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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 A0A023NDP5, 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	88	Confident	94.1	Very high	157 Å²	157	74.3 Å²	74.3	81%	0.805	39%	0.388	S	S	*	.				0	-69.4	0	-58	-179.7	0	0	0	110.2	H3 S4 F5 I6	I1-H3 PolarHBondContact O-N 3Å; I1-S4 PolarHBondContact N-OG 2.92Å; I1-S4 PolarHBondContact O-N 2.73Å; I1-S4 PolarHBondContact O-OG 3.33Å; I1-F5 WeakPolarHBondContact O-CB 3.43Å; I1-F5 PolarHBondContact O-N 3.45Å; I1-I6 HydrophobicContact CG2-CD1 4.4Å
2	N	92.7	Very high	94.4	Very high	88 Å²	88	71.6 Å²	71.6	47%	0.471	38%	0.381	S	S	.	.	I	π-helix	trans	-56.6	-57.6	-176.7	-68.7	14.2	0	0	0	113.4	S4 F5 I6 D7	N2-S4 PolarHBondContact O-N 3.28Å; N2-F5 PolarHBondContact O-N 3.42Å; N2-I6 PolarHBondContact O-N 3.01Å; N2-D7 PolarHBondContact O-N 3.06Å
3	H	91.2	Very high	94.7	Very high	163 Å²	163	71 Å²	71	76%	0.755	38%	0.378	S	S	*	.	I	π-helix	trans	-65.9	-22	-178.5	-61.2	-64.2	0	0	0	115.2	I1	I1-H3 PolarHBondContact O-N 3Å
4	S	88.2	Confident	95	Very high	52 Å²	52	67.1 Å²	67.1	36%	0.364	36%	0.357	S	S	.	.	I	π-helix	trans	-103	-5	-173.7	61.5	0	0	0	0	113.4	I1 N2	I1-S4 PolarHBondContact N-OG 2.92Å; I1-S4 PolarHBondContact O-N 2.73Å; I1-S4 PolarHBondContact O-OG 3.33Å; N2-S4 PolarHBondContact O-N 3.28Å
5	F	92	Very high	95.2	Very high	105 Å²	105	65 Å²	65	46%	0.461	35%	0.35	S	S	.	.	I	π-helix	trans	-154.4	-41.9	-171	-168.1	-97.5	0	0	0	114.5	I1 N2 F207 T212	I1-F5 WeakPolarHBondContact O-CB 3.43Å; I1-F5 PolarHBondContact O-N 3.45Å; N2-F5 PolarHBondContact O-N 3.42Å; F5-F207 HydrophobicContact CD2-CD1 4.47Å; F5-F207 HydrophobicContact CD2-CE1 4.16Å; F5-F207 HydrophobicContact CE2-CD1 4.49Å; F5-F207 AromaticContact CE2-CE1 3.85Å; F5-F207 HydrophobicContact CE2-CE1 3.85Å; F5-F207 HydrophobicContact CZ-CE1 4.19Å; F5-F207 WeakPolarHBondContact O-CB 3.44Å; F5-F207 WeakPolarHBondContact O-CD1 3.26Å; F5-T212 HydrophobicContact CD1-CG2 4.4Å; F5-T212 HydrophobicContact CE1-CG2 3.59Å; F5-T212 HydrophobicContact CZ-CG2 3.72Å
6	I	95.9	Very high	95.4	Very high	59 Å²	59	66.4 Å²	66.4	30%	0.303	37%	0.366	S	S	.	.	I	π-helix	trans	-86.4	-61	-176.5	-56.8	-178.3	0	0	0	109.5	I1 N2 L8 F207 H208	I1-I6 HydrophobicContact CG2-CD1 4.4Å; N2-I6 PolarHBondContact O-N 3.01Å; I6-L8 VanDerWaalsContact C-N 3.33Å; I6-F207 PolarHBondContact O-N 3.28Å; I6-H208 HydrophobicContact CG2-CB 4.08Å; I6-H208 PolarHBondContact O-N 3.42Å
7	D	96.2	Very high	95.6	Very high	88 Å²	88	69.2 Å²	69.2	47%	0.471	37%	0.37	S	S	.	.	S	Bend	trans	-94.4	8.7	-172.7	-54.6	-42.6	0	0	0	112.4	N2 P9	N2-D7 PolarHBondContact O-N 3.06Å; D7-P9 WeakPolarHBondContact O-CD 3.41Å; D7-P9 VanDerWaalsContact O-N 3.16Å
8	L	97.1	Very high	95.7	Very high	28 Å²	28	66.7 Å²	66.7	15%	0.147	35%	0.354	C	S	.	.			trans	-60.1	115.4	-176.6	176.6	66.8	0	0	0	110.4	I6 T10 F207	I6-L8 VanDerWaalsContact C-N 3.33Å; L8-T10 PolarHBondContact O-N 2.97Å; L8-T10 PolarHBondContact O-OG1 3.27Å; L8-T10 VanDerWaalsContact O-OG1 3.1Å; L8-F207 HydrophobicContact CB-CB 3.92Å; L8-F207 HydrophobicContact CD2-CD2 4.29Å; L8-F207 WeakPolarHBondContact O-CB 3.4Å; L8-F207 PolarHBondContact O-N 2.94Å
9	P	97.6	Very high	95.9	Very high	73 Å²	73	63.7 Å²	63.7	47%	0.474	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	116.6	179.9	-20.2	34.3	0	0	0	110.7	D7 K204	D7-P9 WeakPolarHBondContact O-CD 3.41Å; D7-P9 VanDerWaalsContact O-N 3.16Å; P9-K204 HydrophobicContact CB-CB 4.16Å; P9-K204 HydrophobicContact CB-CD 3.6Å; P9-K204 HydrophobicContact CB-CG 4.49Å
10	T	98.1	Very high	96	Very high	3 Å²	3	62.3 Å²	62.3	2%	0.018	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	140.4	-174.3	-52	0	0	0	0	109.9	L8 S12 I14 K204 I205 Y211	L8-T10 PolarHBondContact O-N 2.97Å; L8-T10 PolarHBondContact O-OG1 3.27Å; L8-T10 VanDerWaalsContact O-OG1 3.1Å; T10-S12 PolarHBondContact O-N 3.03Å; T10-I14 HydrophobicContact CG2-CD1 3.55Å; T10-I14 HydrophobicContact CG2-CG1 4.32Å; T10-K204 WeakPolarHBondContact O-CA 3.34Å; T10-I205 PolarHBondContact N-O 3.32Å; T10-I205 PolarHBondContact O-N 2.9Å; T10-Y211 HydrophobicContact CG2-CD2 3.47Å; T10-Y211 VanDerWaalsContact CG2-CD2 3.47Å; T10-Y211 HydrophobicContact CG2-CE2 3.26Å; T10-Y211 HydrophobicContact CG2-CG 4.36Å
11	P	98.4	Very high	96.1	Very high	1 Å²	1	60.9 Å²	60.9	1%	0.006	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.2	138.6	177.7	-17.9	26.5	0	0	0	110.7	N13 I14 S192 N194 S200 Y211	P11-N13 PolarHBondContact O-N 3.49Å; P11-I14 HydrophobicContact CB-CG2 4.08Å; P11-I14 HydrophobicContact CG-CG2 4.14Å; P11-S192 VanDerWaalsContact CG-O 3.27Å; P11-S192 WeakPolarHBondContact CG-O 3.42Å; P11-N194 HydrophobicContact CB-CB 3.78Å; P11-N194 HydrophobicContact CG-CB 4.1Å; P11-S200 WeakPolarHBondContact CB-OG 3.34Å; P11-S200 WeakPolarHBondContact CG-OG 3.35Å; P11-Y211 PolarHBondContact O-OH 2.76Å
12	S	98.2	Very high	96.6	Very high	42 Å²	42	55 Å²	55	29%	0.294	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-20.3	-175.8	66.4	0	0	0	0	114.7	T10 D203 Y211	T10-S12 PolarHBondContact O-N 3.03Å; S12-D203 VanDerWaalsContact CB-OD2 3.3Å; S12-D203 WeakPolarHBondContact CB-OD2 3.38Å; S12-D203 PolarHBondContact N-O 3.37Å; S12-D203 VanDerWaalsContact OG-CG 3.28Å; S12-D203 PolarHBondContact OG-OD2 3.04Å; S12-Y211 PolarHBondContact O-OH 3.45Å
13	N	98.3	Very high	96.9	Very high	64 Å²	64	51.4 Å²	51.4	34%	0.342	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.8	15.7	-165.1	69.1	-26.2	0	0	0	114.8	P11 S15 N194 P195	P11-N13 PolarHBondContact O-N 3.49Å; N13-S15 PolarHBondContact O-N 3.39Å; N13-N194 PolarHBondContact ND2-OD1 3.41Å; N13-N194 VanDerWaalsContact ND2-OD1 3.14Å; N13-N194 WeakPolarHBondContact OD1-CB 3.5Å; N13-P195 VanDerWaalsContact O-CD 3.3Å; N13-P195 WeakPolarHBondContact O-CD 3.46Å; N13-P195 WeakPolarHBondContact O-CG 3.44Å
14	I	98.1	Very high	97.3	Very high	16 Å²	16	44.7 Å²	44.7	8%	0.082	25%	0.252	C	S	.	.			trans	-68.9	128.6	178.3	57.6	168.7	0	0	0	111.5	T10 P11 W18 N193 N194 Y211 K214	T10-I14 HydrophobicContact CG2-CD1 3.55Å; T10-I14 HydrophobicContact CG2-CG1 4.32Å; P11-I14 HydrophobicContact CB-CG2 4.08Å; P11-I14 HydrophobicContact CG-CG2 4.14Å; I14-W18 HydrophobicContact CB-CB 4.01Å; I14-W18 HydrophobicContact CB-CD2 3.75Å; I14-W18 HydrophobicContact CB-CE3 4.27Å; I14-W18 HydrophobicContact CB-CG 3.6Å; I14-W18 HydrophobicContact CD1-CB 3.81Å; I14-W18 HydrophobicContact CD1-CG 3.87Å; I14-W18 HydrophobicContact CG1-CB 4.28Å; I14-W18 HydrophobicContact CG1-CG 4.25Å; I14-W18 HydrophobicContact CG2-CD2 3.84Å; I14-W18 HydrophobicContact CG2-CG 3.88Å; I14-W18 HydrophobicContact CG2-CZ2 4.39Å; I14-N193 WeakPolarHBondContact CG2-O 3.44Å; I14-N194 HydrophobicContact CG2-CB 4.02Å; I14-Y211 HydrophobicContact CD1-CD1 3.85Å; I14-Y211 HydrophobicContact CD1-CD2 4.42Å; I14-Y211 HydrophobicContact CD1-CE1 3.54Å; I14-Y211 HydrophobicContact CD1-CE2 4.1Å; I14-Y211 HydrophobicContact CD1-CG 4.31Å; I14-Y211 HydrophobicContact CG1-CD1 4.06Å; I14-Y211 HydrophobicContact CG1-CE1 3.23Å; I14-Y211 HydrophobicContact CG1-CE2 4.14Å; I14-Y211 WeakPolarHBondContact CG1-OH 3.19Å; I14-K214 PolarHBondContact O-NZ 2.74Å
15	S	98.2	Very high	97.8	Very high	36 Å²	36	43.9 Å²	43.9	25%	0.252	25%	0.253	S	S	.	.			trans	-82.5	-177.7	-175.5	66.1	0	0	0	0	112.7	N13 W17 W18 K214	N13-S15 PolarHBondContact O-N 3.39Å; S15-W17 PolarHBondContact O-N 3.36Å; S15-W17 VanDerWaalsContact O-N 3.11Å; S15-W18 PolarHBondContact O-N 3.4Å; S15-W18 VanDerWaalsContact O-N 3.09Å; S15-K214 PolarHBondContact O-NZ 2.86Å
16	S	98.1	Very high	98.1	Very high	88 Å²	88	39.8 Å²	39.8	62%	0.615	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-60.1	-20.6	179.2	-54.9	0	0	0	0	113.8	W18 N19	S16-W18 PolarHBondContact O-N 3.37Å; S16-N19 VanDerWaalsContact CA-OD1 3.25Å; S16-N19 WeakPolarHBondContact CA-OD1 3.25Å; S16-N19 WeakPolarHBondContact O-CB 3.28Å; S16-N19 PolarHBondContact O-N 2.55Å; S16-N19 VanDerWaalsContact O-N 3.1Å; S16-N19 PolarHBondContact O-OD1 3.05Å; S16-N19 VanDerWaalsContact O-OD1 3.09Å
17	W	98.6	Very high	98.2	Very high	113 Å²	113	37.3 Å²	37.3	43%	0.428	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-62.2	-21.8	175.1	-64.1	109.2	0	0	0	113.4	S15 F20 L83 R87 Y91	S15-W17 PolarHBondContact O-N 3.36Å; S15-W17 VanDerWaalsContact O-N 3.11Å; W17-F20 HydrophobicContact CE3-CD2 4.28Å; W17-F20 AromaticContact CE3-CE2 3.83Å; W17-F20 HydrophobicContact CE3-CE2 3.83Å; W17-F20 HydrophobicContact CZ3-CE2 4.24Å; W17-L83 HydrophobicContact CH2-CD2 4.28Å; W17-L83 HydrophobicContact CZ3-CB 4.33Å; W17-L83 HydrophobicContact CZ3-CD2 3.74Å; W17-R87 HydrophobicContact CB-CB 4.12Å; W17-R87 HydrophobicContact CB-CG 3.6Å; W17-Y91 HydrophobicContact CB-CE2 4.41Å; W17-Y91 HydrophobicContact CG-CE2 4.4Å
18	W	98.7	Very high	98.4	Very high	24 Å²	24	34 Å²	34	9%	0.091	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-77.7	-19	175.9	-89.5	-114	0	0	0	113.8	I14 S15 S16 F20 G21 R87 Y91 N193 P195	I14-W18 HydrophobicContact CB-CB 4.01Å; I14-W18 HydrophobicContact CB-CD2 3.75Å; I14-W18 HydrophobicContact CB-CE3 4.27Å; I14-W18 HydrophobicContact CB-CG 3.6Å; I14-W18 HydrophobicContact CD1-CB 3.81Å; I14-W18 HydrophobicContact CD1-CG 3.87Å; I14-W18 HydrophobicContact CG1-CB 4.28Å; I14-W18 HydrophobicContact CG1-CG 4.25Å; I14-W18 HydrophobicContact CG2-CD2 3.84Å; I14-W18 HydrophobicContact CG2-CG 3.88Å; I14-W18 HydrophobicContact CG2-CZ2 4.39Å; S15-W18 PolarHBondContact O-N 3.4Å; S15-W18 VanDerWaalsContact O-N 3.09Å; S16-W18 PolarHBondContact O-N 3.37Å; W18-F20 PolarHBondContact O-N 3.46Å; W18-G21 PolarHBondContact O-N 3.47Å; W18-R87 HydrophobicContact CE3-CG 4.18Å; W18-R87 HydrophobicContact CH2-CG 4.44Å; W18-R87 HydrophobicContact CZ3-CG 4.03Å; W18-R87 VanDerWaalsContact NE1-NH1 3.2Å; W18-Y91 HydrophobicContact CH2-CD1 4.19Å; W18-Y91 AromaticContact CH2-CD2 3.56Å; W18-Y91 HydrophobicContact CH2-CD2 3.56Å; W18-Y91 HydrophobicContact CH2-CE2 4.02Å; W18-Y91 AromaticContact CH2-CG 3.64Å; W18-Y91 HydrophobicContact CH2-CG 3.64Å; W18-Y91 AromaticContact CZ3-CD2 3.6Å; W18-Y91 HydrophobicContact CZ3-CD2 3.6Å; W18-Y91 AromaticContact CZ3-CE2 3.6Å; W18-Y91 HydrophobicContact CZ3-CE2 3.6Å; W18-Y91 HydrophobicContact CZ3-CG 4.11Å; W18-N193 VanDerWaalsContact CE2-O 3.24Å; W18-N193 HydrophobicContact CZ2-CB 4.3Å; W18-N193 VanDerWaalsContact CZ2-O 3.22Å; W18-N193 WeakPolarHBondContact CZ2-O 3.41Å; W18-N193 PolarHBondContact NE1-O 3.06Å; W18-P195 HydrophobicContact CH2-CG 4.33Å; W18-P195 HydrophobicContact CZ3-CG 4.06Å
19	N	98.6	Very high	98.4	Very high	10 Å²	10	37.9 Å²	37.9	5%	0.053	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-67.2	-23.7	179.3	-64.4	82.5	0	0	0	112.6	S16 G21 S22 L23 K214 D215	S16-N19 VanDerWaalsContact CA-OD1 3.25Å; S16-N19 WeakPolarHBondContact CA-OD1 3.25Å; S16-N19 WeakPolarHBondContact O-CB 3.28Å; S16-N19 PolarHBondContact O-N 2.55Å; S16-N19 VanDerWaalsContact O-N 3.1Å; S16-N19 PolarHBondContact O-OD1 3.05Å; S16-N19 VanDerWaalsContact O-OD1 3.09Å; N19-G21 PolarHBondContact O-N 3.01Å; N19-S22 PolarHBondContact O-N 3.32Å; N19-S22 PolarHBondContact O-OG 2.9Å; N19-L23 WeakPolarHBondContact O-CG 3.26Å; N19-L23 PolarHBondContact O-N 2.93Å; N19-K214 PolarHBondContact ND2-O 2.74Å; N19-K214 WeakPolarHBondContact OD1-CE 3.46Å; N19-K214 PolarHBondContact OD1-NZ 2.77Å; N19-D215 PolarHBondContact ND2-OD1 2.9Å
20	F	98.7	Very high	98.5	Very high	36 Å²	36	35.6 Å²	35.6	16%	0.158	21%	0.209	C	C	.	.	H	α-helix	trans	-62	-20.1	-178.1	-68.9	-69.8	0	0	0	113.6	W17 W18 L23 L24 C80 L83 H84	W17-F20 HydrophobicContact CE3-CD2 4.28Å; W17-F20 AromaticContact CE3-CE2 3.83Å; W17-F20 HydrophobicContact CE3-CE2 3.83Å; W17-F20 HydrophobicContact CZ3-CE2 4.24Å; W18-F20 PolarHBondContact O-N 3.46Å; F20-L23 HydrophobicContact CD1-CD1 3.88Å; F20-L23 HydrophobicContact CE1-CD1 4.03Å; F20-L24 WeakPolarHBondContact O-CB 3.26Å; F20-L24 WeakPolarHBondContact O-CD1 3.3Å; F20-L24 WeakPolarHBondContact O-CG 3.21Å; F20-L24 PolarHBondContact O-N 3.47Å; F20-L24 VanDerWaalsContact O-N 3.1Å; F20-C80 HydrophobicContact CD1-CB 4.14Å; F20-L83 HydrophobicContact CD1-CB 4.01Å; F20-L83 HydrophobicContact CD1-CD1 4.24Å; F20-L83 HydrophobicContact CD2-CB 3.85Å; F20-L83 HydrophobicContact CE1-CB 3.93Å; F20-L83 HydrophobicContact CE1-CD1 3.4Å; F20-L83 VanDerWaalsContact CE1-CD1 3.4Å; F20-L83 HydrophobicContact CE1-CG 4.3Å; F20-L83 HydrophobicContact CE2-CB 3.76Å; F20-L83 HydrophobicContact CE2-CD1 4.12Å; F20-L83 HydrophobicContact CE2-CG 4.47Å; F20-L83 HydrophobicContact CG-CB 3.99Å; F20-L83 HydrophobicContact CZ-CB 3.82Å; F20-L83 HydrophobicContact CZ-CD1 3.35Å; F20-L83 HydrophobicContact CZ-CG 4.15Å; F20-H84 HydrophobicContact CB-CB 3.91Å
21	G	98.3	Very high	98.5	Very high	32 Å²	32	36.5 Å²	36.5	33%	0.33	21%	0.214	S	C	.	.	H	α-helix	trans	-64.3	-49.1	170.8	0	0	0	0	0	112.8	W18 N19 L24 G25 H84	W18-G21 PolarHBondContact O-N 3.47Å; N19-G21 PolarHBondContact O-N 3.01Å; G21-L24 PolarHBondContact O-N 3.26Å; G21-G25 PolarHBondContact O-N 3.47Å; G21-H84 PolarHBondContact N-ND1 3.45Å
22	S	98.3	Very high	98.6	Very high	33 Å²	33	38.4 Å²	38.4	23%	0.231	22%	0.223	C	C	.	.	H	α-helix	trans	-70.4	-38.4	177.9	51.3	0	0	0	0	111.9	N19 L24 G25 V26 D215	N19-S22 PolarHBondContact O-N 3.32Å; N19-S22 PolarHBondContact O-OG 2.9Å; S22-L24 VanDerWaalsContact C-N 3.3Å; S22-L24 PolarHBondContact O-N 2.81Å; S22-G25 PolarHBondContact O-N 3.49Å; S22-G25 VanDerWaalsContact O-N 3.11Å; S22-V26 PolarHBondContact O-N 2.99Å; S22-D215 WeakPolarHBondContact CB-OD2 3.4Å; S22-D215 PolarHBondContact OG-OD1 3.44Å; S22-D215 VanDerWaalsContact OG-OD1 3.1Å; S22-D215 PolarHBondContact OG-OD2 3.33Å
23	L	98.8	Very high	98.6	Very high	13 Å²	13	41.1 Å²	41.1	7%	0.068	23%	0.234	C	C	.	.	H	α-helix	trans	-60.2	-37.4	174.8	-62.3	-177.7	0	0	0	112.7	N19 F20 V26 C27 I219 M222	N19-L23 WeakPolarHBondContact O-CG 3.26Å; N19-L23 PolarHBondContact O-N 2.93Å; F20-L23 HydrophobicContact CD1-CD1 3.88Å; F20-L23 HydrophobicContact CE1-CD1 4.03Å; L23-V26 PolarHBondContact O-N 3.12Å; L23-C27 PolarHBondContact O-N 3.1Å; L23-C27 PolarHBondContact O-SG 3.31Å; L23-I219 HydrophobicContact CD2-CB 4.46Å; L23-I219 HydrophobicContact CD2-CG1 3.83Å; L23-M222 HydrophobicContact CB-SD 4.05Å; L23-M222 HydrophobicContact CD2-CB 4.06Å; L23-M222 HydrophobicContact CD2-SD 3.96Å; L23-M222 HydrophobicContact CG-SD 4.45Å
24	L	98.9	Very high	98.6	Very high	22 Å²	22	38.6 Å²	38.6	12%	0.115	22%	0.22	C	C	.	.	H	α-helix	trans	-63.7	-40.8	173.7	-75.9	169.3	0	0	0	112.4	F20 G21 S22 V26 C27 L28 F77 C80 L81 H84	F20-L24 WeakPolarHBondContact O-CB 3.26Å; F20-L24 WeakPolarHBondContact O-CD1 3.3Å; F20-L24 WeakPolarHBondContact O-CG 3.21Å; F20-L24 PolarHBondContact O-N 3.47Å; F20-L24 VanDerWaalsContact O-N 3.1Å; G21-L24 PolarHBondContact O-N 3.26Å; S22-L24 VanDerWaalsContact C-N 3.3Å; S22-L24 PolarHBondContact O-N 2.81Å; L24-V26 VanDerWaalsContact C-N 3.33Å; L24-V26 PolarHBondContact O-N 3.04Å; L24-C27 PolarHBondContact O-N 2.82Å; L24-L28 PolarHBondContact O-N 3.24Å; L24-F77 HydrophobicContact CD2-CD2 3.56Å; L24-F77 HydrophobicContact CD2-CE2 3.52Å; L24-C80 HydrophobicContact CD2-CB 3.64Å; L24-C80 HydrophobicContact CG-CB 3.95Å; L24-L81 HydrophobicContact CD1-CD2 4.11Å; L24-L81 HydrophobicContact CD2-CB 4.31Å; L24-L81 HydrophobicContact CD2-CD2 3.87Å; L24-L81 HydrophobicContact CD2-CG 3.61Å; L24-H84 HydrophobicContact CD1-CB 3.76Å
25	G	98.7	Very high	98.7	Very high	36 Å²	36	38.6 Å²	38.6	37%	0.371	23%	0.225	S	C	.	.	H	α-helix	trans	-60.6	-42.3	173.1	0	0	0	0	0	112.2	G21 S22 L28 M29	G21-G25 PolarHBondContact O-N 3.47Å; S22-G25 PolarHBondContact O-N 3.49Å; S22-G25 VanDerWaalsContact O-N 3.11Å; G25-L28 PolarHBondContact O-N 2.85Å; G25-M29 WeakPolarHBondContact O-CG 3.47Å; G25-M29 PolarHBondContact O-N 2.59Å
26	V	98.7	Very high	98.7	Very high	19 Å²	19	40.3 Å²	40.3	12%	0.115	23%	0.231	C	C	.	.	H	α-helix	trans	-67.2	-42.2	175.6	179.5	0	0	0	0	111.7	S22 L23 L24 L28 M29 V30 I219 M222 F223	S22-V26 PolarHBondContact O-N 2.99Å; L23-V26 PolarHBondContact O-N 3.12Å; L24-V26 VanDerWaalsContact C-N 3.33Å; L24-V26 PolarHBondContact O-N 3.04Å; V26-L28 VanDerWaalsContact C-N 3.3Å; V26-L28 PolarHBondContact O-N 2.75Å; V26-M29 HydrophobicContact CB-CE 4.35Å; V26-M29 HydrophobicContact CG2-CE 3.93Å; V26-M29 PolarHBondContact O-N 2.92Å; V26-V30 HydrophobicContact CG1-CG2 4.31Å; V26-V30 WeakPolarHBondContact O-CG2 3.4Å; V26-V30 PolarHBondContact O-N 3.2Å; V26-I219 HydrophobicContact CG2-CD1 3.79Å; V26-I219 HydrophobicContact CG2-CG1 3.99Å; V26-M222 HydrophobicContact CB-CE 4.14Å; V26-M222 HydrophobicContact CG1-CE 3.63Å; V26-F223 HydrophobicContact CG1-CE2 4.04Å; V26-F223 HydrophobicContact CG1-CZ 3.97Å
27	C	98.8	Very high	98.7	Very high	6 Å²	6	40.9 Å²	40.9	4%	0.041	22%	0.222	C	C	.	.	H	α-helix	trans	-56.1	-46.6	173.5	-71.3	0	0	0	0	110.9	L23 L24 M29 V30 Q31 F77 M222	L23-C27 PolarHBondContact O-N 3.1Å; L23-C27 PolarHBondContact O-SG 3.31Å; L24-C27 PolarHBondContact O-N 2.82Å; C27-M29 PolarHBondContact O-N 3.43Å; C27-V30 PolarHBondContact O-N 3.4Å; C27-Q31 WeakPolarHBondContact O-CB 3.35Å; C27-Q31 VanDerWaalsContact O-CG 3.27Å; C27-Q31 WeakPolarHBondContact O-CG 3.41Å; C27-Q31 PolarHBondContact O-N 2.89Å; C27-F77 HydrophobicContact CB-CB 4.11Å; C27-F77 HydrophobicContact CB-CD1 3.65Å; C27-F77 HydrophobicContact CB-CD2 4.4Å; C27-F77 HydrophobicContact CB-CE1 4.14Å; C27-F77 HydrophobicContact CB-CG 3.79Å; C27-M222 VanDerWaalsContact SG-SD 3.68Å
28	L	98.8	Very high	98.7	Very high	19 Å²	19	36.6 Å²	36.6	10%	0.099	21%	0.208	C	C	.	.	H	α-helix	trans	-59.9	-45.1	177.4	-177.9	62.6	0	0	0	112.3	L24 G25 V26 Q31 I32 F77 I176 A177	L24-L28 PolarHBondContact O-N 3.24Å; G25-L28 PolarHBondContact O-N 2.85Å; V26-L28 VanDerWaalsContact C-N 3.3Å; V26-L28 PolarHBondContact O-N 2.75Å; L28-Q31 PolarHBondContact O-N 3.21Å; L28-I32 HydrophobicContact CD1-CD1 3.99Å; L28-I32 HydrophobicContact CD1-CG1 4.29Å; L28-I32 HydrophobicContact CG-CD1 3.92Å; L28-I32 WeakPolarHBondContact O-CG1 3.38Å; L28-I32 PolarHBondContact O-N 3.16Å; L28-F77 HydrophobicContact CB-CE1 3.97Å; L28-F77 HydrophobicContact CB-CZ 4.17Å; L28-F77 HydrophobicContact CD1-CE1 4.19Å; L28-F77 HydrophobicContact CD1-CZ 4.49Å; L28-I176 HydrophobicContact CD1-CB 4.41Å; L28-I176 HydrophobicContact CD1-CG2 3.92Å; L28-I176 HydrophobicContact CD2-CG2 4.01Å; L28-A177 HydrophobicContact CD2-CB 3.96Å
29	M	98.8	Very high	98.7	Very high	110 Å²	110	36.5 Å²	36.5	54%	0.542	21%	0.212	S	C	.	.	H	α-helix	trans	-61.9	-46.2	176.4	-70.9	-173	-66.7	0	0	112	G25 V26 C27 Q31 I32 I33	G25-M29 WeakPolarHBondContact O-CG 3.47Å; G25-M29 PolarHBondContact O-N 2.59Å; V26-M29 HydrophobicContact CB-CE 4.35Å; V26-M29 HydrophobicContact CG2-CE 3.93Å; V26-M29 PolarHBondContact O-N 2.92Å; C27-M29 PolarHBondContact O-N 3.43Å; M29-Q31 VanDerWaalsContact C-N 3.29Å; M29-Q31 PolarHBondContact O-N 3.29Å; M29-I32 PolarHBondContact O-N 3.19Å; M29-I33 WeakPolarHBondContact O-CB 3.16Å; M29-I33 VanDerWaalsContact O-CG1 3.26Å; M29-I33 WeakPolarHBondContact O-CG1 3.25Å; M29-I33 PolarHBondContact O-N 3.47Å
30	V	98.6	Very high	98.7	Very high	24 Å²	24	41.8 Å²	41.8	15%	0.145	24%	0.237	C	C	.	.	H	α-helix	trans	-58.1	-44.1	176.5	169.9	0	0	0	0	110.5	V26 C27 T34 F223	V26-V30 HydrophobicContact CG1-CG2 4.31Å; V26-V30 WeakPolarHBondContact O-CG2 3.4Å; V26-V30 PolarHBondContact O-N 3.2Å; C27-V30 PolarHBondContact O-N 3.4Å; V30-T34 HydrophobicContact CG1-CG2 4.32Å; V30-T34 WeakPolarHBondContact O-CB 3.3Å; V30-T34 WeakPolarHBondContact O-CG2 3.21Å; V30-T34 PolarHBondContact O-N 3.19Å; V30-T34 PolarHBondContact O-OG1 2.78Å; V30-F223 HydrophobicContact CG2-CE1 4.06Å; V30-F223 HydrophobicContact CG2-CZ 3.95Å
31	Q	98.9	Very high	98.7	Very high	23 Å²	23	43.8 Å²	43.8	11%	0.107	25%	0.247	C	C	.	.	H	α-helix	trans	-64.9	-44.9	178.9	-71.1	-53.6	-31.7	0	0	113	C27 L28 M29 T34 G35 H70 G73 F77	C27-Q31 WeakPolarHBondContact O-CB 3.35Å; C27-Q31 VanDerWaalsContact O-CG 3.27Å; C27-Q31 WeakPolarHBondContact O-CG 3.41Å; C27-Q31 PolarHBondContact O-N 2.89Å; L28-Q31 PolarHBondContact O-N 3.21Å; M29-Q31 VanDerWaalsContact C-N 3.29Å; M29-Q31 PolarHBondContact O-N 3.29Å; Q31-T34 PolarHBondContact O-OG1 2.74Å; Q31-G35 WeakPolarHBondContact O-CA 3.37Å; Q31-G35 PolarHBondContact O-N 3.11Å; Q31-H70 PolarHBondContact NE2-O 3.31Å; Q31-H70 PolarHBondContact O-CE1 3.4Å; Q31-H70 PolarHBondContact O-ND1 2.96Å; Q31-H70 PolarHBondContact OE1-CE1 3.4Å; Q31-H70 PolarHBondContact OE1-ND1 3.06Å; Q31-H70 PolarHBondContact OE1-O 3.34Å; Q31-G73 PolarHBondContact NE2-O 3.21Å; Q31-F77 HydrophobicContact CG-CD1 4.04Å
32	I	98.9	Very high	98.8	Very high	40 Å²	40	43.6 Å²	43.6	21%	0.205	24%	0.237	C	C	.	.	H	α-helix	trans	-63	-46.7	178.3	-69.8	169.6	0	0	0	110.4	L28 M29 L36 P173 F174	L28-I32 HydrophobicContact CD1-CD1 3.99Å; L28-I32 HydrophobicContact CD1-CG1 4.29Å; L28-I32 HydrophobicContact CG-CD1 3.92Å; L28-I32 WeakPolarHBondContact O-CG1 3.38Å; L28-I32 PolarHBondContact O-N 3.16Å; M29-I32 PolarHBondContact O-N 3.19Å; I32-L36 VanDerWaalsContact O-CB 3.24Å; I32-L36 WeakPolarHBondContact O-CB 3.34Å; I32-L36 PolarHBondContact O-N 3.14Å; I32-P173 HydrophobicContact CD1-CB 4.3Å; I32-P173 HydrophobicContact CG1-CB 3.77Å; I32-F174 HydrophobicContact CG2-CE1 3.99Å; I32-F174 HydrophobicContact CG2-CZ 4.15Å
33	I	98.9	Very high	98.8	Very high	100 Å²	100	45 Å²	45	51%	0.513	24%	0.244	S	C	.	.	H	α-helix	trans	-64.9	-55.6	-178.5	-66.2	166.1	0	0	0	110	M29 G35 L36 F37	M29-I33 WeakPolarHBondContact O-CB 3.16Å; M29-I33 VanDerWaalsContact O-CG1 3.26Å; M29-I33 WeakPolarHBondContact O-CG1 3.25Å; M29-I33 PolarHBondContact O-N 3.47Å; I33-G35 VanDerWaalsContact C-N 3.33Å; I33-G35 PolarHBondContact O-N 3.24Å; I33-L36 PolarHBondContact O-N 2.91Å; I33-F37 HydrophobicContact CG2-CD2 4.31Å; I33-F37 HydrophobicContact CG2-CE2 4.33Å; I33-F37 WeakPolarHBondContact O-CD2 3.16Å; I33-F37 PolarHBondContact O-N 3.1Å
34	T	98.9	Very high	98.8	Very high	10 Å²	10	45.7 Å²	45.7	6%	0.061	25%	0.25	C	C	.	.	H	α-helix	trans	-61.9	-41.9	-179.2	53.3	0	0	0	0	111.7	V30 Q31 L36 F37 L38 I66 M69 H70	V30-T34 HydrophobicContact CG1-CG2 4.32Å; V30-T34 WeakPolarHBondContact O-CB 3.3Å; V30-T34 WeakPolarHBondContact O-CG2 3.21Å; V30-T34 PolarHBondContact O-N 3.19Å; V30-T34 PolarHBondContact O-OG1 2.78Å; Q31-T34 PolarHBondContact O-OG1 2.74Å; T34-L36 PolarHBondContact O-N 3.09Å; T34-F37 PolarHBondContact O-N 3.29Å; T34-L38 VanDerWaalsContact O-CG 3.26Å; T34-L38 WeakPolarHBondContact O-CG 3.34Å; T34-L38 PolarHBondContact O-N 3.46Å; T34-I66 HydrophobicContact CG2-CG2 4.22Å; T34-M69 HydrophobicContact CG2-CB 4.19Å; T34-M69 HydrophobicContact CG2-CE 4.17Å; T34-H70 PolarHBondContact OG1-ND1 3.09Å
35	G	98.9	Very high	98.7	Very high	17 Å²	17	46.6 Å²	46.6	18%	0.175	26%	0.255	C	S	.	.	H	α-helix	trans	-62.3	-40.3	178.2	0	0	0	0	0	112.9	Q31 I33 L38 A39 H70	Q31-G35 WeakPolarHBondContact O-CA 3.37Å; Q31-G35 PolarHBondContact O-N 3.11Å; I33-G35 VanDerWaalsContact C-N 3.33Å; I33-G35 PolarHBondContact O-N 3.24Å; G35-L38 PolarHBondContact O-N 3.04Å; G35-A39 WeakPolarHBondContact O-CB 3.37Å; G35-A39 PolarHBondContact O-N 3.07Å; G35-H70 WeakPolarHBondContact CA-CE1 3.12Å; G35-H70 PolarHBondContact N-ND1 3.39Å
36	L	98.8	Very high	98.7	Very high	72 Å²	72	46.4 Å²	46.4	38%	0.377	25%	0.246	S	C	.	.	H	α-helix	trans	-62.9	-45.2	176.1	-177.1	65.9	0	0	0	111.7	I32 I33 T34 A39 M40 F170	I32-L36 VanDerWaalsContact O-CB 3.24Å; I32-L36 WeakPolarHBondContact O-CB 3.34Å; I32-L36 PolarHBondContact O-N 3.14Å; I33-L36 PolarHBondContact O-N 2.91Å; T34-L36 PolarHBondContact O-N 3.09Å; L36-A39 PolarHBondContact O-N 3.2Å; L36-M40 HydrophobicContact CD2-CE 4.49Å; L36-M40 HydrophobicContact CG-CE 4.13Å; L36-M40 WeakPolarHBondContact O-CG 3.08Å; L36-M40 PolarHBondContact O-N 2.89Å; L36-F170 HydrophobicContact CD1-CE2 4.06Å; L36-F170 HydrophobicContact CD1-CZ 3.92Å
37	F	98.8	Very high	98.7	Very high	100 Å²	100	53.1 Å²	53.1	44%	0.439	28%	0.279	S	S	.	.	H	α-helix	trans	-65.5	-37.3	176.6	-85.4	-97.7	0	0	0	112.2	I33 T34 M40 H41 I66	I33-F37 HydrophobicContact CG2-CD2 4.31Å; I33-F37 HydrophobicContact CG2-CE2 4.33Å; I33-F37 WeakPolarHBondContact O-CD2 3.16Å; I33-F37 PolarHBondContact O-N 3.1Å; T34-F37 PolarHBondContact O-N 3.29Å; F37-M40 PolarHBondContact O-N 2.97Å; F37-H41 PolarHBondContact O-CD2 2.86Å; F37-I66 HydrophobicContact CB-CD1 4.29Å; F37-I66 HydrophobicContact CB-CG2 4.22Å
38	L	98.9	Very high	98.7	Very high	23 Å²	23	55.3 Å²	55.3	12%	0.12	29%	0.292	C	S	.	.	H	α-helix	trans	-64.6	-42	173.2	-67.1	171.4	0	0	0	111.7	T34 G35 M40 H41 Y42 I56 I66 R67 H70	T34-L38 VanDerWaalsContact O-CG 3.26Å; T34-L38 WeakPolarHBondContact O-CG 3.34Å; T34-L38 PolarHBondContact O-N 3.46Å; G35-L38 PolarHBondContact O-N 3.04Å; L38-M40 PolarHBondContact O-N 3.43Å; L38-H41 PolarHBondContact O-N 3.21Å; L38-Y42 WeakPolarHBondContact O-CB 3.42Å; L38-Y42 PolarHBondContact O-N 3.5Å; L38-I56 HydrophobicContact CD2-CD1 4.25Å; L38-I56 HydrophobicContact CD2-CG2 3.59Å; L38-I66 HydrophobicContact CD2-CB 4.49Å; L38-I66 HydrophobicContact CD2-CG2 3.95Å; L38-I66 HydrophobicContact CG-CG2 3.88Å; L38-R67 HydrophobicContact CD2-CB 3.95Å; L38-H70 HydrophobicContact CD1-CB 3.53Å
39	A	98.8	Very high	98.7	Very high	22 Å²	22	54.4 Å²	54.4	18%	0.182	29%	0.287	C	S	.	.	H	α-helix	trans	-62.4	-28.3	-179.8	0	0	0	0	0	113.1	G35 L36 H41 F166 F170	G35-A39 WeakPolarHBondContact O-CB 3.37Å; G35-A39 PolarHBondContact O-N 3.07Å; L36-A39 PolarHBondContact O-N 3.2Å; A39-H41 PolarHBondContact O-N 3.18Å; A39-F166 HydrophobicContact CB-CE2 4.23Å; A39-F166 HydrophobicContact CB-CZ 4.09Å; A39-F170 HydrophobicContact CB-CD2 4.24Å; A39-F170 HydrophobicContact CB-CE2 4.01Å
40	M	98.8	Very high	98.7	Very high	120 Å²	120	55 Å²	55	59%	0.591	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-18.5	174.5	-67.3	174.5	-176.2	0	0	113.6	L36 F37 L38	L36-M40 HydrophobicContact CD2-CE 4.49Å; L36-M40 HydrophobicContact CG-CE 4.13Å; L36-M40 WeakPolarHBondContact O-CG 3.08Å; L36-M40 PolarHBondContact O-N 2.89Å; F37-M40 PolarHBondContact O-N 2.97Å; L38-M40 PolarHBondContact O-N 3.43Å
41	H	98.7	Very high	98.7	Very high	79 Å²	79	56.7 Å²	56.7	37%	0.366	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.3	-6.8	-175.3	-62.4	-67	0	0	0	113.9	F37 L38 A39 I56 V60	F37-H41 PolarHBondContact O-CD2 2.86Å; L38-H41 PolarHBondContact O-N 3.21Å; A39-H41 PolarHBondContact O-N 3.18Å; H41-I56 HydrophobicContact CB-CD1 3.87Å; H41-I56 HydrophobicContact CB-CG1 3.53Å; H41-V60 HydrophobicContact CB-CG2 4.42Å
42	Y	98.9	Very high	98.7	Very high	27 Å²	27	56 Å²	56	11%	0.106	30%	0.298	C	S	.	.			trans	-89.4	146.1	-177.9	173.3	-102.8	0	0	0	112	L38 A49 S52 V53 L120 F166	L38-Y42 WeakPolarHBondContact O-CB 3.42Å; L38-Y42 PolarHBondContact O-N 3.5Å; Y42-A49 HydrophobicContact CE2-CB 4.03Å; Y42-S52 VanDerWaalsContact CD2-OG 3.26Å; Y42-S52 WeakPolarHBondContact CD2-OG 3.31Å; Y42-V53 HydrophobicContact CD2-CG2 3.85Å; Y42-V53 HydrophobicContact CE2-CG2 4.05Å; Y42-L120 HydrophobicContact CE2-CB 4.42Å; Y42-L120 WeakPolarHBondContact CE2-O 3.32Å; Y42-L120 PolarHBondContact OH-O 2.82Å; Y42-F166 AromaticContact CD1-CD2 3.76Å; Y42-F166 HydrophobicContact CD1-CD2 3.76Å; Y42-F166 AromaticContact CD1-CE2 3.66Å; Y42-F166 HydrophobicContact CD1-CE2 3.66Å; Y42-F166 HydrophobicContact CD1-CG 4.31Å; Y42-F166 HydrophobicContact CD1-CZ 4.14Å; Y42-F166 HydrophobicContact CE1-CB 4.34Å; Y42-F166 AromaticContact CE1-CD2 3.66Å; Y42-F166 HydrophobicContact CE1-CD2 3.66Å; Y42-F166 HydrophobicContact CE1-CE2 4.07Å; Y42-F166 AromaticContact CE1-CG 3.94Å; Y42-F166 HydrophobicContact CE1-CG 3.94Å
43	T	98.6	Very high	98.7	Very high	62 Å²	62	55.2 Å²	55.2	38%	0.38	29%	0.294	S	S	.	.			trans	-121.6	124.1	173.5	56.3	0	0	0	0	111.6	D45 T48 A49 S52	T43-D45 VanDerWaalsContact C-N 3.26Å; T43-D45 PolarHBondContact O-N 3.05Å; T43-D45 VanDerWaalsContact O-N 3.1Å; T43-T48 WeakPolarHBondContact OG1-CB 3.36Å; T43-T48 PolarHBondContact OG1-OG1 3.09Å; T43-A49 VanDerWaalsContact O-CA 3.27Å; T43-A49 WeakPolarHBondContact O-CA 3.27Å; T43-S52 PolarHBondContact N-OG 2.65Å; T43-S52 WeakPolarHBondContact OG1-CB 3.4Å
44	S	98.3	Very high	98.7	Very high	28 Å²	28	52.6 Å²	52.6	20%	0.196	28%	0.283	C	S	.	.			trans	-87.5	49	-178.3	71.3	0	0	0	0	113.3	T163	S44-T163 PolarHBondContact O-OG1 3.45Å; S44-T163 VanDerWaalsContact O-OG1 3.1Å
45	D	98.4	Very high	98.7	Very high	42 Å²	42	56.1 Å²	56.1	23%	0.225	30%	0.299	C	S	.	.	S	Bend	trans	-120	135.1	173.4	-178.7	-76.1	0	0	0	109.2	T43 M47 T48 A49 K159	T43-D45 VanDerWaalsContact C-N 3.26Å; T43-D45 PolarHBondContact O-N 3.05Å; T43-D45 VanDerWaalsContact O-N 3.1Å; D45-M47 PolarHBondContact O-N 3.33Å; D45-M47 VanDerWaalsContact O-N 3.08Å; D45-M47 VanDerWaalsContact OD1-CB 3.31Å; D45-M47 WeakPolarHBondContact OD1-CB 3.19Å; D45-M47 PolarHBondContact OD1-N 3.1Å; D45-T48 CarbonylContact O-C 3.56Å; D45-T48 PolarHBondContact O-N 3.21Å; D45-T48 PolarHBondContact O-OG1 3.34Å; D45-A49 WeakPolarHBondContact O-CB 3.43Å; D45-A49 PolarHBondContact O-N 2.91Å; D45-K159 WeakPolarHBondContact OD2-CE 3.32Å; D45-K159 IonicContact OD2-NZ 3.34Å; D45-K159 PolarHBondContact OD2-NZ 3.38Å
46	T	97.9	Very high	98.7	Very high	31 Å²	31	55.5 Å²	55.5	19%	0.19	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-24.2	-172.2	49.6	0	0	0	0	113.6	W122 K159 L162	T46-W122 HydrophobicContact CG2-CD2 4.46Å; T46-W122 HydrophobicContact CG2-CH2 4.23Å; T46-W122 HydrophobicContact CG2-CZ2 3.51Å; T46-K159 HydrophobicContact CG2-CB 4.04Å; T46-L162 HydrophobicContact CG2-CB 4.35Å; T46-L162 HydrophobicContact CG2-CD2 3.89Å
47	M	98.4	Very high	98.7	Very high	160 Å²	160	53.3 Å²	53.3	79%	0.788	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-20.9	176.5	-59	-58.5	-63.8	0	0	113	D45	D45-M47 PolarHBondContact O-N 3.33Å; D45-M47 VanDerWaalsContact O-N 3.08Å; D45-M47 VanDerWaalsContact OD1-CB 3.31Å; D45-M47 WeakPolarHBondContact OD1-CB 3.19Å; D45-M47 PolarHBondContact OD1-N 3.1Å
48	T	98.6	Very high	98.7	Very high	53 Å²	53	58.1 Å²	58.1	33%	0.325	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.2	-11.4	-171.5	61.6	0	0	0	0	114.8	T43 D45 F50 S51 S52	T43-T48 WeakPolarHBondContact OG1-CB 3.36Å; T43-T48 PolarHBondContact OG1-OG1 3.09Å; D45-T48 CarbonylContact O-C 3.56Å; D45-T48 PolarHBondContact O-N 3.21Å; D45-T48 PolarHBondContact O-OG1 3.34Å; T48-F50 PolarHBondContact O-N 2.85Å; T48-S51 WeakPolarHBondContact CA-OG 3.04Å; T48-S51 PolarHBondContact O-N 3.33Å; T48-S51 PolarHBondContact O-OG 2.96Å; T48-S52 WeakPolarHBondContact O-CB 3.19Å; T48-S52 PolarHBondContact O-N 3.03Å; T48-S52 PolarHBondContact O-OG 2.76Å
49	A	98.6	Very high	98.6	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-58.5	-52.2	-175.6	0	0	0	0	0	112.3	Y42 T43 D45 S51 S52 V53 W122 L162	Y42-A49 HydrophobicContact CE2-CB 4.03Å; T43-A49 VanDerWaalsContact O-CA 3.27Å; T43-A49 WeakPolarHBondContact O-CA 3.27Å; D45-A49 WeakPolarHBondContact O-CB 3.43Å; D45-A49 PolarHBondContact O-N 2.91Å; A49-S51 PolarHBondContact O-N 3.41Å; A49-S52 PolarHBondContact O-N 2.87Å; A49-S52 PolarHBondContact O-OG 3.14Å; A49-V53 PolarHBondContact O-N 3.32Å; A49-W122 HydrophobicContact CB-CB 3.89Å; A49-L162 HydrophobicContact CB-CD2 3.69Å
50	F	98.7	Very high	98.6	Very high	123 Å²	123	62.6 Å²	62.6	54%	0.539	32%	0.319	S	S	.	.	H	α-helix	trans	-60.9	-46.5	177.7	-173.9	-89.9	0	0	0	111.7	T48 S52 V53 T54 P121	T48-F50 PolarHBondContact O-N 2.85Å; F50-S52 PolarHBondContact O-N 3.44Å; F50-V53 PolarHBondContact O-N 3.3Å; F50-T54 HydrophobicContact CD1-CG2 4.06Å; F50-T54 HydrophobicContact CE1-CG2 3.7Å; F50-T54 HydrophobicContact CZ-CG2 4.26Å; F50-T54 WeakPolarHBondContact O-CG2 3.34Å; F50-T54 PolarHBondContact O-N 3.29Å; F50-P121 WeakPolarHBondContact CA-O 3.27Å; F50-P121 WeakPolarHBondContact CD2-O 3.37Å
51	S	98.7	Very high	98.6	Very high	59 Å²	59	63.8 Å²	63.8	41%	0.413	33%	0.328	S	S	.	.	H	α-helix	trans	-66.7	-35.8	-178.8	58.2	0	0	0	0	112.3	T48 A49 V53 T54 H55	T48-S51 WeakPolarHBondContact CA-OG 3.04Å; T48-S51 PolarHBondContact O-N 3.33Å; T48-S51 PolarHBondContact O-OG 2.96Å; A49-S51 PolarHBondContact O-N 3.41Å; S51-V53 PolarHBondContact O-N 3Å; S51-T54 WeakPolarHBondContact CA-OG1 3.22Å; S51-T54 PolarHBondContact O-N 3.11Å; S51-T54 VanDerWaalsContact O-N 3.15Å; S51-T54 PolarHBondContact O-OG1 3.47Å; S51-H55 WeakPolarHBondContact O-CB 3.37Å; S51-H55 PolarHBondContact O-N 3.36Å
52	S	98.8	Very high	98.6	Very high	9 Å²	9	68 Å²	68	6%	0.063	34%	0.342	C	S	.	.	H	α-helix	trans	-62.3	-40.3	174.7	76.4	0	0	0	0	112	Y42 T43 T48 A49 F50 T54 H55 I56	Y42-S52 VanDerWaalsContact CD2-OG 3.26Å; Y42-S52 WeakPolarHBondContact CD2-OG 3.31Å; T43-S52 PolarHBondContact N-OG 2.65Å; T43-S52 WeakPolarHBondContact OG1-CB 3.4Å; T48-S52 WeakPolarHBondContact O-CB 3.19Å; T48-S52 PolarHBondContact O-N 3.03Å; T48-S52 PolarHBondContact O-OG 2.76Å; A49-S52 PolarHBondContact O-N 2.87Å; A49-S52 PolarHBondContact O-OG 3.14Å; F50-S52 PolarHBondContact O-N 3.44Å; S52-T54 PolarHBondContact O-N 3.05Å; S52-H55 WeakPolarHBondContact O-CB 3.49Å; S52-H55 PolarHBondContact O-N 3.04Å; S52-I56 WeakPolarHBondContact O-CG1 3.35Å; S52-I56 PolarHBondContact O-N 3.37Å
53	V	98.8	Very high	98.6	Very high	22 Å²	22	66.8 Å²	66.8	13%	0.133	34%	0.337	C	S	.	.	H	α-helix	trans	-66.1	-37.9	173.8	176.4	0	0	0	0	111.4	Y42 A49 F50 S51 I56 C57	Y42-V53 HydrophobicContact CD2-CG2 3.85Å; Y42-V53 HydrophobicContact CE2-CG2 4.05Å; A49-V53 PolarHBondContact O-N 3.32Å; F50-V53 PolarHBondContact O-N 3.3Å; S51-V53 PolarHBondContact O-N 3Å; V53-I56 PolarHBondContact O-N 3.06Å; V53-C57 PolarHBondContact O-N 3.11Å; V53-C57 PolarHBondContact O-SG 3.31Å
54	T	98.8	Very high	98.6	Very high	46 Å²	46	70.5 Å²	70.5	28%	0.282	34%	0.344	S	S	.	.	H	α-helix	trans	-67.2	-38.8	174.2	63.7	0	0	0	0	112.6	F50 S51 S52 C57 R58	F50-T54 HydrophobicContact CD1-CG2 4.06Å; F50-T54 HydrophobicContact CE1-CG2 3.7Å; F50-T54 HydrophobicContact CZ-CG2 4.26Å; F50-T54 WeakPolarHBondContact O-CG2 3.34Å; F50-T54 PolarHBondContact O-N 3.29Å; S51-T54 WeakPolarHBondContact CA-OG1 3.22Å; S51-T54 PolarHBondContact O-N 3.11Å; S51-T54 VanDerWaalsContact O-N 3.15Å; S51-T54 PolarHBondContact O-OG1 3.47Å; S52-T54 PolarHBondContact O-N 3.05Å; T54-C57 PolarHBondContact O-N 2.82Å; T54-C57 VanDerWaalsContact O-N 3.16Å; T54-R58 WeakPolarHBondContact O-CB 3.34Å; T54-R58 WeakPolarHBondContact O-CG 3.26Å; T54-R58 PolarHBondContact O-N 3.2Å
55	H	98.8	Very high	98.6	Very high	83 Å²	83	71.4 Å²	71.4	38%	0.384	35%	0.347	S	S	.	.	H	α-helix	trans	-61.6	-44.1	174.8	166.5	-90	0	0	0	111	S51 S52 C57 R58 D59 V60	S51-H55 WeakPolarHBondContact O-CB 3.37Å; S51-H55 PolarHBondContact O-N 3.36Å; S52-H55 WeakPolarHBondContact O-CB 3.49Å; S52-H55 PolarHBondContact O-N 3.04Å; H55-C57 VanDerWaalsContact C-N 3.26Å; H55-C57 PolarHBondContact O-N 2.93Å; H55-R58 PolarHBondContact O-N 2.8Å; H55-D59 IonicContact CD2-OD2 3.94Å; H55-D59 PolarHBondContact CD2-OD2 3.4Å; H55-D59 IonicContact CG-OD2 2.68Å; H55-D59 PolarHBondContact O-N 3.29Å; H55-V60 PolarHBondContact O-N 3.19Å
56	I	98.8	Very high	98.6	Very high	5 Å²	5	71.1 Å²	71.1	3%	0.026	35%	0.345	C	S	.	.	H	α-helix	trans	-53.3	-45.9	172.3	-71.7	167.4	0	0	0	111.1	L38 H41 S52 V53 R58 G63 R67	L38-I56 HydrophobicContact CD2-CD1 4.25Å; L38-I56 HydrophobicContact CD2-CG2 3.59Å; H41-I56 HydrophobicContact CB-CD1 3.87Å; H41-I56 HydrophobicContact CB-CG1 3.53Å; S52-I56 WeakPolarHBondContact O-CG1 3.35Å; S52-I56 PolarHBondContact O-N 3.37Å; V53-I56 PolarHBondContact O-N 3.06Å; I56-R58 VanDerWaalsContact C-N 3.34Å; I56-R58 PolarHBondContact O-N 3.09Å; I56-G63 CarbonylContact O-C 3.57Å; I56-G63 VanDerWaalsContact O-CA 3.22Å; I56-G63 WeakPolarHBondContact O-CA 3.25Å; I56-R67 HydrophobicContact CG2-CB 4.37Å
57	C	98.8	Very high	98.7	Very high	26 Å²	26	73.2 Å²	73.2	18%	0.176	35%	0.349	C	S	.	.	H	α-helix	trans	-73.7	-25.6	-176.3	-62.5	0	0	0	0	113.6	V53 T54 H55 W64	V53-C57 PolarHBondContact O-N 3.11Å; V53-C57 PolarHBondContact O-SG 3.31Å; T54-C57 PolarHBondContact O-N 2.82Å; T54-C57 VanDerWaalsContact O-N 3.16Å; H55-C57 VanDerWaalsContact C-N 3.26Å; H55-C57 PolarHBondContact O-N 2.93Å; C57-W64 HydrophobicContact CB-CB 4.44Å
58	R	98.7	Very high	98.7	Very high	201 Å²	201	71 Å²	71	76%	0.758	33%	0.333	S	S	*	.	H	α-helix	trans	-106.4	-36.9	-169.1	-68.9	179.3	175.3	-167.7	-1.5	113.7	T54 H55 I56	T54-R58 WeakPolarHBondContact O-CB 3.34Å; T54-R58 WeakPolarHBondContact O-CG 3.26Å; T54-R58 PolarHBondContact O-N 3.2Å; H55-R58 PolarHBondContact O-N 2.8Å; I56-R58 VanDerWaalsContact C-N 3.34Å; I56-R58 PolarHBondContact O-N 3.09Å
59	D	98.6	Very high	98.7	Very high	112 Å²	112	70.9 Å²	70.9	60%	0.599	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.2	-20.4	-164.6	-51.9	-49.3	0	0	0	112.6	H55	H55-D59 IonicContact CD2-OD2 3.94Å; H55-D59 PolarHBondContact CD2-OD2 3.4Å; H55-D59 IonicContact CG-OD2 2.68Å; H55-D59 PolarHBondContact O-N 3.29Å
60	V	98.7	Very high	98.7	Very high	27 Å²	27	72.4 Å²	72.4	16%	0.164	34%	0.336	C	S	.	.	S	Bend	trans	-84.6	129.2	173.8	179.6	0	0	0	0	109.9	H41 H55 Y62 G63	H41-V60 HydrophobicContact CB-CG2 4.42Å; H55-V60 PolarHBondContact O-N 3.19Å; V60-Y62 PolarHBondContact O-N 2.83Å; V60-G63 PolarHBondContact O-N 3.3Å
61	N	98.6	Very high	98.7	Very high	144 Å²	144	68.7 Å²	68.7	77%	0.77	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	121.5	177.1	-68.3	-39	0	0	0	111.1	G63	N61-G63 PolarHBondContact O-N 3.34Å
62	Y	98.5	Very high	98.7	Very high	168 Å²	168	69.9 Å²	69.9	66%	0.659	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	13.3	-173.9	-56.4	-81.2	0	0	0	115.2	V60 W64 L65 I66	V60-Y62 PolarHBondContact O-N 2.83Å; Y62-W64 VanDerWaalsContact C-N 3.3Å; Y62-W64 PolarHBondContact O-N 3.37Å; Y62-L65 WeakPolarHBondContact O-CB 3.46Å; Y62-L65 PolarHBondContact O-N 3.47Å; Y62-I66 PolarHBondContact O-N 2.65Å; Y62-I66 VanDerWaalsContact O-N 3.09Å
63	G	98.7	Very high	98.7	Very high	1 Å²	1	69.6 Å²	69.6	1%	0.01	33%	0.328	C	S	.	.	H	α-helix	trans	-65.2	-32.5	-176.6	0	0	0	0	0	113	I56 V60 N61 L65 I66 R67	I56-G63 CarbonylContact O-C 3.57Å; I56-G63 VanDerWaalsContact O-CA 3.22Å; I56-G63 WeakPolarHBondContact O-CA 3.25Å; V60-G63 PolarHBondContact O-N 3.3Å; N61-G63 PolarHBondContact O-N 3.34Å; G63-L65 VanDerWaalsContact C-N 3.34Å; G63-L65 PolarHBondContact O-N 3.18Å; G63-I66 PolarHBondContact O-N 3.4Å; G63-R67 VanDerWaalsContact O-CB 3.27Å; G63-R67 WeakPolarHBondContact O-CB 3.22Å; G63-R67 PolarHBondContact O-N 3.28Å
64	W	98.6	Very high	98.7	Very high	140 Å²	140	70 Å²	70	53%	0.53	33%	0.334	S	S	.	.	H	α-helix	trans	-58.4	-45.3	170.3	65.7	-90.7	0	0	0	111.8	C57 Y62 R67 Y68	C57-W64 HydrophobicContact CB-CB 4.44Å; Y62-W64 VanDerWaalsContact C-N 3.3Å; Y62-W64 PolarHBondContact O-N 3.37Å; W64-R67 PolarHBondContact O-N 2.89Å; W64-Y68 HydrophobicContact CB-CD2 4.46Å; W64-Y68 HydrophobicContact CE3-CD2 4.36Å; W64-Y68 WeakPolarHBondContact O-CD2 3.27Å; W64-Y68 PolarHBondContact O-N 3.46Å
65	L	98.5	Very high	98.6	Very high	48 Å²	48	71.2 Å²	71.2	25%	0.251	34%	0.344	S	S	.	.	H	α-helix	trans	-64.7	-48	-178.4	177.8	63.1	0	0	0	109.8	Y62 G63 R67 Y68 M69 M227	Y62-L65 WeakPolarHBondContact O-CB 3.46Å; Y62-L65 PolarHBondContact O-N 3.47Å; G63-L65 VanDerWaalsContact C-N 3.34Å; G63-L65 PolarHBondContact O-N 3.18Å; L65-R67 VanDerWaalsContact C-N 3.32Å; L65-R67 PolarHBondContact O-N 2.96Å; L65-Y68 PolarHBondContact O-N 3.45Å; L65-M69 HydrophobicContact CD1-CG 4.15Å; L65-M69 HydrophobicContact CD1-SD 4.3Å; L65-M69 HydrophobicContact CG-CE 3.98Å; L65-M69 HydrophobicContact CG-CG 4.45Å; L65-M69 HydrophobicContact CG-SD 4.24Å; L65-M69 WeakPolarHBondContact O-CB 3.37Å; L65-M69 VanDerWaalsContact O-CG 3.27Å; L65-M69 WeakPolarHBondContact O-CG 3.46Å; L65-M69 PolarHBondContact O-N 2.97Å; L65-M227 HydrophobicContact CD1-CE 3.95Å
66	I	98.7	Very high	98.6	Very high	35 Å²	35	68 Å²	68	18%	0.179	33%	0.33	C	S	.	.	H	α-helix	trans	-58.6	-45.9	176.8	-61	171.9	0	0	0	110.5	T34 F37 L38 Y62 G63 Y68 M69 H70	T34-I66 HydrophobicContact CG2-CG2 4.22Å; F37-I66 HydrophobicContact CB-CD1 4.29Å; F37-I66 HydrophobicContact CB-CG2 4.22Å; L38-I66 HydrophobicContact CD2-CB 4.49Å; L38-I66 HydrophobicContact CD2-CG2 3.95Å; L38-I66 HydrophobicContact CG-CG2 3.88Å; Y62-I66 PolarHBondContact O-N 2.65Å; Y62-I66 VanDerWaalsContact O-N 3.09Å; G63-I66 PolarHBondContact O-N 3.4Å; I66-Y68 PolarHBondContact O-N 2.92Å; I66-M69 HydrophobicContact CG1-CE 4.39Å; I66-M69 PolarHBondContact O-N 3.39Å; I66-H70 WeakPolarHBondContact O-CB 3.35Å; I66-H70 PolarHBondContact O-N 2.91Å
67	R	98.7	Very high	98.6	Very high	75 Å²	75	68.5 Å²	68.5	28%	0.283	33%	0.332	S	S	.	.	H	α-helix	trans	-61.3	-46.6	179.5	-177.6	-87.7	179.5	134.3	0.6	111.8	L38 I56 G63 W64 L65 H70 A71	L38-R67 HydrophobicContact CD2-CB 3.95Å; I56-R67 HydrophobicContact CG2-CB 4.37Å; G63-R67 VanDerWaalsContact O-CB 3.27Å; G63-R67 WeakPolarHBondContact O-CB 3.22Å; G63-R67 PolarHBondContact O-N 3.28Å; W64-R67 PolarHBondContact O-N 2.89Å; L65-R67 VanDerWaalsContact C-N 3.32Å; L65-R67 PolarHBondContact O-N 2.96Å; R67-H70 PolarHBondContact O-N 2.9Å; R67-A71 WeakPolarHBondContact O-CB 3.26Å; R67-A71 PolarHBondContact O-N 2.87Å
68	Y	98.6	Very high	98.6	Very high	115 Å²	115	69.3 Å²	69.3	45%	0.451	33%	0.332	S	S	.	.	H	α-helix	trans	-74.3	-32.5	-178.6	-73.9	-63.7	0	0	0	112.5	W64 L65 I66 A71 N72	W64-Y68 HydrophobicContact CB-CD2 4.46Å; W64-Y68 HydrophobicContact CE3-CD2 4.36Å; W64-Y68 WeakPolarHBondContact O-CD2 3.27Å; W64-Y68 PolarHBondContact O-N 3.46Å; L65-Y68 PolarHBondContact O-N 3.45Å; I66-Y68 PolarHBondContact O-N 2.92Å; Y68-A71 PolarHBondContact O-N 3.38Å; Y68-N72 VanDerWaalsContact O-CB 3.31Å; Y68-N72 WeakPolarHBondContact O-CB 3.44Å; Y68-N72 PolarHBondContact O-N 3.41Å; Y68-N72 PolarHBondContact O-ND2 3.29Å
69	M	98.6	Very high	98.6	Very high	49 Å²	49	64 Å²	64	24%	0.241	32%	0.318	C	S	.	.	H	α-helix	trans	-62.1	-42	169.2	-74.4	-170.7	-55.3	0	0	111.7	T34 L65 I66 G73 M227	T34-M69 HydrophobicContact CG2-CB 4.19Å; T34-M69 HydrophobicContact CG2-CE 4.17Å; L65-M69 HydrophobicContact CD1-CG 4.15Å; L65-M69 HydrophobicContact CD1-SD 4.3Å; L65-M69 HydrophobicContact CG-CE 3.98Å; L65-M69 HydrophobicContact CG-CG 4.45Å; L65-M69 HydrophobicContact CG-SD 4.24Å; L65-M69 WeakPolarHBondContact O-CB 3.37Å; L65-M69 VanDerWaalsContact O-CG 3.27Å; L65-M69 WeakPolarHBondContact O-CG 3.46Å; L65-M69 PolarHBondContact O-N 2.97Å; I66-M69 HydrophobicContact CG1-CE 4.39Å; I66-M69 PolarHBondContact O-N 3.39Å; M69-G73 VanDerWaalsContact O-CA 3.25Å; M69-G73 WeakPolarHBondContact O-CA 3.37Å; M69-G73 PolarHBondContact O-N 3.31Å; M69-M227 HydrophobicContact SD-CE 4.32Å
70	H	98.8	Very high	98.6	Very high	33 Å²	33	58.8 Å²	58.8	15%	0.153	29%	0.291	C	S	.	.	H	α-helix	trans	-62.7	-49.4	176.1	-164.6	77	0	0	0	111	Q31 T34 G35 L38 I66 R67 G73 A74 H169	Q31-H70 PolarHBondContact NE2-O 3.31Å; Q31-H70 PolarHBondContact O-CE1 3.4Å; Q31-H70 PolarHBondContact O-ND1 2.96Å; Q31-H70 PolarHBondContact OE1-CE1 3.4Å; Q31-H70 PolarHBondContact OE1-ND1 3.06Å; Q31-H70 PolarHBondContact OE1-O 3.34Å; T34-H70 PolarHBondContact OG1-ND1 3.09Å; G35-H70 WeakPolarHBondContact CA-CE1 3.12Å; G35-H70 PolarHBondContact N-ND1 3.39Å; L38-H70 HydrophobicContact CD1-CB 3.53Å; I66-H70 WeakPolarHBondContact O-CB 3.35Å; I66-H70 PolarHBondContact O-N 2.91Å; R67-H70 PolarHBondContact O-N 2.9Å; H70-G73 PolarHBondContact O-N 3.22Å; H70-A74 PolarHBondContact O-N 3.46Å; H70-A74 VanDerWaalsContact O-N 3.1Å; H70-H169 AromaticContact NE2-NE2 3.97Å
71	A	98.5	Very high	98.6	Very high	44 Å²	44	58.1 Å²	58.1	36%	0.364	29%	0.286	S	S	.	.	H	α-helix	trans	-64.6	-53.8	-178.9	0	0	0	0	0	113.1	R67 Y68 G73 A74	R67-A71 WeakPolarHBondContact O-CB 3.26Å; R67-A71 PolarHBondContact O-N 2.87Å; Y68-A71 PolarHBondContact O-N 3.38Å; A71-G73 VanDerWaalsContact C-N 3.29Å; A71-G73 PolarHBondContact O-N 3.16Å; A71-A74 WeakPolarHBondContact O-CB 3.42Å; A71-A74 PolarHBondContact O-N 3.21Å
72	N	98.6	Very high	98.6	Very high	84 Å²	84	57.4 Å²	57.4	45%	0.449	28%	0.276	S	S	.	.	H	α-helix	trans	-68.7	-31.7	178.7	-70.1	-38.3	0	0	0	111.6	Y68 A74 S75 M76 L226	Y68-N72 VanDerWaalsContact O-CB 3.31Å; Y68-N72 WeakPolarHBondContact O-CB 3.44Å; Y68-N72 PolarHBondContact O-N 3.41Å; Y68-N72 PolarHBondContact O-ND2 3.29Å; N72-A74 PolarHBondContact O-N 3.41Å; N72-S75 WeakPolarHBondContact O-CB 3.46Å; N72-S75 PolarHBondContact O-N 2.94Å; N72-S75 VanDerWaalsContact O-N 3.15Å; N72-M76 PolarHBondContact O-N 3.04Å; N72-L226 HydrophobicContact CB-CD1 4.05Å
73	G	98.8	Very high	98.7	Very high	3 Å²	3	52.2 Å²	52.2	3%	0.031	26%	0.26	C	S	.	.	H	α-helix	trans	-62.7	-30.2	174.7	0	0	0	0	0	112.1	Q31 M69 H70 A71 M76 F77	Q31-G73 PolarHBondContact NE2-O 3.21Å; M69-G73 VanDerWaalsContact O-CA 3.25Å; M69-G73 WeakPolarHBondContact O-CA 3.37Å; M69-G73 PolarHBondContact O-N 3.31Å; H70-G73 PolarHBondContact O-N 3.22Å; A71-G73 VanDerWaalsContact C-N 3.29Å; A71-G73 PolarHBondContact O-N 3.16Å; G73-M76 PolarHBondContact O-N 3.49Å; G73-F77 WeakPolarHBondContact O-CB 3.27Å; G73-F77 PolarHBondContact O-N 3.3Å
74	A	98.6	Very high	98.7	Very high	31 Å²	31	54 Å²	54	26%	0.256	27%	0.268	S	S	.	.	H	α-helix	trans	-66.8	-42.2	175.6	0	0	0	0	0	110.1	H70 A71 N72 F77 F78	H70-A74 PolarHBondContact O-N 3.46Å; H70-A74 VanDerWaalsContact O-N 3.1Å; A71-A74 WeakPolarHBondContact O-CB 3.42Å; A71-A74 PolarHBondContact O-N 3.21Å; N72-A74 PolarHBondContact O-N 3.41Å; A74-F77 VanDerWaalsContact O-CB 3.32Å; A74-F77 WeakPolarHBondContact O-CB 3.49Å; A74-F77 PolarHBondContact O-N 3.1Å; A74-F78 VanDerWaalsContact O-CD2 3.32Å; A74-F78 WeakPolarHBondContact O-CD2 3.25Å; A74-F78 PolarHBondContact O-N 3.22Å; A74-F78 VanDerWaalsContact O-N 3.16Å
75	S	98.4	Very high	98.7	Very high	71 Å²	71	49.4 Å²	49.4	50%	0.497	26%	0.255	S	S	.	.	H	α-helix	trans	-62.3	-44.4	172.5	-59.4	0	0	0	0	112.2	N72 F77 F78 I79	N72-S75 WeakPolarHBondContact O-CB 3.46Å; N72-S75 PolarHBondContact O-N 2.94Å; N72-S75 VanDerWaalsContact O-N 3.15Å; S75-F77 VanDerWaalsContact C-N 3.27Å; S75-F77 PolarHBondContact O-N 3.48Å; S75-F78 PolarHBondContact O-N 3.34Å; S75-F78 VanDerWaalsContact O-N 3.17Å; S75-I79 WeakPolarHBondContact O-CG1 3.41Å; S75-I79 PolarHBondContact O-N 3.49Å
76	M	98.6	Very high	98.7	Very high	16 Å²	16	48.7 Å²	48.7	8%	0.079	26%	0.259	C	S	.	.	H	α-helix	trans	-60.1	-38.5	175.4	-175.3	60.1	82.2	0	0	111.9	N72 G73 F78 I79 C80 M222 I225 L226	N72-M76 PolarHBondContact O-N 3.04Å; G73-M76 PolarHBondContact O-N 3.49Å; M76-F78 PolarHBondContact O-N 2.83Å; M76-I79 PolarHBondContact O-N 3.01Å; M76-C80 PolarHBondContact O-N 2.98Å; M76-C80 PolarHBondContact O-SG 2.82Å; M76-M222 HydrophobicContact CE-CG 4.02Å; M76-M222 HydrophobicContact CG-CG 3.8Å; M76-M222 HydrophobicContact CG-SD 4.09Å; M76-M222 HydrophobicContact SD-CG 3.86Å; M76-I225 HydrophobicContact CE-CB 3.76Å; M76-I225 HydrophobicContact CE-CG2 3.6Å; M76-L226 HydrophobicContact CB-CD1 4.12Å; M76-L226 HydrophobicContact CE-CB 4.4Å
77	F	98.7	Very high	98.7	Very high	16 Å²	16	48.2 Å²	48.2	7%	0.07	26%	0.255	C	S	.	.	H	α-helix	trans	-57.6	-49.4	174.4	-153.6	139	0	0	0	110.5	L24 C27 L28 Q31 G73 A74 S75 I79 C80 L81 V110	L24-F77 HydrophobicContact CD2-CD2 3.56Å; L24-F77 HydrophobicContact CD2-CE2 3.52Å; C27-F77 HydrophobicContact CB-CB 4.11Å; C27-F77 HydrophobicContact CB-CD1 3.65Å; C27-F77 HydrophobicContact CB-CD2 4.4Å; C27-F77 HydrophobicContact CB-CE1 4.14Å; C27-F77 HydrophobicContact CB-CG 3.79Å; L28-F77 HydrophobicContact CB-CE1 3.97Å; L28-F77 HydrophobicContact CB-CZ 4.17Å; L28-F77 HydrophobicContact CD1-CE1 4.19Å; L28-F77 HydrophobicContact CD1-CZ 4.49Å; Q31-F77 HydrophobicContact CG-CD1 4.04Å; G73-F77 WeakPolarHBondContact O-CB 3.27Å; G73-F77 PolarHBondContact O-N 3.3Å; A74-F77 VanDerWaalsContact O-CB 3.32Å; A74-F77 WeakPolarHBondContact O-CB 3.49Å; A74-F77 PolarHBondContact O-N 3.1Å; S75-F77 VanDerWaalsContact C-N 3.27Å; S75-F77 PolarHBondContact O-N 3.48Å; F77-I79 PolarHBondContact O-N 2.83Å; F77-C80 PolarHBondContact O-N 3.37Å; 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 4.43Å; F77-L81 HydrophobicContact CE2-CG 4.03Å; F77-L81 WeakPolarHBondContact O-CB 3.43Å; F77-L81 PolarHBondContact O-N 2.94Å; F77-V110 HydrophobicContact CD2-CG1 4.07Å; F77-V110 HydrophobicContact CE2-CG1 4.05Å; F77-V110 HydrophobicContact CE2-CG2 3.83Å; F77-V110 HydrophobicContact CG-CG1 4.43Å; F77-V110 HydrophobicContact CZ-CG1 4.38Å; F77-V110 HydrophobicContact CZ-CG2 3.83Å
78	F	98.7	Very high	98.7	Very high	42 Å²	42	44.8 Å²	44.8	18%	0.184	24%	0.243	C	C	.	.	H	α-helix	trans	-65.9	-37.9	178.3	-82.5	-78.3	0	0	0	113.5	A74 S75 M76 C80 L81 F82 V110 M111 A114	A74-F78 VanDerWaalsContact O-CD2 3.32Å; A74-F78 WeakPolarHBondContact O-CD2 3.25Å; A74-F78 PolarHBondContact O-N 3.22Å; A74-F78 VanDerWaalsContact O-N 3.16Å; S75-F78 PolarHBondContact O-N 3.34Å; S75-F78 VanDerWaalsContact O-N 3.17Å; M76-F78 PolarHBondContact O-N 2.83Å; F78-C80 VanDerWaalsContact C-N 3.33Å; F78-C80 PolarHBondContact O-N 3.34Å; F78-L81 HydrophobicContact CD1-CD1 4.19Å; F78-L81 HydrophobicContact CE1-CD1 4.28Å; F78-L81 PolarHBondContact O-N 2.96Å; F78-F82 HydrophobicContact CB-CD2 4.44Å; F78-F82 HydrophobicContact CB-CE2 4Å; F78-F82 HydrophobicContact CD1-CE1 4.41Å; F78-F82 HydrophobicContact CD1-CE2 4.16Å; F78-F82 AromaticContact CD1-CZ 3.82Å; F78-F82 HydrophobicContact CD1-CZ 3.82Å; F78-F82 WeakPolarHBondContact O-CD2 3.43Å; F78-F82 VanDerWaalsContact O-CG 3.3Å; F78-F82 WeakPolarHBondContact O-CG 3.32Å; F78-F82 PolarHBondContact O-N 2.85Å; F78-V110 HydrophobicContact CE2-CG1 4.26Å; F78-V110 HydrophobicContact CZ-CG1 3.99Å; F78-M111 HydrophobicContact CE1-CG 3.78Å; F78-M111 HydrophobicContact CZ-CG 4.14Å; F78-A114 HydrophobicContact CE2-CB 3.52Å; F78-A114 HydrophobicContact CZ-CB 3.92Å
79	I	98.7	Very high	98.7	Very high	91 Å²	91	44 Å²	44	47%	0.467	25%	0.247	S	C	.	.	H	α-helix	trans	-57.6	-50.2	172.9	-68.5	166.6	0	0	0	109.6	S75 M76 F77 L81 F82 L83	S75-I79 WeakPolarHBondContact O-CG1 3.41Å; S75-I79 PolarHBondContact O-N 3.49Å; 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 3.07Å; I79-F82 PolarHBondContact O-N 3.44Å; I79-L83 HydrophobicContact CG2-CD1 3.73Å; I79-L83 VanDerWaalsContact O-CG 3.25Å; I79-L83 WeakPolarHBondContact O-CG 3.42Å; I79-L83 PolarHBondContact O-N 3.28Å
80	C	98.8	Very high	98.7	Very high	2 Å²	2	50.7 Å²	50.7	1%	0.014	27%	0.27	C	S	.	.	H	α-helix	trans	-61.9	-39.8	177.4	-66.7	0	0	0	0	112.1	F20 L24 M76 F77 F78 L83 H84	F20-C80 HydrophobicContact CD1-CB 4.14Å; L24-C80 HydrophobicContact CD2-CB 3.64Å; L24-C80 HydrophobicContact CG-CB 3.95Å; M76-C80 PolarHBondContact O-N 2.98Å; M76-C80 PolarHBondContact O-SG 2.82Å; F77-C80 PolarHBondContact O-N 3.37Å; F78-C80 VanDerWaalsContact C-N 3.33Å; F78-C80 PolarHBondContact O-N 3.34Å; C80-L83 PolarHBondContact O-N 3.1Å; C80-H84 WeakPolarHBondContact O-CB 3.32Å; C80-H84 PolarHBondContact O-N 3.45Å
81	L	98.8	Very high	98.7	Very high	13 Å²	13	51.4 Å²	51.4	7%	0.068	27%	0.272	C	S	.	.	H	α-helix	trans	-61.9	-50.3	178.7	-87.4	170.3	0	0	0	110.8	L24 F77 F78 I79 L83 H84 V85 L107 V110	L24-L81 HydrophobicContact CD1-CD2 4.11Å; L24-L81 HydrophobicContact CD2-CB 4.31Å; L24-L81 HydrophobicContact CD2-CD2 3.87Å; 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 4.43Å; F77-L81 HydrophobicContact CE2-CG 4.03Å; F77-L81 WeakPolarHBondContact O-CB 3.43Å; F77-L81 PolarHBondContact O-N 2.94Å; F78-L81 HydrophobicContact CD1-CD1 4.19Å; F78-L81 HydrophobicContact CE1-CD1 4.28Å; F78-L81 PolarHBondContact O-N 2.96Å; I79-L81 VanDerWaalsContact C-N 3.33Å; I79-L81 PolarHBondContact O-N 3.07Å; L81-L83 VanDerWaalsContact C-N 3.34Å; L81-L83 PolarHBondContact O-N 3.15Å; L81-H84 PolarHBondContact O-N 3.19Å; L81-V85 WeakPolarHBondContact O-CB 3.5Å; L81-V85 VanDerWaalsContact O-CG2 3.32Å; L81-V85 WeakPolarHBondContact O-CG2 3.19Å; L81-V85 PolarHBondContact O-N 3.48Å; L81-L107 HydrophobicContact CD1-CD1 4.23Å; L81-V110 HydrophobicContact CD1-CB 3.97Å; L81-V110 HydrophobicContact CD1-CG1 3.64Å; L81-V110 HydrophobicContact CD1-CG2 4.36Å
82	F	98.8	Very high	98.7	Very high	128 Å²	128	50.2 Å²	50.2	56%	0.561	26%	0.264	S	S	*	.	H	α-helix	trans	-65.5	-38.7	-178.2	-62.9	-40.8	0	0	0	112	F78 I79 G86	F78-F82 HydrophobicContact CB-CD2 4.44Å; F78-F82 HydrophobicContact CB-CE2 4Å; F78-F82 HydrophobicContact CD1-CE1 4.41Å; F78-F82 HydrophobicContact CD1-CE2 4.16Å; F78-F82 AromaticContact CD1-CZ 3.82Å; F78-F82 HydrophobicContact CD1-CZ 3.82Å; F78-F82 WeakPolarHBondContact O-CD2 3.43Å; F78-F82 VanDerWaalsContact O-CG 3.3Å; F78-F82 WeakPolarHBondContact O-CG 3.32Å; F78-F82 PolarHBondContact O-N 2.85Å; I79-F82 PolarHBondContact O-N 3.44Å; F82-G86 PolarHBondContact O-N 3.17Å
83	L	98.8	Very high	98.7	Very high	60 Å²	60	47 Å²	47	31%	0.314	25%	0.249	S	C	.	.	H	α-helix	trans	-67.7	-38	175	-64.1	168.4	0	0	0	111.5	W17 F20 I79 C80 L81 G86 R87	W17-L83 HydrophobicContact CH2-CD2 4.28Å; W17-L83 HydrophobicContact CZ3-CB 4.33Å; W17-L83 HydrophobicContact CZ3-CD2 3.74Å; F20-L83 HydrophobicContact CD1-CB 4.01Å; F20-L83 HydrophobicContact CD1-CD1 4.24Å; F20-L83 HydrophobicContact CD2-CB 3.85Å; F20-L83 HydrophobicContact CE1-CB 3.93Å; F20-L83 HydrophobicContact CE1-CD1 3.4Å; F20-L83 VanDerWaalsContact CE1-CD1 3.4Å; F20-L83 HydrophobicContact CE1-CG 4.3Å; F20-L83 HydrophobicContact CE2-CB 3.76Å; F20-L83 HydrophobicContact CE2-CD1 4.12Å; F20-L83 HydrophobicContact CE2-CG 4.47Å; F20-L83 HydrophobicContact CG-CB 3.99Å; F20-L83 HydrophobicContact CZ-CB 3.82Å; F20-L83 HydrophobicContact CZ-CD1 3.35Å; F20-L83 HydrophobicContact CZ-CG 4.15Å; I79-L83 HydrophobicContact CG2-CD1 3.73Å; I79-L83 VanDerWaalsContact O-CG 3.25Å; I79-L83 WeakPolarHBondContact O-CG 3.42Å; I79-L83 PolarHBondContact O-N 3.28Å; C80-L83 PolarHBondContact O-N 3.1Å; L81-L83 VanDerWaalsContact C-N 3.34Å; L81-L83 PolarHBondContact O-N 3.15Å; L83-G86 PolarHBondContact O-N 3.28Å; L83-R87 WeakPolarHBondContact O-CB 3.32Å; L83-R87 PolarHBondContact O-N 3.32Å
84	H	98.8	Very high	98.7	Very high	38 Å²	38	52.1 Å²	52.1	18%	0.176	27%	0.268	C	S	.	.	H	α-helix	trans	-64.9	-45.8	175.7	-170	97	0	0	0	112.4	F20 G21 L24 C80 L81 R87 G88	F20-H84 HydrophobicContact CB-CB 3.91Å; G21-H84 PolarHBondContact N-ND1 3.45Å; L24-H84 HydrophobicContact CD1-CB 3.76Å; C80-H84 WeakPolarHBondContact O-CB 3.32Å; C80-H84 PolarHBondContact O-N 3.45Å; L81-H84 PolarHBondContact O-N 3.19Å; H84-R87 PolarHBondContact CE1-NH2 2.83Å; H84-R87 PolarHBondContact ND1-NH2 2.94Å; H84-G88 PolarHBondContact O-N 3.27Å; H84-G88 VanDerWaalsContact O-N 3.08Å
85	V	98.9	Very high	98.7	Very high	43 Å²	43	54.9 Å²	54.9	26%	0.261	28%	0.281	S	S	.	.	H	α-helix	trans	-64.2	-45.8	175.2	171.7	0	0	0	0	110.3	L81 R87 G88 L89 W100	L81-V85 WeakPolarHBondContact O-CB 3.5Å; L81-V85 VanDerWaalsContact O-CG2 3.32Å; L81-V85 WeakPolarHBondContact O-CG2 3.19Å; L81-V85 PolarHBondContact O-N 3.48Å; V85-R87 VanDerWaalsContact C-N 3.35Å; V85-R87 PolarHBondContact O-N 3.38Å; V85-G88 WeakPolarHBondContact O-CA 3.39Å; V85-G88 PolarHBondContact O-N 3.5Å; V85-L89 HydrophobicContact CG1-CD1 4.21Å; V85-L89 HydrophobicContact CG1-CG 4.45Å; V85-L89 WeakPolarHBondContact O-CG 3.12Å; V85-L89 PolarHBondContact O-N 3.16Å; V85-W100 HydrophobicContact CG1-CH2 4.24Å
86	G	98.8	Very high	98.7	Very high	34 Å²	34	53.8 Å²	53.8	35%	0.351	27%	0.268	S	S	.	.	H	α-helix	trans	-58.3	-43.7	177.8	0	0	0	0	0	112.6	F82 L83 G88 L89 Y90	F82-G86 PolarHBondContact O-N 3.17Å; L83-G86 PolarHBondContact O-N 3.28Å; G86-G88 VanDerWaalsContact C-N 3.32Å; G86-G88 PolarHBondContact O-N 3.28Å; G86-L89 PolarHBondContact O-N 2.88Å; G86-Y90 WeakPolarHBondContact O-CB 3.4Å; G86-Y90 PolarHBondContact O-N 3.01Å
87	R	98.8	Very high	98.7	Very high	25 Å²	25	58.3 Å²	58.3	9%	0.094	29%	0.29	C	S	.	.	H	α-helix	trans	-56	-48.2	170	177.6	-77.5	-65	-97	-5.7	110.8	W17 W18 L83 H84 V85 L89 Y90 Y91	W17-R87 HydrophobicContact CB-CB 4.12Å; W17-R87 HydrophobicContact CB-CG 3.6Å; W18-R87 HydrophobicContact CE3-CG 4.18Å; W18-R87 HydrophobicContact CH2-CG 4.44Å; W18-R87 HydrophobicContact CZ3-CG 4.03Å; W18-R87 VanDerWaalsContact NE1-NH1 3.2Å; L83-R87 WeakPolarHBondContact O-CB 3.32Å; L83-R87 PolarHBondContact O-N 3.32Å; H84-R87 PolarHBondContact CE1-NH2 2.83Å; H84-R87 PolarHBondContact ND1-NH2 2.94Å; V85-R87 VanDerWaalsContact C-N 3.35Å; V85-R87 PolarHBondContact O-N 3.38Å; R87-L89 VanDerWaalsContact C-N 3.31Å; R87-L89 PolarHBondContact O-N 3.32Å; R87-Y90 PolarHBondContact O-N 2.93Å; R87-Y91 HydrophobicContact CG-CD2 3.79Å; R87-Y91 HydrophobicContact CG-CE2 4.13Å; R87-Y91 WeakPolarHBondContact O-CD2 3.1Å; R87-Y91 PolarHBondContact O-N 3.4Å
88	G	98.8	Very high	98.7	Very high	3 Å²	3	62.5 Å²	62.5	3%	0.031	31%	0.31	C	S	.	.	H	α-helix	trans	-62.2	-38.3	-177.4	0	0	0	0	0	113.2	H84 V85 G86 G92 S93	H84-G88 PolarHBondContact O-N 3.27Å; H84-G88 VanDerWaalsContact O-N 3.08Å; V85-G88 WeakPolarHBondContact O-CA 3.39Å; V85-G88 PolarHBondContact O-N 3.5Å; G86-G88 VanDerWaalsContact C-N 3.32Å; G86-G88 PolarHBondContact O-N 3.28Å; G88-G92 PolarHBondContact O-N 3.34Å; G88-S93 PolarHBondContact O-N 3.24Å
89	L	98.8	Very high	98.7	Very high	99 Å²	99	61.1 Å²	61.1	52%	0.518	31%	0.305	S	S	.	.	H	α-helix	trans	-66.5	-51.8	172.7	-66.7	173.6	0	0	0	111.7	V85 G86 R87 Y91 G92 Y94 W100	V85-L89 HydrophobicContact CG1-CD1 4.21Å; V85-L89 HydrophobicContact CG1-CG 4.45Å; V85-L89 WeakPolarHBondContact O-CG 3.12Å; V85-L89 PolarHBondContact O-N 3.16Å; G86-L89 PolarHBondContact O-N 2.88Å; R87-L89 VanDerWaalsContact C-N 3.31Å; R87-L89 PolarHBondContact O-N 3.32Å; L89-Y91 PolarHBondContact O-N 2.96Å; L89-G92 PolarHBondContact O-N 3.42Å; L89-Y94 HydrophobicContact CD2-CD1 4.37Å; L89-W100 HydrophobicContact CD2-CH2 3.79Å; L89-W100 HydrophobicContact CD2-CZ2 3.91Å; L89-W100 HydrophobicContact CG-CH2 4.01Å
90	Y	98.8	Very high	98.7	Very high	188 Å²	188	60 Å²	60	74%	0.737	30%	0.295	S	S	*	.	H	α-helix	trans	-62.2	-42.2	-174.2	-174.8	-91.3	0	0	0	112.8	G86 R87	G86-Y90 WeakPolarHBondContact O-CB 3.4Å; G86-Y90 PolarHBondContact O-N 3.01Å; R87-Y90 PolarHBondContact O-N 2.93Å
91	Y	98.6	Very high	98.7	Very high	48 Å²	48	64.3 Å²	64.3	19%	0.188	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	11.4	-178.3	-64	-72.7	0	0	0	113.9	W17 W18 R87 L89 S93 N193 P195	W17-Y91 HydrophobicContact CB-CE2 4.41Å; W17-Y91 HydrophobicContact CG-CE2 4.4Å; W18-Y91 HydrophobicContact CH2-CD1 4.19Å; W18-Y91 AromaticContact CH2-CD2 3.56Å; W18-Y91 HydrophobicContact CH2-CD2 3.56Å; W18-Y91 HydrophobicContact CH2-CE2 4.02Å; W18-Y91 AromaticContact CH2-CG 3.64Å; W18-Y91 HydrophobicContact CH2-CG 3.64Å; W18-Y91 AromaticContact CZ3-CD2 3.6Å; W18-Y91 HydrophobicContact CZ3-CD2 3.6Å; W18-Y91 AromaticContact CZ3-CE2 3.6Å; W18-Y91 HydrophobicContact CZ3-CE2 3.6Å; W18-Y91 HydrophobicContact CZ3-CG 4.11Å; R87-Y91 HydrophobicContact CG-CD2 3.79Å; R87-Y91 HydrophobicContact CG-CE2 4.13Å; R87-Y91 WeakPolarHBondContact O-CD2 3.1Å; R87-Y91 PolarHBondContact O-N 3.4Å; L89-Y91 PolarHBondContact O-N 2.96Å; Y91-S93 PolarHBondContact O-N 3.41Å; Y91-N193 PolarHBondContact O-ND2 2.91Å; Y91-P195 HydrophobicContact CD1-CB 4.31Å; Y91-P195 HydrophobicContact CE1-CB 3.72Å; Y91-P195 HydrophobicContact CE1-CG 4.45Å
92	G	98.5	Very high	98.7	Very high	20 Å²	20	65 Å²	65	21%	0.206	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.5	26.5	178.2	0	0	0	0	0	114.4	G88 L89 Y94 T95	G88-G92 PolarHBondContact O-N 3.34Å; L89-G92 PolarHBondContact O-N 3.42Å; G92-Y94 PolarHBondContact O-N 3.06Å; G92-T95 WeakPolarHBondContact O-CG2 3.3Å; G92-T95 PolarHBondContact O-N 3.48Å; G92-T95 PolarHBondContact O-OG1 2.83Å
93	S	98.6	Very high	98.7	Very high	17 Å²	17	59.9 Å²	59.9	12%	0.119	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-73.8	-11.2	-179	-50	0	0	0	0	112.7	G88 Y91 T95 F96 N193	G88-S93 PolarHBondContact O-N 3.24Å; Y91-S93 PolarHBondContact O-N 3.41Å; S93-T95 PolarHBondContact O-N 2.86Å; S93-F96 PolarHBondContact O-N 3.49Å; S93-N193 PolarHBondContact OG-ND2 3.48Å
94	Y	98.5	Very high	98.7	Very high	109 Å²	109	59.4 Å²	59.4	43%	0.427	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-64.7	-11.4	172.2	60.1	-101.7	0	0	0	113.5	L89 G92 F96	L89-Y94 HydrophobicContact CD2-CD1 4.37Å; G92-Y94 PolarHBondContact O-N 3.06Å; Y94-F96 PolarHBondContact O-N 2.86Å
95	T	98.3	Very high	98.7	Very high	89 Å²	89	62.1 Å²	62.1	55%	0.546	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-67.4	-20.1	173.7	55.3	0	0	0	0	112.8	G92 S93 M97	G92-T95 WeakPolarHBondContact O-CG2 3.3Å; G92-T95 PolarHBondContact O-N 3.48Å; G92-T95 PolarHBondContact O-OG1 2.83Å; S93-T95 PolarHBondContact O-N 2.86Å; T95-M97 VanDerWaalsContact C-N 3.26Å; T95-M97 PolarHBondContact O-N 3.23Å
96	F	98.4	Very high	98.7	Very high	48 Å²	48	61.1 Å²	61.1	21%	0.211	31%	0.313	C	S	.	.	S	Bend	trans	-78.2	77.8	166.5	-56	-31	0	0	0	109.4	S93 Y94 E98 T99 W100 T190 N193	S93-F96 PolarHBondContact O-N 3.49Å; Y94-F96 PolarHBondContact O-N 2.86Å; F96-E98 PolarHBondContact O-N 3.45Å; F96-T99 PolarHBondContact O-N 3.42Å; F96-W100 VanDerWaalsContact O-CB 3.3Å; F96-W100 WeakPolarHBondContact O-CB 3.38Å; F96-W100 PolarHBondContact O-N 3.33Å; F96-T190 HydrophobicContact CD1-CG2 4.25Å; F96-N193 HydrophobicContact CE2-CB 3.69Å; F96-N193 HydrophobicContact CZ-CB 3.97Å
97	M	98.5	Very high	98.7	Very high	111 Å²	111	61.2 Å²	61.2	55%	0.547	31%	0.305	S	S	.	.	H	α-helix	trans	-57.9	-42.3	-163.8	-68.4	-63.4	-121	0	0	113.7	T95 N101	T95-M97 VanDerWaalsContact C-N 3.26Å; T95-M97 PolarHBondContact O-N 3.23Å; M97-N101 VanDerWaalsContact O-CB 3.26Å; M97-N101 WeakPolarHBondContact O-CB 3.4Å; M97-N101 PolarHBondContact O-N 3.01Å; M97-N101 PolarHBondContact O-ND2 2.92Å
98	E	98.6	Very high	98.7	Very high	105 Å²	105	65.9 Å²	65.9	49%	0.491	33%	0.326	S	S	.	.	H	α-helix	trans	-64.9	-53.5	179.4	-61.8	77.2	-174.4	0	0	110.1	F96 W100 N101 I102 F186	F96-E98 PolarHBondContact O-N 3.45Å; E98-W100 VanDerWaalsContact C-N 3.32Å; E98-W100 PolarHBondContact O-N 3.08Å; E98-N101 PolarHBondContact O-N 2.99Å; E98-I102 WeakPolarHBondContact O-CG1 3.45Å; E98-I102 PolarHBondContact O-N 3.45Å; E98-F186 HydrophobicContact CB-CB 4.06Å; E98-F186 HydrophobicContact CB-CD1 3.52Å; E98-F186 HydrophobicContact CB-CD2 4.01Å; E98-F186 HydrophobicContact CB-CE1 3.87Å; E98-F186 HydrophobicContact CB-CE2 4.31Å; E98-F186 HydrophobicContact CB-CG 3.6Å; E98-F186 HydrophobicContact CB-CZ 4.24Å; E98-F186 HydrophobicContact CG-CD1 3.95Å; E98-F186 HydrophobicContact CG-CE1 3.9Å; E98-F186 HydrophobicContact CG-CZ 4.41Å
99	T	98.8	Very high	98.7	Very high	13 Å²	13	66.5 Å²	66.5	8%	0.08	33%	0.331	C	S	.	.	H	α-helix	trans	-55.5	-47.6	175.9	-57	0	0	0	0	110.9	F96 I102 G103 H183 F186 L187	F96-T99 PolarHBondContact O-N 3.42Å; T99-I102 PolarHBondContact O-N 3.41Å; T99-G103 PolarHBondContact O-N 3.37Å; T99-H183 WeakPolarHBondContact CG2-CE1 3.33Å; T99-H183 PolarHBondContact O-CE1 3.47Å; T99-H183 PolarHBondContact O-ND1 3.4Å; T99-F186 VanDerWaalsContact OG1-C 3.26Å; T99-F186 WeakPolarHBondContact OG1-CB 3.43Å; T99-L187 HydrophobicContact CG2-CB 4.07Å; T99-L187 HydrophobicContact CG2-CD1 4.38Å; T99-L187 PolarHBondContact OG1-N 3.08Å
100	W	98.9	Very high	98.7	Very high	68 Å²	68	62.2 Å²	62.2	26%	0.258	31%	0.309	S	S	.	.	H	α-helix	trans	-63.1	-47.9	-179.5	-177.1	-101.5	0	0	0	112.6	V85 L89 F96 E98 I102 G103 V104	V85-W100 HydrophobicContact CG1-CH2 4.24Å; L89-W100 HydrophobicContact CD2-CH2 3.79Å; L89-W100 HydrophobicContact CD2-CZ2 3.91Å; L89-W100 HydrophobicContact CG-CH2 4.01Å; F96-W100 VanDerWaalsContact O-CB 3.3Å; F96-W100 WeakPolarHBondContact O-CB 3.38Å; F96-W100 PolarHBondContact O-N 3.33Å; E98-W100 VanDerWaalsContact C-N 3.32Å; E98-W100 PolarHBondContact O-N 3.08Å; W100-I102 PolarHBondContact O-N 3.24Å; W100-G103 CarbonylContact O-C 3.5Å; W100-G103 VanDerWaalsContact O-CA 3.29Å; W100-G103 WeakPolarHBondContact O-CA 3.24Å; W100-G103 PolarHBondContact O-N 3.29Å; W100-V104 PolarHBondContact O-N 3.35Å
101	N	98.8	Very high	98.7	Very high	92 Å²	92	57.5 Å²	57.5	49%	0.492	30%	0.295	S	S	.	.	H	α-helix	trans	-66.2	-38.3	-179.5	-73.6	-39.1	0	0	0	112	M97 E98 G103 V104 L105	M97-N101 VanDerWaalsContact O-CB 3.26Å; M97-N101 WeakPolarHBondContact O-CB 3.4Å; M97-N101 PolarHBondContact O-N 3.01Å; M97-N101 PolarHBondContact O-ND2 2.92Å; E98-N101 PolarHBondContact O-N 2.99Å; N101-G103 VanDerWaalsContact C-N 3.27Å; N101-G103 PolarHBondContact O-N 3.41Å; N101-V104 PolarHBondContact O-N 3.21Å; N101-L105 PolarHBondContact O-N 3.04Å
102	I	98.8	Very high	98.7	Very high	26 Å²	26	57.1 Å²	57.1	13%	0.133	30%	0.301	C	S	.	.	H	α-helix	trans	-63.3	-36.8	169.7	-60.9	-62	0	0	0	110.7	E98 T99 W100 V104 L105 L106 V182 H183 F186	E98-I102 WeakPolarHBondContact O-CG1 3.45Å; E98-I102 PolarHBondContact O-N 3.45Å; T99-I102 PolarHBondContact O-N 3.41Å; W100-I102 PolarHBondContact O-N 3.24Å; I102-V104 VanDerWaalsContact C-N 3.32Å; I102-V104 PolarHBondContact O-N 3.23Å; I102-L105 HydrophobicContact CD1-CD1 4.2Å; I102-L105 PolarHBondContact O-N 2.81Å; I102-L106 HydrophobicContact CG2-CD1 4.24Å; I102-L106 HydrophobicContact CG2-CG 4.49Å; I102-L106 WeakPolarHBondContact O-CG 3.42Å; I102-L106 PolarHBondContact O-N 2.92Å; I102-V182 HydrophobicContact CD1-CG1 4.22Å; I102-V182 HydrophobicContact CG1-CG1 4.29Å; I102-H183 HydrophobicContact CB-CB 4.4Å; I102-H183 HydrophobicContact CG2-CB 3.66Å; I102-F186 HydrophobicContact CG1-CD2 4.19Å; I102-F186 HydrophobicContact CG1-CE2 4.39Å
103	G	98.8	Very high	98.7	Very high	22 Å²	22	56.7 Å²	56.7	23%	0.227	30%	0.295	C	S	.	.	H	α-helix	trans	-59.2	-39.3	172.6	0	0	0	0	0	113.4	T99 W100 N101 L106 L107 H183	T99-G103 PolarHBondContact O-N 3.37Å; W100-G103 CarbonylContact O-C 3.5Å; W100-G103 VanDerWaalsContact O-CA 3.29Å; W100-G103 WeakPolarHBondContact O-CA 3.24Å; W100-G103 PolarHBondContact O-N 3.29Å; N101-G103 VanDerWaalsContact C-N 3.27Å; N101-G103 PolarHBondContact O-N 3.41Å; G103-L106 WeakPolarHBondContact O-CB 3.49Å; G103-L106 PolarHBondContact O-N 3.46Å; G103-L107 PolarHBondContact O-N 3.3Å; G103-H183 PolarHBondContact N-ND1 2.92Å
104	V	98.8	Very high	98.7	Very high	50 Å²	50	57.3 Å²	57.3	30%	0.303	30%	0.301	S	S	.	.	H	α-helix	trans	-65.9	-42.7	173.8	174.9	0	0	0	0	111.2	W100 N101 I102 L106 L107 F108	W100-V104 PolarHBondContact O-N 3.35Å; N101-V104 PolarHBondContact O-N 3.21Å; I102-V104 VanDerWaalsContact C-N 3.32Å; I102-V104 PolarHBondContact O-N 3.23Å; V104-L106 VanDerWaalsContact C-N 3.34Å; V104-L106 PolarHBondContact O-N 3.27Å; V104-L107 WeakPolarHBondContact O-CB 3.47Å; V104-L107 PolarHBondContact O-N 3.28Å; V104-F108 HydrophobicContact CG1-CD2 3.8Å; V104-F108 HydrophobicContact CG1-CE2 3.52Å; V104-F108 VanDerWaalsContact O-CD2 3.25Å; V104-F108 WeakPolarHBondContact O-CD2 3.45Å; V104-F108 PolarHBondContact O-N 3.3Å; V104-F108 VanDerWaalsContact O-N 3.1Å
105	L	98.8	Very high	98.7	Very high	95 Å²	95	54.4 Å²	54.4	50%	0.497	29%	0.291	S	S	.	.	H	α-helix	trans	-61.9	-42.3	174.4	-66.2	179.9	0	0	0	111.8	N101 I102 L107 F108 A109	N101-L105 PolarHBondContact O-N 3.04Å; I102-L105 HydrophobicContact CD1-CD1 4.2Å; I102-L105 PolarHBondContact O-N 2.81Å; L105-L107 PolarHBondContact O-N 2.92Å; L105-F108 PolarHBondContact O-N 3.49Å; L105-A109 VanDerWaalsContact O-CB 3.32Å; L105-A109 WeakPolarHBondContact O-CB 3.45Å; L105-A109 PolarHBondContact O-N 2.87Å
106	L	98.9	Very high	98.7	Very high	21 Å²	21	51 Å²	51	11%	0.11	27%	0.269	C	S	.	.	H	α-helix	trans	-59.3	-44.9	174.5	-79.5	166.6	0	0	0	111.7	I102 G103 V104 F108 A109 V110 I176 L179 A180 H183	I102-L106 HydrophobicContact CG2-CD1 4.24Å; I102-L106 HydrophobicContact CG2-CG 4.49Å; I102-L106 WeakPolarHBondContact O-CG 3.42Å; I102-L106 PolarHBondContact O-N 2.92Å; G103-L106 WeakPolarHBondContact O-CB 3.49Å; G103-L106 PolarHBondContact O-N 3.46Å; V104-L106 VanDerWaalsContact C-N 3.34Å; V104-L106 PolarHBondContact O-N 3.27Å; L106-F108 PolarHBondContact O-N 3.06Å; L106-A109 PolarHBondContact O-N 3.23Å; L106-V110 WeakPolarHBondContact O-CG2 3.38Å; L106-V110 PolarHBondContact O-N 2.94Å; L106-I176 HydrophobicContact CD2-CG2 3.83Å; L106-I176 WeakPolarHBondContact CD2-O 3.07Å; L106-L179 HydrophobicContact CD2-CB 3.57Å; L106-L179 HydrophobicContact CG-CB 4.06Å; L106-A180 HydrophobicContact CD2-CB 4.4Å; L106-H183 HydrophobicContact CD1-CB 3.81Å
107	L	98.8	Very high	98.7	Very high	36 Å²	36	49.6 Å²	49.6	19%	0.188	27%	0.268	C	S	.	.	H	α-helix	trans	-56.8	-52	176.8	175.2	62.6	0	0	0	111.1	L81 G103 V104 L105 A109 V110 M111	L81-L107 HydrophobicContact CD1-CD1 4.23Å; G103-L107 PolarHBondContact O-N 3.3Å; V104-L107 WeakPolarHBondContact O-CB 3.47Å; V104-L107 PolarHBondContact O-N 3.28Å; L105-L107 PolarHBondContact O-N 2.92Å; L107-A109 PolarHBondContact O-N 3.46Å; L107-V110 PolarHBondContact O-N 2.82Å; L107-M111 HydrophobicContact CD1-CG 4.42Å; L107-M111 HydrophobicContact CD1-SD 4.22Å; L107-M111 HydrophobicContact CG-SD 4.1Å; L107-M111 VanDerWaalsContact O-CG 3.28Å; L107-M111 WeakPolarHBondContact O-CG 3.33Å; L107-M111 PolarHBondContact O-N 3.25Å
108	F	98.8	Very high	98.8	Very high	124 Å²	124	50.8 Å²	50.8	54%	0.544	27%	0.267	S	S	.	.	H	α-helix	trans	-65.4	-37.1	179.4	-73.5	-59.6	0	0	0	112.9	V104 L105 L106 M111 A112	V104-F108 HydrophobicContact CG1-CD2 3.8Å; V104-F108 HydrophobicContact CG1-CE2 3.52Å; V104-F108 VanDerWaalsContact O-CD2 3.25Å; V104-F108 WeakPolarHBondContact O-CD2 3.45Å; V104-F108 PolarHBondContact O-N 3.3Å; V104-F108 VanDerWaalsContact O-N 3.1Å; L105-F108 PolarHBondContact O-N 3.49Å; L106-F108 PolarHBondContact O-N 3.06Å; F108-M111 HydrophobicContact CD1-SD 4.17Å; F108-M111 PolarHBondContact O-N 2.94Å; F108-A112 WeakPolarHBondContact O-CB 3.35Å; F108-A112 PolarHBondContact O-N 3.34Å
109	A	98.8	Very high	98.8	Very high	16 Å²	16	45.9 Å²	45.9	13%	0.132	24%	0.244	C	C	.	.	H	α-helix	trans	-64.2	-42.8	176.1	0	0	0	0	0	111.9	L105 L106 L107 A112 T113 I176	L105-A109 VanDerWaalsContact O-CB 3.32Å; L105-A109 WeakPolarHBondContact O-CB 3.45Å; L105-A109 PolarHBondContact O-N 2.87Å; L106-A109 PolarHBondContact O-N 3.23Å; L107-A109 PolarHBondContact O-N 3.46Å; A109-A112 PolarHBondContact O-N 3.34Å; A109-T113 WeakPolarHBondContact O-CB 3.48Å; A109-T113 PolarHBondContact O-N 3.42Å; A109-T113 PolarHBondContact O-OG1 3.4Å; A109-I176 HydrophobicContact CB-CD1 4.17Å; A109-I176 HydrophobicContact CB-CG1 3.69Å
110	V	98.9	Very high	98.8	Very high	9 Å²	9	46 Å²	46	6%	0.055	24%	0.244	C	C	.	.	H	α-helix	trans	-66.5	-40.3	175.5	175.7	0	0	0	0	111	F77 F78 L81 L106 L107 T113 A114 I176	F77-V110 HydrophobicContact CD2-CG1 4.07Å; F77-V110 HydrophobicContact CE2-CG1 4.05Å; F77-V110 HydrophobicContact CE2-CG2 3.83Å; F77-V110 HydrophobicContact CG-CG1 4.43Å; F77-V110 HydrophobicContact CZ-CG1 4.38Å; F77-V110 HydrophobicContact CZ-CG2 3.83Å; F78-V110 HydrophobicContact CE2-CG1 4.26Å; F78-V110 HydrophobicContact CZ-CG1 3.99Å; L81-V110 HydrophobicContact CD1-CB 3.97Å; L81-V110 HydrophobicContact CD1-CG1 3.64Å; L81-V110 HydrophobicContact CD1-CG2 4.36Å; L106-V110 WeakPolarHBondContact O-CG2 3.38Å; L106-V110 PolarHBondContact O-N 2.94Å; L107-V110 PolarHBondContact O-N 2.82Å; V110-T113 PolarHBondContact O-N 3.12Å; V110-A114 WeakPolarHBondContact O-CB 3.38Å; V110-A114 PolarHBondContact O-N 3Å; V110-I176 HydrophobicContact CG2-CD1 3.87Å; V110-I176 HydrophobicContact CG2-CG1 4.44Å; V110-I176 HydrophobicContact CG2-CG2 4.15Å
111	M	98.7	Very high	98.7	Very high	89 Å²	89	44.7 Å²	44.7	44%	0.438	24%	0.244	S	C	.	.	H	α-helix	trans	-57.3	-50.4	173.3	-72.7	174.5	69.7	0	0	112.3	F78 L107 F108 T113 A114 F115	F78-M111 HydrophobicContact CE1-CG 3.78Å; F78-M111 HydrophobicContact CZ-CG 4.14Å; L107-M111 HydrophobicContact CD1-CG 4.42Å; L107-M111 HydrophobicContact CD1-SD 4.22Å; L107-M111 HydrophobicContact CG-SD 4.1Å; L107-M111 VanDerWaalsContact O-CG 3.28Å; L107-M111 WeakPolarHBondContact O-CG 3.33Å; L107-M111 PolarHBondContact O-N 3.25Å; F108-M111 HydrophobicContact CD1-SD 4.17Å; F108-M111 PolarHBondContact O-N 2.94Å; M111-T113 VanDerWaalsContact C-N 3.35Å; M111-T113 PolarHBondContact O-N 3.49Å; M111-A114 PolarHBondContact O-N 3.31Å; M111-F115 WeakPolarHBondContact O-CB 3.39Å; M111-F115 PolarHBondContact O-N 3.27Å
112	A	98.6	Very high	98.7	Very high	39 Å²	39	42.3 Å²	42.3	32%	0.322	23%	0.229	S	C	.	.	H	α-helix	trans	-60.3	-46.2	177.2	0	0	0	0	0	111.3	F108 A109 A114 F115 M116	F108-A112 WeakPolarHBondContact O-CB 3.35Å; F108-A112 PolarHBondContact O-N 3.34Å; A109-A112 PolarHBondContact O-N 3.34Å; A112-A114 PolarHBondContact O-N 2.9Å; A112-F115 PolarHBondContact O-N 3.31Å; A112-M116 VanDerWaalsContact C-CE 3.45Å; A112-M116 HydrophobicContact CB-CE 3.92Å; A112-M116 WeakPolarHBondContact O-CE 3.47Å; A112-M116 PolarHBondContact O-N 3.5Å
113	T	98.9	Very high	98.7	Very high	12 Å²	12	42 Å²	42	7%	0.074	23%	0.232	C	C	.	.	H	α-helix	trans	-59.5	-49.7	179.9	-57.2	0	0	0	0	111.4	A109 V110 M111 M116 G117 H169 L172 P173 I176	A109-T113 WeakPolarHBondContact O-CB 3.48Å; A109-T113 PolarHBondContact O-N 3.42Å; A109-T113 PolarHBondContact O-OG1 3.4Å; V110-T113 PolarHBondContact O-N 3.12Å; M111-T113 VanDerWaalsContact C-N 3.35Å; M111-T113 PolarHBondContact O-N 3.49Å; T113-M116 PolarHBondContact O-N 3.22Å; T113-G117 PolarHBondContact O-N 3.47Å; T113-H169 PolarHBondContact O-CE1 3.5Å; T113-H169 PolarHBondContact O-ND1 3.35Å; T113-L172 HydrophobicContact CG2-CB 4.41Å; T113-L172 VanDerWaalsContact OG1-CB 3.26Å; T113-L172 WeakPolarHBondContact OG1-CB 3.44Å; T113-P173 HydrophobicContact CG2-CG 3.86Å; T113-I176 WeakPolarHBondContact OG1-CD1 3.32Å
114	A	98.7	Very high	98.7	Very high	30 Å²	30	47.6 Å²	47.6	25%	0.248	25%	0.252	C	S	.	.	H	α-helix	trans	-65.9	-40	-179.2	0	0	0	0	0	112.5	F78 V110 M111 A112 G117 Y118	F78-A114 HydrophobicContact CE2-CB 3.52Å; F78-A114 HydrophobicContact CZ-CB 3.92Å; V110-A114 WeakPolarHBondContact O-CB 3.38Å; V110-A114 PolarHBondContact O-N 3Å; M111-A114 PolarHBondContact O-N 3.31Å; A112-A114 PolarHBondContact O-N 2.9Å; A114-G117 PolarHBondContact O-N 3.07Å; A114-Y118 PolarHBondContact O-N 3.44Å
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	-57.3	-52.3	173.8	164.5	-111.2	0	0	0	111.2	M111 A112 G117 Y118 V119 I133 T134 F165	M111-F115 WeakPolarHBondContact O-CB 3.39Å; M111-F115 PolarHBondContact O-N 3.27Å; A112-F115 PolarHBondContact O-N 3.31Å; F115-G117 VanDerWaalsContact C-N 3.31Å; F115-G117 PolarHBondContact O-N 2.91Å; F115-Y118 WeakPolarHBondContact O-CB 3.47Å; F115-Y118 PolarHBondContact O-N 3.1Å; F115-V119 HydrophobicContact CE2-CG2 4.3Å; F115-V119 HydrophobicContact CZ-CG2 4.42Å; F115-V119 WeakPolarHBondContact O-CG2 3.37Å; F115-V119 PolarHBondContact O-N 3.32Å; F115-I133 HydrophobicContact CD2-CD1 3.71Å; F115-I133 HydrophobicContact CD2-CG2 4.32Å; F115-I133 HydrophobicContact CE1-CG2 4.36Å; F115-I133 HydrophobicContact CE2-CB 3.78Å; F115-I133 HydrophobicContact CE2-CD1 3.56Å; F115-I133 HydrophobicContact CE2-CG1 4.22Å; F115-I133 HydrophobicContact CE2-CG2 3.87Å; 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 4.08Å; F115-F165 AromaticContact CE1-CE2 3.81Å; F115-F165 HydrophobicContact CE1-CE2 3.81Å; F115-F165 HydrophobicContact CE1-CZ 4.15Å; F115-F165 HydrophobicContact CZ-CE2 4.13Å
116	M	98.6	Very high	98.5	Very high	18 Å²	18	47.4 Å²	47.4	9%	0.089	25%	0.248	C	C	.	.	H	α-helix	trans	-63.3	-37.4	179	-74	176.2	-84.2	0	0	112.3	A112 T113 Y118 V119 L120 F165 F168 H169 L172	A112-M116 VanDerWaalsContact C-CE 3.45Å; A112-M116 HydrophobicContact CB-CE 3.92Å; A112-M116 WeakPolarHBondContact O-CE 3.47Å; A112-M116 PolarHBondContact O-N 3.5Å; T113-M116 PolarHBondContact O-N 3.22Å; M116-Y118 VanDerWaalsContact C-N 3.31Å; M116-Y118 PolarHBondContact O-N 3.37Å; M116-V119 WeakPolarHBondContact O-CB 3.38Å; M116-V119 PolarHBondContact O-N 3.35Å; M116-V119 VanDerWaalsContact O-N 3.14Å; M116-L120 WeakPolarHBondContact O-CG 3.49Å; M116-F165 HydrophobicContact CB-CB 4.44Å; M116-F165 HydrophobicContact CB-CD2 4.33Å; M116-F165 HydrophobicContact CB-CG 4.45Å; M116-F165 HydrophobicContact CG-CB 4.39Å; M116-F165 HydrophobicContact CG-CD1 4.32Å; M116-F165 HydrophobicContact CG-CD2 3.87Å; M116-F165 HydrophobicContact CG-CE2 4.17Å; M116-F165 HydrophobicContact CG-CG 3.95Å; M116-F165 HydrophobicContact SD-CD1 4.42Å; M116-F168 HydrophobicContact CE-CB 4.31Å; M116-F168 HydrophobicContact SD-CB 3.48Å; M116-F168 WeakPolarHBondContact SD-CB 3.3Å; M116-F168 HydrophobicContact SD-CG 4.34Å; M116-H169 HydrophobicContact CB-CB 4.03Å; M116-L172 HydrophobicContact CE-CD1 3.21Å; M116-L172 HydrophobicContact SD-CD1 4.46Å
117	G	98.6	Very high	98.5	Very high	18 Å²	18	49.1 Å²	49.1	19%	0.186	25%	0.254	C	S	.	.	H	α-helix	trans	-60.7	-39.3	174.7	0	0	0	0	0	112.9	T113 A114 F115 V119 L120 P121 H169	T113-G117 PolarHBondContact O-N 3.47Å; A114-G117 PolarHBondContact O-N 3.07Å; F115-G117 VanDerWaalsContact C-N 3.31Å; F115-G117 PolarHBondContact O-N 2.91Å; G117-V119 PolarHBondContact O-N 3.5Å; G117-L120 WeakPolarHBondContact O-CB 3.37Å; G117-L120 PolarHBondContact O-N 2.68Å; G117-P121 WeakPolarHBondContact O-CD 3.32Å; G117-H169 WeakPolarHBondContact CA-CE1 3.31Å; G117-H169 VanDerWaalsContact CA-ND1 3.31Å; G117-H169 WeakPolarHBondContact CA-ND1 3.49Å; G117-H169 PolarHBondContact N-ND1 2.91Å
118	Y	98.6	Very high	98.4	Very high	137 Å²	137	54.1 Å²	54.1	54%	0.537	27%	0.271	S	S	.	.	H	α-helix	trans	-66.6	-21.8	177	-169.2	-101.5	0	0	0	113.4	A114 F115 M116 P121 M125 S126	A114-Y118 PolarHBondContact O-N 3.44Å; F115-Y118 WeakPolarHBondContact O-CB 3.47Å; F115-Y118 PolarHBondContact O-N 3.1Å; M116-Y118 VanDerWaalsContact C-N 3.31Å; M116-Y118 PolarHBondContact O-N 3.37Å; Y118-P121 WeakPolarHBondContact O-CD 3.26Å; Y118-M125 HydrophobicContact CE1-CB 4.02Å; Y118-M125 VanDerWaalsContact OH-CB 3.31Å; Y118-M125 WeakPolarHBondContact OH-CB 3.48Å; Y118-S126 VanDerWaalsContact O-CB 3.3Å; Y118-S126 WeakPolarHBondContact O-CB 3.36Å; Y118-S126 PolarHBondContact O-OG 3.26Å
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	-76.4	-29.6	176.1	-178.6	0	0	0	0	111.9	F115 M116 G117 W122 A130 F165	F115-V119 HydrophobicContact CE2-CG2 4.3Å; F115-V119 HydrophobicContact CZ-CG2 4.42Å; F115-V119 WeakPolarHBondContact O-CG2 3.37Å; F115-V119 PolarHBondContact O-N 3.32Å; M116-V119 WeakPolarHBondContact O-CB 3.38Å; M116-V119 PolarHBondContact O-N 3.35Å; M116-V119 VanDerWaalsContact O-N 3.14Å; G117-V119 PolarHBondContact O-N 3.5Å; V119-W122 HydrophobicContact CG1-CE3 4.04Å; V119-W122 HydrophobicContact CG1-CZ3 3.8Å; V119-W122 PolarHBondContact O-N 3.46Å; V119-A130 HydrophobicContact CG1-CB 4.05Å; V119-A130 HydrophobicContact CG2-CB 3.77Å; V119-F165 HydrophobicContact CB-CD2 3.94Å; V119-F165 HydrophobicContact CG1-CD2 3.95Å; V119-F165 HydrophobicContact CG2-CD2 3.9Å; V119-F165 HydrophobicContact CG2-CE2 4.06Å
120	L	98.8	Very high	98.3	Very high	17 Å²	17	48.5 Å²	48.5	9%	0.089	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-36.5	-170.4	-54	-175.8	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 3.32Å; Y42-L120 PolarHBondContact OH-O 2.82Å; M116-L120 WeakPolarHBondContact O-CG 3.49Å; G117-L120 WeakPolarHBondContact O-CB 3.37Å; G117-L120 PolarHBondContact O-N 2.68Å; L120-W122 PolarHBondContact O-N 3.15Å; L120-L162 HydrophobicContact CD2-CD1 4.18Å; L120-F165 HydrophobicContact CD2-CB 4.47Å; L120-F166 HydrophobicContact CD1-CD2 3.99Å; L120-F166 HydrophobicContact CD2-CB 3.9Å; L120-F166 HydrophobicContact CD2-CD2 4.49Å; L120-H169 HydrophobicContact CD1-CB 4.26Å; L120-H169 VanDerWaalsContact CD1-CD2 3.47Å; L120-H169 WeakPolarHBondContact CD1-CD2 3.48Å
121	P	98.6	Very high	98.3	Very high	39 Å²	39	49.5 Å²	49.5	25%	0.253	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-13.7	175.3	-24.3	35.6	0	0	0	114.4	F50 G117 Y118 G123	F50-P121 WeakPolarHBondContact CA-O 3.27Å; F50-P121 WeakPolarHBondContact CD2-O 3.37Å; G117-P121 WeakPolarHBondContact O-CD 3.32Å; Y118-P121 WeakPolarHBondContact O-CD 3.26Å; P121-G123 PolarHBondContact O-N 3.06Å
122	W	98.5	Very high	98.2	Very high	43 Å²	43	49.7 Å²	49.7	16%	0.163	26%	0.262	C	S	.	.			trans	53.9	36.7	177.2	-151.5	-113.8	0	0	0	114.3	T46 A49 V119 L120 F127 V157 L162	T46-W122 HydrophobicContact CG2-CD2 4.46Å; T46-W122 HydrophobicContact CG2-CH2 4.23Å; T46-W122 HydrophobicContact CG2-CZ2 3.51Å; A49-W122 HydrophobicContact CB-CB 3.89Å; V119-W122 HydrophobicContact CG1-CE3 4.04Å; V119-W122 HydrophobicContact CG1-CZ3 3.8Å; V119-W122 PolarHBondContact O-N 3.46Å; L120-W122 PolarHBondContact O-N 3.15Å; W122-F127 HydrophobicContact CH2-CD2 4.07Å; W122-F127 AromaticContact CZ2-CD2 3.85Å; W122-F127 HydrophobicContact CZ2-CD2 3.85Å; W122-F127 HydrophobicContact CZ2-CE2 4.27Å; W122-V157 HydrophobicContact CH2-CG1 3.6Å; W122-V157 HydrophobicContact CZ3-CG1 4.07Å; W122-L162 HydrophobicContact CB-CD2 4.48Å; W122-L162 HydrophobicContact CD2-CD1 4.45Å; W122-L162 HydrophobicContact CD2-CD2 3.87Å; W122-L162 HydrophobicContact CE3-CB 4.23Å; W122-L162 HydrophobicContact CE3-CD1 3.66Å; W122-L162 HydrophobicContact CE3-CD2 3.87Å; W122-L162 HydrophobicContact CE3-CG 4.13Å; W122-L162 HydrophobicContact CG-CD2 4.16Å; W122-L162 HydrophobicContact CH2-CB 4.15Å; W122-L162 HydrophobicContact CZ3-CB 3.86Å; W122-L162 HydrophobicContact CZ3-CD1 3.97Å; W122-L162 HydrophobicContact CZ3-CD2 4.32Å; W122-L162 HydrophobicContact CZ3-CG 4.26Å
123	G	98.1	Very high	98.2	Very high	20 Å²	20	51.9 Å²	51.9	21%	0.206	27%	0.267	C	S	.	.			trans	-83	178.4	170.3	0	0	0	0	0	112.7	P121 M125 S126 F127	P121-G123 PolarHBondContact O-N 3.06Å; G123-M125 PolarHBondContact O-N 3.45Å; G123-S126 PolarHBondContact N-OG 3.28Å; G123-S126 VanDerWaalsContact O-CB 3.29Å; G123-S126 WeakPolarHBondContact O-CB 3.5Å; G123-S126 PolarHBondContact O-N 2.95Å; G123-S126 VanDerWaalsContact O-N 3.14Å; G123-F127 PolarHBondContact O-N 3.18Å
124	Q	97.8	Very high	98.2	Very high	139 Å²	139	51.8 Å²	51.8	65%	0.65	27%	0.267	S	S	*	.	H	α-helix	trans	-55.6	-50.9	178.8	-73.9	-70.7	-0.9	0	0	112.5	S126 F127 W128	Q124-S126 VanDerWaalsContact C-N 3.29Å; Q124-S126 PolarHBondContact O-N 3Å; Q124-F127 PolarHBondContact O-N 2.86Å; Q124-W128 PolarHBondContact O-N 3.18Å; Q124-W128 VanDerWaalsContact OE1-NE1 3.07Å
125	M	97.2	Very high	98.1	Very high	133 Å²	133	53.8 Å²	53.8	66%	0.655	27%	0.273	S	S	*	.	H	α-helix	trans	-66.5	-32.1	179	-65.1	-57.4	-167	0	0	112.6	Y118 G123 G129	Y118-M125 HydrophobicContact CE1-CB 4.02Å; Y118-M125 VanDerWaalsContact OH-CB 3.31Å; Y118-M125 WeakPolarHBondContact OH-CB 3.48Å; G123-M125 PolarHBondContact O-N 3.45Å; M125-G129 WeakPolarHBondContact O-CA 3.28Å; M125-G129 PolarHBondContact O-N 3.03Å
126	S	97.6	Very high	98.1	Very high	8 Å²	8	57.3 Å²	57.3	6%	0.056	29%	0.293	C	S	.	.	H	α-helix	trans	-61.4	-50.1	174.2	-59.3	0	0	0	0	111	Y118 G123 Q124 A130	Y118-S126 VanDerWaalsContact O-CB 3.3Å; Y118-S126 WeakPolarHBondContact O-CB 3.36Å; Y118-S126 PolarHBondContact O-OG 3.26Å; G123-S126 PolarHBondContact N-OG 3.28Å; G123-S126 VanDerWaalsContact O-CB 3.29Å; G123-S126 WeakPolarHBondContact O-CB 3.5Å; G123-S126 PolarHBondContact O-N 2.95Å; G123-S126 VanDerWaalsContact O-N 3.14Å; Q124-S126 VanDerWaalsContact C-N 3.29Å; Q124-S126 PolarHBondContact O-N 3Å; S126-A130 WeakPolarHBondContact O-CB 3.26Å; S126-A130 PolarHBondContact O-N 3.49Å
127	F	97.8	Very high	98	Very high	56 Å²	56	59.5 Å²	59.5	25%	0.246	31%	0.305	C	S	.	.	H	α-helix	trans	-65.3	-55.5	-179.3	-178.9	-91.7	0	0	0	111.7	W122 G123 Q124 G129 A130 T131 V157	W122-F127 HydrophobicContact CH2-CD2 4.07Å; W122-F127 AromaticContact CZ2-CD2 3.85Å; W122-F127 HydrophobicContact CZ2-CD2 3.85Å; W122-F127 HydrophobicContact CZ2-CE2 4.27Å; G123-F127 PolarHBondContact O-N 3.18Å; Q124-F127 PolarHBondContact O-N 2.86Å; F127-G129 VanDerWaalsContact C-N 3.32Å; F127-G129 PolarHBondContact O-N 3.07Å; F127-A130 WeakPolarHBondContact O-CB 3.42Å; F127-A130 PolarHBondContact O-N 3.38Å; F127-A130 VanDerWaalsContact O-N 3.14Å; F127-T131 PolarHBondContact O-N 3.43Å; F127-T131 PolarHBondContact O-OG1 3.2Å; F127-T131 VanDerWaalsContact O-OG1 3.1Å; F127-V157 HydrophobicContact CD2-CG1 4.11Å; F127-V157 HydrophobicContact CE2-CB 4.17Å; F127-V157 HydrophobicContact CE2-CG1 4.08Å; F127-V157 VanDerWaalsContact CE2-O 3.29Å; F127-V157 WeakPolarHBondContact CE2-O 3.48Å
128	W	98.3	Very high	98	Very high	142 Å²	142	61 Å²	61	54%	0.538	31%	0.313	S	S	.	.	H	α-helix	trans	-66	-36	-177.6	-68.8	116.4	0	0	0	112.6	Q124 T131 V132	Q124-W128 PolarHBondContact O-N 3.18Å; Q124-W128 VanDerWaalsContact OE1-NE1 3.07Å; W128-T131 PolarHBondContact O-N 3.35Å; W128-V132 WeakPolarHBondContact O-CB 3.33Å; W128-V132 WeakPolarHBondContact O-CG2 3.38Å; W128-V132 PolarHBondContact O-N 3.23Å
129	G	97.4	Very high	98	Very high	22 Å²	22	58.4 Å²	58.4	23%	0.227	32%	0.32	C	S	.	.	H	α-helix	trans	-60	-46.5	172	0	0	0	0	0	111.6	M125 F127 I133	M125-G129 WeakPolarHBondContact O-CA 3.28Å; M125-G129 PolarHBondContact O-N 3.03Å; F127-G129 VanDerWaalsContact C-N 3.32Å; F127-G129 PolarHBondContact O-N 3.07Å; G129-I133 VanDerWaalsContact O-CB 3.29Å; G129-I133 WeakPolarHBondContact O-CB 3.5Å; G129-I133 WeakPolarHBondContact O-CG1 2.93Å; G129-I133 PolarHBondContact O-N 3.38Å
130	A	97.6	Very high	98	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-59.2	-49.8	175.7	0	0	0	0	0	111.5	V119 S126 F127 T134 V157	V119-A130 HydrophobicContact CG1-CB 4.05Å; V119-A130 HydrophobicContact CG2-CB 3.77Å; S126-A130 WeakPolarHBondContact O-CB 3.26Å; S126-A130 PolarHBondContact O-N 3.49Å; F127-A130 WeakPolarHBondContact O-CB 3.42Å; F127-A130 PolarHBondContact O-N 3.38Å; F127-A130 VanDerWaalsContact O-N 3.14Å; A130-T134 WeakPolarHBondContact O-CB 3.35Å; A130-T134 WeakPolarHBondContact O-CG2 3.46Å; A130-T134 PolarHBondContact O-N 2.92Å; A130-T134 VanDerWaalsContact O-N 3.12Å; A130-T134 PolarHBondContact O-OG1 2.8Å; A130-V157 HydrophobicContact CB-CG1 4.07Å; A130-V157 HydrophobicContact CB-CG2 4.23Å
131	T	97.9	Very high	97.9	Very high	30 Å²	30	65.1 Å²	65.1	18%	0.184	36%	0.36	C	S	.	.	H	α-helix	trans	-58.6	-52.9	-179.6	-55.9	0	0	0	0	111.7	F127 W128 T134 N135	F127-T131 PolarHBondContact O-N 3.43Å; F127-T131 PolarHBondContact O-OG1 3.2Å; F127-T131 VanDerWaalsContact O-OG1 3.1Å; W128-T131 PolarHBondContact O-N 3.35Å; T131-T134 PolarHBondContact O-OG1 3.19Å; T131-N135 WeakPolarHBondContact O-CB 3.5Å; T131-N135 PolarHBondContact O-N 3.3Å; T131-N135 VanDerWaalsContact O-N 3.16Å
132	V	98.3	Very high	97.9	Very high	93 Å²	93	74.4 Å²	74.4	56%	0.564	39%	0.392	S	S	*	.	H	α-helix	trans	-67.6	-47.3	-174.5	173.3	0	0	0	0	111.4	W128 N135 L136	W128-V132 WeakPolarHBondContact O-CB 3.33Å; W128-V132 WeakPolarHBondContact O-CG2 3.38Å; W128-V132 PolarHBondContact O-N 3.23Å; V132-N135 PolarHBondContact O-N 2.83Å; V132-L136 PolarHBondContact O-N 3.31Å
133	I	98.1	Very high	97.9	Very high	85 Å²	85	76.9 Å²	76.9	44%	0.436	41%	0.407	S	S	.	.	H	α-helix	trans	-67.9	-45.8	-174	-69.1	170.9	0	0	0	111.2	F115 G129 N135 L136	F115-I133 HydrophobicContact CD2-CD1 3.71Å; F115-I133 HydrophobicContact CD2-CG2 4.32Å; F115-I133 HydrophobicContact CE1-CG2 4.36Å; F115-I133 HydrophobicContact CE2-CB 3.78Å; F115-I133 HydrophobicContact CE2-CD1 3.56Å; F115-I133 HydrophobicContact CE2-CG1 4.22Å; F115-I133 HydrophobicContact CE2-CG2 3.87Å; F115-I133 HydrophobicContact CZ-CB 3.97Å; F115-I133 HydrophobicContact CZ-CG2 3.88Å; G129-I133 VanDerWaalsContact O-CB 3.29Å; G129-I133 WeakPolarHBondContact O-CB 3.5Å; G129-I133 WeakPolarHBondContact O-CG1 2.93Å; G129-I133 PolarHBondContact O-N 3.38Å; I133-N135 VanDerWaalsContact C-N 3.3Å; I133-N135 PolarHBondContact O-N 2.86Å; I133-L136 WeakPolarHBondContact O-CB 3.45Å; I133-L136 WeakPolarHBondContact O-CG 3.4Å; I133-L136 PolarHBondContact O-N 3.26Å
134	T	98.1	Very high	97.9	Very high	10 Å²	10	76 Å²	76	6%	0.061	40%	0.398	C	S	.	.	H	α-helix	trans	-67.9	-33.3	179.5	53.8	0	0	0	0	112	F115 A130 T131 L136 L137 I151 W152 F165	F115-T134 HydrophobicContact CE1-CG2 4.23Å; F115-T134 HydrophobicContact CZ-CG2 4.08Å; A130-T134 WeakPolarHBondContact O-CB 3.35Å; A130-T134 WeakPolarHBondContact O-CG2 3.46Å; A130-T134 PolarHBondContact O-N 2.92Å; A130-T134 VanDerWaalsContact O-N 3.12Å; A130-T134 PolarHBondContact O-OG1 2.8Å; T131-T134 PolarHBondContact O-OG1 3.19Å; T134-L136 PolarHBondContact O-N 2.79Å; T134-L137 WeakPolarHBondContact O-CB 3.33Å; T134-L137 PolarHBondContact O-N 3.42Å; T134-I151 HydrophobicContact CG2-CG2 4.28Å; T134-W152 PolarHBondContact OG1-NE1 3.1Å; T134-F165 HydrophobicContact CG2-CZ 3.99Å
135	N	97.8	Very high	97.9	Very high	71 Å²	71	73.5 Å²	73.5	38%	0.38	39%	0.392	S	S	.	.	H	α-helix	trans	-69.4	-12.5	178.2	-159.9	48.5	0	0	0	113.4	T131 V132 I133 L137 S138 W152	T131-N135 WeakPolarHBondContact O-CB 3.5Å; T131-N135 PolarHBondContact O-N 3.3Å; T131-N135 VanDerWaalsContact O-N 3.16Å; V132-N135 PolarHBondContact O-N 2.83Å; I133-N135 VanDerWaalsContact C-N 3.3Å; I133-N135 PolarHBondContact O-N 2.86Å; N135-L137 PolarHBondContact O-N 3.46Å; N135-L137 VanDerWaalsContact O-N 3.14Å; N135-S138 VanDerWaalsContact O-CB 3.25Å; N135-S138 WeakPolarHBondContact O-CB 3.49Å; N135-S138 PolarHBondContact O-N 2.82Å; N135-S138 PolarHBondContact O-OG 3.21Å; N135-W152 HydrophobicContact CB-CH2 4.49Å; N135-W152 HydrophobicContact CB-CZ2 4.22Å
136	L	97.9	Very high	97.9	Very high	122 Å²	122	71.9 Å²	71.9	64%	0.639	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-57.5	-26.4	169.9	-65.5	174.6	0	0	0	112.4	V132 I133 T134 S138 A139	V132-L136 PolarHBondContact O-N 3.31Å; I133-L136 WeakPolarHBondContact O-CB 3.45Å; I133-L136 WeakPolarHBondContact O-CG 3.4Å; I133-L136 PolarHBondContact O-N 3.26Å; T134-L136 PolarHBondContact O-N 2.79Å; L136-S138 PolarHBondContact O-N 3.04Å; L136-A139 WeakPolarHBondContact O-CB 3.38Å; L136-A139 PolarHBondContact O-N 2.97Å
137	L	97.5	Very high	98	Very high	63 Å²	63	74.3 Å²	74.3	33%	0.33	40%	0.402	S	S	.	.	G	3₁₀ helix	trans	-68.5	-18.6	175.7	-63.6	171.4	0	0	0	113	T134 N135 A139 I140 G144 V148 I151	T134-L137 WeakPolarHBondContact O-CB 3.33Å; T134-L137 PolarHBondContact O-N 3.42Å; N135-L137 PolarHBondContact O-N 3.46Å; N135-L137 VanDerWaalsContact O-N 3.14Å; L137-A139 PolarHBondContact O-N 3.07Å; L137-A139 VanDerWaalsContact O-N 3.16Å; L137-I140 HydrophobicContact CD2-CD1 3.99Å; L137-I140 WeakPolarHBondContact O-CB 3.46Å; L137-I140 WeakPolarHBondContact O-CG1 3.45Å; L137-I140 PolarHBondContact O-N 3.44Å; L137-I140 VanDerWaalsContact O-N 3.11Å; L137-G144 WeakPolarHBondContact O-CA 3.4Å; L137-V148 HydrophobicContact CB-CG2 3.84Å; L137-I151 HydrophobicContact CD1-CD1 3.21Å
138	S	97.7	Very high	98	Very high	50 Å²	50	71.7 Å²	71.7	35%	0.35	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-64.1	-19.3	175.8	83.2	0	0	0	0	112.4	N135 L136 I140	N135-S138 VanDerWaalsContact O-CB 3.25Å; N135-S138 WeakPolarHBondContact O-CB 3.49Å; N135-S138 PolarHBondContact O-N 2.82Å; N135-S138 PolarHBondContact O-OG 3.21Å; L136-S138 PolarHBondContact O-N 3.04Å; S138-I140 PolarHBondContact O-N 3.47Å
139	A	98.3	Very high	98	Very high	83 Å²	83	68.6 Å²	68.6	69%	0.686	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-73	-11.1	176.9	0	0	0	0	0	113.4	L136 L137 P141	L136-A139 WeakPolarHBondContact O-CB 3.38Å; L136-A139 PolarHBondContact O-N 2.97Å; L137-A139 PolarHBondContact O-N 3.07Å; L137-A139 VanDerWaalsContact O-N 3.16Å; A139-P141 WeakPolarHBondContact O-CD 3.4Å
140	I	98.3	Very high	98.1	Very high	67 Å²	67	76.5 Å²	76.5	34%	0.344	41%	0.405	S	S	.	.	S	Bend	trans	-70.9	121.3	175.6	-60.5	172.9	0	0	0	108.9	L137 S138 I143 G144 L147	L137-I140 HydrophobicContact CD2-CD1 3.99Å; L137-I140 WeakPolarHBondContact O-CB 3.46Å; L137-I140 WeakPolarHBondContact O-CG1 3.45Å; L137-I140 PolarHBondContact O-N 3.44Å; L137-I140 VanDerWaalsContact O-N 3.11Å; S138-I140 PolarHBondContact O-N 3.47Å; I140-I143 HydrophobicContact CG2-CD1 4.12Å; I140-I143 HydrophobicContact CG2-CG1 3.66Å; I140-G144 VanDerWaalsContact O-CA 3.27Å; I140-G144 WeakPolarHBondContact O-CA 3.47Å; I140-G144 PolarHBondContact O-N 3.3Å; I140-L147 HydrophobicContact CD1-CD1 4.03Å
141	P	98.2	Very high	98.1	Very high	91 Å²	91	78.3 Å²	78.3	59%	0.591	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	143.1	-178.7	-26	35.1	0	0	0	112.7	A139 I143	A139-P141 WeakPolarHBondContact O-CD 3.4Å; P141-I143 PolarHBondContact O-N 3.3Å
142	Y	97.3	Very high	98.1	Very high	235 Å²	235	78 Å²	78	92%	0.922	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.8	-44	176.2	-43.8	-69.5	0	0	0	116.2
143	I	98.3	Very high	98.1	Very high	95 Å²	95	75.4 Å²	75.4	49%	0.487	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.8	-9	-172	63.6	172.5	0	0	0	114.2	I140 P141 T145 T146 L147	I140-I143 HydrophobicContact CG2-CD1 4.12Å; I140-I143 HydrophobicContact CG2-CG1 3.66Å; P141-I143 PolarHBondContact O-N 3.3Å; I143-T145 PolarHBondContact O-N 3.34Å; I143-T146 PolarHBondContact O-N 2.83Å; I143-L147 HydrophobicContact CD1-CD1 3.88Å; I143-L147 HydrophobicContact CG1-CD1 3.97Å; I143-L147 WeakPolarHBondContact O-CG 3.49Å; I143-L147 PolarHBondContact O-N 3.42Å
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	-52.5	-170.3	0	0	0	0	0	114.3	L137 I140 T146 L147 V148	L137-G144 WeakPolarHBondContact O-CA 3.4Å; I140-G144 VanDerWaalsContact O-CA 3.27Å; I140-G144 WeakPolarHBondContact O-CA 3.47Å; I140-G144 PolarHBondContact O-N 3.3Å; G144-T146 VanDerWaalsContact C-N 3.33Å; G144-T146 PolarHBondContact O-N 2.9Å; G144-L147 WeakPolarHBondContact O-CB 3.45Å; G144-L147 PolarHBondContact O-N 2.81Å; G144-L147 VanDerWaalsContact O-N 3.17Å; G144-V148 WeakPolarHBondContact O-CG2 3.34Å; G144-V148 PolarHBondContact O-N 3.14Å
145	T	98	Very high	98	Very high	86 Å²	86	80.9 Å²	80.9	53%	0.528	43%	0.431	S	S	.	.	H	α-helix	trans	-59.4	-43.7	179.2	-52.4	0	0	0	0	111.8	I143 L147 V148 E149	I143-T145 PolarHBondContact O-N 3.34Å; T145-L147 VanDerWaalsContact C-N 3.32Å; T145-L147 PolarHBondContact O-N 3.25Å; T145-V148 PolarHBondContact O-N 3Å; T145-E149 PolarHBondContact O-N 3.36Å
146	T	98.4	Very high	98	Very high	99 Å²	99	80.6 Å²	80.6	61%	0.607	44%	0.435	S	S	*	.	H	α-helix	trans	-61.2	-39.9	177.1	-50.3	0	0	0	0	111.9	I143 G144 W150	I143-T146 PolarHBondContact O-N 2.83Å; G144-T146 VanDerWaalsContact C-N 3.33Å; G144-T146 PolarHBondContact O-N 2.9Å; T146-W150 WeakPolarHBondContact O-CB 3.31Å; T146-W150 PolarHBondContact O-N 2.79Å
147	L	98.3	Very high	98	Very high	59 Å²	59	75 Å²	75	31%	0.309	41%	0.406	S	S	.	.	H	α-helix	trans	-64.5	-42.1	176.6	-73.9	173.4	0	0	0	112.2	I140 I143 G144 T145 W150 I151	I140-L147 HydrophobicContact CD1-CD1 4.03Å; I143-L147 HydrophobicContact CD1-CD1 3.88Å; I143-L147 HydrophobicContact CG1-CD1 3.97Å; I143-L147 WeakPolarHBondContact O-CG 3.49Å; I143-L147 PolarHBondContact O-N 3.42Å; G144-L147 WeakPolarHBondContact O-CB 3.45Å; G144-L147 PolarHBondContact O-N 2.81Å; G144-L147 VanDerWaalsContact O-N 3.17Å; T145-L147 VanDerWaalsContact C-N 3.32Å; T145-L147 PolarHBondContact O-N 3.25Å; L147-W150 PolarHBondContact O-N 3.44Å; L147-I151 WeakPolarHBondContact O-CG1 3.33Å; L147-I151 PolarHBondContact O-N 3.07Å
148	V	98.6	Very high	98.1	Very high	2 Å²	2	76.2 Å²	76.2	1%	0.012	41%	0.413	C	S	.	.	H	α-helix	trans	-63	-51.9	178.9	173.5	0	0	0	0	110.9	L137 G144 T145 W150 I151 W152	L137-V148 HydrophobicContact CB-CG2 3.84Å; G144-V148 WeakPolarHBondContact O-CG2 3.34Å; G144-V148 PolarHBondContact O-N 3.14Å; T145-V148 PolarHBondContact O-N 3Å; V148-W150 VanDerWaalsContact C-N 3.26Å; V148-W150 PolarHBondContact O-N 3.46Å; V148-I151 PolarHBondContact O-N 3.27Å; V148-I151 VanDerWaalsContact O-N 3.15Å; V148-W152 HydrophobicContact CG1-CD2 3.67Å; V148-W152 VanDerWaalsContact CG1-CE2 3.41Å; V148-W152 HydrophobicContact CG1-CE3 3.75Å; V148-W152 HydrophobicContact CG1-CH2 3.42Å; V148-W152 VanDerWaalsContact CG1-CH2 3.42Å; V148-W152 HydrophobicContact CG1-CZ2 3.31Å; V148-W152 HydrophobicContact CG1-CZ3 3.63Å; V148-W152 PolarHBondContact O-N 3.38Å
149	E	98.4	Very high	98.1	Very high	77 Å²	77	78.9 Å²	78.9	36%	0.36	42%	0.418	S	S	.	.	H	α-helix	trans	-62.3	-35.2	178.6	-68.5	-179.9	178	0	0	111.8	T145 W152 G153 G154	T145-E149 PolarHBondContact O-N 3.36Å; E149-W152 PolarHBondContact O-N 3.24Å; E149-G153 WeakPolarHBondContact O-CA 3.36Å; E149-G153 PolarHBondContact O-N 2.77Å; E149-G154 WeakPolarHBondContact CA-O 3.43Å; E149-G154 PolarHBondContact O-N 2.7Å
150	W	98.4	Very high	98.1	Very high	188 Å²	188	77 Å²	77	71%	0.712	40%	0.402	S	S	*	.	H	α-helix	trans	-64.3	-45.4	173.9	179.6	79	0	0	0	112.1	T146 L147 V148 W152 G153 R164	T146-W150 WeakPolarHBondContact O-CB 3.31Å; T146-W150 PolarHBondContact O-N 2.79Å; L147-W150 PolarHBondContact O-N 3.44Å; V148-W150 VanDerWaalsContact C-N 3.26Å; V148-W150 PolarHBondContact O-N 3.46Å; W150-W152 VanDerWaalsContact C-N 3.35Å; W150-G153 PolarHBondContact O-N 2.94Å; W150-R164 PolarHBondContact O-NH1 2.94Å
151	I	97.8	Very high	98.1	Very high	38 Å²	38	73.8 Å²	73.8	20%	0.195	39%	0.386	C	S	.	.	H	α-helix	trans	-63	-41.7	175.9	-72.4	168.8	0	0	0	110.8	T134 L137 L147 V148 G153 R164 F165	T134-I151 HydrophobicContact CG2-CG2 4.28Å; L137-I151 HydrophobicContact CD1-CD1 3.21Å; L147-I151 WeakPolarHBondContact O-CG1 3.33Å; L147-I151 PolarHBondContact O-N 3.07Å; V148-I151 PolarHBondContact O-N 3.27Å; V148-I151 VanDerWaalsContact O-N 3.15Å; I151-G153 VanDerWaalsContact C-N 3.34Å; I151-R164 VanDerWaalsContact C-NH1 3.33Å; I151-R164 WeakPolarHBondContact O-CD 3.32Å; I151-R164 PolarHBondContact O-NH1 3.4Å; I151-F165 HydrophobicContact CG2-CE1 4.21Å; I151-F165 HydrophobicContact CG2-CZ 4.44Å
152	W	98.5	Very high	98.1	Very high	22 Å²	22	69.4 Å²	69.4	8%	0.083	36%	0.358	C	S	.	.	H	α-helix	trans	-69.2	-35.1	177.4	-66.6	-14.1	0	0	0	112.2	T134 N135 V148 E149 W150 F155 S156 V157 T161	T134-W152 PolarHBondContact OG1-NE1 3.1Å; N135-W152 HydrophobicContact CB-CH2 4.49Å; N135-W152 HydrophobicContact CB-CZ2 4.22Å; V148-W152 HydrophobicContact CG1-CD2 3.67Å; V148-W152 VanDerWaalsContact CG1-CE2 3.41Å; V148-W152 HydrophobicContact CG1-CE3 3.75Å; V148-W152 HydrophobicContact CG1-CH2 3.42Å; V148-W152 VanDerWaalsContact CG1-CH2 3.42Å; V148-W152 HydrophobicContact CG1-CZ2 3.31Å; V148-W152 HydrophobicContact CG1-CZ3 3.63Å; V148-W152 PolarHBondContact O-N 3.38Å; E149-W152 PolarHBondContact O-N 3.24Å; W150-W152 VanDerWaalsContact C-N 3.35Å; W152-F155 WeakPolarHBondContact CZ3-O 3.26Å; W152-S156 VanDerWaalsContact CE3-CA 3.43Å; W152-V157 HydrophobicContact CD2-CG2 4.25Å; W152-V157 HydrophobicContact CG-CG2 4.22Å; W152-V157 HydrophobicContact CZ2-CG2 4.26Å; W152-T161 WeakPolarHBondContact CA-OG1 3.45Å; W152-T161 PolarHBondContact O-N 3.36Å; W152-T161 PolarHBondContact O-OG1 3Å
153	G	97.9	Very high	98.2	Very high	40 Å²	40	61.1 Å²	61.1	41%	0.412	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.7	29.8	-168.6	0	0	0	0	0	112.7	E149 W150 I151	E149-G153 WeakPolarHBondContact O-CA 3.36Å; E149-G153 PolarHBondContact O-N 2.77Å; W150-G153 PolarHBondContact O-N 2.94Å; I151-G153 VanDerWaalsContact C-N 3.34Å
154	G	97	Very high	98.2	Very high	31 Å²	31	60.2 Å²	60.2	32%	0.32	32%	0.322	S	S	.	.	S	Bend	trans	169	-173.1	-174.1	0	0	0	0	0	111.3	E149 S156	E149-G154 WeakPolarHBondContact CA-O 3.43Å; E149-G154 PolarHBondContact O-N 2.7Å; G154-S156 VanDerWaalsContact C-N 3.3Å; G154-S156 PolarHBondContact O-N 3.21Å
155	F	97.9	Very high	98.2	Very high	178 Å²	178	60.6 Å²	60.6	78%	0.781	32%	0.323	S	S	*	.	S	Bend	trans	-80	-9.8	-177	-55.4	-65.5	0	0	0	114.3	W152	W152-F155 WeakPolarHBondContact CZ3-O 3.26Å
156	S	97.5	Very high	98.2	Very high	65 Å²	65	58.8 Å²	58.8	46%	0.455	31%	0.308	S	S	.	.	S	Bend	trans	-152.4	166.1	177.3	60.9	0	0	0	0	110.5	W152 G154 D158	W152-S156 VanDerWaalsContact CE3-CA 3.43Å; G154-S156 VanDerWaalsContact C-N 3.3Å; G154-S156 PolarHBondContact O-N 3.21Å; S156-D158 PolarHBondContact O-N 2.86Å
157	V	98.3	Very high	98.3	Very high	4 Å²	4	56.8 Å²	56.8	2%	0.024	30%	0.301	C	S	.	.	S	Bend	trans	-59.7	119.9	167	173.1	0	0	0	0	109.1	W122 F127 A130 W152 T161	W122-V157 HydrophobicContact CH2-CG1 3.6Å; W122-V157 HydrophobicContact CZ3-CG1 4.07Å; F127-V157 HydrophobicContact CD2-CG1 4.11Å; F127-V157 HydrophobicContact CE2-CB 4.17Å; F127-V157 HydrophobicContact CE2-CG1 4.08Å; F127-V157 VanDerWaalsContact CE2-O 3.29Å; F127-V157 WeakPolarHBondContact CE2-O 3.48Å; A130-V157 HydrophobicContact CB-CG1 4.07Å; A130-V157 HydrophobicContact CB-CG2 4.23Å; W152-V157 HydrophobicContact CD2-CG2 4.25Å; W152-V157 HydrophobicContact CG-CG2 4.22Å; W152-V157 HydrophobicContact CZ2-CG2 4.26Å; V157-T161 HydrophobicContact CG1-CG2 4.21Å; V157-T161 HydrophobicContact CG2-CG2 4.49Å
158	D	98.1	Very high	98.3	Very high	89 Å²	89	59.1 Å²	59.1	48%	0.476	31%	0.309	S	S	.	.	S	Bend	trans	-156.9	-161.1	-178.5	-161.7	-2.8	0	0	0	110.6	S156 A160 T161 L162	S156-D158 PolarHBondContact O-N 2.86Å; D158-A160 VanDerWaalsContact C-N 3.32Å; D158-A160 PolarHBondContact O-N 2.99Å; D158-T161 PolarHBondContact N-OG1 3.44Å; D158-T161 WeakPolarHBondContact O-CA 3.46Å; D158-T161 VanDerWaalsContact O-CB 3.24Å; D158-T161 WeakPolarHBondContact O-CB 3.33Å; D158-T161 PolarHBondContact O-N 3.2Å; D158-T161 PolarHBondContact O-OG1 3.25Å; D158-L162 PolarHBondContact O-N 3.2Å
159	K	98	Very high	98.3	Very high	106 Å²	106	60.3 Å²	60.3	46%	0.461	31%	0.314	S	S	.	.	H	α-helix	trans	-47.6	-46.9	-178.1	179.2	169.4	174	160.4	0	114.2	D45 T46 T161 L162 T163	D45-K159 WeakPolarHBondContact OD2-CE 3.32Å; D45-K159 IonicContact OD2-NZ 3.34Å; D45-K159 PolarHBondContact OD2-NZ 3.38Å; T46-K159 HydrophobicContact CG2-CB 4.04Å; K159-T161 PolarHBondContact O-N 3.42Å; K159-L162 PolarHBondContact O-N 3.29Å; K159-T163 PolarHBondContact O-N 2.72Å; K159-T163 VanDerWaalsContact O-N 3.09Å; K159-T163 PolarHBondContact O-OG1 3.17Å; K159-T163 VanDerWaalsContact O-OG1 3.1Å
160	A	98.3	Very high	98.3	Very high	43 Å²	43	60.5 Å²	60.5	36%	0.355	31%	0.314	S	S	.	.	H	α-helix	trans	-60.9	-34.4	178.8	0	0	0	0	0	112.3	D158 R164	D158-A160 VanDerWaalsContact C-N 3.32Å; D158-A160 PolarHBondContact O-N 2.99Å; A160-R164 WeakPolarHBondContact O-CG 3.37Å; A160-R164 PolarHBondContact O-N 2.95Å; A160-R164 PolarHBondContact O-NE 3.32Å
161	T	98.5	Very high	98.3	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-72.1	-45.6	177.5	-40.6	0	0	0	0	111.2	W152 V157 D158 K159 R164 F165	W152-T161 WeakPolarHBondContact CA-OG1 3.45Å; W152-T161 PolarHBondContact O-N 3.36Å; W152-T161 PolarHBondContact O-OG1 3Å; V157-T161 HydrophobicContact CG1-CG2 4.21Å; V157-T161 HydrophobicContact CG2-CG2 4.49Å; D158-T161 PolarHBondContact N-OG1 3.44Å; D158-T161 WeakPolarHBondContact O-CA 3.46Å; D158-T161 VanDerWaalsContact O-CB 3.24Å; D158-T161 WeakPolarHBondContact O-CB 3.33Å; D158-T161 PolarHBondContact O-N 3.2Å; D158-T161 PolarHBondContact O-OG1 3.25Å; K159-T161 PolarHBondContact O-N 3.42Å; T161-R164 VanDerWaalsContact O-CG 3.24Å; T161-R164 WeakPolarHBondContact O-CG 3.38Å; T161-R164 PolarHBondContact O-N 3.39Å; T161-F165 HydrophobicContact CG2-CD1 4.2Å; T161-F165 HydrophobicContact CG2-CE1 3.96Å; T161-F165 HydrophobicContact CG2-CE2 4.34Å; T161-F165 HydrophobicContact CG2-CG 4.49Å; T161-F165 HydrophobicContact CG2-CZ 4.03Å; T161-F165 WeakPolarHBondContact O-CB 3.28Å; T161-F165 WeakPolarHBondContact O-CD1 3.3Å; T161-F165 WeakPolarHBondContact O-CG 3.41Å; T161-F165 PolarHBondContact O-N 3Å
162	L	98.7	Very high	98.4	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-63.1	-46.5	-179	-178.3	56.8	0	0	0	112.1	T46 A49 L120 W122 D158 K159 R164 F165 F166	T46-L162 HydrophobicContact CG2-CB 4.35Å; T46-L162 HydrophobicContact CG2-CD2 3.89Å; A49-L162 HydrophobicContact CB-CD2 3.69Å; L120-L162 HydrophobicContact CD2-CD1 4.18Å; W122-L162 HydrophobicContact CB-CD2 4.48Å; W122-L162 HydrophobicContact CD2-CD1 4.45Å; W122-L162 HydrophobicContact CD2-CD2 3.87Å; W122-L162 HydrophobicContact CE3-CB 4.23Å; W122-L162 HydrophobicContact CE3-CD1 3.66Å; W122-L162 HydrophobicContact CE3-CD2 3.87Å; W122-L162 HydrophobicContact CE3-CG 4.13Å; W122-L162 HydrophobicContact CG-CD2 4.16Å; W122-L162 HydrophobicContact CH2-CB 4.15Å; W122-L162 HydrophobicContact CZ3-CB 3.86Å; W122-L162 HydrophobicContact CZ3-CD1 3.97Å; W122-L162 HydrophobicContact CZ3-CD2 4.32Å; W122-L162 HydrophobicContact CZ3-CG 4.26Å; D158-L162 PolarHBondContact O-N 3.2Å; K159-L162 PolarHBondContact O-N 3.29Å; L162-R164 PolarHBondContact O-N 3.14Å; L162-F165 PolarHBondContact O-N 3.37Å; L162-F166 PolarHBondContact O-N 3.47Å
163	T	98.6	Very high	98.4	Very high	60 Å²	60	55 Å²	55	37%	0.368	30%	0.301	S	S	.	.	H	α-helix	trans	-61.4	-44.2	-179.5	-54.7	0	0	0	0	112	S44 K159 F166 A167	S44-T163 PolarHBondContact O-OG1 3.45Å; S44-T163 VanDerWaalsContact O-OG1 3.1Å; K159-T163 PolarHBondContact O-N 2.72Å; K159-T163 VanDerWaalsContact O-N 3.09Å; K159-T163 PolarHBondContact O-OG1 3.17Å; K159-T163 VanDerWaalsContact O-OG1 3.1Å; T163-F166 PolarHBondContact O-N 3.43Å; T163-A167 PolarHBondContact O-N 2.94Å
164	R	98.4	Very high	98.4	Very high	76 Å²	76	57.5 Å²	57.5	29%	0.287	30%	0.301	S	S	.	.	H	α-helix	trans	-72.3	-35.4	178.8	72.9	-176.1	65.9	-166.5	-10.8	112.2	W150 I151 A160 T161 L162 F166 A167 F168	W150-R164 PolarHBondContact O-NH1 2.94Å; I151-R164 VanDerWaalsContact C-NH1 3.33Å; I151-R164 WeakPolarHBondContact O-CD 3.32Å; I151-R164 PolarHBondContact O-NH1 3.4Å; A160-R164 WeakPolarHBondContact O-CG 3.37Å; A160-R164 PolarHBondContact O-N 2.95Å; A160-R164 PolarHBondContact O-NE 3.32Å; T161-R164 VanDerWaalsContact O-CG 3.24Å; T161-R164 WeakPolarHBondContact O-CG 3.38Å; T161-R164 PolarHBondContact O-N 3.39Å; L162-R164 PolarHBondContact O-N 3.14Å; R164-F166 VanDerWaalsContact C-N 3.29Å; R164-F166 PolarHBondContact O-N 2.88Å; R164-A167 PolarHBondContact O-N 3.37Å; R164-A167 VanDerWaalsContact O-N 3.16Å; R164-F168 HydrophobicContact CB-CD2 4.36Å; R164-F168 HydrophobicContact CB-CE2 4.2Å; R164-F168 HydrophobicContact CG-CD2 4.5Å; R164-F168 HydrophobicContact CG-CE2 4.4Å; R164-F168 WeakPolarHBondContact O-CD2 3.49Å; R164-F168 PolarHBondContact O-N 2.95Å
165	F	98.7	Very high	98.5	Very high	9 Å²	9	59.8 Å²	59.8	4%	0.039	31%	0.305	C	S	.	.	H	α-helix	trans	-64.9	-36.9	176.6	-85.4	23.4	0	0	0	110.9	F115 M116 V119 L120 T134 I151 T161 L162 H169	F115-F165 AromaticContact CE1-CE2 3.81Å; F115-F165 HydrophobicContact CE1-CE2 3.81Å; F115-F165 HydrophobicContact CE1-CZ 4.15Å; F115-F165 HydrophobicContact CZ-CE2 4.13Å; M116-F165 HydrophobicContact CB-CB 4.44Å; M116-F165 HydrophobicContact CB-CD2 4.33Å; M116-F165 HydrophobicContact CB-CG 4.45Å; M116-F165 HydrophobicContact CG-CB 4.39Å; M116-F165 HydrophobicContact CG-CD1 4.32Å; M116-F165 HydrophobicContact CG-CD2 3.87Å; M116-F165 HydrophobicContact CG-CE2 4.17Å; M116-F165 HydrophobicContact CG-CG 3.95Å; M116-F165 HydrophobicContact SD-CD1 4.42Å; V119-F165 HydrophobicContact CB-CD2 3.94Å; V119-F165 HydrophobicContact CG1-CD2 3.95Å; V119-F165 HydrophobicContact CG2-CD2 3.9Å; V119-F165 HydrophobicContact CG2-CE2 4.06Å; L120-F165 HydrophobicContact CD2-CB 4.47Å; T134-F165 HydrophobicContact CG2-CZ 3.99Å; I151-F165 HydrophobicContact CG2-CE1 4.21Å; I151-F165 HydrophobicContact CG2-CZ 4.44Å; T161-F165 HydrophobicContact CG2-CD1 4.2Å; T161-F165 HydrophobicContact CG2-CE1 3.96Å; T161-F165 HydrophobicContact CG2-CE2 4.34Å; T161-F165 HydrophobicContact CG2-CG 4.49Å; T161-F165 HydrophobicContact CG2-CZ 4.03Å; T161-F165 WeakPolarHBondContact O-CB 3.28Å; T161-F165 WeakPolarHBondContact O-CD1 3.3Å; T161-F165 WeakPolarHBondContact O-CG 3.41Å; T161-F165 PolarHBondContact O-N 3Å; L162-F165 PolarHBondContact O-N 3.37Å; F165-H169 WeakPolarHBondContact O-CB 3.47Å; F165-H169 PolarHBondContact O-N 3.5Å
166	F	98.8	Very high	98.6	Very high	49 Å²	49	51.6 Å²	51.6	22%	0.215	27%	0.269	C	S	.	.	H	α-helix	trans	-59.6	-48.3	170	176.6	-118.8	0	0	0	111.7	A39 Y42 L120 L162 T163 R164 F168 H169 F170	A39-F166 HydrophobicContact CB-CE2 4.23Å; A39-F166 HydrophobicContact CB-CZ 4.09Å; Y42-F166 AromaticContact CD1-CD2 3.76Å; Y42-F166 HydrophobicContact CD1-CD2 3.76Å; Y42-F166 AromaticContact CD1-CE2 3.66Å; Y42-F166 HydrophobicContact CD1-CE2 3.66Å; Y42-F166 HydrophobicContact CD1-CG 4.31Å; Y42-F166 HydrophobicContact CD1-CZ 4.14Å; Y42-F166 HydrophobicContact CE1-CB 4.34Å; Y42-F166 AromaticContact CE1-CD2 3.66Å; Y42-F166 HydrophobicContact CE1-CD2 3.66Å; Y42-F166 HydrophobicContact CE1-CE2 4.07Å; Y42-F166 AromaticContact CE1-CG 3.94Å; Y42-F166 HydrophobicContact CE1-CG 3.94Å; L120-F166 HydrophobicContact CD1-CD2 3.99Å; L120-F166 HydrophobicContact CD2-CB 3.9Å; L120-F166 HydrophobicContact CD2-CD2 4.49Å; L162-F166 PolarHBondContact O-N 3.47Å; T163-F166 PolarHBondContact O-N 3.43Å; R164-F166 VanDerWaalsContact C-N 3.29Å; R164-F166 PolarHBondContact O-N 2.88Å; F166-F168 PolarHBondContact O-N 3.38Å; F166-H169 PolarHBondContact O-N 3.48Å; F166-F170 WeakPolarHBondContact O-CB 3.25Å; F166-F170 PolarHBondContact O-N 3.32Å
167	A	98.8	Very high	98.6	Very high	56 Å²	56	50 Å²	50	46%	0.463	26%	0.26	S	S	.	.	H	α-helix	trans	-60.7	-45.4	178.8	0	0	0	0	0	112.7	T163 R164 F170 I171	T163-A167 PolarHBondContact O-N 2.94Å; R164-A167 PolarHBondContact O-N 3.37Å; R164-A167 VanDerWaalsContact O-N 3.16Å; A167-F170 PolarHBondContact O-N 3.38Å; A167-I171 WeakPolarHBondContact O-CG2 3.29Å; A167-I171 PolarHBondContact O-N 3.46Å; A167-I171 VanDerWaalsContact O-N 3.14Å
168	F	98.8	Very high	98.6	Very high	109 Å²	109	52.4 Å²	52.4	48%	0.478	28%	0.28	S	S	.	.	H	α-helix	trans	-66.8	-44.4	177.2	-73.5	-55.9	0	0	0	112.6	M116 R164 F166 F170 I171 L172	M116-F168 HydrophobicContact CE-CB 4.31Å; M116-F168 HydrophobicContact SD-CB 3.48Å; M116-F168 WeakPolarHBondContact SD-CB 3.3Å; M116-F168 HydrophobicContact SD-CG 4.34Å; R164-F168 HydrophobicContact CB-CD2 4.36Å; R164-F168 HydrophobicContact CB-CE2 4.2Å; R164-F168 HydrophobicContact CG-CD2 4.5Å; R164-F168 HydrophobicContact CG-CE2 4.4Å; R164-F168 WeakPolarHBondContact O-CD2 3.49Å; R164-F168 PolarHBondContact O-N 2.95Å; F166-F168 PolarHBondContact O-N 3.38Å; F168-F170 PolarHBondContact O-N 3.1Å; F168-I171 WeakPolarHBondContact O-CG2 3.26Å; F168-I171 PolarHBondContact O-N 3.31Å; F168-L172 WeakPolarHBondContact O-CB 3.29Å; F168-L172 WeakPolarHBondContact O-CD1 3.31Å; F168-L172 VanDerWaalsContact O-CG 3.31Å; F168-L172 WeakPolarHBondContact O-CG 3.39Å; F168-L172 PolarHBondContact O-N 3.46Å
169	H	98.9	Very high	98.7	Very high	26 Å²	26	50.2 Å²	50.2	12%	0.12	27%	0.268	C	S	.	.	H	α-helix	trans	-60.3	-34.1	175.7	-179.1	69.6	0	0	0	111.9	H70 T113 M116 G117 L120 F165 F166 P173	H70-H169 AromaticContact NE2-NE2 3.97Å; T113-H169 PolarHBondContact O-CE1 3.5Å; T113-H169 PolarHBondContact O-ND1 3.35Å; M116-H169 HydrophobicContact CB-CB 4.03Å; G117-H169 WeakPolarHBondContact CA-CE1 3.31Å; G117-H169 VanDerWaalsContact CA-ND1 3.31Å; G117-H169 WeakPolarHBondContact CA-ND1 3.49Å; G117-H169 PolarHBondContact N-ND1 2.91Å; L120-H169 HydrophobicContact CD1-CB 4.26Å; L120-H169 VanDerWaalsContact CD1-CD2 3.47Å; L120-H169 WeakPolarHBondContact CD1-CD2 3.48Å; F165-H169 WeakPolarHBondContact O-CB 3.47Å; F165-H169 PolarHBondContact O-N 3.5Å; F166-H169 PolarHBondContact O-N 3.48Å; H169-P173 WeakPolarHBondContact O-CD 3.36Å; H169-P173 WeakPolarHBondContact O-CG 3.27Å
170	F	98.8	Very high	98.7	Very high	82 Å²	82	46.5 Å²	46.5	36%	0.36	26%	0.257	S	S	.	.	H	α-helix	trans	-70.8	-44.4	177.3	-169.1	-84.3	0	0	0	112.7	L36 A39 F166 A167 F168 P173 F174	L36-F170 HydrophobicContact CD1-CE2 4.06Å; L36-F170 HydrophobicContact CD1-CZ 3.92Å; A39-F170 HydrophobicContact CB-CD2 4.24Å; A39-F170 HydrophobicContact CB-CE2 4.01Å; F166-F170 WeakPolarHBondContact O-CB 3.25Å; F166-F170 PolarHBondContact O-N 3.32Å; A167-F170 PolarHBondContact O-N 3.38Å; F168-F170 PolarHBondContact O-N 3.1Å; F170-P173 WeakPolarHBondContact O-CD 3.38Å; F170-F174 HydrophobicContact CD1-CE2 4.17Å; F170-F174 AromaticContact CE1-CE2 3.9Å; F170-F174 HydrophobicContact CE1-CE2 3.9Å; F170-F174 HydrophobicContact CZ-CE2 4.48Å; F170-F174 VanDerWaalsContact O-CD2 3.28Å; F170-F174 WeakPolarHBondContact O-CD2 3.1Å; F170-F174 VanDerWaalsContact O-CE2 3.26Å; F170-F174 WeakPolarHBondContact O-CE2 3.33Å
171	I	98.8	Very high	98.7	Very high	83 Å²	83	50 Å²	50	43%	0.426	27%	0.269	S	S	.	.	H	α-helix	trans	-79.4	-34.3	-174.9	-169.9	59.8	0	0	0	113.6	A167 F168 F174 I175	A167-I171 WeakPolarHBondContact O-CG2 3.29Å; A167-I171 PolarHBondContact O-N 3.46Å; A167-I171 VanDerWaalsContact O-N 3.14Å; F168-I171 WeakPolarHBondContact O-CG2 3.26Å; F168-I171 PolarHBondContact O-N 3.31Å; I171-F174 WeakPolarHBondContact O-CB 3.36Å; I171-F174 PolarHBondContact O-N 3.39Å; I171-F174 VanDerWaalsContact O-N 3.1Å; I171-I175 HydrophobicContact CG1-CD1 4.27Å; I171-I175 PolarHBondContact O-N 2.91Å
172	L	98.6	Very high	98.7	Very high	32 Å²	32	52.8 Å²	52.8	17%	0.168	29%	0.286	C	S	.	.	H	α-helix	trans	-60.2	-38.7	-173.9	-80.4	166.9	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 3.44Å; M116-L172 HydrophobicContact CE-CD1 3.21Å; M116-L172 HydrophobicContact SD-CD1 4.46Å; F168-L172 WeakPolarHBondContact O-CB 3.29Å; F168-L172 WeakPolarHBondContact O-CD1 3.31Å; F168-L172 VanDerWaalsContact O-CG 3.31Å; F168-L172 WeakPolarHBondContact O-CG 3.39Å; F168-L172 PolarHBondContact O-N 3.46Å; L172-F174 PolarHBondContact O-N 3.21Å; L172-I175 HydrophobicContact CD2-CD1 4.18Å; L172-I175 CarbonylContact O-C 3.24Å; L172-I175 WeakPolarHBondContact O-CA 3.47Å; L172-I175 WeakPolarHBondContact O-CB 3.47Å; L172-I175 PolarHBondContact O-N 3.28Å; L172-I176 WeakPolarHBondContact O-CG1 3.31Å; L172-I176 PolarHBondContact O-N 2.95Å
173	P	98.8	Very high	98.7	Very high	18 Å²	18	54.1 Å²	54.1	12%	0.117	29%	0.292	C	S	.	.	H	α-helix	trans	-53.6	-34.9	173.2	-29	34.5	0	0	0	113.9	I32 T113 H169 F170 I176 A177	I32-P173 HydrophobicContact CD1-CB 4.3Å; I32-P173 HydrophobicContact CG1-CB 3.77Å; T113-P173 HydrophobicContact CG2-CG 3.86Å; H169-P173 WeakPolarHBondContact O-CD 3.36Å; H169-P173 WeakPolarHBondContact O-CG 3.27Å; F170-P173 WeakPolarHBondContact O-CD 3.38Å; P173-I176 PolarHBondContact O-N 3.5Å; P173-A177 PolarHBondContact O-N 3.49Å
174	F	98.7	Very high	98.7	Very high	91 Å²	91	55.3 Å²	55.3	40%	0.399	30%	0.296	S	S	.	.	H	α-helix	trans	-75.2	-35.2	177.1	-58.4	-78.3	0	0	0	112.2	I32 F170 I171 L172 I176 A177 A178	I32-F174 HydrophobicContact CG2-CE1 3.99Å; I32-F174 HydrophobicContact CG2-CZ 4.15Å; F170-F174 HydrophobicContact CD1-CE2 4.17Å; F170-F174 AromaticContact CE1-CE2 3.9Å; F170-F174 HydrophobicContact CE1-CE2 3.9Å; F170-F174 HydrophobicContact CZ-CE2 4.48Å; F170-F174 VanDerWaalsContact O-CD2 3.28Å; F170-F174 WeakPolarHBondContact O-CD2 3.1Å; F170-F174 VanDerWaalsContact O-CE2 3.26Å; F170-F174 WeakPolarHBondContact O-CE2 3.33Å; I171-F174 WeakPolarHBondContact O-CB 3.36Å; I171-F174 PolarHBondContact O-N 3.39Å; I171-F174 VanDerWaalsContact O-N 3.1Å; L172-F174 PolarHBondContact O-N 3.21Å; F174-I176 VanDerWaalsContact C-N 3.34Å; F174-A177 WeakPolarHBondContact O-CB 3.44Å; F174-A177 PolarHBondContact O-N 3.48Å; F174-A178 PolarHBondContact O-N 2.8Å
175	I	98.8	Very high	98.7	Very high	80 Å²	80	56 Å²	56	41%	0.41	31%	0.305	S	S	.	.	H	α-helix	trans	-64.5	-41.8	171	-62.9	171.4	0	0	0	110.1	I171 L172 A177 A178 L179	I171-I175 HydrophobicContact CG1-CD1 4.27Å; I171-I175 PolarHBondContact O-N 2.91Å; L172-I175 HydrophobicContact CD2-CD1 4.18Å; L172-I175 CarbonylContact O-C 3.24Å; L172-I175 WeakPolarHBondContact O-CA 3.47Å; L172-I175 WeakPolarHBondContact O-CB 3.47Å; L172-I175 PolarHBondContact O-N 3.28Å; I175-A177 VanDerWaalsContact C-N 3.31Å; I175-A177 PolarHBondContact O-N 3.49Å; I175-A178 PolarHBondContact O-N 3.29Å; I175-L179 HydrophobicContact CG2-CD1 4.26Å; I175-L179 WeakPolarHBondContact O-CG 3.48Å; I175-L179 PolarHBondContact O-N 3Å
176	I	98.9	Very high	98.7	Very high	6 Å²	6	59.1 Å²	59.1	3%	0.031	32%	0.318	C	S	.	.	H	α-helix	trans	-60.1	-41.9	174.2	-69	162.3	0	0	0	110.5	L28 L106 A109 V110 T113 L172 P173 F174 A178 L179 A180	L28-I176 HydrophobicContact CD1-CB 4.41Å; L28-I176 HydrophobicContact CD1-CG2 3.92Å; L28-I176 HydrophobicContact CD2-CG2 4.01Å; L106-I176 HydrophobicContact CD2-CG2 3.83Å; L106-I176 WeakPolarHBondContact CD2-O 3.07Å; A109-I176 HydrophobicContact CB-CD1 4.17Å; A109-I176 HydrophobicContact CB-CG1 3.69Å; V110-I176 HydrophobicContact CG2-CD1 3.87Å; V110-I176 HydrophobicContact CG2-CG1 4.44Å; V110-I176 HydrophobicContact CG2-CG2 4.15Å; T113-I176 WeakPolarHBondContact OG1-CD1 3.32Å; L172-I176 WeakPolarHBondContact O-CG1 3.31Å; L172-I176 PolarHBondContact O-N 2.95Å; P173-I176 PolarHBondContact O-N 3.5Å; F174-I176 VanDerWaalsContact C-N 3.34Å; I176-A178 PolarHBondContact O-N 2.95Å; I176-L179 PolarHBondContact O-N 2.92Å; I176-A180 WeakPolarHBondContact O-CB 3.41Å; I176-A180 PolarHBondContact O-N 3.45Å
177	A	98.8	Very high	98.7	Very high	31 Å²	31	58.5 Å²	58.5	26%	0.256	32%	0.317	S	S	.	.	H	α-helix	trans	-61.2	-43.1	175.9	0	0	0	0	0	112	L28 P173 F174 I175 A180 I181	L28-A177 HydrophobicContact CD2-CB 3.96Å; P173-A177 PolarHBondContact O-N 3.49Å; F174-A177 WeakPolarHBondContact O-CB 3.44Å; F174-A177 PolarHBondContact O-N 3.48Å; I175-A177 VanDerWaalsContact C-N 3.31Å; I175-A177 PolarHBondContact O-N 3.49Å; A177-A180 PolarHBondContact O-N 2.88Å; A177-I181 WeakPolarHBondContact O-CG1 3.47Å; A177-I181 PolarHBondContact O-N 3.49Å; A177-I181 VanDerWaalsContact O-N 3.12Å
178	A	98.8	Very high	98.6	Very high	55 Å²	55	59.2 Å²	59.2	46%	0.455	31%	0.311	S	S	.	.	H	α-helix	trans	-63.4	-44.5	175	0	0	0	0	0	112.1	F174 I175 I176 A180 I181 V182	F174-A178 PolarHBondContact O-N 2.8Å; I175-A178 PolarHBondContact O-N 3.29Å; I176-A178 PolarHBondContact O-N 2.95Å; A178-A180 VanDerWaalsContact C-N 3.3Å; A178-A180 PolarHBondContact O-N 2.89Å; A178-I181 WeakPolarHBondContact O-CB 3.29Å; A178-I181 PolarHBondContact O-N 3.1Å; A178-V182 PolarHBondContact O-N 3.02Å; A178-V182 VanDerWaalsContact O-N 3.14Å
179	L	98.7	Very high	98.6	Very high	42 Å²	42	61.2 Å²	61.2	22%	0.22	32%	0.321	C	S	.	.	H	α-helix	trans	-62.5	-36.2	175.1	-72.5	174	0	0	0	112.2	L106 I175 I176 I181 V182 H183	L106-L179 HydrophobicContact CD2-CB 3.57Å; L106-L179 HydrophobicContact CG-CB 4.06Å; I175-L179 HydrophobicContact CG2-CD1 4.26Å; I175-L179 WeakPolarHBondContact O-CG 3.48Å; I175-L179 PolarHBondContact O-N 3Å; I176-L179 PolarHBondContact O-N 2.92Å; L179-I181 VanDerWaalsContact C-N 3.33Å; L179-I181 PolarHBondContact O-N 3.1Å; L179-V182 PolarHBondContact O-N 3.14Å; L179-H183 WeakPolarHBondContact O-CB 3.47Å; L179-H183 PolarHBondContact O-N 3.4Å
180	A	98.8	Very high	98.4	Very high	29 Å²	29	63.3 Å²	63.3	24%	0.24	34%	0.336	C	S	.	.	H	α-helix	trans	-65.9	-35.5	176.5	0	0	0	0	0	112	L106 I176 A177 A178 H183 L184	L106-A180 HydrophobicContact CD2-CB 4.4Å; I176-A180 WeakPolarHBondContact O-CB 3.41Å; I176-A180 PolarHBondContact O-N 3.45Å; A177-A180 PolarHBondContact O-N 2.88Å; A178-A180 VanDerWaalsContact C-N 3.3Å; A178-A180 PolarHBondContact O-N 2.89Å; A180-H183 WeakPolarHBondContact O-CB 3.36Å; A180-H183 PolarHBondContact O-N 3.4Å; A180-L184 WeakPolarHBondContact O-CG 3.34Å; A180-L184 PolarHBondContact O-N 2.97Å
181	I	98.6	Very high	98.3	Very high	117 Å²	117	60 Å²	60	60%	0.6	33%	0.325	S	S	*	.	H	α-helix	trans	-64.1	-45.4	172.3	-66.5	166.4	0	0	0	110.3	A177 A178 L179 H183 L184 L185	A177-I181 WeakPolarHBondContact O-CG1 3.47Å; A177-I181 PolarHBondContact O-N 3.49Å; A177-I181 VanDerWaalsContact O-N 3.12Å; A178-I181 WeakPolarHBondContact O-CB 3.29Å; A178-I181 PolarHBondContact O-N 3.1Å; L179-I181 VanDerWaalsContact C-N 3.33Å; L179-I181 PolarHBondContact O-N 3.1Å; I181-H183 VanDerWaalsContact C-N 3.32Å; I181-H183 PolarHBondContact O-N 3.2Å; I181-L184 PolarHBondContact O-N 3.32Å; I181-L185 WeakPolarHBondContact O-CB 3.35Å; I181-L185 PolarHBondContact O-N 3.36Å
182	V	98.8	Very high	98.3	Very high	57 Å²	57	57.7 Å²	57.7	35%	0.345	32%	0.316	S	S	.	.	H	α-helix	trans	-63.3	-39.5	176.6	176.6	0	0	0	0	111.3	I102 A178 L179 L184 L185 F186	I102-V182 HydrophobicContact CD1-CG1 4.22Å; I102-V182 HydrophobicContact CG1-CG1 4.29Å; A178-V182 PolarHBondContact O-N 3.02Å; A178-V182 VanDerWaalsContact O-N 3.14Å; L179-V182 PolarHBondContact O-N 3.14Å; V182-L184 PolarHBondContact O-N 3.14Å; V182-L185 WeakPolarHBondContact O-CB 3.19Å; V182-L185 PolarHBondContact O-N 3.03Å; V182-F186 HydrophobicContact CG1-CD2 3.91Å; V182-F186 HydrophobicContact CG1-CE2 3.74Å; V182-F186 WeakPolarHBondContact O-CD2 3.24Å; V182-F186 PolarHBondContact O-N 2.94Å; V182-F186 VanDerWaalsContact O-N 3.1Å
183	H	98.7	Very high	98.2	Very high	28 Å²	28	57.1 Å²	57.1	13%	0.13	31%	0.314	C	S	.	.	H	α-helix	trans	-59.1	-46.6	175.2	-175.2	75.9	0	0	0	111.8	T99 I102 G103 L106 L179 A180 I181 L187	T99-H183 WeakPolarHBondContact CG2-CE1 3.33Å; T99-H183 PolarHBondContact O-CE1 3.47Å; T99-H183 PolarHBondContact O-ND1 3.4Å; I102-H183 HydrophobicContact CB-CB 4.4Å; I102-H183 HydrophobicContact CG2-CB 3.66Å; G103-H183 PolarHBondContact N-ND1 2.92Å; L106-H183 HydrophobicContact CD1-CB 3.81Å; L179-H183 WeakPolarHBondContact O-CB 3.47Å; L179-H183 PolarHBondContact O-N 3.4Å; A180-H183 WeakPolarHBondContact O-CB 3.36Å; A180-H183 PolarHBondContact O-N 3.4Å; I181-H183 VanDerWaalsContact C-N 3.32Å; I181-H183 PolarHBondContact O-N 3.2Å; H183-L187 PolarHBondContact O-N 3.16Å; H183-L187 VanDerWaalsContact O-N 3.07Å
184	L	98.4	Very high	98.2	Very high	86 Å²	86	56.5 Å²	56.5	45%	0.45	31%	0.309	S	S	.	.	H	α-helix	trans	-68.9	-33.3	177.1	-70.8	173.5	0	0	0	112.6	A180 I181 V182 L187 H188	A180-L184 WeakPolarHBondContact O-CG 3.34Å; A180-L184 PolarHBondContact O-N 2.97Å; I181-L184 PolarHBondContact O-N 3.32Å; V182-L184 PolarHBondContact O-N 3.14Å; L184-L187 HydrophobicContact CD2-CD2 4.18Å; L184-L187 PolarHBondContact O-N 3.32Å; L184-H188 WeakPolarHBondContact O-CB 3.13Å; L184-H188 PolarHBondContact O-CD2 3.03Å; L184-H188 PolarHBondContact O-N 3.46Å
185	L	98.3	Very high	98.2	Very high	91 Å²	91	54.1 Å²	54.1	48%	0.476	30%	0.303	S	S	.	.	H	α-helix	trans	-59.5	-53.1	174.8	-173.1	160.3	0	0	0	110.4	I181 V182 L187 H188 E189	I181-L185 WeakPolarHBondContact O-CB 3.35Å; I181-L185 PolarHBondContact O-N 3.36Å; V182-L185 WeakPolarHBondContact O-CB 3.19Å; V182-L185 PolarHBondContact O-N 3.03Å; L185-L187 VanDerWaalsContact C-N 3.29Å; L185-L187 PolarHBondContact O-N 2.86Å; L185-H188 PolarHBondContact O-N 2.83Å; L185-H188 VanDerWaalsContact O-N 3.07Å; L185-E189 PolarHBondContact O-N 2.9Å
186	F	98.6	Very high	98.2	Very high	74 Å²	74	54.4 Å²	54.4	33%	0.325	31%	0.309	S	S	.	.	H	α-helix	trans	-63.1	-34.9	176.9	-77.1	-62.7	0	0	0	112.9	E98 T99 I102 V182 H188 E189	E98-F186 HydrophobicContact CB-CB 4.06Å; E98-F186 HydrophobicContact CB-CD1 3.52Å; E98-F186 HydrophobicContact CB-CD2 4.01Å; E98-F186 HydrophobicContact CB-CE1 3.87Å; E98-F186 HydrophobicContact CB-CE2 4.31Å; E98-F186 HydrophobicContact CB-CG 3.6Å; E98-F186 HydrophobicContact CB-CZ 4.24Å; E98-F186 HydrophobicContact CG-CD1 3.95Å; E98-F186 HydrophobicContact CG-CE1 3.9Å; E98-F186 HydrophobicContact CG-CZ 4.41Å; T99-F186 VanDerWaalsContact OG1-C 3.26Å; T99-F186 WeakPolarHBondContact OG1-CB 3.43Å; I102-F186 HydrophobicContact CG1-CD2 4.19Å; I102-F186 HydrophobicContact CG1-CE2 4.39Å; V182-F186 HydrophobicContact CG1-CD2 3.91Å; V182-F186 HydrophobicContact CG1-CE2 3.74Å; V182-F186 WeakPolarHBondContact O-CD2 3.24Å; V182-F186 PolarHBondContact O-N 2.94Å; V182-F186 VanDerWaalsContact O-N 3.1Å; F186-H188 VanDerWaalsContact C-N 3.29Å; F186-H188 PolarHBondContact O-N 3.33Å; F186-E189 PolarHBondContact O-N 2.92Å
187	L	98.3	Very high	98	Very high	35 Å²	35	56.5 Å²	56.5	18%	0.183	33%	0.331	C	S	.	.	H	α-helix	trans	-63.4	-36.5	173.6	-180	63.5	0	0	0	112	T99 H183 L184 L185 E189 T190 G191	T99-L187 HydrophobicContact CG2-CB 4.07Å; T99-L187 HydrophobicContact CG2-CD1 4.38Å; T99-L187 PolarHBondContact OG1-N 3.08Å; H183-L187 PolarHBondContact O-N 3.16Å; H183-L187 VanDerWaalsContact O-N 3.07Å; L184-L187 HydrophobicContact CD2-CD2 4.18Å; L184-L187 PolarHBondContact O-N 3.32Å; L185-L187 VanDerWaalsContact C-N 3.29Å; L185-L187 PolarHBondContact O-N 2.86Å; L187-E189 VanDerWaalsContact C-N 3.32Å; L187-T190 PolarHBondContact O-N 2.77Å; L187-T190 PolarHBondContact O-OG1 2.99Å; L187-G191 CarbonylContact O-C 3.59Å; L187-G191 VanDerWaalsContact O-CA 3.32Å; L187-G191 WeakPolarHBondContact O-CA 3.47Å; L187-G191 PolarHBondContact O-N 2.9Å
188	H	97.8	Very high	97.9	Very high	72 Å²	72	61 Å²	61	33%	0.333	35%	0.35	S	S	.	.	H	α-helix	trans	-73	-23.2	-179.8	-70.3	173.6	0	0	0	113.3	L184 L185 F186 T190	L184-H188 WeakPolarHBondContact O-CB 3.13Å; L184-H188 PolarHBondContact O-CD2 3.03Å; L184-H188 PolarHBondContact O-N 3.46Å; L185-H188 PolarHBondContact O-N 2.83Å; 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 3.32Å; H188-T190 PolarHBondContact O-N 3.45Å
189	E	97.1	Very high	97.8	Very high	150 Å²	150	64.3 Å²	64.3	70%	0.701	36%	0.36	S	S	*	.	H	α-helix	trans	-63.8	-37.4	172.8	-64.7	-60.4	134	0	0	112	L185 F186 L187	L185-E189 PolarHBondContact O-N 2.9Å; F186-E189 PolarHBondContact O-N 2.92Å; L187-E189 VanDerWaalsContact C-N 3.32Å
190	T	95.9	Very high	97.7	Very high	71 Å²	71	63.2 Å²	63.2	44%	0.436	36%	0.356	S	S	.	.	H	α-helix	trans	-99.5	-25.1	-179	61.2	0	0	0	0	113.6	F96 L187 H188	F96-T190 HydrophobicContact CD1-CG2 4.25Å; L187-T190 PolarHBondContact O-N 2.77Å; L187-T190 PolarHBondContact O-OG1 2.99Å; H188-T190 VanDerWaalsContact C-N 3.32Å; H188-T190 PolarHBondContact O-N 3.45Å
191	G	96.5	Very high	97.7	Very high	13 Å²	13	66.5 Å²	66.5	13%	0.134	37%	0.37	C	S	.	.			trans	75.5	174.5	-162.3	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 3.47Å; L187-G191 PolarHBondContact O-N 2.9Å
192	S	97.8	Very high	97.6	Very high	33 Å²	33	66.1 Å²	66.1	23%	0.231	38%	0.384	C	S	.	.			trans	-72.8	142.3	179	-73.6	0	0	0	0	112.4	P11	P11-S192 VanDerWaalsContact CG-O 3.27Å; P11-S192 WeakPolarHBondContact CG-O 3.42Å
193	N	98.1	Very high	97.5	Very high	21 Å²	21	67.8 Å²	67.8	11%	0.112	39%	0.391	C	S	.	.			trans	-68.7	174.5	161.1	-170.5	16.4	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 4.3Å; W18-N193 VanDerWaalsContact CZ2-O 3.22Å; W18-N193 WeakPolarHBondContact CZ2-O 3.41Å; W18-N193 PolarHBondContact NE1-O 3.06Å; Y91-N193 PolarHBondContact O-ND2 2.91Å; S93-N193 PolarHBondContact OG-ND2 3.48Å; F96-N193 HydrophobicContact CE2-CB 3.69Å; F96-N193 HydrophobicContact CZ-CB 3.97Å
194	N	98.6	Very high	97.5	Very high	4 Å²	4	69.9 Å²	69.9	2%	0.021	40%	0.4	C	S	.	.			trans	-143.8	169.3	178	75.2	84.9	0	0	0	112.9	P11 N13 I14 T196 G197 L198	P11-N194 HydrophobicContact CB-CB 3.78Å; P11-N194 HydrophobicContact CG-CB 4.1Å; N13-N194 PolarHBondContact ND2-OD1 3.41Å; N13-N194 VanDerWaalsContact ND2-OD1 3.14Å; N13-N194 WeakPolarHBondContact OD1-CB 3.5Å; I14-N194 HydrophobicContact CG2-CB 4.02Å; N194-T196 PolarHBondContact O-N 2.94Å; N194-T196 VanDerWaalsContact O-N 3.11Å; N194-T196 PolarHBondContact OD1-N 3.39Å; N194-T196 VanDerWaalsContact OD1-N 3.09Å; N194-T196 PolarHBondContact OD1-OG1 3.1Å; N194-G197 PolarHBondContact O-N 3.14Å; N194-L198 PolarHBondContact ND2-O 2.99Å
195	P	98.5	Very high	97.5	Very high	42 Å²	42	67.5 Å²	67.5	27%	0.273	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-23.3	-171.8	-29.2	38	0	0	0	116.5	N13 W18 Y91	N13-P195 VanDerWaalsContact O-CD 3.3Å; N13-P195 WeakPolarHBondContact O-CD 3.46Å; N13-P195 WeakPolarHBondContact O-CG 3.44Å; W18-P195 HydrophobicContact CH2-CG 4.33Å; W18-P195 HydrophobicContact CZ3-CG 4.06Å; Y91-P195 HydrophobicContact CD1-CB 4.31Å; Y91-P195 HydrophobicContact CE1-CB 3.72Å; Y91-P195 HydrophobicContact CE1-CG 4.45Å
196	T	97.7	Very high	97.5	Very high	86 Å²	86	65.9 Å²	65.9	53%	0.528	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-15.1	179.4	69.9	0	0	0	0	112.8	N194 L198	N194-T196 PolarHBondContact O-N 2.94Å; N194-T196 VanDerWaalsContact O-N 3.11Å; N194-T196 PolarHBondContact OD1-N 3.39Å; N194-T196 VanDerWaalsContact OD1-N 3.09Å; N194-T196 PolarHBondContact OD1-OG1 3.1Å; T196-L198 PolarHBondContact O-N 3.32Å; T196-L198 PolarHBondContact OG1-N 3.02Å
197	G	95.8	Very high	97.5	Very high	49 Å²	49	63.8 Å²	63.8	51%	0.505	37%	0.373	S	S	.	.			trans	68.2	4.2	-173.8	0	0	0	0	0	114.6	N194	N194-G197 PolarHBondContact O-N 3.14Å
198	L	96.3	Very high	97.5	Very high	126 Å²	126	66.7 Å²	66.7	66%	0.66	39%	0.385	S	S	*	.	S	Bend	trans	-88	158.6	176.8	-58.5	178.8	0	0	0	111.1	N194 T196 S200	N194-L198 PolarHBondContact ND2-O 2.99Å; T196-L198 PolarHBondContact O-N 3.32Å; T196-L198 PolarHBondContact OG1-N 3.02Å; L198-S200 PolarHBondContact O-N 3.04Å
199	N	96.8	Very high	97.5	Very high	124 Å²	124	66.4 Å²	66.4	66%	0.663	39%	0.39	S	S	*	.			trans	-59.7	131.2	171.7	-176.3	-34.9	0	0	0	109.7	D201	N199-D201 PolarHBondContact ND2-OD2 3.1Å; N199-D201 WeakPolarHBondContact OD1-CB 3.24Å; N199-D201 PolarHBondContact OD1-N 2.68Å; N199-D201 PolarHBondContact OD1-OD2 3.49Å; N199-D201 VanDerWaalsContact OD1-OD2 3.07Å
200	S	97.1	Very high	97.5	Very high	19 Å²	19	65.5 Å²	65.5	13%	0.133	38%	0.381	C	S	.	.			trans	-108.3	7.1	-175.9	57.1	0	0	0	0	114.2	P11 L198 A202 D203 K204	P11-S200 WeakPolarHBondContact CB-OG 3.34Å; P11-S200 WeakPolarHBondContact CG-OG 3.35Å; L198-S200 PolarHBondContact O-N 3.04Å; S200-A202 PolarHBondContact O-N 2.93Å; S200-A202 VanDerWaalsContact O-N 3.14Å; S200-D203 CarbonylContact O-C 3.59Å; S200-D203 VanDerWaalsContact O-C 3.24Å; S200-D203 PolarHBondContact O-N 3.09Å; S200-K204 WeakPolarHBondContact O-CG 3.29Å
201	D	97.3	Very high	97.6	Very high	99 Å²	99	62.7 Å²	62.7	53%	0.529	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-29.5	-177.3	-67.7	-25.4	0	0	0	113	N199 D203 K204	N199-D201 PolarHBondContact ND2-OD2 3.1Å; N199-D201 WeakPolarHBondContact OD1-CB 3.24Å; N199-D201 PolarHBondContact OD1-N 2.68Å; N199-D201 PolarHBondContact OD1-OD2 3.49Å; N199-D201 VanDerWaalsContact OD1-OD2 3.07Å; D201-D203 PolarHBondContact O-N 3.29Å; D201-K204 WeakPolarHBondContact OD1-CE 3.42Å; D201-K204 IonicContact OD1-NZ 2.65Å; D201-K204 PolarHBondContact OD1-NZ 3.29Å
202	A	96.8	Very high	97.7	Very high	108 Å²	108	62.8 Å²	62.8	89%	0.893	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-17.8	175.7	0	0	0	0	0	113.8	S200	S200-A202 PolarHBondContact O-N 2.93Å; S200-A202 VanDerWaalsContact O-N 3.14Å
203	D	97.8	Very high	97.8	Very high	93 Å²	93	66.5 Å²	66.5	50%	0.497	38%	0.377	S	S	.	.	S	Bend	trans	-145.3	71.1	-176.9	-172.7	26.5	0	0	0	111.9	S12 S200 D201	S12-D203 VanDerWaalsContact CB-OD2 3.3Å; S12-D203 WeakPolarHBondContact CB-OD2 3.38Å; S12-D203 PolarHBondContact N-O 3.37Å; S12-D203 VanDerWaalsContact OG-CG 3.28Å; S12-D203 PolarHBondContact OG-OD2 3.04Å; S200-D203 CarbonylContact O-C 3.59Å; S200-D203 VanDerWaalsContact O-C 3.24Å; S200-D203 PolarHBondContact O-N 3.09Å; D201-D203 PolarHBondContact O-N 3.29Å
204	K	98.1	Very high	97.8	Very high	72 Å²	72	67.7 Å²	67.7	31%	0.313	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	143.9	171.1	-66.6	-170.3	-179.3	167.4	0	111.1	P9 T10 S200 D201	P9-K204 HydrophobicContact CB-CB 4.16Å; P9-K204 HydrophobicContact CB-CD 3.6Å; P9-K204 HydrophobicContact CB-CG 4.49Å; T10-K204 WeakPolarHBondContact O-CA 3.34Å; S200-K204 WeakPolarHBondContact O-CG 3.29Å; D201-K204 WeakPolarHBondContact OD1-CE 3.42Å; D201-K204 IonicContact OD1-NZ 2.65Å; D201-K204 PolarHBondContact OD1-NZ 3.29Å
205	I	98.4	Very high	97.8	Very high	35 Å²	35	68.6 Å²	68.6	18%	0.179	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	153.6	172.5	61.5	179.1	0	0	0	109.6	T10 Y210 Y211	T10-I205 PolarHBondContact N-O 3.32Å; T10-I205 PolarHBondContact O-N 2.9Å; I205-Y210 HydrophobicContact CB-CD2 4.11Å; I205-Y210 HydrophobicContact CB-CE2 4.22Å; I205-Y210 HydrophobicContact CD1-CD1 4.3Å; I205-Y210 HydrophobicContact CD1-CD2 3.87Å; I205-Y210 HydrophobicContact CD1-CG 3.74Å; I205-Y210 HydrophobicContact CG1-CD2 4.23Å; I205-Y211 HydrophobicContact CD1-CE2 3.78Å; I205-Y211 HydrophobicContact CG1-CE2 3.85Å
206	P	97.9	Very high	97.8	Very high	58 Å²	58	71 Å²	71	38%	0.377	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	147.7	173	28.8	-35.9	0	0	0	110.2	H208 Y210	P206-H208 WeakPolarHBondContact CB-O 3.13Å; P206-H208 WeakPolarHBondContact CG-O 3.45Å; P206-H208 PolarHBondContact O-N 3.49Å; P206-Y210 HydrophobicContact CG-CD2 4.31Å; P206-Y210 HydrophobicContact CG-CE2 4.13Å; P206-Y210 WeakPolarHBondContact O-CD2 3.34Å
207	F	98.4	Very high	97.8	Very high	29 Å²	29	71.9 Å²	71.9	13%	0.127	40%	0.396	C	S	.	.	S	Bend	trans	-64.4	-41.1	179.4	-173.5	-81.6	0	0	0	112	F5 I6 L8 P209 Y210 Y211 T212	F5-F207 HydrophobicContact CD2-CD1 4.47Å; F5-F207 HydrophobicContact CD2-CE1 4.16Å; F5-F207 HydrophobicContact CE2-CD1 4.49Å; F5-F207 AromaticContact CE2-CE1 3.85Å; F5-F207 HydrophobicContact CE2-CE1 3.85Å; F5-F207 HydrophobicContact CZ-CE1 4.19Å; F5-F207 WeakPolarHBondContact O-CB 3.44Å; F5-F207 WeakPolarHBondContact O-CD1 3.26Å; I6-F207 PolarHBondContact O-N 3.28Å; L8-F207 HydrophobicContact CB-CB 3.92Å; L8-F207 HydrophobicContact CD2-CD2 4.29Å; L8-F207 WeakPolarHBondContact O-CB 3.4Å; L8-F207 PolarHBondContact O-N 2.94Å; F207-P209 CarbonylContact O-C 3.37Å; F207-Y210 PolarHBondContact O-N 3.24Å; F207-Y211 HydrophobicContact CD2-CD2 4.1Å; F207-Y211 HydrophobicContact CD2-CG 4.15Å; F207-Y211 HydrophobicContact CE2-CG 4.21Å; F207-Y211 PolarHBondContact O-N 2.59Å; F207-T212 HydrophobicContact CD1-CG2 3.7Å; F207-T212 HydrophobicContact CE1-CG2 3.7Å; F207-T212 PolarHBondContact O-N 3.39Å
208	H	98.1	Very high	97.9	Very high	96 Å²	96	70.1 Å²	70.1	44%	0.444	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	134.2	168.8	-175	70.8	0	0	0	110.8	I6 P206 T212	I6-H208 HydrophobicContact CG2-CB 4.08Å; I6-H208 PolarHBondContact O-N 3.42Å; P206-H208 WeakPolarHBondContact CB-O 3.13Å; P206-H208 WeakPolarHBondContact CG-O 3.45Å; P206-H208 PolarHBondContact O-N 3.49Å; H208-T212 HydrophobicContact CB-CG2 3.99Å; H208-T212 PolarHBondContact ND1-OG1 3.44Å
209	P	98.1	Very high	98	Very high	67 Å²	67	66 Å²	66	44%	0.435	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	cis	-88.5	-14.4	2.2	34.6	-35.4	0	0	0	114.8	F207 Y211 T212 I213	F207-P209 CarbonylContact O-C 3.37Å; P209-Y211 PolarHBondContact O-N 3.43Å; P209-T212 VanDerWaalsContact C-OG1 3.27Å; P209-T212 WeakPolarHBondContact CA-OG1 3.43Å; P209-T212 PolarHBondContact O-N 3.21Å; P209-T212 PolarHBondContact O-OG1 3.26Å; P209-I213 WeakPolarHBondContact O-CG2 3.32Å; P209-I213 PolarHBondContact O-N 3.44Å
210	Y	98.4	Very high	98.1	Very high	131 Å²	131	65.5 Å²	65.5	51%	0.514	35%	0.353	S	S	.	.	H	α-helix	trans	-58	-54.4	-163.6	-60.4	-77.7	0	0	0	114.3	I205 P206 F207 I213 K214	I205-Y210 HydrophobicContact CB-CD2 4.11Å; I205-Y210 HydrophobicContact CB-CE2 4.22Å; I205-Y210 HydrophobicContact CD1-CD1 4.3Å; I205-Y210 HydrophobicContact CD1-CD2 3.87Å; I205-Y210 HydrophobicContact CD1-CG 3.74Å; I205-Y210 HydrophobicContact CG1-CD2 4.23Å; P206-Y210 HydrophobicContact CG-CD2 4.31Å; P206-Y210 HydrophobicContact CG-CE2 4.13Å; P206-Y210 WeakPolarHBondContact O-CD2 3.34Å; F207-Y210 PolarHBondContact O-N 3.24Å; Y210-I213 WeakPolarHBondContact O-CG2 3.35Å; Y210-K214 WeakPolarHBondContact O-CB 3.45Å; Y210-K214 PolarHBondContact O-N 3.42Å
211	Y	98.3	Very high	98.2	Very high	12 Å²	12	68.8 Å²	68.8	5%	0.047	37%	0.368	C	S	.	.	H	α-helix	trans	-83.5	-25.9	-179.2	-66.1	-59.9	0	0	0	112.3	T10 P11 S12 I14 I205 F207 P209 K214 D215	T10-Y211 HydrophobicContact CG2-CD2 3.47Å; T10-Y211 VanDerWaalsContact CG2-CD2 3.47Å; T10-Y211 HydrophobicContact CG2-CE2 3.26Å; T10-Y211 HydrophobicContact CG2-CG 4.36Å; P11-Y211 PolarHBondContact O-OH 2.76Å; S12-Y211 PolarHBondContact O-OH 3.45Å; I14-Y211 HydrophobicContact CD1-CD1 3.85Å; I14-Y211 HydrophobicContact CD1-CD2 4.42Å; I14-Y211 HydrophobicContact CD1-CE1 3.54Å; I14-Y211 HydrophobicContact CD1-CE2 4.1Å; I14-Y211 HydrophobicContact CD1-CG 4.31Å; I14-Y211 HydrophobicContact CG1-CD1 4.06Å; I14-Y211 HydrophobicContact CG1-CE1 3.23Å; I14-Y211 HydrophobicContact CG1-CE2 4.14Å; I14-Y211 WeakPolarHBondContact CG1-OH 3.19Å; I205-Y211 HydrophobicContact CD1-CE2 3.78Å; I205-Y211 HydrophobicContact CG1-CE2 3.85Å; F207-Y211 HydrophobicContact CD2-CD2 4.1Å; F207-Y211 HydrophobicContact CD2-CG 4.15Å; F207-Y211 HydrophobicContact CE2-CG 4.21Å; F207-Y211 PolarHBondContact O-N 2.59Å; P209-Y211 PolarHBondContact O-N 3.43Å; Y211-K214 HydrophobicContact CD1-CD 3.9Å; Y211-K214 HydrophobicContact CE1-CD 4.12Å; Y211-K214 PolarHBondContact O-N 3.22Å; Y211-D215 VanDerWaalsContact O-CB 3.26Å; Y211-D215 WeakPolarHBondContact O-CB 3.25Å; Y211-D215 PolarHBondContact O-N 2.81Å
212	T	98.3	Very high	98.2	Very high	15 Å²	15	64.4 Å²	64.4	9%	0.092	35%	0.345	C	S	.	.	H	α-helix	trans	-60.1	-47	171.3	55.1	0	0	0	0	112.5	F5 F207 H208 P209 D215 I216	F5-T212 HydrophobicContact CD1-CG2 4.4Å; F5-T212 HydrophobicContact CE1-CG2 3.59Å; F5-T212 HydrophobicContact CZ-CG2 3.72Å; F207-T212 HydrophobicContact CD1-CG2 3.7Å; F207-T212 HydrophobicContact CE1-CG2 3.7Å; F207-T212 PolarHBondContact O-N 3.39Å; H208-T212 HydrophobicContact CB-CG2 3.99Å; H208-T212 PolarHBondContact ND1-OG1 3.44Å; P209-T212 VanDerWaalsContact C-OG1 3.27Å; P209-T212 WeakPolarHBondContact CA-OG1 3.43Å; P209-T212 PolarHBondContact O-N 3.21Å; P209-T212 PolarHBondContact O-OG1 3.26Å; T212-D215 PolarHBondContact O-N 3.12Å; T212-I216 VanDerWaalsContact O-CG1 3.26Å; T212-I216 WeakPolarHBondContact O-CG1 3.45Å; T212-I216 PolarHBondContact O-N 3.16Å
213	I	98.4	Very high	98.1	Very high	110 Å²	110	63 Å²	63	56%	0.564	32%	0.318	S	S	*	.	H	α-helix	trans	-70.8	-36.6	179.7	-168.8	60.2	0	0	0	111.8	P209 Y210 I216 L217	P209-I213 WeakPolarHBondContact O-CG2 3.32Å; P209-I213 PolarHBondContact O-N 3.44Å; Y210-I213 WeakPolarHBondContact O-CG2 3.35Å; I213-I216 PolarHBondContact O-N 3.41Å; I213-L217 PolarHBondContact O-N 3.22Å
214	K	98.4	Very high	98.1	Very high	47 Å²	47	65 Å²	65	20%	0.204	33%	0.328	C	S	.	.	H	α-helix	trans	-64.6	-40.8	176.3	-168.4	-169.2	170	-160	0	111.6	I14 S15 N19 Y210 Y211 L217 G218	I14-K214 PolarHBondContact O-NZ 2.74Å; S15-K214 PolarHBondContact O-NZ 2.86Å; N19-K214 PolarHBondContact ND2-O 2.74Å; N19-K214 WeakPolarHBondContact OD1-CE 3.46Å; N19-K214 PolarHBondContact OD1-NZ 2.77Å; Y210-K214 WeakPolarHBondContact O-CB 3.45Å; Y210-K214 PolarHBondContact O-N 3.42Å; Y211-K214 HydrophobicContact CD1-CD 3.9Å; Y211-K214 HydrophobicContact CE1-CD 4.12Å; Y211-K214 PolarHBondContact O-N 3.22Å; K214-L217 PolarHBondContact O-N 2.95Å; K214-G218 PolarHBondContact O-N 3.29Å
215	D	98.4	Very high	97.9	Very high	23 Å²	23	67 Å²	67	12%	0.123	34%	0.341	C	S	.	.	H	α-helix	trans	-67.8	-41.8	175.7	-82.4	-3.9	0	0	0	111.8	N19 S22 Y211 T212 L217 G218 I219	N19-D215 PolarHBondContact ND2-OD1 2.9Å; S22-D215 WeakPolarHBondContact CB-OD2 3.4Å; S22-D215 PolarHBondContact OG-OD1 3.44Å; S22-D215 VanDerWaalsContact OG-OD1 3.1Å; S22-D215 PolarHBondContact OG-OD2 3.33Å; Y211-D215 VanDerWaalsContact O-CB 3.26Å; Y211-D215 WeakPolarHBondContact O-CB 3.25Å; Y211-D215 PolarHBondContact O-N 2.81Å; T212-D215 PolarHBondContact O-N 3.12Å; D215-L217 VanDerWaalsContact C-N 3.28Å; D215-L217 PolarHBondContact O-N 2.95Å; D215-G218 PolarHBondContact O-N 3.46Å; D215-G218 VanDerWaalsContact O-N 3.12Å; D215-I219 VanDerWaalsContact O-CG1 3.25Å; D215-I219 WeakPolarHBondContact O-CG1 3.2Å; D215-I219 PolarHBondContact O-N 3.23Å
216	I	98.6	Very high	97.3	Very high	92 Å²	92	66.3 Å²	66.3	47%	0.472	34%	0.338	S	S	.	.	H	α-helix	trans	-56.9	-44.5	173.5	-70.7	165.2	0	0	0	110.6	T212 I213 G218 I219 L220	T212-I216 VanDerWaalsContact O-CG1 3.26Å; T212-I216 WeakPolarHBondContact O-CG1 3.45Å; T212-I216 PolarHBondContact O-N 3.16Å; I213-I216 PolarHBondContact O-N 3.41Å; I216-G218 PolarHBondContact O-N 3.15Å; I216-I219 PolarHBondContact O-N 2.94Å; I216-L220 HydrophobicContact CG2-CD1 4.23Å; I216-L220 WeakPolarHBondContact O-CG 3.48Å; I216-L220 PolarHBondContact O-N 3.18Å
217	L	98.6	Very high	96.1	Very high	104 Å²	104	71.7 Å²	71.7	55%	0.545	36%	0.36	S	S	.	.	H	α-helix	trans	-60.2	-45.6	175.3	177.5	61.9	0	0	0	111.9	I213 K214 D215 I219 L220 I221	I213-L217 PolarHBondContact O-N 3.22Å; K214-L217 PolarHBondContact O-N 2.95Å; D215-L217 VanDerWaalsContact C-N 3.28Å; D215-L217 PolarHBondContact O-N 2.95Å; L217-I219 VanDerWaalsContact C-N 3.31Å; L217-I219 PolarHBondContact O-N 3.33Å; L217-L220 PolarHBondContact O-N 3.14Å; L217-I221 HydrophobicContact CD1-CD1 4.16Å; L217-I221 HydrophobicContact CD1-CG1 4.44Å; L217-I221 HydrophobicContact CG-CD1 4.08Å; L217-I221 WeakPolarHBondContact O-CG1 3.48Å; L217-I221 PolarHBondContact O-N 3.29Å
218	G	98.4	Very high	96	Very high	12 Å²	12	73.8 Å²	73.8	12%	0.124	37%	0.372	C	S	.	.	H	α-helix	trans	-58.9	-42	176.2	0	0	0	0	0	112.6	K214 D215 I216 I221 M222	K214-G218 PolarHBondContact O-N 3.29Å; D215-G218 PolarHBondContact O-N 3.46Å; D215-G218 VanDerWaalsContact O-N 3.12Å; I216-G218 PolarHBondContact O-N 3.15Å; G218-I221 PolarHBondContact O-N 3.06Å; G218-M222 WeakPolarHBondContact O-CB 3.27Å; G218-M222 PolarHBondContact O-N 3.4Å
219	I	98.4	Very high	95.8	Very high	41 Å²	41	72.6 Å²	72.6	21%	0.21	37%	0.368	C	S	.	.	H	α-helix	trans	-63.4	-44.3	177.8	-69.8	166.3	0	0	0	110.8	L23 V26 D215 I216 L217 I221 M222 F223	L23-I219 HydrophobicContact CD2-CB 4.46Å; L23-I219 HydrophobicContact CD2-CG1 3.83Å; V26-I219 HydrophobicContact CG2-CD1 3.79Å; V26-I219 HydrophobicContact CG2-CG1 3.99Å; D215-I219 VanDerWaalsContact O-CG1 3.25Å; D215-I219 WeakPolarHBondContact O-CG1 3.2Å; D215-I219 PolarHBondContact O-N 3.23Å; I216-I219 PolarHBondContact O-N 2.94Å; L217-I219 VanDerWaalsContact C-N 3.31Å; L217-I219 PolarHBondContact O-N 3.33Å; I219-I221 VanDerWaalsContact C-N 3.35Å; I219-I221 PolarHBondContact O-N 3.41Å; I219-M222 PolarHBondContact O-N 2.98Å; I219-F223 HydrophobicContact CG2-CD2 3.57Å; 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 3.42Å; I219-F223 PolarHBondContact O-N 3.17Å
220	L	98.3	Very high	95.7	Very high	113 Å²	113	72.9 Å²	72.9	59%	0.592	36%	0.364	S	S	*	.	H	α-helix	trans	-60.9	-43.3	177	-70.1	171.8	0	0	0	111.9	I216 L217 F223 L224	I216-L220 HydrophobicContact CG2-CD1 4.23Å; I216-L220 WeakPolarHBondContact O-CG 3.48Å; I216-L220 PolarHBondContact O-N 3.18Å; L217-L220 PolarHBondContact O-N 3.14Å; L220-F223 PolarHBondContact O-N 3.06Å; L220-L224 PolarHBondContact O-N 3.23Å
221	I	98.1	Very high	95.6	Very high	87 Å²	87	69.5 Å²	69.5	45%	0.446	36%	0.355	S	S	.	.	H	α-helix	trans	-64.1	-43.5	176.2	-65.6	166.5	0	0	0	110.7	L217 G218 I219 F223 L224 I225	L217-I221 HydrophobicContact CD1-CD1 4.16Å; L217-I221 HydrophobicContact CD1-CG1 4.44Å; L217-I221 HydrophobicContact CG-CD1 4.08Å; L217-I221 WeakPolarHBondContact O-CG1 3.48Å; L217-I221 PolarHBondContact O-N 3.29Å; G218-I221 PolarHBondContact O-N 3.06Å; I219-I221 VanDerWaalsContact C-N 3.35Å; I219-I221 PolarHBondContact O-N 3.41Å; I221-F223 PolarHBondContact O-N 2.99Å; I221-L224 WeakPolarHBondContact O-CB 3.45Å; I221-L224 PolarHBondContact O-N 3.4Å; I221-I225 HydrophobicContact CG2-CD1 4Å; I221-I225 WeakPolarHBondContact O-CG1 3.43Å; I221-I225 PolarHBondContact O-N 3.29Å; I221-I225 VanDerWaalsContact O-N 3.16Å
222	M	97.7	Very high	95.4	Very high	8 Å²	8	73.1 Å²	73.1	4%	0.039	38%	0.375	C	S	.	.	H	α-helix	trans	-60.2	-45.3	177.4	-175.3	-167.4	70.3	0	0	111.5	L23 V26 C27 M76 G218 I219 L224 I225 L226	L23-M222 HydrophobicContact CB-SD 4.05Å; L23-M222 HydrophobicContact CD2-CB 4.06Å; L23-M222 HydrophobicContact CD2-SD 3.96Å; L23-M222 HydrophobicContact CG-SD 4.45Å; V26-M222 HydrophobicContact CB-CE 4.14Å; V26-M222 HydrophobicContact CG1-CE 3.63Å; C27-M222 VanDerWaalsContact SG-SD 3.68Å; M76-M222 HydrophobicContact CE-CG 4.02Å; M76-M222 HydrophobicContact CG-CG 3.8Å; M76-M222 HydrophobicContact CG-SD 4.09Å; M76-M222 HydrophobicContact SD-CG 3.86Å; G218-M222 WeakPolarHBondContact O-CB 3.27Å; G218-M222 PolarHBondContact O-N 3.4Å; I219-M222 PolarHBondContact O-N 2.98Å; M222-L224 VanDerWaalsContact C-N 3.32Å; M222-L224 PolarHBondContact O-N 2.97Å; M222-I225 PolarHBondContact O-N 3.38Å; M222-L226 WeakPolarHBondContact O-CB 3.16Å; M222-L226 PolarHBondContact O-N 3.11Å
223	F	96.1	Very high	95.2	Very high	77 Å²	77	77 Å²	77	34%	0.338	39%	0.393	S	S	.	.	H	α-helix	trans	-65.5	-34.6	177.3	-82.3	-63.7	0	0	0	112.7	V26 V30 I219 L220 I221 I225 L226 M227	V26-F223 HydrophobicContact CG1-CE2 4.04Å; V26-F223 HydrophobicContact CG1-CZ 3.97Å; V30-F223 HydrophobicContact CG2-CE1 4.06Å; V30-F223 HydrophobicContact CG2-CZ 3.95Å; I219-F223 HydrophobicContact CG2-CD2 3.57Å; 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 3.42Å; I219-F223 PolarHBondContact O-N 3.17Å; L220-F223 PolarHBondContact O-N 3.06Å; I221-F223 PolarHBondContact O-N 2.99Å; F223-I225 VanDerWaalsContact C-N 3.27Å; F223-I225 PolarHBondContact O-N 3.47Å; F223-L226 HydrophobicContact CD1-CD2 4.07Å; F223-L226 HydrophobicContact CE1-CD2 4.19Å; F223-L226 PolarHBondContact O-N 3.16Å; F223-M227 VanDerWaalsContact O-CG 3.28Å; F223-M227 WeakPolarHBondContact O-CG 3.38Å; F223-M227 PolarHBondContact O-N 2.83Å
224	L	95.7	Very high	95	Very high	136 Å²	136	74.6 Å²	74.6	71%	0.712	38%	0.381	S	S	*	.	H	α-helix	trans	-62.4	-33.9	173.9	-178.6	65.5	0	0	0	112.5	L220 I221 M222	L220-L224 PolarHBondContact O-N 3.23Å; I221-L224 WeakPolarHBondContact O-CB 3.45Å; I221-L224 PolarHBondContact O-N 3.4Å; M222-L224 VanDerWaalsContact C-N 3.32Å; M222-L224 PolarHBondContact O-N 2.97Å
225	I	94.1	Very high	94.7	Very high	114 Å²	114	76.8 Å²	76.8	59%	0.585	40%	0.395	S	S	*	.	H	α-helix	trans	-82.7	-28.1	178.1	-60.5	164.8	0	0	0	111.5	M76 I221 M222 F223	M76-I225 HydrophobicContact CE-CB 3.76Å; M76-I225 HydrophobicContact CE-CG2 3.6Å; I221-I225 HydrophobicContact CG2-CD1 4Å; I221-I225 WeakPolarHBondContact O-CG1 3.43Å; I221-I225 PolarHBondContact O-N 3.29Å; I221-I225 VanDerWaalsContact O-N 3.16Å; M222-I225 PolarHBondContact O-N 3.38Å; F223-I225 VanDerWaalsContact C-N 3.27Å; F223-I225 PolarHBondContact O-N 3.47Å
226	L	87.6	Confident	94.4	Very high	20 Å²	20	81.3 Å²	81.3	11%	0.105	42%	0.417	C	S	.	.	H	α-helix	trans	-73.8	-29.4	-179.2	-177.2	63.9	0	0	0	113.1	N72 M76 M222 F223	N72-L226 HydrophobicContact CB-CD1 4.05Å; M76-L226 HydrophobicContact CB-CD1 4.12Å; M76-L226 HydrophobicContact CE-CB 4.4Å; M222-L226 WeakPolarHBondContact O-CB 3.16Å; M222-L226 PolarHBondContact O-N 3.11Å; F223-L226 HydrophobicContact CD1-CD2 4.07Å; F223-L226 HydrophobicContact CE1-CD2 4.19Å; F223-L226 PolarHBondContact O-N 3.16Å
227	M	71.1	Confident	94	Very high	171 Å²	171	80.3 Å²	80.3	84%	0.842	41%	0.412	S	S	*	.			trans	-86.2	0	178	-59.2	-125.1	92.7	0	0	111.6	L65 M69 F223	L65-M227 HydrophobicContact CD1-CE 3.95Å; M69-M227 HydrophobicContact SD-CE 4.32Å; F223-M227 VanDerWaalsContact O-CG 3.28Å; F223-M227 WeakPolarHBondContact O-CG 3.38Å; F223-M227 PolarHBondContact O-N 2.83Å

Retrieved 227 of 227 residues in 215.2 ms (Link to these results)

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