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Dol-P-Glc:Glc(2)Man(9)GlcNAc(2)-PP-Dol alpha-1,2-glucosyltransferase AlphaSync

Dol-P-Glc:Glc(2)Man(9)GlcNAc(2)-PP-Dol alpha-1,2-glucosyltransferase that operates in the biosynthetic pathway of dolichol-linked oligosaccharides, the glycan precursors employed in protein asparagine (N)-glycosylation. The assembly of dolichol-linked oligosaccharides begins on the cytosolic side of the endoplasmic reticulum membrane and finishes in its lumen. The sequential addition of sugars to dolichol pyrophosphate produces dolichol-linked oligosaccharides containing fourteen sugars, including two GlcNAcs, nine mannoses and three glucoses. Once assembled, the oligosaccharide is transferred from the lipid to nascent proteins by oligosaccharyltransferases. In the lumen of the endoplasmic reticulum, adds the third and last glucose residue from dolichyl phosphate glucose (Dol-P-Glc) onto the lipid-linked oligosaccharide intermediate Glc(2)Man(9)GlcNAc(2)-PP-Dol to produce Glc(3)Man(9)GlcNAc(2)-PP-Dol.

AlphaFold DB , UniProt , Accession A0AA82N8E5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 473 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	65.3	Low	89.1	Confident	185 Å²	185	95.1 Å²	95.1	91%	0.911	46%	0.455	S	S	*	.				0	144.5	0	-74.3	177.5	178.8	0	0	108.8	Y5 I6	M1-Y5 HydrophobicContact CB-CD1 4.16Å; M1-Y5 HydrophobicContact CE-CE1 3.93Å; M1-Y5 HydrophobicContact CG-CD1 4.05Å; M1-Y5 HydrophobicContact CG-CE1 4.25Å; M1-Y5 HydrophobicContact SD-CD1 3.71Å; M1-Y5 HydrophobicContact SD-CE1 3.6Å; M1-I6 HydrophobicContact CB-CD1 4.4Å; M1-I6 HydrophobicContact CB-CG1 4.19Å
2	S	85.8	Confident	89.8	Confident	76 Å²	76	88.1 Å²	88.1	53%	0.531	42%	0.422	S	S	.	.			trans	-69.9	146.4	175.7	72.4	0	0	0	0	110.6	N4 Y5 I6	S2-N4 PolarHBondContact O-N 3.2Å; S2-Y5 WeakPolarHBondContact O-CB 3.46Å; S2-Y5 PolarHBondContact O-N 3.44Å; S2-Y5 PolarHBondContact OG-N 3.32Å; S2-I6 PolarHBondContact O-N 2.89Å
3	Y	87.1	Confident	90.3	Very high	183 Å²	183	88.1 Å²	88.1	72%	0.718	43%	0.431	S	S	*	.	H	α-helix	trans	-50	-43.3	175.9	174.2	-99.4	0	0	0	112.2	Y5 I6 V7	Y3-Y5 VanDerWaalsContact C-N 3.27Å; Y3-Y5 PolarHBondContact O-N 3.4Å; Y3-I6 PolarHBondContact O-N 2.96Å; Y3-V7 HydrophobicContact CD1-CG2 4.21Å; Y3-V7 HydrophobicContact CE1-CG2 3.79Å; Y3-V7 HydrophobicContact CE2-CG2 4.13Å; Y3-V7 WeakPolarHBondContact O-CG2 3.27Å; Y3-V7 PolarHBondContact O-N 3.15Å
4	N	86.7	Confident	90.7	Very high	99 Å²	99	88.3 Å²	88.3	53%	0.529	43%	0.429	S	S	.	.	H	α-helix	trans	-61	-33.2	178	-75.6	-32.9	0	0	0	113.7	S2 S8 N119	S2-N4 PolarHBondContact O-N 3.2Å; N4-S8 PolarHBondContact O-N 3.07Å; N4-S8 PolarHBondContact O-OG 2.82Å; N4-N119 PolarHBondContact O-ND2 3.48Å
5	Y	89.1	Confident	91	Very high	93 Å²	93	82.5 Å²	82.5	37%	0.365	40%	0.401	S	S	.	.	H	α-helix	trans	-70.5	-41.5	177.2	-178.6	-91.1	0	0	0	111.4	M1 S2 Y3 S8 W9	M1-Y5 HydrophobicContact CB-CD1 4.16Å; M1-Y5 HydrophobicContact CE-CE1 3.93Å; M1-Y5 HydrophobicContact CG-CD1 4.05Å; M1-Y5 HydrophobicContact CG-CE1 4.25Å; M1-Y5 HydrophobicContact SD-CD1 3.71Å; M1-Y5 HydrophobicContact SD-CE1 3.6Å; S2-Y5 WeakPolarHBondContact O-CB 3.46Å; S2-Y5 PolarHBondContact O-N 3.44Å; S2-Y5 PolarHBondContact OG-N 3.32Å; Y3-Y5 VanDerWaalsContact C-N 3.27Å; Y3-Y5 PolarHBondContact O-N 3.4Å; Y5-S8 WeakPolarHBondContact O-CB 3.44Å; Y5-S8 PolarHBondContact O-N 3.12Å; Y5-W9 AromaticContact CD1-CD1 3.73Å; Y5-W9 AromaticContact CE1-CD1 3.35Å; Y5-W9 AromaticContact CE1-NE1 3.34Å; Y5-W9 VanDerWaalsContact CE1-NE1 3.34Å; Y5-W9 AromaticContact CE2-NE1 3.45Å; Y5-W9 AromaticContact CZ-CD1 3.54Å; Y5-W9 AromaticContact CZ-NE1 2.99Å; Y5-W9 PolarHBondContact O-N 2.99Å; Y5-W9 PolarHBondContact OH-NE1 3.41Å
6	I	92.4	Very high	91.4	Very high	81 Å²	81	78.4 Å²	78.4	42%	0.415	39%	0.385	S	S	.	.	H	α-helix	trans	-62.3	-48.9	176.4	-61.7	172.5	0	0	0	109.8	M1 S2 Y3 S8 W9 M10	M1-I6 HydrophobicContact CB-CD1 4.4Å; M1-I6 HydrophobicContact CB-CG1 4.19Å; S2-I6 PolarHBondContact O-N 2.89Å; Y3-I6 PolarHBondContact O-N 2.96Å; I6-S8 VanDerWaalsContact C-N 3.31Å; I6-S8 PolarHBondContact O-N 3.02Å; I6-W9 PolarHBondContact O-N 3.48Å; I6-W9 VanDerWaalsContact O-N 3.16Å; I6-M10 HydrophobicContact CG2-CG 4.29Å; I6-M10 HydrophobicContact CG2-SD 3.95Å; I6-M10 WeakPolarHBondContact O-CG 3.41Å; I6-M10 PolarHBondContact O-N 3.22Å
7	V	93.3	Very high	91.8	Very high	31 Å²	31	76.8 Å²	76.8	19%	0.188	39%	0.387	C	S	.	.	H	α-helix	trans	-59.5	-40.9	177.7	175	0	0	0	0	111.9	Y3 W9 M10 L11 N119	Y3-V7 HydrophobicContact CD1-CG2 4.21Å; Y3-V7 HydrophobicContact CE1-CG2 3.79Å; Y3-V7 HydrophobicContact CE2-CG2 4.13Å; Y3-V7 WeakPolarHBondContact O-CG2 3.27Å; Y3-V7 PolarHBondContact O-N 3.15Å; V7-W9 VanDerWaalsContact C-N 3.34Å; V7-W9 PolarHBondContact O-N 3.37Å; V7-M10 PolarHBondContact O-N 2.98Å; V7-L11 HydrophobicContact CG1-CD1 4.13Å; V7-L11 HydrophobicContact CG1-CG 4.47Å; V7-L11 WeakPolarHBondContact O-CG 3.38Å; V7-L11 PolarHBondContact O-N 3.38Å; V7-L11 VanDerWaalsContact O-N 3.09Å; V7-N119 HydrophobicContact CG1-CB 4.26Å
8	S	95	Very high	92	Very high	5 Å²	5	74.6 Å²	74.6	4%	0.035	38%	0.378	C	S	.	.	H	α-helix	trans	-55	-49.6	175.1	-67.6	0	0	0	0	111.8	N4 Y5 I6 L11 I12 K111 N119	N4-S8 PolarHBondContact O-N 3.07Å; N4-S8 PolarHBondContact O-OG 2.82Å; Y5-S8 WeakPolarHBondContact O-CB 3.44Å; Y5-S8 PolarHBondContact O-N 3.12Å; I6-S8 VanDerWaalsContact C-N 3.31Å; I6-S8 PolarHBondContact O-N 3.02Å; S8-L11 PolarHBondContact O-N 3.26Å; S8-I12 WeakPolarHBondContact O-CG1 3.3Å; S8-I12 PolarHBondContact O-N 2.81Å; S8-I12 VanDerWaalsContact O-N 3.12Å; S8-K111 PolarHBondContact OG-NZ 3.09Å; S8-N119 PolarHBondContact OG-OD1 3.33Å
9	W	94.1	Very high	92.3	Very high	125 Å²	125	70.7 Å²	70.7	47%	0.473	36%	0.358	S	S	.	.	H	α-helix	trans	-70.1	-39.3	-179.2	-78.2	112	0	0	0	112.6	Y5 I6 V7 L11 I12 T13	Y5-W9 AromaticContact CD1-CD1 3.73Å; Y5-W9 AromaticContact CE1-CD1 3.35Å; Y5-W9 AromaticContact CE1-NE1 3.34Å; Y5-W9 VanDerWaalsContact CE1-NE1 3.34Å; Y5-W9 AromaticContact CE2-NE1 3.45Å; Y5-W9 AromaticContact CZ-CD1 3.54Å; Y5-W9 AromaticContact CZ-NE1 2.99Å; Y5-W9 PolarHBondContact O-N 2.99Å; Y5-W9 PolarHBondContact OH-NE1 3.41Å; I6-W9 PolarHBondContact O-N 3.48Å; I6-W9 VanDerWaalsContact O-N 3.16Å; V7-W9 VanDerWaalsContact C-N 3.34Å; V7-W9 PolarHBondContact O-N 3.37Å; W9-L11 VanDerWaalsContact C-N 3.28Å; W9-L11 PolarHBondContact O-N 3.04Å; W9-I12 HydrophobicContact CE3-CD1 4.4Å; W9-I12 HydrophobicContact CE3-CG2 4.46Å; W9-I12 PolarHBondContact O-N 3.19Å; W9-T13 WeakPolarHBondContact O-CB 3.42Å; W9-T13 PolarHBondContact O-N 3.23Å; W9-T13 PolarHBondContact O-OG1 2.94Å
10	M	95.6	Very high	92.6	Very high	127 Å²	127	69.5 Å²	69.5	63%	0.626	36%	0.356	S	S	*	.	H	α-helix	trans	-56.2	-42.9	174.9	-71	178	74.8	0	0	112.1	I6 V7 T13 F14	I6-M10 HydrophobicContact CG2-CG 4.29Å; I6-M10 HydrophobicContact CG2-SD 3.95Å; I6-M10 WeakPolarHBondContact O-CG 3.41Å; I6-M10 PolarHBondContact O-N 3.22Å; V7-M10 PolarHBondContact O-N 2.98Å; M10-T13 PolarHBondContact O-N 3.1Å; M10-F14 WeakPolarHBondContact O-CB 3.34Å; M10-F14 PolarHBondContact O-N 3.23Å
11	L	96.2	Very high	92.8	Very high	41 Å²	41	70.6 Å²	70.6	22%	0.215	37%	0.366	C	S	.	.	H	α-helix	trans	-71.6	-37.5	178.8	-67.1	175.4	0	0	0	112.8	V7 S8 W9 F14 T15 H103 N119 I123	V7-L11 HydrophobicContact CG1-CD1 4.13Å; V7-L11 HydrophobicContact CG1-CG 4.47Å; V7-L11 WeakPolarHBondContact O-CG 3.38Å; V7-L11 PolarHBondContact O-N 3.38Å; V7-L11 VanDerWaalsContact O-N 3.09Å; S8-L11 PolarHBondContact O-N 3.26Å; W9-L11 VanDerWaalsContact C-N 3.28Å; W9-L11 PolarHBondContact O-N 3.04Å; L11-F14 WeakPolarHBondContact O-CB 3.45Å; L11-F14 PolarHBondContact O-N 3.5Å; L11-T15 PolarHBondContact O-N 3.4Å; L11-T15 PolarHBondContact O-OG1 3.15Å; L11-H103 PolarHBondContact O-CE1 2.98Å; L11-N119 HydrophobicContact CD1-CB 3.86Å; L11-N119 WeakPolarHBondContact CD1-O 3.32Å; L11-I123 HydrophobicContact CD1-CB 4.42Å; L11-I123 HydrophobicContact CD1-CG2 4.12Å; L11-I123 HydrophobicContact CD2-CG2 4.45Å
12	I	96.5	Very high	94.4	Very high	11 Å²	11	62.6 Å²	62.6	6%	0.056	33%	0.327	C	S	.	.	H	α-helix	trans	-64.3	-44	173.9	-68.2	167.3	0	0	0	110.1	S8 W9 F14 T15 A16 I100 A104 L107	S8-I12 WeakPolarHBondContact O-CG1 3.3Å; S8-I12 PolarHBondContact O-N 2.81Å; S8-I12 VanDerWaalsContact O-N 3.12Å; W9-I12 HydrophobicContact CE3-CD1 4.4Å; W9-I12 HydrophobicContact CE3-CG2 4.46Å; W9-I12 PolarHBondContact O-N 3.19Å; I12-F14 VanDerWaalsContact C-N 3.3Å; I12-F14 PolarHBondContact O-N 2.96Å; I12-T15 PolarHBondContact O-N 3.36Å; I12-A16 WeakPolarHBondContact O-CB 3.3Å; I12-A16 PolarHBondContact O-N 3.1Å; I12-I100 HydrophobicContact CG2-CG2 3.93Å; I12-A104 HydrophobicContact CD1-CB 4.26Å; I12-L107 HydrophobicContact CD1-CD2 4.11Å
13	T	96.4	Very high	94.9	Very high	88 Å²	88	59 Å²	59	54%	0.54	30%	0.301	S	S	.	.	H	α-helix	trans	-62.5	-36.7	174.7	-58.9	0	0	0	0	111.6	W9 M10 A16 A17	W9-T13 WeakPolarHBondContact O-CB 3.42Å; W9-T13 PolarHBondContact O-N 3.23Å; W9-T13 PolarHBondContact O-OG1 2.94Å; M10-T13 PolarHBondContact O-N 3.1Å; T13-A16 WeakPolarHBondContact O-CB 3.46Å; T13-A16 PolarHBondContact O-N 3.45Å; T13-A17 WeakPolarHBondContact O-CB 3.42Å; T13-A17 PolarHBondContact O-N 2.84Å
14	F	96.2	Very high	95.4	Very high	91 Å²	91	55.3 Å²	55.3	40%	0.399	29%	0.287	S	S	.	.	H	α-helix	trans	-62.7	-48.7	173.5	175.4	-100.5	0	0	0	111.9	M10 L11 I12 A16 A17 V18 I123 L444	M10-F14 WeakPolarHBondContact O-CB 3.34Å; M10-F14 PolarHBondContact O-N 3.23Å; L11-F14 WeakPolarHBondContact O-CB 3.45Å; L11-F14 PolarHBondContact O-N 3.5Å; I12-F14 VanDerWaalsContact C-N 3.3Å; I12-F14 PolarHBondContact O-N 2.96Å; F14-A16 VanDerWaalsContact C-N 3.3Å; F14-A16 PolarHBondContact O-N 3.41Å; F14-A17 PolarHBondContact O-N 3.5Å; F14-V18 HydrophobicContact CD1-CG2 4.45Å; F14-V18 HydrophobicContact CD2-CG2 4.37Å; F14-V18 HydrophobicContact CE1-CG2 4.02Å; F14-V18 HydrophobicContact CE2-CG2 3.92Å; F14-V18 HydrophobicContact CZ-CG2 3.73Å; F14-V18 WeakPolarHBondContact O-CG2 3.44Å; F14-V18 PolarHBondContact O-N 3.4Å; F14-I123 HydrophobicContact CD1-CD1 4.15Å; F14-L444 HydrophobicContact CE1-CD1 4.38Å; F14-L444 HydrophobicContact CE1-CD2 4.47Å; F14-L444 HydrophobicContact CZ-CD1 4.22Å
15	T	95.6	Very high	95.9	Very high	2 Å²	2	52.6 Å²	52.6	1%	0.012	27%	0.274	C	S	.	.	H	α-helix	trans	-58.1	-44.5	174	-57.1	0	0	0	0	111.3	L11 I12 A17 V18 S19 H103 I123 A126	L11-T15 PolarHBondContact O-N 3.4Å; L11-T15 PolarHBondContact O-OG1 3.15Å; I12-T15 PolarHBondContact O-N 3.36Å; T15-A17 PolarHBondContact O-N 2.94Å; T15-V18 PolarHBondContact O-N 2.93Å; T15-S19 WeakPolarHBondContact O-CB 3.28Å; T15-S19 PolarHBondContact O-N 3.34Å; T15-S19 PolarHBondContact O-OG 2.84Å; T15-H103 PolarHBondContact OG1-CE1 2.74Å; T15-H103 PolarHBondContact OG1-ND1 3.43Å; T15-I123 WeakPolarHBondContact OG1-CD1 3.48Å; T15-A126 HydrophobicContact CG2-CB 4.45Å
16	A	97.1	Very high	96.3	Very high	17 Å²	17	48.2 Å²	48.2	14%	0.14	26%	0.256	C	S	.	.	H	α-helix	trans	-57.9	-47.7	176.6	0	0	0	0	0	111.5	I12 T13 F14 S19 C20 I100	I12-A16 WeakPolarHBondContact O-CB 3.3Å; I12-A16 PolarHBondContact O-N 3.1Å; T13-A16 WeakPolarHBondContact O-CB 3.46Å; T13-A16 PolarHBondContact O-N 3.45Å; F14-A16 VanDerWaalsContact C-N 3.3Å; F14-A16 PolarHBondContact O-N 3.41Å; A16-S19 PolarHBondContact O-N 3.42Å; A16-C20 VanDerWaalsContact O-CB 3.25Å; A16-C20 WeakPolarHBondContact O-CB 3.34Å; A16-C20 PolarHBondContact O-N 3Å; A16-C20 PolarHBondContact O-SG 2.9Å; A16-I100 HydrophobicContact CB-CD1 3.51Å; A16-I100 HydrophobicContact CB-CG1 3.67Å
17	A	97.5	Very high	96.6	Very high	51 Å²	51	44.4 Å²	44.4	42%	0.421	24%	0.237	S	C	.	.	H	α-helix	trans	-62.6	-46.9	179.9	0	0	0	0	0	111.7	T13 F14 T15 C20 V21	T13-A17 WeakPolarHBondContact O-CB 3.42Å; T13-A17 PolarHBondContact O-N 2.84Å; F14-A17 PolarHBondContact O-N 3.5Å; T15-A17 PolarHBondContact O-N 2.94Å; A17-C20 PolarHBondContact O-N 3.27Å; A17-V21 WeakPolarHBondContact O-CB 3.28Å; A17-V21 VanDerWaalsContact O-CG2 3.29Å; A17-V21 WeakPolarHBondContact O-CG2 3.37Å; A17-V21 PolarHBondContact O-N 3Å
18	V	96.8	Very high	96.7	Very high	37 Å²	37	50.9 Å²	50.9	22%	0.224	26%	0.258	C	S	.	.	H	α-helix	trans	-60.5	-50.2	177.4	173.5	0	0	0	0	110.7	F14 T15 C20 V21 L22 I132	F14-V18 HydrophobicContact CD1-CG2 4.45Å; F14-V18 HydrophobicContact CD2-CG2 4.37Å; F14-V18 HydrophobicContact CE1-CG2 4.02Å; F14-V18 HydrophobicContact CE2-CG2 3.92Å; F14-V18 HydrophobicContact CZ-CG2 3.73Å; F14-V18 WeakPolarHBondContact O-CG2 3.44Å; F14-V18 PolarHBondContact O-N 3.4Å; T15-V18 PolarHBondContact O-N 2.93Å; V18-C20 PolarHBondContact O-N 3.31Å; V18-V21 PolarHBondContact O-N 3.18Å; V18-L22 WeakPolarHBondContact O-CB 3.38Å; V18-L22 PolarHBondContact O-N 3.42Å; V18-I132 HydrophobicContact CG1-CD1 4.23Å; V18-I132 HydrophobicContact CG1-CG2 4.04Å
19	S	97.4	Very high	96.7	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-61.3	-44	177.6	-73.5	0	0	0	0	112.2	T15 A16 L22 T23 S135	T15-S19 WeakPolarHBondContact O-CB 3.28Å; T15-S19 PolarHBondContact O-N 3.34Å; T15-S19 PolarHBondContact O-OG 2.84Å; A16-S19 PolarHBondContact O-N 3.42Å; S19-L22 PolarHBondContact O-N 3.41Å; S19-T23 VanDerWaalsContact O-CB 3.29Å; S19-T23 WeakPolarHBondContact O-CB 2.97Å; S19-T23 PolarHBondContact O-N 2.86Å; S19-T23 PolarHBondContact O-OG1 2.96Å; S19-S135 WeakPolarHBondContact CB-OG 3.46Å; S19-S135 WeakPolarHBondContact OG-CB 3.23Å; S19-S135 PolarHBondContact OG-OG 3.37Å
20	C	97.9	Very high	96.8	Very high	46 Å²	46	51.5 Å²	51.5	31%	0.311	26%	0.262	S	S	.	.	H	α-helix	trans	-61.2	-49.4	177.7	-77.8	0	0	0	0	112.4	A16 A17 V18 L22 T23 Y24 F93	A16-C20 VanDerWaalsContact O-CB 3.25Å; A16-C20 WeakPolarHBondContact O-CB 3.34Å; A16-C20 PolarHBondContact O-N 3Å; A16-C20 PolarHBondContact O-SG 2.9Å; A17-C20 PolarHBondContact O-N 3.27Å; V18-C20 PolarHBondContact O-N 3.31Å; C20-L22 VanDerWaalsContact C-N 3.32Å; C20-L22 PolarHBondContact O-N 3.49Å; C20-T23 PolarHBondContact O-N 3.38Å; C20-Y24 WeakPolarHBondContact O-CB 3.32Å; C20-Y24 PolarHBondContact O-N 2.97Å; C20-F93 HydrophobicContact CB-CE1 4.24Å
21	V	97.7	Very high	96.7	Very high	94 Å²	94	50.9 Å²	50.9	57%	0.57	26%	0.257	S	S	*	.	H	α-helix	trans	-61.8	-46	179.3	169.9	0	0	0	0	109.8	A17 V18 Y24 V25	A17-V21 WeakPolarHBondContact O-CB 3.28Å; A17-V21 VanDerWaalsContact O-CG2 3.29Å; A17-V21 WeakPolarHBondContact O-CG2 3.37Å; A17-V21 PolarHBondContact O-N 3Å; V18-V21 PolarHBondContact O-N 3.18Å; V21-Y24 PolarHBondContact O-N 2.95Å; V21-V25 HydrophobicContact CG1-CG2 4.45Å; V21-V25 VanDerWaalsContact O-CG2 3.3Å; V21-V25 WeakPolarHBondContact O-CG2 3.36Å; V21-V25 PolarHBondContact O-N 2.84Å
22	L	97.3	Very high	96.7	Very high	17 Å²	17	54.5 Å²	54.5	9%	0.089	27%	0.272	C	S	.	.	H	α-helix	trans	-60	-52.2	179.4	-171.7	59.8	0	0	0	110.6	V18 S19 C20 Y24 V25 F26 I132 A136 V447 A451	V18-L22 WeakPolarHBondContact O-CB 3.38Å; V18-L22 PolarHBondContact O-N 3.42Å; S19-L22 PolarHBondContact O-N 3.41Å; C20-L22 VanDerWaalsContact C-N 3.32Å; C20-L22 PolarHBondContact O-N 3.49Å; L22-Y24 VanDerWaalsContact C-N 3.32Å; L22-Y24 PolarHBondContact O-N 2.73Å; L22-V25 PolarHBondContact O-N 2.92Å; L22-V25 VanDerWaalsContact O-N 3.14Å; L22-F26 HydrophobicContact CD1-CD2 3.62Å; L22-F26 HydrophobicContact CD1-CE2 3.27Å; L22-F26 HydrophobicContact CD1-CZ 4.35Å; L22-F26 HydrophobicContact CD2-CD2 4.47Å; L22-F26 HydrophobicContact CD2-CE2 3.9Å; L22-F26 HydrophobicContact CG-CD2 3.54Å; L22-F26 HydrophobicContact CG-CE2 3.36Å; L22-F26 WeakPolarHBondContact O-CB 3.39Å; L22-F26 VanDerWaalsContact O-CD2 3.22Å; L22-F26 WeakPolarHBondContact O-CD2 3.29Å; L22-F26 PolarHBondContact O-N 3.19Å; L22-I132 HydrophobicContact CD2-CG2 3.41Å; L22-I132 VanDerWaalsContact CD2-CG2 3.41Å; L22-A136 HydrophobicContact CD2-CB 4.5Å; L22-A136 HydrophobicContact CG-CB 4.14Å; L22-V447 HydrophobicContact CD2-CG1 4.42Å; L22-A451 HydrophobicContact CD1-CB 3.76Å
23	T	97.8	Very high	96.7	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-56.7	-41.9	176.8	-61.5	0	0	0	0	113.1	S19 C20 S27 R92 F93 V96 S135 A136	S19-T23 VanDerWaalsContact O-CB 3.29Å; S19-T23 WeakPolarHBondContact O-CB 2.97Å; S19-T23 PolarHBondContact O-N 2.86Å; S19-T23 PolarHBondContact O-OG1 2.96Å; C20-T23 PolarHBondContact O-N 3.38Å; T23-S27 VanDerWaalsContact O-CB 3.23Å; T23-S27 WeakPolarHBondContact O-CB 3.35Å; T23-S27 PolarHBondContact O-N 3.24Å; T23-S27 PolarHBondContact O-OG 3.43Å; T23-R92 HydrophobicContact CG2-CB 3.63Å; T23-F93 HydrophobicContact CG2-CD1 4.45Å; T23-F93 HydrophobicContact CG2-CD2 4.24Å; T23-F93 HydrophobicContact CG2-CE1 4.46Å; T23-F93 HydrophobicContact CG2-CE2 4.24Å; T23-F93 HydrophobicContact CG2-CG 4.34Å; T23-F93 HydrophobicContact CG2-CZ 4.35Å; T23-V96 HydrophobicContact CG2-CG2 4.01Å; T23-V96 WeakPolarHBondContact OG1-CG2 3.49Å; T23-S135 PolarHBondContact OG1-O 3.26Å; T23-A136 VanDerWaalsContact OG1-CA 3.22Å; T23-A136 WeakPolarHBondContact OG1-CA 3.29Å
24	Y	97.7	Very high	96.6	Very high	106 Å²	106	51.2 Å²	51.2	42%	0.416	25%	0.252	S	S	.	.	H	α-helix	trans	-61.2	-49.5	175.7	177.3	-98	0	0	0	111	C20 V21 L22 S27 R28	C20-Y24 WeakPolarHBondContact O-CB 3.32Å; C20-Y24 PolarHBondContact O-N 2.97Å; V21-Y24 PolarHBondContact O-N 2.95Å; L22-Y24 VanDerWaalsContact C-N 3.32Å; L22-Y24 PolarHBondContact O-N 2.73Å; Y24-S27 PolarHBondContact O-N 3.47Å; Y24-R28 HydrophobicContact CD1-CG 4.31Å; Y24-R28 HydrophobicContact CE1-CG 3.91Å; Y24-R28 HydrophobicContact CE2-CG 4.45Å; Y24-R28 WeakPolarHBondContact O-CG 3.39Å; Y24-R28 PolarHBondContact O-N 3.4Å; Y24-R28 PolarHBondContact OH-NE 3.37Å; Y24-R28 PolarHBondContact OH-NH2 3.34Å; Y24-R28 VanDerWaalsContact OH-NH2 3.12Å
25	V	97.4	Very high	96.5	Very high	41 Å²	41	47.9 Å²	47.9	25%	0.248	24%	0.238	C	C	.	.	H	α-helix	trans	-64.8	-47.1	-179.7	177.7	0	0	0	0	111	V21 L22 S27 R28 Y29 I455	V21-V25 HydrophobicContact CG1-CG2 4.45Å; V21-V25 VanDerWaalsContact O-CG2 3.3Å; V21-V25 WeakPolarHBondContact O-CG2 3.36Å; V21-V25 PolarHBondContact O-N 2.84Å; L22-V25 PolarHBondContact O-N 2.92Å; L22-V25 VanDerWaalsContact O-N 3.14Å; V25-S27 VanDerWaalsContact C-N 3.27Å; V25-S27 PolarHBondContact O-N 2.92Å; V25-R28 WeakPolarHBondContact O-CB 3.48Å; V25-R28 PolarHBondContact O-N 3.45Å; V25-Y29 HydrophobicContact CG1-CD2 3.82Å; V25-Y29 HydrophobicContact CG1-CE2 3.93Å; V25-Y29 WeakPolarHBondContact O-CD2 3.49Å; V25-Y29 PolarHBondContact O-N 3.36Å; V25-Y29 VanDerWaalsContact O-N 3.09Å; V25-I455 HydrophobicContact CB-CD1 4.44Å; V25-I455 HydrophobicContact CG1-CD1 3.53Å; V25-I455 HydrophobicContact CG1-CG1 4.22Å; V25-I455 HydrophobicContact CG1-CG2 4.27Å
26	F	97.2	Very high	96.4	Very high	1 Å²	1	50.6 Å²	50.6	0%	0.004	25%	0.253	C	S	.	.	H	α-helix	trans	-53.5	-45.5	173.3	-88.5	-78.5	0	0	0	111.7	L22 R28 Y29 Q30 F133 A136 F454	L22-F26 HydrophobicContact CD1-CD2 3.62Å; L22-F26 HydrophobicContact CD1-CE2 3.27Å; L22-F26 HydrophobicContact CD1-CZ 4.35Å; L22-F26 HydrophobicContact CD2-CD2 4.47Å; L22-F26 HydrophobicContact CD2-CE2 3.9Å; L22-F26 HydrophobicContact CG-CD2 3.54Å; L22-F26 HydrophobicContact CG-CE2 3.36Å; L22-F26 WeakPolarHBondContact O-CB 3.39Å; L22-F26 VanDerWaalsContact O-CD2 3.22Å; L22-F26 WeakPolarHBondContact O-CD2 3.29Å; L22-F26 PolarHBondContact O-N 3.19Å; F26-R28 VanDerWaalsContact C-N 3.28Å; F26-R28 PolarHBondContact O-N 2.86Å; F26-Y29 PolarHBondContact O-N 3.16Å; F26-Q30 CarbonylContact O-C 3.53Å; F26-Q30 WeakPolarHBondContact O-CA 3.33Å; F26-Q30 WeakPolarHBondContact O-CB 3.47Å; F26-Q30 PolarHBondContact O-N 3.03Å; F26-F133 HydrophobicContact CE1-CE2 4.2Å; F26-F133 HydrophobicContact CE1-CZ 4.06Å; F26-F133 AromaticContact CZ-CD2 3.94Å; F26-F133 HydrophobicContact CZ-CD2 3.94Å; F26-F133 HydrophobicContact CZ-CE1 4.43Å; F26-F133 AromaticContact CZ-CE2 3.6Å; F26-F133 HydrophobicContact CZ-CE2 3.6Å; F26-F133 HydrophobicContact CZ-CG 4.5Å; F26-F133 AromaticContact CZ-CZ 3.87Å; F26-F133 HydrophobicContact CZ-CZ 3.87Å; F26-A136 HydrophobicContact CB-CB 4.15Å; F26-A136 HydrophobicContact CD2-CB 3.2Å; F26-A136 HydrophobicContact CE2-CB 3.67Å; F26-A136 HydrophobicContact CG-CB 3.86Å; F26-F454 AromaticContact CD1-CD1 3.29Å; F26-F454 HydrophobicContact CD1-CD1 3.29Å; F26-F454 AromaticContact CD1-CE1 3.16Å; F26-F454 HydrophobicContact CD1-CE1 3.16Å; F26-F454 HydrophobicContact CD1-CE2 4.48Å; F26-F454 HydrophobicContact CD1-CG 4.04Å; F26-F454 AromaticContact CD1-CZ 3.81Å; F26-F454 HydrophobicContact CD1-CZ 3.81Å; F26-F454 HydrophobicContact CE1-CB 3.85Å; F26-F454 AromaticContact CE1-CD1 3.02Å; F26-F454 HydrophobicContact CE1-CD1 3.02Å; F26-F454 AromaticContact CE1-CD2 3.79Å; F26-F454 HydrophobicContact CE1-CD2 3.79Å; F26-F454 AromaticContact CE1-CE1 3.32Å; F26-F454 HydrophobicContact CE1-CE1 3.32Å; F26-F454 HydrophobicContact CE1-CE2 4.03Å; F26-F454 AromaticContact CE1-CG 3.28Å; F26-F454 HydrophobicContact CE1-CG 3.28Å; F26-F454 AromaticContact CE1-CZ 3.81Å; F26-F454 HydrophobicContact CE1-CZ 3.81Å; F26-F454 HydrophobicContact CG-CE1 4.46Å; F26-F454 HydrophobicContact CZ-CB 4.3Å; F26-F454 HydrophobicContact CZ-CD1 4.16Å; F26-F454 HydrophobicContact CZ-CG 4.17Å
27	S	96.9	Very high	96.4	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.007	25%	0.246	C	C	.	.	H	α-helix	trans	-71.9	-18.6	180	-55.9	0	0	0	0	114.4	T23 Y24 V25 R92	T23-S27 VanDerWaalsContact O-CB 3.23Å; T23-S27 WeakPolarHBondContact O-CB 3.35Å; T23-S27 PolarHBondContact O-N 3.24Å; T23-S27 PolarHBondContact O-OG 3.43Å; Y24-S27 PolarHBondContact O-N 3.47Å; V25-S27 VanDerWaalsContact C-N 3.27Å; V25-S27 PolarHBondContact O-N 2.92Å; S27-R92 WeakPolarHBondContact OG-CD 3.29Å; S27-R92 PolarHBondContact OG-NH1 3.47Å
28	R	96.1	Very high	96.3	Very high	168 Å²	168	49.8 Å²	49.8	63%	0.634	24%	0.241	S	C	*	.	H	α-helix	trans	-78	-42.5	171.1	-75.8	-64.4	-141.9	164.2	8.1	112.4	Y24 V25 F26	Y24-R28 HydrophobicContact CD1-CG 4.31Å; Y24-R28 HydrophobicContact CE1-CG 3.91Å; Y24-R28 HydrophobicContact CE2-CG 4.45Å; Y24-R28 WeakPolarHBondContact O-CG 3.39Å; Y24-R28 PolarHBondContact O-N 3.4Å; Y24-R28 PolarHBondContact OH-NE 3.37Å; Y24-R28 PolarHBondContact OH-NH2 3.34Å; Y24-R28 VanDerWaalsContact OH-NH2 3.12Å; V25-R28 WeakPolarHBondContact O-CB 3.48Å; V25-R28 PolarHBondContact O-N 3.45Å; F26-R28 VanDerWaalsContact C-N 3.28Å; F26-R28 PolarHBondContact O-N 2.86Å
29	Y	95.3	Very high	96.3	Very high	118 Å²	118	50.6 Å²	50.6	46%	0.463	24%	0.241	S	C	.	.	H	α-helix	trans	-89.2	-26.2	-176.8	-75.6	-88	0	0	0	113.5	V25 F26 I455 F456 R470	V25-Y29 HydrophobicContact CG1-CD2 3.82Å; V25-Y29 HydrophobicContact CG1-CE2 3.93Å; V25-Y29 WeakPolarHBondContact O-CD2 3.49Å; V25-Y29 PolarHBondContact O-N 3.36Å; V25-Y29 VanDerWaalsContact O-N 3.09Å; F26-Y29 PolarHBondContact O-N 3.16Å; Y29-I455 HydrophobicContact CD1-CG2 4.02Å; Y29-I455 HydrophobicContact CD2-CG2 3.51Å; Y29-I455 HydrophobicContact CE1-CG2 4.22Å; Y29-I455 HydrophobicContact CE2-CG2 3.75Å; Y29-I455 HydrophobicContact CG-CG2 3.66Å; Y29-F456 HydrophobicContact CE1-CE1 4.24Å; Y29-F456 HydrophobicContact CE2-CE1 4.47Å; Y29-F456 AromaticContact CZ-CE1 3.85Å; Y29-R470 PolarHBondContact O-NH2 3.47Å
30	Q	95.5	Very high	96.3	Very high	25 Å²	25	51.2 Å²	51.2	12%	0.117	24%	0.244	C	C	.	.			trans	-125.7	78.9	176.5	-173.8	60.2	31.2	0	0	108.3	F26 E32 Y34 R92 F454	F26-Q30 CarbonylContact O-C 3.53Å; F26-Q30 WeakPolarHBondContact O-CA 3.33Å; F26-Q30 WeakPolarHBondContact O-CB 3.47Å; F26-Q30 PolarHBondContact O-N 3.03Å; Q30-E32 PolarHBondContact NE2-O 3.4Å; Q30-Y34 HydrophobicContact CG-CD2 4.37Å; Q30-Y34 HydrophobicContact CG-CG 4.33Å; Q30-R92 PolarHBondContact O-NH1 3.35Å; Q30-R92 PolarHBondContact O-NH2 3.45Å; Q30-F454 HydrophobicContact CB-CE1 3.96Å; Q30-F454 HydrophobicContact CB-CZ 4.25Å; Q30-F454 HydrophobicContact CG-CE1 4.4Å; Q30-F454 HydrophobicContact CG-CZ 4.19Å
31	H	94.4	Very high	96.3	Very high	113 Å²	113	49.4 Å²	49.4	52%	0.523	23%	0.232	S	C	.	.			trans	-65.5	-44	-176.2	-169.8	65.6	0	0	0	112.3
32	E	95.4	Very high	96.2	Very high	117 Å²	117	50.4 Å²	50.4	55%	0.547	23%	0.225	S	C	.	.	S	Bend	trans	-75.5	155.9	179.4	-64.4	-54	135.5	0	0	112.3	Q30 Y34 R92	Q30-E32 PolarHBondContact NE2-O 3.4Å; E32-Y34 PolarHBondContact O-N 3.24Å; E32-R92 PolarHBondContact O-NH2 2.98Å; E32-R92 VanDerWaalsContact O-NH2 3.09Å
33	P	96.4	Very high	96.2	Very high	22 Å²	22	49.7 Å²	49.7	14%	0.143	22%	0.221	C	C	.	.			trans	-57.8	138.9	172.3	-17.1	30.5	0	0	0	110.6	E37 V38 V41 V88	P33-E37 VanDerWaalsContact CA-OE2 3.32Å; P33-E37 WeakPolarHBondContact CA-OE2 3.46Å; P33-E37 HydrophobicContact CB-CB 4.11Å; P33-E37 HydrophobicContact CB-CG 4.07Å; P33-V38 HydrophobicContact CB-CB 4.31Å; P33-V38 HydrophobicContact CB-CG2 3.83Å; P33-V38 WeakPolarHBondContact O-CG2 3.08Å; P33-V41 HydrophobicContact CB-CB 4.34Å; P33-V41 HydrophobicContact CB-CG2 4.01Å; P33-V41 HydrophobicContact CG-CB 4.01Å; P33-V41 HydrophobicContact CG-CG1 3.98Å; P33-V41 HydrophobicContact CG-CG2 3.97Å; P33-V88 HydrophobicContact CG-CG1 4.35Å; P33-V88 HydrophobicContact CG-CG2 3.68Å
34	Y	95.6	Very high	96.2	Very high	8 Å²	8	49.7 Å²	49.7	3%	0.031	22%	0.221	C	C	.	.			trans	-110.2	128.1	-176.4	-167.6	-116	0	0	0	112.3	Q30 E32 D36 E37 Y139 F454 R470 M472	Q30-Y34 HydrophobicContact CG-CD2 4.37Å; Q30-Y34 HydrophobicContact CG-CG 4.33Å; E32-Y34 PolarHBondContact O-N 3.24Å; Y34-D36 PolarHBondContact O-N 3.28Å; Y34-E37 PolarHBondContact N-OE2 3.02Å; Y34-E37 WeakPolarHBondContact O-CB 3.42Å; Y34-E37 PolarHBondContact O-N 2.82Å; Y34-E37 VanDerWaalsContact O-N 3.17Å; Y34-Y139 PolarHBondContact O-OH 2.84Å; Y34-F454 AromaticContact CD1-CE2 3.77Å; Y34-F454 HydrophobicContact CD1-CE2 3.77Å; Y34-F454 HydrophobicContact CD1-CZ 4.04Å; Y34-F454 AromaticContact CE1-CE2 3.77Å; Y34-F454 HydrophobicContact CE1-CE2 3.77Å; Y34-F454 HydrophobicContact CE1-CZ 4.35Å; Y34-F454 HydrophobicContact CG-CZ 4.4Å; Y34-R470 HydrophobicContact CE1-CB 4.37Å; Y34-R470 HydrophobicContact CE2-CB 4.47Å; Y34-R470 WeakPolarHBondContact OH-CA 3.11Å; Y34-R470 PolarHBondContact OH-N 3.17Å; Y34-R470 PolarHBondContact OH-O 3.2Å; Y34-M472 HydrophobicContact CD1-SD 3.67Å; Y34-M472 HydrophobicContact CE1-CG 4.11Å; Y34-M472 HydrophobicContact CE1-SD 3.59Å; Y34-M472 VanDerWaalsContact CE1-SD 3.59Å
35	M	93.7	Very high	96.1	Very high	21 Å²	21	47.3 Å²	47.3	10%	0.103	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	-124.8	-179.4	-59.3	-176.3	172.4	0	0	113.5	E37 V38 R343 H344 M472	M35-E37 PolarHBondContact O-N 3.25Å; M35-E37 VanDerWaalsContact O-N 3.15Å; M35-V38 WeakPolarHBondContact O-CB 3.43Å; M35-V38 VanDerWaalsContact O-CG2 3.27Å; M35-V38 WeakPolarHBondContact O-CG2 3.31Å; M35-V38 PolarHBondContact O-N 2.94Å; M35-V38 VanDerWaalsContact O-N 3.09Å; M35-R343 HydrophobicContact CE-CB 3.22Å; M35-R343 HydrophobicContact CE-CG 4.04Å; M35-R343 VanDerWaalsContact CE-CZ 3.48Å; M35-R343 VanDerWaalsContact CE-NE 3.29Å; M35-H344 VanDerWaalsContact CE-CE1 3.49Å; M35-H344 WeakPolarHBondContact CE-CE1 3.48Å; M35-H344 VanDerWaalsContact SD-CE1 3.58Å; M35-M472 HydrophobicContact CE-CG 3.77Å; M35-M472 HydrophobicContact CE-SD 3.91Å; M35-M472 HydrophobicContact CG-SD 4.28Å; M35-M472 HydrophobicContact SD-CE 4.25Å; M35-M472 HydrophobicContact SD-CG 3.89Å; M35-M472 HydrophobicContact SD-SD 3.28Å
36	D	93.8	Very high	96.1	Very high	60 Å²	60	48.9 Å²	48.9	32%	0.321	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-23.5	-177.7	-65.2	-18.4	0	0	0	112.2	Y34 V38 F39 H40 Y139 R414	Y34-D36 PolarHBondContact O-N 3.28Å; D36-V38 PolarHBondContact O-N 3.31Å; D36-V38 VanDerWaalsContact O-N 3.15Å; D36-F39 HydrophobicContact CB-CD2 4.49Å; D36-F39 WeakPolarHBondContact O-CD2 3.37Å; D36-F39 PolarHBondContact O-N 3.43Å; D36-H40 PolarHBondContact O-CD2 2.83Å; D36-H40 PolarHBondContact O-N 3.33Å; D36-Y139 HydrophobicContact CB-CE1 3.84Å; D36-Y139 PolarHBondContact N-OH 3.27Å; D36-R414 IonicContact OD2-CZ 2.83Å; D36-R414 IonicContact OD2-NH1 2.84Å; D36-R414 IonicContact OD2-NH2 2.81Å; D36-R414 PolarHBondContact OD2-NH2 2.94Å
37	E	96.4	Very high	96.1	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-55.6	-31.3	175.2	-162.1	177.8	-143.8	0	0	111.8	P33 Y34 M35 F39 H40 V41 R92 Y138 Y139	P33-E37 VanDerWaalsContact CA-OE2 3.32Å; P33-E37 WeakPolarHBondContact CA-OE2 3.46Å; P33-E37 HydrophobicContact CB-CB 4.11Å; P33-E37 HydrophobicContact CB-CG 4.07Å; Y34-E37 PolarHBondContact N-OE2 3.02Å; Y34-E37 WeakPolarHBondContact O-CB 3.42Å; Y34-E37 PolarHBondContact O-N 2.82Å; Y34-E37 VanDerWaalsContact O-N 3.17Å; M35-E37 PolarHBondContact O-N 3.25Å; M35-E37 VanDerWaalsContact O-N 3.15Å; E37-F39 VanDerWaalsContact C-N 3.26Å; E37-F39 PolarHBondContact O-N 3.42Å; E37-H40 PolarHBondContact O-N 3.46Å; E37-V41 HydrophobicContact CG-CG2 3.88Å; E37-V41 WeakPolarHBondContact O-CB 3.25Å; E37-V41 VanDerWaalsContact O-CG2 3.25Å; E37-V41 WeakPolarHBondContact O-CG2 3.12Å; E37-V41 PolarHBondContact O-N 3.09Å; E37-R92 VanDerWaalsContact OE1-CG 3.27Å; E37-R92 WeakPolarHBondContact OE1-CG 3.44Å; E37-R92 IonicContact OE1-CZ 3.23Å; E37-R92 IonicContact OE1-NE 3.29Å; E37-R92 PolarHBondContact OE1-NE 2.86Å; E37-R92 IonicContact OE1-NH2 3.86Å; E37-R92 IonicContact OE2-CZ 2.88Å; E37-R92 IonicContact OE2-NE 3.6Å; E37-R92 PolarHBondContact OE2-NE 2.84Å; E37-R92 IonicContact OE2-NH2 3.81Å; E37-R92 PolarHBondContact OE2-NH2 3.45Å; E37-Y138 WeakPolarHBondContact OE1-CB 3.28Å; E37-Y138 PolarHBondContact OE1-N 2.95Å; E37-Y139 HydrophobicContact CB-CD2 4.45Å; E37-Y139 HydrophobicContact CB-CE2 3.84Å; E37-Y139 HydrophobicContact CG-CE2 4.5Å
38	V	96.5	Very high	96	Very high	50 Å²	50	51 Å²	51	30%	0.303	23%	0.229	S	C	.	.	H	α-helix	trans	-58	-38.2	177.1	177.9	0	0	0	0	111.6	P33 M35 D36 R42	P33-V38 HydrophobicContact CB-CB 4.31Å; P33-V38 HydrophobicContact CB-CG2 3.83Å; P33-V38 WeakPolarHBondContact O-CG2 3.08Å; M35-V38 WeakPolarHBondContact O-CB 3.43Å; M35-V38 VanDerWaalsContact O-CG2 3.27Å; M35-V38 WeakPolarHBondContact O-CG2 3.31Å; M35-V38 PolarHBondContact O-N 2.94Å; M35-V38 VanDerWaalsContact O-N 3.09Å; D36-V38 PolarHBondContact O-N 3.31Å; D36-V38 VanDerWaalsContact O-N 3.15Å; V38-R42 WeakPolarHBondContact O-CB 3.41Å; V38-R42 VanDerWaalsContact O-CG 3.26Å; V38-R42 WeakPolarHBondContact O-CG 3.26Å; V38-R42 PolarHBondContact O-N 2.98Å; V38-R42 PolarHBondContact O-NE 2.86Å; V38-R42 VanDerWaalsContact O-NE 3.13Å
39	F	96.3	Very high	95.9	Very high	55 Å²	55	50.1 Å²	50.1	24%	0.241	23%	0.232	C	C	.	.	H	α-helix	trans	-75.3	-43.3	178.4	-49.8	-69.2	0	0	0	110.7	D36 E37 Q43 K58 I59	D36-F39 HydrophobicContact CB-CD2 4.49Å; D36-F39 WeakPolarHBondContact O-CD2 3.37Å; D36-F39 PolarHBondContact O-N 3.43Å; E37-F39 VanDerWaalsContact C-N 3.26Å; E37-F39 PolarHBondContact O-N 3.42Å; F39-Q43 WeakPolarHBondContact O-CB 3.43Å; F39-Q43 PolarHBondContact O-N 2.9Å; F39-K58 HydrophobicContact CD1-CB 3.57Å; F39-K58 HydrophobicContact CD1-CG 4.31Å; F39-K58 HydrophobicContact CD2-CB 4.44Å; F39-K58 HydrophobicContact CE1-CB 3.53Å; F39-K58 HydrophobicContact CE1-CG 3.8Å; F39-K58 HydrophobicContact CE2-CB 4.38Å; F39-K58 HydrophobicContact CG-CB 4.09Å; F39-K58 HydrophobicContact CZ-CB 3.97Å; F39-K58 HydrophobicContact CZ-CG 4.2Å; F39-I59 HydrophobicContact CB-CD1 4.32Å; F39-I59 HydrophobicContact CB-CG1 3.76Å
40	H	97.4	Very high	95.9	Very high	13 Å²	13	46.5 Å²	46.5	6%	0.06	23%	0.231	C	C	.	.	H	α-helix	trans	-63.9	-44.2	-179.6	-61.1	-40.9	0	0	0	113	D36 E37 T44 Y66 Y138	D36-H40 PolarHBondContact O-CD2 2.83Å; D36-H40 PolarHBondContact O-N 3.33Å; E37-H40 PolarHBondContact O-N 3.46Å; H40-T44 WeakPolarHBondContact O-CB 3.47Å; H40-T44 PolarHBondContact O-N 3.45Å; H40-T44 PolarHBondContact O-OG1 3.11Å; H40-Y66 HydrophobicContact CB-CE1 3.9Å; H40-Y66 AromaticContact ND1-CE1 3.73Å; H40-Y66 AromaticContact ND1-CZ 3.69Å; H40-Y66 PolarHBondContact ND1-OH 3.24Å; H40-Y138 HydrophobicContact CB-CD1 3.91Å; H40-Y138 HydrophobicContact CB-CE1 4.08Å; H40-Y138 PolarHBondContact CD2-O 2.84Å
41	V	97.3	Very high	95.9	Very high	7 Å²	7	48.6 Å²	48.6	4%	0.042	24%	0.243	C	C	.	.	H	α-helix	trans	-64	-52	178	169.6	0	0	0	0	110.2	P33 E37 Q43 T44 L45 V88 L91 Y138	P33-V41 HydrophobicContact CB-CB 4.34Å; P33-V41 HydrophobicContact CB-CG2 4.01Å; P33-V41 HydrophobicContact CG-CB 4.01Å; P33-V41 HydrophobicContact CG-CG1 3.98Å; P33-V41 HydrophobicContact CG-CG2 3.97Å; E37-V41 HydrophobicContact CG-CG2 3.88Å; E37-V41 WeakPolarHBondContact O-CB 3.25Å; E37-V41 VanDerWaalsContact O-CG2 3.25Å; E37-V41 WeakPolarHBondContact O-CG2 3.12Å; E37-V41 PolarHBondContact O-N 3.09Å; V41-Q43 VanDerWaalsContact C-N 3.31Å; V41-Q43 PolarHBondContact O-N 3.34Å; V41-T44 PolarHBondContact O-N 2.96Å; V41-T44 VanDerWaalsContact O-N 3.15Å; V41-L45 HydrophobicContact CG1-CD1 4Å; V41-L45 HydrophobicContact CG1-CG 4.41Å; V41-L45 WeakPolarHBondContact O-CG 3.36Å; V41-L45 PolarHBondContact O-N 3.43Å; V41-V88 HydrophobicContact CG1-CG2 4.38Å; V41-V88 HydrophobicContact CG2-CG1 4.4Å; V41-L91 HydrophobicContact CB-CD1 4.13Å; V41-L91 HydrophobicContact CG1-CD1 3.74Å; V41-L91 HydrophobicContact CG2-CD1 3.82Å; V41-Y138 HydrophobicContact CG2-CD1 4.1Å
42	R	96.6	Very high	95.9	Very high	116 Å²	116	48.4 Å²	48.4	44%	0.438	24%	0.238	S	C	.	.	H	α-helix	trans	-58.8	-42.7	-179.4	-74.1	-173.6	-61.3	149.9	7.9	112.1	V38 L45 K46 D56	V38-R42 WeakPolarHBondContact O-CB 3.41Å; V38-R42 VanDerWaalsContact O-CG 3.26Å; V38-R42 WeakPolarHBondContact O-CG 3.26Å; V38-R42 PolarHBondContact O-N 2.98Å; V38-R42 PolarHBondContact O-NE 2.86Å; V38-R42 VanDerWaalsContact O-NE 3.13Å; R42-L45 PolarHBondContact O-N 3.47Å; R42-K46 WeakPolarHBondContact O-CG 3.38Å; R42-K46 PolarHBondContact O-N 2.9Å; R42-K46 VanDerWaalsContact O-N 3.15Å; R42-D56 IonicContact CZ-OD2 3.52Å; R42-D56 IonicContact NH1-OD2 3.4Å; R42-D56 IonicContact NH2-OD2 2.71Å; R42-D56 PolarHBondContact NH2-OD2 3.29Å
43	Q	97	Very high	95.8	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-66.1	-39.9	178	-170.7	62.3	50.6	0	0	112.3	F39 V41 K46 Y47 S54 W55 I59 Y66	F39-Q43 WeakPolarHBondContact O-CB 3.43Å; F39-Q43 PolarHBondContact O-N 2.9Å; V41-Q43 VanDerWaalsContact C-N 3.31Å; V41-Q43 PolarHBondContact O-N 3.34Å; Q43-K46 PolarHBondContact O-N 3.43Å; Q43-Y47 VanDerWaalsContact NE2-CZ 3.34Å; Q43-Y47 PolarHBondContact O-N 2.88Å; Q43-S54 PolarHBondContact NE2-O 3.46Å; Q43-W55 HydrophobicContact CG-CZ3 4.42Å; Q43-I59 HydrophobicContact CB-CD1 3.48Å; Q43-I59 VanDerWaalsContact CB-CD1 3.48Å; Q43-I59 HydrophobicContact CG-CD1 3.71Å; Q43-Y66 HydrophobicContact CB-CD2 4.2Å; Q43-Y66 HydrophobicContact CB-CE2 4Å; Q43-Y66 HydrophobicContact CG-CD2 3.52Å; Q43-Y66 HydrophobicContact CG-CE2 3.49Å; Q43-Y66 VanDerWaalsContact CG-CE2 3.49Å; Q43-Y66 HydrophobicContact CG-CG 4.28Å
44	T	97.3	Very high	95.7	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-62.9	-45.1	177	-55.9	0	0	0	0	111.1	H40 V41 K46 Y47 I48 Y66 Y69 V70 L91 Y138	H40-T44 WeakPolarHBondContact O-CB 3.47Å; H40-T44 PolarHBondContact O-N 3.45Å; H40-T44 PolarHBondContact O-OG1 3.11Å; V41-T44 PolarHBondContact O-N 2.96Å; V41-T44 VanDerWaalsContact O-N 3.15Å; T44-K46 PolarHBondContact O-N 2.9Å; T44-Y47 PolarHBondContact O-N 3.41Å; T44-Y47 VanDerWaalsContact O-N 3.16Å; T44-I48 HydrophobicContact CG2-CD1 4.35Å; T44-I48 WeakPolarHBondContact O-CG1 3.43Å; T44-I48 PolarHBondContact O-N 2.96Å; T44-Y66 WeakPolarHBondContact OG1-CD1 3.45Å; T44-Y69 HydrophobicContact CG2-CD1 3.51Å; T44-Y69 HydrophobicContact CG2-CE1 4.21Å; T44-Y69 HydrophobicContact CG2-CG 4.06Å; T44-V70 HydrophobicContact CG2-CG2 4.22Å; T44-L91 HydrophobicContact CG2-CD2 3.63Å; T44-Y138 WeakPolarHBondContact OG1-CE1 3.49Å; T44-Y138 PolarHBondContact OG1-OH 3Å
45	L	96.3	Very high	95.5	Very high	56 Å²	56	52 Å²	52	29%	0.293	26%	0.262	S	S	.	.	H	α-helix	trans	-61.6	-40.6	178.5	-67.1	175.8	0	0	0	112.5	V41 R42 Y47 I48 Q49 P86	V41-L45 HydrophobicContact CG1-CD1 4Å; V41-L45 HydrophobicContact CG1-CG 4.41Å; V41-L45 WeakPolarHBondContact O-CG 3.36Å; V41-L45 PolarHBondContact O-N 3.43Å; R42-L45 PolarHBondContact O-N 3.47Å; L45-Y47 VanDerWaalsContact C-N 3.3Å; L45-Y47 PolarHBondContact O-N 3.32Å; L45-I48 HydrophobicContact CD2-CD1 4.47Å; L45-I48 PolarHBondContact O-N 3.01Å; L45-Q49 WeakPolarHBondContact O-CG 3.41Å; L45-Q49 PolarHBondContact O-N 3.11Å; L45-P86 HydrophobicContact CD2-CG 4.11Å
46	K	96	Very high	95.4	Very high	74 Å²	74	52.1 Å²	52.1	32%	0.322	26%	0.263	S	S	.	.	H	α-helix	trans	-60.6	-38.9	174.7	-71.2	-172.4	-172.1	178.3	0	112.6	R42 Q43 T44 Q49 G50 N51 S54	R42-K46 WeakPolarHBondContact O-CG 3.38Å; R42-K46 PolarHBondContact O-N 2.9Å; R42-K46 VanDerWaalsContact O-N 3.15Å; Q43-K46 PolarHBondContact O-N 3.43Å; T44-K46 PolarHBondContact O-N 2.9Å; K46-Q49 PolarHBondContact O-N 2.66Å; K46-G50 PolarHBondContact O-N 2.92Å; K46-N51 HydrophobicContact CB-CB 4.48Å; K46-N51 WeakPolarHBondContact O-CA 3.34Å; K46-N51 WeakPolarHBondContact O-CB 3.4Å; K46-N51 PolarHBondContact O-N 3.42Å; K46-S54 WeakPolarHBondContact CD-OG 3.16Å
47	Y	96.9	Very high	95.2	Very high	13 Å²	13	55.1 Å²	55.1	5%	0.051	28%	0.279	C	S	.	.	H	α-helix	trans	-71.6	-33.7	177	-73.4	-1.6	0	0	0	112.9	Q43 T44 L45 Q49 G50 N51 W52 P63 Y66	Q43-Y47 VanDerWaalsContact NE2-CZ 3.34Å; Q43-Y47 PolarHBondContact O-N 2.88Å; T44-Y47 PolarHBondContact O-N 3.41Å; T44-Y47 VanDerWaalsContact O-N 3.16Å; L45-Y47 VanDerWaalsContact C-N 3.3Å; L45-Y47 PolarHBondContact O-N 3.32Å; Y47-Q49 VanDerWaalsContact C-N 3.3Å; Y47-G50 PolarHBondContact O-N 2.87Å; Y47-N51 WeakPolarHBondContact CD1-O 3.39Å; Y47-W52 HydrophobicContact CD1-CD2 4.22Å; Y47-W52 AromaticContact CD1-CE3 3.81Å; Y47-W52 HydrophobicContact CD1-CE3 3.81Å; Y47-W52 HydrophobicContact CD1-CZ3 4.3Å; Y47-W52 AromaticContact CD2-CE3 3.57Å; Y47-W52 HydrophobicContact CD2-CE3 3.57Å; Y47-W52 HydrophobicContact CD2-CH2 4.07Å; Y47-W52 AromaticContact CD2-CZ3 3.26Å; Y47-W52 HydrophobicContact CD2-CZ3 3.26Å; Y47-W52 AromaticContact CE1-CE3 4Å; Y47-W52 HydrophobicContact CE1-CE3 4Å; Y47-W52 AromaticContact CE2-CE3 3.79Å; Y47-W52 HydrophobicContact CE2-CE3 3.79Å; Y47-W52 AromaticContact CE2-CZ3 3.72Å; Y47-W52 HydrophobicContact CE2-CZ3 3.72Å; Y47-W52 HydrophobicContact CG-CD2 4.18Å; Y47-W52 AromaticContact CG-CE3 3.57Å; Y47-W52 HydrophobicContact CG-CE3 3.57Å; Y47-W52 HydrophobicContact CG-CH2 4.2Å; Y47-W52 AromaticContact CG-CZ3 3.58Å; Y47-W52 HydrophobicContact CG-CZ3 3.58Å; Y47-W52 AromaticContact CZ-CE3 3.99Å; Y47-P63 HydrophobicContact CE2-CB 3.88Å; Y47-Y66 HydrophobicContact CE2-CD2 4.13Å
48	I	95.7	Very high	94.9	Very high	34 Å²	34	59.9 Å²	59.9	17%	0.174	30%	0.3	C	S	.	.	H	α-helix	trans	-61	-42.9	170.9	-67	177.4	0	0	0	110.4	T44 L45 G50 Y69 V70 P86	T44-I48 HydrophobicContact CG2-CD1 4.35Å; T44-I48 WeakPolarHBondContact O-CG1 3.43Å; T44-I48 PolarHBondContact O-N 2.96Å; L45-I48 HydrophobicContact CD2-CD1 4.47Å; L45-I48 PolarHBondContact O-N 3.01Å; I48-G50 PolarHBondContact O-N 3.45Å; I48-G50 VanDerWaalsContact O-N 3.09Å; I48-Y69 HydrophobicContact CD1-CD1 4.32Å; I48-Y69 HydrophobicContact CD1-CE1 3.96Å; I48-V70 HydrophobicContact CG1-CG2 3.84Å; I48-P86 HydrophobicContact CD1-CG 3.35Å
49	Q	94.7	Very high	94.6	Very high	149 Å²	149	57.6 Å²	57.6	70%	0.696	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-1.3	175.1	-66.6	168.7	-3.1	0	0	113.8	L45 K46 Y47	L45-Q49 WeakPolarHBondContact O-CG 3.41Å; L45-Q49 PolarHBondContact O-N 3.11Å; K46-Q49 PolarHBondContact O-N 2.66Å; Y47-Q49 VanDerWaalsContact C-N 3.3Å
50	G	94.6	Very high	94.3	Very high	43 Å²	43	56.3 Å²	56.3	44%	0.443	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.5	3	179.7	0	0	0	0	0	114.9	K46 Y47 I48 W52	K46-G50 PolarHBondContact O-N 2.92Å; Y47-G50 PolarHBondContact O-N 2.87Å; I48-G50 PolarHBondContact O-N 3.45Å; I48-G50 VanDerWaalsContact O-N 3.09Å; G50-W52 VanDerWaalsContact C-N 3.34Å; G50-W52 PolarHBondContact O-N 3.37Å
51	N	95.5	Very high	94.1	Very high	68 Å²	68	55.9 Å²	55.9	36%	0.364	28%	0.281	S	S	.	.			trans	-84.5	73.4	178.8	-172	-9.9	0	0	0	112	K46 Y47 T53 S54	K46-N51 HydrophobicContact CB-CB 4.48Å; K46-N51 WeakPolarHBondContact O-CA 3.34Å; K46-N51 WeakPolarHBondContact O-CB 3.4Å; K46-N51 PolarHBondContact O-N 3.42Å; Y47-N51 WeakPolarHBondContact CD1-O 3.39Å; N51-T53 VanDerWaalsContact C-N 3.3Å; N51-T53 PolarHBondContact O-N 3.33Å; N51-T53 PolarHBondContact OD1-OG1 3.31Å; N51-S54 PolarHBondContact O-OG 3.12Å; N51-S54 WeakPolarHBondContact OD1-CB 3.37Å; N51-S54 PolarHBondContact OD1-N 3.01Å; N51-S54 PolarHBondContact OD1-OG 3.24Å
52	W	95	Very high	94	Very high	109 Å²	109	56.1 Å²	56.1	41%	0.413	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-15.5	180	-64.5	96.5	0	0	0	114.6	Y47 G50 V67 V70	Y47-W52 HydrophobicContact CD1-CD2 4.22Å; Y47-W52 AromaticContact CD1-CE3 3.81Å; Y47-W52 HydrophobicContact CD1-CE3 3.81Å; Y47-W52 HydrophobicContact CD1-CZ3 4.3Å; Y47-W52 AromaticContact CD2-CE3 3.57Å; Y47-W52 HydrophobicContact CD2-CE3 3.57Å; Y47-W52 HydrophobicContact CD2-CH2 4.07Å; Y47-W52 AromaticContact CD2-CZ3 3.26Å; Y47-W52 HydrophobicContact CD2-CZ3 3.26Å; Y47-W52 AromaticContact CE1-CE3 4Å; Y47-W52 HydrophobicContact CE1-CE3 4Å; Y47-W52 AromaticContact CE2-CE3 3.79Å; Y47-W52 HydrophobicContact CE2-CE3 3.79Å; Y47-W52 AromaticContact CE2-CZ3 3.72Å; Y47-W52 HydrophobicContact CE2-CZ3 3.72Å; Y47-W52 HydrophobicContact CG-CD2 4.18Å; Y47-W52 AromaticContact CG-CE3 3.57Å; Y47-W52 HydrophobicContact CG-CE3 3.57Å; Y47-W52 HydrophobicContact CG-CH2 4.2Å; Y47-W52 AromaticContact CG-CZ3 3.58Å; Y47-W52 HydrophobicContact CG-CZ3 3.58Å; Y47-W52 AromaticContact CZ-CE3 3.99Å; G50-W52 VanDerWaalsContact C-N 3.34Å; G50-W52 PolarHBondContact O-N 3.37Å; W52-V67 HydrophobicContact CZ3-CG2 4.02Å; W52-V70 HydrophobicContact CH2-CB 4.08Å; W52-V70 HydrophobicContact CH2-CG1 3.75Å; W52-V70 HydrophobicContact CH2-CG2 4.41Å; W52-V70 HydrophobicContact CZ2-CG1 3.72Å
53	T	93.6	Very high	93.9	Very high	137 Å²	137	51.6 Å²	51.6	84%	0.84	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-19	-179.1	56.1	0	0	0	0	112.9	N51	N51-T53 VanDerWaalsContact C-N 3.3Å; N51-T53 PolarHBondContact O-N 3.33Å; N51-T53 PolarHBondContact OD1-OG1 3.31Å
54	S	92.7	Very high	93.9	Very high	21 Å²	21	51.5 Å²	51.5	15%	0.147	27%	0.268	C	S	.	.			trans	-78.3	140.8	177.4	70.1	0	0	0	0	113	Q43 K46 N51	Q43-S54 PolarHBondContact NE2-O 3.46Å; K46-S54 WeakPolarHBondContact CD-OG 3.16Å; N51-S54 PolarHBondContact O-OG 3.12Å; N51-S54 WeakPolarHBondContact OD1-CB 3.37Å; N51-S54 PolarHBondContact OD1-N 3.01Å; N51-S54 PolarHBondContact OD1-OG 3.24Å
55	W	92.6	Very high	94	Very high	66 Å²	66	51.5 Å²	51.5	25%	0.25	27%	0.268	C	S	.	.			trans	-137.5	133.2	174	-170	-103.2	0	0	0	110.6	Q43 I59 T61 P63 Y66 L257	Q43-W55 HydrophobicContact CG-CZ3 4.42Å; W55-I59 HydrophobicContact CH2-CG2 3.87Å; W55-I59 HydrophobicContact CZ2-CB 3.85Å; W55-I59 HydrophobicContact CZ2-CG2 3.43Å; W55-I59 VanDerWaalsContact CZ2-CG2 3.43Å; W55-I59 PolarHBondContact NE1-O 2.97Å; W55-T61 VanDerWaalsContact CH2-O 3.29Å; W55-T61 WeakPolarHBondContact CH2-O 3.27Å; W55-T61 WeakPolarHBondContact CZ2-O 3.43Å; W55-P63 HydrophobicContact CH2-CB 4.2Å; W55-P63 HydrophobicContact CH2-CG 4.35Å; W55-P63 HydrophobicContact CZ3-CB 3.86Å; W55-P63 HydrophobicContact CZ3-CG 4.09Å; W55-Y66 HydrophobicContact CH2-CE2 4.09Å; W55-Y66 HydrophobicContact CZ3-CD2 4.48Å; W55-Y66 HydrophobicContact CZ3-CE2 4.17Å; W55-L257 HydrophobicContact CH2-CD1 4.07Å; W55-L257 HydrophobicContact CZ2-CB 4.05Å; W55-L257 HydrophobicContact CZ2-CD1 3.72Å
56	D	90.5	Very high	94	Very high	23 Å²	23	48.9 Å²	48.9	12%	0.123	25%	0.254	C	S	.	.			trans	-79.4	119.1	170.4	-169.4	-38.3	0	0	0	110.1	R42 K58 I59	R42-D56 IonicContact CZ-OD2 3.52Å; R42-D56 IonicContact NH1-OD2 3.4Å; R42-D56 IonicContact NH2-OD2 2.71Å; R42-D56 PolarHBondContact NH2-OD2 3.29Å; D56-K58 PolarHBondContact O-N 3.17Å; D56-K58 VanDerWaalsContact O-N 3.08Å; D56-K58 WeakPolarHBondContact OD1-CB 3.38Å; D56-K58 PolarHBondContact OD1-N 2.66Å; D56-I59 HydrophobicContact CB-CD1 3.71Å; D56-I59 HydrophobicContact CB-CG1 4.01Å; D56-I59 WeakPolarHBondContact O-CB 3.48Å; D56-I59 PolarHBondContact O-N 3.07Å
57	N	90	Very high	94.1	Very high	123 Å²	123	47 Å²	47	66%	0.658	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-14.1	-176.1	-69.8	-23.6	0	0	0	114.3	I59 G258 D259	N57-I59 VanDerWaalsContact C-N 3.34Å; N57-G258 CarbonylContact O-C 3.49Å; N57-G258 WeakPolarHBondContact O-CA 3.31Å; N57-D259 PolarHBondContact O-N 3.44Å
58	K	89.8	Confident	94.1	Very high	99 Å²	99	47.2 Å²	47.2	43%	0.43	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-8.2	173	-69.3	-59.8	-173.9	-178.9	0	113.7	F39 D56 D259	F39-K58 HydrophobicContact CD1-CB 3.57Å; F39-K58 HydrophobicContact CD1-CG 4.31Å; F39-K58 HydrophobicContact CD2-CB 4.44Å; F39-K58 HydrophobicContact CE1-CB 3.53Å; F39-K58 HydrophobicContact CE1-CG 3.8Å; F39-K58 HydrophobicContact CE2-CB 4.38Å; F39-K58 HydrophobicContact CG-CB 4.09Å; F39-K58 HydrophobicContact CZ-CB 3.97Å; F39-K58 HydrophobicContact CZ-CG 4.2Å; D56-K58 PolarHBondContact O-N 3.17Å; D56-K58 VanDerWaalsContact O-N 3.08Å; D56-K58 WeakPolarHBondContact OD1-CB 3.38Å; D56-K58 PolarHBondContact OD1-N 2.66Å; K58-D259 HydrophobicContact CD-CB 4.46Å; K58-D259 IonicContact NZ-OD1 3.79Å; K58-D259 PolarHBondContact NZ-OD1 3.43Å; K58-D259 IonicContact NZ-OD2 2.73Å; K58-D259 PolarHBondContact NZ-OD2 3.39Å
59	I	91.6	Very high	94.2	Very high	3 Å²	3	46.1 Å²	46.1	2%	0.015	25%	0.247	C	C	.	.			trans	-85.2	118.9	175.3	-60	170.1	0	0	0	109.8	F39 Q43 W55 D56 N57 T61 Y66 G258	F39-I59 HydrophobicContact CB-CD1 4.32Å; F39-I59 HydrophobicContact CB-CG1 3.76Å; Q43-I59 HydrophobicContact CB-CD1 3.48Å; Q43-I59 VanDerWaalsContact CB-CD1 3.48Å; Q43-I59 HydrophobicContact CG-CD1 3.71Å; W55-I59 HydrophobicContact CH2-CG2 3.87Å; W55-I59 HydrophobicContact CZ2-CB 3.85Å; W55-I59 HydrophobicContact CZ2-CG2 3.43Å; W55-I59 VanDerWaalsContact CZ2-CG2 3.43Å; W55-I59 PolarHBondContact NE1-O 2.97Å; D56-I59 HydrophobicContact CB-CD1 3.71Å; D56-I59 HydrophobicContact CB-CG1 4.01Å; D56-I59 WeakPolarHBondContact O-CB 3.48Å; D56-I59 PolarHBondContact O-N 3.07Å; N57-I59 VanDerWaalsContact C-N 3.34Å; I59-T61 VanDerWaalsContact CG2-O 3.31Å; I59-T61 WeakPolarHBondContact CG2-O 3.27Å; I59-Y66 HydrophobicContact CD1-CE2 4.14Å; I59-Y66 WeakPolarHBondContact CD1-OH 3.44Å; I59-Y66 HydrophobicContact CG2-CE2 4.39Å; I59-Y66 VanDerWaalsContact CG2-OH 3.29Å; I59-Y66 WeakPolarHBondContact CG2-OH 3.48Å; I59-G258 VanDerWaalsContact O-CA 3.31Å; I59-G258 WeakPolarHBondContact O-CA 3.24Å; I59-G258 PolarHBondContact O-N 3.46Å; I59-G258 VanDerWaalsContact O-N 3.15Å
60	T	89	Confident	94.3	Very high	27 Å²	27	39.1 Å²	39.1	17%	0.166	22%	0.215	C	C	.	.			trans	-94.8	-18.7	179.3	58.5	0	0	0	0	113.2	Q175 L257 G258 D259 H263	T60-Q175 PolarHBondContact O-NE2 3.27Å; T60-L257 PolarHBondContact O-N 3.49Å; T60-G258 WeakPolarHBondContact CG2-O 3.31Å; T60-D259 HydrophobicContact CG2-CB 3.94Å; T60-H263 WeakPolarHBondContact CG2-CD2 3.39Å
61	T	92.9	Very high	94.4	Very high	4 Å²	4	40.4 Å²	40.4	3%	0.025	22%	0.216	C	C	.	.	S	Bend	trans	-94.1	153.1	-176.6	56.3	0	0	0	0	112.6	W55 I59 R174	W55-T61 VanDerWaalsContact CH2-O 3.29Å; W55-T61 WeakPolarHBondContact CH2-O 3.27Å; W55-T61 WeakPolarHBondContact CZ2-O 3.43Å; I59-T61 VanDerWaalsContact CG2-O 3.31Å; I59-T61 WeakPolarHBondContact CG2-O 3.27Å; T61-R174 HydrophobicContact CG2-CG 4.22Å
62	P	94.8	Very high	94.3	Very high	13 Å²	13	39.4 Å²	39.4	8%	0.084	22%	0.218	C	C	.	.			trans	-72.1	165.5	176.1	-6.2	23.5	0	0	0	113.6	G64 F172 L257	P62-G64 PolarHBondContact O-N 3.28Å; P62-F172 CarbonylContact C-O 3.6Å; P62-F172 VanDerWaalsContact C-O 3.24Å; P62-F172 HydrophobicContact CB-CD2 4.1Å; P62-F172 VanDerWaalsContact CB-O 3.26Å; P62-F172 WeakPolarHBondContact CB-O 3.23Å; P62-L257 VanDerWaalsContact CA-CD1 3.43Å; P62-L257 HydrophobicContact CB-CD1 3.78Å; P62-L257 HydrophobicContact CG-CD1 4.17Å
63	P	96	Very high	94.4	Very high	20 Å²	20	34.5 Å²	34.5	13%	0.13	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	8	-166.2	17.4	-21	0	0	0	116.2	Y47 W55 L65 Y66 V67 F172	Y47-P63 HydrophobicContact CE2-CB 3.88Å; W55-P63 HydrophobicContact CH2-CB 4.2Å; W55-P63 HydrophobicContact CH2-CG 4.35Å; W55-P63 HydrophobicContact CZ3-CB 3.86Å; W55-P63 HydrophobicContact CZ3-CG 4.09Å; P63-L65 VanDerWaalsContact C-N 3.28Å; P63-L65 PolarHBondContact O-N 3.12Å; P63-Y66 HydrophobicContact CB-CD2 3.94Å; P63-Y66 PolarHBondContact O-N 2.83Å; P63-V67 HydrophobicContact CB-CG2 4.2Å; P63-V67 WeakPolarHBondContact O-CG2 3.4Å; P63-V67 PolarHBondContact O-N 3.16Å; P63-F172 HydrophobicContact CB-CZ 4.34Å; P63-F172 HydrophobicContact CG-CE1 4.49Å; P63-F172 HydrophobicContact CG-CE2 3.64Å; P63-F172 HydrophobicContact CG-CZ 3.59Å
64	G	97.3	Very high	94.5	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-55.7	-37.8	-171.2	0	0	0	0	0	114.2	P62 Y66 A68 Y169 F172	P62-G64 PolarHBondContact O-N 3.28Å; G64-Y66 PolarHBondContact O-N 2.82Å; G64-A68 WeakPolarHBondContact O-CB 3.31Å; G64-A68 PolarHBondContact O-N 3.25Å; G64-Y169 PolarHBondContact O-OH 3.07Å; G64-F172 VanDerWaalsContact CA-CD1 3.44Å; G64-F172 WeakPolarHBondContact CA-O 3.27Å; G64-F172 PolarHBondContact N-O 3.3Å
65	L	97.8	Very high	94.6	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-60	-47.6	173.8	175.3	65.5	0	0	0	111.6	P63 A68 Y69 F98 Y138 T140 C143	P63-L65 VanDerWaalsContact C-N 3.28Å; P63-L65 PolarHBondContact O-N 3.12Å; L65-A68 PolarHBondContact O-N 2.91Å; L65-Y69 PolarHBondContact O-N 2.86Å; L65-F98 HydrophobicContact CD1-CE2 4.03Å; L65-Y138 HydrophobicContact CD1-CE2 3.85Å; L65-Y138 HydrophobicContact CD2-CD1 4.41Å; L65-Y138 HydrophobicContact CD2-CE1 4.01Å; L65-Y138 HydrophobicContact CD2-CE2 4.11Å; L65-Y138 HydrophobicContact CG-CE1 4.41Å; L65-Y138 HydrophobicContact CG-CE2 4.02Å; L65-T140 HydrophobicContact CB-CG2 4.02Å; L65-T140 HydrophobicContact CD2-CG2 3.8Å; L65-C143 HydrophobicContact CD1-CB 3.98Å
66	Y	97.6	Very high	94.7	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-71.6	-40.7	-174.8	-37.3	-41	0	0	0	110.8	H40 Q43 T44 Y47 W55 I59 P63 G64 Y69 V70	H40-Y66 HydrophobicContact CB-CE1 3.9Å; H40-Y66 AromaticContact ND1-CE1 3.73Å; H40-Y66 AromaticContact ND1-CZ 3.69Å; H40-Y66 PolarHBondContact ND1-OH 3.24Å; Q43-Y66 HydrophobicContact CB-CD2 4.2Å; Q43-Y66 HydrophobicContact CB-CE2 4Å; Q43-Y66 HydrophobicContact CG-CD2 3.52Å; Q43-Y66 HydrophobicContact CG-CE2 3.49Å; Q43-Y66 VanDerWaalsContact CG-CE2 3.49Å; Q43-Y66 HydrophobicContact CG-CG 4.28Å; T44-Y66 WeakPolarHBondContact OG1-CD1 3.45Å; Y47-Y66 HydrophobicContact CE2-CD2 4.13Å; W55-Y66 HydrophobicContact CH2-CE2 4.09Å; W55-Y66 HydrophobicContact CZ3-CD2 4.48Å; W55-Y66 HydrophobicContact CZ3-CE2 4.17Å; I59-Y66 HydrophobicContact CD1-CE2 4.14Å; I59-Y66 WeakPolarHBondContact CD1-OH 3.44Å; I59-Y66 HydrophobicContact CG2-CE2 4.39Å; I59-Y66 VanDerWaalsContact CG2-OH 3.29Å; I59-Y66 WeakPolarHBondContact CG2-OH 3.48Å; P63-Y66 HydrophobicContact CB-CD2 3.94Å; P63-Y66 PolarHBondContact O-N 2.83Å; G64-Y66 PolarHBondContact O-N 2.82Å; Y66-Y69 PolarHBondContact O-N 3.46Å; Y66-V70 WeakPolarHBondContact O-CB 3.32Å; Y66-V70 WeakPolarHBondContact O-CG2 3.49Å; Y66-V70 PolarHBondContact O-N 3.32Å
67	V	97.5	Very high	94.9	Very high	34 Å²	34	36.4 Å²	36.4	21%	0.206	21%	0.208	C	C	.	.	H	α-helix	trans	-61.2	-46.5	174.9	173.4	0	0	0	0	110.1	W52 P63 Y69 V70 S71 F172	W52-V67 HydrophobicContact CZ3-CG2 4.02Å; P63-V67 HydrophobicContact CB-CG2 4.2Å; P63-V67 WeakPolarHBondContact O-CG2 3.4Å; P63-V67 PolarHBondContact O-N 3.16Å; V67-Y69 VanDerWaalsContact C-N 3.33Å; V67-Y69 PolarHBondContact O-N 3.06Å; V67-V70 PolarHBondContact O-N 3.33Å; V67-S71 WeakPolarHBondContact O-CB 3.12Å; V67-S71 PolarHBondContact O-N 3.27Å; V67-S71 PolarHBondContact O-OG 3.35Å; V67-F172 HydrophobicContact CB-CE1 4.16Å; V67-F172 HydrophobicContact CG1-CE1 4.44Å; V67-F172 HydrophobicContact CG2-CE1 3.91Å; V67-F172 HydrophobicContact CG2-CZ 4.19Å
68	A	96.9	Very high	95.1	Very high	19 Å²	19	35.2 Å²	35.2	16%	0.157	21%	0.208	C	C	.	.	H	α-helix	trans	-55.6	-48.7	176.1	0	0	0	0	0	111.5	G64 L65 A72 F98 Y169	G64-A68 WeakPolarHBondContact O-CB 3.31Å; G64-A68 PolarHBondContact O-N 3.25Å; L65-A68 PolarHBondContact O-N 2.91Å; A68-A72 PolarHBondContact O-N 3.22Å; A68-F98 HydrophobicContact CB-CZ 3.95Å; A68-Y169 WeakPolarHBondContact CA-OH 3.19Å; A68-Y169 HydrophobicContact CB-CE1 4.44Å; A68-Y169 VanDerWaalsContact CB-OH 3.27Å; A68-Y169 WeakPolarHBondContact CB-OH 3.47Å; A68-Y169 PolarHBondContact N-OH 3.46Å; A68-Y169 VanDerWaalsContact N-OH 3.15Å
69	Y	97.7	Very high	95.4	Very high	11 Å²	11	36.3 Å²	36.3	4%	0.043	22%	0.218	C	C	.	.	H	α-helix	trans	-64.2	-51	-179.9	-173.6	-87.5	0	0	0	111.9	T44 I48 L65 Y66 V67 S71 A72 H73 P86 L91 S94 Y138	T44-Y69 HydrophobicContact CG2-CD1 3.51Å; T44-Y69 HydrophobicContact CG2-CE1 4.21Å; T44-Y69 HydrophobicContact CG2-CG 4.06Å; I48-Y69 HydrophobicContact CD1-CD1 4.32Å; I48-Y69 HydrophobicContact CD1-CE1 3.96Å; L65-Y69 PolarHBondContact O-N 2.86Å; Y66-Y69 PolarHBondContact O-N 3.46Å; V67-Y69 VanDerWaalsContact C-N 3.33Å; V67-Y69 PolarHBondContact O-N 3.06Å; Y69-S71 VanDerWaalsContact C-N 3.33Å; Y69-S71 PolarHBondContact O-N 3.32Å; Y69-A72 PolarHBondContact O-N 3.37Å; Y69-H73 HydrophobicContact CD1-CB 4.03Å; Y69-H73 HydrophobicContact CE1-CB 3.74Å; Y69-H73 VanDerWaalsContact O-CB 3.23Å; Y69-H73 WeakPolarHBondContact O-CB 3.44Å; Y69-H73 PolarHBondContact O-N 2.87Å; Y69-P86 HydrophobicContact CE1-CB 4.44Å; Y69-P86 HydrophobicContact CE1-CG 4.12Å; Y69-P86 VanDerWaalsContact OH-CB 3.28Å; Y69-P86 WeakPolarHBondContact OH-CB 3.13Å; Y69-L91 HydrophobicContact CD1-CD2 3.65Å; Y69-L91 HydrophobicContact CD2-CD2 3.81Å; Y69-L91 HydrophobicContact CE1-CD2 3.43Å; Y69-L91 VanDerWaalsContact CE1-CD2 3.43Å; Y69-L91 HydrophobicContact CE1-CG 4.42Å; Y69-L91 HydrophobicContact CE2-CD2 3.6Å; Y69-L91 HydrophobicContact CE2-CG 4.31Å; Y69-L91 HydrophobicContact CG-CD2 3.84Å; Y69-S94 WeakPolarHBondContact CD2-OG 3.3Å; Y69-Y138 WeakPolarHBondContact CB-OH 3.29Å; Y69-Y138 HydrophobicContact CD2-CE2 4.27Å
70	V	97.3	Very high	95.5	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.012	25%	0.251	C	S	.	.	H	α-helix	trans	-62.7	-40.5	-176.4	174	0	0	0	0	111.2	T44 I48 W52 Y66 V67 H73 K74	T44-V70 HydrophobicContact CG2-CG2 4.22Å; I48-V70 HydrophobicContact CG1-CG2 3.84Å; W52-V70 HydrophobicContact CH2-CB 4.08Å; W52-V70 HydrophobicContact CH2-CG1 3.75Å; W52-V70 HydrophobicContact CH2-CG2 4.41Å; W52-V70 HydrophobicContact CZ2-CG1 3.72Å; Y66-V70 WeakPolarHBondContact O-CB 3.32Å; Y66-V70 WeakPolarHBondContact O-CG2 3.49Å; Y66-V70 PolarHBondContact O-N 3.32Å; V67-V70 PolarHBondContact O-N 3.33Å; V70-H73 PolarHBondContact O-N 2.79Å; V70-K74 HydrophobicContact CG1-CD 4.19Å; V70-K74 HydrophobicContact CG1-CG 4.36Å; V70-K74 WeakPolarHBondContact O-CB 3.36Å; V70-K74 WeakPolarHBondContact O-CG 3.34Å; V70-K74 PolarHBondContact O-N 2.98Å
71	S	95.5	Very high	95.7	Very high	69 Å²	69	42.7 Å²	42.7	48%	0.483	27%	0.271	S	S	.	.	H	α-helix	trans	-60.6	-45.5	175.5	-66.5	0	0	0	0	111.8	V67 Y69	V67-S71 WeakPolarHBondContact O-CB 3.12Å; V67-S71 PolarHBondContact O-N 3.27Å; V67-S71 PolarHBondContact O-OG 3.35Å; Y69-S71 VanDerWaalsContact C-N 3.33Å; Y69-S71 PolarHBondContact O-N 3.32Å
72	A	95.3	Very high	95.7	Very high	47 Å²	47	44.4 Å²	44.4	39%	0.388	28%	0.28	S	S	.	.	H	α-helix	trans	-69.5	-42.7	177	0	0	0	0	0	112.2	A68 Y69 K74 V75 L76	A68-A72 PolarHBondContact O-N 3.22Å; Y69-A72 PolarHBondContact O-N 3.37Å; A72-K74 PolarHBondContact O-N 3.18Å; A72-V75 PolarHBondContact O-N 3.19Å; A72-L76 WeakPolarHBondContact O-CB 3.44Å; A72-L76 VanDerWaalsContact O-CG 3.32Å; A72-L76 WeakPolarHBondContact O-CG 3.45Å; A72-L76 PolarHBondContact O-N 2.9Å
73	H	96.3	Very high	95.7	Very high	7 Å²	7	46 Å²	46	3%	0.032	29%	0.291	C	S	.	.	H	α-helix	trans	-61.1	-45	-179.6	174.5	-87.9	0	0	0	111.7	Y69 V70 V75 L76 S77 P83 P84	Y69-H73 HydrophobicContact CD1-CB 4.03Å; Y69-H73 HydrophobicContact CE1-CB 3.74Å; Y69-H73 VanDerWaalsContact O-CB 3.23Å; Y69-H73 WeakPolarHBondContact O-CB 3.44Å; Y69-H73 PolarHBondContact O-N 2.87Å; V70-H73 PolarHBondContact O-N 2.79Å; H73-V75 VanDerWaalsContact C-N 3.33Å; H73-V75 PolarHBondContact O-N 3.14Å; H73-L76 PolarHBondContact O-N 3.5Å; H73-S77 WeakPolarHBondContact O-CA 3.42Å; H73-S77 WeakPolarHBondContact O-CB 3.16Å; H73-S77 PolarHBondContact O-N 2.97Å; H73-P83 PolarHBondContact NE2-O 3.4Å; H73-P84 PolarHBondContact CE1-O 2.88Å; H73-P84 VanDerWaalsContact CE1-O 3.25Å
74	K	94.5	Very high	95.5	Very high	107 Å²	107	49.8 Å²	49.8	47%	0.465	32%	0.315	S	S	.	.	H	α-helix	trans	-58.9	-43	177.7	-76.7	-176.2	176	-171.6	0	112.6	V70 A72 S78	V70-K74 HydrophobicContact CG1-CD 4.19Å; V70-K74 HydrophobicContact CG1-CG 4.36Å; V70-K74 WeakPolarHBondContact O-CB 3.36Å; V70-K74 WeakPolarHBondContact O-CG 3.34Å; V70-K74 PolarHBondContact O-N 2.98Å; A72-K74 PolarHBondContact O-N 3.18Å; K74-S78 WeakPolarHBondContact O-CB 3.3Å; K74-S78 PolarHBondContact O-N 3.23Å; K74-S78 PolarHBondContact O-OG 2.67Å
75	V	95.4	Very high	95.2	Very high	86 Å²	86	57.8 Å²	57.8	52%	0.521	35%	0.352	S	S	.	.	H	α-helix	trans	-67.6	-51.1	177.7	176.8	0	0	0	0	110.5	A72 H73 S77 S78 L79	A72-V75 PolarHBondContact O-N 3.19Å; H73-V75 VanDerWaalsContact C-N 3.33Å; H73-V75 PolarHBondContact O-N 3.14Å; V75-S77 VanDerWaalsContact C-N 3.34Å; V75-S77 PolarHBondContact O-N 3.27Å; V75-S78 PolarHBondContact O-N 3.41Å; V75-S78 PolarHBondContact O-OG 2.82Å; V75-L79 HydrophobicContact CG1-CD1 4.25Å; V75-L79 WeakPolarHBondContact O-CG 3.42Å; V75-L79 PolarHBondContact O-N 3.5Å; V75-L79 VanDerWaalsContact O-N 3.15Å
76	L	95.5	Very high	95.1	Very high	66 Å²	66	58.3 Å²	58.3	35%	0.346	36%	0.356	S	S	.	.	H	α-helix	trans	-66.9	-34.5	-177.3	-69.2	173.9	0	0	0	112.9	A72 H73 L79 G80 V81 L82	A72-L76 WeakPolarHBondContact O-CB 3.44Å; A72-L76 VanDerWaalsContact O-CG 3.32Å; A72-L76 WeakPolarHBondContact O-CG 3.45Å; A72-L76 PolarHBondContact O-N 2.9Å; H73-L76 PolarHBondContact O-N 3.5Å; L76-L79 PolarHBondContact O-N 3.2Å; L76-G80 PolarHBondContact O-N 3.37Å; L76-V81 HydrophobicContact CB-CB 4.3Å; L76-V81 HydrophobicContact CD2-CB 4.33Å; L76-V81 HydrophobicContact CD2-CG1 4.34Å; L76-V81 WeakPolarHBondContact O-CB 3.23Å; L76-V81 PolarHBondContact O-N 2.88Å; L76-L82 HydrophobicContact CB-CB 4.32Å; L76-L82 HydrophobicContact CB-CD1 3.86Å; L76-L82 HydrophobicContact CB-CG 4.01Å; L76-L82 HydrophobicContact CD1-CD1 3.78Å; L76-L82 HydrophobicContact CD1-CG 4.4Å; L76-L82 HydrophobicContact CG-CD1 4.5Å; L76-L82 PolarHBondContact O-N 2.75Å
77	S	95.2	Very high	95	Very high	28 Å²	28	61.3 Å²	61.3	20%	0.196	37%	0.374	C	S	.	.	H	α-helix	trans	-71.6	-38.5	175.7	-168.4	0	0	0	0	111.5	H73 V75 L79 G80 L82	H73-S77 WeakPolarHBondContact O-CA 3.42Å; H73-S77 WeakPolarHBondContact O-CB 3.16Å; H73-S77 PolarHBondContact O-N 2.97Å; V75-S77 VanDerWaalsContact C-N 3.34Å; V75-S77 PolarHBondContact O-N 3.27Å; S77-L79 PolarHBondContact O-N 2.91Å; S77-G80 PolarHBondContact O-N 3.25Å; S77-L82 WeakPolarHBondContact CA-O 3.39Å; S77-L82 WeakPolarHBondContact CB-O 3.23Å; S77-L82 PolarHBondContact OG-O 2.94Å; S77-L82 VanDerWaalsContact OG-O 3.08Å
78	S	94.2	Very high	95	Very high	97 Å²	97	60.5 Å²	60.5	68%	0.678	37%	0.369	S	S	*	.	H	α-helix	trans	-63.1	-25.4	172.1	70.7	0	0	0	0	113.6	K74 V75 G80	K74-S78 WeakPolarHBondContact O-CB 3.3Å; K74-S78 PolarHBondContact O-N 3.23Å; K74-S78 PolarHBondContact O-OG 2.67Å; V75-S78 PolarHBondContact O-N 3.41Å; V75-S78 PolarHBondContact O-OG 2.82Å; S78-G80 VanDerWaalsContact C-N 3.32Å
79	L	95.2	Very high	95	Very high	122 Å²	122	61.8 Å²	61.8	64%	0.639	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	1	174.6	-65.4	173.9	0	0	0	113	V75 L76 S77 V81	V75-L79 HydrophobicContact CG1-CD1 4.25Å; V75-L79 WeakPolarHBondContact O-CG 3.42Å; V75-L79 PolarHBondContact O-N 3.5Å; V75-L79 VanDerWaalsContact O-N 3.15Å; L76-L79 PolarHBondContact O-N 3.2Å; S77-L79 PolarHBondContact O-N 2.91Å; L79-V81 HydrophobicContact CB-CG2 4.08Å; L79-V81 PolarHBondContact O-N 3.03Å
80	G	93.3	Very high	94.9	Very high	68 Å²	68	64.2 Å²	64.2	70%	0.701	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.7	11.5	-177.4	0	0	0	0	0	114.9	L76 S77 S78	L76-G80 PolarHBondContact O-N 3.37Å; S77-G80 PolarHBondContact O-N 3.25Å; S78-G80 VanDerWaalsContact C-N 3.32Å
81	V	93.2	Very high	94.9	Very high	97 Å²	97	64.1 Å²	64.1	59%	0.588	38%	0.383	S	S	*	.	S	Bend	trans	-79.6	-36.1	-179.8	180	0	0	0	0	111.5	L76 L79	L76-V81 HydrophobicContact CB-CB 4.3Å; L76-V81 HydrophobicContact CD2-CB 4.33Å; L76-V81 HydrophobicContact CD2-CG1 4.34Å; L76-V81 WeakPolarHBondContact O-CB 3.23Å; L76-V81 PolarHBondContact O-N 2.88Å; L79-V81 HydrophobicContact CB-CG2 4.08Å; L79-V81 PolarHBondContact O-N 3.03Å
82	L	93.4	Very high	95	Very high	39 Å²	39	60.9 Å²	60.9	20%	0.204	36%	0.36	C	S	.	.	S	Bend	trans	-119.1	145.3	178.5	-72.3	179.7	0	0	0	111.6	L76 S77	L76-L82 HydrophobicContact CB-CB 4.32Å; L76-L82 HydrophobicContact CB-CD1 3.86Å; L76-L82 HydrophobicContact CB-CG 4.01Å; L76-L82 HydrophobicContact CD1-CD1 3.78Å; L76-L82 HydrophobicContact CD1-CG 4.4Å; L76-L82 HydrophobicContact CG-CD1 4.5Å; L76-L82 PolarHBondContact O-N 2.75Å; S77-L82 WeakPolarHBondContact CA-O 3.39Å; S77-L82 WeakPolarHBondContact CB-O 3.23Å; S77-L82 PolarHBondContact OG-O 2.94Å; S77-L82 VanDerWaalsContact OG-O 3.08Å
83	P	94.2	Very high	95.1	Very high	48 Å²	48	62.1 Å²	62.1	31%	0.312	36%	0.357	S	S	.	.			trans	-63.7	149.1	174.8	28.2	-34.6	0	0	0	110.9	H73 E85	H73-P83 PolarHBondContact NE2-O 3.4Å; P83-E85 PolarHBondContact O-N 3.27Å
84	P	91.9	Very high	95.1	Very high	98 Å²	98	62.5 Å²	62.5	64%	0.636	36%	0.361	S	S	*	.	S	Bend	trans	-56.2	-37.2	175.1	-26	34.6	0	0	0	113	H73 P86	H73-P84 PolarHBondContact CE1-O 2.88Å; H73-P84 VanDerWaalsContact CE1-O 3.25Å; P84-P86 WeakPolarHBondContact O-CD 3.37Å
85	E	92.4	Very high	95.3	Very high	169 Å²	169	57.4 Å²	57.4	79%	0.79	34%	0.339	S	S	*	.	S	Bend	trans	-106	101.4	174.5	-65.4	-174.1	173.7	0	0	110	P83	P83-E85 PolarHBondContact O-N 3.27Å
86	P	95	Very high	95.4	Very high	11 Å²	11	53.5 Å²	53.5	7%	0.071	32%	0.315	C	S	.	.			trans	-77.2	139.1	179.6	30.1	-32.2	0	0	0	111.3	L45 I48 Y69 P84 H90	L45-P86 HydrophobicContact CD2-CG 4.11Å; I48-P86 HydrophobicContact CD1-CG 3.35Å; Y69-P86 HydrophobicContact CE1-CB 4.44Å; Y69-P86 HydrophobicContact CE1-CG 4.12Å; Y69-P86 VanDerWaalsContact OH-CB 3.28Å; Y69-P86 WeakPolarHBondContact OH-CB 3.13Å; P84-P86 WeakPolarHBondContact O-CD 3.37Å; P86-H90 HydrophobicContact CB-CB 3.92Å
87	T	95.3	Very high	95.4	Very high	62 Å²	62	54.5 Å²	54.5	38%	0.38	32%	0.32	S	S	.	.			trans	-81.5	168.7	169	72.4	0	0	0	0	111.8	M89 H90 L91	T87-M89 PolarHBondContact O-N 3.32Å; T87-M89 PolarHBondContact OG1-N 3.43Å; T87-H90 PolarHBondContact N-ND1 2.82Å; T87-H90 WeakPolarHBondContact O-CB 3.41Å; T87-H90 PolarHBondContact O-N 2.98Å; T87-H90 PolarHBondContact OG1-CE1 2.89Å; T87-H90 PolarHBondContact OG1-ND1 3.35Å; T87-L91 PolarHBondContact O-N 2.73Å
88	V	97	Very high	95.6	Very high	18 Å²	18	54.3 Å²	54.3	11%	0.109	32%	0.316	C	S	.	.	H	α-helix	trans	-52.3	-38.2	173.9	-173.1	0	0	0	0	111.9	P33 V41 H90 L91 R92	P33-V88 HydrophobicContact CG-CG1 4.35Å; P33-V88 HydrophobicContact CG-CG2 3.68Å; V41-V88 HydrophobicContact CG1-CG2 4.38Å; V41-V88 HydrophobicContact CG2-CG1 4.4Å; V88-H90 VanDerWaalsContact C-N 3.35Å; V88-H90 PolarHBondContact O-N 3.29Å; V88-L91 WeakPolarHBondContact O-CB 3.49Å; V88-L91 PolarHBondContact O-N 2.69Å; V88-R92 HydrophobicContact CG1-CG 4.4Å; V88-R92 WeakPolarHBondContact O-CG 3.32Å; V88-R92 PolarHBondContact O-N 2.83Å
89	M	96.6	Very high	95.7	Very high	46 Å²	46	49.7 Å²	49.7	23%	0.227	28%	0.284	C	S	.	.	H	α-helix	trans	-59.9	-44.5	177.3	-172.1	-176	-68.4	0	0	111.6	T87 L91 R92 F93	T87-M89 PolarHBondContact O-N 3.32Å; T87-M89 PolarHBondContact OG1-N 3.43Å; M89-L91 VanDerWaalsContact C-N 3.3Å; M89-L91 PolarHBondContact O-N 2.91Å; M89-R92 PolarHBondContact O-N 3.45Å; M89-F93 HydrophobicContact CG-CD2 3.85Å; M89-F93 HydrophobicContact CG-CE2 3.65Å; M89-F93 VanDerWaalsContact O-CD2 3.22Å; M89-F93 WeakPolarHBondContact O-CD2 3.47Å; M89-F93 PolarHBondContact O-N 3.42Å; M89-F93 HydrophobicContact SD-CE2 4.14Å
90	H	96.2	Very high	95.9	Very high	61 Å²	61	45.7 Å²	45.7	28%	0.282	26%	0.263	S	S	.	.	H	α-helix	trans	-63.3	-37.4	177.6	-60.3	92.5	0	0	0	111.9	P86 T87 V88 F93 S94	P86-H90 HydrophobicContact CB-CB 3.92Å; T87-H90 PolarHBondContact N-ND1 2.82Å; T87-H90 WeakPolarHBondContact O-CB 3.41Å; T87-H90 PolarHBondContact O-N 2.98Å; T87-H90 PolarHBondContact OG1-CE1 2.89Å; T87-H90 PolarHBondContact OG1-ND1 3.35Å; V88-H90 VanDerWaalsContact C-N 3.35Å; V88-H90 PolarHBondContact O-N 3.29Å; H90-F93 PolarHBondContact O-N 2.76Å; H90-S94 PolarHBondContact O-N 2.93Å
91	L	97.5	Very high	96.1	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-64.7	-46.6	174.6	-68.4	162.9	0	0	0	110.7	V41 T44 Y69 T87 V88 M89 F93 S94 Y138	V41-L91 HydrophobicContact CB-CD1 4.13Å; V41-L91 HydrophobicContact CG1-CD1 3.74Å; V41-L91 HydrophobicContact CG2-CD1 3.82Å; T44-L91 HydrophobicContact CG2-CD2 3.63Å; Y69-L91 HydrophobicContact CD1-CD2 3.65Å; Y69-L91 HydrophobicContact CD2-CD2 3.81Å; Y69-L91 HydrophobicContact CE1-CD2 3.43Å; Y69-L91 VanDerWaalsContact CE1-CD2 3.43Å; Y69-L91 HydrophobicContact CE1-CG 4.42Å; Y69-L91 HydrophobicContact CE2-CD2 3.6Å; Y69-L91 HydrophobicContact CE2-CG 4.31Å; Y69-L91 HydrophobicContact CG-CD2 3.84Å; T87-L91 PolarHBondContact O-N 2.73Å; V88-L91 WeakPolarHBondContact O-CB 3.49Å; V88-L91 PolarHBondContact O-N 2.69Å; M89-L91 VanDerWaalsContact C-N 3.3Å; M89-L91 PolarHBondContact O-N 2.91Å; L91-F93 VanDerWaalsContact C-N 3.33Å; L91-F93 PolarHBondContact O-N 3.22Å; L91-S94 VanDerWaalsContact O-CB 3.3Å; L91-S94 WeakPolarHBondContact O-CB 3.3Å; L91-S94 PolarHBondContact O-N 2.95Å; L91-S94 PolarHBondContact O-OG 3.21Å; L91-Y138 HydrophobicContact CB-CD1 4.1Å; L91-Y138 HydrophobicContact CB-CD2 3.93Å; L91-Y138 HydrophobicContact CB-CE1 4.41Å; L91-Y138 HydrophobicContact CB-CE2 4.26Å; L91-Y138 HydrophobicContact CB-CG 3.83Å; L91-Y138 HydrophobicContact CD2-CD1 4.46Å; L91-Y138 HydrophobicContact CD2-CE1 3.95Å; L91-Y138 HydrophobicContact CD2-CE2 4.13Å; L91-Y138 VanDerWaalsContact O-CD2 3.23Å; L91-Y138 WeakPolarHBondContact O-CD2 3.42Å
92	R	97.8	Very high	96.3	Very high	1 Å²	1	42.6 Å²	42.6	0%	0.004	22%	0.222	C	C	.	.	H	α-helix	trans	-62.7	-35.2	176.5	-68.4	171.9	175.1	165.9	6.1	113.1	T23 S27 Q30 E32 E37 V88 M89 S94 S95 V96 A136	T23-R92 HydrophobicContact CG2-CB 3.63Å; S27-R92 WeakPolarHBondContact OG-CD 3.29Å; S27-R92 PolarHBondContact OG-NH1 3.47Å; Q30-R92 PolarHBondContact O-NH1 3.35Å; Q30-R92 PolarHBondContact O-NH2 3.45Å; E32-R92 PolarHBondContact O-NH2 2.98Å; E32-R92 VanDerWaalsContact O-NH2 3.09Å; E37-R92 VanDerWaalsContact OE1-CG 3.27Å; E37-R92 WeakPolarHBondContact OE1-CG 3.44Å; E37-R92 IonicContact OE1-CZ 3.23Å; E37-R92 IonicContact OE1-NE 3.29Å; E37-R92 PolarHBondContact OE1-NE 2.86Å; E37-R92 IonicContact OE1-NH2 3.86Å; E37-R92 IonicContact OE2-CZ 2.88Å; E37-R92 IonicContact OE2-NE 3.6Å; E37-R92 PolarHBondContact OE2-NE 2.84Å; E37-R92 IonicContact OE2-NH2 3.81Å; E37-R92 PolarHBondContact OE2-NH2 3.45Å; V88-R92 HydrophobicContact CG1-CG 4.4Å; V88-R92 WeakPolarHBondContact O-CG 3.32Å; V88-R92 PolarHBondContact O-N 2.83Å; M89-R92 PolarHBondContact O-N 3.45Å; R92-S94 PolarHBondContact O-N 2.96Å; R92-S95 WeakPolarHBondContact O-CA 3.45Å; R92-S95 VanDerWaalsContact O-CB 3.27Å; R92-S95 WeakPolarHBondContact O-CB 3.2Å; R92-S95 PolarHBondContact O-N 3.45Å; R92-V96 PolarHBondContact O-N 3.44Å; R92-A136 VanDerWaalsContact CD-O 3.25Å; R92-A136 WeakPolarHBondContact CD-O 3.45Å
93	F	97.1	Very high	96.6	Very high	73 Å²	73	40.8 Å²	40.8	32%	0.32	21%	0.212	S	C	.	.	H	α-helix	trans	-64.8	-21.7	173.2	-87	-73.2	0	0	0	113.4	C20 T23 M89 H90 L91 V96 L97	C20-F93 HydrophobicContact CB-CE1 4.24Å; T23-F93 HydrophobicContact CG2-CD1 4.45Å; T23-F93 HydrophobicContact CG2-CD2 4.24Å; T23-F93 HydrophobicContact CG2-CE1 4.46Å; T23-F93 HydrophobicContact CG2-CE2 4.24Å; T23-F93 HydrophobicContact CG2-CG 4.34Å; T23-F93 HydrophobicContact CG2-CZ 4.35Å; M89-F93 HydrophobicContact CG-CD2 3.85Å; M89-F93 HydrophobicContact CG-CE2 3.65Å; M89-F93 VanDerWaalsContact O-CD2 3.22Å; M89-F93 WeakPolarHBondContact O-CD2 3.47Å; M89-F93 PolarHBondContact O-N 3.42Å; M89-F93 HydrophobicContact SD-CE2 4.14Å; H90-F93 PolarHBondContact O-N 2.76Å; L91-F93 VanDerWaalsContact C-N 3.33Å; L91-F93 PolarHBondContact O-N 3.22Å; F93-V96 HydrophobicContact CD1-CB 4.43Å; F93-V96 HydrophobicContact CD1-CG2 4.21Å; F93-V96 WeakPolarHBondContact O-CB 3.32Å; F93-V96 PolarHBondContact O-N 3.48Å; F93-L97 PolarHBondContact O-N 3.34Å; F93-L97 VanDerWaalsContact O-N 3.07Å
94	S	96.6	Very high	96.7	Very high	16 Å²	16	40 Å²	40	11%	0.112	21%	0.21	C	C	.	.	H	α-helix	trans	-69.4	-34.9	168.8	78.4	0	0	0	0	112.6	Y69 H90 L91 R92 V96 L97 F98 Y138	Y69-S94 WeakPolarHBondContact CD2-OG 3.3Å; H90-S94 PolarHBondContact O-N 2.93Å; L91-S94 VanDerWaalsContact O-CB 3.3Å; L91-S94 WeakPolarHBondContact O-CB 3.3Å; L91-S94 PolarHBondContact O-N 2.95Å; L91-S94 PolarHBondContact O-OG 3.21Å; R92-S94 PolarHBondContact O-N 2.96Å; S94-V96 VanDerWaalsContact C-N 3.29Å; S94-V96 PolarHBondContact O-N 3.17Å; S94-L97 WeakPolarHBondContact O-CB 3.47Å; S94-L97 PolarHBondContact O-N 3.05Å; S94-L97 VanDerWaalsContact O-N 3.17Å; S94-F98 WeakPolarHBondContact O-CD2 3.48Å; S94-F98 PolarHBondContact O-N 2.86Å; S94-Y138 WeakPolarHBondContact OG-CE2 3.17Å
95	S	97.6	Very high	97	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-62.3	-38.1	170.9	-60.5	0	0	0	0	111.6	R92 F98 S99 S135 L137	R92-S95 WeakPolarHBondContact O-CA 3.45Å; R92-S95 VanDerWaalsContact O-CB 3.27Å; R92-S95 WeakPolarHBondContact O-CB 3.2Å; R92-S95 PolarHBondContact O-N 3.45Å; S95-F98 PolarHBondContact O-N 3.16Å; S95-S99 WeakPolarHBondContact O-CB 3.43Å; S95-S99 PolarHBondContact O-N 3.4Å; S95-S135 WeakPolarHBondContact CB-O 3Å; S95-L137 VanDerWaalsContact CB-O 3.32Å; S95-L137 WeakPolarHBondContact CB-O 3.45Å; S95-L137 PolarHBondContact OG-O 3.4Å
96	V	97.9	Very high	97.3	Very high	4 Å²	4	28.3 Å²	28.3	2%	0.024	15%	0.148	C	C	.	.	H	α-helix	trans	-60.5	-45.7	172.3	179.2	0	0	0	0	110.9	T23 R92 F93 S94 F98 S99 I100 S135	T23-V96 HydrophobicContact CG2-CG2 4.01Å; T23-V96 WeakPolarHBondContact OG1-CG2 3.49Å; R92-V96 PolarHBondContact O-N 3.44Å; F93-V96 HydrophobicContact CD1-CB 4.43Å; F93-V96 HydrophobicContact CD1-CG2 4.21Å; F93-V96 WeakPolarHBondContact O-CB 3.32Å; F93-V96 PolarHBondContact O-N 3.48Å; S94-V96 VanDerWaalsContact C-N 3.29Å; S94-V96 PolarHBondContact O-N 3.17Å; V96-F98 PolarHBondContact O-N 2.88Å; V96-S99 WeakPolarHBondContact O-CB 3.14Å; V96-S99 PolarHBondContact O-N 3.39Å; V96-S99 VanDerWaalsContact O-N 3.12Å; V96-I100 HydrophobicContact CG1-CD1 4.06Å; V96-I100 WeakPolarHBondContact O-CG1 3.5Å; V96-I100 PolarHBondContact O-N 2.92Å; V96-S135 WeakPolarHBondContact CG2-O 3.43Å; V96-S135 PolarHBondContact N-O 3.48Å
97	L	96.9	Very high	97.3	Very high	86 Å²	86	28.2 Å²	28.2	45%	0.45	15%	0.146	S	C	.	.	H	α-helix	trans	-60	-45.6	177	-177.3	64.6	0	0	0	111.8	F93 S94 S99 I100 F101	F93-L97 PolarHBondContact O-N 3.34Å; F93-L97 VanDerWaalsContact O-N 3.07Å; S94-L97 WeakPolarHBondContact O-CB 3.47Å; S94-L97 PolarHBondContact O-N 3.05Å; S94-L97 VanDerWaalsContact O-N 3.17Å; L97-S99 VanDerWaalsContact C-N 3.32Å; L97-S99 PolarHBondContact O-N 2.89Å; L97-I100 PolarHBondContact O-N 3.04Å; L97-F101 HydrophobicContact CD1-CD2 4.3Å; L97-F101 HydrophobicContact CD1-CE1 4.42Å; L97-F101 HydrophobicContact CD1-CE2 3.66Å; L97-F101 HydrophobicContact CD1-CZ 3.72Å; L97-F101 HydrophobicContact CD2-CE2 3.96Å; L97-F101 HydrophobicContact CG-CD2 4.02Å; L97-F101 HydrophobicContact CG-CE2 3.53Å; L97-F101 HydrophobicContact CG-CZ 4.13Å; L97-F101 WeakPolarHBondContact O-CD2 3.3Å; L97-F101 PolarHBondContact O-N 2.96Å
98	F	97.9	Very high	97.4	Very high	24 Å²	24	31.7 Å²	31.7	11%	0.105	15%	0.152	C	C	.	.	H	α-helix	trans	-61	-39.7	173.8	-67.2	-54.8	0	0	0	111.9	L65 A68 S94 S95 V96 I100 F101 N102 H142 C143 L146	L65-F98 HydrophobicContact CD1-CE2 4.03Å; A68-F98 HydrophobicContact CB-CZ 3.95Å; S94-F98 WeakPolarHBondContact O-CD2 3.48Å; S94-F98 PolarHBondContact O-N 2.86Å; S95-F98 PolarHBondContact O-N 3.16Å; V96-F98 PolarHBondContact O-N 2.88Å; F98-I100 PolarHBondContact O-N 3.26Å; F98-F101 PolarHBondContact O-N 3.37Å; F98-N102 WeakPolarHBondContact O-CB 3.42Å; F98-N102 VanDerWaalsContact O-CG 3.27Å; F98-N102 PolarHBondContact O-N 3.02Å; F98-N102 PolarHBondContact O-ND2 3.39Å; F98-H142 HydrophobicContact CB-CB 3.65Å; F98-C143 HydrophobicContact CD2-CB 4.2Å; F98-C143 HydrophobicContact CE1-CB 4.43Å; F98-C143 HydrophobicContact CE2-CB 4.07Å; F98-C143 HydrophobicContact CG-CB 4.47Å; F98-C143 HydrophobicContact CZ-CB 4.18Å; F98-L146 HydrophobicContact CD1-CD2 3.7Å; F98-L146 HydrophobicContact CE1-CD2 4.31Å
99	S	97.7	Very high	97.3	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-61.1	-42.1	175.7	-177.2	0	0	0	0	112.3	S95 V96 L97 N102 H103	S95-S99 WeakPolarHBondContact O-CB 3.43Å; S95-S99 PolarHBondContact O-N 3.4Å; V96-S99 WeakPolarHBondContact O-CB 3.14Å; V96-S99 PolarHBondContact O-N 3.39Å; V96-S99 VanDerWaalsContact O-N 3.12Å; L97-S99 VanDerWaalsContact C-N 3.32Å; L97-S99 PolarHBondContact O-N 2.89Å; S99-N102 WeakPolarHBondContact O-CB 3.35Å; S99-N102 PolarHBondContact O-N 3.32Å; S99-H103 PolarHBondContact O-N 3.17Å
100	I	97.8	Very high	97.2	Very high	39 Å²	39	28.6 Å²	28.6	20%	0.2	14%	0.136	C	C	.	.	H	α-helix	trans	-63	-47.4	175.8	-64.6	166.5	0	0	0	110.9	I12 A16 V96 L97 F98 N102 H103 A104	I12-I100 HydrophobicContact CG2-CG2 3.93Å; A16-I100 HydrophobicContact CB-CD1 3.51Å; A16-I100 HydrophobicContact CB-CG1 3.67Å; V96-I100 HydrophobicContact CG1-CD1 4.06Å; V96-I100 WeakPolarHBondContact O-CG1 3.5Å; V96-I100 PolarHBondContact O-N 2.92Å; L97-I100 PolarHBondContact O-N 3.04Å; F98-I100 PolarHBondContact O-N 3.26Å; I100-N102 VanDerWaalsContact C-N 3.28Å; I100-N102 PolarHBondContact O-N 3.4Å; I100-H103 PolarHBondContact O-N 3.31Å; I100-A104 PolarHBondContact O-N 3.22Å
101	F	98	Very high	97	Very high	99 Å²	99	29.2 Å²	29.2	43%	0.434	14%	0.138	S	C	.	.	H	α-helix	trans	-63.8	-35.7	176.6	-69.6	-38.1	0	0	0	112.5	L97 F98 A104 I105 L146	L97-F101 HydrophobicContact CD1-CD2 4.3Å; L97-F101 HydrophobicContact CD1-CE1 4.42Å; L97-F101 HydrophobicContact CD1-CE2 3.66Å; L97-F101 HydrophobicContact CD1-CZ 3.72Å; L97-F101 HydrophobicContact CD2-CE2 3.96Å; L97-F101 HydrophobicContact CG-CD2 4.02Å; L97-F101 HydrophobicContact CG-CE2 3.53Å; L97-F101 HydrophobicContact CG-CZ 4.13Å; L97-F101 WeakPolarHBondContact O-CD2 3.3Å; L97-F101 PolarHBondContact O-N 2.96Å; F98-F101 PolarHBondContact O-N 3.37Å; F101-A104 PolarHBondContact O-N 3.28Å; F101-I105 WeakPolarHBondContact O-CG2 3.43Å; F101-I105 PolarHBondContact O-N 2.83Å; F101-L146 HydrophobicContact CB-CD1 3.72Å; F101-L146 HydrophobicContact CB-CD2 3.94Å; F101-L146 HydrophobicContact CB-CG 4.5Å; F101-L146 HydrophobicContact CD2-CD2 4.25Å
102	N	98.4	Very high	96.8	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-60.6	-47.3	173.2	-82.6	-54.3	0	0	0	112	F98 S99 I100 A104 I105 I106 F131 H142 I145 L146	F98-N102 WeakPolarHBondContact O-CB 3.42Å; F98-N102 VanDerWaalsContact O-CG 3.27Å; F98-N102 PolarHBondContact O-N 3.02Å; F98-N102 PolarHBondContact O-ND2 3.39Å; S99-N102 WeakPolarHBondContact O-CB 3.35Å; S99-N102 PolarHBondContact O-N 3.32Å; I100-N102 VanDerWaalsContact C-N 3.28Å; I100-N102 PolarHBondContact O-N 3.4Å; N102-A104 VanDerWaalsContact C-N 3.3Å; N102-A104 PolarHBondContact O-N 2.76Å; N102-I105 VanDerWaalsContact O-CG2 3.26Å; N102-I105 WeakPolarHBondContact O-CG2 3.48Å; N102-I105 PolarHBondContact O-N 2.85Å; N102-I106 HydrophobicContact CB-CD1 4.5Å; N102-I106 VanDerWaalsContact O-CB 3.29Å; N102-I106 WeakPolarHBondContact O-CB 3.47Å; N102-I106 WeakPolarHBondContact O-CD1 3.17Å; N102-I106 WeakPolarHBondContact O-CG1 3.42Å; N102-I106 PolarHBondContact O-N 3.3Å; N102-F131 HydrophobicContact CB-CE1 4.01Å; N102-F131 HydrophobicContact CB-CE2 4.43Å; N102-F131 HydrophobicContact CB-CZ 3.39Å; N102-H142 PolarHBondContact ND2-O 3.21Å; N102-I145 WeakPolarHBondContact OD1-CG2 3.48Å; N102-L146 WeakPolarHBondContact OD1-CA 3.39Å; N102-L146 WeakPolarHBondContact OD1-CB 3.46Å; N102-L146 PolarHBondContact OD1-N 2.95Å
103	H	98.1	Very high	96.4	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-59.1	-45.6	175.2	-172.7	172.1	0	0	0	110.4	L11 T15 S99 I100 I105 I106 L107 A126	L11-H103 PolarHBondContact O-CE1 2.98Å; T15-H103 PolarHBondContact OG1-CE1 2.74Å; T15-H103 PolarHBondContact OG1-ND1 3.43Å; S99-H103 PolarHBondContact O-N 3.17Å; I100-H103 PolarHBondContact O-N 3.31Å; H103-I105 PolarHBondContact O-N 2.59Å; H103-I106 PolarHBondContact O-N 2.78Å; H103-L107 WeakPolarHBondContact O-CB 3.45Å; H103-L107 PolarHBondContact O-N 3.43Å; H103-A126 HydrophobicContact CB-CB 3.9Å
104	A	97.7	Very high	95.9	Very high	31 Å²	31	39.2 Å²	39.2	26%	0.256	19%	0.185	S	C	.	.	H	α-helix	trans	-59.3	-46	178.7	0	0	0	0	0	112.9	I12 I100 F101 N102 L107 R108	I12-A104 HydrophobicContact CD1-CB 4.26Å; I100-A104 PolarHBondContact O-N 3.22Å; F101-A104 PolarHBondContact O-N 3.28Å; N102-A104 VanDerWaalsContact C-N 3.3Å; N102-A104 PolarHBondContact O-N 2.76Å; A104-L107 PolarHBondContact O-N 3.48Å; A104-R108 VanDerWaalsContact O-CG 3.28Å; A104-R108 WeakPolarHBondContact O-CG 3.14Å; A104-R108 PolarHBondContact O-N 2.68Å; A104-R108 VanDerWaalsContact O-N 3.12Å
105	I	97.8	Very high	95.4	Very high	23 Å²	23	38.9 Å²	38.9	12%	0.118	18%	0.183	C	C	.	.	H	α-helix	trans	-71.2	-38.8	179.7	-167.2	61.4	0	0	0	112	F101 N102 H103 L107 R108 L109 L146 M149 Y153	F101-I105 WeakPolarHBondContact O-CG2 3.43Å; F101-I105 PolarHBondContact O-N 2.83Å; N102-I105 VanDerWaalsContact O-CG2 3.26Å; N102-I105 WeakPolarHBondContact O-CG2 3.48Å; N102-I105 PolarHBondContact O-N 2.85Å; H103-I105 PolarHBondContact O-N 2.59Å; I105-L107 VanDerWaalsContact C-N 3.31Å; I105-L107 PolarHBondContact O-N 3.01Å; I105-R108 WeakPolarHBondContact O-CB 3.09Å; I105-R108 PolarHBondContact O-N 3.4Å; I105-R108 VanDerWaalsContact O-N 3.13Å; I105-L109 WeakPolarHBondContact O-CG 3.05Å; I105-L109 PolarHBondContact O-N 2.81Å; I105-L146 HydrophobicContact CG2-CD1 4.04Å; I105-M149 HydrophobicContact CG1-CB 4.21Å; I105-M149 HydrophobicContact CG2-CB 3.68Å; I105-Y153 HydrophobicContact CD1-CD1 3.93Å; I105-Y153 HydrophobicContact CD1-CD2 4.04Å; I105-Y153 HydrophobicContact CD1-CG 3.62Å
106	I	97.5	Very high	94.8	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-60.5	-44	174.6	-70.6	163.8	0	0	0	109.8	N102 H103 R108 L109 V110 A122 I125 F131 M149 V421 I425	N102-I106 HydrophobicContact CB-CD1 4.5Å; N102-I106 VanDerWaalsContact O-CB 3.29Å; N102-I106 WeakPolarHBondContact O-CB 3.47Å; N102-I106 WeakPolarHBondContact O-CD1 3.17Å; N102-I106 WeakPolarHBondContact O-CG1 3.42Å; N102-I106 PolarHBondContact O-N 3.3Å; H103-I106 PolarHBondContact O-N 2.78Å; I106-R108 VanDerWaalsContact C-N 3.29Å; I106-R108 PolarHBondContact O-N 2.86Å; I106-L109 WeakPolarHBondContact O-CB 3.28Å; I106-L109 PolarHBondContact O-N 3.33Å; I106-V110 HydrophobicContact CG2-CG2 4.21Å; I106-V110 WeakPolarHBondContact O-CB 3.47Å; I106-V110 WeakPolarHBondContact O-CG2 3.47Å; I106-V110 PolarHBondContact O-N 2.57Å; I106-A122 HydrophobicContact CG2-CB 4.23Å; I106-I125 HydrophobicContact CD1-CG2 3.9Å; I106-I125 HydrophobicContact CG2-CB 4.26Å; I106-I125 HydrophobicContact CG2-CD1 3.87Å; I106-I125 HydrophobicContact CG2-CG2 4.29Å; I106-F131 HydrophobicContact CD1-CE2 4.49Å; I106-M149 HydrophobicContact CG1-CG 4.26Å; I106-V421 HydrophobicContact CD1-CG1 4.07Å; I106-V421 HydrophobicContact CG1-CG1 4.2Å; I106-I425 HydrophobicContact CG2-CD1 4.48Å
107	L	96.7	Very high	94.5	Very high	8 Å²	8	44.2 Å²	44.2	4%	0.042	21%	0.214	C	C	.	.	H	α-helix	trans	-60.7	-39.9	176	178.5	61.8	0	0	0	112.2	I12 H103 A104 I105 K111 N119 A122	I12-L107 HydrophobicContact CD1-CD2 4.11Å; H103-L107 WeakPolarHBondContact O-CB 3.45Å; H103-L107 PolarHBondContact O-N 3.43Å; A104-L107 PolarHBondContact O-N 3.48Å; I105-L107 VanDerWaalsContact C-N 3.31Å; I105-L107 PolarHBondContact O-N 3.01Å; L107-K111 HydrophobicContact CD1-CD 4.39Å; L107-K111 HydrophobicContact CD1-CG 4.46Å; L107-K111 HydrophobicContact CG-CD 4.36Å; L107-K111 WeakPolarHBondContact O-CB 3.4Å; L107-K111 VanDerWaalsContact O-CG 3.31Å; L107-K111 WeakPolarHBondContact O-CG 3.37Å; L107-K111 PolarHBondContact O-N 3.25Å; L107-N119 WeakPolarHBondContact CD1-OD1 3.42Å; L107-A122 HydrophobicContact CB-CB 3.81Å; L107-A122 HydrophobicContact CD1-CB 3.77Å; L107-A122 HydrophobicContact CG-CB 4.39Å
108	R	95.9	Very high	94.3	Very high	135 Å²	135	41.7 Å²	41.7	51%	0.509	20%	0.203	S	C	.	.	H	α-helix	trans	-65.9	-44	176.5	-69.2	-71.4	-176.9	173	3.9	111.6	A104 I105 I106 K111 I112 Y153	A104-R108 VanDerWaalsContact O-CG 3.28Å; A104-R108 WeakPolarHBondContact O-CG 3.14Å; A104-R108 PolarHBondContact O-N 2.68Å; A104-R108 VanDerWaalsContact O-N 3.12Å; I105-R108 WeakPolarHBondContact O-CB 3.09Å; I105-R108 PolarHBondContact O-N 3.4Å; I105-R108 VanDerWaalsContact O-N 3.13Å; I106-R108 VanDerWaalsContact C-N 3.29Å; I106-R108 PolarHBondContact O-N 2.86Å; R108-K111 PolarHBondContact O-N 3.25Å; R108-I112 WeakPolarHBondContact O-CG1 3.19Å; R108-I112 PolarHBondContact O-N 3.19Å; R108-Y153 HydrophobicContact CB-CD2 4.01Å; R108-Y153 HydrophobicContact CB-CE2 3.62Å
109	L	95.7	Very high	94.2	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-57	-52.5	174.4	-77.4	171.2	0	0	0	111.8	I105 I106 K111 I112 M113 M149 V152 Y153 L156 I425	I105-L109 WeakPolarHBondContact O-CG 3.05Å; I105-L109 PolarHBondContact O-N 2.81Å; I106-L109 WeakPolarHBondContact O-CB 3.28Å; I106-L109 PolarHBondContact O-N 3.33Å; L109-K111 VanDerWaalsContact C-N 3.27Å; L109-K111 PolarHBondContact O-N 3.11Å; L109-I112 PolarHBondContact O-N 3.15Å; L109-I112 VanDerWaalsContact O-N 3.14Å; L109-M113 WeakPolarHBondContact O-CG 3.42Å; L109-M113 PolarHBondContact O-N 2.98Å; L109-M149 HydrophobicContact CD1-CB 3.82Å; L109-M149 HydrophobicContact CD1-CG 4.26Å; L109-M149 HydrophobicContact CD1-SD 3.97Å; L109-V152 HydrophobicContact CD2-CB 4.24Å; L109-V152 HydrophobicContact CD2-CG1 3.76Å; L109-Y153 VanDerWaalsContact CD2-CA 3.43Å; L109-Y153 HydrophobicContact CD2-CD2 4.22Å; L109-Y153 HydrophobicContact CD2-CG 4.46Å; L109-Y153 HydrophobicContact CG-CD2 4.44Å; L109-L156 HydrophobicContact CD2-CD1 3.73Å; L109-I425 HydrophobicContact CB-CD1 4.34Å; L109-I425 HydrophobicContact CD1-CD1 3.85Å
110	V	93.8	Very high	94	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-61.2	-36.4	-178.9	174.4	0	0	0	0	111.5	I106 K114 C115 P118 L121 I425	I106-V110 HydrophobicContact CG2-CG2 4.21Å; I106-V110 WeakPolarHBondContact O-CB 3.47Å; I106-V110 WeakPolarHBondContact O-CG2 3.47Å; I106-V110 PolarHBondContact O-N 2.57Å; V110-K114 PolarHBondContact O-N 2.94Å; V110-C115 HydrophobicContact CG1-CB 3.56Å; V110-C115 PolarHBondContact O-N 2.95Å; V110-C115 VanDerWaalsContact O-N 3.15Å; V110-P118 HydrophobicContact CG1-CB 3.67Å; V110-L121 HydrophobicContact CG1-CB 4.18Å; V110-L121 HydrophobicContact CG1-CD2 3.81Å; V110-L121 HydrophobicContact CG1-CG 4.2Å; V110-L121 HydrophobicContact CG2-CD2 4.21Å; V110-L121 HydrophobicContact CG2-CG 4.29Å; V110-I425 HydrophobicContact CG2-CG1 4.24Å
111	K	93.2	Very high	93.9	Very high	74 Å²	74	41.5 Å²	41.5	32%	0.322	20%	0.203	S	C	.	.	H	α-helix	trans	-68.1	-43.3	174.1	-76.9	177.7	178.6	173	0	112.6	S8 L107 R108 L109 M113 K114 P118	S8-K111 PolarHBondContact OG-NZ 3.09Å; L107-K111 HydrophobicContact CD1-CD 4.39Å; L107-K111 HydrophobicContact CD1-CG 4.46Å; L107-K111 HydrophobicContact CG-CD 4.36Å; L107-K111 WeakPolarHBondContact O-CB 3.4Å; L107-K111 VanDerWaalsContact O-CG 3.31Å; L107-K111 WeakPolarHBondContact O-CG 3.37Å; L107-K111 PolarHBondContact O-N 3.25Å; R108-K111 PolarHBondContact O-N 3.25Å; L109-K111 VanDerWaalsContact C-N 3.27Å; L109-K111 PolarHBondContact O-N 3.11Å; K111-M113 VanDerWaalsContact C-N 3.3Å; K111-M113 PolarHBondContact O-N 3.2Å; K111-K114 PolarHBondContact O-N 3.36Å; K111-K114 VanDerWaalsContact O-N 3.08Å; K111-P118 HydrophobicContact CG-CB 3.79Å; K111-P118 HydrophobicContact CG-CG 4.07Å
112	I	92.5	Very high	93.8	Very high	57 Å²	57	36.8 Å²	36.8	29%	0.292	18%	0.182	S	C	.	.	H	α-helix	trans	-62.4	-40.8	176.7	-74.6	-176.9	0	0	0	111	R108 L109 K114 Y153 L156 L157	R108-I112 WeakPolarHBondContact O-CG1 3.19Å; R108-I112 PolarHBondContact O-N 3.19Å; L109-I112 PolarHBondContact O-N 3.15Å; L109-I112 VanDerWaalsContact O-N 3.14Å; I112-K114 PolarHBondContact O-N 2.88Å; I112-Y153 HydrophobicContact CD1-CD2 3.61Å; I112-Y153 HydrophobicContact CD1-CE2 3.16Å; I112-Y153 HydrophobicContact CG1-CE2 4.2Å; I112-L156 HydrophobicContact CG2-CB 4.13Å; I112-L156 HydrophobicContact CG2-CD1 4.27Å; I112-L157 HydrophobicContact CD1-CD1 4.4Å; I112-L157 HydrophobicContact CD1-CD2 3.6Å; I112-L157 HydrophobicContact CD1-CG 3.9Å
113	M	89.2	Confident	93.7	Very high	47 Å²	47	37.1 Å²	37.1	23%	0.232	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	1.5	177.1	-65.6	-173.4	69.3	0	0	113.6	L109 K111 C115 L156 I425 F426	L109-M113 WeakPolarHBondContact O-CG 3.42Å; L109-M113 PolarHBondContact O-N 2.98Å; K111-M113 VanDerWaalsContact C-N 3.3Å; K111-M113 PolarHBondContact O-N 3.2Å; M113-C115 VanDerWaalsContact C-N 3.26Å; M113-C115 PolarHBondContact O-N 3.48Å; M113-L156 HydrophobicContact CG-CD1 4.04Å; M113-L156 HydrophobicContact SD-CD1 4.24Å; M113-I425 HydrophobicContact CE-CG2 4.19Å; M113-I425 HydrophobicContact SD-CG2 3.19Å; M113-I425 WeakPolarHBondContact SD-CG2 3.38Å; M113-F426 HydrophobicContact CE-CD1 3.79Å; M113-F426 HydrophobicContact CE-CE1 4.05Å
114	K	87.1	Confident	93.6	Very high	179 Å²	179	37.1 Å²	37.1	78%	0.778	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.1	38.8	176.6	-56.2	-178.7	-177.8	178.1	0	112.9	V110 K111 I112	V110-K114 PolarHBondContact O-N 2.94Å; K111-K114 PolarHBondContact O-N 3.36Å; K111-K114 VanDerWaalsContact O-N 3.08Å; I112-K114 PolarHBondContact O-N 2.88Å
115	C	86.9	Confident	93.6	Very high	10 Å²	10	35.6 Å²	35.6	7%	0.068	17%	0.172	C	C	.	.			trans	-69.5	147.1	176.2	-59.4	0	0	0	0	111.6	V110 M113 P118 L121	V110-C115 HydrophobicContact CG1-CB 3.56Å; V110-C115 PolarHBondContact O-N 2.95Å; V110-C115 VanDerWaalsContact O-N 3.15Å; M113-C115 VanDerWaalsContact C-N 3.26Å; M113-C115 PolarHBondContact O-N 3.48Å; C115-P118 WeakPolarHBondContact O-CD 3.41Å; C115-L121 HydrophobicContact CB-CD2 4Å
116	N	85.1	Confident	93.5	Very high	73 Å²	73	34.5 Å²	34.5	39%	0.39	17%	0.166	S	C	.	.	S	Bend	trans	-62.5	138.9	171.4	-73.9	-5.2	0	0	0	110.2	S429 H430	N116-S429 WeakPolarHBondContact CB-O 3.5Å; N116-S429 PolarHBondContact N-O 2.99Å; N116-S429 PolarHBondContact OD1-O 3Å; N116-H430 WeakPolarHBondContact ND2-CA 3.29Å
117	S	90.9	Very high	93.5	Very high	43 Å²	43	34.6 Å²	34.6	30%	0.301	17%	0.166	S	C	.	.	S	Bend	trans	51.2	54.7	177.1	-49.1	0	0	0	0	113	N119 I120 L121 Y433	S117-N119 PolarHBondContact O-N 3.17Å; S117-N119 VanDerWaalsContact O-N 3.13Å; S117-I120 PolarHBondContact O-N 3.27Å; S117-L121 PolarHBondContact O-N 2.89Å; S117-Y433 WeakPolarHBondContact OG-CB 3.22Å
118	P	93	Very high	93.5	Very high	32 Å²	32	34.3 Å²	34.3	21%	0.208	17%	0.165	C	C	.	.	H	α-helix	trans	-59.5	-35	-167.2	24.9	-35.5	0	0	0	113	V110 K111 C115 A122	V110-P118 HydrophobicContact CG1-CB 3.67Å; K111-P118 HydrophobicContact CG-CB 3.79Å; K111-P118 HydrophobicContact CG-CG 4.07Å; C115-P118 WeakPolarHBondContact O-CD 3.41Å; P118-A122 WeakPolarHBondContact O-CB 3.49Å; P118-A122 PolarHBondContact O-N 2.9Å
119	N	94.5	Very high	93.6	Very high	12 Å²	12	28 Å²	28	6%	0.064	14%	0.142	C	C	.	.	H	α-helix	trans	-59.7	-44.6	175.1	-72.1	-35.7	0	0	0	112	N4 V7 S8 L11 L107 S117 I123	N4-N119 PolarHBondContact O-ND2 3.48Å; V7-N119 HydrophobicContact CG1-CB 4.26Å; S8-N119 PolarHBondContact OG-OD1 3.33Å; L11-N119 HydrophobicContact CD1-CB 3.86Å; L11-N119 WeakPolarHBondContact CD1-O 3.32Å; L107-N119 WeakPolarHBondContact CD1-OD1 3.42Å; S117-N119 PolarHBondContact O-N 3.17Å; S117-N119 VanDerWaalsContact O-N 3.13Å; N119-I123 WeakPolarHBondContact O-CG2 3.49Å; N119-I123 PolarHBondContact O-N 3.37Å
120	I	94.5	Very high	93.7	Very high	46 Å²	46	28.1 Å²	28.1	24%	0.236	14%	0.142	C	C	.	.	H	α-helix	trans	-76.9	-36.3	-175.7	-55.2	173.9	0	0	0	110.4	S117 I123 A124 Y433 L436	S117-I120 PolarHBondContact O-N 3.27Å; I120-I123 WeakPolarHBondContact O-CG2 3.37Å; I120-A124 VanDerWaalsContact O-CB 3.29Å; I120-A124 WeakPolarHBondContact O-CB 3.37Å; I120-A124 PolarHBondContact O-N 3.18Å; I120-Y433 HydrophobicContact CD1-CD2 4.18Å; I120-Y433 HydrophobicContact CD1-CG 4.36Å; I120-L436 HydrophobicContact CB-CB 4.38Å; I120-L436 HydrophobicContact CB-CD1 4.38Å; I120-L436 HydrophobicContact CG2-CB 3.5Å; I120-L436 VanDerWaalsContact CG2-CB 3.5Å; I120-L436 HydrophobicContact CG2-CD1 4.37Å
121	L	94.9	Very high	93.8	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-65.7	-40.7	173.9	178.2	56.2	0	0	0	111.6	V110 C115 S117 A124 I125 L436	V110-L121 HydrophobicContact CG1-CB 4.18Å; V110-L121 HydrophobicContact CG1-CD2 3.81Å; V110-L121 HydrophobicContact CG1-CG 4.2Å; V110-L121 HydrophobicContact CG2-CD2 4.21Å; V110-L121 HydrophobicContact CG2-CG 4.29Å; C115-L121 HydrophobicContact CB-CD2 4Å; S117-L121 PolarHBondContact O-N 2.89Å; L121-A124 PolarHBondContact O-N 2.98Å; L121-I125 HydrophobicContact CD1-CD1 4.11Å; L121-I125 HydrophobicContact CD1-CG1 4.26Å; L121-I125 HydrophobicContact CG-CD1 4.2Å; L121-I125 WeakPolarHBondContact O-CG1 3.48Å; L121-I125 PolarHBondContact O-N 3.05Å; L121-L436 HydrophobicContact CB-CD1 3.96Å; L121-L436 HydrophobicContact CD1-CD2 3.87Å
122	A	96.3	Very high	94	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-63.1	-45.6	178.3	0	0	0	0	0	112.2	I106 L107 P118 I125 A126	I106-A122 HydrophobicContact CG2-CB 4.23Å; L107-A122 HydrophobicContact CB-CB 3.81Å; L107-A122 HydrophobicContact CD1-CB 3.77Å; L107-A122 HydrophobicContact CG-CB 4.39Å; P118-A122 WeakPolarHBondContact O-CB 3.49Å; P118-A122 PolarHBondContact O-N 2.9Å; A122-I125 PolarHBondContact O-N 3.34Å; A122-A126 WeakPolarHBondContact O-CB 3.5Å; A122-A126 PolarHBondContact O-N 2.87Å
123	I	96.6	Very high	94.2	Very high	8 Å²	8	22.1 Å²	22.1	4%	0.041	11%	0.114	C	C	.	.	H	α-helix	trans	-68.7	-33	174.3	-173.8	65.2	0	0	0	111.9	L11 F14 T15 N119 I120 I125 A126 S127 V440	L11-I123 HydrophobicContact CD1-CB 4.42Å; L11-I123 HydrophobicContact CD1-CG2 4.12Å; L11-I123 HydrophobicContact CD2-CG2 4.45Å; F14-I123 HydrophobicContact CD1-CD1 4.15Å; T15-I123 WeakPolarHBondContact OG1-CD1 3.48Å; N119-I123 WeakPolarHBondContact O-CG2 3.49Å; N119-I123 PolarHBondContact O-N 3.37Å; I120-I123 WeakPolarHBondContact O-CG2 3.37Å; I123-I125 VanDerWaalsContact C-N 3.28Å; I123-I125 PolarHBondContact O-N 2.82Å; I123-A126 PolarHBondContact O-N 3.19Å; I123-S127 WeakPolarHBondContact O-CA 3.41Å; I123-S127 WeakPolarHBondContact O-CB 3.37Å; I123-S127 PolarHBondContact O-N 3.45Å; I123-S127 PolarHBondContact O-OG 2.93Å; I123-V440 HydrophobicContact CG1-CG2 4.49Å; I123-V440 HydrophobicContact CG2-CG2 3.94Å
124	A	96	Very high	94.6	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-59.8	-40.7	174	0	0	0	0	0	111.6	I120 L121 S127 L436 E439 V440 N443	I120-A124 VanDerWaalsContact O-CB 3.29Å; I120-A124 WeakPolarHBondContact O-CB 3.37Å; I120-A124 PolarHBondContact O-N 3.18Å; L121-A124 PolarHBondContact O-N 2.98Å; A124-S127 PolarHBondContact O-OG 3.37Å; A124-L436 HydrophobicContact CB-CD2 4.48Å; A124-E439 HydrophobicContact CB-CG 4.48Å; A124-V440 HydrophobicContact CB-CG2 3.92Å; A124-N443 PolarHBondContact O-ND2 3.4Å; A124-N443 VanDerWaalsContact O-ND2 3.08Å
125	I	96.8	Very high	95.1	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-71.2	-48.6	174.4	-62.1	167.2	0	0	0	111.1	I106 L121 A122 I123 S127 E128 V421 R424 I425	I106-I125 HydrophobicContact CD1-CG2 3.9Å; I106-I125 HydrophobicContact CG2-CB 4.26Å; I106-I125 HydrophobicContact CG2-CD1 3.87Å; I106-I125 HydrophobicContact CG2-CG2 4.29Å; L121-I125 HydrophobicContact CD1-CD1 4.11Å; L121-I125 HydrophobicContact CD1-CG1 4.26Å; L121-I125 HydrophobicContact CG-CD1 4.2Å; L121-I125 WeakPolarHBondContact O-CG1 3.48Å; L121-I125 PolarHBondContact O-N 3.05Å; A122-I125 PolarHBondContact O-N 3.34Å; I123-I125 VanDerWaalsContact C-N 3.28Å; I123-I125 PolarHBondContact O-N 2.82Å; I125-S127 PolarHBondContact O-N 3Å; I125-E128 WeakPolarHBondContact O-CB 3.4Å; I125-E128 PolarHBondContact O-N 3.31Å; I125-E128 VanDerWaalsContact O-N 3.14Å; I125-V421 HydrophobicContact CG2-CB 4.28Å; I125-V421 HydrophobicContact CG2-CG1 4.05Å; I125-V421 HydrophobicContact CG2-CG2 3.77Å; I125-R424 HydrophobicContact CD1-CB 3.68Å; I125-R424 HydrophobicContact CG1-CB 3.73Å; I125-R424 HydrophobicContact CG1-CG 4.17Å; I125-I425 HydrophobicContact CD1-CG1 3.93Å
126	A	97.2	Very high	95.6	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-70.1	-17.7	-177.5	0	0	0	0	0	113.5	T15 H103 A122 I123 F131 I132	T15-A126 HydrophobicContact CG2-CB 4.45Å; H103-A126 HydrophobicContact CB-CB 3.9Å; A122-A126 WeakPolarHBondContact O-CB 3.5Å; A122-A126 PolarHBondContact O-N 2.87Å; I123-A126 PolarHBondContact O-N 3.19Å; A126-F131 WeakPolarHBondContact O-CD1 3.37Å; A126-I132 WeakPolarHBondContact O-CG1 3.5Å
127	S	96.8	Very high	96.2	Very high	1 Å²	1	7.4 Å²	7.4	1%	0.007	4%	0.044	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-5.8	174.6	61.4	0	0	0	0	113.6	I123 A124 I125 N443	I123-S127 WeakPolarHBondContact O-CA 3.41Å; I123-S127 WeakPolarHBondContact O-CB 3.37Å; I123-S127 PolarHBondContact O-N 3.45Å; I123-S127 PolarHBondContact O-OG 2.93Å; A124-S127 PolarHBondContact O-OG 3.37Å; I125-S127 PolarHBondContact O-N 3Å; S127-N443 WeakPolarHBondContact O-CB 3.21Å; S127-N443 PolarHBondContact OG-ND2 3.03Å
128	E	97.4	Very high	96.5	Very high	2 Å²	2	5.4 Å²	5.4	1%	0.009	3%	0.03	C	C	.	.			trans	-50	136.2	179.7	-171.9	-71	134.8	0	0	110.4	I125 L130 F131 I132 L417 F420	I125-E128 WeakPolarHBondContact O-CB 3.4Å; I125-E128 PolarHBondContact O-N 3.31Å; I125-E128 VanDerWaalsContact O-N 3.14Å; E128-L130 VanDerWaalsContact CD-N 3.31Å; E128-L130 PolarHBondContact O-N 2.86Å; E128-L130 WeakPolarHBondContact OE1-CD1 3.46Å; E128-L130 PolarHBondContact OE1-N 3.37Å; E128-L130 VanDerWaalsContact OE1-N 3.13Å; E128-L130 WeakPolarHBondContact OE2-CA 3.45Å; E128-L130 VanDerWaalsContact OE2-CB 3.23Å; E128-L130 WeakPolarHBondContact OE2-CB 3.45Å; E128-L130 PolarHBondContact OE2-N 3.43Å; E128-F131 HydrophobicContact CB-CB 4.07Å; E128-F131 WeakPolarHBondContact O-CA 3.26Å; E128-F131 WeakPolarHBondContact O-CB 3.49Å; E128-F131 PolarHBondContact O-N 2.87Å; E128-F131 PolarHBondContact OE2-N 2.88Å; E128-I132 PolarHBondContact O-N 2.94Å; E128-L417 WeakPolarHBondContact OE2-CD2 3.46Å; E128-F420 HydrophobicContact CB-CE1 4.04Å; E128-F420 HydrophobicContact CG-CD1 4.08Å; E128-F420 HydrophobicContact CG-CE1 3.56Å; E128-F420 HydrophobicContact CG-CZ 4.1Å
129	P	97.5	Very high	96.7	Very high	4 Å²	4	4 Å²	4	3%	0.026	2%	0.021	C	C	.	.	H	α-helix	trans	-55.7	-41.6	-168.5	-30.9	36.2	0	0	0	116.6	F131 F133 N443 I446 V447 W473	P129-F131 VanDerWaalsContact C-N 3.34Å; P129-F133 WeakPolarHBondContact O-CB 3.19Å; P129-F133 PolarHBondContact O-N 3.38Å; P129-N443 HydrophobicContact CG-CB 4.24Å; P129-I446 HydrophobicContact CB-CB 4.13Å; P129-I446 HydrophobicContact CB-CG2 3.63Å; P129-I446 HydrophobicContact CG-CB 3.61Å; P129-I446 HydrophobicContact CG-CD1 4.07Å; P129-I446 HydrophobicContact CG-CG1 4.46Å; P129-I446 HydrophobicContact CG-CG2 3.57Å; P129-V447 HydrophobicContact CB-CG2 4.03Å; P129-V447 HydrophobicContact CG-CG2 4.42Å; P129-W473 HydrophobicContact CB-CZ2 3.89Å
130	L	96.9	Very high	96.8	Very high	1 Å²	1	3.5 Å²	3.5	1%	0.005	2%	0.018	C	C	.	.	H	α-helix	trans	-68.2	-39.3	176.3	-63.3	140.5	0	0	0	110.2	E128 I132 F133 F134 F278 L413 L417 W473	E128-L130 VanDerWaalsContact CD-N 3.31Å; E128-L130 PolarHBondContact O-N 2.86Å; E128-L130 WeakPolarHBondContact OE1-CD1 3.46Å; E128-L130 PolarHBondContact OE1-N 3.37Å; E128-L130 VanDerWaalsContact OE1-N 3.13Å; E128-L130 WeakPolarHBondContact OE2-CA 3.45Å; E128-L130 VanDerWaalsContact OE2-CB 3.23Å; E128-L130 WeakPolarHBondContact OE2-CB 3.45Å; E128-L130 PolarHBondContact OE2-N 3.43Å; L130-I132 PolarHBondContact O-N 3.25Å; L130-F133 PolarHBondContact O-N 2.96Å; L130-F134 HydrophobicContact CB-CD2 4.27Å; L130-F134 HydrophobicContact CD2-CD2 4.34Å; L130-F134 HydrophobicContact CD2-CE2 3.82Å; L130-F134 WeakPolarHBondContact O-CB 3.27Å; L130-F134 WeakPolarHBondContact O-CD2 3.46Å; L130-F134 PolarHBondContact O-N 3.34Å; L130-F278 HydrophobicContact CD1-CE2 3.45Å; L130-F278 VanDerWaalsContact CD1-CE2 3.45Å; L130-F278 HydrophobicContact CD1-CZ 3.5Å; L130-F278 VanDerWaalsContact CD1-CZ 3.5Å; L130-L413 HydrophobicContact CD1-CB 3.64Å; L130-L413 HydrophobicContact CD2-CB 3.71Å; L130-L413 HydrophobicContact CG-CB 4.35Å; L130-L417 HydrophobicContact CB-CD1 4.37Å; L130-L417 HydrophobicContact CB-CD2 3.7Å; L130-L417 HydrophobicContact CB-CG 4.22Å; L130-W473 HydrophobicContact CD2-CB 3.37Å; L130-W473 HydrophobicContact CD2-CD2 3.77Å; L130-W473 HydrophobicContact CD2-CE3 4.19Å; L130-W473 HydrophobicContact CD2-CG 3.41Å; L130-W473 VanDerWaalsContact CD2-CG 3.41Å; L130-W473 HydrophobicContact CG-CD2 4.23Å; L130-W473 HydrophobicContact CG-CG 4.21Å
131	F	96.5	Very high	96.9	Very high	1 Å²	1	1.7 Å²	1.7	0%	0.004	1%	0.009	C	C	.	.	H	α-helix	trans	-56.9	-48.9	176.6	-152.4	-77.4	0	0	0	112.5	N102 I106 A126 E128 P129 S135 H142 I145 L417 V421	N102-F131 HydrophobicContact CB-CE1 4.01Å; N102-F131 HydrophobicContact CB-CE2 4.43Å; N102-F131 HydrophobicContact CB-CZ 3.39Å; I106-F131 HydrophobicContact CD1-CE2 4.49Å; A126-F131 WeakPolarHBondContact O-CD1 3.37Å; E128-F131 HydrophobicContact CB-CB 4.07Å; E128-F131 WeakPolarHBondContact O-CA 3.26Å; E128-F131 WeakPolarHBondContact O-CB 3.49Å; E128-F131 PolarHBondContact O-N 2.87Å; E128-F131 PolarHBondContact OE2-N 2.88Å; P129-F131 VanDerWaalsContact C-N 3.34Å; F131-S135 PolarHBondContact O-N 3.5Å; F131-H142 AromaticContact CD1-CE1 3.64Å; F131-H142 AromaticContact CE1-CE1 3.45Å; F131-H142 VanDerWaalsContact CE1-CE1 3.45Å; F131-H142 WeakPolarHBondContact CE1-CE1 3.36Å; F131-H142 AromaticContact CE1-ND1 3.72Å; F131-H142 AromaticContact CZ-CE1 3.8Å; F131-H142 AromaticContact CZ-ND1 3.69Å; F131-H142 PolarHBondContact O-CE1 2.99Å; F131-H142 PolarHBondContact O-NE2 3.09Å; F131-I145 HydrophobicContact CD2-CD1 4.38Å; F131-I145 HydrophobicContact CE2-CD1 3.89Å; F131-I145 HydrophobicContact CE2-CG2 4.17Å; F131-L417 HydrophobicContact CB-CD2 4.48Å; F131-L417 HydrophobicContact CD2-CD2 4.4Å; F131-V421 HydrophobicContact CE2-CG2 4.48Å
132	I	97	Very high	97.1	Very high	4 Å²	4	1.8 Å²	1.8	2%	0.021	1%	0.009	C	C	.	.	H	α-helix	trans	-72.6	-44.6	177.5	-70.4	179	0	0	0	110.7	V18 L22 A126 E128 L130 F134 S135 L444 V447	V18-I132 HydrophobicContact CG1-CD1 4.23Å; V18-I132 HydrophobicContact CG1-CG2 4.04Å; L22-I132 HydrophobicContact CD2-CG2 3.41Å; L22-I132 VanDerWaalsContact CD2-CG2 3.41Å; A126-I132 WeakPolarHBondContact O-CG1 3.5Å; E128-I132 PolarHBondContact O-N 2.94Å; L130-I132 PolarHBondContact O-N 3.25Å; I132-F134 PolarHBondContact O-N 3.19Å; I132-S135 WeakPolarHBondContact O-CB 3.25Å; I132-S135 PolarHBondContact O-N 3.2Å; I132-S135 VanDerWaalsContact O-N 3.1Å; I132-S135 PolarHBondContact O-OG 3.41Å; I132-L444 HydrophobicContact CD1-CD2 4.12Å; I132-V447 HydrophobicContact CB-CG1 4.29Å; I132-V447 HydrophobicContact CB-CG2 3.9Å; I132-V447 HydrophobicContact CD1-CG2 4.19Å; I132-V447 HydrophobicContact CG2-CG1 3.67Å; I132-V447 HydrophobicContact CG2-CG2 4.21Å
133	F	97.6	Very high	97.2	Very high	0 Å²	0	1.8 Å²	1.8	0%	0	1%	0.009	C	C	.	.	H	α-helix	trans	-60.7	-46.8	-175.5	-172	-80.2	0	0	0	112.1	F26 P129 L130 S135 A136 L137 A450 F454 M472 W473	F26-F133 HydrophobicContact CE1-CE2 4.2Å; F26-F133 HydrophobicContact CE1-CZ 4.06Å; F26-F133 AromaticContact CZ-CD2 3.94Å; F26-F133 HydrophobicContact CZ-CD2 3.94Å; F26-F133 HydrophobicContact CZ-CE1 4.43Å; F26-F133 AromaticContact CZ-CE2 3.6Å; F26-F133 HydrophobicContact CZ-CE2 3.6Å; F26-F133 HydrophobicContact CZ-CG 4.5Å; F26-F133 AromaticContact CZ-CZ 3.87Å; F26-F133 HydrophobicContact CZ-CZ 3.87Å; P129-F133 WeakPolarHBondContact O-CB 3.19Å; P129-F133 PolarHBondContact O-N 3.38Å; L130-F133 PolarHBondContact O-N 2.96Å; F133-S135 PolarHBondContact O-N 3.08Å; F133-A136 PolarHBondContact O-N 3.4Å; F133-L137 HydrophobicContact CD1-CD1 4.41Å; F133-L137 HydrophobicContact CE1-CD1 3.95Å; F133-A450 HydrophobicContact CD2-CB 4.06Å; F133-A450 HydrophobicContact CE2-CB 4.21Å; F133-F454 HydrophobicContact CE2-CB 4.19Å; F133-F454 HydrophobicContact CZ-CB 4.24Å; F133-F454 AromaticContact CZ-CD2 3.74Å; F133-F454 HydrophobicContact CZ-CD2 3.74Å; F133-F454 HydrophobicContact CZ-CE2 4.4Å; F133-F454 HydrophobicContact CZ-CG 4.23Å; F133-M472 HydrophobicContact CE1-CB 3.76Å; F133-M472 HydrophobicContact CZ-CB 3.73Å; F133-W473 AromaticContact CD1-CD1 3.5Å; F133-W473 AromaticContact CD2-CD1 3.79Å; F133-W473 AromaticContact CD2-NE1 3.62Å; F133-W473 AromaticContact CG-CD1 3.36Å; F133-W473 AromaticContact CG-NE1 3.53Å
134	F	97.1	Very high	97.2	Very high	1 Å²	1	1.5 Å²	1.5	0%	0.004	1%	0.008	C	C	.	.	H	α-helix	trans	-74.2	-7.7	178.9	-77.2	-74.8	0	0	0	113.8	L130 I132 A136 L137 Y139 H142 R414 M472 W473	L130-F134 HydrophobicContact CB-CD2 4.27Å; L130-F134 HydrophobicContact CD2-CD2 4.34Å; L130-F134 HydrophobicContact CD2-CE2 3.82Å; L130-F134 WeakPolarHBondContact O-CB 3.27Å; L130-F134 WeakPolarHBondContact O-CD2 3.46Å; L130-F134 PolarHBondContact O-N 3.34Å; I132-F134 PolarHBondContact O-N 3.19Å; F134-A136 PolarHBondContact O-N 2.91Å; F134-L137 HydrophobicContact CD1-CD1 4.19Å; F134-L137 HydrophobicContact CE1-CD1 4.26Å; F134-L137 PolarHBondContact O-N 3.42Å; F134-Y139 HydrophobicContact CD1-CD1 4.41Å; F134-Y139 HydrophobicContact CD1-CG 4.25Å; F134-Y139 HydrophobicContact CE1-CD1 4.18Å; F134-Y139 HydrophobicContact CE1-CE1 4.25Å; F134-Y139 HydrophobicContact CE1-CG 4.42Å; F134-H142 VanDerWaalsContact C-NE2 3.29Å; F134-H142 PolarHBondContact O-CD2 3.27Å; F134-R414 HydrophobicContact CD2-CB 4.41Å; F134-R414 HydrophobicContact CE2-CB 3.83Å; F134-R414 HydrophobicContact CZ-CB 4.13Å; F134-M472 HydrophobicContact CE1-CE 3.61Å; F134-M472 HydrophobicContact CZ-CE 3.8Å; F134-W473 HydrophobicContact CE2-CB 3.82Å; F134-W473 HydrophobicContact CE2-CG 4.47Å; F134-W473 HydrophobicContact CZ-CB 4.13Å
135	S	97	Very high	97.3	Very high	0 Å²	0	1.5 Å²	1.5	0%	0	1%	0.008	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-18.3	170.2	76.3	0	0	0	0	112.4	S19 T23 S95 V96 F131 I132 F133 H142	S19-S135 WeakPolarHBondContact CB-OG 3.46Å; S19-S135 WeakPolarHBondContact OG-CB 3.23Å; S19-S135 PolarHBondContact OG-OG 3.37Å; T23-S135 PolarHBondContact OG1-O 3.26Å; S95-S135 WeakPolarHBondContact CB-O 3Å; V96-S135 WeakPolarHBondContact CG2-O 3.43Å; V96-S135 PolarHBondContact N-O 3.48Å; F131-S135 PolarHBondContact O-N 3.5Å; I132-S135 WeakPolarHBondContact O-CB 3.25Å; I132-S135 PolarHBondContact O-N 3.2Å; I132-S135 VanDerWaalsContact O-N 3.1Å; I132-S135 PolarHBondContact O-OG 3.41Å; F133-S135 PolarHBondContact O-N 3.08Å; S135-H142 WeakPolarHBondContact CA-NE2 3.48Å; S135-H142 WeakPolarHBondContact CB-NE2 3.36Å; S135-H142 PolarHBondContact N-NE2 2.78Å
136	A	97.5	Very high	97.4	Very high	0 Å²	0	2.6 Å²	2.6	0%	0	1%	0.014	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	1.2	177.5	0	0	0	0	0	115.2	L22 T23 F26 R92 F133 F134	L22-A136 HydrophobicContact CD2-CB 4.5Å; L22-A136 HydrophobicContact CG-CB 4.14Å; T23-A136 VanDerWaalsContact OG1-CA 3.22Å; T23-A136 WeakPolarHBondContact OG1-CA 3.29Å; F26-A136 HydrophobicContact CB-CB 4.15Å; F26-A136 HydrophobicContact CD2-CB 3.2Å; F26-A136 HydrophobicContact CE2-CB 3.67Å; F26-A136 HydrophobicContact CG-CB 3.86Å; R92-A136 VanDerWaalsContact CD-O 3.25Å; R92-A136 WeakPolarHBondContact CD-O 3.45Å; F133-A136 PolarHBondContact O-N 3.4Å; F134-A136 PolarHBondContact O-N 2.91Å
137	L	97.6	Very high	97.5	Very high	0 Å²	0	4.2 Å²	4.2	0%	0	2%	0.021	C	C	.	.	S	Bend	trans	-124.8	148.6	177.2	-64.1	171.8	0	0	0	110.3	S95 F133 F134 Y139 M472	S95-L137 VanDerWaalsContact CB-O 3.32Å; S95-L137 WeakPolarHBondContact CB-O 3.45Å; S95-L137 PolarHBondContact OG-O 3.4Å; F133-L137 HydrophobicContact CD1-CD1 4.41Å; F133-L137 HydrophobicContact CE1-CD1 3.95Å; F134-L137 HydrophobicContact CD1-CD1 4.19Å; F134-L137 HydrophobicContact CE1-CD1 4.26Å; F134-L137 PolarHBondContact O-N 3.42Å; L137-Y139 HydrophobicContact CB-CD2 3.57Å; L137-Y139 HydrophobicContact CB-CE2 3.82Å; L137-Y139 HydrophobicContact CD1-CE2 4.14Å; L137-Y139 HydrophobicContact CG-CE2 4.48Å; L137-Y139 PolarHBondContact O-N 3.04Å; L137-Y139 VanDerWaalsContact O-N 3.11Å; L137-M472 HydrophobicContact CD1-CE 4.09Å; L137-M472 HydrophobicContact CD1-SD 4.37Å
138	Y	97.9	Very high	97.6	Very high	0 Å²	0	4.1 Å²	4.1	0%	0	2%	0.02	C	C	.	.			trans	-87.7	75.9	-179.9	-174.3	-113.9	0	0	0	111.8	E37 H40 V41 T44 L65 Y69 L91 S94	E37-Y138 WeakPolarHBondContact OE1-CB 3.28Å; E37-Y138 PolarHBondContact OE1-N 2.95Å; H40-Y138 HydrophobicContact CB-CD1 3.91Å; H40-Y138 HydrophobicContact CB-CE1 4.08Å; H40-Y138 PolarHBondContact CD2-O 2.84Å; V41-Y138 HydrophobicContact CG2-CD1 4.1Å; T44-Y138 WeakPolarHBondContact OG1-CE1 3.49Å; T44-Y138 PolarHBondContact OG1-OH 3Å; L65-Y138 HydrophobicContact CD1-CE2 3.85Å; L65-Y138 HydrophobicContact CD2-CD1 4.41Å; L65-Y138 HydrophobicContact CD2-CE1 4.01Å; L65-Y138 HydrophobicContact CD2-CE2 4.11Å; L65-Y138 HydrophobicContact CG-CE1 4.41Å; L65-Y138 HydrophobicContact CG-CE2 4.02Å; Y69-Y138 WeakPolarHBondContact CB-OH 3.29Å; Y69-Y138 HydrophobicContact CD2-CE2 4.27Å; L91-Y138 HydrophobicContact CB-CD1 4.1Å; L91-Y138 HydrophobicContact CB-CD2 3.93Å; L91-Y138 HydrophobicContact CB-CE1 4.41Å; L91-Y138 HydrophobicContact CB-CE2 4.26Å; L91-Y138 HydrophobicContact CB-CG 3.83Å; L91-Y138 HydrophobicContact CD2-CD1 4.46Å; L91-Y138 HydrophobicContact CD2-CE1 3.95Å; L91-Y138 HydrophobicContact CD2-CE2 4.13Å; L91-Y138 VanDerWaalsContact O-CD2 3.23Å; L91-Y138 WeakPolarHBondContact O-CD2 3.42Å; S94-Y138 WeakPolarHBondContact OG-CE2 3.17Å
139	Y	97.3	Very high	97.6	Very high	3 Å²	3	4 Å²	4	1%	0.012	2%	0.02	C	C	.	.			trans	-116.6	164.6	-178.8	-81.4	-118.4	0	0	0	111.4	Y34 D36 E37 F134 L137 D141	Y34-Y139 PolarHBondContact O-OH 2.84Å; D36-Y139 HydrophobicContact CB-CE1 3.84Å; D36-Y139 PolarHBondContact N-OH 3.27Å; E37-Y139 HydrophobicContact CB-CD2 4.45Å; E37-Y139 HydrophobicContact CB-CE2 3.84Å; E37-Y139 HydrophobicContact CG-CE2 4.5Å; F134-Y139 HydrophobicContact CD1-CD1 4.41Å; F134-Y139 HydrophobicContact CD1-CG 4.25Å; F134-Y139 HydrophobicContact CE1-CD1 4.18Å; F134-Y139 HydrophobicContact CE1-CE1 4.25Å; F134-Y139 HydrophobicContact CE1-CG 4.42Å; L137-Y139 HydrophobicContact CB-CD2 3.57Å; L137-Y139 HydrophobicContact CB-CE2 3.82Å; L137-Y139 HydrophobicContact CD1-CE2 4.14Å; L137-Y139 HydrophobicContact CG-CE2 4.48Å; L137-Y139 PolarHBondContact O-N 3.04Å; L137-Y139 VanDerWaalsContact O-N 3.11Å; Y139-D141 VanDerWaalsContact C-N 3.28Å; Y139-D141 WeakPolarHBondContact CB-OD2 3.35Å; Y139-D141 PolarHBondContact O-N 2.97Å
140	T	96.9	Very high	97.7	Very high	1 Å²	1	4.1 Å²	4.1	1%	0.006	2%	0.021	C	C	.	.	S	Bend	trans	-75.5	-14.4	-175.9	54.1	0	0	0	0	114	L65 C143 S144 R174	L65-T140 HydrophobicContact CB-CG2 4.02Å; L65-T140 HydrophobicContact CD2-CG2 3.8Å; T140-C143 PolarHBondContact O-N 3.04Å; T140-S144 VanDerWaalsContact O-CB 3.24Å; T140-S144 WeakPolarHBondContact O-CB 3.42Å; T140-S144 PolarHBondContact O-N 2.79Å; T140-R174 PolarHBondContact OG1-NH1 3.39Å
141	D	96.7	Very high	97.8	Very high	9 Å²	9	4 Å²	4	5%	0.048	2%	0.02	C	C	.	.	H	α-helix	trans	-60.1	-50.8	-170.1	-57.4	-91.5	0	0	0	113.3	Y139 C143 S144 I145 L417	Y139-D141 VanDerWaalsContact C-N 3.28Å; Y139-D141 WeakPolarHBondContact CB-OD2 3.35Å; Y139-D141 PolarHBondContact O-N 2.97Å; D141-C143 PolarHBondContact O-N 3.08Å; D141-S144 WeakPolarHBondContact O-CB 3.19Å; D141-S144 PolarHBondContact O-N 3.07Å; D141-I145 WeakPolarHBondContact O-CD1 3.48Å; D141-I145 WeakPolarHBondContact O-CG1 3.3Å; D141-I145 PolarHBondContact O-N 3.06Å; D141-L417 HydrophobicContact CB-CD1 4.23Å
142	H	97.7	Very high	97.9	Very high	3 Å²	3	4.1 Å²	4.1	1%	0.014	2%	0.021	C	C	.	.	H	α-helix	trans	-66.4	-38.8	-177.9	-81.6	-64.4	0	0	0	113.6	F98 N102 F131 F134 S135 L146	F98-H142 HydrophobicContact CB-CB 3.65Å; N102-H142 PolarHBondContact ND2-O 3.21Å; F131-H142 AromaticContact CD1-CE1 3.64Å; F131-H142 AromaticContact CE1-CE1 3.45Å; F131-H142 VanDerWaalsContact CE1-CE1 3.45Å; F131-H142 WeakPolarHBondContact CE1-CE1 3.36Å; F131-H142 AromaticContact CE1-ND1 3.72Å; F131-H142 AromaticContact CZ-CE1 3.8Å; F131-H142 AromaticContact CZ-ND1 3.69Å; F131-H142 PolarHBondContact O-CE1 2.99Å; F131-H142 PolarHBondContact O-NE2 3.09Å; F134-H142 VanDerWaalsContact C-NE2 3.29Å; F134-H142 PolarHBondContact O-CD2 3.27Å; S135-H142 WeakPolarHBondContact CA-NE2 3.48Å; S135-H142 WeakPolarHBondContact CB-NE2 3.36Å; S135-H142 PolarHBondContact N-NE2 2.78Å; H142-L146 WeakPolarHBondContact O-CB 3.2Å; H142-L146 PolarHBondContact O-N 3.46Å; H142-L146 VanDerWaalsContact O-N 3.08Å
143	C	98.3	Very high	97.9	Very high	0 Å²	0	6.1 Å²	6.1	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-62.6	-50	174.2	-170.7	0	0	0	0	109.2	L65 F98 T140 D141 I145 L146 F147 T173	L65-C143 HydrophobicContact CD1-CB 3.98Å; F98-C143 HydrophobicContact CD2-CB 4.2Å; F98-C143 HydrophobicContact CE1-CB 4.43Å; F98-C143 HydrophobicContact CE2-CB 4.07Å; F98-C143 HydrophobicContact CG-CB 4.47Å; F98-C143 HydrophobicContact CZ-CB 4.18Å; T140-C143 PolarHBondContact O-N 3.04Å; D141-C143 PolarHBondContact O-N 3.08Å; C143-I145 PolarHBondContact O-N 3Å; C143-L146 WeakPolarHBondContact O-CB 3.48Å; C143-L146 PolarHBondContact O-N 2.91Å; C143-F147 WeakPolarHBondContact O-CD2 3.34Å; C143-F147 PolarHBondContact O-N 3.26Å; C143-F147 VanDerWaalsContact SG-CE2 3.6Å; C143-T173 HydrophobicContact CB-CG2 4.28Å; C143-T173 WeakPolarHBondContact SG-CG2 3.42Å
144	S	98.2	Very high	98	Very high	1 Å²	1	8.1 Å²	8.1	1%	0.007	4%	0.037	C	C	.	.	H	α-helix	trans	-54.5	-51.1	176.2	173.9	0	0	0	0	113.1	T140 D141 L146 F147 V148 T173 N177 I418	T140-S144 VanDerWaalsContact O-CB 3.24Å; T140-S144 WeakPolarHBondContact O-CB 3.42Å; T140-S144 PolarHBondContact O-N 2.79Å; D141-S144 WeakPolarHBondContact O-CB 3.19Å; D141-S144 PolarHBondContact O-N 3.07Å; S144-L146 VanDerWaalsContact C-N 3.3Å; S144-L146 PolarHBondContact O-N 3.32Å; S144-F147 PolarHBondContact O-N 2.9Å; S144-V148 WeakPolarHBondContact O-CG2 3.49Å; S144-V148 PolarHBondContact O-N 3.04Å; S144-T173 WeakPolarHBondContact CA-OG1 3.21Å; S144-T173 WeakPolarHBondContact CB-OG1 3.45Å; S144-N177 PolarHBondContact OG-ND2 2.92Å; S144-N177 PolarHBondContact OG-OD1 3.13Å; S144-I418 VanDerWaalsContact OG-CD1 3.31Å; S144-I418 WeakPolarHBondContact OG-CD1 3.38Å
145	I	98.3	Very high	98	Very high	1 Å²	1	8.1 Å²	8.1	1%	0.005	4%	0.037	C	C	.	.	H	α-helix	trans	-60.4	-41.9	179.6	-63.1	158	0	0	0	110.5	N102 F131 D141 C143 F147 V148 M149 L417 I418	N102-I145 WeakPolarHBondContact OD1-CG2 3.48Å; F131-I145 HydrophobicContact CD2-CD1 4.38Å; F131-I145 HydrophobicContact CE2-CD1 3.89Å; F131-I145 HydrophobicContact CE2-CG2 4.17Å; D141-I145 WeakPolarHBondContact O-CD1 3.48Å; D141-I145 WeakPolarHBondContact O-CG1 3.3Å; D141-I145 PolarHBondContact O-N 3.06Å; C143-I145 PolarHBondContact O-N 3Å; I145-F147 PolarHBondContact O-N 3.45Å; I145-V148 PolarHBondContact O-N 3.42Å; I145-M149 HydrophobicContact CG2-CE 4.4Å; I145-M149 HydrophobicContact CG2-CG 3.86Å; I145-M149 WeakPolarHBondContact O-CB 3.33Å; I145-M149 VanDerWaalsContact O-CG 3.28Å; I145-M149 WeakPolarHBondContact O-CG 3.16Å; I145-M149 PolarHBondContact O-N 3.3Å; I145-L417 HydrophobicContact CD1-CB 3.88Å; I145-L417 HydrophobicContact CD1-CD1 4.08Å; I145-L417 HydrophobicContact CD1-CG 4.49Å; I145-I418 HydrophobicContact CB-CG1 4.47Å; I145-I418 HydrophobicContact CG1-CD1 4.38Å; I145-I418 HydrophobicContact CG1-CG1 3.61Å
146	L	98.6	Very high	97.9	Very high	23 Å²	23	9.8 Å²	9.8	12%	0.12	5%	0.046	C	C	.	.	H	α-helix	trans	-59.2	-49.1	-178.3	174.6	61	0	0	0	111.2	F98 F101 N102 I105 H142 C143 S144 M149 A150	F98-L146 HydrophobicContact CD1-CD2 3.7Å; F98-L146 HydrophobicContact CE1-CD2 4.31Å; F101-L146 HydrophobicContact CB-CD1 3.72Å; F101-L146 HydrophobicContact CB-CD2 3.94Å; F101-L146 HydrophobicContact CB-CG 4.5Å; F101-L146 HydrophobicContact CD2-CD2 4.25Å; N102-L146 WeakPolarHBondContact OD1-CA 3.39Å; N102-L146 WeakPolarHBondContact OD1-CB 3.46Å; N102-L146 PolarHBondContact OD1-N 2.95Å; I105-L146 HydrophobicContact CG2-CD1 4.04Å; H142-L146 WeakPolarHBondContact O-CB 3.2Å; H142-L146 PolarHBondContact O-N 3.46Å; H142-L146 VanDerWaalsContact O-N 3.08Å; C143-L146 WeakPolarHBondContact O-CB 3.48Å; C143-L146 PolarHBondContact O-N 2.91Å; S144-L146 VanDerWaalsContact C-N 3.3Å; S144-L146 PolarHBondContact O-N 3.32Å; L146-M149 PolarHBondContact O-N 3.18Å; L146-A150 VanDerWaalsContact O-CB 3.22Å; L146-A150 WeakPolarHBondContact O-CB 3.18Å; L146-A150 PolarHBondContact O-N 3.08Å
147	F	98.6	Very high	97.9	Very high	33 Å²	33	12.6 Å²	12.6	15%	0.145	6%	0.061	C	C	.	.	H	α-helix	trans	-72.4	-31.7	-178	-73.1	-78	0	0	0	112.5	C143 S144 I145 S151 F166 Y169 A170 T173	C143-F147 WeakPolarHBondContact O-CD2 3.34Å; C143-F147 PolarHBondContact O-N 3.26Å; C143-F147 VanDerWaalsContact SG-CE2 3.6Å; S144-F147 PolarHBondContact O-N 2.9Å; I145-F147 PolarHBondContact O-N 3.45Å; F147-S151 WeakPolarHBondContact O-CB 3.48Å; F147-S151 PolarHBondContact O-N 3.09Å; F147-S151 PolarHBondContact O-OG 3.12Å; F147-F166 AromaticContact CD1-CD1 3.57Å; F147-F166 HydrophobicContact CD1-CD1 3.57Å; F147-F166 HydrophobicContact CD1-CE1 4.18Å; F147-F166 AromaticContact CE1-CD1 3.98Å; F147-F166 HydrophobicContact CE1-CD1 3.98Å; F147-F166 HydrophobicContact CE1-CE1 4.14Å; F147-Y169 AromaticContact CD1-CD1 3.67Å; F147-Y169 HydrophobicContact CD1-CD1 3.67Å; F147-Y169 AromaticContact CD1-CG 3.92Å; F147-Y169 HydrophobicContact CD1-CG 3.92Å; F147-Y169 AromaticContact CD2-CD1 3.41Å; F147-Y169 HydrophobicContact CD2-CD1 3.41Å; F147-Y169 VanDerWaalsContact CD2-CD1 3.41Å; F147-Y169 AromaticContact CD2-CE1 3.89Å; F147-Y169 HydrophobicContact CD2-CE1 3.89Å; F147-Y169 HydrophobicContact CD2-CG 4.43Å; F147-Y169 AromaticContact CE1-CD1 3.59Å; F147-Y169 HydrophobicContact CE1-CD1 3.59Å; F147-Y169 HydrophobicContact CE1-CE1 4.17Å; F147-Y169 AromaticContact CE1-CG 3.85Å; F147-Y169 HydrophobicContact CE1-CG 3.85Å; F147-Y169 AromaticContact CE2-CD1 3.31Å; F147-Y169 HydrophobicContact CE2-CD1 3.31Å; F147-Y169 AromaticContact CE2-CE1 3.37Å; F147-Y169 HydrophobicContact CE2-CE1 3.37Å; F147-Y169 HydrophobicContact CE2-CG 4.36Å; F147-Y169 AromaticContact CG-CD1 3.64Å; F147-Y169 HydrophobicContact CG-CD1 3.64Å; F147-Y169 HydrophobicContact CG-CG 4.28Å; F147-Y169 AromaticContact CZ-CD1 3.42Å; F147-Y169 HydrophobicContact CZ-CD1 3.42Å; F147-Y169 VanDerWaalsContact CZ-CD1 3.42Å; F147-Y169 AromaticContact CZ-CE1 3.55Å; F147-Y169 HydrophobicContact CZ-CE1 3.55Å; F147-Y169 HydrophobicContact CZ-CG 4.09Å; F147-A170 HydrophobicContact CB-CB 3.72Å; F147-T173 HydrophobicContact CD2-CG2 4.46Å
148	V	98.7	Very high	97.7	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-68.6	-45.2	170.6	179	0	0	0	0	111.3	S144 I145 A150 S151 V152 A170 N177 W180 I418	S144-V148 WeakPolarHBondContact O-CG2 3.49Å; S144-V148 PolarHBondContact O-N 3.04Å; I145-V148 PolarHBondContact O-N 3.42Å; V148-A150 PolarHBondContact O-N 3.11Å; V148-S151 PolarHBondContact O-N 3.15Å; V148-S151 PolarHBondContact O-OG 3.29Å; V148-V152 WeakPolarHBondContact O-CG2 3.37Å; V148-V152 PolarHBondContact O-N 3.31Å; V148-A170 HydrophobicContact CG2-CB 3.71Å; V148-N177 HydrophobicContact CG2-CB 4.24Å; V148-W180 HydrophobicContact CG1-CG 4.17Å; V148-I418 HydrophobicContact CG1-CG2 3.95Å; V148-I418 HydrophobicContact CG2-CD1 4.05Å
149	M	98.6	Very high	97.7	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-67	-38.1	179	-67.6	-45.6	112.2	0	0	111.8	I105 I106 L109 I145 L146 V152 Y153 I418 V421 L422 I425	I105-M149 HydrophobicContact CG1-CB 4.21Å; I105-M149 HydrophobicContact CG2-CB 3.68Å; I106-M149 HydrophobicContact CG1-CG 4.26Å; L109-M149 HydrophobicContact CD1-CB 3.82Å; L109-M149 HydrophobicContact CD1-CG 4.26Å; L109-M149 HydrophobicContact CD1-SD 3.97Å; I145-M149 HydrophobicContact CG2-CE 4.4Å; I145-M149 HydrophobicContact CG2-CG 3.86Å; I145-M149 WeakPolarHBondContact O-CB 3.33Å; I145-M149 VanDerWaalsContact O-CG 3.28Å; I145-M149 WeakPolarHBondContact O-CG 3.16Å; I145-M149 PolarHBondContact O-N 3.3Å; L146-M149 PolarHBondContact O-N 3.18Å; M149-V152 PolarHBondContact O-N 3.04Å; M149-Y153 WeakPolarHBondContact O-CB 3.31Å; M149-Y153 PolarHBondContact O-N 3.37Å; M149-I418 HydrophobicContact CE-CG2 4.12Å; M149-V421 HydrophobicContact CE-CB 4.46Å; M149-V421 HydrophobicContact CE-CG1 4.01Å; M149-V421 HydrophobicContact CG-CG1 4.21Å; M149-V421 HydrophobicContact SD-CG1 3.5Å; M149-V421 WeakPolarHBondContact SD-CG1 3.33Å; M149-L422 HydrophobicContact CE-CD2 3.74Å; M149-L422 HydrophobicContact CE-CG 3.91Å; M149-L422 HydrophobicContact SD-CD2 4.06Å; M149-I425 HydrophobicContact SD-CD1 4.03Å
150	A	98.7	Very high	97.7	Very high	5 Å²	5	22.9 Å²	22.9	4%	0.041	11%	0.11	C	C	.	.	H	α-helix	trans	-62.3	-42.2	173.2	0	0	0	0	0	111.6	L146 V148 V152 Y153 F154 F166	L146-A150 VanDerWaalsContact O-CB 3.22Å; L146-A150 WeakPolarHBondContact O-CB 3.18Å; L146-A150 PolarHBondContact O-N 3.08Å; V148-A150 PolarHBondContact O-N 3.11Å; A150-V152 PolarHBondContact O-N 3.34Å; A150-Y153 WeakPolarHBondContact O-CB 3.48Å; A150-Y153 PolarHBondContact O-N 3.46Å; A150-F154 WeakPolarHBondContact O-CD2 3.39Å; A150-F154 PolarHBondContact O-N 3.47Å; A150-F166 HydrophobicContact CB-CB 4.19Å; A150-F166 HydrophobicContact CB-CD1 3.38Å; A150-F166 HydrophobicContact CB-CD2 4.35Å; A150-F166 HydrophobicContact CB-CE1 3.83Å; A150-F166 HydrophobicContact CB-CG 3.72Å; A150-F166 HydrophobicContact CB-CZ 4.5Å
151	S	98.7	Very high	97.8	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-64.5	-40.8	177.2	66.7	0	0	0	0	112.2	F147 V148 Y153 F154 S155 S163 L184	F147-S151 WeakPolarHBondContact O-CB 3.48Å; F147-S151 PolarHBondContact O-N 3.09Å; F147-S151 PolarHBondContact O-OG 3.12Å; V148-S151 PolarHBondContact O-N 3.15Å; V148-S151 PolarHBondContact O-OG 3.29Å; S151-Y153 VanDerWaalsContact C-N 3.32Å; S151-Y153 PolarHBondContact O-N 2.88Å; S151-F154 PolarHBondContact O-N 3.15Å; S151-S155 WeakPolarHBondContact O-CB 3.39Å; S151-S155 PolarHBondContact O-N 3.34Å; S151-S163 VanDerWaalsContact CB-O 3.26Å; S151-S163 WeakPolarHBondContact CB-O 3.43Å; S151-S163 WeakPolarHBondContact O-CB 3.04Å; S151-S163 PolarHBondContact O-OG 3.15Å; S151-L184 WeakPolarHBondContact OG-CD1 3.2Å
152	V	98.4	Very high	97.8	Very high	3 Å²	3	34.1 Å²	34.1	2%	0.018	16%	0.157	C	C	.	.	H	α-helix	trans	-60	-43.7	172.4	174.7	0	0	0	0	111	L109 V148 M149 A150 S155 L156 L184 I187 L422	L109-V152 HydrophobicContact CD2-CB 4.24Å; L109-V152 HydrophobicContact CD2-CG1 3.76Å; V148-V152 WeakPolarHBondContact O-CG2 3.37Å; V148-V152 PolarHBondContact O-N 3.31Å; M149-V152 PolarHBondContact O-N 3.04Å; A150-V152 PolarHBondContact O-N 3.34Å; V152-S155 PolarHBondContact O-N 3.03Å; V152-L156 HydrophobicContact CG1-CD1 4.11Å; V152-L156 WeakPolarHBondContact O-CG 3.28Å; V152-L156 PolarHBondContact O-N 2.87Å; V152-L184 HydrophobicContact CB-CD2 4.29Å; V152-L184 HydrophobicContact CG2-CD2 3.71Å; V152-I187 HydrophobicContact CG1-CD1 4.18Å; V152-L422 HydrophobicContact CG2-CD2 3.97Å
153	Y	98.1	Very high	97.9	Very high	46 Å²	46	34 Å²	34	18%	0.18	16%	0.156	C	C	.	.	H	α-helix	trans	-60.9	-48.5	-179.9	174.8	-98.8	0	0	0	112.1	I105 R108 L109 I112 M149 A150 S151 S155 L156 L157	I105-Y153 HydrophobicContact CD1-CD1 3.93Å; I105-Y153 HydrophobicContact CD1-CD2 4.04Å; I105-Y153 HydrophobicContact CD1-CG 3.62Å; R108-Y153 HydrophobicContact CB-CD2 4.01Å; R108-Y153 HydrophobicContact CB-CE2 3.62Å; L109-Y153 VanDerWaalsContact CD2-CA 3.43Å; L109-Y153 HydrophobicContact CD2-CD2 4.22Å; L109-Y153 HydrophobicContact CD2-CG 4.46Å; L109-Y153 HydrophobicContact CG-CD2 4.44Å; I112-Y153 HydrophobicContact CD1-CD2 3.61Å; I112-Y153 HydrophobicContact CD1-CE2 3.16Å; I112-Y153 HydrophobicContact CG1-CE2 4.2Å; M149-Y153 WeakPolarHBondContact O-CB 3.31Å; M149-Y153 PolarHBondContact O-N 3.37Å; A150-Y153 WeakPolarHBondContact O-CB 3.48Å; A150-Y153 PolarHBondContact O-N 3.46Å; S151-Y153 VanDerWaalsContact C-N 3.32Å; S151-Y153 PolarHBondContact O-N 2.88Å; Y153-S155 VanDerWaalsContact C-N 3.32Å; Y153-S155 PolarHBondContact O-N 2.87Å; Y153-L156 PolarHBondContact O-N 3.38Å; Y153-L157 HydrophobicContact CD1-CD1 4.05Å; Y153-L157 HydrophobicContact CE1-CD1 3.41Å; Y153-L157 VanDerWaalsContact CE1-CD1 3.41Å; Y153-L157 HydrophobicContact CE1-CG 4.46Å; Y153-L157 HydrophobicContact CE2-CD1 4.25Å; Y153-L157 WeakPolarHBondContact O-CG 3.39Å; Y153-L157 PolarHBondContact O-N 3.08Å; Y153-L157 VanDerWaalsContact O-N 3.14Å
154	F	98.3	Very high	97.9	Very high	42 Å²	42	34.2 Å²	34.2	18%	0.184	16%	0.158	C	C	.	.	H	α-helix	trans	-70.3	-28.9	177.9	-74.2	-68.6	0	0	0	112.8	A150 S151 L157 H158 H159 L162 F166	A150-F154 WeakPolarHBondContact O-CD2 3.39Å; A150-F154 PolarHBondContact O-N 3.47Å; S151-F154 PolarHBondContact O-N 3.15Å; F154-L157 CarbonylContact O-C 3.25Å; F154-L157 PolarHBondContact O-N 3.19Å; F154-H158 PolarHBondContact O-N 3.01Å; F154-H159 HydrophobicContact CB-CB 4.28Å; F154-H159 HydrophobicContact CD1-CB 4.15Å; F154-H159 AromaticContact CD1-ND1 3.98Å; F154-H159 PolarHBondContact O-N 3.31Å; F154-L162 HydrophobicContact CB-CB 4.1Å; F154-L162 HydrophobicContact CD1-CB 3.95Å; F154-L162 HydrophobicContact CD1-CD1 3.78Å; F154-L162 HydrophobicContact CD2-CB 4.35Å; F154-L162 HydrophobicContact CE1-CB 4.5Å; F154-L162 HydrophobicContact CE1-CD1 3.75Å; F154-L162 HydrophobicContact CG-CB 3.87Å; F154-L162 HydrophobicContact CZ-CD1 4.47Å; F154-F166 AromaticContact CD2-CD2 3.43Å; F154-F166 HydrophobicContact CD2-CD2 3.43Å; F154-F166 VanDerWaalsContact CD2-CD2 3.43Å; F154-F166 AromaticContact CD2-CE2 3.47Å; F154-F166 HydrophobicContact CD2-CE2 3.47Å; F154-F166 VanDerWaalsContact CD2-CE2 3.47Å; F154-F166 HydrophobicContact CD2-CG 4.39Å; F154-F166 HydrophobicContact CD2-CZ 4.41Å; F154-F166 AromaticContact CE2-CD2 3.63Å; F154-F166 HydrophobicContact CE2-CD2 3.63Å; F154-F166 AromaticContact CE2-CE2 3.12Å; F154-F166 HydrophobicContact CE2-CE2 3.12Å; F154-F166 AromaticContact CE2-CZ 3.75Å; F154-F166 HydrophobicContact CE2-CZ 3.75Å; F154-F166 HydrophobicContact CG-CD2 4.47Å; F154-F166 AromaticContact CZ-CE2 4Å; F154-F166 HydrophobicContact CZ-CE2 4Å
155	S	97.7	Very high	97.9	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-64.9	-46.1	173	-173.3	0	0	0	0	111.5	S151 V152 Y153 L157 H158 L184 I187 H188	S151-S155 WeakPolarHBondContact O-CB 3.39Å; S151-S155 PolarHBondContact O-N 3.34Å; V152-S155 PolarHBondContact O-N 3.03Å; Y153-S155 VanDerWaalsContact C-N 3.32Å; Y153-S155 PolarHBondContact O-N 2.87Å; S155-L157 PolarHBondContact O-N 3.42Å; S155-H158 PolarHBondContact O-N 3.34Å; S155-L184 PolarHBondContact OG-O 3.39Å; S155-I187 WeakPolarHBondContact OG-CG2 3.43Å; S155-H188 WeakPolarHBondContact OG-CA 3.09Å; S155-H188 WeakPolarHBondContact OG-CB 3.33Å; S155-H188 PolarHBondContact OG-N 2.68Å; S155-H188 VanDerWaalsContact OG-N 3.13Å
156	L	95.6	Very high	97.9	Very high	36 Å²	36	41.5 Å²	41.5	19%	0.188	19%	0.193	C	C	.	.	H	α-helix	trans	-62.1	-27.1	174.3	-73	169.2	0	0	0	113.4	L109 I112 M113 V152 Y153 H158 I187	L109-L156 HydrophobicContact CD2-CD1 3.73Å; I112-L156 HydrophobicContact CG2-CB 4.13Å; I112-L156 HydrophobicContact CG2-CD1 4.27Å; M113-L156 HydrophobicContact CG-CD1 4.04Å; M113-L156 HydrophobicContact SD-CD1 4.24Å; V152-L156 HydrophobicContact CG1-CD1 4.11Å; V152-L156 WeakPolarHBondContact O-CG 3.28Å; V152-L156 PolarHBondContact O-N 2.87Å; Y153-L156 PolarHBondContact O-N 3.38Å; L156-H158 VanDerWaalsContact C-N 3.28Å; L156-I187 HydrophobicContact CD2-CG2 3.53Å; L156-I187 HydrophobicContact CG-CG2 3.75Å
157	L	96.2	Very high	97.9	Very high	59 Å²	59	40.4 Å²	40.4	31%	0.309	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86	5.6	173.7	-69.4	-178.5	0	0	0	113.7	I112 Y153 F154 S155 H159	I112-L157 HydrophobicContact CD1-CD1 4.4Å; I112-L157 HydrophobicContact CD1-CD2 3.6Å; I112-L157 HydrophobicContact CD1-CG 3.9Å; Y153-L157 HydrophobicContact CD1-CD1 4.05Å; Y153-L157 HydrophobicContact CE1-CD1 3.41Å; Y153-L157 VanDerWaalsContact CE1-CD1 3.41Å; Y153-L157 HydrophobicContact CE1-CG 4.46Å; Y153-L157 HydrophobicContact CE2-CD1 4.25Å; Y153-L157 WeakPolarHBondContact O-CG 3.39Å; Y153-L157 PolarHBondContact O-N 3.08Å; Y153-L157 VanDerWaalsContact O-N 3.14Å; F154-L157 CarbonylContact O-C 3.25Å; F154-L157 PolarHBondContact O-N 3.19Å; S155-L157 PolarHBondContact O-N 3.42Å; L157-H159 WeakPolarHBondContact CB-ND1 3.32Å; L157-H159 PolarHBondContact O-N 3.17Å
158	H	95	Very high	97.9	Very high	117 Å²	117	41.2 Å²	41.2	54%	0.542	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.5	27.2	-175.1	-56.6	-74.2	0	0	0	114.7	F154 S155 L156 G160 H188	F154-H158 PolarHBondContact O-N 3.01Å; S155-H158 PolarHBondContact O-N 3.34Å; L156-H158 VanDerWaalsContact C-N 3.28Å; H158-G160 PolarHBondContact O-N 3.36Å; H158-H188 PolarHBondContact ND1-O 3.31Å; H158-H188 PolarHBondContact O-CE1 2.92Å
159	H	97.2	Very high	97.9	Very high	96 Å²	96	44 Å²	44	44%	0.444	21%	0.208	S	C	.	.			trans	-97	74.6	171.8	-60.3	125.9	0	0	0	110.7	F154 L157 W161 L162 S163	F154-H159 HydrophobicContact CB-CB 4.28Å; F154-H159 HydrophobicContact CD1-CB 4.15Å; F154-H159 AromaticContact CD1-ND1 3.98Å; F154-H159 PolarHBondContact O-N 3.31Å; L157-H159 WeakPolarHBondContact CB-ND1 3.32Å; L157-H159 PolarHBondContact O-N 3.17Å; H159-W161 PolarHBondContact O-N 2.84Å; H159-L162 HydrophobicContact CB-CB 4.19Å; H159-L162 HydrophobicContact CB-CD1 4.15Å; H159-L162 PolarHBondContact O-N 2.87Å; H159-S163 WeakPolarHBondContact O-CB 3.26Å; H159-S163 PolarHBondContact O-N 3.31Å
160	G	97.3	Very high	97.9	Very high	6 Å²	6	44 Å²	44	6%	0.062	21%	0.208	C	C	.	.	H	α-helix	trans	-57.3	-42.3	-172.9	0	0	0	0	0	114.4	H158 S163 A164 H188	H158-G160 PolarHBondContact O-N 3.36Å; G160-S163 PolarHBondContact O-N 2.89Å; G160-A164 WeakPolarHBondContact O-CB 3.46Å; G160-A164 PolarHBondContact O-N 3.2Å; G160-H188 PolarHBondContact N-CE1 3.41Å
161	W	98.2	Very high	97.9	Very high	173 Å²	173	44.5 Å²	44.5	66%	0.655	21%	0.21	S	C	*	.	H	α-helix	trans	-66.1	-43.5	178.7	-73.5	100.2	0	0	0	113.5	H159 A164 M165 P237 L240	H159-W161 PolarHBondContact O-N 2.84Å; W161-A164 PolarHBondContact O-N 2.99Å; W161-M165 PolarHBondContact O-N 3.45Å; W161-P237 HydrophobicContact CD2-CB 3.78Å; W161-P237 HydrophobicContact CD2-CG 4.35Å; W161-P237 HydrophobicContact CE3-CB 3.7Å; W161-P237 HydrophobicContact CG-CB 4.29Å; W161-P237 HydrophobicContact CH2-CB 4.37Å; W161-P237 HydrophobicContact CZ2-CB 4.44Å; W161-P237 HydrophobicContact CZ3-CB 4.02Å; W161-L240 HydrophobicContact CH2-CD1 4.01Å; W161-L240 HydrophobicContact CZ3-CD1 4.17Å
162	L	98.2	Very high	97.8	Very high	73 Å²	73	48.2 Å²	48.2	38%	0.382	23%	0.227	S	C	.	.	H	α-helix	trans	-64	-45.5	174.9	-72.2	175.7	0	0	0	110.3	F154 H159 A164 M165 F166	F154-L162 HydrophobicContact CB-CB 4.1Å; F154-L162 HydrophobicContact CD1-CB 3.95Å; F154-L162 HydrophobicContact CD1-CD1 3.78Å; F154-L162 HydrophobicContact CD2-CB 4.35Å; F154-L162 HydrophobicContact CE1-CB 4.5Å; F154-L162 HydrophobicContact CE1-CD1 3.75Å; F154-L162 HydrophobicContact CG-CB 3.87Å; F154-L162 HydrophobicContact CZ-CD1 4.47Å; H159-L162 HydrophobicContact CB-CB 4.19Å; H159-L162 HydrophobicContact CB-CD1 4.15Å; H159-L162 PolarHBondContact O-N 2.87Å; L162-A164 VanDerWaalsContact C-N 3.3Å; L162-A164 PolarHBondContact O-N 2.54Å; L162-M165 HydrophobicContact CD2-CE 4.1Å; L162-M165 WeakPolarHBondContact O-CB 3.42Å; L162-M165 PolarHBondContact O-N 3.43Å; L162-M165 VanDerWaalsContact O-N 3.15Å; L162-F166 WeakPolarHBondContact O-CD2 3.44Å; L162-F166 PolarHBondContact O-N 3.44Å
163	S	98.6	Very high	97.7	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-55.2	-46.7	175.7	-175.6	0	0	0	0	111.7	S151 H159 G160 M165 F166 V167 F238	S151-S163 VanDerWaalsContact CB-O 3.26Å; S151-S163 WeakPolarHBondContact CB-O 3.43Å; S151-S163 WeakPolarHBondContact O-CB 3.04Å; S151-S163 PolarHBondContact O-OG 3.15Å; H159-S163 WeakPolarHBondContact O-CB 3.26Å; H159-S163 PolarHBondContact O-N 3.31Å; G160-S163 PolarHBondContact O-N 2.89Å; S163-M165 PolarHBondContact O-N 3.46Å; S163-F166 PolarHBondContact O-N 2.85Å; S163-V167 PolarHBondContact O-N 3.39Å; S163-F238 WeakPolarHBondContact OG-CE1 3.22Å; S163-F238 WeakPolarHBondContact OG-CZ 3.46Å
164	A	98.6	Very high	97.6	Very high	5 Å²	5	47.5 Å²	47.5	4%	0.041	22%	0.223	C	C	.	.	H	α-helix	trans	-62.1	-39.6	176.9	0	0	0	0	0	113	G160 W161 L162 V167 S168 P237 F238 V241	G160-A164 WeakPolarHBondContact O-CB 3.46Å; G160-A164 PolarHBondContact O-N 3.2Å; W161-A164 PolarHBondContact O-N 2.99Å; L162-A164 VanDerWaalsContact C-N 3.3Å; L162-A164 PolarHBondContact O-N 2.54Å; A164-V167 WeakPolarHBondContact O-CG1 3.47Å; A164-S168 VanDerWaalsContact O-CB 3.32Å; A164-S168 WeakPolarHBondContact O-CB 3.34Å; A164-S168 PolarHBondContact O-N 3.22Å; A164-S168 PolarHBondContact O-OG 3.22Å; A164-P237 HydrophobicContact CB-CB 3.63Å; A164-P237 HydrophobicContact CB-CG 4.45Å; A164-F238 HydrophobicContact CB-CD1 4.21Å; A164-F238 HydrophobicContact CB-CE1 4.3Å; A164-V241 HydrophobicContact CB-CG2 4.09Å
165	M	98.4	Very high	97.4	Very high	110 Å²	110	46.4 Å²	46.4	54%	0.542	22%	0.219	S	C	.	.	H	α-helix	trans	-62.2	-46.6	174.5	-173.3	-174.6	73.2	0	0	111.3	W161 L162 S163 S168 Y169	W161-M165 PolarHBondContact O-N 3.45Å; L162-M165 HydrophobicContact CD2-CE 4.1Å; L162-M165 WeakPolarHBondContact O-CB 3.42Å; L162-M165 PolarHBondContact O-N 3.43Å; L162-M165 VanDerWaalsContact O-N 3.15Å; S163-M165 PolarHBondContact O-N 3.46Å; M165-S168 WeakPolarHBondContact O-CB 3.24Å; M165-S168 PolarHBondContact O-N 2.99Å; M165-Y169 PolarHBondContact O-N 3.24Å; M165-Y169 VanDerWaalsContact O-N 3.09Å
166	F	98.7	Very high	97.2	Very high	45 Å²	45	48.7 Å²	48.7	20%	0.197	24%	0.235	C	C	.	.	H	α-helix	trans	-65.4	-43	178.2	-79.9	-79.3	0	0	0	112.3	F147 A150 F154 L162 S163 Y169 A170	F147-F166 AromaticContact CD1-CD1 3.57Å; F147-F166 HydrophobicContact CD1-CD1 3.57Å; F147-F166 HydrophobicContact CD1-CE1 4.18Å; F147-F166 AromaticContact CE1-CD1 3.98Å; F147-F166 HydrophobicContact CE1-CD1 3.98Å; F147-F166 HydrophobicContact CE1-CE1 4.14Å; A150-F166 HydrophobicContact CB-CB 4.19Å; A150-F166 HydrophobicContact CB-CD1 3.38Å; A150-F166 HydrophobicContact CB-CD2 4.35Å; A150-F166 HydrophobicContact CB-CE1 3.83Å; A150-F166 HydrophobicContact CB-CG 3.72Å; A150-F166 HydrophobicContact CB-CZ 4.5Å; F154-F166 AromaticContact CD2-CD2 3.43Å; F154-F166 HydrophobicContact CD2-CD2 3.43Å; F154-F166 VanDerWaalsContact CD2-CD2 3.43Å; F154-F166 AromaticContact CD2-CE2 3.47Å; F154-F166 HydrophobicContact CD2-CE2 3.47Å; F154-F166 VanDerWaalsContact CD2-CE2 3.47Å; F154-F166 HydrophobicContact CD2-CG 4.39Å; F154-F166 HydrophobicContact CD2-CZ 4.41Å; F154-F166 AromaticContact CE2-CD2 3.63Å; F154-F166 HydrophobicContact CE2-CD2 3.63Å; F154-F166 AromaticContact CE2-CE2 3.12Å; F154-F166 HydrophobicContact CE2-CE2 3.12Å; F154-F166 AromaticContact CE2-CZ 3.75Å; F154-F166 HydrophobicContact CE2-CZ 3.75Å; F154-F166 HydrophobicContact CG-CD2 4.47Å; F154-F166 AromaticContact CZ-CE2 4Å; F154-F166 HydrophobicContact CZ-CE2 4Å; L162-F166 WeakPolarHBondContact O-CD2 3.44Å; L162-F166 PolarHBondContact O-N 3.44Å; S163-F166 PolarHBondContact O-N 2.85Å; F166-Y169 PolarHBondContact O-N 2.87Å; F166-A170 PolarHBondContact O-N 3.35Å
167	V	98.6	Very high	97.3	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-70.2	-31.6	176.7	71	0	0	0	0	112.3	S163 A164 Y169 A170 V171 V181 L184 F238 V241	S163-V167 PolarHBondContact O-N 3.39Å; A164-V167 WeakPolarHBondContact O-CG1 3.47Å; V167-Y169 VanDerWaalsContact C-N 3.3Å; V167-Y169 PolarHBondContact O-N 3.46Å; V167-A170 WeakPolarHBondContact O-CB 3.48Å; V167-A170 PolarHBondContact O-N 2.83Å; V167-V171 WeakPolarHBondContact O-CG2 3.32Å; V167-V171 PolarHBondContact O-N 3.47Å; V167-V181 HydrophobicContact CG1-CG2 4.28Å; V167-V181 HydrophobicContact CG2-CG2 3.87Å; V167-L184 HydrophobicContact CB-CD1 3.52Å; V167-L184 HydrophobicContact CG1-CD1 3.86Å; V167-L184 HydrophobicContact CG2-CD1 3.55Å; V167-F238 HydrophobicContact CG1-CD1 4.44Å; V167-V241 HydrophobicContact CG1-CG1 4.45Å; V167-V241 HydrophobicContact CG1-CG2 4.33Å
168	S	98.5	Very high	97.4	Very high	49 Å²	49	45.8 Å²	45.8	34%	0.343	22%	0.219	S	C	.	.	H	α-helix	trans	-59.6	-44.5	171.8	-60.3	0	0	0	0	110.9	A164 M165 V171 F172 V241	A164-S168 VanDerWaalsContact O-CB 3.32Å; A164-S168 WeakPolarHBondContact O-CB 3.34Å; A164-S168 PolarHBondContact O-N 3.22Å; A164-S168 PolarHBondContact O-OG 3.22Å; M165-S168 WeakPolarHBondContact O-CB 3.24Å; M165-S168 PolarHBondContact O-N 2.99Å; S168-V171 PolarHBondContact O-N 2.81Å; S168-F172 PolarHBondContact O-N 2.94Å; S168-V241 WeakPolarHBondContact OG-CG2 3.26Å
169	Y	98.5	Very high	97.5	Very high	59 Å²	59	41.8 Å²	41.8	23%	0.231	20%	0.202	C	C	.	.	H	α-helix	trans	-67.5	-37.8	174.9	-156.8	-83.1	0	0	0	112	G64 A68 F147 M165 F166 V167 V171 F172 T173	G64-Y169 PolarHBondContact O-OH 3.07Å; A68-Y169 WeakPolarHBondContact CA-OH 3.19Å; A68-Y169 HydrophobicContact CB-CE1 4.44Å; A68-Y169 VanDerWaalsContact CB-OH 3.27Å; A68-Y169 WeakPolarHBondContact CB-OH 3.47Å; A68-Y169 PolarHBondContact N-OH 3.46Å; A68-Y169 VanDerWaalsContact N-OH 3.15Å; F147-Y169 AromaticContact CD1-CD1 3.67Å; F147-Y169 HydrophobicContact CD1-CD1 3.67Å; F147-Y169 AromaticContact CD1-CG 3.92Å; F147-Y169 HydrophobicContact CD1-CG 3.92Å; F147-Y169 AromaticContact CD2-CD1 3.41Å; F147-Y169 HydrophobicContact CD2-CD1 3.41Å; F147-Y169 VanDerWaalsContact CD2-CD1 3.41Å; F147-Y169 AromaticContact CD2-CE1 3.89Å; F147-Y169 HydrophobicContact CD2-CE1 3.89Å; F147-Y169 HydrophobicContact CD2-CG 4.43Å; F147-Y169 AromaticContact CE1-CD1 3.59Å; F147-Y169 HydrophobicContact CE1-CD1 3.59Å; F147-Y169 HydrophobicContact CE1-CE1 4.17Å; F147-Y169 AromaticContact CE1-CG 3.85Å; F147-Y169 HydrophobicContact CE1-CG 3.85Å; F147-Y169 AromaticContact CE2-CD1 3.31Å; F147-Y169 HydrophobicContact CE2-CD1 3.31Å; F147-Y169 AromaticContact CE2-CE1 3.37Å; F147-Y169 HydrophobicContact CE2-CE1 3.37Å; F147-Y169 HydrophobicContact CE2-CG 4.36Å; F147-Y169 AromaticContact CG-CD1 3.64Å; F147-Y169 HydrophobicContact CG-CD1 3.64Å; F147-Y169 HydrophobicContact CG-CG 4.28Å; F147-Y169 AromaticContact CZ-CD1 3.42Å; F147-Y169 HydrophobicContact CZ-CD1 3.42Å; F147-Y169 VanDerWaalsContact CZ-CD1 3.42Å; F147-Y169 AromaticContact CZ-CE1 3.55Å; F147-Y169 HydrophobicContact CZ-CE1 3.55Å; F147-Y169 HydrophobicContact CZ-CG 4.09Å; M165-Y169 PolarHBondContact O-N 3.24Å; M165-Y169 VanDerWaalsContact O-N 3.09Å; F166-Y169 PolarHBondContact O-N 2.87Å; V167-Y169 VanDerWaalsContact C-N 3.3Å; V167-Y169 PolarHBondContact O-N 3.46Å; Y169-V171 VanDerWaalsContact C-N 3.32Å; Y169-V171 PolarHBondContact O-N 2.7Å; Y169-F172 HydrophobicContact CD2-CD1 4.49Å; Y169-F172 HydrophobicContact CE2-CD1 4.27Å; Y169-F172 CarbonylContact O-C 3.55Å; Y169-F172 WeakPolarHBondContact O-CA 3.38Å; Y169-F172 WeakPolarHBondContact O-CB 3.49Å; Y169-F172 PolarHBondContact O-N 3.06Å; Y169-T173 HydrophobicContact CD1-CG2 3.96Å; Y169-T173 HydrophobicContact CE1-CG2 3.94Å; Y169-T173 WeakPolarHBondContact O-CG2 3.35Å; Y169-T173 PolarHBondContact O-N 3.27Å
170	A	98.5	Very high	97.6	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-57.9	-45.5	173	0	0	0	0	0	111.2	F147 V148 F166 V167 F172 T173 R174 N177	F147-A170 HydrophobicContact CB-CB 3.72Å; V148-A170 HydrophobicContact CG2-CB 3.71Å; F166-A170 PolarHBondContact O-N 3.35Å; V167-A170 WeakPolarHBondContact O-CB 3.48Å; V167-A170 PolarHBondContact O-N 2.83Å; A170-F172 VanDerWaalsContact C-N 3.26Å; A170-F172 PolarHBondContact O-N 3.29Å; A170-T173 PolarHBondContact O-N 2.86Å; A170-T173 PolarHBondContact O-OG1 3.34Å; A170-R174 PolarHBondContact O-N 2.81Å; A170-N177 HydrophobicContact CB-CB 4.06Å; A170-N177 PolarHBondContact O-ND2 3.34Å
171	V	98.1	Very high	97.7	Very high	16 Å²	16	37.2 Å²	37.2	10%	0.097	18%	0.179	C	C	.	.	H	α-helix	trans	-60.4	-38.6	173.7	173.6	0	0	0	0	111.1	V167 S168 Y169 T173 R174 Q175 N177 I178 F245	V167-V171 WeakPolarHBondContact O-CG2 3.32Å; V167-V171 PolarHBondContact O-N 3.47Å; S168-V171 PolarHBondContact O-N 2.81Å; Y169-V171 VanDerWaalsContact C-N 3.32Å; Y169-V171 PolarHBondContact O-N 2.7Å; V171-T173 PolarHBondContact O-N 2.97Å; V171-R174 WeakPolarHBondContact CA-O 3.25Å; V171-R174 CarbonylContact O-C 3.5Å; V171-R174 PolarHBondContact O-N 3.49Å; V171-Q175 PolarHBondContact O-N 3.31Å; V171-N177 HydrophobicContact CG2-CB 4.25Å; V171-I178 HydrophobicContact CG2-CB 4.14Å; V171-I178 HydrophobicContact CG2-CD1 4.09Å; V171-F245 HydrophobicContact CG1-CD2 3.58Å; V171-F245 HydrophobicContact CG1-CE2 3.91Å
172	F	96.7	Very high	97.6	Very high	78 Å²	78	32 Å²	32	34%	0.342	17%	0.167	S	C	.	.	H	α-helix	trans	-68.3	-14.8	174.7	-166.6	-127.3	0	0	0	114	P62 P63 G64 V67 S168 Y169 A170	P62-F172 CarbonylContact C-O 3.6Å; P62-F172 VanDerWaalsContact C-O 3.24Å; P62-F172 HydrophobicContact CB-CD2 4.1Å; P62-F172 VanDerWaalsContact CB-O 3.26Å; P62-F172 WeakPolarHBondContact CB-O 3.23Å; P63-F172 HydrophobicContact CB-CZ 4.34Å; P63-F172 HydrophobicContact CG-CE1 4.49Å; P63-F172 HydrophobicContact CG-CE2 3.64Å; P63-F172 HydrophobicContact CG-CZ 3.59Å; G64-F172 VanDerWaalsContact CA-CD1 3.44Å; G64-F172 WeakPolarHBondContact CA-O 3.27Å; G64-F172 PolarHBondContact N-O 3.3Å; V67-F172 HydrophobicContact CB-CE1 4.16Å; V67-F172 HydrophobicContact CG1-CE1 4.44Å; V67-F172 HydrophobicContact CG2-CE1 3.91Å; V67-F172 HydrophobicContact CG2-CZ 4.19Å; S168-F172 PolarHBondContact O-N 2.94Å; Y169-F172 HydrophobicContact CD2-CD1 4.49Å; Y169-F172 HydrophobicContact CE2-CD1 4.27Å; Y169-F172 CarbonylContact O-C 3.55Å; Y169-F172 WeakPolarHBondContact O-CA 3.38Å; Y169-F172 WeakPolarHBondContact O-CB 3.49Å; Y169-F172 PolarHBondContact O-N 3.06Å; A170-F172 VanDerWaalsContact C-N 3.26Å; A170-F172 PolarHBondContact O-N 3.29Å
173	T	97.3	Very high	97.6	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-91.3	-39.9	169.5	64.9	0	0	0	0	112.2	C143 S144 F147 Y169 A170 V171	C143-T173 HydrophobicContact CB-CG2 4.28Å; C143-T173 WeakPolarHBondContact SG-CG2 3.42Å; S144-T173 WeakPolarHBondContact CA-OG1 3.21Å; S144-T173 WeakPolarHBondContact CB-OG1 3.45Å; F147-T173 HydrophobicContact CD2-CG2 4.46Å; Y169-T173 HydrophobicContact CD1-CG2 3.96Å; Y169-T173 HydrophobicContact CE1-CG2 3.94Å; Y169-T173 WeakPolarHBondContact O-CG2 3.35Å; Y169-T173 PolarHBondContact O-N 3.27Å; A170-T173 PolarHBondContact O-N 2.86Å; A170-T173 PolarHBondContact O-OG1 3.34Å; V171-T173 PolarHBondContact O-N 2.97Å
174	R	95.7	Very high	97.6	Very high	33 Å²	33	28.6 Å²	28.6	13%	0.125	15%	0.149	C	C	.	.			trans	-149.4	125.9	176.6	-61.1	-174.7	70	98.5	-1.1	109.6	T61 T140 A170 V171 S176 N177	T61-R174 HydrophobicContact CG2-CG 4.22Å; T140-R174 PolarHBondContact OG1-NH1 3.39Å; A170-R174 PolarHBondContact O-N 2.81Å; V171-R174 WeakPolarHBondContact CA-O 3.25Å; V171-R174 CarbonylContact O-C 3.5Å; V171-R174 PolarHBondContact O-N 3.49Å; R174-S176 PolarHBondContact O-N 2.94Å; R174-S176 VanDerWaalsContact O-N 3.17Å; R174-N177 WeakPolarHBondContact O-CB 3.48Å; R174-N177 PolarHBondContact O-N 3.23Å; R174-N177 PolarHBondContact O-ND2 2.96Å
175	Q	93.5	Very high	97.6	Very high	20 Å²	20	30.4 Å²	30.4	9%	0.093	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-58.5	-29.2	178.7	65	-82.7	31.1	0	0	113.3	T60 V171 N177 I178 F245 I255	T60-Q175 PolarHBondContact O-NE2 3.27Å; V171-Q175 PolarHBondContact O-N 3.31Å; Q175-N177 PolarHBondContact O-N 3.45Å; Q175-N177 VanDerWaalsContact O-N 3.15Å; Q175-I178 VanDerWaalsContact O-CG2 3.3Å; Q175-I178 WeakPolarHBondContact O-CG2 3.43Å; Q175-I178 PolarHBondContact O-N 2.87Å; Q175-F245 HydrophobicContact CB-CE2 4.15Å; Q175-F245 HydrophobicContact CB-CZ 4.38Å; Q175-I255 HydrophobicContact CB-CG2 4.13Å; Q175-I255 HydrophobicContact CG-CG2 3.66Å
176	S	94.6	Very high	97.5	Very high	48 Å²	48	25.8 Å²	25.8	34%	0.336	14%	0.136	S	C	.	.	G	3₁₀ helix	trans	-61.5	-21.7	177	57.1	0	0	0	0	113.3	R174 I178 I179	R174-S176 PolarHBondContact O-N 2.94Å; R174-S176 VanDerWaalsContact O-N 3.17Å; S176-I178 PolarHBondContact O-N 2.88Å; S176-I179 WeakPolarHBondContact O-CG2 3.36Å; S176-I179 PolarHBondContact O-N 3.36Å
177	N	98	Very high	97.4	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-68.7	-12.5	-178.6	-70.3	-31.8	0	0	0	114	S144 V148 A170 V171 R174 Q175 I179 W180 I418	S144-N177 PolarHBondContact OG-ND2 2.92Å; S144-N177 PolarHBondContact OG-OD1 3.13Å; V148-N177 HydrophobicContact CG2-CB 4.24Å; A170-N177 HydrophobicContact CB-CB 4.06Å; A170-N177 PolarHBondContact O-ND2 3.34Å; V171-N177 HydrophobicContact CG2-CB 4.25Å; R174-N177 WeakPolarHBondContact O-CB 3.48Å; R174-N177 PolarHBondContact O-N 3.23Å; R174-N177 PolarHBondContact O-ND2 2.96Å; Q175-N177 PolarHBondContact O-N 3.45Å; Q175-N177 VanDerWaalsContact O-N 3.15Å; N177-I179 PolarHBondContact O-N 3.3Å; N177-I179 VanDerWaalsContact O-N 3.16Å; N177-W180 PolarHBondContact O-N 3.29Å; N177-W180 VanDerWaalsContact O-N 3.1Å; N177-I418 VanDerWaalsContact OD1-CD1 3.24Å; N177-I418 WeakPolarHBondContact OD1-CD1 3.18Å
178	I	97.7	Very high	97.4	Very high	34 Å²	34	24.8 Å²	24.8	17%	0.174	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	-58.7	-28.5	175.9	-167.2	65	0	0	0	111.9	V171 Q175 S176 W180 V181 V241 F245	V171-I178 HydrophobicContact CG2-CB 4.14Å; V171-I178 HydrophobicContact CG2-CD1 4.09Å; Q175-I178 VanDerWaalsContact O-CG2 3.3Å; Q175-I178 WeakPolarHBondContact O-CG2 3.43Å; Q175-I178 PolarHBondContact O-N 2.87Å; S176-I178 PolarHBondContact O-N 2.88Å; I178-W180 PolarHBondContact O-N 3.46Å; I178-W180 VanDerWaalsContact O-N 3.12Å; I178-V181 HydrophobicContact CD1-CG2 3.95Å; I178-V181 WeakPolarHBondContact O-CB 3.36Å; I178-V181 WeakPolarHBondContact O-CG2 3.35Å; I178-V181 PolarHBondContact O-N 2.98Å; I178-V181 VanDerWaalsContact O-N 3.09Å; I178-V241 HydrophobicContact CD1-CG1 4.34Å; I178-F245 HydrophobicContact CB-CD1 4.23Å; I178-F245 HydrophobicContact CB-CD2 4.43Å; I178-F245 HydrophobicContact CB-CE1 4.17Å; I178-F245 HydrophobicContact CB-CE2 4.38Å; I178-F245 HydrophobicContact CB-CG 4.34Å; I178-F245 HydrophobicContact CB-CZ 4.24Å; I178-F245 HydrophobicContact CD1-CB 3.7Å; I178-F245 HydrophobicContact CD1-CD1 4.11Å; I178-F245 HydrophobicContact CD1-CD2 4.34Å; I178-F245 HydrophobicContact CD1-CG 3.78Å; I178-F245 HydrophobicContact CG1-CB 4.23Å; I178-F245 HydrophobicContact CG1-CD1 3.65Å; I178-F245 HydrophobicContact CG1-CD2 4.37Å; I178-F245 HydrophobicContact CG1-CE1 4.04Å; I178-F245 HydrophobicContact CG1-CG 3.81Å; I178-F245 HydrophobicContact CG2-CD1 4.32Å; I178-F245 HydrophobicContact CG2-CE1 3.82Å; I178-F245 HydrophobicContact CG2-CZ 3.92Å
179	I	97.4	Very high	97.2	Very high	33 Å²	33	22.9 Å²	22.9	17%	0.169	12%	0.118	C	C	.	.	G	3₁₀ helix	trans	-63.6	-18.2	179.9	-159.2	58.5	0	0	0	113.4	S176 N177 P182 C400 I403 V404	S176-I179 WeakPolarHBondContact O-CG2 3.36Å; S176-I179 PolarHBondContact O-N 3.36Å; N177-I179 PolarHBondContact O-N 3.3Å; N177-I179 VanDerWaalsContact O-N 3.16Å; I179-P182 WeakPolarHBondContact O-CD 3.28Å; I179-C400 HydrophobicContact CG1-CB 4.35Å; I179-C400 PolarHBondContact O-SG 3.09Å; I179-I403 HydrophobicContact CD1-CB 3.91Å; I179-I403 HydrophobicContact CD1-CD1 4.2Å; I179-I403 HydrophobicContact CD1-CG2 3.52Å; I179-I403 HydrophobicContact CG1-CB 4.22Å; I179-I403 HydrophobicContact CG1-CG2 4.12Å; I179-V404 HydrophobicContact CG1-CB 4.44Å; I179-V404 HydrophobicContact CG2-CB 3.82Å; I179-V404 HydrophobicContact CG2-CG2 3.84Å
180	W	98.5	Very high	97	Very high	4 Å²	4	20.4 Å²	20.4	2%	0.015	11%	0.109	C	C	.	.	G	3₁₀ helix	trans	-84.3	-12.9	178.9	-54.9	119.8	0	0	0	112.9	V148 N177 I178 L183 L184 F397 C400 V404 I418 P419 L422	V148-W180 HydrophobicContact CG1-CG 4.17Å; N177-W180 PolarHBondContact O-N 3.29Å; N177-W180 VanDerWaalsContact O-N 3.1Å; I178-W180 PolarHBondContact O-N 3.46Å; I178-W180 VanDerWaalsContact O-N 3.12Å; W180-L183 HydrophobicContact CE3-CD2 3.9Å; W180-L183 HydrophobicContact CZ3-CD2 4.3Å; W180-L183 WeakPolarHBondContact O-CB 3.29Å; W180-L183 PolarHBondContact O-N 2.9Å; W180-L183 VanDerWaalsContact O-N 3.15Å; W180-L184 WeakPolarHBondContact O-CG 3.5Å; W180-L184 PolarHBondContact O-N 3.45Å; W180-F397 HydrophobicContact CZ3-CD2 4.25Å; W180-F397 HydrophobicContact CZ3-CE2 4.32Å; W180-C400 HydrophobicContact CE3-CB 3.9Å; W180-C400 HydrophobicContact CZ3-CB 3.71Å; W180-V404 HydrophobicContact CH2-CG1 4.05Å; W180-V404 HydrophobicContact CZ2-CG1 3.98Å; W180-I418 HydrophobicContact CD2-CG2 4.35Å; W180-I418 HydrophobicContact CH2-CG2 4.33Å; W180-I418 HydrophobicContact CZ2-CB 4.14Å; W180-I418 HydrophobicContact CZ2-CG2 3.5Å; W180-P419 HydrophobicContact CH2-CB 3.97Å; W180-P419 HydrophobicContact CZ2-CB 4.45Å; W180-L422 HydrophobicContact CD2-CD1 4.02Å; W180-L422 HydrophobicContact CE3-CD1 3.57Å; W180-L422 HydrophobicContact CH2-CD1 3.81Å; W180-L422 HydrophobicContact CZ2-CD1 4.23Å; W180-L422 HydrophobicContact CZ3-CD1 3.45Å; W180-L422 VanDerWaalsContact CZ3-CD1 3.45Å
181	V	98.5	Very high	96.7	Very high	1 Å²	1	22.1 Å²	22.1	1%	0.006	13%	0.128	C	C	.	.	H	α-helix	trans	-59	-46.3	179.9	175.8	0	0	0	0	112.7	V167 I178 L183 L184 M185 F238 V241	V167-V181 HydrophobicContact CG1-CG2 4.28Å; V167-V181 HydrophobicContact CG2-CG2 3.87Å; I178-V181 HydrophobicContact CD1-CG2 3.95Å; I178-V181 WeakPolarHBondContact O-CB 3.36Å; I178-V181 WeakPolarHBondContact O-CG2 3.35Å; I178-V181 PolarHBondContact O-N 2.98Å; I178-V181 VanDerWaalsContact O-N 3.09Å; V181-L183 VanDerWaalsContact C-N 3.29Å; V181-L183 PolarHBondContact O-N 3.45Å; V181-L184 PolarHBondContact O-N 3.44Å; V181-L184 VanDerWaalsContact O-N 3.13Å; V181-M185 HydrophobicContact CG1-CG 4.42Å; V181-M185 HydrophobicContact CG1-SD 4.07Å; V181-M185 WeakPolarHBondContact O-CG 3.32Å; V181-M185 PolarHBondContact O-N 3.24Å; V181-F238 HydrophobicContact CG1-CB 3.83Å; V181-F238 HydrophobicContact CG1-CD1 4.47Å; V181-V241 HydrophobicContact CG2-CG1 4.37Å
182	P	97.9	Very high	96.4	Very high	64 Å²	64	23.7 Å²	23.7	42%	0.416	14%	0.139	S	C	.	.	H	α-helix	trans	-58.2	-38.8	174	-26.1	35.3	0	0	0	113.5	I179 C186 V396	I179-P182 WeakPolarHBondContact O-CD 3.28Å; P182-C186 WeakPolarHBondContact O-CB 3.46Å; P182-C186 PolarHBondContact O-N 2.98Å; P182-V396 HydrophobicContact CB-CG1 4.36Å
183	L	98.4	Very high	96.2	Very high	1 Å²	1	21 Å²	21	1%	0.005	13%	0.128	C	C	.	.	H	α-helix	trans	-63.7	-43.8	175	174.3	61.3	0	0	0	111.2	W180 V181 C186 I187 E393 V396 F397 L422 F426	W180-L183 HydrophobicContact CE3-CD2 3.9Å; W180-L183 HydrophobicContact CZ3-CD2 4.3Å; W180-L183 WeakPolarHBondContact O-CB 3.29Å; W180-L183 PolarHBondContact O-N 2.9Å; W180-L183 VanDerWaalsContact O-N 3.15Å; V181-L183 VanDerWaalsContact C-N 3.29Å; V181-L183 PolarHBondContact O-N 3.45Å; L183-C186 WeakPolarHBondContact O-CB 3.31Å; L183-C186 PolarHBondContact O-N 3.38Å; L183-I187 HydrophobicContact CD1-CD1 3.88Å; L183-I187 HydrophobicContact CD1-CG1 4.08Å; L183-I187 HydrophobicContact CG-CD1 3.8Å; L183-I187 HydrophobicContact CG-CG1 4.44Å; L183-I187 VanDerWaalsContact O-CG1 3.26Å; L183-I187 WeakPolarHBondContact O-CG1 3.07Å; L183-I187 PolarHBondContact O-N 2.91Å; L183-E393 WeakPolarHBondContact CD1-O 3.33Å; L183-V396 HydrophobicContact CB-CG1 4.12Å; L183-V396 HydrophobicContact CD1-CG1 4.4Å; L183-F397 HydrophobicContact CD1-CB 3.92Å; L183-F397 HydrophobicContact CD2-CB 4.25Å; L183-F397 HydrophobicContact CD2-CD2 4.13Å; L183-L422 HydrophobicContact CD2-CD1 4Å; L183-F426 HydrophobicContact CD1-CZ 4.38Å; L183-F426 HydrophobicContact CD2-CE2 4.33Å
184	L	98.5	Very high	95.9	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-64.8	-41.6	178.5	-66.5	168.5	0	0	0	112.5	S151 V152 S155 V167 W180 V181 C186 I187 H188 F238	S151-L184 WeakPolarHBondContact OG-CD1 3.2Å; V152-L184 HydrophobicContact CB-CD2 4.29Å; V152-L184 HydrophobicContact CG2-CD2 3.71Å; S155-L184 PolarHBondContact OG-O 3.39Å; V167-L184 HydrophobicContact CB-CD1 3.52Å; V167-L184 HydrophobicContact CG1-CD1 3.86Å; V167-L184 HydrophobicContact CG2-CD1 3.55Å; W180-L184 WeakPolarHBondContact O-CG 3.5Å; W180-L184 PolarHBondContact O-N 3.45Å; V181-L184 PolarHBondContact O-N 3.44Å; V181-L184 VanDerWaalsContact O-N 3.13Å; L184-C186 VanDerWaalsContact C-N 3.3Å; L184-C186 PolarHBondContact O-N 3.02Å; L184-I187 PolarHBondContact O-N 3.49Å; L184-H188 VanDerWaalsContact O-CB 3.3Å; L184-H188 WeakPolarHBondContact O-CB 3.44Å; L184-H188 PolarHBondContact O-N 3.19Å; L184-F238 HydrophobicContact CB-CD1 4.16Å; L184-F238 HydrophobicContact CB-CE1 3.69Å; L184-F238 HydrophobicContact CB-CZ 4.14Å; L184-F238 HydrophobicContact CD1-CE1 4.23Å
185	M	97.7	Very high	95.7	Very high	43 Å²	43	25.1 Å²	25.1	21%	0.212	15%	0.152	C	C	.	.	H	α-helix	trans	-58.9	-44.2	172.6	-71.1	169.4	70.6	0	0	111	V181 H188 T189 C235 F238 V239	V181-M185 HydrophobicContact CG1-CG 4.42Å; V181-M185 HydrophobicContact CG1-SD 4.07Å; V181-M185 WeakPolarHBondContact O-CG 3.32Å; V181-M185 PolarHBondContact O-N 3.24Å; M185-H188 PolarHBondContact O-N 3.37Å; M185-T189 PolarHBondContact O-N 3.05Å; M185-T189 PolarHBondContact O-OG1 2.94Å; M185-C235 HydrophobicContact CE-CB 3.67Å; M185-C235 HydrophobicContact CG-CB 4.06Å; M185-F238 HydrophobicContact CG-CB 3.47Å; M185-F238 VanDerWaalsContact CG-CB 3.47Å; M185-F238 HydrophobicContact CG-CD2 3.73Å; M185-F238 HydrophobicContact CG-CG 3.69Å; M185-F238 HydrophobicContact SD-CB 3.99Å; M185-V239 HydrophobicContact CE-CG2 4.34Å
186	C	97.1	Very high	95.6	Very high	14 Å²	14	28 Å²	28	10%	0.095	17%	0.168	C	C	.	.	H	α-helix	trans	-61.6	-51.9	176.9	-179.6	0	0	0	0	111.5	P182 L183 L184 H188 T189 S190 V396	P182-C186 WeakPolarHBondContact O-CB 3.46Å; P182-C186 PolarHBondContact O-N 2.98Å; L183-C186 WeakPolarHBondContact O-CB 3.31Å; L183-C186 PolarHBondContact O-N 3.38Å; L184-C186 VanDerWaalsContact C-N 3.3Å; L184-C186 PolarHBondContact O-N 3.02Å; C186-H188 PolarHBondContact O-N 3.28Å; C186-T189 PolarHBondContact O-N 3.03Å; C186-S190 WeakPolarHBondContact O-CA 3.42Å; C186-S190 WeakPolarHBondContact O-CB 3.45Å; C186-S190 PolarHBondContact O-N 2.87Å; C186-S190 PolarHBondContact O-OG 3.4Å; C186-V396 HydrophobicContact CB-CB 4.28Å; C186-V396 HydrophobicContact CB-CG1 4.28Å; C186-V396 HydrophobicContact CB-CG2 4.1Å
187	I	96.6	Very high	95.3	Very high	4 Å²	4	27 Å²	27	2%	0.021	16%	0.158	C	C	.	.	H	α-helix	trans	-58	-39.9	178.8	-66.7	163.5	0	0	0	111	V152 S155 L156 L183 L184 T189 S190 E393 F426	V152-I187 HydrophobicContact CG1-CD1 4.18Å; S155-I187 WeakPolarHBondContact OG-CG2 3.43Å; L156-I187 HydrophobicContact CD2-CG2 3.53Å; L156-I187 HydrophobicContact CG-CG2 3.75Å; L183-I187 HydrophobicContact CD1-CD1 3.88Å; L183-I187 HydrophobicContact CD1-CG1 4.08Å; L183-I187 HydrophobicContact CG-CD1 3.8Å; L183-I187 HydrophobicContact CG-CG1 4.44Å; L183-I187 VanDerWaalsContact O-CG1 3.26Å; L183-I187 WeakPolarHBondContact O-CG1 3.07Å; L183-I187 PolarHBondContact O-N 2.91Å; L184-I187 PolarHBondContact O-N 3.49Å; I187-T189 VanDerWaalsContact C-N 3.31Å; I187-T189 PolarHBondContact O-N 2.96Å; I187-S190 PolarHBondContact O-OG 3.2Å; I187-E393 HydrophobicContact CG1-CG 4.05Å; I187-F426 HydrophobicContact CD1-CZ 3.75Å; I187-F426 HydrophobicContact CG1-CZ 4.25Å
188	H	96.7	Very high	94.9	Very high	19 Å²	19	27.6 Å²	27.6	9%	0.088	16%	0.161	C	C	.	.	H	α-helix	trans	-67	-33.3	-177.5	-169.4	57.1	0	0	0	112.8	S155 H158 G160 L184 M185 C186 P234 F238	S155-H188 WeakPolarHBondContact OG-CA 3.09Å; S155-H188 WeakPolarHBondContact OG-CB 3.33Å; S155-H188 PolarHBondContact OG-N 2.68Å; S155-H188 VanDerWaalsContact OG-N 3.13Å; H158-H188 PolarHBondContact ND1-O 3.31Å; H158-H188 PolarHBondContact O-CE1 2.92Å; G160-H188 PolarHBondContact N-CE1 3.41Å; L184-H188 VanDerWaalsContact O-CB 3.3Å; L184-H188 WeakPolarHBondContact O-CB 3.44Å; L184-H188 PolarHBondContact O-N 3.19Å; M185-H188 PolarHBondContact O-N 3.37Å; C186-H188 PolarHBondContact O-N 3.28Å; H188-P234 PolarHBondContact CD2-O 3.07Å; H188-F238 HydrophobicContact CB-CE2 4.07Å
189	T	96.1	Very high	94.3	Very high	9 Å²	9	27.8 Å²	27.8	6%	0.055	17%	0.171	C	C	.	.	H	α-helix	trans	-110.5	-17.4	-169.3	57.1	0	0	0	0	114.6	M185 C186 I187 G191 S192 L193 S230 P234 C235	M185-T189 PolarHBondContact O-N 3.05Å; M185-T189 PolarHBondContact O-OG1 2.94Å; C186-T189 PolarHBondContact O-N 3.03Å; I187-T189 VanDerWaalsContact C-N 3.31Å; I187-T189 PolarHBondContact O-N 2.96Å; T189-G191 VanDerWaalsContact C-N 3.28Å; T189-G191 PolarHBondContact O-N 3.19Å; T189-S192 PolarHBondContact O-N 3.03Å; T189-L193 WeakPolarHBondContact O-CB 3.48Å; T189-L193 PolarHBondContact O-N 2.91Å; T189-S230 WeakPolarHBondContact CG2-O 3.46Å; T189-P234 HydrophobicContact CG2-CB 3.92Å; T189-C235 WeakPolarHBondContact CG2-SG 3.33Å
190	S	94.1	Very high	93.4	Very high	7 Å²	7	33.9 Å²	33.9	5%	0.049	20%	0.199	C	C	.	.	H	α-helix	trans	-54.3	-41.1	-175.2	62.2	0	0	0	0	113	C186 I187 S194 E393	C186-S190 WeakPolarHBondContact O-CA 3.42Å; C186-S190 WeakPolarHBondContact O-CB 3.45Å; C186-S190 PolarHBondContact O-N 2.87Å; C186-S190 PolarHBondContact O-OG 3.4Å; I187-S190 PolarHBondContact O-OG 3.2Å; S190-S194 VanDerWaalsContact O-CB 3.29Å; S190-S194 WeakPolarHBondContact O-CB 3.2Å; S190-S194 PolarHBondContact O-N 3.46Å; S190-E393 WeakPolarHBondContact CB-OE1 3.36Å; S190-E393 PolarHBondContact OG-OE1 3.25Å
191	G	91	Very high	92.1	Very high	37 Å²	37	38.7 Å²	38.7	38%	0.381	23%	0.225	S	C	.	.	H	α-helix	trans	-64.8	-51.3	178.8	0	0	0	0	0	112.5	T189 S194 Q195	T189-G191 VanDerWaalsContact C-N 3.28Å; T189-G191 PolarHBondContact O-N 3.19Å; G191-S194 WeakPolarHBondContact O-CB 3.37Å; G191-S194 PolarHBondContact O-N 3.07Å; G191-Q195 PolarHBondContact O-N 3.28Å
192	S	91.7	Very high	90.7	Very high	49 Å²	49	50.6 Å²	50.6	34%	0.343	27%	0.27	S	S	.	.	H	α-helix	trans	-62.8	-42.4	177	179.7	0	0	0	0	111.4	T189 S194 Q195 N196	T189-S192 PolarHBondContact O-N 3.03Å; S192-S194 PolarHBondContact O-N 2.61Å; S192-Q195 PolarHBondContact O-N 2.66Å; S192-N196 WeakPolarHBondContact O-CB 3.46Å; S192-N196 VanDerWaalsContact O-CG 3.24Å; S192-N196 PolarHBondContact O-N 3.35Å; S192-N196 PolarHBondContact O-ND2 3.21Å; S192-N196 PolarHBondContact OG-ND2 2.99Å
193	L	92.7	Very high	89.5	Confident	20 Å²	20	48.5 Å²	48.5	11%	0.105	26%	0.256	C	S	.	.	H	α-helix	trans	-60.9	-45.2	176.2	-174.6	63.2	0	0	0	111.5	T189 Q195 N196 M197 V226 I227 F388	T189-L193 WeakPolarHBondContact O-CB 3.48Å; T189-L193 PolarHBondContact O-N 2.91Å; L193-Q195 VanDerWaalsContact C-N 3.33Å; L193-Q195 PolarHBondContact O-N 2.76Å; L193-N196 PolarHBondContact O-N 3.39Å; L193-M197 HydrophobicContact CD1-CE 3.61Å; L193-M197 HydrophobicContact CD1-CG 4.37Å; L193-M197 HydrophobicContact CD1-SD 4.11Å; L193-M197 HydrophobicContact CG-CE 4.12Å; L193-M197 HydrophobicContact CG-SD 4.09Å; L193-M197 WeakPolarHBondContact O-CB 3.48Å; L193-M197 WeakPolarHBondContact O-CG 3.21Å; L193-M197 PolarHBondContact O-N 2.98Å; L193-V226 HydrophobicContact CD1-CG1 4.37Å; L193-I227 HydrophobicContact CD1-CG1 4.1Å; L193-F388 HydrophobicContact CB-CE1 4.49Å; L193-F388 HydrophobicContact CD2-CE1 3.84Å; L193-F388 HydrophobicContact CD2-CZ 4.06Å; L193-F388 HydrophobicContact CG-CE1 3.91Å; L193-F388 HydrophobicContact CG-CZ 4.44Å
194	S	92.1	Very high	88.8	Confident	28 Å²	28	50.4 Å²	50.4	20%	0.196	27%	0.269	C	S	.	.	H	α-helix	trans	-60.4	-43.3	176	-170.4	0	0	0	0	111.7	S190 G191 S192 F198	S190-S194 VanDerWaalsContact O-CB 3.29Å; S190-S194 WeakPolarHBondContact O-CB 3.2Å; S190-S194 PolarHBondContact O-N 3.46Å; G191-S194 WeakPolarHBondContact O-CB 3.37Å; G191-S194 PolarHBondContact O-N 3.07Å; S192-S194 PolarHBondContact O-N 2.61Å; S194-F198 PolarHBondContact O-N 3.47Å
195	Q	90.8	Very high	88.1	Confident	92 Å²	92	51.3 Å²	51.3	43%	0.43	28%	0.276	S	S	.	.	H	α-helix	trans	-67	-42	179.6	-171.7	-178.8	6.3	0	0	111.7	G191 S192 L193 M197 G199 H200	G191-Q195 PolarHBondContact O-N 3.28Å; S192-Q195 PolarHBondContact O-N 2.66Å; L193-Q195 VanDerWaalsContact C-N 3.33Å; L193-Q195 PolarHBondContact O-N 2.76Å; Q195-M197 VanDerWaalsContact C-N 3.34Å; Q195-M197 PolarHBondContact O-N 3.14Å; Q195-G199 WeakPolarHBondContact O-CA 3.36Å; Q195-G199 PolarHBondContact O-N 3.33Å; Q195-H200 PolarHBondContact NE2-CE1 2.91Å; Q195-H200 PolarHBondContact NE2-NE2 2.93Å
196	N	90.7	Very high	87.5	Confident	81 Å²	81	53.8 Å²	53.8	43%	0.433	29%	0.293	S	S	.	.	H	α-helix	trans	-69.8	-30	179.1	-68.7	-29.3	0	0	0	112.9	S192 L193 V226 S230	S192-N196 WeakPolarHBondContact O-CB 3.46Å; S192-N196 VanDerWaalsContact O-CG 3.24Å; S192-N196 PolarHBondContact O-N 3.35Å; S192-N196 PolarHBondContact O-ND2 3.21Å; S192-N196 PolarHBondContact OG-ND2 2.99Å; L193-N196 PolarHBondContact O-N 3.39Å; N196-V226 HydrophobicContact CB-CG1 3.77Å; N196-S230 PolarHBondContact ND2-OG 3.06Å
197	M	89.1	Confident	87.1	Confident	26 Å²	26	56.3 Å²	56.3	13%	0.128	31%	0.306	C	S	.	.	H	α-helix	trans	-86	-39.3	179.4	-74.9	-177.5	169.5	0	0	113.8	L193 Q195 L212 M215 V223 V226 I227 F388	L193-M197 HydrophobicContact CD1-CE 3.61Å; L193-M197 HydrophobicContact CD1-CG 4.37Å; L193-M197 HydrophobicContact CD1-SD 4.11Å; L193-M197 HydrophobicContact CG-CE 4.12Å; L193-M197 HydrophobicContact CG-SD 4.09Å; L193-M197 WeakPolarHBondContact O-CB 3.48Å; L193-M197 WeakPolarHBondContact O-CG 3.21Å; L193-M197 PolarHBondContact O-N 2.98Å; Q195-M197 VanDerWaalsContact C-N 3.34Å; Q195-M197 PolarHBondContact O-N 3.14Å; M197-L212 HydrophobicContact SD-CD1 4.09Å; M197-M215 HydrophobicContact CB-CE 4.39Å; M197-V223 HydrophobicContact CE-CG1 4.13Å; M197-V226 HydrophobicContact CG-CG1 4.04Å; M197-I227 HydrophobicContact CE-CD1 4Å; M197-I227 HydrophobicContact CE-CG1 3.54Å; M197-F388 HydrophobicContact SD-CE1 4.12Å; M197-F388 HydrophobicContact SD-CZ 3.96Å
198	F	89.5	Confident	86.8	Confident	14 Å²	14	56.6 Å²	56.6	6%	0.061	31%	0.307	C	S	.	.	H	α-helix	trans	-123.8	-0.5	-168.8	-52.4	-70.7	0	0	0	114	S194 W208 R211 L212 M215 F388	S194-F198 PolarHBondContact O-N 3.47Å; F198-W208 HydrophobicContact CD1-CB 4.35Å; F198-W208 HydrophobicContact CE1-CB 4.02Å; F198-W208 HydrophobicContact CE2-CB 4.4Å; F198-W208 HydrophobicContact CZ-CB 4.04Å; F198-R211 HydrophobicContact CD1-CB 4.32Å; F198-R211 HydrophobicContact CE1-CB 3.97Å; F198-L212 HydrophobicContact CE1-CB 4.47Å; F198-L212 HydrophobicContact CZ-CB 4.15Å; F198-L212 HydrophobicContact CZ-CD1 4.15Å; F198-M215 HydrophobicContact CD1-CE 4.18Å; F198-M215 HydrophobicContact CE1-CE 3.52Å; F198-M215 HydrophobicContact CZ-CE 4.03Å; F198-F388 HydrophobicContact CD2-CB 4.25Å; F198-F388 HydrophobicContact CD2-CD1 4.44Å; F198-F388 HydrophobicContact CD2-CG 4.34Å; F198-F388 HydrophobicContact CE2-CB 3.81Å; F198-F388 AromaticContact CE2-CD1 3.86Å; F198-F388 HydrophobicContact CE2-CD1 3.86Å; F198-F388 AromaticContact CE2-CD2 3.89Å; F198-F388 HydrophobicContact CE2-CD2 3.89Å; F198-F388 HydrophobicContact CE2-CE1 4.39Å; F198-F388 HydrophobicContact CE2-CE2 4.41Å; F198-F388 AromaticContact CE2-CG 3.57Å; F198-F388 HydrophobicContact CE2-CG 3.57Å; F198-F388 HydrophobicContact CZ-CD2 4.34Å; F198-F388 HydrophobicContact CZ-CG 4.43Å
199	G	85.1	Confident	86.6	Confident	38 Å²	38	59.1 Å²	59.1	39%	0.392	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.4	-155.8	-173.8	0	0	0	0	0	112.8	Q195 D201	Q195-G199 WeakPolarHBondContact O-CA 3.36Å; Q195-G199 PolarHBondContact O-N 3.33Å; G199-D201 PolarHBondContact O-N 2.88Å
200	H	77.7	Confident	86.4	Confident	160 Å²	160	65.9 Å²	65.9	74%	0.741	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-1.6	176	-73.4	-74.5	0	0	0	113.7	Q195 R202	Q195-H200 PolarHBondContact NE2-CE1 2.91Å; Q195-H200 PolarHBondContact NE2-NE2 2.93Å; H200-R202 PolarHBondContact O-N 3.3Å
201	D	71.5	Confident	86.2	Confident	105 Å²	105	70.1 Å²	70.1	56%	0.561	36%	0.363	S	S	*	.			trans	-68.2	116.8	-178.4	-75.4	-11.9	0	0	0	110.9	G199 C203 R211	G199-D201 PolarHBondContact O-N 2.88Å; D201-C203 PolarHBondContact O-N 2.94Å; D201-R211 IonicContact OD2-NH1 2.82Å
202	R	70	Confident	86.3	Confident	252 Å²	252	69.7 Å²	69.7	95%	0.951	35%	0.352	S	S	*	.			trans	-71.4	82.8	167.3	-67.5	-171.1	-175.1	-180	4.7	109.5	H200	H200-R202 PolarHBondContact O-N 3.3Å
203	C	72.2	Confident	86.4	Confident	19 Å²	19	72.6 Å²	72.6	13%	0.128	36%	0.363	C	S	.	.			trans	-68.8	138.6	174.9	-66.3	0	0	0	0	110.6	D201 L207 W208 R211	D201-C203 PolarHBondContact O-N 2.94Å; C203-L207 HydrophobicContact CB-CB 4.22Å; C203-L207 HydrophobicContact CB-CD2 4.05Å; C203-L207 HydrophobicContact CB-CG 4.26Å; C203-W208 HydrophobicContact CB-CB 3.9Å; C203-R211 PolarHBondContact SG-NH1 2.98Å; C203-R211 VanDerWaalsContact SG-NH1 3.4Å
204	S	83.5	Confident	86.4	Confident	41 Å²	41	78.6 Å²	78.6	29%	0.287	39%	0.385	S	S	.	.			trans	-60.9	161	166.2	65.3	0	0	0	0	110.6	T206 L207 W208	S204-T206 VanDerWaalsContact C-N 3.26Å; S204-T206 PolarHBondContact O-N 3.45Å; S204-T206 PolarHBondContact OG-OG1 3.42Å; S204-L207 PolarHBondContact O-N 3.29Å; S204-L207 WeakPolarHBondContact OG-CB 3.25Å; S204-L207 PolarHBondContact OG-N 3.14Å; S204-W208 VanDerWaalsContact O-CD1 3.23Å; S204-W208 PolarHBondContact O-N 3.35Å; S204-W208 VanDerWaalsContact O-N 3.09Å
205	S	84.2	Confident	86.4	Confident	19 Å²	19	79.2 Å²	79.2	13%	0.133	39%	0.386	C	S	.	.	H	α-helix	trans	-58.8	-40.3	-177.7	-55.6	0	0	0	0	112.9	L207 I209 N385 I386	S205-L207 VanDerWaalsContact C-N 3.31Å; S205-L207 PolarHBondContact O-N 3.28Å; S205-I209 WeakPolarHBondContact O-CB 3.21Å; S205-I209 VanDerWaalsContact O-CD1 3.25Å; S205-I209 WeakPolarHBondContact O-CD1 3.29Å; S205-I209 WeakPolarHBondContact O-CG1 3.44Å; S205-I209 PolarHBondContact O-N 2.87Å; S205-N385 PolarHBondContact N-OD1 3.35Å; S205-I386 WeakPolarHBondContact OG-CG2 3.44Å; S205-I386 PolarHBondContact OG-N 3.26Å; S205-I386 PolarHBondContact OG-O 2.94Å
206	T	85.4	Confident	86.6	Confident	95 Å²	95	79 Å²	79	58%	0.583	38%	0.383	S	S	*	.	H	α-helix	trans	-66.1	-33.4	176.9	53	0	0	0	0	112.8	S204 K210	S204-T206 VanDerWaalsContact C-N 3.26Å; S204-T206 PolarHBondContact O-N 3.45Å; S204-T206 PolarHBondContact OG-OG1 3.42Å; T206-K210 VanDerWaalsContact O-CG 3.32Å; T206-K210 WeakPolarHBondContact O-CG 3.19Å; T206-K210 PolarHBondContact O-N 2.94Å
207	L	87.8	Confident	86.7	Confident	68 Å²	68	80.4 Å²	80.4	36%	0.356	40%	0.395	S	S	.	.	H	α-helix	trans	-75.6	-48.2	-177.1	-175.5	64.1	0	0	0	111.9	C203 S204 S205 I209 K210 R211	C203-L207 HydrophobicContact CB-CB 4.22Å; C203-L207 HydrophobicContact CB-CD2 4.05Å; C203-L207 HydrophobicContact CB-CG 4.26Å; S204-L207 PolarHBondContact O-N 3.29Å; S204-L207 WeakPolarHBondContact OG-CB 3.25Å; S204-L207 PolarHBondContact OG-N 3.14Å; S205-L207 VanDerWaalsContact C-N 3.31Å; S205-L207 PolarHBondContact O-N 3.28Å; L207-I209 VanDerWaalsContact C-N 3.3Å; L207-I209 PolarHBondContact O-N 3.47Å; L207-K210 PolarHBondContact O-N 2.83Å; L207-R211 WeakPolarHBondContact O-CG 3.14Å; L207-R211 PolarHBondContact O-N 3.02Å
208	W	90.9	Very high	87	Confident	10 Å²	10	82 Å²	82	4%	0.038	41%	0.406	C	S	.	.	H	α-helix	trans	-67	-33.3	179.2	69.6	-111.6	0	0	0	111.6	F198 C203 S204 R211 L212 I386 F388 F391	F198-W208 HydrophobicContact CD1-CB 4.35Å; F198-W208 HydrophobicContact CE1-CB 4.02Å; F198-W208 HydrophobicContact CE2-CB 4.4Å; F198-W208 HydrophobicContact CZ-CB 4.04Å; C203-W208 HydrophobicContact CB-CB 3.9Å; S204-W208 VanDerWaalsContact O-CD1 3.23Å; S204-W208 PolarHBondContact O-N 3.35Å; S204-W208 VanDerWaalsContact O-N 3.09Å; W208-R211 PolarHBondContact O-N 3.25Å; W208-L212 HydrophobicContact CE3-CD2 4.4Å; W208-L212 HydrophobicContact CZ3-CD2 4.2Å; W208-L212 WeakPolarHBondContact O-CB 3.16Å; W208-L212 PolarHBondContact O-N 2.86Å; W208-I386 PolarHBondContact NE1-O 3.35Å; W208-F388 HydrophobicContact CD2-CB 4.07Å; W208-F388 HydrophobicContact CD2-CD2 4.34Å; W208-F388 HydrophobicContact CE3-CB 4.34Å; W208-F388 AromaticContact CE3-CD2 3.75Å; W208-F388 HydrophobicContact CE3-CD2 3.75Å; W208-F388 HydrophobicContact CG-CB 4.25Å; W208-F388 AromaticContact CZ3-CD2 3.86Å; W208-F388 HydrophobicContact CZ3-CD2 3.86Å; W208-F391 HydrophobicContact CH2-CB 4.33Å; W208-F391 AromaticContact CH2-CD1 3.43Å; W208-F391 HydrophobicContact CH2-CD1 3.43Å; W208-F391 VanDerWaalsContact CH2-CD1 3.43Å; W208-F391 HydrophobicContact CH2-CD2 4.32Å; W208-F391 AromaticContact CH2-CE1 3.73Å; W208-F391 HydrophobicContact CH2-CE1 3.73Å; W208-F391 AromaticContact CH2-CG 3.76Å; W208-F391 HydrophobicContact CH2-CG 3.76Å; W208-F391 HydrophobicContact CH2-CZ 4.29Å; W208-F391 HydrophobicContact CZ2-CB 3.96Å; W208-F391 AromaticContact CZ2-CD1 3.91Å; W208-F391 HydrophobicContact CZ2-CD1 3.91Å; W208-F391 HydrophobicContact CZ2-CD2 4.16Å; W208-F391 HydrophobicContact CZ2-CE1 4.48Å; W208-F391 AromaticContact CZ2-CG 3.73Å; W208-F391 HydrophobicContact CZ2-CG 3.73Å; W208-F391 HydrophobicContact CZ3-CD1 4.41Å
209	I	91.6	Very high	87.2	Confident	71 Å²	71	86.1 Å²	86.1	36%	0.364	43%	0.426	S	S	.	.	H	α-helix	trans	-60.9	-49.1	173.9	-69.7	167.2	0	0	0	110.6	S205 L207 L212 L213	S205-I209 WeakPolarHBondContact O-CB 3.21Å; S205-I209 VanDerWaalsContact O-CD1 3.25Å; S205-I209 WeakPolarHBondContact O-CD1 3.29Å; S205-I209 WeakPolarHBondContact O-CG1 3.44Å; S205-I209 PolarHBondContact O-N 2.87Å; L207-I209 VanDerWaalsContact C-N 3.3Å; L207-I209 PolarHBondContact O-N 3.47Å; I209-L212 PolarHBondContact O-N 3.44Å; I209-L213 HydrophobicContact CG2-CD1 4.02Å; I209-L213 WeakPolarHBondContact O-CG 3.35Å; I209-L213 PolarHBondContact O-N 3.26Å
210	K	91.9	Very high	87.7	Confident	151 Å²	151	87.5 Å²	87.5	66%	0.657	43%	0.428	S	S	*	.	H	α-helix	trans	-62.2	-45	178.3	-75.1	179.2	179.7	-172.9	0	112.1	T206 L207 L212 Y214	T206-K210 VanDerWaalsContact O-CG 3.32Å; T206-K210 WeakPolarHBondContact O-CG 3.19Å; T206-K210 PolarHBondContact O-N 2.94Å; L207-K210 PolarHBondContact O-N 2.83Å; K210-L212 VanDerWaalsContact C-N 3.35Å; K210-Y214 WeakPolarHBondContact O-CB 3.37Å; K210-Y214 PolarHBondContact O-N 3.13Å
211	R	91.2	Very high	88.5	Confident	97 Å²	97	86 Å²	86	37%	0.366	42%	0.424	S	S	.	.	H	α-helix	trans	-61.3	-43.7	176.5	-74.6	-177	177.1	-173.6	-0.5	111.2	F198 D201 C203 L207 W208 Y214 M215	F198-R211 HydrophobicContact CD1-CB 4.32Å; F198-R211 HydrophobicContact CE1-CB 3.97Å; D201-R211 IonicContact OD2-NH1 2.82Å; C203-R211 PolarHBondContact SG-NH1 2.98Å; C203-R211 VanDerWaalsContact SG-NH1 3.4Å; L207-R211 WeakPolarHBondContact O-CG 3.14Å; L207-R211 PolarHBondContact O-N 3.02Å; W208-R211 PolarHBondContact O-N 3.25Å; R211-Y214 PolarHBondContact O-N 2.97Å; R211-M215 VanDerWaalsContact O-CG 3.3Å; R211-M215 WeakPolarHBondContact O-CG 3.38Å; R211-M215 PolarHBondContact O-N 2.85Å
212	L	92.6	Very high	89.4	Confident	27 Å²	27	84 Å²	84	14%	0.141	42%	0.418	C	S	.	.	H	α-helix	trans	-62.5	-49.5	179.3	-171.7	63.8	0	0	0	111.4	M197 F198 W208 I209 K210 Y214 M215 F216 F388	M197-L212 HydrophobicContact SD-CD1 4.09Å; F198-L212 HydrophobicContact CE1-CB 4.47Å; F198-L212 HydrophobicContact CZ-CB 4.15Å; F198-L212 HydrophobicContact CZ-CD1 4.15Å; W208-L212 HydrophobicContact CE3-CD2 4.4Å; W208-L212 HydrophobicContact CZ3-CD2 4.2Å; W208-L212 WeakPolarHBondContact O-CB 3.16Å; W208-L212 PolarHBondContact O-N 2.86Å; I209-L212 PolarHBondContact O-N 3.44Å; K210-L212 VanDerWaalsContact C-N 3.35Å; L212-Y214 VanDerWaalsContact C-N 3.32Å; L212-Y214 PolarHBondContact O-N 3.3Å; L212-M215 HydrophobicContact CD1-CE 4.09Å; L212-M215 PolarHBondContact O-N 3.02Å; L212-F216 HydrophobicContact CD1-CD2 3.89Å; L212-F216 HydrophobicContact CD1-CE2 3.44Å; L212-F216 VanDerWaalsContact CD1-CE2 3.44Å; L212-F216 HydrophobicContact CD1-CZ 4.42Å; L212-F216 HydrophobicContact CD2-CE2 4.15Å; L212-F216 HydrophobicContact CG-CD2 3.78Å; L212-F216 HydrophobicContact CG-CE2 3.58Å; L212-F216 VanDerWaalsContact O-CD2 3.23Å; L212-F216 WeakPolarHBondContact O-CD2 3.37Å; L212-F216 PolarHBondContact O-N 3.09Å; L212-F388 HydrophobicContact CD2-CD2 4.47Å; L212-F388 HydrophobicContact CD2-CE2 3.95Å
213	L	93.6	Very high	90.5	Very high	110 Å²	110	72.3 Å²	72.3	58%	0.576	38%	0.375	S	S	*	.	H	α-helix	trans	-57	-46.7	175.7	-72.3	170.5	0	0	0	111.1	I209 M215 F216 T217	I209-L213 HydrophobicContact CG2-CD1 4.02Å; I209-L213 WeakPolarHBondContact O-CG 3.35Å; I209-L213 PolarHBondContact O-N 3.26Å; L213-M215 PolarHBondContact O-N 2.88Å; L213-F216 PolarHBondContact O-N 3.25Å; L213-T217 WeakPolarHBondContact O-CG2 3.34Å; L213-T217 PolarHBondContact O-N 2.97Å; L213-T217 PolarHBondContact O-OG1 3.13Å; L213-T217 VanDerWaalsContact O-OG1 3.11Å
214	Y	93.5	Very high	91.6	Very high	146 Å²	146	76.3 Å²	76.3	57%	0.573	39%	0.393	S	S	*	.	H	α-helix	trans	-59.1	-44.4	176.6	177.3	-96.2	0	0	0	112.7	K210 R211 L212 T217 T218	K210-Y214 WeakPolarHBondContact O-CB 3.37Å; K210-Y214 PolarHBondContact O-N 3.13Å; R211-Y214 PolarHBondContact O-N 2.97Å; L212-Y214 VanDerWaalsContact C-N 3.32Å; L212-Y214 PolarHBondContact O-N 3.3Å; Y214-T217 WeakPolarHBondContact CA-OG1 3.23Å; Y214-T217 PolarHBondContact O-N 3.41Å; Y214-T217 PolarHBondContact O-OG1 2.95Å; Y214-T218 HydrophobicContact CD2-CG2 4.01Å; Y214-T218 HydrophobicContact CE1-CG2 4.3Å; Y214-T218 HydrophobicContact CE2-CG2 3.61Å; Y214-T218 WeakPolarHBondContact O-CB 3.39Å; Y214-T218 PolarHBondContact O-N 3.41Å; Y214-T218 PolarHBondContact O-OG1 3.13Å
215	M	92	Very high	92	Very high	42 Å²	42	79.4 Å²	79.4	21%	0.207	41%	0.406	C	S	.	.	H	α-helix	trans	-64.8	-41.8	178.1	-72.9	-173.9	-64.3	0	0	112	M197 F198 R211 L212 L213 T217 H219 V223	M197-M215 HydrophobicContact CB-CE 4.39Å; F198-M215 HydrophobicContact CD1-CE 4.18Å; F198-M215 HydrophobicContact CE1-CE 3.52Å; F198-M215 HydrophobicContact CZ-CE 4.03Å; R211-M215 VanDerWaalsContact O-CG 3.3Å; R211-M215 WeakPolarHBondContact O-CG 3.38Å; R211-M215 PolarHBondContact O-N 2.85Å; L212-M215 HydrophobicContact CD1-CE 4.09Å; L212-M215 PolarHBondContact O-N 3.02Å; L213-M215 PolarHBondContact O-N 2.88Å; M215-T217 VanDerWaalsContact C-N 3.31Å; M215-T217 PolarHBondContact O-N 3.31Å; M215-H219 CarbonylContact O-C 3.56Å; M215-H219 VanDerWaalsContact O-C 3.22Å; M215-H219 WeakPolarHBondContact O-CA 3.22Å; M215-H219 PolarHBondContact O-N 2.94Å; M215-V223 HydrophobicContact CB-CG2 3.68Å
216	F	93.8	Very high	92.4	Very high	86 Å²	86	80.6 Å²	80.6	38%	0.377	41%	0.412	S	S	.	.	H	α-helix	trans	-64.4	-35.3	175.6	-84.2	-69.3	0	0	0	112.5	L212 L213 V223 M224 I227	L212-F216 HydrophobicContact CD1-CD2 3.89Å; L212-F216 HydrophobicContact CD1-CE2 3.44Å; L212-F216 VanDerWaalsContact CD1-CE2 3.44Å; L212-F216 HydrophobicContact CD1-CZ 4.42Å; L212-F216 HydrophobicContact CD2-CE2 4.15Å; L212-F216 HydrophobicContact CG-CD2 3.78Å; L212-F216 HydrophobicContact CG-CE2 3.58Å; L212-F216 VanDerWaalsContact O-CD2 3.23Å; L212-F216 WeakPolarHBondContact O-CD2 3.37Å; L212-F216 PolarHBondContact O-N 3.09Å; L213-F216 PolarHBondContact O-N 3.25Å; F216-V223 HydrophobicContact CD1-CB 4.41Å; F216-V223 HydrophobicContact CD1-CG1 3.88Å; F216-V223 HydrophobicContact CE1-CB 4.33Å; F216-V223 HydrophobicContact CE1-CG1 3.4Å; F216-V223 VanDerWaalsContact CE1-CG1 3.4Å; F216-V223 HydrophobicContact CE2-CG1 4.22Å; F216-V223 HydrophobicContact CG-CG1 4.46Å; F216-V223 HydrophobicContact CZ-CG1 3.58Å; F216-M224 HydrophobicContact CD1-CE 4.48Å; F216-M224 HydrophobicContact CE1-CE 3.65Å; F216-I227 HydrophobicContact CZ-CD1 4.41Å
217	T	94	Very high	92.8	Very high	111 Å²	111	78.5 Å²	78.5	68%	0.681	40%	0.397	S	S	*	.	H	α-helix	trans	-77.9	-35.5	179.2	52.8	0	0	0	0	113.4	L213 Y214 M215	L213-T217 WeakPolarHBondContact O-CG2 3.34Å; L213-T217 PolarHBondContact O-N 2.97Å; L213-T217 PolarHBondContact O-OG1 3.13Å; L213-T217 VanDerWaalsContact O-OG1 3.11Å; Y214-T217 WeakPolarHBondContact CA-OG1 3.23Å; Y214-T217 PolarHBondContact O-N 3.41Å; Y214-T217 PolarHBondContact O-OG1 2.95Å; M215-T217 VanDerWaalsContact C-N 3.31Å; M215-T217 PolarHBondContact O-N 3.31Å
218	T	95.4	Very high	93	Very high	59 Å²	59	80.2 Å²	80.2	36%	0.362	41%	0.406	S	S	.	.	H	α-helix	trans	-100.6	-30	-172.4	56.7	0	0	0	0	113.8	Y214	Y214-T218 HydrophobicContact CD2-CG2 4.01Å; Y214-T218 HydrophobicContact CE1-CG2 4.3Å; Y214-T218 HydrophobicContact CE2-CG2 3.61Å; Y214-T218 WeakPolarHBondContact O-CB 3.39Å; Y214-T218 PolarHBondContact O-N 3.41Å; Y214-T218 PolarHBondContact O-OG1 3.13Å
219	H	94	Very high	93	Very high	102 Å²	102	88 Å²	88	47%	0.472	44%	0.44	S	S	.	.			trans	-138.6	53.5	-174	-59.8	84.6	0	0	0	112.5	M215 I221 S222 V223	M215-H219 CarbonylContact O-C 3.56Å; M215-H219 VanDerWaalsContact O-C 3.22Å; M215-H219 WeakPolarHBondContact O-CA 3.22Å; M215-H219 PolarHBondContact O-N 2.94Å; H219-I221 VanDerWaalsContact C-N 3.33Å; H219-I221 PolarHBondContact O-N 2.89Å; H219-S222 PolarHBondContact O-N 3.24Å; H219-V223 WeakPolarHBondContact O-CG2 3.5Å; H219-V223 PolarHBondContact O-N 3.21Å; H219-V223 VanDerWaalsContact O-N 3.08Å
220	P	94.6	Very high	92.9	Very high	66 Å²	66	84.7 Å²	84.7	43%	0.429	42%	0.423	S	S	.	.	H	α-helix	trans	-59.3	-39.5	-173.2	22.9	-33.7	0	0	0	113.4	V223 M224	P220-V223 PolarHBondContact O-N 3.18Å; P220-M224 WeakPolarHBondContact O-CG 3.5Å; P220-M224 PolarHBondContact O-N 2.72Å
221	I	94.6	Very high	92.9	Very high	128 Å²	128	79.5 Å²	79.5	66%	0.656	40%	0.404	S	S	*	.	H	α-helix	trans	-64.3	-45.3	179.1	-61.4	173.2	0	0	0	110.5	H219 V223 M224 L225	H219-I221 VanDerWaalsContact C-N 3.33Å; H219-I221 PolarHBondContact O-N 2.89Å; I221-V223 VanDerWaalsContact C-N 3.3Å; I221-V223 PolarHBondContact O-N 3.41Å; I221-M224 PolarHBondContact O-N 2.94Å; I221-L225 HydrophobicContact CG2-CD1 4.05Å; I221-L225 HydrophobicContact CG2-CG 4.37Å; I221-L225 WeakPolarHBondContact O-CG 3.26Å; I221-L225 PolarHBondContact O-N 2.95Å
222	S	91.8	Very high	92.7	Very high	63 Å²	63	82.2 Å²	82.2	44%	0.441	42%	0.419	S	S	.	.	H	α-helix	trans	-60.6	-41.8	177.6	-50.9	0	0	0	0	111.4	H219 L225 V226	H219-S222 PolarHBondContact O-N 3.24Å; S222-L225 PolarHBondContact O-N 3.42Å; S222-V226 VanDerWaalsContact O-CG2 3.32Å; S222-V226 WeakPolarHBondContact O-CG2 3.41Å; S222-V226 PolarHBondContact O-N 3.23Å
223	V	93.1	Very high	92.6	Very high	8 Å²	8	83.3 Å²	83.3	5%	0.048	44%	0.436	C	S	.	.	H	α-helix	trans	-61.9	-46.2	175.2	176	0	0	0	0	111.2	M197 M215 F216 H219 P220 I221 L225 V226 I227	M197-V223 HydrophobicContact CE-CG1 4.13Å; M215-V223 HydrophobicContact CB-CG2 3.68Å; F216-V223 HydrophobicContact CD1-CB 4.41Å; F216-V223 HydrophobicContact CD1-CG1 3.88Å; F216-V223 HydrophobicContact CE1-CB 4.33Å; F216-V223 HydrophobicContact CE1-CG1 3.4Å; F216-V223 VanDerWaalsContact CE1-CG1 3.4Å; F216-V223 HydrophobicContact CE2-CG1 4.22Å; F216-V223 HydrophobicContact CG-CG1 4.46Å; F216-V223 HydrophobicContact CZ-CG1 3.58Å; H219-V223 WeakPolarHBondContact O-CG2 3.5Å; H219-V223 PolarHBondContact O-N 3.21Å; H219-V223 VanDerWaalsContact O-N 3.08Å; P220-V223 PolarHBondContact O-N 3.18Å; I221-V223 VanDerWaalsContact C-N 3.3Å; I221-V223 PolarHBondContact O-N 3.41Å; V223-L225 PolarHBondContact O-N 3.49Å; V223-V226 PolarHBondContact O-N 2.99Å; V223-I227 HydrophobicContact CG1-CD1 3.84Å; V223-I227 HydrophobicContact CG1-CG1 4.47Å; V223-I227 WeakPolarHBondContact O-CG1 3.22Å; V223-I227 PolarHBondContact O-N 3.16Å
224	M	93.4	Very high	92.6	Very high	102 Å²	102	80.4 Å²	80.4	50%	0.502	42%	0.424	S	S	.	.	H	α-helix	trans	-60.6	-43	177.2	-72	-61.5	113.7	0	0	112.3	F216 P220 I221 I227 L228	F216-M224 HydrophobicContact CD1-CE 4.48Å; F216-M224 HydrophobicContact CE1-CE 3.65Å; P220-M224 WeakPolarHBondContact O-CG 3.5Å; P220-M224 PolarHBondContact O-N 2.72Å; I221-M224 PolarHBondContact O-N 2.94Å; M224-I227 HydrophobicContact CE-CD1 3.86Å; M224-I227 PolarHBondContact O-N 3.19Å; M224-L228 WeakPolarHBondContact O-CB 3.5Å; M224-L228 PolarHBondContact O-N 3.33Å
225	L	93.8	Very high	92.7	Very high	107 Å²	107	73.5 Å²	73.5	56%	0.56	40%	0.397	S	S	*	.	H	α-helix	trans	-64.3	-40	177.3	-70.4	173.4	0	0	0	112.1	I221 S222 V223 L228 K229	I221-L225 HydrophobicContact CG2-CD1 4.05Å; I221-L225 HydrophobicContact CG2-CG 4.37Å; I221-L225 WeakPolarHBondContact O-CG 3.26Å; I221-L225 PolarHBondContact O-N 2.95Å; S222-L225 PolarHBondContact O-N 3.42Å; V223-L225 PolarHBondContact O-N 3.49Å; L225-L228 PolarHBondContact O-N 3.18Å; L225-K229 VanDerWaalsContact O-CB 3.26Å; L225-K229 WeakPolarHBondContact O-CB 3.32Å; L225-K229 PolarHBondContact O-N 2.94Å
226	V	92.3	Very high	92.9	Very high	44 Å²	44	75.4 Å²	75.4	27%	0.267	41%	0.408	S	S	.	.	H	α-helix	trans	-64.5	-43.7	175.4	169.4	0	0	0	0	111.2	L193 N196 M197 S222 V223 S230	L193-V226 HydrophobicContact CD1-CG1 4.37Å; N196-V226 HydrophobicContact CB-CG1 3.77Å; M197-V226 HydrophobicContact CG-CG1 4.04Å; S222-V226 VanDerWaalsContact O-CG2 3.32Å; S222-V226 WeakPolarHBondContact O-CG2 3.41Å; S222-V226 PolarHBondContact O-N 3.23Å; V223-V226 PolarHBondContact O-N 2.99Å; V226-S230 VanDerWaalsContact O-CB 3.28Å; V226-S230 WeakPolarHBondContact O-CB 3.42Å; V226-S230 PolarHBondContact O-N 3.12Å; V226-S230 PolarHBondContact O-OG 3.42Å
227	I	93.3	Very high	93.1	Very high	50 Å²	50	71.6 Å²	71.6	26%	0.256	39%	0.392	S	S	.	.	H	α-helix	trans	-61	-50.6	175.7	-68.4	166.9	0	0	0	109.8	L193 M197 F216 V223 M224 K229 S230 V231	L193-I227 HydrophobicContact CD1-CG1 4.1Å; M197-I227 HydrophobicContact CE-CD1 4Å; M197-I227 HydrophobicContact CE-CG1 3.54Å; F216-I227 HydrophobicContact CZ-CD1 4.41Å; V223-I227 HydrophobicContact CG1-CD1 3.84Å; V223-I227 HydrophobicContact CG1-CG1 4.47Å; V223-I227 WeakPolarHBondContact O-CG1 3.22Å; V223-I227 PolarHBondContact O-N 3.16Å; M224-I227 HydrophobicContact CE-CD1 3.86Å; M224-I227 PolarHBondContact O-N 3.19Å; I227-K229 PolarHBondContact O-N 3.1Å; I227-S230 PolarHBondContact O-N 3.33Å; I227-V231 HydrophobicContact CG2-CG2 4.25Å; I227-V231 WeakPolarHBondContact O-CB 3.31Å; I227-V231 VanDerWaalsContact O-CG2 3.26Å; I227-V231 WeakPolarHBondContact O-CG2 3.32Å; I227-V231 PolarHBondContact O-N 2.88Å
228	L	91.8	Very high	93.3	Very high	104 Å²	104	66.3 Å²	66.3	55%	0.545	36%	0.359	S	S	.	.	H	α-helix	trans	-59.6	-46.9	-178.8	-173.3	67.5	0	0	0	111.5	M224 L225 S230 V231 F232	M224-L228 WeakPolarHBondContact O-CB 3.5Å; M224-L228 PolarHBondContact O-N 3.33Å; L225-L228 PolarHBondContact O-N 3.18Å; L228-S230 VanDerWaalsContact C-N 3.32Å; L228-S230 PolarHBondContact O-N 3.15Å; L228-V231 PolarHBondContact O-N 3.04Å; L228-F232 HydrophobicContact CD1-CB 4.3Å; L228-F232 WeakPolarHBondContact O-CB 3.39Å; L228-F232 PolarHBondContact O-N 2.95Å
229	K	90.1	Very high	93.3	Very high	173 Å²	173	67 Å²	67	75%	0.752	36%	0.363	S	S	*	.	H	α-helix	trans	-61.2	-40	177.2	-176.3	-179.2	178.6	-177.1	0	112.3	L225 I227	L225-K229 VanDerWaalsContact O-CB 3.26Å; L225-K229 WeakPolarHBondContact O-CB 3.32Å; L225-K229 PolarHBondContact O-N 2.94Å; I227-K229 PolarHBondContact O-N 3.1Å
230	S	90.6	Very high	93.5	Very high	3 Å²	3	66 Å²	66	2%	0.021	36%	0.361	C	S	.	.	H	α-helix	trans	-75.9	-25.5	-177.7	-54.3	0	0	0	0	112.8	T189 N196 V226 I227 L228	T189-S230 WeakPolarHBondContact CG2-O 3.46Å; N196-S230 PolarHBondContact ND2-OG 3.06Å; V226-S230 VanDerWaalsContact O-CB 3.28Å; V226-S230 WeakPolarHBondContact O-CB 3.42Å; V226-S230 PolarHBondContact O-N 3.12Å; V226-S230 PolarHBondContact O-OG 3.42Å; I227-S230 PolarHBondContact O-N 3.33Å; L228-S230 VanDerWaalsContact C-N 3.32Å; L228-S230 PolarHBondContact O-N 3.15Å
231	V	91.7	Very high	93.7	Very high	42 Å²	42	63.4 Å²	63.4	26%	0.255	34%	0.344	S	S	.	.	H	α-helix	trans	-102.4	-45.6	-172.9	176.4	0	0	0	0	112.7	I227 L228 G233 C235	I227-V231 HydrophobicContact CG2-CG2 4.25Å; I227-V231 WeakPolarHBondContact O-CB 3.31Å; I227-V231 VanDerWaalsContact O-CG2 3.26Å; I227-V231 WeakPolarHBondContact O-CG2 3.32Å; I227-V231 PolarHBondContact O-N 2.88Å; L228-V231 PolarHBondContact O-N 3.04Å; V231-G233 PolarHBondContact O-N 3.22Å; V231-C235 HydrophobicContact CG1-CB 4.22Å; V231-C235 WeakPolarHBondContact O-CB 3.4Å; V231-C235 PolarHBondContact O-N 3.13Å; V231-C235 PolarHBondContact O-SG 3.18Å
232	F	87.4	Confident	93.8	Very high	154 Å²	154	59.1 Å²	59.1	68%	0.675	33%	0.325	S	S	*	.	H	α-helix	trans	-59.4	-52.9	-165.5	-174.8	-96.7	0	0	0	113.5	L228 L236	L228-F232 HydrophobicContact CD1-CB 4.3Å; L228-F232 WeakPolarHBondContact O-CB 3.39Å; L228-F232 PolarHBondContact O-N 2.95Å; F232-L236 PolarHBondContact O-N 3.26Å
233	G	90.1	Very high	94.1	Very high	49 Å²	49	62.9 Å²	62.9	51%	0.505	33%	0.334	S	S	.	.	H	α-helix	trans	-66.6	-57.5	-179.6	0	0	0	0	0	113	V231 C235 L236	V231-G233 PolarHBondContact O-N 3.22Å; G233-C235 VanDerWaalsContact C-N 3.26Å; G233-C235 PolarHBondContact O-N 2.99Å; G233-L236 WeakPolarHBondContact O-CB 3.41Å; G233-L236 PolarHBondContact O-N 3.06Å
234	P	93.4	Very high	94.2	Very high	50 Å²	50	66 Å²	66	33%	0.325	36%	0.356	S	S	.	.	H	α-helix	trans	-62.8	-28.6	-177.6	-26.2	36.6	0	0	0	114.3	H188 T189	H188-P234 PolarHBondContact CD2-O 3.07Å; T189-P234 HydrophobicContact CG2-CB 3.92Å
235	C	95.6	Very high	94.4	Very high	1 Å²	1	62.5 Å²	62.5	1%	0.007	34%	0.338	C	S	.	.	H	α-helix	trans	-91.2	-2.8	-178.6	-66.1	0	0	0	0	115.2	M185 T189 V231 G233 P237 F238 V239	M185-C235 HydrophobicContact CE-CB 3.67Å; M185-C235 HydrophobicContact CG-CB 4.06Å; T189-C235 WeakPolarHBondContact CG2-SG 3.33Å; V231-C235 HydrophobicContact CG1-CB 4.22Å; V231-C235 WeakPolarHBondContact O-CB 3.4Å; V231-C235 PolarHBondContact O-N 3.13Å; V231-C235 PolarHBondContact O-SG 3.18Å; G233-C235 VanDerWaalsContact C-N 3.26Å; G233-C235 PolarHBondContact O-N 2.99Å; C235-P237 VanDerWaalsContact C-CD 3.43Å; C235-P237 VanDerWaalsContact C-N 3.33Å; C235-F238 HydrophobicContact CB-CD2 4.39Å; C235-F238 WeakPolarHBondContact O-CB 3.39Å; C235-F238 PolarHBondContact O-N 3.33Å; C235-V239 PolarHBondContact O-N 3.03Å
236	L	96.3	Very high	94.5	Very high	81 Å²	81	61.9 Å²	61.9	42%	0.424	34%	0.335	S	S	.	.	H	α-helix	trans	-44.5	-49.3	176.3	-179.5	62.5	0	0	0	113.9	F232 G233 F238 V239 L240	F232-L236 PolarHBondContact O-N 3.26Å; G233-L236 WeakPolarHBondContact O-CB 3.41Å; G233-L236 PolarHBondContact O-N 3.06Å; L236-F238 VanDerWaalsContact C-N 3.26Å; L236-F238 PolarHBondContact O-N 2.94Å; L236-V239 PolarHBondContact O-N 3.37Å; L236-V239 VanDerWaalsContact O-N 3.17Å; L236-L240 WeakPolarHBondContact O-CG 3.3Å; L236-L240 PolarHBondContact O-N 3.26Å; L236-L240 VanDerWaalsContact O-N 3.08Å
237	P	97.7	Very high	94.7	Very high	6 Å²	6	61.6 Å²	61.6	4%	0.039	33%	0.334	C	S	.	.	H	α-helix	trans	-62.8	-31.6	-178.7	26.4	-37.4	0	0	0	113.1	W161 A164 C235 V241	W161-P237 HydrophobicContact CD2-CB 3.78Å; W161-P237 HydrophobicContact CD2-CG 4.35Å; W161-P237 HydrophobicContact CE3-CB 3.7Å; W161-P237 HydrophobicContact CG-CB 4.29Å; W161-P237 HydrophobicContact CH2-CB 4.37Å; W161-P237 HydrophobicContact CZ2-CB 4.44Å; W161-P237 HydrophobicContact CZ3-CB 4.02Å; A164-P237 HydrophobicContact CB-CB 3.63Å; A164-P237 HydrophobicContact CB-CG 4.45Å; C235-P237 VanDerWaalsContact C-CD 3.43Å; C235-P237 VanDerWaalsContact C-N 3.33Å; P237-V241 WeakPolarHBondContact O-CG2 3.36Å; P237-V241 PolarHBondContact O-N 3.38Å
238	F	98.1	Very high	94.7	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-74.9	-37	175.7	-60.2	-69.4	0	0	0	112.6	S163 A164 V167 V181 L184 M185 H188 C235 L236 L240 V241 S242	S163-F238 WeakPolarHBondContact OG-CE1 3.22Å; S163-F238 WeakPolarHBondContact OG-CZ 3.46Å; A164-F238 HydrophobicContact CB-CD1 4.21Å; A164-F238 HydrophobicContact CB-CE1 4.3Å; V167-F238 HydrophobicContact CG1-CD1 4.44Å; V181-F238 HydrophobicContact CG1-CB 3.83Å; V181-F238 HydrophobicContact CG1-CD1 4.47Å; L184-F238 HydrophobicContact CB-CD1 4.16Å; L184-F238 HydrophobicContact CB-CE1 3.69Å; L184-F238 HydrophobicContact CB-CZ 4.14Å; L184-F238 HydrophobicContact CD1-CE1 4.23Å; M185-F238 HydrophobicContact CG-CB 3.47Å; M185-F238 VanDerWaalsContact CG-CB 3.47Å; M185-F238 HydrophobicContact CG-CD2 3.73Å; M185-F238 HydrophobicContact CG-CG 3.69Å; M185-F238 HydrophobicContact SD-CB 3.99Å; H188-F238 HydrophobicContact CB-CE2 4.07Å; C235-F238 HydrophobicContact CB-CD2 4.39Å; C235-F238 WeakPolarHBondContact O-CB 3.39Å; C235-F238 PolarHBondContact O-N 3.33Å; L236-F238 VanDerWaalsContact C-N 3.26Å; L236-F238 PolarHBondContact O-N 2.94Å; F238-L240 VanDerWaalsContact C-N 3.25Å; F238-L240 PolarHBondContact O-N 2.94Å; F238-V241 WeakPolarHBondContact O-CB 3.43Å; F238-V241 PolarHBondContact O-N 3.39Å; F238-V241 VanDerWaalsContact O-N 3.12Å; F238-S242 PolarHBondContact O-N 3.08Å; F238-S242 PolarHBondContact O-OG 3.23Å
239	V	96.5	Very high	94.7	Very high	74 Å²	74	59.1 Å²	59.1	45%	0.448	32%	0.321	S	S	.	.	H	α-helix	trans	-60.1	-39.4	174.4	173.5	0	0	0	0	110.5	M185 C235 L236 V241 S242 F243	M185-V239 HydrophobicContact CE-CG2 4.34Å; C235-V239 PolarHBondContact O-N 3.03Å; L236-V239 PolarHBondContact O-N 3.37Å; L236-V239 VanDerWaalsContact O-N 3.17Å; V239-V241 PolarHBondContact O-N 2.92Å; V239-S242 PolarHBondContact O-N 3.09Å; V239-F243 WeakPolarHBondContact O-CB 3.49Å; V239-F243 PolarHBondContact O-N 2.89Å
240	L	97.6	Very high	94.9	Very high	82 Å²	82	56.7 Å²	56.7	43%	0.429	32%	0.315	S	S	.	.	H	α-helix	trans	-61	-43	174	-66.1	175.7	0	0	0	111.9	W161 L236 F238 S242 F243 S244	W161-L240 HydrophobicContact CH2-CD1 4.01Å; W161-L240 HydrophobicContact CZ3-CD1 4.17Å; L236-L240 WeakPolarHBondContact O-CG 3.3Å; L236-L240 PolarHBondContact O-N 3.26Å; L236-L240 VanDerWaalsContact O-N 3.08Å; F238-L240 VanDerWaalsContact C-N 3.25Å; F238-L240 PolarHBondContact O-N 2.94Å; L240-S242 PolarHBondContact O-N 3.16Å; L240-F243 PolarHBondContact O-N 3.44Å; L240-S244 WeakPolarHBondContact O-CB 3.16Å; L240-S244 PolarHBondContact O-N 3Å; L240-S244 PolarHBondContact O-OG 3.38Å; L240-S244 VanDerWaalsContact O-OG 3.1Å
241	V	98.1	Very high	95	Very high	11 Å²	11	63.2 Å²	63.2	7%	0.067	35%	0.348	C	S	.	.	H	α-helix	trans	-59.3	-47.1	175	-174.9	0	0	0	0	111.1	A164 V167 S168 I178 V181 P237 F238 V239 F243 S244 F245	A164-V241 HydrophobicContact CB-CG2 4.09Å; V167-V241 HydrophobicContact CG1-CG1 4.45Å; V167-V241 HydrophobicContact CG1-CG2 4.33Å; S168-V241 WeakPolarHBondContact OG-CG2 3.26Å; I178-V241 HydrophobicContact CD1-CG1 4.34Å; V181-V241 HydrophobicContact CG2-CG1 4.37Å; P237-V241 WeakPolarHBondContact O-CG2 3.36Å; P237-V241 PolarHBondContact O-N 3.38Å; F238-V241 WeakPolarHBondContact O-CB 3.43Å; F238-V241 PolarHBondContact O-N 3.39Å; F238-V241 VanDerWaalsContact O-N 3.12Å; V239-V241 PolarHBondContact O-N 2.92Å; V241-F243 PolarHBondContact O-N 3.35Å; V241-S244 PolarHBondContact O-N 3.35Å; V241-F245 WeakPolarHBondContact O-CB 3.43Å; V241-F245 PolarHBondContact O-N 3.44Å
242	S	97.1	Very high	94.9	Very high	38 Å²	38	62.7 Å²	62.7	27%	0.266	34%	0.344	S	S	.	.	H	α-helix	trans	-62.1	-43.4	178.3	-63.5	0	0	0	0	112.2	F238 V239 L240 F245 I246	F238-S242 PolarHBondContact O-N 3.08Å; F238-S242 PolarHBondContact O-OG 3.23Å; V239-S242 PolarHBondContact O-N 3.09Å; L240-S242 PolarHBondContact O-N 3.16Å; S242-F245 PolarHBondContact O-N 3.2Å; S242-I246 VanDerWaalsContact O-CG1 3.28Å; S242-I246 WeakPolarHBondContact O-CG1 3.3Å; S242-I246 PolarHBondContact O-N 3.3Å
243	F	97.3	Very high	94.9	Very high	141 Å²	141	63.9 Å²	63.9	62%	0.618	35%	0.348	S	S	*	.	H	α-helix	trans	-64.3	-44.3	177.9	-177.8	-97.7	0	0	0	112	V239 L240 V241 F245 I246 S247	V239-F243 WeakPolarHBondContact O-CB 3.49Å; V239-F243 PolarHBondContact O-N 2.89Å; L240-F243 PolarHBondContact O-N 3.44Å; V241-F243 PolarHBondContact O-N 3.35Å; F243-F245 VanDerWaalsContact C-N 3.33Å; F243-F245 PolarHBondContact O-N 3.32Å; F243-I246 PolarHBondContact O-N 3.12Å; F243-S247 WeakPolarHBondContact O-CB 3.21Å; F243-S247 PolarHBondContact O-N 3.4Å; F243-S247 PolarHBondContact O-OG 3.26Å
244	S	96.8	Very high	94.6	Very high	75 Å²	75	62.5 Å²	62.5	52%	0.524	33%	0.334	S	S	.	.	H	α-helix	trans	-60.7	-40.9	174.4	-65	0	0	0	0	112.1	L240 V241 S247 F248	L240-S244 WeakPolarHBondContact O-CB 3.16Å; L240-S244 PolarHBondContact O-N 3Å; L240-S244 PolarHBondContact O-OG 3.38Å; L240-S244 VanDerWaalsContact O-OG 3.1Å; V241-S244 PolarHBondContact O-N 3.35Å; S244-S247 PolarHBondContact O-N 3.46Å; S244-F248 PolarHBondContact O-N 3.35Å
245	F	96.6	Very high	94.3	Very high	27 Å²	27	64.3 Å²	64.3	12%	0.118	34%	0.34	C	S	.	.	H	α-helix	trans	-66.4	-43	176.5	-175.7	-98.3	0	0	0	112.4	V171 Q175 I178 V241 S242 F243 S247 F248 V249 I255	V171-F245 HydrophobicContact CG1-CD2 3.58Å; V171-F245 HydrophobicContact CG1-CE2 3.91Å; Q175-F245 HydrophobicContact CB-CE2 4.15Å; Q175-F245 HydrophobicContact CB-CZ 4.38Å; I178-F245 HydrophobicContact CB-CD1 4.23Å; I178-F245 HydrophobicContact CB-CD2 4.43Å; I178-F245 HydrophobicContact CB-CE1 4.17Å; I178-F245 HydrophobicContact CB-CE2 4.38Å; I178-F245 HydrophobicContact CB-CG 4.34Å; I178-F245 HydrophobicContact CB-CZ 4.24Å; I178-F245 HydrophobicContact CD1-CB 3.7Å; I178-F245 HydrophobicContact CD1-CD1 4.11Å; I178-F245 HydrophobicContact CD1-CD2 4.34Å; I178-F245 HydrophobicContact CD1-CG 3.78Å; I178-F245 HydrophobicContact CG1-CB 4.23Å; I178-F245 HydrophobicContact CG1-CD1 3.65Å; I178-F245 HydrophobicContact CG1-CD2 4.37Å; I178-F245 HydrophobicContact CG1-CE1 4.04Å; I178-F245 HydrophobicContact CG1-CG 3.81Å; I178-F245 HydrophobicContact CG2-CD1 4.32Å; I178-F245 HydrophobicContact CG2-CE1 3.82Å; I178-F245 HydrophobicContact CG2-CZ 3.92Å; V241-F245 WeakPolarHBondContact O-CB 3.43Å; V241-F245 PolarHBondContact O-N 3.44Å; S242-F245 PolarHBondContact O-N 3.2Å; F243-F245 VanDerWaalsContact C-N 3.33Å; F243-F245 PolarHBondContact O-N 3.32Å; F245-S247 VanDerWaalsContact C-N 3.31Å; F245-S247 PolarHBondContact O-N 3.46Å; F245-F248 HydrophobicContact CD2-CD1 4.2Å; F245-F248 HydrophobicContact CE2-CD1 4.15Å; F245-F248 HydrophobicContact CE2-CE1 4.39Å; F245-F248 WeakPolarHBondContact O-CB 3.26Å; F245-F248 PolarHBondContact O-N 3.49Å; F245-V249 HydrophobicContact CD1-CG2 4.01Å; F245-V249 HydrophobicContact CE1-CG2 3.62Å; F245-V249 HydrophobicContact CZ-CG2 3.93Å; F245-V249 WeakPolarHBondContact O-CG2 3.34Å; F245-V249 PolarHBondContact O-N 3.22Å; F245-I255 HydrophobicContact CZ-CG2 4.3Å
246	I	95.8	Very high	93.6	Very high	95 Å²	95	65.1 Å²	65.1	49%	0.487	35%	0.345	S	S	.	.	H	α-helix	trans	-61	-43.6	175.5	-69.7	165.1	0	0	0	110.3	S242 F243 F248 V249 I250	S242-I246 VanDerWaalsContact O-CG1 3.28Å; S242-I246 WeakPolarHBondContact O-CG1 3.3Å; S242-I246 PolarHBondContact O-N 3.3Å; F243-I246 PolarHBondContact O-N 3.12Å; I246-F248 VanDerWaalsContact C-N 3.32Å; I246-F248 PolarHBondContact O-N 2.98Å; I246-V249 PolarHBondContact O-N 2.82Å; I246-V249 VanDerWaalsContact O-N 3.15Å; I246-I250 HydrophobicContact CG2-CD1 3.84Å; I246-I250 HydrophobicContact CG2-CG1 4.44Å; I246-I250 WeakPolarHBondContact O-CG1 3.35Å; I246-I250 PolarHBondContact O-N 2.88Å
247	S	96.4	Very high	92.8	Very high	37 Å²	37	63.4 Å²	63.4	26%	0.259	34%	0.336	S	S	.	.	H	α-helix	trans	-59.6	-43.8	176.2	-57	0	0	0	0	111.2	F243 S244 F245 I250 I251	F243-S247 WeakPolarHBondContact O-CB 3.21Å; F243-S247 PolarHBondContact O-N 3.4Å; F243-S247 PolarHBondContact O-OG 3.26Å; S244-S247 PolarHBondContact O-N 3.46Å; F245-S247 VanDerWaalsContact C-N 3.31Å; F245-S247 PolarHBondContact O-N 3.46Å; S247-I250 PolarHBondContact O-N 2.91Å; S247-I251 WeakPolarHBondContact O-CB 3.19Å; S247-I251 WeakPolarHBondContact O-CD1 3.39Å; S247-I251 VanDerWaalsContact O-CG1 3.24Å; S247-I251 WeakPolarHBondContact O-CG1 3.35Å; S247-I251 PolarHBondContact O-N 3.23Å
248	F	94.2	Very high	92	Very high	63 Å²	63	63.4 Å²	63.4	28%	0.276	34%	0.337	S	S	.	.	H	α-helix	trans	-58.1	-48.5	172.1	160.2	-101.9	0	0	0	112.1	S244 F245 I246 I250 I251 N252 L257	S244-F248 PolarHBondContact O-N 3.35Å; F245-F248 HydrophobicContact CD2-CD1 4.2Å; F245-F248 HydrophobicContact CE2-CD1 4.15Å; F245-F248 HydrophobicContact CE2-CE1 4.39Å; F245-F248 WeakPolarHBondContact O-CB 3.26Å; F245-F248 PolarHBondContact O-N 3.49Å; I246-F248 VanDerWaalsContact C-N 3.32Å; I246-F248 PolarHBondContact O-N 2.98Å; F248-I250 VanDerWaalsContact C-N 3.31Å; F248-I250 PolarHBondContact O-N 2.95Å; F248-I251 PolarHBondContact O-N 3.41Å; F248-N252 HydrophobicContact CD2-CB 4.14Å; F248-N252 HydrophobicContact CE2-CB 3.72Å; F248-N252 HydrophobicContact CZ-CB 4Å; F248-N252 WeakPolarHBondContact O-CB 3.24Å; F248-N252 PolarHBondContact O-N 3.32Å; F248-L257 HydrophobicContact CE2-CD2 3.66Å; F248-L257 HydrophobicContact CZ-CD2 3.67Å; F248-L257 HydrophobicContact CZ-CG 4.24Å
249	V	92.1	Very high	91	Very high	39 Å²	39	65.2 Å²	65.2	24%	0.236	35%	0.347	C	S	.	.	H	α-helix	trans	-61.2	-40.5	-179.3	172	0	0	0	0	111.4	F245 I246 K253 G254 I255	F245-V249 HydrophobicContact CD1-CG2 4.01Å; F245-V249 HydrophobicContact CE1-CG2 3.62Å; F245-V249 HydrophobicContact CZ-CG2 3.93Å; F245-V249 WeakPolarHBondContact O-CG2 3.34Å; F245-V249 PolarHBondContact O-N 3.22Å; I246-V249 PolarHBondContact O-N 2.82Å; I246-V249 VanDerWaalsContact O-N 3.15Å; V249-K253 WeakPolarHBondContact O-CA 3.21Å; V249-K253 PolarHBondContact O-N 3.28Å; V249-G254 PolarHBondContact O-N 3.41Å; V249-G254 VanDerWaalsContact O-N 3.14Å; V249-I255 HydrophobicContact CG1-CG1 4.3Å; V249-I255 HydrophobicContact CG2-CG1 4.11Å
250	I	93.3	Very high	90	Very high	123 Å²	123	67 Å²	67	63%	0.631	35%	0.345	S	S	*	.	H	α-helix	trans	-64.7	-49	177.2	-66.7	168	0	0	0	110.6	I246 S247 F248 K253	I246-I250 HydrophobicContact CG2-CD1 3.84Å; I246-I250 HydrophobicContact CG2-CG1 4.44Å; I246-I250 WeakPolarHBondContact O-CG1 3.35Å; I246-I250 PolarHBondContact O-N 2.88Å; S247-I250 PolarHBondContact O-N 2.91Å; F248-I250 VanDerWaalsContact C-N 3.31Å; F248-I250 PolarHBondContact O-N 2.95Å; I250-K253 PolarHBondContact O-N 3.03Å
251	I	92.7	Very high	88.9	Confident	139 Å²	139	72 Å²	72	71%	0.713	37%	0.367	S	S	*	.	H	α-helix	trans	-66.6	-43.9	-178.9	-66	165.5	0	0	0	111.1	S247 F248 K253	S247-I251 WeakPolarHBondContact O-CB 3.19Å; S247-I251 WeakPolarHBondContact O-CD1 3.39Å; S247-I251 VanDerWaalsContact O-CG1 3.24Å; S247-I251 WeakPolarHBondContact O-CG1 3.35Å; S247-I251 PolarHBondContact O-N 3.23Å; F248-I251 PolarHBondContact O-N 3.41Å; I251-K253 VanDerWaalsContact C-N 3.25Å; I251-K253 PolarHBondContact O-N 3.28Å
252	N	89.8	Confident	87.7	Confident	31 Å²	31	72.8 Å²	72.8	17%	0.166	37%	0.374	C	S	.	.	H	α-helix	trans	-75.1	-14	-179.8	-174.1	53.1	0	0	0	112.9	F248 G254 V256 R260	F248-N252 HydrophobicContact CD2-CB 4.14Å; F248-N252 HydrophobicContact CE2-CB 3.72Å; F248-N252 HydrophobicContact CZ-CB 4Å; F248-N252 WeakPolarHBondContact O-CB 3.24Å; F248-N252 PolarHBondContact O-N 3.32Å; N252-G254 PolarHBondContact ND2-O 3.13Å; N252-G254 PolarHBondContact O-N 3.12Å; N252-V256 PolarHBondContact ND2-O 3.37Å; N252-R260 PolarHBondContact O-NH1 2.83Å; N252-R260 VanDerWaalsContact O-NH1 3.13Å; N252-R260 PolarHBondContact O-NH2 3.42Å; N252-R260 PolarHBondContact OD1-NH2 3Å; N252-R260 VanDerWaalsContact OD1-NH2 3.11Å
253	K	87.4	Confident	86.5	Confident	179 Å²	179	74.2 Å²	74.2	78%	0.778	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.6	35.5	-173.5	-54	179	179.3	178.7	0	112.8	V249 I250 I251	V249-K253 WeakPolarHBondContact O-CA 3.21Å; V249-K253 PolarHBondContact O-N 3.28Å; I250-K253 PolarHBondContact O-N 3.03Å; I251-K253 VanDerWaalsContact C-N 3.25Å; I251-K253 PolarHBondContact O-N 3.28Å
254	G	84.6	Confident	85.6	Confident	20 Å²	20	72 Å²	72	21%	0.206	38%	0.375	C	S	.	.	S	Bend	trans	166.6	163	-176.2	0	0	0	0	0	113.5	V249 N252	V249-G254 PolarHBondContact O-N 3.41Å; V249-G254 VanDerWaalsContact O-N 3.14Å; N252-G254 PolarHBondContact ND2-O 3.13Å; N252-G254 PolarHBondContact O-N 3.12Å
255	I	85.1	Confident	84.7	Confident	88 Å²	88	72.6 Å²	72.6	45%	0.451	38%	0.384	S	S	.	.	S	Bend	trans	-84	-32	-178.4	-65.5	170.1	0	0	0	111.9	Q175 F245 V249	Q175-I255 HydrophobicContact CB-CG2 4.13Å; Q175-I255 HydrophobicContact CG-CG2 3.66Å; F245-I255 HydrophobicContact CZ-CG2 4.3Å; V249-I255 HydrophobicContact CG1-CG1 4.3Å; V249-I255 HydrophobicContact CG2-CG1 4.11Å
256	V	82.1	Confident	84.3	Confident	19 Å²	19	72.6 Å²	72.6	12%	0.115	39%	0.386	C	S	.	.			trans	-96.1	148.5	-180	-62.3	0	0	0	0	110.9	N252 R260 H263	N252-V256 PolarHBondContact ND2-O 3.37Å; V256-R260 HydrophobicContact CG2-CB 4.38Å; V256-R260 HydrophobicContact CG2-CG 3.95Å; V256-H263 HydrophobicContact CG1-CB 4.02Å; V256-H263 HydrophobicContact CG2-CB 4.5Å
257	L	80.1	Confident	84.2	Confident	45 Å²	45	73.1 Å²	73.1	24%	0.236	39%	0.389	C	S	.	.	S	Bend	trans	-84.1	-33.5	179.9	-71.6	171	0	0	0	113.3	W55 T60 P62 F248	W55-L257 HydrophobicContact CH2-CD1 4.07Å; W55-L257 HydrophobicContact CZ2-CB 4.05Å; W55-L257 HydrophobicContact CZ2-CD1 3.72Å; T60-L257 PolarHBondContact O-N 3.49Å; P62-L257 VanDerWaalsContact CA-CD1 3.43Å; P62-L257 HydrophobicContact CB-CD1 3.78Å; P62-L257 HydrophobicContact CG-CD1 4.17Å; F248-L257 HydrophobicContact CE2-CD2 3.66Å; F248-L257 HydrophobicContact CZ-CD2 3.67Å; F248-L257 HydrophobicContact CZ-CG 4.24Å
258	G	79.7	Confident	84.2	Confident	5 Å²	5	71.4 Å²	71.4	5%	0.052	38%	0.378	C	S	.	.	S	Bend	trans	-135.9	176.6	-179.5	0	0	0	0	0	112.4	N57 I59 T60 R260	N57-G258 CarbonylContact O-C 3.49Å; N57-G258 WeakPolarHBondContact O-CA 3.31Å; I59-G258 VanDerWaalsContact O-CA 3.31Å; I59-G258 WeakPolarHBondContact O-CA 3.24Å; I59-G258 PolarHBondContact O-N 3.46Å; I59-G258 VanDerWaalsContact O-N 3.15Å; T60-G258 WeakPolarHBondContact CG2-O 3.31Å; G258-R260 VanDerWaalsContact C-N 3.27Å; G258-R260 PolarHBondContact O-N 2.9Å; G258-R260 VanDerWaalsContact O-N 3.13Å
259	D	76.9	Confident	84.3	Confident	38 Å²	38	69.4 Å²	69.4	20%	0.203	37%	0.369	C	S	.	.			trans	42.3	45.3	178.5	-148.4	36.6	0	0	0	114.9	N57 K58 T60 E261 A262 H263	N57-D259 PolarHBondContact O-N 3.44Å; K58-D259 HydrophobicContact CD-CB 4.46Å; K58-D259 IonicContact NZ-OD1 3.79Å; K58-D259 PolarHBondContact NZ-OD1 3.43Å; K58-D259 IonicContact NZ-OD2 2.73Å; K58-D259 PolarHBondContact NZ-OD2 3.39Å; T60-D259 HydrophobicContact CG2-CB 3.94Å; D259-E261 VanDerWaalsContact C-N 3.31Å; D259-E261 PolarHBondContact O-N 2.88Å; D259-A262 PolarHBondContact O-N 2.87Å; D259-A262 VanDerWaalsContact O-N 3.14Å; D259-A262 WeakPolarHBondContact OD2-CB 3.42Å; D259-H263 PolarHBondContact O-CD2 2.99Å; D259-H263 PolarHBondContact O-N 2.87Å
260	R	76.1	Confident	84.6	Confident	112 Å²	112	67.5 Å²	67.5	42%	0.423	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-39.2	-168.4	-63.7	-178.2	-178.4	-157.9	-3.5	114.2	N252 V256 G258 A262 H263	N252-R260 PolarHBondContact O-NH1 2.83Å; N252-R260 VanDerWaalsContact O-NH1 3.13Å; N252-R260 PolarHBondContact O-NH2 3.42Å; N252-R260 PolarHBondContact OD1-NH2 3Å; N252-R260 VanDerWaalsContact OD1-NH2 3.11Å; V256-R260 HydrophobicContact CG2-CB 4.38Å; V256-R260 HydrophobicContact CG2-CG 3.95Å; G258-R260 VanDerWaalsContact C-N 3.27Å; G258-R260 PolarHBondContact O-N 2.9Å; G258-R260 VanDerWaalsContact O-N 3.13Å; R260-A262 VanDerWaalsContact C-N 3.31Å; R260-A262 PolarHBondContact O-N 3.35Å; R260-H263 PolarHBondContact O-N 3.46Å
261	E	73.7	Confident	84.8	Confident	188 Å²	188	61.7 Å²	61.7	88%	0.879	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-33.9	-177.5	-64.8	178.9	-179.1	0	0	112.1	D259	D259-E261 VanDerWaalsContact C-N 3.31Å; D259-E261 PolarHBondContact O-N 2.88Å
262	A	72.7	Confident	85	Confident	27 Å²	27	55.5 Å²	55.5	22%	0.223	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-16.9	178.6	0	0	0	0	0	113.2	D259 R260 H335	D259-A262 PolarHBondContact O-N 2.87Å; D259-A262 VanDerWaalsContact O-N 3.14Å; D259-A262 WeakPolarHBondContact OD2-CB 3.42Å; R260-A262 VanDerWaalsContact C-N 3.31Å; R260-A262 PolarHBondContact O-N 3.35Å; A262-H335 PolarHBondContact O-NE2 3.15Å
263	H	72.9	Confident	85.4	Confident	68 Å²	68	54.1 Å²	54.1	32%	0.315	29%	0.289	S	S	.	.			trans	-124.5	48.7	-172.2	-64.7	-75.4	0	0	0	113	T60 V256 D259 R260	T60-H263 WeakPolarHBondContact CG2-CD2 3.39Å; V256-H263 HydrophobicContact CG1-CB 4.02Å; V256-H263 HydrophobicContact CG2-CB 4.5Å; D259-H263 PolarHBondContact O-CD2 2.99Å; D259-H263 PolarHBondContact O-N 2.87Å; R260-H263 PolarHBondContact O-N 3.46Å
264	T	77.9	Confident	85.9	Confident	95 Å²	95	46.4 Å²	46.4	58%	0.583	26%	0.255	S	S	*	.			trans	-73.4	143.1	167.6	55.5	0	0	0	0	110.4	V266	T264-V266 PolarHBondContact O-N 3.39Å
265	A	77.9	Confident	86.6	Confident	87 Å²	87	45.4 Å²	45.4	72%	0.719	25%	0.245	S	C	*	.			trans	-68.5	126.3	175.2	0	0	0	0	0	109.1
266	V	88.7	Confident	87.2	Confident	27 Å²	27	41.2 Å²	41.2	16%	0.164	22%	0.223	C	C	.	.			trans	-119.4	154	179.3	-61.2	0	0	0	0	110.1	T264 N268 F333 A407	T264-V266 PolarHBondContact O-N 3.39Å; V266-N268 HydrophobicContact CG2-CB 4.39Å; V266-F333 HydrophobicContact CB-CD1 4.44Å; V266-F333 HydrophobicContact CB-CD2 4.37Å; V266-F333 HydrophobicContact CB-CG 4.24Å; V266-F333 HydrophobicContact CG1-CD1 4.36Å; V266-F333 HydrophobicContact CG1-CD2 4.15Å; V266-F333 HydrophobicContact CG1-CE1 4.17Å; V266-F333 HydrophobicContact CG1-CE2 3.97Å; V266-F333 HydrophobicContact CG1-CG 4.33Å; V266-F333 HydrophobicContact CG1-CZ 3.98Å; V266-F333 HydrophobicContact CG2-CB 4.34Å; V266-F333 HydrophobicContact CG2-CD1 3.88Å; V266-F333 HydrophobicContact CG2-CE1 4.32Å; V266-F333 HydrophobicContact CG2-CG 4.04Å; V266-A407 WeakPolarHBondContact O-CA 3.13Å
267	L	93.6	Very high	88	Confident	105 Å²	105	42.1 Å²	42.1	55%	0.55	23%	0.229	S	C	.	.			trans	-92.9	100.8	170.7	179.7	63.3	0	0	0	109.2	I269 I406	L267-I269 HydrophobicContact CD1-CD1 4.47Å; L267-I269 HydrophobicContact CD1-CG1 3.92Å; L267-I269 HydrophobicContact CG-CG1 4.23Å; L267-I406 HydrophobicContact CD1-CD1 3.7Å; L267-I406 HydrophobicContact CD1-CG1 4.42Å
268	N	95.9	Very high	88.9	Confident	2 Å²	2	40.8 Å²	40.8	1%	0.011	22%	0.221	C	C	.	.			trans	-119.9	72.8	179.6	-165	5.3	0	0	0	111.2	V266 P270 Q271 C331 F333 I406	V266-N268 HydrophobicContact CG2-CB 4.39Å; N268-P270 VanDerWaalsContact C-N 3.32Å; N268-Q271 HydrophobicContact CB-CG 3.86Å; N268-Q271 VanDerWaalsContact CG-CG 3.49Å; N268-Q271 WeakPolarHBondContact ND2-CG 3.48Å; N268-Q271 VanDerWaalsContact O-CB 3.28Å; N268-Q271 WeakPolarHBondContact O-CB 3.36Å; N268-Q271 WeakPolarHBondContact O-CG 3.41Å; N268-Q271 PolarHBondContact O-N 3.27Å; N268-Q271 VanDerWaalsContact O-N 3.08Å; N268-C331 CarbonylContact C-O 3.14Å; N268-C331 VanDerWaalsContact CA-O 3.29Å; N268-C331 WeakPolarHBondContact CA-O 3.13Å; N268-F333 HydrophobicContact CB-CB 4Å; N268-F333 PolarHBondContact ND2-O 2.97Å; N268-F333 PolarHBondContact OD1-N 3.48Å; N268-I406 PolarHBondContact N-O 2.79Å
269	I	97.6	Very high	89.7	Confident	20 Å²	20	40.6 Å²	40.6	10%	0.103	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-40.1	-177.1	-62.1	179.4	0	0	0	113.1	L267 Q271 F272 F273 F323 C331 F402	L267-I269 HydrophobicContact CD1-CD1 4.47Å; L267-I269 HydrophobicContact CD1-CG1 3.92Å; L267-I269 HydrophobicContact CG-CG1 4.23Å; I269-Q271 PolarHBondContact O-N 3.29Å; I269-F272 PolarHBondContact O-N 2.89Å; I269-F273 HydrophobicContact CG2-CE2 4.21Å; I269-F273 HydrophobicContact CG2-CZ 4.17Å; I269-F323 HydrophobicContact CG2-CZ 4.22Å; I269-C331 HydrophobicContact CB-CB 3.96Å; I269-C331 HydrophobicContact CD1-CB 3.82Å; I269-C331 HydrophobicContact CG1-CB 3.84Å; I269-C331 PolarHBondContact N-O 3.14Å; I269-F402 HydrophobicContact CG2-CE2 4.37Å; I269-F402 HydrophobicContact CG2-CZ 4.23Å
270	P	97.8	Very high	90.7	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-53.5	-25.9	177.1	-31	38.8	0	0	0	115.5	N268 F272 F273 Y274 L328 C331 F332	N268-P270 VanDerWaalsContact C-N 3.32Å; P270-F272 PolarHBondContact O-N 2.95Å; P270-F273 WeakPolarHBondContact O-CA 3.48Å; P270-F273 WeakPolarHBondContact O-CB 3.45Å; P270-F273 PolarHBondContact O-N 3.32Å; P270-Y274 HydrophobicContact CB-CE1 4.28Å; P270-Y274 HydrophobicContact CB-CE2 3.98Å; P270-Y274 WeakPolarHBondContact O-CD2 3.39Å; P270-Y274 PolarHBondContact O-N 2.92Å; P270-L328 HydrophobicContact CB-CD2 3.95Å; P270-L328 HydrophobicContact CG-CD2 3.92Å; P270-C331 WeakPolarHBondContact CD-O 3.33Å; P270-F332 HydrophobicContact CG-CB 3.92Å
271	Q	97.2	Very high	91.7	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-55.8	-36	175	-71	-87.6	61.9	0	0	112.3	N268 I269 F273 Y274 F275 V405 S408 L410	N268-Q271 HydrophobicContact CB-CG 3.86Å; N268-Q271 VanDerWaalsContact CG-CG 3.49Å; N268-Q271 WeakPolarHBondContact ND2-CG 3.48Å; N268-Q271 VanDerWaalsContact O-CB 3.28Å; N268-Q271 WeakPolarHBondContact O-CB 3.36Å; N268-Q271 WeakPolarHBondContact O-CG 3.41Å; N268-Q271 PolarHBondContact O-N 3.27Å; N268-Q271 VanDerWaalsContact O-N 3.08Å; I269-Q271 PolarHBondContact O-N 3.29Å; Q271-F273 VanDerWaalsContact C-N 3.31Å; Q271-F273 PolarHBondContact O-N 3.28Å; Q271-Y274 PolarHBondContact O-N 3.2Å; Q271-F275 WeakPolarHBondContact O-CB 3.34Å; Q271-F275 PolarHBondContact O-N 3.27Å; Q271-V405 HydrophobicContact CB-CG1 3.5Å; Q271-V405 WeakPolarHBondContact CB-O 3.3Å; Q271-V405 VanDerWaalsContact O-CG1 3.25Å; Q271-V405 WeakPolarHBondContact O-CG1 3.41Å; Q271-S408 PolarHBondContact NE2-O 3.32Å; Q271-S408 PolarHBondContact NE2-OG 2.88Å; Q271-L410 VanDerWaalsContact NE2-C 3.33Å; Q271-L410 PolarHBondContact NE2-O 3.42Å
272	F	98.3	Very high	92.8	Very high	10 Å²	10	30.2 Å²	30.2	4%	0.044	17%	0.173	C	C	.	.	H	α-helix	trans	-67.6	-34.1	177.6	-173.8	-102.5	0	0	0	112.1	I269 P270 F275 A276 T372 F375 L398 F402 V405 I406	I269-F272 PolarHBondContact O-N 2.89Å; P270-F272 PolarHBondContact O-N 2.95Å; F272-F275 HydrophobicContact CD2-CD1 4.17Å; F272-F275 HydrophobicContact CE2-CD1 4.12Å; F272-F275 PolarHBondContact O-N 3.39Å; F272-A276 WeakPolarHBondContact O-CB 3.41Å; F272-A276 PolarHBondContact O-N 3.1Å; F272-T372 HydrophobicContact CE1-CG2 4.12Å; F272-F375 HydrophobicContact CE2-CE1 4.43Å; F272-F375 HydrophobicContact CZ-CD1 4.2Å; F272-F375 AromaticContact CZ-CE1 3.91Å; F272-F375 HydrophobicContact CZ-CE1 3.91Å; F272-L398 HydrophobicContact CE2-CD1 4.45Å; F272-L398 HydrophobicContact CZ-CD1 3.76Å; F272-F402 HydrophobicContact CB-CD2 3.81Å; F272-F402 HydrophobicContact CB-CE2 3.91Å; F272-F402 AromaticContact CD1-CD2 3.77Å; F272-F402 HydrophobicContact CD1-CD2 3.77Å; F272-F402 HydrophobicContact CD1-CE2 4.1Å; F272-F402 HydrophobicContact CD2-CB 4.17Å; F272-F402 AromaticContact CD2-CD2 3.66Å; F272-F402 HydrophobicContact CD2-CD2 3.66Å; F272-F402 HydrophobicContact CD2-CG 4.37Å; F272-F402 HydrophobicContact CE1-CD2 4.24Å; F272-F402 HydrophobicContact CE2-CB 4.17Å; F272-F402 HydrophobicContact CE2-CD2 4.13Å; F272-F402 AromaticContact CG-CD2 3.45Å; F272-F402 HydrophobicContact CG-CD2 3.45Å; F272-F402 VanDerWaalsContact CG-CD2 3.45Å; F272-F402 AromaticContact CG-CE2 3.94Å; F272-F402 HydrophobicContact CG-CE2 3.94Å; F272-F402 HydrophobicContact CZ-CD2 4.4Å; F272-V405 HydrophobicContact CB-CG1 4.45Å; F272-I406 HydrophobicContact CB-CG2 3.99Å
273	F	98.3	Very high	93.8	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.009	16%	0.163	C	C	.	.	H	α-helix	trans	-70.7	-36.8	174.2	-53.8	-42.1	0	0	0	111.7	I269 P270 Q271 F275 A276 T277 F323 I324 Y368	I269-F273 HydrophobicContact CG2-CE2 4.21Å; I269-F273 HydrophobicContact CG2-CZ 4.17Å; P270-F273 WeakPolarHBondContact O-CA 3.48Å; P270-F273 WeakPolarHBondContact O-CB 3.45Å; P270-F273 PolarHBondContact O-N 3.32Å; Q271-F273 VanDerWaalsContact C-N 3.31Å; Q271-F273 PolarHBondContact O-N 3.28Å; F273-F275 VanDerWaalsContact C-N 3.32Å; F273-A276 PolarHBondContact O-N 3.43Å; F273-T277 WeakPolarHBondContact O-CB 3.38Å; F273-T277 PolarHBondContact O-N 3.48Å; F273-T277 PolarHBondContact O-OG1 3.5Å; F273-F323 HydrophobicContact CE1-CE1 4.23Å; F273-F323 HydrophobicContact CZ-CD1 4.16Å; F273-F323 AromaticContact CZ-CE1 3.77Å; F273-F323 HydrophobicContact CZ-CE1 3.77Å; F273-I324 HydrophobicContact CD1-CG1 4.48Å; F273-I324 HydrophobicContact CD2-CG2 4.24Å; F273-I324 HydrophobicContact CE1-CG1 3.88Å; F273-I324 HydrophobicContact CE2-CB 4.24Å; F273-I324 HydrophobicContact CE2-CG1 4.05Å; F273-I324 HydrophobicContact CE2-CG2 4.05Å; F273-I324 HydrophobicContact CZ-CB 4.27Å; F273-I324 HydrophobicContact CZ-CG1 3.66Å; F273-Y368 HydrophobicContact CB-CD1 3.85Å; F273-Y368 HydrophobicContact CB-CD2 4.13Å; F273-Y368 HydrophobicContact CB-CE1 4.49Å; F273-Y368 HydrophobicContact CB-CG 3.67Å; F273-Y368 HydrophobicContact CD2-CD2 4.46Å; F273-Y368 HydrophobicContact CG-CG 4.3Å
274	Y	98	Very high	94.9	Very high	16 Å²	16	27.8 Å²	27.8	6%	0.063	16%	0.161	C	C	.	.	H	α-helix	trans	-62.6	-42.1	171.7	-52.2	-28.4	0	0	0	110.7	P270 Q271 T277 F278 W350 I354 Y368 L411	P270-Y274 HydrophobicContact CB-CE1 4.28Å; P270-Y274 HydrophobicContact CB-CE2 3.98Å; P270-Y274 WeakPolarHBondContact O-CD2 3.39Å; P270-Y274 PolarHBondContact O-N 2.92Å; Q271-Y274 PolarHBondContact O-N 3.2Å; Y274-T277 WeakPolarHBondContact O-CB 3.37Å; Y274-T277 PolarHBondContact O-N 3.04Å; Y274-F278 WeakPolarHBondContact O-CB 3.46Å; Y274-F278 PolarHBondContact O-N 2.92Å; Y274-W350 HydrophobicContact CE2-CZ3 4.41Å; Y274-I354 HydrophobicContact CD1-CD1 4.4Å; Y274-I354 HydrophobicContact CE1-CD1 4.22Å; Y274-I354 HydrophobicContact CE1-CG2 4.45Å; Y274-Y368 AromaticContact CD1-CE1 3.97Å; Y274-Y368 HydrophobicContact CD1-CE1 3.97Å; Y274-Y368 AromaticContact CD1-CZ 3.94Å; Y274-Y368 HydrophobicContact CE1-CE1 4.2Å; Y274-Y368 HydrophobicContact CE1-CE2 4.29Å; Y274-Y368 AromaticContact CE1-CZ 3.68Å; Y274-Y368 VanDerWaalsContact CE1-OH 3.3Å; Y274-Y368 WeakPolarHBondContact CE1-OH 3.18Å; Y274-L411 HydrophobicContact CD2-CD1 3.89Å; Y274-L411 HydrophobicContact CD2-CD2 4.06Å; Y274-L411 HydrophobicContact CD2-CG 4.46Å; Y274-L411 HydrophobicContact CE2-CD2 4.32Å; Y274-L411 HydrophobicContact CG-CD1 4.36Å
275	F	98.4	Very high	95.7	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-63.5	-45.5	174.8	173.1	-122.8	0	0	0	113	Q271 F272 F273 T277 F278 C279 F375 V405 F416 P419 F420	Q271-F275 WeakPolarHBondContact O-CB 3.34Å; Q271-F275 PolarHBondContact O-N 3.27Å; F272-F275 HydrophobicContact CD2-CD1 4.17Å; F272-F275 HydrophobicContact CE2-CD1 4.12Å; F272-F275 PolarHBondContact O-N 3.39Å; F273-F275 VanDerWaalsContact C-N 3.32Å; F275-T277 VanDerWaalsContact C-N 3.27Å; F275-T277 PolarHBondContact O-N 3.06Å; F275-F278 HydrophobicContact CD2-CD1 4.27Å; F275-F278 HydrophobicContact CE2-CD1 4.41Å; F275-F278 WeakPolarHBondContact O-CB 3.35Å; F275-F278 PolarHBondContact O-N 2.81Å; F275-C279 WeakPolarHBondContact CE2-SG 3.15Å; F275-C279 VanDerWaalsContact CZ-SG 3.54Å; F275-C279 PolarHBondContact O-N 3.42Å; F275-C279 PolarHBondContact O-SG 3.3Å; F275-F375 HydrophobicContact CD1-CE2 4.26Å; F275-F375 HydrophobicContact CE1-CD2 4.43Å; F275-F375 AromaticContact CE1-CE2 3.45Å; F275-F375 HydrophobicContact CE1-CE2 3.45Å; F275-F375 VanDerWaalsContact CE1-CE2 3.45Å; F275-F375 AromaticContact CE1-CZ 3.7Å; F275-F375 HydrophobicContact CE1-CZ 3.7Å; F275-F375 AromaticContact CZ-CE2 3.87Å; F275-F375 HydrophobicContact CZ-CE2 3.87Å; F275-F375 HydrophobicContact CZ-CZ 4.4Å; F275-V405 HydrophobicContact CB-CG1 4.03Å; F275-V405 HydrophobicContact CB-CG2 4.32Å; F275-V405 HydrophobicContact CD1-CG2 4.23Å; F275-V405 HydrophobicContact CG-CG2 4.19Å; F275-F416 HydrophobicContact CB-CD1 4.06Å; F275-F416 HydrophobicContact CB-CD2 4.29Å; F275-F416 HydrophobicContact CB-CE1 4Å; F275-F416 HydrophobicContact CB-CE2 4.2Å; F275-F416 HydrophobicContact CB-CG 4.23Å; F275-F416 HydrophobicContact CB-CZ 4.06Å; F275-F416 HydrophobicContact CD2-CB 3.59Å; F275-F416 AromaticContact CD2-CD1 3.96Å; F275-F416 HydrophobicContact CD2-CD1 3.96Å; F275-F416 HydrophobicContact CD2-CD2 4.03Å; F275-F416 AromaticContact CD2-CG 3.59Å; F275-F416 HydrophobicContact CD2-CG 3.59Å; F275-F416 HydrophobicContact CE2-CB 3.95Å; F275-F416 HydrophobicContact CE2-CG 4.43Å; F275-F416 HydrophobicContact CG-CD1 4.3Å; F275-F416 HydrophobicContact CG-CG 4.31Å; F275-P419 HydrophobicContact CE1-CB 3.97Å; F275-P419 HydrophobicContact CE2-CB 4.11Å; F275-P419 HydrophobicContact CE2-CG 4.05Å; F275-P419 HydrophobicContact CZ-CB 3.57Å; F275-P419 HydrophobicContact CZ-CG 4.02Å; F275-F420 HydrophobicContact CE2-CB 4.11Å
276	A	98.5	Very high	96.4	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-61.6	-38.1	175.5	0	0	0	0	0	111.8	F272 F273 C279 A280 A371 F375	F272-A276 WeakPolarHBondContact O-CB 3.41Å; F272-A276 PolarHBondContact O-N 3.1Å; F273-A276 PolarHBondContact O-N 3.43Å; A276-C279 WeakPolarHBondContact O-CB 3.38Å; A276-C279 PolarHBondContact O-N 3.41Å; A276-A280 PolarHBondContact O-N 2.93Å; A276-A371 HydrophobicContact CB-CB 4.46Å; A276-F375 HydrophobicContact CB-CB 4.17Å
277	T	98.4	Very high	96.7	Very high	38 Å²	38	23.8 Å²	23.8	23%	0.233	12%	0.122	C	C	.	.	H	α-helix	trans	-66.5	-40.4	174.7	-53.9	0	0	0	0	111.5	F273 Y274 F275 A280 F281 V367 Y368	F273-T277 WeakPolarHBondContact O-CB 3.38Å; F273-T277 PolarHBondContact O-N 3.48Å; F273-T277 PolarHBondContact O-OG1 3.5Å; Y274-T277 WeakPolarHBondContact O-CB 3.37Å; Y274-T277 PolarHBondContact O-N 3.04Å; F275-T277 VanDerWaalsContact C-N 3.27Å; F275-T277 PolarHBondContact O-N 3.06Å; T277-A280 PolarHBondContact O-N 3.2Å; T277-F281 WeakPolarHBondContact O-CB 3.26Å; T277-F281 PolarHBondContact O-N 3.49Å; T277-V367 HydrophobicContact CG2-CG1 4.23Å; T277-Y368 WeakPolarHBondContact OG1-CD1 3.28Å
278	F	98	Very high	96.8	Very high	17 Å²	17	20.1 Å²	20.1	8%	0.075	11%	0.11	C	C	.	.	H	α-helix	trans	-58.9	-47.9	172.1	170.9	-98.9	0	0	0	111.1	L130 Y274 F275 A280 F281 S282 L413 F416 F420	L130-F278 HydrophobicContact CD1-CE2 3.45Å; L130-F278 VanDerWaalsContact CD1-CE2 3.45Å; L130-F278 HydrophobicContact CD1-CZ 3.5Å; L130-F278 VanDerWaalsContact CD1-CZ 3.5Å; Y274-F278 WeakPolarHBondContact O-CB 3.46Å; Y274-F278 PolarHBondContact O-N 2.92Å; F275-F278 HydrophobicContact CD2-CD1 4.27Å; F275-F278 HydrophobicContact CE2-CD1 4.41Å; F275-F278 WeakPolarHBondContact O-CB 3.35Å; F275-F278 PolarHBondContact O-N 2.81Å; F278-A280 VanDerWaalsContact C-N 3.32Å; F278-A280 PolarHBondContact O-N 3.46Å; F278-F281 PolarHBondContact O-N 3.48Å; F278-S282 WeakPolarHBondContact O-CB 3.4Å; F278-S282 PolarHBondContact O-N 3.26Å; F278-S282 PolarHBondContact O-OG 2.79Å; F278-L413 HydrophobicContact CD2-CD2 4.39Å; F278-F416 HydrophobicContact CB-CD2 3.96Å; F278-F416 HydrophobicContact CB-CE2 4.36Å; F278-F416 HydrophobicContact CD1-CB 4.01Å; F278-F416 HydrophobicContact CD1-CD2 4.09Å; F278-F416 HydrophobicContact CE1-CB 4.13Å; F278-F416 AromaticContact CG-CD2 3.95Å; F278-F416 HydrophobicContact CG-CD2 3.95Å; F278-F420 HydrophobicContact CD1-CD2 4.19Å; F278-F420 HydrophobicContact CE1-CB 3.97Å; F278-F420 AromaticContact CE1-CD2 3.67Å; F278-F420 HydrophobicContact CE1-CD2 3.67Å; F278-F420 HydrophobicContact CE1-CE2 4.32Å; F278-F420 AromaticContact CE1-CG 3.82Å; F278-F420 HydrophobicContact CE1-CG 3.82Å
279	C	97.8	Very high	96.7	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-57.1	-42.7	175.2	-71.3	0	0	0	0	112.6	F275 A276 T283 F375 W423	F275-C279 WeakPolarHBondContact CE2-SG 3.15Å; F275-C279 VanDerWaalsContact CZ-SG 3.54Å; F275-C279 PolarHBondContact O-N 3.42Å; F275-C279 PolarHBondContact O-SG 3.3Å; A276-C279 WeakPolarHBondContact O-CB 3.38Å; A276-C279 PolarHBondContact O-N 3.41Å; C279-T283 WeakPolarHBondContact O-CG2 3.35Å; C279-T283 PolarHBondContact O-N 2.96Å; C279-T283 PolarHBondContact O-OG1 3.24Å; C279-F375 HydrophobicContact CB-CD2 4.01Å; C279-W423 HydrophobicContact CB-CD2 4.35Å; C279-W423 HydrophobicContact CB-CE3 3.96Å; C279-W423 HydrophobicContact CB-CH2 3.9Å; C279-W423 HydrophobicContact CB-CZ2 4.26Å; C279-W423 HydrophobicContact CB-CZ3 3.72Å
280	A	97.4	Very high	96.5	Very high	4 Å²	4	21.5 Å²	21.5	3%	0.033	12%	0.122	C	C	.	.	H	α-helix	trans	-65	-43.5	176.1	0	0	0	0	0	112.3	A276 T277 F278 T283 F287 A371 Y374	A276-A280 PolarHBondContact O-N 2.93Å; T277-A280 PolarHBondContact O-N 3.2Å; F278-A280 VanDerWaalsContact C-N 3.32Å; F278-A280 PolarHBondContact O-N 3.46Å; A280-T283 CarbonylContact O-C 3.5Å; A280-T283 PolarHBondContact O-N 3.39Å; A280-T283 PolarHBondContact O-OG1 3.04Å; A280-F287 HydrophobicContact CB-CB 4.47Å; A280-F287 HydrophobicContact CB-CD1 4.19Å; A280-F287 HydrophobicContact CB-CD2 3.69Å; A280-F287 HydrophobicContact CB-CE1 4.33Å; A280-F287 HydrophobicContact CB-CE2 3.85Å; A280-F287 HydrophobicContact CB-CG 3.87Å; A280-F287 HydrophobicContact CB-CZ 4.16Å; A280-A371 HydrophobicContact CB-CB 4.19Å; A280-Y374 HydrophobicContact CB-CD1 3.94Å; A280-Y374 HydrophobicContact CB-CE1 4.38Å
281	F	97	Very high	96.4	Very high	113 Å²	113	24.4 Å²	24.4	50%	0.496	14%	0.137	S	C	.	.	H	α-helix	trans	-66.5	-37.8	178.4	179.6	-95.6	0	0	0	112.8	T277 F278 T283 P284 W442 I446	T277-F281 WeakPolarHBondContact O-CB 3.26Å; T277-F281 PolarHBondContact O-N 3.49Å; F278-F281 PolarHBondContact O-N 3.48Å; F281-T283 PolarHBondContact O-N 2.85Å; F281-P284 WeakPolarHBondContact O-CD 3.42Å; F281-W442 HydrophobicContact CD2-CZ2 4.36Å; F281-W442 HydrophobicContact CE1-CZ2 4.04Å; F281-W442 HydrophobicContact CE2-CH2 4.36Å; F281-W442 AromaticContact CE2-CZ2 3.69Å; F281-W442 HydrophobicContact CE2-CZ2 3.69Å; F281-W442 HydrophobicContact CZ-CH2 4.27Å; F281-W442 AromaticContact CZ-CZ2 3.51Å; F281-W442 HydrophobicContact CZ-CZ2 3.51Å; F281-W442 PolarHBondContact O-NE1 2.95Å; F281-I446 HydrophobicContact CE1-CD1 3.75Å; F281-I446 HydrophobicContact CZ-CD1 4.16Å
282	S	96.1	Very high	96.4	Very high	3 Å²	3	30.1 Å²	30.1	2%	0.021	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-6.1	176.3	-57	0	0	0	0	112.8	F278 E439	F278-S282 WeakPolarHBondContact O-CB 3.4Å; F278-S282 PolarHBondContact O-N 3.26Å; F278-S282 PolarHBondContact O-OG 2.79Å; S282-E439 WeakPolarHBondContact O-CG 3.33Å
283	T	95.3	Very high	96.2	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.192	C	C	.	.	S	Bend	trans	-136.9	51.4	-176	62.1	0	0	0	0	112.5	C279 A280 F281 V285 Q286 F287 Y374 W423	C279-T283 WeakPolarHBondContact O-CG2 3.35Å; C279-T283 PolarHBondContact O-N 2.96Å; C279-T283 PolarHBondContact O-OG1 3.24Å; A280-T283 CarbonylContact O-C 3.5Å; A280-T283 PolarHBondContact O-N 3.39Å; A280-T283 PolarHBondContact O-OG1 3.04Å; F281-T283 PolarHBondContact O-N 2.85Å; T283-V285 VanDerWaalsContact C-N 3.34Å; T283-V285 PolarHBondContact O-N 2.65Å; T283-Q286 PolarHBondContact O-N 2.89Å; T283-Q286 PolarHBondContact O-OE1 3.43Å; T283-F287 WeakPolarHBondContact O-CB 3.46Å; T283-F287 PolarHBondContact O-N 3.48Å; T283-Y374 VanDerWaalsContact OG1-CE1 3.31Å; T283-Y374 WeakPolarHBondContact OG1-CE1 3.48Å; T283-Y374 PolarHBondContact OG1-OH 3.43Å; T283-W423 HydrophobicContact CG2-CH2 3.99Å; T283-W423 HydrophobicContact CG2-CZ3 3.84Å
284	P	95.2	Very high	96	Very high	44 Å²	44	37 Å²	37	29%	0.286	21%	0.208	S	C	.	.	H	α-helix	trans	-63.8	-35.5	-160.1	26.2	-35.4	0	0	0	113.5	F281 G288 W442	F281-P284 WeakPolarHBondContact O-CD 3.42Å; P284-G288 PolarHBondContact O-N 2.93Å; P284-W442 HydrophobicContact CG-CD2 4.03Å; P284-W442 HydrophobicContact CG-CG 3.89Å
285	V	94.5	Very high	95.9	Very high	57 Å²	57	40.2 Å²	40.2	35%	0.345	23%	0.225	S	C	.	.	H	α-helix	trans	-72.7	-40.2	-178.3	-167.6	0	0	0	0	111.1	T283 G288 G289 Y435 C438	T283-V285 VanDerWaalsContact C-N 3.34Å; T283-V285 PolarHBondContact O-N 2.65Å; V285-G288 PolarHBondContact O-N 2.87Å; V285-G289 PolarHBondContact O-N 3.48Å; V285-Y435 HydrophobicContact CB-CD1 4.08Å; V285-Y435 HydrophobicContact CG1-CD1 3.39Å; V285-Y435 HydrophobicContact CG1-CE1 3.63Å; V285-C438 HydrophobicContact CG2-CB 3.82Å
286	Q	92.5	Very high	95.7	Very high	23 Å²	23	46.6 Å²	46.6	11%	0.107	25%	0.253	C	S	.	.	H	α-helix	trans	-67.5	-40.8	175.4	-63	90.4	-37.5	0	0	110.8	T283 G289 F290 Y374 T431 E439	T283-Q286 PolarHBondContact O-N 2.89Å; T283-Q286 PolarHBondContact O-OE1 3.43Å; Q286-G289 PolarHBondContact O-N 3.26Å; Q286-F290 WeakPolarHBondContact O-CB 3.41Å; Q286-F290 PolarHBondContact O-N 2.88Å; Q286-Y374 HydrophobicContact CB-CE2 4.47Å; Q286-Y374 WeakPolarHBondContact CB-OH 3.43Å; Q286-T431 HydrophobicContact CG-CG2 4.3Å; Q286-E439 PolarHBondContact NE2-OE2 3.03Å
287	F	95.1	Very high	95.4	Very high	45 Å²	45	49.7 Å²	49.7	20%	0.197	28%	0.275	C	S	.	.	H	α-helix	trans	-62.3	-46.3	174.4	-178.8	-120.9	0	0	0	111.9	A280 T283 G289 F290 I291 V370 Y374	A280-F287 HydrophobicContact CB-CB 4.47Å; A280-F287 HydrophobicContact CB-CD1 4.19Å; A280-F287 HydrophobicContact CB-CD2 3.69Å; A280-F287 HydrophobicContact CB-CE1 4.33Å; A280-F287 HydrophobicContact CB-CE2 3.85Å; A280-F287 HydrophobicContact CB-CG 3.87Å; A280-F287 HydrophobicContact CB-CZ 4.16Å; T283-F287 WeakPolarHBondContact O-CB 3.46Å; T283-F287 PolarHBondContact O-N 3.48Å; F287-G289 PolarHBondContact O-N 2.97Å; F287-F290 HydrophobicContact CD2-CD1 4.46Å; F287-F290 WeakPolarHBondContact O-CB 3.43Å; F287-F290 PolarHBondContact O-N 2.77Å; F287-F290 VanDerWaalsContact O-N 3.16Å; F287-I291 HydrophobicContact CD1-CD1 4.07Å; F287-I291 HydrophobicContact CE1-CD1 3.63Å; F287-I291 HydrophobicContact CE2-CD1 4.25Å; F287-I291 HydrophobicContact CE2-CG1 4.42Å; F287-I291 HydrophobicContact CZ-CD1 3.74Å; F287-I291 HydrophobicContact CZ-CG1 4.36Å; F287-I291 WeakPolarHBondContact O-CG1 3.48Å; F287-I291 PolarHBondContact O-N 3.42Å; F287-V370 HydrophobicContact CE2-CG1 3.89Å; F287-V370 HydrophobicContact CZ-CG1 3.87Å; F287-Y374 HydrophobicContact CB-CE1 4.41Å; F287-Y374 AromaticContact CD2-CD1 3.77Å; F287-Y374 HydrophobicContact CD2-CD1 3.77Å; F287-Y374 HydrophobicContact CD2-CD2 4.08Å; F287-Y374 HydrophobicContact CD2-CE1 4.4Å; F287-Y374 AromaticContact CD2-CG 3.59Å; F287-Y374 HydrophobicContact CD2-CG 3.59Å; F287-Y374 HydrophobicContact CE2-CD1 4.48Å; F287-Y374 HydrophobicContact CE2-CG 4.21Å
288	G	95.7	Very high	95.1	Very high	28 Å²	28	51.5 Å²	51.5	29%	0.289	28%	0.28	S	S	.	.	H	α-helix	trans	-59.5	-44.1	173.8	0	0	0	0	0	112.4	P284 V285 F290 I291 L292	P284-G288 PolarHBondContact O-N 2.93Å; V285-G288 PolarHBondContact O-N 2.87Å; G288-F290 VanDerWaalsContact C-N 3.33Å; G288-F290 PolarHBondContact O-N 3.15Å; G288-I291 PolarHBondContact O-N 2.72Å; G288-L292 WeakPolarHBondContact O-CG 3.5Å; G288-L292 PolarHBondContact O-N 3.35Å
289	G	93.4	Very high	94.9	Very high	23 Å²	23	57.4 Å²	57.4	24%	0.237	31%	0.305	C	S	.	.	H	α-helix	trans	-60.3	-39.7	173.7	0	0	0	0	0	113.1	V285 Q286 F287 L292 N293	V285-G289 PolarHBondContact O-N 3.48Å; Q286-G289 PolarHBondContact O-N 3.26Å; F287-G289 PolarHBondContact O-N 2.97Å; G289-L292 PolarHBondContact O-N 3.37Å; G289-N293 VanDerWaalsContact O-CB 3.29Å; G289-N293 WeakPolarHBondContact O-CB 3.36Å; G289-N293 PolarHBondContact O-N 3.37Å; G289-N293 PolarHBondContact O-ND2 2.84Å
290	F	93.9	Very high	94.7	Very high	29 Å²	29	61.2 Å²	61.2	13%	0.127	33%	0.326	C	S	.	.	H	α-helix	trans	-62.2	-45.1	174.2	166.7	-100	0	0	0	111.9	Q286 F287 G288 N293 S294 V370 A373 Y374 N377	Q286-F290 WeakPolarHBondContact O-CB 3.41Å; Q286-F290 PolarHBondContact O-N 2.88Å; F287-F290 HydrophobicContact CD2-CD1 4.46Å; F287-F290 WeakPolarHBondContact O-CB 3.43Å; F287-F290 PolarHBondContact O-N 2.77Å; F287-F290 VanDerWaalsContact O-N 3.16Å; G288-F290 VanDerWaalsContact C-N 3.33Å; G288-F290 PolarHBondContact O-N 3.15Å; F290-N293 PolarHBondContact O-N 2.96Å; F290-S294 VanDerWaalsContact O-CB 3.29Å; F290-S294 WeakPolarHBondContact O-CB 3.22Å; F290-S294 PolarHBondContact O-N 3.05Å; F290-S294 PolarHBondContact O-OG 3.16Å; F290-V370 HydrophobicContact CE1-CG1 4.37Å; F290-A373 HydrophobicContact CZ-CB 4.11Å; F290-Y374 HydrophobicContact CB-CD2 3.62Å; F290-Y374 HydrophobicContact CB-CE2 4.08Å; F290-Y374 AromaticContact CD1-CD2 3.86Å; F290-Y374 HydrophobicContact CD1-CD2 3.86Å; F290-Y374 HydrophobicContact CD1-CG 4.2Å; F290-Y374 HydrophobicContact CD2-CD2 4.21Å; F290-Y374 AromaticContact CG-CD2 3.62Å; F290-Y374 HydrophobicContact CG-CD2 3.62Å; F290-Y374 HydrophobicContact CG-CG 4.4Å; F290-N377 HydrophobicContact CD2-CB 4.19Å; F290-N377 HydrophobicContact CE2-CB 3.62Å; F290-N377 HydrophobicContact CZ-CB 4.38Å
291	I	96.6	Very high	94.5	Very high	60 Å²	60	62.9 Å²	62.9	31%	0.308	33%	0.333	S	S	.	.	H	α-helix	trans	-60	-50.1	177.3	-68.3	169.7	0	0	0	110.4	F287 G288 N293 S294 I295 V370	F287-I291 HydrophobicContact CD1-CD1 4.07Å; F287-I291 HydrophobicContact CE1-CD1 3.63Å; F287-I291 HydrophobicContact CE2-CD1 4.25Å; F287-I291 HydrophobicContact CE2-CG1 4.42Å; F287-I291 HydrophobicContact CZ-CD1 3.74Å; F287-I291 HydrophobicContact CZ-CG1 4.36Å; F287-I291 WeakPolarHBondContact O-CG1 3.48Å; F287-I291 PolarHBondContact O-N 3.42Å; G288-I291 PolarHBondContact O-N 2.72Å; I291-N293 PolarHBondContact O-N 2.81Å; I291-S294 WeakPolarHBondContact O-CB 3.36Å; I291-S294 PolarHBondContact O-N 3.15Å; I291-I295 HydrophobicContact CG2-CD1 3.84Å; I291-I295 WeakPolarHBondContact O-CG1 3.34Å; I291-I295 PolarHBondContact O-N 3.09Å; I291-V370 HydrophobicContact CD1-CG1 4.48Å; I291-V370 HydrophobicContact CG1-CG1 4.17Å
292	L	96.5	Very high	94.3	Very high	120 Å²	120	61.1 Å²	61.1	63%	0.628	33%	0.329	S	S	*	.	H	α-helix	trans	-60.6	-43.9	180	-68	174.2	0	0	0	112	G288 G289 S294 I295 K296	G288-L292 WeakPolarHBondContact O-CG 3.5Å; G288-L292 PolarHBondContact O-N 3.35Å; G289-L292 PolarHBondContact O-N 3.37Å; L292-S294 VanDerWaalsContact C-N 3.33Å; L292-S294 PolarHBondContact O-N 2.62Å; L292-I295 PolarHBondContact O-N 2.86Å; L292-K296 WeakPolarHBondContact O-CB 3.41Å; L292-K296 PolarHBondContact O-N 2.93Å
293	N	93.9	Very high	94.2	Very high	109 Å²	109	64.5 Å²	64.5	58%	0.583	36%	0.357	S	S	*	.	H	α-helix	trans	-66	-36.6	177.1	-74.1	-26.1	0	0	0	112.2	G289 F290 I291 K296 S297	G289-N293 VanDerWaalsContact O-CB 3.29Å; G289-N293 WeakPolarHBondContact O-CB 3.36Å; G289-N293 PolarHBondContact O-N 3.37Å; G289-N293 PolarHBondContact O-ND2 2.84Å; F290-N293 PolarHBondContact O-N 2.96Å; I291-N293 PolarHBondContact O-N 2.81Å; N293-K296 PolarHBondContact O-N 2.98Å; N293-S297 VanDerWaalsContact O-CB 3.28Å; N293-S297 WeakPolarHBondContact O-CB 3.45Å; N293-S297 PolarHBondContact O-N 3.39Å
294	S	93.7	Very high	94.1	Very high	48 Å²	48	70.3 Å²	70.3	34%	0.336	39%	0.388	S	S	.	.	H	α-helix	trans	-65.6	-44.2	176.4	-60.5	0	0	0	0	111.2	F290 I291 L292 K296 S297 F298	F290-S294 VanDerWaalsContact O-CB 3.29Å; F290-S294 WeakPolarHBondContact O-CB 3.22Å; F290-S294 PolarHBondContact O-N 3.05Å; F290-S294 PolarHBondContact O-OG 3.16Å; I291-S294 WeakPolarHBondContact O-CB 3.36Å; I291-S294 PolarHBondContact O-N 3.15Å; L292-S294 VanDerWaalsContact C-N 3.33Å; L292-S294 PolarHBondContact O-N 2.62Å; S294-K296 PolarHBondContact O-N 3.43Å; S294-S297 PolarHBondContact O-N 3.1Å; S294-F298 WeakPolarHBondContact O-CB 3.35Å; S294-F298 PolarHBondContact O-N 3.12Å
295	I	95.1	Very high	93.9	Very high	83 Å²	83	77.1 Å²	77.1	43%	0.426	41%	0.408	S	S	.	.	H	α-helix	trans	-61.4	-45.6	174.6	-66.5	166.3	0	0	0	110.6	I291 L292 F298 K299	I291-I295 HydrophobicContact CG2-CD1 3.84Å; I291-I295 WeakPolarHBondContact O-CG1 3.34Å; I291-I295 PolarHBondContact O-N 3.09Å; L292-I295 PolarHBondContact O-N 2.86Å; I295-F298 PolarHBondContact O-N 3.04Å; I295-K299 HydrophobicContact CG2-CD 4.45Å; I295-K299 WeakPolarHBondContact O-CG 3.39Å; I295-K299 PolarHBondContact O-N 2.8Å
296	K	95.4	Very high	93.7	Very high	134 Å²	134	76.6 Å²	76.6	58%	0.583	41%	0.407	S	S	*	.	H	α-helix	trans	-62.3	-44	177.7	-175	177	179.9	177	0	111.7	L292 N293 S294 K299 N300	L292-K296 WeakPolarHBondContact O-CB 3.41Å; L292-K296 PolarHBondContact O-N 2.93Å; N293-K296 PolarHBondContact O-N 2.98Å; S294-K296 PolarHBondContact O-N 3.43Å; K296-K299 PolarHBondContact O-N 2.88Å; K296-N300 VanDerWaalsContact O-CG 3.27Å; K296-N300 PolarHBondContact O-N 3.02Å
297	S	91.9	Very high	93.6	Very high	66 Å²	66	82.7 Å²	82.7	46%	0.462	43%	0.429	S	S	.	.	H	α-helix	trans	-59.8	-46.4	176.7	-172.3	0	0	0	0	111.2	N293 S294 K299 N300 L301	N293-S297 VanDerWaalsContact O-CB 3.28Å; N293-S297 WeakPolarHBondContact O-CB 3.45Å; N293-S297 PolarHBondContact O-N 3.39Å; S294-S297 PolarHBondContact O-N 3.1Å; S297-K299 PolarHBondContact O-N 3.23Å; S297-N300 PolarHBondContact O-N 3.29Å; S297-L301 WeakPolarHBondContact O-CG 3.44Å; S297-L301 PolarHBondContact O-N 2.82Å
298	F	92	Very high	93.4	Very high	76 Å²	76	91.2 Å²	91.2	33%	0.333	46%	0.46	S	S	.	.	H	α-helix	trans	-61.2	-45.1	177.2	-173.8	-102.4	0	0	0	112.6	S294 I295 N300 L301 L302 L310 F313	S294-F298 WeakPolarHBondContact O-CB 3.35Å; S294-F298 PolarHBondContact O-N 3.12Å; I295-F298 PolarHBondContact O-N 3.04Å; F298-N300 VanDerWaalsContact C-N 3.32Å; F298-N300 PolarHBondContact O-N 2.71Å; F298-L301 PolarHBondContact O-N 3.05Å; F298-L302 HydrophobicContact CD1-CD1 3.96Å; F298-L302 HydrophobicContact CE1-CD1 3.56Å; F298-L302 HydrophobicContact CE1-CG 4.27Å; F298-L302 HydrophobicContact CZ-CD1 4.15Å; F298-L302 HydrophobicContact CZ-CG 4.49Å; F298-L302 PolarHBondContact O-N 3.35Å; F298-L302 VanDerWaalsContact O-N 3.12Å; F298-L310 HydrophobicContact CD2-CD1 4.21Å; F298-L310 HydrophobicContact CE2-CD1 3.52Å; F298-L310 HydrophobicContact CZ-CD1 4.13Å; F298-F313 HydrophobicContact CD2-CD1 4.34Å; F298-F313 HydrophobicContact CD2-CE1 4.22Å; F298-F313 HydrophobicContact CE2-CD1 4.06Å; F298-F313 HydrophobicContact CE2-CE1 4.08Å
299	K	94.3	Very high	93.1	Very high	141 Å²	141	93.4 Å²	93.4	61%	0.613	47%	0.468	S	S	*	.	H	α-helix	trans	-59.2	-42.1	174.5	-73.7	-177.5	178	-174.4	0	112.3	I295 K296 S297 L302 A303	I295-K299 HydrophobicContact CG2-CD 4.45Å; I295-K299 WeakPolarHBondContact O-CG 3.39Å; I295-K299 PolarHBondContact O-N 2.8Å; K296-K299 PolarHBondContact O-N 2.88Å; S297-K299 PolarHBondContact O-N 3.23Å; K299-L302 PolarHBondContact O-N 3.18Å; K299-A303 WeakPolarHBondContact O-CB 2.99Å; K299-A303 PolarHBondContact O-N 3.16Å
300	N	94.4	Very high	93	Very high	80 Å²	80	92.9 Å²	92.9	43%	0.428	46%	0.459	S	S	.	.	H	α-helix	trans	-66	-38.2	177.5	-72	-9.9	0	0	0	112.3	K296 S297 F298 L302 A303 N304	K296-N300 VanDerWaalsContact O-CG 3.27Å; K296-N300 PolarHBondContact O-N 3.02Å; S297-N300 PolarHBondContact O-N 3.29Å; F298-N300 VanDerWaalsContact C-N 3.32Å; F298-N300 PolarHBondContact O-N 2.71Å; N300-L302 VanDerWaalsContact C-N 3.34Å; N300-A303 PolarHBondContact O-N 3.36Å; N300-N304 VanDerWaalsContact O-CB 3.27Å; N300-N304 WeakPolarHBondContact O-CB 3.28Å; N300-N304 PolarHBondContact O-N 3.28Å; N300-N304 PolarHBondContact O-ND2 2.84Å
301	L	92.3	Very high	92.8	Very high	38 Å²	38	94.9 Å²	94.9	20%	0.199	48%	0.477	C	S	.	.	H	α-helix	trans	-63	-40.3	176	-72	172.5	0	0	0	112	S297 F298 R305 S306 V309	S297-L301 WeakPolarHBondContact O-CG 3.44Å; S297-L301 PolarHBondContact O-N 2.82Å; F298-L301 PolarHBondContact O-N 3.05Å; L301-R305 PolarHBondContact O-N 3.46Å; L301-S306 PolarHBondContact O-N 2.65Å; L301-V309 HydrophobicContact CD1-CG1 3.92Å; L301-V309 HydrophobicContact CD2-CB 4.08Å; L301-V309 HydrophobicContact CD2-CG1 3.9Å
302	L	92.3	Very high	92.6	Very high	77 Å²	77	96.7 Å²	96.7	40%	0.403	49%	0.486	S	S	.	.	H	α-helix	trans	-64.9	-49	174.1	-69.8	173.1	0	0	0	111.5	F298 K299 N300 N304 R305 L310	F298-L302 HydrophobicContact CD1-CD1 3.96Å; F298-L302 HydrophobicContact CE1-CD1 3.56Å; F298-L302 HydrophobicContact CE1-CG 4.27Å; F298-L302 HydrophobicContact CZ-CD1 4.15Å; F298-L302 HydrophobicContact CZ-CG 4.49Å; F298-L302 PolarHBondContact O-N 3.35Å; F298-L302 VanDerWaalsContact O-N 3.12Å; K299-L302 PolarHBondContact O-N 3.18Å; N300-L302 VanDerWaalsContact C-N 3.34Å; L302-N304 PolarHBondContact O-N 3Å; L302-R305 PolarHBondContact O-N 3.3Å; L302-R305 VanDerWaalsContact O-N 3.15Å; L302-L310 HydrophobicContact CD2-CD1 4.18Å; L302-L310 HydrophobicContact CD2-CD2 3.7Å
303	A	94	Very high	92.2	Very high	74 Å²	74	96 Å²	96	61%	0.612	48%	0.478	S	S	*	.	H	α-helix	trans	-61.1	-43.1	180	0	0	0	0	0	112.2	K299 N300 R305	K299-A303 WeakPolarHBondContact O-CB 2.99Å; K299-A303 PolarHBondContact O-N 3.16Å; N300-A303 PolarHBondContact O-N 3.36Å; A303-R305 PolarHBondContact O-N 3.36Å
304	N	93.7	Very high	92	Very high	121 Å²	121	95.8 Å²	95.8	65%	0.647	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	6	179.5	-66.4	-17.9	0	0	0	113.5	N300 L302 S306	N300-N304 VanDerWaalsContact O-CB 3.27Å; N300-N304 WeakPolarHBondContact O-CB 3.28Å; N300-N304 PolarHBondContact O-N 3.28Å; N300-N304 PolarHBondContact O-ND2 2.84Å; L302-N304 PolarHBondContact O-N 3Å; N304-S306 PolarHBondContact O-N 3.37Å
305	R	90.4	Very high	92	Very high	188 Å²	188	98.8 Å²	98.8	71%	0.709	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	39.7	179.5	-62.1	-177.5	-179.8	-179.5	0.1	112.9	L301 L302 A303 W307	L301-R305 PolarHBondContact O-N 3.46Å; L302-R305 PolarHBondContact O-N 3.3Å; L302-R305 VanDerWaalsContact O-N 3.15Å; A303-R305 PolarHBondContact O-N 3.36Å; R305-W307 HydrophobicContact CB-CZ2 4.45Å; R305-W307 HydrophobicContact CG-CZ2 4.32Å; R305-W307 PolarHBondContact O-N 3.39Å
306	S	90.2	Very high	91.8	Very high	45 Å²	45	99.7 Å²	99.7	32%	0.315	49%	0.493	S	S	.	.			trans	-78.1	58.5	-178	-66.5	0	0	0	0	111.2	L301 N304 R308 V309 L310	L301-S306 PolarHBondContact O-N 2.65Å; N304-S306 PolarHBondContact O-N 3.37Å; S306-R308 VanDerWaalsContact C-N 3.28Å; S306-R308 PolarHBondContact O-N 2.94Å; S306-R308 VanDerWaalsContact O-N 3.15Å; S306-V309 PolarHBondContact O-N 2.82Å; S306-L310 PolarHBondContact O-N 2.88Å; S306-L310 VanDerWaalsContact O-N 3.1Å
307	W	90.4	Very high	91.8	Very high	151 Å²	151	95 Å²	95	57%	0.572	48%	0.476	S	S	*	.	H	α-helix	trans	-56.6	-36	-167.3	-62.3	118.4	0	0	0	113.6	R305 V309 L310 S311	R305-W307 HydrophobicContact CB-CZ2 4.45Å; R305-W307 HydrophobicContact CG-CZ2 4.32Å; R305-W307 PolarHBondContact O-N 3.39Å; W307-V309 PolarHBondContact O-N 3.46Å; W307-L310 HydrophobicContact CE3-CD2 3.63Å; W307-L310 HydrophobicContact CZ3-CD2 3.53Å; W307-L310 PolarHBondContact O-N 3.42Å; W307-S311 WeakPolarHBondContact O-CB 3.35Å; W307-S311 PolarHBondContact O-N 3.45Å; W307-S311 PolarHBondContact O-OG 2.86Å
308	R	91.9	Very high	91.9	Very high	224 Å²	224	95.5 Å²	95.5	85%	0.845	48%	0.478	S	S	*	.	H	α-helix	trans	-58.6	-45.5	176.7	-67.2	-177	-177.6	167.8	0.8	112.4	S306 I312	S306-R308 VanDerWaalsContact C-N 3.28Å; S306-R308 PolarHBondContact O-N 2.94Å; S306-R308 VanDerWaalsContact O-N 3.15Å; R308-I312 VanDerWaalsContact O-CG1 3.32Å; R308-I312 WeakPolarHBondContact O-CG1 3.4Å; R308-I312 PolarHBondContact O-N 3.23Å
309	V	89.5	Confident	92	Very high	75 Å²	75	96.4 Å²	96.4	46%	0.455	49%	0.485	S	S	.	.	H	α-helix	trans	-71	-40	179.2	-178.7	0	0	0	0	110.2	L301 S306 W307 I312 F313	L301-V309 HydrophobicContact CD1-CG1 3.92Å; L301-V309 HydrophobicContact CD2-CB 4.08Å; L301-V309 HydrophobicContact CD2-CG1 3.9Å; S306-V309 PolarHBondContact O-N 2.82Å; W307-V309 PolarHBondContact O-N 3.46Å; V309-I312 PolarHBondContact O-N 3.34Å; V309-F313 PolarHBondContact O-N 3.5Å
310	L	89.9	Confident	92.1	Very high	12 Å²	12	92.9 Å²	92.9	6%	0.063	47%	0.47	C	S	.	.	H	α-helix	trans	-62.6	-43.4	177.5	-167.4	70.2	0	0	0	111.7	F298 L302 S306 W307 I312 F313 L314	F298-L310 HydrophobicContact CD2-CD1 4.21Å; F298-L310 HydrophobicContact CE2-CD1 3.52Å; F298-L310 HydrophobicContact CZ-CD1 4.13Å; L302-L310 HydrophobicContact CD2-CD1 4.18Å; L302-L310 HydrophobicContact CD2-CD2 3.7Å; S306-L310 PolarHBondContact O-N 2.88Å; S306-L310 VanDerWaalsContact O-N 3.1Å; W307-L310 HydrophobicContact CE3-CD2 3.63Å; W307-L310 HydrophobicContact CZ3-CD2 3.53Å; W307-L310 PolarHBondContact O-N 3.42Å; L310-I312 VanDerWaalsContact C-N 3.34Å; L310-I312 PolarHBondContact O-N 3.25Å; L310-F313 PolarHBondContact O-N 3.14Å; L310-L314 HydrophobicContact CD2-CD1 4.44Å; L310-L314 HydrophobicContact CG-CD1 4.05Å; L310-L314 HydrophobicContact CG-CG 4.4Å; L310-L314 WeakPolarHBondContact O-CB 3.41Å; L310-L314 VanDerWaalsContact O-CG 3.3Å; L310-L314 WeakPolarHBondContact O-CG 3.14Å; L310-L314 PolarHBondContact O-N 2.97Å
311	S	91.1	Very high	92.2	Very high	71 Å²	71	90.9 Å²	90.9	50%	0.497	46%	0.46	S	S	.	.	H	α-helix	trans	-62.2	-39.7	176.6	-61.7	0	0	0	0	112.2	W307 L314 L315	W307-S311 WeakPolarHBondContact O-CB 3.35Å; W307-S311 PolarHBondContact O-N 3.45Å; W307-S311 PolarHBondContact O-OG 2.86Å; S311-L314 PolarHBondContact O-N 2.82Å; S311-L315 WeakPolarHBondContact O-CB 3.45Å; S311-L315 PolarHBondContact O-N 2.6Å
312	I	91.5	Very high	92.4	Very high	98 Å²	98	93.9 Å²	93.9	50%	0.503	48%	0.476	S	S	.	.	H	α-helix	trans	-62.4	-45.8	174	-67.3	165.1	0	0	0	110.3	R308 V309 L310 L315 L316	R308-I312 VanDerWaalsContact O-CG1 3.32Å; R308-I312 WeakPolarHBondContact O-CG1 3.4Å; R308-I312 PolarHBondContact O-N 3.23Å; V309-I312 PolarHBondContact O-N 3.34Å; L310-I312 VanDerWaalsContact C-N 3.34Å; L310-I312 PolarHBondContact O-N 3.25Å; I312-L315 PolarHBondContact O-N 2.83Å; I312-L316 HydrophobicContact CG2-CD1 3.57Å; I312-L316 HydrophobicContact CG2-CG 4.12Å; I312-L316 WeakPolarHBondContact O-CB 3.42Å; I312-L316 WeakPolarHBondContact O-CG 3.37Å; I312-L316 PolarHBondContact O-N 2.91Å
313	F	89	Confident	92.6	Very high	105 Å²	105	94.1 Å²	94.1	46%	0.461	47%	0.474	S	S	.	.	H	α-helix	trans	-63.3	-41.9	178.2	-175	-96.2	0	0	0	112.5	F298 V309 L310 L315 T317	F298-F313 HydrophobicContact CD2-CD1 4.34Å; F298-F313 HydrophobicContact CD2-CE1 4.22Å; F298-F313 HydrophobicContact CE2-CD1 4.06Å; F298-F313 HydrophobicContact CE2-CE1 4.08Å; V309-F313 PolarHBondContact O-N 3.5Å; L310-F313 PolarHBondContact O-N 3.14Å; F313-L315 VanDerWaalsContact C-N 3.28Å; F313-L315 PolarHBondContact O-N 3.43Å; F313-T317 VanDerWaalsContact O-CB 3.3Å; F313-T317 WeakPolarHBondContact O-CB 3.41Å; F313-T317 PolarHBondContact O-N 3.33Å; F313-T317 VanDerWaalsContact O-N 3.1Å; F313-T317 PolarHBondContact O-OG1 3.49Å
314	L	89.1	Confident	92.8	Very high	105 Å²	105	90.6 Å²	90.6	55%	0.55	45%	0.445	S	S	.	.	H	α-helix	trans	-67.6	-26	177.5	-73.1	172.2	0	0	0	112.9	L310 S311 P318	L310-L314 HydrophobicContact CD2-CD1 4.44Å; L310-L314 HydrophobicContact CG-CD1 4.05Å; L310-L314 HydrophobicContact CG-CG 4.4Å; L310-L314 WeakPolarHBondContact O-CB 3.41Å; L310-L314 VanDerWaalsContact O-CG 3.3Å; L310-L314 WeakPolarHBondContact O-CG 3.14Å; L310-L314 PolarHBondContact O-N 2.97Å; S311-L314 PolarHBondContact O-N 2.82Å; L314-P318 WeakPolarHBondContact O-CD 3.49Å; L314-P318 VanDerWaalsContact O-CG 3.23Å; L314-P318 WeakPolarHBondContact O-CG 3.33Å
315	L	93	Very high	93	Very high	111 Å²	111	87.6 Å²	87.6	58%	0.581	43%	0.428	S	S	*	.	H	α-helix	trans	-84.3	-47.9	175.7	-177.8	66.3	0	0	0	112.2	S311 I312 F313 P318 I319	S311-L315 WeakPolarHBondContact O-CB 3.45Å; S311-L315 PolarHBondContact O-N 2.6Å; I312-L315 PolarHBondContact O-N 2.83Å; F313-L315 VanDerWaalsContact C-N 3.28Å; F313-L315 PolarHBondContact O-N 3.43Å; L315-P318 WeakPolarHBondContact O-CD 3.44Å; L315-I319 HydrophobicContact CD1-CD1 4.12Å; L315-I319 HydrophobicContact CG-CD1 3.95Å; L315-I319 WeakPolarHBondContact O-CD1 3.49Å; L315-I319 VanDerWaalsContact O-CG1 3.28Å; L315-I319 WeakPolarHBondContact O-CG1 3.27Å
316	L	92.4	Very high	93.4	Very high	101 Å²	101	82.4 Å²	82.4	53%	0.529	41%	0.414	S	S	.	.	H	α-helix	trans	-70.5	-34.5	-174.8	-68.9	179.3	0	0	0	112.6	I312 I319 F320	I312-L316 HydrophobicContact CG2-CD1 3.57Å; I312-L316 HydrophobicContact CG2-CG 4.12Å; I312-L316 WeakPolarHBondContact O-CB 3.42Å; I312-L316 WeakPolarHBondContact O-CG 3.37Å; I312-L316 PolarHBondContact O-N 2.91Å; L316-I319 PolarHBondContact O-N 2.85Å; L316-F320 PolarHBondContact O-N 2.86Å
317	T	94	Very high	93.7	Very high	35 Å²	35	80.3 Å²	80.3	22%	0.215	40%	0.4	C	S	.	.	H	α-helix	trans	-62.9	-52	-177.3	-55.5	0	0	0	0	112.2	F313 I319 F320 V321 L369	F313-T317 VanDerWaalsContact O-CB 3.3Å; F313-T317 WeakPolarHBondContact O-CB 3.41Å; F313-T317 PolarHBondContact O-N 3.33Å; F313-T317 VanDerWaalsContact O-N 3.1Å; F313-T317 PolarHBondContact O-OG1 3.49Å; T317-I319 VanDerWaalsContact C-N 3.33Å; T317-I319 PolarHBondContact O-N 3.26Å; T317-F320 PolarHBondContact O-N 3.43Å; T317-V321 WeakPolarHBondContact O-CG2 3.31Å; T317-V321 PolarHBondContact O-N 3.36Å; T317-L369 HydrophobicContact CG2-CD2 3.91Å
318	P	94.2	Very high	94	Very high	78 Å²	78	73.1 Å²	73.1	51%	0.506	37%	0.372	S	S	.	.	H	α-helix	trans	-60.7	-37.9	174.9	-25	35.4	0	0	0	113.8	L314 L315 F320 V321 L322	L314-P318 WeakPolarHBondContact O-CD 3.49Å; L314-P318 VanDerWaalsContact O-CG 3.23Å; L314-P318 WeakPolarHBondContact O-CG 3.33Å; L315-P318 WeakPolarHBondContact O-CD 3.44Å; P318-F320 VanDerWaalsContact C-N 3.33Å; P318-F320 PolarHBondContact O-N 3.46Å; P318-V321 PolarHBondContact O-N 3.02Å; P318-L322 WeakPolarHBondContact O-CB 3.24Å; P318-L322 PolarHBondContact O-N 3.28Å
319	I	95.5	Very high	94.2	Very high	95 Å²	95	67.6 Å²	67.6	49%	0.487	35%	0.354	S	S	.	.	H	α-helix	trans	-61	-44.8	177	-68.2	169.7	0	0	0	110.3	L315 L316 T317 L322 F323	L315-I319 HydrophobicContact CD1-CD1 4.12Å; L315-I319 HydrophobicContact CG-CD1 3.95Å; L315-I319 WeakPolarHBondContact O-CD1 3.49Å; L315-I319 VanDerWaalsContact O-CG1 3.28Å; L315-I319 WeakPolarHBondContact O-CG1 3.27Å; L316-I319 PolarHBondContact O-N 2.85Å; T317-I319 VanDerWaalsContact C-N 3.33Å; T317-I319 PolarHBondContact O-N 3.26Å; I319-L322 PolarHBondContact O-N 2.84Å; I319-F323 PolarHBondContact O-N 3.12Å
320	F	95.8	Very high	94.5	Very high	66 Å²	66	71.6 Å²	71.6	29%	0.289	36%	0.363	S	S	.	.	H	α-helix	trans	-71.1	-37.4	179.8	-165.1	-109.2	0	0	0	112.5	L316 T317 P318 L322 F323 I324 L369 T372	L316-F320 PolarHBondContact O-N 2.86Å; T317-F320 PolarHBondContact O-N 3.43Å; P318-F320 VanDerWaalsContact C-N 3.33Å; P318-F320 PolarHBondContact O-N 3.46Å; F320-L322 VanDerWaalsContact C-N 3.32Å; F320-L322 PolarHBondContact O-N 2.95Å; F320-F323 HydrophobicContact CD2-CD1 4.2Å; F320-F323 AromaticContact CE2-CD1 3.97Å; F320-F323 HydrophobicContact CE2-CD1 3.97Å; F320-F323 HydrophobicContact CE2-CE1 4.42Å; F320-F323 WeakPolarHBondContact O-CB 3.22Å; F320-F323 PolarHBondContact O-N 3.27Å; F320-I324 HydrophobicContact CD1-CD1 3.77Å; F320-I324 HydrophobicContact CD1-CG1 4.4Å; F320-I324 HydrophobicContact CE1-CD1 3.69Å; F320-I324 HydrophobicContact CE1-CG1 4.25Å; F320-I324 HydrophobicContact CZ-CD1 4.49Å; F320-I324 WeakPolarHBondContact O-CG1 3.34Å; F320-I324 PolarHBondContact O-N 2.83Å; F320-L369 HydrophobicContact CB-CD1 4.49Å; F320-L369 HydrophobicContact CD1-CD1 3.44Å; F320-L369 VanDerWaalsContact CD1-CD1 3.44Å; F320-L369 HydrophobicContact CE1-CD1 4.13Å; F320-L369 HydrophobicContact CG-CD1 4.41Å; F320-T372 HydrophobicContact CE1-CG2 4.19Å; F320-T372 HydrophobicContact CZ-CG2 3.71Å
321	V	96.5	Very high	94.8	Very high	38 Å²	38	72.4 Å²	72.4	23%	0.23	37%	0.369	C	S	.	.	H	α-helix	trans	-60	-44.6	171	171.7	0	0	0	0	110.5	T317 P318 F323 I324 L325 L369	T317-V321 WeakPolarHBondContact O-CG2 3.31Å; T317-V321 PolarHBondContact O-N 3.36Å; P318-V321 PolarHBondContact O-N 3.02Å; V321-F323 VanDerWaalsContact C-N 3.35Å; V321-F323 PolarHBondContact O-N 3.5Å; V321-I324 PolarHBondContact O-N 3.06Å; V321-L325 HydrophobicContact CG1-CD1 3.92Å; V321-L325 HydrophobicContact CG1-CG 4.32Å; V321-L325 VanDerWaalsContact O-CG 3.31Å; V321-L325 WeakPolarHBondContact O-CG 3.39Å; V321-L325 PolarHBondContact O-N 3.48Å; V321-L369 HydrophobicContact CG2-CD2 3.8Å
322	L	96.6	Very high	94.9	Very high	101 Å²	101	73.2 Å²	73.2	53%	0.529	36%	0.364	S	S	.	.	H	α-helix	trans	-61.4	-42.6	176.4	-177.8	63	0	0	0	111.5	P318 I319 F320 I324 L325 I326	P318-L322 WeakPolarHBondContact O-CB 3.24Å; P318-L322 PolarHBondContact O-N 3.28Å; I319-L322 PolarHBondContact O-N 2.84Å; F320-L322 VanDerWaalsContact C-N 3.32Å; F320-L322 PolarHBondContact O-N 2.95Å; L322-I324 PolarHBondContact O-N 3.31Å; L322-L325 PolarHBondContact O-N 3Å; L322-I326 HydrophobicContact CD1-CD1 4.07Å; L322-I326 HydrophobicContact CD1-CG1 4.21Å; L322-I326 HydrophobicContact CD2-CD1 4.45Å; L322-I326 HydrophobicContact CG-CD1 3.82Å; L322-I326 HydrophobicContact CG-CG1 4.37Å; L322-I326 WeakPolarHBondContact O-CB 3.37Å; L322-I326 VanDerWaalsContact O-CG1 3.27Å; L322-I326 WeakPolarHBondContact O-CG1 3.44Å; L322-I326 PolarHBondContact O-N 2.81Å
323	F	97.2	Very high	95.1	Very high	82 Å²	82	72.1 Å²	72.1	36%	0.36	36%	0.355	S	S	.	.	H	α-helix	trans	-58.6	-44.4	174	171.1	-106.9	0	0	0	112.3	I269 F273 I319 F320 V321 S327	I269-F323 HydrophobicContact CG2-CZ 4.22Å; F273-F323 HydrophobicContact CE1-CE1 4.23Å; F273-F323 HydrophobicContact CZ-CD1 4.16Å; F273-F323 AromaticContact CZ-CE1 3.77Å; F273-F323 HydrophobicContact CZ-CE1 3.77Å; I319-F323 PolarHBondContact O-N 3.12Å; F320-F323 HydrophobicContact CD2-CD1 4.2Å; F320-F323 AromaticContact CE2-CD1 3.97Å; F320-F323 HydrophobicContact CE2-CD1 3.97Å; F320-F323 HydrophobicContact CE2-CE1 4.42Å; F320-F323 WeakPolarHBondContact O-CB 3.22Å; F320-F323 PolarHBondContact O-N 3.27Å; V321-F323 VanDerWaalsContact C-N 3.35Å; V321-F323 PolarHBondContact O-N 3.5Å; F323-S327 VanDerWaalsContact O-CB 3.3Å; F323-S327 WeakPolarHBondContact O-CB 3.44Å; F323-S327 PolarHBondContact O-N 3.09Å; F323-S327 PolarHBondContact O-OG 3.39Å
324	I	98	Very high	95.3	Very high	0 Å²	0	69 Å²	69	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-61.2	-48.1	175.2	-67.2	164.7	0	0	0	110.2	F273 F320 V321 L322 I326 S327 L328 Y368 L369	F273-I324 HydrophobicContact CD1-CG1 4.48Å; F273-I324 HydrophobicContact CD2-CG2 4.24Å; F273-I324 HydrophobicContact CE1-CG1 3.88Å; F273-I324 HydrophobicContact CE2-CB 4.24Å; F273-I324 HydrophobicContact CE2-CG1 4.05Å; F273-I324 HydrophobicContact CE2-CG2 4.05Å; F273-I324 HydrophobicContact CZ-CB 4.27Å; F273-I324 HydrophobicContact CZ-CG1 3.66Å; F320-I324 HydrophobicContact CD1-CD1 3.77Å; F320-I324 HydrophobicContact CD1-CG1 4.4Å; F320-I324 HydrophobicContact CE1-CD1 3.69Å; F320-I324 HydrophobicContact CE1-CG1 4.25Å; F320-I324 HydrophobicContact CZ-CD1 4.49Å; F320-I324 WeakPolarHBondContact O-CG1 3.34Å; F320-I324 PolarHBondContact O-N 2.83Å; V321-I324 PolarHBondContact O-N 3.06Å; L322-I324 PolarHBondContact O-N 3.31Å; I324-I326 PolarHBondContact O-N 3.3Å; I324-S327 WeakPolarHBondContact O-CB 3.28Å; I324-S327 PolarHBondContact O-N 3.3Å; I324-L328 HydrophobicContact CG2-CD1 3.85Å; I324-L328 HydrophobicContact CG2-CG 4.19Å; I324-L328 WeakPolarHBondContact O-CB 3.44Å; I324-L328 VanDerWaalsContact O-CG 3.29Å; I324-L328 WeakPolarHBondContact O-CG 3.47Å; I324-L328 PolarHBondContact O-N 3.2Å; I324-Y368 HydrophobicContact CG2-CD2 4.11Å; I324-L369 HydrophobicContact CD1-CB 3.95Å
325	L	97.8	Very high	95.5	Very high	58 Å²	58	64.8 Å²	64.8	30%	0.304	32%	0.322	S	S	.	.	H	α-helix	trans	-63.1	-42.6	-178.7	-69.3	172.8	0	0	0	112.5	V321 L322 L328 K329 Y362	V321-L325 HydrophobicContact CG1-CD1 3.92Å; V321-L325 HydrophobicContact CG1-CG 4.32Å; V321-L325 VanDerWaalsContact O-CG 3.31Å; V321-L325 WeakPolarHBondContact O-CG 3.39Å; V321-L325 PolarHBondContact O-N 3.48Å; L322-L325 PolarHBondContact O-N 3Å; L325-L328 PolarHBondContact O-N 3.38Å; L325-K329 WeakPolarHBondContact O-CB 3.45Å; L325-K329 PolarHBondContact O-N 3.39Å; L325-Y362 HydrophobicContact CD2-CD1 3.89Å
326	I	97.4	Very high	95.5	Very high	79 Å²	79	63.3 Å²	63.3	41%	0.405	32%	0.319	S	S	.	.	H	α-helix	trans	-61.1	-46.7	174.2	-70.7	171.1	0	0	0	109.8	L322 I324 L328 K329 Y330	L322-I326 HydrophobicContact CD1-CD1 4.07Å; L322-I326 HydrophobicContact CD1-CG1 4.21Å; L322-I326 HydrophobicContact CD2-CD1 4.45Å; L322-I326 HydrophobicContact CG-CD1 3.82Å; L322-I326 HydrophobicContact CG-CG1 4.37Å; L322-I326 WeakPolarHBondContact O-CB 3.37Å; L322-I326 VanDerWaalsContact O-CG1 3.27Å; L322-I326 WeakPolarHBondContact O-CG1 3.44Å; L322-I326 PolarHBondContact O-N 2.81Å; I324-I326 PolarHBondContact O-N 3.3Å; I326-L328 PolarHBondContact O-N 3.18Å; I326-K329 PolarHBondContact O-N 3.03Å; I326-Y330 HydrophobicContact CG2-CD2 4Å; I326-Y330 WeakPolarHBondContact O-CD2 3.4Å; I326-Y330 PolarHBondContact O-N 2.97Å
327	S	97.3	Very high	95.5	Very high	2 Å²	2	63.3 Å²	63.3	1%	0.014	31%	0.313	C	S	.	.	H	α-helix	trans	-61.8	-42.5	178.9	-60.5	0	0	0	0	112.2	F323 I324 K329 C331 F332	F323-S327 VanDerWaalsContact O-CB 3.3Å; F323-S327 WeakPolarHBondContact O-CB 3.44Å; F323-S327 PolarHBondContact O-N 3.09Å; F323-S327 PolarHBondContact O-OG 3.39Å; I324-S327 WeakPolarHBondContact O-CB 3.28Å; I324-S327 PolarHBondContact O-N 3.3Å; S327-K329 VanDerWaalsContact C-N 3.28Å; S327-K329 PolarHBondContact O-N 3.39Å; S327-C331 CarbonylContact O-C 3.39Å; S327-C331 VanDerWaalsContact O-C 3.28Å; S327-C331 WeakPolarHBondContact O-CA 3.49Å; S327-C331 WeakPolarHBondContact O-CB 3.49Å; S327-C331 PolarHBondContact O-N 2.91Å; S327-F332 PolarHBondContact O-N 3.08Å
328	L	96.8	Very high	95.5	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-65.8	-29.1	176.8	-71.9	174.6	0	0	0	112.9	P270 I324 L325 I326 F332 Y361 Y362 Y368	P270-L328 HydrophobicContact CB-CD2 3.95Å; P270-L328 HydrophobicContact CG-CD2 3.92Å; I324-L328 HydrophobicContact CG2-CD1 3.85Å; I324-L328 HydrophobicContact CG2-CG 4.19Å; I324-L328 WeakPolarHBondContact O-CB 3.44Å; I324-L328 VanDerWaalsContact O-CG 3.29Å; I324-L328 WeakPolarHBondContact O-CG 3.47Å; I324-L328 PolarHBondContact O-N 3.2Å; L325-L328 PolarHBondContact O-N 3.38Å; I326-L328 PolarHBondContact O-N 3.18Å; L328-F332 WeakPolarHBondContact O-CD1 3.35Å; L328-Y361 HydrophobicContact CB-CE1 3.91Å; L328-Y361 HydrophobicContact CD2-CE1 4.36Å; L328-Y361 HydrophobicContact CD2-CE2 4.08Å; L328-Y361 WeakPolarHBondContact O-CE1 3.38Å; L328-Y361 PolarHBondContact O-OH 3.33Å; L328-Y362 HydrophobicContact CB-CD1 4.43Å; L328-Y362 HydrophobicContact CB-CE1 4.2Å; L328-Y362 HydrophobicContact CD1-CD1 4.44Å; L328-Y368 HydrophobicContact CD1-CD2 4.26Å; L328-Y368 HydrophobicContact CD1-CE2 4.19Å; L328-Y368 HydrophobicContact CD2-CD2 4.44Å; L328-Y368 HydrophobicContact CD2-CE2 3.99Å
329	K	96.3	Very high	95.5	Very high	107 Å²	107	62.9 Å²	62.9	47%	0.465	30%	0.304	S	S	.	.	H	α-helix	trans	-86.7	-41.1	-178.9	-175.4	174.7	178	-167.9	0	112.9	L325 I326 S327 Y362	L325-K329 WeakPolarHBondContact O-CB 3.45Å; L325-K329 PolarHBondContact O-N 3.39Å; I326-K329 PolarHBondContact O-N 3.03Å; S327-K329 VanDerWaalsContact C-N 3.28Å; S327-K329 PolarHBondContact O-N 3.39Å; K329-Y362 HydrophobicContact CB-CE1 4.46Å
330	Y	96.3	Very high	95.3	Very high	160 Å²	160	62.1 Å²	62.1	63%	0.627	31%	0.307	S	S	*	.	H	α-helix	trans	-114.3	-19.3	-168.1	-63.7	-72.4	0	0	0	114.5	I326	I326-Y330 HydrophobicContact CG2-CD2 4Å; I326-Y330 WeakPolarHBondContact O-CD2 3.4Å; I326-Y330 PolarHBondContact O-N 2.97Å
331	C	95.8	Very high	95.2	Very high	28 Å²	28	60.2 Å²	60.2	19%	0.189	30%	0.3	C	S	.	.	S	Bend	trans	-121.7	22.6	-175.5	-53.8	0	0	0	0	112.1	N268 I269 P270 S327	N268-C331 CarbonylContact C-O 3.14Å; N268-C331 VanDerWaalsContact CA-O 3.29Å; N268-C331 WeakPolarHBondContact CA-O 3.13Å; I269-C331 HydrophobicContact CB-CB 3.96Å; I269-C331 HydrophobicContact CD1-CB 3.82Å; I269-C331 HydrophobicContact CG1-CB 3.84Å; I269-C331 PolarHBondContact N-O 3.14Å; P270-C331 WeakPolarHBondContact CD-O 3.33Å; S327-C331 CarbonylContact O-C 3.39Å; S327-C331 VanDerWaalsContact O-C 3.28Å; S327-C331 WeakPolarHBondContact O-CA 3.49Å; S327-C331 WeakPolarHBondContact O-CB 3.49Å; S327-C331 PolarHBondContact O-N 2.91Å
332	F	93.3	Very high	95.1	Very high	89 Å²	89	60.3 Å²	60.3	39%	0.39	30%	0.299	S	S	.	.			trans	-89.3	145.2	173.5	83.5	-80.6	0	0	0	110.2	P270 S327 L328 V334 Y361	P270-F332 HydrophobicContact CG-CB 3.92Å; S327-F332 PolarHBondContact O-N 3.08Å; L328-F332 WeakPolarHBondContact O-CD1 3.35Å; F332-V334 HydrophobicContact CD2-CG2 3.8Å; F332-V334 HydrophobicContact CE2-CG2 3.84Å; F332-Y361 WeakPolarHBondContact CB-OH 3.25Å
333	F	94.1	Very high	95	Very high	74 Å²	74	57.4 Å²	57.4	33%	0.325	28%	0.281	S	S	.	.			trans	-135.3	132.3	172.4	-175	-94.7	0	0	0	109.7	V266 N268 H335	V266-F333 HydrophobicContact CB-CD1 4.44Å; V266-F333 HydrophobicContact CB-CD2 4.37Å; V266-F333 HydrophobicContact CB-CG 4.24Å; V266-F333 HydrophobicContact CG1-CD1 4.36Å; V266-F333 HydrophobicContact CG1-CD2 4.15Å; V266-F333 HydrophobicContact CG1-CE1 4.17Å; V266-F333 HydrophobicContact CG1-CE2 3.97Å; V266-F333 HydrophobicContact CG1-CG 4.33Å; V266-F333 HydrophobicContact CG1-CZ 3.98Å; V266-F333 HydrophobicContact CG2-CB 4.34Å; V266-F333 HydrophobicContact CG2-CD1 3.88Å; V266-F333 HydrophobicContact CG2-CE1 4.32Å; V266-F333 HydrophobicContact CG2-CG 4.04Å; N268-F333 HydrophobicContact CB-CB 4Å; N268-F333 PolarHBondContact ND2-O 2.97Å; N268-F333 PolarHBondContact OD1-N 3.48Å; F333-H335 HydrophobicContact CE1-CB 4.13Å
334	V	93.7	Very high	95	Very high	41 Å²	41	54.8 Å²	54.8	25%	0.248	27%	0.27	C	S	.	.			trans	-112.9	102.7	178.9	-173.2	0	0	0	0	107.8	F332 L338 I339 W350	F332-V334 HydrophobicContact CD2-CG2 3.8Å; F332-V334 HydrophobicContact CE2-CG2 3.84Å; V334-L338 HydrophobicContact CG1-CD2 4.34Å; V334-I339 HydrophobicContact CG1-CG2 3.76Å; V334-W350 HydrophobicContact CB-CZ2 4.36Å; V334-W350 HydrophobicContact CG1-CZ2 4.06Å; V334-W350 HydrophobicContact CG2-CH2 3.7Å; V334-W350 HydrophobicContact CG2-CZ2 3.35Å
335	H	93	Very high	94.9	Very high	16 Å²	16	56.7 Å²	56.7	7%	0.074	28%	0.277	C	S	.	.			trans	-65.4	137.8	178.6	-165.8	-79.5	0	0	0	111	A262 F333 Y337 L338 L410	A262-H335 PolarHBondContact O-NE2 3.15Å; F333-H335 HydrophobicContact CE1-CB 4.13Å; H335-Y337 VanDerWaalsContact C-N 3.3Å; H335-Y337 AromaticContact CE1-CD2 3.2Å; H335-Y337 WeakPolarHBondContact CE1-CD2 3.45Å; H335-Y337 AromaticContact CE1-CE2 3.69Å; H335-Y337 AromaticContact CE1-CG 3.5Å; H335-Y337 WeakPolarHBondContact ND1-CB 3.39Å; H335-Y337 AromaticContact ND1-CD2 3.65Å; H335-Y337 AromaticContact ND1-CG 3.57Å; H335-Y337 PolarHBondContact ND1-N 3.3Å; H335-Y337 PolarHBondContact O-N 3.36Å; H335-L338 VanDerWaalsContact O-CB 3.24Å; H335-L338 WeakPolarHBondContact O-CB 3.13Å; H335-L338 PolarHBondContact O-N 3.34Å; H335-L410 HydrophobicContact CB-CB 4.14Å; H335-L410 HydrophobicContact CB-CD1 3.89Å
336	P	93	Very high	94.8	Very high	79 Å²	79	54.1 Å²	54.1	51%	0.513	26%	0.264	S	S	.	.	H	α-helix	trans	-51	-44.4	177.5	-29.8	36.1	0	0	0	113.9	L338 I339 S340	P336-L338 PolarHBondContact O-N 2.76Å; P336-I339 WeakPolarHBondContact O-CG1 3.48Å; P336-I339 PolarHBondContact O-N 3.11Å; P336-S340 WeakPolarHBondContact O-CB 3.44Å; P336-S340 PolarHBondContact O-N 2.83Å; P336-S340 PolarHBondContact O-OG 3.42Å
337	Y	92	Very high	94.8	Very high	101 Å²	101	51.6 Å²	51.6	40%	0.396	25%	0.251	S	S	.	.	H	α-helix	trans	-57.3	-30	176.2	-59.3	-25.8	0	0	0	114.6	H335 I339 S340 D341	H335-Y337 VanDerWaalsContact C-N 3.3Å; H335-Y337 AromaticContact CE1-CD2 3.2Å; H335-Y337 WeakPolarHBondContact CE1-CD2 3.45Å; H335-Y337 AromaticContact CE1-CE2 3.69Å; H335-Y337 AromaticContact CE1-CG 3.5Å; H335-Y337 WeakPolarHBondContact ND1-CB 3.39Å; H335-Y337 AromaticContact ND1-CD2 3.65Å; H335-Y337 AromaticContact ND1-CG 3.57Å; H335-Y337 PolarHBondContact ND1-N 3.3Å; H335-Y337 PolarHBondContact O-N 3.36Å; Y337-I339 PolarHBondContact O-N 3.38Å; Y337-S340 WeakPolarHBondContact CA-OG 3.3Å; Y337-D341 PolarHBondContact O-N 3.26Å; Y337-D341 VanDerWaalsContact O-N 3.13Å
338	L	94.7	Very high	94.8	Very high	5 Å²	5	54.8 Å²	54.8	3%	0.026	26%	0.263	C	S	.	.	H	α-helix	trans	-64.9	-29.9	177.2	-177.5	61.1	0	0	0	112.3	V334 H335 P336 F347 W350 L410 L411	V334-L338 HydrophobicContact CG1-CD2 4.34Å; H335-L338 VanDerWaalsContact O-CB 3.24Å; H335-L338 WeakPolarHBondContact O-CB 3.13Å; H335-L338 PolarHBondContact O-N 3.34Å; P336-L338 PolarHBondContact O-N 2.76Å; L338-F347 VanDerWaalsContact O-CD2 3.24Å; L338-F347 WeakPolarHBondContact O-CD2 3.25Å; L338-W350 HydrophobicContact CD1-CB 4.23Å; L338-W350 HydrophobicContact CD2-CB 4.2Å; L338-W350 HydrophobicContact CD2-CD2 3.7Å; L338-W350 HydrophobicContact CD2-CE3 3.8Å; L338-W350 HydrophobicContact CD2-CG 3.86Å; L338-W350 HydrophobicContact CD2-CZ3 4.47Å; L338-W350 HydrophobicContact CG-CB 4.17Å; L338-W350 HydrophobicContact CG-CD2 4.49Å; L338-W350 HydrophobicContact CG-CG 4.14Å; L338-L410 HydrophobicContact CB-CD1 4.03Å; L338-L411 HydrophobicContact CD1-CB 4.13Å; L338-L411 HydrophobicContact CD2-CB 4.03Å
339	I	94.4	Very high	94.8	Very high	99 Å²	99	57.6 Å²	57.6	51%	0.508	28%	0.277	S	S	.	.	H	α-helix	trans	-107.6	-7.3	-176.5	60.8	168.4	0	0	0	113.2	V334 P336 Y337 F347	V334-I339 HydrophobicContact CG1-CG2 3.76Å; P336-I339 WeakPolarHBondContact O-CG1 3.48Å; P336-I339 PolarHBondContact O-N 3.11Å; Y337-I339 PolarHBondContact O-N 3.38Å; I339-F347 WeakPolarHBondContact O-CE2 3.33Å
340	S	92.3	Very high	94.8	Very high	79 Å²	79	53.3 Å²	53.3	55%	0.552	26%	0.258	S	S	*	.	H	α-helix	trans	-105.3	-29.5	179.2	68.3	0	0	0	0	113.6	P336 Y337	P336-S340 WeakPolarHBondContact O-CB 3.44Å; P336-S340 PolarHBondContact O-N 2.83Å; P336-S340 PolarHBondContact O-OG 3.42Å; Y337-S340 WeakPolarHBondContact CA-OG 3.3Å
341	D	92.9	Very high	94.8	Very high	26 Å²	26	52.2 Å²	52.2	14%	0.139	25%	0.253	C	S	.	.			trans	-101	98.5	-176.4	-165.4	-22.6	0	0	0	112.1	Y337 R343 H344 F347	Y337-D341 PolarHBondContact O-N 3.26Å; Y337-D341 VanDerWaalsContact O-N 3.13Å; D341-R343 PolarHBondContact O-N 2.93Å; D341-R343 WeakPolarHBondContact OD1-CB 3.21Å; D341-R343 VanDerWaalsContact OD1-CG 3.3Å; D341-R343 WeakPolarHBondContact OD1-CG 3.3Å; D341-R343 IonicContact OD1-CZ 2.74Å; D341-R343 PolarHBondContact OD1-N 3.45Å; D341-R343 IonicContact OD1-NE 3.3Å; D341-R343 PolarHBondContact OD1-NE 2.8Å; D341-R343 IonicContact OD1-NH2 3.76Å; D341-R343 IonicContact OD2-CZ 3.34Å; D341-R343 IonicContact OD2-NE 3.62Å; D341-R343 PolarHBondContact OD2-NE 3.38Å; D341-R343 IonicContact OD2-NH2 2.83Å; D341-R343 PolarHBondContact OD2-NH2 3.45Å; D341-H344 IonicContact OD1-ND1 3.35Å; D341-H344 IonicContact OD2-CE1 2.96Å; D341-H344 PolarHBondContact OD2-CE1 2.88Å; D341-H344 VanDerWaalsContact OD2-CE1 3.29Å; D341-H344 IonicContact OD2-ND1 3.98Å; D341-F347 WeakPolarHBondContact O-CB 3.47Å
342	N	94.3	Very high	94.8	Very high	41 Å²	41	56.5 Å²	56.5	22%	0.219	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	10	-178.4	75.7	-14.6	0	0	0	114.6	F347 Y348 W461 F471	N342-F347 HydrophobicContact CB-CD1 3.99Å; N342-F347 HydrophobicContact CB-CD2 4.42Å; N342-F347 HydrophobicContact CB-CE1 3.77Å; N342-F347 HydrophobicContact CB-CE2 4.22Å; N342-F347 HydrophobicContact CB-CG 4.34Å; N342-F347 HydrophobicContact CB-CZ 3.9Å; N342-Y348 WeakPolarHBondContact O-CE2 3.3Å; N342-Y348 PolarHBondContact O-OH 3.47Å; N342-W461 WeakPolarHBondContact OD1-CZ2 3.5Å; N342-W461 PolarHBondContact OD1-NE1 2.88Å; N342-F471 WeakPolarHBondContact O-CE1 3.34Å
343	R	95.4	Very high	95	Very high	39 Å²	39	56.7 Å²	56.7	15%	0.147	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-14.8	175.6	-58.1	172	-59.9	168.3	5.8	112.6	M35 D341 F459 W461 Q469 F471 M472	M35-R343 HydrophobicContact CE-CB 3.22Å; M35-R343 HydrophobicContact CE-CG 4.04Å; M35-R343 VanDerWaalsContact CE-CZ 3.48Å; M35-R343 VanDerWaalsContact CE-NE 3.29Å; D341-R343 PolarHBondContact O-N 2.93Å; D341-R343 WeakPolarHBondContact OD1-CB 3.21Å; D341-R343 VanDerWaalsContact OD1-CG 3.3Å; D341-R343 WeakPolarHBondContact OD1-CG 3.3Å; D341-R343 IonicContact OD1-CZ 2.74Å; D341-R343 PolarHBondContact OD1-N 3.45Å; D341-R343 IonicContact OD1-NE 3.3Å; D341-R343 PolarHBondContact OD1-NE 2.8Å; D341-R343 IonicContact OD1-NH2 3.76Å; D341-R343 IonicContact OD2-CZ 3.34Å; D341-R343 IonicContact OD2-NE 3.62Å; D341-R343 PolarHBondContact OD2-NE 3.38Å; D341-R343 IonicContact OD2-NH2 2.83Å; D341-R343 PolarHBondContact OD2-NH2 3.45Å; R343-F459 HydrophobicContact CB-CZ 4.36Å; R343-F459 HydrophobicContact CG-CE2 4.41Å; R343-F459 HydrophobicContact CG-CZ 3.73Å; R343-W461 HydrophobicContact CG-CH2 4.36Å; R343-W461 HydrophobicContact CG-CZ2 3.74Å; R343-Q469 HydrophobicContact CG-CB 4.14Å; R343-Q469 VanDerWaalsContact NH1-OE1 3.12Å; R343-F471 CarbonylContact O-C 3.24Å; R343-F471 VanDerWaalsContact O-CA 3.28Å; R343-F471 WeakPolarHBondContact O-CA 3.34Å; R343-M472 PolarHBondContact O-N 3.03Å
344	H	96	Very high	95.1	Very high	27 Å²	27	53.7 Å²	53.7	13%	0.125	26%	0.259	C	S	.	.	B	Isolated β-bridge	trans	-93.6	141.3	-178.4	-62.8	79.2	0	0	0	111.7	M35 D341 T346 F347 Y348 M472 W473	M35-H344 VanDerWaalsContact CE-CE1 3.49Å; M35-H344 WeakPolarHBondContact CE-CE1 3.48Å; M35-H344 VanDerWaalsContact SD-CE1 3.58Å; D341-H344 IonicContact OD1-ND1 3.35Å; D341-H344 IonicContact OD2-CE1 2.96Å; D341-H344 PolarHBondContact OD2-CE1 2.88Å; D341-H344 VanDerWaalsContact OD2-CE1 3.29Å; D341-H344 IonicContact OD2-ND1 3.98Å; H344-T346 PolarHBondContact O-N 2.68Å; H344-F347 WeakPolarHBondContact O-CB 3.29Å; H344-F347 PolarHBondContact O-N 2.88Å; H344-Y348 WeakPolarHBondContact O-CD2 3.43Å; H344-M472 CarbonylContact C-O 3.22Å; H344-M472 VanDerWaalsContact CA-O 3.3Å; H344-M472 WeakPolarHBondContact CA-O 3.39Å; H344-W473 PolarHBondContact CD2-O 3.33Å
345	Y	95.8	Very high	95.1	Very high	40 Å²	40	57.1 Å²	57.1	16%	0.157	27%	0.269	C	S	.	.	H	α-helix	trans	-61.2	-33.7	173.2	-66.1	-60.2	0	0	0	112	F347 Y348 I349 A450 L453 F471 M472 W473	Y345-F347 VanDerWaalsContact C-N 3.25Å; Y345-F347 PolarHBondContact O-N 3.17Å; Y345-Y348 PolarHBondContact O-N 2.92Å; Y345-I349 WeakPolarHBondContact O-CG1 3.22Å; Y345-I349 PolarHBondContact O-N 3.29Å; Y345-A450 HydrophobicContact CE2-CB 4.34Å; Y345-L453 HydrophobicContact CE1-CD1 3.99Å; Y345-F471 HydrophobicContact CE1-CB 3.97Å; Y345-M472 VanDerWaalsContact CD2-O 3.22Å; Y345-M472 WeakPolarHBondContact CD2-O 3.4Å; Y345-M472 PolarHBondContact N-O 3.04Å; Y345-W473 AromaticContact CD2-CD2 3.77Å; Y345-W473 HydrophobicContact CD2-CD2 3.77Å; Y345-W473 AromaticContact CD2-CE3 3.55Å; Y345-W473 HydrophobicContact CD2-CE3 3.55Å; Y345-W473 HydrophobicContact CD2-CG 4.23Å; Y345-W473 HydrophobicContact CD2-CZ3 4Å; Y345-W473 HydrophobicContact CE2-CD2 4.09Å; Y345-W473 HydrophobicContact CE2-CE3 4.26Å; Y345-W473 HydrophobicContact CE2-CG 4.44Å; Y345-W473 HydrophobicContact CG-CE3 4.38Å
346	T	96.6	Very high	95.3	Very high	5 Å²	5	65.5 Å²	65.5	3%	0.031	30%	0.3	C	S	.	.	H	α-helix	trans	-61.4	-31	178.7	55.3	0	0	0	0	113	H344 Y348 I349 W350 L411 L413	H344-T346 PolarHBondContact O-N 2.68Å; T346-Y348 VanDerWaalsContact C-N 3.34Å; T346-Y348 PolarHBondContact O-N 3.37Å; T346-I349 PolarHBondContact O-N 3.29Å; T346-W350 VanDerWaalsContact O-CB 3.23Å; T346-W350 WeakPolarHBondContact O-CB 3.49Å; T346-W350 PolarHBondContact O-N 3.21Å; T346-L411 WeakPolarHBondContact CB-O 3.2Å; T346-L411 HydrophobicContact CG2-CG 4.23Å; T346-L411 WeakPolarHBondContact CG2-O 3.36Å; T346-L411 PolarHBondContact OG1-O 2.96Å; T346-L413 HydrophobicContact CG2-CD2 4.44Å; T346-L413 HydrophobicContact CG2-CG 3.95Å
347	F	96.9	Very high	95.4	Very high	26 Å²	26	64.1 Å²	64.1	11%	0.114	29%	0.292	C	S	.	.	H	α-helix	trans	-57.4	-46	171.5	171.2	-86.5	0	0	0	111.5	L338 I339 D341 N342 H344 Y345 R351	L338-F347 VanDerWaalsContact O-CD2 3.24Å; L338-F347 WeakPolarHBondContact O-CD2 3.25Å; I339-F347 WeakPolarHBondContact O-CE2 3.33Å; D341-F347 WeakPolarHBondContact O-CB 3.47Å; N342-F347 HydrophobicContact CB-CD1 3.99Å; N342-F347 HydrophobicContact CB-CD2 4.42Å; N342-F347 HydrophobicContact CB-CE1 3.77Å; N342-F347 HydrophobicContact CB-CE2 4.22Å; N342-F347 HydrophobicContact CB-CG 4.34Å; N342-F347 HydrophobicContact CB-CZ 3.9Å; H344-F347 WeakPolarHBondContact O-CB 3.29Å; H344-F347 PolarHBondContact O-N 2.88Å; Y345-F347 VanDerWaalsContact C-N 3.25Å; Y345-F347 PolarHBondContact O-N 3.17Å; F347-R351 VanDerWaalsContact O-CB 3.27Å; F347-R351 WeakPolarHBondContact O-CB 3.44Å; F347-R351 PolarHBondContact O-N 3.38Å
348	Y	96.8	Very high	95.6	Very high	69 Å²	69	63.5 Å²	63.5	27%	0.271	30%	0.298	S	S	.	.	H	α-helix	trans	-77.1	-38.5	-179.7	-62.9	-84.5	0	0	0	112.2	N342 H344 Y345 T346 W350 R351 K352 F471	N342-Y348 WeakPolarHBondContact O-CE2 3.3Å; N342-Y348 PolarHBondContact O-OH 3.47Å; H344-Y348 WeakPolarHBondContact O-CD2 3.43Å; Y345-Y348 PolarHBondContact O-N 2.92Å; T346-Y348 VanDerWaalsContact C-N 3.34Å; T346-Y348 PolarHBondContact O-N 3.37Å; Y348-W350 VanDerWaalsContact C-N 3.26Å; Y348-W350 PolarHBondContact O-N 2.89Å; Y348-R351 PolarHBondContact O-N 3.27Å; Y348-K352 WeakPolarHBondContact O-CA 3.1Å; Y348-K352 WeakPolarHBondContact O-CB 3.33Å; Y348-K352 PolarHBondContact O-N 3.19Å; Y348-F471 HydrophobicContact CE2-CD1 4.09Å; Y348-F471 AromaticContact CE2-CE1 3.49Å; Y348-F471 HydrophobicContact CE2-CE1 3.49Å; Y348-F471 VanDerWaalsContact CE2-CE1 3.49Å; Y348-F471 HydrophobicContact CE2-CZ 4.43Å; Y348-F471 AromaticContact CZ-CE1 3.79Å
349	I	96.3	Very high	95.7	Very high	58 Å²	58	68 Å²	68	30%	0.297	33%	0.33	S	S	.	.	H	α-helix	trans	-57.9	-45.3	173.4	-66.5	167.3	0	0	0	109.3	Y345 T346 I353 I354	Y345-I349 WeakPolarHBondContact O-CG1 3.22Å; Y345-I349 PolarHBondContact O-N 3.29Å; T346-I349 PolarHBondContact O-N 3.29Å; I349-I353 WeakPolarHBondContact O-CA 2.99Å; I349-I353 VanDerWaalsContact O-CB 3.27Å; I349-I353 WeakPolarHBondContact O-CB 3.22Å; I349-I353 PolarHBondContact O-N 3.37Å; I349-I354 HydrophobicContact CG2-CD1 3.86Å; I349-I354 HydrophobicContact CG2-CG1 4.12Å; I349-I354 PolarHBondContact O-N 3.37Å
350	W	96.7	Very high	95.8	Very high	17 Å²	17	65.6 Å²	65.6	6%	0.064	32%	0.32	C	S	.	.	I	π-helix	trans	-60.4	-58	175.2	-176.6	-98.2	0	0	0	111.7	Y274 V334 L338 T346 Y348 K352 I354 Y355 Y361 L411	Y274-W350 HydrophobicContact CE2-CZ3 4.41Å; V334-W350 HydrophobicContact CB-CZ2 4.36Å; V334-W350 HydrophobicContact CG1-CZ2 4.06Å; V334-W350 HydrophobicContact CG2-CH2 3.7Å; V334-W350 HydrophobicContact CG2-CZ2 3.35Å; L338-W350 HydrophobicContact CD1-CB 4.23Å; L338-W350 HydrophobicContact CD2-CB 4.2Å; L338-W350 HydrophobicContact CD2-CD2 3.7Å; L338-W350 HydrophobicContact CD2-CE3 3.8Å; L338-W350 HydrophobicContact CD2-CG 3.86Å; L338-W350 HydrophobicContact CD2-CZ3 4.47Å; L338-W350 HydrophobicContact CG-CB 4.17Å; L338-W350 HydrophobicContact CG-CD2 4.49Å; L338-W350 HydrophobicContact CG-CG 4.14Å; T346-W350 VanDerWaalsContact O-CB 3.23Å; T346-W350 WeakPolarHBondContact O-CB 3.49Å; T346-W350 PolarHBondContact O-N 3.21Å; Y348-W350 VanDerWaalsContact C-N 3.26Å; Y348-W350 PolarHBondContact O-N 2.89Å; W350-K352 PolarHBondContact O-N 3.17Å; W350-I354 HydrophobicContact CE3-CB 4.12Å; W350-I354 HydrophobicContact CE3-CD1 4.07Å; W350-I354 HydrophobicContact CE3-CG2 3.79Å; W350-I354 HydrophobicContact CH2-CG2 4.34Å; W350-I354 HydrophobicContact CZ3-CG2 3.7Å; W350-I354 PolarHBondContact O-N 3.43Å; W350-Y355 HydrophobicContact CZ2-CD2 4.23Å; W350-Y355 HydrophobicContact CZ2-CG 4.17Å; W350-Y355 PolarHBondContact O-N 2.81Å; W350-Y361 HydrophobicContact CH2-CE2 4.29Å; W350-L411 HydrophobicContact CE3-CD2 4.4Å
351	R	96.4	Very high	96	Very high	138 Å²	138	62.2 Å²	62.2	52%	0.521	30%	0.295	S	S	.	.	I	π-helix	trans	-69.1	-35.9	-172.4	-176.8	179.8	173.8	-140	1.8	114.1	F347 Y348	F347-R351 VanDerWaalsContact O-CB 3.27Å; F347-R351 WeakPolarHBondContact O-CB 3.44Å; F347-R351 PolarHBondContact O-N 3.38Å; Y348-R351 PolarHBondContact O-N 3.27Å
352	K	96.7	Very high	96.2	Very high	118 Å²	118	64.7 Å²	64.7	51%	0.513	30%	0.303	S	S	.	.	I	π-helix	trans	-103.4	-19.2	-170.2	-60.3	-67.1	-170.4	173.8	0	113.6	Y348 W350	Y348-K352 WeakPolarHBondContact O-CA 3.1Å; Y348-K352 WeakPolarHBondContact O-CB 3.33Å; Y348-K352 PolarHBondContact O-N 3.19Å; W350-K352 PolarHBondContact O-N 3.17Å
353	I	96.3	Very high	96.3	Very high	93 Å²	93	64.8 Å²	64.8	48%	0.477	31%	0.314	S	S	.	.	I	π-helix	trans	-120.2	-66.9	-177.7	-51.8	177	0	0	0	110.1	I349 T360	I349-I353 WeakPolarHBondContact O-CA 2.99Å; I349-I353 VanDerWaalsContact O-CB 3.27Å; I349-I353 WeakPolarHBondContact O-CB 3.22Å; I349-I353 PolarHBondContact O-N 3.37Å; I353-T360 WeakPolarHBondContact O-CG2 3.17Å
354	I	96.1	Very high	96.4	Very high	10 Å²	10	64.3 Å²	64.3	5%	0.051	31%	0.314	C	S	.	.	I	π-helix	trans	-64.4	-53.5	-170.3	-62.2	172.9	0	0	0	111.3	Y274 I349 W350 Y361 L364 L411	Y274-I354 HydrophobicContact CD1-CD1 4.4Å; Y274-I354 HydrophobicContact CE1-CD1 4.22Å; Y274-I354 HydrophobicContact CE1-CG2 4.45Å; I349-I354 HydrophobicContact CG2-CD1 3.86Å; I349-I354 HydrophobicContact CG2-CG1 4.12Å; I349-I354 PolarHBondContact O-N 3.37Å; W350-I354 HydrophobicContact CE3-CB 4.12Å; W350-I354 HydrophobicContact CE3-CD1 4.07Å; W350-I354 HydrophobicContact CE3-CG2 3.79Å; W350-I354 HydrophobicContact CH2-CG2 4.34Å; W350-I354 HydrophobicContact CZ3-CG2 3.7Å; W350-I354 PolarHBondContact O-N 3.43Å; I354-Y361 HydrophobicContact CG2-CD2 3.79Å; I354-Y361 HydrophobicContact CG2-CE2 4.03Å; I354-Y361 WeakPolarHBondContact O-CA 3.49Å; I354-Y361 WeakPolarHBondContact O-CB 3.29Å; I354-Y361 PolarHBondContact O-N 3.39Å; I354-L364 HydrophobicContact CB-CD1 4.43Å; I354-L364 HydrophobicContact CG1-CD1 4.39Å; I354-L411 HydrophobicContact CD1-CD2 3.93Å
355	Y	95.3	Very high	96.4	Very high	114 Å²	114	63.5 Å²	63.5	45%	0.447	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.8	33.5	-174.9	-154.5	-100.9	0	0	0	112.1	W350 S357 Y361	W350-Y355 HydrophobicContact CZ2-CD2 4.23Å; W350-Y355 HydrophobicContact CZ2-CG 4.17Å; W350-Y355 PolarHBondContact O-N 2.81Å; Y355-S357 VanDerWaalsContact C-N 3.28Å; Y355-S357 PolarHBondContact O-N 3.41Å; Y355-Y361 AromaticContact CD2-CD2 3.85Å; Y355-Y361 HydrophobicContact CD2-CD2 3.85Å; Y355-Y361 HydrophobicContact CD2-CE2 4.39Å; Y355-Y361 AromaticContact CD2-CG 3.93Å; Y355-Y361 HydrophobicContact CD2-CG 3.93Å; Y355-Y361 HydrophobicContact CE2-CD1 4.47Å; Y355-Y361 HydrophobicContact CE2-CG 4.28Å
356	R	96	Very high	96.5	Very high	192 Å²	192	65.9 Å²	65.9	73%	0.725	33%	0.33	S	S	*	.	S	Bend	trans	-60.4	-40.9	174.6	179.8	-179.6	172.3	179.1	-1.9	111.9
357	S	96.5	Very high	96.5	Very high	50 Å²	50	68.7 Å²	68.7	35%	0.35	35%	0.347	S	S	.	.	S	Bend	trans	-153.1	160.3	175.4	73.8	0	0	0	0	109.1	Y355 S359 T360 Y361	Y355-S357 VanDerWaalsContact C-N 3.28Å; Y355-S357 PolarHBondContact O-N 3.41Å; S357-S359 PolarHBondContact O-N 3.17Å; S357-T360 PolarHBondContact O-N 2.99Å; S357-T360 VanDerWaalsContact O-N 3.12Å; S357-T360 PolarHBondContact OG-N 2.65Å; S357-T360 VanDerWaalsContact OG-N 3.07Å; S357-T360 PolarHBondContact OG-OG1 3.01Å; S357-Y361 PolarHBondContact O-N 2.85Å
358	V	95.3	Very high	96.6	Very high	88 Å²	88	67.8 Å²	67.8	53%	0.533	34%	0.343	S	S	.	.	H	α-helix	trans	-57.1	-40.7	176.2	179.6	0	0	0	0	111.1	Y361 Y362	V358-Y361 PolarHBondContact O-N 2.81Å; V358-Y362 HydrophobicContact CG1-CD2 3.77Å; V358-Y362 HydrophobicContact CG1-CE2 3.65Å; V358-Y362 VanDerWaalsContact O-CD2 3.27Å; V358-Y362 WeakPolarHBondContact O-CD2 3.37Å; V358-Y362 PolarHBondContact O-N 3.41Å; V358-Y362 VanDerWaalsContact O-N 3.16Å
359	S	96.5	Very high	96.6	Very high	99 Å²	99	66.1 Å²	66.1	69%	0.692	34%	0.339	S	S	*	.	H	α-helix	trans	-64.8	-39.9	177.1	-54.2	0	0	0	0	112.4	S357 G363	S357-S359 PolarHBondContact O-N 3.17Å; S359-G363 WeakPolarHBondContact O-CA 3.39Å; S359-G363 PolarHBondContact O-N 3.31Å
360	T	96.2	Very high	96.7	Very high	49 Å²	49	65.6 Å²	65.6	30%	0.301	34%	0.338	S	S	.	.	H	α-helix	trans	-65.5	-44	175.9	-50.5	0	0	0	0	110.9	I353 S357 Y362 G363 L364	I353-T360 WeakPolarHBondContact O-CG2 3.17Å; S357-T360 PolarHBondContact O-N 2.99Å; S357-T360 VanDerWaalsContact O-N 3.12Å; S357-T360 PolarHBondContact OG-N 2.65Å; S357-T360 VanDerWaalsContact OG-N 3.07Å; S357-T360 PolarHBondContact OG-OG1 3.01Å; T360-Y362 PolarHBondContact O-N 3.29Å; T360-G363 PolarHBondContact O-N 3.47Å; T360-L364 WeakPolarHBondContact O-CG 3.45Å; T360-L364 PolarHBondContact O-N 3.5Å
361	Y	97	Very high	96.7	Very high	7 Å²	7	64.9 Å²	64.9	3%	0.027	34%	0.336	C	S	.	.	H	α-helix	trans	-57.6	-49.4	-179.4	-179.3	-111.6	0	0	0	112.3	L328 F332 W350 I354 Y355 S357 V358	L328-Y361 HydrophobicContact CB-CE1 3.91Å; L328-Y361 HydrophobicContact CD2-CE1 4.36Å; L328-Y361 HydrophobicContact CD2-CE2 4.08Å; L328-Y361 WeakPolarHBondContact O-CE1 3.38Å; L328-Y361 PolarHBondContact O-OH 3.33Å; F332-Y361 WeakPolarHBondContact CB-OH 3.25Å; W350-Y361 HydrophobicContact CH2-CE2 4.29Å; I354-Y361 HydrophobicContact CG2-CD2 3.79Å; I354-Y361 HydrophobicContact CG2-CE2 4.03Å; I354-Y361 WeakPolarHBondContact O-CA 3.49Å; I354-Y361 WeakPolarHBondContact O-CB 3.29Å; I354-Y361 PolarHBondContact O-N 3.39Å; Y355-Y361 AromaticContact CD2-CD2 3.85Å; Y355-Y361 HydrophobicContact CD2-CD2 3.85Å; Y355-Y361 HydrophobicContact CD2-CE2 4.39Å; Y355-Y361 AromaticContact CD2-CG 3.93Å; Y355-Y361 HydrophobicContact CD2-CG 3.93Å; Y355-Y361 HydrophobicContact CE2-CD1 4.47Å; Y355-Y361 HydrophobicContact CE2-CG 4.28Å; S357-Y361 PolarHBondContact O-N 2.85Å; V358-Y361 PolarHBondContact O-N 2.81Å
362	Y	97.4	Very high	96.8	Very high	79 Å²	79	58.6 Å²	58.6	31%	0.31	31%	0.313	S	S	.	.	H	α-helix	trans	-77.2	-30.1	176.7	-67.5	-65.2	0	0	0	113.2	L325 L328 K329 V358 T360 L364 S365	L325-Y362 HydrophobicContact CD2-CD1 3.89Å; L328-Y362 HydrophobicContact CB-CD1 4.43Å; L328-Y362 HydrophobicContact CB-CE1 4.2Å; L328-Y362 HydrophobicContact CD1-CD1 4.44Å; K329-Y362 HydrophobicContact CB-CE1 4.46Å; V358-Y362 HydrophobicContact CG1-CD2 3.77Å; V358-Y362 HydrophobicContact CG1-CE2 3.65Å; V358-Y362 VanDerWaalsContact O-CD2 3.27Å; V358-Y362 WeakPolarHBondContact O-CD2 3.37Å; V358-Y362 PolarHBondContact O-N 3.41Å; V358-Y362 VanDerWaalsContact O-N 3.16Å; T360-Y362 PolarHBondContact O-N 3.29Å; Y362-L364 VanDerWaalsContact C-N 3.27Å; Y362-L364 PolarHBondContact O-N 3.4Å; Y362-S365 WeakPolarHBondContact O-CB 3.2Å; Y362-S365 PolarHBondContact O-N 3.08Å; Y362-S365 VanDerWaalsContact O-N 3.07Å; Y362-S365 PolarHBondContact O-OG 3.17Å
363	G	96.3	Very high	96.8	Very high	43 Å²	43	55 Å²	55	44%	0.443	31%	0.305	S	S	.	.	H	α-helix	trans	-64	-30	176.6	0	0	0	0	0	113.4	S359 T360 S365 V366	S359-G363 WeakPolarHBondContact O-CA 3.39Å; S359-G363 PolarHBondContact O-N 3.31Å; T360-G363 PolarHBondContact O-N 3.47Å; G363-S365 PolarHBondContact O-N 3.12Å; G363-S365 VanDerWaalsContact O-N 3.12Å; G363-V366 PolarHBondContact O-N 3.4Å
364	L	97.2	Very high	96.8	Very high	29 Å²	29	50.8 Å²	50.8	15%	0.152	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-10.6	172.9	-73.1	171.1	0	0	0	113.7	I354 T360 Y362 V366 V367 Y368	I354-L364 HydrophobicContact CB-CD1 4.43Å; I354-L364 HydrophobicContact CG1-CD1 4.39Å; T360-L364 WeakPolarHBondContact O-CG 3.45Å; T360-L364 PolarHBondContact O-N 3.5Å; Y362-L364 VanDerWaalsContact C-N 3.27Å; Y362-L364 PolarHBondContact O-N 3.4Å; L364-V366 PolarHBondContact O-N 3.03Å; L364-V367 HydrophobicContact CD2-CB 4.28Å; L364-V367 HydrophobicContact CD2-CG2 3.94Å; L364-V367 WeakPolarHBondContact O-CA 3.41Å; L364-V367 WeakPolarHBondContact O-CB 3.22Å; L364-V367 PolarHBondContact O-N 3.25Å; L364-Y368 HydrophobicContact CB-CD2 4.39Å; L364-Y368 HydrophobicContact CB-CE1 4.3Å; L364-Y368 HydrophobicContact CB-CE2 3.73Å; L364-Y368 WeakPolarHBondContact CD1-OH 3.49Å; L364-Y368 VanDerWaalsContact O-CD2 3.31Å; L364-Y368 WeakPolarHBondContact O-CD2 3.48Å; L364-Y368 VanDerWaalsContact O-CG 3.27Å; L364-Y368 PolarHBondContact O-N 3.46Å
365	S	97.1	Very high	96.8	Very high	10 Å²	10	50.3 Å²	50.3	7%	0.07	28%	0.28	C	S	.	.	H	α-helix	trans	-54	-33.1	171.6	60	0	0	0	0	113.2	Y362 G363 Y368 L369	Y362-S365 WeakPolarHBondContact O-CB 3.2Å; Y362-S365 PolarHBondContact O-N 3.08Å; Y362-S365 VanDerWaalsContact O-N 3.07Å; Y362-S365 PolarHBondContact O-OG 3.17Å; G363-S365 PolarHBondContact O-N 3.12Å; G363-S365 VanDerWaalsContact O-N 3.12Å; S365-Y368 PolarHBondContact O-N 3.29Å; S365-L369 WeakPolarHBondContact O-CB 3.43Å; S365-L369 PolarHBondContact O-N 2.95Å
366	V	96	Very high	96.8	Very high	90 Å²	90	47 Å²	47	55%	0.545	27%	0.272	S	S	.	.	H	α-helix	trans	-67	-42.5	174.9	-179.2	0	0	0	0	111	G363 L364 L369 V370	G363-V366 PolarHBondContact O-N 3.4Å; L364-V366 PolarHBondContact O-N 3.03Å; V366-L369 PolarHBondContact O-N 3.45Å; V366-V370 WeakPolarHBondContact O-CG2 3.41Å; V366-V370 PolarHBondContact O-N 3.26Å; V366-V370 VanDerWaalsContact O-N 3.11Å
367	V	97.2	Very high	96.6	Very high	64 Å²	64	40.6 Å²	40.6	39%	0.388	25%	0.252	S	S	.	.	H	α-helix	trans	-64	-45.5	176.4	179.5	0	0	0	0	109.9	T277 L364 L369 V370 A371	T277-V367 HydrophobicContact CG2-CG1 4.23Å; L364-V367 HydrophobicContact CD2-CB 4.28Å; L364-V367 HydrophobicContact CD2-CG2 3.94Å; L364-V367 WeakPolarHBondContact O-CA 3.41Å; L364-V367 WeakPolarHBondContact O-CB 3.22Å; L364-V367 PolarHBondContact O-N 3.25Å; V367-L369 PolarHBondContact O-N 2.95Å; V367-V370 PolarHBondContact O-N 3.32Å; V367-A371 VanDerWaalsContact O-CB 3.26Å; V367-A371 WeakPolarHBondContact O-CB 3.49Å; V367-A371 PolarHBondContact O-N 2.92Å
368	Y	98.3	Very high	96.5	Very high	6 Å²	6	38.4 Å²	38.4	2%	0.024	24%	0.237	C	C	.	.	H	α-helix	trans	-62.4	-40	177.8	-60	-28.2	0	0	0	112.7	F273 Y274 T277 I324 L328 L364 S365 T372	F273-Y368 HydrophobicContact CB-CD1 3.85Å; F273-Y368 HydrophobicContact CB-CD2 4.13Å; F273-Y368 HydrophobicContact CB-CE1 4.49Å; F273-Y368 HydrophobicContact CB-CG 3.67Å; F273-Y368 HydrophobicContact CD2-CD2 4.46Å; F273-Y368 HydrophobicContact CG-CG 4.3Å; Y274-Y368 AromaticContact CD1-CE1 3.97Å; Y274-Y368 HydrophobicContact CD1-CE1 3.97Å; Y274-Y368 AromaticContact CD1-CZ 3.94Å; Y274-Y368 HydrophobicContact CE1-CE1 4.2Å; Y274-Y368 HydrophobicContact CE1-CE2 4.29Å; Y274-Y368 AromaticContact CE1-CZ 3.68Å; Y274-Y368 VanDerWaalsContact CE1-OH 3.3Å; Y274-Y368 WeakPolarHBondContact CE1-OH 3.18Å; T277-Y368 WeakPolarHBondContact OG1-CD1 3.28Å; I324-Y368 HydrophobicContact CG2-CD2 4.11Å; L328-Y368 HydrophobicContact CD1-CD2 4.26Å; L328-Y368 HydrophobicContact CD1-CE2 4.19Å; L328-Y368 HydrophobicContact CD2-CD2 4.44Å; L328-Y368 HydrophobicContact CD2-CE2 3.99Å; L364-Y368 HydrophobicContact CB-CD2 4.39Å; L364-Y368 HydrophobicContact CB-CE1 4.3Å; L364-Y368 HydrophobicContact CB-CE2 3.73Å; L364-Y368 WeakPolarHBondContact CD1-OH 3.49Å; L364-Y368 VanDerWaalsContact O-CD2 3.31Å; L364-Y368 WeakPolarHBondContact O-CD2 3.48Å; L364-Y368 VanDerWaalsContact O-CG 3.27Å; L364-Y368 PolarHBondContact O-N 3.46Å; S365-Y368 PolarHBondContact O-N 3.29Å; Y368-T372 VanDerWaalsContact O-CB 3.23Å; Y368-T372 WeakPolarHBondContact O-CB 3.47Å; Y368-T372 PolarHBondContact O-N 2.88Å; Y368-T372 PolarHBondContact O-OG1 3.32Å
369	L	97.8	Very high	96.3	Very high	34 Å²	34	34.2 Å²	34.2	18%	0.178	21%	0.211	C	C	.	.	H	α-helix	trans	-57.5	-54.6	173.2	164.7	69.3	0	0	0	110.7	T317 F320 V321 I324 S365 V366 V367 T372 A373	T317-L369 HydrophobicContact CG2-CD2 3.91Å; F320-L369 HydrophobicContact CB-CD1 4.49Å; F320-L369 HydrophobicContact CD1-CD1 3.44Å; F320-L369 VanDerWaalsContact CD1-CD1 3.44Å; F320-L369 HydrophobicContact CE1-CD1 4.13Å; F320-L369 HydrophobicContact CG-CD1 4.41Å; V321-L369 HydrophobicContact CG2-CD2 3.8Å; I324-L369 HydrophobicContact CD1-CB 3.95Å; S365-L369 WeakPolarHBondContact O-CB 3.43Å; S365-L369 PolarHBondContact O-N 2.95Å; V366-L369 PolarHBondContact O-N 3.45Å; V367-L369 PolarHBondContact O-N 2.95Å; L369-T372 PolarHBondContact O-N 3.42Å; L369-A373 VanDerWaalsContact O-CB 3.31Å; L369-A373 WeakPolarHBondContact O-CB 3.34Å; L369-A373 PolarHBondContact O-N 2.96Å
370	V	97.6	Very high	96.1	Very high	48 Å²	48	30.4 Å²	30.4	29%	0.291	18%	0.182	S	C	.	.	H	α-helix	trans	-67.5	-41.4	-175.3	179.1	0	0	0	0	111.2	F287 F290 I291 V366 V367 A373 Y374	F287-V370 HydrophobicContact CE2-CG1 3.89Å; F287-V370 HydrophobicContact CZ-CG1 3.87Å; F290-V370 HydrophobicContact CE1-CG1 4.37Å; I291-V370 HydrophobicContact CD1-CG1 4.48Å; I291-V370 HydrophobicContact CG1-CG1 4.17Å; V366-V370 WeakPolarHBondContact O-CG2 3.41Å; V366-V370 PolarHBondContact O-N 3.26Å; V366-V370 VanDerWaalsContact O-N 3.11Å; V367-V370 PolarHBondContact O-N 3.32Å; V370-A373 PolarHBondContact O-N 3.5Å; V370-Y374 WeakPolarHBondContact O-CB 3.46Å; V370-Y374 PolarHBondContact O-N 3.34Å
371	A	98.2	Very high	95.4	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.008	20%	0.198	C	C	.	.	H	α-helix	trans	-65.6	-41	177.4	0	0	0	0	0	112.2	A276 A280 V367 Y374 F375	A276-A371 HydrophobicContact CB-CB 4.46Å; A280-A371 HydrophobicContact CB-CB 4.19Å; V367-A371 VanDerWaalsContact O-CB 3.26Å; V367-A371 WeakPolarHBondContact O-CB 3.49Å; V367-A371 PolarHBondContact O-N 2.92Å; A371-Y374 WeakPolarHBondContact O-CB 3.18Å; A371-Y374 PolarHBondContact O-N 3.06Å; A371-F375 WeakPolarHBondContact O-CB 3.24Å; A371-F375 PolarHBondContact O-N 3.15Å
372	T	98	Very high	94.1	Very high	7 Å²	7	37 Å²	37	4%	0.043	21%	0.214	C	C	.	.	H	α-helix	trans	-70.1	-39.1	177.2	-51.3	0	0	0	0	111.4	F272 F320 Y368 L369 Y374 F375 V376	F272-T372 HydrophobicContact CE1-CG2 4.12Å; F320-T372 HydrophobicContact CE1-CG2 4.19Å; F320-T372 HydrophobicContact CZ-CG2 3.71Å; Y368-T372 VanDerWaalsContact O-CB 3.23Å; Y368-T372 WeakPolarHBondContact O-CB 3.47Å; Y368-T372 PolarHBondContact O-N 2.88Å; Y368-T372 PolarHBondContact O-OG1 3.32Å; L369-T372 PolarHBondContact O-N 3.42Å; T372-Y374 VanDerWaalsContact C-N 3.32Å; T372-Y374 PolarHBondContact O-N 3.27Å; T372-F375 PolarHBondContact O-N 2.95Å; T372-V376 HydrophobicContact CG2-CG2 4.45Å; T372-V376 WeakPolarHBondContact O-CG2 3.37Å; T372-V376 PolarHBondContact O-N 3.22Å
373	A	95.8	Very high	92.8	Very high	42 Å²	42	35.8 Å²	35.8	35%	0.347	21%	0.209	S	C	.	.	H	α-helix	trans	-60.1	-43	172.1	0	0	0	0	0	111.3	F290 L369 V370 N377	F290-A373 HydrophobicContact CZ-CB 4.11Å; L369-A373 VanDerWaalsContact O-CB 3.31Å; L369-A373 WeakPolarHBondContact O-CB 3.34Å; L369-A373 PolarHBondContact O-N 2.96Å; V370-A373 PolarHBondContact O-N 3.5Å; A373-N377 WeakPolarHBondContact O-CB 3.32Å; A373-N377 PolarHBondContact O-N 3.1Å
374	Y	96.2	Very high	91.7	Very high	4 Å²	4	45.6 Å²	45.6	2%	0.016	23%	0.233	C	C	.	.	H	α-helix	trans	-60.5	-48.5	173.5	170.1	-112.7	0	0	0	112	A280 T283 Q286 F287 F290 V370 A371 T372 V376 N377 T378 W423	A280-Y374 HydrophobicContact CB-CD1 3.94Å; A280-Y374 HydrophobicContact CB-CE1 4.38Å; T283-Y374 VanDerWaalsContact OG1-CE1 3.31Å; T283-Y374 WeakPolarHBondContact OG1-CE1 3.48Å; T283-Y374 PolarHBondContact OG1-OH 3.43Å; Q286-Y374 HydrophobicContact CB-CE2 4.47Å; Q286-Y374 WeakPolarHBondContact CB-OH 3.43Å; F287-Y374 HydrophobicContact CB-CE1 4.41Å; F287-Y374 AromaticContact CD2-CD1 3.77Å; F287-Y374 HydrophobicContact CD2-CD1 3.77Å; F287-Y374 HydrophobicContact CD2-CD2 4.08Å; F287-Y374 HydrophobicContact CD2-CE1 4.4Å; F287-Y374 AromaticContact CD2-CG 3.59Å; F287-Y374 HydrophobicContact CD2-CG 3.59Å; F287-Y374 HydrophobicContact CE2-CD1 4.48Å; F287-Y374 HydrophobicContact CE2-CG 4.21Å; F290-Y374 HydrophobicContact CB-CD2 3.62Å; F290-Y374 HydrophobicContact CB-CE2 4.08Å; F290-Y374 AromaticContact CD1-CD2 3.86Å; F290-Y374 HydrophobicContact CD1-CD2 3.86Å; F290-Y374 HydrophobicContact CD1-CG 4.2Å; F290-Y374 HydrophobicContact CD2-CD2 4.21Å; F290-Y374 AromaticContact CG-CD2 3.62Å; F290-Y374 HydrophobicContact CG-CD2 3.62Å; F290-Y374 HydrophobicContact CG-CG 4.4Å; V370-Y374 WeakPolarHBondContact O-CB 3.46Å; V370-Y374 PolarHBondContact O-N 3.34Å; A371-Y374 WeakPolarHBondContact O-CB 3.18Å; A371-Y374 PolarHBondContact O-N 3.06Å; T372-Y374 VanDerWaalsContact C-N 3.32Å; T372-Y374 PolarHBondContact O-N 3.27Å; Y374-V376 PolarHBondContact O-N 3.45Å; Y374-N377 PolarHBondContact O-N 2.89Å; Y374-T378 WeakPolarHBondContact CD2-OG1 3.4Å; Y374-T378 WeakPolarHBondContact CE2-OG1 3.26Å; Y374-T378 WeakPolarHBondContact O-CB 3.42Å; Y374-T378 PolarHBondContact O-N 3.49Å; Y374-T378 PolarHBondContact O-OG1 3.21Å; Y374-W423 AromaticContact CE1-CH2 3.68Å; Y374-W423 HydrophobicContact CE1-CH2 3.68Å; Y374-W423 AromaticContact CE1-CZ2 3.84Å; Y374-W423 HydrophobicContact CE1-CZ2 3.84Å
375	F	96.6	Very high	91	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-55.7	-50.2	179.5	179.5	-88.9	0	0	0	111.8	F272 F275 A276 C279 A371 T372 T378 L379 F397 L398 W423	F272-F375 HydrophobicContact CE2-CE1 4.43Å; F272-F375 HydrophobicContact CZ-CD1 4.2Å; F272-F375 AromaticContact CZ-CE1 3.91Å; F272-F375 HydrophobicContact CZ-CE1 3.91Å; F275-F375 HydrophobicContact CD1-CE2 4.26Å; F275-F375 HydrophobicContact CE1-CD2 4.43Å; F275-F375 AromaticContact CE1-CE2 3.45Å; F275-F375 HydrophobicContact CE1-CE2 3.45Å; F275-F375 VanDerWaalsContact CE1-CE2 3.45Å; F275-F375 AromaticContact CE1-CZ 3.7Å; F275-F375 HydrophobicContact CE1-CZ 3.7Å; F275-F375 AromaticContact CZ-CE2 3.87Å; F275-F375 HydrophobicContact CZ-CE2 3.87Å; F275-F375 HydrophobicContact CZ-CZ 4.4Å; A276-F375 HydrophobicContact CB-CB 4.17Å; C279-F375 HydrophobicContact CB-CD2 4.01Å; A371-F375 WeakPolarHBondContact O-CB 3.24Å; A371-F375 PolarHBondContact O-N 3.15Å; T372-F375 PolarHBondContact O-N 2.95Å; F375-T378 PolarHBondContact O-N 3.14Å; F375-L379 HydrophobicContact CD1-CD1 4.03Å; F375-L379 HydrophobicContact CE1-CD1 3.5Å; F375-L379 HydrophobicContact CZ-CD1 3.99Å; F375-L379 PolarHBondContact O-N 2.8Å; F375-F397 HydrophobicContact CZ-CE1 4.02Å; F375-F397 HydrophobicContact CZ-CZ 4.37Å; F375-L398 HydrophobicContact CD1-CD1 4.33Å; F375-L398 HydrophobicContact CE1-CD1 3.69Å; F375-W423 AromaticContact CD2-CD1 3.61Å; F375-W423 HydrophobicContact CD2-CD2 4.17Å; F375-W423 AromaticContact CD2-CE2 3.83Å; F375-W423 HydrophobicContact CD2-CG 4.07Å; F375-W423 HydrophobicContact CD2-CZ2 4.48Å; F375-W423 AromaticContact CD2-NE1 3.44Å; F375-W423 HydrophobicContact CE2-CB 4.06Å; F375-W423 AromaticContact CE2-CD1 3.21Å; F375-W423 HydrophobicContact CE2-CD2 4.04Å; F375-W423 AromaticContact CE2-CG 3.52Å; F375-W423 HydrophobicContact CE2-CG 3.52Å; F375-W423 AromaticContact CE2-NE1 3.59Å; F375-W423 AromaticContact CG-NE1 3.92Å; F375-W423 HydrophobicContact CZ-CB 4.47Å; F375-W423 AromaticContact CZ-CD1 3.57Å; F375-W423 HydrophobicContact CZ-CG 4.14Å; F375-W423 PolarHBondContact O-NE1 3.34Å
376	V	95.2	Very high	90.5	Very high	44 Å²	44	48.9 Å²	48.9	27%	0.267	25%	0.249	S	C	.	.	H	α-helix	trans	-69	-42.2	179.1	175.6	0	0	0	0	111.4	T372 Y374 T378 L379 F380 F381	T372-V376 HydrophobicContact CG2-CG2 4.45Å; T372-V376 WeakPolarHBondContact O-CG2 3.37Å; T372-V376 PolarHBondContact O-N 3.22Å; Y374-V376 PolarHBondContact O-N 3.45Å; V376-T378 VanDerWaalsContact C-N 3.28Å; V376-T378 PolarHBondContact O-N 3.45Å; V376-L379 PolarHBondContact O-N 2.86Å; V376-F380 HydrophobicContact CG1-CD2 3.93Å; V376-F380 HydrophobicContact CG1-CE2 4.41Å; V376-F380 WeakPolarHBondContact O-CD2 3.36Å; V376-F380 PolarHBondContact O-N 2.98Å; V376-F381 HydrophobicContact CG1-CE2 4.45Å
377	N	92.9	Very high	90.2	Very high	58 Å²	58	48 Å²	48	31%	0.31	25%	0.245	S	C	.	.	H	α-helix	trans	-56.5	-45.9	176.7	-177.8	80.6	0	0	0	111.5	F290 A373 Y374 L379 F381 S382	F290-N377 HydrophobicContact CD2-CB 4.19Å; F290-N377 HydrophobicContact CE2-CB 3.62Å; F290-N377 HydrophobicContact CZ-CB 4.38Å; A373-N377 WeakPolarHBondContact O-CB 3.32Å; A373-N377 PolarHBondContact O-N 3.1Å; Y374-N377 PolarHBondContact O-N 2.89Å; N377-L379 VanDerWaalsContact C-N 3.31Å; N377-L379 PolarHBondContact O-N 3.37Å; N377-F381 CarbonylContact O-C 3.58Å; N377-F381 WeakPolarHBondContact O-CA 3.17Å; N377-F381 PolarHBondContact O-N 3.26Å; N377-F381 WeakPolarHBondContact OD1-CB 3.37Å; N377-S382 PolarHBondContact O-N 2.92Å
378	T	92.7	Very high	89.9	Confident	4 Å²	4	45.4 Å²	45.4	3%	0.025	23%	0.229	C	C	.	.	H	α-helix	trans	-65.4	-35.7	-177.8	-51.8	0	0	0	0	111.4	Y374 F375 V376 S382 W423 S427 L428	Y374-T378 WeakPolarHBondContact CD2-OG1 3.4Å; Y374-T378 WeakPolarHBondContact CE2-OG1 3.26Å; Y374-T378 WeakPolarHBondContact O-CB 3.42Å; Y374-T378 PolarHBondContact O-N 3.49Å; Y374-T378 PolarHBondContact O-OG1 3.21Å; F375-T378 PolarHBondContact O-N 3.14Å; V376-T378 VanDerWaalsContact C-N 3.28Å; V376-T378 PolarHBondContact O-N 3.45Å; T378-S382 WeakPolarHBondContact CA-OG 3.4Å; T378-S382 PolarHBondContact O-OG 3.07Å; T378-W423 HydrophobicContact CG2-CH2 4.49Å; T378-W423 HydrophobicContact CG2-CZ2 3.75Å; T378-S427 VanDerWaalsContact CG2-CB 3.49Å; T378-S427 WeakPolarHBondContact O-CB 3.07Å; T378-S427 VanDerWaalsContact O-O 3.12Å; T378-L428 HydrophobicContact CG2-CD2 3.37Å; T378-L428 HydrophobicContact CG2-CG 4.08Å
379	L	92.7	Very high	89.6	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-69.6	-54.1	174.9	-76.4	168.9	0	0	0	112.8	F375 V376 N377 R394 F397 F426	F375-L379 HydrophobicContact CD1-CD1 4.03Å; F375-L379 HydrophobicContact CE1-CD1 3.5Å; F375-L379 HydrophobicContact CZ-CD1 3.99Å; F375-L379 PolarHBondContact O-N 2.8Å; V376-L379 PolarHBondContact O-N 2.86Å; N377-L379 VanDerWaalsContact C-N 3.31Å; N377-L379 PolarHBondContact O-N 3.37Å; L379-R394 WeakPolarHBondContact O-CD 3.4Å; L379-R394 PolarHBondContact O-NH1 3.14Å; L379-F397 HydrophobicContact CD1-CD1 4.04Å; L379-F397 HydrophobicContact CD1-CE1 3.89Å; L379-F397 HydrophobicContact CD2-CD1 3.83Å; L379-F397 HydrophobicContact CD2-CE1 3.84Å; L379-F397 HydrophobicContact CG-CE1 4.47Å; L379-F426 HydrophobicContact CD2-CB 4.06Å
380	F	91	Very high	89.3	Confident	19 Å²	19	45.6 Å²	45.6	8%	0.083	23%	0.233	C	C	.	.	H	α-helix	trans	-99.5	-32.7	-165.5	-65.1	-81.6	0	0	0	114.1	V376 F391 R394 L395 L398	V376-F380 HydrophobicContact CG1-CD2 3.93Å; V376-F380 HydrophobicContact CG1-CE2 4.41Å; V376-F380 WeakPolarHBondContact O-CD2 3.36Å; V376-F380 PolarHBondContact O-N 2.98Å; F380-F391 AromaticContact CD1-CD2 3.86Å; F380-F391 HydrophobicContact CD1-CD2 3.86Å; F380-F391 AromaticContact CD1-CE2 3.84Å; F380-F391 HydrophobicContact CD1-CE2 3.84Å; F380-F391 HydrophobicContact CE1-CD2 4.16Å; F380-F391 HydrophobicContact CE1-CE2 4.09Å; F380-R394 HydrophobicContact CD1-CB 4.26Å; F380-R394 HydrophobicContact CE1-CB 3.63Å; F380-R394 HydrophobicContact CZ-CB 3.9Å; F380-L395 HydrophobicContact CE1-CB 4.44Å; F380-L395 HydrophobicContact CZ-CB 4.45Å; F380-L398 HydrophobicContact CE2-CD2 4.18Å; F380-L398 HydrophobicContact CZ-CD2 4.47Å
381	F	81.5	Confident	89	Confident	143 Å²	143	45.9 Å²	45.9	63%	0.627	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-111.5	-0.1	-163.7	-59.3	-79.4	0	0	0	113.8	V376 N377 Y383	V376-F381 HydrophobicContact CG1-CE2 4.45Å; N377-F381 CarbonylContact O-C 3.58Å; N377-F381 WeakPolarHBondContact O-CA 3.17Å; N377-F381 PolarHBondContact O-N 3.26Å; N377-F381 WeakPolarHBondContact OD1-CB 3.37Å; F381-Y383 PolarHBondContact O-N 3.17Å; F381-Y383 VanDerWaalsContact O-N 3.14Å
382	S	70.5	Confident	88.8	Confident	52 Å²	52	48 Å²	48	36%	0.364	24%	0.241	S	C	.	.	S	Bend	trans	-58.4	-19.3	165.8	-62.7	0	0	0	0	112.8	N377 T378	N377-S382 PolarHBondContact O-N 2.92Å; T378-S382 WeakPolarHBondContact CA-OG 3.4Å; T378-S382 PolarHBondContact O-OG 3.07Å
383	Y	69.1	Low	88.7	Confident	53 Å²	53	48.6 Å²	48.6	21%	0.208	24%	0.244	C	C	.	.	S	Bend	trans	-112.4	132.8	177.3	-56.9	-98.1	0	0	0	109.7	F381 N385 R394 S429 H430	F381-Y383 PolarHBondContact O-N 3.17Å; F381-Y383 VanDerWaalsContact O-N 3.14Å; Y383-N385 PolarHBondContact O-N 2.95Å; Y383-R394 VanDerWaalsContact CE2-CZ 3.47Å; Y383-R394 PolarHBondContact OH-NH2 3.36Å; Y383-S429 WeakPolarHBondContact CE1-OG 3.14Å; Y383-S429 WeakPolarHBondContact OH-CB 3.42Å; Y383-S429 PolarHBondContact OH-OG 3.22Å; Y383-H430 AromaticContact CD1-CD2 3.79Å; Y383-H430 AromaticContact CD1-NE2 3.65Å; Y383-H430 AromaticContact CE1-CD2 3.49Å; Y383-H430 VanDerWaalsContact CE1-CD2 3.49Å; Y383-H430 WeakPolarHBondContact CE1-CD2 3.38Å; Y383-H430 AromaticContact CE1-NE2 3.32Å; Y383-H430 VanDerWaalsContact CE1-NE2 3.32Å; Y383-H430 WeakPolarHBondContact CE1-NE2 3.46Å
384	R	73.2	Confident	88.7	Confident	250 Å²	250	47.2 Å²	47.2	94%	0.943	23%	0.229	S	C	*	.	S	Bend	trans	-61.3	-33.2	171.1	-81.7	-173	176.3	178.6	-0.7	112.6
385	N	82.6	Confident	88.7	Confident	96 Å²	96	50.4 Å²	50.4	51%	0.513	25%	0.247	S	C	.	.	S	Bend	trans	-137.1	117.3	176.9	-74.4	-55.2	0	0	0	108.9	S205 Y383	S205-N385 PolarHBondContact N-OD1 3.35Å; Y383-N385 PolarHBondContact O-N 2.95Å
386	I	87.2	Confident	88.8	Confident	11 Å²	11	52.1 Å²	52.1	6%	0.056	26%	0.257	C	S	.	.			trans	-100.3	126.1	170.2	-169.2	172.9	0	0	0	109.6	S205 W208 P390 F391	S205-I386 WeakPolarHBondContact OG-CG2 3.44Å; S205-I386 PolarHBondContact OG-N 3.26Å; S205-I386 PolarHBondContact OG-O 2.94Å; W208-I386 PolarHBondContact NE1-O 3.35Å; I386-P390 HydrophobicContact CD1-CB 4.32Å; I386-P390 HydrophobicContact CG1-CB 4.04Å; I386-F391 VanDerWaalsContact CD1-CA 3.48Å; I386-F391 HydrophobicContact CD1-CB 3.86Å; I386-F391 HydrophobicContact CD1-CD2 4.36Å; I386-F391 HydrophobicContact CG1-CB 4.05Å; I386-F391 HydrophobicContact CG2-CB 4.08Å; I386-F391 HydrophobicContact CG2-CD2 3.87Å; I386-F391 HydrophobicContact CG2-CG 4.41Å
387	P	89	Confident	88.9	Confident	71 Å²	71	50 Å²	50	46%	0.461	24%	0.244	S	C	.	.			trans	-66.1	159.1	171.8	-15.7	29.2	0	0	0	111.4	G389 P390 F391	P387-G389 PolarHBondContact O-N 3.36Å; P387-P390 HydrophobicContact CB-CG 4.46Å; P387-P390 HydrophobicContact CG-CG 4.46Å; P387-P390 WeakPolarHBondContact O-CD 3.28Å; P387-F391 WeakPolarHBondContact O-CB 3.43Å; P387-F391 PolarHBondContact O-N 3.3Å; P387-F391 VanDerWaalsContact O-N 3.09Å
388	F	91.7	Very high	89.1	Confident	11 Å²	11	49 Å²	49	5%	0.048	24%	0.239	C	C	.	.	H	α-helix	trans	-54.3	-48.1	-177.4	170.7	-101.5	0	0	0	113.3	L193 M197 F198 W208 L212 F391 I392	L193-F388 HydrophobicContact CB-CE1 4.49Å; L193-F388 HydrophobicContact CD2-CE1 3.84Å; L193-F388 HydrophobicContact CD2-CZ 4.06Å; L193-F388 HydrophobicContact CG-CE1 3.91Å; L193-F388 HydrophobicContact CG-CZ 4.44Å; M197-F388 HydrophobicContact SD-CE1 4.12Å; M197-F388 HydrophobicContact SD-CZ 3.96Å; F198-F388 HydrophobicContact CD2-CB 4.25Å; F198-F388 HydrophobicContact CD2-CD1 4.44Å; F198-F388 HydrophobicContact CD2-CG 4.34Å; F198-F388 HydrophobicContact CE2-CB 3.81Å; F198-F388 AromaticContact CE2-CD1 3.86Å; F198-F388 HydrophobicContact CE2-CD1 3.86Å; F198-F388 AromaticContact CE2-CD2 3.89Å; F198-F388 HydrophobicContact CE2-CD2 3.89Å; F198-F388 HydrophobicContact CE2-CE1 4.39Å; F198-F388 HydrophobicContact CE2-CE2 4.41Å; F198-F388 AromaticContact CE2-CG 3.57Å; F198-F388 HydrophobicContact CE2-CG 3.57Å; F198-F388 HydrophobicContact CZ-CD2 4.34Å; F198-F388 HydrophobicContact CZ-CG 4.43Å; W208-F388 HydrophobicContact CD2-CB 4.07Å; W208-F388 HydrophobicContact CD2-CD2 4.34Å; W208-F388 HydrophobicContact CE3-CB 4.34Å; W208-F388 AromaticContact CE3-CD2 3.75Å; W208-F388 HydrophobicContact CE3-CD2 3.75Å; W208-F388 HydrophobicContact CG-CB 4.25Å; W208-F388 AromaticContact CZ3-CD2 3.86Å; W208-F388 HydrophobicContact CZ3-CD2 3.86Å; L212-F388 HydrophobicContact CD2-CD2 4.47Å; L212-F388 HydrophobicContact CD2-CE2 3.95Å; F388-F391 WeakPolarHBondContact O-CB 3.43Å; F388-F391 PolarHBondContact O-N 3.37Å; F388-I392 HydrophobicContact CD2-CD1 4.48Å; F388-I392 HydrophobicContact CD2-CG1 3.96Å; F388-I392 HydrophobicContact CE1-CG1 4.26Å; F388-I392 HydrophobicContact CE2-CD1 3.89Å; F388-I392 HydrophobicContact CE2-CG1 3.53Å; F388-I392 HydrophobicContact CG-CG1 4.5Å; F388-I392 HydrophobicContact CZ-CD1 4.35Å; F388-I392 HydrophobicContact CZ-CG1 3.72Å; F388-I392 WeakPolarHBondContact O-CG1 3.37Å; F388-I392 PolarHBondContact O-N 2.95Å
389	G	91.8	Very high	89.4	Confident	2 Å²	2	52.4 Å²	52.4	2%	0.021	26%	0.259	C	S	.	.	H	α-helix	trans	-56.1	-61	-178.5	0	0	0	0	0	113.4	P387 F391 I392 E393	P387-G389 PolarHBondContact O-N 3.36Å; G389-F391 PolarHBondContact O-N 3.48Å; G389-I392 PolarHBondContact O-N 2.93Å; G389-I392 VanDerWaalsContact O-N 3.15Å; G389-E393 WeakPolarHBondContact O-CG 3.48Å; G389-E393 PolarHBondContact O-N 2.76Å
390	P	90.9	Very high	89.7	Confident	41 Å²	41	52.6 Å²	52.6	27%	0.266	26%	0.26	S	S	.	.	H	α-helix	trans	-57.6	-30.6	175.1	-27.8	35.9	0	0	0	114.3	I386 P387 R394	I386-P390 HydrophobicContact CD1-CB 4.32Å; I386-P390 HydrophobicContact CG1-CB 4.04Å; P387-P390 HydrophobicContact CB-CG 4.46Å; P387-P390 HydrophobicContact CG-CG 4.46Å; P387-P390 WeakPolarHBondContact O-CD 3.28Å; P390-R394 WeakPolarHBondContact O-CB 3.47Å; P390-R394 WeakPolarHBondContact O-CG 3.37Å; P390-R394 PolarHBondContact O-N 2.75Å; P390-R394 VanDerWaalsContact O-N 3.11Å
391	F	92.8	Very high	90	Very high	55 Å²	55	51.7 Å²	51.7	24%	0.241	26%	0.257	C	S	.	.	H	α-helix	trans	-65	-49.1	175.4	176.7	-91.4	0	0	0	111.8	W208 F380 I386 P387 F388 G389 R394 L395	W208-F391 HydrophobicContact CH2-CB 4.33Å; W208-F391 AromaticContact CH2-CD1 3.43Å; W208-F391 HydrophobicContact CH2-CD1 3.43Å; W208-F391 VanDerWaalsContact CH2-CD1 3.43Å; W208-F391 HydrophobicContact CH2-CD2 4.32Å; W208-F391 AromaticContact CH2-CE1 3.73Å; W208-F391 HydrophobicContact CH2-CE1 3.73Å; W208-F391 AromaticContact CH2-CG 3.76Å; W208-F391 HydrophobicContact CH2-CG 3.76Å; W208-F391 HydrophobicContact CH2-CZ 4.29Å; W208-F391 HydrophobicContact CZ2-CB 3.96Å; W208-F391 AromaticContact CZ2-CD1 3.91Å; W208-F391 HydrophobicContact CZ2-CD1 3.91Å; W208-F391 HydrophobicContact CZ2-CD2 4.16Å; W208-F391 HydrophobicContact CZ2-CE1 4.48Å; W208-F391 AromaticContact CZ2-CG 3.73Å; W208-F391 HydrophobicContact CZ2-CG 3.73Å; W208-F391 HydrophobicContact CZ3-CD1 4.41Å; F380-F391 AromaticContact CD1-CD2 3.86Å; F380-F391 HydrophobicContact CD1-CD2 3.86Å; F380-F391 AromaticContact CD1-CE2 3.84Å; F380-F391 HydrophobicContact CD1-CE2 3.84Å; F380-F391 HydrophobicContact CE1-CD2 4.16Å; F380-F391 HydrophobicContact CE1-CE2 4.09Å; I386-F391 VanDerWaalsContact CD1-CA 3.48Å; I386-F391 HydrophobicContact CD1-CB 3.86Å; I386-F391 HydrophobicContact CD1-CD2 4.36Å; I386-F391 HydrophobicContact CG1-CB 4.05Å; I386-F391 HydrophobicContact CG2-CB 4.08Å; I386-F391 HydrophobicContact CG2-CD2 3.87Å; I386-F391 HydrophobicContact CG2-CG 4.41Å; P387-F391 WeakPolarHBondContact O-CB 3.43Å; P387-F391 PolarHBondContact O-N 3.3Å; P387-F391 VanDerWaalsContact O-N 3.09Å; F388-F391 WeakPolarHBondContact O-CB 3.43Å; F388-F391 PolarHBondContact O-N 3.37Å; G389-F391 PolarHBondContact O-N 3.48Å; F391-R394 PolarHBondContact O-N 2.9Å; F391-L395 HydrophobicContact CE1-CD2 4.43Å; F391-L395 WeakPolarHBondContact O-CB 3.22Å; F391-L395 PolarHBondContact O-N 2.72Å
392	I	94.1	Very high	90.8	Very high	44 Å²	44	47.6 Å²	47.6	23%	0.226	24%	0.239	C	C	.	.	H	α-helix	trans	-67.1	-39.2	179.1	-61.3	-64.2	0	0	0	110.7	F388 G389 R394 L395 V396	F388-I392 HydrophobicContact CD2-CD1 4.48Å; F388-I392 HydrophobicContact CD2-CG1 3.96Å; F388-I392 HydrophobicContact CE1-CG1 4.26Å; F388-I392 HydrophobicContact CE2-CD1 3.89Å; F388-I392 HydrophobicContact CE2-CG1 3.53Å; F388-I392 HydrophobicContact CG-CG1 4.5Å; F388-I392 HydrophobicContact CZ-CD1 4.35Å; F388-I392 HydrophobicContact CZ-CG1 3.72Å; F388-I392 WeakPolarHBondContact O-CG1 3.37Å; F388-I392 PolarHBondContact O-N 2.95Å; G389-I392 PolarHBondContact O-N 2.93Å; G389-I392 VanDerWaalsContact O-N 3.15Å; I392-R394 VanDerWaalsContact C-N 3.32Å; I392-R394 PolarHBondContact O-N 2.58Å; I392-L395 PolarHBondContact O-N 3.41Å; I392-V396 HydrophobicContact CG2-CG2 4.22Å; I392-V396 WeakPolarHBondContact O-CG2 3.33Å; I392-V396 PolarHBondContact O-N 3.22Å
393	E	95.3	Very high	92.1	Very high	20 Å²	20	48.6 Å²	48.6	9%	0.093	24%	0.239	C	C	.	.	H	α-helix	trans	-55.3	-46.5	173.7	-71.1	162.4	-151.6	0	0	112.2	L183 I187 S190 G389 V396 F397 F426	L183-E393 WeakPolarHBondContact CD1-O 3.33Å; I187-E393 HydrophobicContact CG1-CG 4.05Å; S190-E393 WeakPolarHBondContact CB-OE1 3.36Å; S190-E393 PolarHBondContact OG-OE1 3.25Å; G389-E393 WeakPolarHBondContact O-CG 3.48Å; G389-E393 PolarHBondContact O-N 2.76Å; E393-V396 PolarHBondContact O-N 3Å; E393-F397 VanDerWaalsContact O-CB 3.31Å; E393-F397 WeakPolarHBondContact O-CB 3.39Å; E393-F397 PolarHBondContact O-N 3.26Å; E393-F426 HydrophobicContact CB-CE1 4.27Å
394	R	95.4	Very high	93.3	Very high	13 Å²	13	47.4 Å²	47.4	5%	0.049	24%	0.237	C	C	.	.	H	α-helix	trans	-70	-33.1	179.1	-69	175.4	-166.3	173.3	5.5	112.8	L379 F380 Y383 P390 F391 I392 L398 F426	L379-R394 WeakPolarHBondContact O-CD 3.4Å; L379-R394 PolarHBondContact O-NH1 3.14Å; F380-R394 HydrophobicContact CD1-CB 4.26Å; F380-R394 HydrophobicContact CE1-CB 3.63Å; F380-R394 HydrophobicContact CZ-CB 3.9Å; Y383-R394 VanDerWaalsContact CE2-CZ 3.47Å; Y383-R394 PolarHBondContact OH-NH2 3.36Å; P390-R394 WeakPolarHBondContact O-CB 3.47Å; P390-R394 WeakPolarHBondContact O-CG 3.37Å; P390-R394 PolarHBondContact O-N 2.75Å; P390-R394 VanDerWaalsContact O-N 3.11Å; F391-R394 PolarHBondContact O-N 2.9Å; I392-R394 VanDerWaalsContact C-N 3.32Å; I392-R394 PolarHBondContact O-N 2.58Å; R394-L398 WeakPolarHBondContact O-CB 3.48Å; R394-L398 PolarHBondContact O-N 3Å; R394-F426 HydrophobicContact CG-CB 4.35Å; R394-F426 HydrophobicContact CG-CD1 4.31Å; R394-F426 PolarHBondContact NE-O 3.41Å; R394-F426 PolarHBondContact NH2-O 3.45Å
395	L	96.5	Very high	94.5	Very high	72 Å²	72	35.6 Å²	35.6	38%	0.377	19%	0.193	S	C	.	.	H	α-helix	trans	-66.6	-47.7	174.2	-177.5	64.3	0	0	0	111.2	F380 F391 I392 F397 L398 V399	F380-L395 HydrophobicContact CE1-CB 4.44Å; F380-L395 HydrophobicContact CZ-CB 4.45Å; F391-L395 HydrophobicContact CE1-CD2 4.43Å; F391-L395 WeakPolarHBondContact O-CB 3.22Å; F391-L395 PolarHBondContact O-N 2.72Å; I392-L395 PolarHBondContact O-N 3.41Å; L395-F397 VanDerWaalsContact C-N 3.33Å; L395-F397 PolarHBondContact O-N 3.4Å; L395-L398 WeakPolarHBondContact O-CB 3.41Å; L395-L398 PolarHBondContact O-N 3.47Å; L395-V399 WeakPolarHBondContact O-CG2 3.44Å; L395-V399 PolarHBondContact O-N 3.09Å; L395-V399 VanDerWaalsContact O-N 3.09Å
396	V	97.9	Very high	95.1	Very high	35 Å²	35	32 Å²	32	21%	0.212	17%	0.173	C	C	.	.	H	α-helix	trans	-64.1	-41.4	176.3	177.1	0	0	0	0	110.4	P182 L183 C186 I392 E393 L398 V399 C400	P182-V396 HydrophobicContact CB-CG1 4.36Å; L183-V396 HydrophobicContact CB-CG1 4.12Å; L183-V396 HydrophobicContact CD1-CG1 4.4Å; C186-V396 HydrophobicContact CB-CB 4.28Å; C186-V396 HydrophobicContact CB-CG1 4.28Å; C186-V396 HydrophobicContact CB-CG2 4.1Å; I392-V396 HydrophobicContact CG2-CG2 4.22Å; I392-V396 WeakPolarHBondContact O-CG2 3.33Å; I392-V396 PolarHBondContact O-N 3.22Å; E393-V396 PolarHBondContact O-N 3Å; V396-L398 PolarHBondContact O-N 2.74Å; V396-V399 PolarHBondContact O-N 3.35Å; V396-C400 WeakPolarHBondContact O-CB 3.37Å; V396-C400 PolarHBondContact O-N 2.91Å; V396-C400 PolarHBondContact O-SG 3.34Å
397	F	98	Very high	95.4	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-56	-48.7	172.5	164.6	-103.4	0	0	0	111.9	W180 L183 F375 L379 E393 L395 V399 C400 A401 P419 L422 W423 F426	W180-F397 HydrophobicContact CZ3-CD2 4.25Å; W180-F397 HydrophobicContact CZ3-CE2 4.32Å; L183-F397 HydrophobicContact CD1-CB 3.92Å; L183-F397 HydrophobicContact CD2-CB 4.25Å; L183-F397 HydrophobicContact CD2-CD2 4.13Å; F375-F397 HydrophobicContact CZ-CE1 4.02Å; F375-F397 HydrophobicContact CZ-CZ 4.37Å; L379-F397 HydrophobicContact CD1-CD1 4.04Å; L379-F397 HydrophobicContact CD1-CE1 3.89Å; L379-F397 HydrophobicContact CD2-CD1 3.83Å; L379-F397 HydrophobicContact CD2-CE1 3.84Å; L379-F397 HydrophobicContact CG-CE1 4.47Å; E393-F397 VanDerWaalsContact O-CB 3.31Å; E393-F397 WeakPolarHBondContact O-CB 3.39Å; E393-F397 PolarHBondContact O-N 3.26Å; L395-F397 VanDerWaalsContact C-N 3.33Å; L395-F397 PolarHBondContact O-N 3.4Å; F397-V399 VanDerWaalsContact C-N 3.29Å; F397-V399 PolarHBondContact O-N 2.83Å; F397-C400 PolarHBondContact O-N 3.47Å; F397-A401 HydrophobicContact CD2-CB 4.49Å; F397-A401 HydrophobicContact CE1-CB 4.46Å; F397-A401 HydrophobicContact CE2-CB 3.92Å; F397-A401 HydrophobicContact CZ-CB 3.9Å; F397-A401 VanDerWaalsContact O-CB 3.24Å; F397-A401 WeakPolarHBondContact O-CB 3.38Å; F397-A401 PolarHBondContact O-N 3.37Å; F397-P419 WeakPolarHBondContact CZ-O 3.26Å; F397-L422 HydrophobicContact CD2-CB 3.83Å; F397-L422 HydrophobicContact CD2-CD1 4.22Å; F397-L422 HydrophobicContact CE2-CB 3.39Å; F397-L422 HydrophobicContact CE2-CD1 4.15Å; F397-L422 HydrophobicContact CE2-CG 4.42Å; F397-L422 HydrophobicContact CZ-CB 4.19Å; F397-W423 HydrophobicContact CE1-CB 3.97Å; F397-W423 HydrophobicContact CZ-CB 3.69Å; F397-F426 HydrophobicContact CB-CD2 4.48Å; F397-F426 HydrophobicContact CD2-CD2 4.34Å; F397-F426 HydrophobicContact CG-CD2 4.19Å
398	L	97.8	Very high	95.5	Very high	38 Å²	38	31.2 Å²	31.2	20%	0.199	17%	0.173	C	C	.	.	H	α-helix	trans	-56.5	-44.4	178.4	174.5	67.2	0	0	0	111.1	F272 F375 F380 R394 L395 V396 F402	F272-L398 HydrophobicContact CE2-CD1 4.45Å; F272-L398 HydrophobicContact CZ-CD1 3.76Å; F375-L398 HydrophobicContact CD1-CD1 4.33Å; F375-L398 HydrophobicContact CE1-CD1 3.69Å; F380-L398 HydrophobicContact CE2-CD2 4.18Å; F380-L398 HydrophobicContact CZ-CD2 4.47Å; R394-L398 WeakPolarHBondContact O-CB 3.48Å; R394-L398 PolarHBondContact O-N 3Å; L395-L398 WeakPolarHBondContact O-CB 3.41Å; L395-L398 PolarHBondContact O-N 3.47Å; V396-L398 PolarHBondContact O-N 2.74Å; L398-F402 VanDerWaalsContact O-CB 3.26Å; L398-F402 WeakPolarHBondContact O-CB 3.41Å; L398-F402 PolarHBondContact O-N 2.74Å
399	V	98.3	Very high	95.4	Very high	75 Å²	75	31.3 Å²	31.3	46%	0.455	18%	0.177	S	C	.	.	H	α-helix	trans	-66	-47	178.2	174.4	0	0	0	0	111.4	L395 V396 F397 A401 F402 I403	L395-V399 WeakPolarHBondContact O-CG2 3.44Å; L395-V399 PolarHBondContact O-N 3.09Å; L395-V399 VanDerWaalsContact O-N 3.09Å; V396-V399 PolarHBondContact O-N 3.35Å; F397-V399 VanDerWaalsContact C-N 3.29Å; F397-V399 PolarHBondContact O-N 2.83Å; V399-A401 PolarHBondContact O-N 2.95Å; V399-F402 WeakPolarHBondContact O-CB 3.4Å; V399-F402 PolarHBondContact O-N 3.38Å; V399-I403 HydrophobicContact CG1-CD1 3.75Å; V399-I403 HydrophobicContact CG1-CG1 4.46Å; V399-I403 WeakPolarHBondContact O-CG1 3.49Å; V399-I403 PolarHBondContact O-N 3.09Å
400	C	98.4	Very high	95.5	Very high	4 Å²	4	32.5 Å²	32.5	3%	0.027	18%	0.183	C	C	.	.	H	α-helix	trans	-61.1	-45.2	177.3	-69.1	0	0	0	0	111.9	I179 W180 V396 F397 F402 I403 V404	I179-C400 HydrophobicContact CG1-CB 4.35Å; I179-C400 PolarHBondContact O-SG 3.09Å; W180-C400 HydrophobicContact CE3-CB 3.9Å; W180-C400 HydrophobicContact CZ3-CB 3.71Å; V396-C400 WeakPolarHBondContact O-CB 3.37Å; V396-C400 PolarHBondContact O-N 2.91Å; V396-C400 PolarHBondContact O-SG 3.34Å; F397-C400 PolarHBondContact O-N 3.47Å; C400-F402 VanDerWaalsContact C-N 3.33Å; C400-I403 PolarHBondContact O-N 2.8Å; C400-V404 WeakPolarHBondContact O-CB 3.42Å; C400-V404 WeakPolarHBondContact O-CG1 3.37Å; C400-V404 PolarHBondContact O-N 3.45Å
401	A	98.2	Very high	95.7	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-64.8	-37.3	176.9	0	0	0	0	0	111.8	F397 V399 V404 V405 P419	F397-A401 HydrophobicContact CD2-CB 4.49Å; F397-A401 HydrophobicContact CE1-CB 4.46Å; F397-A401 HydrophobicContact CE2-CB 3.92Å; F397-A401 HydrophobicContact CZ-CB 3.9Å; F397-A401 VanDerWaalsContact O-CB 3.24Å; F397-A401 WeakPolarHBondContact O-CB 3.38Å; F397-A401 PolarHBondContact O-N 3.37Å; V399-A401 PolarHBondContact O-N 2.95Å; A401-V404 WeakPolarHBondContact O-CG1 3.36Å; A401-V405 WeakPolarHBondContact O-CB 3.23Å; A401-V405 WeakPolarHBondContact O-CG2 3.23Å; A401-V405 PolarHBondContact O-N 3.22Å; A401-P419 HydrophobicContact CB-CB 4.01Å
402	F	98	Very high	95.8	Very high	57 Å²	57	28.4 Å²	28.4	25%	0.25	16%	0.162	C	C	.	.	H	α-helix	trans	-61.9	-55.9	172.7	-174.5	-103.1	0	0	0	110.4	I269 F272 L398 V399 C400 V404 V405 I406	I269-F402 HydrophobicContact CG2-CE2 4.37Å; I269-F402 HydrophobicContact CG2-CZ 4.23Å; F272-F402 HydrophobicContact CB-CD2 3.81Å; F272-F402 HydrophobicContact CB-CE2 3.91Å; F272-F402 AromaticContact CD1-CD2 3.77Å; F272-F402 HydrophobicContact CD1-CD2 3.77Å; F272-F402 HydrophobicContact CD1-CE2 4.1Å; F272-F402 HydrophobicContact CD2-CB 4.17Å; F272-F402 AromaticContact CD2-CD2 3.66Å; F272-F402 HydrophobicContact CD2-CD2 3.66Å; F272-F402 HydrophobicContact CD2-CG 4.37Å; F272-F402 HydrophobicContact CE1-CD2 4.24Å; F272-F402 HydrophobicContact CE2-CB 4.17Å; F272-F402 HydrophobicContact CE2-CD2 4.13Å; F272-F402 AromaticContact CG-CD2 3.45Å; F272-F402 HydrophobicContact CG-CD2 3.45Å; F272-F402 VanDerWaalsContact CG-CD2 3.45Å; F272-F402 AromaticContact CG-CE2 3.94Å; F272-F402 HydrophobicContact CG-CE2 3.94Å; F272-F402 HydrophobicContact CZ-CD2 4.4Å; L398-F402 VanDerWaalsContact O-CB 3.26Å; L398-F402 WeakPolarHBondContact O-CB 3.41Å; L398-F402 PolarHBondContact O-N 2.74Å; V399-F402 WeakPolarHBondContact O-CB 3.4Å; V399-F402 PolarHBondContact O-N 3.38Å; C400-F402 VanDerWaalsContact C-N 3.33Å; F402-V404 PolarHBondContact O-N 3.15Å; F402-V405 PolarHBondContact O-N 3.3Å; F402-I406 HydrophobicContact CD1-CD1 3.78Å; F402-I406 HydrophobicContact CD1-CG1 4.46Å; F402-I406 HydrophobicContact CD1-CG2 4.46Å; F402-I406 HydrophobicContact CD2-CG2 4.14Å; F402-I406 HydrophobicContact CE1-CD1 3.38Å; F402-I406 HydrophobicContact CE1-CG1 4.38Å; F402-I406 HydrophobicContact CE1-CG2 4.25Å; F402-I406 HydrophobicContact CE2-CG2 3.88Å; F402-I406 HydrophobicContact CG-CG2 4.41Å; F402-I406 HydrophobicContact CZ-CD1 4Å; F402-I406 HydrophobicContact CZ-CG2 3.94Å; F402-I406 WeakPolarHBondContact O-CG1 3.27Å; F402-I406 WeakPolarHBondContact O-CG2 3.32Å; F402-I406 PolarHBondContact O-N 3.05Å
403	I	97	Very high	95.9	Very high	73 Å²	73	27.3 Å²	27.3	37%	0.374	16%	0.156	S	C	.	.	H	α-helix	trans	-59.4	-47.5	-176.5	-65.6	166.6	0	0	0	111.8	I179 V399 C400 V405 I406 A407	I179-I403 HydrophobicContact CD1-CB 3.91Å; I179-I403 HydrophobicContact CD1-CD1 4.2Å; I179-I403 HydrophobicContact CD1-CG2 3.52Å; I179-I403 HydrophobicContact CG1-CB 4.22Å; I179-I403 HydrophobicContact CG1-CG2 4.12Å; V399-I403 HydrophobicContact CG1-CD1 3.75Å; V399-I403 HydrophobicContact CG1-CG1 4.46Å; V399-I403 WeakPolarHBondContact O-CG1 3.49Å; V399-I403 PolarHBondContact O-N 3.09Å; C400-I403 PolarHBondContact O-N 2.8Å; I403-V405 VanDerWaalsContact C-N 3.26Å; I403-V405 PolarHBondContact O-N 3.15Å; I403-I406 PolarHBondContact O-N 2.96Å; I403-A407 WeakPolarHBondContact O-CB 3.27Å; I403-A407 PolarHBondContact O-N 2.85Å
404	V	96.1	Very high	95.9	Very high	28 Å²	28	27 Å²	27	17%	0.17	15%	0.154	C	C	.	.	H	α-helix	trans	-63	-35.5	-176.6	75.3	0	0	0	0	112.2	I179 W180 C400 A401 F402 P419	I179-V404 HydrophobicContact CG1-CB 4.44Å; I179-V404 HydrophobicContact CG2-CB 3.82Å; I179-V404 HydrophobicContact CG2-CG2 3.84Å; W180-V404 HydrophobicContact CH2-CG1 4.05Å; W180-V404 HydrophobicContact CZ2-CG1 3.98Å; C400-V404 WeakPolarHBondContact O-CB 3.42Å; C400-V404 WeakPolarHBondContact O-CG1 3.37Å; C400-V404 PolarHBondContact O-N 3.45Å; A401-V404 WeakPolarHBondContact O-CG1 3.36Å; F402-V404 PolarHBondContact O-N 3.15Å; V404-P419 HydrophobicContact CG1-CG 4.44Å
405	V	96.8	Very high	95.9	Very high	2 Å²	2	29 Å²	29	1%	0.012	16%	0.162	C	C	.	.	H	α-helix	trans	-79.2	-46	-178.3	171	0	0	0	0	110.9	Q271 F272 F275 A401 F402 I403 A407 S408 F416 P419	Q271-V405 HydrophobicContact CB-CG1 3.5Å; Q271-V405 WeakPolarHBondContact CB-O 3.3Å; Q271-V405 VanDerWaalsContact O-CG1 3.25Å; Q271-V405 WeakPolarHBondContact O-CG1 3.41Å; F272-V405 HydrophobicContact CB-CG1 4.45Å; F275-V405 HydrophobicContact CB-CG1 4.03Å; F275-V405 HydrophobicContact CB-CG2 4.32Å; F275-V405 HydrophobicContact CD1-CG2 4.23Å; F275-V405 HydrophobicContact CG-CG2 4.19Å; A401-V405 WeakPolarHBondContact O-CB 3.23Å; A401-V405 WeakPolarHBondContact O-CG2 3.23Å; A401-V405 PolarHBondContact O-N 3.22Å; F402-V405 PolarHBondContact O-N 3.3Å; I403-V405 VanDerWaalsContact C-N 3.26Å; I403-V405 PolarHBondContact O-N 3.15Å; V405-A407 VanDerWaalsContact C-N 3.28Å; V405-A407 PolarHBondContact O-N 2.79Å; V405-S408 PolarHBondContact O-N 3.37Å; V405-S408 PolarHBondContact O-OG 3.18Å; V405-F416 HydrophobicContact CG1-CD1 4.44Å; V405-F416 HydrophobicContact CG1-CE1 3.81Å; V405-F416 HydrophobicContact CG2-CD1 4.14Å; V405-F416 HydrophobicContact CG2-CE1 4.31Å; V405-P419 HydrophobicContact CG2-CG 4.24Å
406	I	96.1	Very high	95.9	Very high	19 Å²	19	25.6 Å²	25.6	10%	0.097	14%	0.144	C	C	.	.	H	α-helix	trans	-71.3	-23.8	-177.7	70	170.1	0	0	0	113.2	L267 N268 F272 F402 I403 S408	L267-I406 HydrophobicContact CD1-CD1 3.7Å; L267-I406 HydrophobicContact CD1-CG1 4.42Å; N268-I406 PolarHBondContact N-O 2.79Å; F272-I406 HydrophobicContact CB-CG2 3.99Å; F402-I406 HydrophobicContact CD1-CD1 3.78Å; F402-I406 HydrophobicContact CD1-CG1 4.46Å; F402-I406 HydrophobicContact CD1-CG2 4.46Å; F402-I406 HydrophobicContact CD2-CG2 4.14Å; F402-I406 HydrophobicContact CE1-CD1 3.38Å; F402-I406 HydrophobicContact CE1-CG1 4.38Å; F402-I406 HydrophobicContact CE1-CG2 4.25Å; F402-I406 HydrophobicContact CE2-CG2 3.88Å; F402-I406 HydrophobicContact CG-CG2 4.41Å; F402-I406 HydrophobicContact CZ-CD1 4Å; F402-I406 HydrophobicContact CZ-CG2 3.94Å; F402-I406 WeakPolarHBondContact O-CG1 3.27Å; F402-I406 WeakPolarHBondContact O-CG2 3.32Å; F402-I406 PolarHBondContact O-N 3.05Å; I403-I406 PolarHBondContact O-N 2.96Å; I406-S408 PolarHBondContact O-N 3.04Å
407	A	93.7	Very high	95.9	Very high	47 Å²	47	24 Å²	24	39%	0.388	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-11.6	176.3	0	0	0	0	0	112.8	V266 I403 V405	V266-A407 WeakPolarHBondContact O-CA 3.13Å; I403-A407 WeakPolarHBondContact O-CB 3.27Å; I403-A407 PolarHBondContact O-N 2.85Å; V405-A407 VanDerWaalsContact C-N 3.28Å; V405-A407 PolarHBondContact O-N 2.79Å
408	S	91.6	Very high	95.9	Very high	19 Å²	19	24.9 Å²	24.9	13%	0.133	14%	0.139	C	C	.	.			trans	-89.4	120.9	179.1	72.1	0	0	0	0	111.5	Q271 V405 I406	Q271-S408 PolarHBondContact NE2-O 3.32Å; Q271-S408 PolarHBondContact NE2-OG 2.88Å; V405-S408 PolarHBondContact O-N 3.37Å; V405-S408 PolarHBondContact O-OG 3.18Å; I406-S408 PolarHBondContact O-N 3.04Å
409	G	89.1	Confident	96	Very high	13 Å²	13	23.1 Å²	23.1	13%	0.134	13%	0.13	C	C	.	.			trans	-76.8	-32.9	177.8	0	0	0	0	0	114.1
410	L	93.5	Very high	95.9	Very high	28 Å²	28	19.6 Å²	19.6	15%	0.147	11%	0.108	C	C	.	.	S	Bend	trans	-89.1	124.2	-178.8	-178.8	64	0	0	0	110.7	Q271 H335 L338 E412 Y415	Q271-L410 VanDerWaalsContact NE2-C 3.33Å; Q271-L410 PolarHBondContact NE2-O 3.42Å; H335-L410 HydrophobicContact CB-CB 4.14Å; H335-L410 HydrophobicContact CB-CD1 3.89Å; L338-L410 HydrophobicContact CB-CD1 4.03Å; L410-E412 HydrophobicContact CD2-CB 4.35Å; L410-E412 HydrophobicContact CG-CB 4.23Å; L410-E412 PolarHBondContact O-N 3.35Å; L410-Y415 HydrophobicContact CB-CE2 4.33Å
411	L	95.5	Very high	95.9	Very high	6 Å²	6	19.4 Å²	19.4	3%	0.031	11%	0.107	C	C	.	.			trans	-71.7	98.5	168.3	172	56.2	0	0	0	108.9	Y274 L338 T346 W350 I354 L413 F416	Y274-L411 HydrophobicContact CD2-CD1 3.89Å; Y274-L411 HydrophobicContact CD2-CD2 4.06Å; Y274-L411 HydrophobicContact CD2-CG 4.46Å; Y274-L411 HydrophobicContact CE2-CD2 4.32Å; Y274-L411 HydrophobicContact CG-CD1 4.36Å; L338-L411 HydrophobicContact CD1-CB 4.13Å; L338-L411 HydrophobicContact CD2-CB 4.03Å; T346-L411 WeakPolarHBondContact CB-O 3.2Å; T346-L411 HydrophobicContact CG2-CG 4.23Å; T346-L411 WeakPolarHBondContact CG2-O 3.36Å; T346-L411 PolarHBondContact OG1-O 2.96Å; W350-L411 HydrophobicContact CE3-CD2 4.4Å; I354-L411 HydrophobicContact CD1-CD2 3.93Å; L411-L413 HydrophobicContact CD1-CD2 4.45Å; L411-F416 HydrophobicContact CD1-CE2 4.26Å; L411-F416 HydrophobicContact CD1-CZ 3.99Å
412	E	94.4	Very high	95.8	Very high	4 Å²	4	19.4 Å²	19.4	2%	0.019	11%	0.107	C	C	.	.			trans	-137.2	121.2	177.7	-156.8	175.5	-178.6	0	0	109.6	L410 R414 Y415	L410-E412 HydrophobicContact CD2-CB 4.35Å; L410-E412 HydrophobicContact CG-CB 4.23Å; L410-E412 PolarHBondContact O-N 3.35Å; E412-R414 VanDerWaalsContact CD-CZ 3.45Å; E412-R414 VanDerWaalsContact CD-NH2 3.3Å; E412-R414 HydrophobicContact CG-CG 3.95Å; E412-R414 PolarHBondContact O-N 2.95Å; E412-R414 WeakPolarHBondContact OE1-CD 3.42Å; E412-R414 IonicContact OE1-CZ 3.46Å; E412-R414 IonicContact OE1-NE 3.72Å; E412-R414 PolarHBondContact OE1-NE 3.02Å; E412-R414 IonicContact OE1-NH1 2.8Å; E412-R414 IonicContact OE1-NH2 3.49Å; E412-R414 PolarHBondContact OE1-NH2 3.45Å; E412-R414 IonicContact OE2-CZ 3Å; E412-R414 IonicContact OE2-NE 2.81Å; E412-R414 PolarHBondContact OE2-NE 2.96Å; E412-R414 IonicContact OE2-NH2 3.01Å; E412-R414 PolarHBondContact OE2-NH2 3.13Å; E412-Y415 HydrophobicContact CB-CD2 3.9Å; E412-Y415 HydrophobicContact CB-CE2 3.73Å; E412-Y415 HydrophobicContact CB-CG 4.42Å; E412-Y415 WeakPolarHBondContact O-CB 3.32Å; E412-Y415 PolarHBondContact O-N 3.15Å; E412-Y415 VanDerWaalsContact O-N 3.12Å; E412-Y415 PolarHBondContact OE2-OH 3.1Å
413	L	96.4	Very high	95.7	Very high	20 Å²	20	16.7 Å²	16.7	11%	0.105	10%	0.095	C	C	.	.	G	3₁₀ helix	trans	-67.2	-23.5	-169.5	-58.8	-176.7	0	0	0	112.6	L130 F278 T346 L411 Y415 F416 W473	L130-L413 HydrophobicContact CD1-CB 3.64Å; L130-L413 HydrophobicContact CD2-CB 3.71Å; L130-L413 HydrophobicContact CG-CB 4.35Å; F278-L413 HydrophobicContact CD2-CD2 4.39Å; T346-L413 HydrophobicContact CG2-CD2 4.44Å; T346-L413 HydrophobicContact CG2-CG 3.95Å; L411-L413 HydrophobicContact CD1-CD2 4.45Å; L413-Y415 PolarHBondContact O-N 3.4Å; L413-F416 HydrophobicContact CD2-CD2 3.86Å; L413-F416 HydrophobicContact CD2-CE2 3.67Å; L413-F416 VanDerWaalsContact O-CB 3.26Å; L413-F416 WeakPolarHBondContact O-CB 3.44Å; L413-F416 PolarHBondContact O-N 2.9Å; L413-W473 HydrophobicContact CD1-CE3 3.83Å; L413-W473 HydrophobicContact CD1-CZ3 4.01Å
414	R	95.4	Very high	95.6	Very high	14 Å²	14	13.2 Å²	13.2	5%	0.053	8%	0.077	C	C	.	.	G	3₁₀ helix	trans	-58.9	-31.2	175	74.8	-178.4	172	177.5	-23.7	112.6	D36 F134 E412 F416 L417	D36-R414 IonicContact OD2-CZ 2.83Å; D36-R414 IonicContact OD2-NH1 2.84Å; D36-R414 IonicContact OD2-NH2 2.81Å; D36-R414 PolarHBondContact OD2-NH2 2.94Å; F134-R414 HydrophobicContact CD2-CB 4.41Å; F134-R414 HydrophobicContact CE2-CB 3.83Å; F134-R414 HydrophobicContact CZ-CB 4.13Å; E412-R414 VanDerWaalsContact CD-CZ 3.45Å; E412-R414 VanDerWaalsContact CD-NH2 3.3Å; E412-R414 HydrophobicContact CG-CG 3.95Å; E412-R414 PolarHBondContact O-N 2.95Å; E412-R414 WeakPolarHBondContact OE1-CD 3.42Å; E412-R414 IonicContact OE1-CZ 3.46Å; E412-R414 IonicContact OE1-NE 3.72Å; E412-R414 PolarHBondContact OE1-NE 3.02Å; E412-R414 IonicContact OE1-NH1 2.8Å; E412-R414 IonicContact OE1-NH2 3.49Å; E412-R414 PolarHBondContact OE1-NH2 3.45Å; E412-R414 IonicContact OE2-CZ 3Å; E412-R414 IonicContact OE2-NE 2.81Å; E412-R414 PolarHBondContact OE2-NE 2.96Å; E412-R414 IonicContact OE2-NH2 3.01Å; E412-R414 PolarHBondContact OE2-NH2 3.13Å; R414-F416 PolarHBondContact O-N 3.08Å; R414-F416 VanDerWaalsContact O-N 3.16Å; R414-L417 HydrophobicContact CB-CD1 4.36Å; R414-L417 WeakPolarHBondContact O-CB 3.36Å; R414-L417 WeakPolarHBondContact O-CG 3.25Å; R414-L417 PolarHBondContact O-N 2.93Å; R414-L417 VanDerWaalsContact O-N 3.09Å
415	Y	95.1	Very high	95.4	Very high	54 Å²	54	12 Å²	12	21%	0.212	7%	0.07	C	C	.	.	G	3₁₀ helix	trans	-67	-16.2	176.7	-58.3	-22.3	0	0	0	112.8	L410 E412 L413	L410-Y415 HydrophobicContact CB-CE2 4.33Å; E412-Y415 HydrophobicContact CB-CD2 3.9Å; E412-Y415 HydrophobicContact CB-CE2 3.73Å; E412-Y415 HydrophobicContact CB-CG 4.42Å; E412-Y415 WeakPolarHBondContact O-CB 3.32Å; E412-Y415 PolarHBondContact O-N 3.15Å; E412-Y415 VanDerWaalsContact O-N 3.12Å; E412-Y415 PolarHBondContact OE2-OH 3.1Å; L413-Y415 PolarHBondContact O-N 3.4Å
416	F	97.6	Very high	95.1	Very high	1 Å²	1	11.9 Å²	11.9	0%	0.004	7%	0.069	C	C	.	.	G	3₁₀ helix	trans	-85.7	-9.4	176.6	-57.9	-16	0	0	0	113.1	F275 F278 V405 L411 L413 R414 P419 F420	F275-F416 HydrophobicContact CB-CD1 4.06Å; F275-F416 HydrophobicContact CB-CD2 4.29Å; F275-F416 HydrophobicContact CB-CE1 4Å; F275-F416 HydrophobicContact CB-CE2 4.2Å; F275-F416 HydrophobicContact CB-CG 4.23Å; F275-F416 HydrophobicContact CB-CZ 4.06Å; F275-F416 HydrophobicContact CD2-CB 3.59Å; F275-F416 AromaticContact CD2-CD1 3.96Å; F275-F416 HydrophobicContact CD2-CD1 3.96Å; F275-F416 HydrophobicContact CD2-CD2 4.03Å; F275-F416 AromaticContact CD2-CG 3.59Å; F275-F416 HydrophobicContact CD2-CG 3.59Å; F275-F416 HydrophobicContact CE2-CB 3.95Å; F275-F416 HydrophobicContact CE2-CG 4.43Å; F275-F416 HydrophobicContact CG-CD1 4.3Å; F275-F416 HydrophobicContact CG-CG 4.31Å; F278-F416 HydrophobicContact CB-CD2 3.96Å; F278-F416 HydrophobicContact CB-CE2 4.36Å; F278-F416 HydrophobicContact CD1-CB 4.01Å; F278-F416 HydrophobicContact CD1-CD2 4.09Å; F278-F416 HydrophobicContact CE1-CB 4.13Å; F278-F416 AromaticContact CG-CD2 3.95Å; F278-F416 HydrophobicContact CG-CD2 3.95Å; V405-F416 HydrophobicContact CG1-CD1 4.44Å; V405-F416 HydrophobicContact CG1-CE1 3.81Å; V405-F416 HydrophobicContact CG2-CD1 4.14Å; V405-F416 HydrophobicContact CG2-CE1 4.31Å; L411-F416 HydrophobicContact CD1-CE2 4.26Å; L411-F416 HydrophobicContact CD1-CZ 3.99Å; L413-F416 HydrophobicContact CD2-CD2 3.86Å; L413-F416 HydrophobicContact CD2-CE2 3.67Å; L413-F416 VanDerWaalsContact O-CB 3.26Å; L413-F416 WeakPolarHBondContact O-CB 3.44Å; L413-F416 PolarHBondContact O-N 2.9Å; R414-F416 PolarHBondContact O-N 3.08Å; R414-F416 VanDerWaalsContact O-N 3.16Å; F416-P419 VanDerWaalsContact O-CD 3.31Å; F416-P419 WeakPolarHBondContact O-CD 3.5Å; F416-P419 VanDerWaalsContact O-CG 3.32Å; F416-P419 WeakPolarHBondContact O-CG 3.45Å; F416-F420 WeakPolarHBondContact O-CB 3.34Å; F416-F420 PolarHBondContact O-N 3.41Å
417	L	97.5	Very high	94.5	Very high	3 Å²	3	11 Å²	11	2%	0.016	7%	0.065	C	C	.	.	H	α-helix	trans	-58.6	-54.9	-173.8	-78.7	172.5	0	0	0	113.3	E128 L130 F131 D141 I145 R414 F420 V421	E128-L417 WeakPolarHBondContact OE2-CD2 3.46Å; L130-L417 HydrophobicContact CB-CD1 4.37Å; L130-L417 HydrophobicContact CB-CD2 3.7Å; L130-L417 HydrophobicContact CB-CG 4.22Å; F131-L417 HydrophobicContact CB-CD2 4.48Å; F131-L417 HydrophobicContact CD2-CD2 4.4Å; D141-L417 HydrophobicContact CB-CD1 4.23Å; I145-L417 HydrophobicContact CD1-CB 3.88Å; I145-L417 HydrophobicContact CD1-CD1 4.08Å; I145-L417 HydrophobicContact CD1-CG 4.49Å; R414-L417 HydrophobicContact CB-CD1 4.36Å; R414-L417 WeakPolarHBondContact O-CB 3.36Å; R414-L417 WeakPolarHBondContact O-CG 3.25Å; R414-L417 PolarHBondContact O-N 2.93Å; R414-L417 VanDerWaalsContact O-N 3.09Å; L417-F420 PolarHBondContact O-N 2.91Å; L417-V421 WeakPolarHBondContact O-CB 3.27Å; L417-V421 WeakPolarHBondContact O-CG2 3.49Å; L417-V421 PolarHBondContact O-N 3.13Å
418	I	98.2	Very high	93.3	Very high	17 Å²	17	9.3 Å²	9.3	9%	0.087	5%	0.049	C	C	.	.	H	α-helix	trans	-61.9	-53.3	179.3	-63.7	170.1	0	0	0	112.2	S144 I145 V148 M149 N177 W180 F420 V421 L422	S144-I418 VanDerWaalsContact OG-CD1 3.31Å; S144-I418 WeakPolarHBondContact OG-CD1 3.38Å; I145-I418 HydrophobicContact CB-CG1 4.47Å; I145-I418 HydrophobicContact CG1-CD1 4.38Å; I145-I418 HydrophobicContact CG1-CG1 3.61Å; V148-I418 HydrophobicContact CG1-CG2 3.95Å; V148-I418 HydrophobicContact CG2-CD1 4.05Å; M149-I418 HydrophobicContact CE-CG2 4.12Å; N177-I418 VanDerWaalsContact OD1-CD1 3.24Å; N177-I418 WeakPolarHBondContact OD1-CD1 3.18Å; W180-I418 HydrophobicContact CD2-CG2 4.35Å; W180-I418 HydrophobicContact CH2-CG2 4.33Å; W180-I418 HydrophobicContact CZ2-CB 4.14Å; W180-I418 HydrophobicContact CZ2-CG2 3.5Å; I418-F420 PolarHBondContact O-N 2.81Å; I418-V421 PolarHBondContact O-N 3.35Å; I418-L422 HydrophobicContact CG2-CD1 3.89Å; I418-L422 HydrophobicContact CG2-CG 4.31Å; I418-L422 WeakPolarHBondContact O-CG 3.31Å; I418-L422 PolarHBondContact O-N 2.95Å
419	P	98.1	Very high	92.1	Very high	2 Å²	2	8.8 Å²	8.8	1%	0.013	5%	0.045	C	C	.	.	H	α-helix	trans	-62.1	-32	178.9	23	-31.9	0	0	0	112	W180 F275 F397 A401 V404 V405 F416 W423	W180-P419 HydrophobicContact CH2-CB 3.97Å; W180-P419 HydrophobicContact CZ2-CB 4.45Å; F275-P419 HydrophobicContact CE1-CB 3.97Å; F275-P419 HydrophobicContact CE2-CB 4.11Å; F275-P419 HydrophobicContact CE2-CG 4.05Å; F275-P419 HydrophobicContact CZ-CB 3.57Å; F275-P419 HydrophobicContact CZ-CG 4.02Å; F397-P419 WeakPolarHBondContact CZ-O 3.26Å; A401-P419 HydrophobicContact CB-CB 4.01Å; V404-P419 HydrophobicContact CG1-CG 4.44Å; V405-P419 HydrophobicContact CG2-CG 4.24Å; F416-P419 VanDerWaalsContact O-CD 3.31Å; F416-P419 WeakPolarHBondContact O-CD 3.5Å; F416-P419 VanDerWaalsContact O-CG 3.32Å; F416-P419 WeakPolarHBondContact O-CG 3.45Å; P419-W423 WeakPolarHBondContact O-CB 3.41Å; P419-W423 PolarHBondContact O-N 2.8Å
420	F	97.7	Very high	91.1	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-65	-51.1	173.3	176.2	-99.6	0	0	0	112	E128 F275 F278 F416 L417 I418 L422 W423 R424	E128-F420 HydrophobicContact CB-CE1 4.04Å; E128-F420 HydrophobicContact CG-CD1 4.08Å; E128-F420 HydrophobicContact CG-CE1 3.56Å; E128-F420 HydrophobicContact CG-CZ 4.1Å; F275-F420 HydrophobicContact CE2-CB 4.11Å; F278-F420 HydrophobicContact CD1-CD2 4.19Å; F278-F420 HydrophobicContact CE1-CB 3.97Å; F278-F420 AromaticContact CE1-CD2 3.67Å; F278-F420 HydrophobicContact CE1-CD2 3.67Å; F278-F420 HydrophobicContact CE1-CE2 4.32Å; F278-F420 AromaticContact CE1-CG 3.82Å; F278-F420 HydrophobicContact CE1-CG 3.82Å; F416-F420 WeakPolarHBondContact O-CB 3.34Å; F416-F420 PolarHBondContact O-N 3.41Å; L417-F420 PolarHBondContact O-N 2.91Å; I418-F420 PolarHBondContact O-N 2.81Å; F420-L422 VanDerWaalsContact C-N 3.31Å; F420-L422 PolarHBondContact O-N 3.11Å; F420-W423 HydrophobicContact CD2-CE3 4.08Å; F420-W423 HydrophobicContact CD2-CZ3 4.37Å; F420-W423 HydrophobicContact CE2-CE3 4.1Å; F420-W423 AromaticContact CE2-CZ3 3.99Å; F420-W423 HydrophobicContact CE2-CZ3 3.99Å; F420-W423 WeakPolarHBondContact O-CB 3.38Å; F420-W423 PolarHBondContact O-N 2.82Å; F420-R424 HydrophobicContact CD1-CG 4.17Å; F420-R424 HydrophobicContact CD2-CG 4.3Å; F420-R424 HydrophobicContact CE1-CG 3.74Å; F420-R424 HydrophobicContact CE2-CG 3.9Å; F420-R424 HydrophobicContact CG-CG 4.43Å; F420-R424 HydrophobicContact CZ-CG 3.6Å; F420-R424 WeakPolarHBondContact O-CB 3.21Å; F420-R424 VanDerWaalsContact O-CG 3.3Å; F420-R424 WeakPolarHBondContact O-CG 3.29Å; F420-R424 PolarHBondContact O-N 3.02Å
421	V	96.9	Very high	90.5	Very high	1 Å²	1	12.7 Å²	12.7	1%	0.006	6%	0.06	C	C	.	.	H	α-helix	trans	-57.5	-46.8	178.7	171.6	0	0	0	0	110.2	I106 I125 F131 M149 L417 I418 R424 I425	I106-V421 HydrophobicContact CD1-CG1 4.07Å; I106-V421 HydrophobicContact CG1-CG1 4.2Å; I125-V421 HydrophobicContact CG2-CB 4.28Å; I125-V421 HydrophobicContact CG2-CG1 4.05Å; I125-V421 HydrophobicContact CG2-CG2 3.77Å; F131-V421 HydrophobicContact CE2-CG2 4.48Å; M149-V421 HydrophobicContact CE-CB 4.46Å; M149-V421 HydrophobicContact CE-CG1 4.01Å; M149-V421 HydrophobicContact CG-CG1 4.21Å; M149-V421 HydrophobicContact SD-CG1 3.5Å; M149-V421 WeakPolarHBondContact SD-CG1 3.33Å; L417-V421 WeakPolarHBondContact O-CB 3.27Å; L417-V421 WeakPolarHBondContact O-CG2 3.49Å; L417-V421 PolarHBondContact O-N 3.13Å; I418-V421 PolarHBondContact O-N 3.35Å; V421-R424 PolarHBondContact O-N 3Å; V421-I425 HydrophobicContact CG1-CD1 3.77Å; V421-I425 WeakPolarHBondContact O-CB 3.44Å; V421-I425 VanDerWaalsContact O-CG1 3.25Å; V421-I425 WeakPolarHBondContact O-CG1 3.47Å; V421-I425 PolarHBondContact O-N 3.12Å
422	L	96.7	Very high	90	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-62.6	-47	176.1	-69.4	175.2	0	0	0	111.7	M149 V152 W180 L183 F397 I418 F420 R424 I425 F426	M149-L422 HydrophobicContact CE-CD2 3.74Å; M149-L422 HydrophobicContact CE-CG 3.91Å; M149-L422 HydrophobicContact SD-CD2 4.06Å; V152-L422 HydrophobicContact CG2-CD2 3.97Å; W180-L422 HydrophobicContact CD2-CD1 4.02Å; W180-L422 HydrophobicContact CE3-CD1 3.57Å; W180-L422 HydrophobicContact CH2-CD1 3.81Å; W180-L422 HydrophobicContact CZ2-CD1 4.23Å; W180-L422 HydrophobicContact CZ3-CD1 3.45Å; W180-L422 VanDerWaalsContact CZ3-CD1 3.45Å; L183-L422 HydrophobicContact CD2-CD1 4Å; F397-L422 HydrophobicContact CD2-CB 3.83Å; F397-L422 HydrophobicContact CD2-CD1 4.22Å; F397-L422 HydrophobicContact CE2-CB 3.39Å; F397-L422 HydrophobicContact CE2-CD1 4.15Å; F397-L422 HydrophobicContact CE2-CG 4.42Å; F397-L422 HydrophobicContact CZ-CB 4.19Å; I418-L422 HydrophobicContact CG2-CD1 3.89Å; I418-L422 HydrophobicContact CG2-CG 4.31Å; I418-L422 WeakPolarHBondContact O-CG 3.31Å; I418-L422 PolarHBondContact O-N 2.95Å; F420-L422 VanDerWaalsContact C-N 3.31Å; F420-L422 PolarHBondContact O-N 3.11Å; L422-R424 VanDerWaalsContact C-N 3.3Å; L422-R424 PolarHBondContact O-N 3.38Å; L422-I425 PolarHBondContact O-N 3.47Å; L422-I425 VanDerWaalsContact O-N 3.17Å; L422-F426 HydrophobicContact CB-CD2 4.31Å; L422-F426 HydrophobicContact CB-CE2 4.45Å; L422-F426 HydrophobicContact CD2-CE2 4.21Å; L422-F426 WeakPolarHBondContact O-CB 3.29Å; L422-F426 WeakPolarHBondContact O-CD2 3.47Å; L422-F426 PolarHBondContact O-N 3.4Å
423	W	96.1	Very high	89.8	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-54.1	-48.5	176	174.3	73.9	0	0	0	110.8	C279 T283 Y374 F375 T378 F397 P419 F420 I425 F426 S427	C279-W423 HydrophobicContact CB-CD2 4.35Å; C279-W423 HydrophobicContact CB-CE3 3.96Å; C279-W423 HydrophobicContact CB-CH2 3.9Å; C279-W423 HydrophobicContact CB-CZ2 4.26Å; C279-W423 HydrophobicContact CB-CZ3 3.72Å; T283-W423 HydrophobicContact CG2-CH2 3.99Å; T283-W423 HydrophobicContact CG2-CZ3 3.84Å; Y374-W423 AromaticContact CE1-CH2 3.68Å; Y374-W423 HydrophobicContact CE1-CH2 3.68Å; Y374-W423 AromaticContact CE1-CZ2 3.84Å; Y374-W423 HydrophobicContact CE1-CZ2 3.84Å; F375-W423 AromaticContact CD2-CD1 3.61Å; F375-W423 HydrophobicContact CD2-CD2 4.17Å; F375-W423 AromaticContact CD2-CE2 3.83Å; F375-W423 HydrophobicContact CD2-CG 4.07Å; F375-W423 HydrophobicContact CD2-CZ2 4.48Å; F375-W423 AromaticContact CD2-NE1 3.44Å; F375-W423 HydrophobicContact CE2-CB 4.06Å; F375-W423 AromaticContact CE2-CD1 3.21Å; F375-W423 HydrophobicContact CE2-CD2 4.04Å; F375-W423 AromaticContact CE2-CG 3.52Å; F375-W423 HydrophobicContact CE2-CG 3.52Å; F375-W423 AromaticContact CE2-NE1 3.59Å; F375-W423 AromaticContact CG-NE1 3.92Å; F375-W423 HydrophobicContact CZ-CB 4.47Å; F375-W423 AromaticContact CZ-CD1 3.57Å; F375-W423 HydrophobicContact CZ-CG 4.14Å; F375-W423 PolarHBondContact O-NE1 3.34Å; T378-W423 HydrophobicContact CG2-CH2 4.49Å; T378-W423 HydrophobicContact CG2-CZ2 3.75Å; F397-W423 HydrophobicContact CE1-CB 3.97Å; F397-W423 HydrophobicContact CZ-CB 3.69Å; P419-W423 WeakPolarHBondContact O-CB 3.41Å; P419-W423 PolarHBondContact O-N 2.8Å; F420-W423 HydrophobicContact CD2-CE3 4.08Å; F420-W423 HydrophobicContact CD2-CZ3 4.37Å; F420-W423 HydrophobicContact CE2-CE3 4.1Å; F420-W423 AromaticContact CE2-CZ3 3.99Å; F420-W423 HydrophobicContact CE2-CZ3 3.99Å; F420-W423 WeakPolarHBondContact O-CB 3.38Å; F420-W423 PolarHBondContact O-N 2.82Å; W423-I425 VanDerWaalsContact C-N 3.35Å; W423-I425 PolarHBondContact O-N 3.17Å; W423-F426 PolarHBondContact O-N 3.29Å; W423-S427 WeakPolarHBondContact O-CB 3.31Å; W423-S427 PolarHBondContact O-N 3.19Å; W423-S427 PolarHBondContact O-OG 3.23Å
424	R	94.2	Very high	89.6	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-60.4	-41.2	178.7	-71.7	-61.6	-55.9	-162.5	-10.8	113.1	I125 F420 V421 L422 L436 E439	I125-R424 HydrophobicContact CD1-CB 3.68Å; I125-R424 HydrophobicContact CG1-CB 3.73Å; I125-R424 HydrophobicContact CG1-CG 4.17Å; F420-R424 HydrophobicContact CD1-CG 4.17Å; F420-R424 HydrophobicContact CD2-CG 4.3Å; F420-R424 HydrophobicContact CE1-CG 3.74Å; F420-R424 HydrophobicContact CE2-CG 3.9Å; F420-R424 HydrophobicContact CG-CG 4.43Å; F420-R424 HydrophobicContact CZ-CG 3.6Å; F420-R424 WeakPolarHBondContact O-CB 3.21Å; F420-R424 VanDerWaalsContact O-CG 3.3Å; F420-R424 WeakPolarHBondContact O-CG 3.29Å; F420-R424 PolarHBondContact O-N 3.02Å; V421-R424 PolarHBondContact O-N 3Å; L422-R424 VanDerWaalsContact C-N 3.3Å; L422-R424 PolarHBondContact O-N 3.38Å; R424-L436 VanDerWaalsContact NH2-CD2 3.31Å; R424-E439 VanDerWaalsContact CZ-CD 3.49Å; R424-E439 IonicContact CZ-OE1 3.77Å; R424-E439 IonicContact CZ-OE2 3.05Å; R424-E439 IonicContact NE-OE1 3.5Å; R424-E439 IonicContact NH1-OE1 2.76Å; R424-E439 PolarHBondContact NH1-OE1 3.4Å; R424-E439 IonicContact NH1-OE2 3.38Å; R424-E439 PolarHBondContact NH1-OE2 3.41Å; R424-E439 IonicContact NH2-OE1 3.14Å; R424-E439 PolarHBondContact NH2-OE1 3Å; R424-E439 IonicContact NH2-OE2 3.21Å; R424-E439 PolarHBondContact NH2-OE2 2.8Å
425	I	92.4	Very high	89.4	Confident	2 Å²	2	30.7 Å²	30.7	1%	0.01	14%	0.135	C	C	.	.	H	α-helix	trans	-68	-43.3	178	-71.1	171.3	0	0	0	111.1	I106 L109 V110 M113 I125 M149 V421 L422 W423	I106-I425 HydrophobicContact CG2-CD1 4.48Å; L109-I425 HydrophobicContact CB-CD1 4.34Å; L109-I425 HydrophobicContact CD1-CD1 3.85Å; V110-I425 HydrophobicContact CG2-CG1 4.24Å; M113-I425 HydrophobicContact CE-CG2 4.19Å; M113-I425 HydrophobicContact SD-CG2 3.19Å; M113-I425 WeakPolarHBondContact SD-CG2 3.38Å; I125-I425 HydrophobicContact CD1-CG1 3.93Å; M149-I425 HydrophobicContact SD-CD1 4.03Å; V421-I425 HydrophobicContact CG1-CD1 3.77Å; V421-I425 WeakPolarHBondContact O-CB 3.44Å; V421-I425 VanDerWaalsContact O-CG1 3.25Å; V421-I425 WeakPolarHBondContact O-CG1 3.47Å; V421-I425 PolarHBondContact O-N 3.12Å; L422-I425 PolarHBondContact O-N 3.47Å; L422-I425 VanDerWaalsContact O-N 3.17Å; W423-I425 VanDerWaalsContact C-N 3.35Å; W423-I425 PolarHBondContact O-N 3.17Å
426	F	91.2	Very high	89.4	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-77.2	-25.5	-177.9	-80.3	-67.1	0	0	0	114.9	M113 L183 I187 L379 E393 R394 F397 L422 W423	M113-F426 HydrophobicContact CE-CD1 3.79Å; M113-F426 HydrophobicContact CE-CE1 4.05Å; L183-F426 HydrophobicContact CD1-CZ 4.38Å; L183-F426 HydrophobicContact CD2-CE2 4.33Å; I187-F426 HydrophobicContact CD1-CZ 3.75Å; I187-F426 HydrophobicContact CG1-CZ 4.25Å; L379-F426 HydrophobicContact CD2-CB 4.06Å; E393-F426 HydrophobicContact CB-CE1 4.27Å; R394-F426 HydrophobicContact CG-CB 4.35Å; R394-F426 HydrophobicContact CG-CD1 4.31Å; R394-F426 PolarHBondContact NE-O 3.41Å; R394-F426 PolarHBondContact NH2-O 3.45Å; F397-F426 HydrophobicContact CB-CD2 4.48Å; F397-F426 HydrophobicContact CD2-CD2 4.34Å; F397-F426 HydrophobicContact CG-CD2 4.19Å; L422-F426 HydrophobicContact CB-CD2 4.31Å; L422-F426 HydrophobicContact CB-CE2 4.45Å; L422-F426 HydrophobicContact CD2-CE2 4.21Å; L422-F426 WeakPolarHBondContact O-CB 3.29Å; L422-F426 WeakPolarHBondContact O-CD2 3.47Å; L422-F426 PolarHBondContact O-N 3.4Å; W423-F426 PolarHBondContact O-N 3.29Å
427	S	84.2	Confident	89.3	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-97.7	-25.7	-166	61.6	0	0	0	0	115.5	T378 W423	T378-S427 VanDerWaalsContact CG2-CB 3.49Å; T378-S427 WeakPolarHBondContact O-CB 3.07Å; T378-S427 VanDerWaalsContact O-O 3.12Å; W423-S427 WeakPolarHBondContact O-CB 3.31Å; W423-S427 PolarHBondContact O-N 3.19Å; W423-S427 PolarHBondContact O-OG 3.23Å
428	L	68.4	Low	89.2	Confident	12 Å²	12	35 Å²	35	6%	0.063	17%	0.165	C	C	.	.			trans	-124.1	48.3	-160.4	-67.6	-175.4	0	0	0	116.9	T378 H430 T431	T378-L428 HydrophobicContact CG2-CD2 3.37Å; T378-L428 HydrophobicContact CG2-CG 4.08Å; L428-H430 PolarHBondContact O-N 3.43Å; L428-T431 WeakPolarHBondContact CB-OG1 3.24Å; L428-T431 VanDerWaalsContact CD2-OG1 3.28Å; L428-T431 WeakPolarHBondContact CD2-OG1 3.49Å
429	S	65.7	Low	89.1	Confident	7 Å²	7	34.2 Å²	34.2	5%	0.049	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-14.5	174.5	78.5	0	0	0	0	114.4	N116 Y383	N116-S429 WeakPolarHBondContact CB-O 3.5Å; N116-S429 PolarHBondContact N-O 2.99Å; N116-S429 PolarHBondContact OD1-O 3Å; Y383-S429 WeakPolarHBondContact CE1-OG 3.14Å; Y383-S429 WeakPolarHBondContact OH-CB 3.42Å; Y383-S429 PolarHBondContact OH-OG 3.22Å
430	H	68	Low	89.1	Confident	108 Å²	108	34.8 Å²	34.8	50%	0.5	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119	4.8	-172.1	-64.8	-53.6	0	0	0	115.3	N116 Y383 L428 H432	N116-H430 WeakPolarHBondContact ND2-CA 3.29Å; Y383-H430 AromaticContact CD1-CD2 3.79Å; Y383-H430 AromaticContact CD1-NE2 3.65Å; Y383-H430 AromaticContact CE1-CD2 3.49Å; Y383-H430 VanDerWaalsContact CE1-CD2 3.49Å; Y383-H430 WeakPolarHBondContact CE1-CD2 3.38Å; Y383-H430 AromaticContact CE1-NE2 3.32Å; Y383-H430 VanDerWaalsContact CE1-NE2 3.32Å; Y383-H430 WeakPolarHBondContact CE1-NE2 3.46Å; L428-H430 PolarHBondContact O-N 3.43Å; H430-H432 PolarHBondContact O-N 2.99Å
431	T	80	Confident	89	Confident	16 Å²	16	39.9 Å²	39.9	10%	0.098	19%	0.191	C	C	.	.			trans	-61.3	129	179.2	-55.2	0	0	0	0	110.6	Q286 L428 Y435 L436	Q286-T431 HydrophobicContact CG-CG2 4.3Å; L428-T431 WeakPolarHBondContact CB-OG1 3.24Å; L428-T431 VanDerWaalsContact CD2-OG1 3.28Å; L428-T431 WeakPolarHBondContact CD2-OG1 3.49Å; T431-Y435 HydrophobicContact CG2-CD2 4.19Å; T431-Y435 HydrophobicContact CG2-CG 4.44Å; T431-L436 HydrophobicContact CG2-CD2 3.85Å; T431-L436 HydrophobicContact CG2-CG 3.86Å
432	H	86	Confident	89.1	Confident	93 Å²	93	43.6 Å²	43.6	43%	0.431	21%	0.205	S	C	.	.			trans	-63.9	137.3	174.7	-168.7	-87	0	0	0	110.2	H430 K434 Y435	H430-H432 PolarHBondContact O-N 2.99Å; H432-K434 PolarHBondContact ND1-N 3.33Å; H432-K434 PolarHBondContact O-N 2.97Å; H432-Y435 HydrophobicContact CB-CD2 3.77Å; H432-Y435 HydrophobicContact CB-CE2 3.99Å; H432-Y435 PolarHBondContact O-N 3.15Å
433	Y	90.2	Very high	89.1	Confident	98 Å²	98	43.6 Å²	43.6	38%	0.384	21%	0.205	S	C	.	.	H	α-helix	trans	-55.5	-32.3	-173.1	78.3	-88.5	0	0	0	114	S117 I120 Y435 L436 L437	S117-Y433 WeakPolarHBondContact OG-CB 3.22Å; I120-Y433 HydrophobicContact CD1-CD2 4.18Å; I120-Y433 HydrophobicContact CD1-CG 4.36Å; Y433-Y435 VanDerWaalsContact C-N 3.31Å; Y433-Y435 PolarHBondContact O-N 3.05Å; Y433-L436 WeakPolarHBondContact O-CB 3.45Å; Y433-L436 PolarHBondContact O-N 3.39Å; Y433-L436 VanDerWaalsContact O-N 3.16Å; Y433-L437 PolarHBondContact O-N 3.43Å
434	K	91.9	Very high	89.2	Confident	121 Å²	121	45.8 Å²	45.8	53%	0.526	22%	0.216	S	C	.	.	H	α-helix	trans	-58.2	-40.4	176.8	-68.7	179.2	-179.7	-178.4	0	112.6	H432 L436 L437 C438	H432-K434 PolarHBondContact ND1-N 3.33Å; H432-K434 PolarHBondContact O-N 2.97Å; K434-L436 VanDerWaalsContact C-N 3.34Å; K434-L437 PolarHBondContact O-N 3.5Å; K434-C438 PolarHBondContact O-N 3.15Å; K434-C438 PolarHBondContact O-SG 2.89Å; K434-C438 VanDerWaalsContact O-SG 3.33Å
435	Y	92.3	Very high	89.4	Confident	110 Å²	110	50 Å²	50	43%	0.431	24%	0.239	S	C	.	.	H	α-helix	trans	-66.4	-40.1	176.8	-62.3	-56.2	0	0	0	111.4	V285 T431 H432 Y433 L437 C438 E439	V285-Y435 HydrophobicContact CB-CD1 4.08Å; V285-Y435 HydrophobicContact CG1-CD1 3.39Å; V285-Y435 HydrophobicContact CG1-CE1 3.63Å; T431-Y435 HydrophobicContact CG2-CD2 4.19Å; T431-Y435 HydrophobicContact CG2-CG 4.44Å; H432-Y435 HydrophobicContact CB-CD2 3.77Å; H432-Y435 HydrophobicContact CB-CE2 3.99Å; H432-Y435 PolarHBondContact O-N 3.15Å; Y433-Y435 VanDerWaalsContact C-N 3.31Å; Y433-Y435 PolarHBondContact O-N 3.05Å; Y435-L437 VanDerWaalsContact C-N 3.33Å; Y435-C438 PolarHBondContact O-N 3.33Å; Y435-E439 WeakPolarHBondContact O-CB 3.42Å; Y435-E439 PolarHBondContact O-N 2.94Å
436	L	94.3	Very high	89.6	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-66.3	-36	175.9	-58.6	172.7	0	0	0	111.7	I120 L121 A124 R424 T431 Y433 K434 E439 V440	I120-L436 HydrophobicContact CB-CB 4.38Å; I120-L436 HydrophobicContact CB-CD1 4.38Å; I120-L436 HydrophobicContact CG2-CB 3.5Å; I120-L436 VanDerWaalsContact CG2-CB 3.5Å; I120-L436 HydrophobicContact CG2-CD1 4.37Å; L121-L436 HydrophobicContact CB-CD1 3.96Å; L121-L436 HydrophobicContact CD1-CD2 3.87Å; A124-L436 HydrophobicContact CB-CD2 4.48Å; R424-L436 VanDerWaalsContact NH2-CD2 3.31Å; T431-L436 HydrophobicContact CG2-CD2 3.85Å; T431-L436 HydrophobicContact CG2-CG 3.86Å; Y433-L436 WeakPolarHBondContact O-CB 3.45Å; Y433-L436 PolarHBondContact O-N 3.39Å; Y433-L436 VanDerWaalsContact O-N 3.16Å; K434-L436 VanDerWaalsContact C-N 3.34Å; L436-E439 WeakPolarHBondContact O-CB 3.46Å; L436-E439 PolarHBondContact O-N 2.73Å; L436-V440 WeakPolarHBondContact O-CG2 3.36Å; L436-V440 PolarHBondContact O-N 2.84Å
437	L	95	Very high	89.9	Confident	89 Å²	89	51.3 Å²	51.3	47%	0.466	25%	0.246	S	C	.	.	H	α-helix	trans	-67	-43.3	175.3	-174.7	63.9	0	0	0	111.6	Y433 K434 Y435 E439 V440 L441	Y433-L437 PolarHBondContact O-N 3.43Å; K434-L437 PolarHBondContact O-N 3.5Å; Y435-L437 VanDerWaalsContact C-N 3.33Å; L437-E439 VanDerWaalsContact C-N 3.25Å; L437-E439 PolarHBondContact O-N 3Å; L437-V440 PolarHBondContact O-N 3.34Å; L437-L441 WeakPolarHBondContact O-CG 3.4Å; L437-L441 PolarHBondContact O-N 2.98Å
438	C	96.2	Very high	90.5	Very high	60 Å²	60	58 Å²	58	41%	0.405	28%	0.275	S	S	.	.	H	α-helix	trans	-60.4	-38	172.8	-66	0	0	0	0	111.8	V285 K434 Y435 L441 W442	V285-C438 HydrophobicContact CG2-CB 3.82Å; K434-C438 PolarHBondContact O-N 3.15Å; K434-C438 PolarHBondContact O-SG 2.89Å; K434-C438 VanDerWaalsContact O-SG 3.33Å; Y435-C438 PolarHBondContact O-N 3.33Å; C438-L441 PolarHBondContact O-N 2.77Å; C438-W442 VanDerWaalsContact O-CB 3.3Å; C438-W442 WeakPolarHBondContact O-CB 3.33Å; C438-W442 PolarHBondContact O-N 3.03Å
439	E	96	Very high	91.9	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-63.2	-44.9	175	-172.2	-179.5	136.9	0	0	112	A124 S282 Q286 R424 Y435 L436 L437 L441 W442 N443	A124-E439 HydrophobicContact CB-CG 4.48Å; S282-E439 WeakPolarHBondContact O-CG 3.33Å; Q286-E439 PolarHBondContact NE2-OE2 3.03Å; R424-E439 VanDerWaalsContact CZ-CD 3.49Å; R424-E439 IonicContact CZ-OE1 3.77Å; R424-E439 IonicContact CZ-OE2 3.05Å; R424-E439 IonicContact NE-OE1 3.5Å; R424-E439 IonicContact NH1-OE1 2.76Å; R424-E439 PolarHBondContact NH1-OE1 3.4Å; R424-E439 IonicContact NH1-OE2 3.38Å; R424-E439 PolarHBondContact NH1-OE2 3.41Å; R424-E439 IonicContact NH2-OE1 3.14Å; R424-E439 PolarHBondContact NH2-OE1 3Å; R424-E439 IonicContact NH2-OE2 3.21Å; R424-E439 PolarHBondContact NH2-OE2 2.8Å; Y435-E439 WeakPolarHBondContact O-CB 3.42Å; Y435-E439 PolarHBondContact O-N 2.94Å; L436-E439 WeakPolarHBondContact O-CB 3.46Å; L436-E439 PolarHBondContact O-N 2.73Å; L437-E439 VanDerWaalsContact C-N 3.25Å; L437-E439 PolarHBondContact O-N 3Å; E439-L441 VanDerWaalsContact C-N 3.34Å; E439-L441 PolarHBondContact O-N 2.76Å; E439-W442 WeakPolarHBondContact O-CB 3.36Å; E439-W442 PolarHBondContact O-N 3.19Å; E439-N443 WeakPolarHBondContact O-CB 3.44Å; E439-N443 PolarHBondContact O-N 3.39Å; E439-N443 PolarHBondContact O-ND2 3.13Å; E439-N443 PolarHBondContact O-OD1 3.15Å
440	V	96.8	Very high	93.4	Very high	13 Å²	13	61.2 Å²	61.2	8%	0.079	29%	0.291	C	S	.	.	H	α-helix	trans	-58.5	-46	174.4	173	0	0	0	0	110.9	I123 A124 L436 L437 N443 L444	I123-V440 HydrophobicContact CG1-CG2 4.49Å; I123-V440 HydrophobicContact CG2-CG2 3.94Å; A124-V440 HydrophobicContact CB-CG2 3.92Å; L436-V440 WeakPolarHBondContact O-CG2 3.36Å; L436-V440 PolarHBondContact O-N 2.84Å; L437-V440 PolarHBondContact O-N 3.34Å; V440-N443 PolarHBondContact O-N 3.09Å; V440-L444 HydrophobicContact CG1-CD1 3.95Å; V440-L444 HydrophobicContact CG1-CG 4.33Å; V440-L444 WeakPolarHBondContact O-CB 3.27Å; V440-L444 VanDerWaalsContact O-CG 3.28Å; V440-L444 WeakPolarHBondContact O-CG 3.34Å; V440-L444 PolarHBondContact O-N 3.44Å
441	L	97.4	Very high	94.8	Very high	108 Å²	108	56.4 Å²	56.4	57%	0.565	27%	0.271	S	S	*	.	H	α-helix	trans	-64.5	-41.4	178.8	-67.3	174.8	0	0	0	112.2	L437 C438 E439 N443 L444 L445	L437-L441 WeakPolarHBondContact O-CG 3.4Å; L437-L441 PolarHBondContact O-N 2.98Å; C438-L441 PolarHBondContact O-N 2.77Å; E439-L441 VanDerWaalsContact C-N 3.34Å; E439-L441 PolarHBondContact O-N 2.76Å; L441-N443 VanDerWaalsContact C-N 3.34Å; L441-L444 PolarHBondContact O-N 3.32Å; L441-L445 WeakPolarHBondContact O-CB 3.14Å; L441-L445 PolarHBondContact O-N 3.5Å
442	W	97.8	Very high	95.6	Very high	78 Å²	78	60.4 Å²	60.4	30%	0.295	28%	0.284	S	S	.	.	H	α-helix	trans	-58.6	-47	174	174.3	-112.4	0	0	0	111.5	F281 P284 C438 E439 L445 I446	F281-W442 HydrophobicContact CD2-CZ2 4.36Å; F281-W442 HydrophobicContact CE1-CZ2 4.04Å; F281-W442 HydrophobicContact CE2-CH2 4.36Å; F281-W442 AromaticContact CE2-CZ2 3.69Å; F281-W442 HydrophobicContact CE2-CZ2 3.69Å; F281-W442 HydrophobicContact CZ-CH2 4.27Å; F281-W442 AromaticContact CZ-CZ2 3.51Å; F281-W442 HydrophobicContact CZ-CZ2 3.51Å; F281-W442 PolarHBondContact O-NE1 2.95Å; P284-W442 HydrophobicContact CG-CD2 4.03Å; P284-W442 HydrophobicContact CG-CG 3.89Å; C438-W442 VanDerWaalsContact O-CB 3.3Å; C438-W442 WeakPolarHBondContact O-CB 3.33Å; C438-W442 PolarHBondContact O-N 3.03Å; E439-W442 WeakPolarHBondContact O-CB 3.36Å; E439-W442 PolarHBondContact O-N 3.19Å; W442-L445 PolarHBondContact O-N 3.45Å; W442-I446 HydrophobicContact CD2-CD1 4.01Å; W442-I446 VanDerWaalsContact CE2-CD1 3.46Å; W442-I446 HydrophobicContact CG-CD1 4.28Å; W442-I446 HydrophobicContact CZ2-CD1 3.82Å; W442-I446 WeakPolarHBondContact O-CG1 3.4Å; W442-I446 PolarHBondContact O-N 3.42Å; W442-I446 VanDerWaalsContact O-N 3.12Å
443	N	98	Very high	96.2	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-64.7	-46.4	179.2	-67.2	-16.9	0	0	0	111.7	A124 S127 P129 E439 V440 L441 L445 I446 V447	A124-N443 PolarHBondContact O-ND2 3.4Å; A124-N443 VanDerWaalsContact O-ND2 3.08Å; S127-N443 WeakPolarHBondContact O-CB 3.21Å; S127-N443 PolarHBondContact OG-ND2 3.03Å; P129-N443 HydrophobicContact CG-CB 4.24Å; E439-N443 WeakPolarHBondContact O-CB 3.44Å; E439-N443 PolarHBondContact O-N 3.39Å; E439-N443 PolarHBondContact O-ND2 3.13Å; E439-N443 PolarHBondContact O-OD1 3.15Å; V440-N443 PolarHBondContact O-N 3.09Å; L441-N443 VanDerWaalsContact C-N 3.34Å; N443-L445 VanDerWaalsContact C-N 3.28Å; N443-L445 PolarHBondContact O-N 3.16Å; N443-I446 PolarHBondContact O-N 3.4Å; N443-I446 VanDerWaalsContact O-N 3.15Å; N443-V447 WeakPolarHBondContact O-CG2 3.49Å; N443-V447 PolarHBondContact O-N 2.95Å
444	L	97	Very high	96.5	Very high	46 Å²	46	53.8 Å²	53.8	24%	0.241	26%	0.259	C	S	.	.	H	α-helix	trans	-61.2	-36.2	177.8	-70	175.9	0	0	0	112.5	F14 I132 V440 L441 F448	F14-L444 HydrophobicContact CE1-CD1 4.38Å; F14-L444 HydrophobicContact CE1-CD2 4.47Å; F14-L444 HydrophobicContact CZ-CD1 4.22Å; I132-L444 HydrophobicContact CD1-CD2 4.12Å; V440-L444 HydrophobicContact CG1-CD1 3.95Å; V440-L444 HydrophobicContact CG1-CG 4.33Å; V440-L444 WeakPolarHBondContact O-CB 3.27Å; V440-L444 VanDerWaalsContact O-CG 3.28Å; V440-L444 WeakPolarHBondContact O-CG 3.34Å; V440-L444 PolarHBondContact O-N 3.44Å; L441-L444 PolarHBondContact O-N 3.32Å; L444-F448 WeakPolarHBondContact O-CB 3.39Å; L444-F448 PolarHBondContact O-N 3.01Å
445	L	97.9	Very high	96.7	Very high	89 Å²	89	48.6 Å²	48.6	47%	0.466	24%	0.236	S	C	.	.	H	α-helix	trans	-62.8	-46.7	173.6	176.1	64	0	0	0	111.5	L441 W442 N443 F448 I449	L441-L445 WeakPolarHBondContact O-CB 3.14Å; L441-L445 PolarHBondContact O-N 3.5Å; W442-L445 PolarHBondContact O-N 3.45Å; N443-L445 VanDerWaalsContact C-N 3.28Å; N443-L445 PolarHBondContact O-N 3.16Å; L445-F448 PolarHBondContact O-N 3.22Å; L445-I449 HydrophobicContact CD1-CD1 4.16Å; L445-I449 HydrophobicContact CG-CD1 4.13Å; L445-I449 WeakPolarHBondContact O-CG1 3.26Å; L445-I449 PolarHBondContact O-N 3.39Å
446	I	97.9	Very high	96.9	Very high	20 Å²	20	48 Å²	48	10%	0.103	24%	0.237	C	C	.	.	H	α-helix	trans	-65.2	-42.9	178.7	-64.6	165.2	0	0	0	110.7	P129 F281 W442 N443 F448 I449 A450 W473	P129-I446 HydrophobicContact CB-CB 4.13Å; P129-I446 HydrophobicContact CB-CG2 3.63Å; P129-I446 HydrophobicContact CG-CB 3.61Å; P129-I446 HydrophobicContact CG-CD1 4.07Å; P129-I446 HydrophobicContact CG-CG1 4.46Å; P129-I446 HydrophobicContact CG-CG2 3.57Å; F281-I446 HydrophobicContact CE1-CD1 3.75Å; F281-I446 HydrophobicContact CZ-CD1 4.16Å; W442-I446 HydrophobicContact CD2-CD1 4.01Å; W442-I446 VanDerWaalsContact CE2-CD1 3.46Å; W442-I446 HydrophobicContact CG-CD1 4.28Å; W442-I446 HydrophobicContact CZ2-CD1 3.82Å; W442-I446 WeakPolarHBondContact O-CG1 3.4Å; W442-I446 PolarHBondContact O-N 3.42Å; W442-I446 VanDerWaalsContact O-N 3.12Å; N443-I446 PolarHBondContact O-N 3.4Å; N443-I446 VanDerWaalsContact O-N 3.15Å; I446-F448 VanDerWaalsContact C-N 3.3Å; I446-F448 PolarHBondContact O-N 3.35Å; I446-I449 PolarHBondContact O-N 2.86Å; I446-A450 WeakPolarHBondContact O-CB 3.32Å; I446-A450 PolarHBondContact O-N 2.88Å; I446-W473 HydrophobicContact CG2-CH2 3.65Å; I446-W473 HydrophobicContact CG2-CZ2 3.66Å
447	V	97.3	Very high	97	Very high	10 Å²	10	53.1 Å²	53.1	6%	0.061	26%	0.259	C	S	.	.	H	α-helix	trans	-56.2	-47.5	174.3	170.5	0	0	0	0	110.5	L22 P129 I132 N443 I449 A450 A451	L22-V447 HydrophobicContact CD2-CG1 4.42Å; P129-V447 HydrophobicContact CB-CG2 4.03Å; P129-V447 HydrophobicContact CG-CG2 4.42Å; I132-V447 HydrophobicContact CB-CG1 4.29Å; I132-V447 HydrophobicContact CB-CG2 3.9Å; I132-V447 HydrophobicContact CD1-CG2 4.19Å; I132-V447 HydrophobicContact CG2-CG1 3.67Å; I132-V447 HydrophobicContact CG2-CG2 4.21Å; N443-V447 WeakPolarHBondContact O-CG2 3.49Å; N443-V447 PolarHBondContact O-N 2.95Å; V447-I449 VanDerWaalsContact C-N 3.35Å; V447-I449 PolarHBondContact O-N 3.34Å; V447-A450 PolarHBondContact O-N 2.96Å; V447-A451 WeakPolarHBondContact O-CB 3.41Å; V447-A451 PolarHBondContact O-N 3.08Å
448	F	97	Very high	97	Very high	139 Å²	139	51.1 Å²	51.1	61%	0.61	25%	0.251	S	S	*	.	H	α-helix	trans	-58.5	-46.8	179.1	176.2	-96.1	0	0	0	111.5	L444 L445 I446 Y452	L444-F448 WeakPolarHBondContact O-CB 3.39Å; L444-F448 PolarHBondContact O-N 3.01Å; L445-F448 PolarHBondContact O-N 3.22Å; I446-F448 VanDerWaalsContact C-N 3.3Å; I446-F448 PolarHBondContact O-N 3.35Å; F448-Y452 WeakPolarHBondContact O-CB 3.41Å; F448-Y452 PolarHBondContact O-N 3.02Å
449	I	97.6	Very high	97	Very high	84 Å²	84	50.2 Å²	50.2	43%	0.431	24%	0.24	S	C	.	.	H	α-helix	trans	-63.1	-49.3	177.9	-65.7	165.8	0	0	0	110.7	L445 I446 V447 A451 Y452 L453	L445-I449 HydrophobicContact CD1-CD1 4.16Å; L445-I449 HydrophobicContact CG-CD1 4.13Å; L445-I449 WeakPolarHBondContact O-CG1 3.26Å; L445-I449 PolarHBondContact O-N 3.39Å; I446-I449 PolarHBondContact O-N 2.86Å; V447-I449 VanDerWaalsContact C-N 3.35Å; V447-I449 PolarHBondContact O-N 3.34Å; I449-A451 PolarHBondContact O-N 3.38Å; I449-Y452 PolarHBondContact O-N 3.41Å; I449-L453 HydrophobicContact CG2-CD1 4.11Å; I449-L453 HydrophobicContact CG2-CG 4.47Å; I449-L453 WeakPolarHBondContact O-CG 3.41Å; I449-L453 PolarHBondContact O-N 3.15Å
450	A	97.2	Very high	96.9	Very high	3 Å²	3	54.7 Å²	54.7	3%	0.025	26%	0.261	C	S	.	.	H	α-helix	trans	-63.3	-42.6	-178	0	0	0	0	0	112	F133 Y345 I446 V447 F454 W473	F133-A450 HydrophobicContact CD2-CB 4.06Å; F133-A450 HydrophobicContact CE2-CB 4.21Å; Y345-A450 HydrophobicContact CE2-CB 4.34Å; I446-A450 WeakPolarHBondContact O-CB 3.32Å; I446-A450 PolarHBondContact O-N 2.88Å; V447-A450 PolarHBondContact O-N 2.96Å; A450-F454 PolarHBondContact O-N 3.32Å; A450-W473 HydrophobicContact CB-CZ2 3.72Å
451	A	97.3	Very high	96.7	Very high	8 Å²	8	56.7 Å²	56.7	7%	0.066	27%	0.267	C	S	.	.	H	α-helix	trans	-65.6	-43.5	175.2	0	0	0	0	0	111.5	L22 V447 I449 L453 F454 I455	L22-A451 HydrophobicContact CD1-CB 3.76Å; V447-A451 WeakPolarHBondContact O-CB 3.41Å; V447-A451 PolarHBondContact O-N 3.08Å; I449-A451 PolarHBondContact O-N 3.38Å; A451-L453 PolarHBondContact O-N 3.25Å; A451-F454 PolarHBondContact O-N 2.75Å; A451-I455 HydrophobicContact CB-CD1 4.33Å; A451-I455 WeakPolarHBondContact O-CB 3.36Å; A451-I455 WeakPolarHBondContact O-CD1 3.34Å; A451-I455 VanDerWaalsContact O-CG1 3.22Å; A451-I455 WeakPolarHBondContact O-CG1 3.47Å; A451-I455 PolarHBondContact O-N 3.06Å
452	Y	97.3	Very high	96.5	Very high	99 Å²	99	57.8 Å²	57.8	39%	0.388	28%	0.281	S	S	.	.	H	α-helix	trans	-58.7	-46.6	176.7	176.2	-89.3	0	0	0	111.7	F448 I449 I455 F456 K457	F448-Y452 WeakPolarHBondContact O-CB 3.41Å; F448-Y452 PolarHBondContact O-N 3.02Å; I449-Y452 PolarHBondContact O-N 3.41Å; Y452-I455 PolarHBondContact O-N 3.35Å; Y452-F456 HydrophobicContact CD2-CB 4.46Å; Y452-F456 AromaticContact CD2-CD2 3.52Å; Y452-F456 HydrophobicContact CD2-CD2 3.52Å; Y452-F456 HydrophobicContact CD2-CE2 4.21Å; Y452-F456 HydrophobicContact CD2-CG 4.38Å; Y452-F456 HydrophobicContact CE2-CB 4.17Å; Y452-F456 AromaticContact CE2-CD2 3.8Å; Y452-F456 HydrophobicContact CE2-CD2 3.8Å; Y452-F456 HydrophobicContact CE2-CG 4.27Å; Y452-F456 HydrophobicContact CG-CD2 4.22Å; Y452-F456 WeakPolarHBondContact O-CB 3.43Å; Y452-F456 PolarHBondContact O-N 3.34Å; Y452-K457 HydrophobicContact CE1-CG 4.09Å
453	L	97.1	Very high	96.2	Very high	52 Å²	52	58.8 Å²	58.8	27%	0.272	30%	0.3	S	S	.	.	H	α-helix	trans	-63	-43.7	177.5	-69.8	177.2	0	0	0	111.6	Y345 I449 A451 K457	Y345-L453 HydrophobicContact CE1-CD1 3.99Å; I449-L453 HydrophobicContact CG2-CD1 4.11Å; I449-L453 HydrophobicContact CG2-CG 4.47Å; I449-L453 WeakPolarHBondContact O-CG 3.41Å; I449-L453 PolarHBondContact O-N 3.15Å; A451-L453 PolarHBondContact O-N 3.25Å; L453-K457 HydrophobicContact CD2-CB 4.26Å; L453-K457 HydrophobicContact CD2-CG 4Å; L453-K457 CarbonylContact O-C 3.59Å; L453-K457 WeakPolarHBondContact O-CA 3.18Å; L453-K457 WeakPolarHBondContact O-CB 3.36Å; L453-K457 PolarHBondContact O-N 2.68Å; L453-K457 VanDerWaalsContact O-N 3.15Å
454	F	97.2	Very high	95.8	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-62	-46.8	176.9	-174.7	-79.7	0	0	0	111.9	F26 Q30 Y34 F133 A450 A451 R470 F471 M472	F26-F454 AromaticContact CD1-CD1 3.29Å; F26-F454 HydrophobicContact CD1-CD1 3.29Å; F26-F454 AromaticContact CD1-CE1 3.16Å; F26-F454 HydrophobicContact CD1-CE1 3.16Å; F26-F454 HydrophobicContact CD1-CE2 4.48Å; F26-F454 HydrophobicContact CD1-CG 4.04Å; F26-F454 AromaticContact CD1-CZ 3.81Å; F26-F454 HydrophobicContact CD1-CZ 3.81Å; F26-F454 HydrophobicContact CE1-CB 3.85Å; F26-F454 AromaticContact CE1-CD1 3.02Å; F26-F454 HydrophobicContact CE1-CD1 3.02Å; F26-F454 AromaticContact CE1-CD2 3.79Å; F26-F454 HydrophobicContact CE1-CD2 3.79Å; F26-F454 AromaticContact CE1-CE1 3.32Å; F26-F454 HydrophobicContact CE1-CE1 3.32Å; F26-F454 HydrophobicContact CE1-CE2 4.03Å; F26-F454 AromaticContact CE1-CG 3.28Å; F26-F454 HydrophobicContact CE1-CG 3.28Å; F26-F454 AromaticContact CE1-CZ 3.81Å; F26-F454 HydrophobicContact CE1-CZ 3.81Å; F26-F454 HydrophobicContact CG-CE1 4.46Å; F26-F454 HydrophobicContact CZ-CB 4.3Å; F26-F454 HydrophobicContact CZ-CD1 4.16Å; F26-F454 HydrophobicContact CZ-CG 4.17Å; Q30-F454 HydrophobicContact CB-CE1 3.96Å; Q30-F454 HydrophobicContact CB-CZ 4.25Å; Q30-F454 HydrophobicContact CG-CE1 4.4Å; Q30-F454 HydrophobicContact CG-CZ 4.19Å; Y34-F454 AromaticContact CD1-CE2 3.77Å; Y34-F454 HydrophobicContact CD1-CE2 3.77Å; Y34-F454 HydrophobicContact CD1-CZ 4.04Å; Y34-F454 AromaticContact CE1-CE2 3.77Å; Y34-F454 HydrophobicContact CE1-CE2 3.77Å; Y34-F454 HydrophobicContact CE1-CZ 4.35Å; Y34-F454 HydrophobicContact CG-CZ 4.4Å; F133-F454 HydrophobicContact CE2-CB 4.19Å; F133-F454 HydrophobicContact CZ-CB 4.24Å; F133-F454 AromaticContact CZ-CD2 3.74Å; F133-F454 HydrophobicContact CZ-CD2 3.74Å; F133-F454 HydrophobicContact CZ-CE2 4.4Å; F133-F454 HydrophobicContact CZ-CG 4.23Å; A450-F454 PolarHBondContact O-N 3.32Å; A451-F454 PolarHBondContact O-N 2.75Å; F454-R470 HydrophobicContact CD1-CB 4.31Å; F454-R470 HydrophobicContact CD2-CB 3.73Å; F454-R470 HydrophobicContact CE1-CB 4.31Å; F454-R470 HydrophobicContact CE1-CG 4.39Å; F454-R470 HydrophobicContact CE2-CB 3.76Å; F454-R470 HydrophobicContact CG-CB 4.03Å; F454-R470 HydrophobicContact CZ-CB 4.07Å; F454-R470 HydrophobicContact CZ-CG 4.46Å; F454-R470 WeakPolarHBondContact O-CD 3.23Å; F454-R470 WeakPolarHBondContact O-CG 3.28Å; F454-R470 PolarHBondContact O-NH1 3.28Å; F454-F471 WeakPolarHBondContact CB-O 3.44Å; F454-F471 VanDerWaalsContact CD2-O 3.27Å; F454-F471 WeakPolarHBondContact CD2-O 3.5Å; F454-M472 HydrophobicContact CD2-CB 4.18Å; F454-M472 HydrophobicContact CE2-CB 4.34Å
455	I	96.3	Very high	95.5	Very high	12 Å²	12	65.6 Å²	65.6	6%	0.062	34%	0.339	C	S	.	.	H	α-helix	trans	-77.5	-49.2	-171.1	-66.2	160.5	0	0	0	111.5	V25 Y29 A451 Y452 R470	V25-I455 HydrophobicContact CB-CD1 4.44Å; V25-I455 HydrophobicContact CG1-CD1 3.53Å; V25-I455 HydrophobicContact CG1-CG1 4.22Å; V25-I455 HydrophobicContact CG1-CG2 4.27Å; Y29-I455 HydrophobicContact CD1-CG2 4.02Å; Y29-I455 HydrophobicContact CD2-CG2 3.51Å; Y29-I455 HydrophobicContact CE1-CG2 4.22Å; Y29-I455 HydrophobicContact CE2-CG2 3.75Å; Y29-I455 HydrophobicContact CG-CG2 3.66Å; A451-I455 HydrophobicContact CB-CD1 4.33Å; A451-I455 WeakPolarHBondContact O-CB 3.36Å; A451-I455 WeakPolarHBondContact O-CD1 3.34Å; A451-I455 VanDerWaalsContact O-CG1 3.22Å; A451-I455 WeakPolarHBondContact O-CG1 3.47Å; A451-I455 PolarHBondContact O-N 3.06Å; Y452-I455 PolarHBondContact O-N 3.35Å; I455-R470 PolarHBondContact O-NH1 2.93Å
456	F	96.3	Very high	95.1	Very high	99 Å²	99	64 Å²	64	43%	0.434	35%	0.345	S	S	.	.	H	α-helix	trans	-108.2	-5.9	-166.4	-59.4	-68.3	0	0	0	114.5	Y29 Y452 P458	Y29-F456 HydrophobicContact CE1-CE1 4.24Å; Y29-F456 HydrophobicContact CE2-CE1 4.47Å; Y29-F456 AromaticContact CZ-CE1 3.85Å; Y452-F456 HydrophobicContact CD2-CB 4.46Å; Y452-F456 AromaticContact CD2-CD2 3.52Å; Y452-F456 HydrophobicContact CD2-CD2 3.52Å; Y452-F456 HydrophobicContact CD2-CE2 4.21Å; Y452-F456 HydrophobicContact CD2-CG 4.38Å; Y452-F456 HydrophobicContact CE2-CB 4.17Å; Y452-F456 AromaticContact CE2-CD2 3.8Å; Y452-F456 HydrophobicContact CE2-CD2 3.8Å; Y452-F456 HydrophobicContact CE2-CG 4.27Å; Y452-F456 HydrophobicContact CG-CD2 4.22Å; Y452-F456 WeakPolarHBondContact O-CB 3.43Å; Y452-F456 PolarHBondContact O-N 3.34Å; F456-P458 WeakPolarHBondContact O-CD 3.46Å
457	K	96.2	Very high	94.8	Very high	106 Å²	106	66.4 Å²	66.4	46%	0.461	36%	0.36	S	S	.	.			trans	-122.1	54.7	176.4	-58.7	-64.9	178.8	-173.8	0	112.5	Y452 L453	Y452-K457 HydrophobicContact CE1-CG 4.09Å; L453-K457 HydrophobicContact CD2-CB 4.26Å; L453-K457 HydrophobicContact CD2-CG 4Å; L453-K457 CarbonylContact O-C 3.59Å; L453-K457 WeakPolarHBondContact O-CA 3.18Å; L453-K457 WeakPolarHBondContact O-CB 3.36Å; L453-K457 PolarHBondContact O-N 2.68Å; L453-K457 VanDerWaalsContact O-N 3.15Å
458	P	95.8	Very high	94.5	Very high	48 Å²	48	70.5 Å²	70.5	31%	0.312	38%	0.378	S	S	.	.			trans	-65.2	159.7	168.4	32	-34.8	0	0	0	110.7	F456 H468 Q469 R470	F456-P458 WeakPolarHBondContact O-CD 3.46Å; P458-H468 HydrophobicContact CB-CB 3.96Å; P458-Q469 CarbonylContact C-O 3.28Å; P458-Q469 WeakPolarHBondContact CA-O 3.38Å; P458-Q469 WeakPolarHBondContact CB-O 3.48Å; P458-R470 HydrophobicContact CB-CG 4.29Å
459	F	95	Very high	94.4	Very high	41 Å²	41	64.2 Å²	64.2	18%	0.18	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	162.7	174.9	62.3	-85.8	0	0	0	109.9	R343 W461 Q469 F471	R343-F459 HydrophobicContact CB-CZ 4.36Å; R343-F459 HydrophobicContact CG-CE2 4.41Å; R343-F459 HydrophobicContact CG-CZ 3.73Å; F459-W461 AromaticContact CE2-CD1 3.94Å; F459-W461 AromaticContact CE2-NE1 3.57Å; F459-Q469 HydrophobicContact CD1-CB 4.42Å; F459-Q469 HydrophobicContact CD2-CB 4.03Å; F459-Q469 HydrophobicContact CE1-CB 4.14Å; F459-Q469 HydrophobicContact CE2-CB 3.73Å; F459-Q469 HydrophobicContact CE2-CG 4.37Å; F459-Q469 HydrophobicContact CG-CB 4.39Å; F459-Q469 HydrophobicContact CZ-CB 3.81Å; F459-Q469 PolarHBondContact N-O 2.91Å; F459-Q469 WeakPolarHBondContact O-CA 3.34Å; F459-Q469 WeakPolarHBondContact O-CB 3.39Å; F459-Q469 PolarHBondContact O-N 3.29Å; F459-F471 HydrophobicContact CD1-CD2 4.02Å; F459-F471 HydrophobicContact CD1-CE1 4.22Å; F459-F471 AromaticContact CD1-CE2 3.51Å; F459-F471 HydrophobicContact CD1-CE2 3.51Å; F459-F471 AromaticContact CD1-CZ 3.63Å; F459-F471 HydrophobicContact CD1-CZ 3.63Å; F459-F471 AromaticContact CE1-CD1 3.81Å; F459-F471 HydrophobicContact CE1-CD1 3.81Å; F459-F471 AromaticContact CE1-CD2 3.87Å; F459-F471 HydrophobicContact CE1-CD2 3.87Å; F459-F471 AromaticContact CE1-CE1 3.5Å; F459-F471 HydrophobicContact CE1-CE1 3.5Å; F459-F471 VanDerWaalsContact CE1-CE1 3.5Å; F459-F471 AromaticContact CE1-CE2 3.59Å; F459-F471 HydrophobicContact CE1-CE2 3.59Å; F459-F471 AromaticContact CE1-CG 3.98Å; F459-F471 HydrophobicContact CE1-CG 3.98Å; F459-F471 AromaticContact CE1-CZ 3.39Å; F459-F471 HydrophobicContact CE1-CZ 3.39Å; F459-F471 HydrophobicContact CG-CZ 4.47Å; F459-F471 HydrophobicContact CZ-CD1 4.41Å; F459-F471 AromaticContact CZ-CE1 3.92Å; F459-F471 HydrophobicContact CZ-CE1 3.92Å; F459-F471 HydrophobicContact CZ-CZ 4.07Å
460	E	94.5	Very high	94.3	Very high	94 Å²	94	60.8 Å²	60.8	44%	0.439	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	147.6	179.9	-66.9	-175.9	-163.1	0	0	110.7	G466 H468	E460-G466 PolarHBondContact OE2-N 3.25Å; E460-H468 IonicContact OE1-CE1 3.76Å; E460-H468 PolarHBondContact OE1-CE1 3.03Å; E460-H468 IonicContact OE1-ND1 3.21Å; E460-H468 PolarHBondContact OE1-ND1 3.36Å
461	W	93.3	Very high	94.2	Very high	54 Å²	54	62.7 Å²	62.7	21%	0.205	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	138.6	169.3	-71.9	-24.9	0	0	0	109.9	N342 R343 F459 S463 Q464 Q469	N342-W461 WeakPolarHBondContact OD1-CZ2 3.5Å; N342-W461 PolarHBondContact OD1-NE1 2.88Å; R343-W461 HydrophobicContact CG-CH2 4.36Å; R343-W461 HydrophobicContact CG-CZ2 3.74Å; F459-W461 AromaticContact CE2-CD1 3.94Å; F459-W461 AromaticContact CE2-NE1 3.57Å; W461-S463 PolarHBondContact O-N 3.36Å; W461-S463 VanDerWaalsContact O-N 3.1Å; W461-Q464 CarbonylContact O-C 3.43Å; W461-Q464 VanDerWaalsContact O-C 3.25Å; W461-Q464 PolarHBondContact O-N 3.09Å; W461-Q469 HydrophobicContact CD2-CG 3.9Å; W461-Q469 HydrophobicContact CE3-CG 4.18Å; W461-Q469 HydrophobicContact CG-CG 4.23Å; W461-Q469 HydrophobicContact CZ2-CG 4.45Å
462	P	92.5	Very high	94.1	Very high	132 Å²	132	62.3 Å²	62.3	86%	0.857	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-27.6	173.1	-25.6	34.4	0	0	0	113.5
463	S	91.7	Very high	93.8	Very high	98 Å²	98	59 Å²	59	69%	0.685	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-16.9	177.4	54.7	0	0	0	0	114.4	W461	W461-S463 PolarHBondContact O-N 3.36Å; W461-S463 VanDerWaalsContact O-N 3.1Å
464	Q	89.8	Confident	93.6	Very high	87 Å²	87	59.4 Å²	59.4	41%	0.407	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	66.1	-178.2	-66	-176.4	-7.5	0	0	110	W461 V467	W461-Q464 CarbonylContact O-C 3.43Å; W461-Q464 VanDerWaalsContact O-C 3.25Å; W461-Q464 PolarHBondContact O-N 3.09Å; Q464-V467 HydrophobicContact CB-CB 4.24Å; Q464-V467 HydrophobicContact CB-CG2 4.26Å; Q464-V467 PolarHBondContact O-N 3.36Å
465	P	89.9	Confident	93.4	Very high	102 Å²	102	62.5 Å²	62.5	66%	0.662	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.2	140.7	-179.1	26.3	-34.3	0	0	0	111.1	V467	P465-V467 PolarHBondContact O-N 3.07Å
466	G	90.6	Very high	93.2	Very high	56 Å²	56	65.3 Å²	65.3	58%	0.577	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	78.9	-4.9	-178.4	0	0	0	0	0	115.4	E460	E460-G466 PolarHBondContact OE2-N 3.25Å
467	V	90.3	Very high	93.1	Very high	71 Å²	71	63.4 Å²	63.4	43%	0.43	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	107.1	172.8	-174.2	0	0	0	0	109.5	Q464 P465 Q469	Q464-V467 HydrophobicContact CB-CB 4.24Å; Q464-V467 HydrophobicContact CB-CG2 4.26Å; Q464-V467 PolarHBondContact O-N 3.36Å; P465-V467 PolarHBondContact O-N 3.07Å; V467-Q469 PolarHBondContact O-N 3.24Å
468	H	92.4	Very high	92.9	Very high	96 Å²	96	60.7 Å²	60.7	44%	0.444	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	110.4	176.8	-66.2	-45	0	0	0	111.9	P458 E460	P458-H468 HydrophobicContact CB-CB 3.96Å; E460-H468 IonicContact OE1-CE1 3.76Å; E460-H468 PolarHBondContact OE1-CE1 3.03Å; E460-H468 IonicContact OE1-ND1 3.21Å; E460-H468 PolarHBondContact OE1-ND1 3.36Å
469	Q	94.5	Very high	92.7	Very high	7 Å²	7	61.5 Å²	61.5	3%	0.033	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	152.1	166.6	-52.4	-58.6	-33.9	0	0	110	R343 P458 F459 W461 V467	R343-Q469 HydrophobicContact CG-CB 4.14Å; R343-Q469 VanDerWaalsContact NH1-OE1 3.12Å; P458-Q469 CarbonylContact C-O 3.28Å; P458-Q469 WeakPolarHBondContact CA-O 3.38Å; P458-Q469 WeakPolarHBondContact CB-O 3.48Å; F459-Q469 HydrophobicContact CD1-CB 4.42Å; F459-Q469 HydrophobicContact CD2-CB 4.03Å; F459-Q469 HydrophobicContact CE1-CB 4.14Å; F459-Q469 HydrophobicContact CE2-CB 3.73Å; F459-Q469 HydrophobicContact CE2-CG 4.37Å; F459-Q469 HydrophobicContact CG-CB 4.39Å; F459-Q469 HydrophobicContact CZ-CB 3.81Å; F459-Q469 PolarHBondContact N-O 2.91Å; F459-Q469 WeakPolarHBondContact O-CA 3.34Å; F459-Q469 WeakPolarHBondContact O-CB 3.39Å; F459-Q469 PolarHBondContact O-N 3.29Å; W461-Q469 HydrophobicContact CD2-CG 3.9Å; W461-Q469 HydrophobicContact CE3-CG 4.18Å; W461-Q469 HydrophobicContact CG-CG 4.23Å; W461-Q469 HydrophobicContact CZ2-CG 4.45Å; V467-Q469 PolarHBondContact O-N 3.24Å
470	R	95.9	Very high	92.5	Very high	12 Å²	12	63 Å²	63	5%	0.045	36%	0.363	C	S	.	.			trans	-135.1	142.8	-174.9	-60.3	-179.5	177.7	-79.2	0.3	111.3	Y29 Y34 F454 I455 P458	Y29-R470 PolarHBondContact O-NH2 3.47Å; Y34-R470 HydrophobicContact CE1-CB 4.37Å; Y34-R470 HydrophobicContact CE2-CB 4.47Å; Y34-R470 WeakPolarHBondContact OH-CA 3.11Å; Y34-R470 PolarHBondContact OH-N 3.17Å; Y34-R470 PolarHBondContact OH-O 3.2Å; F454-R470 HydrophobicContact CD1-CB 4.31Å; F454-R470 HydrophobicContact CD2-CB 3.73Å; F454-R470 HydrophobicContact CE1-CB 4.31Å; F454-R470 HydrophobicContact CE1-CG 4.39Å; F454-R470 HydrophobicContact CE2-CB 3.76Å; F454-R470 HydrophobicContact CG-CB 4.03Å; F454-R470 HydrophobicContact CZ-CB 4.07Å; F454-R470 HydrophobicContact CZ-CG 4.46Å; F454-R470 WeakPolarHBondContact O-CD 3.23Å; F454-R470 WeakPolarHBondContact O-CG 3.28Å; F454-R470 PolarHBondContact O-NH1 3.28Å; I455-R470 PolarHBondContact O-NH1 2.93Å; P458-R470 HydrophobicContact CB-CG 4.29Å
471	F	94.5	Very high	92.4	Very high	43 Å²	43	60.6 Å²	60.6	19%	0.189	36%	0.358	C	S	.	.			trans	-74.9	127.2	177.2	-69.1	-68.5	0	0	0	111.9	N342 R343 Y345 Y348 F454 F459	N342-F471 WeakPolarHBondContact O-CE1 3.34Å; R343-F471 CarbonylContact O-C 3.24Å; R343-F471 VanDerWaalsContact O-CA 3.28Å; R343-F471 WeakPolarHBondContact O-CA 3.34Å; Y345-F471 HydrophobicContact CE1-CB 3.97Å; Y348-F471 HydrophobicContact CE2-CD1 4.09Å; Y348-F471 AromaticContact CE2-CE1 3.49Å; Y348-F471 HydrophobicContact CE2-CE1 3.49Å; Y348-F471 VanDerWaalsContact CE2-CE1 3.49Å; Y348-F471 HydrophobicContact CE2-CZ 4.43Å; Y348-F471 AromaticContact CZ-CE1 3.79Å; F454-F471 WeakPolarHBondContact CB-O 3.44Å; F454-F471 VanDerWaalsContact CD2-O 3.27Å; F454-F471 WeakPolarHBondContact CD2-O 3.5Å; F459-F471 HydrophobicContact CD1-CD2 4.02Å; F459-F471 HydrophobicContact CD1-CE1 4.22Å; F459-F471 AromaticContact CD1-CE2 3.51Å; F459-F471 HydrophobicContact CD1-CE2 3.51Å; F459-F471 AromaticContact CD1-CZ 3.63Å; F459-F471 HydrophobicContact CD1-CZ 3.63Å; F459-F471 AromaticContact CE1-CD1 3.81Å; F459-F471 HydrophobicContact CE1-CD1 3.81Å; F459-F471 AromaticContact CE1-CD2 3.87Å; F459-F471 HydrophobicContact CE1-CD2 3.87Å; F459-F471 AromaticContact CE1-CE1 3.5Å; F459-F471 HydrophobicContact CE1-CE1 3.5Å; F459-F471 VanDerWaalsContact CE1-CE1 3.5Å; F459-F471 AromaticContact CE1-CE2 3.59Å; F459-F471 HydrophobicContact CE1-CE2 3.59Å; F459-F471 AromaticContact CE1-CG 3.98Å; F459-F471 HydrophobicContact CE1-CG 3.98Å; F459-F471 AromaticContact CE1-CZ 3.39Å; F459-F471 HydrophobicContact CE1-CZ 3.39Å; F459-F471 HydrophobicContact CG-CZ 4.47Å; F459-F471 HydrophobicContact CZ-CD1 4.41Å; F459-F471 AromaticContact CZ-CE1 3.92Å; F459-F471 HydrophobicContact CZ-CE1 3.92Å; F459-F471 HydrophobicContact CZ-CZ 4.07Å
472	M	94.4	Very high	92.3	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-135.3	174.4	172	66.1	176	-85.4	0	0	112.3	Y34 M35 F133 F134 L137 R343 H344 Y345 F454	Y34-M472 HydrophobicContact CD1-SD 3.67Å; Y34-M472 HydrophobicContact CE1-CG 4.11Å; Y34-M472 HydrophobicContact CE1-SD 3.59Å; Y34-M472 VanDerWaalsContact CE1-SD 3.59Å; M35-M472 HydrophobicContact CE-CG 3.77Å; M35-M472 HydrophobicContact CE-SD 3.91Å; M35-M472 HydrophobicContact CG-SD 4.28Å; M35-M472 HydrophobicContact SD-CE 4.25Å; M35-M472 HydrophobicContact SD-CG 3.89Å; M35-M472 HydrophobicContact SD-SD 3.28Å; F133-M472 HydrophobicContact CE1-CB 3.76Å; F133-M472 HydrophobicContact CZ-CB 3.73Å; F134-M472 HydrophobicContact CE1-CE 3.61Å; F134-M472 HydrophobicContact CZ-CE 3.8Å; L137-M472 HydrophobicContact CD1-CE 4.09Å; L137-M472 HydrophobicContact CD1-SD 4.37Å; R343-M472 PolarHBondContact O-N 3.03Å; H344-M472 CarbonylContact C-O 3.22Å; H344-M472 VanDerWaalsContact CA-O 3.3Å; H344-M472 WeakPolarHBondContact CA-O 3.39Å; Y345-M472 VanDerWaalsContact CD2-O 3.22Å; Y345-M472 WeakPolarHBondContact CD2-O 3.4Å; Y345-M472 PolarHBondContact N-O 3.04Å; F454-M472 HydrophobicContact CD2-CB 4.18Å; F454-M472 HydrophobicContact CE2-CB 4.34Å
473	W	90.9	Very high	92.3	Very high	30 Å²	30	54.7 Å²	54.7	11%	0.114	33%	0.326	C	S	.	.			trans	-66.5	0	-179.2	-68.4	111.5	0	0	0	114.7	P129 L130 F133 F134 H344 Y345 L413 I446 A450	P129-W473 HydrophobicContact CB-CZ2 3.89Å; L130-W473 HydrophobicContact CD2-CB 3.37Å; L130-W473 HydrophobicContact CD2-CD2 3.77Å; L130-W473 HydrophobicContact CD2-CE3 4.19Å; L130-W473 HydrophobicContact CD2-CG 3.41Å; L130-W473 VanDerWaalsContact CD2-CG 3.41Å; L130-W473 HydrophobicContact CG-CD2 4.23Å; L130-W473 HydrophobicContact CG-CG 4.21Å; F133-W473 AromaticContact CD1-CD1 3.5Å; F133-W473 AromaticContact CD2-CD1 3.79Å; F133-W473 AromaticContact CD2-NE1 3.62Å; F133-W473 AromaticContact CG-CD1 3.36Å; F133-W473 AromaticContact CG-NE1 3.53Å; F134-W473 HydrophobicContact CE2-CB 3.82Å; F134-W473 HydrophobicContact CE2-CG 4.47Å; F134-W473 HydrophobicContact CZ-CB 4.13Å; H344-W473 PolarHBondContact CD2-O 3.33Å; Y345-W473 AromaticContact CD2-CD2 3.77Å; Y345-W473 HydrophobicContact CD2-CD2 3.77Å; Y345-W473 AromaticContact CD2-CE3 3.55Å; Y345-W473 HydrophobicContact CD2-CE3 3.55Å; Y345-W473 HydrophobicContact CD2-CG 4.23Å; Y345-W473 HydrophobicContact CD2-CZ3 4Å; Y345-W473 HydrophobicContact CE2-CD2 4.09Å; Y345-W473 HydrophobicContact CE2-CE3 4.26Å; Y345-W473 HydrophobicContact CE2-CG 4.44Å; Y345-W473 HydrophobicContact CG-CE3 4.38Å; L413-W473 HydrophobicContact CD1-CE3 3.83Å; L413-W473 HydrophobicContact CD1-CZ3 4.01Å; I446-W473 HydrophobicContact CG2-CH2 3.65Å; I446-W473 HydrophobicContact CG2-CZ2 3.66Å; A450-W473 HydrophobicContact CB-CZ2 3.72Å

Retrieved 473 of 473 residues in 641.6 ms (Link to these results)

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