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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 A0A023NE78, Species MOUSE (Mus musculus, Mouse), Gene cytB, Length 226 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	I	88.3	Confident	93.5	Very high	157 Å²	157	74.8 Å²	74.8	81%	0.805	39%	0.392	S	S	*	.				0	-69.8	0	-57.2	-179.1	0	0	0	110.1	H3 S4 F5 I6	I1-H3 PolarHBondContact O-N 3.01Å; I1-S4 PolarHBondContact N-OG 2.92Å; I1-S4 PolarHBondContact O-N 3.5Å; I1-S4 PolarHBondContact O-OG 2.74Å; I1-F5 WeakPolarHBondContact O-CB 3.44Å; I1-F5 PolarHBondContact O-N 3.32Å; I1-I6 HydrophobicContact CG2-CD1 4.35Å
2	N	91.8	Very high	93.9	Very high	89 Å²	89	72.2 Å²	72.2	48%	0.476	38%	0.384	S	S	.	.	I	π-helix	trans	-56.6	-57.4	-176.7	-67.6	13.8	0	0	0	113.3	S4 F5 I6 D7	N2-S4 PolarHBondContact O-N 3.45Å; N2-F5 PolarHBondContact O-N 3.27Å; N2-I6 PolarHBondContact O-N 2.96Å; N2-D7 PolarHBondContact O-N 3.36Å
3	H	90.7	Very high	94.2	Very high	165 Å²	165	71.3 Å²	71.3	76%	0.764	38%	0.38	S	S	*	.	I	π-helix	trans	-66.9	-20.1	-178.1	-60.9	-63.8	0	0	0	115.2	I1	I1-H3 PolarHBondContact O-N 3.01Å
4	S	87.1	Confident	94.5	Very high	52 Å²	52	67.4 Å²	67.4	36%	0.364	36%	0.359	S	S	.	.	I	π-helix	trans	-105.5	-4.4	-173.7	63.5	0	0	0	0	113.4	I1 N2	I1-S4 PolarHBondContact N-OG 2.92Å; I1-S4 PolarHBondContact O-N 3.5Å; I1-S4 PolarHBondContact O-OG 2.74Å; N2-S4 PolarHBondContact O-N 3.45Å
5	F	90.6	Very high	94.7	Very high	107 Å²	107	65.3 Å²	65.3	47%	0.469	35%	0.352	S	S	.	.	I	π-helix	trans	-154.3	-41.8	-171.4	-168.7	-98.6	0	0	0	114.4	I1 N2 F207 T212	I1-F5 WeakPolarHBondContact O-CB 3.44Å; I1-F5 PolarHBondContact O-N 3.32Å; N2-F5 PolarHBondContact O-N 3.27Å; F5-F207 HydrophobicContact CD2-CD1 4.46Å; F5-F207 HydrophobicContact CD2-CE1 4.16Å; F5-F207 HydrophobicContact CE2-CD1 4.48Å; F5-F207 AromaticContact CE2-CE1 3.86Å; F5-F207 HydrophobicContact CE2-CE1 3.86Å; F5-F207 HydrophobicContact CZ-CE1 4.27Å; F5-F207 WeakPolarHBondContact O-CB 3.47Å; F5-F207 WeakPolarHBondContact O-CD1 3.5Å; F5-T212 HydrophobicContact CD1-CG2 4.42Å; F5-T212 HydrophobicContact CE1-CG2 3.63Å; F5-T212 HydrophobicContact CZ-CG2 3.74Å
6	I	94.8	Very high	95	Very high	56 Å²	56	66.8 Å²	66.8	29%	0.287	37%	0.368	S	S	.	.	I	π-helix	trans	-87.1	-62	-176.1	-56.3	-178.5	0	0	0	109.6	I1 N2 L8 F207 H208	I1-I6 HydrophobicContact CG2-CD1 4.35Å; N2-I6 PolarHBondContact O-N 2.96Å; I6-L8 VanDerWaalsContact C-N 3.32Å; I6-L8 PolarHBondContact O-N 3.28Å; I6-F207 PolarHBondContact O-N 3.48Å; I6-H208 HydrophobicContact CG2-CB 4.07Å; I6-H208 PolarHBondContact O-N 3Å
7	D	95.4	Very high	95.2	Very high	91 Å²	91	69.4 Å²	69.4	49%	0.487	37%	0.371	S	S	.	.	S	Bend	trans	-93.9	8.4	-173.7	-54.3	-42.1	0	0	0	112.3	N2 P9	N2-D7 PolarHBondContact O-N 3.36Å; D7-P9 WeakPolarHBondContact O-CD 3.26Å
8	L	96.6	Very high	95.4	Very high	29 Å²	29	66.9 Å²	66.9	15%	0.152	36%	0.356	C	S	.	.			trans	-59.4	118.8	-179.3	176.5	67.1	0	0	0	109.6	I6 A10 F207	I6-L8 VanDerWaalsContact C-N 3.32Å; I6-L8 PolarHBondContact O-N 3.28Å; L8-A10 PolarHBondContact O-N 3.4Å; L8-F207 HydrophobicContact CB-CB 3.95Å; L8-F207 HydrophobicContact CD2-CD2 4.25Å; L8-F207 WeakPolarHBondContact O-CB 3.44Å; L8-F207 PolarHBondContact O-N 3.47Å
9	P	97.2	Very high	95.5	Very high	72 Å²	72	63.9 Å²	63.9	47%	0.468	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	118.6	178.2	-19.5	34.3	0	0	0	110.7	D7 K204	D7-P9 WeakPolarHBondContact O-CD 3.26Å; P9-K204 HydrophobicContact CB-CB 4.1Å; P9-K204 HydrophobicContact CB-CD 3.56Å; P9-K204 HydrophobicContact CB-CG 4.45Å
10	A	97.8	Very high	95.7	Very high	4 Å²	4	62.5 Å²	62.5	3%	0.033	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	145.5	179.4	0	0	0	0	0	110.8	L8 S12 K204 I205 F207 Y211	L8-A10 PolarHBondContact O-N 3.4Å; A10-S12 PolarHBondContact O-N 3.38Å; A10-K204 VanDerWaalsContact O-CA 3.31Å; A10-K204 WeakPolarHBondContact O-CA 3.38Å; A10-I205 PolarHBondContact N-O 2.76Å; A10-I205 PolarHBondContact O-N 2.6Å; A10-F207 HydrophobicContact CB-CD2 4.5Å; A10-Y211 HydrophobicContact CB-CD2 3.56Å; A10-Y211 HydrophobicContact CB-CE2 3.4Å
11	P	98.3	Very high	95.8	Very high	1 Å²	1	61 Å²	61	1%	0.006	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56	138.8	175.3	-17	26.7	0	0	0	110.1	N13 I14 S192 N194 S200 Y211	P11-N13 PolarHBondContact O-N 3.39Å; P11-I14 HydrophobicContact CB-CG2 3.83Å; P11-I14 HydrophobicContact CG-CG2 3.88Å; P11-S192 VanDerWaalsContact CG-O 3.3Å; P11-S192 WeakPolarHBondContact CG-O 3.4Å; P11-N194 HydrophobicContact CB-CB 3.75Å; P11-N194 HydrophobicContact CG-CB 4.06Å; P11-S200 WeakPolarHBondContact CB-OG 3.41Å; P11-S200 WeakPolarHBondContact CG-OG 3.34Å; P11-Y211 PolarHBondContact O-OH 2.96Å
12	S	98.1	Very high	96.3	Very high	43 Å²	43	55.1 Å²	55.1	30%	0.301	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-19.4	-176.5	66.3	0	0	0	0	114.7	A10 D203 Y211	A10-S12 PolarHBondContact O-N 3.38Å; S12-D203 VanDerWaalsContact CB-OD2 3.3Å; S12-D203 WeakPolarHBondContact CB-OD2 3.45Å; S12-D203 PolarHBondContact N-O 3.39Å; S12-D203 VanDerWaalsContact OG-CG 3.27Å; S12-D203 PolarHBondContact OG-OD2 3.01Å; S12-Y211 PolarHBondContact O-OH 3.35Å
13	N	98.2	Very high	96.6	Very high	61 Å²	61	51.4 Å²	51.4	33%	0.326	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.8	15.5	-164.6	69.2	-26	0	0	0	114.8	P11 S15 N194 P195	P11-N13 PolarHBondContact O-N 3.39Å; N13-S15 PolarHBondContact O-N 3.02Å; N13-N194 PolarHBondContact ND2-OD1 3.43Å; N13-N194 VanDerWaalsContact ND2-OD1 3.1Å; N13-N194 WeakPolarHBondContact OD1-CB 3.35Å; N13-P195 VanDerWaalsContact O-CD 3.31Å; N13-P195 WeakPolarHBondContact O-CD 3.42Å; N13-P195 WeakPolarHBondContact O-CG 3.35Å
14	I	98.1	Very high	97	Very high	16 Å²	16	44.7 Å²	44.7	8%	0.082	25%	0.253	C	S	.	.			trans	-70	129.5	179.5	74.7	-166.7	0	0	0	111.2	P11 W18 N194 Y211 K214	P11-I14 HydrophobicContact CB-CG2 3.83Å; P11-I14 HydrophobicContact CG-CG2 3.88Å; I14-W18 HydrophobicContact CB-CB 4Å; I14-W18 HydrophobicContact CB-CD2 3.75Å; I14-W18 HydrophobicContact CB-CE3 4.27Å; I14-W18 HydrophobicContact CB-CG 3.59Å; I14-W18 HydrophobicContact CD1-CB 3.93Å; I14-W18 HydrophobicContact CD1-CG 3.98Å; I14-W18 HydrophobicContact CG1-CB 3.92Å; I14-W18 HydrophobicContact CG1-CG 4Å; I14-W18 HydrophobicContact CG2-CD2 4.15Å; I14-W18 HydrophobicContact CG2-CG 4.1Å; I14-N194 HydrophobicContact CG2-CB 4.06Å; I14-Y211 HydrophobicContact CD1-CD1 3.84Å; I14-Y211 HydrophobicContact CD1-CD2 4.25Å; I14-Y211 HydrophobicContact CD1-CE1 3.49Å; I14-Y211 VanDerWaalsContact CD1-CE1 3.49Å; I14-Y211 HydrophobicContact CD1-CE2 3.89Å; I14-Y211 HydrophobicContact CD1-CG 4.24Å; I14-Y211 HydrophobicContact CG1-CD1 4.03Å; I14-Y211 HydrophobicContact CG1-CE1 3.27Å; I14-Y211 HydrophobicContact CG1-CE2 4.3Å; I14-Y211 VanDerWaalsContact CG1-CZ 3.43Å; I14-Y211 WeakPolarHBondContact CG1-OH 3.32Å; I14-K214 PolarHBondContact O-NZ 3.33Å
15	S	98.3	Very high	97.6	Very high	37 Å²	37	44 Å²	44	26%	0.259	25%	0.254	S	S	.	.			trans	-82.6	-177.6	-174.8	66.7	0	0	0	0	112.7	N13 W17 W18 K214	N13-S15 PolarHBondContact O-N 3.02Å; S15-W17 PolarHBondContact O-N 3.36Å; S15-W17 VanDerWaalsContact O-N 3.11Å; S15-W18 PolarHBondContact O-N 2.89Å; S15-W18 VanDerWaalsContact O-N 3.08Å; S15-K214 PolarHBondContact O-NZ 3.15Å
16	S	98.2	Very high	98	Very high	88 Å²	88	40.5 Å²	40.5	62%	0.615	24%	0.241	S	C	*	.	G	3₁₀ helix	trans	-59.8	-20.4	178.6	-53.8	0	0	0	0	113.8	W18 N19	S16-W18 PolarHBondContact O-N 3.5Å; S16-N19 VanDerWaalsContact CA-OD1 3.25Å; S16-N19 WeakPolarHBondContact CA-OD1 3.25Å; S16-N19 WeakPolarHBondContact O-CB 3.28Å; S16-N19 PolarHBondContact O-N 3.06Å; S16-N19 VanDerWaalsContact O-N 3.09Å; S16-N19 PolarHBondContact O-OD1 3.01Å; S16-N19 VanDerWaalsContact O-OD1 3.11Å
17	W	98.6	Very high	98.1	Very high	111 Å²	111	38.1 Å²	38.1	42%	0.42	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-62.5	-21.5	174.9	-64.9	107.9	0	0	0	113.5	S15 N19 F20 L83 R87 Y91	S15-W17 PolarHBondContact O-N 3.36Å; S15-W17 VanDerWaalsContact O-N 3.11Å; W17-N19 VanDerWaalsContact C-N 3.34Å; W17-F20 HydrophobicContact CE3-CD2 4.22Å; W17-F20 AromaticContact CE3-CE2 3.76Å; W17-F20 HydrophobicContact CE3-CE2 3.76Å; W17-F20 HydrophobicContact CZ3-CE2 4.18Å; W17-F20 WeakPolarHBondContact O-CD2 3.41Å; W17-L83 HydrophobicContact CH2-CD2 4.21Å; W17-L83 HydrophobicContact CZ3-CB 4.27Å; W17-L83 HydrophobicContact CZ3-CD2 3.72Å; W17-R87 HydrophobicContact CB-CB 4.14Å; W17-R87 HydrophobicContact CB-CG 3.62Å; W17-R87 HydrophobicContact CE3-CB 4.46Å; W17-Y91 HydrophobicContact CB-CE2 4.41Å; W17-Y91 HydrophobicContact CG-CE2 4.4Å
18	W	98.7	Very high	98.3	Very high	25 Å²	25	34.6 Å²	34.6	10%	0.095	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-78.2	-17.6	175.9	-89.1	-114	0	0	0	113.7	I14 S15 S16 F20 R87 Y91 N193 P195	I14-W18 HydrophobicContact CB-CB 4Å; I14-W18 HydrophobicContact CB-CD2 3.75Å; I14-W18 HydrophobicContact CB-CE3 4.27Å; I14-W18 HydrophobicContact CB-CG 3.59Å; I14-W18 HydrophobicContact CD1-CB 3.93Å; I14-W18 HydrophobicContact CD1-CG 3.98Å; I14-W18 HydrophobicContact CG1-CB 3.92Å; I14-W18 HydrophobicContact CG1-CG 4Å; I14-W18 HydrophobicContact CG2-CD2 4.15Å; I14-W18 HydrophobicContact CG2-CG 4.1Å; S15-W18 PolarHBondContact O-N 2.89Å; S15-W18 VanDerWaalsContact O-N 3.08Å; S16-W18 PolarHBondContact O-N 3.5Å; W18-F20 PolarHBondContact O-N 3.47Å; W18-R87 HydrophobicContact CE3-CG 4.18Å; W18-R87 HydrophobicContact CH2-CG 4.41Å; W18-R87 HydrophobicContact CZ3-CG 4.02Å; W18-R87 VanDerWaalsContact NE1-NH1 3.19Å; W18-Y91 HydrophobicContact CH2-CD1 4.17Å; W18-Y91 AromaticContact CH2-CD2 3.54Å; W18-Y91 HydrophobicContact CH2-CD2 3.54Å; W18-Y91 AromaticContact CH2-CE2 3.99Å; W18-Y91 HydrophobicContact CH2-CE2 3.99Å; W18-Y91 AromaticContact CH2-CG 3.63Å; W18-Y91 HydrophobicContact CH2-CG 3.63Å; W18-Y91 AromaticContact CZ3-CD2 3.61Å; W18-Y91 HydrophobicContact CZ3-CD2 3.61Å; W18-Y91 AromaticContact CZ3-CE2 3.59Å; W18-Y91 HydrophobicContact CZ3-CE2 3.59Å; W18-Y91 HydrophobicContact CZ3-CG 4.12Å; W18-N193 VanDerWaalsContact CE2-O 3.24Å; W18-N193 HydrophobicContact CZ2-CB 4.34Å; W18-N193 VanDerWaalsContact CZ2-O 3.26Å; W18-N193 WeakPolarHBondContact CZ2-O 3.26Å; W18-N193 PolarHBondContact NE1-O 3.4Å; W18-P195 HydrophobicContact CH2-CG 4.27Å; W18-P195 HydrophobicContact CZ3-CG 4.03Å
19	N	98.6	Very high	98.4	Very high	11 Å²	11	38.2 Å²	38.2	6%	0.059	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-68.3	-22.8	178.6	-65	85.2	0	0	0	112.8	S16 W17 G21 S22 L23 K214 D215	S16-N19 VanDerWaalsContact CA-OD1 3.25Å; S16-N19 WeakPolarHBondContact CA-OD1 3.25Å; S16-N19 WeakPolarHBondContact O-CB 3.28Å; S16-N19 PolarHBondContact O-N 3.06Å; S16-N19 VanDerWaalsContact O-N 3.09Å; S16-N19 PolarHBondContact O-OD1 3.01Å; S16-N19 VanDerWaalsContact O-OD1 3.11Å; W17-N19 VanDerWaalsContact C-N 3.34Å; N19-G21 PolarHBondContact O-N 3.49Å; N19-S22 PolarHBondContact O-N 3.3Å; N19-S22 VanDerWaalsContact O-N 3.08Å; N19-S22 PolarHBondContact O-OG 2.91Å; N19-L23 WeakPolarHBondContact O-CG 3.27Å; N19-L23 PolarHBondContact O-N 2.98Å; N19-K214 PolarHBondContact ND2-O 3.46Å; N19-K214 WeakPolarHBondContact OD1-CE 3.27Å; N19-K214 PolarHBondContact OD1-NZ 2.94Å; N19-D215 PolarHBondContact ND2-OD1 3.19Å
20	F	98.7	Very high	98.5	Very high	35 Å²	35	35.7 Å²	35.7	15%	0.154	21%	0.211	C	C	.	.	H	α-helix	trans	-62.5	-20.1	-178.5	-68.2	-69.2	0	0	0	113.5	W17 W18 L23 L24 C80 L83 H84	W17-F20 HydrophobicContact CE3-CD2 4.22Å; W17-F20 AromaticContact CE3-CE2 3.76Å; W17-F20 HydrophobicContact CE3-CE2 3.76Å; W17-F20 HydrophobicContact CZ3-CE2 4.18Å; W17-F20 WeakPolarHBondContact O-CD2 3.41Å; W18-F20 PolarHBondContact O-N 3.47Å; F20-L23 HydrophobicContact CD1-CD1 3.87Å; F20-L23 HydrophobicContact CE1-CD1 4.05Å; F20-L24 WeakPolarHBondContact O-CB 3.44Å; F20-L24 WeakPolarHBondContact O-CD1 3.31Å; F20-L24 WeakPolarHBondContact O-CG 3.3Å; F20-L24 PolarHBondContact O-N 3.45Å; F20-L24 VanDerWaalsContact O-N 3.1Å; F20-C80 HydrophobicContact CD1-CB 4.18Å; F20-L83 HydrophobicContact CD1-CB 3.99Å; F20-L83 HydrophobicContact CD1-CD1 4.25Å; F20-L83 HydrophobicContact CD2-CB 3.85Å; F20-L83 HydrophobicContact CE1-CB 3.9Å; F20-L83 HydrophobicContact CE1-CD1 3.41Å; F20-L83 VanDerWaalsContact CE1-CD1 3.41Å; F20-L83 HydrophobicContact CE1-CG 4.28Å; F20-L83 HydrophobicContact CE2-CB 3.75Å; F20-L83 HydrophobicContact CE2-CD1 4.16Å; F20-L83 HydrophobicContact CE2-CG 4.47Å; F20-L83 HydrophobicContact CG-CB 3.99Å; F20-L83 HydrophobicContact CZ-CB 3.79Å; F20-L83 HydrophobicContact CZ-CD1 3.37Å; F20-L83 HydrophobicContact CZ-CG 4.13Å; F20-H84 HydrophobicContact CB-CB 3.89Å
21	G	98.3	Very high	98.5	Very high	31 Å²	31	36.6 Å²	36.6	32%	0.32	22%	0.215	S	C	.	.	H	α-helix	trans	-64.8	-48.9	171.1	0	0	0	0	0	112.8	N19 L24 G25 H84	N19-G21 PolarHBondContact O-N 3.49Å; G21-L24 PolarHBondContact O-N 3.29Å; G21-G25 PolarHBondContact O-N 3.43Å; G21-H84 PolarHBondContact N-ND1 3.17Å
22	S	98.3	Very high	98.6	Very high	33 Å²	33	37.6 Å²	37.6	23%	0.231	22%	0.22	C	C	.	.	H	α-helix	trans	-69.5	-39.1	178.1	53.5	0	0	0	0	111.7	N19 L24 G25 V26 D215	N19-S22 PolarHBondContact O-N 3.3Å; N19-S22 VanDerWaalsContact O-N 3.08Å; N19-S22 PolarHBondContact O-OG 2.91Å; S22-L24 VanDerWaalsContact C-N 3.31Å; S22-L24 PolarHBondContact O-N 2.81Å; S22-G25 PolarHBondContact O-N 3.47Å; S22-G25 VanDerWaalsContact O-N 3.13Å; S22-V26 WeakPolarHBondContact O-CG2 3.47Å; S22-V26 PolarHBondContact O-N 2.91Å; S22-D215 VanDerWaalsContact CB-OD2 3.29Å; S22-D215 WeakPolarHBondContact CB-OD2 3.4Å; S22-D215 PolarHBondContact OG-OD1 3.18Å; S22-D215 PolarHBondContact OG-OD2 3.2Å
23	L	98.8	Very high	98.6	Very high	12 Å²	12	39.7 Å²	39.7	6%	0.063	23%	0.227	C	C	.	.	H	α-helix	trans	-60.4	-37.7	175	-63	-179.2	0	0	0	112.8	N19 F20 V26 C27 I219 M222	N19-L23 WeakPolarHBondContact O-CG 3.27Å; N19-L23 PolarHBondContact O-N 2.98Å; F20-L23 HydrophobicContact CD1-CD1 3.87Å; F20-L23 HydrophobicContact CE1-CD1 4.05Å; L23-V26 PolarHBondContact O-N 3.11Å; L23-C27 WeakPolarHBondContact O-CB 3.4Å; L23-C27 PolarHBondContact O-N 2.92Å; L23-C27 PolarHBondContact O-SG 3.25Å; L23-I219 HydrophobicContact CD2-CB 4.48Å; L23-I219 HydrophobicContact CD2-CG1 3.87Å; L23-M222 HydrophobicContact CB-SD 4.16Å; L23-M222 HydrophobicContact CD2-CB 4.1Å; L23-M222 HydrophobicContact CD2-SD 3.97Å
24	L	98.9	Very high	98.6	Very high	24 Å²	24	37.2 Å²	37.2	13%	0.126	21%	0.214	C	C	.	.	H	α-helix	trans	-63.9	-40.5	174	-75.1	168.8	0	0	0	112.4	F20 G21 S22 V26 C27 L28 F77 C80 L81 H84	F20-L24 WeakPolarHBondContact O-CB 3.44Å; F20-L24 WeakPolarHBondContact O-CD1 3.31Å; F20-L24 WeakPolarHBondContact O-CG 3.3Å; F20-L24 PolarHBondContact O-N 3.45Å; F20-L24 VanDerWaalsContact O-N 3.1Å; G21-L24 PolarHBondContact O-N 3.29Å; S22-L24 VanDerWaalsContact C-N 3.31Å; S22-L24 PolarHBondContact O-N 2.81Å; L24-V26 VanDerWaalsContact C-N 3.33Å; L24-V26 PolarHBondContact O-N 3.03Å; L24-C27 PolarHBondContact O-N 2.76Å; L24-L28 PolarHBondContact O-N 2.82Å; L24-F77 HydrophobicContact CD2-CD2 3.5Å; L24-F77 VanDerWaalsContact CD2-CD2 3.5Å; L24-F77 HydrophobicContact CD2-CE2 3.51Å; L24-C80 HydrophobicContact CD2-CB 3.64Å; L24-C80 HydrophobicContact CG-CB 3.97Å; L24-L81 HydrophobicContact CD1-CD2 4.12Å; L24-L81 HydrophobicContact CD2-CB 4.3Å; L24-L81 HydrophobicContact CD2-CD2 3.83Å; L24-L81 HydrophobicContact CD2-CG 3.6Å; L24-H84 HydrophobicContact CD1-CB 3.74Å
25	G	98.7	Very high	98.7	Very high	38 Å²	38	37.3 Å²	37.3	39%	0.392	22%	0.219	S	C	.	.	H	α-helix	trans	-60.6	-42.4	173.2	0	0	0	0	0	112.2	G21 S22 L28 M29	G21-G25 PolarHBondContact O-N 3.43Å; S22-G25 PolarHBondContact O-N 3.47Å; S22-G25 VanDerWaalsContact O-N 3.13Å; G25-L28 PolarHBondContact O-N 2.86Å; G25-M29 WeakPolarHBondContact O-CG 3.17Å; G25-M29 PolarHBondContact O-N 2.56Å
26	V	98.7	Very high	98.7	Very high	32 Å²	32	38.4 Å²	38.4	19%	0.194	22%	0.221	C	C	.	.	H	α-helix	trans	-67.3	-42.9	176.4	177.4	0	0	0	0	111.4	S22 L23 L24 L28 M29 V30 I219 M222 F223	S22-V26 WeakPolarHBondContact O-CG2 3.47Å; S22-V26 PolarHBondContact O-N 2.91Å; L23-V26 PolarHBondContact O-N 3.11Å; L24-V26 VanDerWaalsContact C-N 3.33Å; L24-V26 PolarHBondContact O-N 3.03Å; V26-L28 VanDerWaalsContact C-N 3.31Å; V26-L28 PolarHBondContact O-N 3.32Å; V26-M29 PolarHBondContact O-N 2.91Å; V26-V30 HydrophobicContact CG1-CG2 4.34Å; V26-V30 WeakPolarHBondContact O-CG2 3.25Å; V26-V30 PolarHBondContact O-N 3.42Å; V26-I219 HydrophobicContact CG2-CD1 3.74Å; V26-I219 HydrophobicContact CG2-CG1 3.98Å; V26-M222 HydrophobicContact CB-CE 4.24Å; V26-M222 HydrophobicContact CG1-CE 3.65Å; V26-F223 HydrophobicContact CG1-CE2 3.99Å; V26-F223 HydrophobicContact CG1-CZ 4.02Å
27	C	98.8	Very high	98.7	Very high	6 Å²	6	39.1 Å²	39.1	4%	0.041	21%	0.214	C	C	.	.	H	α-helix	trans	-56	-46.8	173.7	-70.7	0	0	0	0	110.9	L23 L24 M29 V30 Q31 F77	L23-C27 WeakPolarHBondContact O-CB 3.4Å; L23-C27 PolarHBondContact O-N 2.92Å; L23-C27 PolarHBondContact O-SG 3.25Å; L24-C27 PolarHBondContact O-N 2.76Å; C27-M29 PolarHBondContact O-N 3.44Å; C27-V30 PolarHBondContact O-N 2.92Å; C27-Q31 VanDerWaalsContact O-CG 3.31Å; C27-Q31 WeakPolarHBondContact O-CG 3.35Å; C27-Q31 PolarHBondContact O-N 3.03Å; C27-F77 HydrophobicContact CB-CB 4.07Å; C27-F77 HydrophobicContact CB-CD1 3.76Å; C27-F77 HydrophobicContact CB-CD2 4.26Å; C27-F77 HydrophobicContact CB-CE1 4.25Å; C27-F77 HydrophobicContact CB-CG 3.76Å
28	L	98.9	Very high	98.7	Very high	17 Å²	17	35 Å²	35	9%	0.089	20%	0.2	C	C	.	.	H	α-helix	trans	-59	-45.3	177.2	-178.4	61.9	0	0	0	112	L24 G25 V26 Q31 I32 F77 I176 A177	L24-L28 PolarHBondContact O-N 2.82Å; G25-L28 PolarHBondContact O-N 2.86Å; V26-L28 VanDerWaalsContact C-N 3.31Å; V26-L28 PolarHBondContact O-N 3.32Å; L28-Q31 PolarHBondContact O-N 3.3Å; L28-I32 HydrophobicContact CD1-CD1 3.99Å; L28-I32 HydrophobicContact CD1-CG1 4.3Å; L28-I32 HydrophobicContact CG-CD1 3.92Å; L28-I32 WeakPolarHBondContact O-CG1 3.31Å; L28-I32 PolarHBondContact O-N 3.46Å; L28-F77 HydrophobicContact CB-CE1 4.01Å; L28-F77 HydrophobicContact CB-CZ 4.1Å; L28-F77 HydrophobicContact CD1-CE1 4.16Å; L28-F77 HydrophobicContact CD1-CZ 4.41Å; L28-I176 HydrophobicContact CD1-CB 4.39Å; L28-I176 HydrophobicContact CD1-CG2 3.91Å; L28-I176 HydrophobicContact CD2-CG2 4Å; L28-A177 HydrophobicContact CD2-CB 4Å
29	M	98.8	Very high	98.7	Very high	105 Å²	105	35 Å²	35	52%	0.517	21%	0.205	S	C	.	.	H	α-helix	trans	-63.2	-44.5	177.3	-71	-55.8	-55.7	0	0	112.4	G25 V26 C27 Q31 I32 I33	G25-M29 WeakPolarHBondContact O-CG 3.17Å; G25-M29 PolarHBondContact O-N 2.56Å; V26-M29 PolarHBondContact O-N 2.91Å; C27-M29 PolarHBondContact O-N 3.44Å; M29-Q31 VanDerWaalsContact C-N 3.34Å; M29-Q31 PolarHBondContact O-N 3.18Å; M29-I32 PolarHBondContact O-N 3.18Å; M29-I33 HydrophobicContact CE-CD1 4.29Å; M29-I33 WeakPolarHBondContact O-CB 3.34Å; M29-I33 VanDerWaalsContact O-CG1 3.26Å; M29-I33 WeakPolarHBondContact O-CG1 3.2Å; M29-I33 PolarHBondContact O-N 2.94Å
30	V	98.7	Very high	98.7	Very high	19 Å²	19	40.8 Å²	40.8	12%	0.115	23%	0.233	C	C	.	.	H	α-helix	trans	-59.2	-45.9	175.6	170.3	0	0	0	0	110.4	V26 C27 I33 T34 M69 F223	V26-V30 HydrophobicContact CG1-CG2 4.34Å; V26-V30 WeakPolarHBondContact O-CG2 3.25Å; V26-V30 PolarHBondContact O-N 3.42Å; C27-V30 PolarHBondContact O-N 2.92Å; V30-I33 PolarHBondContact O-N 3.46Å; V30-T34 HydrophobicContact CG1-CG2 4.28Å; V30-T34 WeakPolarHBondContact O-CB 3.37Å; V30-T34 WeakPolarHBondContact O-CG2 3.36Å; V30-T34 PolarHBondContact O-N 3.11Å; V30-T34 PolarHBondContact O-OG1 3.4Å; V30-M69 HydrophobicContact CG1-CG 4.03Å; V30-M69 HydrophobicContact CG1-SD 4.24Å; V30-F223 HydrophobicContact CG2-CE1 4.1Å; V30-F223 HydrophobicContact CG2-CZ 3.84Å
31	Q	98.9	Very high	98.7	Very high	23 Å²	23	42.9 Å²	42.9	11%	0.107	24%	0.243	C	C	.	.	H	α-helix	trans	-64.3	-42.7	179	-68.7	-50.8	103.6	0	0	112.5	C27 L28 M29 T34 G35 H70 G73 F77	C27-Q31 VanDerWaalsContact O-CG 3.31Å; C27-Q31 WeakPolarHBondContact O-CG 3.35Å; C27-Q31 PolarHBondContact O-N 3.03Å; L28-Q31 PolarHBondContact O-N 3.3Å; M29-Q31 VanDerWaalsContact C-N 3.34Å; M29-Q31 PolarHBondContact O-N 3.18Å; Q31-T34 PolarHBondContact O-OG1 2.56Å; Q31-G35 WeakPolarHBondContact O-CA 3.19Å; Q31-G35 PolarHBondContact O-N 3.24Å; Q31-H70 PolarHBondContact NE2-CE1 3.01Å; Q31-H70 PolarHBondContact NE2-O 3.43Å; Q31-H70 PolarHBondContact O-CE1 3.28Å; Q31-H70 VanDerWaalsContact O-CE1 3.24Å; Q31-H70 PolarHBondContact O-ND1 3.2Å; Q31-H70 PolarHBondContact OE1-O 3.18Å; Q31-G73 VanDerWaalsContact OE1-C 3.3Å; Q31-F77 HydrophobicContact CG-CD1 4.02Å
32	I	98.9	Very high	98.8	Very high	22 Å²	22	42.7 Å²	42.7	11%	0.113	23%	0.233	C	C	.	.	H	α-helix	trans	-63.4	-49.2	177.7	-70.4	169.2	0	0	0	110.3	L28 M29 G35 L36 P173 F174	L28-I32 HydrophobicContact CD1-CD1 3.99Å; L28-I32 HydrophobicContact CD1-CG1 4.3Å; L28-I32 HydrophobicContact CG-CD1 3.92Å; L28-I32 WeakPolarHBondContact O-CG1 3.31Å; L28-I32 PolarHBondContact O-N 3.46Å; M29-I32 PolarHBondContact O-N 3.18Å; I32-G35 PolarHBondContact O-N 3.28Å; I32-L36 HydrophobicContact CG2-CD1 3.86Å; I32-L36 HydrophobicContact CG2-CG 4.44Å; I32-L36 WeakPolarHBondContact O-CB 3.47Å; I32-L36 WeakPolarHBondContact O-CG 3.49Å; I32-L36 PolarHBondContact O-N 3.48Å; I32-P173 HydrophobicContact CD1-CB 4.29Å; I32-P173 HydrophobicContact CG1-CB 3.77Å; I32-F174 HydrophobicContact CG2-CE1 4Å; I32-F174 HydrophobicContact CG2-CZ 4.16Å
33	I	98.9	Very high	98.8	Very high	88 Å²	88	44 Å²	44	45%	0.451	24%	0.24	S	C	.	.	H	α-helix	trans	-64	-54.5	-177.5	-66.4	166.1	0	0	0	110.2	M29 V30 G35 L36 F37	M29-I33 HydrophobicContact CE-CD1 4.29Å; M29-I33 WeakPolarHBondContact O-CB 3.34Å; M29-I33 VanDerWaalsContact O-CG1 3.26Å; M29-I33 WeakPolarHBondContact O-CG1 3.2Å; M29-I33 PolarHBondContact O-N 2.94Å; V30-I33 PolarHBondContact O-N 3.46Å; I33-G35 VanDerWaalsContact C-N 3.32Å; I33-G35 PolarHBondContact O-N 2.78Å; I33-L36 PolarHBondContact O-N 2.74Å; I33-F37 HydrophobicContact CG2-CD2 4.31Å; I33-F37 HydrophobicContact CG2-CE2 4.34Å; I33-F37 WeakPolarHBondContact O-CD2 3.09Å; I33-F37 PolarHBondContact O-N 3.21Å
34	T	98.9	Very high	98.8	Very high	9 Å²	9	44.9 Å²	44.9	6%	0.055	25%	0.247	C	C	.	.	H	α-helix	trans	-62	-40.6	-180	54.3	0	0	0	0	111.6	V30 Q31 L36 F37 L38 I66 M69 H70	V30-T34 HydrophobicContact CG1-CG2 4.28Å; V30-T34 WeakPolarHBondContact O-CB 3.37Å; V30-T34 WeakPolarHBondContact O-CG2 3.36Å; V30-T34 PolarHBondContact O-N 3.11Å; V30-T34 PolarHBondContact O-OG1 3.4Å; Q31-T34 PolarHBondContact O-OG1 2.56Å; T34-L36 PolarHBondContact O-N 3.08Å; T34-F37 PolarHBondContact O-N 3.18Å; T34-L38 VanDerWaalsContact O-CG 3.25Å; T34-L38 WeakPolarHBondContact O-CG 3.14Å; T34-L38 PolarHBondContact O-N 3.11Å; T34-I66 HydrophobicContact CG2-CG2 4.22Å; T34-M69 HydrophobicContact CG2-CB 4.28Å; T34-M69 HydrophobicContact CG2-CG 4.04Å; T34-M69 HydrophobicContact CG2-SD 3.83Å; T34-H70 PolarHBondContact OG1-ND1 3.1Å
35	G	98.9	Very high	98.7	Very high	17 Å²	17	45.8 Å²	45.8	18%	0.175	25%	0.252	C	S	.	.	H	α-helix	trans	-62.9	-40.8	178.1	0	0	0	0	0	113	Q31 I32 I33 L38 A39 H70	Q31-G35 WeakPolarHBondContact O-CA 3.19Å; Q31-G35 PolarHBondContact O-N 3.24Å; I32-G35 PolarHBondContact O-N 3.28Å; I33-G35 VanDerWaalsContact C-N 3.32Å; I33-G35 PolarHBondContact O-N 2.78Å; G35-L38 PolarHBondContact O-N 2.86Å; G35-A39 VanDerWaalsContact O-CB 3.32Å; G35-A39 WeakPolarHBondContact O-CB 3.47Å; G35-A39 PolarHBondContact O-N 3.05Å; G35-H70 VanDerWaalsContact CA-CE1 3.48Å; G35-H70 WeakPolarHBondContact CA-CE1 3.4Å; G35-H70 PolarHBondContact N-ND1 3.03Å
36	L	98.8	Very high	98.7	Very high	60 Å²	60	45.4 Å²	45.4	31%	0.314	24%	0.242	S	C	.	.	H	α-helix	trans	-61.7	-46.1	174.7	-77.3	169.9	0	0	0	111.9	I32 I33 T34 L38 A39 M40 F170 F174	I32-L36 HydrophobicContact CG2-CD1 3.86Å; I32-L36 HydrophobicContact CG2-CG 4.44Å; I32-L36 WeakPolarHBondContact O-CB 3.47Å; I32-L36 WeakPolarHBondContact O-CG 3.49Å; I32-L36 PolarHBondContact O-N 3.48Å; I33-L36 PolarHBondContact O-N 2.74Å; T34-L36 PolarHBondContact O-N 3.08Å; L36-L38 VanDerWaalsContact C-N 3.35Å; L36-L38 PolarHBondContact O-N 2.99Å; L36-A39 PolarHBondContact O-N 3.45Å; L36-M40 WeakPolarHBondContact O-CG 3.37Å; L36-M40 PolarHBondContact O-N 3.33Å; L36-F170 HydrophobicContact CD2-CE2 3.71Å; L36-F170 HydrophobicContact CD2-CZ 3.5Å; L36-F174 HydrophobicContact CD2-CZ 4.41Å
37	F	98.8	Very high	98.7	Very high	104 Å²	104	51.5 Å²	51.5	46%	0.456	27%	0.27	S	S	.	.	H	α-helix	trans	-64.5	-38.4	177	-86.3	-97.6	0	0	0	112.2	I33 T34 M40 H41 I66	I33-F37 HydrophobicContact CG2-CD2 4.31Å; I33-F37 HydrophobicContact CG2-CE2 4.34Å; I33-F37 WeakPolarHBondContact O-CD2 3.09Å; I33-F37 PolarHBondContact O-N 3.21Å; T34-F37 PolarHBondContact O-N 3.18Å; F37-M40 PolarHBondContact O-N 3.1Å; F37-H41 PolarHBondContact O-CD2 2.91Å; F37-I66 HydrophobicContact CB-CD1 4.25Å; F37-I66 HydrophobicContact CB-CG2 4.19Å; F37-I66 HydrophobicContact CD1-CD1 4.44Å
38	L	98.9	Very high	98.7	Very high	25 Å²	25	53.7 Å²	53.7	13%	0.131	28%	0.284	C	S	.	.	H	α-helix	trans	-64.6	-42.1	173.9	-67.2	170.9	0	0	0	111.7	T34 G35 L36 M40 H41 Y42 I56 I66 R67 H70	T34-L38 VanDerWaalsContact O-CG 3.25Å; T34-L38 WeakPolarHBondContact O-CG 3.14Å; T34-L38 PolarHBondContact O-N 3.11Å; G35-L38 PolarHBondContact O-N 2.86Å; L36-L38 VanDerWaalsContact C-N 3.35Å; L36-L38 PolarHBondContact O-N 2.99Å; L38-M40 PolarHBondContact O-N 3.31Å; L38-H41 PolarHBondContact O-N 3.47Å; L38-Y42 WeakPolarHBondContact O-CB 3.22Å; L38-Y42 PolarHBondContact O-N 3.06Å; L38-I56 HydrophobicContact CD2-CD1 4.27Å; L38-I56 HydrophobicContact CD2-CG2 3.6Å; L38-I66 HydrophobicContact CD2-CB 4.5Å; L38-I66 HydrophobicContact CD2-CG2 3.97Å; L38-I66 HydrophobicContact CG-CG2 3.88Å; L38-R67 HydrophobicContact CD2-CB 3.94Å; L38-H70 HydrophobicContact CD1-CB 3.53Å
39	A	98.8	Very high	98.7	Very high	25 Å²	25	52.9 Å²	52.9	21%	0.207	28%	0.28	C	S	.	.	H	α-helix	trans	-62.6	-28.6	-179.5	0	0	0	0	0	113.1	G35 L36 H41 F166 F170	G35-A39 VanDerWaalsContact O-CB 3.32Å; G35-A39 WeakPolarHBondContact O-CB 3.47Å; G35-A39 PolarHBondContact O-N 3.05Å; L36-A39 PolarHBondContact O-N 3.45Å; A39-H41 PolarHBondContact O-N 3.31Å; A39-F166 HydrophobicContact CB-CE2 4.22Å; A39-F166 HydrophobicContact CB-CZ 4.11Å; A39-F170 HydrophobicContact CB-CD2 4.25Å; A39-F170 HydrophobicContact CB-CE2 4.03Å
40	M	98.8	Very high	98.7	Very high	132 Å²	132	53.7 Å²	53.7	65%	0.65	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-18.2	174.8	-66.4	175.3	-168	0	0	113.5	L36 F37 L38	L36-M40 WeakPolarHBondContact O-CG 3.37Å; L36-M40 PolarHBondContact O-N 3.33Å; F37-M40 PolarHBondContact O-N 3.1Å; L38-M40 PolarHBondContact O-N 3.31Å
41	H	98.7	Very high	98.7	Very high	79 Å²	79	55.6 Å²	55.6	37%	0.366	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.1	-6.1	-175.8	-62.2	-67.5	0	0	0	113.8	F37 L38 A39 I56 V60	F37-H41 PolarHBondContact O-CD2 2.91Å; L38-H41 PolarHBondContact O-N 3.47Å; A39-H41 PolarHBondContact O-N 3.31Å; H41-I56 HydrophobicContact CB-CD1 3.87Å; H41-I56 HydrophobicContact CB-CG1 3.53Å; H41-V60 HydrophobicContact CB-CG2 4.42Å
42	Y	98.9	Very high	98.7	Very high	26 Å²	26	55 Å²	55	10%	0.102	29%	0.293	C	S	.	.			trans	-90.4	145.4	-177.8	173.5	-102.4	0	0	0	111.8	L38 A49 S52 V53 L120 F166	L38-Y42 WeakPolarHBondContact O-CB 3.22Å; L38-Y42 PolarHBondContact O-N 3.06Å; Y42-A49 HydrophobicContact CE2-CB 4.02Å; Y42-S52 VanDerWaalsContact CD2-OG 3.26Å; Y42-S52 WeakPolarHBondContact CD2-OG 3.49Å; Y42-V53 HydrophobicContact CD2-CG2 3.87Å; Y42-V53 HydrophobicContact CE2-CG2 4.06Å; Y42-L120 HydrophobicContact CE2-CB 4.42Å; Y42-L120 WeakPolarHBondContact CE2-O 3.31Å; Y42-L120 PolarHBondContact OH-O 3.06Å; Y42-F166 AromaticContact CD1-CD2 3.71Å; Y42-F166 HydrophobicContact CD1-CD2 3.71Å; Y42-F166 AromaticContact CD1-CE2 3.65Å; Y42-F166 HydrophobicContact CD1-CE2 3.65Å; Y42-F166 HydrophobicContact CD1-CG 4.33Å; Y42-F166 HydrophobicContact CD1-CZ 4.21Å; Y42-F166 HydrophobicContact CE1-CB 4.35Å; Y42-F166 AromaticContact CE1-CD2 3.63Å; Y42-F166 HydrophobicContact CE1-CD2 3.63Å; Y42-F166 HydrophobicContact CE1-CE2 4.08Å; Y42-F166 AromaticContact CE1-CG 3.97Å; Y42-F166 HydrophobicContact CE1-CG 3.97Å
43	T	98.6	Very high	98.7	Very high	62 Å²	62	54.9 Å²	54.9	38%	0.38	29%	0.293	S	S	.	.			trans	-121.2	124	173.8	55.9	0	0	0	0	111.4	D45 T48 A49 S52	T43-D45 PolarHBondContact O-N 3.37Å; T43-D45 VanDerWaalsContact O-N 3.08Å; T43-T48 WeakPolarHBondContact OG1-CB 3.3Å; T43-T48 PolarHBondContact OG1-OG1 3.43Å; T43-A49 VanDerWaalsContact O-CA 3.28Å; T43-A49 WeakPolarHBondContact O-CA 3.29Å; T43-S52 PolarHBondContact N-OG 2.83Å; T43-S52 WeakPolarHBondContact OG1-CB 3.38Å
44	S	98.1	Very high	98.7	Very high	29 Å²	29	52.9 Å²	52.9	20%	0.203	29%	0.285	C	S	.	.			trans	-86.6	45.3	-177.8	71.4	0	0	0	0	113.5	T163	S44-T163 PolarHBondContact O-OG1 3.44Å; S44-T163 VanDerWaalsContact O-OG1 3.08Å
45	D	98.4	Very high	98.7	Very high	43 Å²	43	56.3 Å²	56.3	23%	0.23	30%	0.3	C	S	.	.	S	Bend	trans	-116.3	135.2	174	-178.8	-75.8	0	0	0	109.4	T43 M47 T48 A49 K159	T43-D45 PolarHBondContact O-N 3.37Å; T43-D45 VanDerWaalsContact O-N 3.08Å; D45-M47 PolarHBondContact O-N 3.43Å; D45-M47 VanDerWaalsContact O-N 3.08Å; D45-M47 VanDerWaalsContact OD1-CB 3.31Å; D45-M47 WeakPolarHBondContact OD1-CB 3.39Å; D45-M47 PolarHBondContact OD1-N 3.01Å; D45-T48 CarbonylContact O-C 3.55Å; D45-T48 PolarHBondContact O-N 3.13Å; D45-T48 PolarHBondContact O-OG1 3.37Å; D45-A49 WeakPolarHBondContact O-CB 3.05Å; D45-A49 PolarHBondContact O-N 3.18Å; D45-K159 WeakPolarHBondContact OD2-CE 3.39Å; D45-K159 IonicContact OD2-NZ 3.31Å; D45-K159 PolarHBondContact OD2-NZ 3Å
46	T	98.1	Very high	98.7	Very high	30 Å²	30	55.8 Å²	55.8	18%	0.184	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-24.6	-172.6	49.6	0	0	0	0	113.6	W122 K159 L162	T46-W122 HydrophobicContact CG2-CD2 4.47Å; T46-W122 HydrophobicContact CG2-CH2 4.27Å; T46-W122 HydrophobicContact CG2-CZ2 3.53Å; T46-K159 HydrophobicContact CG2-CB 4.01Å; T46-L162 HydrophobicContact CG2-CB 4.35Å; T46-L162 HydrophobicContact CG2-CD2 3.88Å
47	M	98.4	Very high	98.7	Very high	160 Å²	160	54.3 Å²	54.3	79%	0.788	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-20.7	176.5	-59.3	-58.6	-63.7	0	0	113	D45	D45-M47 PolarHBondContact O-N 3.43Å; D45-M47 VanDerWaalsContact O-N 3.08Å; D45-M47 VanDerWaalsContact OD1-CB 3.31Å; D45-M47 WeakPolarHBondContact OD1-CB 3.39Å; D45-M47 PolarHBondContact OD1-N 3.01Å
48	T	98.6	Very high	98.7	Very high	53 Å²	53	59 Å²	59	33%	0.325	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.8	-11.5	-171.6	61.8	0	0	0	0	114.8	T43 D45 F50 S51 S52	T43-T48 WeakPolarHBondContact OG1-CB 3.3Å; T43-T48 PolarHBondContact OG1-OG1 3.43Å; D45-T48 CarbonylContact O-C 3.55Å; D45-T48 PolarHBondContact O-N 3.13Å; D45-T48 PolarHBondContact O-OG1 3.37Å; T48-F50 PolarHBondContact O-N 3.04Å; T48-S51 WeakPolarHBondContact CA-OG 3.18Å; T48-S51 PolarHBondContact O-N 3.08Å; T48-S51 PolarHBondContact O-OG 3.3Å; T48-S52 VanDerWaalsContact O-CB 3.32Å; T48-S52 WeakPolarHBondContact O-CB 3.42Å; T48-S52 PolarHBondContact O-N 3.33Å; T48-S52 PolarHBondContact O-OG 3.09Å
49	A	98.6	Very high	98.6	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-58.7	-52.2	-175.7	0	0	0	0	0	112.3	Y42 T43 D45 S51 S52 V53 W122 L162	Y42-A49 HydrophobicContact CE2-CB 4.02Å; T43-A49 VanDerWaalsContact O-CA 3.28Å; T43-A49 WeakPolarHBondContact O-CA 3.29Å; D45-A49 WeakPolarHBondContact O-CB 3.05Å; D45-A49 PolarHBondContact O-N 3.18Å; A49-S51 PolarHBondContact O-N 2.66Å; A49-S52 PolarHBondContact O-N 3.05Å; A49-S52 PolarHBondContact O-OG 3.2Å; A49-V53 PolarHBondContact O-N 2.88Å; A49-W122 HydrophobicContact CB-CB 3.87Å; A49-L162 HydrophobicContact CB-CD2 3.69Å
50	F	98.7	Very high	98.6	Very high	121 Å²	121	63.1 Å²	63.1	53%	0.531	32%	0.322	S	S	.	.	H	α-helix	trans	-61	-46.4	177.4	-173.7	-90.1	0	0	0	111.8	T48 S52 V53 T54 P121	T48-F50 PolarHBondContact O-N 3.04Å; F50-S52 PolarHBondContact O-N 2.84Å; F50-V53 PolarHBondContact O-N 2.79Å; F50-T54 HydrophobicContact CD1-CG2 4.07Å; F50-T54 HydrophobicContact CE1-CG2 3.71Å; F50-T54 HydrophobicContact CZ-CG2 4.27Å; F50-T54 WeakPolarHBondContact O-CG2 3.36Å; F50-T54 PolarHBondContact O-N 3.38Å; F50-P121 WeakPolarHBondContact CA-O 3.48Å; F50-P121 WeakPolarHBondContact CD2-O 3.36Å
51	S	98.7	Very high	98.6	Very high	59 Å²	59	63.8 Å²	63.8	41%	0.413	33%	0.328	S	S	.	.	H	α-helix	trans	-66.9	-35.6	-178.8	58	0	0	0	0	112.4	T48 A49 V53 T54 H55	T48-S51 WeakPolarHBondContact CA-OG 3.18Å; T48-S51 PolarHBondContact O-N 3.08Å; T48-S51 PolarHBondContact O-OG 3.3Å; A49-S51 PolarHBondContact O-N 2.66Å; S51-V53 VanDerWaalsContact C-N 3.35Å; S51-V53 PolarHBondContact O-N 2.77Å; S51-T54 WeakPolarHBondContact CA-OG1 3.26Å; S51-T54 PolarHBondContact O-N 3.16Å; S51-T54 VanDerWaalsContact O-N 3.14Å; S51-T54 PolarHBondContact O-OG1 3.06Å; S51-H55 WeakPolarHBondContact O-CB 3.49Å; S51-H55 PolarHBondContact O-N 2.97Å
52	S	98.8	Very high	98.6	Very high	10 Å²	10	68.1 Å²	68.1	7%	0.07	34%	0.342	C	S	.	.	H	α-helix	trans	-62.3	-40	174.6	76.1	0	0	0	0	112	Y42 T43 T48 A49 F50 H55 I56	Y42-S52 VanDerWaalsContact CD2-OG 3.26Å; Y42-S52 WeakPolarHBondContact CD2-OG 3.49Å; T43-S52 PolarHBondContact N-OG 2.83Å; T43-S52 WeakPolarHBondContact OG1-CB 3.38Å; T48-S52 VanDerWaalsContact O-CB 3.32Å; T48-S52 WeakPolarHBondContact O-CB 3.42Å; T48-S52 PolarHBondContact O-N 3.33Å; T48-S52 PolarHBondContact O-OG 3.09Å; A49-S52 PolarHBondContact O-N 3.05Å; A49-S52 PolarHBondContact O-OG 3.2Å; F50-S52 PolarHBondContact O-N 2.84Å; S52-H55 WeakPolarHBondContact O-CB 3.35Å; S52-H55 PolarHBondContact O-N 3.1Å; S52-I56 VanDerWaalsContact O-CG1 3.31Å; S52-I56 WeakPolarHBondContact O-CG1 3.26Å; S52-I56 PolarHBondContact O-N 3.3Å
53	V	98.8	Very high	98.6	Very high	21 Å²	21	66.9 Å²	66.9	13%	0.127	34%	0.338	C	S	.	.	H	α-helix	trans	-66.2	-37.9	173.5	176.5	0	0	0	0	111.4	Y42 A49 F50 S51 I56 C57	Y42-V53 HydrophobicContact CD2-CG2 3.87Å; Y42-V53 HydrophobicContact CE2-CG2 4.06Å; A49-V53 PolarHBondContact O-N 2.88Å; F50-V53 PolarHBondContact O-N 2.79Å; S51-V53 VanDerWaalsContact C-N 3.35Å; S51-V53 PolarHBondContact O-N 2.77Å; V53-I56 PolarHBondContact O-N 3.23Å; V53-C57 PolarHBondContact O-N 3.35Å; V53-C57 PolarHBondContact O-SG 2.82Å
54	T	98.8	Very high	98.6	Very high	45 Å²	45	70.6 Å²	70.6	28%	0.276	35%	0.345	S	S	.	.	H	α-helix	trans	-67.4	-38.6	174.5	63.8	0	0	0	0	112.6	F50 S51 C57 R58	F50-T54 HydrophobicContact CD1-CG2 4.07Å; F50-T54 HydrophobicContact CE1-CG2 3.71Å; F50-T54 HydrophobicContact CZ-CG2 4.27Å; F50-T54 WeakPolarHBondContact O-CG2 3.36Å; F50-T54 PolarHBondContact O-N 3.38Å; S51-T54 WeakPolarHBondContact CA-OG1 3.26Å; S51-T54 PolarHBondContact O-N 3.16Å; S51-T54 VanDerWaalsContact O-N 3.14Å; S51-T54 PolarHBondContact O-OG1 3.06Å; T54-C57 PolarHBondContact O-N 3.31Å; T54-R58 WeakPolarHBondContact O-CB 3.46Å; T54-R58 WeakPolarHBondContact O-CG 3.24Å; T54-R58 PolarHBondContact O-N 3.37Å
55	H	98.8	Very high	98.6	Very high	82 Å²	82	72.7 Å²	72.7	38%	0.38	35%	0.354	S	S	.	.	H	α-helix	trans	-62.1	-44.1	174.5	166.7	-90.3	0	0	0	111	S51 S52 C57 R58 D59 V60	S51-H55 WeakPolarHBondContact O-CB 3.49Å; S51-H55 PolarHBondContact O-N 2.97Å; S52-H55 WeakPolarHBondContact O-CB 3.35Å; S52-H55 PolarHBondContact O-N 3.1Å; H55-C57 VanDerWaalsContact C-N 3.27Å; H55-C57 PolarHBondContact O-N 3.11Å; H55-R58 PolarHBondContact O-N 2.83Å; H55-D59 IonicContact CD2-OD2 3.91Å; H55-D59 PolarHBondContact CD2-OD2 3.18Å; H55-D59 VanDerWaalsContact CD2-OD2 3.31Å; H55-D59 IonicContact CG-OD2 2.67Å; H55-D59 PolarHBondContact O-N 3.47Å; H55-V60 PolarHBondContact O-N 3.3Å
56	I	98.8	Very high	98.7	Very high	5 Å²	5	72.5 Å²	72.5	3%	0.026	35%	0.352	C	S	.	.	H	α-helix	trans	-53.6	-46.5	172.3	-71.6	166.9	0	0	0	111	L38 H41 S52 V53 R58 G63 R67	L38-I56 HydrophobicContact CD2-CD1 4.27Å; L38-I56 HydrophobicContact CD2-CG2 3.6Å; H41-I56 HydrophobicContact CB-CD1 3.87Å; H41-I56 HydrophobicContact CB-CG1 3.53Å; S52-I56 VanDerWaalsContact O-CG1 3.31Å; S52-I56 WeakPolarHBondContact O-CG1 3.26Å; S52-I56 PolarHBondContact O-N 3.3Å; V53-I56 PolarHBondContact O-N 3.23Å; I56-R58 VanDerWaalsContact C-N 3.34Å; I56-R58 PolarHBondContact O-N 3.32Å; I56-G63 CarbonylContact O-C 3.56Å; I56-G63 VanDerWaalsContact O-CA 3.24Å; I56-G63 WeakPolarHBondContact O-CA 3.36Å; I56-R67 HydrophobicContact CG2-CB 4.36Å
57	C	98.8	Very high	98.7	Very high	30 Å²	30	74.5 Å²	74.5	20%	0.203	36%	0.356	C	S	.	.	H	α-helix	trans	-71.6	-28.4	-177.1	-61.5	0	0	0	0	113.4	V53 T54 H55 W64	V53-C57 PolarHBondContact O-N 3.35Å; V53-C57 PolarHBondContact O-SG 2.82Å; T54-C57 PolarHBondContact O-N 3.31Å; H55-C57 VanDerWaalsContact C-N 3.27Å; H55-C57 PolarHBondContact O-N 3.11Å; C57-W64 HydrophobicContact CB-CB 4.46Å; C57-W64 WeakPolarHBondContact O-CB 3.37Å
58	R	98.7	Very high	98.7	Very high	202 Å²	202	72.4 Å²	72.4	76%	0.762	34%	0.341	S	S	*	.	H	α-helix	trans	-104.6	-36.8	-168.6	-69.6	179.1	174.4	-178.6	-1.8	113.9	T54 H55 I56	T54-R58 WeakPolarHBondContact O-CB 3.46Å; T54-R58 WeakPolarHBondContact O-CG 3.24Å; T54-R58 PolarHBondContact O-N 3.37Å; H55-R58 PolarHBondContact O-N 2.83Å; I56-R58 VanDerWaalsContact C-N 3.34Å; I56-R58 PolarHBondContact O-N 3.32Å
59	D	98.6	Very high	98.7	Very high	111 Å²	111	73.1 Å²	73.1	59%	0.594	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.8	-21.2	-164.4	-51.9	-48.6	0	0	0	112.6	H55	H55-D59 IonicContact CD2-OD2 3.91Å; H55-D59 PolarHBondContact CD2-OD2 3.18Å; H55-D59 VanDerWaalsContact CD2-OD2 3.31Å; H55-D59 IonicContact CG-OD2 2.67Å; H55-D59 PolarHBondContact O-N 3.47Å
60	V	98.7	Very high	98.7	Very high	26 Å²	26	74.6 Å²	74.6	16%	0.158	35%	0.348	C	S	.	.	S	Bend	trans	-84	129.4	174.3	179.8	0	0	0	0	109.9	H41 H55 Y62 G63	H41-V60 HydrophobicContact CB-CG2 4.42Å; H55-V60 PolarHBondContact O-N 3.3Å; V60-Y62 PolarHBondContact O-N 3.48Å; V60-G63 PolarHBondContact O-N 2.96Å
61	N	98.6	Very high	98.7	Very high	145 Å²	145	71 Å²	71	78%	0.775	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	121.8	177	-68.9	-38.3	0	0	0	111	G63	N61-G63 PolarHBondContact O-N 2.92Å
62	Y	98.6	Very high	98.7	Very high	170 Å²	170	72 Å²	72	67%	0.667	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	13.1	-174	-55.4	-81.1	0	0	0	115.1	V60 W64 L65 I66	V60-Y62 PolarHBondContact O-N 3.48Å; Y62-W64 VanDerWaalsContact C-N 3.3Å; Y62-W64 PolarHBondContact O-N 2.65Å; Y62-L65 WeakPolarHBondContact O-CB 3.25Å; Y62-L65 PolarHBondContact O-N 3.4Å; Y62-I66 PolarHBondContact O-N 2.85Å; Y62-I66 VanDerWaalsContact O-N 3.1Å
63	G	98.8	Very high	98.7	Very high	1 Å²	1	71.7 Å²	71.7	1%	0.01	34%	0.339	C	S	.	.	H	α-helix	trans	-65	-33	-176.7	0	0	0	0	0	113	I56 V60 N61 L65 I66 R67	I56-G63 CarbonylContact O-C 3.56Å; I56-G63 VanDerWaalsContact O-CA 3.24Å; I56-G63 WeakPolarHBondContact O-CA 3.36Å; V60-G63 PolarHBondContact O-N 2.96Å; N61-G63 PolarHBondContact O-N 2.92Å; G63-L65 VanDerWaalsContact C-N 3.34Å; G63-L65 PolarHBondContact O-N 3.48Å; G63-I66 PolarHBondContact O-N 2.89Å; G63-R67 VanDerWaalsContact O-CB 3.26Å; G63-R67 WeakPolarHBondContact O-CB 3.43Å; G63-R67 PolarHBondContact O-N 3.46Å
64	W	98.6	Very high	98.7	Very high	139 Å²	139	72 Å²	72	53%	0.527	34%	0.344	S	S	.	.	H	α-helix	trans	-58.3	-45.7	170.3	66.1	-90.4	0	0	0	111.8	C57 Y62 R67 Y68	C57-W64 HydrophobicContact CB-CB 4.46Å; C57-W64 WeakPolarHBondContact O-CB 3.37Å; Y62-W64 VanDerWaalsContact C-N 3.3Å; Y62-W64 PolarHBondContact O-N 2.65Å; W64-R67 PolarHBondContact O-N 3.39Å; W64-Y68 HydrophobicContact CB-CD2 4.43Å; W64-Y68 HydrophobicContact CE3-CD2 4.37Å; W64-Y68 WeakPolarHBondContact O-CD2 3.37Å; W64-Y68 PolarHBondContact O-N 3.31Å
65	L	98.6	Very high	98.7	Very high	73 Å²	73	73.2 Å²	73.2	38%	0.382	36%	0.355	S	S	.	.	H	α-helix	trans	-63.2	-48	-178.8	176.2	63.8	0	0	0	109.9	Y62 G63 R67 Y68 M69	Y62-L65 WeakPolarHBondContact O-CB 3.25Å; Y62-L65 PolarHBondContact O-N 3.4Å; G63-L65 VanDerWaalsContact C-N 3.34Å; G63-L65 PolarHBondContact O-N 3.48Å; L65-R67 VanDerWaalsContact C-N 3.33Å; L65-R67 PolarHBondContact O-N 2.96Å; L65-Y68 PolarHBondContact O-N 3.3Å; L65-M69 VanDerWaalsContact O-CB 3.22Å; L65-M69 WeakPolarHBondContact O-CB 3.4Å; L65-M69 PolarHBondContact O-N 3.43Å
66	I	98.7	Very high	98.7	Very high	40 Å²	40	70.3 Å²	70.3	21%	0.205	34%	0.341	C	S	.	.	H	α-helix	trans	-60.2	-44.9	177.8	-60.6	172	0	0	0	110.4	T34 F37 L38 Y62 G63 M69 H70	T34-I66 HydrophobicContact CG2-CG2 4.22Å; F37-I66 HydrophobicContact CB-CD1 4.25Å; F37-I66 HydrophobicContact CB-CG2 4.19Å; F37-I66 HydrophobicContact CD1-CD1 4.44Å; L38-I66 HydrophobicContact CD2-CB 4.5Å; L38-I66 HydrophobicContact CD2-CG2 3.97Å; L38-I66 HydrophobicContact CG-CG2 3.88Å; Y62-I66 PolarHBondContact O-N 2.85Å; Y62-I66 VanDerWaalsContact O-N 3.1Å; G63-I66 PolarHBondContact O-N 2.89Å; I66-M69 PolarHBondContact O-N 3.2Å; I66-H70 WeakPolarHBondContact O-CB 3.43Å; I66-H70 PolarHBondContact O-N 3.38Å
67	R	98.8	Very high	98.7	Very high	71 Å²	71	70.9 Å²	70.9	27%	0.268	34%	0.344	S	S	.	.	H	α-helix	trans	-62	-46.8	179.7	-176	-88.5	-179.5	157.9	0.4	111.8	L38 I56 G63 W64 L65 H70 A71	L38-R67 HydrophobicContact CD2-CB 3.94Å; I56-R67 HydrophobicContact CG2-CB 4.36Å; G63-R67 VanDerWaalsContact O-CB 3.26Å; G63-R67 WeakPolarHBondContact O-CB 3.43Å; G63-R67 PolarHBondContact O-N 3.46Å; W64-R67 PolarHBondContact O-N 3.39Å; L65-R67 VanDerWaalsContact C-N 3.33Å; L65-R67 PolarHBondContact O-N 2.96Å; R67-H70 PolarHBondContact O-N 3.39Å; R67-A71 WeakPolarHBondContact O-CB 3.35Å; R67-A71 PolarHBondContact O-N 3.37Å
68	Y	98.6	Very high	98.6	Very high	117 Å²	117	71.5 Å²	71.5	46%	0.459	34%	0.343	S	S	.	.	H	α-helix	trans	-74.1	-31.6	-179.4	-75.2	-66.7	0	0	0	112.6	W64 L65 A71 N72	W64-Y68 HydrophobicContact CB-CD2 4.43Å; W64-Y68 HydrophobicContact CE3-CD2 4.37Å; W64-Y68 WeakPolarHBondContact O-CD2 3.37Å; W64-Y68 PolarHBondContact O-N 3.31Å; L65-Y68 PolarHBondContact O-N 3.3Å; Y68-A71 PolarHBondContact O-N 3.24Å; Y68-N72 WeakPolarHBondContact O-CB 3.25Å; Y68-N72 PolarHBondContact O-N 3.19Å; Y68-N72 PolarHBondContact O-ND2 2.89Å
69	M	98.7	Very high	98.6	Very high	68 Å²	68	66.1 Å²	66.1	34%	0.335	33%	0.329	S	S	.	.	H	α-helix	trans	-63.6	-42.9	170.4	-173	178.3	-73.8	0	0	111.1	V30 T34 L65 I66 G73 L226	V30-M69 HydrophobicContact CG1-CG 4.03Å; V30-M69 HydrophobicContact CG1-SD 4.24Å; T34-M69 HydrophobicContact CG2-CB 4.28Å; T34-M69 HydrophobicContact CG2-CG 4.04Å; T34-M69 HydrophobicContact CG2-SD 3.83Å; L65-M69 VanDerWaalsContact O-CB 3.22Å; L65-M69 WeakPolarHBondContact O-CB 3.4Å; L65-M69 PolarHBondContact O-N 3.43Å; I66-M69 PolarHBondContact O-N 3.2Å; M69-G73 VanDerWaalsContact O-CA 3.25Å; M69-G73 WeakPolarHBondContact O-CA 3.26Å; M69-G73 PolarHBondContact O-N 3.05Å; M69-L226 HydrophobicContact CG-CD2 4.5Å
70	H	98.8	Very high	98.7	Very high	31 Å²	31	61 Å²	61	14%	0.144	30%	0.301	C	S	.	.	H	α-helix	trans	-65.3	-40.4	176	-166.2	81.4	0	0	0	112.5	Q31 T34 G35 L38 I66 R67 A74 H169	Q31-H70 PolarHBondContact NE2-CE1 3.01Å; Q31-H70 PolarHBondContact NE2-O 3.43Å; Q31-H70 PolarHBondContact O-CE1 3.28Å; Q31-H70 VanDerWaalsContact O-CE1 3.24Å; Q31-H70 PolarHBondContact O-ND1 3.2Å; Q31-H70 PolarHBondContact OE1-O 3.18Å; T34-H70 PolarHBondContact OG1-ND1 3.1Å; G35-H70 VanDerWaalsContact CA-CE1 3.48Å; G35-H70 WeakPolarHBondContact CA-CE1 3.4Å; G35-H70 PolarHBondContact N-ND1 3.03Å; L38-H70 HydrophobicContact CD1-CB 3.53Å; I66-H70 WeakPolarHBondContact O-CB 3.43Å; I66-H70 PolarHBondContact O-N 3.38Å; R67-H70 PolarHBondContact O-N 3.39Å; H70-A74 PolarHBondContact O-N 3.44Å; H70-H169 AromaticContact NE2-NE2 3.95Å
71	A	98.6	Very high	98.7	Very high	44 Å²	44	60.3 Å²	60.3	36%	0.364	30%	0.297	S	S	.	.	H	α-helix	trans	-70	-51.3	-179.8	0	0	0	0	0	112.4	R67 Y68 G73 A74	R67-A71 WeakPolarHBondContact O-CB 3.35Å; R67-A71 PolarHBondContact O-N 3.37Å; Y68-A71 PolarHBondContact O-N 3.24Å; A71-G73 VanDerWaalsContact C-N 3.34Å; A71-A74 WeakPolarHBondContact O-CB 3.43Å; A71-A74 PolarHBondContact O-N 2.92Å
72	N	98.6	Very high	98.7	Very high	81 Å²	81	59.6 Å²	59.6	43%	0.433	29%	0.287	S	S	.	.	H	α-helix	trans	-72.1	-30.2	178.2	-67.9	-61.5	0	0	0	111.9	Y68 A74 S75 M76 L226	Y68-N72 WeakPolarHBondContact O-CB 3.25Å; Y68-N72 PolarHBondContact O-N 3.19Å; Y68-N72 PolarHBondContact O-ND2 2.89Å; N72-A74 VanDerWaalsContact C-N 3.26Å; N72-A74 PolarHBondContact O-N 3.01Å; N72-S75 WeakPolarHBondContact O-CB 3.31Å; N72-S75 PolarHBondContact O-N 2.79Å; N72-S75 VanDerWaalsContact O-N 3.07Å; N72-M76 PolarHBondContact O-N 3.18Å; N72-L226 HydrophobicContact CB-CD1 3.9Å
73	G	98.7	Very high	98.7	Very high	3 Å²	3	54.4 Å²	54.4	3%	0.031	27%	0.27	C	S	.	.	H	α-helix	trans	-61.1	-35.2	174	0	0	0	0	0	112.1	Q31 M69 A71 M76 F77	Q31-G73 VanDerWaalsContact OE1-C 3.3Å; M69-G73 VanDerWaalsContact O-CA 3.25Å; M69-G73 WeakPolarHBondContact O-CA 3.26Å; M69-G73 PolarHBondContact O-N 3.05Å; A71-G73 VanDerWaalsContact C-N 3.34Å; G73-M76 PolarHBondContact O-N 3.33Å; G73-F77 WeakPolarHBondContact O-CB 3.43Å; G73-F77 PolarHBondContact O-N 2.95Å
74	A	98.6	Very high	98.7	Very high	28 Å²	28	56.1 Å²	56.1	23%	0.231	28%	0.278	C	S	.	.	H	α-helix	trans	-61.6	-43.4	171.3	0	0	0	0	0	112	H70 A71 N72 F77 F78	H70-A74 PolarHBondContact O-N 3.44Å; A71-A74 WeakPolarHBondContact O-CB 3.43Å; A71-A74 PolarHBondContact O-N 2.92Å; N72-A74 VanDerWaalsContact C-N 3.26Å; N72-A74 PolarHBondContact O-N 3.01Å; A74-F77 WeakPolarHBondContact O-CB 3.31Å; A74-F77 PolarHBondContact O-N 3.37Å; A74-F78 WeakPolarHBondContact O-CD2 3.5Å; A74-F78 PolarHBondContact O-N 3.32Å
75	S	98.4	Very high	98.7	Very high	71 Å²	71	51.6 Å²	51.6	50%	0.497	27%	0.266	S	S	.	.	H	α-helix	trans	-63.9	-43.7	175.1	-62.2	0	0	0	0	112.2	N72 F77 F78 I79	N72-S75 WeakPolarHBondContact O-CB 3.31Å; N72-S75 PolarHBondContact O-N 2.79Å; N72-S75 VanDerWaalsContact O-N 3.07Å; S75-F77 VanDerWaalsContact C-N 3.28Å; S75-F77 PolarHBondContact O-N 2.83Å; S75-F78 PolarHBondContact O-N 3.1Å; S75-I79 WeakPolarHBondContact O-CG1 3.5Å; S75-I79 PolarHBondContact O-N 2.83Å
76	M	98.5	Very high	98.7	Very high	20 Å²	20	49.7 Å²	49.7	10%	0.099	26%	0.264	C	S	.	.	H	α-helix	trans	-60.9	-37.9	175.6	-173.1	60.9	79.2	0	0	111.8	N72 G73 F78 I79 C80 M222 I225 L226	N72-M76 PolarHBondContact O-N 3.18Å; G73-M76 PolarHBondContact O-N 3.33Å; M76-F78 PolarHBondContact O-N 3.43Å; M76-I79 PolarHBondContact O-N 2.9Å; M76-C80 PolarHBondContact O-N 3.4Å; M76-C80 PolarHBondContact O-SG 3.43Å; M76-M222 HydrophobicContact CE-CG 4.13Å; M76-M222 HydrophobicContact CG-CG 3.77Å; M76-M222 HydrophobicContact CG-SD 3.98Å; M76-M222 HydrophobicContact SD-CG 3.9Å; M76-I225 HydrophobicContact CE-CB 4.04Å; M76-I225 HydrophobicContact CE-CG2 3.81Å; M76-L226 HydrophobicContact CB-CD1 4.12Å; M76-L226 HydrophobicContact CE-CB 4.35Å
77	F	98.7	Very high	98.7	Very high	17 Å²	17	48.9 Å²	48.9	8%	0.075	26%	0.258	C	S	.	.	H	α-helix	trans	-57.6	-48.7	173.9	-153.7	146.1	0	0	0	110.5	L24 C27 L28 Q31 G73 A74 S75 C80 L81 V110	L24-F77 HydrophobicContact CD2-CD2 3.5Å; L24-F77 VanDerWaalsContact CD2-CD2 3.5Å; L24-F77 HydrophobicContact CD2-CE2 3.51Å; C27-F77 HydrophobicContact CB-CB 4.07Å; C27-F77 HydrophobicContact CB-CD1 3.76Å; C27-F77 HydrophobicContact CB-CD2 4.26Å; C27-F77 HydrophobicContact CB-CE1 4.25Å; C27-F77 HydrophobicContact CB-CG 3.76Å; L28-F77 HydrophobicContact CB-CE1 4.01Å; L28-F77 HydrophobicContact CB-CZ 4.1Å; L28-F77 HydrophobicContact CD1-CE1 4.16Å; L28-F77 HydrophobicContact CD1-CZ 4.41Å; Q31-F77 HydrophobicContact CG-CD1 4.02Å; G73-F77 WeakPolarHBondContact O-CB 3.43Å; G73-F77 PolarHBondContact O-N 2.95Å; A74-F77 WeakPolarHBondContact O-CB 3.31Å; A74-F77 PolarHBondContact O-N 3.37Å; S75-F77 VanDerWaalsContact C-N 3.28Å; S75-F77 PolarHBondContact O-N 2.83Å; F77-C80 PolarHBondContact O-N 3.49Å; F77-L81 HydrophobicContact CD2-CD1 3.86Å; F77-L81 HydrophobicContact CD2-CG 3.93Å; F77-L81 HydrophobicContact CE2-CD1 4.1Å; F77-L81 HydrophobicContact CE2-CD2 4.48Å; F77-L81 HydrophobicContact CE2-CG 4.12Å; F77-L81 WeakPolarHBondContact O-CB 3.42Å; F77-L81 WeakPolarHBondContact O-CG 3.47Å; F77-L81 PolarHBondContact O-N 3.28Å; F77-V110 HydrophobicContact CD2-CG1 4.22Å; F77-V110 HydrophobicContact CE2-CG1 4.2Å; F77-V110 HydrophobicContact CE2-CG2 3.91Å; F77-V110 HydrophobicContact CG-CG1 4.45Å; F77-V110 HydrophobicContact CZ-CG1 4.41Å; F77-V110 HydrophobicContact CZ-CG2 3.82Å
78	F	98.7	Very high	98.7	Very high	43 Å²	43	45.6 Å²	45.6	19%	0.189	25%	0.247	C	C	.	.	H	α-helix	trans	-66.1	-38.2	177.9	-82.9	-78.8	0	0	0	113.6	A74 S75 M76 C80 L81 F82 V110 M111 A114	A74-F78 WeakPolarHBondContact O-CD2 3.5Å; A74-F78 PolarHBondContact O-N 3.32Å; S75-F78 PolarHBondContact O-N 3.1Å; M76-F78 PolarHBondContact O-N 3.43Å; F78-C80 VanDerWaalsContact C-N 3.33Å; F78-C80 PolarHBondContact O-N 2.89Å; F78-L81 HydrophobicContact CD1-CD1 4.19Å; F78-L81 HydrophobicContact CE1-CD1 4.29Å; F78-L81 PolarHBondContact O-N 3.07Å; F78-F82 HydrophobicContact CB-CD2 4.46Å; F78-F82 HydrophobicContact CB-CE2 4.01Å; F78-F82 HydrophobicContact CD1-CE1 4.41Å; F78-F82 HydrophobicContact CD1-CE2 4.18Å; F78-F82 AromaticContact CD1-CZ 3.82Å; F78-F82 HydrophobicContact CD1-CZ 3.82Å; F78-F82 WeakPolarHBondContact O-CD2 3.34Å; F78-F82 VanDerWaalsContact O-CG 3.3Å; F78-F82 WeakPolarHBondContact O-CG 3.42Å; F78-F82 PolarHBondContact O-N 3.2Å; F78-V110 HydrophobicContact CE2-CG1 4.22Å; F78-V110 HydrophobicContact CZ-CG1 3.97Å; F78-M111 HydrophobicContact CE1-CG 3.8Å; F78-M111 HydrophobicContact CZ-CG 4.14Å; F78-A114 HydrophobicContact CE2-CB 3.53Å; F78-A114 HydrophobicContact CZ-CB 3.93Å
79	I	98.7	Very high	98.7	Very high	90 Å²	90	44.7 Å²	44.7	46%	0.462	25%	0.249	S	C	.	.	H	α-helix	trans	-57.7	-50	173.1	-68.4	167.1	0	0	0	109.6	S75 M76 L81 F82 L83	S75-I79 WeakPolarHBondContact O-CG1 3.5Å; S75-I79 PolarHBondContact O-N 2.83Å; M76-I79 PolarHBondContact O-N 2.9Å; I79-L81 VanDerWaalsContact C-N 3.33Å; I79-L81 PolarHBondContact O-N 3.38Å; I79-F82 PolarHBondContact O-N 3.12Å; I79-L83 HydrophobicContact CG2-CD1 3.74Å; I79-L83 VanDerWaalsContact O-CG 3.26Å; I79-L83 WeakPolarHBondContact O-CG 3.1Å; I79-L83 PolarHBondContact O-N 2.89Å
80	C	98.8	Very high	98.7	Very high	2 Å²	2	50.2 Å²	50.2	1%	0.014	27%	0.267	C	S	.	.	H	α-helix	trans	-61.8	-39.8	177.2	-67	0	0	0	0	112.1	F20 L24 M76 F77 F78 L83 H84	F20-C80 HydrophobicContact CD1-CB 4.18Å; L24-C80 HydrophobicContact CD2-CB 3.64Å; L24-C80 HydrophobicContact CG-CB 3.97Å; M76-C80 PolarHBondContact O-N 3.4Å; M76-C80 PolarHBondContact O-SG 3.43Å; F77-C80 PolarHBondContact O-N 3.49Å; F78-C80 VanDerWaalsContact C-N 3.33Å; F78-C80 PolarHBondContact O-N 2.89Å; C80-L83 PolarHBondContact O-N 3.38Å; C80-H84 WeakPolarHBondContact O-CB 3.19Å; C80-H84 PolarHBondContact O-N 3.48Å
81	L	98.8	Very high	98.7	Very high	13 Å²	13	51 Å²	51	7%	0.068	27%	0.269	C	S	.	.	H	α-helix	trans	-62.1	-49.8	178.8	-86.5	170.3	0	0	0	110.9	L24 F77 F78 I79 L83 H84 V85 L107 V110	L24-L81 HydrophobicContact CD1-CD2 4.12Å; L24-L81 HydrophobicContact CD2-CB 4.3Å; L24-L81 HydrophobicContact CD2-CD2 3.83Å; L24-L81 HydrophobicContact CD2-CG 3.6Å; F77-L81 HydrophobicContact CD2-CD1 3.86Å; F77-L81 HydrophobicContact CD2-CG 3.93Å; F77-L81 HydrophobicContact CE2-CD1 4.1Å; F77-L81 HydrophobicContact CE2-CD2 4.48Å; F77-L81 HydrophobicContact CE2-CG 4.12Å; F77-L81 WeakPolarHBondContact O-CB 3.42Å; F77-L81 WeakPolarHBondContact O-CG 3.47Å; F77-L81 PolarHBondContact O-N 3.28Å; F78-L81 HydrophobicContact CD1-CD1 4.19Å; F78-L81 HydrophobicContact CE1-CD1 4.29Å; F78-L81 PolarHBondContact O-N 3.07Å; I79-L81 VanDerWaalsContact C-N 3.33Å; I79-L81 PolarHBondContact O-N 3.38Å; L81-L83 VanDerWaalsContact C-N 3.34Å; L81-L83 PolarHBondContact O-N 3.24Å; L81-H84 PolarHBondContact O-N 3.19Å; L81-V85 WeakPolarHBondContact O-CB 3.36Å; L81-V85 VanDerWaalsContact O-CG2 3.31Å; L81-V85 WeakPolarHBondContact O-CG2 3.26Å; L81-V85 PolarHBondContact O-N 3.32Å; L81-L107 HydrophobicContact CD1-CD1 4.21Å; L81-V110 HydrophobicContact CD1-CB 3.97Å; L81-V110 HydrophobicContact CD1-CG1 3.65Å; L81-V110 HydrophobicContact CD1-CG2 4.32Å
82	F	98.8	Very high	98.7	Very high	130 Å²	130	49.9 Å²	49.9	57%	0.57	26%	0.262	S	S	*	.	H	α-helix	trans	-65.4	-38.9	-178.6	-62.7	-40.8	0	0	0	112	F78 I79 G86	F78-F82 HydrophobicContact CB-CD2 4.46Å; F78-F82 HydrophobicContact CB-CE2 4.01Å; F78-F82 HydrophobicContact CD1-CE1 4.41Å; F78-F82 HydrophobicContact CD1-CE2 4.18Å; F78-F82 AromaticContact CD1-CZ 3.82Å; F78-F82 HydrophobicContact CD1-CZ 3.82Å; F78-F82 WeakPolarHBondContact O-CD2 3.34Å; F78-F82 VanDerWaalsContact O-CG 3.3Å; F78-F82 WeakPolarHBondContact O-CG 3.42Å; F78-F82 PolarHBondContact O-N 3.2Å; I79-F82 PolarHBondContact O-N 3.12Å; F82-G86 PolarHBondContact O-N 3.39Å
83	L	98.8	Very high	98.7	Very high	60 Å²	60	46.8 Å²	46.8	31%	0.314	25%	0.247	S	C	.	.	H	α-helix	trans	-67.9	-38.2	175.2	-64.3	168.4	0	0	0	111.6	W17 F20 I79 C80 L81 G86 R87	W17-L83 HydrophobicContact CH2-CD2 4.21Å; W17-L83 HydrophobicContact CZ3-CB 4.27Å; W17-L83 HydrophobicContact CZ3-CD2 3.72Å; F20-L83 HydrophobicContact CD1-CB 3.99Å; F20-L83 HydrophobicContact CD1-CD1 4.25Å; F20-L83 HydrophobicContact CD2-CB 3.85Å; F20-L83 HydrophobicContact CE1-CB 3.9Å; F20-L83 HydrophobicContact CE1-CD1 3.41Å; F20-L83 VanDerWaalsContact CE1-CD1 3.41Å; F20-L83 HydrophobicContact CE1-CG 4.28Å; F20-L83 HydrophobicContact CE2-CB 3.75Å; F20-L83 HydrophobicContact CE2-CD1 4.16Å; F20-L83 HydrophobicContact CE2-CG 4.47Å; F20-L83 HydrophobicContact CG-CB 3.99Å; F20-L83 HydrophobicContact CZ-CB 3.79Å; F20-L83 HydrophobicContact CZ-CD1 3.37Å; F20-L83 HydrophobicContact CZ-CG 4.13Å; I79-L83 HydrophobicContact CG2-CD1 3.74Å; I79-L83 VanDerWaalsContact O-CG 3.26Å; I79-L83 WeakPolarHBondContact O-CG 3.1Å; I79-L83 PolarHBondContact O-N 2.89Å; C80-L83 PolarHBondContact O-N 3.38Å; L81-L83 VanDerWaalsContact C-N 3.34Å; L81-L83 PolarHBondContact O-N 3.24Å; L83-G86 PolarHBondContact O-N 3.31Å; L83-R87 WeakPolarHBondContact O-CB 3.49Å; L83-R87 PolarHBondContact O-N 2.93Å
84	H	98.8	Very high	98.7	Very high	38 Å²	38	51.8 Å²	51.8	18%	0.176	27%	0.266	C	S	.	.	H	α-helix	trans	-64.6	-45.6	175.6	-169.9	96.3	0	0	0	112.4	F20 G21 L24 C80 L81 R87 G88	F20-H84 HydrophobicContact CB-CB 3.89Å; G21-H84 PolarHBondContact N-ND1 3.17Å; L24-H84 HydrophobicContact CD1-CB 3.74Å; C80-H84 WeakPolarHBondContact O-CB 3.19Å; C80-H84 PolarHBondContact O-N 3.48Å; L81-H84 PolarHBondContact O-N 3.19Å; H84-R87 PolarHBondContact CE1-NH2 3.36Å; H84-R87 PolarHBondContact ND1-NH2 2.87Å; H84-G88 PolarHBondContact O-N 3.01Å; H84-G88 VanDerWaalsContact O-N 3.09Å
85	V	98.9	Very high	98.6	Very high	44 Å²	44	54.6 Å²	54.6	27%	0.267	28%	0.28	S	S	.	.	H	α-helix	trans	-64.7	-45.6	175.3	171.8	0	0	0	0	110.4	L81 R87 G88 L89 W100	L81-V85 WeakPolarHBondContact O-CB 3.36Å; L81-V85 VanDerWaalsContact O-CG2 3.31Å; L81-V85 WeakPolarHBondContact O-CG2 3.26Å; L81-V85 PolarHBondContact O-N 3.32Å; V85-R87 VanDerWaalsContact C-N 3.34Å; V85-R87 PolarHBondContact O-N 3.35Å; V85-G88 WeakPolarHBondContact O-CA 3.1Å; V85-G88 PolarHBondContact O-N 2.98Å; V85-L89 HydrophobicContact CG1-CD1 4.2Å; V85-L89 HydrophobicContact CG1-CG 4.44Å; V85-L89 WeakPolarHBondContact O-CG 3.42Å; V85-L89 PolarHBondContact O-N 3.23Å; V85-W100 HydrophobicContact CG1-CH2 4.23Å
86	G	98.8	Very high	98.6	Very high	33 Å²	33	53.5 Å²	53.5	34%	0.34	27%	0.267	S	S	.	.	H	α-helix	trans	-58	-43.8	177.5	0	0	0	0	0	112.6	F82 L83 G88 L89 Y90	F82-G86 PolarHBondContact O-N 3.39Å; L83-G86 PolarHBondContact O-N 3.31Å; G86-G88 VanDerWaalsContact C-N 3.32Å; G86-G88 PolarHBondContact O-N 3.42Å; G86-L89 PolarHBondContact O-N 3.48Å; G86-Y90 WeakPolarHBondContact O-CB 3.3Å; G86-Y90 PolarHBondContact O-N 2.92Å
87	R	98.8	Very high	98.6	Very high	22 Å²	22	57.6 Å²	57.6	8%	0.083	29%	0.286	C	S	.	.	H	α-helix	trans	-56	-48.3	170.1	177.7	-77.7	-65.4	-97	-4.9	110.8	W17 W18 L83 H84 V85 L89 Y90 Y91	W17-R87 HydrophobicContact CB-CB 4.14Å; W17-R87 HydrophobicContact CB-CG 3.62Å; W17-R87 HydrophobicContact CE3-CB 4.46Å; W18-R87 HydrophobicContact CE3-CG 4.18Å; W18-R87 HydrophobicContact CH2-CG 4.41Å; W18-R87 HydrophobicContact CZ3-CG 4.02Å; W18-R87 VanDerWaalsContact NE1-NH1 3.19Å; L83-R87 WeakPolarHBondContact O-CB 3.49Å; L83-R87 PolarHBondContact O-N 2.93Å; H84-R87 PolarHBondContact CE1-NH2 3.36Å; H84-R87 PolarHBondContact ND1-NH2 2.87Å; V85-R87 VanDerWaalsContact C-N 3.34Å; V85-R87 PolarHBondContact O-N 3.35Å; R87-L89 VanDerWaalsContact C-N 3.31Å; R87-L89 PolarHBondContact O-N 2.83Å; R87-Y90 PolarHBondContact O-N 3.29Å; R87-Y91 HydrophobicContact CG-CD2 3.79Å; R87-Y91 HydrophobicContact CG-CE2 4.14Å; R87-Y91 WeakPolarHBondContact O-CD2 3.4Å; R87-Y91 PolarHBondContact O-N 3.3Å
88	G	98.7	Very high	98.6	Very high	3 Å²	3	61.9 Å²	61.9	3%	0.031	31%	0.307	C	S	.	.	H	α-helix	trans	-62.4	-38.1	-177.2	0	0	0	0	0	113.2	H84 V85 G86 G92 S93	H84-G88 PolarHBondContact O-N 3.01Å; H84-G88 VanDerWaalsContact O-N 3.09Å; V85-G88 WeakPolarHBondContact O-CA 3.1Å; V85-G88 PolarHBondContact O-N 2.98Å; G86-G88 VanDerWaalsContact C-N 3.32Å; G86-G88 PolarHBondContact O-N 3.42Å; G88-G92 CarbonylContact O-C 3.59Å; G88-G92 PolarHBondContact O-N 2.92Å; G88-S93 PolarHBondContact O-N 2.86Å
89	L	98.7	Very high	98.6	Very high	97 Å²	97	60.4 Å²	60.4	51%	0.508	30%	0.301	S	S	.	.	H	α-helix	trans	-66.6	-51.6	172.7	-66.5	173.6	0	0	0	111.7	V85 G86 R87 Y91 G92 Y94 W100	V85-L89 HydrophobicContact CG1-CD1 4.2Å; V85-L89 HydrophobicContact CG1-CG 4.44Å; V85-L89 WeakPolarHBondContact O-CG 3.42Å; V85-L89 PolarHBondContact O-N 3.23Å; G86-L89 PolarHBondContact O-N 3.48Å; R87-L89 VanDerWaalsContact C-N 3.31Å; R87-L89 PolarHBondContact O-N 2.83Å; L89-Y91 PolarHBondContact O-N 3.41Å; L89-G92 PolarHBondContact O-N 3.47Å; L89-Y94 HydrophobicContact CD2-CD1 4.39Å; L89-W100 HydrophobicContact CD2-CH2 3.77Å; L89-W100 HydrophobicContact CD2-CZ2 3.88Å; L89-W100 HydrophobicContact CG-CH2 3.99Å
90	Y	98.7	Very high	98.6	Very high	184 Å²	184	59.3 Å²	59.3	72%	0.722	29%	0.291	S	S	*	.	H	α-helix	trans	-62.3	-42.2	-174.2	-174.7	-91.3	0	0	0	112.7	G86 R87	G86-Y90 WeakPolarHBondContact O-CB 3.3Å; G86-Y90 PolarHBondContact O-N 2.92Å; R87-Y90 PolarHBondContact O-N 3.29Å
91	Y	98.6	Very high	98.6	Very high	48 Å²	48	63.3 Å²	63.3	19%	0.188	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95	11.6	-178.1	-63.9	-73.1	0	0	0	113.8	W17 W18 R87 L89 S93 N193 P195	W17-Y91 HydrophobicContact CB-CE2 4.41Å; W17-Y91 HydrophobicContact CG-CE2 4.4Å; W18-Y91 HydrophobicContact CH2-CD1 4.17Å; W18-Y91 AromaticContact CH2-CD2 3.54Å; W18-Y91 HydrophobicContact CH2-CD2 3.54Å; W18-Y91 AromaticContact CH2-CE2 3.99Å; W18-Y91 HydrophobicContact CH2-CE2 3.99Å; W18-Y91 AromaticContact CH2-CG 3.63Å; W18-Y91 HydrophobicContact CH2-CG 3.63Å; W18-Y91 AromaticContact CZ3-CD2 3.61Å; W18-Y91 HydrophobicContact CZ3-CD2 3.61Å; W18-Y91 AromaticContact CZ3-CE2 3.59Å; W18-Y91 HydrophobicContact CZ3-CE2 3.59Å; W18-Y91 HydrophobicContact CZ3-CG 4.12Å; R87-Y91 HydrophobicContact CG-CD2 3.79Å; R87-Y91 HydrophobicContact CG-CE2 4.14Å; R87-Y91 WeakPolarHBondContact O-CD2 3.4Å; R87-Y91 PolarHBondContact O-N 3.3Å; L89-Y91 PolarHBondContact O-N 3.41Å; Y91-S93 PolarHBondContact O-N 3.06Å; Y91-N193 PolarHBondContact O-ND2 3.35Å; Y91-P195 HydrophobicContact CD1-CB 4.32Å; Y91-P195 HydrophobicContact CE1-CB 3.72Å; Y91-P195 HydrophobicContact CE1-CG 4.47Å
92	G	98.4	Very high	98.6	Very high	20 Å²	20	64 Å²	64	21%	0.206	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.1	23.1	178	0	0	0	0	0	114.6	G88 L89 Y94 T95	G88-G92 CarbonylContact O-C 3.59Å; G88-G92 PolarHBondContact O-N 2.92Å; L89-G92 PolarHBondContact O-N 3.47Å; G92-Y94 PolarHBondContact O-N 3.46Å; G92-T95 WeakPolarHBondContact O-CG2 3.38Å; G92-T95 PolarHBondContact O-N 2.82Å; G92-T95 PolarHBondContact O-OG1 3.09Å
93	S	98.4	Very high	98.6	Very high	17 Å²	17	58.9 Å²	58.9	12%	0.119	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-71.7	-12.2	-178	-50	0	0	0	0	113	G88 Y91 T95 F96 N193	G88-S93 PolarHBondContact O-N 2.86Å; Y91-S93 PolarHBondContact O-N 3.06Å; S93-T95 PolarHBondContact O-N 3.24Å; S93-F96 PolarHBondContact O-N 2.91Å; S93-N193 PolarHBondContact OG-ND2 3.48Å
94	Y	98.4	Very high	98.6	Very high	107 Å²	107	58.4 Å²	58.4	42%	0.42	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-63.6	-13.4	171.9	60.5	-101.6	0	0	0	113.6	L89 G92 F96	L89-Y94 HydrophobicContact CD2-CD1 4.39Å; G92-Y94 PolarHBondContact O-N 3.46Å; Y94-F96 PolarHBondContact O-N 2.98Å
95	T	98.2	Very high	98.6	Very high	87 Å²	87	61.1 Å²	61.1	53%	0.534	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-65.7	-19.9	173.3	53.6	0	0	0	0	113.1	G92 S93 M97	G92-T95 WeakPolarHBondContact O-CG2 3.38Å; G92-T95 PolarHBondContact O-N 2.82Å; G92-T95 PolarHBondContact O-OG1 3.09Å; S93-T95 PolarHBondContact O-N 3.24Å; T95-M97 VanDerWaalsContact C-N 3.27Å; T95-M97 PolarHBondContact O-N 3.45Å
96	F	98.2	Very high	98.6	Very high	49 Å²	49	60 Å²	60	22%	0.215	31%	0.307	C	S	.	.	S	Bend	trans	-78.8	78.5	165.8	-56.4	-32.7	0	0	0	109.4	S93 Y94 E98 T99 W100 T190 N193	S93-F96 PolarHBondContact O-N 2.91Å; Y94-F96 PolarHBondContact O-N 2.98Å; F96-E98 PolarHBondContact O-N 3.01Å; F96-T99 PolarHBondContact O-N 3.27Å; F96-W100 VanDerWaalsContact O-CB 3.29Å; F96-W100 WeakPolarHBondContact O-CB 3.36Å; F96-W100 PolarHBondContact O-N 3.31Å; F96-T190 HydrophobicContact CD1-CG2 4.25Å; F96-T190 HydrophobicContact CE1-CG2 4.48Å; F96-N193 HydrophobicContact CE2-CB 3.7Å; F96-N193 HydrophobicContact CZ-CB 4.01Å
97	M	98.4	Very high	98.6	Very high	105 Å²	105	60.1 Å²	60.1	52%	0.517	30%	0.3	S	S	.	.	H	α-helix	trans	-58.5	-42.2	-163.5	-64.8	-64.7	-85	0	0	113.4	T95 N101	T95-M97 VanDerWaalsContact C-N 3.27Å; T95-M97 PolarHBondContact O-N 3.45Å; M97-N101 VanDerWaalsContact O-CB 3.25Å; M97-N101 WeakPolarHBondContact O-CB 3.42Å; M97-N101 PolarHBondContact O-N 3.3Å; M97-N101 PolarHBondContact O-ND2 3.42Å
98	E	98.5	Very high	98.6	Very high	107 Å²	107	64.9 Å²	64.9	50%	0.5	32%	0.322	S	S	.	.	H	α-helix	trans	-65	-53.6	179.4	-62	76.7	-173.5	0	0	110.2	F96 W100 N101 I102 F186	F96-E98 PolarHBondContact O-N 3.01Å; E98-W100 VanDerWaalsContact C-N 3.31Å; E98-W100 PolarHBondContact O-N 3.33Å; E98-N101 PolarHBondContact O-N 3.4Å; E98-I102 WeakPolarHBondContact O-CG1 3.44Å; E98-I102 PolarHBondContact O-N 2.81Å; E98-F186 HydrophobicContact CB-CB 4.1Å; E98-F186 HydrophobicContact CB-CD1 3.55Å; E98-F186 HydrophobicContact CB-CD2 4.04Å; E98-F186 HydrophobicContact CB-CE1 3.88Å; E98-F186 HydrophobicContact CB-CE2 4.32Å; E98-F186 HydrophobicContact CB-CG 3.64Å; E98-F186 HydrophobicContact CB-CZ 4.25Å; E98-F186 HydrophobicContact CG-CD1 3.98Å; E98-F186 HydrophobicContact CG-CE1 3.92Å; E98-F186 HydrophobicContact CG-CZ 4.42Å
99	T	98.8	Very high	98.6	Very high	12 Å²	12	65.5 Å²	65.5	7%	0.074	33%	0.327	C	S	.	.	H	α-helix	trans	-55.6	-47.3	175.8	-57	0	0	0	0	110.9	F96 I102 G103 H183 F186 L187	F96-T99 PolarHBondContact O-N 3.27Å; T99-I102 PolarHBondContact O-N 3.21Å; T99-G103 PolarHBondContact O-N 3.46Å; T99-H183 WeakPolarHBondContact CG2-CE1 3.42Å; T99-H183 PolarHBondContact O-CE1 2.9Å; T99-H183 PolarHBondContact O-ND1 3.03Å; T99-F186 VanDerWaalsContact OG1-C 3.28Å; T99-F186 WeakPolarHBondContact OG1-CB 3.22Å; T99-L187 HydrophobicContact CG2-CB 4.07Å; T99-L187 HydrophobicContact CG2-CD1 4.39Å; T99-L187 PolarHBondContact OG1-N 3.46Å
100	W	98.8	Very high	98.6	Very high	67 Å²	67	61.3 Å²	61.3	25%	0.254	31%	0.305	S	S	.	.	H	α-helix	trans	-62.7	-48.2	-179.7	-177	-101.3	0	0	0	112.5	V85 L89 F96 E98 I102 G103 V104	V85-W100 HydrophobicContact CG1-CH2 4.23Å; L89-W100 HydrophobicContact CD2-CH2 3.77Å; L89-W100 HydrophobicContact CD2-CZ2 3.88Å; L89-W100 HydrophobicContact CG-CH2 3.99Å; F96-W100 VanDerWaalsContact O-CB 3.29Å; F96-W100 WeakPolarHBondContact O-CB 3.36Å; F96-W100 PolarHBondContact O-N 3.31Å; E98-W100 VanDerWaalsContact C-N 3.31Å; E98-W100 PolarHBondContact O-N 3.33Å; W100-I102 PolarHBondContact O-N 2.92Å; W100-G103 CarbonylContact O-C 3.51Å; W100-G103 VanDerWaalsContact O-CA 3.29Å; W100-G103 WeakPolarHBondContact O-CA 3.49Å; W100-G103 PolarHBondContact O-N 3.28Å; W100-V104 PolarHBondContact O-N 3.31Å
101	N	98.8	Very high	98.6	Very high	87 Å²	87	56.8 Å²	56.8	47%	0.465	29%	0.291	S	S	.	.	H	α-helix	trans	-65.5	-38.8	-179.5	-73.3	-35.4	0	0	0	112	M97 E98 G103 V104 L105	M97-N101 VanDerWaalsContact O-CB 3.25Å; M97-N101 WeakPolarHBondContact O-CB 3.42Å; M97-N101 PolarHBondContact O-N 3.3Å; M97-N101 PolarHBondContact O-ND2 3.42Å; E98-N101 PolarHBondContact O-N 3.4Å; N101-G103 VanDerWaalsContact C-N 3.27Å; N101-G103 PolarHBondContact O-N 3.22Å; N101-V104 PolarHBondContact O-N 3.19Å; N101-L105 PolarHBondContact O-N 3.26Å
102	I	98.8	Very high	98.6	Very high	27 Å²	27	56.4 Å²	56.4	14%	0.138	30%	0.298	C	S	.	.	H	α-helix	trans	-63.4	-36.9	170.1	-61.1	-61.8	0	0	0	110.7	E98 T99 W100 V104 L105 L106 V182 H183 F186	E98-I102 WeakPolarHBondContact O-CG1 3.44Å; E98-I102 PolarHBondContact O-N 2.81Å; T99-I102 PolarHBondContact O-N 3.21Å; W100-I102 PolarHBondContact O-N 2.92Å; I102-V104 VanDerWaalsContact C-N 3.32Å; I102-V104 PolarHBondContact O-N 3.41Å; I102-L105 HydrophobicContact CD1-CD1 4.2Å; I102-L105 PolarHBondContact O-N 3.2Å; I102-L106 HydrophobicContact CG2-CD1 4.25Å; I102-L106 WeakPolarHBondContact O-CG 3.31Å; I102-L106 PolarHBondContact O-N 3.05Å; I102-V182 HydrophobicContact CD1-CG1 4.22Å; I102-V182 HydrophobicContact CG1-CG1 4.28Å; I102-H183 HydrophobicContact CB-CB 4.41Å; I102-H183 HydrophobicContact CG2-CB 3.67Å; I102-F186 HydrophobicContact CG1-CD2 4.21Å; I102-F186 HydrophobicContact CG1-CE2 4.39Å
103	G	98.8	Very high	98.7	Very high	23 Å²	23	56 Å²	56	24%	0.237	29%	0.292	C	S	.	.	H	α-helix	trans	-59.3	-39.5	172.9	0	0	0	0	0	113.3	T99 W100 N101 L106 L107 H183	T99-G103 PolarHBondContact O-N 3.46Å; W100-G103 CarbonylContact O-C 3.51Å; W100-G103 VanDerWaalsContact O-CA 3.29Å; W100-G103 WeakPolarHBondContact O-CA 3.49Å; W100-G103 PolarHBondContact O-N 3.28Å; N101-G103 VanDerWaalsContact C-N 3.27Å; N101-G103 PolarHBondContact O-N 3.22Å; G103-L106 WeakPolarHBondContact O-CB 3.48Å; G103-L106 PolarHBondContact O-N 3.48Å; G103-L107 PolarHBondContact O-N 3.06Å; G103-H183 PolarHBondContact N-ND1 2.85Å
104	V	98.8	Very high	98.7	Very high	50 Å²	50	56.7 Å²	56.7	30%	0.303	30%	0.298	S	S	.	.	H	α-helix	trans	-65.6	-42.3	173.7	174.3	0	0	0	0	111.2	W100 N101 I102 L106 L107 F108	W100-V104 PolarHBondContact O-N 3.31Å; N101-V104 PolarHBondContact O-N 3.19Å; I102-V104 VanDerWaalsContact C-N 3.32Å; I102-V104 PolarHBondContact O-N 3.41Å; V104-L106 PolarHBondContact O-N 3.45Å; V104-L107 WeakPolarHBondContact O-CB 3.45Å; V104-L107 PolarHBondContact O-N 2.87Å; V104-F108 HydrophobicContact CG1-CD2 3.82Å; V104-F108 HydrophobicContact CG1-CE2 3.47Å; V104-F108 VanDerWaalsContact CG1-CE2 3.47Å; V104-F108 HydrophobicContact CG1-CZ 4.48Å; V104-F108 VanDerWaalsContact O-CD2 3.26Å; V104-F108 WeakPolarHBondContact O-CD2 3.42Å; V104-F108 PolarHBondContact O-N 3.49Å; V104-F108 VanDerWaalsContact O-N 3.1Å
105	L	98.8	Very high	98.7	Very high	94 Å²	94	53.9 Å²	53.9	49%	0.492	29%	0.288	S	S	.	.	H	α-helix	trans	-62.3	-42.2	174.4	-66.2	179.9	0	0	0	112	N101 I102 L107 F108 A109	N101-L105 PolarHBondContact O-N 3.26Å; I102-L105 HydrophobicContact CD1-CD1 4.2Å; I102-L105 PolarHBondContact O-N 3.2Å; L105-L107 PolarHBondContact O-N 3.35Å; L105-F108 PolarHBondContact O-N 2.84Å; L105-A109 WeakPolarHBondContact O-CB 3.48Å; L105-A109 PolarHBondContact O-N 2.93Å
106	L	98.9	Very high	98.7	Very high	21 Å²	21	50.6 Å²	50.6	11%	0.11	27%	0.267	C	S	.	.	H	α-helix	trans	-59.3	-44.8	174.4	-79.7	166.4	0	0	0	111.6	I102 G103 V104 F108 A109 V110 I176 L179 A180 H183	I102-L106 HydrophobicContact CG2-CD1 4.25Å; I102-L106 WeakPolarHBondContact O-CG 3.31Å; I102-L106 PolarHBondContact O-N 3.05Å; G103-L106 WeakPolarHBondContact O-CB 3.48Å; G103-L106 PolarHBondContact O-N 3.48Å; V104-L106 PolarHBondContact O-N 3.45Å; L106-F108 PolarHBondContact O-N 3.29Å; L106-A109 PolarHBondContact O-N 2.91Å; L106-V110 WeakPolarHBondContact O-CG2 3.37Å; L106-V110 PolarHBondContact O-N 3.34Å; L106-I176 HydrophobicContact CD2-CG2 3.79Å; L106-I176 WeakPolarHBondContact CD2-O 3.45Å; L106-L179 HydrophobicContact CD2-CB 3.56Å; L106-L179 HydrophobicContact CG-CB 4.05Å; L106-A180 HydrophobicContact CD2-CB 4.41Å; L106-H183 HydrophobicContact CD1-CB 3.82Å
107	L	98.8	Very high	98.7	Very high	35 Å²	35	49.1 Å²	49.1	18%	0.183	27%	0.266	C	S	.	.	H	α-helix	trans	-56.8	-51.7	176.7	175.3	62.7	0	0	0	111.1	L81 G103 V104 L105 A109 V110 M111	L81-L107 HydrophobicContact CD1-CD1 4.21Å; G103-L107 PolarHBondContact O-N 3.06Å; V104-L107 WeakPolarHBondContact O-CB 3.45Å; V104-L107 PolarHBondContact O-N 2.87Å; L105-L107 PolarHBondContact O-N 3.35Å; L107-A109 VanDerWaalsContact C-N 3.35Å; L107-A109 PolarHBondContact O-N 2.92Å; L107-V110 PolarHBondContact O-N 3.12Å; L107-M111 HydrophobicContact CD1-CG 4.42Å; L107-M111 HydrophobicContact CD1-SD 4.23Å; L107-M111 HydrophobicContact CG-SD 4.08Å; L107-M111 VanDerWaalsContact O-CG 3.27Å; L107-M111 WeakPolarHBondContact O-CG 3.32Å; L107-M111 PolarHBondContact O-N 3.23Å
108	F	98.8	Very high	98.7	Very high	123 Å²	123	50.6 Å²	50.6	54%	0.539	27%	0.266	S	S	.	.	H	α-helix	trans	-65	-37.1	179.2	-71.6	-54.4	0	0	0	112.9	V104 L105 L106 M111 A112	V104-F108 HydrophobicContact CG1-CD2 3.82Å; V104-F108 HydrophobicContact CG1-CE2 3.47Å; V104-F108 VanDerWaalsContact CG1-CE2 3.47Å; V104-F108 HydrophobicContact CG1-CZ 4.48Å; V104-F108 VanDerWaalsContact O-CD2 3.26Å; V104-F108 WeakPolarHBondContact O-CD2 3.42Å; V104-F108 PolarHBondContact O-N 3.49Å; V104-F108 VanDerWaalsContact O-N 3.1Å; L105-F108 PolarHBondContact O-N 2.84Å; L106-F108 PolarHBondContact O-N 3.29Å; F108-M111 HydrophobicContact CD1-SD 4.11Å; F108-M111 PolarHBondContact O-N 3.4Å; F108-A112 WeakPolarHBondContact O-CB 3.49Å; F108-A112 PolarHBondContact O-N 3.32Å
109	A	98.8	Very high	98.8	Very high	16 Å²	16	45.5 Å²	45.5	13%	0.132	24%	0.243	C	C	.	.	H	α-helix	trans	-64.6	-42.8	176.3	0	0	0	0	0	111.9	L105 L106 L107 A112 T113 I176	L105-A109 WeakPolarHBondContact O-CB 3.48Å; L105-A109 PolarHBondContact O-N 2.93Å; L106-A109 PolarHBondContact O-N 2.91Å; L107-A109 VanDerWaalsContact C-N 3.35Å; L107-A109 PolarHBondContact O-N 2.92Å; A109-A112 PolarHBondContact O-N 3.24Å; A109-T113 WeakPolarHBondContact O-CB 3.44Å; A109-T113 PolarHBondContact O-N 3.32Å; A109-T113 PolarHBondContact O-OG1 3.27Å; A109-I176 HydrophobicContact CB-CD1 4.11Å; A109-I176 HydrophobicContact CB-CG1 3.68Å
110	V	98.9	Very high	98.8	Very high	9 Å²	9	45.7 Å²	45.7	6%	0.055	24%	0.243	C	C	.	.	H	α-helix	trans	-65.8	-40.7	175.2	175.9	0	0	0	0	110.9	F77 F78 L81 L106 L107 T113 A114 I176	F77-V110 HydrophobicContact CD2-CG1 4.22Å; F77-V110 HydrophobicContact CE2-CG1 4.2Å; F77-V110 HydrophobicContact CE2-CG2 3.91Å; F77-V110 HydrophobicContact CG-CG1 4.45Å; F77-V110 HydrophobicContact CZ-CG1 4.41Å; F77-V110 HydrophobicContact CZ-CG2 3.82Å; F78-V110 HydrophobicContact CE2-CG1 4.22Å; F78-V110 HydrophobicContact CZ-CG1 3.97Å; L81-V110 HydrophobicContact CD1-CB 3.97Å; L81-V110 HydrophobicContact CD1-CG1 3.65Å; L81-V110 HydrophobicContact CD1-CG2 4.32Å; L106-V110 WeakPolarHBondContact O-CG2 3.37Å; L106-V110 PolarHBondContact O-N 3.34Å; L107-V110 PolarHBondContact O-N 3.12Å; V110-T113 PolarHBondContact O-N 3.5Å; V110-A114 WeakPolarHBondContact O-CB 3.37Å; V110-A114 PolarHBondContact O-N 3.3Å; V110-I176 HydrophobicContact CG2-CD1 3.88Å; V110-I176 HydrophobicContact CG2-CG2 4.18Å
111	M	98.7	Very high	98.7	Very high	88 Å²	88	44.3 Å²	44.3	43%	0.433	24%	0.243	S	C	.	.	H	α-helix	trans	-57.2	-50.5	173.6	-72.5	173.7	71.3	0	0	112.3	F78 L107 F108 T113 A114 F115	F78-M111 HydrophobicContact CE1-CG 3.8Å; F78-M111 HydrophobicContact CZ-CG 4.14Å; L107-M111 HydrophobicContact CD1-CG 4.42Å; L107-M111 HydrophobicContact CD1-SD 4.23Å; L107-M111 HydrophobicContact CG-SD 4.08Å; L107-M111 VanDerWaalsContact O-CG 3.27Å; L107-M111 WeakPolarHBondContact O-CG 3.32Å; L107-M111 PolarHBondContact O-N 3.23Å; F108-M111 HydrophobicContact CD1-SD 4.11Å; F108-M111 PolarHBondContact O-N 3.4Å; M111-T113 VanDerWaalsContact C-N 3.35Å; M111-T113 PolarHBondContact O-N 2.99Å; M111-A114 PolarHBondContact O-N 3.5Å; M111-F115 WeakPolarHBondContact O-CB 3.33Å; M111-F115 PolarHBondContact O-N 3.46Å
112	A	98.6	Very high	98.7	Very high	40 Å²	40	42.2 Å²	42.2	33%	0.331	23%	0.228	S	C	.	.	H	α-helix	trans	-60.6	-45.8	177.3	0	0	0	0	0	111.4	F108 A109 F115 M116	F108-A112 WeakPolarHBondContact O-CB 3.49Å; F108-A112 PolarHBondContact O-N 3.32Å; A109-A112 PolarHBondContact O-N 3.24Å; A112-F115 PolarHBondContact O-N 3.07Å; A112-M116 HydrophobicContact CB-CE 4.04Å; A112-M116 WeakPolarHBondContact O-CE 3.36Å; A112-M116 PolarHBondContact O-N 2.9Å
113	T	98.9	Very high	98.7	Very high	12 Å²	12	41.9 Å²	41.9	7%	0.074	23%	0.232	C	C	.	.	H	α-helix	trans	-60	-49.5	179.8	-57.4	0	0	0	0	111.5	A109 V110 M111 M116 G117 H169 L172 P173 I176	A109-T113 WeakPolarHBondContact O-CB 3.44Å; A109-T113 PolarHBondContact O-N 3.32Å; A109-T113 PolarHBondContact O-OG1 3.27Å; V110-T113 PolarHBondContact O-N 3.5Å; M111-T113 VanDerWaalsContact C-N 3.35Å; M111-T113 PolarHBondContact O-N 2.99Å; T113-M116 PolarHBondContact O-N 2.9Å; T113-G117 PolarHBondContact O-N 3.44Å; T113-H169 PolarHBondContact O-CE1 3.1Å; T113-H169 PolarHBondContact O-ND1 3.49Å; T113-L172 HydrophobicContact CG2-CB 4.44Å; T113-L172 VanDerWaalsContact OG1-CB 3.25Å; T113-L172 WeakPolarHBondContact OG1-CB 3.38Å; T113-P173 HydrophobicContact CG2-CG 3.86Å; T113-I176 WeakPolarHBondContact OG1-CD1 3.48Å
114	A	98.7	Very high	98.6	Very high	31 Å²	31	47.3 Å²	47.3	26%	0.256	25%	0.251	S	S	.	.	H	α-helix	trans	-66.2	-40.4	-179.1	0	0	0	0	0	112.3	F78 V110 M111 G117 Y118	F78-A114 HydrophobicContact CE2-CB 3.53Å; F78-A114 HydrophobicContact CZ-CB 3.93Å; V110-A114 WeakPolarHBondContact O-CB 3.37Å; V110-A114 PolarHBondContact O-N 3.3Å; M111-A114 PolarHBondContact O-N 3.5Å; A114-G117 PolarHBondContact O-N 3.36Å; A114-Y118 PolarHBondContact O-N 3.31Å
115	F	98.8	Very high	98.5	Very high	48 Å²	48	51.3 Å²	51.3	21%	0.211	27%	0.268	C	S	.	.	H	α-helix	trans	-56.8	-52.5	173.7	164.4	-110.8	0	0	0	111.2	M111 A112 G117 Y118 V119 I133 T134 F165	M111-F115 WeakPolarHBondContact O-CB 3.33Å; M111-F115 PolarHBondContact O-N 3.46Å; A112-F115 PolarHBondContact O-N 3.07Å; F115-G117 VanDerWaalsContact C-N 3.31Å; F115-G117 PolarHBondContact O-N 3.25Å; F115-Y118 WeakPolarHBondContact O-CB 3.46Å; F115-Y118 PolarHBondContact O-N 3.35Å; F115-Y118 VanDerWaalsContact O-N 3.17Å; F115-V119 HydrophobicContact CE2-CG2 4.34Å; F115-V119 HydrophobicContact CZ-CG2 4.44Å; F115-V119 WeakPolarHBondContact O-CG2 3.33Å; F115-V119 PolarHBondContact O-N 2.82Å; F115-I133 HydrophobicContact CD2-CD1 3.72Å; F115-I133 HydrophobicContact CD2-CG2 4.3Å; F115-I133 HydrophobicContact CE1-CG2 4.36Å; F115-I133 HydrophobicContact CE2-CB 3.77Å; F115-I133 HydrophobicContact CE2-CD1 3.56Å; F115-I133 HydrophobicContact CE2-CG1 4.22Å; F115-I133 HydrophobicContact CE2-CG2 3.84Å; F115-I133 HydrophobicContact CZ-CB 3.96Å; F115-I133 HydrophobicContact CZ-CG2 3.86Å; F115-T134 HydrophobicContact CE1-CG2 4.24Å; F115-T134 HydrophobicContact CZ-CG2 4.09Å; F115-F165 AromaticContact CE1-CE2 3.83Å; F115-F165 HydrophobicContact CE1-CE2 3.83Å; F115-F165 HydrophobicContact CE1-CZ 4.16Å; F115-F165 HydrophobicContact CZ-CE2 4.15Å
116	M	98.6	Very high	98.5	Very high	18 Å²	18	47.1 Å²	47.1	9%	0.089	25%	0.247	C	C	.	.	H	α-helix	trans	-63.7	-37.3	179.1	-73.4	178.7	-82	0	0	112.3	A112 T113 Y118 V119 L120 F165 F168 H169 L172	A112-M116 HydrophobicContact CB-CE 4.04Å; A112-M116 WeakPolarHBondContact O-CE 3.36Å; A112-M116 PolarHBondContact O-N 2.9Å; T113-M116 PolarHBondContact O-N 2.9Å; M116-Y118 VanDerWaalsContact C-N 3.3Å; M116-Y118 PolarHBondContact O-N 3.49Å; M116-V119 WeakPolarHBondContact O-CB 3.36Å; M116-V119 PolarHBondContact O-N 3.14Å; M116-V119 VanDerWaalsContact O-N 3.1Å; M116-L120 WeakPolarHBondContact O-CG 3.48Å; M116-F165 HydrophobicContact CB-CB 4.42Å; M116-F165 HydrophobicContact CB-CD2 4.3Å; M116-F165 HydrophobicContact CB-CG 4.44Å; M116-F165 HydrophobicContact CG-CB 4.39Å; M116-F165 HydrophobicContact CG-CD1 4.32Å; M116-F165 HydrophobicContact CG-CD2 3.85Å; M116-F165 HydrophobicContact CG-CE2 4.15Å; M116-F165 HydrophobicContact CG-CG 3.95Å; M116-F165 HydrophobicContact SD-CD1 4.33Å; M116-F165 HydrophobicContact SD-CG 4.42Å; M116-F168 HydrophobicContact CE-CB 4.15Å; M116-F168 HydrophobicContact SD-CB 3.46Å; M116-F168 WeakPolarHBondContact SD-CB 3.46Å; M116-F168 HydrophobicContact SD-CD2 4.45Å; M116-F168 HydrophobicContact SD-CG 4.3Å; M116-H169 HydrophobicContact CB-CB 4.06Å; M116-L172 HydrophobicContact CE-CD1 3.2Å
117	G	98.6	Very high	98.4	Very high	18 Å²	18	48.8 Å²	48.8	19%	0.186	25%	0.253	C	S	.	.	H	α-helix	trans	-60.1	-39.2	174.6	0	0	0	0	0	112.8	T113 A114 F115 V119 L120 P121 H169	T113-G117 PolarHBondContact O-N 3.44Å; A114-G117 PolarHBondContact O-N 3.36Å; F115-G117 VanDerWaalsContact C-N 3.31Å; F115-G117 PolarHBondContact O-N 3.25Å; G117-V119 PolarHBondContact O-N 3.46Å; G117-L120 PolarHBondContact O-N 3.32Å; G117-P121 WeakPolarHBondContact O-CD 3.25Å; G117-H169 WeakPolarHBondContact CA-CE1 3.46Å; G117-H169 VanDerWaalsContact CA-ND1 3.3Å; G117-H169 WeakPolarHBondContact CA-ND1 3.49Å; G117-H169 PolarHBondContact N-ND1 3.37Å
118	Y	98.6	Very high	98.4	Very high	136 Å²	136	54 Å²	54	53%	0.533	27%	0.27	S	S	.	.	H	α-helix	trans	-67	-21.1	176.9	-168.6	-101.8	0	0	0	113.3	A114 F115 M116 P121 M125 S126	A114-Y118 PolarHBondContact O-N 3.31Å; F115-Y118 WeakPolarHBondContact O-CB 3.46Å; F115-Y118 PolarHBondContact O-N 3.35Å; F115-Y118 VanDerWaalsContact O-N 3.17Å; M116-Y118 VanDerWaalsContact C-N 3.3Å; M116-Y118 PolarHBondContact O-N 3.49Å; Y118-P121 WeakPolarHBondContact O-CD 3.27Å; Y118-M125 HydrophobicContact CE1-CB 4.01Å; Y118-M125 WeakPolarHBondContact OH-CB 3.39Å; Y118-S126 VanDerWaalsContact O-CB 3.29Å; Y118-S126 WeakPolarHBondContact O-CB 3.49Å; Y118-S126 PolarHBondContact O-OG 2.69Å
119	V	98.8	Very high	98.3	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-76.9	-30	176	-178.4	0	0	0	0	111.9	F115 M116 G117 W122 A130 F165	F115-V119 HydrophobicContact CE2-CG2 4.34Å; F115-V119 HydrophobicContact CZ-CG2 4.44Å; F115-V119 WeakPolarHBondContact O-CG2 3.33Å; F115-V119 PolarHBondContact O-N 2.82Å; M116-V119 WeakPolarHBondContact O-CB 3.36Å; M116-V119 PolarHBondContact O-N 3.14Å; M116-V119 VanDerWaalsContact O-N 3.1Å; G117-V119 PolarHBondContact O-N 3.46Å; V119-W122 HydrophobicContact CG1-CE3 4.02Å; V119-W122 HydrophobicContact CG1-CZ3 3.78Å; V119-W122 PolarHBondContact O-N 3.46Å; V119-A130 HydrophobicContact CG1-CB 4.05Å; V119-A130 HydrophobicContact CG2-CB 3.77Å; V119-F165 HydrophobicContact CB-CD2 3.92Å; V119-F165 HydrophobicContact CG1-CD2 3.93Å; V119-F165 HydrophobicContact CG2-CD2 3.89Å; V119-F165 HydrophobicContact CG2-CE2 4.04Å
120	L	98.8	Very high	98.3	Very high	17 Å²	17	48.4 Å²	48.4	9%	0.089	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-36.6	-170.5	-54.3	-175.7	0	0	0	115.5	Y42 M116 G117 W122 L162 F165 F166 H169	Y42-L120 HydrophobicContact CE2-CB 4.42Å; Y42-L120 WeakPolarHBondContact CE2-O 3.31Å; Y42-L120 PolarHBondContact OH-O 3.06Å; M116-L120 WeakPolarHBondContact O-CG 3.48Å; G117-L120 PolarHBondContact O-N 3.32Å; L120-W122 PolarHBondContact O-N 3.28Å; L120-L162 HydrophobicContact CD2-CD1 4.16Å; L120-F165 HydrophobicContact CD2-CB 4.45Å; L120-F166 HydrophobicContact CD1-CD2 4.02Å; L120-F166 HydrophobicContact CD2-CB 3.9Å; L120-H169 HydrophobicContact CD1-CB 4.22Å; L120-H169 VanDerWaalsContact CD1-CD2 3.46Å; L120-H169 WeakPolarHBondContact CD1-CD2 3.44Å
121	P	98.5	Very high	98.2	Very high	38 Å²	38	49.4 Å²	49.4	25%	0.247	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-13.7	175.3	-24	35.3	0	0	0	114.3	F50 G117 Y118 G123	F50-P121 WeakPolarHBondContact CA-O 3.48Å; F50-P121 WeakPolarHBondContact CD2-O 3.36Å; G117-P121 WeakPolarHBondContact O-CD 3.25Å; Y118-P121 WeakPolarHBondContact O-CD 3.27Å; P121-G123 PolarHBondContact O-N 3.18Å
122	W	98.4	Very high	98.2	Very high	42 Å²	42	49.7 Å²	49.7	16%	0.159	26%	0.262	C	S	.	.			trans	54	36.3	177.3	-151.5	-114.6	0	0	0	114.3	T46 A49 V119 L120 F127 V157 L162	T46-W122 HydrophobicContact CG2-CD2 4.47Å; T46-W122 HydrophobicContact CG2-CH2 4.27Å; T46-W122 HydrophobicContact CG2-CZ2 3.53Å; A49-W122 HydrophobicContact CB-CB 3.87Å; V119-W122 HydrophobicContact CG1-CE3 4.02Å; V119-W122 HydrophobicContact CG1-CZ3 3.78Å; V119-W122 PolarHBondContact O-N 3.46Å; L120-W122 PolarHBondContact O-N 3.28Å; W122-F127 HydrophobicContact CH2-CD2 4.05Å; W122-F127 AromaticContact CZ2-CD2 3.83Å; W122-F127 HydrophobicContact CZ2-CD2 3.83Å; W122-F127 HydrophobicContact CZ2-CE2 4.25Å; W122-V157 HydrophobicContact CH2-CG1 3.56Å; W122-V157 HydrophobicContact CZ3-CG1 4.04Å; W122-L162 HydrophobicContact CB-CD2 4.47Å; W122-L162 HydrophobicContact CD2-CD1 4.44Å; W122-L162 HydrophobicContact CD2-CD2 3.86Å; W122-L162 HydrophobicContact CE3-CB 4.24Å; W122-L162 HydrophobicContact CE3-CD1 3.66Å; W122-L162 HydrophobicContact CE3-CD2 3.88Å; W122-L162 HydrophobicContact CE3-CG 4.14Å; W122-L162 HydrophobicContact CG-CD2 4.14Å; W122-L162 HydrophobicContact CH2-CB 4.16Å; W122-L162 HydrophobicContact CZ3-CB 3.88Å; W122-L162 HydrophobicContact CZ3-CD1 3.98Å; W122-L162 HydrophobicContact CZ3-CD2 4.34Å; W122-L162 HydrophobicContact CZ3-CG 4.28Å
123	G	97.9	Very high	98.2	Very high	20 Å²	20	51.8 Å²	51.8	21%	0.206	27%	0.267	C	S	.	.			trans	-82.4	178.1	170.3	0	0	0	0	0	112.7	P121 M125 S126 F127	P121-G123 PolarHBondContact O-N 3.18Å; G123-M125 PolarHBondContact O-N 2.89Å; G123-S126 PolarHBondContact N-OG 3.46Å; G123-S126 VanDerWaalsContact O-CB 3.28Å; G123-S126 WeakPolarHBondContact O-CB 3.43Å; G123-S126 PolarHBondContact O-N 3.48Å; G123-S126 VanDerWaalsContact O-N 3.14Å; G123-F127 PolarHBondContact O-N 3.4Å
124	Q	97.8	Very high	98.1	Very high	138 Å²	138	51.7 Å²	51.7	65%	0.645	27%	0.266	S	S	*	.	H	α-helix	trans	-55.4	-50.6	178.7	-73.5	-70.4	-2.4	0	0	112.4	S126 F127 W128	Q124-S126 VanDerWaalsContact C-N 3.29Å; Q124-S126 PolarHBondContact O-N 2.86Å; Q124-F127 PolarHBondContact O-N 3.46Å; Q124-W128 PolarHBondContact O-N 3.19Å
125	M	97	Very high	98.1	Very high	133 Å²	133	53.6 Å²	53.6	66%	0.655	27%	0.272	S	S	*	.	H	α-helix	trans	-66.2	-32.8	179.3	-64	-57.8	-179	0	0	112.5	Y118 G123 G129	Y118-M125 HydrophobicContact CE1-CB 4.01Å; Y118-M125 WeakPolarHBondContact OH-CB 3.39Å; G123-M125 PolarHBondContact O-N 2.89Å; M125-G129 WeakPolarHBondContact O-CA 3.49Å; M125-G129 PolarHBondContact O-N 2.99Å
126	S	97.2	Very high	98	Very high	7 Å²	7	57.2 Å²	57.2	5%	0.049	29%	0.293	C	S	.	.	H	α-helix	trans	-60.9	-50.4	174.1	-58.9	0	0	0	0	111.1	Y118 G123 Q124 A130	Y118-S126 VanDerWaalsContact O-CB 3.29Å; Y118-S126 WeakPolarHBondContact O-CB 3.49Å; Y118-S126 PolarHBondContact O-OG 2.69Å; G123-S126 PolarHBondContact N-OG 3.46Å; G123-S126 VanDerWaalsContact O-CB 3.28Å; G123-S126 WeakPolarHBondContact O-CB 3.43Å; G123-S126 PolarHBondContact O-N 3.48Å; G123-S126 VanDerWaalsContact O-N 3.14Å; Q124-S126 VanDerWaalsContact C-N 3.29Å; Q124-S126 PolarHBondContact O-N 2.86Å; S126-A130 WeakPolarHBondContact O-CB 3.32Å; S126-A130 PolarHBondContact O-N 3.07Å
127	F	97.7	Very high	97.9	Very high	56 Å²	56	59.3 Å²	59.3	25%	0.246	30%	0.304	C	S	.	.	H	α-helix	trans	-66.8	-50.3	-178.3	-179.6	-90.5	0	0	0	112.5	W122 G123 Q124 A130 T131 V157	W122-F127 HydrophobicContact CH2-CD2 4.05Å; W122-F127 AromaticContact CZ2-CD2 3.83Å; W122-F127 HydrophobicContact CZ2-CD2 3.83Å; W122-F127 HydrophobicContact CZ2-CE2 4.25Å; G123-F127 PolarHBondContact O-N 3.4Å; Q124-F127 PolarHBondContact O-N 3.46Å; F127-A130 PolarHBondContact O-N 2.92Å; F127-T131 WeakPolarHBondContact O-CB 3.36Å; F127-T131 PolarHBondContact O-N 3.21Å; F127-T131 PolarHBondContact O-OG1 2.83Å; F127-V157 HydrophobicContact CD2-CG1 4.09Å; F127-V157 HydrophobicContact CE2-CB 4.18Å; F127-V157 HydrophobicContact CE2-CG1 4.07Å; F127-V157 VanDerWaalsContact CE2-O 3.26Å; F127-V157 WeakPolarHBondContact CE2-O 3.34Å
128	W	98.3	Very high	97.9	Very high	143 Å²	143	60.8 Å²	60.8	54%	0.542	31%	0.311	S	S	.	.	H	α-helix	trans	-69.5	-37.2	-178.9	-68.9	117.5	0	0	0	112	Q124 T131 V132	Q124-W128 PolarHBondContact O-N 3.19Å; W128-T131 PolarHBondContact O-N 3.24Å; W128-V132 WeakPolarHBondContact O-CG2 3.5Å; W128-V132 PolarHBondContact O-N 2.77Å
129	G	97.3	Very high	97.9	Very high	22 Å²	22	58.3 Å²	58.3	23%	0.227	32%	0.319	C	S	.	.	H	α-helix	trans	-59.5	-47.6	172.4	0	0	0	0	0	111.7	M125 T131 I133	M125-G129 WeakPolarHBondContact O-CA 3.49Å; M125-G129 PolarHBondContact O-N 2.99Å; G129-T131 PolarHBondContact O-N 3.21Å; G129-I133 VanDerWaalsContact O-CB 3.3Å; G129-I133 WeakPolarHBondContact O-CB 3.49Å; G129-I133 WeakPolarHBondContact O-CG1 3.35Å; G129-I133 PolarHBondContact O-N 2.86Å
130	A	97.4	Very high	97.8	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-57.8	-48.9	175.4	0	0	0	0	0	111.7	V119 S126 F127 T134 V157	V119-A130 HydrophobicContact CG1-CB 4.05Å; V119-A130 HydrophobicContact CG2-CB 3.77Å; S126-A130 WeakPolarHBondContact O-CB 3.32Å; S126-A130 PolarHBondContact O-N 3.07Å; F127-A130 PolarHBondContact O-N 2.92Å; A130-T134 WeakPolarHBondContact O-CB 2.94Å; A130-T134 WeakPolarHBondContact O-CG2 3.35Å; A130-T134 PolarHBondContact O-N 3.37Å; A130-T134 VanDerWaalsContact O-N 3.11Å; A130-T134 PolarHBondContact O-OG1 2.96Å; A130-V157 HydrophobicContact CB-CG1 4.07Å; A130-V157 HydrophobicContact CB-CG2 4.21Å
131	T	97.8	Very high	97.8	Very high	30 Å²	30	65.1 Å²	65.1	18%	0.184	36%	0.36	C	S	.	.	H	α-helix	trans	-59.2	-53.2	-178.7	-58.3	0	0	0	0	111.4	F127 W128 G129 T134 N135	F127-T131 WeakPolarHBondContact O-CB 3.36Å; F127-T131 PolarHBondContact O-N 3.21Å; F127-T131 PolarHBondContact O-OG1 2.83Å; W128-T131 PolarHBondContact O-N 3.24Å; G129-T131 PolarHBondContact O-N 3.21Å; T131-T134 PolarHBondContact O-OG1 3.44Å; T131-N135 WeakPolarHBondContact O-CB 3.46Å; T131-N135 PolarHBondContact O-N 3.04Å
132	V	98.3	Very high	97.7	Very high	94 Å²	94	74.3 Å²	74.3	57%	0.57	39%	0.391	S	S	*	.	H	α-helix	trans	-67.8	-47.5	-175.4	173.4	0	0	0	0	111.4	W128 N135 L136	W128-V132 WeakPolarHBondContact O-CG2 3.5Å; W128-V132 PolarHBondContact O-N 2.77Å; V132-N135 PolarHBondContact O-N 3.46Å; V132-L136 PolarHBondContact O-N 3.27Å
133	I	98	Very high	97.7	Very high	85 Å²	85	76.9 Å²	76.9	44%	0.436	41%	0.407	S	S	.	.	H	α-helix	trans	-67.8	-46.1	-173.4	-69.5	170.7	0	0	0	111.2	F115 G129 N135 L136	F115-I133 HydrophobicContact CD2-CD1 3.72Å; F115-I133 HydrophobicContact CD2-CG2 4.3Å; F115-I133 HydrophobicContact CE1-CG2 4.36Å; F115-I133 HydrophobicContact CE2-CB 3.77Å; F115-I133 HydrophobicContact CE2-CD1 3.56Å; F115-I133 HydrophobicContact CE2-CG1 4.22Å; F115-I133 HydrophobicContact CE2-CG2 3.84Å; F115-I133 HydrophobicContact CZ-CB 3.96Å; F115-I133 HydrophobicContact CZ-CG2 3.86Å; G129-I133 VanDerWaalsContact O-CB 3.3Å; G129-I133 WeakPolarHBondContact O-CB 3.49Å; G129-I133 WeakPolarHBondContact O-CG1 3.35Å; G129-I133 PolarHBondContact O-N 2.86Å; I133-N135 VanDerWaalsContact C-N 3.29Å; I133-N135 PolarHBondContact O-N 2.79Å; I133-L136 WeakPolarHBondContact O-CB 3.31Å; I133-L136 WeakPolarHBondContact O-CG 3.48Å; I133-L136 PolarHBondContact O-N 3.29Å
134	T	98	Very high	97.7	Very high	10 Å²	10	76 Å²	76	6%	0.061	40%	0.398	C	S	.	.	H	α-helix	trans	-67.2	-33.5	179.1	53.9	0	0	0	0	111.9	F115 A130 T131 L136 L137 I151 W152 F165	F115-T134 HydrophobicContact CE1-CG2 4.24Å; F115-T134 HydrophobicContact CZ-CG2 4.09Å; A130-T134 WeakPolarHBondContact O-CB 2.94Å; A130-T134 WeakPolarHBondContact O-CG2 3.35Å; A130-T134 PolarHBondContact O-N 3.37Å; A130-T134 VanDerWaalsContact O-N 3.11Å; A130-T134 PolarHBondContact O-OG1 2.96Å; T131-T134 PolarHBondContact O-OG1 3.44Å; T134-L136 PolarHBondContact O-N 3.19Å; T134-L137 WeakPolarHBondContact O-CB 3.45Å; T134-L137 PolarHBondContact O-N 3.1Å; T134-I151 HydrophobicContact CG2-CG2 4.29Å; T134-W152 PolarHBondContact OG1-NE1 2.82Å; T134-F165 HydrophobicContact CG2-CZ 4.01Å
135	N	97.5	Very high	97.7	Very high	71 Å²	71	73.5 Å²	73.5	38%	0.38	39%	0.392	S	S	.	.	H	α-helix	trans	-70	-10.8	178.7	-160	38.6	0	0	0	113.5	T131 V132 I133 L137 S138 W152	T131-N135 WeakPolarHBondContact O-CB 3.46Å; T131-N135 PolarHBondContact O-N 3.04Å; V132-N135 PolarHBondContact O-N 3.46Å; I133-N135 VanDerWaalsContact C-N 3.29Å; I133-N135 PolarHBondContact O-N 2.79Å; N135-L137 PolarHBondContact O-N 3.3Å; N135-S138 VanDerWaalsContact O-CB 3.27Å; N135-S138 WeakPolarHBondContact O-CB 3.37Å; N135-S138 PolarHBondContact O-N 3.2Å; N135-S138 PolarHBondContact O-OG 3.07Å; N135-S138 PolarHBondContact OD1-OG 3.46Å; N135-W152 HydrophobicContact CB-CH2 4.49Å; N135-W152 HydrophobicContact CB-CZ2 4.25Å
136	L	97.6	Very high	97.8	Very high	123 Å²	123	71.8 Å²	71.8	64%	0.644	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-58.2	-27.2	169.4	-65.9	174.7	0	0	0	112.3	V132 I133 T134 S138 A139	V132-L136 PolarHBondContact O-N 3.27Å; I133-L136 WeakPolarHBondContact O-CB 3.31Å; I133-L136 WeakPolarHBondContact O-CG 3.48Å; I133-L136 PolarHBondContact O-N 3.29Å; T134-L136 PolarHBondContact O-N 3.19Å; L136-S138 PolarHBondContact O-N 3.33Å; L136-A139 WeakPolarHBondContact O-CB 3.4Å; L136-A139 PolarHBondContact O-N 2.83Å
137	L	97.4	Very high	97.9	Very high	63 Å²	63	74.2 Å²	74.2	33%	0.33	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-68.6	-19	176.3	-63.6	171.7	0	0	0	113.1	T134 N135 A139 I140 G144 V148 I151	T134-L137 WeakPolarHBondContact O-CB 3.45Å; T134-L137 PolarHBondContact O-N 3.1Å; N135-L137 PolarHBondContact O-N 3.3Å; L137-A139 PolarHBondContact O-N 3.34Å; L137-A139 VanDerWaalsContact O-N 3.17Å; L137-I140 HydrophobicContact CD2-CD1 3.94Å; L137-I140 WeakPolarHBondContact O-CB 3.43Å; L137-I140 WeakPolarHBondContact O-CG1 3.26Å; L137-I140 PolarHBondContact O-N 3.43Å; L137-I140 VanDerWaalsContact O-N 3.08Å; L137-G144 WeakPolarHBondContact O-CA 3.4Å; L137-V148 HydrophobicContact CB-CG2 3.84Å; L137-I151 HydrophobicContact CD1-CD1 3.24Å
138	S	97.4	Very high	97.9	Very high	48 Å²	48	71.7 Å²	71.7	34%	0.336	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-62.5	-20.8	174.8	69	0	0	0	0	112.8	N135 L136 I140	N135-S138 VanDerWaalsContact O-CB 3.27Å; N135-S138 WeakPolarHBondContact O-CB 3.37Å; N135-S138 PolarHBondContact O-N 3.2Å; N135-S138 PolarHBondContact O-OG 3.07Å; N135-S138 PolarHBondContact OD1-OG 3.46Å; L136-S138 PolarHBondContact O-N 3.33Å; S138-I140 PolarHBondContact O-N 2.89Å
139	A	98.3	Very high	97.9	Very high	84 Å²	84	68.5 Å²	68.5	69%	0.694	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-71.8	-11.3	176.4	0	0	0	0	0	113.5	L136 L137 P141	L136-A139 WeakPolarHBondContact O-CB 3.4Å; L136-A139 PolarHBondContact O-N 2.83Å; L137-A139 PolarHBondContact O-N 3.34Å; L137-A139 VanDerWaalsContact O-N 3.17Å; A139-P141 WeakPolarHBondContact O-CD 3.47Å
140	I	98.2	Very high	98	Very high	67 Å²	67	76.3 Å²	76.3	34%	0.344	41%	0.405	S	S	.	.	S	Bend	trans	-71.3	121.2	176.3	-60.4	172.6	0	0	0	108.8	L137 S138 I143 G144 L147	L137-I140 HydrophobicContact CD2-CD1 3.94Å; L137-I140 WeakPolarHBondContact O-CB 3.43Å; L137-I140 WeakPolarHBondContact O-CG1 3.26Å; L137-I140 PolarHBondContact O-N 3.43Å; L137-I140 VanDerWaalsContact O-N 3.08Å; S138-I140 PolarHBondContact O-N 2.89Å; I140-I143 HydrophobicContact CG2-CD1 4.1Å; I140-I143 HydrophobicContact CG2-CG1 3.64Å; I140-G144 VanDerWaalsContact O-CA 3.27Å; I140-G144 WeakPolarHBondContact O-CA 3.46Å; I140-G144 PolarHBondContact O-N 3.25Å; I140-L147 HydrophobicContact CD1-CD1 4.05Å
141	P	98.1	Very high	98	Very high	93 Å²	93	78.2 Å²	78.2	60%	0.604	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	142.9	-178.4	-25.9	35	0	0	0	112.8	A139 I143	A139-P141 WeakPolarHBondContact O-CD 3.47Å; P141-I143 PolarHBondContact O-N 2.81Å
142	Y	97.1	Very high	98	Very high	232 Å²	232	77.8 Å²	77.8	91%	0.91	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.6	-43.7	176.3	-44.5	-69.7	0	0	0	116.2
143	I	98.2	Very high	98	Very high	95 Å²	95	75.2 Å²	75.2	49%	0.487	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.2	-9.6	-172.1	63.8	172.7	0	0	0	114.2	I140 P141 T145 T146 L147	I140-I143 HydrophobicContact CG2-CD1 4.1Å; I140-I143 HydrophobicContact CG2-CG1 3.64Å; P141-I143 PolarHBondContact O-N 2.81Å; I143-T145 PolarHBondContact O-N 3.1Å; I143-T146 PolarHBondContact O-N 3.01Å; I143-L147 HydrophobicContact CD1-CD1 3.85Å; I143-L147 HydrophobicContact CG1-CD1 3.95Å; I143-L147 WeakPolarHBondContact O-CG 3.34Å; I143-L147 PolarHBondContact O-N 3.46Å
144	G	98.1	Very high	97.9	Very high	1 Å²	1	72.7 Å²	72.7	1%	0.01	40%	0.397	C	S	.	.	H	α-helix	trans	-57.5	-52.5	-170.1	0	0	0	0	0	114.3	L137 I140 T146 L147 V148	L137-G144 WeakPolarHBondContact O-CA 3.4Å; I140-G144 VanDerWaalsContact O-CA 3.27Å; I140-G144 WeakPolarHBondContact O-CA 3.46Å; I140-G144 PolarHBondContact O-N 3.25Å; G144-T146 VanDerWaalsContact C-N 3.34Å; G144-T146 PolarHBondContact O-N 3.13Å; G144-L147 WeakPolarHBondContact O-CB 3.46Å; G144-L147 PolarHBondContact O-N 3.27Å; G144-V148 WeakPolarHBondContact O-CG2 3.3Å; G144-V148 PolarHBondContact O-N 3.39Å
145	T	98	Very high	97.9	Very high	86 Å²	86	80.7 Å²	80.7	53%	0.528	43%	0.431	S	S	.	.	H	α-helix	trans	-59.7	-44.4	179.4	-50.3	0	0	0	0	111.7	I143 L147 V148 E149	I143-T145 PolarHBondContact O-N 3.1Å; T145-L147 VanDerWaalsContact C-N 3.32Å; T145-L147 PolarHBondContact O-N 2.79Å; T145-V148 PolarHBondContact O-N 3.37Å; T145-E149 PolarHBondContact O-N 2.92Å
146	T	98.4	Very high	97.9	Very high	97 Å²	97	80.4 Å²	80.4	60%	0.595	43%	0.434	S	S	*	.	H	α-helix	trans	-60.6	-40.1	176.7	-50.1	0	0	0	0	111.9	I143 G144 W150	I143-T146 PolarHBondContact O-N 3.01Å; G144-T146 VanDerWaalsContact C-N 3.34Å; G144-T146 PolarHBondContact O-N 3.13Å; T146-W150 WeakPolarHBondContact O-CB 3.36Å; T146-W150 PolarHBondContact O-N 3.06Å
147	L	98.2	Very high	98	Very high	58 Å²	58	74.7 Å²	74.7	30%	0.304	41%	0.405	S	S	.	.	H	α-helix	trans	-64.2	-42.3	176.7	-75	174.3	0	0	0	112.2	I140 I143 G144 T145 W150 I151	I140-L147 HydrophobicContact CD1-CD1 4.05Å; I143-L147 HydrophobicContact CD1-CD1 3.85Å; I143-L147 HydrophobicContact CG1-CD1 3.95Å; I143-L147 WeakPolarHBondContact O-CG 3.34Å; I143-L147 PolarHBondContact O-N 3.46Å; G144-L147 WeakPolarHBondContact O-CB 3.46Å; G144-L147 PolarHBondContact O-N 3.27Å; T145-L147 VanDerWaalsContact C-N 3.32Å; T145-L147 PolarHBondContact O-N 2.79Å; L147-W150 PolarHBondContact O-N 3.39Å; L147-I151 VanDerWaalsContact O-CG1 3.32Å; L147-I151 WeakPolarHBondContact O-CG1 3.25Å; L147-I151 PolarHBondContact O-N 2.71Å
148	V	98.5	Very high	98	Very high	3 Å²	3	75.9 Å²	75.9	2%	0.018	41%	0.412	C	S	.	.	H	α-helix	trans	-63.2	-51.6	178.9	173.6	0	0	0	0	110.8	L137 G144 T145 W150 I151 W152	L137-V148 HydrophobicContact CB-CG2 3.84Å; G144-V148 WeakPolarHBondContact O-CG2 3.3Å; G144-V148 PolarHBondContact O-N 3.39Å; T145-V148 PolarHBondContact O-N 3.37Å; V148-W150 VanDerWaalsContact C-N 3.25Å; V148-W150 PolarHBondContact O-N 2.78Å; V148-I151 PolarHBondContact O-N 3.44Å; V148-I151 VanDerWaalsContact O-N 3.15Å; V148-W152 HydrophobicContact CG1-CD2 3.72Å; V148-W152 VanDerWaalsContact CG1-CE2 3.45Å; V148-W152 HydrophobicContact CG1-CE3 3.78Å; V148-W152 HydrophobicContact CG1-CH2 3.42Å; V148-W152 VanDerWaalsContact CG1-CH2 3.42Å; V148-W152 HydrophobicContact CG1-CZ2 3.32Å; V148-W152 HydrophobicContact CG1-CZ3 3.63Å; V148-W152 PolarHBondContact O-N 2.94Å
149	E	98.3	Very high	98	Very high	77 Å²	77	78.7 Å²	78.7	36%	0.36	42%	0.417	S	S	.	.	H	α-helix	trans	-62.1	-35	178.4	-68.8	179.5	178.9	0	0	111.9	T145 W152 G153 G154	T145-E149 PolarHBondContact O-N 2.92Å; E149-W152 PolarHBondContact O-N 3.45Å; E149-G153 WeakPolarHBondContact O-CA 3.45Å; E149-G153 PolarHBondContact O-N 3.2Å; E149-G154 WeakPolarHBondContact CA-O 3.48Å; E149-G154 PolarHBondContact O-N 2.86Å
150	W	98.4	Very high	98	Very high	186 Å²	186	76.7 Å²	76.7	71%	0.705	40%	0.401	S	S	*	.	H	α-helix	trans	-65.3	-44.8	174.1	-179.8	78.8	0	0	0	112.2	T146 L147 V148 W152 G153 R164	T146-W150 WeakPolarHBondContact O-CB 3.36Å; T146-W150 PolarHBondContact O-N 3.06Å; L147-W150 PolarHBondContact O-N 3.39Å; V148-W150 VanDerWaalsContact C-N 3.25Å; V148-W150 PolarHBondContact O-N 2.78Å; W150-W152 VanDerWaalsContact C-N 3.33Å; W150-W152 PolarHBondContact O-N 3.24Å; W150-G153 PolarHBondContact O-N 2.77Å; W150-R164 PolarHBondContact O-NH1 2.94Å
151	I	97.7	Very high	98	Very high	39 Å²	39	73.5 Å²	73.5	20%	0.2	39%	0.385	C	S	.	.	H	α-helix	trans	-62.6	-41	175.9	-72.6	168.4	0	0	0	110.9	T134 L137 L147 V148 R164 F165	T134-I151 HydrophobicContact CG2-CG2 4.29Å; L137-I151 HydrophobicContact CD1-CD1 3.24Å; L147-I151 VanDerWaalsContact O-CG1 3.32Å; L147-I151 WeakPolarHBondContact O-CG1 3.25Å; L147-I151 PolarHBondContact O-N 2.71Å; V148-I151 PolarHBondContact O-N 3.44Å; V148-I151 VanDerWaalsContact O-N 3.15Å; I151-R164 VanDerWaalsContact C-NH1 3.34Å; I151-R164 WeakPolarHBondContact O-CD 3.27Å; I151-R164 PolarHBondContact O-NH1 3.39Å; I151-F165 HydrophobicContact CG2-CE1 4.22Å; I151-F165 HydrophobicContact CG2-CZ 4.45Å
152	W	98.5	Very high	98.1	Very high	21 Å²	21	69.1 Å²	69.1	8%	0.08	36%	0.356	C	S	.	.	H	α-helix	trans	-70.8	-34.3	176	-64.6	-14.5	0	0	0	112.3	T134 N135 V148 E149 W150 G154 F155 S156 V157 T161	T134-W152 PolarHBondContact OG1-NE1 2.82Å; N135-W152 HydrophobicContact CB-CH2 4.49Å; N135-W152 HydrophobicContact CB-CZ2 4.25Å; V148-W152 HydrophobicContact CG1-CD2 3.72Å; V148-W152 VanDerWaalsContact CG1-CE2 3.45Å; V148-W152 HydrophobicContact CG1-CE3 3.78Å; V148-W152 HydrophobicContact CG1-CH2 3.42Å; V148-W152 VanDerWaalsContact CG1-CH2 3.42Å; V148-W152 HydrophobicContact CG1-CZ2 3.32Å; V148-W152 HydrophobicContact CG1-CZ3 3.63Å; V148-W152 PolarHBondContact O-N 2.94Å; E149-W152 PolarHBondContact O-N 3.45Å; W150-W152 VanDerWaalsContact C-N 3.33Å; W150-W152 PolarHBondContact O-N 3.24Å; W152-G154 VanDerWaalsContact C-N 3.34Å; W152-F155 WeakPolarHBondContact CZ3-O 3.35Å; W152-S156 VanDerWaalsContact CE3-CA 3.44Å; W152-V157 HydrophobicContact CD2-CG2 4.25Å; W152-V157 HydrophobicContact CG-CG2 4.25Å; W152-V157 HydrophobicContact CZ2-CG2 4.23Å; W152-T161 WeakPolarHBondContact CA-OG1 3.29Å; W152-T161 PolarHBondContact O-N 3.38Å; W152-T161 PolarHBondContact O-OG1 3.19Å
153	G	97.9	Very high	98.1	Very high	41 Å²	41	60.9 Å²	60.9	42%	0.423	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.5	32.3	-168	0	0	0	0	0	112.6	E149 W150 R164	E149-G153 WeakPolarHBondContact O-CA 3.45Å; E149-G153 PolarHBondContact O-N 3.2Å; W150-G153 PolarHBondContact O-N 2.77Å; G153-R164 VanDerWaalsContact CA-NH2 3.27Å
154	G	96.9	Very high	98.2	Very high	31 Å²	31	60 Å²	60	32%	0.32	32%	0.321	S	S	.	.	S	Bend	trans	170.5	-173.6	-175	0	0	0	0	0	111.3	E149 W152 S156	E149-G154 WeakPolarHBondContact CA-O 3.48Å; E149-G154 PolarHBondContact O-N 2.86Å; W152-G154 VanDerWaalsContact C-N 3.34Å; G154-S156 VanDerWaalsContact C-N 3.32Å
155	F	97.8	Very high	98.2	Very high	179 Å²	179	60.5 Å²	60.5	79%	0.785	32%	0.323	S	S	*	.	S	Bend	trans	-81.4	-9.9	-176.7	-55.4	-66.1	0	0	0	114.3	W152	W152-F155 WeakPolarHBondContact CZ3-O 3.35Å
156	S	97.4	Very high	98.2	Very high	64 Å²	64	58.7 Å²	58.7	45%	0.448	31%	0.308	S	S	.	.	S	Bend	trans	-152.6	167.1	177.9	59.8	0	0	0	0	110.5	W152 G154 D158	W152-S156 VanDerWaalsContact CE3-CA 3.44Å; G154-S156 VanDerWaalsContact C-N 3.32Å; S156-D158 PolarHBondContact O-N 3.44Å
157	V	98.4	Very high	98.2	Very high	3 Å²	3	56.8 Å²	56.8	2%	0.018	30%	0.301	C	S	.	.	S	Bend	trans	-60.8	119.8	167.2	172.4	0	0	0	0	109	W122 F127 A130 W152 T161	W122-V157 HydrophobicContact CH2-CG1 3.56Å; W122-V157 HydrophobicContact CZ3-CG1 4.04Å; F127-V157 HydrophobicContact CD2-CG1 4.09Å; F127-V157 HydrophobicContact CE2-CB 4.18Å; F127-V157 HydrophobicContact CE2-CG1 4.07Å; F127-V157 VanDerWaalsContact CE2-O 3.26Å; F127-V157 WeakPolarHBondContact CE2-O 3.34Å; A130-V157 HydrophobicContact CB-CG1 4.07Å; A130-V157 HydrophobicContact CB-CG2 4.21Å; W152-V157 HydrophobicContact CD2-CG2 4.25Å; W152-V157 HydrophobicContact CG-CG2 4.25Å; W152-V157 HydrophobicContact CZ2-CG2 4.23Å; V157-T161 HydrophobicContact CG1-CG2 4.19Å; V157-T161 HydrophobicContact CG2-CG2 4.44Å
158	D	98.1	Very high	98.3	Very high	89 Å²	89	59 Å²	59	48%	0.476	31%	0.309	S	S	.	.	S	Bend	trans	-156.3	-159.7	-178.7	-161.7	-3	0	0	0	110.7	S156 A160 T161 L162	S156-D158 PolarHBondContact O-N 3.44Å; D158-A160 VanDerWaalsContact C-N 3.32Å; D158-A160 PolarHBondContact O-N 3.26Å; D158-T161 PolarHBondContact N-OG1 3.42Å; D158-T161 WeakPolarHBondContact O-CA 3.47Å; D158-T161 VanDerWaalsContact O-CB 3.26Å; D158-T161 WeakPolarHBondContact O-CB 3.33Å; D158-T161 PolarHBondContact O-N 3.35Å; D158-T161 PolarHBondContact O-OG1 3.48Å; D158-L162 PolarHBondContact O-N 3Å
159	K	98.1	Very high	98.3	Very high	106 Å²	106	60.1 Å²	60.1	46%	0.461	31%	0.314	S	S	.	.	H	α-helix	trans	-50	-44.1	-177.8	-180	169.5	173.7	161.4	0	114.3	D45 T46 T161 L162 T163	D45-K159 WeakPolarHBondContact OD2-CE 3.39Å; D45-K159 IonicContact OD2-NZ 3.31Å; D45-K159 PolarHBondContact OD2-NZ 3Å; T46-K159 HydrophobicContact CG2-CB 4.01Å; K159-T161 VanDerWaalsContact C-N 3.27Å; K159-T161 PolarHBondContact O-N 3.48Å; K159-L162 PolarHBondContact O-N 3.22Å; K159-T163 PolarHBondContact O-N 3.37Å; K159-T163 VanDerWaalsContact O-N 3.12Å; K159-T163 PolarHBondContact O-OG1 3.41Å; K159-T163 VanDerWaalsContact O-OG1 3.09Å
160	A	98.3	Very high	98.3	Very high	43 Å²	43	60.4 Å²	60.4	36%	0.355	31%	0.314	S	S	.	.	H	α-helix	trans	-62.3	-36.7	178.3	0	0	0	0	0	112.2	D158 R164	D158-A160 VanDerWaalsContact C-N 3.32Å; D158-A160 PolarHBondContact O-N 3.26Å; A160-R164 WeakPolarHBondContact O-CG 3.36Å; A160-R164 PolarHBondContact O-N 3.17Å; A160-R164 PolarHBondContact O-NE 3.3Å
161	T	98.5	Very high	98.3	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-68.6	-46.6	176.7	-41.2	0	0	0	0	111.4	W152 V157 D158 K159 R164 F165	W152-T161 WeakPolarHBondContact CA-OG1 3.29Å; W152-T161 PolarHBondContact O-N 3.38Å; W152-T161 PolarHBondContact O-OG1 3.19Å; V157-T161 HydrophobicContact CG1-CG2 4.19Å; V157-T161 HydrophobicContact CG2-CG2 4.44Å; D158-T161 PolarHBondContact N-OG1 3.42Å; D158-T161 WeakPolarHBondContact O-CA 3.47Å; D158-T161 VanDerWaalsContact O-CB 3.26Å; D158-T161 WeakPolarHBondContact O-CB 3.33Å; D158-T161 PolarHBondContact O-N 3.35Å; D158-T161 PolarHBondContact O-OG1 3.48Å; K159-T161 VanDerWaalsContact C-N 3.27Å; K159-T161 PolarHBondContact O-N 3.48Å; T161-R164 VanDerWaalsContact O-CG 3.25Å; T161-R164 WeakPolarHBondContact O-CG 3.33Å; T161-R164 PolarHBondContact O-N 2.95Å; T161-F165 HydrophobicContact CG2-CD1 4.17Å; T161-F165 HydrophobicContact CG2-CD2 4.48Å; T161-F165 HydrophobicContact CG2-CE1 3.92Å; T161-F165 HydrophobicContact CG2-CE2 4.27Å; T161-F165 HydrophobicContact CG2-CG 4.44Å; T161-F165 HydrophobicContact CG2-CZ 3.98Å; T161-F165 VanDerWaalsContact O-CB 3.31Å; T161-F165 WeakPolarHBondContact O-CB 3.47Å; T161-F165 WeakPolarHBondContact O-CD1 3.29Å; T161-F165 WeakPolarHBondContact O-CG 3.4Å; T161-F165 PolarHBondContact O-N 3.42Å
162	L	98.7	Very high	98.4	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-63.5	-46.5	-177.7	-178.2	56.8	0	0	0	112	T46 A49 L120 W122 D158 K159 R164 F165 F166	T46-L162 HydrophobicContact CG2-CB 4.35Å; T46-L162 HydrophobicContact CG2-CD2 3.88Å; A49-L162 HydrophobicContact CB-CD2 3.69Å; L120-L162 HydrophobicContact CD2-CD1 4.16Å; W122-L162 HydrophobicContact CB-CD2 4.47Å; W122-L162 HydrophobicContact CD2-CD1 4.44Å; W122-L162 HydrophobicContact CD2-CD2 3.86Å; W122-L162 HydrophobicContact CE3-CB 4.24Å; W122-L162 HydrophobicContact CE3-CD1 3.66Å; W122-L162 HydrophobicContact CE3-CD2 3.88Å; W122-L162 HydrophobicContact CE3-CG 4.14Å; W122-L162 HydrophobicContact CG-CD2 4.14Å; W122-L162 HydrophobicContact CH2-CB 4.16Å; W122-L162 HydrophobicContact CZ3-CB 3.88Å; W122-L162 HydrophobicContact CZ3-CD1 3.98Å; W122-L162 HydrophobicContact CZ3-CD2 4.34Å; W122-L162 HydrophobicContact CZ3-CG 4.28Å; D158-L162 PolarHBondContact O-N 3Å; K159-L162 PolarHBondContact O-N 3.22Å; L162-R164 PolarHBondContact O-N 3.29Å; L162-F165 PolarHBondContact O-N 3.1Å; L162-F166 PolarHBondContact O-N 3.48Å
163	T	98.6	Very high	98.4	Very high	60 Å²	60	55 Å²	55	37%	0.368	30%	0.301	S	S	.	.	H	α-helix	trans	-61.4	-44.4	-179.6	-56.7	0	0	0	0	112	S44 K159 F166 A167	S44-T163 PolarHBondContact O-OG1 3.44Å; S44-T163 VanDerWaalsContact O-OG1 3.08Å; K159-T163 PolarHBondContact O-N 3.37Å; K159-T163 VanDerWaalsContact O-N 3.12Å; K159-T163 PolarHBondContact O-OG1 3.41Å; K159-T163 VanDerWaalsContact O-OG1 3.09Å; T163-F166 PolarHBondContact O-N 2.7Å; T163-A167 PolarHBondContact O-N 2.95Å
164	R	98.4	Very high	98.4	Very high	77 Å²	77	57.1 Å²	57.1	29%	0.291	30%	0.299	S	S	.	.	H	α-helix	trans	-72.3	-35	178.7	73.4	-175.7	65	-165.1	-10.8	112.1	W150 I151 G153 A160 T161 L162 F166 A167 F168	W150-R164 PolarHBondContact O-NH1 2.94Å; I151-R164 VanDerWaalsContact C-NH1 3.34Å; I151-R164 WeakPolarHBondContact O-CD 3.27Å; I151-R164 PolarHBondContact O-NH1 3.39Å; G153-R164 VanDerWaalsContact CA-NH2 3.27Å; A160-R164 WeakPolarHBondContact O-CG 3.36Å; A160-R164 PolarHBondContact O-N 3.17Å; A160-R164 PolarHBondContact O-NE 3.3Å; T161-R164 VanDerWaalsContact O-CG 3.25Å; T161-R164 WeakPolarHBondContact O-CG 3.33Å; T161-R164 PolarHBondContact O-N 2.95Å; L162-R164 PolarHBondContact O-N 3.29Å; R164-F166 VanDerWaalsContact C-N 3.29Å; R164-F166 PolarHBondContact O-N 2.87Å; R164-A167 PolarHBondContact O-N 3.32Å; R164-F168 HydrophobicContact CB-CD2 4.35Å; R164-F168 HydrophobicContact CB-CE2 4.17Å; R164-F168 HydrophobicContact CG-CD2 4.46Å; R164-F168 HydrophobicContact CG-CE2 4.34Å; R164-F168 WeakPolarHBondContact O-CD2 3.36Å; R164-F168 PolarHBondContact O-N 3.34Å
165	F	98.7	Very high	98.5	Very high	10 Å²	10	59.5 Å²	59.5	4%	0.044	30%	0.303	C	S	.	.	H	α-helix	trans	-65.2	-36.5	176.6	-85.1	23.4	0	0	0	110.9	F115 M116 V119 L120 T134 I151 T161 L162 H169	F115-F165 AromaticContact CE1-CE2 3.83Å; F115-F165 HydrophobicContact CE1-CE2 3.83Å; F115-F165 HydrophobicContact CE1-CZ 4.16Å; F115-F165 HydrophobicContact CZ-CE2 4.15Å; M116-F165 HydrophobicContact CB-CB 4.42Å; M116-F165 HydrophobicContact CB-CD2 4.3Å; M116-F165 HydrophobicContact CB-CG 4.44Å; M116-F165 HydrophobicContact CG-CB 4.39Å; M116-F165 HydrophobicContact CG-CD1 4.32Å; M116-F165 HydrophobicContact CG-CD2 3.85Å; M116-F165 HydrophobicContact CG-CE2 4.15Å; M116-F165 HydrophobicContact CG-CG 3.95Å; M116-F165 HydrophobicContact SD-CD1 4.33Å; M116-F165 HydrophobicContact SD-CG 4.42Å; V119-F165 HydrophobicContact CB-CD2 3.92Å; V119-F165 HydrophobicContact CG1-CD2 3.93Å; V119-F165 HydrophobicContact CG2-CD2 3.89Å; V119-F165 HydrophobicContact CG2-CE2 4.04Å; L120-F165 HydrophobicContact CD2-CB 4.45Å; T134-F165 HydrophobicContact CG2-CZ 4.01Å; I151-F165 HydrophobicContact CG2-CE1 4.22Å; I151-F165 HydrophobicContact CG2-CZ 4.45Å; T161-F165 HydrophobicContact CG2-CD1 4.17Å; T161-F165 HydrophobicContact CG2-CD2 4.48Å; T161-F165 HydrophobicContact CG2-CE1 3.92Å; T161-F165 HydrophobicContact CG2-CE2 4.27Å; T161-F165 HydrophobicContact CG2-CG 4.44Å; T161-F165 HydrophobicContact CG2-CZ 3.98Å; T161-F165 VanDerWaalsContact O-CB 3.31Å; T161-F165 WeakPolarHBondContact O-CB 3.47Å; T161-F165 WeakPolarHBondContact O-CD1 3.29Å; T161-F165 WeakPolarHBondContact O-CG 3.4Å; T161-F165 PolarHBondContact O-N 3.42Å; L162-F165 PolarHBondContact O-N 3.1Å; F165-H169 WeakPolarHBondContact O-CB 3.29Å; F165-H169 PolarHBondContact O-N 3Å
166	F	98.8	Very high	98.6	Very high	49 Å²	49	51.2 Å²	51.2	22%	0.215	27%	0.267	C	S	.	.	H	α-helix	trans	-59.6	-49	169.9	175.8	-115.5	0	0	0	111.6	A39 Y42 L120 L162 T163 R164 F168 H169 F170	A39-F166 HydrophobicContact CB-CE2 4.22Å; A39-F166 HydrophobicContact CB-CZ 4.11Å; Y42-F166 AromaticContact CD1-CD2 3.71Å; Y42-F166 HydrophobicContact CD1-CD2 3.71Å; Y42-F166 AromaticContact CD1-CE2 3.65Å; Y42-F166 HydrophobicContact CD1-CE2 3.65Å; Y42-F166 HydrophobicContact CD1-CG 4.33Å; Y42-F166 HydrophobicContact CD1-CZ 4.21Å; Y42-F166 HydrophobicContact CE1-CB 4.35Å; Y42-F166 AromaticContact CE1-CD2 3.63Å; Y42-F166 HydrophobicContact CE1-CD2 3.63Å; Y42-F166 HydrophobicContact CE1-CE2 4.08Å; Y42-F166 AromaticContact CE1-CG 3.97Å; Y42-F166 HydrophobicContact CE1-CG 3.97Å; L120-F166 HydrophobicContact CD1-CD2 4.02Å; L120-F166 HydrophobicContact CD2-CB 3.9Å; L162-F166 PolarHBondContact O-N 3.48Å; T163-F166 PolarHBondContact O-N 2.7Å; R164-F166 VanDerWaalsContact C-N 3.29Å; R164-F166 PolarHBondContact O-N 2.87Å; F166-F168 PolarHBondContact O-N 3.39Å; F166-H169 PolarHBondContact O-N 3.48Å; F166-F170 HydrophobicContact CZ-CD2 4.48Å; F166-F170 WeakPolarHBondContact O-CB 3.31Å; F166-F170 PolarHBondContact O-N 3.37Å
167	A	98.8	Very high	98.6	Very high	56 Å²	56	49.7 Å²	49.7	46%	0.463	26%	0.258	S	S	.	.	H	α-helix	trans	-60.3	-45.2	178.5	0	0	0	0	0	112.8	T163 R164 F170 I171	T163-A167 PolarHBondContact O-N 2.95Å; R164-A167 PolarHBondContact O-N 3.32Å; A167-F170 PolarHBondContact O-N 3.45Å; A167-I171 WeakPolarHBondContact O-CG2 3.25Å; A167-I171 PolarHBondContact O-N 2.95Å; A167-I171 VanDerWaalsContact O-N 3.12Å
168	F	98.8	Very high	98.6	Very high	105 Å²	105	52.1 Å²	52.1	46%	0.461	28%	0.279	S	S	.	.	H	α-helix	trans	-66.7	-44.4	177.2	-72.8	-54.9	0	0	0	112.6	M116 R164 F166 F170 I171 L172	M116-F168 HydrophobicContact CE-CB 4.15Å; M116-F168 HydrophobicContact SD-CB 3.46Å; M116-F168 WeakPolarHBondContact SD-CB 3.46Å; M116-F168 HydrophobicContact SD-CD2 4.45Å; M116-F168 HydrophobicContact SD-CG 4.3Å; R164-F168 HydrophobicContact CB-CD2 4.35Å; R164-F168 HydrophobicContact CB-CE2 4.17Å; R164-F168 HydrophobicContact CG-CD2 4.46Å; R164-F168 HydrophobicContact CG-CE2 4.34Å; R164-F168 WeakPolarHBondContact O-CD2 3.36Å; R164-F168 PolarHBondContact O-N 3.34Å; F166-F168 PolarHBondContact O-N 3.39Å; F168-F170 PolarHBondContact O-N 3.3Å; F168-I171 WeakPolarHBondContact O-CG2 3.28Å; F168-I171 PolarHBondContact O-N 3.29Å; F168-L172 HydrophobicContact CB-CD1 4.49Å; F168-L172 WeakPolarHBondContact O-CB 3.33Å; F168-L172 WeakPolarHBondContact O-CD1 3.47Å; F168-L172 VanDerWaalsContact O-CG 3.31Å; F168-L172 WeakPolarHBondContact O-CG 3.28Å; F168-L172 PolarHBondContact O-N 2.9Å
169	H	98.9	Very high	98.7	Very high	26 Å²	26	49.9 Å²	49.9	12%	0.12	27%	0.267	C	S	.	.	H	α-helix	trans	-60.4	-34.1	175.6	-178.8	69.7	0	0	0	111.9	H70 T113 M116 G117 L120 F165 F166 P173	H70-H169 AromaticContact NE2-NE2 3.95Å; T113-H169 PolarHBondContact O-CE1 3.1Å; T113-H169 PolarHBondContact O-ND1 3.49Å; M116-H169 HydrophobicContact CB-CB 4.06Å; G117-H169 WeakPolarHBondContact CA-CE1 3.46Å; G117-H169 VanDerWaalsContact CA-ND1 3.3Å; G117-H169 WeakPolarHBondContact CA-ND1 3.49Å; G117-H169 PolarHBondContact N-ND1 3.37Å; L120-H169 HydrophobicContact CD1-CB 4.22Å; L120-H169 VanDerWaalsContact CD1-CD2 3.46Å; L120-H169 WeakPolarHBondContact CD1-CD2 3.44Å; F165-H169 WeakPolarHBondContact O-CB 3.29Å; F165-H169 PolarHBondContact O-N 3Å; F166-H169 PolarHBondContact O-N 3.48Å; H169-P173 WeakPolarHBondContact O-CD 3.38Å; H169-P173 WeakPolarHBondContact O-CG 3.31Å
170	F	98.8	Very high	98.7	Very high	84 Å²	84	46.2 Å²	46.2	37%	0.368	26%	0.256	S	S	.	.	H	α-helix	trans	-70.5	-45.2	177.2	-169.6	-82.7	0	0	0	112.6	L36 A39 F166 A167 F168 P173 F174	L36-F170 HydrophobicContact CD2-CE2 3.71Å; L36-F170 HydrophobicContact CD2-CZ 3.5Å; A39-F170 HydrophobicContact CB-CD2 4.25Å; A39-F170 HydrophobicContact CB-CE2 4.03Å; F166-F170 HydrophobicContact CZ-CD2 4.48Å; F166-F170 WeakPolarHBondContact O-CB 3.31Å; F166-F170 PolarHBondContact O-N 3.37Å; A167-F170 PolarHBondContact O-N 3.45Å; F168-F170 PolarHBondContact O-N 3.3Å; F170-P173 WeakPolarHBondContact O-CD 3.37Å; F170-F174 HydrophobicContact CD1-CE2 4.16Å; F170-F174 AromaticContact CE1-CE2 3.91Å; F170-F174 HydrophobicContact CE1-CE2 3.91Å; F170-F174 VanDerWaalsContact O-CD2 3.27Å; F170-F174 WeakPolarHBondContact O-CD2 3.34Å; F170-F174 VanDerWaalsContact O-CE2 3.25Å; F170-F174 WeakPolarHBondContact O-CE2 3.49Å
171	I	98.8	Very high	98.7	Very high	82 Å²	82	49.8 Å²	49.8	42%	0.421	27%	0.268	S	S	.	.	H	α-helix	trans	-79.6	-34.4	-174.2	-169.3	58.9	0	0	0	113.6	A167 F168 F174 I175	A167-I171 WeakPolarHBondContact O-CG2 3.25Å; A167-I171 PolarHBondContact O-N 2.95Å; A167-I171 VanDerWaalsContact O-N 3.12Å; F168-I171 WeakPolarHBondContact O-CG2 3.28Å; F168-I171 PolarHBondContact O-N 3.29Å; I171-F174 WeakPolarHBondContact O-CB 3.46Å; I171-F174 PolarHBondContact O-N 2.91Å; I171-F174 VanDerWaalsContact O-N 3.1Å; I171-I175 HydrophobicContact CG1-CD1 4.28Å; I171-I175 PolarHBondContact O-N 2.92Å
172	L	98.6	Very high	98.7	Very high	32 Å²	32	52.5 Å²	52.5	17%	0.168	28%	0.284	C	S	.	.	H	α-helix	trans	-60.5	-38.7	-173.9	-79.8	166	0	0	0	115	T113 M116 F168 F174 I175 I176	T113-L172 HydrophobicContact CG2-CB 4.44Å; T113-L172 VanDerWaalsContact OG1-CB 3.25Å; T113-L172 WeakPolarHBondContact OG1-CB 3.38Å; M116-L172 HydrophobicContact CE-CD1 3.2Å; F168-L172 HydrophobicContact CB-CD1 4.49Å; F168-L172 WeakPolarHBondContact O-CB 3.33Å; F168-L172 WeakPolarHBondContact O-CD1 3.47Å; F168-L172 VanDerWaalsContact O-CG 3.31Å; F168-L172 WeakPolarHBondContact O-CG 3.28Å; F168-L172 PolarHBondContact O-N 2.9Å; L172-F174 PolarHBondContact O-N 2.99Å; L172-I175 HydrophobicContact CD2-CD1 4.14Å; L172-I175 CarbonylContact O-C 3.26Å; L172-I175 WeakPolarHBondContact O-CA 3.1Å; L172-I175 WeakPolarHBondContact O-CB 3.31Å; L172-I175 PolarHBondContact O-N 3.5Å; L172-I176 VanDerWaalsContact O-CG1 3.31Å; L172-I176 WeakPolarHBondContact O-CG1 3.13Å; L172-I176 PolarHBondContact O-N 3.39Å
173	P	98.8	Very high	98.7	Very high	19 Å²	19	53.8 Å²	53.8	12%	0.123	29%	0.29	C	S	.	.	H	α-helix	trans	-53.2	-35.2	173.1	-28.9	34.4	0	0	0	113.9	I32 T113 H169 F170 I176 A177	I32-P173 HydrophobicContact CD1-CB 4.29Å; I32-P173 HydrophobicContact CG1-CB 3.77Å; T113-P173 HydrophobicContact CG2-CG 3.86Å; H169-P173 WeakPolarHBondContact O-CD 3.38Å; H169-P173 WeakPolarHBondContact O-CG 3.31Å; F170-P173 WeakPolarHBondContact O-CD 3.37Å; P173-I176 PolarHBondContact O-N 3.5Å; P173-A177 PolarHBondContact O-N 3.22Å
174	F	98.7	Very high	98.7	Very high	84 Å²	84	55 Å²	55	37%	0.368	29%	0.294	S	S	.	.	H	α-helix	trans	-75.2	-34.8	177.2	-58.4	-77.5	0	0	0	112.3	I32 L36 F170 I171 L172 I176 A177 A178	I32-F174 HydrophobicContact CG2-CE1 4Å; I32-F174 HydrophobicContact CG2-CZ 4.16Å; L36-F174 HydrophobicContact CD2-CZ 4.41Å; F170-F174 HydrophobicContact CD1-CE2 4.16Å; F170-F174 AromaticContact CE1-CE2 3.91Å; F170-F174 HydrophobicContact CE1-CE2 3.91Å; F170-F174 VanDerWaalsContact O-CD2 3.27Å; F170-F174 WeakPolarHBondContact O-CD2 3.34Å; F170-F174 VanDerWaalsContact O-CE2 3.25Å; F170-F174 WeakPolarHBondContact O-CE2 3.49Å; I171-F174 WeakPolarHBondContact O-CB 3.46Å; I171-F174 PolarHBondContact O-N 2.91Å; I171-F174 VanDerWaalsContact O-N 3.1Å; L172-F174 PolarHBondContact O-N 2.99Å; F174-I176 VanDerWaalsContact C-N 3.34Å; F174-A177 WeakPolarHBondContact O-CB 3.26Å; F174-A177 PolarHBondContact O-N 3.29Å; F174-A178 PolarHBondContact O-N 3.34Å; F174-A178 VanDerWaalsContact O-N 3.07Å
175	I	98.8	Very high	98.7	Very high	81 Å²	81	55.7 Å²	55.7	42%	0.415	30%	0.303	S	S	.	.	H	α-helix	trans	-64.9	-41.3	170.8	-63.2	169.8	0	0	0	110	I171 L172 A177 A178 L179	I171-I175 HydrophobicContact CG1-CD1 4.28Å; I171-I175 PolarHBondContact O-N 2.92Å; L172-I175 HydrophobicContact CD2-CD1 4.14Å; L172-I175 CarbonylContact O-C 3.26Å; L172-I175 WeakPolarHBondContact O-CA 3.1Å; L172-I175 WeakPolarHBondContact O-CB 3.31Å; L172-I175 PolarHBondContact O-N 3.5Å; I175-A177 VanDerWaalsContact C-N 3.32Å; I175-A177 PolarHBondContact O-N 2.99Å; I175-A178 PolarHBondContact O-N 3.14Å; I175-L179 HydrophobicContact CG2-CD1 4.25Å; I175-L179 WeakPolarHBondContact O-CG 3.42Å; I175-L179 PolarHBondContact O-N 3.45Å
176	I	98.9	Very high	98.7	Very high	6 Å²	6	58.8 Å²	58.8	3%	0.031	32%	0.317	C	S	.	.	H	α-helix	trans	-60.6	-42.1	174.6	-68.3	164.6	0	0	0	110.3	L28 L106 A109 V110 T113 L172 P173 F174 A178 L179 A180	L28-I176 HydrophobicContact CD1-CB 4.39Å; L28-I176 HydrophobicContact CD1-CG2 3.91Å; L28-I176 HydrophobicContact CD2-CG2 4Å; L106-I176 HydrophobicContact CD2-CG2 3.79Å; L106-I176 WeakPolarHBondContact CD2-O 3.45Å; A109-I176 HydrophobicContact CB-CD1 4.11Å; A109-I176 HydrophobicContact CB-CG1 3.68Å; V110-I176 HydrophobicContact CG2-CD1 3.88Å; V110-I176 HydrophobicContact CG2-CG2 4.18Å; T113-I176 WeakPolarHBondContact OG1-CD1 3.48Å; L172-I176 VanDerWaalsContact O-CG1 3.31Å; L172-I176 WeakPolarHBondContact O-CG1 3.13Å; L172-I176 PolarHBondContact O-N 3.39Å; P173-I176 PolarHBondContact O-N 3.5Å; F174-I176 VanDerWaalsContact C-N 3.34Å; I176-A178 VanDerWaalsContact C-N 3.35Å; I176-A178 PolarHBondContact O-N 3.4Å; I176-L179 PolarHBondContact O-N 2.88Å; I176-A180 WeakPolarHBondContact O-CB 3.38Å; I176-A180 PolarHBondContact O-N 2.8Å
177	A	98.8	Very high	98.7	Very high	31 Å²	31	58.2 Å²	58.2	26%	0.256	32%	0.316	S	S	.	.	H	α-helix	trans	-60.6	-43	175.1	0	0	0	0	0	112	L28 P173 F174 I175 A180 I181	L28-A177 HydrophobicContact CD2-CB 4Å; P173-A177 PolarHBondContact O-N 3.22Å; F174-A177 WeakPolarHBondContact O-CB 3.26Å; F174-A177 PolarHBondContact O-N 3.29Å; I175-A177 VanDerWaalsContact C-N 3.32Å; I175-A177 PolarHBondContact O-N 2.99Å; A177-A180 PolarHBondContact O-N 3.04Å; A177-I181 WeakPolarHBondContact O-CG1 3.25Å; A177-I181 PolarHBondContact O-N 2.91Å; A177-I181 VanDerWaalsContact O-N 3.12Å
178	A	98.7	Very high	98.6	Very high	55 Å²	55	58.9 Å²	58.9	46%	0.455	31%	0.309	S	S	.	.	H	α-helix	trans	-63.5	-44.5	175.2	0	0	0	0	0	112.2	F174 I175 I176 A180 I181 V182	F174-A178 PolarHBondContact O-N 3.34Å; F174-A178 VanDerWaalsContact O-N 3.07Å; I175-A178 PolarHBondContact O-N 3.14Å; I176-A178 VanDerWaalsContact C-N 3.35Å; I176-A178 PolarHBondContact O-N 3.4Å; A178-A180 VanDerWaalsContact C-N 3.31Å; A178-A180 PolarHBondContact O-N 3.2Å; A178-I181 WeakPolarHBondContact O-CB 3.15Å; A178-I181 PolarHBondContact O-N 3.46Å; A178-V182 PolarHBondContact O-N 3.48Å; A178-V182 VanDerWaalsContact O-N 3.13Å
179	L	98.7	Very high	98.5	Very high	42 Å²	42	61 Å²	61	22%	0.22	32%	0.32	C	S	.	.	H	α-helix	trans	-63	-35.8	175.3	-72.8	173.8	0	0	0	112.2	L106 I175 I176 I181 V182 H183	L106-L179 HydrophobicContact CD2-CB 3.56Å; L106-L179 HydrophobicContact CG-CB 4.05Å; I175-L179 HydrophobicContact CG2-CD1 4.25Å; I175-L179 WeakPolarHBondContact O-CG 3.42Å; I175-L179 PolarHBondContact O-N 3.45Å; I176-L179 PolarHBondContact O-N 2.88Å; L179-I181 VanDerWaalsContact C-N 3.33Å; L179-I181 PolarHBondContact O-N 3.33Å; L179-V182 PolarHBondContact O-N 3.08Å; L179-H183 WeakPolarHBondContact O-CB 3.33Å; L179-H183 PolarHBondContact O-N 3.08Å
180	A	98.8	Very high	98.3	Very high	28 Å²	28	63.3 Å²	63.3	23%	0.231	34%	0.337	C	S	.	.	H	α-helix	trans	-65.9	-35.8	176.3	0	0	0	0	0	111.9	L106 I176 A177 A178 H183 L184	L106-A180 HydrophobicContact CD2-CB 4.41Å; I176-A180 WeakPolarHBondContact O-CB 3.38Å; I176-A180 PolarHBondContact O-N 2.8Å; A177-A180 PolarHBondContact O-N 3.04Å; A178-A180 VanDerWaalsContact C-N 3.31Å; A178-A180 PolarHBondContact O-N 3.2Å; A180-H183 WeakPolarHBondContact O-CB 3.3Å; A180-H183 PolarHBondContact O-N 3.17Å; A180-L184 WeakPolarHBondContact O-CG 3.35Å; A180-L184 PolarHBondContact O-N 3.39Å
181	I	98.5	Very high	98.2	Very high	118 Å²	118	59.9 Å²	59.9	61%	0.605	33%	0.325	S	S	*	.	H	α-helix	trans	-64	-45.5	172.3	-66.4	166.2	0	0	0	110.4	A177 A178 L179 H183 L184 L185	A177-I181 WeakPolarHBondContact O-CG1 3.25Å; A177-I181 PolarHBondContact O-N 2.91Å; A177-I181 VanDerWaalsContact O-N 3.12Å; A178-I181 WeakPolarHBondContact O-CB 3.15Å; A178-I181 PolarHBondContact O-N 3.46Å; L179-I181 VanDerWaalsContact C-N 3.33Å; L179-I181 PolarHBondContact O-N 3.33Å; I181-H183 VanDerWaalsContact C-N 3.32Å; I181-H183 PolarHBondContact O-N 3.12Å; I181-L184 PolarHBondContact O-N 2.92Å; I181-L185 WeakPolarHBondContact O-CB 3.44Å; I181-L185 PolarHBondContact O-N 2.98Å
182	V	98.7	Very high	98.1	Very high	58 Å²	58	57.7 Å²	57.7	35%	0.352	32%	0.317	S	S	.	.	H	α-helix	trans	-62.9	-39.8	176.5	176.3	0	0	0	0	111.3	I102 A178 L179 L184 L185 F186	I102-V182 HydrophobicContact CD1-CG1 4.22Å; I102-V182 HydrophobicContact CG1-CG1 4.28Å; A178-V182 PolarHBondContact O-N 3.48Å; A178-V182 VanDerWaalsContact O-N 3.13Å; L179-V182 PolarHBondContact O-N 3.08Å; V182-L184 PolarHBondContact O-N 3.08Å; V182-L185 WeakPolarHBondContact O-CB 3.34Å; V182-L185 PolarHBondContact O-N 3.46Å; V182-F186 HydrophobicContact CG1-CD2 3.91Å; V182-F186 HydrophobicContact CG1-CE2 3.75Å; V182-F186 WeakPolarHBondContact O-CD2 3.12Å; V182-F186 PolarHBondContact O-N 3.32Å; V182-F186 VanDerWaalsContact O-N 3.1Å
183	H	98.7	Very high	98.1	Very high	27 Å²	27	57.1 Å²	57.1	13%	0.125	31%	0.314	C	S	.	.	H	α-helix	trans	-59.2	-46.6	175.4	-174.6	76.5	0	0	0	111.8	T99 I102 G103 L106 L179 A180 I181 L187	T99-H183 WeakPolarHBondContact CG2-CE1 3.42Å; T99-H183 PolarHBondContact O-CE1 2.9Å; T99-H183 PolarHBondContact O-ND1 3.03Å; I102-H183 HydrophobicContact CB-CB 4.41Å; I102-H183 HydrophobicContact CG2-CB 3.67Å; G103-H183 PolarHBondContact N-ND1 2.85Å; L106-H183 HydrophobicContact CD1-CB 3.82Å; L179-H183 WeakPolarHBondContact O-CB 3.33Å; L179-H183 PolarHBondContact O-N 3.08Å; A180-H183 WeakPolarHBondContact O-CB 3.3Å; A180-H183 PolarHBondContact O-N 3.17Å; I181-H183 VanDerWaalsContact C-N 3.32Å; I181-H183 PolarHBondContact O-N 3.12Å; H183-L187 PolarHBondContact O-N 3.36Å
184	L	98.4	Very high	98.1	Very high	85 Å²	85	56.4 Å²	56.4	45%	0.445	31%	0.309	S	S	.	.	H	α-helix	trans	-69.1	-33.4	177.3	-70.8	173.4	0	0	0	112.5	A180 I181 V182 L187 H188	A180-L184 WeakPolarHBondContact O-CG 3.35Å; A180-L184 PolarHBondContact O-N 3.39Å; I181-L184 PolarHBondContact O-N 2.92Å; V182-L184 PolarHBondContact O-N 3.08Å; L184-L187 HydrophobicContact CD2-CD2 4.16Å; L184-L187 PolarHBondContact O-N 2.77Å; L184-H188 WeakPolarHBondContact O-CB 3.45Å; L184-H188 PolarHBondContact O-CD2 3.31Å; L184-H188 PolarHBondContact O-N 2.9Å
185	L	98.1	Very high	98	Very high	92 Å²	92	54.3 Å²	54.3	48%	0.482	30%	0.304	S	S	.	.	H	α-helix	trans	-59.5	-53.4	174.9	-172.9	160.6	0	0	0	110.3	I181 V182 L187 H188 E189	I181-L185 WeakPolarHBondContact O-CB 3.44Å; I181-L185 PolarHBondContact O-N 2.98Å; V182-L185 WeakPolarHBondContact O-CB 3.34Å; V182-L185 PolarHBondContact O-N 3.46Å; L185-L187 VanDerWaalsContact C-N 3.29Å; L185-L187 PolarHBondContact O-N 2.83Å; L185-H188 PolarHBondContact O-N 3.06Å; L185-E189 PolarHBondContact O-N 3.32Å
186	F	98.4	Very high	98	Very high	75 Å²	75	54.6 Å²	54.6	33%	0.329	31%	0.309	S	S	.	.	H	α-helix	trans	-62.6	-35.3	176.8	-77.3	-62.8	0	0	0	112.8	E98 T99 I102 V182 H188 E189	E98-F186 HydrophobicContact CB-CB 4.1Å; E98-F186 HydrophobicContact CB-CD1 3.55Å; E98-F186 HydrophobicContact CB-CD2 4.04Å; E98-F186 HydrophobicContact CB-CE1 3.88Å; E98-F186 HydrophobicContact CB-CE2 4.32Å; E98-F186 HydrophobicContact CB-CG 3.64Å; E98-F186 HydrophobicContact CB-CZ 4.25Å; E98-F186 HydrophobicContact CG-CD1 3.98Å; E98-F186 HydrophobicContact CG-CE1 3.92Å; E98-F186 HydrophobicContact CG-CZ 4.42Å; T99-F186 VanDerWaalsContact OG1-C 3.28Å; T99-F186 WeakPolarHBondContact OG1-CB 3.22Å; I102-F186 HydrophobicContact CG1-CD2 4.21Å; I102-F186 HydrophobicContact CG1-CE2 4.39Å; V182-F186 HydrophobicContact CG1-CD2 3.91Å; V182-F186 HydrophobicContact CG1-CE2 3.75Å; V182-F186 WeakPolarHBondContact O-CD2 3.12Å; V182-F186 PolarHBondContact O-N 3.32Å; V182-F186 VanDerWaalsContact O-N 3.1Å; F186-H188 VanDerWaalsContact C-N 3.29Å; F186-H188 PolarHBondContact O-N 2.99Å; F186-E189 PolarHBondContact O-N 2.99Å
187	L	98.2	Very high	97.8	Very high	36 Å²	36	56.7 Å²	56.7	19%	0.188	33%	0.332	C	S	.	.	H	α-helix	trans	-63.1	-36.8	173.7	-179.9	63.6	0	0	0	112.1	T99 H183 L184 L185 E189 T190 G191	T99-L187 HydrophobicContact CG2-CB 4.07Å; T99-L187 HydrophobicContact CG2-CD1 4.39Å; T99-L187 PolarHBondContact OG1-N 3.46Å; H183-L187 PolarHBondContact O-N 3.36Å; L184-L187 HydrophobicContact CD2-CD2 4.16Å; L184-L187 PolarHBondContact O-N 2.77Å; L185-L187 VanDerWaalsContact C-N 3.29Å; L185-L187 PolarHBondContact O-N 2.83Å; L187-E189 VanDerWaalsContact C-N 3.32Å; L187-T190 PolarHBondContact O-N 3.04Å; L187-T190 PolarHBondContact O-OG1 2.93Å; L187-G191 CarbonylContact O-C 3.6Å; L187-G191 VanDerWaalsContact O-CA 3.31Å; L187-G191 WeakPolarHBondContact O-CA 3.26Å; L187-G191 PolarHBondContact O-N 2.88Å
188	H	97.4	Very high	97.7	Very high	71 Å²	71	61 Å²	61	33%	0.329	35%	0.351	S	S	.	.	H	α-helix	trans	-73.3	-22.9	-179.6	-70.1	174.1	0	0	0	113.3	L184 L185 F186 T190	L184-H188 WeakPolarHBondContact O-CB 3.45Å; L184-H188 PolarHBondContact O-CD2 3.31Å; L184-H188 PolarHBondContact O-N 2.9Å; L185-H188 PolarHBondContact O-N 3.06Å; F186-H188 VanDerWaalsContact C-N 3.29Å; F186-H188 PolarHBondContact O-N 2.99Å; H188-T190 VanDerWaalsContact C-N 3.32Å; H188-T190 PolarHBondContact O-N 2.98Å
189	E	96.6	Very high	97.6	Very high	149 Å²	149	64.4 Å²	64.4	70%	0.696	36%	0.361	S	S	*	.	H	α-helix	trans	-63.8	-37.7	173.3	-65.4	-60.2	132.8	0	0	112	L185 F186 L187	L185-E189 PolarHBondContact O-N 3.32Å; F186-E189 PolarHBondContact O-N 2.99Å; L187-E189 VanDerWaalsContact C-N 3.32Å
190	T	94.9	Very high	97.5	Very high	75 Å²	75	63.2 Å²	63.2	46%	0.46	36%	0.357	S	S	.	.	H	α-helix	trans	-99.6	-25	-179.4	60.6	0	0	0	0	113.6	F96 L187 H188	F96-T190 HydrophobicContact CD1-CG2 4.25Å; F96-T190 HydrophobicContact CE1-CG2 4.48Å; L187-T190 PolarHBondContact O-N 3.04Å; L187-T190 PolarHBondContact O-OG1 2.93Å; H188-T190 VanDerWaalsContact C-N 3.32Å; H188-T190 PolarHBondContact O-N 2.98Å
191	G	96.1	Very high	97.4	Very high	12 Å²	12	66.6 Å²	66.6	12%	0.124	37%	0.371	C	S	.	.			trans	76.1	174.2	-162.7	0	0	0	0	0	112.8	L187	L187-G191 CarbonylContact O-C 3.6Å; L187-G191 VanDerWaalsContact O-CA 3.31Å; L187-G191 WeakPolarHBondContact O-CA 3.26Å; L187-G191 PolarHBondContact O-N 2.88Å
192	S	97.4	Very high	97.3	Very high	36 Å²	36	66.1 Å²	66.1	25%	0.252	38%	0.384	S	S	.	.			trans	-72.6	142.1	179.2	-73.3	0	0	0	0	112.4	P11	P11-S192 VanDerWaalsContact CG-O 3.3Å; P11-S192 WeakPolarHBondContact CG-O 3.4Å
193	N	97.9	Very high	97.3	Very high	20 Å²	20	67.8 Å²	67.8	11%	0.107	39%	0.391	C	S	.	.			trans	-68.4	173.7	161.1	-170.1	16.2	0	0	0	110.2	W18 Y91 S93 F96	W18-N193 VanDerWaalsContact CE2-O 3.24Å; W18-N193 HydrophobicContact CZ2-CB 4.34Å; W18-N193 VanDerWaalsContact CZ2-O 3.26Å; W18-N193 WeakPolarHBondContact CZ2-O 3.26Å; W18-N193 PolarHBondContact NE1-O 3.4Å; Y91-N193 PolarHBondContact O-ND2 3.35Å; S93-N193 PolarHBondContact OG-ND2 3.48Å; F96-N193 HydrophobicContact CE2-CB 3.7Å; F96-N193 HydrophobicContact CZ-CB 4.01Å
194	N	98.6	Very high	97.2	Very high	3 Å²	3	70 Å²	70	2%	0.016	40%	0.401	C	S	.	.			trans	-143.2	169.4	178.1	75.5	85	0	0	0	112.5	P11 N13 I14 T196 G197 L198	P11-N194 HydrophobicContact CB-CB 3.75Å; P11-N194 HydrophobicContact CG-CB 4.06Å; N13-N194 PolarHBondContact ND2-OD1 3.43Å; N13-N194 VanDerWaalsContact ND2-OD1 3.1Å; N13-N194 WeakPolarHBondContact OD1-CB 3.35Å; I14-N194 HydrophobicContact CG2-CB 4.06Å; N194-T196 PolarHBondContact O-N 2.67Å; N194-T196 VanDerWaalsContact O-N 3.11Å; N194-T196 PolarHBondContact OD1-N 3.09Å; N194-T196 VanDerWaalsContact OD1-N 3.1Å; N194-T196 PolarHBondContact OD1-OG1 3.03Å; N194-G197 PolarHBondContact O-N 3.48Å; N194-L198 PolarHBondContact ND2-O 3.46Å
195	P	98.4	Very high	97.2	Very high	40 Å²	40	67.6 Å²	67.6	26%	0.26	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-23.7	-171.8	-29.2	37.9	0	0	0	116.6	N13 W18 Y91	N13-P195 VanDerWaalsContact O-CD 3.31Å; N13-P195 WeakPolarHBondContact O-CD 3.42Å; N13-P195 WeakPolarHBondContact O-CG 3.35Å; W18-P195 HydrophobicContact CH2-CG 4.27Å; W18-P195 HydrophobicContact CZ3-CG 4.03Å; Y91-P195 HydrophobicContact CD1-CB 4.32Å; Y91-P195 HydrophobicContact CE1-CB 3.72Å; Y91-P195 HydrophobicContact CE1-CG 4.47Å
196	T	97.7	Very high	97.2	Very high	87 Å²	87	66 Å²	66	53%	0.534	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-15.4	179.4	69.1	0	0	0	0	112.7	N194 L198	N194-T196 PolarHBondContact O-N 2.67Å; N194-T196 VanDerWaalsContact O-N 3.11Å; N194-T196 PolarHBondContact OD1-N 3.09Å; N194-T196 VanDerWaalsContact OD1-N 3.1Å; N194-T196 PolarHBondContact OD1-OG1 3.03Å; T196-L198 PolarHBondContact O-N 3.12Å; T196-L198 PolarHBondContact OG1-N 3.36Å
197	G	95.6	Very high	97.2	Very high	50 Å²	50	63.9 Å²	63.9	52%	0.515	37%	0.373	S	S	.	.			trans	68.7	5	-173.5	0	0	0	0	0	114.6	N194	N194-G197 PolarHBondContact O-N 3.48Å
198	L	95.9	Very high	97.2	Very high	123 Å²	123	66.7 Å²	66.7	64%	0.644	39%	0.385	S	S	*	.	S	Bend	trans	-89.2	158.4	177.4	-58.2	178.6	0	0	0	111.1	N194 T196 S200	N194-L198 PolarHBondContact ND2-O 3.46Å; T196-L198 PolarHBondContact O-N 3.12Å; T196-L198 PolarHBondContact OG1-N 3.36Å; L198-S200 PolarHBondContact O-N 3.04Å
199	N	96.5	Very high	97.2	Very high	125 Å²	125	66.4 Å²	66.4	67%	0.668	39%	0.39	S	S	*	.			trans	-59.3	131.8	171.8	-178.9	-45.7	0	0	0	109.7	D201	N199-D201 PolarHBondContact ND2-OD2 3.49Å; N199-D201 WeakPolarHBondContact OD1-CB 3.48Å; N199-D201 PolarHBondContact OD1-N 2.93Å; N199-D201 PolarHBondContact OD1-OD2 3.38Å; N199-D201 VanDerWaalsContact OD1-OD2 3.12Å
200	S	96.8	Very high	97.3	Very high	18 Å²	18	65.5 Å²	65.5	13%	0.126	38%	0.381	C	S	.	.			trans	-109.9	8.6	-175.7	56.7	0	0	0	0	114.1	P11 L198 A202 D203 K204	P11-S200 WeakPolarHBondContact CB-OG 3.41Å; P11-S200 WeakPolarHBondContact CG-OG 3.34Å; L198-S200 PolarHBondContact O-N 3.04Å; S200-A202 PolarHBondContact O-N 3.38Å; S200-A202 VanDerWaalsContact O-N 3.16Å; S200-D203 CarbonylContact O-C 3.57Å; S200-D203 VanDerWaalsContact O-C 3.26Å; S200-D203 PolarHBondContact O-N 3.46Å; S200-K204 WeakPolarHBondContact O-CG 3.41Å
201	D	96.8	Very high	97.5	Very high	98 Å²	98	62.6 Å²	62.6	52%	0.524	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-28.8	-177.2	-65.8	-26.7	0	0	0	112.9	N199 D203 K204	N199-D201 PolarHBondContact ND2-OD2 3.49Å; N199-D201 WeakPolarHBondContact OD1-CB 3.48Å; N199-D201 PolarHBondContact OD1-N 2.93Å; N199-D201 PolarHBondContact OD1-OD2 3.38Å; N199-D201 VanDerWaalsContact OD1-OD2 3.12Å; D201-D203 VanDerWaalsContact C-N 3.26Å; D201-D203 PolarHBondContact O-N 2.87Å; D201-K204 WeakPolarHBondContact OD1-CE 3.4Å; D201-K204 IonicContact OD1-NZ 2.66Å; D201-K204 PolarHBondContact OD1-NZ 2.97Å
202	A	96.5	Very high	97.6	Very high	108 Å²	108	62.7 Å²	62.7	89%	0.893	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-17.9	175.7	0	0	0	0	0	113.8	S200	S200-A202 PolarHBondContact O-N 3.38Å; S200-A202 VanDerWaalsContact O-N 3.16Å
203	D	97.5	Very high	97.6	Very high	93 Å²	93	66.1 Å²	66.1	50%	0.497	37%	0.374	S	S	.	.	S	Bend	trans	-144.9	71.9	-176.9	-172.8	25.8	0	0	0	111.8	S12 S200 D201	S12-D203 VanDerWaalsContact CB-OD2 3.3Å; S12-D203 WeakPolarHBondContact CB-OD2 3.45Å; S12-D203 PolarHBondContact N-O 3.39Å; S12-D203 VanDerWaalsContact OG-CG 3.27Å; S12-D203 PolarHBondContact OG-OD2 3.01Å; S200-D203 CarbonylContact O-C 3.57Å; S200-D203 VanDerWaalsContact O-C 3.26Å; S200-D203 PolarHBondContact O-N 3.46Å; D201-D203 VanDerWaalsContact C-N 3.26Å; D201-D203 PolarHBondContact O-N 2.87Å
204	K	97.9	Very high	97.6	Very high	74 Å²	74	67.4 Å²	67.4	32%	0.322	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	144.1	171.3	-65.4	-168.7	-179.6	165.4	0	111.1	P9 A10 S200 D201	P9-K204 HydrophobicContact CB-CB 4.1Å; P9-K204 HydrophobicContact CB-CD 3.56Å; P9-K204 HydrophobicContact CB-CG 4.45Å; A10-K204 VanDerWaalsContact O-CA 3.31Å; A10-K204 WeakPolarHBondContact O-CA 3.38Å; S200-K204 WeakPolarHBondContact O-CG 3.41Å; D201-K204 WeakPolarHBondContact OD1-CE 3.4Å; D201-K204 IonicContact OD1-NZ 2.66Å; D201-K204 PolarHBondContact OD1-NZ 2.97Å
205	I	98.3	Very high	97.6	Very high	34 Å²	34	68.3 Å²	68.3	17%	0.174	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	153.2	172.7	61.6	178.7	0	0	0	109.5	A10 Y210 Y211	A10-I205 PolarHBondContact N-O 2.76Å; A10-I205 PolarHBondContact O-N 2.6Å; I205-Y210 HydrophobicContact CB-CD2 4.15Å; I205-Y210 HydrophobicContact CB-CE2 4.28Å; I205-Y210 HydrophobicContact CD1-CD1 4.26Å; I205-Y210 HydrophobicContact CD1-CD2 3.95Å; I205-Y210 HydrophobicContact CD1-CG 3.75Å; I205-Y210 HydrophobicContact CG1-CD2 4.3Å; I205-Y211 HydrophobicContact CD1-CE2 3.82Å; I205-Y211 HydrophobicContact CG1-CE2 3.9Å
206	P	97.8	Very high	97.6	Very high	58 Å²	58	70.8 Å²	70.8	38%	0.377	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	146.1	173.2	28.9	-35.8	0	0	0	110.2	H208 Y210	P206-H208 VanDerWaalsContact C-N 3.35Å; P206-H208 WeakPolarHBondContact CB-O 3.38Å; P206-H208 WeakPolarHBondContact CG-O 3.14Å; P206-H208 PolarHBondContact O-N 3.34Å; P206-Y210 HydrophobicContact CG-CD2 4.29Å; P206-Y210 HydrophobicContact CG-CE2 4.12Å; P206-Y210 WeakPolarHBondContact O-CD2 3.47Å
207	F	98.3	Very high	97.7	Very high	31 Å²	31	71.5 Å²	71.5	14%	0.136	39%	0.394	C	S	.	.	S	Bend	trans	-63.8	-41.1	179.9	-172.1	-82.3	0	0	0	112	F5 I6 L8 A10 P209 Y210 Y211 T212 D215	F5-F207 HydrophobicContact CD2-CD1 4.46Å; F5-F207 HydrophobicContact CD2-CE1 4.16Å; F5-F207 HydrophobicContact CE2-CD1 4.48Å; F5-F207 AromaticContact CE2-CE1 3.86Å; F5-F207 HydrophobicContact CE2-CE1 3.86Å; F5-F207 HydrophobicContact CZ-CE1 4.27Å; F5-F207 WeakPolarHBondContact O-CB 3.47Å; F5-F207 WeakPolarHBondContact O-CD1 3.5Å; I6-F207 PolarHBondContact O-N 3.48Å; L8-F207 HydrophobicContact CB-CB 3.95Å; L8-F207 HydrophobicContact CD2-CD2 4.25Å; L8-F207 WeakPolarHBondContact O-CB 3.44Å; L8-F207 PolarHBondContact O-N 3.47Å; A10-F207 HydrophobicContact CB-CD2 4.5Å; F207-P209 CarbonylContact O-C 3.38Å; F207-Y210 PolarHBondContact O-N 2.92Å; F207-Y211 HydrophobicContact CD2-CD2 4.01Å; F207-Y211 HydrophobicContact CD2-CG 4.13Å; F207-Y211 HydrophobicContact CE2-CD2 4.46Å; F207-Y211 HydrophobicContact CE2-CG 4.16Å; F207-Y211 PolarHBondContact O-N 3.41Å; F207-T212 HydrophobicContact CD1-CG2 3.69Å; F207-T212 HydrophobicContact CE1-CG2 3.76Å; F207-T212 PolarHBondContact O-N 3.24Å; F207-D215 WeakPolarHBondContact CZ-OD2 3.34Å
208	H	98	Very high	97.8	Very high	95 Å²	95	69.8 Å²	69.8	44%	0.44	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	133.5	168.1	-175.1	71.4	0	0	0	110.7	I6 P206 T212	I6-H208 HydrophobicContact CG2-CB 4.07Å; I6-H208 PolarHBondContact O-N 3Å; P206-H208 VanDerWaalsContact C-N 3.35Å; P206-H208 WeakPolarHBondContact CB-O 3.38Å; P206-H208 WeakPolarHBondContact CG-O 3.14Å; P206-H208 PolarHBondContact O-N 3.34Å; H208-T212 HydrophobicContact CB-CG2 3.89Å; H208-T212 PolarHBondContact ND1-OG1 3.11Å
209	P	98.1	Very high	97.9	Very high	65 Å²	65	66 Å²	66	42%	0.422	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	cis	-88.6	-15	3.2	34.6	-35.5	0	0	0	114.9	F207 Y211 T212 I213	F207-P209 CarbonylContact O-C 3.38Å; P209-Y211 PolarHBondContact O-N 3.43Å; P209-T212 VanDerWaalsContact C-OG1 3.31Å; P209-T212 WeakPolarHBondContact CA-OG1 3.37Å; P209-T212 PolarHBondContact O-N 3.25Å; P209-T212 PolarHBondContact O-OG1 2.91Å; P209-I213 WeakPolarHBondContact O-CG2 3.16Å; P209-I213 PolarHBondContact O-N 3.21Å
210	Y	98.4	Very high	98	Very high	131 Å²	131	65.3 Å²	65.3	51%	0.514	35%	0.352	S	S	.	.	H	α-helix	trans	-58	-54.5	-163.2	-61.2	-80.5	0	0	0	114.3	I205 P206 F207 I213 K214	I205-Y210 HydrophobicContact CB-CD2 4.15Å; I205-Y210 HydrophobicContact CB-CE2 4.28Å; I205-Y210 HydrophobicContact CD1-CD1 4.26Å; I205-Y210 HydrophobicContact CD1-CD2 3.95Å; I205-Y210 HydrophobicContact CD1-CG 3.75Å; I205-Y210 HydrophobicContact CG1-CD2 4.3Å; P206-Y210 HydrophobicContact CG-CD2 4.29Å; P206-Y210 HydrophobicContact CG-CE2 4.12Å; P206-Y210 WeakPolarHBondContact O-CD2 3.47Å; F207-Y210 PolarHBondContact O-N 2.92Å; Y210-I213 WeakPolarHBondContact O-CG2 3.44Å; Y210-K214 WeakPolarHBondContact O-CB 3.48Å; Y210-K214 PolarHBondContact O-N 2.77Å
211	Y	98.3	Very high	98.1	Very high	13 Å²	13	68.6 Å²	68.6	5%	0.051	37%	0.367	C	S	.	.	H	α-helix	trans	-83.6	-25.7	-179.4	-66.3	-57.8	0	0	0	112.4	A10 P11 S12 I14 I205 F207 P209 I213 K214 D215	A10-Y211 HydrophobicContact CB-CD2 3.56Å; A10-Y211 HydrophobicContact CB-CE2 3.4Å; P11-Y211 PolarHBondContact O-OH 2.96Å; S12-Y211 PolarHBondContact O-OH 3.35Å; I14-Y211 HydrophobicContact CD1-CD1 3.84Å; I14-Y211 HydrophobicContact CD1-CD2 4.25Å; I14-Y211 HydrophobicContact CD1-CE1 3.49Å; I14-Y211 VanDerWaalsContact CD1-CE1 3.49Å; I14-Y211 HydrophobicContact CD1-CE2 3.89Å; I14-Y211 HydrophobicContact CD1-CG 4.24Å; I14-Y211 HydrophobicContact CG1-CD1 4.03Å; I14-Y211 HydrophobicContact CG1-CE1 3.27Å; I14-Y211 HydrophobicContact CG1-CE2 4.3Å; I14-Y211 VanDerWaalsContact CG1-CZ 3.43Å; I14-Y211 WeakPolarHBondContact CG1-OH 3.32Å; I205-Y211 HydrophobicContact CD1-CE2 3.82Å; I205-Y211 HydrophobicContact CG1-CE2 3.9Å; F207-Y211 HydrophobicContact CD2-CD2 4.01Å; F207-Y211 HydrophobicContact CD2-CG 4.13Å; F207-Y211 HydrophobicContact CE2-CD2 4.46Å; F207-Y211 HydrophobicContact CE2-CG 4.16Å; F207-Y211 PolarHBondContact O-N 3.41Å; P209-Y211 PolarHBondContact O-N 3.43Å; Y211-I213 PolarHBondContact O-N 3.01Å; Y211-K214 HydrophobicContact CD1-CD 3.92Å; Y211-K214 HydrophobicContact CE1-CD 4.14Å; Y211-K214 PolarHBondContact O-N 2.93Å; Y211-D215 VanDerWaalsContact O-CB 3.27Å; Y211-D215 WeakPolarHBondContact O-CB 3.4Å; Y211-D215 PolarHBondContact O-N 3.39Å
212	T	98.2	Very high	98.1	Very high	14 Å²	14	64.3 Å²	64.3	9%	0.086	34%	0.344	C	S	.	.	H	α-helix	trans	-60.4	-46.9	171.9	59.1	0	0	0	0	112.5	F5 F207 H208 P209 D215 I216	F5-T212 HydrophobicContact CD1-CG2 4.42Å; F5-T212 HydrophobicContact CE1-CG2 3.63Å; F5-T212 HydrophobicContact CZ-CG2 3.74Å; F207-T212 HydrophobicContact CD1-CG2 3.69Å; F207-T212 HydrophobicContact CE1-CG2 3.76Å; F207-T212 PolarHBondContact O-N 3.24Å; H208-T212 HydrophobicContact CB-CG2 3.89Å; H208-T212 PolarHBondContact ND1-OG1 3.11Å; P209-T212 VanDerWaalsContact C-OG1 3.31Å; P209-T212 WeakPolarHBondContact CA-OG1 3.37Å; P209-T212 PolarHBondContact O-N 3.25Å; P209-T212 PolarHBondContact O-OG1 2.91Å; T212-D215 PolarHBondContact O-N 2.75Å; T212-I216 WeakPolarHBondContact O-CD1 3.21Å; T212-I216 VanDerWaalsContact O-CG1 3.26Å; T212-I216 WeakPolarHBondContact O-CG1 3.47Å; T212-I216 PolarHBondContact O-N 2.75Å
213	I	98.4	Very high	98	Very high	108 Å²	108	63.1 Å²	63.1	55%	0.554	32%	0.319	S	S	*	.	H	α-helix	trans	-70.8	-36.5	179.5	-169.2	59.8	0	0	0	111.8	P209 Y210 Y211 I216 L217	P209-I213 WeakPolarHBondContact O-CG2 3.16Å; P209-I213 PolarHBondContact O-N 3.21Å; Y210-I213 WeakPolarHBondContact O-CG2 3.44Å; Y211-I213 PolarHBondContact O-N 3.01Å; I213-I216 PolarHBondContact O-N 3.24Å; I213-L217 PolarHBondContact O-N 3.01Å
214	K	98.4	Very high	97.9	Very high	47 Å²	47	66 Å²	66	20%	0.204	33%	0.333	C	S	.	.	H	α-helix	trans	-65.1	-40.8	176.7	-168.7	-170.3	171.1	-159.1	0	111.6	I14 S15 N19 Y210 Y211 L217 G218	I14-K214 PolarHBondContact O-NZ 3.33Å; S15-K214 PolarHBondContact O-NZ 3.15Å; N19-K214 PolarHBondContact ND2-O 3.46Å; N19-K214 WeakPolarHBondContact OD1-CE 3.27Å; N19-K214 PolarHBondContact OD1-NZ 2.94Å; Y210-K214 WeakPolarHBondContact O-CB 3.48Å; Y210-K214 PolarHBondContact O-N 2.77Å; Y211-K214 HydrophobicContact CD1-CD 3.92Å; Y211-K214 HydrophobicContact CE1-CD 4.14Å; Y211-K214 PolarHBondContact O-N 2.93Å; K214-L217 PolarHBondContact O-N 3.28Å; K214-G218 PolarHBondContact O-N 3.23Å
215	D	98.4	Very high	97.6	Very high	23 Å²	23	68.2 Å²	68.2	12%	0.123	35%	0.348	C	S	.	.	H	α-helix	trans	-66.9	-42.7	175.1	-82.4	-11.4	0	0	0	111.8	N19 S22 F207 Y211 T212 L217 G218 I219	N19-D215 PolarHBondContact ND2-OD1 3.19Å; S22-D215 VanDerWaalsContact CB-OD2 3.29Å; S22-D215 WeakPolarHBondContact CB-OD2 3.4Å; S22-D215 PolarHBondContact OG-OD1 3.18Å; S22-D215 PolarHBondContact OG-OD2 3.2Å; F207-D215 WeakPolarHBondContact CZ-OD2 3.34Å; Y211-D215 VanDerWaalsContact O-CB 3.27Å; Y211-D215 WeakPolarHBondContact O-CB 3.4Å; Y211-D215 PolarHBondContact O-N 3.39Å; T212-D215 PolarHBondContact O-N 2.75Å; D215-L217 VanDerWaalsContact C-N 3.28Å; D215-L217 PolarHBondContact O-N 3.32Å; D215-G218 PolarHBondContact O-N 3.48Å; D215-G218 VanDerWaalsContact O-N 3.11Å; D215-I219 VanDerWaalsContact O-CG1 3.25Å; D215-I219 WeakPolarHBondContact O-CG1 3.41Å; D215-I219 PolarHBondContact O-N 3.21Å
216	I	98.6	Very high	97	Very high	92 Å²	92	70.2 Å²	70.2	47%	0.472	36%	0.358	S	S	.	.	H	α-helix	trans	-57	-44.2	173.9	-70.6	164.9	0	0	0	110.6	T212 I213 G218 I219 L220	T212-I216 WeakPolarHBondContact O-CD1 3.21Å; T212-I216 VanDerWaalsContact O-CG1 3.26Å; T212-I216 WeakPolarHBondContact O-CG1 3.47Å; T212-I216 PolarHBondContact O-N 2.75Å; I213-I216 PolarHBondContact O-N 3.24Å; I216-G218 PolarHBondContact O-N 3.5Å; I216-I219 PolarHBondContact O-N 3.19Å; I216-L220 HydrophobicContact CG2-CD1 4.19Å; I216-L220 WeakPolarHBondContact O-CG 3.47Å; I216-L220 PolarHBondContact O-N 2.62Å
217	L	98.6	Very high	97	Very high	102 Å²	102	70.8 Å²	70.8	53%	0.534	36%	0.357	S	S	.	.	H	α-helix	trans	-60.4	-45.2	175.3	177.7	62.2	0	0	0	111.9	I213 K214 D215 I219 L220 I221	I213-L217 PolarHBondContact O-N 3.01Å; K214-L217 PolarHBondContact O-N 3.28Å; D215-L217 VanDerWaalsContact C-N 3.28Å; D215-L217 PolarHBondContact O-N 3.32Å; L217-I219 VanDerWaalsContact C-N 3.31Å; L217-I219 PolarHBondContact O-N 3.41Å; L217-L220 PolarHBondContact O-N 3.17Å; L217-I221 HydrophobicContact CD1-CD1 4.14Å; L217-I221 HydrophobicContact CD1-CG1 4.41Å; L217-I221 HydrophobicContact CG-CD1 4.03Å; L217-I221 WeakPolarHBondContact O-CG1 3.14Å; L217-I221 PolarHBondContact O-N 3.05Å
218	G	98.4	Very high	96.9	Very high	14 Å²	14	72.9 Å²	72.9	14%	0.144	37%	0.369	C	S	.	.	H	α-helix	trans	-59	-42.3	176	0	0	0	0	0	112.6	K214 D215 I216 I221 M222	K214-G218 PolarHBondContact O-N 3.23Å; D215-G218 PolarHBondContact O-N 3.48Å; D215-G218 VanDerWaalsContact O-N 3.11Å; I216-G218 PolarHBondContact O-N 3.5Å; G218-I221 PolarHBondContact O-N 3.47Å; G218-M222 PolarHBondContact O-N 3.41Å
219	I	98.5	Very high	96.8	Very high	42 Å²	42	71.7 Å²	71.7	22%	0.215	37%	0.365	C	S	.	.	H	α-helix	trans	-62.9	-45.3	177.5	-68.8	166.9	0	0	0	110.8	L23 V26 D215 I216 L217 I221 M222 F223	L23-I219 HydrophobicContact CD2-CB 4.48Å; L23-I219 HydrophobicContact CD2-CG1 3.87Å; V26-I219 HydrophobicContact CG2-CD1 3.74Å; V26-I219 HydrophobicContact CG2-CG1 3.98Å; D215-I219 VanDerWaalsContact O-CG1 3.25Å; D215-I219 WeakPolarHBondContact O-CG1 3.41Å; D215-I219 PolarHBondContact O-N 3.21Å; I216-I219 PolarHBondContact O-N 3.19Å; L217-I219 VanDerWaalsContact C-N 3.31Å; L217-I219 PolarHBondContact O-N 3.41Å; I219-I221 VanDerWaalsContact C-N 3.33Å; I219-I221 PolarHBondContact O-N 2.97Å; I219-M222 PolarHBondContact O-N 3.05Å; I219-F223 HydrophobicContact CG2-CD2 3.6Å; I219-F223 HydrophobicContact CG2-CE2 3.55Å; I219-F223 VanDerWaalsContact O-CD2 3.28Å; I219-F223 WeakPolarHBondContact O-CD2 3.43Å; I219-F223 PolarHBondContact O-N 3.39Å
220	L	98.3	Very high	96.7	Very high	112 Å²	112	72.1 Å²	72.1	59%	0.586	36%	0.362	S	S	*	.	H	α-helix	trans	-61.1	-42.2	177.2	-70.5	172.3	0	0	0	111.9	I216 L217 F223 L224	I216-L220 HydrophobicContact CG2-CD1 4.19Å; I216-L220 WeakPolarHBondContact O-CG 3.47Å; I216-L220 PolarHBondContact O-N 2.62Å; L217-L220 PolarHBondContact O-N 3.17Å; L220-F223 PolarHBondContact O-N 2.96Å; L220-L224 PolarHBondContact O-N 3.23Å
221	I	97.9	Very high	96.6	Very high	87 Å²	87	68.4 Å²	68.4	45%	0.446	35%	0.352	S	S	.	.	H	α-helix	trans	-64.2	-43.4	176.2	-66.5	166.2	0	0	0	110.6	L217 G218 I219 F223 L224 I225	L217-I221 HydrophobicContact CD1-CD1 4.14Å; L217-I221 HydrophobicContact CD1-CG1 4.41Å; L217-I221 HydrophobicContact CG-CD1 4.03Å; L217-I221 WeakPolarHBondContact O-CG1 3.14Å; L217-I221 PolarHBondContact O-N 3.05Å; G218-I221 PolarHBondContact O-N 3.47Å; I219-I221 VanDerWaalsContact C-N 3.33Å; I219-I221 PolarHBondContact O-N 2.97Å; I221-F223 PolarHBondContact O-N 3.31Å; I221-L224 WeakPolarHBondContact O-CB 3.39Å; I221-L224 PolarHBondContact O-N 3.08Å; I221-I225 HydrophobicContact CG2-CD1 4Å; I221-I225 WeakPolarHBondContact O-CG1 3.27Å; I221-I225 PolarHBondContact O-N 3.3Å
222	M	97.4	Very high	96.5	Very high	8 Å²	8	72.1 Å²	72.1	4%	0.039	37%	0.372	C	S	.	.	H	α-helix	trans	-59.5	-45.7	177.5	-175.2	-171	71.1	0	0	111.5	L23 V26 M76 G218 I219 L224 I225 L226	L23-M222 HydrophobicContact CB-SD 4.16Å; L23-M222 HydrophobicContact CD2-CB 4.1Å; L23-M222 HydrophobicContact CD2-SD 3.97Å; V26-M222 HydrophobicContact CB-CE 4.24Å; V26-M222 HydrophobicContact CG1-CE 3.65Å; M76-M222 HydrophobicContact CE-CG 4.13Å; M76-M222 HydrophobicContact CG-CG 3.77Å; M76-M222 HydrophobicContact CG-SD 3.98Å; M76-M222 HydrophobicContact SD-CG 3.9Å; G218-M222 PolarHBondContact O-N 3.41Å; I219-M222 PolarHBondContact O-N 3.05Å; M222-L224 VanDerWaalsContact C-N 3.29Å; M222-L224 PolarHBondContact O-N 3.17Å; M222-I225 PolarHBondContact O-N 2.95Å; M222-L226 WeakPolarHBondContact O-CB 3.39Å; M222-L226 PolarHBondContact O-N 2.83Å
223	F	95.3	Very high	96.4	Very high	82 Å²	82	76.2 Å²	76.2	36%	0.36	39%	0.393	S	S	.	.	H	α-helix	trans	-70.5	-21	177.4	-79.8	-63.8	0	0	0	114.1	V26 V30 I219 L220 I221 I225 L226	V26-F223 HydrophobicContact CG1-CE2 3.99Å; V26-F223 HydrophobicContact CG1-CZ 4.02Å; V30-F223 HydrophobicContact CG2-CE1 4.1Å; V30-F223 HydrophobicContact CG2-CZ 3.84Å; I219-F223 HydrophobicContact CG2-CD2 3.6Å; I219-F223 HydrophobicContact CG2-CE2 3.55Å; I219-F223 VanDerWaalsContact O-CD2 3.28Å; I219-F223 WeakPolarHBondContact O-CD2 3.43Å; I219-F223 PolarHBondContact O-N 3.39Å; L220-F223 PolarHBondContact O-N 2.96Å; I221-F223 PolarHBondContact O-N 3.31Å; F223-I225 VanDerWaalsContact C-N 3.3Å; F223-L226 HydrophobicContact CD1-CD2 4.11Å; F223-L226 HydrophobicContact CE1-CD2 4.18Å
224	L	94.9	Very high	96.3	Very high	153 Å²	153	73.8 Å²	73.8	80%	0.801	38%	0.38	S	S	*	.	H	α-helix	trans	-71.6	-29.1	171.9	-168.8	77.1	0	0	0	111.8	L220 I221 M222	L220-L224 PolarHBondContact O-N 3.23Å; I221-L224 WeakPolarHBondContact O-CB 3.39Å; I221-L224 PolarHBondContact O-N 3.08Å; M222-L224 VanDerWaalsContact C-N 3.29Å; M222-L224 PolarHBondContact O-N 3.17Å
225	I	90.8	Very high	96.1	Very high	121 Å²	121	76 Å²	76	62%	0.621	40%	0.395	S	S	*	.	H	α-helix	trans	-90.1	-28.1	-178	-61.3	167.2	0	0	0	111.5	M76 I221 M222 F223	M76-I225 HydrophobicContact CE-CB 4.04Å; M76-I225 HydrophobicContact CE-CG2 3.81Å; I221-I225 HydrophobicContact CG2-CD1 4Å; I221-I225 WeakPolarHBondContact O-CG1 3.27Å; I221-I225 PolarHBondContact O-N 3.3Å; M222-I225 PolarHBondContact O-N 2.95Å; F223-I225 VanDerWaalsContact C-N 3.3Å
226	L	85.9	Confident	95.9	Very high	76 Å²	76	80.8 Å²	80.8	40%	0.398	42%	0.42	S	S	.	.			trans	-76.7	0	-179.9	-175.5	67.6	0	0	0	112.5	M69 N72 M76 M222 F223	M69-L226 HydrophobicContact CG-CD2 4.5Å; N72-L226 HydrophobicContact CB-CD1 3.9Å; M76-L226 HydrophobicContact CB-CD1 4.12Å; M76-L226 HydrophobicContact CE-CB 4.35Å; M222-L226 WeakPolarHBondContact O-CB 3.39Å; M222-L226 PolarHBondContact O-N 2.83Å; F223-L226 HydrophobicContact CD1-CD2 4.11Å; F223-L226 HydrophobicContact CE1-CD2 4.18Å

Retrieved 226 of 226 residues in 48.9 ms (Link to these results)

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