A0A3Q0KHM5_SCHMA Loading...

Putative seven transmembrane receptor

AlphaFold DB , UniProt , Accession A0A3Q0KHM5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 366 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
1M55.6Low67.3Low183 Ų18395.1 Ų95.190%0.90148%0.477SS*.  0-55.70-147.8-175-49.300112.7V3 Q4 N5M1-V3 PolarHBondContact O-N 2.98Å; M1-Q4 PolarHBondContact O-N 3.22Å; M1-N5 PolarHBondContact O-N 3.43Å; M1-N5 VanDerWaalsContact O-N 3.09Å
2I66.9Low68.4Low149 Ų14992 Ų9276%0.76447%0.467SS*.Hα-helixtrans-58-45.6-178.5-61.5171.4000112.7Q4 N5 Y6I2-Q4 VanDerWaalsContact C-N 3.35Å; I2-Q4 PolarHBondContact O-N 2.96Å; I2-N5 PolarHBondContact O-N 2.89Å; I2-Y6 PolarHBondContact O-N 3.49Å
3V58.5Low69.5Low116 Ų11691.3 Ų91.370%0.70346%0.461SS*.Hα-helixtrans-63-39.6179179.90000112M1 Y6 L7M1-V3 PolarHBondContact O-N 2.98Å; V3-Y6 PolarHBondContact O-N 3.22Å; V3-L7 WeakPolarHBondContact O-CB 3.22Å; V3-L7 PolarHBondContact O-N 3.37Å
4Q60Low70.6Confident55 Ų5590.6 Ų90.626%0.25745%0.454SS..Hα-helixtrans-64.5-46.2177.7-176.5-179-20.900111.1M1 I2 Y6 L7 Q8 C257M1-Q4 PolarHBondContact O-N 3.22Å; I2-Q4 VanDerWaalsContact C-N 3.35Å; I2-Q4 PolarHBondContact O-N 2.96Å; Q4-Y6 VanDerWaalsContact C-N 3.34Å; Q4-Y6 PolarHBondContact O-N 3.07Å; Q4-L7 PolarHBondContact O-N 3.46Å; Q4-Q8 VanDerWaalsContact O-CB 3.27Å; Q4-Q8 WeakPolarHBondContact O-CB 3.31Å; Q4-Q8 PolarHBondContact O-N 3.3Å; Q4-C257 HydrophobicContact CG-CB 4.48Å
5N70.3Confident71.6Confident87 Ų8786.1 Ų86.147%0.46544%0.436SS..Hα-helixtrans-62.6-41.3176.5-74.21.3000111.5M1 I2 N9M1-N5 PolarHBondContact O-N 3.43Å; M1-N5 VanDerWaalsContact O-N 3.09Å; I2-N5 PolarHBondContact O-N 2.89Å; N5-N9 VanDerWaalsContact O-CB 3.31Å; N5-N9 WeakPolarHBondContact O-CB 3.43Å; N5-N9 PolarHBondContact O-N 3.1Å; N5-N9 PolarHBondContact O-ND2 3.31Å; N5-N9 PolarHBondContact O-OD1 2.75Å
6Y64Low72.6Confident159 Ų15985.9 Ų85.962%0.62444%0.436SS*.Hα-helixtrans-64-48.1177.4-176.8-97.8000112.1I2 V3 Q4 Q8 N9 V10I2-Y6 PolarHBondContact O-N 3.49Å; V3-Y6 PolarHBondContact O-N 3.22Å; Q4-Y6 VanDerWaalsContact C-N 3.34Å; Q4-Y6 PolarHBondContact O-N 3.07Å; Y6-Q8 PolarHBondContact O-N 3.02Å; Y6-N9 PolarHBondContact O-N 3.39Å; Y6-V10 HydrophobicContact CD1-CG2 4.18Å; Y6-V10 HydrophobicContact CE1-CG2 3.76Å; Y6-V10 HydrophobicContact CE2-CG2 4.3Å; Y6-V10 WeakPolarHBondContact O-CG2 3.1Å; Y6-V10 PolarHBondContact O-N 3.08Å
7L63.6Low73.5Confident76 Ų7685.5 Ų85.540%0.39843%0.431SS..Hα-helixtrans-64.1-42.4-179.5-173.662000111.7V3 Q4 N9 V10 L11 V253V3-L7 WeakPolarHBondContact O-CB 3.22Å; V3-L7 PolarHBondContact O-N 3.37Å; Q4-L7 PolarHBondContact O-N 3.46Å; L7-N9 VanDerWaalsContact C-N 3.34Å; L7-N9 PolarHBondContact O-N 3.28Å; L7-V10 PolarHBondContact O-N 3.01Å; L7-L11 WeakPolarHBondContact O-CB 3.41Å; L7-L11 PolarHBondContact O-N 2.71Å; L7-V253 HydrophobicContact CD2-CB 4.48Å; L7-V253 HydrophobicContact CD2-CG1 3.73Å; L7-V253 HydrophobicContact CD2-CG2 3.85Å; L7-V253 HydrophobicContact CG-CG1 4.44Å
8Q72.5Confident74.4Confident80 Ų8082 Ų8237%0.37441%0.413SS..Hα-helixtrans-62.8-40.7175.4-174.6173.1-20.200111.5Q4 Y6 L11 T12Q4-Q8 VanDerWaalsContact O-CB 3.27Å; Q4-Q8 WeakPolarHBondContact O-CB 3.31Å; Q4-Q8 PolarHBondContact O-N 3.3Å; Y6-Q8 PolarHBondContact O-N 3.02Å; Q8-L11 PolarHBondContact O-N 3.49Å; Q8-T12 VanDerWaalsContact O-CB 3.29Å; Q8-T12 WeakPolarHBondContact O-CB 3.37Å; Q8-T12 PolarHBondContact O-N 3.32Å; Q8-T12 PolarHBondContact O-OG1 2.81Å
9N76.6Confident75.2Confident106 Ų10684.5 Ų84.557%0.56742%0.421SS*.Hα-helixtrans-63.3-47176-72.4-12.4000112.1N5 Y6 L7 L11 T12 Q13N5-N9 VanDerWaalsContact O-CB 3.31Å; N5-N9 WeakPolarHBondContact O-CB 3.43Å; N5-N9 PolarHBondContact O-N 3.1Å; N5-N9 PolarHBondContact O-ND2 3.31Å; N5-N9 PolarHBondContact O-OD1 2.75Å; Y6-N9 PolarHBondContact O-N 3.39Å; L7-N9 VanDerWaalsContact C-N 3.34Å; L7-N9 PolarHBondContact O-N 3.28Å; N9-L11 VanDerWaalsContact C-N 3.29Å; N9-L11 PolarHBondContact O-N 2.95Å; N9-T12 PolarHBondContact O-N 3.12Å; N9-Q13 WeakPolarHBondContact O-CB 3.16Å; N9-Q13 PolarHBondContact O-N 3.12Å
10V74.9Confident76Confident17 Ų1780.8 Ų80.810%0.10340%0.404CS..Hα-helixtrans-61.7-40.6178.1171.90000111Y6 L7 Q13 K14 Y129Y6-V10 HydrophobicContact CD1-CG2 4.18Å; Y6-V10 HydrophobicContact CE1-CG2 3.76Å; Y6-V10 HydrophobicContact CE2-CG2 4.3Å; Y6-V10 WeakPolarHBondContact O-CG2 3.1Å; Y6-V10 PolarHBondContact O-N 3.08Å; L7-V10 PolarHBondContact O-N 3.01Å; V10-Q13 WeakPolarHBondContact O-CB 3.41Å; V10-Q13 PolarHBondContact O-N 2.77Å; V10-K14 WeakPolarHBondContact O-CG 3.34Å; V10-K14 PolarHBondContact O-N 3.35Å; V10-Y129 WeakPolarHBondContact CG1-OH 3.49Å
11L77.8Confident76.7Confident18 Ų1879.1 Ų79.19%0.09440%0.396CS..Hα-helixtrans-71.3-38.1-179.3-166.855.6000112.4L7 Q8 N9 Q13 K14 A15 T246 N250L7-L11 WeakPolarHBondContact O-CB 3.41Å; L7-L11 PolarHBondContact O-N 2.71Å; Q8-L11 PolarHBondContact O-N 3.49Å; N9-L11 VanDerWaalsContact C-N 3.29Å; N9-L11 PolarHBondContact O-N 2.95Å; L11-Q13 VanDerWaalsContact C-N 3.32Å; L11-K14 PolarHBondContact O-N 3.41Å; L11-A15 PolarHBondContact O-N 2.98Å; L11-T246 HydrophobicContact CD1-CG2 3.42Å; L11-T246 VanDerWaalsContact CD1-CG2 3.42Å; L11-T246 HydrophobicContact CG-CG2 4.08Å; L11-N250 HydrophobicContact CD2-CB 3.26Å; L11-N250 VanDerWaalsContact CD2-N 3.33Å; L11-N250 HydrophobicContact CG-CB 3.98Å
12T80.5Confident78.4Confident58 Ų5871.6 Ų71.636%0.35636%0.362SS..Hα-helixtrans-63.6-41172.7-54.80000110.3Q8 N9 K14 A15 L16Q8-T12 VanDerWaalsContact O-CB 3.29Å; Q8-T12 WeakPolarHBondContact O-CB 3.37Å; Q8-T12 PolarHBondContact O-N 3.32Å; Q8-T12 PolarHBondContact O-OG1 2.81Å; N9-T12 PolarHBondContact O-N 3.12Å; T12-K14 PolarHBondContact O-N 2.95Å; T12-A15 PolarHBondContact O-N 2.92Å; T12-L16 HydrophobicContact CG2-CD1 4.28Å; T12-L16 WeakPolarHBondContact O-CB 3.5Å; T12-L16 VanDerWaalsContact O-CG 3.31Å; T12-L16 WeakPolarHBondContact O-CG 3.46Å; T12-L16 PolarHBondContact O-N 3.08Å
13Q83Confident79.6Confident83 Ų8365.7 Ų65.739%0.38834%0.335SS..Hα-helixtrans-60.4-44.8174.9-170.6-178.2-11.700111.6N9 V10 L11 L16 F17 W50N9-Q13 WeakPolarHBondContact O-CB 3.16Å; N9-Q13 PolarHBondContact O-N 3.12Å; V10-Q13 WeakPolarHBondContact O-CB 3.41Å; V10-Q13 PolarHBondContact O-N 2.77Å; L11-Q13 VanDerWaalsContact C-N 3.32Å; Q13-L16 PolarHBondContact O-N 3.29Å; Q13-F17 WeakPolarHBondContact O-CB 3.42Å; Q13-F17 PolarHBondContact O-N 3.16Å; Q13-W50 HydrophobicContact CB-CH2 4.43Å; Q13-W50 HydrophobicContact CG-CH2 3.43Å; Q13-W50 VanDerWaalsContact CG-CH2 3.43Å; Q13-W50 HydrophobicContact CG-CZ2 3.94Å; Q13-W50 WeakPolarHBondContact O-CH2 3.36Å
14K84.4Confident81.2Confident82 Ų8260.5 Ų60.536%0.35730%0.304SS..Hα-helixtrans-62.2-44.3175.3-70.5176.6-172.41720112.2V10 L11 T12 L16 F17 L18 Y129 T246V10-K14 WeakPolarHBondContact O-CG 3.34Å; V10-K14 PolarHBondContact O-N 3.35Å; L11-K14 PolarHBondContact O-N 3.41Å; T12-K14 PolarHBondContact O-N 2.95Å; K14-L16 PolarHBondContact O-N 3.27Å; K14-F17 PolarHBondContact O-N 2.9Å; K14-L18 WeakPolarHBondContact O-CB 3.25Å; K14-L18 WeakPolarHBondContact O-CG 3.36Å; K14-L18 PolarHBondContact O-N 3.35Å; K14-Y129 VanDerWaalsContact CE-CE1 3.47Å; K14-Y129 VanDerWaalsContact NZ-CE1 3.29Å; K14-Y129 PolarHBondContact NZ-OH 3.45Å; K14-T246 HydrophobicContact CB-CG2 4.34Å
15A85.7Confident82.8Confident23 Ų2359.2 Ų59.219%0.1930%0.298CS..Hα-helixtrans-62.4-42.6178.300000112L11 T12 L18 F19 T246L11-A15 PolarHBondContact O-N 2.98Å; T12-A15 PolarHBondContact O-N 2.92Å; A15-L18 PolarHBondContact O-N 3.31Å; A15-F19 WeakPolarHBondContact O-CB 3.23Å; A15-F19 PolarHBondContact O-N 3.07Å; A15-T246 HydrophobicContact CB-CG2 3.96Å
16L87.1Confident83.9Confident82 Ų8259.1 Ų59.143%0.42930%0.297SS..Hα-helixtrans-64.3-40.6175.9-71.6174.3000112.1T12 Q13 K14 F19 A20 W50 L53T12-L16 HydrophobicContact CG2-CD1 4.28Å; T12-L16 WeakPolarHBondContact O-CB 3.5Å; T12-L16 VanDerWaalsContact O-CG 3.31Å; T12-L16 WeakPolarHBondContact O-CG 3.46Å; T12-L16 PolarHBondContact O-N 3.08Å; Q13-L16 PolarHBondContact O-N 3.29Å; K14-L16 PolarHBondContact O-N 3.27Å; L16-F19 PolarHBondContact O-N 3.07Å; L16-A20 WeakPolarHBondContact O-CB 3.07Å; L16-A20 PolarHBondContact O-N 3.01Å; L16-W50 HydrophobicContact CB-CE3 4.39Å; L16-W50 HydrophobicContact CB-CH2 4.35Å; L16-W50 HydrophobicContact CB-CZ3 3.6Å; L16-L53 HydrophobicContact CD1-CD2 4.42Å
17F87.9Confident85.2Confident80 Ų8053 Ų5335%0.35128%0.275SS..Hα-helixtrans-63.1-45.1174.7177.2-102.8000111.9Q13 K14 F19 A20 L21 F47 W50Q13-F17 WeakPolarHBondContact O-CB 3.42Å; Q13-F17 PolarHBondContact O-N 3.16Å; K14-F17 PolarHBondContact O-N 2.9Å; F17-F19 VanDerWaalsContact C-N 3.32Å; F17-F19 PolarHBondContact O-N 3.45Å; F17-A20 PolarHBondContact O-N 3.38Å; F17-L21 HydrophobicContact CE1-CD1 4.13Å; F17-L21 HydrophobicContact CZ-CD1 4.33Å; F17-L21 WeakPolarHBondContact O-CB 3.13Å; F17-L21 PolarHBondContact O-N 2.94Å; F17-F47 HydrophobicContact CE2-CE1 4.05Å; F17-F47 HydrophobicContact CZ-CE1 4.47Å; F17-W50 HydrophobicContact CB-CH2 3.94Å; F17-W50 HydrophobicContact CB-CZ2 3.83Å; F17-W50 HydrophobicContact CB-CZ3 4.44Å; F17-W50 HydrophobicContact CD2-CD2 4.3Å; F17-W50 AromaticContact CD2-CE2 3.8Å; F17-W50 HydrophobicContact CD2-CG 4.43Å; F17-W50 HydrophobicContact CD2-CZ2 4.17Å; F17-W50 AromaticContact CD2-NE1 3.66Å; F17-W50 HydrophobicContact CG-CZ2 4.42Å
18L89.9Confident86.5Confident22 Ų2251 Ų5112%0.11527%0.267CS..Hα-helixtrans-63.4-38176.4-73173.3000111.9K14 A15 L21 S22 L242 M243K14-L18 WeakPolarHBondContact O-CB 3.25Å; K14-L18 WeakPolarHBondContact O-CG 3.36Å; K14-L18 PolarHBondContact O-N 3.35Å; A15-L18 PolarHBondContact O-N 3.31Å; L18-L21 PolarHBondContact O-N 3.32Å; L18-S22 WeakPolarHBondContact O-CB 3.38Å; L18-S22 PolarHBondContact O-N 3.09Å; L18-L242 HydrophobicContact CD1-CB 4.06Å; L18-L242 HydrophobicContact CD2-CB 4.27Å; L18-L242 HydrophobicContact CD2-CD1 4.31Å; L18-M243 HydrophobicContact CB-CG 4.08Å; L18-M243 HydrophobicContact CB-SD 3.31Å; L18-M243 WeakPolarHBondContact CB-SD 3.43Å; L18-M243 HydrophobicContact CD1-CG 4.37Å; L18-M243 HydrophobicContact CD1-SD 3.91Å; L18-M243 HydrophobicContact CG-SD 4.27Å
19F89.7Confident87.5Confident130 Ų13048.5 Ų48.557%0.5726%0.256SS*.Hα-helixtrans-63.3-48.4173.3-177.5-98000111.5A15 L16 F17 L21 S22 A23A15-F19 WeakPolarHBondContact O-CB 3.23Å; A15-F19 PolarHBondContact O-N 3.07Å; L16-F19 PolarHBondContact O-N 3.07Å; F17-F19 VanDerWaalsContact C-N 3.32Å; F17-F19 PolarHBondContact O-N 3.45Å; F19-L21 VanDerWaalsContact C-N 3.3Å; F19-L21 PolarHBondContact O-N 3.31Å; F19-S22 PolarHBondContact O-N 3.22Å; F19-S22 VanDerWaalsContact O-N 3.16Å; F19-S22 PolarHBondContact O-OG 3.49Å; F19-A23 PolarHBondContact O-N 2.91Å
20A90.8Very high88.2Confident10 Ų1046.1 Ų46.18%0.08324%0.243CC..Hα-helixtrans-58.9-42.8175.500000111.4L16 F17 A23 N24 P46 W50L16-A20 WeakPolarHBondContact O-CB 3.07Å; L16-A20 PolarHBondContact O-N 3.01Å; F17-A20 PolarHBondContact O-N 3.38Å; A20-A23 PolarHBondContact O-N 2.88Å; A20-N24 PolarHBondContact O-N 3.12Å; A20-N24 PolarHBondContact O-ND2 3.45Å; A20-P46 HydrophobicContact CB-CB 4.39Å; A20-W50 HydrophobicContact CB-CB 4.42Å
21L91.2Very high89Confident45 Ų4548.3 Ų48.324%0.23625%0.249CC..Hα-helixtrans-61.1-45.3175.4-176.4147.9000111.3F17 L18 F19 A23 N24 L25 F47 V239F17-L21 HydrophobicContact CE1-CD1 4.13Å; F17-L21 HydrophobicContact CZ-CD1 4.33Å; F17-L21 WeakPolarHBondContact O-CB 3.13Å; F17-L21 PolarHBondContact O-N 2.94Å; L18-L21 PolarHBondContact O-N 3.32Å; F19-L21 VanDerWaalsContact C-N 3.3Å; F19-L21 PolarHBondContact O-N 3.31Å; L21-A23 PolarHBondContact O-N 2.99Å; L21-N24 PolarHBondContact O-N 3.01Å; L21-L25 HydrophobicContact CD2-CD1 3.57Å; L21-L25 HydrophobicContact CD2-CG 4.15Å; L21-L25 WeakPolarHBondContact O-CG 3.4Å; L21-L25 PolarHBondContact O-N 3.44Å; L21-F47 HydrophobicContact CB-CZ 4.39Å; L21-F47 HydrophobicContact CG-CZ 4.46Å; L21-V239 HydrophobicContact CD2-CG1 4.25Å; L21-V239 HydrophobicContact CD2-CG2 3.54Å
22S91.9Very high89.5Confident25 Ų2550.4 Ų50.418%0.17526%0.26CS..Hα-helixtrans-61-43177.274.90000112.3L18 F19 N24 L25 I26L18-S22 WeakPolarHBondContact O-CB 3.38Å; L18-S22 PolarHBondContact O-N 3.09Å; F19-S22 PolarHBondContact O-N 3.22Å; F19-S22 VanDerWaalsContact O-N 3.16Å; F19-S22 PolarHBondContact O-OG 3.49Å; S22-N24 PolarHBondContact O-N 3.27Å; S22-L25 PolarHBondContact O-N 3.1Å; S22-I26 WeakPolarHBondContact O-CG1 3.48Å; S22-I26 PolarHBondContact O-N 3.28Å
23A92.6Very high89.9Confident25 Ų2549.5 Ų49.521%0.20725%0.253CS..Hα-helixtrans-63.8-42.4177.200000111.8F19 A20 L21 L25 I26 L27 P46F19-A23 PolarHBondContact O-N 2.91Å; A20-A23 PolarHBondContact O-N 2.88Å; L21-A23 PolarHBondContact O-N 2.99Å; A23-L25 PolarHBondContact O-N 3.05Å; A23-I26 PolarHBondContact O-N 3.35Å; A23-L27 WeakPolarHBondContact O-CG 3.39Å; A23-L27 PolarHBondContact O-N 2.94Å; A23-P46 HydrophobicContact CB-CB 4.02Å; A23-P46 HydrophobicContact CB-CG 3.81Å
24N92Very high90.1Very high8 Ų851 Ų514%0.04326%0.264CS..Hα-helixtrans-63.3-39.9174.8-78.6-76.6000112.1A20 L21 S22 L27 C28 L43 F44 P46 F47A20-N24 PolarHBondContact O-N 3.12Å; A20-N24 PolarHBondContact O-ND2 3.45Å; L21-N24 PolarHBondContact O-N 3.01Å; S22-N24 PolarHBondContact O-N 3.27Å; N24-L27 PolarHBondContact O-N 3.02Å; N24-C28 VanDerWaalsContact O-CB 3.26Å; N24-C28 WeakPolarHBondContact O-CB 3.37Å; N24-C28 PolarHBondContact O-N 3.25Å; N24-L43 PolarHBondContact OD1-O 3.17Å; N24-L43 VanDerWaalsContact OD1-O 3.12Å; N24-F44 WeakPolarHBondContact OD1-CA 3.46Å; N24-P46 WeakPolarHBondContact ND2-CB 3.4Å; N24-P46 WeakPolarHBondContact OD1-CD 3.42Å; N24-F47 HydrophobicContact CB-CD2 3.9Å; N24-F47 HydrophobicContact CB-CE2 3.57Å; N24-F47 HydrophobicContact CB-CZ 4.31Å; N24-F47 WeakPolarHBondContact ND2-CD2 3.47Å; N24-F47 VanDerWaalsContact ND2-CE2 3.3Å; N24-F47 WeakPolarHBondContact ND2-CE2 3.46Å; N24-F47 WeakPolarHBondContact ND2-CG 3.26Å; N24-F47 PolarHBondContact ND2-N 3.36Å; N24-F47 VanDerWaalsContact ND2-N 3.19Å; N24-F47 WeakPolarHBondContact OD1-CD2 3.49Å
25L92.5Very high90.3Very high27 Ų2754.9 Ų54.914%0.14128%0.277CS..Hα-helixtrans-63.1-42176.8-72.7177.6000111.8L21 S22 A23 C28 L29 F232 L235 F236 V239L21-L25 HydrophobicContact CD2-CD1 3.57Å; L21-L25 HydrophobicContact CD2-CG 4.15Å; L21-L25 WeakPolarHBondContact O-CG 3.4Å; L21-L25 PolarHBondContact O-N 3.44Å; S22-L25 PolarHBondContact O-N 3.1Å; A23-L25 PolarHBondContact O-N 3.05Å; L25-C28 PolarHBondContact O-N 3.45Å; L25-L29 WeakPolarHBondContact O-CB 3.49Å; L25-L29 PolarHBondContact O-N 3.49Å; L25-F232 HydrophobicContact CD2-CE1 4.36Å; L25-L235 HydrophobicContact CD1-CD2 3.63Å; L25-L235 HydrophobicContact CD1-CG 3.91Å; L25-L235 HydrophobicContact CD2-CD2 3.55Å; L25-L235 HydrophobicContact CG-CD2 4.24Å; L25-F236 HydrophobicContact CB-CE1 3.95Å; L25-F236 HydrophobicContact CB-CZ 4.04Å; L25-V239 HydrophobicContact CD1-CG2 3.99Å
26I92.6Very high90.5Very high85 Ų8556.7 Ų56.744%0.43628%0.283SS..Hα-helixtrans-61.8-48.1175.8-65.5167.7000110.3S22 A23 C28 L29 L30 F236S22-I26 WeakPolarHBondContact O-CG1 3.48Å; S22-I26 PolarHBondContact O-N 3.28Å; A23-I26 PolarHBondContact O-N 3.35Å; I26-C28 VanDerWaalsContact C-N 3.31Å; I26-C28 PolarHBondContact O-N 3.17Å; I26-L29 PolarHBondContact O-N 3.44Å; I26-L30 HydrophobicContact CG2-CD1 3.85Å; I26-L30 HydrophobicContact CG2-CG 4.4Å; I26-L30 WeakPolarHBondContact O-CB 3.29Å; I26-L30 VanDerWaalsContact O-CG 3.3Å; I26-L30 WeakPolarHBondContact O-CG 3.5Å; I26-L30 PolarHBondContact O-N 2.93Å; I26-F236 HydrophobicContact CG1-CE1 3.71Å; I26-F236 HydrophobicContact CG1-CZ 4.06Å
27L92.8Very high90.5Very high32 Ų3260.4 Ų60.417%0.16830%0.298CS..Hα-helixtrans-61-40.3177.2-71.3173.3000112.2A23 N24 L30 R31 F42 P46A23-L27 WeakPolarHBondContact O-CG 3.39Å; A23-L27 PolarHBondContact O-N 2.94Å; N24-L27 PolarHBondContact O-N 3.02Å; L27-L30 PolarHBondContact O-N 3.16Å; L27-R31 WeakPolarHBondContact O-CB 3.25Å; L27-R31 PolarHBondContact O-N 2.99Å; L27-F42 HydrophobicContact CD2-CE1 4.2Å; L27-P46 HydrophobicContact CD1-CG 3.84Å
28C91Very high90.5Very high34 Ų3458.3 Ų58.323%0.2329%0.291CS..Hα-helixtrans-63.5-46.2177.2-172.10000111.5N24 L25 I26 R31 I32 L43N24-C28 VanDerWaalsContact O-CB 3.26Å; N24-C28 WeakPolarHBondContact O-CB 3.37Å; N24-C28 PolarHBondContact O-N 3.25Å; L25-C28 PolarHBondContact O-N 3.45Å; I26-C28 VanDerWaalsContact C-N 3.31Å; I26-C28 PolarHBondContact O-N 3.17Å; C28-R31 PolarHBondContact O-N 3.32Å; C28-I32 WeakPolarHBondContact O-CB 3.49Å; C28-I32 VanDerWaalsContact O-CG1 3.27Å; C28-I32 WeakPolarHBondContact O-CG1 3.28Å; C28-I32 PolarHBondContact O-N 3.48Å; C28-L43 HydrophobicContact CB-CD1 4.46Å
29L92.2Very high90.5Very high26 Ų2661.9 Ų61.914%0.13631%0.311CS..Hα-helixtrans-63.9-43.2177.9-173.667.4000111.9L25 I26 R31 I32 N33 N229 F232 F236L25-L29 WeakPolarHBondContact O-CB 3.49Å; L25-L29 PolarHBondContact O-N 3.49Å; I26-L29 PolarHBondContact O-N 3.44Å; L29-R31 VanDerWaalsContact C-N 3.29Å; L29-R31 PolarHBondContact O-N 2.97Å; L29-I32 PolarHBondContact O-N 2.9Å; L29-N33 WeakPolarHBondContact O-CB 3.31Å; L29-N33 PolarHBondContact O-N 2.88Å; L29-N33 PolarHBondContact O-ND2 3.09Å; L29-N229 WeakPolarHBondContact CD1-OD1 3.46Å; L29-N229 WeakPolarHBondContact CD2-OD1 3.4Å; L29-F232 HydrophobicContact CD1-CB 4.19Å; L29-F232 HydrophobicContact CD1-CD2 4.08Å; L29-F232 HydrophobicContact CD1-CG 4.14Å; L29-F236 HydrophobicContact CD2-CE2 3.9Å; L29-F236 HydrophobicContact CD2-CZ 4.36Å
30L92.1Very high90.5Very high56 Ų5655.7 Ų55.729%0.29328%0.284SS..Hα-helixtrans-61.5-38.6177-72.4169.9000112I26 L27 Y35 I36I26-L30 HydrophobicContact CG2-CD1 3.85Å; I26-L30 HydrophobicContact CG2-CG 4.4Å; I26-L30 WeakPolarHBondContact O-CB 3.29Å; I26-L30 VanDerWaalsContact O-CG 3.3Å; I26-L30 WeakPolarHBondContact O-CG 3.5Å; I26-L30 PolarHBondContact O-N 2.93Å; L27-L30 PolarHBondContact O-N 3.16Å; L30-Y35 HydrophobicContact CD2-CD2 3.94Å; L30-Y35 HydrophobicContact CD2-CG 4.32Å; L30-Y35 WeakPolarHBondContact O-CB 3.29Å; L30-Y35 PolarHBondContact O-N 3.4Å; L30-I36 HydrophobicContact CB-CD1 3.94Å; L30-I36 HydrophobicContact CB-CG1 4.2Å; L30-I36 HydrophobicContact CD1-CD1 3.78Å; L30-I36 HydrophobicContact CG-CD1 4.36Å; L30-I36 PolarHBondContact O-N 3.3Å
31R90.5Very high90.5Very high64 Ų6461 Ų6124%0.24230%0.301CS..Hα-helixtrans-70-43.5175-173.7-178.2179.8178.61.1112.3L27 C28 L29 N33 D34 L43L27-R31 WeakPolarHBondContact O-CB 3.25Å; L27-R31 PolarHBondContact O-N 2.99Å; C28-R31 PolarHBondContact O-N 3.32Å; L29-R31 VanDerWaalsContact C-N 3.29Å; L29-R31 PolarHBondContact O-N 2.97Å; R31-N33 PolarHBondContact O-N 3.45Å; R31-D34 PolarHBondContact O-N 3.22Å; R31-D34 VanDerWaalsContact O-N 3.09Å; R31-L43 HydrophobicContact CB-CD1 3.87Å; R31-L43 HydrophobicContact CG-CD1 4.19Å
32I88.7Confident90.5Very high61 Ų6164 Ų6431%0.31331%0.313SS..Hα-helixtrans-63.5-33.5-179.3-72.3168.8000111.5C28 L29 D34 Y228 F232C28-I32 WeakPolarHBondContact O-CB 3.49Å; C28-I32 VanDerWaalsContact O-CG1 3.27Å; C28-I32 WeakPolarHBondContact O-CG1 3.28Å; C28-I32 PolarHBondContact O-N 3.48Å; L29-I32 PolarHBondContact O-N 2.9Å; I32-D34 PolarHBondContact O-N 3.36Å; I32-Y228 HydrophobicContact CG2-CD1 3.99Å; I32-Y228 HydrophobicContact CG2-CD2 3.31Å; I32-Y228 HydrophobicContact CG2-CE1 4.32Å; I32-Y228 HydrophobicContact CG2-CE2 3.67Å; I32-Y228 HydrophobicContact CG2-CG 3.48Å; I32-Y228 VanDerWaalsContact CG2-CG 3.48Å; I32-F232 HydrophobicContact CD1-CE2 4.29Å; I32-F232 HydrophobicContact CD1-CZ 4.12Å
33N89.5Confident90.4Very high40 Ų4063.3 Ų63.321%0.21431%0.307CS..THydrogen-bonded Turntrans-85.811.4176.5-67.1-35.3000113.7L29 R31 Y35 N229L29-N33 WeakPolarHBondContact O-CB 3.31Å; L29-N33 PolarHBondContact O-N 2.88Å; L29-N33 PolarHBondContact O-ND2 3.09Å; R31-N33 PolarHBondContact O-N 3.45Å; N33-Y35 HydrophobicContact CB-CD2 3.45Å; N33-Y35 VanDerWaalsContact CB-CD2 3.45Å; N33-Y35 HydrophobicContact CB-CE2 3.49Å; N33-Y35 VanDerWaalsContact CB-CE2 3.49Å; N33-Y35 HydrophobicContact CB-CG 4.43Å; N33-Y35 PolarHBondContact O-N 3.42Å; N33-N229 PolarHBondContact ND2-OD1 3.45Å
34D86.3Confident90.3Very high114 Ų11463.4 Ų63.461%0.6130%0.303SS*.THydrogen-bonded Turntrans56.519.4-178.7-62.7-50.7000114.8R31 I32 I36 H37R31-D34 PolarHBondContact O-N 3.22Å; R31-D34 VanDerWaalsContact O-N 3.09Å; I32-D34 PolarHBondContact O-N 3.36Å; D34-I36 VanDerWaalsContact C-N 3.27Å; D34-I36 PolarHBondContact O-N 3.07Å; D34-H37 IonicContact OD1-CE1 2.79Å
35Y89.6Confident90.2Very high163 Ų16367.3 Ų67.364%0.63932%0.322SS*.SBendtrans-70-30.1173.4-70.5-62.1000111.7L30 N33L30-Y35 HydrophobicContact CD2-CD2 3.94Å; L30-Y35 HydrophobicContact CD2-CG 4.32Å; L30-Y35 WeakPolarHBondContact O-CB 3.29Å; L30-Y35 PolarHBondContact O-N 3.4Å; N33-Y35 HydrophobicContact CB-CD2 3.45Å; N33-Y35 VanDerWaalsContact CB-CD2 3.45Å; N33-Y35 HydrophobicContact CB-CE2 3.49Å; N33-Y35 VanDerWaalsContact CB-CE2 3.49Å; N33-Y35 HydrophobicContact CB-CG 4.43Å; N33-Y35 PolarHBondContact O-N 3.42Å
36I90Very high90.2Very high62 Ų6267 Ų6732%0.31832%0.321SS..  trans-137.5119.2-176.5-53.4-179.1000109.9L30 D34 V38L30-I36 HydrophobicContact CB-CD1 3.94Å; L30-I36 HydrophobicContact CB-CG1 4.2Å; L30-I36 HydrophobicContact CD1-CD1 3.78Å; L30-I36 HydrophobicContact CG-CD1 4.36Å; L30-I36 PolarHBondContact O-N 3.3Å; D34-I36 VanDerWaalsContact C-N 3.27Å; D34-I36 PolarHBondContact O-N 3.07Å; I36-V38 VanDerWaalsContact C-N 3.35Å; I36-V38 HydrophobicContact CB-CG2 4.5Å; I36-V38 HydrophobicContact CG2-CB 3.94Å; I36-V38 HydrophobicContact CG2-CG1 3.3Å; I36-V38 HydrophobicContact CG2-CG2 3.7Å; I36-V38 PolarHBondContact O-N 3.06Å
37H86.7Confident90Very high159 Ų15964.8 Ų64.874%0.73631%0.309SS*.  trans-92.462172.3-58.8-64.2000111.4D34D34-H37 IonicContact OD1-CE1 2.79Å
38V88.3Confident89.8Confident36 Ų3665.9 Ų65.922%0.21831%0.311CS..  trans-88.8146.4176.8-800000111.9I36 F42I36-V38 VanDerWaalsContact C-N 3.35Å; I36-V38 HydrophobicContact CB-CG2 4.5Å; I36-V38 HydrophobicContact CG2-CB 3.94Å; I36-V38 HydrophobicContact CG2-CG1 3.3Å; I36-V38 HydrophobicContact CG2-CG2 3.7Å; I36-V38 PolarHBondContact O-N 3.06Å; V38-F42 HydrophobicContact CB-CB 4.22Å; V38-F42 HydrophobicContact CB-CD1 3.93Å; V38-F42 HydrophobicContact CB-CG 4.44Å; V38-F42 HydrophobicContact CG1-CD1 3.72Å; V38-F42 HydrophobicContact CG1-CE1 4.25Å; V38-F42 HydrophobicContact CG1-CG 4.35Å; V38-F42 HydrophobicContact CG2-CD1 4.09Å
39N90.3Very high89.6Confident97 Ų9769.1 Ų69.152%0.51933%0.326SS..  trans-56.1151.3173.6-63.28.6000111W41 F42 L43N39-W41 PolarHBondContact O-N 3Å; N39-W41 VanDerWaalsContact O-N 3.11Å; N39-F42 PolarHBondContact O-N 2.98Å; N39-L43 PolarHBondContact O-N 3.39Å
40A88.3Confident89.5Confident0 Ų069.1 Ų69.10%032%0.324CS..Hα-helixtrans-56.9-33.2-17900000113.4F42 L43 F44 C91 L94 E95A40-F42 VanDerWaalsContact C-N 3.32Å; A40-F42 PolarHBondContact O-N 2.87Å; A40-L43 PolarHBondContact O-N 3.41Å; A40-F44 VanDerWaalsContact O-CD2 3.25Å; A40-F44 WeakPolarHBondContact O-CD2 3.33Å; A40-F44 PolarHBondContact O-N 3.28Å; A40-C91 HydrophobicContact CB-CB 4.43Å; A40-L94 HydrophobicContact CB-CB 3.76Å; A40-L94 HydrophobicContact CB-CD1 4.31Å; A40-E95 PolarHBondContact N-OE2 3.3Å
41W91.7Very high89.2Confident121 Ų12166.6 Ų66.646%0.45831%0.31SS..Hα-helixtrans-58.7-40.1176.4-61.291.2000113.5N39 W48 C91N39-W41 PolarHBondContact O-N 3Å; N39-W41 VanDerWaalsContact O-N 3.11Å; W41-W48 AromaticContact CE3-CZ2 3.85Å; W41-W48 HydrophobicContact CE3-CZ2 3.85Å; W41-W48 AromaticContact CZ3-CH2 3.97Å; W41-W48 HydrophobicContact CZ3-CH2 3.97Å; W41-W48 AromaticContact CZ3-CZ2 3.64Å; W41-W48 HydrophobicContact CZ3-CZ2 3.64Å; W41-C91 HydrophobicContact CD2-CB 4.15Å; W41-C91 HydrophobicContact CE3-CB 4.39Å; W41-C91 HydrophobicContact CZ2-CB 4.27Å
42F90.6Very high89Confident109 Ų10968.8 Ų68.848%0.47833%0.326SS..Hα-helixtrans-74.8-32.8-179.7-172.6-96.1000111.7L27 V38 N39 A40 F44 M45L27-F42 HydrophobicContact CD2-CE1 4.2Å; V38-F42 HydrophobicContact CB-CB 4.22Å; V38-F42 HydrophobicContact CB-CD1 3.93Å; V38-F42 HydrophobicContact CB-CG 4.44Å; V38-F42 HydrophobicContact CG1-CD1 3.72Å; V38-F42 HydrophobicContact CG1-CE1 4.25Å; V38-F42 HydrophobicContact CG1-CG 4.35Å; V38-F42 HydrophobicContact CG2-CD1 4.09Å; N39-F42 PolarHBondContact O-N 2.98Å; A40-F42 VanDerWaalsContact C-N 3.32Å; A40-F42 PolarHBondContact O-N 2.87Å; F42-F44 VanDerWaalsContact C-N 3.25Å; F42-F44 PolarHBondContact O-N 2.93Å; F42-M45 WeakPolarHBondContact O-CB 3.3Å; F42-M45 PolarHBondContact O-N 3.43Å
43L89.9Confident88.9Confident11 Ų1170.7 Ų70.76%0.05834%0.336CS..Hα-helixtrans-59.5-37177.7-178.5144.8000112.4N24 C28 R31 N39 A40 M45N24-L43 PolarHBondContact OD1-O 3.17Å; N24-L43 VanDerWaalsContact OD1-O 3.12Å; C28-L43 HydrophobicContact CB-CD1 4.46Å; R31-L43 HydrophobicContact CB-CD1 3.87Å; R31-L43 HydrophobicContact CG-CD1 4.19Å; N39-L43 PolarHBondContact O-N 3.39Å; A40-L43 PolarHBondContact O-N 3.41Å; L43-M45 VanDerWaalsContact C-N 3.35Å
44F91.2Very high88.6Confident27 Ų2769.6 Ų69.612%0.11833%0.331CS..THydrogen-bonded Turntrans-90.77.4178.1-63.6-73000113.6N24 A40 F42 P46 F47 W48 L90 C91 L94N24-F44 WeakPolarHBondContact OD1-CA 3.46Å; A40-F44 VanDerWaalsContact O-CD2 3.25Å; A40-F44 WeakPolarHBondContact O-CD2 3.33Å; A40-F44 PolarHBondContact O-N 3.28Å; F42-F44 VanDerWaalsContact C-N 3.25Å; F42-F44 PolarHBondContact O-N 2.93Å; F44-P46 VanDerWaalsContact C-CD 3.49Å; F44-F47 HydrophobicContact CD1-CD2 4.23Å; F44-F47 WeakPolarHBondContact O-CA 3.36Å; F44-F47 WeakPolarHBondContact O-CB 3.5Å; F44-F47 PolarHBondContact O-N 3.19Å; F44-W48 VanDerWaalsContact C-CD1 3.44Å; F44-W48 PolarHBondContact O-N 2.75Å; F44-L90 HydrophobicContact CE1-CD2 3.74Å; F44-L90 HydrophobicContact CE2-CD2 3.95Å; F44-L90 HydrophobicContact CE2-CG 4.13Å; F44-L90 HydrophobicContact CZ-CD2 3.26Å; F44-L90 HydrophobicContact CZ-CG 3.88Å; F44-C91 VanDerWaalsContact CD2-SG 3.53Å; F44-L94 HydrophobicContact CE2-CD1 3.84Å; F44-L94 HydrophobicContact CZ-CD1 4.19Å
45M90.1Very high88.4Confident90 Ų9066.6 Ų66.644%0.44331%0.312SS..Hα-helixtrans-53.1-43-173.6-176.5-85.5-177.500114F42 L43 F47 W48 L49F42-M45 WeakPolarHBondContact O-CB 3.3Å; F42-M45 PolarHBondContact O-N 3.43Å; L43-M45 VanDerWaalsContact C-N 3.35Å; M45-F47 VanDerWaalsContact C-N 3.28Å; M45-F47 PolarHBondContact O-N 2.96Å; M45-W48 WeakPolarHBondContact O-CB 3.44Å; M45-W48 PolarHBondContact O-N 2.99Å; M45-L49 PolarHBondContact O-N 2.98Å
46P90.7Very high88Confident19 Ų1960.2 Ų60.212%0.12330%0.296CS..Hα-helixtrans-65.7-29.9176.8-9.919.4000113.1A20 A23 N24 L27 F44 W50A20-P46 HydrophobicContact CB-CB 4.39Å; A23-P46 HydrophobicContact CB-CB 4.02Å; A23-P46 HydrophobicContact CB-CG 3.81Å; N24-P46 WeakPolarHBondContact ND2-CB 3.4Å; N24-P46 WeakPolarHBondContact OD1-CD 3.42Å; L27-P46 HydrophobicContact CD1-CG 3.84Å; F44-P46 VanDerWaalsContact C-CD 3.49Å; P46-W50 WeakPolarHBondContact O-CB 3.38Å; P46-W50 PolarHBondContact O-N 3.21Å; P46-W50 VanDerWaalsContact O-N 3.07Å
47F88.4Confident87.6Confident40 Ų4058.9 Ų58.918%0.17530%0.298CS..Hα-helixtrans-73.7-37.3172.2-80.9-54000112.5F17 L21 N24 F44 M45 L49 W50 N51F17-F47 HydrophobicContact CE2-CE1 4.05Å; F17-F47 HydrophobicContact CZ-CE1 4.47Å; L21-F47 HydrophobicContact CB-CZ 4.39Å; L21-F47 HydrophobicContact CG-CZ 4.46Å; N24-F47 HydrophobicContact CB-CD2 3.9Å; N24-F47 HydrophobicContact CB-CE2 3.57Å; N24-F47 HydrophobicContact CB-CZ 4.31Å; N24-F47 WeakPolarHBondContact ND2-CD2 3.47Å; N24-F47 VanDerWaalsContact ND2-CE2 3.3Å; N24-F47 WeakPolarHBondContact ND2-CE2 3.46Å; N24-F47 WeakPolarHBondContact ND2-CG 3.26Å; N24-F47 PolarHBondContact ND2-N 3.36Å; N24-F47 VanDerWaalsContact ND2-N 3.19Å; N24-F47 WeakPolarHBondContact OD1-CD2 3.49Å; F44-F47 HydrophobicContact CD1-CD2 4.23Å; F44-F47 WeakPolarHBondContact O-CA 3.36Å; F44-F47 WeakPolarHBondContact O-CB 3.5Å; F44-F47 PolarHBondContact O-N 3.19Å; M45-F47 VanDerWaalsContact C-N 3.28Å; M45-F47 PolarHBondContact O-N 2.96Å; F47-L49 VanDerWaalsContact C-N 3.33Å; F47-L49 PolarHBondContact O-N 3.25Å; F47-W50 WeakPolarHBondContact O-CB 3.35Å; F47-W50 PolarHBondContact O-N 3.08Å; F47-N51 PolarHBondContact O-N 2.92Å; F47-N51 PolarHBondContact O-ND2 3.46Å
48W89Confident87.1Confident54 Ų5452.5 Ų52.521%0.20527%0.271CS..Hα-helixtrans-58.6-46.9171.8-74.3108.1000111.3W41 F44 M45 W50 N51 I52 L84 I88W41-W48 AromaticContact CE3-CZ2 3.85Å; W41-W48 HydrophobicContact CE3-CZ2 3.85Å; W41-W48 AromaticContact CZ3-CH2 3.97Å; W41-W48 HydrophobicContact CZ3-CH2 3.97Å; W41-W48 AromaticContact CZ3-CZ2 3.64Å; W41-W48 HydrophobicContact CZ3-CZ2 3.64Å; F44-W48 VanDerWaalsContact C-CD1 3.44Å; F44-W48 PolarHBondContact O-N 2.75Å; M45-W48 WeakPolarHBondContact O-CB 3.44Å; M45-W48 PolarHBondContact O-N 2.99Å; W48-W50 VanDerWaalsContact C-N 3.32Å; W48-W50 PolarHBondContact O-N 3.44Å; W48-N51 PolarHBondContact O-N 2.83Å; W48-I52 VanDerWaalsContact O-CG1 3.29Å; W48-I52 WeakPolarHBondContact O-CG1 3.46Å; W48-I52 PolarHBondContact O-N 3.29Å; W48-L84 HydrophobicContact CE3-CD1 3.72Å; W48-L84 HydrophobicContact CH2-CD1 4.26Å; W48-L84 HydrophobicContact CZ3-CD1 3.48Å; W48-L84 VanDerWaalsContact CZ3-CD1 3.48Å; W48-L84 HydrophobicContact CZ3-CG 4.38Å; W48-I88 HydrophobicContact CH2-CD1 4.08Å; W48-I88 HydrophobicContact CH2-CG1 3.39Å; W48-I88 HydrophobicContact CZ2-CG1 4Å; W48-I88 HydrophobicContact CZ3-CG1 4.34Å
49L88.2Confident86.6Confident103 Ų10355.5 Ų55.554%0.53929%0.285SS..Hα-helixtrans-61.9-41.2178-172.263.5000111.5M45 F47 I52 L53M45-L49 PolarHBondContact O-N 2.98Å; F47-L49 VanDerWaalsContact C-N 3.33Å; F47-L49 PolarHBondContact O-N 3.25Å; L49-I52 PolarHBondContact O-N 3Å; L49-L53 WeakPolarHBondContact O-CB 3.3Å; L49-L53 PolarHBondContact O-N 3.37Å
50W88.6Confident86.2Confident25 Ų2555.3 Ų55.310%0.09528%0.283CS..Hα-helixtrans-59.8-48.9173.7175.4-105000112.5Q13 L16 F17 A20 P46 F47 W48 I52 L53 V54Q13-W50 HydrophobicContact CB-CH2 4.43Å; Q13-W50 HydrophobicContact CG-CH2 3.43Å; Q13-W50 VanDerWaalsContact CG-CH2 3.43Å; Q13-W50 HydrophobicContact CG-CZ2 3.94Å; Q13-W50 WeakPolarHBondContact O-CH2 3.36Å; L16-W50 HydrophobicContact CB-CE3 4.39Å; L16-W50 HydrophobicContact CB-CH2 4.35Å; L16-W50 HydrophobicContact CB-CZ3 3.6Å; F17-W50 HydrophobicContact CB-CH2 3.94Å; F17-W50 HydrophobicContact CB-CZ2 3.83Å; F17-W50 HydrophobicContact CB-CZ3 4.44Å; F17-W50 HydrophobicContact CD2-CD2 4.3Å; F17-W50 AromaticContact CD2-CE2 3.8Å; F17-W50 HydrophobicContact CD2-CG 4.43Å; F17-W50 HydrophobicContact CD2-CZ2 4.17Å; F17-W50 AromaticContact CD2-NE1 3.66Å; F17-W50 HydrophobicContact CG-CZ2 4.42Å; A20-W50 HydrophobicContact CB-CB 4.42Å; P46-W50 WeakPolarHBondContact O-CB 3.38Å; P46-W50 PolarHBondContact O-N 3.21Å; P46-W50 VanDerWaalsContact O-N 3.07Å; F47-W50 WeakPolarHBondContact O-CB 3.35Å; F47-W50 PolarHBondContact O-N 3.08Å; W48-W50 VanDerWaalsContact C-N 3.32Å; W48-W50 PolarHBondContact O-N 3.44Å; W50-I52 PolarHBondContact O-N 3.31Å; W50-L53 HydrophobicContact CE3-CD2 4.21Å; W50-L53 HydrophobicContact CZ3-CD2 4.19Å; W50-L53 WeakPolarHBondContact O-CB 3.33Å; W50-L53 PolarHBondContact O-N 2.94Å; W50-V54 HydrophobicContact CD2-CG2 4.12Å; W50-V54 HydrophobicContact CH2-CG2 4.41Å; W50-V54 HydrophobicContact CZ2-CG2 3.82Å; W50-V54 WeakPolarHBondContact O-CG2 3.38Å; W50-V54 PolarHBondContact O-N 3.45Å
51N86.6Confident85.5Confident3 Ų360.2 Ų60.22%0.01631%0.309CS..Hα-helixtrans-62.7-43.8179.7-72.1-24.8000110.9F47 W48 L53 V54 F55 L84 Q87F47-N51 PolarHBondContact O-N 2.92Å; F47-N51 PolarHBondContact O-ND2 3.46Å; W48-N51 PolarHBondContact O-N 2.83Å; N51-L53 VanDerWaalsContact C-N 3.31Å; N51-L53 PolarHBondContact O-N 3.01Å; N51-V54 PolarHBondContact O-N 3.21Å; N51-F55 HydrophobicContact CB-CD2 4.43Å; N51-F55 WeakPolarHBondContact O-CB 3.18Å; N51-F55 WeakPolarHBondContact O-CD2 3.4Å; N51-F55 PolarHBondContact O-N 3.49Å; N51-L84 HydrophobicContact CB-CD1 4.09Å; N51-Q87 PolarHBondContact ND2-OE1 3.25Å
52I86.9Confident84.6Confident110 Ų11058.9 Ų58.956%0.56431%0.307SS*.Hα-helixtrans-60.7-41.3175.4-68.2166.8000110.9W48 L49 W50 G56W48-I52 VanDerWaalsContact O-CG1 3.29Å; W48-I52 WeakPolarHBondContact O-CG1 3.46Å; W48-I52 PolarHBondContact O-N 3.29Å; L49-I52 PolarHBondContact O-N 3Å; W50-I52 PolarHBondContact O-N 3.31Å; I52-G56 WeakPolarHBondContact O-CA 3.3Å; I52-G56 PolarHBondContact O-N 3.22Å
53L86.3Confident84Confident102 Ų10259.4 Ų59.453%0.53431%0.314SS..Hα-helixtrans-61.9-45.2177.1-177.568.5000111.5L16 L49 W50 N51 G57L16-L53 HydrophobicContact CD1-CD2 4.42Å; L49-L53 WeakPolarHBondContact O-CB 3.3Å; L49-L53 PolarHBondContact O-N 3.37Å; W50-L53 HydrophobicContact CE3-CD2 4.21Å; W50-L53 HydrophobicContact CZ3-CD2 4.19Å; W50-L53 WeakPolarHBondContact O-CB 3.33Å; W50-L53 PolarHBondContact O-N 2.94Å; N51-L53 VanDerWaalsContact C-N 3.31Å; N51-L53 PolarHBondContact O-N 3.01Å; L53-G57 PolarHBondContact O-N 3.46Å
54V83.1Confident83.3Confident17 Ų1767.6 Ų67.610%0.10335%0.35CS..Hα-helixtrans-67-49.1179.2171.60000111.3W50 N51 S58 Y76 Q80W50-V54 HydrophobicContact CD2-CG2 4.12Å; W50-V54 HydrophobicContact CH2-CG2 4.41Å; W50-V54 HydrophobicContact CZ2-CG2 3.82Å; W50-V54 WeakPolarHBondContact O-CG2 3.38Å; W50-V54 PolarHBondContact O-N 3.45Å; N51-V54 PolarHBondContact O-N 3.21Å; V54-S58 WeakPolarHBondContact O-CB 3.44Å; V54-S58 PolarHBondContact O-N 3.11Å; V54-Y76 HydrophobicContact CG1-CE1 3.59Å; V54-Y76 WeakPolarHBondContact CG1-OH 3.49Å; V54-Q80 HydrophobicContact CG1-CG 3.97Å
55F82.8Confident82.2Confident50 Ų5073.4 Ų73.422%0.21938%0.375CS..Hα-helixtrans-64.3-45178.1-83.5-68.2000111.9N51 S58 L59 Y77 Q80 I81 L84N51-F55 HydrophobicContact CB-CD2 4.43Å; N51-F55 WeakPolarHBondContact O-CB 3.18Å; N51-F55 WeakPolarHBondContact O-CD2 3.4Å; N51-F55 PolarHBondContact O-N 3.49Å; F55-S58 PolarHBondContact O-N 3.27Å; F55-L59 VanDerWaalsContact O-CB 3.29Å; F55-L59 WeakPolarHBondContact O-CB 3.43Å; F55-L59 PolarHBondContact O-N 3.39Å; F55-Y77 HydrophobicContact CD1-CD1 4.29Å; F55-Y77 HydrophobicContact CD1-CE1 4.48Å; F55-Y77 HydrophobicContact CE1-CD1 4.13Å; F55-Q80 HydrophobicContact CE1-CB 4Å; F55-Q80 HydrophobicContact CE2-CB 3.77Å; F55-Q80 HydrophobicContact CZ-CB 3.4Å; F55-I81 HydrophobicContact CE1-CG1 3.98Å; F55-I81 HydrophobicContact CZ-CG1 3.74Å; F55-L84 HydrophobicContact CE2-CD2 4.2Å
56G80.8Confident80.9Confident29 Ų2974.1 Ų74.130%0.29939%0.388SS..Hα-helixtrans-62-47.4178.100000111.8I52 S58 L59 I60I52-G56 WeakPolarHBondContact O-CA 3.3Å; I52-G56 PolarHBondContact O-N 3.22Å; G56-S58 VanDerWaalsContact C-N 3.32Å; G56-S58 PolarHBondContact O-N 3.07Å; G56-L59 PolarHBondContact O-N 3.19Å; G56-I60 WeakPolarHBondContact O-CB 3.36Å; G56-I60 WeakPolarHBondContact O-CD1 3.48Å; G56-I60 WeakPolarHBondContact O-CG1 3.26Å; G56-I60 PolarHBondContact O-N 2.94Å
57G80.1Confident79.3Confident34 Ų3476.9 Ų76.935%0.35140%0.402SS..Hα-helixtrans-59.8-42176.400000112.6L53 L61L53-G57 PolarHBondContact O-N 3.46Å; G57-L61 WeakPolarHBondContact O-CG 3.46Å; G57-L61 PolarHBondContact O-N 3.32Å; G57-L61 VanDerWaalsContact O-N 3.08Å
58S76.8Confident78.1Confident26 Ų2681.7 Ų81.718%0.18243%0.429CS..Hα-helixtrans-70-38178.5-158.90000112.8V54 F55 G56 L61 F62 Y77V54-S58 WeakPolarHBondContact O-CB 3.44Å; V54-S58 PolarHBondContact O-N 3.11Å; F55-S58 PolarHBondContact O-N 3.27Å; G56-S58 VanDerWaalsContact C-N 3.32Å; G56-S58 PolarHBondContact O-N 3.07Å; S58-L61 PolarHBondContact O-N 3.23Å; S58-F62 WeakPolarHBondContact O-CB 3.36Å; S58-F62 PolarHBondContact O-N 3.13Å; S58-Y77 WeakPolarHBondContact CB-OH 3.44Å; S58-Y77 PolarHBondContact O-OH 3.08Å; S58-Y77 WeakPolarHBondContact OG-CE1 3.37Å; S58-Y77 PolarHBondContact OG-OH 3.28Å
59L78.6Confident76.8Confident98 Ų9883.3 Ų83.351%0.51344%0.442SS..Hα-helixtrans-67.1-42176.5-173.3149.3000111.7F55 G56 F62 L63F55-L59 VanDerWaalsContact O-CB 3.29Å; F55-L59 WeakPolarHBondContact O-CB 3.43Å; F55-L59 PolarHBondContact O-N 3.39Å; G56-L59 PolarHBondContact O-N 3.19Å; L59-F62 WeakPolarHBondContact O-CB 3.17Å; L59-F62 PolarHBondContact O-N 3.4Å; L59-L63 HydrophobicContact CD2-CD1 3.58Å; L59-L63 HydrophobicContact CD2-CG 4.14Å; L59-L63 WeakPolarHBondContact O-CG 3.4Å; L59-L63 PolarHBondContact O-N 3.28Å
60I81Confident76Confident93 Ų9382.2 Ų82.248%0.47744%0.439SS..Hα-helixtrans-60.2-47174.3-68.1161.1000109.8G56 F62 L63 F64G56-I60 WeakPolarHBondContact O-CB 3.36Å; G56-I60 WeakPolarHBondContact O-CD1 3.48Å; G56-I60 WeakPolarHBondContact O-CG1 3.26Å; G56-I60 PolarHBondContact O-N 2.94Å; I60-F62 VanDerWaalsContact C-N 3.31Å; I60-F62 PolarHBondContact O-N 3.12Å; I60-L63 PolarHBondContact O-N 2.78Å; I60-F64 HydrophobicContact CG2-CD2 3.7Å; I60-F64 HydrophobicContact CG2-CE2 4.01Å; I60-F64 WeakPolarHBondContact O-CB 3.49Å; I60-F64 WeakPolarHBondContact O-CD2 3.26Å; I60-F64 PolarHBondContact O-N 3.12Å
61L74.4Confident75.4Confident103 Ų10390.2 Ų90.254%0.53948%0.475SS..Hα-helixtrans-61.6-38.5176.6-74.2172.6000112.6G57 S58 K65 L67G57-L61 WeakPolarHBondContact O-CG 3.46Å; G57-L61 PolarHBondContact O-N 3.32Å; G57-L61 VanDerWaalsContact O-N 3.08Å; S58-L61 PolarHBondContact O-N 3.23Å; L61-K65 WeakPolarHBondContact O-CB 3.46Å; L61-K65 PolarHBondContact O-N 3.4Å; L61-L67 HydrophobicContact CB-CD1 4.4Å
62F72.9Confident74.8Confident93 Ų9396.3 Ų96.341%0.40851%0.507SS..Hα-helixtrans-62.6-48.9176178.9-103.3000111.7S58 L59 I60 S66 L69S58-F62 WeakPolarHBondContact O-CB 3.36Å; S58-F62 PolarHBondContact O-N 3.13Å; L59-F62 WeakPolarHBondContact O-CB 3.17Å; L59-F62 PolarHBondContact O-N 3.4Å; I60-F62 VanDerWaalsContact C-N 3.31Å; I60-F62 PolarHBondContact O-N 3.12Å; F62-S66 PolarHBondContact O-N 3.4Å; F62-L69 HydrophobicContact CD2-CD2 4.34Å; F62-L69 HydrophobicContact CE2-CD1 4.39Å; F62-L69 HydrophobicContact CE2-CD2 4.19Å; F62-L69 HydrophobicContact CE2-CG 4.04Å
63L78.5Confident74.2Confident121 Ų12192.7 Ų92.763%0.63449%0.491SS*.Hα-helixtrans-65.1-44.7178.9-69.6178.6000112.6L59 I60L59-L63 HydrophobicContact CD2-CD1 3.58Å; L59-L63 HydrophobicContact CD2-CG 4.14Å; L59-L63 WeakPolarHBondContact O-CG 3.4Å; L59-L63 PolarHBondContact O-N 3.28Å; I60-L63 PolarHBondContact O-N 2.78Å
64F73.5Confident73.9Confident183 Ų18392 Ų9280%0.80349%0.487SS*.Hα-helixtrans-77.3-34.3-174.4-89.1-86.6000113.9I60I60-F64 HydrophobicContact CG2-CD2 3.7Å; I60-F64 HydrophobicContact CG2-CE2 4.01Å; I60-F64 WeakPolarHBondContact O-CB 3.49Å; I60-F64 WeakPolarHBondContact O-CD2 3.26Å; I60-F64 PolarHBondContact O-N 3.12Å
65K69Low73.8Confident148 Ų14892.8 Ų92.864%0.64349%0.489SS*.Hα-helixtrans-105.5-1.3-170.2-163.7165.9177.3177.50114.2L61 L67L61-K65 WeakPolarHBondContact O-CB 3.46Å; L61-K65 PolarHBondContact O-N 3.4Å; K65-L67 HydrophobicContact CB-CD1 3.9Å; K65-L67 HydrophobicContact CB-CG 3.86Å; K65-L67 HydrophobicContact CD-CD1 4.03Å; K65-L67 HydrophobicContact CD-CD2 4.27Å; K65-L67 HydrophobicContact CD-CG 4.05Å; K65-L67 HydrophobicContact CG-CD1 4.19Å; K65-L67 HydrophobicContact CG-CD2 4.41Å; K65-L67 HydrophobicContact CG-CG 3.87Å; K65-L67 PolarHBondContact O-N 3.46Å; K65-L67 VanDerWaalsContact O-N 3.1Å
66S63.2Low73.6Confident105 Ų10594.2 Ų94.273%0.73449%0.494SS*.THydrogen-bonded Turntrans43.645.8-173.4-166.90000110.5F62 N68F62-S66 PolarHBondContact O-N 3.4Å; S66-N68 PolarHBondContact O-N 3.42Å; S66-N68 VanDerWaalsContact O-N 3.13Å
67L57.2Low73.7Confident77 Ų7794.9 Ų94.940%0.40349%0.488SS..  trans-68.6116.5-175.9-87.5155.8000107.5L61 K65 L69L61-L67 HydrophobicContact CB-CD1 4.4Å; K65-L67 HydrophobicContact CB-CD1 3.9Å; K65-L67 HydrophobicContact CB-CG 3.86Å; K65-L67 HydrophobicContact CD-CD1 4.03Å; K65-L67 HydrophobicContact CD-CD2 4.27Å; K65-L67 HydrophobicContact CD-CG 4.05Å; K65-L67 HydrophobicContact CG-CD1 4.19Å; K65-L67 HydrophobicContact CG-CD2 4.41Å; K65-L67 HydrophobicContact CG-CG 3.87Å; K65-L67 PolarHBondContact O-N 3.46Å; K65-L67 VanDerWaalsContact O-N 3.1Å; L67-L69 PolarHBondContact O-N 2.84Å
68N62.1Low74Confident141 Ų14197.4 Ų97.475%0.75449%0.493SS*.  trans-47.4119.8163.5-77.1-17.7000107.6S66 T70S66-N68 PolarHBondContact O-N 3.42Å; S66-N68 VanDerWaalsContact O-N 3.13Å; N68-T70 VanDerWaalsContact C-N 3.27Å; N68-T70 PolarHBondContact O-N 3.06Å
69L61.9Low74.5Confident89 Ų8996.6 Ų96.647%0.46649%0.487SS..  trans-57.195175.2-75.4166.2000107.8F62 L67 L74 Y77F62-L69 HydrophobicContact CD2-CD2 4.34Å; F62-L69 HydrophobicContact CE2-CD1 4.39Å; F62-L69 HydrophobicContact CE2-CD2 4.19Å; F62-L69 HydrophobicContact CE2-CG 4.04Å; L67-L69 PolarHBondContact O-N 2.84Å; L69-L74 HydrophobicContact CB-CG 4.44Å; L69-L74 HydrophobicContact CD1-CD2 4.38Å; L69-L74 HydrophobicContact CD2-CD2 4.32Å; L69-Y77 HydrophobicContact CD2-CE2 4.26Å
70T71.3Confident74.8Confident80 Ų8092.7 Ų92.749%0.49147%0.466SS..  trans-66.5147.9173.159.30000107.3N68 L72 S73 L74N68-T70 VanDerWaalsContact C-N 3.27Å; N68-T70 PolarHBondContact O-N 3.06Å; T70-L72 PolarHBondContact O-N 3.03Å; T70-S73 WeakPolarHBondContact O-CB 3.45Å; T70-S73 PolarHBondContact O-N 3.45Å; T70-S73 PolarHBondContact OG1-N 3.28Å; T70-L74 PolarHBondContact O-N 3.15Å
71K76.2Confident75.2Confident192 Ų19292.2 Ų92.284%0.83546%0.464SS*.Hα-helixtrans-50.5-31.7175.6-65.8177.1-179.3174.10111.9F75K71-F75 PolarHBondContact O-N 3.31Å
72L73.1Confident76Confident131 Ų13188 Ų8869%0.68644%0.443SS*.Hα-helixtrans-69-39.9176.2-172.267.5000113.2T70 F75 Y76T70-L72 PolarHBondContact O-N 3.03Å; L72-F75 PolarHBondContact O-N 3.45Å; L72-Y76 PolarHBondContact O-N 3.39Å
73S75.5Confident76.9Confident34 Ų3486.3 Ų86.324%0.23844%0.438CS..Hα-helixtrans-64.4-44.6177.8178.80000111.2T70 F75 Y76 Y77T70-S73 WeakPolarHBondContact O-CB 3.45Å; T70-S73 PolarHBondContact O-N 3.45Å; T70-S73 PolarHBondContact OG1-N 3.28Å; S73-F75 VanDerWaalsContact C-N 3.31Å; S73-F75 PolarHBondContact O-N 2.9Å; S73-Y76 PolarHBondContact O-N 3.25Å; S73-Y77 WeakPolarHBondContact O-CD2 3.43Å; S73-Y77 PolarHBondContact O-N 3.05Å; S73-Y77 WeakPolarHBondContact OG-CE2 3.48Å
74L79.1Confident77.5Confident87 Ų8782.6 Ų82.646%0.45542%0.418SS..Hα-helixtrans-58.9-42.6175.1-73.4174.6000112.1L69 T70 Y77 L78L69-L74 HydrophobicContact CB-CG 4.44Å; L69-L74 HydrophobicContact CD1-CD2 4.38Å; L69-L74 HydrophobicContact CD2-CD2 4.32Å; T70-L74 PolarHBondContact O-N 3.15Å; L74-Y77 PolarHBondContact O-N 2.93Å; L74-L78 WeakPolarHBondContact O-CG 3.44Å; L74-L78 PolarHBondContact O-N 3.38Å
75F81.6Confident78.5Confident34 Ų3476 Ų7615%0.14939%0.393CS..Hα-helixtrans-60.3-47176.4175.7-98.5000112K71 L72 S73 Y77 L78 C79 L114 T118 E132K71-F75 PolarHBondContact O-N 3.31Å; L72-F75 PolarHBondContact O-N 3.45Å; S73-F75 VanDerWaalsContact C-N 3.31Å; S73-F75 PolarHBondContact O-N 2.9Å; F75-Y77 VanDerWaalsContact C-N 3.35Å; F75-Y77 PolarHBondContact O-N 3.47Å; F75-L78 PolarHBondContact O-N 3.41Å; F75-C79 PolarHBondContact O-N 3.21Å; F75-C79 PolarHBondContact O-SG 2.88Å; F75-C79 VanDerWaalsContact O-SG 3.42Å; F75-L114 HydrophobicContact CD2-CD2 4.49Å; F75-L114 HydrophobicContact CE2-CB 3.91Å; F75-L114 HydrophobicContact CE2-CD2 4.41Å; F75-T118 HydrophobicContact CD2-CG2 4.03Å; F75-T118 HydrophobicContact CE1-CG2 3.92Å; F75-T118 HydrophobicContact CE2-CG2 3.33Å; F75-T118 HydrophobicContact CZ-CG2 3.29Å; F75-E132 VanDerWaalsContact CE1-CD 3.46Å; F75-E132 WeakPolarHBondContact CE1-OE1 3.44Å; F75-E132 WeakPolarHBondContact CE1-OE2 3.3Å; F75-E132 VanDerWaalsContact CZ-OE2 3.29Å; F75-E132 WeakPolarHBondContact CZ-OE2 3.36Å
76Y79.5Confident79.7Confident80 Ų8070.9 Ų70.931%0.31437%0.371SS..Hα-helixtrans-60.9-42.3176-176-100.9000112.3V54 L72 S73 L78 C79 Q80V54-Y76 HydrophobicContact CG1-CE1 3.59Å; V54-Y76 WeakPolarHBondContact CG1-OH 3.49Å; L72-Y76 PolarHBondContact O-N 3.39Å; S73-Y76 PolarHBondContact O-N 3.25Å; Y76-L78 PolarHBondContact O-N 3.47Å; Y76-C79 WeakPolarHBondContact O-CB 3.45Å; Y76-C79 PolarHBondContact O-N 3.49Å; Y76-Q80 HydrophobicContact CD1-CG 4.03Å; Y76-Q80 HydrophobicContact CE1-CG 3.68Å; Y76-Q80 HydrophobicContact CE2-CG 4.49Å; Y76-Q80 WeakPolarHBondContact O-CG 3.47Å; Y76-Q80 PolarHBondContact O-N 3.11Å; Y76-Q80 PolarHBondContact OH-NE2 3.38Å
77Y82.9Confident81.1Confident43 Ų4366.4 Ų66.417%0.16934%0.338CS..Hα-helixtrans-61.3-43175.4-76.4-62.8000112.4F55 S58 L69 S73 L74 F75 C79 Q80 I81F55-Y77 HydrophobicContact CD1-CD1 4.29Å; F55-Y77 HydrophobicContact CD1-CE1 4.48Å; F55-Y77 HydrophobicContact CE1-CD1 4.13Å; S58-Y77 WeakPolarHBondContact CB-OH 3.44Å; S58-Y77 PolarHBondContact O-OH 3.08Å; S58-Y77 WeakPolarHBondContact OG-CE1 3.37Å; S58-Y77 PolarHBondContact OG-OH 3.28Å; L69-Y77 HydrophobicContact CD2-CE2 4.26Å; S73-Y77 WeakPolarHBondContact O-CD2 3.43Å; S73-Y77 PolarHBondContact O-N 3.05Å; S73-Y77 WeakPolarHBondContact OG-CE2 3.48Å; L74-Y77 PolarHBondContact O-N 2.93Å; F75-Y77 VanDerWaalsContact C-N 3.35Å; F75-Y77 PolarHBondContact O-N 3.47Å; Y77-C79 VanDerWaalsContact C-N 3.29Å; Y77-C79 PolarHBondContact O-N 2.94Å; Y77-Q80 PolarHBondContact O-N 3.26Å; Y77-I81 WeakPolarHBondContact O-CB 3.29Å; Y77-I81 VanDerWaalsContact O-CG1 3.26Å; Y77-I81 WeakPolarHBondContact O-CG1 3.43Å; Y77-I81 PolarHBondContact O-N 3.11Å
78L85.7Confident82.9Confident87 Ų8765.2 Ų65.246%0.45533%0.332SS..Hα-helixtrans-61.2-39.3175.6-71.9172.5000111.6L74 F75 Y76 S82 L114L74-L78 WeakPolarHBondContact O-CG 3.44Å; L74-L78 PolarHBondContact O-N 3.38Å; F75-L78 PolarHBondContact O-N 3.41Å; Y76-L78 PolarHBondContact O-N 3.47Å; L78-S82 WeakPolarHBondContact O-CB 3.24Å; L78-S82 PolarHBondContact O-N 3.49Å; L78-S82 PolarHBondContact O-OG 3.46Å; L78-L114 HydrophobicContact CB-CD1 4.02Å
79C86.2Confident84.4Confident10 Ų1061.2 Ų61.27%0.06831%0.308CS..Hα-helixtrans-62.4-48.3174.4-68.90000111.6F75 Y76 Y77 I81 S82 I83 L111F75-C79 PolarHBondContact O-N 3.21Å; F75-C79 PolarHBondContact O-SG 2.88Å; F75-C79 VanDerWaalsContact O-SG 3.42Å; Y76-C79 WeakPolarHBondContact O-CB 3.45Å; Y76-C79 PolarHBondContact O-N 3.49Å; Y77-C79 VanDerWaalsContact C-N 3.29Å; Y77-C79 PolarHBondContact O-N 2.94Å; C79-I81 PolarHBondContact O-N 3.43Å; C79-S82 PolarHBondContact O-N 3.4Å; C79-I83 WeakPolarHBondContact O-CG1 3.49Å; C79-I83 PolarHBondContact O-N 2.93Å; C79-L111 HydrophobicContact CB-CD2 3.93Å
80Q86.7Confident86Confident16 Ų1658.2 Ų58.28%0.07529%0.292CS..Hα-helixtrans-63.7-41.7179.2-65.8-57-30.400112.5V54 F55 Y76 Y77 S82 I83 L84V54-Q80 HydrophobicContact CG1-CG 3.97Å; F55-Q80 HydrophobicContact CE1-CB 4Å; F55-Q80 HydrophobicContact CE2-CB 3.77Å; F55-Q80 HydrophobicContact CZ-CB 3.4Å; Y76-Q80 HydrophobicContact CD1-CG 4.03Å; Y76-Q80 HydrophobicContact CE1-CG 3.68Å; Y76-Q80 HydrophobicContact CE2-CG 4.49Å; Y76-Q80 WeakPolarHBondContact O-CG 3.47Å; Y76-Q80 PolarHBondContact O-N 3.11Å; Y76-Q80 PolarHBondContact OH-NE2 3.38Å; Y77-Q80 PolarHBondContact O-N 3.26Å; Q80-S82 VanDerWaalsContact C-N 3.32Å; Q80-S82 PolarHBondContact O-N 3.02Å; Q80-I83 PolarHBondContact O-N 2.82Å; Q80-L84 WeakPolarHBondContact O-CB 3.25Å; Q80-L84 PolarHBondContact O-N 3.39Å
81I89.3Confident87Confident82 Ų8254.4 Ų54.442%0.42127%0.269SS..Hα-helixtrans-62.1-44.1177.2-70.4169.2000109.7F55 Y77 C79 I83 L84 T85F55-I81 HydrophobicContact CE1-CG1 3.98Å; F55-I81 HydrophobicContact CZ-CG1 3.74Å; Y77-I81 WeakPolarHBondContact O-CB 3.29Å; Y77-I81 VanDerWaalsContact O-CG1 3.26Å; Y77-I81 WeakPolarHBondContact O-CG1 3.43Å; Y77-I81 PolarHBondContact O-N 3.11Å; C79-I81 PolarHBondContact O-N 3.43Å; I81-I83 PolarHBondContact O-N 3.18Å; I81-L84 WeakPolarHBondContact O-CB 3.49Å; I81-L84 PolarHBondContact O-N 3.42Å; I81-T85 PolarHBondContact O-N 3.48Å; I81-T85 PolarHBondContact O-OG1 2.98Å
82S91.3Very high87.9Confident15 Ų1547.7 Ų47.711%0.10524%0.241CC..Hα-helixtrans-64.5-40.1-179.5-56.40000112.3L78 C79 Q80 T85 F86 P107 L111L78-S82 WeakPolarHBondContact O-CB 3.24Å; L78-S82 PolarHBondContact O-N 3.49Å; L78-S82 PolarHBondContact O-OG 3.46Å; C79-S82 PolarHBondContact O-N 3.4Å; Q80-S82 VanDerWaalsContact C-N 3.32Å; Q80-S82 PolarHBondContact O-N 3.02Å; S82-T85 PolarHBondContact O-N 3.03Å; S82-F86 PolarHBondContact O-N 3.21Å; S82-P107 WeakPolarHBondContact O-CB 3.32Å; S82-L111 VanDerWaalsContact CB-CG 3.49Å
83I90.7Very high88.8Confident58 Ų5842.2 Ų42.230%0.29721%0.212SC..Hα-helixtrans-62.5-44.3173.9-66.6167.8000110.7C79 Q80 I81 F86 Q87 L111C79-I83 WeakPolarHBondContact O-CG1 3.49Å; C79-I83 PolarHBondContact O-N 2.93Å; Q80-I83 PolarHBondContact O-N 2.82Å; I81-I83 PolarHBondContact O-N 3.18Å; I83-F86 PolarHBondContact O-N 3.37Å; I83-Q87 WeakPolarHBondContact O-CG 3.4Å; I83-Q87 PolarHBondContact O-N 3.4Å; I83-Q87 VanDerWaalsContact O-N 3.11Å; I83-L111 HydrophobicContact CG1-CD1 3.79Å
84L91.8Very high89.6Confident43 Ų4344.1 Ų44.123%0.22522%0.219CC..Hα-helixtrans-63.4-44.9178.1-172.670.4000111.7W48 N51 F55 Q80 I81 F86 Q87 I88W48-L84 HydrophobicContact CE3-CD1 3.72Å; W48-L84 HydrophobicContact CH2-CD1 4.26Å; W48-L84 HydrophobicContact CZ3-CD1 3.48Å; W48-L84 VanDerWaalsContact CZ3-CD1 3.48Å; W48-L84 HydrophobicContact CZ3-CG 4.38Å; N51-L84 HydrophobicContact CB-CD1 4.09Å; F55-L84 HydrophobicContact CE2-CD2 4.2Å; Q80-L84 WeakPolarHBondContact O-CB 3.25Å; Q80-L84 PolarHBondContact O-N 3.39Å; I81-L84 WeakPolarHBondContact O-CB 3.49Å; I81-L84 PolarHBondContact O-N 3.42Å; L84-F86 VanDerWaalsContact C-N 3.32Å; L84-F86 PolarHBondContact O-N 3.46Å; L84-Q87 PolarHBondContact O-N 3.24Å; L84-I88 HydrophobicContact CG-CD1 4.21Å; L84-I88 WeakPolarHBondContact O-CG1 3.34Å; L84-I88 PolarHBondContact O-N 2.95Å
85T93.4Very high90.1Very high44 Ų4444.1 Ų44.127%0.2722%0.217SC..Hα-helixtrans-61.5-41.1177.3-53.80000111.4I81 S82 Q87 I88 F89 P107I81-T85 PolarHBondContact O-N 3.48Å; I81-T85 PolarHBondContact O-OG1 2.98Å; S82-T85 PolarHBondContact O-N 3.03Å; T85-Q87 VanDerWaalsContact C-N 3.35Å; T85-Q87 PolarHBondContact O-N 3.03Å; T85-I88 PolarHBondContact O-N 3.42Å; T85-F89 HydrophobicContact CG2-CD2 4.26Å; T85-F89 HydrophobicContact CG2-CE1 4.18Å; T85-F89 HydrophobicContact CG2-CE2 3.85Å; T85-F89 HydrophobicContact CG2-CZ 3.81Å; T85-F89 WeakPolarHBondContact O-CG 3.35Å; T85-F89 PolarHBondContact O-N 3.22Å; T85-P107 HydrophobicContact CG2-CB 4.31Å; T85-P107 HydrophobicContact CG2-CG 3.6Å
86F94.5Very high90.5Very high40 Ų4050.2 Ų50.218%0.17524%0.243CC..Hα-helixtrans-58.4-46.8174.4171.3-105.3000111.7S82 I83 L84 I88 F89 L90 V104 F105 P107 I108S82-F86 PolarHBondContact O-N 3.21Å; I83-F86 PolarHBondContact O-N 3.37Å; L84-F86 VanDerWaalsContact C-N 3.32Å; L84-F86 PolarHBondContact O-N 3.46Å; F86-I88 VanDerWaalsContact C-N 3.34Å; F86-I88 PolarHBondContact O-N 2.89Å; F86-F89 PolarHBondContact O-N 2.86Å; F86-L90 HydrophobicContact CE1-CD2 4.02Å; F86-L90 HydrophobicContact CZ-CD2 4.11Å; F86-L90 WeakPolarHBondContact O-CB 3.25Å; F86-L90 PolarHBondContact O-N 3.24Å; F86-V104 HydrophobicContact CD2-CG1 4.29Å; F86-V104 VanDerWaalsContact CD2-O 3.3Å; F86-V104 WeakPolarHBondContact CD2-O 3.42Å; F86-V104 HydrophobicContact CE2-CG1 3.98Å; F86-F105 HydrophobicContact CE2-CD1 4.27Å; F86-F105 HydrophobicContact CE2-CE1 4.3Å; F86-P107 HydrophobicContact CB-CB 4.13Å; F86-P107 HydrophobicContact CB-CG 4.38Å; F86-I108 HydrophobicContact CB-CG1 4.23Å; F86-I108 HydrophobicContact CD1-CD1 4.04Å; F86-I108 HydrophobicContact CD1-CG1 4.48Å; F86-I108 HydrophobicContact CD2-CD1 3.36Å; F86-I108 HydrophobicContact CD2-CG1 3.62Å; F86-I108 HydrophobicContact CE1-CD1 3.98Å; F86-I108 HydrophobicContact CE2-CD1 3.29Å; F86-I108 HydrophobicContact CE2-CG1 4.09Å; F86-I108 HydrophobicContact CG-CD1 3.75Å; F86-I108 HydrophobicContact CG-CG1 3.84Å; F86-I108 HydrophobicContact CZ-CD1 3.62Å
87Q93Very high91Very high12 Ų1251.9 Ų51.96%0.05626%0.257CS..Hα-helixtrans-62.7-39.7179.1-69.9173.6400112.4N51 I83 L84 T85 L90 C91N51-Q87 PolarHBondContact ND2-OE1 3.25Å; I83-Q87 WeakPolarHBondContact O-CG 3.4Å; I83-Q87 PolarHBondContact O-N 3.4Å; I83-Q87 VanDerWaalsContact O-N 3.11Å; L84-Q87 PolarHBondContact O-N 3.24Å; T85-Q87 VanDerWaalsContact C-N 3.35Å; T85-Q87 PolarHBondContact O-N 3.03Å; Q87-L90 PolarHBondContact O-N 3.4Å; Q87-C91 PolarHBondContact O-N 3.42Å; Q87-C91 PolarHBondContact O-SG 3Å
88I94Very high91.4Very high52 Ų5253.3 Ų53.327%0.26728%0.278SS..Hα-helixtrans-60.7-50.2174.8-70.2161.2000110.6W48 L84 T85 F86 L90 C91 I92W48-I88 HydrophobicContact CH2-CD1 4.08Å; W48-I88 HydrophobicContact CH2-CG1 3.39Å; W48-I88 HydrophobicContact CZ2-CG1 4Å; W48-I88 HydrophobicContact CZ3-CG1 4.34Å; L84-I88 HydrophobicContact CG-CD1 4.21Å; L84-I88 WeakPolarHBondContact O-CG1 3.34Å; L84-I88 PolarHBondContact O-N 2.95Å; T85-I88 PolarHBondContact O-N 3.42Å; F86-I88 VanDerWaalsContact C-N 3.34Å; F86-I88 PolarHBondContact O-N 2.89Å; I88-L90 VanDerWaalsContact C-N 3.29Å; I88-L90 PolarHBondContact O-N 3.34Å; I88-C91 PolarHBondContact O-N 3.28Å; I88-I92 HydrophobicContact CG2-CD1 3.85Å; I88-I92 WeakPolarHBondContact O-CG1 3.29Å; I88-I92 PolarHBondContact O-N 2.96Å
89F95.2Very high91.7Very high56 Ų5651.4 Ų51.425%0.24627%0.268CS..Hα-helixtrans-63.4-37.9179.7-70.8-9.3000112T85 F86 I92 K93 L99 V104 P107T85-F89 HydrophobicContact CG2-CD2 4.26Å; T85-F89 HydrophobicContact CG2-CE1 4.18Å; T85-F89 HydrophobicContact CG2-CE2 3.85Å; T85-F89 HydrophobicContact CG2-CZ 3.81Å; T85-F89 WeakPolarHBondContact O-CG 3.35Å; T85-F89 PolarHBondContact O-N 3.22Å; F86-F89 PolarHBondContact O-N 2.86Å; F89-I92 PolarHBondContact O-N 3.01Å; F89-K93 WeakPolarHBondContact O-CB 3.34Å; F89-K93 PolarHBondContact O-N 3.36Å; F89-L99 HydrophobicContact CD1-CD1 4.44Å; F89-V104 HydrophobicContact CB-CB 4.3Å; F89-V104 HydrophobicContact CB-CG1 4.06Å; F89-V104 HydrophobicContact CB-CG2 4.29Å; F89-P107 HydrophobicContact CD2-CG 3.85Å; F89-P107 HydrophobicContact CE2-CG 3.93Å
90L94Very high92.1Very high26 Ų2654.3 Ų54.314%0.13628%0.283CS..Hα-helixtrans-63.1-42.8174.9-172.762.5000111.6F44 F86 Q87 I88 K93 L94 W101 V104F44-L90 HydrophobicContact CE1-CD2 3.74Å; F44-L90 HydrophobicContact CE2-CD2 3.95Å; F44-L90 HydrophobicContact CE2-CG 4.13Å; F44-L90 HydrophobicContact CZ-CD2 3.26Å; F44-L90 HydrophobicContact CZ-CG 3.88Å; F86-L90 HydrophobicContact CE1-CD2 4.02Å; F86-L90 HydrophobicContact CZ-CD2 4.11Å; F86-L90 WeakPolarHBondContact O-CB 3.25Å; F86-L90 PolarHBondContact O-N 3.24Å; Q87-L90 PolarHBondContact O-N 3.4Å; I88-L90 VanDerWaalsContact C-N 3.29Å; I88-L90 PolarHBondContact O-N 3.34Å; L90-K93 PolarHBondContact O-N 2.9Å; L90-L94 HydrophobicContact CD1-CD1 4.33Å; L90-L94 HydrophobicContact CD1-CG 4.48Å; L90-L94 HydrophobicContact CG-CD1 4.09Å; L90-L94 WeakPolarHBondContact O-CB 3.46Å; L90-L94 VanDerWaalsContact O-CG 3.3Å; L90-L94 WeakPolarHBondContact O-CG 3.44Å; L90-L94 PolarHBondContact O-N 3.13Å; L90-W101 HydrophobicContact CD1-CZ3 3.89Å; L90-V104 HydrophobicContact CB-CG1 4.23Å; L90-V104 HydrophobicContact CD1-CG1 4.32Å
91C93.3Very high92.5Very high0 Ų056 Ų560%029%0.289CS..Hα-helixtrans-61.8-45.9174.7-67.60000111.8A40 W41 F44 Q87 I88 K93 L94 E95A40-C91 HydrophobicContact CB-CB 4.43Å; W41-C91 HydrophobicContact CD2-CB 4.15Å; W41-C91 HydrophobicContact CE3-CB 4.39Å; W41-C91 HydrophobicContact CZ2-CB 4.27Å; F44-C91 VanDerWaalsContact CD2-SG 3.53Å; Q87-C91 PolarHBondContact O-N 3.42Å; Q87-C91 PolarHBondContact O-SG 3Å; I88-C91 PolarHBondContact O-N 3.28Å; C91-K93 VanDerWaalsContact C-N 3.33Å; C91-K93 PolarHBondContact O-N 2.74Å; C91-L94 PolarHBondContact O-N 3.33Å; C91-E95 WeakPolarHBondContact O-CB 3.14Å; C91-E95 PolarHBondContact O-N 2.94Å
92I94.2Very high92.7Very high51 Ų5156.5 Ų56.526%0.26229%0.286SS..Hα-helixtrans-61.9-42.1178.4-66.5167.5000110.9I88 F89 K96 L99I88-I92 HydrophobicContact CG2-CD1 3.85Å; I88-I92 WeakPolarHBondContact O-CG1 3.29Å; I88-I92 PolarHBondContact O-N 2.96Å; F89-I92 PolarHBondContact O-N 3.01Å; I92-K96 PolarHBondContact O-N 2.89Å; I92-L99 HydrophobicContact CB-CD1 4.29Å; I92-L99 HydrophobicContact CG2-CD1 3.85Å; I92-L99 HydrophobicContact CG2-CG 4.17Å
93K93.4Very high92.9Very high17 Ų1757.4 Ų57.47%0.07429%0.291CS..Hα-helixtrans-63-46.7176.8177.660.5169.2174.60111.8F89 L90 C91 E95 N97 L99 W101 V104F89-K93 WeakPolarHBondContact O-CB 3.34Å; F89-K93 PolarHBondContact O-N 3.36Å; L90-K93 PolarHBondContact O-N 2.9Å; C91-K93 VanDerWaalsContact C-N 3.33Å; C91-K93 PolarHBondContact O-N 2.74Å; K93-E95 VanDerWaalsContact C-N 3.32Å; K93-E95 PolarHBondContact O-N 2.64Å; K93-N97 WeakPolarHBondContact CE-OD1 3.03Å; K93-N97 PolarHBondContact NZ-OD1 2.91Å; K93-N97 WeakPolarHBondContact O-CA 3.41Å; K93-N97 PolarHBondContact O-N 3.45Å; K93-L99 WeakPolarHBondContact CD-O 3.35Å; K93-L99 VanDerWaalsContact CE-O 3.23Å; K93-L99 WeakPolarHBondContact CE-O 3.38Å; K93-L99 PolarHBondContact NZ-O 3.06Å; K93-W101 HydrophobicContact CG-CD2 4.33Å; K93-W101 HydrophobicContact CG-CE3 4.21Å; K93-W101 HydrophobicContact CG-CH2 3.96Å; K93-W101 HydrophobicContact CG-CZ2 4.09Å; K93-W101 HydrophobicContact CG-CZ3 4.02Å; K93-V104 HydrophobicContact CB-CG2 3.77Å; K93-V104 HydrophobicContact CG-CG2 4.11Å
94L91.4Very high93.1Very high73 Ų7354.7 Ų54.738%0.38228%0.277SS..Hα-helixtrans-69.7-28.8-177.9-71.8171.5000113.3A40 F44 L90 C91A40-L94 HydrophobicContact CB-CB 3.76Å; A40-L94 HydrophobicContact CB-CD1 4.31Å; F44-L94 HydrophobicContact CE2-CD1 3.84Å; F44-L94 HydrophobicContact CZ-CD1 4.19Å; L90-L94 HydrophobicContact CD1-CD1 4.33Å; L90-L94 HydrophobicContact CD1-CG 4.48Å; L90-L94 HydrophobicContact CG-CD1 4.09Å; L90-L94 WeakPolarHBondContact O-CB 3.46Å; L90-L94 VanDerWaalsContact O-CG 3.3Å; L90-L94 WeakPolarHBondContact O-CG 3.44Å; L90-L94 PolarHBondContact O-N 3.13Å; C91-L94 PolarHBondContact O-N 3.33Å
95E89.9Confident93.3Very high87 Ų8753.7 Ų53.741%0.40727%0.271SS..Hα-helixtrans-91.9-47.5-177.2-162.773.5-165.900112.7A40 C91 K93A40-E95 PolarHBondContact N-OE2 3.3Å; C91-E95 WeakPolarHBondContact O-CB 3.14Å; C91-E95 PolarHBondContact O-N 2.94Å; K93-E95 VanDerWaalsContact C-N 3.32Å; K93-E95 PolarHBondContact O-N 2.64Å
96K90.6Very high93.4Very high163 Ų16355.3 Ų55.371%0.70928%0.277SS*.Hα-helixtrans-106.4-12.3-172.2-62.6-175.8178.7-177.90113.4I92 A98I92-K96 PolarHBondContact O-N 2.89Å; K96-A98 HydrophobicContact CB-CB 4.02Å; K96-A98 PolarHBondContact O-N 3.23Å
97N89.7Confident93.5Very high114 Ų11453.8 Ų53.861%0.6127%0.271SS*.  trans47.428.2-171.6-16125.8000114.2K93K93-N97 WeakPolarHBondContact CE-OD1 3.03Å; K93-N97 PolarHBondContact NZ-OD1 2.91Å; K93-N97 WeakPolarHBondContact O-CA 3.41Å; K93-N97 PolarHBondContact O-N 3.45Å
98A90.2Very high93.5Very high73 Ų7354.3 Ų54.360%0.60327%0.274SS*.  trans-86.8-13.8-168.300000114.2K96K96-A98 HydrophobicContact CB-CB 4.02Å; K96-A98 PolarHBondContact O-N 3.23Å
99L93.4Very high93.5Very high48 Ų4854.3 Ų54.325%0.25127%0.271SS..SBendtrans-113.6152.9-176.7-60.5176.6000110F89 I92 K93 V104F89-L99 HydrophobicContact CD1-CD1 4.44Å; I92-L99 HydrophobicContact CB-CD1 4.29Å; I92-L99 HydrophobicContact CG2-CD1 3.85Å; I92-L99 HydrophobicContact CG2-CG 4.17Å; K93-L99 WeakPolarHBondContact CD-O 3.35Å; K93-L99 VanDerWaalsContact CE-O 3.23Å; K93-L99 WeakPolarHBondContact CE-O 3.38Å; K93-L99 PolarHBondContact NZ-O 3.06Å; L99-V104 HydrophobicContact CB-CG2 4.33Å
100N94.3Very high93.4Very high71 Ų7154.5 Ų54.538%0.3828%0.279SS..  trans-80.9154.2167.8-65.1-26.8000110.1Y102 V103 V104N100-Y102 VanDerWaalsContact C-N 3.33Å; N100-Y102 HydrophobicContact CB-CD1 3.55Å; N100-Y102 HydrophobicContact CB-CE1 3.19Å; N100-Y102 HydrophobicContact CB-CG 4.43Å; N100-Y102 VanDerWaalsContact ND2-CE1 3.31Å; N100-Y102 WeakPolarHBondContact ND2-CE1 3.29Å; N100-Y102 PolarHBondContact ND2-OH 2.95Å; N100-Y102 PolarHBondContact O-N 2.9Å; N100-V103 HydrophobicContact CB-CG2 4.5Å; N100-V103 WeakPolarHBondContact O-CB 3.46Å; N100-V103 PolarHBondContact O-N 3.23Å; N100-V103 VanDerWaalsContact O-N 3.12Å; N100-V104 PolarHBondContact O-N 3.47Å
101W95.5Very high93.3Very high52 Ų5254.2 Ų54.220%0.19728%0.277CS..Hα-helixtrans-61.3-39.7-178.8-68102.8000112L90 K93 V103 V104 F105 L149 D150L90-W101 HydrophobicContact CD1-CZ3 3.89Å; K93-W101 HydrophobicContact CG-CD2 4.33Å; K93-W101 HydrophobicContact CG-CE3 4.21Å; K93-W101 HydrophobicContact CG-CH2 3.96Å; K93-W101 HydrophobicContact CG-CZ2 4.09Å; K93-W101 HydrophobicContact CG-CZ3 4.02Å; W101-V103 PolarHBondContact O-N 3.18Å; W101-V103 VanDerWaalsContact O-N 3.12Å; W101-V104 WeakPolarHBondContact O-CA 3.19Å; W101-V104 WeakPolarHBondContact O-CB 3.4Å; W101-V104 PolarHBondContact O-N 3.1Å; W101-F105 HydrophobicContact CB-CD2 4.43Å; W101-F105 HydrophobicContact CE3-CE2 4.14Å; W101-F105 VanDerWaalsContact O-CD2 3.25Å; W101-F105 WeakPolarHBondContact O-CD2 3.48Å; W101-F105 PolarHBondContact O-N 2.99Å; W101-L149 HydrophobicContact CB-CB 3.87Å; W101-L149 VanDerWaalsContact CD1-CB 3.45Å; W101-L149 HydrophobicContact CD2-CB 3.83Å; W101-L149 HydrophobicContact CD2-CD1 3.96Å; W101-L149 HydrophobicContact CD2-CG 4.4Å; W101-L149 HydrophobicContact CE3-CD1 3.94Å; W101-L149 HydrophobicContact CG-CB 3.45Å; W101-L149 VanDerWaalsContact CG-CB 3.45Å; W101-L149 HydrophobicContact CG-CD1 4.28Å; W101-L149 HydrophobicContact CG-CG 4.45Å; W101-L149 HydrophobicContact CZ3-CD1 4.4Å; W101-L149 PolarHBondContact NE1-O 3.41Å; W101-D150 WeakPolarHBondContact CA-OD2 3.39Å; W101-D150 WeakPolarHBondContact CB-OD1 3.42Å; W101-D150 WeakPolarHBondContact CB-OD2 3.28Å; W101-D150 VanDerWaalsContact N-CG 3.3Å; W101-D150 PolarHBondContact N-OD1 3.29Å; W101-D150 PolarHBondContact N-OD2 2.96Å; W101-D150 VanDerWaalsContact N-OD2 3.1Å
102Y93.2Very high93.3Very high92 Ų9254.2 Ų54.236%0.36128%0.278SS..Hα-helixtrans-56.1-33.417670.8-98.7000113N100 F105 I106 D150 Y152N100-Y102 VanDerWaalsContact C-N 3.33Å; N100-Y102 HydrophobicContact CB-CD1 3.55Å; N100-Y102 HydrophobicContact CB-CE1 3.19Å; N100-Y102 HydrophobicContact CB-CG 4.43Å; N100-Y102 VanDerWaalsContact ND2-CE1 3.31Å; N100-Y102 WeakPolarHBondContact ND2-CE1 3.29Å; N100-Y102 PolarHBondContact ND2-OH 2.95Å; N100-Y102 PolarHBondContact O-N 2.9Å; Y102-F105 PolarHBondContact O-N 3.16Å; Y102-I106 WeakPolarHBondContact O-CG1 3.15Å; Y102-I106 PolarHBondContact O-N 3.27Å; Y102-D150 WeakPolarHBondContact CD1-OD2 3.38Å; Y102-D150 PolarHBondContact N-OD2 3.33Å; Y102-Y152 HydrophobicContact CD1-CE2 4.17Å; Y102-Y152 HydrophobicContact CE1-CE2 4.41Å
103V95.1Very high93.1Very high34 Ų3455.7 Ų55.721%0.20629%0.288CS..Hα-helixtrans-69.5-43.4175-177.80000110.5N100 W101 F105 I106N100-V103 HydrophobicContact CB-CG2 4.5Å; N100-V103 WeakPolarHBondContact O-CB 3.46Å; N100-V103 PolarHBondContact O-N 3.23Å; N100-V103 VanDerWaalsContact O-N 3.12Å; W101-V103 PolarHBondContact O-N 3.18Å; W101-V103 VanDerWaalsContact O-N 3.12Å; V103-F105 PolarHBondContact O-N 3.3Å; V103-I106 HydrophobicContact CB-CD1 4.38Å; V103-I106 HydrophobicContact CG1-CD1 4.12Å; V103-I106 WeakPolarHBondContact O-CB 3.26Å; V103-I106 WeakPolarHBondContact O-CG1 3.4Å; V103-I106 PolarHBondContact O-N 3.01Å; V103-I106 VanDerWaalsContact O-N 3.16Å
104V96Very high92.8Very high0 Ų056.4 Ų56.40%029%0.293CS..Hα-helixtrans-58.6-38.2177.2179.40000110.9F86 F89 L90 K93 L99 N100 W101 P107F86-V104 HydrophobicContact CD2-CG1 4.29Å; F86-V104 VanDerWaalsContact CD2-O 3.3Å; F86-V104 WeakPolarHBondContact CD2-O 3.42Å; F86-V104 HydrophobicContact CE2-CG1 3.98Å; F89-V104 HydrophobicContact CB-CB 4.3Å; F89-V104 HydrophobicContact CB-CG1 4.06Å; F89-V104 HydrophobicContact CB-CG2 4.29Å; L90-V104 HydrophobicContact CB-CG1 4.23Å; L90-V104 HydrophobicContact CD1-CG1 4.32Å; K93-V104 HydrophobicContact CB-CG2 3.77Å; K93-V104 HydrophobicContact CG-CG2 4.11Å; L99-V104 HydrophobicContact CB-CG2 4.33Å; N100-V104 PolarHBondContact O-N 3.47Å; W101-V104 WeakPolarHBondContact O-CA 3.19Å; W101-V104 WeakPolarHBondContact O-CB 3.4Å; W101-V104 PolarHBondContact O-N 3.1Å; V104-P107 VanDerWaalsContact O-CD 3.26Å; V104-P107 WeakPolarHBondContact O-CD 3.18Å
105F95.8Very high92.6Very high23 Ų2353 Ų5310%0.10128%0.275CS..THydrogen-bonded Turntrans-80.9-7.8-179.8-79.3-85000115F86 W101 Y102 V103 P107 I108 Y109 V142 I145 A146 L149F86-F105 HydrophobicContact CE2-CD1 4.27Å; F86-F105 HydrophobicContact CE2-CE1 4.3Å; W101-F105 HydrophobicContact CB-CD2 4.43Å; W101-F105 HydrophobicContact CE3-CE2 4.14Å; W101-F105 VanDerWaalsContact O-CD2 3.25Å; W101-F105 WeakPolarHBondContact O-CD2 3.48Å; W101-F105 PolarHBondContact O-N 2.99Å; Y102-F105 PolarHBondContact O-N 3.16Å; V103-F105 PolarHBondContact O-N 3.3Å; F105-P107 VanDerWaalsContact C-CD 3.47Å; F105-I108 HydrophobicContact CD1-CD1 3.84Å; F105-I108 HydrophobicContact CE1-CD1 4.09Å; F105-I108 WeakPolarHBondContact O-CA 3.48Å; F105-I108 WeakPolarHBondContact O-CB 3.48Å; F105-I108 PolarHBondContact O-N 3.36Å; F105-Y109 HydrophobicContact CB-CE1 4.05Å; F105-Y109 HydrophobicContact CB-CE2 4.05Å; F105-Y109 PolarHBondContact O-N 3.37Å; F105-V142 HydrophobicContact CD1-CG1 3.51Å; F105-V142 HydrophobicContact CE1-CG1 4.09Å; F105-V142 HydrophobicContact CG-CG1 4.38Å; F105-I145 HydrophobicContact CE2-CG2 4.48Å; F105-I145 HydrophobicContact CZ-CG2 3.93Å; F105-A146 HydrophobicContact CB-CB 4.06Å; F105-A146 HydrophobicContact CD2-CB 3.5Å; F105-A146 HydrophobicContact CE2-CB 4.13Å; F105-A146 HydrophobicContact CG-CB 3.85Å; F105-L149 HydrophobicContact CE2-CD1 3.77Å; F105-L149 HydrophobicContact CZ-CD1 4.15Å
106I95.1Very high92.4Very high77 Ų7754.7 Ų54.740%0.39528%0.282SS..Hα-helixtrans-49.6-48.1179.1-68.6172.6000113.1Y102 V103 I108 Y109 C110Y102-I106 WeakPolarHBondContact O-CG1 3.15Å; Y102-I106 PolarHBondContact O-N 3.27Å; V103-I106 HydrophobicContact CB-CD1 4.38Å; V103-I106 HydrophobicContact CG1-CD1 4.12Å; V103-I106 WeakPolarHBondContact O-CB 3.26Å; V103-I106 WeakPolarHBondContact O-CG1 3.4Å; V103-I106 PolarHBondContact O-N 3.01Å; V103-I106 VanDerWaalsContact O-N 3.16Å; I106-I108 PolarHBondContact O-N 3.42Å; I106-Y109 WeakPolarHBondContact O-CB 3.39Å; I106-Y109 PolarHBondContact O-N 2.8Å; I106-Y109 VanDerWaalsContact O-N 3.08Å; I106-C110 PolarHBondContact O-N 2.87Å
107P95.5Very high92.1Very high8 Ų851.3 Ų51.35%0.05227%0.271CS..Hα-helixtrans-64.6-29.9-179-20.234.1000112.8S82 T85 F86 F89 V104 F105 C110 L111S82-P107 WeakPolarHBondContact O-CB 3.32Å; T85-P107 HydrophobicContact CG2-CB 4.31Å; T85-P107 HydrophobicContact CG2-CG 3.6Å; F86-P107 HydrophobicContact CB-CB 4.13Å; F86-P107 HydrophobicContact CB-CG 4.38Å; F89-P107 HydrophobicContact CD2-CG 3.85Å; F89-P107 HydrophobicContact CE2-CG 3.93Å; V104-P107 VanDerWaalsContact O-CD 3.26Å; V104-P107 WeakPolarHBondContact O-CD 3.18Å; F105-P107 VanDerWaalsContact C-CD 3.47Å; P107-C110 WeakPolarHBondContact O-CB 3.49Å; P107-C110 PolarHBondContact O-N 3.45Å; P107-L111 WeakPolarHBondContact O-CG 3.47Å; P107-L111 PolarHBondContact O-N 2.9Å
108I94.2Very high91.6Very high23 Ų2347.5 Ų47.512%0.11825%0.251CS..Hα-helixtrans-71.3-37.9174.1-60.6-178.9000110.5F86 F105 I106 C110 L111 C112 L135 V142F86-I108 HydrophobicContact CB-CG1 4.23Å; F86-I108 HydrophobicContact CD1-CD1 4.04Å; F86-I108 HydrophobicContact CD1-CG1 4.48Å; F86-I108 HydrophobicContact CD2-CD1 3.36Å; F86-I108 HydrophobicContact CD2-CG1 3.62Å; F86-I108 HydrophobicContact CE1-CD1 3.98Å; F86-I108 HydrophobicContact CE2-CD1 3.29Å; F86-I108 HydrophobicContact CE2-CG1 4.09Å; F86-I108 HydrophobicContact CG-CD1 3.75Å; F86-I108 HydrophobicContact CG-CG1 3.84Å; F86-I108 HydrophobicContact CZ-CD1 3.62Å; F105-I108 HydrophobicContact CD1-CD1 3.84Å; F105-I108 HydrophobicContact CE1-CD1 4.09Å; F105-I108 WeakPolarHBondContact O-CA 3.48Å; F105-I108 WeakPolarHBondContact O-CB 3.48Å; F105-I108 PolarHBondContact O-N 3.36Å; I106-I108 PolarHBondContact O-N 3.42Å; I108-C110 VanDerWaalsContact C-N 3.29Å; I108-C110 PolarHBondContact O-N 3.3Å; I108-L111 WeakPolarHBondContact O-CA 3.35Å; I108-L111 WeakPolarHBondContact O-CB 3.16Å; I108-L111 PolarHBondContact O-N 3.09Å; I108-L111 VanDerWaalsContact O-N 3.09Å; I108-C112 PolarHBondContact O-N 3.44Å; I108-C112 PolarHBondContact O-SG 2.89Å; I108-L135 HydrophobicContact CG2-CD1 4.14Å; I108-V142 HydrophobicContact CB-CG1 4.25Å; I108-V142 HydrophobicContact CG2-CG1 3.66Å; I108-V142 HydrophobicContact CG2-CG2 4.12Å
109Y94.3Very high91Very high52 Ų5247.5 Ų47.520%0.20424%0.238CC..Hα-helixtrans-59.8-41.9173-54.7-34.6000111.6F105 I106 L111 C112 V113 L139 V142 I143 A146F105-Y109 HydrophobicContact CB-CE1 4.05Å; F105-Y109 HydrophobicContact CB-CE2 4.05Å; F105-Y109 PolarHBondContact O-N 3.37Å; I106-Y109 WeakPolarHBondContact O-CB 3.39Å; I106-Y109 PolarHBondContact O-N 2.8Å; I106-Y109 VanDerWaalsContact O-N 3.08Å; Y109-L111 VanDerWaalsContact C-N 3.33Å; Y109-L111 PolarHBondContact O-N 3.02Å; Y109-C112 PolarHBondContact O-N 3.49Å; Y109-V113 WeakPolarHBondContact O-CG2 3.27Å; Y109-V113 PolarHBondContact O-N 3.34Å; Y109-L139 HydrophobicContact CD1-CD1 4.05Å; Y109-V142 HydrophobicContact CD1-CG1 4.05Å; Y109-V142 HydrophobicContact CE1-CB 4.32Å; Y109-V142 HydrophobicContact CE1-CG1 3.66Å; Y109-I143 HydrophobicContact CD1-CG1 4.21Å; Y109-I143 HydrophobicContact CE1-CB 4.48Å; Y109-I143 HydrophobicContact CE1-CG1 3.66Å; Y109-A146 WeakPolarHBondContact OH-CB 3.34Å
110C92.7Very high90.1Very high61 Ų6148.7 Ų48.741%0.41225%0.247SC..Hα-helixtrans-58.7-43.6172.7-65.10000111.8I106 P107 I108 C112 V113 L114I106-C110 PolarHBondContact O-N 2.87Å; P107-C110 WeakPolarHBondContact O-CB 3.49Å; P107-C110 PolarHBondContact O-N 3.45Å; I108-C110 VanDerWaalsContact C-N 3.29Å; I108-C110 PolarHBondContact O-N 3.3Å; C110-C112 PolarHBondContact O-N 3.26Å; C110-V113 PolarHBondContact O-N 2.85Å; C110-L114 WeakPolarHBondContact O-CB 3.48Å; C110-L114 VanDerWaalsContact O-CG 3.3Å; C110-L114 WeakPolarHBondContact O-CG 3.49Å; C110-L114 PolarHBondContact O-N 3.49Å
111L92.4Very high88.8Confident19 Ų1953.5 Ų53.510%0.09927%0.265CS..Hα-helixtrans-60.4-42.2174.8-73.1169.8000112.7C79 S82 I83 P107 I108 Y109 L114 G115 L135C79-L111 HydrophobicContact CB-CD2 3.93Å; S82-L111 VanDerWaalsContact CB-CG 3.49Å; I83-L111 HydrophobicContact CG1-CD1 3.79Å; P107-L111 WeakPolarHBondContact O-CG 3.47Å; P107-L111 PolarHBondContact O-N 2.9Å; I108-L111 WeakPolarHBondContact O-CA 3.35Å; I108-L111 WeakPolarHBondContact O-CB 3.16Å; I108-L111 PolarHBondContact O-N 3.09Å; I108-L111 VanDerWaalsContact O-N 3.09Å; Y109-L111 VanDerWaalsContact C-N 3.33Å; Y109-L111 PolarHBondContact O-N 3.02Å; L111-L114 PolarHBondContact O-N 3.02Å; L111-G115 PolarHBondContact O-N 3.01Å; L111-L135 HydrophobicContact CB-CD2 3.68Å; L111-L135 HydrophobicContact CD1-CD2 4.33Å
112C92.3Very high87Confident1 Ų152.3 Ų52.31%0.00727%0.266CS..Hα-helixtrans-63.5-42.8177-65.20000111.8I108 Y109 C110 G115 F116 L135 L139I108-C112 PolarHBondContact O-N 3.44Å; I108-C112 PolarHBondContact O-SG 2.89Å; Y109-C112 PolarHBondContact O-N 3.49Å; C110-C112 PolarHBondContact O-N 3.26Å; C112-G115 PolarHBondContact O-N 3.43Å; C112-F116 PolarHBondContact O-N 2.81Å; C112-L135 PolarHBondContact SG-O 3.42Å; C112-L139 HydrophobicContact CB-CB 3.99Å; C112-L139 HydrophobicContact CB-CD1 3.68Å; C112-L139 HydrophobicContact CB-CD2 4.38Å; C112-L139 HydrophobicContact CB-CG 4.22Å
113V90Very high85.1Confident81 Ų8155.6 Ų55.649%0.49128%0.283SS..Hα-helixtrans-63.4-44.3176.2173.30000110.4Y109 C110 G115 F116 L117Y109-V113 WeakPolarHBondContact O-CG2 3.27Å; Y109-V113 PolarHBondContact O-N 3.34Å; C110-V113 PolarHBondContact O-N 2.85Å; V113-G115 VanDerWaalsContact C-N 3.33Å; V113-G115 PolarHBondContact O-N 3.41Å; V113-F116 PolarHBondContact O-N 3.29Å; V113-F116 VanDerWaalsContact O-N 3.17Å; V113-L117 HydrophobicContact CG1-CD1 4.44Å; V113-L117 WeakPolarHBondContact O-CG 3.29Å; V113-L117 PolarHBondContact O-N 3.02Å
114L88.1Confident83Confident33 Ų3359.7 Ų59.717%0.17331%0.311CS..Hα-helixtrans-58.9-43.1174.6-75175.2000111.9F75 L78 C110 L111 F116 L117 T118F75-L114 HydrophobicContact CD2-CD2 4.49Å; F75-L114 HydrophobicContact CE2-CB 3.91Å; F75-L114 HydrophobicContact CE2-CD2 4.41Å; L78-L114 HydrophobicContact CB-CD1 4.02Å; C110-L114 WeakPolarHBondContact O-CB 3.48Å; C110-L114 VanDerWaalsContact O-CG 3.3Å; C110-L114 WeakPolarHBondContact O-CG 3.49Å; C110-L114 PolarHBondContact O-N 3.49Å; L111-L114 PolarHBondContact O-N 3.02Å; L114-F116 VanDerWaalsContact C-N 3.35Å; L114-F116 PolarHBondContact O-N 3.44Å; L114-L117 PolarHBondContact O-N 3.04Å; L114-T118 PolarHBondContact O-N 2.79Å; L114-T118 VanDerWaalsContact O-N 3.08Å
115G87.1Confident80.7Confident0 Ų066.4 Ų66.40%034%0.343CS..Hα-helixtrans-64.4-35.1174.700000113.5L111 C112 V113 T118 F119L111-G115 PolarHBondContact O-N 3.01Å; C112-G115 PolarHBondContact O-N 3.43Å; V113-G115 VanDerWaalsContact C-N 3.33Å; V113-G115 PolarHBondContact O-N 3.41Å; G115-T118 PolarHBondContact O-N 3.46Å; G115-T118 PolarHBondContact O-OG1 3.46Å; G115-F119 WeakPolarHBondContact O-CB 3.26Å; G115-F119 PolarHBondContact O-N 2.88Å
116F85.7Confident77.9Confident124 Ų12473.4 Ų73.454%0.54438%0.38SS..Hα-helixtrans-68.2-38.1173.3-173.2-96000112.1C112 V113 L114 T118 F119 T120C112-F116 PolarHBondContact O-N 2.81Å; V113-F116 PolarHBondContact O-N 3.29Å; V113-F116 VanDerWaalsContact O-N 3.17Å; L114-F116 VanDerWaalsContact C-N 3.35Å; L114-F116 PolarHBondContact O-N 3.44Å; F116-T118 VanDerWaalsContact C-N 3.32Å; F116-T118 PolarHBondContact O-N 3.12Å; F116-F119 WeakPolarHBondContact O-CB 3.27Å; F116-F119 PolarHBondContact O-N 3.3Å; F116-T120 HydrophobicContact CE1-CG2 4.11Å; F116-T120 HydrophobicContact CZ-CG2 4.41Å; F116-T120 PolarHBondContact O-N 3.12Å; F116-T120 VanDerWaalsContact O-N 3.16Å
117L84.1Confident75.4Confident92 Ų9274.6 Ų74.648%0.48239%0.392SS..Hα-helixtrans-65.6-33.7175.5-67.3175.3000112.4V113 L114 T120V113-L117 HydrophobicContact CG1-CD1 4.44Å; V113-L117 WeakPolarHBondContact O-CG 3.29Å; V113-L117 PolarHBondContact O-N 3.02Å; L114-L117 PolarHBondContact O-N 3.04Å; L117-T120 PolarHBondContact O-OG1 3.07Å
118T79.2Confident72.9Confident33 Ų3379.4 Ų79.420%0.20242%0.42CS..Hα-helixtrans-76.2-33.9172.6570000112.1F75 L114 G115 F116 T120 K121 A122F75-T118 HydrophobicContact CD2-CG2 4.03Å; F75-T118 HydrophobicContact CE1-CG2 3.92Å; F75-T118 HydrophobicContact CE2-CG2 3.33Å; F75-T118 HydrophobicContact CZ-CG2 3.29Å; L114-T118 PolarHBondContact O-N 2.79Å; L114-T118 VanDerWaalsContact O-N 3.08Å; G115-T118 PolarHBondContact O-N 3.46Å; G115-T118 PolarHBondContact O-OG1 3.46Å; F116-T118 VanDerWaalsContact C-N 3.32Å; F116-T118 PolarHBondContact O-N 3.12Å; T118-T120 VanDerWaalsContact C-N 3.33Å; T118-T120 PolarHBondContact O-N 3.5Å; T118-K121 PolarHBondContact O-N 3.19Å; T118-A122 WeakPolarHBondContact O-CB 3.28Å; T118-A122 PolarHBondContact O-N 3.34Å
119F77.3Confident70.7Confident73 Ų7383.9 Ų83.932%0.3244%0.437SS..Hα-helixtrans-55.7-46.3174.7-174.7-102.3000112.1G115 F116 K121 A122 F123 K133G115-F119 WeakPolarHBondContact O-CB 3.26Å; G115-F119 PolarHBondContact O-N 2.88Å; F116-F119 WeakPolarHBondContact O-CB 3.27Å; F116-F119 PolarHBondContact O-N 3.3Å; F119-K121 VanDerWaalsContact C-N 3.35Å; F119-K121 PolarHBondContact O-N 3.02Å; F119-A122 PolarHBondContact O-N 2.92Å; F119-F123 AromaticContact CD1-CE2 3.69Å; F119-F123 HydrophobicContact CD1-CE2 3.69Å; F119-F123 HydrophobicContact CD1-CZ 4.11Å; F119-F123 HydrophobicContact CE1-CE1 4.47Å; F119-F123 AromaticContact CE1-CE2 3.36Å; F119-F123 HydrophobicContact CE1-CE2 3.36Å; F119-F123 AromaticContact CE1-CZ 3.31Å; F119-F123 HydrophobicContact CE1-CZ 3.31Å; F119-F123 HydrophobicContact CE2-CZ 4.38Å; F119-F123 HydrophobicContact CG-CE2 4.48Å; F119-F123 HydrophobicContact CZ-CE1 4.27Å; F119-F123 AromaticContact CZ-CE2 3.92Å; F119-F123 HydrophobicContact CZ-CE2 3.92Å; F119-F123 AromaticContact CZ-CZ 3.47Å; F119-F123 HydrophobicContact CZ-CZ 3.47Å; F119-F123 VanDerWaalsContact CZ-CZ 3.47Å; F119-F123 VanDerWaalsContact O-CD2 3.24Å; F119-F123 WeakPolarHBondContact O-CD2 3.26Å; F119-F123 PolarHBondContact O-N 3.3Å; F119-K133 HydrophobicContact CD2-CD 4.32Å; F119-K133 HydrophobicContact CD2-CG 4.32Å
120T73.8Confident69.4Low73 Ų7385.9 Ų85.945%0.44845%0.451SS..Hα-helixtrans-64.9-34.3178.256.80000113.6F116 L117 T118F116-T120 HydrophobicContact CE1-CG2 4.11Å; F116-T120 HydrophobicContact CZ-CG2 4.41Å; F116-T120 PolarHBondContact O-N 3.12Å; F116-T120 VanDerWaalsContact O-N 3.16Å; L117-T120 PolarHBondContact O-OG1 3.07Å; T118-T120 VanDerWaalsContact C-N 3.33Å; T118-T120 PolarHBondContact O-N 3.5Å
121K67.3Low68.2Low172 Ų17288 Ų8875%0.74847%0.465SS*.Hα-helixtrans-79.3-33.1177-71.9-179.9179.5171.40113.1T118 F119 F123T118-K121 PolarHBondContact O-N 3.19Å; F119-K121 VanDerWaalsContact C-N 3.35Å; F119-K121 PolarHBondContact O-N 3.02Å; K121-F123 VanDerWaalsContact C-N 3.34Å; K121-F123 PolarHBondContact O-N 2.95Å
122A58.8Low67.5Low28 Ų2890.3 Ų90.323%0.23148%0.475CS..Hα-helixtrans-82.9-2.8-17300000114.3T118 F119 C124 E125T118-A122 WeakPolarHBondContact O-CB 3.28Å; T118-A122 PolarHBondContact O-N 3.34Å; F119-A122 PolarHBondContact O-N 2.92Å; A122-C124 PolarHBondContact O-N 2.94Å; A122-E125 CarbonylContact O-C 3.46Å; A122-E125 PolarHBondContact O-N 2.91Å
123F53.2Low66.9Low160 Ų16092.1 Ų92.170%0.70248%0.483SS*.THydrogen-bonded Turntrans-54.7-21.1167.8-83.8-74.4000112.6F119 K121F119-F123 AromaticContact CD1-CE2 3.69Å; F119-F123 HydrophobicContact CD1-CE2 3.69Å; F119-F123 HydrophobicContact CD1-CZ 4.11Å; F119-F123 HydrophobicContact CE1-CE1 4.47Å; F119-F123 AromaticContact CE1-CE2 3.36Å; F119-F123 HydrophobicContact CE1-CE2 3.36Å; F119-F123 AromaticContact CE1-CZ 3.31Å; F119-F123 HydrophobicContact CE1-CZ 3.31Å; F119-F123 HydrophobicContact CE2-CZ 4.38Å; F119-F123 HydrophobicContact CG-CE2 4.48Å; F119-F123 HydrophobicContact CZ-CE1 4.27Å; F119-F123 AromaticContact CZ-CE2 3.92Å; F119-F123 HydrophobicContact CZ-CE2 3.92Å; F119-F123 AromaticContact CZ-CZ 3.47Å; F119-F123 HydrophobicContact CZ-CZ 3.47Å; F119-F123 VanDerWaalsContact CZ-CZ 3.47Å; F119-F123 VanDerWaalsContact O-CD2 3.24Å; F119-F123 WeakPolarHBondContact O-CD2 3.26Å; F119-F123 PolarHBondContact O-N 3.3Å; K121-F123 VanDerWaalsContact C-N 3.34Å; K121-F123 PolarHBondContact O-N 2.95Å
124C50.4Low66.6Low120 Ų12091.8 Ų91.881%0.81148%0.475SS*.THydrogen-bonded Turntrans-89.9-22176.2-120.40000114.9A122A122-C124 PolarHBondContact O-N 2.94Å
125E47.5Very low66.6Low142 Ų14292.7 Ų92.766%0.66448%0.48SS*.  trans-139.389.2-173.1-71.7-178.9-176.300110A122 T127A122-E125 CarbonylContact O-C 3.46Å; A122-E125 PolarHBondContact O-N 2.91Å; E125-T127 PolarHBondContact O-N 3.05Å
126L37.5Very low66.7Low169 Ų16993.5 Ų93.589%0.88549%0.487SS*.  trans-70.968177-156.691.4000110.4
127T42.7Very low66.9Low103 Ų10392.3 Ų92.363%0.63249%0.486SS*.  trans-104.8145.8176.454.50000112E125 Y129E125-T127 PolarHBondContact O-N 3.05Å; T127-Y129 PolarHBondContact O-N 3.2Å
128V42.9Very low67.4Low108 Ų10888.3 Ų88.366%0.65547%0.465SS*.SBendtrans-56.1121.5-169.5-177.80000111
129Y48.1Very low68.1Low118 Ų11889.2 Ų89.246%0.46347%0.468SS..  trans159.178.7140.4-76.9-53.3000110.1V10 K14 T127 C131V10-Y129 WeakPolarHBondContact CG1-OH 3.49Å; K14-Y129 VanDerWaalsContact CE-CE1 3.47Å; K14-Y129 VanDerWaalsContact NZ-CE1 3.29Å; K14-Y129 PolarHBondContact NZ-OH 3.45Å; T127-Y129 PolarHBondContact O-N 3.2Å; Y129-C131 VanDerWaalsContact C-N 3.27Å; Y129-C131 PolarHBondContact O-N 3.46Å; Y129-C131 VanDerWaalsContact O-N 3.12Å
130D65.8Low68.9Low93 Ų9388.7 Ų88.750%0.49747%0.472SS..THydrogen-bonded Turntrans-78.612.6-165.8-61.2-56.3000116.4E132 K133 F134D130-E132 VanDerWaalsContact C-N 3.33Å; D130-E132 PolarHBondContact O-N 3.46Å; D130-K133 PolarHBondContact O-N 2.91Å; D130-K133 WeakPolarHBondContact OD1-CD 3.02Å; D130-K133 IonicContact OD1-NZ 3.8Å; D130-K133 PolarHBondContact OD1-NZ 2.95Å; D130-F134 VanDerWaalsContact O-CB 3.26Å; D130-F134 WeakPolarHBondContact O-CB 3.21Å; D130-F134 PolarHBondContact O-N 3.44Å
131C68.7Low69.9Low106 Ų10685.6 Ų85.672%0.71645%0.453SS*.Hα-helixtrans-64.3-38.9178.1-65.70000112Y129 F134 L135Y129-C131 VanDerWaalsContact C-N 3.27Å; Y129-C131 PolarHBondContact O-N 3.46Å; Y129-C131 VanDerWaalsContact O-N 3.12Å; C131-F134 PolarHBondContact O-N 2.91Å; C131-L135 WeakPolarHBondContact O-CB 3.44Å; C131-L135 PolarHBondContact O-N 2.85Å
132E76.7Confident71.1Confident67 Ų6778.1 Ų78.131%0.31342%0.422SS..Hα-helixtrans-69.7-39.9-179.4-65.3171.2178.600111.7F75 D130 L135 A136F75-E132 VanDerWaalsContact CE1-CD 3.46Å; F75-E132 WeakPolarHBondContact CE1-OE1 3.44Å; F75-E132 WeakPolarHBondContact CE1-OE2 3.3Å; F75-E132 VanDerWaalsContact CZ-OE2 3.29Å; F75-E132 WeakPolarHBondContact CZ-OE2 3.36Å; D130-E132 VanDerWaalsContact C-N 3.33Å; D130-E132 PolarHBondContact O-N 3.46Å; E132-L135 PolarHBondContact O-N 3.02Å; E132-A136 WeakPolarHBondContact O-CB 3.37Å; E132-A136 PolarHBondContact O-N 3.27Å
133K79.5Confident72.9Confident39 Ų3980 Ų8017%0.1743%0.427CS..Hα-helixtrans-67.1-43.9175-59.6179.7-160.8150.60110.5F119 D130 L135 A136 L137F119-K133 HydrophobicContact CD2-CD 4.32Å; F119-K133 HydrophobicContact CD2-CG 4.32Å; D130-K133 PolarHBondContact O-N 2.91Å; D130-K133 WeakPolarHBondContact OD1-CD 3.02Å; D130-K133 IonicContact OD1-NZ 3.8Å; D130-K133 PolarHBondContact OD1-NZ 2.95Å; K133-L135 VanDerWaalsContact C-N 3.31Å; K133-L135 PolarHBondContact O-N 3.26Å; K133-A136 PolarHBondContact O-N 3.19Å; K133-L137 WeakPolarHBondContact O-CB 3.21Å; K133-L137 VanDerWaalsContact O-CG 3.29Å; K133-L137 WeakPolarHBondContact O-CG 3.45Å; K133-L137 PolarHBondContact O-N 3.42Å
134F84.9Confident75Confident74 Ų7474 Ų7433%0.32540%0.403SS..Hα-helixtrans-59.7-43.2175.6-176.4-97.4000111.3D130 C131 N138 F164 I167 M168D130-F134 VanDerWaalsContact O-CB 3.26Å; D130-F134 WeakPolarHBondContact O-CB 3.21Å; D130-F134 PolarHBondContact O-N 3.44Å; C131-F134 PolarHBondContact O-N 2.91Å; F134-N138 VanDerWaalsContact CE1-ND2 3.28Å; F134-N138 WeakPolarHBondContact CE1-ND2 3.11Å; F134-N138 VanDerWaalsContact CZ-ND2 3.27Å; F134-N138 WeakPolarHBondContact CZ-ND2 3.21Å; F134-N138 WeakPolarHBondContact O-CB 3.44Å; F134-N138 PolarHBondContact O-N 3.3Å; F134-N138 VanDerWaalsContact O-N 3.08Å; F134-N138 PolarHBondContact O-ND2 3.4Å; F134-F164 HydrophobicContact CZ-CE2 4.14Å; F134-I167 HydrophobicContact CD2-CG2 4.09Å; F134-I167 HydrophobicContact CE2-CG2 3.7Å; F134-M168 HydrophobicContact CE2-SD 4.22Å; F134-M168 HydrophobicContact CZ-SD 4.14Å
135L87.6Confident77.1Confident52 Ų5270.3 Ų70.327%0.27237%0.374SS..Hα-helixtrans-65.2-43.8176.2-175.462.8000111.9I108 L111 C112 C131 E132 K133 L137 N138 L139 V142I108-L135 HydrophobicContact CG2-CD1 4.14Å; L111-L135 HydrophobicContact CB-CD2 3.68Å; L111-L135 HydrophobicContact CD1-CD2 4.33Å; C112-L135 PolarHBondContact SG-O 3.42Å; C131-L135 WeakPolarHBondContact O-CB 3.44Å; C131-L135 PolarHBondContact O-N 2.85Å; E132-L135 PolarHBondContact O-N 3.02Å; K133-L135 VanDerWaalsContact C-N 3.31Å; K133-L135 PolarHBondContact O-N 3.26Å; L135-L137 PolarHBondContact O-N 2.92Å; L135-N138 CarbonylContact O-C 3.47Å; L135-N138 PolarHBondContact O-N 2.87Å; L135-N138 VanDerWaalsContact O-N 3.11Å; L135-L139 PolarHBondContact O-N 3.35Å; L135-V142 HydrophobicContact CD1-CG2 4.45Å
136A89.6Confident79.4Confident18 Ų1863.5 Ų63.515%0.14934%0.343CS..Hα-helixtrans-60.8-43.3177.300000112.3E132 K133 N138 L139E132-A136 WeakPolarHBondContact O-CB 3.37Å; E132-A136 PolarHBondContact O-N 3.27Å; K133-A136 PolarHBondContact O-N 3.19Å; A136-N138 VanDerWaalsContact C-N 3.25Å; A136-N138 PolarHBondContact O-N 2.9Å; A136-L139 WeakPolarHBondContact O-CB 3.43Å; A136-L139 PolarHBondContact O-N 2.77Å
137L90.3Very high82.2Confident99 Ų9958 Ų5852%0.51831%0.314SS..Hα-helixtrans-64.1-32175-68.9172.8000112K133 L135 L139 P140 I167K133-L137 WeakPolarHBondContact O-CB 3.21Å; K133-L137 VanDerWaalsContact O-CG 3.29Å; K133-L137 WeakPolarHBondContact O-CG 3.45Å; K133-L137 PolarHBondContact O-N 3.42Å; L135-L137 PolarHBondContact O-N 2.92Å; L137-L139 VanDerWaalsContact C-N 3.3Å; L137-L139 PolarHBondContact O-N 3.4Å; L137-P140 WeakPolarHBondContact O-CD 3.35Å; L137-I167 HydrophobicContact CB-CD1 3.8Å; L137-I167 WeakPolarHBondContact O-CD1 3.21Å
138N92.8Very high84.7Confident8 Ų855 Ų554%0.04329%0.291CS..THydrogen-bonded Turntrans-85.39.7177.5-79-74.4000114.2F134 L135 A136 P140 C141 V142 I167F134-N138 VanDerWaalsContact CE1-ND2 3.28Å; F134-N138 WeakPolarHBondContact CE1-ND2 3.11Å; F134-N138 VanDerWaalsContact CZ-ND2 3.27Å; F134-N138 WeakPolarHBondContact CZ-ND2 3.21Å; F134-N138 WeakPolarHBondContact O-CB 3.44Å; F134-N138 PolarHBondContact O-N 3.3Å; F134-N138 VanDerWaalsContact O-N 3.08Å; F134-N138 PolarHBondContact O-ND2 3.4Å; L135-N138 CarbonylContact O-C 3.47Å; L135-N138 PolarHBondContact O-N 2.87Å; L135-N138 VanDerWaalsContact O-N 3.11Å; A136-N138 VanDerWaalsContact C-N 3.25Å; A136-N138 PolarHBondContact O-N 2.9Å; N138-P140 VanDerWaalsContact C-CD 3.49Å; N138-C141 HydrophobicContact CB-CB 4.36Å; N138-C141 WeakPolarHBondContact O-CA 3.46Å; N138-C141 VanDerWaalsContact O-CB 3.25Å; N138-C141 WeakPolarHBondContact O-CB 3.5Å; N138-C141 PolarHBondContact O-N 3.24Å; N138-V142 WeakPolarHBondContact O-CG2 3.43Å; N138-V142 PolarHBondContact O-N 2.92Å; N138-I167 WeakPolarHBondContact OD1-CD1 3.39Å
139L94.1Very high87.1Confident51 Ų5152.4 Ų52.427%0.26727%0.273SS..Hα-helixtrans-51.1-46.1176.817461.8000113.5Y109 C112 L135 A136 L137 C141 V142 I143Y109-L139 HydrophobicContact CD1-CD1 4.05Å; C112-L139 HydrophobicContact CB-CB 3.99Å; C112-L139 HydrophobicContact CB-CD1 3.68Å; C112-L139 HydrophobicContact CB-CD2 4.38Å; C112-L139 HydrophobicContact CB-CG 4.22Å; L135-L139 PolarHBondContact O-N 3.35Å; A136-L139 WeakPolarHBondContact O-CB 3.43Å; A136-L139 PolarHBondContact O-N 2.77Å; L137-L139 VanDerWaalsContact C-N 3.3Å; L137-L139 PolarHBondContact O-N 3.4Å; L139-C141 VanDerWaalsContact C-N 3.26Å; L139-C141 PolarHBondContact O-N 3.02Å; L139-V142 PolarHBondContact O-N 3.08Å; L139-I143 HydrophobicContact CD1-CD1 3.86Å; L139-I143 HydrophobicContact CD1-CG1 4.1Å; L139-I143 HydrophobicContact CG-CD1 3.97Å; L139-I143 WeakPolarHBondContact O-CG1 3.39Å; L139-I143 PolarHBondContact O-N 2.93Å; L139-I143 VanDerWaalsContact O-N 3.09Å
140P94.5Very high89.3Confident63 Ų6348.1 Ų48.141%0.40926%0.258SS..Hα-helixtrans-60.5-36.4177.3-23.334.8000112.8L137 N138 I143 L144 P163L137-P140 WeakPolarHBondContact O-CD 3.35Å; N138-P140 VanDerWaalsContact C-CD 3.49Å; P140-I143 PolarHBondContact O-N 3.1Å; P140-L144 VanDerWaalsContact O-CG 3.29Å; P140-L144 WeakPolarHBondContact O-CG 3.34Å; P140-L144 PolarHBondContact O-N 3.4Å; P140-P163 HydrophobicContact CB-CB 4.13Å; P140-P163 HydrophobicContact CB-CG 3.98Å
141C94.1Very high90.6Very high7 Ų749.1 Ų49.15%0.04726%0.263CS..Hα-helixtrans-64-47.1177-176.40000111.1N138 L139 I143 L144 I145 L161 P163 F164N138-C141 HydrophobicContact CB-CB 4.36Å; N138-C141 WeakPolarHBondContact O-CA 3.46Å; N138-C141 VanDerWaalsContact O-CB 3.25Å; N138-C141 WeakPolarHBondContact O-CB 3.5Å; N138-C141 PolarHBondContact O-N 3.24Å; L139-C141 VanDerWaalsContact C-N 3.26Å; L139-C141 PolarHBondContact O-N 3.02Å; C141-I143 VanDerWaalsContact C-N 3.3Å; C141-I143 PolarHBondContact O-N 3.34Å; C141-L144 PolarHBondContact O-N 3.35Å; C141-I145 WeakPolarHBondContact O-CB 3.29Å; C141-I145 VanDerWaalsContact O-CG1 3.25Å; C141-I145 WeakPolarHBondContact O-CG1 3.35Å; C141-I145 PolarHBondContact O-N 3.37Å; C141-L161 WeakPolarHBondContact SG-CD2 3.3Å; C141-P163 HydrophobicContact CB-CB 4.28Å; C141-F164 HydrophobicContact CB-CB 4.43Å
142V94.4Very high91.8Very high16 Ų1651.2 Ų51.210%0.09726%0.257CS..Hα-helixtrans-59.1-43.1178.1-176.90000111.1F105 I108 Y109 L135 N138 L139 I145 A146F105-V142 HydrophobicContact CD1-CG1 3.51Å; F105-V142 HydrophobicContact CE1-CG1 4.09Å; F105-V142 HydrophobicContact CG-CG1 4.38Å; I108-V142 HydrophobicContact CB-CG1 4.25Å; I108-V142 HydrophobicContact CG2-CG1 3.66Å; I108-V142 HydrophobicContact CG2-CG2 4.12Å; Y109-V142 HydrophobicContact CD1-CG1 4.05Å; Y109-V142 HydrophobicContact CE1-CB 4.32Å; Y109-V142 HydrophobicContact CE1-CG1 3.66Å; L135-V142 HydrophobicContact CD1-CG2 4.45Å; N138-V142 WeakPolarHBondContact O-CG2 3.43Å; N138-V142 PolarHBondContact O-N 2.92Å; L139-V142 PolarHBondContact O-N 3.08Å; V142-I145 PolarHBondContact O-N 3.47Å; V142-A146 PolarHBondContact O-N 3.34Å; V142-A146 VanDerWaalsContact O-N 3.1Å
143I95.5Very high92.7Very high66 Ų6649.3 Ų49.334%0.33825%0.249SC..Hα-helixtrans-63.4-48.3178.2-66167.5000110.9Y109 L139 P140 C141 I145 A146 L147Y109-I143 HydrophobicContact CD1-CG1 4.21Å; Y109-I143 HydrophobicContact CE1-CB 4.48Å; Y109-I143 HydrophobicContact CE1-CG1 3.66Å; L139-I143 HydrophobicContact CD1-CD1 3.86Å; L139-I143 HydrophobicContact CD1-CG1 4.1Å; L139-I143 HydrophobicContact CG-CD1 3.97Å; L139-I143 WeakPolarHBondContact O-CG1 3.39Å; L139-I143 PolarHBondContact O-N 2.93Å; L139-I143 VanDerWaalsContact O-N 3.09Å; P140-I143 PolarHBondContact O-N 3.1Å; C141-I143 VanDerWaalsContact C-N 3.3Å; C141-I143 PolarHBondContact O-N 3.34Å; I143-I145 VanDerWaalsContact C-N 3.34Å; I143-I145 PolarHBondContact O-N 2.95Å; I143-A146 PolarHBondContact O-N 3.44Å; I143-L147 HydrophobicContact CG2-CD1 3.94Å; I143-L147 HydrophobicContact CG2-CG 4.43Å; I143-L147 WeakPolarHBondContact O-CG 3.36Å; I143-L147 PolarHBondContact O-N 2.85Å
144L96.4Very high93.4Very high36 Ų3653.4 Ų53.419%0.18827%0.273CS..Hα-helixtrans-64.6-38.2-179.4-68.7173000112P140 C141 L147 R148 I153 W155 V160 P163P140-L144 VanDerWaalsContact O-CG 3.29Å; P140-L144 WeakPolarHBondContact O-CG 3.34Å; P140-L144 PolarHBondContact O-N 3.4Å; C141-L144 PolarHBondContact O-N 3.35Å; L144-L147 PolarHBondContact O-N 3.02Å; L144-R148 VanDerWaalsContact O-CB 3.29Å; L144-R148 WeakPolarHBondContact O-CB 3.42Å; L144-R148 PolarHBondContact O-N 3.4Å; L144-I153 HydrophobicContact CB-CD1 4.46Å; L144-I153 HydrophobicContact CD2-CD1 3.96Å; L144-W155 HydrophobicContact CD2-CZ3 4.31Å; L144-V160 HydrophobicContact CB-CG1 3.89Å; L144-V160 WeakPolarHBondContact CD1-O 3.19Å; L144-P163 HydrophobicContact CD1-CG 4.02Å
145I95.8Very high93.9Very high41 Ų4156.6 Ų56.621%0.2128%0.283CS..Hα-helixtrans-60.2-47.7174.6-70.4165.5000110.5F105 C141 V142 I143 R148 L149 V160 L161F105-I145 HydrophobicContact CE2-CG2 4.48Å; F105-I145 HydrophobicContact CZ-CG2 3.93Å; C141-I145 WeakPolarHBondContact O-CB 3.29Å; C141-I145 VanDerWaalsContact O-CG1 3.25Å; C141-I145 WeakPolarHBondContact O-CG1 3.35Å; C141-I145 PolarHBondContact O-N 3.37Å; V142-I145 PolarHBondContact O-N 3.47Å; I143-I145 VanDerWaalsContact C-N 3.34Å; I143-I145 PolarHBondContact O-N 2.95Å; I145-R148 PolarHBondContact O-N 2.89Å; I145-L149 HydrophobicContact CG2-CD1 3.75Å; I145-L149 HydrophobicContact CG2-CG 4.36Å; I145-L149 WeakPolarHBondContact O-CB 3.48Å; I145-L149 VanDerWaalsContact O-CG 3.28Å; I145-L149 WeakPolarHBondContact O-CG 3.35Å; I145-L149 PolarHBondContact O-N 3.49Å; I145-V160 HydrophobicContact CG1-CG1 4.1Å; I145-L161 HydrophobicContact CD1-CD2 3.9Å; I145-L161 HydrophobicContact CG1-CD2 4.11Å
146A95.6Very high94.3Very high0 Ų057.4 Ų57.40%029%0.29CS..Hα-helixtrans-61.8-46.1179.700000111.9F105 Y109 V142 I143 R148 L149 D150F105-A146 HydrophobicContact CB-CB 4.06Å; F105-A146 HydrophobicContact CD2-CB 3.5Å; F105-A146 HydrophobicContact CE2-CB 4.13Å; F105-A146 HydrophobicContact CG-CB 3.85Å; Y109-A146 WeakPolarHBondContact OH-CB 3.34Å; V142-A146 PolarHBondContact O-N 3.34Å; V142-A146 VanDerWaalsContact O-N 3.1Å; I143-A146 PolarHBondContact O-N 3.44Å; A146-R148 VanDerWaalsContact C-N 3.31Å; A146-R148 PolarHBondContact O-N 3.12Å; A146-L149 PolarHBondContact O-N 3.32Å; A146-D150 PolarHBondContact O-N 3.01Å; A146-D150 VanDerWaalsContact O-N 3.08Å
147L95.8Very high94.6Very high53 Ų5358 Ų5828%0.27729%0.288SS..Hα-helixtrans-63.3-37.2177.6-69.7174.6000112.4I143 L144 D150 N151 Y152 I153I143-L147 HydrophobicContact CG2-CD1 3.94Å; I143-L147 HydrophobicContact CG2-CG 4.43Å; I143-L147 WeakPolarHBondContact O-CG 3.36Å; I143-L147 PolarHBondContact O-N 2.85Å; L144-L147 PolarHBondContact O-N 3.02Å; L147-D150 PolarHBondContact O-N 2.91Å; L147-N151 PolarHBondContact O-N 3.27Å; L147-Y152 HydrophobicContact CD2-CD2 3.92Å; L147-Y152 HydrophobicContact CD2-CG 4.25Å; L147-Y152 PolarHBondContact O-N 3.27Å; L147-I153 HydrophobicContact CB-CD1 4.07Å; L147-I153 HydrophobicContact CB-CG1 4.05Å
148R95.2Very high94.8Very high41 Ų4156.8 Ų56.816%0.15528%0.284CS..Hα-helixtrans-67.5-43.3176.7179.857.1173.4149.6-7.4111.5L144 I145 A146 D150 N151 I153 N154 W155 W157 V160L144-R148 VanDerWaalsContact O-CB 3.29Å; L144-R148 WeakPolarHBondContact O-CB 3.42Å; L144-R148 PolarHBondContact O-N 3.4Å; I145-R148 PolarHBondContact O-N 2.89Å; A146-R148 VanDerWaalsContact C-N 3.31Å; A146-R148 PolarHBondContact O-N 3.12Å; R148-D150 VanDerWaalsContact C-N 3.26Å; R148-D150 PolarHBondContact O-N 2.88Å; R148-N151 PolarHBondContact O-N 3.05Å; R148-I153 HydrophobicContact CB-CD1 4.19Å; R148-I153 HydrophobicContact CB-CG1 3.97Å; R148-I153 WeakPolarHBondContact CD-O 3.46Å; R148-I153 PolarHBondContact NH1-O 3.16Å; R148-N154 VanDerWaalsContact NH1-CA 3.32Å; R148-W155 PolarHBondContact NE-O 2.91Å; R148-W155 PolarHBondContact NH2-O 3.46Å; R148-W155 VanDerWaalsContact NH2-O 3.12Å; R148-W157 HydrophobicContact CB-CH2 4.18Å; R148-W157 HydrophobicContact CB-CZ3 4.15Å; R148-W157 HydrophobicContact CG-CD2 4.1Å; R148-W157 HydrophobicContact CG-CE3 3.97Å; R148-W157 HydrophobicContact CG-CH2 3.53Å; R148-W157 HydrophobicContact CG-CZ2 3.66Å; R148-W157 HydrophobicContact CG-CZ3 3.68Å; R148-V160 HydrophobicContact CB-CG1 4.29Å; R148-V160 HydrophobicContact CB-CG2 4.01Å; R148-V160 HydrophobicContact CG-CG2 4.04Å
149L94Very high94.9Very high52 Ų5258.9 Ų58.927%0.27230%0.297SS..Hα-helixtrans-64.6-30.7178.2-73.1168.4000112.7W101 F105 I145 A146 N151 W157W101-L149 HydrophobicContact CB-CB 3.87Å; W101-L149 VanDerWaalsContact CD1-CB 3.45Å; W101-L149 HydrophobicContact CD2-CB 3.83Å; W101-L149 HydrophobicContact CD2-CD1 3.96Å; W101-L149 HydrophobicContact CD2-CG 4.4Å; W101-L149 HydrophobicContact CE3-CD1 3.94Å; W101-L149 HydrophobicContact CG-CB 3.45Å; W101-L149 VanDerWaalsContact CG-CB 3.45Å; W101-L149 HydrophobicContact CG-CD1 4.28Å; W101-L149 HydrophobicContact CG-CG 4.45Å; W101-L149 HydrophobicContact CZ3-CD1 4.4Å; W101-L149 PolarHBondContact NE1-O 3.41Å; F105-L149 HydrophobicContact CE2-CD1 3.77Å; F105-L149 HydrophobicContact CZ-CD1 4.15Å; I145-L149 HydrophobicContact CG2-CD1 3.75Å; I145-L149 HydrophobicContact CG2-CG 4.36Å; I145-L149 WeakPolarHBondContact O-CB 3.48Å; I145-L149 VanDerWaalsContact O-CG 3.28Å; I145-L149 WeakPolarHBondContact O-CG 3.35Å; I145-L149 PolarHBondContact O-N 3.49Å; A146-L149 PolarHBondContact O-N 3.32Å; L149-N151 VanDerWaalsContact C-N 3.28Å; L149-W157 HydrophobicContact CD2-CH2 3.81Å; L149-W157 HydrophobicContact CD2-CZ2 4.45Å; L149-W157 HydrophobicContact CG-CH2 4.03Å
150D94.4Very high95.1Very high28 Ų2856.4 Ų56.415%0.1529%0.285CS..THydrogen-bonded Turntrans-83.12.4172.6-78.4-34.9000113.9W101 Y102 A146 L147 R148 Y152W101-D150 WeakPolarHBondContact CA-OD2 3.39Å; W101-D150 WeakPolarHBondContact CB-OD1 3.42Å; W101-D150 WeakPolarHBondContact CB-OD2 3.28Å; W101-D150 VanDerWaalsContact N-CG 3.3Å; W101-D150 PolarHBondContact N-OD1 3.29Å; W101-D150 PolarHBondContact N-OD2 2.96Å; W101-D150 VanDerWaalsContact N-OD2 3.1Å; Y102-D150 WeakPolarHBondContact CD1-OD2 3.38Å; Y102-D150 PolarHBondContact N-OD2 3.33Å; A146-D150 PolarHBondContact O-N 3.01Å; A146-D150 VanDerWaalsContact O-N 3.08Å; L147-D150 PolarHBondContact O-N 2.91Å; R148-D150 VanDerWaalsContact C-N 3.26Å; R148-D150 PolarHBondContact O-N 2.88Å; D150-Y152 HydrophobicContact CB-CD2 3.5Å; D150-Y152 VanDerWaalsContact CB-CD2 3.5Å; D150-Y152 HydrophobicContact CB-CE2 3.72Å; D150-Y152 PolarHBondContact O-N 3.45Å
151N93.2Very high95.1Very high114 Ų11454.4 Ų54.461%0.6127%0.27SS*.THydrogen-bonded Turntrans58.122.4-175.6-55.5-57.5000114.9L147 R148 L149 I153L147-N151 PolarHBondContact O-N 3.27Å; R148-N151 PolarHBondContact O-N 3.05Å; L149-N151 VanDerWaalsContact C-N 3.28Å; N151-I153 VanDerWaalsContact C-N 3.3Å
152Y94.3Very high95.2Very high150 Ų15058 Ų5859%0.58829%0.288SS*.SBendtrans-68.6-33.9170.7-78.2-69.4000111.7Y102 L147 D150Y102-Y152 HydrophobicContact CD1-CE2 4.17Å; Y102-Y152 HydrophobicContact CE1-CE2 4.41Å; L147-Y152 HydrophobicContact CD2-CD2 3.92Å; L147-Y152 HydrophobicContact CD2-CG 4.25Å; L147-Y152 PolarHBondContact O-N 3.27Å; D150-Y152 HydrophobicContact CB-CD2 3.5Å; D150-Y152 VanDerWaalsContact CB-CD2 3.5Å; D150-Y152 HydrophobicContact CB-CE2 3.72Å; D150-Y152 PolarHBondContact O-N 3.45Å
153I95.2Very high95.2Very high27 Ų2758.5 Ų58.514%0.13829%0.292CS..  trans-117.5131.7175.460.3175.6000110L144 L147 R148 N151 W155 V160L144-I153 HydrophobicContact CB-CD1 4.46Å; L144-I153 HydrophobicContact CD2-CD1 3.96Å; L147-I153 HydrophobicContact CB-CD1 4.07Å; L147-I153 HydrophobicContact CB-CG1 4.05Å; R148-I153 HydrophobicContact CB-CD1 4.19Å; R148-I153 HydrophobicContact CB-CG1 3.97Å; R148-I153 WeakPolarHBondContact CD-O 3.46Å; R148-I153 PolarHBondContact NH1-O 3.16Å; N151-I153 VanDerWaalsContact C-N 3.3Å; I153-W155 HydrophobicContact CD1-CE3 4.3Å; I153-V160 HydrophobicContact CD1-CG2 4.05Å
154N93.5Very high95.1Very high125 Ų12556.4 Ų56.467%0.66828%0.28SS*.  trans-97.917.3-179-71.9-29.6000114.2R148R148-N154 VanDerWaalsContact NH1-CA 3.32Å
155W95.1Very high95.1Very high142 Ų14258 Ų5854%0.53828%0.284SS..  trans-70.2156.8-178-58.9-13.4000112.1L144 R148 I153 V159 V160L144-W155 HydrophobicContact CD2-CZ3 4.31Å; R148-W155 PolarHBondContact NE-O 2.91Å; R148-W155 PolarHBondContact NH2-O 3.46Å; R148-W155 VanDerWaalsContact NH2-O 3.12Å; I153-W155 HydrophobicContact CD1-CE3 4.3Å; W155-V159 HydrophobicContact CB-CB 4.29Å; W155-V159 HydrophobicContact CB-CG1 4.19Å; W155-V159 HydrophobicContact CD2-CG1 4.16Å; W155-V159 HydrophobicContact CE3-CG1 3.73Å; W155-V159 HydrophobicContact CG-CG1 4.39Å; W155-V159 HydrophobicContact CZ3-CG1 4.43Å; W155-V160 HydrophobicContact CB-CG2 4.32Å
156T95.5Very high95Very high68 Ų6861.5 Ų61.542%0.41730%0.302SS..  trans-64.3152172.2580000110.5V158 V159 V160 D221T156-V158 PolarHBondContact O-N 2.9Å; T156-V159 PolarHBondContact O-N 2.69Å; T156-V159 WeakPolarHBondContact OG1-CG2 3.33Å; T156-V160 WeakPolarHBondContact O-CG2 3.42Å; T156-V160 PolarHBondContact O-N 3.18Å; T156-V160 VanDerWaalsContact O-N 3.07Å; T156-D221 VanDerWaalsContact CA-OD1 3.31Å; T156-D221 WeakPolarHBondContact CA-OD1 3.48Å; T156-D221 WeakPolarHBondContact CB-OD1 3.33Å
157W96Very high94.8Very high31 Ų3163 Ų6312%0.11731%0.31CS..Hα-helixtrans-63.6-29.6179-70.499.1000112.2R148 L149 V159 V160 L161 I217 L220 D221R148-W157 HydrophobicContact CB-CH2 4.18Å; R148-W157 HydrophobicContact CB-CZ3 4.15Å; R148-W157 HydrophobicContact CG-CD2 4.1Å; R148-W157 HydrophobicContact CG-CE3 3.97Å; R148-W157 HydrophobicContact CG-CH2 3.53Å; R148-W157 HydrophobicContact CG-CZ2 3.66Å; R148-W157 HydrophobicContact CG-CZ3 3.68Å; L149-W157 HydrophobicContact CD2-CH2 3.81Å; L149-W157 HydrophobicContact CD2-CZ2 4.45Å; L149-W157 HydrophobicContact CG-CH2 4.03Å; W157-V159 VanDerWaalsContact C-N 3.29Å; W157-V159 PolarHBondContact O-N 3.35Å; W157-V160 HydrophobicContact CE3-CG1 4.26Å; W157-V160 HydrophobicContact CZ3-CG1 4.49Å; W157-V160 PolarHBondContact O-N 3.3Å; W157-L161 WeakPolarHBondContact O-CG 3.34Å; W157-L161 PolarHBondContact O-N 3.41Å; W157-L161 VanDerWaalsContact O-N 3.12Å; W157-I217 HydrophobicContact CB-CG2 4Å; W157-L220 HydrophobicContact CB-CB 4.21Å; W157-L220 HydrophobicContact CD2-CB 4Å; W157-L220 HydrophobicContact CD2-CD2 3.69Å; W157-L220 HydrophobicContact CD2-CG 4.3Å; W157-L220 HydrophobicContact CE3-CD2 3.83Å; W157-L220 HydrophobicContact CG-CB 3.65Å; W157-L220 HydrophobicContact CG-CD2 4.17Å; W157-L220 HydrophobicContact CG-CG 4.45Å; W157-L220 HydrophobicContact CH2-CD2 4.19Å; W157-L220 HydrophobicContact CZ2-CD2 4.07Å; W157-L220 HydrophobicContact CZ3-CD2 4.08Å; W157-L220 PolarHBondContact NE1-O 2.98Å; W157-D221 PolarHBondContact N-OD1 3.42Å; W157-D221 PolarHBondContact N-OD2 2.91Å
158V95.4Very high94.7Very high73 Ų7360.9 Ų60.944%0.44230%0.298SS..Hα-helixtrans-54.6-45.8169.3179.60000111.4T156 W165 I217 D221T156-V158 PolarHBondContact O-N 2.9Å; V158-W165 PolarHBondContact O-NE1 3.03Å; V158-I217 HydrophobicContact CB-CG2 4.29Å; V158-I217 HydrophobicContact CG2-CG2 3.43Å; V158-I217 VanDerWaalsContact CG2-CG2 3.43Å; V158-D221 PolarHBondContact N-OD2 3.46Å
159V95.7Very high94.6Very high52 Ų5260.5 Ų60.532%0.31531%0.307SS..Hα-helixtrans-72.6-41.6-178.5173.30000111.3W155 T156 W157 L161 I162W155-V159 HydrophobicContact CB-CB 4.29Å; W155-V159 HydrophobicContact CB-CG1 4.19Å; W155-V159 HydrophobicContact CD2-CG1 4.16Å; W155-V159 HydrophobicContact CE3-CG1 3.73Å; W155-V159 HydrophobicContact CG-CG1 4.39Å; W155-V159 HydrophobicContact CZ3-CG1 4.43Å; T156-V159 PolarHBondContact O-N 2.69Å; T156-V159 WeakPolarHBondContact OG1-CG2 3.33Å; W157-V159 VanDerWaalsContact C-N 3.29Å; W157-V159 PolarHBondContact O-N 3.35Å; V159-L161 PolarHBondContact O-N 2.92Å; V159-I162 HydrophobicContact CB-CD1 4.13Å; V159-I162 HydrophobicContact CG1-CD1 3.75Å; V159-I162 HydrophobicContact CG2-CD1 4.42Å; V159-I162 WeakPolarHBondContact O-CB 3.32Å; V159-I162 VanDerWaalsContact O-CD1 3.26Å; V159-I162 WeakPolarHBondContact O-CD1 3.44Å; V159-I162 WeakPolarHBondContact O-CG1 3.32Å; V159-I162 PolarHBondContact O-N 2.94Å; V159-I162 VanDerWaalsContact O-N 3.12Å
160V96.6Very high94.5Very high0 Ų065 Ų650%033%0.325CS..Hα-helixtrans-57.3-33177.1168.60000111.7L144 I145 R148 I153 W155 T156 W157L144-V160 HydrophobicContact CB-CG1 3.89Å; L144-V160 WeakPolarHBondContact CD1-O 3.19Å; I145-V160 HydrophobicContact CG1-CG1 4.1Å; R148-V160 HydrophobicContact CB-CG1 4.29Å; R148-V160 HydrophobicContact CB-CG2 4.01Å; R148-V160 HydrophobicContact CG-CG2 4.04Å; I153-V160 HydrophobicContact CD1-CG2 4.05Å; W155-V160 HydrophobicContact CB-CG2 4.32Å; T156-V160 WeakPolarHBondContact O-CG2 3.42Å; T156-V160 PolarHBondContact O-N 3.18Å; T156-V160 VanDerWaalsContact O-N 3.07Å; W157-V160 HydrophobicContact CE3-CG1 4.26Å; W157-V160 HydrophobicContact CZ3-CG1 4.49Å; W157-V160 PolarHBondContact O-N 3.3Å
161L96.1Very high94.3Very high21 Ų2166.8 Ų66.811%0.1133%0.334CS..THydrogen-bonded Turntrans-94.910.3-178.5-65.3171.6000114.3C141 I145 W157 V159 P163 F164 W165 I217C141-L161 WeakPolarHBondContact SG-CD2 3.3Å; I145-L161 HydrophobicContact CD1-CD2 3.9Å; I145-L161 HydrophobicContact CG1-CD2 4.11Å; W157-L161 WeakPolarHBondContact O-CG 3.34Å; W157-L161 PolarHBondContact O-N 3.41Å; W157-L161 VanDerWaalsContact O-N 3.12Å; V159-L161 PolarHBondContact O-N 2.92Å; L161-P163 VanDerWaalsContact C-CD 3.47Å; L161-F164 HydrophobicContact CD2-CB 4.47Å; L161-F164 WeakPolarHBondContact O-CA 3.4Å; L161-F164 WeakPolarHBondContact O-CB 3.37Å; L161-F164 PolarHBondContact O-N 3.4Å; L161-W165 PolarHBondContact O-N 3.38Å; L161-I217 HydrophobicContact CB-CD1 4.42Å; L161-I217 HydrophobicContact CD1-CD1 3.29Å; L161-I217 HydrophobicContact CD1-CG1 3.41Å; L161-I217 VanDerWaalsContact CD1-CG1 3.41Å; L161-I217 HydrophobicContact CG-CD1 4.46Å
162I95.5Very high94.2Very high82 Ų8263.7 Ų63.742%0.42132%0.317SS..Hα-helixtrans-48.5-47.9174.4-71.5163.8000113V159 F164 W165 I166V159-I162 HydrophobicContact CB-CD1 4.13Å; V159-I162 HydrophobicContact CG1-CD1 3.75Å; V159-I162 HydrophobicContact CG2-CD1 4.42Å; V159-I162 WeakPolarHBondContact O-CB 3.32Å; V159-I162 VanDerWaalsContact O-CD1 3.26Å; V159-I162 WeakPolarHBondContact O-CD1 3.44Å; V159-I162 WeakPolarHBondContact O-CG1 3.32Å; V159-I162 PolarHBondContact O-N 2.94Å; V159-I162 VanDerWaalsContact O-N 3.12Å; I162-F164 VanDerWaalsContact C-N 3.27Å; I162-F164 PolarHBondContact O-N 3.38Å; I162-W165 WeakPolarHBondContact O-CB 3.24Å; I162-W165 PolarHBondContact O-N 3.02Å; I162-W165 VanDerWaalsContact O-N 3.15Å; I162-I166 HydrophobicContact CG2-CD1 3.86Å; I162-I166 HydrophobicContact CG2-CG1 4.45Å; I162-I166 WeakPolarHBondContact O-CG1 3.43Å; I162-I166 PolarHBondContact O-N 3.45Å
163P94.8Very high94.2Very high26 Ų2661.2 Ų61.217%0.16932%0.317CS..Hα-helixtrans-61-38.1179.6-22.333.7000112.6P140 C141 L144 L161 I166 I167P140-P163 HydrophobicContact CB-CB 4.13Å; P140-P163 HydrophobicContact CB-CG 3.98Å; C141-P163 HydrophobicContact CB-CB 4.28Å; L144-P163 HydrophobicContact CD1-CG 4.02Å; L161-P163 VanDerWaalsContact C-CD 3.47Å; P163-I166 PolarHBondContact O-N 2.93Å; P163-I167 WeakPolarHBondContact O-CG1 3.47Å; P163-I167 PolarHBondContact O-N 3.29Å
164F93.2Very high94Very high23 Ų2363.8 Ų63.810%0.10133%0.331CS..Hα-helixtrans-67.1-41.1176.4174.6-92.6000111.5F134 C141 L161 I162 I166 I167 M168 F209 V213F134-F164 HydrophobicContact CZ-CE2 4.14Å; C141-F164 HydrophobicContact CB-CB 4.43Å; L161-F164 HydrophobicContact CD2-CB 4.47Å; L161-F164 WeakPolarHBondContact O-CA 3.4Å; L161-F164 WeakPolarHBondContact O-CB 3.37Å; L161-F164 PolarHBondContact O-N 3.4Å; I162-F164 VanDerWaalsContact C-N 3.27Å; I162-F164 PolarHBondContact O-N 3.38Å; F164-I166 VanDerWaalsContact C-N 3.32Å; F164-I166 PolarHBondContact O-N 2.75Å; F164-I167 PolarHBondContact O-N 3.5Å; F164-M168 HydrophobicContact CD1-CG 3.93Å; F164-M168 HydrophobicContact CD2-CG 4.12Å; F164-M168 HydrophobicContact CE1-CB 4.42Å; F164-M168 HydrophobicContact CE1-CG 3.46Å; F164-M168 VanDerWaalsContact CE1-CG 3.46Å; F164-M168 HydrophobicContact CE2-CG 3.69Å; F164-M168 HydrophobicContact CE2-SD 4.07Å; F164-M168 HydrophobicContact CG-CG 4.24Å; F164-M168 HydrophobicContact CZ-CG 3.34Å; F164-M168 HydrophobicContact CZ-SD 3.91Å; F164-M168 WeakPolarHBondContact O-CB 3.48Å; F164-M168 WeakPolarHBondContact O-CG 3.45Å; F164-M168 PolarHBondContact O-N 2.83Å; F164-F209 HydrophobicContact CE2-CE1 4.34Å; F164-F209 AromaticContact CZ-CE1 3.77Å; F164-F209 HydrophobicContact CZ-CE1 3.77Å; F164-F209 HydrophobicContact CZ-CZ 4.37Å; F164-V213 HydrophobicContact CD1-CG1 4.33Å; F164-V213 HydrophobicContact CE1-CB 4.29Å; F164-V213 HydrophobicContact CE1-CG1 3.74Å; F164-V213 HydrophobicContact CE1-CG2 4.01Å; F164-V213 HydrophobicContact CZ-CG2 4.02Å
165W95.3Very high93.8Very high68 Ų6859 Ų5926%0.25831%0.305SS..Hα-helixtrans-60.7-39.8175.9-65.8127.3000113V158 L161 I162 G169 L210 V213 V214 I217V158-W165 PolarHBondContact O-NE1 3.03Å; L161-W165 PolarHBondContact O-N 3.38Å; I162-W165 WeakPolarHBondContact O-CB 3.24Å; I162-W165 PolarHBondContact O-N 3.02Å; I162-W165 VanDerWaalsContact O-N 3.15Å; W165-G169 WeakPolarHBondContact O-CA 3.35Å; W165-G169 PolarHBondContact O-N 3.36Å; W165-L210 HydrophobicContact CZ3-CG 4.22Å; W165-V213 HydrophobicContact CH2-CG1 3.87Å; W165-V213 HydrophobicContact CZ2-CG1 4.35Å; W165-V213 HydrophobicContact CZ3-CG1 4.34Å; W165-V214 HydrophobicContact CH2-CG2 3.53Å; W165-V214 HydrophobicContact CZ2-CG2 4.48Å; W165-V214 HydrophobicContact CZ3-CG2 4.15Å; W165-I217 HydrophobicContact CH2-CD1 3.79Å; W165-I217 HydrophobicContact CZ2-CD1 3.13Å
166I94.4Very high93.6Very high115 Ų11557.6 Ų57.659%0.5931%0.308SS*.Hα-helixtrans-62.8-46.8177.9-64.9163.1000110.2I162 P163 F164 F170I162-I166 HydrophobicContact CG2-CD1 3.86Å; I162-I166 HydrophobicContact CG2-CG1 4.45Å; I162-I166 WeakPolarHBondContact O-CG1 3.43Å; I162-I166 PolarHBondContact O-N 3.45Å; P163-I166 PolarHBondContact O-N 2.93Å; F164-I166 VanDerWaalsContact C-N 3.32Å; F164-I166 PolarHBondContact O-N 2.75Å; I166-F170 WeakPolarHBondContact O-CB 3.3Å; I166-F170 PolarHBondContact O-N 2.98Å
167I92.5Very high93.4Very high33 Ų3360.1 Ų60.117%0.16931%0.313CS..Hα-helixtrans-67.6-45.9-179.3-64.4164.2000110.9F134 L137 N138 P163 F164 F170 L171F134-I167 HydrophobicContact CD2-CG2 4.09Å; F134-I167 HydrophobicContact CE2-CG2 3.7Å; L137-I167 HydrophobicContact CB-CD1 3.8Å; L137-I167 WeakPolarHBondContact O-CD1 3.21Å; N138-I167 WeakPolarHBondContact OD1-CD1 3.39Å; P163-I167 WeakPolarHBondContact O-CG1 3.47Å; P163-I167 PolarHBondContact O-N 3.29Å; F164-I167 PolarHBondContact O-N 3.5Å; I167-F170 PolarHBondContact O-N 3.29Å; I167-L171 WeakPolarHBondContact O-CB 3.24Å; I167-L171 PolarHBondContact O-N 2.87Å
168M91.8Very high93.1Very high8 Ų862.3 Ų62.34%0.03933%0.327CS..Hα-helixtrans-66.4-38.7178.6-71.9-57.8-6400112.2F134 F164 L171 I172 F209F134-M168 HydrophobicContact CE2-SD 4.22Å; F134-M168 HydrophobicContact CZ-SD 4.14Å; F164-M168 HydrophobicContact CD1-CG 3.93Å; F164-M168 HydrophobicContact CD2-CG 4.12Å; F164-M168 HydrophobicContact CE1-CB 4.42Å; F164-M168 HydrophobicContact CE1-CG 3.46Å; F164-M168 VanDerWaalsContact CE1-CG 3.46Å; F164-M168 HydrophobicContact CE2-CG 3.69Å; F164-M168 HydrophobicContact CE2-SD 4.07Å; F164-M168 HydrophobicContact CG-CG 4.24Å; F164-M168 HydrophobicContact CZ-CG 3.34Å; F164-M168 HydrophobicContact CZ-SD 3.91Å; F164-M168 WeakPolarHBondContact O-CB 3.48Å; F164-M168 WeakPolarHBondContact O-CG 3.45Å; F164-M168 PolarHBondContact O-N 2.83Å; M168-L171 PolarHBondContact O-N 3.26Å; M168-I172 WeakPolarHBondContact O-CG1 3.48Å; M168-I172 PolarHBondContact O-N 3.19Å; M168-F209 HydrophobicContact CE-CD1 3.81Å; M168-F209 HydrophobicContact CE-CE1 4.2Å
169G93.4Very high92.7Very high33 Ų3360.3 Ų60.334%0.3431%0.314SS..Hα-helixtrans-60.1-46.9173.900000111.4W165 L171 I172 V173W165-G169 WeakPolarHBondContact O-CA 3.35Å; W165-G169 PolarHBondContact O-N 3.36Å; G169-L171 PolarHBondContact O-N 3.5Å; G169-I172 PolarHBondContact O-N 2.79Å; G169-V173 WeakPolarHBondContact O-CG2 3.35Å; G169-V173 PolarHBondContact O-N 3.45Å
170F92.3Very high92.4Very high147 Ų14761.9 Ų61.965%0.64533%0.327SS*.Hα-helixtrans-59.9-44.6174-178.5-97.8000112.2I166 I167 I172 V173 L174I166-F170 WeakPolarHBondContact O-CB 3.3Å; I166-F170 PolarHBondContact O-N 2.98Å; I167-F170 PolarHBondContact O-N 3.29Å; F170-I172 PolarHBondContact O-N 3.46Å; F170-V173 PolarHBondContact O-N 2.86Å; F170-L174 HydrophobicContact CE1-CD2 4.32Å; F170-L174 VanDerWaalsContact O-CB 3.32Å; F170-L174 WeakPolarHBondContact O-CB 3.37Å; F170-L174 PolarHBondContact O-N 3.14Å
171L90.7Very high91.9Very high64 Ų6467 Ų6734%0.33535%0.352SS..Hα-helixtrans-61.2-43.3178.8-174151.6000112I167 M168 G169 L174 L175 A206I167-L171 WeakPolarHBondContact O-CB 3.24Å; I167-L171 PolarHBondContact O-N 2.87Å; M168-L171 PolarHBondContact O-N 3.26Å; G169-L171 PolarHBondContact O-N 3.5Å; L171-L174 PolarHBondContact O-N 2.98Å; L171-L175 VanDerWaalsContact O-CB 3.28Å; L171-L175 WeakPolarHBondContact O-CB 3.21Å; L171-L175 PolarHBondContact O-N 3.25Å; L171-A206 HydrophobicContact CD2-CB 4.13Å
172I91.8Very high91.3Very high49 Ų4968.1 Ų68.125%0.25136%0.358SS..Hα-helixtrans-66.7-45.2178.7-70.5168.5000110.9M168 G169 F170 L174 L175 L176 A206 L210M168-I172 WeakPolarHBondContact O-CG1 3.48Å; M168-I172 PolarHBondContact O-N 3.19Å; G169-I172 PolarHBondContact O-N 2.79Å; F170-I172 PolarHBondContact O-N 3.46Å; I172-L174 VanDerWaalsContact C-N 3.34Å; I172-L174 PolarHBondContact O-N 3.45Å; I172-L175 PolarHBondContact O-N 3.49Å; I172-L176 VanDerWaalsContact O-CB 3.31Å; I172-L176 WeakPolarHBondContact O-CB 3.4Å; I172-L176 PolarHBondContact O-N 3.38Å; I172-A206 HydrophobicContact CG1-CB 4.49Å; I172-L210 HydrophobicContact CD1-CB 4.49Å; I172-L210 HydrophobicContact CD1-CD1 3.33Å
173V93.6Very high90.7Very high98 Ų9868.1 Ų68.159%0.59436%0.364SS*.Hα-helixtrans-61.5-43.8177.3171.60000110.9G169 F170 L175 L176 F177G169-V173 WeakPolarHBondContact O-CG2 3.35Å; G169-V173 PolarHBondContact O-N 3.45Å; F170-V173 PolarHBondContact O-N 2.86Å; V173-L175 PolarHBondContact O-N 3.29Å; V173-L176 PolarHBondContact O-N 3.48Å; V173-F177 VanDerWaalsContact O-CB 3.29Å; V173-F177 WeakPolarHBondContact O-CB 3.49Å; V173-F177 PolarHBondContact O-N 3.13Å
174L90.4Very high90.1Very high81 Ų8169.8 Ų69.842%0.42439%0.386SS..Hα-helixtrans-60.4-45.9176.5177.161.8000111.4F170 L171 I172 F177 L178F170-L174 HydrophobicContact CE1-CD2 4.32Å; F170-L174 VanDerWaalsContact O-CB 3.32Å; F170-L174 WeakPolarHBondContact O-CB 3.37Å; F170-L174 PolarHBondContact O-N 3.14Å; L171-L174 PolarHBondContact O-N 2.98Å; I172-L174 VanDerWaalsContact C-N 3.34Å; I172-L174 PolarHBondContact O-N 3.45Å; L174-F177 WeakPolarHBondContact O-CB 3.31Å; L174-F177 PolarHBondContact O-N 3.45Å; L174-L178 HydrophobicContact CD1-CD1 4.47Å; L174-L178 HydrophobicContact CG-CD1 4.31Å; L174-L178 VanDerWaalsContact O-CG 3.31Å; L174-L178 WeakPolarHBondContact O-CG 3.47Å; L174-L178 PolarHBondContact O-N 2.88Å
175L90.4Very high89.4Confident25 Ų2574.7 Ų74.713%0.13141%0.413CS..Hα-helixtrans-70-38-177.5-163.967000111.9L171 I172 V173 L178 V179 M199 C202 T203 A206L171-L175 VanDerWaalsContact O-CB 3.28Å; L171-L175 WeakPolarHBondContact O-CB 3.21Å; L171-L175 PolarHBondContact O-N 3.25Å; I172-L175 PolarHBondContact O-N 3.49Å; V173-L175 PolarHBondContact O-N 3.29Å; L175-L178 PolarHBondContact O-N 3.1Å; L175-V179 WeakPolarHBondContact O-CG2 3.41Å; L175-V179 PolarHBondContact O-N 3.34Å; L175-M199 HydrophobicContact CD1-CE 3.51Å; L175-M199 HydrophobicContact CD1-SD 4.33Å; L175-C202 HydrophobicContact CD1-CB 4.32Å; L175-C202 HydrophobicContact CD2-CB 4.15Å; L175-T203 HydrophobicContact CB-CG2 4.13Å; L175-T203 VanDerWaalsContact CD2-CA 3.42Å; L175-T203 HydrophobicContact CD2-CG2 3.51Å; L175-T203 HydrophobicContact CG-CG2 3.39Å; L175-A206 HydrophobicContact CD2-CB 4.28Å
176L91Very high87.9Confident113 Ų11376.3 Ų76.359%0.59244%0.435SS*.Hα-helixtrans-63.5-42.3172-17668.8000111.5I172 V173 V179 C180I172-L176 VanDerWaalsContact O-CB 3.31Å; I172-L176 WeakPolarHBondContact O-CB 3.4Å; I172-L176 PolarHBondContact O-N 3.38Å; V173-L176 PolarHBondContact O-N 3.48Å; L176-V179 PolarHBondContact O-N 3.4Å; L176-C180 WeakPolarHBondContact O-CB 3.29Å; L176-C180 PolarHBondContact O-N 2.96Å
177F91.4Very high86.7Confident121 Ų12181.4 Ų81.453%0.53145%0.446SS..Hα-helixtrans-59.7-45.4174.8173.5-101.2000111.3V173 L174 V179 C180 M181V173-F177 VanDerWaalsContact O-CB 3.29Å; V173-F177 WeakPolarHBondContact O-CB 3.49Å; V173-F177 PolarHBondContact O-N 3.13Å; L174-F177 WeakPolarHBondContact O-CB 3.31Å; L174-F177 PolarHBondContact O-N 3.45Å; F177-V179 PolarHBondContact O-N 3.44Å; F177-C180 PolarHBondContact O-N 3.36Å; F177-M181 HydrophobicContact CD1-CG 4.31Å; F177-M181 HydrophobicContact CD2-CG 4.34Å; F177-M181 HydrophobicContact CE1-CG 3.88Å; F177-M181 HydrophobicContact CE2-CG 3.9Å; F177-M181 HydrophobicContact CE2-SD 4.09Å; F177-M181 HydrophobicContact CZ-CG 3.65Å; F177-M181 HydrophobicContact CZ-SD 3.95Å; F177-M181 WeakPolarHBondContact O-CG 3.45Å; F177-M181 PolarHBondContact O-N 2.97Å
178L88.6Confident85.4Confident77 Ų7784.8 Ų84.840%0.40346%0.46SS..Hα-helixtrans-63.1-41.6176.9-68.8169.2000112.2L174 L175 M181 L182 M199L174-L178 HydrophobicContact CD1-CD1 4.47Å; L174-L178 HydrophobicContact CG-CD1 4.31Å; L174-L178 VanDerWaalsContact O-CG 3.31Å; L174-L178 WeakPolarHBondContact O-CG 3.47Å; L174-L178 PolarHBondContact O-N 2.88Å; L175-L178 PolarHBondContact O-N 3.1Å; L178-M181 PolarHBondContact O-N 2.85Å; L178-L182 WeakPolarHBondContact O-CB 3.31Å; L178-L182 PolarHBondContact O-N 2.99Å; L178-M199 HydrophobicContact CB-CE 3.42Å; L178-M199 VanDerWaalsContact CB-CE 3.42Å; L178-M199 HydrophobicContact CD1-CE 3.75Å; L178-M199 HydrophobicContact CG-CE 4.22Å
179V88.3Confident84.3Confident30 Ų3088 Ų8818%0.18248%0.48CS..Hα-helixtrans-63.2-41.8174.5170.30000111.3L175 L176 F177 L182 C183 M199 T203L175-V179 WeakPolarHBondContact O-CG2 3.41Å; L175-V179 PolarHBondContact O-N 3.34Å; L176-V179 PolarHBondContact O-N 3.4Å; F177-V179 PolarHBondContact O-N 3.44Å; V179-L182 PolarHBondContact O-N 3.16Å; V179-C183 VanDerWaalsContact O-CB 3.29Å; V179-C183 WeakPolarHBondContact O-CB 3.37Å; V179-C183 PolarHBondContact O-N 3.17Å; V179-M199 HydrophobicContact CG2-CB 3.88Å; V179-T203 HydrophobicContact CG2-CG2 3.68Å
180C88.2Confident83.1Confident86 Ų8695 Ų9558%0.58150%0.504SS*.Hα-helixtrans-63.5-46.1177.8-176.30000111.9L176 F177 L182 C183 G184L176-C180 WeakPolarHBondContact O-CB 3.29Å; L176-C180 PolarHBondContact O-N 2.96Å; F177-C180 PolarHBondContact O-N 3.36Å; C180-L182 VanDerWaalsContact C-N 3.31Å; C180-L182 PolarHBondContact O-N 2.95Å; C180-C183 PolarHBondContact O-N 3.48Å; C180-G184 PolarHBondContact O-N 2.95Å
181M86.4Confident82Confident108 Ų10895.6 Ų95.653%0.53251%0.506SS..Hα-helixtrans-59.9-42.1176.3-73.1-63.9-66.900112F177 L178 G184 L185F177-M181 HydrophobicContact CD1-CG 4.31Å; F177-M181 HydrophobicContact CD2-CG 4.34Å; F177-M181 HydrophobicContact CE1-CG 3.88Å; F177-M181 HydrophobicContact CE2-CG 3.9Å; F177-M181 HydrophobicContact CE2-SD 4.09Å; F177-M181 HydrophobicContact CZ-CG 3.65Å; F177-M181 HydrophobicContact CZ-SD 3.95Å; F177-M181 WeakPolarHBondContact O-CG 3.45Å; F177-M181 PolarHBondContact O-N 2.97Å; L178-M181 PolarHBondContact O-N 2.85Å; M181-G184 PolarHBondContact O-N 3.35Å; M181-L185 PolarHBondContact O-N 3.3Å
182L84.2Confident81.1Confident44 Ų4494.8 Ų94.823%0.2350%0.503CS..Hα-helixtrans-71.7-34.7-179.8-165.163.6000112.4L178 V179 C180 D195 I196 M199L178-L182 WeakPolarHBondContact O-CB 3.31Å; L178-L182 PolarHBondContact O-N 2.99Å; V179-L182 PolarHBondContact O-N 3.16Å; C180-L182 VanDerWaalsContact C-N 3.31Å; C180-L182 PolarHBondContact O-N 2.95Å; L182-D195 HydrophobicContact CD2-CB 4.25Å; L182-I196 HydrophobicContact CB-CG1 4.44Å; L182-I196 HydrophobicContact CD1-CG1 4.49Å; L182-I196 HydrophobicContact CD2-CB 4.13Å; L182-I196 HydrophobicContact CD2-CG1 3.36Å; L182-I196 HydrophobicContact CG-CD1 4.27Å; L182-I196 HydrophobicContact CG-CG1 3.47Å; L182-I196 VanDerWaalsContact CG-CG1 3.47Å; L182-M199 HydrophobicContact CD2-CG 4.31Å
183C83Confident80.3Confident82 Ų8296.9 Ų96.955%0.55451%0.514SS*.Hα-helixtrans-72.1-36.3174.8-169.40000112.4V179 C180 L185V179-C183 VanDerWaalsContact O-CB 3.29Å; V179-C183 WeakPolarHBondContact O-CB 3.37Å; V179-C183 PolarHBondContact O-N 3.17Å; C180-C183 PolarHBondContact O-N 3.48Å; C183-L185 VanDerWaalsContact C-N 3.31Å; C183-L185 PolarHBondContact O-N 3.34Å
184G81.1Confident79.5Confident61 Ų6196 Ų9663%0.62950%0.503SS*.Hα-helixtrans-70.3-23.6178.400000114.1C180 M181 S186C180-G184 PolarHBondContact O-N 2.95Å; M181-G184 PolarHBondContact O-N 3.35Å; G184-S186 VanDerWaalsContact C-N 3.28Å; G184-S186 PolarHBondContact O-N 2.93Å
185L78.7Confident79Confident125 Ų12595.9 Ų95.965%0.65450%0.503SS*.  trans-75.281.7172.4-131.874.9000109.2M181 C183 R187M181-L185 PolarHBondContact O-N 3.3Å; C183-L185 VanDerWaalsContact C-N 3.31Å; C183-L185 PolarHBondContact O-N 3.34Å; L185-R187 PolarHBondContact O-N 3.14Å
186S63.1Low78.6Confident103 Ų10396.6 Ų96.672%0.7251%0.506SS*.  trans-65.818.6-17270.40000116.1G184G184-S186 VanDerWaalsContact C-N 3.28Å; G184-S186 PolarHBondContact O-N 2.93Å
187R70.4Confident78.3Confident221 Ų22195.7 Ų95.783%0.83451%0.505SS*.  trans-115.177.1175.9-71-170.8178.6-166.40.6109.4L185 T189L185-R187 PolarHBondContact O-N 3.14Å; R187-T189 PolarHBondContact O-N 3.04Å
188F64.9Low78Confident104 Ų10491.3 Ų91.346%0.45649%0.489SS..  trans-73.7111.8178.3-56.9-61.2000110.9L193 I196F188-L193 HydrophobicContact CB-CD2 4.21Å; F188-L193 HydrophobicContact CG-CD2 4.35Å; F188-I196 HydrophobicContact CD1-CD1 3.32Å; F188-I196 HydrophobicContact CE1-CD1 3.21Å; F188-I196 HydrophobicContact CG-CD1 4.48Å; F188-I196 HydrophobicContact CZ-CD1 4.29Å
189T69.2Low77.9Confident76 Ų7689.7 Ų89.747%0.46648%0.48SS..  trans-85.616215871.50000109.9R187 K191 D192 L193R187-T189 PolarHBondContact O-N 3.04Å; T189-K191 PolarHBondContact O-N 3.1Å; T189-K191 VanDerWaalsContact O-N 3.11Å; T189-D192 WeakPolarHBondContact CA-OD2 3.31Å; T189-D192 VanDerWaalsContact CB-OD2 3.31Å; T189-D192 WeakPolarHBondContact CB-OD2 3.28Å; T189-D192 PolarHBondContact N-OD2 3.28Å; T189-D192 WeakPolarHBondContact O-CB 3.5Å; T189-D192 PolarHBondContact O-N 3.01Å; T189-D192 PolarHBondContact OG1-OD1 2.99Å; T189-D192 PolarHBondContact OG1-OD2 2.68Å; T189-L193 PolarHBondContact O-N 2.85Å
190Q68.1Low77.9Confident179 Ų17992.5 Ų92.584%0.83649%0.494SS*.Hα-helixtrans-57.9-27.6-179.6-161-169.91600113
191K68.2Low77.9Confident160 Ų16088.6 Ų88.670%0.69647%0.468SS*.Hα-helixtrans-70.4-40.1174.3-67.1176.2-176.9167.20111.2T189 L193 H194 D195T189-K191 PolarHBondContact O-N 3.1Å; T189-K191 VanDerWaalsContact O-N 3.11Å; K191-L193 VanDerWaalsContact C-N 3.33Å; K191-L193 PolarHBondContact O-N 3.16Å; K191-H194 PolarHBondContact O-N 3.19Å; K191-D195 PolarHBondContact O-N 3.36Å
192D71.4Confident78Confident48 Ų4885.8 Ų85.826%0.25746%0.458SS..Hα-helixtrans-66.4-34.7-179.6-51.7-37.9000111.8T189 H194 D195 I196T189-D192 WeakPolarHBondContact CA-OD2 3.31Å; T189-D192 VanDerWaalsContact CB-OD2 3.31Å; T189-D192 WeakPolarHBondContact CB-OD2 3.28Å; T189-D192 PolarHBondContact N-OD2 3.28Å; T189-D192 WeakPolarHBondContact O-CB 3.5Å; T189-D192 PolarHBondContact O-N 3.01Å; T189-D192 PolarHBondContact OG1-OD1 2.99Å; T189-D192 PolarHBondContact OG1-OD2 2.68Å; D192-H194 VanDerWaalsContact C-N 3.3Å; D192-H194 PolarHBondContact O-N 3.47Å; D192-D195 PolarHBondContact O-N 3.26Å; D192-I196 WeakPolarHBondContact O-CD1 3.29Å; D192-I196 WeakPolarHBondContact O-CG1 3.38Å; D192-I196 PolarHBondContact O-N 2.98Å
193L76.1Confident78.2Confident93 Ų9385.1 Ų85.149%0.48746%0.456SS..Hα-helixtrans-59.8-39.5175.5-69.6179.5000112.5F188 T189 K191 I196 V197F188-L193 HydrophobicContact CB-CD2 4.21Å; F188-L193 HydrophobicContact CG-CD2 4.35Å; T189-L193 PolarHBondContact O-N 2.85Å; K191-L193 VanDerWaalsContact C-N 3.33Å; K191-L193 PolarHBondContact O-N 3.16Å; L193-I196 PolarHBondContact O-N 2.88Å; L193-V197 WeakPolarHBondContact O-CB 3.35Å; L193-V197 VanDerWaalsContact O-CG2 3.23Å; L193-V197 WeakPolarHBondContact O-CG2 3.45Å; L193-V197 PolarHBondContact O-N 2.94Å
194H76Confident78.6Confident79 Ų7984 Ų8437%0.36645%0.449SS..Hα-helixtrans-66.1-43.4176.6171.9-85.3000111.2K191 D192 I196 V197 S198 L252K191-H194 PolarHBondContact O-N 3.19Å; D192-H194 VanDerWaalsContact C-N 3.3Å; D192-H194 PolarHBondContact O-N 3.47Å; H194-I196 VanDerWaalsContact C-N 3.29Å; H194-I196 PolarHBondContact O-N 3.3Å; H194-V197 PolarHBondContact O-N 2.9Å; H194-S198 VanDerWaalsContact O-CB 3.31Å; H194-S198 WeakPolarHBondContact O-CB 3.32Å; H194-S198 PolarHBondContact O-N 3.37Å; H194-L252 VanDerWaalsContact NE2-CD1 3.34Å; H194-L252 WeakPolarHBondContact NE2-CD1 3.48Å
195D80.3Confident79.2Confident79 Ų7982.3 Ų82.342%0.42243%0.425SS..Hα-helixtrans-64.9-37.8179-66.4-15.4000110.6L182 K191 D192 S198 M199L182-D195 HydrophobicContact CD2-CB 4.25Å; K191-D195 PolarHBondContact O-N 3.36Å; D192-D195 PolarHBondContact O-N 3.26Å; D195-S198 PolarHBondContact O-N 2.92Å; D195-M199 VanDerWaalsContact O-CB 3.28Å; D195-M199 WeakPolarHBondContact O-CB 3.47Å; D195-M199 WeakPolarHBondContact O-CG 3.22Å; D195-M199 PolarHBondContact O-N 3.3Å
196I82Confident79.8Confident40 Ų4077 Ų7721%0.20540%0.399CS..Hα-helixtrans-61.6-49.1172-66.4160.9000111.2L182 F188 D192 L193 H194 S198 M199 I200L182-I196 HydrophobicContact CB-CG1 4.44Å; L182-I196 HydrophobicContact CD1-CG1 4.49Å; L182-I196 HydrophobicContact CD2-CB 4.13Å; L182-I196 HydrophobicContact CD2-CG1 3.36Å; L182-I196 HydrophobicContact CG-CD1 4.27Å; L182-I196 HydrophobicContact CG-CG1 3.47Å; L182-I196 VanDerWaalsContact CG-CG1 3.47Å; F188-I196 HydrophobicContact CD1-CD1 3.32Å; F188-I196 HydrophobicContact CE1-CD1 3.21Å; F188-I196 HydrophobicContact CG-CD1 4.48Å; F188-I196 HydrophobicContact CZ-CD1 4.29Å; D192-I196 WeakPolarHBondContact O-CD1 3.29Å; D192-I196 WeakPolarHBondContact O-CG1 3.38Å; D192-I196 PolarHBondContact O-N 2.98Å; L193-I196 PolarHBondContact O-N 2.88Å; H194-I196 VanDerWaalsContact C-N 3.29Å; H194-I196 PolarHBondContact O-N 3.3Å; I196-S198 VanDerWaalsContact C-N 3.31Å; I196-S198 PolarHBondContact O-N 2.99Å; I196-M199 PolarHBondContact O-N 3.5Å; I196-I200 WeakPolarHBondContact O-CG2 3.27Å; I196-I200 PolarHBondContact O-N 3.49Å
197V84.4Confident81.2Confident93 Ų9377.9 Ų77.956%0.56439%0.391SS*.Hα-helixtrans-63.2-38.4179.6171.80000111.5L193 H194 I200 G201L193-V197 WeakPolarHBondContact O-CB 3.35Å; L193-V197 VanDerWaalsContact O-CG2 3.23Å; L193-V197 WeakPolarHBondContact O-CG2 3.45Å; L193-V197 PolarHBondContact O-N 2.94Å; H194-V197 PolarHBondContact O-N 2.9Å; V197-I200 WeakPolarHBondContact O-CG2 3.41Å; V197-G201 PolarHBondContact O-N 3.36Å
198S85.3Confident82.4Confident29 Ų2968.4 Ų68.420%0.20336%0.357CS..Hα-helixtrans-66.7-44.5175.7-175.70000111.2H194 D195 I196 G201 C202H194-S198 VanDerWaalsContact O-CB 3.31Å; H194-S198 WeakPolarHBondContact O-CB 3.32Å; H194-S198 PolarHBondContact O-N 3.37Å; D195-S198 PolarHBondContact O-N 2.92Å; I196-S198 VanDerWaalsContact C-N 3.31Å; I196-S198 PolarHBondContact O-N 2.99Å; S198-G201 PolarHBondContact O-N 3.42Å; S198-C202 PolarHBondContact O-N 2.92Å; S198-C202 PolarHBondContact O-SG 3.25Å
199M86.6Confident83.7Confident43 Ų4366.5 Ų66.521%0.21235%0.349CS..Hα-helixtrans-68.4-43.1-179.7-70.5-63.4-68.600112.4L175 L178 V179 L182 D195 I196 G201 C202 T203L175-M199 HydrophobicContact CD1-CE 3.51Å; L175-M199 HydrophobicContact CD1-SD 4.33Å; L178-M199 HydrophobicContact CB-CE 3.42Å; L178-M199 VanDerWaalsContact CB-CE 3.42Å; L178-M199 HydrophobicContact CD1-CE 3.75Å; L178-M199 HydrophobicContact CG-CE 4.22Å; V179-M199 HydrophobicContact CG2-CB 3.88Å; L182-M199 HydrophobicContact CD2-CG 4.31Å; D195-M199 VanDerWaalsContact O-CB 3.28Å; D195-M199 WeakPolarHBondContact O-CB 3.47Å; D195-M199 WeakPolarHBondContact O-CG 3.22Å; D195-M199 PolarHBondContact O-N 3.3Å; I196-M199 PolarHBondContact O-N 3.5Å; M199-G201 VanDerWaalsContact C-N 3.28Å; M199-G201 PolarHBondContact O-N 2.99Å; M199-C202 PolarHBondContact O-N 3.31Å; M199-T203 PolarHBondContact O-N 3.49Å; M199-T203 PolarHBondContact O-OG1 3.32Å
200I87.6Confident84.9Confident90 Ų9064.9 Ų64.946%0.46234%0.337SS..Hα-helixtrans-62.4-38.9172.4-168.870.6000110.5I196 V197 T203 S204I196-I200 WeakPolarHBondContact O-CG2 3.27Å; I196-I200 PolarHBondContact O-N 3.49Å; V197-I200 WeakPolarHBondContact O-CG2 3.41Å; I200-T203 WeakPolarHBondContact CA-OG1 3.34Å; I200-T203 PolarHBondContact O-N 2.96Å; I200-T203 PolarHBondContact O-OG1 3.49Å; I200-S204 WeakPolarHBondContact O-CB 3.31Å; I200-S204 PolarHBondContact O-N 2.98Å
201G88.5Confident86.2Confident4 Ų459.2 Ų59.24%0.04131%0.312CS..Hα-helixtrans-58.1-50.1172.800000112.2V197 S198 M199 T203 S204 I205V197-G201 PolarHBondContact O-N 3.36Å; S198-G201 PolarHBondContact O-N 3.42Å; M199-G201 VanDerWaalsContact C-N 3.28Å; M199-G201 PolarHBondContact O-N 2.99Å; G201-T203 VanDerWaalsContact C-N 3.34Å; G201-T203 PolarHBondContact O-N 3.32Å; G201-S204 WeakPolarHBondContact O-CB 3.49Å; G201-S204 PolarHBondContact O-N 3.36Å; G201-I205 WeakPolarHBondContact O-CG1 3.34Å; G201-I205 PolarHBondContact O-N 3.25Å
202C88.5Confident87.5Confident49 Ų4952.6 Ų52.633%0.33128%0.283SS..Hα-helixtrans-59.5-41.2175.5-70.90000112.2L175 S198 M199 S204 I205 A206L175-C202 HydrophobicContact CD1-CB 4.32Å; L175-C202 HydrophobicContact CD2-CB 4.15Å; S198-C202 PolarHBondContact O-N 2.92Å; S198-C202 PolarHBondContact O-SG 3.25Å; M199-C202 PolarHBondContact O-N 3.31Å; C202-S204 VanDerWaalsContact C-N 3.35Å; C202-I205 PolarHBondContact O-N 2.86Å; C202-A206 PolarHBondContact O-N 2.92Å
203T89.7Confident88.6Confident29 Ų2950.9 Ų50.918%0.17827%0.274CS..Hα-helixtrans-63.3-41.717654.70000112.2L175 V179 M199 I200 G201 I205 A206 F207L175-T203 HydrophobicContact CB-CG2 4.13Å; L175-T203 VanDerWaalsContact CD2-CA 3.42Å; L175-T203 HydrophobicContact CD2-CG2 3.51Å; L175-T203 HydrophobicContact CG-CG2 3.39Å; V179-T203 HydrophobicContact CG2-CG2 3.68Å; M199-T203 PolarHBondContact O-N 3.49Å; M199-T203 PolarHBondContact O-OG1 3.32Å; I200-T203 WeakPolarHBondContact CA-OG1 3.34Å; I200-T203 PolarHBondContact O-N 2.96Å; I200-T203 PolarHBondContact O-OG1 3.49Å; G201-T203 VanDerWaalsContact C-N 3.34Å; G201-T203 PolarHBondContact O-N 3.32Å; T203-I205 PolarHBondContact O-N 2.87Å; T203-A206 PolarHBondContact O-N 3.22Å; T203-F207 WeakPolarHBondContact O-CB 3.43Å; T203-F207 PolarHBondContact O-N 3.47Å
204S91.1Very high89.5Confident60 Ų6049.2 Ų49.242%0.4227%0.268SS..Hα-helixtrans-63.9-41.2178.4-174.90000111.4I200 G201 C202 F207 T208I200-S204 WeakPolarHBondContact O-CB 3.31Å; I200-S204 PolarHBondContact O-N 2.98Å; G201-S204 WeakPolarHBondContact O-CB 3.49Å; G201-S204 PolarHBondContact O-N 3.36Å; C202-S204 VanDerWaalsContact C-N 3.35Å; S204-F207 PolarHBondContact O-N 2.68Å; S204-T208 WeakPolarHBondContact O-CB 3.43Å; S204-T208 PolarHBondContact O-N 3.42Å; S204-T208 PolarHBondContact O-OG1 2.9Å
205I92.7Very high90.4Very high24 Ų2447 Ų4712%0.12326%0.259CS..Hα-helixtrans-61.5-49.4174-64.1159.9000110.7G201 C202 T203 F207 T208 F209 C238 F241 L242G201-I205 WeakPolarHBondContact O-CG1 3.34Å; G201-I205 PolarHBondContact O-N 3.25Å; C202-I205 PolarHBondContact O-N 2.86Å; T203-I205 PolarHBondContact O-N 2.87Å; I205-F207 VanDerWaalsContact C-N 3.28Å; I205-F207 PolarHBondContact O-N 3.5Å; I205-T208 PolarHBondContact O-N 3.38Å; I205-F209 WeakPolarHBondContact O-CB 3.36Å; I205-F209 PolarHBondContact O-N 3.44Å; I205-C238 HydrophobicContact CG2-CB 4.42Å; I205-F241 HydrophobicContact CD1-CD1 3.43Å; I205-F241 VanDerWaalsContact CD1-CD1 3.43Å; I205-F241 HydrophobicContact CD1-CE1 3.92Å; I205-F241 HydrophobicContact CG1-CB 4.35Å; I205-F241 HydrophobicContact CG1-CD1 3.33Å; I205-F241 HydrophobicContact CG1-CE1 3.96Å; I205-F241 HydrophobicContact CG1-CG 4.19Å; I205-L242 HydrophobicContact CD1-CD2 3.67Å; I205-L242 HydrophobicContact CD1-CG 4.13Å; I205-L242 HydrophobicContact CG2-CD2 4.36Å; I205-L242 HydrophobicContact CG2-CG 4.3Å
206A91.8Very high91.1Very high13 Ų1345.5 Ų45.511%0.10725%0.25CS..Hα-helixtrans-59.7-41.3-178.600000111.6L171 I172 L175 C202 T203 L210L171-A206 HydrophobicContact CD2-CB 4.13Å; I172-A206 HydrophobicContact CG1-CB 4.49Å; L175-A206 HydrophobicContact CD2-CB 4.28Å; C202-A206 PolarHBondContact O-N 2.92Å; T203-A206 PolarHBondContact O-N 3.22Å; A206-L210 PolarHBondContact O-N 2.73Å
207F92.5Very high91.7Very high123 Ų12343.8 Ų43.854%0.53924%0.242SC..Hα-helixtrans-68.1-43.9176.5-171.7-104.2000112.6T203 S204 I205 F209 L210 I211T203-F207 WeakPolarHBondContact O-CB 3.43Å; T203-F207 PolarHBondContact O-N 3.47Å; S204-F207 PolarHBondContact O-N 2.68Å; I205-F207 VanDerWaalsContact C-N 3.28Å; I205-F207 PolarHBondContact O-N 3.5Å; F207-F209 VanDerWaalsContact C-N 3.29Å; F207-F209 PolarHBondContact O-N 2.89Å; F207-L210 WeakPolarHBondContact O-CB 3.37Å; F207-L210 PolarHBondContact O-N 3.43Å; F207-L210 VanDerWaalsContact O-N 3.13Å; F207-I211 HydrophobicContact CD1-CD1 3.81Å; F207-I211 HydrophobicContact CD1-CG1 4.43Å; F207-I211 HydrophobicContact CE1-CD1 3.57Å; F207-I211 HydrophobicContact CE1-CG1 4.21Å; F207-I211 HydrophobicContact CZ-CD1 4.36Å; F207-I211 WeakPolarHBondContact O-CG1 3.43Å; F207-I211 PolarHBondContact O-N 3.26Å
208T94.6Very high92.1Very high22 Ų2241 Ų4114%0.13523%0.226CC..Hα-helixtrans-63.7-37.7177.7-54.40000111.2S204 I205 I211 F212 P234 I237 C238S204-T208 WeakPolarHBondContact O-CB 3.43Å; S204-T208 PolarHBondContact O-N 3.42Å; S204-T208 PolarHBondContact O-OG1 2.9Å; I205-T208 PolarHBondContact O-N 3.38Å; T208-I211 PolarHBondContact O-N 2.84Å; T208-F212 PolarHBondContact O-N 2.87Å; T208-F212 VanDerWaalsContact O-N 3.1Å; T208-P234 HydrophobicContact CG2-CB 3.79Å; T208-P234 VanDerWaalsContact CG2-O 3.29Å; T208-P234 WeakPolarHBondContact CG2-O 3.29Å; T208-I237 HydrophobicContact CG2-CB 4.28Å; T208-I237 HydrophobicContact CG2-CG2 4.2Å; T208-C238 WeakPolarHBondContact CB-SG 3.27Å; T208-C238 WeakPolarHBondContact CG2-SG 3.34Å
209F93.6Very high92.5Very high63 Ų6342.4 Ų42.428%0.27623%0.227SC..Hα-helixtrans-67.1-37.7173.7-178.8-113.1000111.9F164 M168 I205 F207 F212 V213 L235 C238F164-F209 HydrophobicContact CE2-CE1 4.34Å; F164-F209 AromaticContact CZ-CE1 3.77Å; F164-F209 HydrophobicContact CZ-CE1 3.77Å; F164-F209 HydrophobicContact CZ-CZ 4.37Å; M168-F209 HydrophobicContact CE-CD1 3.81Å; M168-F209 HydrophobicContact CE-CE1 4.2Å; I205-F209 WeakPolarHBondContact O-CB 3.36Å; I205-F209 PolarHBondContact O-N 3.44Å; F207-F209 VanDerWaalsContact C-N 3.29Å; F207-F209 PolarHBondContact O-N 2.89Å; F209-F212 HydrophobicContact CD2-CD1 4.1Å; F209-F212 AromaticContact CE2-CD1 3.98Å; F209-F212 HydrophobicContact CE2-CD1 3.98Å; F209-F212 HydrophobicContact CE2-CE1 4.34Å; F209-F212 WeakPolarHBondContact O-CB 3.43Å; F209-F212 PolarHBondContact O-N 2.98Å; F209-V213 HydrophobicContact CD1-CG2 4.48Å; F209-V213 HydrophobicContact CE1-CG2 4.13Å; F209-V213 HydrophobicContact CE2-CG2 4.31Å; F209-V213 HydrophobicContact CZ-CG2 4.02Å; F209-V213 WeakPolarHBondContact O-CG2 3.34Å; F209-V213 PolarHBondContact O-N 3.35Å; F209-L235 HydrophobicContact CD2-CD1 4.21Å; F209-L235 HydrophobicContact CE2-CD1 4.3Å; F209-C238 PolarHBondContact N-SG 3.26Å
210L94.2Very high92.8Very high42 Ų4243.2 Ų43.222%0.2223%0.232CC..Hα-helixtrans-60.1-45.6172.4-174.6155.9000111.1W165 I172 A206 F207 F212 V213 V214W165-L210 HydrophobicContact CZ3-CG 4.22Å; I172-L210 HydrophobicContact CD1-CB 4.49Å; I172-L210 HydrophobicContact CD1-CD1 3.33Å; A206-L210 PolarHBondContact O-N 2.73Å; F207-L210 WeakPolarHBondContact O-CB 3.37Å; F207-L210 PolarHBondContact O-N 3.43Å; F207-L210 VanDerWaalsContact O-N 3.13Å; L210-F212 VanDerWaalsContact C-N 3.31Å; L210-F212 PolarHBondContact O-N 3.21Å; L210-V213 PolarHBondContact O-N 3.48Å; L210-V213 VanDerWaalsContact O-N 3.12Å; L210-V214 HydrophobicContact CD2-CG2 3.64Å; L210-V214 HydrophobicContact CG-CG2 4.49Å; L210-V214 WeakPolarHBondContact O-CG2 3.31Å; L210-V214 PolarHBondContact O-N 3.3Å
211I95Very high93Very high61 Ų6140.5 Ų40.531%0.31322%0.218SC..Hα-helixtrans-56.7-47176.5-66167.1000110.3F207 T208 V213 V214 L215 P234F207-I211 HydrophobicContact CD1-CD1 3.81Å; F207-I211 HydrophobicContact CD1-CG1 4.43Å; F207-I211 HydrophobicContact CE1-CD1 3.57Å; F207-I211 HydrophobicContact CE1-CG1 4.21Å; F207-I211 HydrophobicContact CZ-CD1 4.36Å; F207-I211 WeakPolarHBondContact O-CG1 3.43Å; F207-I211 PolarHBondContact O-N 3.26Å; T208-I211 PolarHBondContact O-N 2.84Å; I211-V213 VanDerWaalsContact C-N 3.34Å; I211-V213 PolarHBondContact O-N 2.89Å; I211-V214 PolarHBondContact O-N 2.88Å; I211-L215 HydrophobicContact CG2-CD1 3.83Å; I211-L215 HydrophobicContact CG2-CG 4.22Å; I211-L215 WeakPolarHBondContact O-CB 3.5Å; I211-L215 VanDerWaalsContact O-CG 3.28Å; I211-L215 WeakPolarHBondContact O-CG 3.31Å; I211-L215 PolarHBondContact O-N 2.92Å; I211-P234 HydrophobicContact CG2-CB 4.45Å; I211-P234 HydrophobicContact CG2-CG 4.08Å
212F95.5Very high93Very high21 Ų2146.6 Ų46.69%0.09225%0.25CC..Hα-helixtrans-54-49.8174.7162.9-106.5000111.8T208 F209 L210 V214 L215 L216 I231 F232 P234 L235T208-F212 PolarHBondContact O-N 2.87Å; T208-F212 VanDerWaalsContact O-N 3.1Å; F209-F212 HydrophobicContact CD2-CD1 4.1Å; F209-F212 AromaticContact CE2-CD1 3.98Å; F209-F212 HydrophobicContact CE2-CD1 3.98Å; F209-F212 HydrophobicContact CE2-CE1 4.34Å; F209-F212 WeakPolarHBondContact O-CB 3.43Å; F209-F212 PolarHBondContact O-N 2.98Å; L210-F212 VanDerWaalsContact C-N 3.31Å; L210-F212 PolarHBondContact O-N 3.21Å; F212-V214 PolarHBondContact O-N 3.34Å; F212-L215 PolarHBondContact O-N 2.92Å; F212-L216 HydrophobicContact CE1-CD2 4.18Å; F212-L216 HydrophobicContact CZ-CD2 3.86Å; F212-L216 VanDerWaalsContact O-CB 3.29Å; F212-L216 WeakPolarHBondContact O-CB 3.47Å; F212-L216 PolarHBondContact O-N 3.38Å; F212-I231 HydrophobicContact CD2-CG2 4.42Å; F212-I231 VanDerWaalsContact CD2-O 3.3Å; F212-I231 WeakPolarHBondContact CD2-O 3.26Å; F212-I231 HydrophobicContact CE2-CG2 4.37Å; F212-F232 HydrophobicContact CE2-CD1 4.39Å; F212-F232 HydrophobicContact CE2-CG 4.48Å; F212-P234 HydrophobicContact CB-CB 4.17Å; F212-L235 HydrophobicContact CB-CB 4.45Å; F212-L235 HydrophobicContact CD1-CB 4.45Å; F212-L235 HydrophobicContact CD1-CD1 4.07Å; F212-L235 HydrophobicContact CD2-CB 3.72Å; F212-L235 HydrophobicContact CD2-CD2 4.44Å; F212-L235 HydrophobicContact CE1-CD1 4.15Å; F212-L235 HydrophobicContact CE1-CD2 4.24Å; F212-L235 HydrophobicContact CE2-CB 4.03Å; F212-L235 HydrophobicContact CE2-CD2 3.94Å; F212-L235 HydrophobicContact CE2-CG 4.49Å; F212-L235 HydrophobicContact CG-CB 3.95Å; F212-L235 HydrophobicContact CG-CD1 4.38Å; F212-L235 HydrophobicContact CZ-CD2 3.82Å
213V95.1Very high93Very high11 Ų1148.5 Ų48.57%0.06726%0.256CS..Hα-helixtrans-63.5-43.3-178.5175.20000111.4F164 W165 F209 L210 I211 L216 I217F164-V213 HydrophobicContact CD1-CG1 4.33Å; F164-V213 HydrophobicContact CE1-CB 4.29Å; F164-V213 HydrophobicContact CE1-CG1 3.74Å; F164-V213 HydrophobicContact CE1-CG2 4.01Å; F164-V213 HydrophobicContact CZ-CG2 4.02Å; W165-V213 HydrophobicContact CH2-CG1 3.87Å; W165-V213 HydrophobicContact CZ2-CG1 4.35Å; W165-V213 HydrophobicContact CZ3-CG1 4.34Å; F209-V213 HydrophobicContact CD1-CG2 4.48Å; F209-V213 HydrophobicContact CE1-CG2 4.13Å; F209-V213 HydrophobicContact CE2-CG2 4.31Å; F209-V213 HydrophobicContact CZ-CG2 4.02Å; F209-V213 WeakPolarHBondContact O-CG2 3.34Å; F209-V213 PolarHBondContact O-N 3.35Å; L210-V213 PolarHBondContact O-N 3.48Å; L210-V213 VanDerWaalsContact O-N 3.12Å; I211-V213 VanDerWaalsContact C-N 3.34Å; I211-V213 PolarHBondContact O-N 2.89Å; V213-L216 PolarHBondContact O-N 3.42Å; V213-I217 HydrophobicContact CG1-CD1 3.59Å; V213-I217 HydrophobicContact CG1-CG1 4.34Å; V213-I217 WeakPolarHBondContact O-CB 3.45Å; V213-I217 VanDerWaalsContact O-CD1 3.32Å; V213-I217 WeakPolarHBondContact O-CD1 3.39Å; V213-I217 WeakPolarHBondContact O-CG1 3.32Å; V213-I217 PolarHBondContact O-N 3.49Å
214V95.4Very high92.6Very high58 Ų5854.7 Ų54.735%0.35228%0.28SS..Hα-helixtrans-59.4-49176.1173.50000110.9W165 L210 I211 F212 L216 I217 C218W165-V214 HydrophobicContact CH2-CG2 3.53Å; W165-V214 HydrophobicContact CZ2-CG2 4.48Å; W165-V214 HydrophobicContact CZ3-CG2 4.15Å; L210-V214 HydrophobicContact CD2-CG2 3.64Å; L210-V214 HydrophobicContact CG-CG2 4.49Å; L210-V214 WeakPolarHBondContact O-CG2 3.31Å; L210-V214 PolarHBondContact O-N 3.3Å; I211-V214 PolarHBondContact O-N 2.88Å; F212-V214 PolarHBondContact O-N 3.34Å; V214-L216 VanDerWaalsContact C-N 3.33Å; V214-L216 PolarHBondContact O-N 3.25Å; V214-I217 PolarHBondContact O-N 3.47Å; V214-C218 PolarHBondContact O-N 3.24Å; V214-C218 PolarHBondContact O-SG 3.49Å; V214-C218 VanDerWaalsContact O-SG 3.34Å
215L95.1Very high92.2Very high34 Ų3457.4 Ų57.418%0.17829%0.289CS..Hα-helixtrans-62.5-41179.7-69.9176.7000112.1I211 F212 I217 C218 R219 F226 I231 P234I211-L215 HydrophobicContact CG2-CD1 3.83Å; I211-L215 HydrophobicContact CG2-CG 4.22Å; I211-L215 WeakPolarHBondContact O-CB 3.5Å; I211-L215 VanDerWaalsContact O-CG 3.28Å; I211-L215 WeakPolarHBondContact O-CG 3.31Å; I211-L215 PolarHBondContact O-N 2.92Å; F212-L215 PolarHBondContact O-N 2.92Å; L215-I217 VanDerWaalsContact C-N 3.34Å; L215-C218 PolarHBondContact O-N 2.88Å; L215-R219 PolarHBondContact O-N 2.68Å; L215-F226 HydrophobicContact CD2-CD2 3.57Å; L215-F226 HydrophobicContact CD2-CE2 3.59Å; L215-F226 HydrophobicContact CD2-CG 4.41Å; L215-F226 HydrophobicContact CD2-CZ 4.45Å; L215-I231 HydrophobicContact CB-CB 4.47Å; L215-I231 HydrophobicContact CB-CG1 4.21Å; L215-I231 HydrophobicContact CB-CG2 4.08Å; L215-P234 HydrophobicContact CD1-CG 4.15Å
216L94Very high92Very high46 Ų4660.4 Ų60.424%0.24130%0.302CS..Hα-helixtrans-60.7-45.7175.9-17765.1000110.6F212 V213 V214 R219 L220 I231F212-L216 HydrophobicContact CE1-CD2 4.18Å; F212-L216 HydrophobicContact CZ-CD2 3.86Å; F212-L216 VanDerWaalsContact O-CB 3.29Å; F212-L216 WeakPolarHBondContact O-CB 3.47Å; F212-L216 PolarHBondContact O-N 3.38Å; V213-L216 PolarHBondContact O-N 3.42Å; V214-L216 VanDerWaalsContact C-N 3.33Å; V214-L216 PolarHBondContact O-N 3.25Å; L216-R219 WeakPolarHBondContact O-CB 3.32Å; L216-R219 PolarHBondContact O-N 3.32Å; L216-L220 HydrophobicContact CD1-CD1 3.59Å; L216-L220 HydrophobicContact CG-CD1 3.88Å; L216-L220 WeakPolarHBondContact O-CB 3.33Å; L216-L220 WeakPolarHBondContact O-CD1 3.37Å; L216-L220 PolarHBondContact O-N 2.9Å; L216-I231 HydrophobicContact CB-CG2 4.16Å; L216-I231 HydrophobicContact CD1-CG2 4.35Å
217I94.7Very high92Very high5 Ų563.2 Ų63.23%0.02632%0.318CS..Hα-helixtrans-63.7-45.5179.8-69.9163.4000111.9W157 V158 L161 W165 V213 V214 L215 R219 L220 D221W157-I217 HydrophobicContact CB-CG2 4Å; V158-I217 HydrophobicContact CB-CG2 4.29Å; V158-I217 HydrophobicContact CG2-CG2 3.43Å; V158-I217 VanDerWaalsContact CG2-CG2 3.43Å; L161-I217 HydrophobicContact CB-CD1 4.42Å; L161-I217 HydrophobicContact CD1-CD1 3.29Å; L161-I217 HydrophobicContact CD1-CG1 3.41Å; L161-I217 VanDerWaalsContact CD1-CG1 3.41Å; L161-I217 HydrophobicContact CG-CD1 4.46Å; W165-I217 HydrophobicContact CH2-CD1 3.79Å; W165-I217 HydrophobicContact CZ2-CD1 3.13Å; V213-I217 HydrophobicContact CG1-CD1 3.59Å; V213-I217 HydrophobicContact CG1-CG1 4.34Å; V213-I217 WeakPolarHBondContact O-CB 3.45Å; V213-I217 VanDerWaalsContact O-CD1 3.32Å; V213-I217 WeakPolarHBondContact O-CD1 3.39Å; V213-I217 WeakPolarHBondContact O-CG1 3.32Å; V213-I217 PolarHBondContact O-N 3.49Å; V214-I217 PolarHBondContact O-N 3.47Å; L215-I217 VanDerWaalsContact C-N 3.34Å; I217-R219 PolarHBondContact O-N 2.88Å; I217-L220 PolarHBondContact O-N 3.35Å; I217-L220 VanDerWaalsContact O-N 3.1Å; I217-D221 WeakPolarHBondContact O-CB 3.49Å; I217-D221 PolarHBondContact O-N 3.42Å
218C93.6Very high91.9Very high35 Ų3561.1 Ų61.124%0.23631%0.307CS..Hα-helixtrans-54.4-43.9175.8-68.80000111V214 L215 D221 I223V214-C218 PolarHBondContact O-N 3.24Å; V214-C218 PolarHBondContact O-SG 3.49Å; V214-C218 VanDerWaalsContact O-SG 3.34Å; L215-C218 PolarHBondContact O-N 2.88Å; C218-D221 PolarHBondContact O-N 3.4Å; C218-I223 HydrophobicContact CB-CB 4.45Å; C218-I223 WeakPolarHBondContact O-CA 3.45Å; C218-I223 VanDerWaalsContact O-CB 3.26Å; C218-I223 WeakPolarHBondContact O-CB 3.33Å; C218-I223 PolarHBondContact O-N 2.96Å
219R92.5Very high91.7Very high57 Ų5763.3 Ų63.322%0.21532%0.317CS..Hα-helixtrans-66.4-42.9177.6-174.767.4179.4-173.53.7112.5L215 L216 I217 D221 N222 F226 Y228 I231L215-R219 PolarHBondContact O-N 2.68Å; L216-R219 WeakPolarHBondContact O-CB 3.32Å; L216-R219 PolarHBondContact O-N 3.32Å; I217-R219 PolarHBondContact O-N 2.88Å; R219-D221 VanDerWaalsContact C-N 3.28Å; R219-D221 PolarHBondContact O-N 3.49Å; R219-N222 PolarHBondContact O-N 2.94Å; R219-N222 VanDerWaalsContact O-N 3.07Å; R219-F226 PolarHBondContact NH1-O 2.9Å; R219-F226 VanDerWaalsContact NH1-O 3.16Å; R219-Y228 HydrophobicContact CG-CE1 3.92Å; R219-I231 HydrophobicContact CB-CD1 3.51Å; R219-I231 HydrophobicContact CG-CD1 3.63Å
220L92.2Very high91.7Very high60 Ų6064.8 Ų64.831%0.31433%0.325SS..Hα-helixtrans-65.1-32178.6-97.969.5000112.1W157 L216 I217 N222W157-L220 HydrophobicContact CB-CB 4.21Å; W157-L220 HydrophobicContact CD2-CB 4Å; W157-L220 HydrophobicContact CD2-CD2 3.69Å; W157-L220 HydrophobicContact CD2-CG 4.3Å; W157-L220 HydrophobicContact CE3-CD2 3.83Å; W157-L220 HydrophobicContact CG-CB 3.65Å; W157-L220 HydrophobicContact CG-CD2 4.17Å; W157-L220 HydrophobicContact CG-CG 4.45Å; W157-L220 HydrophobicContact CH2-CD2 4.19Å; W157-L220 HydrophobicContact CZ2-CD2 4.07Å; W157-L220 HydrophobicContact CZ3-CD2 4.08Å; W157-L220 PolarHBondContact NE1-O 2.98Å; L216-L220 HydrophobicContact CD1-CD1 3.59Å; L216-L220 HydrophobicContact CG-CD1 3.88Å; L216-L220 WeakPolarHBondContact O-CB 3.33Å; L216-L220 WeakPolarHBondContact O-CD1 3.37Å; L216-L220 PolarHBondContact O-N 2.9Å; I217-L220 PolarHBondContact O-N 3.35Å; I217-L220 VanDerWaalsContact O-N 3.1Å; L220-N222 PolarHBondContact O-N 3.38Å
221D92.6Very high91.7Very high34 Ų3462.8 Ų62.818%0.18232%0.315CS..THydrogen-bonded Turntrans-80.115.6171.9-81.4-34.5000113.5T156 W157 V158 I217 C218 R219 I223T156-D221 VanDerWaalsContact CA-OD1 3.31Å; T156-D221 WeakPolarHBondContact CA-OD1 3.48Å; T156-D221 WeakPolarHBondContact CB-OD1 3.33Å; W157-D221 PolarHBondContact N-OD1 3.42Å; W157-D221 PolarHBondContact N-OD2 2.91Å; V158-D221 PolarHBondContact N-OD2 3.46Å; I217-D221 WeakPolarHBondContact O-CB 3.49Å; I217-D221 PolarHBondContact O-N 3.42Å; C218-D221 PolarHBondContact O-N 3.4Å; R219-D221 VanDerWaalsContact C-N 3.28Å; R219-D221 PolarHBondContact O-N 3.49Å; D221-I223 HydrophobicContact CB-CG1 4.49Å; D221-I223 PolarHBondContact O-N 3.4Å
222N88.3Confident91.6Very high131 Ų13160.9 Ų60.970%0.70130%0.304SS*.THydrogen-bonded Turntrans63.715.4-180-59.2-64.4000115.2R219 L220 K224R219-N222 PolarHBondContact O-N 2.94Å; R219-N222 VanDerWaalsContact O-N 3.07Å; L220-N222 PolarHBondContact O-N 3.38Å; N222-K224 PolarHBondContact O-N 3.36Å; N222-K224 VanDerWaalsContact O-N 3.13Å
223I89.5Confident91.6Very high89 Ų8964.5 Ų64.546%0.45632%0.324SS..  trans-83.589172.5-51.6172.9000107.5C218 D221 L225C218-I223 HydrophobicContact CB-CB 4.45Å; C218-I223 WeakPolarHBondContact O-CA 3.45Å; C218-I223 VanDerWaalsContact O-CB 3.26Å; C218-I223 WeakPolarHBondContact O-CB 3.33Å; C218-I223 PolarHBondContact O-N 2.96Å; D221-I223 HydrophobicContact CB-CG1 4.49Å; D221-I223 PolarHBondContact O-N 3.4Å; I223-L225 HydrophobicContact CG2-CD1 3.71Å; I223-L225 HydrophobicContact CG2-CG 3.82Å; I223-L225 PolarHBondContact O-N 2.66Å
224K81.6Confident91.6Very high159 Ų15964.6 Ų64.669%0.69133%0.325SS*.  trans-77.962.9-174.7-61.1-174.9-176.9175.70112.7N222N222-K224 PolarHBondContact O-N 3.36Å; N222-K224 VanDerWaalsContact O-N 3.13Å
225L82.8Confident91.5Very high117 Ų11762.8 Ų62.861%0.61331%0.313SS*.  trans-80.2-34.2175.4-70.5164.7000112.6I223I223-L225 HydrophobicContact CG2-CD1 3.71Å; I223-L225 HydrophobicContact CG2-CG 3.82Å; I223-L225 PolarHBondContact O-N 2.66Å
226F88.5Confident91.4Very high88 Ų8863.4 Ų63.439%0.38632%0.315SS..SBendtrans-131.8152.9-169.9-57.6-71.1000112.1L215 R219 E230 I231L215-F226 HydrophobicContact CD2-CD2 3.57Å; L215-F226 HydrophobicContact CD2-CE2 3.59Å; L215-F226 HydrophobicContact CD2-CG 4.41Å; L215-F226 HydrophobicContact CD2-CZ 4.45Å; R219-F226 PolarHBondContact NH1-O 2.9Å; R219-F226 VanDerWaalsContact NH1-O 3.16Å; F226-E230 WeakPolarHBondContact CA-OE2 3.33Å; F226-E230 HydrophobicContact CB-CB 4.21Å; F226-E230 WeakPolarHBondContact CB-OE2 3.41Å; F226-I231 HydrophobicContact CB-CD1 4.42Å; F226-I231 HydrophobicContact CB-CG1 3.97Å
227T90.3Very high91.4Very high71 Ų7165.3 Ų65.344%0.43632%0.324SS..  trans-78.1159.9172.4620000111N229 E230 I231T227-N229 PolarHBondContact O-N 3.36Å; T227-E230 PolarHBondContact N-OE2 3.26Å; T227-E230 PolarHBondContact O-N 3.39Å; T227-E230 VanDerWaalsContact O-N 3.16Å; T227-E230 VanDerWaalsContact OG1-CD 3.29Å; T227-E230 WeakPolarHBondContact OG1-CG 3.45Å; T227-E230 PolarHBondContact OG1-OE2 2.88Å; T227-I231 VanDerWaalsContact O-CG1 3.32Å; T227-I231 WeakPolarHBondContact O-CG1 3.47Å; T227-I231 PolarHBondContact O-N 3.31Å
228Y90.4Very high91.4Very high80 Ų8065.3 Ų65.331%0.31432%0.324SS..Hα-helixtrans-60.5-33.1177.9-70.9-67.5000112.3I32 R219 E230 I231 F232I32-Y228 HydrophobicContact CG2-CD1 3.99Å; I32-Y228 HydrophobicContact CG2-CD2 3.31Å; I32-Y228 HydrophobicContact CG2-CE1 4.32Å; I32-Y228 HydrophobicContact CG2-CE2 3.67Å; I32-Y228 HydrophobicContact CG2-CG 3.48Å; I32-Y228 VanDerWaalsContact CG2-CG 3.48Å; R219-Y228 HydrophobicContact CG-CE1 3.92Å; Y228-E230 PolarHBondContact O-N 2.96Å; Y228-I231 HydrophobicContact CD1-CD1 4.42Å; Y228-I231 PolarHBondContact O-N 3.42Å; Y228-F232 HydrophobicContact CD1-CE2 4.35Å; Y228-F232 VanDerWaalsContact O-CD2 3.24Å; Y228-F232 WeakPolarHBondContact O-CD2 3.27Å; Y228-F232 PolarHBondContact O-N 3.28Å
229N91.7Very high91.3Very high67 Ų6764 Ų6436%0.35832%0.316SS..Hα-helixtrans-60-44.7175-68.5-24000112.5L29 N33 T227 L233L29-N229 WeakPolarHBondContact CD1-OD1 3.46Å; L29-N229 WeakPolarHBondContact CD2-OD1 3.4Å; N33-N229 PolarHBondContact ND2-OD1 3.45Å; T227-N229 PolarHBondContact O-N 3.36Å; N229-L233 WeakPolarHBondContact O-CB 3.3Å; N229-L233 PolarHBondContact O-N 3.09Å
230E93.2Very high91.2Very high94 Ų9466.6 Ų66.644%0.43933%0.333SS..Hα-helixtrans-69.2-38.6178.8-68.4162.2165.300111.7F226 T227 Y228 L233 P234F226-E230 WeakPolarHBondContact CA-OE2 3.33Å; F226-E230 HydrophobicContact CB-CB 4.21Å; F226-E230 WeakPolarHBondContact CB-OE2 3.41Å; T227-E230 PolarHBondContact N-OE2 3.26Å; T227-E230 PolarHBondContact O-N 3.39Å; T227-E230 VanDerWaalsContact O-N 3.16Å; T227-E230 VanDerWaalsContact OG1-CD 3.29Å; T227-E230 WeakPolarHBondContact OG1-CG 3.45Å; T227-E230 PolarHBondContact OG1-OE2 2.88Å; Y228-E230 PolarHBondContact O-N 2.96Å; E230-L233 PolarHBondContact O-N 3.22Å; E230-P234 VanDerWaalsContact O-CD 3.31Å; E230-P234 WeakPolarHBondContact O-CD 3.45Å
231I93.8Very high91.1Very high1 Ų167 Ų671%0.00533%0.333CS..Hα-helixtrans-65.1-43.6178.3-64.2163.3000110.6F212 L215 L216 R219 F226 T227 Y228 L233 P234F212-I231 HydrophobicContact CD2-CG2 4.42Å; F212-I231 VanDerWaalsContact CD2-O 3.3Å; F212-I231 WeakPolarHBondContact CD2-O 3.26Å; F212-I231 HydrophobicContact CE2-CG2 4.37Å; L215-I231 HydrophobicContact CB-CB 4.47Å; L215-I231 HydrophobicContact CB-CG1 4.21Å; L215-I231 HydrophobicContact CB-CG2 4.08Å; L216-I231 HydrophobicContact CB-CG2 4.16Å; L216-I231 HydrophobicContact CD1-CG2 4.35Å; R219-I231 HydrophobicContact CB-CD1 3.51Å; R219-I231 HydrophobicContact CG-CD1 3.63Å; F226-I231 HydrophobicContact CB-CD1 4.42Å; F226-I231 HydrophobicContact CB-CG1 3.97Å; T227-I231 VanDerWaalsContact O-CG1 3.32Å; T227-I231 WeakPolarHBondContact O-CG1 3.47Å; T227-I231 PolarHBondContact O-N 3.31Å; Y228-I231 HydrophobicContact CD1-CD1 4.42Å; Y228-I231 PolarHBondContact O-N 3.42Å; I231-L233 VanDerWaalsContact C-N 3.34Å; I231-P234 WeakPolarHBondContact O-CD 3.44Å
232F94Very high91Very high20 Ų2068.4 Ų68.49%0.08834%0.339CS..Hα-helixtrans-78.8-13.7-178.1-82.4-102.4000113.6L25 L29 I32 F212 Y228 L235 F236L25-F232 HydrophobicContact CD2-CE1 4.36Å; L29-F232 HydrophobicContact CD1-CB 4.19Å; L29-F232 HydrophobicContact CD1-CD2 4.08Å; L29-F232 HydrophobicContact CD1-CG 4.14Å; I32-F232 HydrophobicContact CD1-CE2 4.29Å; I32-F232 HydrophobicContact CD1-CZ 4.12Å; F212-F232 HydrophobicContact CE2-CD1 4.39Å; F212-F232 HydrophobicContact CE2-CG 4.48Å; Y228-F232 HydrophobicContact CD1-CE2 4.35Å; Y228-F232 VanDerWaalsContact O-CD2 3.24Å; Y228-F232 WeakPolarHBondContact O-CD2 3.27Å; Y228-F232 PolarHBondContact O-N 3.28Å; F232-L235 HydrophobicContact CD1-CD2 4Å; F232-L235 HydrophobicContact CE1-CD2 4.34Å; F232-L235 WeakPolarHBondContact O-CB 3.34Å; F232-L235 PolarHBondContact O-N 3.48Å; F232-L235 VanDerWaalsContact O-N 3.1Å; F232-F236 HydrophobicContact CB-CD2 4.32Å; F232-F236 HydrophobicContact CB-CE2 4.02Å; F232-F236 WeakPolarHBondContact O-CD2 3.31Å; F232-F236 PolarHBondContact O-N 2.86Å
233L93.5Very high91.1Very high97 Ų9764 Ų6451%0.50832%0.315SS..Hα-helixtrans-58.9-47.9-178-178.9155.9000113.5N229 E230 I231 L235 F236 I237N229-L233 WeakPolarHBondContact O-CB 3.3Å; N229-L233 PolarHBondContact O-N 3.09Å; E230-L233 PolarHBondContact O-N 3.22Å; I231-L233 VanDerWaalsContact C-N 3.34Å; L233-L235 PolarHBondContact O-N 2.92Å; L233-F236 PolarHBondContact O-N 3.27Å; L233-F236 VanDerWaalsContact O-N 3.14Å; L233-I237 HydrophobicContact CD2-CD1 3.52Å; L233-I237 HydrophobicContact CD2-CG1 4.26Å; L233-I237 WeakPolarHBondContact O-CG1 3.32Å; L233-I237 PolarHBondContact O-N 3.49Å
234P95.3Very high91Very high13 Ų1364.3 Ų64.38%0.08432%0.317CS..Hα-helixtrans-58.9-33.8174-23.732.7000113.1T208 I211 F212 L215 E230 I231 I237 C238T208-P234 HydrophobicContact CG2-CB 3.79Å; T208-P234 VanDerWaalsContact CG2-O 3.29Å; T208-P234 WeakPolarHBondContact CG2-O 3.29Å; I211-P234 HydrophobicContact CG2-CB 4.45Å; I211-P234 HydrophobicContact CG2-CG 4.08Å; F212-P234 HydrophobicContact CB-CB 4.17Å; L215-P234 HydrophobicContact CD1-CG 4.15Å; E230-P234 VanDerWaalsContact O-CD 3.31Å; E230-P234 WeakPolarHBondContact O-CD 3.45Å; I231-P234 WeakPolarHBondContact O-CD 3.44Å; P234-I237 PolarHBondContact O-N 3.39Å; P234-C238 PolarHBondContact O-N 3.02Å; P234-C238 PolarHBondContact O-SG 2.98Å
235L94Very high91.2Very high20 Ų2058.6 Ų58.611%0.10529%0.293CS..Hα-helixtrans-66.4-42.4175.7-174.968.8000111.5L25 F209 F212 F232 L233 I237 C238 V239L25-L235 HydrophobicContact CD1-CD2 3.63Å; L25-L235 HydrophobicContact CD1-CG 3.91Å; L25-L235 HydrophobicContact CD2-CD2 3.55Å; L25-L235 HydrophobicContact CG-CD2 4.24Å; F209-L235 HydrophobicContact CD2-CD1 4.21Å; F209-L235 HydrophobicContact CE2-CD1 4.3Å; F212-L235 HydrophobicContact CB-CB 4.45Å; F212-L235 HydrophobicContact CD1-CB 4.45Å; F212-L235 HydrophobicContact CD1-CD1 4.07Å; F212-L235 HydrophobicContact CD2-CB 3.72Å; F212-L235 HydrophobicContact CD2-CD2 4.44Å; F212-L235 HydrophobicContact CE1-CD1 4.15Å; F212-L235 HydrophobicContact CE1-CD2 4.24Å; F212-L235 HydrophobicContact CE2-CB 4.03Å; F212-L235 HydrophobicContact CE2-CD2 3.94Å; F212-L235 HydrophobicContact CE2-CG 4.49Å; F212-L235 HydrophobicContact CG-CB 3.95Å; F212-L235 HydrophobicContact CG-CD1 4.38Å; F212-L235 HydrophobicContact CZ-CD2 3.82Å; F232-L235 HydrophobicContact CD1-CD2 4Å; F232-L235 HydrophobicContact CE1-CD2 4.34Å; F232-L235 WeakPolarHBondContact O-CB 3.34Å; F232-L235 PolarHBondContact O-N 3.48Å; F232-L235 VanDerWaalsContact O-N 3.1Å; L233-L235 PolarHBondContact O-N 2.92Å; L235-I237 VanDerWaalsContact C-N 3.33Å; L235-I237 PolarHBondContact O-N 3.44Å; L235-C238 WeakPolarHBondContact O-CB 3.29Å; L235-C238 PolarHBondContact O-N 3.41Å; L235-V239 WeakPolarHBondContact O-CG2 3.16Å; L235-V239 PolarHBondContact O-N 2.79Å
236F93.8Very high91.3Very high48 Ų4853.8 Ų53.821%0.21127%0.269CS..Hα-helixtrans-61.2-42.3173.3-76.7-68000111.9L25 I26 L29 F232 L233 C238 V239 L240L25-F236 HydrophobicContact CB-CE1 3.95Å; L25-F236 HydrophobicContact CB-CZ 4.04Å; I26-F236 HydrophobicContact CG1-CE1 3.71Å; I26-F236 HydrophobicContact CG1-CZ 4.06Å; L29-F236 HydrophobicContact CD2-CE2 3.9Å; L29-F236 HydrophobicContact CD2-CZ 4.36Å; F232-F236 HydrophobicContact CB-CD2 4.32Å; F232-F236 HydrophobicContact CB-CE2 4.02Å; F232-F236 WeakPolarHBondContact O-CD2 3.31Å; F232-F236 PolarHBondContact O-N 2.86Å; L233-F236 PolarHBondContact O-N 3.27Å; L233-F236 VanDerWaalsContact O-N 3.14Å; F236-C238 VanDerWaalsContact C-N 3.31Å; F236-C238 PolarHBondContact O-N 3.26Å; F236-V239 PolarHBondContact O-N 2.82Å; F236-L240 WeakPolarHBondContact O-CB 3.33Å; F236-L240 VanDerWaalsContact O-CG 3.27Å; F236-L240 WeakPolarHBondContact O-CG 3.28Å; F236-L240 PolarHBondContact O-N 3.17Å
237I93.5Very high91.2Very high85 Ų8554.4 Ų54.444%0.43628%0.275SS..Hα-helixtrans-58.7-44.6174.5-65.4174.1000110.5T208 L233 P234 L235 V239 L240 F241T208-I237 HydrophobicContact CG2-CB 4.28Å; T208-I237 HydrophobicContact CG2-CG2 4.2Å; L233-I237 HydrophobicContact CD2-CD1 3.52Å; L233-I237 HydrophobicContact CD2-CG1 4.26Å; L233-I237 WeakPolarHBondContact O-CG1 3.32Å; L233-I237 PolarHBondContact O-N 3.49Å; P234-I237 PolarHBondContact O-N 3.39Å; L235-I237 VanDerWaalsContact C-N 3.33Å; L235-I237 PolarHBondContact O-N 3.44Å; I237-V239 PolarHBondContact O-N 2.94Å; I237-L240 PolarHBondContact O-N 2.86Å; I237-F241 WeakPolarHBondContact O-CB 3.31Å; I237-F241 PolarHBondContact O-N 2.79Å
238C93.6Very high90.8Very high5 Ų553.5 Ų53.53%0.03427%0.271CS..Hα-helixtrans-58.3-48.9176.4-67.90000111.9I205 T208 F209 P234 L235 F236 F241 L242I205-C238 HydrophobicContact CG2-CB 4.42Å; T208-C238 WeakPolarHBondContact CB-SG 3.27Å; T208-C238 WeakPolarHBondContact CG2-SG 3.34Å; F209-C238 PolarHBondContact N-SG 3.26Å; P234-C238 PolarHBondContact O-N 3.02Å; P234-C238 PolarHBondContact O-SG 2.98Å; L235-C238 WeakPolarHBondContact O-CB 3.29Å; L235-C238 PolarHBondContact O-N 3.41Å; F236-C238 VanDerWaalsContact C-N 3.31Å; F236-C238 PolarHBondContact O-N 3.26Å; C238-F241 PolarHBondContact O-N 3.11Å; C238-L242 WeakPolarHBondContact O-CB 3.38Å; C238-L242 VanDerWaalsContact O-CG 3.27Å; C238-L242 WeakPolarHBondContact O-CG 3.27Å; C238-L242 PolarHBondContact O-N 2.91Å
239V92.6Very high90.3Very high9 Ų951.8 Ų51.86%0.05527%0.269CS..Hα-helixtrans-66.3-41.5-178.21760000111.2L21 L25 L235 F236 I237 L242 M243L21-V239 HydrophobicContact CD2-CG1 4.25Å; L21-V239 HydrophobicContact CD2-CG2 3.54Å; L25-V239 HydrophobicContact CD1-CG2 3.99Å; L235-V239 WeakPolarHBondContact O-CG2 3.16Å; L235-V239 PolarHBondContact O-N 2.79Å; F236-V239 PolarHBondContact O-N 2.82Å; I237-V239 PolarHBondContact O-N 2.94Å; V239-L242 PolarHBondContact O-N 3.41Å; V239-M243 WeakPolarHBondContact O-CB 3.24Å; V239-M243 VanDerWaalsContact O-CG 3.29Å; V239-M243 WeakPolarHBondContact O-CG 3.29Å; V239-M243 PolarHBondContact O-N 2.86Å
240L90.8Very high89.7Confident111 Ų11150.8 Ų50.858%0.58126%0.264SS*.Hα-helixtrans-62.1-43.8175.1-72174.8000111.5F236 I237 M243 I244F236-L240 WeakPolarHBondContact O-CB 3.33Å; F236-L240 VanDerWaalsContact O-CG 3.27Å; F236-L240 WeakPolarHBondContact O-CG 3.28Å; F236-L240 PolarHBondContact O-N 3.17Å; I237-L240 PolarHBondContact O-N 2.86Å; L240-M243 WeakPolarHBondContact O-CB 3.49Å; L240-M243 PolarHBondContact O-N 3.48Å; L240-I244 WeakPolarHBondContact O-CG1 3.09Å; L240-I244 PolarHBondContact O-N 3.01Å
241F90.6Very high88.9Confident69 Ų6953.6 Ų53.630%0.30327%0.271SS..Hα-helixtrans-67.5-39178.5-162-92.5000111.7I205 I237 C238 M243 I244 M245I205-F241 HydrophobicContact CD1-CD1 3.43Å; I205-F241 VanDerWaalsContact CD1-CD1 3.43Å; I205-F241 HydrophobicContact CD1-CE1 3.92Å; I205-F241 HydrophobicContact CG1-CB 4.35Å; I205-F241 HydrophobicContact CG1-CD1 3.33Å; I205-F241 HydrophobicContact CG1-CE1 3.96Å; I205-F241 HydrophobicContact CG1-CG 4.19Å; I237-F241 WeakPolarHBondContact O-CB 3.31Å; I237-F241 PolarHBondContact O-N 2.79Å; C238-F241 PolarHBondContact O-N 3.11Å; F241-M243 VanDerWaalsContact C-N 3.33Å; F241-M243 PolarHBondContact O-N 2.97Å; F241-I244 PolarHBondContact O-N 3.15Å; F241-M245 HydrophobicContact CD1-CG 3.91Å; F241-M245 HydrophobicContact CE1-CG 3.75Å; F241-M245 HydrophobicContact CE1-SD 4.16Å; F241-M245 HydrophobicContact CZ-CG 4.5Å; F241-M245 HydrophobicContact CZ-SD 4.47Å; F241-M245 WeakPolarHBondContact O-CB 3.44Å; F241-M245 VanDerWaalsContact O-CG 3.3Å; F241-M245 WeakPolarHBondContact O-CG 3.33Å; F241-M245 PolarHBondContact O-N 3.45Å
242L90.4Very high88Confident62 Ų6255.5 Ų55.533%0.32528%0.281SS..Hα-helixtrans-61.7-39.9171.5-74.5170.4000112.1L18 I205 C238 V239 M245 T246L18-L242 HydrophobicContact CD1-CB 4.06Å; L18-L242 HydrophobicContact CD2-CB 4.27Å; L18-L242 HydrophobicContact CD2-CD1 4.31Å; I205-L242 HydrophobicContact CD1-CD2 3.67Å; I205-L242 HydrophobicContact CD1-CG 4.13Å; I205-L242 HydrophobicContact CG2-CD2 4.36Å; I205-L242 HydrophobicContact CG2-CG 4.3Å; C238-L242 WeakPolarHBondContact O-CB 3.38Å; C238-L242 VanDerWaalsContact O-CG 3.27Å; C238-L242 WeakPolarHBondContact O-CG 3.27Å; C238-L242 PolarHBondContact O-N 2.91Å; V239-L242 PolarHBondContact O-N 3.41Å; L242-M245 PolarHBondContact O-N 2.92Å; L242-T246 VanDerWaalsContact O-CB 3.31Å; L242-T246 WeakPolarHBondContact O-CB 3.42Å; L242-T246 PolarHBondContact O-N 2.86Å; L242-T246 PolarHBondContact O-OG1 3.47Å
243M88.5Confident87Confident38 Ų3856.3 Ų56.319%0.18729%0.287CS..Hα-helixtrans-63-47.2174.5-76.8-67.9-74.100111.3L18 V239 L240 F241 M245 T246 I247L18-M243 HydrophobicContact CB-CG 4.08Å; L18-M243 HydrophobicContact CB-SD 3.31Å; L18-M243 WeakPolarHBondContact CB-SD 3.43Å; L18-M243 HydrophobicContact CD1-CG 4.37Å; L18-M243 HydrophobicContact CD1-SD 3.91Å; L18-M243 HydrophobicContact CG-SD 4.27Å; V239-M243 WeakPolarHBondContact O-CB 3.24Å; V239-M243 VanDerWaalsContact O-CG 3.29Å; V239-M243 WeakPolarHBondContact O-CG 3.29Å; V239-M243 PolarHBondContact O-N 2.86Å; L240-M243 WeakPolarHBondContact O-CB 3.49Å; L240-M243 PolarHBondContact O-N 3.48Å; F241-M243 VanDerWaalsContact C-N 3.33Å; F241-M243 PolarHBondContact O-N 2.97Å; M243-M245 PolarHBondContact O-N 3.44Å; M243-T246 PolarHBondContact O-N 3.44Å; M243-I247 VanDerWaalsContact O-CG1 3.26Å; M243-I247 WeakPolarHBondContact O-CG1 3.43Å; M243-I247 PolarHBondContact O-N 3.36Å
244I88.9Confident86.1Confident97 Ų9754.4 Ų54.450%0.49728%0.282SS..Hα-helixtrans-59.2-49.3176.6-68165.2000110.1L240 F241 T246 I247 S248L240-I244 WeakPolarHBondContact O-CG1 3.09Å; L240-I244 PolarHBondContact O-N 3.01Å; F241-I244 PolarHBondContact O-N 3.15Å; I244-T246 VanDerWaalsContact C-N 3.31Å; I244-T246 PolarHBondContact O-N 2.93Å; I244-I247 PolarHBondContact O-N 3.48Å; I244-S248 WeakPolarHBondContact O-CB 3.34Å; I244-S248 PolarHBondContact O-N 2.77Å; I244-S248 PolarHBondContact O-OG 3.46Å
245M85.4Confident85.2Confident38 Ų3859.8 Ų59.819%0.18730%0.304CS..Hα-helixtrans-59.8-39.9177.9-72.6-62-70.200112.6F241 L242 M243 T249F241-M245 HydrophobicContact CD1-CG 3.91Å; F241-M245 HydrophobicContact CE1-CG 3.75Å; F241-M245 HydrophobicContact CE1-SD 4.16Å; F241-M245 HydrophobicContact CZ-CG 4.5Å; F241-M245 HydrophobicContact CZ-SD 4.47Å; F241-M245 WeakPolarHBondContact O-CB 3.44Å; F241-M245 VanDerWaalsContact O-CG 3.3Å; F241-M245 WeakPolarHBondContact O-CG 3.33Å; F241-M245 PolarHBondContact O-N 3.45Å; L242-M245 PolarHBondContact O-N 2.92Å; M243-M245 PolarHBondContact O-N 3.44Å; M245-T249 WeakPolarHBondContact O-CB 3.43Å; M245-T249 VanDerWaalsContact O-CG2 3.27Å; M245-T249 WeakPolarHBondContact O-CG2 3.41Å; M245-T249 PolarHBondContact O-N 2.92Å; M245-T249 PolarHBondContact O-OG1 3.44Å
246T85.4Confident84Confident17 Ų1765.1 Ų65.110%0.10433%0.327CS..Hα-helixtrans-66.2-40.3177.3-57.40000111.5L11 K14 A15 L242 M243 I244 T249 N250L11-T246 HydrophobicContact CD1-CG2 3.42Å; L11-T246 VanDerWaalsContact CD1-CG2 3.42Å; L11-T246 HydrophobicContact CG-CG2 4.08Å; K14-T246 HydrophobicContact CB-CG2 4.34Å; A15-T246 HydrophobicContact CB-CG2 3.96Å; L242-T246 VanDerWaalsContact O-CB 3.31Å; L242-T246 WeakPolarHBondContact O-CB 3.42Å; L242-T246 PolarHBondContact O-N 2.86Å; L242-T246 PolarHBondContact O-OG1 3.47Å; M243-T246 PolarHBondContact O-N 3.44Å; I244-T246 VanDerWaalsContact C-N 3.31Å; I244-T246 PolarHBondContact O-N 2.93Å; T246-T249 WeakPolarHBondContact CA-OG1 3.19Å; T246-T249 PolarHBondContact O-OG1 2.95Å; T246-N250 PolarHBondContact O-N 3.31Å; T246-N250 VanDerWaalsContact O-N 3.15Å
247I85.5Confident82.6Confident101 Ų10164.5 Ų64.552%0.51833%0.328SS..Hα-helixtrans-71.9-43.8177.7-66.3164.3000110.6M243 I244 T249 N250 W251M243-I247 VanDerWaalsContact O-CG1 3.26Å; M243-I247 WeakPolarHBondContact O-CG1 3.43Å; M243-I247 PolarHBondContact O-N 3.36Å; I244-I247 PolarHBondContact O-N 3.48Å; I247-T249 PolarHBondContact O-N 3.37Å; I247-N250 WeakPolarHBondContact O-CB 3.23Å; I247-N250 PolarHBondContact O-N 3.22Å; I247-N250 VanDerWaalsContact O-N 3.11Å; I247-W251 WeakPolarHBondContact O-CB 3.47Å; I247-W251 PolarHBondContact O-N 3.41Å
248S82.6Confident81.1Confident51 Ų5162.3 Ų62.336%0.35733%0.326SS..Hα-helixtrans-60.7-43.8177.7-660000111.6I244 N250 W251 L252I244-S248 WeakPolarHBondContact O-CB 3.34Å; I244-S248 PolarHBondContact O-N 2.77Å; I244-S248 PolarHBondContact O-OG 3.46Å; S248-N250 VanDerWaalsContact C-N 3.31Å; S248-N250 PolarHBondContact O-N 2.92Å; S248-W251 PolarHBondContact O-N 3.23Å; S248-L252 WeakPolarHBondContact O-CB 3.5Å; S248-L252 VanDerWaalsContact O-CG 3.26Å; S248-L252 WeakPolarHBondContact O-CG 3.42Å; S248-L252 PolarHBondContact O-N 3.21Å
249T79.9Confident79.4Confident44 Ų4466.5 Ų66.527%0.2735%0.348SS..Hα-helixtrans-63.5-37.2174.249.40000111.8M245 T246 I247 L252 V253M245-T249 WeakPolarHBondContact O-CB 3.43Å; M245-T249 VanDerWaalsContact O-CG2 3.27Å; M245-T249 WeakPolarHBondContact O-CG2 3.41Å; M245-T249 PolarHBondContact O-N 2.92Å; M245-T249 PolarHBondContact O-OG1 3.44Å; T246-T249 WeakPolarHBondContact CA-OG1 3.19Å; T246-T249 PolarHBondContact O-OG1 2.95Å; I247-T249 PolarHBondContact O-N 3.37Å; T249-L252 PolarHBondContact O-N 3.23Å; T249-V253 WeakPolarHBondContact O-CB 3.26Å; T249-V253 VanDerWaalsContact O-CG2 3.24Å; T249-V253 WeakPolarHBondContact O-CG2 3.38Å; T249-V253 PolarHBondContact O-N 3.49Å
250N78.9Confident77.6Confident47 Ų4771.4 Ų71.425%0.25137%0.373SS..Hα-helixtrans-67.8-45.5178.2-162.818.9000111.9L11 T246 I247 S248 L252 V253 S254L11-N250 HydrophobicContact CD2-CB 3.26Å; L11-N250 VanDerWaalsContact CD2-N 3.33Å; L11-N250 HydrophobicContact CG-CB 3.98Å; T246-N250 PolarHBondContact O-N 3.31Å; T246-N250 VanDerWaalsContact O-N 3.15Å; I247-N250 WeakPolarHBondContact O-CB 3.23Å; I247-N250 PolarHBondContact O-N 3.22Å; I247-N250 VanDerWaalsContact O-N 3.11Å; S248-N250 VanDerWaalsContact C-N 3.31Å; S248-N250 PolarHBondContact O-N 2.92Å; N250-L252 VanDerWaalsContact C-N 3.29Å; N250-L252 PolarHBondContact O-N 3.45Å; N250-V253 PolarHBondContact O-N 2.84Å; N250-S254 PolarHBondContact O-N 3.17Å; N250-S254 PolarHBondContact O-OG 3.36Å
251W76.7Confident75.7Confident152 Ų15271.8 Ų71.858%0.57638%0.375SS*.Hα-helixtrans-62.1-38.6176.7-175.684.2000111.5I247 S248 S254 K255I247-W251 WeakPolarHBondContact O-CB 3.47Å; I247-W251 PolarHBondContact O-N 3.41Å; S248-W251 PolarHBondContact O-N 3.23Å; W251-S254 PolarHBondContact O-OG 3.15Å; W251-K255 HydrophobicContact CH2-CD 3.82Å; W251-K255 HydrophobicContact CZ2-CD 4.21Å; W251-K255 HydrophobicContact CZ3-CD 4.13Å; W251-K255 WeakPolarHBondContact O-CB 3.32Å; W251-K255 PolarHBondContact O-N 3.44Å
252L73.3Confident73.9Confident42 Ų4272.9 Ų72.922%0.2239%0.391CS..Hα-helixtrans-67.5-46.8175.1-75.9170000112.4H194 S248 T249 N250 S254 K255 F256H194-L252 VanDerWaalsContact NE2-CD1 3.34Å; H194-L252 WeakPolarHBondContact NE2-CD1 3.48Å; S248-L252 WeakPolarHBondContact O-CB 3.5Å; S248-L252 VanDerWaalsContact O-CG 3.26Å; S248-L252 WeakPolarHBondContact O-CG 3.42Å; S248-L252 PolarHBondContact O-N 3.21Å; T249-L252 PolarHBondContact O-N 3.23Å; N250-L252 VanDerWaalsContact C-N 3.29Å; N250-L252 PolarHBondContact O-N 3.45Å; L252-S254 VanDerWaalsContact C-N 3.27Å; L252-S254 PolarHBondContact O-N 3.03Å; L252-K255 PolarHBondContact O-N 2.91Å; L252-F256 HydrophobicContact CB-CD2 4.41Å; L252-F256 HydrophobicContact CD2-CE2 4.17Å; L252-F256 WeakPolarHBondContact O-CB 3.31Å; L252-F256 VanDerWaalsContact O-CD2 3.32Å; L252-F256 WeakPolarHBondContact O-CD2 3.48Å; L252-F256 PolarHBondContact O-N 2.83Å
253V73Confident72Confident36 Ų3674 Ų7422%0.21841%0.405CS..Hα-helixtrans-57.2-43.7176.8167.90000110.6L7 T249 N250 C257L7-V253 HydrophobicContact CD2-CB 4.48Å; L7-V253 HydrophobicContact CD2-CG1 3.73Å; L7-V253 HydrophobicContact CD2-CG2 3.85Å; L7-V253 HydrophobicContact CG-CG1 4.44Å; T249-V253 WeakPolarHBondContact O-CB 3.26Å; T249-V253 VanDerWaalsContact O-CG2 3.24Å; T249-V253 WeakPolarHBondContact O-CG2 3.38Å; T249-V253 PolarHBondContact O-N 3.49Å; N250-V253 PolarHBondContact O-N 2.84Å; V253-C257 VanDerWaalsContact O-CB 3.31Å; V253-C257 WeakPolarHBondContact O-CB 3.31Å; V253-C257 PolarHBondContact O-N 3.34Å; V253-C257 PolarHBondContact O-SG 2.78Å
254S74.7Confident70.1Confident57 Ų5774.4 Ų74.440%0.39941%0.411SS..Hα-helixtrans-66.2-38.9178.473.40000112.4N250 W251 L252 G258N250-S254 PolarHBondContact O-N 3.17Å; N250-S254 PolarHBondContact O-OG 3.36Å; W251-S254 PolarHBondContact O-OG 3.15Å; L252-S254 VanDerWaalsContact C-N 3.27Å; L252-S254 PolarHBondContact O-N 3.03Å; S254-G258 WeakPolarHBondContact O-CA 3.32Å; S254-G258 PolarHBondContact O-N 2.62Å
255K76.6Confident67.9Low126 Ų12671.9 Ų71.955%0.54841%0.409SS..Hα-helixtrans-69.2-46.1177.1-169.8176-179177.70112.7W251 L252 G258 N259W251-K255 HydrophobicContact CH2-CD 3.82Å; W251-K255 HydrophobicContact CZ2-CD 4.21Å; W251-K255 HydrophobicContact CZ3-CD 4.13Å; W251-K255 WeakPolarHBondContact O-CB 3.32Å; W251-K255 PolarHBondContact O-N 3.44Å; L252-K255 PolarHBondContact O-N 2.91Å; K255-G258 PolarHBondContact O-N 3.11Å; K255-N259 WeakPolarHBondContact O-CB 3.11Å; K255-N259 PolarHBondContact O-N 3.49Å
256F68.8Low65.7Low133 Ų13381 Ų8158%0.58344%0.441SS*.Hα-helixtrans-64-44.6177.6-84.7-71.5000111.4L252 N259 I260L252-F256 HydrophobicContact CB-CD2 4.41Å; L252-F256 HydrophobicContact CD2-CE2 4.17Å; L252-F256 WeakPolarHBondContact O-CB 3.31Å; L252-F256 VanDerWaalsContact O-CD2 3.32Å; L252-F256 WeakPolarHBondContact O-CD2 3.48Å; L252-F256 PolarHBondContact O-N 2.83Å; F256-N259 PolarHBondContact O-N 3.43Å; F256-I260 VanDerWaalsContact O-CG1 3.32Å; F256-I260 WeakPolarHBondContact O-CG1 3.44Å; F256-I260 PolarHBondContact O-N 3.47Å; F256-I260 VanDerWaalsContact O-N 3.15Å
257C65.6Low63.3Low35 Ų3586.1 Ų86.124%0.23647%0.468CS..Hα-helixtrans-68.6-38.7175.7-72.60000112.7Q4 V253 N259 I260 N261Q4-C257 HydrophobicContact CG-CB 4.48Å; V253-C257 VanDerWaalsContact O-CB 3.31Å; V253-C257 WeakPolarHBondContact O-CB 3.31Å; V253-C257 PolarHBondContact O-N 3.34Å; V253-C257 PolarHBondContact O-SG 2.78Å; C257-N259 VanDerWaalsContact C-N 3.32Å; C257-N259 PolarHBondContact O-N 3.25Å; C257-I260 PolarHBondContact O-N 2.98Å; C257-N261 PolarHBondContact O-N 3.27Å
258G61.5Low60.8Low38 Ų3884.2 Ų84.239%0.39246%0.463SS..Hα-helixtrans-61.1-40.6174.700000112.4S254 K255 N261 S262S254-G258 WeakPolarHBondContact O-CA 3.32Å; S254-G258 PolarHBondContact O-N 2.62Å; K255-G258 PolarHBondContact O-N 3.11Å; G258-N261 PolarHBondContact O-N 3.04Å; G258-S262 PolarHBondContact O-N 3.41Å; G258-S262 VanDerWaalsContact O-N 3.11Å; G258-S262 PolarHBondContact O-OG 2.82Å
259N56.8Low58.5Low93 Ų9387.7 Ų87.750%0.49748%0.476SS..Hα-helixtrans-70.6-32.6178.3-161.140.4000113K255 F256 C257 N261 S262 S263K255-N259 WeakPolarHBondContact O-CB 3.11Å; K255-N259 PolarHBondContact O-N 3.49Å; F256-N259 PolarHBondContact O-N 3.43Å; C257-N259 VanDerWaalsContact C-N 3.32Å; C257-N259 PolarHBondContact O-N 3.25Å; N259-N261 VanDerWaalsContact C-N 3.31Å; N259-N261 PolarHBondContact O-N 3.29Å; N259-S262 WeakPolarHBondContact CA-OG 3.46Å; N259-S262 PolarHBondContact O-N 3.38Å; N259-S262 PolarHBondContact O-OG 2.92Å; N259-S263 WeakPolarHBondContact O-CB 3.34Å; N259-S263 PolarHBondContact O-N 3.02Å
260I55.3Low56.3Low113 Ų11391.9 Ų91.958%0.57950%0.495SS*.Hα-helixtrans-64-40.4173.7-67.8164.1000110.5F256 C257F256-I260 VanDerWaalsContact O-CG1 3.32Å; F256-I260 WeakPolarHBondContact O-CG1 3.44Å; F256-I260 PolarHBondContact O-N 3.47Å; F256-I260 VanDerWaalsContact O-N 3.15Å; C257-I260 PolarHBondContact O-N 2.98Å
261N51.8Low54.2Low119 Ų11996.4 Ų96.464%0.63651%0.514SS*.Hα-helixtrans-71.3-29.4178.6-67.1-12.8000112.9C257 G258 N259C257-N261 PolarHBondContact O-N 3.27Å; G258-N261 PolarHBondContact O-N 3.04Å; N259-N261 VanDerWaalsContact C-N 3.31Å; N259-N261 PolarHBondContact O-N 3.29Å
262S52.1Low52.1Low91 Ų9198.6 Ų98.664%0.63652%0.524SS*.Hα-helixtrans-91-33.5179.564.10000114.4G258 N259G258-S262 PolarHBondContact O-N 3.41Å; G258-S262 VanDerWaalsContact O-N 3.11Å; G258-S262 PolarHBondContact O-OG 2.82Å; N259-S262 WeakPolarHBondContact CA-OG 3.46Å; N259-S262 PolarHBondContact O-N 3.38Å; N259-S262 PolarHBondContact O-OG 2.92Å
263S50.4Low50.3Low87 Ų87101 Ų10161%0.60854%0.54SS*.Hα-helixtrans-99.5-16.8-167.3-179.10000115.2N259N259-S263 WeakPolarHBondContact O-CB 3.34Å; N259-S263 PolarHBondContact O-N 3.02Å
264S49.5Very low48.7Very low46 Ų46103.4 Ų103.432%0.32256%0.559SS.*THydrogen-bonded Turntrans-149.66.9177.4-145.80000116.4R266 N267 C268S264-R266 PolarHBondContact O-N 3.22Å; S264-N267 PolarHBondContact O-N 3.34Å; S264-C268 PolarHBondContact O-N 3.11Å; S264-C268 PolarHBondContact OG-SG 3.31Å
265G42.4Very low46.6Very low43 Ų43103.7 Ų103.744%0.44357%0.571SS.*THydrogen-bonded Turntrans-65.7-17.7176.300000114.8
266R38.4Very low44.5Very low231 Ų231102.1 Ų102.187%0.87258%0.575SS**THydrogen-bonded Turntrans-98.5-22.3176.6-108.8-174.1-82.5175.1-4.6114.9S264S264-R266 PolarHBondContact O-N 3.22Å
267N34.8Very low42.5Very low124 Ų124107.1 Ų107.166%0.66359%0.59SS**THydrogen-bonded Turntrans-107.3-41.2-176.8-67.84.2000112.6S264 L269 M270 E271S264-N267 PolarHBondContact O-N 3.34Å; N267-L269 PolarHBondContact O-N 3.34Å; N267-M270 PolarHBondContact O-N 3.29Å; N267-E271 PolarHBondContact O-N 2.78Å
268C33.9Very low40.6Very low60 Ų60113.7 Ų113.741%0.40562%0.622SS.*Hα-helixtrans-71.5-27.9177.7-78.90000113.4S264 M270 E271 Y272S264-C268 PolarHBondContact O-N 3.11Å; S264-C268 PolarHBondContact OG-SG 3.31Å; C268-M270 VanDerWaalsContact C-N 3.29Å; C268-E271 PolarHBondContact O-N 3.43Å; C268-Y272 WeakPolarHBondContact O-CD2 3.47Å; C268-Y272 PolarHBondContact O-N 3.36Å
269L34.2Very low39Very low124 Ų124116.9 Ų116.965%0.64964%0.639SS**Hα-helixtrans-75.2-22.5177.3-153.5132.2000112.3N267 T273N267-L269 PolarHBondContact O-N 3.34Å; L269-T273 WeakPolarHBondContact O-CG2 3.41Å; L269-T273 PolarHBondContact O-N 3.32Å; L269-T273 PolarHBondContact O-OG1 3.41Å
270M33.8Very low37.6Very low132 Ų132116.7 Ų116.765%0.6565%0.65SS**Hα-helixtrans-78.5-29.9173.2-155.766.5176.100111.9N267 C268 T273 S274N267-M270 PolarHBondContact O-N 3.29Å; C268-M270 VanDerWaalsContact C-N 3.29Å; M270-T273 PolarHBondContact O-OG1 3.12Å; M270-S274 WeakPolarHBondContact O-CB 3.45Å; M270-S274 PolarHBondContact O-N 3.4Å; M270-S274 VanDerWaalsContact O-N 3.12Å; M270-S274 PolarHBondContact O-OG 3.32Å
271E34.3Very low36.1Very low142 Ų142118.7 Ų118.766%0.66466%0.662SS**Hα-helixtrans-76.6-32.4179.4-154.9158.5-162.200112.6N267 C268 G275N267-E271 PolarHBondContact O-N 2.78Å; C268-E271 PolarHBondContact O-N 3.43Å; E271-G275 PolarHBondContact O-N 3.44Å
272Y33.8Very low34.8Very low199 Ų199120.2 Ų120.278%0.7868%0.676SS**Hα-helixtrans-79.7-20.7173.3-81.5-82000114.2C268C268-Y272 WeakPolarHBondContact O-CD2 3.47Å; C268-Y272 PolarHBondContact O-N 3.36Å
273T35.6Very low33.5Very low92 Ų92120 Ų12056%0.56467%0.674SS**Hα-helixtrans-91.6-13.1175.550.70000113.6L269 M270L269-T273 WeakPolarHBondContact O-CG2 3.41Å; L269-T273 PolarHBondContact O-N 3.32Å; L269-T273 PolarHBondContact O-OG1 3.41Å; M270-T273 PolarHBondContact O-OG1 3.12Å
274S37.8Very low32.3Very low86 Ų86123.1 Ų123.160%0.60168%0.683SS**Hα-helixtrans-95.7-13.3170.948.40000113.8M270 S276M270-S274 WeakPolarHBondContact O-CB 3.45Å; M270-S274 PolarHBondContact O-N 3.4Å; M270-S274 VanDerWaalsContact O-N 3.12Å; M270-S274 PolarHBondContact O-OG 3.32Å; S274-S276 VanDerWaalsContact C-N 3.33Å; S274-S276 PolarHBondContact O-N 2.65Å
275G32.3Very low31Very low63 Ų63127.4 Ų127.465%0.64970%0.703SS**THydrogen-bonded Turntrans-79.42.1178.300000116.9E271E271-G275 PolarHBondContact O-N 3.44Å
276S32.1Very low30.2Very low93 Ų93131.6 Ų131.665%0.6572%0.722SS**THydrogen-bonded Turntrans-135.548.1-178.453.90000113.5S274S274-S276 VanDerWaalsContact C-N 3.33Å; S274-S276 PolarHBondContact O-N 2.65Å
277R26.5Very low29.6Very low238 Ų238127.7 Ų127.790%0.89872%0.717SS**  trans-128.258144.9-72.9-167.9-168.8178.24.3109.1
278L26.5Very low29.1Very low173 Ų173131 Ų13191%0.90673%0.728SS**  trans-121.464.1163.2-148.788000108.2
279S26.6Very low28.7Very low106 Ų106131.9 Ų131.974%0.74175%0.747SS**SBendtrans-145.9112.6162.462.10000108.6
280A27.3Very low28.2Very low88 Ų88129.2 Ų129.273%0.72775%0.75SS**  trans60.891.216500000116.1
281N24.6Very low27.9Very low156 Ų156130.8 Ų130.883%0.83476%0.761SS**  -155.890.6120-89.6-13.2000108.8S283N281-S283 PolarHBondContact O-N 3.16Å; N281-S283 VanDerWaalsContact O-N 3.16Å
282T23.6Very low27.4Very low150 Ų150130 Ų13092%0.9277%0.766SS**  trans-62.398.5154.1-49.30000107.5
283S25.7Very low27.1Very low87 Ų87128.7 Ų128.761%0.60877%0.772SS**  trans-172.9108153.655.90000112.1N281N281-S283 PolarHBondContact O-N 3.16Å; N281-S283 VanDerWaalsContact O-N 3.16Å
284L24.9Very low26.6Very low152 Ų152130.6 Ų130.680%0.79678%0.783SS**  trans60.9122.2146.5-71.8106.4000121.4
285D22.6Very low26.1Very low137 Ų137130.5 Ų130.573%0.73379%0.787SS**  trans-48.9158.6154.6-62.7-51.5000112.5
286P25.4Very low25.6Very low130 Ų130133.4 Ų133.484%0.84479%0.788SS**  -132.814590.833.5-20.3000114.9
287I24.7Very low25.4Very low150 Ų150135.6 Ų135.677%0.76979%0.791SS**  trans-67.6125.5171-65.2156.5000109.6
288E25.8Very low25.2Very low194 Ų194130.3 Ų130.391%0.90778%0.78SS**  trans-158.3130.6150.8-118.4-179.2-167.500111.1
289G24.3Very low25.3Very low78 Ų78127.2 Ų127.280%0.80477%0.769SS**  trans98.899.7154.500000117
290G23.3Very low25.2Very low68 Ų68127.9 Ų127.970%0.70177%0.773SS**  trans-56152.2-178.700000117.3
291N27.4Very low25.1Very low165 Ų165133.7 Ų133.788%0.88278%0.776SS**  -162128.1116.2-93.2-25.2000110.3L293N291-L293 PolarHBondContact O-N 3.45Å
292T23.8Very low25.1Very low125 Ų125133.8 Ų133.877%0.76778%0.777SS**  trans-51.7118.517234.30000113.3
293L28.6Very low25.2Very low172 Ų172136.1 Ų136.190%0.90177%0.774SS**  trans-143.983.2146.4-95168.7000107.9N291 A295N291-L293 PolarHBondContact O-N 3.45Å; L293-A295 PolarHBondContact O-N 3.07Å
294V24.7Very low25Very low131 Ų131142.8 Ų142.879%0.79479%0.787SS**  trans-71.892.7170.6177.50000107.5N296V294-N296 PolarHBondContact O-N 3.09Å; V294-N296 VanDerWaalsContact O-N 3.16Å
295A28.2Very low25Very low85 Ų85140.3 Ų140.370%0.70278%0.783SS**  trans-77.594.9166.100000108.3L293 I297L293-A295 PolarHBondContact O-N 3.07Å; A295-I297 PolarHBondContact O-N 2.88Å
296N21.6Very low25.2Very low124 Ų124142.6 Ų142.666%0.66379%0.789SS**  trans-67.290.6177.1-15815.6000109.6V294 N298V294-N296 PolarHBondContact O-N 3.09Å; V294-N296 VanDerWaalsContact O-N 3.16Å; N296-N298 PolarHBondContact OD1-OD1 3.43Å
297I27.2Very low25.1Very low139 Ų139142.5 Ų142.571%0.71379%0.786SS**  trans-97.389.6171.3-54.4-179.1000107.6A295 V299A295-I297 PolarHBondContact O-N 2.88Å; I297-V299 VanDerWaalsContact C-N 3.26Å; I297-V299 HydrophobicContact CG2-CG2 3.74Å; I297-V299 PolarHBondContact O-N 3.02Å
298N23.3Very low25.2Very low126 Ų126144 Ų14467%0.67479%0.789SS**  trans-65.384.1167.5-73.5-21.7000109.5N296 S300N296-N298 PolarHBondContact OD1-OD1 3.43Å; N298-S300 PolarHBondContact O-N 3.16Å; N298-S300 VanDerWaalsContact O-N 3.09Å
299V28.1Very low25.1Very low109 Ų109142.5 Ų142.566%0.66178%0.782SS**  trans-76.198.9167.1-178.70000107.7I297 R301I297-V299 VanDerWaalsContact C-N 3.26Å; I297-V299 HydrophobicContact CG2-CG2 3.74Å; I297-V299 PolarHBondContact O-N 3.02Å; V299-R301 PolarHBondContact O-N 3.04Å
300S24.6Very low25Very low119 Ų119145.5 Ų145.583%0.83278%0.78SS**  trans-63.5100.6170.3-600000109.4N298N298-S300 PolarHBondContact O-N 3.16Å; N298-S300 VanDerWaalsContact O-N 3.09Å
301R25.4Very low25.2Very low210 Ų210150.7 Ų150.779%0.79279%0.791SS**  trans-149.4100.3165.3-159-178-142.31140106.2V299V299-R301 PolarHBondContact O-N 3.04Å
302D23.9Very low25Very low159 Ų159148.1 Ų148.185%0.8578%0.781SS**  trans176.3103.5148.4-85.3-15.2000109.5
303K24.9Very low24.9Very low198 Ų198151 Ų15186%0.86178%0.783SS**  trans-167.482.6154.2-117.7-179.8-175.6178.20106.8
304Y23.1Very low24.6Very low227 Ų227149.9 Ų149.989%0.8978%0.778SS**SBendtrans-168.3123.1141.1-104.3-75.3000108.9
305S24.9Very low24.6Very low100 Ų100150 Ų15070%0.69978%0.779SS**  trans56.9106.1160.260.70000118.5
306E25.9Very low24.3Very low185 Ų185149.8 Ų149.886%0.86478%0.778SS**  -168.312990.2-110.4171.717200112.4H308E306-H308 PolarHBondContact O-N 3.43Å
307V23Very low24.4Very low128 Ų128148.8 Ų148.878%0.77678%0.78SS**  trans-76.9106.5164.9169.50000106.1
308H27.4Very low24.1Very low182 Ų182150.9 Ų150.984%0.84379%0.787SS**  trans-148.7110.9144.2-99.3-58.3000110.3E306E306-H308 PolarHBondContact O-N 3.43Å
309Q24.4Very low24.5Very low163 Ų163150.5 Ų150.576%0.76279%0.792SS**  trans-63.1145.2172.1-74.5172.6-3000111.4
310N21.6Very low24Very low140 Ų140152.3 Ų152.375%0.74980%0.796SS**  trans65.194.2143-59.9-17.8000117.9
311L27Very low23.9Very low177 Ų177156 Ų15693%0.92780%0.801SS**  trans-126.5115.2133.6-157.368.9000110.1
312T24.3Very low23.7Very low111 Ų111152 Ų15268%0.68180%0.795SS**  trans-66.9136.6-178.137.50000113.9
313K20.9Very low23.6Very low186 Ų186148.6 Ų148.681%0.80978%0.784SS**  48.4145127.9-70.5-176.4173.41790121.2
314N22.5Very low23.4Very low148 Ų148145.3 Ų145.379%0.79178%0.78SS**  trans100.7129.4164.2-53.4-17.2000111.7
315T24Very low23.3Very low133 Ų133142.7 Ų142.782%0.81678%0.776SS**  cis-166.7139.820.2-24.20000109.8
316A22.8Very low23.2Very low82 Ų82144.3 Ų144.368%0.67878%0.782SS**  trans52.8131.5136.100000125.4
317S22.7Very low22.9Very low103 Ų103141.5 Ų141.572%0.7278%0.777SS**  trans64.7112.1134.154.50000119.8
318E20.7Very low22.9Very low183 Ų183143.4 Ų143.486%0.85578%0.781SS**  71.9152.287.3-87.5-166.8165.300115.1
319P32.1Very low22.6Very low118 Ų118139.1 Ų139.177%0.76677%0.772SS**  cis-136.7-176.8-37.937.9-19.1000113.9
320L18.6Very low22.5Very low146 Ų146139.9 Ų139.976%0.76478%0.78SS**  trans-56.8140.2176.5-166.379.7000115.8
321E21.8Very low22.5Very low198 Ų198139.9 Ų139.993%0.92578%0.78SS**  trans-143.9130.7157.6-144.4172.7-161.600111.7
322N21.8Very low22.2Very low125 Ų125136.6 Ų136.667%0.66877%0.767SS**  trans-88.9133.5-168.9-84.8-18.7000111.8
323S21.2Very low22.1Very low88 Ų88139 Ų13962%0.61577%0.771SS**  53.3115.9100.380.20000118.5
324V21.5Very low22.2Very low129 Ų129136.5 Ų136.578%0.78277%0.771SS**  trans-140.1119.3152.9171.90000109.7
325E21.1Very low23.3Very low172 Ų172135.1 Ų135.180%0.80477%0.77SS**  trans36.1135.1142.2-59.7176.7143.300122.6
326T22Very low23.2Very low134 Ų134134.8 Ų134.882%0.82277%0.772SS**  179.6138.187.9-52.60000111.2
327V18.9Very low23.1Very low126 Ų126135.5 Ų135.576%0.76477%0.772SS**  trans-87.2149-176.51690000111.5
328I23.2Very low23.2Very low168 Ų168137.1 Ų137.186%0.86277%0.772SS**  trans-159.4130.4139.7-90.4143.1000110
329S20.6Very low23.3Very low92 Ų92134.9 Ų134.964%0.64377%0.766SS**  trans-73.8153.7177.6510000115.1
330L22.2Very low22.9Very low178 Ų178135.4 Ų135.493%0.93276%0.761SS**  trans-149.4135.6145.8-145.183.8000112.7
331N22Very low23.1Very low141 Ų141135.9 Ų135.975%0.75476%0.763SS**  trans-98.4143.3-168.1-105.40.1000112.6
332T20.9Very low23.3Very low107 Ų107135.3 Ų135.366%0.65676%0.758SS**  trans36.5129.4135.852.60000123.6
333E22Very low23.5Very low163 Ų163135.3 Ų135.376%0.76276%0.758SS**  98.5117127-79.4175.7-17000123.1
334T24.2Very low23.5Very low132 Ų132139.7 Ų139.781%0.8177%0.765SS**  trans85.2151.9135.653.30000122.3
335P44Very low23.7Very low119 Ų119140.6 Ų140.677%0.77376%0.761SS**  trans-111.5154.3-139.940.1-31.2000114.6
336C23.5Very low24Very low127 Ų127142.3 Ų142.386%0.85877%0.766SS**  trans-146.8121.4160.3-121.50000111.2
337S21.1Very low24Very low96 Ų96143.7 Ų143.767%0.67177%0.768SS**  trans-55131.4159.146.60000111.6
338N23.6Very low24.5Very low137 Ų137145.8 Ų145.873%0.73377%0.769SS**  163134124-86.3-21.9000114
339L22.9Very low24.6Very low137 Ų137142.2 Ų142.272%0.71776%0.758SS**  trans66.7133.8140.5-86.398.9000122.9
340L23.5Very low24.9Very low129 Ų129145.9 Ų145.968%0.67577%0.771SS**  trans75.8102.9141.7-72.6161.5000117
341I23.1Very low25Very low155 Ų155146.5 Ų146.580%0.79577%0.766SS**  47.496.791.8-55.1178.6000111.4
342K26.5Very low25.8Very low187 Ų187144.3 Ų144.381%0.81376%0.76SS**  trans-152.3110.1150-144.5170.7-176.1179.10110.8
343D25.5Very low26.2Very low125 Ų125147.7 Ų147.767%0.66877%0.774SS**  trans43.7114.1138.2-53.5-39.5000118.7
344K21.8Very low26.4Very low179 Ų179148.7 Ų148.778%0.77878%0.778SS**  65.6125.770.4-146.2-176.3-162.8-177.60112.4
345H25.1Very low26.6Very low148 Ų148154.2 Ų154.269%0.68578%0.784SS**  trans86.5102.4175-65.3-86.8000117.4
346F28Very low25.7Very low209 Ų209156.5 Ų156.592%0.91779%0.787SS**  -154.595.7118.5-104.1-76.5000109.6
347L22.5Very low26.1Very low163 Ų163158.1 Ų158.185%0.85379%0.785SS**  trans-80.3122.7153.2-92.7156.3000106.4
348H29.2Very low26.3Very low169 Ų169160.9 Ų160.978%0.78279%0.785SS**  trans-147.5118.8146-142.2-41.2000110.6
349S24.4Very low26.8Very low93 Ų93161.8 Ų161.865%0.6579%0.79SS**  trans-64.8144.6165.959.20000110.9
350N27.6Very low27.1Very low169 Ų169161 Ų16190%0.90479%0.787SS**  trans-141.9116.7146.3-114.2-6.3000110.6
351K23.3Very low27.4Very low192 Ų192159.8 Ų159.884%0.83579%0.788SS**  trans-110.9172.4164.4-119.5-169.8179.8179.80105
352P39.6Very low27.8Very low95 Ų95159.9 Ų159.962%0.61779%0.79SS**  cis-126.3155.8-47.231.5-14.7000111
353N29.1Very low28.1Very low177 Ų177155.7 Ų155.795%0.94778%0.784SS**  trans-108.396.8160.6-84.9-18.5000109.4
354Q25.9Very low28.1Very low185 Ų185157.7 Ų157.786%0.86479%0.794SS**  trans-80.9125.6156-86.9176.2-37.500108.3
355R28.8Very low29.1Very low248 Ų248154.9 Ų154.994%0.93679%0.794SS**  trans-140.4114.4148.2-117.5-177.3-164.5-176.24.5109.3
356M23.9Very low29.7Very low167 Ų167159.4 Ų159.482%0.82382%0.823SS**  trans-56.4131.5161.7-69159.973.900109.5
357I32.3Very low29.8Very low161 Ų161157 Ų15783%0.82682%0.819SS**  trans-133.6123.3131.4-61.8-175.1000106.2
358K25.1Very low30.2Very low154 Ų154156.6 Ų156.667%0.6782%0.817SS**  trans-103.2126.2-179.1-173.1-169.1-168.2-166.90103.5
359D33.8Very low30.3Very low156 Ų156155.9 Ų155.983%0.83482%0.819SS**  trans-147.6130.4156-88.3-36000108.9
360D30.1Very low30.6Very low121 Ų121159.6 Ų159.665%0.64783%0.829SS**  trans-80.5154.5-165.6-70.8-53.9000112.5
361S29Very low30.8Very low102 Ų102159.1 Ų159.171%0.71382%0.824SS**  trans51.1120.614163.70000120.2
362L32.3Very low31.3Very low158 Ų158156.9 Ų156.983%0.82782%0.823SS**  -165.5115.2117.1-129.477.4000112.8
363S32Very low30.7Very low99 Ų99161.3 Ų161.369%0.69284%0.838SS**  trans24129.5145.657.60000123.2
364L25.5Very low30.8Very low167 Ų167160.1 Ų160.187%0.87483%0.83SS**  trans-50.7146.9148.4-89.176.5000112.8
365P44.1Very low31.2Very low119 Ų119158 Ų15877%0.77383%0.827SS**  trans-103.6150.2148.934-22.5000111.6
366D37.9Very low31.5Very low244 Ų244149.8 Ų149.8100%1.30582%0.817SS**  trans-57.60171.5-66.9-51000114.1

Retrieved 366 of 366 residues in 133 ms (Link to these results)