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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 A0A023ND59, Species MOUSE (Mus musculus, Mouse), Gene cytB, Length 227 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	87.1	Confident	92.8	Very high	158 Å²	158	74.5 Å²	74.5	81%	0.81	39%	0.39	S	S	*	.				0	-68.2	0	-57.4	-179.4	0	0	0	110.1	H3 S4 F5 I6	I1-H3 PolarHBondContact O-N 3.01Å; I1-S4 PolarHBondContact N-OG 2.93Å; I1-S4 PolarHBondContact O-N 2.74Å; I1-S4 PolarHBondContact O-OG 3.31Å; I1-F5 WeakPolarHBondContact O-CB 3.43Å; I1-F5 PolarHBondContact O-N 3.44Å; I1-I6 HydrophobicContact CG2-CD1 4.4Å
2	N	91.4	Very high	93.3	Very high	89 Å²	89	71.9 Å²	71.9	48%	0.476	38%	0.383	S	S	.	.	I	π-helix	trans	-56.2	-57.6	-177.3	-67.5	12.4	0	0	0	113.3	S4 F5 I6 D7	N2-S4 VanDerWaalsContact C-N 3.25Å; N2-S4 PolarHBondContact O-N 3.28Å; N2-F5 PolarHBondContact O-N 3.01Å; N2-I6 PolarHBondContact O-N 3.42Å; N2-D7 PolarHBondContact O-N 3.06Å
3	H	89.5	Confident	93.6	Very high	164 Å²	164	71.3 Å²	71.3	76%	0.759	38%	0.38	S	S	*	.	I	π-helix	trans	-66.8	-20.8	-177.9	-61.1	-63.6	0	0	0	115.4	I1	I1-H3 PolarHBondContact O-N 3.01Å
4	S	85.8	Confident	93.9	Very high	52 Å²	52	67.4 Å²	67.4	36%	0.364	36%	0.359	S	S	.	.	I	π-helix	trans	-104.6	-5.1	-173.7	62.7	0	0	0	0	113.4	I1 N2	I1-S4 PolarHBondContact N-OG 2.93Å; I1-S4 PolarHBondContact O-N 2.74Å; I1-S4 PolarHBondContact O-OG 3.31Å; N2-S4 VanDerWaalsContact C-N 3.25Å; N2-S4 PolarHBondContact O-N 3.28Å
5	F	89.4	Confident	94.2	Very high	105 Å²	105	65.4 Å²	65.4	46%	0.461	35%	0.352	S	S	.	.	I	π-helix	trans	-153.2	-40.8	-171	-167.4	-98.5	0	0	0	114.4	I1 N2 F207 T212	I1-F5 WeakPolarHBondContact O-CB 3.43Å; I1-F5 PolarHBondContact O-N 3.44Å; N2-F5 PolarHBondContact O-N 3.01Å; F5-F207 HydrophobicContact CD2-CE1 4.23Å; F5-F207 AromaticContact CE2-CE1 3.94Å; F5-F207 HydrophobicContact CE2-CE1 3.94Å; F5-F207 HydrophobicContact CZ-CE1 4.32Å; F5-F207 WeakPolarHBondContact O-CB 3.45Å; F5-F207 WeakPolarHBondContact O-CD1 3.5Å; F5-T212 HydrophobicContact CD1-CG2 4.41Å; F5-T212 HydrophobicContact CE1-CG2 3.64Å; F5-T212 HydrophobicContact CZ-CG2 3.79Å
6	I	94.4	Very high	94.5	Very high	59 Å²	59	66.8 Å²	66.8	30%	0.303	37%	0.369	S	S	.	.	I	π-helix	trans	-88.3	-61.7	-176.5	-55.8	-177.9	0	0	0	109.6	I1 N2 L8 F207 H208	I1-I6 HydrophobicContact CG2-CD1 4.4Å; N2-I6 PolarHBondContact O-N 3.42Å; I6-L8 VanDerWaalsContact C-N 3.33Å; I6-F207 PolarHBondContact O-N 3.29Å; I6-H208 HydrophobicContact CG2-CB 4.06Å; I6-H208 PolarHBondContact O-N 3.41Å; I6-H208 VanDerWaalsContact O-N 3.07Å
7	D	94.9	Very high	94.7	Very high	87 Å²	87	69.5 Å²	69.5	47%	0.465	37%	0.372	S	S	.	.	S	Bend	trans	-93.8	7.4	-173.4	-54	-41.6	0	0	0	112.4	N2 P9	N2-D7 PolarHBondContact O-N 3.06Å; D7-P9 WeakPolarHBondContact O-CD 3.41Å
8	L	96.1	Very high	94.9	Very high	30 Å²	30	67.1 Å²	67.1	16%	0.157	36%	0.357	C	S	.	.			trans	-59	118.7	-179.4	177	67.5	0	0	0	109.7	I6 A10 F207	I6-L8 VanDerWaalsContact C-N 3.33Å; L8-A10 PolarHBondContact O-N 2.98Å; L8-F207 HydrophobicContact CB-CB 3.96Å; L8-F207 HydrophobicContact CD2-CD2 4.25Å; L8-F207 WeakPolarHBondContact O-CB 3.48Å; L8-F207 PolarHBondContact O-N 2.61Å
9	P	96.8	Very high	95.1	Very high	71 Å²	71	64 Å²	64	46%	0.461	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	118.1	178.3	-19.5	34.2	0	0	0	110.8	D7 K204	D7-P9 WeakPolarHBondContact O-CD 3.41Å; P9-K204 HydrophobicContact CB-CB 4.13Å; P9-K204 HydrophobicContact CB-CD 3.57Å; P9-K204 HydrophobicContact CB-CG 4.46Å
10	A	97.6	Very high	95.3	Very high	4 Å²	4	62.6 Å²	62.6	3%	0.033	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	145.5	179.6	0	0	0	0	0	110.8	L8 S12 K204 I205 F207 Y211	L8-A10 PolarHBondContact O-N 2.98Å; A10-S12 PolarHBondContact O-N 3.49Å; A10-K204 WeakPolarHBondContact O-CA 3.36Å; A10-I205 PolarHBondContact N-O 2.98Å; A10-I205 PolarHBondContact O-N 3.46Å; A10-F207 HydrophobicContact CB-CD2 4.47Å; A10-Y211 HydrophobicContact CB-CD2 3.56Å; A10-Y211 HydrophobicContact CB-CE2 3.4Å
11	P	98.1	Very high	95.4	Very high	1 Å²	1	61.1 Å²	61.1	1%	0.006	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.7	139.3	175.5	-16.3	26.1	0	0	0	110.2	N13 I14 S192 N194 S200 Y211	P11-N13 PolarHBondContact O-N 3.27Å; P11-I14 HydrophobicContact CB-CG2 4.05Å; P11-I14 HydrophobicContact CG-CG2 4.04Å; P11-S192 VanDerWaalsContact CG-O 3.3Å; P11-S192 WeakPolarHBondContact CG-O 3.41Å; P11-N194 HydrophobicContact CB-CB 3.78Å; P11-N194 HydrophobicContact CG-CB 4.08Å; P11-S200 WeakPolarHBondContact CB-OG 3.38Å; P11-S200 WeakPolarHBondContact CG-OG 3.36Å; P11-Y211 PolarHBondContact O-OH 3.45Å
12	S	97.9	Very high	96	Very high	43 Å²	43	55.1 Å²	55.1	30%	0.301	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-20.2	-176.6	66.3	0	0	0	0	114.8	A10 D203 Y211	A10-S12 PolarHBondContact O-N 3.49Å; S12-D203 VanDerWaalsContact CB-OD2 3.3Å; S12-D203 WeakPolarHBondContact CB-OD2 3.37Å; S12-D203 PolarHBondContact N-O 3.03Å; S12-D203 VanDerWaalsContact OG-CG 3.28Å; S12-D203 PolarHBondContact OG-OD2 3.32Å; S12-Y211 PolarHBondContact O-OH 3.44Å
13	N	98.1	Very high	96.3	Very high	64 Å²	64	51.5 Å²	51.5	34%	0.342	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.4	15.8	-165.1	69.3	-25.2	0	0	0	114.7	P11 S15 N194 P195	P11-N13 PolarHBondContact O-N 3.27Å; N13-S15 PolarHBondContact O-N 3.4Å; N13-N194 PolarHBondContact ND2-OD1 3.35Å; N13-N194 VanDerWaalsContact ND2-OD1 3.12Å; N13-N194 WeakPolarHBondContact OD1-CB 3.26Å; N13-P195 VanDerWaalsContact O-CD 3.32Å; N13-P195 WeakPolarHBondContact O-CD 3.44Å; N13-P195 WeakPolarHBondContact O-CG 3.42Å
14	I	97.9	Very high	96.7	Very high	17 Å²	17	44.9 Å²	44.9	9%	0.087	25%	0.254	C	S	.	.			trans	-68.8	126.6	178.1	57.5	172.2	0	0	0	111.5	P11 W18 N193 N194 Y211 K214	P11-I14 HydrophobicContact CB-CG2 4.05Å; P11-I14 HydrophobicContact CG-CG2 4.04Å; I14-W18 HydrophobicContact CB-CB 4.01Å; I14-W18 HydrophobicContact CB-CD2 3.76Å; I14-W18 HydrophobicContact CB-CE3 4.28Å; I14-W18 HydrophobicContact CB-CG 3.61Å; I14-W18 HydrophobicContact CD1-CB 3.88Å; I14-W18 HydrophobicContact CD1-CG 3.92Å; I14-W18 HydrophobicContact CG1-CB 4.29Å; I14-W18 HydrophobicContact CG1-CG 4.26Å; I14-W18 HydrophobicContact CG2-CD2 3.84Å; I14-W18 HydrophobicContact CG2-CG 3.88Å; I14-W18 HydrophobicContact CG2-CZ2 4.4Å; I14-N193 WeakPolarHBondContact CG2-O 3.44Å; I14-N194 HydrophobicContact CG2-CB 4.04Å; I14-Y211 HydrophobicContact CD1-CD1 3.88Å; I14-Y211 HydrophobicContact CD1-CD2 4.28Å; I14-Y211 HydrophobicContact CD1-CE1 3.56Å; I14-Y211 HydrophobicContact CD1-CE2 3.95Å; I14-Y211 HydrophobicContact CD1-CG 4.27Å; I14-Y211 HydrophobicContact CG1-CD1 4.06Å; I14-Y211 HydrophobicContact CG1-CE1 3.25Å; I14-Y211 HydrophobicContact CG1-CE2 4.05Å; I14-Y211 WeakPolarHBondContact CG1-OH 3.16Å; I14-K214 PolarHBondContact O-NZ 2.99Å
15	S	98.1	Very high	97.4	Very high	37 Å²	37	44 Å²	44	26%	0.259	25%	0.253	S	S	.	.			trans	-80.4	-179	-176.1	67	0	0	0	0	112.7	N13 W17 W18 K214	N13-S15 PolarHBondContact O-N 3.4Å; S15-W17 PolarHBondContact O-N 3.39Å; S15-W17 VanDerWaalsContact O-N 3.08Å; S15-W18 PolarHBondContact O-N 3.37Å; S15-W18 VanDerWaalsContact O-N 3.08Å; S15-K214 PolarHBondContact O-NZ 3.25Å
16	S	98.1	Very high	97.8	Very high	88 Å²	88	40.5 Å²	40.5	62%	0.615	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-59	-20.3	179.4	-53.8	0	0	0	0	113.9	W18 N19	S16-W18 PolarHBondContact O-N 3.4Å; S16-N19 VanDerWaalsContact CA-OD1 3.26Å; S16-N19 WeakPolarHBondContact CA-OD1 3.26Å; S16-N19 WeakPolarHBondContact O-CB 3.41Å; S16-N19 PolarHBondContact O-N 3.36Å; S16-N19 VanDerWaalsContact O-N 3.1Å; S16-N19 PolarHBondContact O-OD1 2.56Å; S16-N19 VanDerWaalsContact O-OD1 3.08Å
17	W	98.6	Very high	98	Very high	112 Å²	112	38 Å²	38	42%	0.424	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-62.7	-21.7	175.3	-64.3	108.3	0	0	0	113.6	S15 N19 F20 L83 R87 Y91	S15-W17 PolarHBondContact O-N 3.39Å; S15-W17 VanDerWaalsContact O-N 3.08Å; 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 4.15Å; W17-F20 WeakPolarHBondContact O-CD2 3.31Å; W17-L83 HydrophobicContact CH2-CD2 4.26Å; W17-L83 HydrophobicContact CZ3-CB 4.29Å; W17-L83 HydrophobicContact CZ3-CD2 3.74Å; W17-R87 HydrophobicContact CB-CB 4.13Å; W17-R87 HydrophobicContact CB-CG 3.61Å; W17-Y91 HydrophobicContact CB-CE2 4.43Å; W17-Y91 HydrophobicContact CG-CE2 4.44Å
18	W	98.6	Very high	98.2	Very high	26 Å²	26	34.8 Å²	34.8	10%	0.098	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-77	-18.6	175.6	-89.9	-113.9	0	0	0	113.7	I14 S15 S16 F20 G21 R87 Y91 N193 P195	I14-W18 HydrophobicContact CB-CB 4.01Å; I14-W18 HydrophobicContact CB-CD2 3.76Å; I14-W18 HydrophobicContact CB-CE3 4.28Å; I14-W18 HydrophobicContact CB-CG 3.61Å; I14-W18 HydrophobicContact CD1-CB 3.88Å; I14-W18 HydrophobicContact CD1-CG 3.92Å; I14-W18 HydrophobicContact CG1-CB 4.29Å; I14-W18 HydrophobicContact CG1-CG 4.26Å; I14-W18 HydrophobicContact CG2-CD2 3.84Å; I14-W18 HydrophobicContact CG2-CG 3.88Å; I14-W18 HydrophobicContact CG2-CZ2 4.4Å; S15-W18 PolarHBondContact O-N 3.37Å; S15-W18 VanDerWaalsContact O-N 3.08Å; S16-W18 PolarHBondContact O-N 3.4Å; W18-F20 PolarHBondContact O-N 3.03Å; W18-G21 PolarHBondContact O-N 3.07Å; W18-R87 HydrophobicContact CE3-CG 4.19Å; W18-R87 HydrophobicContact CH2-CG 4.44Å; W18-R87 HydrophobicContact CZ3-CG 4.03Å; W18-R87 VanDerWaalsContact NE1-NH1 3.19Å; W18-Y91 HydrophobicContact CH2-CD1 4.24Å; W18-Y91 AromaticContact CH2-CD2 3.52Å; W18-Y91 HydrophobicContact CH2-CD2 3.52Å; W18-Y91 AromaticContact CH2-CE2 4Å; W18-Y91 HydrophobicContact CH2-CE2 4Å; W18-Y91 AromaticContact CH2-CG 3.64Å; W18-Y91 HydrophobicContact CH2-CG 3.64Å; W18-Y91 AromaticContact CZ3-CD2 3.57Å; W18-Y91 HydrophobicContact CZ3-CD2 3.57Å; W18-Y91 AromaticContact CZ3-CE2 3.57Å; W18-Y91 HydrophobicContact CZ3-CE2 3.57Å; W18-Y91 HydrophobicContact CZ3-CG 4.11Å; W18-N193 VanDerWaalsContact CE2-O 3.24Å; W18-N193 HydrophobicContact CZ2-CB 4.27Å; W18-N193 VanDerWaalsContact CZ2-O 3.23Å; W18-N193 WeakPolarHBondContact CZ2-O 3.27Å; W18-N193 PolarHBondContact NE1-O 3.25Å; W18-P195 HydrophobicContact CH2-CG 4.34Å; W18-P195 HydrophobicContact CZ3-CG 4.07Å
19	N	98.6	Very high	98.3	Very high	9 Å²	9	38.2 Å²	38.2	5%	0.048	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-67.6	-22.9	179.3	-64.7	81.9	0	0	0	112.8	S16 W17 G21 S22 L23 K214 D215	S16-N19 VanDerWaalsContact CA-OD1 3.26Å; S16-N19 WeakPolarHBondContact CA-OD1 3.26Å; S16-N19 WeakPolarHBondContact O-CB 3.41Å; S16-N19 PolarHBondContact O-N 3.36Å; S16-N19 VanDerWaalsContact O-N 3.1Å; S16-N19 PolarHBondContact O-OD1 2.56Å; S16-N19 VanDerWaalsContact O-OD1 3.08Å; W17-N19 VanDerWaalsContact C-N 3.34Å; N19-G21 PolarHBondContact O-N 3.49Å; N19-S22 PolarHBondContact O-N 3.48Å; N19-S22 VanDerWaalsContact O-N 3.07Å; N19-S22 PolarHBondContact O-OG 2.92Å; N19-L23 WeakPolarHBondContact O-CG 3.26Å; N19-L23 PolarHBondContact O-N 2.92Å; N19-K214 PolarHBondContact ND2-O 3.26Å; N19-K214 WeakPolarHBondContact OD1-CE 3.48Å; N19-K214 PolarHBondContact OD1-NZ 3.45Å; N19-D215 PolarHBondContact ND2-OD1 3.19Å
20	F	98.7	Very high	98.4	Very high	36 Å²	36	35.9 Å²	35.9	16%	0.158	21%	0.21	C	C	.	.	H	α-helix	trans	-62.3	-20.4	-179	-68.7	-69	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 4.15Å; W17-F20 WeakPolarHBondContact O-CD2 3.31Å; W18-F20 PolarHBondContact O-N 3.03Å; F20-L23 HydrophobicContact CD1-CD1 3.92Å; F20-L23 HydrophobicContact CE1-CD1 4.08Å; F20-L24 WeakPolarHBondContact O-CB 3.2Å; F20-L24 WeakPolarHBondContact O-CD1 3.32Å; F20-L24 WeakPolarHBondContact O-CG 3.3Å; F20-L24 PolarHBondContact O-N 3.26Å; F20-L24 VanDerWaalsContact O-N 3.1Å; F20-C80 HydrophobicContact CD1-CB 4.16Å; F20-L83 HydrophobicContact CD1-CB 4.02Å; F20-L83 HydrophobicContact CD1-CD1 4.26Å; F20-L83 HydrophobicContact CD2-CB 3.85Å; F20-L83 HydrophobicContact CE1-CB 3.92Å; F20-L83 HydrophobicContact CE1-CD1 3.42Å; F20-L83 VanDerWaalsContact CE1-CD1 3.42Å; F20-L83 HydrophobicContact CE1-CG 4.3Å; F20-L83 HydrophobicContact CE2-CB 3.75Å; F20-L83 HydrophobicContact CE2-CD1 4.14Å; F20-L83 HydrophobicContact CE2-CG 4.47Å; F20-L83 HydrophobicContact CG-CB 4.01Å; F20-L83 HydrophobicContact CZ-CB 3.8Å; F20-L83 HydrophobicContact CZ-CD1 3.36Å; F20-L83 HydrophobicContact CZ-CG 4.14Å; F20-H84 HydrophobicContact CB-CB 3.91Å
21	G	98.3	Very high	98.4	Very high	32 Å²	32	36.9 Å²	36.9	33%	0.33	21%	0.214	S	C	.	.	H	α-helix	trans	-64.5	-49	171	0	0	0	0	0	112.8	W18 N19 L24 G25 H84	W18-G21 PolarHBondContact O-N 3.07Å; N19-G21 PolarHBondContact O-N 3.49Å; G21-L24 PolarHBondContact O-N 3.46Å; G21-G25 PolarHBondContact O-N 2.86Å; G21-H84 PolarHBondContact N-ND1 2.88Å
22	S	98.1	Very high	98.5	Very high	32 Å²	32	38.3 Å²	38.3	22%	0.224	22%	0.221	C	C	.	.	H	α-helix	trans	-69.3	-39	178.1	53.4	0	0	0	0	111.6	N19 L24 G25 I26 D215	N19-S22 PolarHBondContact O-N 3.48Å; N19-S22 VanDerWaalsContact O-N 3.07Å; N19-S22 PolarHBondContact O-OG 2.92Å; S22-L24 VanDerWaalsContact C-N 3.32Å; S22-L24 PolarHBondContact O-N 3.32Å; S22-G25 WeakPolarHBondContact O-CA 3.22Å; S22-G25 PolarHBondContact O-N 2.82Å; S22-G25 VanDerWaalsContact O-N 3.09Å; S22-I26 PolarHBondContact O-N 3.45Å; S22-D215 VanDerWaalsContact CB-OD2 3.31Å; S22-D215 WeakPolarHBondContact CB-OD2 3.41Å; S22-D215 PolarHBondContact OG-OD1 3.22Å; S22-D215 PolarHBondContact OG-OD2 3.14Å
23	L	98.7	Very high	98.5	Very high	13 Å²	13	41 Å²	41	7%	0.068	23%	0.232	C	C	.	.	H	α-helix	trans	-61.1	-36.9	175.5	-62.3	-178.4	0	0	0	113	N19 F20 G25 I26 C27 I219 M222	N19-L23 WeakPolarHBondContact O-CG 3.26Å; N19-L23 PolarHBondContact O-N 2.92Å; F20-L23 HydrophobicContact CD1-CD1 3.92Å; F20-L23 HydrophobicContact CE1-CD1 4.08Å; L23-G25 VanDerWaalsContact C-N 3.34Å; L23-I26 PolarHBondContact O-N 3.04Å; L23-C27 PolarHBondContact O-N 2.97Å; L23-C27 PolarHBondContact O-SG 2.94Å; L23-I219 HydrophobicContact CD2-CB 4.46Å; L23-I219 HydrophobicContact CD2-CG1 3.84Å; L23-M222 HydrophobicContact CB-SD 4.07Å; L23-M222 HydrophobicContact CD2-CB 4.03Å; L23-M222 HydrophobicContact CD2-SD 3.94Å; L23-M222 HydrophobicContact CG-SD 4.44Å
24	L	98.9	Very high	98.6	Very high	24 Å²	24	38.5 Å²	38.5	13%	0.126	22%	0.218	C	C	.	.	H	α-helix	trans	-63.5	-39.7	173.3	-75	168.9	0	0	0	112.1	F20 G21 S22 C27 L28 F77 C80 L81 H84	F20-L24 WeakPolarHBondContact O-CB 3.2Å; F20-L24 WeakPolarHBondContact O-CD1 3.32Å; F20-L24 WeakPolarHBondContact O-CG 3.3Å; F20-L24 PolarHBondContact O-N 3.26Å; F20-L24 VanDerWaalsContact O-N 3.1Å; G21-L24 PolarHBondContact O-N 3.46Å; S22-L24 VanDerWaalsContact C-N 3.32Å; S22-L24 PolarHBondContact O-N 3.32Å; L24-C27 PolarHBondContact O-N 2.82Å; L24-L28 PolarHBondContact O-N 3.33Å; L24-F77 HydrophobicContact CD2-CD2 3.55Å; L24-F77 HydrophobicContact CD2-CE2 3.52Å; L24-C80 HydrophobicContact CD2-CB 3.64Å; L24-C80 HydrophobicContact CG-CB 3.98Å; L24-L81 HydrophobicContact CD1-CD2 4.12Å; L24-L81 HydrophobicContact CD2-CB 4.32Å; L24-L81 HydrophobicContact CD2-CD2 3.86Å; L24-L81 HydrophobicContact CD2-CG 3.61Å; L24-H84 HydrophobicContact CD1-CB 3.78Å
25	G	98.6	Very high	98.6	Very high	34 Å²	34	38.5 Å²	38.5	35%	0.351	22%	0.222	S	C	.	.	H	α-helix	trans	-60.2	-44.4	172.3	0	0	0	0	0	112.3	G21 S22 L23 L28 M29	G21-G25 PolarHBondContact O-N 2.86Å; S22-G25 WeakPolarHBondContact O-CA 3.22Å; S22-G25 PolarHBondContact O-N 2.82Å; S22-G25 VanDerWaalsContact O-N 3.09Å; L23-G25 VanDerWaalsContact C-N 3.34Å; G25-L28 PolarHBondContact O-N 3.1Å; G25-M29 WeakPolarHBondContact O-CG 3.39Å; G25-M29 PolarHBondContact O-N 3.27Å; G25-M29 VanDerWaalsContact O-N 3.09Å
26	I	98.6	Very high	98.6	Very high	32 Å²	32	39.6 Å²	39.6	16%	0.164	23%	0.225	C	C	.	.	H	α-helix	trans	-64.2	-44.7	174.7	-57.8	-48.1	0	0	0	111.3	S22 L23 L28 M29 V30 I219 M222 F223	S22-I26 PolarHBondContact O-N 3.45Å; L23-I26 PolarHBondContact O-N 3.04Å; I26-L28 VanDerWaalsContact C-N 3.3Å; I26-L28 PolarHBondContact O-N 2.77Å; I26-M29 HydrophobicContact CD1-CE 3.24Å; I26-M29 HydrophobicContact CG1-CE 4.42Å; I26-M29 PolarHBondContact O-N 2.58Å; I26-V30 HydrophobicContact CG2-CG2 4.14Å; I26-V30 WeakPolarHBondContact O-CG2 3.34Å; I26-V30 PolarHBondContact O-N 3.2Å; I26-I219 HydrophobicContact CD1-CD1 3.91Å; I26-I219 HydrophobicContact CG1-CD1 3.67Å; I26-I219 HydrophobicContact CG1-CG1 3.8Å; I26-M222 HydrophobicContact CB-CE 4.07Å; I26-M222 HydrophobicContact CG2-CE 3.58Å; I26-F223 HydrophobicContact CG2-CE2 4.03Å; I26-F223 HydrophobicContact CG2-CZ 3.89Å
27	C	98.8	Very high	98.7	Very high	6 Å²	6	40.4 Å²	40.4	4%	0.041	22%	0.218	C	C	.	.	H	α-helix	trans	-55.8	-46.5	176.7	-71.6	0	0	0	0	111	L23 L24 M29 V30 Q31 F77	L23-C27 PolarHBondContact O-N 2.97Å; L23-C27 PolarHBondContact O-SG 2.94Å; L24-C27 PolarHBondContact O-N 2.82Å; C27-M29 PolarHBondContact O-N 2.91Å; C27-V30 PolarHBondContact O-N 3.2Å; C27-Q31 WeakPolarHBondContact O-CB 3.4Å; C27-Q31 VanDerWaalsContact O-CG 3.26Å; C27-Q31 WeakPolarHBondContact O-CG 3.49Å; C27-Q31 PolarHBondContact O-N 3.43Å; C27-F77 HydrophobicContact CB-CB 4.1Å; C27-F77 HydrophobicContact CB-CD1 3.68Å; C27-F77 HydrophobicContact CB-CD2 4.37Å; C27-F77 HydrophobicContact CB-CE1 4.18Å; C27-F77 HydrophobicContact CB-CG 3.78Å
28	L	98.8	Very high	98.7	Very high	19 Å²	19	36.3 Å²	36.3	10%	0.099	20%	0.204	C	C	.	.	H	α-helix	trans	-59.8	-45.8	177.3	-178.1	61.7	0	0	0	112.2	L24 G25 I26 Q31 I32 F77 I176 A177	L24-L28 PolarHBondContact O-N 3.33Å; G25-L28 PolarHBondContact O-N 3.1Å; I26-L28 VanDerWaalsContact C-N 3.3Å; I26-L28 PolarHBondContact O-N 2.77Å; L28-Q31 PolarHBondContact O-N 2.9Å; L28-I32 HydrophobicContact CD1-CD1 3.98Å; L28-I32 HydrophobicContact CD1-CG1 4.3Å; L28-I32 HydrophobicContact CG-CD1 3.94Å; L28-I32 WeakPolarHBondContact O-CG1 3.11Å; L28-I32 PolarHBondContact O-N 3.17Å; L28-F77 HydrophobicContact CB-CE1 3.99Å; L28-F77 HydrophobicContact CB-CZ 4.17Å; L28-F77 HydrophobicContact CD1-CE1 4.2Å; L28-F77 HydrophobicContact CD1-CZ 4.49Å; L28-I176 HydrophobicContact CD1-CB 4.39Å; L28-I176 HydrophobicContact CD1-CG2 3.91Å; L28-I176 HydrophobicContact CD2-CG2 3.99Å; L28-A177 HydrophobicContact CD2-CB 3.99Å
29	M	98.7	Very high	98.7	Very high	102 Å²	102	36.1 Å²	36.1	50%	0.502	21%	0.208	S	C	.	.	H	α-helix	trans	-62.8	-44.8	177	-71.1	-171.4	-64.9	0	0	112.3	G25 I26 C27 Q31 I32 I33	G25-M29 WeakPolarHBondContact O-CG 3.39Å; G25-M29 PolarHBondContact O-N 3.27Å; G25-M29 VanDerWaalsContact O-N 3.09Å; I26-M29 HydrophobicContact CD1-CE 3.24Å; I26-M29 HydrophobicContact CG1-CE 4.42Å; I26-M29 PolarHBondContact O-N 2.58Å; C27-M29 PolarHBondContact O-N 2.91Å; M29-Q31 VanDerWaalsContact C-N 3.31Å; M29-Q31 PolarHBondContact O-N 3.25Å; M29-I32 PolarHBondContact O-N 3.45Å; M29-I33 WeakPolarHBondContact O-CB 3.26Å; M29-I33 VanDerWaalsContact O-CG1 3.27Å; M29-I33 WeakPolarHBondContact O-CG1 3.32Å; M29-I33 PolarHBondContact O-N 3.46Å
30	V	98.5	Very high	98.7	Very high	23 Å²	23	42 Å²	42	14%	0.139	24%	0.237	C	C	.	.	H	α-helix	trans	-59.1	-44.9	176.4	170.5	0	0	0	0	110.4	I26 C27 T34 F223	I26-V30 HydrophobicContact CG2-CG2 4.14Å; I26-V30 WeakPolarHBondContact O-CG2 3.34Å; I26-V30 PolarHBondContact O-N 3.2Å; C27-V30 PolarHBondContact O-N 3.2Å; V30-T34 HydrophobicContact CG1-CG2 4.3Å; V30-T34 WeakPolarHBondContact O-CB 3.35Å; V30-T34 WeakPolarHBondContact O-CG2 3.22Å; V30-T34 PolarHBondContact O-N 3.1Å; V30-T34 PolarHBondContact O-OG1 3.21Å; V30-F223 HydrophobicContact CG2-CE1 4.11Å; V30-F223 HydrophobicContact CG2-CZ 4Å
31	Q	98.8	Very high	98.7	Very high	24 Å²	24	44.1 Å²	44.1	11%	0.112	25%	0.247	C	C	.	.	H	α-helix	trans	-64.4	-43.9	178.9	-70.6	-58.1	-60.4	0	0	112.5	C27 L28 M29 T34 G35 H70 G73 F77	C27-Q31 WeakPolarHBondContact O-CB 3.4Å; C27-Q31 VanDerWaalsContact O-CG 3.26Å; C27-Q31 WeakPolarHBondContact O-CG 3.49Å; C27-Q31 PolarHBondContact O-N 3.43Å; L28-Q31 PolarHBondContact O-N 2.9Å; M29-Q31 VanDerWaalsContact C-N 3.31Å; M29-Q31 PolarHBondContact O-N 3.25Å; Q31-T34 PolarHBondContact O-OG1 3.08Å; Q31-G35 WeakPolarHBondContact O-CA 3.37Å; Q31-G35 PolarHBondContact O-N 2.77Å; Q31-H70 PolarHBondContact NE2-O 3.43Å; Q31-H70 PolarHBondContact O-CE1 2.95Å; Q31-H70 VanDerWaalsContact O-CE1 3.27Å; Q31-H70 PolarHBondContact O-ND1 3.37Å; Q31-H70 PolarHBondContact OE1-CE1 3.47Å; Q31-H70 VanDerWaalsContact OE1-CE1 3.28Å; Q31-H70 PolarHBondContact OE1-ND1 3.19Å; Q31-H70 PolarHBondContact OE1-O 3.19Å; Q31-G73 VanDerWaalsContact NE2-CA 3.29Å; Q31-F77 HydrophobicContact CG-CD1 4.06Å
32	I	98.9	Very high	98.7	Very high	31 Å²	31	43.9 Å²	43.9	16%	0.159	24%	0.237	C	C	.	.	H	α-helix	trans	-63.2	-48.7	177.6	-69.7	169.1	0	0	0	110.4	L28 M29 G35 L36 P173 F174	L28-I32 HydrophobicContact CD1-CD1 3.98Å; L28-I32 HydrophobicContact CD1-CG1 4.3Å; L28-I32 HydrophobicContact CG-CD1 3.94Å; L28-I32 WeakPolarHBondContact O-CG1 3.11Å; L28-I32 PolarHBondContact O-N 3.17Å; M29-I32 PolarHBondContact O-N 3.45Å; I32-G35 PolarHBondContact O-N 2.74Å; I32-L36 HydrophobicContact CG2-CD1 3.85Å; I32-L36 HydrophobicContact CG2-CG 4.42Å; I32-L36 WeakPolarHBondContact O-CB 3.18Å; I32-L36 WeakPolarHBondContact O-CG 3.43Å; I32-L36 PolarHBondContact O-N 3.08Å; I32-P173 HydrophobicContact CD1-CB 4.28Å; I32-P173 HydrophobicContact CG1-CB 3.76Å; I32-F174 HydrophobicContact CG2-CE1 3.97Å; I32-F174 HydrophobicContact CG2-CZ 4.12Å
33	I	98.8	Very high	98.8	Very high	101 Å²	101	45.4 Å²	45.4	52%	0.518	24%	0.244	S	C	.	.	H	α-helix	trans	-63.5	-54.7	-178.1	-66.3	166.2	0	0	0	110.1	M29 G35 L36 F37	M29-I33 WeakPolarHBondContact O-CB 3.26Å; M29-I33 VanDerWaalsContact O-CG1 3.27Å; M29-I33 WeakPolarHBondContact O-CG1 3.32Å; M29-I33 PolarHBondContact O-N 3.46Å; I33-G35 VanDerWaalsContact C-N 3.32Å; I33-G35 PolarHBondContact O-N 3.24Å; I33-L36 PolarHBondContact O-N 3.47Å; I33-F37 HydrophobicContact CG2-CD2 4.3Å; I33-F37 HydrophobicContact CG2-CE2 4.32Å; I33-F37 WeakPolarHBondContact O-CD2 3.36Å; I33-F37 PolarHBondContact O-N 2.92Å
34	T	98.8	Very high	98.7	Very high	10 Å²	10	46.2 Å²	46.2	6%	0.061	25%	0.251	C	S	.	.	H	α-helix	trans	-62.1	-41	-179.7	53.5	0	0	0	0	111.8	V30 Q31 L36 F37 L38 I66 M69 H70	V30-T34 HydrophobicContact CG1-CG2 4.3Å; V30-T34 WeakPolarHBondContact O-CB 3.35Å; V30-T34 WeakPolarHBondContact O-CG2 3.22Å; V30-T34 PolarHBondContact O-N 3.1Å; V30-T34 PolarHBondContact O-OG1 3.21Å; Q31-T34 PolarHBondContact O-OG1 3.08Å; T34-L36 PolarHBondContact O-N 3.35Å; T34-F37 PolarHBondContact O-N 3.3Å; T34-L38 VanDerWaalsContact O-CG 3.27Å; T34-L38 WeakPolarHBondContact O-CG 3.09Å; T34-L38 PolarHBondContact O-N 3.04Å; T34-I66 HydrophobicContact CG2-CG2 4.21Å; T34-M69 HydrophobicContact CG2-CB 4.21Å; T34-M69 HydrophobicContact CG2-CE 4.17Å; T34-H70 PolarHBondContact OG1-ND1 3.35Å
35	G	98.8	Very high	98.7	Very high	17 Å²	17	47 Å²	47	18%	0.175	26%	0.256	C	S	.	.	H	α-helix	trans	-62.6	-41	177.9	0	0	0	0	0	113.1	Q31 I32 I33 L38 A39 H70	Q31-G35 WeakPolarHBondContact O-CA 3.37Å; Q31-G35 PolarHBondContact O-N 2.77Å; I32-G35 PolarHBondContact O-N 2.74Å; I33-G35 VanDerWaalsContact C-N 3.32Å; I33-G35 PolarHBondContact O-N 3.24Å; G35-L38 PolarHBondContact O-N 3.49Å; G35-A39 VanDerWaalsContact O-CB 3.31Å; G35-A39 WeakPolarHBondContact O-CB 3.38Å; G35-A39 PolarHBondContact O-N 2.89Å; G35-H70 VanDerWaalsContact CA-CE1 3.45Å; G35-H70 WeakPolarHBondContact CA-CE1 3.15Å; G35-H70 PolarHBondContact N-ND1 3.08Å
36	L	98.8	Very high	98.7	Very high	60 Å²	60	46.9 Å²	46.9	31%	0.314	25%	0.248	S	C	.	.	H	α-helix	trans	-61.7	-45.7	174.9	-76.7	170.1	0	0	0	111.9	I32 I33 T34 L38 A39 M40 F170 F174	I32-L36 HydrophobicContact CG2-CD1 3.85Å; I32-L36 HydrophobicContact CG2-CG 4.42Å; I32-L36 WeakPolarHBondContact O-CB 3.18Å; I32-L36 WeakPolarHBondContact O-CG 3.43Å; I32-L36 PolarHBondContact O-N 3.08Å; I33-L36 PolarHBondContact O-N 3.47Å; T34-L36 PolarHBondContact O-N 3.35Å; L36-L38 VanDerWaalsContact C-N 3.35Å; L36-L38 PolarHBondContact O-N 3.12Å; L36-A39 PolarHBondContact O-N 3.26Å; L36-M40 WeakPolarHBondContact O-CG 3.27Å; L36-M40 PolarHBondContact O-N 2.98Å; L36-F170 HydrophobicContact CD2-CE2 3.7Å; L36-F170 HydrophobicContact CD2-CZ 3.52Å; L36-F174 HydrophobicContact CD2-CZ 4.41Å
37	F	98.8	Very high	98.7	Very high	106 Å²	106	53 Å²	53	47%	0.465	28%	0.278	S	S	.	.	H	α-helix	trans	-64.9	-37.9	176.9	-85.6	-96.7	0	0	0	112.3	I33 T34 M40 H41 I66	I33-F37 HydrophobicContact CG2-CD2 4.3Å; I33-F37 HydrophobicContact CG2-CE2 4.32Å; I33-F37 WeakPolarHBondContact O-CD2 3.36Å; I33-F37 PolarHBondContact O-N 2.92Å; T34-F37 PolarHBondContact O-N 3.3Å; F37-M40 PolarHBondContact O-N 3.45Å; F37-H41 PolarHBondContact O-CD2 3.11Å; F37-I66 HydrophobicContact CB-CD1 4.28Å; F37-I66 HydrophobicContact CB-CG2 4.2Å
38	L	98.9	Very high	98.7	Very high	25 Å²	25	55.2 Å²	55.2	13%	0.131	29%	0.291	C	S	.	.	H	α-helix	trans	-64.8	-42.1	173.7	-67.4	171.2	0	0	0	111.7	T34 G35 L36 M40 H41 Y42 I56 I66 R67 H70	T34-L38 VanDerWaalsContact O-CG 3.27Å; T34-L38 WeakPolarHBondContact O-CG 3.09Å; T34-L38 PolarHBondContact O-N 3.04Å; G35-L38 PolarHBondContact O-N 3.49Å; L36-L38 VanDerWaalsContact C-N 3.35Å; L36-L38 PolarHBondContact O-N 3.12Å; L38-M40 PolarHBondContact O-N 3.21Å; L38-H41 PolarHBondContact O-N 3.18Å; L38-Y42 WeakPolarHBondContact O-CB 3.5Å; L38-Y42 PolarHBondContact O-N 3.07Å; L38-Y42 VanDerWaalsContact O-N 3.09Å; L38-I56 HydrophobicContact CD2-CD1 4.31Å; 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 3.51Å
39	A	98.8	Very high	98.7	Very high	23 Å²	23	54.3 Å²	54.3	19%	0.19	29%	0.287	C	S	.	.	H	α-helix	trans	-62.5	-29	-179.2	0	0	0	0	0	113	G35 L36 H41 F166 F170	G35-A39 VanDerWaalsContact O-CB 3.31Å; G35-A39 WeakPolarHBondContact O-CB 3.38Å; G35-A39 PolarHBondContact O-N 2.89Å; L36-A39 PolarHBondContact O-N 3.26Å; A39-H41 PolarHBondContact O-N 2.86Å; A39-F166 HydrophobicContact CB-CE2 4.23Å; A39-F166 HydrophobicContact CB-CZ 4.11Å; A39-F170 HydrophobicContact CB-CD2 4.27Å; A39-F170 HydrophobicContact CB-CE2 4.07Å
40	M	98.8	Very high	98.7	Very high	132 Å²	132	55.2 Å²	55.2	65%	0.65	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-18.4	175	-66.7	175.1	-168.8	0	0	113.5	L36 F37 L38	L36-M40 WeakPolarHBondContact O-CG 3.27Å; L36-M40 PolarHBondContact O-N 2.98Å; F37-M40 PolarHBondContact O-N 3.45Å; L38-M40 PolarHBondContact O-N 3.21Å
41	H	98.7	Very high	98.7	Very high	81 Å²	81	56.9 Å²	56.9	38%	0.375	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.7	-5.2	-175.7	-62.5	-67.4	0	0	0	113.8	F37 L38 A39 I56 V60	F37-H41 PolarHBondContact O-CD2 3.11Å; L38-H41 PolarHBondContact O-N 3.18Å; A39-H41 PolarHBondContact O-N 2.86Å; H41-I56 HydrophobicContact CB-CD1 3.85Å; H41-I56 HydrophobicContact CB-CG1 3.51Å; H41-V60 HydrophobicContact CB-CG2 4.43Å
42	Y	98.9	Very high	98.7	Very high	27 Å²	27	56.1 Å²	56.1	11%	0.106	30%	0.298	C	S	.	.			trans	-91.2	145.7	-177.4	173.4	-102.7	0	0	0	111.9	L38 A49 S52 V53 L120 F166	L38-Y42 WeakPolarHBondContact O-CB 3.5Å; L38-Y42 PolarHBondContact O-N 3.07Å; L38-Y42 VanDerWaalsContact O-N 3.09Å; Y42-A49 HydrophobicContact CE2-CB 4.05Å; Y42-S52 VanDerWaalsContact CD2-OG 3.25Å; Y42-S52 WeakPolarHBondContact CD2-OG 3.42Å; 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 3.49Å; Y42-L120 PolarHBondContact OH-O 3.06Å; Y42-F166 AromaticContact CD1-CD2 3.74Å; Y42-F166 HydrophobicContact CD1-CD2 3.74Å; Y42-F166 AromaticContact CD1-CE2 3.65Å; Y42-F166 HydrophobicContact CD1-CE2 3.65Å; Y42-F166 HydrophobicContact CD1-CG 4.3Å; Y42-F166 HydrophobicContact CD1-CZ 4.16Å; Y42-F166 HydrophobicContact CE1-CB 4.34Å; Y42-F166 AromaticContact CE1-CD2 3.65Å; Y42-F166 HydrophobicContact CE1-CD2 3.65Å; Y42-F166 HydrophobicContact CE1-CE2 4.08Å; Y42-F166 AromaticContact CE1-CG 3.95Å; Y42-F166 HydrophobicContact CE1-CG 3.95Å
43	T	98.6	Very high	98.7	Very high	63 Å²	63	55.7 Å²	55.7	39%	0.387	30%	0.297	S	S	.	.			trans	-121.2	123.8	173.7	56.5	0	0	0	0	111.5	D45 T48 A49 S52	T43-D45 VanDerWaalsContact C-N 3.25Å; T43-D45 PolarHBondContact O-N 3.34Å; T43-D45 VanDerWaalsContact O-N 3.1Å; T43-T48 WeakPolarHBondContact OG1-CB 3.4Å; T43-T48 PolarHBondContact OG1-OG1 2.91Å; T43-A49 VanDerWaalsContact O-CA 3.27Å; T43-A49 WeakPolarHBondContact O-CA 3.35Å; T43-A49 WeakPolarHBondContact O-CB 3.48Å; T43-S52 PolarHBondContact N-OG 3.07Å; T43-S52 WeakPolarHBondContact OG1-CB 3.23Å
44	S	98.2	Very high	98.7	Very high	30 Å²	30	53.3 Å²	53.3	21%	0.21	29%	0.287	C	S	.	.			trans	-87	45.6	-177.7	70.4	0	0	0	0	113.7	T163	S44-T163 PolarHBondContact O-OG1 3.21Å
45	D	98.4	Very high	98.7	Very high	41 Å²	41	56.8 Å²	56.8	22%	0.219	30%	0.302	C	S	.	.			trans	-117	135.3	174.3	-178.6	-77.1	0	0	0	109.6	T43 M47 T48 A49 K159	T43-D45 VanDerWaalsContact C-N 3.25Å; T43-D45 PolarHBondContact O-N 3.34Å; T43-D45 VanDerWaalsContact O-N 3.1Å; D45-M47 PolarHBondContact O-N 3.43Å; D45-M47 VanDerWaalsContact O-N 3.1Å; D45-M47 VanDerWaalsContact OD1-CB 3.32Å; D45-M47 WeakPolarHBondContact OD1-CB 3.3Å; D45-M47 PolarHBondContact OD1-N 3.46Å; D45-T48 CarbonylContact O-C 3.6Å; D45-T48 PolarHBondContact O-N 3.31Å; D45-A49 WeakPolarHBondContact O-CB 3.04Å; D45-A49 PolarHBondContact O-N 2.85Å; D45-K159 WeakPolarHBondContact OD2-CE 3.31Å; D45-K159 IonicContact OD2-NZ 2.67Å; D45-K159 PolarHBondContact OD2-NZ 3.3Å
46	T	98.1	Very high	98.7	Very high	31 Å²	31	56.2 Å²	56.2	19%	0.19	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-25.3	-172.4	49.1	0	0	0	0	113.7	W122 K159 L162	T46-W122 HydrophobicContact CG2-CD2 4.48Å; T46-W122 HydrophobicContact CG2-CH2 4.26Å; T46-W122 HydrophobicContact CG2-CZ2 3.53Å; T46-K159 HydrophobicContact CG2-CB 4.02Å; T46-L162 HydrophobicContact CG2-CB 4.38Å; T46-L162 HydrophobicContact CG2-CD2 3.9Å
47	M	98.4	Very high	98.7	Very high	160 Å²	160	54.7 Å²	54.7	79%	0.788	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-23	176.8	-58.5	-60.3	-60.8	0	0	112.7	D45	D45-M47 PolarHBondContact O-N 3.43Å; D45-M47 VanDerWaalsContact O-N 3.1Å; D45-M47 VanDerWaalsContact OD1-CB 3.32Å; D45-M47 WeakPolarHBondContact OD1-CB 3.3Å; D45-M47 PolarHBondContact OD1-N 3.46Å
48	T	98.6	Very high	98.7	Very high	53 Å²	53	59.4 Å²	59.4	33%	0.325	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.9	-16.9	-171.4	61.9	0	0	0	0	114.7	T43 D45 F50 S51 S52	T43-T48 WeakPolarHBondContact OG1-CB 3.4Å; T43-T48 PolarHBondContact OG1-OG1 2.91Å; D45-T48 CarbonylContact O-C 3.6Å; D45-T48 PolarHBondContact O-N 3.31Å; T48-F50 PolarHBondContact O-N 3.45Å; T48-S51 WeakPolarHBondContact CA-OG 3.39Å; T48-S51 CarbonylContact O-C 3.57Å; T48-S51 PolarHBondContact O-N 3.34Å; T48-S51 VanDerWaalsContact O-N 3.08Å; T48-S51 PolarHBondContact O-OG 3.38Å; T48-S52 WeakPolarHBondContact O-CB 3.31Å; T48-S52 PolarHBondContact O-N 3.17Å
49	A	98.6	Very high	98.6	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-54.2	-53.7	-173.6	0	0	0	0	0	112.9	Y42 T43 D45 S51 S52 V53 W122 L162	Y42-A49 HydrophobicContact CE2-CB 4.05Å; T43-A49 VanDerWaalsContact O-CA 3.27Å; T43-A49 WeakPolarHBondContact O-CA 3.35Å; T43-A49 WeakPolarHBondContact O-CB 3.48Å; D45-A49 WeakPolarHBondContact O-CB 3.04Å; D45-A49 PolarHBondContact O-N 2.85Å; A49-S51 PolarHBondContact O-N 3.42Å; A49-S52 PolarHBondContact O-N 3.04Å; A49-S52 PolarHBondContact O-OG 2.66Å; A49-V53 PolarHBondContact O-N 2.77Å; A49-W122 HydrophobicContact CB-CB 3.92Å; A49-L162 HydrophobicContact CB-CD2 3.72Å
50	F	98.7	Very high	98.6	Very high	122 Å²	122	63.7 Å²	63.7	54%	0.535	33%	0.325	S	S	.	.	H	α-helix	trans	-58.9	-47.3	176.9	-174.2	-90.1	0	0	0	111.6	T48 S52 V53 T54 P121	T48-F50 PolarHBondContact O-N 3.45Å; F50-S52 VanDerWaalsContact C-N 3.32Å; F50-S52 PolarHBondContact O-N 2.85Å; F50-V53 PolarHBondContact O-N 3.12Å; F50-T54 HydrophobicContact CD1-CG2 4.06Å; F50-T54 HydrophobicContact CE1-CG2 3.7Å; F50-T54 HydrophobicContact CZ-CG2 4.25Å; F50-T54 PolarHBondContact O-N 3.44Å; F50-P121 WeakPolarHBondContact CA-O 3.39Å; F50-P121 WeakPolarHBondContact CD2-O 3.27Å
51	S	98.7	Very high	98.6	Very high	57 Å²	57	64.3 Å²	64.3	40%	0.399	33%	0.331	S	S	.	.	H	α-helix	trans	-63.3	-36.1	-180	66.4	0	0	0	0	112.8	T48 A49 V53 T54 H55	T48-S51 WeakPolarHBondContact CA-OG 3.39Å; T48-S51 CarbonylContact O-C 3.57Å; T48-S51 PolarHBondContact O-N 3.34Å; T48-S51 VanDerWaalsContact O-N 3.08Å; T48-S51 PolarHBondContact O-OG 3.38Å; A49-S51 PolarHBondContact O-N 3.42Å; S51-V53 PolarHBondContact O-N 3Å; S51-T54 WeakPolarHBondContact CA-OG1 3.49Å; S51-T54 PolarHBondContact O-N 3.09Å; S51-T54 PolarHBondContact O-OG1 3.3Å; S51-H55 WeakPolarHBondContact O-CB 3.23Å; S51-H55 PolarHBondContact O-N 3.3Å
52	S	98.8	Very high	98.6	Very high	9 Å²	9	68.6 Å²	68.6	6%	0.063	35%	0.345	C	S	.	.	H	α-helix	trans	-65.2	-39.1	177.3	76.5	0	0	0	0	111.5	Y42 T43 T48 A49 F50 H55 I56	Y42-S52 VanDerWaalsContact CD2-OG 3.25Å; Y42-S52 WeakPolarHBondContact CD2-OG 3.42Å; T43-S52 PolarHBondContact N-OG 3.07Å; T43-S52 WeakPolarHBondContact OG1-CB 3.23Å; T48-S52 WeakPolarHBondContact O-CB 3.31Å; T48-S52 PolarHBondContact O-N 3.17Å; A49-S52 PolarHBondContact O-N 3.04Å; A49-S52 PolarHBondContact O-OG 2.66Å; F50-S52 VanDerWaalsContact C-N 3.32Å; F50-S52 PolarHBondContact O-N 2.85Å; S52-H55 WeakPolarHBondContact O-CB 3.38Å; S52-H55 PolarHBondContact O-N 3.07Å; S52-I56 VanDerWaalsContact O-CG1 3.32Å; S52-I56 WeakPolarHBondContact O-CG1 3.25Å; S52-I56 PolarHBondContact O-N 2.94Å
53	V	98.8	Very high	98.6	Very high	22 Å²	22	67.3 Å²	67.3	13%	0.133	34%	0.34	C	S	.	.	H	α-helix	trans	-66.4	-37.9	173.4	177.3	0	0	0	0	111.3	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 2.77Å; F50-V53 PolarHBondContact O-N 3.12Å; S51-V53 PolarHBondContact O-N 3Å; V53-I56 PolarHBondContact O-N 2.79Å; V53-C57 PolarHBondContact O-N 3.36Å; V53-C57 PolarHBondContact O-SG 3.09Å
54	T	98.7	Very high	98.6	Very high	50 Å²	50	70.9 Å²	70.9	31%	0.307	35%	0.347	S	S	.	.	H	α-helix	trans	-67.1	-39.4	174.4	62.9	0	0	0	0	112.6	F50 S51 C57 R58	F50-T54 HydrophobicContact CD1-CG2 4.06Å; F50-T54 HydrophobicContact CE1-CG2 3.7Å; F50-T54 HydrophobicContact CZ-CG2 4.25Å; F50-T54 PolarHBondContact O-N 3.44Å; S51-T54 WeakPolarHBondContact CA-OG1 3.49Å; S51-T54 PolarHBondContact O-N 3.09Å; S51-T54 PolarHBondContact O-OG1 3.3Å; T54-C57 PolarHBondContact O-N 3.06Å; T54-C57 VanDerWaalsContact O-N 3.16Å; T54-R58 WeakPolarHBondContact O-CB 3.35Å; T54-R58 WeakPolarHBondContact O-CG 3.35Å; T54-R58 PolarHBondContact O-N 3.1Å
55	H	98.8	Very high	98.6	Very high	84 Å²	84	72 Å²	72	39%	0.389	35%	0.35	S	S	.	.	H	α-helix	trans	-61.3	-44.3	174.3	166.5	-91.1	0	0	0	111.1	S51 S52 C57 R58 D59 V60	S51-H55 WeakPolarHBondContact O-CB 3.23Å; S51-H55 PolarHBondContact O-N 3.3Å; S52-H55 WeakPolarHBondContact O-CB 3.38Å; S52-H55 PolarHBondContact O-N 3.07Å; H55-C57 VanDerWaalsContact C-N 3.26Å; H55-C57 PolarHBondContact O-N 3.06Å; H55-R58 PolarHBondContact O-N 3.46Å; H55-D59 IonicContact CD2-OD2 3.33Å; H55-D59 PolarHBondContact CD2-OD2 3.29Å; H55-D59 IonicContact CG-OD2 3.93Å; H55-D59 PolarHBondContact O-N 2.83Å; H55-V60 PolarHBondContact O-N 3.23Å
56	I	98.8	Very high	98.6	Very high	5 Å²	5	71.7 Å²	71.7	3%	0.026	35%	0.348	C	S	.	.	H	α-helix	trans	-53.5	-45.2	172.5	-72.6	166.3	0	0	0	111.1	L38 H41 S52 V53 G63 R67	L38-I56 HydrophobicContact CD2-CD1 4.31Å; L38-I56 HydrophobicContact CD2-CG2 3.6Å; H41-I56 HydrophobicContact CB-CD1 3.85Å; H41-I56 HydrophobicContact CB-CG1 3.51Å; S52-I56 VanDerWaalsContact O-CG1 3.32Å; S52-I56 WeakPolarHBondContact O-CG1 3.25Å; S52-I56 PolarHBondContact O-N 2.94Å; V53-I56 PolarHBondContact O-N 2.79Å; I56-G63 CarbonylContact O-C 3.55Å; I56-G63 VanDerWaalsContact O-CA 3.22Å; I56-G63 WeakPolarHBondContact O-CA 3.49Å; I56-R67 HydrophobicContact CG2-CB 4.36Å
57	C	98.8	Very high	98.7	Very high	28 Å²	28	73.7 Å²	73.7	19%	0.189	35%	0.352	C	S	.	.	H	α-helix	trans	-74.3	-27.1	-176.6	-62.6	0	0	0	0	113.4	V53 T54 H55 W64	V53-C57 PolarHBondContact O-N 3.36Å; V53-C57 PolarHBondContact O-SG 3.09Å; T54-C57 PolarHBondContact O-N 3.06Å; T54-C57 VanDerWaalsContact O-N 3.16Å; H55-C57 VanDerWaalsContact C-N 3.26Å; H55-C57 PolarHBondContact O-N 3.06Å; C57-W64 HydrophobicContact CB-CB 4.44Å; C57-W64 WeakPolarHBondContact O-CB 3.46Å
58	R	98.7	Very high	98.7	Very high	205 Å²	205	71.5 Å²	71.5	77%	0.774	34%	0.335	S	S	*	.	H	α-helix	trans	-104.5	-37.4	-169	-68.9	-179.8	175	-164.6	-1.7	113.8	T54 H55	T54-R58 WeakPolarHBondContact O-CB 3.35Å; T54-R58 WeakPolarHBondContact O-CG 3.35Å; T54-R58 PolarHBondContact O-N 3.1Å; H55-R58 PolarHBondContact O-N 3.46Å
59	D	98.6	Very high	98.7	Very high	112 Å²	112	71.2 Å²	71.2	60%	0.599	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.1	-22.1	-164.9	-51.8	-50	0	0	0	112.6	H55	H55-D59 IonicContact CD2-OD2 3.33Å; H55-D59 PolarHBondContact CD2-OD2 3.29Å; H55-D59 IonicContact CG-OD2 3.93Å; H55-D59 PolarHBondContact O-N 2.83Å
60	V	98.7	Very high	98.7	Very high	26 Å²	26	72.7 Å²	72.7	16%	0.158	34%	0.338	C	S	.	.	S	Bend	trans	-82.9	128.8	174.5	180	0	0	0	0	110	H41 H55 Y62 G63	H41-V60 HydrophobicContact CB-CG2 4.43Å; H55-V60 PolarHBondContact O-N 3.23Å; V60-Y62 PolarHBondContact O-N 3.2Å; V60-G63 PolarHBondContact O-N 3.37Å
61	N	98.6	Very high	98.7	Very high	145 Å²	145	69 Å²	69	78%	0.775	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	121.3	177.3	-68.1	-38.4	0	0	0	111.1	G63	N61-G63 PolarHBondContact O-N 3.39Å
62	Y	98.5	Very high	98.6	Very high	170 Å²	170	70.2 Å²	70.2	67%	0.667	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.6	13.6	-174	-57.2	-81.3	0	0	0	115.3	V60 W64 L65 I66	V60-Y62 PolarHBondContact O-N 3.2Å; Y62-W64 VanDerWaalsContact C-N 3.3Å; Y62-W64 PolarHBondContact O-N 3.31Å; Y62-L65 WeakPolarHBondContact O-CB 3.27Å; Y62-L65 PolarHBondContact O-N 3.33Å; Y62-L65 VanDerWaalsContact O-N 3.07Å; Y62-I66 PolarHBondContact O-N 2.84Å; Y62-I66 VanDerWaalsContact O-N 3.11Å
63	G	98.7	Very high	98.6	Very high	1 Å²	1	69.9 Å²	69.9	1%	0.01	33%	0.33	C	S	.	.	H	α-helix	trans	-65.4	-32.4	-177	0	0	0	0	0	113.1	I56 V60 N61 L65 I66 R67	I56-G63 CarbonylContact O-C 3.55Å; I56-G63 VanDerWaalsContact O-CA 3.22Å; I56-G63 WeakPolarHBondContact O-CA 3.49Å; V60-G63 PolarHBondContact O-N 3.37Å; N61-G63 PolarHBondContact O-N 3.39Å; G63-L65 VanDerWaalsContact C-N 3.34Å; G63-L65 PolarHBondContact O-N 3.28Å; G63-I66 PolarHBondContact O-N 2.86Å; G63-R67 VanDerWaalsContact O-CB 3.28Å; G63-R67 WeakPolarHBondContact O-CB 3.36Å; G63-R67 PolarHBondContact O-N 2.92Å
64	W	98.6	Very high	98.6	Very high	138 Å²	138	70.2 Å²	70.2	52%	0.523	34%	0.335	S	S	.	.	H	α-helix	trans	-58.1	-45.9	170.5	66.2	-90.6	0	0	0	111.7	C57 Y62 R67 Y68	C57-W64 HydrophobicContact CB-CB 4.44Å; C57-W64 WeakPolarHBondContact O-CB 3.46Å; Y62-W64 VanDerWaalsContact C-N 3.3Å; Y62-W64 PolarHBondContact O-N 3.31Å; W64-R67 PolarHBondContact O-N 3.37Å; W64-Y68 HydrophobicContact CB-CD2 4.46Å; W64-Y68 HydrophobicContact CE3-CD2 4.34Å; W64-Y68 WeakPolarHBondContact O-CD2 3.22Å; W64-Y68 PolarHBondContact O-N 3.18Å
65	L	98.4	Very high	98.6	Very high	53 Å²	53	71.3 Å²	71.3	28%	0.277	35%	0.345	S	S	.	.	H	α-helix	trans	-64.3	-47.6	-178.4	177.9	64.1	0	0	0	109.8	Y62 G63 R67 Y68 M69 M227	Y62-L65 WeakPolarHBondContact O-CB 3.27Å; Y62-L65 PolarHBondContact O-N 3.33Å; Y62-L65 VanDerWaalsContact O-N 3.07Å; G63-L65 VanDerWaalsContact C-N 3.34Å; G63-L65 PolarHBondContact O-N 3.28Å; L65-R67 VanDerWaalsContact C-N 3.33Å; L65-R67 PolarHBondContact O-N 2.64Å; L65-Y68 PolarHBondContact O-N 3.39Å; L65-M69 HydrophobicContact CD1-CG 4.18Å; L65-M69 HydrophobicContact CD1-SD 4.33Å; L65-M69 HydrophobicContact CG-CE 3.98Å; L65-M69 HydrophobicContact CG-CG 4.44Å; L65-M69 HydrophobicContact CG-SD 4.24Å; L65-M69 WeakPolarHBondContact O-CB 3.49Å; L65-M69 VanDerWaalsContact O-CG 3.27Å; L65-M69 WeakPolarHBondContact O-CG 3.42Å; L65-M69 PolarHBondContact O-N 2.91Å; L65-M227 HydrophobicContact CD1-CE 4.17Å
66	I	98.6	Very high	98.6	Very high	34 Å²	34	68.1 Å²	68.1	17%	0.174	33%	0.33	C	S	.	.	H	α-helix	trans	-59.1	-45.4	176.8	-61.3	168.8	0	0	0	110.7	T34 F37 L38 Y62 G63 Y68 M69 H70	T34-I66 HydrophobicContact CG2-CG2 4.21Å; F37-I66 HydrophobicContact CB-CD1 4.28Å; F37-I66 HydrophobicContact CB-CG2 4.2Å; 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 2.84Å; Y62-I66 VanDerWaalsContact O-N 3.11Å; G63-I66 PolarHBondContact O-N 2.86Å; I66-Y68 PolarHBondContact O-N 3.33Å; I66-M69 HydrophobicContact CG1-CE 4.37Å; I66-M69 PolarHBondContact O-N 3.43Å; I66-H70 WeakPolarHBondContact O-CB 3.28Å; I66-H70 PolarHBondContact O-N 3.33Å
67	R	98.7	Very high	98.6	Very high	73 Å²	73	68.7 Å²	68.7	28%	0.275	33%	0.333	S	S	.	.	H	α-helix	trans	-61.6	-46.1	179.5	-177.4	-89	179	145.2	0.5	111.9	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 3.28Å; G63-R67 WeakPolarHBondContact O-CB 3.36Å; G63-R67 PolarHBondContact O-N 2.92Å; W64-R67 PolarHBondContact O-N 3.37Å; L65-R67 VanDerWaalsContact C-N 3.33Å; L65-R67 PolarHBondContact O-N 2.64Å; R67-H70 PolarHBondContact O-N 3.35Å; R67-A71 WeakPolarHBondContact O-CB 3.37Å; R67-A71 PolarHBondContact O-N 2.95Å
68	Y	98.5	Very high	98.6	Very high	114 Å²	114	69.3 Å²	69.3	45%	0.447	33%	0.332	S	S	.	.	H	α-helix	trans	-74.2	-33.5	-179	-74.6	-65.6	0	0	0	112.5	W64 L65 I66 H70 A71 N72	W64-Y68 HydrophobicContact CB-CD2 4.46Å; W64-Y68 HydrophobicContact CE3-CD2 4.34Å; W64-Y68 WeakPolarHBondContact O-CD2 3.22Å; W64-Y68 PolarHBondContact O-N 3.18Å; L65-Y68 PolarHBondContact O-N 3.39Å; I66-Y68 PolarHBondContact O-N 3.33Å; Y68-H70 VanDerWaalsContact C-N 3.34Å; Y68-A71 PolarHBondContact O-N 3.09Å; Y68-N72 VanDerWaalsContact O-CB 3.31Å; Y68-N72 WeakPolarHBondContact O-CB 3.47Å; Y68-N72 PolarHBondContact O-N 3.37Å; Y68-N72 PolarHBondContact O-ND2 3.38Å
69	M	98.5	Very high	98.6	Very high	47 Å²	47	63.9 Å²	63.9	23%	0.232	32%	0.318	C	S	.	.	H	α-helix	trans	-61.9	-41.2	169.4	-74.8	-170.5	-55.3	0	0	111.8	T34 L65 I66 G73 M227	T34-M69 HydrophobicContact CG2-CB 4.21Å; T34-M69 HydrophobicContact CG2-CE 4.17Å; L65-M69 HydrophobicContact CD1-CG 4.18Å; L65-M69 HydrophobicContact CD1-SD 4.33Å; L65-M69 HydrophobicContact CG-CE 3.98Å; L65-M69 HydrophobicContact CG-CG 4.44Å; L65-M69 HydrophobicContact CG-SD 4.24Å; L65-M69 WeakPolarHBondContact O-CB 3.49Å; L65-M69 VanDerWaalsContact O-CG 3.27Å; L65-M69 WeakPolarHBondContact O-CG 3.42Å; L65-M69 PolarHBondContact O-N 2.91Å; I66-M69 HydrophobicContact CG1-CE 4.37Å; I66-M69 PolarHBondContact O-N 3.43Å; M69-G73 VanDerWaalsContact O-CA 3.26Å; M69-G73 WeakPolarHBondContact O-CA 3.35Å; M69-G73 PolarHBondContact O-N 2.88Å; M69-M227 HydrophobicContact CG-CE 3.92Å; M69-M227 HydrophobicContact SD-CE 3.71Å
70	H	98.8	Very high	98.6	Very high	31 Å²	31	58.7 Å²	58.7	14%	0.144	29%	0.29	C	S	.	.	H	α-helix	trans	-63.5	-50	176	-164.6	75.2	0	0	0	111	Q31 T34 G35 L38 I66 R67 Y68 G73 A74 H169	Q31-H70 PolarHBondContact NE2-O 3.43Å; Q31-H70 PolarHBondContact O-CE1 2.95Å; Q31-H70 VanDerWaalsContact O-CE1 3.27Å; Q31-H70 PolarHBondContact O-ND1 3.37Å; Q31-H70 PolarHBondContact OE1-CE1 3.47Å; Q31-H70 VanDerWaalsContact OE1-CE1 3.28Å; Q31-H70 PolarHBondContact OE1-ND1 3.19Å; Q31-H70 PolarHBondContact OE1-O 3.19Å; T34-H70 PolarHBondContact OG1-ND1 3.35Å; G35-H70 VanDerWaalsContact CA-CE1 3.45Å; G35-H70 WeakPolarHBondContact CA-CE1 3.15Å; G35-H70 PolarHBondContact N-ND1 3.08Å; L38-H70 HydrophobicContact CD1-CB 3.51Å; I66-H70 WeakPolarHBondContact O-CB 3.28Å; I66-H70 PolarHBondContact O-N 3.33Å; R67-H70 PolarHBondContact O-N 3.35Å; Y68-H70 VanDerWaalsContact C-N 3.34Å; H70-G73 PolarHBondContact O-N 3.02Å; H70-A74 PolarHBondContact O-N 3.16Å; H70-A74 VanDerWaalsContact O-N 3.08Å; H70-H169 AromaticContact NE2-NE2 3.95Å
71	A	98.5	Very high	98.6	Very high	44 Å²	44	58 Å²	58	36%	0.364	29%	0.286	S	S	.	.	H	α-helix	trans	-63.4	-52.8	-179	0	0	0	0	0	113.3	R67 Y68 G73 A74	R67-A71 WeakPolarHBondContact O-CB 3.37Å; R67-A71 PolarHBondContact O-N 2.95Å; Y68-A71 PolarHBondContact O-N 3.09Å; A71-G73 VanDerWaalsContact C-N 3.29Å; A71-G73 PolarHBondContact O-N 3.28Å; A71-A74 WeakPolarHBondContact O-CB 3.44Å; A71-A74 PolarHBondContact O-N 3.19Å
72	N	98.6	Very high	98.6	Very high	83 Å²	83	57.3 Å²	57.3	44%	0.444	28%	0.276	S	S	.	.	H	α-helix	trans	-69.1	-31.2	178.4	-69	-29.9	0	0	0	111.6	Y68 A74 S75 M76 L226	Y68-N72 VanDerWaalsContact O-CB 3.31Å; Y68-N72 WeakPolarHBondContact O-CB 3.47Å; Y68-N72 PolarHBondContact O-N 3.37Å; Y68-N72 PolarHBondContact O-ND2 3.38Å; N72-A74 VanDerWaalsContact C-N 3.27Å; N72-A74 PolarHBondContact O-N 2.89Å; N72-S75 WeakPolarHBondContact O-CB 3.26Å; N72-S75 PolarHBondContact O-N 3.42Å; N72-S75 VanDerWaalsContact O-N 3.12Å; N72-M76 PolarHBondContact O-N 3.4Å; N72-L226 HydrophobicContact CB-CD1 4.04Å
73	G	98.7	Very high	98.6	Very high	3 Å²	3	52 Å²	52	3%	0.031	26%	0.259	C	S	.	.	H	α-helix	trans	-63.9	-31.8	175.4	0	0	0	0	0	112.5	Q31 M69 H70 A71 M76 F77	Q31-G73 VanDerWaalsContact NE2-CA 3.29Å; M69-G73 VanDerWaalsContact O-CA 3.26Å; M69-G73 WeakPolarHBondContact O-CA 3.35Å; M69-G73 PolarHBondContact O-N 2.88Å; H70-G73 PolarHBondContact O-N 3.02Å; A71-G73 VanDerWaalsContact C-N 3.29Å; A71-G73 PolarHBondContact O-N 3.28Å; G73-M76 PolarHBondContact O-N 2.93Å; G73-F77 WeakPolarHBondContact O-CB 3.26Å; G73-F77 PolarHBondContact O-N 2.96Å
74	A	98.6	Very high	98.6	Very high	29 Å²	29	53.9 Å²	53.9	24%	0.24	27%	0.267	C	S	.	.	H	α-helix	trans	-63.4	-42.8	171.6	0	0	0	0	0	111.3	H70 A71 N72 F77 F78	H70-A74 PolarHBondContact O-N 3.16Å; H70-A74 VanDerWaalsContact O-N 3.08Å; A71-A74 WeakPolarHBondContact O-CB 3.44Å; A71-A74 PolarHBondContact O-N 3.19Å; N72-A74 VanDerWaalsContact C-N 3.27Å; N72-A74 PolarHBondContact O-N 2.89Å; A74-F77 VanDerWaalsContact O-CB 3.31Å; A74-F77 WeakPolarHBondContact O-CB 3.44Å; A74-F77 PolarHBondContact O-N 2.95Å; A74-F78 WeakPolarHBondContact O-CD2 3.47Å; A74-F78 PolarHBondContact O-N 3.1Å; A74-F78 VanDerWaalsContact O-N 3.17Å
75	S	98.4	Very high	98.6	Very high	72 Å²	72	49.3 Å²	49.3	50%	0.503	25%	0.254	S	S	.	.	H	α-helix	trans	-63.3	-43.8	174.1	-60.3	0	0	0	0	112.3	N72 F77 F78 I79	N72-S75 WeakPolarHBondContact O-CB 3.26Å; N72-S75 PolarHBondContact O-N 3.42Å; N72-S75 VanDerWaalsContact O-N 3.12Å; S75-F77 VanDerWaalsContact C-N 3.27Å; S75-F77 PolarHBondContact O-N 3.34Å; S75-F78 PolarHBondContact O-N 3.44Å; S75-I79 WeakPolarHBondContact O-CG1 3.45Å; S75-I79 PolarHBondContact O-N 2.83Å
76	M	98.4	Very high	98.7	Very high	18 Å²	18	48.4 Å²	48.4	9%	0.089	26%	0.258	C	S	.	.	H	α-helix	trans	-60.2	-38.4	175.1	-175.7	60.1	80.2	0	0	111.9	N72 G73 F78 I79 C80 M222 I225 L226	N72-M76 PolarHBondContact O-N 3.4Å; G73-M76 PolarHBondContact O-N 2.93Å; M76-F78 PolarHBondContact O-N 3.5Å; M76-I79 PolarHBondContact O-N 3.01Å; M76-C80 PolarHBondContact O-N 2.84Å; M76-C80 PolarHBondContact O-SG 3.43Å; M76-M222 HydrophobicContact CE-CG 4.05Å; M76-M222 HydrophobicContact CG-CG 3.81Å; M76-M222 HydrophobicContact CG-SD 4.07Å; M76-M222 HydrophobicContact SD-CG 3.84Å; M76-I225 HydrophobicContact CE-CB 3.79Å; M76-I225 HydrophobicContact CE-CG2 3.62Å; M76-L226 HydrophobicContact CB-CD1 4.07Å; M76-L226 HydrophobicContact CE-CB 4.33Å
77	F	98.6	Very high	98.7	Very high	16 Å²	16	47.9 Å²	47.9	7%	0.07	25%	0.254	C	S	.	.	H	α-helix	trans	-57.5	-49.5	174.3	-153.5	140.8	0	0	0	110.5	L24 C27 L28 Q31 G73 A74 S75 I79 C80 L81 V110	L24-F77 HydrophobicContact CD2-CD2 3.55Å; L24-F77 HydrophobicContact CD2-CE2 3.52Å; C27-F77 HydrophobicContact CB-CB 4.1Å; C27-F77 HydrophobicContact CB-CD1 3.68Å; C27-F77 HydrophobicContact CB-CD2 4.37Å; C27-F77 HydrophobicContact CB-CE1 4.18Å; C27-F77 HydrophobicContact CB-CG 3.78Å; L28-F77 HydrophobicContact CB-CE1 3.99Å; L28-F77 HydrophobicContact CB-CZ 4.17Å; L28-F77 HydrophobicContact CD1-CE1 4.2Å; L28-F77 HydrophobicContact CD1-CZ 4.49Å; Q31-F77 HydrophobicContact CG-CD1 4.06Å; G73-F77 WeakPolarHBondContact O-CB 3.26Å; G73-F77 PolarHBondContact O-N 2.96Å; A74-F77 VanDerWaalsContact O-CB 3.31Å; A74-F77 WeakPolarHBondContact O-CB 3.44Å; A74-F77 PolarHBondContact O-N 2.95Å; S75-F77 VanDerWaalsContact C-N 3.27Å; S75-F77 PolarHBondContact O-N 3.34Å; F77-I79 PolarHBondContact O-N 2.83Å; F77-C80 PolarHBondContact O-N 3.27Å; F77-L81 HydrophobicContact CD2-CD1 3.75Å; F77-L81 HydrophobicContact CD2-CG 3.87Å; F77-L81 HydrophobicContact CE2-CD1 3.97Å; F77-L81 HydrophobicContact CE2-CD2 4.42Å; F77-L81 HydrophobicContact CE2-CG 4.04Å; F77-L81 PolarHBondContact O-N 3.35Å; F77-V110 HydrophobicContact CD2-CG1 4.11Å; F77-V110 HydrophobicContact CE2-CG1 4.08Å; F77-V110 HydrophobicContact CE2-CG2 3.85Å; F77-V110 HydrophobicContact CG-CG1 4.43Å; F77-V110 HydrophobicContact CZ-CG1 4.36Å; F77-V110 HydrophobicContact CZ-CG2 3.81Å
78	F	98.7	Very high	98.7	Very high	42 Å²	42	44.6 Å²	44.6	18%	0.184	24%	0.242	C	C	.	.	H	α-helix	trans	-65.9	-38	178.4	-82.7	-78.9	0	0	0	113.6	A74 S75 M76 C80 L81 F82 V110 M111 A114	A74-F78 WeakPolarHBondContact O-CD2 3.47Å; A74-F78 PolarHBondContact O-N 3.1Å; A74-F78 VanDerWaalsContact O-N 3.17Å; S75-F78 PolarHBondContact O-N 3.44Å; M76-F78 PolarHBondContact O-N 3.5Å; F78-C80 VanDerWaalsContact C-N 3.33Å; F78-C80 PolarHBondContact O-N 2.86Å; F78-L81 HydrophobicContact CD1-CD1 4.2Å; F78-L81 HydrophobicContact CE1-CD1 4.29Å; F78-L81 PolarHBondContact O-N 3.12Å; F78-F82 HydrophobicContact CB-CD2 4.46Å; F78-F82 HydrophobicContact CB-CE2 4Å; F78-F82 HydrophobicContact CB-CZ 4.46Å; F78-F82 HydrophobicContact CD1-CE1 4.34Å; F78-F82 HydrophobicContact CD1-CE2 4.17Å; F78-F82 AromaticContact CD1-CZ 3.78Å; F78-F82 HydrophobicContact CD1-CZ 3.78Å; F78-F82 WeakPolarHBondContact O-CD2 3.43Å; F78-F82 VanDerWaalsContact O-CG 3.28Å; F78-F82 WeakPolarHBondContact O-CG 3.32Å; F78-F82 PolarHBondContact O-N 3.22Å; F78-V110 HydrophobicContact CE2-CG1 4.24Å; F78-V110 HydrophobicContact CZ-CG1 3.99Å; F78-M111 HydrophobicContact CE1-CG 3.8Å; F78-M111 HydrophobicContact CZ-CG 4.14Å; F78-A114 HydrophobicContact CE2-CB 3.54Å; F78-A114 HydrophobicContact CZ-CB 3.95Å
79	I	98.6	Very high	98.7	Very high	91 Å²	91	43.9 Å²	43.9	47%	0.467	25%	0.246	S	C	.	.	H	α-helix	trans	-57.5	-50.2	172.9	-68.1	167	0	0	0	109.7	S75 M76 F77 L81 F82 L83	S75-I79 WeakPolarHBondContact O-CG1 3.45Å; S75-I79 PolarHBondContact O-N 2.83Å; M76-I79 PolarHBondContact O-N 3.01Å; F77-I79 PolarHBondContact O-N 2.83Å; I79-L81 VanDerWaalsContact C-N 3.33Å; I79-L81 PolarHBondContact O-N 3.39Å; I79-F82 PolarHBondContact O-N 2.95Å; I79-L83 HydrophobicContact CG2-CD1 3.73Å; I79-L83 VanDerWaalsContact O-CG 3.25Å; I79-L83 WeakPolarHBondContact O-CG 3.12Å; I79-L83 PolarHBondContact O-N 3.05Å
80	C	98.8	Very high	98.7	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.014	27%	0.27	C	S	.	.	H	α-helix	trans	-61.9	-40.1	177.4	-67.1	0	0	0	0	112.1	F20 L24 M76 F77 F78 L83 H84	F20-C80 HydrophobicContact CD1-CB 4.16Å; L24-C80 HydrophobicContact CD2-CB 3.64Å; L24-C80 HydrophobicContact CG-CB 3.98Å; M76-C80 PolarHBondContact O-N 2.84Å; M76-C80 PolarHBondContact O-SG 3.43Å; F77-C80 PolarHBondContact O-N 3.27Å; F78-C80 VanDerWaalsContact C-N 3.33Å; F78-C80 PolarHBondContact O-N 2.86Å; C80-L83 PolarHBondContact O-N 3.28Å; C80-H84 WeakPolarHBondContact O-CB 3.18Å; C80-H84 PolarHBondContact O-N 3.42Å
81	L	98.8	Very high	98.7	Very high	13 Å²	13	51.3 Å²	51.3	7%	0.068	27%	0.272	C	S	.	.	H	α-helix	trans	-61.6	-50.1	178.5	-86.5	169.9	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 4.32Å; L24-L81 HydrophobicContact CD2-CD2 3.86Å; L24-L81 HydrophobicContact CD2-CG 3.61Å; F77-L81 HydrophobicContact CD2-CD1 3.75Å; F77-L81 HydrophobicContact CD2-CG 3.87Å; F77-L81 HydrophobicContact CE2-CD1 3.97Å; F77-L81 HydrophobicContact CE2-CD2 4.42Å; F77-L81 HydrophobicContact CE2-CG 4.04Å; F77-L81 PolarHBondContact O-N 3.35Å; F78-L81 HydrophobicContact CD1-CD1 4.2Å; F78-L81 HydrophobicContact CE1-CD1 4.29Å; F78-L81 PolarHBondContact O-N 3.12Å; I79-L81 VanDerWaalsContact C-N 3.33Å; I79-L81 PolarHBondContact O-N 3.39Å; L81-L83 VanDerWaalsContact C-N 3.35Å; L81-L83 PolarHBondContact O-N 3.08Å; L81-H84 PolarHBondContact O-N 2.94Å; L81-V85 WeakPolarHBondContact O-CB 3.38Å; L81-V85 VanDerWaalsContact O-CG2 3.31Å; L81-V85 WeakPolarHBondContact O-CG2 3.1Å; L81-V85 PolarHBondContact O-N 3.38Å; L81-L107 HydrophobicContact CD1-CD1 4.2Å; L81-V110 HydrophobicContact CD1-CB 3.99Å; L81-V110 HydrophobicContact CD1-CG1 3.66Å; L81-V110 HydrophobicContact CD1-CG2 4.37Å
82	F	98.8	Very high	98.7	Very high	129 Å²	129	50.2 Å²	50.2	57%	0.566	27%	0.265	S	S	*	.	H	α-helix	trans	-65.4	-39	-178.3	-62.3	-39.3	0	0	0	112	F78 I79 G86	F78-F82 HydrophobicContact CB-CD2 4.46Å; F78-F82 HydrophobicContact CB-CE2 4Å; F78-F82 HydrophobicContact CB-CZ 4.46Å; F78-F82 HydrophobicContact CD1-CE1 4.34Å; F78-F82 HydrophobicContact CD1-CE2 4.17Å; F78-F82 AromaticContact CD1-CZ 3.78Å; F78-F82 HydrophobicContact CD1-CZ 3.78Å; F78-F82 WeakPolarHBondContact O-CD2 3.43Å; F78-F82 VanDerWaalsContact O-CG 3.28Å; F78-F82 WeakPolarHBondContact O-CG 3.32Å; F78-F82 PolarHBondContact O-N 3.22Å; I79-F82 PolarHBondContact O-N 2.95Å; F82-G86 PolarHBondContact O-N 3.33Å
83	L	98.8	Very high	98.7	Very high	60 Å²	60	47.1 Å²	47.1	31%	0.314	25%	0.249	S	C	.	.	H	α-helix	trans	-67.8	-37.8	175.1	-63.9	168.2	0	0	0	111.5	W17 F20 I79 C80 L81 G86 R87	W17-L83 HydrophobicContact CH2-CD2 4.26Å; W17-L83 HydrophobicContact CZ3-CB 4.29Å; W17-L83 HydrophobicContact CZ3-CD2 3.74Å; F20-L83 HydrophobicContact CD1-CB 4.02Å; F20-L83 HydrophobicContact CD1-CD1 4.26Å; F20-L83 HydrophobicContact CD2-CB 3.85Å; F20-L83 HydrophobicContact CE1-CB 3.92Å; F20-L83 HydrophobicContact CE1-CD1 3.42Å; F20-L83 VanDerWaalsContact CE1-CD1 3.42Å; F20-L83 HydrophobicContact CE1-CG 4.3Å; F20-L83 HydrophobicContact CE2-CB 3.75Å; F20-L83 HydrophobicContact CE2-CD1 4.14Å; F20-L83 HydrophobicContact CE2-CG 4.47Å; F20-L83 HydrophobicContact CG-CB 4.01Å; F20-L83 HydrophobicContact CZ-CB 3.8Å; F20-L83 HydrophobicContact CZ-CD1 3.36Å; F20-L83 HydrophobicContact CZ-CG 4.14Å; I79-L83 HydrophobicContact CG2-CD1 3.73Å; I79-L83 VanDerWaalsContact O-CG 3.25Å; I79-L83 WeakPolarHBondContact O-CG 3.12Å; I79-L83 PolarHBondContact O-N 3.05Å; C80-L83 PolarHBondContact O-N 3.28Å; L81-L83 VanDerWaalsContact C-N 3.35Å; L81-L83 PolarHBondContact O-N 3.08Å; L83-G86 PolarHBondContact O-N 2.94Å; L83-R87 WeakPolarHBondContact O-CB 3.43Å; L83-R87 PolarHBondContact O-N 3.46Å
84	H	98.8	Very high	98.6	Very high	39 Å²	39	52.1 Å²	52.1	18%	0.181	27%	0.268	C	S	.	.	H	α-helix	trans	-64.9	-45.8	175.7	-170.2	96.9	0	0	0	112.3	F20 G21 L24 C80 L81 R87 G88	F20-H84 HydrophobicContact CB-CB 3.91Å; G21-H84 PolarHBondContact N-ND1 2.88Å; L24-H84 HydrophobicContact CD1-CB 3.78Å; C80-H84 WeakPolarHBondContact O-CB 3.18Å; C80-H84 PolarHBondContact O-N 3.42Å; L81-H84 PolarHBondContact O-N 2.94Å; H84-R87 PolarHBondContact CE1-NH2 3.01Å; H84-R87 PolarHBondContact ND1-NH2 3.28Å; H84-G88 PolarHBondContact O-N 2.98Å; H84-G88 VanDerWaalsContact O-N 3.08Å
85	V	98.9	Very high	98.6	Very high	43 Å²	43	54.9 Å²	54.9	26%	0.261	28%	0.282	S	S	.	.	H	α-helix	trans	-64.4	-45.6	175.3	172	0	0	0	0	110.3	L81 R87 G88 L89 W100	L81-V85 WeakPolarHBondContact O-CB 3.38Å; L81-V85 VanDerWaalsContact O-CG2 3.31Å; L81-V85 WeakPolarHBondContact O-CG2 3.1Å; L81-V85 PolarHBondContact O-N 3.38Å; V85-R87 VanDerWaalsContact C-N 3.35Å; V85-R87 PolarHBondContact O-N 3.27Å; V85-G88 WeakPolarHBondContact O-CA 3.28Å; V85-G88 PolarHBondContact O-N 3.42Å; V85-L89 HydrophobicContact CG1-CD1 4.24Å; V85-L89 HydrophobicContact CG1-CG 4.46Å; V85-L89 WeakPolarHBondContact O-CG 3.41Å; V85-L89 PolarHBondContact O-N 3.49Å; V85-W100 HydrophobicContact CG1-CH2 4.24Å
86	G	98.8	Very high	98.6	Very high	34 Å²	34	53.7 Å²	53.7	35%	0.351	27%	0.268	S	S	.	.	H	α-helix	trans	-58.3	-43.9	177.8	0	0	0	0	0	112.6	F82 L83 G88 L89 Y90	F82-G86 PolarHBondContact O-N 3.33Å; L83-G86 PolarHBondContact O-N 2.94Å; G86-G88 VanDerWaalsContact C-N 3.32Å; G86-G88 PolarHBondContact O-N 3.24Å; G86-L89 PolarHBondContact O-N 3.38Å; G86-Y90 WeakPolarHBondContact O-CB 3.38Å; G86-Y90 PolarHBondContact O-N 2.83Å
87	R	98.8	Very high	98.6	Very high	23 Å²	23	58 Å²	58	9%	0.087	29%	0.289	C	S	.	.	H	α-helix	trans	-56	-47.9	170.1	177.2	-77.5	-65.3	-98.4	-5.6	110.9	W17 W18 L83 H84 V85 L89 Y90 Y91	W17-R87 HydrophobicContact CB-CB 4.13Å; W17-R87 HydrophobicContact CB-CG 3.61Å; W18-R87 HydrophobicContact CE3-CG 4.19Å; W18-R87 HydrophobicContact CH2-CG 4.44Å; W18-R87 HydrophobicContact CZ3-CG 4.03Å; W18-R87 VanDerWaalsContact NE1-NH1 3.19Å; L83-R87 WeakPolarHBondContact O-CB 3.43Å; L83-R87 PolarHBondContact O-N 3.46Å; H84-R87 PolarHBondContact CE1-NH2 3.01Å; H84-R87 PolarHBondContact ND1-NH2 3.28Å; V85-R87 VanDerWaalsContact C-N 3.35Å; V85-R87 PolarHBondContact O-N 3.27Å; R87-L89 VanDerWaalsContact C-N 3.32Å; R87-L89 PolarHBondContact O-N 3.5Å; R87-Y90 PolarHBondContact O-N 3.31Å; R87-Y91 HydrophobicContact CG-CD2 3.79Å; R87-Y91 HydrophobicContact CG-CE2 4.12Å; R87-Y91 WeakPolarHBondContact O-CD2 3.38Å; R87-Y91 PolarHBondContact O-N 3.33Å
88	G	98.7	Very high	98.6	Very high	3 Å²	3	62.4 Å²	62.4	3%	0.031	31%	0.31	C	S	.	.	H	α-helix	trans	-62.2	-38.8	-177.5	0	0	0	0	0	113.1	H84 V85 G86 G92 S93	H84-G88 PolarHBondContact O-N 2.98Å; H84-G88 VanDerWaalsContact O-N 3.08Å; V85-G88 WeakPolarHBondContact O-CA 3.28Å; V85-G88 PolarHBondContact O-N 3.42Å; G86-G88 VanDerWaalsContact C-N 3.32Å; G86-G88 PolarHBondContact O-N 3.24Å; G88-G92 PolarHBondContact O-N 3.48Å; G88-S93 PolarHBondContact O-N 3.48Å
89	L	98.7	Very high	98.6	Very high	99 Å²	99	61 Å²	61	52%	0.518	31%	0.305	S	S	.	.	H	α-helix	trans	-66.3	-51.1	172.9	-66.6	173.7	0	0	0	111.6	V85 G86 R87 Y91 G92 Y94 W100	V85-L89 HydrophobicContact CG1-CD1 4.24Å; V85-L89 HydrophobicContact CG1-CG 4.46Å; V85-L89 WeakPolarHBondContact O-CG 3.41Å; V85-L89 PolarHBondContact O-N 3.49Å; G86-L89 PolarHBondContact O-N 3.38Å; R87-L89 VanDerWaalsContact C-N 3.32Å; R87-L89 PolarHBondContact O-N 3.5Å; L89-Y91 PolarHBondContact O-N 3.41Å; L89-G92 PolarHBondContact O-N 2.92Å; L89-Y94 HydrophobicContact CD2-CD1 4.35Å; L89-W100 HydrophobicContact CD2-CH2 3.76Å; L89-W100 HydrophobicContact CD2-CZ2 3.89Å; L89-W100 HydrophobicContact CG-CH2 4Å
90	Y	98.7	Very high	98.6	Very high	188 Å²	188	59.9 Å²	59.9	74%	0.737	30%	0.295	S	S	*	.	H	α-helix	trans	-62.4	-42.5	-174.1	-174.5	-91.6	0	0	0	112.8	G86 R87	G86-Y90 WeakPolarHBondContact O-CB 3.38Å; G86-Y90 PolarHBondContact O-N 2.83Å; R87-Y90 PolarHBondContact O-N 3.31Å
91	Y	98.6	Very high	98.6	Very high	47 Å²	47	64.2 Å²	64.2	18%	0.184	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	11.2	-178.6	-63.9	-71.5	0	0	0	113.8	W17 W18 R87 L89 S93 N193 P195	W17-Y91 HydrophobicContact CB-CE2 4.43Å; W17-Y91 HydrophobicContact CG-CE2 4.44Å; W18-Y91 HydrophobicContact CH2-CD1 4.24Å; W18-Y91 AromaticContact CH2-CD2 3.52Å; W18-Y91 HydrophobicContact CH2-CD2 3.52Å; W18-Y91 AromaticContact CH2-CE2 4Å; W18-Y91 HydrophobicContact CH2-CE2 4Å; W18-Y91 AromaticContact CH2-CG 3.64Å; W18-Y91 HydrophobicContact CH2-CG 3.64Å; W18-Y91 AromaticContact CZ3-CD2 3.57Å; W18-Y91 HydrophobicContact CZ3-CD2 3.57Å; W18-Y91 AromaticContact CZ3-CE2 3.57Å; W18-Y91 HydrophobicContact CZ3-CE2 3.57Å; W18-Y91 HydrophobicContact CZ3-CG 4.11Å; R87-Y91 HydrophobicContact CG-CD2 3.79Å; R87-Y91 HydrophobicContact CG-CE2 4.12Å; R87-Y91 WeakPolarHBondContact O-CD2 3.38Å; R87-Y91 PolarHBondContact O-N 3.33Å; L89-Y91 PolarHBondContact O-N 3.41Å; Y91-S93 PolarHBondContact O-N 3.06Å; Y91-N193 PolarHBondContact O-ND2 3.5Å; Y91-P195 HydrophobicContact CD1-CB 4.3Å; Y91-P195 HydrophobicContact CE1-CB 3.71Å; Y91-P195 HydrophobicContact CE1-CG 4.44Å
92	G	98.4	Very high	98.6	Very high	21 Å²	21	64.8 Å²	64.8	22%	0.216	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.4	27	178.5	0	0	0	0	0	114.3	G88 L89 Y94 T95	G88-G92 PolarHBondContact O-N 3.48Å; L89-G92 PolarHBondContact O-N 2.92Å; G92-Y94 PolarHBondContact O-N 2.92Å; G92-T95 WeakPolarHBondContact O-CG2 3.42Å; G92-T95 PolarHBondContact O-N 3.48Å; G92-T95 PolarHBondContact O-OG1 3.46Å
93	S	98.4	Very high	98.6	Very high	18 Å²	18	59.7 Å²	59.7	13%	0.126	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-73.4	-10.4	-178.9	-50.6	0	0	0	0	112.8	G88 Y91 T95 F96 N193	G88-S93 PolarHBondContact O-N 3.48Å; Y91-S93 PolarHBondContact O-N 3.06Å; S93-T95 PolarHBondContact O-N 2.82Å; S93-F96 PolarHBondContact O-N 2.86Å; S93-N193 PolarHBondContact OG-ND2 3.23Å
94	Y	98.4	Very high	98.6	Very high	108 Å²	108	59.2 Å²	59.2	42%	0.424	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-65.5	-11.3	173.2	59.3	-102.1	0	0	0	113.5	L89 G92 F96	L89-Y94 HydrophobicContact CD2-CD1 4.35Å; G92-Y94 PolarHBondContact O-N 2.92Å; Y94-F96 PolarHBondContact O-N 3.08Å
95	T	98.2	Very high	98.6	Very high	86 Å²	86	61.8 Å²	61.8	53%	0.528	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-67.7	-19.9	173.8	56.7	0	0	0	0	112.8	G92 S93 M97	G92-T95 WeakPolarHBondContact O-CG2 3.42Å; G92-T95 PolarHBondContact O-N 3.48Å; G92-T95 PolarHBondContact O-OG1 3.46Å; S93-T95 PolarHBondContact O-N 2.82Å; T95-M97 PolarHBondContact O-N 2.99Å
96	F	98.3	Very high	98.6	Very high	48 Å²	48	60.8 Å²	60.8	21%	0.211	31%	0.312	C	S	.	.	S	Bend	trans	-77.7	77.4	166	-56.5	-32.5	0	0	0	109.2	S93 Y94 E98 T99 W100 T190 N193	S93-F96 PolarHBondContact O-N 2.86Å; Y94-F96 PolarHBondContact O-N 3.08Å; F96-E98 VanDerWaalsContact C-N 3.35Å; F96-E98 PolarHBondContact O-N 3.43Å; F96-T99 PolarHBondContact O-N 3.17Å; F96-W100 VanDerWaalsContact O-CB 3.3Å; F96-W100 WeakPolarHBondContact O-CB 3.43Å; F96-W100 PolarHBondContact O-N 2.82Å; F96-T190 HydrophobicContact CD1-CG2 4.21Å; F96-T190 HydrophobicContact CE1-CG2 4.43Å; F96-N193 HydrophobicContact CE2-CB 3.71Å; F96-N193 HydrophobicContact CZ-CB 4.05Å
97	M	98.4	Very high	98.6	Very high	109 Å²	109	60.9 Å²	60.9	54%	0.537	30%	0.304	S	S	.	.	H	α-helix	trans	-58.1	-42	-163.8	-66.2	-63.6	-112.8	0	0	113.4	T95 N101	T95-M97 PolarHBondContact O-N 2.99Å; M97-N101 VanDerWaalsContact O-CB 3.25Å; M97-N101 WeakPolarHBondContact O-CB 3.2Å; M97-N101 PolarHBondContact O-N 3.23Å; M97-N101 PolarHBondContact O-ND2 3.45Å
98	E	98.5	Very high	98.6	Very high	107 Å²	107	65.7 Å²	65.7	50%	0.5	33%	0.325	S	S	.	.	H	α-helix	trans	-65.1	-53.5	179.4	-61.4	76.5	-172.5	0	0	110.1	F96 W100 N101 I102 F186	F96-E98 VanDerWaalsContact C-N 3.35Å; F96-E98 PolarHBondContact O-N 3.43Å; E98-W100 VanDerWaalsContact C-N 3.32Å; E98-W100 PolarHBondContact O-N 3.02Å; E98-N101 PolarHBondContact O-N 3.33Å; E98-I102 WeakPolarHBondContact O-CG1 3.49Å; E98-I102 PolarHBondContact O-N 3.41Å; E98-F186 HydrophobicContact CB-CB 4.11Å; E98-F186 HydrophobicContact CB-CD1 3.56Å; E98-F186 HydrophobicContact CB-CD2 4.04Å; E98-F186 HydrophobicContact CB-CE1 3.89Å; E98-F186 HydrophobicContact CB-CE2 4.33Å; E98-F186 HydrophobicContact CB-CG 3.65Å; E98-F186 HydrophobicContact CB-CZ 4.26Å; E98-F186 HydrophobicContact CG-CD1 4Å; E98-F186 HydrophobicContact CG-CE1 3.95Å; E98-F186 HydrophobicContact CG-CZ 4.45Å
99	T	98.8	Very high	98.6	Very high	13 Å²	13	66.2 Å²	66.2	8%	0.08	33%	0.33	C	S	.	.	H	α-helix	trans	-55.8	-47.4	175.8	-57	0	0	0	0	110.9	F96 I102 G103 H183 F186 L187	F96-T99 PolarHBondContact O-N 3.17Å; T99-I102 PolarHBondContact O-N 3.37Å; T99-G103 PolarHBondContact O-N 3.2Å; T99-H183 WeakPolarHBondContact CG2-CE1 3.16Å; T99-H183 PolarHBondContact O-CE1 3.1Å; T99-H183 PolarHBondContact O-ND1 2.93Å; T99-F186 VanDerWaalsContact OG1-C 3.29Å; T99-F186 WeakPolarHBondContact OG1-CB 3.36Å; T99-L187 HydrophobicContact CG2-CB 4.09Å; T99-L187 HydrophobicContact CG2-CD1 4.4Å; T99-L187 PolarHBondContact OG1-N 2.93Å
100	W	98.8	Very high	98.6	Very high	68 Å²	68	62 Å²	62	26%	0.258	31%	0.308	S	S	.	.	H	α-helix	trans	-63	-48	-179.5	-177.1	-101	0	0	0	112.6	V85 L89 F96 E98 I102 G103 V104	V85-W100 HydrophobicContact CG1-CH2 4.24Å; L89-W100 HydrophobicContact CD2-CH2 3.76Å; L89-W100 HydrophobicContact CD2-CZ2 3.89Å; L89-W100 HydrophobicContact CG-CH2 4Å; F96-W100 VanDerWaalsContact O-CB 3.3Å; F96-W100 WeakPolarHBondContact O-CB 3.43Å; F96-W100 PolarHBondContact O-N 2.82Å; E98-W100 VanDerWaalsContact C-N 3.32Å; E98-W100 PolarHBondContact O-N 3.02Å; W100-I102 PolarHBondContact O-N 2.93Å; W100-G103 CarbonylContact O-C 3.51Å; W100-G103 VanDerWaalsContact O-CA 3.29Å; W100-G103 WeakPolarHBondContact O-CA 3.43Å; W100-G103 PolarHBondContact O-N 3.05Å; W100-V104 PolarHBondContact O-N 3.28Å
101	N	98.8	Very high	98.6	Very high	92 Å²	92	57.2 Å²	57.2	49%	0.492	29%	0.294	S	S	.	.	H	α-helix	trans	-65.8	-38.6	-179.5	-73.3	-36.3	0	0	0	111.9	M97 E98 G103 V104 L105	M97-N101 VanDerWaalsContact O-CB 3.25Å; M97-N101 WeakPolarHBondContact O-CB 3.2Å; M97-N101 PolarHBondContact O-N 3.23Å; M97-N101 PolarHBondContact O-ND2 3.45Å; E98-N101 PolarHBondContact O-N 3.33Å; N101-G103 VanDerWaalsContact C-N 3.27Å; N101-G103 PolarHBondContact O-N 3.48Å; N101-V104 PolarHBondContact O-N 3.23Å; N101-L105 PolarHBondContact O-N 3.31Å
102	I	98.8	Very high	98.6	Very high	26 Å²	26	56.9 Å²	56.9	13%	0.133	30%	0.301	C	S	.	.	H	α-helix	trans	-63.3	-37.1	170	-61.4	-62.9	0	0	0	110.6	E98 T99 W100 V104 L105 L106 V182 H183 F186	E98-I102 WeakPolarHBondContact O-CG1 3.49Å; E98-I102 PolarHBondContact O-N 3.41Å; T99-I102 PolarHBondContact O-N 3.37Å; W100-I102 PolarHBondContact O-N 2.93Å; I102-V104 VanDerWaalsContact C-N 3.32Å; I102-V104 PolarHBondContact O-N 3.28Å; I102-L105 HydrophobicContact CD1-CD1 4.25Å; I102-L105 PolarHBondContact O-N 3.42Å; I102-L106 HydrophobicContact CG2-CD1 4.25Å; I102-L106 HydrophobicContact CG2-CG 4.5Å; I102-L106 WeakPolarHBondContact O-CG 3.46Å; I102-L106 PolarHBondContact O-N 3.36Å; I102-V182 HydrophobicContact CD1-CG1 4.21Å; I102-V182 HydrophobicContact CG1-CG1 4.3Å; I102-H183 HydrophobicContact CB-CB 4.42Å; I102-H183 HydrophobicContact CG2-CB 3.66Å; I102-F186 HydrophobicContact CG1-CD2 4.2Å; I102-F186 HydrophobicContact CG1-CE2 4.37Å
103	G	98.8	Very high	98.7	Very high	22 Å²	22	56.5 Å²	56.5	23%	0.227	29%	0.294	C	S	.	.	H	α-helix	trans	-59.2	-39.3	172.8	0	0	0	0	0	113.3	T99 W100 N101 L106 L107	T99-G103 PolarHBondContact O-N 3.2Å; W100-G103 CarbonylContact O-C 3.51Å; W100-G103 VanDerWaalsContact O-CA 3.29Å; W100-G103 WeakPolarHBondContact O-CA 3.43Å; W100-G103 PolarHBondContact O-N 3.05Å; N101-G103 VanDerWaalsContact C-N 3.27Å; N101-G103 PolarHBondContact O-N 3.48Å; G103-L106 WeakPolarHBondContact O-CB 3.32Å; G103-L106 PolarHBondContact O-N 3.28Å; G103-L107 PolarHBondContact O-N 3.45Å
104	V	98.8	Very high	98.7	Very high	49 Å²	49	57 Å²	57	30%	0.297	30%	0.3	S	S	.	.	H	α-helix	trans	-65.8	-42.6	173.8	174.5	0	0	0	0	111.3	W100 N101 I102 L106 L107 F108	W100-V104 PolarHBondContact O-N 3.28Å; N101-V104 PolarHBondContact O-N 3.23Å; I102-V104 VanDerWaalsContact C-N 3.32Å; I102-V104 PolarHBondContact O-N 3.28Å; V104-L106 VanDerWaalsContact C-N 3.35Å; V104-L106 PolarHBondContact O-N 3.49Å; V104-L107 WeakPolarHBondContact O-CB 3.27Å; V104-L107 PolarHBondContact O-N 3.32Å; V104-F108 HydrophobicContact CG1-CD2 3.82Å; V104-F108 HydrophobicContact CG1-CE2 3.49Å; V104-F108 VanDerWaalsContact CG1-CE2 3.49Å; V104-F108 VanDerWaalsContact O-CD2 3.26Å; V104-F108 WeakPolarHBondContact O-CD2 3.48Å; V104-F108 PolarHBondContact O-N 3.34Å; V104-F108 VanDerWaalsContact O-N 3.1Å
105	L	98.8	Very high	98.7	Very high	94 Å²	94	54.1 Å²	54.1	49%	0.492	29%	0.289	S	S	.	.	H	α-helix	trans	-62.2	-41.9	174.4	-66.3	-179.9	0	0	0	112	N101 I102 L107 F108 A109	N101-L105 PolarHBondContact O-N 3.31Å; I102-L105 HydrophobicContact CD1-CD1 4.25Å; I102-L105 PolarHBondContact O-N 3.42Å; L105-L107 PolarHBondContact O-N 3.09Å; L105-F108 PolarHBondContact O-N 2.97Å; L105-A109 WeakPolarHBondContact O-CB 3.45Å; L105-A109 PolarHBondContact O-N 2.92Å
106	L	98.9	Very high	98.7	Very high	22 Å²	22	51 Å²	51	12%	0.115	27%	0.269	C	S	.	.	H	α-helix	trans	-59.4	-44.6	174.2	-79.7	166.9	0	0	0	111.7	I102 G103 V104 F108 A109 V110 I176 L179 A180 H183	I102-L106 HydrophobicContact CG2-CD1 4.25Å; I102-L106 HydrophobicContact CG2-CG 4.5Å; I102-L106 WeakPolarHBondContact O-CG 3.46Å; I102-L106 PolarHBondContact O-N 3.36Å; G103-L106 WeakPolarHBondContact O-CB 3.32Å; G103-L106 PolarHBondContact O-N 3.28Å; V104-L106 VanDerWaalsContact C-N 3.35Å; V104-L106 PolarHBondContact O-N 3.49Å; L106-F108 PolarHBondContact O-N 3.49Å; L106-A109 PolarHBondContact O-N 2.92Å; L106-V110 WeakPolarHBondContact O-CG2 3.39Å; L106-V110 PolarHBondContact O-N 3.31Å; L106-I176 HydrophobicContact CD2-CG2 3.84Å; L106-L179 HydrophobicContact CD2-CB 3.56Å; L106-L179 HydrophobicContact CG-CB 4.07Å; L106-A180 HydrophobicContact CD2-CB 4.4Å; L106-H183 HydrophobicContact CD1-CB 3.82Å
107	L	98.8	Very high	98.7	Very high	36 Å²	36	49.5 Å²	49.5	19%	0.188	27%	0.267	C	S	.	.	H	α-helix	trans	-57.2	-51.4	176.7	175.8	62.4	0	0	0	111.1	L81 G103 V104 L105 A109 V110 M111	L81-L107 HydrophobicContact CD1-CD1 4.2Å; G103-L107 PolarHBondContact O-N 3.45Å; V104-L107 WeakPolarHBondContact O-CB 3.27Å; V104-L107 PolarHBondContact O-N 3.32Å; L105-L107 PolarHBondContact O-N 3.09Å; L107-A109 VanDerWaalsContact C-N 3.35Å; L107-A109 PolarHBondContact O-N 2.86Å; L107-V110 PolarHBondContact O-N 2.94Å; L107-M111 HydrophobicContact CD1-CG 4.41Å; L107-M111 HydrophobicContact CD1-SD 4.24Å; L107-M111 HydrophobicContact CG-SD 4.08Å; L107-M111 VanDerWaalsContact O-CG 3.27Å; L107-M111 WeakPolarHBondContact O-CG 3.31Å; L107-M111 PolarHBondContact O-N 3.37Å
108	F	98.8	Very high	98.7	Very high	123 Å²	123	50.8 Å²	50.8	54%	0.539	27%	0.267	S	S	.	.	H	α-helix	trans	-65	-37.4	179	-72.5	-56.7	0	0	0	112.8	V104 L105 L106 M111 A112	V104-F108 HydrophobicContact CG1-CD2 3.82Å; V104-F108 HydrophobicContact CG1-CE2 3.49Å; V104-F108 VanDerWaalsContact CG1-CE2 3.49Å; V104-F108 VanDerWaalsContact O-CD2 3.26Å; V104-F108 WeakPolarHBondContact O-CD2 3.48Å; V104-F108 PolarHBondContact O-N 3.34Å; V104-F108 VanDerWaalsContact O-N 3.1Å; L105-F108 PolarHBondContact O-N 2.97Å; L106-F108 PolarHBondContact O-N 3.49Å; F108-M111 HydrophobicContact CD1-SD 4.14Å; F108-M111 PolarHBondContact O-N 3.5Å; F108-A112 WeakPolarHBondContact O-CB 3.43Å; F108-A112 PolarHBondContact O-N 3.13Å
109	A	98.8	Very high	98.8	Very high	15 Å²	15	45.7 Å²	45.7	12%	0.124	24%	0.243	C	C	.	.	H	α-helix	trans	-64.1	-42.9	176.2	0	0	0	0	0	111.9	L105 L106 L107 A112 T113 I176	L105-A109 WeakPolarHBondContact O-CB 3.45Å; L105-A109 PolarHBondContact O-N 2.92Å; L106-A109 PolarHBondContact O-N 2.92Å; L107-A109 VanDerWaalsContact C-N 3.35Å; L107-A109 PolarHBondContact O-N 2.86Å; A109-A112 PolarHBondContact O-N 3.5Å; A109-T113 WeakPolarHBondContact O-CB 3.39Å; A109-T113 PolarHBondContact O-N 2.83Å; A109-T113 PolarHBondContact O-OG1 3.01Å; A109-I176 HydrophobicContact CB-CD1 4.17Å; A109-I176 HydrophobicContact CB-CG1 3.7Å
110	V	98.9	Very high	98.8	Very high	10 Å²	10	45.9 Å²	45.9	6%	0.061	24%	0.244	C	C	.	.	H	α-helix	trans	-66.5	-40.5	175.6	176	0	0	0	0	111	F77 F78 L81 L106 L107 T113 A114 I176	F77-V110 HydrophobicContact CD2-CG1 4.11Å; F77-V110 HydrophobicContact CE2-CG1 4.08Å; F77-V110 HydrophobicContact CE2-CG2 3.85Å; F77-V110 HydrophobicContact CG-CG1 4.43Å; F77-V110 HydrophobicContact CZ-CG1 4.36Å; F77-V110 HydrophobicContact CZ-CG2 3.81Å; F78-V110 HydrophobicContact CE2-CG1 4.24Å; F78-V110 HydrophobicContact CZ-CG1 3.99Å; L81-V110 HydrophobicContact CD1-CB 3.99Å; L81-V110 HydrophobicContact CD1-CG1 3.66Å; L81-V110 HydrophobicContact CD1-CG2 4.37Å; L106-V110 WeakPolarHBondContact O-CG2 3.39Å; L106-V110 PolarHBondContact O-N 3.31Å; L107-V110 PolarHBondContact O-N 2.94Å; V110-T113 PolarHBondContact O-N 3.27Å; V110-A114 WeakPolarHBondContact O-CB 3.49Å; V110-A114 PolarHBondContact O-N 2.91Å; V110-I176 HydrophobicContact CG2-CD1 3.87Å; V110-I176 HydrophobicContact CG2-CG1 4.45Å; V110-I176 HydrophobicContact CG2-CG2 4.15Å
111	M	98.7	Very high	98.7	Very high	88 Å²	88	44.5 Å²	44.5	43%	0.433	24%	0.244	S	C	.	.	H	α-helix	trans	-57.1	-50.5	173.4	-72.6	173.7	70.6	0	0	112.4	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 4.41Å; L107-M111 HydrophobicContact CD1-SD 4.24Å; L107-M111 HydrophobicContact CG-SD 4.08Å; L107-M111 VanDerWaalsContact O-CG 3.27Å; L107-M111 WeakPolarHBondContact O-CG 3.31Å; L107-M111 PolarHBondContact O-N 3.37Å; F108-M111 HydrophobicContact CD1-SD 4.14Å; F108-M111 PolarHBondContact O-N 3.5Å; M111-T113 VanDerWaalsContact C-N 3.35Å; M111-T113 PolarHBondContact O-N 3.23Å; M111-A114 PolarHBondContact O-N 3.26Å; M111-F115 WeakPolarHBondContact O-CB 3.34Å; M111-F115 PolarHBondContact O-N 3.3Å
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	-60.4	-46	177.3	0	0	0	0	0	111.3	F108 A109 F115 M116	F108-A112 WeakPolarHBondContact O-CB 3.43Å; F108-A112 PolarHBondContact O-N 3.13Å; A109-A112 PolarHBondContact O-N 3.5Å; A112-F115 PolarHBondContact O-N 3.48Å; A112-M116 VanDerWaalsContact C-CE 3.48Å; A112-M116 HydrophobicContact CB-CE 3.96Å; A112-M116 WeakPolarHBondContact O-CE 3.38Å; A112-M116 PolarHBondContact O-N 3.47Å
113	T	98.9	Very high	98.7	Very high	12 Å²	12	41.9 Å²	41.9	7%	0.074	23%	0.231	C	C	.	.	H	α-helix	trans	-59.7	-49.8	180	-57.3	0	0	0	0	111.5	A109 V110 M111 M116 G117 H169 L172 P173 I176	A109-T113 WeakPolarHBondContact O-CB 3.39Å; A109-T113 PolarHBondContact O-N 2.83Å; A109-T113 PolarHBondContact O-OG1 3.01Å; V110-T113 PolarHBondContact O-N 3.27Å; M111-T113 VanDerWaalsContact C-N 3.35Å; M111-T113 PolarHBondContact O-N 3.23Å; T113-M116 PolarHBondContact O-N 3.39Å; T113-G117 PolarHBondContact O-N 3.07Å; T113-H169 PolarHBondContact O-CE1 2.95Å; T113-H169 PolarHBondContact O-ND1 3.45Å; T113-L172 HydrophobicContact CG2-CB 4.41Å; T113-L172 VanDerWaalsContact OG1-CB 3.26Å; T113-L172 WeakPolarHBondContact OG1-CB 3.36Å; T113-P173 HydrophobicContact CG2-CG 3.86Å; T113-I176 WeakPolarHBondContact OG1-CD1 3.3Å
114	A	98.7	Very high	98.6	Very high	30 Å²	30	47.6 Å²	47.6	25%	0.248	25%	0.252	C	S	.	.	H	α-helix	trans	-66	-40	-179.2	0	0	0	0	0	112.4	F78 V110 M111 G117 Y118	F78-A114 HydrophobicContact CE2-CB 3.54Å; F78-A114 HydrophobicContact CZ-CB 3.95Å; V110-A114 WeakPolarHBondContact O-CB 3.49Å; V110-A114 PolarHBondContact O-N 2.91Å; M111-A114 PolarHBondContact O-N 3.26Å; A114-G117 PolarHBondContact O-N 2.91Å; A114-Y118 PolarHBondContact O-N 3.31Å
115	F	98.8	Very high	98.6	Very high	47 Å²	47	51.6 Å²	51.6	21%	0.206	27%	0.269	C	S	.	.	H	α-helix	trans	-57.1	-52.2	173.7	164.5	-111.1	0	0	0	111.2	M111 A112 G117 Y118 V119 I133 T134 F165	M111-F115 WeakPolarHBondContact O-CB 3.34Å; M111-F115 PolarHBondContact O-N 3.3Å; A112-F115 PolarHBondContact O-N 3.48Å; F115-G117 VanDerWaalsContact C-N 3.31Å; F115-G117 PolarHBondContact O-N 3.43Å; F115-Y118 WeakPolarHBondContact O-CB 3.48Å; F115-Y118 PolarHBondContact O-N 3.34Å; F115-V119 HydrophobicContact CE2-CG2 4.34Å; F115-V119 HydrophobicContact CZ-CG2 4.45Å; F115-V119 PolarHBondContact O-N 3.17Å; F115-I133 HydrophobicContact CD2-CD1 3.73Å; F115-I133 HydrophobicContact CD2-CG2 4.34Å; F115-I133 HydrophobicContact CE1-CG2 4.37Å; F115-I133 HydrophobicContact CE2-CB 3.79Å; F115-I133 HydrophobicContact CE2-CD1 3.56Å; F115-I133 HydrophobicContact CE2-CG1 4.23Å; F115-I133 HydrophobicContact CE2-CG2 3.88Å; F115-I133 HydrophobicContact CZ-CB 3.97Å; F115-I133 HydrophobicContact CZ-CG2 3.88Å; F115-T134 HydrophobicContact CE1-CG2 4.23Å; F115-T134 HydrophobicContact CZ-CG2 4.09Å; F115-F165 AromaticContact CE1-CE2 3.8Å; F115-F165 HydrophobicContact CE1-CE2 3.8Å; F115-F165 HydrophobicContact CE1-CZ 4.13Å; F115-F165 HydrophobicContact CZ-CE2 4.13Å
116	M	98.6	Very high	98.5	Very high	19 Å²	19	47.5 Å²	47.5	9%	0.094	25%	0.248	C	C	.	.	H	α-helix	trans	-63.7	-37	179	-73.7	177.4	-83.3	0	0	112.3	A112 T113 Y118 V119 L120 F165 F168 H169 L172	A112-M116 VanDerWaalsContact C-CE 3.48Å; A112-M116 HydrophobicContact CB-CE 3.96Å; A112-M116 WeakPolarHBondContact O-CE 3.38Å; A112-M116 PolarHBondContact O-N 3.47Å; T113-M116 PolarHBondContact O-N 3.39Å; M116-Y118 VanDerWaalsContact C-N 3.31Å; M116-Y118 PolarHBondContact O-N 2.84Å; M116-V119 WeakPolarHBondContact O-CB 3.34Å; M116-V119 PolarHBondContact O-N 3.48Å; M116-V119 VanDerWaalsContact O-N 3.13Å; M116-L120 WeakPolarHBondContact O-CG 3.43Å; M116-F165 HydrophobicContact CB-CB 4.44Å; M116-F165 HydrophobicContact CB-CD2 4.29Å; M116-F165 HydrophobicContact CB-CG 4.43Å; M116-F165 HydrophobicContact CG-CB 4.4Å; M116-F165 HydrophobicContact CG-CD1 4.31Å; M116-F165 HydrophobicContact CG-CD2 3.83Å; M116-F165 HydrophobicContact CG-CE2 4.12Å; M116-F165 HydrophobicContact CG-CG 3.94Å; M116-F165 HydrophobicContact CG-CZ 4.49Å; M116-F165 HydrophobicContact SD-CD1 4.37Å; M116-F165 HydrophobicContact SD-CG 4.47Å; M116-F168 HydrophobicContact CE-CB 4.25Å; M116-F168 HydrophobicContact SD-CB 3.48Å; M116-F168 WeakPolarHBondContact SD-CB 3.37Å; M116-F168 HydrophobicContact SD-CD2 4.48Å; M116-F168 HydrophobicContact SD-CG 4.31Å; M116-H169 HydrophobicContact CB-CB 4.06Å; M116-L172 HydrophobicContact CE-CD1 3.21Å; M116-L172 HydrophobicContact SD-CD1 4.5Å
117	G	98.6	Very high	98.4	Very high	18 Å²	18	49.1 Å²	49.1	19%	0.186	25%	0.254	C	S	.	.	H	α-helix	trans	-60.5	-39.1	174.5	0	0	0	0	0	112.8	T113 A114 F115 V119 L120 P121 H169	T113-G117 PolarHBondContact O-N 3.07Å; A114-G117 PolarHBondContact O-N 2.91Å; F115-G117 VanDerWaalsContact C-N 3.31Å; F115-G117 PolarHBondContact O-N 3.43Å; G117-V119 PolarHBondContact O-N 3.37Å; G117-L120 WeakPolarHBondContact O-CB 3.31Å; G117-L120 PolarHBondContact O-N 3.27Å; G117-P121 WeakPolarHBondContact O-CD 3.29Å; G117-H169 WeakPolarHBondContact CA-CE1 3.48Å; G117-H169 VanDerWaalsContact CA-ND1 3.31Å; G117-H169 WeakPolarHBondContact CA-ND1 3.09Å; G117-H169 PolarHBondContact N-ND1 3.3Å
118	Y	98.6	Very high	98.4	Very high	135 Å²	135	54.1 Å²	54.1	53%	0.529	27%	0.271	S	S	.	.	H	α-helix	trans	-66.8	-21.2	177	-168.9	-101.6	0	0	0	113.4	A114 F115 M116 P121 M125 S126	A114-Y118 PolarHBondContact O-N 3.31Å; F115-Y118 WeakPolarHBondContact O-CB 3.48Å; F115-Y118 PolarHBondContact O-N 3.34Å; M116-Y118 VanDerWaalsContact C-N 3.31Å; M116-Y118 PolarHBondContact O-N 2.84Å; Y118-P121 WeakPolarHBondContact O-CD 3.41Å; Y118-M125 HydrophobicContact CE1-CB 4.04Å; Y118-M125 WeakPolarHBondContact OH-CB 3.31Å; Y118-S126 VanDerWaalsContact O-CB 3.29Å; Y118-S126 WeakPolarHBondContact O-CB 3.37Å; Y118-S126 PolarHBondContact O-OG 2.69Å
119	V	98.8	Very high	98.4	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.006	26%	0.256	C	S	.	.	H	α-helix	trans	-76.8	-29.9	176.1	-178.7	0	0	0	0	111.9	F115 M116 G117 W122 A130 F165	F115-V119 HydrophobicContact CE2-CG2 4.34Å; F115-V119 HydrophobicContact CZ-CG2 4.45Å; F115-V119 PolarHBondContact O-N 3.17Å; M116-V119 WeakPolarHBondContact O-CB 3.34Å; M116-V119 PolarHBondContact O-N 3.48Å; M116-V119 VanDerWaalsContact O-N 3.13Å; G117-V119 PolarHBondContact O-N 3.37Å; V119-W122 HydrophobicContact CG1-CE3 4.04Å; V119-W122 HydrophobicContact CG1-CZ3 3.8Å; V119-W122 PolarHBondContact O-N 3.18Å; V119-A130 HydrophobicContact CG1-CB 4.08Å; V119-A130 HydrophobicContact CG2-CB 3.79Å; V119-F165 HydrophobicContact CB-CD2 3.92Å; V119-F165 HydrophobicContact CG1-CD2 3.95Å; V119-F165 HydrophobicContact CG2-CD2 3.87Å; V119-F165 HydrophobicContact CG2-CE2 4.03Å
120	L	98.8	Very high	98.3	Very high	17 Å²	17	48.6 Å²	48.6	9%	0.089	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-36.6	-170.3	-53.9	-175.5	0	0	0	115.4	Y42 M116 G117 W122 L162 F165 F166 H169	Y42-L120 HydrophobicContact CE2-CB 4.42Å; Y42-L120 WeakPolarHBondContact CE2-O 3.49Å; Y42-L120 PolarHBondContact OH-O 3.06Å; M116-L120 WeakPolarHBondContact O-CG 3.43Å; G117-L120 WeakPolarHBondContact O-CB 3.31Å; G117-L120 PolarHBondContact O-N 3.27Å; L120-W122 PolarHBondContact O-N 3.25Å; L120-L162 HydrophobicContact CD2-CD1 4.19Å; L120-F165 HydrophobicContact CD2-CB 4.46Å; L120-F166 HydrophobicContact CD1-CD2 4Å; L120-F166 HydrophobicContact CD2-CB 3.9Å; L120-H169 HydrophobicContact CD1-CB 4.25Å; L120-H169 VanDerWaalsContact CD1-CD2 3.47Å; L120-H169 WeakPolarHBondContact CD1-CD2 3.49Å
121	P	98.6	Very high	98.2	Very high	39 Å²	39	49.6 Å²	49.6	25%	0.253	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-13.7	175.5	-24.1	35.5	0	0	0	114.4	F50 G117 Y118 G123	F50-P121 WeakPolarHBondContact CA-O 3.39Å; F50-P121 WeakPolarHBondContact CD2-O 3.27Å; G117-P121 WeakPolarHBondContact O-CD 3.29Å; Y118-P121 WeakPolarHBondContact O-CD 3.41Å; P121-G123 PolarHBondContact O-N 3.28Å
122	W	98.5	Very high	98.2	Very high	43 Å²	43	49.9 Å²	49.9	16%	0.163	26%	0.263	C	S	.	.			trans	53.9	36.4	177.2	-151.5	-114.4	0	0	0	114.2	T46 A49 V119 L120 F127 V157 L162	T46-W122 HydrophobicContact CG2-CD2 4.48Å; T46-W122 HydrophobicContact CG2-CH2 4.26Å; T46-W122 HydrophobicContact CG2-CZ2 3.53Å; A49-W122 HydrophobicContact CB-CB 3.92Å; V119-W122 HydrophobicContact CG1-CE3 4.04Å; V119-W122 HydrophobicContact CG1-CZ3 3.8Å; V119-W122 PolarHBondContact O-N 3.18Å; L120-W122 PolarHBondContact O-N 3.25Å; W122-F127 HydrophobicContact CH2-CD2 4.03Å; W122-F127 AromaticContact CZ2-CD2 3.82Å; W122-F127 HydrophobicContact CZ2-CD2 3.82Å; W122-F127 HydrophobicContact CZ2-CE2 4.24Å; W122-V157 HydrophobicContact CH2-CG1 3.6Å; W122-V157 HydrophobicContact CZ3-CG1 4.07Å; W122-L162 HydrophobicContact CB-CD2 4.5Å; W122-L162 HydrophobicContact CD2-CD1 4.44Å; W122-L162 HydrophobicContact CD2-CD2 3.9Å; W122-L162 HydrophobicContact CE3-CB 4.22Å; W122-L162 HydrophobicContact CE3-CD1 3.67Å; W122-L162 HydrophobicContact CE3-CD2 3.91Å; W122-L162 HydrophobicContact CE3-CG 4.15Å; W122-L162 HydrophobicContact CG-CD2 4.17Å; W122-L162 HydrophobicContact CH2-CB 4.17Å; W122-L162 HydrophobicContact CZ3-CB 3.87Å; W122-L162 HydrophobicContact CZ3-CD1 4Å; W122-L162 HydrophobicContact CZ3-CD2 4.37Å; W122-L162 HydrophobicContact CZ3-CG 4.3Å
123	G	98	Very high	98.2	Very high	19 Å²	19	52.1 Å²	52.1	20%	0.196	27%	0.268	C	S	.	.			trans	-82.3	178.1	170.2	0	0	0	0	0	112.6	P121 M125 S126 F127	P121-G123 PolarHBondContact O-N 3.28Å; G123-M125 PolarHBondContact O-N 3.24Å; G123-S126 PolarHBondContact N-OG 3.35Å; G123-S126 VanDerWaalsContact O-CB 3.3Å; G123-S126 WeakPolarHBondContact O-CB 2.95Å; G123-S126 PolarHBondContact O-N 2.86Å; G123-S126 VanDerWaalsContact O-N 3.14Å; G123-F127 PolarHBondContact O-N 3.44Å
124	Q	97.7	Very high	98.2	Very high	142 Å²	142	52 Å²	52	66%	0.664	27%	0.267	S	S	*	.	H	α-helix	trans	-55.3	-50.6	178.7	-73.2	-69.8	-6.7	0	0	112.5	S126 F127 W128	Q124-S126 VanDerWaalsContact C-N 3.31Å; Q124-S126 PolarHBondContact O-N 3.09Å; Q124-F127 PolarHBondContact O-N 3.23Å; Q124-W128 PolarHBondContact O-N 3.2Å; Q124-W128 VanDerWaalsContact OE1-NE1 3.11Å
125	M	97.1	Very high	98.1	Very high	133 Å²	133	54 Å²	54	66%	0.655	27%	0.274	S	S	*	.	H	α-helix	trans	-66.8	-32.6	179.2	-64.8	-57.2	-170.8	0	0	112.7	Y118 G123 G129	Y118-M125 HydrophobicContact CE1-CB 4.04Å; Y118-M125 WeakPolarHBondContact OH-CB 3.31Å; G123-M125 PolarHBondContact O-N 3.24Å; M125-G129 WeakPolarHBondContact O-CA 3.5Å; M125-G129 PolarHBondContact O-N 2.99Å
126	S	97.5	Very high	98.1	Very high	8 Å²	8	57.7 Å²	57.7	6%	0.056	30%	0.295	C	S	.	.	H	α-helix	trans	-61	-50	174.2	-59.3	0	0	0	0	111.1	Y118 G123 Q124 A130	Y118-S126 VanDerWaalsContact O-CB 3.29Å; Y118-S126 WeakPolarHBondContact O-CB 3.37Å; Y118-S126 PolarHBondContact O-OG 2.69Å; G123-S126 PolarHBondContact N-OG 3.35Å; G123-S126 VanDerWaalsContact O-CB 3.3Å; G123-S126 WeakPolarHBondContact O-CB 2.95Å; G123-S126 PolarHBondContact O-N 2.86Å; G123-S126 VanDerWaalsContact O-N 3.14Å; Q124-S126 VanDerWaalsContact C-N 3.31Å; Q124-S126 PolarHBondContact O-N 3.09Å; S126-A130 WeakPolarHBondContact O-CB 3.35Å; S126-A130 PolarHBondContact O-N 3.4Å
127	F	97.9	Very high	98	Very high	56 Å²	56	59.8 Å²	59.8	25%	0.246	31%	0.307	C	S	.	.	H	α-helix	trans	-66	-52.7	-179.2	-179.4	-90.9	0	0	0	112.1	W122 G123 Q124 G129 A130 T131 V157	W122-F127 HydrophobicContact CH2-CD2 4.03Å; W122-F127 AromaticContact CZ2-CD2 3.82Å; W122-F127 HydrophobicContact CZ2-CD2 3.82Å; W122-F127 HydrophobicContact CZ2-CE2 4.24Å; G123-F127 PolarHBondContact O-N 3.44Å; Q124-F127 PolarHBondContact O-N 3.23Å; F127-G129 VanDerWaalsContact C-N 3.34Å; F127-G129 PolarHBondContact O-N 3.17Å; F127-A130 PolarHBondContact O-N 2.86Å; F127-T131 PolarHBondContact O-N 3.18Å; F127-T131 PolarHBondContact O-OG1 3.3Å; F127-T131 VanDerWaalsContact O-OG1 3.11Å; F127-V157 HydrophobicContact CD2-CG1 4.13Å; F127-V157 HydrophobicContact CE2-CB 4.2Å; F127-V157 HydrophobicContact CE2-CG1 4.11Å; F127-V157 VanDerWaalsContact CE2-O 3.22Å; F127-V157 WeakPolarHBondContact CE2-O 3.29Å
128	W	98.3	Very high	98	Very high	142 Å²	142	61.3 Å²	61.3	54%	0.538	31%	0.314	S	S	.	.	H	α-helix	trans	-67.8	-36.4	-178.2	-69.2	117	0	0	0	112.4	Q124 T131 V132	Q124-W128 PolarHBondContact O-N 3.2Å; Q124-W128 VanDerWaalsContact OE1-NE1 3.11Å; W128-T131 PolarHBondContact O-N 3.28Å; W128-V132 WeakPolarHBondContact O-CB 3.41Å; W128-V132 WeakPolarHBondContact O-CG2 3.47Å; W128-V132 PolarHBondContact O-N 2.98Å
129	G	97.3	Very high	98	Very high	22 Å²	22	58.9 Å²	58.9	23%	0.227	32%	0.322	C	S	.	.	H	α-helix	trans	-59.9	-46.8	172.2	0	0	0	0	0	111.7	M125 F127 T131 I133	M125-G129 WeakPolarHBondContact O-CA 3.5Å; M125-G129 PolarHBondContact O-N 2.99Å; F127-G129 VanDerWaalsContact C-N 3.34Å; F127-G129 PolarHBondContact O-N 3.17Å; G129-T131 PolarHBondContact O-N 3.26Å; G129-I133 VanDerWaalsContact O-CB 3.3Å; G129-I133 WeakPolarHBondContact O-CB 3.45Å; G129-I133 WeakPolarHBondContact O-CG1 3.49Å; G129-I133 PolarHBondContact O-N 3.38Å
130	A	97.6	Very high	97.9	Very high	0 Å²	0	62 Å²	62	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-58.8	-49.6	176.1	0	0	0	0	0	111.6	V119 S126 F127 T134 V157	V119-A130 HydrophobicContact CG1-CB 4.08Å; V119-A130 HydrophobicContact CG2-CB 3.79Å; S126-A130 WeakPolarHBondContact O-CB 3.35Å; S126-A130 PolarHBondContact O-N 3.4Å; F127-A130 PolarHBondContact O-N 2.86Å; A130-T134 WeakPolarHBondContact O-CB 3.33Å; A130-T134 WeakPolarHBondContact O-CG2 3.44Å; A130-T134 PolarHBondContact O-N 2.92Å; A130-T134 VanDerWaalsContact O-N 3.09Å; A130-T134 PolarHBondContact O-OG1 2.83Å; A130-V157 HydrophobicContact CB-CG1 4.07Å; A130-V157 HydrophobicContact CB-CG2 4.24Å
131	T	97.8	Very high	97.9	Very high	31 Å²	31	65.6 Å²	65.6	19%	0.19	36%	0.362	C	S	.	.	H	α-helix	trans	-59.2	-52	-179.2	-62.5	0	0	0	0	111.7	F127 W128 G129 N135	F127-T131 PolarHBondContact O-N 3.18Å; F127-T131 PolarHBondContact O-OG1 3.3Å; F127-T131 VanDerWaalsContact O-OG1 3.11Å; W128-T131 PolarHBondContact O-N 3.28Å; G129-T131 PolarHBondContact O-N 3.26Å; T131-N135 WeakPolarHBondContact O-CB 3.4Å; T131-N135 PolarHBondContact O-N 2.82Å
132	V	98.4	Very high	97.8	Very high	94 Å²	94	74.9 Å²	74.9	57%	0.57	39%	0.394	S	S	*	.	H	α-helix	trans	-67.9	-47.2	-175.8	173.4	0	0	0	0	111.5	W128 N135 L136	W128-V132 WeakPolarHBondContact O-CB 3.41Å; W128-V132 WeakPolarHBondContact O-CG2 3.47Å; W128-V132 PolarHBondContact O-N 2.98Å; V132-N135 PolarHBondContact O-N 3.39Å; V132-L136 PolarHBondContact O-N 3.27Å
133	I	98.1	Very high	97.8	Very high	86 Å²	86	77.4 Å²	77.4	44%	0.441	41%	0.409	S	S	.	.	H	α-helix	trans	-68.2	-45.8	-173.8	-69.1	170.6	0	0	0	111.2	F115 G129 N135 L136	F115-I133 HydrophobicContact CD2-CD1 3.73Å; F115-I133 HydrophobicContact CD2-CG2 4.34Å; F115-I133 HydrophobicContact CE1-CG2 4.37Å; F115-I133 HydrophobicContact CE2-CB 3.79Å; F115-I133 HydrophobicContact CE2-CD1 3.56Å; F115-I133 HydrophobicContact CE2-CG1 4.23Å; F115-I133 HydrophobicContact CE2-CG2 3.88Å; F115-I133 HydrophobicContact CZ-CB 3.97Å; F115-I133 HydrophobicContact CZ-CG2 3.88Å; G129-I133 VanDerWaalsContact O-CB 3.3Å; G129-I133 WeakPolarHBondContact O-CB 3.45Å; G129-I133 WeakPolarHBondContact O-CG1 3.49Å; G129-I133 PolarHBondContact O-N 3.38Å; I133-N135 VanDerWaalsContact C-N 3.31Å; I133-N135 PolarHBondContact O-N 3.19Å; I133-L136 WeakPolarHBondContact O-CB 3.41Å; I133-L136 WeakPolarHBondContact O-CG 3.46Å; I133-L136 PolarHBondContact O-N 3.11Å
134	T	98.1	Very high	97.8	Very high	10 Å²	10	76.5 Å²	76.5	6%	0.061	40%	0.401	C	S	.	.	H	α-helix	trans	-68.3	-32.9	179.7	53.8	0	0	0	0	112.1	F115 A130 L136 L137 I151 W152 F165	F115-T134 HydrophobicContact CE1-CG2 4.23Å; F115-T134 HydrophobicContact CZ-CG2 4.09Å; A130-T134 WeakPolarHBondContact O-CB 3.33Å; A130-T134 WeakPolarHBondContact O-CG2 3.44Å; A130-T134 PolarHBondContact O-N 2.92Å; A130-T134 VanDerWaalsContact O-N 3.09Å; A130-T134 PolarHBondContact O-OG1 2.83Å; T134-L136 PolarHBondContact O-N 2.97Å; T134-L137 WeakPolarHBondContact O-CB 3.41Å; T134-L137 PolarHBondContact O-N 3.44Å; T134-I151 HydrophobicContact CG2-CG2 4.31Å; T134-W152 PolarHBondContact OG1-NE1 3.04Å; T134-F165 HydrophobicContact CG2-CZ 4.02Å
135	N	97.8	Very high	97.9	Very high	72 Å²	72	73.9 Å²	73.9	39%	0.385	39%	0.394	S	S	.	.	H	α-helix	trans	-69.5	-12.2	178.1	-159.7	44.7	0	0	0	113.5	T131 V132 I133 L137 S138 W152	T131-N135 WeakPolarHBondContact O-CB 3.4Å; T131-N135 PolarHBondContact O-N 2.82Å; V132-N135 PolarHBondContact O-N 3.39Å; I133-N135 VanDerWaalsContact C-N 3.31Å; I133-N135 PolarHBondContact O-N 3.19Å; N135-L137 PolarHBondContact O-N 3.33Å; N135-L137 VanDerWaalsContact O-N 3.14Å; N135-S138 VanDerWaalsContact O-CB 3.26Å; N135-S138 WeakPolarHBondContact O-CB 3.25Å; N135-S138 PolarHBondContact O-N 3.47Å; N135-S138 PolarHBondContact O-OG 3.21Å; N135-W152 HydrophobicContact CB-CH2 4.45Å; N135-W152 HydrophobicContact CB-CZ2 4.23Å
136	L	97.9	Very high	97.9	Very high	124 Å²	124	72.1 Å²	72.1	65%	0.649	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-57.5	-26.7	169.8	-65.8	174.6	0	0	0	112.5	V132 I133 T134 S138 A139	V132-L136 PolarHBondContact O-N 3.27Å; I133-L136 WeakPolarHBondContact O-CB 3.41Å; I133-L136 WeakPolarHBondContact O-CG 3.46Å; I133-L136 PolarHBondContact O-N 3.11Å; T134-L136 PolarHBondContact O-N 2.97Å; L136-S138 PolarHBondContact O-N 3.08Å; L136-A139 WeakPolarHBondContact O-CB 3.47Å; L136-A139 PolarHBondContact O-N 3.45Å
137	L	97.4	Very high	98	Very high	64 Å²	64	74.6 Å²	74.6	34%	0.335	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-68.7	-18.1	176	-63.9	172.5	0	0	0	113	T134 N135 A139 I140 G144 V148 I151	T134-L137 WeakPolarHBondContact O-CB 3.41Å; T134-L137 PolarHBondContact O-N 3.44Å; N135-L137 PolarHBondContact O-N 3.33Å; N135-L137 VanDerWaalsContact O-N 3.14Å; L137-A139 PolarHBondContact O-N 3.31Å; L137-A139 VanDerWaalsContact O-N 3.16Å; L137-I140 HydrophobicContact CD2-CD1 3.98Å; L137-I140 WeakPolarHBondContact O-CB 3.33Å; L137-I140 WeakPolarHBondContact O-CG1 3.31Å; L137-I140 PolarHBondContact O-N 2.9Å; L137-I140 VanDerWaalsContact O-N 3.12Å; L137-G144 WeakPolarHBondContact O-CA 3.35Å; L137-V148 HydrophobicContact CB-CG2 3.84Å; L137-I151 HydrophobicContact CD1-CD1 3.28Å
138	S	97.6	Very high	98	Very high	50 Å²	50	72 Å²	72	35%	0.35	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-64.3	-19	175.8	83.1	0	0	0	0	112.5	N135 L136 I140	N135-S138 VanDerWaalsContact O-CB 3.26Å; N135-S138 WeakPolarHBondContact O-CB 3.25Å; N135-S138 PolarHBondContact O-N 3.47Å; N135-S138 PolarHBondContact O-OG 3.21Å; L136-S138 PolarHBondContact O-N 3.08Å; S138-I140 PolarHBondContact O-N 2.84Å
139	A	98.3	Very high	98	Very high	83 Å²	83	68.8 Å²	68.8	69%	0.686	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-72.8	-11.4	176.9	0	0	0	0	0	113.5	L136 L137 P141	L136-A139 WeakPolarHBondContact O-CB 3.47Å; L136-A139 PolarHBondContact O-N 3.45Å; L137-A139 PolarHBondContact O-N 3.31Å; L137-A139 VanDerWaalsContact O-N 3.16Å; A139-P141 WeakPolarHBondContact O-CD 3.5Å
140	I	98.3	Very high	98.1	Very high	68 Å²	68	76.7 Å²	76.7	35%	0.349	41%	0.406	S	S	.	.	S	Bend	trans	-71.3	121.7	176.1	-60.8	172.9	0	0	0	109	L137 S138 I143 G144 L147	L137-I140 HydrophobicContact CD2-CD1 3.98Å; L137-I140 WeakPolarHBondContact O-CB 3.33Å; L137-I140 WeakPolarHBondContact O-CG1 3.31Å; L137-I140 PolarHBondContact O-N 2.9Å; L137-I140 VanDerWaalsContact O-N 3.12Å; S138-I140 PolarHBondContact O-N 2.84Å; I140-I143 HydrophobicContact CG2-CD1 4.14Å; I140-I143 HydrophobicContact CG2-CG1 3.68Å; I140-G144 VanDerWaalsContact O-CA 3.28Å; I140-G144 WeakPolarHBondContact O-CA 3.26Å; I140-G144 PolarHBondContact O-N 3.42Å; I140-L147 HydrophobicContact CD1-CD1 4.08Å
141	P	98.1	Very high	98.1	Very high	91 Å²	91	78.5 Å²	78.5	59%	0.591	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	143.5	-178.9	-25.8	35	0	0	0	112.8	A139 I143	A139-P141 WeakPolarHBondContact O-CD 3.5Å; P141-I143 PolarHBondContact O-N 3.35Å
142	Y	97.1	Very high	98.1	Very high	234 Å²	234	78 Å²	78	92%	0.918	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.7	-43.5	176.2	-43.9	-68.9	0	0	0	116.3
143	I	98.3	Very high	98.1	Very high	96 Å²	96	75.5 Å²	75.5	49%	0.492	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.6	-9.3	-171.9	63.5	172.5	0	0	0	114.2	I140 P141 T145 T146 L147	I140-I143 HydrophobicContact CG2-CD1 4.14Å; I140-I143 HydrophobicContact CG2-CG1 3.68Å; P141-I143 PolarHBondContact O-N 3.35Å; I143-T145 PolarHBondContact O-N 2.82Å; I143-T146 PolarHBondContact O-N 3.26Å; I143-L147 HydrophobicContact CD1-CD1 3.89Å; I143-L147 HydrophobicContact CG1-CD1 3.98Å; I143-L147 WeakPolarHBondContact O-CG 3.44Å; I143-L147 PolarHBondContact O-N 3.14Å
144	G	98.3	Very high	98	Very high	1 Å²	1	72.9 Å²	72.9	1%	0.01	40%	0.397	C	S	.	.	H	α-helix	trans	-57.3	-52.7	-170.2	0	0	0	0	0	114.3	L137 I140 T146 L147 V148	L137-G144 WeakPolarHBondContact O-CA 3.35Å; I140-G144 VanDerWaalsContact O-CA 3.28Å; I140-G144 WeakPolarHBondContact O-CA 3.26Å; I140-G144 PolarHBondContact O-N 3.42Å; G144-T146 VanDerWaalsContact C-N 3.33Å; G144-T146 PolarHBondContact O-N 3.32Å; G144-L147 WeakPolarHBondContact O-CB 3.36Å; G144-L147 PolarHBondContact O-N 3.12Å; G144-L147 VanDerWaalsContact O-N 3.16Å; G144-V148 WeakPolarHBondContact O-CG2 3.47Å; G144-V148 PolarHBondContact O-N 3.42Å
145	T	98	Very high	98	Very high	87 Å²	87	80.8 Å²	80.8	53%	0.534	43%	0.432	S	S	.	.	H	α-helix	trans	-59.6	-43.7	179.5	-50.5	0	0	0	0	111.8	I143 L147 V148 E149	I143-T145 PolarHBondContact O-N 2.82Å; T145-L147 VanDerWaalsContact C-N 3.32Å; T145-L147 PolarHBondContact O-N 2.72Å; T145-V148 PolarHBondContact O-N 3.08Å; T145-E149 PolarHBondContact O-N 3.26Å
146	T	98.4	Very high	98	Very high	96 Å²	96	80.5 Å²	80.5	59%	0.589	44%	0.435	S	S	*	.	H	α-helix	trans	-61.1	-40	176.8	-50.3	0	0	0	0	111.9	I143 G144 W150	I143-T146 PolarHBondContact O-N 3.26Å; G144-T146 VanDerWaalsContact C-N 3.33Å; G144-T146 PolarHBondContact O-N 3.32Å; T146-W150 WeakPolarHBondContact O-CB 3.33Å; T146-W150 PolarHBondContact O-N 2.78Å
147	L	98.3	Very high	98	Very high	59 Å²	59	74.7 Å²	74.7	31%	0.309	41%	0.405	S	S	.	.	H	α-helix	trans	-64.1	-42.7	176.5	-74	173.7	0	0	0	112.1	I140 I143 G144 T145 W150 I151	I140-L147 HydrophobicContact CD1-CD1 4.08Å; I143-L147 HydrophobicContact CD1-CD1 3.89Å; I143-L147 HydrophobicContact CG1-CD1 3.98Å; I143-L147 WeakPolarHBondContact O-CG 3.44Å; I143-L147 PolarHBondContact O-N 3.14Å; G144-L147 WeakPolarHBondContact O-CB 3.36Å; G144-L147 PolarHBondContact O-N 3.12Å; G144-L147 VanDerWaalsContact O-N 3.16Å; T145-L147 VanDerWaalsContact C-N 3.32Å; T145-L147 PolarHBondContact O-N 2.72Å; L147-W150 PolarHBondContact O-N 3.36Å; L147-I151 VanDerWaalsContact O-CG1 3.32Å; L147-I151 WeakPolarHBondContact O-CG1 3.32Å; L147-I151 PolarHBondContact O-N 3.39Å
148	V	98.6	Very high	98.1	Very high	2 Å²	2	76 Å²	76	1%	0.012	41%	0.412	C	S	.	.	H	α-helix	trans	-62.9	-51.8	178.9	173.8	0	0	0	0	110.8	L137 G144 T145 W150 I151 W152	L137-V148 HydrophobicContact CB-CG2 3.84Å; G144-V148 WeakPolarHBondContact O-CG2 3.47Å; G144-V148 PolarHBondContact O-N 3.42Å; T145-V148 PolarHBondContact O-N 3.08Å; V148-W150 VanDerWaalsContact C-N 3.25Å; V148-W150 PolarHBondContact O-N 2.75Å; V148-I151 PolarHBondContact O-N 3.38Å; V148-I151 VanDerWaalsContact O-N 3.14Å; V148-W152 HydrophobicContact CG1-CD2 3.7Å; V148-W152 VanDerWaalsContact CG1-CE2 3.44Å; V148-W152 HydrophobicContact CG1-CE3 3.76Å; 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 3.62Å; V148-W152 PolarHBondContact O-N 3.24Å
149	E	98.4	Very high	98.1	Very high	75 Å²	75	78.5 Å²	78.5	35%	0.35	42%	0.416	S	S	.	.	H	α-helix	trans	-62.4	-34.5	178.6	-68.6	179.3	177.3	0	0	111.9	T145 W152 G153 G154	T145-E149 PolarHBondContact O-N 3.26Å; E149-W152 PolarHBondContact O-N 2.78Å; E149-G153 WeakPolarHBondContact O-CA 3.47Å; E149-G153 PolarHBondContact O-N 2.71Å; E149-G154 WeakPolarHBondContact CA-O 3.42Å; E149-G154 PolarHBondContact O-N 3.21Å
150	W	98.5	Very high	98.1	Very high	187 Å²	187	76.5 Å²	76.5	71%	0.708	40%	0.4	S	S	*	.	H	α-helix	trans	-65.4	-44.7	173.8	-180	79.3	0	0	0	112.1	T146 L147 V148 W152 G153 R164	T146-W150 WeakPolarHBondContact O-CB 3.33Å; T146-W150 PolarHBondContact O-N 2.78Å; L147-W150 PolarHBondContact O-N 3.36Å; V148-W150 VanDerWaalsContact C-N 3.25Å; V148-W150 PolarHBondContact O-N 2.75Å; W150-W152 VanDerWaalsContact C-N 3.33Å; W150-W152 PolarHBondContact O-N 2.93Å; W150-G153 PolarHBondContact O-N 3.07Å; W150-R164 PolarHBondContact O-NH1 3.48Å
151	I	97.9	Very high	98.1	Very high	39 Å²	39	73.3 Å²	73.3	20%	0.2	38%	0.384	C	S	.	.	H	α-helix	trans	-63.2	-39.3	175.8	-72	169.7	0	0	0	111	T134 L137 L147 V148 R164 F165	T134-I151 HydrophobicContact CG2-CG2 4.31Å; L137-I151 HydrophobicContact CD1-CD1 3.28Å; L147-I151 VanDerWaalsContact O-CG1 3.32Å; L147-I151 WeakPolarHBondContact O-CG1 3.32Å; L147-I151 PolarHBondContact O-N 3.39Å; V148-I151 PolarHBondContact O-N 3.38Å; V148-I151 VanDerWaalsContact O-N 3.14Å; I151-R164 VanDerWaalsContact C-NH1 3.28Å; I151-R164 WeakPolarHBondContact O-CD 3.41Å; I151-R164 PolarHBondContact O-NE 3.41Å; I151-R164 PolarHBondContact O-NH1 2.88Å; I151-F165 HydrophobicContact CG2-CE1 4.23Å; I151-F165 HydrophobicContact CG2-CZ 4.48Å
152	W	98.6	Very high	98.1	Very high	20 Å²	20	69 Å²	69	8%	0.076	36%	0.356	C	S	.	.	H	α-helix	trans	-72.7	-33.8	175.9	-64.5	-14.3	0	0	0	112.3	T134 N135 V148 E149 W150 G154 F155 V157 T161	T134-W152 PolarHBondContact OG1-NE1 3.04Å; N135-W152 HydrophobicContact CB-CH2 4.45Å; N135-W152 HydrophobicContact CB-CZ2 4.23Å; V148-W152 HydrophobicContact CG1-CD2 3.7Å; V148-W152 VanDerWaalsContact CG1-CE2 3.44Å; V148-W152 HydrophobicContact CG1-CE3 3.76Å; 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 3.62Å; V148-W152 PolarHBondContact O-N 3.24Å; E149-W152 PolarHBondContact O-N 2.78Å; W150-W152 VanDerWaalsContact C-N 3.33Å; W150-W152 PolarHBondContact O-N 2.93Å; W152-G154 VanDerWaalsContact C-N 3.34Å; W152-F155 WeakPolarHBondContact CZ3-O 3.39Å; W152-V157 HydrophobicContact CD2-CG2 4.21Å; W152-V157 HydrophobicContact CG-CG2 4.22Å; W152-V157 HydrophobicContact CZ2-CG2 4.19Å; W152-T161 WeakPolarHBondContact CA-OG1 3.47Å; W152-T161 PolarHBondContact O-N 3Å; W152-T161 PolarHBondContact O-OG1 3.2Å
153	G	98	Very high	98.2	Very high	42 Å²	42	60.7 Å²	60.7	43%	0.433	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.2	32.2	-168.1	0	0	0	0	0	112.7	E149 W150	E149-G153 WeakPolarHBondContact O-CA 3.47Å; E149-G153 PolarHBondContact O-N 2.71Å; W150-G153 PolarHBondContact O-N 3.07Å
154	G	97	Very high	98.2	Very high	30 Å²	30	59.6 Å²	59.6	31%	0.309	32%	0.319	S	S	.	.	S	Bend	trans	169.7	-175.1	-175.8	0	0	0	0	0	111.1	E149 W152 S156	E149-G154 WeakPolarHBondContact CA-O 3.42Å; E149-G154 PolarHBondContact O-N 3.21Å; W152-G154 VanDerWaalsContact C-N 3.34Å; G154-S156 VanDerWaalsContact C-N 3.28Å; G154-S156 PolarHBondContact O-N 2.87Å
155	F	97.9	Very high	98.3	Very high	177 Å²	177	60 Å²	60	78%	0.776	32%	0.321	S	S	*	.	S	Bend	trans	-79.3	-8	-176.7	-56.2	-65.7	0	0	0	114.4	W152	W152-F155 WeakPolarHBondContact CZ3-O 3.39Å
156	S	97.6	Very high	98.3	Very high	65 Å²	65	58.1 Å²	58.1	46%	0.455	31%	0.305	S	S	.	.	S	Bend	trans	-155.6	167.6	178.5	63.4	0	0	0	0	110.6	G154 D158	G154-S156 VanDerWaalsContact C-N 3.28Å; G154-S156 PolarHBondContact O-N 2.87Å; S156-D158 PolarHBondContact O-N 3.44Å
157	V	98.4	Very high	98.3	Very high	3 Å²	3	56.2 Å²	56.2	2%	0.018	30%	0.299	C	S	.	.	S	Bend	trans	-62.9	117.2	170.6	172.1	0	0	0	0	109.5	W122 F127 A130 W152 T161	W122-V157 HydrophobicContact CH2-CG1 3.6Å; W122-V157 HydrophobicContact CZ3-CG1 4.07Å; F127-V157 HydrophobicContact CD2-CG1 4.13Å; F127-V157 HydrophobicContact CE2-CB 4.2Å; F127-V157 HydrophobicContact CE2-CG1 4.11Å; F127-V157 VanDerWaalsContact CE2-O 3.22Å; F127-V157 WeakPolarHBondContact CE2-O 3.29Å; A130-V157 HydrophobicContact CB-CG1 4.07Å; A130-V157 HydrophobicContact CB-CG2 4.24Å; W152-V157 HydrophobicContact CD2-CG2 4.21Å; W152-V157 HydrophobicContact CG-CG2 4.22Å; W152-V157 HydrophobicContact CZ2-CG2 4.19Å; V157-T161 HydrophobicContact CG1-CG2 4.16Å; V157-T161 HydrophobicContact CG2-CG2 4.45Å
158	D	98.1	Very high	98.3	Very high	90 Å²	90	58.4 Å²	58.4	48%	0.481	31%	0.306	S	S	.	.	S	Bend	trans	-152.9	-159.8	-178.4	-161.6	-3.5	0	0	0	110.9	S156 A160 T161 L162	S156-D158 PolarHBondContact O-N 3.44Å; D158-A160 VanDerWaalsContact C-N 3.3Å; D158-A160 PolarHBondContact O-N 3.38Å; D158-T161 PolarHBondContact N-OG1 3.43Å; D158-T161 WeakPolarHBondContact O-CA 3.37Å; D158-T161 VanDerWaalsContact O-CB 3.27Å; D158-T161 WeakPolarHBondContact O-CB 3.37Å; D158-T161 PolarHBondContact O-N 3.37Å; D158-L162 PolarHBondContact O-N 3.01Å
159	K	98.1	Very high	98.3	Very high	103 Å²	103	59.6 Å²	59.6	45%	0.448	31%	0.312	S	S	.	.	H	α-helix	trans	-49.4	-42.7	-177.5	179.6	170.2	173	160.1	0	114.6	D45 T46 T161 L162 T163	D45-K159 WeakPolarHBondContact OD2-CE 3.31Å; D45-K159 IonicContact OD2-NZ 2.67Å; D45-K159 PolarHBondContact OD2-NZ 3.3Å; T46-K159 HydrophobicContact CG2-CB 4.02Å; K159-T161 VanDerWaalsContact C-N 3.3Å; K159-T161 PolarHBondContact O-N 3.25Å; K159-L162 PolarHBondContact O-N 2.71Å; K159-T163 WeakPolarHBondContact O-CB 3.29Å; K159-T163 PolarHBondContact O-N 3.43Å; K159-T163 VanDerWaalsContact O-N 3.07Å; K159-T163 PolarHBondContact O-OG1 3.29Å
160	A	98.4	Very high	98.4	Very high	42 Å²	42	60 Å²	60	35%	0.347	31%	0.312	S	S	.	.	H	α-helix	trans	-64	-36.7	178.2	0	0	0	0	0	112	D158 R164	D158-A160 VanDerWaalsContact C-N 3.3Å; D158-A160 PolarHBondContact O-N 3.38Å; A160-R164 WeakPolarHBondContact O-CG 3.25Å; A160-R164 PolarHBondContact O-N 3.31Å; A160-R164 PolarHBondContact O-NE 3Å
161	T	98.6	Very high	98.4	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-68.5	-47.6	176.2	-43	0	0	0	0	111.3	W152 V157 D158 K159 T163 R164 F165	W152-T161 WeakPolarHBondContact CA-OG1 3.47Å; W152-T161 PolarHBondContact O-N 3Å; W152-T161 PolarHBondContact O-OG1 3.2Å; V157-T161 HydrophobicContact CG1-CG2 4.16Å; V157-T161 HydrophobicContact CG2-CG2 4.45Å; D158-T161 PolarHBondContact N-OG1 3.43Å; D158-T161 WeakPolarHBondContact O-CA 3.37Å; D158-T161 VanDerWaalsContact O-CB 3.27Å; D158-T161 WeakPolarHBondContact O-CB 3.37Å; D158-T161 PolarHBondContact O-N 3.37Å; K159-T161 VanDerWaalsContact C-N 3.3Å; K159-T161 PolarHBondContact O-N 3.25Å; T161-T163 PolarHBondContact O-N 3.18Å; T161-R164 VanDerWaalsContact O-CG 3.27Å; T161-R164 WeakPolarHBondContact O-CG 3.33Å; T161-R164 PolarHBondContact O-N 2.94Å; T161-F165 HydrophobicContact CG2-CD1 4.18Å; T161-F165 HydrophobicContact CG2-CE1 3.96Å; T161-F165 HydrophobicContact CG2-CE2 4.31Å; T161-F165 HydrophobicContact CG2-CG 4.45Å; T161-F165 HydrophobicContact CG2-CZ 4.02Å; T161-F165 VanDerWaalsContact O-CB 3.31Å; T161-F165 WeakPolarHBondContact O-CB 3.49Å; T161-F165 WeakPolarHBondContact O-CD1 3.27Å; T161-F165 WeakPolarHBondContact O-CG 3.33Å; T161-F165 PolarHBondContact O-N 3.38Å
162	L	98.7	Very high	98.4	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-62.5	-45.5	-178.8	-179	57.5	0	0	0	112	T46 A49 L120 W122 D158 K159 R164 F165 F166	T46-L162 HydrophobicContact CG2-CB 4.38Å; T46-L162 HydrophobicContact CG2-CD2 3.9Å; A49-L162 HydrophobicContact CB-CD2 3.72Å; L120-L162 HydrophobicContact CD2-CD1 4.19Å; W122-L162 HydrophobicContact CB-CD2 4.5Å; W122-L162 HydrophobicContact CD2-CD1 4.44Å; W122-L162 HydrophobicContact CD2-CD2 3.9Å; W122-L162 HydrophobicContact CE3-CB 4.22Å; W122-L162 HydrophobicContact CE3-CD1 3.67Å; W122-L162 HydrophobicContact CE3-CD2 3.91Å; W122-L162 HydrophobicContact CE3-CG 4.15Å; W122-L162 HydrophobicContact CG-CD2 4.17Å; W122-L162 HydrophobicContact CH2-CB 4.17Å; W122-L162 HydrophobicContact CZ3-CB 3.87Å; W122-L162 HydrophobicContact CZ3-CD1 4Å; W122-L162 HydrophobicContact CZ3-CD2 4.37Å; W122-L162 HydrophobicContact CZ3-CG 4.3Å; D158-L162 PolarHBondContact O-N 3.01Å; K159-L162 PolarHBondContact O-N 2.71Å; L162-R164 PolarHBondContact O-N 3.39Å; L162-F165 PolarHBondContact O-N 3.47Å; L162-F166 PolarHBondContact O-N 2.94Å
163	T	98.7	Very high	98.4	Very high	61 Å²	61	54.6 Å²	54.6	37%	0.374	30%	0.299	S	S	.	.	H	α-helix	trans	-61.8	-45.8	-178.8	-52.6	0	0	0	0	111.4	S44 K159 T161 F166 A167	S44-T163 PolarHBondContact O-OG1 3.21Å; K159-T163 WeakPolarHBondContact O-CB 3.29Å; K159-T163 PolarHBondContact O-N 3.43Å; K159-T163 VanDerWaalsContact O-N 3.07Å; K159-T163 PolarHBondContact O-OG1 3.29Å; T161-T163 PolarHBondContact O-N 3.18Å; T163-F166 PolarHBondContact O-N 2.96Å; T163-A167 PolarHBondContact O-N 2.91Å
164	R	98.4	Very high	98.5	Very high	73 Å²	73	56.5 Å²	56.5	28%	0.275	30%	0.296	S	S	.	.	H	α-helix	trans	-72	-35.1	178.8	74.5	-175.1	65.1	-163.9	-11	112.2	W150 I151 A160 T161 L162 F166 A167 F168	W150-R164 PolarHBondContact O-NH1 3.48Å; I151-R164 VanDerWaalsContact C-NH1 3.28Å; I151-R164 WeakPolarHBondContact O-CD 3.41Å; I151-R164 PolarHBondContact O-NE 3.41Å; I151-R164 PolarHBondContact O-NH1 2.88Å; A160-R164 WeakPolarHBondContact O-CG 3.25Å; A160-R164 PolarHBondContact O-N 3.31Å; A160-R164 PolarHBondContact O-NE 3Å; T161-R164 VanDerWaalsContact O-CG 3.27Å; T161-R164 WeakPolarHBondContact O-CG 3.33Å; T161-R164 PolarHBondContact O-N 2.94Å; L162-R164 PolarHBondContact O-N 3.39Å; R164-F166 VanDerWaalsContact C-N 3.29Å; R164-F166 PolarHBondContact O-N 3.32Å; R164-A167 PolarHBondContact O-N 3.49Å; R164-A167 VanDerWaalsContact O-N 3.16Å; R164-F168 HydrophobicContact CB-CD2 4.36Å; R164-F168 HydrophobicContact CB-CE2 4.21Å; R164-F168 HydrophobicContact CG-CD2 4.44Å; R164-F168 HydrophobicContact CG-CE2 4.35Å; R164-F168 WeakPolarHBondContact O-CD2 3.3Å; R164-F168 PolarHBondContact O-N 3.38Å
165	F	98.7	Very high	98.5	Very high	9 Å²	9	58.9 Å²	58.9	4%	0.039	30%	0.301	C	S	.	.	H	α-helix	trans	-65	-36.7	177.3	-85.7	23.7	0	0	0	110.8	F115 M116 V119 L120 T134 I151 T161 L162 H169	F115-F165 AromaticContact CE1-CE2 3.8Å; F115-F165 HydrophobicContact CE1-CE2 3.8Å; F115-F165 HydrophobicContact CE1-CZ 4.13Å; F115-F165 HydrophobicContact CZ-CE2 4.13Å; M116-F165 HydrophobicContact CB-CB 4.44Å; M116-F165 HydrophobicContact CB-CD2 4.29Å; M116-F165 HydrophobicContact CB-CG 4.43Å; M116-F165 HydrophobicContact CG-CB 4.4Å; M116-F165 HydrophobicContact CG-CD1 4.31Å; M116-F165 HydrophobicContact CG-CD2 3.83Å; M116-F165 HydrophobicContact CG-CE2 4.12Å; M116-F165 HydrophobicContact CG-CG 3.94Å; M116-F165 HydrophobicContact CG-CZ 4.49Å; M116-F165 HydrophobicContact SD-CD1 4.37Å; M116-F165 HydrophobicContact SD-CG 4.47Å; V119-F165 HydrophobicContact CB-CD2 3.92Å; V119-F165 HydrophobicContact CG1-CD2 3.95Å; V119-F165 HydrophobicContact CG2-CD2 3.87Å; V119-F165 HydrophobicContact CG2-CE2 4.03Å; L120-F165 HydrophobicContact CD2-CB 4.46Å; T134-F165 HydrophobicContact CG2-CZ 4.02Å; I151-F165 HydrophobicContact CG2-CE1 4.23Å; I151-F165 HydrophobicContact CG2-CZ 4.48Å; T161-F165 HydrophobicContact CG2-CD1 4.18Å; T161-F165 HydrophobicContact CG2-CE1 3.96Å; T161-F165 HydrophobicContact CG2-CE2 4.31Å; T161-F165 HydrophobicContact CG2-CG 4.45Å; T161-F165 HydrophobicContact CG2-CZ 4.02Å; T161-F165 VanDerWaalsContact O-CB 3.31Å; T161-F165 WeakPolarHBondContact O-CB 3.49Å; T161-F165 WeakPolarHBondContact O-CD1 3.27Å; T161-F165 WeakPolarHBondContact O-CG 3.33Å; T161-F165 PolarHBondContact O-N 3.38Å; L162-F165 PolarHBondContact O-N 3.47Å; F165-H169 WeakPolarHBondContact O-CB 3.27Å; F165-H169 PolarHBondContact O-N 3.37Å
166	F	98.8	Very high	98.6	Very high	47 Å²	47	50.8 Å²	50.8	21%	0.206	27%	0.265	C	S	.	.	H	α-helix	trans	-59.6	-48.6	170	176.2	-117.8	0	0	0	111.6	A39 Y42 L120 L162 T163 R164 F168 H169 F170	A39-F166 HydrophobicContact CB-CE2 4.23Å; A39-F166 HydrophobicContact CB-CZ 4.11Å; Y42-F166 AromaticContact CD1-CD2 3.74Å; Y42-F166 HydrophobicContact CD1-CD2 3.74Å; Y42-F166 AromaticContact CD1-CE2 3.65Å; Y42-F166 HydrophobicContact CD1-CE2 3.65Å; Y42-F166 HydrophobicContact CD1-CG 4.3Å; Y42-F166 HydrophobicContact CD1-CZ 4.16Å; Y42-F166 HydrophobicContact CE1-CB 4.34Å; Y42-F166 AromaticContact CE1-CD2 3.65Å; Y42-F166 HydrophobicContact CE1-CD2 3.65Å; Y42-F166 HydrophobicContact CE1-CE2 4.08Å; Y42-F166 AromaticContact CE1-CG 3.95Å; Y42-F166 HydrophobicContact CE1-CG 3.95Å; L120-F166 HydrophobicContact CD1-CD2 4Å; L120-F166 HydrophobicContact CD2-CB 3.9Å; L162-F166 PolarHBondContact O-N 2.94Å; T163-F166 PolarHBondContact O-N 2.96Å; R164-F166 VanDerWaalsContact C-N 3.29Å; R164-F166 PolarHBondContact O-N 3.32Å; F166-F168 PolarHBondContact O-N 2.95Å; F166-H169 PolarHBondContact O-N 3.46Å; F166-F170 WeakPolarHBondContact O-CB 3.36Å; F166-F170 PolarHBondContact O-N 3.34Å
167	A	98.8	Very high	98.6	Very high	56 Å²	56	49.1 Å²	49.1	46%	0.463	26%	0.256	S	S	.	.	H	α-helix	trans	-60.4	-45.4	178.4	0	0	0	0	0	112.8	T163 R164 F170 I171	T163-A167 PolarHBondContact O-N 2.91Å; R164-A167 PolarHBondContact O-N 3.49Å; R164-A167 VanDerWaalsContact O-N 3.16Å; A167-F170 PolarHBondContact O-N 3.5Å; A167-I171 WeakPolarHBondContact O-CG2 3.48Å; A167-I171 PolarHBondContact O-N 3.39Å; A167-I171 VanDerWaalsContact O-N 3.13Å
168	F	98.8	Very high	98.7	Very high	105 Å²	105	51.6 Å²	51.6	46%	0.461	28%	0.277	S	S	.	.	H	α-helix	trans	-66.3	-44.5	177.1	-73.8	-55.4	0	0	0	112.6	M116 R164 F166 F170 I171 L172	M116-F168 HydrophobicContact CE-CB 4.25Å; M116-F168 HydrophobicContact SD-CB 3.48Å; M116-F168 WeakPolarHBondContact SD-CB 3.37Å; M116-F168 HydrophobicContact SD-CD2 4.48Å; M116-F168 HydrophobicContact SD-CG 4.31Å; R164-F168 HydrophobicContact CB-CD2 4.36Å; R164-F168 HydrophobicContact CB-CE2 4.21Å; R164-F168 HydrophobicContact CG-CD2 4.44Å; R164-F168 HydrophobicContact CG-CE2 4.35Å; R164-F168 WeakPolarHBondContact O-CD2 3.3Å; R164-F168 PolarHBondContact O-N 3.38Å; F166-F168 PolarHBondContact O-N 2.95Å; F168-F170 PolarHBondContact O-N 3.28Å; F168-I171 WeakPolarHBondContact O-CG2 3.31Å; F168-I171 PolarHBondContact O-N 3.49Å; F168-L172 HydrophobicContact CB-CD1 4.49Å; F168-L172 WeakPolarHBondContact O-CB 3.38Å; F168-L172 WeakPolarHBondContact O-CD1 3.47Å; F168-L172 VanDerWaalsContact O-CG 3.31Å; F168-L172 WeakPolarHBondContact O-CG 3.48Å; F168-L172 PolarHBondContact O-N 3.1Å
169	H	98.9	Very high	98.7	Very high	27 Å²	27	49.3 Å²	49.3	13%	0.125	26%	0.264	C	S	.	.	H	α-helix	trans	-60.7	-33.6	176	-178.6	69.6	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 2.95Å; T113-H169 PolarHBondContact O-ND1 3.45Å; M116-H169 HydrophobicContact CB-CB 4.06Å; G117-H169 WeakPolarHBondContact CA-CE1 3.48Å; G117-H169 VanDerWaalsContact CA-ND1 3.31Å; G117-H169 WeakPolarHBondContact CA-ND1 3.09Å; G117-H169 PolarHBondContact N-ND1 3.3Å; L120-H169 HydrophobicContact CD1-CB 4.25Å; L120-H169 VanDerWaalsContact CD1-CD2 3.47Å; L120-H169 WeakPolarHBondContact CD1-CD2 3.49Å; F165-H169 WeakPolarHBondContact O-CB 3.27Å; F165-H169 PolarHBondContact O-N 3.37Å; F166-H169 PolarHBondContact O-N 3.46Å; H169-P173 WeakPolarHBondContact O-CD 3.11Å; H169-P173 WeakPolarHBondContact O-CG 3.33Å
170	F	98.8	Very high	98.7	Very high	83 Å²	83	45.8 Å²	45.8	36%	0.364	25%	0.254	S	S	.	.	H	α-helix	trans	-70.4	-45.1	176.8	-169.7	-83	0	0	0	112.6	L36 A39 F166 A167 F168 F174	L36-F170 HydrophobicContact CD2-CE2 3.7Å; L36-F170 HydrophobicContact CD2-CZ 3.52Å; A39-F170 HydrophobicContact CB-CD2 4.27Å; A39-F170 HydrophobicContact CB-CE2 4.07Å; F166-F170 WeakPolarHBondContact O-CB 3.36Å; F166-F170 PolarHBondContact O-N 3.34Å; A167-F170 PolarHBondContact O-N 3.5Å; F168-F170 PolarHBondContact O-N 3.28Å; F170-F174 HydrophobicContact CD1-CE2 4.2Å; F170-F174 AromaticContact CE1-CE2 3.94Å; F170-F174 HydrophobicContact CE1-CE2 3.94Å; F170-F174 VanDerWaalsContact O-CD2 3.29Å; F170-F174 WeakPolarHBondContact O-CD2 3.47Å; F170-F174 VanDerWaalsContact O-CE2 3.27Å; F170-F174 WeakPolarHBondContact O-CE2 3.26Å
171	I	98.8	Very high	98.7	Very high	82 Å²	82	49.4 Å²	49.4	42%	0.421	27%	0.266	S	S	.	.	H	α-helix	trans	-79.8	-34.4	-174.2	-169.6	59.5	0	0	0	113.5	A167 F168 F174 I175	A167-I171 WeakPolarHBondContact O-CG2 3.48Å; A167-I171 PolarHBondContact O-N 3.39Å; A167-I171 VanDerWaalsContact O-N 3.13Å; F168-I171 WeakPolarHBondContact O-CG2 3.31Å; F168-I171 PolarHBondContact O-N 3.49Å; I171-F174 PolarHBondContact O-N 3.45Å; I171-F174 VanDerWaalsContact O-N 3.11Å; I171-I175 HydrophobicContact CG1-CD1 4.3Å; I171-I175 PolarHBondContact O-N 3.49Å
172	L	98.6	Very high	98.7	Very high	32 Å²	32	52.1 Å²	52.1	17%	0.168	28%	0.283	C	S	.	.	H	α-helix	trans	-60.4	-38.6	-173.8	-80.1	166.6	0	0	0	115.2	T113 M116 F168 F174 I175 I176	T113-L172 HydrophobicContact CG2-CB 4.41Å; T113-L172 VanDerWaalsContact OG1-CB 3.26Å; T113-L172 WeakPolarHBondContact OG1-CB 3.36Å; M116-L172 HydrophobicContact CE-CD1 3.21Å; M116-L172 HydrophobicContact SD-CD1 4.5Å; F168-L172 HydrophobicContact CB-CD1 4.49Å; F168-L172 WeakPolarHBondContact O-CB 3.38Å; F168-L172 WeakPolarHBondContact O-CD1 3.47Å; F168-L172 VanDerWaalsContact O-CG 3.31Å; F168-L172 WeakPolarHBondContact O-CG 3.48Å; F168-L172 PolarHBondContact O-N 3.1Å; L172-F174 PolarHBondContact O-N 3.48Å; L172-I175 HydrophobicContact CD2-CD1 4.16Å; L172-I175 CarbonylContact O-C 3.24Å; L172-I175 WeakPolarHBondContact O-CA 3.33Å; L172-I175 WeakPolarHBondContact O-CB 3.43Å; L172-I175 PolarHBondContact O-N 3.22Å; L172-I176 WeakPolarHBondContact O-CG1 3.45Å; L172-I176 PolarHBondContact O-N 2.91Å
173	P	98.8	Very high	98.7	Very high	19 Å²	19	53.4 Å²	53.4	12%	0.123	29%	0.289	C	S	.	.	H	α-helix	trans	-53.7	-34.8	173.3	-28.8	34.6	0	0	0	113.9	I32 T113 H169 I176 A177	I32-P173 HydrophobicContact CD1-CB 4.28Å; I32-P173 HydrophobicContact CG1-CB 3.76Å; T113-P173 HydrophobicContact CG2-CG 3.86Å; H169-P173 WeakPolarHBondContact O-CD 3.11Å; H169-P173 WeakPolarHBondContact O-CG 3.33Å; P173-I176 PolarHBondContact O-N 3Å; P173-A177 PolarHBondContact O-N 2.93Å
174	F	98.7	Very high	98.7	Very high	82 Å²	82	54.6 Å²	54.6	36%	0.36	29%	0.292	S	S	.	.	H	α-helix	trans	-75.4	-34.5	177.1	-58.3	-77.6	0	0	0	112.2	I32 L36 F170 I171 L172 I176 A177 A178	I32-F174 HydrophobicContact CG2-CE1 3.97Å; I32-F174 HydrophobicContact CG2-CZ 4.12Å; L36-F174 HydrophobicContact CD2-CZ 4.41Å; F170-F174 HydrophobicContact CD1-CE2 4.2Å; F170-F174 AromaticContact CE1-CE2 3.94Å; F170-F174 HydrophobicContact CE1-CE2 3.94Å; F170-F174 VanDerWaalsContact O-CD2 3.29Å; F170-F174 WeakPolarHBondContact O-CD2 3.47Å; F170-F174 VanDerWaalsContact O-CE2 3.27Å; F170-F174 WeakPolarHBondContact O-CE2 3.26Å; I171-F174 PolarHBondContact O-N 3.45Å; I171-F174 VanDerWaalsContact O-N 3.11Å; L172-F174 PolarHBondContact O-N 3.48Å; F174-I176 VanDerWaalsContact C-N 3.34Å; F174-A177 PolarHBondContact O-N 2.98Å; F174-A178 PolarHBondContact O-N 3.14Å; F174-A178 VanDerWaalsContact O-N 3.08Å
175	I	98.8	Very high	98.7	Very high	81 Å²	81	55.6 Å²	55.6	42%	0.415	30%	0.303	S	S	.	.	H	α-helix	trans	-64.8	-41.6	170.7	-63.1	171.1	0	0	0	110.1	I171 L172 A177 A178 L179	I171-I175 HydrophobicContact CG1-CD1 4.3Å; I171-I175 PolarHBondContact O-N 3.49Å; L172-I175 HydrophobicContact CD2-CD1 4.16Å; L172-I175 CarbonylContact O-C 3.24Å; L172-I175 WeakPolarHBondContact O-CA 3.33Å; L172-I175 WeakPolarHBondContact O-CB 3.43Å; L172-I175 PolarHBondContact O-N 3.22Å; I175-A177 VanDerWaalsContact C-N 3.32Å; I175-A177 PolarHBondContact O-N 3Å; I175-A178 PolarHBondContact O-N 3.41Å; I175-L179 HydrophobicContact CG2-CD1 4.22Å; I175-L179 WeakPolarHBondContact O-CG 3.36Å; I175-L179 PolarHBondContact O-N 2.88Å
176	I	98.9	Very high	98.7	Very high	6 Å²	6	58.7 Å²	58.7	3%	0.031	32%	0.316	C	S	.	.	H	α-helix	trans	-60.3	-42.1	174.5	-68.7	162.5	0	0	0	110.5	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 3.99Å; L106-I176 HydrophobicContact CD2-CG2 3.84Å; A109-I176 HydrophobicContact CB-CD1 4.17Å; A109-I176 HydrophobicContact CB-CG1 3.7Å; V110-I176 HydrophobicContact CG2-CD1 3.87Å; V110-I176 HydrophobicContact CG2-CG1 4.45Å; V110-I176 HydrophobicContact CG2-CG2 4.15Å; T113-I176 WeakPolarHBondContact OG1-CD1 3.3Å; L172-I176 WeakPolarHBondContact O-CG1 3.45Å; L172-I176 PolarHBondContact O-N 2.91Å; P173-I176 PolarHBondContact O-N 3Å; F174-I176 VanDerWaalsContact C-N 3.34Å; I176-A178 PolarHBondContact O-N 2.79Å; I176-L179 PolarHBondContact O-N 2.8Å; I176-A180 WeakPolarHBondContact O-CB 3.3Å; I176-A180 PolarHBondContact O-N 3.29Å
177	A	98.8	Very high	98.7	Very high	30 Å²	30	58.1 Å²	58.1	25%	0.248	32%	0.315	C	S	.	.	H	α-helix	trans	-60.9	-43.1	175.5	0	0	0	0	0	112.1	L28 P173 F174 I175 A180 I181	L28-A177 HydrophobicContact CD2-CB 3.99Å; P173-A177 PolarHBondContact O-N 2.93Å; F174-A177 PolarHBondContact O-N 2.98Å; I175-A177 VanDerWaalsContact C-N 3.32Å; I175-A177 PolarHBondContact O-N 3Å; A177-A180 PolarHBondContact O-N 3.39Å; A177-I181 WeakPolarHBondContact O-CG1 3.31Å; A177-I181 PolarHBondContact O-N 3.13Å; A177-I181 VanDerWaalsContact O-N 3.13Å
178	A	98.7	Very high	98.6	Very high	56 Å²	56	58.9 Å²	58.9	46%	0.463	31%	0.309	S	S	.	.	H	α-helix	trans	-63.5	-44.6	175.2	0	0	0	0	0	112.1	F174 I175 I176 A180 I181 V182	F174-A178 PolarHBondContact O-N 3.14Å; F174-A178 VanDerWaalsContact O-N 3.08Å; I175-A178 PolarHBondContact O-N 3.41Å; I176-A178 PolarHBondContact O-N 2.79Å; A178-A180 VanDerWaalsContact C-N 3.31Å; A178-A180 PolarHBondContact O-N 2.92Å; A178-I181 WeakPolarHBondContact O-CB 3.48Å; A178-I181 PolarHBondContact O-N 3.32Å; A178-V182 PolarHBondContact O-N 3.1Å; A178-V182 VanDerWaalsContact O-N 3.14Å
179	L	98.7	Very high	98.5	Very high	42 Å²	42	61 Å²	61	22%	0.22	32%	0.321	C	S	.	.	H	α-helix	trans	-62.5	-36.4	175.3	-73.3	173.7	0	0	0	112.3	L106 I175 I176 I181 V182 H183	L106-L179 HydrophobicContact CD2-CB 3.56Å; L106-L179 HydrophobicContact CG-CB 4.07Å; I175-L179 HydrophobicContact CG2-CD1 4.22Å; I175-L179 WeakPolarHBondContact O-CG 3.36Å; I175-L179 PolarHBondContact O-N 2.88Å; I176-L179 PolarHBondContact O-N 2.8Å; L179-I181 VanDerWaalsContact C-N 3.33Å; L179-I181 PolarHBondContact O-N 3.35Å; L179-V182 PolarHBondContact O-N 3.24Å; L179-H183 WeakPolarHBondContact O-CB 3.4Å; L179-H183 PolarHBondContact O-N 3.16Å
180	A	98.8	Very high	98.3	Very high	28 Å²	28	63.2 Å²	63.2	23%	0.231	34%	0.336	C	S	.	.	H	α-helix	trans	-66.1	-35.5	176.5	0	0	0	0	0	112.1	L106 I176 A177 A178 H183 L184	L106-A180 HydrophobicContact CD2-CB 4.4Å; I176-A180 WeakPolarHBondContact O-CB 3.3Å; I176-A180 PolarHBondContact O-N 3.29Å; A177-A180 PolarHBondContact O-N 3.39Å; A178-A180 VanDerWaalsContact C-N 3.31Å; A178-A180 PolarHBondContact O-N 2.92Å; A180-H183 WeakPolarHBondContact O-CB 3.35Å; A180-H183 PolarHBondContact O-N 3.47Å; A180-L184 WeakPolarHBondContact O-CG 3.17Å; A180-L184 PolarHBondContact O-N 3.32Å
181	I	98.5	Very high	98.1	Very high	118 Å²	118	59.9 Å²	59.9	61%	0.605	33%	0.325	S	S	*	.	H	α-helix	trans	-64	-45.4	172.3	-66.9	165.4	0	0	0	110.4	A177 A178 L179 H183 L184 L185	A177-I181 WeakPolarHBondContact O-CG1 3.31Å; A177-I181 PolarHBondContact O-N 3.13Å; A177-I181 VanDerWaalsContact O-N 3.13Å; A178-I181 WeakPolarHBondContact O-CB 3.48Å; A178-I181 PolarHBondContact O-N 3.32Å; L179-I181 VanDerWaalsContact C-N 3.33Å; L179-I181 PolarHBondContact O-N 3.35Å; I181-H183 VanDerWaalsContact C-N 3.32Å; I181-H183 PolarHBondContact O-N 3.03Å; I181-L184 PolarHBondContact O-N 2.77Å; I181-L185 WeakPolarHBondContact O-CB 3.32Å; I181-L185 PolarHBondContact O-N 2.84Å
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	176.3	176.1	0	0	0	0	111.4	I102 A178 L179 L184 L185 F186	I102-V182 HydrophobicContact CD1-CG1 4.21Å; I102-V182 HydrophobicContact CG1-CG1 4.3Å; A178-V182 PolarHBondContact O-N 3.1Å; A178-V182 VanDerWaalsContact O-N 3.14Å; L179-V182 PolarHBondContact O-N 3.24Å; V182-L184 PolarHBondContact O-N 3.46Å; V182-L185 WeakPolarHBondContact O-CB 3.27Å; V182-L185 PolarHBondContact O-N 3.13Å; V182-F186 HydrophobicContact CG1-CD2 3.93Å; V182-F186 HydrophobicContact CG1-CE2 3.76Å; V182-F186 WeakPolarHBondContact O-CD2 3.36Å; V182-F186 PolarHBondContact O-N 2.86Å; V182-F186 VanDerWaalsContact O-N 3.12Å
183	H	98.7	Very high	98	Very high	27 Å²	27	57.1 Å²	57.1	13%	0.125	31%	0.314	C	S	.	.	H	α-helix	trans	-58.8	-46.4	175.3	-174.9	75	0	0	0	111.9	T99 I102 L106 L179 A180 I181 L187	T99-H183 WeakPolarHBondContact CG2-CE1 3.16Å; T99-H183 PolarHBondContact O-CE1 3.1Å; T99-H183 PolarHBondContact O-ND1 2.93Å; I102-H183 HydrophobicContact CB-CB 4.42Å; I102-H183 HydrophobicContact CG2-CB 3.66Å; L106-H183 HydrophobicContact CD1-CB 3.82Å; L179-H183 WeakPolarHBondContact O-CB 3.4Å; L179-H183 PolarHBondContact O-N 3.16Å; A180-H183 WeakPolarHBondContact O-CB 3.35Å; A180-H183 PolarHBondContact O-N 3.47Å; I181-H183 VanDerWaalsContact C-N 3.32Å; I181-H183 PolarHBondContact O-N 3.03Å; H183-L187 PolarHBondContact O-N 2.93Å; H183-L187 VanDerWaalsContact O-N 3.09Å
184	L	98.4	Very high	98	Very high	85 Å²	85	56.3 Å²	56.3	45%	0.445	31%	0.309	S	S	.	.	H	α-helix	trans	-69.4	-33.2	177.5	-70.5	173.4	0	0	0	112.6	A180 I181 V182 L187 H188	A180-L184 WeakPolarHBondContact O-CG 3.17Å; A180-L184 PolarHBondContact O-N 3.32Å; I181-L184 PolarHBondContact O-N 2.77Å; V182-L184 PolarHBondContact O-N 3.46Å; L184-L187 HydrophobicContact CD2-CD2 4.17Å; L184-L187 PolarHBondContact O-N 3Å; L184-H188 WeakPolarHBondContact O-CB 3.47Å; L184-H188 PolarHBondContact O-CD2 3.02Å; L184-H188 PolarHBondContact O-N 2.99Å
185	L	98.1	Very high	98	Very high	94 Å²	94	54.3 Å²	54.3	49%	0.492	30%	0.304	S	S	.	.	H	α-helix	trans	-59.7	-52.8	175	-173	159.5	0	0	0	110.4	I181 V182 L187 H188 E189	I181-L185 WeakPolarHBondContact O-CB 3.32Å; I181-L185 PolarHBondContact O-N 2.84Å; V182-L185 WeakPolarHBondContact O-CB 3.27Å; V182-L185 PolarHBondContact O-N 3.13Å; L185-L187 VanDerWaalsContact C-N 3.29Å; L185-L187 PolarHBondContact O-N 3.38Å; L185-H188 PolarHBondContact O-N 2.98Å; L185-H188 VanDerWaalsContact O-N 3.07Å; L185-E189 PolarHBondContact O-N 3.03Å
186	F	98.4	Very high	98	Very high	74 Å²	74	54.6 Å²	54.6	33%	0.325	31%	0.309	S	S	.	.	H	α-helix	trans	-62.6	-35.5	176.7	-77.2	-62.5	0	0	0	112.8	E98 T99 I102 V182 H188 E189	E98-F186 HydrophobicContact CB-CB 4.11Å; E98-F186 HydrophobicContact CB-CD1 3.56Å; E98-F186 HydrophobicContact CB-CD2 4.04Å; E98-F186 HydrophobicContact CB-CE1 3.89Å; E98-F186 HydrophobicContact CB-CE2 4.33Å; E98-F186 HydrophobicContact CB-CG 3.65Å; E98-F186 HydrophobicContact CB-CZ 4.26Å; E98-F186 HydrophobicContact CG-CD1 4Å; E98-F186 HydrophobicContact CG-CE1 3.95Å; E98-F186 HydrophobicContact CG-CZ 4.45Å; T99-F186 VanDerWaalsContact OG1-C 3.29Å; T99-F186 WeakPolarHBondContact OG1-CB 3.36Å; I102-F186 HydrophobicContact CG1-CD2 4.2Å; I102-F186 HydrophobicContact CG1-CE2 4.37Å; V182-F186 HydrophobicContact CG1-CD2 3.93Å; V182-F186 HydrophobicContact CG1-CE2 3.76Å; V182-F186 WeakPolarHBondContact O-CD2 3.36Å; V182-F186 PolarHBondContact O-N 2.86Å; V182-F186 VanDerWaalsContact O-N 3.12Å; F186-H188 VanDerWaalsContact C-N 3.29Å; F186-H188 PolarHBondContact O-N 3.33Å; F186-E189 PolarHBondContact O-N 2.88Å
187	L	98.2	Very high	97.8	Very high	35 Å²	35	56.7 Å²	56.7	18%	0.183	33%	0.333	C	S	.	.	H	α-helix	trans	-63	-36.7	173.8	179.8	64	0	0	0	112.1	T99 H183 L184 L185 E189 T190 G191	T99-L187 HydrophobicContact CG2-CB 4.09Å; T99-L187 HydrophobicContact CG2-CD1 4.4Å; T99-L187 PolarHBondContact OG1-N 2.93Å; H183-L187 PolarHBondContact O-N 2.93Å; H183-L187 VanDerWaalsContact O-N 3.09Å; L184-L187 HydrophobicContact CD2-CD2 4.17Å; L184-L187 PolarHBondContact O-N 3Å; L185-L187 VanDerWaalsContact C-N 3.29Å; L185-L187 PolarHBondContact O-N 3.38Å; L187-E189 VanDerWaalsContact C-N 3.32Å; L187-T190 PolarHBondContact O-N 2.9Å; L187-T190 PolarHBondContact O-OG1 3.06Å; L187-G191 CarbonylContact O-C 3.59Å; L187-G191 VanDerWaalsContact O-CA 3.32Å; L187-G191 WeakPolarHBondContact O-CA 3.44Å; L187-G191 PolarHBondContact O-N 3.39Å
188	H	97.3	Very high	97.6	Very high	73 Å²	73	61.2 Å²	61.2	34%	0.338	35%	0.352	S	S	.	.	H	α-helix	trans	-73	-23	-179.6	-70.8	176.7	0	0	0	113.3	L184 L185 F186 T190	L184-H188 WeakPolarHBondContact O-CB 3.47Å; L184-H188 PolarHBondContact O-CD2 3.02Å; L184-H188 PolarHBondContact O-N 2.99Å; L185-H188 PolarHBondContact O-N 2.98Å; L185-H188 VanDerWaalsContact O-N 3.07Å; F186-H188 VanDerWaalsContact C-N 3.29Å; F186-H188 PolarHBondContact O-N 3.33Å; H188-T190 VanDerWaalsContact C-N 3.33Å
189	E	96.6	Very high	97.5	Very high	150 Å²	150	64.5 Å²	64.5	70%	0.701	36%	0.362	S	S	*	.	H	α-helix	trans	-63.9	-37.7	173	-65.1	-60.6	133.1	0	0	112	L185 F186 L187	L185-E189 PolarHBondContact O-N 3.03Å; F186-E189 PolarHBondContact O-N 2.88Å; L187-E189 VanDerWaalsContact C-N 3.32Å
190	T	94.9	Very high	97.4	Very high	72 Å²	72	63.4 Å²	63.4	44%	0.442	36%	0.358	S	S	.	.	H	α-helix	trans	-99.6	-24.8	-179.2	60.7	0	0	0	0	113.6	F96 L187 H188	F96-T190 HydrophobicContact CD1-CG2 4.21Å; F96-T190 HydrophobicContact CE1-CG2 4.43Å; L187-T190 PolarHBondContact O-N 2.9Å; L187-T190 PolarHBondContact O-OG1 3.06Å; H188-T190 VanDerWaalsContact C-N 3.33Å
191	G	95.9	Very high	97.3	Very high	13 Å²	13	66.8 Å²	66.8	13%	0.134	37%	0.372	C	S	.	.			trans	75.5	175.7	-162.4	0	0	0	0	0	112.8	L187	L187-G191 CarbonylContact O-C 3.59Å; L187-G191 VanDerWaalsContact O-CA 3.32Å; L187-G191 WeakPolarHBondContact O-CA 3.44Å; L187-G191 PolarHBondContact O-N 3.39Å
192	S	97.4	Very high	97.2	Very high	37 Å²	37	66.3 Å²	66.3	26%	0.259	39%	0.386	S	S	.	.			trans	-74.2	142.5	179.7	-72.1	0	0	0	0	112.6	P11	P11-S192 VanDerWaalsContact CG-O 3.3Å; P11-S192 WeakPolarHBondContact CG-O 3.41Å
193	N	97.9	Very high	97.1	Very high	19 Å²	19	68 Å²	68	10%	0.102	39%	0.393	C	S	.	.			trans	-68.2	173.7	161.3	-170.1	15.4	0	0	0	110.3	I14 W18 Y91 S93 F96	I14-N193 WeakPolarHBondContact CG2-O 3.44Å; W18-N193 VanDerWaalsContact CE2-O 3.24Å; W18-N193 HydrophobicContact CZ2-CB 4.27Å; W18-N193 VanDerWaalsContact CZ2-O 3.23Å; W18-N193 WeakPolarHBondContact CZ2-O 3.27Å; W18-N193 PolarHBondContact NE1-O 3.25Å; Y91-N193 PolarHBondContact O-ND2 3.5Å; S93-N193 PolarHBondContact OG-ND2 3.23Å; F96-N193 HydrophobicContact CE2-CB 3.71Å; F96-N193 HydrophobicContact CZ-CB 4.05Å
194	N	98.4	Very high	97.1	Very high	3 Å²	3	70.2 Å²	70.2	2%	0.016	40%	0.402	C	S	.	.			trans	-143.6	169	177.6	76.3	85.5	0	0	0	113	P11 N13 I14 T196 G197 L198	P11-N194 HydrophobicContact CB-CB 3.78Å; P11-N194 HydrophobicContact CG-CB 4.08Å; N13-N194 PolarHBondContact ND2-OD1 3.35Å; N13-N194 VanDerWaalsContact ND2-OD1 3.12Å; N13-N194 WeakPolarHBondContact OD1-CB 3.26Å; I14-N194 HydrophobicContact CG2-CB 4.04Å; N194-T196 PolarHBondContact O-N 3.2Å; N194-T196 VanDerWaalsContact O-N 3.1Å; N194-T196 PolarHBondContact OD1-N 2.84Å; N194-T196 VanDerWaalsContact OD1-N 3.09Å; N194-T196 PolarHBondContact OD1-OG1 2.67Å; N194-G197 PolarHBondContact O-N 3.48Å; N194-L198 PolarHBondContact ND2-O 3.02Å
195	P	98.3	Very high	97.1	Very high	40 Å²	40	67.8 Å²	67.8	26%	0.26	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-22.6	-171.9	-29	37.9	0	0	0	116.7	N13 W18 Y91	N13-P195 VanDerWaalsContact O-CD 3.32Å; N13-P195 WeakPolarHBondContact O-CD 3.44Å; N13-P195 WeakPolarHBondContact O-CG 3.42Å; W18-P195 HydrophobicContact CH2-CG 4.34Å; W18-P195 HydrophobicContact CZ3-CG 4.07Å; Y91-P195 HydrophobicContact CD1-CB 4.3Å; Y91-P195 HydrophobicContact CE1-CB 3.71Å; Y91-P195 HydrophobicContact CE1-CG 4.44Å
196	T	97.4	Very high	97.1	Very high	86 Å²	86	66 Å²	66	53%	0.528	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-15.7	179.1	70.1	0	0	0	0	112.8	N194 L198	N194-T196 PolarHBondContact O-N 3.2Å; N194-T196 VanDerWaalsContact O-N 3.1Å; N194-T196 PolarHBondContact OD1-N 2.84Å; N194-T196 VanDerWaalsContact OD1-N 3.09Å; N194-T196 PolarHBondContact OD1-OG1 2.67Å; T196-L198 PolarHBondContact O-N 3.07Å; T196-L198 PolarHBondContact OG1-N 3.46Å
197	G	95.4	Very high	97.1	Very high	51 Å²	51	64 Å²	64	53%	0.526	37%	0.374	S	S	.	.			trans	69.1	3.4	-173.4	0	0	0	0	0	114.7	N194	N194-G197 PolarHBondContact O-N 3.48Å
198	L	95.8	Very high	97	Very high	125 Å²	125	66.9 Å²	66.9	65%	0.654	39%	0.387	S	S	*	.	S	Bend	trans	-88.2	159.6	177.3	-58.5	178.2	0	0	0	111.2	N194 T196 S200	N194-L198 PolarHBondContact ND2-O 3.02Å; T196-L198 PolarHBondContact O-N 3.07Å; T196-L198 PolarHBondContact OG1-N 3.46Å; L198-S200 PolarHBondContact O-N 3.43Å
199	N	96.2	Very high	97.1	Very high	124 Å²	124	66.6 Å²	66.6	66%	0.663	39%	0.391	S	S	*	.			trans	-60.4	130.7	172.1	-174.4	-26.7	0	0	0	109.9	D201	N199-D201 PolarHBondContact ND2-OD2 3.34Å; N199-D201 VanDerWaalsContact OD1-CB 3.23Å; N199-D201 WeakPolarHBondContact OD1-CB 3.45Å; N199-D201 PolarHBondContact OD1-N 3.44Å; N199-D201 PolarHBondContact OD1-OD2 2.93Å; N199-D201 VanDerWaalsContact OD1-OD2 3.05Å
200	S	96.4	Very high	97.2	Very high	19 Å²	19	65.6 Å²	65.6	13%	0.133	38%	0.382	C	S	.	.			trans	-105.8	6.5	-177.2	57.9	0	0	0	0	114.4	P11 L198 A202 D203 K204	P11-S200 WeakPolarHBondContact CB-OG 3.38Å; P11-S200 WeakPolarHBondContact CG-OG 3.36Å; L198-S200 PolarHBondContact O-N 3.43Å; S200-A202 PolarHBondContact O-N 3.04Å; S200-A202 VanDerWaalsContact O-N 3.12Å; S200-D203 CarbonylContact O-C 3.59Å; S200-D203 VanDerWaalsContact O-C 3.24Å; S200-D203 PolarHBondContact O-N 3.48Å; S200-K204 WeakPolarHBondContact O-CG 3.42Å
201	D	96.6	Very high	97.3	Very high	100 Å²	100	62.8 Å²	62.8	54%	0.535	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-29.1	-177.6	-68.7	-25.4	0	0	0	113.2	N199 D203 K204	N199-D201 PolarHBondContact ND2-OD2 3.34Å; N199-D201 VanDerWaalsContact OD1-CB 3.23Å; N199-D201 WeakPolarHBondContact OD1-CB 3.45Å; N199-D201 PolarHBondContact OD1-N 3.44Å; N199-D201 PolarHBondContact OD1-OD2 2.93Å; N199-D201 VanDerWaalsContact OD1-OD2 3.05Å; D201-D203 VanDerWaalsContact C-N 3.26Å; D201-D203 PolarHBondContact O-N 3.48Å; D201-K204 WeakPolarHBondContact OD1-CE 3.36Å; D201-K204 IonicContact OD1-NZ 2.66Å; D201-K204 PolarHBondContact OD1-NZ 3.11Å
202	A	96.2	Very high	97.4	Very high	108 Å²	108	62.9 Å²	62.9	89%	0.893	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-18.2	175.9	0	0	0	0	0	113.8	S200	S200-A202 PolarHBondContact O-N 3.04Å; S200-A202 VanDerWaalsContact O-N 3.12Å
203	D	97.4	Very high	97.5	Very high	92 Å²	92	66.2 Å²	66.2	49%	0.492	38%	0.376	S	S	.	.	S	Bend	trans	-145	71.6	-177	-172.7	25.9	0	0	0	111.7	S12 S200 D201	S12-D203 VanDerWaalsContact CB-OD2 3.3Å; S12-D203 WeakPolarHBondContact CB-OD2 3.37Å; S12-D203 PolarHBondContact N-O 3.03Å; S12-D203 VanDerWaalsContact OG-CG 3.28Å; S12-D203 PolarHBondContact OG-OD2 3.32Å; S200-D203 CarbonylContact O-C 3.59Å; S200-D203 VanDerWaalsContact O-C 3.24Å; S200-D203 PolarHBondContact O-N 3.48Å; D201-D203 VanDerWaalsContact C-N 3.26Å; D201-D203 PolarHBondContact O-N 3.48Å
204	K	97.8	Very high	97.5	Very high	74 Å²	74	67.5 Å²	67.5	32%	0.322	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	144.3	171.1	-65.6	-168.7	-179.3	166.5	0	111.1	P9 A10 S200 D201	P9-K204 HydrophobicContact CB-CB 4.13Å; P9-K204 HydrophobicContact CB-CD 3.57Å; P9-K204 HydrophobicContact CB-CG 4.46Å; A10-K204 WeakPolarHBondContact O-CA 3.36Å; S200-K204 WeakPolarHBondContact O-CG 3.42Å; D201-K204 WeakPolarHBondContact OD1-CE 3.36Å; D201-K204 IonicContact OD1-NZ 2.66Å; D201-K204 PolarHBondContact OD1-NZ 3.11Å
205	I	98.1	Very high	97.5	Very high	34 Å²	34	68.4 Å²	68.4	17%	0.174	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	153.1	172.9	61.3	178.5	0	0	0	109.5	A10 Y210 Y211	A10-I205 PolarHBondContact N-O 2.98Å; A10-I205 PolarHBondContact O-N 3.46Å; I205-Y210 HydrophobicContact CB-CD2 4.16Å; I205-Y210 HydrophobicContact CB-CE2 4.27Å; I205-Y210 HydrophobicContact CD1-CD1 4.23Å; I205-Y210 HydrophobicContact CD1-CD2 3.93Å; I205-Y210 HydrophobicContact CD1-CG 3.73Å; I205-Y210 HydrophobicContact CG1-CD2 4.29Å; I205-Y211 HydrophobicContact CD1-CE2 3.84Å; I205-Y211 HydrophobicContact CG1-CE2 3.92Å
206	P	97.8	Very high	97.5	Very high	58 Å²	58	70.9 Å²	70.9	38%	0.377	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	146.2	173.1	28.7	-35.7	0	0	0	110.2	H208 Y210	P206-H208 VanDerWaalsContact C-N 3.33Å; P206-H208 WeakPolarHBondContact CB-O 3.13Å; P206-H208 WeakPolarHBondContact CG-O 3.47Å; P206-H208 PolarHBondContact O-N 2.77Å; P206-Y210 HydrophobicContact CG-CD2 4.31Å; P206-Y210 HydrophobicContact CG-CE2 4.14Å; P206-Y210 WeakPolarHBondContact O-CD2 3.36Å
207	F	98.2	Very high	97.5	Very high	30 Å²	30	71.8 Å²	71.8	13%	0.132	40%	0.396	C	S	.	.	S	Bend	trans	-63.5	-40.6	179.6	-171.3	-83	0	0	0	112	F5 I6 L8 A10 P209 Y210 Y211 T212	F5-F207 HydrophobicContact CD2-CE1 4.23Å; F5-F207 AromaticContact CE2-CE1 3.94Å; F5-F207 HydrophobicContact CE2-CE1 3.94Å; F5-F207 HydrophobicContact CZ-CE1 4.32Å; F5-F207 WeakPolarHBondContact O-CB 3.45Å; F5-F207 WeakPolarHBondContact O-CD1 3.5Å; I6-F207 PolarHBondContact O-N 3.29Å; L8-F207 HydrophobicContact CB-CB 3.96Å; L8-F207 HydrophobicContact CD2-CD2 4.25Å; L8-F207 WeakPolarHBondContact O-CB 3.48Å; L8-F207 PolarHBondContact O-N 2.61Å; A10-F207 HydrophobicContact CB-CD2 4.47Å; F207-P209 CarbonylContact O-C 3.36Å; F207-Y210 PolarHBondContact O-N 3.18Å; F207-Y211 AromaticContact CD2-CD2 3.99Å; F207-Y211 HydrophobicContact CD2-CD2 3.99Å; F207-Y211 HydrophobicContact CD2-CG 4.13Å; F207-Y211 HydrophobicContact CE2-CD2 4.42Å; F207-Y211 HydrophobicContact CE2-CG 4.14Å; F207-Y211 PolarHBondContact O-N 3.28Å; F207-T212 HydrophobicContact CD1-CG2 3.69Å; F207-T212 HydrophobicContact CE1-CG2 3.77Å; F207-T212 PolarHBondContact O-N 3.44Å
208	H	97.9	Very high	97.7	Very high	96 Å²	96	70 Å²	70	44%	0.444	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	133.8	168.6	-174.8	71.3	0	0	0	110.9	I6 P206 T212	I6-H208 HydrophobicContact CG2-CB 4.06Å; I6-H208 PolarHBondContact O-N 3.41Å; I6-H208 VanDerWaalsContact O-N 3.07Å; P206-H208 VanDerWaalsContact C-N 3.33Å; P206-H208 WeakPolarHBondContact CB-O 3.13Å; P206-H208 WeakPolarHBondContact CG-O 3.47Å; P206-H208 PolarHBondContact O-N 2.77Å; H208-T212 HydrophobicContact CB-CG2 3.94Å; H208-T212 PolarHBondContact ND1-OG1 3.39Å
209	P	98	Very high	97.8	Very high	67 Å²	67	65.8 Å²	65.8	44%	0.435	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	cis	-88.2	-14.7	2.4	34.5	-35.4	0	0	0	114.8	F207 Y211 T212 I213	F207-P209 CarbonylContact O-C 3.36Å; P209-Y211 PolarHBondContact O-N 3.09Å; P209-T212 VanDerWaalsContact C-OG1 3.31Å; P209-T212 WeakPolarHBondContact CA-OG1 3.42Å; P209-T212 PolarHBondContact O-N 2.93Å; P209-T212 PolarHBondContact O-OG1 3.2Å; P209-I213 WeakPolarHBondContact O-CG2 3.22Å; P209-I213 PolarHBondContact O-N 2.72Å
210	Y	98.3	Very high	97.9	Very high	129 Å²	129	65.2 Å²	65.2	51%	0.506	35%	0.352	S	S	.	.	H	α-helix	trans	-57.3	-54.8	-163.2	-61.2	-80.6	0	0	0	114.3	I205 P206 F207 I213 K214	I205-Y210 HydrophobicContact CB-CD2 4.16Å; I205-Y210 HydrophobicContact CB-CE2 4.27Å; I205-Y210 HydrophobicContact CD1-CD1 4.23Å; I205-Y210 HydrophobicContact CD1-CD2 3.93Å; I205-Y210 HydrophobicContact CD1-CG 3.73Å; I205-Y210 HydrophobicContact CG1-CD2 4.29Å; P206-Y210 HydrophobicContact CG-CD2 4.31Å; P206-Y210 HydrophobicContact CG-CE2 4.14Å; P206-Y210 WeakPolarHBondContact O-CD2 3.36Å; F207-Y210 PolarHBondContact O-N 3.18Å; Y210-I213 WeakPolarHBondContact O-CG2 3.32Å; Y210-K214 WeakPolarHBondContact O-CB 3.4Å; Y210-K214 PolarHBondContact O-N 2.93Å
211	Y	98.3	Very high	98	Very high	13 Å²	13	68.5 Å²	68.5	5%	0.051	37%	0.367	C	S	.	.	H	α-helix	trans	-83.6	-25.6	-179.3	-65.7	-57.3	0	0	0	112.5	A10 P11 S12 I14 I205 F207 P209 K214 D215	A10-Y211 HydrophobicContact CB-CD2 3.56Å; A10-Y211 HydrophobicContact CB-CE2 3.4Å; P11-Y211 PolarHBondContact O-OH 3.45Å; S12-Y211 PolarHBondContact O-OH 3.44Å; I14-Y211 HydrophobicContact CD1-CD1 3.88Å; I14-Y211 HydrophobicContact CD1-CD2 4.28Å; I14-Y211 HydrophobicContact CD1-CE1 3.56Å; I14-Y211 HydrophobicContact CD1-CE2 3.95Å; I14-Y211 HydrophobicContact CD1-CG 4.27Å; I14-Y211 HydrophobicContact CG1-CD1 4.06Å; I14-Y211 HydrophobicContact CG1-CE1 3.25Å; I14-Y211 HydrophobicContact CG1-CE2 4.05Å; I14-Y211 WeakPolarHBondContact CG1-OH 3.16Å; I205-Y211 HydrophobicContact CD1-CE2 3.84Å; I205-Y211 HydrophobicContact CG1-CE2 3.92Å; F207-Y211 AromaticContact CD2-CD2 3.99Å; F207-Y211 HydrophobicContact CD2-CD2 3.99Å; F207-Y211 HydrophobicContact CD2-CG 4.13Å; F207-Y211 HydrophobicContact CE2-CD2 4.42Å; F207-Y211 HydrophobicContact CE2-CG 4.14Å; F207-Y211 PolarHBondContact O-N 3.28Å; P209-Y211 PolarHBondContact O-N 3.09Å; Y211-K214 HydrophobicContact CD1-CD 3.82Å; Y211-K214 HydrophobicContact CE1-CD 4.09Å; Y211-K214 PolarHBondContact O-N 3.46Å; Y211-D215 VanDerWaalsContact O-CB 3.26Å; Y211-D215 WeakPolarHBondContact O-CB 3.26Å; Y211-D215 PolarHBondContact O-N 2.92Å
212	T	98.1	Very high	98	Very high	15 Å²	15	64 Å²	64	9%	0.092	34%	0.343	C	S	.	.	H	α-helix	trans	-60.5	-46.8	171.9	58.7	0	0	0	0	112.5	F5 F207 H208 P209 D215 I216	F5-T212 HydrophobicContact CD1-CG2 4.41Å; F5-T212 HydrophobicContact CE1-CG2 3.64Å; F5-T212 HydrophobicContact CZ-CG2 3.79Å; F207-T212 HydrophobicContact CD1-CG2 3.69Å; F207-T212 HydrophobicContact CE1-CG2 3.77Å; F207-T212 PolarHBondContact O-N 3.44Å; H208-T212 HydrophobicContact CB-CG2 3.94Å; H208-T212 PolarHBondContact ND1-OG1 3.39Å; P209-T212 VanDerWaalsContact C-OG1 3.31Å; P209-T212 WeakPolarHBondContact CA-OG1 3.42Å; P209-T212 PolarHBondContact O-N 2.93Å; P209-T212 PolarHBondContact O-OG1 3.2Å; T212-D215 PolarHBondContact O-N 2.93Å; T212-I216 WeakPolarHBondContact O-CD1 3.49Å; T212-I216 VanDerWaalsContact O-CG1 3.26Å; T212-I216 WeakPolarHBondContact O-CG1 3.41Å; T212-I216 PolarHBondContact O-N 3.39Å
213	I	98.4	Very high	97.9	Very high	108 Å²	108	62.6 Å²	62.6	55%	0.554	32%	0.317	S	S	*	.	H	α-helix	trans	-71.1	-36.5	179.2	-168.4	60.4	0	0	0	111.9	P209 Y210 I216 L217	P209-I213 WeakPolarHBondContact O-CG2 3.22Å; P209-I213 PolarHBondContact O-N 2.72Å; Y210-I213 WeakPolarHBondContact O-CG2 3.32Å; I213-I216 PolarHBondContact O-N 2.75Å; I213-L217 PolarHBondContact O-N 3.32Å
214	K	98.4	Very high	97.8	Very high	45 Å²	45	64.6 Å²	64.6	20%	0.196	33%	0.327	C	S	.	.	H	α-helix	trans	-64.1	-41.7	176.2	-168	-165.6	174.8	-163.3	0	111.6	I14 S15 N19 Y210 Y211 L217 G218	I14-K214 PolarHBondContact O-NZ 2.99Å; S15-K214 PolarHBondContact O-NZ 3.25Å; N19-K214 PolarHBondContact ND2-O 3.26Å; N19-K214 WeakPolarHBondContact OD1-CE 3.48Å; N19-K214 PolarHBondContact OD1-NZ 3.45Å; Y210-K214 WeakPolarHBondContact O-CB 3.4Å; Y210-K214 PolarHBondContact O-N 2.93Å; Y211-K214 HydrophobicContact CD1-CD 3.82Å; Y211-K214 HydrophobicContact CE1-CD 4.09Å; Y211-K214 PolarHBondContact O-N 3.46Å; K214-L217 PolarHBondContact O-N 3.25Å; K214-G218 PolarHBondContact O-N 3.14Å
215	D	98.3	Very high	97.6	Very high	23 Å²	23	66.6 Å²	66.6	12%	0.123	34%	0.34	C	S	.	.	H	α-helix	trans	-67	-42.7	175.9	-82.2	-11	0	0	0	111.6	N19 S22 Y211 T212 L217 G218 I219	N19-D215 PolarHBondContact ND2-OD1 3.19Å; S22-D215 VanDerWaalsContact CB-OD2 3.31Å; S22-D215 WeakPolarHBondContact CB-OD2 3.41Å; S22-D215 PolarHBondContact OG-OD1 3.22Å; S22-D215 PolarHBondContact OG-OD2 3.14Å; Y211-D215 VanDerWaalsContact O-CB 3.26Å; Y211-D215 WeakPolarHBondContact O-CB 3.26Å; Y211-D215 PolarHBondContact O-N 2.92Å; T212-D215 PolarHBondContact O-N 2.93Å; D215-L217 VanDerWaalsContact C-N 3.28Å; D215-L217 PolarHBondContact O-N 3.48Å; D215-G218 PolarHBondContact O-N 3.33Å; D215-G218 VanDerWaalsContact O-N 3.1Å; D215-I219 VanDerWaalsContact O-CG1 3.22Å; D215-I219 WeakPolarHBondContact O-CG1 3.46Å; D215-I219 PolarHBondContact O-N 2.93Å
216	I	98.5	Very high	97.1	Very high	92 Å²	92	65.8 Å²	65.8	47%	0.472	34%	0.336	S	S	.	.	H	α-helix	trans	-56.6	-44.5	174	-70.6	164.9	0	0	0	110.7	T212 I213 G218 I219 L220	T212-I216 WeakPolarHBondContact O-CD1 3.49Å; T212-I216 VanDerWaalsContact O-CG1 3.26Å; T212-I216 WeakPolarHBondContact O-CG1 3.41Å; T212-I216 PolarHBondContact O-N 3.39Å; I213-I216 PolarHBondContact O-N 2.75Å; I216-G218 PolarHBondContact O-N 2.96Å; I216-I219 PolarHBondContact O-N 2.96Å; I216-L220 HydrophobicContact CG2-CD1 4.25Å; I216-L220 WeakPolarHBondContact O-CG 3.47Å; I216-L220 PolarHBondContact O-N 3.3Å
217	L	98.4	Very high	95.7	Very high	104 Å²	104	70.7 Å²	70.7	55%	0.545	36%	0.356	S	S	.	.	H	α-helix	trans	-60.1	-45.7	175.3	177.6	62.4	0	0	0	111.9	I213 K214 D215 I219 L220 I221	I213-L217 PolarHBondContact O-N 3.32Å; K214-L217 PolarHBondContact O-N 3.25Å; D215-L217 VanDerWaalsContact C-N 3.28Å; D215-L217 PolarHBondContact O-N 3.48Å; L217-I219 VanDerWaalsContact C-N 3.3Å; L217-I219 PolarHBondContact O-N 3.41Å; L217-L220 PolarHBondContact O-N 3.22Å; L217-I221 HydrophobicContact CD1-CD1 4.2Å; L217-I221 HydrophobicContact CD1-CG1 4.47Å; L217-I221 HydrophobicContact CG-CD1 4.09Å; L217-I221 WeakPolarHBondContact O-CG1 3.19Å; L217-I221 PolarHBondContact O-N 2.78Å
218	G	98.3	Very high	95.6	Very high	14 Å²	14	72.8 Å²	72.8	14%	0.144	37%	0.367	C	S	.	.	H	α-helix	trans	-59.1	-41.6	176.2	0	0	0	0	0	112.6	K214 D215 I216 I221 M222	K214-G218 PolarHBondContact O-N 3.14Å; D215-G218 PolarHBondContact O-N 3.33Å; D215-G218 VanDerWaalsContact O-N 3.1Å; I216-G218 PolarHBondContact O-N 2.96Å; G218-I221 PolarHBondContact O-N 3.4Å; G218-M222 WeakPolarHBondContact O-CB 3.28Å; G218-M222 PolarHBondContact O-N 3.16Å
219	I	98.2	Very high	95.4	Very high	36 Å²	36	71.5 Å²	71.5	19%	0.185	36%	0.363	C	S	.	.	H	α-helix	trans	-63.3	-44.7	177.8	-68.3	168.8	0	0	0	110.8	L23 I26 D215 I216 L217 I221 M222 F223	L23-I219 HydrophobicContact CD2-CB 4.46Å; L23-I219 HydrophobicContact CD2-CG1 3.84Å; I26-I219 HydrophobicContact CD1-CD1 3.91Å; I26-I219 HydrophobicContact CG1-CD1 3.67Å; I26-I219 HydrophobicContact CG1-CG1 3.8Å; D215-I219 VanDerWaalsContact O-CG1 3.22Å; D215-I219 WeakPolarHBondContact O-CG1 3.46Å; D215-I219 PolarHBondContact O-N 2.93Å; I216-I219 PolarHBondContact O-N 2.96Å; L217-I219 VanDerWaalsContact C-N 3.3Å; L217-I219 PolarHBondContact O-N 3.41Å; I219-I221 VanDerWaalsContact C-N 3.34Å; I219-I221 PolarHBondContact O-N 3.4Å; I219-M222 PolarHBondContact O-N 2.96Å; I219-F223 HydrophobicContact CG2-CD2 3.58Å; I219-F223 HydrophobicContact CG2-CE2 3.48Å; I219-F223 VanDerWaalsContact CG2-CE2 3.48Å; I219-F223 VanDerWaalsContact O-CD2 3.26Å; I219-F223 WeakPolarHBondContact O-CD2 3.43Å; I219-F223 PolarHBondContact O-N 3.04Å
220	L	98.1	Very high	95.3	Very high	113 Å²	113	71.8 Å²	71.8	59%	0.592	36%	0.359	S	S	*	.	H	α-helix	trans	-60.8	-43.1	176.9	-69.8	172.2	0	0	0	111.8	I216 L217 F223 L224	I216-L220 HydrophobicContact CG2-CD1 4.25Å; I216-L220 WeakPolarHBondContact O-CG 3.47Å; I216-L220 PolarHBondContact O-N 3.3Å; L217-L220 PolarHBondContact O-N 3.22Å; L220-F223 PolarHBondContact O-N 3.24Å; L220-L224 PolarHBondContact O-N 3.06Å
221	I	97.8	Very high	95.1	Very high	87 Å²	87	68.4 Å²	68.4	45%	0.446	35%	0.35	S	S	.	.	H	α-helix	trans	-64	-43.6	176.3	-65.6	166.7	0	0	0	110.7	L217 G218 I219 F223 L224 I225	L217-I221 HydrophobicContact CD1-CD1 4.2Å; L217-I221 HydrophobicContact CD1-CG1 4.47Å; L217-I221 HydrophobicContact CG-CD1 4.09Å; L217-I221 WeakPolarHBondContact O-CG1 3.19Å; L217-I221 PolarHBondContact O-N 2.78Å; G218-I221 PolarHBondContact O-N 3.4Å; I219-I221 VanDerWaalsContact C-N 3.34Å; I219-I221 PolarHBondContact O-N 3.4Å; I221-F223 PolarHBondContact O-N 2.98Å; I221-L224 WeakPolarHBondContact O-CB 3.46Å; I221-L224 PolarHBondContact O-N 3.4Å; I221-I225 HydrophobicContact CG2-CD1 4.01Å; I221-I225 WeakPolarHBondContact O-CG1 3.43Å; I221-I225 PolarHBondContact O-N 3.12Å; I221-I225 VanDerWaalsContact O-N 3.17Å
222	M	97.3	Very high	94.9	Very high	7 Å²	7	71.9 Å²	71.9	3%	0.034	37%	0.369	C	S	.	.	H	α-helix	trans	-60.6	-45	177.6	-175.3	-166	69.9	0	0	111.5	L23 I26 M76 G218 I219 L224 I225 L226	L23-M222 HydrophobicContact CB-SD 4.07Å; L23-M222 HydrophobicContact CD2-CB 4.03Å; L23-M222 HydrophobicContact CD2-SD 3.94Å; L23-M222 HydrophobicContact CG-SD 4.44Å; I26-M222 HydrophobicContact CB-CE 4.07Å; I26-M222 HydrophobicContact CG2-CE 3.58Å; M76-M222 HydrophobicContact CE-CG 4.05Å; M76-M222 HydrophobicContact CG-CG 3.81Å; M76-M222 HydrophobicContact CG-SD 4.07Å; M76-M222 HydrophobicContact SD-CG 3.84Å; G218-M222 WeakPolarHBondContact O-CB 3.28Å; G218-M222 PolarHBondContact O-N 3.16Å; I219-M222 PolarHBondContact O-N 2.96Å; M222-L224 VanDerWaalsContact C-N 3.31Å; M222-L224 PolarHBondContact O-N 3.38Å; M222-I225 PolarHBondContact O-N 3.16Å; M222-L226 WeakPolarHBondContact O-CB 3.16Å; M222-L226 PolarHBondContact O-N 3.29Å
223	F	95.2	Very high	94.7	Very high	77 Å²	77	75.7 Å²	75.7	34%	0.338	39%	0.387	S	S	.	.	H	α-helix	trans	-65.5	-33.4	177.2	-82.2	-63.2	0	0	0	113	I26 V30 I219 L220 I221 I225 L226 M227	I26-F223 HydrophobicContact CG2-CE2 4.03Å; I26-F223 HydrophobicContact CG2-CZ 3.89Å; V30-F223 HydrophobicContact CG2-CE1 4.11Å; V30-F223 HydrophobicContact CG2-CZ 4Å; I219-F223 HydrophobicContact CG2-CD2 3.58Å; I219-F223 HydrophobicContact CG2-CE2 3.48Å; I219-F223 VanDerWaalsContact CG2-CE2 3.48Å; I219-F223 VanDerWaalsContact O-CD2 3.26Å; I219-F223 WeakPolarHBondContact O-CD2 3.43Å; I219-F223 PolarHBondContact O-N 3.04Å; L220-F223 PolarHBondContact O-N 3.24Å; I221-F223 PolarHBondContact O-N 2.98Å; F223-I225 VanDerWaalsContact C-N 3.27Å; F223-I225 PolarHBondContact O-N 3.47Å; F223-L226 HydrophobicContact CD1-CD2 4.12Å; F223-L226 HydrophobicContact CE1-CD2 4.24Å; F223-L226 PolarHBondContact O-N 2.97Å; F223-M227 VanDerWaalsContact O-CG 3.31Å; F223-M227 WeakPolarHBondContact O-CG 3.4Å; F223-M227 PolarHBondContact O-N 2.84Å
224	L	95.3	Very high	94.5	Very high	135 Å²	135	73.4 Å²	73.4	71%	0.707	38%	0.376	S	S	*	.	H	α-helix	trans	-63.3	-33.6	173.4	-178.8	65.7	0	0	0	112.5	L220 I221 M222	L220-L224 PolarHBondContact O-N 3.06Å; I221-L224 WeakPolarHBondContact O-CB 3.46Å; I221-L224 PolarHBondContact O-N 3.4Å; M222-L224 VanDerWaalsContact C-N 3.31Å; M222-L224 PolarHBondContact O-N 3.38Å
225	I	93.3	Very high	94.1	Very high	115 Å²	115	75.5 Å²	75.5	59%	0.59	39%	0.389	S	S	*	.	H	α-helix	trans	-83.7	-28.9	178.6	-60.5	165.5	0	0	0	111.6	M76 I221 M222 F223	M76-I225 HydrophobicContact CE-CB 3.79Å; M76-I225 HydrophobicContact CE-CG2 3.62Å; I221-I225 HydrophobicContact CG2-CD1 4.01Å; I221-I225 WeakPolarHBondContact O-CG1 3.43Å; I221-I225 PolarHBondContact O-N 3.12Å; I221-I225 VanDerWaalsContact O-N 3.17Å; M222-I225 PolarHBondContact O-N 3.16Å; F223-I225 VanDerWaalsContact C-N 3.27Å; F223-I225 PolarHBondContact O-N 3.47Å
226	L	86.6	Confident	93.8	Very high	17 Å²	17	79.9 Å²	79.9	9%	0.089	41%	0.412	C	S	.	.	H	α-helix	trans	-73.5	-28.9	-178.8	-178	63.5	0	0	0	113.1	N72 M76 M222 F223	N72-L226 HydrophobicContact CB-CD1 4.04Å; M76-L226 HydrophobicContact CB-CD1 4.07Å; M76-L226 HydrophobicContact CE-CB 4.33Å; M222-L226 WeakPolarHBondContact O-CB 3.16Å; M222-L226 PolarHBondContact O-N 3.29Å; F223-L226 HydrophobicContact CD1-CD2 4.12Å; F223-L226 HydrophobicContact CE1-CD2 4.24Å; F223-L226 PolarHBondContact O-N 2.97Å
227	M	68.6	Low	93.4	Very high	162 Å²	162	78.8 Å²	78.8	80%	0.798	41%	0.406	S	S	*	.			trans	-85.8	0	177.4	-66.5	-100.5	114.1	0	0	111.2	L65 M69 F223	L65-M227 HydrophobicContact CD1-CE 4.17Å; M69-M227 HydrophobicContact CG-CE 3.92Å; M69-M227 HydrophobicContact SD-CE 3.71Å; F223-M227 VanDerWaalsContact O-CG 3.31Å; F223-M227 WeakPolarHBondContact O-CG 3.4Å; F223-M227 PolarHBondContact O-N 2.84Å

Retrieved 227 of 227 residues in 225.4 ms (Link to these results)

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