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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 A0A059QHA2, 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	81.9	Confident	92.8	Very high	242 Å²	242	110.5 Å²	110.5	100%	1.192	57%	0.573	S	S	*	*				0	135	0	-71.4	174.9	173.2	0	0	108.5
2	T	89.2	Confident	92.9	Very high	102 Å²	102	109.5 Å²	109.5	63%	0.626	56%	0.56	S	S	*	*			trans	-64.3	134.3	172.5	21.7	0	0	0	0	109.4	I7	T2-I7 WeakPolarHBondContact O-CD1 3.45Å
3	P	94.1	Very high	92.9	Very high	59 Å²	59	110.5 Å²	110.5	38%	0.383	57%	0.567	S	S	.	*			trans	-70.1	148	-176.5	29.2	-35.4	0	0	0	110.8	R5 K6	P3-R5 HydrophobicContact CB-CG 4.16Å; P3-R5 HydrophobicContact CG-CG 4.1Å; P3-R5 PolarHBondContact O-N 3.13Å; P3-K6 HydrophobicContact CG-CB 4.36Å; P3-K6 HydrophobicContact CG-CD 3.97Å; P3-K6 HydrophobicContact CG-CG 3.99Å; P3-K6 PolarHBondContact O-N 2.94Å
4	M	94.3	Very high	92.9	Very high	136 Å²	136	109.6 Å²	109.6	67%	0.67	56%	0.562	S	S	*	*	H	α-helix	trans	-52.5	-34.1	178.8	-77.6	-63.9	-171.2	0	0	113	K6 I7 N8 M11	M4-K6 PolarHBondContact O-N 3.29Å; M4-I7 PolarHBondContact O-N 3.27Å; M4-N8 PolarHBondContact O-N 2.89Å; M4-M11 HydrophobicContact CB-SD 4.48Å
5	R	95.2	Very high	93.1	Very high	94 Å²	94	102.3 Å²	102.3	36%	0.355	53%	0.525	S	S	.	.	H	α-helix	trans	-59.2	-19	177	79.8	-176.2	-161.7	-162.6	2.9	114.6	P3 M11 K12 N15 D20	P3-R5 HydrophobicContact CB-CG 4.16Å; P3-R5 HydrophobicContact CG-CG 4.1Å; P3-R5 PolarHBondContact O-N 3.13Å; R5-M11 HydrophobicContact CB-CE 4.4Å; R5-M11 CarbonylContact O-C 3.58Å; R5-K12 VanDerWaalsContact O-CA 3.31Å; R5-K12 WeakPolarHBondContact O-CA 3.27Å; R5-K12 PolarHBondContact O-N 3.11Å; R5-N15 HydrophobicContact CB-CB 4.4Å; R5-N15 WeakPolarHBondContact CD-OD1 3.38Å; R5-N15 HydrophobicContact CG-CB 4.44Å; R5-N15 WeakPolarHBondContact CG-OD1 3.4Å; R5-N15 PolarHBondContact NE-OD1 3.44Å; R5-N15 VanDerWaalsContact O-CB 3.23Å; R5-N15 WeakPolarHBondContact O-CB 3.45Å; R5-D20 IonicContact CZ-OD1 3.62Å; R5-D20 IonicContact NE-OD2 3.9Å; R5-D20 IonicContact NH2-OD1 2.77Å; R5-D20 PolarHBondContact NH2-OD1 3.09Å; R5-D20 IonicContact NH2-OD2 3.51Å
6	K	94.3	Very high	93.2	Very high	95 Å²	95	102.3 Å²	102.3	41%	0.413	52%	0.521	S	S	.	.	H	α-helix	trans	-102	-12.2	177	-67.1	-174.1	177.4	-171.5	0	113.4	P3 M4 D20	P3-K6 HydrophobicContact CG-CB 4.36Å; P3-K6 HydrophobicContact CG-CD 3.97Å; P3-K6 HydrophobicContact CG-CG 3.99Å; P3-K6 PolarHBondContact O-N 2.94Å; M4-K6 PolarHBondContact O-N 3.29Å; K6-D20 WeakPolarHBondContact CE-OD2 3.47Å; K6-D20 IonicContact NZ-OD2 3.34Å; K6-D20 PolarHBondContact NZ-OD2 2.81Å
7	I	95	Very high	93.1	Very high	93 Å²	93	97.5 Å²	97.5	48%	0.477	50%	0.5	S	S	.	.	H	α-helix	trans	-105.9	-50	-173.5	-57.4	169.3	0	0	0	110.7	T2 M4	T2-I7 WeakPolarHBondContact O-CD1 3.45Å; M4-I7 PolarHBondContact O-N 3.27Å
8	N	96	Very high	93	Very high	64 Å²	64	98.6 Å²	98.6	34%	0.342	50%	0.5	S	S	.	.	S	Bend	trans	-63.2	127.9	-177.2	176	-78.6	0	0	0	110	M4 L10 M11 K12	M4-N8 PolarHBondContact O-N 2.89Å; N8-L10 VanDerWaalsContact C-N 3.29Å; N8-L10 PolarHBondContact O-N 3.33Å; N8-L10 PolarHBondContact OD1-N 2.97Å; N8-M11 HydrophobicContact CB-CB 4.05Å; N8-M11 HydrophobicContact CB-CG 4.01Å; N8-M11 HydrophobicContact CB-SD 4.18Å; N8-M11 PolarHBondContact O-N 3.37Å; N8-M11 PolarHBondContact OD1-N 3.42Å; N8-K12 WeakPolarHBondContact O-CB 3.4Å; N8-K12 PolarHBondContact O-N 2.66Å
9	P	94.1	Very high	93.2	Very high	107 Å²	107	95.7 Å²	95.7	70%	0.695	49%	0.486	S	S	*	.	H	α-helix	trans	-55	-39.3	-173.6	-29.2	35.4	0	0	0	114.7
10	L	92.5	Very high	93.4	Very high	134 Å²	134	92.7 Å²	92.7	70%	0.702	47%	0.471	S	S	*	.	H	α-helix	trans	-75.8	-48.5	178.8	-65.5	176	0	0	0	111.5	N8 K12 L13 I14	N8-L10 VanDerWaalsContact C-N 3.29Å; N8-L10 PolarHBondContact O-N 3.33Å; N8-L10 PolarHBondContact OD1-N 2.97Å; L10-K12 PolarHBondContact O-N 3.41Å; L10-L13 WeakPolarHBondContact O-CB 3.35Å; L10-L13 PolarHBondContact O-N 3.2Å; L10-I14 PolarHBondContact O-N 3.22Å
11	M	93.8	Very high	93.6	Very high	90 Å²	90	89.5 Å²	89.5	44%	0.443	46%	0.455	S	S	.	.	H	α-helix	trans	-64.7	-29.6	179.5	-58.3	-176.4	80.1	0	0	111.9	M4 R5 N8 I14 N15	M4-M11 HydrophobicContact CB-SD 4.48Å; R5-M11 HydrophobicContact CB-CE 4.4Å; R5-M11 CarbonylContact O-C 3.58Å; N8-M11 HydrophobicContact CB-CB 4.05Å; N8-M11 HydrophobicContact CB-CG 4.01Å; N8-M11 HydrophobicContact CB-SD 4.18Å; N8-M11 PolarHBondContact O-N 3.37Å; N8-M11 PolarHBondContact OD1-N 3.42Å; M11-I14 PolarHBondContact O-N 3.1Å; M11-N15 VanDerWaalsContact O-CB 3.25Å; M11-N15 WeakPolarHBondContact O-CB 3.36Å; M11-N15 PolarHBondContact O-N 2.87Å
12	K	94.1	Very high	94.3	Very high	98 Å²	98	81.4 Å²	81.4	43%	0.426	42%	0.42	S	S	.	.	H	α-helix	trans	-61.8	-43.6	175.6	-179.2	175.7	179.4	-173.7	0	111.2	R5 N8 L10 N15 H16	R5-K12 VanDerWaalsContact O-CA 3.31Å; R5-K12 WeakPolarHBondContact O-CA 3.27Å; R5-K12 PolarHBondContact O-N 3.11Å; N8-K12 WeakPolarHBondContact O-CB 3.4Å; N8-K12 PolarHBondContact O-N 2.66Å; L10-K12 PolarHBondContact O-N 3.41Å; K12-N15 PolarHBondContact O-N 3Å; K12-H16 WeakPolarHBondContact CE-NE2 3.36Å; K12-H16 VanDerWaalsContact CG-CD2 3.48Å; K12-H16 WeakPolarHBondContact CG-CD2 3.46Å; K12-H16 PolarHBondContact O-CD2 2.86Å; K12-H16 PolarHBondContact O-N 3.42Å
13	L	92.9	Very high	94.8	Very high	123 Å²	123	76.7 Å²	76.7	64%	0.644	39%	0.391	S	S	*	.	H	α-helix	trans	-59.9	-47.3	175.3	-177.8	67.7	0	0	0	111.3	L10 N15 H16 S17	L10-L13 WeakPolarHBondContact O-CB 3.35Å; L10-L13 PolarHBondContact O-N 3.2Å; L13-N15 VanDerWaalsContact C-N 3.34Å; L13-N15 PolarHBondContact O-N 3Å; L13-H16 PolarHBondContact O-N 3.13Å; L13-S17 VanDerWaalsContact O-CB 3.25Å; L13-S17 WeakPolarHBondContact O-CB 3.49Å; L13-S17 PolarHBondContact O-N 3.14Å; L13-S17 PolarHBondContact O-OG 3.47Å
14	I	93.8	Very high	95	Very high	98 Å²	98	73.9 Å²	73.9	50%	0.503	37%	0.373	S	S	.	.	H	α-helix	trans	-61.8	-44.3	176.8	-61.5	172.3	0	0	0	110.4	L10 M11 H16 S17 F18	L10-I14 PolarHBondContact O-N 3.22Å; M11-I14 PolarHBondContact O-N 3.1Å; I14-H16 PolarHBondContact O-N 3.33Å; I14-S17 PolarHBondContact O-N 3.36Å; I14-F18 WeakPolarHBondContact O-CB 3.37Å; I14-F18 PolarHBondContact O-N 3.07Å
15	N	95.9	Very high	95.2	Very high	0 Å²	0	69.4 Å²	69.4	0%	0	36%	0.355	C	S	.	.	I	π-helix	trans	-62.2	-46.1	-178.4	-176	79.6	0	0	0	111.8	R5 M11 K12 L13 S17 I19 D20	R5-N15 HydrophobicContact CB-CB 4.4Å; R5-N15 WeakPolarHBondContact CD-OD1 3.38Å; R5-N15 HydrophobicContact CG-CB 4.44Å; R5-N15 WeakPolarHBondContact CG-OD1 3.4Å; R5-N15 PolarHBondContact NE-OD1 3.44Å; R5-N15 VanDerWaalsContact O-CB 3.23Å; R5-N15 WeakPolarHBondContact O-CB 3.45Å; M11-N15 VanDerWaalsContact O-CB 3.25Å; M11-N15 WeakPolarHBondContact O-CB 3.36Å; M11-N15 PolarHBondContact O-N 2.87Å; K12-N15 PolarHBondContact O-N 3Å; L13-N15 VanDerWaalsContact C-N 3.34Å; L13-N15 PolarHBondContact O-N 3Å; N15-S17 VanDerWaalsContact C-N 3.31Å; N15-S17 PolarHBondContact O-N 3.42Å; N15-I19 PolarHBondContact O-N 3Å; N15-D20 PolarHBondContact ND2-OD2 2.98Å; N15-D20 PolarHBondContact O-N 3.19Å; N15-D20 PolarHBondContact OD1-OD2 2.69Å
16	H	93.9	Very high	95.3	Very high	101 Å²	101	67.7 Å²	67.7	47%	0.468	35%	0.353	S	S	.	.	I	π-helix	trans	-71	-26.4	178.7	-73.9	-66.8	0	0	0	113.4	K12 L13 I14 L21	K12-H16 WeakPolarHBondContact CE-NE2 3.36Å; K12-H16 VanDerWaalsContact CG-CD2 3.48Å; K12-H16 WeakPolarHBondContact CG-CD2 3.46Å; K12-H16 PolarHBondContact O-CD2 2.86Å; K12-H16 PolarHBondContact O-N 3.42Å; L13-H16 PolarHBondContact O-N 3.13Å; I14-H16 PolarHBondContact O-N 3.33Å; H16-L21 WeakPolarHBondContact O-CB 3.42Å
17	S	91.9	Very high	95.5	Very high	22 Å²	22	63.9 Å²	63.9	15%	0.154	34%	0.337	C	S	.	.	I	π-helix	trans	-92.7	-25.2	-176.7	-56.6	0	0	0	0	114	L13 I14 N15 L21	L13-S17 VanDerWaalsContact O-CB 3.25Å; L13-S17 WeakPolarHBondContact O-CB 3.49Å; L13-S17 PolarHBondContact O-N 3.14Å; L13-S17 PolarHBondContact O-OG 3.47Å; I14-S17 PolarHBondContact O-N 3.36Å; N15-S17 VanDerWaalsContact C-N 3.31Å; N15-S17 PolarHBondContact O-N 3.42Å; S17-L21 WeakPolarHBondContact O-CD2 3.18Å
18	F	91.8	Very high	95.7	Very high	117 Å²	117	61.2 Å²	61.2	51%	0.513	33%	0.326	S	S	.	.	I	π-helix	trans	-135.8	-20.9	-171.4	-77.6	-82.4	0	0	0	115.7	I14 F220	I14-F18 WeakPolarHBondContact O-CB 3.37Å; I14-F18 PolarHBondContact O-N 3.07Å; F18-F220 WeakPolarHBondContact O-CD1 3.41Å
19	I	96.4	Very high	95.8	Very high	44 Å²	44	61.4 Å²	61.4	23%	0.226	34%	0.337	C	S	.	.	I	π-helix	trans	-105.8	-68.5	-173.9	-54.7	177.7	0	0	0	110.3	N15 L21 F220 H221	N15-I19 PolarHBondContact O-N 3Å; I19-L21 VanDerWaalsContact C-N 3.28Å; I19-L21 PolarHBondContact O-N 3.48Å; I19-F220 PolarHBondContact O-N 3.27Å; I19-H221 HydrophobicContact CG2-CB 4.07Å; I19-H221 PolarHBondContact O-N 3.11Å
20	D	97.3	Very high	96	Very high	35 Å²	35	61 Å²	61	19%	0.187	32%	0.322	C	S	.	.	S	Bend	trans	-91.7	14	-176.8	-66	-14.4	0	0	0	111.7	R5 K6 N15 P22	R5-D20 IonicContact CZ-OD1 3.62Å; R5-D20 IonicContact NE-OD2 3.9Å; R5-D20 IonicContact NH2-OD1 2.77Å; R5-D20 PolarHBondContact NH2-OD1 3.09Å; R5-D20 IonicContact NH2-OD2 3.51Å; K6-D20 WeakPolarHBondContact CE-OD2 3.47Å; K6-D20 IonicContact NZ-OD2 3.34Å; K6-D20 PolarHBondContact NZ-OD2 2.81Å; N15-D20 PolarHBondContact ND2-OD2 2.98Å; N15-D20 PolarHBondContact O-N 3.19Å; N15-D20 PolarHBondContact OD1-OD2 2.69Å; D20-P22 WeakPolarHBondContact O-CD 3.34Å
21	L	97.4	Very high	96.3	Very high	26 Å²	26	55.8 Å²	55.8	14%	0.136	29%	0.293	C	S	.	.			trans	-61.2	117.3	178.6	176	67	0	0	0	110.4	H16 S17 I19 T23 F220	H16-L21 WeakPolarHBondContact O-CB 3.42Å; S17-L21 WeakPolarHBondContact O-CD2 3.18Å; I19-L21 VanDerWaalsContact C-N 3.28Å; I19-L21 PolarHBondContact O-N 3.48Å; L21-T23 PolarHBondContact O-N 3.5Å; L21-T23 PolarHBondContact O-OG1 2.99Å; L21-F220 HydrophobicContact CB-CB 3.95Å; L21-F220 HydrophobicContact CD2-CD2 4.25Å; L21-F220 PolarHBondContact O-N 3.05Å
22	P	97.4	Very high	96.5	Very high	71 Å²	71	52 Å²	52	46%	0.461	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	113.3	178	-17.5	33	0	0	0	110.9	D20 K217	D20-P22 WeakPolarHBondContact O-CD 3.34Å; P22-K217 HydrophobicContact CB-CB 4.16Å; P22-K217 HydrophobicContact CB-CD 3.64Å
23	T	98.1	Very high	96.8	Very high	4 Å²	4	48.9 Å²	48.9	3%	0.025	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	139.9	-174.4	-51.5	0	0	0	0	109.5	L21 S25 I27 K217 I218 Y224	L21-T23 PolarHBondContact O-N 3.5Å; L21-T23 PolarHBondContact O-OG1 2.99Å; T23-S25 PolarHBondContact O-N 3.05Å; T23-I27 HydrophobicContact CG2-CD1 3.64Å; T23-I27 HydrophobicContact CG2-CG1 4.27Å; T23-K217 WeakPolarHBondContact O-CA 3.36Å; T23-I218 PolarHBondContact N-O 2.92Å; T23-I218 PolarHBondContact O-N 2.82Å; 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 4.35Å
24	P	98.3	Very high	97	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.3	139.1	175.5	-18.9	26.3	0	0	0	110.7	N26 I27 S205 N207 S213 Y224	P24-N26 PolarHBondContact O-N 3.15Å; P24-I27 HydrophobicContact CB-CG2 4.12Å; P24-I27 HydrophobicContact CG-CG2 4.17Å; P24-S205 VanDerWaalsContact CG-O 3.28Å; P24-S205 WeakPolarHBondContact CG-O 3.19Å; P24-N207 HydrophobicContact CB-CB 3.86Å; P24-N207 HydrophobicContact CG-CB 4.17Å; P24-S213 WeakPolarHBondContact CB-OG 3.44Å; P24-S213 WeakPolarHBondContact CG-OG 3.35Å; P24-Y224 PolarHBondContact O-OH 2.67Å
25	S	98.3	Very high	97.2	Very high	42 Å²	42	42.1 Å²	42.1	29%	0.294	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-19.9	-177.2	63	0	0	0	0	114.5	T23 D216 Y224	T23-S25 PolarHBondContact O-N 3.05Å; S25-D216 VanDerWaalsContact CB-OD2 3.29Å; S25-D216 WeakPolarHBondContact CB-OD2 3.3Å; S25-D216 PolarHBondContact N-O 2.99Å; S25-D216 PolarHBondContact OG-OD2 3.48Å; S25-Y224 VanDerWaalsContact C-OH 3.28Å; S25-Y224 PolarHBondContact O-OH 2.96Å
26	N	98.3	Very high	97.4	Very high	57 Å²	57	42.8 Å²	42.8	31%	0.305	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.9	15.9	-166.4	69.4	-28.7	0	0	0	114.7	P24 S28 N207 P208	P24-N26 PolarHBondContact O-N 3.15Å; N26-S28 PolarHBondContact O-N 3.22Å; N26-N207 PolarHBondContact ND2-OD1 3.44Å; N26-N207 WeakPolarHBondContact OD1-CB 3.48Å; N26-P208 VanDerWaalsContact O-CD 3.27Å; N26-P208 WeakPolarHBondContact O-CD 3.17Å; N26-P208 WeakPolarHBondContact O-CG 3.3Å
27	I	98.5	Very high	97.6	Very high	16 Å²	16	39.1 Å²	39.1	8%	0.082	23%	0.226	C	C	.	.			trans	-68.1	129.2	177.4	53.5	161.4	0	0	0	111.1	T23 P24 W31 N206 N207 Y224 K227	T23-I27 HydrophobicContact CG2-CD1 3.64Å; T23-I27 HydrophobicContact CG2-CG1 4.27Å; P24-I27 HydrophobicContact CB-CG2 4.12Å; P24-I27 HydrophobicContact CG-CG2 4.17Å; I27-W31 HydrophobicContact CB-CB 4.04Å; I27-W31 HydrophobicContact CB-CD2 3.75Å; I27-W31 HydrophobicContact CB-CE3 4.21Å; I27-W31 HydrophobicContact CB-CG 3.64Å; I27-W31 HydrophobicContact CD1-CB 3.78Å; I27-W31 HydrophobicContact CD1-CG 3.91Å; I27-W31 HydrophobicContact CG1-CB 4.38Å; I27-W31 HydrophobicContact CG1-CG 4.34Å; I27-W31 HydrophobicContact CG2-CD2 3.76Å; I27-W31 HydrophobicContact CG2-CE3 4.45Å; I27-W31 HydrophobicContact CG2-CG 3.83Å; I27-W31 HydrophobicContact CG2-CZ2 4.27Å; I27-N206 WeakPolarHBondContact CG2-O 3.38Å; I27-N207 HydrophobicContact CG2-CB 4.12Å; I27-Y224 HydrophobicContact CD1-CD1 3.78Å; I27-Y224 HydrophobicContact CD1-CD2 4.44Å; I27-Y224 HydrophobicContact CD1-CE1 3.47Å; I27-Y224 VanDerWaalsContact CD1-CE1 3.47Å; I27-Y224 HydrophobicContact CD1-CE2 4.13Å; I27-Y224 HydrophobicContact CD1-CG 4.29Å; I27-Y224 HydrophobicContact CG1-CD1 4.09Å; I27-Y224 HydrophobicContact CG1-CE1 3.26Å; I27-Y224 HydrophobicContact CG1-CE2 4.11Å; I27-Y224 WeakPolarHBondContact CG1-OH 3.38Å; I27-K227 PolarHBondContact O-NZ 3Å
28	S	98.4	Very high	97.9	Very high	36 Å²	36	39.7 Å²	39.7	25%	0.252	24%	0.235	S	C	.	.			trans	-81.6	-179.1	-175.9	63.4	0	0	0	0	112.5	N26 W30 W31 K227	N26-S28 PolarHBondContact O-N 3.22Å; S28-W30 PolarHBondContact O-N 3.13Å; S28-W30 VanDerWaalsContact O-N 3.12Å; S28-W31 PolarHBondContact O-N 3.3Å; S28-W31 VanDerWaalsContact O-N 3.11Å; S28-K227 PolarHBondContact O-NZ 3.45Å
29	A	98.6	Very high	98.3	Very high	69 Å²	69	35.3 Å²	35.3	57%	0.57	22%	0.22	S	C	*	.	G	3₁₀ helix	trans	-56.8	-24.5	177.6	0	0	0	0	0	113.4	W31 N32	A29-W31 PolarHBondContact O-N 3.42Å; A29-W31 VanDerWaalsContact O-N 3.12Å; A29-N32 WeakPolarHBondContact CA-OD1 3.38Å; A29-N32 VanDerWaalsContact O-CB 3.27Å; A29-N32 WeakPolarHBondContact O-CB 3.32Å; A29-N32 PolarHBondContact O-N 3.47Å; A29-N32 PolarHBondContact O-OD1 2.69Å; A29-N32 VanDerWaalsContact O-OD1 3.13Å
30	W	98.7	Very high	98.4	Very high	99 Å²	99	33.2 Å²	33.2	38%	0.375	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-61.6	-20.8	177.1	-59	115.4	0	0	0	113.7	S28 N32 F33 L96 R100 Y104	S28-W30 PolarHBondContact O-N 3.13Å; S28-W30 VanDerWaalsContact O-N 3.12Å; W30-N32 VanDerWaalsContact C-N 3.33Å; W30-F33 HydrophobicContact CE3-CD2 4.18Å; W30-F33 AromaticContact CE3-CE2 3.6Å; W30-F33 HydrophobicContact CE3-CE2 3.6Å; W30-F33 AromaticContact CZ3-CE2 3.93Å; W30-F33 HydrophobicContact CZ3-CE2 3.93Å; W30-F33 WeakPolarHBondContact O-CD2 3.36Å; W30-L96 HydrophobicContact CZ3-CD2 4.13Å; W30-R100 HydrophobicContact CB-CB 4.07Å; W30-R100 HydrophobicContact CB-CG 3.52Å; W30-Y104 HydrophobicContact CB-CE2 4.26Å; W30-Y104 AromaticContact CD1-CE2 3.83Å; W30-Y104 HydrophobicContact CG-CE2 4.2Å
31	W	98.7	Very high	98.5	Very high	23 Å²	23	32.4 Å²	32.4	9%	0.087	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-77	-17.9	175.3	-87.2	-113.2	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 3.75Å; I27-W31 HydrophobicContact CB-CE3 4.21Å; I27-W31 HydrophobicContact CB-CG 3.64Å; I27-W31 HydrophobicContact CD1-CB 3.78Å; I27-W31 HydrophobicContact CD1-CG 3.91Å; I27-W31 HydrophobicContact CG1-CB 4.38Å; I27-W31 HydrophobicContact CG1-CG 4.34Å; I27-W31 HydrophobicContact CG2-CD2 3.76Å; I27-W31 HydrophobicContact CG2-CE3 4.45Å; I27-W31 HydrophobicContact CG2-CG 3.83Å; I27-W31 HydrophobicContact CG2-CZ2 4.27Å; S28-W31 PolarHBondContact O-N 3.3Å; S28-W31 VanDerWaalsContact O-N 3.11Å; A29-W31 PolarHBondContact O-N 3.42Å; A29-W31 VanDerWaalsContact O-N 3.12Å; W31-F33 PolarHBondContact O-N 3.39Å; W31-G34 PolarHBondContact O-N 2.88Å; W31-R100 VanDerWaalsContact CE2-NH1 3.27Å; W31-R100 HydrophobicContact CE3-CG 4.31Å; W31-R100 HydrophobicContact CZ3-CG 4.22Å; W31-Y104 HydrophobicContact CH2-CD1 4.18Å; W31-Y104 AromaticContact CH2-CD2 3.56Å; W31-Y104 HydrophobicContact CH2-CD2 3.56Å; W31-Y104 HydrophobicContact CH2-CE2 4.02Å; W31-Y104 AromaticContact CH2-CG 3.63Å; W31-Y104 HydrophobicContact CH2-CG 3.63Å; W31-Y104 AromaticContact CZ3-CD2 3.62Å; W31-Y104 HydrophobicContact CZ3-CD2 3.62Å; W31-Y104 AromaticContact CZ3-CE2 3.61Å; W31-Y104 HydrophobicContact CZ3-CE2 3.61Å; W31-Y104 HydrophobicContact CZ3-CG 4.1Å; W31-N206 VanDerWaalsContact CE2-O 3.3Å; W31-N206 HydrophobicContact CZ2-CB 4.33Å; W31-N206 VanDerWaalsContact CZ2-O 3.29Å; W31-N206 WeakPolarHBondContact CZ2-O 3.42Å; W31-N206 PolarHBondContact NE1-O 3.47Å; W31-P208 HydrophobicContact CH2-CG 4.09Å; W31-P208 HydrophobicContact CZ3-CG 3.84Å
32	N	98.7	Very high	98.5	Very high	12 Å²	12	36.5 Å²	36.5	6%	0.064	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-66.9	-22.9	178.7	-67.1	66.1	0	0	0	112.6	A29 W30 G34 S35 L36 K227 D228	A29-N32 WeakPolarHBondContact CA-OD1 3.38Å; A29-N32 VanDerWaalsContact O-CB 3.27Å; A29-N32 WeakPolarHBondContact O-CB 3.32Å; A29-N32 PolarHBondContact O-N 3.47Å; A29-N32 PolarHBondContact O-OD1 2.69Å; A29-N32 VanDerWaalsContact O-OD1 3.13Å; W30-N32 VanDerWaalsContact C-N 3.33Å; N32-G34 PolarHBondContact O-N 3.49Å; N32-G34 VanDerWaalsContact O-N 3.09Å; N32-S35 PolarHBondContact O-N 2.94Å; N32-S35 VanDerWaalsContact O-N 3.12Å; N32-S35 PolarHBondContact O-OG 3.01Å; N32-L36 WeakPolarHBondContact O-CG 3.34Å; N32-L36 PolarHBondContact O-N 2.89Å; N32-K227 PolarHBondContact ND2-O 3.02Å; N32-K227 VanDerWaalsContact ND2-O 3.1Å; N32-K227 WeakPolarHBondContact OD1-CE 3.35Å; N32-K227 PolarHBondContact OD1-NZ 2.61Å; N32-D228 PolarHBondContact ND2-OD1 3.44Å
33	F	98.8	Very high	98.6	Very high	31 Å²	31	34.8 Å²	34.8	14%	0.136	21%	0.213	C	C	.	.	H	α-helix	trans	-62.8	-20.4	-179.1	-70.3	-69.2	0	0	0	113.5	W30 W31 L36 L37 C93 L96 H97	W30-F33 HydrophobicContact CE3-CD2 4.18Å; W30-F33 AromaticContact CE3-CE2 3.6Å; W30-F33 HydrophobicContact CE3-CE2 3.6Å; W30-F33 AromaticContact CZ3-CE2 3.93Å; W30-F33 HydrophobicContact CZ3-CE2 3.93Å; W30-F33 WeakPolarHBondContact O-CD2 3.36Å; W31-F33 PolarHBondContact O-N 3.39Å; F33-L36 HydrophobicContact CD1-CD1 3.97Å; F33-L36 HydrophobicContact CE1-CD1 4.1Å; F33-L37 WeakPolarHBondContact O-CB 3.28Å; F33-L37 WeakPolarHBondContact O-CD1 3.39Å; F33-L37 WeakPolarHBondContact O-CG 3.41Å; F33-L37 PolarHBondContact O-N 2.84Å; F33-C93 HydrophobicContact CD1-CB 4.08Å; F33-L96 HydrophobicContact CD1-CB 4.05Å; F33-L96 HydrophobicContact CD1-CD1 4.41Å; F33-L96 HydrophobicContact CD2-CB 3.92Å; F33-L96 HydrophobicContact CE1-CB 3.91Å; F33-L96 HydrophobicContact CE1-CD1 3.49Å; F33-L96 VanDerWaalsContact CE1-CD1 3.49Å; F33-L96 HydrophobicContact CE1-CG 4.33Å; F33-L96 HydrophobicContact CE2-CB 3.78Å; F33-L96 HydrophobicContact CE2-CD1 4.06Å; F33-L96 HydrophobicContact CG-CB 4.08Å; F33-L96 HydrophobicContact CZ-CB 3.78Å; F33-L96 HydrophobicContact CZ-CD1 3.29Å; F33-L96 HydrophobicContact CZ-CG 4.15Å; F33-H97 HydrophobicContact CB-CB 3.92Å
34	G	98.3	Very high	98.6	Very high	35 Å²	35	35.8 Å²	35.8	36%	0.361	22%	0.217	S	C	.	.	H	α-helix	trans	-65.1	-49.9	171.4	0	0	0	0	0	112.6	W31 N32 L37 G38 H97	W31-G34 PolarHBondContact O-N 2.88Å; N32-G34 PolarHBondContact O-N 3.49Å; N32-G34 VanDerWaalsContact O-N 3.09Å; G34-L37 PolarHBondContact O-N 3.47Å; G34-G38 PolarHBondContact O-N 3.42Å; G34-H97 PolarHBondContact N-ND1 3.12Å
35	S	98.3	Very high	98.7	Very high	44 Å²	44	37.6 Å²	37.6	31%	0.308	23%	0.226	S	C	.	.	H	α-helix	trans	-70.8	-34.8	177.6	46	0	0	0	0	112.4	N32 L37 G38 A39 D228	N32-S35 PolarHBondContact O-N 2.94Å; N32-S35 VanDerWaalsContact O-N 3.12Å; N32-S35 PolarHBondContact O-OG 3.01Å; S35-L37 PolarHBondContact O-N 3.22Å; S35-G38 PolarHBondContact O-N 3.22Å; S35-A39 PolarHBondContact O-N 2.75Å; S35-D228 WeakPolarHBondContact CB-OD2 3.48Å; S35-D228 PolarHBondContact OG-OD2 3.17Å
36	L	98.8	Very high	98.7	Very high	14 Å²	14	38.7 Å²	38.7	7%	0.073	23%	0.231	C	C	.	.	H	α-helix	trans	-62.6	-39.1	173.2	-66.1	-178.2	0	0	0	112.7	N32 F33 G38 A39 C40 F235	N32-L36 WeakPolarHBondContact O-CG 3.34Å; N32-L36 PolarHBondContact O-N 2.89Å; F33-L36 HydrophobicContact CD1-CD1 3.97Å; F33-L36 HydrophobicContact CE1-CD1 4.1Å; L36-G38 VanDerWaalsContact C-N 3.33Å; L36-G38 PolarHBondContact O-N 3.2Å; L36-A39 WeakPolarHBondContact O-CB 3.42Å; L36-A39 PolarHBondContact O-N 2.76Å; L36-C40 PolarHBondContact O-N 3.39Å; L36-C40 PolarHBondContact O-SG 2.98Å; L36-F235 HydrophobicContact CD2-CB 3.66Å; L36-F235 HydrophobicContact CD2-CD2 4.4Å; L36-F235 HydrophobicContact CD2-CG 4.07Å
37	L	98.9	Very high	98.7	Very high	25 Å²	25	36.4 Å²	36.4	13%	0.131	22%	0.22	C	C	.	.	H	α-helix	trans	-63.2	-39.1	173.8	-76.1	169.1	0	0	0	112.2	F33 G34 S35 C40 L41 F90 C93 L94 H97	F33-L37 WeakPolarHBondContact O-CB 3.28Å; F33-L37 WeakPolarHBondContact O-CD1 3.39Å; F33-L37 WeakPolarHBondContact O-CG 3.41Å; F33-L37 PolarHBondContact O-N 2.84Å; G34-L37 PolarHBondContact O-N 3.47Å; S35-L37 PolarHBondContact O-N 3.22Å; L37-C40 PolarHBondContact O-N 3.4Å; L37-L41 PolarHBondContact O-N 3.36Å; L37-F90 HydrophobicContact CD2-CD2 3.93Å; L37-F90 HydrophobicContact CD2-CE2 3.78Å; L37-F90 HydrophobicContact CD2-CZ 4.32Å; L37-C93 HydrophobicContact CD2-CB 3.66Å; L37-C93 HydrophobicContact CG-CB 3.96Å; L37-L94 HydrophobicContact CD1-CD2 3.94Å; L37-L94 HydrophobicContact CD2-CB 4.31Å; L37-L94 HydrophobicContact CD2-CD2 3.74Å; L37-L94 HydrophobicContact CD2-CG 3.6Å; L37-H97 HydrophobicContact CD1-CB 3.81Å
38	G	98.7	Very high	98.7	Very high	34 Å²	34	36.5 Å²	36.5	35%	0.351	22%	0.224	S	C	.	.	H	α-helix	trans	-60.3	-44.1	171.4	0	0	0	0	0	112.4	G34 S35 L36 L41 I42	G34-G38 PolarHBondContact O-N 3.42Å; S35-G38 PolarHBondContact O-N 3.22Å; L36-G38 VanDerWaalsContact C-N 3.33Å; L36-G38 PolarHBondContact O-N 3.2Å; G38-L41 PolarHBondContact O-N 3.13Å; G38-I42 WeakPolarHBondContact O-CG1 3.38Å; G38-I42 PolarHBondContact O-N 3.15Å
39	A	98.8	Very high	98.7	Very high	24 Å²	24	38.5 Å²	38.5	20%	0.198	23%	0.231	C	C	.	.	H	α-helix	trans	-63.7	-41.5	175.3	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 3.42Å; L36-A39 PolarHBondContact O-N 2.76Å; A39-L41 VanDerWaalsContact C-N 3.34Å; A39-L41 PolarHBondContact O-N 3.03Å; A39-I42 PolarHBondContact O-N 2.71Å; A39-L43 WeakPolarHBondContact O-CB 3.35Å; A39-L43 PolarHBondContact O-N 3.25Å; A39-L232 HydrophobicContact CB-CD1 3.7Å
40	C	98.9	Very high	98.8	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-61.1	-42.8	174.7	-62.5	0	0	0	0	111	L36 L37 L43 Q44 F90 F235	L36-C40 PolarHBondContact O-N 3.39Å; L36-C40 PolarHBondContact O-SG 2.98Å; L37-C40 PolarHBondContact O-N 3.4Å; C40-L43 WeakPolarHBondContact O-CB 3.47Å; C40-L43 PolarHBondContact O-N 3.5Å; C40-Q44 WeakPolarHBondContact O-CG 3.41Å; C40-Q44 PolarHBondContact O-N 2.66Å; C40-F90 HydrophobicContact CB-CB 4.12Å; C40-F90 HydrophobicContact CB-CD1 3.2Å; C40-F90 HydrophobicContact CB-CE1 3.72Å; C40-F90 HydrophobicContact CB-CG 3.83Å; C40-F235 WeakPolarHBondContact SG-CE2 3.43Å; C40-F235 WeakPolarHBondContact SG-CZ 3.4Å
41	L	98.9	Very high	98.8	Very high	19 Å²	19	36.9 Å²	36.9	10%	0.099	22%	0.215	C	C	.	.	H	α-helix	trans	-63.2	-44.7	179	-176.2	61	0	0	0	112.1	L37 G38 A39 Q44 I45 F90 I189 A190	L37-L41 PolarHBondContact O-N 3.36Å; G38-L41 PolarHBondContact O-N 3.13Å; A39-L41 VanDerWaalsContact C-N 3.34Å; A39-L41 PolarHBondContact O-N 3.03Å; L41-Q44 PolarHBondContact O-N 3.36Å; L41-I45 HydrophobicContact CD1-CD1 3.95Å; L41-I45 HydrophobicContact CD1-CG1 4.28Å; L41-I45 HydrophobicContact CG-CD1 3.91Å; L41-I45 WeakPolarHBondContact O-CB 3.22Å; L41-I45 VanDerWaalsContact O-CG1 3.31Å; L41-I45 WeakPolarHBondContact O-CG1 3.49Å; L41-I45 PolarHBondContact O-N 3Å; L41-F90 HydrophobicContact CB-CE1 3.93Å; L41-F90 HydrophobicContact CB-CZ 4.44Å; L41-F90 HydrophobicContact CD1-CE1 4.37Å; L41-I189 HydrophobicContact CD1-CB 4.37Å; L41-I189 HydrophobicContact CD1-CG2 3.87Å; L41-I189 HydrophobicContact CD2-CG2 3.99Å; L41-A190 HydrophobicContact CD2-CB 3.96Å
42	I	98.9	Very high	98.8	Very high	112 Å²	112	36.9 Å²	36.9	57%	0.574	22%	0.22	S	C	*	.	H	α-helix	trans	-61.7	-45.1	175.1	-68.3	161.6	0	0	0	110.4	G38 A39 Q44 I45 T46	G38-I42 WeakPolarHBondContact O-CG1 3.38Å; G38-I42 PolarHBondContact O-N 3.15Å; A39-I42 PolarHBondContact O-N 2.71Å; I42-Q44 PolarHBondContact O-N 3.3Å; I42-I45 PolarHBondContact O-N 3.4Å; I42-T46 HydrophobicContact CG2-CG2 4.26Å; I42-T46 WeakPolarHBondContact O-CB 3.31Å; I42-T46 VanDerWaalsContact O-CG2 3.27Å; I42-T46 WeakPolarHBondContact O-CG2 3.44Å; I42-T46 PolarHBondContact O-N 3.47Å; I42-T46 PolarHBondContact O-OG1 2.87Å
43	L	98.9	Very high	98.8	Very high	34 Å²	34	42 Å²	42	18%	0.178	25%	0.245	C	C	.	.	H	α-helix	trans	-57.5	-48.8	176.1	177.8	72.8	0	0	0	111.5	A39 C40 T46 T47 L239	A39-L43 WeakPolarHBondContact O-CB 3.35Å; A39-L43 PolarHBondContact O-N 3.25Å; C40-L43 WeakPolarHBondContact O-CB 3.47Å; C40-L43 PolarHBondContact O-N 3.5Å; L43-T46 WeakPolarHBondContact CA-OG1 3.14Å; L43-T46 PolarHBondContact O-N 3.33Å; L43-T46 PolarHBondContact O-OG1 2.97Å; L43-T47 HydrophobicContact CD1-CG2 3.97Å; L43-T47 HydrophobicContact CG-CG2 4.47Å; L43-T47 WeakPolarHBondContact O-CB 3.4Å; L43-T47 WeakPolarHBondContact O-CG2 3.25Å; L43-T47 PolarHBondContact O-N 2.88Å; L43-T47 PolarHBondContact O-OG1 2.81Å; L43-L239 HydrophobicContact CD2-CD2 3.42Å; L43-L239 VanDerWaalsContact CD2-CD2 3.42Å
44	Q	98.9	Very high	98.8	Very high	25 Å²	25	44.4 Å²	44.4	12%	0.117	26%	0.257	C	S	.	.	H	α-helix	trans	-65.6	-43	-178.8	-67.7	-48.7	108.1	0	0	112.2	C40 L41 I42 T47 G48 H83 G86 F90	C40-Q44 WeakPolarHBondContact O-CG 3.41Å; C40-Q44 PolarHBondContact O-N 2.66Å; L41-Q44 PolarHBondContact O-N 3.36Å; I42-Q44 PolarHBondContact O-N 3.3Å; Q44-T47 PolarHBondContact O-OG1 2.7Å; Q44-G48 WeakPolarHBondContact O-CA 3.29Å; Q44-G48 PolarHBondContact O-N 3.14Å; Q44-H83 PolarHBondContact NE2-O 3.16Å; Q44-H83 PolarHBondContact O-CE1 3.03Å; Q44-H83 VanDerWaalsContact O-CE1 3.27Å; Q44-H83 PolarHBondContact O-ND1 3.08Å; Q44-H83 PolarHBondContact OE1-O 3.48Å; Q44-G86 VanDerWaalsContact OE1-CA 3.28Å; Q44-F90 HydrophobicContact CG-CD1 4.17Å
45	I	98.9	Very high	98.8	Very high	39 Å²	39	43.9 Å²	43.9	20%	0.2	24%	0.244	C	C	.	.	H	α-helix	trans	-63.7	-46.7	178.1	-69.9	170.3	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 WeakPolarHBondContact O-CB 3.22Å; L41-I45 VanDerWaalsContact O-CG1 3.31Å; L41-I45 WeakPolarHBondContact O-CG1 3.49Å; L41-I45 PolarHBondContact O-N 3Å; I42-I45 PolarHBondContact O-N 3.4Å; I45-L49 VanDerWaalsContact O-CB 3.28Å; I45-L49 WeakPolarHBondContact O-CB 3.3Å; I45-L49 PolarHBondContact O-N 2.91Å; I45-P186 HydrophobicContact CD1-CB 4.22Å; I45-P186 HydrophobicContact CG1-CB 3.7Å; I45-F187 HydrophobicContact CG2-CE1 4Å; I45-F187 HydrophobicContact CG2-CZ 4.19Å
46	T	98.9	Very high	98.8	Very high	64 Å²	64	44.1 Å²	44.1	39%	0.393	25%	0.246	S	C	.	.	H	α-helix	trans	-65.5	-55.6	-178.2	50.7	0	0	0	0	111.6	I42 L43 G48 L49 F50	I42-T46 HydrophobicContact CG2-CG2 4.26Å; I42-T46 WeakPolarHBondContact O-CB 3.31Å; I42-T46 VanDerWaalsContact O-CG2 3.27Å; I42-T46 WeakPolarHBondContact O-CG2 3.44Å; I42-T46 PolarHBondContact O-N 3.47Å; I42-T46 PolarHBondContact O-OG1 2.87Å; L43-T46 WeakPolarHBondContact CA-OG1 3.14Å; L43-T46 PolarHBondContact O-N 3.33Å; L43-T46 PolarHBondContact O-OG1 2.97Å; T46-G48 VanDerWaalsContact C-N 3.32Å; T46-G48 PolarHBondContact O-N 3.26Å; T46-L49 PolarHBondContact O-N 3.45Å; T46-F50 VanDerWaalsContact O-CD2 3.31Å; T46-F50 WeakPolarHBondContact O-CD2 3.4Å; T46-F50 PolarHBondContact O-N 3.3Å
47	T	98.9	Very high	98.7	Very high	10 Å²	10	45 Å²	45	6%	0.061	25%	0.252	C	S	.	.	H	α-helix	trans	-60.8	-41.3	178.1	54.3	0	0	0	0	111.9	L43 Q44 L49 F50 L51 I79 L82 H83	L43-T47 HydrophobicContact CD1-CG2 3.97Å; L43-T47 HydrophobicContact CG-CG2 4.47Å; L43-T47 WeakPolarHBondContact O-CB 3.4Å; L43-T47 WeakPolarHBondContact O-CG2 3.25Å; L43-T47 PolarHBondContact O-N 2.88Å; L43-T47 PolarHBondContact O-OG1 2.81Å; Q44-T47 PolarHBondContact O-OG1 2.7Å; T47-L49 PolarHBondContact O-N 2.85Å; T47-F50 PolarHBondContact O-N 3.12Å; T47-L51 VanDerWaalsContact O-CG 3.29Å; T47-L51 WeakPolarHBondContact O-CG 3.37Å; T47-L51 PolarHBondContact O-N 3.42Å; T47-I79 HydrophobicContact CG2-CG2 4.31Å; T47-L82 HydrophobicContact CG2-CB 4.09Å; T47-H83 PolarHBondContact OG1-ND1 3.43Å
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	-62.7	-40	178.3	0	0	0	0	0	112.9	Q44 T46 L51 A52 H83	Q44-G48 WeakPolarHBondContact O-CA 3.29Å; Q44-G48 PolarHBondContact O-N 3.14Å; T46-G48 VanDerWaalsContact C-N 3.32Å; T46-G48 PolarHBondContact O-N 3.26Å; G48-L51 PolarHBondContact O-N 2.89Å; G48-A52 WeakPolarHBondContact O-CB 3.38Å; G48-A52 PolarHBondContact O-N 3.42Å; G48-H83 VanDerWaalsContact CA-CE1 3.45Å; G48-H83 WeakPolarHBondContact CA-CE1 3.5Å; G48-H83 PolarHBondContact N-ND1 3.32Å
49	L	98.8	Very high	98.5	Very high	78 Å²	78	45.8 Å²	45.8	41%	0.408	25%	0.252	S	S	.	.	H	α-helix	trans	-62.2	-44.9	175.4	-177.2	65.8	0	0	0	111.6	I45 T46 T47 A52 M53 F183	I45-L49 VanDerWaalsContact O-CB 3.28Å; I45-L49 WeakPolarHBondContact O-CB 3.3Å; I45-L49 PolarHBondContact O-N 2.91Å; T46-L49 PolarHBondContact O-N 3.45Å; T47-L49 PolarHBondContact O-N 2.85Å; L49-A52 PolarHBondContact O-N 3.4Å; L49-M53 HydrophobicContact CD2-CE 4.45Å; L49-M53 HydrophobicContact CG-CE 4.03Å; L49-M53 WeakPolarHBondContact O-CG 3.28Å; L49-M53 PolarHBondContact O-N 3.48Å; L49-F183 HydrophobicContact CD1-CE2 4.2Å; L49-F183 HydrophobicContact CD1-CZ 4.03Å
50	F	98.8	Very high	98.4	Very high	111 Å²	111	49.5 Å²	49.5	49%	0.487	28%	0.276	S	S	.	.	H	α-helix	trans	-65.1	-38.6	176.5	-82.7	-81.6	0	0	0	112.4	T46 T47 M53 H54 I79	T46-F50 VanDerWaalsContact O-CD2 3.31Å; T46-F50 WeakPolarHBondContact O-CD2 3.4Å; T46-F50 PolarHBondContact O-N 3.3Å; T47-F50 PolarHBondContact O-N 3.12Å; F50-M53 HydrophobicContact CD1-SD 4.4Å; F50-M53 PolarHBondContact O-N 3.13Å; F50-H54 PolarHBondContact O-CD2 3.28Å; F50-I79 HydrophobicContact CB-CD1 4.34Å; F50-I79 HydrophobicContact CB-CG2 4.2Å
51	L	98.9	Very high	98.4	Very high	23 Å²	23	51.7 Å²	51.7	12%	0.12	29%	0.289	C	S	.	.	H	α-helix	trans	-64.5	-41.8	174.5	-67.4	170.2	0	0	0	111.7	T47 G48 M53 H54 Y55 I69 I79 R80 H83	T47-L51 VanDerWaalsContact O-CG 3.29Å; T47-L51 WeakPolarHBondContact O-CG 3.37Å; T47-L51 PolarHBondContact O-N 3.42Å; G48-L51 PolarHBondContact O-N 2.89Å; L51-M53 PolarHBondContact O-N 2.89Å; L51-H54 PolarHBondContact O-N 3.04Å; L51-Y55 PolarHBondContact O-N 2.9Å; L51-Y55 VanDerWaalsContact O-N 3.11Å; L51-I69 HydrophobicContact CD2-CD1 4.3Å; L51-I69 HydrophobicContact CD2-CG2 3.55Å; L51-I79 HydrophobicContact CD1-CG2 4.49Å; L51-I79 HydrophobicContact CD2-CG2 3.96Å; L51-I79 HydrophobicContact CG-CG2 3.87Å; L51-R80 HydrophobicContact CD2-CB 4.1Å; L51-H83 HydrophobicContact CD1-CB 3.51Å
52	A	98.7	Very high	98.4	Very high	23 Å²	23	50.8 Å²	50.8	19%	0.19	29%	0.285	C	S	.	.	H	α-helix	trans	-62.1	-26.8	-179.8	0	0	0	0	0	113.3	G48 L49 H54 F179 F183	G48-A52 WeakPolarHBondContact O-CB 3.38Å; G48-A52 PolarHBondContact O-N 3.42Å; L49-A52 PolarHBondContact O-N 3.4Å; A52-H54 PolarHBondContact O-N 3.45Å; A52-F179 HydrophobicContact CB-CE2 4.24Å; A52-F179 HydrophobicContact CB-CZ 4.16Å; A52-F183 HydrophobicContact CB-CD2 4.29Å; A52-F183 HydrophobicContact CB-CE2 4.01Å
53	M	98.7	Very high	98.4	Very high	120 Å²	120	48.1 Å²	48.1	59%	0.591	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-17.2	174.9	-64	179.3	-167	0	0	113.4	L49 F50 L51	L49-M53 HydrophobicContact CD2-CE 4.45Å; L49-M53 HydrophobicContact CG-CE 4.03Å; L49-M53 WeakPolarHBondContact O-CG 3.28Å; L49-M53 PolarHBondContact O-N 3.48Å; F50-M53 HydrophobicContact CD1-SD 4.4Å; F50-M53 PolarHBondContact O-N 3.13Å; L51-M53 PolarHBondContact O-N 2.89Å
54	H	98.6	Very high	98.4	Very high	82 Å²	82	49.6 Å²	49.6	38%	0.38	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124	-4.6	-174.9	-60.8	-67.7	0	0	0	113.6	F50 L51 A52 I69 V73	F50-H54 PolarHBondContact O-CD2 3.28Å; L51-H54 PolarHBondContact O-N 3.04Å; A52-H54 PolarHBondContact O-N 3.45Å; H54-I69 HydrophobicContact CB-CD1 3.89Å; H54-I69 HydrophobicContact CB-CG1 3.51Å; H54-V73 HydrophobicContact CB-CG2 4.35Å
55	Y	98.8	Very high	98.4	Very high	23 Å²	23	49 Å²	49	9%	0.09	28%	0.28	C	S	.	.			trans	-90.4	144.2	-177.2	175.7	-108.7	0	0	0	111.9	L51 P57 A62 S65 I66 L133 F179	L51-Y55 PolarHBondContact O-N 2.9Å; L51-Y55 VanDerWaalsContact O-N 3.11Å; Y55-P57 HydrophobicContact CD1-CB 4.41Å; Y55-P57 HydrophobicContact CE1-CB 3.7Å; Y55-A62 HydrophobicContact CE2-CB 4Å; Y55-S65 WeakPolarHBondContact CD2-OG 3.37Å; Y55-I66 HydrophobicContact CD2-CD1 3.76Å; Y55-I66 HydrophobicContact CD2-CG1 4.17Å; Y55-I66 HydrophobicContact CE2-CD1 4.16Å; Y55-I66 HydrophobicContact CE2-CG1 4.24Å; Y55-L133 HydrophobicContact CE1-CB 4.44Å; Y55-L133 HydrophobicContact CE2-CB 4.41Å; Y55-L133 WeakPolarHBondContact CE2-O 3.44Å; Y55-L133 PolarHBondContact OH-O 2.97Å; Y55-F179 AromaticContact CD1-CD2 3.65Å; Y55-F179 HydrophobicContact CD1-CD2 3.65Å; Y55-F179 AromaticContact CD1-CE2 3.66Å; Y55-F179 HydrophobicContact CD1-CE2 3.66Å; Y55-F179 HydrophobicContact CD1-CG 4.34Å; Y55-F179 HydrophobicContact CD1-CZ 4.36Å; Y55-F179 HydrophobicContact CE1-CB 4.31Å; Y55-F179 AromaticContact CE1-CD2 3.59Å; Y55-F179 HydrophobicContact CE1-CD2 3.59Å; Y55-F179 HydrophobicContact CE1-CE2 4.12Å; Y55-F179 HydrophobicContact CE1-CG 4.02Å
56	S	98.3	Very high	98.3	Very high	49 Å²	49	48.3 Å²	48.3	34%	0.343	28%	0.277	S	S	.	.			trans	-120.2	113.5	177.1	-172.9	0	0	0	0	110.5	D58 T61 A62 S65	S56-D58 PolarHBondContact O-N 2.94Å; S56-T61 WeakPolarHBondContact CB-OG1 3.26Å; S56-T61 PolarHBondContact OG-OG1 3.03Å; S56-A62 VanDerWaalsContact O-CA 3.26Å; S56-A62 WeakPolarHBondContact O-CA 3.19Å; S56-A62 WeakPolarHBondContact O-CB 3.37Å; S56-S65 PolarHBondContact N-OG 3.28Å
57	P	96.9	Very high	98.3	Very high	33 Å²	33	46.9 Å²	46.9	21%	0.214	27%	0.272	C	S	.	.			trans	-85.4	53.3	-173.2	36.3	-38.3	0	0	0	113.3	Y55 T176 F179	Y55-P57 HydrophobicContact CD1-CB 4.41Å; Y55-P57 HydrophobicContact CE1-CB 3.7Å; P57-T176 PolarHBondContact O-OG1 3.35Å; P57-F179 HydrophobicContact CB-CB 3.8Å; P57-F179 HydrophobicContact CB-CD1 3.96Å; P57-F179 HydrophobicContact CB-CG 3.91Å; P57-F179 HydrophobicContact CG-CD1 3.93Å; P57-F179 HydrophobicContact CG-CE1 4.43Å; P57-F179 HydrophobicContact CG-CG 4.38Å
58	D	97.3	Very high	98.3	Very high	57 Å²	57	50.3 Å²	50.3	31%	0.305	29%	0.287	S	S	.	.	S	Bend	trans	-126.3	140.3	173.9	176.5	-97.2	0	0	0	110.6	S56 S60 T61 A62 S172	S56-D58 PolarHBondContact O-N 2.94Å; D58-S60 PolarHBondContact O-N 2.82Å; D58-S60 VanDerWaalsContact O-N 3.11Å; D58-S60 VanDerWaalsContact OD1-CB 3.26Å; D58-S60 WeakPolarHBondContact OD1-CB 3.21Å; D58-S60 PolarHBondContact OD1-N 2.93Å; D58-S60 PolarHBondContact OD1-OG 2.82Å; D58-T61 PolarHBondContact O-N 3.41Å; D58-A62 WeakPolarHBondContact O-CB 3.41Å; D58-A62 PolarHBondContact O-N 3.41Å; D58-S172 PolarHBondContact OD2-OG 3.41Å
59	A	96.1	Very high	98.3	Very high	19 Å²	19	49.6 Å²	49.6	16%	0.157	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-26.9	-174	0	0	0	0	0	113.4	W135 S172	A59-W135 HydrophobicContact CB-CZ2 3.69Å; A59-W135 PolarHBondContact O-NE1 3.26Å; A59-S172 WeakPolarHBondContact CB-OG 3.3Å; A59-S172 PolarHBondContact N-OG 3.09Å
60	S	97.6	Very high	98.3	Very high	101 Å²	101	47.4 Å²	47.4	71%	0.706	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-26	178.2	75.5	0	0	0	0	113.4	D58	D58-S60 PolarHBondContact O-N 2.82Å; D58-S60 VanDerWaalsContact O-N 3.11Å; D58-S60 VanDerWaalsContact OD1-CB 3.26Å; D58-S60 WeakPolarHBondContact OD1-CB 3.21Å; D58-S60 PolarHBondContact OD1-N 2.93Å; D58-S60 PolarHBondContact OD1-OG 2.82Å
61	T	98.3	Very high	98.3	Very high	47 Å²	47	52 Å²	52	29%	0.288	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.1	-18.8	-172.6	57.9	0	0	0	0	114.4	S56 D58 F63 S64 S65	S56-T61 WeakPolarHBondContact CB-OG1 3.26Å; S56-T61 PolarHBondContact OG-OG1 3.03Å; D58-T61 PolarHBondContact O-N 3.41Å; T61-F63 PolarHBondContact O-N 3.07Å; T61-S64 WeakPolarHBondContact CA-OG 3.41Å; T61-S64 CarbonylContact O-C 3.54Å; T61-S64 PolarHBondContact O-N 3.37Å; T61-S64 PolarHBondContact O-OG 3.47Å; T61-S65 WeakPolarHBondContact O-CB 3.36Å; T61-S65 PolarHBondContact O-N 3.26Å
62	A	98.6	Very high	98.3	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-56.1	-54.3	-172.3	0	0	0	0	0	112.7	Y55 S56 D58 S64 S65 I66 W135 L175	Y55-A62 HydrophobicContact CE2-CB 4Å; S56-A62 VanDerWaalsContact O-CA 3.26Å; S56-A62 WeakPolarHBondContact O-CA 3.19Å; S56-A62 WeakPolarHBondContact O-CB 3.37Å; D58-A62 WeakPolarHBondContact O-CB 3.41Å; D58-A62 PolarHBondContact O-N 3.41Å; A62-S64 PolarHBondContact O-N 3.06Å; A62-S65 PolarHBondContact O-N 2.83Å; A62-S65 VanDerWaalsContact O-N 3.13Å; A62-S65 PolarHBondContact O-OG 3.42Å; A62-I66 PolarHBondContact O-N 3.46Å; A62-I66 VanDerWaalsContact O-N 3.13Å; A62-W135 HydrophobicContact CB-CB 3.87Å; A62-W135 HydrophobicContact CB-CG 4.39Å; A62-L175 HydrophobicContact CB-CD2 3.55Å
63	F	98.6	Very high	98.3	Very high	56 Å²	56	56.3 Å²	56.3	25%	0.246	30%	0.304	C	S	.	.	H	α-helix	trans	-58.6	-45.6	178.1	-173	-91.4	0	0	0	112	T61 S65 I66 A67 P134 W135 Y256 L258	T61-F63 PolarHBondContact O-N 3.07Å; F63-S65 VanDerWaalsContact C-N 3.33Å; F63-S65 PolarHBondContact O-N 2.91Å; F63-I66 PolarHBondContact O-N 2.85Å; F63-A67 PolarHBondContact O-N 2.92Å; F63-A67 VanDerWaalsContact O-N 3.11Å; F63-P134 WeakPolarHBondContact CA-O 3.35Å; F63-P134 WeakPolarHBondContact CD2-O 3.5Å; F63-W135 HydrophobicContact CB-CB 4.45Å; F63-Y256 WeakPolarHBondContact CZ-O 3.15Å; F63-L258 HydrophobicContact CB-CD1 3.45Å; F63-L258 VanDerWaalsContact CB-CD1 3.45Å; F63-L258 HydrophobicContact CD1-CB 4.2Å; F63-L258 HydrophobicContact CD1-CD1 4.14Å; F63-L258 HydrophobicContact CD2-CB 4.46Å; F63-L258 HydrophobicContact CD2-CD1 4.22Å; F63-L258 HydrophobicContact CE1-CB 4.34Å; F63-L258 HydrophobicContact CG-CB 4.28Å; F63-L258 HydrophobicContact CG-CD1 3.69Å
64	S	98.6	Very high	98.3	Very high	64 Å²	64	57.4 Å²	57.4	45%	0.448	31%	0.312	S	S	.	.	H	α-helix	trans	-66.4	-32.2	177.1	56.2	0	0	0	0	113.2	T61 A62 I66 A67 H68	T61-S64 WeakPolarHBondContact CA-OG 3.41Å; T61-S64 CarbonylContact O-C 3.54Å; T61-S64 PolarHBondContact O-N 3.37Å; T61-S64 PolarHBondContact O-OG 3.47Å; A62-S64 PolarHBondContact O-N 3.06Å; S64-I66 VanDerWaalsContact C-N 3.35Å; S64-A67 WeakPolarHBondContact O-CB 3.49Å; S64-A67 PolarHBondContact O-N 3.5Å; S64-H68 WeakPolarHBondContact O-CB 3.41Å; S64-H68 PolarHBondContact O-N 2.86Å
65	S	98.6	Very high	98.3	Very high	12 Å²	12	61.8 Å²	61.8	8%	0.084	33%	0.327	C	S	.	.	H	α-helix	trans	-68.9	-35.1	177.9	75.5	0	0	0	0	111.6	Y55 S56 T61 A62 F63 H68 I69	Y55-S65 WeakPolarHBondContact CD2-OG 3.37Å; S56-S65 PolarHBondContact N-OG 3.28Å; T61-S65 WeakPolarHBondContact O-CB 3.36Å; T61-S65 PolarHBondContact O-N 3.26Å; A62-S65 PolarHBondContact O-N 2.83Å; A62-S65 VanDerWaalsContact O-N 3.13Å; A62-S65 PolarHBondContact O-OG 3.42Å; F63-S65 VanDerWaalsContact C-N 3.33Å; F63-S65 PolarHBondContact O-N 2.91Å; S65-H68 PolarHBondContact O-N 3.31Å; S65-I69 VanDerWaalsContact O-CG1 3.3Å; S65-I69 WeakPolarHBondContact O-CG1 3.38Å; S65-I69 PolarHBondContact O-N 2.89Å
66	I	98.6	Very high	98.3	Very high	26 Å²	26	60.8 Å²	60.8	13%	0.133	32%	0.323	C	S	.	.	H	α-helix	trans	-67.6	-39.7	171.2	-63.8	-63.3	0	0	0	111.4	Y55 A62 F63 S64 I69 T70 R80	Y55-I66 HydrophobicContact CD2-CD1 3.76Å; Y55-I66 HydrophobicContact CD2-CG1 4.17Å; Y55-I66 HydrophobicContact CE2-CD1 4.16Å; Y55-I66 HydrophobicContact CE2-CG1 4.24Å; A62-I66 PolarHBondContact O-N 3.46Å; A62-I66 VanDerWaalsContact O-N 3.13Å; F63-I66 PolarHBondContact O-N 2.85Å; S64-I66 VanDerWaalsContact C-N 3.35Å; I66-I69 HydrophobicContact CD1-CD1 4.24Å; I66-I69 PolarHBondContact O-N 3.41Å; I66-T70 PolarHBondContact O-N 3.2Å; I66-T70 PolarHBondContact O-OG1 2.9Å; I66-R80 VanDerWaalsContact CG2-NE 3.28Å
67	A	98.4	Very high	98.3	Very high	34 Å²	34	63.5 Å²	63.5	28%	0.281	33%	0.326	S	S	.	.	H	α-helix	trans	-62.7	-43.8	173.6	0	0	0	0	0	111.5	F63 S64 T70 R71	F63-A67 PolarHBondContact O-N 2.92Å; F63-A67 VanDerWaalsContact O-N 3.11Å; S64-A67 WeakPolarHBondContact O-CB 3.49Å; S64-A67 PolarHBondContact O-N 3.5Å; A67-T70 PolarHBondContact O-N 3.13Å; A67-T70 VanDerWaalsContact O-N 3.15Å; A67-R71 WeakPolarHBondContact O-CB 3.36Å; A67-R71 WeakPolarHBondContact O-CG 3.46Å; A67-R71 PolarHBondContact O-N 3.37Å
68	H	98.8	Very high	98.4	Very high	81 Å²	81	63.5 Å²	63.5	38%	0.375	32%	0.324	S	S	.	.	H	α-helix	trans	-59.9	-46.6	174.3	165.3	-92.2	0	0	0	112	S64 S65 T70 R71 D72 V73	S64-H68 WeakPolarHBondContact O-CB 3.41Å; S64-H68 PolarHBondContact O-N 2.86Å; S65-H68 PolarHBondContact O-N 3.31Å; H68-T70 PolarHBondContact O-N 3.46Å; H68-R71 PolarHBondContact O-N 3.2Å; H68-D72 IonicContact CD2-OD2 3.33Å; H68-D72 PolarHBondContact CD2-OD2 2.99Å; H68-D72 IonicContact CG-OD2 3.92Å; H68-D72 WeakPolarHBondContact O-CB 3.42Å; H68-D72 PolarHBondContact O-N 3.13Å; H68-V73 PolarHBondContact O-N 3.22Å
69	I	98.8	Very high	98.5	Very high	2 Å²	2	62.7 Å²	62.7	1%	0.01	32%	0.319	C	S	.	.	H	α-helix	trans	-54.2	-44.5	173.1	-75	164.6	0	0	0	110.9	L51 H54 S65 I66 G76 R80	L51-I69 HydrophobicContact CD2-CD1 4.3Å; L51-I69 HydrophobicContact CD2-CG2 3.55Å; H54-I69 HydrophobicContact CB-CD1 3.89Å; H54-I69 HydrophobicContact CB-CG1 3.51Å; S65-I69 VanDerWaalsContact O-CG1 3.3Å; S65-I69 WeakPolarHBondContact O-CG1 3.38Å; S65-I69 PolarHBondContact O-N 2.89Å; I66-I69 HydrophobicContact CD1-CD1 4.24Å; I66-I69 PolarHBondContact O-N 3.41Å; I69-G76 CarbonylContact O-C 3.49Å; I69-G76 WeakPolarHBondContact O-CA 3.49Å; I69-R80 HydrophobicContact CG2-CB 4.4Å
70	T	98.5	Very high	98.6	Very high	33 Å²	33	63.7 Å²	63.7	20%	0.202	32%	0.319	C	S	.	.	H	α-helix	trans	-72.8	-33.9	-175	-50.8	0	0	0	0	112.1	I66 A67 H68 W77 R80	I66-T70 PolarHBondContact O-N 3.2Å; I66-T70 PolarHBondContact O-OG1 2.9Å; A67-T70 PolarHBondContact O-N 3.13Å; A67-T70 VanDerWaalsContact O-N 3.15Å; H68-T70 PolarHBondContact O-N 3.46Å; T70-W77 HydrophobicContact CG2-CB 3.95Å; T70-W77 WeakPolarHBondContact O-CB 3.49Å; T70-R80 WeakPolarHBondContact OG1-CD 3.38Å
71	R	98.6	Very high	98.6	Very high	206 Å²	206	60.3 Å²	60.3	78%	0.777	29%	0.291	S	S	*	.	H	α-helix	trans	-103.2	-35.1	-168.6	-65.8	178	178.7	-168.9	-0.3	114.2	A67 H68	A67-R71 WeakPolarHBondContact O-CB 3.36Å; A67-R71 WeakPolarHBondContact O-CG 3.46Å; A67-R71 PolarHBondContact O-N 3.37Å; H68-R71 PolarHBondContact O-N 3.2Å
72	D	98.6	Very high	98.7	Very high	111 Å²	111	59.5 Å²	59.5	59%	0.594	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.2	-27.1	-165.5	-52.3	-42.6	0	0	0	112.7	H68	H68-D72 IonicContact CD2-OD2 3.33Å; H68-D72 PolarHBondContact CD2-OD2 2.99Å; H68-D72 IonicContact CG-OD2 3.92Å; H68-D72 WeakPolarHBondContact O-CB 3.42Å; H68-D72 PolarHBondContact O-N 3.13Å
73	V	98.8	Very high	98.7	Very high	26 Å²	26	61 Å²	61	16%	0.158	29%	0.292	C	S	.	.	S	Bend	trans	-78.7	128.9	176.5	179.4	0	0	0	0	110	H54 H68 Y75 G76	H54-V73 HydrophobicContact CB-CG2 4.35Å; H68-V73 PolarHBondContact O-N 3.22Å; V73-Y75 PolarHBondContact O-N 3.42Å; V73-Y75 VanDerWaalsContact O-N 3.14Å; V73-G76 PolarHBondContact O-N 3.29Å
74	N	98.6	Very high	98.7	Very high	144 Å²	144	60.8 Å²	60.8	77%	0.77	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	120.2	176	-69.5	-41.3	0	0	0	110.9	G76	N74-G76 PolarHBondContact O-N 3Å; N74-G76 VanDerWaalsContact O-N 3.1Å
75	Y	98.6	Very high	98.7	Very high	174 Å²	174	58 Å²	58	68%	0.682	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.6	14.8	-174.4	-55	-78.5	0	0	0	114.8	V73 W77 I78 I79	V73-Y75 PolarHBondContact O-N 3.42Å; V73-Y75 VanDerWaalsContact O-N 3.14Å; Y75-W77 VanDerWaalsContact C-N 3.3Å; Y75-W77 PolarHBondContact O-N 2.77Å; Y75-I78 HydrophobicContact CD1-CG2 4.34Å; Y75-I78 WeakPolarHBondContact O-CG2 3.33Å; Y75-I78 PolarHBondContact O-N 3.38Å; Y75-I79 WeakPolarHBondContact O-CG1 3.27Å; Y75-I79 PolarHBondContact O-N 3.28Å; Y75-I79 VanDerWaalsContact O-N 3.16Å
76	G	98.8	Very high	98.7	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.01	28%	0.276	C	S	.	.	H	α-helix	trans	-65.4	-32.9	-179.5	0	0	0	0	0	112.9	I69 V73 N74 I78 I79 R80	I69-G76 CarbonylContact O-C 3.49Å; I69-G76 WeakPolarHBondContact O-CA 3.49Å; V73-G76 PolarHBondContact O-N 3.29Å; N74-G76 PolarHBondContact O-N 3Å; N74-G76 VanDerWaalsContact O-N 3.1Å; G76-I78 PolarHBondContact O-N 3.17Å; G76-I79 PolarHBondContact O-N 3.32Å; G76-R80 WeakPolarHBondContact O-CB 3.48Å; G76-R80 PolarHBondContact O-N 3.34Å
77	W	98.6	Very high	98.7	Very high	107 Å²	107	57.1 Å²	57.1	41%	0.405	28%	0.277	S	S	.	.	H	α-helix	trans	-57.8	-47.5	172.9	69.6	-90.2	0	0	0	112.5	T70 Y75 R80 Y81 L244	T70-W77 HydrophobicContact CG2-CB 3.95Å; T70-W77 WeakPolarHBondContact O-CB 3.49Å; Y75-W77 VanDerWaalsContact C-N 3.3Å; Y75-W77 PolarHBondContact O-N 2.77Å; W77-R80 PolarHBondContact O-N 3.43Å; W77-Y81 HydrophobicContact CE3-CD2 4.06Å; W77-Y81 HydrophobicContact CE3-CE2 4.49Å; W77-Y81 WeakPolarHBondContact O-CD2 3.32Å; W77-Y81 PolarHBondContact O-N 3.1Å; W77-L244 HydrophobicContact CH2-CD2 3.94Å; W77-L244 HydrophobicContact CZ3-CD2 4.28Å
78	I	98.8	Very high	98.8	Very high	33 Å²	33	55.6 Å²	55.6	17%	0.169	27%	0.265	C	S	.	.	H	α-helix	trans	-71.5	-37	-177.5	-172.5	169	0	0	0	110.7	Y75 G76 R80 Y81 L82 M240 T243 L244	Y75-I78 HydrophobicContact CD1-CG2 4.34Å; Y75-I78 WeakPolarHBondContact O-CG2 3.33Å; Y75-I78 PolarHBondContact O-N 3.38Å; G76-I78 PolarHBondContact O-N 3.17Å; I78-R80 PolarHBondContact O-N 2.93Å; I78-Y81 PolarHBondContact O-N 3.08Å; I78-L82 HydrophobicContact CG1-CD1 4.05Å; I78-L82 HydrophobicContact CG1-CG 4.19Å; I78-L82 VanDerWaalsContact O-CB 3.27Å; I78-L82 WeakPolarHBondContact O-CB 3.32Å; I78-L82 WeakPolarHBondContact O-CG 3.36Å; I78-L82 PolarHBondContact O-N 3.35Å; I78-M240 HydrophobicContact CD1-CE 4.28Å; I78-T243 HydrophobicContact CG1-CG2 4.28Å; I78-L244 HydrophobicContact CD1-CD2 4.02Å
79	I	98.9	Very high	98.8	Very high	40 Å²	40	52.7 Å²	52.7	21%	0.205	25%	0.252	C	S	.	.	H	α-helix	trans	-62.4	-44.3	174.2	-62	170.3	0	0	0	110.3	T47 F50 L51 Y75 G76 L82 H83	T47-I79 HydrophobicContact CG2-CG2 4.31Å; F50-I79 HydrophobicContact CB-CD1 4.34Å; F50-I79 HydrophobicContact CB-CG2 4.2Å; L51-I79 HydrophobicContact CD1-CG2 4.49Å; L51-I79 HydrophobicContact CD2-CG2 3.96Å; L51-I79 HydrophobicContact CG-CG2 3.87Å; Y75-I79 WeakPolarHBondContact O-CG1 3.27Å; Y75-I79 PolarHBondContact O-N 3.28Å; Y75-I79 VanDerWaalsContact O-N 3.16Å; G76-I79 PolarHBondContact O-N 3.32Å; I79-L82 PolarHBondContact O-N 3.37Å; I79-H83 WeakPolarHBondContact O-CB 3.41Å; I79-H83 PolarHBondContact O-N 2.98Å
80	R	98.8	Very high	98.8	Very high	40 Å²	40	53.3 Å²	53.3	15%	0.151	25%	0.254	C	S	.	.	H	α-helix	trans	-59.5	-49.6	176.5	178.8	-176.4	175.3	-101	1.7	111.3	L51 I66 I69 T70 G76 W77 I78 H83 A84 Y256	L51-R80 HydrophobicContact CD2-CB 4.1Å; I66-R80 VanDerWaalsContact CG2-NE 3.28Å; I69-R80 HydrophobicContact CG2-CB 4.4Å; T70-R80 WeakPolarHBondContact OG1-CD 3.38Å; G76-R80 WeakPolarHBondContact O-CB 3.48Å; G76-R80 PolarHBondContact O-N 3.34Å; W77-R80 PolarHBondContact O-N 3.43Å; I78-R80 PolarHBondContact O-N 2.93Å; R80-H83 WeakPolarHBondContact O-CB 3.38Å; R80-H83 PolarHBondContact O-N 2.86Å; R80-A84 PolarHBondContact O-N 2.89Å; R80-Y256 PolarHBondContact NH1-OH 3.31Å; R80-Y256 VanDerWaalsContact NH1-OH 3.13Å
81	Y	98.8	Very high	98.8	Very high	30 Å²	30	51.9 Å²	51.9	12%	0.118	25%	0.245	C	C	.	.	H	α-helix	trans	-72.8	-31.8	-178	-69.8	-59.7	0	0	0	113.1	W77 I78 H83 A84 N85 P247 Y256	W77-Y81 HydrophobicContact CE3-CD2 4.06Å; W77-Y81 HydrophobicContact CE3-CE2 4.49Å; W77-Y81 WeakPolarHBondContact O-CD2 3.32Å; W77-Y81 PolarHBondContact O-N 3.1Å; I78-Y81 PolarHBondContact O-N 3.08Å; Y81-H83 VanDerWaalsContact C-N 3.3Å; Y81-H83 PolarHBondContact O-N 3.41Å; Y81-A84 PolarHBondContact O-N 2.85Å; Y81-N85 VanDerWaalsContact O-CB 3.24Å; Y81-N85 WeakPolarHBondContact O-CB 3.34Å; Y81-N85 PolarHBondContact O-N 3.36Å; Y81-N85 PolarHBondContact O-ND2 2.97Å; Y81-P247 HydrophobicContact CD1-CB 3.55Å; Y81-P247 HydrophobicContact CD2-CB 4.05Å; Y81-P247 HydrophobicContact CE1-CB 3.77Å; Y81-P247 HydrophobicContact CE2-CB 4.25Å; Y81-P247 HydrophobicContact CG-CB 3.71Å; Y81-Y256 PolarHBondContact OH-OH 2.72Å
82	L	98.9	Very high	98.8	Very high	29 Å²	29	44.8 Å²	44.8	15%	0.152	22%	0.222	C	C	.	.	H	α-helix	trans	-61.3	-40.6	168.8	-77.3	172.2	0	0	0	111.1	T47 I78 I79 G86 L239 M240 T243	T47-L82 HydrophobicContact CG2-CB 4.09Å; I78-L82 HydrophobicContact CG1-CD1 4.05Å; I78-L82 HydrophobicContact CG1-CG 4.19Å; I78-L82 VanDerWaalsContact O-CB 3.27Å; I78-L82 WeakPolarHBondContact O-CB 3.32Å; I78-L82 WeakPolarHBondContact O-CG 3.36Å; I78-L82 PolarHBondContact O-N 3.35Å; I79-L82 PolarHBondContact O-N 3.37Å; L82-G86 WeakPolarHBondContact O-CA 3.32Å; L82-G86 PolarHBondContact O-N 3.46Å; L82-L239 HydrophobicContact CD2-CD2 3.9Å; L82-L239 HydrophobicContact CD2-CG 4.03Å; L82-M240 HydrophobicContact CD2-SD 3.85Å; L82-T243 HydrophobicContact CD2-CG2 4.19Å; L82-T243 HydrophobicContact CG-CG2 4.18Å
83	H	98.9	Very high	98.8	Very high	33 Å²	33	39.7 Å²	39.7	15%	0.153	20%	0.195	C	C	.	.	H	α-helix	trans	-68.4	-44.4	177.7	-165.2	82	0	0	0	112.3	Q44 T47 G48 L51 I79 R80 Y81 A87 H182	Q44-H83 PolarHBondContact NE2-O 3.16Å; Q44-H83 PolarHBondContact O-CE1 3.03Å; Q44-H83 VanDerWaalsContact O-CE1 3.27Å; Q44-H83 PolarHBondContact O-ND1 3.08Å; Q44-H83 PolarHBondContact OE1-O 3.48Å; T47-H83 PolarHBondContact OG1-ND1 3.43Å; G48-H83 VanDerWaalsContact CA-CE1 3.45Å; G48-H83 WeakPolarHBondContact CA-CE1 3.5Å; G48-H83 PolarHBondContact N-ND1 3.32Å; L51-H83 HydrophobicContact CD1-CB 3.51Å; I79-H83 WeakPolarHBondContact O-CB 3.41Å; I79-H83 PolarHBondContact O-N 2.98Å; R80-H83 WeakPolarHBondContact O-CB 3.38Å; R80-H83 PolarHBondContact O-N 2.86Å; Y81-H83 VanDerWaalsContact C-N 3.3Å; Y81-H83 PolarHBondContact O-N 3.41Å; H83-A87 PolarHBondContact O-N 3.3Å; H83-A87 VanDerWaalsContact O-N 3.13Å; H83-H182 AromaticContact NE2-NE2 3.97Å
84	A	98.8	Very high	98.8	Very high	50 Å²	50	39.1 Å²	39.1	41%	0.413	19%	0.191	S	C	.	.	H	α-helix	trans	-68.7	-51.6	-179.8	0	0	0	0	0	112.2	R80 Y81 G86 A87 S88	R80-A84 PolarHBondContact O-N 2.89Å; Y81-A84 PolarHBondContact O-N 2.85Å; A84-G86 VanDerWaalsContact C-N 3.34Å; A84-A87 WeakPolarHBondContact O-CB 3.43Å; A84-A87 PolarHBondContact O-N 3.43Å; A84-S88 PolarHBondContact O-N 2.89Å
85	N	98.9	Very high	98.8	Very high	5 Å²	5	35.3 Å²	35.3	3%	0.027	17%	0.167	C	C	.	.	H	α-helix	trans	-71.7	-31.3	178.1	-70.9	-51.5	0	0	0	112	Y81 A87 S88 M89 L239 L242 P247	Y81-N85 VanDerWaalsContact O-CB 3.24Å; Y81-N85 WeakPolarHBondContact O-CB 3.34Å; Y81-N85 PolarHBondContact O-N 3.36Å; Y81-N85 PolarHBondContact O-ND2 2.97Å; N85-A87 VanDerWaalsContact C-N 3.29Å; N85-A87 PolarHBondContact O-N 3.05Å; N85-S88 WeakPolarHBondContact O-CB 3.47Å; N85-S88 PolarHBondContact O-N 3.39Å; N85-S88 VanDerWaalsContact O-N 3.14Å; N85-M89 WeakPolarHBondContact O-CG 3.48Å; N85-M89 PolarHBondContact O-N 3.38Å; N85-L239 HydrophobicContact CB-CD1 3.89Å; N85-L242 HydrophobicContact CB-CD2 3.76Å; N85-L242 HydrophobicContact CB-CG 4.18Å; N85-L242 WeakPolarHBondContact OD1-CD2 3.3Å; N85-P247 PolarHBondContact ND2-O 3.48Å; N85-P247 PolarHBondContact OD1-O 2.8Å
86	G	98.9	Very high	98.8	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-60.5	-36.1	172.1	0	0	0	0	0	112.7	Q44 L82 A84 M89 F90	Q44-G86 VanDerWaalsContact OE1-CA 3.28Å; L82-G86 WeakPolarHBondContact O-CA 3.32Å; L82-G86 PolarHBondContact O-N 3.46Å; A84-G86 VanDerWaalsContact C-N 3.34Å; G86-M89 PolarHBondContact O-N 2.96Å; G86-F90 WeakPolarHBondContact O-CB 3.48Å; G86-F90 PolarHBondContact O-N 3.44Å
87	A	98.9	Very high	98.8	Very high	20 Å²	20	31.8 Å²	31.8	17%	0.165	16%	0.159	C	C	.	.	H	α-helix	trans	-62.7	-43.5	172	0	0	0	0	0	112	H83 A84 N85 F90 F91	H83-A87 PolarHBondContact O-N 3.3Å; H83-A87 VanDerWaalsContact O-N 3.13Å; A84-A87 WeakPolarHBondContact O-CB 3.43Å; A84-A87 PolarHBondContact O-N 3.43Å; N85-A87 VanDerWaalsContact C-N 3.29Å; N85-A87 PolarHBondContact O-N 3.05Å; A87-F90 VanDerWaalsContact O-CB 3.24Å; A87-F90 WeakPolarHBondContact O-CB 3.46Å; A87-F90 PolarHBondContact O-N 3.38Å; A87-F91 WeakPolarHBondContact O-CD2 3.48Å; A87-F91 PolarHBondContact O-N 3.17Å
88	S	98.8	Very high	98.9	Very high	3 Å²	3	28.1 Å²	28.1	2%	0.021	15%	0.147	C	C	.	.	H	α-helix	trans	-62	-45	173.8	-73.9	0	0	0	0	111.9	A84 N85 F90 F91 I92 L250 W272	A84-S88 PolarHBondContact O-N 2.89Å; N85-S88 WeakPolarHBondContact O-CB 3.47Å; N85-S88 PolarHBondContact O-N 3.39Å; N85-S88 VanDerWaalsContact O-N 3.14Å; S88-F90 PolarHBondContact O-N 2.67Å; S88-F91 PolarHBondContact O-N 2.8Å; S88-F91 VanDerWaalsContact O-N 3.14Å; S88-I92 WeakPolarHBondContact O-CG1 3.41Å; S88-I92 PolarHBondContact O-N 3.14Å; S88-L250 VanDerWaalsContact CB-CD1 3.49Å; S88-W272 PolarHBondContact OG-NE1 3.12Å
89	M	98.8	Very high	98.9	Very high	20 Å²	20	26.9 Å²	26.9	10%	0.099	14%	0.143	C	C	.	.	H	α-helix	trans	-62.5	-32.9	176.3	-67.1	-57.9	-63.7	0	0	112.5	N85 G86 I92 C93 F235 S238 L239	N85-M89 WeakPolarHBondContact O-CG 3.48Å; N85-M89 PolarHBondContact O-N 3.38Å; G86-M89 PolarHBondContact O-N 2.96Å; M89-I92 PolarHBondContact O-N 2.91Å; M89-I92 HydrophobicContact SD-CD1 3.95Å; M89-C93 WeakPolarHBondContact O-CB 3.33Å; M89-C93 PolarHBondContact O-N 2.93Å; M89-C93 PolarHBondContact O-SG 3.28Å; M89-F235 HydrophobicContact CB-CE2 3.7Å; M89-F235 HydrophobicContact CB-CZ 4.09Å; M89-F235 HydrophobicContact CE-CD2 3.94Å; M89-F235 HydrophobicContact CE-CE2 4.02Å; M89-F235 HydrophobicContact CG-CE2 4.41Å; M89-S238 WeakPolarHBondContact CE-OG 3.39Å; M89-L239 HydrophobicContact CG-CB 4.38Å; M89-L239 HydrophobicContact CG-CD1 3.94Å
90	F	98.9	Very high	98.9	Very high	15 Å²	15	26.1 Å²	26.1	7%	0.066	14%	0.137	C	C	.	.	H	α-helix	trans	-59.4	-48.4	172.5	-156.7	115.2	0	0	0	110.8	L37 C40 L41 Q44 G86 A87 S88 C93 L94 T123	L37-F90 HydrophobicContact CD2-CD2 3.93Å; L37-F90 HydrophobicContact CD2-CE2 3.78Å; L37-F90 HydrophobicContact CD2-CZ 4.32Å; C40-F90 HydrophobicContact CB-CB 4.12Å; C40-F90 HydrophobicContact CB-CD1 3.2Å; C40-F90 HydrophobicContact CB-CE1 3.72Å; C40-F90 HydrophobicContact CB-CG 3.83Å; L41-F90 HydrophobicContact CB-CE1 3.93Å; L41-F90 HydrophobicContact CB-CZ 4.44Å; L41-F90 HydrophobicContact CD1-CE1 4.37Å; Q44-F90 HydrophobicContact CG-CD1 4.17Å; G86-F90 WeakPolarHBondContact O-CB 3.48Å; G86-F90 PolarHBondContact O-N 3.44Å; A87-F90 VanDerWaalsContact O-CB 3.24Å; A87-F90 WeakPolarHBondContact O-CB 3.46Å; A87-F90 PolarHBondContact O-N 3.38Å; S88-F90 PolarHBondContact O-N 2.67Å; F90-C93 PolarHBondContact O-N 2.85Å; F90-L94 HydrophobicContact CD2-CD1 3.64Å; F90-L94 HydrophobicContact CD2-CG 3.81Å; F90-L94 HydrophobicContact CE2-CD1 3.74Å; F90-L94 HydrophobicContact CE2-CD2 4.23Å; F90-L94 HydrophobicContact CE2-CG 3.85Å; F90-L94 WeakPolarHBondContact O-CG 3.5Å; F90-L94 PolarHBondContact O-N 3.48Å; F90-T123 HydrophobicContact CD2-CG2 3.66Å; F90-T123 HydrophobicContact CE2-CG2 3.52Å; F90-T123 HydrophobicContact CG-CG2 4.5Å; F90-T123 HydrophobicContact CZ-CG2 4.27Å
91	F	98.9	Very high	98.9	Very high	2 Å²	2	24.3 Å²	24.3	1%	0.009	13%	0.131	C	C	.	.	H	α-helix	trans	-69	-37	178.6	-82.7	-80.9	0	0	0	113.5	A87 S88 C93 L94 F95 T123 M124 A127 W272 Y273	A87-F91 WeakPolarHBondContact O-CD2 3.48Å; A87-F91 PolarHBondContact O-N 3.17Å; S88-F91 PolarHBondContact O-N 2.8Å; S88-F91 VanDerWaalsContact O-N 3.14Å; F91-C93 VanDerWaalsContact C-N 3.32Å; F91-C93 PolarHBondContact O-N 2.94Å; F91-L94 HydrophobicContact CD1-CD1 4.12Å; F91-L94 HydrophobicContact CE1-CD1 4.19Å; F91-L94 PolarHBondContact O-N 3.3Å; F91-F95 HydrophobicContact CB-CD2 4.48Å; F91-F95 HydrophobicContact CB-CE2 4.02Å; F91-F95 HydrophobicContact CB-CZ 4.43Å; F91-F95 HydrophobicContact CD1-CE1 4.29Å; F91-F95 HydrophobicContact CD1-CE2 4.24Å; F91-F95 AromaticContact CD1-CZ 3.8Å; F91-F95 HydrophobicContact CD1-CZ 3.8Å; F91-F95 WeakPolarHBondContact O-CD2 3.39Å; F91-F95 VanDerWaalsContact O-CG 3.28Å; F91-F95 WeakPolarHBondContact O-CG 3.47Å; F91-F95 PolarHBondContact O-N 3.38Å; F91-T123 HydrophobicContact CE2-CG2 4.3Å; F91-T123 HydrophobicContact CZ-CG2 4.05Å; F91-M124 HydrophobicContact CE1-CG 3.8Å; F91-M124 HydrophobicContact CZ-CG 4.12Å; F91-A127 HydrophobicContact CE2-CB 3.49Å; F91-A127 VanDerWaalsContact CE2-CB 3.49Å; F91-A127 HydrophobicContact CZ-CB 3.87Å; F91-W272 HydrophobicContact CB-CH2 4.12Å; F91-W272 HydrophobicContact CB-CZ2 4.14Å; 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 3.79Å; F91-Y273 HydrophobicContact CD2-CD1 3.79Å; F91-Y273 AromaticContact CD2-CD2 3.53Å; F91-Y273 HydrophobicContact CD2-CD2 3.53Å; F91-Y273 HydrophobicContact CD2-CE1 4.1Å; F91-Y273 AromaticContact CD2-CE2 3.79Å; F91-Y273 HydrophobicContact CD2-CE2 3.79Å; F91-Y273 AromaticContact CD2-CG 3.52Å; F91-Y273 HydrophobicContact CD2-CG 3.52Å; F91-Y273 AromaticContact CE1-CD2 3.92Å; F91-Y273 HydrophobicContact CE1-CD2 3.92Å; F91-Y273 HydrophobicContact CE1-CG 4.43Å; F91-Y273 HydrophobicContact CE2-CD1 4.44Å; F91-Y273 AromaticContact CE2-CD2 3.48Å; F91-Y273 HydrophobicContact CE2-CD2 3.48Å; F91-Y273 VanDerWaalsContact CE2-CD2 3.48Å; F91-Y273 HydrophobicContact CE2-CE1 4.47Å; F91-Y273 AromaticContact CE2-CE2 3.45Å; F91-Y273 HydrophobicContact CE2-CE2 3.45Å; F91-Y273 VanDerWaalsContact CE2-CE2 3.45Å; F91-Y273 AromaticContact CE2-CG 4Å; F91-Y273 HydrophobicContact CE2-CG 4Å; F91-Y273 HydrophobicContact CG-CD1 4.08Å; 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 3.54Å; F91-Y273 HydrophobicContact CG-CG 3.54Å; F91-Y273 AromaticContact CZ-CD2 3.68Å; F91-Y273 HydrophobicContact CZ-CD2 3.68Å; F91-Y273 AromaticContact CZ-CE2 3.89Å; F91-Y273 HydrophobicContact CZ-CE2 3.89Å; F91-Y273 HydrophobicContact CZ-CG 4.43Å
92	I	98.9	Very high	98.9	Very high	58 Å²	58	24.1 Å²	24.1	30%	0.297	13%	0.132	S	C	.	.	H	α-helix	trans	-57.7	-49.5	171.5	-66.6	169.4	0	0	0	109.5	S88 M89 L94 F95 L96 W272	S88-I92 WeakPolarHBondContact O-CG1 3.41Å; S88-I92 PolarHBondContact O-N 3.14Å; M89-I92 PolarHBondContact O-N 2.91Å; M89-I92 HydrophobicContact SD-CD1 3.95Å; I92-L94 VanDerWaalsContact C-N 3.33Å; I92-L94 PolarHBondContact O-N 3.46Å; I92-F95 PolarHBondContact O-N 3.39Å; I92-L96 HydrophobicContact CG2-CD1 3.94Å; I92-L96 VanDerWaalsContact O-CG 3.28Å; I92-L96 WeakPolarHBondContact O-CG 3.4Å; I92-L96 PolarHBondContact O-N 2.95Å; I92-L96 VanDerWaalsContact O-N 3.08Å; I92-W272 HydrophobicContact CD1-CH2 4.5Å; 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	98.9	Very high	3 Å²	3	24.2 Å²	24.2	2%	0.02	13%	0.13	C	C	.	.	H	α-helix	trans	-62.2	-39.9	177.7	-66.6	0	0	0	0	112.1	F33 L37 M89 F90 F91 H97	F33-C93 HydrophobicContact CD1-CB 4.08Å; L37-C93 HydrophobicContact CD2-CB 3.66Å; L37-C93 HydrophobicContact CG-CB 3.96Å; M89-C93 WeakPolarHBondContact O-CB 3.33Å; M89-C93 PolarHBondContact O-N 2.93Å; M89-C93 PolarHBondContact O-SG 3.28Å; F90-C93 PolarHBondContact O-N 2.85Å; F91-C93 VanDerWaalsContact C-N 3.32Å; F91-C93 PolarHBondContact O-N 2.94Å; C93-H97 WeakPolarHBondContact O-CB 3.31Å; C93-H97 PolarHBondContact O-N 3.17Å
94	L	98.8	Very high	98.9	Very high	15 Å²	15	23.7 Å²	23.7	8%	0.079	13%	0.127	C	C	.	.	H	α-helix	trans	-62	-51	178	-84.7	175.8	0	0	0	111.3	L37 F90 F91 I92 L96 H97 I98 L120 T123	L37-L94 HydrophobicContact CD1-CD2 3.94Å; L37-L94 HydrophobicContact CD2-CB 4.31Å; L37-L94 HydrophobicContact CD2-CD2 3.74Å; L37-L94 HydrophobicContact CD2-CG 3.6Å; F90-L94 HydrophobicContact CD2-CD1 3.64Å; F90-L94 HydrophobicContact CD2-CG 3.81Å; F90-L94 HydrophobicContact CE2-CD1 3.74Å; F90-L94 HydrophobicContact CE2-CD2 4.23Å; F90-L94 HydrophobicContact CE2-CG 3.85Å; F90-L94 WeakPolarHBondContact O-CG 3.5Å; F90-L94 PolarHBondContact O-N 3.48Å; F91-L94 HydrophobicContact CD1-CD1 4.12Å; F91-L94 HydrophobicContact CE1-CD1 4.19Å; F91-L94 PolarHBondContact O-N 3.3Å; I92-L94 VanDerWaalsContact C-N 3.33Å; I92-L94 PolarHBondContact O-N 3.46Å; 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 3.27Å; L94-I98 WeakPolarHBondContact O-CG1 3.47Å; L94-I98 PolarHBondContact O-N 3.27Å; L94-L120 HydrophobicContact CD1-CD1 4.15Å; L94-T123 HydrophobicContact CD1-CG2 3.8Å
95	F	98.9	Very high	98.9	Very high	63 Å²	63	21.3 Å²	21.3	28%	0.276	11%	0.108	S	C	.	.	H	α-helix	trans	-63.9	-39.2	-178.2	-62.7	-37.6	0	0	0	111.9	F91 I92 I98 G99 W272 Y273 F276	F91-F95 HydrophobicContact CB-CD2 4.48Å; F91-F95 HydrophobicContact CB-CE2 4.02Å; F91-F95 HydrophobicContact CB-CZ 4.43Å; F91-F95 HydrophobicContact CD1-CE1 4.29Å; F91-F95 HydrophobicContact CD1-CE2 4.24Å; F91-F95 AromaticContact CD1-CZ 3.8Å; F91-F95 HydrophobicContact CD1-CZ 3.8Å; F91-F95 WeakPolarHBondContact O-CD2 3.39Å; F91-F95 VanDerWaalsContact O-CG 3.28Å; F91-F95 WeakPolarHBondContact O-CG 3.47Å; F91-F95 PolarHBondContact O-N 3.38Å; I92-F95 PolarHBondContact O-N 3.39Å; F95-I98 PolarHBondContact O-N 3.4Å; F95-G99 PolarHBondContact O-N 3.26Å; F95-W272 HydrophobicContact CD2-CH2 4.19Å; F95-W272 HydrophobicContact CD2-CZ3 4.15Å; F95-W272 HydrophobicContact CE2-CH2 4.02Å; F95-W272 AromaticContact CE2-CZ3 3.83Å; F95-W272 HydrophobicContact CE2-CZ3 3.83Å; F95-Y273 WeakPolarHBondContact CZ-O 2.88Å; F95-F276 HydrophobicContact CE1-CE1 4.42Å; F95-F276 HydrophobicContact CZ-CE1 4.29Å
96	L	98.9	Very high	98.8	Very high	64 Å²	64	22 Å²	22	34%	0.335	11%	0.113	S	C	.	.	H	α-helix	trans	-69.1	-36.4	174.8	-63.5	177.6	0	0	0	112.1	W30 F33 I92 L94 G99 R100	W30-L96 HydrophobicContact CZ3-CD2 4.13Å; F33-L96 HydrophobicContact CD1-CB 4.05Å; F33-L96 HydrophobicContact CD1-CD1 4.41Å; F33-L96 HydrophobicContact CD2-CB 3.92Å; F33-L96 HydrophobicContact CE1-CB 3.91Å; F33-L96 HydrophobicContact CE1-CD1 3.49Å; F33-L96 VanDerWaalsContact CE1-CD1 3.49Å; F33-L96 HydrophobicContact CE1-CG 4.33Å; F33-L96 HydrophobicContact CE2-CB 3.78Å; F33-L96 HydrophobicContact CE2-CD1 4.06Å; F33-L96 HydrophobicContact CG-CB 4.08Å; F33-L96 HydrophobicContact CZ-CB 3.78Å; F33-L96 HydrophobicContact CZ-CD1 3.29Å; F33-L96 HydrophobicContact CZ-CG 4.15Å; I92-L96 HydrophobicContact CG2-CD1 3.94Å; I92-L96 VanDerWaalsContact O-CG 3.28Å; I92-L96 WeakPolarHBondContact O-CG 3.4Å; I92-L96 PolarHBondContact O-N 2.95Å; 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 2.75Å; L96-R100 WeakPolarHBondContact O-CB 3.39Å; L96-R100 PolarHBondContact O-N 3.09Å
97	H	98.9	Very high	98.8	Very high	37 Å²	37	22.6 Å²	22.6	17%	0.171	12%	0.115	C	C	.	.	H	α-helix	trans	-64.5	-43.4	174.7	-168.1	101.1	0	0	0	112.2	F33 G34 L37 C93 L94 R100 G101	F33-H97 HydrophobicContact CB-CB 3.92Å; G34-H97 PolarHBondContact N-ND1 3.12Å; L37-H97 HydrophobicContact CD1-CB 3.81Å; C93-H97 WeakPolarHBondContact O-CB 3.31Å; C93-H97 PolarHBondContact O-N 3.17Å; L94-H97 WeakPolarHBondContact O-CB 3.37Å; L94-H97 PolarHBondContact O-N 3.33Å; H97-R100 PolarHBondContact CE1-NH2 2.88Å; H97-R100 PolarHBondContact ND1-NH2 3.31Å; H97-R100 PolarHBondContact NE2-NH2 3.39Å; H97-G101 PolarHBondContact O-N 2.89Å; H97-G101 VanDerWaalsContact O-N 3.09Å
98	I	98.9	Very high	98.8	Very high	30 Å²	30	24.8 Å²	24.8	15%	0.154	12%	0.124	C	C	.	.	H	α-helix	trans	-65.6	-47.7	175.2	-66.9	163.1	0	0	0	109.9	L94 F95 R100 G101 L102 W113 L120 L301	L94-I98 VanDerWaalsContact O-CG1 3.27Å; L94-I98 WeakPolarHBondContact O-CG1 3.47Å; L94-I98 PolarHBondContact O-N 3.27Å; F95-I98 PolarHBondContact O-N 3.4Å; I98-R100 VanDerWaalsContact C-N 3.33Å; I98-R100 PolarHBondContact O-N 2.87Å; I98-G101 CarbonylContact O-C 3.36Å; I98-G101 WeakPolarHBondContact O-CA 3.48Å; I98-G101 PolarHBondContact O-N 3.39Å; I98-L102 HydrophobicContact CG2-CD1 4.16Å; I98-L102 HydrophobicContact CG2-CG 4.37Å; I98-L102 WeakPolarHBondContact O-CG 3.35Å; I98-L102 PolarHBondContact O-N 3.43Å; I98-W113 HydrophobicContact CG2-CH2 4.17Å; I98-L120 HydrophobicContact CD1-CD1 4.12Å; I98-L120 HydrophobicContact CD1-CD2 3.85Å; I98-L120 HydrophobicContact CD1-CG 4.45Å; I98-L301 HydrophobicContact CG2-CD1 4.32Å; I98-L301 HydrophobicContact CG2-CD2 4.1Å
99	G	98.9	Very high	98.8	Very high	8 Å²	8	27 Å²	27	8%	0.082	13%	0.133	C	C	.	.	H	α-helix	trans	-56.8	-44.4	177.6	0	0	0	0	0	112.4	F95 L96 G101 L102 Y103 Y325	F95-G99 PolarHBondContact O-N 3.26Å; L96-G99 PolarHBondContact O-N 2.75Å; G99-G101 VanDerWaalsContact C-N 3.31Å; G99-G101 PolarHBondContact O-N 3.48Å; G99-L102 PolarHBondContact O-N 3.1Å; G99-Y103 WeakPolarHBondContact O-CB 3.33Å; G99-Y103 PolarHBondContact O-N 2.91Å; G99-Y325 WeakPolarHBondContact O-CE2 3.34Å; G99-Y325 PolarHBondContact O-OH 2.82Å
100	R	98.9	Very high	98.7	Very high	23 Å²	23	28.2 Å²	28.2	9%	0.087	14%	0.143	C	C	.	.	H	α-helix	trans	-54.9	-47.8	169.7	179	-76.5	-65.2	-96.5	-5.5	111.1	W30 W31 L96 H97 I98 L102 Y103 Y104	W30-R100 HydrophobicContact CB-CB 4.07Å; W30-R100 HydrophobicContact CB-CG 3.52Å; W31-R100 VanDerWaalsContact CE2-NH1 3.27Å; W31-R100 HydrophobicContact CE3-CG 4.31Å; W31-R100 HydrophobicContact CZ3-CG 4.22Å; L96-R100 WeakPolarHBondContact O-CB 3.39Å; L96-R100 PolarHBondContact O-N 3.09Å; H97-R100 PolarHBondContact CE1-NH2 2.88Å; H97-R100 PolarHBondContact ND1-NH2 3.31Å; H97-R100 PolarHBondContact NE2-NH2 3.39Å; I98-R100 VanDerWaalsContact C-N 3.33Å; I98-R100 PolarHBondContact O-N 2.87Å; R100-L102 VanDerWaalsContact C-N 3.33Å; R100-L102 PolarHBondContact O-N 2.85Å; R100-Y103 PolarHBondContact O-N 3.19Å; R100-Y104 HydrophobicContact CG-CD2 3.76Å; R100-Y104 HydrophobicContact CG-CE2 4.12Å; R100-Y104 WeakPolarHBondContact O-CD2 3.48Å; R100-Y104 PolarHBondContact O-N 2.87Å
101	G	98.8	Very high	98.7	Very high	3 Å²	3	32.2 Å²	32.2	3%	0.031	16%	0.162	C	C	.	.	H	α-helix	trans	-61.5	-39.8	-179.6	0	0	0	0	0	113.3	H97 I98 G99 G105 S106 F107	H97-G101 PolarHBondContact O-N 2.89Å; H97-G101 VanDerWaalsContact O-N 3.09Å; I98-G101 CarbonylContact O-C 3.36Å; I98-G101 WeakPolarHBondContact O-CA 3.48Å; I98-G101 PolarHBondContact O-N 3.39Å; G99-G101 VanDerWaalsContact C-N 3.31Å; G99-G101 PolarHBondContact O-N 3.48Å; G101-G105 CarbonylContact O-C 3.6Å; G101-G105 PolarHBondContact O-N 3.19Å; G101-S106 PolarHBondContact O-N 3.43Å; G101-F107 WeakPolarHBondContact O-CD1 3.41Å
102	L	98.9	Very high	98.7	Very high	26 Å²	26	32.8 Å²	32.8	14%	0.136	17%	0.165	C	C	.	.	H	α-helix	trans	-66.4	-49.4	174.2	-66.1	174.5	0	0	0	111.8	I98 G99 R100 G105 F107 W113 L301 I304 Y325	I98-L102 HydrophobicContact CG2-CD1 4.16Å; I98-L102 HydrophobicContact CG2-CG 4.37Å; I98-L102 WeakPolarHBondContact O-CG 3.35Å; I98-L102 PolarHBondContact O-N 3.43Å; G99-L102 PolarHBondContact O-N 3.1Å; R100-L102 VanDerWaalsContact C-N 3.33Å; R100-L102 PolarHBondContact O-N 2.85Å; L102-G105 PolarHBondContact O-N 3Å; L102-F107 HydrophobicContact CD2-CD1 4.29Å; L102-W113 HydrophobicContact CD2-CH2 3.74Å; L102-W113 HydrophobicContact CD2-CZ2 3.97Å; L102-W113 HydrophobicContact CG-CH2 4.05Å; L102-L301 HydrophobicContact CD1-CD2 4.5Å; L102-L301 HydrophobicContact CD2-CD2 4.4Å; L102-I304 HydrophobicContact CD2-CD1 4.26Å; L102-I304 HydrophobicContact CD2-CG1 4.04Å; L102-I304 HydrophobicContact CD2-CG2 3.91Å; L102-Y325 HydrophobicContact CB-CE2 4.22Å
103	Y	98.9	Very high	98.7	Very high	30 Å²	30	31.1 Å²	31.1	12%	0.118	16%	0.155	C	C	.	.	H	α-helix	trans	-66.4	-42.5	-175.1	-171.3	-89.5	0	0	0	112.9	G99 R100 M315 Q322 Y325	G99-Y103 WeakPolarHBondContact O-CB 3.33Å; G99-Y103 PolarHBondContact O-N 2.91Å; R100-Y103 PolarHBondContact O-N 3.19Å; Y103-M315 HydrophobicContact CD2-CB 4.29Å; Y103-M315 HydrophobicContact CD2-SD 4.38Å; Y103-M315 HydrophobicContact CE1-CB 4.46Å; Y103-M315 HydrophobicContact CE2-CB 4.21Å; Y103-M315 HydrophobicContact CG-CB 4.48Å; Y103-M315 VanDerWaalsContact O-CB 3.28Å; Y103-M315 WeakPolarHBondContact O-CB 3.26Å; Y103-M315 VanDerWaalsContact O-CG 3.3Å; Y103-M315 WeakPolarHBondContact O-CG 3.35Å; Y103-M315 PolarHBondContact O-N 3.21Å; Y103-Q322 HydrophobicContact CE2-CG 3.94Å; Y103-Q322 WeakPolarHBondContact OH-CG 3.46Å; Y103-Q322 PolarHBondContact OH-OE1 3.1Å; Y103-Y325 AromaticContact CD2-CD1 3.51Å; Y103-Y325 HydrophobicContact CD2-CD1 3.51Å; Y103-Y325 HydrophobicContact CD2-CD2 4.05Å; Y103-Y325 AromaticContact CD2-CE1 3.74Å; Y103-Y325 HydrophobicContact CD2-CE1 3.74Å; 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 4.46Å; Y103-Y325 HydrophobicContact CE2-CG 4.41Å
104	Y	98.8	Very high	98.6	Very high	23 Å²	23	34 Å²	34	9%	0.09	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	4.2	-177.1	-63.7	-68.7	0	0	0	113.7	W30 W31 R100 S106 N206 P208 S314	W30-Y104 HydrophobicContact CB-CE2 4.26Å; W30-Y104 AromaticContact CD1-CE2 3.83Å; W30-Y104 HydrophobicContact CG-CE2 4.2Å; W31-Y104 HydrophobicContact CH2-CD1 4.18Å; W31-Y104 AromaticContact CH2-CD2 3.56Å; W31-Y104 HydrophobicContact CH2-CD2 3.56Å; W31-Y104 HydrophobicContact CH2-CE2 4.02Å; W31-Y104 AromaticContact CH2-CG 3.63Å; W31-Y104 HydrophobicContact CH2-CG 3.63Å; W31-Y104 AromaticContact CZ3-CD2 3.62Å; W31-Y104 HydrophobicContact CZ3-CD2 3.62Å; W31-Y104 AromaticContact CZ3-CE2 3.61Å; W31-Y104 HydrophobicContact CZ3-CE2 3.61Å; W31-Y104 HydrophobicContact CZ3-CG 4.1Å; R100-Y104 HydrophobicContact CG-CD2 3.76Å; R100-Y104 HydrophobicContact CG-CE2 4.12Å; R100-Y104 WeakPolarHBondContact O-CD2 3.48Å; R100-Y104 PolarHBondContact O-N 2.87Å; Y104-S106 VanDerWaalsContact C-N 3.3Å; Y104-S106 PolarHBondContact O-N 3.46Å; Y104-N206 PolarHBondContact O-ND2 3.48Å; Y104-P208 VanDerWaalsContact CD1-CA 3.49Å; Y104-P208 HydrophobicContact CD1-CB 4.19Å; Y104-P208 WeakPolarHBondContact CD1-O 3.47Å; Y104-P208 VanDerWaalsContact CE1-CA 3.5Å; Y104-P208 HydrophobicContact CE1-CB 3.65Å; Y104-P208 HydrophobicContact CE1-CG 4.4Å; Y104-S314 WeakPolarHBondContact CD1-OG 3.46Å
105	G	98.6	Very high	98.6	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.5	29.5	179.4	0	0	0	0	0	113.7	G101 L102 F107 L108 Q313	G101-G105 CarbonylContact O-C 3.6Å; G101-G105 PolarHBondContact O-N 3.19Å; L102-G105 PolarHBondContact O-N 3Å; G105-F107 PolarHBondContact O-N 3.4Å; G105-L108 WeakPolarHBondContact O-CG 3.22Å; G105-L108 PolarHBondContact O-N 3.42Å; G105-Q313 WeakPolarHBondContact CA-O 3.36Å; G105-Q313 WeakPolarHBondContact O-CG 3.18Å; G105-Q313 PolarHBondContact O-NE2 2.88Å
106	S	98.6	Very high	98.6	Very high	20 Å²	20	32.1 Å²	32.1	14%	0.14	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-72.5	-14.3	178	-54.2	0	0	0	0	112.6	G101 Y104 L108 Y109 N206	G101-S106 PolarHBondContact O-N 3.43Å; Y104-S106 VanDerWaalsContact C-N 3.3Å; Y104-S106 PolarHBondContact O-N 3.46Å; S106-L108 PolarHBondContact O-N 3.11Å; S106-Y109 PolarHBondContact O-N 3.03Å; S106-Y109 VanDerWaalsContact O-N 3.15Å; S106-N206 PolarHBondContact OG-ND2 3.12Å
107	F	98.6	Very high	98.6	Very high	11 Å²	11	29.6 Å²	29.6	5%	0.048	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-62.2	-15.4	172.4	57.4	-107.7	0	0	0	113.5	G101 L102 G105 Y109 W113 I304 P305 H308	G101-F107 WeakPolarHBondContact O-CD1 3.41Å; L102-F107 HydrophobicContact CD2-CD1 4.29Å; G105-F107 PolarHBondContact O-N 3.4Å; F107-Y109 PolarHBondContact O-N 2.84Å; F107-W113 HydrophobicContact CB-CB 4.39Å; F107-W113 HydrophobicContact CB-CD2 3.3Å; F107-W113 HydrophobicContact CB-CE3 3.54Å; F107-W113 HydrophobicContact CB-CG 3.69Å; F107-W113 HydrophobicContact CB-CH2 4.14Å; F107-W113 HydrophobicContact CB-CZ2 3.94Å; F107-W113 HydrophobicContact CB-CZ3 3.96Å; F107-I304 HydrophobicContact CB-CG2 4.25Å; F107-I304 HydrophobicContact CD1-CG2 3.46Å; F107-I304 VanDerWaalsContact CD1-CG2 3.46Å; F107-I304 HydrophobicContact CD2-CG2 3.79Å; F107-I304 HydrophobicContact CE1-CG2 3.6Å; F107-I304 HydrophobicContact CE2-CG2 3.95Å; F107-I304 HydrophobicContact CG-CG2 3.55Å; F107-I304 HydrophobicContact CZ-CG2 3.85Å; F107-P305 HydrophobicContact CB-CG 4.31Å; F107-P305 HydrophobicContact CD2-CB 4.36Å; F107-P305 HydrophobicContact CD2-CG 4.32Å; F107-P305 WeakPolarHBondContact O-CG 3.44Å; F107-H308 HydrophobicContact CE2-CB 3.81Å; F107-H308 AromaticContact CE2-CG 3.9Å; F107-H308 AromaticContact CE2-ND1 3.75Å; F107-H308 HydrophobicContact CZ-CB 4.33Å; F107-H308 AromaticContact CZ-ND1 3.56Å
108	L	98.3	Very high	98.6	Very high	66 Å²	66	32 Å²	32	35%	0.346	17%	0.17	S	C	.	.	G	3₁₀ helix	trans	-65.5	-18.3	173.6	-66.2	-177.6	0	0	0	112.8	G105 S106 S110 H308 Q313	G105-L108 WeakPolarHBondContact O-CG 3.22Å; G105-L108 PolarHBondContact O-N 3.42Å; S106-L108 PolarHBondContact O-N 3.11Å; L108-S110 VanDerWaalsContact C-N 3.28Å; L108-S110 PolarHBondContact O-N 3.26Å; L108-S110 VanDerWaalsContact O-N 3.08Å; L108-H308 HydrophobicContact CD2-CB 4.23Å; L108-Q313 HydrophobicContact CD1-CB 4.1Å; L108-Q313 HydrophobicContact CD1-CG 3.73Å
109	Y	98.1	Very high	98.6	Very high	51 Å²	51	31.6 Å²	31.6	20%	0.2	17%	0.168	C	C	.	.	S	Bend	trans	-80	80.9	164.5	-54	-44.8	0	0	0	108.9	S106 F107 E111 T112 W113 T203 N206	S106-Y109 PolarHBondContact O-N 3.03Å; S106-Y109 VanDerWaalsContact O-N 3.15Å; F107-Y109 PolarHBondContact O-N 2.84Å; Y109-E111 VanDerWaalsContact C-N 3.34Å; Y109-E111 PolarHBondContact O-N 3.49Å; Y109-T112 PolarHBondContact O-N 3.03Å; Y109-W113 VanDerWaalsContact O-CB 3.32Å; Y109-W113 WeakPolarHBondContact O-CB 3.28Å; Y109-W113 PolarHBondContact O-N 3.11Å; Y109-T203 HydrophobicContact CD1-CG2 4.01Å; Y109-T203 HydrophobicContact CE1-CG2 4.27Å; Y109-N206 HydrophobicContact CE2-CB 3.64Å
110	S	97.4	Very high	98.6	Very high	45 Å²	45	31.6 Å²	31.6	32%	0.315	17%	0.166	S	C	.	.	H	α-helix	trans	-53.4	-44.7	-167.2	33.6	0	0	0	0	114.3	L108 W113 N114	L108-S110 VanDerWaalsContact C-N 3.28Å; L108-S110 PolarHBondContact O-N 3.26Å; L108-S110 VanDerWaalsContact O-N 3.08Å; S110-W113 PolarHBondContact O-N 3.25Å; S110-N114 VanDerWaalsContact O-CB 3.27Å; S110-N114 WeakPolarHBondContact O-CB 3.42Å; S110-N114 PolarHBondContact O-N 3.3Å; S110-N114 PolarHBondContact O-ND2 3.2Å; S110-N114 VanDerWaalsContact O-ND2 3.1Å
111	E	98.3	Very high	98.6	Very high	99 Å²	99	33.8 Å²	33.8	46%	0.463	18%	0.178	S	C	.	.	H	α-helix	trans	-68.4	-51.1	-176.2	-66.6	81.3	170.6	0	0	109.9	Y109 W113 N114 I115 F199	Y109-E111 VanDerWaalsContact C-N 3.34Å; Y109-E111 PolarHBondContact O-N 3.49Å; E111-W113 VanDerWaalsContact C-N 3.31Å; E111-W113 PolarHBondContact O-N 3.03Å; E111-N114 PolarHBondContact O-N 3.15Å; E111-I115 WeakPolarHBondContact O-CB 3.4Å; E111-I115 WeakPolarHBondContact O-CD1 3.48Å; E111-I115 WeakPolarHBondContact O-CG1 3.38Å; E111-I115 PolarHBondContact O-N 3.44Å; E111-F199 HydrophobicContact CB-CB 4.12Å; E111-F199 HydrophobicContact CB-CD1 3.49Å; E111-F199 VanDerWaalsContact CB-CD1 3.49Å; E111-F199 HydrophobicContact CB-CD2 4.23Å; E111-F199 HydrophobicContact CB-CE1 3.85Å; E111-F199 HydrophobicContact CB-CG 3.69Å; E111-F199 HydrophobicContact CB-CZ 4.34Å; E111-F199 HydrophobicContact CG-CD1 3.91Å; E111-F199 HydrophobicContact CG-CE1 3.85Å; E111-F199 HydrophobicContact CG-CZ 4.45Å
112	T	98.7	Very high	98.6	Very high	14 Å²	14	34.3 Å²	34.3	9%	0.086	18%	0.183	C	C	.	.	H	α-helix	trans	-56.7	-46.6	174.1	-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 3.03Å; T112-H196 WeakPolarHBondContact CG2-CE1 3.47Å; T112-H196 PolarHBondContact O-CE1 2.88Å; T112-H196 PolarHBondContact O-ND1 3.44Å; T112-F199 WeakPolarHBondContact OG1-CB 3.41Å; T112-L200 HydrophobicContact CG2-CB 4.16Å; T112-L200 HydrophobicContact CG2-CD1 4.49Å; T112-L200 PolarHBondContact OG1-N 3.07Å
113	W	98.8	Very high	98.6	Very high	23 Å²	23	33.7 Å²	33.7	9%	0.087	18%	0.18	C	C	.	.	H	α-helix	trans	-63.1	-49.5	-179.7	-178	-103.5	0	0	0	112.8	I98 L102 F107 Y109 S110 E111 I115 G116 V117 L301 I304	I98-W113 HydrophobicContact CG2-CH2 4.17Å; L102-W113 HydrophobicContact CD2-CH2 3.74Å; L102-W113 HydrophobicContact CD2-CZ2 3.97Å; L102-W113 HydrophobicContact CG-CH2 4.05Å; F107-W113 HydrophobicContact CB-CB 4.39Å; F107-W113 HydrophobicContact CB-CD2 3.3Å; F107-W113 HydrophobicContact CB-CE3 3.54Å; F107-W113 HydrophobicContact CB-CG 3.69Å; F107-W113 HydrophobicContact CB-CH2 4.14Å; F107-W113 HydrophobicContact CB-CZ2 3.94Å; F107-W113 HydrophobicContact CB-CZ3 3.96Å; Y109-W113 VanDerWaalsContact O-CB 3.32Å; Y109-W113 WeakPolarHBondContact O-CB 3.28Å; Y109-W113 PolarHBondContact O-N 3.11Å; S110-W113 PolarHBondContact O-N 3.25Å; E111-W113 VanDerWaalsContact C-N 3.31Å; E111-W113 PolarHBondContact O-N 3.03Å; W113-I115 VanDerWaalsContact C-N 3.34Å; W113-I115 PolarHBondContact O-N 3.06Å; W113-G116 CarbonylContact O-C 3.55Å; W113-G116 VanDerWaalsContact O-CA 3.23Å; W113-G116 WeakPolarHBondContact O-CA 3.35Å; W113-G116 PolarHBondContact O-N 2.97Å; W113-V117 PolarHBondContact O-N 3.12Å; W113-L301 HydrophobicContact CH2-CD2 4.49Å; W113-L301 HydrophobicContact CZ2-CB 4.22Å; W113-L301 HydrophobicContact CZ2-CD2 4.06Å; W113-L301 PolarHBondContact NE1-O 2.58Å; W113-I304 HydrophobicContact CZ2-CB 4.48Å; W113-I304 HydrophobicContact CZ2-CG1 4.5Å
114	N	98.6	Very high	98.6	Very high	64 Å²	64	33.1 Å²	33.1	34%	0.342	18%	0.179	S	C	.	.	H	α-helix	trans	-65.9	-37.3	-178.6	-72.2	-30.7	0	0	0	111.7	S110 E111 G116 V117 I118	S110-N114 VanDerWaalsContact O-CB 3.27Å; S110-N114 WeakPolarHBondContact O-CB 3.42Å; S110-N114 PolarHBondContact O-N 3.3Å; S110-N114 PolarHBondContact O-ND2 3.2Å; S110-N114 VanDerWaalsContact O-ND2 3.1Å; E111-N114 PolarHBondContact O-N 3.15Å; N114-G116 VanDerWaalsContact C-N 3.27Å; N114-G116 PolarHBondContact O-N 2.76Å; N114-V117 PolarHBondContact O-N 3.41Å; N114-I118 WeakPolarHBondContact O-CG1 3.26Å; N114-I118 PolarHBondContact O-N 3.03Å
115	I	98.8	Very high	98.6	Very high	14 Å²	14	34 Å²	34	7%	0.072	19%	0.191	C	C	.	.	H	α-helix	trans	-64.4	-36.1	169.6	-66.5	162.6	0	0	0	110.7	E111 W113 V117 I118 L119 L195 H196 F199	E111-I115 WeakPolarHBondContact O-CB 3.4Å; E111-I115 WeakPolarHBondContact O-CD1 3.48Å; E111-I115 WeakPolarHBondContact O-CG1 3.38Å; E111-I115 PolarHBondContact O-N 3.44Å; W113-I115 VanDerWaalsContact C-N 3.34Å; W113-I115 PolarHBondContact O-N 3.06Å; I115-V117 VanDerWaalsContact C-N 3.33Å; I115-V117 PolarHBondContact O-N 3.46Å; I115-I118 PolarHBondContact O-N 3.44Å; I115-L119 HydrophobicContact CG2-CD1 4.12Å; I115-L119 HydrophobicContact CG2-CG 4.37Å; I115-L119 WeakPolarHBondContact O-CB 3.31Å; I115-L119 WeakPolarHBondContact O-CG 3.29Å; I115-L119 PolarHBondContact O-N 3.43Å; I115-L195 HydrophobicContact CD1-CD2 3.87Å; I115-L195 HydrophobicContact CD1-CG 3.77Å; I115-L195 HydrophobicContact CG1-CD2 4.46Å; I115-H196 HydrophobicContact CB-CB 4.5Å; I115-H196 HydrophobicContact CG2-CB 3.7Å; I115-F199 HydrophobicContact CD1-CD2 3.17Å; I115-F199 HydrophobicContact CD1-CE2 3.43Å; I115-F199 VanDerWaalsContact CD1-CE2 3.43Å; I115-F199 HydrophobicContact CD1-CG 4.25Å
116	G	98.8	Very high	98.6	Very high	24 Å²	24	34.6 Å²	34.6	25%	0.247	19%	0.194	C	C	.	.	H	α-helix	trans	-58.1	-41.1	171.4	0	0	0	0	0	113.1	T112 W113 N114 L119 L120	T112-G116 PolarHBondContact O-N 3.03Å; W113-G116 CarbonylContact O-C 3.55Å; W113-G116 VanDerWaalsContact O-CA 3.23Å; W113-G116 WeakPolarHBondContact O-CA 3.35Å; W113-G116 PolarHBondContact O-N 2.97Å; N114-G116 VanDerWaalsContact C-N 3.27Å; N114-G116 PolarHBondContact O-N 2.76Å; G116-L119 WeakPolarHBondContact O-CB 3.33Å; G116-L119 PolarHBondContact O-N 3.2Å; G116-L120 PolarHBondContact O-N 2.85Å
117	V	98.9	Very high	98.6	Very high	11 Å²	11	34.3 Å²	34.3	7%	0.067	19%	0.193	C	C	.	.	H	α-helix	trans	-65.5	-41.3	174.2	-179.1	0	0	0	0	111.1	W113 N114 I115 L120 L121 L301	W113-V117 PolarHBondContact O-N 3.12Å; N114-V117 PolarHBondContact O-N 3.41Å; I115-V117 VanDerWaalsContact C-N 3.33Å; I115-V117 PolarHBondContact O-N 3.46Å; V117-L120 WeakPolarHBondContact O-CB 3.4Å; V117-L120 PolarHBondContact O-N 2.94Å; V117-L121 HydrophobicContact CG1-CD1 4.44Å; V117-L121 WeakPolarHBondContact O-CG 3.27Å; V117-L121 PolarHBondContact O-N 2.84Å; V117-L301 HydrophobicContact CG2-CB 3.86Å
118	I	98.9	Very high	98.6	Very high	88 Å²	88	35.7 Å²	35.7	45%	0.451	20%	0.199	S	C	.	.	H	α-helix	trans	-63.6	-42.4	175.3	-64	166.6	0	0	0	110.8	N114 I115 L120 L121 A122 L192	N114-I118 WeakPolarHBondContact O-CG1 3.26Å; N114-I118 PolarHBondContact O-N 3.03Å; I115-I118 PolarHBondContact O-N 3.44Å; I118-L120 VanDerWaalsContact C-N 3.34Å; I118-L120 PolarHBondContact O-N 2.91Å; I118-L121 PolarHBondContact O-N 3.26Å; I118-A122 WeakPolarHBondContact O-CB 3.4Å; I118-A122 PolarHBondContact O-N 2.99Å; I118-L192 HydrophobicContact CG2-CD1 3.92Å; I118-L192 HydrophobicContact CG2-CD2 4.33Å
119	L	98.9	Very high	98.7	Very high	21 Å²	21	33.4 Å²	33.4	11%	0.11	19%	0.187	C	C	.	.	H	α-helix	trans	-60.4	-42	175	-81.4	167.3	0	0	0	112	I115 G116 A122 T123 I189 L192 A193 H196	I115-L119 HydrophobicContact CG2-CD1 4.12Å; I115-L119 HydrophobicContact CG2-CG 4.37Å; I115-L119 WeakPolarHBondContact O-CB 3.31Å; I115-L119 WeakPolarHBondContact O-CG 3.29Å; I115-L119 PolarHBondContact O-N 3.43Å; G116-L119 WeakPolarHBondContact O-CB 3.33Å; G116-L119 PolarHBondContact O-N 3.2Å; L119-A122 PolarHBondContact O-N 3.28Å; L119-T123 WeakPolarHBondContact O-CB 3.32Å; L119-T123 PolarHBondContact O-N 2.98Å; L119-T123 PolarHBondContact O-OG1 3.14Å; L119-I189 HydrophobicContact CD2-CG2 3.84Å; L119-L192 HydrophobicContact CD2-CB 3.53Å; L119-L192 HydrophobicContact CD2-CD1 4.47Å; L119-L192 HydrophobicContact CG-CB 4.04Å; L119-A193 HydrophobicContact CD2-CB 4.4Å; L119-H196 HydrophobicContact CD1-CB 3.81Å
120	L	98.9	Very high	98.7	Very high	8 Å²	8	31.8 Å²	31.8	4%	0.042	19%	0.185	C	C	.	.	H	α-helix	trans	-59.1	-51.8	174.4	174.2	64.1	0	0	0	110.7	L94 I98 G116 V117 I118 A122 T123 M124 I298 L301	L94-L120 HydrophobicContact CD1-CD1 4.15Å; I98-L120 HydrophobicContact CD1-CD1 4.12Å; I98-L120 HydrophobicContact CD1-CD2 3.85Å; I98-L120 HydrophobicContact CD1-CG 4.45Å; G116-L120 PolarHBondContact O-N 2.85Å; V117-L120 WeakPolarHBondContact O-CB 3.4Å; V117-L120 PolarHBondContact O-N 2.94Å; I118-L120 VanDerWaalsContact C-N 3.34Å; I118-L120 PolarHBondContact O-N 2.91Å; L120-A122 PolarHBondContact O-N 3.4Å; L120-T123 PolarHBondContact O-N 3.45Å; L120-M124 HydrophobicContact CD1-CG 4.17Å; L120-M124 HydrophobicContact CD1-SD 3.95Å; L120-M124 HydrophobicContact CG-CG 4.49Å; L120-M124 HydrophobicContact CG-SD 3.88Å; L120-M124 WeakPolarHBondContact O-CB 3.5Å; L120-M124 VanDerWaalsContact O-CG 3.24Å; L120-M124 WeakPolarHBondContact O-CG 3.47Å; L120-M124 PolarHBondContact O-N 3.26Å; L120-I298 HydrophobicContact CD2-CG2 3.9Å; L120-L301 HydrophobicContact CD2-CD1 3.69Å
121	L	98.8	Very high	98.7	Very high	68 Å²	68	31.5 Å²	31.5	36%	0.356	18%	0.178	S	C	.	.	H	α-helix	trans	-60.8	-43.1	179.5	-71.5	169.3	0	0	0	112.3	V117 I118 M124 A125 I298 L299	V117-L121 HydrophobicContact CG1-CD1 4.44Å; V117-L121 WeakPolarHBondContact O-CG 3.27Å; V117-L121 PolarHBondContact O-N 2.84Å; I118-L121 PolarHBondContact O-N 3.26Å; L121-M124 PolarHBondContact O-N 3.16Å; L121-A125 WeakPolarHBondContact O-CB 3.33Å; L121-A125 PolarHBondContact O-N 3.31Å; L121-I298 HydrophobicContact CD2-CD1 4.5Å; L121-I298 HydrophobicContact CD2-CG2 3.76Å; L121-I298 HydrophobicContact CG-CG2 4.37Å; L121-L299 HydrophobicContact CD1-CD2 4.1Å
122	A	98.9	Very high	98.8	Very high	15 Å²	15	26.9 Å²	26.9	12%	0.124	16%	0.156	C	C	.	.	H	α-helix	trans	-63.8	-40.8	177	0	0	0	0	0	111.8	I118 L119 L120 A125 T126 I189 L192	I118-A122 WeakPolarHBondContact O-CB 3.4Å; I118-A122 PolarHBondContact O-N 2.99Å; L119-A122 PolarHBondContact O-N 3.28Å; L120-A122 PolarHBondContact O-N 3.4Å; A122-A125 PolarHBondContact O-N 3.41Å; A122-T126 WeakPolarHBondContact O-CB 3.23Å; A122-T126 PolarHBondContact O-N 3.31Å; A122-T126 PolarHBondContact O-OG1 3.43Å; A122-I189 HydrophobicContact CB-CD1 4.2Å; A122-I189 HydrophobicContact CB-CG1 3.76Å; A122-L192 HydrophobicContact CB-CD1 4.5Å
123	T	98.9	Very high	98.8	Very high	12 Å²	12	27 Å²	27	7%	0.074	16%	0.156	C	C	.	.	H	α-helix	trans	-66.9	-41.9	176.4	-53.2	0	0	0	0	111.3	F90 F91 L94 L119 L120 T126 A127	F90-T123 HydrophobicContact CD2-CG2 3.66Å; F90-T123 HydrophobicContact CE2-CG2 3.52Å; F90-T123 HydrophobicContact CG-CG2 4.5Å; F90-T123 HydrophobicContact CZ-CG2 4.27Å; F91-T123 HydrophobicContact CE2-CG2 4.3Å; F91-T123 HydrophobicContact CZ-CG2 4.05Å; L94-T123 HydrophobicContact CD1-CG2 3.8Å; L119-T123 WeakPolarHBondContact O-CB 3.32Å; L119-T123 PolarHBondContact O-N 2.98Å; L119-T123 PolarHBondContact O-OG1 3.14Å; L120-T123 PolarHBondContact O-N 3.45Å; T123-T126 PolarHBondContact O-N 2.95Å; T123-A127 WeakPolarHBondContact O-CB 3.49Å; T123-A127 PolarHBondContact O-N 3.22Å
124	M	98.8	Very high	98.8	Very high	19 Å²	19	27.1 Å²	27.1	9%	0.094	16%	0.16	C	C	.	.	H	α-helix	trans	-58.5	-48.3	173.8	-72.8	176.9	86.7	0	0	111.7	F91 L120 L121 T126 A127 F128 F274 I298	F91-M124 HydrophobicContact CE1-CG 3.8Å; F91-M124 HydrophobicContact CZ-CG 4.12Å; L120-M124 HydrophobicContact CD1-CG 4.17Å; L120-M124 HydrophobicContact CD1-SD 3.95Å; L120-M124 HydrophobicContact CG-CG 4.49Å; L120-M124 HydrophobicContact CG-SD 3.88Å; L120-M124 WeakPolarHBondContact O-CB 3.5Å; L120-M124 VanDerWaalsContact O-CG 3.24Å; L120-M124 WeakPolarHBondContact O-CG 3.47Å; L120-M124 PolarHBondContact O-N 3.26Å; L121-M124 PolarHBondContact O-N 3.16Å; M124-T126 VanDerWaalsContact C-N 3.34Å; M124-T126 PolarHBondContact O-N 3.02Å; M124-A127 PolarHBondContact O-N 2.99Å; M124-F128 WeakPolarHBondContact O-CB 3.49Å; M124-F128 PolarHBondContact O-N 3.27Å; M124-F274 HydrophobicContact CB-CE1 3.81Å; M124-F274 HydrophobicContact CB-CZ 4.23Å; M124-F274 HydrophobicContact CE-CD1 3.62Å; M124-F274 HydrophobicContact CE-CE1 3.48Å; M124-F274 VanDerWaalsContact CE-CE1 3.48Å; M124-F274 HydrophobicContact CG-CE1 3.82Å; M124-F274 WeakPolarHBondContact O-CZ 3.14Å; M124-I298 HydrophobicContact CE-CD1 3.4Å; M124-I298 HydrophobicContact CE-CG1 4.15Å; M124-I298 HydrophobicContact SD-CD1 3.85Å; M124-I298 HydrophobicContact SD-CG1 4.43Å; M124-I298 HydrophobicContact SD-CG2 4.33Å
125	A	98.7	Very high	98.7	Very high	41 Å²	41	24.7 Å²	24.7	34%	0.339	15%	0.146	S	C	.	.	H	α-helix	trans	-60.1	-44.3	175.8	0	0	0	0	0	111.9	L121 A122 M129 L185	L121-A125 WeakPolarHBondContact O-CB 3.33Å; L121-A125 PolarHBondContact O-N 3.31Å; A122-A125 PolarHBondContact O-N 3.41Å; A125-M129 HydrophobicContact CB-CE 4.32Å; A125-M129 WeakPolarHBondContact O-CE 3.4Å; A125-M129 WeakPolarHBondContact O-CG 3.49Å; A125-M129 PolarHBondContact O-N 3.17Å; A125-M129 VanDerWaalsContact O-N 3.09Å; A125-L185 HydrophobicContact CB-CD1 4.11Å
126	T	98.9	Very high	98.7	Very high	13 Å²	13	24 Å²	24	8%	0.08	14%	0.143	C	C	.	.	H	α-helix	trans	-60.5	-49.7	178.7	-57.2	0	0	0	0	111.3	A122 T123 M124 M129 G130 H182 L185 P186 I189	A122-T126 WeakPolarHBondContact O-CB 3.23Å; A122-T126 PolarHBondContact O-N 3.31Å; A122-T126 PolarHBondContact O-OG1 3.43Å; T123-T126 PolarHBondContact O-N 2.95Å; M124-T126 VanDerWaalsContact C-N 3.34Å; M124-T126 PolarHBondContact O-N 3.02Å; T126-M129 PolarHBondContact O-N 2.91Å; T126-G130 PolarHBondContact O-N 3.34Å; T126-H182 PolarHBondContact O-CE1 2.85Å; T126-H182 PolarHBondContact O-ND1 2.98Å; T126-L185 HydrophobicContact CG2-CB 4.47Å; T126-L185 WeakPolarHBondContact OG1-CB 3.19Å; T126-L185 WeakPolarHBondContact OG1-CD1 3.13Å; T126-P186 HydrophobicContact CG2-CG 3.88Å; T126-I189 WeakPolarHBondContact OG1-CD1 3.5Å
127	A	98.8	Very high	98.7	Very high	13 Å²	13	23.3 Å²	23.3	11%	0.107	13%	0.133	C	C	.	.	H	α-helix	trans	-67.1	-41.2	-178.2	0	0	0	0	0	112.4	F91 T123 M124 M129 G130 Y131 Y273	F91-A127 HydrophobicContact CE2-CB 3.49Å; F91-A127 VanDerWaalsContact CE2-CB 3.49Å; F91-A127 HydrophobicContact CZ-CB 3.87Å; T123-A127 WeakPolarHBondContact O-CB 3.49Å; T123-A127 PolarHBondContact O-N 3.22Å; M124-A127 PolarHBondContact O-N 2.99Å; A127-M129 PolarHBondContact O-N 2.76Å; A127-G130 PolarHBondContact O-N 3.37Å; A127-Y131 WeakPolarHBondContact O-CB 3.47Å; A127-Y131 PolarHBondContact O-N 2.84Å; A127-Y273 HydrophobicContact CB-CE2 3.98Å
128	F	98.7	Very high	98.6	Very high	41 Å²	41	22.9 Å²	22.9	18%	0.18	13%	0.13	C	C	.	.	H	α-helix	trans	-56.3	-52.6	174	168.9	-104.3	0	0	0	111.2	M124 G130 Y131 V132 I146 T147 F178 F274	M124-F128 WeakPolarHBondContact O-CB 3.49Å; M124-F128 PolarHBondContact O-N 3.27Å; F128-G130 VanDerWaalsContact C-N 3.34Å; F128-G130 PolarHBondContact O-N 2.94Å; F128-Y131 PolarHBondContact O-N 2.66Å; F128-V132 WeakPolarHBondContact O-CG2 3.45Å; F128-V132 PolarHBondContact O-N 3.2Å; F128-I146 HydrophobicContact CD2-CG2 4.39Å; F128-I146 HydrophobicContact CE2-CB 3.76Å; F128-I146 HydrophobicContact CE2-CG1 4.09Å; F128-I146 HydrophobicContact CE2-CG2 3.74Å; F128-I146 HydrophobicContact CZ-CB 4Å; F128-I146 HydrophobicContact CZ-CG2 3.9Å; F128-T147 HydrophobicContact CE1-CG2 4.28Å; F128-T147 HydrophobicContact CZ-CG2 4.13Å; F128-F178 AromaticContact CE1-CE2 3.86Å; F128-F178 HydrophobicContact CE1-CE2 3.86Å; F128-F178 HydrophobicContact CE1-CZ 4.16Å; F128-F178 HydrophobicContact CZ-CE2 4.41Å; F128-F274 HydrophobicContact CB-CE2 4.27Å; F128-F274 HydrophobicContact CB-CZ 4.19Å
129	M	98.7	Very high	98.5	Very high	17 Å²	17	18.8 Å²	18.8	8%	0.084	11%	0.109	C	C	.	.	H	α-helix	trans	-66.3	-37	-180	-67.6	-178.6	-74.2	0	0	112.4	A125 T126 A127 Y131 V132 L133 F178 F181 H182 L185	A125-M129 HydrophobicContact CB-CE 4.32Å; A125-M129 WeakPolarHBondContact O-CE 3.4Å; A125-M129 WeakPolarHBondContact O-CG 3.49Å; A125-M129 PolarHBondContact O-N 3.17Å; A125-M129 VanDerWaalsContact O-N 3.09Å; T126-M129 PolarHBondContact O-N 2.91Å; A127-M129 PolarHBondContact O-N 2.76Å; M129-Y131 VanDerWaalsContact C-N 3.27Å; M129-Y131 PolarHBondContact O-N 3.38Å; M129-V132 WeakPolarHBondContact O-CB 3.4Å; M129-V132 PolarHBondContact O-N 3.38Å; M129-V132 VanDerWaalsContact O-N 3.08Å; M129-L133 WeakPolarHBondContact O-CG 3.49Å; M129-F178 HydrophobicContact CB-CB 4.24Å; M129-F178 HydrophobicContact CB-CD2 4.35Å; M129-F178 HydrophobicContact CB-CG 4.31Å; M129-F178 HydrophobicContact CG-CB 4.36Å; M129-F178 HydrophobicContact CG-CD1 4.23Å; M129-F178 HydrophobicContact CG-CD2 4.04Å; M129-F178 HydrophobicContact CG-CE2 4.39Å; M129-F178 HydrophobicContact CG-CG 3.96Å; M129-F178 HydrophobicContact SD-CD1 4.17Å; M129-F178 HydrophobicContact SD-CG 4.36Å; M129-F181 HydrophobicContact CE-CB 3.78Å; M129-F181 HydrophobicContact SD-CB 3.47Å; M129-F181 WeakPolarHBondContact SD-CB 3.28Å; M129-F181 HydrophobicContact SD-CG 4.34Å; M129-H182 HydrophobicContact CB-CB 4.11Å; M129-L185 HydrophobicContact CE-CD1 3.2Å; M129-L185 HydrophobicContact CE-CG 4.41Å
130	G	98.6	Very high	98.5	Very high	17 Å²	17	18.3 Å²	18.3	18%	0.175	11%	0.106	C	C	.	.	H	α-helix	trans	-59.7	-39.1	174.9	0	0	0	0	0	112.4	T126 A127 F128 V132 L133 P134 H182	T126-G130 PolarHBondContact O-N 3.34Å; A127-G130 PolarHBondContact O-N 3.37Å; F128-G130 VanDerWaalsContact C-N 3.34Å; F128-G130 PolarHBondContact O-N 2.94Å; G130-V132 PolarHBondContact O-N 2.9Å; G130-L133 WeakPolarHBondContact O-CB 3.44Å; G130-L133 WeakPolarHBondContact O-CG 3.49Å; G130-L133 PolarHBondContact O-N 3.31Å; G130-P134 WeakPolarHBondContact O-CD 3.49Å; G130-H182 WeakPolarHBondContact CA-CE1 2.99Å; G130-H182 VanDerWaalsContact CA-ND1 3.26Å; G130-H182 WeakPolarHBondContact CA-ND1 3.46Å; G130-H182 PolarHBondContact N-ND1 3.17Å
131	Y	98.6	Very high	98.4	Very high	40 Å²	40	19.5 Å²	19.5	16%	0.157	11%	0.11	C	C	.	.	H	α-helix	trans	-69.2	-17.5	177	-168.1	-104.7	0	0	0	113.6	A127 F128 M129 P134 M138 S139 E271	A127-Y131 WeakPolarHBondContact O-CB 3.47Å; A127-Y131 PolarHBondContact O-N 2.84Å; F128-Y131 PolarHBondContact O-N 2.66Å; M129-Y131 VanDerWaalsContact C-N 3.27Å; M129-Y131 PolarHBondContact O-N 3.38Å; Y131-P134 WeakPolarHBondContact O-CD 3.41Å; Y131-M138 HydrophobicContact CE1-CB 4.15Å; Y131-S139 VanDerWaalsContact O-CB 3.27Å; Y131-S139 WeakPolarHBondContact O-CB 3.36Å; Y131-S139 PolarHBondContact O-OG 2.87Å; Y131-E271 HydrophobicContact CD1-CG 4.14Å; Y131-E271 HydrophobicContact CD2-CG 3.45Å; Y131-E271 VanDerWaalsContact CD2-CG 3.45Å; Y131-E271 HydrophobicContact CE1-CG 4.09Å; Y131-E271 HydrophobicContact CE2-CG 3.38Å; Y131-E271 WeakPolarHBondContact CE2-OE1 3.23Å; Y131-E271 HydrophobicContact CG-CG 3.82Å; Y131-E271 VanDerWaalsContact CZ-CD 3.48Å; Y131-E271 PolarHBondContact OH-OE1 3.31Å
132	V	98.6	Very high	98.3	Very high	2 Å²	2	16.7 Å²	16.7	1%	0.012	10%	0.098	C	C	.	.	H	α-helix	trans	-79	-28.3	174.2	-175	0	0	0	0	111.7	F128 M129 G130 P134 W135 A143 L175 F178	F128-V132 WeakPolarHBondContact O-CG2 3.45Å; F128-V132 PolarHBondContact O-N 3.2Å; M129-V132 WeakPolarHBondContact O-CB 3.4Å; M129-V132 PolarHBondContact O-N 3.38Å; M129-V132 VanDerWaalsContact O-N 3.08Å; G130-V132 PolarHBondContact O-N 2.9Å; V132-P134 VanDerWaalsContact C-CD 3.49Å; V132-W135 HydrophobicContact CG1-CE3 4.2Å; V132-W135 HydrophobicContact CG1-CZ3 4.02Å; V132-W135 PolarHBondContact O-N 3.47Å; V132-A143 HydrophobicContact CG1-CB 4Å; V132-A143 HydrophobicContact CG2-CB 3.77Å; V132-L175 HydrophobicContact CG1-CD1 4.4Å; V132-F178 HydrophobicContact CB-CD2 3.93Å; V132-F178 HydrophobicContact CG1-CD2 4Å; V132-F178 HydrophobicContact CG2-CD2 3.82Å; V132-F178 HydrophobicContact CG2-CE2 3.99Å
133	L	98.8	Very high	98.2	Very high	16 Å²	16	16 Å²	16	8%	0.084	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-34.2	-171.9	-53.8	-174.5	0	0	0	115.1	Y55 M129 G130 W135 L175 F179 H182	Y55-L133 HydrophobicContact CE1-CB 4.44Å; Y55-L133 HydrophobicContact CE2-CB 4.41Å; Y55-L133 WeakPolarHBondContact CE2-O 3.44Å; Y55-L133 PolarHBondContact OH-O 2.97Å; M129-L133 WeakPolarHBondContact O-CG 3.49Å; G130-L133 WeakPolarHBondContact O-CB 3.44Å; G130-L133 WeakPolarHBondContact O-CG 3.49Å; G130-L133 PolarHBondContact O-N 3.31Å; L133-W135 PolarHBondContact O-N 3.22Å; L133-W135 VanDerWaalsContact O-N 3.15Å; L133-L175 HydrophobicContact CD2-CD1 4Å; L133-F179 HydrophobicContact CD1-CD2 4.04Å; L133-F179 HydrophobicContact CD2-CB 3.9Å; L133-H182 HydrophobicContact CD1-CB 4.31Å
134	P	98.4	Very high	98.1	Very high	26 Å²	26	16.9 Å²	16.9	17%	0.169	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-19.1	175	-25.8	36	0	0	0	115.4	F63 G130 Y131 V132 G136	F63-P134 WeakPolarHBondContact CA-O 3.35Å; F63-P134 WeakPolarHBondContact CD2-O 3.5Å; G130-P134 WeakPolarHBondContact O-CD 3.49Å; Y131-P134 WeakPolarHBondContact O-CD 3.41Å; V132-P134 VanDerWaalsContact C-CD 3.49Å; P134-G136 PolarHBondContact O-N 3.48Å
135	W	98.4	Very high	98	Very high	12 Å²	12	18.7 Å²	18.7	5%	0.045	11%	0.11	C	C	.	.			trans	56	35.1	178.2	-151.4	-111.2	0	0	0	114.2	A59 A62 F63 V132 L133 F140 V170 L175 A259	A59-W135 HydrophobicContact CB-CZ2 3.69Å; A59-W135 PolarHBondContact O-NE1 3.26Å; A62-W135 HydrophobicContact CB-CB 3.87Å; A62-W135 HydrophobicContact CB-CG 4.39Å; F63-W135 HydrophobicContact CB-CB 4.45Å; V132-W135 HydrophobicContact CG1-CE3 4.2Å; V132-W135 HydrophobicContact CG1-CZ3 4.02Å; V132-W135 PolarHBondContact O-N 3.47Å; L133-W135 PolarHBondContact O-N 3.22Å; L133-W135 VanDerWaalsContact O-N 3.15Å; W135-F140 HydrophobicContact CH2-CD2 4.05Å; W135-F140 HydrophobicContact CH2-CE2 4.49Å; W135-F140 AromaticContact CZ2-CD2 3.92Å; W135-F140 HydrophobicContact CZ2-CD2 3.92Å; W135-F140 HydrophobicContact CZ2-CE2 4.31Å; W135-V170 HydrophobicContact CH2-CG1 3.73Å; W135-V170 HydrophobicContact CZ3-CG1 4.03Å; W135-L175 HydrophobicContact CD2-CD2 3.85Å; W135-L175 HydrophobicContact CE3-CB 4.28Å; W135-L175 HydrophobicContact CE3-CD1 3.65Å; W135-L175 HydrophobicContact CE3-CD2 3.67Å; W135-L175 HydrophobicContact CE3-CG 4.07Å; W135-L175 HydrophobicContact CG-CD2 4.27Å; W135-L175 HydrophobicContact CH2-CB 4.19Å; W135-L175 HydrophobicContact CZ3-CB 3.83Å; W135-L175 HydrophobicContact CZ3-CD1 3.87Å; W135-L175 HydrophobicContact CZ3-CD2 4.05Å; W135-L175 HydrophobicContact CZ3-CG 4.13Å; W135-A259 HydrophobicContact CG-CB 4.41Å; W135-A259 WeakPolarHBondContact O-CB 3.48Å; W135-A259 PolarHBondContact O-N 3.07Å; W135-A259 VanDerWaalsContact O-N 3.11Å
136	G	98.3	Very high	97.8	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.106	C	C	.	.	B	Isolated β-bridge	trans	-85.3	-179.3	169	0	0	0	0	0	112.7	P134 M138 S139 F140 N255 T257	P134-G136 PolarHBondContact O-N 3.48Å; G136-M138 PolarHBondContact O-N 3.38Å; G136-S139 WeakPolarHBondContact O-CB 3.27Å; G136-S139 PolarHBondContact O-N 2.84Å; G136-F140 PolarHBondContact O-N 3.09Å; G136-N255 VanDerWaalsContact C-OD1 3.29Å; G136-N255 VanDerWaalsContact CA-OD1 3.24Å; G136-N255 WeakPolarHBondContact CA-OD1 3.5Å; G136-T257 CarbonylContact C-O 3.48Å; G136-T257 WeakPolarHBondContact CA-O 3.5Å
137	Q	98	Very high	97.7	Very high	10 Å²	10	18.9 Å²	18.9	5%	0.047	11%	0.105	C	C	.	.	H	α-helix	trans	-58.7	-48.8	-179.1	-73.9	-78.5	68.9	0	0	112.7	F140 W141 D254 T257 N263 P265	Q137-F140 PolarHBondContact O-N 2.91Å; Q137-W141 WeakPolarHBondContact O-CB 3.27Å; Q137-W141 PolarHBondContact O-N 3.26Å; Q137-D254 HydrophobicContact CB-CB 4.39Å; Q137-D254 WeakPolarHBondContact CB-O 3.39Å; Q137-T257 HydrophobicContact CG-CG2 4.03Å; Q137-T257 PolarHBondContact N-O 2.92Å; Q137-N263 PolarHBondContact NE2-O 3.17Å; Q137-P265 HydrophobicContact CB-CG 3.87Å
138	M	97.1	Very high	97.7	Very high	2 Å²	2	21.2 Å²	21.2	1%	0.01	12%	0.115	C	C	.	.	H	α-helix	trans	-68.5	-36.7	179.8	-70.3	-62.4	161.1	0	0	112.1	Y131 G136 G142 D252 D254 N255 P265	Y131-M138 HydrophobicContact CE1-CB 4.15Å; G136-M138 PolarHBondContact O-N 3.38Å; M138-G142 WeakPolarHBondContact O-CA 3.36Å; M138-G142 PolarHBondContact O-N 2.77Å; M138-D252 HydrophobicContact CG-CB 4.1Å; M138-D254 HydrophobicContact CE-CB 3.51Å; M138-D254 WeakPolarHBondContact CE-OD2 3.33Å; M138-D254 HydrophobicContact CG-CB 3.81Å; M138-N255 HydrophobicContact CB-CB 4.17Å; M138-N255 PolarHBondContact N-OD1 3.48Å; M138-P265 HydrophobicContact CE-CB 3.45Å; M138-P265 VanDerWaalsContact CE-CB 3.45Å; M138-P265 HydrophobicContact CE-CG 3.94Å
139	S	97.4	Very high	97.5	Very high	1 Å²	1	20.3 Å²	20.3	1%	0.007	11%	0.112	C	C	.	.	H	α-helix	trans	-55.6	-54.3	172.3	-66.2	0	0	0	0	112	Y131 G136 A143 N255	Y131-S139 VanDerWaalsContact O-CB 3.27Å; Y131-S139 WeakPolarHBondContact O-CB 3.36Å; Y131-S139 PolarHBondContact O-OG 2.87Å; G136-S139 WeakPolarHBondContact O-CB 3.27Å; G136-S139 PolarHBondContact O-N 2.84Å; S139-A143 VanDerWaalsContact O-CB 3.29Å; S139-A143 WeakPolarHBondContact O-CB 3.29Å; S139-A143 PolarHBondContact O-N 3.39Å; S139-N255 PolarHBondContact N-OD1 2.72Å; S139-N255 PolarHBondContact OG-ND2 3.33Å; S139-N255 PolarHBondContact OG-OD1 3.3Å
140	F	98	Very high	97.3	Very high	11 Å²	11	22.1 Å²	22.1	5%	0.048	12%	0.122	C	C	.	.	H	α-helix	trans	-68.7	-49.6	-175.6	175.5	-90.6	0	0	0	112.6	W135 G136 Q137 A143 T144 V170 A259 P261	W135-F140 HydrophobicContact CH2-CD2 4.05Å; W135-F140 HydrophobicContact CH2-CE2 4.49Å; W135-F140 AromaticContact CZ2-CD2 3.92Å; W135-F140 HydrophobicContact CZ2-CD2 3.92Å; W135-F140 HydrophobicContact CZ2-CE2 4.31Å; G136-F140 PolarHBondContact O-N 3.09Å; Q137-F140 PolarHBondContact O-N 2.91Å; F140-A143 PolarHBondContact O-N 3.44Å; F140-T144 WeakPolarHBondContact O-CB 3.12Å; F140-T144 PolarHBondContact O-N 3.38Å; F140-T144 PolarHBondContact O-OG1 3.11Å; F140-V170 HydrophobicContact CD2-CG1 4.1Å; F140-V170 HydrophobicContact CE2-CB 4.12Å; F140-V170 HydrophobicContact CE2-CG1 4.13Å; F140-V170 VanDerWaalsContact CE2-O 3.29Å; F140-V170 WeakPolarHBondContact CE2-O 3.48Å; F140-A259 HydrophobicContact CB-CB 3.52Å; F140-A259 HydrophobicContact CD2-CB 4.27Å; F140-A259 HydrophobicContact CG-CB 3.93Å; F140-P261 HydrophobicContact CE1-CB 4.11Å; F140-P261 HydrophobicContact CE1-CG 4.27Å; F140-P261 HydrophobicContact CE2-CG 4.22Å; F140-P261 HydrophobicContact CZ-CB 3.86Å; F140-P261 HydrophobicContact CZ-CG 3.79Å
141	W	98.2	Very high	97.2	Very high	33 Å²	33	22.7 Å²	22.7	13%	0.125	12%	0.123	C	C	.	.	H	α-helix	trans	-72.2	-35.8	-177.3	-74	106	0	0	0	112	Q137 T144 V145 N260 P261 N263 T264 P265 I268	Q137-W141 WeakPolarHBondContact O-CB 3.27Å; Q137-W141 PolarHBondContact O-N 3.26Å; W141-T144 PolarHBondContact O-N 2.56Å; W141-V145 WeakPolarHBondContact O-CB 3.2Å; W141-V145 WeakPolarHBondContact O-CG2 3.47Å; W141-V145 PolarHBondContact O-N 3.12Å; W141-N260 PolarHBondContact NE1-O 2.74Å; W141-P261 WeakPolarHBondContact CH2-O 3.46Å; W141-P261 WeakPolarHBondContact CZ2-O 3.43Å; W141-N263 PolarHBondContact NE1-O 2.92Å; W141-T264 HydrophobicContact CD2-CG2 4.42Å; W141-T264 HydrophobicContact CE3-CG2 4.45Å; W141-T264 WeakPolarHBondContact CH2-OG1 3.47Å; W141-T264 VanDerWaalsContact CZ2-OG1 3.3Å; W141-T264 WeakPolarHBondContact CZ2-OG1 3.25Å; W141-P265 HydrophobicContact CG-CG 4.38Å; W141-I268 HydrophobicContact CB-CD1 3.76Å; W141-I268 HydrophobicContact CB-CG1 3.88Å; W141-I268 HydrophobicContact CB-CG2 4.11Å; W141-I268 HydrophobicContact CD2-CD1 4.3Å; W141-I268 HydrophobicContact CE3-CD1 4.18Å; W141-I268 HydrophobicContact CG-CD1 4.16Å; W141-I268 HydrophobicContact CG-CG1 4.48Å
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	-59.8	-47.3	170.4	0	0	0	0	0	111.7	M138 T144 V145 I146	M138-G142 WeakPolarHBondContact O-CA 3.36Å; M138-G142 PolarHBondContact O-N 2.77Å; G142-T144 PolarHBondContact O-N 2.79Å; G142-V145 PolarHBondContact O-N 3.19Å; G142-I146 WeakPolarHBondContact O-CB 3.32Å; G142-I146 VanDerWaalsContact O-CG1 3.26Å; G142-I146 WeakPolarHBondContact O-CG1 3.29Å; G142-I146 PolarHBondContact O-N 3.04Å
143	A	96.7	Very high	96.9	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.008	14%	0.136	C	C	.	.	H	α-helix	trans	-57.7	-48.1	175.2	0	0	0	0	0	111.7	V132 S139 F140 T147 V170	V132-A143 HydrophobicContact CG1-CB 4Å; V132-A143 HydrophobicContact CG2-CB 3.77Å; S139-A143 VanDerWaalsContact O-CB 3.29Å; S139-A143 WeakPolarHBondContact O-CB 3.29Å; S139-A143 PolarHBondContact O-N 3.39Å; F140-A143 PolarHBondContact O-N 3.44Å; A143-T147 WeakPolarHBondContact O-CB 3.45Å; A143-T147 WeakPolarHBondContact O-CG2 3.33Å; A143-T147 PolarHBondContact O-N 3.48Å; A143-T147 PolarHBondContact O-OG1 3.31Å; A143-V170 HydrophobicContact CB-CG1 4.24Å; A143-V170 HydrophobicContact CB-CG2 4.33Å
144	T	97.1	Very high	96.8	Very high	30 Å²	30	26.9 Å²	26.9	18%	0.184	15%	0.154	C	C	.	.	H	α-helix	trans	-59.7	-49.6	-179.3	-60.5	0	0	0	0	111.8	F140 W141 G142 N148	F140-T144 WeakPolarHBondContact O-CB 3.12Å; F140-T144 PolarHBondContact O-N 3.38Å; F140-T144 PolarHBondContact O-OG1 3.11Å; W141-T144 PolarHBondContact O-N 2.56Å; G142-T144 PolarHBondContact O-N 2.79Å; T144-N148 WeakPolarHBondContact O-CB 3.38Å; T144-N148 PolarHBondContact O-N 3.37Å
145	V	96.5	Very high	96.7	Very high	57 Å²	57	36.6 Å²	36.6	35%	0.345	19%	0.189	S	C	.	.	H	α-helix	trans	-66.8	-49.9	-178	171.2	0	0	0	0	111.3	W141 G142 N148 L149 I268	W141-V145 WeakPolarHBondContact O-CB 3.2Å; W141-V145 WeakPolarHBondContact O-CG2 3.47Å; W141-V145 PolarHBondContact O-N 3.12Å; G142-V145 PolarHBondContact O-N 3.19Å; V145-N148 PolarHBondContact O-N 3.48Å; V145-L149 PolarHBondContact O-N 3.3Å; V145-I268 HydrophobicContact CG2-CD1 4.18Å; V145-I268 HydrophobicContact CG2-CG2 4.3Å
146	I	95.3	Very high	96.7	Very high	49 Å²	49	40.9 Å²	40.9	25%	0.251	21%	0.212	S	C	.	.	H	α-helix	trans	-68.6	-44.4	-173.3	-64	-62	0	0	0	111.6	F128 G142 N148 L149	F128-I146 HydrophobicContact CD2-CG2 4.39Å; F128-I146 HydrophobicContact CE2-CB 3.76Å; F128-I146 HydrophobicContact CE2-CG1 4.09Å; F128-I146 HydrophobicContact CE2-CG2 3.74Å; F128-I146 HydrophobicContact CZ-CB 4Å; F128-I146 HydrophobicContact CZ-CG2 3.9Å; G142-I146 WeakPolarHBondContact O-CB 3.32Å; G142-I146 VanDerWaalsContact O-CG1 3.26Å; G142-I146 WeakPolarHBondContact O-CG1 3.29Å; G142-I146 PolarHBondContact O-N 3.04Å; I146-N148 VanDerWaalsContact C-N 3.34Å; I146-N148 PolarHBondContact O-N 2.94Å; I146-L149 HydrophobicContact CD1-CD1 4.22Å; I146-L149 WeakPolarHBondContact O-CB 3.3Å; I146-L149 WeakPolarHBondContact O-CG 3.48Å; I146-L149 PolarHBondContact O-N 3.24Å
147	T	96.8	Very high	96.7	Very high	9 Å²	9	41 Å²	41	6%	0.055	21%	0.212	C	C	.	.	H	α-helix	trans	-68.4	-35.4	179	54.4	0	0	0	0	112	F128 A143 L149 L150 V161 I164 W165 F178	F128-T147 HydrophobicContact CE1-CG2 4.28Å; F128-T147 HydrophobicContact CZ-CG2 4.13Å; A143-T147 WeakPolarHBondContact O-CB 3.45Å; A143-T147 WeakPolarHBondContact O-CG2 3.33Å; A143-T147 PolarHBondContact O-N 3.48Å; A143-T147 PolarHBondContact O-OG1 3.31Å; T147-L149 PolarHBondContact O-N 2.94Å; T147-L149 VanDerWaalsContact O-N 3.12Å; T147-L150 WeakPolarHBondContact O-CB 3.46Å; T147-L150 PolarHBondContact O-N 2.98Å; T147-L150 VanDerWaalsContact O-N 3.11Å; T147-V161 WeakPolarHBondContact O-CG2 3.48Å; T147-I164 HydrophobicContact CG2-CG2 4.38Å; T147-W165 PolarHBondContact OG1-NE1 3.47Å; T147-F178 HydrophobicContact CG2-CZ 4.01Å
148	N	96.9	Very high	96.6	Very high	62 Å²	62	44.3 Å²	44.3	33%	0.332	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-69.7	-4.3	175.7	-168.9	35.2	0	0	0	113.6	T144 V145 I146 L150 S151 W165 K287	T144-N148 WeakPolarHBondContact O-CB 3.38Å; T144-N148 PolarHBondContact O-N 3.37Å; V145-N148 PolarHBondContact O-N 3.48Å; I146-N148 VanDerWaalsContact C-N 3.34Å; I146-N148 PolarHBondContact O-N 2.94Å; N148-L150 PolarHBondContact O-N 2.92Å; N148-S151 PolarHBondContact O-N 3.31Å; N148-S151 PolarHBondContact O-OG 3.41Å; N148-S151 PolarHBondContact OD1-OG 3.05Å; N148-W165 HydrophobicContact CB-CH2 4.26Å; N148-W165 HydrophobicContact CB-CZ2 4.09Å; N148-K287 WeakPolarHBondContact O-CE 3.39Å; N148-K287 PolarHBondContact O-NZ 2.87Å
149	L	94.9	Very high	96.7	Very high	22 Å²	22	49.4 Å²	49.4	12%	0.115	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-63.2	-31.2	167.5	-67.1	179.4	0	0	0	111.6	V145 I146 T147 S151 A152 L281 V291	V145-L149 PolarHBondContact O-N 3.3Å; I146-L149 HydrophobicContact CD1-CD1 4.22Å; I146-L149 WeakPolarHBondContact O-CB 3.3Å; I146-L149 WeakPolarHBondContact O-CG 3.48Å; I146-L149 PolarHBondContact O-N 3.24Å; T147-L149 PolarHBondContact O-N 2.94Å; T147-L149 VanDerWaalsContact O-N 3.12Å; L149-S151 PolarHBondContact O-N 3.36Å; L149-A152 WeakPolarHBondContact O-CB 3.4Å; L149-A152 PolarHBondContact O-N 3.45Å; L149-L281 HydrophobicContact CD1-CD1 4.3Å; L149-L281 HydrophobicContact CD1-CD2 3.69Å; L149-L281 HydrophobicContact CD2-CD1 4.2Å; L149-L281 HydrophobicContact CD2-CD2 4.18Å; L149-V291 HydrophobicContact CB-CG2 3.72Å; L149-V291 HydrophobicContact CD2-CG2 4.01Å; L149-V291 HydrophobicContact CG-CG2 4.28Å
150	L	94.2	Very high	96.7	Very high	55 Å²	55	52 Å²	52	29%	0.288	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-66.2	-21.5	179.4	-65.6	171.6	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 2.98Å; T147-L150 VanDerWaalsContact O-N 3.11Å; N148-L150 PolarHBondContact O-N 2.92Å; L150-A152 PolarHBondContact O-N 3.28Å; L150-A152 VanDerWaalsContact O-N 3.11Å; L150-I153 HydrophobicContact CD2-CD1 4.04Å; L150-I153 WeakPolarHBondContact O-CB 3.42Å; L150-I153 WeakPolarHBondContact O-CG1 3.34Å; L150-I153 PolarHBondContact O-N 3.4Å; L150-G157 VanDerWaalsContact O-CA 3.29Å; L150-G157 WeakPolarHBondContact O-CA 3.43Å; L150-L160 HydrophobicContact CB-CD2 4.28Å; L150-L160 HydrophobicContact CD1-CD2 4.23Å; L150-L160 HydrophobicContact CD2-CD2 4.42Å; L150-V161 HydrophobicContact CB-CG2 3.79Å; L150-I164 HydrophobicContact CD1-CD1 3.26Å
151	S	96.4	Very high	96.7	Very high	29 Å²	29	51.6 Å²	51.6	20%	0.203	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-68.3	-7.2	173.6	64.4	0	0	0	0	113.5	N148 L149 I153 K287	N148-S151 PolarHBondContact O-N 3.31Å; N148-S151 PolarHBondContact O-OG 3.41Å; N148-S151 PolarHBondContact OD1-OG 3.05Å; L149-S151 PolarHBondContact O-N 3.36Å; S151-I153 PolarHBondContact O-N 3.43Å; S151-K287 PolarHBondContact OG-NZ 3.03Å
152	A	96.1	Very high	96.7	Very high	17 Å²	17	53.5 Å²	53.5	14%	0.14	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-71.8	-17.2	169.4	0	0	0	0	0	113.3	L149 L150 P154 K287 L288 V291	L149-A152 WeakPolarHBondContact O-CB 3.4Å; L149-A152 PolarHBondContact O-N 3.45Å; L150-A152 PolarHBondContact O-N 3.28Å; L150-A152 VanDerWaalsContact O-N 3.11Å; A152-P154 WeakPolarHBondContact O-CD 3.4Å; A152-K287 HydrophobicContact CB-CB 4.48Å; A152-K287 HydrophobicContact CB-CD 3.97Å; A152-K287 HydrophobicContact CB-CG 3.89Å; A152-L288 HydrophobicContact CB-CB 4.23Å; A152-L288 HydrophobicContact CB-CD1 4.35Å; A152-V291 HydrophobicContact CB-CG2 4.31Å
153	I	96.6	Very high	96.8	Very high	58 Å²	58	62 Å²	62	30%	0.297	31%	0.312	S	S	.	.	S	Bend	trans	-68.5	122.6	178.9	-60.7	171.3	0	0	0	108.9	L150 S151 I156 G157 L160	L150-I153 HydrophobicContact CD2-CD1 4.04Å; L150-I153 WeakPolarHBondContact O-CB 3.42Å; L150-I153 WeakPolarHBondContact O-CG1 3.34Å; L150-I153 PolarHBondContact O-N 3.4Å; S151-I153 PolarHBondContact O-N 3.43Å; I153-I156 HydrophobicContact CG2-CD1 4.19Å; I153-I156 HydrophobicContact CG2-CG1 3.72Å; I153-G157 VanDerWaalsContact O-CA 3.31Å; I153-G157 WeakPolarHBondContact O-CA 3.48Å; I153-G157 PolarHBondContact O-N 3.49Å; I153-L160 HydrophobicContact CD1-CD2 4.1Å
154	P	96.3	Very high	96.8	Very high	71 Å²	71	63.6 Å²	63.6	46%	0.461	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	144.3	179.2	-25.4	35	0	0	0	112.4	A152 I156 L288	A152-P154 WeakPolarHBondContact O-CD 3.4Å; P154-I156 PolarHBondContact O-N 3.41Å; P154-L288 HydrophobicContact CG-CD2 4.37Å
155	Y	96.5	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	68.9	-58.4	177.7	-45.8	-71.9	0	0	0	115.1
156	I	97.8	Very high	96.9	Very high	103 Å²	103	62.2 Å²	62.2	53%	0.528	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-7	-170.2	59.6	164.9	0	0	0	114.5	I153 P154 T158 D159 L160	I153-I156 HydrophobicContact CG2-CD1 4.19Å; I153-I156 HydrophobicContact CG2-CG1 3.72Å; P154-I156 PolarHBondContact O-N 3.41Å; I156-T158 PolarHBondContact O-N 2.81Å; I156-D159 PolarHBondContact O-N 2.97Å; I156-L160 WeakPolarHBondContact O-CB 3.36Å; I156-L160 PolarHBondContact O-N 3.08Å
157	G	97.4	Very high	97	Very high	1 Å²	1	61.3 Å²	61.3	1%	0.01	32%	0.319	C	S	.	.	H	α-helix	trans	-61.9	-43.3	-168.2	0	0	0	0	0	114.3	L150 I153 L160 V161	L150-G157 VanDerWaalsContact O-CA 3.29Å; L150-G157 WeakPolarHBondContact O-CA 3.43Å; I153-G157 VanDerWaalsContact O-CA 3.31Å; I153-G157 WeakPolarHBondContact O-CA 3.48Å; I153-G157 PolarHBondContact O-N 3.49Å; G157-L160 PolarHBondContact O-N 2.92Å; G157-V161 WeakPolarHBondContact O-CG2 3.48Å; G157-V161 PolarHBondContact O-N 3.43Å; G157-V161 VanDerWaalsContact O-N 3.08Å
158	T	97	Very high	97	Very high	81 Å²	81	70.4 Å²	70.4	50%	0.497	35%	0.354	S	S	.	.	H	α-helix	trans	-66.7	-44.1	-179	-53.9	0	0	0	0	111.5	I156 L160 V161 Q162	I156-T158 PolarHBondContact O-N 2.81Å; T158-L160 VanDerWaalsContact C-N 3.31Å; T158-L160 PolarHBondContact O-N 2.89Å; T158-V161 PolarHBondContact O-N 3.21Å; T158-Q162 PolarHBondContact O-N 3.46Å
159	D	98.1	Very high	96.9	Very high	108 Å²	108	70.5 Å²	70.5	58%	0.578	36%	0.359	S	S	*	.	H	α-helix	trans	-63.4	-39.7	177.4	-61.6	-19.3	0	0	0	111	I156 V161 Q162 W163	I156-D159 PolarHBondContact O-N 2.97Å; D159-V161 PolarHBondContact O-N 2.8Å; D159-Q162 PolarHBondContact O-N 3.23Å; D159-W163 WeakPolarHBondContact O-CB 3.25Å; D159-W163 PolarHBondContact O-N 2.89Å
160	L	97.8	Very high	97.1	Very high	55 Å²	55	69.6 Å²	69.6	29%	0.288	36%	0.355	S	S	.	.	H	α-helix	trans	-62.6	-42.4	176.7	-174.6	65.1	0	0	0	112	L150 I153 I156 G157 T158 W163 I164	L150-L160 HydrophobicContact CB-CD2 4.28Å; L150-L160 HydrophobicContact CD1-CD2 4.23Å; L150-L160 HydrophobicContact CD2-CD2 4.42Å; I153-L160 HydrophobicContact CD1-CD2 4.1Å; I156-L160 WeakPolarHBondContact O-CB 3.36Å; I156-L160 PolarHBondContact O-N 3.08Å; G157-L160 PolarHBondContact O-N 2.92Å; T158-L160 VanDerWaalsContact C-N 3.31Å; T158-L160 PolarHBondContact O-N 2.89Å; L160-W163 HydrophobicContact CD1-CE3 4.26Å; L160-W163 PolarHBondContact O-N 2.91Å; L160-I164 HydrophobicContact CD1-CD1 4.49Å; L160-I164 HydrophobicContact CG-CD1 4.18Å; L160-I164 VanDerWaalsContact O-CG1 3.3Å; L160-I164 WeakPolarHBondContact O-CG1 3.21Å; L160-I164 PolarHBondContact O-N 3.06Å
161	V	98.1	Very high	97.2	Very high	3 Å²	3	70.9 Å²	70.9	2%	0.018	36%	0.362	C	S	.	.	H	α-helix	trans	-63.6	-49.6	177.3	170.7	0	0	0	0	110.9	T147 L150 G157 T158 D159 W163 I164 W165	T147-V161 WeakPolarHBondContact O-CG2 3.48Å; L150-V161 HydrophobicContact CB-CG2 3.79Å; G157-V161 WeakPolarHBondContact O-CG2 3.48Å; G157-V161 PolarHBondContact O-N 3.43Å; G157-V161 VanDerWaalsContact O-N 3.08Å; T158-V161 PolarHBondContact O-N 3.21Å; D159-V161 PolarHBondContact O-N 2.8Å; V161-W163 VanDerWaalsContact C-N 3.27Å; V161-W163 PolarHBondContact O-N 3.49Å; V161-I164 PolarHBondContact O-N 2.85Å; V161-I164 VanDerWaalsContact O-N 3.17Å; V161-W165 HydrophobicContact CG1-CD2 3.63Å; V161-W165 VanDerWaalsContact CG1-CE2 3.46Å; V161-W165 HydrophobicContact CG1-CE3 3.66Å; 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 3.4Å; V161-W165 VanDerWaalsContact CG1-CZ2 3.4Å; V161-W165 HydrophobicContact CG1-CZ3 3.58Å; V161-W165 PolarHBondContact O-N 3.39Å
162	Q	98	Very high	97.2	Very high	73 Å²	73	70.6 Å²	70.6	34%	0.341	36%	0.36	S	S	.	.	H	α-helix	trans	-63.7	-35.4	178.4	-69.1	-178.6	-0.6	0	0	112	T158 D159 W165 G166 G167	T158-Q162 PolarHBondContact O-N 3.46Å; D159-Q162 PolarHBondContact O-N 3.23Å; Q162-W165 PolarHBondContact O-N 2.89Å; Q162-G166 WeakPolarHBondContact O-CA 3.36Å; Q162-G166 PolarHBondContact O-N 2.84Å; Q162-G167 WeakPolarHBondContact CA-O 3.47Å; Q162-G167 PolarHBondContact O-N 2.8Å
163	W	98.2	Very high	97.3	Very high	189 Å²	189	72.7 Å²	72.7	72%	0.716	37%	0.372	S	S	*	.	H	α-helix	trans	-63.9	-44.5	173.4	-178.8	80.5	0	0	0	111.7	D159 L160 V161 W165 G166 R177	D159-W163 WeakPolarHBondContact O-CB 3.25Å; D159-W163 PolarHBondContact O-N 2.89Å; L160-W163 HydrophobicContact CD1-CE3 4.26Å; L160-W163 PolarHBondContact O-N 2.91Å; V161-W163 VanDerWaalsContact C-N 3.27Å; V161-W163 PolarHBondContact O-N 3.49Å; W163-W165 VanDerWaalsContact C-N 3.34Å; W163-G166 PolarHBondContact O-N 3.33Å; W163-R177 PolarHBondContact O-NH1 3.27Å
164	I	97.2	Very high	97.4	Very high	34 Å²	34	69.9 Å²	69.9	17%	0.174	36%	0.358	C	S	.	.	H	α-helix	trans	-64.2	-37.9	175.3	-71.9	168.9	0	0	0	111.3	T147 L150 L160 V161 R177 F178	T147-I164 HydrophobicContact CG2-CG2 4.38Å; L150-I164 HydrophobicContact CD1-CD1 3.26Å; L160-I164 HydrophobicContact CD1-CD1 4.49Å; L160-I164 HydrophobicContact CG-CD1 4.18Å; L160-I164 VanDerWaalsContact O-CG1 3.3Å; L160-I164 WeakPolarHBondContact O-CG1 3.21Å; L160-I164 PolarHBondContact O-N 3.06Å; V161-I164 PolarHBondContact O-N 2.85Å; V161-I164 VanDerWaalsContact O-N 3.17Å; I164-R177 WeakPolarHBondContact O-CD 3.42Å; I164-R177 PolarHBondContact O-NE 3.38Å; I164-R177 PolarHBondContact O-NH1 3.11Å; I164-F178 HydrophobicContact CG2-CE1 4.22Å; I164-F178 HydrophobicContact CG2-CZ 4.43Å
165	W	98.3	Very high	97.5	Very high	22 Å²	22	66.5 Å²	66.5	8%	0.083	34%	0.336	C	S	.	.	H	α-helix	trans	-74.3	-33.3	177.4	-66.8	-16.8	0	0	0	112.7	T147 N148 V161 Q162 W163 G167 Y168 V170 T174	T147-W165 PolarHBondContact OG1-NE1 3.47Å; N148-W165 HydrophobicContact CB-CH2 4.26Å; N148-W165 HydrophobicContact CB-CZ2 4.09Å; V161-W165 HydrophobicContact CG1-CD2 3.63Å; V161-W165 VanDerWaalsContact CG1-CE2 3.46Å; V161-W165 HydrophobicContact CG1-CE3 3.66Å; 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 3.4Å; V161-W165 VanDerWaalsContact CG1-CZ2 3.4Å; V161-W165 HydrophobicContact CG1-CZ3 3.58Å; V161-W165 PolarHBondContact O-N 3.39Å; Q162-W165 PolarHBondContact O-N 2.89Å; W163-W165 VanDerWaalsContact C-N 3.34Å; W165-G167 VanDerWaalsContact C-N 3.32Å; W165-Y168 VanDerWaalsContact CZ3-O 3.26Å; W165-Y168 WeakPolarHBondContact CZ3-O 3.48Å; W165-V170 HydrophobicContact CD2-CG2 4.39Å; W165-V170 HydrophobicContact CG-CG2 4.36Å; W165-V170 HydrophobicContact CZ2-CG2 4.33Å; W165-T174 WeakPolarHBondContact CA-OG1 3.15Å; W165-T174 PolarHBondContact O-N 3.23Å; W165-T174 PolarHBondContact O-OG1 3.16Å
166	G	97.3	Very high	97.6	Very high	37 Å²	37	58.6 Å²	58.6	38%	0.381	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.8	27.3	-168.9	0	0	0	0	0	113	Q162 W163	Q162-G166 WeakPolarHBondContact O-CA 3.36Å; Q162-G166 PolarHBondContact O-N 2.84Å; W163-G166 PolarHBondContact O-N 3.33Å
167	G	96.4	Very high	97.6	Very high	29 Å²	29	57 Å²	57	30%	0.299	30%	0.299	S	S	.	.	S	Bend	trans	172.2	-166.7	-171.8	0	0	0	0	0	110.8	Q162 W165	Q162-G167 WeakPolarHBondContact CA-O 3.47Å; Q162-G167 PolarHBondContact O-N 2.8Å; W165-G167 VanDerWaalsContact C-N 3.32Å
168	Y	97	Very high	97.7	Very high	200 Å²	200	57.5 Å²	57.5	78%	0.784	30%	0.301	S	S	*	.	S	Bend	trans	-89.4	-11.4	-176.9	-59.1	-71.1	0	0	0	114.1	W165	W165-Y168 VanDerWaalsContact CZ3-O 3.26Å; W165-Y168 WeakPolarHBondContact CZ3-O 3.48Å
169	S	96.3	Very high	97.7	Very high	64 Å²	64	55.7 Å²	55.7	45%	0.448	29%	0.286	S	S	.	.	S	Bend	trans	-150.1	168.1	178.1	56.7	0	0	0	0	109.8	D171	S169-D171 PolarHBondContact O-N 3.34Å
170	V	97.8	Very high	97.8	Very high	3 Å²	3	54.5 Å²	54.5	2%	0.018	28%	0.283	C	S	.	.	S	Bend	trans	-61.9	123.3	167.3	175.8	0	0	0	0	108.7	W135 F140 A143 W165 T174	W135-V170 HydrophobicContact CH2-CG1 3.73Å; W135-V170 HydrophobicContact CZ3-CG1 4.03Å; F140-V170 HydrophobicContact CD2-CG1 4.1Å; F140-V170 HydrophobicContact CE2-CB 4.12Å; F140-V170 HydrophobicContact CE2-CG1 4.13Å; F140-V170 VanDerWaalsContact CE2-O 3.29Å; F140-V170 WeakPolarHBondContact CE2-O 3.48Å; A143-V170 HydrophobicContact CB-CG1 4.24Å; A143-V170 HydrophobicContact CB-CG2 4.33Å; W165-V170 HydrophobicContact CD2-CG2 4.39Å; W165-V170 HydrophobicContact CG-CG2 4.36Å; W165-V170 HydrophobicContact CZ2-CG2 4.33Å; V170-T174 HydrophobicContact CG1-CG2 4.2Å
171	D	96.9	Very high	97.8	Very high	82 Å²	82	57 Å²	57	44%	0.439	29%	0.292	S	S	.	.	S	Bend	trans	-158	-170.4	-178.5	-162	1.6	0	0	0	110.8	S169 P173 T174 L175	S169-D171 PolarHBondContact O-N 3.34Å; D171-P173 VanDerWaalsContact C-CD 3.45Å; D171-P173 VanDerWaalsContact C-N 3.33Å; D171-T174 PolarHBondContact N-OG1 3.11Å; D171-T174 WeakPolarHBondContact O-CA 3.41Å; D171-T174 VanDerWaalsContact O-CB 3.25Å; D171-T174 WeakPolarHBondContact O-CB 3.41Å; D171-T174 PolarHBondContact O-N 3.31Å; D171-L175 PolarHBondContact O-N 2.9Å
172	S	97.1	Very high	97.8	Very high	23 Å²	23	58.2 Å²	58.2	16%	0.161	30%	0.297	C	S	.	.	H	α-helix	trans	-43.7	-47.2	178.7	-81.9	0	0	0	0	114	D58 A59 T174 L175 T176	D58-S172 PolarHBondContact OD2-OG 3.41Å; A59-S172 WeakPolarHBondContact CB-OG 3.3Å; A59-S172 PolarHBondContact N-OG 3.09Å; S172-T174 PolarHBondContact O-N 3.3Å; S172-L175 PolarHBondContact O-N 3.05Å; S172-L175 VanDerWaalsContact O-N 3.09Å; S172-T176 PolarHBondContact O-N 3.08Å; S172-T176 PolarHBondContact O-OG1 3.27Å; S172-T176 VanDerWaalsContact O-OG1 3.1Å
173	P	98.1	Very high	97.9	Very high	61 Å²	61	58.6 Å²	58.6	40%	0.396	30%	0.298	S	S	.	.	H	α-helix	trans	-58.7	-34.3	176.9	-24.8	35.1	0	0	0	113.8	D171 R177	D171-P173 VanDerWaalsContact C-CD 3.45Å; D171-P173 VanDerWaalsContact C-N 3.33Å; P173-R177 WeakPolarHBondContact O-CG 3.28Å; P173-R177 PolarHBondContact O-N 3.1Å; P173-R177 PolarHBondContact O-NE 3.12Å
174	T	98.1	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	-72.1	-40.5	175.4	-44.2	0	0	0	0	111.3	W165 V170 D171 S172 R177 F178	W165-T174 WeakPolarHBondContact CA-OG1 3.15Å; W165-T174 PolarHBondContact O-N 3.23Å; W165-T174 PolarHBondContact O-OG1 3.16Å; V170-T174 HydrophobicContact CG1-CG2 4.2Å; D171-T174 PolarHBondContact N-OG1 3.11Å; D171-T174 WeakPolarHBondContact O-CA 3.41Å; D171-T174 VanDerWaalsContact O-CB 3.25Å; D171-T174 WeakPolarHBondContact O-CB 3.41Å; D171-T174 PolarHBondContact O-N 3.31Å; S172-T174 PolarHBondContact O-N 3.3Å; T174-R177 WeakPolarHBondContact O-CG 3.43Å; T174-F178 HydrophobicContact CG2-CD1 4.32Å; T174-F178 HydrophobicContact CG2-CD2 4.47Å; T174-F178 HydrophobicContact CG2-CE1 4.05Å; T174-F178 HydrophobicContact CG2-CE2 4.23Å; T174-F178 HydrophobicContact CG2-CZ 4Å; T174-F178 WeakPolarHBondContact O-CB 3.45Å; T174-F178 WeakPolarHBondContact O-CG 3.35Å; T174-F178 PolarHBondContact O-N 3.44Å
175	L	98.1	Very high	98	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-66.7	-44.7	-179.7	-174	55.8	0	0	0	111.9	A62 V132 L133 W135 D171 S172 R177 F178 F179	A62-L175 HydrophobicContact CB-CD2 3.55Å; V132-L175 HydrophobicContact CG1-CD1 4.4Å; L133-L175 HydrophobicContact CD2-CD1 4Å; W135-L175 HydrophobicContact CD2-CD2 3.85Å; W135-L175 HydrophobicContact CE3-CB 4.28Å; W135-L175 HydrophobicContact CE3-CD1 3.65Å; W135-L175 HydrophobicContact CE3-CD2 3.67Å; W135-L175 HydrophobicContact CE3-CG 4.07Å; W135-L175 HydrophobicContact CG-CD2 4.27Å; W135-L175 HydrophobicContact CH2-CB 4.19Å; W135-L175 HydrophobicContact CZ3-CB 3.83Å; W135-L175 HydrophobicContact CZ3-CD1 3.87Å; W135-L175 HydrophobicContact CZ3-CD2 4.05Å; W135-L175 HydrophobicContact CZ3-CG 4.13Å; D171-L175 PolarHBondContact O-N 2.9Å; S172-L175 PolarHBondContact O-N 3.05Å; S172-L175 VanDerWaalsContact O-N 3.09Å; L175-R177 PolarHBondContact O-N 3.19Å; L175-F178 PolarHBondContact O-N 2.99Å; L175-F179 PolarHBondContact O-N 3.46Å
176	T	98.4	Very high	98	Very high	63 Å²	63	52.9 Å²	52.9	39%	0.387	28%	0.283	S	S	.	.	H	α-helix	trans	-60.8	-46.5	179.1	-52.2	0	0	0	0	111.9	P57 S172 F179 T180	P57-T176 PolarHBondContact O-OG1 3.35Å; S172-T176 PolarHBondContact O-N 3.08Å; S172-T176 PolarHBondContact O-OG1 3.27Å; S172-T176 VanDerWaalsContact O-OG1 3.1Å; T176-F179 WeakPolarHBondContact O-CB 3.49Å; T176-F179 PolarHBondContact O-N 3.39Å; T176-T180 PolarHBondContact O-N 3.42Å; T176-T180 PolarHBondContact O-OG1 2.9Å; T176-T180 VanDerWaalsContact O-OG1 3.09Å
177	R	98.2	Very high	98.1	Very high	69 Å²	69	55.6 Å²	55.6	26%	0.26	29%	0.285	S	S	.	.	H	α-helix	trans	-66.9	-38.4	177.1	66.1	-175.1	68.5	-155	-11.4	112.4	W163 I164 P173 T174 L175 F179 T180 F181	W163-R177 PolarHBondContact O-NH1 3.27Å; I164-R177 WeakPolarHBondContact O-CD 3.42Å; I164-R177 PolarHBondContact O-NE 3.38Å; I164-R177 PolarHBondContact O-NH1 3.11Å; P173-R177 WeakPolarHBondContact O-CG 3.28Å; P173-R177 PolarHBondContact O-N 3.1Å; P173-R177 PolarHBondContact O-NE 3.12Å; T174-R177 WeakPolarHBondContact O-CG 3.43Å; L175-R177 PolarHBondContact O-N 3.19Å; R177-F179 VanDerWaalsContact C-N 3.29Å; R177-F179 PolarHBondContact O-N 3.45Å; R177-T180 WeakPolarHBondContact O-CB 3.28Å; R177-T180 PolarHBondContact O-N 3.42Å; R177-T180 VanDerWaalsContact O-N 3.17Å; R177-F181 HydrophobicContact CB-CD2 4.37Å; R177-F181 HydrophobicContact CB-CE2 4.3Å; R177-F181 WeakPolarHBondContact O-CD2 3.35Å; R177-F181 PolarHBondContact O-N 3.44Å
178	F	98.6	Very high	98.2	Very high	12 Å²	12	57.9 Å²	57.9	5%	0.053	29%	0.289	C	S	.	.	H	α-helix	trans	-65.9	-37.4	178.6	-83.7	16.8	0	0	0	110.5	F128 M129 V132 T147 I164 T174 L175 H182	F128-F178 AromaticContact CE1-CE2 3.86Å; F128-F178 HydrophobicContact CE1-CE2 3.86Å; F128-F178 HydrophobicContact CE1-CZ 4.16Å; F128-F178 HydrophobicContact CZ-CE2 4.41Å; M129-F178 HydrophobicContact CB-CB 4.24Å; M129-F178 HydrophobicContact CB-CD2 4.35Å; M129-F178 HydrophobicContact CB-CG 4.31Å; M129-F178 HydrophobicContact CG-CB 4.36Å; M129-F178 HydrophobicContact CG-CD1 4.23Å; M129-F178 HydrophobicContact CG-CD2 4.04Å; M129-F178 HydrophobicContact CG-CE2 4.39Å; M129-F178 HydrophobicContact CG-CG 3.96Å; M129-F178 HydrophobicContact SD-CD1 4.17Å; M129-F178 HydrophobicContact SD-CG 4.36Å; V132-F178 HydrophobicContact CB-CD2 3.93Å; V132-F178 HydrophobicContact CG1-CD2 4Å; V132-F178 HydrophobicContact CG2-CD2 3.82Å; V132-F178 HydrophobicContact CG2-CE2 3.99Å; T147-F178 HydrophobicContact CG2-CZ 4.01Å; I164-F178 HydrophobicContact CG2-CE1 4.22Å; I164-F178 HydrophobicContact CG2-CZ 4.43Å; T174-F178 HydrophobicContact CG2-CD1 4.32Å; T174-F178 HydrophobicContact CG2-CD2 4.47Å; T174-F178 HydrophobicContact CG2-CE1 4.05Å; T174-F178 HydrophobicContact CG2-CE2 4.23Å; T174-F178 HydrophobicContact CG2-CZ 4Å; T174-F178 WeakPolarHBondContact O-CB 3.45Å; T174-F178 WeakPolarHBondContact O-CG 3.35Å; T174-F178 PolarHBondContact O-N 3.44Å; L175-F178 PolarHBondContact O-N 2.99Å; F178-H182 WeakPolarHBondContact O-CB 3.44Å; F178-H182 PolarHBondContact O-N 3.18Å
179	F	98.8	Very high	98.3	Very high	43 Å²	43	48.7 Å²	48.7	19%	0.189	25%	0.254	C	S	.	.	H	α-helix	trans	-59.8	-48.7	169.4	174.4	-108.7	0	0	0	111.8	A52 Y55 P57 L133 L175 T176 R177 F181 H182 F183	A52-F179 HydrophobicContact CB-CE2 4.24Å; A52-F179 HydrophobicContact CB-CZ 4.16Å; Y55-F179 AromaticContact CD1-CD2 3.65Å; Y55-F179 HydrophobicContact CD1-CD2 3.65Å; Y55-F179 AromaticContact CD1-CE2 3.66Å; Y55-F179 HydrophobicContact CD1-CE2 3.66Å; Y55-F179 HydrophobicContact CD1-CG 4.34Å; Y55-F179 HydrophobicContact CD1-CZ 4.36Å; Y55-F179 HydrophobicContact CE1-CB 4.31Å; Y55-F179 AromaticContact CE1-CD2 3.59Å; Y55-F179 HydrophobicContact CE1-CD2 3.59Å; Y55-F179 HydrophobicContact CE1-CE2 4.12Å; Y55-F179 HydrophobicContact CE1-CG 4.02Å; P57-F179 HydrophobicContact CB-CB 3.8Å; P57-F179 HydrophobicContact CB-CD1 3.96Å; P57-F179 HydrophobicContact CB-CG 3.91Å; P57-F179 HydrophobicContact CG-CD1 3.93Å; P57-F179 HydrophobicContact CG-CE1 4.43Å; P57-F179 HydrophobicContact CG-CG 4.38Å; L133-F179 HydrophobicContact CD1-CD2 4.04Å; L133-F179 HydrophobicContact CD2-CB 3.9Å; L175-F179 PolarHBondContact O-N 3.46Å; T176-F179 WeakPolarHBondContact O-CB 3.49Å; T176-F179 PolarHBondContact O-N 3.39Å; R177-F179 VanDerWaalsContact C-N 3.29Å; R177-F179 PolarHBondContact O-N 3.45Å; F179-F181 PolarHBondContact O-N 2.93Å; F179-H182 PolarHBondContact O-N 2.87Å; F179-F183 HydrophobicContact CZ-CD2 4.34Å; F179-F183 WeakPolarHBondContact O-CB 3.26Å; F179-F183 PolarHBondContact O-N 2.86Å
180	T	98.7	Very high	98.4	Very high	82 Å²	82	47.5 Å²	47.5	50%	0.503	25%	0.248	S	C	.	.	H	α-helix	trans	-58.6	-46.8	178.2	-54	0	0	0	0	112.4	T176 R177 F183 I184	T176-T180 PolarHBondContact O-N 3.42Å; T176-T180 PolarHBondContact O-OG1 2.9Å; T176-T180 VanDerWaalsContact O-OG1 3.09Å; R177-T180 WeakPolarHBondContact O-CB 3.28Å; R177-T180 PolarHBondContact O-N 3.42Å; R177-T180 VanDerWaalsContact O-N 3.17Å; T180-F183 PolarHBondContact O-N 3.29Å; T180-I184 WeakPolarHBondContact O-CG2 3.48Å; T180-I184 PolarHBondContact O-N 3.44Å; T180-I184 VanDerWaalsContact O-N 3.11Å
181	F	98.7	Very high	98.4	Very high	109 Å²	109	50.5 Å²	50.5	48%	0.478	27%	0.273	S	S	.	.	H	α-helix	trans	-68.4	-41.2	178.7	-74.3	-58.8	0	0	0	112.6	M129 R177 F179 F183 I184 L185	M129-F181 HydrophobicContact CE-CB 3.78Å; M129-F181 HydrophobicContact SD-CB 3.47Å; M129-F181 WeakPolarHBondContact SD-CB 3.28Å; M129-F181 HydrophobicContact SD-CG 4.34Å; R177-F181 HydrophobicContact CB-CD2 4.37Å; R177-F181 HydrophobicContact CB-CE2 4.3Å; R177-F181 WeakPolarHBondContact O-CD2 3.35Å; R177-F181 PolarHBondContact O-N 3.44Å; F179-F181 PolarHBondContact O-N 2.93Å; F181-F183 PolarHBondContact O-N 3.13Å; F181-I184 WeakPolarHBondContact O-CG2 3.47Å; F181-I184 PolarHBondContact O-N 3.47Å; F181-L185 WeakPolarHBondContact O-CB 3.5Å; F181-L185 VanDerWaalsContact O-CG 3.32Å; F181-L185 WeakPolarHBondContact O-CG 3.27Å; F181-L185 PolarHBondContact O-N 3.24Å
182	H	98.8	Very high	98.5	Very high	27 Å²	27	48.3 Å²	48.3	13%	0.125	26%	0.261	C	S	.	.	H	α-helix	trans	-61.8	-34	174.3	-179.7	71.6	0	0	0	112	H83 T126 M129 G130 L133 F178 F179 P186	H83-H182 AromaticContact NE2-NE2 3.97Å; T126-H182 PolarHBondContact O-CE1 2.85Å; T126-H182 PolarHBondContact O-ND1 2.98Å; M129-H182 HydrophobicContact CB-CB 4.11Å; G130-H182 WeakPolarHBondContact CA-CE1 2.99Å; G130-H182 VanDerWaalsContact CA-ND1 3.26Å; G130-H182 WeakPolarHBondContact CA-ND1 3.46Å; G130-H182 PolarHBondContact N-ND1 3.17Å; L133-H182 HydrophobicContact CD1-CB 4.31Å; F178-H182 WeakPolarHBondContact O-CB 3.44Å; F178-H182 PolarHBondContact O-N 3.18Å; F179-H182 PolarHBondContact O-N 2.87Å; H182-P186 WeakPolarHBondContact O-CD 3.38Å; H182-P186 WeakPolarHBondContact O-CG 3.26Å
183	F	98.8	Very high	98.6	Very high	81 Å²	81	48.6 Å²	48.6	36%	0.355	26%	0.264	S	S	.	.	H	α-helix	trans	-72.1	-43	177.3	-167.9	-84.4	0	0	0	112.5	L49 A52 F179 T180 F181 F187	L49-F183 HydrophobicContact CD1-CE2 4.2Å; L49-F183 HydrophobicContact CD1-CZ 4.03Å; A52-F183 HydrophobicContact CB-CD2 4.29Å; A52-F183 HydrophobicContact CB-CE2 4.01Å; F179-F183 HydrophobicContact CZ-CD2 4.34Å; F179-F183 WeakPolarHBondContact O-CB 3.26Å; F179-F183 PolarHBondContact O-N 2.86Å; T180-F183 PolarHBondContact O-N 3.29Å; F181-F183 PolarHBondContact O-N 3.13Å; F183-F187 HydrophobicContact CD1-CE2 4.11Å; F183-F187 AromaticContact CE1-CE2 3.86Å; F183-F187 HydrophobicContact CE1-CE2 3.86Å; F183-F187 HydrophobicContact CE1-CZ 4.5Å; F183-F187 HydrophobicContact CZ-CE2 4.48Å; F183-F187 VanDerWaalsContact O-CD2 3.26Å; F183-F187 WeakPolarHBondContact O-CD2 3.36Å; F183-F187 VanDerWaalsContact O-CE2 3.26Å; F183-F187 WeakPolarHBondContact O-CE2 3.24Å
184	I	98.8	Very high	98.6	Very high	79 Å²	79	48.6 Å²	48.6	41%	0.405	27%	0.27	S	S	.	.	H	α-helix	trans	-79.7	-35.3	-175.5	-169	61.6	0	0	0	113.6	T180 F181 F187 I188	T180-I184 WeakPolarHBondContact O-CG2 3.48Å; T180-I184 PolarHBondContact O-N 3.44Å; T180-I184 VanDerWaalsContact O-N 3.11Å; F181-I184 WeakPolarHBondContact O-CG2 3.47Å; F181-I184 PolarHBondContact O-N 3.47Å; I184-F187 PolarHBondContact O-N 3.38Å; I184-F187 VanDerWaalsContact O-N 3.12Å; I184-I188 HydrophobicContact CG1-CD1 4.2Å; I184-I188 PolarHBondContact O-N 3.02Å
185	L	98.7	Very high	98.6	Very high	30 Å²	30	52.1 Å²	52.1	16%	0.157	29%	0.288	C	S	.	.	H	α-helix	trans	-59.4	-39.7	-174.6	-80.5	176.7	0	0	0	114.7	A125 T126 M129 F181 F187 I188 I189	A125-L185 HydrophobicContact CB-CD1 4.11Å; T126-L185 HydrophobicContact CG2-CB 4.47Å; T126-L185 WeakPolarHBondContact OG1-CB 3.19Å; T126-L185 WeakPolarHBondContact OG1-CD1 3.13Å; M129-L185 HydrophobicContact CE-CD1 3.2Å; M129-L185 HydrophobicContact CE-CG 4.41Å; F181-L185 WeakPolarHBondContact O-CB 3.5Å; F181-L185 VanDerWaalsContact O-CG 3.32Å; F181-L185 WeakPolarHBondContact O-CG 3.27Å; F181-L185 PolarHBondContact O-N 3.24Å; L185-F187 PolarHBondContact O-N 3.43Å; L185-I188 HydrophobicContact CD2-CD1 4.2Å; L185-I188 CarbonylContact O-C 3.25Å; L185-I188 WeakPolarHBondContact O-CA 3.14Å; L185-I188 WeakPolarHBondContact O-CB 3.45Å; L185-I188 PolarHBondContact O-N 3.12Å; L185-I189 WeakPolarHBondContact O-CG1 3.38Å; L185-I189 PolarHBondContact O-N 3.11Å
186	P	98.8	Very high	98.7	Very high	16 Å²	16	53.4 Å²	53.4	10%	0.104	29%	0.294	C	S	.	.	H	α-helix	trans	-54.1	-34.8	174.7	-29.1	34.9	0	0	0	113.9	I45 T126 H182 I189 A190	I45-P186 HydrophobicContact CD1-CB 4.22Å; I45-P186 HydrophobicContact CG1-CB 3.7Å; T126-P186 HydrophobicContact CG2-CG 3.88Å; H182-P186 WeakPolarHBondContact O-CD 3.38Å; H182-P186 WeakPolarHBondContact O-CG 3.26Å; P186-I189 PolarHBondContact O-N 2.77Å; P186-A190 PolarHBondContact O-N 2.95Å
187	F	98.7	Very high	98.6	Very high	95 Å²	95	53.9 Å²	53.9	42%	0.417	29%	0.294	S	S	.	.	H	α-helix	trans	-74.4	-35.6	176.2	-58.6	-75.8	0	0	0	112.1	I45 F183 I184 L185 I189 A190 A191	I45-F187 HydrophobicContact CG2-CE1 4Å; I45-F187 HydrophobicContact CG2-CZ 4.19Å; F183-F187 HydrophobicContact CD1-CE2 4.11Å; F183-F187 AromaticContact CE1-CE2 3.86Å; F183-F187 HydrophobicContact CE1-CE2 3.86Å; F183-F187 HydrophobicContact CE1-CZ 4.5Å; F183-F187 HydrophobicContact CZ-CE2 4.48Å; F183-F187 VanDerWaalsContact O-CD2 3.26Å; F183-F187 WeakPolarHBondContact O-CD2 3.36Å; F183-F187 VanDerWaalsContact O-CE2 3.26Å; F183-F187 WeakPolarHBondContact O-CE2 3.24Å; I184-F187 PolarHBondContact O-N 3.38Å; I184-F187 VanDerWaalsContact O-N 3.12Å; L185-F187 PolarHBondContact O-N 3.43Å; F187-I189 VanDerWaalsContact C-N 3.34Å; F187-A190 WeakPolarHBondContact O-CB 3.38Å; F187-A190 PolarHBondContact O-N 3.42Å; F187-A191 PolarHBondContact O-N 2.76Å; F187-A191 VanDerWaalsContact O-N 3.08Å
188	I	98.8	Very high	98.6	Very high	77 Å²	77	55.1 Å²	55.1	40%	0.395	31%	0.305	S	S	.	.	H	α-helix	trans	-64.4	-41.8	171.4	-63	171.8	0	0	0	110	I184 L185 A190 A191 L192	I184-I188 HydrophobicContact CG1-CD1 4.2Å; I184-I188 PolarHBondContact O-N 3.02Å; L185-I188 HydrophobicContact CD2-CD1 4.2Å; L185-I188 CarbonylContact O-C 3.25Å; L185-I188 WeakPolarHBondContact O-CA 3.14Å; L185-I188 WeakPolarHBondContact O-CB 3.45Å; L185-I188 PolarHBondContact O-N 3.12Å; I188-A190 VanDerWaalsContact C-N 3.31Å; I188-A190 PolarHBondContact O-N 2.74Å; I188-A191 PolarHBondContact O-N 2.58Å; I188-L192 HydrophobicContact CG2-CD1 4.08Å; I188-L192 HydrophobicContact CG2-CG 4.44Å; I188-L192 WeakPolarHBondContact O-CG 3.44Å; I188-L192 PolarHBondContact O-N 3.18Å
189	I	98.9	Very high	98.6	Very high	7 Å²	7	57.8 Å²	57.8	4%	0.036	32%	0.317	C	S	.	.	H	α-helix	trans	-60.1	-41.6	174.1	-68.7	167	0	0	0	110.4	L41 L119 A122 T126 L185 P186 F187 A191 L192 A193	L41-I189 HydrophobicContact CD1-CB 4.37Å; L41-I189 HydrophobicContact CD1-CG2 3.87Å; L41-I189 HydrophobicContact CD2-CG2 3.99Å; L119-I189 HydrophobicContact CD2-CG2 3.84Å; A122-I189 HydrophobicContact CB-CD1 4.2Å; A122-I189 HydrophobicContact CB-CG1 3.76Å; T126-I189 WeakPolarHBondContact OG1-CD1 3.5Å; L185-I189 WeakPolarHBondContact O-CG1 3.38Å; L185-I189 PolarHBondContact O-N 3.11Å; P186-I189 PolarHBondContact O-N 2.77Å; F187-I189 VanDerWaalsContact C-N 3.34Å; I189-A191 PolarHBondContact O-N 3.21Å; I189-L192 PolarHBondContact O-N 2.6Å; I189-A193 VanDerWaalsContact O-CB 3.29Å; I189-A193 WeakPolarHBondContact O-CB 3.18Å; I189-A193 PolarHBondContact O-N 3.03Å
190	A	98.8	Very high	98.5	Very high	39 Å²	39	57.4 Å²	57.4	32%	0.322	32%	0.317	S	S	.	.	H	α-helix	trans	-61.3	-42.2	175.5	0	0	0	0	0	112.4	L41 P186 F187 I188 A193 A194	L41-A190 HydrophobicContact CD2-CB 3.96Å; P186-A190 PolarHBondContact O-N 2.95Å; F187-A190 WeakPolarHBondContact O-CB 3.38Å; F187-A190 PolarHBondContact O-N 3.42Å; I188-A190 VanDerWaalsContact C-N 3.31Å; I188-A190 PolarHBondContact O-N 2.74Å; A190-A193 PolarHBondContact O-N 3.44Å; A190-A194 PolarHBondContact O-N 2.92Å
191	A	98.8	Very high	98.4	Very high	66 Å²	66	56.6 Å²	56.6	55%	0.545	31%	0.307	S	S	.	.	H	α-helix	trans	-65	-43.7	175.1	0	0	0	0	0	112.1	F187 I188 I189 A193 A194 L195	F187-A191 PolarHBondContact O-N 2.76Å; F187-A191 VanDerWaalsContact O-N 3.08Å; I188-A191 PolarHBondContact O-N 2.58Å; I189-A191 PolarHBondContact O-N 3.21Å; A191-A193 VanDerWaalsContact C-N 3.32Å; A191-A193 PolarHBondContact O-N 3.45Å; A191-A194 PolarHBondContact O-N 2.86Å; A191-L195 PolarHBondContact O-N 3.37Å
192	L	98.8	Very high	98.3	Very high	35 Å²	35	58.5 Å²	58.5	18%	0.183	32%	0.317	C	S	.	.	H	α-helix	trans	-64	-35.7	175	-72.2	170.6	0	0	0	112.2	I118 L119 A122 I188 I189 L195 H196	I118-L192 HydrophobicContact CG2-CD1 3.92Å; I118-L192 HydrophobicContact CG2-CD2 4.33Å; L119-L192 HydrophobicContact CD2-CB 3.53Å; L119-L192 HydrophobicContact CD2-CD1 4.47Å; L119-L192 HydrophobicContact CG-CB 4.04Å; A122-L192 HydrophobicContact CB-CD1 4.5Å; I188-L192 HydrophobicContact CG2-CD1 4.08Å; I188-L192 HydrophobicContact CG2-CG 4.44Å; I188-L192 WeakPolarHBondContact O-CG 3.44Å; I188-L192 PolarHBondContact O-N 3.18Å; I189-L192 PolarHBondContact O-N 2.6Å; L192-L195 PolarHBondContact O-N 3.23Å; L192-H196 WeakPolarHBondContact O-CB 3.43Å; L192-H196 PolarHBondContact O-N 3.32Å
193	A	98.7	Very high	98	Very high	29 Å²	29	60.5 Å²	60.5	24%	0.24	33%	0.332	C	S	.	.	H	α-helix	trans	-67.9	-38	176.2	0	0	0	0	0	111.6	L119 I189 A190 A191 L195 H196 L197	L119-A193 HydrophobicContact CD2-CB 4.4Å; I189-A193 VanDerWaalsContact O-CB 3.29Å; I189-A193 WeakPolarHBondContact O-CB 3.18Å; I189-A193 PolarHBondContact O-N 3.03Å; A190-A193 PolarHBondContact O-N 3.44Å; A191-A193 VanDerWaalsContact C-N 3.32Å; A191-A193 PolarHBondContact O-N 3.45Å; A193-L195 VanDerWaalsContact C-N 3.34Å; A193-H196 WeakPolarHBondContact O-CB 3.5Å; A193-H196 PolarHBondContact O-N 3.06Å; A193-L197 WeakPolarHBondContact O-CG 3.4Å; A193-L197 PolarHBondContact O-N 3.37Å
194	A	98.2	Very high	97.9	Very high	62 Å²	62	57.1 Å²	57.1	51%	0.512	32%	0.32	S	S	.	.	H	α-helix	trans	-62.7	-42.1	171.5	0	0	0	0	0	111.5	A190 A191 L197 L198	A190-A194 PolarHBondContact O-N 2.92Å; A191-A194 PolarHBondContact O-N 2.86Å; A194-L197 PolarHBondContact O-N 3.17Å; A194-L198 WeakPolarHBondContact O-CB 3.29Å; A194-L198 PolarHBondContact O-N 2.72Å
195	L	98.4	Very high	97.8	Very high	73 Å²	73	54.8 Å²	54.8	38%	0.382	31%	0.31	S	S	.	.	H	α-helix	trans	-64.7	-40.5	174.7	-172.8	65.6	0	0	0	112.1	I115 A191 L192 A193 L197 L198 F199	I115-L195 HydrophobicContact CD1-CD2 3.87Å; I115-L195 HydrophobicContact CD1-CG 3.77Å; I115-L195 HydrophobicContact CG1-CD2 4.46Å; A191-L195 PolarHBondContact O-N 3.37Å; L192-L195 PolarHBondContact O-N 3.23Å; A193-L195 VanDerWaalsContact C-N 3.34Å; L195-L197 VanDerWaalsContact C-N 3.34Å; L195-L197 PolarHBondContact O-N 3.44Å; L195-L198 HydrophobicContact CD1-CD2 4.26Å; L195-L198 WeakPolarHBondContact O-CB 3.41Å; L195-L198 PolarHBondContact O-N 2.75Å; L195-F199 HydrophobicContact CD1-CD2 4.18Å; L195-F199 HydrophobicContact CD1-CE2 3.74Å; L195-F199 HydrophobicContact CD2-CE2 4.4Å; L195-F199 HydrophobicContact CG-CD2 4.1Å; L195-F199 HydrophobicContact CG-CE2 3.89Å; L195-F199 WeakPolarHBondContact O-CD2 3.49Å; L195-F199 PolarHBondContact O-N 2.94Å; L195-F199 VanDerWaalsContact O-N 3.11Å
196	H	98.6	Very high	97.8	Very high	27 Å²	27	53.6 Å²	53.6	13%	0.125	30%	0.304	C	S	.	.	H	α-helix	trans	-58.7	-45.4	175.4	-175.1	83.9	0	0	0	111.7	T112 I115 L119 L192 A193 L200	T112-H196 WeakPolarHBondContact CG2-CE1 3.47Å; T112-H196 PolarHBondContact O-CE1 2.88Å; T112-H196 PolarHBondContact O-ND1 3.44Å; I115-H196 HydrophobicContact CB-CB 4.5Å; I115-H196 HydrophobicContact CG2-CB 3.7Å; L119-H196 HydrophobicContact CD1-CB 3.81Å; L192-H196 WeakPolarHBondContact O-CB 3.43Å; L192-H196 PolarHBondContact O-N 3.32Å; A193-H196 WeakPolarHBondContact O-CB 3.5Å; A193-H196 PolarHBondContact O-N 3.06Å; H196-L200 WeakPolarHBondContact O-CB 3.43Å; H196-L200 PolarHBondContact O-N 3.46Å
197	L	98.1	Very high	97.8	Very high	74 Å²	74	53 Å²	53	39%	0.387	30%	0.3	S	S	.	.	H	α-helix	trans	-67.9	-35.7	176.2	-71.4	174.3	0	0	0	112.5	A193 A194 L195 L200 H201	A193-L197 WeakPolarHBondContact O-CG 3.4Å; A193-L197 PolarHBondContact O-N 3.37Å; A194-L197 PolarHBondContact O-N 3.17Å; L195-L197 VanDerWaalsContact C-N 3.34Å; L195-L197 PolarHBondContact O-N 3.44Å; L197-L200 HydrophobicContact CD2-CD2 4.13Å; L197-L200 WeakPolarHBondContact O-CB 3.43Å; L197-L200 PolarHBondContact O-N 3.48Å; L197-H201 WeakPolarHBondContact O-CB 3.49Å; L197-H201 PolarHBondContact O-CD2 2.91Å; L197-H201 VanDerWaalsContact O-CG 3.22Å; L197-H201 PolarHBondContact O-N 3.38Å
198	L	97.3	Very high	97.8	Very high	95 Å²	95	49 Å²	49	50%	0.497	28%	0.284	S	S	.	.	H	α-helix	trans	-58.2	-52.9	175.1	-177.5	122.2	0	0	0	110.9	A194 L195 L200 H201 E202	A194-L198 WeakPolarHBondContact O-CB 3.29Å; A194-L198 PolarHBondContact O-N 2.72Å; L195-L198 HydrophobicContact CD1-CD2 4.26Å; L195-L198 WeakPolarHBondContact O-CB 3.41Å; L195-L198 PolarHBondContact O-N 2.75Å; L198-L200 VanDerWaalsContact C-N 3.3Å; L198-L200 PolarHBondContact O-N 3.2Å; L198-H201 PolarHBondContact O-N 3.49Å; L198-H201 VanDerWaalsContact O-N 3.09Å; L198-E202 PolarHBondContact O-N 3.31Å
199	F	98.2	Very high	97.7	Very high	67 Å²	67	48 Å²	48	29%	0.294	28%	0.279	S	S	.	.	H	α-helix	trans	-63.6	-35.2	176.3	-77.2	-70.7	0	0	0	113	E111 T112 I115 L195 H201 E202	E111-F199 HydrophobicContact CB-CB 4.12Å; E111-F199 HydrophobicContact CB-CD1 3.49Å; E111-F199 VanDerWaalsContact CB-CD1 3.49Å; E111-F199 HydrophobicContact CB-CD2 4.23Å; E111-F199 HydrophobicContact CB-CE1 3.85Å; E111-F199 HydrophobicContact CB-CG 3.69Å; E111-F199 HydrophobicContact CB-CZ 4.34Å; E111-F199 HydrophobicContact CG-CD1 3.91Å; E111-F199 HydrophobicContact CG-CE1 3.85Å; E111-F199 HydrophobicContact CG-CZ 4.45Å; T112-F199 WeakPolarHBondContact OG1-CB 3.41Å; I115-F199 HydrophobicContact CD1-CD2 3.17Å; I115-F199 HydrophobicContact CD1-CE2 3.43Å; I115-F199 VanDerWaalsContact CD1-CE2 3.43Å; I115-F199 HydrophobicContact CD1-CG 4.25Å; L195-F199 HydrophobicContact CD1-CD2 4.18Å; L195-F199 HydrophobicContact CD1-CE2 3.74Å; L195-F199 HydrophobicContact CD2-CE2 4.4Å; L195-F199 HydrophobicContact CG-CD2 4.1Å; L195-F199 HydrophobicContact CG-CE2 3.89Å; L195-F199 WeakPolarHBondContact O-CD2 3.49Å; L195-F199 PolarHBondContact O-N 2.94Å; L195-F199 VanDerWaalsContact O-N 3.11Å; F199-H201 VanDerWaalsContact C-N 3.28Å; F199-H201 PolarHBondContact O-N 3.46Å; F199-E202 WeakPolarHBondContact O-CB 3.39Å; F199-E202 PolarHBondContact O-N 2.8Å
200	L	97.8	Very high	97.6	Very high	36 Å²	36	48.2 Å²	48.2	19%	0.188	28%	0.283	C	S	.	.	H	α-helix	trans	-62.2	-36.6	173.7	178.3	65.1	0	0	0	112	T112 H196 L197 L198 E202 T203 G204	T112-L200 HydrophobicContact CG2-CB 4.16Å; T112-L200 HydrophobicContact CG2-CD1 4.49Å; T112-L200 PolarHBondContact OG1-N 3.07Å; H196-L200 WeakPolarHBondContact O-CB 3.43Å; H196-L200 PolarHBondContact O-N 3.46Å; L197-L200 HydrophobicContact CD2-CD2 4.13Å; L197-L200 WeakPolarHBondContact O-CB 3.43Å; L197-L200 PolarHBondContact O-N 3.48Å; L198-L200 VanDerWaalsContact C-N 3.3Å; L198-L200 PolarHBondContact O-N 3.2Å; L200-E202 VanDerWaalsContact C-N 3.33Å; L200-T203 PolarHBondContact O-N 2.93Å; L200-T203 PolarHBondContact O-OG1 2.67Å; L200-G204 CarbonylContact O-C 2.91Å; L200-G204 VanDerWaalsContact O-CA 3.25Å; L200-G204 WeakPolarHBondContact O-CA 3.49Å; L200-G204 PolarHBondContact O-N 3.35Å
201	H	96.4	Very high	97.5	Very high	64 Å²	64	51.2 Å²	51.2	30%	0.296	29%	0.293	S	S	.	.	H	α-helix	trans	-74.6	-22.3	-178.8	-70.5	177.5	0	0	0	113.3	L197 L198 F199	L197-H201 WeakPolarHBondContact O-CB 3.49Å; L197-H201 PolarHBondContact O-CD2 2.91Å; L197-H201 VanDerWaalsContact O-CG 3.22Å; L197-H201 PolarHBondContact O-N 3.38Å; L198-H201 PolarHBondContact O-N 3.49Å; L198-H201 VanDerWaalsContact O-N 3.09Å; F199-H201 VanDerWaalsContact C-N 3.28Å; F199-H201 PolarHBondContact O-N 3.46Å
202	E	95.7	Very high	97.4	Very high	149 Å²	149	52.8 Å²	52.8	70%	0.696	30%	0.296	S	S	*	.	H	α-helix	trans	-62.2	-41.7	172.1	-66.5	-61	135.3	0	0	111.7	L198 F199 L200	L198-E202 PolarHBondContact O-N 3.31Å; F199-E202 WeakPolarHBondContact O-CB 3.39Å; F199-E202 PolarHBondContact O-N 2.8Å; L200-E202 VanDerWaalsContact C-N 3.33Å
203	T	94.1	Very high	97.3	Very high	70 Å²	70	51.9 Å²	51.9	43%	0.429	29%	0.292	S	S	.	.	H	α-helix	trans	-95.8	-27	179.9	60.7	0	0	0	0	113.3	Y109 L200	Y109-T203 HydrophobicContact CD1-CG2 4.01Å; Y109-T203 HydrophobicContact CE1-CG2 4.27Å; L200-T203 PolarHBondContact O-N 2.93Å; L200-T203 PolarHBondContact O-OG1 2.67Å
204	G	95.4	Very high	97.2	Very high	10 Å²	10	57.5 Å²	57.5	10%	0.103	31%	0.313	C	S	.	.			trans	75.7	173.2	-161.9	0	0	0	0	0	112.6	L200	L200-G204 CarbonylContact O-C 2.91Å; L200-G204 VanDerWaalsContact O-CA 3.25Å; L200-G204 WeakPolarHBondContact O-CA 3.49Å; L200-G204 PolarHBondContact O-N 3.35Å
205	S	97.1	Very high	97.1	Very high	29 Å²	29	60.2 Å²	60.2	20%	0.203	33%	0.328	C	S	.	.			trans	-68.8	141	179	-72.6	0	0	0	0	112.8	P24	P24-S205 VanDerWaalsContact CG-O 3.28Å; P24-S205 WeakPolarHBondContact CG-O 3.19Å
206	N	97.9	Very high	97	Very high	5 Å²	5	60.8 Å²	60.8	3%	0.027	33%	0.332	C	S	.	.			trans	-66.1	174.6	159.5	-174.8	24.2	0	0	0	110.4	I27 W31 Y104 S106 Y109 Q313	I27-N206 WeakPolarHBondContact CG2-O 3.38Å; W31-N206 VanDerWaalsContact CE2-O 3.3Å; W31-N206 HydrophobicContact CZ2-CB 4.33Å; W31-N206 VanDerWaalsContact CZ2-O 3.29Å; W31-N206 WeakPolarHBondContact CZ2-O 3.42Å; W31-N206 PolarHBondContact NE1-O 3.47Å; Y104-N206 PolarHBondContact O-ND2 3.48Å; S106-N206 PolarHBondContact OG-ND2 3.12Å; Y109-N206 HydrophobicContact CE2-CB 3.64Å; N206-Q313 PolarHBondContact ND2-NE2 2.97Å
207	N	98.6	Very high	97	Very high	3 Å²	3	62.7 Å²	62.7	2%	0.016	34%	0.34	C	S	.	.			trans	-140.7	167.3	175.7	70.1	85.5	0	0	0	112.6	P24 N26 I27 L209 G210 I211	P24-N207 HydrophobicContact CB-CB 3.86Å; P24-N207 HydrophobicContact CG-CB 4.17Å; N26-N207 PolarHBondContact ND2-OD1 3.44Å; N26-N207 WeakPolarHBondContact OD1-CB 3.48Å; I27-N207 HydrophobicContact CG2-CB 4.12Å; N207-L209 PolarHBondContact O-N 2.79Å; N207-L209 VanDerWaalsContact O-N 3.12Å; N207-L209 WeakPolarHBondContact OD1-CB 2.99Å; N207-L209 PolarHBondContact OD1-N 2.89Å; N207-L209 VanDerWaalsContact OD1-N 3.11Å; N207-G210 PolarHBondContact O-N 3.31Å; N207-I211 PolarHBondContact ND2-O 3.05Å
208	P	98.6	Very high	97	Very high	13 Å²	13	61.2 Å²	61.2	8%	0.084	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-31.3	-173.7	-29.9	37.6	0	0	0	115.6	N26 W31 Y104 G210 S314 M316	N26-P208 VanDerWaalsContact O-CD 3.27Å; N26-P208 WeakPolarHBondContact O-CD 3.17Å; N26-P208 WeakPolarHBondContact O-CG 3.3Å; W31-P208 HydrophobicContact CH2-CG 4.09Å; W31-P208 HydrophobicContact CZ3-CG 3.84Å; Y104-P208 VanDerWaalsContact CD1-CA 3.49Å; Y104-P208 HydrophobicContact CD1-CB 4.19Å; Y104-P208 WeakPolarHBondContact CD1-O 3.47Å; Y104-P208 VanDerWaalsContact CE1-CA 3.5Å; Y104-P208 HydrophobicContact CE1-CB 3.65Å; Y104-P208 HydrophobicContact CE1-CG 4.4Å; P208-G210 VanDerWaalsContact C-N 3.3Å; P208-G210 PolarHBondContact O-N 3.21Å; P208-S314 WeakPolarHBondContact O-CB 2.86Å; P208-S314 PolarHBondContact O-OG 3.37Å; P208-M316 HydrophobicContact CB-SD 4.3Å
209	L	98.2	Very high	97	Very high	54 Å²	54	59.6 Å²	59.6	28%	0.283	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-20.3	-178.8	-57.5	179.2	0	0	0	112.5	N207 I211 M316 F317	N207-L209 PolarHBondContact O-N 2.79Å; N207-L209 VanDerWaalsContact O-N 3.12Å; N207-L209 WeakPolarHBondContact OD1-CB 2.99Å; N207-L209 PolarHBondContact OD1-N 2.89Å; N207-L209 VanDerWaalsContact OD1-N 3.11Å; L209-I211 HydrophobicContact CB-CD1 4.21Å; L209-I211 HydrophobicContact CB-CG1 3.84Å; L209-I211 HydrophobicContact CD1-CD1 3.99Å; L209-I211 HydrophobicContact CD1-CG1 4.33Å; L209-I211 PolarHBondContact O-N 3.3Å; L209-M316 HydrophobicContact CD2-CE 3.82Å; L209-M316 HydrophobicContact CD2-SD 3.69Å; L209-F317 HydrophobicContact CD2-CE2 4.19Å; L209-F317 HydrophobicContact CD2-CZ 3.84Å
210	G	97.2	Very high	97	Very high	12 Å²	12	57.9 Å²	57.9	12%	0.124	32%	0.318	C	S	.	.			trans	64.1	26.6	-176	0	0	0	0	0	113.9	N207 P208	N207-G210 PolarHBondContact O-N 3.31Å; P208-G210 VanDerWaalsContact C-N 3.3Å; P208-G210 PolarHBondContact O-N 3.21Å
211	I	96.7	Very high	97	Very high	103 Å²	103	60.6 Å²	60.6	53%	0.528	33%	0.33	S	S	.	.	S	Bend	trans	-117.3	163.1	173.5	65	179.2	0	0	0	109.6	N207 L209 S213	N207-I211 PolarHBondContact ND2-O 3.05Å; L209-I211 HydrophobicContact CB-CD1 4.21Å; L209-I211 HydrophobicContact CB-CG1 3.84Å; L209-I211 HydrophobicContact CD1-CD1 3.99Å; L209-I211 HydrophobicContact CD1-CG1 4.33Å; L209-I211 PolarHBondContact O-N 3.3Å; I211-S213 PolarHBondContact O-N 3.3Å
212	T	96.4	Very high	97.1	Very high	99 Å²	99	60.8 Å²	60.8	61%	0.607	34%	0.337	S	S	*	.			trans	-58.9	135.8	176.7	-177.3	0	0	0	0	111.9	H214	T212-H214 PolarHBondContact OG1-CD2 3.46Å; T212-H214 PolarHBondContact OG1-N 3.04Å
213	S	96.5	Very high	97.2	Very high	16 Å²	16	60.1 Å²	60.1	11%	0.112	33%	0.329	C	S	.	.			trans	-106.1	13.5	178.1	80.4	0	0	0	0	112.8	P24 I211 S215 D216 K217	P24-S213 WeakPolarHBondContact CB-OG 3.44Å; P24-S213 WeakPolarHBondContact CG-OG 3.35Å; I211-S213 PolarHBondContact O-N 3.3Å; S213-S215 PolarHBondContact O-N 3.37Å; S213-D216 CarbonylContact O-C 3.58Å; S213-D216 VanDerWaalsContact O-C 3.25Å; S213-D216 PolarHBondContact O-N 2.94Å; S213-K217 VanDerWaalsContact O-CG 3.26Å; S213-K217 WeakPolarHBondContact O-CG 3.44Å
214	H	95.2	Very high	97.4	Very high	146 Å²	146	57.2 Å²	57.2	68%	0.676	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-30.5	-176.5	-71.8	-60.1	0	0	0	113.2	T212 D216	T212-H214 PolarHBondContact OG1-CD2 3.46Å; T212-H214 PolarHBondContact OG1-N 3.04Å; H214-D216 VanDerWaalsContact C-N 3.26Å; H214-D216 PolarHBondContact O-N 3.39Å
215	S	96.4	Very high	97.6	Very high	120 Å²	120	59.5 Å²	59.5	84%	0.839	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-20.9	177.2	55.6	0	0	0	0	113.7	S213	S213-S215 PolarHBondContact O-N 3.37Å
216	D	97.4	Very high	97.6	Very high	85 Å²	85	63.7 Å²	63.7	46%	0.455	34%	0.341	S	S	.	.	S	Bend	trans	-145.6	85.2	-177.4	-173	16.9	0	0	0	111.3	S25 S213 H214	S25-D216 VanDerWaalsContact CB-OD2 3.29Å; S25-D216 WeakPolarHBondContact CB-OD2 3.3Å; S25-D216 PolarHBondContact N-O 2.99Å; S25-D216 PolarHBondContact OG-OD2 3.48Å; S213-D216 CarbonylContact O-C 3.58Å; S213-D216 VanDerWaalsContact O-C 3.25Å; S213-D216 PolarHBondContact O-N 2.94Å; H214-D216 VanDerWaalsContact C-N 3.26Å; H214-D216 PolarHBondContact O-N 3.39Å
217	K	97.8	Very high	97.7	Very high	67 Å²	67	65.8 Å²	65.8	29%	0.291	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	140	170.5	-64.3	-164.6	175.8	-170.4	0	109.9	P22 T23 S213	P22-K217 HydrophobicContact CB-CB 4.16Å; P22-K217 HydrophobicContact CB-CD 3.64Å; T23-K217 WeakPolarHBondContact O-CA 3.36Å; S213-K217 VanDerWaalsContact O-CG 3.26Å; S213-K217 WeakPolarHBondContact O-CG 3.44Å
218	I	98.1	Very high	97.7	Very high	43 Å²	43	67 Å²	67	22%	0.221	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	158.5	170.8	62.5	-178.5	0	0	0	109.4	T23 Y223 Y224	T23-I218 PolarHBondContact N-O 2.92Å; T23-I218 PolarHBondContact O-N 2.82Å; I218-Y223 HydrophobicContact CB-CD2 4.06Å; I218-Y223 HydrophobicContact CB-CE2 4.23Å; I218-Y223 HydrophobicContact CD1-CD1 4.36Å; I218-Y223 HydrophobicContact CD1-CD2 3.84Å; I218-Y223 HydrophobicContact CD1-CG 3.74Å; I218-Y223 HydrophobicContact CG1-CD2 4.2Å; I218-Y224 HydrophobicContact CD1-CD2 4.49Å; I218-Y224 HydrophobicContact CD1-CE2 3.7Å; I218-Y224 HydrophobicContact CG1-CD2 4.49Å; I218-Y224 HydrophobicContact CG1-CE2 3.75Å
219	T	97.4	Very high	97.7	Very high	60 Å²	60	68.9 Å²	68.9	37%	0.368	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	145.3	172.1	51.4	0	0	0	0	110.3	H221 Y223	T219-H221 WeakPolarHBondContact CB-O 3.49Å; T219-H221 PolarHBondContact O-N 3.49Å; T219-H221 PolarHBondContact OG1-O 3.2Å; T219-Y223 WeakPolarHBondContact O-CD2 3.34Å
220	F	98.3	Very high	97.7	Very high	31 Å²	31	71.2 Å²	71.2	14%	0.136	39%	0.385	C	S	.	.	S	Bend	trans	-59.8	-46.3	178.4	-171.2	-81.5	0	0	0	112	F18 I19 L21 P222 Y223 Y224 T225	F18-F220 WeakPolarHBondContact O-CD1 3.41Å; I19-F220 PolarHBondContact O-N 3.27Å; L21-F220 HydrophobicContact CB-CB 3.95Å; L21-F220 HydrophobicContact CD2-CD2 4.25Å; L21-F220 PolarHBondContact O-N 3.05Å; F220-P222 CarbonylContact O-C 3.45Å; F220-Y223 PolarHBondContact O-N 3.01Å; F220-Y224 VanDerWaalsContact CD2-CB 3.5Å; F220-Y224 HydrophobicContact CD2-CD2 4.23Å; F220-Y224 HydrophobicContact CD2-CG 4.19Å; F220-Y224 HydrophobicContact CE2-CG 4.27Å; F220-Y224 WeakPolarHBondContact O-CA 3.45Å; F220-Y224 PolarHBondContact O-N 3.07Å; F220-T225 PolarHBondContact O-N 2.98Å
221	H	98.1	Very high	97.8	Very high	93 Å²	93	71.2 Å²	71.2	43%	0.431	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	133.6	170.6	-172.3	74.1	0	0	0	110.6	I19 T219 T225	I19-H221 HydrophobicContact CG2-CB 4.07Å; I19-H221 PolarHBondContact O-N 3.11Å; T219-H221 WeakPolarHBondContact CB-O 3.49Å; T219-H221 PolarHBondContact O-N 3.49Å; T219-H221 PolarHBondContact OG1-O 3.2Å; H221-T225 PolarHBondContact ND1-OG1 3.33Å; H221-T225 VanDerWaalsContact ND1-OG1 3.13Å
222	P	97.9	Very high	97.9	Very high	68 Å²	68	69.6 Å²	69.6	44%	0.442	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	cis	-89.3	-14.8	1.8	35.3	-35.4	0	0	0	114.7	F220 Y224 T225 I226	F220-P222 CarbonylContact O-C 3.45Å; P222-Y224 PolarHBondContact O-N 3.38Å; P222-T225 PolarHBondContact O-N 3.14Å; P222-I226 WeakPolarHBondContact O-CG2 3.48Å; P222-I226 PolarHBondContact O-N 3.4Å
223	Y	98.5	Very high	98	Very high	135 Å²	135	70.1 Å²	70.1	53%	0.529	38%	0.376	S	S	.	.	H	α-helix	trans	-58.4	-52.7	-164	-61.9	-75.8	0	0	0	114.3	I218 T219 F220 I226 K227	I218-Y223 HydrophobicContact CB-CD2 4.06Å; I218-Y223 HydrophobicContact CB-CE2 4.23Å; I218-Y223 HydrophobicContact CD1-CD1 4.36Å; I218-Y223 HydrophobicContact CD1-CD2 3.84Å; I218-Y223 HydrophobicContact CD1-CG 3.74Å; I218-Y223 HydrophobicContact CG1-CD2 4.2Å; T219-Y223 WeakPolarHBondContact O-CD2 3.34Å; F220-Y223 PolarHBondContact O-N 3.01Å; Y223-I226 VanDerWaalsContact O-CG2 3.29Å; Y223-I226 WeakPolarHBondContact O-CG2 3.29Å; Y223-K227 WeakPolarHBondContact O-CB 3.24Å; Y223-K227 PolarHBondContact O-N 2.91Å
224	Y	98.3	Very high	98.1	Very high	9 Å²	9	74.3 Å²	74.3	4%	0.035	40%	0.396	C	S	.	.	H	α-helix	trans	-84	-25	-180	-67	-59.4	0	0	0	112.4	T23 P24 S25 I27 I218 F220 P222 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 4.35Å; P24-Y224 PolarHBondContact O-OH 2.67Å; S25-Y224 VanDerWaalsContact C-OH 3.28Å; S25-Y224 PolarHBondContact O-OH 2.96Å; I27-Y224 HydrophobicContact CD1-CD1 3.78Å; I27-Y224 HydrophobicContact CD1-CD2 4.44Å; I27-Y224 HydrophobicContact CD1-CE1 3.47Å; I27-Y224 VanDerWaalsContact CD1-CE1 3.47Å; I27-Y224 HydrophobicContact CD1-CE2 4.13Å; I27-Y224 HydrophobicContact CD1-CG 4.29Å; I27-Y224 HydrophobicContact CG1-CD1 4.09Å; I27-Y224 HydrophobicContact CG1-CE1 3.26Å; I27-Y224 HydrophobicContact CG1-CE2 4.11Å; I27-Y224 WeakPolarHBondContact CG1-OH 3.38Å; I218-Y224 HydrophobicContact CD1-CD2 4.49Å; I218-Y224 HydrophobicContact CD1-CE2 3.7Å; I218-Y224 HydrophobicContact CG1-CD2 4.49Å; I218-Y224 HydrophobicContact CG1-CE2 3.75Å; F220-Y224 VanDerWaalsContact CD2-CB 3.5Å; F220-Y224 HydrophobicContact CD2-CD2 4.23Å; F220-Y224 HydrophobicContact CD2-CG 4.19Å; F220-Y224 HydrophobicContact CE2-CG 4.27Å; F220-Y224 WeakPolarHBondContact O-CA 3.45Å; F220-Y224 PolarHBondContact O-N 3.07Å; P222-Y224 PolarHBondContact O-N 3.38Å; Y224-K227 HydrophobicContact CD1-CD 3.79Å; Y224-K227 HydrophobicContact CE1-CD 3.96Å; Y224-K227 PolarHBondContact O-N 3.36Å; Y224-D228 WeakPolarHBondContact O-CB 3.43Å; Y224-D228 VanDerWaalsContact O-CG 3.29Å; Y224-D228 PolarHBondContact O-N 2.96Å
225	T	98.3	Very high	98.2	Very high	58 Å²	58	68 Å²	68	36%	0.356	37%	0.367	S	S	.	.	H	α-helix	trans	-59.5	-48.5	169.5	-45.8	0	0	0	0	111.7	F220 H221 P222 D228 A229	F220-T225 PolarHBondContact O-N 2.98Å; H221-T225 PolarHBondContact ND1-OG1 3.33Å; H221-T225 VanDerWaalsContact ND1-OG1 3.13Å; P222-T225 PolarHBondContact O-N 3.14Å; T225-D228 PolarHBondContact O-N 3.46Å; T225-A229 WeakPolarHBondContact O-CB 3.4Å; T225-A229 PolarHBondContact O-N 3.32Å
226	I	98.5	Very high	98.4	Very high	118 Å²	118	66.1 Å²	66.1	61%	0.605	35%	0.347	S	S	*	.	H	α-helix	trans	-71.3	-36.7	-179.6	-168.1	61.1	0	0	0	111.9	P222 Y223 A229 L230	P222-I226 WeakPolarHBondContact O-CG2 3.48Å; P222-I226 PolarHBondContact O-N 3.4Å; Y223-I226 VanDerWaalsContact O-CG2 3.29Å; Y223-I226 WeakPolarHBondContact O-CG2 3.29Å; I226-A229 PolarHBondContact O-N 3.23Å; I226-L230 PolarHBondContact O-N 2.84Å
227	K	98.6	Very high	98.4	Very high	49 Å²	49	67.2 Å²	67.2	21%	0.213	35%	0.352	C	S	.	.	H	α-helix	trans	-64.4	-41.3	175.5	-170.5	-168.3	170.8	-158.6	0	111.6	I27 S28 N32 Y223 Y224 L230 G231	I27-K227 PolarHBondContact O-NZ 3Å; S28-K227 PolarHBondContact O-NZ 3.45Å; N32-K227 PolarHBondContact ND2-O 3.02Å; N32-K227 VanDerWaalsContact ND2-O 3.1Å; N32-K227 WeakPolarHBondContact OD1-CE 3.35Å; N32-K227 PolarHBondContact OD1-NZ 2.61Å; Y223-K227 WeakPolarHBondContact O-CB 3.24Å; Y223-K227 PolarHBondContact O-N 2.91Å; Y224-K227 HydrophobicContact CD1-CD 3.79Å; Y224-K227 HydrophobicContact CE1-CD 3.96Å; Y224-K227 PolarHBondContact O-N 3.36Å; K227-L230 PolarHBondContact O-N 2.87Å; K227-G231 PolarHBondContact O-N 3.35Å
228	D	98.6	Very high	98.5	Very high	29 Å²	29	66.4 Å²	66.4	16%	0.155	36%	0.355	C	S	.	.	H	α-helix	trans	-69.6	-37	176.8	-78.7	10	0	0	0	111.6	N32 S35 Y224 T225 L230 G231 L232	N32-D228 PolarHBondContact ND2-OD1 3.44Å; S35-D228 WeakPolarHBondContact CB-OD2 3.48Å; S35-D228 PolarHBondContact OG-OD2 3.17Å; Y224-D228 WeakPolarHBondContact O-CB 3.43Å; Y224-D228 VanDerWaalsContact O-CG 3.29Å; Y224-D228 PolarHBondContact O-N 2.96Å; T225-D228 PolarHBondContact O-N 3.46Å; D228-L230 VanDerWaalsContact C-N 3.32Å; D228-L230 PolarHBondContact O-N 3.33Å; D228-G231 PolarHBondContact O-N 2.97Å; D228-L232 WeakPolarHBondContact O-CB 3.44Å; D228-L232 PolarHBondContact O-N 3.1Å
229	A	98.7	Very high	98.5	Very high	52 Å²	52	64.6 Å²	64.6	43%	0.43	35%	0.346	S	S	.	.	H	α-helix	trans	-60.6	-40.3	172.3	0	0	0	0	0	112.2	T225 I226 L232 L233	T225-A229 WeakPolarHBondContact O-CB 3.4Å; T225-A229 PolarHBondContact O-N 3.32Å; I226-A229 PolarHBondContact O-N 3.23Å; A229-L232 PolarHBondContact O-N 2.99Å; A229-L233 PolarHBondContact O-N 3.12Å
230	L	98.7	Very high	98.5	Very high	102 Å²	102	64.5 Å²	64.5	53%	0.534	34%	0.342	S	S	.	.	H	α-helix	trans	-63.4	-45.5	172.7	176.1	62.2	0	0	0	111.7	I226 K227 D228 L232 L233 L234	I226-L230 PolarHBondContact O-N 2.84Å; K227-L230 PolarHBondContact O-N 2.87Å; D228-L230 VanDerWaalsContact C-N 3.32Å; D228-L230 PolarHBondContact O-N 3.33Å; L230-L232 VanDerWaalsContact C-N 3.31Å; L230-L232 PolarHBondContact O-N 2.91Å; L230-L233 WeakPolarHBondContact O-CB 3.31Å; L230-L233 PolarHBondContact O-N 3.21Å; L230-L234 WeakPolarHBondContact O-CG 3.29Å; L230-L234 PolarHBondContact O-N 3.09Å; L230-L234 VanDerWaalsContact O-N 3.09Å
231	G	98.7	Very high	98.6	Very high	13 Å²	13	66.3 Å²	66.3	13%	0.134	36%	0.355	C	S	.	.	H	α-helix	trans	-57.6	-44.2	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 2.97Å; G231-L234 PolarHBondContact O-N 2.97Å; G231-F235 WeakPolarHBondContact O-CB 3.29Å; G231-F235 PolarHBondContact O-N 3.03Å
232	L	98.8	Very high	98.6	Very high	68 Å²	68	63 Å²	63	36%	0.356	34%	0.341	S	S	.	.	H	α-helix	trans	-64	-39.9	177	-178.2	62	0	0	0	112.1	A39 D228 A229 L230 F235 I236	A39-L232 HydrophobicContact CB-CD1 3.7Å; D228-L232 WeakPolarHBondContact O-CB 3.44Å; D228-L232 PolarHBondContact O-N 3.1Å; A229-L232 PolarHBondContact O-N 2.99Å; L230-L232 VanDerWaalsContact C-N 3.31Å; L230-L232 PolarHBondContact O-N 2.91Å; L232-F235 HydrophobicContact CD1-CD1 4.19Å; L232-F235 WeakPolarHBondContact O-CB 3.46Å; L232-F235 PolarHBondContact O-N 3.37Å; L232-I236 HydrophobicContact CD1-CD1 4.14Å; L232-I236 HydrophobicContact CD1-CG1 4.24Å; L232-I236 HydrophobicContact CG-CD1 3.94Å; L232-I236 HydrophobicContact CG-CG1 4.44Å; L232-I236 VanDerWaalsContact O-CG1 3.31Å; L232-I236 WeakPolarHBondContact O-CG1 3.38Å; L232-I236 PolarHBondContact O-N 3.49Å
233	L	98.8	Very high	98.6	Very high	111 Å²	111	59.8 Å²	59.8	58%	0.581	32%	0.32	S	S	*	.	H	α-helix	trans	-60.3	-46.1	175.8	178.9	65	0	0	0	111.5	A229 L230 I236 L237	A229-L233 PolarHBondContact O-N 3.12Å; L230-L233 WeakPolarHBondContact O-CB 3.31Å; L230-L233 PolarHBondContact O-N 3.21Å; L233-I236 PolarHBondContact O-N 2.83Å; L233-L237 WeakPolarHBondContact O-CB 3.48Å; L233-L237 PolarHBondContact O-N 3.24Å
234	L	98.7	Very high	98.6	Very high	103 Å²	103	57.3 Å²	57.3	54%	0.539	32%	0.315	S	S	.	.	H	α-helix	trans	-65.1	-40	177.1	-65.8	176.5	0	0	0	111.8	L230 G231 L237 S238	L230-L234 WeakPolarHBondContact O-CG 3.29Å; L230-L234 PolarHBondContact O-N 3.09Å; L230-L234 VanDerWaalsContact O-N 3.09Å; G231-L234 PolarHBondContact O-N 2.97Å; L234-L237 PolarHBondContact O-N 3.1Å; L234-S238 PolarHBondContact O-N 3.46Å; L234-S238 PolarHBondContact O-OG 2.91Å
235	F	98.6	Very high	98.6	Very high	13 Å²	13	64.6 Å²	64.6	6%	0.057	35%	0.348	C	S	.	.	H	α-helix	trans	-58.2	-52.6	173.2	170.3	-89.9	0	0	0	111.4	L36 C40 M89 G231 L232 L237 S238 L239	L36-F235 HydrophobicContact CD2-CB 3.66Å; L36-F235 HydrophobicContact CD2-CD2 4.4Å; L36-F235 HydrophobicContact CD2-CG 4.07Å; C40-F235 WeakPolarHBondContact SG-CE2 3.43Å; C40-F235 WeakPolarHBondContact SG-CZ 3.4Å; M89-F235 HydrophobicContact CB-CE2 3.7Å; M89-F235 HydrophobicContact CB-CZ 4.09Å; M89-F235 HydrophobicContact CE-CD2 3.94Å; M89-F235 HydrophobicContact CE-CE2 4.02Å; M89-F235 HydrophobicContact CG-CE2 4.41Å; G231-F235 WeakPolarHBondContact O-CB 3.29Å; G231-F235 PolarHBondContact O-N 3.03Å; L232-F235 HydrophobicContact CD1-CD1 4.19Å; L232-F235 WeakPolarHBondContact O-CB 3.46Å; L232-F235 PolarHBondContact O-N 3.37Å; F235-L237 VanDerWaalsContact C-N 3.31Å; F235-L237 PolarHBondContact O-N 3.18Å; F235-S238 PolarHBondContact O-N 3.45Å; F235-S238 PolarHBondContact O-OG 3.28Å; F235-L239 HydrophobicContact CE1-CD2 4.06Å; F235-L239 HydrophobicContact CZ-CD2 4.31Å; F235-L239 WeakPolarHBondContact O-CB 3.19Å; F235-L239 PolarHBondContact O-N 3.5Å
236	I	98.8	Very high	98.6	Very high	81 Å²	81	64.6 Å²	64.6	42%	0.415	35%	0.35	S	S	.	.	H	α-helix	trans	-60.3	-43.7	179.2	-68.2	169.1	0	0	0	110	L232 L233 S238 L239 M240	L232-I236 HydrophobicContact CD1-CD1 4.14Å; L232-I236 HydrophobicContact CD1-CG1 4.24Å; L232-I236 HydrophobicContact CG-CD1 3.94Å; L232-I236 HydrophobicContact CG-CG1 4.44Å; L232-I236 VanDerWaalsContact O-CG1 3.31Å; L232-I236 WeakPolarHBondContact O-CG1 3.38Å; L232-I236 PolarHBondContact O-N 3.49Å; L233-I236 PolarHBondContact O-N 2.83Å; I236-S238 VanDerWaalsContact C-N 3.33Å; I236-S238 PolarHBondContact O-N 3.32Å; I236-L239 PolarHBondContact O-N 3.45Å; I236-M240 HydrophobicContact CG2-CG 3.85Å; I236-M240 VanDerWaalsContact O-CB 3.27Å; I236-M240 WeakPolarHBondContact O-CB 3.48Å; I236-M240 WeakPolarHBondContact O-CG 3.19Å; I236-M240 PolarHBondContact O-N 3.09Å
237	L	98.8	Very high	98.6	Very high	108 Å²	108	60.6 Å²	60.6	57%	0.565	33%	0.332	S	S	*	.	H	α-helix	trans	-57.4	-46.8	177	-180	64.5	0	0	0	111.6	L233 L234 F235 T241	L233-L237 WeakPolarHBondContact O-CB 3.48Å; L233-L237 PolarHBondContact O-N 3.24Å; L234-L237 PolarHBondContact O-N 3.1Å; F235-L237 VanDerWaalsContact C-N 3.31Å; F235-L237 PolarHBondContact O-N 3.18Å; L237-T241 WeakPolarHBondContact O-CB 3.49Å; L237-T241 PolarHBondContact O-N 3.41Å; L237-T241 PolarHBondContact O-OG1 3.45Å
238	S	98.6	Very high	98.6	Very high	51 Å²	51	61.8 Å²	61.8	36%	0.357	34%	0.341	S	S	.	.	H	α-helix	trans	-64.6	-46	178.5	66.7	0	0	0	0	112.6	M89 L234 F235 I236 T241 L242	M89-S238 WeakPolarHBondContact CE-OG 3.39Å; L234-S238 PolarHBondContact O-N 3.46Å; L234-S238 PolarHBondContact O-OG 2.91Å; F235-S238 PolarHBondContact O-N 3.45Å; F235-S238 PolarHBondContact O-OG 3.28Å; I236-S238 VanDerWaalsContact C-N 3.33Å; I236-S238 PolarHBondContact O-N 3.32Å; S238-T241 PolarHBondContact O-N 2.92Å; S238-L242 PolarHBondContact O-N 2.87Å
239	L	98.8	Very high	98.6	Very high	5 Å²	5	66.4 Å²	66.4	3%	0.026	36%	0.364	C	S	.	.	H	α-helix	trans	-62.7	-44.7	178.3	174.2	63.8	0	0	0	111.6	L43 L82 N85 M89 F235 I236 L242 T243	L43-L239 HydrophobicContact CD2-CD2 3.42Å; L43-L239 VanDerWaalsContact CD2-CD2 3.42Å; L82-L239 HydrophobicContact CD2-CD2 3.9Å; L82-L239 HydrophobicContact CD2-CG 4.03Å; N85-L239 HydrophobicContact CB-CD1 3.89Å; M89-L239 HydrophobicContact CG-CB 4.38Å; M89-L239 HydrophobicContact CG-CD1 3.94Å; F235-L239 HydrophobicContact CE1-CD2 4.06Å; F235-L239 HydrophobicContact CZ-CD2 4.31Å; F235-L239 WeakPolarHBondContact O-CB 3.19Å; F235-L239 PolarHBondContact O-N 3.5Å; I236-L239 PolarHBondContact O-N 3.45Å; L239-L242 PolarHBondContact O-N 3.27Å; L239-T243 WeakPolarHBondContact O-CB 3.4Å; L239-T243 PolarHBondContact O-N 3.21Å; L239-T243 PolarHBondContact O-OG1 2.93Å
240	M	98.6	Very high	98.6	Very high	57 Å²	57	66.5 Å²	66.5	28%	0.281	36%	0.357	S	S	.	.	H	α-helix	trans	-69	-36.5	179.2	-67.9	-57.8	-61.5	0	0	111.3	I78 L82 I236 T243 L244	I78-M240 HydrophobicContact CD1-CE 4.28Å; L82-M240 HydrophobicContact CD2-SD 3.85Å; I236-M240 HydrophobicContact CG2-CG 3.85Å; I236-M240 VanDerWaalsContact O-CB 3.27Å; I236-M240 WeakPolarHBondContact O-CB 3.48Å; I236-M240 WeakPolarHBondContact O-CG 3.19Å; I236-M240 PolarHBondContact O-N 3.09Å; M240-T243 PolarHBondContact O-N 3.28Å; M240-L244 HydrophobicContact CE-CD1 3.71Å; M240-L244 HydrophobicContact CE-CD2 4.22Å; M240-L244 HydrophobicContact CE-CG 3.96Å; M240-L244 VanDerWaalsContact O-CB 3.23Å; M240-L244 WeakPolarHBondContact O-CB 3.34Å; M240-L244 VanDerWaalsContact O-CG 3.25Å; M240-L244 WeakPolarHBondContact O-CG 3.17Å; M240-L244 PolarHBondContact O-N 3.24Å
241	T	98.7	Very high	98.4	Very high	69 Å²	69	63.6 Å²	63.6	42%	0.423	35%	0.352	S	S	.	.	H	α-helix	trans	-61.5	-48.7	174.9	-58	0	0	0	0	110.4	L237 S238 F245	L237-T241 WeakPolarHBondContact O-CB 3.49Å; L237-T241 PolarHBondContact O-N 3.41Å; L237-T241 PolarHBondContact O-OG1 3.45Å; S238-T241 PolarHBondContact O-N 2.92Å; T241-F245 HydrophobicContact CG2-CD2 4.14Å; T241-F245 WeakPolarHBondContact O-CB 3.35Å; T241-F245 WeakPolarHBondContact O-CD2 3.25Å; T241-F245 PolarHBondContact O-N 2.79Å
242	L	98.4	Very high	98.3	Very high	23 Å²	23	64 Å²	64	12%	0.12	35%	0.351	C	S	.	.	H	α-helix	trans	-60.1	-50	175.5	-179.5	62.5	0	0	0	111.2	N85 S238 L239 L244 S246 P247 L249 L250	N85-L242 HydrophobicContact CB-CD2 3.76Å; N85-L242 HydrophobicContact CB-CG 4.18Å; N85-L242 WeakPolarHBondContact OD1-CD2 3.3Å; S238-L242 PolarHBondContact O-N 2.87Å; L239-L242 PolarHBondContact O-N 3.27Å; L242-L244 PolarHBondContact O-N 3.49Å; L242-S246 WeakPolarHBondContact CD1-O 3.01Å; L242-S246 CarbonylContact O-C 3.35Å; L242-S246 WeakPolarHBondContact O-CA 3.45Å; L242-S246 PolarHBondContact O-N 3.33Å; L242-P247 WeakPolarHBondContact O-CA 3.38Å; L242-L249 HydrophobicContact CD1-CB 3.97Å; L242-L249 HydrophobicContact CD1-CD2 4.06Å; L242-L250 HydrophobicContact CD1-CG 4.4Å; L242-L250 HydrophobicContact CD2-CD1 3.65Å; L242-L250 HydrophobicContact CD2-CG 4.3Å
243	T	98.4	Very high	98.3	Very high	1 Å²	1	65.3 Å²	65.3	1%	0.006	36%	0.364	C	S	.	.	H	α-helix	trans	-66	-37.4	-175.1	-61.4	0	0	0	0	113.5	I78 L82 L239 M240 P247	I78-T243 HydrophobicContact CG1-CG2 4.28Å; L82-T243 HydrophobicContact CD2-CG2 4.19Å; L82-T243 HydrophobicContact CG-CG2 4.18Å; L239-T243 WeakPolarHBondContact O-CB 3.4Å; L239-T243 PolarHBondContact O-N 3.21Å; L239-T243 PolarHBondContact O-OG1 2.93Å; M240-T243 PolarHBondContact O-N 3.28Å; T243-P247 WeakPolarHBondContact O-CB 3.47Å
244	L	98.6	Very high	98.2	Very high	83 Å²	83	62.7 Å²	62.7	44%	0.435	35%	0.35	S	S	.	.	H	α-helix	trans	-90.4	-33	-175.1	-63.4	177.9	0	0	0	113.2	W77 I78 M240 L242	W77-L244 HydrophobicContact CH2-CD2 3.94Å; W77-L244 HydrophobicContact CZ3-CD2 4.28Å; I78-L244 HydrophobicContact CD1-CD2 4.02Å; M240-L244 HydrophobicContact CE-CD1 3.71Å; M240-L244 HydrophobicContact CE-CD2 4.22Å; M240-L244 HydrophobicContact CE-CG 3.96Å; M240-L244 VanDerWaalsContact O-CB 3.23Å; M240-L244 WeakPolarHBondContact O-CB 3.34Å; M240-L244 VanDerWaalsContact O-CG 3.25Å; M240-L244 WeakPolarHBondContact O-CG 3.17Å; M240-L244 PolarHBondContact O-N 3.24Å; L242-L244 PolarHBondContact O-N 3.49Å
245	F	98.6	Very high	98.1	Very high	163 Å²	163	58.7 Å²	58.7	72%	0.715	33%	0.33	S	S	*	.	H	α-helix	trans	-107.9	-25.5	-173.9	-63.6	-76.6	0	0	0	114	T241	T241-F245 HydrophobicContact CG2-CD2 4.14Å; T241-F245 WeakPolarHBondContact O-CB 3.35Å; T241-F245 WeakPolarHBondContact O-CD2 3.25Å; T241-F245 PolarHBondContact O-N 2.79Å
246	S	98.4	Very high	98.1	Very high	57 Å²	57	63 Å²	63	40%	0.399	35%	0.346	S	S	.	.			trans	-147.1	54.4	-177.3	-54.2	0	0	0	0	112.2	L242 D248 L249	L242-S246 WeakPolarHBondContact CD1-O 3.01Å; L242-S246 CarbonylContact O-C 3.35Å; L242-S246 WeakPolarHBondContact O-CA 3.45Å; L242-S246 PolarHBondContact O-N 3.33Å; S246-D248 PolarHBondContact O-N 3.42Å; S246-L249 VanDerWaalsContact O-CB 3.3Å; S246-L249 WeakPolarHBondContact O-CB 2.93Å; S246-L249 PolarHBondContact O-N 2.94Å; S246-L249 VanDerWaalsContact O-N 3.07Å
247	P	98.2	Very high	98	Very high	34 Å²	34	62.9 Å²	62.9	22%	0.221	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-25.7	-168	21.1	-33	0	0	0	114.7	Y81 N85 L242 T243	Y81-P247 HydrophobicContact CD1-CB 3.55Å; Y81-P247 HydrophobicContact CD2-CB 4.05Å; Y81-P247 HydrophobicContact CE1-CB 3.77Å; Y81-P247 HydrophobicContact CE2-CB 4.25Å; Y81-P247 HydrophobicContact CG-CB 3.71Å; N85-P247 PolarHBondContact ND2-O 3.48Å; N85-P247 PolarHBondContact OD1-O 2.8Å; L242-P247 WeakPolarHBondContact O-CA 3.38Å; T243-P247 WeakPolarHBondContact O-CB 3.47Å
248	D	98.3	Very high	98	Very high	75 Å²	75	62.1 Å²	62.1	40%	0.401	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	1.9	-177	-63.1	-53.5	0	0	0	113.7	S246 L250 G251 Y256	S246-D248 PolarHBondContact O-N 3.42Å; D248-L250 PolarHBondContact O-N 2.82Å; D248-L250 VanDerWaalsContact O-N 3.12Å; D248-G251 PolarHBondContact O-N 3.21Å; D248-G251 VanDerWaalsContact O-N 3.14Å; D248-Y256 WeakPolarHBondContact OD1-CE2 3.34Å; D248-Y256 PolarHBondContact OD1-OH 3.4Å
249	L	98.5	Very high	97.9	Very high	125 Å²	125	60.4 Å²	60.4	65%	0.654	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-33.8	-173.1	178.5	64.1	0	0	0	113.6	L242 S246	L242-L249 HydrophobicContact CD1-CB 3.97Å; L242-L249 HydrophobicContact CD1-CD2 4.06Å; S246-L249 VanDerWaalsContact O-CB 3.3Å; S246-L249 WeakPolarHBondContact O-CB 2.93Å; S246-L249 PolarHBondContact O-N 2.94Å; S246-L249 VanDerWaalsContact O-N 3.07Å
250	L	98	Very high	97.8	Very high	54 Å²	54	63.3 Å²	63.3	28%	0.283	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-5.2	-175.9	-58.4	-177.1	0	0	0	113.7	S88 L242 D248	S88-L250 VanDerWaalsContact CB-CD1 3.49Å; L242-L250 HydrophobicContact CD1-CG 4.4Å; L242-L250 HydrophobicContact CD2-CD1 3.65Å; L242-L250 HydrophobicContact CD2-CG 4.3Å; D248-L250 PolarHBondContact O-N 2.82Å; D248-L250 VanDerWaalsContact O-N 3.12Å
251	G	95.8	Very high	97.7	Very high	42 Å²	42	64.4 Å²	64.4	43%	0.433	36%	0.361	S	S	.	.	S	Bend	trans	-97.5	172.8	-179.1	0	0	0	0	0	113	D248	D248-G251 PolarHBondContact O-N 3.21Å; D248-G251 VanDerWaalsContact O-N 3.14Å
252	D	97.1	Very high	97.6	Very high	21 Å²	21	69 Å²	69	11%	0.112	38%	0.382	C	S	.	.			trans	-103.7	129.4	175.6	-161.6	-71.6	0	0	0	111.5	M138 D254 N255 K269	M138-D252 HydrophobicContact CG-CB 4.1Å; D252-D254 PolarHBondContact O-N 3.31Å; D252-D254 WeakPolarHBondContact OD1-CB 3.19Å; D252-D254 PolarHBondContact OD1-N 3.46Å; D252-N255 WeakPolarHBondContact O-CB 3.13Å; D252-N255 PolarHBondContact O-N 2.96Å; D252-N255 VanDerWaalsContact O-N 3.1Å; D252-K269 WeakPolarHBondContact OD2-CE 3.25Å; D252-K269 IonicContact OD2-NZ 3.58Å; D252-K269 PolarHBondContact OD2-NZ 2.79Å
253	P	97.1	Very high	97.5	Very high	95 Å²	95	72.2 Å²	72.2	62%	0.617	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-62.1	-27	-177.8	25.7	-35.8	0	0	0	113.6	N255 Y256	P253-N255 PolarHBondContact O-N 2.75Å; P253-N255 VanDerWaalsContact O-N 3.14Å; P253-Y256 WeakPolarHBondContact O-CB 3.32Å; P253-Y256 PolarHBondContact O-N 3.32Å
254	D	96.9	Very high	97.2	Very high	56 Å²	56	75.7 Å²	75.7	30%	0.299	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-63.3	-22.8	178.7	-78.1	-8.7	0	0	0	111.4	Q137 M138 D252 Y256 T257	Q137-D254 HydrophobicContact CB-CB 4.39Å; Q137-D254 WeakPolarHBondContact CB-O 3.39Å; M138-D254 HydrophobicContact CE-CB 3.51Å; M138-D254 WeakPolarHBondContact CE-OD2 3.33Å; M138-D254 HydrophobicContact CG-CB 3.81Å; D252-D254 PolarHBondContact O-N 3.31Å; D252-D254 WeakPolarHBondContact OD1-CB 3.19Å; D252-D254 PolarHBondContact OD1-N 3.46Å; D254-Y256 PolarHBondContact O-N 2.78Å; D254-T257 WeakPolarHBondContact O-CB 3.4Å; D254-T257 PolarHBondContact O-N 3.21Å
255	N	97.5	Very high	97	Very high	20 Å²	20	72.1 Å²	72.1	11%	0.107	40%	0.403	C	S	.	.	G	3₁₀ helix	trans	-73.6	-5.4	176.7	-139.8	32.1	0	0	0	114.3	G136 M138 S139 D252 P253 T257	G136-N255 VanDerWaalsContact C-OD1 3.29Å; G136-N255 VanDerWaalsContact CA-OD1 3.24Å; G136-N255 WeakPolarHBondContact CA-OD1 3.5Å; M138-N255 HydrophobicContact CB-CB 4.17Å; M138-N255 PolarHBondContact N-OD1 3.48Å; S139-N255 PolarHBondContact N-OD1 2.72Å; S139-N255 PolarHBondContact OG-ND2 3.33Å; S139-N255 PolarHBondContact OG-OD1 3.3Å; D252-N255 WeakPolarHBondContact O-CB 3.13Å; D252-N255 PolarHBondContact O-N 2.96Å; D252-N255 VanDerWaalsContact O-N 3.1Å; P253-N255 PolarHBondContact O-N 2.75Å; P253-N255 VanDerWaalsContact O-N 3.14Å; N255-T257 VanDerWaalsContact C-N 3.32Å
256	Y	97.7	Very high	96.6	Very high	102 Å²	102	70.8 Å²	70.8	40%	0.4	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-88.1	2.6	167.2	-74.5	-71.1	0	0	0	113.6	F63 R80 Y81 D248 P253 D254	F63-Y256 WeakPolarHBondContact CZ-O 3.15Å; R80-Y256 PolarHBondContact NH1-OH 3.31Å; R80-Y256 VanDerWaalsContact NH1-OH 3.13Å; Y81-Y256 PolarHBondContact OH-OH 2.72Å; D248-Y256 WeakPolarHBondContact OD1-CE2 3.34Å; D248-Y256 PolarHBondContact OD1-OH 3.4Å; P253-Y256 WeakPolarHBondContact O-CB 3.32Å; P253-Y256 PolarHBondContact O-N 3.32Å; D254-Y256 PolarHBondContact O-N 2.78Å
257	T	97.9	Very high	96.3	Very high	79 Å²	79	70.3 Å²	70.3	49%	0.485	40%	0.402	S	S	.	.	S	Bend	trans	-104.7	133.2	169.9	-56	0	0	0	0	109.3	G136 Q137 D254 N255 A259	G136-T257 CarbonylContact C-O 3.48Å; G136-T257 WeakPolarHBondContact CA-O 3.5Å; Q137-T257 HydrophobicContact CG-CG2 4.03Å; Q137-T257 PolarHBondContact N-O 2.92Å; D254-T257 WeakPolarHBondContact O-CB 3.4Å; D254-T257 PolarHBondContact O-N 3.21Å; N255-T257 VanDerWaalsContact C-N 3.32Å; T257-A259 PolarHBondContact O-N 3.35Å
258	L	97.6	Very high	96.1	Very high	92 Å²	92	70.2 Å²	70.2	48%	0.482	40%	0.399	S	S	.	.	B	Isolated β-bridge	trans	-54.6	137.9	176.1	175.5	64.6	0	0	0	110.7	F63 N260	F63-L258 HydrophobicContact CB-CD1 3.45Å; F63-L258 VanDerWaalsContact CB-CD1 3.45Å; F63-L258 HydrophobicContact CD1-CB 4.2Å; F63-L258 HydrophobicContact CD1-CD1 4.14Å; F63-L258 HydrophobicContact CD2-CB 4.46Å; F63-L258 HydrophobicContact CD2-CD1 4.22Å; F63-L258 HydrophobicContact CE1-CB 4.34Å; F63-L258 HydrophobicContact CG-CB 4.28Å; F63-L258 HydrophobicContact CG-CD1 3.69Å; L258-N260 PolarHBondContact O-N 2.81Å
259	A	97.2	Very high	96	Very high	15 Å²	15	69.4 Å²	69.4	12%	0.124	39%	0.392	C	S	.	.			trans	-53.1	128.5	176	0	0	0	0	0	112.2	W135 F140 T257	W135-A259 HydrophobicContact CG-CB 4.41Å; W135-A259 WeakPolarHBondContact O-CB 3.48Å; W135-A259 PolarHBondContact O-N 3.07Å; W135-A259 VanDerWaalsContact O-N 3.11Å; F140-A259 HydrophobicContact CB-CB 3.52Å; F140-A259 HydrophobicContact CD2-CB 4.27Å; F140-A259 HydrophobicContact CG-CB 3.93Å; T257-A259 PolarHBondContact O-N 3.35Å
260	N	97.1	Very high	95.9	Very high	67 Å²	67	64.6 Å²	64.6	36%	0.358	37%	0.368	S	S	.	.			trans	-126	108.2	173.1	-177.6	-11.5	0	0	0	109.3	W141 L258 L262 N263	W141-N260 PolarHBondContact NE1-O 2.74Å; L258-N260 PolarHBondContact O-N 2.81Å; N260-L262 PolarHBondContact O-N 2.76Å; N260-L262 WeakPolarHBondContact OD1-CB 3.46Å; N260-L262 PolarHBondContact OD1-N 3.04Å; N260-N263 HydrophobicContact CB-CB 4.16Å; N260-N263 PolarHBondContact O-N 2.81Å; N260-N263 VanDerWaalsContact O-N 3.09Å
261	P	95.7	Very high	95.9	Very high	79 Å²	79	63 Å²	63	51%	0.513	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-16.2	178.9	-24.3	34.1	0	0	0	114.8	F140 W141	F140-P261 HydrophobicContact CE1-CB 4.11Å; F140-P261 HydrophobicContact CE1-CG 4.27Å; F140-P261 HydrophobicContact CE2-CG 4.22Å; F140-P261 HydrophobicContact CZ-CB 3.86Å; F140-P261 HydrophobicContact CZ-CG 3.79Å; W141-P261 WeakPolarHBondContact CH2-O 3.46Å; W141-P261 WeakPolarHBondContact CZ2-O 3.43Å
262	L	96.4	Very high	96	Very high	165 Å²	165	63.9 Å²	63.9	86%	0.864	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.6	-5.4	-179.2	-55.4	179.4	0	0	0	113.5	N260	N260-L262 PolarHBondContact O-N 2.76Å; N260-L262 WeakPolarHBondContact OD1-CB 3.46Å; N260-L262 PolarHBondContact OD1-N 3.04Å
263	N	96	Very high	96.1	Very high	92 Å²	92	63.3 Å²	63.3	49%	0.492	35%	0.346	S	S	.	.			trans	-128.7	100.7	-179.4	-174.7	16.1	0	0	0	111	Q137 W141 N260	Q137-N263 PolarHBondContact NE2-O 3.17Å; W141-N263 PolarHBondContact NE1-O 2.92Å; N260-N263 HydrophobicContact CB-CB 4.16Å; N260-N263 PolarHBondContact O-N 2.81Å; N260-N263 VanDerWaalsContact O-N 3.09Å
264	T	93.8	Very high	96.1	Very high	73 Å²	73	60.2 Å²	60.2	45%	0.448	32%	0.323	S	S	.	.			trans	-77.9	127.7	178	-55.8	0	0	0	0	111.3	W141 I268	W141-T264 HydrophobicContact CD2-CG2 4.42Å; W141-T264 HydrophobicContact CE3-CG2 4.45Å; W141-T264 WeakPolarHBondContact CH2-OG1 3.47Å; W141-T264 VanDerWaalsContact CZ2-OG1 3.3Å; W141-T264 WeakPolarHBondContact CZ2-OG1 3.25Å; T264-I268 HydrophobicContact CG2-CD1 3.5Å; T264-I268 HydrophobicContact CG2-CG1 4.2Å
265	P	93.8	Very high	96.2	Very high	9 Å²	9	58.3 Å²	58.3	6%	0.058	31%	0.313	C	S	.	.			trans	-56.7	149.7	172.2	-28.5	36	0	0	0	112.7	Q137 M138 W141 H267 I268	Q137-P265 HydrophobicContact CB-CG 3.87Å; M138-P265 HydrophobicContact CE-CB 3.45Å; M138-P265 VanDerWaalsContact CE-CB 3.45Å; M138-P265 HydrophobicContact CE-CG 3.94Å; W141-P265 HydrophobicContact CG-CG 4.38Å; P265-H267 VanDerWaalsContact C-N 3.25Å; P265-H267 PolarHBondContact O-N 2.85Å; P265-I268 HydrophobicContact CB-CG1 4.39Å
266	P	90.6	Very high	96.3	Very high	135 Å²	135	58.5 Å²	58.5	88%	0.877	31%	0.313	S	S	*	.	S	Bend	trans	-57	-35.1	-179.3	-25.7	33.6	0	0	0	114.3
267	H	92.4	Very high	96.3	Very high	47 Å²	47	53.8 Å²	53.8	22%	0.218	30%	0.295	C	S	.	.	S	Bend	trans	-141.9	89.9	-179.3	-173.2	-118.2	0	0	0	111.7	P265 K269 G340 Q341	P265-H267 VanDerWaalsContact C-N 3.25Å; P265-H267 PolarHBondContact O-N 2.85Å; H267-K269 PolarHBondContact O-N 3.38Å; H267-G340 PolarHBondContact CE1-O 2.85Å; H267-G340 VanDerWaalsContact CE1-O 3.3Å; H267-Q341 PolarHBondContact NE2-O 2.82Å; H267-Q341 VanDerWaalsContact NE2-O 3.16Å
268	I	93.8	Very high	96.4	Very high	31 Å²	31	51.4 Å²	51.4	16%	0.159	28%	0.277	C	S	.	.			trans	-71.1	121.6	174.4	-56.6	161.9	0	0	0	109.5	W141 V145 T264 P265 Y278	W141-I268 HydrophobicContact CB-CD1 3.76Å; W141-I268 HydrophobicContact CB-CG1 3.88Å; W141-I268 HydrophobicContact CB-CG2 4.11Å; W141-I268 HydrophobicContact CD2-CD1 4.3Å; W141-I268 HydrophobicContact CE3-CD1 4.18Å; W141-I268 HydrophobicContact CG-CD1 4.16Å; W141-I268 HydrophobicContact CG-CG1 4.48Å; V145-I268 HydrophobicContact CG2-CD1 4.18Å; V145-I268 HydrophobicContact CG2-CG2 4.3Å; T264-I268 HydrophobicContact CG2-CD1 3.5Å; T264-I268 HydrophobicContact CG2-CG1 4.2Å; P265-I268 HydrophobicContact CB-CG1 4.39Å; I268-Y278 PolarHBondContact O-OH 3.02Å
269	K	94.6	Very high	96.4	Very high	59 Å²	59	47.2 Å²	47.2	26%	0.257	26%	0.255	S	S	.	.			trans	-143.1	153	176.2	59.6	-178.7	174.6	-178.9	0	109.8	D252 H267 L275 Y278	D252-K269 WeakPolarHBondContact OD2-CE 3.25Å; D252-K269 IonicContact OD2-NZ 3.58Å; D252-K269 PolarHBondContact OD2-NZ 2.79Å; H267-K269 PolarHBondContact O-N 3.38Å; K269-L275 HydrophobicContact CB-CD2 4.16Å; K269-Y278 HydrophobicContact CB-CE1 4.37Å
270	P	96.6	Very high	96.5	Very high	23 Å²	23	46.5 Å²	46.5	15%	0.149	25%	0.25	C	C	.	.			trans	-77.9	174.3	171.2	36	-36.8	0	0	0	111	F274 L275 Y278	P270-F274 HydrophobicContact CB-CB 3.8Å; P270-F274 HydrophobicContact CB-CD2 4.16Å; P270-F274 HydrophobicContact CB-CG 4.42Å; P270-F274 HydrophobicContact CG-CB 3.73Å; P270-L275 HydrophobicContact CG-CD2 4.11Å; P270-L275 WeakPolarHBondContact O-CD2 3.47Å; P270-Y278 HydrophobicContact CG-CD2 4.45Å; P270-Y278 HydrophobicContact CG-CG 4.08Å
271	E	97.6	Very high	96.5	Very high	22 Å²	22	44.2 Å²	44.2	10%	0.103	24%	0.237	C	C	.	.			trans	-57.8	156.3	172	-68.4	-69.5	103.2	0	0	112.7	Y131 Y273 F274	Y131-E271 HydrophobicContact CD1-CG 4.14Å; Y131-E271 HydrophobicContact CD2-CG 3.45Å; Y131-E271 VanDerWaalsContact CD2-CG 3.45Å; Y131-E271 HydrophobicContact CE1-CG 4.09Å; Y131-E271 HydrophobicContact CE2-CG 3.38Å; Y131-E271 WeakPolarHBondContact CE2-OE1 3.23Å; Y131-E271 HydrophobicContact CG-CG 3.82Å; Y131-E271 VanDerWaalsContact CZ-CD 3.48Å; Y131-E271 PolarHBondContact OH-OE1 3.31Å; E271-Y273 HydrophobicContact CB-CD1 4.19Å; E271-Y273 HydrophobicContact CB-CE1 3.57Å; E271-Y273 HydrophobicContact CB-CE2 4.07Å; E271-Y273 VanDerWaalsContact CB-CZ 3.49Å; E271-Y273 HydrophobicContact CG-CE1 4.29Å; E271-Y273 PolarHBondContact O-N 3.02Å; E271-F274 PolarHBondContact O-N 3.19Å
272	W	98.6	Very high	96.6	Very high	59 Å²	59	43.3 Å²	43.3	22%	0.223	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-53.4	-37	-166.9	71.7	-93.8	0	0	0	114.2	S88 F91 I92 F95 F274 L275	S88-W272 PolarHBondContact OG-NE1 3.12Å; F91-W272 HydrophobicContact CB-CH2 4.12Å; F91-W272 HydrophobicContact CB-CZ2 4.14Å; I92-W272 HydrophobicContact CD1-CH2 4.5Å; 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 4.19Å; F95-W272 HydrophobicContact CD2-CZ3 4.15Å; F95-W272 HydrophobicContact CE2-CH2 4.02Å; F95-W272 AromaticContact CE2-CZ3 3.83Å; F95-W272 HydrophobicContact CE2-CZ3 3.83Å; W272-F274 PolarHBondContact O-N 3.29Å; W272-L275 HydrophobicContact CB-CD1 4.28Å; W272-L275 WeakPolarHBondContact O-CB 3.34Å; W272-L275 PolarHBondContact O-N 2.96Å; W272-L275 VanDerWaalsContact O-N 3.11Å
273	Y	98.5	Very high	96.7	Very high	9 Å²	9	36.1 Å²	36.1	4%	0.035	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-70.8	-7.7	-178.8	46.2	-96.4	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 3.79Å; F91-Y273 HydrophobicContact CD2-CD1 3.79Å; F91-Y273 AromaticContact CD2-CD2 3.53Å; F91-Y273 HydrophobicContact CD2-CD2 3.53Å; F91-Y273 HydrophobicContact CD2-CE1 4.1Å; F91-Y273 AromaticContact CD2-CE2 3.79Å; F91-Y273 HydrophobicContact CD2-CE2 3.79Å; F91-Y273 AromaticContact CD2-CG 3.52Å; F91-Y273 HydrophobicContact CD2-CG 3.52Å; F91-Y273 AromaticContact CE1-CD2 3.92Å; F91-Y273 HydrophobicContact CE1-CD2 3.92Å; F91-Y273 HydrophobicContact CE1-CG 4.43Å; F91-Y273 HydrophobicContact CE2-CD1 4.44Å; F91-Y273 AromaticContact CE2-CD2 3.48Å; F91-Y273 HydrophobicContact CE2-CD2 3.48Å; F91-Y273 VanDerWaalsContact CE2-CD2 3.48Å; F91-Y273 HydrophobicContact CE2-CE1 4.47Å; F91-Y273 AromaticContact CE2-CE2 3.45Å; F91-Y273 HydrophobicContact CE2-CE2 3.45Å; F91-Y273 VanDerWaalsContact CE2-CE2 3.45Å; F91-Y273 AromaticContact CE2-CG 4Å; F91-Y273 HydrophobicContact CE2-CG 4Å; F91-Y273 HydrophobicContact CG-CD1 4.08Å; 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 3.54Å; F91-Y273 HydrophobicContact CG-CG 3.54Å; F91-Y273 AromaticContact CZ-CD2 3.68Å; F91-Y273 HydrophobicContact CZ-CD2 3.68Å; F91-Y273 AromaticContact CZ-CE2 3.89Å; F91-Y273 HydrophobicContact CZ-CE2 3.89Å; F91-Y273 HydrophobicContact CZ-CG 4.43Å; F95-Y273 WeakPolarHBondContact CZ-O 2.88Å; A127-Y273 HydrophobicContact CB-CE2 3.98Å; E271-Y273 HydrophobicContact CB-CD1 4.19Å; E271-Y273 HydrophobicContact CB-CE1 3.57Å; E271-Y273 HydrophobicContact CB-CE2 4.07Å; E271-Y273 VanDerWaalsContact CB-CZ 3.49Å; E271-Y273 HydrophobicContact CG-CE1 4.29Å; E271-Y273 PolarHBondContact O-N 3.02Å; Y273-F276 WeakPolarHBondContact O-CE1 3.16Å
274	F	98.6	Very high	96.8	Very high	31 Å²	31	34.2 Å²	34.2	14%	0.136	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-104.3	-9.4	171.4	-66.4	-57.6	0	0	0	113.9	M124 F128 P270 E271 W272 F276 A277 Y278	M124-F274 HydrophobicContact CB-CE1 3.81Å; M124-F274 HydrophobicContact CB-CZ 4.23Å; M124-F274 HydrophobicContact CE-CD1 3.62Å; M124-F274 HydrophobicContact CE-CE1 3.48Å; M124-F274 VanDerWaalsContact CE-CE1 3.48Å; M124-F274 HydrophobicContact CG-CE1 3.82Å; M124-F274 WeakPolarHBondContact O-CZ 3.14Å; F128-F274 HydrophobicContact CB-CE2 4.27Å; F128-F274 HydrophobicContact CB-CZ 4.19Å; P270-F274 HydrophobicContact CB-CB 3.8Å; P270-F274 HydrophobicContact CB-CD2 4.16Å; P270-F274 HydrophobicContact CB-CG 4.42Å; P270-F274 HydrophobicContact CG-CB 3.73Å; E271-F274 PolarHBondContact O-N 3.19Å; W272-F274 PolarHBondContact O-N 3.29Å; F274-F276 VanDerWaalsContact C-N 3.3Å; F274-F276 PolarHBondContact O-N 3.45Å; F274-A277 PolarHBondContact O-N 3.08Å; F274-Y278 WeakPolarHBondContact O-CB 3.02Å; F274-Y278 PolarHBondContact O-N 3.47Å
275	L	98.7	Very high	96.9	Very high	16 Å²	16	36.8 Å²	36.8	8%	0.084	20%	0.197	C	C	.	.	H	α-helix	trans	-62.6	-34	-170.3	-68.3	179	0	0	0	113.3	K269 P270 W272 A277 Y278 T279 T336	K269-L275 HydrophobicContact CB-CD2 4.16Å; P270-L275 HydrophobicContact CG-CD2 4.11Å; P270-L275 WeakPolarHBondContact O-CD2 3.47Å; W272-L275 HydrophobicContact CB-CD1 4.28Å; W272-L275 WeakPolarHBondContact O-CB 3.34Å; W272-L275 PolarHBondContact O-N 2.96Å; W272-L275 VanDerWaalsContact O-N 3.11Å; L275-A277 PolarHBondContact O-N 2.85Å; L275-Y278 HydrophobicContact CD2-CD1 4.35Å; L275-Y278 PolarHBondContact O-N 3.48Å; L275-T279 PolarHBondContact O-N 2.96Å; L275-T279 PolarHBondContact O-OG1 3.29Å; L275-T336 HydrophobicContact CB-CG2 4.09Å; L275-T336 WeakPolarHBondContact CB-O 3.4Å; L275-T336 HydrophobicContact CD1-CG2 4.36Å
276	F	98.9	Very high	97.1	Very high	23 Å²	23	41 Å²	41	10%	0.101	22%	0.218	C	C	.	.	H	α-helix	trans	-61	-46.1	178.1	80.3	-83.6	0	0	0	111.9	F95 Y273 F274 T279 I280 L332 L335	F95-F276 HydrophobicContact CE1-CE1 4.42Å; F95-F276 HydrophobicContact CZ-CE1 4.29Å; Y273-F276 WeakPolarHBondContact O-CE1 3.16Å; F274-F276 VanDerWaalsContact C-N 3.3Å; F274-F276 PolarHBondContact O-N 3.45Å; F276-T279 PolarHBondContact O-N 2.82Å; F276-I280 PolarHBondContact O-N 2.77Å; F276-L332 HydrophobicContact CB-CD2 4.22Å; F276-L332 HydrophobicContact CD2-CD2 3.64Å; F276-L332 HydrophobicContact CE2-CD2 4.32Å; F276-L332 HydrophobicContact CG-CD2 4.06Å; F276-L335 HydrophobicContact CB-CB 3.92Å
277	A	98.6	Very high	97.3	Very high	3 Å²	3	39.1 Å²	39.1	3%	0.025	20%	0.196	C	C	.	.	H	α-helix	trans	-71.3	-37.2	178.3	0	0	0	0	0	110.8	F274 L275 T279 I280 L281 L294	F274-A277 PolarHBondContact O-N 3.08Å; L275-A277 PolarHBondContact O-N 2.85Å; A277-T279 VanDerWaalsContact C-N 3.28Å; A277-T279 PolarHBondContact O-N 3.49Å; A277-I280 WeakPolarHBondContact O-CB 3.41Å; A277-I280 PolarHBondContact O-N 3.3Å; A277-I280 VanDerWaalsContact O-N 3.12Å; A277-L281 PolarHBondContact O-N 2.86Å; A277-L294 HydrophobicContact CB-CD1 3.82Å; A277-L294 HydrophobicContact CB-CG 4.45Å; A277-L294 WeakPolarHBondContact O-CD1 3.31Å
278	Y	98.5	Very high	97.5	Very high	30 Å²	30	39.7 Å²	39.7	12%	0.118	20%	0.201	C	C	.	.	H	α-helix	trans	-60.4	-36	174.3	178.7	-115.4	0	0	0	112.6	I268 K269 P270 F274 L275 L281 R282	I268-Y278 PolarHBondContact O-OH 3.02Å; K269-Y278 HydrophobicContact CB-CE1 4.37Å; P270-Y278 HydrophobicContact CG-CD2 4.45Å; P270-Y278 HydrophobicContact CG-CG 4.08Å; F274-Y278 WeakPolarHBondContact O-CB 3.02Å; F274-Y278 PolarHBondContact O-N 3.47Å; L275-Y278 HydrophobicContact CD2-CD1 4.35Å; L275-Y278 PolarHBondContact O-N 3.48Å; Y278-L281 HydrophobicContact CD2-CD2 4.14Å; Y278-L281 WeakPolarHBondContact O-CB 3.3Å; Y278-R282 HydrophobicContact CE2-CG 4.14Å; Y278-R282 VanDerWaalsContact CZ-CD 3.43Å; Y278-R282 WeakPolarHBondContact O-CG 3.43Å; Y278-R282 PolarHBondContact O-N 2.77Å; Y278-R282 WeakPolarHBondContact OH-CD 3.49Å; Y278-R282 PolarHBondContact OH-NH1 3.28Å
279	T	98.7	Very high	97.7	Very high	3 Å²	3	39.3 Å²	39.3	2%	0.018	20%	0.204	C	C	.	.	H	α-helix	trans	-62.9	-48.8	170.4	-64.6	0	0	0	0	111.5	L275 F276 A277 L281 R282 S283 L335 I338 G339	L275-T279 PolarHBondContact O-N 2.96Å; L275-T279 PolarHBondContact O-OG1 3.29Å; F276-T279 PolarHBondContact O-N 2.82Å; A277-T279 VanDerWaalsContact C-N 3.28Å; A277-T279 PolarHBondContact O-N 3.49Å; T279-L281 VanDerWaalsContact C-N 3.29Å; T279-L281 PolarHBondContact O-N 3.34Å; T279-R282 PolarHBondContact O-N 2.93Å; T279-R282 VanDerWaalsContact O-N 3.09Å; T279-S283 PolarHBondContact O-N 2.8Å; T279-S283 PolarHBondContact O-OG 2.91Å; T279-L335 WeakPolarHBondContact CB-O 3.49Å; T279-L335 HydrophobicContact CG2-CD2 3.52Å; T279-L335 PolarHBondContact OG1-O 3.44Å; T279-I338 HydrophobicContact CG2-CB 4.04Å; T279-I338 HydrophobicContact CG2-CG2 3.62Å; T279-G339 WeakPolarHBondContact OG1-CA 3.24Å; T279-G339 PolarHBondContact OG1-N 3.4Å
280	I	98.8	Very high	97.9	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-57.9	-41.9	178.9	-66.8	171.6	0	0	0	111.5	F276 A277 R282 S283 A293 S297 L335 Y358 F359	F276-I280 PolarHBondContact O-N 2.77Å; A277-I280 WeakPolarHBondContact O-CB 3.41Å; A277-I280 PolarHBondContact O-N 3.3Å; A277-I280 VanDerWaalsContact O-N 3.12Å; I280-R282 PolarHBondContact O-N 3.31Å; I280-S283 PolarHBondContact O-N 3.35Å; I280-A293 HydrophobicContact CG2-CB 3.78Å; I280-S297 VanDerWaalsContact CD1-CB 3.42Å; I280-L335 HydrophobicContact CD1-CD1 4.06Å; I280-L335 HydrophobicContact CG1-CD1 4.22Å; I280-L335 HydrophobicContact CG1-CD2 4.13Å; I280-Y358 HydrophobicContact CD1-CD1 3.95Å; I280-Y358 HydrophobicContact CD1-CE1 4.29Å; I280-Y358 HydrophobicContact CD1-CG 4.25Å; I280-F359 HydrophobicContact CG2-CE2 3.85Å; I280-F359 HydrophobicContact CG2-CZ 4.32Å
281	L	98.4	Very high	97.9	Very high	18 Å²	18	35.9 Å²	35.9	9%	0.094	19%	0.188	C	C	.	.	H	α-helix	trans	-54.5	-51.4	173.3	170.7	66.2	0	0	0	111.8	L149 A277 Y278 T279 S283 G290 V291 L294	L149-L281 HydrophobicContact CD1-CD1 4.3Å; L149-L281 HydrophobicContact CD1-CD2 3.69Å; L149-L281 HydrophobicContact CD2-CD1 4.2Å; L149-L281 HydrophobicContact CD2-CD2 4.18Å; A277-L281 PolarHBondContact O-N 2.86Å; Y278-L281 HydrophobicContact CD2-CD2 4.14Å; Y278-L281 WeakPolarHBondContact O-CB 3.3Å; T279-L281 VanDerWaalsContact C-N 3.29Å; T279-L281 PolarHBondContact O-N 3.34Å; L281-S283 VanDerWaalsContact C-N 3.32Å; L281-S283 PolarHBondContact O-N 3.07Å; L281-G290 WeakPolarHBondContact CD1-O 3.17Å; L281-G290 WeakPolarHBondContact O-CA 3.36Å; L281-V291 HydrophobicContact CD1-CG2 4.26Å; L281-L294 HydrophobicContact CB-CB 4.21Å; L281-L294 HydrophobicContact CB-CD1 3.99Å; L281-L294 HydrophobicContact CD2-CD1 4.43Å
282	R	97.3	Very high	97.9	Very high	60 Å²	60	39 Å²	39	23%	0.226	21%	0.205	C	C	.	.	H	α-helix	trans	-74.9	-19.8	-175.5	-67.7	-169.7	-60.8	174.7	12.4	113.6	Y278 T279 I280 V284 I338 G339 Q341	Y278-R282 HydrophobicContact CE2-CG 4.14Å; Y278-R282 VanDerWaalsContact CZ-CD 3.43Å; Y278-R282 WeakPolarHBondContact O-CG 3.43Å; Y278-R282 PolarHBondContact O-N 2.77Å; Y278-R282 WeakPolarHBondContact OH-CD 3.49Å; Y278-R282 PolarHBondContact OH-NH1 3.28Å; T279-R282 PolarHBondContact O-N 2.93Å; T279-R282 VanDerWaalsContact O-N 3.09Å; I280-R282 PolarHBondContact O-N 3.31Å; R282-V284 PolarHBondContact O-N 3.18Å; R282-I338 PolarHBondContact NH2-O 3.06Å; R282-G339 PolarHBondContact NH2-O 3.33Å; R282-Q341 PolarHBondContact NH1-O 2.91Å; R282-Q341 PolarHBondContact NH2-O 3.11Å; R282-Q341 VanDerWaalsContact NH2-O 3.14Å
283	S	98.1	Very high	97.9	Very high	14 Å²	14	36.9 Å²	36.9	10%	0.098	20%	0.2	C	C	.	.	H	α-helix	trans	-66.9	-25.5	178.3	-67.7	0	0	0	0	113.2	T279 I280 L281 G351 Q352 S355	T279-S283 PolarHBondContact O-N 2.8Å; T279-S283 PolarHBondContact O-OG 2.91Å; I280-S283 PolarHBondContact O-N 3.35Å; L281-S283 VanDerWaalsContact C-N 3.32Å; L281-S283 PolarHBondContact O-N 3.07Å; S283-G351 PolarHBondContact OG-O 3.2Å; S283-G351 VanDerWaalsContact OG-O 3.05Å; S283-Q352 WeakPolarHBondContact O-CG 3.27Å; S283-Q352 PolarHBondContact O-NE2 3.39Å; S283-Q352 PolarHBondContact OG-N 3.02Å; S283-S355 WeakPolarHBondContact CB-OG 3.45Å; S283-S355 PolarHBondContact OG-OG 3.24Å
284	V	98	Very high	97.9	Very high	53 Å²	53	38.2 Å²	38.2	32%	0.321	21%	0.208	S	C	.	.	S	Bend	trans	-93.3	117.5	-179.4	-175.4	0	0	0	0	109.9	R282 N286 A293	R282-V284 PolarHBondContact O-N 3.18Å; V284-N286 HydrophobicContact CG1-CB 4.26Å; V284-N286 PolarHBondContact O-N 3.14Å; V284-A293 HydrophobicContact CG2-CB 3.88Å
285	P	96.1	Very high	97.8	Very high	127 Å²	127	40.8 Å²	40.8	83%	0.825	22%	0.222	S	C	*	.	S	Bend	trans	-78.6	44.2	-178.7	34.8	-37.2	0	0	0	112.4
286	N	97.5	Very high	97.8	Very high	96 Å²	96	44.6 Å²	44.6	51%	0.513	24%	0.242	S	C	.	.	S	Bend	trans	-151.8	130.2	176.1	179.7	-80.6	0	0	0	108.8	V284 L288 G289 G290	V284-N286 HydrophobicContact CG1-CB 4.26Å; V284-N286 PolarHBondContact O-N 3.14Å; N286-L288 PolarHBondContact O-N 3.23Å; N286-L288 PolarHBondContact OD1-N 3.48Å; N286-G289 PolarHBondContact O-N 3.1Å; N286-G289 PolarHBondContact OD1-N 3.39Å; N286-G290 PolarHBondContact O-N 3.12Å
287	K	94.7	Very high	97.8	Very high	96 Å²	96	43.6 Å²	43.6	42%	0.417	24%	0.238	S	C	.	.	H	α-helix	trans	-58.1	-52.8	-175.9	-166.6	-174.7	178.5	179.5	0	112.3	N148 S151 A152 G290 V291	N148-K287 WeakPolarHBondContact O-CE 3.39Å; N148-K287 PolarHBondContact O-NZ 2.87Å; S151-K287 PolarHBondContact OG-NZ 3.03Å; A152-K287 HydrophobicContact CB-CB 4.48Å; A152-K287 HydrophobicContact CB-CD 3.97Å; A152-K287 HydrophobicContact CB-CG 3.89Å; K287-G290 PolarHBondContact O-N 3.34Å; K287-V291 VanDerWaalsContact O-CG2 3.31Å; K287-V291 WeakPolarHBondContact O-CG2 3.5Å; K287-V291 PolarHBondContact O-N 3.09Å; K287-V291 VanDerWaalsContact O-N 3.1Å
288	L	96.8	Very high	97.8	Very high	60 Å²	60	44.2 Å²	44.2	31%	0.314	24%	0.241	S	C	.	.	H	α-helix	trans	-65.7	-44.2	-180	177.1	60	0	0	0	111.4	A152 P154 N286 G290 V291 L292	A152-L288 HydrophobicContact CB-CB 4.23Å; A152-L288 HydrophobicContact CB-CD1 4.35Å; P154-L288 HydrophobicContact CG-CD2 4.37Å; N286-L288 PolarHBondContact O-N 3.23Å; N286-L288 PolarHBondContact OD1-N 3.48Å; L288-G290 VanDerWaalsContact C-N 3.33Å; L288-G290 PolarHBondContact O-N 2.71Å; L288-V291 PolarHBondContact O-N 3.33Å; L288-L292 HydrophobicContact CD1-CD1 4.32Å; L288-L292 HydrophobicContact CD1-CG 4.22Å; L288-L292 HydrophobicContact CG-CD1 4.18Å; L288-L292 HydrophobicContact CG-CG 4.49Å; L288-L292 WeakPolarHBondContact O-CG 3.4Å; L288-L292 PolarHBondContact O-N 2.92Å
289	G	98.3	Very high	97.8	Very high	22 Å²	22	46.5 Å²	46.5	23%	0.227	25%	0.254	C	S	.	.	H	α-helix	trans	-58.9	-42.6	177.5	0	0	0	0	0	112.8	N286 L292 A293	N286-G289 PolarHBondContact O-N 3.1Å; N286-G289 PolarHBondContact OD1-N 3.39Å; G289-L292 PolarHBondContact O-N 2.92Å; G289-A293 WeakPolarHBondContact O-CB 3.34Å; G289-A293 PolarHBondContact O-N 3.4Å
290	G	98.1	Very high	97.8	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-64.7	-41.2	175.2	0	0	0	0	0	112.6	L281 N286 K287 L288 A293 L294	L281-G290 WeakPolarHBondContact CD1-O 3.17Å; L281-G290 WeakPolarHBondContact O-CA 3.36Å; N286-G290 PolarHBondContact O-N 3.12Å; K287-G290 PolarHBondContact O-N 3.34Å; L288-G290 VanDerWaalsContact C-N 3.33Å; L288-G290 PolarHBondContact O-N 2.71Å; G290-A293 PolarHBondContact O-N 2.86Å; G290-L294 WeakPolarHBondContact O-CB 3.49Å; G290-L294 PolarHBondContact O-N 3.36Å
291	V	97.7	Very high	97.8	Very high	10 Å²	10	47.6 Å²	47.6	6%	0.061	26%	0.26	C	S	.	.	H	α-helix	trans	-62.9	-43.5	175.7	172.5	0	0	0	0	111.3	L149 A152 L281 K287 L288 L294 L295	L149-V291 HydrophobicContact CB-CG2 3.72Å; L149-V291 HydrophobicContact CD2-CG2 4.01Å; L149-V291 HydrophobicContact CG-CG2 4.28Å; A152-V291 HydrophobicContact CB-CG2 4.31Å; L281-V291 HydrophobicContact CD1-CG2 4.26Å; K287-V291 VanDerWaalsContact O-CG2 3.31Å; K287-V291 WeakPolarHBondContact O-CG2 3.5Å; K287-V291 PolarHBondContact O-N 3.09Å; K287-V291 VanDerWaalsContact O-N 3.1Å; L288-V291 PolarHBondContact O-N 3.33Å; V291-L294 PolarHBondContact O-N 2.94Å; V291-L295 HydrophobicContact CG1-CD1 4.31Å; V291-L295 WeakPolarHBondContact O-CG 3.5Å; V291-L295 PolarHBondContact O-N 3.18Å
292	L	98.2	Very high	97.8	Very high	88 Å²	88	48.5 Å²	48.5	46%	0.461	27%	0.27	S	S	.	.	H	α-helix	trans	-63.4	-42.4	174.9	-67.7	174.9	0	0	0	111.4	L288 G289 L294 L295 L296	L288-L292 HydrophobicContact CD1-CD1 4.32Å; L288-L292 HydrophobicContact CD1-CG 4.22Å; L288-L292 HydrophobicContact CG-CD1 4.18Å; L288-L292 HydrophobicContact CG-CG 4.49Å; L288-L292 WeakPolarHBondContact O-CG 3.4Å; L288-L292 PolarHBondContact O-N 2.92Å; G289-L292 PolarHBondContact O-N 2.92Å; L292-L294 PolarHBondContact O-N 3.4Å; L292-L295 PolarHBondContact O-N 2.96Å; L292-L296 VanDerWaalsContact O-CB 3.3Å; L292-L296 WeakPolarHBondContact O-CB 3.27Å; L292-L296 WeakPolarHBondContact O-CG 3.42Å; L292-L296 PolarHBondContact O-N 3.39Å
293	A	98.4	Very high	97.8	Very high	14 Å²	14	50 Å²	50	12%	0.116	28%	0.281	C	S	.	.	H	α-helix	trans	-63	-41.6	177.8	0	0	0	0	0	112.4	I280 V284 G289 G290 L296 S297	I280-A293 HydrophobicContact CG2-CB 3.78Å; V284-A293 HydrophobicContact CG2-CB 3.88Å; G289-A293 WeakPolarHBondContact O-CB 3.34Å; G289-A293 PolarHBondContact O-N 3.4Å; G290-A293 PolarHBondContact O-N 2.86Å; A293-L296 PolarHBondContact O-N 3.31Å; A293-S297 PolarHBondContact O-N 3.42Å
294	L	97.9	Very high	97.8	Very high	38 Å²	38	50 Å²	50	20%	0.199	28%	0.28	C	S	.	.	H	α-helix	trans	-59.9	-48.2	172.9	175.7	111.4	0	0	0	111.9	A277 L281 G290 V291 L292 L296 S297	A277-L294 HydrophobicContact CB-CD1 3.82Å; A277-L294 HydrophobicContact CB-CG 4.45Å; A277-L294 WeakPolarHBondContact O-CD1 3.31Å; L281-L294 HydrophobicContact CB-CB 4.21Å; L281-L294 HydrophobicContact CB-CD1 3.99Å; L281-L294 HydrophobicContact CD2-CD1 4.43Å; G290-L294 WeakPolarHBondContact O-CB 3.49Å; G290-L294 PolarHBondContact O-N 3.36Å; V291-L294 PolarHBondContact O-N 2.94Å; L292-L294 PolarHBondContact O-N 3.4Å; L294-L296 VanDerWaalsContact C-N 3.35Å; L294-S297 PolarHBondContact O-N 2.91Å; L294-S297 PolarHBondContact O-OG 3.45Å
295	L	97.3	Very high	97.8	Very high	85 Å²	85	48.9 Å²	48.9	45%	0.445	27%	0.274	S	S	.	.	H	α-helix	trans	-63.2	-44.7	178.6	-70.3	174	0	0	0	110.9	V291 L292 S297 I298 L299	V291-L295 HydrophobicContact CG1-CD1 4.31Å; V291-L295 WeakPolarHBondContact O-CG 3.5Å; V291-L295 PolarHBondContact O-N 3.18Å; L292-L295 PolarHBondContact O-N 2.96Å; L295-S297 VanDerWaalsContact C-N 3.29Å; L295-S297 PolarHBondContact O-N 3.04Å; L295-I298 PolarHBondContact O-N 2.98Å; L295-L299 WeakPolarHBondContact O-CB 3.4Å; L295-L299 WeakPolarHBondContact O-CG 3.24Å; L295-L299 PolarHBondContact O-N 3.4Å
296	L	98.3	Very high	97.8	Very high	96 Å²	96	48.5 Å²	48.5	50%	0.503	26%	0.263	S	S	.	.	H	α-helix	trans	-65.4	-29.7	178.4	-71.3	171.9	0	0	0	112.6	L292 A293 L294 I298 L299 I300 F359	L292-L296 VanDerWaalsContact O-CB 3.3Å; L292-L296 WeakPolarHBondContact O-CB 3.27Å; L292-L296 WeakPolarHBondContact O-CG 3.42Å; L292-L296 PolarHBondContact O-N 3.39Å; A293-L296 PolarHBondContact O-N 3.31Å; L294-L296 VanDerWaalsContact C-N 3.35Å; L296-I298 PolarHBondContact O-N 3.36Å; L296-I298 VanDerWaalsContact O-N 3.13Å; L296-L299 PolarHBondContact O-N 3.09Å; L296-I300 WeakPolarHBondContact O-CB 3.16Å; L296-I300 WeakPolarHBondContact O-CG2 3.45Å; L296-I300 PolarHBondContact O-N 3.23Å; L296-F359 HydrophobicContact CB-CE1 4.13Å; L296-F359 HydrophobicContact CB-CZ 4.25Å
297	S	98.4	Very high	97.8	Very high	2 Å²	2	45.7 Å²	45.7	1%	0.014	25%	0.248	C	C	.	.	H	α-helix	trans	-66	-14.2	176.8	72	0	0	0	0	113.8	I280 A293 L294 L295 Y358	I280-S297 VanDerWaalsContact CD1-CB 3.42Å; A293-S297 PolarHBondContact O-N 3.42Å; L294-S297 PolarHBondContact O-N 2.91Å; L294-S297 PolarHBondContact O-OG 3.45Å; L295-S297 VanDerWaalsContact C-N 3.29Å; L295-S297 PolarHBondContact O-N 3.04Å; S297-Y358 PolarHBondContact O-OH 3.23Å
298	I	98.4	Very high	98	Very high	16 Å²	16	43 Å²	43	8%	0.082	24%	0.237	C	C	.	.	H	α-helix	trans	-105.3	-47.2	173.8	-53.9	161.8	0	0	0	109.5	L120 L121 M124 L295 L296 I300 L301	L120-I298 HydrophobicContact CD2-CG2 3.9Å; L121-I298 HydrophobicContact CD2-CD1 4.5Å; L121-I298 HydrophobicContact CD2-CG2 3.76Å; L121-I298 HydrophobicContact CG-CG2 4.37Å; M124-I298 HydrophobicContact CE-CD1 3.4Å; M124-I298 HydrophobicContact CE-CG1 4.15Å; M124-I298 HydrophobicContact SD-CD1 3.85Å; M124-I298 HydrophobicContact SD-CG1 4.43Å; M124-I298 HydrophobicContact SD-CG2 4.33Å; L295-I298 PolarHBondContact O-N 2.98Å; L296-I298 PolarHBondContact O-N 3.36Å; L296-I298 VanDerWaalsContact O-N 3.13Å; I298-I300 PolarHBondContact O-N 3Å; I298-L301 WeakPolarHBondContact O-CB 3.44Å; I298-L301 WeakPolarHBondContact O-CG 3.43Å; I298-L301 PolarHBondContact O-N 3.35Å; I298-L301 VanDerWaalsContact O-N 3.12Å
299	L	98.3	Very high	98	Very high	77 Å²	77	44.3 Å²	44.3	40%	0.403	24%	0.242	S	C	.	.	H	α-helix	trans	-66.3	-19.4	-177.6	-66.6	179.1	0	0	0	113.5	L121 L295 L296 L301 A302	L121-L299 HydrophobicContact CD1-CD2 4.1Å; L295-L299 WeakPolarHBondContact O-CB 3.4Å; L295-L299 WeakPolarHBondContact O-CG 3.24Å; L295-L299 PolarHBondContact O-N 3.4Å; L296-L299 PolarHBondContact O-N 3.09Å; L299-L301 PolarHBondContact O-N 2.97Å; L299-L301 VanDerWaalsContact O-N 3.13Å; L299-A302 WeakPolarHBondContact O-CB 3.44Å; L299-A302 PolarHBondContact O-N 2.94Å
300	I	98.5	Very high	98	Very high	9 Å²	9	43.7 Å²	43.7	5%	0.046	23%	0.234	C	C	.	.	H	α-helix	trans	-56.7	-26	172	-166.4	166.2	0	0	0	112.6	L296 I298 A302 M303 I304 Y358 F359 I362 L363	L296-I300 WeakPolarHBondContact O-CB 3.16Å; L296-I300 WeakPolarHBondContact O-CG2 3.45Å; L296-I300 PolarHBondContact O-N 3.23Å; I298-I300 PolarHBondContact O-N 3Å; I300-A302 VanDerWaalsContact C-N 3.26Å; I300-A302 PolarHBondContact O-N 2.86Å; I300-M303 WeakPolarHBondContact O-CB 3.39Å; I300-M303 PolarHBondContact O-N 3.48Å; I300-I304 PolarHBondContact O-N 3.13Å; I300-Y358 HydrophobicContact CG2-CE1 4.17Å; I300-Y358 VanDerWaalsContact CG2-OH 3.26Å; I300-Y358 WeakPolarHBondContact CG2-OH 3.46Å; I300-F359 HydrophobicContact CD1-CD1 3.78Å; I300-F359 HydrophobicContact CD1-CE1 4.16Å; I300-I362 HydrophobicContact CD1-CB 3.82Å; I300-I362 HydrophobicContact CD1-CD1 4.04Å; I300-I362 HydrophobicContact CD1-CG2 3.53Å; I300-I362 HydrophobicContact CG1-CG2 3.78Å; I300-I362 HydrophobicContact CG2-CD1 4.32Å; I300-L363 HydrophobicContact CD1-CD1 4.37Å; I300-L363 HydrophobicContact CD1-CD2 3.69Å; I300-L363 HydrophobicContact CD1-CG 3.83Å; I300-L363 HydrophobicContact CG1-CD2 4.12Å
301	L	98.6	Very high	98	Very high	18 Å²	18	50.2 Å²	50.2	9%	0.094	26%	0.263	C	S	.	.	H	α-helix	trans	-58.6	-37	173.8	-68.5	175.1	0	0	0	112.1	I98 L102 W113 V117 L120 I298 L299 M303 I304	I98-L301 HydrophobicContact CG2-CD1 4.32Å; I98-L301 HydrophobicContact CG2-CD2 4.1Å; L102-L301 HydrophobicContact CD1-CD2 4.5Å; L102-L301 HydrophobicContact CD2-CD2 4.4Å; W113-L301 HydrophobicContact CH2-CD2 4.49Å; W113-L301 HydrophobicContact CZ2-CB 4.22Å; W113-L301 HydrophobicContact CZ2-CD2 4.06Å; W113-L301 PolarHBondContact NE1-O 2.58Å; V117-L301 HydrophobicContact CG2-CB 3.86Å; L120-L301 HydrophobicContact CD2-CD1 3.69Å; I298-L301 WeakPolarHBondContact O-CB 3.44Å; I298-L301 WeakPolarHBondContact O-CG 3.43Å; I298-L301 PolarHBondContact O-N 3.35Å; I298-L301 VanDerWaalsContact O-N 3.12Å; L299-L301 PolarHBondContact O-N 2.97Å; L299-L301 VanDerWaalsContact O-N 3.13Å; L301-M303 PolarHBondContact O-N 3.31Å; L301-I304 WeakPolarHBondContact O-CB 3.31Å; L301-I304 WeakPolarHBondContact O-CG1 3.4Å; L301-I304 PolarHBondContact O-N 3.14Å
302	A	98.2	Very high	98	Very high	37 Å²	37	51.7 Å²	51.7	31%	0.306	27%	0.269	S	S	.	.	H	α-helix	trans	-67.9	-20.7	177.1	0	0	0	0	0	112.8	L299 I300 P305	L299-A302 WeakPolarHBondContact O-CB 3.44Å; L299-A302 PolarHBondContact O-N 2.94Å; I300-A302 VanDerWaalsContact C-N 3.26Å; I300-A302 PolarHBondContact O-N 2.86Å; A302-P305 WeakPolarHBondContact O-CD 3.43Å
303	M	97.5	Very high	98	Very high	91 Å²	91	49.6 Å²	49.6	45%	0.448	26%	0.257	S	S	.	.	H	α-helix	trans	-83.3	-19.4	176.7	-61.4	-62	-66.6	0	0	112.9	I300 L301 P305 I306 L307	I300-M303 WeakPolarHBondContact O-CB 3.39Å; I300-M303 PolarHBondContact O-N 3.48Å; L301-M303 PolarHBondContact O-N 3.31Å; M303-P305 VanDerWaalsContact C-CD 3.48Å; M303-I306 HydrophobicContact CE-CD1 4.5Å; M303-I306 PolarHBondContact O-N 3.42Å; M303-I306 HydrophobicContact SD-CD1 4.49Å; M303-L307 HydrophobicContact CB-CD1 4.14Å; M303-L307 WeakPolarHBondContact O-CG 3.46Å; M303-L307 PolarHBondContact O-N 2.88Å; M303-L307 VanDerWaalsContact O-N 3.13Å
304	I	98.3	Very high	98	Very high	15 Å²	15	49 Å²	49	8%	0.077	25%	0.252	C	S	.	.	H	α-helix	trans	-53.4	-44.6	-174.6	-61.6	-68.4	0	0	0	113.6	L102 F107 W113 I300 L301 I306 L307 H308 I362	L102-I304 HydrophobicContact CD2-CD1 4.26Å; L102-I304 HydrophobicContact CD2-CG1 4.04Å; L102-I304 HydrophobicContact CD2-CG2 3.91Å; F107-I304 HydrophobicContact CB-CG2 4.25Å; F107-I304 HydrophobicContact CD1-CG2 3.46Å; F107-I304 VanDerWaalsContact CD1-CG2 3.46Å; F107-I304 HydrophobicContact CD2-CG2 3.79Å; F107-I304 HydrophobicContact CE1-CG2 3.6Å; F107-I304 HydrophobicContact CE2-CG2 3.95Å; F107-I304 HydrophobicContact CG-CG2 3.55Å; F107-I304 HydrophobicContact CZ-CG2 3.85Å; W113-I304 HydrophobicContact CZ2-CB 4.48Å; W113-I304 HydrophobicContact CZ2-CG1 4.5Å; I300-I304 PolarHBondContact O-N 3.13Å; L301-I304 WeakPolarHBondContact O-CB 3.31Å; L301-I304 WeakPolarHBondContact O-CG1 3.4Å; L301-I304 PolarHBondContact O-N 3.14Å; I304-I306 PolarHBondContact O-N 3.41Å; I304-L307 PolarHBondContact O-N 2.8Å; I304-L307 VanDerWaalsContact O-N 3.15Å; I304-H308 PolarHBondContact O-N 3.4Å; I304-I362 HydrophobicContact CD1-CG2 3.45Å; I304-I362 VanDerWaalsContact CD1-CG2 3.45Å
305	P	97.8	Very high	98	Very high	30 Å²	30	47.9 Å²	47.9	20%	0.195	25%	0.246	C	C	.	.	H	α-helix	trans	-59.1	-35.4	178.8	-23.2	34.2	0	0	0	113.2	F107 A302 M303	F107-P305 HydrophobicContact CB-CG 4.31Å; F107-P305 HydrophobicContact CD2-CB 4.36Å; F107-P305 HydrophobicContact CD2-CG 4.32Å; F107-P305 WeakPolarHBondContact O-CG 3.44Å; A302-P305 WeakPolarHBondContact O-CD 3.43Å; M303-P305 VanDerWaalsContact C-CD 3.48Å
306	I	97.4	Very high	98.1	Very high	119 Å²	119	47.6 Å²	47.6	61%	0.61	24%	0.244	S	C	*	.	H	α-helix	trans	-77.1	-29	-178.8	-55.6	166.2	0	0	0	111	M303 I304 H308	M303-I306 HydrophobicContact CE-CD1 4.5Å; M303-I306 PolarHBondContact O-N 3.42Å; M303-I306 HydrophobicContact SD-CD1 4.49Å; I304-I306 PolarHBondContact O-N 3.41Å; I306-H308 PolarHBondContact O-N 2.83Å
307	L	97.8	Very high	98.1	Very high	36 Å²	36	48.3 Å²	48.3	19%	0.188	24%	0.243	C	C	.	.	H	α-helix	trans	-78.5	-6.1	178.2	-65.7	171.8	0	0	0	113.2	M303 I304 M309 I362 L363 P367	M303-L307 HydrophobicContact CB-CD1 4.14Å; M303-L307 WeakPolarHBondContact O-CG 3.46Å; M303-L307 PolarHBondContact O-N 2.88Å; M303-L307 VanDerWaalsContact O-N 3.13Å; I304-L307 PolarHBondContact O-N 2.8Å; I304-L307 VanDerWaalsContact O-N 3.15Å; L307-M309 PolarHBondContact O-N 2.94Å; L307-I362 HydrophobicContact CD1-CG2 4.12Å; L307-L363 HydrophobicContact CD1-CD2 3.88Å; L307-P367 HydrophobicContact CB-CG 4.15Å; L307-P367 HydrophobicContact CD2-CG 4.35Å
308	H	98.1	Very high	98.1	Very high	41 Å²	41	48.5 Å²	48.5	19%	0.19	24%	0.243	C	C	.	.			trans	-75.5	108.5	-177.3	-172	77.9	0	0	0	112.3	F107 L108 I304 I306 S310	F107-H308 HydrophobicContact CE2-CB 3.81Å; F107-H308 AromaticContact CE2-CG 3.9Å; F107-H308 AromaticContact CE2-ND1 3.75Å; F107-H308 HydrophobicContact CZ-CB 4.33Å; F107-H308 AromaticContact CZ-ND1 3.56Å; L108-H308 HydrophobicContact CD2-CB 4.23Å; I304-H308 PolarHBondContact O-N 3.4Å; I306-H308 PolarHBondContact O-N 2.83Å; H308-S310 PolarHBondContact NE2-O 3.2Å
309	M	97.8	Very high	98.1	Very high	86 Å²	86	52.1 Å²	52.1	42%	0.424	27%	0.268	S	S	.	.			trans	-107.8	-4	-178.8	-61.9	-64.9	171.3	0	0	114.1	L307 P367 L371 N374	L307-M309 PolarHBondContact O-N 2.94Å; M309-P367 HydrophobicContact CG-CB 4.07Å; M309-L371 HydrophobicContact CB-CD2 3.83Å; M309-L371 HydrophobicContact CB-CG 3.88Å; M309-L371 HydrophobicContact CG-CD2 4.47Å; M309-L371 HydrophobicContact CG-CG 4.39Å; M309-N374 PolarHBondContact O-ND2 2.82Å
310	S	98.1	Very high	98.1	Very high	9 Å²	9	51.5 Å²	51.5	6%	0.063	27%	0.265	C	S	.	.			trans	-76.9	147.3	-178.3	172.9	0	0	0	0	111.3	H308 Q312 R318	H308-S310 PolarHBondContact NE2-O 3.2Å; S310-Q312 VanDerWaalsContact C-N 3.32Å; S310-Q312 WeakPolarHBondContact CB-O 3.5Å; S310-Q312 PolarHBondContact OG-N 3.44Å; S310-Q312 PolarHBondContact OG-O 3.02Å; S310-R318 VanDerWaalsContact OG-CZ 3.29Å; S310-R318 PolarHBondContact OG-NE 3.36Å; S310-R318 PolarHBondContact OG-NH1 3.48Å
311	K	97.8	Very high	98.1	Very high	137 Å²	137	51.1 Å²	51.1	60%	0.596	26%	0.263	S	S	*	.	S	Bend	trans	-83.4	-12.4	168.8	-54.7	-70.8	-173.3	173.7	0	112.5	N374 W379 A380	K311-N374 PolarHBondContact N-OD1 2.93Å; K311-W379 HydrophobicContact CB-CD2 4.01Å; K311-W379 HydrophobicContact CB-CE3 3.46Å; K311-W379 VanDerWaalsContact CB-CE3 3.46Å; K311-W379 HydrophobicContact CB-CH2 4.48Å; K311-W379 HydrophobicContact CB-CZ3 3.72Å; K311-W379 HydrophobicContact CG-CB 4.23Å; K311-W379 HydrophobicContact CG-CD2 4.24Å; K311-W379 HydrophobicContact CG-CE3 3.9Å; K311-W379 HydrophobicContact CG-CG 4.44Å; K311-A380 VanDerWaalsContact CE-O 3.27Å; K311-A380 WeakPolarHBondContact CE-O 3.46Å; K311-A380 PolarHBondContact NZ-O 3.33Å
312	Q	98	Very high	98.1	Very high	42 Å²	42	52.8 Å²	52.8	20%	0.196	27%	0.27	C	S	.	.	S	Bend	trans	-99.1	130	169.8	-81.3	160.4	-28.3	0	0	110.7	S310 R318 W379	S310-Q312 VanDerWaalsContact C-N 3.32Å; S310-Q312 WeakPolarHBondContact CB-O 3.5Å; S310-Q312 PolarHBondContact OG-N 3.44Å; S310-Q312 PolarHBondContact OG-O 3.02Å; Q312-R318 HydrophobicContact CB-CG 4.42Å; Q312-R318 PolarHBondContact O-NH1 2.86Å; Q312-R318 VanDerWaalsContact OE1-CG 3.25Å; Q312-W379 HydrophobicContact CB-CZ3 4.38Å; Q312-W379 VanDerWaalsContact CD-CH2 3.46Å; Q312-W379 HydrophobicContact CG-CH2 3.38Å; Q312-W379 HydrophobicContact CG-CZ3 3.57Å
313	Q	97.8	Very high	98.1	Very high	43 Å²	43	54.3 Å²	54.3	20%	0.201	28%	0.279	C	S	.	.	S	Bend	trans	-65.8	-56	177.5	175.2	168.9	4.1	0	0	112.2	G105 L108 N206	G105-Q313 WeakPolarHBondContact CA-O 3.36Å; G105-Q313 WeakPolarHBondContact O-CG 3.18Å; G105-Q313 PolarHBondContact O-NE2 2.88Å; L108-Q313 HydrophobicContact CD1-CB 4.1Å; L108-Q313 HydrophobicContact CD1-CG 3.73Å; N206-Q313 PolarHBondContact ND2-NE2 2.97Å
314	S	98.3	Very high	98.1	Very high	3 Å²	3	50.8 Å²	50.8	2%	0.021	26%	0.261	C	S	.	.	S	Bend	trans	-82.9	147.6	-176.8	175.1	0	0	0	0	112.5	Y104 P208 M316 R318	Y104-S314 WeakPolarHBondContact CD1-OG 3.46Å; P208-S314 WeakPolarHBondContact O-CB 2.86Å; P208-S314 PolarHBondContact O-OG 3.37Å; S314-M316 PolarHBondContact O-N 3.31Å; S314-M316 WeakPolarHBondContact OG-CB 3.45Å; S314-M316 PolarHBondContact OG-N 3.08Å; S314-M316 VanDerWaalsContact OG-N 3.07Å; S314-R318 WeakPolarHBondContact O-CD 3.32Å
315	M	98.6	Very high	98.2	Very high	14 Å²	14	51.7 Å²	51.7	7%	0.069	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-75.4	-5.9	170.2	-63.7	-172.2	-173.9	0	0	113.5	Y103 F317 R318 Q322 Y325	Y103-M315 HydrophobicContact CD2-CB 4.29Å; Y103-M315 HydrophobicContact CD2-SD 4.38Å; Y103-M315 HydrophobicContact CE1-CB 4.46Å; Y103-M315 HydrophobicContact CE2-CB 4.21Å; Y103-M315 HydrophobicContact CG-CB 4.48Å; Y103-M315 VanDerWaalsContact O-CB 3.28Å; Y103-M315 WeakPolarHBondContact O-CB 3.26Å; Y103-M315 VanDerWaalsContact O-CG 3.3Å; Y103-M315 WeakPolarHBondContact O-CG 3.35Å; Y103-M315 PolarHBondContact O-N 3.21Å; M315-F317 PolarHBondContact O-N 3.4Å; M315-R318 PolarHBondContact O-N 3.27Å; M315-Q322 HydrophobicContact CB-CG 4.18Å; M315-Q322 VanDerWaalsContact O-CG 3.25Å; M315-Q322 WeakPolarHBondContact O-CG 3.37Å; M315-Q322 PolarHBondContact O-NE2 3.23Å; M315-Y325 HydrophobicContact SD-CG 4.45Å
316	M	97.9	Very high	98.2	Very high	79 Å²	79	57.1 Å²	57.1	39%	0.389	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-52.6	-32.4	-176.1	-179	164.6	176.8	0	0	114.3	P208 L209 S314 Q322	P208-M316 HydrophobicContact CB-SD 4.3Å; L209-M316 HydrophobicContact CD2-CE 3.82Å; L209-M316 HydrophobicContact CD2-SD 3.69Å; S314-M316 PolarHBondContact O-N 3.31Å; S314-M316 WeakPolarHBondContact OG-CB 3.45Å; S314-M316 PolarHBondContact OG-N 3.08Å; S314-M316 VanDerWaalsContact OG-N 3.07Å; M316-Q322 PolarHBondContact O-NE2 2.84Å
317	F	98.1	Very high	98.3	Very high	111 Å²	111	54.8 Å²	54.8	49%	0.487	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-109.6	19.9	179.4	-56	-62.1	0	0	0	113.7	L209 M315	L209-F317 HydrophobicContact CD2-CE2 4.19Å; L209-F317 HydrophobicContact CD2-CZ 3.84Å; M315-F317 PolarHBondContact O-N 3.4Å
318	R	98.4	Very high	98.3	Very high	5 Å²	5	53.4 Å²	53.4	2%	0.019	26%	0.262	C	S	.	.			trans	-127.6	77.9	-170.9	-69.8	175.3	56.7	-165	0.1	110.8	S310 Q312 S314 M315 L320 S321 Q322 S370 E373	S310-R318 VanDerWaalsContact OG-CZ 3.29Å; S310-R318 PolarHBondContact OG-NE 3.36Å; S310-R318 PolarHBondContact OG-NH1 3.48Å; Q312-R318 HydrophobicContact CB-CG 4.42Å; Q312-R318 PolarHBondContact O-NH1 2.86Å; Q312-R318 VanDerWaalsContact OE1-CG 3.25Å; S314-R318 WeakPolarHBondContact O-CD 3.32Å; M315-R318 PolarHBondContact O-N 3.27Å; R318-L320 VanDerWaalsContact C-N 3.31Å; R318-L320 PolarHBondContact O-N 3.28Å; R318-S321 PolarHBondContact NE-OG 3.13Å; R318-S321 PolarHBondContact NH2-OG 2.95Å; R318-S321 PolarHBondContact O-N 3.41Å; R318-S321 VanDerWaalsContact O-N 3.15Å; R318-Q322 WeakPolarHBondContact O-CG 3.05Å; R318-Q322 PolarHBondContact O-N 3.09Å; R318-S370 PolarHBondContact NH2-OG 3.25Å; R318-E373 WeakPolarHBondContact CA-OE1 3.49Å; R318-E373 WeakPolarHBondContact CB-OE1 3.21Å; R318-E373 WeakPolarHBondContact CB-OE2 3.07Å; R318-E373 IonicContact CZ-OE2 3.39Å; R318-E373 IonicContact NE-OE2 3.01Å; R318-E373 PolarHBondContact NE-OE2 3.32Å; R318-E373 IonicContact NH2-OE2 2.84Å; R318-E373 PolarHBondContact NH2-OE2 3.33Å
319	P	98.3	Very high	98.4	Very high	92 Å²	92	52.8 Å²	52.8	60%	0.597	26%	0.264	S	S	*	.	H	α-helix	trans	-62.8	-34	-167.8	24.1	-34.2	0	0	0	113.5	Q322 S323	P319-Q322 PolarHBondContact O-N 3.02Å; P319-S323 PolarHBondContact O-N 2.93Å; P319-S323 VanDerWaalsContact O-N 3.13Å
320	L	98.5	Very high	98.4	Very high	65 Å²	65	50.9 Å²	50.9	34%	0.34	26%	0.262	S	S	.	.	H	α-helix	trans	-69.7	-42.9	177.5	-59.9	178.1	0	0	0	109.8	R318 Q322 S323 L324 I369 I372 E373 M376	R318-L320 VanDerWaalsContact C-N 3.31Å; R318-L320 PolarHBondContact O-N 3.28Å; L320-Q322 VanDerWaalsContact C-N 3.34Å; L320-Q322 PolarHBondContact O-N 2.92Å; L320-S323 PolarHBondContact O-N 3.47Å; L320-S323 PolarHBondContact O-OG 3.48Å; L320-L324 PolarHBondContact O-N 3.3Å; L320-L324 VanDerWaalsContact O-N 3.13Å; L320-I369 HydrophobicContact CB-CD1 4.47Å; L320-I369 HydrophobicContact CB-CG2 3.42Å; L320-I369 VanDerWaalsContact CB-CG2 3.42Å; L320-I369 HydrophobicContact CD1-CD1 4.37Å; L320-I369 HydrophobicContact CD1-CG2 4.46Å; L320-I372 HydrophobicContact CD1-CG2 4.39Å; L320-E373 HydrophobicContact CB-CG 4.25Å; L320-E373 WeakPolarHBondContact CB-OE1 3.4Å; L320-E373 HydrophobicContact CD1-CG 4.21Å; L320-E373 PolarHBondContact N-OE1 3.03Å; L320-M376 HydrophobicContact CD1-SD 4.05Å
321	S	98.6	Very high	98.5	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.007	26%	0.26	C	S	.	.	H	α-helix	trans	-64.5	-36.1	175.2	-63.6	0	0	0	0	113.1	R318 S323 L324 Y325 E373	R318-S321 PolarHBondContact NE-OG 3.13Å; R318-S321 PolarHBondContact NH2-OG 2.95Å; R318-S321 PolarHBondContact O-N 3.41Å; R318-S321 VanDerWaalsContact O-N 3.15Å; S321-S323 VanDerWaalsContact C-N 3.34Å; S321-S323 PolarHBondContact O-N 3.39Å; S321-L324 PolarHBondContact O-N 2.87Å; S321-Y325 PolarHBondContact O-N 2.95Å; S321-E373 PolarHBondContact N-OE1 3.24Å; S321-E373 PolarHBondContact OG-OE1 3.42Å; S321-E373 PolarHBondContact OG-OE2 3.37Å
322	Q	98.8	Very high	98.5	Very high	52 Å²	52	46.7 Å²	46.7	24%	0.243	25%	0.245	C	C	.	.	H	α-helix	trans	-60.3	-43.5	172.8	-70.1	178.7	38.3	0	0	111.8	Y103 M315 M316 R318 P319 L320 L324 Y325 W326	Y103-Q322 HydrophobicContact CE2-CG 3.94Å; Y103-Q322 WeakPolarHBondContact OH-CG 3.46Å; Y103-Q322 PolarHBondContact OH-OE1 3.1Å; M315-Q322 HydrophobicContact CB-CG 4.18Å; M315-Q322 VanDerWaalsContact O-CG 3.25Å; M315-Q322 WeakPolarHBondContact O-CG 3.37Å; M315-Q322 PolarHBondContact O-NE2 3.23Å; M316-Q322 PolarHBondContact O-NE2 2.84Å; R318-Q322 WeakPolarHBondContact O-CG 3.05Å; R318-Q322 PolarHBondContact O-N 3.09Å; P319-Q322 PolarHBondContact O-N 3.02Å; L320-Q322 VanDerWaalsContact C-N 3.34Å; L320-Q322 PolarHBondContact O-N 2.92Å; Q322-L324 VanDerWaalsContact C-N 3.32Å; Q322-L324 PolarHBondContact O-N 3.35Å; Q322-Y325 PolarHBondContact O-N 3.45Å; Q322-W326 PolarHBondContact O-N 3.01Å
323	S	98.6	Very high	98.6	Very high	70 Å²	70	50.7 Å²	50.7	49%	0.49	27%	0.267	S	S	.	.	H	α-helix	trans	-61.7	-41	177.3	76	0	0	0	0	111.8	P319 L320 S321 W326 L327	P319-S323 PolarHBondContact O-N 2.93Å; P319-S323 VanDerWaalsContact O-N 3.13Å; L320-S323 PolarHBondContact O-N 3.47Å; L320-S323 PolarHBondContact O-OG 3.48Å; S321-S323 VanDerWaalsContact C-N 3.34Å; S321-S323 PolarHBondContact O-N 3.39Å; S323-W326 PolarHBondContact O-N 3.47Å; S323-L327 WeakPolarHBondContact O-CB 3.33Å; S323-L327 PolarHBondContact O-N 3.3Å
324	L	98.6	Very high	98.6	Very high	17 Å²	17	51.9 Å²	51.9	9%	0.089	27%	0.274	C	S	.	.	H	α-helix	trans	-68.3	-35.9	175.6	-72.9	-173.1	0	0	0	113.1	L320 S321 Q322 L327 L328 L365 M366 I369	L320-L324 PolarHBondContact O-N 3.3Å; L320-L324 VanDerWaalsContact O-N 3.13Å; S321-L324 PolarHBondContact O-N 2.87Å; Q322-L324 VanDerWaalsContact C-N 3.32Å; Q322-L324 PolarHBondContact O-N 3.35Å; L324-L327 HydrophobicContact CD2-CD2 4.09Å; L324-L327 PolarHBondContact O-N 3.38Å; L324-L328 WeakPolarHBondContact O-CB 3.49Å; L324-L328 PolarHBondContact O-N 3.43Å; L324-L365 HydrophobicContact CD1-CB 3.75Å; L324-L365 HydrophobicContact CD2-CB 4.21Å; L324-L365 HydrophobicContact CD2-CD1 4.24Å; L324-M366 HydrophobicContact CB-CE 4.42Å; L324-M366 HydrophobicContact CB-CG 4.31Å; L324-M366 HydrophobicContact CD1-CG 4.14Å; L324-I369 HydrophobicContact CD1-CB 3.86Å; L324-I369 HydrophobicContact CD1-CG1 3.53Å; L324-I369 HydrophobicContact CD1-CG2 4.32Å; L324-I369 HydrophobicContact CG-CG1 4.41Å
325	Y	98.8	Very high	98.6	Very high	34 Å²	34	51.7 Å²	51.7	13%	0.133	27%	0.273	C	S	.	.	H	α-helix	trans	-61.5	-46.2	173.8	170.8	-91.4	0	0	0	111.2	G99 L102 Y103 M315 S321 Q322 L328 A329	G99-Y325 WeakPolarHBondContact O-CE2 3.34Å; G99-Y325 PolarHBondContact O-OH 2.82Å; L102-Y325 HydrophobicContact CB-CE2 4.22Å; Y103-Y325 AromaticContact CD2-CD1 3.51Å; Y103-Y325 HydrophobicContact CD2-CD1 3.51Å; Y103-Y325 HydrophobicContact CD2-CD2 4.05Å; Y103-Y325 AromaticContact CD2-CE1 3.74Å; Y103-Y325 HydrophobicContact CD2-CE1 3.74Å; 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 4.46Å; Y103-Y325 HydrophobicContact CE2-CG 4.41Å; M315-Y325 HydrophobicContact SD-CG 4.45Å; S321-Y325 PolarHBondContact O-N 2.95Å; Q322-Y325 PolarHBondContact O-N 3.45Å; Y325-L328 WeakPolarHBondContact O-CB 3.07Å; Y325-L328 PolarHBondContact O-N 3.07Å; Y325-A329 PolarHBondContact O-N 3.46Å
326	W	98.8	Very high	98.6	Very high	143 Å²	143	52.7 Å²	52.7	54%	0.542	28%	0.28	S	S	.	.	H	α-helix	trans	-71.3	-31.5	178.4	-71.5	117.2	0	0	0	112.7	Q322 S323 A329 A330	Q322-W326 PolarHBondContact O-N 3.01Å; S323-W326 PolarHBondContact O-N 3.47Å; W326-A329 HydrophobicContact CE3-CB 4.11Å; W326-A329 PolarHBondContact O-N 3.09Å; W326-A330 WeakPolarHBondContact O-CB 3.49Å; W326-A330 PolarHBondContact O-N 3.11Å
327	L	98.7	Very high	98.7	Very high	70 Å²	70	55.1 Å²	55.1	37%	0.366	29%	0.285	S	S	.	.	H	α-helix	trans	-59.8	-47.6	168.5	-179.9	64.8	0	0	0	111	S323 L324 A329 A330 D331 L357	S323-L327 WeakPolarHBondContact O-CB 3.33Å; S323-L327 PolarHBondContact O-N 3.3Å; L324-L327 HydrophobicContact CD2-CD2 4.09Å; L324-L327 PolarHBondContact O-N 3.38Å; L327-A329 VanDerWaalsContact C-N 3.34Å; L327-A329 PolarHBondContact O-N 3.05Å; L327-A330 PolarHBondContact O-N 3.04Å; L327-D331 VanDerWaalsContact O-CB 3.32Å; L327-D331 WeakPolarHBondContact O-CB 3.26Å; L327-D331 PolarHBondContact O-N 2.93Å; L327-L357 HydrophobicContact CD1-CD2 4.24Å; L327-L357 HydrophobicContact CD2-CD1 4.32Å; L327-L357 HydrophobicContact CG-CD2 4.49Å
328	L	98.8	Very high	98.7	Very high	8 Å²	8	50 Å²	50	4%	0.042	26%	0.263	C	S	.	.	H	α-helix	trans	-61.4	-41.8	176.6	178.7	62.8	0	0	0	111.9	L324 Y325 D331 L332 Y358 T361 I362 M366	L324-L328 WeakPolarHBondContact O-CB 3.49Å; L324-L328 PolarHBondContact O-N 3.43Å; Y325-L328 WeakPolarHBondContact O-CB 3.07Å; Y325-L328 PolarHBondContact O-N 3.07Å; L328-D331 PolarHBondContact O-N 3Å; L328-L332 HydrophobicContact CG-CD1 4.49Å; L328-L332 WeakPolarHBondContact O-CG 3.31Å; L328-L332 PolarHBondContact O-N 3.07Å; L328-Y358 HydrophobicContact CD1-CD2 3.65Å; L328-Y358 HydrophobicContact CD1-CE2 3.95Å; L328-T361 HydrophobicContact CB-CG2 4.11Å; L328-I362 HydrophobicContact CD1-CD1 4.08Å; L328-I362 HydrophobicContact CD1-CG1 4.09Å; L328-I362 HydrophobicContact CD2-CD1 4.23Å; L328-I362 HydrophobicContact CD2-CG1 3.93Å; L328-M366 HydrophobicContact CB-CE 4.27Å; L328-M366 HydrophobicContact CD2-CE 3.8Å
329	A	98.8	Very high	98.7	Very high	28 Å²	28	49.8 Å²	49.8	23%	0.231	26%	0.262	C	S	.	.	H	α-helix	trans	-63.7	-43.6	176.8	0	0	0	0	0	111.7	Y325 W326 L327 L332 L333	Y325-A329 PolarHBondContact O-N 3.46Å; W326-A329 HydrophobicContact CE3-CB 4.11Å; W326-A329 PolarHBondContact O-N 3.09Å; L327-A329 VanDerWaalsContact C-N 3.34Å; L327-A329 PolarHBondContact O-N 3.05Å; A329-L332 PolarHBondContact O-N 3.07Å; A329-L333 WeakPolarHBondContact O-CG 3.44Å; A329-L333 PolarHBondContact O-N 2.95Å
330	A	98.9	Very high	98.6	Very high	46 Å²	46	46.4 Å²	46.4	38%	0.38	24%	0.243	S	C	.	.	H	α-helix	trans	-64.9	-40.3	175.6	0	0	0	0	0	111.9	W326 L327 L333 I334	W326-A330 WeakPolarHBondContact O-CB 3.49Å; W326-A330 PolarHBondContact O-N 3.11Å; L327-A330 PolarHBondContact O-N 3.04Å; A330-L333 WeakPolarHBondContact O-CB 3.46Å; A330-L333 PolarHBondContact O-N 3.24Å; A330-I334 WeakPolarHBondContact O-CG1 3.39Å; A330-I334 PolarHBondContact O-N 3.07Å
331	D	98.9	Very high	98.6	Very high	3 Å²	3	45.7 Å²	45.7	2%	0.016	24%	0.238	C	C	.	.	H	α-helix	trans	-63.3	-41.2	176.8	-172.9	55.4	0	0	0	111.9	L327 L328 L333 I334 L335 A354 L357 Y358	L327-D331 VanDerWaalsContact O-CB 3.32Å; L327-D331 WeakPolarHBondContact O-CB 3.26Å; L327-D331 PolarHBondContact O-N 2.93Å; L328-D331 PolarHBondContact O-N 3Å; D331-L333 VanDerWaalsContact C-N 3.31Å; D331-L333 PolarHBondContact O-N 3.05Å; D331-I334 CarbonylContact O-C 3.59Å; D331-I334 WeakPolarHBondContact O-CB 3.39Å; D331-I334 PolarHBondContact O-N 3Å; D331-I334 VanDerWaalsContact O-N 3.14Å; D331-L335 WeakPolarHBondContact O-CB 3.38Å; D331-L335 WeakPolarHBondContact O-CG 3.33Å; D331-L335 PolarHBondContact O-N 3.14Å; D331-A354 VanDerWaalsContact OD1-CA 3.31Å; D331-A354 WeakPolarHBondContact OD1-CA 3.5Å; D331-A354 VanDerWaalsContact OD1-CB 3.32Å; D331-A354 WeakPolarHBondContact OD1-CB 3.39Å; D331-A354 VanDerWaalsContact OD2-O 3.08Å; D331-L357 HydrophobicContact CB-CD2 4.25Å; D331-Y358 VanDerWaalsContact OD2-CA 3.3Å; D331-Y358 WeakPolarHBondContact OD2-CA 3.26Å; D331-Y358 WeakPolarHBondContact OD2-CB 3.35Å; D331-Y358 PolarHBondContact OD2-N 3.34Å; D331-Y358 VanDerWaalsContact OD2-N 3.12Å
332	L	98.9	Very high	98.5	Very high	55 Å²	55	48.4 Å²	48.4	29%	0.288	26%	0.256	S	S	.	.	H	α-helix	trans	-61	-37	172	-78.7	168.7	0	0	0	113	F276 L328 A329 L335 T336 Y358	F276-L332 HydrophobicContact CB-CD2 4.22Å; F276-L332 HydrophobicContact CD2-CD2 3.64Å; F276-L332 HydrophobicContact CE2-CD2 4.32Å; F276-L332 HydrophobicContact CG-CD2 4.06Å; L328-L332 HydrophobicContact CG-CD1 4.49Å; L328-L332 WeakPolarHBondContact O-CG 3.31Å; L328-L332 PolarHBondContact O-N 3.07Å; A329-L332 PolarHBondContact O-N 3.07Å; L332-L335 HydrophobicContact CD2-CD1 4.41Å; L332-T336 WeakPolarHBondContact O-CB 3.18Å; L332-T336 PolarHBondContact O-N 3.44Å; L332-T336 PolarHBondContact O-OG1 2.69Å; L332-Y358 HydrophobicContact CD2-CD2 4.03Å; L332-Y358 HydrophobicContact CD2-CE2 3.79Å; L332-Y358 HydrophobicContact CG-CD2 4.39Å; L332-Y358 HydrophobicContact CG-CE2 4.33Å
333	L	98.8	Very high	98.3	Very high	126 Å²	126	50.6 Å²	50.6	66%	0.66	27%	0.273	S	S	*	.	H	α-helix	trans	-67.3	-39.7	173.7	-67.6	173.4	0	0	0	111.5	A329 A330 D331 T336 W337	A329-L333 WeakPolarHBondContact O-CG 3.44Å; A329-L333 PolarHBondContact O-N 2.95Å; A330-L333 WeakPolarHBondContact O-CB 3.46Å; A330-L333 PolarHBondContact O-N 3.24Å; D331-L333 VanDerWaalsContact C-N 3.31Å; D331-L333 PolarHBondContact O-N 3.05Å; L333-T336 PolarHBondContact O-N 3.01Å; L333-W337 WeakPolarHBondContact O-CB 3.41Å; L333-W337 PolarHBondContact O-N 3.33Å
334	I	98.9	Very high	98.2	Very high	67 Å²	67	49.7 Å²	49.7	34%	0.344	27%	0.266	S	S	.	.	H	α-helix	trans	-63.4	-48.3	173.9	-68.1	167.6	0	0	0	110.3	A330 D331 T336 W337 I338 I350 A354	A330-I334 WeakPolarHBondContact O-CG1 3.39Å; A330-I334 PolarHBondContact O-N 3.07Å; D331-I334 CarbonylContact O-C 3.59Å; D331-I334 WeakPolarHBondContact O-CB 3.39Å; D331-I334 PolarHBondContact O-N 3Å; D331-I334 VanDerWaalsContact O-N 3.14Å; I334-T336 VanDerWaalsContact C-N 3.27Å; I334-T336 PolarHBondContact O-N 3.04Å; I334-W337 HydrophobicContact CG2-CE3 4.44Å; I334-W337 PolarHBondContact O-N 3.49Å; I334-I338 HydrophobicContact CG2-CG1 4.14Å; I334-I338 WeakPolarHBondContact O-CB 3.48Å; I334-I338 VanDerWaalsContact O-CG1 3.28Å; I334-I338 WeakPolarHBondContact O-CG1 3.21Å; I334-I338 PolarHBondContact O-N 3.13Å; I334-I350 HydrophobicContact CG2-CG2 3.99Å; I334-A354 HydrophobicContact CG2-CB 4.11Å
335	L	98.9	Very high	98.1	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-57.6	-41.4	176.3	-73.1	170.4	0	0	0	111.6	F276 T279 I280 D331 L332 G339 A354 Y358	F276-L335 HydrophobicContact CB-CB 3.92Å; T279-L335 WeakPolarHBondContact CB-O 3.49Å; T279-L335 HydrophobicContact CG2-CD2 3.52Å; T279-L335 PolarHBondContact OG1-O 3.44Å; I280-L335 HydrophobicContact CD1-CD1 4.06Å; I280-L335 HydrophobicContact CG1-CD1 4.22Å; I280-L335 HydrophobicContact CG1-CD2 4.13Å; D331-L335 WeakPolarHBondContact O-CB 3.38Å; D331-L335 WeakPolarHBondContact O-CG 3.33Å; D331-L335 PolarHBondContact O-N 3.14Å; L332-L335 HydrophobicContact CD2-CD1 4.41Å; L335-G339 PolarHBondContact O-N 2.84Å; L335-A354 HydrophobicContact CD2-CB 3.59Å; L335-A354 HydrophobicContact CG-CB 3.96Å; L335-Y358 HydrophobicContact CD1-CD2 4.26Å; L335-Y358 HydrophobicContact CD1-CG 4.31Å
336	T	98.8	Very high	98	Very high	35 Å²	35	59.4 Å²	59.4	22%	0.215	31%	0.31	C	S	.	.	H	α-helix	trans	-63.2	-48.1	175.7	-58.6	0	0	0	0	111.1	L275 L332 L333 I334 G339 G340	L275-T336 HydrophobicContact CB-CG2 4.09Å; L275-T336 WeakPolarHBondContact CB-O 3.4Å; L275-T336 HydrophobicContact CD1-CG2 4.36Å; L332-T336 WeakPolarHBondContact O-CB 3.18Å; L332-T336 PolarHBondContact O-N 3.44Å; L332-T336 PolarHBondContact O-OG1 2.69Å; L333-T336 PolarHBondContact O-N 3.01Å; I334-T336 VanDerWaalsContact C-N 3.27Å; I334-T336 PolarHBondContact O-N 3.04Å; T336-G339 PolarHBondContact O-N 3.33Å; T336-G340 PolarHBondContact O-N 2.91Å
337	W	98.7	Very high	98	Very high	130 Å²	130	54.7 Å²	54.7	49%	0.492	29%	0.293	S	S	.	.	H	α-helix	trans	-59.5	-49.1	177.5	166	58.3	0	0	0	112	L333 I334 G339 G340 Q341 F347	L333-W337 WeakPolarHBondContact O-CB 3.41Å; L333-W337 PolarHBondContact O-N 3.33Å; I334-W337 HydrophobicContact CG2-CE3 4.44Å; I334-W337 PolarHBondContact O-N 3.49Å; W337-G339 PolarHBondContact O-N 2.53Å; W337-G340 PolarHBondContact O-N 3.34Å; W337-G340 VanDerWaalsContact O-N 3.1Å; W337-Q341 WeakPolarHBondContact O-CG 3.25Å; W337-F347 HydrophobicContact CH2-CD1 4.38Å; W337-F347 HydrophobicContact CH2-CE1 4.04Å; W337-F347 HydrophobicContact CZ2-CD1 4.41Å; W337-F347 AromaticContact CZ2-CE1 3.77Å; W337-F347 HydrophobicContact CZ2-CE1 3.77Å
338	I	98.7	Very high	98	Very high	4 Å²	4	53.9 Å²	53.9	2%	0.021	29%	0.291	C	S	.	.	H	α-helix	trans	-62.2	-31.7	178.2	-65.6	-61.7	0	0	0	111.7	T279 R282 I334 G340 Q341 F347 I350	T279-I338 HydrophobicContact CG2-CB 4.04Å; T279-I338 HydrophobicContact CG2-CG2 3.62Å; R282-I338 PolarHBondContact NH2-O 3.06Å; I334-I338 HydrophobicContact CG2-CG1 4.14Å; I334-I338 WeakPolarHBondContact O-CB 3.48Å; I334-I338 VanDerWaalsContact O-CG1 3.28Å; I334-I338 WeakPolarHBondContact O-CG1 3.21Å; I334-I338 PolarHBondContact O-N 3.13Å; I338-G340 PolarHBondContact O-N 3.24Å; I338-Q341 WeakPolarHBondContact O-CB 3.17Å; I338-Q341 PolarHBondContact O-N 2.76Å; I338-F347 HydrophobicContact CD1-CB 4.25Å; I338-F347 HydrophobicContact CD1-CD1 3.73Å; I338-F347 HydrophobicContact CD1-CG 4.44Å; I338-I350 HydrophobicContact CD1-CB 3.88Å; I338-I350 HydrophobicContact CD1-CD1 4.36Å; I338-I350 HydrophobicContact CD1-CG2 3.66Å; I338-I350 HydrophobicContact CG1-CB 4.37Å; I338-I350 HydrophobicContact CG1-CG2 3.83Å
339	G	98.1	Very high	97.9	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-62.9	-31.3	177.8	0	0	0	0	0	112.1	T279 R282 L335 T336 W337 Q341	T279-G339 WeakPolarHBondContact OG1-CA 3.24Å; T279-G339 PolarHBondContact OG1-N 3.4Å; R282-G339 PolarHBondContact NH2-O 3.33Å; L335-G339 PolarHBondContact O-N 2.84Å; T336-G339 PolarHBondContact O-N 3.33Å; W337-G339 PolarHBondContact O-N 2.53Å; G339-Q341 VanDerWaalsContact C-N 3.33Å
340	G	97.1	Very high	97.9	Very high	20 Å²	20	58.6 Å²	58.6	21%	0.206	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-9.6	174.6	0	0	0	0	0	114.7	H267 T336 W337 I338	H267-G340 PolarHBondContact CE1-O 2.85Å; H267-G340 VanDerWaalsContact CE1-O 3.3Å; T336-G340 PolarHBondContact O-N 2.91Å; W337-G340 PolarHBondContact O-N 3.34Å; W337-G340 VanDerWaalsContact O-N 3.1Å; I338-G340 PolarHBondContact O-N 3.24Å
341	Q	97.9	Very high	97.9	Very high	51 Å²	51	56.4 Å²	56.4	24%	0.238	29%	0.293	C	S	.	.	S	Bend	trans	-93.3	153.4	-179.3	-57.6	-50	-44.8	0	0	112.4	H267 R282 W337 I338 G339 F347	H267-Q341 PolarHBondContact NE2-O 2.82Å; H267-Q341 VanDerWaalsContact NE2-O 3.16Å; R282-Q341 PolarHBondContact NH1-O 2.91Å; R282-Q341 PolarHBondContact NH2-O 3.11Å; R282-Q341 VanDerWaalsContact NH2-O 3.14Å; W337-Q341 WeakPolarHBondContact O-CG 3.25Å; I338-Q341 WeakPolarHBondContact O-CB 3.17Å; I338-Q341 PolarHBondContact O-N 2.76Å; G339-Q341 VanDerWaalsContact C-N 3.33Å; Q341-F347 HydrophobicContact CB-CB 4.1Å; Q341-F347 HydrophobicContact CB-CD1 3.93Å; Q341-F347 HydrophobicContact CB-CD2 3.69Å; Q341-F347 HydrophobicContact CB-CE1 4.26Å; Q341-F347 HydrophobicContact CB-CE2 4.02Å; Q341-F347 HydrophobicContact CB-CG 3.63Å; Q341-F347 HydrophobicContact CB-CZ 4.29Å; Q341-F347 HydrophobicContact CG-CD1 3.79Å; Q341-F347 HydrophobicContact CG-CD2 4.27Å; Q341-F347 HydrophobicContact CG-CE1 3.78Å; Q341-F347 HydrophobicContact CG-CE2 4.24Å; Q341-F347 HydrophobicContact CG-CG 4.04Å; Q341-F347 HydrophobicContact CG-CZ 4Å
342	P	95.9	Very high	97.9	Very high	58 Å²	58	59.5 Å²	59.5	38%	0.377	31%	0.307	S	S	.	.			trans	-63.9	158.1	173.9	28.2	-36.3	0	0	0	112.1	S344 F347	P342-S344 VanDerWaalsContact C-N 3.29Å; P342-S344 PolarHBondContact O-N 3.25Å; P342-F347 HydrophobicContact CG-CD2 4.31Å; P342-F347 HydrophobicContact CG-CE2 4.39Å
343	V	95.3	Very high	97.9	Very high	98 Å²	98	61.2 Å²	61.2	59%	0.594	32%	0.32	S	S	*	.	S	Bend	trans	-78.9	80.4	175.1	-171.4	0	0	0	0	109.4
344	S	96	Very high	97.9	Very high	51 Å²	51	55.5 Å²	55.5	36%	0.357	29%	0.291	S	S	.	.			trans	-145.6	165.6	177.7	61.9	0	0	0	0	111.3	P342 P346 F347 T348	P342-S344 VanDerWaalsContact C-N 3.29Å; P342-S344 PolarHBondContact O-N 3.25Å; S344-P346 CarbonylContact O-C 3.56Å; S344-F347 WeakPolarHBondContact O-CA 3.39Å; S344-F347 WeakPolarHBondContact O-CB 3.37Å; S344-F347 PolarHBondContact O-N 3.15Å; S344-T348 PolarHBondContact O-N 2.93Å; S344-T348 PolarHBondContact O-OG1 3.24Å
345	Y	96.1	Very high	97.9	Very high	202 Å²	202	52.8 Å²	52.8	79%	0.792	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	136.3	170	-178.8	-91.6	0	0	0	110.3	I349	Y345-I349 HydrophobicContact CD2-CG2 4.47Å; Y345-I349 HydrophobicContact CE2-CG2 4.33Å
346	P	97.4	Very high	97.9	Very high	53 Å²	53	57.2 Å²	57.2	34%	0.344	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	cis	-92.5	1.3	2.3	36.8	-35.7	0	0	0	114.7	S344 T348 I349 I350	S344-P346 CarbonylContact O-C 3.56Å; P346-T348 VanDerWaalsContact C-N 3.33Å; P346-T348 PolarHBondContact O-N 3.47Å; P346-I349 HydrophobicContact CB-CG2 4.48Å; P346-I349 WeakPolarHBondContact O-CG2 3.49Å; P346-I349 PolarHBondContact O-N 2.97Å; P346-I350 HydrophobicContact CB-CD1 4.21Å; P346-I350 HydrophobicContact CG-CD1 4.23Å; P346-I350 WeakPolarHBondContact O-CG1 3.27Å; P346-I350 PolarHBondContact O-N 3.11Å; P346-I350 VanDerWaalsContact O-N 3.16Å
347	F	98.4	Very high	97.9	Very high	43 Å²	43	58.1 Å²	58.1	19%	0.189	31%	0.308	C	S	.	.	H	α-helix	trans	-62.8	-35	-173.4	-56.4	-54.3	0	0	0	113.9	W337 I338 Q341 P342 S344 I349 I350 G351	W337-F347 HydrophobicContact CH2-CD1 4.38Å; W337-F347 HydrophobicContact CH2-CE1 4.04Å; W337-F347 HydrophobicContact CZ2-CD1 4.41Å; W337-F347 AromaticContact CZ2-CE1 3.77Å; W337-F347 HydrophobicContact CZ2-CE1 3.77Å; I338-F347 HydrophobicContact CD1-CB 4.25Å; I338-F347 HydrophobicContact CD1-CD1 3.73Å; I338-F347 HydrophobicContact CD1-CG 4.44Å; Q341-F347 HydrophobicContact CB-CB 4.1Å; Q341-F347 HydrophobicContact CB-CD1 3.93Å; Q341-F347 HydrophobicContact CB-CD2 3.69Å; Q341-F347 HydrophobicContact CB-CE1 4.26Å; Q341-F347 HydrophobicContact CB-CE2 4.02Å; Q341-F347 HydrophobicContact CB-CG 3.63Å; Q341-F347 HydrophobicContact CB-CZ 4.29Å; Q341-F347 HydrophobicContact CG-CD1 3.79Å; Q341-F347 HydrophobicContact CG-CD2 4.27Å; Q341-F347 HydrophobicContact CG-CE1 3.78Å; Q341-F347 HydrophobicContact CG-CE2 4.24Å; Q341-F347 HydrophobicContact CG-CG 4.04Å; Q341-F347 HydrophobicContact CG-CZ 4Å; P342-F347 HydrophobicContact CG-CD2 4.31Å; P342-F347 HydrophobicContact CG-CE2 4.39Å; S344-F347 WeakPolarHBondContact O-CA 3.39Å; S344-F347 WeakPolarHBondContact O-CB 3.37Å; S344-F347 PolarHBondContact O-N 3.15Å; F347-I349 PolarHBondContact O-N 3.47Å; F347-I350 PolarHBondContact O-N 3.47Å; F347-G351 PolarHBondContact O-N 3.03Å
348	T	97.9	Very high	97.9	Very high	54 Å²	54	52.4 Å²	52.4	33%	0.331	29%	0.287	S	S	.	.	H	α-helix	trans	-58.8	-48.5	176.8	-53.5	0	0	0	0	111.9	S344 P346 G351 Q352	S344-T348 PolarHBondContact O-N 2.93Å; S344-T348 PolarHBondContact O-OG1 3.24Å; P346-T348 VanDerWaalsContact C-N 3.33Å; P346-T348 PolarHBondContact O-N 3.47Å; T348-G351 PolarHBondContact O-N 2.97Å; T348-Q352 WeakPolarHBondContact O-CG 3.42Å; T348-Q352 PolarHBondContact O-N 3.4Å; T348-Q352 VanDerWaalsContact O-N 3.08Å
349	I	98.5	Very high	97.9	Very high	80 Å²	80	54.2 Å²	54.2	41%	0.41	29%	0.294	S	S	.	.	H	α-helix	trans	-72.1	-36.1	-178.3	-173.4	61.1	0	0	0	111.6	Y345 P346 F347 G351 Q352 V353	Y345-I349 HydrophobicContact CD2-CG2 4.47Å; Y345-I349 HydrophobicContact CE2-CG2 4.33Å; P346-I349 HydrophobicContact CB-CG2 4.48Å; P346-I349 WeakPolarHBondContact O-CG2 3.49Å; P346-I349 PolarHBondContact O-N 2.97Å; F347-I349 PolarHBondContact O-N 3.47Å; I349-G351 VanDerWaalsContact C-N 3.35Å; I349-G351 PolarHBondContact O-N 3.5Å; I349-Q352 PolarHBondContact O-N 2.83Å; I349-V353 HydrophobicContact CD1-CG2 4.32Å; I349-V353 HydrophobicContact CG1-CG2 4.42Å; I349-V353 WeakPolarHBondContact O-CG2 3.19Å; I349-V353 PolarHBondContact O-N 2.91Å
350	I	98.8	Very high	98	Very high	54 Å²	54	56.4 Å²	56.4	28%	0.277	31%	0.308	S	S	.	.	H	α-helix	trans	-62.1	-45.4	174.7	-61.5	165.4	0	0	0	110.1	I334 I338 P346 F347 Q352 V353 A354	I334-I350 HydrophobicContact CG2-CG2 3.99Å; I338-I350 HydrophobicContact CD1-CB 3.88Å; I338-I350 HydrophobicContact CD1-CD1 4.36Å; I338-I350 HydrophobicContact CD1-CG2 3.66Å; I338-I350 HydrophobicContact CG1-CB 4.37Å; I338-I350 HydrophobicContact CG1-CG2 3.83Å; P346-I350 HydrophobicContact CB-CD1 4.21Å; P346-I350 HydrophobicContact CG-CD1 4.23Å; P346-I350 WeakPolarHBondContact O-CG1 3.27Å; P346-I350 PolarHBondContact O-N 3.11Å; P346-I350 VanDerWaalsContact O-N 3.16Å; F347-I350 PolarHBondContact O-N 3.47Å; I350-Q352 VanDerWaalsContact C-N 3.34Å; I350-Q352 PolarHBondContact O-N 3.42Å; I350-V353 PolarHBondContact O-N 2.96Å; I350-A354 VanDerWaalsContact O-CB 3.27Å; I350-A354 WeakPolarHBondContact O-CB 3.43Å; I350-A354 PolarHBondContact O-N 3.28Å
351	G	98.7	Very high	98	Very high	1 Å²	1	55.4 Å²	55.4	1%	0.01	30%	0.298	C	S	.	.	H	α-helix	trans	-59.3	-43	176.8	0	0	0	0	0	112.8	S283 F347 T348 I349 S355	S283-G351 PolarHBondContact OG-O 3.2Å; S283-G351 VanDerWaalsContact OG-O 3.05Å; F347-G351 PolarHBondContact O-N 3.03Å; T348-G351 PolarHBondContact O-N 2.97Å; I349-G351 VanDerWaalsContact C-N 3.35Å; I349-G351 PolarHBondContact O-N 3.5Å; G351-S355 VanDerWaalsContact O-CB 3.32Å; G351-S355 WeakPolarHBondContact O-CB 3.21Å; G351-S355 PolarHBondContact O-N 2.97Å; G351-S355 PolarHBondContact O-OG 3.42Å
352	Q	98.8	Very high	98.1	Very high	67 Å²	67	53.3 Å²	53.3	31%	0.313	29%	0.288	S	S	.	.	H	α-helix	trans	-62.8	-48.8	176.7	-74.8	174	-22.9	0	0	112.3	S283 T348 I349 I350 S355 V356	S283-Q352 WeakPolarHBondContact O-CG 3.27Å; S283-Q352 PolarHBondContact O-NE2 3.39Å; S283-Q352 PolarHBondContact OG-N 3.02Å; T348-Q352 WeakPolarHBondContact O-CG 3.42Å; T348-Q352 PolarHBondContact O-N 3.4Å; T348-Q352 VanDerWaalsContact O-N 3.08Å; I349-Q352 PolarHBondContact O-N 2.83Å; I350-Q352 VanDerWaalsContact C-N 3.34Å; I350-Q352 PolarHBondContact O-N 3.42Å; Q352-S355 PolarHBondContact O-N 3.28Å; Q352-V356 WeakPolarHBondContact O-CG2 3.26Å; Q352-V356 PolarHBondContact O-N 2.94Å
353	V	98.8	Very high	98.2	Very high	92 Å²	92	54.3 Å²	54.3	56%	0.558	29%	0.29	S	S	*	.	H	α-helix	trans	-62.7	-45.6	178.9	172.5	0	0	0	0	110.9	I349 I350 S355 V356 L357	I349-V353 HydrophobicContact CD1-CG2 4.32Å; I349-V353 HydrophobicContact CG1-CG2 4.42Å; I349-V353 WeakPolarHBondContact O-CG2 3.19Å; I349-V353 PolarHBondContact O-N 2.91Å; I350-V353 PolarHBondContact O-N 2.96Å; V353-S355 VanDerWaalsContact C-N 3.35Å; V353-S355 PolarHBondContact O-N 3.46Å; V353-V356 PolarHBondContact O-N 3.48Å; V353-L357 WeakPolarHBondContact O-CB 3.21Å; V353-L357 PolarHBondContact O-N 2.85Å
354	A	98.9	Very high	98.4	Very high	5 Å²	5	54.3 Å²	54.3	4%	0.041	29%	0.285	C	S	.	.	H	α-helix	trans	-61.8	-41.7	176.5	0	0	0	0	0	111.7	D331 I334 L335 I350 V356 L357 Y358	D331-A354 VanDerWaalsContact OD1-CA 3.31Å; D331-A354 WeakPolarHBondContact OD1-CA 3.5Å; D331-A354 VanDerWaalsContact OD1-CB 3.32Å; D331-A354 WeakPolarHBondContact OD1-CB 3.39Å; D331-A354 VanDerWaalsContact OD2-O 3.08Å; I334-A354 HydrophobicContact CG2-CB 4.11Å; L335-A354 HydrophobicContact CD2-CB 3.59Å; L335-A354 HydrophobicContact CG-CB 3.96Å; I350-A354 VanDerWaalsContact O-CB 3.27Å; I350-A354 WeakPolarHBondContact O-CB 3.43Å; I350-A354 PolarHBondContact O-N 3.28Å; A354-V356 VanDerWaalsContact C-N 3.34Å; A354-V356 PolarHBondContact O-N 2.97Å; A354-L357 WeakPolarHBondContact O-CB 3.21Å; A354-L357 PolarHBondContact O-N 2.93Å; A354-L357 VanDerWaalsContact O-N 3.14Å; A354-Y358 PolarHBondContact O-N 3.4Å
355	S	98.8	Very high	98.5	Very high	10 Å²	10	54.5 Å²	54.5	7%	0.07	28%	0.282	C	S	.	.	H	α-helix	trans	-63.8	-40.1	177.8	-56.4	0	0	0	0	111.9	S283 G351 Q352 V353 F359	S283-S355 WeakPolarHBondContact CB-OG 3.45Å; S283-S355 PolarHBondContact OG-OG 3.24Å; G351-S355 VanDerWaalsContact O-CB 3.32Å; G351-S355 WeakPolarHBondContact O-CB 3.21Å; G351-S355 PolarHBondContact O-N 2.97Å; G351-S355 PolarHBondContact O-OG 3.42Å; Q352-S355 PolarHBondContact O-N 3.28Å; V353-S355 VanDerWaalsContact C-N 3.35Å; V353-S355 PolarHBondContact O-N 3.46Å; S355-F359 VanDerWaalsContact O-CD2 3.29Å; S355-F359 WeakPolarHBondContact O-CD2 3.49Å; S355-F359 PolarHBondContact O-N 2.67Å
356	V	98.8	Very high	98.6	Very high	94 Å²	94	46.2 Å²	46.2	57%	0.57	25%	0.251	S	S	*	.	H	α-helix	trans	-64.9	-43.2	173.2	171.3	0	0	0	0	110.6	Q352 V353 A354 Y358 F359 T360	Q352-V356 WeakPolarHBondContact O-CG2 3.26Å; Q352-V356 PolarHBondContact O-N 2.94Å; V353-V356 PolarHBondContact O-N 3.48Å; A354-V356 VanDerWaalsContact C-N 3.34Å; A354-V356 PolarHBondContact O-N 2.97Å; V356-Y358 PolarHBondContact O-N 2.75Å; V356-F359 PolarHBondContact O-N 2.94Å; V356-T360 WeakPolarHBondContact O-CB 3.32Å; V356-T360 PolarHBondContact O-N 3.01Å; V356-T360 PolarHBondContact O-OG1 3.24Å
357	L	98.8	Very high	98.6	Very high	53 Å²	53	44.5 Å²	44.5	28%	0.277	24%	0.24	S	C	.	.	H	α-helix	trans	-61.6	-42.7	179	-176	60.4	0	0	0	111.8	L327 D331 V353 A354 T360 T361	L327-L357 HydrophobicContact CD1-CD2 4.24Å; L327-L357 HydrophobicContact CD2-CD1 4.32Å; L327-L357 HydrophobicContact CG-CD2 4.49Å; D331-L357 HydrophobicContact CB-CD2 4.25Å; V353-L357 WeakPolarHBondContact O-CB 3.21Å; V353-L357 PolarHBondContact O-N 2.85Å; A354-L357 WeakPolarHBondContact O-CB 3.21Å; A354-L357 PolarHBondContact O-N 2.93Å; A354-L357 VanDerWaalsContact O-N 3.14Å; L357-T360 PolarHBondContact O-N 3.29Å; L357-T361 VanDerWaalsContact O-CB 3.22Å; L357-T361 WeakPolarHBondContact O-CB 3.29Å; L357-T361 PolarHBondContact O-N 2.94Å; L357-T361 PolarHBondContact O-OG1 2.88Å
358	Y	98.9	Very high	98.7	Very high	11 Å²	11	45.4 Å²	45.4	4%	0.043	25%	0.249	C	C	.	.	H	α-helix	trans	-53	-58.5	175.9	175.5	-96.9	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 4.29Å; I280-Y358 HydrophobicContact CD1-CG 4.25Å; S297-Y358 PolarHBondContact O-OH 3.23Å; I300-Y358 HydrophobicContact CG2-CE1 4.17Å; I300-Y358 VanDerWaalsContact CG2-OH 3.26Å; I300-Y358 WeakPolarHBondContact CG2-OH 3.46Å; L328-Y358 HydrophobicContact CD1-CD2 3.65Å; L328-Y358 HydrophobicContact CD1-CE2 3.95Å; D331-Y358 VanDerWaalsContact OD2-CA 3.3Å; D331-Y358 WeakPolarHBondContact OD2-CA 3.26Å; D331-Y358 WeakPolarHBondContact OD2-CB 3.35Å; D331-Y358 PolarHBondContact OD2-N 3.34Å; D331-Y358 VanDerWaalsContact OD2-N 3.12Å; L332-Y358 HydrophobicContact CD2-CD2 4.03Å; L332-Y358 HydrophobicContact CD2-CE2 3.79Å; L332-Y358 HydrophobicContact CG-CD2 4.39Å; L332-Y358 HydrophobicContact CG-CE2 4.33Å; L335-Y358 HydrophobicContact CD1-CD2 4.26Å; L335-Y358 HydrophobicContact CD1-CG 4.31Å; A354-Y358 PolarHBondContact O-N 3.4Å; V356-Y358 PolarHBondContact O-N 2.75Å; Y358-T361 PolarHBondContact O-N 3.34Å; Y358-I362 HydrophobicContact CD1-CD1 4.44Å; Y358-I362 HydrophobicContact CD2-CD1 4.21Å; Y358-I362 HydrophobicContact CE1-CD1 3.9Å; Y358-I362 HydrophobicContact CE2-CD1 3.66Å; Y358-I362 VanDerWaalsContact CZ-CD1 3.47Å; Y358-I362 PolarHBondContact O-N 2.86Å
359	F	98.8	Very high	98.7	Very high	42 Å²	42	44.4 Å²	44.4	18%	0.184	24%	0.241	C	C	.	.	H	α-helix	trans	-67.8	-39.9	-178.5	-74.3	-70.9	0	0	0	112	I280 L296 I300 S355 V356 T361 I362 L363	I280-F359 HydrophobicContact CG2-CE2 3.85Å; I280-F359 HydrophobicContact CG2-CZ 4.32Å; L296-F359 HydrophobicContact CB-CE1 4.13Å; L296-F359 HydrophobicContact CB-CZ 4.25Å; I300-F359 HydrophobicContact CD1-CD1 3.78Å; I300-F359 HydrophobicContact CD1-CE1 4.16Å; S355-F359 VanDerWaalsContact O-CD2 3.29Å; S355-F359 WeakPolarHBondContact O-CD2 3.49Å; S355-F359 PolarHBondContact O-N 2.67Å; V356-F359 PolarHBondContact O-N 2.94Å; F359-T361 VanDerWaalsContact C-N 3.33Å; F359-T361 PolarHBondContact O-N 2.94Å; F359-I362 PolarHBondContact O-N 2.74Å; F359-L363 HydrophobicContact CB-CD1 4.41Å; F359-L363 HydrophobicContact CD1-CD1 4.4Å; F359-L363 VanDerWaalsContact O-CB 3.28Å; F359-L363 WeakPolarHBondContact O-CB 3.4Å; F359-L363 WeakPolarHBondContact O-CG 3.4Å; F359-L363 PolarHBondContact O-N 3.11Å
360	T	98.8	Very high	98.7	Very high	45 Å²	45	40.9 Å²	40.9	28%	0.276	22%	0.223	S	C	.	.	H	α-helix	trans	-64.2	-40.5	179.2	-58.1	0	0	0	0	111.3	V356 L357 I364 L365	V356-T360 WeakPolarHBondContact O-CB 3.32Å; V356-T360 PolarHBondContact O-N 3.01Å; V356-T360 PolarHBondContact O-OG1 3.24Å; L357-T360 PolarHBondContact O-N 3.29Å; T360-I364 HydrophobicContact CG2-CB 4.43Å; T360-I364 HydrophobicContact CG2-CD1 4.4Å; T360-I364 WeakPolarHBondContact O-CA 3.31Å; T360-I364 WeakPolarHBondContact O-CB 3.37Å; T360-I364 PolarHBondContact O-N 2.79Å; T360-L365 HydrophobicContact CG2-CD1 4.36Å; T360-L365 HydrophobicContact CG2-CG 4.15Å; T360-L365 PolarHBondContact O-N 3.36Å
361	T	98.8	Very high	98.6	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.231	C	C	.	.	I	π-helix	trans	-62.3	-47.3	179.1	-59.9	0	0	0	0	110.9	L328 L357 Y358 F359 L365 M366	L328-T361 HydrophobicContact CB-CG2 4.11Å; L357-T361 VanDerWaalsContact O-CB 3.22Å; L357-T361 WeakPolarHBondContact O-CB 3.29Å; L357-T361 PolarHBondContact O-N 2.94Å; L357-T361 PolarHBondContact O-OG1 2.88Å; Y358-T361 PolarHBondContact O-N 3.34Å; F359-T361 VanDerWaalsContact C-N 3.33Å; F359-T361 PolarHBondContact O-N 2.94Å; T361-L365 PolarHBondContact O-N 2.89Å; T361-M366 HydrophobicContact CG2-CE 4.2Å; T361-M366 HydrophobicContact CG2-CG 4.39Å; T361-M366 WeakPolarHBondContact O-CB 3.38Å; T361-M366 WeakPolarHBondContact O-CG 3.28Å; T361-M366 PolarHBondContact O-N 3.43Å
362	I	98.7	Very high	98.6	Very high	6 Å²	6	46 Å²	46	3%	0.031	25%	0.25	C	S	.	.	I	π-helix	trans	-74	-49.3	-177.1	-63.5	168	0	0	0	112	I300 I304 L307 L328 Y358 F359 P367	I300-I362 HydrophobicContact CD1-CB 3.82Å; I300-I362 HydrophobicContact CD1-CD1 4.04Å; I300-I362 HydrophobicContact CD1-CG2 3.53Å; I300-I362 HydrophobicContact CG1-CG2 3.78Å; I300-I362 HydrophobicContact CG2-CD1 4.32Å; I304-I362 HydrophobicContact CD1-CG2 3.45Å; I304-I362 VanDerWaalsContact CD1-CG2 3.45Å; L307-I362 HydrophobicContact CD1-CG2 4.12Å; L328-I362 HydrophobicContact CD1-CD1 4.08Å; L328-I362 HydrophobicContact CD1-CG1 4.09Å; L328-I362 HydrophobicContact CD2-CD1 4.23Å; L328-I362 HydrophobicContact CD2-CG1 3.93Å; Y358-I362 HydrophobicContact CD1-CD1 4.44Å; Y358-I362 HydrophobicContact CD2-CD1 4.21Å; Y358-I362 HydrophobicContact CE1-CD1 3.9Å; Y358-I362 HydrophobicContact CE2-CD1 3.66Å; Y358-I362 VanDerWaalsContact CZ-CD1 3.47Å; Y358-I362 PolarHBondContact O-N 2.86Å; F359-I362 PolarHBondContact O-N 2.74Å; I362-P367 WeakPolarHBondContact O-CD 3.26Å
363	L	98.6	Very high	98.6	Very high	80 Å²	80	43.3 Å²	43.3	42%	0.419	24%	0.238	S	C	.	.	I	π-helix	trans	-80.9	-29.1	-170.8	-62.4	176.7	0	0	0	113.3	I300 L307 F359	I300-L363 HydrophobicContact CD1-CD1 4.37Å; I300-L363 HydrophobicContact CD1-CD2 3.69Å; I300-L363 HydrophobicContact CD1-CG 3.83Å; I300-L363 HydrophobicContact CG1-CD2 4.12Å; L307-L363 HydrophobicContact CD1-CD2 3.88Å; F359-L363 HydrophobicContact CB-CD1 4.41Å; F359-L363 HydrophobicContact CD1-CD1 4.4Å; F359-L363 VanDerWaalsContact O-CB 3.28Å; F359-L363 WeakPolarHBondContact O-CB 3.4Å; F359-L363 WeakPolarHBondContact O-CG 3.4Å; F359-L363 PolarHBondContact O-N 3.11Å
364	I	98.6	Very high	98.6	Very high	97 Å²	97	39.4 Å²	39.4	50%	0.497	21%	0.213	S	C	.	.	I	π-helix	trans	-120.2	-58.7	-169.7	-57.2	174.6	0	0	0	111.1	T360 P367 T368	T360-I364 HydrophobicContact CG2-CB 4.43Å; T360-I364 HydrophobicContact CG2-CD1 4.4Å; T360-I364 WeakPolarHBondContact O-CA 3.31Å; T360-I364 WeakPolarHBondContact O-CB 3.37Å; T360-I364 PolarHBondContact O-N 2.79Å; I364-P367 WeakPolarHBondContact O-CD 3.27Å; I364-T368 WeakPolarHBondContact O-CB 3.23Å; I364-T368 WeakPolarHBondContact O-CG2 3.05Å; I364-T368 PolarHBondContact O-N 3.04Å; I364-T368 VanDerWaalsContact O-N 3.1Å; I364-T368 PolarHBondContact O-OG1 3.43Å
365	L	98.6	Very high	98.5	Very high	56 Å²	56	46.9 Å²	46.9	29%	0.293	25%	0.245	S	C	.	.	I	π-helix	trans	-68.4	-45.6	-170.2	-58.6	178	0	0	0	112.4	L324 T360 T361 T368 I369	L324-L365 HydrophobicContact CD1-CB 3.75Å; L324-L365 HydrophobicContact CD2-CB 4.21Å; L324-L365 HydrophobicContact CD2-CD1 4.24Å; T360-L365 HydrophobicContact CG2-CD1 4.36Å; T360-L365 HydrophobicContact CG2-CG 4.15Å; T360-L365 PolarHBondContact O-N 3.36Å; T361-L365 PolarHBondContact O-N 2.89Å; L365-T368 WeakPolarHBondContact CA-OG1 3.43Å; L365-T368 PolarHBondContact O-N 3.4Å; L365-T368 PolarHBondContact O-OG1 3.4Å; L365-I369 VanDerWaalsContact O-CB 3.3Å; L365-I369 WeakPolarHBondContact O-CB 3.42Å; L365-I369 WeakPolarHBondContact O-CG1 3.3Å; L365-I369 PolarHBondContact O-N 2.78Å
366	M	98.4	Very high	98.5	Very high	28 Å²	28	52.7 Å²	52.7	14%	0.138	27%	0.272	C	S	.	.	H	α-helix	trans	-62.1	-48.3	-180	-78.7	-174.9	175.4	0	0	112.8	L324 L328 T361 S370	L324-M366 HydrophobicContact CB-CE 4.42Å; L324-M366 HydrophobicContact CB-CG 4.31Å; L324-M366 HydrophobicContact CD1-CG 4.14Å; L328-M366 HydrophobicContact CB-CE 4.27Å; L328-M366 HydrophobicContact CD2-CE 3.8Å; T361-M366 HydrophobicContact CG2-CE 4.2Å; T361-M366 HydrophobicContact CG2-CG 4.39Å; T361-M366 WeakPolarHBondContact O-CB 3.38Å; T361-M366 WeakPolarHBondContact O-CG 3.28Å; T361-M366 PolarHBondContact O-N 3.43Å; M366-S370 WeakPolarHBondContact O-CB 3.47Å; M366-S370 PolarHBondContact O-N 2.77Å; M366-S370 PolarHBondContact O-OG 3.5Å
367	P	98.4	Very high	98.4	Very high	16 Å²	16	52.3 Å²	52.3	10%	0.104	27%	0.267	C	S	.	.	H	α-helix	trans	-62.2	-42.8	175.1	-25.7	35.2	0	0	0	113.3	L307 M309 I362 I364 S370 L371	L307-P367 HydrophobicContact CB-CG 4.15Å; L307-P367 HydrophobicContact CD2-CG 4.35Å; M309-P367 HydrophobicContact CG-CB 4.07Å; I362-P367 WeakPolarHBondContact O-CD 3.26Å; I364-P367 WeakPolarHBondContact O-CD 3.27Å; P367-S370 WeakPolarHBondContact O-CB 3.09Å; P367-S370 PolarHBondContact O-N 3.47Å; P367-L371 WeakPolarHBondContact O-CG 3.37Å; P367-L371 PolarHBondContact O-N 3.26Å; P367-L371 VanDerWaalsContact O-N 3.13Å
368	T	98.5	Very high	98.3	Very high	62 Å²	62	59.1 Å²	59.1	38%	0.38	29%	0.294	S	S	.	.	H	α-helix	trans	-66.7	-44.4	-179.8	47.3	0	0	0	0	112.4	I364 L365 S370 L371 I372	I364-T368 WeakPolarHBondContact O-CB 3.23Å; I364-T368 WeakPolarHBondContact O-CG2 3.05Å; I364-T368 PolarHBondContact O-N 3.04Å; I364-T368 VanDerWaalsContact O-N 3.1Å; I364-T368 PolarHBondContact O-OG1 3.43Å; L365-T368 WeakPolarHBondContact CA-OG1 3.43Å; L365-T368 PolarHBondContact O-N 3.4Å; L365-T368 PolarHBondContact O-OG1 3.4Å; T368-S370 VanDerWaalsContact C-N 3.3Å; T368-S370 PolarHBondContact O-N 3.16Å; T368-L371 PolarHBondContact O-N 2.76Å; T368-I372 WeakPolarHBondContact O-CG1 3.44Å; T368-I372 PolarHBondContact O-N 3.2Å
369	I	98.3	Very high	98	Very high	34 Å²	34	63.6 Å²	63.6	17%	0.174	31%	0.311	C	S	.	.	H	α-helix	trans	-62.5	-38.4	174.5	-72.8	-60.6	0	0	0	111.3	L320 L324 L365 L371 I372 E373	L320-I369 HydrophobicContact CB-CD1 4.47Å; L320-I369 HydrophobicContact CB-CG2 3.42Å; L320-I369 VanDerWaalsContact CB-CG2 3.42Å; L320-I369 HydrophobicContact CD1-CD1 4.37Å; L320-I369 HydrophobicContact CD1-CG2 4.46Å; L324-I369 HydrophobicContact CD1-CB 3.86Å; L324-I369 HydrophobicContact CD1-CG1 3.53Å; L324-I369 HydrophobicContact CD1-CG2 4.32Å; L324-I369 HydrophobicContact CG-CG1 4.41Å; L365-I369 VanDerWaalsContact O-CB 3.3Å; L365-I369 WeakPolarHBondContact O-CB 3.42Å; L365-I369 WeakPolarHBondContact O-CG1 3.3Å; L365-I369 PolarHBondContact O-N 2.78Å; I369-L371 VanDerWaalsContact C-N 3.3Å; I369-L371 PolarHBondContact O-N 2.89Å; I369-I372 HydrophobicContact CD1-CD1 4.07Å; I369-I372 PolarHBondContact O-N 2.56Å; I369-I372 VanDerWaalsContact O-N 3.14Å; I369-E373 HydrophobicContact CG2-CG 4.23Å; I369-E373 WeakPolarHBondContact O-CG 3.38Å; I369-E373 PolarHBondContact O-N 3.21Å
370	S	98	Very high	96.6	Very high	5 Å²	5	68.6 Å²	68.6	4%	0.035	36%	0.36	C	S	.	.	H	α-helix	trans	-57	-43.7	174.3	-58	0	0	0	0	112	R318 M366 P367 T368 N374	R318-S370 PolarHBondContact NH2-OG 3.25Å; M366-S370 WeakPolarHBondContact O-CB 3.47Å; M366-S370 PolarHBondContact O-N 2.77Å; M366-S370 PolarHBondContact O-OG 3.5Å; P367-S370 WeakPolarHBondContact O-CB 3.09Å; P367-S370 PolarHBondContact O-N 3.47Å; T368-S370 VanDerWaalsContact C-N 3.3Å; T368-S370 PolarHBondContact O-N 3.16Å; S370-N374 PolarHBondContact O-N 3.05Å; S370-N374 PolarHBondContact O-ND2 3.13Å; S370-N374 PolarHBondContact O-OD1 2.73Å
371	L	98.3	Very high	96.5	Very high	84 Å²	84	69.8 Å²	69.8	44%	0.44	36%	0.364	S	S	.	.	H	α-helix	trans	-67.4	-37.1	176.5	-68.2	172.5	0	0	0	112.6	M309 P367 T368 I369 K375	M309-L371 HydrophobicContact CB-CD2 3.83Å; M309-L371 HydrophobicContact CB-CG 3.88Å; M309-L371 HydrophobicContact CG-CD2 4.47Å; M309-L371 HydrophobicContact CG-CG 4.39Å; P367-L371 WeakPolarHBondContact O-CG 3.37Å; P367-L371 PolarHBondContact O-N 3.26Å; P367-L371 VanDerWaalsContact O-N 3.13Å; T368-L371 PolarHBondContact O-N 2.76Å; I369-L371 VanDerWaalsContact C-N 3.3Å; I369-L371 PolarHBondContact O-N 2.89Å; L371-K375 WeakPolarHBondContact O-CG 3.41Å; L371-K375 PolarHBondContact O-N 3.13Å; L371-K375 VanDerWaalsContact O-N 3.13Å
372	I	98.3	Very high	96.4	Very high	80 Å²	80	73.4 Å²	73.4	41%	0.41	38%	0.384	S	S	.	.	H	α-helix	trans	-64.6	-47.5	175.9	-70.1	163.3	0	0	0	110.3	L320 T368 I369 N374 K375 M376	L320-I372 HydrophobicContact CD1-CG2 4.39Å; T368-I372 WeakPolarHBondContact O-CG1 3.44Å; T368-I372 PolarHBondContact O-N 3.2Å; I369-I372 HydrophobicContact CD1-CD1 4.07Å; I369-I372 PolarHBondContact O-N 2.56Å; I369-I372 VanDerWaalsContact O-N 3.14Å; I372-N374 VanDerWaalsContact C-N 3.33Å; I372-N374 PolarHBondContact O-N 2.92Å; I372-K375 PolarHBondContact O-N 3.11Å; I372-K375 VanDerWaalsContact O-N 3.11Å; I372-M376 HydrophobicContact CG2-CG 4.36Å; I372-M376 HydrophobicContact CG2-SD 3.97Å; I372-M376 WeakPolarHBondContact O-CG 3.37Å; I372-M376 PolarHBondContact O-N 3.36Å
373	E	98.4	Very high	96.3	Very high	10 Å²	10	77.2 Å²	77.2	5%	0.047	40%	0.403	C	S	.	.	H	α-helix	trans	-60	-41.9	177.7	-72.9	176.8	146.9	0	0	111.6	R318 L320 S321 I369 K375 M376 L377	R318-E373 WeakPolarHBondContact CA-OE1 3.49Å; R318-E373 WeakPolarHBondContact CB-OE1 3.21Å; R318-E373 WeakPolarHBondContact CB-OE2 3.07Å; R318-E373 IonicContact CZ-OE2 3.39Å; R318-E373 IonicContact NE-OE2 3.01Å; R318-E373 PolarHBondContact NE-OE2 3.32Å; R318-E373 IonicContact NH2-OE2 2.84Å; R318-E373 PolarHBondContact NH2-OE2 3.33Å; L320-E373 HydrophobicContact CB-CG 4.25Å; L320-E373 WeakPolarHBondContact CB-OE1 3.4Å; L320-E373 HydrophobicContact CD1-CG 4.21Å; L320-E373 PolarHBondContact N-OE1 3.03Å; S321-E373 PolarHBondContact N-OE1 3.24Å; S321-E373 PolarHBondContact OG-OE1 3.42Å; S321-E373 PolarHBondContact OG-OE2 3.37Å; I369-E373 HydrophobicContact CG2-CG 4.23Å; I369-E373 WeakPolarHBondContact O-CG 3.38Å; I369-E373 PolarHBondContact O-N 3.21Å; E373-K375 VanDerWaalsContact C-N 3.33Å; E373-K375 PolarHBondContact O-N 3.27Å; E373-M376 PolarHBondContact O-N 2.85Å; E373-L377 WeakPolarHBondContact O-CG 3.35Å; E373-L377 PolarHBondContact O-N 3.1Å; E373-L377 VanDerWaalsContact O-N 3.09Å
374	N	98.4	Very high	96.2	Very high	9 Å²	9	77 Å²	77	5%	0.048	40%	0.402	C	S	.	.	H	α-helix	trans	-56.7	-46.9	173.1	-68.7	-20.5	0	0	0	111.6	M309 K311 S370 I372 L377 K378 W379	M309-N374 PolarHBondContact O-ND2 2.82Å; K311-N374 PolarHBondContact N-OD1 2.93Å; S370-N374 PolarHBondContact O-N 3.05Å; S370-N374 PolarHBondContact O-ND2 3.13Å; S370-N374 PolarHBondContact O-OD1 2.73Å; I372-N374 VanDerWaalsContact C-N 3.33Å; I372-N374 PolarHBondContact O-N 2.92Å; N374-L377 CarbonylContact O-C 3.52Å; N374-L377 PolarHBondContact O-N 2.83Å; N374-K378 PolarHBondContact O-N 3.41Å; N374-W379 HydrophobicContact CB-CB 4.34Å; N374-W379 PolarHBondContact O-N 3.14Å
375	K	97.8	Very high	96	Very high	163 Å²	163	75.8 Å²	75.8	71%	0.709	40%	0.396	S	S	*	.	H	α-helix	trans	-65.4	-38.6	178.9	-73.1	-179.3	179.9	-177.5	0	112.4	L371 I372 E373 L377 K378	L371-K375 WeakPolarHBondContact O-CG 3.41Å; L371-K375 PolarHBondContact O-N 3.13Å; L371-K375 VanDerWaalsContact O-N 3.13Å; I372-K375 PolarHBondContact O-N 3.11Å; I372-K375 VanDerWaalsContact O-N 3.11Å; E373-K375 VanDerWaalsContact C-N 3.33Å; E373-K375 PolarHBondContact O-N 3.27Å; K375-L377 PolarHBondContact O-N 3.15Å; K375-K378 PolarHBondContact O-N 3.28Å
376	M	97.8	Very high	95.8	Very high	131 Å²	131	77.1 Å²	77.1	65%	0.645	40%	0.403	S	S	*	.	H	α-helix	trans	-60.1	-34.1	174.9	-70.5	172.6	65.3	0	0	111.8	L320 I372 E373 K378	L320-M376 HydrophobicContact CD1-SD 4.05Å; I372-M376 HydrophobicContact CG2-CG 4.36Å; I372-M376 HydrophobicContact CG2-SD 3.97Å; I372-M376 WeakPolarHBondContact O-CG 3.37Å; I372-M376 PolarHBondContact O-N 3.36Å; E373-M376 PolarHBondContact O-N 2.85Å; M376-K378 VanDerWaalsContact C-N 3.28Å
377	L	97.8	Very high	95.7	Very high	87 Å²	87	80.6 Å²	80.6	46%	0.455	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	5	175.1	-64.1	176.5	0	0	0	113.8	E373 N374 K375 W379	E373-L377 WeakPolarHBondContact O-CG 3.35Å; E373-L377 PolarHBondContact O-N 3.1Å; E373-L377 VanDerWaalsContact O-N 3.09Å; N374-L377 CarbonylContact O-C 3.52Å; N374-L377 PolarHBondContact O-N 2.83Å; K375-L377 PolarHBondContact O-N 3.15Å; L377-W379 HydrophobicContact CB-CD2 4.17Å; L377-W379 HydrophobicContact CB-CE3 4.21Å; L377-W379 HydrophobicContact CD1-CE3 3.92Å; L377-W379 HydrophobicContact CD1-CH2 3.85Å; L377-W379 HydrophobicContact CD1-CZ2 4.45Å; L377-W379 HydrophobicContact CD1-CZ3 3.56Å; L377-W379 PolarHBondContact O-N 3.3Å
378	K	96.4	Very high	95.4	Very high	195 Å²	195	85.5 Å²	85.5	85%	0.848	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.5	32.1	-176.3	-53.6	177.3	-178.8	176.9	0	113.1	N374 K375 M376	N374-K378 PolarHBondContact O-N 3.41Å; K375-K378 PolarHBondContact O-N 3.28Å; M376-K378 VanDerWaalsContact C-N 3.28Å
379	W	92.9	Very high	95.2	Very high	105 Å²	105	87.5 Å²	87.5	40%	0.398	45%	0.452	S	S	.	.			trans	-80.4	135.3	169.5	-74.7	-24.8	0	0	0	111.1	K311 Q312 N374 L377	K311-W379 HydrophobicContact CB-CD2 4.01Å; K311-W379 HydrophobicContact CB-CE3 3.46Å; K311-W379 VanDerWaalsContact CB-CE3 3.46Å; K311-W379 HydrophobicContact CB-CH2 4.48Å; K311-W379 HydrophobicContact CB-CZ3 3.72Å; K311-W379 HydrophobicContact CG-CB 4.23Å; K311-W379 HydrophobicContact CG-CD2 4.24Å; K311-W379 HydrophobicContact CG-CE3 3.9Å; K311-W379 HydrophobicContact CG-CG 4.44Å; Q312-W379 HydrophobicContact CB-CZ3 4.38Å; Q312-W379 VanDerWaalsContact CD-CH2 3.46Å; Q312-W379 HydrophobicContact CG-CH2 3.38Å; Q312-W379 HydrophobicContact CG-CZ3 3.57Å; N374-W379 HydrophobicContact CB-CB 4.34Å; N374-W379 PolarHBondContact O-N 3.14Å; L377-W379 HydrophobicContact CB-CD2 4.17Å; L377-W379 HydrophobicContact CB-CE3 4.21Å; L377-W379 HydrophobicContact CD1-CE3 3.92Å; L377-W379 HydrophobicContact CD1-CH2 3.85Å; L377-W379 HydrophobicContact CD1-CZ2 4.45Å; L377-W379 HydrophobicContact CD1-CZ3 3.56Å; L377-W379 PolarHBondContact O-N 3.3Å
380	A	69.8	Low	94.9	Very high	147 Å²	147	92.4 Å²	92.4	100%	1.215	48%	0.477	S	S	*	.			trans	-72.2	0	-179.7	0	0	0	0	0	112.9	K311	K311-A380 VanDerWaalsContact CE-O 3.27Å; K311-A380 WeakPolarHBondContact CE-O 3.46Å; K311-A380 PolarHBondContact NZ-O 3.33Å

Retrieved 380 of 380 residues in 201.7 ms (Link to these results)

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