A0A077Z080_TRITR Loading...

Cytochrome c oxidase assembly protein COX15

AlphaFold DB , UniProt , Accession A0A077Z080, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 312 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] 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
1M67.1Low68.7Low23 Ų2386.3 Ų86.311%0.11340%0.401CS..  0114.10-175.9-170.4-17300109.5D3 G9 E53 R57M1-D3 WeakPolarHBondContact CE-O 3.28Å; M1-G9 WeakPolarHBondContact CE-O 3.49Å; M1-E53 HydrophobicContact CB-CG 4.14Å; M1-R57 PolarHBondContact O-NH2 3.39Å; M1-R57 PolarHBondContact SD-NH1 3.4Å
2V68.6Low70.3Confident11 Ų1183 Ų837%0.06739%0.393CS..  trans-91.8-33-175-64.60000112.4K25 Y26 Y29 L110V2-K25 HydrophobicContact CG2-CD 3.57Å; V2-K25 HydrophobicContact CG2-CG 3.94Å; V2-Y26 HydrophobicContact CG1-CD2 4.14Å; V2-Y29 HydrophobicContact CB-CD2 4.31Å; V2-Y29 HydrophobicContact CB-CE2 3.64Å; V2-Y29 HydrophobicContact CG1-CD2 3.6Å; V2-Y29 HydrophobicContact CG1-CE2 3.44Å; V2-Y29 VanDerWaalsContact CG1-CE2 3.44Å; V2-Y29 HydrophobicContact CG1-CG 4.34Å; V2-Y29 HydrophobicContact CG2-CE2 3.74Å; V2-L110 HydrophobicContact CB-CD1 4.32Å; V2-L110 HydrophobicContact CB-CD2 4.15Å; V2-L110 HydrophobicContact CG1-CD2 3.97Å; V2-L110 WeakPolarHBondContact O-CD1 3.4Å
3D72.8Confident71.7Confident50 Ų5078.2 Ų78.227%0.26737%0.373SS..  trans-74138.9177.3-68.3-28.9000111.6M1 H5 K25 R57M1-D3 WeakPolarHBondContact CE-O 3.28Å; D3-H5 WeakPolarHBondContact CB-ND1 3.49Å; D3-H5 IonicContact OD2-CE1 2.83Å; D3-K25 IonicContact OD1-NZ 2.84Å; D3-K25 PolarHBondContact OD1-NZ 3.38Å; D3-K25 IonicContact OD2-NZ 3.32Å; D3-K25 PolarHBondContact OD2-NZ 2.89Å; D3-R57 PolarHBondContact O-NH1 3.39Å
4W67.4Low73Confident96 Ų9680.4 Ų80.436%0.36439%0.394SS..  trans-110.693.9168.1-161.497.9000108.9V6 W103W4-V6 HydrophobicContact CH2-CG2 3.93Å; W4-V6 HydrophobicContact CZ3-CG2 3.62Å; W4-W103 HydrophobicContact CD2-CB 4.14Å; W4-W103 AromaticContact CD2-CD1 3.58Å; W4-W103 HydrophobicContact CD2-CG 4.24Å; W4-W103 AromaticContact CE3-CD1 3.6Å; W4-W103 HydrophobicContact CE3-CG 4.37Å; W4-W103 AromaticContact CG-CD1 3.83Å; W4-W103 HydrophobicContact CH2-CB 4.48Å; W4-W103 HydrophobicContact CZ2-CB 4.01Å
5H70.6Confident74.4Confident76 Ų7678.3 Ų78.335%0.35239%0.39SS..  trans-116.5133.2172.1-64.5109.9000109.4D3 I7 R8 R61D3-H5 WeakPolarHBondContact CB-ND1 3.49Å; D3-H5 IonicContact OD2-CE1 2.83Å; H5-I7 VanDerWaalsContact C-N 3.32Å; H5-I7 PolarHBondContact O-N 3.14Å; H5-R8 HydrophobicContact CB-CB 3.94Å; H5-R61 PolarHBondContact O-NH2 2.87Å
6V63Low75.5Confident94 Ų9483.1 Ų83.157%0.5741%0.411SS*.SBendtrans-59.1-44.5178.7-176.90000111.2W4 R61W4-V6 HydrophobicContact CH2-CG2 3.93Å; W4-V6 HydrophobicContact CZ3-CG2 3.62Å; V6-R61 PolarHBondContact O-NH1 3.45Å
7I61.9Low76.6Confident119 Ų11982.3 Ų82.361%0.6142%0.421SS*.SBendtrans-118.4-49.5-175-60.1177.6000111.5H5 G9 M10H5-I7 VanDerWaalsContact C-N 3.32Å; H5-I7 PolarHBondContact O-N 3.14Å; I7-G9 PolarHBondContact O-N 3.46Å; I7-M10 HydrophobicContact CB-CE 4.11Å; I7-M10 HydrophobicContact CG2-CE 3.51Å; I7-M10 WeakPolarHBondContact O-CB 3.41Å; I7-M10 WeakPolarHBondContact O-CE 3.33Å; I7-M10 VanDerWaalsContact O-CG 3.25Å; I7-M10 WeakPolarHBondContact O-CG 3.3Å; I7-M10 PolarHBondContact O-N 3.01Å
8R59.1Low77.5Confident220 Ų22080.8 Ų80.883%0.8341%0.414SS*.G310 helixtrans-61.1-25.1-170.9-66.5-176.5179.1178.1-0.6114.7H5 M10H5-R8 HydrophobicContact CB-CB 3.94Å; R8-M10 VanDerWaalsContact C-N 3.33Å; R8-M10 PolarHBondContact O-N 3.14Å
9G67.9Low78.4Confident10 Ų1077.5 Ų77.510%0.10340%0.396CS..G310 helixtrans-89.615.1178.600000114.7M1 I7M1-G9 WeakPolarHBondContact CE-O 3.49Å; I7-G9 PolarHBondContact O-N 3.46Å
10M74.4Confident79.3Confident84 Ų8477.5 Ų77.541%0.41440%0.395SS..G310 helixtrans-80.7-22.7-179.7-71.7-173.6-54.900113.8I7 R8 P12 Y54 M58I7-M10 HydrophobicContact CB-CE 4.11Å; I7-M10 HydrophobicContact CG2-CE 3.51Å; I7-M10 WeakPolarHBondContact O-CB 3.41Å; I7-M10 WeakPolarHBondContact O-CE 3.33Å; I7-M10 VanDerWaalsContact O-CG 3.25Å; I7-M10 WeakPolarHBondContact O-CG 3.3Å; I7-M10 PolarHBondContact O-N 3.01Å; R8-M10 VanDerWaalsContact C-N 3.33Å; R8-M10 PolarHBondContact O-N 3.14Å; M10-P12 WeakPolarHBondContact O-CD 3.44Å; M10-Y54 VanDerWaalsContact O-CE2 3.29Å; M10-Y54 WeakPolarHBondContact O-CE2 3.36Å; M10-Y54 PolarHBondContact O-OH 3.33Å; M10-M58 HydrophobicContact CB-SD 4.43Å; M10-M58 HydrophobicContact CG-SD 4.07Å
11K82.6Confident79.9Confident166 Ų16680.5 Ų80.572%0.72241%0.407SS*.SBendtrans-83.2119.8178.6-171-178.6176.9-171.70109.5
12P87.5Confident81.1Confident47 Ų4780.9 Ų80.931%0.30541%0.409SS..PPolyproline II helixtrans-74.6155.1175.131.8-33.5000111.6M10 V14 W50 Y54M10-P12 WeakPolarHBondContact O-CD 3.44Å; P12-V14 WeakPolarHBondContact O-CG2 3.45Å; P12-V14 PolarHBondContact O-N 2.79Å; P12-W50 HydrophobicContact CB-CH2 3.6Å; P12-W50 HydrophobicContact CB-CZ3 3.79Å; P12-Y54 HydrophobicContact CB-CE2 4.33Å
13P89.1Confident82.3Confident20 Ų2081 Ų8113%0.1341%0.409CS..PPolyproline II helixtrans-55.1128.3167-24.434.4000110.2D18 W19 E22 W50P13-D18 HydrophobicContact CB-CB 3.61Å; P13-W19 HydrophobicContact CB-CD2 3.68Å; P13-W19 HydrophobicContact CB-CE3 3.99Å; P13-W19 HydrophobicContact CB-CG 4.06Å; P13-W19 HydrophobicContact CB-CH2 4.31Å; P13-W19 HydrophobicContact CB-CZ2 4.01Å; P13-W19 HydrophobicContact CB-CZ3 4.29Å; P13-W19 HydrophobicContact CG-CD2 4.31Å; P13-W19 HydrophobicContact CG-CE3 4.1Å; P13-W19 HydrophobicContact CG-CH2 4.22Å; P13-W19 HydrophobicContact CG-CZ2 4.4Å; P13-W19 HydrophobicContact CG-CZ3 4.06Å; P13-W19 PolarHBondContact O-NE1 3.3Å; P13-E22 HydrophobicContact CG-CB 4.47Å; P13-W50 HydrophobicContact CG-CH2 4.4Å; P13-W50 HydrophobicContact CG-CZ2 4.01Å
14V89.5Confident83.3Confident110 Ų11082.1 Ų82.167%0.66742%0.415SS*.  trans-114.6-39-178-1730000110.6P12 D18P12-V14 WeakPolarHBondContact O-CG2 3.45Å; P12-V14 PolarHBondContact O-N 2.79Å; V14-D18 PolarHBondContact N-OD2 2.84Å
15S93.7Very high84.4Confident49 Ų4980 Ų8034%0.34341%0.408SS..SBendtrans-86.6159.417882.30000112A17 D18 W19S15-A17 VanDerWaalsContact C-N 3.25Å; S15-A17 PolarHBondContact O-N 3.08Å; S15-A17 PolarHBondContact OG-N 3.04Å; S15-D18 PolarHBondContact N-OD2 3.02Å; S15-D18 PolarHBondContact O-N 2.91Å; S15-D18 PolarHBondContact OG-N 3.1Å; S15-D18 PolarHBondContact OG-OD1 2.76Å; S15-D18 PolarHBondContact OG-OD2 3.14Å; S15-W19 PolarHBondContact O-N 3.29Å; S15-W19 VanDerWaalsContact O-N 3.16Å
16E93.4Very high85.3Confident154 Ų15476.7 Ų76.772%0.7239%0.393SS*.Hα-helixtrans-60.2-38.1171.6-174.5171.3-169.300111.8D18 W19 M20E16-D18 PolarHBondContact O-N 2.97Å; E16-W19 PolarHBondContact O-N 3.32Å; E16-M20 WeakPolarHBondContact O-CG 3.42Å; E16-M20 PolarHBondContact O-N 2.92Å
17A94.2Very high86.6Confident70 Ų7075.5 Ų75.558%0.57938%0.38SS*.Hα-helixtrans-61.9-41.7175.300000112.3S15 W19 M20 Q21S15-A17 VanDerWaalsContact C-N 3.25Å; S15-A17 PolarHBondContact O-N 3.08Å; S15-A17 PolarHBondContact OG-N 3.04Å; A17-W19 VanDerWaalsContact C-N 3.3Å; A17-W19 PolarHBondContact O-N 3.09Å; A17-M20 PolarHBondContact O-N 3.01Å; A17-Q21 WeakPolarHBondContact O-CB 3.32Å; A17-Q21 PolarHBondContact O-N 3.11Å
18D92.1Very high87.8Confident56 Ų5676.6 Ų76.630%0.29938%0.382SS..Hα-helixtrans-61.2-42.2175.9-55.2-16.9000110.6P13 V14 S15 E16 E22P13-D18 HydrophobicContact CB-CB 3.61Å; V14-D18 PolarHBondContact N-OD2 2.84Å; S15-D18 PolarHBondContact N-OD2 3.02Å; S15-D18 PolarHBondContact O-N 2.91Å; S15-D18 PolarHBondContact OG-N 3.1Å; S15-D18 PolarHBondContact OG-OD1 2.76Å; S15-D18 PolarHBondContact OG-OD2 3.14Å; E16-D18 PolarHBondContact O-N 2.97Å; D18-E22 WeakPolarHBondContact O-CB 3.44Å; D18-E22 PolarHBondContact O-N 2.94Å
19W94.8Very high88.9Confident18 Ų1868.3 Ų68.37%0.06835%0.351CS..Hα-helixtrans-65.6-42.3178.5-81114.1000112.2P13 S15 E16 A17 E22 F23 L43 F46 K47 W50 R51P13-W19 HydrophobicContact CB-CD2 3.68Å; P13-W19 HydrophobicContact CB-CE3 3.99Å; P13-W19 HydrophobicContact CB-CG 4.06Å; P13-W19 HydrophobicContact CB-CH2 4.31Å; P13-W19 HydrophobicContact CB-CZ2 4.01Å; P13-W19 HydrophobicContact CB-CZ3 4.29Å; P13-W19 HydrophobicContact CG-CD2 4.31Å; P13-W19 HydrophobicContact CG-CE3 4.1Å; P13-W19 HydrophobicContact CG-CH2 4.22Å; P13-W19 HydrophobicContact CG-CZ2 4.4Å; P13-W19 HydrophobicContact CG-CZ3 4.06Å; P13-W19 PolarHBondContact O-NE1 3.3Å; S15-W19 PolarHBondContact O-N 3.29Å; S15-W19 VanDerWaalsContact O-N 3.16Å; E16-W19 PolarHBondContact O-N 3.32Å; A17-W19 VanDerWaalsContact C-N 3.3Å; A17-W19 PolarHBondContact O-N 3.09Å; W19-E22 PolarHBondContact O-N 3.32Å; W19-F23 VanDerWaalsContact O-CB 3.26Å; W19-F23 WeakPolarHBondContact O-CB 3.35Å; W19-F23 PolarHBondContact O-N 3.41Å; W19-L43 HydrophobicContact CB-CD1 4.42Å; W19-F46 HydrophobicContact CE3-CE1 4.19Å; W19-F46 HydrophobicContact CZ3-CE1 4.38Å; W19-K47 HydrophobicContact CD2-CD 4.35Å; W19-K47 HydrophobicContact CD2-CG 3.83Å; W19-K47 HydrophobicContact CE3-CG 3.65Å; W19-K47 HydrophobicContact CH2-CG 4.16Å; W19-K47 HydrophobicContact CZ2-CG 4.32Å; W19-K47 HydrophobicContact CZ3-CB 4.43Å; W19-K47 HydrophobicContact CZ3-CG 3.83Å; W19-W50 HydrophobicContact CH2-CB 4.48Å; W19-W50 AromaticContact CH2-CD2 3.88Å; W19-W50 HydrophobicContact CH2-CD2 3.88Å; W19-W50 AromaticContact CH2-CE3 3.52Å; W19-W50 HydrophobicContact CH2-CE3 3.52Å; W19-W50 HydrophobicContact CH2-CG 4.29Å; W19-W50 HydrophobicContact CH2-CZ3 4.13Å; W19-W50 HydrophobicContact CZ3-CB 4.02Å; W19-W50 AromaticContact CZ3-CD2 3.84Å; W19-W50 HydrophobicContact CZ3-CD2 3.84Å; W19-W50 AromaticContact CZ3-CE3 3.99Å; W19-W50 HydrophobicContact CZ3-CE3 3.99Å; W19-W50 AromaticContact CZ3-CG 3.84Å; W19-W50 HydrophobicContact CZ3-CG 3.84Å; W19-R51 HydrophobicContact CH2-CG 4.44Å
20M95.4Very high89.6Confident76 Ų7668.8 Ų68.837%0.37435%0.353SS..Hα-helixtrans-64.3-45.1176.7-71.9-59.1-65.600111.4E16 A17 E22 F23 D24 L43E16-M20 WeakPolarHBondContact O-CG 3.42Å; E16-M20 PolarHBondContact O-N 2.92Å; A17-M20 PolarHBondContact O-N 3.01Å; M20-E22 VanDerWaalsContact C-N 3.32Å; M20-E22 PolarHBondContact O-N 2.84Å; M20-F23 PolarHBondContact O-N 3.46Å; M20-D24 WeakPolarHBondContact O-CB 3.34Å; M20-D24 PolarHBondContact O-N 2.97Å; M20-L43 HydrophobicContact SD-CD1 4.46Å; M20-L43 HydrophobicContact SD-CD2 4.03Å
21Q92.4Very high90.1Very high141 Ų14168.1 Ų68.166%0.65935%0.349SS*.Hα-helixtrans-57.5-46176.4-176.1-179.422.600111.7A17 D24 K25A17-Q21 WeakPolarHBondContact O-CB 3.32Å; A17-Q21 PolarHBondContact O-N 3.11Å; Q21-D24 PolarHBondContact O-N 3.43Å; Q21-K25 WeakPolarHBondContact O-CB 3.47Å; Q21-K25 PolarHBondContact O-N 3.39Å
22E91.9Very high90.3Very high32 Ų3261.7 Ų61.715%0.1532%0.32CS..Hα-helixtrans-74.8-28.9-177-161.365.1161.900112.4P13 D18 W19 M20 K25 Y26 F46P13-E22 HydrophobicContact CG-CB 4.47Å; D18-E22 WeakPolarHBondContact O-CB 3.44Å; D18-E22 PolarHBondContact O-N 2.94Å; W19-E22 PolarHBondContact O-N 3.32Å; M20-E22 VanDerWaalsContact C-N 3.32Å; M20-E22 PolarHBondContact O-N 2.84Å; E22-K25 WeakPolarHBondContact OE2-CD 3.23Å; E22-Y26 WeakPolarHBondContact O-CB 3.33Å; E22-Y26 PolarHBondContact O-N 3.46Å; E22-F46 HydrophobicContact CB-CE1 4.48Å; E22-F46 HydrophobicContact CB-CZ 4.43Å; E22-F46 HydrophobicContact CG-CZ 4.18Å; E22-F46 WeakPolarHBondContact O-CZ 3.21Å
23F94.5Very high90.2Very high13 Ų1366 Ų666%0.05733%0.334CS..Hα-helixtrans-69.8-43.6171.2-175.2-141.4000111.6W19 M20 K25 Y26 K27 Y32 M41 L43 F46W19-F23 VanDerWaalsContact O-CB 3.26Å; W19-F23 WeakPolarHBondContact O-CB 3.35Å; W19-F23 PolarHBondContact O-N 3.41Å; M20-F23 PolarHBondContact O-N 3.46Å; F23-K25 VanDerWaalsContact C-N 3.27Å; F23-K25 PolarHBondContact O-N 2.89Å; F23-Y26 HydrophobicContact CD2-CD1 4.48Å; F23-Y26 WeakPolarHBondContact O-CA 3.49Å; F23-Y26 WeakPolarHBondContact O-CB 3.16Å; F23-Y26 PolarHBondContact O-N 3.23Å; F23-K27 HydrophobicContact CE2-CG 4.39Å; F23-K27 WeakPolarHBondContact O-CG 3.42Å; F23-K27 PolarHBondContact O-N 3.24Å; F23-Y32 HydrophobicContact CE2-CD2 4.12Å; F23-Y32 AromaticContact CE2-CE2 3.71Å; F23-Y32 HydrophobicContact CE2-CE2 3.71Å; F23-Y32 AromaticContact CZ-CE2 3.85Å; F23-Y32 HydrophobicContact CZ-CE2 3.85Å; F23-M41 WeakPolarHBondContact CZ-O 3.41Å; F23-L43 HydrophobicContact CB-CD1 3.78Å; F23-L43 HydrophobicContact CD1-CD1 3.8Å; F23-L43 HydrophobicContact CG-CD1 3.87Å; F23-F46 HydrophobicContact CB-CD1 3.73Å; F23-F46 HydrophobicContact CB-CE1 3.73Å; F23-F46 HydrophobicContact CB-CG 4.43Å; F23-F46 HydrophobicContact CB-CZ 4.45Å; F23-F46 HydrophobicContact CD2-CB 3.72Å; F23-F46 AromaticContact CD2-CD1 3.68Å; F23-F46 HydrophobicContact CD2-CD1 3.68Å; F23-F46 AromaticContact CD2-CD2 3.99Å; F23-F46 HydrophobicContact CD2-CD2 3.99Å; F23-F46 HydrophobicContact CD2-CE1 4.26Å; F23-F46 AromaticContact CD2-CG 3.5Å; F23-F46 HydrophobicContact CD2-CG 3.5Å; F23-F46 VanDerWaalsContact CD2-CG 3.5Å; F23-F46 HydrophobicContact CE2-CB 3.85Å; F23-F46 HydrophobicContact CE2-CG 4.11Å; F23-F46 AromaticContact CG-CD1 3.97Å; F23-F46 HydrophobicContact CG-CD1 3.97Å; F23-F46 HydrophobicContact CG-CE1 4.41Å; F23-F46 HydrophobicContact CG-CG 4.25Å
24D93.5Very high89.9Confident74 Ų7469.8 Ų69.840%0.39635%0.346SS..Hα-helixtrans-63.3-36.1175.8-71.9-24.4000111.9M20 Q21 K27M20-D24 WeakPolarHBondContact O-CB 3.34Å; M20-D24 PolarHBondContact O-N 2.97Å; Q21-D24 PolarHBondContact O-N 3.43Å; D24-K27 PolarHBondContact O-N 2.93Å; D24-K27 IonicContact OD1-NZ 3.55Å; D24-K27 PolarHBondContact OD1-NZ 3.06Å
25K89.9Confident89.6Confident50 Ų5069.4 Ų69.422%0.21734%0.336CS..Hα-helixtrans-62.2-44.4169.2-171.1179.5-173.8172.50111.7V2 D3 Q21 E22 F23 K27 Q28 Y29V2-K25 HydrophobicContact CG2-CD 3.57Å; V2-K25 HydrophobicContact CG2-CG 3.94Å; D3-K25 IonicContact OD1-NZ 2.84Å; D3-K25 PolarHBondContact OD1-NZ 3.38Å; D3-K25 IonicContact OD2-NZ 3.32Å; D3-K25 PolarHBondContact OD2-NZ 2.89Å; Q21-K25 WeakPolarHBondContact O-CB 3.47Å; Q21-K25 PolarHBondContact O-N 3.39Å; E22-K25 WeakPolarHBondContact OE2-CD 3.23Å; F23-K25 VanDerWaalsContact C-N 3.27Å; F23-K25 PolarHBondContact O-N 2.89Å; K25-K27 VanDerWaalsContact C-N 3.32Å; K25-K27 PolarHBondContact O-N 3.27Å; K25-Q28 WeakPolarHBondContact O-CB 3.45Å; K25-Q28 PolarHBondContact O-N 3.41Å; K25-Y29 HydrophobicContact CG-CE2 4.3Å; K25-Y29 VanDerWaalsContact O-CD2 3.29Å; K25-Y29 WeakPolarHBondContact O-CD2 3.29Å; K25-Y29 WeakPolarHBondContact O-CE2 3.31Å
26Y89.4Confident89.4Confident8 Ų868 Ų683%0.03133%0.326CS..Hα-helixtrans-62.3-37.1178.8-176.1-109.5000112.9V2 E22 F23 Q28 Y29 E31 Y32 M41 F46V2-Y26 HydrophobicContact CG1-CD2 4.14Å; E22-Y26 WeakPolarHBondContact O-CB 3.33Å; E22-Y26 PolarHBondContact O-N 3.46Å; F23-Y26 HydrophobicContact CD2-CD1 4.48Å; F23-Y26 WeakPolarHBondContact O-CA 3.49Å; F23-Y26 WeakPolarHBondContact O-CB 3.16Å; F23-Y26 PolarHBondContact O-N 3.23Å; Y26-Q28 PolarHBondContact O-N 3.03Å; Y26-Q28 VanDerWaalsContact O-N 3.11Å; Y26-Y29 PolarHBondContact O-N 3.37Å; Y26-E31 WeakPolarHBondContact CE2-OE2 3.4Å; Y26-E31 WeakPolarHBondContact OH-CG 3.43Å; Y26-E31 PolarHBondContact OH-OE2 3.45Å; Y26-Y32 AromaticContact CD1-CD2 3.86Å; Y26-Y32 HydrophobicContact CD1-CD2 3.86Å; Y26-Y32 HydrophobicContact CD1-CG 4.33Å; Y26-Y32 AromaticContact CE1-CD2 3.96Å; Y26-Y32 HydrophobicContact CE1-CD2 3.96Å; Y26-Y32 HydrophobicContact CE1-CG 4.39Å; Y26-M41 HydrophobicContact CD1-SD 4.38Å; Y26-M41 HydrophobicContact CE1-CE 3.97Å; Y26-M41 HydrophobicContact CE1-SD 3.76Å; Y26-F46 AromaticContact CD1-CD2 3.52Å; Y26-F46 HydrophobicContact CD1-CD2 3.52Å; Y26-F46 AromaticContact CD1-CE2 3.76Å; Y26-F46 HydrophobicContact CD1-CE2 3.76Å; Y26-F46 HydrophobicContact CD2-CD2 4.36Å; Y26-F46 AromaticContact CD2-CE2 3.89Å; Y26-F46 HydrophobicContact CD2-CE2 3.89Å; Y26-F46 HydrophobicContact CE1-CD2 4.05Å; Y26-F46 AromaticContact CG-CD2 3.7Å; Y26-F46 HydrophobicContact CG-CD2 3.7Å; Y26-F46 AromaticContact CG-CE2 3.39Å; Y26-F46 HydrophobicContact CG-CE2 3.39Å; Y26-F46 HydrophobicContact CG-CZ 4.39Å
27K90.7Very high89Confident69 Ų6964.4 Ų64.430%0.332%0.318SS..Hα-helixtrans-57.4-24.7176.5-69.9176.4-172.1158.40114F23 D24 K25 Y29 Y32F23-K27 HydrophobicContact CE2-CG 4.39Å; F23-K27 WeakPolarHBondContact O-CG 3.42Å; F23-K27 PolarHBondContact O-N 3.24Å; D24-K27 PolarHBondContact O-N 2.93Å; D24-K27 IonicContact OD1-NZ 3.55Å; D24-K27 PolarHBondContact OD1-NZ 3.06Å; K25-K27 VanDerWaalsContact C-N 3.32Å; K25-K27 PolarHBondContact O-N 3.27Å; K27-Y29 VanDerWaalsContact C-N 3.25Å; K27-Y29 PolarHBondContact O-N 2.88Å; K27-Y32 HydrophobicContact CB-CD1 4.09Å; K27-Y32 HydrophobicContact CB-CE1 4.21Å; K27-Y32 HydrophobicContact CB-CG 4.33Å; K27-Y32 HydrophobicContact CG-CD1 4.09Å; K27-Y32 HydrophobicContact CG-CD2 4.03Å; K27-Y32 HydrophobicContact CG-CE1 3.86Å; K27-Y32 HydrophobicContact CG-CE2 3.76Å; K27-Y32 HydrophobicContact CG-CG 4.18Å
28Q86.8Confident88.7Confident142 Ų14268.5 Ų68.566%0.66433%0.33SS*.THydrogen-bonded Turntrans-71.9-20.5179.1-59.8179-1.200112.7K25 Y26K25-Q28 WeakPolarHBondContact O-CB 3.45Å; K25-Q28 PolarHBondContact O-N 3.41Å; Y26-Q28 PolarHBondContact O-N 3.03Å; Y26-Q28 VanDerWaalsContact O-N 3.11Å
29Y83.4Confident88.6Confident45 Ų4572.7 Ų72.718%0.17634%0.342CS..SBendtrans-89.3149.8-176.2-65.6-79.9000112.2V2 K25 Y26 K27 E31 Y32 L110V2-Y29 HydrophobicContact CB-CD2 4.31Å; V2-Y29 HydrophobicContact CB-CE2 3.64Å; V2-Y29 HydrophobicContact CG1-CD2 3.6Å; V2-Y29 HydrophobicContact CG1-CE2 3.44Å; V2-Y29 VanDerWaalsContact CG1-CE2 3.44Å; V2-Y29 HydrophobicContact CG1-CG 4.34Å; V2-Y29 HydrophobicContact CG2-CE2 3.74Å; K25-Y29 HydrophobicContact CG-CE2 4.3Å; K25-Y29 VanDerWaalsContact O-CD2 3.29Å; K25-Y29 WeakPolarHBondContact O-CD2 3.29Å; K25-Y29 WeakPolarHBondContact O-CE2 3.31Å; Y26-Y29 PolarHBondContact O-N 3.37Å; K27-Y29 VanDerWaalsContact C-N 3.25Å; K27-Y29 PolarHBondContact O-N 2.88Å; Y29-E31 PolarHBondContact O-N 3.43Å; Y29-Y32 PolarHBondContact O-N 3.34Å; Y29-L110 HydrophobicContact CD1-CB 3.89Å; Y29-L110 HydrophobicContact CD1-CD2 3.39Å; Y29-L110 HydrophobicContact CD1-CG 4.13Å; Y29-L110 HydrophobicContact CD2-CD2 4.41Å; Y29-L110 HydrophobicContact CE1-CB 3.73Å; Y29-L110 HydrophobicContact CE1-CD1 4.09Å; Y29-L110 HydrophobicContact CE1-CD2 3.52Å; Y29-L110 HydrophobicContact CE1-CG 3.94Å; Y29-L110 HydrophobicContact CG-CD2 3.85Å
30P83.1Confident88.5Confident21 Ų2179 Ų7914%0.13637%0.372CS..Hα-helixtrans-68.3-22.4-175.513.7-9.5000112.7Y32 K33 Y34 T112 P117P30-Y32 VanDerWaalsContact C-N 3.31Å; P30-Y32 PolarHBondContact O-N 3.42Å; P30-K33 WeakPolarHBondContact O-CB 3.36Å; P30-K33 PolarHBondContact O-N 2.87Å; P30-K33 VanDerWaalsContact O-N 3.09Å; P30-Y34 PolarHBondContact O-N 3.33Å; P30-T112 HydrophobicContact CG-CG2 4.43Å; P30-P117 VanDerWaalsContact C-CB 3.46Å; P30-P117 HydrophobicContact CB-CB 3.65Å; P30-P117 HydrophobicContact CB-CG 3.98Å; P30-P117 HydrophobicContact CG-CB 3.92Å; P30-P117 VanDerWaalsContact O-CG 3.29Å; P30-P117 WeakPolarHBondContact O-CG 3.34Å
31E83.1Confident88.4Confident70 Ų7076.2 Ų76.233%0.32736%0.358SS..Hα-helixtrans-58-41.8174.7-166.4-167.4-173.100112.3Y26 Y29 K33 Y34 K35 P117Y26-E31 WeakPolarHBondContact CE2-OE2 3.4Å; Y26-E31 WeakPolarHBondContact OH-CG 3.43Å; Y26-E31 PolarHBondContact OH-OE2 3.45Å; Y29-E31 PolarHBondContact O-N 3.43Å; E31-K33 VanDerWaalsContact C-N 3.33Å; E31-K33 PolarHBondContact O-N 3.04Å; E31-Y34 PolarHBondContact O-N 3.19Å; E31-K35 HydrophobicContact CG-CD 4.27Å; E31-K35 PolarHBondContact O-N 3.15Å; E31-K35 WeakPolarHBondContact OE1-CE 3.38Å; E31-P117 HydrophobicContact CB-CB 4.31Å; E31-P117 VanDerWaalsContact N-CB 3.31Å
32Y87.1Confident88.5Confident30 Ų3072.3 Ų72.312%0.11834%0.344CS..Hα-helixtrans-59.7-45.7174.5173.3-94.1000111F23 Y26 K27 Y29 P30 Y34 K35 S36 M41F23-Y32 HydrophobicContact CE2-CD2 4.12Å; F23-Y32 AromaticContact CE2-CE2 3.71Å; F23-Y32 HydrophobicContact CE2-CE2 3.71Å; F23-Y32 AromaticContact CZ-CE2 3.85Å; F23-Y32 HydrophobicContact CZ-CE2 3.85Å; Y26-Y32 AromaticContact CD1-CD2 3.86Å; Y26-Y32 HydrophobicContact CD1-CD2 3.86Å; Y26-Y32 HydrophobicContact CD1-CG 4.33Å; Y26-Y32 AromaticContact CE1-CD2 3.96Å; Y26-Y32 HydrophobicContact CE1-CD2 3.96Å; Y26-Y32 HydrophobicContact CE1-CG 4.39Å; K27-Y32 HydrophobicContact CB-CD1 4.09Å; K27-Y32 HydrophobicContact CB-CE1 4.21Å; K27-Y32 HydrophobicContact CB-CG 4.33Å; K27-Y32 HydrophobicContact CG-CD1 4.09Å; K27-Y32 HydrophobicContact CG-CD2 4.03Å; K27-Y32 HydrophobicContact CG-CE1 3.86Å; K27-Y32 HydrophobicContact CG-CE2 3.76Å; K27-Y32 HydrophobicContact CG-CG 4.18Å; Y29-Y32 PolarHBondContact O-N 3.34Å; P30-Y32 VanDerWaalsContact C-N 3.31Å; P30-Y32 PolarHBondContact O-N 3.42Å; Y32-Y34 VanDerWaalsContact C-N 3.29Å; Y32-Y34 PolarHBondContact O-N 3.43Å; Y32-K35 PolarHBondContact O-N 3.26Å; Y32-S36 WeakPolarHBondContact CE2-OG 3.2Å; Y32-S36 WeakPolarHBondContact O-CB 3.44Å; Y32-S36 PolarHBondContact O-N 3.48Å; Y32-S36 PolarHBondContact O-OG 3.47Å; Y32-M41 HydrophobicContact CD2-CB 4.33Å; Y32-M41 HydrophobicContact CD2-SD 4.45Å; Y32-M41 HydrophobicContact CE2-CB 3.94Å
33K85.5Confident88.6Confident139 Ų13972.5 Ų72.560%0.60435%0.346SS*.Hα-helixtrans-60.8-39.1178.5-58.4-178.7-178.71790111.8P30 E31 S37P30-K33 WeakPolarHBondContact O-CB 3.36Å; P30-K33 PolarHBondContact O-N 2.87Å; P30-K33 VanDerWaalsContact O-N 3.09Å; E31-K33 VanDerWaalsContact C-N 3.33Å; E31-K33 PolarHBondContact O-N 3.04Å; K33-S37 PolarHBondContact O-N 3.26Å
34Y83.2Confident88.6Confident98 Ų9877.1 Ų77.138%0.38437%0.371SS..Hα-helixtrans-69.6-46.8177.4177.6-107.2000112.4P30 E31 Y32 S36 S37 P117 R118P30-Y34 PolarHBondContact O-N 3.33Å; E31-Y34 PolarHBondContact O-N 3.19Å; Y32-Y34 VanDerWaalsContact C-N 3.29Å; Y32-Y34 PolarHBondContact O-N 3.43Å; Y34-S36 PolarHBondContact O-N 3.03Å; Y34-S37 PolarHBondContact O-N 2.92Å; Y34-S37 PolarHBondContact O-OG 3.47Å; Y34-P117 HydrophobicContact CG-CG 4.27Å; Y34-R118 PolarHBondContact OH-NH2 3.43Å
35K83.9Confident88.6Confident102 Ų10277 Ų7744%0.44337%0.368SS..Hα-helixtrans-70.5-23.2178.1-74.4177.2175.7-83.10113E31 Y32 M41 I49E31-K35 HydrophobicContact CG-CD 4.27Å; E31-K35 PolarHBondContact O-N 3.15Å; E31-K35 WeakPolarHBondContact OE1-CE 3.38Å; Y32-K35 PolarHBondContact O-N 3.26Å; K35-M41 HydrophobicContact CB-CE 3.59Å; K35-M41 HydrophobicContact CD-CE 3.42Å; K35-M41 VanDerWaalsContact CD-CE 3.42Å; K35-M41 HydrophobicContact CG-CE 4.16Å; K35-I49 HydrophobicContact CD-CD1 4.19Å
36S88.3Confident88.8Confident21 Ų2174.8 Ų74.815%0.14736%0.358CS..THydrogen-bonded Turntrans-99.514.6179.4-50.70000113.7Y32 Y34 D38 R39 M41Y32-S36 WeakPolarHBondContact CE2-OG 3.2Å; Y32-S36 WeakPolarHBondContact O-CB 3.44Å; Y32-S36 PolarHBondContact O-N 3.48Å; Y32-S36 PolarHBondContact O-OG 3.47Å; Y34-S36 PolarHBondContact O-N 3.03Å; S36-D38 VanDerWaalsContact C-N 3.31Å; S36-D38 PolarHBondContact O-N 3.45Å; S36-R39 VanDerWaalsContact CA-O 3.23Å; S36-R39 WeakPolarHBondContact CA-O 3.49Å; S36-M41 PolarHBondContact OG-N 2.96Å
37S85.8Confident89.1Confident78 Ų7876.7 Ų76.755%0.54537%0.367SS..SBendtrans-64.8-36.2-177.364.20000112.8K33 Y34K33-S37 PolarHBondContact O-N 3.26Å; Y34-S37 PolarHBondContact O-N 2.92Å; Y34-S37 PolarHBondContact O-OG 3.47Å
38D87.8Confident89.2Confident156 Ų15679 Ų7983%0.83438%0.377SS*.SBendtrans-103.4-30-174.9-53.7-20.3000111.8S36S36-D38 VanDerWaalsContact C-N 3.31Å; S36-D38 PolarHBondContact O-N 3.45Å
39R90.7Very high89.4Confident144 Ų14474.5 Ų74.554%0.54336%0.357SS..SBendtrans-154.8137.4178.1-177.3178.767.188-2.2109.8S36 M41 E45S36-R39 VanDerWaalsContact CA-O 3.23Å; S36-R39 WeakPolarHBondContact CA-O 3.49Å; R39-M41 PolarHBondContact O-N 3.25Å; R39-E45 IonicContact CZ-OE1 3.39Å; R39-E45 IonicContact CZ-OE2 3.14Å; R39-E45 IonicContact NH1-OE2 3.09Å; R39-E45 IonicContact NH2-OE1 3.91Å; R39-E45 PolarHBondContact NH2-OE1 3.22Å; R39-E45 IonicContact NH2-OE2 2.71Å; R39-E45 PolarHBondContact NH2-OE2 3.11Å
40E92.2Very high89.8Confident150 Ų15072.7 Ų72.770%0.70135%0.35SS*.PPolyproline II helixtrans-56.1129.5174.6-65.3-167162.200112T42E40-T42 PolarHBondContact O-N 2.91Å
41M92.9Very high90.3Very high17 Ų1778.6 Ų78.68%0.08437%0.37CS..PPolyproline II helixtrans-64.9130.8172.7178.4-175.5-63.800109.8F23 Y26 Y32 K35 S36 R39 E45 F46 I49F23-M41 WeakPolarHBondContact CZ-O 3.41Å; Y26-M41 HydrophobicContact CD1-SD 4.38Å; Y26-M41 HydrophobicContact CE1-CE 3.97Å; Y26-M41 HydrophobicContact CE1-SD 3.76Å; Y32-M41 HydrophobicContact CD2-CB 4.33Å; Y32-M41 HydrophobicContact CD2-SD 4.45Å; Y32-M41 HydrophobicContact CE2-CB 3.94Å; K35-M41 HydrophobicContact CB-CE 3.59Å; K35-M41 HydrophobicContact CD-CE 3.42Å; K35-M41 VanDerWaalsContact CD-CE 3.42Å; K35-M41 HydrophobicContact CG-CE 4.16Å; S36-M41 PolarHBondContact OG-N 2.96Å; R39-M41 PolarHBondContact O-N 3.25Å; M41-E45 HydrophobicContact CG-CB 3.84Å; M41-F46 HydrophobicContact SD-CB 3.88Å; M41-I49 HydrophobicContact CE-CD1 3.84Å; M41-I49 HydrophobicContact SD-CD1 4.26Å
42T94.7Very high90.7Very high60 Ų6080 Ų8037%0.36838%0.378SS..PPolyproline II helixtrans-77.6158.2175.261.80000111.6E40 D44 E45 F46E40-T42 PolarHBondContact O-N 2.91Å; T42-D44 PolarHBondContact O-N 3.46Å; T42-E45 WeakPolarHBondContact CB-OE2 3.46Å; T42-E45 PolarHBondContact N-OE2 3.37Å; T42-E45 PolarHBondContact O-N 3.03Å; T42-E45 VanDerWaalsContact OG1-CD 3.31Å; T42-E45 VanDerWaalsContact OG1-CG 3.25Å; T42-E45 WeakPolarHBondContact OG1-CG 3.4Å; T42-E45 PolarHBondContact OG1-N 3.38Å; T42-E45 PolarHBondContact OG1-OE2 2.86Å; T42-F46 PolarHBondContact O-N 2.64Å
43L94Very high90.8Very high35 Ų3581.4 Ų81.418%0.18339%0.385CS..Hα-helixtrans-57.9-33.9174.3-178.563.7000112.1W19 M20 F23 F46 K47W19-L43 HydrophobicContact CB-CD1 4.42Å; M20-L43 HydrophobicContact SD-CD1 4.46Å; M20-L43 HydrophobicContact SD-CD2 4.03Å; F23-L43 HydrophobicContact CB-CD1 3.78Å; F23-L43 HydrophobicContact CD1-CD1 3.8Å; F23-L43 HydrophobicContact CG-CD1 3.87Å; L43-F46 HydrophobicContact CD1-CD1 4.13Å; L43-F46 PolarHBondContact O-N 3.42Å; L43-K47 HydrophobicContact CG-CD 4.38Å; L43-K47 WeakPolarHBondContact O-CB 3.42Å; L43-K47 VanDerWaalsContact O-CG 3.31Å; L43-K47 WeakPolarHBondContact O-CG 3.48Å; L43-K47 PolarHBondContact O-N 3.24Å
44D94.9Very high91.2Very high110 Ų11077 Ų7759%0.58837%0.365SS*.Hα-helixtrans-73.2-38-179.2-69.3-28.2000112.8T42 F46 K47 F48T42-D44 PolarHBondContact O-N 3.46Å; D44-F46 VanDerWaalsContact C-N 3.33Å; D44-K47 PolarHBondContact O-N 3.36Å; D44-K47 IonicContact OD1-NZ 2.65Å; D44-F48 PolarHBondContact O-N 3.28Å
45E93.1Very high91.6Very high72 Ų7275.6 Ų75.634%0.33637%0.367SS..Hα-helixtrans-62.4-42.3170.8-72.5166.1135.100111.4R39 M41 T42 F48 I49R39-E45 IonicContact CZ-OE1 3.39Å; R39-E45 IonicContact CZ-OE2 3.14Å; R39-E45 IonicContact NH1-OE2 3.09Å; R39-E45 IonicContact NH2-OE1 3.91Å; R39-E45 PolarHBondContact NH2-OE1 3.22Å; R39-E45 IonicContact NH2-OE2 2.71Å; R39-E45 PolarHBondContact NH2-OE2 3.11Å; M41-E45 HydrophobicContact CG-CB 3.84Å; T42-E45 WeakPolarHBondContact CB-OE2 3.46Å; T42-E45 PolarHBondContact N-OE2 3.37Å; T42-E45 PolarHBondContact O-N 3.03Å; T42-E45 VanDerWaalsContact OG1-CD 3.31Å; T42-E45 VanDerWaalsContact OG1-CG 3.25Å; T42-E45 WeakPolarHBondContact OG1-CG 3.4Å; T42-E45 PolarHBondContact OG1-N 3.38Å; T42-E45 PolarHBondContact OG1-OE2 2.86Å; E45-F48 PolarHBondContact O-N 2.89Å; E45-I49 WeakPolarHBondContact O-CG1 3.35Å; E45-I49 PolarHBondContact O-N 3.45Å; E45-I49 VanDerWaalsContact O-N 3.13Å
46F93.8Very high92.1Very high3 Ų375.4 Ų75.41%0.01337%0.367CS..Hα-helixtrans-61.5-46.6173.1170.1-109.4000111.9W19 E22 F23 Y26 M41 T42 L43 D44 F48 I49 W50W19-F46 HydrophobicContact CE3-CE1 4.19Å; W19-F46 HydrophobicContact CZ3-CE1 4.38Å; E22-F46 HydrophobicContact CB-CE1 4.48Å; E22-F46 HydrophobicContact CB-CZ 4.43Å; E22-F46 HydrophobicContact CG-CZ 4.18Å; E22-F46 WeakPolarHBondContact O-CZ 3.21Å; F23-F46 HydrophobicContact CB-CD1 3.73Å; F23-F46 HydrophobicContact CB-CE1 3.73Å; F23-F46 HydrophobicContact CB-CG 4.43Å; F23-F46 HydrophobicContact CB-CZ 4.45Å; F23-F46 HydrophobicContact CD2-CB 3.72Å; F23-F46 AromaticContact CD2-CD1 3.68Å; F23-F46 HydrophobicContact CD2-CD1 3.68Å; F23-F46 AromaticContact CD2-CD2 3.99Å; F23-F46 HydrophobicContact CD2-CD2 3.99Å; F23-F46 HydrophobicContact CD2-CE1 4.26Å; F23-F46 AromaticContact CD2-CG 3.5Å; F23-F46 HydrophobicContact CD2-CG 3.5Å; F23-F46 VanDerWaalsContact CD2-CG 3.5Å; F23-F46 HydrophobicContact CE2-CB 3.85Å; F23-F46 HydrophobicContact CE2-CG 4.11Å; F23-F46 AromaticContact CG-CD1 3.97Å; F23-F46 HydrophobicContact CG-CD1 3.97Å; F23-F46 HydrophobicContact CG-CE1 4.41Å; F23-F46 HydrophobicContact CG-CG 4.25Å; Y26-F46 AromaticContact CD1-CD2 3.52Å; Y26-F46 HydrophobicContact CD1-CD2 3.52Å; Y26-F46 AromaticContact CD1-CE2 3.76Å; Y26-F46 HydrophobicContact CD1-CE2 3.76Å; Y26-F46 HydrophobicContact CD2-CD2 4.36Å; Y26-F46 AromaticContact CD2-CE2 3.89Å; Y26-F46 HydrophobicContact CD2-CE2 3.89Å; Y26-F46 HydrophobicContact CE1-CD2 4.05Å; Y26-F46 AromaticContact CG-CD2 3.7Å; Y26-F46 HydrophobicContact CG-CD2 3.7Å; Y26-F46 AromaticContact CG-CE2 3.39Å; Y26-F46 HydrophobicContact CG-CE2 3.39Å; Y26-F46 HydrophobicContact CG-CZ 4.39Å; M41-F46 HydrophobicContact SD-CB 3.88Å; T42-F46 PolarHBondContact O-N 2.64Å; L43-F46 HydrophobicContact CD1-CD1 4.13Å; L43-F46 PolarHBondContact O-N 3.42Å; D44-F46 VanDerWaalsContact C-N 3.33Å; F46-F48 VanDerWaalsContact C-N 3.26Å; F46-F48 PolarHBondContact O-N 3.36Å; F46-I49 PolarHBondContact O-N 3.24Å; F46-W50 HydrophobicContact CE2-CB 4.44Å; F46-W50 HydrophobicContact CZ-CB 4.34Å; F46-W50 AromaticContact CZ-CD1 3.73Å; F46-W50 HydrophobicContact CZ-CG 4.37Å; F46-W50 WeakPolarHBondContact O-CB 3.47Å; F46-W50 PolarHBondContact O-N 3.09Å
47K95Very high92.2Very high48 Ų4875.2 Ų75.221%0.20936%0.363CS..Hα-helixtrans-56.6-40.5176.5-81171.1-178165.20111.4W19 L43 D44 W50 R51W19-K47 HydrophobicContact CD2-CD 4.35Å; W19-K47 HydrophobicContact CD2-CG 3.83Å; W19-K47 HydrophobicContact CE3-CG 3.65Å; W19-K47 HydrophobicContact CH2-CG 4.16Å; W19-K47 HydrophobicContact CZ2-CG 4.32Å; W19-K47 HydrophobicContact CZ3-CB 4.43Å; W19-K47 HydrophobicContact CZ3-CG 3.83Å; L43-K47 HydrophobicContact CG-CD 4.38Å; L43-K47 WeakPolarHBondContact O-CB 3.42Å; L43-K47 VanDerWaalsContact O-CG 3.31Å; L43-K47 WeakPolarHBondContact O-CG 3.48Å; L43-K47 PolarHBondContact O-N 3.24Å; D44-K47 PolarHBondContact O-N 3.36Å; D44-K47 IonicContact OD1-NZ 2.65Å; K47-W50 PolarHBondContact O-N 3.5Å; K47-R51 VanDerWaalsContact O-CB 3.29Å; K47-R51 WeakPolarHBondContact O-CB 3.4Å; K47-R51 WeakPolarHBondContact O-CG 3.35Å; K47-R51 PolarHBondContact O-N 2.95Å
48F93.3Very high92.5Very high117 Ų11773.2 Ų73.251%0.51335%0.346SS..Hα-helixtrans-61.5-53.3176177.6-99.1000111.6D44 E45 F46 W50 R51 M52D44-F48 PolarHBondContact O-N 3.28Å; E45-F48 PolarHBondContact O-N 2.89Å; F46-F48 VanDerWaalsContact C-N 3.26Å; F46-F48 PolarHBondContact O-N 3.36Å; F48-W50 VanDerWaalsContact C-N 3.29Å; F48-W50 PolarHBondContact O-N 2.95Å; F48-R51 PolarHBondContact O-N 3.48Å; F48-M52 HydrophobicContact CD1-CG 4.47Å; F48-M52 HydrophobicContact CD2-CG 4.5Å; F48-M52 HydrophobicContact CE1-CG 4.07Å; F48-M52 HydrophobicContact CE2-CG 4.09Å; F48-M52 HydrophobicContact CE2-SD 4.39Å; F48-M52 HydrophobicContact CZ-CG 3.87Å; F48-M52 HydrophobicContact CZ-SD 4.35Å; F48-M52 WeakPolarHBondContact O-CG 3.43Å; F48-M52 PolarHBondContact O-N 2.9Å
49I90.5Very high92.8Very high49 Ų4970.2 Ų70.225%0.25133%0.329SS..Hα-helixtrans-57.3-45.3177.7-64.6169000110.5K35 M41 E45 F46 M52 E53K35-I49 HydrophobicContact CD-CD1 4.19Å; M41-I49 HydrophobicContact CE-CD1 3.84Å; M41-I49 HydrophobicContact SD-CD1 4.26Å; E45-I49 WeakPolarHBondContact O-CG1 3.35Å; E45-I49 PolarHBondContact O-N 3.45Å; E45-I49 VanDerWaalsContact O-N 3.13Å; F46-I49 PolarHBondContact O-N 3.24Å; I49-M52 PolarHBondContact O-N 3.31Å; I49-E53 WeakPolarHBondContact O-CB 3.26Å; I49-E53 PolarHBondContact O-N 3.29Å
50W92.2Very high92.9Very high7 Ų765.9 Ų65.93%0.02732%0.324CS..Hα-helixtrans-62.7-45.6-179.8-168.6108.2000111.7P12 P13 W19 F46 K47 F48 E53 Y54P12-W50 HydrophobicContact CB-CH2 3.6Å; P12-W50 HydrophobicContact CB-CZ3 3.79Å; P13-W50 HydrophobicContact CG-CH2 4.4Å; P13-W50 HydrophobicContact CG-CZ2 4.01Å; W19-W50 HydrophobicContact CH2-CB 4.48Å; W19-W50 AromaticContact CH2-CD2 3.88Å; W19-W50 HydrophobicContact CH2-CD2 3.88Å; W19-W50 AromaticContact CH2-CE3 3.52Å; W19-W50 HydrophobicContact CH2-CE3 3.52Å; W19-W50 HydrophobicContact CH2-CG 4.29Å; W19-W50 HydrophobicContact CH2-CZ3 4.13Å; W19-W50 HydrophobicContact CZ3-CB 4.02Å; W19-W50 AromaticContact CZ3-CD2 3.84Å; W19-W50 HydrophobicContact CZ3-CD2 3.84Å; W19-W50 AromaticContact CZ3-CE3 3.99Å; W19-W50 HydrophobicContact CZ3-CE3 3.99Å; W19-W50 AromaticContact CZ3-CG 3.84Å; W19-W50 HydrophobicContact CZ3-CG 3.84Å; F46-W50 HydrophobicContact CE2-CB 4.44Å; F46-W50 HydrophobicContact CZ-CB 4.34Å; F46-W50 AromaticContact CZ-CD1 3.73Å; F46-W50 HydrophobicContact CZ-CG 4.37Å; F46-W50 WeakPolarHBondContact O-CB 3.47Å; F46-W50 PolarHBondContact O-N 3.09Å; K47-W50 PolarHBondContact O-N 3.5Å; F48-W50 VanDerWaalsContact C-N 3.29Å; F48-W50 PolarHBondContact O-N 2.95Å; W50-E53 PolarHBondContact O-N 2.98Å; W50-Y54 HydrophobicContact CE3-CG 4.39Å; W50-Y54 HydrophobicContact CH2-CD1 4.44Å; W50-Y54 AromaticContact CH2-CD2 3.32Å; W50-Y54 HydrophobicContact CH2-CD2 3.32Å; W50-Y54 HydrophobicContact CH2-CE2 4.04Å; W50-Y54 AromaticContact CH2-CG 3.56Å; W50-Y54 HydrophobicContact CH2-CG 3.56Å; W50-Y54 HydrophobicContact CZ2-CD2 4.19Å; W50-Y54 HydrophobicContact CZ3-CD1 4.12Å; W50-Y54 AromaticContact CZ3-CD2 3.79Å; W50-Y54 HydrophobicContact CZ3-CD2 3.79Å; W50-Y54 AromaticContact CZ3-CG 3.48Å; W50-Y54 HydrophobicContact CZ3-CG 3.48Å; W50-Y54 VanDerWaalsContact CZ3-CG 3.48Å; W50-Y54 VanDerWaalsContact O-CB 3.3Å; W50-Y54 WeakPolarHBondContact O-CB 3.21Å; W50-Y54 PolarHBondContact O-N 3.34Å
51R93.5Very high92.9Very high145 Ų14561.2 Ų61.255%0.54730%0.299SS..Hα-helixtrans-64.6-41179.5-76.8172.5-176.5-115.52.1112.1W19 K47 F48 Y54 T55W19-R51 HydrophobicContact CH2-CG 4.44Å; K47-R51 VanDerWaalsContact O-CB 3.29Å; K47-R51 WeakPolarHBondContact O-CB 3.4Å; K47-R51 WeakPolarHBondContact O-CG 3.35Å; K47-R51 PolarHBondContact O-N 2.95Å; F48-R51 PolarHBondContact O-N 3.48Å; R51-Y54 PolarHBondContact O-N 3.04Å; R51-T55 VanDerWaalsContact O-CB 3.25Å; R51-T55 WeakPolarHBondContact O-CB 3.29Å; R51-T55 PolarHBondContact O-N 2.86Å; R51-T55 PolarHBondContact O-OG1 3Å
52M92.2Very high93Very high100 Ų10062.8 Ų62.849%0.49332%0.316SS..Hα-helixtrans-61.9-48176.1-71.7-58.9-70.900111.1F48 I49 T55 H56F48-M52 HydrophobicContact CD1-CG 4.47Å; F48-M52 HydrophobicContact CD2-CG 4.5Å; F48-M52 HydrophobicContact CE1-CG 4.07Å; F48-M52 HydrophobicContact CE2-CG 4.09Å; F48-M52 HydrophobicContact CE2-SD 4.39Å; F48-M52 HydrophobicContact CZ-CG 3.87Å; F48-M52 HydrophobicContact CZ-SD 4.35Å; F48-M52 WeakPolarHBondContact O-CG 3.43Å; F48-M52 PolarHBondContact O-N 2.9Å; I49-M52 PolarHBondContact O-N 3.31Å; M52-T55 PolarHBondContact O-N 3.1Å; M52-H56 WeakPolarHBondContact O-CB 3.12Å; M52-H56 PolarHBondContact O-N 3.48Å
53E90.2Very high92.9Very high59 Ų5965.2 Ų65.228%0.27633%0.326SS..Hα-helixtrans-63.8-43.7178.2-177.263.3-169.200112.1M1 I49 W50 H56 R57M1-E53 HydrophobicContact CB-CG 4.14Å; I49-E53 WeakPolarHBondContact O-CB 3.26Å; I49-E53 PolarHBondContact O-N 3.29Å; W50-E53 PolarHBondContact O-N 2.98Å; E53-H56 PolarHBondContact O-N 3.41Å; E53-R57 WeakPolarHBondContact O-CB 3.21Å; E53-R57 VanDerWaalsContact O-CG 3.29Å; E53-R57 WeakPolarHBondContact O-CG 3.46Å; E53-R57 PolarHBondContact O-N 3.48Å; E53-R57 IonicContact OE1-CZ 3.59Å; E53-R57 IonicContact OE1-NE 2.76Å; E53-R57 PolarHBondContact OE1-NE 2.93Å; E53-R57 IonicContact OE1-NH2 2.65Å; E53-R57 PolarHBondContact OE1-NH2 3.43Å
54Y92Very high93Very high47 Ų4764.1 Ų64.118%0.18432%0.322CS..Hα-helixtrans-60.4-48.7176.3174.6-95.4000111.4M10 P12 W50 R51 H56 R57 M58M10-Y54 VanDerWaalsContact O-CE2 3.29Å; M10-Y54 WeakPolarHBondContact O-CE2 3.36Å; M10-Y54 PolarHBondContact O-OH 3.33Å; P12-Y54 HydrophobicContact CB-CE2 4.33Å; W50-Y54 HydrophobicContact CE3-CG 4.39Å; W50-Y54 HydrophobicContact CH2-CD1 4.44Å; W50-Y54 AromaticContact CH2-CD2 3.32Å; W50-Y54 HydrophobicContact CH2-CD2 3.32Å; W50-Y54 HydrophobicContact CH2-CE2 4.04Å; W50-Y54 AromaticContact CH2-CG 3.56Å; W50-Y54 HydrophobicContact CH2-CG 3.56Å; W50-Y54 HydrophobicContact CZ2-CD2 4.19Å; W50-Y54 HydrophobicContact CZ3-CD1 4.12Å; W50-Y54 AromaticContact CZ3-CD2 3.79Å; W50-Y54 HydrophobicContact CZ3-CD2 3.79Å; W50-Y54 AromaticContact CZ3-CG 3.48Å; W50-Y54 HydrophobicContact CZ3-CG 3.48Å; W50-Y54 VanDerWaalsContact CZ3-CG 3.48Å; W50-Y54 VanDerWaalsContact O-CB 3.3Å; W50-Y54 WeakPolarHBondContact O-CB 3.21Å; W50-Y54 PolarHBondContact O-N 3.34Å; R51-Y54 PolarHBondContact O-N 3.04Å; Y54-H56 PolarHBondContact O-N 2.89Å; Y54-R57 PolarHBondContact O-N 3.43Å; Y54-M58 HydrophobicContact CD1-CG 4.05Å; Y54-M58 HydrophobicContact CD2-CE 4.21Å; Y54-M58 HydrophobicContact CD2-CG 4.22Å; Y54-M58 HydrophobicContact CE1-CG 3.57Å; Y54-M58 HydrophobicContact CE2-CE 4.05Å; Y54-M58 HydrophobicContact CE2-CG 3.78Å; Y54-M58 HydrophobicContact CE2-SD 3.9Å; Y54-M58 HydrophobicContact CG-CG 4.35Å; Y54-M58 VanDerWaalsContact CZ-CG 3.43Å; Y54-M58 WeakPolarHBondContact O-CG 3.36Å; Y54-M58 PolarHBondContact O-N 3.32Å
55T93.3Very high92.9Very high68 Ų6863.7 Ų63.742%0.41732%0.32SS..Hα-helixtrans-61.1-46.9179.6-58.40000110.7R51 M52 R57 M58 I59R51-T55 VanDerWaalsContact O-CB 3.25Å; R51-T55 WeakPolarHBondContact O-CB 3.29Å; R51-T55 PolarHBondContact O-N 2.86Å; R51-T55 PolarHBondContact O-OG1 3Å; M52-T55 PolarHBondContact O-N 3.1Å; T55-R57 VanDerWaalsContact C-N 3.35Å; T55-R57 PolarHBondContact O-N 2.84Å; T55-M58 PolarHBondContact O-N 2.93Å; T55-I59 HydrophobicContact CG2-CD1 3.69Å; T55-I59 HydrophobicContact CG2-CG1 4.34Å; T55-I59 WeakPolarHBondContact O-CB 3.37Å; T55-I59 VanDerWaalsContact O-CG1 3.29Å; T55-I59 WeakPolarHBondContact O-CG1 3.25Å; T55-I59 PolarHBondContact O-N 2.84Å
56H93.2Very high93.1Very high98 Ų9865.3 Ų65.345%0.45433%0.334SS..Hα-helixtrans-54.7-49175171.768.2000111.8M52 E53 Y54 A60M52-H56 WeakPolarHBondContact O-CB 3.12Å; M52-H56 PolarHBondContact O-N 3.48Å; E53-H56 PolarHBondContact O-N 3.41Å; Y54-H56 PolarHBondContact O-N 2.89Å; H56-A60 WeakPolarHBondContact O-CB 3.39Å; H56-A60 PolarHBondContact O-N 3.4Å
57R90.9Very high93.2Very high16 Ų1667.4 Ų67.46%0.0634%0.343CS..Hα-helixtrans-66.1-40.4179.3-70.4177.4-174.3-169.910113M1 D3 E53 Y54 T55 A60 R61 V106M1-R57 PolarHBondContact O-NH2 3.39Å; M1-R57 PolarHBondContact SD-NH1 3.4Å; D3-R57 PolarHBondContact O-NH1 3.39Å; E53-R57 WeakPolarHBondContact O-CB 3.21Å; E53-R57 VanDerWaalsContact O-CG 3.29Å; E53-R57 WeakPolarHBondContact O-CG 3.46Å; E53-R57 PolarHBondContact O-N 3.48Å; E53-R57 IonicContact OE1-CZ 3.59Å; E53-R57 IonicContact OE1-NE 2.76Å; E53-R57 PolarHBondContact OE1-NE 2.93Å; E53-R57 IonicContact OE1-NH2 2.65Å; E53-R57 PolarHBondContact OE1-NH2 3.43Å; Y54-R57 PolarHBondContact O-N 3.43Å; T55-R57 VanDerWaalsContact C-N 3.35Å; T55-R57 PolarHBondContact O-N 2.84Å; R57-A60 PolarHBondContact O-N 3.21Å; R57-R61 VanDerWaalsContact O-CG 3.29Å; R57-R61 WeakPolarHBondContact O-CG 3.3Å; R57-R61 PolarHBondContact O-N 2.86Å; R57-V106 VanDerWaalsContact NH2-CG2 3.26Å
58M92.5Very high93.2Very high37 Ų3768.5 Ų68.518%0.18235%0.351CS..Hα-helixtrans-67.8-43.5179-69.6-41.89300111.2M10 Y54 T55 R61 A62M10-M58 HydrophobicContact CB-SD 4.43Å; M10-M58 HydrophobicContact CG-SD 4.07Å; Y54-M58 HydrophobicContact CD1-CG 4.05Å; Y54-M58 HydrophobicContact CD2-CE 4.21Å; Y54-M58 HydrophobicContact CD2-CG 4.22Å; Y54-M58 HydrophobicContact CE1-CG 3.57Å; Y54-M58 HydrophobicContact CE2-CE 4.05Å; Y54-M58 HydrophobicContact CE2-CG 3.78Å; Y54-M58 HydrophobicContact CE2-SD 3.9Å; Y54-M58 HydrophobicContact CG-CG 4.35Å; Y54-M58 VanDerWaalsContact CZ-CG 3.43Å; Y54-M58 WeakPolarHBondContact O-CG 3.36Å; Y54-M58 PolarHBondContact O-N 3.32Å; T55-M58 PolarHBondContact O-N 2.93Å; M58-R61 PolarHBondContact O-N 2.91Å; M58-A62 WeakPolarHBondContact O-CB 3.32Å; M58-A62 PolarHBondContact O-N 3.02Å
59I93.8Very high93.4Very high93 Ų9368.2 Ų68.248%0.47735%0.354SS..Hα-helixtrans-61.3-45.4174.7-68.5172.4000110.2T55 R61 A62 L63T55-I59 HydrophobicContact CG2-CD1 3.69Å; T55-I59 HydrophobicContact CG2-CG1 4.34Å; T55-I59 WeakPolarHBondContact O-CB 3.37Å; T55-I59 VanDerWaalsContact O-CG1 3.29Å; T55-I59 WeakPolarHBondContact O-CG1 3.25Å; T55-I59 PolarHBondContact O-N 2.84Å; I59-R61 VanDerWaalsContact C-N 3.34Å; I59-R61 PolarHBondContact O-N 3.42Å; I59-A62 PolarHBondContact O-N 3.49Å; I59-L63 HydrophobicContact CG2-CD1 3.74Å; I59-L63 HydrophobicContact CG2-CG 4.14Å; I59-L63 WeakPolarHBondContact O-CB 3.44Å; I59-L63 VanDerWaalsContact O-CG 3.31Å; I59-L63 WeakPolarHBondContact O-CG 3.46Å; I59-L63 PolarHBondContact O-N 3.33Å
60A93.6Very high93.7Very high52 Ų5268.3 Ų68.343%0.4336%0.358SS..Hα-helixtrans-59.4-42.5178.300000112.5H56 R57 G64H56-A60 WeakPolarHBondContact O-CB 3.39Å; H56-A60 PolarHBondContact O-N 3.4Å; R57-A60 PolarHBondContact O-N 3.21Å; A60-G64 PolarHBondContact O-N 3.45Å
61R91.6Very high93.9Very high52 Ų5268.8 Ų68.820%0.19636%0.363CS..Hα-helixtrans-63.6-47.6174.8-71.6169.3-168.4178.70.5111.8H5 V6 R57 M58 I59 L63 G64 L65H5-R61 PolarHBondContact O-NH2 2.87Å; V6-R61 PolarHBondContact O-NH1 3.45Å; R57-R61 VanDerWaalsContact O-CG 3.29Å; R57-R61 WeakPolarHBondContact O-CG 3.3Å; R57-R61 PolarHBondContact O-N 2.86Å; M58-R61 PolarHBondContact O-N 2.91Å; I59-R61 VanDerWaalsContact C-N 3.34Å; I59-R61 PolarHBondContact O-N 3.42Å; R61-L63 PolarHBondContact O-N 3.4Å; R61-G64 PolarHBondContact O-N 2.94Å; R61-L65 WeakPolarHBondContact O-CG 3.48Å; R61-L65 PolarHBondContact O-N 3.31Å
62A93.7Very high94Very high51 Ų5164.6 Ų64.642%0.42136%0.36SS..Hα-helixtrans-59.1-48.917900000111.1M58 I59 G64 L65 V66M58-A62 WeakPolarHBondContact O-CB 3.32Å; M58-A62 PolarHBondContact O-N 3.02Å; I59-A62 PolarHBondContact O-N 3.49Å; A62-G64 VanDerWaalsContact C-N 3.33Å; A62-G64 PolarHBondContact O-N 3.29Å; A62-L65 PolarHBondContact O-N 2.89Å; A62-V66 WeakPolarHBondContact O-CB 3.38Å; A62-V66 WeakPolarHBondContact O-CG2 3.33Å; A62-V66 PolarHBondContact O-N 2.94Å
63L94.1Very high94.3Very high111 Ų11165.6 Ų65.658%0.58136%0.359SS*.Hα-helixtrans-61.2-41.1176.5-69.1175.7000112.2I59 R61 V66 F67I59-L63 HydrophobicContact CG2-CD1 3.74Å; I59-L63 HydrophobicContact CG2-CG 4.14Å; I59-L63 WeakPolarHBondContact O-CB 3.44Å; I59-L63 VanDerWaalsContact O-CG 3.31Å; I59-L63 WeakPolarHBondContact O-CG 3.46Å; I59-L63 PolarHBondContact O-N 3.33Å; R61-L63 PolarHBondContact O-N 3.4Å; L63-V66 PolarHBondContact O-N 2.93Å; L63-F67 PolarHBondContact O-N 3.34Å
64G94.8Very high94.6Very high11 Ų1167 Ų6711%0.11336%0.364CS..Hα-helixtrans-59.6-46.1174.700000112.4A60 R61 A62 F67 I68A60-G64 PolarHBondContact O-N 3.45Å; R61-G64 PolarHBondContact O-N 2.94Å; A62-G64 VanDerWaalsContact C-N 3.33Å; A62-G64 PolarHBondContact O-N 3.29Å; G64-F67 PolarHBondContact O-N 3.46Å; G64-I68 VanDerWaalsContact O-CB 3.26Å; G64-I68 WeakPolarHBondContact O-CB 3.41Å; G64-I68 WeakPolarHBondContact O-CG1 3.33Å; G64-I68 PolarHBondContact O-N 2.93Å
65L94.3Very high94.9Very high101 Ų10170.3 Ų70.353%0.52938%0.376SS..Hα-helixtrans-68.1-43.5178-68.9172.1000112.5R61 A62 F67 I68 L69R61-L65 WeakPolarHBondContact O-CG 3.48Å; R61-L65 PolarHBondContact O-N 3.31Å; A62-L65 PolarHBondContact O-N 2.89Å; L65-F67 PolarHBondContact O-N 2.9Å; L65-I68 PolarHBondContact O-N 3.47Å; L65-L69 HydrophobicContact CB-CD1 4.3Å; L65-L69 HydrophobicContact CD2-CD1 4.26Å; L65-L69 HydrophobicContact CD2-CG 4.38Å; L65-L69 WeakPolarHBondContact O-CB 3.38Å; L65-L69 WeakPolarHBondContact O-CG 3.4Å; L65-L69 PolarHBondContact O-N 3.44Å
66V96.2Very high95.1Very high107 Ų10776.1 Ų76.165%0.64839%0.392SS*.Hα-helixtrans-61.2-28.1177.4168.40000111.6A62 L63 P70A62-V66 WeakPolarHBondContact O-CB 3.38Å; A62-V66 WeakPolarHBondContact O-CG2 3.33Å; A62-V66 PolarHBondContact O-N 2.94Å; L63-V66 PolarHBondContact O-N 2.93Å; V66-P70 WeakPolarHBondContact O-CD 3.48Å; V66-P70 WeakPolarHBondContact O-CG 3.5Å
67F96.3Very high95.3Very high46 Ų4676.4 Ų76.420%0.20239%0.392CS..Hα-helixtrans-86.1-54.4172.4-176.3-92.6000112.6L63 G64 L65 P70 A71 C91 V95 L138L63-F67 PolarHBondContact O-N 3.34Å; G64-F67 PolarHBondContact O-N 3.46Å; L65-F67 PolarHBondContact O-N 2.9Å; F67-P70 WeakPolarHBondContact O-CD 3.42Å; F67-A71 HydrophobicContact CE1-CB 4.31Å; F67-A71 WeakPolarHBondContact O-CB 3.49Å; F67-A71 PolarHBondContact O-N 2.73Å; F67-A71 VanDerWaalsContact O-N 3.08Å; F67-C91 HydrophobicContact CE1-CB 4.03Å; F67-C91 HydrophobicContact CE2-CB 3.86Å; F67-C91 HydrophobicContact CZ-CB 3.38Å; F67-V95 HydrophobicContact CD1-CG2 4.17Å; F67-V95 HydrophobicContact CG-CG2 4.47Å; F67-L138 HydrophobicContact CD2-CD2 4.07Å; F67-L138 HydrophobicContact CE2-CD2 3.77Å
68I95.9Very high95.5Very high71 Ų7178.3 Ų78.336%0.36442%0.416SS..Hα-helixtrans-66.9-43.4-169.5-68.4170.5000111.6G64 L65 A71 A72 V95G64-I68 VanDerWaalsContact O-CB 3.26Å; G64-I68 WeakPolarHBondContact O-CB 3.41Å; G64-I68 WeakPolarHBondContact O-CG1 3.33Å; G64-I68 PolarHBondContact O-N 2.93Å; L65-I68 PolarHBondContact O-N 3.47Å; I68-A71 PolarHBondContact O-N 3.45Å; I68-A72 VanDerWaalsContact O-CB 3.3Å; I68-A72 WeakPolarHBondContact O-CB 3.39Å; I68-A72 PolarHBondContact O-N 3.46Å; I68-V95 HydrophobicContact CD1-CG1 3.87Å; I68-V95 HydrophobicContact CG1-CG1 4.3Å
69L96.5Very high95.7Very high111 Ų11182.9 Ų82.958%0.58144%0.436SS*.Hα-helixtrans-65.6-50.6-175.8-63.8175.2000111.9L65 A71 A72 Y73L65-L69 HydrophobicContact CB-CD1 4.3Å; L65-L69 HydrophobicContact CD2-CD1 4.26Å; L65-L69 HydrophobicContact CD2-CG 4.38Å; L65-L69 WeakPolarHBondContact O-CB 3.38Å; L65-L69 WeakPolarHBondContact O-CG 3.4Å; L65-L69 PolarHBondContact O-N 3.44Å; L69-A71 PolarHBondContact O-N 3.42Å; L69-A72 PolarHBondContact O-N 3.29Å; L69-Y73 WeakPolarHBondContact O-CB 3.44Å; L69-Y73 PolarHBondContact O-N 3.14Å
70P96.4Very high95.6Very high52 Ų5279.5 Ų79.534%0.33842%0.419SS..Hα-helixtrans-64.9-38.1175.3-24.137.8000112.8V66 F67 A72 Y73 F74V66-P70 WeakPolarHBondContact O-CD 3.48Å; V66-P70 WeakPolarHBondContact O-CG 3.5Å; F67-P70 WeakPolarHBondContact O-CD 3.42Å; P70-A72 PolarHBondContact O-N 2.94Å; P70-Y73 PolarHBondContact O-N 3.1Å; P70-F74 HydrophobicContact CB-CD2 4.48Å; P70-F74 HydrophobicContact CB-CE2 4.14Å; P70-F74 WeakPolarHBondContact O-CB 3.31Å; P70-F74 WeakPolarHBondContact O-CD2 3.28Å; P70-F74 VanDerWaalsContact O-CG 3.23Å; P70-F74 WeakPolarHBondContact O-CG 3.31Å; P70-F74 PolarHBondContact O-N 2.96Å
71A96.4Very high95.6Very high16 Ų1685.8 Ų85.813%0.13243%0.431CS..Hα-helixtrans-60.3-4617700000111.8F67 I68 L69 W75 V88F67-A71 HydrophobicContact CE1-CB 4.31Å; F67-A71 WeakPolarHBondContact O-CB 3.49Å; F67-A71 PolarHBondContact O-N 2.73Å; F67-A71 VanDerWaalsContact O-N 3.08Å; I68-A71 PolarHBondContact O-N 3.45Å; L69-A71 PolarHBondContact O-N 3.42Å; A71-W75 VanDerWaalsContact O-CB 3.25Å; A71-W75 WeakPolarHBondContact O-CB 3.26Å; A71-W75 PolarHBondContact O-N 2.99Å; A71-V88 HydrophobicContact CB-CG1 3.93Å
72A96.9Very high95.6Very high57 Ų5788.4 Ų88.447%0.47146%0.455SS..Hα-helixtrans-63.8-43.9176.800000111.7I68 L69 P70 W75 Y76I68-A72 VanDerWaalsContact O-CB 3.3Å; I68-A72 WeakPolarHBondContact O-CB 3.39Å; I68-A72 PolarHBondContact O-N 3.46Å; L69-A72 PolarHBondContact O-N 3.29Å; P70-A72 PolarHBondContact O-N 2.94Å; A72-W75 PolarHBondContact O-N 2.85Å; A72-Y76 WeakPolarHBondContact O-CB 3.27Å; A72-Y76 PolarHBondContact O-N 3.06Å
73Y97.9Very high95.4Very high121 Ų12191.4 Ų91.448%0.47547%0.468SS..Hα-helixtrans-62-49.8177.1176.2-98.9000112.3L69 P70 W75 Y76 K77 F79L69-Y73 WeakPolarHBondContact O-CB 3.44Å; L69-Y73 PolarHBondContact O-N 3.14Å; P70-Y73 PolarHBondContact O-N 3.1Å; Y73-W75 VanDerWaalsContact C-N 3.28Å; Y73-W75 PolarHBondContact O-N 3.29Å; Y73-Y76 PolarHBondContact O-N 3.22Å; Y73-K77 HydrophobicContact CD2-CG 4.33Å; Y73-K77 HydrophobicContact CE1-CG 4.14Å; Y73-K77 HydrophobicContact CE2-CG 3.92Å; Y73-K77 WeakPolarHBondContact O-CB 3.43Å; Y73-K77 WeakPolarHBondContact O-CG 3.47Å; Y73-K77 PolarHBondContact O-N 3.47Å; Y73-F79 HydrophobicContact CE1-CE2 4.31Å
74F97.3Very high95.3Very high90 Ų9088.8 Ų88.840%0.39546%0.456SS..Hα-helixtrans-65.6-32178.3-65.3-25.7000112.6P70 G78 F79 L80P70-F74 HydrophobicContact CB-CD2 4.48Å; P70-F74 HydrophobicContact CB-CE2 4.14Å; P70-F74 WeakPolarHBondContact O-CB 3.31Å; P70-F74 WeakPolarHBondContact O-CD2 3.28Å; P70-F74 VanDerWaalsContact O-CG 3.23Å; P70-F74 WeakPolarHBondContact O-CG 3.31Å; P70-F74 PolarHBondContact O-N 2.96Å; F74-G78 PolarHBondContact O-N 3.12Å; F74-F79 HydrophobicContact CB-CB 4.23Å; F74-F79 HydrophobicContact CD1-CB 4.45Å; F74-F79 AromaticContact CD1-CD2 3.77Å; F74-F79 HydrophobicContact CD1-CD2 3.77Å; F74-F79 HydrophobicContact CE1-CD2 4.3Å; F74-F79 PolarHBondContact O-N 2.67Å; F74-L80 HydrophobicContact CB-CD2 3.83Å; F74-L80 HydrophobicContact CB-CG 3.91Å
75W97Very high95.3Very high116 Ų11692 Ų9244%0.43947%0.467SS..Hα-helixtrans-65.9-52.4172.9-170.9-76.3000111.2A71 A72 Y73 K77 G78 L80 K85 I89A71-W75 VanDerWaalsContact O-CB 3.25Å; A71-W75 WeakPolarHBondContact O-CB 3.26Å; A71-W75 PolarHBondContact O-N 2.99Å; A72-W75 PolarHBondContact O-N 2.85Å; Y73-W75 VanDerWaalsContact C-N 3.28Å; Y73-W75 PolarHBondContact O-N 3.29Å; W75-K77 VanDerWaalsContact C-N 3.32Å; W75-K77 PolarHBondContact O-N 2.88Å; W75-G78 PolarHBondContact O-N 3.43Å; W75-L80 HydrophobicContact CB-CD1 3.91Å; W75-L80 HydrophobicContact CD2-CD1 4.25Å; W75-L80 HydrophobicContact CE3-CD1 3.55Å; W75-L80 HydrophobicContact CG-CD1 4.46Å; W75-L80 HydrophobicContact CZ3-CD1 4.39Å; W75-K85 HydrophobicContact CE3-CG 4.28Å; W75-K85 HydrophobicContact CH2-CB 3.86Å; W75-K85 HydrophobicContact CH2-CD 3.75Å; W75-K85 HydrophobicContact CH2-CG 3.89Å; W75-K85 HydrophobicContact CZ2-CD 4.31Å; W75-K85 HydrophobicContact CZ3-CB 3.6Å; W75-K85 HydrophobicContact CZ3-CD 3.98Å; W75-K85 HydrophobicContact CZ3-CG 3.6Å; W75-I89 HydrophobicContact CH2-CD1 3.81Å; W75-I89 HydrophobicContact CH2-CG1 4.32Å; W75-I89 HydrophobicContact CZ3-CD1 4.04Å; W75-I89 HydrophobicContact CZ3-CG1 4.08Å
76Y97.2Very high95.4Very high189 Ų18993.4 Ų93.474%0.74147%0.474SS*.Hα-helixtrans-60-40.2-180174.1-106.3000112.5A72 Y73 G78A72-Y76 WeakPolarHBondContact O-CB 3.27Å; A72-Y76 PolarHBondContact O-N 3.06Å; Y73-Y76 PolarHBondContact O-N 3.22Å; Y76-G78 PolarHBondContact O-N 3.47Å
77K97.6Very high95.3Very high104 Ų10490 Ų9045%0.45245%0.454SS..THydrogen-bonded Turntrans-76.5-4.7176.1-69.5-59.7-169.1-179.30114.5Y73 W75 F79Y73-K77 HydrophobicContact CD2-CG 4.33Å; Y73-K77 HydrophobicContact CE1-CG 4.14Å; Y73-K77 HydrophobicContact CE2-CG 3.92Å; Y73-K77 WeakPolarHBondContact O-CB 3.43Å; Y73-K77 WeakPolarHBondContact O-CG 3.47Å; Y73-K77 PolarHBondContact O-N 3.47Å; W75-K77 VanDerWaalsContact C-N 3.32Å; W75-K77 PolarHBondContact O-N 2.88Å; K77-F79 VanDerWaalsContact C-N 3.26Å; K77-F79 HydrophobicContact CB-CD1 3.85Å; K77-F79 HydrophobicContact CB-CD2 4.11Å; K77-F79 HydrophobicContact CB-CE1 3.78Å; K77-F79 HydrophobicContact CB-CE2 4.04Å; K77-F79 HydrophobicContact CB-CG 4.01Å; K77-F79 HydrophobicContact CB-CZ 3.88Å; K77-F79 HydrophobicContact CG-CE2 4.45Å; K77-F79 HydrophobicContact CG-CZ 4.35Å; K77-F79 WeakPolarHBondContact O-CD1 3.24Å; K77-F79 PolarHBondContact O-N 2.93Å
78G96.1Very high95.3Very high56 Ų5689.2 Ų89.258%0.57745%0.453SS*.THydrogen-bonded Turntrans70.818-178.600000114.4F74 W75 Y76 L80F74-G78 PolarHBondContact O-N 3.12Å; W75-G78 PolarHBondContact O-N 3.43Å; Y76-G78 PolarHBondContact O-N 3.47Å; G78-L80 VanDerWaalsContact C-N 3.27Å; G78-L80 PolarHBondContact O-N 3.3Å
79F95.7Very high95.4Very high133 Ų13390.2 Ų90.258%0.58346%0.458SS*.  trans-75.8-16.6-179.1-65.6-6.6000112.9Y73 F74 K77 R81Y73-F79 HydrophobicContact CE1-CE2 4.31Å; F74-F79 HydrophobicContact CB-CB 4.23Å; F74-F79 HydrophobicContact CD1-CB 4.45Å; F74-F79 AromaticContact CD1-CD2 3.77Å; F74-F79 HydrophobicContact CD1-CD2 3.77Å; F74-F79 HydrophobicContact CE1-CD2 4.3Å; F74-F79 PolarHBondContact O-N 2.67Å; K77-F79 VanDerWaalsContact C-N 3.26Å; K77-F79 HydrophobicContact CB-CD1 3.85Å; K77-F79 HydrophobicContact CB-CD2 4.11Å; K77-F79 HydrophobicContact CB-CE1 3.78Å; K77-F79 HydrophobicContact CB-CE2 4.04Å; K77-F79 HydrophobicContact CB-CG 4.01Å; K77-F79 HydrophobicContact CB-CZ 3.88Å; K77-F79 HydrophobicContact CG-CE2 4.45Å; K77-F79 HydrophobicContact CG-CZ 4.35Å; K77-F79 WeakPolarHBondContact O-CD1 3.24Å; K77-F79 PolarHBondContact O-N 2.93Å; F79-R81 PolarHBondContact O-N 2.92Å
80L93.1Very high95.4Very high23 Ų2386.8 Ų86.812%0.1245%0.446CS..SBendtrans-79.7115.1179.4-61.4179.6000111.9F74 W75 G78 V84 K85 V88F74-L80 HydrophobicContact CB-CD2 3.83Å; F74-L80 HydrophobicContact CB-CG 3.91Å; W75-L80 HydrophobicContact CB-CD1 3.91Å; W75-L80 HydrophobicContact CD2-CD1 4.25Å; W75-L80 HydrophobicContact CE3-CD1 3.55Å; W75-L80 HydrophobicContact CG-CD1 4.46Å; W75-L80 HydrophobicContact CZ3-CD1 4.39Å; G78-L80 VanDerWaalsContact C-N 3.27Å; G78-L80 PolarHBondContact O-N 3.3Å; L80-V84 HydrophobicContact CD2-CG1 4.26Å; L80-K85 HydrophobicContact CB-CG 4.07Å; L80-K85 VanDerWaalsContact O-CE 3.3Å; L80-K85 WeakPolarHBondContact O-CE 3.41Å; L80-V88 HydrophobicContact CD1-CB 4.5Å; L80-V88 HydrophobicContact CD1-CG1 4.19Å; L80-V88 HydrophobicContact CD1-CG2 4.32Å; L80-V88 HydrophobicContact CD2-CG2 4.4Å
81R92Very high95.4Very high184 Ų18484.4 Ų84.469%0.69443%0.43SS*.  trans-58.4147.5170.3-62.1-177.9-175.9-175.30.7110.7F79 T83 V84 K85F79-R81 PolarHBondContact O-N 2.92Å; R81-T83 PolarHBondContact O-N 2.83Å; R81-T83 VanDerWaalsContact O-N 3.1Å; R81-V84 HydrophobicContact CB-CG2 4.37Å; R81-V84 PolarHBondContact O-N 3.44Å; R81-K85 PolarHBondContact O-N 2.75Å
82P91.7Very high95.5Very high106 Ų10684.5 Ų84.569%0.68843%0.433SS*.Hα-helixtrans-51.5-38.3-179.8-28.935.3000114.2V84 K85P82-V84 VanDerWaalsContact C-N 3.26Å; P82-V84 PolarHBondContact O-N 3.35Å; P82-K85 PolarHBondContact O-N 3Å
83T90.1Very high95.5Very high114 Ų11484.7 Ų84.770%0.69943%0.431SS*.Hα-helixtrans-68.6-19.9179.353.80000114.3R81 P87R81-T83 PolarHBondContact O-N 2.83Å; R81-T83 VanDerWaalsContact O-N 3.1Å; T83-P87 WeakPolarHBondContact O-CD 3.41Å
84V92Very high95.4Very high56 Ų5680.5 Ų80.534%0.33942%0.416SS..Hα-helixtrans-95.6-22.3-179.2179.20000111.7L80 R81 P82 I86 P87 V88L80-V84 HydrophobicContact CD2-CG1 4.26Å; R81-V84 HydrophobicContact CB-CG2 4.37Å; R81-V84 PolarHBondContact O-N 3.44Å; P82-V84 VanDerWaalsContact C-N 3.26Å; P82-V84 PolarHBondContact O-N 3.35Å; V84-I86 PolarHBondContact O-N 2.74Å; V84-P87 VanDerWaalsContact O-CD 3.3Å; V84-P87 WeakPolarHBondContact O-CD 3.32Å; V84-V88 HydrophobicContact CG1-CG2 3.81Å; V84-V88 WeakPolarHBondContact O-CG2 3.21Å; V84-V88 PolarHBondContact O-N 3.41Å
85K95.3Very high95.4Very high78 Ų7877.3 Ų77.334%0.33940%0.404SS..Hα-helixtrans-57.8-44.6-179.3-70.7-174.2176.9-175.20112.8W75 L80 R81 P82 V88 I89W75-K85 HydrophobicContact CE3-CG 4.28Å; W75-K85 HydrophobicContact CH2-CB 3.86Å; W75-K85 HydrophobicContact CH2-CD 3.75Å; W75-K85 HydrophobicContact CH2-CG 3.89Å; W75-K85 HydrophobicContact CZ2-CD 4.31Å; W75-K85 HydrophobicContact CZ3-CB 3.6Å; W75-K85 HydrophobicContact CZ3-CD 3.98Å; W75-K85 HydrophobicContact CZ3-CG 3.6Å; L80-K85 HydrophobicContact CB-CG 4.07Å; L80-K85 VanDerWaalsContact O-CE 3.3Å; L80-K85 WeakPolarHBondContact O-CE 3.41Å; R81-K85 PolarHBondContact O-N 2.75Å; P82-K85 PolarHBondContact O-N 3Å; K85-V88 PolarHBondContact O-N 3.34Å; K85-I89 WeakPolarHBondContact O-CG1 3.45Å; K85-I89 PolarHBondContact O-N 3.38Å
86I95.4Very high95.4Very high131 Ų13175.6 Ų75.667%0.67241%0.406SS*.Hα-helixtrans-63.5-52.1179.8-64.5168.8000111.3V84 V88 I89 A90V84-I86 PolarHBondContact O-N 2.74Å; I86-V88 VanDerWaalsContact C-N 3.31Å; I86-V88 PolarHBondContact O-N 3.43Å; I86-I89 PolarHBondContact O-N 2.94Å; I86-A90 WeakPolarHBondContact O-CB 3.42Å; I86-A90 PolarHBondContact O-N 3.41Å
87P94.8Very high95.3Very high37 Ų3770.5 Ų70.524%0.2439%0.392CS..Hα-helixtrans-55.6-40.1172.9-28.532.7000114.8T83 V84 A90 C91T83-P87 WeakPolarHBondContact O-CD 3.41Å; V84-P87 VanDerWaalsContact O-CD 3.3Å; V84-P87 WeakPolarHBondContact O-CD 3.32Å; P87-A90 PolarHBondContact O-N 3.12Å; P87-C91 WeakPolarHBondContact O-CB 3.42Å; P87-C91 PolarHBondContact O-N 2.88Å; P87-C91 PolarHBondContact O-SG 3.44Å
88V96.5Very high95.2Very high28 Ų2866.9 Ų66.917%0.1738%0.376CS..Hα-helixtrans-63.6-44.2178.4168.20000111.2A71 L80 V84 K85 I86 G92A71-V88 HydrophobicContact CB-CG1 3.93Å; L80-V88 HydrophobicContact CD1-CB 4.5Å; L80-V88 HydrophobicContact CD1-CG1 4.19Å; L80-V88 HydrophobicContact CD1-CG2 4.32Å; L80-V88 HydrophobicContact CD2-CG2 4.4Å; V84-V88 HydrophobicContact CG1-CG2 3.81Å; V84-V88 WeakPolarHBondContact O-CG2 3.21Å; V84-V88 PolarHBondContact O-N 3.41Å; K85-V88 PolarHBondContact O-N 3.34Å; I86-V88 VanDerWaalsContact C-N 3.31Å; I86-V88 PolarHBondContact O-N 3.43Å; V88-G92 PolarHBondContact O-N 2.89Å
89I96.8Very high95.1Very high93 Ų9365.9 Ų65.948%0.47737%0.366SS..Hα-helixtrans-61.6-46.8174.2-69166.7000110.3W75 K85 I86 G92 S93W75-I89 HydrophobicContact CH2-CD1 3.81Å; W75-I89 HydrophobicContact CH2-CG1 4.32Å; W75-I89 HydrophobicContact CZ3-CD1 4.04Å; W75-I89 HydrophobicContact CZ3-CG1 4.08Å; K85-I89 WeakPolarHBondContact O-CG1 3.45Å; K85-I89 PolarHBondContact O-N 3.38Å; I86-I89 PolarHBondContact O-N 2.94Å; I89-G92 PolarHBondContact O-N 3.01Å; I89-S93 WeakPolarHBondContact O-CB 3.29Å; I89-S93 PolarHBondContact O-N 3.3Å; I89-S93 PolarHBondContact O-OG 3.26Å; I89-S93 VanDerWaalsContact O-OG 3.05Å
90A96.9Very high95Very high38 Ų3864.2 Ų64.231%0.31436%0.363SS..Hα-helixtrans-60.8-49.2-179.300000112.2I86 P87 S93 L94 L137I86-A90 WeakPolarHBondContact O-CB 3.42Å; I86-A90 PolarHBondContact O-N 3.41Å; P87-A90 PolarHBondContact O-N 3.12Å; A90-S93 PolarHBondContact O-N 2.94Å; A90-L94 WeakPolarHBondContact O-CG 3.31Å; A90-L94 PolarHBondContact O-N 3.31Å; A90-L137 HydrophobicContact CB-CD2 3.88Å
91C97.4Very high95Very high3 Ų364.6 Ų64.62%0.0236%0.364CS..Hα-helixtrans-62.4-43.3175.1-72.30000112F67 P87 S93 L94 V95 L134 L137 L138F67-C91 HydrophobicContact CE1-CB 4.03Å; F67-C91 HydrophobicContact CE2-CB 3.86Å; F67-C91 HydrophobicContact CZ-CB 3.38Å; P87-C91 WeakPolarHBondContact O-CB 3.42Å; P87-C91 PolarHBondContact O-N 2.88Å; P87-C91 PolarHBondContact O-SG 3.44Å; C91-S93 PolarHBondContact O-N 2.87Å; C91-L94 PolarHBondContact O-N 2.95Å; C91-V95 WeakPolarHBondContact O-CG2 3.3Å; C91-V95 PolarHBondContact O-N 2.94Å; C91-L134 HydrophobicContact CB-CD1 4.1Å; C91-L137 WeakPolarHBondContact SG-CD2 3.21Å; C91-L137 VanDerWaalsContact SG-CG 3.59Å; C91-L138 HydrophobicContact CB-CD2 4.18Å
92G97Very high95Very high17 Ų1756.6 Ų56.618%0.17534%0.34CS..Hα-helixtrans-60.6-45.4178.100000112.4V88 I89 L94 V95 V96V88-G92 PolarHBondContact O-N 2.89Å; I89-G92 PolarHBondContact O-N 3.01Å; G92-L94 VanDerWaalsContact C-N 3.34Å; G92-L94 PolarHBondContact O-N 3.35Å; G92-V95 PolarHBondContact O-N 3.39Å; G92-V96 WeakPolarHBondContact O-CG2 3.33Å; G92-V96 PolarHBondContact O-N 3.35Å
93S96.9Very high94.9Very high62 Ų6256.3 Ų56.343%0.43433%0.325SS..Hα-helixtrans-60.4-42.5174.1-64.90000111.9I89 A90 C91 V96 L97I89-S93 WeakPolarHBondContact O-CB 3.29Å; I89-S93 PolarHBondContact O-N 3.3Å; I89-S93 PolarHBondContact O-OG 3.26Å; I89-S93 VanDerWaalsContact O-OG 3.05Å; A90-S93 PolarHBondContact O-N 2.94Å; C91-S93 PolarHBondContact O-N 2.87Å; S93-V96 PolarHBondContact O-N 2.86Å; S93-L97 WeakPolarHBondContact O-CB 3.43Å; S93-L97 VanDerWaalsContact O-CG 3.26Å; S93-L97 WeakPolarHBondContact O-CG 3.44Å; S93-L97 PolarHBondContact O-N 2.91Å
94L97.2Very high94.8Very high32 Ų3255.8 Ų55.817%0.16831%0.311CS..Hα-helixtrans-64.5-39.7176.4-74.1173.5000112.6A90 C91 G92 L97 Q98 L130 L134 L137A90-L94 WeakPolarHBondContact O-CG 3.31Å; A90-L94 PolarHBondContact O-N 3.31Å; C91-L94 PolarHBondContact O-N 2.95Å; G92-L94 VanDerWaalsContact C-N 3.34Å; G92-L94 PolarHBondContact O-N 3.35Å; L94-L97 PolarHBondContact O-N 3.37Å; L94-Q98 WeakPolarHBondContact O-CB 3.22Å; L94-Q98 VanDerWaalsContact O-CG 3.27Å; L94-Q98 WeakPolarHBondContact O-CG 3.15Å; L94-Q98 PolarHBondContact O-N 3.24Å; L94-L130 HydrophobicContact CD2-CD2 3.72Å; L94-L134 HydrophobicContact CB-CB 4.17Å; L94-L134 HydrophobicContact CB-CD1 4Å; L94-L134 HydrophobicContact CB-CG 4.48Å; L94-L134 HydrophobicContact CD1-CB 4.21Å; L94-L134 HydrophobicContact CD1-CD1 4.45Å; L94-L137 HydrophobicContact CD1-CD2 4.19Å
95V97.2Very high94.7Very high24 Ų2454.3 Ų54.315%0.14530%0.3CS..Hα-helixtrans-60.4-45.2174.4169.50000111F67 I68 C91 G92 Q98 G99 L134F67-V95 HydrophobicContact CD1-CG2 4.17Å; F67-V95 HydrophobicContact CG-CG2 4.47Å; I68-V95 HydrophobicContact CD1-CG1 3.87Å; I68-V95 HydrophobicContact CG1-CG1 4.3Å; C91-V95 WeakPolarHBondContact O-CG2 3.3Å; C91-V95 PolarHBondContact O-N 2.94Å; G92-V95 PolarHBondContact O-N 3.39Å; V95-Q98 WeakPolarHBondContact O-CB 3.26Å; V95-Q98 PolarHBondContact O-N 3.34Å; V95-G99 PolarHBondContact O-N 3.43Å; V95-L134 HydrophobicContact CG2-CD1 4.13Å; V95-L134 HydrophobicContact CG2-CD2 3.73Å
96V95.6Very high94.1Very high79 Ų7951.8 Ų51.848%0.47929%0.291SS..Hα-helixtrans-65.1-45.1177.2174.20000110.9G92 S93 Q98 G99 L100G92-V96 WeakPolarHBondContact O-CG2 3.33Å; G92-V96 PolarHBondContact O-N 3.35Å; S93-V96 PolarHBondContact O-N 2.86Å; V96-Q98 VanDerWaalsContact C-N 3.3Å; V96-Q98 PolarHBondContact O-N 3.48Å; V96-G99 PolarHBondContact O-N 2.93Å; V96-G99 VanDerWaalsContact O-N 3.15Å; V96-L100 HydrophobicContact CG1-CD1 3.97Å; V96-L100 HydrophobicContact CG1-CG 4.32Å; V96-L100 WeakPolarHBondContact O-CG 3.38Å; V96-L100 PolarHBondContact O-N 3.5Å
97L96.2Very high93.6Very high83 Ų8351.8 Ų51.844%0.43529%0.287SS..Hα-helixtrans-61.2-36.2177.1-75171000112.6S93 L94 L100 L101S93-L97 WeakPolarHBondContact O-CB 3.43Å; S93-L97 VanDerWaalsContact O-CG 3.26Å; S93-L97 WeakPolarHBondContact O-CG 3.44Å; S93-L97 PolarHBondContact O-N 2.91Å; L94-L97 PolarHBondContact O-N 3.37Å; L97-L100 PolarHBondContact O-N 3.24Å; L97-L101 VanDerWaalsContact O-CB 3.22Å; L97-L101 WeakPolarHBondContact O-CB 3.36Å; L97-L101 PolarHBondContact O-N 3.4Å
98Q96Very high92.8Very high28 Ų2850.5 Ų50.513%0.13128%0.279CS..Hα-helixtrans-58.8-47.9172.9-79.7-68.9-58.900111.3L94 V95 V96 G102 H127 A131 L134L94-Q98 WeakPolarHBondContact O-CB 3.22Å; L94-Q98 VanDerWaalsContact O-CG 3.27Å; L94-Q98 WeakPolarHBondContact O-CG 3.15Å; L94-Q98 PolarHBondContact O-N 3.24Å; V95-Q98 WeakPolarHBondContact O-CB 3.26Å; V95-Q98 PolarHBondContact O-N 3.34Å; V96-Q98 VanDerWaalsContact C-N 3.3Å; V96-Q98 PolarHBondContact O-N 3.48Å; Q98-G102 PolarHBondContact O-N 2.85Å; Q98-H127 PolarHBondContact NE2-O 2.87Å; Q98-H127 PolarHBondContact O-CE1 3.49Å; Q98-H127 VanDerWaalsContact O-CE1 3.31Å; Q98-H127 PolarHBondContact OE1-CE1 3.2Å; Q98-H127 PolarHBondContact OE1-ND1 2.87Å; Q98-A131 VanDerWaalsContact NE2-N 3.11Å; Q98-L134 HydrophobicContact CG-CD2 4.4Å
99G93.4Very high91.7Very high35 Ų3550 Ų5036%0.36128%0.279SS..Hα-helixtrans-62.8-45.2176.900000113V95 V96 G102 W103V95-G99 PolarHBondContact O-N 3.43Å; V96-G99 PolarHBondContact O-N 2.93Å; V96-G99 VanDerWaalsContact O-N 3.15Å; G99-G102 PolarHBondContact O-N 3.25Å; G99-W103 WeakPolarHBondContact O-CB 3.49Å; G99-W103 PolarHBondContact O-N 3.04Å
100L93.6Very high90.4Very high98 Ų9847.8 Ų47.851%0.51327%0.268SS..Hα-helixtrans-64.3-44178.6-69.6175.3000112.3V96 L97 W103 Y104V96-L100 HydrophobicContact CG1-CD1 3.97Å; V96-L100 HydrophobicContact CG1-CG 4.32Å; V96-L100 WeakPolarHBondContact O-CG 3.38Å; V96-L100 PolarHBondContact O-N 3.5Å; L97-L100 PolarHBondContact O-N 3.24Å; L100-W103 PolarHBondContact O-N 2.86Å; L100-Y104 PolarHBondContact O-N 3.46Å
101L93.1Very high89.1Confident30 Ų3049 Ų4916%0.15727%0.269CS..Hα-helixtrans-70.7-37.6179.1-173.956.1000111.7L97 Y104 M105 H127 L130L97-L101 VanDerWaalsContact O-CB 3.22Å; L97-L101 WeakPolarHBondContact O-CB 3.36Å; L97-L101 PolarHBondContact O-N 3.4Å; L101-Y104 HydrophobicContact CD1-CD1 4.06Å; L101-Y104 PolarHBondContact O-N 3.3Å; L101-M105 WeakPolarHBondContact O-CG 3.3Å; L101-M105 PolarHBondContact O-N 3.26Å; L101-H127 VanDerWaalsContact CD2-CA 3.49Å; L101-H127 HydrophobicContact CD2-CB 3.81Å; L101-H127 VanDerWaalsContact CD2-N 3.34Å; L101-H127 HydrophobicContact CG-CB 4.07Å; L101-L130 HydrophobicContact CD2-CD1 3.84Å
102G91.6Very high87.4Confident17 Ų1753.5 Ų53.518%0.17530%0.296CS..Hα-helixtrans-61.5-44.6172.400000112.1Q98 G99 Y104 M105 V106Q98-G102 PolarHBondContact O-N 2.85Å; G99-G102 PolarHBondContact O-N 3.25Å; G102-Y104 VanDerWaalsContact C-N 3.32Å; G102-Y104 PolarHBondContact O-N 2.83Å; G102-M105 PolarHBondContact O-N 3.08Å; G102-V106 WeakPolarHBondContact O-CG2 3.38Å; G102-V106 PolarHBondContact O-N 2.99Å; G102-V106 VanDerWaalsContact O-N 3.09Å
103W89.6Confident85.6Confident100 Ų10059.5 Ų59.538%0.37933%0.325SS..Hα-helixtrans-57.3-45.2171.3167.576.5000112W4 G99 L100 M105 V106 K107W4-W103 HydrophobicContact CD2-CB 4.14Å; W4-W103 AromaticContact CD2-CD1 3.58Å; W4-W103 HydrophobicContact CD2-CG 4.24Å; W4-W103 AromaticContact CE3-CD1 3.6Å; W4-W103 HydrophobicContact CE3-CG 4.37Å; W4-W103 AromaticContact CG-CD1 3.83Å; W4-W103 HydrophobicContact CH2-CB 4.48Å; W4-W103 HydrophobicContact CZ2-CB 4.01Å; G99-W103 WeakPolarHBondContact O-CB 3.49Å; G99-W103 PolarHBondContact O-N 3.04Å; L100-W103 PolarHBondContact O-N 2.86Å; W103-M105 PolarHBondContact O-N 3.4Å; W103-V106 PolarHBondContact O-N 2.65Å; W103-K107 HydrophobicContact CH2-CD 4.08Å; W103-K107 HydrophobicContact CZ2-CD 3.73Å; W103-K107 WeakPolarHBondContact O-CB 3.33Å; W103-K107 PolarHBondContact O-N 2.91Å
104Y88.7Confident83.6Confident102 Ų10259.5 Ų59.540%0.432%0.318SS..Hα-helixtrans-64.5-38.5178.8-179.1-128.5000112.8L100 L101 G102 S108 R123L100-Y104 PolarHBondContact O-N 3.46Å; L101-Y104 HydrophobicContact CD1-CD1 4.06Å; L101-Y104 PolarHBondContact O-N 3.3Å; G102-Y104 VanDerWaalsContact C-N 3.32Å; G102-Y104 PolarHBondContact O-N 2.83Å; Y104-S108 WeakPolarHBondContact O-CB 3.36Å; Y104-S108 PolarHBondContact O-N 2.87Å; Y104-S108 PolarHBondContact O-OG 3.4Å; Y104-R123 HydrophobicContact CD1-CG 4.17Å; Y104-R123 HydrophobicContact CE1-CG 3.89Å; Y104-R123 PolarHBondContact OH-NE 3.28Å; Y104-R123 PolarHBondContact OH-NH2 2.79Å
105M88.8Confident81.4Confident25 Ų2564.6 Ų64.612%0.12336%0.356CS..Hα-helixtrans-60.2-46.9173.6-74.8169.866.100111.7L101 G102 W103 S108 G109 V119 R123 L124 H127L101-M105 WeakPolarHBondContact O-CG 3.3Å; L101-M105 PolarHBondContact O-N 3.26Å; G102-M105 PolarHBondContact O-N 3.08Å; W103-M105 PolarHBondContact O-N 3.4Å; M105-S108 PolarHBondContact O-OG 3.43Å; M105-G109 PolarHBondContact O-N 2.87Å; M105-V119 HydrophobicContact CB-CG1 3.97Å; M105-V119 HydrophobicContact CE-CG1 3.83Å; M105-V119 HydrophobicContact CG-CG1 3.78Å; M105-R123 HydrophobicContact CG-CB 3.77Å; M105-L124 HydrophobicContact CE-CB 4.37Å; M105-L124 HydrophobicContact CE-CD1 3.9Å; M105-H127 HydrophobicContact CE-CB 4.3Å; M105-H127 HydrophobicContact SD-CB 3.33Å; M105-H127 WeakPolarHBondContact SD-CB 3.39Å; M105-H127 VanDerWaalsContact SD-CG 3.56Å
106V84.3Confident79.5Confident25 Ų2565.2 Ų65.215%0.15236%0.364CS..Hα-helixtrans-63.7-55.2178.1176.10000110.4R57 G102 W103 S108 G109 L110R57-V106 VanDerWaalsContact NH2-CG2 3.26Å; G102-V106 WeakPolarHBondContact O-CG2 3.38Å; G102-V106 PolarHBondContact O-N 2.99Å; G102-V106 VanDerWaalsContact O-N 3.09Å; W103-V106 PolarHBondContact O-N 2.65Å; V106-S108 PolarHBondContact O-N 2.89Å; V106-S108 VanDerWaalsContact O-N 3.14Å; V106-G109 PolarHBondContact O-N 2.87Å; V106-G109 VanDerWaalsContact O-N 3.13Å; V106-L110 HydrophobicContact CG1-CD1 4.16Å; V106-L110 WeakPolarHBondContact O-CG 3.33Å; V106-L110 PolarHBondContact O-N 3.35Å
107K83.1Confident77.5Confident132 Ų13262.4 Ų62.457%0.57435%0.347SS*.Hα-helixtrans-53-42-178.9-178.7179.7178.8-177.40112W103W103-K107 HydrophobicContact CH2-CD 4.08Å; W103-K107 HydrophobicContact CZ2-CD 3.73Å; W103-K107 WeakPolarHBondContact O-CB 3.33Å; W103-K107 PolarHBondContact O-N 2.91Å
108S78.4Confident76.1Confident10 Ų1062.1 Ų62.17%0.0734%0.34CS..Hα-helixtrans-82.5-20.9-175.767.30000115Y104 M105 V106 L110 Q114 R123Y104-S108 WeakPolarHBondContact O-CB 3.36Å; Y104-S108 PolarHBondContact O-N 2.87Å; Y104-S108 PolarHBondContact O-OG 3.4Å; M105-S108 PolarHBondContact O-OG 3.43Å; V106-S108 PolarHBondContact O-N 2.89Å; V106-S108 VanDerWaalsContact O-N 3.14Å; S108-L110 VanDerWaalsContact C-N 3.3Å; S108-Q114 PolarHBondContact O-NE2 3.24Å; S108-R123 VanDerWaalsContact CB-CZ 3.45Å; S108-R123 WeakPolarHBondContact OG-CD 3.35Å; S108-R123 VanDerWaalsContact OG-CZ 3.3Å; S108-R123 PolarHBondContact OG-NE 3Å; S108-R123 PolarHBondContact OG-NH1 3.18Å
109G73.4Confident75.1Confident17 Ų1763.3 Ų63.318%0.17535%0.349CS..Hα-helixtrans-76-19.4171.200000113.2M105 V106M105-G109 PolarHBondContact O-N 2.87Å; V106-G109 PolarHBondContact O-N 2.87Å; V106-G109 VanDerWaalsContact O-N 3.13Å
110L71Confident74.8Confident47 Ų4763.1 Ų63.125%0.24634%0.342CS..SBendtrans-89.7-3.3177.6-58.7176.5000113.5V2 Y29 V106 S108 T112V2-L110 HydrophobicContact CB-CD1 4.32Å; V2-L110 HydrophobicContact CB-CD2 4.15Å; V2-L110 HydrophobicContact CG1-CD2 3.97Å; V2-L110 WeakPolarHBondContact O-CD1 3.4Å; Y29-L110 HydrophobicContact CD1-CB 3.89Å; Y29-L110 HydrophobicContact CD1-CD2 3.39Å; Y29-L110 HydrophobicContact CD1-CG 4.13Å; Y29-L110 HydrophobicContact CD2-CD2 4.41Å; Y29-L110 HydrophobicContact CE1-CB 3.73Å; Y29-L110 HydrophobicContact CE1-CD1 4.09Å; Y29-L110 HydrophobicContact CE1-CD2 3.52Å; Y29-L110 HydrophobicContact CE1-CG 3.94Å; Y29-L110 HydrophobicContact CG-CD2 3.85Å; V106-L110 HydrophobicContact CG1-CD1 4.16Å; V106-L110 WeakPolarHBondContact O-CG 3.33Å; V106-L110 PolarHBondContact O-N 3.35Å; S108-L110 VanDerWaalsContact C-N 3.3Å; L110-T112 PolarHBondContact O-N 3.44Å
111D68.3Low74.6Confident62 Ų6259.8 Ų59.833%0.33232%0.324SS..  trans-69.9116.4178.9-176.51.4000110.7N113D111-N113 PolarHBondContact O-N 3.45Å; D111-N113 WeakPolarHBondContact OD1-CB 3.39Å; D111-N113 PolarHBondContact OD1-N 3.31Å; D111-N113 PolarHBondContact OD1-ND2 2.95Å
112T60.9Low74.7Confident98 Ų9862.1 Ų62.160%0.60133%0.331SS*.THydrogen-bonded Turntrans-72.9-13.9-177.352.60000113.8P30 L110 Q114P30-T112 HydrophobicContact CG-CG2 4.43Å; L110-T112 PolarHBondContact O-N 3.44Å; T112-Q114 VanDerWaalsContact C-N 3.29Å; T112-Q114 PolarHBondContact O-N 2.99Å
113N61.2Low74.8Confident144 Ų14463.6 Ų63.677%0.7733%0.332SS*.THydrogen-bonded Turntrans-81.5-6.5-177.8-63.1-36.6000113.5D111D111-N113 PolarHBondContact O-N 3.45Å; D111-N113 WeakPolarHBondContact OD1-CB 3.39Å; D111-N113 PolarHBondContact OD1-N 3.31Å; D111-N113 PolarHBondContact OD1-ND2 2.95Å
114Q53.3Low74.9Confident62 Ų6261.4 Ų61.429%0.2933%0.327SS..SBendtrans-86.2130.3178.6-71.2175.45200111.2S108 T112 A116S108-Q114 PolarHBondContact O-NE2 3.24Å; T112-Q114 VanDerWaalsContact C-N 3.29Å; T112-Q114 PolarHBondContact O-N 2.99Å; Q114-A116 PolarHBondContact O-N 2.8Å
115S52.1Low75.3Confident138 Ų13856.9 Ų56.997%0.96531%0.31SS*.SBendtrans-65.4-15.1179.239.90000114.2
116A55.9Low75.7Confident38 Ų3858.5 Ų58.531%0.31432%0.324SS..SBendtrans-134.9123.7167.100000109.4Q114 R118Q114-A116 PolarHBondContact O-N 2.8Å; A116-R118 HydrophobicContact CB-CG 4.42Å; A116-R118 PolarHBondContact O-N 2.99Å
117P55.4Low76.3Confident19 Ų1958.6 Ų58.612%0.12332%0.322CS..  trans-77.971.8-179.631.1-33.4000110.2P30 E31 Y34P30-P117 VanDerWaalsContact C-CB 3.46Å; P30-P117 HydrophobicContact CB-CB 3.65Å; P30-P117 HydrophobicContact CB-CG 3.98Å; P30-P117 HydrophobicContact CG-CB 3.92Å; P30-P117 VanDerWaalsContact O-CG 3.29Å; P30-P117 WeakPolarHBondContact O-CG 3.34Å; E31-P117 HydrophobicContact CB-CB 4.31Å; E31-P117 VanDerWaalsContact N-CB 3.31Å; Y34-P117 HydrophobicContact CG-CG 4.27Å
118R66.8Low76.9Confident78 Ų7854.3 Ų54.329%0.29431%0.306SS..  trans-132.1138-178.7-57.7-174.8-147.5179.42.9109.2Y34 A116 S120Y34-R118 PolarHBondContact OH-NH2 3.43Å; A116-R118 HydrophobicContact CB-CG 4.42Å; A116-R118 PolarHBondContact O-N 2.99Å; R118-S120 PolarHBondContact O-N 3.25Å
119V73.6Confident77.8Confident53 Ų5356.2 Ų56.232%0.32132%0.317SS..  trans-58125.2166.5-178.10000107.5M105 H121 R123 L124M105-V119 HydrophobicContact CB-CG1 3.97Å; M105-V119 HydrophobicContact CE-CG1 3.83Å; M105-V119 HydrophobicContact CG-CG1 3.78Å; V119-H121 PolarHBondContact O-N 3.26Å; V119-R123 HydrophobicContact CG1-CB 4.08Å; V119-L124 HydrophobicContact CG1-CB 4.5Å
120S87Confident79Confident31 Ų3158 Ų5822%0.21732%0.322CS..  trans-49.1130.7175.9172.40000110.3R118 Y122 R123 L124R118-S120 PolarHBondContact O-N 3.25Å; S120-Y122 PolarHBondContact O-N 2.93Å; S120-Y122 VanDerWaalsContact O-N 3.12Å; S120-Y122 PolarHBondContact OG-N 3.44Å; S120-R123 PolarHBondContact O-N 3.27Å; S120-L124 PolarHBondContact O-N 2.78Å
121H90.9Very high80.3Confident27 Ų2757.2 Ų57.213%0.12532%0.323CS..Hα-helixtrans-56.3-29.1177.756.9-87.2000111.9V119 T125 L185 F217V119-H121 PolarHBondContact O-N 3.26Å; H121-T125 WeakPolarHBondContact O-CB 3.28Å; H121-T125 PolarHBondContact O-N 2.98Å; H121-T125 PolarHBondContact O-OG1 3.38Å; H121-L185 HydrophobicContact CB-CD2 4.4Å; H121-L185 HydrophobicContact CB-CG 4.08Å; H121-L185 WeakPolarHBondContact ND1-CD2 3.31Å; H121-F217 PolarHBondContact NE2-O 3.15Å
122Y93.6Very high81.7Confident80 Ų8055.7 Ų55.731%0.31431%0.313SS..Hα-helixtrans-62.8-47.9170.6-64-66.3000112.3S120 T125 S126 F217 E218S120-Y122 PolarHBondContact O-N 2.93Å; S120-Y122 VanDerWaalsContact O-N 3.12Å; S120-Y122 PolarHBondContact OG-N 3.44Å; Y122-T125 PolarHBondContact O-N 2.86Å; Y122-S126 VanDerWaalsContact O-CB 3.31Å; Y122-S126 WeakPolarHBondContact O-CB 3.38Å; Y122-S126 PolarHBondContact O-N 2.92Å; Y122-S126 PolarHBondContact O-OG 2.86Å; Y122-F217 HydrophobicContact CE1-CB 3.93Å; Y122-F217 HydrophobicContact CE1-CG 4.48Å; Y122-E218 HydrophobicContact CE2-CG 4.41Å; Y122-E218 WeakPolarHBondContact OH-CG 3.46Å; Y122-E218 PolarHBondContact OH-OE1 2.96Å
123R93.5Very high83.4Confident48 Ų4852.8 Ų52.818%0.18130%0.303CS..Hα-helixtrans-66-45.3-179.6-62.4176.8-171.7129.54.5111.2Y104 M105 S108 V119 S120 S126 H127Y104-R123 HydrophobicContact CD1-CG 4.17Å; Y104-R123 HydrophobicContact CE1-CG 3.89Å; Y104-R123 PolarHBondContact OH-NE 3.28Å; Y104-R123 PolarHBondContact OH-NH2 2.79Å; M105-R123 HydrophobicContact CG-CB 3.77Å; S108-R123 VanDerWaalsContact CB-CZ 3.45Å; S108-R123 WeakPolarHBondContact OG-CD 3.35Å; S108-R123 VanDerWaalsContact OG-CZ 3.3Å; S108-R123 PolarHBondContact OG-NE 3Å; S108-R123 PolarHBondContact OG-NH1 3.18Å; V119-R123 HydrophobicContact CG1-CB 4.08Å; S120-R123 PolarHBondContact O-N 3.27Å; R123-S126 PolarHBondContact O-N 3.29Å; R123-H127 WeakPolarHBondContact O-CB 3.43Å; R123-H127 PolarHBondContact O-N 3.29Å
124L93.4Very high85.1Confident53 Ų5347 Ų4728%0.27727%0.272SS..Hα-helixtrans-57.2-51.7175.3177.568.1000111.2M105 V119 S120 S126 H127 L128M105-L124 HydrophobicContact CE-CB 4.37Å; M105-L124 HydrophobicContact CE-CD1 3.9Å; V119-L124 HydrophobicContact CG1-CB 4.5Å; S120-L124 PolarHBondContact O-N 2.78Å; L124-S126 PolarHBondContact O-N 2.84Å; L124-H127 PolarHBondContact O-N 3.44Å; L124-L128 WeakPolarHBondContact O-CB 3.4Å; L124-L128 PolarHBondContact O-N 2.81Å
125T96.6Very high87.3Confident7 Ų748.1 Ų48.14%0.04327%0.274CS..Hα-helixtrans-62.9-42.9-179-57.80000111.3H121 Y122 H127 L128 T129 V177 G180 L181H121-T125 WeakPolarHBondContact O-CB 3.28Å; H121-T125 PolarHBondContact O-N 2.98Å; H121-T125 PolarHBondContact O-OG1 3.38Å; Y122-T125 PolarHBondContact O-N 2.86Å; T125-H127 PolarHBondContact O-N 3.29Å; T125-L128 PolarHBondContact O-N 2.9Å; T125-T129 VanDerWaalsContact O-CB 3.24Å; T125-T129 WeakPolarHBondContact O-CB 3.43Å; T125-T129 PolarHBondContact O-N 3.13Å; T125-T129 PolarHBondContact O-OG1 3.25Å; T125-V177 HydrophobicContact CG2-CG1 3.88Å; T125-V177 VanDerWaalsContact CG2-O 3.3Å; T125-V177 WeakPolarHBondContact CG2-O 3.33Å; T125-G180 PolarHBondContact OG1-O 3.04Å; T125-L181 HydrophobicContact CG2-CD2 4.26Å; T125-L181 HydrophobicContact CG2-CG 4.11Å; T125-L181 PolarHBondContact OG1-N 3.16Å; T125-L181 VanDerWaalsContact OG1-N 3.09Å
126S96.9Very high89.5Confident59 Ų5942.1 Ų42.141%0.41323%0.234SC..Hα-helixtrans-61.8-42.8176.4-68.50000111.9Y122 R123 L124 T129 L130Y122-S126 VanDerWaalsContact O-CB 3.31Å; Y122-S126 WeakPolarHBondContact O-CB 3.38Å; Y122-S126 PolarHBondContact O-N 2.92Å; Y122-S126 PolarHBondContact O-OG 2.86Å; R123-S126 PolarHBondContact O-N 3.29Å; L124-S126 PolarHBondContact O-N 2.84Å; S126-T129 PolarHBondContact O-N 3.42Å; S126-L130 WeakPolarHBondContact O-CB 3.42Å; S126-L130 VanDerWaalsContact O-CG 3.28Å; S126-L130 WeakPolarHBondContact O-CG 3.42Å; S126-L130 PolarHBondContact O-N 3.15Å
127H96.7Very high91.4Very high27 Ų2742.7 Ų42.713%0.12523%0.231CC..Hα-helixtrans-64-47.6178.6-172.168.3000111.4Q98 L101 M105 R123 L124 T125 T129 L130 A131Q98-H127 PolarHBondContact NE2-O 2.87Å; Q98-H127 PolarHBondContact O-CE1 3.49Å; Q98-H127 VanDerWaalsContact O-CE1 3.31Å; Q98-H127 PolarHBondContact OE1-CE1 3.2Å; Q98-H127 PolarHBondContact OE1-ND1 2.87Å; L101-H127 VanDerWaalsContact CD2-CA 3.49Å; L101-H127 HydrophobicContact CD2-CB 3.81Å; L101-H127 VanDerWaalsContact CD2-N 3.34Å; L101-H127 HydrophobicContact CG-CB 4.07Å; M105-H127 HydrophobicContact CE-CB 4.3Å; M105-H127 HydrophobicContact SD-CB 3.33Å; M105-H127 WeakPolarHBondContact SD-CB 3.39Å; M105-H127 VanDerWaalsContact SD-CG 3.56Å; R123-H127 WeakPolarHBondContact O-CB 3.43Å; R123-H127 PolarHBondContact O-N 3.29Å; L124-H127 PolarHBondContact O-N 3.44Å; T125-H127 PolarHBondContact O-N 3.29Å; H127-T129 PolarHBondContact O-N 2.98Å; H127-L130 PolarHBondContact O-N 3.39Å; H127-A131 WeakPolarHBondContact O-CB 3.44Å; H127-A131 PolarHBondContact O-N 3.39Å
128L96.3Very high93.4Very high43 Ų4344.6 Ų44.623%0.22524%0.24CC..Hα-helixtrans-60.7-46.1176.4-171.666.6000112.2L124 T125 L130 A131 F132L124-L128 WeakPolarHBondContact O-CB 3.4Å; L124-L128 PolarHBondContact O-N 2.81Å; T125-L128 PolarHBondContact O-N 2.9Å; L128-L130 PolarHBondContact O-N 3.08Å; L128-A131 WeakPolarHBondContact O-CB 3.33Å; L128-A131 PolarHBondContact O-N 3.35Å; L128-F132 HydrophobicContact CD1-CD1 4.39Å; L128-F132 HydrophobicContact CD1-CE1 3.61Å; L128-F132 HydrophobicContact CD1-CE2 3.88Å; L128-F132 HydrophobicContact CD1-CZ 3.34Å; L128-F132 HydrophobicContact CD2-CE2 3.87Å; L128-F132 HydrophobicContact CD2-CZ 4.03Å; L128-F132 HydrophobicContact CG-CD2 4.12Å; L128-F132 HydrophobicContact CG-CE1 4.16Å; L128-F132 HydrophobicContact CG-CE2 3.54Å; L128-F132 HydrophobicContact CG-CZ 3.58Å; L128-F132 VanDerWaalsContact O-CG 3.31Å; L128-F132 WeakPolarHBondContact O-CG 3.38Å; L128-F132 PolarHBondContact O-N 3.45Å
129T97.7Very high94.9Very high49 Ų4942.4 Ų42.430%0.30123%0.234SC..Hα-helixtrans-63.5-44.1-179.2-58.20000111.3T125 S126 H127 A131 F132 G133 V177T125-T129 VanDerWaalsContact O-CB 3.24Å; T125-T129 WeakPolarHBondContact O-CB 3.43Å; T125-T129 PolarHBondContact O-N 3.13Å; T125-T129 PolarHBondContact O-OG1 3.25Å; S126-T129 PolarHBondContact O-N 3.42Å; H127-T129 PolarHBondContact O-N 2.98Å; T129-A131 VanDerWaalsContact C-N 3.31Å; T129-A131 PolarHBondContact O-N 3.38Å; T129-F132 PolarHBondContact O-N 2.86Å; T129-G133 PolarHBondContact O-N 3.41Å; T129-V177 HydrophobicContact CG2-CG2 3.93Å
130L97.7Very high96Very high55 Ų5542.8 Ų42.829%0.28823%0.23SC..Hα-helixtrans-65.7-34.6175.7-73.4173.6000111.7L94 L101 S126 H127 L128 G133 L134L94-L130 HydrophobicContact CD2-CD2 3.72Å; L101-L130 HydrophobicContact CD2-CD1 3.84Å; S126-L130 WeakPolarHBondContact O-CB 3.42Å; S126-L130 VanDerWaalsContact O-CG 3.28Å; S126-L130 WeakPolarHBondContact O-CG 3.42Å; S126-L130 PolarHBondContact O-N 3.15Å; H127-L130 PolarHBondContact O-N 3.39Å; L128-L130 PolarHBondContact O-N 3.08Å; L130-G133 PolarHBondContact O-N 2.91Å; L130-L134 WeakPolarHBondContact O-CB 3.33Å; L130-L134 PolarHBondContact O-N 3.36Å
131A97.7Very high96.3Very high31 Ų3143.1 Ų43.126%0.25623%0.231SC..Hα-helixtrans-66.2-45176.100000111.2Q98 H127 L128 T129 G133 L134 Y135Q98-A131 VanDerWaalsContact NE2-N 3.11Å; H127-A131 WeakPolarHBondContact O-CB 3.44Å; H127-A131 PolarHBondContact O-N 3.39Å; L128-A131 WeakPolarHBondContact O-CB 3.33Å; L128-A131 PolarHBondContact O-N 3.35Å; T129-A131 VanDerWaalsContact C-N 3.31Å; T129-A131 PolarHBondContact O-N 3.38Å; A131-G133 VanDerWaalsContact C-N 3.34Å; A131-G133 PolarHBondContact O-N 2.82Å; A131-L134 PolarHBondContact O-N 2.89Å; A131-Y135 WeakPolarHBondContact O-CB 3.5Å; A131-Y135 PolarHBondContact O-N 3.5Å
132F97.8Very high96.5Very high30 Ų3044.9 Ų44.913%0.13225%0.247CC..Hα-helixtrans-64.9-37.9174.9-63.5-16.4000112.3L128 T129 Y135 G136 F292 M293 L296L128-F132 HydrophobicContact CD1-CD1 4.39Å; L128-F132 HydrophobicContact CD1-CE1 3.61Å; L128-F132 HydrophobicContact CD1-CE2 3.88Å; L128-F132 HydrophobicContact CD1-CZ 3.34Å; L128-F132 HydrophobicContact CD2-CE2 3.87Å; L128-F132 HydrophobicContact CD2-CZ 4.03Å; L128-F132 HydrophobicContact CG-CD2 4.12Å; L128-F132 HydrophobicContact CG-CE1 4.16Å; L128-F132 HydrophobicContact CG-CE2 3.54Å; L128-F132 HydrophobicContact CG-CZ 3.58Å; L128-F132 VanDerWaalsContact O-CG 3.31Å; L128-F132 WeakPolarHBondContact O-CG 3.38Å; L128-F132 PolarHBondContact O-N 3.45Å; T129-F132 PolarHBondContact O-N 2.86Å; F132-Y135 PolarHBondContact O-N 3.48Å; F132-G136 PolarHBondContact O-N 3.49Å; F132-F292 HydrophobicContact CD2-CD1 4.11Å; F132-F292 AromaticContact CD2-CE1 3.46Å; F132-F292 HydrophobicContact CD2-CE1 3.46Å; F132-F292 VanDerWaalsContact CD2-CE1 3.46Å; F132-F292 HydrophobicContact CD2-CZ 4.46Å; F132-F292 AromaticContact CE2-CD1 3.57Å; F132-F292 HydrophobicContact CE2-CD1 3.57Å; F132-F292 AromaticContact CE2-CE1 3.39Å; F132-F292 HydrophobicContact CE2-CE1 3.39Å; F132-F292 HydrophobicContact CG-CE1 4.08Å; F132-F292 AromaticContact CZ-CD1 3.79Å; F132-F292 HydrophobicContact CZ-CD1 3.79Å; F132-F292 AromaticContact CZ-CE1 4Å; F132-F292 HydrophobicContact CZ-CE1 4Å; F132-M293 HydrophobicContact CD1-CE 3.19Å; F132-M293 HydrophobicContact CD1-SD 3.62Å; F132-M293 HydrophobicContact CD2-CE 4.15Å; F132-M293 HydrophobicContact CE1-CE 3.08Å; F132-M293 HydrophobicContact CE1-SD 3.56Å; F132-M293 VanDerWaalsContact CE1-SD 3.56Å; F132-M293 HydrophobicContact CE2-CE 4.03Å; F132-M293 HydrophobicContact CG-CE 3.73Å; F132-M293 HydrophobicContact CZ-CE 3.5Å; F132-M293 HydrophobicContact CZ-SD 4.47Å; F132-L296 HydrophobicContact CB-CD2 4.12Å
133G97.4Very high96.6Very high37 Ų3741.7 Ų41.738%0.38124%0.235SC..Hα-helixtrans-63-45.7173.600000112.6T129 L130 A131 G136 L137T129-G133 PolarHBondContact O-N 3.41Å; L130-G133 PolarHBondContact O-N 2.91Å; A131-G133 VanDerWaalsContact C-N 3.34Å; A131-G133 PolarHBondContact O-N 2.82Å; G133-G136 PolarHBondContact O-N 3.46Å; G133-L137 WeakPolarHBondContact O-CB 3.29Å; G133-L137 PolarHBondContact O-N 3.48Å
134L97.8Very high96.5Very high23 Ų2341.4 Ų41.412%0.1224%0.243CC..Hα-helixtrans-60.4-48.6174.7173.759.1000111.3C91 L94 V95 Q98 L130 A131 G136 L137 L138C91-L134 HydrophobicContact CB-CD1 4.1Å; L94-L134 HydrophobicContact CB-CB 4.17Å; L94-L134 HydrophobicContact CB-CD1 4Å; L94-L134 HydrophobicContact CB-CG 4.48Å; L94-L134 HydrophobicContact CD1-CB 4.21Å; L94-L134 HydrophobicContact CD1-CD1 4.45Å; V95-L134 HydrophobicContact CG2-CD1 4.13Å; V95-L134 HydrophobicContact CG2-CD2 3.73Å; Q98-L134 HydrophobicContact CG-CD2 4.4Å; L130-L134 WeakPolarHBondContact O-CB 3.33Å; L130-L134 PolarHBondContact O-N 3.36Å; A131-L134 PolarHBondContact O-N 2.89Å; L134-G136 PolarHBondContact O-N 2.99Å; L134-L137 PolarHBondContact O-N 2.88Å; L134-L138 HydrophobicContact CD1-CD1 3.81Å; L134-L138 HydrophobicContact CD1-CG 4Å; L134-L138 HydrophobicContact CG-CD1 4.01Å; L134-L138 WeakPolarHBondContact O-CB 3.34Å; L134-L138 WeakPolarHBondContact O-CG 3.34Å; L134-L138 PolarHBondContact O-N 3.49Å
135Y98Very high96.3Very high84 Ų8446 Ų4633%0.32926%0.263SS..Hα-helixtrans-56.7-50.6176.1172.8-96.6000111.8A131 F132 L137 L138 L139 M293 L296 T297A131-Y135 WeakPolarHBondContact O-CB 3.5Å; A131-Y135 PolarHBondContact O-N 3.5Å; F132-Y135 PolarHBondContact O-N 3.48Å; Y135-L137 VanDerWaalsContact C-N 3.34Å; Y135-L137 PolarHBondContact O-N 3.35Å; Y135-L138 PolarHBondContact O-N 2.91Å; Y135-L139 HydrophobicContact CE1-CD2 4.08Å; Y135-L139 VanDerWaalsContact O-CB 3.32Å; Y135-L139 WeakPolarHBondContact O-CB 3.38Å; Y135-L139 PolarHBondContact O-N 2.72Å; Y135-M293 HydrophobicContact CD1-SD 4.44Å; Y135-L296 HydrophobicContact CD1-CD2 3.8Å; Y135-L296 HydrophobicContact CD1-CG 4.33Å; Y135-L296 HydrophobicContact CE1-CD2 4.31Å; Y135-L296 HydrophobicContact CE1-CG 4.42Å; Y135-T297 PolarHBondContact OH-OG1 3.3Å
136G98Very high96.1Very high12 Ų1251.2 Ų51.212%0.12429%0.29CS..Hα-helixtrans-61.9-40-18000000112.8F132 G133 L134 W140F132-G136 PolarHBondContact O-N 3.49Å; G133-G136 PolarHBondContact O-N 3.46Å; L134-G136 PolarHBondContact O-N 2.99Å; G136-W140 WeakPolarHBondContact O-CB 3.35Å; G136-W140 PolarHBondContact O-N 2.92Å
137L97Very high95.7Very high50 Ų5051.2 Ų51.226%0.26228%0.282SS..Hα-helixtrans-67.7-46177.5-176.660.2000111.8A90 C91 L94 G133 L134 Y135 W140 C141A90-L137 HydrophobicContact CB-CD2 3.88Å; C91-L137 WeakPolarHBondContact SG-CD2 3.21Å; C91-L137 VanDerWaalsContact SG-CG 3.59Å; L94-L137 HydrophobicContact CD1-CD2 4.19Å; G133-L137 WeakPolarHBondContact O-CB 3.29Å; G133-L137 PolarHBondContact O-N 3.48Å; L134-L137 PolarHBondContact O-N 2.88Å; Y135-L137 VanDerWaalsContact C-N 3.34Å; Y135-L137 PolarHBondContact O-N 3.35Å; L137-W140 PolarHBondContact O-N 3.26Å; L137-C141 WeakPolarHBondContact O-CB 3.45Å; L137-C141 PolarHBondContact O-N 2.9Å; L137-C141 PolarHBondContact O-SG 3.47Å
138L97.1Very high94.8Very high60 Ų6054.8 Ų54.831%0.31431%0.308SS..Hα-helixtrans-58.8-49.8175.1-73.9171.2000110.7F67 C91 L134 Y135 W140 C141 S142F67-L138 HydrophobicContact CD2-CD2 4.07Å; F67-L138 HydrophobicContact CE2-CD2 3.77Å; C91-L138 HydrophobicContact CB-CD2 4.18Å; L134-L138 HydrophobicContact CD1-CD1 3.81Å; L134-L138 HydrophobicContact CD1-CG 4Å; L134-L138 HydrophobicContact CG-CD1 4.01Å; L134-L138 WeakPolarHBondContact O-CB 3.34Å; L134-L138 WeakPolarHBondContact O-CG 3.34Å; L134-L138 PolarHBondContact O-N 3.49Å; Y135-L138 PolarHBondContact O-N 2.91Å; L138-W140 VanDerWaalsContact C-N 3.35Å; L138-W140 PolarHBondContact O-N 3.29Å; L138-C141 PolarHBondContact O-N 3.38Å; L138-S142 WeakPolarHBondContact O-CB 3.4Å; L138-S142 PolarHBondContact O-N 2.86Å; L138-S142 PolarHBondContact O-OG 3Å
139L97.7Very high93.9Very high31 Ų3156.5 Ų56.516%0.16232%0.32CS..Hα-helixtrans-58.1-46.8177.7178.363.8000111.6Y135 C141 S142 L143 T297 T300Y135-L139 HydrophobicContact CE1-CD2 4.08Å; Y135-L139 VanDerWaalsContact O-CB 3.32Å; Y135-L139 WeakPolarHBondContact O-CB 3.38Å; Y135-L139 PolarHBondContact O-N 2.72Å; L139-C141 PolarHBondContact O-N 3.04Å; L139-S142 PolarHBondContact O-N 3.47Å; L139-L143 HydrophobicContact CD1-CD1 3.93Å; L139-L143 HydrophobicContact CD1-CG 4.03Å; L139-L143 HydrophobicContact CG-CD1 3.91Å; L139-L143 HydrophobicContact CG-CG 4.4Å; L139-L143 WeakPolarHBondContact O-CB 3.32Å; L139-L143 VanDerWaalsContact O-CG 3.26Å; L139-L143 WeakPolarHBondContact O-CG 3.39Å; L139-L143 PolarHBondContact O-N 3.03Å; L139-T297 HydrophobicContact CD2-CG2 3.86Å; L139-T300 HydrophobicContact CD2-CG2 4.14Å; L139-T300 HydrophobicContact CG-CG2 4.38Å
140W96.3Very high92.7Very high62 Ų6257.8 Ų57.824%0.23533%0.325CS..Hα-helixtrans-58.6-46.3178.2177.2-93.7000112.1G136 L137 L138 A144 T300 L303 N304 R307G136-W140 WeakPolarHBondContact O-CB 3.35Å; G136-W140 PolarHBondContact O-N 2.92Å; L137-W140 PolarHBondContact O-N 3.26Å; L138-W140 VanDerWaalsContact C-N 3.35Å; L138-W140 PolarHBondContact O-N 3.29Å; W140-A144 VanDerWaalsContact O-CB 3.29Å; W140-A144 WeakPolarHBondContact O-CB 3.41Å; W140-A144 PolarHBondContact O-N 2.93Å; W140-T300 HydrophobicContact CB-CG2 4.18Å; W140-T300 HydrophobicContact CE3-CG2 3.98Å; W140-L303 HydrophobicContact CH2-CD2 4.45Å; W140-L303 HydrophobicContact CH2-CG 4.18Å; W140-L303 HydrophobicContact CZ3-CB 4.16Å; W140-L303 HydrophobicContact CZ3-CD2 4.16Å; W140-L303 HydrophobicContact CZ3-CG 3.94Å; W140-N304 HydrophobicContact CE3-CB 3.86Å; W140-N304 HydrophobicContact CZ3-CB 3.76Å; W140-N304 PolarHBondContact O-ND2 3.48Å; W140-R307 VanDerWaalsContact CZ2-NH1 3.26Å
141C94.8Very high91.3Very high37 Ų3761.4 Ų61.425%0.2534%0.34CS..Hα-helixtrans-64.9-44.6178-72.70000111.9L137 L138 L139 A144 H145L137-C141 WeakPolarHBondContact O-CB 3.45Å; L137-C141 PolarHBondContact O-N 2.9Å; L137-C141 PolarHBondContact O-SG 3.47Å; L138-C141 PolarHBondContact O-N 3.38Å; L139-C141 PolarHBondContact O-N 3.04Å; C141-A144 PolarHBondContact O-N 3.27Å; C141-H145 WeakPolarHBondContact O-CB 3.33Å; C141-H145 PolarHBondContact O-N 3.49Å
142S95.1Very high89.9Confident64 Ų6466.9 Ų66.945%0.44837%0.365SS..Hα-helixtrans-60.2-47.2176.3-63.80000111.6L138 L139 A144 H145 L146L138-S142 WeakPolarHBondContact O-CB 3.4Å; L138-S142 PolarHBondContact O-N 2.86Å; L138-S142 PolarHBondContact O-OG 3Å; L139-S142 PolarHBondContact O-N 3.47Å; S142-A144 PolarHBondContact O-N 2.91Å; S142-H145 PolarHBondContact O-N 3.4Å; S142-L146 WeakPolarHBondContact O-CB 3.35Å; S142-L146 VanDerWaalsContact O-CG 3.32Å; S142-L146 WeakPolarHBondContact O-CG 3.46Å; S142-L146 PolarHBondContact O-N 3.24Å
143L95Very high88.6Confident13 Ų1368.7 Ų68.77%0.06837%0.372CS..Hα-helixtrans-65-39.5178.3-71173.5000112.3L139 H145 F147 W301 N304 R308L139-L143 HydrophobicContact CD1-CD1 3.93Å; L139-L143 HydrophobicContact CD1-CG 4.03Å; L139-L143 HydrophobicContact CG-CD1 3.91Å; L139-L143 HydrophobicContact CG-CG 4.4Å; L139-L143 WeakPolarHBondContact O-CB 3.32Å; L139-L143 VanDerWaalsContact O-CG 3.26Å; L139-L143 WeakPolarHBondContact O-CG 3.39Å; L139-L143 PolarHBondContact O-N 3.03Å; L143-H145 VanDerWaalsContact C-N 3.27Å; L143-H145 PolarHBondContact O-N 3.47Å; L143-F147 HydrophobicContact CD2-CD2 4.13Å; L143-F147 HydrophobicContact CD2-CE2 3.91Å; L143-F147 PolarHBondContact O-N 2.87Å; L143-F147 VanDerWaalsContact O-N 3.11Å; L143-W301 HydrophobicContact CD1-CB 3.77Å; L143-W301 HydrophobicContact CD1-CG 3.83Å; L143-W301 HydrophobicContact CD2-CD2 4.38Å; L143-W301 HydrophobicContact CD2-CG 4.26Å; L143-N304 HydrophobicContact CB-CB 4.4Å; L143-N304 HydrophobicContact CD1-CB 4.28Å; L143-R308 PolarHBondContact O-NH2 2.92Å; L143-R308 VanDerWaalsContact O-NH2 3.09Å
144A91.8Very high87.9Confident42 Ų4271.5 Ų71.535%0.34738%0.377SS..Hα-helixtrans-66.4-31.3176.700000112.3W140 C141 S142W140-A144 VanDerWaalsContact O-CB 3.29Å; W140-A144 WeakPolarHBondContact O-CB 3.41Å; W140-A144 PolarHBondContact O-N 2.93Å; C141-A144 PolarHBondContact O-N 3.27Å; S142-A144 PolarHBondContact O-N 2.91Å
145H89.8Confident87.4Confident151 Ų15170.9 Ų70.970%0.69937%0.374SS*.Hα-helixtrans-78-46.2176.6-175.464.7000112.6C141 S142 L143 F147C141-H145 WeakPolarHBondContact O-CB 3.33Å; C141-H145 PolarHBondContact O-N 3.49Å; S142-H145 PolarHBondContact O-N 3.4Å; L143-H145 VanDerWaalsContact C-N 3.27Å; L143-H145 PolarHBondContact O-N 3.47Å; H145-F147 VanDerWaalsContact C-N 3.28Å; H145-F147 PolarHBondContact O-N 3.46Å
146L91.9Very high86.9Confident115 Ų11571.4 Ų71.460%0.60239%0.388SS*.Hα-helixtrans-67.6-28.5-178.3-72.2172000112.9S142S142-L146 WeakPolarHBondContact O-CB 3.35Å; S142-L146 VanDerWaalsContact O-CG 3.32Å; S142-L146 WeakPolarHBondContact O-CG 3.46Å; S142-L146 PolarHBondContact O-N 3.24Å
147F88.2Confident86.6Confident60 Ų6073 Ų7326%0.26340%0.404SS..SBendtrans-134.190.3-173.4-53.9-56.2000110.6L143 H145 R308L143-F147 HydrophobicContact CD2-CD2 4.13Å; L143-F147 HydrophobicContact CD2-CE2 3.91Å; L143-F147 PolarHBondContact O-N 2.87Å; L143-F147 VanDerWaalsContact O-N 3.11Å; H145-F147 VanDerWaalsContact C-N 3.28Å; H145-F147 PolarHBondContact O-N 3.46Å; F147-R308 WeakPolarHBondContact O-CD 3.42Å; F147-R308 PolarHBondContact O-NE 3.29Å
148P78.6Confident86.4Confident101 Ų10170.8 Ų70.866%0.65639%0.393SS*.  trans-66.3163.8-179.926.5-33.6000112.5N150P148-N150 PolarHBondContact O-N 3.06Å
149V77.6Confident86.2Confident80 Ų8075.2 Ų75.249%0.48541%0.409SS..  trans-61.2132.6177.4-179.30000109.6H151 R308V149-H151 WeakPolarHBondContact CG1-NE2 3.29Å; V149-R308 WeakPolarHBondContact CG1-O 3.45Å; V149-R308 HydrophobicContact CG2-CB 4.46Å; V149-R308 HydrophobicContact CG2-CG 4.27Å
150N71.4Confident86.1Confident76 Ų7681.8 Ų81.841%0.40643%0.432SS..  trans-120114.9171.9-178.8-15.5000108.1P148 N152 Y153P148-N150 PolarHBondContact O-N 3.06Å; N150-N152 VanDerWaalsContact C-N 3.3Å; N150-N152 PolarHBondContact O-N 3.31Å; N150-N152 VanDerWaalsContact OD1-CB 3.28Å; N150-N152 WeakPolarHBondContact OD1-CB 3.25Å; N150-N152 PolarHBondContact OD1-N 3.21Å; N150-Y153 HydrophobicContact CB-CE1 4.07Å; N150-Y153 VanDerWaalsContact O-CE1 3.3Å; N150-Y153 WeakPolarHBondContact O-CE1 3.34Å
151H68.2Low86.1Confident130 Ų13078.8 Ų78.860%0.60242%0.421SS*.  trans-82.6-2-174.2-67.5-77.2000113.9V149 Y153V149-H151 WeakPolarHBondContact CG1-NE2 3.29Å; H151-Y153 VanDerWaalsContact C-N 3.25Å; H151-Y153 PolarHBondContact O-N 3.05Å; H151-Y153 VanDerWaalsContact O-N 3.14Å
152N68.1Low86.2Confident147 Ų14779.2 Ų79.279%0.78642%0.417SS*.SBendtrans-829.1-165.8-64.2-5.1000115N150N150-N152 VanDerWaalsContact C-N 3.3Å; N150-N152 PolarHBondContact O-N 3.31Å; N150-N152 VanDerWaalsContact OD1-CB 3.28Å; N150-N152 WeakPolarHBondContact OD1-CB 3.25Å; N150-N152 PolarHBondContact OD1-N 3.21Å
153Y71.1Confident86.3Confident68 Ų6878.5 Ų78.527%0.26742%0.415SS..  trans-144.5118.6179.660.1-80.3000112.1N150 H151 I155 M309N150-Y153 HydrophobicContact CB-CE1 4.07Å; N150-Y153 VanDerWaalsContact O-CE1 3.3Å; N150-Y153 WeakPolarHBondContact O-CE1 3.34Å; H151-Y153 VanDerWaalsContact C-N 3.25Å; H151-Y153 PolarHBondContact O-N 3.05Å; H151-Y153 VanDerWaalsContact O-N 3.14Å; Y153-I155 HydrophobicContact CD2-CD1 4.02Å; Y153-I155 HydrophobicContact CD2-CG1 4.13Å; Y153-I155 HydrophobicContact CE2-CD1 4.31Å; Y153-M309 HydrophobicContact CD2-CG 4.5Å; Y153-M309 HydrophobicContact CE2-CB 4.15Å; Y153-M309 HydrophobicContact CE2-CE 3.84Å; Y153-M309 HydrophobicContact CE2-CG 3.49Å; Y153-M309 VanDerWaalsContact CE2-CG 3.49Å; Y153-M309 HydrophobicContact CE2-SD 3.78Å
154L83.1Confident86.5Confident95 Ų9579.2 Ų79.250%0.49742%0.419SS..  trans-99.1118.5175.5-69.7163.3000109.2P310 K312L154-P310 HydrophobicContact CD2-CB 3.81Å; L154-P310 HydrophobicContact CD2-CG 3.61Å; L154-P310 HydrophobicContact CG-CG 4.36Å; L154-K312 HydrophobicContact CB-CG 4.48Å; L154-K312 HydrophobicContact CD1-CG 4.37Å; L154-K312 HydrophobicContact CD2-CG 3.89Å; L154-K312 HydrophobicContact CG-CG 4.49Å
155I86.8Confident86.8Confident10 Ų1077.2 Ų77.25%0.05140%0.402CS..  trans-106.4115.8178.5-59.3-176.2000109.3Y153 G157 V158 M248 P249 L250 M309Y153-I155 HydrophobicContact CD2-CD1 4.02Å; Y153-I155 HydrophobicContact CD2-CG1 4.13Å; Y153-I155 HydrophobicContact CE2-CD1 4.31Å; I155-G157 PolarHBondContact O-N 3.27Å; I155-V158 HydrophobicContact CB-CB 4.23Å; I155-V158 HydrophobicContact CG2-CB 4.5Å; I155-V158 WeakPolarHBondContact O-CB 3.49Å; I155-V158 WeakPolarHBondContact O-CG1 3.49Å; I155-V158 PolarHBondContact O-N 3.37Å; I155-M248 HydrophobicContact CG2-CB 4.08Å; I155-M248 HydrophobicContact CG2-CG 4.33Å; I155-M248 HydrophobicContact CG2-SD 4.25Å; I155-P249 WeakPolarHBondContact CD1-O 3.22Å; I155-P249 HydrophobicContact CG2-CG 4.26Å; I155-L250 HydrophobicContact CD1-CD2 3.94Å; I155-M309 HydrophobicContact CD1-CE 4.49Å; I155-M309 HydrophobicContact CD1-SD 3.76Å
156P88.2Confident87.2Confident96 Ų9672 Ų7262%0.62339%0.386SS*.THydrogen-bonded Turntrans-54.8135.8174.2-25.634.7000111.9V158P156-V158 VanDerWaalsContact C-N 3.28Å; P156-V158 PolarHBondContact O-N 3.16Å
157G91.2Very high87.5Confident45 Ų4571.3 Ų71.346%0.46438%0.382SS..THydrogen-bonded Turntrans76.92.6178.200000115.8I155 K159 R160 L161 M248I155-G157 PolarHBondContact O-N 3.27Å; G157-K159 PolarHBondContact O-N 3.43Å; G157-K159 VanDerWaalsContact O-N 3.1Å; G157-R160 WeakPolarHBondContact O-CB 3.38Å; G157-R160 PolarHBondContact O-N 3Å; G157-L161 PolarHBondContact O-N 3.31Å; G157-M248 WeakPolarHBondContact O-CE 3.36Å
158V92.2Very high88Confident3 Ų368.5 Ų68.52%0.01837%0.37CS..Hα-helixtrans-59.4-25.2-179.573.90000113.6I155 P156 L161 R162 L306 M309I155-V158 HydrophobicContact CB-CB 4.23Å; I155-V158 HydrophobicContact CG2-CB 4.5Å; I155-V158 WeakPolarHBondContact O-CB 3.49Å; I155-V158 WeakPolarHBondContact O-CG1 3.49Å; I155-V158 PolarHBondContact O-N 3.37Å; P156-V158 VanDerWaalsContact C-N 3.28Å; P156-V158 PolarHBondContact O-N 3.16Å; V158-L161 PolarHBondContact O-N 2.89Å; V158-R162 WeakPolarHBondContact O-CB 3.3Å; V158-R162 WeakPolarHBondContact O-CG 3.37Å; V158-R162 PolarHBondContact O-N 3.06Å; V158-R162 PolarHBondContact O-NE 3.01Å; V158-R162 VanDerWaalsContact O-NE 3.14Å; V158-L306 HydrophobicContact CG2-CD2 4.28Å; V158-M309 HydrophobicContact CG2-CB 3.94Å; V158-M309 HydrophobicContact CG2-CG 4.41Å; V158-M309 HydrophobicContact CG2-SD 3.85Å
159K93.9Very high89Confident153 Ų15365.2 Ų65.267%0.66535%0.346SS*.Hα-helixtrans-59.6-45.2171.2-168.9177.8178.5178.10111.9G157 R162 A163 V311G157-K159 PolarHBondContact O-N 3.43Å; G157-K159 VanDerWaalsContact O-N 3.1Å; K159-R162 VanDerWaalsContact CA-NH2 3.31Å; K159-R162 PolarHBondContact O-N 3.07Å; K159-A163 PolarHBondContact O-N 3.38Å; K159-V311 HydrophobicContact CB-CG1 3.82Å; K159-V311 HydrophobicContact CD-CG1 4.08Å; K159-V311 HydrophobicContact CG-CG1 4.12Å
160R95.6Very high90Very high169 Ų16963.3 Ų63.364%0.63834%0.343SS*.Hα-helixtrans-65.2-44.9177.7-176.6179.4179.3175.81.3111.2G157 R162 A163 L164G157-R160 WeakPolarHBondContact O-CB 3.38Å; G157-R160 PolarHBondContact O-N 3Å; R160-R162 VanDerWaalsContact C-N 3.32Å; R160-R162 PolarHBondContact O-N 3.42Å; R160-A163 PolarHBondContact O-N 3.23Å; R160-L164 HydrophobicContact CG-CD1 4.22Å; R160-L164 WeakPolarHBondContact O-CG 3.41Å; R160-L164 PolarHBondContact O-N 3.48Å
161L96.7Very high91.3Very high0 Ų060.2 Ų60.20%033%0.328CS..Hα-helixtrans-62.8-40.1178.4-176.561.3000111.8G157 V158 L164 T165 T241 V244 M248 L250 L306G157-L161 PolarHBondContact O-N 3.31Å; V158-L161 PolarHBondContact O-N 2.89Å; L161-L164 PolarHBondContact O-N 2.99Å; L161-T165 WeakPolarHBondContact O-CB 3.33Å; L161-T165 PolarHBondContact O-N 3.4Å; L161-T165 PolarHBondContact O-OG1 3.49Å; L161-T241 HydrophobicContact CD1-CG2 3.87Å; L161-T241 WeakPolarHBondContact CD1-O 3.46Å; L161-V244 HydrophobicContact CB-CG1 4.4Å; L161-V244 HydrophobicContact CD1-CB 4.48Å; L161-V244 HydrophobicContact CD1-CG1 4.28Å; L161-M248 HydrophobicContact CB-CE 4.08Å; L161-M248 HydrophobicContact CB-SD 3.9Å; L161-M248 HydrophobicContact CD2-SD 3.63Å; L161-M248 HydrophobicContact CG-SD 4.34Å; L161-L250 HydrophobicContact CD2-CD1 4.21Å; L161-L250 HydrophobicContact CD2-CD2 4.12Å; L161-L306 HydrophobicContact CD2-CD1 4.03Å; L161-L306 HydrophobicContact CD2-CD2 3.59Å; L161-L306 HydrophobicContact CD2-CG 4.47Å; L161-L306 HydrophobicContact CG-CD1 3.73Å; L161-L306 HydrophobicContact CG-CD2 4.19Å
162R96Very high92.8Very high45 Ų4554.1 Ų54.117%0.1730%0.3CS..Hα-helixtrans-62.1-45.9173.5-80.3178.8-70.2159.94112.8V158 K159 R160 T165 A166 L306 V311V158-R162 WeakPolarHBondContact O-CB 3.3Å; V158-R162 WeakPolarHBondContact O-CG 3.37Å; V158-R162 PolarHBondContact O-N 3.06Å; V158-R162 PolarHBondContact O-NE 3.01Å; V158-R162 VanDerWaalsContact O-NE 3.14Å; K159-R162 VanDerWaalsContact CA-NH2 3.31Å; K159-R162 PolarHBondContact O-N 3.07Å; R160-R162 VanDerWaalsContact C-N 3.32Å; R160-R162 PolarHBondContact O-N 3.42Å; R162-T165 PolarHBondContact O-N 3.15Å; R162-A166 WeakPolarHBondContact O-CB 3.29Å; R162-A166 PolarHBondContact O-N 3.42Å; R162-L306 WeakPolarHBondContact CD-O 3.42Å; R162-L306 HydrophobicContact CG-CB 3.43Å; R162-L306 VanDerWaalsContact CG-CB 3.43Å; R162-L306 HydrophobicContact CG-CD1 4.22Å; R162-L306 HydrophobicContact CG-CG 4.42Å; R162-V311 VanDerWaalsContact NH2-CB 3.34Å
163A97.6Very high94.2Very high50 Ų5049.1 Ų49.141%0.41328%0.279SS..Hα-helixtrans-59.9-47.1177.400000111.1K159 R160 T165 A166 L167K159-A163 PolarHBondContact O-N 3.38Å; R160-A163 PolarHBondContact O-N 3.23Å; A163-T165 VanDerWaalsContact C-N 3.35Å; A163-T165 PolarHBondContact O-N 2.88Å; A163-A166 PolarHBondContact O-N 3.37Å; A163-L167 WeakPolarHBondContact O-CB 3.29Å; A163-L167 VanDerWaalsContact O-CG 3.29Å; A163-L167 WeakPolarHBondContact O-CG 3.36Å; A163-L167 PolarHBondContact O-N 3.38Å
164L98.3Very high95.5Very high27 Ų2749.7 Ų49.714%0.14129%0.286CS..Hα-helixtrans-62.2-40.2176.5-71.9173000112.7R160 L161 L167 S168 A240 T241 V244R160-L164 HydrophobicContact CG-CD1 4.22Å; R160-L164 WeakPolarHBondContact O-CG 3.41Å; R160-L164 PolarHBondContact O-N 3.48Å; L161-L164 PolarHBondContact O-N 2.99Å; L164-L167 PolarHBondContact O-N 2.93Å; L164-S168 WeakPolarHBondContact O-CB 3.46Å; L164-S168 PolarHBondContact O-N 3.34Å; L164-S168 PolarHBondContact O-OG 3.43Å; L164-A240 HydrophobicContact CD2-CB 4.47Å; L164-T241 WeakPolarHBondContact CB-OG1 3.5Å; L164-T241 PolarHBondContact O-OG1 2.83Å; L164-V244 HydrophobicContact CD1-CB 4.11Å; L164-V244 HydrophobicContact CD1-CG1 4.42Å; L164-V244 HydrophobicContact CD1-CG2 3.75Å
165T98.5Very high96.2Very high0 Ų045.9 Ų45.90%027%0.267CS..Hα-helixtrans-66.6-42176.8-530000111.3L161 R162 A163 S168 L169 T241 L302 L303 L306L161-T165 WeakPolarHBondContact O-CB 3.33Å; L161-T165 PolarHBondContact O-N 3.4Å; L161-T165 PolarHBondContact O-OG1 3.49Å; R162-T165 PolarHBondContact O-N 3.15Å; A163-T165 VanDerWaalsContact C-N 3.35Å; A163-T165 PolarHBondContact O-N 2.88Å; T165-S168 WeakPolarHBondContact O-CB 3.43Å; T165-S168 PolarHBondContact O-N 3.49Å; T165-L169 PolarHBondContact O-N 3.24Å; T165-T241 WeakPolarHBondContact OG1-CG2 3.3Å; T165-L302 HydrophobicContact CG2-CB 3.91Å; T165-L302 HydrophobicContact CG2-CD2 3.82Å; T165-L302 HydrophobicContact CG2-CG 3.81Å; T165-L303 HydrophobicContact CG2-CB 3.83Å; T165-L303 HydrophobicContact CG2-CD1 4.38Å; T165-L306 HydrophobicContact CG2-CD1 4.34Å; T165-L306 VanDerWaalsContact OG1-CD1 3.26Å; T165-L306 WeakPolarHBondContact OG1-CD1 3.43Å
166A98.5Very high96.8Very high43 Ų4346.1 Ų46.136%0.35527%0.27SS..Hα-helixtrans-64.5-4217600000111.9R162 A163 S168 L169 G170 L303R162-A166 WeakPolarHBondContact O-CB 3.29Å; R162-A166 PolarHBondContact O-N 3.42Å; A163-A166 PolarHBondContact O-N 3.37Å; A166-S168 VanDerWaalsContact C-N 3.35Å; A166-L169 PolarHBondContact O-N 2.91Å; A166-G170 PolarHBondContact O-N 2.94Å; A166-L303 HydrophobicContact CB-CD1 4.08Å; A166-L303 HydrophobicContact CB-CD2 4.22Å
167L98.7Very high97.3Very high100 Ų10043.2 Ų43.252%0.52425%0.25SS..Hα-helixtrans-62.3-41.8172.9-72170.4000111.5A163 L164 G170 A171 L237A163-L167 WeakPolarHBondContact O-CB 3.29Å; A163-L167 VanDerWaalsContact O-CG 3.29Å; A163-L167 WeakPolarHBondContact O-CG 3.36Å; A163-L167 PolarHBondContact O-N 3.38Å; L164-L167 PolarHBondContact O-N 2.93Å; L167-G170 PolarHBondContact O-N 3.24Å; L167-A171 VanDerWaalsContact O-CB 3.25Å; L167-A171 WeakPolarHBondContact O-CB 3.25Å; L167-A171 PolarHBondContact O-N 3.26Å; L167-L237 HydrophobicContact CB-CD1 4.35Å; L167-L237 HydrophobicContact CB-CD2 4.2Å
168S98.8Very high97.6Very high0 Ų043.2 Ų43.20%024%0.236CC..Hα-helixtrans-62.9-42.9176.8-590000111.9L164 T165 A166 S172 L237 T241L164-S168 WeakPolarHBondContact O-CB 3.46Å; L164-S168 PolarHBondContact O-N 3.34Å; L164-S168 PolarHBondContact O-OG 3.43Å; T165-S168 WeakPolarHBondContact O-CB 3.43Å; T165-S168 PolarHBondContact O-N 3.49Å; A166-S168 VanDerWaalsContact C-N 3.35Å; S168-S172 VanDerWaalsContact O-CB 3.31Å; S168-S172 WeakPolarHBondContact O-CB 3.33Å; S168-S172 PolarHBondContact O-N 2.94Å; S168-S172 PolarHBondContact O-OG 2.99Å; S168-L237 PolarHBondContact OG-O 2.78Å; S168-T241 PolarHBondContact OG-OG1 3.46Å
169L98.7Very high97.9Very high32 Ų3243.9 Ų43.917%0.16824%0.244CC..Hα-helixtrans-64.4-46.4175.1177.560.3000111.5T165 A166 S172 A173 L296 A299 L303T165-L169 PolarHBondContact O-N 3.24Å; A166-L169 PolarHBondContact O-N 2.91Å; L169-S172 WeakPolarHBondContact O-CB 3.31Å; L169-S172 PolarHBondContact O-N 2.85Å; L169-A173 WeakPolarHBondContact O-CB 3.49Å; L169-A173 PolarHBondContact O-N 3.08Å; L169-L296 HydrophobicContact CD1-CD1 3.63Å; L169-A299 HydrophobicContact CB-CB 4.33Å; L169-A299 HydrophobicContact CD1-CB 3.91Å; L169-L303 HydrophobicContact CD2-CD2 3.77Å
170G98.5Very high98.1Very high40 Ų4036.6 Ų36.641%0.41221%0.212SC..Hα-helixtrans-62.2-44.1177.900000112.7A166 L167 A173 L174A166-G170 PolarHBondContact O-N 2.94Å; L167-G170 PolarHBondContact O-N 3.24Å; G170-A173 PolarHBondContact O-N 3.12Å; G170-L174 WeakPolarHBondContact O-CB 3.19Å; G170-L174 PolarHBondContact O-N 3.49Å
171A98.7Very high98.1Very high11 Ų1128.8 Ų28.89%0.09118%0.183CC..Hα-helixtrans-64.8-39.6175.400000111.8L167 L174 T175 T234 L237L167-A171 VanDerWaalsContact O-CB 3.25Å; L167-A171 WeakPolarHBondContact O-CB 3.25Å; L167-A171 PolarHBondContact O-N 3.26Å; A171-L174 PolarHBondContact O-N 3.43Å; A171-T175 VanDerWaalsContact O-CB 3.32Å; A171-T175 WeakPolarHBondContact O-CB 3.36Å; A171-T175 PolarHBondContact O-N 3.34Å; A171-T175 PolarHBondContact O-OG1 2.87Å; A171-T234 VanDerWaalsContact C-OG1 3.29Å; A171-T234 WeakPolarHBondContact CB-OG1 3.29Å; A171-T234 PolarHBondContact O-OG1 3.19Å; A171-L237 HydrophobicContact CB-CD1 3.59Å
172S98.6Very high98.2Very high2 Ų229.5 Ų29.51%0.01419%0.187CC..Hα-helixtrans-61.7-44.9174.2-60.20000111.6S168 L169 T175 S176 T234S168-S172 VanDerWaalsContact O-CB 3.31Å; S168-S172 WeakPolarHBondContact O-CB 3.33Å; S168-S172 PolarHBondContact O-N 2.94Å; S168-S172 PolarHBondContact O-OG 2.99Å; L169-S172 WeakPolarHBondContact O-CB 3.31Å; L169-S172 PolarHBondContact O-N 2.85Å; S172-T175 PolarHBondContact O-N 3.08Å; S172-S176 PolarHBondContact O-N 3.14Å; S172-T234 VanDerWaalsContact OG-CG2 3.27Å; S172-T234 WeakPolarHBondContact OG-CG2 3.4Å
173A98.4Very high98.1Very high43 Ų4330.2 Ų30.236%0.35520%0.2SC..Hα-helixtrans-61.5-47.7176.300000111.3L169 G170 T175 S176 V177L169-A173 WeakPolarHBondContact O-CB 3.49Å; L169-A173 PolarHBondContact O-N 3.08Å; G170-A173 PolarHBondContact O-N 3.12Å; A173-T175 PolarHBondContact O-N 2.94Å; A173-S176 WeakPolarHBondContact O-CB 3.25Å; A173-S176 PolarHBondContact O-N 2.86Å; A173-S176 VanDerWaalsContact O-N 3.14Å; A173-S176 PolarHBondContact O-OG 3.23Å; A173-V177 PolarHBondContact O-N 2.83Å; A173-V177 VanDerWaalsContact O-N 3.13Å
174L98.4Very high97.9Very high79 Ų7928.7 Ų28.741%0.41419%0.188SC..Hα-helixtrans-63-41.6178-174.961.4000112.3G170 A171 S176 V177 W178 L230G170-L174 WeakPolarHBondContact O-CB 3.19Å; G170-L174 PolarHBondContact O-N 3.49Å; A171-L174 PolarHBondContact O-N 3.43Å; L174-S176 PolarHBondContact O-N 3.27Å; L174-V177 WeakPolarHBondContact O-CB 3.34Å; L174-V177 PolarHBondContact O-N 2.92Å; L174-W178 HydrophobicContact CD1-CE3 3.91Å; L174-W178 HydrophobicContact CD1-CZ3 3.63Å; L174-W178 HydrophobicContact CG-CE3 4.49Å; L174-W178 PolarHBondContact O-N 2.71Å; L174-L230 HydrophobicContact CD2-CD2 3.73Å; L174-L230 HydrophobicContact CG-CD1 4.12Å; L174-L230 HydrophobicContact CG-CD2 4.1Å
175T98.7Very high97.7Very high16 Ų1628.3 Ų28.310%0.09819%0.186CC..Hα-helixtrans-58.9-39.2174.6-570000111A171 S172 A173 W178 G179 H227 L230 A231 T234A171-T175 VanDerWaalsContact O-CB 3.32Å; A171-T175 WeakPolarHBondContact O-CB 3.36Å; A171-T175 PolarHBondContact O-N 3.34Å; A171-T175 PolarHBondContact O-OG1 2.87Å; S172-T175 PolarHBondContact O-N 3.08Å; A173-T175 PolarHBondContact O-N 2.94Å; T175-W178 CarbonylContact O-C 3.58Å; T175-W178 PolarHBondContact O-N 3.44Å; T175-G179 PolarHBondContact O-N 3.38Å; T175-H227 PolarHBondContact O-CE1 2.95Å; T175-H227 PolarHBondContact O-ND1 3.25Å; T175-H227 VanDerWaalsContact O-ND1 3.08Å; T175-L230 HydrophobicContact CG2-CB 4.29Å; T175-L230 WeakPolarHBondContact OG1-CB 3.47Å; T175-L230 PolarHBondContact OG1-O 2.93Å; T175-A231 HydrophobicContact CG2-CB 4.09Å; T175-T234 PolarHBondContact OG1-OG1 3.21Å
176S98.2Very high97.4Very high14 Ų1431.8 Ų31.810%0.09820%0.203CC..Hα-helixtrans-69.4-32.9178.981.80000113.4S172 A173 L174 G179 G180S172-S176 PolarHBondContact O-N 3.14Å; A173-S176 WeakPolarHBondContact O-CB 3.25Å; A173-S176 PolarHBondContact O-N 2.86Å; A173-S176 VanDerWaalsContact O-N 3.14Å; A173-S176 PolarHBondContact O-OG 3.23Å; L174-S176 PolarHBondContact O-N 3.27Å; S176-G179 CarbonylContact O-C 3.58Å; S176-G179 WeakPolarHBondContact O-CA 3.31Å; S176-G179 PolarHBondContact O-N 2.93Å; S176-G180 PolarHBondContact O-N 2.88Å
177V98.4Very high97.3Very high36 Ų3629.7 Ų29.722%0.21819%0.186CC..Hα-helixtrans-61.8-49.5172.1174.60000109.5T125 T129 A173 L174 G179 G180 L181T125-V177 HydrophobicContact CG2-CG1 3.88Å; T125-V177 VanDerWaalsContact CG2-O 3.3Å; T125-V177 WeakPolarHBondContact CG2-O 3.33Å; T129-V177 HydrophobicContact CG2-CG2 3.93Å; A173-V177 PolarHBondContact O-N 2.83Å; A173-V177 VanDerWaalsContact O-N 3.13Å; L174-V177 WeakPolarHBondContact O-CB 3.34Å; L174-V177 PolarHBondContact O-N 2.92Å; V177-G179 VanDerWaalsContact C-N 3.25Å; V177-G179 PolarHBondContact O-N 3.29Å; V177-G180 PolarHBondContact O-N 3.39Å; V177-G180 VanDerWaalsContact O-N 3.13Å; V177-L181 PolarHBondContact O-N 2.7Å
178W98.3Very high97.2Very high44 Ų4425.6 Ų25.617%0.16717%0.167CC..Hα-helixtrans-67.4-26.1175.1-100.9-97.8000113.2L174 T175 L181 T182 G216 F217 A226 H227 L230L174-W178 HydrophobicContact CD1-CE3 3.91Å; L174-W178 HydrophobicContact CD1-CZ3 3.63Å; L174-W178 HydrophobicContact CG-CE3 4.49Å; L174-W178 PolarHBondContact O-N 2.71Å; T175-W178 CarbonylContact O-C 3.58Å; T175-W178 PolarHBondContact O-N 3.44Å; W178-L181 HydrophobicContact CD2-CD1 4.18Å; W178-L181 HydrophobicContact CG-CD1 4.37Å; W178-T182 VanDerWaalsContact O-CB 3.3Å; W178-T182 WeakPolarHBondContact O-CB 3.35Å; W178-T182 PolarHBondContact O-N 2.88Å; W178-T182 PolarHBondContact O-OG1 3.01Å; W178-G216 PolarHBondContact NE1-O 2.83Å; W178-F217 AromaticContact CH2-CE1 3.78Å; W178-F217 HydrophobicContact CH2-CE1 3.78Å; W178-F217 HydrophobicContact CH2-CZ 4.27Å; W178-F217 HydrophobicContact CZ2-CD1 4.42Å; W178-F217 AromaticContact CZ2-CE1 3.91Å; W178-F217 HydrophobicContact CZ2-CE1 3.91Å; W178-F217 HydrophobicContact CZ2-CZ 4.41Å; W178-A226 HydrophobicContact CG-CB 4.26Å; W178-A226 VanDerWaalsContact NE1-CB 3.33Å; W178-H227 HydrophobicContact CB-CB 4.02Å; W178-L230 HydrophobicContact CB-CD1 3.94Å; W178-L230 HydrophobicContact CD2-CD1 4Å; W178-L230 HydrophobicContact CE3-CD1 4.18Å; W178-L230 HydrophobicContact CG-CD1 3.89Å
179G98.2Very high97Very high18 Ų1829.8 Ų29.819%0.18619%0.189CC..Hα-helixtrans-65.9-42.4169.500000112T175 S176 V177 T182 S183 H227T175-G179 PolarHBondContact O-N 3.38Å; S176-G179 CarbonylContact O-C 3.58Å; S176-G179 WeakPolarHBondContact O-CA 3.31Å; S176-G179 PolarHBondContact O-N 2.93Å; V177-G179 VanDerWaalsContact C-N 3.25Å; V177-G179 PolarHBondContact O-N 3.29Å; G179-T182 WeakPolarHBondContact O-CB 3.4Å; G179-T182 PolarHBondContact O-N 2.83Å; G179-S183 PolarHBondContact O-N 3.37Å; G179-H227 VanDerWaalsContact CA-CE1 3.49Å; G179-H227 WeakPolarHBondContact CA-CE1 3.39Å; G179-H227 WeakPolarHBondContact CA-ND1 3.43Å; G179-H227 PolarHBondContact N-ND1 3.04Å
180G97.5Very high96.8Very high0 Ų029.9 Ų29.90%019%0.191CC..Hα-helixtrans-60.4-45.4172.700000112.3T125 S176 V177 T182 S183 G184T125-G180 PolarHBondContact OG1-O 3.04Å; S176-G180 PolarHBondContact O-N 2.88Å; V177-G180 PolarHBondContact O-N 3.39Å; V177-G180 VanDerWaalsContact O-N 3.13Å; G180-T182 VanDerWaalsContact C-N 3.34Å; G180-T182 PolarHBondContact O-N 3.23Å; G180-S183 PolarHBondContact O-N 3.34Å; G180-G184 PolarHBondContact O-N 3Å
181L97.3Very high96.6Very high5 Ų531.2 Ų31.23%0.02618%0.184CC..Hα-helixtrans-62-44174.9-66172.6000111T125 V177 W178 S183 G184 L185 F217 V223T125-L181 HydrophobicContact CG2-CD2 4.26Å; T125-L181 HydrophobicContact CG2-CG 4.11Å; T125-L181 PolarHBondContact OG1-N 3.16Å; T125-L181 VanDerWaalsContact OG1-N 3.09Å; V177-L181 PolarHBondContact O-N 2.7Å; W178-L181 HydrophobicContact CD2-CD1 4.18Å; W178-L181 HydrophobicContact CG-CD1 4.37Å; L181-S183 VanDerWaalsContact C-N 3.31Å; L181-S183 PolarHBondContact O-N 2.91Å; L181-G184 PolarHBondContact O-N 3.41Å; L181-L185 WeakPolarHBondContact O-CB 3.27Å; L181-L185 PolarHBondContact O-N 2.93Å; L181-F217 HydrophobicContact CD1-CD1 4Å; L181-V223 HydrophobicContact CB-CG1 3.59Å
182T97.2Very high96.5Very high14 Ų1432 Ų329%0.08619%0.186CC..Hα-helixtrans-59.1-43.6177.9-61.80000111.1W178 G179 G180 Q186 A187 H227W178-T182 VanDerWaalsContact O-CB 3.3Å; W178-T182 WeakPolarHBondContact O-CB 3.35Å; W178-T182 PolarHBondContact O-N 2.88Å; W178-T182 PolarHBondContact O-OG1 3.01Å; G179-T182 WeakPolarHBondContact O-CB 3.4Å; G179-T182 PolarHBondContact O-N 2.83Å; G180-T182 VanDerWaalsContact C-N 3.34Å; G180-T182 PolarHBondContact O-N 3.23Å; T182-Q186 CarbonylContact O-C 3.53Å; T182-Q186 WeakPolarHBondContact O-CA 3.32Å; T182-Q186 PolarHBondContact O-N 3.03Å; T182-A187 HydrophobicContact CG2-CB 4.1Å; T182-A187 PolarHBondContact O-N 3.49Å; T182-H227 WeakPolarHBondContact OG1-CB 3.26Å
183S95.2Very high96.4Very high61 Ų6133.6 Ų33.643%0.42720%0.198SC..Hα-helixtrans-66-47.9176-172.20000111.9G179 G180 L181 L185 Q186G179-S183 PolarHBondContact O-N 3.37Å; G180-S183 PolarHBondContact O-N 3.34Å; L181-S183 VanDerWaalsContact C-N 3.31Å; L181-S183 PolarHBondContact O-N 2.91Å; S183-L185 PolarHBondContact O-N 2.93Å; S183-Q186 PolarHBondContact O-N 3.17Å
184G93Very high96.4Very high17 Ų1737.2 Ų37.218%0.17520%0.202CC..Hα-helixtrans-67.1-35.3-176.200000113.7G180 L181 Q186G180-G184 PolarHBondContact O-N 3Å; L181-G184 PolarHBondContact O-N 3.41Å; G184-Q186 VanDerWaalsContact C-N 3.32Å
185L93.7Very high96.3Very high19 Ų1936.1 Ų36.110%0.09920%0.2CC..THydrogen-bonded Turntrans-83.9-6175.4-74.9173.6000113.8H121 L181 S183 A187 F217 R220 V223H121-L185 HydrophobicContact CB-CD2 4.4Å; H121-L185 HydrophobicContact CB-CG 4.08Å; H121-L185 WeakPolarHBondContact ND1-CD2 3.31Å; L181-L185 WeakPolarHBondContact O-CB 3.27Å; L181-L185 PolarHBondContact O-N 2.93Å; S183-L185 PolarHBondContact O-N 2.93Å; L185-A187 HydrophobicContact CB-CB 4.19Å; L185-A187 PolarHBondContact O-N 3.5Å; L185-F217 WeakPolarHBondContact CD1-O 3.48Å; L185-R220 HydrophobicContact CB-CG 4.3Å; L185-R220 WeakPolarHBondContact O-CD 3.33Å; L185-R220 PolarHBondContact O-NE 3.21Å; L185-V223 HydrophobicContact CD1-CB 4.17Å; L185-V223 HydrophobicContact CD1-CG1 4.28Å; L185-V223 HydrophobicContact CD1-CG2 3.78Å
186Q93.1Very high96.2Very high73 Ų7339 Ų3934%0.34121%0.211SC..THydrogen-bonded Turntrans53.231.9-166.2-56.1174.9-57.600112.3T182 S183 G184 G188 L189T182-Q186 CarbonylContact O-C 3.53Å; T182-Q186 WeakPolarHBondContact O-CA 3.32Å; T182-Q186 PolarHBondContact O-N 3.03Å; S183-Q186 PolarHBondContact O-N 3.17Å; G184-Q186 VanDerWaalsContact C-N 3.32Å; Q186-G188 PolarHBondContact O-N 3.42Å; Q186-L189 HydrophobicContact CB-CD1 4.15Å; Q186-L189 WeakPolarHBondContact O-CB 3.25Å; Q186-L189 PolarHBondContact O-N 2.88Å; Q186-L189 VanDerWaalsContact O-N 3.08Å
187A96.2Very high96Very high0 Ų038.8 Ų38.80%021%0.208CC..G310 helixtrans-67.9-16.5-178.800000112.5T182 L185 L189 V190 R220 Q224T182-A187 HydrophobicContact CG2-CB 4.1Å; T182-A187 PolarHBondContact O-N 3.49Å; L185-A187 HydrophobicContact CB-CB 4.19Å; L185-A187 PolarHBondContact O-N 3.5Å; A187-L189 PolarHBondContact O-N 2.89Å; A187-V190 PolarHBondContact O-N 2.96Å; A187-R220 HydrophobicContact CB-CB 3.85Å; A187-R220 VanDerWaalsContact CB-O 3.3Å; A187-R220 WeakPolarHBondContact CB-O 3.18Å; A187-Q224 HydrophobicContact CB-CB 4.14Å; A187-Q224 PolarHBondContact O-NE2 2.73Å; A187-Q224 PolarHBondContact O-OE1 3.44Å
188G95.4Very high95.7Very high13 Ų1339.5 Ų39.513%0.13422%0.219CC..G310 helixtrans-64.8-16.5170.700000114.2Q186 V190 N192 V280Q186-G188 PolarHBondContact O-N 3.42Å; G188-V190 VanDerWaalsContact C-N 3.32Å; G188-N192 PolarHBondContact O-ND2 2.96Å; G188-V280 VanDerWaalsContact O-CG2 3.29Å; G188-V280 WeakPolarHBondContact O-CG2 3.42Å
189L95.3Very high95.5Very high89 Ų8944.4 Ų44.447%0.46625%0.248SC..G310 helixtrans-89.64.6175.5-61.5176.4000113.3Q186 A187 N192 Y279 V280Q186-L189 HydrophobicContact CB-CD1 4.15Å; Q186-L189 WeakPolarHBondContact O-CB 3.25Å; Q186-L189 PolarHBondContact O-N 2.88Å; Q186-L189 VanDerWaalsContact O-N 3.08Å; A187-L189 PolarHBondContact O-N 2.89Å; L189-N192 VanDerWaalsContact C-OD1 3.23Å; L189-N192 PolarHBondContact O-OD1 3.28Å; L189-N192 VanDerWaalsContact O-OD1 3.11Å; L189-Y279 WeakPolarHBondContact CD2-O 3.4Å; L189-V280 HydrophobicContact CD2-CB 4.18Å; L189-V280 HydrophobicContact CD2-CG2 4.12Å
190V94.5Very high95.3Very high33 Ų3350.8 Ų50.820%0.227%0.266CS..SBendtrans-101.2144175.4-174.80000107.4A187 G188 N192 R220 Q224A187-V190 PolarHBondContact O-N 2.96Å; G188-V190 VanDerWaalsContact C-N 3.32Å; V190-N192 PolarHBondContact O-N 3.47Å; V190-R220 HydrophobicContact CG2-CB 3.91Å; V190-Q224 PolarHBondContact O-NE2 2.81Å; V190-Q224 PolarHBondContact O-OE1 3.4Å
191Y94.6Very high95.1Very high69 Ų6958.8 Ų58.827%0.27130%0.297SS..  trans41.462.9177.8-63.9-68000115.5S193 F197 A198 P203 D205 T221Y191-S193 PolarHBondContact O-N 3.28Å; Y191-F197 HydrophobicContact CD1-CB 3.95Å; Y191-F197 HydrophobicContact CD2-CB 4.35Å; Y191-F197 AromaticContact CD2-CD1 3.83Å; Y191-F197 HydrophobicContact CD2-CD1 3.83Å; Y191-F197 HydrophobicContact CE1-CB 4.46Å; Y191-F197 HydrophobicContact CG-CB 3.89Å; Y191-F197 AromaticContact CG-CD1 3.83Å; Y191-F197 HydrophobicContact CG-CD1 3.83Å; Y191-F197 HydrophobicContact CG-CG 4.37Å; Y191-A198 HydrophobicContact CD1-CB 4.13Å; Y191-A198 HydrophobicContact CE1-CB 4.31Å; Y191-P203 HydrophobicContact CD2-CG 4.42Å; Y191-P203 HydrophobicContact CE2-CB 3.89Å; Y191-P203 HydrophobicContact CE2-CG 4.27Å; Y191-D205 WeakPolarHBondContact CE2-OD1 3.47Å; Y191-D205 PolarHBondContact OH-OD1 3.06Å; Y191-T221 HydrophobicContact CD2-CG2 3.82Å; Y191-T221 HydrophobicContact CE2-CG2 3.44Å; Y191-T221 VanDerWaalsContact CE2-CG2 3.44Å
192N96.8Very high95Very high26 Ų2663.8 Ų63.814%0.13932%0.322CS..  trans-7334-179.2-63.293.4000115G188 L189 V190 L276 Y279G188-N192 PolarHBondContact O-ND2 2.96Å; L189-N192 VanDerWaalsContact C-OD1 3.23Å; L189-N192 PolarHBondContact O-OD1 3.28Å; L189-N192 VanDerWaalsContact O-OD1 3.11Å; V190-N192 PolarHBondContact O-N 3.47Å; N192-L276 WeakPolarHBondContact CB-O 3.17Å; N192-L276 PolarHBondContact ND2-O 3.47Å; N192-Y279 HydrophobicContact CB-CD1 3.9Å; N192-Y279 HydrophobicContact CB-CE1 3.78Å; N192-Y279 HydrophobicContact CB-CG 4.49Å
193S96.7Very high94.8Very high36 Ų3663.3 Ų63.325%0.25232%0.32SS..  trans-115.2154.7175.562.70000111.2Y191 K196 A198 R228Y191-S193 PolarHBondContact O-N 3.28Å; S193-K196 CarbonylContact C-O 3.25Å; S193-K196 VanDerWaalsContact C-O 3.25Å; S193-K196 PolarHBondContact OG-O 3.24Å; S193-A198 WeakPolarHBondContact OG-CA 3.36Å; S193-A198 PolarHBondContact OG-N 3.44Å; S193-R228 PolarHBondContact O-NH1 2.96Å; S193-R228 PolarHBondContact O-NH2 3.29Å
194W97Very high94.6Very high119 Ų11963.9 Ų63.945%0.45133%0.328SS..SBendtrans-143.8139.8177-175.490.7000110.7Y232 I273 L276 V277W194-Y232 AromaticContact NE1-CE1 3.86Å; W194-Y232 AromaticContact NE1-CZ 3.75Å; W194-Y232 PolarHBondContact NE1-OH 2.84Å; W194-I273 HydrophobicContact CB-CG2 4.29Å; W194-I273 HydrophobicContact CD2-CD1 4.22Å; W194-I273 HydrophobicContact CD2-CG1 4.38Å; W194-I273 HydrophobicContact CD2-CG2 4.06Å; W194-I273 HydrophobicContact CE3-CG2 4.39Å; W194-I273 HydrophobicContact CG-CG1 4.34Å; W194-I273 HydrophobicContact CG-CG2 3.99Å; W194-I273 HydrophobicContact CH2-CD1 4.45Å; W194-I273 HydrophobicContact CZ2-CD1 3.82Å; W194-L276 HydrophobicContact CB-CD2 4.46Å; W194-V277 HydrophobicContact CB-CG2 4.02Å
195P96.1Very high94.7Very high57 Ų5765.2 Ų65.237%0.3733%0.331SS..SBendcis-85.2-135.134.3-36.5000114.8W201 R228P195-W201 HydrophobicContact CB-CZ3 4.17Å; P195-W201 HydrophobicContact CG-CH2 4.02Å; P195-W201 HydrophobicContact CG-CZ3 4.06Å; P195-R228 VanDerWaalsContact C-NH2 3.32Å; P195-R228 PolarHBondContact O-NH2 3.22Å
196K96.4Very high94.8Very high77 Ų7765.7 Ų65.734%0.33533%0.334SS..SBendtrans-82.5165.2178.6-67.8-177.9178.6-177.20112.3S193 A198 R200 W201S193-K196 CarbonylContact C-O 3.25Å; S193-K196 VanDerWaalsContact C-O 3.25Å; S193-K196 PolarHBondContact OG-O 3.24Å; K196-A198 WeakPolarHBondContact CB-O 3.44Å; K196-R200 WeakPolarHBondContact CB-O 3.23Å; K196-W201 VanDerWaalsContact CE-CE2 3.5Å; K196-W201 HydrophobicContact CG-CD2 3.89Å; K196-W201 HydrophobicContact CG-CE3 3.98Å; K196-W201 HydrophobicContact CG-CG 4.44Å; K196-W201 HydrophobicContact CG-CH2 4.33Å; K196-W201 HydrophobicContact CG-CZ2 4.25Å; K196-W201 HydrophobicContact CG-CZ3 4.2Å
197F95.2Very high94.8Very high8 Ų867.9 Ų67.94%0.03535%0.347CS..BIsolated β-bridgetrans-97.297.3167.9-66.8-103.2000108.2Y191 D199 R200 P203 F225Y191-F197 HydrophobicContact CD1-CB 3.95Å; Y191-F197 HydrophobicContact CD2-CB 4.35Å; Y191-F197 AromaticContact CD2-CD1 3.83Å; Y191-F197 HydrophobicContact CD2-CD1 3.83Å; Y191-F197 HydrophobicContact CE1-CB 4.46Å; Y191-F197 HydrophobicContact CG-CB 3.89Å; Y191-F197 AromaticContact CG-CD1 3.83Å; Y191-F197 HydrophobicContact CG-CD1 3.83Å; Y191-F197 HydrophobicContact CG-CG 4.37Å; F197-D199 PolarHBondContact O-N 3.13Å; F197-R200 PolarHBondContact N-O 3.33Å; F197-R200 PolarHBondContact O-N 3.32Å; F197-P203 HydrophobicContact CB-CG 3.65Å; F197-P203 HydrophobicContact CD1-CG 3.44Å; F197-P203 VanDerWaalsContact CD1-CG 3.44Å; F197-P203 HydrophobicContact CD2-CG 3.97Å; F197-P203 HydrophobicContact CE1-CG 4.04Å; F197-P203 HydrophobicContact CG-CG 3.42Å; F197-P203 VanDerWaalsContact CG-CG 3.42Å; F197-F225 HydrophobicContact CD2-CD2 4.39Å; F197-F225 HydrophobicContact CE1-CB 4.23Å; F197-F225 HydrophobicContact CE1-CD2 4.36Å; F197-F225 AromaticContact CE2-CD2 3.59Å; F197-F225 HydrophobicContact CE2-CD2 3.59Å; F197-F225 HydrophobicContact CE2-CE2 4.16Å; F197-F225 HydrophobicContact CZ-CB 3.99Å; F197-F225 AromaticContact CZ-CD2 3.59Å; F197-F225 HydrophobicContact CZ-CD2 3.59Å; F197-F225 HydrophobicContact CZ-CG 4.23Å
198A92.4Very high94.8Very high52 Ų5272.2 Ų72.243%0.4337%0.373SS..THydrogen-bonded Turntrans48.6-121.5-15800000110.2Y191 S193 K196 R200Y191-A198 HydrophobicContact CD1-CB 4.13Å; Y191-A198 HydrophobicContact CE1-CB 4.31Å; S193-A198 WeakPolarHBondContact OG-CA 3.36Å; S193-A198 PolarHBondContact OG-N 3.44Å; K196-A198 WeakPolarHBondContact CB-O 3.44Å; A198-R200 VanDerWaalsContact C-N 3.34Å
199D92.6Very high94.7Very high146 Ų14674.5 Ų74.578%0.78138%0.382SS*.THydrogen-bonded Turntrans-84.9-5.8-178.9-58.9-46.6000114.2F197F197-D199 PolarHBondContact O-N 3.13Å
200R94Very high94.6Very high153 Ų15376.6 Ų76.658%0.57739%0.39SS*.BIsolated β-bridgetrans-109.4145.6-170.9-57.5-174.5-174.9-159.13.1112.4K196 F197 A198 I202K196-R200 WeakPolarHBondContact CB-O 3.23Å; F197-R200 PolarHBondContact N-O 3.33Å; F197-R200 PolarHBondContact O-N 3.32Å; A198-R200 VanDerWaalsContact C-N 3.34Å; R200-I202 WeakPolarHBondContact CB-O 3.43Å
201W93.9Very high94.7Very high168 Ų16877.8 Ų77.864%0.63640%0.398SS*.SBendtrans-74-34171.1-71.5107.7000112.5P195 K196P195-W201 HydrophobicContact CB-CZ3 4.17Å; P195-W201 HydrophobicContact CG-CH2 4.02Å; P195-W201 HydrophobicContact CG-CZ3 4.06Å; K196-W201 VanDerWaalsContact CE-CE2 3.5Å; K196-W201 HydrophobicContact CG-CD2 3.89Å; K196-W201 HydrophobicContact CG-CE3 3.98Å; K196-W201 HydrophobicContact CG-CG 4.44Å; K196-W201 HydrophobicContact CG-CH2 4.33Å; K196-W201 HydrophobicContact CG-CZ2 4.25Å; K196-W201 HydrophobicContact CG-CZ3 4.2Å
202I95Very high94.6Very high109 Ų10979 Ų7956%0.55941%0.409SS*.SBendtrans-123.2121.1178.3-57.7177.7000107.3R200 L206R200-I202 WeakPolarHBondContact CB-O 3.43Å; I202-L206 HydrophobicContact CG2-CD1 3.51Å
203P93.8Very high94.4Very high5 Ų585.2 Ų85.23%0.03243%0.43CS..  trans-59.3148173.9-21.130.1000112.3Y191 F197 D205 L206 T221 F225Y191-P203 HydrophobicContact CD2-CG 4.42Å; Y191-P203 HydrophobicContact CE2-CB 3.89Å; Y191-P203 HydrophobicContact CE2-CG 4.27Å; F197-P203 HydrophobicContact CB-CG 3.65Å; F197-P203 HydrophobicContact CD1-CG 3.44Å; F197-P203 VanDerWaalsContact CD1-CG 3.44Å; F197-P203 HydrophobicContact CD2-CG 3.97Å; F197-P203 HydrophobicContact CE1-CG 4.04Å; F197-P203 HydrophobicContact CG-CG 3.42Å; F197-P203 VanDerWaalsContact CG-CG 3.42Å; P203-D205 VanDerWaalsContact C-N 3.35Å; P203-D205 WeakPolarHBondContact CB-OD1 3.49Å; P203-L206 HydrophobicContact CB-CD2 4.28Å; P203-L206 HydrophobicContact CB-CG 4.16Å; P203-L206 HydrophobicContact CG-CD2 4.19Å; P203-L206 HydrophobicContact CG-CG 4.44Å; P203-L206 WeakPolarHBondContact O-CG 3.44Å; P203-T221 HydrophobicContact CB-CG2 3.33Å; P203-T221 HydrophobicContact CG-CG2 3.57Å; P203-F225 HydrophobicContact CG-CD2 4.44Å
204A91.5Very high94.3Very high73 Ų7386.6 Ų86.660%0.60343%0.432SS*.THydrogen-bonded Turntrans-77.3-25.1179.300000113L206A204-L206 PolarHBondContact O-N 2.88Å
205D94.4Very high94.2Very high45 Ų4581 Ų8124%0.24141%0.411CS..THydrogen-bonded Turntrans-96.223.9-168.658.9-49.9000113.1Y191 P203 L207 T208 N219 T221Y191-D205 WeakPolarHBondContact CE2-OD1 3.47Å; Y191-D205 PolarHBondContact OH-OD1 3.06Å; P203-D205 VanDerWaalsContact C-N 3.35Å; P203-D205 WeakPolarHBondContact CB-OD1 3.49Å; D205-L207 PolarHBondContact O-N 3.49Å; D205-T208 HydrophobicContact CB-CG2 3.87Å; D205-T208 PolarHBondContact O-OG1 2.83Å; D205-N219 PolarHBondContact O-ND2 3.26Å; D205-T221 WeakPolarHBondContact OD2-CB 3.44Å; D205-T221 PolarHBondContact OD2-OG1 3.44Å
206L94.8Very high94Very high29 Ų2979.7 Ų79.715%0.15241%0.408CS..THydrogen-bonded Turntrans-69.4-28-179.4-69.4175.6000114.3I202 P203 A204 N215 N219 T221 A222 F225I202-L206 HydrophobicContact CG2-CD1 3.51Å; P203-L206 HydrophobicContact CB-CD2 4.28Å; P203-L206 HydrophobicContact CB-CG 4.16Å; P203-L206 HydrophobicContact CG-CD2 4.19Å; P203-L206 HydrophobicContact CG-CG 4.44Å; P203-L206 WeakPolarHBondContact O-CG 3.44Å; A204-L206 PolarHBondContact O-N 2.88Å; L206-N215 WeakPolarHBondContact O-CB 3.47Å; L206-N215 PolarHBondContact O-OD1 3.39Å; L206-N219 PolarHBondContact O-ND2 2.89Å; L206-T221 HydrophobicContact CD2-CG2 3.9Å; L206-A222 HydrophobicContact CD2-CB 3.96Å; L206-F225 HydrophobicContact CD2-CB 3.79Å; L206-F225 HydrophobicContact CD2-CD1 4.4Å; L206-F225 HydrophobicContact CD2-CD2 4.48Å; L206-F225 HydrophobicContact CD2-CG 3.99Å
207L94.9Very high94Very high118 Ų11879.6 Ų79.662%0.61841%0.407SS*.THydrogen-bonded Turntrans-124.337.2-170.6-62.3178000112.5D205 L212 N215D205-L207 PolarHBondContact O-N 3.49Å; L207-L212 HydrophobicContact CB-CD2 4.25Å; L207-N215 HydrophobicContact CD2-CB 4.35Å
208T95Very high93.9Very high91 Ų9182 Ų8256%0.55842%0.419SS*.  trans-83.2-23.5-174.353.40000114.2D205 N215 N219D205-T208 HydrophobicContact CB-CG2 3.87Å; D205-T208 PolarHBondContact O-OG1 2.83Å; T208-N215 PolarHBondContact N-OD1 3.24Å; T208-N215 VanDerWaalsContact N-OD1 3.11Å; T208-N219 PolarHBondContact OG1-ND2 3.38Å
209L93.4Very high94.1Very high61 Ų6180 Ų8032%0.31940%0.401SS..SBendtrans-87.2146.9-179.8-57.6-178.4000111.9K214 N215 E218 N219L209-K214 HydrophobicContact CB-CB 4.35Å; L209-N215 WeakPolarHBondContact CB-OD1 3.4Å; L209-N215 PolarHBondContact N-OD1 3.43Å; L209-N215 PolarHBondContact O-ND2 2.74Å; L209-E218 HydrophobicContact CD1-CB 3.87Å; L209-N219 HydrophobicContact CD1-CB 3.8Å; L209-N219 HydrophobicContact CG-CB 4.18Å
210Q94.2Very high94.3Very high134 Ų13478.4 Ų78.463%0.62638%0.384SS*.SBendtrans-116.2141.4170.1-67.9-61.6-25.700111
211P95.2Very high94.5Very high57 Ų5771.3 Ų71.337%0.3736%0.357SS..SBendcis-65.1155.4-10.428.4-38.3000113.2W213 K214P211-W213 HydrophobicContact CG-CD2 4.43Å; P211-W213 HydrophobicContact CG-CG 4.44Å; P211-W213 HydrophobicContact CG-CZ2 4.04Å; P211-W213 PolarHBondContact O-N 3.44Å; P211-K214 HydrophobicContact CG-CD 4.34Å; P211-K214 HydrophobicContact CG-CG 4.2Å; P211-K214 WeakPolarHBondContact O-CB 3.31Å; P211-K214 PolarHBondContact O-N 3.35Å
212L93.2Very high94.6Very high95 Ų9563.9 Ų63.950%0.49733%0.332SS..G310 helixtrans-52.4-34.1-170.8-70.9179.2000115L207 K214 N215L207-L212 HydrophobicContact CB-CD2 4.25Å; L212-K214 PolarHBondContact O-N 3.06Å; L212-N215 WeakPolarHBondContact O-CB 3.43Å; L212-N215 PolarHBondContact O-N 2.86Å; L212-N215 VanDerWaalsContact O-N 3.12Å; L212-N215 PolarHBondContact O-ND2 3.31Å
213W93.2Very high94.8Very high157 Ų15758.7 Ų58.760%0.59531%0.305SS*.G310 helixtrans-61.4-26.7179.766-101.8000113.2P211 N215 G216 F217P211-W213 HydrophobicContact CG-CD2 4.43Å; P211-W213 HydrophobicContact CG-CG 4.44Å; P211-W213 HydrophobicContact CG-CZ2 4.04Å; P211-W213 PolarHBondContact O-N 3.44Å; W213-N215 PolarHBondContact O-N 2.71Å; W213-G216 PolarHBondContact O-N 2.96Å; W213-F217 HydrophobicContact CE3-CD2 4.44Å
214K93.7Very high95Very high64 Ų6458.6 Ų58.628%0.27831%0.305SS..G310 helixtrans-62.2-28177.3-73.6-173.2172.3-1750112.3L209 P211 L212 G216 F217 E218L209-K214 HydrophobicContact CB-CB 4.35Å; P211-K214 HydrophobicContact CG-CD 4.34Å; P211-K214 HydrophobicContact CG-CG 4.2Å; P211-K214 WeakPolarHBondContact O-CB 3.31Å; P211-K214 PolarHBondContact O-N 3.35Å; L212-K214 PolarHBondContact O-N 3.06Å; K214-G216 PolarHBondContact O-N 2.87Å; K214-F217 PolarHBondContact O-N 2.94Å; K214-F217 VanDerWaalsContact O-N 3.08Å; K214-E218 WeakPolarHBondContact O-CB 3.43Å; K214-E218 PolarHBondContact O-N 3.36Å
215N95.1Very high95.2Very high3 Ų357.7 Ų57.72%0.01629%0.287CS..G310 helixtrans-60.4-33.7178.9-67.5-79.3000112.1L206 L207 T208 L209 L212 W213 F217 N219 A222L206-N215 WeakPolarHBondContact O-CB 3.47Å; L206-N215 PolarHBondContact O-OD1 3.39Å; L207-N215 HydrophobicContact CD2-CB 4.35Å; T208-N215 PolarHBondContact N-OD1 3.24Å; T208-N215 VanDerWaalsContact N-OD1 3.11Å; L209-N215 WeakPolarHBondContact CB-OD1 3.4Å; L209-N215 PolarHBondContact N-OD1 3.43Å; L209-N215 PolarHBondContact O-ND2 2.74Å; L212-N215 WeakPolarHBondContact O-CB 3.43Å; L212-N215 PolarHBondContact O-N 2.86Å; L212-N215 VanDerWaalsContact O-N 3.12Å; L212-N215 PolarHBondContact O-ND2 3.31Å; W213-N215 PolarHBondContact O-N 2.71Å; N215-F217 PolarHBondContact O-N 3.47Å; N215-F217 VanDerWaalsContact O-N 3.12Å; N215-N219 HydrophobicContact CB-CB 3.93Å; N215-N219 WeakPolarHBondContact O-CB 3.46Å; N215-N219 WeakPolarHBondContact OD1-CB 3.31Å; N215-N219 PolarHBondContact OD1-ND2 3.39Å; N215-A222 HydrophobicContact CB-CB 4.33Å; N215-A222 WeakPolarHBondContact O-CB 3.27Å
216G92.9Very high95.4Very high29 Ų2956.8 Ų56.830%0.29929%0.286SS..G310 helixtrans-63.1-19.5178.400000114.6W178 W213 K214 V223W178-G216 PolarHBondContact NE1-O 2.83Å; W213-G216 PolarHBondContact O-N 2.96Å; K214-G216 PolarHBondContact O-N 2.87Å; G216-V223 WeakPolarHBondContact O-CG2 3.45Å
217F95.2Very high95.6Very high75 Ų7556.9 Ų56.933%0.32929%0.285SS..THydrogen-bonded Turntrans-129.3-24-169.9-57.8-78.8000115H121 Y122 W178 L181 L185 W213 K214 N215H121-F217 PolarHBondContact NE2-O 3.15Å; Y122-F217 HydrophobicContact CE1-CB 3.93Å; Y122-F217 HydrophobicContact CE1-CG 4.48Å; W178-F217 AromaticContact CH2-CE1 3.78Å; W178-F217 HydrophobicContact CH2-CE1 3.78Å; W178-F217 HydrophobicContact CH2-CZ 4.27Å; W178-F217 HydrophobicContact CZ2-CD1 4.42Å; W178-F217 AromaticContact CZ2-CE1 3.91Å; W178-F217 HydrophobicContact CZ2-CE1 3.91Å; W178-F217 HydrophobicContact CZ2-CZ 4.41Å; L181-F217 HydrophobicContact CD1-CD1 4Å; L185-F217 WeakPolarHBondContact CD1-O 3.48Å; W213-F217 HydrophobicContact CE3-CD2 4.44Å; K214-F217 PolarHBondContact O-N 2.94Å; K214-F217 VanDerWaalsContact O-N 3.08Å; N215-F217 PolarHBondContact O-N 3.47Å; N215-F217 VanDerWaalsContact O-N 3.12Å
218E94.5Very high95.7Very high59 Ų5952 Ų5228%0.27626%0.259SS..THydrogen-bonded Turntrans-121-26.2-172.3-59.4-178.5-175.900112.7Y122 L209 K214 R220Y122-E218 HydrophobicContact CE2-CG 4.41Å; Y122-E218 WeakPolarHBondContact OH-CG 3.46Å; Y122-E218 PolarHBondContact OH-OE1 2.96Å; L209-E218 HydrophobicContact CD1-CB 3.87Å; K214-E218 WeakPolarHBondContact O-CB 3.43Å; K214-E218 PolarHBondContact O-N 3.36Å; E218-R220 PolarHBondContact O-N 2.88Å
219N96.3Very high95.8Very high10 Ų1050.9 Ų50.95%0.05325%0.25CC..  trans-76.9115.3174.7179.1-32.1000109D205 L206 T208 L209 N215 T221 A222 V223D205-N219 PolarHBondContact O-ND2 3.26Å; L206-N219 PolarHBondContact O-ND2 2.89Å; T208-N219 PolarHBondContact OG1-ND2 3.38Å; L209-N219 HydrophobicContact CD1-CB 3.8Å; L209-N219 HydrophobicContact CG-CB 4.18Å; N215-N219 HydrophobicContact CB-CB 3.93Å; N215-N219 WeakPolarHBondContact O-CB 3.46Å; N215-N219 WeakPolarHBondContact OD1-CB 3.31Å; N215-N219 PolarHBondContact OD1-ND2 3.39Å; N219-T221 VanDerWaalsContact C-N 3.32Å; N219-T221 PolarHBondContact O-N 3.33Å; N219-T221 WeakPolarHBondContact OD1-CB 3.47Å; N219-T221 PolarHBondContact OD1-N 2.91Å; N219-A222 HydrophobicContact CB-CB 4.03Å; N219-A222 PolarHBondContact O-N 3.44Å; N219-A222 PolarHBondContact OD1-N 3.06Å; N219-V223 WeakPolarHBondContact O-CB 3.47Å; N219-V223 WeakPolarHBondContact O-CG2 3.29Å; N219-V223 PolarHBondContact O-N 3.23Å
220R96.5Very high96.1Very high111 Ų11149.3 Ų49.342%0.41924%0.241SC..Hα-helixtrans-55.4-47.7-176.7-56.8-169.2-174.8176.12.7111.7L185 A187 V190 E218 A222 V223 Q224L185-R220 HydrophobicContact CB-CG 4.3Å; L185-R220 WeakPolarHBondContact O-CD 3.33Å; L185-R220 PolarHBondContact O-NE 3.21Å; A187-R220 HydrophobicContact CB-CB 3.85Å; A187-R220 VanDerWaalsContact CB-O 3.3Å; A187-R220 WeakPolarHBondContact CB-O 3.18Å; V190-R220 HydrophobicContact CG2-CB 3.91Å; E218-R220 PolarHBondContact O-N 2.88Å; R220-A222 PolarHBondContact O-N 3.34Å; R220-V223 PolarHBondContact O-N 3.48Å; R220-Q224 WeakPolarHBondContact O-CB 3.48Å; R220-Q224 PolarHBondContact O-N 2.93Å
221T97.1Very high96.3Very high4 Ų444.4 Ų44.43%0.02522%0.223CC..Hα-helixtrans-61.4-45.9-179.9-58.20000111.6Y191 P203 D205 L206 N219 Q224 F225Y191-T221 HydrophobicContact CD2-CG2 3.82Å; Y191-T221 HydrophobicContact CE2-CG2 3.44Å; Y191-T221 VanDerWaalsContact CE2-CG2 3.44Å; P203-T221 HydrophobicContact CB-CG2 3.33Å; P203-T221 HydrophobicContact CG-CG2 3.57Å; D205-T221 WeakPolarHBondContact OD2-CB 3.44Å; D205-T221 PolarHBondContact OD2-OG1 3.44Å; L206-T221 HydrophobicContact CD2-CG2 3.9Å; N219-T221 VanDerWaalsContact C-N 3.32Å; N219-T221 PolarHBondContact O-N 3.33Å; N219-T221 WeakPolarHBondContact OD1-CB 3.47Å; N219-T221 PolarHBondContact OD1-N 2.91Å; T221-Q224 PolarHBondContact O-N 2.75Å; T221-F225 WeakPolarHBondContact O-CB 3.38Å; T221-F225 PolarHBondContact O-N 3.39Å
222A97.5Very high96.5Very high13 Ų1344.8 Ų44.811%0.10722%0.218CC..Hα-helixtrans-69-38.9-179.900000113L206 N215 N219 R220 F225 A226L206-A222 HydrophobicContact CD2-CB 3.96Å; N215-A222 HydrophobicContact CB-CB 4.33Å; N215-A222 WeakPolarHBondContact O-CB 3.27Å; N219-A222 HydrophobicContact CB-CB 4.03Å; N219-A222 PolarHBondContact O-N 3.44Å; N219-A222 PolarHBondContact OD1-N 3.06Å; R220-A222 PolarHBondContact O-N 3.34Å; A222-F225 PolarHBondContact O-N 3.02Å; A222-A226 WeakPolarHBondContact O-CB 3.44Å; A222-A226 PolarHBondContact O-N 2.9Å
223V97.8Very high96.7Very high0 Ų044.7 Ų44.70%022%0.217CC..Hα-helixtrans-62.7-46.7173.8167.60000111L181 L185 G216 N219 R220 A226 H227L181-V223 HydrophobicContact CB-CG1 3.59Å; L185-V223 HydrophobicContact CD1-CB 4.17Å; L185-V223 HydrophobicContact CD1-CG1 4.28Å; L185-V223 HydrophobicContact CD1-CG2 3.78Å; G216-V223 WeakPolarHBondContact O-CG2 3.45Å; N219-V223 WeakPolarHBondContact O-CB 3.47Å; N219-V223 WeakPolarHBondContact O-CG2 3.29Å; N219-V223 PolarHBondContact O-N 3.23Å; R220-V223 PolarHBondContact O-N 3.48Å; V223-A226 PolarHBondContact O-N 2.77Å; V223-H227 WeakPolarHBondContact O-CB 3.39Å; V223-H227 PolarHBondContact O-N 3.37Å
224Q97.5Very high97Very high3 Ų337.5 Ų37.51%0.01419%0.191CC..Hα-helixtrans-65.1-40.8177.6-168.4-167.415.300111.8A187 V190 R220 T221 H227 R228A187-Q224 HydrophobicContact CB-CB 4.14Å; A187-Q224 PolarHBondContact O-NE2 2.73Å; A187-Q224 PolarHBondContact O-OE1 3.44Å; V190-Q224 PolarHBondContact O-NE2 2.81Å; V190-Q224 PolarHBondContact O-OE1 3.4Å; R220-Q224 WeakPolarHBondContact O-CB 3.48Å; R220-Q224 PolarHBondContact O-N 2.93Å; T221-Q224 PolarHBondContact O-N 2.75Å; Q224-H227 PolarHBondContact O-N 3.34Å; Q224-R228 WeakPolarHBondContact O-CG 3.47Å; Q224-R228 PolarHBondContact O-N 3.42Å
225F97.4Very high97.2Very high53 Ų5336.9 Ų36.923%0.23219%0.188CC..Hα-helixtrans-58.9-48.5174.6177.7-89.8000111.6F197 P203 L206 T221 A222 R228 N229F197-F225 HydrophobicContact CD2-CD2 4.39Å; F197-F225 HydrophobicContact CE1-CB 4.23Å; F197-F225 HydrophobicContact CE1-CD2 4.36Å; F197-F225 AromaticContact CE2-CD2 3.59Å; F197-F225 HydrophobicContact CE2-CD2 3.59Å; F197-F225 HydrophobicContact CE2-CE2 4.16Å; F197-F225 HydrophobicContact CZ-CB 3.99Å; F197-F225 AromaticContact CZ-CD2 3.59Å; F197-F225 HydrophobicContact CZ-CD2 3.59Å; F197-F225 HydrophobicContact CZ-CG 4.23Å; P203-F225 HydrophobicContact CG-CD2 4.44Å; L206-F225 HydrophobicContact CD2-CB 3.79Å; L206-F225 HydrophobicContact CD2-CD1 4.4Å; L206-F225 HydrophobicContact CD2-CD2 4.48Å; L206-F225 HydrophobicContact CD2-CG 3.99Å; T221-F225 WeakPolarHBondContact O-CB 3.38Å; T221-F225 PolarHBondContact O-N 3.39Å; A222-F225 PolarHBondContact O-N 3.02Å; F225-R228 PolarHBondContact O-N 3.36Å; F225-N229 WeakPolarHBondContact CE1-ND2 3.29Å; F225-N229 WeakPolarHBondContact CE2-ND2 3.41Å; F225-N229 VanDerWaalsContact CZ-ND2 3.28Å; F225-N229 WeakPolarHBondContact CZ-ND2 3.34Å; F225-N229 PolarHBondContact O-N 2.75Å; F225-N229 PolarHBondContact O-ND2 3.47Å
226A97.8Very high97.4Very high27 Ų2740.5 Ų40.522%0.22321%0.213CC..Hα-helixtrans-62.3-44.9176.700000111.6W178 A222 V223 R228 N229 L230W178-A226 HydrophobicContact CG-CB 4.26Å; W178-A226 VanDerWaalsContact NE1-CB 3.33Å; A222-A226 WeakPolarHBondContact O-CB 3.44Å; A222-A226 PolarHBondContact O-N 2.9Å; V223-A226 PolarHBondContact O-N 2.77Å; A226-R228 PolarHBondContact O-N 3.34Å; A226-N229 PolarHBondContact O-N 2.98Å; A226-L230 VanDerWaalsContact O-CB 3.29Å; A226-L230 WeakPolarHBondContact O-CB 3.34Å; A226-L230 VanDerWaalsContact O-CG 3.22Å; A226-L230 WeakPolarHBondContact O-CG 3.38Å; A226-L230 PolarHBondContact O-N 3.25Å
227H98.2Very high97.7Very high30 Ų3040.8 Ų40.814%0.13921%0.207CC..Hα-helixtrans-58.1-46.8177-178.958.6000112.4T175 W178 G179 T182 V223 Q224 L230 A231T175-H227 PolarHBondContact O-CE1 2.95Å; T175-H227 PolarHBondContact O-ND1 3.25Å; T175-H227 VanDerWaalsContact O-ND1 3.08Å; W178-H227 HydrophobicContact CB-CB 4.02Å; G179-H227 VanDerWaalsContact CA-CE1 3.49Å; G179-H227 WeakPolarHBondContact CA-CE1 3.39Å; G179-H227 WeakPolarHBondContact CA-ND1 3.43Å; G179-H227 PolarHBondContact N-ND1 3.04Å; T182-H227 WeakPolarHBondContact OG1-CB 3.26Å; V223-H227 WeakPolarHBondContact O-CB 3.39Å; V223-H227 PolarHBondContact O-N 3.37Å; Q224-H227 PolarHBondContact O-N 3.34Å; H227-L230 PolarHBondContact O-N 3.08Å; H227-A231 WeakPolarHBondContact O-CB 3.42Å; H227-A231 PolarHBondContact O-N 3.25Å
228R97.8Very high97.9Very high16 Ų1637.2 Ų37.26%0.0619%0.192CC..Hα-helixtrans-62-45.9178.2-73.8172.763.2165.35.4112.1S193 P195 Q224 F225 A226 A231 Y232S193-R228 PolarHBondContact O-NH1 2.96Å; S193-R228 PolarHBondContact O-NH2 3.29Å; P195-R228 VanDerWaalsContact C-NH2 3.32Å; P195-R228 PolarHBondContact O-NH2 3.22Å; Q224-R228 WeakPolarHBondContact O-CG 3.47Å; Q224-R228 PolarHBondContact O-N 3.42Å; F225-R228 PolarHBondContact O-N 3.36Å; A226-R228 PolarHBondContact O-N 3.34Å; R228-A231 WeakPolarHBondContact O-CB 3.44Å; R228-A231 PolarHBondContact O-N 2.87Å; R228-Y232 HydrophobicContact CB-CE2 4.46Å; R228-Y232 VanDerWaalsContact O-CD2 3.29Å; R228-Y232 WeakPolarHBondContact O-CD2 3.49Å; R228-Y232 PolarHBondContact O-N 3.44Å
229N98.1Very high98.1Very high68 Ų6836.4 Ų36.436%0.36419%0.191SC..Hα-helixtrans-69.8-36.3179.9-75.9-78.4000112.7F225 A226 A231 Y232 L233F225-N229 WeakPolarHBondContact CE1-ND2 3.29Å; F225-N229 WeakPolarHBondContact CE2-ND2 3.41Å; F225-N229 VanDerWaalsContact CZ-ND2 3.28Å; F225-N229 WeakPolarHBondContact CZ-ND2 3.34Å; F225-N229 PolarHBondContact O-N 2.75Å; F225-N229 PolarHBondContact O-ND2 3.47Å; A226-N229 PolarHBondContact O-N 2.98Å; N229-A231 VanDerWaalsContact C-N 3.31Å; N229-Y232 PolarHBondContact O-N 3.24Å; N229-L233 WeakPolarHBondContact O-CB 3.47Å; N229-L233 PolarHBondContact O-N 2.9Å
230L98.6Very high98.2Very high28 Ų2837.6 Ų37.615%0.14720%0.202CC..Hα-helixtrans-63.3-37.6171.1-74.8170.6000111.7L174 T175 W178 A226 H227 L233 T234L174-L230 HydrophobicContact CD2-CD2 3.73Å; L174-L230 HydrophobicContact CG-CD1 4.12Å; L174-L230 HydrophobicContact CG-CD2 4.1Å; T175-L230 HydrophobicContact CG2-CB 4.29Å; T175-L230 WeakPolarHBondContact OG1-CB 3.47Å; T175-L230 PolarHBondContact OG1-O 2.93Å; W178-L230 HydrophobicContact CB-CD1 3.94Å; W178-L230 HydrophobicContact CD2-CD1 4Å; W178-L230 HydrophobicContact CE3-CD1 4.18Å; W178-L230 HydrophobicContact CG-CD1 3.89Å; A226-L230 VanDerWaalsContact O-CB 3.29Å; A226-L230 WeakPolarHBondContact O-CB 3.34Å; A226-L230 VanDerWaalsContact O-CG 3.22Å; A226-L230 WeakPolarHBondContact O-CG 3.38Å; A226-L230 PolarHBondContact O-N 3.25Å; H227-L230 PolarHBondContact O-N 3.08Å; L230-L233 PolarHBondContact O-N 3.28Å; L230-T234 WeakPolarHBondContact O-CB 3.35Å; L230-T234 PolarHBondContact O-N 2.79Å; L230-T234 PolarHBondContact O-OG1 3.13Å
231A98.7Very high98.3Very high30 Ų3032.3 Ų32.325%0.24818%0.182CC..Hα-helixtrans-63.8-43.8174.100000112T175 H227 R228 N229 T234 F235T175-A231 HydrophobicContact CG2-CB 4.09Å; H227-A231 WeakPolarHBondContact O-CB 3.42Å; H227-A231 PolarHBondContact O-N 3.25Å; R228-A231 WeakPolarHBondContact O-CB 3.44Å; R228-A231 PolarHBondContact O-N 2.87Å; N229-A231 VanDerWaalsContact C-N 3.31Å; A231-T234 PolarHBondContact O-N 3.37Å; A231-F235 WeakPolarHBondContact O-CB 3.23Å; A231-F235 PolarHBondContact O-N 3.35Å
232Y98.6Very high98.4Very high66 Ų6634.9 Ų34.926%0.25919%0.192SC..Hα-helixtrans-62.8-44.9174.5-57.4-38.8000112.3W194 R228 N229 T234 F235 C236 M269W194-Y232 AromaticContact NE1-CE1 3.86Å; W194-Y232 AromaticContact NE1-CZ 3.75Å; W194-Y232 PolarHBondContact NE1-OH 2.84Å; R228-Y232 HydrophobicContact CB-CE2 4.46Å; R228-Y232 VanDerWaalsContact O-CD2 3.29Å; R228-Y232 WeakPolarHBondContact O-CD2 3.49Å; R228-Y232 PolarHBondContact O-N 3.44Å; N229-Y232 PolarHBondContact O-N 3.24Å; Y232-T234 VanDerWaalsContact C-N 3.31Å; Y232-T234 PolarHBondContact O-N 3.2Å; Y232-F235 PolarHBondContact O-N 3.14Å; Y232-C236 PolarHBondContact O-N 3.13Å; Y232-C236 PolarHBondContact O-SG 2.69Å; Y232-C236 VanDerWaalsContact O-SG 3.38Å; Y232-M269 HydrophobicContact CD1-SD 4.43Å
233L98.7Very high98.4Very high92 Ų9237.4 Ų37.448%0.48220%0.203SC..Hα-helixtrans-58-46.1175.517661.6000111.1N229 L230 F235 C236 L237N229-L233 WeakPolarHBondContact O-CB 3.47Å; N229-L233 PolarHBondContact O-N 2.9Å; L230-L233 PolarHBondContact O-N 3.28Å; L233-F235 PolarHBondContact O-N 3.46Å; L233-C236 PolarHBondContact O-N 2.84Å; L233-L237 HydrophobicContact CD1-CD1 4.22Å; L233-L237 HydrophobicContact CD1-CG 4.32Å; L233-L237 HydrophobicContact CG-CD1 4.09Å; L233-L237 WeakPolarHBondContact O-CG 3.49Å; L233-L237 PolarHBondContact O-N 3.41Å
234T98.8Very high98.4Very high7 Ų738.7 Ų38.74%0.04321%0.211CC..Hα-helixtrans-59.4-46.7176.8-620000111.2A171 S172 T175 L230 A231 Y232 C236 L237 V238A171-T234 VanDerWaalsContact C-OG1 3.29Å; A171-T234 WeakPolarHBondContact CB-OG1 3.29Å; A171-T234 PolarHBondContact O-OG1 3.19Å; S172-T234 VanDerWaalsContact OG-CG2 3.27Å; S172-T234 WeakPolarHBondContact OG-CG2 3.4Å; T175-T234 PolarHBondContact OG1-OG1 3.21Å; L230-T234 WeakPolarHBondContact O-CB 3.35Å; L230-T234 PolarHBondContact O-N 2.79Å; L230-T234 PolarHBondContact O-OG1 3.13Å; A231-T234 PolarHBondContact O-N 3.37Å; Y232-T234 VanDerWaalsContact C-N 3.31Å; Y232-T234 PolarHBondContact O-N 3.2Å; T234-C236 PolarHBondContact O-N 3.02Å; T234-L237 PolarHBondContact O-N 3.36Å; T234-V238 WeakPolarHBondContact O-CG2 3.47Å; T234-V238 PolarHBondContact O-N 2.83Å
235F98.8Very high98.4Very high50 Ų5038.5 Ų38.522%0.21921%0.21CC..Hα-helixtrans-60.3-46.2177.7-174.7-100.3000111.8A231 Y232 L233 L237 V238 V239 I262 A266 M269A231-F235 WeakPolarHBondContact O-CB 3.23Å; A231-F235 PolarHBondContact O-N 3.35Å; Y232-F235 PolarHBondContact O-N 3.14Å; L233-F235 PolarHBondContact O-N 3.46Å; F235-L237 PolarHBondContact O-N 2.66Å; F235-V238 PolarHBondContact O-N 2.65Å; F235-V239 HydrophobicContact CD1-CG2 4.09Å; F235-V239 HydrophobicContact CE1-CG2 3.71Å; F235-V239 HydrophobicContact CE2-CG2 4.39Å; F235-V239 HydrophobicContact CZ-CG2 3.88Å; F235-V239 WeakPolarHBondContact O-CG2 3.47Å; F235-V239 PolarHBondContact O-N 3.43Å; F235-I262 HydrophobicContact CE2-CD1 4.5Å; F235-A266 HydrophobicContact CE2-CB 4.15Å; F235-M269 HydrophobicContact CB-SD 4.01Å; F235-M269 HydrophobicContact CD1-CE 3.74Å; F235-M269 HydrophobicContact CD1-SD 4.03Å; F235-M269 HydrophobicContact CD2-CB 4.42Å; F235-M269 HydrophobicContact CD2-CE 3.68Å; F235-M269 HydrophobicContact CD2-SD 3.96Å; F235-M269 HydrophobicContact CE1-CE 3.64Å; F235-M269 HydrophobicContact CE2-CE 3.61Å; F235-M269 HydrophobicContact CE2-SD 4.49Å; F235-M269 HydrophobicContact CG-CE 3.76Å; F235-M269 HydrophobicContact CG-SD 3.72Å; F235-M269 HydrophobicContact CZ-CE 3.58Å
236C98.8Very high98.4Very high80 Ų8041.8 Ų41.854%0.54122%0.221SC..Hα-helixtrans-59.8-42.5175.7-720000112.6Y232 L233 T234 V239 A240Y232-C236 PolarHBondContact O-N 3.13Å; Y232-C236 PolarHBondContact O-SG 2.69Å; Y232-C236 VanDerWaalsContact O-SG 3.38Å; L233-C236 PolarHBondContact O-N 2.84Å; T234-C236 PolarHBondContact O-N 3.02Å; C236-V239 PolarHBondContact O-N 2.95Å; C236-A240 WeakPolarHBondContact O-CB 3.29Å; C236-A240 PolarHBondContact O-N 3.48Å
237L98.8Very high98.3Very high34 Ų3450 Ų5018%0.17825%0.246CC..Hα-helixtrans-64.4-40.9176.5-74169.9000112.1L167 S168 A171 L233 T234 F235 A240 T241L167-L237 HydrophobicContact CB-CD1 4.35Å; L167-L237 HydrophobicContact CB-CD2 4.2Å; S168-L237 PolarHBondContact OG-O 2.78Å; A171-L237 HydrophobicContact CB-CD1 3.59Å; L233-L237 HydrophobicContact CD1-CD1 4.22Å; L233-L237 HydrophobicContact CD1-CG 4.32Å; L233-L237 HydrophobicContact CG-CD1 4.09Å; L233-L237 WeakPolarHBondContact O-CG 3.49Å; L233-L237 PolarHBondContact O-N 3.41Å; T234-L237 PolarHBondContact O-N 3.36Å; F235-L237 PolarHBondContact O-N 2.66Å; L237-A240 PolarHBondContact O-N 3.26Å; L237-T241 WeakPolarHBondContact O-CB 3.48Å; L237-T241 PolarHBondContact O-N 2.93Å; L237-T241 PolarHBondContact O-OG1 3.07Å
238V98.8Very high98.1Very high1 Ų149.5 Ų49.51%0.00624%0.244CC..Hα-helixtrans-68.1-41.1176.81730000111.1T234 F235 T241 W242 L261 I262 C265T234-V238 WeakPolarHBondContact O-CG2 3.47Å; T234-V238 PolarHBondContact O-N 2.83Å; F235-V238 PolarHBondContact O-N 2.65Å; V238-T241 WeakPolarHBondContact O-CB 3.48Å; V238-T241 PolarHBondContact O-N 3.46Å; V238-W242 WeakPolarHBondContact O-CB 3.25Å; V238-W242 PolarHBondContact O-N 3.01Å; V238-L261 HydrophobicContact CG1-CD1 4.47Å; V238-L261 HydrophobicContact CG1-CD2 4.43Å; V238-L261 HydrophobicContact CG1-CG 3.91Å; V238-I262 HydrophobicContact CG1-CB 4.3Å; V238-I262 HydrophobicContact CG1-CD1 3.85Å; V238-C265 HydrophobicContact CB-CB 4.22Å; V238-C265 HydrophobicContact CG1-CB 3.73Å; V238-C265 HydrophobicContact CG2-CB 4.32Å
239V98.8Very high97.9Very high42 Ų4253.3 Ų53.326%0.25527%0.271SS..Hα-helixtrans-60.4-46.3173169.40000110.8F235 C236 T241 W242 L243 I262F235-V239 HydrophobicContact CD1-CG2 4.09Å; F235-V239 HydrophobicContact CE1-CG2 3.71Å; F235-V239 HydrophobicContact CE2-CG2 4.39Å; F235-V239 HydrophobicContact CZ-CG2 3.88Å; F235-V239 WeakPolarHBondContact O-CG2 3.47Å; F235-V239 PolarHBondContact O-N 3.43Å; C236-V239 PolarHBondContact O-N 2.95Å; V239-T241 VanDerWaalsContact C-N 3.35Å; V239-T241 PolarHBondContact O-N 2.89Å; V239-W242 PolarHBondContact O-N 2.92Å; V239-L243 HydrophobicContact CG1-CD1 3.85Å; V239-L243 HydrophobicContact CG1-CG 4.21Å; V239-L243 WeakPolarHBondContact O-CB 3.41Å; V239-L243 WeakPolarHBondContact O-CG 3.24Å; V239-L243 PolarHBondContact O-N 3.3Å; V239-I262 HydrophobicContact CG2-CD1 3.7Å
240A98.7Very high97.6Very high35 Ų3550.6 Ų50.629%0.28926%0.256SS..Hα-helixtrans-61-43.5176.400000111.8L164 C236 L237 W242 L243 V244L164-A240 HydrophobicContact CD2-CB 4.47Å; C236-A240 WeakPolarHBondContact O-CB 3.29Å; C236-A240 PolarHBondContact O-N 3.48Å; L237-A240 PolarHBondContact O-N 3.26Å; A240-W242 VanDerWaalsContact C-N 3.33Å; A240-W242 PolarHBondContact O-N 3.32Å; A240-L243 PolarHBondContact O-N 3.43Å; A240-V244 WeakPolarHBondContact O-CB 3.28Å; A240-V244 WeakPolarHBondContact O-CG2 3.34Å; A240-V244 PolarHBondContact O-N 3.21Å
241T98.7Very high97.2Very high0 Ų051.7 Ų51.70%027%0.269CS..Hα-helixtrans-57-46.8173.9-60.40000110.9L161 L164 T165 S168 L237 V238 V239 G245 L258 L302L161-T241 HydrophobicContact CD1-CG2 3.87Å; L161-T241 WeakPolarHBondContact CD1-O 3.46Å; L164-T241 WeakPolarHBondContact CB-OG1 3.5Å; L164-T241 PolarHBondContact O-OG1 2.83Å; T165-T241 WeakPolarHBondContact OG1-CG2 3.3Å; S168-T241 PolarHBondContact OG-OG1 3.46Å; L237-T241 WeakPolarHBondContact O-CB 3.48Å; L237-T241 PolarHBondContact O-N 2.93Å; L237-T241 PolarHBondContact O-OG1 3.07Å; V238-T241 WeakPolarHBondContact O-CB 3.48Å; V238-T241 PolarHBondContact O-N 3.46Å; V239-T241 VanDerWaalsContact C-N 3.35Å; V239-T241 PolarHBondContact O-N 2.89Å; T241-G245 PolarHBondContact O-N 3.4Å; T241-L258 HydrophobicContact CG2-CD1 4.17Å; T241-L302 HydrophobicContact CG2-CD2 4.02Å
242W98.7Very high96.9Very high58 Ų5853.8 Ų53.822%0.2229%0.287CS..Hα-helixtrans-65.8-46.4179178.877.3000112.9V238 V239 A240 V244 G245 R246 H259 I262V238-W242 WeakPolarHBondContact O-CB 3.25Å; V238-W242 PolarHBondContact O-N 3.01Å; V239-W242 PolarHBondContact O-N 2.92Å; A240-W242 VanDerWaalsContact C-N 3.33Å; A240-W242 PolarHBondContact O-N 3.32Å; W242-V244 VanDerWaalsContact C-N 3.31Å; W242-V244 PolarHBondContact O-N 3.49Å; W242-G245 PolarHBondContact O-N 3.09Å; W242-R246 VanDerWaalsContact O-CB 3.31Å; W242-R246 WeakPolarHBondContact O-CB 3.31Å; W242-R246 VanDerWaalsContact O-CG 3.29Å; W242-R246 WeakPolarHBondContact O-CG 3.4Å; W242-R246 PolarHBondContact O-N 2.99Å; W242-H259 AromaticContact NE1-CE1 3.61Å; W242-H259 AromaticContact NE1-ND1 3.27Å; W242-H259 PolarHBondContact NE1-ND1 2.96Å; W242-I262 HydrophobicContact CB-CB 4.14Å; W242-I262 HydrophobicContact CB-CG1 4.4Å; W242-I262 HydrophobicContact CB-CG2 4.45Å; W242-I262 VanDerWaalsContact CD1-CG2 3.41Å; W242-I262 HydrophobicContact CD2-CG2 4.35Å; W242-I262 HydrophobicContact CG-CB 4.03Å; W242-I262 HydrophobicContact CG-CG1 4.27Å; W242-I262 HydrophobicContact CG-CG2 3.84Å
243L98.5Very high96.7Very high66 Ų6654.4 Ų54.435%0.34629%0.289SS..Hα-helixtrans-62.5-36.5179-72.9175.3000112.8V239 A240 R247V239-L243 HydrophobicContact CG1-CD1 3.85Å; V239-L243 HydrophobicContact CG1-CG 4.21Å; V239-L243 WeakPolarHBondContact O-CB 3.41Å; V239-L243 WeakPolarHBondContact O-CG 3.24Å; V239-L243 PolarHBondContact O-N 3.3Å; A240-L243 PolarHBondContact O-N 3.43Å; L243-R247 PolarHBondContact O-NH1 2.84Å
244V97.8Very high96.5Very high26 Ų2650.1 Ų50.116%0.15827%0.266CS..Hα-helixtrans-73.1-50.5174.3171.90000110.2L161 L164 A240 W242 R246 R247 M248L161-V244 HydrophobicContact CB-CG1 4.4Å; L161-V244 HydrophobicContact CD1-CB 4.48Å; L161-V244 HydrophobicContact CD1-CG1 4.28Å; L164-V244 HydrophobicContact CD1-CB 4.11Å; L164-V244 HydrophobicContact CD1-CG1 4.42Å; L164-V244 HydrophobicContact CD1-CG2 3.75Å; A240-V244 WeakPolarHBondContact O-CB 3.28Å; A240-V244 WeakPolarHBondContact O-CG2 3.34Å; A240-V244 PolarHBondContact O-N 3.21Å; W242-V244 VanDerWaalsContact C-N 3.31Å; W242-V244 PolarHBondContact O-N 3.49Å; V244-R246 PolarHBondContact O-N 3.44Å; V244-R247 PolarHBondContact O-N 2.86Å; V244-M248 HydrophobicContact CG1-CE 3.59Å
245G97.4Very high96.4Very high0 Ų053.6 Ų53.60%028%0.279CS..Hα-helixtrans-67.5-33.5-173.800000114.2T241 W242 R247 M248T241-G245 PolarHBondContact O-N 3.4Å; W242-G245 PolarHBondContact O-N 3.09Å; G245-R247 PolarHBondContact O-N 2.86Å; G245-M248 WeakPolarHBondContact O-CB 3.33Å; G245-M248 PolarHBondContact O-N 3.43Å
246R97Very high96.3Very high122 Ų12259.8 Ų59.846%0.4630%0.3SS..THydrogen-bonded Turntrans-63.9-26.2-177.569.3-178.6-68.6-165.7-2113.4W242 V244 R255W242-R246 VanDerWaalsContact O-CB 3.31Å; W242-R246 WeakPolarHBondContact O-CB 3.31Å; W242-R246 VanDerWaalsContact O-CG 3.29Å; W242-R246 WeakPolarHBondContact O-CG 3.4Å; W242-R246 PolarHBondContact O-N 2.99Å; V244-R246 PolarHBondContact O-N 3.44Å; R246-R255 PolarHBondContact O-NH1 3.24Å; R246-R255 VanDerWaalsContact O-NH1 3.14Å
247R95.5Very high96.3Very high198 Ų19856.2 Ų56.275%0.74728%0.276SS*.THydrogen-bonded Turntrans-85.1-9.7178.4-61.8-176.1177.4108.1-12.3113.1L243 V244 G245L243-R247 PolarHBondContact O-NH1 2.84Å; V244-R247 PolarHBondContact O-N 2.86Å; G245-R247 PolarHBondContact O-N 2.86Å
248M94.3Very high96.3Very high21 Ų2154.6 Ų54.610%0.10327%0.268CS..SBendtrans-88.3149.3-179.9-67.3-178.7176.700111.2I155 G157 L161 V244 G245 L250 R255I155-M248 HydrophobicContact CG2-CB 4.08Å; I155-M248 HydrophobicContact CG2-CG 4.33Å; I155-M248 HydrophobicContact CG2-SD 4.25Å; G157-M248 WeakPolarHBondContact O-CE 3.36Å; L161-M248 HydrophobicContact CB-CE 4.08Å; L161-M248 HydrophobicContact CB-SD 3.9Å; L161-M248 HydrophobicContact CD2-SD 3.63Å; L161-M248 HydrophobicContact CG-SD 4.34Å; V244-M248 HydrophobicContact CG1-CE 3.59Å; G245-M248 WeakPolarHBondContact O-CB 3.33Å; G245-M248 PolarHBondContact O-N 3.43Å; M248-L250 HydrophobicContact CB-CD2 4.15Å; M248-L250 HydrophobicContact CB-CG 4.04Å; M248-L250 PolarHBondContact O-N 2.94Å; M248-R255 PolarHBondContact O-NH2 3.06Å
249P92.7Very high96.3Very high96 Ų9658.1 Ų58.162%0.62328%0.284SS*.  trans-75.558.8174.333.2-37.6000111.7I155I155-P249 WeakPolarHBondContact CD1-O 3.22Å; I155-P249 HydrophobicContact CG2-CG 4.26Å
250L92Very high96.3Very high10 Ų1057.2 Ų57.25%0.05228%0.281CS..  trans-69.4143.7177.6-60179000111.1I155 L161 M248 R255 L258 L306 M309I155-L250 HydrophobicContact CD1-CD2 3.94Å; L161-L250 HydrophobicContact CD2-CD1 4.21Å; L161-L250 HydrophobicContact CD2-CD2 4.12Å; M248-L250 HydrophobicContact CB-CD2 4.15Å; M248-L250 HydrophobicContact CB-CG 4.04Å; M248-L250 PolarHBondContact O-N 2.94Å; L250-R255 HydrophobicContact CB-CB 4.39Å; L250-L258 HydrophobicContact CD1-CD2 3.96Å; L250-L306 HydrophobicContact CD2-CD2 4.19Å; L250-M309 HydrophobicContact CD2-CE 4.25Å; L250-M309 HydrophobicContact CD2-SD 4.31Å
251A91Very high96.3Very high51 Ų5155.6 Ų55.642%0.42127%0.267SS..  trans-54.3149.5169.100000111.3R253 S254 R255A251-R253 PolarHBondContact O-N 3.26Å; A251-R253 VanDerWaalsContact O-N 3.1Å; A251-S254 PolarHBondContact O-N 3.37Å; A251-R255 PolarHBondContact O-N 2.79Å
252A93Very high96.3Very high75 Ų7556.8 Ų56.862%0.6227%0.273SS*.Hα-helixtrans-53.4-38.3-173.600000113.4R256A252-R256 WeakPolarHBondContact O-CG 3.37Å; A252-R256 PolarHBondContact O-N 2.86Å
253R93.5Very high96.3Very high79 Ų7958.7 Ų58.730%0.29829%0.291SS..Hα-helixtrans-64.8-53.5175.2-175.1177.365.5-160.4-2.1112.1A251 R255 R256 V257 W301 E305 R308A251-R253 PolarHBondContact O-N 3.26Å; A251-R253 VanDerWaalsContact O-N 3.1Å; R253-R255 PolarHBondContact O-N 2.73Å; R253-R256 WeakPolarHBondContact O-CB 3.41Å; R253-R256 PolarHBondContact O-N 3.3Å; R253-R256 VanDerWaalsContact O-N 3.08Å; R253-V257 WeakPolarHBondContact O-CG2 3.26Å; R253-V257 PolarHBondContact O-N 3Å; R253-W301 HydrophobicContact CG-CZ2 4.27Å; R253-E305 IonicContact CZ-OE1 3.13Å; R253-E305 IonicContact CZ-OE2 3.21Å; R253-E305 VanDerWaalsContact NE-CD 3.29Å; R253-E305 IonicContact NE-OE1 2.71Å; R253-E305 PolarHBondContact NE-OE1 3.24Å; R253-E305 IonicContact NE-OE2 2.92Å; R253-E305 PolarHBondContact NE-OE2 2.99Å; R253-E305 VanDerWaalsContact NE-OE2 3.09Å; R253-E305 IonicContact NH2-OE1 3.59Å; R253-E305 PolarHBondContact NH2-OE1 3.2Å; R253-E305 VanDerWaalsContact NH2-OE1 3.14Å; R253-E305 IonicContact NH2-OE2 3.41Å; R253-E305 PolarHBondContact NH2-OE2 2.97Å; R253-R308 VanDerWaalsContact NH2-NH1 3.14Å
254S94.5Very high96.3Very high1 Ų156.2 Ų56.21%0.00728%0.279CS..Hα-helixtrans-61-34.7-179.9-40.80000111.6A251 V257 L258 E305A251-S254 PolarHBondContact O-N 3.37Å; S254-V257 PolarHBondContact O-N 2.65Å; S254-L258 WeakPolarHBondContact O-CB 3.46Å; S254-L258 PolarHBondContact O-N 3.35Å; S254-E305 PolarHBondContact OG-OE2 2.71Å
255R96.5Very high96.4Very high81 Ų8155.2 Ų55.231%0.30627%0.273SS..Hα-helixtrans-63.8-46.1172.4-173.7177.8-62.9-85.3-4.2112R246 M248 L250 A251 R253 V257 L258 H259R246-R255 PolarHBondContact O-NH1 3.24Å; R246-R255 VanDerWaalsContact O-NH1 3.14Å; M248-R255 PolarHBondContact O-NH2 3.06Å; L250-R255 HydrophobicContact CB-CB 4.39Å; A251-R255 PolarHBondContact O-N 2.79Å; R253-R255 PolarHBondContact O-N 2.73Å; R255-V257 VanDerWaalsContact C-N 3.35Å; R255-V257 PolarHBondContact O-N 2.8Å; R255-L258 WeakPolarHBondContact O-CB 3.46Å; R255-L258 PolarHBondContact O-N 3.42Å; R255-H259 PolarHBondContact O-CD2 3.27Å; R255-H259 PolarHBondContact O-N 3.11Å
256R98.2Very high96.4Very high180 Ų18057.3 Ų57.368%0.67929%0.29SS*.Hα-helixtrans-59.3-44.5174.7-75.6-173.6-68.6166.2-2.7111.9A252 R253 L258 H259 A260A252-R256 WeakPolarHBondContact O-CG 3.37Å; A252-R256 PolarHBondContact O-N 2.86Å; R253-R256 WeakPolarHBondContact O-CB 3.41Å; R253-R256 PolarHBondContact O-N 3.3Å; R253-R256 VanDerWaalsContact O-N 3.08Å; R256-L258 VanDerWaalsContact C-N 3.34Å; R256-L258 PolarHBondContact O-N 2.83Å; R256-H259 PolarHBondContact O-N 2.78Å; R256-A260 WeakPolarHBondContact O-CB 3.48Å; R256-A260 PolarHBondContact O-N 3.43Å
257V98.1Very high96.5Very high4 Ų453.1 Ų53.12%0.02428%0.281CS..Hα-helixtrans-62.7-40.7176.9177.60000111.3R253 S254 R255 H259 A260 L261 F298 W301 L302R253-V257 WeakPolarHBondContact O-CG2 3.26Å; R253-V257 PolarHBondContact O-N 3Å; S254-V257 PolarHBondContact O-N 2.65Å; R255-V257 VanDerWaalsContact C-N 3.35Å; R255-V257 PolarHBondContact O-N 2.8Å; V257-H259 PolarHBondContact O-N 3.47Å; V257-A260 PolarHBondContact O-N 3.36Å; V257-L261 WeakPolarHBondContact O-CB 3.42Å; V257-L261 PolarHBondContact O-N 3.06Å; V257-F298 HydrophobicContact CG1-CD1 4.24Å; V257-W301 HydrophobicContact CG1-CB 4.09Å; V257-W301 HydrophobicContact CG1-CD2 4.32Å; V257-W301 HydrophobicContact CG1-CG 4.06Å; V257-W301 HydrophobicContact CG2-CD2 3.65Å; V257-W301 HydrophobicContact CG2-CE3 4Å; V257-W301 HydrophobicContact CG2-CG 4.08Å; V257-W301 HydrophobicContact CG2-CH2 4.39Å; V257-W301 HydrophobicContact CG2-CZ2 4.06Å; V257-W301 HydrophobicContact CG2-CZ3 4.35Å; V257-L302 HydrophobicContact CG1-CB 3.82Å; V257-L302 HydrophobicContact CG1-CD1 4.33Å
258L98.5Very high96.7Very high1 Ų144.7 Ų44.71%0.00525%0.25CS..Hα-helixtrans-60.2-43.3175-17873.7000112.2T241 L250 S254 R255 R256 I262 L302T241-L258 HydrophobicContact CG2-CD1 4.17Å; L250-L258 HydrophobicContact CD1-CD2 3.96Å; S254-L258 WeakPolarHBondContact O-CB 3.46Å; S254-L258 PolarHBondContact O-N 3.35Å; R255-L258 WeakPolarHBondContact O-CB 3.46Å; R255-L258 PolarHBondContact O-N 3.42Å; R256-L258 VanDerWaalsContact C-N 3.34Å; R256-L258 PolarHBondContact O-N 2.83Å; L258-I262 PolarHBondContact O-N 2.88Å; L258-L302 HydrophobicContact CB-CD1 4.23Å; L258-L302 HydrophobicContact CD1-CD1 4.44Å; L258-L302 HydrophobicContact CD1-CD2 3.59Å
259H98.7Very high96.9Very high74 Ų7446.2 Ų46.234%0.34326%0.258SS..Hα-helixtrans-68.9-41.3175.9-71.3-65.4000112.1W242 R255 R256 V257 L261 I262 V263W242-H259 AromaticContact NE1-CE1 3.61Å; W242-H259 AromaticContact NE1-ND1 3.27Å; W242-H259 PolarHBondContact NE1-ND1 2.96Å; R255-H259 PolarHBondContact O-CD2 3.27Å; R255-H259 PolarHBondContact O-N 3.11Å; R256-H259 PolarHBondContact O-N 2.78Å; V257-H259 PolarHBondContact O-N 3.47Å; H259-L261 VanDerWaalsContact C-N 3.31Å; H259-L261 PolarHBondContact O-N 2.7Å; H259-I262 WeakPolarHBondContact O-CG2 3.48Å; H259-I262 PolarHBondContact O-N 3.2Å; H259-V263 WeakPolarHBondContact O-CG2 3.4Å; H259-V263 PolarHBondContact O-N 3.19Å; H259-V263 VanDerWaalsContact O-N 3.15Å
260A98.8Very high97.1Very high23 Ų2344.5 Ų44.519%0.1925%0.252CS..Hα-helixtrans-59.8-43.1176.200000111.4R256 V257 I262 V263 T264 F298R256-A260 WeakPolarHBondContact O-CB 3.48Å; R256-A260 PolarHBondContact O-N 3.43Å; V257-A260 PolarHBondContact O-N 3.36Å; A260-I262 PolarHBondContact O-N 3.08Å; A260-V263 PolarHBondContact O-N 3.24Å; A260-T264 WeakPolarHBondContact O-CB 3.38Å; A260-T264 VanDerWaalsContact O-CG2 3.31Å; A260-T264 WeakPolarHBondContact O-CG2 3.4Å; A260-T264 PolarHBondContact O-N 3.49Å; A260-T264 PolarHBondContact O-OG1 3.46Å; A260-F298 HydrophobicContact CB-CD1 3.73Å; A260-F298 HydrophobicContact CB-CD2 3.87Å; A260-F298 HydrophobicContact CB-CE1 3.65Å; A260-F298 HydrophobicContact CB-CE2 3.78Å; A260-F298 HydrophobicContact CB-CG 3.85Å; A260-F298 HydrophobicContact CB-CZ 3.67Å
261L98.8Very high97.5Very high2 Ų245.9 Ų45.91%0.0126%0.259CS..Hα-helixtrans-54.9-52.5178176.258.6000112.3V238 V257 H259 T264 C265 L295 F298 A299 L302V238-L261 HydrophobicContact CG1-CD1 4.47Å; V238-L261 HydrophobicContact CG1-CD2 4.43Å; V238-L261 HydrophobicContact CG1-CG 3.91Å; V257-L261 WeakPolarHBondContact O-CB 3.42Å; V257-L261 PolarHBondContact O-N 3.06Å; H259-L261 VanDerWaalsContact C-N 3.31Å; H259-L261 PolarHBondContact O-N 2.7Å; L261-T264 PolarHBondContact O-N 3.4Å; L261-T264 PolarHBondContact O-OG1 2.88Å; L261-C265 WeakPolarHBondContact O-CB 3.41Å; L261-C265 PolarHBondContact O-N 3.37Å; L261-L295 HydrophobicContact CD1-CD1 3.55Å; L261-F298 HydrophobicContact CB-CB 4.14Å; L261-F298 HydrophobicContact CD1-CB 4.36Å; L261-A299 HydrophobicContact CD1-CB 3.91Å; L261-L302 HydrophobicContact CD2-CD2 3.57Å
262I98.7Very high97.8Very high25 Ų2544.5 Ų44.513%0.12825%0.25CC..Hα-helixtrans-66.2-39.8-179.2-17760.5000112.1F235 V238 V239 W242 L258 H259 A260 T264 C265 A266F235-I262 HydrophobicContact CE2-CD1 4.5Å; V238-I262 HydrophobicContact CG1-CB 4.3Å; V238-I262 HydrophobicContact CG1-CD1 3.85Å; V239-I262 HydrophobicContact CG2-CD1 3.7Å; W242-I262 HydrophobicContact CB-CB 4.14Å; W242-I262 HydrophobicContact CB-CG1 4.4Å; W242-I262 HydrophobicContact CB-CG2 4.45Å; W242-I262 VanDerWaalsContact CD1-CG2 3.41Å; W242-I262 HydrophobicContact CD2-CG2 4.35Å; W242-I262 HydrophobicContact CG-CB 4.03Å; W242-I262 HydrophobicContact CG-CG1 4.27Å; W242-I262 HydrophobicContact CG-CG2 3.84Å; L258-I262 PolarHBondContact O-N 2.88Å; H259-I262 WeakPolarHBondContact O-CG2 3.48Å; H259-I262 PolarHBondContact O-N 3.2Å; A260-I262 PolarHBondContact O-N 3.08Å; I262-T264 PolarHBondContact O-N 3.18Å; I262-C265 PolarHBondContact O-N 3.2Å; I262-A266 WeakPolarHBondContact O-CB 3.36Å; I262-A266 PolarHBondContact O-N 2.85Å
263V98.8Very high98.1Very high98 Ų9842.8 Ų42.859%0.59423%0.23SC*.Hα-helixtrans-61.6-46.3177.5171.10000110.3H259 A260 C265 A266 A267H259-V263 WeakPolarHBondContact O-CG2 3.4Å; H259-V263 PolarHBondContact O-N 3.19Å; H259-V263 VanDerWaalsContact O-N 3.15Å; A260-V263 PolarHBondContact O-N 3.24Å; V263-C265 VanDerWaalsContact C-N 3.33Å; V263-C265 PolarHBondContact O-N 3.18Å; V263-A266 PolarHBondContact O-N 2.71Å; V263-A267 WeakPolarHBondContact O-CB 3.41Å; V263-A267 PolarHBondContact O-N 2.87Å
264T98.7Very high98.3Very high14 Ų1440.4 Ų40.49%0.08623%0.227CC..Hα-helixtrans-69.7-30.2179.657.40000113.1A260 L261 I262 Q268 N291 V294 F298A260-T264 WeakPolarHBondContact O-CB 3.38Å; A260-T264 VanDerWaalsContact O-CG2 3.31Å; A260-T264 WeakPolarHBondContact O-CG2 3.4Å; A260-T264 PolarHBondContact O-N 3.49Å; A260-T264 PolarHBondContact O-OG1 3.46Å; L261-T264 PolarHBondContact O-N 3.4Å; L261-T264 PolarHBondContact O-OG1 2.88Å; I262-T264 PolarHBondContact O-N 3.18Å; T264-Q268 WeakPolarHBondContact O-CB 3.49Å; T264-Q268 PolarHBondContact O-N 3.45Å; T264-N291 PolarHBondContact O-ND2 3.08Å; T264-V294 HydrophobicContact CG2-CB 4.5Å; T264-V294 HydrophobicContact CG2-CG1 3.63Å; T264-F298 HydrophobicContact CG2-CD2 3.75Å; T264-F298 HydrophobicContact CG2-CE2 3.8Å
265C98.8Very high98.5Very high5 Ų540.8 Ų40.83%0.03423%0.23CC..Hα-helixtrans-71.3-40.6174.6-170.90000111.5V238 L261 I262 V263 Q268 M269 L295V238-C265 HydrophobicContact CB-CB 4.22Å; V238-C265 HydrophobicContact CG1-CB 3.73Å; V238-C265 HydrophobicContact CG2-CB 4.32Å; L261-C265 WeakPolarHBondContact O-CB 3.41Å; L261-C265 PolarHBondContact O-N 3.37Å; I262-C265 PolarHBondContact O-N 3.2Å; V263-C265 VanDerWaalsContact C-N 3.33Å; V263-C265 PolarHBondContact O-N 3.18Å; C265-Q268 WeakPolarHBondContact O-CB 3.28Å; C265-Q268 PolarHBondContact O-N 2.91Å; C265-M269 PolarHBondContact O-N 3.27Å; C265-L295 HydrophobicContact CB-CD1 3.88Å
266A98.8Very high98.6Very high43 Ų4337.7 Ų37.736%0.35522%0.219SC..Hα-helixtrans-62.5-44.7172.300000111.5F235 I262 V263 Q268 M269 A270F235-A266 HydrophobicContact CE2-CB 4.15Å; I262-A266 WeakPolarHBondContact O-CB 3.36Å; I262-A266 PolarHBondContact O-N 2.85Å; V263-A266 PolarHBondContact O-N 2.71Å; A266-Q268 VanDerWaalsContact C-N 3.32Å; A266-Q268 PolarHBondContact O-N 2.88Å; A266-M269 PolarHBondContact O-N 3.4Å; A266-A270 WeakPolarHBondContact O-CB 3.34Å; A266-A270 PolarHBondContact O-N 3.31Å
267A98.8Very high98.6Very high34 Ų3431.9 Ų31.928%0.28120%0.204SC..Hα-helixtrans-59.6-41.3172.900000111.9V263 M269 A270 L271V263-A267 WeakPolarHBondContact O-CB 3.41Å; V263-A267 PolarHBondContact O-N 2.87Å; A267-M269 PolarHBondContact O-N 3.41Å; A267-A270 PolarHBondContact O-N 3.09Å; A267-L271 WeakPolarHBondContact O-CB 3.34Å; A267-L271 VanDerWaalsContact O-CG 3.28Å; A267-L271 WeakPolarHBondContact O-CG 3.42Å; A267-L271 PolarHBondContact O-N 2.67Å
268Q98.8Very high98.6Very high21 Ų2137.4 Ų37.410%0.09823%0.229CC..Hα-helixtrans-60.4-46.3177.6-171.364.815.200111.5T264 C265 A266 G272 H288 N291 L295T264-Q268 WeakPolarHBondContact O-CB 3.49Å; T264-Q268 PolarHBondContact O-N 3.45Å; C265-Q268 WeakPolarHBondContact O-CB 3.28Å; C265-Q268 PolarHBondContact O-N 2.91Å; A266-Q268 VanDerWaalsContact C-N 3.32Å; A266-Q268 PolarHBondContact O-N 2.88Å; Q268-G272 PolarHBondContact O-N 2.92Å; Q268-H288 PolarHBondContact NE2-CD2 3.01Å; Q268-H288 PolarHBondContact NE2-CE1 3.41Å; Q268-H288 PolarHBondContact NE2-ND1 3.41Å; Q268-H288 PolarHBondContact NE2-NE2 2.85Å; Q268-H288 PolarHBondContact NE2-O 3.31Å; Q268-H288 PolarHBondContact O-CE1 3.47Å; Q268-H288 PolarHBondContact O-ND1 3.34Å; Q268-H288 VanDerWaalsContact O-ND1 3.12Å; Q268-H288 PolarHBondContact OE1-O 2.89Å; Q268-H288 VanDerWaalsContact OE1-O 3.13Å; Q268-N291 VanDerWaalsContact CA-ND2 3.33Å; Q268-N291 WeakPolarHBondContact CA-ND2 3.42Å; Q268-N291 WeakPolarHBondContact CB-ND2 3.38Å; Q268-N291 PolarHBondContact N-ND2 3.23Å; Q268-N291 VanDerWaalsContact N-ND2 3.18Å; Q268-N291 VanDerWaalsContact OE1-C 3.25Å; Q268-N291 PolarHBondContact OE1-ND2 3.33Å; Q268-L295 HydrophobicContact CB-CD2 4.18Å; Q268-L295 HydrophobicContact CG-CD2 4.1Å
269M98.5Very high98.5Very high53 Ų5345 Ų4526%0.26126%0.259SS..Hα-helixtrans-65.1-44.8178.8-172.9165.669.800111.3Y232 F235 C265 A266 A267 G272 I273Y232-M269 HydrophobicContact CD1-SD 4.43Å; F235-M269 HydrophobicContact CB-SD 4.01Å; F235-M269 HydrophobicContact CD1-CE 3.74Å; F235-M269 HydrophobicContact CD1-SD 4.03Å; F235-M269 HydrophobicContact CD2-CB 4.42Å; F235-M269 HydrophobicContact CD2-CE 3.68Å; F235-M269 HydrophobicContact CD2-SD 3.96Å; F235-M269 HydrophobicContact CE1-CE 3.64Å; F235-M269 HydrophobicContact CE2-CE 3.61Å; F235-M269 HydrophobicContact CE2-SD 4.49Å; F235-M269 HydrophobicContact CG-CE 3.76Å; F235-M269 HydrophobicContact CG-SD 3.72Å; F235-M269 HydrophobicContact CZ-CE 3.58Å; C265-M269 PolarHBondContact O-N 3.27Å; A266-M269 PolarHBondContact O-N 3.4Å; A267-M269 PolarHBondContact O-N 3.41Å; M269-G272 PolarHBondContact O-N 3.12Å; M269-I273 HydrophobicContact CG-CD1 3.91Å; M269-I273 VanDerWaalsContact O-CG1 3.31Å; M269-I273 WeakPolarHBondContact O-CG1 3.22Å; M269-I273 PolarHBondContact O-N 3Å
270A98.6Very high98.4Very high60 Ų6044 Ų4450%0.49626%0.258SS..Hα-helixtrans-60.6-46.7176.900000112A266 A267 G272 I273 A274A266-A270 WeakPolarHBondContact O-CB 3.34Å; A266-A270 PolarHBondContact O-N 3.31Å; A267-A270 PolarHBondContact O-N 3.09Å; A270-G272 VanDerWaalsContact C-N 3.31Å; A270-G272 PolarHBondContact O-N 3.26Å; A270-I273 PolarHBondContact O-N 3.46Å; A270-A274 WeakPolarHBondContact O-CB 3.48Å; A270-A274 PolarHBondContact O-N 3.3Å
271L98.7Very high98.4Very high40 Ų4045 Ų4521%0.20926%0.262CS..Hα-helixtrans-62-38.7176.1-73.9167.4000112A267 A274 A275 A287 H288 N291A267-L271 WeakPolarHBondContact O-CB 3.34Å; A267-L271 VanDerWaalsContact O-CG 3.28Å; A267-L271 WeakPolarHBondContact O-CG 3.42Å; A267-L271 PolarHBondContact O-N 2.67Å; L271-A274 PolarHBondContact O-N 2.86Å; L271-A275 VanDerWaalsContact O-CB 3.25Å; L271-A275 WeakPolarHBondContact O-CB 3.3Å; L271-A275 PolarHBondContact O-N 3.36Å; L271-A287 HydrophobicContact CD2-CB 4.02Å; L271-H288 HydrophobicContact CB-CB 4.08Å; L271-N291 HydrophobicContact CD1-CB 3.62Å
272G98.5Very high98.2Very high21 Ų2150 Ų5022%0.21629%0.288CS..Hα-helixtrans-67.6-42.6178.500000112.4Q268 M269 A270 L276 H288Q268-G272 PolarHBondContact O-N 2.92Å; M269-G272 PolarHBondContact O-N 3.12Å; A270-G272 VanDerWaalsContact C-N 3.31Å; A270-G272 PolarHBondContact O-N 3.26Å; G272-L276 WeakPolarHBondContact O-CB 3.19Å; G272-L276 PolarHBondContact O-N 3.26Å; G272-H288 WeakPolarHBondContact CA-CE1 3.15Å; G272-H288 VanDerWaalsContact CA-ND1 3.31Å; G272-H288 WeakPolarHBondContact CA-ND1 3.29Å; G272-H288 PolarHBondContact N-ND1 2.92Å
273I98.4Very high98.1Very high40 Ų4052.7 Ų52.721%0.20531%0.31CS..Hα-helixtrans-65-45.3174.9-66.2166.2000110.3W194 M269 A270 L276 V277W194-I273 HydrophobicContact CB-CG2 4.29Å; W194-I273 HydrophobicContact CD2-CD1 4.22Å; W194-I273 HydrophobicContact CD2-CG1 4.38Å; W194-I273 HydrophobicContact CD2-CG2 4.06Å; W194-I273 HydrophobicContact CE3-CG2 4.39Å; W194-I273 HydrophobicContact CG-CG1 4.34Å; W194-I273 HydrophobicContact CG-CG2 3.99Å; W194-I273 HydrophobicContact CH2-CD1 4.45Å; W194-I273 HydrophobicContact CZ2-CD1 3.82Å; M269-I273 HydrophobicContact CG-CD1 3.91Å; M269-I273 VanDerWaalsContact O-CG1 3.31Å; M269-I273 WeakPolarHBondContact O-CG1 3.22Å; M269-I273 PolarHBondContact O-N 3Å; A270-I273 PolarHBondContact O-N 3.46Å; I273-L276 WeakPolarHBondContact O-CB 3.23Å; I273-L276 PolarHBondContact O-N 3.4Å; I273-V277 HydrophobicContact CG2-CG2 4.29Å; I273-V277 WeakPolarHBondContact O-CG2 3.36Å; I273-V277 PolarHBondContact O-N 2.83Å
274A98.5Very high98.1Very high28 Ų2850 Ų5023%0.23129%0.292CS..Hα-helixtrans-61.8-47.817800000111.5A270 L271 L276 V277 H278 L284A270-A274 WeakPolarHBondContact O-CB 3.48Å; A270-A274 PolarHBondContact O-N 3.3Å; L271-A274 PolarHBondContact O-N 2.86Å; A274-L276 VanDerWaalsContact C-N 3.27Å; A274-L276 PolarHBondContact O-N 3.24Å; A274-V277 PolarHBondContact O-N 3.42Å; A274-H278 WeakPolarHBondContact O-CB 3.47Å; A274-H278 PolarHBondContact O-CD2 3.04Å; A274-H278 PolarHBondContact O-N 3.45Å; A274-L284 HydrophobicContact CB-CD1 4.02Å
275A98.3Very high98Very high9 Ų950.5 Ų50.57%0.07430%0.297CS..Hα-helixtrans-58-41.6175.800000111.4L271 V280 L284L271-A275 VanDerWaalsContact O-CB 3.25Å; L271-A275 WeakPolarHBondContact O-CB 3.3Å; L271-A275 PolarHBondContact O-N 3.36Å; A275-V280 VanDerWaalsContact O-CA 3.23Å; A275-V280 WeakPolarHBondContact O-CA 3.35Å; A275-V280 PolarHBondContact O-N 3.11Å; A275-L284 HydrophobicContact CB-CB 3.94Å
276L97.8Very high97.9Very high16 Ų1654.7 Ų54.78%0.08432%0.316CS..Hα-helixtrans-63.2-53.2176.7175.164.8000112.5N192 W194 G272 I273 A274 H278 Y279N192-L276 WeakPolarHBondContact CB-O 3.17Å; N192-L276 PolarHBondContact ND2-O 3.47Å; W194-L276 HydrophobicContact CB-CD2 4.46Å; G272-L276 WeakPolarHBondContact O-CB 3.19Å; G272-L276 PolarHBondContact O-N 3.26Å; I273-L276 WeakPolarHBondContact O-CB 3.23Å; I273-L276 PolarHBondContact O-N 3.4Å; A274-L276 VanDerWaalsContact C-N 3.27Å; A274-L276 PolarHBondContact O-N 3.24Å; L276-H278 VanDerWaalsContact C-N 3.29Å; L276-H278 PolarHBondContact O-N 2.94Å; L276-Y279 PolarHBondContact O-N 2.82Å
277V98Very high97.9Very high58 Ų5854.5 Ų54.535%0.35232%0.315SS..Hα-helixtrans-70.1-27.3-172.9173.30000112W194 I273 A274W194-V277 HydrophobicContact CB-CG2 4.02Å; I273-V277 HydrophobicContact CG2-CG2 4.29Å; I273-V277 WeakPolarHBondContact O-CG2 3.36Å; I273-V277 PolarHBondContact O-N 2.83Å; A274-V277 PolarHBondContact O-N 3.42Å
278H98.1Very high97.9Very high120 Ų12054.6 Ų54.656%0.55631%0.309SS*.THydrogen-bonded Turntrans-94.919.1179-65.2-66.6000114.4A274 L276 P281 L284A274-H278 WeakPolarHBondContact O-CB 3.47Å; A274-H278 PolarHBondContact O-CD2 3.04Å; A274-H278 PolarHBondContact O-N 3.45Å; L276-H278 VanDerWaalsContact C-N 3.29Å; L276-H278 PolarHBondContact O-N 2.94Å; H278-P281 HydrophobicContact CB-CG 4.11Å; H278-P281 WeakPolarHBondContact O-CD 3.48Å; H278-L284 HydrophobicContact CB-CD1 4.15Å
279Y97.3Very high97.8Very high161 Ų16157.7 Ų57.763%0.63132%0.324SS*.THydrogen-bonded Turntrans63.238.7177.5-55.4-92.5000114.6L189 N192 L276L189-Y279 WeakPolarHBondContact CD2-O 3.4Å; N192-Y279 HydrophobicContact CB-CD1 3.9Å; N192-Y279 HydrophobicContact CB-CE1 3.78Å; N192-Y279 HydrophobicContact CB-CG 4.49Å; L276-Y279 PolarHBondContact O-N 2.82Å
280V97.1Very high97.8Very high53 Ų5358 Ų5832%0.32134%0.335SS..  trans54.155.7173.7-163.40000112.4G188 L189 A275 A285G188-V280 VanDerWaalsContact O-CG2 3.29Å; G188-V280 WeakPolarHBondContact O-CG2 3.42Å; L189-V280 HydrophobicContact CD2-CB 4.18Å; L189-V280 HydrophobicContact CD2-CG2 4.12Å; A275-V280 VanDerWaalsContact O-CA 3.23Å; A275-V280 WeakPolarHBondContact O-CA 3.35Å; A275-V280 PolarHBondContact O-N 3.11Å; V280-A285 HydrophobicContact CG1-CB 3.9Å
281P97.7Very high97.8Very high44 Ų4456.3 Ų56.329%0.28632%0.317SS..  trans-64.8142.5174.230.7-30.7000108.5H278 S283 L284 A285H278-P281 HydrophobicContact CB-CG 4.11Å; H278-P281 WeakPolarHBondContact O-CD 3.48Å; P281-S283 VanDerWaalsContact C-N 3.25Å; P281-S283 PolarHBondContact O-N 3.19Å; P281-S283 VanDerWaalsContact O-N 3.16Å; P281-L284 HydrophobicContact CG-CB 3.9Å; P281-L284 HydrophobicContact CG-CD1 3.57Å; P281-L284 HydrophobicContact CG-CG 3.77Å; P281-L284 PolarHBondContact O-N 3.14Å; P281-A285 PolarHBondContact O-N 3.3Å
282L94.4Very high97.8Very high106 Ų10655.2 Ų55.256%0.55531%0.311SS*.Hα-helixtrans-53-43.5-171.1179.862.9000112.4L284 A285 E286L282-L284 PolarHBondContact O-N 3.03Å; L282-A285 PolarHBondContact O-N 3.13Å; L282-E286 HydrophobicContact CD1-CG 3.9Å; L282-E286 WeakPolarHBondContact CD1-OE1 3.36Å; L282-E286 HydrophobicContact CG-CG 4.25Å; L282-E286 WeakPolarHBondContact O-CB 3.43Å; L282-E286 WeakPolarHBondContact O-CG 3.41Å; L282-E286 PolarHBondContact O-N 3.02Å
283S97.6Very high97.8Very high83 Ų8356.3 Ų56.358%0.5831%0.311SS*.Hα-helixtrans-60.1-41.5179.955.70000113.4P281 A287P281-S283 VanDerWaalsContact C-N 3.25Å; P281-S283 PolarHBondContact O-N 3.19Å; P281-S283 VanDerWaalsContact O-N 3.16Å; S283-A287 WeakPolarHBondContact O-CB 3.46Å; S283-A287 PolarHBondContact O-N 2.74Å
284L98.3Very high97.8Very high42 Ų4257.2 Ų57.222%0.2232%0.318CS..Hα-helixtrans-74.3-36.8177.4-66.9-179.4000111.6A274 A275 H278 P281 L282 A287 H288A274-L284 HydrophobicContact CB-CD1 4.02Å; A275-L284 HydrophobicContact CB-CB 3.94Å; H278-L284 HydrophobicContact CB-CD1 4.15Å; P281-L284 HydrophobicContact CG-CB 3.9Å; P281-L284 HydrophobicContact CG-CD1 3.57Å; P281-L284 HydrophobicContact CG-CG 3.77Å; P281-L284 PolarHBondContact O-N 3.14Å; L282-L284 PolarHBondContact O-N 3.03Å; L284-A287 PolarHBondContact O-N 3.27Å; L284-H288 VanDerWaalsContact O-CB 3.23Å; L284-H288 WeakPolarHBondContact O-CB 3.35Å; L284-H288 PolarHBondContact O-N 2.77Å
285A97.6Very high97.8Very high24 Ų2456.1 Ų56.120%0.19831%0.308CS..Hα-helixtrans-62.8-46.7176.500000111.4V280 P281 L282 H288 Q289V280-A285 HydrophobicContact CG1-CB 3.9Å; P281-A285 PolarHBondContact O-N 3.3Å; L282-A285 PolarHBondContact O-N 3.13Å; A285-H288 PolarHBondContact O-N 3.05Å; A285-Q289 WeakPolarHBondContact O-CG 3.22Å; A285-Q289 PolarHBondContact O-N 3.02Å
286E96.2Very high97.8Very high92 Ų9256.2 Ų56.243%0.4331%0.308SS..Hα-helixtrans-65.9-44176.3-71.2178.9164.900111.7L282 H288 Q289 A290L282-E286 HydrophobicContact CD1-CG 3.9Å; L282-E286 WeakPolarHBondContact CD1-OE1 3.36Å; L282-E286 HydrophobicContact CG-CG 4.25Å; L282-E286 WeakPolarHBondContact O-CB 3.43Å; L282-E286 WeakPolarHBondContact O-CG 3.41Å; L282-E286 PolarHBondContact O-N 3.02Å; E286-H288 VanDerWaalsContact C-N 3.3Å; E286-H288 PolarHBondContact O-N 2.84Å; E286-Q289 PolarHBondContact O-N 3.38Å; E286-A290 WeakPolarHBondContact O-CB 3.4Å; E286-A290 PolarHBondContact O-N 3.23Å
287A98.6Very high97.8Very high39 Ų3956.8 Ų56.832%0.32231%0.312SS..Hα-helixtrans-60.1-41.1175.500000111.8L271 S283 L284 A290 N291L271-A287 HydrophobicContact CD2-CB 4.02Å; S283-A287 WeakPolarHBondContact O-CB 3.46Å; S283-A287 PolarHBondContact O-N 2.74Å; L284-A287 PolarHBondContact O-N 3.27Å; A287-A290 PolarHBondContact O-N 3.21Å; A287-N291 WeakPolarHBondContact O-CB 3.3Å; A287-N291 PolarHBondContact O-N 3.12Å
288H98.5Very high97.9Very high36 Ų3656.1 Ų56.117%0.16730%0.304CS..Hα-helixtrans-63.5-41.7175.5-174.575.3000112.1Q268 L271 G272 L284 A285 E286 F292Q268-H288 PolarHBondContact NE2-CD2 3.01Å; Q268-H288 PolarHBondContact NE2-CE1 3.41Å; Q268-H288 PolarHBondContact NE2-ND1 3.41Å; Q268-H288 PolarHBondContact NE2-NE2 2.85Å; Q268-H288 PolarHBondContact NE2-O 3.31Å; Q268-H288 PolarHBondContact O-CE1 3.47Å; Q268-H288 PolarHBondContact O-ND1 3.34Å; Q268-H288 VanDerWaalsContact O-ND1 3.12Å; Q268-H288 PolarHBondContact OE1-O 2.89Å; Q268-H288 VanDerWaalsContact OE1-O 3.13Å; L271-H288 HydrophobicContact CB-CB 4.08Å; G272-H288 WeakPolarHBondContact CA-CE1 3.15Å; G272-H288 VanDerWaalsContact CA-ND1 3.31Å; G272-H288 WeakPolarHBondContact CA-ND1 3.29Å; G272-H288 PolarHBondContact N-ND1 2.92Å; L284-H288 VanDerWaalsContact O-CB 3.23Å; L284-H288 WeakPolarHBondContact O-CB 3.35Å; L284-H288 PolarHBondContact O-N 2.77Å; A285-H288 PolarHBondContact O-N 3.05Å; E286-H288 VanDerWaalsContact C-N 3.3Å; E286-H288 PolarHBondContact O-N 2.84Å; H288-F292 PolarHBondContact O-N 2.96Å; H288-F292 VanDerWaalsContact O-N 3.15Å
289Q97.1Very high97.9Very high87 Ų8750.5 Ų50.541%0.40728%0.278SS..Hα-helixtrans-68.7-41.7175.7-72.9-180-23.200112.4A285 E286 F292 M293A285-Q289 WeakPolarHBondContact O-CG 3.22Å; A285-Q289 PolarHBondContact O-N 3.02Å; E286-Q289 PolarHBondContact O-N 3.38Å; Q289-F292 WeakPolarHBondContact O-CB 3.4Å; Q289-F292 PolarHBondContact O-N 3.47Å; Q289-M293 PolarHBondContact O-N 3.21Å
290A98Very high98Very high59 Ų5943 Ų4349%0.48825%0.25SC..Hα-helixtrans-64.1-44.4177.500000111.5E286 A287 F292 M293 V294E286-A290 WeakPolarHBondContact O-CB 3.4Å; E286-A290 PolarHBondContact O-N 3.23Å; A287-A290 PolarHBondContact O-N 3.21Å; A290-F292 VanDerWaalsContact C-N 3.25Å; A290-F292 PolarHBondContact O-N 3.26Å; A290-M293 WeakPolarHBondContact O-CB 3.21Å; A290-M293 PolarHBondContact O-N 2.9Å; A290-M293 VanDerWaalsContact O-N 3.08Å; A290-V294 PolarHBondContact O-N 3.41Å
291N98.7Very high98Very high25 Ų2543.6 Ų43.613%0.13425%0.246CC..Hα-helixtrans-66.3-27.8176.7-173.480000112.2T264 Q268 L271 A287 M293 V294 L295T264-N291 PolarHBondContact O-ND2 3.08Å; Q268-N291 VanDerWaalsContact CA-ND2 3.33Å; Q268-N291 WeakPolarHBondContact CA-ND2 3.42Å; Q268-N291 WeakPolarHBondContact CB-ND2 3.38Å; Q268-N291 PolarHBondContact N-ND2 3.23Å; Q268-N291 VanDerWaalsContact N-ND2 3.18Å; Q268-N291 VanDerWaalsContact OE1-C 3.25Å; Q268-N291 PolarHBondContact OE1-ND2 3.33Å; L271-N291 HydrophobicContact CD1-CB 3.62Å; A287-N291 WeakPolarHBondContact O-CB 3.3Å; A287-N291 PolarHBondContact O-N 3.12Å; N291-M293 VanDerWaalsContact C-N 3.27Å; N291-M293 PolarHBondContact O-N 3.44Å; N291-V294 WeakPolarHBondContact O-CB 3.41Å; N291-V294 PolarHBondContact O-N 2.84Å; N291-V294 VanDerWaalsContact O-N 3.12Å; N291-L295 PolarHBondContact O-N 2.93Å
292F98.7Very high98Very high16 Ų1641.5 Ų41.57%0.0723%0.232CC..Hα-helixtrans-61.6-35.8171.6177.5-112.2000112F132 H288 Q289 A290 V294 L295 L296F132-F292 HydrophobicContact CD2-CD1 4.11Å; F132-F292 AromaticContact CD2-CE1 3.46Å; F132-F292 HydrophobicContact CD2-CE1 3.46Å; F132-F292 VanDerWaalsContact CD2-CE1 3.46Å; F132-F292 HydrophobicContact CD2-CZ 4.46Å; F132-F292 AromaticContact CE2-CD1 3.57Å; F132-F292 HydrophobicContact CE2-CD1 3.57Å; F132-F292 AromaticContact CE2-CE1 3.39Å; F132-F292 HydrophobicContact CE2-CE1 3.39Å; F132-F292 HydrophobicContact CG-CE1 4.08Å; F132-F292 AromaticContact CZ-CD1 3.79Å; F132-F292 HydrophobicContact CZ-CD1 3.79Å; F132-F292 AromaticContact CZ-CE1 4Å; F132-F292 HydrophobicContact CZ-CE1 4Å; H288-F292 PolarHBondContact O-N 2.96Å; H288-F292 VanDerWaalsContact O-N 3.15Å; Q289-F292 WeakPolarHBondContact O-CB 3.4Å; Q289-F292 PolarHBondContact O-N 3.47Å; A290-F292 VanDerWaalsContact C-N 3.25Å; A290-F292 PolarHBondContact O-N 3.26Å; F292-V294 VanDerWaalsContact C-N 3.32Å; F292-V294 PolarHBondContact O-N 3.36Å; F292-L295 HydrophobicContact CD2-CD2 4.31Å; F292-L295 PolarHBondContact O-N 3.09Å; F292-L296 HydrophobicContact CE1-CD2 4.38Å; F292-L296 HydrophobicContact CZ-CB 4.35Å; F292-L296 WeakPolarHBondContact O-CB 3.45Å; F292-L296 PolarHBondContact O-N 2.77Å
293M98.2Very high98.2Very high45 Ų4537.8 Ų37.822%0.22221%0.213CC..Hα-helixtrans-62.7-39.7172.8-66.3-62.190.400112.3F132 Y135 Q289 A290 N291 L296 T297F132-M293 HydrophobicContact CD1-CE 3.19Å; F132-M293 HydrophobicContact CD1-SD 3.62Å; F132-M293 HydrophobicContact CD2-CE 4.15Å; F132-M293 HydrophobicContact CE1-CE 3.08Å; F132-M293 HydrophobicContact CE1-SD 3.56Å; F132-M293 VanDerWaalsContact CE1-SD 3.56Å; F132-M293 HydrophobicContact CE2-CE 4.03Å; F132-M293 HydrophobicContact CG-CE 3.73Å; F132-M293 HydrophobicContact CZ-CE 3.5Å; F132-M293 HydrophobicContact CZ-SD 4.47Å; Y135-M293 HydrophobicContact CD1-SD 4.44Å; Q289-M293 PolarHBondContact O-N 3.21Å; A290-M293 WeakPolarHBondContact O-CB 3.21Å; A290-M293 PolarHBondContact O-N 2.9Å; A290-M293 VanDerWaalsContact O-N 3.08Å; N291-M293 VanDerWaalsContact C-N 3.27Å; N291-M293 PolarHBondContact O-N 3.44Å; M293-L296 HydrophobicContact CE-CB 4.43Å; M293-L296 HydrophobicContact CE-CD2 3.83Å; M293-L296 PolarHBondContact O-N 3.25Å; M293-T297 WeakPolarHBondContact O-CB 3.49Å; M293-T297 PolarHBondContact O-N 3.44Å; M293-T297 PolarHBondContact O-OG1 3.27Å
294V98.6Very high98Very high58 Ų5834 Ų3435%0.35219%0.186SC..Hα-helixtrans-65.5-44.1174.8-1720000110.9T264 A290 N291 F292 T297 F298T264-V294 HydrophobicContact CG2-CB 4.5Å; T264-V294 HydrophobicContact CG2-CG1 3.63Å; A290-V294 PolarHBondContact O-N 3.41Å; N291-V294 WeakPolarHBondContact O-CB 3.41Å; N291-V294 PolarHBondContact O-N 2.84Å; N291-V294 VanDerWaalsContact O-N 3.12Å; F292-V294 VanDerWaalsContact C-N 3.32Å; F292-V294 PolarHBondContact O-N 3.36Å; V294-T297 VanDerWaalsContact O-CB 3.27Å; V294-T297 WeakPolarHBondContact O-CB 3.34Å; V294-T297 PolarHBondContact O-N 2.92Å; V294-F298 HydrophobicContact CG1-CD2 3.81Å; V294-F298 HydrophobicContact CG1-CE2 3.43Å; V294-F298 VanDerWaalsContact CG1-CE2 3.43Å; V294-F298 HydrophobicContact CG1-CZ 4.48Å; V294-F298 VanDerWaalsContact O-CD2 3.31Å; V294-F298 WeakPolarHBondContact O-CD2 3.14Å; V294-F298 PolarHBondContact O-N 3.39Å
295L98.8Very high97.8Very high5 Ų532.1 Ų32.13%0.02618%0.176CC..Hα-helixtrans-59.8-48.4175.4175.659.1000111.8L261 C265 Q268 N291 F292 T297 F298 A299L261-L295 HydrophobicContact CD1-CD1 3.55Å; C265-L295 HydrophobicContact CB-CD1 3.88Å; Q268-L295 HydrophobicContact CB-CD2 4.18Å; Q268-L295 HydrophobicContact CG-CD2 4.1Å; N291-L295 PolarHBondContact O-N 2.93Å; F292-L295 HydrophobicContact CD2-CD2 4.31Å; F292-L295 PolarHBondContact O-N 3.09Å; L295-T297 PolarHBondContact O-N 2.8Å; L295-F298 PolarHBondContact O-N 3.5Å; L295-A299 WeakPolarHBondContact O-CB 3.4Å; L295-A299 PolarHBondContact O-N 3.34Å
296L98.7Very high97.6Very high12 Ų1231 Ų316%0.06317%0.167CC..Hα-helixtrans-59.3-38.2176.8-179.360.2000111.2F132 Y135 L169 F292 M293 T300F132-L296 HydrophobicContact CB-CD2 4.12Å; Y135-L296 HydrophobicContact CD1-CD2 3.8Å; Y135-L296 HydrophobicContact CD1-CG 4.33Å; Y135-L296 HydrophobicContact CE1-CD2 4.31Å; Y135-L296 HydrophobicContact CE1-CG 4.42Å; L169-L296 HydrophobicContact CD1-CD1 3.63Å; F292-L296 HydrophobicContact CE1-CD2 4.38Å; F292-L296 HydrophobicContact CZ-CB 4.35Å; F292-L296 WeakPolarHBondContact O-CB 3.45Å; F292-L296 PolarHBondContact O-N 2.77Å; M293-L296 HydrophobicContact CE-CB 4.43Å; M293-L296 HydrophobicContact CE-CD2 3.83Å; M293-L296 PolarHBondContact O-N 3.25Å; L296-T300 VanDerWaalsContact O-CB 3.24Å; L296-T300 WeakPolarHBondContact O-CB 3.19Å; L296-T300 PolarHBondContact O-N 3.22Å; L296-T300 PolarHBondContact O-OG1 2.83Å
297T98.7Very high97.3Very high28 Ų2833.7 Ų33.717%0.17217%0.173CC..Hα-helixtrans-59.3-55.8175.7-54.50000111Y135 L139 M293 V294 L295 T300 W301Y135-T297 PolarHBondContact OH-OG1 3.3Å; L139-T297 HydrophobicContact CD2-CG2 3.86Å; M293-T297 WeakPolarHBondContact O-CB 3.49Å; M293-T297 PolarHBondContact O-N 3.44Å; M293-T297 PolarHBondContact O-OG1 3.27Å; V294-T297 VanDerWaalsContact O-CB 3.27Å; V294-T297 WeakPolarHBondContact O-CB 3.34Å; V294-T297 PolarHBondContact O-N 2.92Å; L295-T297 PolarHBondContact O-N 2.8Å; T297-T300 PolarHBondContact O-N 3.18Å; T297-W301 WeakPolarHBondContact O-CB 3.29Å; T297-W301 PolarHBondContact O-N 2.98Å
298F98.8Very high96.6Very high44 Ų4432.4 Ų32.419%0.19316%0.16CC..Hα-helixtrans-71.6-32.7-175.6-69.3-56.5000112.9V257 A260 L261 T264 V294 L295 W301 L302V257-F298 HydrophobicContact CG1-CD1 4.24Å; A260-F298 HydrophobicContact CB-CD1 3.73Å; A260-F298 HydrophobicContact CB-CD2 3.87Å; A260-F298 HydrophobicContact CB-CE1 3.65Å; A260-F298 HydrophobicContact CB-CE2 3.78Å; A260-F298 HydrophobicContact CB-CG 3.85Å; A260-F298 HydrophobicContact CB-CZ 3.67Å; L261-F298 HydrophobicContact CB-CB 4.14Å; L261-F298 HydrophobicContact CD1-CB 4.36Å; T264-F298 HydrophobicContact CG2-CD2 3.75Å; T264-F298 HydrophobicContact CG2-CE2 3.8Å; V294-F298 HydrophobicContact CG1-CD2 3.81Å; V294-F298 HydrophobicContact CG1-CE2 3.43Å; V294-F298 VanDerWaalsContact CG1-CE2 3.43Å; V294-F298 HydrophobicContact CG1-CZ 4.48Å; V294-F298 VanDerWaalsContact O-CD2 3.31Å; V294-F298 WeakPolarHBondContact O-CD2 3.14Å; V294-F298 PolarHBondContact O-N 3.39Å; L295-F298 PolarHBondContact O-N 3.5Å; F298-W301 HydrophobicContact CD1-CE3 4.08Å; F298-W301 HydrophobicContact CE1-CE3 4.12Å; F298-W301 HydrophobicContact CE1-CZ3 4.19Å; F298-L302 VanDerWaalsContact O-CB 3.28Å; F298-L302 WeakPolarHBondContact O-CB 3.45Å; F298-L302 PolarHBondContact O-N 3.42Å
299A98.7Very high96Very high1 Ų130.8 Ų30.81%0.00815%0.153CC..Hα-helixtrans-64.8-47.4174.200000111.1L169 L261 L295 L303L169-A299 HydrophobicContact CB-CB 4.33Å; L169-A299 HydrophobicContact CD1-CB 3.91Å; L261-A299 HydrophobicContact CD1-CB 3.91Å; L295-A299 WeakPolarHBondContact O-CB 3.4Å; L295-A299 PolarHBondContact O-N 3.34Å; A299-L303 PolarHBondContact O-N 3Å; A299-L303 VanDerWaalsContact O-N 3.12Å
300T98.5Very high95.1Very high5 Ų528.1 Ų28.13%0.03114%0.143CC..Hα-helixtrans-63.5-44.1176.2-56.70000111.1L139 W140 L296 T297 L303 N304L139-T300 HydrophobicContact CD2-CG2 4.14Å; L139-T300 HydrophobicContact CG-CG2 4.38Å; W140-T300 HydrophobicContact CB-CG2 4.18Å; W140-T300 HydrophobicContact CE3-CG2 3.98Å; L296-T300 VanDerWaalsContact O-CB 3.24Å; L296-T300 WeakPolarHBondContact O-CB 3.19Å; L296-T300 PolarHBondContact O-N 3.22Å; L296-T300 PolarHBondContact O-OG1 2.83Å; T297-T300 PolarHBondContact O-N 3.18Å; T300-L303 PolarHBondContact O-N 2.68Å; T300-N304 WeakPolarHBondContact O-CB 3.39Å; T300-N304 PolarHBondContact O-N 2.6Å
301W98Very high94.1Very high64 Ų6428.7 Ų28.724%0.24214%0.14CC..Hα-helixtrans-64.8-46.2179.7-172.11.4000111.6L143 R253 V257 T297 F298 L303 N304 E305L143-W301 HydrophobicContact CD1-CB 3.77Å; L143-W301 HydrophobicContact CD1-CG 3.83Å; L143-W301 HydrophobicContact CD2-CD2 4.38Å; L143-W301 HydrophobicContact CD2-CG 4.26Å; R253-W301 HydrophobicContact CG-CZ2 4.27Å; V257-W301 HydrophobicContact CG1-CB 4.09Å; V257-W301 HydrophobicContact CG1-CD2 4.32Å; V257-W301 HydrophobicContact CG1-CG 4.06Å; V257-W301 HydrophobicContact CG2-CD2 3.65Å; V257-W301 HydrophobicContact CG2-CE3 4Å; V257-W301 HydrophobicContact CG2-CG 4.08Å; V257-W301 HydrophobicContact CG2-CH2 4.39Å; V257-W301 HydrophobicContact CG2-CZ2 4.06Å; V257-W301 HydrophobicContact CG2-CZ3 4.35Å; T297-W301 WeakPolarHBondContact O-CB 3.29Å; T297-W301 PolarHBondContact O-N 2.98Å; F298-W301 HydrophobicContact CD1-CE3 4.08Å; F298-W301 HydrophobicContact CE1-CE3 4.12Å; F298-W301 HydrophobicContact CE1-CZ3 4.19Å; W301-L303 VanDerWaalsContact C-N 3.31Å; W301-L303 PolarHBondContact O-N 3.4Å; W301-N304 WeakPolarHBondContact O-CB 3.47Å; W301-N304 PolarHBondContact O-N 2.76Å; W301-N304 VanDerWaalsContact O-N 3.11Å; W301-E305 PolarHBondContact NE1-OE1 3.25Å; W301-E305 WeakPolarHBondContact O-CG 3.45Å; W301-E305 PolarHBondContact O-N 3.07Å
302L97.8Very high92.5Very high0 Ų037.5 Ų37.50%018%0.177CC..Hα-helixtrans-58.5-46.7177.6-174.660000110.7T165 T241 V257 L258 L261 F298 N304 E305 L306T165-L302 HydrophobicContact CG2-CB 3.91Å; T165-L302 HydrophobicContact CG2-CD2 3.82Å; T165-L302 HydrophobicContact CG2-CG 3.81Å; T241-L302 HydrophobicContact CG2-CD2 4.02Å; V257-L302 HydrophobicContact CG1-CB 3.82Å; V257-L302 HydrophobicContact CG1-CD1 4.33Å; L258-L302 HydrophobicContact CB-CD1 4.23Å; L258-L302 HydrophobicContact CD1-CD1 4.44Å; L258-L302 HydrophobicContact CD1-CD2 3.59Å; L261-L302 HydrophobicContact CD2-CD2 3.57Å; F298-L302 VanDerWaalsContact O-CB 3.28Å; F298-L302 WeakPolarHBondContact O-CB 3.45Å; F298-L302 PolarHBondContact O-N 3.42Å; L302-N304 VanDerWaalsContact C-N 3.27Å; L302-N304 PolarHBondContact O-N 2.93Å; L302-E305 PolarHBondContact O-N 3.25Å; L302-L306 HydrophobicContact CD1-CD1 4.21Å; L302-L306 HydrophobicContact CD1-CG 4.22Å; L302-L306 HydrophobicContact CG-CD1 3.91Å; L302-L306 HydrophobicContact CG-CG 4.35Å; L302-L306 WeakPolarHBondContact O-CB 3.21Å; L302-L306 WeakPolarHBondContact O-CG 3.47Å; L302-L306 PolarHBondContact O-N 3.21Å
303L97.2Very high92.2Very high28 Ų2838.6 Ų38.615%0.14718%0.182CC..Hα-helixtrans-61.5-39.3178.4-174.358.2000111.6W140 T165 A166 L169 A299 T300 W301 L306 R307W140-L303 HydrophobicContact CH2-CD2 4.45Å; W140-L303 HydrophobicContact CH2-CG 4.18Å; W140-L303 HydrophobicContact CZ3-CB 4.16Å; W140-L303 HydrophobicContact CZ3-CD2 4.16Å; W140-L303 HydrophobicContact CZ3-CG 3.94Å; T165-L303 HydrophobicContact CG2-CB 3.83Å; T165-L303 HydrophobicContact CG2-CD1 4.38Å; A166-L303 HydrophobicContact CB-CD1 4.08Å; A166-L303 HydrophobicContact CB-CD2 4.22Å; L169-L303 HydrophobicContact CD2-CD2 3.77Å; A299-L303 PolarHBondContact O-N 3Å; A299-L303 VanDerWaalsContact O-N 3.12Å; T300-L303 PolarHBondContact O-N 2.68Å; W301-L303 VanDerWaalsContact C-N 3.31Å; W301-L303 PolarHBondContact O-N 3.4Å; L303-L306 PolarHBondContact O-N 3.18Å; L303-R307 WeakPolarHBondContact O-CB 3.5Å; L303-R307 PolarHBondContact O-N 3.05Å
304N95.1Very high91.9Very high4 Ų438.3 Ų38.32%0.02118%0.18CC..Hα-helixtrans-65.8-43.6177.8-160.3-82.6000111.8W140 L143 T300 W301 L302 R307 R308W140-N304 HydrophobicContact CE3-CB 3.86Å; W140-N304 HydrophobicContact CZ3-CB 3.76Å; W140-N304 PolarHBondContact O-ND2 3.48Å; L143-N304 HydrophobicContact CB-CB 4.4Å; L143-N304 HydrophobicContact CD1-CB 4.28Å; T300-N304 WeakPolarHBondContact O-CB 3.39Å; T300-N304 PolarHBondContact O-N 2.6Å; W301-N304 WeakPolarHBondContact O-CB 3.47Å; W301-N304 PolarHBondContact O-N 2.76Å; W301-N304 VanDerWaalsContact O-N 3.11Å; L302-N304 VanDerWaalsContact C-N 3.27Å; L302-N304 PolarHBondContact O-N 2.93Å; N304-R307 PolarHBondContact O-N 3.47Å; N304-R308 WeakPolarHBondContact O-CG 3.33Å; N304-R308 PolarHBondContact O-NE 3.44Å; N304-R308 VanDerWaalsContact OD1-CZ 3.32Å; N304-R308 PolarHBondContact OD1-NE 3.44Å; N304-R308 PolarHBondContact OD1-NH2 2.84Å
305E93.1Very high91.5Very high2 Ų237.2 Ų37.21%0.00917%0.171CC..Hα-helixtrans-59.1-47.8173.3-69.3-67.9139.900111.2R253 S254 W301 L302 R307 R308R253-E305 IonicContact CZ-OE1 3.13Å; R253-E305 IonicContact CZ-OE2 3.21Å; R253-E305 VanDerWaalsContact NE-CD 3.29Å; R253-E305 IonicContact NE-OE1 2.71Å; R253-E305 PolarHBondContact NE-OE1 3.24Å; R253-E305 IonicContact NE-OE2 2.92Å; R253-E305 PolarHBondContact NE-OE2 2.99Å; R253-E305 VanDerWaalsContact NE-OE2 3.09Å; R253-E305 IonicContact NH2-OE1 3.59Å; R253-E305 PolarHBondContact NH2-OE1 3.2Å; R253-E305 VanDerWaalsContact NH2-OE1 3.14Å; R253-E305 IonicContact NH2-OE2 3.41Å; R253-E305 PolarHBondContact NH2-OE2 2.97Å; S254-E305 PolarHBondContact OG-OE2 2.71Å; W301-E305 PolarHBondContact NE1-OE1 3.25Å; W301-E305 WeakPolarHBondContact O-CG 3.45Å; W301-E305 PolarHBondContact O-N 3.07Å; L302-E305 PolarHBondContact O-N 3.25Å; E305-R307 PolarHBondContact O-N 3.31Å; E305-R308 WeakPolarHBondContact O-CB 3.21Å; E305-R308 PolarHBondContact O-N 2.8Å; E305-R308 IonicContact OE1-CZ 3.91Å; E305-R308 IonicContact OE1-NH1 3.76Å; E305-R308 PolarHBondContact OE1-NH1 3.12Å; E305-R308 IonicContact OE1-NH2 2.74Å; E305-R308 IonicContact OE2-NH1 3.65Å; E305-R308 PolarHBondContact OE2-NH1 3.11Å
306L93Very high91.1Very high0 Ų039.1 Ų39.10%018%0.179CC..Hα-helixtrans-69.1-33.9-175.3-65.4172.6000112.4V158 L161 R162 T165 L250 L302 L303 R308 M309V158-L306 HydrophobicContact CG2-CD2 4.28Å; L161-L306 HydrophobicContact CD2-CD1 4.03Å; L161-L306 HydrophobicContact CD2-CD2 3.59Å; L161-L306 HydrophobicContact CD2-CG 4.47Å; L161-L306 HydrophobicContact CG-CD1 3.73Å; L161-L306 HydrophobicContact CG-CD2 4.19Å; R162-L306 WeakPolarHBondContact CD-O 3.42Å; R162-L306 HydrophobicContact CG-CB 3.43Å; R162-L306 VanDerWaalsContact CG-CB 3.43Å; R162-L306 HydrophobicContact CG-CD1 4.22Å; R162-L306 HydrophobicContact CG-CG 4.42Å; T165-L306 HydrophobicContact CG2-CD1 4.34Å; T165-L306 VanDerWaalsContact OG1-CD1 3.26Å; T165-L306 WeakPolarHBondContact OG1-CD1 3.43Å; L250-L306 HydrophobicContact CD2-CD2 4.19Å; L302-L306 HydrophobicContact CD1-CD1 4.21Å; L302-L306 HydrophobicContact CD1-CG 4.22Å; L302-L306 HydrophobicContact CG-CD1 3.91Å; L302-L306 HydrophobicContact CG-CG 4.35Å; L302-L306 WeakPolarHBondContact O-CB 3.21Å; L302-L306 WeakPolarHBondContact O-CG 3.47Å; L302-L306 PolarHBondContact O-N 3.21Å; L303-L306 PolarHBondContact O-N 3.18Å; L306-R308 PolarHBondContact O-N 3.47Å; L306-M309 HydrophobicContact CD2-CE 4.06Å; L306-M309 HydrophobicContact CD2-SD 3.88Å; L306-M309 WeakPolarHBondContact O-CB 3.43Å; L306-M309 WeakPolarHBondContact O-CG 3.36Å; L306-M309 PolarHBondContact O-N 3.03Å
307R89.8Confident90.6Very high150 Ų15040.8 Ų40.857%0.56619%0.187SC*.Hα-helixtrans-58.9-28.9175.6176.8-178.7168-159.2-0.4112.4W140 L303 N304 E305 M309W140-R307 VanDerWaalsContact CZ2-NH1 3.26Å; L303-R307 WeakPolarHBondContact O-CB 3.5Å; L303-R307 PolarHBondContact O-N 3.05Å; N304-R307 PolarHBondContact O-N 3.47Å; E305-R307 PolarHBondContact O-N 3.31Å; R307-M309 PolarHBondContact O-N 2.96Å
308R85.5Confident90.1Very high12 Ų1241.6 Ų41.65%0.04519%0.188CC..THydrogen-bonded Turntrans-75.1-10.3178.8-59.4172.1-155.3154.4-1.6112.9L143 F147 V149 R253 N304 E305 L306L143-R308 PolarHBondContact O-NH2 2.92Å; L143-R308 VanDerWaalsContact O-NH2 3.09Å; F147-R308 WeakPolarHBondContact O-CD 3.42Å; F147-R308 PolarHBondContact O-NE 3.29Å; V149-R308 WeakPolarHBondContact CG1-O 3.45Å; V149-R308 HydrophobicContact CG2-CB 4.46Å; V149-R308 HydrophobicContact CG2-CG 4.27Å; R253-R308 VanDerWaalsContact NH2-NH1 3.14Å; N304-R308 WeakPolarHBondContact O-CG 3.33Å; N304-R308 PolarHBondContact O-NE 3.44Å; N304-R308 VanDerWaalsContact OD1-CZ 3.32Å; N304-R308 PolarHBondContact OD1-NE 3.44Å; N304-R308 PolarHBondContact OD1-NH2 2.84Å; E305-R308 WeakPolarHBondContact O-CB 3.21Å; E305-R308 PolarHBondContact O-N 2.8Å; E305-R308 IonicContact OE1-CZ 3.91Å; E305-R308 IonicContact OE1-NH1 3.76Å; E305-R308 PolarHBondContact OE1-NH1 3.12Å; E305-R308 IonicContact OE1-NH2 2.74Å; E305-R308 IonicContact OE2-NH1 3.65Å; E305-R308 PolarHBondContact OE2-NH1 3.11Å; L306-R308 PolarHBondContact O-N 3.47Å
309M85.8Confident89.5Confident2 Ų241.4 Ų41.41%0.0119%0.187CC..SBendtrans-89.9123.3179.2-47.5-172.7176.200108.9Y153 I155 V158 L250 L306 R307Y153-M309 HydrophobicContact CD2-CG 4.5Å; Y153-M309 HydrophobicContact CE2-CB 4.15Å; Y153-M309 HydrophobicContact CE2-CE 3.84Å; Y153-M309 HydrophobicContact CE2-CG 3.49Å; Y153-M309 VanDerWaalsContact CE2-CG 3.49Å; Y153-M309 HydrophobicContact CE2-SD 3.78Å; I155-M309 HydrophobicContact CD1-CE 4.49Å; I155-M309 HydrophobicContact CD1-SD 3.76Å; V158-M309 HydrophobicContact CG2-CB 3.94Å; V158-M309 HydrophobicContact CG2-CG 4.41Å; V158-M309 HydrophobicContact CG2-SD 3.85Å; L250-M309 HydrophobicContact CD2-CE 4.25Å; L250-M309 HydrophobicContact CD2-SD 4.31Å; L306-M309 HydrophobicContact CD2-CE 4.06Å; L306-M309 HydrophobicContact CD2-SD 3.88Å; L306-M309 WeakPolarHBondContact O-CB 3.43Å; L306-M309 WeakPolarHBondContact O-CG 3.36Å; L306-M309 PolarHBondContact O-N 3.03Å; R307-M309 PolarHBondContact O-N 2.96Å
310P78.2Confident88.8Confident30 Ų3044.5 Ų44.520%0.19520%0.201CC..PPolyproline II helixtrans-59.5144.217819-26.8000111.7L154L154-P310 HydrophobicContact CD2-CB 3.81Å; L154-P310 HydrophobicContact CD2-CG 3.61Å; L154-P310 HydrophobicContact CG-CG 4.36Å
311V76.9Confident88Confident71 Ų7147.8 Ų47.843%0.4322%0.215SC..PPolyproline II helixtrans-88.4126.9173-152.20000106.5K159 R162K159-V311 HydrophobicContact CB-CG1 3.82Å; K159-V311 HydrophobicContact CD-CG1 4.08Å; K159-V311 HydrophobicContact CG-CG1 4.12Å; R162-V311 VanDerWaalsContact NH2-CB 3.34Å
312K65.4Low87.1Confident211 Ų21146.4 Ų46.492%0.91721%0.213SC*.  trans-69.90157.1-72.5-168.6174.3-175.40109.3L154L154-K312 HydrophobicContact CB-CG 4.48Å; L154-K312 HydrophobicContact CD1-CG 4.37Å; L154-K312 HydrophobicContact CD2-CG 3.89Å; L154-K312 HydrophobicContact CG-CG 4.49Å

Retrieved 312 of 312 residues in 160.8 ms (Link to these results)

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