very high	101 Å²	101	42.3 Å²	42.3	44%	0.443	23%	0.226	S	C	.	.	H	α-helix	trans	-56.4	-44	171	171.7	-112.8	0	0	0	112	F112 L113 V118 F119 C120 F223	F112-F116 PolarHBondContact O-N 3.38Å; L113-F116 PolarHBondContact O-N 2.83Å; F116-V118 PolarHBondContact O-N 3Å; F116-F119 PolarHBondContact O-N 2.94Å; F116-C120 VanDerWaalsContact CE2-SG 3.54Å; F116-C120 VanDerWaalsContact CZ-SG 3.54Å; F116-C120 PolarHBondContact O-N 3.34Å; F116-C120 PolarHBondContact O-SG 3.44Å; F116-F223 HydrophobicContact CB-CD2 3.97Å; F116-F223 HydrophobicContact CB-CE2 3.78Å; F116-F223 HydrophobicContact CB-CZ 4.41Å; F116-F223 AromaticContact CD2-CE2 3.74Å; F116-F223 HydrophobicContact CD2-CE2 3.74Å; F116-F223 HydrophobicContact CD2-CZ 4.3Å; F116-F223 HydrophobicContact CG-CE2 4.26Å
117	G	98.9	Very high	98.7	Very high	18 Å²	18	43.8 Å²	43.8	19%	0.186	23%	0.234	C	C	.	.	H	α-helix	trans	-58.5	-45.1	175.9	0	0	0	0	0	112.9	L113 G114 A115 C120 V121	L113-G117 PolarHBondContact O-N 3.01Å; G114-G117 WeakPolarHBondContact O-CA 3.44Å; G114-G117 PolarHBondContact O-N 3.02Å; G114-G117 VanDerWaalsContact O-N 3.15Å; A115-G117 VanDerWaalsContact C-N 3.28Å; A115-G117 PolarHBondContact O-N 3.37Å; G117-C120 PolarHBondContact O-N 3.3Å; G117-V121 WeakPolarHBondContact O-CG2 3.23Å; G117-V121 PolarHBondContact O-N 3.37Å
118	V	98.9	Very high	98.6	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-62.7	-44.7	177.1	178.9	0	0	0	0	111.1	F36 E39 A43 G114 A115 F116 C120 V121 Y122 I145 F146	F36-V118 HydrophobicContact CD2-CG2 3.76Å; F36-V118 HydrophobicContact CE2-CG2 4.32Å; F36-V118 HydrophobicContact CG-CG2 4.36Å; F36-V118 VanDerWaalsContact O-CG2 3.23Å; F36-V118 WeakPolarHBondContact O-CG2 3.46Å; E39-V118 HydrophobicContact CB-CB 4.25Å; E39-V118 HydrophobicContact CB-CG1 4.12Å; E39-V118 HydrophobicContact CB-CG2 3.64Å; A43-V118 HydrophobicContact CB-CG1 4.24Å; G114-V118 WeakPolarHBondContact O-CG2 3.14Å; G114-V118 PolarHBondContact O-N 2.83Å; A115-V118 PolarHBondContact O-N 3.18Å; F116-V118 PolarHBondContact O-N 3Å; V118-C120 VanDerWaalsContact C-N 3.3Å; V118-C120 PolarHBondContact O-N 3.18Å; V118-V121 PolarHBondContact O-N 3.4Å; V118-Y122 HydrophobicContact CG1-CD2 3.9Å; V118-Y122 HydrophobicContact CG1-CE2 4.47Å; V118-Y122 PolarHBondContact O-N 3.16Å; V118-I145 HydrophobicContact CG1-CG2 4.26Å; V118-F146 HydrophobicContact CB-CE1 4.18Å; V118-F146 HydrophobicContact CG1-CE1 4.21Å
119	F	98.7	Very high	98.6	Very high	26 Å²	26	49.6 Å²	49.6	11%	0.114	27%	0.268	C	S	.	.	H	α-helix	trans	-59.2	-40.8	176.9	-178.9	-99.4	0	0	0	112.3	A115 F116 Y123 I126 F146 F223 A227	A115-F119 PolarHBondContact O-N 3.3Å; F116-F119 PolarHBondContact O-N 2.94Å; F119-Y123 HydrophobicContact CD1-CD2 4.17Å; F119-Y123 AromaticContact CE1-CD2 3.48Å; F119-Y123 HydrophobicContact CE1-CD2 3.48Å; F119-Y123 VanDerWaalsContact CE1-CD2 3.48Å; F119-Y123 AromaticContact CE1-CE2 3.73Å; F119-Y123 HydrophobicContact CE1-CE2 3.73Å; F119-Y123 HydrophobicContact CE2-CD2 4.27Å; F119-Y123 AromaticContact CZ-CD2 3.54Å; F119-Y123 HydrophobicContact CZ-CD2 3.54Å; F119-Y123 AromaticContact CZ-CE2 3.62Å; F119-Y123 HydrophobicContact CZ-CE2 3.62Å; F119-Y123 WeakPolarHBondContact O-CA 3.43Å; F119-Y123 VanDerWaalsContact O-CB 3.31Å; F119-Y123 WeakPolarHBondContact O-CB 3.27Å; F119-Y123 PolarHBondContact O-N 3.47Å; F119-I126 HydrophobicContact CD2-CD1 4.11Å; F119-F146 HydrophobicContact CB-CE1 4Å; F119-F146 HydrophobicContact CB-CZ 4.02Å; F119-F146 HydrophobicContact CD2-CZ 4.09Å; F119-F223 HydrophobicContact CB-CE1 3.49Å; F119-F223 VanDerWaalsContact CB-CE1 3.49Å; F119-F223 HydrophobicContact CB-CZ 3.37Å; F119-F223 AromaticContact CD1-CZ 3.82Å; F119-F223 HydrophobicContact CD1-CZ 3.82Å; F119-F223 HydrophobicContact CD2-CE1 4.18Å; F119-F223 HydrophobicContact CD2-CZ 4.17Å; F119-F223 AromaticContact CG-CE1 3.87Å; F119-F223 HydrophobicContact CG-CE1 3.87Å; F119-F223 AromaticContact CG-CZ 3.53Å; F119-F223 HydrophobicContact CG-CZ 3.53Å; F119-A227 HydrophobicContact CD2-CB 4.5Å; F119-A227 HydrophobicContact CE2-CB 4.22Å; F119-A227 HydrophobicContact CZ-CB 4.37Å
120	C	98.7	Very high	98.5	Very high	71 Å²	71	46.7 Å²	46.7	48%	0.48	25%	0.252	S	S	.	.	H	α-helix	trans	-64.2	-43.7	174.5	-71.4	0	0	0	0	112.5	F116 G117 V118	F116-C120 VanDerWaalsContact CE2-SG 3.54Å; F116-C120 VanDerWaalsContact CZ-SG 3.54Å; F116-C120 PolarHBondContact O-N 3.34Å; F116-C120 PolarHBondContact O-SG 3.44Å; G117-C120 PolarHBondContact O-N 3.3Å; V118-C120 VanDerWaalsContact C-N 3.3Å; V118-C120 PolarHBondContact O-N 3.18Å
121	V	98.6	Very high	98.3	Very high	94 Å²	94	49.9 Å²	49.9	57%	0.57	29%	0.286	S	S	*	.	H	α-helix	trans	-65.6	-39.5	-179.7	171.1	0	0	0	0	111.7	F36 G117 V118	F36-V121 HydrophobicContact CE2-CG2 3.97Å; F36-V121 HydrophobicContact CZ-CG2 4.16Å; G117-V121 WeakPolarHBondContact O-CG2 3.23Å; G117-V121 PolarHBondContact O-N 3.37Å; V118-V121 PolarHBondContact O-N 3.4Å
122	Y	98.5	Very high	97.8	Very high	48 Å²	48	51.9 Å²	51.9	19%	0.188	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	12.3	-174.9	-73.8	-86.8	0	0	0	113.9	C40 A43 L47 V118 D124 A125 I126	C40-Y122 HydrophobicContact CB-CE2 4.14Å; A43-Y122 HydrophobicContact CB-CD1 3.98Å; A43-Y122 HydrophobicContact CB-CD2 3.78Å; A43-Y122 HydrophobicContact CB-CE1 4.03Å; A43-Y122 HydrophobicContact CB-CE2 3.84Å; A43-Y122 HydrophobicContact CB-CG 3.85Å; L47-Y122 HydrophobicContact CD1-CD1 3.53Å; L47-Y122 HydrophobicContact CD1-CE1 4.32Å; L47-Y122 HydrophobicContact CD1-CG 4.08Å; V118-Y122 HydrophobicContact CG1-CD2 3.9Å; V118-Y122 HydrophobicContact CG1-CE2 4.47Å; V118-Y122 PolarHBondContact O-N 3.16Å; Y122-D124 PolarHBondContact O-N 3.31Å; Y122-A125 HydrophobicContact CD1-CB 4.4Å; Y122-A125 PolarHBondContact O-N 3.36Å; Y122-A125 VanDerWaalsContact O-N 3.09Å; Y122-I126 WeakPolarHBondContact O-CG1 3.38Å; Y122-I126 PolarHBondContact O-N 3.27Å
123	Y	98.3	Very high	97.6	Very high	104 Å²	104	54.2 Å²	54.2	41%	0.408	32%	0.321	S	S	.	.	H	α-helix	trans	-50.8	-52.5	-170.7	-177.4	-103	0	0	0	113.1	F119 I126 N127	F119-Y123 HydrophobicContact CD1-CD2 4.17Å; F119-Y123 AromaticContact CE1-CD2 3.48Å; F119-Y123 HydrophobicContact CE1-CD2 3.48Å; F119-Y123 VanDerWaalsContact CE1-CD2 3.48Å; F119-Y123 AromaticContact CE1-CE2 3.73Å; F119-Y123 HydrophobicContact CE1-CE2 3.73Å; F119-Y123 HydrophobicContact CE2-CD2 4.27Å; F119-Y123 AromaticContact CZ-CD2 3.54Å; F119-Y123 HydrophobicContact CZ-CD2 3.54Å; F119-Y123 AromaticContact CZ-CE2 3.62Å; F119-Y123 HydrophobicContact CZ-CE2 3.62Å; F119-Y123 WeakPolarHBondContact O-CA 3.43Å; F119-Y123 VanDerWaalsContact O-CB 3.31Å; F119-Y123 WeakPolarHBondContact O-CB 3.27Å; F119-Y123 PolarHBondContact O-N 3.47Å; Y123-I126 PolarHBondContact O-N 3Å; Y123-N127 WeakPolarHBondContact CD1-ND2 3.24Å; Y123-N127 WeakPolarHBondContact CE1-ND2 3.47Å; Y123-N127 PolarHBondContact O-N 2.85Å; Y123-N127 PolarHBondContact O-ND2 3.35Å
124	D	98.1	Very high	97.4	Very high	122 Å²	122	52.7 Å²	52.7	65%	0.652	31%	0.309	S	S	*	.	H	α-helix	trans	-67	-41.5	-178.8	-66.5	-26.7	0	0	0	111.7	Y122 I126 N127 V128	Y122-D124 PolarHBondContact O-N 3.31Å; D124-I126 PolarHBondContact O-N 3.36Å; D124-N127 PolarHBondContact O-N 3.33Å; D124-V128 WeakPolarHBondContact O-CB 3.34Å; D124-V128 VanDerWaalsContact O-CG2 3.28Å; D124-V128 WeakPolarHBondContact O-CG2 3.35Å; D124-V128 PolarHBondContact O-N 2.92Å
125	A	98.1	Very high	97.3	Very high	45 Å²	45	53.8 Å²	53.8	37%	0.372	32%	0.315	S	S	.	.	H	α-helix	trans	-65	-40.8	179.5	0	0	0	0	0	111.9	L47 Y122 F129	L47-A125 HydrophobicContact CD1-CB 3.89Å; Y122-A125 HydrophobicContact CD1-CB 4.4Å; Y122-A125 PolarHBondContact O-N 3.36Å; Y122-A125 VanDerWaalsContact O-N 3.09Å; A125-F129 VanDerWaalsContact O-CB 3.27Å; A125-F129 WeakPolarHBondContact O-CB 3.39Å; A125-F129 PolarHBondContact O-N 3Å
126	I	98.6	Very high	97.3	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-61.7	-51.6	173.4	-69.8	166.3	0	0	0	109.8	L47 F119 Y122 Y123 D124 V128 F129 E130 I145 F146	L47-I126 HydrophobicContact CD1-CG1 4Å; L47-I126 HydrophobicContact CD2-CG1 4.07Å; F119-I126 HydrophobicContact CD2-CD1 4.11Å; Y122-I126 WeakPolarHBondContact O-CG1 3.38Å; Y122-I126 PolarHBondContact O-N 3.27Å; Y123-I126 PolarHBondContact O-N 3Å; D124-I126 PolarHBondContact O-N 3.36Å; I126-V128 VanDerWaalsContact C-N 3.31Å; I126-V128 PolarHBondContact O-N 3.04Å; I126-F129 PolarHBondContact O-N 3.39Å; I126-F129 VanDerWaalsContact O-N 3.15Å; I126-E130 HydrophobicContact CG2-CG 4.24Å; I126-E130 WeakPolarHBondContact CG2-OE2 3.4Å; I126-E130 WeakPolarHBondContact O-CB 3.27Å; I126-E130 WeakPolarHBondContact O-CG 3.47Å; I126-E130 PolarHBondContact O-N 2.83Å; I126-I145 HydrophobicContact CG1-CD1 4.31Å; I126-F146 HydrophobicContact CD1-CE2 4.3Å; I126-F146 HydrophobicContact CD1-CZ 3.89Å
127	N	97.9	Very high	97.1	Very high	32 Å²	32	52.6 Å²	52.6	17%	0.171	32%	0.316	C	S	.	.	H	α-helix	trans	-60.2	-39.7	-178.9	-75.8	-46.5	0	0	0	112.9	Y123 D124 G131 G132 R134	Y123-N127 WeakPolarHBondContact CD1-ND2 3.24Å; Y123-N127 WeakPolarHBondContact CE1-ND2 3.47Å; Y123-N127 PolarHBondContact O-N 2.85Å; Y123-N127 PolarHBondContact O-ND2 3.35Å; D124-N127 PolarHBondContact O-N 3.33Å; N127-G131 WeakPolarHBondContact O-CA 3.33Å; N127-G131 PolarHBondContact O-N 3.06Å; N127-G132 PolarHBondContact O-N 3.46Å; N127-G132 VanDerWaalsContact O-N 3.08Å; N127-R134 PolarHBondContact OD1-NH1 2.7Å; N127-R134 PolarHBondContact OD1-NH2 2.96Å
128	V	97.6	Very high	96.8	Very high	125 Å²	125	54.3 Å²	54.3	76%	0.758	33%	0.334	S	S	*	.	H	α-helix	trans	-66.2	-44.4	176	169.1	0	0	0	0	111	D124 I126 G131	D124-V128 WeakPolarHBondContact O-CB 3.34Å; D124-V128 VanDerWaalsContact O-CG2 3.28Å; D124-V128 WeakPolarHBondContact O-CG2 3.35Å; D124-V128 PolarHBondContact O-N 2.92Å; I126-V128 VanDerWaalsContact C-N 3.31Å; I126-V128 PolarHBondContact O-N 3.04Å; V128-G131 PolarHBondContact O-N 3.44Å
129	F	98	Very high	96.6	Very high	37 Å²	37	60.6 Å²	60.6	16%	0.162	38%	0.375	C	S	.	.	H	α-helix	trans	-64.9	-41.6	-179.8	-174	-88.3	0	0	0	112.4	V46 L47 Q49 A125 I126 T142	V46-F129 HydrophobicContact CG1-CE1 4.4Å; V46-F129 HydrophobicContact CG1-CZ 4.38Å; V46-F129 WeakPolarHBondContact O-CE2 3.42Å; L47-F129 HydrophobicContact CD2-CB 3.7Å; L47-F129 HydrophobicContact CD2-CD1 4.29Å; L47-F129 HydrophobicContact CD2-CD2 4.24Å; L47-F129 HydrophobicContact CD2-CG 3.84Å; Q49-F129 HydrophobicContact CG-CE2 3.67Å; Q49-F129 HydrophobicContact CG-CZ 4.33Å; A125-F129 VanDerWaalsContact O-CB 3.27Å; A125-F129 WeakPolarHBondContact O-CB 3.39Å; A125-F129 PolarHBondContact O-N 3Å; I126-F129 PolarHBondContact O-N 3.39Å; I126-F129 VanDerWaalsContact O-N 3.15Å; F129-T142 HydrophobicContact CD1-CG2 3.34Å; F129-T142 HydrophobicContact CE1-CG2 3.74Å; F129-T142 HydrophobicContact CG-CG2 4.27Å
130	E	96.3	Very high	96.5	Very high	8 Å²	8	62.2 Å²	62.2	4%	0.037	39%	0.387	C	S	.	.	H	α-helix	trans	-83.7	-12.5	-177.9	-64.9	-166.5	132.8	0	0	113.9	I126 G132 N133 T140 T142 Y229	I126-E130 HydrophobicContact CG2-CG 4.24Å; I126-E130 WeakPolarHBondContact CG2-OE2 3.4Å; I126-E130 WeakPolarHBondContact O-CB 3.27Å; I126-E130 WeakPolarHBondContact O-CG 3.47Å; I126-E130 PolarHBondContact O-N 2.83Å; E130-G132 PolarHBondContact O-N 3.34Å; E130-N133 PolarHBondContact O-N 3.07Å; E130-T140 WeakPolarHBondContact CG-O 3.33Å; E130-T142 HydrophobicContact CG-CG2 3.5Å; E130-T142 WeakPolarHBondContact OE1-CB 3.32Å; E130-T142 PolarHBondContact OE1-N 3.17Å; E130-T142 PolarHBondContact OE1-OG1 2.94Å; E130-Y229 WeakPolarHBondContact OE1-CE1 3.39Å
131	G	95.2	Very high	96.4	Very high	69 Å²	69	59.4 Å²	59.4	71%	0.711	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.8	25.7	-170.3	0	0	0	0	0	113	N127 V128	N127-G131 WeakPolarHBondContact O-CA 3.33Å; N127-G131 PolarHBondContact O-N 3.06Å; V128-G131 PolarHBondContact O-N 3.44Å
132	G	89.4	Confident	96.4	Very high	41 Å²	41	55 Å²	55	42%	0.423	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.2	-5.4	-178.6	0	0	0	0	0	115.8	N127 E130 R134	N127-G132 PolarHBondContact O-N 3.46Å; N127-G132 VanDerWaalsContact O-N 3.08Å; E130-G132 PolarHBondContact O-N 3.34Å; G132-R134 PolarHBondContact O-NH1 2.69Å
133	N	93.9	Very high	96.4	Very high	108 Å²	108	52.7 Å²	52.7	58%	0.578	33%	0.333	S	S	*	.			trans	-103	106.2	179.8	-172.2	34.4	0	0	0	111.9	E130 T135	E130-N133 PolarHBondContact O-N 3.07Å; N133-T135 WeakPolarHBondContact ND2-CG2 3.47Å; N133-T135 PolarHBondContact O-N 3.5Å
134	R	95.9	Very high	96.4	Very high	54 Å²	54	50.2 Å²	50.2	20%	0.204	33%	0.331	C	S	.	.			trans	-74.5	114.1	-178.7	-59.7	96.3	171.9	83.7	14.8	110.2	N127 G132 Y229	N127-R134 PolarHBondContact OD1-NH1 2.7Å; N127-R134 PolarHBondContact OD1-NH2 2.96Å; G132-R134 PolarHBondContact O-NH1 2.69Å; R134-Y229 HydrophobicContact CB-CD1 3.73Å; R134-Y229 HydrophobicContact CB-CD2 4.17Å; R134-Y229 HydrophobicContact CB-CE1 3.91Å; R134-Y229 HydrophobicContact CB-CE2 4.36Å; R134-Y229 HydrophobicContact CB-CG 3.88Å; R134-Y229 HydrophobicContact CG-CE2 4.38Å
135	T	97	Very high	96.4	Very high	26 Å²	26	44.4 Å²	44.4	16%	0.16	30%	0.3	C	S	.	.			trans	-129.2	153.8	-179.9	67.1	0	0	0	0	112.7	N133 T137 A141 T142	N133-T135 WeakPolarHBondContact ND2-CG2 3.47Å; N133-T135 PolarHBondContact O-N 3.5Å; T135-T137 PolarHBondContact OG1-O 3Å; T135-T137 VanDerWaalsContact OG1-O 3.05Å; T135-A141 WeakPolarHBondContact O-CB 3.48Å; T135-A141 WeakPolarHBondContact OG1-CA 3.49Å; T135-T142 PolarHBondContact O-N 3.36Å
136	V	96.9	Very high	96.4	Very high	9 Å²	9	42.3 Å²	42.3	6%	0.055	28%	0.282	C	S	.	.	S	Bend	trans	-86.1	-32.1	176.2	176.6	0	0	0	0	111.8	A143 Y149 E232 V233 Y236	V136-A143 HydrophobicContact CB-CB 4.22Å; V136-A143 HydrophobicContact CG1-CB 4.38Å; V136-A143 HydrophobicContact CG2-CB 3.94Å; V136-Y149 HydrophobicContact CG1-CD1 3.8Å; V136-Y149 HydrophobicContact CG1-CE1 3.29Å; V136-Y149 HydrophobicContact CG1-CE2 4.2Å; V136-Y149 HydrophobicContact CG1-CG 4.44Å; V136-E232 HydrophobicContact CB-CB 4.22Å; V136-E232 HydrophobicContact CB-CG 3.86Å; V136-E232 HydrophobicContact CG1-CG 4.34Å; V136-E232 HydrophobicContact CG2-CB 3.79Å; V136-E232 HydrophobicContact CG2-CG 4Å; V136-V233 HydrophobicContact CG2-CB 4.42Å; V136-V233 HydrophobicContact CG2-CG1 3.64Å; V136-Y236 HydrophobicContact CG1-CD2 4.24Å
137	T	95	Very high	96.4	Very high	67 Å²	67	42.3 Å²	42.3	41%	0.411	28%	0.282	S	S	.	.	S	Bend	trans	-127.6	157.7	-177.8	59.2	0	0	0	0	111.5	T135 A141 E232 Y236	T135-T137 PolarHBondContact OG1-O 3Å; T135-T137 VanDerWaalsContact OG1-O 3.05Å; T137-A141 VanDerWaalsContact C-CB 3.47Å; T137-E232 WeakPolarHBondContact CG2-OE1 3.44Å; T137-E232 PolarHBondContact OG1-OE1 3.09Å; T137-E232 VanDerWaalsContact OG1-OE1 3.08Å; T137-Y236 HydrophobicContact CG2-CD2 3.76Å; T137-Y236 HydrophobicContact CG2-CE2 3.42Å; T137-Y236 VanDerWaalsContact CG2-CE2 3.42Å
138	G	94.1	Very high	96.4	Very high	54 Å²	54	41.1 Å²	41.1	56%	0.557	28%	0.277	S	S	*	.	S	Bend	trans	112.2	174.4	-179.9	0	0	0	0	0	113.6	T140 A141	G138-T140 PolarHBondContact O-N 3.22Å; G138-A141 PolarHBondContact O-N 3.29Å
139	P	93.6	Very high	96.4	Very high	132 Å²	132	36.8 Å²	36.8	86%	0.857	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68	-23.1	-172.5	27.3	-35.3	0	0	0	113.6
140	T	96.3	Very high	96.4	Very high	60 Å²	60	35.2 Å²	35.2	37%	0.368	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.5	12.3	-179.9	57.9	0	0	0	0	112.3	E130 G138	E130-T140 WeakPolarHBondContact CG-O 3.33Å; G138-T140 PolarHBondContact O-N 3.22Å
141	A	97.3	Very high	96.3	Very high	13 Å²	13	35.6 Å²	35.6	11%	0.107	25%	0.246	C	C	.	.			trans	-68.8	136	-179.4	0	0	0	0	0	111.8	T135 T137 G138	T135-A141 WeakPolarHBondContact O-CB 3.48Å; T135-A141 WeakPolarHBondContact OG1-CA 3.49Å; T137-A141 VanDerWaalsContact C-CB 3.47Å; G138-A141 PolarHBondContact O-N 3.29Å
142	T	98.5	Very high	96.2	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	25%	0.25	C	S	.	.			trans	-121.3	4	178.3	73.1	0	0	0	0	114.9	V46 L47 F129 E130 T135 S144 I145 Y229	V46-T142 HydrophobicContact CG1-CG2 4.35Å; L47-T142 HydrophobicContact CD2-CG2 4.07Å; F129-T142 HydrophobicContact CD1-CG2 3.34Å; F129-T142 HydrophobicContact CE1-CG2 3.74Å; F129-T142 HydrophobicContact CG-CG2 4.27Å; E130-T142 HydrophobicContact CG-CG2 3.5Å; E130-T142 WeakPolarHBondContact OE1-CB 3.32Å; E130-T142 PolarHBondContact OE1-N 3.17Å; E130-T142 PolarHBondContact OE1-OG1 2.94Å; T135-T142 PolarHBondContact O-N 3.36Å; T142-S144 PolarHBondContact O-N 3.21Å; T142-I145 HydrophobicContact CG2-CD1 4.32Å; T142-I145 VanDerWaalsContact O-CB 3.29Å; T142-I145 WeakPolarHBondContact O-CB 3.46Å; T142-I145 WeakPolarHBondContact O-CG1 3.25Å; T142-I145 PolarHBondContact O-N 2.88Å; T142-Y229 PolarHBondContact OG1-OH 3.29Å
143	A	98.3	Very high	96.5	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-57.3	-26.6	176.7	0	0	0	0	0	113.2	V136 I145 F146 A147 Y149 N224 Y229	V136-A143 HydrophobicContact CB-CB 4.22Å; V136-A143 HydrophobicContact CG1-CB 4.38Å; V136-A143 HydrophobicContact CG2-CB 3.94Å; A143-I145 PolarHBondContact O-N 3Å; A143-F146 PolarHBondContact O-N 2.8Å; A143-A147 PolarHBondContact O-N 3.14Å; A143-Y149 HydrophobicContact CB-CE2 3.87Å; A143-N224 PolarHBondContact O-ND2 3.46Å; A143-Y229 HydrophobicContact CB-CD1 3.65Å; A143-Y229 HydrophobicContact CB-CE1 3.8Å; A143-Y229 HydrophobicContact CB-CG 4.4Å
144	S	97.8	Very high	96.7	Very high	53 Å²	53	37.4 Å²	37.4	37%	0.371	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-70.2	-13.1	177.6	59.4	0	0	0	0	114.5	T142 F146 A147	T142-S144 PolarHBondContact O-N 3.21Å; S144-F146 PolarHBondContact O-N 3.13Å; S144-A147 VanDerWaalsContact CA-O 3.31Å; S144-A147 WeakPolarHBondContact CA-O 3.49Å
145	I	98.6	Very high	96.8	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-59.8	-42.9	168.6	-67.7	176.5	0	0	0	109.5	E39 N42 A43 V46 L47 V118 I126 T142 A143	E39-I145 WeakPolarHBondContact CG-O 3.4Å; N42-I145 HydrophobicContact CB-CG2 4.39Å; N42-I145 WeakPolarHBondContact CB-O 3.45Å; N42-I145 PolarHBondContact ND2-O 3.19Å; A43-I145 HydrophobicContact CB-CD1 4.17Å; A43-I145 HydrophobicContact CB-CG2 3.77Å; V46-I145 HydrophobicContact CB-CD1 4.2Å; V46-I145 HydrophobicContact CB-CG1 3.83Å; V46-I145 HydrophobicContact CG1-CD1 4.14Å; V46-I145 HydrophobicContact CG1-CG1 3.98Å; V46-I145 HydrophobicContact CG2-CG1 3.93Å; L47-I145 HydrophobicContact CD1-CD1 4.23Å; L47-I145 HydrophobicContact CD2-CD1 4.02Å; L47-I145 HydrophobicContact CG-CD1 3.96Å; V118-I145 HydrophobicContact CG1-CG2 4.26Å; I126-I145 HydrophobicContact CG1-CD1 4.31Å; T142-I145 HydrophobicContact CG2-CD1 4.32Å; T142-I145 VanDerWaalsContact O-CB 3.29Å; T142-I145 WeakPolarHBondContact O-CB 3.46Å; T142-I145 WeakPolarHBondContact O-CG1 3.25Å; T142-I145 PolarHBondContact O-N 2.88Å; A143-I145 PolarHBondContact O-N 3Å
146	F	98.8	Very high	96.8	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-57.1	-169.3	-55.1	-84.3	0	0	0	111.8	E39 A115 V118 F119 I126 A143 S144 R216 P220 F223 N224 Y229	E39-F146 WeakPolarHBondContact OE1-CA 3.35Å; E39-F146 VanDerWaalsContact OE2-CD1 3.28Å; E39-F146 WeakPolarHBondContact OE2-CD1 3.48Å; A115-F146 HydrophobicContact CB-CD1 4.01Å; A115-F146 WeakPolarHBondContact O-CE1 3.47Å; V118-F146 HydrophobicContact CB-CE1 4.18Å; V118-F146 HydrophobicContact CG1-CE1 4.21Å; F119-F146 HydrophobicContact CB-CE1 4Å; F119-F146 HydrophobicContact CB-CZ 4.02Å; F119-F146 HydrophobicContact CD2-CZ 4.09Å; I126-F146 HydrophobicContact CD1-CE2 4.3Å; I126-F146 HydrophobicContact CD1-CZ 3.89Å; A143-F146 PolarHBondContact O-N 2.8Å; S144-F146 PolarHBondContact O-N 3.13Å; F146-R216 PolarHBondContact O-NH1 3.25Å; F146-P220 HydrophobicContact CB-CB 3.94Å; F146-F223 HydrophobicContact CD1-CD1 4.09Å; F146-F223 HydrophobicContact CD1-CE1 4.21Å; F146-F223 HydrophobicContact CE1-CD1 4.25Å; F146-F223 AromaticContact CE1-CE1 3.91Å; F146-F223 HydrophobicContact CE1-CE1 3.91Å; F146-F223 HydrophobicContact CZ-CE1 4.34Å; F146-N224 WeakPolarHBondContact CD2-OD1 3.03Å; F146-N224 VanDerWaalsContact CG-OD1 3.3Å; F146-N224 WeakPolarHBondContact CG-OD1 3.42Å; F146-Y229 HydrophobicContact CE2-CE2 4.46Å; F146-Y229 WeakPolarHBondContact CE2-OH 3.18Å
147	A	98.2	Very high	96.9	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	28%	0.277	C	S	.	.	S	Bend	trans	-113.2	156.8	-177.2	0	0	0	0	0	111.9	A143 S144 Y149 R221	A143-A147 PolarHBondContact O-N 3.14Å; S144-A147 VanDerWaalsContact CA-O 3.31Å; S144-A147 WeakPolarHBondContact CA-O 3.49Å; A147-Y149 HydrophobicContact CB-CE2 4.15Å; A147-Y149 WeakPolarHBondContact O-CD2 3.29Å; A147-Y149 WeakPolarHBondContact O-CE2 3.46Å; A147-R221 HydrophobicContact CB-CB 4.49Å; A147-R221 HydrophobicContact CB-CG 3.44Å; A147-R221 VanDerWaalsContact CB-CG 3.44Å
148	T	98.2	Very high	97	Very high	8 Å²	8	46 Å²	46	5%	0.049	28%	0.282	C	S	.	.			trans	-77.4	149.3	179.9	60.7	0	0	0	0	111.6	A208 A211 D217 R221 W241	T148-A208 WeakPolarHBondContact CB-O 3.36Å; T148-A211 HydrophobicContact CG2-CB 3.66Å; T148-A211 WeakPolarHBondContact OG1-CB 3.42Å; T148-D217 WeakPolarHBondContact CB-OD2 3.39Å; T148-D217 PolarHBondContact N-OD2 3.2Å; T148-D217 PolarHBondContact OG1-OD2 3.21Å; T148-R221 PolarHBondContact O-NH2 3.13Å; T148-W241 PolarHBondContact O-NE1 3.5Å; T148-W241 WeakPolarHBondContact OG1-CZ2 3.43Å
149	Y	97.7	Very high	97.2	Very high	33 Å²	33	43.5 Å²	43.5	13%	0.129	26%	0.256	C	S	.	.			trans	-140.9	137.4	170.2	-63.7	-88.8	0	0	0	108.7	V136 A143 A147 Y236	V136-Y149 HydrophobicContact CG1-CD1 3.8Å; V136-Y149 HydrophobicContact CG1-CE1 3.29Å; V136-Y149 HydrophobicContact CG1-CE2 4.2Å; V136-Y149 HydrophobicContact CG1-CG 4.44Å; A143-Y149 HydrophobicContact CB-CE2 3.87Å; A147-Y149 HydrophobicContact CB-CE2 4.15Å; A147-Y149 WeakPolarHBondContact O-CD2 3.29Å; A147-Y149 WeakPolarHBondContact O-CE2 3.46Å; Y149-Y236 AromaticContact CD1-CD1 3.86Å; Y149-Y236 HydrophobicContact CD1-CD1 3.86Å; Y149-Y236 HydrophobicContact CD1-CD2 4.42Å; Y149-Y236 HydrophobicContact CD1-CE1 4.29Å; Y149-Y236 AromaticContact CD1-CG 3.92Å; Y149-Y236 HydrophobicContact CD1-CG 3.92Å; Y149-Y236 HydrophobicContact CE1-CG 4.35Å
150	P	97	Very high	97.5	Very high	5 Å²	5	39.5 Å²	39.5	3%	0.032	23%	0.227	C	C	.	.			trans	-74	143.6	-174.9	30.6	-37	0	0	0	110.3	L154 N207 A208 Y236 W241	P150-L154 HydrophobicContact CB-CB 4.25Å; P150-L154 HydrophobicContact CB-CD2 3.74Å; P150-N207 WeakPolarHBondContact CA-O 3.5Å; P150-A208 HydrophobicContact CB-CB 4.04Å; P150-Y236 HydrophobicContact CG-CE1 3.74Å; P150-Y236 PolarHBondContact O-OH 2.66Å; P150-W241 HydrophobicContact CB-CD2 4.49Å; P150-W241 HydrophobicContact CB-CE3 4.18Å; P150-W241 HydrophobicContact CB-CZ3 4.23Å; P150-W241 VanDerWaalsContact CD-CE2 3.43Å; P150-W241 HydrophobicContact CG-CD2 3.78Å; P150-W241 HydrophobicContact CG-CE3 3.77Å; P150-W241 HydrophobicContact CG-CG 4.08Å; P150-W241 HydrophobicContact CG-CZ3 4.33Å
151	G	93.9	Very high	97.6	Very high	16 Å²	16	40 Å²	40	17%	0.165	23%	0.23	C	C	.	.			trans	-55.5	152	175.6	0	0	0	0	0	112	F153 L154 N207 R237	G151-F153 PolarHBondContact O-N 3.37Å; G151-L154 PolarHBondContact O-N 3.29Å; G151-N207 PolarHBondContact N-O 2.9Å; G151-R237 PolarHBondContact O-NH2 2.61Å
152	P	94.1	Very high	97.6	Very high	122 Å²	122	40 Å²	40	79%	0.792	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56	-28.2	-173.1	21.6	-32.8	0	0	0	113.6	R237	P152-R237 PolarHBondContact O-NH2 2.86Å
153	F	96.1	Very high	97.6	Very high	124 Å²	124	40 Å²	40	54%	0.544	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-18.3	-179.9	55.2	-96.8	0	0	0	114.8	G151 G155 L206	G151-F153 PolarHBondContact O-N 3.37Å; F153-G155 PolarHBondContact O-N 2.98Å; F153-L206 HydrophobicContact CZ-CD1 4.35Å; F153-L206 HydrophobicContact CZ-CG 4.11Å
154	L	97.3	Very high	97.7	Very high	9 Å²	9	41.9 Å²	41.9	5%	0.047	24%	0.237	C	C	.	.			trans	-82	114.8	-168.8	-172.4	69.6	0	0	0	111.8	P150 G151 N158 A159 N207 A208 R237	P150-L154 HydrophobicContact CB-CB 4.25Å; P150-L154 HydrophobicContact CB-CD2 3.74Å; G151-L154 PolarHBondContact O-N 3.29Å; L154-N158 HydrophobicContact CD1-CB 3.69Å; L154-A159 HydrophobicContact CD2-CB 3.75Å; L154-A159 HydrophobicContact CG-CB 4.12Å; L154-N207 HydrophobicContact CD1-CB 4.06Å; L154-N207 HydrophobicContact CD2-CB 3.86Å; L154-A208 HydrophobicContact CD2-CB 3.9Å; L154-R237 PolarHBondContact O-NH1 2.76Å
155	G	97.7	Very high	97.7	Very high	41 Å²	41	41.3 Å²	41.3	42%	0.423	24%	0.236	S	C	.	.			trans	-72.4	158.7	172.5	0	0	0	0	0	113.3	F153 F157 N158 A159	F153-G155 PolarHBondContact O-N 2.98Å; G155-F157 VanDerWaalsContact C-N 3.32Å; G155-F157 PolarHBondContact O-N 3.29Å; G155-N158 PolarHBondContact O-N 2.99Å; G155-A159 WeakPolarHBondContact O-CB 3.42Å; G155-A159 PolarHBondContact O-N 3.17Å
156	T	97.8	Very high	97.7	Very high	49 Å²	49	41.4 Å²	41.4	30%	0.301	24%	0.237	S	C	.	.	H	α-helix	trans	-57.5	-40.2	-178.3	-55	0	0	0	0	113.3	A159 I160 K240 I244	T156-A159 WeakPolarHBondContact O-CB 3.33Å; T156-A159 PolarHBondContact O-N 2.9Å; T156-I160 WeakPolarHBondContact O-CG1 3.35Å; T156-I160 PolarHBondContact O-N 3.46Å; T156-I160 VanDerWaalsContact O-N 3.11Å; T156-K240 HydrophobicContact CG2-CB 4.38Å; T156-I244 HydrophobicContact CG2-CD1 4.05Å
157	F	98.3	Very high	97.7	Very high	152 Å²	152	41.4 Å²	41.4	67%	0.667	24%	0.237	S	C	*	.	H	α-helix	trans	-63.3	-48.7	178.2	178.8	-100.3	0	0	0	111.9	G155 A159 I160 V161	G155-F157 VanDerWaalsContact C-N 3.32Å; G155-F157 PolarHBondContact O-N 3.29Å; F157-A159 VanDerWaalsContact C-N 3.28Å; F157-A159 PolarHBondContact O-N 3.21Å; F157-I160 WeakPolarHBondContact O-CB 3.41Å; F157-I160 PolarHBondContact O-N 3.04Å; F157-I160 VanDerWaalsContact O-N 3.12Å; F157-V161 HydrophobicContact CD1-CG2 4.38Å; F157-V161 HydrophobicContact CE1-CG2 3.95Å; F157-V161 HydrophobicContact CZ-CG2 4.07Å; F157-V161 PolarHBondContact O-N 3.02Å; F157-V161 VanDerWaalsContact O-N 3.1Å
158	N	98.3	Very high	97.7	Very high	95 Å²	95	43.2 Å²	43.2	51%	0.508	25%	0.247	S	C	.	.	H	α-helix	trans	-67.6	-29.6	178.1	-76.4	-3.1	0	0	0	112.2	L154 G155 I160 V161 D162	L154-N158 HydrophobicContact CD1-CB 3.69Å; G155-N158 PolarHBondContact O-N 2.99Å; N158-I160 VanDerWaalsContact C-N 3.33Å; N158-V161 PolarHBondContact O-N 3.15Å; N158-D162 WeakPolarHBondContact O-CB 3.27Å; N158-D162 PolarHBondContact O-N 2.85Å
159	A	98.2	Very high	97.7	Very high	2 Å²	2	45.5 Å²	45.5	2%	0.017	26%	0.26	C	S	.	.	H	α-helix	trans	-62.1	-38.1	171	0	0	0	0	0	113	L154 G155 T156 F157 Q163 W241 I244	L154-A159 HydrophobicContact CD2-CB 3.75Å; L154-A159 HydrophobicContact CG-CB 4.12Å; G155-A159 WeakPolarHBondContact O-CB 3.42Å; G155-A159 PolarHBondContact O-N 3.17Å; T156-A159 WeakPolarHBondContact O-CB 3.33Å; T156-A159 PolarHBondContact O-N 2.9Å; F157-A159 VanDerWaalsContact C-N 3.28Å; F157-A159 PolarHBondContact O-N 3.21Å; A159-Q163 WeakPolarHBondContact O-CG 3.45Å; A159-Q163 PolarHBondContact O-N 2.93Å; A159-Q163 VanDerWaalsContact O-N 3.15Å; A159-W241 HydrophobicContact CB-CE3 4.33Å; A159-W241 HydrophobicContact CB-CZ3 3.92Å; A159-I244 HydrophobicContact CB-CD1 3.94Å
160	I	98.7	Very high	97.8	Very high	47 Å²	47	44.3 Å²	44.3	24%	0.241	26%	0.256	C	S	.	.	H	α-helix	trans	-64.8	-50.2	173.5	-68.1	163.5	0	0	0	110.2	T156 F157 N158 D162 Q163 I164 W243 I244	T156-I160 WeakPolarHBondContact O-CG1 3.35Å; T156-I160 PolarHBondContact O-N 3.46Å; T156-I160 VanDerWaalsContact O-N 3.11Å; F157-I160 WeakPolarHBondContact O-CB 3.41Å; F157-I160 PolarHBondContact O-N 3.04Å; F157-I160 VanDerWaalsContact O-N 3.12Å; N158-I160 VanDerWaalsContact C-N 3.33Å; I160-D162 VanDerWaalsContact C-N 3.32Å; I160-D162 PolarHBondContact O-N 3.43Å; I160-Q163 PolarHBondContact O-N 2.96Å; I160-I164 HydrophobicContact CG2-CD1 3.78Å; I160-I164 WeakPolarHBondContact O-CG1 3.3Å; I160-I164 PolarHBondContact O-N 3.38Å; I160-W243 HydrophobicContact CD1-CH2 3.8Å; I160-W243 HydrophobicContact CG1-CH2 4.01Å; I160-W243 HydrophobicContact CG1-CZ3 4.5Å; I160-I244 HydrophobicContact CG1-CD1 3.99Å; I160-I244 HydrophobicContact CG1-CG1 4.2Å
161	V	98.5	Very high	97.9	Very high	72 Å²	72	44.1 Å²	44.1	44%	0.436	26%	0.255	S	S	.	.	H	α-helix	trans	-58.6	-45.6	179.2	175.4	0	0	0	0	110.8	F157 N158 I164 A165	F157-V161 HydrophobicContact CD1-CG2 4.38Å; F157-V161 HydrophobicContact CE1-CG2 3.95Å; F157-V161 HydrophobicContact CZ-CG2 4.07Å; F157-V161 PolarHBondContact O-N 3.02Å; F157-V161 VanDerWaalsContact O-N 3.1Å; N158-V161 PolarHBondContact O-N 3.15Å; V161-I164 PolarHBondContact O-N 3.47Å; V161-A165 VanDerWaalsContact O-CB 3.22Å; V161-A165 WeakPolarHBondContact O-CB 3.28Å; V161-A165 PolarHBondContact O-N 2.82Å
162	D	98.4	Very high	98.1	Very high	12 Å²	12	46.5 Å²	46.5	6%	0.064	26%	0.263	C	S	.	.	H	α-helix	trans	-56.7	-51.3	178.7	178.8	83.9	0	0	0	112.3	N158 I160 A165 G166 N207	N158-D162 WeakPolarHBondContact O-CB 3.27Å; N158-D162 PolarHBondContact O-N 2.85Å; I160-D162 VanDerWaalsContact C-N 3.32Å; I160-D162 PolarHBondContact O-N 3.43Å; D162-A165 PolarHBondContact O-N 3.43Å; D162-G166 PolarHBondContact O-N 3.46Å; D162-N207 VanDerWaalsContact OD1-CB 3.24Å; D162-N207 WeakPolarHBondContact OD1-CB 3.47Å; D162-N207 PolarHBondContact OD1-ND2 3.09Å
163	Q	98.6	Very high	98.3	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-72.2	-31.7	-177.8	-68	-57.5	-61.6	0	0	113.2	A159 I160 T167 A211 I212 W241 I244 C248	A159-Q163 WeakPolarHBondContact O-CG 3.45Å; A159-Q163 PolarHBondContact O-N 2.93Å; A159-Q163 VanDerWaalsContact O-N 3.15Å; I160-Q163 PolarHBondContact O-N 2.96Å; Q163-T167 WeakPolarHBondContact O-CB 3.39Å; Q163-T167 PolarHBondContact O-N 3.28Å; Q163-T167 PolarHBondContact O-OG1 2.7Å; Q163-A211 VanDerWaalsContact OE1-CB 3.3Å; Q163-I212 VanDerWaalsContact OE1-N 3.16Å; Q163-W241 HydrophobicContact CG-CH2 4.16Å; Q163-W241 HydrophobicContact CG-CZ3 4.49Å; Q163-I244 HydrophobicContact CB-CG2 4.05Å; Q163-I244 HydrophobicContact CG-CG2 3.8Å; Q163-C248 HydrophobicContact CB-CB 3.72Å
164	I	98.8	Very high	98.5	Very high	38 Å²	38	35.9 Å²	35.9	20%	0.195	21%	0.209	C	C	.	.	H	α-helix	trans	-65.6	-50.8	170.3	-68.7	173.9	0	0	0	109.8	I160 V161 T167 L168 C248 I251 G252 L255	I160-I164 HydrophobicContact CG2-CD1 3.78Å; I160-I164 WeakPolarHBondContact O-CG1 3.3Å; I160-I164 PolarHBondContact O-N 3.38Å; V161-I164 PolarHBondContact O-N 3.47Å; I164-T167 PolarHBondContact O-N 2.99Å; I164-L168 WeakPolarHBondContact O-CB 3.37Å; I164-L168 PolarHBondContact O-N 3.46Å; I164-C248 HydrophobicContact CG1-CB 3.87Å; I164-I251 HydrophobicContact CD1-CG2 4.22Å; I164-I251 HydrophobicContact CG1-CB 4.45Å; I164-I251 HydrophobicContact CG1-CG2 4.43Å; I164-G252 WeakPolarHBondContact O-CA 3.45Å; I164-L255 HydrophobicContact CG2-CD1 4.14Å
165	A	98.6	Very high	98.5	Very high	41 Å²	41	35.5 Å²	35.5	34%	0.339	21%	0.207	S	C	.	.	H	α-helix	trans	-63.6	-46.1	-175.6	0	0	0	0	0	112.3	V161 D162 T167 L168 V169	V161-A165 VanDerWaalsContact O-CB 3.22Å; V161-A165 WeakPolarHBondContact O-CB 3.28Å; V161-A165 PolarHBondContact O-N 2.82Å; D162-A165 PolarHBondContact O-N 3.43Å; A165-T167 VanDerWaalsContact C-N 3.34Å; A165-T167 PolarHBondContact O-N 3.5Å; A165-L168 WeakPolarHBondContact O-CB 3.37Å; A165-L168 PolarHBondContact O-N 2.92Å; A165-V169 WeakPolarHBondContact O-CG2 3.17Å; A165-V169 PolarHBondContact O-N 3.47Å
166	G	98.6	Very high	98.5	Very high	2 Å²	2	34.7 Å²	34.7	2%	0.021	20%	0.196	C	C	.	.	H	α-helix	trans	-61.5	-42.1	177.8	0	0	0	0	0	112.6	D162 V169 L170	D162-G166 PolarHBondContact O-N 3.46Å; G166-V169 PolarHBondContact O-N 3.38Å; G166-L170 PolarHBondContact O-N 2.99Å
167	T	98.8	Very high	98.6	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-75.9	-29.2	179.9	-42.4	0	0	0	0	112.6	A84 Q163 I164 A165 L170 C171 I212 P249	A84-T167 HydrophobicContact CB-CG2 3.99Å; Q163-T167 WeakPolarHBondContact O-CB 3.39Å; Q163-T167 PolarHBondContact O-N 3.28Å; Q163-T167 PolarHBondContact O-OG1 2.7Å; I164-T167 PolarHBondContact O-N 2.99Å; A165-T167 VanDerWaalsContact C-N 3.34Å; A165-T167 PolarHBondContact O-N 3.5Å; T167-L170 PolarHBondContact O-N 3.43Å; T167-C171 WeakPolarHBondContact O-CB 3.49Å; T167-C171 PolarHBondContact O-N 2.69Å; T167-C171 PolarHBondContact O-SG 3.08Å; T167-C171 VanDerWaalsContact O-SG 3.38Å; T167-I212 WeakPolarHBondContact OG1-CA 3.38Å; T167-I212 WeakPolarHBondContact OG1-CB 3.48Å; T167-P249 HydrophobicContact CG2-CB 3.85Å; T167-P249 WeakPolarHBondContact CG2-O 3.46Å; T167-P249 VanDerWaalsContact OG1-CA 3.29Å; T167-P249 WeakPolarHBondContact OG1-CA 3.22Å; T167-P249 WeakPolarHBondContact OG1-CB 3.37Å
168	L	98.8	Very high	98.5	Very high	39 Å²	39	28 Å²	28	20%	0.204	17%	0.167	C	C	.	.	H	α-helix	trans	-59.5	-52.7	170.2	-179.4	164.8	0	0	0	110.3	I164 A165 L170 C171 L172 G252 L255 G256 L259	I164-L168 WeakPolarHBondContact O-CB 3.37Å; I164-L168 PolarHBondContact O-N 3.46Å; A165-L168 WeakPolarHBondContact O-CB 3.37Å; A165-L168 PolarHBondContact O-N 2.92Å; L168-L170 VanDerWaalsContact C-N 3.31Å; L168-L170 PolarHBondContact O-N 3.04Å; L168-C171 PolarHBondContact O-N 2.87Å; L168-L172 HydrophobicContact CD2-CD1 4.38Å; L168-L172 WeakPolarHBondContact O-CB 3.45Å; L168-L172 PolarHBondContact O-N 2.59Å; L168-G252 WeakPolarHBondContact CA-O 3.37Å; L168-L255 HydrophobicContact CD1-CB 4.13Å; L168-L255 HydrophobicContact CG-CB 4.48Å; L168-G256 WeakPolarHBondContact O-CA 3.36Å; L168-L259 HydrophobicContact CD1-CD1 3.99Å; L168-L259 HydrophobicContact CD2-CD1 4.44Å; L168-L259 HydrophobicContact CG-CD1 4.4Å
169	V	98.6	Very high	98.4	Very high	55 Å²	55	24.4 Å²	24.4	33%	0.333	15%	0.148	S	C	.	.	H	α-helix	trans	-62.6	-40.9	178.7	177	0	0	0	0	110.9	A165 G166 G173 F199 L200	A165-V169 WeakPolarHBondContact O-CG2 3.17Å; A165-V169 PolarHBondContact O-N 3.47Å; G166-V169 PolarHBondContact O-N 3.38Å; V169-G173 PolarHBondContact O-N 2.91Å; V169-F199 HydrophobicContact CG1-CE1 4.38Å; V169-L200 HydrophobicContact CB-CD2 3.92Å; V169-L200 HydrophobicContact CG1-CD2 3.77Å
170	L	98.8	Very high	98.1	Very high	9 Å²	9	35.1 Å²	35.1	5%	0.047	19%	0.188	C	C	.	.	H	α-helix	trans	-56.6	-54.8	174.3	178.8	67.1	0	0	0	111.7	G166 T167 L168 G173 V174 L196 L200 I212	G166-L170 PolarHBondContact O-N 2.99Å; T167-L170 PolarHBondContact O-N 3.43Å; L168-L170 VanDerWaalsContact C-N 3.31Å; L168-L170 PolarHBondContact O-N 3.04Å; L170-G173 PolarHBondContact O-N 3.45Å; L170-V174 HydrophobicContact CD1-CG2 4.29Å; L170-V174 HydrophobicContact CG-CG2 4.49Å; L170-V174 VanDerWaalsContact O-CG2 3.3Å; L170-V174 WeakPolarHBondContact O-CG2 3.48Å; L170-V174 PolarHBondContact O-N 3.24Å; L170-L196 HydrophobicContact CD1-CD2 4.11Å; L170-L196 HydrophobicContact CD1-CG 4.34Å; L170-L196 WeakPolarHBondContact O-CD2 3.08Å; L170-L200 HydrophobicContact CB-CD1 3.67Å; L170-L200 HydrophobicContact CD1-CD1 3.77Å; L170-L200 HydrophobicContact CG-CD1 4.3Å; L170-I212 HydrophobicContact CB-CD1 4.45Å; L170-I212 HydrophobicContact CD2-CB 4.39Å; L170-I212 HydrophobicContact CD2-CD1 3.88Å; L170-I212 HydrophobicContact CD2-CG1 3.98Å
171	C	98.8	Very high	97.8	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-77	-27.5	-172	-63.8	0	0	0	0	112.7	F88 T167 L168 A175 G253	F88-C171 HydrophobicContact CD1-CB 3.71Å; F88-C171 HydrophobicContact CE1-CB 3.78Å; T167-C171 WeakPolarHBondContact O-CB 3.49Å; T167-C171 PolarHBondContact O-N 2.69Å; T167-C171 PolarHBondContact O-SG 3.08Å; T167-C171 VanDerWaalsContact O-SG 3.38Å; L168-C171 PolarHBondContact O-N 2.87Å; C171-A175 VanDerWaalsContact O-CB 3.25Å; C171-A175 WeakPolarHBondContact O-CB 3.07Å; C171-A175 PolarHBondContact O-N 3.28Å; C171-G253 VanDerWaalsContact CB-O 3.3Å; C171-G253 WeakPolarHBondContact CB-O 3.45Å; C171-G253 WeakPolarHBondContact SG-CA 3.28Å
172	L	98.8	Very high	97.5	Very high	66 Å²	66	36.5 Å²	36.5	35%	0.346	19%	0.187	S	C	.	.	H	α-helix	trans	-60.3	-50.7	166.8	-176.2	159.3	0	0	0	110.3	L168 A175 A176 G256	L168-L172 HydrophobicContact CD2-CD1 4.38Å; L168-L172 WeakPolarHBondContact O-CB 3.45Å; L168-L172 PolarHBondContact O-N 2.59Å; L172-A175 PolarHBondContact O-N 3.49Å; L172-A176 PolarHBondContact O-N 2.97Å; L172-G256 WeakPolarHBondContact CA-O 3.38Å; L172-G256 WeakPolarHBondContact CB-O 3.49Å
173	G	98.7	Very high	97.3	Very high	11 Å²	11	38.7 Å²	38.7	11%	0.113	21%	0.212	C	C	.	.	H	α-helix	trans	-63.7	-42.4	178.7	0	0	0	0	0	112.6	V169 L170 A176 I177	V169-G173 PolarHBondContact O-N 2.91Å; L170-G173 PolarHBondContact O-N 3.45Å; G173-A176 PolarHBondContact O-N 3.4Å; G173-I177 WeakPolarHBondContact O-CB 3.24Å; G173-I177 WeakPolarHBondContact O-CD1 3.37Å; G173-I177 WeakPolarHBondContact O-CG1 3.28Å; G173-I177 PolarHBondContact O-N 3.23Å
174	V	98.6	Very high	97.1	Very high	13 Å²	13	40.8 Å²	40.8	8%	0.079	22%	0.223	C	C	.	.	H	α-helix	trans	-62	-43.8	174.9	171.2	0	0	0	0	111.2	F88 L170 I177 T178 L196	F88-V174 HydrophobicContact CE1-CG1 4.45Å; F88-V174 HydrophobicContact CZ-CG1 4.03Å; L170-V174 HydrophobicContact CD1-CG2 4.29Å; L170-V174 HydrophobicContact CG-CG2 4.49Å; L170-V174 VanDerWaalsContact O-CG2 3.3Å; L170-V174 WeakPolarHBondContact O-CG2 3.48Å; L170-V174 PolarHBondContact O-N 3.24Å; V174-I177 PolarHBondContact O-N 2.97Å; V174-T178 HydrophobicContact CG1-CG2 4.29Å; V174-T178 WeakPolarHBondContact O-CB 3.17Å; V174-T178 WeakPolarHBondContact O-CG2 3.3Å; V174-T178 PolarHBondContact O-N 3.34Å; V174-T178 PolarHBondContact O-OG1 2.79Å; V174-L196 HydrophobicContact CG2-CD2 4.22Å
175	A	98.4	Very high	96.9	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.008	23%	0.232	C	C	.	.	H	α-helix	trans	-59.6	-47.7	176.3	0	0	0	0	0	110.9	C171 L172 I177 T178 D179 A257 Y260	C171-A175 VanDerWaalsContact O-CB 3.25Å; C171-A175 WeakPolarHBondContact O-CB 3.07Å; C171-A175 PolarHBondContact O-N 3.28Å; L172-A175 PolarHBondContact O-N 3.49Å; A175-I177 PolarHBondContact O-N 2.93Å; A175-T178 PolarHBondContact O-N 3.39Å; A175-T178 PolarHBondContact O-OG1 3.42Å; A175-D179 WeakPolarHBondContact O-CB 3.48Å; A175-D179 PolarHBondContact O-N 3.35Å; A175-A257 HydrophobicContact CB-CB 4.32Å; A175-Y260 HydrophobicContact CB-CD1 3.59Å; A175-Y260 HydrophobicContact CB-CE1 4.31Å; A175-Y260 HydrophobicContact CB-CG 3.87Å
176	A	98.3	Very high	96.7	Very high	24 Å²	24	43.3 Å²	43.3	20%	0.198	24%	0.244	C	C	.	.	H	α-helix	trans	-60.9	-46.2	176.2	0	0	0	0	0	113	L172 G173 T178 D179 N182 Y260	L172-A176 PolarHBondContact O-N 2.97Å; G173-A176 PolarHBondContact O-N 3.4Å; A176-T178 VanDerWaalsContact C-N 3.31Å; A176-T178 PolarHBondContact O-N 3.46Å; A176-D179 PolarHBondContact O-N 2.97Å; A176-N182 PolarHBondContact O-ND2 3.17Å; A176-Y260 VanDerWaalsContact CA-CE2 3.47Å; A176-Y260 HydrophobicContact CB-CD2 3.74Å; A176-Y260 HydrophobicContact CB-CE2 3.49Å; A176-Y260 VanDerWaalsContact CB-CE2 3.49Å
177	I	98.4	Very high	96.5	Very high	18 Å²	18	50.7 Å²	50.7	9%	0.092	28%	0.276	C	S	.	.	H	α-helix	trans	-66	-35.9	-177.2	-68.6	160.3	0	0	0	111.8	G173 V174 A175 I184 Q189 W192 I193 L196	G173-I177 WeakPolarHBondContact O-CB 3.24Å; G173-I177 WeakPolarHBondContact O-CD1 3.37Å; G173-I177 WeakPolarHBondContact O-CG1 3.28Å; G173-I177 PolarHBondContact O-N 3.23Å; V174-I177 PolarHBondContact O-N 2.97Å; A175-I177 PolarHBondContact O-N 2.93Å; I177-I184 HydrophobicContact CB-CD1 4.43Å; I177-I184 HydrophobicContact CG1-CD1 4.45Å; I177-I184 HydrophobicContact CG2-CD1 4.49Å; I177-Q189 HydrophobicContact CG2-CB 3.93Å; I177-Q189 HydrophobicContact CG2-CG 3.99Å; I177-Q189 PolarHBondContact O-NE2 2.8Å; I177-W192 HydrophobicContact CD1-CB 3.81Å; I177-W192 HydrophobicContact CG1-CB 4.05Å; I177-W192 HydrophobicContact CG2-CB 4.05Å; I177-I193 HydrophobicContact CD1-CG1 4.14Å; I177-I193 HydrophobicContact CG2-CD1 4.37Å; I177-I193 HydrophobicContact CG2-CG1 4Å; I177-L196 HydrophobicContact CD1-CB 4.49Å; I177-L196 HydrophobicContact CD1-CD2 4.17Å
178	T	96.5	Very high	96.4	Very high	43 Å²	43	53.9 Å²	53.9	26%	0.264	29%	0.293	S	S	.	.	H	α-helix	trans	-91.5	-11	-175.5	59.8	0	0	0	0	113.5	V174 A175 A176 R180 I193	V174-T178 HydrophobicContact CG1-CG2 4.29Å; V174-T178 WeakPolarHBondContact O-CB 3.17Å; V174-T178 WeakPolarHBondContact O-CG2 3.3Å; V174-T178 PolarHBondContact O-N 3.34Å; V174-T178 PolarHBondContact O-OG1 2.79Å; A175-T178 PolarHBondContact O-N 3.39Å; A175-T178 PolarHBondContact O-OG1 3.42Å; A176-T178 VanDerWaalsContact C-N 3.31Å; A176-T178 PolarHBondContact O-N 3.46Å; T178-R180 PolarHBondContact O-N 3.3Å; T178-I193 HydrophobicContact CG2-CD1 4.36Å
179	D	95.6	Very high	96.4	Very high	18 Å²	18	53.9 Å²	53.9	10%	0.096	29%	0.292	C	S	.	.			trans	-68	117.2	172.6	-168.6	-15.2	0	0	0	110.6	A175 A176 R181 N182 Y260	A175-D179 WeakPolarHBondContact O-CB 3.48Å; A175-D179 PolarHBondContact O-N 3.35Å; A176-D179 PolarHBondContact O-N 2.97Å; D179-R181 VanDerWaalsContact CG-NE 3.34Å; D179-R181 PolarHBondContact O-N 3.15Å; D179-R181 WeakPolarHBondContact OD1-CB 3.43Å; D179-R181 WeakPolarHBondContact OD1-CG 3.45Å; D179-R181 IonicContact OD1-CZ 3.14Å; D179-R181 PolarHBondContact OD1-N 3.45Å; D179-R181 IonicContact OD1-NE 3.71Å; D179-R181 PolarHBondContact OD1-NE 3.26Å; D179-R181 IonicContact OD1-NH2 3.72Å; D179-R181 IonicContact OD2-CZ 2.77Å; D179-R181 VanDerWaalsContact OD2-CZ 3.25Å; D179-R181 IonicContact OD2-NE 2.69Å; D179-R181 PolarHBondContact OD2-NE 3.45Å; D179-R181 IonicContact OD2-NH2 3.25Å; D179-R181 PolarHBondContact OD2-NH2 3.09Å; D179-N182 PolarHBondContact O-N 3.32Å; D179-N182 VanDerWaalsContact O-N 3.17Å; D179-Y260 HydrophobicContact CB-CE1 4.11Å; D179-Y260 VanDerWaalsContact CB-OH 3.29Å; D179-Y260 WeakPolarHBondContact CB-OH 3.26Å; D179-Y260 VanDerWaalsContact CG-OH 3.28Å; D179-Y260 WeakPolarHBondContact OD2-CE1 3.16Å; D179-Y260 PolarHBondContact OD2-OH 3.07Å
180	R	92.7	Very high	96.4	Very high	227 Å²	227	51.7 Å²	51.7	86%	0.857	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-62.1	-28.6	-179.1	-65.6	-179.7	179.6	164.7	0.1	112	T178 N182 G183	T178-R180 PolarHBondContact O-N 3.3Å; R180-N182 PolarHBondContact O-N 3.2Å; R180-G183 PolarHBondContact O-N 3.1Å
181	R	92.6	Very high	96.3	Very high	86 Å²	86	53.3 Å²	53.3	33%	0.325	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-67.2	-21.3	-179.1	-58	169.5	-69.4	-174.7	2.8	112.4	D179 G183 E261 G265 I268 D270	D179-R181 VanDerWaalsContact CG-NE 3.34Å; D179-R181 PolarHBondContact O-N 3.15Å; D179-R181 WeakPolarHBondContact OD1-CB 3.43Å; D179-R181 WeakPolarHBondContact OD1-CG 3.45Å; D179-R181 IonicContact OD1-CZ 3.14Å; D179-R181 PolarHBondContact OD1-N 3.45Å; D179-R181 IonicContact OD1-NE 3.71Å; D179-R181 PolarHBondContact OD1-NE 3.26Å; D179-R181 IonicContact OD1-NH2 3.72Å; D179-R181 IonicContact OD2-CZ 2.77Å; D179-R181 VanDerWaalsContact OD2-CZ 3.25Å; D179-R181 IonicContact OD2-NE 2.69Å; D179-R181 PolarHBondContact OD2-NE 3.45Å; D179-R181 IonicContact OD2-NH2 3.25Å; D179-R181 PolarHBondContact OD2-NH2 3.09Å; R181-G183 PolarHBondContact O-N 2.92Å; R181-E261 IonicContact NH2-OE2 2.76Å; R181-E261 PolarHBondContact NH2-OE2 3.37Å; R181-E261 VanDerWaalsContact NH2-OE2 3.14Å; R181-G265 VanDerWaalsContact CZ-O 3.24Å; R181-G265 PolarHBondContact NH1-O 3.27Å; R181-G265 PolarHBondContact NH2-O 3.25Å; R181-I268 HydrophobicContact CB-CB 4.12Å; R181-I268 HydrophobicContact CB-CD1 3.99Å; R181-I268 HydrophobicContact CB-CG2 3.64Å; R181-D270 WeakPolarHBondContact CD-OD1 3.38Å
182	N	92.9	Very high	96.3	Very high	63 Å²	63	60.2 Å²	60.2	34%	0.337	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-78.8	-3.6	172.2	-73	-39.6	0	0	0	113.7	A176 D179 R180 I184 Y260 I268	A176-N182 PolarHBondContact O-ND2 3.17Å; D179-N182 PolarHBondContact O-N 3.32Å; D179-N182 VanDerWaalsContact O-N 3.17Å; R180-N182 PolarHBondContact O-N 3.2Å; N182-I184 HydrophobicContact CB-CD1 4.47Å; N182-I184 PolarHBondContact O-N 2.97Å; N182-I184 VanDerWaalsContact O-N 3.1Å; N182-Y260 PolarHBondContact ND2-OH 3.03Å; N182-I268 VanDerWaalsContact OD1-CD1 3.27Å; N182-I268 WeakPolarHBondContact OD1-CD1 3.47Å
183	G	92.8	Very high	96.3	Very high	58 Å²	58	57.9 Å²	57.9	60%	0.598	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	67	13.8	173.1	0	0	0	0	0	115.4	R180 R181 P185	R180-G183 PolarHBondContact O-N 3.1Å; R181-G183 PolarHBondContact O-N 2.92Å; G183-P185 VanDerWaalsContact O-CD 3.25Å; G183-P185 WeakPolarHBondContact O-CD 3.49Å
184	I	94.9	Very high	96.3	Very high	45 Å²	45	57.5 Å²	57.5	23%	0.231	30%	0.303	C	S	.	.			trans	-70.1	118.7	177	-64.5	165.3	0	0	0	108.8	I177 N182 A186 L188 Q189	I177-I184 HydrophobicContact CB-CD1 4.43Å; I177-I184 HydrophobicContact CG1-CD1 4.45Å; I177-I184 HydrophobicContact CG2-CD1 4.49Å; N182-I184 HydrophobicContact CB-CD1 4.47Å; N182-I184 PolarHBondContact O-N 2.97Å; N182-I184 VanDerWaalsContact O-N 3.1Å; I184-A186 PolarHBondContact O-N 3.07Å; I184-L188 HydrophobicContact CG2-CB 4.43Å; I184-Q189 HydrophobicContact CG2-CG 3.85Å
185	P	95.5	Very high	96.3	Very high	58 Å²	58	59.1 Å²	59.1	38%	0.377	32%	0.318	S	S	.	.			trans	-56.8	133.2	178.8	-25.3	34.4	0	0	0	111.5	G183 F187 L188 Q189	G183-P185 VanDerWaalsContact O-CD 3.25Å; G183-P185 WeakPolarHBondContact O-CD 3.49Å; P185-F187 HydrophobicContact CB-CD1 3.69Å; P185-F187 HydrophobicContact CB-CE1 3.37Å; P185-F187 HydrophobicContact CB-CZ 4.09Å; P185-F187 HydrophobicContact CG-CE1 4.24Å; P185-F187 PolarHBondContact O-N 3.18Å; P185-L188 HydrophobicContact CB-CD1 4.43Å; P185-L188 HydrophobicContact CB-CG 4.45Å; P185-L188 HydrophobicContact CG-CD1 4.15Å; P185-L188 WeakPolarHBondContact O-CB 3.3Å; P185-L188 PolarHBondContact O-N 3.24Å; P185-Q189 PolarHBondContact O-N 2.86Å
186	A	93	Very high	96.4	Very high	73 Å²	73	60.2 Å²	60.2	60%	0.603	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-30.6	-173.8	0	0	0	0	0	113.9	I184 L188	I184-A186 PolarHBondContact O-N 3.07Å; A186-L188 VanDerWaalsContact C-N 3.31Å; A186-L188 PolarHBondContact O-N 3.23Å
187	F	94.3	Very high	96.4	Very high	157 Å²	157	59.7 Å²	59.7	69%	0.689	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-18.9	177.6	73.5	-91.8	0	0	0	113.8	P185	P185-F187 HydrophobicContact CB-CD1 3.69Å; P185-F187 HydrophobicContact CB-CE1 3.37Å; P185-F187 HydrophobicContact CB-CZ 4.09Å; P185-F187 HydrophobicContact CG-CE1 4.24Å; P185-F187 PolarHBondContact O-N 3.18Å
188	L	97.4	Very high	96.4	Very high	67 Å²	67	59.3 Å²	59.3	35%	0.351	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-19.4	175.8	-68.1	-178.9	0	0	0	113.1	I184 P185 A186 P190 A191 W192	I184-L188 HydrophobicContact CG2-CB 4.43Å; P185-L188 HydrophobicContact CB-CD1 4.43Å; P185-L188 HydrophobicContact CB-CG 4.45Å; P185-L188 HydrophobicContact CG-CD1 4.15Å; P185-L188 WeakPolarHBondContact O-CB 3.3Å; P185-L188 PolarHBondContact O-N 3.24Å; A186-L188 VanDerWaalsContact C-N 3.31Å; A186-L188 PolarHBondContact O-N 3.23Å; L188-P190 VanDerWaalsContact C-CD 3.45Å; L188-A191 WeakPolarHBondContact O-CB 3.45Å; L188-A191 PolarHBondContact O-N 3.35Å; L188-W192 PolarHBondContact O-N 2.89Å
189	Q	98	Very high	96.5	Very high	40 Å²	40	62.5 Å²	62.5	19%	0.187	33%	0.328	C	S	.	.	H	α-helix	trans	-53.6	-43.2	-179.5	-65.9	179.5	-9.8	0	0	113.5	I177 I184 P185 A191 W192 I193	I177-Q189 HydrophobicContact CG2-CB 3.93Å; I177-Q189 HydrophobicContact CG2-CG 3.99Å; I177-Q189 PolarHBondContact O-NE2 2.8Å; I184-Q189 HydrophobicContact CG2-CG 3.85Å; P185-Q189 PolarHBondContact O-N 2.86Å; Q189-A191 VanDerWaalsContact C-N 3.29Å; Q189-A191 PolarHBondContact O-N 3.33Å; Q189-W192 PolarHBondContact O-N 3.38Å; Q189-I193 WeakPolarHBondContact O-CG1 3.4Å; Q189-I193 PolarHBondContact O-N 3.39Å
190	P	98.5	Very high	96.6	Very high	8 Å²	8	61.7 Å²	61.7	5%	0.052	32%	0.323	C	S	.	.	H	α-helix	trans	-59.7	-38.2	177.1	-22.5	32.9	0	0	0	113.2	M67 V70 L71 L188 I193 G194	M67-P190 WeakPolarHBondContact CA-O 3.31Å; M67-P190 HydrophobicContact CG-CB 4.35Å; V70-P190 HydrophobicContact CB-CB 4.15Å; V70-P190 HydrophobicContact CG1-CB 3.94Å; V70-P190 HydrophobicContact CG1-CG 4.04Å; L71-P190 HydrophobicContact CB-CB 4.25Å; L71-P190 HydrophobicContact CB-CG 4.43Å; L71-P190 HydrophobicContact CD1-CG 4.33Å; L188-P190 VanDerWaalsContact C-CD 3.45Å; P190-I193 PolarHBondContact O-N 3.4Å; P190-G194 PolarHBondContact O-N 3.04Å
191	A	98.5	Very high	96.8	Very high	43 Å²	43	51 Å²	51	36%	0.355	28%	0.283	S	S	.	.	H	α-helix	trans	-66.7	-43.7	179.7	0	0	0	0	0	111.5	M67 L188 Q189 G194 A195	M67-A191 HydrophobicContact SD-CB 4.03Å; L188-A191 WeakPolarHBondContact O-CB 3.45Å; L188-A191 PolarHBondContact O-N 3.35Å; Q189-A191 VanDerWaalsContact C-N 3.29Å; Q189-A191 PolarHBondContact O-N 3.33Å; A191-G194 PolarHBondContact O-N 3.33Å; A191-A195 WeakPolarHBondContact O-CB 3.5Å; A191-A195 PolarHBondContact O-N 3.45Å
192	W	98.6	Very high	97	Very high	146 Å²	146	51.9 Å²	51.9	55%	0.553	29%	0.292	S	S	*	.	H	α-helix	trans	-67.2	-37.2	176.4	-74.7	116.9	0	0	0	113	I177 L188 Q189 A195 L196	I177-W192 HydrophobicContact CD1-CB 3.81Å; I177-W192 HydrophobicContact CG1-CB 4.05Å; I177-W192 HydrophobicContact CG2-CB 4.05Å; L188-W192 PolarHBondContact O-N 2.89Å; Q189-W192 PolarHBondContact O-N 3.38Å; W192-A195 HydrophobicContact CE3-CB 4.47Å; W192-A195 PolarHBondContact O-N 3.03Å; W192-L196 WeakPolarHBondContact O-CB 3.47Å; W192-L196 PolarHBondContact O-N 3.48Å
193	I	98.8	Very high	97.1	Very high	16 Å²	16	51.7 Å²	51.7	8%	0.082	30%	0.296	C	S	.	.	H	α-helix	trans	-64.8	-41.4	174.7	-70.2	165.6	0	0	0	110.8	L66 V70 I177 T178 Q189 P190 L196 L197	L66-I193 HydrophobicContact CD2-CG2 3.63Å; L66-I193 HydrophobicContact CG-CG2 4.06Å; V70-I193 HydrophobicContact CG1-CD1 4.15Å; V70-I193 HydrophobicContact CG2-CG2 4.13Å; I177-I193 HydrophobicContact CD1-CG1 4.14Å; I177-I193 HydrophobicContact CG2-CD1 4.37Å; I177-I193 HydrophobicContact CG2-CG1 4Å; T178-I193 HydrophobicContact CG2-CD1 4.36Å; Q189-I193 WeakPolarHBondContact O-CG1 3.4Å; Q189-I193 PolarHBondContact O-N 3.39Å; P190-I193 PolarHBondContact O-N 3.4Å; I193-L196 PolarHBondContact O-N 3.35Å; I193-L197 PolarHBondContact O-N 3.3Å; I193-L197 VanDerWaalsContact O-N 3.12Å
194	G	98.8	Very high	97.2	Very high	3 Å²	3	51.3 Å²	51.3	3%	0.031	28%	0.28	C	S	.	.	H	α-helix	trans	-64.6	-44	173.9	0	0	0	0	0	113	G63 P190 A191 L196 L197 A198	G63-G194 WeakPolarHBondContact CA-O 3.43Å; G63-G194 WeakPolarHBondContact O-CA 3.48Å; P190-G194 PolarHBondContact O-N 3.04Å; A191-G194 PolarHBondContact O-N 3.33Å; G194-L196 VanDerWaalsContact C-N 3.32Å; G194-L196 PolarHBondContact O-N 2.79Å; G194-L197 PolarHBondContact O-N 3Å; G194-A198 PolarHBondContact O-N 3.38Å
195	A	98.8	Very high	97.2	Very high	47 Å²	47	49.6 Å²	49.6	39%	0.388	27%	0.272	S	S	.	.	H	α-helix	trans	-61.7	-39.5	176	0	0	0	0	0	112.1	A191 W192 A198 F199	A191-A195 WeakPolarHBondContact O-CB 3.5Å; A191-A195 PolarHBondContact O-N 3.45Å; W192-A195 HydrophobicContact CE3-CB 4.47Å; W192-A195 PolarHBondContact O-N 3.03Å; A195-A198 PolarHBondContact O-N 3.22Å; A195-F199 WeakPolarHBondContact O-CB 3.33Å; A195-F199 PolarHBondContact O-N 3.38Å
196	L	98.8	Very high	97.2	Very high	24 Å²	24	53.4 Å²	53.4	13%	0.126	29%	0.289	C	S	.	.	H	α-helix	trans	-59.9	-45.3	173.8	175	62.7	0	0	0	111.6	L170 V174 I177 W192 I193 G194 F199 L200	L170-L196 HydrophobicContact CD1-CD2 4.11Å; L170-L196 HydrophobicContact CD1-CG 4.34Å; L170-L196 WeakPolarHBondContact O-CD2 3.08Å; V174-L196 HydrophobicContact CG2-CD2 4.22Å; I177-L196 HydrophobicContact CD1-CB 4.49Å; I177-L196 HydrophobicContact CD1-CD2 4.17Å; W192-L196 WeakPolarHBondContact O-CB 3.47Å; W192-L196 PolarHBondContact O-N 3.48Å; I193-L196 PolarHBondContact O-N 3.35Å; G194-L196 VanDerWaalsContact C-N 3.32Å; G194-L196 PolarHBondContact O-N 2.79Å; L196-F199 HydrophobicContact CD1-CD1 4.47Å; L196-F199 WeakPolarHBondContact O-CB 3.43Å; L196-F199 PolarHBondContact O-N 3.14Å; L196-L200 HydrophobicContact CD1-CD1 4.45Å; L196-L200 HydrophobicContact CG-CD1 4.35Å; L196-L200 WeakPolarHBondContact O-CG 3.37Å; L196-L200 PolarHBondContact O-N 3.44Å
197	L	98.7	Very high	97.4	Very high	13 Å²	13	52.4 Å²	52.4	7%	0.068	27%	0.274	C	S	.	.	H	α-helix	trans	-65.2	-41.5	176.6	-176.7	67.1	0	0	0	111.9	W62 L66 I193 G194 F199 L200 G201 Y210 I212	W62-L197 HydrophobicContact CB-CD2 4.07Å; W62-L197 WeakPolarHBondContact O-CD2 3.3Å; L66-L197 HydrophobicContact CB-CD2 3.71Å; L66-L197 HydrophobicContact CD2-CB 3.79Å; L66-L197 HydrophobicContact CD2-CD2 3.64Å; L66-L197 HydrophobicContact CD2-CG 4.23Å; L66-L197 HydrophobicContact CG-CD2 4.26Å; I193-L197 PolarHBondContact O-N 3.3Å; I193-L197 VanDerWaalsContact O-N 3.12Å; G194-L197 PolarHBondContact O-N 3Å; L197-F199 VanDerWaalsContact C-N 3.33Å; L197-F199 PolarHBondContact O-N 3.42Å; L197-L200 PolarHBondContact O-N 3.48Å; L197-G201 PolarHBondContact O-N 2.99Å; L197-Y210 HydrophobicContact CD1-CD2 4.34Å; L197-Y210 HydrophobicContact CD1-CE2 4.29Å; L197-I212 HydrophobicContact CD1-CD1 3.75Å
198	A	98.7	Very high	97.4	Very high	11 Å²	11	45 Å²	45	9%	0.091	24%	0.241	C	C	.	.	H	α-helix	trans	-61.4	-42.9	175.7	0	0	0	0	0	111.8	S59 G194 A195 L200 G201 M202	S59-A198 WeakPolarHBondContact O-CA 3.37Å; G194-A198 PolarHBondContact O-N 3.38Å; A195-A198 PolarHBondContact O-N 3.22Å; A198-L200 VanDerWaalsContact C-N 3.35Å; A198-L200 PolarHBondContact O-N 3.23Å; A198-G201 PolarHBondContact O-N 2.64Å; A198-M202 WeakPolarHBondContact O-CG 3.22Å; A198-M202 PolarHBondContact O-N 2.97Å
199	F	98.4	Very high	97.3	Very high	110 Å²	110	42.5 Å²	42.5	48%	0.482	23%	0.232	S	C	.	.	H	α-helix	trans	-58.2	-45	174	165.4	-104.1	0	0	0	112.1	V169 A195 L196 L197 G201 M202 S203	V169-F199 HydrophobicContact CG1-CE1 4.38Å; A195-F199 WeakPolarHBondContact O-CB 3.33Å; A195-F199 PolarHBondContact O-N 3.38Å; L196-F199 HydrophobicContact CD1-CD1 4.47Å; L196-F199 WeakPolarHBondContact O-CB 3.43Å; L196-F199 PolarHBondContact O-N 3.14Å; L197-F199 VanDerWaalsContact C-N 3.33Å; L197-F199 PolarHBondContact O-N 3.42Å; F199-G201 PolarHBondContact O-N 3.35Å; F199-M202 PolarHBondContact O-N 3.2Å; F199-S203 WeakPolarHBondContact O-CB 3.46Å; F199-S203 PolarHBondContact O-N 3Å; F199-S203 VanDerWaalsContact O-N 3.09Å; F199-S203 PolarHBondContact O-OG 3.05Å
200	L	98.2	Very high	97.2	Very high	1 Å²	1	41 Å²	41	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-62.5	-42.3	176.9	-72.6	165.5	0	0	0	112	V169 L170 L196 L197 A198 M202 S203 L204 I212	V169-L200 HydrophobicContact CB-CD2 3.92Å; V169-L200 HydrophobicContact CG1-CD2 3.77Å; L170-L200 HydrophobicContact CB-CD1 3.67Å; L170-L200 HydrophobicContact CD1-CD1 3.77Å; L170-L200 HydrophobicContact CG-CD1 4.3Å; L196-L200 HydrophobicContact CD1-CD1 4.45Å; L196-L200 HydrophobicContact CG-CD1 4.35Å; L196-L200 WeakPolarHBondContact O-CG 3.37Å; L196-L200 PolarHBondContact O-N 3.44Å; L197-L200 PolarHBondContact O-N 3.48Å; A198-L200 VanDerWaalsContact C-N 3.35Å; A198-L200 PolarHBondContact O-N 3.23Å; L200-M202 VanDerWaalsContact C-N 3.35Å; L200-M202 PolarHBondContact O-N 3.45Å; L200-S203 PolarHBondContact O-N 2.91Å; L200-S203 PolarHBondContact O-OG 3.49Å; L200-L204 HydrophobicContact CD2-CD1 3.77Å; L200-L204 PolarHBondContact O-N 3.25Å; L200-I212 HydrophobicContact CD1-CD1 3.91Å
201	G	97.3	Very high	97.1	Very high	2 Å²	2	40.7 Å²	40.7	2%	0.021	22%	0.223	C	C	.	.	H	α-helix	trans	-60.4	-44	174.5	0	0	0	0	0	112.2	S59 L197 A198 F199 S203 A205	S59-G201 WeakPolarHBondContact OG-CA 3.25Å; S59-G201 PolarHBondContact OG-O 3.27Å; L197-G201 PolarHBondContact O-N 2.99Å; A198-G201 PolarHBondContact O-N 2.64Å; F199-G201 PolarHBondContact O-N 3.35Å; G201-S203 VanDerWaalsContact C-N 3.25Å; G201-S203 PolarHBondContact O-N 2.81Å; G201-A205 WeakPolarHBondContact O-CB 3.3Å; G201-A205 PolarHBondContact O-N 3Å
202	M	97	Very high	97.1	Very high	104 Å²	104	38.9 Å²	38.9	51%	0.512	21%	0.207	S	C	.	.	H	α-helix	trans	-69.3	-21.7	-179.9	-69.3	-174.9	-67.2	0	0	113.7	I56 S59 A198 F199 L200	I56-M202 HydrophobicContact CD1-SD 4.24Å; I56-M202 HydrophobicContact CG1-CG 4.5Å; I56-M202 HydrophobicContact CG1-SD 3.98Å; S59-M202 PolarHBondContact OG-N 3.5Å; A198-M202 WeakPolarHBondContact O-CG 3.22Å; A198-M202 PolarHBondContact O-N 2.97Å; F199-M202 PolarHBondContact O-N 3.2Å; L200-M202 VanDerWaalsContact C-N 3.35Å; L200-M202 PolarHBondContact O-N 3.45Å
203	S	95.2	Very high	97.1	Very high	60 Å²	60	32.4 Å²	32.4	42%	0.42	18%	0.183	S	C	.	.	H	α-helix	trans	-109.1	-32.3	-172.1	54.6	0	0	0	0	114.6	F199 L200 G201	F199-S203 WeakPolarHBondContact O-CB 3.46Å; F199-S203 PolarHBondContact O-N 3Å; F199-S203 VanDerWaalsContact O-N 3.09Å; F199-S203 PolarHBondContact O-OG 3.05Å; L200-S203 PolarHBondContact O-N 2.91Å; L200-S203 PolarHBondContact O-OG 3.49Å; G201-S203 VanDerWaalsContact C-N 3.25Å; G201-S203 PolarHBondContact O-N 2.81Å
204	L	94.1	Very high	97.1	Very high	50 Å²	50	32 Å²	32	26%	0.262	18%	0.181	S	C	.	.	H	α-helix	trans	-123	4.2	-170.1	-61.2	177.8	0	0	0	113.9	L200 L206	L200-L204 HydrophobicContact CD2-CD1 3.77Å; L200-L204 PolarHBondContact O-N 3.25Å; L204-L206 PolarHBondContact O-N 3.48Å
205	A	94.3	Very high	97.1	Very high	8 Å²	8	31.8 Å²	31.8	7%	0.066	18%	0.18	C	C	.	.	H	α-helix	trans	-70.8	-28.6	-176.3	0	0	0	0	0	115.5	W55 G201 N207 G209 Y210	W55-A205 HydrophobicContact CE3-CB 3.97Å; W55-A205 HydrophobicContact CH2-CB 4.36Å; W55-A205 HydrophobicContact CZ3-CB 3.71Å; G201-A205 WeakPolarHBondContact O-CB 3.3Å; G201-A205 PolarHBondContact O-N 3Å; A205-N207 VanDerWaalsContact C-N 3.29Å; A205-N207 PolarHBondContact O-N 2.85Å; A205-G209 WeakPolarHBondContact O-CA 3.25Å; A205-G209 PolarHBondContact O-N 2.87Å; A205-Y210 HydrophobicContact CB-CD1 3.38Å; A205-Y210 HydrophobicContact CB-CE1 3.65Å
206	L	95.6	Very high	97.1	Very high	138 Å²	138	30.2 Å²	30.2	72%	0.723	16%	0.163	S	C	*	.	H	α-helix	trans	-56.9	-39.9	-169.1	177.7	60.9	0	0	0	113.4	F153 L204	F153-L206 HydrophobicContact CZ-CD1 4.35Å; F153-L206 HydrophobicContact CZ-CG 4.11Å; L204-L206 PolarHBondContact O-N 3.48Å
207	N	97.1	Very high	97.1	Very high	53 Å²	53	29 Å²	29	28%	0.283	16%	0.157	S	C	.	.	H	α-helix	trans	-69.7	-58.9	-174.4	-73.2	-26.6	0	0	0	111.7	P150 G151 L154 D162 A205	P150-N207 WeakPolarHBondContact CA-O 3.5Å; G151-N207 PolarHBondContact N-O 2.9Å; L154-N207 HydrophobicContact CD1-CB 4.06Å; L154-N207 HydrophobicContact CD2-CB 3.86Å; D162-N207 VanDerWaalsContact OD1-CB 3.24Å; D162-N207 WeakPolarHBondContact OD1-CB 3.47Å; D162-N207 PolarHBondContact OD1-ND2 3.09Å; A205-N207 VanDerWaalsContact C-N 3.29Å; A205-N207 PolarHBondContact O-N 2.85Å
208	A	95.8	Very high	97.1	Very high	1 Å²	1	32 Å²	32	1%	0.008	17%	0.17	C	C	.	.	H	α-helix	trans	-146.9	25	-172.2	0	0	0	0	0	114.6	T148 P150 L154 Y210 W241	T148-A208 WeakPolarHBondContact CB-O 3.36Å; P150-A208 HydrophobicContact CB-CB 4.04Å; L154-A208 HydrophobicContact CD2-CB 3.9Å; A208-Y210 VanDerWaalsContact C-N 3.32Å; A208-Y210 PolarHBondContact O-N 3.3Å; A208-W241 HydrophobicContact CB-CH2 3.32Å; A208-W241 HydrophobicContact CB-CZ2 3.95Å; A208-W241 HydrophobicContact CB-CZ3 3.97Å
209	G	94.1	Very high	97.1	Very high	15 Å²	15	31.7 Å²	31.7	16%	0.155	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	69	26.5	172.2	0	0	0	0	0	114.7	A205 A211	A205-G209 WeakPolarHBondContact O-CA 3.25Å; A205-G209 PolarHBondContact O-N 2.87Å; G209-A211 PolarHBondContact O-N 2.9Å
210	Y	96.1	Very high	97.1	Very high	9 Å²	9	26.4 Å²	26.4	4%	0.035	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	44	52.5	173.4	65.5	-78.2	0	0	0	113.9	W55 L197 A205 A208 I212	W55-Y210 HydrophobicContact CZ3-CE1 4.38Å; L197-Y210 HydrophobicContact CD1-CD2 4.34Å; L197-Y210 HydrophobicContact CD1-CE2 4.29Å; A205-Y210 HydrophobicContact CB-CD1 3.38Å; A205-Y210 HydrophobicContact CB-CE1 3.65Å; A208-Y210 VanDerWaalsContact C-N 3.32Å; A208-Y210 PolarHBondContact O-N 3.3Å; Y210-I212 HydrophobicContact CD2-CD1 4.29Å; Y210-I212 WeakPolarHBondContact O-CG1 3.39Å; Y210-I212 PolarHBondContact O-N 3.31Å
211	A	96.6	Very high	97.2	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.008	14%	0.144	C	C	.	.			trans	-53.1	-51.3	-176	0	0	0	0	0	112.5	T148 Q163 G209 N213 D217 P245	T148-A211 HydrophobicContact CG2-CB 3.66Å; T148-A211 WeakPolarHBondContact OG1-CB 3.42Å; Q163-A211 VanDerWaalsContact OE1-CB 3.3Å; G209-A211 PolarHBondContact O-N 2.9Å; A211-N213 PolarHBondContact O-N 2.96Å; A211-D217 HydrophobicContact CB-CB 4.35Å; A211-P245 HydrophobicContact CB-CB 3.76Å; A211-P245 HydrophobicContact CB-CG 4.16Å
212	I	98.3	Very high	97.2	Very high	4 Å²	4	29.6 Å²	29.6	2%	0.021	16%	0.16	C	C	.	.			trans	44.2	5.5	168	75.2	-174.1	0	0	0	118.2	N82 Q163 T167 L170 L197 L200 Y210	N82-I212 PolarHBondContact ND2-O 3Å; Q163-I212 VanDerWaalsContact OE1-N 3.16Å; T167-I212 WeakPolarHBondContact OG1-CA 3.38Å; T167-I212 WeakPolarHBondContact OG1-CB 3.48Å; L170-I212 HydrophobicContact CB-CD1 4.45Å; L170-I212 HydrophobicContact CD2-CB 4.39Å; L170-I212 HydrophobicContact CD2-CD1 3.88Å; L170-I212 HydrophobicContact CD2-CG1 3.98Å; L197-I212 HydrophobicContact CD1-CD1 3.75Å; L200-I212 HydrophobicContact CD1-CD1 3.91Å; Y210-I212 HydrophobicContact CD2-CD1 4.29Å; Y210-I212 WeakPolarHBondContact O-CG1 3.39Å; Y210-I212 PolarHBondContact O-N 3.31Å
213	N	98.8	Very high	97.3	Very high	11 Å²	11	25.1 Å²	25.1	6%	0.059	14%	0.138	C	C	.	.			trans	-148.1	108.3	-175.7	175.7	-17.8	0	0	0	107.8	L81 N82 P83 A211 A215 R216 D217	L81-N213 PolarHBondContact O-ND2 3.34Å; N82-N213 HydrophobicContact CB-CB 4.28Å; N82-N213 WeakPolarHBondContact CB-ND2 3.46Å; N82-N213 VanDerWaalsContact CG-CG 3.43Å; N82-N213 WeakPolarHBondContact ND2-CB 3.29Å; N82-N213 WeakPolarHBondContact OD1-CA 3.25Å; P83-N213 WeakPolarHBondContact CD-OD1 3.18Å; A211-N213 PolarHBondContact O-N 2.96Å; N213-A215 VanDerWaalsContact C-N 3.3Å; N213-A215 PolarHBondContact O-N 2.85Å; N213-A215 PolarHBondContact OD1-N 3.26Å; N213-R216 HydrophobicContact CB-CB 3.75Å; N213-R216 PolarHBondContact O-N 2.88Å; N213-R216 PolarHBondContact OD1-N 2.84Å; N213-D217 PolarHBondContact O-N 3.42Å
214	P	98.9	Very high	97.5	Very high	6 Å²	6	22.3 Å²	22.3	4%	0.039	12%	0.118	C	C	.	.	H	α-helix	trans	-57	-38	-178.4	-30.6	38.3	0	0	0	114.4	N82 P83 D217 F218 P245 I246 P249 M250	N82-P214 VanDerWaalsContact OD1-CD 3.28Å; N82-P214 WeakPolarHBondContact OD1-CD 3.45Å; P83-P214 HydrophobicContact CB-CB 4.09Å; P83-P214 HydrophobicContact CB-CG 4.15Å; P83-P214 HydrophobicContact CG-CB 4.02Å; P83-P214 HydrophobicContact CG-CG 4.5Å; P214-D217 PolarHBondContact O-N 2.81Å; P214-F218 VanDerWaalsContact O-CB 3.27Å; P214-F218 WeakPolarHBondContact O-CB 3.44Å; P214-F218 PolarHBondContact O-N 2.96Å; P214-P245 WeakPolarHBondContact CA-O 3.31Å; P214-I246 HydrophobicContact CB-CG2 4.4Å; P214-I246 WeakPolarHBondContact CG-O 3.32Å; P214-P249 HydrophobicContact CG-CB 4.1Å; P214-M250 HydrophobicContact CG-CG 4.22Å; P214-M250 HydrophobicContact CG-SD 4.08Å
215	A	98.9	Very high	97.7	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-70.9	-38.1	-179.4	0	0	0	0	0	112.2	T31 P83 Q107 A111 N213 D217 A219 P220	T31-A215 HydrophobicContact CG2-CB 4.5Å; P83-A215 HydrophobicContact CG-CB 3.82Å; Q107-A215 HydrophobicContact CB-CB 3.75Å; A111-A215 HydrophobicContact CB-CB 4.43Å; A111-A215 WeakPolarHBondContact CB-O 3.37Å; N213-A215 VanDerWaalsContact C-N 3.3Å; N213-A215 PolarHBondContact O-N 2.85Å; N213-A215 PolarHBondContact OD1-N 3.26Å; A215-D217 PolarHBondContact O-N 3.45Å; A215-A219 WeakPolarHBondContact O-CB 3.32Å; A215-A219 PolarHBondContact O-N 3.38Å; A215-P220 WeakPolarHBondContact O-CD 3.47Å
216	R	98.6	Very high	97.9	Very high	13 Å²	13	25.8 Å²	25.8	5%	0.049	14%	0.142	C	C	.	.	H	α-helix	trans	-65.8	-14.4	176.7	175	-95.8	176.1	-84.5	5.1	113.3	V35 W62 F146 N213 P220	V35-R216 HydrophobicContact CG2-CB 4.29Å; V35-R216 HydrophobicContact CG2-CG 4.38Å; W62-R216 HydrophobicContact CH2-CG 3.79Å; W62-R216 HydrophobicContact CZ3-CG 3.83Å; F146-R216 PolarHBondContact O-NH1 3.25Å; N213-R216 HydrophobicContact CB-CB 3.75Å; N213-R216 PolarHBondContact O-N 2.88Å; N213-R216 PolarHBondContact OD1-N 2.84Å; R216-P220 WeakPolarHBondContact O-CG 3.16Å
217	D	98.8	Very high	98	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-112.9	-50.1	178.7	-168.1	-104	0	0	0	112.7	T148 A211 N213 P214 A215 R221 P245	T148-D217 WeakPolarHBondContact CB-OD2 3.39Å; T148-D217 PolarHBondContact N-OD2 3.2Å; T148-D217 PolarHBondContact OG1-OD2 3.21Å; A211-D217 HydrophobicContact CB-CB 4.35Å; N213-D217 PolarHBondContact O-N 3.42Å; P214-D217 PolarHBondContact O-N 2.81Å; A215-D217 PolarHBondContact O-N 3.45Å; D217-R221 WeakPolarHBondContact O-CG 3.35Å; D217-R221 PolarHBondContact O-N 3.2Å; D217-R221 IonicContact OD1-CZ 2.87Å; D217-R221 IonicContact OD1-NE 2.74Å; D217-R221 PolarHBondContact OD1-NE 3.09Å; D217-R221 IonicContact OD1-NH2 3.21Å; D217-R221 PolarHBondContact OD1-NH2 3.38Å; D217-R221 IonicContact OD2-CZ 3.04Å; D217-R221 IonicContact OD2-NE 2.92Å; D217-R221 IonicContact OD2-NH2 3.81Å; D217-R221 PolarHBondContact OD2-NH2 3.2Å; D217-P245 HydrophobicContact CB-CB 3.76Å; D217-P245 WeakPolarHBondContact OD1-CB 3.47Å; D217-P245 WeakPolarHBondContact OD1-CG 3.41Å
218	F	98.8	Very high	98	Very high	76 Å²	76	19.7 Å²	19.7	33%	0.333	12%	0.123	S	C	.	.	H	α-helix	trans	-64.1	-47.5	-177	174.1	-106.9	0	0	0	112.7	N108 P214 R221 L222 F234 I246	N108-F218 WeakPolarHBondContact OD1-CD1 3.18Å; P214-F218 VanDerWaalsContact O-CB 3.27Å; P214-F218 WeakPolarHBondContact O-CB 3.44Å; P214-F218 PolarHBondContact O-N 2.96Å; F218-R221 WeakPolarHBondContact O-CB 3.27Å; F218-R221 PolarHBondContact O-N 3.16Å; F218-L222 PolarHBondContact O-N 3.45Å; F218-L222 VanDerWaalsContact O-N 3.07Å; F218-F234 HydrophobicContact CD2-CE1 4.26Å; F218-F234 HydrophobicContact CE2-CE1 4.14Å; F218-F234 HydrophobicContact CE2-CZ 4.47Å; F218-I246 HydrophobicContact CB-CD1 3.98Å; F218-I246 HydrophobicContact CB-CG1 4.16Å; F218-I246 HydrophobicContact CD2-CD1 3.66Å; F218-I246 HydrophobicContact CG-CD1 4.1Å
219	A	98.8	Very high	98.1	Very high	3 Å²	3	20 Å²	20	3%	0.025	12%	0.124	C	C	.	.	H	α-helix	trans	-69.1	-40.6	-174.4	0	0	0	0	0	112.6	N108 A111 F112 A215 R221 L222 F223	N108-A219 HydrophobicContact CB-CB 4.32Å; N108-A219 WeakPolarHBondContact O-CB 3.39Å; A111-A219 HydrophobicContact CB-CB 3.68Å; F112-A219 HydrophobicContact CB-CB 4.09Å; A215-A219 WeakPolarHBondContact O-CB 3.32Å; A215-A219 PolarHBondContact O-N 3.38Å; A219-R221 VanDerWaalsContact C-N 3.33Å; A219-R221 PolarHBondContact O-N 3.34Å; A219-L222 WeakPolarHBondContact O-CB 3.41Å; A219-L222 PolarHBondContact O-N 2.77Å; A219-F223 PolarHBondContact O-N 3.35Å
220	P	98.8	Very high	98.3	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-64.7	-29.6	170.9	-26.9	38.8	0	0	0	114.4	V35 E39 A115 F146 A215 R216 F223 N224	V35-P220 HydrophobicContact CG1-CG 3.96Å; E39-P220 VanDerWaalsContact OE1-CB 3.24Å; E39-P220 WeakPolarHBondContact OE1-CB 3.34Å; E39-P220 WeakPolarHBondContact OE1-CG 3.39Å; A115-P220 HydrophobicContact CB-CB 3.96Å; A115-P220 HydrophobicContact CB-CG 4.15Å; F146-P220 HydrophobicContact CB-CB 3.94Å; A215-P220 WeakPolarHBondContact O-CD 3.47Å; R216-P220 WeakPolarHBondContact O-CG 3.16Å; P220-F223 WeakPolarHBondContact O-CB 3.14Å; P220-F223 PolarHBondContact O-N 2.98Å; P220-N224 PolarHBondContact O-N 3.45Å
221	R	98.7	Very high	98.3	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-63.1	-43.7	169.1	-72.2	177.5	-165.7	-61.1	-22.1	112.1	A147 T148 D217 F218 A219 F223 N224 L225 V233 F234	A147-R221 HydrophobicContact CB-CB 4.49Å; A147-R221 HydrophobicContact CB-CG 3.44Å; A147-R221 VanDerWaalsContact CB-CG 3.44Å; T148-R221 PolarHBondContact O-NH2 3.13Å; D217-R221 WeakPolarHBondContact O-CG 3.35Å; D217-R221 PolarHBondContact O-N 3.2Å; D217-R221 IonicContact OD1-CZ 2.87Å; D217-R221 IonicContact OD1-NE 2.74Å; D217-R221 PolarHBondContact OD1-NE 3.09Å; D217-R221 IonicContact OD1-NH2 3.21Å; D217-R221 PolarHBondContact OD1-NH2 3.38Å; D217-R221 IonicContact OD2-CZ 3.04Å; D217-R221 IonicContact OD2-NE 2.92Å; D217-R221 IonicContact OD2-NH2 3.81Å; D217-R221 PolarHBondContact OD2-NH2 3.2Å; F218-R221 WeakPolarHBondContact O-CB 3.27Å; F218-R221 PolarHBondContact O-N 3.16Å; A219-R221 VanDerWaalsContact C-N 3.33Å; A219-R221 PolarHBondContact O-N 3.34Å; R221-F223 VanDerWaalsContact C-N 3.27Å; R221-F223 PolarHBondContact O-N 3.45Å; R221-N224 WeakPolarHBondContact O-CB 3.27Å; R221-N224 PolarHBondContact O-N 3.12Å; R221-L225 PolarHBondContact O-N 2.96Å; R221-V233 PolarHBondContact NH1-O 3.12Å; R221-F234 HydrophobicContact CB-CE1 3.84Å; R221-F234 HydrophobicContact CB-CZ 3.79Å
222	L	98.8	Very high	98.4	Very high	70 Å²	70	31.7 Å²	31.7	37%	0.366	18%	0.176	S	C	.	.	H	α-helix	trans	-61.9	-40.9	176.2	-176.9	62.9	0	0	0	110.4	F112 F218 A219 L225 C226	F112-L222 HydrophobicContact CD2-CB 4.33Å; F112-L222 HydrophobicContact CD2-CD2 4.31Å; F112-L222 HydrophobicContact CD2-CG 4.28Å; F112-L222 HydrophobicContact CE2-CB 4.45Å; F112-L222 HydrophobicContact CE2-CD2 4.4Å; F112-L222 HydrophobicContact CE2-CG 4.1Å; F218-L222 PolarHBondContact O-N 3.45Å; F218-L222 VanDerWaalsContact O-N 3.07Å; A219-L222 WeakPolarHBondContact O-CB 3.41Å; A219-L222 PolarHBondContact O-N 2.77Å; L222-L225 WeakPolarHBondContact O-CB 3.15Å; L222-L225 PolarHBondContact O-N 2.95Å; L222-C226 PolarHBondContact O-N 2.85Å; L222-C226 VanDerWaalsContact O-N 3.16Å; L222-C226 PolarHBondContact O-SG 3.39Å; L222-C226 VanDerWaalsContact O-SG 3.37Å
223	F	98.8	Very high	98.4	Very high	10 Å²	10	31.5 Å²	31.5	4%	0.044	18%	0.175	C	C	.	.	H	α-helix	trans	-60.3	-47.6	172.5	175.1	-101.8	0	0	0	112.2	F112 A115 F116 F119 F146 A219 P220 R221 L225 C226 A227	F112-F223 HydrophobicContact CD2-CB 3.85Å; F112-F223 HydrophobicContact CE1-CD2 4.33Å; F112-F223 VanDerWaalsContact CE2-CA 3.49Å; F112-F223 HydrophobicContact CE2-CB 3.78Å; F112-F223 HydrophobicContact CE2-CD2 4.27Å; F112-F223 HydrophobicContact CG-CB 4.5Å; F112-F223 HydrophobicContact CZ-CB 4.36Å; F112-F223 HydrophobicContact CZ-CD2 4.01Å; A115-F223 HydrophobicContact CB-CB 4.08Å; A115-F223 HydrophobicContact CB-CD1 3.83Å; A115-F223 HydrophobicContact CB-CG 4Å; F116-F223 HydrophobicContact CB-CD2 3.97Å; F116-F223 HydrophobicContact CB-CE2 3.78Å; F116-F223 HydrophobicContact CB-CZ 4.41Å; F116-F223 AromaticContact CD2-CE2 3.74Å; F116-F223 HydrophobicContact CD2-CE2 3.74Å; F116-F223 HydrophobicContact CD2-CZ 4.3Å; F116-F223 HydrophobicContact CG-CE2 4.26Å; F119-F223 HydrophobicContact CB-CE1 3.49Å; F119-F223 VanDerWaalsContact CB-CE1 3.49Å; F119-F223 HydrophobicContact CB-CZ 3.37Å; F119-F223 AromaticContact CD1-CZ 3.82Å; F119-F223 HydrophobicContact CD1-CZ 3.82Å; F119-F223 HydrophobicContact CD2-CE1 4.18Å; F119-F223 HydrophobicContact CD2-CZ 4.17Å; F119-F223 AromaticContact CG-CE1 3.87Å; F119-F223 HydrophobicContact CG-CE1 3.87Å; F119-F223 AromaticContact CG-CZ 3.53Å; F119-F223 HydrophobicContact CG-CZ 3.53Å; F146-F223 HydrophobicContact CD1-CD1 4.09Å; F146-F223 HydrophobicContact CD1-CE1 4.21Å; F146-F223 HydrophobicContact CE1-CD1 4.25Å; F146-F223 AromaticContact CE1-CE1 3.91Å; F146-F223 HydrophobicContact CE1-CE1 3.91Å; F146-F223 HydrophobicContact CZ-CE1 4.34Å; A219-F223 PolarHBondContact O-N 3.35Å; P220-F223 WeakPolarHBondContact O-CB 3.14Å; P220-F223 PolarHBondContact O-N 2.98Å; R221-F223 VanDerWaalsContact C-N 3.27Å; R221-F223 PolarHBondContact O-N 3.45Å; F223-L225 VanDerWaalsContact C-N 3.27Å; F223-L225 PolarHBondContact O-N 2.87Å; F223-C226 CarbonylContact O-C 3.6Å; F223-C226 WeakPolarHBondContact O-CA 3.4Å; F223-C226 WeakPolarHBondContact O-CB 3.45Å; F223-C226 PolarHBondContact O-N 3Å; F223-A227 HydrophobicContact CE1-CB 3.95Å; F223-A227 HydrophobicContact CE2-CB 4.39Å; F223-A227 HydrophobicContact CZ-CB 3.84Å; F223-A227 WeakPolarHBondContact O-CB 3.4Å; F223-A227 PolarHBondContact O-N 2.89Å
224	N	98.4	Very high	98.3	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-56.6	-41	175.9	-78.7	-19.8	0	0	0	112.2	A143 F146 P220 R221 C226 A227 G228 Y229 V233	A143-N224 PolarHBondContact O-ND2 3.46Å; F146-N224 WeakPolarHBondContact CD2-OD1 3.03Å; F146-N224 VanDerWaalsContact CG-OD1 3.3Å; F146-N224 WeakPolarHBondContact CG-OD1 3.42Å; P220-N224 PolarHBondContact O-N 3.45Å; R221-N224 WeakPolarHBondContact O-CB 3.27Å; R221-N224 PolarHBondContact O-N 3.12Å; N224-C226 VanDerWaalsContact C-N 3.3Å; N224-C226 PolarHBondContact O-N 3.28Å; N224-A227 PolarHBondContact O-N 3.2Å; N224-G228 PolarHBondContact O-N 3.3Å; N224-Y229 HydrophobicContact CB-CD2 3.73Å; N224-Y229 HydrophobicContact CB-CE2 4.39Å; N224-Y229 HydrophobicContact CB-CG 4.06Å; N224-Y229 WeakPolarHBondContact O-CB 3.4Å; N224-Y229 VanDerWaalsContact O-CD2 3.29Å; N224-Y229 WeakPolarHBondContact O-CD2 3.37Å; N224-Y229 PolarHBondContact O-N 2.95Å; N224-Y229 VanDerWaalsContact O-N 3.09Å; N224-Y229 WeakPolarHBondContact OD1-CE2 3.21Å; N224-V233 HydrophobicContact CB-CB 4.43Å; N224-V233 HydrophobicContact CB-CG1 3.68Å
225	L	98.4	Very high	98.2	Very high	40 Å²	40	33.2 Å²	33.2	21%	0.209	19%	0.185	C	C	.	.	I	π-helix	trans	-57.8	-44.7	174.8	-179	62.7	0	0	0	111	R221 L222 F223 G230 W231 V233 F234	R221-L225 PolarHBondContact O-N 2.96Å; L222-L225 WeakPolarHBondContact O-CB 3.15Å; L222-L225 PolarHBondContact O-N 2.95Å; F223-L225 VanDerWaalsContact C-N 3.27Å; F223-L225 PolarHBondContact O-N 2.87Å; L225-G230 WeakPolarHBondContact CD1-O 3.21Å; L225-W231 HydrophobicContact CD1-CD2 4.04Å; L225-W231 HydrophobicContact CD1-CE3 4.43Å; L225-W231 HydrophobicContact CD1-CG 4.18Å; L225-W231 HydrophobicContact CD2-CD2 4.43Å; L225-W231 HydrophobicContact CD2-CE3 4.27Å; L225-W231 HydrophobicContact CD2-CH2 3.92Å; L225-W231 HydrophobicContact CD2-CZ2 4.09Å; L225-W231 HydrophobicContact CD2-CZ3 4.02Å; L225-V233 HydrophobicContact CB-CG2 4.13Å; L225-F234 HydrophobicContact CB-CE2 4.24Å; L225-F234 HydrophobicContact CD2-CD2 4.43Å; L225-F234 HydrophobicContact CD2-CE2 3.97Å
226	C	98.4	Very high	98	Very high	91 Å²	91	34.9 Å²	34.9	62%	0.615	19%	0.192	S	C	*	.	I	π-helix	trans	-67.5	-33.5	176	-62.4	0	0	0	0	113.4	L222 F223 N224 G228	L222-C226 PolarHBondContact O-N 2.85Å; L222-C226 VanDerWaalsContact O-N 3.16Å; L222-C226 PolarHBondContact O-SG 3.39Å; L222-C226 VanDerWaalsContact O-SG 3.37Å; F223-C226 CarbonylContact O-C 3.6Å; F223-C226 WeakPolarHBondContact O-CA 3.4Å; F223-C226 WeakPolarHBondContact O-CB 3.45Å; F223-C226 PolarHBondContact O-N 3Å; N224-C226 VanDerWaalsContact C-N 3.3Å; N224-C226 PolarHBondContact O-N 3.28Å; C226-G228 PolarHBondContact O-N 2.87Å
227	A	97.7	Very high	97.8	Very high	16 Å²	16	37.6 Å²	37.6	13%	0.132	20%	0.202	C	C	.	.	I	π-helix	trans	-78.8	-3.1	-178.1	0	0	0	0	0	114	F119 F223 N224 Y229	F119-A227 HydrophobicContact CD2-CB 4.5Å; F119-A227 HydrophobicContact CE2-CB 4.22Å; F119-A227 HydrophobicContact CZ-CB 4.37Å; F223-A227 HydrophobicContact CE1-CB 3.95Å; F223-A227 HydrophobicContact CE2-CB 4.39Å; F223-A227 HydrophobicContact CZ-CB 3.84Å; F223-A227 WeakPolarHBondContact O-CB 3.4Å; F223-A227 PolarHBondContact O-N 2.89Å; N224-A227 PolarHBondContact O-N 3.2Å; A227-Y229 HydrophobicContact CB-CD2 4.12Å; A227-Y229 HydrophobicContact CB-CE2 4.11Å
228	G	97.6	Very high	97.7	Very high	47 Å²	47	44 Å²	44	49%	0.485	24%	0.236	S	C	.	.	I	π-helix	trans	101	11.9	172.8	0	0	0	0	0	115.5	N224 C226 G230	N224-G228 PolarHBondContact O-N 3.3Å; C226-G228 PolarHBondContact O-N 2.87Å; G228-G230 PolarHBondContact O-N 3.49Å
229	Y	98	Very high	97.6	Very high	7 Å²	7	46.6 Å²	46.6	3%	0.027	25%	0.245	C	C	.	.	I	π-helix	trans	-72.7	-8.3	173.6	-68.9	-94.3	0	0	0	113.3	E130 R134 T142 A143 F146 N224 A227	E130-Y229 WeakPolarHBondContact OE1-CE1 3.39Å; R134-Y229 HydrophobicContact CB-CD1 3.73Å; R134-Y229 HydrophobicContact CB-CD2 4.17Å; R134-Y229 HydrophobicContact CB-CE1 3.91Å; R134-Y229 HydrophobicContact CB-CE2 4.36Å; R134-Y229 HydrophobicContact CB-CG 3.88Å; R134-Y229 HydrophobicContact CG-CE2 4.38Å; T142-Y229 PolarHBondContact OG1-OH 3.29Å; A143-Y229 HydrophobicContact CB-CD1 3.65Å; A143-Y229 HydrophobicContact CB-CE1 3.8Å; A143-Y229 HydrophobicContact CB-CG 4.4Å; F146-Y229 HydrophobicContact CE2-CE2 4.46Å; F146-Y229 WeakPolarHBondContact CE2-OH 3.18Å; N224-Y229 HydrophobicContact CB-CD2 3.73Å; N224-Y229 HydrophobicContact CB-CE2 4.39Å; N224-Y229 HydrophobicContact CB-CG 4.06Å; N224-Y229 WeakPolarHBondContact O-CB 3.4Å; N224-Y229 VanDerWaalsContact O-CD2 3.29Å; N224-Y229 WeakPolarHBondContact O-CD2 3.37Å; N224-Y229 PolarHBondContact O-N 2.95Å; N224-Y229 VanDerWaalsContact O-N 3.09Å; N224-Y229 WeakPolarHBondContact OD1-CE2 3.21Å; A227-Y229 HydrophobicContact CB-CD2 4.12Å; A227-Y229 HydrophobicContact CB-CE2 4.11Å
230	G	97.6	Very high	97.5	Very high	31 Å²	31	51.6 Å²	51.6	32%	0.32	27%	0.266	S	S	.	.			trans	70.8	-174.9	178.7	0	0	0	0	0	113.9	L225 G228 E232 V233	L225-G230 WeakPolarHBondContact CD1-O 3.21Å; G228-G230 PolarHBondContact O-N 3.49Å; G230-E232 PolarHBondContact O-N 3.04Å; G230-V233 WeakPolarHBondContact O-CG2 3.29Å
231	W	97.4	Very high	97.4	Very high	171 Å²	171	51.7 Å²	51.7	65%	0.648	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-10.5	-174.8	-78.3	102.8	0	0	0	114.6	L225 V233 F234 S235	L225-W231 HydrophobicContact CD1-CD2 4.04Å; L225-W231 HydrophobicContact CD1-CE3 4.43Å; L225-W231 HydrophobicContact CD1-CG 4.18Å; L225-W231 HydrophobicContact CD2-CD2 4.43Å; L225-W231 HydrophobicContact CD2-CE3 4.27Å; L225-W231 HydrophobicContact CD2-CH2 3.92Å; L225-W231 HydrophobicContact CD2-CZ2 4.09Å; L225-W231 HydrophobicContact CD2-CZ3 4.02Å; W231-V233 PolarHBondContact O-N 3.02Å; W231-V233 VanDerWaalsContact O-N 3.12Å; W231-F234 AromaticContact CE3-CD2 3.99Å; W231-F234 HydrophobicContact CE3-CD2 3.99Å; W231-F234 HydrophobicContact CZ3-CD2 4.03Å; W231-F234 PolarHBondContact O-N 2.87Å; W231-S235 PolarHBondContact O-N 3Å; W231-S235 PolarHBondContact O-OG 2.92Å
232	E	97.6	Very high	97.3	Very high	70 Å²	70	54.6 Å²	54.6	33%	0.327	28%	0.279	S	S	.	.	H	α-helix	trans	-56.9	-27.6	176.7	-165.6	-177.1	170.4	0	0	112.2	V136 T137 G230 F234 S235 Y236	V136-E232 HydrophobicContact CB-CB 4.22Å; V136-E232 HydrophobicContact CB-CG 3.86Å; V136-E232 HydrophobicContact CG1-CG 4.34Å; V136-E232 HydrophobicContact CG2-CB 3.79Å; V136-E232 HydrophobicContact CG2-CG 4Å; T137-E232 WeakPolarHBondContact CG2-OE1 3.44Å; T137-E232 PolarHBondContact OG1-OE1 3.09Å; T137-E232 VanDerWaalsContact OG1-OE1 3.08Å; G230-E232 PolarHBondContact O-N 3.04Å; E232-F234 PolarHBondContact O-N 3.1Å; E232-F234 VanDerWaalsContact O-N 3.09Å; E232-S235 WeakPolarHBondContact CA-OG 3.4Å; E232-S235 PolarHBondContact O-N 3.14Å; E232-Y236 WeakPolarHBondContact O-CB 3.39Å; E232-Y236 PolarHBondContact O-N 2.74Å
233	V	97.9	Very high	97.3	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-59.3	-25.9	177.9	-55.1	0	0	0	0	113.1	V136 R221 N224 L225 G230 W231	V136-V233 HydrophobicContact CG2-CB 4.42Å; V136-V233 HydrophobicContact CG2-CG1 3.64Å; R221-V233 PolarHBondContact NH1-O 3.12Å; N224-V233 HydrophobicContact CB-CB 4.43Å; N224-V233 HydrophobicContact CB-CG1 3.68Å; L225-V233 HydrophobicContact CB-CG2 4.13Å; G230-V233 WeakPolarHBondContact O-CG2 3.29Å; W231-V233 PolarHBondContact O-N 3.02Å; W231-V233 VanDerWaalsContact O-N 3.12Å
234	F	98.1	Very high	97.3	Very high	20 Å²	20	55 Å²	55	9%	0.088	28%	0.276	C	S	.	.	H	α-helix	trans	-106.1	-35.6	174.7	-66.8	-71.2	0	0	0	112.5	F218 R221 L225 W231 E232 Y236 F242	F218-F234 HydrophobicContact CD2-CE1 4.26Å; F218-F234 HydrophobicContact CE2-CE1 4.14Å; F218-F234 HydrophobicContact CE2-CZ 4.47Å; R221-F234 HydrophobicContact CB-CE1 3.84Å; R221-F234 HydrophobicContact CB-CZ 3.79Å; L225-F234 HydrophobicContact CB-CE2 4.24Å; L225-F234 HydrophobicContact CD2-CD2 4.43Å; L225-F234 HydrophobicContact CD2-CE2 3.97Å; W231-F234 AromaticContact CE3-CD2 3.99Å; W231-F234 HydrophobicContact CE3-CD2 3.99Å; W231-F234 HydrophobicContact CZ3-CD2 4.03Å; W231-F234 PolarHBondContact O-N 2.87Å; E232-F234 PolarHBondContact O-N 3.1Å; E232-F234 VanDerWaalsContact O-N 3.09Å; F234-Y236 VanDerWaalsContact C-N 3.33Å; F234-Y236 PolarHBondContact O-N 2.96Å; F234-F242 HydrophobicContact CB-CG 4.48Å; F234-F242 HydrophobicContact CD1-CB 3.96Å; F234-F242 AromaticContact CD1-CD2 3.86Å; F234-F242 HydrophobicContact CD1-CD2 3.86Å; F234-F242 AromaticContact CD1-CG 4Å; F234-F242 HydrophobicContact CD1-CG 4Å; F234-F242 VanDerWaalsContact O-CD1 3.27Å; F234-F242 WeakPolarHBondContact O-CD1 3.36Å
235	S	97.1	Very high	97.3	Very high	32 Å²	32	55 Å²	55	22%	0.224	28%	0.276	C	S	.	.	H	α-helix	trans	-83.4	-4.5	-176.6	73.6	0	0	0	0	114.6	W231 E232 R237 N238 Y239	W231-S235 PolarHBondContact O-N 3Å; W231-S235 PolarHBondContact O-OG 2.92Å; E232-S235 WeakPolarHBondContact CA-OG 3.4Å; E232-S235 PolarHBondContact O-N 3.14Å; S235-R237 PolarHBondContact O-N 2.99Å; S235-N238 WeakPolarHBondContact O-CA 3.19Å; S235-N238 PolarHBondContact O-N 3.31Å; S235-Y239 VanDerWaalsContact CB-CE1 3.42Å; S235-Y239 PolarHBondContact O-N 3.19Å
236	Y	94.9	Very high	97.3	Very high	36 Å²	36	55 Å²	55	14%	0.141	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-45	127.2	177	-179.8	-103.6	0	0	0	111.8	V136 T137 Y149 P150 E232 F234 Y239 W241	V136-Y236 HydrophobicContact CG1-CD2 4.24Å; T137-Y236 HydrophobicContact CG2-CD2 3.76Å; T137-Y236 HydrophobicContact CG2-CE2 3.42Å; T137-Y236 VanDerWaalsContact CG2-CE2 3.42Å; Y149-Y236 AromaticContact CD1-CD1 3.86Å; Y149-Y236 HydrophobicContact CD1-CD1 3.86Å; Y149-Y236 HydrophobicContact CD1-CD2 4.42Å; Y149-Y236 HydrophobicContact CD1-CE1 4.29Å; Y149-Y236 AromaticContact CD1-CG 3.92Å; Y149-Y236 HydrophobicContact CD1-CG 3.92Å; Y149-Y236 HydrophobicContact CE1-CG 4.35Å; P150-Y236 HydrophobicContact CG-CE1 3.74Å; P150-Y236 PolarHBondContact O-OH 2.66Å; E232-Y236 WeakPolarHBondContact O-CB 3.39Å; E232-Y236 PolarHBondContact O-N 2.74Å; F234-Y236 VanDerWaalsContact C-N 3.33Å; F234-Y236 PolarHBondContact O-N 2.96Å; Y236-Y239 PolarHBondContact O-N 2.8Å; Y236-W241 HydrophobicContact CD1-CB 3.98Å; Y236-W241 HydrophobicContact CD1-CG 4.3Å
237	R	94.3	Very high	97.3	Very high	70 Å²	70	54.9 Å²	54.9	26%	0.264	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.7	46.2	-172.6	-65.7	179	172.6	-169	-4.6	114	G151 P152 L154 S235 Y239 K240	G151-R237 PolarHBondContact O-NH2 2.61Å; P152-R237 PolarHBondContact O-NH2 2.86Å; L154-R237 PolarHBondContact O-NH1 2.76Å; S235-R237 PolarHBondContact O-N 2.99Å; R237-Y239 PolarHBondContact O-N 2.75Å; R237-K240 HydrophobicContact CB-CB 4.39Å; R237-K240 VanDerWaalsContact O-CB 3.23Å; R237-K240 WeakPolarHBondContact O-CB 3.15Å; R237-K240 WeakPolarHBondContact O-CD 3.4Å; R237-K240 WeakPolarHBondContact O-CG 3.27Å; R237-K240 PolarHBondContact O-N 2.85Å
238	N	95.4	Very high	97.4	Very high	133 Å²	133	54.3 Å²	54.3	71%	0.711	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.8	50.1	-179.2	-57.1	-34.5	0	0	0	111.7	S235 K240	S235-N238 WeakPolarHBondContact O-CA 3.19Å; S235-N238 PolarHBondContact O-N 3.31Å; N238-K240 PolarHBondContact O-N 2.91Å; N238-K240 VanDerWaalsContact O-N 3.12Å
239	Y	96.6	Very high	97.4	Very high	132 Å²	132	52 Å²	52	52%	0.518	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.8	12.5	178.8	-56.3	-86.7	0	0	0	115.2	S235 Y236 R237 W241 F242 W243	S235-Y239 VanDerWaalsContact CB-CE1 3.42Å; S235-Y239 PolarHBondContact O-N 3.19Å; Y236-Y239 PolarHBondContact O-N 2.8Å; R237-Y239 PolarHBondContact O-N 2.75Å; Y239-W241 VanDerWaalsContact C-N 3.28Å; Y239-W241 PolarHBondContact O-N 3.31Å; Y239-F242 HydrophobicContact CD1-CE1 4.27Å; Y239-W243 VanDerWaalsContact O-CD1 3.27Å; Y239-W243 PolarHBondContact O-NE1 2.9Å
240	K	96.3	Very high	97.5	Very high	107 Å²	107	53.4 Å²	53.4	47%	0.465	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-11.3	-176.3	-67.9	177	-175.7	-177.8	0	114.2	T156 R237 N238 I244	T156-K240 HydrophobicContact CG2-CB 4.38Å; R237-K240 HydrophobicContact CB-CB 4.39Å; R237-K240 VanDerWaalsContact O-CB 3.23Å; R237-K240 WeakPolarHBondContact O-CB 3.15Å; R237-K240 WeakPolarHBondContact O-CD 3.4Å; R237-K240 WeakPolarHBondContact O-CG 3.27Å; R237-K240 PolarHBondContact O-N 2.85Å; N238-K240 PolarHBondContact O-N 2.91Å; N238-K240 VanDerWaalsContact O-N 3.12Å; K240-I244 WeakPolarHBondContact O-CD1 3.29Å
241	W	97.8	Very high	97.6	Very high	3 Å²	3	55.6 Å²	55.6	1%	0.011	25%	0.25	C	S	.	.	S	Bend	trans	-105.4	-50.7	-172.8	177.2	-118.4	0	0	0	114.6	T148 P150 A159 Q163 A208 Y236 Y239 W243 I244 P245	T148-W241 PolarHBondContact O-NE1 3.5Å; T148-W241 WeakPolarHBondContact OG1-CZ2 3.43Å; P150-W241 HydrophobicContact CB-CD2 4.49Å; P150-W241 HydrophobicContact CB-CE3 4.18Å; P150-W241 HydrophobicContact CB-CZ3 4.23Å; P150-W241 VanDerWaalsContact CD-CE2 3.43Å; P150-W241 HydrophobicContact CG-CD2 3.78Å; P150-W241 HydrophobicContact CG-CE3 3.77Å; P150-W241 HydrophobicContact CG-CG 4.08Å; P150-W241 HydrophobicContact CG-CZ3 4.33Å; A159-W241 HydrophobicContact CB-CE3 4.33Å; A159-W241 HydrophobicContact CB-CZ3 3.92Å; Q163-W241 HydrophobicContact CG-CH2 4.16Å; Q163-W241 HydrophobicContact CG-CZ3 4.49Å; A208-W241 HydrophobicContact CB-CH2 3.32Å; A208-W241 HydrophobicContact CB-CZ2 3.95Å; A208-W241 HydrophobicContact CB-CZ3 3.97Å; Y236-W241 HydrophobicContact CD1-CB 3.98Å; Y236-W241 HydrophobicContact CD1-CG 4.3Å; Y239-W241 VanDerWaalsContact C-N 3.28Å; Y239-W241 PolarHBondContact O-N 3.31Å; W241-W243 PolarHBondContact O-N 2.82Å; W241-I244 HydrophobicContact CE3-CB 4.09Å; W241-I244 HydrophobicContact CE3-CD1 4.11Å; W241-I244 HydrophobicContact CE3-CG2 4.36Å; W241-I244 HydrophobicContact CZ3-CB 4.11Å; W241-I244 HydrophobicContact CZ3-CD1 4.46Å; W241-I244 HydrophobicContact CZ3-CG2 3.89Å; W241-I244 WeakPolarHBondContact O-CB 3.47Å; W241-I244 PolarHBondContact O-N 3.31Å; W241-P245 HydrophobicContact CD2-CG 4.32Å; W241-P245 HydrophobicContact CH2-CG 3.78Å; W241-P245 HydrophobicContact CZ2-CG 3.4Å; W241-P245 HydrophobicContact CZ3-CG 4.42Å; W241-P245 WeakPolarHBondContact O-CD 3.37Å
242	F	97.3	Very high	97.6	Very high	61 Å²	61	47.5 Å²	47.5	27%	0.268	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-29.8	-163	81.2	-82.9	0	0	0	115.2	F234 Y239 I246	F234-F242 HydrophobicContact CB-CG 4.48Å; F234-F242 HydrophobicContact CD1-CB 3.96Å; F234-F242 AromaticContact CD1-CD2 3.86Å; F234-F242 HydrophobicContact CD1-CD2 3.86Å; F234-F242 AromaticContact CD1-CG 4Å; F234-F242 HydrophobicContact CD1-CG 4Å; F234-F242 VanDerWaalsContact O-CD1 3.27Å; F234-F242 WeakPolarHBondContact O-CD1 3.36Å; Y239-F242 HydrophobicContact CD1-CE1 4.27Å; F242-I246 WeakPolarHBondContact O-CD1 3.36Å; F242-I246 WeakPolarHBondContact O-CG1 3.44Å
243	W	98.3	Very high	97.7	Very high	88 Å²	88	44.1 Å²	44.1	33%	0.333	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-21.1	-179.9	63.4	-95.8	0	0	0	113.1	I160 Y239 W241 I246 I247	I160-W243 HydrophobicContact CD1-CH2 3.8Å; I160-W243 HydrophobicContact CG1-CH2 4.01Å; I160-W243 HydrophobicContact CG1-CZ3 4.5Å; Y239-W243 VanDerWaalsContact O-CD1 3.27Å; Y239-W243 PolarHBondContact O-NE1 2.9Å; W241-W243 PolarHBondContact O-N 2.82Å; W243-I246 WeakPolarHBondContact O-CB 3.45Å; W243-I246 PolarHBondContact O-N 3.33Å; W243-I246 VanDerWaalsContact O-N 3.1Å; W243-I247 HydrophobicContact CE3-CB 4.4Å; W243-I247 HydrophobicContact CE3-CG1 4.47Å; W243-I247 PolarHBondContact O-N 3.24Å
244	I	98.7	Very high	97.7	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-63.2	-52.3	-177.9	-65.6	177.3	0	0	0	110.1	T156 A159 I160 Q163 K240 W241 I246 I247 C248 P249	T156-I244 HydrophobicContact CG2-CD1 4.05Å; A159-I244 HydrophobicContact CB-CD1 3.94Å; I160-I244 HydrophobicContact CG1-CD1 3.99Å; I160-I244 HydrophobicContact CG1-CG1 4.2Å; Q163-I244 HydrophobicContact CB-CG2 4.05Å; Q163-I244 HydrophobicContact CG-CG2 3.8Å; K240-I244 WeakPolarHBondContact O-CD1 3.29Å; W241-I244 HydrophobicContact CE3-CB 4.09Å; W241-I244 HydrophobicContact CE3-CD1 4.11Å; W241-I244 HydrophobicContact CE3-CG2 4.36Å; W241-I244 HydrophobicContact CZ3-CB 4.11Å; W241-I244 HydrophobicContact CZ3-CD1 4.46Å; W241-I244 HydrophobicContact CZ3-CG2 3.89Å; W241-I244 WeakPolarHBondContact O-CB 3.47Å; W241-I244 PolarHBondContact O-N 3.31Å; I244-I246 PolarHBondContact O-N 3.08Å; I244-I247 PolarHBondContact O-N 2.55Å; I244-C248 HydrophobicContact CG2-CB 4.15Å; I244-C248 WeakPolarHBondContact O-CB 3.41Å; I244-C248 PolarHBondContact O-N 2.94Å; I244-P249 WeakPolarHBondContact O-CD 3.36Å
245	P	98.4	Very high	97.8	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-62.1	-7.1	174	-26.7	38	0	0	0	115.5	A211 P214 D217 W241 P249	A211-P245 HydrophobicContact CB-CB 3.76Å; A211-P245 HydrophobicContact CB-CG 4.16Å; P214-P245 WeakPolarHBondContact CA-O 3.31Å; D217-P245 HydrophobicContact CB-CB 3.76Å; D217-P245 WeakPolarHBondContact OD1-CB 3.47Å; D217-P245 WeakPolarHBondContact OD1-CG 3.41Å; W241-P245 HydrophobicContact CD2-CG 4.32Å; W241-P245 HydrophobicContact CH2-CG 3.78Å; W241-P245 HydrophobicContact CZ2-CG 3.4Å; W241-P245 HydrophobicContact CZ3-CG 4.42Å; W241-P245 WeakPolarHBondContact O-CD 3.37Å; P245-P249 VanDerWaalsContact O-CG 3.3Å; P245-P249 WeakPolarHBondContact O-CG 3.44Å
246	I	98.6	Very high	97.8	Very high	40 Å²	40	47.2 Å²	47.2	21%	0.205	22%	0.219	C	C	.	.	H	α-helix	trans	-98.6	-52.6	179.4	-56.3	174.9	0	0	0	109.9	P214 F218 F242 W243 I244 M250	P214-I246 HydrophobicContact CB-CG2 4.4Å; P214-I246 WeakPolarHBondContact CG-O 3.32Å; F218-I246 HydrophobicContact CB-CD1 3.98Å; F218-I246 HydrophobicContact CB-CG1 4.16Å; F218-I246 HydrophobicContact CD2-CD1 3.66Å; F218-I246 HydrophobicContact CG-CD1 4.1Å; F242-I246 WeakPolarHBondContact O-CD1 3.36Å; F242-I246 WeakPolarHBondContact O-CG1 3.44Å; W243-I246 WeakPolarHBondContact O-CB 3.45Å; W243-I246 PolarHBondContact O-N 3.33Å; W243-I246 VanDerWaalsContact O-N 3.1Å; I244-I246 PolarHBondContact O-N 3.08Å; I246-M250 WeakPolarHBondContact O-CG 3.46Å
247	I	98.7	Very high	98	Very high	88 Å²	88	45.5 Å²	45.5	45%	0.451	21%	0.212	S	C	.	.	H	α-helix	trans	-87.4	-43.4	-171.8	-56.2	-58.1	0	0	0	111.6	W243 I244 M250 I251	W243-I247 HydrophobicContact CE3-CB 4.4Å; W243-I247 HydrophobicContact CE3-CG1 4.47Å; W243-I247 PolarHBondContact O-N 3.24Å; I244-I247 PolarHBondContact O-N 2.55Å; I247-M250 WeakPolarHBondContact O-CB 3.37Å; I247-M250 PolarHBondContact O-N 2.77Å; I247-M250 VanDerWaalsContact O-N 3.14Å; I247-I251 HydrophobicContact CG2-CD1 4.17Å; I247-I251 PolarHBondContact O-N 3.49Å
248	C	98.8	Very high	98.2	Very high	3 Å²	3	46 Å²	46	2%	0.02	21%	0.214	C	C	.	.	H	α-helix	trans	-65.3	-39.4	-175.1	-64.2	0	0	0	0	112.8	Q163 I164 I244 M250 I251 G252	Q163-C248 HydrophobicContact CB-CB 3.72Å; I164-C248 HydrophobicContact CG1-CB 3.87Å; I244-C248 HydrophobicContact CG2-CB 4.15Å; I244-C248 WeakPolarHBondContact O-CB 3.41Å; I244-C248 PolarHBondContact O-N 2.94Å; C248-M250 VanDerWaalsContact C-N 3.31Å; C248-M250 PolarHBondContact O-N 3.17Å; C248-I251 PolarHBondContact O-N 3.4Å; C248-G252 PolarHBondContact O-N 3.31Å
249	P	98.9	Very high	98.4	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-60.5	-35.5	171.5	-32.2	41.7	0	0	0	114.3	A84 T167 P214 I244 P245 I251 G252 G253	A84-P249 HydrophobicContact CB-CB 4.11Å; A84-P249 WeakPolarHBondContact CB-O 3.19Å; T167-P249 HydrophobicContact CG2-CB 3.85Å; T167-P249 WeakPolarHBondContact CG2-O 3.46Å; T167-P249 VanDerWaalsContact OG1-CA 3.29Å; T167-P249 WeakPolarHBondContact OG1-CA 3.22Å; T167-P249 WeakPolarHBondContact OG1-CB 3.37Å; P214-P249 HydrophobicContact CG-CB 4.1Å; I244-P249 WeakPolarHBondContact O-CD 3.36Å; P245-P249 VanDerWaalsContact O-CG 3.3Å; P245-P249 WeakPolarHBondContact O-CG 3.44Å; P249-I251 VanDerWaalsContact C-N 3.32Å; P249-I251 PolarHBondContact O-N 3.21Å; P249-G252 PolarHBondContact O-N 3.02Å; P249-G253 PolarHBondContact O-N 3.32Å
250	M	98.8	Very high	98.5	Very high	35 Å²	35	36.7 Å²	36.7	17%	0.172	17%	0.173	C	C	.	.	H	α-helix	trans	-63.5	-41.6	177.5	-58.8	-72.6	-78	0	0	111	P83 A84 F87 F100 P214 I246 I247 C248 V254	P83-M250 HydrophobicContact CB-SD 4.1Å; A84-M250 VanDerWaalsContact CA-SD 3.59Å; A84-M250 HydrophobicContact CB-SD 4.14Å; F87-M250 HydrophobicContact CB-CE 3.45Å; F87-M250 VanDerWaalsContact CB-CE 3.45Å; F87-M250 HydrophobicContact CB-SD 4.01Å; F87-M250 HydrophobicContact CD1-CB 4.18Å; F87-M250 HydrophobicContact CD1-CE 3.76Å; F87-M250 HydrophobicContact CD2-CE 3.79Å; F87-M250 HydrophobicContact CE1-CE 4.44Å; F87-M250 HydrophobicContact CE2-CE 4.48Å; F87-M250 HydrophobicContact CG-CE 3.39Å; F87-M250 HydrophobicContact CG-SD 4.38Å; F100-M250 HydrophobicContact CE2-CE 4.17Å; F100-M250 HydrophobicContact CZ-CE 3.86Å; P214-M250 HydrophobicContact CG-CG 4.22Å; P214-M250 HydrophobicContact CG-SD 4.08Å; I246-M250 WeakPolarHBondContact O-CG 3.46Å; I247-M250 WeakPolarHBondContact O-CB 3.37Å; I247-M250 PolarHBondContact O-N 2.77Å; I247-M250 VanDerWaalsContact O-N 3.14Å; C248-M250 VanDerWaalsContact C-N 3.31Å; C248-M250 PolarHBondContact O-N 3.17Å; M250-V254 WeakPolarHBondContact O-CG2 3.43Å; M250-V254 PolarHBondContact O-N 3.24Å
251	I	98.9	Very high	98.5	Very high	78 Å²	78	32.3 Å²	32.3	40%	0.4	15%	0.154	S	C	.	.	H	α-helix	trans	-66.1	-51.6	175.7	-61.3	168.2	0	0	0	110.3	I164 I247 C248 P249 G253 V254 L255	I164-I251 HydrophobicContact CD1-CG2 4.22Å; I164-I251 HydrophobicContact CG1-CB 4.45Å; I164-I251 HydrophobicContact CG1-CG2 4.43Å; I247-I251 HydrophobicContact CG2-CD1 4.17Å; I247-I251 PolarHBondContact O-N 3.49Å; C248-I251 PolarHBondContact O-N 3.4Å; P249-I251 VanDerWaalsContact C-N 3.32Å; P249-I251 PolarHBondContact O-N 3.21Å; I251-G253 VanDerWaalsContact C-N 3.29Å; I251-G253 PolarHBondContact O-N 3.44Å; I251-V254 PolarHBondContact O-N 2.89Å; I251-L255 HydrophobicContact CG2-CD1 3.93Å; I251-L255 HydrophobicContact CG2-CG 4.43Å; I251-L255 WeakPolarHBondContact O-CG 3.35Å; I251-L255 PolarHBondContact O-N 3.04Å
252	G	98.8	Very high	98.6	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-57.8	-42	179.3	0	0	0	0	0	112.2	I164 L168 C248 P249 V254 L255 G256	I164-G252 WeakPolarHBondContact O-CA 3.45Å; L168-G252 WeakPolarHBondContact CA-O 3.37Å; C248-G252 PolarHBondContact O-N 3.31Å; P249-G252 PolarHBondContact O-N 3.02Å; G252-V254 PolarHBondContact O-N 3.37Å; G252-L255 PolarHBondContact O-N 2.88Å; G252-G256 PolarHBondContact O-N 2.85Å
253	G	98.8	Very high	98.6	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-62.5	-44.1	-179.1	0	0	0	0	0	113.6	C171 P249 I251 A257	C171-G253 VanDerWaalsContact CB-O 3.3Å; C171-G253 WeakPolarHBondContact CB-O 3.45Å; C171-G253 WeakPolarHBondContact SG-CA 3.28Å; P249-G253 PolarHBondContact O-N 3.32Å; I251-G253 VanDerWaalsContact C-N 3.29Å; I251-G253 PolarHBondContact O-N 3.44Å; G253-A257 WeakPolarHBondContact O-CB 3.39Å; G253-A257 PolarHBondContact O-N 3.01Å; G253-A257 VanDerWaalsContact O-N 3.14Å
254	V	98.8	Very high	98.5	Very high	35 Å²	35	41.8 Å²	41.8	21%	0.212	20%	0.202	C	C	.	.	H	α-helix	trans	-63.3	-50.5	173.9	174.4	0	0	0	0	110.2	F87 F88 T91 M250 I251 G252 G256 A257 W258	F87-V254 HydrophobicContact CD1-CG2 3.54Å; F87-V254 HydrophobicContact CE1-CG2 3.68Å; F88-V254 HydrophobicContact CB-CG2 4.37Å; T91-V254 HydrophobicContact CG2-CG1 4.44Å; T91-V254 HydrophobicContact CG2-CG2 3.9Å; M250-V254 WeakPolarHBondContact O-CG2 3.43Å; M250-V254 PolarHBondContact O-N 3.24Å; I251-V254 PolarHBondContact O-N 2.89Å; G252-V254 PolarHBondContact O-N 3.37Å; V254-G256 VanDerWaalsContact C-N 3.32Å; V254-G256 PolarHBondContact O-N 3.43Å; V254-A257 PolarHBondContact O-N 3.02Å; V254-W258 WeakPolarHBondContact O-CB 3.22Å; V254-W258 PolarHBondContact O-N 3.48Å
255	L	98.8	Very high	98.4	Very high	81 Å²	81	41.8 Å²	41.8	42%	0.424	20%	0.201	S	C	.	.	H	α-helix	trans	-57	-45.3	179.8	-69.5	175.3	0	0	0	112	I164 L168 I251 G252 L259	I164-L255 HydrophobicContact CG2-CD1 4.14Å; L168-L255 HydrophobicContact CD1-CB 4.13Å; L168-L255 HydrophobicContact CG-CB 4.48Å; I251-L255 HydrophobicContact CG2-CD1 3.93Å; I251-L255 HydrophobicContact CG2-CG 4.43Å; I251-L255 WeakPolarHBondContact O-CG 3.35Å; I251-L255 PolarHBondContact O-N 3.04Å; G252-L255 PolarHBondContact O-N 2.88Å; L255-L259 VanDerWaalsContact O-CB 3.27Å; L255-L259 WeakPolarHBondContact O-CB 3.19Å; L255-L259 WeakPolarHBondContact O-CG 3.49Å; L255-L259 PolarHBondContact O-N 3.42Å
256	G	98.8	Very high	98.2	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-63.8	-50.1	-178.5	0	0	0	0	0	113.4	L168 L172 G252 V254 W258 L259 Y260	L168-G256 WeakPolarHBondContact O-CA 3.36Å; L172-G256 WeakPolarHBondContact CA-O 3.38Å; L172-G256 WeakPolarHBondContact CB-O 3.49Å; G252-G256 PolarHBondContact O-N 2.85Å; V254-G256 VanDerWaalsContact C-N 3.32Å; V254-G256 PolarHBondContact O-N 3.43Å; G256-W258 PolarHBondContact O-N 3.42Å; G256-L259 PolarHBondContact O-N 3.31Å; G256-Y260 PolarHBondContact O-N 2.97Å
257	A	98.6	Very high	98	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-65.2	-39.1	-179.5	0	0	0	0	0	112.2	F88 A175 G253 V254 Y260 E261	F88-A257 HydrophobicContact CB-CB 3.86Å; F88-A257 HydrophobicContact CD1-CB 4.19Å; F88-A257 HydrophobicContact CD2-CB 3.34Å; F88-A257 HydrophobicContact CE2-CB 3.91Å; F88-A257 HydrophobicContact CG-CB 3.55Å; A175-A257 HydrophobicContact CB-CB 4.32Å; G253-A257 WeakPolarHBondContact O-CB 3.39Å; G253-A257 PolarHBondContact O-N 3.01Å; G253-A257 VanDerWaalsContact O-N 3.14Å; V254-A257 PolarHBondContact O-N 3.02Å; A257-Y260 WeakPolarHBondContact O-CB 3.18Å; A257-Y260 PolarHBondContact O-N 3.15Å; A257-E261 PolarHBondContact O-N 3.09Å
258	W	98.6	Very high	97.7	Very high	81 Å²	81	49.6 Å²	49.6	31%	0.307	23%	0.234	S	C	.	.	H	α-helix	trans	-74.3	-35.7	178	-78.9	96.1	0	0	0	113.1	T91 Q92 V254 G256 Y260 E261 F262 F266	T91-W258 WeakPolarHBondContact O-CZ2 3.41Å; T91-W258 PolarHBondContact OG1-NE1 3.26Å; Q92-W258 HydrophobicContact CG-CZ2 4.11Å; V254-W258 WeakPolarHBondContact O-CB 3.22Å; V254-W258 PolarHBondContact O-N 3.48Å; G256-W258 PolarHBondContact O-N 3.42Å; W258-Y260 VanDerWaalsContact C-N 3.27Å; W258-Y260 PolarHBondContact O-N 2.92Å; W258-E261 PolarHBondContact O-N 3.33Å; W258-F262 HydrophobicContact CB-CD2 4.35Å; W258-F262 HydrophobicContact CB-CE2 4.19Å; W258-F262 AromaticContact CE3-CE2 3.95Å; W258-F262 HydrophobicContact CE3-CE2 3.95Å; W258-F262 HydrophobicContact CE3-CZ 4.14Å; W258-F262 WeakPolarHBondContact O-CD2 3.23Å; W258-F262 PolarHBondContact O-N 2.9Å; W258-F266 HydrophobicContact CZ3-CZ 4.38Å
259	L	98.7	Very high	97	Very high	64 Å²	64	57 Å²	57	34%	0.335	27%	0.268	S	S	.	.	H	α-helix	trans	-61	-38.9	171	-75.7	171.4	0	0	0	111.3	L168 L255 G256 F262 F263	L168-L259 HydrophobicContact CD1-CD1 3.99Å; L168-L259 HydrophobicContact CD2-CD1 4.44Å; L168-L259 HydrophobicContact CG-CD1 4.4Å; L255-L259 VanDerWaalsContact O-CB 3.27Å; L255-L259 WeakPolarHBondContact O-CB 3.19Å; L255-L259 WeakPolarHBondContact O-CG 3.49Å; L255-L259 PolarHBondContact O-N 3.42Å; G256-L259 PolarHBondContact O-N 3.31Å; L259-F262 PolarHBondContact O-N 3.48Å; L259-F263 HydrophobicContact CD2-CD2 3.93Å; L259-F263 HydrophobicContact CD2-CE2 3.56Å; L259-F263 WeakPolarHBondContact O-CB 3.5Å; L259-F263 WeakPolarHBondContact O-CD2 3.38Å; L259-F263 PolarHBondContact O-N 3.13Å
260	Y	98.6	Very high	95.9	Very high	5 Å²	5	61 Å²	61	2%	0.02	29%	0.29	C	S	.	.	H	α-helix	trans	-56.2	-50.9	171.7	169.4	-99.9	0	0	0	111.5	A175 A176 D179 N182 G256 A257 W258 I264 G265 I268	A175-Y260 HydrophobicContact CB-CD1 3.59Å; A175-Y260 HydrophobicContact CB-CE1 4.31Å; A175-Y260 HydrophobicContact CB-CG 3.87Å; A176-Y260 VanDerWaalsContact CA-CE2 3.47Å; A176-Y260 HydrophobicContact CB-CD2 3.74Å; A176-Y260 HydrophobicContact CB-CE2 3.49Å; A176-Y260 VanDerWaalsContact CB-CE2 3.49Å; D179-Y260 HydrophobicContact CB-CE1 4.11Å; D179-Y260 VanDerWaalsContact CB-OH 3.29Å; D179-Y260 WeakPolarHBondContact CB-OH 3.26Å; D179-Y260 VanDerWaalsContact CG-OH 3.28Å; D179-Y260 WeakPolarHBondContact OD2-CE1 3.16Å; D179-Y260 PolarHBondContact OD2-OH 3.07Å; N182-Y260 PolarHBondContact ND2-OH 3.03Å; G256-Y260 PolarHBondContact O-N 2.97Å; A257-Y260 WeakPolarHBondContact O-CB 3.18Å; A257-Y260 PolarHBondContact O-N 3.15Å; W258-Y260 VanDerWaalsContact C-N 3.27Å; W258-Y260 PolarHBondContact O-N 2.92Å; Y260-I264 HydrophobicContact CD2-CB 4Å; Y260-I264 HydrophobicContact CD2-CG1 4.47Å; Y260-I264 HydrophobicContact CD2-CG2 4.36Å; Y260-I264 HydrophobicContact CE2-CB 3.85Å; Y260-I264 HydrophobicContact CE2-CG2 3.72Å; Y260-I264 CarbonylContact O-C 3.34Å; Y260-I264 WeakPolarHBondContact O-CA 3.14Å; Y260-I264 WeakPolarHBondContact O-CB 3.41Å; Y260-I264 PolarHBondContact O-N 3.31Å; Y260-G265 PolarHBondContact O-N 3.15Å; Y260-I268 WeakPolarHBondContact OH-CD1 3.34Å
261	E	97.8	Very high	94.2	Very high	16 Å²	16	67.6 Å²	67.6	8%	0.075	32%	0.32	C	S	.	.	H	α-helix	trans	-61.6	-50.2	179.7	-61.4	-61.5	164.5	0	0	111.7	Q92 R181 A257 W258 F263 G265 F266	Q92-E261 PolarHBondContact NE2-OE1 2.91Å; Q92-E261 VanDerWaalsContact NE2-OE1 3.13Å; R181-E261 IonicContact NH2-OE2 2.76Å; R181-E261 PolarHBondContact NH2-OE2 3.37Å; R181-E261 VanDerWaalsContact NH2-OE2 3.14Å; A257-E261 PolarHBondContact O-N 3.09Å; W258-E261 PolarHBondContact O-N 3.33Å; E261-F263 VanDerWaalsContact C-N 3.35Å; E261-F263 PolarHBondContact O-N 2.89Å; E261-G265 PolarHBondContact O-N 3.5Å; E261-F266 HydrophobicContact CB-CD1 4.09Å; E261-F266 HydrophobicContact CB-CE1 3.71Å; E261-F266 HydrophobicContact CB-CE2 4.19Å; E261-F266 HydrophobicContact CB-CG 4.49Å; E261-F266 HydrophobicContact CB-CZ 3.77Å; E261-F266 HydrophobicContact CG-CE1 4.35Å; E261-F266 WeakPolarHBondContact O-CB 3.42Å; E261-F266 WeakPolarHBondContact O-CD2 3.34Å; E261-F266 VanDerWaalsContact O-CG 3.22Å; E261-F266 WeakPolarHBondContact O-CG 3.38Å; E261-F266 PolarHBondContact O-N 2.91Å
262	F	98.2	Very high	92.2	Very high	115 Å²	115	70 Å²	70	50%	0.504	33%	0.334	S	S	.	.	H	α-helix	trans	-62	-39.4	-176.6	-76.2	-58.8	0	0	0	113.5	W258 L259 F266 H267	W258-F262 HydrophobicContact CB-CD2 4.35Å; W258-F262 HydrophobicContact CB-CE2 4.19Å; W258-F262 AromaticContact CE3-CE2 3.95Å; W258-F262 HydrophobicContact CE3-CE2 3.95Å; W258-F262 HydrophobicContact CE3-CZ 4.14Å; W258-F262 WeakPolarHBondContact O-CD2 3.23Å; W258-F262 PolarHBondContact O-N 2.9Å; L259-F262 PolarHBondContact O-N 3.48Å; F262-F266 AromaticContact CD1-CD2 4Å; F262-F266 HydrophobicContact CD1-CD2 4Å; F262-F266 AromaticContact CD1-CE2 3.61Å; F262-F266 HydrophobicContact CD1-CE2 3.61Å; F262-F266 AromaticContact CE1-CE2 3.78Å; F262-F266 HydrophobicContact CE1-CE2 3.78Å; F262-F266 HydrophobicContact CG-CE2 4.36Å; F262-H267 PolarHBondContact O-CE1 3.28Å; F262-H267 PolarHBondContact O-ND1 3.42Å
263	F	97.9	Very high	90	Very high	147 Å²	147	72.2 Å²	72.2	65%	0.645	35%	0.352	S	S	*	.	H	α-helix	trans	-95.6	-27.2	-174.3	-74.7	-87.4	0	0	0	113.5	L259 E261	L259-F263 HydrophobicContact CD2-CD2 3.93Å; L259-F263 HydrophobicContact CD2-CE2 3.56Å; L259-F263 WeakPolarHBondContact O-CB 3.5Å; L259-F263 WeakPolarHBondContact O-CD2 3.38Å; L259-F263 PolarHBondContact O-N 3.13Å; E261-F263 VanDerWaalsContact C-N 3.35Å; E261-F263 PolarHBondContact O-N 2.89Å
264	I	96.9	Very high	87.9	Confident	89 Å²	89	76 Å²	76	46%	0.456	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.2	-61.8	-173.1	-52.8	-65.2	0	0	0	110.7	Y260 F266 H267 I268	Y260-I264 HydrophobicContact CD2-CB 4Å; Y260-I264 HydrophobicContact CD2-CG1 4.47Å; Y260-I264 HydrophobicContact CD2-CG2 4.36Å; Y260-I264 HydrophobicContact CE2-CB 3.85Å; Y260-I264 HydrophobicContact CE2-CG2 3.72Å; Y260-I264 CarbonylContact O-C 3.34Å; Y260-I264 WeakPolarHBondContact O-CA 3.14Å; Y260-I264 WeakPolarHBondContact O-CB 3.41Å; Y260-I264 PolarHBondContact O-N 3.31Å; I264-F266 PolarHBondContact O-N 2.85Å; I264-H267 WeakPolarHBondContact O-CA 3.39Å; I264-H267 WeakPolarHBondContact O-CB 3.42Å; I264-H267 PolarHBondContact O-N 2.98Å; I264-I268 HydrophobicContact CG2-CD1 4.31Å; I264-I268 HydrophobicContact CG2-CG1 4.4Å; I264-I268 PolarHBondContact O-N 3.47Å
265	G	95.1	Very high	85.8	Confident	0 Å²	0	76.9 Å²	76.9	0%	0	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-56.4	-42.9	-169.5	0	0	0	0	0	114.4	R181 Y260 E261 H267 I268	R181-G265 VanDerWaalsContact CZ-O 3.24Å; R181-G265 PolarHBondContact NH1-O 3.27Å; R181-G265 PolarHBondContact NH2-O 3.25Å; Y260-G265 PolarHBondContact O-N 3.15Å; E261-G265 PolarHBondContact O-N 3.5Å; G265-H267 PolarHBondContact O-N 3.41Å; G265-I268 PolarHBondContact O-N 3.49Å
266	F	95.1	Very high	83.9	Confident	116 Å²	116	78.4 Å²	78.4	51%	0.509	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-69.9	-11.8	177	-65.3	-19	0	0	0	114.2	W258 E261 F262 I264	W258-F266 HydrophobicContact CZ3-CZ 4.38Å; E261-F266 HydrophobicContact CB-CD1 4.09Å; E261-F266 HydrophobicContact CB-CE1 3.71Å; E261-F266 HydrophobicContact CB-CE2 4.19Å; E261-F266 HydrophobicContact CB-CG 4.49Å; E261-F266 HydrophobicContact CB-CZ 3.77Å; E261-F266 HydrophobicContact CG-CE1 4.35Å; E261-F266 WeakPolarHBondContact O-CB 3.42Å; E261-F266 WeakPolarHBondContact O-CD2 3.34Å; E261-F266 VanDerWaalsContact O-CG 3.22Å; E261-F266 WeakPolarHBondContact O-CG 3.38Å; E261-F266 PolarHBondContact O-N 2.91Å; F262-F266 AromaticContact CD1-CD2 4Å; F262-F266 HydrophobicContact CD1-CD2 4Å; F262-F266 AromaticContact CD1-CE2 3.61Å; F262-F266 HydrophobicContact CD1-CE2 3.61Å; F262-F266 AromaticContact CE1-CE2 3.78Å; F262-F266 HydrophobicContact CE1-CE2 3.78Å; F262-F266 HydrophobicContact CG-CE2 4.36Å; I264-F266 PolarHBondContact O-N 2.85Å
267	H	94.9	Very high	82.1	Confident	136 Å²	136	83.5 Å²	83.5	63%	0.63	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-107.1	-5.5	-177.3	-60.7	89.5	0	0	0	112.9	F262 I264 G265 Q269	F262-H267 PolarHBondContact O-CE1 3.28Å; F262-H267 PolarHBondContact O-ND1 3.42Å; I264-H267 WeakPolarHBondContact O-CA 3.39Å; I264-H267 WeakPolarHBondContact O-CB 3.42Å; I264-H267 PolarHBondContact O-N 2.98Å; G265-H267 PolarHBondContact O-N 3.41Å; H267-Q269 PolarHBondContact O-N 3.28Å
268	I	92.6	Very high	80.5	Confident	41 Å²	41	86 Å²	86	21%	0.21	44%	0.436	C	S	.	.	S	Bend	trans	-74.7	124.3	171.6	-52.6	169.3	0	0	0	107.8	R181 N182 Y260 I264 G265 D270	R181-I268 HydrophobicContact CB-CB 4.12Å; R181-I268 HydrophobicContact CB-CD1 3.99Å; R181-I268 HydrophobicContact CB-CG2 3.64Å; N182-I268 VanDerWaalsContact OD1-CD1 3.27Å; N182-I268 WeakPolarHBondContact OD1-CD1 3.47Å; Y260-I268 WeakPolarHBondContact OH-CD1 3.34Å; I264-I268 HydrophobicContact CG2-CD1 4.31Å; I264-I268 HydrophobicContact CG2-CG1 4.4Å; I264-I268 PolarHBondContact O-N 3.47Å; G265-I268 PolarHBondContact O-N 3.49Å; I268-D270 PolarHBondContact O-N 3.25Å
269	Q	84.3	Confident	79.2	Confident	157 Å²	157	87.6 Å²	87.6	73%	0.734	45%	0.446	S	S	*	.			trans	-71.9	126.8	177.3	-65.1	-179.3	-9.6	0	0	109.5	H267 E271	H267-Q269 PolarHBondContact O-N 3.28Å; Q269-E271 PolarHBondContact O-N 3Å
270	D	73.9	Confident	77.9	Confident	85 Å²	85	87.1 Å²	87.1	46%	0.455	45%	0.448	S	S	.	.			trans	-69.8	114.3	173.3	-67.2	-36.7	0	0	0	108.6	R181 I268 D272 A273 V274	R181-D270 WeakPolarHBondContact CD-OD1 3.38Å; I268-D270 PolarHBondContact O-N 3.25Å; D270-D272 PolarHBondContact O-N 2.87Å; D270-D272 VanDerWaalsContact O-N 3.15Å; D270-A273 HydrophobicContact CB-CB 3.96Å; D270-A273 PolarHBondContact O-N 2.96Å; D270-V274 PolarHBondContact O-N 2.97Å
271	E	64.1	Low	76.8	Confident	174 Å²	174	91.9 Å²	91.9	81%	0.813	47%	0.474	S	S	*	.	H	α-helix	trans	-55.2	-32.1	176.5	-70.7	-175.4	165.7	0	0	111.6	Q269 V274 S275	Q269-E271 PolarHBondContact O-N 3Å; E271-V274 PolarHBondContact O-N 3.23Å; E271-S275 PolarHBondContact O-N 3.48Å
272	D	56.2	Low	76	Confident	128 Å²	128	98 Å²	98	68%	0.684	50%	0.5	S	S	*	.	H	α-helix	trans	-66.5	-37.6	176	-66.8	-30	0	0	0	112.3	D270 S275 L276	D270-D272 PolarHBondContact O-N 2.87Å; D270-D272 VanDerWaalsContact O-N 3.15Å; D272-S275 PolarHBondContact O-N 3.37Å; D272-S275 PolarHBondContact O-OG 2.98Å; D272-L276 WeakPolarHBondContact O-CG 3.36Å; D272-L276 PolarHBondContact O-N 3.29Å
273	A	54	Low	75.3	Confident	47 Å²	47	98.3 Å²	98.3	39%	0.388	50%	0.504	S	S	.	.	H	α-helix	trans	-70.2	-39.7	177.9	0	0	0	0	0	111.6	D270 S275 L276 D277	D270-A273 HydrophobicContact CB-CB 3.96Å; D270-A273 PolarHBondContact O-N 2.96Å; A273-S275 VanDerWaalsContact C-N 3.31Å; A273-S275 PolarHBondContact O-N 3.32Å; A273-L276 PolarHBondContact O-N 3Å; A273-D277 PolarHBondContact O-N 2.9Å
274	V	53.2	Low	74.4	Confident	80 Å²	80	96 Å²	96	49%	0.485	50%	0.498	S	S	.	.	H	α-helix	trans	-65.4	-36.6	175.3	-179.7	0	0	0	0	111.1	D270 E271 S278	D270-V274 PolarHBondContact O-N 2.97Å; E271-V274 PolarHBondContact O-N 3.23Å; V274-S278 VanDerWaalsContact O-CB 3.23Å; V274-S278 WeakPolarHBondContact O-CB 3.32Å; V274-S278 PolarHBondContact O-N 2.96Å; V274-S278 PolarHBondContact O-OG 3.27Å
275	S	55.6	Low	73.6	Confident	52 Å²	52	98.4 Å²	98.4	36%	0.364	51%	0.505	S	S	.	.	H	α-helix	trans	-65.2	-42.8	177.4	77.1	0	0	0	0	112.2	E271 D272 A273 S278 E279	E271-S275 PolarHBondContact O-N 3.48Å; D272-S275 PolarHBondContact O-N 3.37Å; D272-S275 PolarHBondContact O-OG 2.98Å; A273-S275 VanDerWaalsContact C-N 3.31Å; A273-S275 PolarHBondContact O-N 3.32Å; S275-S278 PolarHBondContact O-N 3.12Å; S275-S278 PolarHBondContact O-OG 3.37Å; S275-E279 WeakPolarHBondContact O-CB 3.22Å; S275-E279 PolarHBondContact O-N 2.62Å
276	L	58	Low	73.2	Confident	113 Å²	113	102 Å²	102	59%	0.592	53%	0.527	S	S	*	.	H	α-helix	trans	-68.2	-41.8	178.5	-69.6	169.4	0	0	0	112.2	D272 A273 E279 S280	D272-L276 WeakPolarHBondContact O-CG 3.36Å; D272-L276 PolarHBondContact O-N 3.29Å; A273-L276 PolarHBondContact O-N 3Å; L276-E279 PolarHBondContact O-N 2.87Å; L276-S280 WeakPolarHBondContact O-CB 3.32Å; L276-S280 PolarHBondContact O-N 2.87Å; L276-S280 PolarHBondContact O-OG 3.32Å
277	D	61.8	Low	72.6	Confident	107 Å²	107	102.5 Å²	102.5	57%	0.572	53%	0.532	S	S	*	.	H	α-helix	trans	-65.1	-40.7	173.7	-81.5	-2.8	0	0	0	110.8	A273 E279 S280 D281	A273-D277 PolarHBondContact O-N 2.9Å; D277-E279 VanDerWaalsContact C-N 3.34Å; D277-E279 PolarHBondContact O-N 3.26Å; D277-S280 WeakPolarHBondContact CA-OG 3.48Å; D277-S280 PolarHBondContact O-OG 3.08Å; D277-D281 VanDerWaalsContact O-CB 3.23Å; D277-D281 WeakPolarHBondContact O-CB 3.45Å; D277-D281 PolarHBondContact O-N 2.87Å
278	S	65.5	Low	71.9	Confident	53 Å²	53	100.3 Å²	100.3	37%	0.371	52%	0.524	S	S	.	.	H	α-helix	trans	-68	-32.4	178.4	81.1	0	0	0	0	113.7	V274 S275 K282	V274-S278 VanDerWaalsContact O-CB 3.23Å; V274-S278 WeakPolarHBondContact O-CB 3.32Å; V274-S278 PolarHBondContact O-N 2.96Å; V274-S278 PolarHBondContact O-OG 3.27Å; S275-S278 PolarHBondContact O-N 3.12Å; S275-S278 PolarHBondContact O-OG 3.37Å; S278-K282 WeakPolarHBondContact O-CB 3.45Å; S278-K282 VanDerWaalsContact O-CG 3.25Å; S278-K282 WeakPolarHBondContact O-CG 3.42Å; S278-K282 PolarHBondContact O-N 3.05Å
279	E	70.8	Confident	71.4	Confident	114 Å²	114	102.4 Å²	102.4	53%	0.533	54%	0.536	S	S	.	.	H	α-helix	trans	-79.9	-39.5	179.9	-164.6	165.3	-156.2	0	0	111	S275 L276 D277 K282 Q283	S275-E279 WeakPolarHBondContact O-CB 3.22Å; S275-E279 PolarHBondContact O-N 2.62Å; L276-E279 PolarHBondContact O-N 2.87Å; D277-E279 VanDerWaalsContact C-N 3.34Å; D277-E279 PolarHBondContact O-N 3.26Å; E279-K282 PolarHBondContact O-N 3.49Å; E279-Q283 WeakPolarHBondContact O-CG 3.27Å; E279-Q283 PolarHBondContact O-N 3.38Å
280	S	71.6	Confident	71.5	Confident	54 Å²	54	99.2 Å²	99.2	38%	0.378	52%	0.524	S	S	.	.	H	α-helix	trans	-65.2	-40.3	171	55.4	0	0	0	0	112.2	L276 D277 K282 Q283 L284	L276-S280 WeakPolarHBondContact O-CB 3.32Å; L276-S280 PolarHBondContact O-N 2.87Å; L276-S280 PolarHBondContact O-OG 3.32Å; D277-S280 WeakPolarHBondContact CA-OG 3.48Å; D277-S280 PolarHBondContact O-OG 3.08Å; S280-K282 PolarHBondContact O-N 3.49Å; S280-Q283 PolarHBondContact O-N 3.46Å; S280-L284 WeakPolarHBondContact O-CB 3.39Å; S280-L284 PolarHBondContact O-N 3.37Å
281	D	76	Confident	71.6	Confident	105 Å²	105	101.8 Å²	101.8	56%	0.561	54%	0.535	S	S	*	.	H	α-helix	trans	-63.3	-39.8	172.9	-84.2	-16	0	0	0	112.2	D277 L284 K285	D277-D281 VanDerWaalsContact O-CB 3.23Å; D277-D281 WeakPolarHBondContact O-CB 3.45Å; D277-D281 PolarHBondContact O-N 2.87Å; D281-L284 PolarHBondContact O-N 3.02Å; D281-K285 VanDerWaalsContact O-CB 3.3Å; D281-K285 WeakPolarHBondContact O-CB 3.32Å; D281-K285 PolarHBondContact O-N 3.36Å
282	K	81.1	Confident	72.2	Confident	144 Å²	144	96.6 Å²	96.6	63%	0.626	52%	0.515	S	S	*	.	H	α-helix	trans	-64.4	-42	173.9	-81.5	172.5	-176.2	170.9	0	112	S278 E279 S280 K285 T286	S278-K282 WeakPolarHBondContact O-CB 3.45Å; S278-K282 VanDerWaalsContact O-CG 3.25Å; S278-K282 WeakPolarHBondContact O-CG 3.42Å; S278-K282 PolarHBondContact O-N 3.05Å; E279-K282 PolarHBondContact O-N 3.49Å; S280-K282 PolarHBondContact O-N 3.49Å; K282-K285 PolarHBondContact O-N 2.83Å; K282-T286 WeakPolarHBondContact O-CB 3.02Å; K282-T286 PolarHBondContact O-N 3.39Å; K282-T286 PolarHBondContact O-OG1 3.35Å
283	Q	83.4	Confident	73.2	Confident	123 Å²	123	94.8 Å²	94.8	58%	0.575	51%	0.505	S	S	*	.	H	α-helix	trans	-64.8	-44.3	177	-75.4	178.3	0.5	0	0	111.3	E279 S280 K285 T286 M287	E279-Q283 WeakPolarHBondContact O-CG 3.27Å; E279-Q283 PolarHBondContact O-N 3.38Å; S280-Q283 PolarHBondContact O-N 3.46Å; Q283-K285 PolarHBondContact O-N 3.15Å; Q283-T286 PolarHBondContact O-N 3.42Å; Q283-M287 WeakPolarHBondContact O-CG 3.42Å; Q283-M287 PolarHBondContact O-N 2.83Å
284	L	78.2	Confident	74.2	Confident	99 Å²	99	97.4 Å²	97.4	52%	0.518	51%	0.512	S	S	.	.	H	α-helix	trans	-62.2	-44.5	177.4	-172	69	0	0	0	111.4	S280 D281 T286 M287 I288	S280-L284 WeakPolarHBondContact O-CB 3.39Å; S280-L284 PolarHBondContact O-N 3.37Å; D281-L284 PolarHBondContact O-N 3.02Å; L284-T286 VanDerWaalsContact C-N 3.34Å; L284-T286 PolarHBondContact O-N 3.42Å; L284-M287 WeakPolarHBondContact O-CB 3.47Å; L284-M287 PolarHBondContact O-N 2.85Å; L284-I288 HydrophobicContact CG-CD1 4.19Å; L284-I288 WeakPolarHBondContact O-CG1 3.33Å; L284-I288 PolarHBondContact O-N 3.3Å
285	K	80	Confident	75	Confident	138 Å²	138	98.8 Å²	98.8	60%	0.6	51%	0.513	S	S	*	.	H	α-helix	trans	-61.1	-43.3	176.3	-166.5	174.7	-177.4	-178.1	0	112	D281 K282 Q283 M287 I288 D289	D281-K285 VanDerWaalsContact O-CB 3.3Å; D281-K285 WeakPolarHBondContact O-CB 3.32Å; D281-K285 PolarHBondContact O-N 3.36Å; K282-K285 PolarHBondContact O-N 2.83Å; Q283-K285 PolarHBondContact O-N 3.15Å; K285-M287 VanDerWaalsContact C-N 3.32Å; K285-M287 PolarHBondContact O-N 3.49Å; K285-I288 PolarHBondContact O-N 2.84Å; K285-D289 VanDerWaalsContact O-CG 3.28Å; K285-D289 PolarHBondContact O-N 3.28Å
286	T	86.6	Confident	75.6	Confident	77 Å²	77	102.2 Å²	102.2	47%	0.472	53%	0.527	S	S	.	.	H	α-helix	trans	-61.7	-39.6	175.7	-50.9	0	0	0	0	111.9	K282 Q283 L284 N290	K282-T286 WeakPolarHBondContact O-CB 3.02Å; K282-T286 PolarHBondContact O-N 3.39Å; K282-T286 PolarHBondContact O-OG1 3.35Å; Q283-T286 PolarHBondContact O-N 3.42Å; L284-T286 VanDerWaalsContact C-N 3.34Å; L284-T286 PolarHBondContact O-N 3.42Å; T286-N290 WeakPolarHBondContact O-CB 3.29Å; T286-N290 VanDerWaalsContact O-CG 3.23Å; T286-N290 PolarHBondContact O-N 2.91Å; T286-N290 VanDerWaalsContact O-N 3.08Å; T286-N290 PolarHBondContact O-ND2 3.01Å
287	M	82.3	Confident	76.2	Confident	126 Å²	126	104.3 Å²	104.3	62%	0.621	53%	0.534	S	S	*	.	H	α-helix	trans	-65.3	-41.8	175.9	-75.8	-178.1	158.2	0	0	112.4	Q283 L284 K285 N290 M291	Q283-M287 WeakPolarHBondContact O-CG 3.42Å; Q283-M287 PolarHBondContact O-N 2.83Å; L284-M287 WeakPolarHBondContact O-CB 3.47Å; L284-M287 PolarHBondContact O-N 2.85Å; K285-M287 VanDerWaalsContact C-N 3.32Å; K285-M287 PolarHBondContact O-N 3.49Å; M287-N290 PolarHBondContact O-N 3.45Å; M287-M291 WeakPolarHBondContact O-CG 3.29Å; M287-M291 PolarHBondContact O-N 3.46Å
288	I	80.7	Confident	75.9	Confident	90 Å²	90	104.6 Å²	104.6	46%	0.462	54%	0.535	S	S	.	.	H	α-helix	trans	-64.3	-47.1	177.2	-68.8	167.1	0	0	0	110.5	L284 K285 N290 M291 V292	L284-I288 HydrophobicContact CG-CD1 4.19Å; L284-I288 WeakPolarHBondContact O-CG1 3.33Å; L284-I288 PolarHBondContact O-N 3.3Å; K285-I288 PolarHBondContact O-N 2.84Å; I288-N290 VanDerWaalsContact C-N 3.3Å; I288-N290 PolarHBondContact O-N 3.35Å; I288-M291 PolarHBondContact O-N 3.15Å; I288-M291 VanDerWaalsContact O-N 3.09Å; I288-V292 HydrophobicContact CG2-CG2 4.48Å; I288-V292 WeakPolarHBondContact O-CG2 3.3Å; I288-V292 PolarHBondContact O-N 3.36Å
289	D	83.1	Confident	75.6	Confident	85 Å²	85	107.1 Å²	107.1	46%	0.455	55%	0.55	S	S	.	*	H	α-helix	trans	-59.6	-42.5	179.2	-68.7	-19.7	0	0	0	110.9	K285 M291 V292 D293	K285-D289 VanDerWaalsContact O-CG 3.28Å; K285-D289 PolarHBondContact O-N 3.28Å; D289-M291 PolarHBondContact O-N 3.35Å; D289-V292 PolarHBondContact O-N 3.39Å; D289-D293 PolarHBondContact O-N 3.48Å
290	N	84.8	Confident	74.9	Confident	89 Å²	89	109.6 Å²	109.6	48%	0.476	56%	0.561	S	S	.	*	H	α-helix	trans	-64.2	-37.2	174.6	-72	-26.2	0	0	0	113.1	T286 M287 I288 D293 I294	T286-N290 WeakPolarHBondContact O-CB 3.29Å; T286-N290 VanDerWaalsContact O-CG 3.23Å; T286-N290 PolarHBondContact O-N 2.91Å; T286-N290 VanDerWaalsContact O-N 3.08Å; T286-N290 PolarHBondContact O-ND2 3.01Å; M287-N290 PolarHBondContact O-N 3.45Å; I288-N290 VanDerWaalsContact C-N 3.3Å; I288-N290 PolarHBondContact O-N 3.35Å; N290-D293 PolarHBondContact O-N 2.96Å; N290-I294 WeakPolarHBondContact O-CD1 3.46Å; N290-I294 VanDerWaalsContact O-CG1 3.23Å; N290-I294 WeakPolarHBondContact O-CG1 3.13Å; N290-I294 PolarHBondContact O-N 3.38Å
291	M	76	Confident	73.9	Confident	139 Å²	139	117.2 Å²	117.2	69%	0.685	58%	0.584	S	S	*	*	H	α-helix	trans	-67.3	-39.7	176.8	-78.7	-173.4	163.6	0	0	111.9	M287 I288 D289 I294 E295	M287-M291 WeakPolarHBondContact O-CG 3.29Å; M287-M291 PolarHBondContact O-N 3.46Å; I288-M291 PolarHBondContact O-N 3.15Å; I288-M291 VanDerWaalsContact O-N 3.09Å; D289-M291 PolarHBondContact O-N 3.35Å; M291-I294 PolarHBondContact O-N 3.25Å; M291-E295 PolarHBondContact O-N 3.5Å
292	V	78.1	Confident	72.7	Confident	66 Å²	66	118.5 Å²	118.5	40%	0.4	60%	0.595	S	S	.	*	H	α-helix	trans	-65.1	-40.8	175.4	173	0	0	0	0	110.9	I288 D289 E295 N296	I288-V292 HydrophobicContact CG2-CG2 4.48Å; I288-V292 WeakPolarHBondContact O-CG2 3.3Å; I288-V292 PolarHBondContact O-N 3.36Å; D289-V292 PolarHBondContact O-N 3.39Å; V292-E295 PolarHBondContact O-N 2.7Å; V292-N296 VanDerWaalsContact O-CG 3.28Å; V292-N296 PolarHBondContact O-N 3.33Å; V292-N296 PolarHBondContact O-ND2 3.29Å; V292-N296 VanDerWaalsContact O-ND2 3.09Å
293	D	76.5	Confident	71.4	Confident	90 Å²	90	116.4 Å²	116.4	48%	0.481	59%	0.591	S	S	.	*	H	α-helix	trans	-64.2	-39	175	-83.6	-14.5	0	0	0	112.5	D289 N290 N296 Q297	D289-D293 PolarHBondContact O-N 3.48Å; N290-D293 PolarHBondContact O-N 2.96Å; D293-N296 PolarHBondContact O-N 3.39Å; D293-Q297 VanDerWaalsContact O-CG 3.29Å; D293-Q297 WeakPolarHBondContact O-CG 3.43Å; D293-Q297 PolarHBondContact O-N 2.83Å; D293-Q297 VanDerWaalsContact O-N 3.16Å
294	I	74.7	Confident	70	Confident	102 Å²	102	118.4 Å²	118.4	52%	0.523	60%	0.598	S	S	.	*	H	α-helix	trans	-65.1	-43.8	174.1	-69.3	164.1	0	0	0	110.6	N290 M291 N296 Q297 L298	N290-I294 WeakPolarHBondContact O-CD1 3.46Å; N290-I294 VanDerWaalsContact O-CG1 3.23Å; N290-I294 WeakPolarHBondContact O-CG1 3.13Å; N290-I294 PolarHBondContact O-N 3.38Å; M291-I294 PolarHBondContact O-N 3.25Å; I294-N296 VanDerWaalsContact C-N 3.29Å; I294-N296 PolarHBondContact O-N 3.36Å; I294-Q297 PolarHBondContact O-N 3.09Å; I294-Q297 VanDerWaalsContact O-N 3.1Å; I294-L298 WeakPolarHBondContact O-CG 3.36Å; I294-L298 PolarHBondContact O-N 3.28Å; I294-L298 VanDerWaalsContact O-N 3.12Å
295	E	69.4	Low	68.8	Low	109 Å²	109	121 Å²	121	51%	0.509	61%	0.605	S	S	.	*	H	α-helix	trans	-59.2	-40.3	176.6	-169.2	174.9	-174.7	0	0	111.8	M291 V292 Q297 L298	M291-E295 PolarHBondContact O-N 3.5Å; V292-E295 PolarHBondContact O-N 2.7Å; E295-Q297 VanDerWaalsContact C-N 3.29Å; E295-Q297 PolarHBondContact O-N 3.15Å; E295-L298 PolarHBondContact O-N 3.15Å
296	N	69.9	Low	67.6	Low	124 Å²	124	121.4 Å²	121.4	66%	0.663	61%	0.609	S	S	*	*	H	α-helix	trans	-71.9	-18.1	176.8	-70.8	-36.6	0	0	0	114.2	V292 D293 I294	V292-N296 VanDerWaalsContact O-CG 3.28Å; V292-N296 PolarHBondContact O-N 3.33Å; V292-N296 PolarHBondContact O-ND2 3.29Å; V292-N296 VanDerWaalsContact O-ND2 3.09Å; D293-N296 PolarHBondContact O-N 3.39Å; I294-N296 VanDerWaalsContact C-N 3.29Å; I294-N296 PolarHBondContact O-N 3.36Å
297	Q	68.8	Low	66	Low	157 Å²	157	122.6 Å²	122.6	73%	0.734	61%	0.612	S	S	*	*	H	α-helix	trans	-96.4	-11.3	178	-72.3	177.5	20.5	0	0	113.4	D293 I294 E295	D293-Q297 VanDerWaalsContact O-CG 3.29Å; D293-Q297 WeakPolarHBondContact O-CG 3.43Å; D293-Q297 PolarHBondContact O-N 2.83Å; D293-Q297 VanDerWaalsContact O-N 3.16Å; I294-Q297 PolarHBondContact O-N 3.09Å; I294-Q297 VanDerWaalsContact O-N 3.1Å; E295-Q297 VanDerWaalsContact C-N 3.29Å; E295-Q297 PolarHBondContact O-N 3.15Å
298	L	57.2	Low	64.7	Low	113 Å²	113	119.5 Å²	119.5	59%	0.592	60%	0.603	S	S	*	*	S	Bend	trans	-71.8	128.1	174	-73.7	166.7	0	0	0	109.1	I294 E295 E300	I294-L298 WeakPolarHBondContact O-CG 3.36Å; I294-L298 PolarHBondContact O-N 3.28Å; I294-L298 VanDerWaalsContact O-N 3.12Å; E295-L298 PolarHBondContact O-N 3.15Å; L298-E300 PolarHBondContact O-N 2.85Å
299	P	59	Low	63.5	Low	106 Å²	106	119.7 Å²	119.7	69%	0.688	60%	0.604	S	S	*	*			trans	-59	140.2	172.6	23.6	-30.4	0	0	0	108.8	Y301	P299-Y301 PolarHBondContact O-N 3.13Å
300	E	55.5	Low	62.2	Low	165 Å²	165	121 Å²	121	77%	0.771	61%	0.61	S	S	*	*			trans	-57	87.7	175.9	-92.1	-167.8	147.3	0	0	109.9	L298 K304	L298-E300 PolarHBondContact O-N 2.85Å; E300-K304 IonicContact OE1-NZ 2.7Å; E300-K304 PolarHBondContact OE1-NZ 3.31Å
301	Y	50.2	Low	60.8	Low	215 Å²	215	119.6 Å²	119.6	84%	0.843	61%	0.611	S	S	*	*			trans	-106.8	111.3	162.1	-125.9	-91.2	0	0	0	105.9	P299 D303	P299-Y301 PolarHBondContact O-N 3.13Å; Y301-D303 PolarHBondContact O-N 2.94Å
302	T	50.4	Low	59.9	Low	132 Å²	132	116.1 Å²	116.1	81%	0.81	60%	0.6	S	S	*	*	S	Bend	trans	-29	114.4	171.7	-33.9	0	0	0	0	110.2
303	D	54	Low	58.8	Low	100 Å²	100	117.8 Å²	117.8	54%	0.535	61%	0.606	S	S	.	*				-164.6	100.2	82.6	-159.4	-4.6	0	0	0	110	Y301 K305	Y301-D303 PolarHBondContact O-N 2.94Å; D303-K305 PolarHBondContact O-N 3.25Å
304	K	54	Low	57.6	Low	165 Å²	165	121 Å²	121	72%	0.717	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	1.3	-176.4	-75.8	-179.9	179.2	167.9	0	114.6	E300	E300-K304 IonicContact OE1-NZ 2.7Å; E300-K304 PolarHBondContact OE1-NZ 3.31Å
305	K	53.4	Low	56.6	Low	153 Å²	153	124.1 Å²	124.1	67%	0.665	63%	0.63	S	S	*	*	H	α-helix	trans	-91.1	-27.1	-174.4	-153.2	176	-177.4	-175.9	0	114	D303 S308	D303-K305 PolarHBondContact O-N 3.25Å; K305-S308 PolarHBondContact O-OG 3.37Å
306	Q	54.2	Low	55.4	Low	147 Å²	147	122.7 Å²	122.7	69%	0.687	63%	0.626	S	S	*	*	H	α-helix	trans	-81.4	-28	-177.8	-79.2	-175.2	-23.8	0	0	113.9
307	L	53.1	Low	54.6	Low	102 Å²	102	122.1 Å²	122.1	53%	0.534	63%	0.629	S	S	.	*	H	α-helix	trans	-83.1	-33	-179.7	-76.6	166.1	0	0	0	112.9	D309 I310 A311	L307-D309 PolarHBondContact O-N 3.1Å; L307-I310 PolarHBondContact O-N 3.12Å; L307-A311 PolarHBondContact O-N 3.31Å
308	S	56.3	Low	53.6	Low	61 Å²	61	118.9 Å²	118.9	43%	0.427	62%	0.624	S	S	.	*	H	α-helix	trans	-62.9	-31.8	173.8	58.7	0	0	0	0	112.8	K305 A311 S312	K305-S308 PolarHBondContact O-OG 3.37Å; S308-A311 PolarHBondContact O-N 2.75Å; S308-S312 WeakPolarHBondContact O-CB 3.48Å; S308-S312 PolarHBondContact O-N 3.24Å; S308-S312 VanDerWaalsContact O-N 3.11Å
309	D	55.6	Low	53.3	Low	93 Å²	93	119 Å²	119	50%	0.497	63%	0.625	S	S	.	*	H	α-helix	trans	-69.9	-34.9	-179.8	-70.6	-9.4	0	0	0	111.2	L307 S312 I313	L307-D309 PolarHBondContact O-N 3.1Å; D309-S312 PolarHBondContact O-OG 3.02Å; D309-I313 WeakPolarHBondContact O-CG1 3.13Å
310	I	55.1	Low	52.9	Low	112 Å²	112	123.8 Å²	123.8	57%	0.574	63%	0.629	S	S	*	*	H	α-helix	trans	-72	-40.4	176.4	-62.1	173.3	0	0	0	111.3	L307 S312 I313	L307-I310 PolarHBondContact O-N 3.12Å; I310-S312 VanDerWaalsContact C-N 3.3Å; I310-S312 PolarHBondContact O-N 3.36Å; I310-I313 PolarHBondContact O-N 3.11Å
311	A	55.1	Low	52.4	Low	61 Å²	61	123.5 Å²	123.5	50%	0.504	63%	0.633	S	S	.	*	H	α-helix	trans	-66.4	-31.7	177	0	0	0	0	0	112.7	L307 S308 I313 H314	L307-A311 PolarHBondContact O-N 3.31Å; S308-A311 PolarHBondContact O-N 2.75Å; A311-I313 VanDerWaalsContact C-N 3.34Å; A311-I313 PolarHBondContact O-N 2.99Å; A311-H314 PolarHBondContact O-N 3.29Å
312	S	56.7	Low	51.9	Low	65 Å²	65	124.4 Å²	124.4	46%	0.455	65%	0.65	S	S	.	*	H	α-helix	trans	-71.4	-24.6	179	78	0	0	0	0	114.1	S308 D309 I310 H314 Q315	S308-S312 WeakPolarHBondContact O-CB 3.48Å; S308-S312 PolarHBondContact O-N 3.24Å; S308-S312 VanDerWaalsContact O-N 3.11Å; D309-S312 PolarHBondContact O-OG 3.02Å; I310-S312 VanDerWaalsContact C-N 3.3Å; I310-S312 PolarHBondContact O-N 3.36Å; S312-H314 VanDerWaalsContact C-N 3.31Å; S312-H314 PolarHBondContact O-N 2.86Å; S312-Q315 PolarHBondContact O-N 2.64Å
313	I	55.1	Low	52	Low	101 Å²	101	124.1 Å²	124.1	52%	0.518	64%	0.642	S	S	.	*	H	α-helix	trans	-69	-30.8	178.3	-69	166.7	0	0	0	111.1	D309 I310 A311	D309-I313 WeakPolarHBondContact O-CG1 3.13Å; I310-I313 PolarHBondContact O-N 3.11Å; A311-I313 VanDerWaalsContact C-N 3.34Å; A311-I313 PolarHBondContact O-N 2.99Å
314	H	52.5	Low	51.9	Low	157 Å²	157	125.3 Å²	125.3	73%	0.727	65%	0.648	S	S	*	*	H	α-helix	trans	-85.8	-15.4	-179.5	-95.2	-55.1	0	0	0	115.1	A311 S312	A311-H314 PolarHBondContact O-N 3.29Å; S312-H314 VanDerWaalsContact C-N 3.31Å; S312-H314 PolarHBondContact O-N 2.86Å
315	Q	52.5	Low	51.8	Low	169 Å²	169	123.1 Å²	123.1	79%	0.79	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	-1.6	176.5	-69	-171.9	-4.5	0	0	113.6	S312 P317	S312-Q315 PolarHBondContact O-N 2.64Å; Q315-P317 WeakPolarHBondContact O-CD 3.24Å
316	N	45.9	Very low	51.7	Low	79 Å²	79	121.4 Å²	121.4	42%	0.422	64%	0.642	S	S	.	*			trans	-100.2	110	178.8	-162.9	-21.7	0	0	0	111.5	S318	N316-S318 VanDerWaalsContact CG-OG 3.31Å; N316-S318 PolarHBondContact O-N 3.19Å; N316-S318 PolarHBondContact OD1-N 2.83Å; N316-S318 PolarHBondContact OD1-OG 3.33Å
317	P	52.2	Low	51.5	Low	111 Å²	111	119.8 Å²	119.8	72%	0.721	64%	0.64	S	S	*	*	G	3₁₀ helix	trans	-65.3	-12.3	-176.9	-18.8	31.3	0	0	0	114.7	Q315 L319	Q315-P317 WeakPolarHBondContact O-CD 3.24Å; P317-L319 VanDerWaalsContact C-N 3.35Å; P317-L319 PolarHBondContact O-N 3.49Å
318	S	48.3	Very low	51.4	Low	90 Å²	90	120.9 Å²	120.9	63%	0.629	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-79.8	-7.6	-174	60	0	0	0	0	115.3	N316	N316-S318 VanDerWaalsContact CG-OG 3.31Å; N316-S318 PolarHBondContact O-N 3.19Å; N316-S318 PolarHBondContact OD1-N 2.83Å; N316-S318 PolarHBondContact OD1-OG 3.33Å
319	L	50.4	Low	51.1	Low	116 Å²	116	125.2 Å²	125.2	61%	0.607	66%	0.662	S	S	*	*	G	3₁₀ helix	trans	-106.3	8.3	-177.5	-73	167.2	0	0	0	114.5	P317 N321	P317-L319 VanDerWaalsContact C-N 3.35Å; P317-L319 PolarHBondContact O-N 3.49Å; L319-N321 VanDerWaalsContact C-N 3.31Å; L319-N321 PolarHBondContact O-N 3.37Å
320	R	51.3	Low	50.7	Low	205 Å²	205	127.7 Å²	127.7	77%	0.774	68%	0.675	S	S	*	*	S	Bend	trans	-80.1	1.7	179.5	-78.8	-172	-178.1	-168.4	-0.3	115.6
321	N	43.6	Very low	50.3	Low	159 Å²	159	129 Å²	129	85%	0.85	68%	0.684	S	S	*	*			trans	-122.8	66.4	-176.3	-75.2	-18.3	0	0	0	112.9	L319	L319-N321 VanDerWaalsContact C-N 3.31Å; L319-N321 PolarHBondContact O-N 3.37Å
322	I	40.7	Very low	49.9	Very low	235 Å²	235	135.2 Å²	135.2	100%	1.205	70%	0.7	S	S	*	*			trans	-131	0	152.1	-59.5	-179	0	0	0	107.5

Retrieved 322 of 322 residues in 165.9 ms (Link to these results)

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