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Cytochrome b

Component of the ubiquinol-cytochrome c reductase complex (complex III or cytochrome b-c1 complex) that is part of the mitochondrial respiratory chain. The b-c1 complex mediates electron transfer from ubiquinol to cytochrome c. Contributes to the generation of a proton gradient across the mitochondrial membrane that is then used for ATP synthesis.

AlphaFold DB , UniProt , Accession A0A059RQQ5, Species HUMAN (Homo sapiens, Human), Gene CYTB, Length 380 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	80.6	Confident	91.2	Very high	237 Å²	237	105.4 Å²	105.4	100%	1.167	55%	0.552	S	S	*	*				0	129.7	0	-155.6	168.8	-177	0	0	107.5
2	A	85.7	Confident	91.4	Very high	53 Å²	53	104.8 Å²	104.8	44%	0.438	54%	0.542	S	S	.	.			trans	-65.9	147	178.3	0	0	0	0	0	110	I7	A2-I7 HydrophobicContact CB-CD1 3.93Å; A2-I7 HydrophobicContact CB-CG1 3.89Å; A2-I7 WeakPolarHBondContact O-CD1 3.21Å
3	P	92	Very high	91.5	Very high	67 Å²	67	106.2 Å²	106.2	44%	0.435	55%	0.55	S	S	.	.			trans	-64.7	149.3	179.4	28.1	-35.2	0	0	0	110.3	R5 K6 I7	P3-R5 HydrophobicContact CB-CG 4.17Å; P3-R5 HydrophobicContact CG-CG 4.08Å; P3-R5 PolarHBondContact O-N 2.89Å; P3-K6 HydrophobicContact CG-CB 4.36Å; P3-K6 HydrophobicContact CG-CD 3.99Å; P3-K6 HydrophobicContact CG-CG 4Å; P3-K6 PolarHBondContact O-N 3.33Å; P3-I7 PolarHBondContact O-N 3.5Å
4	M	92.5	Very high	91.6	Very high	129 Å²	129	105.4 Å²	105.4	64%	0.635	55%	0.545	S	S	*	.	H	α-helix	trans	-54	-32.8	-177.4	-170.1	162.1	153.6	0	0	112.8	K6 I7 N8 M11	M4-K6 PolarHBondContact O-N 2.97Å; M4-K6 VanDerWaalsContact O-N 3.14Å; M4-I7 PolarHBondContact O-N 3.14Å; M4-I7 VanDerWaalsContact O-N 3.1Å; M4-N8 HydrophobicContact CG-CB 4.37Å; M4-N8 WeakPolarHBondContact O-CB 3.45Å; M4-N8 PolarHBondContact O-N 3.27Å; M4-M11 HydrophobicContact CE-CE 4.09Å; M4-M11 HydrophobicContact CE-SD 4.29Å; M4-M11 HydrophobicContact CG-SD 4.08Å
5	R	93.9	Very high	91.8	Very high	99 Å²	99	98.5 Å²	98.5	37%	0.374	51%	0.509	S	S	.	.	H	α-helix	trans	-59.9	-20.4	174.7	78.3	-175.9	-161.3	-168.6	4.6	115.1	P3 M11 K12 N15 D20	P3-R5 HydrophobicContact CB-CG 4.17Å; P3-R5 HydrophobicContact CG-CG 4.08Å; P3-R5 PolarHBondContact O-N 2.89Å; R5-M11 CarbonylContact O-C 2.9Å; R5-K12 VanDerWaalsContact O-CA 3.32Å; R5-K12 WeakPolarHBondContact O-CA 3.4Å; R5-K12 PolarHBondContact O-N 3.22Å; R5-N15 HydrophobicContact CB-CB 4.42Å; R5-N15 WeakPolarHBondContact CD-OD1 3.38Å; R5-N15 WeakPolarHBondContact CG-OD1 3.35Å; R5-N15 PolarHBondContact NE-OD1 3.44Å; R5-N15 VanDerWaalsContact O-CB 3.28Å; R5-N15 WeakPolarHBondContact O-CB 3.38Å; R5-D20 IonicContact CZ-OD1 3.6Å; R5-D20 IonicContact CZ-OD2 3.98Å; R5-D20 IonicContact NE-OD2 3.83Å; R5-D20 IonicContact NH2-OD1 2.76Å; R5-D20 PolarHBondContact NH2-OD1 3.07Å; R5-D20 IonicContact NH2-OD2 3.32Å; R5-D20 PolarHBondContact NH2-OD2 3.01Å
6	K	93.1	Very high	91.9	Very high	99 Å²	99	98.6 Å²	98.6	43%	0.43	51%	0.506	S	S	.	.	H	α-helix	trans	-101.5	-15.5	177.3	-67.3	-173.1	178.4	-172.4	0	113.2	P3 M4 D20	P3-K6 HydrophobicContact CG-CB 4.36Å; P3-K6 HydrophobicContact CG-CD 3.99Å; P3-K6 HydrophobicContact CG-CG 4Å; P3-K6 PolarHBondContact O-N 3.33Å; M4-K6 PolarHBondContact O-N 2.97Å; M4-K6 VanDerWaalsContact O-N 3.14Å; K6-D20 WeakPolarHBondContact CE-OD2 3.45Å; K6-D20 IonicContact NZ-OD2 3.43Å; K6-D20 PolarHBondContact NZ-OD2 3.08Å
7	I	93.8	Very high	91.9	Very high	101 Å²	101	94 Å²	94	52%	0.518	49%	0.485	S	S	.	.	H	α-helix	trans	-101.1	-48.5	-175.2	-58	175	0	0	0	110.9	A2 P3 M4	A2-I7 HydrophobicContact CB-CD1 3.93Å; A2-I7 HydrophobicContact CB-CG1 3.89Å; A2-I7 WeakPolarHBondContact O-CD1 3.21Å; P3-I7 PolarHBondContact O-N 3.5Å; M4-I7 PolarHBondContact O-N 3.14Å; M4-I7 VanDerWaalsContact O-N 3.1Å
8	N	95.1	Very high	91.9	Very high	52 Å²	52	95.4 Å²	95.4	28%	0.278	49%	0.487	S	S	.	.	S	Bend	trans	-64.7	128.1	-176.3	175.6	-79.2	0	0	0	110.2	M4 L10 M11 K12	M4-N8 HydrophobicContact CG-CB 4.37Å; M4-N8 WeakPolarHBondContact O-CB 3.45Å; M4-N8 PolarHBondContact O-N 3.27Å; N8-L10 VanDerWaalsContact C-N 3.3Å; N8-L10 PolarHBondContact O-N 3.41Å; N8-L10 PolarHBondContact OD1-N 3.11Å; N8-M11 HydrophobicContact CB-CB 4.05Å; N8-M11 HydrophobicContact CB-CG 4.09Å; N8-M11 HydrophobicContact CB-SD 4.2Å; N8-M11 PolarHBondContact O-N 3.2Å; N8-M11 PolarHBondContact OD1-N 2.93Å; N8-K12 WeakPolarHBondContact O-CB 3.35Å; N8-K12 PolarHBondContact O-N 3.29Å
9	P	92.9	Very high	92.1	Very high	108 Å²	108	92.8 Å²	92.8	70%	0.701	47%	0.474	S	S	*	.	H	α-helix	trans	-55.6	-38.8	-173.6	-28.9	35.3	0	0	0	114.8
10	L	91.3	Very high	92.3	Very high	133 Å²	133	89.9 Å²	89.9	70%	0.696	46%	0.46	S	S	*	.	H	α-helix	trans	-76.5	-48.1	179	-65.5	175.9	0	0	0	111.4	N8 K12 L13 I14	N8-L10 VanDerWaalsContact C-N 3.3Å; N8-L10 PolarHBondContact O-N 3.41Å; N8-L10 PolarHBondContact OD1-N 3.11Å; L10-K12 PolarHBondContact O-N 3.2Å; L10-L13 WeakPolarHBondContact O-CB 3.37Å; L10-L13 PolarHBondContact O-N 2.71Å; L10-I14 PolarHBondContact O-N 3.12Å
11	M	92.9	Very high	92.6	Very high	81 Å²	81	86.9 Å²	86.9	40%	0.399	44%	0.444	S	S	.	.	H	α-helix	trans	-64.7	-29.3	179.2	-61.7	-177.5	169.8	0	0	112	M4 R5 N8 I14 N15	M4-M11 HydrophobicContact CE-CE 4.09Å; M4-M11 HydrophobicContact CE-SD 4.29Å; M4-M11 HydrophobicContact CG-SD 4.08Å; R5-M11 CarbonylContact O-C 2.9Å; N8-M11 HydrophobicContact CB-CB 4.05Å; N8-M11 HydrophobicContact CB-CG 4.09Å; N8-M11 HydrophobicContact CB-SD 4.2Å; N8-M11 PolarHBondContact O-N 3.2Å; N8-M11 PolarHBondContact OD1-N 2.93Å; M11-I14 PolarHBondContact O-N 2.88Å; M11-N15 VanDerWaalsContact O-CB 3.25Å; M11-N15 WeakPolarHBondContact O-CB 3.17Å; M11-N15 PolarHBondContact O-N 2.95Å
12	K	93.1	Very high	93.4	Very high	99 Å²	99	79 Å²	79	43%	0.43	41%	0.411	S	S	.	.	H	α-helix	trans	-61.5	-43.1	175.3	-179.7	175.3	178.5	-173.9	0	111.4	R5 N8 L10 N15 H16	R5-K12 VanDerWaalsContact O-CA 3.32Å; R5-K12 WeakPolarHBondContact O-CA 3.4Å; R5-K12 PolarHBondContact O-N 3.22Å; N8-K12 WeakPolarHBondContact O-CB 3.35Å; N8-K12 PolarHBondContact O-N 3.29Å; L10-K12 PolarHBondContact O-N 3.2Å; K12-N15 PolarHBondContact O-N 3.03Å; K12-H16 WeakPolarHBondContact CE-NE2 3.37Å; K12-H16 VanDerWaalsContact CG-CD2 3.46Å; K12-H16 WeakPolarHBondContact CG-CD2 3.45Å; K12-H16 PolarHBondContact O-CD2 3.36Å; K12-H16 PolarHBondContact O-N 3.43Å
13	L	92.3	Very high	93.9	Very high	123 Å²	123	76.6 Å²	76.6	64%	0.644	39%	0.391	S	S	*	.	H	α-helix	trans	-60.3	-46.8	175.8	-177.7	67.7	0	0	0	111.3	L10 N15 S17	L10-L13 WeakPolarHBondContact O-CB 3.37Å; L10-L13 PolarHBondContact O-N 2.71Å; L13-N15 VanDerWaalsContact C-N 3.35Å; L13-S17 VanDerWaalsContact O-CB 3.27Å; L13-S17 WeakPolarHBondContact O-CB 3.4Å; L13-S17 PolarHBondContact O-N 3.49Å; L13-S17 VanDerWaalsContact O-N 3.09Å; L13-S17 PolarHBondContact O-OG 3.14Å
14	I	93.1	Very high	94.2	Very high	95 Å²	95	73.4 Å²	73.4	49%	0.487	37%	0.37	S	S	.	.	H	α-helix	trans	-62.3	-44.5	176.6	-61	173	0	0	0	110.2	L10 M11 H16 S17 F18	L10-I14 PolarHBondContact O-N 3.12Å; M11-I14 PolarHBondContact O-N 2.88Å; I14-H16 PolarHBondContact O-N 3.12Å; I14-S17 PolarHBondContact O-N 2.85Å; I14-F18 WeakPolarHBondContact O-CB 3.47Å; I14-F18 PolarHBondContact O-N 3.37Å
15	N	95.1	Very high	94.5	Very high	1 Å²	1	69.2 Å²	69.2	1%	0.005	35%	0.353	C	S	.	.	I	π-helix	trans	-61.9	-46.3	-178.3	-175	79.4	0	0	0	111.9	R5 M11 K12 L13 S17 I19 D20	R5-N15 HydrophobicContact CB-CB 4.42Å; R5-N15 WeakPolarHBondContact CD-OD1 3.38Å; R5-N15 WeakPolarHBondContact CG-OD1 3.35Å; R5-N15 PolarHBondContact NE-OD1 3.44Å; R5-N15 VanDerWaalsContact O-CB 3.28Å; R5-N15 WeakPolarHBondContact O-CB 3.38Å; M11-N15 VanDerWaalsContact O-CB 3.25Å; M11-N15 WeakPolarHBondContact O-CB 3.17Å; M11-N15 PolarHBondContact O-N 2.95Å; K12-N15 PolarHBondContact O-N 3.03Å; L13-N15 VanDerWaalsContact C-N 3.35Å; N15-S17 VanDerWaalsContact C-N 3.31Å; N15-S17 PolarHBondContact O-N 3.42Å; N15-I19 PolarHBondContact O-N 3.45Å; N15-I19 VanDerWaalsContact O-N 3.08Å; N15-D20 PolarHBondContact ND2-OD2 2.8Å; N15-D20 PolarHBondContact O-N 3.21Å; N15-D20 PolarHBondContact OD1-OD2 2.98Å
16	H	93.4	Very high	94.7	Very high	100 Å²	100	67.1 Å²	67.1	46%	0.463	35%	0.35	S	S	.	.	I	π-helix	trans	-70.6	-26.3	178.9	-74.6	-67	0	0	0	113.6	K12 I14 L21	K12-H16 WeakPolarHBondContact CE-NE2 3.37Å; K12-H16 VanDerWaalsContact CG-CD2 3.46Å; K12-H16 WeakPolarHBondContact CG-CD2 3.45Å; K12-H16 PolarHBondContact O-CD2 3.36Å; K12-H16 PolarHBondContact O-N 3.43Å; I14-H16 PolarHBondContact O-N 3.12Å; H16-L21 WeakPolarHBondContact O-CB 3.4Å
17	S	91.8	Very high	95	Very high	21 Å²	21	63.1 Å²	63.1	15%	0.147	33%	0.333	C	S	.	.	I	π-helix	trans	-94.3	-25.3	-176.1	-56.4	0	0	0	0	113.9	L13 I14 N15 L21	L13-S17 VanDerWaalsContact O-CB 3.27Å; L13-S17 WeakPolarHBondContact O-CB 3.4Å; L13-S17 PolarHBondContact O-N 3.49Å; L13-S17 VanDerWaalsContact O-N 3.09Å; L13-S17 PolarHBondContact O-OG 3.14Å; I14-S17 PolarHBondContact O-N 2.85Å; N15-S17 VanDerWaalsContact C-N 3.31Å; N15-S17 PolarHBondContact O-N 3.42Å; S17-L21 WeakPolarHBondContact O-CD2 3.35Å
18	F	91.7	Very high	95.2	Very high	119 Å²	119	60 Å²	60	52%	0.522	32%	0.32	S	S	.	.	I	π-helix	trans	-134.6	-19.4	-171	-72.8	-82.4	0	0	0	115.5	I14 F220	I14-F18 WeakPolarHBondContact O-CB 3.47Å; I14-F18 PolarHBondContact O-N 3.37Å; F18-F220 WeakPolarHBondContact O-CD1 3.31Å
19	I	95.9	Very high	95.3	Very high	46 Å²	46	60.9 Å²	60.9	24%	0.236	34%	0.335	C	S	.	.	I	π-helix	trans	-108.5	-68.8	-174	-54.5	178.3	0	0	0	110.3	N15 L21 F220 H221	N15-I19 PolarHBondContact O-N 3.45Å; N15-I19 VanDerWaalsContact O-N 3.08Å; I19-L21 VanDerWaalsContact C-N 3.28Å; I19-L21 PolarHBondContact O-N 2.66Å; I19-F220 PolarHBondContact O-N 3.07Å; I19-H221 HydrophobicContact CG2-CB 4.11Å; I19-H221 PolarHBondContact O-N 3.41Å
20	D	96.9	Very high	95.6	Very high	35 Å²	35	60.4 Å²	60.4	19%	0.187	32%	0.319	C	S	.	.	S	Bend	trans	-91.4	12.8	-176.3	-67.2	-15	0	0	0	111.7	R5 K6 N15 P22	R5-D20 IonicContact CZ-OD1 3.6Å; R5-D20 IonicContact CZ-OD2 3.98Å; R5-D20 IonicContact NE-OD2 3.83Å; R5-D20 IonicContact NH2-OD1 2.76Å; R5-D20 PolarHBondContact NH2-OD1 3.07Å; R5-D20 IonicContact NH2-OD2 3.32Å; R5-D20 PolarHBondContact NH2-OD2 3.01Å; K6-D20 WeakPolarHBondContact CE-OD2 3.45Å; K6-D20 IonicContact NZ-OD2 3.43Å; K6-D20 PolarHBondContact NZ-OD2 3.08Å; N15-D20 PolarHBondContact ND2-OD2 2.8Å; N15-D20 PolarHBondContact O-N 3.21Å; N15-D20 PolarHBondContact OD1-OD2 2.98Å; D20-P22 WeakPolarHBondContact O-CD 3.31Å
21	L	97	Very high	96	Very high	26 Å²	26	55.1 Å²	55.1	14%	0.136	29%	0.29	C	S	.	.			trans	-60.7	117.8	178.6	176.3	67.3	0	0	0	110.4	H16 S17 I19 T23 F220	H16-L21 WeakPolarHBondContact O-CB 3.4Å; S17-L21 WeakPolarHBondContact O-CD2 3.35Å; I19-L21 VanDerWaalsContact C-N 3.28Å; I19-L21 PolarHBondContact O-N 2.66Å; L21-T23 PolarHBondContact O-N 3.08Å; L21-T23 PolarHBondContact O-OG1 3.14Å; L21-F220 HydrophobicContact CB-CB 3.93Å; L21-F220 HydrophobicContact CD2-CD2 4.22Å; L21-F220 PolarHBondContact O-N 2.98Å
22	P	97.1	Very high	96.2	Very high	71 Å²	71	51.8 Å²	51.8	46%	0.461	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	113.7	178	-17.4	32.6	0	0	0	111	D20 K217	D20-P22 WeakPolarHBondContact O-CD 3.31Å; P22-K217 HydrophobicContact CB-CB 4.15Å; P22-K217 HydrophobicContact CB-CD 3.66Å
23	T	97.9	Very high	96.5	Very high	3 Å²	3	48.7 Å²	48.7	2%	0.018	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	139.5	-174.5	-51.2	0	0	0	0	109.5	L21 S25 I27 K217 I218 Y224	L21-T23 PolarHBondContact O-N 3.08Å; L21-T23 PolarHBondContact O-OG1 3.14Å; T23-S25 PolarHBondContact O-N 3.21Å; T23-I27 HydrophobicContact CG2-CD1 3.63Å; T23-I27 HydrophobicContact CG2-CG1 4.27Å; T23-K217 WeakPolarHBondContact O-CA 3.34Å; T23-I218 PolarHBondContact N-O 3.49Å; T23-I218 PolarHBondContact O-N 3.44Å; T23-Y224 HydrophobicContact CG2-CD2 3.49Å; T23-Y224 VanDerWaalsContact CG2-CD2 3.49Å; T23-Y224 HydrophobicContact CG2-CE2 3.29Å; T23-Y224 HydrophobicContact CG2-CG 4.34Å
24	P	98.2	Very high	96.8	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.5	139.2	175.7	-18.6	25.9	0	0	0	110.8	N26 I27 S205 N207 S213 Y224	P24-N26 PolarHBondContact O-N 3.12Å; P24-I27 HydrophobicContact CB-CG2 4.12Å; P24-I27 HydrophobicContact CG-CG2 4.16Å; P24-S205 WeakPolarHBondContact CG-O 2.99Å; P24-N207 HydrophobicContact CB-CB 3.88Å; P24-N207 HydrophobicContact CG-CB 4.19Å; P24-S213 WeakPolarHBondContact CB-OG 3.36Å; P24-S213 WeakPolarHBondContact CG-OG 3.48Å; P24-Y224 PolarHBondContact O-OH 3.32Å
25	S	98.1	Very high	97	Very high	41 Å²	41	42 Å²	42	29%	0.287	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-21	-177.2	62.9	0	0	0	0	114.4	T23 D216 Y224	T23-S25 PolarHBondContact O-N 3.21Å; S25-D216 VanDerWaalsContact CB-OD2 3.28Å; S25-D216 WeakPolarHBondContact CB-OD2 3.38Å; S25-D216 PolarHBondContact N-O 3.21Å; S25-D216 PolarHBondContact OG-OD2 3.44Å; S25-Y224 VanDerWaalsContact C-OH 3.29Å; S25-Y224 PolarHBondContact O-OH 3.15Å
26	N	98.3	Very high	97.2	Very high	55 Å²	55	42.6 Å²	42.6	29%	0.294	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.1	15.7	-167.1	70	-29.4	0	0	0	114.7	P24 S28 N207 P208 L209	P24-N26 PolarHBondContact O-N 3.12Å; N26-S28 PolarHBondContact O-N 3.28Å; N26-N207 PolarHBondContact ND2-OD1 3.07Å; N26-N207 WeakPolarHBondContact OD1-CB 2.86Å; N26-P208 VanDerWaalsContact O-CD 3.27Å; N26-P208 WeakPolarHBondContact O-CD 2.93Å; N26-P208 WeakPolarHBondContact O-CG 3.26Å; N26-L209 WeakPolarHBondContact ND2-CD1 3.43Å
27	I	98.4	Very high	97.4	Very high	16 Å²	16	39 Å²	39	8%	0.082	22%	0.224	C	C	.	.			trans	-68.3	128	177	54.4	161.3	0	0	0	111	T23 P24 W31 N206 N207 Y224 K227	T23-I27 HydrophobicContact CG2-CD1 3.63Å; T23-I27 HydrophobicContact CG2-CG1 4.27Å; P24-I27 HydrophobicContact CB-CG2 4.12Å; P24-I27 HydrophobicContact CG-CG2 4.16Å; I27-W31 HydrophobicContact CB-CB 4.04Å; I27-W31 HydrophobicContact CB-CD2 3.77Å; I27-W31 HydrophobicContact CB-CE3 4.22Å; I27-W31 HydrophobicContact CB-CG 3.65Å; I27-W31 HydrophobicContact CD1-CB 3.79Å; I27-W31 HydrophobicContact CD1-CG 3.93Å; I27-W31 HydrophobicContact CG1-CB 4.38Å; I27-W31 HydrophobicContact CG1-CG 4.36Å; I27-W31 HydrophobicContact CG2-CD2 3.79Å; I27-W31 HydrophobicContact CG2-CE3 4.48Å; I27-W31 HydrophobicContact CG2-CG 3.86Å; I27-W31 HydrophobicContact CG2-CZ2 4.31Å; I27-N206 VanDerWaalsContact CG2-O 3.28Å; I27-N206 WeakPolarHBondContact CG2-O 3.38Å; I27-N207 HydrophobicContact CG2-CB 4.12Å; I27-Y224 HydrophobicContact CD1-CD1 3.76Å; I27-Y224 HydrophobicContact CD1-CD2 4.46Å; I27-Y224 HydrophobicContact CD1-CE1 3.46Å; I27-Y224 VanDerWaalsContact CD1-CE1 3.46Å; I27-Y224 HydrophobicContact CD1-CE2 4.14Å; I27-Y224 HydrophobicContact CD1-CG 4.29Å; I27-Y224 HydrophobicContact CG1-CD1 4.08Å; I27-Y224 HydrophobicContact CG1-CE1 3.25Å; I27-Y224 HydrophobicContact CG1-CE2 4.12Å; I27-Y224 WeakPolarHBondContact CG1-OH 3.44Å; I27-K227 PolarHBondContact O-NZ 3.25Å
28	S	98.3	Very high	97.8	Very high	36 Å²	36	39.6 Å²	39.6	25%	0.252	23%	0.234	S	C	.	.			trans	-82.2	-177.7	-175.7	64.7	0	0	0	0	112.6	N26 W30 W31 K227	N26-S28 PolarHBondContact O-N 3.28Å; S28-W30 PolarHBondContact O-N 3.48Å; S28-W30 VanDerWaalsContact O-N 3.12Å; S28-W31 PolarHBondContact O-N 3.5Å; S28-W31 VanDerWaalsContact O-N 3.1Å; S28-K227 VanDerWaalsContact C-NZ 3.27Å; S28-K227 PolarHBondContact O-NZ 2.69Å
29	A	98.4	Very high	98.1	Very high	70 Å²	70	35.1 Å²	35.1	58%	0.579	22%	0.219	S	C	*	.	G	3₁₀ helix	trans	-57	-24.4	177.7	0	0	0	0	0	113.5	W31 N32	A29-W31 PolarHBondContact O-N 2.91Å; A29-W31 VanDerWaalsContact O-N 3.13Å; A29-N32 WeakPolarHBondContact CA-OD1 3.34Å; A29-N32 VanDerWaalsContact O-CB 3.26Å; A29-N32 WeakPolarHBondContact O-CB 3.42Å; A29-N32 PolarHBondContact O-N 3.43Å; A29-N32 PolarHBondContact O-OD1 2.88Å
30	W	98.6	Very high	98.3	Very high	97 Å²	97	32.9 Å²	32.9	37%	0.367	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-60.9	-21.8	176.7	-60.3	115.3	0	0	0	113.6	S28 N32 F33 L96 R100 Y104	S28-W30 PolarHBondContact O-N 3.48Å; S28-W30 VanDerWaalsContact O-N 3.12Å; W30-N32 VanDerWaalsContact C-N 3.34Å; W30-F33 HydrophobicContact CE3-CD2 4.19Å; W30-F33 AromaticContact CE3-CE2 3.63Å; W30-F33 HydrophobicContact CE3-CE2 3.63Å; W30-F33 AromaticContact CZ3-CE2 3.97Å; W30-F33 HydrophobicContact CZ3-CE2 3.97Å; W30-F33 WeakPolarHBondContact O-CD2 3.41Å; W30-L96 HydrophobicContact CZ3-CD2 4.04Å; W30-R100 HydrophobicContact CB-CB 4.11Å; W30-R100 HydrophobicContact CB-CG 3.55Å; W30-Y104 HydrophobicContact CB-CE2 4.22Å; W30-Y104 AromaticContact CD1-CE2 3.85Å; W30-Y104 HydrophobicContact CG-CE2 4.17Å
31	W	98.7	Very high	98.3	Very high	22 Å²	22	32.1 Å²	32.1	8%	0.083	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-77.4	-18.2	175.5	-86.6	-113.8	0	0	0	113.8	I27 S28 A29 F33 G34 R100 Y104 N206 P208	I27-W31 HydrophobicContact CB-CB 4.04Å; I27-W31 HydrophobicContact CB-CD2 3.77Å; I27-W31 HydrophobicContact CB-CE3 4.22Å; I27-W31 HydrophobicContact CB-CG 3.65Å; I27-W31 HydrophobicContact CD1-CB 3.79Å; I27-W31 HydrophobicContact CD1-CG 3.93Å; I27-W31 HydrophobicContact CG1-CB 4.38Å; I27-W31 HydrophobicContact CG1-CG 4.36Å; I27-W31 HydrophobicContact CG2-CD2 3.79Å; I27-W31 HydrophobicContact CG2-CE3 4.48Å; I27-W31 HydrophobicContact CG2-CG 3.86Å; I27-W31 HydrophobicContact CG2-CZ2 4.31Å; S28-W31 PolarHBondContact O-N 3.5Å; S28-W31 VanDerWaalsContact O-N 3.1Å; A29-W31 PolarHBondContact O-N 2.91Å; A29-W31 VanDerWaalsContact O-N 3.13Å; W31-F33 PolarHBondContact O-N 3.43Å; W31-G34 PolarHBondContact O-N 3.44Å; W31-R100 VanDerWaalsContact CE2-NH1 3.32Å; W31-R100 HydrophobicContact CE3-CG 4.34Å; W31-R100 HydrophobicContact CZ3-CG 4.26Å; W31-Y104 HydrophobicContact CH2-CD1 4.13Å; W31-Y104 AromaticContact CH2-CD2 3.53Å; W31-Y104 HydrophobicContact CH2-CD2 3.53Å; W31-Y104 AromaticContact CH2-CE2 3.97Å; W31-Y104 HydrophobicContact CH2-CE2 3.97Å; W31-Y104 AromaticContact CH2-CG 3.6Å; W31-Y104 HydrophobicContact CH2-CG 3.6Å; W31-Y104 AromaticContact CZ3-CD2 3.61Å; W31-Y104 HydrophobicContact CZ3-CD2 3.61Å; W31-Y104 AromaticContact CZ3-CE2 3.57Å; W31-Y104 HydrophobicContact CZ3-CE2 3.57Å; W31-Y104 HydrophobicContact CZ3-CG 4.1Å; W31-N206 VanDerWaalsContact CE2-O 3.28Å; W31-N206 HydrophobicContact CZ2-CB 4.27Å; W31-N206 VanDerWaalsContact CZ2-O 3.28Å; W31-N206 WeakPolarHBondContact CZ2-O 3.17Å; W31-N206 PolarHBondContact NE1-O 2.94Å; W31-P208 HydrophobicContact CH2-CG 4.09Å; W31-P208 HydrophobicContact CZ3-CG 3.84Å
32	N	98.6	Very high	98.4	Very high	12 Å²	12	36.2 Å²	36.2	6%	0.064	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-65.6	-23.5	178.2	-67.2	60.7	0	0	0	112.5	A29 W30 G34 S35 L36 K227 D228	A29-N32 WeakPolarHBondContact CA-OD1 3.34Å; A29-N32 VanDerWaalsContact O-CB 3.26Å; A29-N32 WeakPolarHBondContact O-CB 3.42Å; A29-N32 PolarHBondContact O-N 3.43Å; A29-N32 PolarHBondContact O-OD1 2.88Å; W30-N32 VanDerWaalsContact C-N 3.34Å; N32-G34 PolarHBondContact O-N 3Å; N32-G34 VanDerWaalsContact O-N 3.1Å; N32-S35 PolarHBondContact O-N 2.88Å; N32-S35 VanDerWaalsContact O-N 3.12Å; N32-S35 PolarHBondContact O-OG 3.45Å; N32-L36 WeakPolarHBondContact O-CG 3.45Å; N32-L36 PolarHBondContact O-N 2.69Å; N32-K227 PolarHBondContact ND2-O 3.16Å; N32-K227 WeakPolarHBondContact OD1-CE 3.33Å; N32-K227 PolarHBondContact OD1-NZ 2.61Å; N32-D228 PolarHBondContact ND2-OD1 3.38Å
33	F	98.8	Very high	98.5	Very high	33 Å²	33	34.5 Å²	34.5	15%	0.145	21%	0.211	C	C	.	.	H	α-helix	trans	-62.4	-21.3	-179.3	-69.5	-67.9	0	0	0	113.1	W30 W31 L36 L37 C93 L96 H97	W30-F33 HydrophobicContact CE3-CD2 4.19Å; W30-F33 AromaticContact CE3-CE2 3.63Å; W30-F33 HydrophobicContact CE3-CE2 3.63Å; W30-F33 AromaticContact CZ3-CE2 3.97Å; W30-F33 HydrophobicContact CZ3-CE2 3.97Å; W30-F33 WeakPolarHBondContact O-CD2 3.41Å; W31-F33 PolarHBondContact O-N 3.43Å; F33-L36 HydrophobicContact CD1-CD1 3.97Å; F33-L36 HydrophobicContact CE1-CD1 4.1Å; F33-L37 WeakPolarHBondContact O-CB 3.27Å; F33-L37 WeakPolarHBondContact O-CD1 3.44Å; F33-L37 WeakPolarHBondContact O-CG 3.33Å; F33-L37 PolarHBondContact O-N 2.85Å; F33-C93 HydrophobicContact CD1-CB 4.09Å; F33-L96 HydrophobicContact CD1-CB 4.06Å; F33-L96 HydrophobicContact CD1-CD1 4.35Å; F33-L96 HydrophobicContact CD2-CB 3.89Å; F33-L96 HydrophobicContact CE1-CB 3.92Å; F33-L96 HydrophobicContact CE1-CD1 3.46Å; F33-L96 VanDerWaalsContact CE1-CD1 3.46Å; F33-L96 HydrophobicContact CE1-CG 4.33Å; F33-L96 HydrophobicContact CE2-CB 3.75Å; F33-L96 HydrophobicContact CE2-CD1 4.13Å; F33-L96 HydrophobicContact CE2-CG 4.5Å; F33-L96 HydrophobicContact CG-CB 4.07Å; F33-L96 HydrophobicContact CZ-CB 3.77Å; F33-L96 HydrophobicContact CZ-CD1 3.34Å; F33-L96 HydrophobicContact CZ-CG 4.14Å; F33-H97 HydrophobicContact CB-CB 3.94Å
34	G	98.1	Very high	98.6	Very high	33 Å²	33	35.3 Å²	35.3	34%	0.34	21%	0.214	S	C	.	.	H	α-helix	trans	-63.8	-50.3	171.5	0	0	0	0	0	112.7	W31 N32 L37 G38 H97	W31-G34 PolarHBondContact O-N 3.44Å; N32-G34 PolarHBondContact O-N 3Å; N32-G34 VanDerWaalsContact O-N 3.1Å; G34-L37 PolarHBondContact O-N 3.4Å; G34-G38 PolarHBondContact O-N 3.24Å; G34-H97 PolarHBondContact N-ND1 2.92Å
35	S	98.1	Very high	98.6	Very high	44 Å²	44	37.2 Å²	37.2	31%	0.308	22%	0.224	S	C	.	.	H	α-helix	trans	-71	-34.7	178.1	46.1	0	0	0	0	112.5	N32 L37 G38 A39 D228	N32-S35 PolarHBondContact O-N 2.88Å; N32-S35 VanDerWaalsContact O-N 3.12Å; N32-S35 PolarHBondContact O-OG 3.45Å; S35-L37 VanDerWaalsContact C-N 3.34Å; S35-L37 PolarHBondContact O-N 3.14Å; S35-G38 PolarHBondContact O-N 3.46Å; S35-A39 PolarHBondContact O-N 2.75Å; S35-D228 WeakPolarHBondContact CB-OD2 3.19Å; S35-D228 PolarHBondContact OG-OD2 2.94Å
36	L	98.8	Very high	98.6	Very high	15 Å²	15	38.3 Å²	38.3	8%	0.079	23%	0.229	C	C	.	.	H	α-helix	trans	-63	-37.2	173.3	-66.3	-178.9	0	0	0	112.8	N32 F33 G38 A39 C40 L232 F235	N32-L36 WeakPolarHBondContact O-CG 3.45Å; N32-L36 PolarHBondContact O-N 2.69Å; F33-L36 HydrophobicContact CD1-CD1 3.97Å; F33-L36 HydrophobicContact CE1-CD1 4.1Å; L36-G38 VanDerWaalsContact C-N 3.34Å; L36-A39 WeakPolarHBondContact O-CB 3.4Å; L36-A39 PolarHBondContact O-N 2.77Å; L36-C40 PolarHBondContact O-N 3.38Å; L36-C40 PolarHBondContact O-SG 2.72Å; L36-L232 HydrophobicContact CD2-CB 4.47Å; L36-L232 HydrophobicContact CD2-CD1 4.45Å; L36-F235 HydrophobicContact CD2-CB 3.66Å; L36-F235 HydrophobicContact CD2-CD2 4.34Å; L36-F235 HydrophobicContact CD2-CG 4.04Å
37	L	98.9	Very high	98.7	Very high	24 Å²	24	36.2 Å²	36.2	13%	0.126	22%	0.218	C	C	.	.	H	α-helix	trans	-64.5	-38.6	173.4	-72.6	169.1	0	0	0	112	F33 G34 S35 C40 L41 F90 C93 L94 H97	F33-L37 WeakPolarHBondContact O-CB 3.27Å; F33-L37 WeakPolarHBondContact O-CD1 3.44Å; F33-L37 WeakPolarHBondContact O-CG 3.33Å; F33-L37 PolarHBondContact O-N 2.85Å; G34-L37 PolarHBondContact O-N 3.4Å; S35-L37 VanDerWaalsContact C-N 3.34Å; S35-L37 PolarHBondContact O-N 3.14Å; L37-C40 PolarHBondContact O-N 3.48Å; L37-L41 PolarHBondContact O-N 3.24Å; L37-F90 HydrophobicContact CB-CE1 4.45Å; L37-F90 HydrophobicContact CD2-CD1 3.47Å; L37-F90 VanDerWaalsContact CD2-CD1 3.47Å; L37-F90 HydrophobicContact CD2-CE1 3.51Å; L37-C93 HydrophobicContact CD2-CB 3.62Å; L37-C93 HydrophobicContact CG-CB 4.04Å; L37-L94 HydrophobicContact CD1-CD2 4.03Å; L37-L94 HydrophobicContact CD2-CB 4.28Å; L37-L94 HydrophobicContact CD2-CD2 3.74Å; L37-L94 HydrophobicContact CD2-CG 3.57Å; L37-H97 HydrophobicContact CD1-CB 3.77Å
38	G	98.7	Very high	98.7	Very high	34 Å²	34	36.3 Å²	36.3	35%	0.351	22%	0.223	S	C	.	.	H	α-helix	trans	-60.5	-44	171	0	0	0	0	0	112.3	G34 S35 L36 L41 I42	G34-G38 PolarHBondContact O-N 3.24Å; S35-G38 PolarHBondContact O-N 3.46Å; L36-G38 VanDerWaalsContact C-N 3.34Å; G38-L41 PolarHBondContact O-N 2.98Å; G38-I42 WeakPolarHBondContact O-CG1 3.47Å; G38-I42 PolarHBondContact O-N 3.03Å; G38-I42 VanDerWaalsContact O-N 3.07Å
39	A	98.8	Very high	98.7	Very high	24 Å²	24	38.2 Å²	38.2	20%	0.198	23%	0.23	C	C	.	.	H	α-helix	trans	-63.8	-41.5	175.2	0	0	0	0	0	112.3	S35 L36 L41 I42 L43 L232	S35-A39 PolarHBondContact O-N 2.75Å; L36-A39 WeakPolarHBondContact O-CB 3.4Å; L36-A39 PolarHBondContact O-N 2.77Å; A39-L41 PolarHBondContact O-N 3.04Å; A39-I42 PolarHBondContact O-N 3.4Å; A39-L43 WeakPolarHBondContact O-CB 3.29Å; A39-L43 PolarHBondContact O-N 3.33Å; A39-L232 HydrophobicContact CB-CD1 3.71Å
40	C	98.9	Very high	98.7	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-59	-46.8	173.8	-67.3	0	0	0	0	111	L36 L37 I42 L43 Q44 F90 F235	L36-C40 PolarHBondContact O-N 3.38Å; L36-C40 PolarHBondContact O-SG 2.72Å; L37-C40 PolarHBondContact O-N 3.48Å; C40-I42 PolarHBondContact O-N 3.47Å; C40-L43 WeakPolarHBondContact O-CB 3.4Å; C40-L43 PolarHBondContact O-N 3.19Å; C40-Q44 WeakPolarHBondContact O-CG 3.49Å; C40-Q44 PolarHBondContact O-N 3.5Å; C40-F90 HydrophobicContact CB-CB 4.02Å; C40-F90 HydrophobicContact CB-CD1 3.88Å; C40-F90 HydrophobicContact CB-CD2 3.95Å; C40-F90 HydrophobicContact CB-CE1 4.32Å; C40-F90 HydrophobicContact CB-CE2 4.38Å; C40-F90 HydrophobicContact CB-CG 3.67Å; C40-F235 WeakPolarHBondContact SG-CE2 3.39Å; C40-F235 WeakPolarHBondContact SG-CZ 3.33Å
41	L	98.9	Very high	98.7	Very high	19 Å²	19	36.8 Å²	36.8	10%	0.099	21%	0.214	C	C	.	.	H	α-helix	trans	-61.2	-44.3	179.7	-177.2	61.3	0	0	0	112	L37 G38 A39 Q44 I45 F90 I189 A190	L37-L41 PolarHBondContact O-N 3.24Å; G38-L41 PolarHBondContact O-N 2.98Å; A39-L41 PolarHBondContact O-N 3.04Å; L41-Q44 PolarHBondContact O-N 2.98Å; L41-I45 HydrophobicContact CD1-CD1 3.95Å; L41-I45 HydrophobicContact CD1-CG1 4.28Å; L41-I45 HydrophobicContact CG-CD1 3.91Å; L41-I45 VanDerWaalsContact O-CG1 3.31Å; L41-I45 WeakPolarHBondContact O-CG1 3.49Å; L41-I45 PolarHBondContact O-N 3.47Å; L41-F90 HydrophobicContact CB-CE2 4.35Å; L41-F90 HydrophobicContact CB-CZ 4.19Å; L41-F90 HydrophobicContact CD1-CE2 4.27Å; L41-F90 HydrophobicContact CD1-CZ 4.42Å; L41-I189 HydrophobicContact CD1-CB 4.34Å; L41-I189 HydrophobicContact CD1-CG2 3.86Å; L41-I189 HydrophobicContact CD2-CG2 3.99Å; L41-A190 HydrophobicContact CD2-CB 3.94Å
42	I	98.8	Very high	98.7	Very high	112 Å²	112	36.9 Å²	36.9	57%	0.574	22%	0.22	S	C	*	.	H	α-helix	trans	-62.7	-44.5	175.7	-66.9	167.4	0	0	0	110.6	G38 A39 C40 Q44 I45 T46	G38-I42 WeakPolarHBondContact O-CG1 3.47Å; G38-I42 PolarHBondContact O-N 3.03Å; G38-I42 VanDerWaalsContact O-N 3.07Å; A39-I42 PolarHBondContact O-N 3.4Å; C40-I42 PolarHBondContact O-N 3.47Å; I42-Q44 PolarHBondContact O-N 3.36Å; I42-I45 PolarHBondContact O-N 3.28Å; I42-T46 HydrophobicContact CG2-CG2 4.24Å; I42-T46 WeakPolarHBondContact O-CB 3.12Å; I42-T46 VanDerWaalsContact O-CG2 3.27Å; I42-T46 WeakPolarHBondContact O-CG2 3.48Å; I42-T46 PolarHBondContact O-N 2.99Å; I42-T46 PolarHBondContact O-OG1 3.47Å
43	L	98.9	Very high	98.7	Very high	34 Å²	34	42 Å²	42	18%	0.178	25%	0.245	C	C	.	.	H	α-helix	trans	-58.1	-48	176.2	177.1	72.8	0	0	0	111.2	A39 C40 T46 T47 L239	A39-L43 WeakPolarHBondContact O-CB 3.29Å; A39-L43 PolarHBondContact O-N 3.33Å; C40-L43 WeakPolarHBondContact O-CB 3.4Å; C40-L43 PolarHBondContact O-N 3.19Å; L43-T46 PolarHBondContact O-N 3.28Å; L43-T46 PolarHBondContact O-OG1 3.33Å; L43-T47 HydrophobicContact CD1-CG2 3.99Å; L43-T47 HydrophobicContact CG-CG2 4.49Å; L43-T47 WeakPolarHBondContact O-CB 3.29Å; L43-T47 WeakPolarHBondContact O-CG2 3.22Å; L43-T47 PolarHBondContact O-N 3.3Å; L43-T47 PolarHBondContact O-OG1 3.09Å; L43-L239 HydrophobicContact CD2-CD2 3.44Å; L43-L239 VanDerWaalsContact CD2-CD2 3.44Å
44	Q	98.9	Very high	98.7	Very high	21 Å²	21	44.4 Å²	44.4	10%	0.098	26%	0.256	C	S	.	.	H	α-helix	trans	-65.8	-43.1	-179.2	-67.2	-48.6	104.4	0	0	112.2	C40 L41 I42 T47 G48 H83 G86 F90	C40-Q44 WeakPolarHBondContact O-CG 3.49Å; C40-Q44 PolarHBondContact O-N 3.5Å; L41-Q44 PolarHBondContact O-N 2.98Å; I42-Q44 PolarHBondContact O-N 3.36Å; Q44-T47 PolarHBondContact O-OG1 3.48Å; Q44-G48 WeakPolarHBondContact O-CA 3.33Å; Q44-G48 PolarHBondContact O-N 3.42Å; Q44-H83 PolarHBondContact NE2-O 3.44Å; Q44-H83 PolarHBondContact O-CE1 3.28Å; Q44-H83 VanDerWaalsContact O-CE1 3.26Å; Q44-H83 PolarHBondContact O-ND1 3.41Å; Q44-H83 PolarHBondContact OE1-O 3.03Å; Q44-G86 VanDerWaalsContact OE1-C 3.23Å; Q44-F90 HydrophobicContact CG-CD2 3.97Å; Q44-F90 HydrophobicContact CG-CE2 4.45Å
45	I	98.9	Very high	98.8	Very high	40 Å²	40	44 Å²	44	21%	0.205	25%	0.245	C	C	.	.	H	α-helix	trans	-63.8	-46.1	178	-69.5	169.5	0	0	0	110.4	L41 I42 L49 P186 F187	L41-I45 HydrophobicContact CD1-CD1 3.95Å; L41-I45 HydrophobicContact CD1-CG1 4.28Å; L41-I45 HydrophobicContact CG-CD1 3.91Å; L41-I45 VanDerWaalsContact O-CG1 3.31Å; L41-I45 WeakPolarHBondContact O-CG1 3.49Å; L41-I45 PolarHBondContact O-N 3.47Å; I42-I45 PolarHBondContact O-N 3.28Å; I45-L49 VanDerWaalsContact O-CB 3.26Å; I45-L49 WeakPolarHBondContact O-CB 3.27Å; I45-L49 PolarHBondContact O-N 3.15Å; I45-P186 HydrophobicContact CD1-CB 4.23Å; I45-P186 HydrophobicContact CG1-CB 3.7Å; I45-F187 HydrophobicContact CG2-CE1 4.03Å; I45-F187 HydrophobicContact CG2-CZ 4.21Å
46	T	98.9	Very high	98.8	Very high	64 Å²	64	44.2 Å²	44.2	39%	0.393	25%	0.246	S	C	.	.	H	α-helix	trans	-66.3	-55.1	-177.7	51.3	0	0	0	0	111.3	I42 L43 G48 L49 F50	I42-T46 HydrophobicContact CG2-CG2 4.24Å; I42-T46 WeakPolarHBondContact O-CB 3.12Å; I42-T46 VanDerWaalsContact O-CG2 3.27Å; I42-T46 WeakPolarHBondContact O-CG2 3.48Å; I42-T46 PolarHBondContact O-N 2.99Å; I42-T46 PolarHBondContact O-OG1 3.47Å; L43-T46 PolarHBondContact O-N 3.28Å; L43-T46 PolarHBondContact O-OG1 3.33Å; T46-G48 VanDerWaalsContact C-N 3.33Å; T46-G48 PolarHBondContact O-N 2.81Å; T46-L49 PolarHBondContact O-N 3.28Å; T46-F50 VanDerWaalsContact O-CD2 3.26Å; T46-F50 WeakPolarHBondContact O-CD2 3.35Å; T46-F50 PolarHBondContact O-N 3.39Å
47	T	98.9	Very high	98.7	Very high	11 Å²	11	45 Å²	45	7%	0.067	25%	0.253	C	S	.	.	H	α-helix	trans	-61.4	-41.4	178.1	54.4	0	0	0	0	112	L43 Q44 L49 F50 L51 I79 L82 H83	L43-T47 HydrophobicContact CD1-CG2 3.99Å; L43-T47 HydrophobicContact CG-CG2 4.49Å; L43-T47 WeakPolarHBondContact O-CB 3.29Å; L43-T47 WeakPolarHBondContact O-CG2 3.22Å; L43-T47 PolarHBondContact O-N 3.3Å; L43-T47 PolarHBondContact O-OG1 3.09Å; Q44-T47 PolarHBondContact O-OG1 3.48Å; T47-L49 PolarHBondContact O-N 2.88Å; T47-F50 PolarHBondContact O-N 2.87Å; T47-L51 VanDerWaalsContact O-CG 3.3Å; T47-L51 WeakPolarHBondContact O-CG 3.41Å; T47-L51 PolarHBondContact O-N 2.86Å; T47-I79 HydrophobicContact CG2-CG2 4.35Å; T47-L82 HydrophobicContact CG2-CB 4.08Å; T47-H83 PolarHBondContact OG1-ND1 3.16Å
48	G	98.8	Very high	98.6	Very high	17 Å²	17	46.5 Å²	46.5	18%	0.175	26%	0.261	C	S	.	.	H	α-helix	trans	-62.9	-39.6	178.3	0	0	0	0	0	112.9	Q44 T46 L51 A52 H83	Q44-G48 WeakPolarHBondContact O-CA 3.33Å; Q44-G48 PolarHBondContact O-N 3.42Å; T46-G48 VanDerWaalsContact C-N 3.33Å; T46-G48 PolarHBondContact O-N 2.81Å; G48-L51 PolarHBondContact O-N 2.9Å; G48-A52 VanDerWaalsContact O-CB 3.31Å; G48-A52 WeakPolarHBondContact O-CB 3.4Å; G48-A52 PolarHBondContact O-N 2.71Å; G48-H83 VanDerWaalsContact CA-CE1 3.43Å; G48-H83 WeakPolarHBondContact CA-CE1 3.48Å; G48-H83 PolarHBondContact N-ND1 3.47Å
49	L	98.8	Very high	98.4	Very high	77 Å²	77	45.8 Å²	45.8	40%	0.403	25%	0.252	S	S	.	.	H	α-helix	trans	-62.3	-45.1	175	-179.5	65.1	0	0	0	111.7	I45 T46 T47 A52 M53 F183	I45-L49 VanDerWaalsContact O-CB 3.26Å; I45-L49 WeakPolarHBondContact O-CB 3.27Å; I45-L49 PolarHBondContact O-N 3.15Å; T46-L49 PolarHBondContact O-N 3.28Å; T47-L49 PolarHBondContact O-N 2.88Å; L49-A52 PolarHBondContact O-N 2.9Å; L49-M53 HydrophobicContact CD1-CE 4.47Å; L49-M53 HydrophobicContact CD2-CE 4.48Å; L49-M53 HydrophobicContact CG-CE 4.06Å; L49-M53 WeakPolarHBondContact O-CG 3.45Å; L49-M53 PolarHBondContact O-N 3.26Å; L49-F183 HydrophobicContact CD1-CE2 4.29Å; L49-F183 HydrophobicContact CD1-CZ 4.05Å
50	F	98.8	Very high	98.4	Very high	113 Å²	113	49.3 Å²	49.3	50%	0.496	27%	0.274	S	S	.	.	H	α-helix	trans	-65.1	-38.4	176.5	-81.3	-77.7	0	0	0	112.4	T46 T47 M53 H54 I79	T46-F50 VanDerWaalsContact O-CD2 3.26Å; T46-F50 WeakPolarHBondContact O-CD2 3.35Å; T46-F50 PolarHBondContact O-N 3.39Å; T47-F50 PolarHBondContact O-N 2.87Å; F50-M53 HydrophobicContact CD1-SD 4.25Å; F50-M53 PolarHBondContact O-N 2.89Å; F50-H54 PolarHBondContact O-CD2 3.41Å; F50-I79 HydrophobicContact CB-CD1 4.34Å; F50-I79 HydrophobicContact CB-CG2 4.16Å
51	L	98.9	Very high	98.3	Very high	23 Å²	23	51.5 Å²	51.5	12%	0.12	29%	0.288	C	S	.	.	H	α-helix	trans	-64.9	-41.8	174.4	-67.4	170.6	0	0	0	111.7	T47 G48 M53 H54 Y55 I69 I79 R80 H83	T47-L51 VanDerWaalsContact O-CG 3.3Å; T47-L51 WeakPolarHBondContact O-CG 3.41Å; T47-L51 PolarHBondContact O-N 2.86Å; G48-L51 PolarHBondContact O-N 2.9Å; L51-M53 PolarHBondContact O-N 3.4Å; L51-H54 PolarHBondContact O-N 3.45Å; L51-Y55 WeakPolarHBondContact O-CB 3.4Å; L51-Y55 PolarHBondContact O-N 3.5Å; L51-Y55 VanDerWaalsContact O-N 3.12Å; L51-I69 HydrophobicContact CD2-CD1 4.28Å; L51-I69 HydrophobicContact CD2-CG2 3.56Å; L51-I79 HydrophobicContact CD1-CG2 4.5Å; L51-I79 HydrophobicContact CD2-CB 4.49Å; L51-I79 HydrophobicContact CD2-CG2 3.92Å; L51-I79 HydrophobicContact CG-CG2 3.84Å; L51-R80 HydrophobicContact CD2-CB 4.09Å; L51-H83 HydrophobicContact CD1-CB 3.5Å
52	A	98.7	Very high	98.3	Very high	24 Å²	24	50.6 Å²	50.6	20%	0.198	28%	0.283	C	S	.	.	H	α-helix	trans	-62	-27.9	-179.7	0	0	0	0	0	113.2	G48 L49 H54 F179 F183	G48-A52 VanDerWaalsContact O-CB 3.31Å; G48-A52 WeakPolarHBondContact O-CB 3.4Å; G48-A52 PolarHBondContact O-N 2.71Å; L49-A52 PolarHBondContact O-N 2.9Å; A52-H54 PolarHBondContact O-N 3.3Å; A52-F179 HydrophobicContact CB-CE2 4.22Å; A52-F179 HydrophobicContact CB-CZ 4.14Å; A52-F183 HydrophobicContact CB-CD2 4.23Å; A52-F183 HydrophobicContact CB-CE2 3.91Å
53	M	98.7	Very high	98.3	Very high	121 Å²	121	47.9 Å²	47.9	60%	0.596	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-17.4	174.7	-67	172.9	-176.6	0	0	113.5	L49 F50 L51	L49-M53 HydrophobicContact CD1-CE 4.47Å; L49-M53 HydrophobicContact CD2-CE 4.48Å; L49-M53 HydrophobicContact CG-CE 4.06Å; L49-M53 WeakPolarHBondContact O-CG 3.45Å; L49-M53 PolarHBondContact O-N 3.26Å; F50-M53 HydrophobicContact CD1-SD 4.25Å; F50-M53 PolarHBondContact O-N 2.89Å; L51-M53 PolarHBondContact O-N 3.4Å
54	H	98.6	Very high	98.3	Very high	82 Å²	82	49.3 Å²	49.3	38%	0.38	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.6	-2.8	-175	-61.3	-68	0	0	0	113.6	F50 L51 A52 I69 V73	F50-H54 PolarHBondContact O-CD2 3.41Å; L51-H54 PolarHBondContact O-N 3.45Å; A52-H54 PolarHBondContact O-N 3.3Å; H54-I69 HydrophobicContact CB-CD1 3.88Å; H54-I69 HydrophobicContact CB-CG1 3.51Å; H54-V73 HydrophobicContact CB-CG2 4.37Å
55	Y	98.7	Very high	98.3	Very high	24 Å²	24	48.9 Å²	48.9	9%	0.094	28%	0.279	C	S	.	.			trans	-93	144.7	-176.7	175.6	-109	0	0	0	112	L51 P57 A62 S65 I66 L133 F179	L51-Y55 WeakPolarHBondContact O-CB 3.4Å; L51-Y55 PolarHBondContact O-N 3.5Å; L51-Y55 VanDerWaalsContact O-N 3.12Å; Y55-P57 HydrophobicContact CD1-CB 4.42Å; Y55-P57 HydrophobicContact CE1-CB 3.7Å; Y55-A62 HydrophobicContact CE2-CB 3.99Å; Y55-S65 VanDerWaalsContact CD2-OG 3.24Å; Y55-S65 WeakPolarHBondContact CD2-OG 3.35Å; Y55-I66 HydrophobicContact CD2-CD1 3.69Å; Y55-I66 HydrophobicContact CD2-CG1 4.22Å; Y55-I66 HydrophobicContact CE2-CD1 4.12Å; Y55-I66 HydrophobicContact CE2-CG1 4.28Å; Y55-L133 HydrophobicContact CE1-CB 4.43Å; Y55-L133 HydrophobicContact CE2-CB 4.44Å; Y55-L133 WeakPolarHBondContact CE2-O 3.48Å; Y55-L133 PolarHBondContact OH-O 3.32Å; Y55-F179 AromaticContact CD1-CD2 3.66Å; Y55-F179 HydrophobicContact CD1-CD2 3.66Å; Y55-F179 AromaticContact CD1-CE2 3.67Å; Y55-F179 HydrophobicContact CD1-CE2 3.67Å; Y55-F179 HydrophobicContact CD1-CG 4.35Å; Y55-F179 HydrophobicContact CD1-CZ 4.36Å; Y55-F179 HydrophobicContact CE1-CB 4.34Å; Y55-F179 AromaticContact CE1-CD2 3.6Å; Y55-F179 HydrophobicContact CE1-CD2 3.6Å; Y55-F179 HydrophobicContact CE1-CE2 4.12Å; Y55-F179 HydrophobicContact CE1-CG 4.04Å
56	S	98.2	Very high	98.3	Very high	49 Å²	49	48.2 Å²	48.2	34%	0.343	28%	0.276	S	S	.	.			trans	-120.1	113.6	177.1	-172.6	0	0	0	0	110.6	D58 T61 A62 S65	S56-D58 VanDerWaalsContact C-N 3.25Å; S56-D58 PolarHBondContact O-N 3.04Å; S56-T61 WeakPolarHBondContact CB-OG1 3.32Å; S56-T61 PolarHBondContact OG-OG1 3.41Å; S56-A62 VanDerWaalsContact O-CA 3.27Å; S56-A62 WeakPolarHBondContact O-CA 3.3Å; S56-S65 PolarHBondContact N-OG 2.74Å
57	P	96.8	Very high	98.2	Very high	32 Å²	32	46.7 Å²	46.7	21%	0.208	27%	0.27	C	S	.	.			trans	-85.6	53.9	-173.6	36.2	-38.3	0	0	0	113.3	Y55 T176 F179	Y55-P57 HydrophobicContact CD1-CB 4.42Å; Y55-P57 HydrophobicContact CE1-CB 3.7Å; P57-T176 PolarHBondContact O-OG1 3.11Å; P57-F179 HydrophobicContact CB-CB 3.81Å; P57-F179 HydrophobicContact CB-CD1 3.97Å; P57-F179 HydrophobicContact CB-CG 3.92Å; P57-F179 HydrophobicContact CG-CD1 3.94Å; P57-F179 HydrophobicContact CG-CE1 4.43Å; P57-F179 HydrophobicContact CG-CG 4.38Å
58	D	96.8	Very high	98.2	Very high	56 Å²	56	49.9 Å²	49.9	30%	0.299	28%	0.284	S	S	.	.	S	Bend	trans	-126.5	140.8	173.3	178.8	-97.3	0	0	0	110.9	S56 S60 T61 A62 S172	S56-D58 VanDerWaalsContact C-N 3.25Å; S56-D58 PolarHBondContact O-N 3.04Å; D58-S60 PolarHBondContact O-N 3.36Å; D58-S60 VanDerWaalsContact O-N 3.1Å; D58-S60 VanDerWaalsContact OD1-CB 3.27Å; D58-S60 WeakPolarHBondContact OD1-CB 3.38Å; D58-S60 PolarHBondContact OD1-N 2.96Å; D58-S60 PolarHBondContact OD1-OG 2.82Å; D58-T61 PolarHBondContact O-N 3.43Å; D58-A62 WeakPolarHBondContact O-CB 3.25Å; D58-A62 PolarHBondContact O-N 2.89Å; D58-S172 PolarHBondContact OD2-OG 3.47Å
59	A	95.9	Very high	98.2	Very high	19 Å²	19	49.1 Å²	49.1	16%	0.157	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-26.1	-174.6	0	0	0	0	0	113.4	W135 S172	A59-W135 HydrophobicContact CB-CZ2 3.75Å; A59-S172 WeakPolarHBondContact CB-OG 3.5Å; A59-S172 PolarHBondContact N-OG 3.1Å
60	S	97.4	Very high	98.2	Very high	97 Å²	97	47 Å²	47	68%	0.678	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-23.8	177.8	73	0	0	0	0	113.8	D58	D58-S60 PolarHBondContact O-N 3.36Å; D58-S60 VanDerWaalsContact O-N 3.1Å; D58-S60 VanDerWaalsContact OD1-CB 3.27Å; D58-S60 WeakPolarHBondContact OD1-CB 3.38Å; D58-S60 PolarHBondContact OD1-N 2.96Å; D58-S60 PolarHBondContact OD1-OG 2.82Å
61	T	98.2	Very high	98.2	Very high	46 Å²	46	51.4 Å²	51.4	28%	0.282	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.5	-13.2	-173.1	56.7	0	0	0	0	114.6	S56 D58 F63 S64 S65	S56-T61 WeakPolarHBondContact CB-OG1 3.32Å; S56-T61 PolarHBondContact OG-OG1 3.41Å; D58-T61 PolarHBondContact O-N 3.43Å; T61-F63 PolarHBondContact O-N 3.4Å; T61-S64 PolarHBondContact O-N 3.03Å; T61-S64 PolarHBondContact O-OG 3.4Å; T61-S65 VanDerWaalsContact O-CB 3.27Å; T61-S65 WeakPolarHBondContact O-CB 3.28Å; T61-S65 PolarHBondContact O-N 2.93Å; T61-S65 PolarHBondContact O-OG 2.82Å
62	A	98.5	Very high	98.2	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-59.8	-53.4	-173.9	0	0	0	0	0	112.5	Y55 S56 D58 S64 S65 I66 W135 L175	Y55-A62 HydrophobicContact CE2-CB 3.99Å; S56-A62 VanDerWaalsContact O-CA 3.27Å; S56-A62 WeakPolarHBondContact O-CA 3.3Å; D58-A62 WeakPolarHBondContact O-CB 3.25Å; D58-A62 PolarHBondContact O-N 2.89Å; A62-S64 PolarHBondContact O-N 3.07Å; A62-S65 PolarHBondContact O-N 2.92Å; A62-S65 PolarHBondContact O-OG 2.84Å; A62-I66 PolarHBondContact O-N 3.37Å; A62-I66 VanDerWaalsContact O-N 3.11Å; A62-W135 HydrophobicContact CB-CB 3.84Å; A62-W135 HydrophobicContact CB-CG 4.37Å; A62-L175 HydrophobicContact CB-CD2 3.55Å
63	F	98.5	Very high	98.2	Very high	55 Å²	55	55.6 Å²	55.6	24%	0.241	30%	0.3	C	S	.	.	H	α-helix	trans	-60.2	-44.6	179	-173.3	-90.8	0	0	0	112.3	T61 I66 A67 P134 W135 Y256 L258	T61-F63 PolarHBondContact O-N 3.4Å; F63-I66 PolarHBondContact O-N 3.27Å; F63-A67 PolarHBondContact O-N 2.82Å; F63-A67 VanDerWaalsContact O-N 3.1Å; F63-P134 WeakPolarHBondContact CA-O 3.33Å; F63-P134 WeakPolarHBondContact CD2-O 3.33Å; F63-W135 HydrophobicContact CB-CB 4.48Å; F63-Y256 WeakPolarHBondContact CZ-O 3.47Å; F63-L258 HydrophobicContact CB-CD1 3.45Å; F63-L258 VanDerWaalsContact CB-CD1 3.45Å; F63-L258 HydrophobicContact CD1-CB 4.25Å; F63-L258 HydrophobicContact CD1-CD1 4.16Å; F63-L258 HydrophobicContact CD2-CB 4.48Å; F63-L258 HydrophobicContact CD2-CD1 4.23Å; F63-L258 HydrophobicContact CE1-CB 4.39Å; F63-L258 HydrophobicContact CG-CB 4.31Å; F63-L258 HydrophobicContact CG-CD1 3.7Å
64	S	98.5	Very high	98.2	Very high	64 Å²	64	56.7 Å²	56.7	45%	0.448	31%	0.308	S	S	.	.	H	α-helix	trans	-69.8	-31.5	178.9	58.4	0	0	0	0	112.4	T61 A62 A67 H68	T61-S64 PolarHBondContact O-N 3.03Å; T61-S64 PolarHBondContact O-OG 3.4Å; A62-S64 PolarHBondContact O-N 3.07Å; S64-A67 WeakPolarHBondContact O-CB 3.43Å; S64-A67 PolarHBondContact O-N 2.88Å; S64-H68 WeakPolarHBondContact O-CB 3.46Å; S64-H68 PolarHBondContact O-N 3.26Å
65	S	98.6	Very high	98.2	Very high	12 Å²	12	61.1 Å²	61.1	8%	0.084	32%	0.323	C	S	.	.	H	α-helix	trans	-66.6	-37.1	174.2	76	0	0	0	0	112.2	Y55 S56 T61 A62 H68 I69	Y55-S65 VanDerWaalsContact CD2-OG 3.24Å; Y55-S65 WeakPolarHBondContact CD2-OG 3.35Å; S56-S65 PolarHBondContact N-OG 2.74Å; T61-S65 VanDerWaalsContact O-CB 3.27Å; T61-S65 WeakPolarHBondContact O-CB 3.28Å; T61-S65 PolarHBondContact O-N 2.93Å; T61-S65 PolarHBondContact O-OG 2.82Å; A62-S65 PolarHBondContact O-N 2.92Å; A62-S65 PolarHBondContact O-OG 2.84Å; S65-H68 PolarHBondContact O-N 3.41Å; S65-I69 VanDerWaalsContact O-CG1 3.32Å; S65-I69 WeakPolarHBondContact O-CG1 3.36Å; S65-I69 PolarHBondContact O-N 3.47Å
66	I	98.5	Very high	98.2	Very high	26 Å²	26	60 Å²	60	13%	0.133	32%	0.319	C	S	.	.	H	α-helix	trans	-65.8	-40.1	171.1	-64.9	-55.1	0	0	0	111.4	Y55 A62 F63 I69 T70 P134	Y55-I66 HydrophobicContact CD2-CD1 3.69Å; Y55-I66 HydrophobicContact CD2-CG1 4.22Å; Y55-I66 HydrophobicContact CE2-CD1 4.12Å; Y55-I66 HydrophobicContact CE2-CG1 4.28Å; A62-I66 PolarHBondContact O-N 3.37Å; A62-I66 VanDerWaalsContact O-N 3.11Å; F63-I66 PolarHBondContact O-N 3.27Å; I66-I69 HydrophobicContact CD1-CD1 4.17Å; I66-I69 PolarHBondContact O-N 3.07Å; I66-T70 PolarHBondContact O-N 3.48Å; I66-T70 PolarHBondContact O-OG1 3.43Å; I66-P134 HydrophobicContact CG1-CB 4.41Å
67	A	98.4	Very high	98.2	Very high	32 Å²	32	62.9 Å²	62.9	26%	0.264	32%	0.322	S	S	.	.	H	α-helix	trans	-62.7	-43.6	174.5	0	0	0	0	0	111.5	F63 S64 T70 R71	F63-A67 PolarHBondContact O-N 2.82Å; F63-A67 VanDerWaalsContact O-N 3.1Å; S64-A67 WeakPolarHBondContact O-CB 3.43Å; S64-A67 PolarHBondContact O-N 2.88Å; A67-T70 PolarHBondContact O-N 3.43Å; A67-T70 VanDerWaalsContact O-N 3.16Å; A67-R71 WeakPolarHBondContact O-CB 3.43Å; A67-R71 WeakPolarHBondContact O-CG 3.35Å; A67-R71 PolarHBondContact O-N 2.87Å
68	H	98.8	Very high	98.3	Very high	79 Å²	79	62.9 Å²	62.9	37%	0.366	32%	0.32	S	S	.	.	H	α-helix	trans	-60	-46.1	174.4	165.6	-91.9	0	0	0	112	S64 S65 T70 R71 D72 V73	S64-H68 WeakPolarHBondContact O-CB 3.46Å; S64-H68 PolarHBondContact O-N 3.26Å; S65-H68 PolarHBondContact O-N 3.41Å; H68-T70 PolarHBondContact O-N 3.14Å; H68-R71 PolarHBondContact O-N 3.37Å; H68-D72 IonicContact CD2-OD2 3.3Å; H68-D72 PolarHBondContact CD2-OD2 2.86Å; H68-D72 VanDerWaalsContact CD2-OD2 3.3Å; H68-D72 IonicContact CG-OD2 3.9Å; H68-D72 WeakPolarHBondContact O-CB 3.26Å; H68-D72 PolarHBondContact O-N 2.92Å; H68-V73 PolarHBondContact O-N 3.3Å
69	I	98.8	Very high	98.4	Very high	1 Å²	1	62.1 Å²	62.1	1%	0.005	32%	0.316	C	S	.	.	H	α-helix	trans	-54.5	-44.4	173.1	-73.7	167.1	0	0	0	110.9	L51 H54 S65 I66 G76 R80	L51-I69 HydrophobicContact CD2-CD1 4.28Å; L51-I69 HydrophobicContact CD2-CG2 3.56Å; H54-I69 HydrophobicContact CB-CD1 3.88Å; H54-I69 HydrophobicContact CB-CG1 3.51Å; S65-I69 VanDerWaalsContact O-CG1 3.32Å; S65-I69 WeakPolarHBondContact O-CG1 3.36Å; S65-I69 PolarHBondContact O-N 3.47Å; I66-I69 HydrophobicContact CD1-CD1 4.17Å; I66-I69 PolarHBondContact O-N 3.07Å; I69-G76 CarbonylContact O-C 3.36Å; I69-G76 VanDerWaalsContact O-CA 3.22Å; I69-G76 WeakPolarHBondContact O-CA 3.2Å; I69-R80 HydrophobicContact CG2-CB 4.45Å
70	T	98.4	Very high	98.5	Very high	33 Å²	33	63.1 Å²	63.1	20%	0.202	32%	0.315	C	S	.	.	H	α-helix	trans	-73.1	-33.1	-175	-50.8	0	0	0	0	112.1	I66 A67 H68 W77 R80	I66-T70 PolarHBondContact O-N 3.48Å; I66-T70 PolarHBondContact O-OG1 3.43Å; A67-T70 PolarHBondContact O-N 3.43Å; A67-T70 VanDerWaalsContact O-N 3.16Å; H68-T70 PolarHBondContact O-N 3.14Å; T70-W77 HydrophobicContact CG2-CB 3.96Å; T70-W77 WeakPolarHBondContact O-CB 3.42Å; T70-R80 WeakPolarHBondContact OG1-CD 3.38Å
71	R	98.6	Very high	98.6	Very high	205 Å²	205	60 Å²	60	77%	0.774	29%	0.289	S	S	*	.	H	α-helix	trans	-102.7	-36.6	-169	-66.4	177.4	177.7	-166.7	-0.7	114.1	A67 H68	A67-R71 WeakPolarHBondContact O-CB 3.43Å; A67-R71 WeakPolarHBondContact O-CG 3.35Å; A67-R71 PolarHBondContact O-N 2.87Å; H68-R71 PolarHBondContact O-N 3.37Å
72	D	98.6	Very high	98.6	Very high	108 Å²	108	59.1 Å²	59.1	58%	0.578	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.8	-26.9	-164.8	-52.4	-41.4	0	0	0	112.6	H68	H68-D72 IonicContact CD2-OD2 3.3Å; H68-D72 PolarHBondContact CD2-OD2 2.86Å; H68-D72 VanDerWaalsContact CD2-OD2 3.3Å; H68-D72 IonicContact CG-OD2 3.9Å; H68-D72 WeakPolarHBondContact O-CB 3.26Å; H68-D72 PolarHBondContact O-N 2.92Å
73	V	98.8	Very high	98.7	Very high	27 Å²	27	60.7 Å²	60.7	16%	0.164	29%	0.29	C	S	.	.	S	Bend	trans	-79.1	129.1	176.9	179.4	0	0	0	0	110.2	H54 H68 Y75 G76	H54-V73 HydrophobicContact CB-CG2 4.37Å; H68-V73 PolarHBondContact O-N 3.3Å; V73-Y75 PolarHBondContact O-N 3.2Å; V73-Y75 VanDerWaalsContact O-N 3.15Å; V73-G76 PolarHBondContact O-N 3.12Å
74	N	98.6	Very high	98.7	Very high	144 Å²	144	60.5 Å²	60.5	77%	0.77	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	120.5	176	-69.6	-39.2	0	0	0	110.9	G76	N74-G76 PolarHBondContact O-N 2.96Å; N74-G76 VanDerWaalsContact O-N 3.09Å
75	Y	98.6	Very high	98.7	Very high	174 Å²	174	57.7 Å²	57.7	68%	0.682	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	13.4	-174.6	-55.4	-78.7	0	0	0	114.9	V73 W77 I78 I79	V73-Y75 PolarHBondContact O-N 3.2Å; V73-Y75 VanDerWaalsContact O-N 3.15Å; Y75-W77 VanDerWaalsContact C-N 3.29Å; Y75-W77 PolarHBondContact O-N 3.4Å; Y75-I78 HydrophobicContact CD1-CG2 4.28Å; Y75-I78 WeakPolarHBondContact O-CG2 3.21Å; Y75-I78 PolarHBondContact O-N 2.84Å; Y75-I79 WeakPolarHBondContact O-CG1 3.3Å; Y75-I79 PolarHBondContact O-N 3.16Å; Y75-I79 VanDerWaalsContact O-N 3.14Å
76	G	98.8	Very high	98.7	Very high	2 Å²	2	57.1 Å²	57.1	2%	0.021	27%	0.274	C	S	.	.	H	α-helix	trans	-64.7	-32.9	-179	0	0	0	0	0	112.9	I69 V73 N74 I78 I79 R80	I69-G76 CarbonylContact O-C 3.36Å; I69-G76 VanDerWaalsContact O-CA 3.22Å; I69-G76 WeakPolarHBondContact O-CA 3.2Å; V73-G76 PolarHBondContact O-N 3.12Å; N74-G76 PolarHBondContact O-N 2.96Å; N74-G76 VanDerWaalsContact O-N 3.09Å; G76-I78 PolarHBondContact O-N 3.4Å; G76-I79 PolarHBondContact O-N 3.31Å; G76-R80 WeakPolarHBondContact O-CB 3.34Å; G76-R80 PolarHBondContact O-N 2.98Å
77	W	98.6	Very high	98.7	Very high	108 Å²	108	56.9 Å²	56.9	41%	0.409	28%	0.276	S	S	.	.	H	α-helix	trans	-57.8	-47.5	172.9	69.1	-90.3	0	0	0	112.5	T70 Y75 R80 Y81 L244	T70-W77 HydrophobicContact CG2-CB 3.96Å; T70-W77 WeakPolarHBondContact O-CB 3.42Å; Y75-W77 VanDerWaalsContact C-N 3.29Å; Y75-W77 PolarHBondContact O-N 3.4Å; W77-R80 PolarHBondContact O-N 2.96Å; W77-Y81 HydrophobicContact CE3-CD2 4.05Å; W77-Y81 HydrophobicContact CE3-CE2 4.46Å; W77-Y81 WeakPolarHBondContact O-CD2 3.45Å; W77-Y81 PolarHBondContact O-N 3.22Å; W77-L244 HydrophobicContact CH2-CD2 3.94Å; W77-L244 HydrophobicContact CZ3-CD2 4.26Å
78	I	98.7	Very high	98.7	Very high	32 Å²	32	55.5 Å²	55.5	16%	0.164	27%	0.265	C	S	.	.	H	α-helix	trans	-72.4	-37	-177.6	-176.4	164.3	0	0	0	110.8	Y75 G76 R80 Y81 L82 M240 T243 L244	Y75-I78 HydrophobicContact CD1-CG2 4.28Å; Y75-I78 WeakPolarHBondContact O-CG2 3.21Å; Y75-I78 PolarHBondContact O-N 2.84Å; G76-I78 PolarHBondContact O-N 3.4Å; I78-R80 VanDerWaalsContact C-N 3.34Å; I78-R80 PolarHBondContact O-N 3.37Å; I78-Y81 PolarHBondContact O-N 3.04Å; I78-L82 HydrophobicContact CG1-CD1 4Å; I78-L82 HydrophobicContact CG1-CG 4.14Å; I78-L82 VanDerWaalsContact O-CB 3.27Å; I78-L82 WeakPolarHBondContact O-CB 3.49Å; I78-L82 WeakPolarHBondContact O-CG 3.5Å; I78-L82 PolarHBondContact O-N 3.35Å; I78-M240 HydrophobicContact CD1-CE 4.21Å; I78-T243 HydrophobicContact CG1-CG2 4.35Å; I78-L244 HydrophobicContact CD1-CD2 3.95Å
79	I	98.8	Very high	98.7	Very high	40 Å²	40	52.7 Å²	52.7	21%	0.205	25%	0.252	C	S	.	.	H	α-helix	trans	-61.4	-44.6	173.6	-62.5	170	0	0	0	110.2	T47 F50 L51 Y75 G76 L82 H83	T47-I79 HydrophobicContact CG2-CG2 4.35Å; F50-I79 HydrophobicContact CB-CD1 4.34Å; F50-I79 HydrophobicContact CB-CG2 4.16Å; L51-I79 HydrophobicContact CD1-CG2 4.5Å; L51-I79 HydrophobicContact CD2-CB 4.49Å; L51-I79 HydrophobicContact CD2-CG2 3.92Å; L51-I79 HydrophobicContact CG-CG2 3.84Å; Y75-I79 WeakPolarHBondContact O-CG1 3.3Å; Y75-I79 PolarHBondContact O-N 3.16Å; Y75-I79 VanDerWaalsContact O-N 3.14Å; G76-I79 PolarHBondContact O-N 3.31Å; I79-L82 PolarHBondContact O-N 3.32Å; I79-H83 WeakPolarHBondContact O-CB 3.49Å; I79-H83 PolarHBondContact O-N 3.38Å
80	R	98.8	Very high	98.7	Very high	41 Å²	41	53.5 Å²	53.5	16%	0.155	26%	0.255	C	S	.	.	H	α-helix	trans	-59.8	-49.6	176.8	179.8	-176.2	175.4	-100.9	2.2	111.5	L51 I69 T70 G76 W77 I78 H83 A84 Y256	L51-R80 HydrophobicContact CD2-CB 4.09Å; I69-R80 HydrophobicContact CG2-CB 4.45Å; T70-R80 WeakPolarHBondContact OG1-CD 3.38Å; G76-R80 WeakPolarHBondContact O-CB 3.34Å; G76-R80 PolarHBondContact O-N 2.98Å; W77-R80 PolarHBondContact O-N 2.96Å; I78-R80 VanDerWaalsContact C-N 3.34Å; I78-R80 PolarHBondContact O-N 3.37Å; R80-H83 PolarHBondContact O-N 3.06Å; R80-A84 WeakPolarHBondContact O-CB 3.46Å; R80-A84 PolarHBondContact O-N 3.09Å; R80-Y256 PolarHBondContact NH1-OH 2.8Å
81	Y	98.8	Very high	98.7	Very high	30 Å²	30	52 Å²	52	12%	0.118	25%	0.246	C	C	.	.	H	α-helix	trans	-72.4	-31.9	-178.1	-69.4	-59.5	0	0	0	113.1	W77 I78 H83 A84 N85 P247 Y256	W77-Y81 HydrophobicContact CE3-CD2 4.05Å; W77-Y81 HydrophobicContact CE3-CE2 4.46Å; W77-Y81 WeakPolarHBondContact O-CD2 3.45Å; W77-Y81 PolarHBondContact O-N 3.22Å; I78-Y81 PolarHBondContact O-N 3.04Å; Y81-H83 VanDerWaalsContact C-N 3.31Å; Y81-A84 PolarHBondContact O-N 2.85Å; Y81-N85 VanDerWaalsContact O-CB 3.24Å; Y81-N85 WeakPolarHBondContact O-CB 3.36Å; Y81-N85 PolarHBondContact O-N 3.3Å; Y81-N85 PolarHBondContact O-ND2 3.34Å; Y81-P247 HydrophobicContact CD1-CB 3.57Å; Y81-P247 HydrophobicContact CD2-CB 4.04Å; Y81-P247 HydrophobicContact CE1-CB 3.77Å; Y81-P247 HydrophobicContact CE2-CB 4.23Å; Y81-P247 HydrophobicContact CG-CB 3.73Å; Y81-Y256 PolarHBondContact OH-OH 3.02Å
82	L	98.9	Very high	98.8	Very high	29 Å²	29	45 Å²	45	15%	0.152	22%	0.224	C	C	.	.	H	α-helix	trans	-61.5	-41	169.1	-77.5	172.5	0	0	0	111.2	T47 I78 I79 G86 L239 M240 T243	T47-L82 HydrophobicContact CG2-CB 4.08Å; I78-L82 HydrophobicContact CG1-CD1 4Å; I78-L82 HydrophobicContact CG1-CG 4.14Å; I78-L82 VanDerWaalsContact O-CB 3.27Å; I78-L82 WeakPolarHBondContact O-CB 3.49Å; I78-L82 WeakPolarHBondContact O-CG 3.5Å; I78-L82 PolarHBondContact O-N 3.35Å; I79-L82 PolarHBondContact O-N 3.32Å; L82-G86 WeakPolarHBondContact O-CA 3.35Å; L82-G86 PolarHBondContact O-N 3.42Å; L82-L239 HydrophobicContact CD2-CD2 3.91Å; L82-L239 HydrophobicContact CD2-CG 4.05Å; L82-M240 HydrophobicContact CD2-SD 3.86Å; L82-T243 HydrophobicContact CD2-CG2 4.18Å; L82-T243 HydrophobicContact CG-CG2 4.19Å
83	H	98.9	Very high	98.8	Very high	32 Å²	32	40 Å²	40	15%	0.148	20%	0.197	C	C	.	.	H	α-helix	trans	-68	-43.9	177.6	-164.8	80.9	0	0	0	112.2	Q44 T47 G48 L51 I79 R80 Y81 A87 H182	Q44-H83 PolarHBondContact NE2-O 3.44Å; Q44-H83 PolarHBondContact O-CE1 3.28Å; Q44-H83 VanDerWaalsContact O-CE1 3.26Å; Q44-H83 PolarHBondContact O-ND1 3.41Å; Q44-H83 PolarHBondContact OE1-O 3.03Å; T47-H83 PolarHBondContact OG1-ND1 3.16Å; G48-H83 VanDerWaalsContact CA-CE1 3.43Å; G48-H83 WeakPolarHBondContact CA-CE1 3.48Å; G48-H83 PolarHBondContact N-ND1 3.47Å; L51-H83 HydrophobicContact CD1-CB 3.5Å; I79-H83 WeakPolarHBondContact O-CB 3.49Å; I79-H83 PolarHBondContact O-N 3.38Å; R80-H83 PolarHBondContact O-N 3.06Å; Y81-H83 VanDerWaalsContact C-N 3.31Å; H83-A87 PolarHBondContact O-N 2.86Å; H83-A87 VanDerWaalsContact O-N 3.14Å; H83-H182 AromaticContact NE2-NE2 3.95Å
84	A	98.8	Very high	98.8	Very high	51 Å²	51	39.4 Å²	39.4	42%	0.421	19%	0.193	S	C	.	.	H	α-helix	trans	-69.3	-51.9	-179.6	0	0	0	0	0	112.2	R80 Y81 G86 A87	R80-A84 WeakPolarHBondContact O-CB 3.46Å; R80-A84 PolarHBondContact O-N 3.09Å; Y81-A84 PolarHBondContact O-N 2.85Å; A84-G86 VanDerWaalsContact C-N 3.34Å; A84-A87 WeakPolarHBondContact O-CB 3.28Å; A84-A87 PolarHBondContact O-N 3.44Å
85	N	98.9	Very high	98.8	Very high	5 Å²	5	35.8 Å²	35.8	3%	0.027	17%	0.17	C	C	.	.	H	α-helix	trans	-71.5	-31.2	177.9	-71	-52	0	0	0	112	Y81 A87 S88 M89 L239 L242 P247	Y81-N85 VanDerWaalsContact O-CB 3.24Å; Y81-N85 WeakPolarHBondContact O-CB 3.36Å; Y81-N85 PolarHBondContact O-N 3.3Å; Y81-N85 PolarHBondContact O-ND2 3.34Å; N85-A87 VanDerWaalsContact C-N 3.29Å; N85-A87 PolarHBondContact O-N 2.89Å; N85-S88 WeakPolarHBondContact O-CB 3.41Å; N85-S88 PolarHBondContact O-N 2.89Å; N85-S88 VanDerWaalsContact O-N 3.14Å; N85-M89 WeakPolarHBondContact O-CG 3.47Å; N85-M89 PolarHBondContact O-N 2.97Å; N85-L239 HydrophobicContact CB-CD1 3.91Å; N85-L242 HydrophobicContact CB-CD2 3.79Å; N85-L242 HydrophobicContact CB-CG 4.19Å; N85-L242 WeakPolarHBondContact OD1-CD2 3.44Å; N85-P247 PolarHBondContact ND2-O 3.32Å; N85-P247 PolarHBondContact OD1-O 2.72Å
86	G	98.9	Very high	98.8	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-60.3	-36.2	172.1	0	0	0	0	0	112.7	Q44 L82 A84 M89 F90	Q44-G86 VanDerWaalsContact OE1-C 3.23Å; L82-G86 WeakPolarHBondContact O-CA 3.35Å; L82-G86 PolarHBondContact O-N 3.42Å; A84-G86 VanDerWaalsContact C-N 3.34Å; G86-M89 PolarHBondContact O-N 2.79Å; G86-F90 WeakPolarHBondContact O-CB 3.43Å; G86-F90 PolarHBondContact O-N 3.04Å
87	A	98.8	Very high	98.8	Very high	21 Å²	21	32 Å²	32	17%	0.174	16%	0.16	C	C	.	.	H	α-helix	trans	-62.3	-43.5	172.3	0	0	0	0	0	111.8	H83 A84 N85 F90 F91	H83-A87 PolarHBondContact O-N 2.86Å; H83-A87 VanDerWaalsContact O-N 3.14Å; A84-A87 WeakPolarHBondContact O-CB 3.28Å; A84-A87 PolarHBondContact O-N 3.44Å; N85-A87 VanDerWaalsContact C-N 3.29Å; N85-A87 PolarHBondContact O-N 2.89Å; A87-F90 VanDerWaalsContact O-CB 3.29Å; A87-F90 WeakPolarHBondContact O-CB 3.38Å; A87-F90 PolarHBondContact O-N 2.67Å; A87-F91 WeakPolarHBondContact O-CD2 3.32Å; A87-F91 PolarHBondContact O-N 3.13Å; A87-F91 VanDerWaalsContact O-N 3.16Å
88	S	98.8	Very high	98.8	Very high	4 Å²	4	28.3 Å²	28.3	3%	0.028	15%	0.148	C	C	.	.	H	α-helix	trans	-62.4	-45	174.1	-73	0	0	0	0	112	N85 F90 F91 I92 L250 W272	N85-S88 WeakPolarHBondContact O-CB 3.41Å; N85-S88 PolarHBondContact O-N 2.89Å; N85-S88 VanDerWaalsContact O-N 3.14Å; S88-F90 PolarHBondContact O-N 3.18Å; S88-F91 PolarHBondContact O-N 2.95Å; S88-F91 VanDerWaalsContact O-N 3.15Å; S88-I92 WeakPolarHBondContact O-CG1 3.37Å; S88-I92 PolarHBondContact O-N 3.37Å; S88-L250 VanDerWaalsContact CB-CD1 3.48Å; S88-W272 PolarHBondContact OG-NE1 2.96Å
89	M	98.8	Very high	98.8	Very high	20 Å²	20	27.2 Å²	27.2	10%	0.099	15%	0.145	C	C	.	.	H	α-helix	trans	-61.5	-34.8	176.2	-67.9	-57.9	-65.6	0	0	112.2	N85 G86 I92 C93 F235 S238 L239	N85-M89 WeakPolarHBondContact O-CG 3.47Å; N85-M89 PolarHBondContact O-N 2.97Å; G86-M89 PolarHBondContact O-N 2.79Å; M89-I92 PolarHBondContact O-N 2.85Å; M89-I92 HydrophobicContact SD-CD1 3.96Å; M89-C93 WeakPolarHBondContact O-CB 3.33Å; M89-C93 PolarHBondContact O-N 3.48Å; M89-C93 PolarHBondContact O-SG 3.39Å; M89-C93 VanDerWaalsContact O-SG 3.38Å; M89-F235 HydrophobicContact CB-CE2 3.7Å; M89-F235 HydrophobicContact CB-CZ 3.99Å; M89-F235 HydrophobicContact CE-CD2 3.87Å; M89-F235 HydrophobicContact CE-CE2 3.91Å; M89-F235 HydrophobicContact CG-CE2 4.4Å; M89-S238 WeakPolarHBondContact CE-OG 3.17Å; M89-L239 HydrophobicContact CG-CB 4.36Å; M89-L239 HydrophobicContact CG-CD1 3.88Å
90	F	98.8	Very high	98.8	Very high	17 Å²	17	26.4 Å²	26.4	8%	0.075	14%	0.139	C	C	.	.	H	α-helix	trans	-59.7	-48.5	173.2	-155	-19.6	0	0	0	110.9	L37 C40 L41 Q44 G86 A87 S88 C93 L94 T123	L37-F90 HydrophobicContact CB-CE1 4.45Å; L37-F90 HydrophobicContact CD2-CD1 3.47Å; L37-F90 VanDerWaalsContact CD2-CD1 3.47Å; L37-F90 HydrophobicContact CD2-CE1 3.51Å; C40-F90 HydrophobicContact CB-CB 4.02Å; C40-F90 HydrophobicContact CB-CD1 3.88Å; C40-F90 HydrophobicContact CB-CD2 3.95Å; C40-F90 HydrophobicContact CB-CE1 4.32Å; C40-F90 HydrophobicContact CB-CE2 4.38Å; C40-F90 HydrophobicContact CB-CG 3.67Å; L41-F90 HydrophobicContact CB-CE2 4.35Å; L41-F90 HydrophobicContact CB-CZ 4.19Å; L41-F90 HydrophobicContact CD1-CE2 4.27Å; L41-F90 HydrophobicContact CD1-CZ 4.42Å; Q44-F90 HydrophobicContact CG-CD2 3.97Å; Q44-F90 HydrophobicContact CG-CE2 4.45Å; G86-F90 WeakPolarHBondContact O-CB 3.43Å; G86-F90 PolarHBondContact O-N 3.04Å; A87-F90 VanDerWaalsContact O-CB 3.29Å; A87-F90 WeakPolarHBondContact O-CB 3.38Å; A87-F90 PolarHBondContact O-N 2.67Å; S88-F90 PolarHBondContact O-N 3.18Å; F90-C93 PolarHBondContact O-N 2.8Å; F90-L94 HydrophobicContact CD1-CD1 4.07Å; F90-L94 HydrophobicContact CD1-CG 4.04Å; F90-L94 HydrophobicContact CE1-CD1 4.28Å; F90-L94 HydrophobicContact CE1-CG 4.24Å; F90-L94 WeakPolarHBondContact O-CB 3.48Å; F90-L94 WeakPolarHBondContact O-CG 3.33Å; F90-L94 PolarHBondContact O-N 2.93Å; F90-T123 HydrophobicContact CD1-CG2 4.48Å; F90-T123 HydrophobicContact CD2-CG2 4.29Å; F90-T123 HydrophobicContact CE1-CG2 4.35Å; F90-T123 HydrophobicContact CE2-CG2 4.16Å; F90-T123 HydrophobicContact CG-CG2 4.47Å; F90-T123 HydrophobicContact CZ-CG2 4.19Å
91	F	98.9	Very high	98.8	Very high	2 Å²	2	24.6 Å²	24.6	1%	0.009	13%	0.133	C	C	.	.	H	α-helix	trans	-67.1	-37	177.8	-82.3	-80.3	0	0	0	113.5	A87 S88 C93 L94 F95 T123 M124 A127 W272 Y273	A87-F91 WeakPolarHBondContact O-CD2 3.32Å; A87-F91 PolarHBondContact O-N 3.13Å; A87-F91 VanDerWaalsContact O-N 3.16Å; S88-F91 PolarHBondContact O-N 2.95Å; S88-F91 VanDerWaalsContact O-N 3.15Å; F91-C93 VanDerWaalsContact C-N 3.35Å; F91-C93 PolarHBondContact O-N 3.38Å; F91-L94 HydrophobicContact CD1-CD1 4.18Å; F91-L94 HydrophobicContact CE1-CD1 4.27Å; F91-L94 PolarHBondContact O-N 2.96Å; F91-F95 HydrophobicContact CB-CD2 4.49Å; F91-F95 HydrophobicContact CB-CE2 4.03Å; F91-F95 HydrophobicContact CB-CZ 4.44Å; F91-F95 HydrophobicContact CD1-CE1 4.31Å; F91-F95 HydrophobicContact CD1-CE2 4.27Å; F91-F95 AromaticContact CD1-CZ 3.83Å; F91-F95 HydrophobicContact CD1-CZ 3.83Å; F91-F95 WeakPolarHBondContact O-CD2 3.49Å; F91-F95 VanDerWaalsContact O-CG 3.28Å; F91-F95 WeakPolarHBondContact O-CG 3.48Å; F91-F95 PolarHBondContact O-N 3.43Å; F91-T123 HydrophobicContact CE2-CG2 4.39Å; F91-T123 HydrophobicContact CZ-CG2 4.14Å; F91-M124 HydrophobicContact CE1-CG 3.83Å; F91-M124 HydrophobicContact CZ-CG 4.16Å; F91-A127 HydrophobicContact CE2-CB 3.5Å; F91-A127 VanDerWaalsContact CE2-CB 3.5Å; F91-A127 HydrophobicContact CZ-CB 3.88Å; F91-W272 HydrophobicContact CB-CH2 4.09Å; F91-W272 HydrophobicContact CB-CZ2 4.11Å; F91-Y273 HydrophobicContact CB-CD1 4.24Å; F91-Y273 HydrophobicContact CB-CG 3.97Å; F91-Y273 AromaticContact CD1-CD2 3.97Å; F91-Y273 HydrophobicContact CD1-CD2 3.97Å; F91-Y273 HydrophobicContact CD1-CG 4.01Å; F91-Y273 AromaticContact CD2-CD1 3.75Å; F91-Y273 HydrophobicContact CD2-CD1 3.75Å; F91-Y273 AromaticContact CD2-CD2 3.52Å; F91-Y273 HydrophobicContact CD2-CD2 3.52Å; F91-Y273 HydrophobicContact CD2-CE1 4.07Å; F91-Y273 AromaticContact CD2-CE2 3.79Å; F91-Y273 HydrophobicContact CD2-CE2 3.79Å; F91-Y273 AromaticContact CD2-CG 3.5Å; F91-Y273 HydrophobicContact CD2-CG 3.5Å; F91-Y273 VanDerWaalsContact CD2-CG 3.5Å; F91-Y273 AromaticContact CE1-CD2 3.91Å; F91-Y273 HydrophobicContact CE1-CD2 3.91Å; F91-Y273 HydrophobicContact CE1-CG 4.41Å; F91-Y273 HydrophobicContact CE2-CD1 4.4Å; F91-Y273 AromaticContact CE2-CD2 3.46Å; F91-Y273 HydrophobicContact CE2-CD2 3.46Å; F91-Y273 VanDerWaalsContact CE2-CD2 3.46Å; F91-Y273 HydrophobicContact CE2-CE1 4.43Å; F91-Y273 AromaticContact CE2-CE2 3.43Å; F91-Y273 HydrophobicContact CE2-CE2 3.43Å; F91-Y273 VanDerWaalsContact CE2-CE2 3.43Å; F91-Y273 AromaticContact CE2-CG 3.97Å; F91-Y273 HydrophobicContact CE2-CG 3.97Å; F91-Y273 AromaticContact CE2-CZ 3.98Å; F91-Y273 HydrophobicContact CG-CD1 4.06Å; F91-Y273 AromaticContact CG-CD2 3.79Å; F91-Y273 HydrophobicContact CG-CD2 3.79Å; F91-Y273 HydrophobicContact CG-CE2 4.5Å; F91-Y273 AromaticContact CG-CG 3.53Å; F91-Y273 HydrophobicContact CG-CG 3.53Å; F91-Y273 AromaticContact CZ-CD2 3.67Å; F91-Y273 HydrophobicContact CZ-CD2 3.67Å; F91-Y273 AromaticContact CZ-CE2 3.87Å; F91-Y273 HydrophobicContact CZ-CE2 3.87Å; F91-Y273 HydrophobicContact CZ-CG 4.4Å
92	I	98.9	Very high	98.8	Very high	59 Å²	59	24.4 Å²	24.4	30%	0.303	13%	0.134	S	C	.	.	H	α-helix	trans	-57.8	-50.8	171.9	-67.3	168.7	0	0	0	109.6	S88 M89 L94 F95 L96 W272	S88-I92 WeakPolarHBondContact O-CG1 3.37Å; S88-I92 PolarHBondContact O-N 3.37Å; M89-I92 PolarHBondContact O-N 2.85Å; M89-I92 HydrophobicContact SD-CD1 3.96Å; I92-L94 VanDerWaalsContact C-N 3.31Å; I92-L94 PolarHBondContact O-N 3.3Å; I92-F95 PolarHBondContact O-N 2.9Å; I92-L96 HydrophobicContact CG2-CD1 3.79Å; I92-L96 VanDerWaalsContact O-CG 3.25Å; I92-L96 WeakPolarHBondContact O-CG 3.42Å; I92-L96 PolarHBondContact O-N 2.94Å; I92-L96 VanDerWaalsContact O-N 3.08Å; I92-W272 HydrophobicContact CD1-CZ2 4.3Å; I92-W272 HydrophobicContact CG1-CH2 3.56Å; I92-W272 HydrophobicContact CG1-CZ2 3.72Å
93	C	98.9	Very high	98.8	Very high	3 Å²	3	24.6 Å²	24.6	2%	0.02	13%	0.133	C	C	.	.	H	α-helix	trans	-61.3	-38.5	176.9	-69.9	0	0	0	0	112.4	F33 L37 M89 F90 F91 H97	F33-C93 HydrophobicContact CD1-CB 4.09Å; L37-C93 HydrophobicContact CD2-CB 3.62Å; L37-C93 HydrophobicContact CG-CB 4.04Å; M89-C93 WeakPolarHBondContact O-CB 3.33Å; M89-C93 PolarHBondContact O-N 3.48Å; M89-C93 PolarHBondContact O-SG 3.39Å; M89-C93 VanDerWaalsContact O-SG 3.38Å; F90-C93 PolarHBondContact O-N 2.8Å; F91-C93 VanDerWaalsContact C-N 3.35Å; F91-C93 PolarHBondContact O-N 3.38Å; C93-H97 WeakPolarHBondContact O-CB 3.41Å; C93-H97 PolarHBondContact O-N 3.18Å
94	L	98.8	Very high	98.8	Very high	14 Å²	14	24.2 Å²	24.2	7%	0.073	13%	0.13	C	C	.	.	H	α-helix	trans	-64.1	-50	179	-84.8	172	0	0	0	111	L37 F90 F91 I92 L96 H97 I98 L120 T123	L37-L94 HydrophobicContact CD1-CD2 4.03Å; L37-L94 HydrophobicContact CD2-CB 4.28Å; L37-L94 HydrophobicContact CD2-CD2 3.74Å; L37-L94 HydrophobicContact CD2-CG 3.57Å; F90-L94 HydrophobicContact CD1-CD1 4.07Å; F90-L94 HydrophobicContact CD1-CG 4.04Å; F90-L94 HydrophobicContact CE1-CD1 4.28Å; F90-L94 HydrophobicContact CE1-CG 4.24Å; F90-L94 WeakPolarHBondContact O-CB 3.48Å; F90-L94 WeakPolarHBondContact O-CG 3.33Å; F90-L94 PolarHBondContact O-N 2.93Å; F91-L94 HydrophobicContact CD1-CD1 4.18Å; F91-L94 HydrophobicContact CE1-CD1 4.27Å; F91-L94 PolarHBondContact O-N 2.96Å; I92-L94 VanDerWaalsContact C-N 3.31Å; I92-L94 PolarHBondContact O-N 3.3Å; L94-L96 VanDerWaalsContact C-N 3.33Å; L94-L96 PolarHBondContact O-N 3.48Å; L94-H97 WeakPolarHBondContact O-CB 3.37Å; L94-H97 PolarHBondContact O-N 3.33Å; L94-I98 VanDerWaalsContact O-CG1 3.28Å; L94-I98 WeakPolarHBondContact O-CG1 3.29Å; L94-I98 PolarHBondContact O-N 3.25Å; L94-L120 HydrophobicContact CD1-CD1 4.38Å; L94-T123 HydrophobicContact CD1-CG2 3.74Å
95	F	98.9	Very high	98.8	Very high	67 Å²	67	21.8 Å²	21.8	29%	0.294	11%	0.11	S	C	.	.	H	α-helix	trans	-63.9	-39.3	-179.2	-62.4	-37.4	0	0	0	111.9	F91 I92 I98 G99 W272 Y273 F276	F91-F95 HydrophobicContact CB-CD2 4.49Å; F91-F95 HydrophobicContact CB-CE2 4.03Å; F91-F95 HydrophobicContact CB-CZ 4.44Å; F91-F95 HydrophobicContact CD1-CE1 4.31Å; F91-F95 HydrophobicContact CD1-CE2 4.27Å; F91-F95 AromaticContact CD1-CZ 3.83Å; F91-F95 HydrophobicContact CD1-CZ 3.83Å; F91-F95 WeakPolarHBondContact O-CD2 3.49Å; F91-F95 VanDerWaalsContact O-CG 3.28Å; F91-F95 WeakPolarHBondContact O-CG 3.48Å; F91-F95 PolarHBondContact O-N 3.43Å; I92-F95 PolarHBondContact O-N 2.9Å; F95-I98 PolarHBondContact O-N 3.47Å; F95-G99 PolarHBondContact O-N 3.39Å; F95-W272 HydrophobicContact CD2-CH2 4.17Å; F95-W272 HydrophobicContact CD2-CZ3 4.13Å; F95-W272 HydrophobicContact CE2-CH2 4Å; F95-W272 AromaticContact CE2-CZ3 3.81Å; F95-W272 HydrophobicContact CE2-CZ3 3.81Å; F95-Y273 WeakPolarHBondContact CZ-O 3.32Å; F95-F276 HydrophobicContact CE1-CE1 4.44Å; F95-F276 HydrophobicContact CZ-CE1 4.31Å
96	L	98.9	Very high	98.8	Very high	60 Å²	60	22.5 Å²	22.5	31%	0.314	12%	0.116	S	C	.	.	H	α-helix	trans	-68.8	-36.3	175	-62.3	170.4	0	0	0	111.9	W30 F33 I92 L94 G99 R100	W30-L96 HydrophobicContact CZ3-CD2 4.04Å; F33-L96 HydrophobicContact CD1-CB 4.06Å; F33-L96 HydrophobicContact CD1-CD1 4.35Å; F33-L96 HydrophobicContact CD2-CB 3.89Å; F33-L96 HydrophobicContact CE1-CB 3.92Å; F33-L96 HydrophobicContact CE1-CD1 3.46Å; F33-L96 VanDerWaalsContact CE1-CD1 3.46Å; F33-L96 HydrophobicContact CE1-CG 4.33Å; F33-L96 HydrophobicContact CE2-CB 3.75Å; F33-L96 HydrophobicContact CE2-CD1 4.13Å; F33-L96 HydrophobicContact CE2-CG 4.5Å; F33-L96 HydrophobicContact CG-CB 4.07Å; F33-L96 HydrophobicContact CZ-CB 3.77Å; F33-L96 HydrophobicContact CZ-CD1 3.34Å; F33-L96 HydrophobicContact CZ-CG 4.14Å; I92-L96 HydrophobicContact CG2-CD1 3.79Å; I92-L96 VanDerWaalsContact O-CG 3.25Å; I92-L96 WeakPolarHBondContact O-CG 3.42Å; I92-L96 PolarHBondContact O-N 2.94Å; I92-L96 VanDerWaalsContact O-N 3.08Å; L94-L96 VanDerWaalsContact C-N 3.33Å; L94-L96 PolarHBondContact O-N 3.48Å; L96-G99 PolarHBondContact O-N 3.39Å; L96-R100 WeakPolarHBondContact O-CB 3.48Å; L96-R100 PolarHBondContact O-N 3.08Å
97	H	98.9	Very high	98.8	Very high	37 Å²	37	23 Å²	23	17%	0.171	12%	0.118	C	C	.	.	H	α-helix	trans	-65.1	-43.2	175	-168.6	102.4	0	0	0	112.3	F33 G34 L37 C93 L94 R100 G101	F33-H97 HydrophobicContact CB-CB 3.94Å; G34-H97 PolarHBondContact N-ND1 2.92Å; L37-H97 HydrophobicContact CD1-CB 3.77Å; C93-H97 WeakPolarHBondContact O-CB 3.41Å; C93-H97 PolarHBondContact O-N 3.18Å; L94-H97 WeakPolarHBondContact O-CB 3.37Å; L94-H97 PolarHBondContact O-N 3.33Å; H97-R100 PolarHBondContact CE1-NH2 3.21Å; H97-R100 PolarHBondContact ND1-NH2 3.08Å; H97-R100 PolarHBondContact NE2-NH2 2.89Å; H97-G101 PolarHBondContact O-N 2.66Å; H97-G101 VanDerWaalsContact O-N 3.07Å
98	I	98.9	Very high	98.8	Very high	30 Å²	30	25.2 Å²	25.2	15%	0.154	13%	0.127	C	C	.	.	H	α-helix	trans	-65.7	-47.6	175.1	-67	163.5	0	0	0	109.9	L94 F95 R100 G101 L102 W113 L120 L301	L94-I98 VanDerWaalsContact O-CG1 3.28Å; L94-I98 WeakPolarHBondContact O-CG1 3.29Å; L94-I98 PolarHBondContact O-N 3.25Å; F95-I98 PolarHBondContact O-N 3.47Å; I98-R100 VanDerWaalsContact C-N 3.33Å; I98-R100 PolarHBondContact O-N 3.26Å; I98-G101 CarbonylContact O-C 3.57Å; I98-G101 WeakPolarHBondContact O-CA 3.48Å; I98-G101 PolarHBondContact O-N 3.38Å; I98-L102 HydrophobicContact CG2-CD1 4.19Å; I98-L102 HydrophobicContact CG2-CG 4.39Å; I98-L102 WeakPolarHBondContact O-CG 3.47Å; I98-L102 PolarHBondContact O-N 2.88Å; I98-W113 HydrophobicContact CG2-CH2 4.14Å; I98-L120 HydrophobicContact CD1-CD1 4.1Å; I98-L120 HydrophobicContact CD1-CD2 3.87Å; I98-L120 HydrophobicContact CD1-CG 4.45Å; I98-L301 HydrophobicContact CG2-CD1 4.44Å; I98-L301 HydrophobicContact CG2-CD2 4.14Å
99	G	98.9	Very high	98.7	Very high	10 Å²	10	27.4 Å²	27.4	10%	0.103	14%	0.135	C	C	.	.	H	α-helix	trans	-56.9	-44.7	177.5	0	0	0	0	0	112.4	F95 L96 G101 L102 Y103 Y325	F95-G99 PolarHBondContact O-N 3.39Å; L96-G99 PolarHBondContact O-N 3.39Å; G99-G101 VanDerWaalsContact C-N 3.3Å; G99-G101 PolarHBondContact O-N 2.88Å; G99-L102 PolarHBondContact O-N 3.25Å; G99-Y103 WeakPolarHBondContact O-CB 3.34Å; G99-Y103 PolarHBondContact O-N 3.48Å; G99-Y325 WeakPolarHBondContact O-CE2 3.34Å; G99-Y325 PolarHBondContact O-OH 3.08Å
100	R	98.9	Very high	98.6	Very high	22 Å²	22	28.8 Å²	28.8	8%	0.083	15%	0.146	C	C	.	.	H	α-helix	trans	-54.7	-47.6	169.5	178	-76.8	-65.9	-97	-5.9	111.1	W30 W31 L96 H97 I98 L102 Y103 Y104	W30-R100 HydrophobicContact CB-CB 4.11Å; W30-R100 HydrophobicContact CB-CG 3.55Å; W31-R100 VanDerWaalsContact CE2-NH1 3.32Å; W31-R100 HydrophobicContact CE3-CG 4.34Å; W31-R100 HydrophobicContact CZ3-CG 4.26Å; L96-R100 WeakPolarHBondContact O-CB 3.48Å; L96-R100 PolarHBondContact O-N 3.08Å; H97-R100 PolarHBondContact CE1-NH2 3.21Å; H97-R100 PolarHBondContact ND1-NH2 3.08Å; H97-R100 PolarHBondContact NE2-NH2 2.89Å; I98-R100 VanDerWaalsContact C-N 3.33Å; I98-R100 PolarHBondContact O-N 3.26Å; R100-L102 VanDerWaalsContact C-N 3.33Å; R100-L102 PolarHBondContact O-N 3.38Å; R100-Y103 PolarHBondContact O-N 3.45Å; R100-Y104 HydrophobicContact CG-CD2 3.77Å; R100-Y104 HydrophobicContact CG-CE2 4.12Å; R100-Y104 WeakPolarHBondContact O-CD2 3.38Å; R100-Y104 PolarHBondContact O-N 3.49Å
101	G	98.8	Very high	98.6	Very high	3 Å²	3	32.7 Å²	32.7	3%	0.031	16%	0.164	C	C	.	.	H	α-helix	trans	-60.9	-40.1	-179.7	0	0	0	0	0	113.2	H97 I98 G99 G105 S106 F107	H97-G101 PolarHBondContact O-N 2.66Å; H97-G101 VanDerWaalsContact O-N 3.07Å; I98-G101 CarbonylContact O-C 3.57Å; I98-G101 WeakPolarHBondContact O-CA 3.48Å; I98-G101 PolarHBondContact O-N 3.38Å; G99-G101 VanDerWaalsContact C-N 3.3Å; G99-G101 PolarHBondContact O-N 2.88Å; G101-G105 CarbonylContact O-C 3.59Å; G101-G105 PolarHBondContact O-N 2.84Å; G101-S106 PolarHBondContact O-N 3.2Å; G101-F107 WeakPolarHBondContact O-CD1 3.39Å
102	L	98.8	Very high	98.6	Very high	26 Å²	26	33.3 Å²	33.3	14%	0.136	17%	0.168	C	C	.	.	H	α-helix	trans	-66.9	-49.4	174.6	-65.7	174.8	0	0	0	111.8	I98 G99 R100 G105 F107 W113 L301 I304 Y325	I98-L102 HydrophobicContact CG2-CD1 4.19Å; I98-L102 HydrophobicContact CG2-CG 4.39Å; I98-L102 WeakPolarHBondContact O-CG 3.47Å; I98-L102 PolarHBondContact O-N 2.88Å; G99-L102 PolarHBondContact O-N 3.25Å; R100-L102 VanDerWaalsContact C-N 3.33Å; R100-L102 PolarHBondContact O-N 3.38Å; L102-G105 PolarHBondContact O-N 3.19Å; L102-F107 HydrophobicContact CD2-CD1 4.27Å; L102-W113 HydrophobicContact CD2-CH2 3.79Å; L102-W113 HydrophobicContact CD2-CZ2 3.97Å; L102-W113 HydrophobicContact CG-CH2 4.1Å; L102-L301 HydrophobicContact CD2-CD2 4.45Å; L102-I304 HydrophobicContact CD2-CB 4.48Å; L102-I304 HydrophobicContact CD2-CD1 4.23Å; L102-I304 HydrophobicContact CD2-CG1 4.02Å; L102-I304 HydrophobicContact CD2-CG2 3.87Å; L102-Y325 HydrophobicContact CB-CE2 4.25Å
103	Y	98.9	Very high	98.6	Very high	33 Å²	33	31.6 Å²	31.6	13%	0.129	16%	0.158	C	C	.	.	H	α-helix	trans	-65.7	-42.4	-175.1	-171	-89.2	0	0	0	113	G99 R100 M315 Q322 Y325	G99-Y103 WeakPolarHBondContact O-CB 3.34Å; G99-Y103 PolarHBondContact O-N 3.48Å; R100-Y103 PolarHBondContact O-N 3.45Å; Y103-M315 HydrophobicContact CD2-CB 4.29Å; Y103-M315 HydrophobicContact CD2-SD 4.3Å; Y103-M315 HydrophobicContact CE1-CB 4.42Å; Y103-M315 HydrophobicContact CE2-CB 4.2Å; Y103-M315 HydrophobicContact CG-CB 4.47Å; Y103-M315 VanDerWaalsContact O-CB 3.3Å; Y103-M315 WeakPolarHBondContact O-CB 3.34Å; Y103-M315 WeakPolarHBondContact O-CG 3.45Å; Y103-M315 PolarHBondContact O-N 2.9Å; Y103-Q322 HydrophobicContact CE2-CG 3.95Å; Y103-Q322 WeakPolarHBondContact OH-CG 3.05Å; Y103-Q322 PolarHBondContact OH-OE1 3.35Å; Y103-Y325 AromaticContact CD2-CD1 3.52Å; Y103-Y325 HydrophobicContact CD2-CD1 3.52Å; Y103-Y325 HydrophobicContact CD2-CD2 4.05Å; Y103-Y325 AromaticContact CD2-CE1 3.75Å; Y103-Y325 HydrophobicContact CD2-CE1 3.75Å; Y103-Y325 HydrophobicContact CD2-CE2 4.25Å; Y103-Y325 AromaticContact CD2-CG 3.68Å; Y103-Y325 HydrophobicContact CD2-CG 3.68Å; Y103-Y325 HydrophobicContact CE2-CD1 4.05Å; Y103-Y325 HydrophobicContact CE2-CE1 4.47Å; Y103-Y325 HydrophobicContact CE2-CG 4.41Å
104	Y	98.8	Very high	98.6	Very high	24 Å²	24	34.8 Å²	34.8	9%	0.094	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94	4	-177	-63.8	-68.7	0	0	0	113.8	W30 W31 R100 S106 N206 P208 S314	W30-Y104 HydrophobicContact CB-CE2 4.22Å; W30-Y104 AromaticContact CD1-CE2 3.85Å; W30-Y104 HydrophobicContact CG-CE2 4.17Å; W31-Y104 HydrophobicContact CH2-CD1 4.13Å; W31-Y104 AromaticContact CH2-CD2 3.53Å; W31-Y104 HydrophobicContact CH2-CD2 3.53Å; W31-Y104 AromaticContact CH2-CE2 3.97Å; W31-Y104 HydrophobicContact CH2-CE2 3.97Å; W31-Y104 AromaticContact CH2-CG 3.6Å; W31-Y104 HydrophobicContact CH2-CG 3.6Å; W31-Y104 AromaticContact CZ3-CD2 3.61Å; W31-Y104 HydrophobicContact CZ3-CD2 3.61Å; W31-Y104 AromaticContact CZ3-CE2 3.57Å; W31-Y104 HydrophobicContact CZ3-CE2 3.57Å; W31-Y104 HydrophobicContact CZ3-CG 4.1Å; R100-Y104 HydrophobicContact CG-CD2 3.77Å; R100-Y104 HydrophobicContact CG-CE2 4.12Å; R100-Y104 WeakPolarHBondContact O-CD2 3.38Å; R100-Y104 PolarHBondContact O-N 3.49Å; Y104-S106 VanDerWaalsContact C-N 3.32Å; Y104-S106 PolarHBondContact O-N 3.46Å; Y104-N206 PolarHBondContact O-ND2 3.44Å; Y104-P208 VanDerWaalsContact CD1-CA 3.5Å; Y104-P208 HydrophobicContact CD1-CB 4.21Å; Y104-P208 WeakPolarHBondContact CD1-O 3.33Å; Y104-P208 VanDerWaalsContact CE1-CA 3.48Å; Y104-P208 HydrophobicContact CE1-CB 3.65Å; Y104-P208 HydrophobicContact CE1-CG 4.39Å; Y104-S314 WeakPolarHBondContact CD1-OG 3.35Å
105	G	98.5	Very high	98.5	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	67	30	179.3	0	0	0	0	0	113.7	G101 L102 F107 L108 Q313	G101-G105 CarbonylContact O-C 3.59Å; G101-G105 PolarHBondContact O-N 2.84Å; L102-G105 PolarHBondContact O-N 3.19Å; G105-F107 PolarHBondContact O-N 3.46Å; G105-L108 WeakPolarHBondContact O-CG 3.19Å; G105-L108 PolarHBondContact O-N 2.88Å; G105-Q313 PolarHBondContact O-NE2 3.2Å
106	S	98.6	Very high	98.5	Very high	20 Å²	20	33 Å²	33	14%	0.14	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-72.8	-14.5	178	-54.4	0	0	0	0	112.7	G101 Y104 L108 Y109 N206	G101-S106 PolarHBondContact O-N 3.2Å; Y104-S106 VanDerWaalsContact C-N 3.32Å; Y104-S106 PolarHBondContact O-N 3.46Å; S106-L108 PolarHBondContact O-N 2.88Å; S106-L108 VanDerWaalsContact O-N 3.16Å; S106-Y109 PolarHBondContact O-N 3.02Å; S106-Y109 VanDerWaalsContact O-N 3.12Å; S106-N206 PolarHBondContact OG-ND2 3.4Å
107	F	98.5	Very high	98.5	Very high	11 Å²	11	30.8 Å²	30.8	5%	0.048	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-62.5	-14.5	172.7	56.9	-106.9	0	0	0	113.5	G101 L102 G105 Y109 W113 I304 P305 H308	G101-F107 WeakPolarHBondContact O-CD1 3.39Å; L102-F107 HydrophobicContact CD2-CD1 4.27Å; G105-F107 PolarHBondContact O-N 3.46Å; F107-Y109 PolarHBondContact O-N 3.46Å; F107-W113 HydrophobicContact CB-CB 4.42Å; F107-W113 HydrophobicContact CB-CD2 3.34Å; F107-W113 HydrophobicContact CB-CE3 3.65Å; F107-W113 HydrophobicContact CB-CG 3.7Å; F107-W113 HydrophobicContact CB-CH2 4.22Å; F107-W113 HydrophobicContact CB-CZ2 3.95Å; F107-W113 HydrophobicContact CB-CZ3 4.08Å; F107-I304 HydrophobicContact CB-CG2 4.29Å; F107-I304 HydrophobicContact CD1-CG2 3.45Å; F107-I304 VanDerWaalsContact CD1-CG2 3.45Å; F107-I304 HydrophobicContact CD2-CG2 3.79Å; F107-I304 HydrophobicContact CE1-CG2 3.56Å; F107-I304 HydrophobicContact CE2-CG2 3.93Å; F107-I304 HydrophobicContact CG-CG2 3.56Å; F107-I304 HydrophobicContact CZ-CG2 3.81Å; F107-P305 HydrophobicContact CB-CG 4.34Å; F107-P305 HydrophobicContact CD2-CB 4.35Å; F107-P305 HydrophobicContact CD2-CG 4.26Å; F107-P305 WeakPolarHBondContact O-CG 3.48Å; F107-H308 HydrophobicContact CE2-CB 3.83Å; F107-H308 AromaticContact CE2-CG 3.94Å; F107-H308 AromaticContact CE2-ND1 3.81Å; F107-H308 HydrophobicContact CZ-CB 4.33Å; F107-H308 AromaticContact CZ-ND1 3.61Å
108	L	98.2	Very high	98.5	Very high	68 Å²	68	32.8 Å²	32.8	36%	0.356	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	-66.2	-19.2	173.1	-65.4	-178.1	0	0	0	112.7	G105 S106 S110 H308 Q313	G105-L108 WeakPolarHBondContact O-CG 3.19Å; G105-L108 PolarHBondContact O-N 2.88Å; S106-L108 PolarHBondContact O-N 2.88Å; S106-L108 VanDerWaalsContact O-N 3.16Å; L108-S110 VanDerWaalsContact C-N 3.29Å; L108-S110 PolarHBondContact O-N 2.84Å; L108-H308 HydrophobicContact CD2-CB 4.27Å; L108-Q313 HydrophobicContact CD1-CB 4.15Å; L108-Q313 HydrophobicContact CD1-CG 3.73Å
109	Y	97.9	Very high	98.5	Very high	50 Å²	50	32.4 Å²	32.4	20%	0.196	17%	0.172	C	C	.	.	S	Bend	trans	-80.2	82.1	166	-55	-40.6	0	0	0	109.1	S106 F107 E111 T112 W113 T203 N206	S106-Y109 PolarHBondContact O-N 3.02Å; S106-Y109 VanDerWaalsContact O-N 3.12Å; F107-Y109 PolarHBondContact O-N 3.46Å; Y109-E111 VanDerWaalsContact C-N 3.34Å; Y109-E111 PolarHBondContact O-N 3.44Å; Y109-T112 PolarHBondContact O-N 3.03Å; Y109-W113 WeakPolarHBondContact O-CB 3.41Å; Y109-W113 PolarHBondContact O-N 3.13Å; Y109-T203 HydrophobicContact CD1-CG2 4.14Å; Y109-T203 HydrophobicContact CE1-CG2 4.41Å; Y109-N206 HydrophobicContact CE2-CB 3.65Å
110	S	96.6	Very high	98.5	Very high	48 Å²	48	32.3 Å²	32.3	34%	0.336	17%	0.169	S	C	.	.	H	α-helix	trans	-58.9	-40.9	-162.5	74.1	0	0	0	0	113.9	L108 W113 N114	L108-S110 VanDerWaalsContact C-N 3.29Å; L108-S110 PolarHBondContact O-N 2.84Å; S110-W113 PolarHBondContact O-N 3.31Å; S110-N114 VanDerWaalsContact O-CB 3.27Å; S110-N114 WeakPolarHBondContact O-CB 3.46Å; S110-N114 PolarHBondContact O-N 2.99Å; S110-N114 PolarHBondContact O-ND2 3.12Å
111	E	97.9	Very high	98.5	Very high	99 Å²	99	34.2 Å²	34.2	46%	0.463	18%	0.18	S	C	.	.	H	α-helix	trans	-68.4	-50.6	-179	-63.9	83.3	166.5	0	0	110	Y109 W113 N114 I115 F199	Y109-E111 VanDerWaalsContact C-N 3.34Å; Y109-E111 PolarHBondContact O-N 3.44Å; E111-W113 VanDerWaalsContact C-N 3.31Å; E111-W113 PolarHBondContact O-N 3.08Å; E111-N114 PolarHBondContact O-N 3.16Å; E111-I115 WeakPolarHBondContact O-CG1 3.44Å; E111-I115 PolarHBondContact O-N 2.77Å; E111-F199 HydrophobicContact CB-CB 4.07Å; E111-F199 HydrophobicContact CB-CD1 3.65Å; E111-F199 HydrophobicContact CB-CD2 4.04Å; E111-F199 HydrophobicContact CB-CE1 4.02Å; E111-F199 HydrophobicContact CB-CE2 4.37Å; E111-F199 HydrophobicContact CB-CG 3.67Å; E111-F199 HydrophobicContact CB-CZ 4.36Å; E111-F199 HydrophobicContact CG-CD1 4.1Å; E111-F199 HydrophobicContact CG-CE1 4.11Å
112	T	98.6	Very high	98.5	Very high	15 Å²	15	34.8 Å²	34.8	9%	0.092	18%	0.184	C	C	.	.	H	α-helix	trans	-57.4	-45.7	174.7	-55.1	0	0	0	0	110.7	Y109 G116 H196 F199 L200	Y109-T112 PolarHBondContact O-N 3.03Å; T112-G116 PolarHBondContact O-N 3.37Å; T112-H196 WeakPolarHBondContact CG2-CE1 3.21Å; T112-H196 PolarHBondContact O-CE1 2.89Å; T112-H196 PolarHBondContact O-ND1 3.46Å; T112-F199 WeakPolarHBondContact OG1-CB 3.43Å; T112-L200 HydrophobicContact CG2-CB 4.18Å; T112-L200 HydrophobicContact CG2-CD1 4.47Å; T112-L200 PolarHBondContact OG1-N 3.12Å
113	W	98.8	Very high	98.5	Very high	24 Å²	24	33.9 Å²	33.9	9%	0.091	18%	0.18	C	C	.	.	H	α-helix	trans	-63.1	-48.1	179.3	-175.9	-108.2	0	0	0	112.7	I98 L102 F107 Y109 S110 E111 G116 I117 L301	I98-W113 HydrophobicContact CG2-CH2 4.14Å; L102-W113 HydrophobicContact CD2-CH2 3.79Å; L102-W113 HydrophobicContact CD2-CZ2 3.97Å; L102-W113 HydrophobicContact CG-CH2 4.1Å; F107-W113 HydrophobicContact CB-CB 4.42Å; F107-W113 HydrophobicContact CB-CD2 3.34Å; F107-W113 HydrophobicContact CB-CE3 3.65Å; F107-W113 HydrophobicContact CB-CG 3.7Å; F107-W113 HydrophobicContact CB-CH2 4.22Å; F107-W113 HydrophobicContact CB-CZ2 3.95Å; F107-W113 HydrophobicContact CB-CZ3 4.08Å; Y109-W113 WeakPolarHBondContact O-CB 3.41Å; Y109-W113 PolarHBondContact O-N 3.13Å; S110-W113 PolarHBondContact O-N 3.31Å; E111-W113 VanDerWaalsContact C-N 3.31Å; E111-W113 PolarHBondContact O-N 3.08Å; W113-G116 CarbonylContact O-C 3.26Å; W113-G116 VanDerWaalsContact O-CA 3.27Å; W113-G116 WeakPolarHBondContact O-CA 3.24Å; W113-G116 PolarHBondContact O-N 3.11Å; W113-I117 PolarHBondContact O-N 3.04Å; W113-L301 HydrophobicContact CH2-CD2 4.43Å; W113-L301 HydrophobicContact CZ2-CB 4.19Å; W113-L301 HydrophobicContact CZ2-CD2 4Å; W113-L301 PolarHBondContact NE1-O 3.45Å
114	N	98.6	Very high	98.5	Very high	69 Å²	69	33.2 Å²	33.2	37%	0.369	18%	0.178	S	C	.	.	H	α-helix	trans	-66.1	-40.8	-179.2	-72.1	-30.9	0	0	0	112	S110 E111 G116 I117 I118	S110-N114 VanDerWaalsContact O-CB 3.27Å; S110-N114 WeakPolarHBondContact O-CB 3.46Å; S110-N114 PolarHBondContact O-N 2.99Å; S110-N114 PolarHBondContact O-ND2 3.12Å; E111-N114 PolarHBondContact O-N 3.16Å; N114-G116 PolarHBondContact O-N 3.29Å; N114-I117 PolarHBondContact O-N 3.19Å; N114-I118 WeakPolarHBondContact O-CG1 3.42Å; N114-I118 PolarHBondContact O-N 3.06Å; N114-I118 VanDerWaalsContact O-N 3.08Å
115	I	98.8	Very high	98.5	Very high	21 Å²	21	34 Å²	34	11%	0.108	19%	0.19	C	C	.	.	H	α-helix	trans	-62.3	-35.9	169.9	-62.7	-58.7	0	0	0	110.6	E111 I117 I118 L119 L195 H196 F199	E111-I115 WeakPolarHBondContact O-CG1 3.44Å; E111-I115 PolarHBondContact O-N 2.77Å; I115-I117 VanDerWaalsContact C-N 3.34Å; I115-I117 PolarHBondContact O-N 3.46Å; I115-I118 HydrophobicContact CD1-CD1 4.21Å; I115-I118 PolarHBondContact O-N 3.5Å; I115-L119 HydrophobicContact CG2-CD1 4.2Å; I115-L119 HydrophobicContact CG2-CG 4.42Å; I115-L119 WeakPolarHBondContact O-CB 3.44Å; I115-L119 WeakPolarHBondContact O-CG 3.35Å; I115-L119 PolarHBondContact O-N 3.06Å; I115-L195 HydrophobicContact CD1-CD2 3.79Å; I115-L195 HydrophobicContact CD1-CG 4.39Å; I115-L195 HydrophobicContact CG1-CD2 4.37Å; I115-L195 HydrophobicContact CG1-CG 4.45Å; I115-H196 HydrophobicContact CB-CB 4.46Å; I115-H196 HydrophobicContact CG2-CB 3.68Å; I115-F199 HydrophobicContact CG1-CD2 4.01Å; I115-F199 HydrophobicContact CG1-CE2 4.08Å
116	G	98.8	Very high	98.5	Very high	24 Å²	24	34.6 Å²	34.6	25%	0.247	19%	0.194	C	C	.	.	H	α-helix	trans	-59.1	-40	172.8	0	0	0	0	0	113.5	T112 W113 N114 L119 L120	T112-G116 PolarHBondContact O-N 3.37Å; W113-G116 CarbonylContact O-C 3.26Å; W113-G116 VanDerWaalsContact O-CA 3.27Å; W113-G116 WeakPolarHBondContact O-CA 3.24Å; W113-G116 PolarHBondContact O-N 3.11Å; N114-G116 PolarHBondContact O-N 3.29Å; G116-L119 WeakPolarHBondContact O-CB 3.41Å; G116-L119 PolarHBondContact O-N 3.37Å; G116-L120 PolarHBondContact O-N 3.01Å
117	I	98.8	Very high	98.5	Very high	12 Å²	12	34.3 Å²	34.3	6%	0.062	19%	0.192	C	C	.	.	H	α-helix	trans	-66	-42	174.4	-62.6	168	0	0	0	110.6	W113 N114 I115 L119 L120 L121 L301 A302	W113-I117 PolarHBondContact O-N 3.04Å; N114-I117 PolarHBondContact O-N 3.19Å; I115-I117 VanDerWaalsContact C-N 3.34Å; I115-I117 PolarHBondContact O-N 3.46Å; I117-L119 VanDerWaalsContact C-N 3.33Å; I117-L119 PolarHBondContact O-N 2.86Å; I117-L120 WeakPolarHBondContact O-CB 3.31Å; I117-L120 PolarHBondContact O-N 3.37Å; I117-L121 HydrophobicContact CG2-CD1 4.27Å; I117-L121 WeakPolarHBondContact O-CG 3.3Å; I117-L121 PolarHBondContact O-N 3.4Å; I117-L301 HydrophobicContact CD1-CB 3.82Å; I117-L301 HydrophobicContact CG1-CB 3.95Å; I117-A302 HydrophobicContact CD1-CB 3.9Å
118	I	98.8	Very high	98.6	Very high	80 Å²	80	35.7 Å²	35.7	41%	0.41	20%	0.199	S	C	.	.	H	α-helix	trans	-63.2	-41.7	176	-62.5	171.7	0	0	0	110.5	N114 I115 L120 L121 A122 L192	N114-I118 WeakPolarHBondContact O-CG1 3.42Å; N114-I118 PolarHBondContact O-N 3.06Å; N114-I118 VanDerWaalsContact O-N 3.08Å; I115-I118 HydrophobicContact CD1-CD1 4.21Å; I115-I118 PolarHBondContact O-N 3.5Å; I118-L120 PolarHBondContact O-N 3Å; I118-L121 PolarHBondContact O-N 2.85Å; I118-A122 WeakPolarHBondContact O-CB 3.28Å; I118-A122 PolarHBondContact O-N 3.04Å; I118-L192 HydrophobicContact CG2-CD1 3.86Å; I118-L192 HydrophobicContact CG2-CD2 4.32Å
119	L	98.9	Very high	98.6	Very high	21 Å²	21	33.4 Å²	33.4	11%	0.11	19%	0.186	C	C	.	.	H	α-helix	trans	-60.4	-42.4	174.3	-79.7	167.5	0	0	0	112.2	I115 G116 I117 A122 T123 I189 L192 A193 H196	I115-L119 HydrophobicContact CG2-CD1 4.2Å; I115-L119 HydrophobicContact CG2-CG 4.42Å; I115-L119 WeakPolarHBondContact O-CB 3.44Å; I115-L119 WeakPolarHBondContact O-CG 3.35Å; I115-L119 PolarHBondContact O-N 3.06Å; G116-L119 WeakPolarHBondContact O-CB 3.41Å; G116-L119 PolarHBondContact O-N 3.37Å; I117-L119 VanDerWaalsContact C-N 3.33Å; I117-L119 PolarHBondContact O-N 2.86Å; L119-A122 PolarHBondContact O-N 3.27Å; L119-T123 WeakPolarHBondContact O-CB 3.4Å; L119-T123 PolarHBondContact O-N 3.49Å; L119-T123 PolarHBondContact O-OG1 2.89Å; L119-I189 HydrophobicContact CD2-CG2 3.83Å; L119-L192 HydrophobicContact CD2-CB 3.56Å; L119-L192 HydrophobicContact CG-CB 4.08Å; L119-A193 HydrophobicContact CD2-CB 4.39Å; L119-H196 HydrophobicContact CD1-CB 3.81Å
120	L	98.8	Very high	98.6	Very high	9 Å²	9	31.7 Å²	31.7	5%	0.047	18%	0.184	C	C	.	.	H	α-helix	trans	-59.1	-52.2	174.6	173.9	64.1	0	0	0	110.7	L94 I98 G116 I117 I118 A122 T123 M124 I298 L301	L94-L120 HydrophobicContact CD1-CD1 4.38Å; I98-L120 HydrophobicContact CD1-CD1 4.1Å; I98-L120 HydrophobicContact CD1-CD2 3.87Å; I98-L120 HydrophobicContact CD1-CG 4.45Å; G116-L120 PolarHBondContact O-N 3.01Å; I117-L120 WeakPolarHBondContact O-CB 3.31Å; I117-L120 PolarHBondContact O-N 3.37Å; I118-L120 PolarHBondContact O-N 3Å; L120-A122 PolarHBondContact O-N 2.93Å; L120-T123 PolarHBondContact O-N 3.46Å; L120-M124 HydrophobicContact CD1-CG 4.18Å; L120-M124 HydrophobicContact CD1-SD 3.98Å; L120-M124 HydrophobicContact CG-CG 4.5Å; L120-M124 HydrophobicContact CG-SD 3.91Å; L120-M124 WeakPolarHBondContact O-CB 3.27Å; L120-M124 VanDerWaalsContact O-CG 3.25Å; L120-M124 WeakPolarHBondContact O-CG 3.36Å; L120-M124 PolarHBondContact O-N 2.85Å; L120-I298 HydrophobicContact CD2-CG2 3.89Å; L120-L301 HydrophobicContact CD2-CD1 3.74Å
121	L	98.8	Very high	98.7	Very high	62 Å²	62	31.3 Å²	31.3	33%	0.325	18%	0.176	S	C	.	.	H	α-helix	trans	-61.1	-42.8	-179.9	-70.8	170.3	0	0	0	112.3	I117 I118 M124 A125 I298 L299	I117-L121 HydrophobicContact CG2-CD1 4.27Å; I117-L121 WeakPolarHBondContact O-CG 3.3Å; I117-L121 PolarHBondContact O-N 3.4Å; I118-L121 PolarHBondContact O-N 2.85Å; L121-M124 PolarHBondContact O-N 3.08Å; L121-A125 WeakPolarHBondContact O-CB 3.34Å; L121-A125 PolarHBondContact O-N 2.91Å; L121-I298 HydrophobicContact CD2-CD1 4.48Å; L121-I298 HydrophobicContact CD2-CG2 3.78Å; L121-I298 HydrophobicContact CG-CG2 4.44Å; L121-L299 HydrophobicContact CD1-CD2 4.16Å
122	A	98.8	Very high	98.7	Very high	14 Å²	14	26.7 Å²	26.7	12%	0.116	15%	0.154	C	C	.	.	H	α-helix	trans	-64.2	-40.6	176.8	0	0	0	0	0	111.8	I118 L119 L120 A125 T126 I189	I118-A122 WeakPolarHBondContact O-CB 3.28Å; I118-A122 PolarHBondContact O-N 3.04Å; L119-A122 PolarHBondContact O-N 3.27Å; L120-A122 PolarHBondContact O-N 2.93Å; A122-A125 PolarHBondContact O-N 3.25Å; A122-T126 WeakPolarHBondContact O-CB 3.33Å; A122-T126 PolarHBondContact O-N 3.27Å; A122-T126 PolarHBondContact O-OG1 3.38Å; A122-I189 HydrophobicContact CB-CD1 4.17Å; A122-I189 HydrophobicContact CB-CG1 3.73Å
123	T	98.8	Very high	98.7	Very high	7 Å²	7	26.7 Å²	26.7	4%	0.043	15%	0.153	C	C	.	.	H	α-helix	trans	-67.9	-40.4	177.2	-52.2	0	0	0	0	111.3	F90 F91 L94 L119 L120 T126 A127	F90-T123 HydrophobicContact CD1-CG2 4.48Å; F90-T123 HydrophobicContact CD2-CG2 4.29Å; F90-T123 HydrophobicContact CE1-CG2 4.35Å; F90-T123 HydrophobicContact CE2-CG2 4.16Å; F90-T123 HydrophobicContact CG-CG2 4.47Å; F90-T123 HydrophobicContact CZ-CG2 4.19Å; F91-T123 HydrophobicContact CE2-CG2 4.39Å; F91-T123 HydrophobicContact CZ-CG2 4.14Å; L94-T123 HydrophobicContact CD1-CG2 3.74Å; L119-T123 WeakPolarHBondContact O-CB 3.4Å; L119-T123 PolarHBondContact O-N 3.49Å; L119-T123 PolarHBondContact O-OG1 2.89Å; L120-T123 PolarHBondContact O-N 3.46Å; T123-T126 PolarHBondContact O-N 3.5Å; T123-A127 WeakPolarHBondContact O-CB 3.46Å; T123-A127 PolarHBondContact O-N 2.85Å
124	M	98.8	Very high	98.7	Very high	19 Å²	19	26.9 Å²	26.9	9%	0.094	16%	0.157	C	C	.	.	H	α-helix	trans	-58.6	-48.9	172.1	-72.3	177.1	85.8	0	0	111.9	F91 L120 L121 T126 A127 F128 F274 I298	F91-M124 HydrophobicContact CE1-CG 3.83Å; F91-M124 HydrophobicContact CZ-CG 4.16Å; L120-M124 HydrophobicContact CD1-CG 4.18Å; L120-M124 HydrophobicContact CD1-SD 3.98Å; L120-M124 HydrophobicContact CG-CG 4.5Å; L120-M124 HydrophobicContact CG-SD 3.91Å; L120-M124 WeakPolarHBondContact O-CB 3.27Å; L120-M124 VanDerWaalsContact O-CG 3.25Å; L120-M124 WeakPolarHBondContact O-CG 3.36Å; L120-M124 PolarHBondContact O-N 2.85Å; L121-M124 PolarHBondContact O-N 3.08Å; M124-T126 VanDerWaalsContact C-N 3.34Å; M124-T126 PolarHBondContact O-N 3.28Å; M124-A127 PolarHBondContact O-N 3.13Å; M124-F128 WeakPolarHBondContact O-CB 3.27Å; M124-F128 PolarHBondContact O-N 3.18Å; M124-F274 HydrophobicContact CB-CE1 3.83Å; M124-F274 HydrophobicContact CB-CZ 4.26Å; M124-F274 HydrophobicContact CE-CD1 3.64Å; M124-F274 HydrophobicContact CE-CE1 3.5Å; M124-F274 VanDerWaalsContact CE-CE1 3.5Å; M124-F274 HydrophobicContact CG-CE1 3.85Å; M124-F274 WeakPolarHBondContact O-CZ 3.4Å; M124-I298 HydrophobicContact CE-CD1 3.42Å; M124-I298 VanDerWaalsContact CE-CD1 3.42Å; M124-I298 HydrophobicContact CE-CG1 4.17Å; M124-I298 HydrophobicContact SD-CD1 3.86Å; M124-I298 HydrophobicContact SD-CG1 4.44Å; M124-I298 HydrophobicContact SD-CG2 4.4Å
125	A	98.6	Very high	98.7	Very high	41 Å²	41	24.1 Å²	24.1	34%	0.339	14%	0.142	S	C	.	.	H	α-helix	trans	-60.8	-44.2	176.6	0	0	0	0	0	111.8	L121 A122 F128 M129 L185	L121-A125 WeakPolarHBondContact O-CB 3.34Å; L121-A125 PolarHBondContact O-N 2.91Å; A122-A125 PolarHBondContact O-N 3.25Å; A125-F128 PolarHBondContact O-N 3.22Å; A125-M129 HydrophobicContact CB-CE 4.21Å; A125-M129 WeakPolarHBondContact O-CE 3.48Å; A125-M129 PolarHBondContact O-N 3.34Å; A125-M129 VanDerWaalsContact O-N 3.08Å; A125-L185 HydrophobicContact CB-CD1 4.22Å
126	T	98.9	Very high	98.7	Very high	13 Å²	13	23.1 Å²	23.1	8%	0.08	14%	0.137	C	C	.	.	H	α-helix	trans	-60.2	-49.6	178.9	-57	0	0	0	0	111.2	A122 T123 M124 M129 G130 H182 L185 P186 I189	A122-T126 WeakPolarHBondContact O-CB 3.33Å; A122-T126 PolarHBondContact O-N 3.27Å; A122-T126 PolarHBondContact O-OG1 3.38Å; T123-T126 PolarHBondContact O-N 3.5Å; M124-T126 VanDerWaalsContact C-N 3.34Å; M124-T126 PolarHBondContact O-N 3.28Å; T126-M129 PolarHBondContact O-N 3.36Å; T126-G130 PolarHBondContact O-N 3.17Å; T126-H182 PolarHBondContact O-CE1 2.96Å; T126-H182 PolarHBondContact O-ND1 3.18Å; T126-L185 HydrophobicContact CG2-CB 4.46Å; T126-L185 WeakPolarHBondContact OG1-CB 3.37Å; T126-P186 HydrophobicContact CG2-CG 3.87Å; T126-I189 WeakPolarHBondContact OG1-CD1 3.3Å
127	A	98.7	Very high	98.6	Very high	13 Å²	13	22.6 Å²	22.6	11%	0.107	13%	0.128	C	C	.	.	H	α-helix	trans	-67	-41	-178.4	0	0	0	0	0	112.4	F91 T123 M124 M129 G130 Y131 Y273	F91-A127 HydrophobicContact CE2-CB 3.5Å; F91-A127 VanDerWaalsContact CE2-CB 3.5Å; F91-A127 HydrophobicContact CZ-CB 3.88Å; T123-A127 WeakPolarHBondContact O-CB 3.46Å; T123-A127 PolarHBondContact O-N 2.85Å; M124-A127 PolarHBondContact O-N 3.13Å; A127-M129 PolarHBondContact O-N 2.95Å; A127-G130 PolarHBondContact O-N 3.44Å; A127-Y131 WeakPolarHBondContact O-CB 3.39Å; A127-Y131 PolarHBondContact O-N 2.66Å; A127-Y273 HydrophobicContact CB-CE2 3.98Å
128	F	98.7	Very high	98.5	Very high	41 Å²	41	22.1 Å²	22.1	18%	0.18	13%	0.125	C	C	.	.	H	α-helix	trans	-56.6	-51.9	174.2	169.6	-104.1	0	0	0	111.4	M124 A125 G130 Y131 V132 I146 T147 F178 F274	M124-F128 WeakPolarHBondContact O-CB 3.27Å; M124-F128 PolarHBondContact O-N 3.18Å; A125-F128 PolarHBondContact O-N 3.22Å; F128-G130 VanDerWaalsContact C-N 3.34Å; F128-G130 PolarHBondContact O-N 3.18Å; F128-Y131 PolarHBondContact O-N 2.91Å; F128-V132 WeakPolarHBondContact O-CG2 3.45Å; F128-V132 PolarHBondContact O-N 2.75Å; F128-I146 HydrophobicContact CD2-CG2 4.36Å; F128-I146 HydrophobicContact CE2-CB 3.74Å; F128-I146 HydrophobicContact CE2-CG1 4.09Å; F128-I146 HydrophobicContact CE2-CG2 3.72Å; F128-I146 HydrophobicContact CZ-CB 3.99Å; F128-I146 HydrophobicContact CZ-CG2 3.88Å; F128-T147 HydrophobicContact CE1-CG2 4.25Å; F128-T147 HydrophobicContact CZ-CG2 4.11Å; F128-F178 AromaticContact CE1-CE2 3.92Å; F128-F178 HydrophobicContact CE1-CE2 3.92Å; F128-F178 HydrophobicContact CE1-CZ 4.2Å; F128-F178 HydrophobicContact CZ-CE2 4.47Å; F128-F274 HydrophobicContact CB-CE2 4.27Å; F128-F274 HydrophobicContact CB-CZ 4.19Å
129	M	98.6	Very high	98.5	Very high	19 Å²	19	18.3 Å²	18.3	9%	0.094	11%	0.106	C	C	.	.	H	α-helix	trans	-66.3	-37.1	179.7	-71	-178.9	-76	0	0	112.4	A125 T126 A127 Y131 V132 L133 F178 F181 H182 L185	A125-M129 HydrophobicContact CB-CE 4.21Å; A125-M129 WeakPolarHBondContact O-CE 3.48Å; A125-M129 PolarHBondContact O-N 3.34Å; A125-M129 VanDerWaalsContact O-N 3.08Å; T126-M129 PolarHBondContact O-N 3.36Å; A127-M129 PolarHBondContact O-N 2.95Å; M129-Y131 VanDerWaalsContact C-N 3.28Å; M129-Y131 PolarHBondContact O-N 2.97Å; M129-V132 WeakPolarHBondContact O-CB 3.41Å; M129-V132 PolarHBondContact O-N 3.48Å; M129-V132 VanDerWaalsContact O-N 3.12Å; M129-L133 WeakPolarHBondContact O-CG 3.5Å; M129-F178 HydrophobicContact CB-CB 4.26Å; M129-F178 HydrophobicContact CB-CD2 4.42Å; M129-F178 HydrophobicContact CB-CG 4.34Å; M129-F178 HydrophobicContact CG-CB 4.31Å; M129-F178 HydrophobicContact CG-CD1 4.16Å; M129-F178 HydrophobicContact CG-CD2 4.04Å; M129-F178 HydrophobicContact CG-CE2 4.39Å; M129-F178 HydrophobicContact CG-CG 3.92Å; M129-F178 HydrophobicContact SD-CD1 4.11Å; M129-F178 HydrophobicContact SD-CG 4.35Å; M129-F181 HydrophobicContact CE-CB 3.83Å; M129-F181 HydrophobicContact SD-CB 3.44Å; M129-F181 WeakPolarHBondContact SD-CB 3Å; M129-F181 HydrophobicContact SD-CD2 4.45Å; M129-F181 HydrophobicContact SD-CG 4.29Å; M129-H182 HydrophobicContact CB-CB 4.1Å; M129-L185 HydrophobicContact CE-CD1 3.22Å
130	G	98.6	Very high	98.4	Very high	15 Å²	15	17.8 Å²	17.8	16%	0.155	10%	0.103	C	C	.	.	H	α-helix	trans	-60.2	-38.9	175.1	0	0	0	0	0	112.6	T126 A127 F128 V132 L133 P134 H182	T126-G130 PolarHBondContact O-N 3.17Å; A127-G130 PolarHBondContact O-N 3.44Å; F128-G130 VanDerWaalsContact C-N 3.34Å; F128-G130 PolarHBondContact O-N 3.18Å; G130-V132 PolarHBondContact O-N 3.37Å; G130-L133 WeakPolarHBondContact O-CB 3.39Å; G130-L133 WeakPolarHBondContact O-CG 3.36Å; G130-L133 PolarHBondContact O-N 2.92Å; G130-P134 WeakPolarHBondContact O-CD 3.5Å; G130-H182 WeakPolarHBondContact CA-CE1 3.43Å; G130-H182 WeakPolarHBondContact CA-ND1 3.5Å; G130-H182 PolarHBondContact N-ND1 3.16Å
131	Y	98.6	Very high	98.4	Very high	40 Å²	40	18.9 Å²	18.9	16%	0.157	11%	0.106	C	C	.	.	H	α-helix	trans	-68.1	-19.3	177.3	-169.4	-104.5	0	0	0	113.6	A127 F128 M129 P134 M138 S139 E271	A127-Y131 WeakPolarHBondContact O-CB 3.39Å; A127-Y131 PolarHBondContact O-N 2.66Å; F128-Y131 PolarHBondContact O-N 2.91Å; M129-Y131 VanDerWaalsContact C-N 3.28Å; M129-Y131 PolarHBondContact O-N 2.97Å; Y131-P134 WeakPolarHBondContact O-CD 3.28Å; Y131-M138 HydrophobicContact CE1-CB 4.16Å; Y131-S139 VanDerWaalsContact O-CB 3.29Å; Y131-S139 WeakPolarHBondContact O-CB 3.28Å; Y131-S139 PolarHBondContact O-OG 2.87Å; Y131-E271 HydrophobicContact CD1-CG 4.25Å; Y131-E271 HydrophobicContact CD2-CG 3.48Å; Y131-E271 VanDerWaalsContact CD2-CG 3.48Å; Y131-E271 HydrophobicContact CE1-CG 4.2Å; Y131-E271 HydrophobicContact CE2-CG 3.4Å; Y131-E271 VanDerWaalsContact CE2-CG 3.4Å; Y131-E271 WeakPolarHBondContact CE2-OE1 3.17Å; Y131-E271 HydrophobicContact CG-CG 3.89Å; Y131-E271 PolarHBondContact OH-OE1 3.47Å
132	V	98.6	Very high	98.2	Very high	1 Å²	1	16.4 Å²	16.4	1%	0.006	10%	0.096	C	C	.	.	H	α-helix	trans	-78.3	-27.5	175.5	-177.3	0	0	0	0	111.8	F128 M129 G130 W135 A143 L175 F178	F128-V132 WeakPolarHBondContact O-CG2 3.45Å; F128-V132 PolarHBondContact O-N 2.75Å; M129-V132 WeakPolarHBondContact O-CB 3.41Å; M129-V132 PolarHBondContact O-N 3.48Å; M129-V132 VanDerWaalsContact O-N 3.12Å; G130-V132 PolarHBondContact O-N 3.37Å; V132-W135 HydrophobicContact CG1-CE3 4.14Å; V132-W135 HydrophobicContact CG1-CZ3 3.94Å; V132-W135 PolarHBondContact O-N 2.96Å; V132-A143 HydrophobicContact CG1-CB 4.06Å; V132-A143 HydrophobicContact CG2-CB 3.76Å; V132-L175 HydrophobicContact CG1-CD1 4.38Å; V132-F178 HydrophobicContact CB-CD2 3.93Å; V132-F178 HydrophobicContact CG1-CD2 3.97Å; V132-F178 HydrophobicContact CG2-CD2 3.87Å; V132-F178 HydrophobicContact CG2-CE2 4.04Å
133	L	98.7	Very high	98.1	Very high	16 Å²	16	15.8 Å²	15.8	8%	0.084	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-34.6	-171.5	-53.8	-175.2	0	0	0	115.1	Y55 M129 G130 W135 L175 F178 F179 H182	Y55-L133 HydrophobicContact CE1-CB 4.43Å; Y55-L133 HydrophobicContact CE2-CB 4.44Å; Y55-L133 WeakPolarHBondContact CE2-O 3.48Å; Y55-L133 PolarHBondContact OH-O 3.32Å; M129-L133 WeakPolarHBondContact O-CG 3.5Å; G130-L133 WeakPolarHBondContact O-CB 3.39Å; G130-L133 WeakPolarHBondContact O-CG 3.36Å; G130-L133 PolarHBondContact O-N 2.92Å; L133-W135 PolarHBondContact O-N 3.48Å; L133-W135 VanDerWaalsContact O-N 3.15Å; L133-L175 HydrophobicContact CD2-CD1 3.99Å; L133-F178 HydrophobicContact CD2-CB 4.49Å; L133-F179 HydrophobicContact CD1-CD2 4.05Å; L133-F179 HydrophobicContact CD2-CB 3.9Å; L133-H182 HydrophobicContact CD1-CB 4.3Å
134	P	98.4	Very high	98.1	Very high	27 Å²	27	16.9 Å²	16.9	18%	0.175	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-17.7	175.2	-24.9	35.8	0	0	0	115.1	F63 I66 G130 Y131 G136	F63-P134 WeakPolarHBondContact CA-O 3.33Å; F63-P134 WeakPolarHBondContact CD2-O 3.33Å; I66-P134 HydrophobicContact CG1-CB 4.41Å; G130-P134 WeakPolarHBondContact O-CD 3.5Å; Y131-P134 WeakPolarHBondContact O-CD 3.28Å; P134-G136 PolarHBondContact O-N 3.21Å
135	W	98.4	Very high	98	Very high	12 Å²	12	18.6 Å²	18.6	5%	0.045	11%	0.109	C	C	.	.			trans	56.1	35.3	177.3	-150.8	-111.4	0	0	0	114.4	A59 A62 F63 V132 L133 F140 V170 L175 A259	A59-W135 HydrophobicContact CB-CZ2 3.75Å; A62-W135 HydrophobicContact CB-CB 3.84Å; A62-W135 HydrophobicContact CB-CG 4.37Å; F63-W135 HydrophobicContact CB-CB 4.48Å; V132-W135 HydrophobicContact CG1-CE3 4.14Å; V132-W135 HydrophobicContact CG1-CZ3 3.94Å; V132-W135 PolarHBondContact O-N 2.96Å; L133-W135 PolarHBondContact O-N 3.48Å; L133-W135 VanDerWaalsContact O-N 3.15Å; W135-F140 HydrophobicContact CH2-CD2 4.09Å; W135-F140 AromaticContact CZ2-CD2 3.93Å; W135-F140 HydrophobicContact CZ2-CD2 3.93Å; W135-F140 HydrophobicContact CZ2-CE2 4.32Å; W135-V170 HydrophobicContact CH2-CG1 3.71Å; W135-V170 HydrophobicContact CZ3-CG1 4.04Å; W135-L175 HydrophobicContact CD2-CD2 3.85Å; W135-L175 HydrophobicContact CE3-CB 4.26Å; W135-L175 HydrophobicContact CE3-CD1 3.64Å; W135-L175 HydrophobicContact CE3-CD2 3.68Å; W135-L175 HydrophobicContact CE3-CG 4.07Å; W135-L175 HydrophobicContact CG-CD2 4.27Å; W135-L175 HydrophobicContact CH2-CB 4.15Å; W135-L175 HydrophobicContact CZ3-CB 3.8Å; W135-L175 HydrophobicContact CZ3-CD1 3.85Å; W135-L175 HydrophobicContact CZ3-CD2 4.06Å; W135-L175 HydrophobicContact CZ3-CG 4.12Å; W135-A259 HydrophobicContact CG-CB 4.44Å; W135-A259 WeakPolarHBondContact O-CB 3.27Å; W135-A259 PolarHBondContact O-N 3.43Å; W135-A259 VanDerWaalsContact O-N 3.12Å
136	G	98.2	Very high	97.8	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.103	C	C	.	.	B	Isolated β-bridge	trans	-85.1	-179.9	169.1	0	0	0	0	0	112.7	P134 M138 S139 F140 N255 T257	P134-G136 PolarHBondContact O-N 3.21Å; G136-M138 PolarHBondContact O-N 2.92Å; G136-S139 WeakPolarHBondContact O-CB 3.33Å; G136-S139 PolarHBondContact O-N 3.25Å; G136-F140 PolarHBondContact O-N 2.9Å; G136-N255 VanDerWaalsContact C-OD1 3.28Å; G136-N255 VanDerWaalsContact CA-OD1 3.24Å; G136-N255 WeakPolarHBondContact CA-OD1 3.47Å; G136-T257 CarbonylContact C-O 3.52Å; G136-T257 WeakPolarHBondContact CA-O 3.47Å
137	Q	97.9	Very high	97.7	Very high	12 Å²	12	18.6 Å²	18.6	6%	0.056	10%	0.102	C	C	.	.	H	α-helix	trans	-58.6	-48.4	-179.2	-75.2	-76.3	53.2	0	0	112.9	F140 W141 D254 T257 N263 P265	Q137-F140 PolarHBondContact O-N 3.47Å; Q137-W141 WeakPolarHBondContact O-CB 3.28Å; Q137-W141 PolarHBondContact O-N 3.49Å; Q137-D254 HydrophobicContact CB-CB 4.48Å; Q137-T257 WeakPolarHBondContact CG-OG1 3.27Å; Q137-T257 PolarHBondContact N-O 2.83Å; Q137-N263 PolarHBondContact NE2-O 3.47Å; Q137-P265 HydrophobicContact CB-CG 3.88Å
138	M	97	Very high	97.6	Very high	2 Å²	2	20.9 Å²	20.9	1%	0.01	11%	0.113	C	C	.	.	H	α-helix	trans	-68.4	-36.6	179.8	-70.3	-62.6	161.7	0	0	112.1	Y131 G136 G142 D252 D254 N255 P265	Y131-M138 HydrophobicContact CE1-CB 4.16Å; G136-M138 PolarHBondContact O-N 2.92Å; M138-G142 WeakPolarHBondContact O-CA 3.49Å; M138-G142 PolarHBondContact O-N 2.98Å; M138-D252 HydrophobicContact CG-CB 4.08Å; M138-D254 HydrophobicContact CE-CB 3.49Å; M138-D254 VanDerWaalsContact CE-CB 3.49Å; M138-D254 WeakPolarHBondContact CE-OD2 3.28Å; M138-D254 HydrophobicContact CG-CB 3.8Å; M138-N255 HydrophobicContact CB-CB 4.14Å; M138-N255 PolarHBondContact N-OD1 3.39Å; M138-P265 HydrophobicContact CE-CB 3.44Å; M138-P265 VanDerWaalsContact CE-CB 3.44Å; M138-P265 HydrophobicContact CE-CG 3.93Å
139	S	97.1	Very high	97.5	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-55.5	-53.8	172	-66.4	0	0	0	0	111.9	Y131 G136 A143 N255	Y131-S139 VanDerWaalsContact O-CB 3.29Å; Y131-S139 WeakPolarHBondContact O-CB 3.28Å; Y131-S139 PolarHBondContact O-OG 2.87Å; G136-S139 WeakPolarHBondContact O-CB 3.33Å; G136-S139 PolarHBondContact O-N 3.25Å; S139-A143 VanDerWaalsContact O-CB 3.31Å; S139-A143 WeakPolarHBondContact O-CB 3.2Å; S139-A143 PolarHBondContact O-N 2.79Å; S139-N255 PolarHBondContact N-OD1 3.03Å; S139-N255 PolarHBondContact OG-ND2 3.39Å; S139-N255 PolarHBondContact OG-OD1 3.2Å
140	F	97.9	Very high	97.3	Very high	10 Å²	10	22 Å²	22	4%	0.044	12%	0.121	C	C	.	.	H	α-helix	trans	-69	-49.8	-175.6	175.9	-91.2	0	0	0	112.7	W135 G136 Q137 A143 T144 V170 A259 P261	W135-F140 HydrophobicContact CH2-CD2 4.09Å; W135-F140 AromaticContact CZ2-CD2 3.93Å; W135-F140 HydrophobicContact CZ2-CD2 3.93Å; W135-F140 HydrophobicContact CZ2-CE2 4.32Å; G136-F140 PolarHBondContact O-N 2.9Å; Q137-F140 PolarHBondContact O-N 3.47Å; F140-A143 PolarHBondContact O-N 3.45Å; F140-T144 WeakPolarHBondContact O-CB 3.47Å; F140-T144 PolarHBondContact O-N 3.07Å; F140-T144 PolarHBondContact O-OG1 3.36Å; F140-V170 HydrophobicContact CD2-CG1 4.09Å; F140-V170 HydrophobicContact CE2-CB 4.13Å; F140-V170 HydrophobicContact CE2-CG1 4.12Å; F140-V170 VanDerWaalsContact CE2-O 3.29Å; F140-V170 WeakPolarHBondContact CE2-O 3.45Å; F140-A259 HydrophobicContact CB-CB 3.51Å; F140-A259 HydrophobicContact CD2-CB 4.26Å; F140-A259 HydrophobicContact CG-CB 3.92Å; F140-P261 HydrophobicContact CE1-CB 4.13Å; F140-P261 HydrophobicContact CE1-CG 4.28Å; F140-P261 HydrophobicContact CE2-CG 4.25Å; F140-P261 HydrophobicContact CZ-CB 3.89Å; F140-P261 HydrophobicContact CZ-CG 3.81Å
141	W	98.2	Very high	97.2	Very high	33 Å²	33	22.8 Å²	22.8	13%	0.125	12%	0.124	C	C	.	.	H	α-helix	trans	-72.2	-35.5	-177.6	-73.7	106.1	0	0	0	112	Q137 T144 V145 N260 P261 N263 T264 P265 I268	Q137-W141 WeakPolarHBondContact O-CB 3.28Å; Q137-W141 PolarHBondContact O-N 3.49Å; W141-T144 PolarHBondContact O-N 3.28Å; W141-V145 WeakPolarHBondContact O-CB 3.21Å; W141-V145 WeakPolarHBondContact O-CG2 3.32Å; W141-V145 PolarHBondContact O-N 3.13Å; W141-N260 PolarHBondContact NE1-O 2.55Å; W141-P261 WeakPolarHBondContact CH2-O 2.91Å; W141-P261 WeakPolarHBondContact CZ2-O 3.16Å; W141-N263 PolarHBondContact NE1-O 2.73Å; W141-N263 VanDerWaalsContact NE1-O 3.07Å; W141-T264 HydrophobicContact CD2-CG2 4.19Å; W141-T264 HydrophobicContact CE3-CG2 4.17Å; W141-T264 HydrophobicContact CH2-CG2 4.49Å; W141-T264 VanDerWaalsContact CH2-OG1 3.26Å; W141-T264 WeakPolarHBondContact CH2-OG1 3.28Å; W141-T264 HydrophobicContact CZ2-CG2 4.49Å; W141-T264 WeakPolarHBondContact CZ2-OG1 3.25Å; W141-T264 HydrophobicContact CZ3-CG2 4.34Å; W141-P265 HydrophobicContact CG-CG 4.37Å; W141-I268 HydrophobicContact CB-CD1 3.74Å; W141-I268 HydrophobicContact CB-CG1 3.92Å; W141-I268 HydrophobicContact CB-CG2 4.22Å; W141-I268 HydrophobicContact CD2-CD1 4.32Å; W141-I268 HydrophobicContact CE3-CD1 4.23Å; W141-I268 HydrophobicContact CG-CD1 4.16Å
142	G	95.8	Very high	97	Very high	10 Å²	10	21.6 Å²	21.6	10%	0.103	12%	0.122	C	C	.	.	H	α-helix	trans	-59.4	-47.9	170	0	0	0	0	0	111.7	M138 T144 V145 I146	M138-G142 WeakPolarHBondContact O-CA 3.49Å; M138-G142 PolarHBondContact O-N 2.98Å; G142-T144 VanDerWaalsContact C-N 3.35Å; G142-T144 PolarHBondContact O-N 2.77Å; G142-V145 PolarHBondContact O-N 3.24Å; G142-I146 WeakPolarHBondContact O-CB 3.47Å; G142-I146 VanDerWaalsContact O-CG1 3.25Å; G142-I146 WeakPolarHBondContact O-CG1 3.44Å; G142-I146 PolarHBondContact O-N 3.41Å
143	A	96.8	Very high	96.9	Very high	1 Å²	1	24.2 Å²	24.2	1%	0.008	14%	0.136	C	C	.	.	H	α-helix	trans	-57.5	-48.2	175.3	0	0	0	0	0	111.7	V132 S139 F140 T147 V170	V132-A143 HydrophobicContact CG1-CB 4.06Å; V132-A143 HydrophobicContact CG2-CB 3.76Å; S139-A143 VanDerWaalsContact O-CB 3.31Å; S139-A143 WeakPolarHBondContact O-CB 3.2Å; S139-A143 PolarHBondContact O-N 2.79Å; F140-A143 PolarHBondContact O-N 3.45Å; A143-T147 WeakPolarHBondContact O-CB 3.38Å; A143-T147 WeakPolarHBondContact O-CG2 3.49Å; A143-T147 PolarHBondContact O-N 3.33Å; A143-T147 PolarHBondContact O-OG1 2.99Å; A143-V170 HydrophobicContact CB-CG1 4.21Å; A143-V170 HydrophobicContact CB-CG2 4.27Å
144	T	97.3	Very high	96.8	Very high	30 Å²	30	26.8 Å²	26.8	18%	0.184	15%	0.153	C	C	.	.	H	α-helix	trans	-59.9	-49.3	-178.8	-60.3	0	0	0	0	111.9	F140 W141 G142 N148	F140-T144 WeakPolarHBondContact O-CB 3.47Å; F140-T144 PolarHBondContact O-N 3.07Å; F140-T144 PolarHBondContact O-OG1 3.36Å; W141-T144 PolarHBondContact O-N 3.28Å; G142-T144 VanDerWaalsContact C-N 3.35Å; G142-T144 PolarHBondContact O-N 2.77Å; T144-N148 WeakPolarHBondContact O-CB 3.42Å; T144-N148 PolarHBondContact O-N 3.38Å
145	V	96.4	Very high	96.7	Very high	54 Å²	54	36.4 Å²	36.4	33%	0.327	19%	0.188	S	C	.	.	H	α-helix	trans	-67.5	-49.5	-178.1	171.6	0	0	0	0	111.3	W141 G142 N148 L149 I268	W141-V145 WeakPolarHBondContact O-CB 3.21Å; W141-V145 WeakPolarHBondContact O-CG2 3.32Å; W141-V145 PolarHBondContact O-N 3.13Å; G142-V145 PolarHBondContact O-N 3.24Å; V145-N148 PolarHBondContact O-N 3.12Å; V145-L149 PolarHBondContact O-N 3.18Å; V145-I268 HydrophobicContact CG2-CD1 4.18Å; V145-I268 HydrophobicContact CG2-CG2 4.26Å
146	I	95.6	Very high	96.7	Very high	45 Å²	45	40.9 Å²	40.9	23%	0.231	21%	0.211	C	C	.	.	H	α-helix	trans	-68.8	-44.4	-173.2	-63.7	-61.7	0	0	0	111.6	F128 G142 N148 L149	F128-I146 HydrophobicContact CD2-CG2 4.36Å; F128-I146 HydrophobicContact CE2-CB 3.74Å; F128-I146 HydrophobicContact CE2-CG1 4.09Å; F128-I146 HydrophobicContact CE2-CG2 3.72Å; F128-I146 HydrophobicContact CZ-CB 3.99Å; F128-I146 HydrophobicContact CZ-CG2 3.88Å; G142-I146 WeakPolarHBondContact O-CB 3.47Å; G142-I146 VanDerWaalsContact O-CG1 3.25Å; G142-I146 WeakPolarHBondContact O-CG1 3.44Å; G142-I146 PolarHBondContact O-N 3.41Å; I146-N148 VanDerWaalsContact C-N 3.34Å; I146-N148 PolarHBondContact O-N 3.47Å; I146-L149 HydrophobicContact CD1-CD1 4.23Å; I146-L149 WeakPolarHBondContact O-CB 3.45Å; I146-L149 WeakPolarHBondContact O-CG 3.33Å; I146-L149 PolarHBondContact O-N 2.93Å
147	T	97	Very high	96.6	Very high	9 Å²	9	40.9 Å²	40.9	6%	0.055	21%	0.212	C	C	.	.	H	α-helix	trans	-68	-35.3	178.8	54.9	0	0	0	0	112	F128 A143 L149 L150 V161 I164 W165 F178	F128-T147 HydrophobicContact CE1-CG2 4.25Å; F128-T147 HydrophobicContact CZ-CG2 4.11Å; A143-T147 WeakPolarHBondContact O-CB 3.38Å; A143-T147 WeakPolarHBondContact O-CG2 3.49Å; A143-T147 PolarHBondContact O-N 3.33Å; A143-T147 PolarHBondContact O-OG1 2.99Å; T147-L149 PolarHBondContact O-N 3.29Å; T147-L149 VanDerWaalsContact O-N 3.12Å; T147-L150 WeakPolarHBondContact O-CB 3.46Å; T147-L150 PolarHBondContact O-N 3.29Å; T147-L150 VanDerWaalsContact O-N 3.13Å; T147-V161 WeakPolarHBondContact O-CG2 3.35Å; T147-I164 HydrophobicContact CG2-CG2 4.36Å; T147-W165 PolarHBondContact OG1-NE1 2.94Å; T147-F178 HydrophobicContact CG2-CZ 4.03Å
148	N	96.9	Very high	96.6	Very high	62 Å²	62	44.2 Å²	44.2	33%	0.332	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-70.1	-3.2	175.8	-168.6	34.9	0	0	0	113.8	T144 V145 I146 L150 S151 W165 K287	T144-N148 WeakPolarHBondContact O-CB 3.42Å; T144-N148 PolarHBondContact O-N 3.38Å; V145-N148 PolarHBondContact O-N 3.12Å; I146-N148 VanDerWaalsContact C-N 3.34Å; I146-N148 PolarHBondContact O-N 3.47Å; N148-L150 PolarHBondContact O-N 3.43Å; N148-S151 PolarHBondContact O-N 3.26Å; N148-S151 PolarHBondContact O-OG 3.03Å; N148-S151 PolarHBondContact OD1-OG 3.44Å; N148-W165 HydrophobicContact CB-CH2 4.3Å; N148-W165 HydrophobicContact CB-CZ2 4.1Å; N148-K287 WeakPolarHBondContact O-CE 3.49Å; N148-K287 PolarHBondContact O-NZ 3.31Å
149	L	95.1	Very high	96.6	Very high	27 Å²	27	49.4 Å²	49.4	14%	0.141	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-63.5	-31.8	167.3	-67	179.8	0	0	0	111.5	V145 I146 T147 S151 A152 L281 V291	V145-L149 PolarHBondContact O-N 3.18Å; I146-L149 HydrophobicContact CD1-CD1 4.23Å; I146-L149 WeakPolarHBondContact O-CB 3.45Å; I146-L149 WeakPolarHBondContact O-CG 3.33Å; I146-L149 PolarHBondContact O-N 2.93Å; T147-L149 PolarHBondContact O-N 3.29Å; T147-L149 VanDerWaalsContact O-N 3.12Å; L149-S151 PolarHBondContact O-N 2.95Å; L149-A152 VanDerWaalsContact O-CB 3.24Å; L149-A152 WeakPolarHBondContact O-CB 3.49Å; L149-A152 PolarHBondContact O-N 3.26Å; L149-A152 VanDerWaalsContact O-N 3.08Å; L149-L281 HydrophobicContact CD1-CD1 4.39Å; L149-L281 HydrophobicContact CD1-CD2 3.72Å; L149-L281 HydrophobicContact CD2-CD1 4.23Å; L149-L281 HydrophobicContact CD2-CD2 4.12Å; L149-V291 HydrophobicContact CB-CG2 3.74Å; L149-V291 HydrophobicContact CD2-CG2 4.01Å; L149-V291 HydrophobicContact CG-CG2 4.31Å
150	L	94.4	Very high	96.7	Very high	56 Å²	56	52 Å²	52	29%	0.293	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-66.4	-20.8	179.6	-64.6	172.3	0	0	0	113.4	T147 N148 A152 I153 G157 L160 V161 I164	T147-L150 WeakPolarHBondContact O-CB 3.46Å; T147-L150 PolarHBondContact O-N 3.29Å; T147-L150 VanDerWaalsContact O-N 3.13Å; N148-L150 PolarHBondContact O-N 3.43Å; L150-A152 PolarHBondContact O-N 3.44Å; L150-A152 VanDerWaalsContact O-N 3.11Å; L150-I153 HydrophobicContact CD2-CD1 4.03Å; L150-I153 WeakPolarHBondContact O-CB 3.47Å; L150-I153 WeakPolarHBondContact O-CG1 3.48Å; L150-I153 PolarHBondContact O-N 3.41Å; L150-G157 VanDerWaalsContact O-CA 3.3Å; L150-G157 WeakPolarHBondContact O-CA 3.38Å; L150-L160 HydrophobicContact CB-CD2 4.27Å; L150-L160 HydrophobicContact CD1-CD2 4.22Å; L150-L160 HydrophobicContact CD2-CD2 4.48Å; L150-V161 HydrophobicContact CB-CG2 3.8Å; L150-I164 HydrophobicContact CD1-CD1 3.26Å
151	S	96.4	Very high	96.7	Very high	31 Å²	31	51.7 Å²	51.7	22%	0.217	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-68.1	-7.6	173.5	64	0	0	0	0	113.5	N148 L149 I153 K287	N148-S151 PolarHBondContact O-N 3.26Å; N148-S151 PolarHBondContact O-OG 3.03Å; N148-S151 PolarHBondContact OD1-OG 3.44Å; L149-S151 PolarHBondContact O-N 2.95Å; S151-I153 PolarHBondContact O-N 2.92Å; S151-K287 PolarHBondContact OG-NZ 3.41Å
152	A	95.9	Very high	96.7	Very high	15 Å²	15	53.5 Å²	53.5	12%	0.124	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-72.2	-16.7	169.7	0	0	0	0	0	113.4	L149 L150 P154 K287 L288 V291	L149-A152 VanDerWaalsContact O-CB 3.24Å; L149-A152 WeakPolarHBondContact O-CB 3.49Å; L149-A152 PolarHBondContact O-N 3.26Å; L149-A152 VanDerWaalsContact O-N 3.08Å; L150-A152 PolarHBondContact O-N 3.44Å; L150-A152 VanDerWaalsContact O-N 3.11Å; A152-P154 WeakPolarHBondContact O-CD 3.31Å; A152-K287 HydrophobicContact CB-CB 4.47Å; A152-K287 HydrophobicContact CB-CD 3.95Å; A152-K287 HydrophobicContact CB-CG 3.88Å; A152-L288 HydrophobicContact CB-CB 4.29Å; A152-L288 HydrophobicContact CB-CD1 4.43Å; A152-V291 HydrophobicContact CB-CG2 4.3Å
153	I	96.5	Very high	96.8	Very high	57 Å²	57	62 Å²	62	29%	0.292	31%	0.312	S	S	.	.	S	Bend	trans	-68.8	122.5	179	-60.8	171.4	0	0	0	108.9	L150 S151 I156 G157 L160	L150-I153 HydrophobicContact CD2-CD1 4.03Å; L150-I153 WeakPolarHBondContact O-CB 3.47Å; L150-I153 WeakPolarHBondContact O-CG1 3.48Å; L150-I153 PolarHBondContact O-N 3.41Å; S151-I153 PolarHBondContact O-N 2.92Å; I153-I156 HydrophobicContact CG2-CD1 4.13Å; I153-I156 HydrophobicContact CG2-CG1 3.66Å; I153-G157 VanDerWaalsContact O-CA 3.31Å; I153-G157 WeakPolarHBondContact O-CA 3.35Å; I153-G157 PolarHBondContact O-N 3.5Å; I153-L160 HydrophobicContact CD1-CD2 4.09Å
154	P	96.1	Very high	96.8	Very high	70 Å²	70	63.6 Å²	63.6	46%	0.455	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	144.2	179.5	-25.2	34.9	0	0	0	112.4	A152 I156 L288	A152-P154 WeakPolarHBondContact O-CD 3.31Å; P154-I156 PolarHBondContact O-N 3.07Å; P154-L288 HydrophobicContact CG-CD2 4.44Å
155	Y	96.1	Very high	96.9	Very high	229 Å²	229	63.2 Å²	63.2	90%	0.898	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.8	-53.1	177.2	-46.2	-70.9	0	0	0	115.5
156	I	97.8	Very high	96.9	Very high	105 Å²	105	62.4 Å²	62.4	54%	0.538	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	-6.7	-170.6	62.5	169.9	0	0	0	114.4	I153 P154 T158 D159 L160	I153-I156 HydrophobicContact CG2-CD1 4.13Å; I153-I156 HydrophobicContact CG2-CG1 3.66Å; P154-I156 PolarHBondContact O-N 3.07Å; I156-T158 PolarHBondContact O-N 2.88Å; I156-D159 PolarHBondContact O-N 3.18Å; I156-L160 WeakPolarHBondContact O-CB 3.2Å; I156-L160 PolarHBondContact O-N 2.97Å
157	G	97.3	Very high	96.9	Very high	1 Å²	1	61.7 Å²	61.7	1%	0.01	32%	0.322	C	S	.	.	H	α-helix	trans	-61.5	-45.7	-168.3	0	0	0	0	0	114.2	L150 I153 L160 V161	L150-G157 VanDerWaalsContact O-CA 3.3Å; L150-G157 WeakPolarHBondContact O-CA 3.38Å; I153-G157 VanDerWaalsContact O-CA 3.31Å; I153-G157 WeakPolarHBondContact O-CA 3.35Å; I153-G157 PolarHBondContact O-N 3.5Å; G157-L160 PolarHBondContact O-N 3.49Å; G157-V161 WeakPolarHBondContact O-CG2 3.45Å; G157-V161 PolarHBondContact O-N 2.84Å
158	T	96.8	Very high	96.9	Very high	82 Å²	82	70.8 Å²	70.8	50%	0.503	36%	0.356	S	S	.	.	H	α-helix	trans	-64.7	-45.1	-179.4	-54.1	0	0	0	0	111.6	I156 L160 V161 Q162	I156-T158 PolarHBondContact O-N 2.88Å; T158-L160 VanDerWaalsContact C-N 3.31Å; T158-L160 PolarHBondContact O-N 3.21Å; T158-V161 PolarHBondContact O-N 3.08Å; T158-Q162 PolarHBondContact O-N 3.46Å
159	D	98	Very high	96.9	Very high	111 Å²	111	70.9 Å²	70.9	59%	0.594	36%	0.362	S	S	*	.	H	α-helix	trans	-63.4	-39.9	178.7	-62.6	-18	0	0	0	110.9	I156 V161 Q162 W163	I156-D159 PolarHBondContact O-N 3.18Å; D159-V161 PolarHBondContact O-N 2.92Å; D159-Q162 PolarHBondContact O-N 2.8Å; D159-W163 WeakPolarHBondContact O-CB 3.4Å; D159-W163 PolarHBondContact O-N 3.4Å
160	L	97.8	Very high	97	Very high	55 Å²	55	69.8 Å²	69.8	29%	0.288	36%	0.356	S	S	.	.	H	α-helix	trans	-62.8	-42.6	176.5	-176	64.5	0	0	0	112	L150 I153 I156 G157 T158 W163 I164	L150-L160 HydrophobicContact CB-CD2 4.27Å; L150-L160 HydrophobicContact CD1-CD2 4.22Å; L150-L160 HydrophobicContact CD2-CD2 4.48Å; I153-L160 HydrophobicContact CD1-CD2 4.09Å; I156-L160 WeakPolarHBondContact O-CB 3.2Å; I156-L160 PolarHBondContact O-N 2.97Å; G157-L160 PolarHBondContact O-N 3.49Å; T158-L160 VanDerWaalsContact C-N 3.31Å; T158-L160 PolarHBondContact O-N 3.21Å; L160-W163 HydrophobicContact CD1-CE3 4.16Å; L160-W163 PolarHBondContact O-N 2.98Å; L160-I164 HydrophobicContact CD1-CD1 4.44Å; L160-I164 HydrophobicContact CG-CD1 4.17Å; L160-I164 VanDerWaalsContact O-CG1 3.3Å; L160-I164 WeakPolarHBondContact O-CG1 3.28Å; L160-I164 PolarHBondContact O-N 3.04Å
161	V	98.1	Very high	97.1	Very high	3 Å²	3	71 Å²	71	2%	0.018	36%	0.363	C	S	.	.	H	α-helix	trans	-64.1	-49.4	177.5	170.8	0	0	0	0	111	T147 L150 G157 T158 D159 W163 I164 W165	T147-V161 WeakPolarHBondContact O-CG2 3.35Å; L150-V161 HydrophobicContact CB-CG2 3.8Å; G157-V161 WeakPolarHBondContact O-CG2 3.45Å; G157-V161 PolarHBondContact O-N 2.84Å; T158-V161 PolarHBondContact O-N 3.08Å; D159-V161 PolarHBondContact O-N 2.92Å; V161-W163 VanDerWaalsContact C-N 3.27Å; V161-W163 PolarHBondContact O-N 2.91Å; V161-I164 PolarHBondContact O-N 2.96Å; V161-I164 VanDerWaalsContact O-N 3.16Å; V161-W165 HydrophobicContact CG1-CD2 3.64Å; V161-W165 VanDerWaalsContact CG1-CE2 3.44Å; V161-W165 HydrophobicContact CG1-CE3 3.68Å; V161-W165 HydrophobicContact CG1-CG 4.48Å; V161-W165 HydrophobicContact CG1-CH2 3.46Å; V161-W165 VanDerWaalsContact CG1-CH2 3.46Å; V161-W165 HydrophobicContact CG1-CZ2 3.38Å; V161-W165 HydrophobicContact CG1-CZ3 3.6Å; V161-W165 PolarHBondContact O-N 3.28Å
162	Q	98	Very high	97.1	Very high	71 Å²	71	70.7 Å²	70.7	33%	0.332	36%	0.361	S	S	.	.	H	α-helix	trans	-63.6	-35.1	178.4	-69.5	-178.6	-3	0	0	112	T158 D159 W165 G166 G167	T158-Q162 PolarHBondContact O-N 3.46Å; D159-Q162 PolarHBondContact O-N 2.8Å; Q162-W165 PolarHBondContact O-N 3.11Å; Q162-G166 WeakPolarHBondContact O-CA 3.39Å; Q162-G166 PolarHBondContact O-N 3.5Å; Q162-G167 WeakPolarHBondContact CA-O 3.25Å; Q162-G167 PolarHBondContact O-N 3.42Å
163	W	98.2	Very high	97.2	Very high	188 Å²	188	72.9 Å²	72.9	71%	0.712	37%	0.374	S	S	*	.	H	α-helix	trans	-64.1	-44.6	173.2	-179.6	78.2	0	0	0	111.8	D159 L160 V161 W165 G166 R177	D159-W163 WeakPolarHBondContact O-CB 3.4Å; D159-W163 PolarHBondContact O-N 3.4Å; L160-W163 HydrophobicContact CD1-CE3 4.16Å; L160-W163 PolarHBondContact O-N 2.98Å; V161-W163 VanDerWaalsContact C-N 3.27Å; V161-W163 PolarHBondContact O-N 2.91Å; W163-W165 VanDerWaalsContact C-N 3.33Å; W163-W165 PolarHBondContact O-N 3.25Å; W163-G166 PolarHBondContact O-N 2.85Å; W163-R177 PolarHBondContact O-NH1 3.43Å
164	I	97.3	Very high	97.3	Very high	34 Å²	34	70.2 Å²	70.2	17%	0.174	36%	0.36	C	S	.	.	H	α-helix	trans	-63.4	-38.3	175.1	-71.8	167.5	0	0	0	111.3	T147 L150 L160 V161 R177 F178	T147-I164 HydrophobicContact CG2-CG2 4.36Å; L150-I164 HydrophobicContact CD1-CD1 3.26Å; L160-I164 HydrophobicContact CD1-CD1 4.44Å; L160-I164 HydrophobicContact CG-CD1 4.17Å; L160-I164 VanDerWaalsContact O-CG1 3.3Å; L160-I164 WeakPolarHBondContact O-CG1 3.28Å; L160-I164 PolarHBondContact O-N 3.04Å; V161-I164 PolarHBondContact O-N 2.96Å; V161-I164 VanDerWaalsContact O-N 3.16Å; I164-R177 WeakPolarHBondContact O-CD 3.15Å; I164-R177 PolarHBondContact O-NE 3.27Å; I164-R177 PolarHBondContact O-NH1 3.37Å; I164-F178 HydrophobicContact CG2-CE1 4.21Å; I164-F178 HydrophobicContact CG2-CZ 4.39Å
165	W	98.3	Very high	97.4	Very high	23 Å²	23	66.9 Å²	66.9	9%	0.087	34%	0.338	C	S	.	.	H	α-helix	trans	-74	-33.6	177.6	-66.4	-16.7	0	0	0	112.7	T147 N148 V161 Q162 W163 G167 Y168 S169 V170 T174	T147-W165 PolarHBondContact OG1-NE1 2.94Å; N148-W165 HydrophobicContact CB-CH2 4.3Å; N148-W165 HydrophobicContact CB-CZ2 4.1Å; V161-W165 HydrophobicContact CG1-CD2 3.64Å; V161-W165 VanDerWaalsContact CG1-CE2 3.44Å; V161-W165 HydrophobicContact CG1-CE3 3.68Å; V161-W165 HydrophobicContact CG1-CG 4.48Å; V161-W165 HydrophobicContact CG1-CH2 3.46Å; V161-W165 VanDerWaalsContact CG1-CH2 3.46Å; V161-W165 HydrophobicContact CG1-CZ2 3.38Å; V161-W165 HydrophobicContact CG1-CZ3 3.6Å; V161-W165 PolarHBondContact O-N 3.28Å; Q162-W165 PolarHBondContact O-N 3.11Å; W163-W165 VanDerWaalsContact C-N 3.33Å; W163-W165 PolarHBondContact O-N 3.25Å; W165-G167 VanDerWaalsContact C-N 3.32Å; W165-Y168 VanDerWaalsContact CZ3-O 3.23Å; W165-Y168 WeakPolarHBondContact CZ3-O 3.26Å; W165-S169 VanDerWaalsContact CE3-CA 3.48Å; W165-V170 HydrophobicContact CD2-CG2 4.43Å; W165-V170 HydrophobicContact CG-CG2 4.37Å; W165-V170 HydrophobicContact CZ2-CG2 4.37Å; W165-T174 WeakPolarHBondContact CA-OG1 3.44Å; W165-T174 PolarHBondContact O-N 3.49Å; W165-T174 PolarHBondContact O-OG1 2.9Å
166	G	97.3	Very high	97.5	Very high	37 Å²	37	59 Å²	59	38%	0.381	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	74	27.6	-168.8	0	0	0	0	0	113	Q162 W163	Q162-G166 WeakPolarHBondContact O-CA 3.39Å; Q162-G166 PolarHBondContact O-N 3.5Å; W163-G166 PolarHBondContact O-N 2.85Å
167	G	96.3	Very high	97.5	Very high	30 Å²	30	57.3 Å²	57.3	31%	0.309	30%	0.301	S	S	.	.	S	Bend	trans	171.3	-165.6	-171.6	0	0	0	0	0	110.8	Q162 W165	Q162-G167 WeakPolarHBondContact CA-O 3.25Å; Q162-G167 PolarHBondContact O-N 3.42Å; W165-G167 VanDerWaalsContact C-N 3.32Å
168	Y	96.9	Very high	97.6	Very high	199 Å²	199	57.8 Å²	57.8	78%	0.78	30%	0.303	S	S	*	.	S	Bend	trans	-90.3	-11.1	-176.1	-58.7	-71.6	0	0	0	114.1	W165	W165-Y168 VanDerWaalsContact CZ3-O 3.23Å; W165-Y168 WeakPolarHBondContact CZ3-O 3.26Å
169	S	96.3	Very high	97.7	Very high	65 Å²	65	55.9 Å²	55.9	46%	0.455	29%	0.288	S	S	.	.	S	Bend	trans	-150.7	168	177.7	57.1	0	0	0	0	109.8	W165 D171	W165-S169 VanDerWaalsContact CE3-CA 3.48Å; S169-D171 PolarHBondContact O-N 3.44Å
170	V	97.8	Very high	97.7	Very high	3 Å²	3	54.5 Å²	54.5	2%	0.018	28%	0.283	C	S	.	.	S	Bend	trans	-61.4	123.9	167	175.5	0	0	0	0	108.7	W135 F140 A143 W165 T174	W135-V170 HydrophobicContact CH2-CG1 3.71Å; W135-V170 HydrophobicContact CZ3-CG1 4.04Å; F140-V170 HydrophobicContact CD2-CG1 4.09Å; F140-V170 HydrophobicContact CE2-CB 4.13Å; F140-V170 HydrophobicContact CE2-CG1 4.12Å; F140-V170 VanDerWaalsContact CE2-O 3.29Å; F140-V170 WeakPolarHBondContact CE2-O 3.45Å; A143-V170 HydrophobicContact CB-CG1 4.21Å; A143-V170 HydrophobicContact CB-CG2 4.27Å; W165-V170 HydrophobicContact CD2-CG2 4.43Å; W165-V170 HydrophobicContact CG-CG2 4.37Å; W165-V170 HydrophobicContact CZ2-CG2 4.37Å; V170-T174 HydrophobicContact CG1-CG2 4.22Å
171	D	96.7	Very high	97.8	Very high	82 Å²	82	57 Å²	57	44%	0.439	29%	0.292	S	S	.	.	S	Bend	trans	-158.4	-170.6	-178.7	-162.1	2.1	0	0	0	110.8	S169 P173 T174 L175	S169-D171 PolarHBondContact O-N 3.44Å; D171-P173 VanDerWaalsContact C-CD 3.44Å; D171-P173 VanDerWaalsContact C-N 3.33Å; D171-T174 PolarHBondContact N-OG1 3.05Å; D171-T174 WeakPolarHBondContact O-CA 3.36Å; D171-T174 VanDerWaalsContact O-CB 3.25Å; D171-T174 WeakPolarHBondContact O-CB 3.5Å; D171-T174 PolarHBondContact O-N 2.99Å; D171-T174 PolarHBondContact O-OG1 3.19Å; D171-L175 PolarHBondContact O-N 3.08Å
172	S	96.8	Very high	97.8	Very high	24 Å²	24	58.1 Å²	58.1	17%	0.168	30%	0.297	C	S	.	.	H	α-helix	trans	-43.5	-47.3	178.5	-83.3	0	0	0	0	114	D58 A59 T174 L175 T176	D58-S172 PolarHBondContact OD2-OG 3.47Å; A59-S172 WeakPolarHBondContact CB-OG 3.5Å; A59-S172 PolarHBondContact N-OG 3.1Å; S172-T174 PolarHBondContact O-N 3.39Å; S172-L175 PolarHBondContact O-N 3.43Å; S172-L175 VanDerWaalsContact O-N 3.08Å; S172-T176 PolarHBondContact O-N 3.39Å; S172-T176 PolarHBondContact O-OG1 3.26Å; S172-T176 VanDerWaalsContact O-OG1 3.13Å
173	P	97.9	Very high	97.8	Very high	62 Å²	62	58.7 Å²	58.7	40%	0.403	30%	0.299	S	S	.	.	H	α-helix	trans	-58.7	-34.5	177.1	-25	35.2	0	0	0	113.6	D171 R177	D171-P173 VanDerWaalsContact C-CD 3.44Å; D171-P173 VanDerWaalsContact C-N 3.33Å; P173-R177 WeakPolarHBondContact O-CG 3.49Å; P173-R177 PolarHBondContact O-N 2.87Å; P173-R177 PolarHBondContact O-NE 3.13Å
174	T	98.1	Very high	97.9	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-71.7	-40	175.6	-44.1	0	0	0	0	111.4	W165 V170 D171 S172 R177 F178	W165-T174 WeakPolarHBondContact CA-OG1 3.44Å; W165-T174 PolarHBondContact O-N 3.49Å; W165-T174 PolarHBondContact O-OG1 2.9Å; V170-T174 HydrophobicContact CG1-CG2 4.22Å; D171-T174 PolarHBondContact N-OG1 3.05Å; D171-T174 WeakPolarHBondContact O-CA 3.36Å; D171-T174 VanDerWaalsContact O-CB 3.25Å; D171-T174 WeakPolarHBondContact O-CB 3.5Å; D171-T174 PolarHBondContact O-N 2.99Å; D171-T174 PolarHBondContact O-OG1 3.19Å; S172-T174 PolarHBondContact O-N 3.39Å; T174-R177 WeakPolarHBondContact O-CG 3.25Å; T174-F178 HydrophobicContact CG2-CD1 4.33Å; T174-F178 HydrophobicContact CG2-CD2 4.42Å; T174-F178 HydrophobicContact CG2-CE1 4.04Å; T174-F178 HydrophobicContact CG2-CE2 4.16Å; T174-F178 HydrophobicContact CG2-CZ 3.95Å; T174-F178 WeakPolarHBondContact O-CB 3.34Å; T174-F178 WeakPolarHBondContact O-CG 3.47Å; T174-F178 PolarHBondContact O-N 3.11Å
175	L	98	Very high	97.9	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-66.7	-45	-179.8	-174.4	55.6	0	0	0	112	A62 V132 L133 W135 D171 S172 R177 F178 F179	A62-L175 HydrophobicContact CB-CD2 3.55Å; V132-L175 HydrophobicContact CG1-CD1 4.38Å; L133-L175 HydrophobicContact CD2-CD1 3.99Å; W135-L175 HydrophobicContact CD2-CD2 3.85Å; W135-L175 HydrophobicContact CE3-CB 4.26Å; W135-L175 HydrophobicContact CE3-CD1 3.64Å; W135-L175 HydrophobicContact CE3-CD2 3.68Å; W135-L175 HydrophobicContact CE3-CG 4.07Å; W135-L175 HydrophobicContact CG-CD2 4.27Å; W135-L175 HydrophobicContact CH2-CB 4.15Å; W135-L175 HydrophobicContact CZ3-CB 3.8Å; W135-L175 HydrophobicContact CZ3-CD1 3.85Å; W135-L175 HydrophobicContact CZ3-CD2 4.06Å; W135-L175 HydrophobicContact CZ3-CG 4.12Å; D171-L175 PolarHBondContact O-N 3.08Å; S172-L175 PolarHBondContact O-N 3.43Å; S172-L175 VanDerWaalsContact O-N 3.08Å; L175-R177 PolarHBondContact O-N 3.44Å; L175-F178 PolarHBondContact O-N 2.99Å; L175-F179 PolarHBondContact O-N 3.4Å
176	T	98.3	Very high	98	Very high	63 Å²	63	53 Å²	53	39%	0.387	28%	0.284	S	S	.	.	H	α-helix	trans	-61.3	-45.8	179.6	-51.6	0	0	0	0	111.9	P57 S172 F179 T180	P57-T176 PolarHBondContact O-OG1 3.11Å; S172-T176 PolarHBondContact O-N 3.39Å; S172-T176 PolarHBondContact O-OG1 3.26Å; S172-T176 VanDerWaalsContact O-OG1 3.13Å; T176-F179 WeakPolarHBondContact O-CB 3.19Å; T176-F179 PolarHBondContact O-N 3.46Å; T176-T180 PolarHBondContact O-N 3.12Å; T176-T180 PolarHBondContact O-OG1 2.9Å; T176-T180 VanDerWaalsContact O-OG1 3.08Å
177	R	98.2	Very high	98	Very high	71 Å²	71	55.8 Å²	55.8	27%	0.268	29%	0.286	S	S	.	.	H	α-helix	trans	-66.8	-38.7	176.7	66.1	-174.6	68.6	-155.2	-12	112.4	W163 I164 P173 T174 L175 F179 T180 F181	W163-R177 PolarHBondContact O-NH1 3.43Å; I164-R177 WeakPolarHBondContact O-CD 3.15Å; I164-R177 PolarHBondContact O-NE 3.27Å; I164-R177 PolarHBondContact O-NH1 3.37Å; P173-R177 WeakPolarHBondContact O-CG 3.49Å; P173-R177 PolarHBondContact O-N 2.87Å; P173-R177 PolarHBondContact O-NE 3.13Å; T174-R177 WeakPolarHBondContact O-CG 3.25Å; L175-R177 PolarHBondContact O-N 3.44Å; R177-F179 VanDerWaalsContact C-N 3.3Å; R177-F179 PolarHBondContact O-N 2.93Å; R177-T180 WeakPolarHBondContact O-CB 3.49Å; R177-T180 PolarHBondContact O-N 3.16Å; R177-T180 VanDerWaalsContact O-N 3.17Å; R177-F181 HydrophobicContact CB-CD2 4.36Å; R177-F181 HydrophobicContact CB-CE2 4.28Å; R177-F181 WeakPolarHBondContact O-CD2 3.1Å; R177-F181 PolarHBondContact O-N 3.01Å
178	F	98.6	Very high	98.1	Very high	10 Å²	10	58.1 Å²	58.1	4%	0.044	29%	0.291	C	S	.	.	H	α-helix	trans	-66.1	-37.2	178.8	-82.8	14.9	0	0	0	110.5	F128 M129 V132 L133 T147 I164 T174 L175 F181 H182	F128-F178 AromaticContact CE1-CE2 3.92Å; F128-F178 HydrophobicContact CE1-CE2 3.92Å; F128-F178 HydrophobicContact CE1-CZ 4.2Å; F128-F178 HydrophobicContact CZ-CE2 4.47Å; M129-F178 HydrophobicContact CB-CB 4.26Å; M129-F178 HydrophobicContact CB-CD2 4.42Å; M129-F178 HydrophobicContact CB-CG 4.34Å; M129-F178 HydrophobicContact CG-CB 4.31Å; M129-F178 HydrophobicContact CG-CD1 4.16Å; M129-F178 HydrophobicContact CG-CD2 4.04Å; M129-F178 HydrophobicContact CG-CE2 4.39Å; M129-F178 HydrophobicContact CG-CG 3.92Å; M129-F178 HydrophobicContact SD-CD1 4.11Å; M129-F178 HydrophobicContact SD-CG 4.35Å; V132-F178 HydrophobicContact CB-CD2 3.93Å; V132-F178 HydrophobicContact CG1-CD2 3.97Å; V132-F178 HydrophobicContact CG2-CD2 3.87Å; V132-F178 HydrophobicContact CG2-CE2 4.04Å; L133-F178 HydrophobicContact CD2-CB 4.49Å; T147-F178 HydrophobicContact CG2-CZ 4.03Å; I164-F178 HydrophobicContact CG2-CE1 4.21Å; I164-F178 HydrophobicContact CG2-CZ 4.39Å; T174-F178 HydrophobicContact CG2-CD1 4.33Å; T174-F178 HydrophobicContact CG2-CD2 4.42Å; T174-F178 HydrophobicContact CG2-CE1 4.04Å; T174-F178 HydrophobicContact CG2-CE2 4.16Å; T174-F178 HydrophobicContact CG2-CZ 3.95Å; T174-F178 WeakPolarHBondContact O-CB 3.34Å; T174-F178 WeakPolarHBondContact O-CG 3.47Å; T174-F178 PolarHBondContact O-N 3.11Å; L175-F178 PolarHBondContact O-N 2.99Å; F178-F181 PolarHBondContact O-N 3.45Å; F178-H182 WeakPolarHBondContact O-CB 3.13Å; F178-H182 PolarHBondContact O-N 2.88Å
179	F	98.8	Very high	98.2	Very high	43 Å²	43	49 Å²	49	19%	0.189	26%	0.255	C	S	.	.	H	α-helix	trans	-59.7	-48.7	169.4	174.8	-109.2	0	0	0	111.7	A52 Y55 P57 L133 L175 T176 R177 F181 H182 F183	A52-F179 HydrophobicContact CB-CE2 4.22Å; A52-F179 HydrophobicContact CB-CZ 4.14Å; Y55-F179 AromaticContact CD1-CD2 3.66Å; Y55-F179 HydrophobicContact CD1-CD2 3.66Å; Y55-F179 AromaticContact CD1-CE2 3.67Å; Y55-F179 HydrophobicContact CD1-CE2 3.67Å; Y55-F179 HydrophobicContact CD1-CG 4.35Å; Y55-F179 HydrophobicContact CD1-CZ 4.36Å; Y55-F179 HydrophobicContact CE1-CB 4.34Å; Y55-F179 AromaticContact CE1-CD2 3.6Å; Y55-F179 HydrophobicContact CE1-CD2 3.6Å; Y55-F179 HydrophobicContact CE1-CE2 4.12Å; Y55-F179 HydrophobicContact CE1-CG 4.04Å; P57-F179 HydrophobicContact CB-CB 3.81Å; P57-F179 HydrophobicContact CB-CD1 3.97Å; P57-F179 HydrophobicContact CB-CG 3.92Å; P57-F179 HydrophobicContact CG-CD1 3.94Å; P57-F179 HydrophobicContact CG-CE1 4.43Å; P57-F179 HydrophobicContact CG-CG 4.38Å; L133-F179 HydrophobicContact CD1-CD2 4.05Å; L133-F179 HydrophobicContact CD2-CB 3.9Å; L175-F179 PolarHBondContact O-N 3.4Å; T176-F179 WeakPolarHBondContact O-CB 3.19Å; T176-F179 PolarHBondContact O-N 3.46Å; R177-F179 VanDerWaalsContact C-N 3.3Å; R177-F179 PolarHBondContact O-N 2.93Å; F179-F181 PolarHBondContact O-N 3.43Å; F179-H182 PolarHBondContact O-N 2.84Å; F179-F183 HydrophobicContact CZ-CD2 4.29Å; F179-F183 WeakPolarHBondContact O-CB 3.48Å; F179-F183 PolarHBondContact O-N 3.06Å
180	T	98.6	Very high	98.4	Very high	81 Å²	81	47.6 Å²	47.6	50%	0.497	25%	0.248	S	C	.	.	H	α-helix	trans	-58.5	-47	177.9	-53.4	0	0	0	0	112.4	T176 R177 F183 I184	T176-T180 PolarHBondContact O-N 3.12Å; T176-T180 PolarHBondContact O-OG1 2.9Å; T176-T180 VanDerWaalsContact O-OG1 3.08Å; R177-T180 WeakPolarHBondContact O-CB 3.49Å; R177-T180 PolarHBondContact O-N 3.16Å; R177-T180 VanDerWaalsContact O-N 3.17Å; T180-F183 PolarHBondContact O-N 3.26Å; T180-I184 WeakPolarHBondContact O-CG2 3.37Å; T180-I184 PolarHBondContact O-N 3.5Å; T180-I184 VanDerWaalsContact O-N 3.1Å
181	F	98.7	Very high	98.4	Very high	108 Å²	108	50.6 Å²	50.6	47%	0.474	27%	0.273	S	S	.	.	H	α-helix	trans	-68.3	-41.6	178.8	-74.5	-58.1	0	0	0	112.6	M129 R177 F178 F179 F183 I184 L185	M129-F181 HydrophobicContact CE-CB 3.83Å; M129-F181 HydrophobicContact SD-CB 3.44Å; M129-F181 WeakPolarHBondContact SD-CB 3Å; M129-F181 HydrophobicContact SD-CD2 4.45Å; M129-F181 HydrophobicContact SD-CG 4.29Å; R177-F181 HydrophobicContact CB-CD2 4.36Å; R177-F181 HydrophobicContact CB-CE2 4.28Å; R177-F181 WeakPolarHBondContact O-CD2 3.1Å; R177-F181 PolarHBondContact O-N 3.01Å; F178-F181 PolarHBondContact O-N 3.45Å; F179-F181 PolarHBondContact O-N 3.43Å; F181-F183 PolarHBondContact O-N 3.36Å; F181-I184 WeakPolarHBondContact O-CG2 3.44Å; F181-I184 PolarHBondContact O-N 3.22Å; F181-L185 WeakPolarHBondContact O-CB 3.38Å; F181-L185 VanDerWaalsContact O-CG 3.32Å; F181-L185 WeakPolarHBondContact O-CG 3.4Å; F181-L185 PolarHBondContact O-N 3.19Å
182	H	98.8	Very high	98.5	Very high	27 Å²	27	48.3 Å²	48.3	13%	0.125	26%	0.26	C	S	.	.	H	α-helix	trans	-61.7	-34.2	174.4	-179.7	71.5	0	0	0	111.9	H83 T126 M129 G130 L133 F178 F179 P186	H83-H182 AromaticContact NE2-NE2 3.95Å; T126-H182 PolarHBondContact O-CE1 2.96Å; T126-H182 PolarHBondContact O-ND1 3.18Å; M129-H182 HydrophobicContact CB-CB 4.1Å; G130-H182 WeakPolarHBondContact CA-CE1 3.43Å; G130-H182 WeakPolarHBondContact CA-ND1 3.5Å; G130-H182 PolarHBondContact N-ND1 3.16Å; L133-H182 HydrophobicContact CD1-CB 4.3Å; F178-H182 WeakPolarHBondContact O-CB 3.13Å; F178-H182 PolarHBondContact O-N 2.88Å; F179-H182 PolarHBondContact O-N 2.84Å; H182-P186 WeakPolarHBondContact O-CD 3.23Å; H182-P186 WeakPolarHBondContact O-CG 3.36Å
183	F	98.8	Very high	98.6	Very high	82 Å²	82	48.5 Å²	48.5	36%	0.36	26%	0.264	S	S	.	.	H	α-helix	trans	-72.2	-43	177.5	-166.3	-83.7	0	0	0	112.5	L49 A52 F179 T180 F181 F187	L49-F183 HydrophobicContact CD1-CE2 4.29Å; L49-F183 HydrophobicContact CD1-CZ 4.05Å; A52-F183 HydrophobicContact CB-CD2 4.23Å; A52-F183 HydrophobicContact CB-CE2 3.91Å; F179-F183 HydrophobicContact CZ-CD2 4.29Å; F179-F183 WeakPolarHBondContact O-CB 3.48Å; F179-F183 PolarHBondContact O-N 3.06Å; T180-F183 PolarHBondContact O-N 3.26Å; F181-F183 PolarHBondContact O-N 3.36Å; F183-F187 HydrophobicContact CD1-CE2 4.09Å; F183-F187 AromaticContact CE1-CE2 3.87Å; F183-F187 HydrophobicContact CE1-CE2 3.87Å; F183-F187 HydrophobicContact CE1-CZ 4.47Å; F183-F187 VanDerWaalsContact O-CD2 3.26Å; F183-F187 WeakPolarHBondContact O-CD2 3.13Å; F183-F187 VanDerWaalsContact O-CE2 3.25Å; F183-F187 WeakPolarHBondContact O-CE2 3.12Å
184	I	98.8	Very high	98.6	Very high	80 Å²	80	48.5 Å²	48.5	41%	0.41	27%	0.268	S	S	.	.	H	α-helix	trans	-79.3	-35.3	-175.6	-168.9	60.8	0	0	0	113.6	T180 F181 F187 I188	T180-I184 WeakPolarHBondContact O-CG2 3.37Å; T180-I184 PolarHBondContact O-N 3.5Å; T180-I184 VanDerWaalsContact O-N 3.1Å; F181-I184 WeakPolarHBondContact O-CG2 3.44Å; F181-I184 PolarHBondContact O-N 3.22Å; I184-F187 PolarHBondContact O-N 3.38Å; I184-F187 VanDerWaalsContact O-N 3.12Å; I184-I188 HydrophobicContact CG1-CD1 4.22Å; I184-I188 PolarHBondContact O-N 3.1Å
185	L	98.7	Very high	98.6	Very high	30 Å²	30	51.6 Å²	51.6	16%	0.157	29%	0.285	C	S	.	.	H	α-helix	trans	-59.9	-39.4	-174.1	-81.9	172.9	0	0	0	114.9	A125 T126 M129 F181 F187 I188 I189	A125-L185 HydrophobicContact CB-CD1 4.22Å; T126-L185 HydrophobicContact CG2-CB 4.46Å; T126-L185 WeakPolarHBondContact OG1-CB 3.37Å; M129-L185 HydrophobicContact CE-CD1 3.22Å; F181-L185 WeakPolarHBondContact O-CB 3.38Å; F181-L185 VanDerWaalsContact O-CG 3.32Å; F181-L185 WeakPolarHBondContact O-CG 3.4Å; F181-L185 PolarHBondContact O-N 3.19Å; L185-F187 PolarHBondContact O-N 2.76Å; L185-I188 HydrophobicContact CD2-CD1 4.2Å; L185-I188 CarbonylContact O-C 3.51Å; L185-I188 WeakPolarHBondContact O-CA 3.25Å; L185-I188 WeakPolarHBondContact O-CB 3.46Å; L185-I188 PolarHBondContact O-N 2.75Å; L185-I189 WeakPolarHBondContact O-CG1 3.39Å; L185-I189 PolarHBondContact O-N 2.58Å
186	P	98.8	Very high	98.6	Very high	17 Å²	17	53 Å²	53	11%	0.11	29%	0.291	C	S	.	.	H	α-helix	trans	-54.3	-34.8	174.4	-28.9	34.9	0	0	0	113.8	I45 T126 H182 I189 A190	I45-P186 HydrophobicContact CD1-CB 4.23Å; I45-P186 HydrophobicContact CG1-CB 3.7Å; T126-P186 HydrophobicContact CG2-CG 3.87Å; H182-P186 WeakPolarHBondContact O-CD 3.23Å; H182-P186 WeakPolarHBondContact O-CG 3.36Å; P186-I189 PolarHBondContact O-N 3.16Å; P186-A190 PolarHBondContact O-N 3.23Å
187	F	98.7	Very high	98.6	Very high	95 Å²	95	53.4 Å²	53.4	42%	0.417	29%	0.291	S	S	.	.	H	α-helix	trans	-74.3	-35.7	176.2	-58.5	-76.4	0	0	0	112.1	I45 F183 I184 L185 I189 A190 A191	I45-F187 HydrophobicContact CG2-CE1 4.03Å; I45-F187 HydrophobicContact CG2-CZ 4.21Å; F183-F187 HydrophobicContact CD1-CE2 4.09Å; F183-F187 AromaticContact CE1-CE2 3.87Å; F183-F187 HydrophobicContact CE1-CE2 3.87Å; F183-F187 HydrophobicContact CE1-CZ 4.47Å; F183-F187 VanDerWaalsContact O-CD2 3.26Å; F183-F187 WeakPolarHBondContact O-CD2 3.13Å; F183-F187 VanDerWaalsContact O-CE2 3.25Å; F183-F187 WeakPolarHBondContact O-CE2 3.12Å; I184-F187 PolarHBondContact O-N 3.38Å; I184-F187 VanDerWaalsContact O-N 3.12Å; L185-F187 PolarHBondContact O-N 2.76Å; F187-I189 VanDerWaalsContact C-N 3.34Å; F187-A190 WeakPolarHBondContact O-CB 3.49Å; F187-A190 PolarHBondContact O-N 3.03Å; F187-A191 PolarHBondContact O-N 2.6Å; F187-A191 VanDerWaalsContact O-N 3.08Å
188	I	98.8	Very high	98.6	Very high	79 Å²	79	54.5 Å²	54.5	41%	0.405	30%	0.301	S	S	.	.	H	α-helix	trans	-64.3	-42.2	171.3	-63.4	171	0	0	0	110	I184 L185 A190 A191 L192	I184-I188 HydrophobicContact CG1-CD1 4.22Å; I184-I188 PolarHBondContact O-N 3.1Å; L185-I188 HydrophobicContact CD2-CD1 4.2Å; L185-I188 CarbonylContact O-C 3.51Å; L185-I188 WeakPolarHBondContact O-CA 3.25Å; L185-I188 WeakPolarHBondContact O-CB 3.46Å; L185-I188 PolarHBondContact O-N 2.75Å; I188-A190 VanDerWaalsContact C-N 3.31Å; I188-A190 PolarHBondContact O-N 2.97Å; I188-A191 PolarHBondContact O-N 2.78Å; I188-L192 HydrophobicContact CG2-CD1 4.05Å; I188-L192 HydrophobicContact CG2-CG 4.42Å; I188-L192 WeakPolarHBondContact O-CG 3.37Å; I188-L192 PolarHBondContact O-N 3.45Å
189	I	98.9	Very high	98.5	Very high	6 Å²	6	57.1 Å²	57.1	3%	0.031	31%	0.313	C	S	.	.	H	α-helix	trans	-59.9	-41.5	174.2	-68.6	167.5	0	0	0	110.4	L41 L119 A122 T126 L185 P186 F187 A191 L192 A193	L41-I189 HydrophobicContact CD1-CB 4.34Å; L41-I189 HydrophobicContact CD1-CG2 3.86Å; L41-I189 HydrophobicContact CD2-CG2 3.99Å; L119-I189 HydrophobicContact CD2-CG2 3.83Å; A122-I189 HydrophobicContact CB-CD1 4.17Å; A122-I189 HydrophobicContact CB-CG1 3.73Å; T126-I189 WeakPolarHBondContact OG1-CD1 3.3Å; L185-I189 WeakPolarHBondContact O-CG1 3.39Å; L185-I189 PolarHBondContact O-N 2.58Å; P186-I189 PolarHBondContact O-N 3.16Å; F187-I189 VanDerWaalsContact C-N 3.34Å; I189-A191 PolarHBondContact O-N 3.43Å; I189-L192 PolarHBondContact O-N 3.43Å; I189-A193 VanDerWaalsContact O-CB 3.3Å; I189-A193 WeakPolarHBondContact O-CB 3.42Å; I189-A193 PolarHBondContact O-N 2.92Å
190	A	98.8	Very high	98.5	Very high	37 Å²	37	56.8 Å²	56.8	31%	0.306	31%	0.313	S	S	.	.	H	α-helix	trans	-61.4	-42.3	175.7	0	0	0	0	0	112.4	L41 P186 F187 I188 A193 A194	L41-A190 HydrophobicContact CD2-CB 3.94Å; P186-A190 PolarHBondContact O-N 3.23Å; F187-A190 WeakPolarHBondContact O-CB 3.49Å; F187-A190 PolarHBondContact O-N 3.03Å; I188-A190 VanDerWaalsContact C-N 3.31Å; I188-A190 PolarHBondContact O-N 2.97Å; A190-A193 PolarHBondContact O-N 2.87Å; A190-A194 PolarHBondContact O-N 3.22Å
191	A	98.7	Very high	98.4	Very high	65 Å²	65	56 Å²	56	54%	0.537	30%	0.303	S	S	.	.	H	α-helix	trans	-65.1	-43.5	175.1	0	0	0	0	0	112.1	F187 I188 I189 A193 A194 L195	F187-A191 PolarHBondContact O-N 2.6Å; F187-A191 VanDerWaalsContact O-N 3.08Å; I188-A191 PolarHBondContact O-N 2.78Å; I189-A191 PolarHBondContact O-N 3.43Å; A191-A193 VanDerWaalsContact C-N 3.32Å; A191-A193 PolarHBondContact O-N 3.39Å; A191-A194 PolarHBondContact O-N 3.43Å; A191-L195 PolarHBondContact O-N 2.73Å
192	L	98.7	Very high	98.2	Very high	34 Å²	34	58.1 Å²	58.1	18%	0.178	32%	0.315	C	S	.	.	H	α-helix	trans	-64	-35.3	175	-71.8	170.5	0	0	0	112.2	I118 L119 I188 I189 L195 H196	I118-L192 HydrophobicContact CG2-CD1 3.86Å; I118-L192 HydrophobicContact CG2-CD2 4.32Å; L119-L192 HydrophobicContact CD2-CB 3.56Å; L119-L192 HydrophobicContact CG-CB 4.08Å; I188-L192 HydrophobicContact CG2-CD1 4.05Å; I188-L192 HydrophobicContact CG2-CG 4.42Å; I188-L192 WeakPolarHBondContact O-CG 3.37Å; I188-L192 PolarHBondContact O-N 3.45Å; I189-L192 PolarHBondContact O-N 3.43Å; L192-L195 PolarHBondContact O-N 3.49Å; L192-H196 WeakPolarHBondContact O-CB 3.47Å; L192-H196 PolarHBondContact O-N 3.21Å
193	A	98.7	Very high	98	Very high	29 Å²	29	60.2 Å²	60.2	24%	0.24	33%	0.33	C	S	.	.	H	α-helix	trans	-67.6	-38.1	176.1	0	0	0	0	0	111.6	L119 I189 A190 A191 L195 H196 L197	L119-A193 HydrophobicContact CD2-CB 4.39Å; I189-A193 VanDerWaalsContact O-CB 3.3Å; I189-A193 WeakPolarHBondContact O-CB 3.42Å; I189-A193 PolarHBondContact O-N 2.92Å; A190-A193 PolarHBondContact O-N 2.87Å; A191-A193 VanDerWaalsContact C-N 3.32Å; A191-A193 PolarHBondContact O-N 3.39Å; A193-L195 VanDerWaalsContact C-N 3.35Å; A193-H196 WeakPolarHBondContact O-CB 3.4Å; A193-H196 PolarHBondContact O-N 2.86Å; A193-L197 WeakPolarHBondContact O-CG 3.49Å; A193-L197 PolarHBondContact O-N 3.16Å
194	A	98.2	Very high	97.8	Very high	61 Å²	61	56.9 Å²	56.9	50%	0.504	32%	0.318	S	S	.	.	H	α-helix	trans	-62.6	-42.2	171.5	0	0	0	0	0	111.6	A190 A191 L197 L198	A190-A194 PolarHBondContact O-N 3.22Å; A191-A194 PolarHBondContact O-N 3.43Å; A194-L197 PolarHBondContact O-N 3.37Å; A194-L198 WeakPolarHBondContact O-CB 3.3Å; A194-L198 PolarHBondContact O-N 2.92Å
195	L	98.3	Very high	97.7	Very high	65 Å²	65	54.4 Å²	54.4	34%	0.34	31%	0.308	S	S	.	.	H	α-helix	trans	-64.5	-39.8	174.4	-177.3	61.5	0	0	0	112.3	I115 A191 L192 A193 L197 L198 F199	I115-L195 HydrophobicContact CD1-CD2 3.79Å; I115-L195 HydrophobicContact CD1-CG 4.39Å; I115-L195 HydrophobicContact CG1-CD2 4.37Å; I115-L195 HydrophobicContact CG1-CG 4.45Å; A191-L195 PolarHBondContact O-N 2.73Å; L192-L195 PolarHBondContact O-N 3.49Å; A193-L195 VanDerWaalsContact C-N 3.35Å; L195-L197 PolarHBondContact O-N 3.26Å; L195-L198 WeakPolarHBondContact O-CB 3.41Å; L195-L198 PolarHBondContact O-N 3.35Å; L195-F199 HydrophobicContact CD1-CD2 4.07Å; L195-F199 HydrophobicContact CD1-CE2 3.57Å; L195-F199 HydrophobicContact CD1-CZ 4.22Å; L195-F199 HydrophobicContact CD2-CE2 4.28Å; L195-F199 HydrophobicContact CG-CD2 4.07Å; L195-F199 HydrophobicContact CG-CE2 3.75Å; L195-F199 WeakPolarHBondContact O-CD2 3.38Å; L195-F199 PolarHBondContact O-N 2.72Å; L195-F199 VanDerWaalsContact O-N 3.11Å
196	H	98.6	Very high	97.6	Very high	29 Å²	29	53.3 Å²	53.3	13%	0.134	30%	0.302	C	S	.	.	H	α-helix	trans	-59.4	-45.7	175.5	-174.7	82.7	0	0	0	111.6	T112 I115 L119 L192 A193 L200	T112-H196 WeakPolarHBondContact CG2-CE1 3.21Å; T112-H196 PolarHBondContact O-CE1 2.89Å; T112-H196 PolarHBondContact O-ND1 3.46Å; I115-H196 HydrophobicContact CB-CB 4.46Å; I115-H196 HydrophobicContact CG2-CB 3.68Å; L119-H196 HydrophobicContact CD1-CB 3.81Å; L192-H196 WeakPolarHBondContact O-CB 3.47Å; L192-H196 PolarHBondContact O-N 3.21Å; A193-H196 WeakPolarHBondContact O-CB 3.4Å; A193-H196 PolarHBondContact O-N 2.86Å; H196-L200 WeakPolarHBondContact O-CB 3.49Å; H196-L200 PolarHBondContact O-N 2.92Å
197	L	98	Very high	97.6	Very high	73 Å²	73	52.7 Å²	52.7	38%	0.382	30%	0.298	S	S	.	.	H	α-helix	trans	-67.6	-35.4	176.3	-70.5	175.1	0	0	0	112.4	A193 A194 L195 L200 H201	A193-L197 WeakPolarHBondContact O-CG 3.49Å; A193-L197 PolarHBondContact O-N 3.16Å; A194-L197 PolarHBondContact O-N 3.37Å; L195-L197 PolarHBondContact O-N 3.26Å; L197-L200 HydrophobicContact CD2-CD2 4.11Å; L197-L200 WeakPolarHBondContact O-CB 3.46Å; L197-L200 PolarHBondContact O-N 3.5Å; L197-H201 WeakPolarHBondContact O-CB 3.41Å; L197-H201 PolarHBondContact O-CD2 2.93Å; L197-H201 PolarHBondContact O-N 3.43Å
198	L	97.2	Very high	97.6	Very high	93 Å²	93	48.8 Å²	48.8	49%	0.487	28%	0.282	S	S	.	.	H	α-helix	trans	-58.6	-52.6	174.8	-176.6	149.7	0	0	0	110.8	A194 L195 L200 H201 E202	A194-L198 WeakPolarHBondContact O-CB 3.3Å; A194-L198 PolarHBondContact O-N 2.92Å; L195-L198 WeakPolarHBondContact O-CB 3.41Å; L195-L198 PolarHBondContact O-N 3.35Å; L198-L200 VanDerWaalsContact C-N 3.29Å; L198-L200 PolarHBondContact O-N 3.24Å; L198-H201 PolarHBondContact O-N 3.29Å; L198-H201 VanDerWaalsContact O-N 3.1Å; L198-E202 PolarHBondContact O-N 2.68Å
199	F	98.1	Very high	97.6	Very high	65 Å²	65	47.7 Å²	47.7	29%	0.285	28%	0.277	S	S	.	.	H	α-helix	trans	-63.5	-34.5	176.5	-73.3	-59.9	0	0	0	113	E111 T112 I115 L195 H201 E202	E111-F199 HydrophobicContact CB-CB 4.07Å; E111-F199 HydrophobicContact CB-CD1 3.65Å; E111-F199 HydrophobicContact CB-CD2 4.04Å; E111-F199 HydrophobicContact CB-CE1 4.02Å; E111-F199 HydrophobicContact CB-CE2 4.37Å; E111-F199 HydrophobicContact CB-CG 3.67Å; E111-F199 HydrophobicContact CB-CZ 4.36Å; E111-F199 HydrophobicContact CG-CD1 4.1Å; E111-F199 HydrophobicContact CG-CE1 4.11Å; T112-F199 WeakPolarHBondContact OG1-CB 3.43Å; I115-F199 HydrophobicContact CG1-CD2 4.01Å; I115-F199 HydrophobicContact CG1-CE2 4.08Å; L195-F199 HydrophobicContact CD1-CD2 4.07Å; L195-F199 HydrophobicContact CD1-CE2 3.57Å; L195-F199 HydrophobicContact CD1-CZ 4.22Å; L195-F199 HydrophobicContact CD2-CE2 4.28Å; L195-F199 HydrophobicContact CG-CD2 4.07Å; L195-F199 HydrophobicContact CG-CE2 3.75Å; L195-F199 WeakPolarHBondContact O-CD2 3.38Å; L195-F199 PolarHBondContact O-N 2.72Å; L195-F199 VanDerWaalsContact O-N 3.11Å; F199-H201 VanDerWaalsContact C-N 3.31Å; F199-H201 PolarHBondContact O-N 2.8Å; F199-E202 PolarHBondContact O-N 3.34Å
200	L	97.4	Very high	97.5	Very high	36 Å²	36	48 Å²	48	19%	0.188	28%	0.282	C	S	.	.	H	α-helix	trans	-63.1	-38.3	173.6	178.6	65	0	0	0	111.7	T112 H196 L197 L198 E202 T203 G204	T112-L200 HydrophobicContact CG2-CB 4.18Å; T112-L200 HydrophobicContact CG2-CD1 4.47Å; T112-L200 PolarHBondContact OG1-N 3.12Å; H196-L200 WeakPolarHBondContact O-CB 3.49Å; H196-L200 PolarHBondContact O-N 2.92Å; L197-L200 HydrophobicContact CD2-CD2 4.11Å; L197-L200 WeakPolarHBondContact O-CB 3.46Å; L197-L200 PolarHBondContact O-N 3.5Å; L198-L200 VanDerWaalsContact C-N 3.29Å; L198-L200 PolarHBondContact O-N 3.24Å; L200-E202 VanDerWaalsContact C-N 3.33Å; L200-E202 PolarHBondContact O-N 2.93Å; L200-T203 PolarHBondContact O-N 3.46Å; L200-T203 PolarHBondContact O-OG1 3.32Å; L200-G204 VanDerWaalsContact O-CA 3.31Å; L200-G204 WeakPolarHBondContact O-CA 3.46Å; L200-G204 PolarHBondContact O-N 3.29Å
201	H	96.1	Very high	97.4	Very high	64 Å²	64	51.2 Å²	51.2	30%	0.296	29%	0.293	S	S	.	.	H	α-helix	trans	-74	-22.6	-178	-70.4	177.1	0	0	0	113.4	L197 L198 F199 T203	L197-H201 WeakPolarHBondContact O-CB 3.41Å; L197-H201 PolarHBondContact O-CD2 2.93Å; L197-H201 PolarHBondContact O-N 3.43Å; L198-H201 PolarHBondContact O-N 3.29Å; L198-H201 VanDerWaalsContact O-N 3.1Å; F199-H201 VanDerWaalsContact C-N 3.31Å; F199-H201 PolarHBondContact O-N 2.8Å; H201-T203 VanDerWaalsContact C-N 3.32Å; H201-T203 PolarHBondContact O-N 2.8Å
202	E	95.4	Very high	97.2	Very high	153 Å²	153	52.8 Å²	52.8	72%	0.715	30%	0.296	S	S	*	.	H	α-helix	trans	-62.1	-39.1	172.1	-67.7	-60.9	135	0	0	112.1	L198 F199 L200	L198-E202 PolarHBondContact O-N 2.68Å; F199-E202 PolarHBondContact O-N 3.34Å; L200-E202 VanDerWaalsContact C-N 3.33Å; L200-E202 PolarHBondContact O-N 2.93Å
203	T	93.7	Very high	97.1	Very high	72 Å²	72	52 Å²	52	44%	0.442	29%	0.293	S	S	.	.	H	α-helix	trans	-99.6	-28.4	-178.2	54.3	0	0	0	0	113.1	Y109 L200 H201	Y109-T203 HydrophobicContact CD1-CG2 4.14Å; Y109-T203 HydrophobicContact CE1-CG2 4.41Å; L200-T203 PolarHBondContact O-N 3.46Å; L200-T203 PolarHBondContact O-OG1 3.32Å; H201-T203 VanDerWaalsContact C-N 3.32Å; H201-T203 PolarHBondContact O-N 2.8Å
204	G	94.8	Very high	96.9	Very high	11 Å²	11	57.5 Å²	57.5	11%	0.113	31%	0.314	C	S	.	.			trans	80	169.2	-166.9	0	0	0	0	0	112.6	L200	L200-G204 VanDerWaalsContact O-CA 3.31Å; L200-G204 WeakPolarHBondContact O-CA 3.46Å; L200-G204 PolarHBondContact O-N 3.29Å
205	S	96.7	Very high	96.8	Very high	29 Å²	29	60.4 Å²	60.4	20%	0.203	33%	0.33	C	S	.	.			trans	-66.2	138.9	178.3	-73.6	0	0	0	0	112.4	P24	P24-S205 WeakPolarHBondContact CG-O 2.99Å
206	N	97.8	Very high	96.8	Very high	6 Å²	6	61.2 Å²	61.2	3%	0.032	34%	0.335	C	S	.	.			trans	-64.3	173.6	159.8	-173.3	21.3	0	0	0	110.2	I27 W31 Y104 S106 Y109 Q313	I27-N206 VanDerWaalsContact CG2-O 3.28Å; I27-N206 WeakPolarHBondContact CG2-O 3.38Å; W31-N206 VanDerWaalsContact CE2-O 3.28Å; W31-N206 HydrophobicContact CZ2-CB 4.27Å; W31-N206 VanDerWaalsContact CZ2-O 3.28Å; W31-N206 WeakPolarHBondContact CZ2-O 3.17Å; W31-N206 PolarHBondContact NE1-O 2.94Å; Y104-N206 PolarHBondContact O-ND2 3.44Å; S106-N206 PolarHBondContact OG-ND2 3.4Å; Y109-N206 HydrophobicContact CE2-CB 3.65Å; N206-Q313 PolarHBondContact ND2-NE2 2.86Å
207	N	98.6	Very high	96.7	Very high	4 Å²	4	63 Å²	63	2%	0.021	34%	0.342	C	S	.	.			trans	-140.4	166.7	175.7	69.8	85.1	0	0	0	112.8	P24 N26 I27 L209 G210 I211	P24-N207 HydrophobicContact CB-CB 3.88Å; P24-N207 HydrophobicContact CG-CB 4.19Å; N26-N207 PolarHBondContact ND2-OD1 3.07Å; N26-N207 WeakPolarHBondContact OD1-CB 2.86Å; I27-N207 HydrophobicContact CG2-CB 4.12Å; N207-L209 PolarHBondContact O-N 3.06Å; N207-L209 VanDerWaalsContact O-N 3.13Å; N207-L209 WeakPolarHBondContact OD1-CB 3.42Å; N207-L209 PolarHBondContact OD1-N 3.46Å; N207-L209 VanDerWaalsContact OD1-N 3.12Å; N207-G210 PolarHBondContact O-N 3.36Å; N207-I211 PolarHBondContact ND2-O 3.31Å
208	P	98.5	Very high	96.7	Very high	13 Å²	13	61.4 Å²	61.4	8%	0.084	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-32.1	-173.7	-30.2	37.5	0	0	0	115.6	N26 W31 Y104 G210 S314 M316	N26-P208 VanDerWaalsContact O-CD 3.27Å; N26-P208 WeakPolarHBondContact O-CD 2.93Å; N26-P208 WeakPolarHBondContact O-CG 3.26Å; W31-P208 HydrophobicContact CH2-CG 4.09Å; W31-P208 HydrophobicContact CZ3-CG 3.84Å; Y104-P208 VanDerWaalsContact CD1-CA 3.5Å; Y104-P208 HydrophobicContact CD1-CB 4.21Å; Y104-P208 WeakPolarHBondContact CD1-O 3.33Å; Y104-P208 VanDerWaalsContact CE1-CA 3.48Å; Y104-P208 HydrophobicContact CE1-CB 3.65Å; Y104-P208 HydrophobicContact CE1-CG 4.39Å; P208-G210 VanDerWaalsContact C-N 3.3Å; P208-G210 PolarHBondContact O-N 3.29Å; P208-S314 WeakPolarHBondContact O-CB 3.38Å; P208-S314 PolarHBondContact O-OG 3.23Å; P208-M316 HydrophobicContact CB-SD 4.28Å
209	L	98.1	Very high	96.7	Very high	57 Å²	57	60 Å²	60	30%	0.298	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-19.4	-178.4	-60.1	171.1	0	0	0	112.4	N26 N207 I211 M316 F317	N26-L209 WeakPolarHBondContact ND2-CD1 3.43Å; N207-L209 PolarHBondContact O-N 3.06Å; N207-L209 VanDerWaalsContact O-N 3.13Å; N207-L209 WeakPolarHBondContact OD1-CB 3.42Å; N207-L209 PolarHBondContact OD1-N 3.46Å; N207-L209 VanDerWaalsContact OD1-N 3.12Å; L209-I211 HydrophobicContact CB-CD1 4.22Å; L209-I211 HydrophobicContact CB-CG1 3.84Å; L209-I211 HydrophobicContact CD1-CD1 4.12Å; L209-I211 HydrophobicContact CD1-CG1 4.42Å; L209-I211 PolarHBondContact O-N 2.79Å; L209-M316 HydrophobicContact CD2-CE 3.84Å; L209-M316 HydrophobicContact CD2-SD 3.69Å; L209-F317 HydrophobicContact CD2-CE2 4.03Å; L209-F317 HydrophobicContact CD2-CZ 3.65Å
210	G	97.1	Very high	96.7	Very high	13 Å²	13	58.4 Å²	58.4	13%	0.134	32%	0.322	C	S	.	.			trans	63.8	27.6	-177	0	0	0	0	0	113.8	N207 P208	N207-G210 PolarHBondContact O-N 3.36Å; P208-G210 VanDerWaalsContact C-N 3.3Å; P208-G210 PolarHBondContact O-N 3.29Å
211	I	96.3	Very high	96.7	Very high	103 Å²	103	61.3 Å²	61.3	53%	0.528	33%	0.334	S	S	.	.	S	Bend	trans	-118.4	162.7	174.3	64.1	177.7	0	0	0	109.9	N207 L209 S213	N207-I211 PolarHBondContact ND2-O 3.31Å; L209-I211 HydrophobicContact CB-CD1 4.22Å; L209-I211 HydrophobicContact CB-CG1 3.84Å; L209-I211 HydrophobicContact CD1-CD1 4.12Å; L209-I211 HydrophobicContact CD1-CG1 4.42Å; L209-I211 PolarHBondContact O-N 2.79Å; I211-S213 PolarHBondContact O-N 2.89Å
212	T	96.1	Very high	96.8	Very high	98 Å²	98	61.4 Å²	61.4	60%	0.601	34%	0.34	S	S	*	.			trans	-56.1	132.7	175	174.4	0	0	0	0	111.8	H214	T212-H214 PolarHBondContact OG1-CD2 2.95Å; T212-H214 PolarHBondContact OG1-N 3.39Å
213	S	95.9	Very high	97	Very high	17 Å²	17	60.3 Å²	60.3	12%	0.119	33%	0.331	C	S	.	.			trans	-105.7	13.5	177.3	80	0	0	0	0	112.7	P24 I211 S215 D216 K217	P24-S213 WeakPolarHBondContact CB-OG 3.36Å; P24-S213 WeakPolarHBondContact CG-OG 3.48Å; I211-S213 PolarHBondContact O-N 2.89Å; S213-S215 PolarHBondContact O-N 3.39Å; S213-D216 CarbonylContact O-C 3.55Å; S213-D216 VanDerWaalsContact O-C 3.26Å; S213-D216 PolarHBondContact O-N 2.99Å; S213-K217 VanDerWaalsContact O-CG 3.28Å; S213-K217 WeakPolarHBondContact O-CG 3.35Å
214	H	94.6	Very high	97.2	Very high	146 Å²	146	57.3 Å²	57.3	68%	0.676	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-29.9	-176	-74.3	-63.3	0	0	0	113.3	T212 D216	T212-H214 PolarHBondContact OG1-CD2 2.95Å; T212-H214 PolarHBondContact OG1-N 3.39Å; H214-D216 VanDerWaalsContact C-N 3.27Å; H214-D216 PolarHBondContact O-N 3.11Å
215	S	95.9	Very high	97.3	Very high	121 Å²	121	59 Å²	59	85%	0.846	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-20.2	177.1	55.2	0	0	0	0	113.8	S213	S213-S215 PolarHBondContact O-N 3.39Å
216	D	97.2	Very high	97.4	Very high	82 Å²	82	63.3 Å²	63.3	44%	0.439	34%	0.339	S	S	.	.	S	Bend	trans	-145.8	83.2	-176.9	-172.8	17.4	0	0	0	111.3	S25 S213 H214	S25-D216 VanDerWaalsContact CB-OD2 3.28Å; S25-D216 WeakPolarHBondContact CB-OD2 3.38Å; S25-D216 PolarHBondContact N-O 3.21Å; S25-D216 PolarHBondContact OG-OD2 3.44Å; S213-D216 CarbonylContact O-C 3.55Å; S213-D216 VanDerWaalsContact O-C 3.26Å; S213-D216 PolarHBondContact O-N 2.99Å; H214-D216 VanDerWaalsContact C-N 3.27Å; H214-D216 PolarHBondContact O-N 3.11Å
217	K	97.6	Very high	97.5	Very high	68 Å²	68	65.3 Å²	65.3	30%	0.296	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	139.6	170	-64	-165.5	176.9	-171.8	0	109.8	P22 T23 S213	P22-K217 HydrophobicContact CB-CB 4.15Å; P22-K217 HydrophobicContact CB-CD 3.66Å; T23-K217 WeakPolarHBondContact O-CA 3.34Å; S213-K217 VanDerWaalsContact O-CG 3.28Å; S213-K217 WeakPolarHBondContact O-CG 3.35Å
218	I	98.1	Very high	97.5	Very high	39 Å²	39	66.6 Å²	66.6	20%	0.2	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	158.1	171.1	62.2	-177.6	0	0	0	109.5	T23 Y223 Y224	T23-I218 PolarHBondContact N-O 3.49Å; T23-I218 PolarHBondContact O-N 3.44Å; I218-Y223 HydrophobicContact CB-CD2 4.02Å; I218-Y223 HydrophobicContact CB-CE2 4.18Å; I218-Y223 HydrophobicContact CD1-CD1 4.28Å; I218-Y223 HydrophobicContact CD1-CD2 3.8Å; I218-Y223 HydrophobicContact CD1-CE2 4.48Å; I218-Y223 HydrophobicContact CD1-CG 3.68Å; I218-Y223 HydrophobicContact CG1-CD2 4.16Å; I218-Y223 HydrophobicContact CG1-CG 4.48Å; I218-Y224 HydrophobicContact CD1-CE2 3.71Å; I218-Y224 HydrophobicContact CG1-CD2 4.5Å; I218-Y224 HydrophobicContact CG1-CE2 3.75Å
219	T	97.3	Very high	97.5	Very high	62 Å²	62	68.4 Å²	68.4	38%	0.38	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	144.8	171.9	50.6	0	0	0	0	110.3	H221 Y223	T219-H221 VanDerWaalsContact C-N 3.34Å; T219-H221 WeakPolarHBondContact CB-O 3.46Å; T219-H221 PolarHBondContact O-N 2.99Å; T219-H221 PolarHBondContact OG1-O 2.68Å; T219-Y223 WeakPolarHBondContact O-CD2 3.48Å
220	F	98.2	Very high	97.5	Very high	32 Å²	32	70.5 Å²	70.5	14%	0.14	38%	0.381	C	S	.	.	S	Bend	trans	-60	-44.4	179.2	-170.8	-82.9	0	0	0	112.2	F18 I19 L21 P222 Y223 Y224 T225	F18-F220 WeakPolarHBondContact O-CD1 3.31Å; I19-F220 PolarHBondContact O-N 3.07Å; L21-F220 HydrophobicContact CB-CB 3.93Å; L21-F220 HydrophobicContact CD2-CD2 4.22Å; L21-F220 PolarHBondContact O-N 2.98Å; F220-P222 CarbonylContact O-C 3.36Å; F220-Y223 PolarHBondContact O-N 2.97Å; F220-Y224 VanDerWaalsContact CD2-CB 3.47Å; F220-Y224 HydrophobicContact CD2-CD2 4.17Å; F220-Y224 HydrophobicContact CD2-CG 4.13Å; F220-Y224 HydrophobicContact CE2-CG 4.21Å; F220-Y224 WeakPolarHBondContact O-CA 3.29Å; F220-Y224 PolarHBondContact O-N 3.4Å; F220-T225 HydrophobicContact CD1-CG2 3.69Å; F220-T225 HydrophobicContact CE1-CG2 3.69Å; F220-T225 PolarHBondContact O-N 3.33Å
221	H	97.9	Very high	97.6	Very high	97 Å²	97	70.5 Å²	70.5	45%	0.449	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	134.3	169.5	-174.9	72	0	0	0	110.6	I19 T219 T225	I19-H221 HydrophobicContact CG2-CB 4.11Å; I19-H221 PolarHBondContact O-N 3.41Å; T219-H221 VanDerWaalsContact C-N 3.34Å; T219-H221 WeakPolarHBondContact CB-O 3.46Å; T219-H221 PolarHBondContact O-N 2.99Å; T219-H221 PolarHBondContact OG1-O 2.68Å; H221-T225 HydrophobicContact CB-CG2 3.97Å; H221-T225 PolarHBondContact ND1-OG1 3.02Å
222	P	97.9	Very high	97.7	Very high	66 Å²	66	68.8 Å²	68.8	43%	0.429	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	cis	-88.4	-15.7	1.6	35.1	-35.4	0	0	0	114.8	F220 Y224 T225 I226	F220-P222 CarbonylContact O-C 3.36Å; P222-Y224 PolarHBondContact O-N 2.92Å; P222-T225 VanDerWaalsContact C-OG1 3.27Å; P222-T225 WeakPolarHBondContact CA-OG1 3.5Å; P222-T225 PolarHBondContact O-N 3.35Å; P222-T225 PolarHBondContact O-OG1 2.95Å; P222-I226 WeakPolarHBondContact O-CG2 3.43Å; P222-I226 PolarHBondContact O-N 2.87Å
223	Y	98.4	Very high	97.8	Very high	131 Å²	131	69.4 Å²	69.4	51%	0.514	37%	0.372	S	S	.	.	H	α-helix	trans	-57.7	-52.9	-164	-61.7	-76.8	0	0	0	114.3	I218 T219 F220 I226 K227	I218-Y223 HydrophobicContact CB-CD2 4.02Å; I218-Y223 HydrophobicContact CB-CE2 4.18Å; I218-Y223 HydrophobicContact CD1-CD1 4.28Å; I218-Y223 HydrophobicContact CD1-CD2 3.8Å; I218-Y223 HydrophobicContact CD1-CE2 4.48Å; I218-Y223 HydrophobicContact CD1-CG 3.68Å; I218-Y223 HydrophobicContact CG1-CD2 4.16Å; I218-Y223 HydrophobicContact CG1-CG 4.48Å; T219-Y223 WeakPolarHBondContact O-CD2 3.48Å; F220-Y223 PolarHBondContact O-N 2.97Å; Y223-I226 VanDerWaalsContact O-CG2 3.29Å; Y223-I226 WeakPolarHBondContact O-CG2 3.38Å; Y223-K227 WeakPolarHBondContact O-CB 3.42Å; Y223-K227 PolarHBondContact O-N 2.96Å
224	Y	98.2	Very high	97.9	Very high	9 Å²	9	73.5 Å²	73.5	4%	0.035	39%	0.392	C	S	.	.	H	α-helix	trans	-83.8	-25.8	-179.8	-66.9	-60.2	0	0	0	112.3	T23 P24 S25 I27 I218 F220 P222 I226 K227 D228	T23-Y224 HydrophobicContact CG2-CD2 3.49Å; T23-Y224 VanDerWaalsContact CG2-CD2 3.49Å; T23-Y224 HydrophobicContact CG2-CE2 3.29Å; T23-Y224 HydrophobicContact CG2-CG 4.34Å; P24-Y224 PolarHBondContact O-OH 3.32Å; S25-Y224 VanDerWaalsContact C-OH 3.29Å; S25-Y224 PolarHBondContact O-OH 3.15Å; I27-Y224 HydrophobicContact CD1-CD1 3.76Å; I27-Y224 HydrophobicContact CD1-CD2 4.46Å; I27-Y224 HydrophobicContact CD1-CE1 3.46Å; I27-Y224 VanDerWaalsContact CD1-CE1 3.46Å; I27-Y224 HydrophobicContact CD1-CE2 4.14Å; I27-Y224 HydrophobicContact CD1-CG 4.29Å; I27-Y224 HydrophobicContact CG1-CD1 4.08Å; I27-Y224 HydrophobicContact CG1-CE1 3.25Å; I27-Y224 HydrophobicContact CG1-CE2 4.12Å; I27-Y224 WeakPolarHBondContact CG1-OH 3.44Å; I218-Y224 HydrophobicContact CD1-CE2 3.71Å; I218-Y224 HydrophobicContact CG1-CD2 4.5Å; I218-Y224 HydrophobicContact CG1-CE2 3.75Å; F220-Y224 VanDerWaalsContact CD2-CB 3.47Å; F220-Y224 HydrophobicContact CD2-CD2 4.17Å; F220-Y224 HydrophobicContact CD2-CG 4.13Å; F220-Y224 HydrophobicContact CE2-CG 4.21Å; F220-Y224 WeakPolarHBondContact O-CA 3.29Å; F220-Y224 PolarHBondContact O-N 3.4Å; P222-Y224 PolarHBondContact O-N 2.92Å; Y224-I226 PolarHBondContact O-N 3.35Å; Y224-K227 HydrophobicContact CD1-CD 3.87Å; Y224-K227 HydrophobicContact CE1-CD 3.97Å; Y224-K227 PolarHBondContact O-N 2.89Å; Y224-D228 WeakPolarHBondContact O-CB 3.44Å; Y224-D228 VanDerWaalsContact O-CG 3.3Å; Y224-D228 PolarHBondContact O-N 2.86Å
225	T	98.2	Very high	98.1	Very high	47 Å²	47	67.2 Å²	67.2	29%	0.288	36%	0.363	S	S	.	.	H	α-helix	trans	-61.3	-44	170.3	54.3	0	0	0	0	112.6	F220 H221 P222 A229	F220-T225 HydrophobicContact CD1-CG2 3.69Å; F220-T225 HydrophobicContact CE1-CG2 3.69Å; F220-T225 PolarHBondContact O-N 3.33Å; H221-T225 HydrophobicContact CB-CG2 3.97Å; H221-T225 PolarHBondContact ND1-OG1 3.02Å; P222-T225 VanDerWaalsContact C-OG1 3.27Å; P222-T225 WeakPolarHBondContact CA-OG1 3.5Å; P222-T225 PolarHBondContact O-N 3.35Å; P222-T225 PolarHBondContact O-OG1 2.95Å; T225-A229 WeakPolarHBondContact O-CB 3.36Å; T225-A229 PolarHBondContact O-N 3.15Å
226	I	98.4	Very high	98.3	Very high	118 Å²	118	65.1 Å²	65.1	61%	0.605	34%	0.341	S	S	*	.	H	α-helix	trans	-73.7	-37.6	179.2	-168.6	61.4	0	0	0	111.6	P222 Y223 Y224 A229 L230	P222-I226 WeakPolarHBondContact O-CG2 3.43Å; P222-I226 PolarHBondContact O-N 2.87Å; Y223-I226 VanDerWaalsContact O-CG2 3.29Å; Y223-I226 WeakPolarHBondContact O-CG2 3.38Å; Y224-I226 PolarHBondContact O-N 3.35Å; I226-A229 PolarHBondContact O-N 3Å; I226-L230 PolarHBondContact O-N 3.12Å
227	K	98.6	Very high	98.3	Very high	49 Å²	49	66.3 Å²	66.3	21%	0.213	35%	0.347	C	S	.	.	H	α-helix	trans	-64.2	-40.9	176	-174.1	-174.9	166	-148	0	111.7	I27 S28 N32 Y223 Y224 L230 G231	I27-K227 PolarHBondContact O-NZ 3.25Å; S28-K227 VanDerWaalsContact C-NZ 3.27Å; S28-K227 PolarHBondContact O-NZ 2.69Å; N32-K227 PolarHBondContact ND2-O 3.16Å; N32-K227 WeakPolarHBondContact OD1-CE 3.33Å; N32-K227 PolarHBondContact OD1-NZ 2.61Å; Y223-K227 WeakPolarHBondContact O-CB 3.42Å; Y223-K227 PolarHBondContact O-N 2.96Å; Y224-K227 HydrophobicContact CD1-CD 3.87Å; Y224-K227 HydrophobicContact CE1-CD 3.97Å; Y224-K227 PolarHBondContact O-N 2.89Å; K227-L230 PolarHBondContact O-N 3.28Å; K227-G231 PolarHBondContact O-N 3.35Å
228	D	98.5	Very high	98.4	Very high	30 Å²	30	65.5 Å²	65.5	16%	0.16	35%	0.35	C	S	.	.	H	α-helix	trans	-71.1	-36.7	177.2	-77.8	11.5	0	0	0	111.5	N32 S35 Y224 L230 G231 L232	N32-D228 PolarHBondContact ND2-OD1 3.38Å; S35-D228 WeakPolarHBondContact CB-OD2 3.19Å; S35-D228 PolarHBondContact OG-OD2 2.94Å; Y224-D228 WeakPolarHBondContact O-CB 3.44Å; Y224-D228 VanDerWaalsContact O-CG 3.3Å; Y224-D228 PolarHBondContact O-N 2.86Å; D228-L230 VanDerWaalsContact C-N 3.32Å; D228-L230 PolarHBondContact O-N 3.1Å; D228-G231 PolarHBondContact O-N 3.06Å; D228-L232 WeakPolarHBondContact O-CB 3.49Å; D228-L232 PolarHBondContact O-N 3.4Å
229	A	98.6	Very high	98.4	Very high	52 Å²	52	64 Å²	64	43%	0.43	34%	0.342	S	S	.	.	H	α-helix	trans	-60.4	-40.4	171.9	0	0	0	0	0	112.2	T225 I226 L232 L233	T225-A229 WeakPolarHBondContact O-CB 3.36Å; T225-A229 PolarHBondContact O-N 3.15Å; I226-A229 PolarHBondContact O-N 3Å; A229-L232 PolarHBondContact O-N 2.82Å; A229-L233 PolarHBondContact O-N 3.23Å
230	L	98.6	Very high	98.5	Very high	101 Å²	101	63.7 Å²	63.7	53%	0.529	34%	0.337	S	S	.	.	H	α-helix	trans	-63.3	-45.5	172.7	176.4	62.5	0	0	0	111.6	I226 K227 D228 L232 L233 L234	I226-L230 PolarHBondContact O-N 3.12Å; K227-L230 PolarHBondContact O-N 3.28Å; D228-L230 VanDerWaalsContact C-N 3.32Å; D228-L230 PolarHBondContact O-N 3.1Å; L230-L232 VanDerWaalsContact C-N 3.3Å; L230-L232 PolarHBondContact O-N 2.98Å; L230-L233 WeakPolarHBondContact O-CB 3.29Å; L230-L233 PolarHBondContact O-N 3.45Å; L230-L234 WeakPolarHBondContact O-CG 3.38Å; L230-L234 PolarHBondContact O-N 3.49Å; L230-L234 VanDerWaalsContact O-N 3.08Å
231	G	98.6	Very high	98.5	Very high	13 Å²	13	65.4 Å²	65.4	13%	0.134	35%	0.351	C	S	.	.	H	α-helix	trans	-57.8	-43.4	175.3	0	0	0	0	0	112.2	K227 D228 L234 F235	K227-G231 PolarHBondContact O-N 3.35Å; D228-G231 PolarHBondContact O-N 3.06Å; G231-L234 PolarHBondContact O-N 3.44Å; G231-F235 WeakPolarHBondContact O-CB 3.5Å; G231-F235 PolarHBondContact O-N 3.26Å
232	L	98.8	Very high	98.5	Very high	67 Å²	67	61.8 Å²	61.8	35%	0.351	33%	0.334	S	S	.	.	H	α-helix	trans	-64.5	-40.1	176.7	-178.4	62	0	0	0	112.1	L36 A39 D228 A229 L230 F235 I236	L36-L232 HydrophobicContact CD2-CB 4.47Å; L36-L232 HydrophobicContact CD2-CD1 4.45Å; A39-L232 HydrophobicContact CB-CD1 3.71Å; D228-L232 WeakPolarHBondContact O-CB 3.49Å; D228-L232 PolarHBondContact O-N 3.4Å; A229-L232 PolarHBondContact O-N 2.82Å; L230-L232 VanDerWaalsContact C-N 3.3Å; L230-L232 PolarHBondContact O-N 2.98Å; L232-F235 HydrophobicContact CD1-CD1 4.22Å; L232-F235 WeakPolarHBondContact O-CB 3.16Å; L232-F235 PolarHBondContact O-N 3.46Å; L232-I236 HydrophobicContact CD1-CD1 4.12Å; L232-I236 HydrophobicContact CD1-CG1 4.21Å; L232-I236 HydrophobicContact CG-CD1 3.91Å; L232-I236 HydrophobicContact CG-CG1 4.42Å; L232-I236 VanDerWaalsContact O-CG1 3.31Å; L232-I236 WeakPolarHBondContact O-CG1 3.19Å; L232-I236 PolarHBondContact O-N 3.48Å
233	L	98.8	Very high	98.6	Very high	110 Å²	110	58.7 Å²	58.7	58%	0.576	31%	0.314	S	S	*	.	H	α-helix	trans	-60.3	-46.1	175.7	178.6	64.8	0	0	0	111.5	A229 L230 F235 I236 L237	A229-L233 PolarHBondContact O-N 3.23Å; L230-L233 WeakPolarHBondContact O-CB 3.29Å; L230-L233 PolarHBondContact O-N 3.45Å; L233-F235 VanDerWaalsContact C-N 3.35Å; L233-I236 PolarHBondContact O-N 2.93Å; L233-L237 WeakPolarHBondContact O-CB 3.46Å; L233-L237 PolarHBondContact O-N 3.31Å
234	L	98.7	Very high	98.6	Very high	104 Å²	104	56.4 Å²	56.4	55%	0.545	31%	0.31	S	S	.	.	H	α-helix	trans	-65	-39.7	177.1	-65.6	176.4	0	0	0	111.8	L230 G231 L237 S238	L230-L234 WeakPolarHBondContact O-CG 3.38Å; L230-L234 PolarHBondContact O-N 3.49Å; L230-L234 VanDerWaalsContact O-N 3.08Å; G231-L234 PolarHBondContact O-N 3.44Å; L234-L237 PolarHBondContact O-N 3.08Å; L234-S238 PolarHBondContact O-N 3.45Å; L234-S238 PolarHBondContact O-OG 2.94Å
235	F	98.6	Very high	98.6	Very high	13 Å²	13	64 Å²	64	6%	0.057	34%	0.344	C	S	.	.	H	α-helix	trans	-58.8	-52.5	173.3	171.2	-88.9	0	0	0	111.4	L36 C40 M89 G231 L232 L233 L237 S238 L239	L36-F235 HydrophobicContact CD2-CB 3.66Å; L36-F235 HydrophobicContact CD2-CD2 4.34Å; L36-F235 HydrophobicContact CD2-CG 4.04Å; C40-F235 WeakPolarHBondContact SG-CE2 3.39Å; C40-F235 WeakPolarHBondContact SG-CZ 3.33Å; M89-F235 HydrophobicContact CB-CE2 3.7Å; M89-F235 HydrophobicContact CB-CZ 3.99Å; M89-F235 HydrophobicContact CE-CD2 3.87Å; M89-F235 HydrophobicContact CE-CE2 3.91Å; M89-F235 HydrophobicContact CG-CE2 4.4Å; G231-F235 WeakPolarHBondContact O-CB 3.5Å; G231-F235 PolarHBondContact O-N 3.26Å; L232-F235 HydrophobicContact CD1-CD1 4.22Å; L232-F235 WeakPolarHBondContact O-CB 3.16Å; L232-F235 PolarHBondContact O-N 3.46Å; L233-F235 VanDerWaalsContact C-N 3.35Å; F235-L237 VanDerWaalsContact C-N 3.3Å; F235-L237 PolarHBondContact O-N 3.44Å; F235-S238 PolarHBondContact O-N 2.9Å; F235-S238 PolarHBondContact O-OG 3.35Å; F235-L239 HydrophobicContact CE1-CD2 4.07Å; F235-L239 HydrophobicContact CZ-CD2 4.4Å; F235-L239 WeakPolarHBondContact O-CB 3.49Å; F235-L239 PolarHBondContact O-N 2.83Å
236	I	98.8	Very high	98.6	Very high	78 Å²	78	63.8 Å²	63.8	40%	0.4	34%	0.344	S	S	.	.	H	α-helix	trans	-60.1	-43.5	179.2	-68.6	168.8	0	0	0	110	L232 L233 S238 L239 M240	L232-I236 HydrophobicContact CD1-CD1 4.12Å; L232-I236 HydrophobicContact CD1-CG1 4.21Å; L232-I236 HydrophobicContact CG-CD1 3.91Å; L232-I236 HydrophobicContact CG-CG1 4.42Å; L232-I236 VanDerWaalsContact O-CG1 3.31Å; L232-I236 WeakPolarHBondContact O-CG1 3.19Å; L232-I236 PolarHBondContact O-N 3.48Å; L233-I236 PolarHBondContact O-N 2.93Å; I236-S238 PolarHBondContact O-N 3.33Å; I236-L239 PolarHBondContact O-N 3.24Å; I236-M240 HydrophobicContact CG2-CG 3.88Å; I236-M240 VanDerWaalsContact O-CB 3.3Å; I236-M240 WeakPolarHBondContact O-CB 3.42Å; I236-M240 WeakPolarHBondContact O-CG 3.25Å; I236-M240 PolarHBondContact O-N 3.46Å
237	L	98.7	Very high	98.6	Very high	107 Å²	107	59.7 Å²	59.7	56%	0.56	33%	0.326	S	S	*	.	H	α-helix	trans	-56.1	-51.1	176.4	-179.2	64	0	0	0	111	L233 L234 F235 L239 M240 T241	L233-L237 WeakPolarHBondContact O-CB 3.46Å; L233-L237 PolarHBondContact O-N 3.31Å; L234-L237 PolarHBondContact O-N 3.08Å; F235-L237 VanDerWaalsContact C-N 3.3Å; F235-L237 PolarHBondContact O-N 3.44Å; L237-L239 PolarHBondContact O-N 2.92Å; L237-M240 PolarHBondContact O-N 2.79Å; L237-T241 WeakPolarHBondContact O-CB 3.02Å; L237-T241 PolarHBondContact O-N 2.94Å; L237-T241 PolarHBondContact O-OG1 3.29Å
238	S	98.5	Very high	98.5	Very high	51 Å²	51	60.9 Å²	60.9	36%	0.357	33%	0.334	S	S	.	.	H	α-helix	trans	-61.9	-44.2	179.4	66.3	0	0	0	0	113.2	M89 L234 F235 I236 T241 L242	M89-S238 WeakPolarHBondContact CE-OG 3.17Å; L234-S238 PolarHBondContact O-N 3.45Å; L234-S238 PolarHBondContact O-OG 2.94Å; F235-S238 PolarHBondContact O-N 2.9Å; F235-S238 PolarHBondContact O-OG 3.35Å; I236-S238 PolarHBondContact O-N 3.33Å; S238-T241 PolarHBondContact O-N 3.19Å; S238-L242 PolarHBondContact O-N 3.3Å
239	L	98.8	Very high	98.5	Very high	6 Å²	6	65.3 Å²	65.3	3%	0.031	36%	0.357	C	S	.	.	H	α-helix	trans	-63.8	-43.9	178	174	63.9	0	0	0	111.4	L43 L82 N85 M89 F235 I236 L237 L242 T243	L43-L239 HydrophobicContact CD2-CD2 3.44Å; L43-L239 VanDerWaalsContact CD2-CD2 3.44Å; L82-L239 HydrophobicContact CD2-CD2 3.91Å; L82-L239 HydrophobicContact CD2-CG 4.05Å; N85-L239 HydrophobicContact CB-CD1 3.91Å; M89-L239 HydrophobicContact CG-CB 4.36Å; M89-L239 HydrophobicContact CG-CD1 3.88Å; F235-L239 HydrophobicContact CE1-CD2 4.07Å; F235-L239 HydrophobicContact CZ-CD2 4.4Å; F235-L239 WeakPolarHBondContact O-CB 3.49Å; F235-L239 PolarHBondContact O-N 2.83Å; I236-L239 PolarHBondContact O-N 3.24Å; L237-L239 PolarHBondContact O-N 2.92Å; L239-L242 PolarHBondContact O-N 3.29Å; L239-T243 WeakPolarHBondContact O-CB 3.21Å; L239-T243 PolarHBondContact O-N 2.78Å; L239-T243 PolarHBondContact O-OG1 2.72Å
240	M	98.6	Very high	98.5	Very high	57 Å²	57	65.6 Å²	65.6	28%	0.281	35%	0.351	S	S	.	.	H	α-helix	trans	-69.7	-37.6	179.4	-67.5	-57.7	-61	0	0	111.3	I78 L82 I236 L237 T243 L244	I78-M240 HydrophobicContact CD1-CE 4.21Å; L82-M240 HydrophobicContact CD2-SD 3.86Å; I236-M240 HydrophobicContact CG2-CG 3.88Å; I236-M240 VanDerWaalsContact O-CB 3.3Å; I236-M240 WeakPolarHBondContact O-CB 3.42Å; I236-M240 WeakPolarHBondContact O-CG 3.25Å; I236-M240 PolarHBondContact O-N 3.46Å; L237-M240 PolarHBondContact O-N 2.79Å; M240-T243 PolarHBondContact O-N 3.25Å; M240-L244 HydrophobicContact CB-CD1 4.44Å; M240-L244 HydrophobicContact CE-CD1 3.67Å; M240-L244 HydrophobicContact CE-CD2 4.17Å; M240-L244 HydrophobicContact CE-CG 3.92Å; M240-L244 VanDerWaalsContact O-CB 3.23Å; M240-L244 WeakPolarHBondContact O-CB 3.45Å; M240-L244 VanDerWaalsContact O-CG 3.24Å; M240-L244 WeakPolarHBondContact O-CG 3.35Å; M240-L244 PolarHBondContact O-N 3.41Å
241	T	98.7	Very high	98.4	Very high	68 Å²	68	62.8 Å²	62.8	42%	0.417	35%	0.347	S	S	.	.	H	α-helix	trans	-60.3	-48.5	173.5	-61.2	0	0	0	0	110.8	L237 S238 F245	L237-T241 WeakPolarHBondContact O-CB 3.02Å; L237-T241 PolarHBondContact O-N 2.94Å; L237-T241 PolarHBondContact O-OG1 3.29Å; S238-T241 PolarHBondContact O-N 3.19Å; T241-F245 HydrophobicContact CG2-CD2 4.14Å; T241-F245 WeakPolarHBondContact O-CB 3.37Å; T241-F245 WeakPolarHBondContact O-CD2 3.4Å; T241-F245 PolarHBondContact O-N 2.7Å
242	L	98.5	Very high	98.3	Very high	20 Å²	20	63.2 Å²	63.2	11%	0.105	35%	0.346	C	S	.	.	H	α-helix	trans	-60.1	-49.3	176.1	178.8	62.7	0	0	0	111.2	N85 S238 L239 L244 S246 P247 L249 L250	N85-L242 HydrophobicContact CB-CD2 3.79Å; N85-L242 HydrophobicContact CB-CG 4.19Å; N85-L242 WeakPolarHBondContact OD1-CD2 3.44Å; S238-L242 PolarHBondContact O-N 3.3Å; L239-L242 PolarHBondContact O-N 3.29Å; L242-L244 PolarHBondContact O-N 3.43Å; L242-S246 WeakPolarHBondContact CD1-O 3.38Å; L242-S246 CarbonylContact O-C 3.45Å; L242-S246 WeakPolarHBondContact O-CA 3.33Å; L242-S246 PolarHBondContact O-N 2.76Å; L242-S246 VanDerWaalsContact O-O 3.14Å; L242-S246 PolarHBondContact O-OG 3.43Å; L242-P247 WeakPolarHBondContact O-CA 3.3Å; L242-P247 VanDerWaalsContact O-N 3.09Å; L242-L249 HydrophobicContact CD1-CB 4.01Å; L242-L249 HydrophobicContact CD1-CD2 4.08Å; L242-L250 HydrophobicContact CD1-CG 4.41Å; L242-L250 HydrophobicContact CD2-CD1 3.69Å; L242-L250 HydrophobicContact CD2-CG 4.37Å
243	T	98.3	Very high	98.2	Very high	1 Å²	1	64.5 Å²	64.5	1%	0.006	36%	0.358	C	S	.	.	H	α-helix	trans	-67.5	-37.2	-174.7	-62	0	0	0	0	113.4	I78 L82 L239 M240 P247	I78-T243 HydrophobicContact CG1-CG2 4.35Å; L82-T243 HydrophobicContact CD2-CG2 4.18Å; L82-T243 HydrophobicContact CG-CG2 4.19Å; L239-T243 WeakPolarHBondContact O-CB 3.21Å; L239-T243 PolarHBondContact O-N 2.78Å; L239-T243 PolarHBondContact O-OG1 2.72Å; M240-T243 PolarHBondContact O-N 3.25Å; T243-P247 WeakPolarHBondContact O-CB 3.47Å
244	L	98.6	Very high	98.1	Very high	83 Å²	83	61.8 Å²	61.8	44%	0.435	34%	0.344	S	S	.	.	H	α-helix	trans	-90.8	-33.6	-174.5	-63.7	177.1	0	0	0	113.2	W77 I78 M240 L242	W77-L244 HydrophobicContact CH2-CD2 3.94Å; W77-L244 HydrophobicContact CZ3-CD2 4.26Å; I78-L244 HydrophobicContact CD1-CD2 3.95Å; M240-L244 HydrophobicContact CB-CD1 4.44Å; M240-L244 HydrophobicContact CE-CD1 3.67Å; M240-L244 HydrophobicContact CE-CD2 4.17Å; M240-L244 HydrophobicContact CE-CG 3.92Å; M240-L244 VanDerWaalsContact O-CB 3.23Å; M240-L244 WeakPolarHBondContact O-CB 3.45Å; M240-L244 VanDerWaalsContact O-CG 3.24Å; M240-L244 WeakPolarHBondContact O-CG 3.35Å; M240-L244 PolarHBondContact O-N 3.41Å; L242-L244 PolarHBondContact O-N 3.43Å
245	F	98.5	Very high	98	Very high	168 Å²	168	57.9 Å²	57.9	74%	0.737	32%	0.324	S	S	*	.	H	α-helix	trans	-105.2	-28.3	-174.6	-64	-76.9	0	0	0	113.8	T241	T241-F245 HydrophobicContact CG2-CD2 4.14Å; T241-F245 WeakPolarHBondContact O-CB 3.37Å; T241-F245 WeakPolarHBondContact O-CD2 3.4Å; T241-F245 PolarHBondContact O-N 2.7Å
246	S	98.3	Very high	98	Very high	43 Å²	43	62.1 Å²	62.1	30%	0.301	34%	0.34	S	S	.	.			trans	-145.1	55	-175.8	61.6	0	0	0	0	112.1	L242 D248 L249	L242-S246 WeakPolarHBondContact CD1-O 3.38Å; L242-S246 CarbonylContact O-C 3.45Å; L242-S246 WeakPolarHBondContact O-CA 3.33Å; L242-S246 PolarHBondContact O-N 2.76Å; L242-S246 VanDerWaalsContact O-O 3.14Å; L242-S246 PolarHBondContact O-OG 3.43Å; S246-D248 PolarHBondContact O-N 3.5Å; S246-D248 VanDerWaalsContact O-N 3.1Å; S246-L249 WeakPolarHBondContact O-CB 3.14Å; S246-L249 PolarHBondContact O-N 3.49Å; S246-L249 VanDerWaalsContact O-N 3.12Å
247	P	98.1	Very high	97.9	Very high	33 Å²	33	61.8 Å²	61.8	21%	0.214	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-26.7	-167.8	20.5	-32.6	0	0	0	114.7	Y81 N85 L242 T243	Y81-P247 HydrophobicContact CD1-CB 3.57Å; Y81-P247 HydrophobicContact CD2-CB 4.04Å; Y81-P247 HydrophobicContact CE1-CB 3.77Å; Y81-P247 HydrophobicContact CE2-CB 4.23Å; Y81-P247 HydrophobicContact CG-CB 3.73Å; N85-P247 PolarHBondContact ND2-O 3.32Å; N85-P247 PolarHBondContact OD1-O 2.72Å; L242-P247 WeakPolarHBondContact O-CA 3.3Å; L242-P247 VanDerWaalsContact O-N 3.09Å; T243-P247 WeakPolarHBondContact O-CB 3.47Å
248	D	98.1	Very high	97.9	Very high	73 Å²	73	61.2 Å²	61.2	39%	0.39	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	2.8	-176.3	-63.7	-53.6	0	0	0	113.7	S246 L250 G251 Y256	S246-D248 PolarHBondContact O-N 3.5Å; S246-D248 VanDerWaalsContact O-N 3.1Å; D248-L250 PolarHBondContact O-N 3.3Å; D248-L250 VanDerWaalsContact O-N 3.1Å; D248-G251 PolarHBondContact O-N 3.38Å; D248-G251 VanDerWaalsContact O-N 3.12Å; D248-Y256 WeakPolarHBondContact OD1-CE2 3.46Å; D248-Y256 PolarHBondContact OD1-OH 3.32Å
249	L	98.4	Very high	97.8	Very high	124 Å²	124	59.5 Å²	59.5	65%	0.649	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-33.8	-173.5	178.8	63.9	0	0	0	113.6	L242 S246	L242-L249 HydrophobicContact CD1-CB 4.01Å; L242-L249 HydrophobicContact CD1-CD2 4.08Å; S246-L249 WeakPolarHBondContact O-CB 3.14Å; S246-L249 PolarHBondContact O-N 3.49Å; S246-L249 VanDerWaalsContact O-N 3.12Å
250	L	97.9	Very high	97.7	Very high	57 Å²	57	62.4 Å²	62.4	30%	0.298	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99	-7	-176.1	-58.2	-177.7	0	0	0	113.7	S88 L242 D248	S88-L250 VanDerWaalsContact CB-CD1 3.48Å; L242-L250 HydrophobicContact CD1-CG 4.41Å; L242-L250 HydrophobicContact CD2-CD1 3.69Å; L242-L250 HydrophobicContact CD2-CG 4.37Å; D248-L250 PolarHBondContact O-N 3.3Å; D248-L250 VanDerWaalsContact O-N 3.1Å
251	G	95.7	Very high	97.6	Very high	42 Å²	42	63.4 Å²	63.4	43%	0.433	35%	0.354	S	S	.	.	S	Bend	trans	-96.1	167.2	-178.2	0	0	0	0	0	113	D248	D248-G251 PolarHBondContact O-N 3.38Å; D248-G251 VanDerWaalsContact O-N 3.12Å
252	D	96.9	Very high	97.5	Very high	22 Å²	22	68.1 Å²	68.1	12%	0.118	38%	0.376	C	S	.	.			trans	-97.8	128.7	175.4	-161.1	-70.8	0	0	0	111.5	M138 D254 N255 K269	M138-D252 HydrophobicContact CG-CB 4.08Å; D252-D254 PolarHBondContact O-N 3.45Å; D252-D254 WeakPolarHBondContact OD1-CB 3.32Å; D252-D254 PolarHBondContact OD1-N 3.08Å; D252-N255 WeakPolarHBondContact O-CB 3.35Å; D252-N255 PolarHBondContact O-N 2.72Å; D252-N255 VanDerWaalsContact O-N 3.09Å; D252-K269 WeakPolarHBondContact OD2-CE 3.47Å; D252-K269 IonicContact OD2-NZ 3.6Å; D252-K269 PolarHBondContact OD2-NZ 3.48Å
253	P	96.9	Very high	97.3	Very high	95 Å²	95	71.5 Å²	71.5	62%	0.617	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-61.8	-27	-178	25.6	-35.7	0	0	0	113.4	N255 Y256	P253-N255 PolarHBondContact O-N 3.42Å; P253-N255 VanDerWaalsContact O-N 3.15Å; P253-Y256 WeakPolarHBondContact O-CB 3.44Å; P253-Y256 PolarHBondContact O-N 2.96Å
254	D	96.7	Very high	97.1	Very high	53 Å²	53	75 Å²	75	28%	0.283	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-63.4	-23.3	178.6	-76.4	-8.8	0	0	0	111.2	Q137 M138 D252 Y256 T257	Q137-D254 HydrophobicContact CB-CB 4.48Å; M138-D254 HydrophobicContact CE-CB 3.49Å; M138-D254 VanDerWaalsContact CE-CB 3.49Å; M138-D254 WeakPolarHBondContact CE-OD2 3.28Å; M138-D254 HydrophobicContact CG-CB 3.8Å; D252-D254 PolarHBondContact O-N 3.45Å; D252-D254 WeakPolarHBondContact OD1-CB 3.32Å; D252-D254 PolarHBondContact OD1-N 3.08Å; D254-Y256 PolarHBondContact O-N 3.04Å; D254-T257 PolarHBondContact O-N 3.44Å; D254-T257 PolarHBondContact O-OG1 2.8Å
255	N	97.4	Very high	96.8	Very high	21 Å²	21	71.5 Å²	71.5	11%	0.112	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-73.4	-5.3	176.9	-140.1	32.4	0	0	0	114.2	G136 M138 S139 D252 P253 T257	G136-N255 VanDerWaalsContact C-OD1 3.28Å; G136-N255 VanDerWaalsContact CA-OD1 3.24Å; G136-N255 WeakPolarHBondContact CA-OD1 3.47Å; M138-N255 HydrophobicContact CB-CB 4.14Å; M138-N255 PolarHBondContact N-OD1 3.39Å; S139-N255 PolarHBondContact N-OD1 3.03Å; S139-N255 PolarHBondContact OG-ND2 3.39Å; S139-N255 PolarHBondContact OG-OD1 3.2Å; D252-N255 WeakPolarHBondContact O-CB 3.35Å; D252-N255 PolarHBondContact O-N 2.72Å; D252-N255 VanDerWaalsContact O-N 3.09Å; P253-N255 PolarHBondContact O-N 3.42Å; P253-N255 VanDerWaalsContact O-N 3.15Å; N255-T257 VanDerWaalsContact C-N 3.3Å
256	Y	97.4	Very high	96.5	Very high	103 Å²	103	69.9 Å²	69.9	40%	0.404	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-86.9	3.3	167.5	-75.1	-72	0	0	0	113.7	F63 R80 Y81 D248 P253 D254	F63-Y256 WeakPolarHBondContact CZ-O 3.47Å; R80-Y256 PolarHBondContact NH1-OH 2.8Å; Y81-Y256 PolarHBondContact OH-OH 3.02Å; D248-Y256 WeakPolarHBondContact OD1-CE2 3.46Å; D248-Y256 PolarHBondContact OD1-OH 3.32Å; P253-Y256 WeakPolarHBondContact O-CB 3.44Å; P253-Y256 PolarHBondContact O-N 2.96Å; D254-Y256 PolarHBondContact O-N 3.04Å
257	T	97.8	Very high	96.2	Very high	70 Å²	70	70.2 Å²	70.2	43%	0.429	40%	0.401	S	S	.	.	S	Bend	trans	-108.3	135.3	170.6	61.4	0	0	0	0	110.1	G136 Q137 D254 N255 A259	G136-T257 CarbonylContact C-O 3.52Å; G136-T257 WeakPolarHBondContact CA-O 3.47Å; Q137-T257 WeakPolarHBondContact CG-OG1 3.27Å; Q137-T257 PolarHBondContact N-O 2.83Å; D254-T257 PolarHBondContact O-N 3.44Å; D254-T257 PolarHBondContact O-OG1 2.8Å; N255-T257 VanDerWaalsContact C-N 3.3Å; T257-A259 PolarHBondContact O-N 3.12Å
258	L	97.6	Very high	96	Very high	96 Å²	96	70.1 Å²	70.1	50%	0.503	40%	0.398	S	S	.	.	B	Isolated β-bridge	trans	-56.5	137.9	178.8	175.6	65.5	0	0	0	110.3	F63 N260	F63-L258 HydrophobicContact CB-CD1 3.45Å; F63-L258 VanDerWaalsContact CB-CD1 3.45Å; F63-L258 HydrophobicContact CD1-CB 4.25Å; F63-L258 HydrophobicContact CD1-CD1 4.16Å; F63-L258 HydrophobicContact CD2-CB 4.48Å; F63-L258 HydrophobicContact CD2-CD1 4.23Å; F63-L258 HydrophobicContact CE1-CB 4.39Å; F63-L258 HydrophobicContact CG-CB 4.31Å; F63-L258 HydrophobicContact CG-CD1 3.7Å; L258-N260 PolarHBondContact O-N 3.32Å
259	A	96.9	Very high	95.8	Very high	15 Å²	15	69.6 Å²	69.6	12%	0.124	39%	0.392	C	S	.	.			trans	-52.5	128.6	176.1	0	0	0	0	0	112	W135 F140 T257	W135-A259 HydrophobicContact CG-CB 4.44Å; W135-A259 WeakPolarHBondContact O-CB 3.27Å; W135-A259 PolarHBondContact O-N 3.43Å; W135-A259 VanDerWaalsContact O-N 3.12Å; F140-A259 HydrophobicContact CB-CB 3.51Å; F140-A259 HydrophobicContact CD2-CB 4.26Å; F140-A259 HydrophobicContact CG-CB 3.92Å; T257-A259 PolarHBondContact O-N 3.12Å
260	N	96.8	Very high	95.7	Very high	66 Å²	66	64.7 Å²	64.7	35%	0.353	37%	0.368	S	S	.	.			trans	-126.1	108	173	-177.4	-10.5	0	0	0	109.4	W141 L258 L262 N263	W141-N260 PolarHBondContact NE1-O 2.55Å; L258-N260 PolarHBondContact O-N 3.32Å; N260-L262 PolarHBondContact O-N 3.21Å; N260-L262 WeakPolarHBondContact OD1-CB 3.38Å; N260-L262 PolarHBondContact OD1-N 3.29Å; N260-N263 HydrophobicContact CB-CB 4.19Å; N260-N263 PolarHBondContact O-N 3.08Å
261	P	95.5	Very high	95.7	Very high	79 Å²	79	63 Å²	63	51%	0.513	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-16.7	179.3	-24.2	34.1	0	0	0	114.7	F140 W141	F140-P261 HydrophobicContact CE1-CB 4.13Å; F140-P261 HydrophobicContact CE1-CG 4.28Å; F140-P261 HydrophobicContact CE2-CG 4.25Å; F140-P261 HydrophobicContact CZ-CB 3.89Å; F140-P261 HydrophobicContact CZ-CG 3.81Å; W141-P261 WeakPolarHBondContact CH2-O 2.91Å; W141-P261 WeakPolarHBondContact CZ2-O 3.16Å
262	L	96.3	Very high	95.9	Very high	166 Å²	166	63.9 Å²	63.9	87%	0.869	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	-5.4	-179.4	-55.5	179.4	0	0	0	113.5	N260	N260-L262 PolarHBondContact O-N 3.21Å; N260-L262 WeakPolarHBondContact OD1-CB 3.38Å; N260-L262 PolarHBondContact OD1-N 3.29Å
263	N	95.6	Very high	95.9	Very high	91 Å²	91	63.3 Å²	63.3	49%	0.487	35%	0.345	S	S	.	.			trans	-129.8	100.3	-179	-174.7	15.4	0	0	0	111.1	Q137 W141 N260	Q137-N263 PolarHBondContact NE2-O 3.47Å; W141-N263 PolarHBondContact NE1-O 2.73Å; W141-N263 VanDerWaalsContact NE1-O 3.07Å; N260-N263 HydrophobicContact CB-CB 4.19Å; N260-N263 PolarHBondContact O-N 3.08Å
264	T	93.6	Very high	96	Very high	74 Å²	74	60.1 Å²	60.1	45%	0.454	32%	0.322	S	S	.	.			trans	-78	127.6	178.4	-48.2	0	0	0	0	110.8	W141 I268	W141-T264 HydrophobicContact CD2-CG2 4.19Å; W141-T264 HydrophobicContact CE3-CG2 4.17Å; W141-T264 HydrophobicContact CH2-CG2 4.49Å; W141-T264 VanDerWaalsContact CH2-OG1 3.26Å; W141-T264 WeakPolarHBondContact CH2-OG1 3.28Å; W141-T264 HydrophobicContact CZ2-CG2 4.49Å; W141-T264 WeakPolarHBondContact CZ2-OG1 3.25Å; W141-T264 HydrophobicContact CZ3-CG2 4.34Å; T264-I268 HydrophobicContact CG2-CD1 3.46Å; T264-I268 VanDerWaalsContact CG2-CD1 3.46Å; T264-I268 HydrophobicContact CG2-CG1 4.3Å
265	P	93.5	Very high	96.1	Very high	11 Å²	11	58.4 Å²	58.4	7%	0.071	31%	0.313	C	S	.	.			trans	-57.1	150.7	173.1	-28	35.4	0	0	0	112.6	Q137 M138 W141 H267 I268	Q137-P265 HydrophobicContact CB-CG 3.88Å; M138-P265 HydrophobicContact CE-CB 3.44Å; M138-P265 VanDerWaalsContact CE-CB 3.44Å; M138-P265 HydrophobicContact CE-CG 3.93Å; W141-P265 HydrophobicContact CG-CG 4.37Å; P265-H267 VanDerWaalsContact C-N 3.25Å; P265-H267 PolarHBondContact O-N 2.84Å; P265-I268 HydrophobicContact CB-CG1 4.43Å
266	P	90.4	Very high	96.2	Very high	133 Å²	133	58.5 Å²	58.5	86%	0.864	31%	0.312	S	S	*	.	S	Bend	trans	-58	-35	-178.6	-24.9	33.7	0	0	0	114.1
267	H	92.2	Very high	96.2	Very high	51 Å²	51	53.8 Å²	53.8	24%	0.236	29%	0.294	C	S	.	.	S	Bend	trans	-141.3	94.2	-179.1	-174	-110	0	0	0	111.9	P265 K269 G340 Q341	P265-H267 VanDerWaalsContact C-N 3.25Å; P265-H267 PolarHBondContact O-N 2.84Å; H267-K269 PolarHBondContact O-N 2.85Å; H267-G340 PolarHBondContact CE1-O 3.32Å; H267-Q341 PolarHBondContact NE2-O 3.17Å
268	I	93.8	Very high	96.3	Very high	31 Å²	31	51.9 Å²	51.9	16%	0.159	28%	0.28	C	S	.	.			trans	-75	124.7	174.6	-57.3	162.1	0	0	0	109.6	W141 V145 T264 P265 Y278	W141-I268 HydrophobicContact CB-CD1 3.74Å; W141-I268 HydrophobicContact CB-CG1 3.92Å; W141-I268 HydrophobicContact CB-CG2 4.22Å; W141-I268 HydrophobicContact CD2-CD1 4.32Å; W141-I268 HydrophobicContact CE3-CD1 4.23Å; W141-I268 HydrophobicContact CG-CD1 4.16Å; V145-I268 HydrophobicContact CG2-CD1 4.18Å; V145-I268 HydrophobicContact CG2-CG2 4.26Å; T264-I268 HydrophobicContact CG2-CD1 3.46Å; T264-I268 VanDerWaalsContact CG2-CD1 3.46Å; T264-I268 HydrophobicContact CG2-CG1 4.3Å; P265-I268 HydrophobicContact CB-CG1 4.43Å; I268-Y278 PolarHBondContact O-OH 2.76Å
269	K	94.8	Very high	96.3	Very high	61 Å²	61	47.4 Å²	47.4	27%	0.265	26%	0.256	S	S	.	.			trans	-146.1	152.2	176.2	59.3	-179.2	175.6	-176.6	0	109.4	D252 H267 L275 Y278	D252-K269 WeakPolarHBondContact OD2-CE 3.47Å; D252-K269 IonicContact OD2-NZ 3.6Å; D252-K269 PolarHBondContact OD2-NZ 3.48Å; H267-K269 PolarHBondContact O-N 2.85Å; K269-L275 HydrophobicContact CB-CD2 4.13Å; K269-Y278 HydrophobicContact CB-CE1 4.17Å
270	P	96.8	Very high	96.4	Very high	21 Å²	21	46.8 Å²	46.8	14%	0.136	25%	0.251	C	S	.	.			trans	-77.6	174.3	170.5	36	-36.8	0	0	0	110.9	F274 L275 Y278	P270-F274 HydrophobicContact CB-CB 3.79Å; P270-F274 HydrophobicContact CB-CD2 4.12Å; P270-F274 HydrophobicContact CB-CG 4.39Å; P270-F274 HydrophobicContact CG-CB 3.7Å; P270-L275 HydrophobicContact CG-CD2 4.13Å; P270-L275 WeakPolarHBondContact O-CD2 3.32Å; P270-Y278 HydrophobicContact CG-CD1 4.42Å; P270-Y278 HydrophobicContact CG-CG 4.09Å
271	E	97.8	Very high	96.5	Very high	22 Å²	22	44.5 Å²	44.5	10%	0.103	24%	0.238	C	C	.	.			trans	-57.8	156.7	172.2	-69.4	-67.4	111.2	0	0	112.7	Y131 Y273 F274	Y131-E271 HydrophobicContact CD1-CG 4.25Å; Y131-E271 HydrophobicContact CD2-CG 3.48Å; Y131-E271 VanDerWaalsContact CD2-CG 3.48Å; Y131-E271 HydrophobicContact CE1-CG 4.2Å; Y131-E271 HydrophobicContact CE2-CG 3.4Å; Y131-E271 VanDerWaalsContact CE2-CG 3.4Å; Y131-E271 WeakPolarHBondContact CE2-OE1 3.17Å; Y131-E271 HydrophobicContact CG-CG 3.89Å; Y131-E271 PolarHBondContact OH-OE1 3.47Å; E271-Y273 HydrophobicContact CB-CD1 4.19Å; E271-Y273 HydrophobicContact CB-CE1 3.56Å; E271-Y273 HydrophobicContact CB-CE2 4.08Å; E271-Y273 VanDerWaalsContact CB-CZ 3.49Å; E271-Y273 HydrophobicContact CG-CE1 4.3Å; E271-Y273 PolarHBondContact O-N 3.26Å; E271-F274 PolarHBondContact O-N 3.09Å
272	W	98.6	Very high	96.6	Very high	60 Å²	60	43.5 Å²	43.5	23%	0.227	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-53.6	-36.9	-166.6	71.6	-93.3	0	0	0	114.2	S88 F91 I92 F95 F274 L275	S88-W272 PolarHBondContact OG-NE1 2.96Å; F91-W272 HydrophobicContact CB-CH2 4.09Å; F91-W272 HydrophobicContact CB-CZ2 4.11Å; I92-W272 HydrophobicContact CD1-CZ2 4.3Å; I92-W272 HydrophobicContact CG1-CH2 3.56Å; I92-W272 HydrophobicContact CG1-CZ2 3.72Å; F95-W272 HydrophobicContact CD2-CH2 4.17Å; F95-W272 HydrophobicContact CD2-CZ3 4.13Å; F95-W272 HydrophobicContact CE2-CH2 4Å; F95-W272 AromaticContact CE2-CZ3 3.81Å; F95-W272 HydrophobicContact CE2-CZ3 3.81Å; W272-F274 PolarHBondContact O-N 2.82Å; W272-L275 HydrophobicContact CB-CD1 4.28Å; W272-L275 WeakPolarHBondContact O-CB 3.45Å; W272-L275 PolarHBondContact O-N 2.78Å; W272-L275 VanDerWaalsContact O-N 3.11Å
273	Y	98.4	Very high	96.7	Very high	10 Å²	10	36.3 Å²	36.3	4%	0.039	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-70.6	-8.3	-178.9	46	-96.1	0	0	0	114	F91 F95 A127 E271 F276	F91-Y273 HydrophobicContact CB-CD1 4.24Å; F91-Y273 HydrophobicContact CB-CG 3.97Å; F91-Y273 AromaticContact CD1-CD2 3.97Å; F91-Y273 HydrophobicContact CD1-CD2 3.97Å; F91-Y273 HydrophobicContact CD1-CG 4.01Å; F91-Y273 AromaticContact CD2-CD1 3.75Å; F91-Y273 HydrophobicContact CD2-CD1 3.75Å; F91-Y273 AromaticContact CD2-CD2 3.52Å; F91-Y273 HydrophobicContact CD2-CD2 3.52Å; F91-Y273 HydrophobicContact CD2-CE1 4.07Å; F91-Y273 AromaticContact CD2-CE2 3.79Å; F91-Y273 HydrophobicContact CD2-CE2 3.79Å; F91-Y273 AromaticContact CD2-CG 3.5Å; F91-Y273 HydrophobicContact CD2-CG 3.5Å; F91-Y273 VanDerWaalsContact CD2-CG 3.5Å; F91-Y273 AromaticContact CE1-CD2 3.91Å; F91-Y273 HydrophobicContact CE1-CD2 3.91Å; F91-Y273 HydrophobicContact CE1-CG 4.41Å; F91-Y273 HydrophobicContact CE2-CD1 4.4Å; F91-Y273 AromaticContact CE2-CD2 3.46Å; F91-Y273 HydrophobicContact CE2-CD2 3.46Å; F91-Y273 VanDerWaalsContact CE2-CD2 3.46Å; F91-Y273 HydrophobicContact CE2-CE1 4.43Å; F91-Y273 AromaticContact CE2-CE2 3.43Å; F91-Y273 HydrophobicContact CE2-CE2 3.43Å; F91-Y273 VanDerWaalsContact CE2-CE2 3.43Å; F91-Y273 AromaticContact CE2-CG 3.97Å; F91-Y273 HydrophobicContact CE2-CG 3.97Å; F91-Y273 AromaticContact CE2-CZ 3.98Å; F91-Y273 HydrophobicContact CG-CD1 4.06Å; F91-Y273 AromaticContact CG-CD2 3.79Å; F91-Y273 HydrophobicContact CG-CD2 3.79Å; F91-Y273 HydrophobicContact CG-CE2 4.5Å; F91-Y273 AromaticContact CG-CG 3.53Å; F91-Y273 HydrophobicContact CG-CG 3.53Å; F91-Y273 AromaticContact CZ-CD2 3.67Å; F91-Y273 HydrophobicContact CZ-CD2 3.67Å; F91-Y273 AromaticContact CZ-CE2 3.87Å; F91-Y273 HydrophobicContact CZ-CE2 3.87Å; F91-Y273 HydrophobicContact CZ-CG 4.4Å; F95-Y273 WeakPolarHBondContact CZ-O 3.32Å; A127-Y273 HydrophobicContact CB-CE2 3.98Å; E271-Y273 HydrophobicContact CB-CD1 4.19Å; E271-Y273 HydrophobicContact CB-CE1 3.56Å; E271-Y273 HydrophobicContact CB-CE2 4.08Å; E271-Y273 VanDerWaalsContact CB-CZ 3.49Å; E271-Y273 HydrophobicContact CG-CE1 4.3Å; E271-Y273 PolarHBondContact O-N 3.26Å; Y273-F276 WeakPolarHBondContact O-CE1 3.46Å
274	F	98.6	Very high	96.8	Very high	29 Å²	29	34.5 Å²	34.5	13%	0.127	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-103.7	-9.5	171.5	-66.1	-57.3	0	0	0	113.8	M124 F128 P270 E271 W272 F276 A277 Y278	M124-F274 HydrophobicContact CB-CE1 3.83Å; M124-F274 HydrophobicContact CB-CZ 4.26Å; M124-F274 HydrophobicContact CE-CD1 3.64Å; M124-F274 HydrophobicContact CE-CE1 3.5Å; M124-F274 VanDerWaalsContact CE-CE1 3.5Å; M124-F274 HydrophobicContact CG-CE1 3.85Å; M124-F274 WeakPolarHBondContact O-CZ 3.4Å; F128-F274 HydrophobicContact CB-CE2 4.27Å; F128-F274 HydrophobicContact CB-CZ 4.19Å; P270-F274 HydrophobicContact CB-CB 3.79Å; P270-F274 HydrophobicContact CB-CD2 4.12Å; P270-F274 HydrophobicContact CB-CG 4.39Å; P270-F274 HydrophobicContact CG-CB 3.7Å; E271-F274 PolarHBondContact O-N 3.09Å; W272-F274 PolarHBondContact O-N 2.82Å; F274-F276 VanDerWaalsContact C-N 3.29Å; F274-F276 PolarHBondContact O-N 3.28Å; F274-A277 PolarHBondContact O-N 3.3Å; F274-Y278 WeakPolarHBondContact O-CB 3.42Å; F274-Y278 PolarHBondContact O-N 3.43Å
275	L	98.7	Very high	96.9	Very high	17 Å²	17	37 Å²	37	9%	0.089	20%	0.198	C	C	.	.	H	α-helix	trans	-62.7	-33.6	-170.6	-69.5	-179.5	0	0	0	113.3	K269 P270 W272 A277 Y278 T279 T336	K269-L275 HydrophobicContact CB-CD2 4.13Å; P270-L275 HydrophobicContact CG-CD2 4.13Å; P270-L275 WeakPolarHBondContact O-CD2 3.32Å; W272-L275 HydrophobicContact CB-CD1 4.28Å; W272-L275 WeakPolarHBondContact O-CB 3.45Å; W272-L275 PolarHBondContact O-N 2.78Å; W272-L275 VanDerWaalsContact O-N 3.11Å; L275-A277 PolarHBondContact O-N 2.86Å; L275-Y278 HydrophobicContact CD2-CD1 4.28Å; L275-Y278 PolarHBondContact O-N 3.32Å; L275-T279 PolarHBondContact O-N 3Å; L275-T279 PolarHBondContact O-OG1 3.18Å; L275-T336 HydrophobicContact CB-CG2 4.05Å; L275-T336 WeakPolarHBondContact CB-O 3.41Å; L275-T336 HydrophobicContact CD1-CG2 4.38Å
276	F	98.9	Very high	97.1	Very high	23 Å²	23	41 Å²	41	10%	0.101	22%	0.219	C	C	.	.	H	α-helix	trans	-61.2	-46.3	177.7	81	-83.9	0	0	0	111.8	F95 Y273 F274 T279 I280 L332 L335	F95-F276 HydrophobicContact CE1-CE1 4.44Å; F95-F276 HydrophobicContact CZ-CE1 4.31Å; Y273-F276 WeakPolarHBondContact O-CE1 3.46Å; F274-F276 VanDerWaalsContact C-N 3.29Å; F274-F276 PolarHBondContact O-N 3.28Å; F276-T279 PolarHBondContact O-N 3.33Å; F276-I280 PolarHBondContact O-N 3.01Å; F276-L332 HydrophobicContact CB-CD2 4.24Å; F276-L332 HydrophobicContact CD2-CD2 3.7Å; F276-L332 HydrophobicContact CE2-CD2 4.38Å; F276-L332 HydrophobicContact CG-CD2 4.11Å; F276-L335 HydrophobicContact CB-CB 3.95Å
277	A	98.6	Very high	97.3	Very high	4 Å²	4	39.5 Å²	39.5	3%	0.033	20%	0.198	C	C	.	.	H	α-helix	trans	-72.7	-33.3	178.6	0	0	0	0	0	111.4	F274 L275 T279 I280 L281 L294	F274-A277 PolarHBondContact O-N 3.3Å; L275-A277 PolarHBondContact O-N 2.86Å; A277-T279 VanDerWaalsContact C-N 3.32Å; A277-T279 PolarHBondContact O-N 3.35Å; A277-I280 PolarHBondContact O-N 3.23Å; A277-L281 PolarHBondContact O-N 3.09Å; A277-L294 HydrophobicContact CB-CD1 4.48Å; A277-L294 HydrophobicContact CB-CG 4.3Å
278	Y	98.5	Very high	97.5	Very high	30 Å²	30	40 Å²	40	12%	0.118	20%	0.202	C	C	.	.	H	α-helix	trans	-63.1	-36.1	172.9	-178.7	-123.9	0	0	0	112.5	I268 K269 P270 F274 L275 L281 R282	I268-Y278 PolarHBondContact O-OH 2.76Å; K269-Y278 HydrophobicContact CB-CE1 4.17Å; P270-Y278 HydrophobicContact CG-CD1 4.42Å; P270-Y278 HydrophobicContact CG-CG 4.09Å; F274-Y278 WeakPolarHBondContact O-CB 3.42Å; F274-Y278 PolarHBondContact O-N 3.43Å; L275-Y278 HydrophobicContact CD2-CD1 4.28Å; L275-Y278 PolarHBondContact O-N 3.32Å; Y278-L281 HydrophobicContact CD2-CD2 4.07Å; Y278-L281 HydrophobicContact CE2-CD2 4.41Å; Y278-L281 WeakPolarHBondContact O-CB 3.43Å; Y278-R282 HydrophobicContact CD2-CG 4.42Å; Y278-R282 VanDerWaalsContact CE1-NE 3.29Å; Y278-R282 HydrophobicContact CE2-CG 4.05Å; Y278-R282 VanDerWaalsContact CZ-CD 3.44Å; Y278-R282 WeakPolarHBondContact O-CG 3.42Å; Y278-R282 PolarHBondContact O-N 3.1Å
279	T	98.7	Very high	97.7	Very high	2 Å²	2	39.5 Å²	39.5	1%	0.012	21%	0.205	C	C	.	.	H	α-helix	trans	-63.7	-48.3	170.9	-65.1	0	0	0	0	111.4	L275 F276 A277 L281 R282 S283 L335 I338 G339	L275-T279 PolarHBondContact O-N 3Å; L275-T279 PolarHBondContact O-OG1 3.18Å; F276-T279 PolarHBondContact O-N 3.33Å; A277-T279 VanDerWaalsContact C-N 3.32Å; A277-T279 PolarHBondContact O-N 3.35Å; T279-L281 VanDerWaalsContact C-N 3.29Å; T279-L281 PolarHBondContact O-N 3.12Å; T279-R282 PolarHBondContact O-N 3.12Å; T279-R282 VanDerWaalsContact O-N 3.08Å; T279-S283 PolarHBondContact O-N 3.43Å; T279-S283 PolarHBondContact O-OG 3.07Å; T279-L335 WeakPolarHBondContact CB-O 3.45Å; T279-L335 HydrophobicContact CG2-CD2 3.52Å; T279-L335 PolarHBondContact OG1-O 2.51Å; T279-I338 HydrophobicContact CG2-CB 4.01Å; T279-I338 HydrophobicContact CG2-CG2 3.61Å; T279-G339 WeakPolarHBondContact OG1-CA 3.4Å; T279-G339 PolarHBondContact OG1-N 2.86Å
280	I	98.8	Very high	97.8	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.01	19%	0.193	C	C	.	.	H	α-helix	trans	-58.5	-41.5	179	-66.8	171.5	0	0	0	111.5	F276 A277 R282 S283 A293 S297 L335 Y358 F359	F276-I280 PolarHBondContact O-N 3.01Å; A277-I280 PolarHBondContact O-N 3.23Å; I280-R282 PolarHBondContact O-N 3.42Å; I280-S283 PolarHBondContact O-N 3.19Å; I280-A293 HydrophobicContact CG2-CB 3.79Å; I280-S297 VanDerWaalsContact CD1-CB 3.47Å; I280-L335 HydrophobicContact CD1-CD1 4.05Å; I280-L335 HydrophobicContact CG1-CD1 4.21Å; I280-L335 HydrophobicContact CG1-CD2 4.13Å; I280-Y358 HydrophobicContact CD1-CD1 3.95Å; I280-Y358 HydrophobicContact CD1-CE1 4.28Å; I280-Y358 HydrophobicContact CD1-CG 4.29Å; I280-F359 HydrophobicContact CG2-CE2 3.88Å; I280-F359 HydrophobicContact CG2-CZ 4.35Å
281	L	98.4	Very high	97.9	Very high	18 Å²	18	36.8 Å²	36.8	9%	0.094	19%	0.193	C	C	.	.	H	α-helix	trans	-54.1	-51.9	172.6	171.1	65.4	0	0	0	111.9	L149 A277 Y278 T279 S283 G290 V291 L294	L149-L281 HydrophobicContact CD1-CD1 4.39Å; L149-L281 HydrophobicContact CD1-CD2 3.72Å; L149-L281 HydrophobicContact CD2-CD1 4.23Å; L149-L281 HydrophobicContact CD2-CD2 4.12Å; A277-L281 PolarHBondContact O-N 3.09Å; Y278-L281 HydrophobicContact CD2-CD2 4.07Å; Y278-L281 HydrophobicContact CE2-CD2 4.41Å; Y278-L281 WeakPolarHBondContact O-CB 3.43Å; T279-L281 VanDerWaalsContact C-N 3.29Å; T279-L281 PolarHBondContact O-N 3.12Å; L281-S283 VanDerWaalsContact C-N 3.31Å; L281-S283 PolarHBondContact O-N 2.98Å; L281-G290 WeakPolarHBondContact CD1-O 3.18Å; L281-G290 WeakPolarHBondContact O-CA 3.04Å; L281-V291 HydrophobicContact CD1-CG2 4.25Å; L281-L294 HydrophobicContact CB-CB 4.16Å; L281-L294 HydrophobicContact CB-CD1 3.93Å; L281-L294 HydrophobicContact CD2-CD1 4.09Å; L281-L294 HydrophobicContact CG-CD1 4.44Å
282	R	97.3	Very high	97.9	Very high	58 Å²	58	40 Å²	40	22%	0.219	21%	0.21	C	C	.	.	H	α-helix	trans	-74.6	-19.8	-174.9	-67.4	-173.8	-62.2	166.4	11.9	113.5	Y278 T279 I280 V284 I338 G339 Q341	Y278-R282 HydrophobicContact CD2-CG 4.42Å; Y278-R282 VanDerWaalsContact CE1-NE 3.29Å; Y278-R282 HydrophobicContact CE2-CG 4.05Å; Y278-R282 VanDerWaalsContact CZ-CD 3.44Å; Y278-R282 WeakPolarHBondContact O-CG 3.42Å; Y278-R282 PolarHBondContact O-N 3.1Å; T279-R282 PolarHBondContact O-N 3.12Å; T279-R282 VanDerWaalsContact O-N 3.08Å; I280-R282 PolarHBondContact O-N 3.42Å; R282-V284 VanDerWaalsContact C-N 3.26Å; R282-V284 PolarHBondContact O-N 2.69Å; R282-I338 PolarHBondContact NH2-O 2.97Å; R282-G339 VanDerWaalsContact NH2-CA 3.3Å; R282-G339 PolarHBondContact NH2-O 3.02Å; R282-Q341 PolarHBondContact NH1-O 3.42Å; R282-Q341 VanDerWaalsContact NH1-O 3.13Å
283	S	98	Very high	97.9	Very high	14 Å²	14	37.7 Å²	37.7	10%	0.098	21%	0.205	C	C	.	.	H	α-helix	trans	-67.4	-25.9	178.1	-67.6	0	0	0	0	113.3	T279 I280 L281 P285 G351 Q352 S355	T279-S283 PolarHBondContact O-N 3.43Å; T279-S283 PolarHBondContact O-OG 3.07Å; I280-S283 PolarHBondContact O-N 3.19Å; L281-S283 VanDerWaalsContact C-N 3.31Å; L281-S283 PolarHBondContact O-N 2.98Å; S283-P285 WeakPolarHBondContact O-CD 3.42Å; S283-G351 PolarHBondContact OG-O 2.92Å; S283-G351 VanDerWaalsContact OG-O 3.04Å; S283-Q352 WeakPolarHBondContact O-CG 3.22Å; S283-Q352 PolarHBondContact O-NE2 3.26Å; S283-Q352 PolarHBondContact OG-N 3.26Å; S283-S355 WeakPolarHBondContact CB-OG 3.24Å; S283-S355 PolarHBondContact OG-OG 2.91Å
284	V	98.1	Very high	97.9	Very high	54 Å²	54	39.3 Å²	39.3	33%	0.327	21%	0.214	S	C	.	.	S	Bend	trans	-93.6	116.9	-179.7	-175.5	0	0	0	0	109.7	R282 N286 A293	R282-V284 VanDerWaalsContact C-N 3.26Å; R282-V284 PolarHBondContact O-N 2.69Å; V284-N286 HydrophobicContact CG1-CB 4.25Å; V284-N286 PolarHBondContact O-N 3.03Å; V284-A293 HydrophobicContact CG2-CB 3.85Å
285	P	96.1	Very high	97.8	Very high	127 Å²	127	41.8 Å²	41.8	83%	0.825	23%	0.228	S	C	*	.	S	Bend	trans	-78.6	44.6	-178.5	34.7	-37.3	0	0	0	112.3	S283	S283-P285 WeakPolarHBondContact O-CD 3.42Å
286	N	97.5	Very high	97.8	Very high	95 Å²	95	45.4 Å²	45.4	51%	0.508	25%	0.247	S	C	.	.	S	Bend	trans	-151.3	130.4	176.3	180	-80.9	0	0	0	108.8	V284 L288 G289 G290	V284-N286 HydrophobicContact CG1-CB 4.25Å; V284-N286 PolarHBondContact O-N 3.03Å; N286-L288 PolarHBondContact O-N 2.99Å; N286-L288 PolarHBondContact OD1-N 2.92Å; N286-G289 PolarHBondContact O-N 2.93Å; N286-G289 PolarHBondContact OD1-N 2.99Å; N286-G290 PolarHBondContact O-N 3.21Å
287	K	94.4	Very high	97.8	Very high	100 Å²	100	44.4 Å²	44.4	44%	0.435	24%	0.243	S	C	.	.	H	α-helix	trans	-58.4	-53.1	-175.8	-166.1	-174.6	179.6	178.6	0	112.2	N148 S151 A152 G290 V291	N148-K287 WeakPolarHBondContact O-CE 3.49Å; N148-K287 PolarHBondContact O-NZ 3.31Å; S151-K287 PolarHBondContact OG-NZ 3.41Å; A152-K287 HydrophobicContact CB-CB 4.47Å; A152-K287 HydrophobicContact CB-CD 3.95Å; A152-K287 HydrophobicContact CB-CG 3.88Å; K287-G290 PolarHBondContact O-N 3.42Å; K287-V291 VanDerWaalsContact O-CG2 3.29Å; K287-V291 WeakPolarHBondContact O-CG2 3.24Å; K287-V291 PolarHBondContact O-N 3.47Å; K287-V291 VanDerWaalsContact O-N 3.08Å
288	L	96.8	Very high	97.8	Very high	61 Å²	61	44.9 Å²	44.9	32%	0.319	24%	0.244	S	C	.	.	H	α-helix	trans	-65	-45.1	179.7	176.6	60.4	0	0	0	111.3	A152 P154 N286 G290 V291 L292	A152-L288 HydrophobicContact CB-CB 4.29Å; A152-L288 HydrophobicContact CB-CD1 4.43Å; P154-L288 HydrophobicContact CG-CD2 4.44Å; N286-L288 PolarHBondContact O-N 2.99Å; N286-L288 PolarHBondContact OD1-N 2.92Å; L288-G290 VanDerWaalsContact C-N 3.33Å; L288-G290 PolarHBondContact O-N 3.14Å; L288-V291 PolarHBondContact O-N 3.35Å; L288-L292 HydrophobicContact CD1-CD1 4.24Å; L288-L292 HydrophobicContact CD1-CG 4.18Å; L288-L292 HydrophobicContact CG-CD1 4.12Å; L288-L292 HydrophobicContact CG-CG 4.48Å; L288-L292 WeakPolarHBondContact O-CG 3.45Å; L288-L292 PolarHBondContact O-N 2.99Å
289	G	98.2	Very high	97.8	Very high	22 Å²	22	46.5 Å²	46.5	23%	0.227	26%	0.255	C	S	.	.	H	α-helix	trans	-58.9	-42.5	178.1	0	0	0	0	0	112.8	N286 L292 A293	N286-G289 PolarHBondContact O-N 2.93Å; N286-G289 PolarHBondContact OD1-N 2.99Å; G289-L292 PolarHBondContact O-N 2.85Å; G289-A293 WeakPolarHBondContact O-CB 3.49Å; G289-A293 PolarHBondContact O-N 3.39Å
290	G	97.9	Very high	97.7	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-65.5	-41.3	175.4	0	0	0	0	0	112.7	L281 N286 K287 L288 A293 L294	L281-G290 WeakPolarHBondContact CD1-O 3.18Å; L281-G290 WeakPolarHBondContact O-CA 3.04Å; N286-G290 PolarHBondContact O-N 3.21Å; K287-G290 PolarHBondContact O-N 3.42Å; L288-G290 VanDerWaalsContact C-N 3.33Å; L288-G290 PolarHBondContact O-N 3.14Å; G290-A293 PolarHBondContact O-N 2.86Å; G290-L294 WeakPolarHBondContact O-CB 3.45Å; G290-L294 PolarHBondContact O-N 2.92Å
291	V	97.8	Very high	97.7	Very high	24 Å²	24	47.5 Å²	47.5	15%	0.145	26%	0.26	C	S	.	.	H	α-helix	trans	-62.6	-43.4	175.8	172.1	0	0	0	0	111.2	L149 A152 L281 K287 L288 L294 L295	L149-V291 HydrophobicContact CB-CG2 3.74Å; L149-V291 HydrophobicContact CD2-CG2 4.01Å; L149-V291 HydrophobicContact CG-CG2 4.31Å; A152-V291 HydrophobicContact CB-CG2 4.3Å; L281-V291 HydrophobicContact CD1-CG2 4.25Å; K287-V291 VanDerWaalsContact O-CG2 3.29Å; K287-V291 WeakPolarHBondContact O-CG2 3.24Å; K287-V291 PolarHBondContact O-N 3.47Å; K287-V291 VanDerWaalsContact O-N 3.08Å; L288-V291 PolarHBondContact O-N 3.35Å; V291-L294 PolarHBondContact O-N 3.31Å; V291-L295 PolarHBondContact O-N 2.72Å
292	L	98.1	Very high	97.7	Very high	89 Å²	89	48.6 Å²	48.6	47%	0.466	27%	0.272	S	S	.	.	H	α-helix	trans	-63.6	-42.9	174.4	-68	174.5	0	0	0	111.5	L288 G289 L294 L295 L296	L288-L292 HydrophobicContact CD1-CD1 4.24Å; L288-L292 HydrophobicContact CD1-CG 4.18Å; L288-L292 HydrophobicContact CG-CD1 4.12Å; L288-L292 HydrophobicContact CG-CG 4.48Å; L288-L292 WeakPolarHBondContact O-CG 3.45Å; L288-L292 PolarHBondContact O-N 2.99Å; G289-L292 PolarHBondContact O-N 2.85Å; L292-L294 PolarHBondContact O-N 3.42Å; L292-L295 PolarHBondContact O-N 3.36Å; L292-L296 VanDerWaalsContact O-CB 3.3Å; L292-L296 WeakPolarHBondContact O-CB 3.35Å; L292-L296 WeakPolarHBondContact O-CG 3.39Å; L292-L296 PolarHBondContact O-N 3.39Å
293	A	98.4	Very high	97.7	Very high	13 Å²	13	49.9 Å²	49.9	11%	0.107	28%	0.281	C	S	.	.	H	α-helix	trans	-62.9	-41.5	178.1	0	0	0	0	0	112.4	I280 V284 G289 G290 L296 S297	I280-A293 HydrophobicContact CG2-CB 3.79Å; V284-A293 HydrophobicContact CG2-CB 3.85Å; G289-A293 WeakPolarHBondContact O-CB 3.49Å; G289-A293 PolarHBondContact O-N 3.39Å; G290-A293 PolarHBondContact O-N 2.86Å; A293-L296 PolarHBondContact O-N 2.95Å; A293-S297 PolarHBondContact O-N 3.03Å
294	L	97.9	Very high	97.7	Very high	43 Å²	43	49.9 Å²	49.9	23%	0.225	28%	0.28	C	S	.	.	H	α-helix	trans	-60.3	-49.1	173.5	175.2	148.1	0	0	0	111.3	A277 L281 G290 V291 L292 L296 S297	A277-L294 HydrophobicContact CB-CD1 4.48Å; A277-L294 HydrophobicContact CB-CG 4.3Å; L281-L294 HydrophobicContact CB-CB 4.16Å; L281-L294 HydrophobicContact CB-CD1 3.93Å; L281-L294 HydrophobicContact CD2-CD1 4.09Å; L281-L294 HydrophobicContact CG-CD1 4.44Å; G290-L294 WeakPolarHBondContact O-CB 3.45Å; G290-L294 PolarHBondContact O-N 2.92Å; V291-L294 PolarHBondContact O-N 3.31Å; L292-L294 PolarHBondContact O-N 3.42Å; L294-L296 VanDerWaalsContact C-N 3.33Å; L294-L296 PolarHBondContact O-N 3.38Å; L294-S297 PolarHBondContact O-N 3.41Å; L294-S297 PolarHBondContact O-OG 2.97Å
295	L	97.3	Very high	97.7	Very high	82 Å²	82	48.9 Å²	48.9	43%	0.429	28%	0.275	S	S	.	.	H	α-helix	trans	-61.3	-45.6	179.5	-177.3	65.8	0	0	0	110.7	V291 L292 S297 I298 L299	V291-L295 PolarHBondContact O-N 2.72Å; L292-L295 PolarHBondContact O-N 3.36Å; L295-S297 VanDerWaalsContact C-N 3.29Å; L295-S297 PolarHBondContact O-N 3.03Å; L295-I298 PolarHBondContact O-N 3.34Å; L295-L299 HydrophobicContact CD1-CD1 3.93Å; L295-L299 HydrophobicContact CD1-CG 4.17Å; L295-L299 HydrophobicContact CD2-CD1 4.06Å; L295-L299 HydrophobicContact CG-CD1 3.68Å; L295-L299 HydrophobicContact CG-CG 4.18Å; L295-L299 WeakPolarHBondContact O-CG 3.5Å; L295-L299 PolarHBondContact O-N 3.08Å
296	L	98.3	Very high	97.8	Very high	93 Å²	93	48.4 Å²	48.4	49%	0.487	26%	0.264	S	S	.	.	H	α-helix	trans	-65	-29.7	178.1	-71.1	172.3	0	0	0	112.7	L292 A293 L294 I298 L299 I300 F359	L292-L296 VanDerWaalsContact O-CB 3.3Å; L292-L296 WeakPolarHBondContact O-CB 3.35Å; L292-L296 WeakPolarHBondContact O-CG 3.39Å; L292-L296 PolarHBondContact O-N 3.39Å; A293-L296 PolarHBondContact O-N 2.95Å; L294-L296 VanDerWaalsContact C-N 3.33Å; L294-L296 PolarHBondContact O-N 3.38Å; L296-I298 PolarHBondContact O-N 3.23Å; L296-I298 VanDerWaalsContact O-N 3.14Å; L296-L299 PolarHBondContact O-N 2.93Å; L296-I300 WeakPolarHBondContact O-CB 3.44Å; L296-I300 WeakPolarHBondContact O-CG2 3.15Å; L296-I300 PolarHBondContact O-N 3.2Å; L296-F359 HydrophobicContact CB-CE1 4.17Å; L296-F359 HydrophobicContact CB-CZ 4.28Å
297	S	98.4	Very high	97.8	Very high	2 Å²	2	45.5 Å²	45.5	1%	0.014	25%	0.248	C	C	.	.	H	α-helix	trans	-63.8	-18	176.1	75.5	0	0	0	0	113.9	I280 A293 L294 L295 Y358	I280-S297 VanDerWaalsContact CD1-CB 3.47Å; A293-S297 PolarHBondContact O-N 3.03Å; L294-S297 PolarHBondContact O-N 3.41Å; L294-S297 PolarHBondContact O-OG 2.97Å; L295-S297 VanDerWaalsContact C-N 3.29Å; L295-S297 PolarHBondContact O-N 3.03Å; S297-Y358 PolarHBondContact O-OH 3.31Å
298	I	98.4	Very high	97.9	Very high	13 Å²	13	42.7 Å²	42.7	7%	0.067	24%	0.237	C	C	.	.	H	α-helix	trans	-101.8	-47.4	174.7	-53.8	161.5	0	0	0	109.3	L120 L121 M124 L295 L296 I300 L301	L120-I298 HydrophobicContact CD2-CG2 3.89Å; L121-I298 HydrophobicContact CD2-CD1 4.48Å; L121-I298 HydrophobicContact CD2-CG2 3.78Å; L121-I298 HydrophobicContact CG-CG2 4.44Å; M124-I298 HydrophobicContact CE-CD1 3.42Å; M124-I298 VanDerWaalsContact CE-CD1 3.42Å; M124-I298 HydrophobicContact CE-CG1 4.17Å; M124-I298 HydrophobicContact SD-CD1 3.86Å; M124-I298 HydrophobicContact SD-CG1 4.44Å; M124-I298 HydrophobicContact SD-CG2 4.4Å; L295-I298 PolarHBondContact O-N 3.34Å; L296-I298 PolarHBondContact O-N 3.23Å; L296-I298 VanDerWaalsContact O-N 3.14Å; I298-I300 PolarHBondContact O-N 3.14Å; I298-L301 WeakPolarHBondContact O-CB 3.29Å; I298-L301 WeakPolarHBondContact O-CG 3.42Å; I298-L301 PolarHBondContact O-N 2.58Å; I298-L301 VanDerWaalsContact O-N 3.16Å
299	L	98.2	Very high	98	Very high	64 Å²	64	43.9 Å²	43.9	34%	0.335	24%	0.242	S	C	.	.	H	α-helix	trans	-67.4	-17	-177.5	-65.4	-173.3	0	0	0	113.8	L121 L295 L296 L301 A302	L121-L299 HydrophobicContact CD1-CD2 4.16Å; L295-L299 HydrophobicContact CD1-CD1 3.93Å; L295-L299 HydrophobicContact CD1-CG 4.17Å; L295-L299 HydrophobicContact CD2-CD1 4.06Å; L295-L299 HydrophobicContact CG-CD1 3.68Å; L295-L299 HydrophobicContact CG-CG 4.18Å; L295-L299 WeakPolarHBondContact O-CG 3.5Å; L295-L299 PolarHBondContact O-N 3.08Å; L296-L299 PolarHBondContact O-N 2.93Å; L299-L301 PolarHBondContact O-N 3.31Å; L299-L301 VanDerWaalsContact O-N 3.12Å; L299-A302 WeakPolarHBondContact O-CB 3.44Å; L299-A302 PolarHBondContact O-N 2.88Å
300	I	98.5	Very high	98	Very high	8 Å²	8	43.3 Å²	43.3	4%	0.041	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-57.1	-25	172.1	-166.6	167.2	0	0	0	112.6	L296 I298 A302 M303 Y358 F359 I362 L363	L296-I300 WeakPolarHBondContact O-CB 3.44Å; L296-I300 WeakPolarHBondContact O-CG2 3.15Å; L296-I300 PolarHBondContact O-N 3.2Å; I298-I300 PolarHBondContact O-N 3.14Å; I300-A302 PolarHBondContact O-N 2.8Å; I300-M303 WeakPolarHBondContact O-CB 3.38Å; I300-M303 PolarHBondContact O-N 3.39Å; I300-Y358 HydrophobicContact CG2-CE1 4.12Å; I300-Y358 VanDerWaalsContact CG2-OH 3.26Å; I300-Y358 WeakPolarHBondContact CG2-OH 3.31Å; I300-F359 HydrophobicContact CD1-CD1 3.72Å; I300-F359 HydrophobicContact CD1-CE1 4.08Å; I300-I362 HydrophobicContact CD1-CB 3.8Å; I300-I362 HydrophobicContact CD1-CD1 3.97Å; I300-I362 HydrophobicContact CD1-CG2 3.55Å; I300-I362 HydrophobicContact CG1-CG2 3.77Å; I300-I362 HydrophobicContact CG2-CD1 4.29Å; I300-L363 HydrophobicContact CD1-CD1 4.42Å; I300-L363 HydrophobicContact CD1-CD2 3.74Å; I300-L363 HydrophobicContact CD1-CG 3.87Å; I300-L363 HydrophobicContact CG1-CD2 4.08Å
301	L	98.6	Very high	98	Very high	17 Å²	17	49.6 Å²	49.6	9%	0.089	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-57.1	-32.3	173.1	-67.5	175.5	0	0	0	112.4	I98 L102 W113 I117 L120 I298 L299 M303 I304	I98-L301 HydrophobicContact CG2-CD1 4.44Å; I98-L301 HydrophobicContact CG2-CD2 4.14Å; L102-L301 HydrophobicContact CD2-CD2 4.45Å; W113-L301 HydrophobicContact CH2-CD2 4.43Å; W113-L301 HydrophobicContact CZ2-CB 4.19Å; W113-L301 HydrophobicContact CZ2-CD2 4Å; W113-L301 PolarHBondContact NE1-O 3.45Å; I117-L301 HydrophobicContact CD1-CB 3.82Å; I117-L301 HydrophobicContact CG1-CB 3.95Å; L120-L301 HydrophobicContact CD2-CD1 3.74Å; I298-L301 WeakPolarHBondContact O-CB 3.29Å; I298-L301 WeakPolarHBondContact O-CG 3.42Å; I298-L301 PolarHBondContact O-N 2.58Å; I298-L301 VanDerWaalsContact O-N 3.16Å; L299-L301 PolarHBondContact O-N 3.31Å; L299-L301 VanDerWaalsContact O-N 3.12Å; L301-M303 PolarHBondContact O-N 2.83Å; L301-I304 WeakPolarHBondContact O-CB 3.43Å; L301-I304 WeakPolarHBondContact O-CG1 3.29Å; L301-I304 PolarHBondContact O-N 3.01Å
302	A	98.1	Very high	98	Very high	41 Å²	41	50.5 Å²	50.5	34%	0.339	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-70.6	-21.7	177.3	0	0	0	0	0	112.7	I117 L299 I300 P305	I117-A302 HydrophobicContact CD1-CB 3.9Å; L299-A302 WeakPolarHBondContact O-CB 3.44Å; L299-A302 PolarHBondContact O-N 2.88Å; I300-A302 PolarHBondContact O-N 2.8Å; A302-P305 WeakPolarHBondContact O-CD 3.48Å
303	M	97.5	Very high	98	Very high	86 Å²	86	48.2 Å²	48.2	42%	0.424	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-81.4	-20.2	176.7	-61.3	-60.4	-66.1	0	0	112.5	I300 L301 I306 L307	I300-M303 WeakPolarHBondContact O-CB 3.38Å; I300-M303 PolarHBondContact O-N 3.39Å; L301-M303 PolarHBondContact O-N 2.83Å; M303-I306 WeakPolarHBondContact O-CB 3.39Å; M303-I306 PolarHBondContact O-N 3.44Å; M303-I306 HydrophobicContact SD-CD1 4.47Å; M303-L307 HydrophobicContact CB-CD1 3.97Å; M303-L307 HydrophobicContact CB-CG 4.44Å; M303-L307 WeakPolarHBondContact O-CG 3.45Å; M303-L307 PolarHBondContact O-N 3.01Å
304	I	98.1	Very high	97.9	Very high	14 Å²	14	47.7 Å²	47.7	7%	0.072	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-45.7	-173.9	-60	-68.1	0	0	0	113.4	L102 F107 L301 I306 L307 H308 I362	L102-I304 HydrophobicContact CD2-CB 4.48Å; L102-I304 HydrophobicContact CD2-CD1 4.23Å; L102-I304 HydrophobicContact CD2-CG1 4.02Å; L102-I304 HydrophobicContact CD2-CG2 3.87Å; F107-I304 HydrophobicContact CB-CG2 4.29Å; F107-I304 HydrophobicContact CD1-CG2 3.45Å; F107-I304 VanDerWaalsContact CD1-CG2 3.45Å; F107-I304 HydrophobicContact CD2-CG2 3.79Å; F107-I304 HydrophobicContact CE1-CG2 3.56Å; F107-I304 HydrophobicContact CE2-CG2 3.93Å; F107-I304 HydrophobicContact CG-CG2 3.56Å; F107-I304 HydrophobicContact CZ-CG2 3.81Å; L301-I304 WeakPolarHBondContact O-CB 3.43Å; L301-I304 WeakPolarHBondContact O-CG1 3.29Å; L301-I304 PolarHBondContact O-N 3.01Å; I304-I306 PolarHBondContact O-N 3.37Å; I304-L307 PolarHBondContact O-N 3.48Å; I304-H308 PolarHBondContact O-N 3.22Å; I304-I362 HydrophobicContact CD1-CG2 3.44Å; I304-I362 VanDerWaalsContact CD1-CG2 3.44Å
305	P	97.5	Very high	98	Very high	33 Å²	33	46.3 Å²	46.3	21%	0.214	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-35.4	178	-23.4	34.6	0	0	0	113.1	F107 A302 H308	F107-P305 HydrophobicContact CB-CG 4.34Å; F107-P305 HydrophobicContact CD2-CB 4.35Å; F107-P305 HydrophobicContact CD2-CG 4.26Å; F107-P305 WeakPolarHBondContact O-CG 3.48Å; A302-P305 WeakPolarHBondContact O-CD 3.48Å; P305-H308 WeakPolarHBondContact O-CB 3.49Å; P305-H308 PolarHBondContact O-N 3.3Å
306	I	97.1	Very high	98	Very high	117 Å²	117	46.2 Å²	46.2	60%	0.6	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-31.6	-179.1	-54.3	170.9	0	0	0	110.9	M303 I304 H308	M303-I306 WeakPolarHBondContact O-CB 3.39Å; M303-I306 PolarHBondContact O-N 3.44Å; M303-I306 HydrophobicContact SD-CD1 4.47Å; I304-I306 PolarHBondContact O-N 3.37Å; I306-H308 PolarHBondContact O-N 3.12Å
307	L	97.6	Very high	98	Very high	34 Å²	34	47 Å²	47	18%	0.178	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-3.6	178.4	-63.7	169.3	0	0	0	113.1	M303 I304 M309 I362 L363	M303-L307 HydrophobicContact CB-CD1 3.97Å; M303-L307 HydrophobicContact CB-CG 4.44Å; M303-L307 WeakPolarHBondContact O-CG 3.45Å; M303-L307 PolarHBondContact O-N 3.01Å; I304-L307 PolarHBondContact O-N 3.48Å; L307-M309 PolarHBondContact O-N 2.95Å; L307-M309 VanDerWaalsContact O-N 3.14Å; L307-I362 HydrophobicContact CD1-CG2 4.13Å; L307-L363 HydrophobicContact CD1-CD2 3.87Å
308	H	98	Very high	98	Very high	41 Å²	41	47.1 Å²	47.1	19%	0.19	24%	0.237	C	C	.	.			trans	-76	102.8	-179.2	-172.2	77.7	0	0	0	112	F107 L108 I304 P305 I306 S310 Q312	F107-H308 HydrophobicContact CE2-CB 3.83Å; F107-H308 AromaticContact CE2-CG 3.94Å; F107-H308 AromaticContact CE2-ND1 3.81Å; F107-H308 HydrophobicContact CZ-CB 4.33Å; F107-H308 AromaticContact CZ-ND1 3.61Å; L108-H308 HydrophobicContact CD2-CB 4.27Å; I304-H308 PolarHBondContact O-N 3.22Å; P305-H308 WeakPolarHBondContact O-CB 3.49Å; P305-H308 PolarHBondContact O-N 3.3Å; I306-H308 PolarHBondContact O-N 3.12Å; H308-S310 PolarHBondContact NE2-O 3.27Å; H308-Q312 PolarHBondContact CE1-O 3.41Å
309	M	97.7	Very high	98	Very high	86 Å²	86	50.9 Å²	50.9	42%	0.424	26%	0.262	S	S	.	.			trans	-104	-5.3	-178.9	-61.3	-64.1	171	0	0	114	L307 P367 L371 N374	L307-M309 PolarHBondContact O-N 2.95Å; L307-M309 VanDerWaalsContact O-N 3.14Å; M309-P367 HydrophobicContact CG-CB 3.94Å; M309-L371 HydrophobicContact CB-CD2 3.82Å; M309-L371 HydrophobicContact CB-CG 3.87Å; M309-L371 HydrophobicContact CG-CD2 4.44Å; M309-L371 HydrophobicContact CG-CG 4.36Å; M309-N374 PolarHBondContact O-ND2 2.82Å
310	S	98.1	Very high	98	Very high	9 Å²	9	51 Å²	51	6%	0.063	26%	0.263	C	S	.	.			trans	-75.5	147.6	-178.4	172.3	0	0	0	0	111.4	H308 Q312 R318	H308-S310 PolarHBondContact NE2-O 3.27Å; S310-Q312 VanDerWaalsContact C-N 3.33Å; S310-Q312 WeakPolarHBondContact CB-O 3.25Å; S310-Q312 PolarHBondContact OG-N 3.37Å; S310-Q312 PolarHBondContact OG-O 3.48Å; S310-R318 WeakPolarHBondContact OG-CD 3.4Å; S310-R318 PolarHBondContact OG-NE 3.34Å; S310-R318 PolarHBondContact OG-NH1 2.91Å
311	K	97.8	Very high	98	Very high	133 Å²	133	50.7 Å²	50.7	58%	0.578	26%	0.261	S	S	*	.	S	Bend	trans	-83.9	-11.1	168.8	-52.4	-72.1	-173	172.5	0	112.7	N374 W379 A380	K311-N374 PolarHBondContact N-OD1 3.26Å; K311-W379 HydrophobicContact CB-CD2 4.02Å; K311-W379 HydrophobicContact CB-CE3 3.45Å; K311-W379 VanDerWaalsContact CB-CE3 3.45Å; K311-W379 HydrophobicContact CB-CH2 4.39Å; K311-W379 HydrophobicContact CB-CZ3 3.67Å; K311-W379 HydrophobicContact CG-CB 4.22Å; K311-W379 HydrophobicContact CG-CD2 4.18Å; K311-W379 HydrophobicContact CG-CE3 3.83Å; K311-W379 HydrophobicContact CG-CG 4.41Å; K311-A380 WeakPolarHBondContact CE-O 3.05Å; K311-A380 PolarHBondContact NZ-O 3.3Å
312	Q	98	Very high	98	Very high	42 Å²	42	52.4 Å²	52.4	20%	0.196	27%	0.269	C	S	.	.	S	Bend	trans	-99.9	130.4	169.7	-78.5	161.1	-25	0	0	110.5	H308 S310 R318 W379	H308-Q312 PolarHBondContact CE1-O 3.41Å; S310-Q312 VanDerWaalsContact C-N 3.33Å; S310-Q312 WeakPolarHBondContact CB-O 3.25Å; S310-Q312 PolarHBondContact OG-N 3.37Å; S310-Q312 PolarHBondContact OG-O 3.48Å; Q312-R318 HydrophobicContact CB-CG 4.44Å; Q312-R318 PolarHBondContact O-NH1 2.97Å; Q312-W379 HydrophobicContact CB-CZ3 4.46Å; Q312-W379 HydrophobicContact CG-CH2 3.44Å; Q312-W379 VanDerWaalsContact CG-CH2 3.44Å; Q312-W379 HydrophobicContact CG-CZ3 3.6Å
313	Q	97.7	Very high	98	Very high	41 Å²	41	53.7 Å²	53.7	19%	0.192	28%	0.276	C	S	.	.	S	Bend	trans	-65.9	-55.2	177.8	175.5	168.8	3.2	0	0	112.2	G105 L108 N206	G105-Q313 PolarHBondContact O-NE2 3.2Å; L108-Q313 HydrophobicContact CD1-CB 4.15Å; L108-Q313 HydrophobicContact CD1-CG 3.73Å; N206-Q313 PolarHBondContact ND2-NE2 2.86Å
314	S	98.2	Very high	98.1	Very high	3 Å²	3	50.4 Å²	50.4	2%	0.021	26%	0.26	C	S	.	.	S	Bend	trans	-83.4	148	-177.2	174.9	0	0	0	0	112.4	Y104 P208 M316 R318	Y104-S314 WeakPolarHBondContact CD1-OG 3.35Å; P208-S314 WeakPolarHBondContact O-CB 3.38Å; P208-S314 PolarHBondContact O-OG 3.23Å; S314-M316 PolarHBondContact O-N 3.44Å; S314-M316 WeakPolarHBondContact OG-CB 3.37Å; S314-M316 PolarHBondContact OG-N 3.39Å; S314-M316 VanDerWaalsContact OG-N 3.07Å; S314-R318 WeakPolarHBondContact O-CD 3.32Å
315	M	98.6	Very high	98.1	Very high	14 Å²	14	51.1 Å²	51.1	7%	0.069	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-75.3	-5.5	170.2	-64.5	-175.7	-174	0	0	113.5	Y103 F317 R318 Q322 Y325	Y103-M315 HydrophobicContact CD2-CB 4.29Å; Y103-M315 HydrophobicContact CD2-SD 4.3Å; Y103-M315 HydrophobicContact CE1-CB 4.42Å; Y103-M315 HydrophobicContact CE2-CB 4.2Å; Y103-M315 HydrophobicContact CG-CB 4.47Å; Y103-M315 VanDerWaalsContact O-CB 3.3Å; Y103-M315 WeakPolarHBondContact O-CB 3.34Å; Y103-M315 WeakPolarHBondContact O-CG 3.45Å; Y103-M315 PolarHBondContact O-N 2.9Å; M315-F317 PolarHBondContact O-N 3.07Å; M315-R318 PolarHBondContact O-N 3.5Å; M315-Q322 HydrophobicContact CB-CG 4.17Å; M315-Q322 VanDerWaalsContact O-CG 3.25Å; M315-Q322 WeakPolarHBondContact O-CG 3.35Å; M315-Q322 PolarHBondContact O-NE2 3.47Å; M315-Y325 HydrophobicContact SD-CG 4.41Å
316	M	97.9	Very high	98.2	Very high	79 Å²	79	56.5 Å²	56.5	39%	0.389	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-52.4	-32.5	-176.4	-178	166	178.6	0	0	114.3	P208 L209 S314 Q322	P208-M316 HydrophobicContact CB-SD 4.28Å; L209-M316 HydrophobicContact CD2-CE 3.84Å; L209-M316 HydrophobicContact CD2-SD 3.69Å; S314-M316 PolarHBondContact O-N 3.44Å; S314-M316 WeakPolarHBondContact OG-CB 3.37Å; S314-M316 PolarHBondContact OG-N 3.39Å; S314-M316 VanDerWaalsContact OG-N 3.07Å; M316-Q322 PolarHBondContact O-NE2 2.88Å
317	F	98	Very high	98.2	Very high	110 Å²	110	54.3 Å²	54.3	48%	0.482	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-109.7	19.3	179.3	-55.5	-62.5	0	0	0	113.7	L209 M315	L209-F317 HydrophobicContact CD2-CE2 4.03Å; L209-F317 HydrophobicContact CD2-CZ 3.65Å; M315-F317 PolarHBondContact O-N 3.07Å
318	R	98.4	Very high	98.3	Very high	5 Å²	5	53.1 Å²	53.1	2%	0.019	26%	0.261	C	S	.	.			trans	-126.7	76.9	-171.4	-69.3	174.9	55.8	-164.8	-0.5	110.9	S310 Q312 S314 M315 L320 S321 Q322 S370 E373	S310-R318 WeakPolarHBondContact OG-CD 3.4Å; S310-R318 PolarHBondContact OG-NE 3.34Å; S310-R318 PolarHBondContact OG-NH1 2.91Å; Q312-R318 HydrophobicContact CB-CG 4.44Å; Q312-R318 PolarHBondContact O-NH1 2.97Å; S314-R318 WeakPolarHBondContact O-CD 3.32Å; M315-R318 PolarHBondContact O-N 3.5Å; R318-L320 VanDerWaalsContact C-N 3.3Å; R318-L320 PolarHBondContact O-N 3.08Å; R318-S321 PolarHBondContact NE-OG 3.13Å; R318-S321 PolarHBondContact NH2-OG 2.93Å; R318-S321 PolarHBondContact O-N 2.84Å; R318-S321 VanDerWaalsContact O-N 3.14Å; R318-Q322 WeakPolarHBondContact O-CG 3.38Å; R318-Q322 PolarHBondContact O-N 3.47Å; R318-S370 PolarHBondContact NH2-OG 2.74Å; R318-E373 WeakPolarHBondContact CA-OE1 3.37Å; R318-E373 WeakPolarHBondContact CB-OE1 3.49Å; R318-E373 WeakPolarHBondContact CB-OE2 3.22Å; R318-E373 IonicContact CZ-OE2 3.43Å; R318-E373 IonicContact NE-OE2 2.99Å; R318-E373 PolarHBondContact NE-OE2 3.45Å; R318-E373 IonicContact NH2-OE2 2.85Å; R318-E373 PolarHBondContact NH2-OE2 3.3Å
319	P	98.3	Very high	98.3	Very high	92 Å²	92	52.6 Å²	52.6	60%	0.597	26%	0.263	S	S	*	.	H	α-helix	trans	-62.2	-33.8	-168.1	23.9	-34.1	0	0	0	113.5	Q322 S323	P319-Q322 PolarHBondContact O-N 3.4Å; P319-S323 PolarHBondContact O-N 3.38Å; P319-S323 VanDerWaalsContact O-N 3.11Å
320	L	98.5	Very high	98.4	Very high	65 Å²	65	50.7 Å²	50.7	34%	0.34	26%	0.261	S	S	.	.	H	α-helix	trans	-69.5	-43.2	177.3	-60	177.6	0	0	0	109.9	R318 Q322 S323 L324 I369 I372 E373 M376	R318-L320 VanDerWaalsContact C-N 3.3Å; R318-L320 PolarHBondContact O-N 3.08Å; L320-Q322 VanDerWaalsContact C-N 3.34Å; L320-Q322 PolarHBondContact O-N 3.04Å; L320-S323 PolarHBondContact O-N 3.02Å; L320-S323 PolarHBondContact O-OG 3.43Å; L320-L324 PolarHBondContact O-N 3.23Å; L320-L324 VanDerWaalsContact O-N 3.12Å; L320-I369 HydrophobicContact CB-CG2 3.44Å; L320-I369 VanDerWaalsContact CB-CG2 3.44Å; L320-I369 HydrophobicContact CD1-CD1 4.4Å; L320-I369 HydrophobicContact CD1-CG2 4.46Å; L320-I372 HydrophobicContact CD1-CG2 4.47Å; L320-E373 HydrophobicContact CB-CG 4.27Å; L320-E373 WeakPolarHBondContact CB-OE1 3.42Å; L320-E373 HydrophobicContact CD1-CG 4.22Å; L320-E373 PolarHBondContact N-OE1 3.2Å; L320-E373 VanDerWaalsContact N-OE1 3.08Å; L320-M376 HydrophobicContact CD1-SD 4.08Å
321	S	98.6	Very high	98.4	Very high	2 Å²	2	50.4 Å²	50.4	1%	0.014	26%	0.259	C	S	.	.	H	α-helix	trans	-64.1	-35.7	174.7	-63.4	0	0	0	0	113.1	R318 S323 L324 Y325 E373	R318-S321 PolarHBondContact NE-OG 3.13Å; R318-S321 PolarHBondContact NH2-OG 2.93Å; R318-S321 PolarHBondContact O-N 2.84Å; R318-S321 VanDerWaalsContact O-N 3.14Å; S321-S323 VanDerWaalsContact C-N 3.34Å; S321-S323 PolarHBondContact O-N 3.36Å; S321-L324 PolarHBondContact O-N 3.49Å; S321-Y325 PolarHBondContact O-N 3.45Å; S321-E373 PolarHBondContact N-OE1 3.02Å; S321-E373 PolarHBondContact OG-OE1 3.25Å; S321-E373 PolarHBondContact OG-OE2 3.33Å
322	Q	98.8	Very high	98.5	Very high	53 Å²	53	46.7 Å²	46.7	25%	0.248	25%	0.245	C	C	.	.	H	α-helix	trans	-60.7	-43.7	172.7	-69.4	178.8	36.7	0	0	111.7	Y103 M315 M316 R318 P319 L320 L324 Y325 W326	Y103-Q322 HydrophobicContact CE2-CG 3.95Å; Y103-Q322 WeakPolarHBondContact OH-CG 3.05Å; Y103-Q322 PolarHBondContact OH-OE1 3.35Å; M315-Q322 HydrophobicContact CB-CG 4.17Å; M315-Q322 VanDerWaalsContact O-CG 3.25Å; M315-Q322 WeakPolarHBondContact O-CG 3.35Å; M315-Q322 PolarHBondContact O-NE2 3.47Å; M316-Q322 PolarHBondContact O-NE2 2.88Å; R318-Q322 WeakPolarHBondContact O-CG 3.38Å; R318-Q322 PolarHBondContact O-N 3.47Å; P319-Q322 PolarHBondContact O-N 3.4Å; L320-Q322 VanDerWaalsContact C-N 3.34Å; L320-Q322 PolarHBondContact O-N 3.04Å; Q322-L324 VanDerWaalsContact C-N 3.32Å; Q322-L324 PolarHBondContact O-N 2.96Å; Q322-Y325 PolarHBondContact O-N 3.46Å; Q322-W326 PolarHBondContact O-N 3.28Å
323	S	98.5	Very high	98.5	Very high	69 Å²	69	50.7 Å²	50.7	48%	0.483	27%	0.268	S	S	.	.	H	α-helix	trans	-61.7	-40.8	177.4	75.7	0	0	0	0	111.8	P319 L320 S321 W326 L327	P319-S323 PolarHBondContact O-N 3.38Å; P319-S323 VanDerWaalsContact O-N 3.11Å; L320-S323 PolarHBondContact O-N 3.02Å; L320-S323 PolarHBondContact O-OG 3.43Å; S321-S323 VanDerWaalsContact C-N 3.34Å; S321-S323 PolarHBondContact O-N 3.36Å; S323-W326 PolarHBondContact O-N 2.81Å; S323-L327 WeakPolarHBondContact O-CB 2.93Å; S323-L327 PolarHBondContact O-N 2.86Å
324	L	98.5	Very high	98.6	Very high	17 Å²	17	52 Å²	52	9%	0.089	28%	0.275	C	S	.	.	H	α-helix	trans	-68	-36.6	175.1	-73.5	-173.1	0	0	0	113.2	L320 S321 Q322 L327 L328 L365 M366 I369	L320-L324 PolarHBondContact O-N 3.23Å; L320-L324 VanDerWaalsContact O-N 3.12Å; S321-L324 PolarHBondContact O-N 3.49Å; Q322-L324 VanDerWaalsContact C-N 3.32Å; Q322-L324 PolarHBondContact O-N 2.96Å; L324-L327 HydrophobicContact CD2-CD2 4.1Å; L324-L327 PolarHBondContact O-N 3.17Å; L324-L328 WeakPolarHBondContact O-CB 3.5Å; L324-L328 PolarHBondContact O-N 3.06Å; L324-L365 HydrophobicContact CD1-CB 3.76Å; L324-L365 HydrophobicContact CD2-CB 4.19Å; L324-L365 HydrophobicContact CD2-CD1 4.22Å; L324-M366 HydrophobicContact CD1-CG 4.3Å; L324-I369 HydrophobicContact CD1-CB 3.87Å; L324-I369 HydrophobicContact CD1-CG1 3.56Å; L324-I369 HydrophobicContact CD1-CG2 4.31Å; L324-I369 HydrophobicContact CG-CG1 4.45Å
325	Y	98.8	Very high	98.6	Very high	29 Å²	29	51.9 Å²	51.9	11%	0.114	27%	0.274	C	S	.	.	H	α-helix	trans	-61	-45.9	174.1	170.7	-91.2	0	0	0	111.3	G99 L102 Y103 M315 S321 Q322 L328 A329	G99-Y325 WeakPolarHBondContact O-CE2 3.34Å; G99-Y325 PolarHBondContact O-OH 3.08Å; L102-Y325 HydrophobicContact CB-CE2 4.25Å; Y103-Y325 AromaticContact CD2-CD1 3.52Å; Y103-Y325 HydrophobicContact CD2-CD1 3.52Å; Y103-Y325 HydrophobicContact CD2-CD2 4.05Å; Y103-Y325 AromaticContact CD2-CE1 3.75Å; Y103-Y325 HydrophobicContact CD2-CE1 3.75Å; Y103-Y325 HydrophobicContact CD2-CE2 4.25Å; Y103-Y325 AromaticContact CD2-CG 3.68Å; Y103-Y325 HydrophobicContact CD2-CG 3.68Å; Y103-Y325 HydrophobicContact CE2-CD1 4.05Å; Y103-Y325 HydrophobicContact CE2-CE1 4.47Å; Y103-Y325 HydrophobicContact CE2-CG 4.41Å; M315-Y325 HydrophobicContact SD-CG 4.41Å; S321-Y325 PolarHBondContact O-N 3.45Å; Q322-Y325 PolarHBondContact O-N 3.46Å; Y325-L328 WeakPolarHBondContact O-CB 3.08Å; Y325-L328 PolarHBondContact O-N 3.1Å; Y325-A329 PolarHBondContact O-N 3.28Å
326	W	98.8	Very high	98.6	Very high	145 Å²	145	52.9 Å²	52.9	55%	0.549	28%	0.281	S	S	.	.	H	α-helix	trans	-71.5	-31.6	178.2	-71.4	116.7	0	0	0	112.8	Q322 S323 A329 A330	Q322-W326 PolarHBondContact O-N 3.28Å; S323-W326 PolarHBondContact O-N 2.81Å; W326-A329 HydrophobicContact CE3-CB 4.11Å; W326-A329 PolarHBondContact O-N 2.81Å; W326-A330 WeakPolarHBondContact O-CB 3.31Å; W326-A330 PolarHBondContact O-N 3.02Å
327	L	98.7	Very high	98.7	Very high	71 Å²	71	55.2 Å²	55.2	37%	0.372	29%	0.286	S	S	.	.	H	α-helix	trans	-60.1	-46.9	168.5	-179.8	65.1	0	0	0	111	S323 L324 A329 A330 D331 L357	S323-L327 WeakPolarHBondContact O-CB 2.93Å; S323-L327 PolarHBondContact O-N 2.86Å; L324-L327 HydrophobicContact CD2-CD2 4.1Å; L324-L327 PolarHBondContact O-N 3.17Å; L327-A329 VanDerWaalsContact C-N 3.35Å; L327-A329 PolarHBondContact O-N 3.34Å; L327-A330 PolarHBondContact O-N 3.26Å; L327-D331 WeakPolarHBondContact O-CB 3.25Å; L327-D331 PolarHBondContact O-N 3.05Å; L327-L357 HydrophobicContact CD1-CD2 4.29Å; L327-L357 HydrophobicContact CD2-CD1 4.34Å
328	L	98.8	Very high	98.7	Very high	10 Å²	10	50.2 Å²	50.2	5%	0.052	26%	0.264	C	S	.	.	H	α-helix	trans	-62	-41.7	176.5	179.4	63.1	0	0	0	111.9	L324 Y325 D331 L332 Y358 T361 I362 M366	L324-L328 WeakPolarHBondContact O-CB 3.5Å; L324-L328 PolarHBondContact O-N 3.06Å; Y325-L328 WeakPolarHBondContact O-CB 3.08Å; Y325-L328 PolarHBondContact O-N 3.1Å; L328-D331 PolarHBondContact O-N 2.92Å; L328-L332 WeakPolarHBondContact O-CG 3.34Å; L328-L332 PolarHBondContact O-N 3.06Å; L328-Y358 HydrophobicContact CD1-CD2 3.65Å; L328-Y358 HydrophobicContact CD1-CE2 3.95Å; L328-T361 HydrophobicContact CB-CG2 4.09Å; L328-I362 HydrophobicContact CD1-CD1 4.09Å; L328-I362 HydrophobicContact CD1-CG1 4.09Å; L328-I362 HydrophobicContact CD2-CD1 4.19Å; L328-I362 HydrophobicContact CD2-CG1 3.9Å; L328-M366 HydrophobicContact CB-CE 4.35Å; L328-M366 HydrophobicContact CD2-CE 3.73Å
329	A	98.8	Very high	98.7	Very high	29 Å²	29	50 Å²	50	24%	0.24	26%	0.263	C	S	.	.	H	α-helix	trans	-63.2	-43.6	176.3	0	0	0	0	0	111.7	Y325 W326 L327 L332 L333	Y325-A329 PolarHBondContact O-N 3.28Å; W326-A329 HydrophobicContact CE3-CB 4.11Å; W326-A329 PolarHBondContact O-N 2.81Å; L327-A329 VanDerWaalsContact C-N 3.35Å; L327-A329 PolarHBondContact O-N 3.34Å; A329-L332 PolarHBondContact O-N 3.21Å; A329-L333 WeakPolarHBondContact O-CG 3.14Å; A329-L333 PolarHBondContact O-N 3.02Å; A329-L333 VanDerWaalsContact O-N 3.16Å
330	A	98.9	Very high	98.6	Very high	46 Å²	46	46.6 Å²	46.6	38%	0.38	25%	0.245	S	C	.	.	H	α-helix	trans	-64.7	-40.3	175.7	0	0	0	0	0	112	W326 L327 L333 I334	W326-A330 WeakPolarHBondContact O-CB 3.31Å; W326-A330 PolarHBondContact O-N 3.02Å; L327-A330 PolarHBondContact O-N 3.26Å; A330-L333 WeakPolarHBondContact O-CB 3.49Å; A330-L333 PolarHBondContact O-N 3.14Å; A330-I334 WeakPolarHBondContact O-CG1 3.42Å; A330-I334 PolarHBondContact O-N 2.85Å
331	D	98.9	Very high	98.6	Very high	4 Å²	4	46 Å²	46	2%	0.021	24%	0.241	C	C	.	.	H	α-helix	trans	-63.4	-41.4	176.7	-173.1	55.3	0	0	0	112	L327 L328 L333 I334 L335 A354 L357 Y358	L327-D331 WeakPolarHBondContact O-CB 3.25Å; L327-D331 PolarHBondContact O-N 3.05Å; L328-D331 PolarHBondContact O-N 2.92Å; D331-L333 VanDerWaalsContact C-N 3.31Å; D331-L333 PolarHBondContact O-N 3.1Å; D331-I334 WeakPolarHBondContact O-CB 3.4Å; D331-I334 PolarHBondContact O-N 3.48Å; D331-I334 VanDerWaalsContact O-N 3.13Å; D331-L335 WeakPolarHBondContact O-CG 3.46Å; D331-L335 PolarHBondContact O-N 3.15Å; D331-A354 VanDerWaalsContact OD1-CA 3.29Å; D331-A354 WeakPolarHBondContact OD1-CA 3.2Å; D331-A354 WeakPolarHBondContact OD1-CB 3.21Å; D331-A354 VanDerWaalsContact OD2-O 3.07Å; D331-L357 HydrophobicContact CB-CD2 4.22Å; D331-Y358 VanDerWaalsContact OD2-CA 3.27Å; D331-Y358 WeakPolarHBondContact OD2-CA 3.26Å; D331-Y358 WeakPolarHBondContact OD2-CB 3.48Å; D331-Y358 PolarHBondContact OD2-N 2.95Å; D331-Y358 VanDerWaalsContact OD2-N 3.09Å
332	L	98.9	Very high	98.5	Very high	55 Å²	55	48.8 Å²	48.8	29%	0.288	26%	0.258	S	S	.	.	H	α-helix	trans	-60.9	-37.2	172.1	-78.5	168.8	0	0	0	112.9	F276 L328 A329 L335 T336 Y358	F276-L332 HydrophobicContact CB-CD2 4.24Å; F276-L332 HydrophobicContact CD2-CD2 3.7Å; F276-L332 HydrophobicContact CE2-CD2 4.38Å; F276-L332 HydrophobicContact CG-CD2 4.11Å; L328-L332 WeakPolarHBondContact O-CG 3.34Å; L328-L332 PolarHBondContact O-N 3.06Å; A329-L332 PolarHBondContact O-N 3.21Å; L332-L335 HydrophobicContact CD2-CD1 4.4Å; L332-T336 WeakPolarHBondContact O-CB 3.4Å; L332-T336 PolarHBondContact O-N 3.1Å; L332-T336 PolarHBondContact O-OG1 3.01Å; L332-Y358 HydrophobicContact CD2-CD2 4.01Å; L332-Y358 HydrophobicContact CD2-CE2 3.76Å; L332-Y358 HydrophobicContact CG-CD2 4.37Å; L332-Y358 HydrophobicContact CG-CE2 4.29Å
333	L	98.8	Very high	98.3	Very high	126 Å²	126	51 Å²	51	66%	0.66	28%	0.275	S	S	*	.	H	α-helix	trans	-66.7	-40	173.4	-67.5	173.3	0	0	0	111.5	A329 A330 D331 T336 W337	A329-L333 WeakPolarHBondContact O-CG 3.14Å; A329-L333 PolarHBondContact O-N 3.02Å; A329-L333 VanDerWaalsContact O-N 3.16Å; A330-L333 WeakPolarHBondContact O-CB 3.49Å; A330-L333 PolarHBondContact O-N 3.14Å; D331-L333 VanDerWaalsContact C-N 3.31Å; D331-L333 PolarHBondContact O-N 3.1Å; L333-T336 PolarHBondContact O-N 3.04Å; L333-W337 WeakPolarHBondContact O-CB 3.45Å; L333-W337 PolarHBondContact O-N 2.84Å
334	I	98.9	Very high	98.1	Very high	68 Å²	68	50 Å²	50	35%	0.349	27%	0.269	S	S	.	.	H	α-helix	trans	-63.3	-47.8	174.3	-68.3	167.3	0	0	0	110.3	A330 D331 T336 W337 I338 I350 A354	A330-I334 WeakPolarHBondContact O-CG1 3.42Å; A330-I334 PolarHBondContact O-N 2.85Å; D331-I334 WeakPolarHBondContact O-CB 3.4Å; D331-I334 PolarHBondContact O-N 3.48Å; D331-I334 VanDerWaalsContact O-N 3.13Å; I334-T336 VanDerWaalsContact C-N 3.27Å; I334-T336 PolarHBondContact O-N 3.38Å; I334-W337 HydrophobicContact CG2-CE3 4.4Å; I334-W337 PolarHBondContact O-N 3.39Å; I334-I338 HydrophobicContact CG2-CG1 4.17Å; I334-I338 WeakPolarHBondContact O-CB 3.24Å; I334-I338 VanDerWaalsContact O-CG1 3.3Å; I334-I338 WeakPolarHBondContact O-CG1 3.23Å; I334-I338 PolarHBondContact O-N 3.06Å; I334-I350 HydrophobicContact CG2-CG2 3.98Å; I334-A354 HydrophobicContact CG2-CB 4.07Å
335	L	98.9	Very high	98	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-57.8	-41.3	176.3	-73.3	170.9	0	0	0	111.6	F276 T279 I280 D331 L332 G339 A354 Y358	F276-L335 HydrophobicContact CB-CB 3.95Å; T279-L335 WeakPolarHBondContact CB-O 3.45Å; T279-L335 HydrophobicContact CG2-CD2 3.52Å; T279-L335 PolarHBondContact OG1-O 2.51Å; I280-L335 HydrophobicContact CD1-CD1 4.05Å; I280-L335 HydrophobicContact CG1-CD1 4.21Å; I280-L335 HydrophobicContact CG1-CD2 4.13Å; D331-L335 WeakPolarHBondContact O-CG 3.46Å; D331-L335 PolarHBondContact O-N 3.15Å; L332-L335 HydrophobicContact CD2-CD1 4.4Å; L335-G339 PolarHBondContact O-N 3.37Å; L335-A354 HydrophobicContact CD2-CB 3.6Å; L335-A354 HydrophobicContact CG-CB 3.96Å; L335-Y358 HydrophobicContact CD1-CD2 4.26Å; L335-Y358 HydrophobicContact CD1-CG 4.3Å
336	T	98.8	Very high	97.9	Very high	36 Å²	36	60 Å²	60	22%	0.221	31%	0.313	C	S	.	.	H	α-helix	trans	-63.5	-47.6	176	-57.5	0	0	0	0	111	L275 L332 L333 I334 G339 G340	L275-T336 HydrophobicContact CB-CG2 4.05Å; L275-T336 WeakPolarHBondContact CB-O 3.41Å; L275-T336 HydrophobicContact CD1-CG2 4.38Å; L332-T336 WeakPolarHBondContact O-CB 3.4Å; L332-T336 PolarHBondContact O-N 3.1Å; L332-T336 PolarHBondContact O-OG1 3.01Å; L333-T336 PolarHBondContact O-N 3.04Å; I334-T336 VanDerWaalsContact C-N 3.27Å; I334-T336 PolarHBondContact O-N 3.38Å; T336-G339 PolarHBondContact O-N 3.48Å; T336-G340 PolarHBondContact O-N 3.47Å
337	W	98.7	Very high	97.9	Very high	127 Å²	127	55.1 Å²	55.1	48%	0.481	30%	0.296	S	S	.	.	H	α-helix	trans	-59.3	-50.3	177.2	165.7	58.7	0	0	0	112	L333 I334 G339 G340 Q341 F347 I350	L333-W337 WeakPolarHBondContact O-CB 3.45Å; L333-W337 PolarHBondContact O-N 2.84Å; I334-W337 HydrophobicContact CG2-CE3 4.4Å; I334-W337 PolarHBondContact O-N 3.39Å; W337-G339 PolarHBondContact O-N 3.49Å; W337-G340 PolarHBondContact O-N 3.44Å; W337-G340 VanDerWaalsContact O-N 3.08Å; W337-Q341 WeakPolarHBondContact O-CG 3.15Å; W337-F347 HydrophobicContact CH2-CD1 4.34Å; W337-F347 HydrophobicContact CH2-CE1 4.02Å; W337-F347 HydrophobicContact CZ2-CD1 4.35Å; W337-F347 AromaticContact CZ2-CE1 3.73Å; W337-F347 HydrophobicContact CZ2-CE1 3.73Å; W337-I350 HydrophobicContact CH2-CD1 4.43Å; W337-I350 HydrophobicContact CZ3-CD1 4.48Å; W337-I350 HydrophobicContact CZ3-CG2 4.43Å
338	I	98.7	Very high	97.9	Very high	5 Å²	5	54.4 Å²	54.4	3%	0.026	29%	0.294	C	S	.	.	H	α-helix	trans	-60.9	-31.7	177.5	-64.8	-61.5	0	0	0	111.5	T279 R282 I334 G340 Q341 F347 I350	T279-I338 HydrophobicContact CG2-CB 4.01Å; T279-I338 HydrophobicContact CG2-CG2 3.61Å; R282-I338 PolarHBondContact NH2-O 2.97Å; I334-I338 HydrophobicContact CG2-CG1 4.17Å; I334-I338 WeakPolarHBondContact O-CB 3.24Å; I334-I338 VanDerWaalsContact O-CG1 3.3Å; I334-I338 WeakPolarHBondContact O-CG1 3.23Å; I334-I338 PolarHBondContact O-N 3.06Å; I338-G340 PolarHBondContact O-N 2.87Å; I338-Q341 PolarHBondContact O-N 3.5Å; I338-F347 HydrophobicContact CD1-CB 4.24Å; I338-F347 HydrophobicContact CD1-CD1 3.74Å; I338-F347 HydrophobicContact CD1-CG 4.45Å; I338-I350 HydrophobicContact CD1-CB 3.87Å; I338-I350 HydrophobicContact CD1-CD1 4.39Å; I338-I350 HydrophobicContact CD1-CG2 3.66Å; I338-I350 HydrophobicContact CG1-CB 4.37Å; I338-I350 HydrophobicContact CG1-CG2 3.84Å
339	G	98.1	Very high	97.9	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-58.6	-35.4	176.8	0	0	0	0	0	112.2	T279 R282 L335 T336 W337 Q341	T279-G339 WeakPolarHBondContact OG1-CA 3.4Å; T279-G339 PolarHBondContact OG1-N 2.86Å; R282-G339 VanDerWaalsContact NH2-CA 3.3Å; R282-G339 PolarHBondContact NH2-O 3.02Å; L335-G339 PolarHBondContact O-N 3.37Å; T336-G339 PolarHBondContact O-N 3.48Å; W337-G339 PolarHBondContact O-N 3.49Å; G339-Q341 VanDerWaalsContact C-N 3.35Å
340	G	97	Very high	97.9	Very high	21 Å²	21	59 Å²	59	22%	0.216	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-8.9	176.8	0	0	0	0	0	114.9	H267 T336 W337 I338	H267-G340 PolarHBondContact CE1-O 3.32Å; T336-G340 PolarHBondContact O-N 3.47Å; W337-G340 PolarHBondContact O-N 3.44Å; W337-G340 VanDerWaalsContact O-N 3.08Å; I338-G340 PolarHBondContact O-N 2.87Å
341	Q	97.9	Very high	97.8	Very high	54 Å²	54	56.9 Å²	56.9	25%	0.252	30%	0.296	S	S	.	.	S	Bend	trans	-93.7	153.5	-178.4	-58.2	-50.9	-42.2	0	0	112.5	H267 R282 W337 I338 G339 F347	H267-Q341 PolarHBondContact NE2-O 3.17Å; R282-Q341 PolarHBondContact NH1-O 3.42Å; R282-Q341 VanDerWaalsContact NH1-O 3.13Å; W337-Q341 WeakPolarHBondContact O-CG 3.15Å; I338-Q341 PolarHBondContact O-N 3.5Å; G339-Q341 VanDerWaalsContact C-N 3.35Å; Q341-F347 HydrophobicContact CB-CB 4.13Å; Q341-F347 HydrophobicContact CB-CD1 3.93Å; Q341-F347 HydrophobicContact CB-CD2 3.75Å; Q341-F347 HydrophobicContact CB-CE1 4.26Å; Q341-F347 HydrophobicContact CB-CE2 4.08Å; Q341-F347 HydrophobicContact CB-CG 3.66Å; Q341-F347 HydrophobicContact CB-CZ 4.31Å; Q341-F347 HydrophobicContact CG-CD1 3.82Å; Q341-F347 HydrophobicContact CG-CD2 4.35Å; Q341-F347 HydrophobicContact CG-CE1 3.81Å; Q341-F347 HydrophobicContact CG-CE2 4.32Å; Q341-F347 HydrophobicContact CG-CG 4.1Å; Q341-F347 HydrophobicContact CG-CZ 4.05Å
342	P	95.8	Very high	97.8	Very high	59 Å²	59	59.9 Å²	59.9	38%	0.383	31%	0.31	S	S	.	.			trans	-65.8	154.1	175.3	28.2	-36	0	0	0	112	S344 F347	P342-S344 VanDerWaalsContact C-N 3.31Å; P342-S344 PolarHBondContact O-N 3.25Å; P342-S344 PolarHBondContact O-OG 2.83Å; P342-F347 HydrophobicContact CG-CD2 4.34Å; P342-F347 HydrophobicContact CG-CE2 4.42Å
343	V	94.9	Very high	97.8	Very high	100 Å²	100	61.6 Å²	61.6	61%	0.606	32%	0.323	S	S	*	.	S	Bend	trans	-75.4	84.9	175.7	-172.9	0	0	0	0	109.5
344	S	95.6	Very high	97.8	Very high	49 Å²	49	55.8 Å²	55.8	34%	0.343	29%	0.293	S	S	.	.			trans	-152.3	163.7	-178.6	58.3	0	0	0	0	110.6	P342 F347 T348	P342-S344 VanDerWaalsContact C-N 3.31Å; P342-S344 PolarHBondContact O-N 3.25Å; P342-S344 PolarHBondContact O-OG 2.83Å; S344-F347 WeakPolarHBondContact O-CA 3.42Å; S344-F347 WeakPolarHBondContact O-CB 3.19Å; S344-F347 PolarHBondContact O-N 3.46Å; S344-T348 PolarHBondContact N-OG1 3.03Å; S344-T348 PolarHBondContact O-N 2.76Å; S344-T348 PolarHBondContact O-OG1 2.93Å
345	Y	95.8	Very high	97.8	Very high	203 Å²	203	53 Å²	53	80%	0.796	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	136.1	171.3	-178.7	-90.9	0	0	0	110.3	I349	Y345-I349 HydrophobicContact CD2-CG2 4.45Å; Y345-I349 HydrophobicContact CE2-CG2 4.3Å
346	P	97.3	Very high	97.8	Very high	52 Å²	52	57.4 Å²	57.4	34%	0.338	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	cis	-92.6	0.8	3	36.7	-35.6	0	0	0	114.7	T348 I349 I350	P346-T348 VanDerWaalsContact C-N 3.32Å; P346-T348 PolarHBondContact O-N 3.12Å; P346-I349 HydrophobicContact CB-CG2 4.46Å; P346-I349 WeakPolarHBondContact O-CG2 3.4Å; P346-I349 PolarHBondContact O-N 3.4Å; P346-I350 HydrophobicContact CB-CD1 4.24Å; P346-I350 HydrophobicContact CG-CD1 4.26Å; P346-I350 WeakPolarHBondContact O-CG1 3.17Å; P346-I350 PolarHBondContact O-N 2.9Å; P346-I350 VanDerWaalsContact O-N 3.16Å
347	F	98.3	Very high	97.8	Very high	43 Å²	43	58.2 Å²	58.2	19%	0.189	31%	0.309	C	S	.	.	H	α-helix	trans	-62.1	-35.4	-173.7	-56.5	-55.2	0	0	0	113.9	W337 I338 Q341 P342 S344 I349 I350 G351	W337-F347 HydrophobicContact CH2-CD1 4.34Å; W337-F347 HydrophobicContact CH2-CE1 4.02Å; W337-F347 HydrophobicContact CZ2-CD1 4.35Å; W337-F347 AromaticContact CZ2-CE1 3.73Å; W337-F347 HydrophobicContact CZ2-CE1 3.73Å; I338-F347 HydrophobicContact CD1-CB 4.24Å; I338-F347 HydrophobicContact CD1-CD1 3.74Å; I338-F347 HydrophobicContact CD1-CG 4.45Å; Q341-F347 HydrophobicContact CB-CB 4.13Å; Q341-F347 HydrophobicContact CB-CD1 3.93Å; Q341-F347 HydrophobicContact CB-CD2 3.75Å; Q341-F347 HydrophobicContact CB-CE1 4.26Å; Q341-F347 HydrophobicContact CB-CE2 4.08Å; Q341-F347 HydrophobicContact CB-CG 3.66Å; Q341-F347 HydrophobicContact CB-CZ 4.31Å; Q341-F347 HydrophobicContact CG-CD1 3.82Å; Q341-F347 HydrophobicContact CG-CD2 4.35Å; Q341-F347 HydrophobicContact CG-CE1 3.81Å; Q341-F347 HydrophobicContact CG-CE2 4.32Å; Q341-F347 HydrophobicContact CG-CG 4.1Å; Q341-F347 HydrophobicContact CG-CZ 4.05Å; P342-F347 HydrophobicContact CG-CD2 4.34Å; P342-F347 HydrophobicContact CG-CE2 4.42Å; S344-F347 WeakPolarHBondContact O-CA 3.42Å; S344-F347 WeakPolarHBondContact O-CB 3.19Å; S344-F347 PolarHBondContact O-N 3.46Å; F347-I349 PolarHBondContact O-N 3.25Å; F347-I350 PolarHBondContact O-N 3.1Å; F347-G351 PolarHBondContact O-N 2.9Å
348	T	97.8	Very high	97.8	Very high	55 Å²	55	52.7 Å²	52.7	34%	0.337	29%	0.288	S	S	.	.	H	α-helix	trans	-59	-47.8	177	-54.5	0	0	0	0	111.9	S344 P346 G351 Q352	S344-T348 PolarHBondContact N-OG1 3.03Å; S344-T348 PolarHBondContact O-N 2.76Å; S344-T348 PolarHBondContact O-OG1 2.93Å; P346-T348 VanDerWaalsContact C-N 3.32Å; P346-T348 PolarHBondContact O-N 3.12Å; T348-G351 PolarHBondContact O-N 3.25Å; T348-Q352 WeakPolarHBondContact O-CG 3.3Å; T348-Q352 PolarHBondContact O-N 3.15Å; T348-Q352 VanDerWaalsContact O-N 3.09Å
349	I	98.5	Very high	97.8	Very high	81 Å²	81	54.6 Å²	54.6	42%	0.415	30%	0.296	S	S	.	.	H	α-helix	trans	-72.5	-36.1	-178.3	-173.5	61.4	0	0	0	111.5	Y345 P346 F347 G351 Q352 V353	Y345-I349 HydrophobicContact CD2-CG2 4.45Å; Y345-I349 HydrophobicContact CE2-CG2 4.3Å; P346-I349 HydrophobicContact CB-CG2 4.46Å; P346-I349 WeakPolarHBondContact O-CG2 3.4Å; P346-I349 PolarHBondContact O-N 3.4Å; F347-I349 PolarHBondContact O-N 3.25Å; I349-G351 VanDerWaalsContact C-N 3.35Å; I349-G351 PolarHBondContact O-N 2.97Å; I349-Q352 PolarHBondContact O-N 3.47Å; I349-V353 HydrophobicContact CD1-CG2 4.36Å; I349-V353 HydrophobicContact CG1-CG2 4.44Å; I349-V353 WeakPolarHBondContact O-CG2 3.36Å; I349-V353 PolarHBondContact O-N 2.82Å
350	I	98.8	Very high	97.9	Very high	55 Å²	55	56.7 Å²	56.7	28%	0.282	31%	0.309	S	S	.	.	H	α-helix	trans	-62.2	-45.3	174.8	-61.6	166	0	0	0	110	I334 W337 I338 P346 F347 Q352 V353 A354	I334-I350 HydrophobicContact CG2-CG2 3.98Å; W337-I350 HydrophobicContact CH2-CD1 4.43Å; W337-I350 HydrophobicContact CZ3-CD1 4.48Å; W337-I350 HydrophobicContact CZ3-CG2 4.43Å; I338-I350 HydrophobicContact CD1-CB 3.87Å; I338-I350 HydrophobicContact CD1-CD1 4.39Å; I338-I350 HydrophobicContact CD1-CG2 3.66Å; I338-I350 HydrophobicContact CG1-CB 4.37Å; I338-I350 HydrophobicContact CG1-CG2 3.84Å; P346-I350 HydrophobicContact CB-CD1 4.24Å; P346-I350 HydrophobicContact CG-CD1 4.26Å; P346-I350 WeakPolarHBondContact O-CG1 3.17Å; P346-I350 PolarHBondContact O-N 2.9Å; P346-I350 VanDerWaalsContact O-N 3.16Å; F347-I350 PolarHBondContact O-N 3.1Å; I350-Q352 VanDerWaalsContact C-N 3.33Å; I350-Q352 PolarHBondContact O-N 3.49Å; I350-V353 PolarHBondContact O-N 2.78Å; I350-A354 VanDerWaalsContact O-CB 3.28Å; I350-A354 WeakPolarHBondContact O-CB 3.49Å; I350-A354 PolarHBondContact O-N 3.03Å
351	G	98.6	Very high	98	Very high	2 Å²	2	55.7 Å²	55.7	2%	0.021	30%	0.299	C	S	.	.	H	α-helix	trans	-58.9	-43	176.8	0	0	0	0	0	112.8	S283 F347 T348 I349 S355	S283-G351 PolarHBondContact OG-O 2.92Å; S283-G351 VanDerWaalsContact OG-O 3.04Å; F347-G351 PolarHBondContact O-N 2.9Å; T348-G351 PolarHBondContact O-N 3.25Å; I349-G351 VanDerWaalsContact C-N 3.35Å; I349-G351 PolarHBondContact O-N 2.97Å; G351-S355 VanDerWaalsContact O-CB 3.32Å; G351-S355 WeakPolarHBondContact O-CB 3.44Å; G351-S355 PolarHBondContact O-N 3.38Å; G351-S355 PolarHBondContact O-OG 2.92Å
352	Q	98.8	Very high	98	Very high	67 Å²	67	53.4 Å²	53.4	31%	0.313	29%	0.288	S	S	.	.	H	α-helix	trans	-63	-48.7	176.6	-74.4	173.7	-22.6	0	0	112.3	S283 T348 I349 I350 S355 V356	S283-Q352 WeakPolarHBondContact O-CG 3.22Å; S283-Q352 PolarHBondContact O-NE2 3.26Å; S283-Q352 PolarHBondContact OG-N 3.26Å; T348-Q352 WeakPolarHBondContact O-CG 3.3Å; T348-Q352 PolarHBondContact O-N 3.15Å; T348-Q352 VanDerWaalsContact O-N 3.09Å; I349-Q352 PolarHBondContact O-N 3.47Å; I350-Q352 VanDerWaalsContact C-N 3.33Å; I350-Q352 PolarHBondContact O-N 3.49Å; Q352-S355 PolarHBondContact O-N 3.42Å; Q352-V356 WeakPolarHBondContact O-CG2 3.38Å; Q352-V356 PolarHBondContact O-N 3.27Å
353	V	98.8	Very high	98.1	Very high	90 Å²	90	54.2 Å²	54.2	55%	0.545	29%	0.289	S	S	.	.	H	α-helix	trans	-63.2	-45.3	179	173.6	0	0	0	0	111	I349 I350 S355 V356 L357	I349-V353 HydrophobicContact CD1-CG2 4.36Å; I349-V353 HydrophobicContact CG1-CG2 4.44Å; I349-V353 WeakPolarHBondContact O-CG2 3.36Å; I349-V353 PolarHBondContact O-N 2.82Å; I350-V353 PolarHBondContact O-N 2.78Å; V353-S355 VanDerWaalsContact C-N 3.34Å; V353-S355 PolarHBondContact O-N 2.85Å; V353-V356 PolarHBondContact O-N 3.45Å; V353-L357 WeakPolarHBondContact O-CB 3.27Å; V353-L357 PolarHBondContact O-N 2.85Å
354	A	98.9	Very high	98.3	Very high	4 Å²	4	53.9 Å²	53.9	3%	0.033	28%	0.283	C	S	.	.	H	α-helix	trans	-61.4	-41.9	176.3	0	0	0	0	0	111.5	D331 I334 L335 I350 V356 L357 Y358	D331-A354 VanDerWaalsContact OD1-CA 3.29Å; D331-A354 WeakPolarHBondContact OD1-CA 3.2Å; D331-A354 WeakPolarHBondContact OD1-CB 3.21Å; D331-A354 VanDerWaalsContact OD2-O 3.07Å; I334-A354 HydrophobicContact CG2-CB 4.07Å; L335-A354 HydrophobicContact CD2-CB 3.6Å; L335-A354 HydrophobicContact CG-CB 3.96Å; I350-A354 VanDerWaalsContact O-CB 3.28Å; I350-A354 WeakPolarHBondContact O-CB 3.49Å; I350-A354 PolarHBondContact O-N 3.03Å; A354-V356 VanDerWaalsContact C-N 3.34Å; A354-V356 PolarHBondContact O-N 3.44Å; A354-L357 PolarHBondContact O-N 2.95Å; A354-L357 VanDerWaalsContact O-N 3.15Å; A354-Y358 PolarHBondContact O-N 2.77Å
355	S	98.8	Very high	98.5	Very high	9 Å²	9	54.2 Å²	54.2	6%	0.063	28%	0.281	C	S	.	.	H	α-helix	trans	-63.5	-40.2	177.5	-56.5	0	0	0	0	111.9	S283 G351 Q352 V353 F359	S283-S355 WeakPolarHBondContact CB-OG 3.24Å; S283-S355 PolarHBondContact OG-OG 2.91Å; G351-S355 VanDerWaalsContact O-CB 3.32Å; G351-S355 WeakPolarHBondContact O-CB 3.44Å; G351-S355 PolarHBondContact O-N 3.38Å; G351-S355 PolarHBondContact O-OG 2.92Å; Q352-S355 PolarHBondContact O-N 3.42Å; V353-S355 VanDerWaalsContact C-N 3.34Å; V353-S355 PolarHBondContact O-N 2.85Å; S355-F359 VanDerWaalsContact O-CD2 3.28Å; S355-F359 WeakPolarHBondContact O-CD2 3.37Å; S355-F359 PolarHBondContact O-N 2.96Å
356	V	98.8	Very high	98.6	Very high	94 Å²	94	45.8 Å²	45.8	57%	0.57	25%	0.249	S	C	*	.	H	α-helix	trans	-65.1	-42.9	173.6	171.5	0	0	0	0	110.8	Q352 V353 A354 Y358 F359 T360	Q352-V356 WeakPolarHBondContact O-CG2 3.38Å; Q352-V356 PolarHBondContact O-N 3.27Å; V353-V356 PolarHBondContact O-N 3.45Å; A354-V356 VanDerWaalsContact C-N 3.34Å; A354-V356 PolarHBondContact O-N 3.44Å; V356-Y358 PolarHBondContact O-N 3.01Å; V356-F359 PolarHBondContact O-N 2.66Å; V356-T360 WeakPolarHBondContact O-CB 3.3Å; V356-T360 PolarHBondContact O-N 2.94Å; V356-T360 PolarHBondContact O-OG1 3.36Å
357	L	98.8	Very high	98.6	Very high	53 Å²	53	44 Å²	44	28%	0.277	24%	0.237	S	C	.	.	H	α-helix	trans	-61.9	-42.3	179.1	-176.7	60.5	0	0	0	111.7	L327 D331 V353 A354 T360 T361	L327-L357 HydrophobicContact CD1-CD2 4.29Å; L327-L357 HydrophobicContact CD2-CD1 4.34Å; D331-L357 HydrophobicContact CB-CD2 4.22Å; V353-L357 WeakPolarHBondContact O-CB 3.27Å; V353-L357 PolarHBondContact O-N 2.85Å; A354-L357 PolarHBondContact O-N 2.95Å; A354-L357 VanDerWaalsContact O-N 3.15Å; L357-T360 PolarHBondContact O-N 3.48Å; L357-T361 VanDerWaalsContact O-CB 3.22Å; L357-T361 WeakPolarHBondContact O-CB 3.27Å; L357-T361 PolarHBondContact O-N 2.99Å; L357-T361 PolarHBondContact O-OG1 2.76Å
358	Y	98.9	Very high	98.6	Very high	11 Å²	11	44.8 Å²	44.8	4%	0.043	25%	0.245	C	C	.	.	H	α-helix	trans	-53.3	-58.5	175.7	176.2	-98.1	0	0	0	112.1	I280 S297 I300 L328 D331 L332 L335 A354 V356 T361 I362	I280-Y358 HydrophobicContact CD1-CD1 3.95Å; I280-Y358 HydrophobicContact CD1-CE1 4.28Å; I280-Y358 HydrophobicContact CD1-CG 4.29Å; S297-Y358 PolarHBondContact O-OH 3.31Å; I300-Y358 HydrophobicContact CG2-CE1 4.12Å; I300-Y358 VanDerWaalsContact CG2-OH 3.26Å; I300-Y358 WeakPolarHBondContact CG2-OH 3.31Å; L328-Y358 HydrophobicContact CD1-CD2 3.65Å; L328-Y358 HydrophobicContact CD1-CE2 3.95Å; D331-Y358 VanDerWaalsContact OD2-CA 3.27Å; D331-Y358 WeakPolarHBondContact OD2-CA 3.26Å; D331-Y358 WeakPolarHBondContact OD2-CB 3.48Å; D331-Y358 PolarHBondContact OD2-N 2.95Å; D331-Y358 VanDerWaalsContact OD2-N 3.09Å; L332-Y358 HydrophobicContact CD2-CD2 4.01Å; L332-Y358 HydrophobicContact CD2-CE2 3.76Å; L332-Y358 HydrophobicContact CG-CD2 4.37Å; L332-Y358 HydrophobicContact CG-CE2 4.29Å; L335-Y358 HydrophobicContact CD1-CD2 4.26Å; L335-Y358 HydrophobicContact CD1-CG 4.3Å; A354-Y358 PolarHBondContact O-N 2.77Å; V356-Y358 PolarHBondContact O-N 3.01Å; Y358-T361 PolarHBondContact O-N 2.98Å; Y358-I362 HydrophobicContact CD1-CD1 4.47Å; Y358-I362 HydrophobicContact CD2-CD1 4.23Å; Y358-I362 HydrophobicContact CE1-CD1 3.94Å; Y358-I362 HydrophobicContact CE2-CD1 3.67Å; Y358-I362 VanDerWaalsContact CZ-CD1 3.49Å; Y358-I362 PolarHBondContact O-N 2.93Å
359	F	98.8	Very high	98.7	Very high	44 Å²	44	43.8 Å²	43.8	19%	0.193	24%	0.238	C	C	.	.	H	α-helix	trans	-67.2	-40.2	-178.7	-75	-72.3	0	0	0	112	I280 L296 I300 S355 V356 T361 I362 L363	I280-F359 HydrophobicContact CG2-CE2 3.88Å; I280-F359 HydrophobicContact CG2-CZ 4.35Å; L296-F359 HydrophobicContact CB-CE1 4.17Å; L296-F359 HydrophobicContact CB-CZ 4.28Å; I300-F359 HydrophobicContact CD1-CD1 3.72Å; I300-F359 HydrophobicContact CD1-CE1 4.08Å; S355-F359 VanDerWaalsContact O-CD2 3.28Å; S355-F359 WeakPolarHBondContact O-CD2 3.37Å; S355-F359 PolarHBondContact O-N 2.96Å; V356-F359 PolarHBondContact O-N 2.66Å; F359-T361 VanDerWaalsContact C-N 3.35Å; F359-T361 PolarHBondContact O-N 2.95Å; F359-I362 PolarHBondContact O-N 2.88Å; F359-L363 HydrophobicContact CB-CD1 4.43Å; F359-L363 HydrophobicContact CD1-CD1 4.38Å; F359-L363 VanDerWaalsContact O-CB 3.27Å; F359-L363 WeakPolarHBondContact O-CB 3.24Å; F359-L363 WeakPolarHBondContact O-CG 3.43Å; F359-L363 PolarHBondContact O-N 3.22Å
360	T	98.8	Very high	98.6	Very high	45 Å²	45	40.2 Å²	40.2	28%	0.276	22%	0.22	S	C	.	.	H	α-helix	trans	-64.3	-40.9	179.4	-58.3	0	0	0	0	111.3	V356 L357 I364 L365	V356-T360 WeakPolarHBondContact O-CB 3.3Å; V356-T360 PolarHBondContact O-N 2.94Å; V356-T360 PolarHBondContact O-OG1 3.36Å; L357-T360 PolarHBondContact O-N 3.48Å; T360-I364 HydrophobicContact CG2-CB 4.43Å; T360-I364 HydrophobicContact CG2-CD1 4.41Å; T360-I364 WeakPolarHBondContact O-CA 3.26Å; T360-I364 WeakPolarHBondContact O-CB 3.27Å; T360-I364 PolarHBondContact O-N 3.42Å; T360-L365 HydrophobicContact CG2-CD1 4.39Å; T360-L365 HydrophobicContact CG2-CG 4.14Å; T360-L365 PolarHBondContact O-N 3.36Å
361	T	98.7	Very high	98.6	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.227	C	C	.	.	I	π-helix	trans	-61.8	-47.7	179.3	-60	0	0	0	0	110.8	L328 L357 Y358 F359 L365 M366	L328-T361 HydrophobicContact CB-CG2 4.09Å; L357-T361 VanDerWaalsContact O-CB 3.22Å; L357-T361 WeakPolarHBondContact O-CB 3.27Å; L357-T361 PolarHBondContact O-N 2.99Å; L357-T361 PolarHBondContact O-OG1 2.76Å; Y358-T361 PolarHBondContact O-N 2.98Å; F359-T361 VanDerWaalsContact C-N 3.35Å; F359-T361 PolarHBondContact O-N 2.95Å; T361-L365 PolarHBondContact O-N 2.81Å; T361-M366 HydrophobicContact CG2-CE 4.28Å; T361-M366 HydrophobicContact CG2-CG 4.45Å; T361-M366 WeakPolarHBondContact O-CB 3.41Å; T361-M366 WeakPolarHBondContact O-CG 3.4Å; T361-M366 PolarHBondContact O-N 3.37Å
362	I	98.7	Very high	98.6	Very high	6 Å²	6	45.3 Å²	45.3	3%	0.031	25%	0.246	C	C	.	.	I	π-helix	trans	-73.2	-50.6	-177.3	-64	168	0	0	0	111.8	I300 I304 L307 L328 Y358 F359 P367	I300-I362 HydrophobicContact CD1-CB 3.8Å; I300-I362 HydrophobicContact CD1-CD1 3.97Å; I300-I362 HydrophobicContact CD1-CG2 3.55Å; I300-I362 HydrophobicContact CG1-CG2 3.77Å; I300-I362 HydrophobicContact CG2-CD1 4.29Å; I304-I362 HydrophobicContact CD1-CG2 3.44Å; I304-I362 VanDerWaalsContact CD1-CG2 3.44Å; L307-I362 HydrophobicContact CD1-CG2 4.13Å; L328-I362 HydrophobicContact CD1-CD1 4.09Å; L328-I362 HydrophobicContact CD1-CG1 4.09Å; L328-I362 HydrophobicContact CD2-CD1 4.19Å; L328-I362 HydrophobicContact CD2-CG1 3.9Å; Y358-I362 HydrophobicContact CD1-CD1 4.47Å; Y358-I362 HydrophobicContact CD2-CD1 4.23Å; Y358-I362 HydrophobicContact CE1-CD1 3.94Å; Y358-I362 HydrophobicContact CE2-CD1 3.67Å; Y358-I362 VanDerWaalsContact CZ-CD1 3.49Å; Y358-I362 PolarHBondContact O-N 2.93Å; F359-I362 PolarHBondContact O-N 2.88Å; I362-P367 WeakPolarHBondContact O-CD 3.31Å
363	L	98.6	Very high	98.6	Very high	76 Å²	76	42.6 Å²	42.6	40%	0.398	23%	0.233	S	C	.	.	I	π-helix	trans	-79.8	-28.1	-170.6	-61.7	177.9	0	0	0	113.5	I300 L307 F359 P367	I300-L363 HydrophobicContact CD1-CD1 4.42Å; I300-L363 HydrophobicContact CD1-CD2 3.74Å; I300-L363 HydrophobicContact CD1-CG 3.87Å; I300-L363 HydrophobicContact CG1-CD2 4.08Å; L307-L363 HydrophobicContact CD1-CD2 3.87Å; F359-L363 HydrophobicContact CB-CD1 4.43Å; F359-L363 HydrophobicContact CD1-CD1 4.38Å; F359-L363 VanDerWaalsContact O-CB 3.27Å; F359-L363 WeakPolarHBondContact O-CB 3.24Å; F359-L363 WeakPolarHBondContact O-CG 3.43Å; F359-L363 PolarHBondContact O-N 3.22Å; L363-P367 VanDerWaalsContact O-CG 3.29Å; L363-P367 WeakPolarHBondContact O-CG 3.26Å
364	I	98.6	Very high	98.6	Very high	93 Å²	93	38.7 Å²	38.7	48%	0.477	21%	0.209	S	C	.	.	I	π-helix	trans	-122.1	-57.4	-170	-55.8	175.9	0	0	0	111.1	T360 P367 T368	T360-I364 HydrophobicContact CG2-CB 4.43Å; T360-I364 HydrophobicContact CG2-CD1 4.41Å; T360-I364 WeakPolarHBondContact O-CA 3.26Å; T360-I364 WeakPolarHBondContact O-CB 3.27Å; T360-I364 PolarHBondContact O-N 3.42Å; I364-P367 WeakPolarHBondContact O-CD 3.49Å; I364-P367 WeakPolarHBondContact O-CG 3.38Å; I364-T368 HydrophobicContact CG2-CG2 4.41Å; I364-T368 WeakPolarHBondContact O-CB 3.04Å; I364-T368 WeakPolarHBondContact O-CG2 3.46Å; I364-T368 PolarHBondContact O-N 3.1Å; I364-T368 VanDerWaalsContact O-N 3.12Å; I364-T368 PolarHBondContact O-OG1 3.24Å
365	L	98.6	Very high	98.5	Very high	56 Å²	56	46.3 Å²	46.3	29%	0.293	24%	0.241	S	C	.	.	I	π-helix	trans	-69	-45.2	-170.4	-57.5	179.1	0	0	0	112.5	L324 T360 T361 T368 I369	L324-L365 HydrophobicContact CD1-CB 3.76Å; L324-L365 HydrophobicContact CD2-CB 4.19Å; L324-L365 HydrophobicContact CD2-CD1 4.22Å; T360-L365 HydrophobicContact CG2-CD1 4.39Å; T360-L365 HydrophobicContact CG2-CG 4.14Å; T360-L365 PolarHBondContact O-N 3.36Å; T361-L365 PolarHBondContact O-N 2.81Å; L365-T368 WeakPolarHBondContact CA-OG1 3.27Å; L365-T368 PolarHBondContact O-N 3.49Å; L365-T368 PolarHBondContact O-OG1 3.14Å; L365-I369 VanDerWaalsContact O-CB 3.31Å; L365-I369 WeakPolarHBondContact O-CB 3.32Å; L365-I369 WeakPolarHBondContact O-CG1 3.39Å; L365-I369 PolarHBondContact O-N 3.01Å
366	M	98.3	Very high	98.4	Very high	26 Å²	26	52.1 Å²	52.1	13%	0.128	27%	0.269	C	S	.	.	H	α-helix	trans	-59.4	-51.3	178.3	-78	-174	174.2	0	0	113.6	L324 L328 T361 S370	L324-M366 HydrophobicContact CD1-CG 4.3Å; L328-M366 HydrophobicContact CB-CE 4.35Å; L328-M366 HydrophobicContact CD2-CE 3.73Å; T361-M366 HydrophobicContact CG2-CE 4.28Å; T361-M366 HydrophobicContact CG2-CG 4.45Å; T361-M366 WeakPolarHBondContact O-CB 3.41Å; T361-M366 WeakPolarHBondContact O-CG 3.4Å; T361-M366 PolarHBondContact O-N 3.37Å; M366-S370 WeakPolarHBondContact O-CB 3.09Å; M366-S370 PolarHBondContact O-N 3.37Å; M366-S370 PolarHBondContact O-OG 3.05Å
367	P	98.3	Very high	98.4	Very high	14 Å²	14	51.7 Å²	51.7	9%	0.091	26%	0.264	C	S	.	.	H	α-helix	trans	-65.2	-39.2	177.6	20.1	-29.7	0	0	0	112.6	M309 I362 L363 I364 S370 L371	M309-P367 HydrophobicContact CG-CB 3.94Å; I362-P367 WeakPolarHBondContact O-CD 3.31Å; L363-P367 VanDerWaalsContact O-CG 3.29Å; L363-P367 WeakPolarHBondContact O-CG 3.26Å; I364-P367 WeakPolarHBondContact O-CD 3.49Å; I364-P367 WeakPolarHBondContact O-CG 3.38Å; P367-S370 WeakPolarHBondContact O-CB 3.36Å; P367-S370 PolarHBondContact O-N 3.41Å; P367-L371 WeakPolarHBondContact O-CG 3.27Å; P367-L371 PolarHBondContact O-N 2.89Å; P367-L371 VanDerWaalsContact O-N 3.12Å
368	T	98.5	Very high	98.3	Very high	60 Å²	60	58.4 Å²	58.4	37%	0.368	29%	0.29	S	S	.	.	H	α-helix	trans	-66.3	-45.3	179.2	53	0	0	0	0	112.3	I364 L365 S370 L371 I372	I364-T368 HydrophobicContact CG2-CG2 4.41Å; I364-T368 WeakPolarHBondContact O-CB 3.04Å; I364-T368 WeakPolarHBondContact O-CG2 3.46Å; I364-T368 PolarHBondContact O-N 3.1Å; I364-T368 VanDerWaalsContact O-N 3.12Å; I364-T368 PolarHBondContact O-OG1 3.24Å; L365-T368 WeakPolarHBondContact CA-OG1 3.27Å; L365-T368 PolarHBondContact O-N 3.49Å; L365-T368 PolarHBondContact O-OG1 3.14Å; T368-S370 VanDerWaalsContact C-N 3.31Å; T368-S370 PolarHBondContact O-N 3.47Å; T368-L371 PolarHBondContact O-N 3.23Å; T368-I372 WeakPolarHBondContact O-CG1 3.5Å; T368-I372 PolarHBondContact O-N 3.42Å
369	I	98.3	Very high	98	Very high	34 Å²	34	62.8 Å²	62.8	17%	0.174	31%	0.307	C	S	.	.	H	α-helix	trans	-63.1	-38.3	175.1	-72.6	-63.8	0	0	0	111.3	L320 L324 L365 L371 I372 E373	L320-I369 HydrophobicContact CB-CG2 3.44Å; L320-I369 VanDerWaalsContact CB-CG2 3.44Å; L320-I369 HydrophobicContact CD1-CD1 4.4Å; L320-I369 HydrophobicContact CD1-CG2 4.46Å; L324-I369 HydrophobicContact CD1-CB 3.87Å; L324-I369 HydrophobicContact CD1-CG1 3.56Å; L324-I369 HydrophobicContact CD1-CG2 4.31Å; L324-I369 HydrophobicContact CG-CG1 4.45Å; L365-I369 VanDerWaalsContact O-CB 3.31Å; L365-I369 WeakPolarHBondContact O-CB 3.32Å; L365-I369 WeakPolarHBondContact O-CG1 3.39Å; L365-I369 PolarHBondContact O-N 3.01Å; I369-L371 VanDerWaalsContact C-N 3.3Å; I369-L371 PolarHBondContact O-N 3.26Å; I369-I372 HydrophobicContact CD1-CD1 4.1Å; I369-I372 PolarHBondContact O-N 3.35Å; I369-I372 VanDerWaalsContact O-N 3.14Å; I369-E373 HydrophobicContact CG2-CG 4.24Å; I369-E373 WeakPolarHBondContact O-CG 3.33Å; I369-E373 PolarHBondContact O-N 2.91Å
370	S	97.8	Very high	96.7	Very high	5 Å²	5	67.7 Å²	67.7	4%	0.035	36%	0.355	C	S	.	.	H	α-helix	trans	-57.2	-43.6	174.4	-58.2	0	0	0	0	112	R318 M366 P367 T368 E373 N374	R318-S370 PolarHBondContact NH2-OG 2.74Å; M366-S370 WeakPolarHBondContact O-CB 3.09Å; M366-S370 PolarHBondContact O-N 3.37Å; M366-S370 PolarHBondContact O-OG 3.05Å; P367-S370 WeakPolarHBondContact O-CB 3.36Å; P367-S370 PolarHBondContact O-N 3.41Å; T368-S370 VanDerWaalsContact C-N 3.31Å; T368-S370 PolarHBondContact O-N 3.47Å; S370-E373 PolarHBondContact O-N 3.12Å; S370-N374 VanDerWaalsContact O-CG 3.24Å; S370-N374 PolarHBondContact O-N 2.8Å; S370-N374 VanDerWaalsContact O-N 3.07Å; S370-N374 PolarHBondContact O-ND2 3.11Å
371	L	98.3	Very high	96.6	Very high	83 Å²	83	68.8 Å²	68.8	44%	0.435	36%	0.359	S	S	.	.	H	α-helix	trans	-67.4	-37	176.5	-68.3	171.9	0	0	0	112.4	M309 P367 T368 I369 K375	M309-L371 HydrophobicContact CB-CD2 3.82Å; M309-L371 HydrophobicContact CB-CG 3.87Å; M309-L371 HydrophobicContact CG-CD2 4.44Å; M309-L371 HydrophobicContact CG-CG 4.36Å; P367-L371 WeakPolarHBondContact O-CG 3.27Å; P367-L371 PolarHBondContact O-N 2.89Å; P367-L371 VanDerWaalsContact O-N 3.12Å; T368-L371 PolarHBondContact O-N 3.23Å; I369-L371 VanDerWaalsContact C-N 3.3Å; I369-L371 PolarHBondContact O-N 3.26Å; L371-K375 WeakPolarHBondContact O-CG 3.47Å; L371-K375 PolarHBondContact O-N 3.22Å; L371-K375 VanDerWaalsContact O-N 3.14Å
372	I	98.3	Very high	96.4	Very high	82 Å²	82	72.4 Å²	72.4	42%	0.421	38%	0.378	S	S	.	.	H	α-helix	trans	-64.5	-47.4	175.7	-69.3	163.9	0	0	0	110.3	L320 T368 I369 N374 K375 M376	L320-I372 HydrophobicContact CD1-CG2 4.47Å; T368-I372 WeakPolarHBondContact O-CG1 3.5Å; T368-I372 PolarHBondContact O-N 3.42Å; I369-I372 HydrophobicContact CD1-CD1 4.1Å; I369-I372 PolarHBondContact O-N 3.35Å; I369-I372 VanDerWaalsContact O-N 3.14Å; I372-N374 VanDerWaalsContact C-N 3.33Å; I372-N374 PolarHBondContact O-N 2.55Å; I372-K375 PolarHBondContact O-N 2.93Å; I372-K375 VanDerWaalsContact O-N 3.11Å; I372-M376 HydrophobicContact CG2-CG 4.35Å; I372-M376 HydrophobicContact CG2-SD 3.97Å; I372-M376 WeakPolarHBondContact O-CG 3.4Å; I372-M376 PolarHBondContact O-N 3.34Å
373	E	98.4	Very high	96.3	Very high	10 Å²	10	76.1 Å²	76.1	5%	0.047	40%	0.397	C	S	.	.	H	α-helix	trans	-59.7	-42.4	177.7	-73	176.6	147.5	0	0	111.6	R318 L320 S321 I369 S370 K375 M376 L377	R318-E373 WeakPolarHBondContact CA-OE1 3.37Å; R318-E373 WeakPolarHBondContact CB-OE1 3.49Å; R318-E373 WeakPolarHBondContact CB-OE2 3.22Å; R318-E373 IonicContact CZ-OE2 3.43Å; R318-E373 IonicContact NE-OE2 2.99Å; R318-E373 PolarHBondContact NE-OE2 3.45Å; R318-E373 IonicContact NH2-OE2 2.85Å; R318-E373 PolarHBondContact NH2-OE2 3.3Å; L320-E373 HydrophobicContact CB-CG 4.27Å; L320-E373 WeakPolarHBondContact CB-OE1 3.42Å; L320-E373 HydrophobicContact CD1-CG 4.22Å; L320-E373 PolarHBondContact N-OE1 3.2Å; L320-E373 VanDerWaalsContact N-OE1 3.08Å; S321-E373 PolarHBondContact N-OE1 3.02Å; S321-E373 PolarHBondContact OG-OE1 3.25Å; S321-E373 PolarHBondContact OG-OE2 3.33Å; I369-E373 HydrophobicContact CG2-CG 4.24Å; I369-E373 WeakPolarHBondContact O-CG 3.33Å; I369-E373 PolarHBondContact O-N 2.91Å; S370-E373 PolarHBondContact O-N 3.12Å; E373-K375 VanDerWaalsContact C-N 3.34Å; E373-K375 PolarHBondContact O-N 3.28Å; E373-M376 PolarHBondContact O-N 3.09Å; E373-L377 WeakPolarHBondContact O-CG 3.45Å; E373-L377 PolarHBondContact O-N 3.15Å; E373-L377 VanDerWaalsContact O-N 3.08Å
374	N	98.4	Very high	96.2	Very high	8 Å²	8	76.1 Å²	76.1	4%	0.043	40%	0.397	C	S	.	.	H	α-helix	trans	-56.9	-46.7	173.3	-69.1	-20.4	0	0	0	111.7	M309 K311 S370 I372 L377 K378 W379	M309-N374 PolarHBondContact O-ND2 2.82Å; K311-N374 PolarHBondContact N-OD1 3.26Å; S370-N374 VanDerWaalsContact O-CG 3.24Å; S370-N374 PolarHBondContact O-N 2.8Å; S370-N374 VanDerWaalsContact O-N 3.07Å; S370-N374 PolarHBondContact O-ND2 3.11Å; I372-N374 VanDerWaalsContact C-N 3.33Å; I372-N374 PolarHBondContact O-N 2.55Å; N374-L377 CarbonylContact O-C 3.51Å; N374-L377 PolarHBondContact O-N 2.83Å; N374-K378 PolarHBondContact O-N 3.38Å; N374-W379 HydrophobicContact CB-CB 4.33Å; N374-W379 PolarHBondContact O-N 3.31Å
375	K	97.8	Very high	96	Very high	163 Å²	163	75.1 Å²	75.1	71%	0.709	39%	0.392	S	S	*	.	H	α-helix	trans	-65	-39.1	178.7	-73	-179.7	-179.9	-177.3	0	112.4	L371 I372 E373 L377 K378	L371-K375 WeakPolarHBondContact O-CG 3.47Å; L371-K375 PolarHBondContact O-N 3.22Å; L371-K375 VanDerWaalsContact O-N 3.14Å; I372-K375 PolarHBondContact O-N 2.93Å; I372-K375 VanDerWaalsContact O-N 3.11Å; E373-K375 VanDerWaalsContact C-N 3.34Å; E373-K375 PolarHBondContact O-N 3.28Å; K375-L377 PolarHBondContact O-N 3.16Å; K375-K378 PolarHBondContact O-N 2.9Å
376	M	97.8	Very high	95.9	Very high	131 Å²	131	76.3 Å²	76.3	65%	0.645	40%	0.399	S	S	*	.	H	α-helix	trans	-60.3	-33.9	175	-70.2	172.9	66	0	0	111.8	L320 I372 E373 K378	L320-M376 HydrophobicContact CD1-SD 4.08Å; I372-M376 HydrophobicContact CG2-CG 4.35Å; I372-M376 HydrophobicContact CG2-SD 3.97Å; I372-M376 WeakPolarHBondContact O-CG 3.4Å; I372-M376 PolarHBondContact O-N 3.34Å; E373-M376 PolarHBondContact O-N 3.09Å; M376-K378 VanDerWaalsContact C-N 3.28Å; M376-K378 PolarHBondContact O-N 2.86Å
377	L	97.7	Very high	95.7	Very high	86 Å²	86	79.9 Å²	79.9	45%	0.45	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	4.8	174.8	-64.4	176.2	0	0	0	113.8	E373 N374 K375 W379	E373-L377 WeakPolarHBondContact O-CG 3.45Å; E373-L377 PolarHBondContact O-N 3.15Å; E373-L377 VanDerWaalsContact O-N 3.08Å; N374-L377 CarbonylContact O-C 3.51Å; N374-L377 PolarHBondContact O-N 2.83Å; K375-L377 PolarHBondContact O-N 3.16Å; L377-W379 HydrophobicContact CB-CD2 4.19Å; L377-W379 HydrophobicContact CB-CE3 4.2Å; L377-W379 HydrophobicContact CD1-CE3 3.9Å; L377-W379 HydrophobicContact CD1-CH2 3.97Å; L377-W379 HydrophobicContact CD1-CZ3 3.59Å; L377-W379 PolarHBondContact O-N 3.34Å
378	K	96.3	Very high	95.5	Very high	194 Å²	194	85 Å²	85	84%	0.843	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.7	31.8	-176.3	-53.1	177.4	-178.3	176.8	0	113.1	N374 K375 M376	N374-K378 PolarHBondContact O-N 3.38Å; K375-K378 PolarHBondContact O-N 2.9Å; M376-K378 VanDerWaalsContact C-N 3.28Å; M376-K378 PolarHBondContact O-N 2.86Å
379	W	92.9	Very high	95.2	Very high	103 Å²	103	87.1 Å²	87.1	39%	0.39	45%	0.45	S	S	.	.			trans	-81.8	135.5	169.4	-74.9	-24.4	0	0	0	111	K311 Q312 N374 L377	K311-W379 HydrophobicContact CB-CD2 4.02Å; K311-W379 HydrophobicContact CB-CE3 3.45Å; K311-W379 VanDerWaalsContact CB-CE3 3.45Å; K311-W379 HydrophobicContact CB-CH2 4.39Å; K311-W379 HydrophobicContact CB-CZ3 3.67Å; K311-W379 HydrophobicContact CG-CB 4.22Å; K311-W379 HydrophobicContact CG-CD2 4.18Å; K311-W379 HydrophobicContact CG-CE3 3.83Å; K311-W379 HydrophobicContact CG-CG 4.41Å; Q312-W379 HydrophobicContact CB-CZ3 4.46Å; Q312-W379 HydrophobicContact CG-CH2 3.44Å; Q312-W379 VanDerWaalsContact CG-CH2 3.44Å; Q312-W379 HydrophobicContact CG-CZ3 3.6Å; N374-W379 HydrophobicContact CB-CB 4.33Å; N374-W379 PolarHBondContact O-N 3.31Å; L377-W379 HydrophobicContact CB-CD2 4.19Å; L377-W379 HydrophobicContact CB-CE3 4.2Å; L377-W379 HydrophobicContact CD1-CE3 3.9Å; L377-W379 HydrophobicContact CD1-CH2 3.97Å; L377-W379 HydrophobicContact CD1-CZ3 3.59Å; L377-W379 PolarHBondContact O-N 3.34Å
380	A	71.1	Confident	95	Very high	146 Å²	146	91.9 Å²	91.9	100%	1.207	48%	0.475	S	S	*	.			trans	-71.7	0	-180	0	0	0	0	0	112.9	K311	K311-A380 WeakPolarHBondContact CE-O 3.05Å; K311-A380 PolarHBondContact NZ-O 3.3Å

Retrieved 380 of 380 residues in 276.7 ms (Link to these results)

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