G4V9D2_SCHMA Loading...

BCL domain-containing protein

AlphaFold DB , UniProt , Accession G4V9D2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 210 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
1M36.2Very low72.9Confident242 Ų24278.8 Ų78.8100%1.19242%0.424SS*.  095.80-71.3160.1107.500107.4N3M1-N3 PolarHBondContact O-N 3.28Å
2S41.6Very low74.6Confident82 Ų8274.5 Ų74.557%0.57340%0.404SS*.  trans-72.5116.7169.7159.70000107.2S4S2-S4 PolarHBondContact O-N 3.12Å
3N54Low76.1Confident113 Ų11368.9 Ų68.960%0.60437%0.374SS*.  trans-53123.1-175.6-96.9-21.8000110.3M1 T5 D6M1-N3 PolarHBondContact O-N 3.28Å; N3-T5 PolarHBondContact O-N 3.03Å; N3-D6 HydrophobicContact CB-CB 4.22Å; N3-D6 WeakPolarHBondContact O-CB 3.5Å; N3-D6 PolarHBondContact O-N 3.49Å
4S55.4Low77.5Confident70 Ų7064.1 Ų64.149%0.4935%0.348SS..Hα-helixtrans-53.9-38.1173.651.60000112.7S2 D6 F7 R8 K151S2-S4 PolarHBondContact O-N 3.12Å; S4-D6 PolarHBondContact O-N 2.65Å; S4-F7 PolarHBondContact O-N 3.23Å; S4-R8 PolarHBondContact O-N 2.94Å; S4-K151 VanDerWaalsContact CA-NZ 3.3Å
5T60.4Low78.7Confident84 Ų8459.8 Ų59.852%0.51533%0.325SS..Hα-helixtrans-58.3-29.5175.88.80000114N3 L9N3-T5 PolarHBondContact O-N 3.03Å; T5-L9 WeakPolarHBondContact O-CB 3.37Å; T5-L9 PolarHBondContact O-N 3.08Å
6D85.2Confident79.6Confident70 Ų7056.9 Ų56.937%0.37431%0.308SS..Hα-helixtrans-75.1-47-178.2-172.326.2000111.3N3 S4 R8 L9 Q10N3-D6 HydrophobicContact CB-CB 4.22Å; N3-D6 WeakPolarHBondContact O-CB 3.5Å; N3-D6 PolarHBondContact O-N 3.49Å; S4-D6 PolarHBondContact O-N 2.65Å; D6-R8 PolarHBondContact O-N 3.24Å; D6-L9 PolarHBondContact O-N 3.38Å; D6-Q10 VanDerWaalsContact O-CG 3.29Å; D6-Q10 WeakPolarHBondContact O-CG 3.35Å; D6-Q10 PolarHBondContact O-N 3.06Å; D6-Q10 PolarHBondContact OD1-NE2 3.13Å; D6-Q10 PolarHBondContact OD2-NE2 3.46Å; D6-Q10 VanDerWaalsContact OD2-NE2 3.08Å
7F93.3Very high80.4Confident4 Ų454.5 Ų54.52%0.01830%0.297CS..Hα-helixtrans-64.6-42.6-177.9-173.4-91000113S4 L9 Q10 T11 D147 K151 I154 W160S4-F7 PolarHBondContact O-N 3.23Å; F7-L9 VanDerWaalsContact C-N 3.32Å; F7-L9 PolarHBondContact O-N 3.48Å; F7-Q10 PolarHBondContact O-N 3.11Å; F7-T11 WeakPolarHBondContact CE1-OG1 3.47Å; F7-T11 WeakPolarHBondContact O-CB 3.37Å; F7-T11 PolarHBondContact O-N 3.07Å; F7-T11 PolarHBondContact O-OG1 3.23Å; F7-D147 HydrophobicContact CD1-CB 4.34Å; F7-K151 HydrophobicContact CB-CD 3.77Å; F7-K151 HydrophobicContact CB-CG 4.3Å; F7-K151 HydrophobicContact CD1-CB 3.78Å; F7-K151 HydrophobicContact CD1-CD 3.86Å; F7-K151 HydrophobicContact CD1-CG 3.76Å; F7-K151 HydrophobicContact CD2-CD 4.42Å; F7-K151 HydrophobicContact CD2-CG 4.03Å; F7-K151 HydrophobicContact CE1-CB 3.73Å; F7-K151 HydrophobicContact CE1-CG 4.08Å; F7-K151 HydrophobicContact CE2-CG 4.32Å; F7-K151 HydrophobicContact CG-CB 4.28Å; F7-K151 HydrophobicContact CG-CD 3.74Å; F7-K151 HydrophobicContact CG-CG 3.74Å; F7-K151 HydrophobicContact CZ-CB 4.19Å; F7-K151 HydrophobicContact CZ-CG 4.35Å; F7-I154 HydrophobicContact CE2-CB 4.27Å; F7-I154 HydrophobicContact CE2-CG2 3.68Å; F7-I154 HydrophobicContact CZ-CB 4.05Å; F7-I154 HydrophobicContact CZ-CD1 3.77Å; F7-I154 HydrophobicContact CZ-CG2 3.8Å; F7-W160 HydrophobicContact CE1-CZ2 4.35Å; F7-W160 AromaticContact CE1-NE1 3.98Å; F7-W160 AromaticContact CE2-CD1 3.69Å; F7-W160 AromaticContact CE2-NE1 3.36Å; F7-W160 AromaticContact CZ-CE2 3.66Å; F7-W160 AromaticContact CZ-CZ2 3.89Å; F7-W160 HydrophobicContact CZ-CZ2 3.89Å; F7-W160 AromaticContact CZ-NE1 3.3Å; F7-W160 VanDerWaalsContact CZ-NE1 3.3Å
8R94.1Very high81.2Confident98 Ų9851.5 Ų51.537%0.3728%0.28SS..Hα-helixtrans-61.5-43175.6-171.1172.367.9-162.11.3111.4S4 D6 T11 S12 D147S4-R8 PolarHBondContact O-N 2.94Å; D6-R8 PolarHBondContact O-N 3.24Å; R8-T11 PolarHBondContact O-N 3.43Å; R8-S12 PolarHBondContact O-N 3.42Å; R8-D147 HydrophobicContact CB-CB 3.87Å; R8-D147 HydrophobicContact CG-CB 4.23Å
9L92Very high81.8Confident75 Ų7549 Ų4939%0.39327%0.267SS..Hα-helixtrans-64.1-47.5178-178.961.3000111.1T5 D6 F7 T11 S12 V13T5-L9 WeakPolarHBondContact O-CB 3.37Å; T5-L9 PolarHBondContact O-N 3.08Å; D6-L9 PolarHBondContact O-N 3.38Å; F7-L9 VanDerWaalsContact C-N 3.32Å; F7-L9 PolarHBondContact O-N 3.48Å; L9-T11 VanDerWaalsContact C-N 3.28Å; L9-T11 PolarHBondContact O-N 3.02Å; L9-S12 WeakPolarHBondContact O-CB 3.36Å; L9-S12 PolarHBondContact O-N 2.92Å; L9-S12 VanDerWaalsContact O-N 3.12Å; L9-V13 HydrophobicContact CD1-CG2 4.44Å; L9-V13 WeakPolarHBondContact O-CG2 3.31Å; L9-V13 PolarHBondContact O-N 2.87Å
10Q93.6Very high82.3Confident29 Ų2948.8 Ų48.814%0.13627%0.265CS..Hα-helixtrans-55.5-44.8175.1-7117311.100111.5D6 F7 S12 V13 L14 V45D6-Q10 VanDerWaalsContact O-CG 3.29Å; D6-Q10 WeakPolarHBondContact O-CG 3.35Å; D6-Q10 PolarHBondContact O-N 3.06Å; D6-Q10 PolarHBondContact OD1-NE2 3.13Å; D6-Q10 PolarHBondContact OD2-NE2 3.46Å; D6-Q10 VanDerWaalsContact OD2-NE2 3.08Å; F7-Q10 PolarHBondContact O-N 3.11Å; Q10-S12 PolarHBondContact O-N 3.38Å; Q10-V13 PolarHBondContact O-N 2.99Å; Q10-L14 WeakPolarHBondContact O-CB 3.27Å; Q10-L14 WeakPolarHBondContact O-CG 3.46Å; Q10-L14 PolarHBondContact O-N 3.27Å; Q10-V45 HydrophobicContact CB-CG2 4.04Å; Q10-V45 HydrophobicContact CG-CG2 4.15Å
11T95.5Very high82.8Confident0 Ų049 Ų490%027%0.274CS..Hα-helixtrans-63.3-42178-52.60000111.8F7 R8 L9 L14 C15 W160F7-T11 WeakPolarHBondContact CE1-OG1 3.47Å; F7-T11 WeakPolarHBondContact O-CB 3.37Å; F7-T11 PolarHBondContact O-N 3.07Å; F7-T11 PolarHBondContact O-OG1 3.23Å; R8-T11 PolarHBondContact O-N 3.43Å; L9-T11 VanDerWaalsContact C-N 3.28Å; L9-T11 PolarHBondContact O-N 3.02Å; T11-L14 PolarHBondContact O-N 2.78Å; T11-C15 PolarHBondContact O-N 3.5Å; T11-C15 PolarHBondContact O-SG 3.21Å; T11-W160 HydrophobicContact CG2-CH2 4.37Å; T11-W160 HydrophobicContact CG2-CZ2 3.61Å; T11-W160 WeakPolarHBondContact OG1-CZ2 3.43Å; T11-W160 PolarHBondContact OG1-NE1 2.84Å; T11-W160 VanDerWaalsContact OG1-NE1 3.1Å
12S94.3Very high85.4Confident27 Ų2738.1 Ų38.119%0.18922%0.221CC..Hα-helixtrans-61.3-46.6175.8-168.10000111.2R8 L9 Q10 L14 C15 H16R8-S12 PolarHBondContact O-N 3.42Å; L9-S12 WeakPolarHBondContact O-CB 3.36Å; L9-S12 PolarHBondContact O-N 2.92Å; L9-S12 VanDerWaalsContact O-N 3.12Å; Q10-S12 PolarHBondContact O-N 3.38Å; S12-L14 VanDerWaalsContact C-N 3.33Å; S12-L14 PolarHBondContact O-N 2.9Å; S12-C15 WeakPolarHBondContact O-CB 3.45Å; S12-C15 PolarHBondContact O-N 3.35Å; S12-H16 PolarHBondContact O-CD2 3.43Å; S12-H16 VanDerWaalsContact O-CD2 3.24Å; S12-H16 PolarHBondContact O-N 3.49Å
13V93.6Very high87.6Confident2 Ų235.4 Ų35.41%0.01220%0.201CC..Hα-helixtrans-60-43.1176.9171.20000111.2L9 Q10 H16 S17 N39 L42 V45L9-V13 HydrophobicContact CD1-CG2 4.44Å; L9-V13 WeakPolarHBondContact O-CG2 3.31Å; L9-V13 PolarHBondContact O-N 2.87Å; Q10-V13 PolarHBondContact O-N 2.99Å; V13-H16 PolarHBondContact O-N 3.5Å; V13-S17 VanDerWaalsContact O-CB 3.29Å; V13-S17 WeakPolarHBondContact O-CB 3.35Å; V13-S17 PolarHBondContact O-N 2.92Å; V13-S17 PolarHBondContact O-OG 3.42Å; V13-N39 WeakPolarHBondContact CG2-O 3.29Å; V13-L42 HydrophobicContact CG1-CB 4.45Å; V13-L42 HydrophobicContact CG1-CD1 4Å; V13-V45 HydrophobicContact CB-CG2 4.01Å; V13-V45 HydrophobicContact CG1-CG2 3.78Å
14L95.5Very high88.9Confident1 Ų134.1 Ų34.11%0.00520%0.195CC..Hα-helixtrans-62.2-43.7175.3-75174.1000111.9Q10 T11 S12 S17 F18 L42 V45 I51 I52 W160Q10-L14 WeakPolarHBondContact O-CB 3.27Å; Q10-L14 WeakPolarHBondContact O-CG 3.46Å; Q10-L14 PolarHBondContact O-N 3.27Å; T11-L14 PolarHBondContact O-N 2.78Å; S12-L14 VanDerWaalsContact C-N 3.33Å; S12-L14 PolarHBondContact O-N 2.9Å; L14-S17 PolarHBondContact O-N 2.9Å; L14-F18 WeakPolarHBondContact O-CB 3.46Å; L14-F18 PolarHBondContact O-N 3Å; L14-L42 HydrophobicContact CD2-CD1 4.06Å; L14-V45 HydrophobicContact CD1-CG1 4.21Å; L14-V45 HydrophobicContact CD2-CG1 4.06Å; L14-V45 HydrophobicContact CG-CG1 4.12Å; L14-V45 HydrophobicContact CG-CG2 4.32Å; L14-I51 HydrophobicContact CD1-CG2 4.25Å; L14-I51 HydrophobicContact CD2-CB 4.23Å; L14-I51 HydrophobicContact CD2-CG2 3.71Å; L14-I52 HydrophobicContact CD2-CD1 3.86Å; L14-I52 HydrophobicContact CD2-CG1 4.27Å; L14-W160 HydrophobicContact CD1-CB 3.83Å; L14-W160 HydrophobicContact CD1-CD2 3.57Å; L14-W160 HydrophobicContact CD1-CE3 4.12Å; L14-W160 HydrophobicContact CD1-CG 3.43Å; L14-W160 VanDerWaalsContact CD1-CG 3.43Å
15C95.5Very high89.9Confident0 Ų040.3 Ų40.30%021%0.213CC..Hα-helixtrans-58.8-51.2176.4-68.50000111.4T11 S12 F18 L19 L119 I139T11-C15 PolarHBondContact O-N 3.5Å; T11-C15 PolarHBondContact O-SG 3.21Å; S12-C15 WeakPolarHBondContact O-CB 3.45Å; S12-C15 PolarHBondContact O-N 3.35Å; C15-F18 PolarHBondContact O-N 3.29Å; C15-L19 WeakPolarHBondContact O-CB 3.3Å; C15-L19 WeakPolarHBondContact O-CD1 3.47Å; C15-L19 WeakPolarHBondContact O-CG 3.43Å; C15-L19 PolarHBondContact O-N 2.93Å; C15-L119 HydrophobicContact CB-CD2 4.31Å; C15-I139 HydrophobicContact CB-CG2 3.86Å
16H92.9Very high90.5Very high14 Ų1444.1 Ų44.17%0.06523%0.225CC..Hα-helixtrans-59.3-51.3178.2-80.8-79.1000111.9S12 V13 F18 L19 L20 T40S12-H16 PolarHBondContact O-CD2 3.43Å; S12-H16 VanDerWaalsContact O-CD2 3.24Å; S12-H16 PolarHBondContact O-N 3.49Å; V13-H16 PolarHBondContact O-N 3.5Å; H16-F18 VanDerWaalsContact C-N 3.33Å; H16-F18 PolarHBondContact O-N 3.48Å; H16-L19 PolarHBondContact O-N 3.1Å; H16-L20 WeakPolarHBondContact O-CB 3.37Å; H16-L20 WeakPolarHBondContact O-CG 3.27Å; H16-L20 PolarHBondContact O-N 3.05Å; H16-T40 HydrophobicContact CB-CG2 3.59Å
17S92.7Very high90.2Very high16 Ų1642 Ų4211%0.11221%0.213CC..Hα-helixtrans-62.3-41.2-177.3-600000111.9V13 L14 A21V13-S17 VanDerWaalsContact O-CB 3.29Å; V13-S17 WeakPolarHBondContact O-CB 3.35Å; V13-S17 PolarHBondContact O-N 2.92Å; V13-S17 PolarHBondContact O-OG 3.42Å; L14-S17 PolarHBondContact O-N 2.9Å; S17-A21 VanDerWaalsContact O-CB 3.22Å; S17-A21 WeakPolarHBondContact O-CB 3.45Å; S17-A21 PolarHBondContact O-N 3.43Å
18F95.1Very high89.5Confident0 Ų042.8 Ų42.80%022%0.221CC..Hα-helixtrans-65.3-47.5176.6166-107.6000111.7L14 C15 H16 A21 S22 I52 L55 L56 V59 F116 R120L14-F18 WeakPolarHBondContact O-CB 3.46Å; L14-F18 PolarHBondContact O-N 3Å; C15-F18 PolarHBondContact O-N 3.29Å; H16-F18 VanDerWaalsContact C-N 3.33Å; H16-F18 PolarHBondContact O-N 3.48Å; F18-A21 PolarHBondContact O-N 3.34Å; F18-S22 WeakPolarHBondContact O-CB 3.36Å; F18-S22 PolarHBondContact O-N 3.38Å; F18-S22 PolarHBondContact O-OG 2.94Å; F18-S22 VanDerWaalsContact O-OG 3.05Å; F18-I52 HydrophobicContact CB-CD1 3.77Å; F18-L55 HydrophobicContact CB-CD2 3.91Å; F18-L55 HydrophobicContact CD1-CD2 4.3Å; F18-L55 HydrophobicContact CD2-CB 4.35Å; F18-L55 HydrophobicContact CD2-CD2 3.62Å; F18-L55 HydrophobicContact CD2-CG 3.75Å; F18-L55 HydrophobicContact CE2-CD2 4.23Å; F18-L55 HydrophobicContact CE2-CG 3.97Å; F18-L55 HydrophobicContact CG-CD2 3.66Å; F18-L55 HydrophobicContact CG-CG 4.29Å; F18-L56 HydrophobicContact CD2-CD2 3.99Å; F18-L56 HydrophobicContact CD2-CG 4.34Å; F18-L56 HydrophobicContact CE2-CD2 3.95Å; F18-V59 HydrophobicContact CE2-CB 4.13Å; F18-V59 HydrophobicContact CE2-CG1 4.46Å; F18-V59 HydrophobicContact CE2-CG2 3.91Å; F18-V59 HydrophobicContact CZ-CB 4.04Å; F18-V59 HydrophobicContact CZ-CG1 3.96Å; F18-V59 HydrophobicContact CZ-CG2 3.7Å; F18-F116 HydrophobicContact CD1-CB 4.34Å; F18-F116 AromaticContact CD1-CD1 3.81Å; F18-F116 HydrophobicContact CD1-CD1 3.81Å; F18-F116 HydrophobicContact CE1-CB 3.94Å; F18-F116 HydrophobicContact CE1-CD1 4.25Å; F18-F116 WeakPolarHBondContact CE1-O 3.32Å; F18-F116 HydrophobicContact CG-CD1 4.34Å; F18-F116 HydrophobicContact CZ-CB 4.34Å; F18-R120 HydrophobicContact CE1-CB 3.91Å; F18-R120 HydrophobicContact CZ-CB 4.29Å
19L93.8Very high88.7Confident4 Ų441.3 Ų41.32%0.02123%0.225CC..Hα-helixtrans-58.5-52.9179.3-72.4168000109.9C15 H16 A21 S22 T23 L31 L119 R120 V123 I139C15-L19 WeakPolarHBondContact O-CB 3.3Å; C15-L19 WeakPolarHBondContact O-CD1 3.47Å; C15-L19 WeakPolarHBondContact O-CG 3.43Å; C15-L19 PolarHBondContact O-N 2.93Å; H16-L19 PolarHBondContact O-N 3.1Å; L19-A21 VanDerWaalsContact C-N 3.34Å; L19-A21 PolarHBondContact O-N 2.86Å; L19-S22 PolarHBondContact O-N 2.91Å; L19-S22 PolarHBondContact O-OG 3.33Å; L19-T23 VanDerWaalsContact O-CG2 3.22Å; L19-T23 WeakPolarHBondContact O-CG2 3.33Å; L19-T23 PolarHBondContact O-N 3.14Å; L19-L31 HydrophobicContact CB-CD1 4.46Å; L19-L119 HydrophobicContact CD1-CD2 4.43Å; L19-R120 HydrophobicContact CD2-CB 3.99Å; L19-R120 HydrophobicContact CD2-CG 4.35Å; L19-V123 HydrophobicContact CD1-CG1 4.26Å; L19-V123 HydrophobicContact CD1-CG2 4.05Å; L19-V123 HydrophobicContact CD2-CB 3.98Å; L19-V123 HydrophobicContact CD2-CG1 4.06Å; L19-V123 HydrophobicContact CD2-CG2 4.15Å; L19-I139 HydrophobicContact CD1-CD1 3.67Å; L19-I139 HydrophobicContact CD1-CG1 3.84Å
20L91.4Very high88.3Confident44 Ų4440.8 Ų40.823%0.2322%0.218CC..Hα-helixtrans-55.7-44.4177-70.9171.7000113H16 S22 T23 L31 T32 A35H16-L20 WeakPolarHBondContact O-CB 3.37Å; H16-L20 WeakPolarHBondContact O-CG 3.27Å; H16-L20 PolarHBondContact O-N 3.05Å; L20-S22 PolarHBondContact O-N 2.85Å; L20-T23 PolarHBondContact O-OG1 3.34Å; L20-L31 HydrophobicContact CD2-CB 3.66Å; L20-T32 WeakPolarHBondContact CD2-OG1 3.19Å; L20-A35 HydrophobicContact CD1-CB 4.15Å
21A91.8Very high87.9Confident55 Ų5539.8 Ų39.846%0.45521%0.214SC..Hα-helixtrans-75-12.3-179.100000113.8S17 F18 L19 I52 L56S17-A21 VanDerWaalsContact O-CB 3.22Å; S17-A21 WeakPolarHBondContact O-CB 3.45Å; S17-A21 PolarHBondContact O-N 3.43Å; F18-A21 PolarHBondContact O-N 3.34Å; L19-A21 VanDerWaalsContact C-N 3.34Å; L19-A21 PolarHBondContact O-N 2.86Å; A21-I52 HydrophobicContact CB-CG2 4.06Å; A21-L56 HydrophobicContact CB-CD1 3.91Å; A21-L56 HydrophobicContact CB-CD2 4.34Å
22S91.1Very high87.2Confident12 Ų1242.4 Ų42.48%0.08423%0.23CC..Hα-helixtrans-105.9-1.9-174.476.70000114.3F18 L19 L20 R120F18-S22 WeakPolarHBondContact O-CB 3.36Å; F18-S22 PolarHBondContact O-N 3.38Å; F18-S22 PolarHBondContact O-OG 2.94Å; F18-S22 VanDerWaalsContact O-OG 3.05Å; L19-S22 PolarHBondContact O-N 2.91Å; L19-S22 PolarHBondContact O-OG 3.33Å; L20-S22 PolarHBondContact O-N 2.85Å; S22-R120 VanDerWaalsContact CB-NE 3.34Å; S22-R120 VanDerWaalsContact O-CZ 3.24Å; S22-R120 PolarHBondContact O-NE 3.35Å; S22-R120 PolarHBondContact O-NH2 2.91Å; S22-R120 VanDerWaalsContact OG-CD 3.22Å; S22-R120 WeakPolarHBondContact OG-CD 3.37Å; S22-R120 PolarHBondContact OG-NE 3.14Å; S22-R120 VanDerWaalsContact OG-NE 3.11Å
23T87.3Confident86.6Confident25 Ų2545.8 Ų45.815%0.15325%0.246CC..SBendtrans-100.3163.7-177.759.40000112.8L19 L20 D27 A28 L31 L124L19-T23 VanDerWaalsContact O-CG2 3.22Å; L19-T23 WeakPolarHBondContact O-CG2 3.33Å; L19-T23 PolarHBondContact O-N 3.14Å; L20-T23 PolarHBondContact O-OG1 3.34Å; T23-D27 HydrophobicContact CG2-CB 4.2Å; T23-A28 WeakPolarHBondContact OG1-CA 3.33Å; T23-A28 WeakPolarHBondContact OG1-CB 3.48Å; T23-A28 PolarHBondContact OG1-N 2.9Å; T23-L31 HydrophobicContact CG2-CD1 3.53Å; T23-L124 HydrophobicContact CG2-CD2 3.42Å; T23-L124 VanDerWaalsContact CG2-CD2 3.42Å; T23-L124 HydrophobicContact CG2-CG 4.43Å
24N83Confident85.9Confident87 Ų8746.4 Ų46.447%0.46525%0.249SC..  trans-72.5170.5169.467.949.5000110Q26 D27 A28N24-Q26 VanDerWaalsContact C-N 3.26Å; N24-Q26 PolarHBondContact O-N 3.35Å; N24-Q26 WeakPolarHBondContact OD1-CB 3.44Å; N24-Q26 PolarHBondContact OD1-N 3.22Å; N24-D27 PolarHBondContact ND2-OD2 2.91Å; N24-D27 PolarHBondContact O-N 3.17Å; N24-D27 PolarHBondContact OD1-N 3.35Å; N24-D27 PolarHBondContact OD1-OD2 3.1Å; N24-A28 WeakPolarHBondContact O-CB 3.4Å; N24-A28 PolarHBondContact O-N 3.45Å
25K75.5Confident84.9Confident200 Ų20046.4 Ų46.487%0.8725%0.249SC*.Hα-helixtrans-57.7-33.9-176.9-69.6-173.6178.2-177.90114.3S29K25-S29 PolarHBondContact O-N 3.33Å
26Q74Confident83.5Confident164 Ų16452.2 Ų52.277%0.76628%0.281SS*.Hα-helixtrans-74.5-50.6-176.9-174.7173.7-0.200111N24 A28 S29N24-Q26 VanDerWaalsContact C-N 3.26Å; N24-Q26 PolarHBondContact O-N 3.35Å; N24-Q26 WeakPolarHBondContact OD1-CB 3.44Å; N24-Q26 PolarHBondContact OD1-N 3.22Å; Q26-A28 VanDerWaalsContact C-N 3.26Å; Q26-A28 PolarHBondContact O-N 3.21Å; Q26-S29 PolarHBondContact O-N 2.79Å
27D77.9Confident81.8Confident24 Ų2457.7 Ų57.713%0.12831%0.31CS..Hα-helixtrans-64.9-33.4176.6-63.1-27.1000111.2T23 N24 S29 Y30 L31 L124T23-D27 HydrophobicContact CG2-CB 4.2Å; N24-D27 PolarHBondContact ND2-OD2 2.91Å; N24-D27 PolarHBondContact O-N 3.17Å; N24-D27 PolarHBondContact OD1-N 3.35Å; N24-D27 PolarHBondContact OD1-OD2 3.1Å; D27-S29 PolarHBondContact O-N 3.13Å; D27-Y30 PolarHBondContact O-N 3.09Å; D27-L31 WeakPolarHBondContact O-CB 2.88Å; D27-L31 WeakPolarHBondContact O-CG 3.49Å; D27-L31 PolarHBondContact O-N 2.83Å; D27-L124 HydrophobicContact CB-CD2 4.24Å
28A77.9Confident80.3Confident22 Ų2259.5 Ų59.518%0.18232%0.321CS..Hα-helixtrans-60.6-41.317500000112.3T23 N24 Q26 L31 T32T23-A28 WeakPolarHBondContact OG1-CA 3.33Å; T23-A28 WeakPolarHBondContact OG1-CB 3.48Å; T23-A28 PolarHBondContact OG1-N 2.9Å; N24-A28 WeakPolarHBondContact O-CB 3.4Å; N24-A28 PolarHBondContact O-N 3.45Å; Q26-A28 VanDerWaalsContact C-N 3.26Å; Q26-A28 PolarHBondContact O-N 3.21Å; A28-L31 PolarHBondContact O-N 2.99Å; A28-T32 VanDerWaalsContact O-CB 3.28Å; A28-T32 WeakPolarHBondContact O-CB 3.22Å; A28-T32 PolarHBondContact O-N 2.85Å; A28-T32 PolarHBondContact O-OG1 3.35Å
29S78.4Confident78.8Confident67 Ų6764.5 Ų64.547%0.46935%0.347SS..Hα-helixtrans-60.2-51.1177.5-169.50000111.1K25 Q26 D27 L31 T32 D33K25-S29 PolarHBondContact O-N 3.33Å; Q26-S29 PolarHBondContact O-N 2.79Å; D27-S29 PolarHBondContact O-N 3.13Å; S29-L31 VanDerWaalsContact C-N 3.33Å; S29-L31 PolarHBondContact O-N 3.13Å; S29-T32 WeakPolarHBondContact O-CB 3.29Å; S29-T32 PolarHBondContact O-N 3.43Å; S29-T32 VanDerWaalsContact O-N 3.11Å; S29-D33 VanDerWaalsContact O-CG 3.32Å; S29-D33 PolarHBondContact O-N 3.09Å
30Y83.7Confident77.7Confident63 Ų6366.1 Ų66.125%0.24736%0.358CS..Hα-helixtrans-59.9-43179.4174.4-98.7000112.4D27 T32 L34 G130 S132 I135D27-Y30 PolarHBondContact O-N 3.09Å; Y30-T32 VanDerWaalsContact C-N 3.32Å; Y30-L34 PolarHBondContact O-N 3.23Å; Y30-L34 VanDerWaalsContact O-N 3.17Å; Y30-G130 VanDerWaalsContact OH-CA 3.3Å; Y30-G130 WeakPolarHBondContact OH-CA 3.18Å; Y30-G130 PolarHBondContact OH-O 2.89Å; Y30-S132 VanDerWaalsContact OH-CA 3.29Å; Y30-S132 WeakPolarHBondContact OH-CA 3.28Å; Y30-S132 VanDerWaalsContact OH-CB 3.28Å; Y30-S132 WeakPolarHBondContact OH-CB 3.43Å; Y30-S132 PolarHBondContact OH-N 2.83Å; Y30-S132 VanDerWaalsContact OH-N 3.1Å; Y30-I135 HydrophobicContact CE1-CD1 3.82Å
31L84.6Confident77.4Confident8 Ų867.3 Ų67.34%0.04236%0.364CS..Hα-helixtrans-71.5-27.2177.4-67.9178.1000112.9L19 L20 T23 D27 A28 S29 L34 A35 V123 I135L19-L31 HydrophobicContact CB-CD1 4.46Å; L20-L31 HydrophobicContact CD2-CB 3.66Å; T23-L31 HydrophobicContact CG2-CD1 3.53Å; D27-L31 WeakPolarHBondContact O-CB 2.88Å; D27-L31 WeakPolarHBondContact O-CG 3.49Å; D27-L31 PolarHBondContact O-N 2.83Å; A28-L31 PolarHBondContact O-N 2.99Å; S29-L31 VanDerWaalsContact C-N 3.33Å; S29-L31 PolarHBondContact O-N 3.13Å; L31-L34 HydrophobicContact CD2-CD2 4.37Å; L31-L34 WeakPolarHBondContact O-CB 3.41Å; L31-L34 PolarHBondContact O-N 2.9Å; L31-A35 VanDerWaalsContact O-CB 3.25Å; L31-A35 WeakPolarHBondContact O-CB 3.38Å; L31-A35 PolarHBondContact O-N 3.33Å; L31-V123 HydrophobicContact CD1-CG1 4.14Å; L31-V123 HydrophobicContact CD2-CG1 3.8Å; L31-I135 HydrophobicContact CD2-CD1 4.23Å; L31-I135 HydrophobicContact CD2-CG2 4.25Å
32T82Confident77.1Confident55 Ų5566.4 Ų66.434%0.33735%0.352SS..Hα-helixtrans-70.2-47.6176.4-590000109.8L20 A28 S29 Y30 L34 A35 D36L20-T32 WeakPolarHBondContact CD2-OG1 3.19Å; A28-T32 VanDerWaalsContact O-CB 3.28Å; A28-T32 WeakPolarHBondContact O-CB 3.22Å; A28-T32 PolarHBondContact O-N 2.85Å; A28-T32 PolarHBondContact O-OG1 3.35Å; S29-T32 WeakPolarHBondContact O-CB 3.29Å; S29-T32 PolarHBondContact O-N 3.43Å; S29-T32 VanDerWaalsContact O-N 3.11Å; Y30-T32 VanDerWaalsContact C-N 3.32Å; T32-L34 PolarHBondContact O-N 3.49Å; T32-A35 CarbonylContact O-C 3.54Å; T32-A35 WeakPolarHBondContact O-CA 3.47Å; T32-A35 WeakPolarHBondContact O-CB 3.12Å; T32-A35 PolarHBondContact O-N 3.29Å; T32-D36 PolarHBondContact O-N 3.24Å
33D80.8Confident76.8Confident99 Ų9971.4 Ų71.453%0.52938%0.382SS..Hα-helixtrans-58.7-34.2175-60.6-20.2000111.4S29 N37S29-D33 VanDerWaalsContact O-CG 3.32Å; S29-D33 PolarHBondContact O-N 3.09Å; D33-N37 PolarHBondContact O-ND2 3.1Å
34L78Confident76.6Confident14 Ų1475.2 Ų75.27%0.07340%0.397CS..Hα-helixtrans-68.9-37.5174.1-167.266.6000112.4Y30 L31 T32 I135 K136Y30-L34 PolarHBondContact O-N 3.23Å; Y30-L34 VanDerWaalsContact O-N 3.17Å; L31-L34 HydrophobicContact CD2-CD2 4.37Å; L31-L34 WeakPolarHBondContact O-CB 3.41Å; L31-L34 PolarHBondContact O-N 2.9Å; T32-L34 PolarHBondContact O-N 3.49Å; L34-I135 HydrophobicContact CD2-CB 3.99Å; L34-I135 HydrophobicContact CD2-CG2 3.54Å; L34-K136 HydrophobicContact CD1-CD 3.89Å; L34-K136 HydrophobicContact CD1-CG 4.08Å; L34-K136 HydrophobicContact CD2-CG 4.3Å; L34-K136 HydrophobicContact CG-CG 4.24Å
35A75.9Confident77Confident1 Ų171.3 Ų71.31%0.00838%0.376CS..Hα-helixtrans-77.9-29.6-176.200000113.5L20 L31 T32 N37 T38 T40L20-A35 HydrophobicContact CD1-CB 4.15Å; L31-A35 VanDerWaalsContact O-CB 3.25Å; L31-A35 WeakPolarHBondContact O-CB 3.38Å; L31-A35 PolarHBondContact O-N 3.33Å; T32-A35 CarbonylContact O-C 3.54Å; T32-A35 WeakPolarHBondContact O-CA 3.47Å; T32-A35 WeakPolarHBondContact O-CB 3.12Å; T32-A35 PolarHBondContact O-N 3.29Å; A35-N37 PolarHBondContact O-N 3.5Å; A35-T38 WeakPolarHBondContact CA-OG1 3.27Å; A35-T38 CarbonylContact O-C 3.56Å; A35-T38 WeakPolarHBondContact O-CA 3.27Å; A35-T38 PolarHBondContact O-N 3.22Å; A35-T38 PolarHBondContact O-OG1 3.42Å; A35-T40 HydrophobicContact CB-CG2 3.96Å
36D65.6Low77.8Confident123 Ų12365.5 Ų65.566%0.65836%0.359SS*.THydrogen-bonded Turntrans-59.4-15.9-179.7-78.1-12.3000113.6T32T32-D36 PolarHBondContact O-N 3.24Å
37N57.3Low78.7Confident128 Ų12861.9 Ų61.968%0.68434%0.344SS*.THydrogen-bonded Turntrans-91.84174.1-65-66.7000114.1D33 A35D33-N37 PolarHBondContact O-ND2 3.1Å; A35-N37 PolarHBondContact O-N 3.5Å
38T60.5Low79.5Confident55 Ų5560.9 Ų60.934%0.33734%0.34SS..SBendtrans-135.9138.9-173.430.60000110A35 T40A35-T38 WeakPolarHBondContact CA-OG1 3.27Å; A35-T38 CarbonylContact O-C 3.56Å; A35-T38 WeakPolarHBondContact O-CA 3.27Å; A35-T38 PolarHBondContact O-N 3.22Å; A35-T38 PolarHBondContact O-OG1 3.42Å; T38-T40 WeakPolarHBondContact O-CG2 3.35Å; T38-T40 PolarHBondContact O-N 2.98Å
39N64.2Low80.2Confident104 Ų10465.9 Ų65.956%0.55636%0.36SS*.  trans-69.698.8-179.5-159.20.2000109.4V13V13-N39 WeakPolarHBondContact CG2-O 3.29Å
40T71.7Confident81Confident39 Ų3966.5 Ų66.524%0.23936%0.355CS..  trans-106.713.2-173.549.20000113.2H16 A35 T38 L42H16-T40 HydrophobicContact CB-CG2 3.59Å; A35-T40 HydrophobicContact CB-CG2 3.96Å; T38-T40 WeakPolarHBondContact O-CG2 3.35Å; T38-T40 PolarHBondContact O-N 2.98Å; T40-L42 PolarHBondContact O-N 2.92Å
41D83.8Confident81.6Confident68 Ų6863.5 Ų63.536%0.36434%0.343SS..  trans-66106.5-177.3-179.11.5000111.1T43 F44D41-T43 PolarHBondContact O-N 3.19Å; D41-T43 VanDerWaalsContact O-N 3.16Å; D41-T43 VanDerWaalsContact OD1-CB 3.26Å; D41-T43 WeakPolarHBondContact OD1-CB 3.37Å; D41-T43 VanDerWaalsContact OD1-CG2 3.23Å; D41-T43 WeakPolarHBondContact OD1-CG2 3.4Å; D41-T43 PolarHBondContact OD1-N 3.05Å; D41-T43 PolarHBondContact OD1-OG1 3.26Å; D41-T43 PolarHBondContact OD2-OG1 3Å; D41-F44 HydrophobicContact CB-CD2 3.69Å; D41-F44 HydrophobicContact CB-CE2 3.82Å; D41-F44 WeakPolarHBondContact O-CD2 3.27Å; D41-F44 PolarHBondContact O-N 3.37Å
42L86Confident82.2Confident36 Ų3663.7 Ų63.719%0.18834%0.344CS..G310 helixtrans-66.2-14.3-178.4-168.360.7000112.5V13 L14 T40 F44 V45 Q49 I52V13-L42 HydrophobicContact CG1-CB 4.45Å; V13-L42 HydrophobicContact CG1-CD1 4Å; L14-L42 HydrophobicContact CD2-CD1 4.06Å; T40-L42 PolarHBondContact O-N 2.92Å; L42-F44 PolarHBondContact O-N 3.25Å; L42-V45 HydrophobicContact CD1-CB 4.28Å; L42-V45 HydrophobicContact CD1-CG2 4.26Å; L42-V45 PolarHBondContact O-N 2.74Å; L42-Q49 HydrophobicContact CD2-CG 4.09Å; L42-I52 HydrophobicContact CD1-CG1 4.16Å; L42-I52 HydrophobicContact CD2-CG1 3.89Å
43T84.4Confident82.8Confident118 Ų11867 Ų6772%0.72435%0.354SS*.G310 helixtrans-66.8-19.7175.569.90000112.9D41 V45D41-T43 PolarHBondContact O-N 3.19Å; D41-T43 VanDerWaalsContact O-N 3.16Å; D41-T43 VanDerWaalsContact OD1-CB 3.26Å; D41-T43 WeakPolarHBondContact OD1-CB 3.37Å; D41-T43 VanDerWaalsContact OD1-CG2 3.23Å; D41-T43 WeakPolarHBondContact OD1-CG2 3.4Å; D41-T43 PolarHBondContact OD1-N 3.05Å; D41-T43 PolarHBondContact OD1-OG1 3.26Å; D41-T43 PolarHBondContact OD2-OG1 3Å; T43-V45 PolarHBondContact O-N 2.83Å
44F83.1Confident83.5Confident105 Ų10562.8 Ų62.846%0.46133%0.332SS..G310 helixtrans-71-16.2171.7-74.5-83.6000113.3D41 L42D41-F44 HydrophobicContact CB-CD2 3.69Å; D41-F44 HydrophobicContact CB-CE2 3.82Å; D41-F44 WeakPolarHBondContact O-CD2 3.27Å; D41-F44 PolarHBondContact O-N 3.37Å; L42-F44 PolarHBondContact O-N 3.25Å
45V91.4Very high84.3Confident4 Ų462.1 Ų62.12%0.02433%0.329CS..SBendtrans-101.3116.2179.3-172.10000109Q10 V13 L14 L42 T43 N47 G48 I51Q10-V45 HydrophobicContact CB-CG2 4.04Å; Q10-V45 HydrophobicContact CG-CG2 4.15Å; V13-V45 HydrophobicContact CB-CG2 4.01Å; V13-V45 HydrophobicContact CG1-CG2 3.78Å; L14-V45 HydrophobicContact CD1-CG1 4.21Å; L14-V45 HydrophobicContact CD2-CG1 4.06Å; L14-V45 HydrophobicContact CG-CG1 4.12Å; L14-V45 HydrophobicContact CG-CG2 4.32Å; L42-V45 HydrophobicContact CD1-CB 4.28Å; L42-V45 HydrophobicContact CD1-CG2 4.26Å; L42-V45 PolarHBondContact O-N 2.74Å; T43-V45 PolarHBondContact O-N 2.83Å; V45-N47 PolarHBondContact O-N 2.99Å; V45-G48 WeakPolarHBondContact O-CA 3.45Å; V45-G48 PolarHBondContact O-N 2.9Å; V45-I51 HydrophobicContact CG1-CD1 4.08Å
46P91.6Very high85.1Confident79 Ų7963.7 Ų63.751%0.51334%0.337SS..THydrogen-bonded Turntrans-54.8128173.7-25.234.5000111G48 I51P46-G48 PolarHBondContact O-N 3.32Å; P46-I51 VanDerWaalsContact O-CD1 3.27Å; P46-I51 WeakPolarHBondContact O-CD1 3.33Å
47N93.8Very high86.4Confident87 Ų8761.8 Ų61.847%0.46532%0.324SS..THydrogen-bonded Turntrans57.826.8-174.9-49.6-46.1000114.1V45 Q49 E50 I51 S161 I164V45-N47 PolarHBondContact O-N 2.99Å; N47-Q49 VanDerWaalsContact C-N 3.3Å; N47-Q49 PolarHBondContact O-N 3.38Å; N47-E50 HydrophobicContact CB-CB 4.47Å; N47-E50 PolarHBondContact O-N 3.42Å; N47-E50 VanDerWaalsContact O-N 3.13Å; N47-I51 HydrophobicContact CB-CD1 4.42Å; N47-I51 VanDerWaalsContact O-CG1 3.29Å; N47-I51 WeakPolarHBondContact O-CG1 3.29Å; N47-I51 PolarHBondContact O-N 3.22Å; N47-S161 PolarHBondContact ND2-OG 3.14Å; N47-I164 HydrophobicContact CB-CD1 3.7Å
48G93.7Very high88Confident4 Ų455.9 Ų55.94%0.04129%0.292CS..Hα-helixtrans-54.6-41.4-172.700000113.8V45 P46 I51 I52V45-G48 WeakPolarHBondContact O-CA 3.45Å; V45-G48 PolarHBondContact O-N 2.9Å; P46-G48 PolarHBondContact O-N 3.32Å; G48-I51 PolarHBondContact O-N 3.18Å; G48-I52 VanDerWaalsContact O-CG1 3.29Å; G48-I52 WeakPolarHBondContact O-CG1 3.39Å; G48-I52 PolarHBondContact O-N 3.02Å
49Q94.1Very high89.4Confident127 Ų12753.3 Ų53.359%0.59328%0.277SS*.Hα-helixtrans-64.9-43.2179.1-71-173.3-0.900112.4L42 N47 I52 K53L42-Q49 HydrophobicContact CD2-CG 4.09Å; N47-Q49 VanDerWaalsContact C-N 3.3Å; N47-Q49 PolarHBondContact O-N 3.38Å; Q49-I52 PolarHBondContact O-N 2.92Å; Q49-K53 WeakPolarHBondContact O-CG 3.01Å; Q49-K53 PolarHBondContact O-N 3.2Å
50E95Very high90.6Very high79 Ų7955 Ų5537%0.36928%0.276SS..Hα-helixtrans-65.2-43.3177.7-69.861.3-138.700110.5N47 I52 K53 S54 I164N47-E50 HydrophobicContact CB-CB 4.47Å; N47-E50 PolarHBondContact O-N 3.42Å; N47-E50 VanDerWaalsContact O-N 3.13Å; E50-I52 VanDerWaalsContact C-N 3.34Å; E50-I52 PolarHBondContact O-N 2.87Å; E50-K53 PolarHBondContact O-N 3.39Å; E50-S54 WeakPolarHBondContact O-CB 3.23Å; E50-S54 PolarHBondContact O-N 3.36Å; E50-S54 PolarHBondContact O-OG 3.34Å; E50-I164 HydrophobicContact CB-CD1 3.6Å; E50-I164 HydrophobicContact CB-CG1 4.1Å
51I96.4Very high91.1Very high1 Ų155.8 Ų55.81%0.00528%0.278CS..Hα-helixtrans-58.2-46.9175-65.8162.7000110.3L14 V45 P46 N47 G48 K53 S54 L55 W160 L163 I164L14-I51 HydrophobicContact CD1-CG2 4.25Å; L14-I51 HydrophobicContact CD2-CB 4.23Å; L14-I51 HydrophobicContact CD2-CG2 3.71Å; V45-I51 HydrophobicContact CG1-CD1 4.08Å; P46-I51 VanDerWaalsContact O-CD1 3.27Å; P46-I51 WeakPolarHBondContact O-CD1 3.33Å; N47-I51 HydrophobicContact CB-CD1 4.42Å; N47-I51 VanDerWaalsContact O-CG1 3.29Å; N47-I51 WeakPolarHBondContact O-CG1 3.29Å; N47-I51 PolarHBondContact O-N 3.22Å; G48-I51 PolarHBondContact O-N 3.18Å; I51-K53 PolarHBondContact O-N 2.85Å; I51-S54 PolarHBondContact O-N 3.03Å; I51-L55 VanDerWaalsContact O-CB 3.27Å; I51-L55 WeakPolarHBondContact O-CB 3.37Å; I51-L55 PolarHBondContact O-N 3.2Å; I51-W160 HydrophobicContact CD1-CB 3.84Å; I51-L163 HydrophobicContact CG2-CD1 4.19Å; I51-I164 HydrophobicContact CG1-CD1 3.99Å; I51-I164 HydrophobicContact CG1-CG1 4.02Å
52I96.1Very high91.1Very high12 Ų1252.6 Ų52.66%0.06226%0.261CS..Hα-helixtrans-63.1-42.6178.1-67-58.3000111.3L14 F18 A21 L42 G48 Q49 E50 S54 L55 L56L14-I52 HydrophobicContact CD2-CD1 3.86Å; L14-I52 HydrophobicContact CD2-CG1 4.27Å; F18-I52 HydrophobicContact CB-CD1 3.77Å; A21-I52 HydrophobicContact CB-CG2 4.06Å; L42-I52 HydrophobicContact CD1-CG1 4.16Å; L42-I52 HydrophobicContact CD2-CG1 3.89Å; G48-I52 VanDerWaalsContact O-CG1 3.29Å; G48-I52 WeakPolarHBondContact O-CG1 3.39Å; G48-I52 PolarHBondContact O-N 3.02Å; Q49-I52 PolarHBondContact O-N 2.92Å; E50-I52 VanDerWaalsContact C-N 3.34Å; E50-I52 PolarHBondContact O-N 2.87Å; I52-S54 PolarHBondContact O-N 3.38Å; I52-L55 PolarHBondContact O-N 3.2Å; I52-L56 HydrophobicContact CG2-CD1 3.85Å; I52-L56 HydrophobicContact CG2-CG 4.23Å; I52-L56 WeakPolarHBondContact O-CB 3.42Å; I52-L56 WeakPolarHBondContact O-CG 3.33Å; I52-L56 PolarHBondContact O-N 3.45Å
53K95Very high90.7Very high123 Ų12352.4 Ų52.454%0.53526%0.26SS..Hα-helixtrans-59.6-47.7175.8-72.8169.1-173.4163.90111.6Q49 E50 I51 L56 Q57Q49-K53 WeakPolarHBondContact O-CG 3.01Å; Q49-K53 PolarHBondContact O-N 3.2Å; E50-K53 PolarHBondContact O-N 3.39Å; I51-K53 PolarHBondContact O-N 2.85Å; K53-L56 PolarHBondContact O-N 3.24Å; K53-Q57 PolarHBondContact O-N 3.08Å
54S95Very high90.3Very high11 Ų1152.2 Ų52.28%0.07725%0.251CS..Hα-helixtrans-61.1-45.7176.9-71.40000111.8E50 I51 I52 L56 Q57 L58 S167E50-S54 WeakPolarHBondContact O-CB 3.23Å; E50-S54 PolarHBondContact O-N 3.36Å; E50-S54 PolarHBondContact O-OG 3.34Å; I51-S54 PolarHBondContact O-N 3.03Å; I52-S54 PolarHBondContact O-N 3.38Å; S54-L56 PolarHBondContact O-N 3.15Å; S54-Q57 WeakPolarHBondContact O-CB 3.46Å; S54-Q57 PolarHBondContact O-N 3.28Å; S54-L58 WeakPolarHBondContact O-CB 3.29Å; S54-L58 VanDerWaalsContact O-CG 3.27Å; S54-L58 WeakPolarHBondContact O-CG 3.22Å; S54-L58 PolarHBondContact O-N 3.26Å; S54-S167 WeakPolarHBondContact CB-OG 3.26Å; S54-S167 PolarHBondContact OG-OG 2.9Å
55L95.1Very high89.8Confident1 Ų152.3 Ų52.31%0.00525%0.248CC..Hα-helixtrans-65.1-41.1179.2-171.862.4000111.9F18 I51 I52 Q57 L58 V59 V113 F116 L163F18-L55 HydrophobicContact CB-CD2 3.91Å; F18-L55 HydrophobicContact CD1-CD2 4.3Å; F18-L55 HydrophobicContact CD2-CB 4.35Å; F18-L55 HydrophobicContact CD2-CD2 3.62Å; F18-L55 HydrophobicContact CD2-CG 3.75Å; F18-L55 HydrophobicContact CE2-CD2 4.23Å; F18-L55 HydrophobicContact CE2-CG 3.97Å; F18-L55 HydrophobicContact CG-CD2 3.66Å; F18-L55 HydrophobicContact CG-CG 4.29Å; I51-L55 VanDerWaalsContact O-CB 3.27Å; I51-L55 WeakPolarHBondContact O-CB 3.37Å; I51-L55 PolarHBondContact O-N 3.2Å; I52-L55 PolarHBondContact O-N 3.2Å; L55-Q57 VanDerWaalsContact C-N 3.31Å; L55-Q57 PolarHBondContact O-N 3.31Å; L55-L58 PolarHBondContact O-N 3.23Å; L55-V59 HydrophobicContact CD1-CG2 4.16Å; L55-V59 HydrophobicContact CG-CG2 4.36Å; L55-V59 WeakPolarHBondContact O-CB 3.47Å; L55-V59 VanDerWaalsContact O-CG2 3.3Å; L55-V59 WeakPolarHBondContact O-CG2 3.18Å; L55-V59 PolarHBondContact O-N 3.26Å; L55-V113 HydrophobicContact CD1-CG2 4.31Å; L55-F116 HydrophobicContact CD1-CB 4.03Å; L55-F116 HydrophobicContact CD1-CD2 3.86Å; L55-F116 HydrophobicContact CD1-CG 3.98Å; L55-F116 HydrophobicContact CD2-CB 4.24Å; L55-F116 HydrophobicContact CD2-CD1 3.63Å; L55-F116 HydrophobicContact CD2-CD2 4.01Å; L55-F116 HydrophobicContact CD2-CE1 3.87Å; L55-F116 HydrophobicContact CD2-CE2 4.26Å; L55-F116 HydrophobicContact CD2-CG 3.7Å; L55-F116 HydrophobicContact CD2-CZ 4.19Å; L55-F116 HydrophobicContact CG-CB 4.44Å; L55-F116 HydrophobicContact CG-CG 4.34Å; L55-L163 HydrophobicContact CD1-CD2 4.45Å
56L94.3Very high88.7Confident33 Ų3352.3 Ų52.317%0.17325%0.248CC..Hα-helixtrans-60.5-40.8174-73.7168.7000111.7F18 A21 I52 K53 S54 R60F18-L56 HydrophobicContact CD2-CD2 3.99Å; F18-L56 HydrophobicContact CD2-CG 4.34Å; F18-L56 HydrophobicContact CE2-CD2 3.95Å; A21-L56 HydrophobicContact CB-CD1 3.91Å; A21-L56 HydrophobicContact CB-CD2 4.34Å; I52-L56 HydrophobicContact CG2-CD1 3.85Å; I52-L56 HydrophobicContact CG2-CG 4.23Å; I52-L56 WeakPolarHBondContact O-CB 3.42Å; I52-L56 WeakPolarHBondContact O-CG 3.33Å; I52-L56 PolarHBondContact O-N 3.45Å; K53-L56 PolarHBondContact O-N 3.24Å; S54-L56 PolarHBondContact O-N 3.15Å; L56-R60 WeakPolarHBondContact O-CB 3.36Å; L56-R60 VanDerWaalsContact O-CG 3.27Å; L56-R60 WeakPolarHBondContact O-CG 3.17Å; L56-R60 PolarHBondContact O-N 3.14Å; L56-R60 PolarHBondContact O-NH1 2.77Å
57Q92.7Very high87.7Confident84 Ų8452.9 Ų52.939%0.39325%0.254SS..Hα-helixtrans-63.9-53.1174.9179.7180-2400111.5K53 S54 L55 V59 R60 D61K53-Q57 PolarHBondContact O-N 3.08Å; S54-Q57 WeakPolarHBondContact O-CB 3.46Å; S54-Q57 PolarHBondContact O-N 3.28Å; L55-Q57 VanDerWaalsContact C-N 3.31Å; L55-Q57 PolarHBondContact O-N 3.31Å; Q57-V59 VanDerWaalsContact C-N 3.31Å; Q57-V59 PolarHBondContact O-N 3.24Å; Q57-R60 WeakPolarHBondContact O-CB 3.11Å; Q57-R60 PolarHBondContact O-N 3.35Å; Q57-R60 VanDerWaalsContact O-N 3.1Å; Q57-D61 PolarHBondContact O-N 3.31Å
58L90.5Very high86.5Confident3 Ų357.7 Ų57.72%0.01627%0.265CS..Hα-helixtrans-61.1-38.6-177.9-70.1166.3000112.3S54 L55 D61 F62 V113 L163 F166 F171S54-L58 WeakPolarHBondContact O-CB 3.29Å; S54-L58 VanDerWaalsContact O-CG 3.27Å; S54-L58 WeakPolarHBondContact O-CG 3.22Å; S54-L58 PolarHBondContact O-N 3.26Å; L55-L58 PolarHBondContact O-N 3.23Å; L58-D61 PolarHBondContact O-N 3.05Å; L58-F62 WeakPolarHBondContact O-CB 3.35Å; L58-F62 PolarHBondContact O-N 3.21Å; L58-V113 HydrophobicContact CB-CB 4.45Å; L58-V113 HydrophobicContact CB-CG1 3.75Å; L58-V113 HydrophobicContact CB-CG2 3.77Å; L58-V113 HydrophobicContact CD1-CG2 3.75Å; L58-V113 HydrophobicContact CG-CG2 4.29Å; L58-L163 HydrophobicContact CD1-CD2 3.73Å; L58-F166 HydrophobicContact CD1-CD1 3.76Å; L58-F166 HydrophobicContact CD1-CE1 4.08Å; L58-F166 HydrophobicContact CD2-CD1 4.1Å; L58-F166 HydrophobicContact CD2-CE1 3.85Å; L58-F171 HydrophobicContact CD2-CB 4.34Å; L58-F171 HydrophobicContact CD2-CD2 3.52Å; L58-F171 HydrophobicContact CD2-CE2 3.81Å; L58-F171 HydrophobicContact CD2-CG 4.07Å
59V90Very high85Confident2 Ų261.5 Ų61.51%0.01229%0.288CS..Hα-helixtrans-72.4-33.2175.9173.10000112F18 L55 Q57 D61 F62 N63 V113 F116 A117F18-V59 HydrophobicContact CE2-CB 4.13Å; F18-V59 HydrophobicContact CE2-CG1 4.46Å; F18-V59 HydrophobicContact CE2-CG2 3.91Å; F18-V59 HydrophobicContact CZ-CB 4.04Å; F18-V59 HydrophobicContact CZ-CG1 3.96Å; F18-V59 HydrophobicContact CZ-CG2 3.7Å; L55-V59 HydrophobicContact CD1-CG2 4.16Å; L55-V59 HydrophobicContact CG-CG2 4.36Å; L55-V59 WeakPolarHBondContact O-CB 3.47Å; L55-V59 VanDerWaalsContact O-CG2 3.3Å; L55-V59 WeakPolarHBondContact O-CG2 3.18Å; L55-V59 PolarHBondContact O-N 3.26Å; Q57-V59 VanDerWaalsContact C-N 3.31Å; Q57-V59 PolarHBondContact O-N 3.24Å; V59-D61 VanDerWaalsContact C-N 3.34Å; V59-F62 PolarHBondContact O-N 3.49Å; V59-N63 WeakPolarHBondContact O-CB 3.22Å; V59-N63 VanDerWaalsContact O-CG 3.32Å; V59-N63 PolarHBondContact O-N 2.81Å; V59-V113 HydrophobicContact CG2-CG1 3.92Å; V59-F116 HydrophobicContact CG2-CB 4.31Å; V59-A117 HydrophobicContact CG1-CB 3.79Å; V59-A117 HydrophobicContact CG2-CB 4.18Å
60R88.4Confident83.7Confident140 Ų14057.7 Ų57.753%0.52827%0.27SS..Hα-helixtrans-61.6-45.7170.9-78.9-172.7-54.6-963.3110.9L56 Q57 F62 N63 Q64L56-R60 WeakPolarHBondContact O-CB 3.36Å; L56-R60 VanDerWaalsContact O-CG 3.27Å; L56-R60 WeakPolarHBondContact O-CG 3.17Å; L56-R60 PolarHBondContact O-N 3.14Å; L56-R60 PolarHBondContact O-NH1 2.77Å; Q57-R60 WeakPolarHBondContact O-CB 3.11Å; Q57-R60 PolarHBondContact O-N 3.35Å; Q57-R60 VanDerWaalsContact O-N 3.1Å; R60-F62 VanDerWaalsContact C-N 3.33Å; R60-F62 PolarHBondContact O-N 3.29Å; R60-N63 PolarHBondContact O-N 2.86Å; R60-Q64 WeakPolarHBondContact O-CB 3.46Å; R60-Q64 PolarHBondContact O-N 3.35Å
61D82.5Confident82.4Confident54 Ų5460.9 Ų60.929%0.28929%0.285SS..Hα-helixtrans-63.5-40.9178.2-66.9-12.5000111.4Q57 L58 V59 R65 F171Q57-D61 PolarHBondContact O-N 3.31Å; L58-D61 PolarHBondContact O-N 3.05Å; V59-D61 VanDerWaalsContact C-N 3.34Å; D61-R65 WeakPolarHBondContact O-CG 3.48Å; D61-R65 PolarHBondContact O-N 2.67Å; D61-F171 HydrophobicContact CB-CD1 4.15Å; D61-F171 HydrophobicContact CB-CE1 4.32Å
62F83Confident81.2Confident1 Ų162.6 Ų62.60%0.00429%0.294CS..Hα-helixtrans-58.6-54.2172.1-179.7-86.8000111.3L58 V59 R60 Q64 R65 F66 V113 A114 A117 F171 Q176 I179L58-F62 WeakPolarHBondContact O-CB 3.35Å; L58-F62 PolarHBondContact O-N 3.21Å; V59-F62 PolarHBondContact O-N 3.49Å; R60-F62 VanDerWaalsContact C-N 3.33Å; R60-F62 PolarHBondContact O-N 3.29Å; F62-Q64 VanDerWaalsContact C-N 3.32Å; F62-Q64 PolarHBondContact O-N 3.16Å; F62-R65 PolarHBondContact O-N 2.97Å; F62-R65 VanDerWaalsContact O-N 3.1Å; F62-F66 HydrophobicContact CD1-CB 4.29Å; F62-F66 HydrophobicContact CD1-CD2 4.44Å; F62-F66 HydrophobicContact CE1-CB 4.11Å; F62-F66 AromaticContact CE1-CD2 3.47Å; F62-F66 HydrophobicContact CE1-CD2 3.47Å; F62-F66 VanDerWaalsContact CE1-CD2 3.47Å; F62-F66 HydrophobicContact CE1-CE2 4.12Å; F62-F66 HydrophobicContact CE1-CG 4.05Å; F62-F66 AromaticContact CZ-CD2 3.68Å; F62-F66 HydrophobicContact CZ-CD2 3.68Å; F62-F66 HydrophobicContact CZ-CE2 4.19Å; F62-F66 WeakPolarHBondContact O-CB 3.29Å; F62-F66 PolarHBondContact O-N 3.33Å; F62-V113 HydrophobicContact CB-CG1 4.45Å; F62-A114 HydrophobicContact CD2-CB 4.21Å; F62-A114 HydrophobicContact CE2-CB 3.54Å; F62-A114 HydrophobicContact CZ-CB 4.07Å; F62-A117 HydrophobicContact CD1-CB 3.31Å; F62-A117 HydrophobicContact CE1-CB 3.55Å; F62-A117 HydrophobicContact CG-CB 3.96Å; F62-A117 HydrophobicContact CZ-CB 4.34Å; F62-F171 HydrophobicContact CB-CE1 4.3Å; F62-F171 HydrophobicContact CB-CZ 4.39Å; F62-Q176 HydrophobicContact CD2-CB 4.41Å; F62-Q176 HydrophobicContact CE2-CB 3.69Å; F62-Q176 HydrophobicContact CZ-CB 4.11Å; F62-I179 HydrophobicContact CZ-CD1 4.1Å
63N78.7Confident80.2Confident32 Ų3266.2 Ų66.217%0.17131%0.311CS..Hα-helixtrans-62.7-38.3-176.4-77.4-7.1000112.4V59 R60 R65 F66 S67 R120V59-N63 WeakPolarHBondContact O-CB 3.22Å; V59-N63 VanDerWaalsContact O-CG 3.32Å; V59-N63 PolarHBondContact O-N 2.81Å; R60-N63 PolarHBondContact O-N 2.86Å; N63-R65 VanDerWaalsContact C-N 3.26Å; N63-R65 PolarHBondContact O-N 2.88Å; N63-F66 PolarHBondContact O-N 2.93Å; N63-S67 PolarHBondContact O-N 2.94Å; N63-S67 PolarHBondContact O-OG 3.19Å; N63-R120 PolarHBondContact ND2-NH1 3.42Å
64Q76.7Confident79.1Confident115 Ų11562.7 Ų62.754%0.53730%0.3SS..Hα-helixtrans-62-35.3176.9-175.9177.7-13.500112.2R60 F62 R68R60-Q64 WeakPolarHBondContact O-CB 3.46Å; R60-Q64 PolarHBondContact O-N 3.35Å; F62-Q64 VanDerWaalsContact C-N 3.32Å; F62-Q64 PolarHBondContact O-N 3.16Å; Q64-R68 WeakPolarHBondContact O-CG 3.29Å
65R71.3Confident78.1Confident107 Ų10762.4 Ų62.440%0.40430%0.298SS..Hα-helixtrans-79.1-35.6174.8-65.1-179.9-172.7-172.38.7111.9D61 F62 N63 R68 T69 F171 Q176D61-R65 WeakPolarHBondContact O-CG 3.48Å; D61-R65 PolarHBondContact O-N 2.67Å; F62-R65 PolarHBondContact O-N 2.97Å; F62-R65 VanDerWaalsContact O-N 3.1Å; N63-R65 VanDerWaalsContact C-N 3.26Å; N63-R65 PolarHBondContact O-N 2.88Å; R65-R68 PolarHBondContact O-N 2.94Å; R65-T69 PolarHBondContact O-OG1 3.33Å; R65-F171 PolarHBondContact NH1-O 2.94Å; R65-F171 PolarHBondContact NH2-O 2.72Å; R65-Q176 PolarHBondContact O-NE2 3.4Å; R65-Q176 VanDerWaalsContact O-NE2 3.09Å
66F69.7Low77.1Confident4 Ų462.4 Ų62.42%0.01830%0.298CS..Hα-helixtrans-61.8-52.9178.3-167-82.8000112.5F62 N63 R68 T69 H70 I72 I121 Q176 W180F62-F66 HydrophobicContact CD1-CB 4.29Å; F62-F66 HydrophobicContact CD1-CD2 4.44Å; F62-F66 HydrophobicContact CE1-CB 4.11Å; F62-F66 AromaticContact CE1-CD2 3.47Å; F62-F66 HydrophobicContact CE1-CD2 3.47Å; F62-F66 VanDerWaalsContact CE1-CD2 3.47Å; F62-F66 HydrophobicContact CE1-CE2 4.12Å; F62-F66 HydrophobicContact CE1-CG 4.05Å; F62-F66 AromaticContact CZ-CD2 3.68Å; F62-F66 HydrophobicContact CZ-CD2 3.68Å; F62-F66 HydrophobicContact CZ-CE2 4.19Å; F62-F66 WeakPolarHBondContact O-CB 3.29Å; F62-F66 PolarHBondContact O-N 3.33Å; N63-F66 PolarHBondContact O-N 2.93Å; F66-R68 PolarHBondContact O-N 3.47Å; F66-R68 VanDerWaalsContact O-N 3.13Å; F66-T69 PolarHBondContact O-N 3.44Å; F66-T69 VanDerWaalsContact O-N 3.13Å; F66-T69 PolarHBondContact O-OG1 3.34Å; F66-H70 HydrophobicContact CE1-CB 4.42Å; F66-H70 PolarHBondContact O-N 3.33Å; F66-H70 VanDerWaalsContact O-N 3.09Å; F66-I72 HydrophobicContact CD1-CD1 4.42Å; F66-I72 HydrophobicContact CD1-CG1 4.43Å; F66-I72 HydrophobicContact CE1-CD1 3.86Å; F66-I72 HydrophobicContact CE1-CG1 3.5Å; F66-I72 VanDerWaalsContact CE1-CG1 3.5Å; F66-I72 HydrophobicContact CZ-CG1 4.21Å; F66-I121 HydrophobicContact CE1-CD1 4.45Å; F66-I121 HydrophobicContact CZ-CD1 4.45Å; F66-Q176 VanDerWaalsContact CA-NE2 3.29Å; F66-Q176 HydrophobicContact CD2-CG 3.94Å; F66-W180 AromaticContact CD2-NE1 3.52Å; F66-W180 AromaticContact CE1-CE2 3.91Å; F66-W180 AromaticContact CE1-CZ2 3.46Å; F66-W180 HydrophobicContact CE1-CZ2 3.46Å; F66-W180 VanDerWaalsContact CE1-CZ2 3.46Å; F66-W180 AromaticContact CE1-NE1 3.79Å; F66-W180 AromaticContact CE2-CD1 3.74Å; F66-W180 AromaticContact CE2-CE2 3.54Å; F66-W180 AromaticContact CE2-CZ2 3.89Å; F66-W180 HydrophobicContact CE2-CZ2 3.89Å; F66-W180 AromaticContact CE2-NE1 2.9Å; F66-W180 HydrophobicContact CZ-CD2 4.46Å; F66-W180 AromaticContact CZ-CE2 3.22Å; F66-W180 HydrophobicContact CZ-CH2 4.16Å; F66-W180 AromaticContact CZ-CZ2 3.05Å; F66-W180 HydrophobicContact CZ-CZ2 3.05Å; F66-W180 AromaticContact CZ-NE1 3.09Å
67S70Confident76.2Confident91 Ų9167.8 Ų67.864%0.63632%0.322SS*.THydrogen-bonded Turntrans-65.6-16.5-178.4-59.30000113.9N63 T69N63-S67 PolarHBondContact O-N 2.94Å; N63-S67 PolarHBondContact O-OG 3.19Å; S67-T69 VanDerWaalsContact C-N 3.34Å
68R68Low75.3Confident187 Ų18765.2 Ų65.271%0.70631%0.314SS*.THydrogen-bonded Turntrans-76.7-23.3176.6-76.7177.2179.8-178.2-0.4113.3Q64 R65 F66Q64-R68 WeakPolarHBondContact O-CG 3.29Å; R65-R68 PolarHBondContact O-N 2.94Å; F66-R68 PolarHBondContact O-N 3.47Å; F66-R68 VanDerWaalsContact O-N 3.13Å
69T63Low74.6Confident85 Ų8566.5 Ų66.552%0.52132%0.32SS..THydrogen-bonded Turntrans-122.7-15-168.842.50000113.2R65 F66 S67 Q176R65-T69 PolarHBondContact O-OG1 3.33Å; F66-T69 PolarHBondContact O-N 3.44Å; F66-T69 VanDerWaalsContact O-N 3.13Å; F66-T69 PolarHBondContact O-OG1 3.34Å; S67-T69 VanDerWaalsContact C-N 3.34Å; T69-Q176 PolarHBondContact OG1-NE2 2.98Å
70H65.4Low74.1Confident47 Ų4767.9 Ų67.922%0.21834%0.335CS..  trans-149.7149.1-171.4-50.183.1000114.6F66 E177 W180F66-H70 HydrophobicContact CE1-CB 4.42Å; F66-H70 PolarHBondContact O-N 3.33Å; F66-H70 VanDerWaalsContact O-N 3.09Å; H70-E177 IonicContact CE1-OE1 3.88Å; H70-W180 HydrophobicContact CB-CD2 4.06Å; H70-W180 HydrophobicContact CB-CH2 4.16Å; H70-W180 HydrophobicContact CB-CZ2 3.21Å; H70-W180 AromaticContact CD2-CD1 3.25Å; H70-W180 AromaticContact CD2-CD2 3.42Å; H70-W180 VanDerWaalsContact CD2-CD2 3.42Å; H70-W180 AromaticContact CD2-CE2 3.45Å; H70-W180 VanDerWaalsContact CD2-CE2 3.45Å; H70-W180 AromaticContact CD2-CG 3.28Å; H70-W180 AromaticContact CD2-NE1 3.31Å; H70-W180 PolarHBondContact CD2-NE1 3.35Å; H70-W180 VanDerWaalsContact CD2-NE1 3.31Å; H70-W180 AromaticContact CE1-CD1 3.39Å; H70-W180 AromaticContact CE1-NE1 3.79Å; H70-W180 AromaticContact CG-CD1 3.34Å; H70-W180 AromaticContact CG-CD2 3.82Å; H70-W180 AromaticContact CG-CE2 3.31Å; H70-W180 AromaticContact CG-CG 3.82Å; H70-W180 AromaticContact CG-CZ2 3.92Å; H70-W180 AromaticContact CG-NE1 2.97Å; H70-W180 AromaticContact ND1-CD1 3.4Å; H70-W180 AromaticContact ND1-NE1 3.28Å; H70-W180 PolarHBondContact ND1-NE1 3.47Å; H70-W180 AromaticContact NE2-CD1 3.29Å; H70-W180 VanDerWaalsContact NE2-CD1 3.29Å; H70-W180 AromaticContact NE2-CG 3.44Å; H70-W180 AromaticContact NE2-NE1 3.82Å
71E69.5Low74Confident146 Ų14661.2 Ų61.268%0.68231%0.31SS*.  trans-104.8139.2174.6-67.7-179.8177.500110.3W180E71-W180 WeakPolarHBondContact O-CH2 3.38Å
72I71.2Confident74Confident36 Ų3661.1 Ų61.119%0.18531%0.31CS..SBendtrans-90.3-22.2-173.9-63.8166.9000111.1F66 P74 V75 A76 I121 R125F66-I72 HydrophobicContact CD1-CD1 4.42Å; F66-I72 HydrophobicContact CD1-CG1 4.43Å; F66-I72 HydrophobicContact CE1-CD1 3.86Å; F66-I72 HydrophobicContact CE1-CG1 3.5Å; F66-I72 VanDerWaalsContact CE1-CG1 3.5Å; F66-I72 HydrophobicContact CZ-CG1 4.21Å; I72-P74 VanDerWaalsContact C-CD 3.44Å; I72-V75 WeakPolarHBondContact O-CB 3.42Å; I72-V75 PolarHBondContact O-N 3.31Å; I72-A76 PolarHBondContact O-N 3.35Å; I72-A76 VanDerWaalsContact O-N 3.11Å; I72-I121 HydrophobicContact CD1-CD1 3.75Å; I72-I121 HydrophobicContact CD1-CG1 3.98Å; I72-I121 HydrophobicContact CD1-CG2 3.82Å; I72-I121 HydrophobicContact CG1-CG2 4.38Å; I72-I121 HydrophobicContact CG2-CG2 3.49Å; I72-I121 VanDerWaalsContact CG2-CG2 3.49Å; I72-R125 VanDerWaalsContact CG2-NE 3.31Å
73E73.5Confident74Confident89 Ų8963 Ų6342%0.41632%0.322SS..Hα-helixtrans-49-47.3-175.1-72.858.2-139.400112.6V75 A76 E77 R125E73-V75 VanDerWaalsContact C-N 3.26Å; E73-V75 PolarHBondContact O-N 3.29Å; E73-A76 PolarHBondContact O-N 2.8Å; E73-A76 VanDerWaalsContact O-N 3.14Å; E73-E77 WeakPolarHBondContact O-CB 3.4Å; E73-E77 WeakPolarHBondContact O-CG 3.35Å; E73-E77 PolarHBondContact O-N 2.92Å; E73-R125 IonicContact OE1-CZ 2.75Å; E73-R125 IonicContact OE1-NH2 3.71Å; E73-R125 PolarHBondContact OE1-NH2 3.21Å; E73-R125 IonicContact OE2-NH2 3.63Å
74P73.1Confident74.2Confident49 Ų4967.9 Ų67.932%0.31835%0.349SS..Hα-helixtrans-61.6-33.8-179.8-22.834.6000113.4I72 S78 L189I72-P74 VanDerWaalsContact C-CD 3.44Å; P74-S78 VanDerWaalsContact O-CB 3.29Å; P74-S78 WeakPolarHBondContact O-CB 3.42Å; P74-S78 PolarHBondContact O-N 2.85Å; P74-S78 PolarHBondContact O-OG 3.06Å; P74-L189 HydrophobicContact CB-CD1 4.16Å; P74-L189 HydrophobicContact CB-CD2 4.02Å
75V72.7Confident74.7Confident4 Ų469.8 Ų69.82%0.02436%0.355CS..Hα-helixtrans-73.3-43.1178.6179.80000109.8I72 E73 S78 L79 F95 W180 L183 L189I72-V75 WeakPolarHBondContact O-CB 3.42Å; I72-V75 PolarHBondContact O-N 3.31Å; E73-V75 VanDerWaalsContact C-N 3.26Å; E73-V75 PolarHBondContact O-N 3.29Å; V75-S78 PolarHBondContact O-N 2.98Å; V75-S78 PolarHBondContact O-OG 3.39Å; V75-L79 HydrophobicContact CG1-CD1 4.05Å; V75-L79 WeakPolarHBondContact O-CG 3.32Å; V75-L79 PolarHBondContact O-N 3.23Å; V75-F95 HydrophobicContact CG1-CE1 4.43Å; V75-F95 HydrophobicContact CG1-CZ 3.95Å; V75-W180 HydrophobicContact CG2-CH2 3.96Å; V75-W180 HydrophobicContact CG2-CZ3 3.75Å; V75-L183 HydrophobicContact CG1-CD2 3.88Å; V75-L183 HydrophobicContact CG2-CD1 3.99Å; V75-L183 HydrophobicContact CG2-CD2 4.17Å; V75-L183 HydrophobicContact CG2-CG 4.48Å; V75-L189 HydrophobicContact CG2-CD1 4.24Å
76A75.2Confident75.4Confident1 Ų170.7 Ų70.71%0.00838%0.375CS..Hα-helixtrans-67.7-42.6-178.600000112.7I72 E73 S78 L79 G80 I81 D82I72-A76 PolarHBondContact O-N 3.35Å; I72-A76 VanDerWaalsContact O-N 3.11Å; E73-A76 PolarHBondContact O-N 2.8Å; E73-A76 VanDerWaalsContact O-N 3.14Å; A76-S78 VanDerWaalsContact C-N 3.28Å; A76-S78 PolarHBondContact O-N 3.05Å; A76-L79 PolarHBondContact O-N 3.35Å; A76-G80 PolarHBondContact O-N 2.96Å; A76-I81 HydrophobicContact CB-CD1 4.17Å; A76-I81 HydrophobicContact CB-CG1 3.96Å; A76-I81 WeakPolarHBondContact O-CG1 3.44Å; A76-I81 PolarHBondContact O-N 2.94Å; A76-D82 WeakPolarHBondContact CB-OD2 3.38Å
77E75Confident76.3Confident146 Ų14671.4 Ų71.468%0.68238%0.38SS*.Hα-helixtrans-58.9-43.1172.9-74.7-179.1176.300111E73 L79 G80E73-E77 WeakPolarHBondContact O-CB 3.4Å; E73-E77 WeakPolarHBondContact O-CG 3.35Å; E73-E77 PolarHBondContact O-N 2.92Å; E77-L79 VanDerWaalsContact C-N 3.3Å; E77-L79 PolarHBondContact O-N 3.11Å; E77-G80 PolarHBondContact O-N 3.28Å; E77-G80 VanDerWaalsContact O-N 3.08Å
78S72.9Confident77.3Confident31 Ų3171.8 Ų71.822%0.21738%0.375CS..Hα-helixtrans-65.3-31.7-178.275.80000115.1P74 V75 A76 G80 L199P74-S78 VanDerWaalsContact O-CB 3.29Å; P74-S78 WeakPolarHBondContact O-CB 3.42Å; P74-S78 PolarHBondContact O-N 2.85Å; P74-S78 PolarHBondContact O-OG 3.06Å; V75-S78 PolarHBondContact O-N 2.98Å; V75-S78 PolarHBondContact O-OG 3.39Å; A76-S78 VanDerWaalsContact C-N 3.28Å; A76-S78 PolarHBondContact O-N 3.05Å; S78-G80 VanDerWaalsContact C-N 3.3Å; S78-L199 VanDerWaalsContact OG-CD1 3.27Å; S78-L199 WeakPolarHBondContact OG-CD1 3.18Å; S78-L199 WeakPolarHBondContact OG-CD2 3.3Å
79L76.1Confident78.5Confident29 Ų2966.9 Ų66.915%0.15236%0.358CS..THydrogen-bonded Turntrans-86.9-6.1177.5-62.1169.7000112.1V75 A76 E77 I81 L92 F95 L122V75-L79 HydrophobicContact CG1-CD1 4.05Å; V75-L79 WeakPolarHBondContact O-CG 3.32Å; V75-L79 PolarHBondContact O-N 3.23Å; A76-L79 PolarHBondContact O-N 3.35Å; E77-L79 VanDerWaalsContact C-N 3.3Å; E77-L79 PolarHBondContact O-N 3.11Å; L79-I81 HydrophobicContact CB-CB 4.5Å; L79-I81 HydrophobicContact CB-CG1 4.23Å; L79-I81 HydrophobicContact CB-CG2 3.72Å; L79-I81 HydrophobicContact CD1-CD1 4.3Å; L79-I81 PolarHBondContact O-N 3.4Å; L79-L92 HydrophobicContact CD1-CD1 4.01Å; L79-L92 HydrophobicContact CD2-CD1 4.27Å; L79-F95 HydrophobicContact CD1-CD1 3.79Å; L79-F95 HydrophobicContact CD1-CE1 3.46Å; L79-F95 VanDerWaalsContact CD1-CE1 3.46Å; L79-F95 HydrophobicContact CD1-CZ 3.99Å; L79-F95 HydrophobicContact CD2-CB 3.9Å; L79-F95 HydrophobicContact CD2-CD1 3.43Å; L79-F95 VanDerWaalsContact CD2-CD1 3.43Å; L79-F95 HydrophobicContact CD2-CD2 3.73Å; L79-F95 HydrophobicContact CD2-CE1 3.78Å; L79-F95 HydrophobicContact CD2-CE2 4.04Å; L79-F95 HydrophobicContact CD2-CG 3.39Å; L79-F95 HydrophobicContact CD2-CZ 4.04Å; L79-F95 HydrophobicContact CG-CD1 4.2Å; L79-F95 HydrophobicContact CG-CE1 4.11Å; L79-F95 HydrophobicContact CG-CZ 4.31Å; L79-L122 HydrophobicContact CD1-CD2 4.02Å
80G80.9Confident79.8Confident31 Ų3166.5 Ų66.532%0.3236%0.356SS..THydrogen-bonded Turntrans65.318.4-175.300000114.1A76 E77 S78 S83A76-G80 PolarHBondContact O-N 2.96Å; E77-G80 PolarHBondContact O-N 3.28Å; E77-G80 VanDerWaalsContact O-N 3.08Å; S78-G80 VanDerWaalsContact C-N 3.3Å; G80-S83 PolarHBondContact O-OG 2.86Å
81I84.6Confident80.9Confident1 Ų165.2 Ų65.21%0.00535%0.354CS..THydrogen-bonded Turntrans-83.4-14.3-172.562.6172000114A76 L79 S83 V87 L92 L122 R125 L126 H129A76-I81 HydrophobicContact CB-CD1 4.17Å; A76-I81 HydrophobicContact CB-CG1 3.96Å; A76-I81 WeakPolarHBondContact O-CG1 3.44Å; A76-I81 PolarHBondContact O-N 2.94Å; L79-I81 HydrophobicContact CB-CB 4.5Å; L79-I81 HydrophobicContact CB-CG1 4.23Å; L79-I81 HydrophobicContact CB-CG2 3.72Å; L79-I81 HydrophobicContact CD1-CD1 4.3Å; L79-I81 PolarHBondContact O-N 3.4Å; I81-S83 VanDerWaalsContact C-N 3.26Å; I81-S83 PolarHBondContact O-N 3.48Å; I81-V87 HydrophobicContact CG2-CG1 4.3Å; I81-V87 HydrophobicContact CG2-CG2 4.39Å; I81-L92 HydrophobicContact CG2-CD1 4.4Å; I81-L92 HydrophobicContact CG2-CD2 4.45Å; I81-L122 HydrophobicContact CD1-CD2 3.68Å; I81-R125 HydrophobicContact CD1-CB 4.05Å; I81-R125 HydrophobicContact CG1-CB 4.41Å; I81-L126 HydrophobicContact CB-CD2 3.81Å; I81-L126 HydrophobicContact CB-CG 4.3Å; I81-L126 HydrophobicContact CG2-CD2 3.71Å; I81-L126 HydrophobicContact CG2-CG 4.38Å; I81-H129 PolarHBondContact O-CD2 2.91Å
82D84.2Confident81.9Confident52 Ų5258.4 Ų58.428%0.27832%0.322SS..THydrogen-bonded Turntrans-90.119.2174.3-77.2-19000112.5A76 R125 H129A76-D82 WeakPolarHBondContact CB-OD2 3.38Å; D82-R125 WeakPolarHBondContact OD1-CD 3.37Å; D82-R125 IonicContact OD1-CZ 3.23Å; D82-R125 IonicContact OD1-NH1 2.75Å; D82-R125 PolarHBondContact OD1-NH1 2.86Å; D82-R125 IonicContact OD2-CZ 3.1Å; D82-R125 IonicContact OD2-NH1 3.96Å; D82-R125 PolarHBondContact OD2-NH1 3.42Å; D82-H129 PolarHBondContact O-CE1 3.19Å; D82-H129 PolarHBondContact O-NE2 2.98Å
83S83.1Confident82.9Confident39 Ų3960.3 Ų60.327%0.27333%0.33SS..SBendtrans-121153.4179.880.50000112G80 I81 K85 H131G80-S83 PolarHBondContact O-OG 2.86Å; I81-S83 VanDerWaalsContact C-N 3.26Å; I81-S83 PolarHBondContact O-N 3.48Å; S83-K85 PolarHBondContact O-N 3.47Å; S83-K85 PolarHBondContact OG-N 2.91Å; S83-H131 PolarHBondContact O-NE2 3.37Å
84D83Confident83.7Confident136 Ų13658.3 Ų58.373%0.72732%0.322SS*.SBendtrans-72.5-3.8173.6-59.9-33.1000112.9H129D84-H129 IonicContact OD1-CE1 3.91Å; D84-H129 IonicContact OD1-CG 3.66Å; D84-H129 IonicContact OD1-ND1 3.87Å; D84-H129 PolarHBondContact OD1-ND1 3.27Å
85K86.4Confident84.5Confident155 Ų15556.2 Ų56.267%0.67431%0.307SS*.SBendtrans-73.1148.6178.4-64179.6-178.4174.50109.9S83 V87 H131S83-K85 PolarHBondContact O-N 3.47Å; S83-K85 PolarHBondContact OG-N 2.91Å; K85-V87 PolarHBondContact O-N 3.21Å; K85-H131 PolarHBondContact O-CE1 2.93Å; K85-H131 PolarHBondContact O-NE2 2.94Å
86P86.5Confident85.4Confident125 Ų12556 Ų5681%0.81231%0.306SS*.PPolyproline II helixtrans-52.9130.1172.8-25.133.9000111.3
87V89Confident86.2Confident20 Ų2058.5 Ų58.512%0.12132%0.319CS..PPolyproline II helixtrans-76.4133.7177.4174.80000109.7I81 K85 K89 L92 L126 H131 A134I81-V87 HydrophobicContact CG2-CG1 4.3Å; I81-V87 HydrophobicContact CG2-CG2 4.39Å; K85-V87 PolarHBondContact O-N 3.21Å; V87-K89 PolarHBondContact O-N 3.36Å; V87-L92 HydrophobicContact CG1-CB 4.3Å; V87-L92 HydrophobicContact CG1-CD2 3.89Å; V87-L126 HydrophobicContact CG2-CD2 3.86Å; V87-H131 HydrophobicContact CG2-CB 4.36Å; V87-A134 HydrophobicContact CG1-CB 4.48Å
88D90.5Very high86.9Confident99 Ų9954.5 Ų54.553%0.52930%0.301SS..  trans-71.197.3167.7-174.5-20.6000109.3T90 A91 L92D88-T90 VanDerWaalsContact C-N 3.28Å; D88-T90 PolarHBondContact O-N 3.45Å; D88-T90 PolarHBondContact OD1-N 3.45Å; D88-A91 HydrophobicContact CB-CB 3.96Å; D88-A91 PolarHBondContact O-N 3.31Å; D88-A91 PolarHBondContact OD1-N 3.47Å; D88-L92 WeakPolarHBondContact O-CB 3.41Å; D88-L92 PolarHBondContact O-N 3.04Å
89K91.9Very high87.6Confident84 Ų8453 Ų5337%0.36529%0.29SS..Hα-helixtrans-63.2-33.5-178.6-71.3-174.4-64.5-160.70113V87 E93 D133 A134 M137V87-K89 PolarHBondContact O-N 3.36Å; K89-E93 WeakPolarHBondContact O-CB 3.4Å; K89-E93 PolarHBondContact O-N 2.89Å; K89-D133 HydrophobicContact CD-CB 4.33Å; K89-D133 VanDerWaalsContact CD-OD2 3.29Å; K89-D133 WeakPolarHBondContact CD-OD2 3.33Å; K89-D133 VanDerWaalsContact CE-OD2 3.29Å; K89-D133 WeakPolarHBondContact CE-OD2 3.46Å; K89-D133 IonicContact NZ-OD2 2.71Å; K89-D133 PolarHBondContact NZ-OD2 3.41Å; K89-A134 HydrophobicContact CG-CB 4.4Å; K89-M137 HydrophobicContact CB-CE 4.13Å; K89-M137 HydrophobicContact CG-CE 4.34Å; K89-M137 WeakPolarHBondContact O-CE 3.45Å
90T91.1Very high88.3Confident77 Ų7751.7 Ų51.747%0.47228%0.283SS..Hα-helixtrans-68.7-46.4-179.9-57.50000109.6D88 L92 E93 I94 I210D88-T90 VanDerWaalsContact C-N 3.28Å; D88-T90 PolarHBondContact O-N 3.45Å; D88-T90 PolarHBondContact OD1-N 3.45Å; T90-L92 PolarHBondContact O-N 3.41Å; T90-E93 PolarHBondContact O-N 3.05Å; T90-I94 HydrophobicContact CG2-CD1 3.97Å; T90-I94 VanDerWaalsContact O-CG1 3.3Å; T90-I94 WeakPolarHBondContact O-CG1 3.46Å; T90-I94 PolarHBondContact O-N 3.44Å; T90-I210 HydrophobicContact CG2-CD1 4.43Å
91A88.1Confident88.7Confident20 Ų2054.2 Ų54.217%0.16529%0.289CS..Hα-helixtrans-62.3-42.9175.900000111.8D88 I94 F95D88-A91 HydrophobicContact CB-CB 3.96Å; D88-A91 PolarHBondContact O-N 3.31Å; D88-A91 PolarHBondContact OD1-N 3.47Å; A91-I94 PolarHBondContact O-N 3.08Å; A91-F95 WeakPolarHBondContact O-CB 3.24Å; A91-F95 PolarHBondContact O-N 3.5Å
92L90.8Very high88.8Confident2 Ų254.8 Ų54.81%0.0130%0.296CS..Hα-helixtrans-65-41.5177.3179.861.5000112.4L79 I81 V87 D88 T90 Y96 L126 A134 M137 L138L79-L92 HydrophobicContact CD1-CD1 4.01Å; L79-L92 HydrophobicContact CD2-CD1 4.27Å; I81-L92 HydrophobicContact CG2-CD1 4.4Å; I81-L92 HydrophobicContact CG2-CD2 4.45Å; V87-L92 HydrophobicContact CG1-CB 4.3Å; V87-L92 HydrophobicContact CG1-CD2 3.89Å; D88-L92 WeakPolarHBondContact O-CB 3.41Å; D88-L92 PolarHBondContact O-N 3.04Å; T90-L92 PolarHBondContact O-N 3.41Å; L92-Y96 VanDerWaalsContact O-CB 3.22Å; L92-Y96 WeakPolarHBondContact O-CB 3.44Å; L92-Y96 PolarHBondContact O-N 3.14Å; L92-L126 HydrophobicContact CD2-CD1 4.2Å; L92-A134 HydrophobicContact CD2-CB 4.17Å; L92-M137 HydrophobicContact CB-CE 4.02Å; L92-M137 HydrophobicContact CD2-CE 3.74Å; L92-M137 HydrophobicContact CG-CE 3.86Å; L92-L138 HydrophobicContact CD2-CD1 4.35Å; L92-L138 HydrophobicContact CD2-CD2 4.39Å; L92-L138 HydrophobicContact CD2-CG 4.41Å; L92-L138 HydrophobicContact CG-CD2 4.25Å
93E93.3Very high88.9Confident76 Ų7652.4 Ų52.436%0.35528%0.283SS..Hα-helixtrans-60.3-49.6175.7162.6156-165.900111.3K89 T90 Y96 L97 M137 I141K89-E93 WeakPolarHBondContact O-CB 3.4Å; K89-E93 PolarHBondContact O-N 2.89Å; T90-E93 PolarHBondContact O-N 3.05Å; E93-Y96 PolarHBondContact O-N 2.95Å; E93-L97 HydrophobicContact CG-CD1 4.05Å; E93-L97 WeakPolarHBondContact O-CB 3.09Å; E93-L97 WeakPolarHBondContact O-CG 3.38Å; E93-L97 PolarHBondContact O-N 3.1Å; E93-M137 HydrophobicContact CB-CE 4.3Å; E93-M137 HydrophobicContact CB-SD 4.01Å; E93-I141 HydrophobicContact CB-CD1 3.64Å; E93-I141 HydrophobicContact CG-CD1 3.4Å; E93-I141 HydrophobicContact CG-CG1 4.47Å
94I89.8Confident89.2Confident48 Ų4851.4 Ų51.425%0.24627%0.273CS..Hα-helixtrans-61-49.7179-67.6165.6000110.3T90 A91 Y96 L97 E98 I206T90-I94 HydrophobicContact CG2-CD1 3.97Å; T90-I94 VanDerWaalsContact O-CG1 3.3Å; T90-I94 WeakPolarHBondContact O-CG1 3.46Å; T90-I94 PolarHBondContact O-N 3.44Å; A91-I94 PolarHBondContact O-N 3.08Å; I94-Y96 VanDerWaalsContact C-N 3.32Å; I94-Y96 PolarHBondContact O-N 3.36Å; I94-L97 PolarHBondContact O-N 2.75Å; I94-E98 HydrophobicContact CG2-CG 4.48Å; I94-E98 WeakPolarHBondContact O-CG 3.21Å; I94-E98 PolarHBondContact O-N 3.32Å; I94-I206 HydrophobicContact CB-CD1 4.05Å; I94-I206 HydrophobicContact CD1-CD1 4.37Å; I94-I206 HydrophobicContact CD1-CG1 4.49Å; I94-I206 HydrophobicContact CD1-CG2 3.45Å; I94-I206 VanDerWaalsContact CD1-CG2 3.45Å; I94-I206 HydrophobicContact CG2-CD1 3.47Å; I94-I206 VanDerWaalsContact CG2-CD1 3.47Å; I94-I206 HydrophobicContact CG2-CG1 4.07Å
95F89.1Confident89.3Confident4 Ų452 Ų522%0.01827%0.272CS..Hα-helixtrans-57-46.3177.1171.1-91.3000112V75 L79 A91 L97 E98 V99 F118 L183 V186 L199 L202V75-F95 HydrophobicContact CG1-CE1 4.43Å; V75-F95 HydrophobicContact CG1-CZ 3.95Å; L79-F95 HydrophobicContact CD1-CD1 3.79Å; L79-F95 HydrophobicContact CD1-CE1 3.46Å; L79-F95 VanDerWaalsContact CD1-CE1 3.46Å; L79-F95 HydrophobicContact CD1-CZ 3.99Å; L79-F95 HydrophobicContact CD2-CB 3.9Å; L79-F95 HydrophobicContact CD2-CD1 3.43Å; L79-F95 VanDerWaalsContact CD2-CD1 3.43Å; L79-F95 HydrophobicContact CD2-CD2 3.73Å; L79-F95 HydrophobicContact CD2-CE1 3.78Å; L79-F95 HydrophobicContact CD2-CE2 4.04Å; L79-F95 HydrophobicContact CD2-CG 3.39Å; L79-F95 HydrophobicContact CD2-CZ 4.04Å; L79-F95 HydrophobicContact CG-CD1 4.2Å; L79-F95 HydrophobicContact CG-CE1 4.11Å; L79-F95 HydrophobicContact CG-CZ 4.31Å; A91-F95 WeakPolarHBondContact O-CB 3.24Å; A91-F95 PolarHBondContact O-N 3.5Å; F95-L97 PolarHBondContact O-N 3.08Å; F95-E98 PolarHBondContact O-N 2.9Å; F95-V99 HydrophobicContact CD1-CG2 4.32Å; F95-V99 HydrophobicContact CE1-CG2 3.87Å; F95-V99 HydrophobicContact CE2-CG2 4.28Å; F95-V99 HydrophobicContact CZ-CG2 3.88Å; F95-V99 WeakPolarHBondContact O-CG2 3.36Å; F95-V99 PolarHBondContact O-N 3.48Å; F95-F118 HydrophobicContact CE1-CZ 4.07Å; F95-L183 HydrophobicContact CE1-CD2 4.17Å; F95-L183 HydrophobicContact CE2-CD2 4.22Å; F95-L183 HydrophobicContact CZ-CD2 3.4Å; F95-L183 VanDerWaalsContact CZ-CD2 3.4Å; F95-V186 HydrophobicContact CD2-CG1 3.5Å; F95-V186 HydrophobicContact CE2-CG1 3.73Å; F95-L199 HydrophobicContact CD2-CD2 4.5Å; F95-L199 HydrophobicContact CE2-CD2 4.25Å; F95-L202 HydrophobicContact CD2-CD2 4.02Å
96Y91.4Very high89.3Confident0 Ų051.5 Ų51.50%027%0.27CS..Hα-helixtrans-63.7-43.9-178.2-173.9-114.2000111.1L92 E93 I94 V99 L100 F118 L122 L138 I141 T142L92-Y96 VanDerWaalsContact O-CB 3.22Å; L92-Y96 WeakPolarHBondContact O-CB 3.44Å; L92-Y96 PolarHBondContact O-N 3.14Å; E93-Y96 PolarHBondContact O-N 2.95Å; I94-Y96 VanDerWaalsContact C-N 3.32Å; I94-Y96 PolarHBondContact O-N 3.36Å; Y96-V99 PolarHBondContact O-N 3.36Å; Y96-L100 HydrophobicContact CD1-CD1 4.15Å; Y96-L100 HydrophobicContact CD1-CG 4.44Å; Y96-L100 HydrophobicContact CE1-CD1 3.71Å; Y96-L100 HydrophobicContact CE1-CD2 4.48Å; Y96-L100 HydrophobicContact CE1-CG 4.21Å; Y96-L100 HydrophobicContact CE2-CD2 4.37Å; Y96-L100 WeakPolarHBondContact O-CG 3.16Å; Y96-L100 PolarHBondContact O-N 2.96Å; Y96-F118 HydrophobicContact CD2-CD1 4.16Å; Y96-F118 AromaticContact CD2-CE1 3.89Å; Y96-F118 HydrophobicContact CD2-CE1 3.89Å; Y96-F118 AromaticContact CE2-CD1 3.81Å; Y96-F118 HydrophobicContact CE2-CD1 3.81Å; Y96-F118 HydrophobicContact CE2-CE1 4.04Å; Y96-L122 HydrophobicContact CD2-CD1 3.63Å; Y96-L122 HydrophobicContact CE2-CD1 3.9Å; Y96-L138 HydrophobicContact CD1-CD2 3.77Å; Y96-L138 HydrophobicContact CD2-CD2 3.99Å; Y96-L138 HydrophobicContact CE1-CD2 4.24Å; Y96-L138 HydrophobicContact CE2-CD2 4.45Å; Y96-L138 HydrophobicContact CG-CD2 3.63Å; Y96-I141 HydrophobicContact CD1-CB 4.37Å; Y96-I141 HydrophobicContact CD1-CG2 3.83Å; Y96-I141 HydrophobicContact CE1-CG2 4.11Å; Y96-T142 WeakPolarHBondContact CE1-OG1 3.34Å; Y96-T142 PolarHBondContact OH-OG1 2.97Å
97L92.4Very high89.4Confident54 Ų5448.5 Ų48.528%0.28325%0.247SC..Hα-helixtrans-61.2-43.2175.4-75.6170.8000112.6E93 I94 F95 V99 L100 D101 I141 Y145E93-L97 HydrophobicContact CG-CD1 4.05Å; E93-L97 WeakPolarHBondContact O-CB 3.09Å; E93-L97 WeakPolarHBondContact O-CG 3.38Å; E93-L97 PolarHBondContact O-N 3.1Å; I94-L97 PolarHBondContact O-N 2.75Å; F95-L97 PolarHBondContact O-N 3.08Å; L97-V99 VanDerWaalsContact C-N 3.29Å; L97-V99 PolarHBondContact O-N 3.36Å; L97-L100 PolarHBondContact O-N 3.43Å; L97-L100 VanDerWaalsContact O-N 3.14Å; L97-D101 PolarHBondContact O-N 3.42Å; L97-I141 HydrophobicContact CD2-CG2 3.59Å; L97-I141 HydrophobicContact CG-CG2 4.03Å; L97-Y145 HydrophobicContact CD2-CD2 3.81Å; L97-Y145 HydrophobicContact CD2-CE2 4.43Å
98E89Confident89.5Confident62 Ų6249.7 Ų49.729%0.2925%0.252SS..Hα-helixtrans-61.8-38.1175.8-73.1179.5169.600111.9I94 F95 G102 V186I94-E98 HydrophobicContact CG2-CG 4.48Å; I94-E98 WeakPolarHBondContact O-CG 3.21Å; I94-E98 PolarHBondContact O-N 3.32Å; F95-E98 PolarHBondContact O-N 2.9Å; E98-G102 PolarHBondContact O-N 2.86Å; E98-V186 HydrophobicContact CB-CG1 4.23Å; E98-V186 HydrophobicContact CB-CG2 3.88Å; E98-V186 VanDerWaalsContact OE2-CG1 3.27Å; E98-V186 WeakPolarHBondContact OE2-CG1 3.27Å
99V87.8Confident89.5Confident0 Ų046 Ų460%023%0.231CC..Hα-helixtrans-63.6-43.8173.4174.20000111.4F95 Y96 L97 L103 F118 T182 L183F95-V99 HydrophobicContact CD1-CG2 4.32Å; F95-V99 HydrophobicContact CE1-CG2 3.87Å; F95-V99 HydrophobicContact CE2-CG2 4.28Å; F95-V99 HydrophobicContact CZ-CG2 3.88Å; F95-V99 WeakPolarHBondContact O-CG2 3.36Å; F95-V99 PolarHBondContact O-N 3.48Å; Y96-V99 PolarHBondContact O-N 3.36Å; L97-V99 VanDerWaalsContact C-N 3.29Å; L97-V99 PolarHBondContact O-N 3.36Å; V99-L103 VanDerWaalsContact O-CB 3.26Å; V99-L103 WeakPolarHBondContact O-CB 3.42Å; V99-L103 PolarHBondContact O-N 3.11Å; V99-F118 HydrophobicContact CB-CE1 4.15Å; V99-F118 HydrophobicContact CG1-CD1 3.98Å; V99-F118 HydrophobicContact CG1-CE1 3.64Å; V99-F118 HydrophobicContact CG1-CZ 4.27Å; V99-F118 HydrophobicContact CG2-CE1 4.34Å; V99-T182 HydrophobicContact CB-CG2 4.48Å; V99-T182 HydrophobicContact CG2-CG2 4.46Å; V99-L183 HydrophobicContact CG2-CD2 3.83Å
100L90.4Very high89.4Confident0 Ų042.1 Ų42.10%021%0.214CC..Hα-helixtrans-64.8-43.6177.7-63.7-170.5000111.9Y96 L97 G102 L103 F104 M115 Y145Y96-L100 HydrophobicContact CD1-CD1 4.15Å; Y96-L100 HydrophobicContact CD1-CG 4.44Å; Y96-L100 HydrophobicContact CE1-CD1 3.71Å; Y96-L100 HydrophobicContact CE1-CD2 4.48Å; Y96-L100 HydrophobicContact CE1-CG 4.21Å; Y96-L100 HydrophobicContact CE2-CD2 4.37Å; Y96-L100 WeakPolarHBondContact O-CG 3.16Å; Y96-L100 PolarHBondContact O-N 2.96Å; L97-L100 PolarHBondContact O-N 3.43Å; L97-L100 VanDerWaalsContact O-N 3.14Å; L100-G102 PolarHBondContact O-N 2.79Å; L100-L103 WeakPolarHBondContact O-CB 3.26Å; L100-L103 PolarHBondContact O-N 3.02Å; L100-L103 VanDerWaalsContact O-N 3.16Å; L100-F104 HydrophobicContact CB-CD2 4.34Å; L100-F104 HydrophobicContact CD2-CE2 4.26Å; L100-F104 WeakPolarHBondContact O-CB 3.5Å; L100-F104 VanDerWaalsContact O-CD2 3.24Å; L100-F104 WeakPolarHBondContact O-CD2 3.45Å; L100-F104 PolarHBondContact O-N 3.09Å; L100-M115 HydrophobicContact CD1-SD 4.49Å; L100-M115 HydrophobicContact CD2-CB 4.36Å; L100-M115 HydrophobicContact CD2-CG 3.69Å; L100-M115 HydrophobicContact CD2-SD 4.13Å; L100-Y145 HydrophobicContact CB-CD1 4.4Å; L100-Y145 HydrophobicContact CB-CD2 4.2Å; L100-Y145 HydrophobicContact CB-CE1 4.1Å; L100-Y145 HydrophobicContact CB-CE2 3.85Å; L100-Y145 HydrophobicContact CB-CG 4.46Å; L100-Y145 HydrophobicContact CD1-CD1 4.01Å; L100-Y145 HydrophobicContact CD1-CD2 3.97Å; L100-Y145 HydrophobicContact CD1-CE2 4.46Å; L100-Y145 HydrophobicContact CD1-CG 3.71Å
101D90.6Very high89.4Confident85 Ų8538.8 Ų38.846%0.45519%0.193SC..Hα-helixtrans-62-42.9178.4-79.4-20.5000112L97 F104 E105 Y145L97-D101 PolarHBondContact O-N 3.42Å; D101-F104 PolarHBondContact O-N 3.22Å; D101-E105 PolarHBondContact O-N 3.44Å; D101-Y145 WeakPolarHBondContact OD1-CE2 3.21Å; D101-Y145 PolarHBondContact OD1-OH 2.78Å
102G85.4Confident89.7Confident13 Ų1338 Ų3813%0.13419%0.186CC..Hα-helixtrans-67.3-36.6173.400000113E98 L100 F104E98-G102 PolarHBondContact O-N 2.86Å; L100-G102 PolarHBondContact O-N 2.79Å; G102-F104 VanDerWaalsContact C-N 3.34Å
103L86.6Confident89.7Confident1 Ų137.9 Ų37.91%0.00519%0.185CC..Hα-helixtrans-65.5-37.9176.7-179.356.6000111.9V99 L100 R111 A114 M115 L178 I179V99-L103 VanDerWaalsContact O-CB 3.26Å; V99-L103 WeakPolarHBondContact O-CB 3.42Å; V99-L103 PolarHBondContact O-N 3.11Å; L100-L103 WeakPolarHBondContact O-CB 3.26Å; L100-L103 PolarHBondContact O-N 3.02Å; L100-L103 VanDerWaalsContact O-N 3.16Å; L103-R111 HydrophobicContact CD1-CB 4.1Å; L103-R111 HydrophobicContact CD1-CG 4.04Å; L103-R111 HydrophobicContact CG-CB 4.29Å; L103-R111 WeakPolarHBondContact O-CD 3.42Å; L103-R111 PolarHBondContact O-NH1 3.15Å; L103-A114 HydrophobicContact CD1-CB 4.36Å; L103-A114 HydrophobicContact CD2-CB 4.33Å; L103-M115 HydrophobicContact CD2-CB 4.07Å; L103-L178 HydrophobicContact CD1-CB 4.31Å; L103-I179 HydrophobicContact CD1-CD1 4.43Å; L103-I179 HydrophobicContact CD1-CG1 3.74Å; L103-I179 HydrophobicContact CD2-CD1 4.08Å; L103-I179 HydrophobicContact CD2-CG1 4Å; L103-I179 HydrophobicContact CG-CG1 4.38Å
104F89.5Confident89.5Confident18 Ų1834.2 Ų34.28%0.07917%0.168CC..THydrogen-bonded Turntrans-101.723.3-172.5-67.4-63.2000115.1L100 D101 G102 K106 L107 R111 I112 M115 Y145 L150L100-F104 HydrophobicContact CB-CD2 4.34Å; L100-F104 HydrophobicContact CD2-CE2 4.26Å; L100-F104 WeakPolarHBondContact O-CB 3.5Å; L100-F104 VanDerWaalsContact O-CD2 3.24Å; L100-F104 WeakPolarHBondContact O-CD2 3.45Å; L100-F104 PolarHBondContact O-N 3.09Å; D101-F104 PolarHBondContact O-N 3.22Å; G102-F104 VanDerWaalsContact C-N 3.34Å; F104-K106 PolarHBondContact O-N 2.76Å; F104-L107 HydrophobicContact CB-CD2 3.96Å; F104-L107 HydrophobicContact CD1-CD2 3.75Å; F104-L107 HydrophobicContact CG-CD2 4.21Å; F104-R111 HydrophobicContact CD1-CB 4.18Å; F104-R111 HydrophobicContact CE1-CB 3.86Å; F104-I112 HydrophobicContact CE1-CG1 3.87Å; F104-I112 HydrophobicContact CZ-CG1 4.27Å; F104-M115 HydrophobicContact CE2-CB 4.08Å; F104-M115 HydrophobicContact CE2-CG 4.28Å; F104-M115 HydrophobicContact CE2-SD 3.67Å; F104-M115 HydrophobicContact CZ-CB 3.84Å; F104-M115 HydrophobicContact CZ-CG 4.4Å; F104-M115 HydrophobicContact CZ-SD 3.87Å; F104-Y145 HydrophobicContact CB-CE1 4.49Å; F104-Y145 HydrophobicContact CD2-CD1 4.38Å; F104-Y145 AromaticContact CD2-CE1 3.54Å; F104-Y145 HydrophobicContact CD2-CE1 3.54Å; F104-Y145 HydrophobicContact CE2-CE1 4.12Å; F104-Y145 HydrophobicContact CG-CE1 4.31Å; F104-L150 HydrophobicContact CB-CD2 4.36Å; F104-L150 HydrophobicContact CD1-CD2 3.74Å; F104-L150 HydrophobicContact CD2-CD1 4.47Å; F104-L150 HydrophobicContact CD2-CD2 4.07Å; F104-L150 HydrophobicContact CE1-CD1 4.15Å; F104-L150 HydrophobicContact CE1-CD2 3.96Å; F104-L150 HydrophobicContact CE2-CD1 3.9Å; F104-L150 HydrophobicContact CE2-CD2 4.27Å; F104-L150 HydrophobicContact CG-CD2 3.8Å; F104-L150 HydrophobicContact CZ-CD1 3.71Å; F104-L150 HydrophobicContact CZ-CD2 4.21Å
105E86.4Confident89.7Confident149 Ų14932 Ų3270%0.69616%0.157SC*.THydrogen-bonded Turntrans-53.3-24.8163.5-71.4-176.4173.900112.9D101D101-E105 PolarHBondContact O-N 3.44Å
106K84.9Confident90Very high145 Ų14531.8 Ų31.863%0.6316%0.156SC*.SBendtrans-135.4151.1166.9-52-178.4179.8178.50109F104 R111F104-K106 PolarHBondContact O-N 2.76Å; K106-R111 WeakPolarHBondContact O-CD 3.42Å; K106-R111 PolarHBondContact O-NH1 2.91Å
107L90Very high90Very high62 Ų6231.8 Ų31.833%0.32516%0.156SC..  trans-106.3123.1-179-57.4-177.8000110.5F104 L150 W153F104-L107 HydrophobicContact CB-CD2 3.96Å; F104-L107 HydrophobicContact CD1-CD2 3.75Å; F104-L107 HydrophobicContact CG-CD2 4.21Å; L107-L150 HydrophobicContact CD2-CD2 3.57Å; L107-W153 HydrophobicContact CB-CB 4.39Å; L107-W153 HydrophobicContact CB-CD2 3.89Å; L107-W153 HydrophobicContact CB-CG 3.69Å; L107-W153 HydrophobicContact CD1-CB 3.53Å; L107-W153 HydrophobicContact CD1-CG 3.73Å; L107-W153 HydrophobicContact CG-CG 4.36Å
108N89.6Confident89.9Confident45 Ų4529.5 Ų29.524%0.24114%0.144CC..  trans-156.6162169.170.553.9000109.7G110 R111 I112 D174N108-G110 VanDerWaalsContact C-N 3.29Å; N108-G110 PolarHBondContact O-N 3.29Å; N108-G110 VanDerWaalsContact OD1-CA 3.28Å; N108-G110 WeakPolarHBondContact OD1-CA 3.19Å; N108-G110 PolarHBondContact OD1-N 2.95Å; N108-R111 PolarHBondContact ND2-NE 2.86Å; N108-R111 PolarHBondContact O-N 2.78Å; N108-R111 PolarHBondContact OD1-N 3.46Å; N108-I112 PolarHBondContact O-N 3.16Å; N108-D174 PolarHBondContact ND2-OD1 3.08Å
109W92.2Very high90.1Very high22 Ų2226.6 Ų26.68%0.08313%0.13CC..Hα-helixtrans-61.5-33.9179.6-73.5124.8000113.7R111 I112 V113 W153 I154 H157 G159 W160 L163 F166W109-R111 VanDerWaalsContact C-N 3.32Å; W109-R111 PolarHBondContact O-N 3.49Å; W109-I112 HydrophobicContact CD2-CD1 4.38Å; W109-I112 HydrophobicContact CE3-CB 4.2Å; W109-I112 HydrophobicContact CE3-CD1 3.53Å; W109-I112 HydrophobicContact CE3-CG1 4.44Å; W109-I112 HydrophobicContact CE3-CG2 4.21Å; W109-I112 HydrophobicContact CZ3-CD1 3.68Å; W109-I112 HydrophobicContact CZ3-CG2 4.3Å; W109-I112 PolarHBondContact O-N 3.29Å; W109-V113 WeakPolarHBondContact O-CG2 3.28Å; W109-V113 PolarHBondContact O-N 2.86Å; W109-W153 AromaticContact CD1-CH2 3.79Å; W109-W153 AromaticContact CD2-CH2 3.93Å; W109-W153 HydrophobicContact CD2-CH2 3.93Å; W109-W153 AromaticContact CD2-CZ3 3.73Å; W109-W153 HydrophobicContact CD2-CZ3 3.73Å; W109-W153 AromaticContact CE2-CH2 3.9Å; W109-W153 AromaticContact CE2-CZ3 3.69Å; W109-W153 HydrophobicContact CE3-CZ3 4.07Å; W109-W153 AromaticContact CG-CH2 3.86Å; W109-W153 HydrophobicContact CG-CH2 3.86Å; W109-W153 HydrophobicContact CG-CZ3 4.16Å; W109-W153 HydrophobicContact CH2-CZ3 4.35Å; W109-W153 HydrophobicContact CZ2-CZ3 4.02Å; W109-W153 HydrophobicContact CZ3-CZ3 4.36Å; W109-W153 AromaticContact NE1-CH2 3.8Å; W109-I154 HydrophobicContact CH2-CB 4.44Å; W109-I154 HydrophobicContact CH2-CG1 4.14Å; W109-I154 HydrophobicContact CH2-CG2 4Å; W109-I154 HydrophobicContact CZ3-CG1 4.23Å; W109-H157 HydrophobicContact CZ2-CB 3.9Å; W109-G159 WeakPolarHBondContact CH2-O 3.4Å; W109-W160 HydrophobicContact CZ3-CE3 4.21Å; W109-W160 HydrophobicContact CZ3-CZ3 4.26Å; W109-L163 HydrophobicContact CD2-CG 4.34Å; W109-L163 HydrophobicContact CE3-CD1 4.32Å; W109-L163 HydrophobicContact CE3-CD2 4.04Å; W109-L163 HydrophobicContact CE3-CG 3.65Å; W109-L163 HydrophobicContact CH2-CG 4.36Å; W109-L163 HydrophobicContact CZ3-CD1 3.98Å; W109-L163 HydrophobicContact CZ3-CG 3.67Å; W109-F166 HydrophobicContact CB-CB 4.2Å; W109-F166 HydrophobicContact CB-CD1 3.51Å; W109-F166 HydrophobicContact CB-CD2 3.71Å; W109-F166 HydrophobicContact CB-CE1 3.66Å; W109-F166 HydrophobicContact CB-CE2 3.87Å; W109-F166 HydrophobicContact CB-CG 3.52Å; W109-F166 HydrophobicContact CB-CZ 3.83Å; W109-F166 AromaticContact CD1-CG 3.92Å; W109-F166 HydrophobicContact CG-CB 4.05Å; W109-F166 HydrophobicContact CG-CD1 4.23Å; W109-F166 HydrophobicContact CG-CD2 4.21Å; W109-F166 AromaticContact CG-CG 3.9Å; W109-F166 HydrophobicContact CG-CG 3.9Å
110G88.5Confident90.4Very high1 Ų129 Ų291%0.0114%0.139CC..Hα-helixtrans-60.6-3817700000113.5N108 A114 N173N108-G110 VanDerWaalsContact C-N 3.29Å; N108-G110 PolarHBondContact O-N 3.29Å; N108-G110 VanDerWaalsContact OD1-CA 3.28Å; N108-G110 WeakPolarHBondContact OD1-CA 3.19Å; N108-G110 PolarHBondContact OD1-N 2.95Å; G110-A114 WeakPolarHBondContact O-CB 3.34Å; G110-A114 PolarHBondContact O-N 2.93Å; G110-N173 PolarHBondContact O-ND2 3.23Å
111R90.9Very high90.3Very high8 Ų829.8 Ų29.83%0.0314%0.143CC..Hα-helixtrans-73.3-36.2174.8-68.6170.9179.3-137.910.6112.2L103 F104 K106 N108 W109 A114 M115 D174L103-R111 HydrophobicContact CD1-CB 4.1Å; L103-R111 HydrophobicContact CD1-CG 4.04Å; L103-R111 HydrophobicContact CG-CB 4.29Å; L103-R111 WeakPolarHBondContact O-CD 3.42Å; L103-R111 PolarHBondContact O-NH1 3.15Å; F104-R111 HydrophobicContact CD1-CB 4.18Å; F104-R111 HydrophobicContact CE1-CB 3.86Å; K106-R111 WeakPolarHBondContact O-CD 3.42Å; K106-R111 PolarHBondContact O-NH1 2.91Å; N108-R111 PolarHBondContact ND2-NE 2.86Å; N108-R111 PolarHBondContact O-N 2.78Å; N108-R111 PolarHBondContact OD1-N 3.46Å; W109-R111 VanDerWaalsContact C-N 3.32Å; W109-R111 PolarHBondContact O-N 3.49Å; R111-A114 WeakPolarHBondContact O-CB 3.47Å; R111-A114 PolarHBondContact O-N 3.49Å; R111-M115 PolarHBondContact O-N 3.32Å; R111-D174 IonicContact CZ-OD2 2.65Å; R111-D174 IonicContact NE-OD1 3.67Å; R111-D174 IonicContact NE-OD2 3.86Å; R111-D174 PolarHBondContact NE-OD2 3.2Å; R111-D174 IonicContact NH2-OD2 2.97Å; R111-D174 PolarHBondContact NH2-OD2 3.43Å; R111-D174 VanDerWaalsContact NH2-OD2 3.1Å
112I94.2Very high90.3Very high2 Ų225.9 Ų25.91%0.0112%0.122CC..Hα-helixtrans-61.9-45.6172-66.7169.8000110.3F104 N108 W109 A114 M115 F116 W153 I154 W160F104-I112 HydrophobicContact CE1-CG1 3.87Å; F104-I112 HydrophobicContact CZ-CG1 4.27Å; N108-I112 PolarHBondContact O-N 3.16Å; W109-I112 HydrophobicContact CD2-CD1 4.38Å; W109-I112 HydrophobicContact CE3-CB 4.2Å; W109-I112 HydrophobicContact CE3-CD1 3.53Å; W109-I112 HydrophobicContact CE3-CG1 4.44Å; W109-I112 HydrophobicContact CE3-CG2 4.21Å; W109-I112 HydrophobicContact CZ3-CD1 3.68Å; W109-I112 HydrophobicContact CZ3-CG2 4.3Å; W109-I112 PolarHBondContact O-N 3.29Å; I112-A114 VanDerWaalsContact C-N 3.28Å; I112-A114 PolarHBondContact O-N 3.39Å; I112-M115 WeakPolarHBondContact O-CB 3.48Å; I112-M115 PolarHBondContact O-N 3.38Å; I112-F116 HydrophobicContact CG2-CD2 4.19Å; I112-F116 HydrophobicContact CG2-CE2 3.97Å; I112-F116 VanDerWaalsContact O-CD2 3.32Å; I112-F116 WeakPolarHBondContact O-CD2 3.49Å; I112-F116 PolarHBondContact O-N 3.44Å; I112-W153 HydrophobicContact CD1-CE3 3.9Å; I112-W153 HydrophobicContact CD1-CZ3 3.64Å; I112-I154 HydrophobicContact CD1-CD1 4Å; I112-I154 HydrophobicContact CD1-CG1 3.82Å; I112-W160 HydrophobicContact CG2-CH2 4.13Å; I112-W160 HydrophobicContact CG2-CZ3 3.74Å
113V91.7Very high90.7Very high0 Ų025.3 Ų25.30%012%0.116CC..Hα-helixtrans-58.2-42.5173.1171.10000111.2L55 L58 V59 F62 W109 M115 F116 A117 L163 F166 F171L55-V113 HydrophobicContact CD1-CG2 4.31Å; L58-V113 HydrophobicContact CB-CB 4.45Å; L58-V113 HydrophobicContact CB-CG1 3.75Å; L58-V113 HydrophobicContact CB-CG2 3.77Å; L58-V113 HydrophobicContact CD1-CG2 3.75Å; L58-V113 HydrophobicContact CG-CG2 4.29Å; V59-V113 HydrophobicContact CG2-CG1 3.92Å; F62-V113 HydrophobicContact CB-CG1 4.45Å; W109-V113 WeakPolarHBondContact O-CG2 3.28Å; W109-V113 PolarHBondContact O-N 2.86Å; V113-M115 VanDerWaalsContact C-N 3.31Å; V113-M115 PolarHBondContact O-N 2.9Å; V113-F116 PolarHBondContact O-N 3.39Å; V113-A117 PolarHBondContact O-N 2.93Å; V113-L163 HydrophobicContact CG2-CD2 3.93Å; V113-F166 HydrophobicContact CG2-CE1 4.33Å; V113-F171 HydrophobicContact CB-CE2 4.3Å; V113-F171 HydrophobicContact CB-CZ 4.35Å; V113-F171 HydrophobicContact CG1-CE2 4.2Å; V113-F171 HydrophobicContact CG1-CZ 3.85Å; V113-F171 HydrophobicContact CG2-CE2 4.32Å
114A89.2Confident90.9Very high0 Ų026.9 Ų26.90%013%0.125CC..Hα-helixtrans-62.1-37.817900000111.9F62 L103 G110 R111 I112 A117 F118 I179F62-A114 HydrophobicContact CD2-CB 4.21Å; F62-A114 HydrophobicContact CE2-CB 3.54Å; F62-A114 HydrophobicContact CZ-CB 4.07Å; L103-A114 HydrophobicContact CD1-CB 4.36Å; L103-A114 HydrophobicContact CD2-CB 4.33Å; G110-A114 WeakPolarHBondContact O-CB 3.34Å; G110-A114 PolarHBondContact O-N 2.93Å; R111-A114 WeakPolarHBondContact O-CB 3.47Å; R111-A114 PolarHBondContact O-N 3.49Å; I112-A114 VanDerWaalsContact C-N 3.28Å; I112-A114 PolarHBondContact O-N 3.39Å; A114-A117 PolarHBondContact O-N 2.96Å; A114-F118 WeakPolarHBondContact O-CB 3.37Å; A114-F118 PolarHBondContact O-N 3.48Å; A114-I179 HydrophobicContact CB-CD1 3.55Å; A114-I179 HydrophobicContact CB-CG1 4.35Å; A114-I179 WeakPolarHBondContact O-CD1 3.45Å
115M94.7Very high90.8Very high0 Ų027.4 Ų27.40%013%0.126CC..Hα-helixtrans-59.1-48.5171.9175.9-175.677.500111.7L100 L103 F104 R111 I112 V113 A117 F118 L119 T142 L150L100-M115 HydrophobicContact CD1-SD 4.49Å; L100-M115 HydrophobicContact CD2-CB 4.36Å; L100-M115 HydrophobicContact CD2-CG 3.69Å; L100-M115 HydrophobicContact CD2-SD 4.13Å; L103-M115 HydrophobicContact CD2-CB 4.07Å; F104-M115 HydrophobicContact CE2-CB 4.08Å; F104-M115 HydrophobicContact CE2-CG 4.28Å; F104-M115 HydrophobicContact CE2-SD 3.67Å; F104-M115 HydrophobicContact CZ-CB 3.84Å; F104-M115 HydrophobicContact CZ-CG 4.4Å; F104-M115 HydrophobicContact CZ-SD 3.87Å; R111-M115 PolarHBondContact O-N 3.32Å; I112-M115 WeakPolarHBondContact O-CB 3.48Å; I112-M115 PolarHBondContact O-N 3.38Å; V113-M115 VanDerWaalsContact C-N 3.31Å; V113-M115 PolarHBondContact O-N 2.9Å; M115-A117 PolarHBondContact O-N 3.4Å; M115-F118 PolarHBondContact O-N 3.23Å; M115-L119 WeakPolarHBondContact O-CB 3.25Å; M115-L119 PolarHBondContact O-N 3.01Å; M115-T142 HydrophobicContact CE-CG2 3.73Å; M115-T142 HydrophobicContact CG-CG2 4.31Å; M115-T142 HydrophobicContact SD-CG2 3.86Å; M115-L150 HydrophobicContact CE-CD1 4.2Å; M115-L150 HydrophobicContact SD-CD1 4.15Å
116F95.2Very high91Very high1 Ų120.3 Ų20.30%0.0049%0.093CC..Hα-helixtrans-63.7-40.2177.2-79.7-82.4000112.5F18 L55 V59 I112 V113 F118 R120 W160F18-F116 HydrophobicContact CD1-CB 4.34Å; F18-F116 AromaticContact CD1-CD1 3.81Å; F18-F116 HydrophobicContact CD1-CD1 3.81Å; F18-F116 HydrophobicContact CE1-CB 3.94Å; F18-F116 HydrophobicContact CE1-CD1 4.25Å; F18-F116 WeakPolarHBondContact CE1-O 3.32Å; F18-F116 HydrophobicContact CG-CD1 4.34Å; F18-F116 HydrophobicContact CZ-CB 4.34Å; L55-F116 HydrophobicContact CD1-CB 4.03Å; L55-F116 HydrophobicContact CD1-CD2 3.86Å; L55-F116 HydrophobicContact CD1-CG 3.98Å; L55-F116 HydrophobicContact CD2-CB 4.24Å; L55-F116 HydrophobicContact CD2-CD1 3.63Å; L55-F116 HydrophobicContact CD2-CD2 4.01Å; L55-F116 HydrophobicContact CD2-CE1 3.87Å; L55-F116 HydrophobicContact CD2-CE2 4.26Å; L55-F116 HydrophobicContact CD2-CG 3.7Å; L55-F116 HydrophobicContact CD2-CZ 4.19Å; L55-F116 HydrophobicContact CG-CB 4.44Å; L55-F116 HydrophobicContact CG-CG 4.34Å; V59-F116 HydrophobicContact CG2-CB 4.31Å; I112-F116 HydrophobicContact CG2-CD2 4.19Å; I112-F116 HydrophobicContact CG2-CE2 3.97Å; I112-F116 VanDerWaalsContact O-CD2 3.32Å; I112-F116 WeakPolarHBondContact O-CD2 3.49Å; I112-F116 PolarHBondContact O-N 3.44Å; V113-F116 PolarHBondContact O-N 3.39Å; F116-F118 VanDerWaalsContact C-N 3.35Å; F116-R120 WeakPolarHBondContact O-CB 3.43Å; F116-R120 PolarHBondContact O-N 3.38Å; F116-W160 AromaticContact CE2-CH2 3.82Å; F116-W160 HydrophobicContact CE2-CH2 3.82Å; F116-W160 AromaticContact CE2-CZ3 3.79Å; F116-W160 HydrophobicContact CE2-CZ3 3.79Å; F116-W160 AromaticContact CZ-CH2 3.99Å; F116-W160 HydrophobicContact CZ-CH2 3.99Å; F116-W160 HydrophobicContact CZ-CZ3 4.15Å
117A90.3Very high91.3Very high0 Ų013.9 Ų13.90%07%0.066CC..Hα-helixtrans-61.3-45175.800000111.5V59 F62 V113 A114 M115 R120 I121V59-A117 HydrophobicContact CG1-CB 3.79Å; V59-A117 HydrophobicContact CG2-CB 4.18Å; F62-A117 HydrophobicContact CD1-CB 3.31Å; F62-A117 HydrophobicContact CE1-CB 3.55Å; F62-A117 HydrophobicContact CG-CB 3.96Å; F62-A117 HydrophobicContact CZ-CB 4.34Å; V113-A117 PolarHBondContact O-N 2.93Å; A114-A117 PolarHBondContact O-N 2.96Å; M115-A117 PolarHBondContact O-N 3.4Å; A117-R120 PolarHBondContact O-N 3.43Å; A117-I121 WeakPolarHBondContact O-CG1 3.44Å; A117-I121 PolarHBondContact O-N 3.43Å
118F89.9Confident91.2Very high6 Ų617.7 Ų17.73%0.0268%0.08CC..Hα-helixtrans-67.3-43.9178.6-171.8-120.7000112.6F95 Y96 V99 A114 M115 F116 R120 I121 L122 I179 L183F95-F118 HydrophobicContact CE1-CZ 4.07Å; Y96-F118 HydrophobicContact CD2-CD1 4.16Å; Y96-F118 AromaticContact CD2-CE1 3.89Å; Y96-F118 HydrophobicContact CD2-CE1 3.89Å; Y96-F118 AromaticContact CE2-CD1 3.81Å; Y96-F118 HydrophobicContact CE2-CD1 3.81Å; Y96-F118 HydrophobicContact CE2-CE1 4.04Å; V99-F118 HydrophobicContact CB-CE1 4.15Å; V99-F118 HydrophobicContact CG1-CD1 3.98Å; V99-F118 HydrophobicContact CG1-CE1 3.64Å; V99-F118 HydrophobicContact CG1-CZ 4.27Å; V99-F118 HydrophobicContact CG2-CE1 4.34Å; A114-F118 WeakPolarHBondContact O-CB 3.37Å; A114-F118 PolarHBondContact O-N 3.48Å; M115-F118 PolarHBondContact O-N 3.23Å; F116-F118 VanDerWaalsContact C-N 3.35Å; F118-R120 VanDerWaalsContact C-N 3.3Å; F118-R120 PolarHBondContact O-N 3.01Å; F118-I121 WeakPolarHBondContact O-CB 3.38Å; F118-I121 PolarHBondContact O-N 3.2Å; F118-I121 VanDerWaalsContact O-N 3.14Å; F118-L122 HydrophobicContact CD1-CD1 4.22Å; F118-L122 HydrophobicContact CE1-CD1 3.75Å; F118-L122 HydrophobicContact CE1-CG 4.37Å; F118-L122 HydrophobicContact CE2-CD2 4.38Å; F118-L122 HydrophobicContact CE2-CG 4.43Å; F118-L122 HydrophobicContact CZ-CD1 3.98Å; F118-L122 HydrophobicContact CZ-CD2 4.19Å; F118-L122 HydrophobicContact CZ-CG 4.22Å; F118-L122 PolarHBondContact O-N 2.63Å; F118-L122 VanDerWaalsContact O-N 3.08Å; F118-I179 HydrophobicContact CB-CD1 4Å; F118-I179 HydrophobicContact CD2-CG2 4.31Å; F118-L183 HydrophobicContact CE2-CD1 4.22Å; F118-L183 HydrophobicContact CE2-CD2 4.21Å; F118-L183 HydrophobicContact CZ-CD2 3.91Å
119L94.9Very high91.2Very high0 Ų018 Ų180%08%0.08CC..Hα-helixtrans-53.7-48.2172.2176.461.9000111C15 L19 M115 I121 L122 V123 L138 T142C15-L119 HydrophobicContact CB-CD2 4.31Å; L19-L119 HydrophobicContact CD1-CD2 4.43Å; M115-L119 WeakPolarHBondContact O-CB 3.25Å; M115-L119 PolarHBondContact O-N 3.01Å; L119-I121 VanDerWaalsContact C-N 3.33Å; L119-I121 PolarHBondContact O-N 3.42Å; L119-L122 PolarHBondContact O-N 3.11Å; L119-V123 HydrophobicContact CD1-CG2 3.91Å; L119-V123 HydrophobicContact CG-CG2 4.3Å; L119-V123 WeakPolarHBondContact O-CB 3.48Å; L119-V123 VanDerWaalsContact O-CG2 3.3Å; L119-V123 WeakPolarHBondContact O-CG2 3.42Å; L119-V123 PolarHBondContact O-N 3.31Å; L119-L138 HydrophobicContact CD1-CB 3.73Å; L119-T142 HydrophobicContact CD2-CG2 4.16Å
120R92.8Very high91Very high50 Ų5018.9 Ų18.919%0.18910%0.095CC..Hα-helixtrans-58.9-43.2177.8178.9-177.2174.1-134.9-10.3112.2F18 L19 S22 N63 F116 A117 F118 L122 V123 L124F18-R120 HydrophobicContact CE1-CB 3.91Å; F18-R120 HydrophobicContact CZ-CB 4.29Å; L19-R120 HydrophobicContact CD2-CB 3.99Å; L19-R120 HydrophobicContact CD2-CG 4.35Å; S22-R120 VanDerWaalsContact CB-NE 3.34Å; S22-R120 VanDerWaalsContact O-CZ 3.24Å; S22-R120 PolarHBondContact O-NE 3.35Å; S22-R120 PolarHBondContact O-NH2 2.91Å; S22-R120 VanDerWaalsContact OG-CD 3.22Å; S22-R120 WeakPolarHBondContact OG-CD 3.37Å; S22-R120 PolarHBondContact OG-NE 3.14Å; S22-R120 VanDerWaalsContact OG-NE 3.11Å; N63-R120 PolarHBondContact ND2-NH1 3.42Å; F116-R120 WeakPolarHBondContact O-CB 3.43Å; F116-R120 PolarHBondContact O-N 3.38Å; A117-R120 PolarHBondContact O-N 3.43Å; F118-R120 VanDerWaalsContact C-N 3.3Å; F118-R120 PolarHBondContact O-N 3.01Å; R120-L122 PolarHBondContact O-N 2.84Å; R120-V123 PolarHBondContact O-N 3.45Å; R120-L124 HydrophobicContact CG-CD1 3.96Å; R120-L124 HydrophobicContact CG-CG 4.31Å; R120-L124 WeakPolarHBondContact O-CB 3.33Å; R120-L124 VanDerWaalsContact O-CG 3.29Å; R120-L124 WeakPolarHBondContact O-CG 3.39Å; R120-L124 PolarHBondContact O-N 2.98Å
121I89.1Confident91.1Very high18 Ų1819.6 Ų19.69%0.09210%0.098CC..Hα-helixtrans-58.3-48.8177.9-73.4164.2000110.7F66 I72 A117 F118 L119 R125F66-I121 HydrophobicContact CE1-CD1 4.45Å; F66-I121 HydrophobicContact CZ-CD1 4.45Å; I72-I121 HydrophobicContact CD1-CD1 3.75Å; I72-I121 HydrophobicContact CD1-CG1 3.98Å; I72-I121 HydrophobicContact CD1-CG2 3.82Å; I72-I121 HydrophobicContact CG1-CG2 4.38Å; I72-I121 HydrophobicContact CG2-CG2 3.49Å; I72-I121 VanDerWaalsContact CG2-CG2 3.49Å; A117-I121 WeakPolarHBondContact O-CG1 3.44Å; A117-I121 PolarHBondContact O-N 3.43Å; F118-I121 WeakPolarHBondContact O-CB 3.38Å; F118-I121 PolarHBondContact O-N 3.2Å; F118-I121 VanDerWaalsContact O-N 3.14Å; L119-I121 VanDerWaalsContact C-N 3.33Å; L119-I121 PolarHBondContact O-N 3.42Å; I121-R125 PolarHBondContact O-N 2.9Å
122L91Very high91.1Very high3 Ų321.3 Ų21.32%0.01611%0.112CC..Hα-helixtrans-64.9-46.2179.6-63.4179.6000111.7L79 I81 Y96 F118 L119 R120 L124 R125 L126 L138L79-L122 HydrophobicContact CD1-CD2 4.02Å; I81-L122 HydrophobicContact CD1-CD2 3.68Å; Y96-L122 HydrophobicContact CD2-CD1 3.63Å; Y96-L122 HydrophobicContact CE2-CD1 3.9Å; F118-L122 HydrophobicContact CD1-CD1 4.22Å; F118-L122 HydrophobicContact CE1-CD1 3.75Å; F118-L122 HydrophobicContact CE1-CG 4.37Å; F118-L122 HydrophobicContact CE2-CD2 4.38Å; F118-L122 HydrophobicContact CE2-CG 4.43Å; F118-L122 HydrophobicContact CZ-CD1 3.98Å; F118-L122 HydrophobicContact CZ-CD2 4.19Å; F118-L122 HydrophobicContact CZ-CG 4.22Å; F118-L122 PolarHBondContact O-N 2.63Å; F118-L122 VanDerWaalsContact O-N 3.08Å; L119-L122 PolarHBondContact O-N 3.11Å; R120-L122 PolarHBondContact O-N 2.84Å; L122-L124 VanDerWaalsContact C-N 3.35Å; L122-L124 PolarHBondContact O-N 3.03Å; L122-R125 PolarHBondContact O-N 3.12Å; L122-L126 WeakPolarHBondContact O-CB 3.49Å; L122-L126 WeakPolarHBondContact O-CG 3.27Å; L122-L126 PolarHBondContact O-N 2.75Å; L122-L138 HydrophobicContact CB-CD1 3.85Å; L122-L138 HydrophobicContact CD1-CD1 4.17Å; L122-L138 HydrophobicContact CD1-CD2 4.47Å
123V93.1Very high90.9Very high0 Ų024.6 Ų24.60%013%0.13CC..Hα-helixtrans-61.6-42.5-179.6169.20000111.6L19 L31 L119 R120 R125 L126 S127 I135L19-V123 HydrophobicContact CD1-CG1 4.26Å; L19-V123 HydrophobicContact CD1-CG2 4.05Å; L19-V123 HydrophobicContact CD2-CB 3.98Å; L19-V123 HydrophobicContact CD2-CG1 4.06Å; L19-V123 HydrophobicContact CD2-CG2 4.15Å; L31-V123 HydrophobicContact CD1-CG1 4.14Å; L31-V123 HydrophobicContact CD2-CG1 3.8Å; L119-V123 HydrophobicContact CD1-CG2 3.91Å; L119-V123 HydrophobicContact CG-CG2 4.3Å; L119-V123 WeakPolarHBondContact O-CB 3.48Å; L119-V123 VanDerWaalsContact O-CG2 3.3Å; L119-V123 WeakPolarHBondContact O-CG2 3.42Å; L119-V123 PolarHBondContact O-N 3.31Å; R120-V123 PolarHBondContact O-N 3.45Å; V123-R125 VanDerWaalsContact C-N 3.34Å; V123-R125 PolarHBondContact O-N 3.34Å; V123-L126 PolarHBondContact O-N 3.24Å; V123-S127 VanDerWaalsContact O-CB 3.27Å; V123-S127 WeakPolarHBondContact O-CB 3.35Å; V123-S127 PolarHBondContact O-N 3.35Å; V123-S127 PolarHBondContact O-OG 3.02Å; V123-I135 HydrophobicContact CG1-CD1 4.27Å; V123-I135 HydrophobicContact CG1-CG1 4.22Å; V123-I135 HydrophobicContact CG1-CG2 3.92Å; V123-I135 HydrophobicContact CG2-CG1 4.47Å; V123-I135 HydrophobicContact CG2-CG2 4.09Å
124L90Very high91Very high35 Ų3524.6 Ų24.618%0.18313%0.13CC..Hα-helixtrans-61.6-42.1177.7-76.9176.6000111.8T23 D27 R120 L122 S127 K128T23-L124 HydrophobicContact CG2-CD2 3.42Å; T23-L124 VanDerWaalsContact CG2-CD2 3.42Å; T23-L124 HydrophobicContact CG2-CG 4.43Å; D27-L124 HydrophobicContact CB-CD2 4.24Å; R120-L124 HydrophobicContact CG-CD1 3.96Å; R120-L124 HydrophobicContact CG-CG 4.31Å; R120-L124 WeakPolarHBondContact O-CB 3.33Å; R120-L124 VanDerWaalsContact O-CG 3.29Å; R120-L124 WeakPolarHBondContact O-CG 3.39Å; R120-L124 PolarHBondContact O-N 2.98Å; L122-L124 VanDerWaalsContact C-N 3.35Å; L122-L124 PolarHBondContact O-N 3.03Å; L124-S127 WeakPolarHBondContact CA-OG 3.47Å; L124-S127 PolarHBondContact O-N 3.48Å; L124-S127 PolarHBondContact O-OG 3.19Å; L124-K128 PolarHBondContact O-N 3.45Å
125R88.7Confident91.2Very high28 Ų2824.6 Ų24.611%0.10613%0.13CC..Hα-helixtrans-66.4-48.1176.9-71.4-175.2175.6-87.74.3111.9I72 E73 I81 D82 I121 L122 V123 S127 K128I72-R125 VanDerWaalsContact CG2-NE 3.31Å; E73-R125 IonicContact OE1-CZ 2.75Å; E73-R125 IonicContact OE1-NH2 3.71Å; E73-R125 PolarHBondContact OE1-NH2 3.21Å; E73-R125 IonicContact OE2-NH2 3.63Å; I81-R125 HydrophobicContact CD1-CB 4.05Å; I81-R125 HydrophobicContact CG1-CB 4.41Å; D82-R125 WeakPolarHBondContact OD1-CD 3.37Å; D82-R125 IonicContact OD1-CZ 3.23Å; D82-R125 IonicContact OD1-NH1 2.75Å; D82-R125 PolarHBondContact OD1-NH1 2.86Å; D82-R125 IonicContact OD2-CZ 3.1Å; D82-R125 IonicContact OD2-NH1 3.96Å; D82-R125 PolarHBondContact OD2-NH1 3.42Å; I121-R125 PolarHBondContact O-N 2.9Å; L122-R125 PolarHBondContact O-N 3.12Å; V123-R125 VanDerWaalsContact C-N 3.34Å; V123-R125 PolarHBondContact O-N 3.34Å; R125-S127 VanDerWaalsContact C-N 3.25Å; R125-S127 PolarHBondContact O-N 3.43Å; R125-K128 WeakPolarHBondContact O-CB 3.3Å; R125-K128 PolarHBondContact O-N 3.25Å
126L91.1Very high91.1Very high0 Ų028.7 Ų28.70%015%0.147CC..Hα-helixtrans-59.5-35.5176.2-72.4167.3000112.8I81 V87 L92 L122 V123 K128 H129 G130 H131 A134 I135 L138I81-L126 HydrophobicContact CB-CD2 3.81Å; I81-L126 HydrophobicContact CB-CG 4.3Å; I81-L126 HydrophobicContact CG2-CD2 3.71Å; I81-L126 HydrophobicContact CG2-CG 4.38Å; V87-L126 HydrophobicContact CG2-CD2 3.86Å; L92-L126 HydrophobicContact CD2-CD1 4.2Å; L122-L126 WeakPolarHBondContact O-CB 3.49Å; L122-L126 WeakPolarHBondContact O-CG 3.27Å; L122-L126 PolarHBondContact O-N 2.75Å; V123-L126 PolarHBondContact O-N 3.24Å; L126-K128 VanDerWaalsContact C-N 3.31Å; L126-K128 PolarHBondContact O-N 3.27Å; L126-H129 PolarHBondContact O-N 3.43Å; L126-G130 PolarHBondContact O-N 3.32Å; L126-H131 HydrophobicContact CB-CB 4.11Å; L126-H131 HydrophobicContact CD2-CB 3.67Å; L126-H131 HydrophobicContact CG-CB 4.48Å; L126-H131 PolarHBondContact O-N 2.81Å; L126-H131 VanDerWaalsContact O-N 3.12Å; L126-A134 HydrophobicContact CD1-CB 4.04Å; L126-A134 HydrophobicContact CD2-CB 4.01Å; L126-I135 HydrophobicContact CB-CD1 3.99Å; L126-I135 HydrophobicContact CB-CG1 3.7Å; L126-I135 HydrophobicContact CD1-CG1 4.1Å; L126-L138 HydrophobicContact CD1-CD1 3.55Å
127S90.5Very high91.1Very high11 Ų1129.6 Ų29.68%0.07715%0.152CC..Hα-helixtrans-67.2-30.9-179.169.50000112.9V123 L124 R125 H129 G130V123-S127 VanDerWaalsContact O-CB 3.27Å; V123-S127 WeakPolarHBondContact O-CB 3.35Å; V123-S127 PolarHBondContact O-N 3.35Å; V123-S127 PolarHBondContact O-OG 3.02Å; L124-S127 WeakPolarHBondContact CA-OG 3.47Å; L124-S127 PolarHBondContact O-N 3.48Å; L124-S127 PolarHBondContact O-OG 3.19Å; R125-S127 VanDerWaalsContact C-N 3.25Å; R125-S127 PolarHBondContact O-N 3.43Å; S127-H129 PolarHBondContact O-N 3.42Å; S127-G130 PolarHBondContact O-N 3.19Å
128K87.9Confident91.4Very high141 Ų14129.6 Ų29.661%0.61315%0.152SC*.Hα-helixtrans-62.4-25.8176.3-69.1176.2-179.9-178.80113.1L124 R125 L126L124-K128 PolarHBondContact O-N 3.45Å; R125-K128 WeakPolarHBondContact O-CB 3.3Å; R125-K128 PolarHBondContact O-N 3.25Å; L126-K128 VanDerWaalsContact C-N 3.31Å; L126-K128 PolarHBondContact O-N 3.27Å
129H88.8Confident91.7Very high53 Ų5329.5 Ų29.525%0.24515%0.151CC..THydrogen-bonded Turntrans-112.28.8-177-59.7-73.9000113.1I81 D82 D84 L126 S127 H131I81-H129 PolarHBondContact O-CD2 2.91Å; D82-H129 PolarHBondContact O-CE1 3.19Å; D82-H129 PolarHBondContact O-NE2 2.98Å; D84-H129 IonicContact OD1-CE1 3.91Å; D84-H129 IonicContact OD1-CG 3.66Å; D84-H129 IonicContact OD1-ND1 3.87Å; D84-H129 PolarHBondContact OD1-ND1 3.27Å; L126-H129 PolarHBondContact O-N 3.43Å; S127-H129 PolarHBondContact O-N 3.42Å; H129-H131 WeakPolarHBondContact CB-NE2 3.47Å; H129-H131 PolarHBondContact O-N 2.94Å
130G88.3Confident91.7Very high39 Ų3935.4 Ų35.440%0.40218%0.177SC..THydrogen-bonded Turntrans7321.4174.700000115.3Y30 L126 S127 S132Y30-G130 VanDerWaalsContact OH-CA 3.3Å; Y30-G130 WeakPolarHBondContact OH-CA 3.18Å; Y30-G130 PolarHBondContact OH-O 2.89Å; L126-G130 PolarHBondContact O-N 3.32Å; S127-G130 PolarHBondContact O-N 3.19Å; G130-S132 PolarHBondContact O-N 2.96Å
131H91Very high91.9Very high16 Ų1633.4 Ų33.47%0.07417%0.17CC..  trans-79.160.3-178.2-63.8-50.6000112.8S83 K85 V87 L126 H129 D133 A134 I135S83-H131 PolarHBondContact O-NE2 3.37Å; K85-H131 PolarHBondContact O-CE1 2.93Å; K85-H131 PolarHBondContact O-NE2 2.94Å; V87-H131 HydrophobicContact CG2-CB 4.36Å; L126-H131 HydrophobicContact CB-CB 4.11Å; L126-H131 HydrophobicContact CD2-CB 3.67Å; L126-H131 HydrophobicContact CG-CB 4.48Å; L126-H131 PolarHBondContact O-N 2.81Å; L126-H131 VanDerWaalsContact O-N 3.12Å; H129-H131 WeakPolarHBondContact CB-NE2 3.47Å; H129-H131 PolarHBondContact O-N 2.94Å; H131-D133 VanDerWaalsContact C-N 3.34Å; H131-D133 PolarHBondContact O-N 3.26Å; H131-A134 HydrophobicContact CB-CB 4.16Å; H131-A134 PolarHBondContact O-N 3.24Å; H131-I135 WeakPolarHBondContact O-CG1 3.32Å; H131-I135 PolarHBondContact O-N 2.81Å; H131-I135 VanDerWaalsContact O-N 3.12Å
132S90.2Very high92.3Very high45 Ų4532.5 Ų32.532%0.31517%0.166SC..Hα-helixtrans-59.1-37.1-173.556.40000114.7Y30 G130 I135 K136Y30-S132 VanDerWaalsContact OH-CA 3.29Å; Y30-S132 WeakPolarHBondContact OH-CA 3.28Å; Y30-S132 VanDerWaalsContact OH-CB 3.28Å; Y30-S132 WeakPolarHBondContact OH-CB 3.43Å; Y30-S132 PolarHBondContact OH-N 2.83Å; Y30-S132 VanDerWaalsContact OH-N 3.1Å; G130-S132 PolarHBondContact O-N 2.96Å; S132-I135 PolarHBondContact O-N 3.41Å; S132-K136 WeakPolarHBondContact O-CG 3.47Å; S132-K136 PolarHBondContact O-N 3.38Å
133D91Very high92.6Very high71 Ų7132.7 Ų32.738%0.3817%0.167SC..Hα-helixtrans-74.1-36.8-179.164.8-30.9000112.1K89 H131 K136 M137K89-D133 HydrophobicContact CD-CB 4.33Å; K89-D133 VanDerWaalsContact CD-OD2 3.29Å; K89-D133 WeakPolarHBondContact CD-OD2 3.33Å; K89-D133 VanDerWaalsContact CE-OD2 3.29Å; K89-D133 WeakPolarHBondContact CE-OD2 3.46Å; K89-D133 IonicContact NZ-OD2 2.71Å; K89-D133 PolarHBondContact NZ-OD2 3.41Å; H131-D133 VanDerWaalsContact C-N 3.34Å; H131-D133 PolarHBondContact O-N 3.26Å; D133-K136 PolarHBondContact O-N 2.72Å; D133-M137 WeakPolarHBondContact O-CB 3.29Å; D133-M137 PolarHBondContact O-N 3.04Å
134A93.3Very high92.8Very high0 Ų035.2 Ų35.20%018%0.179CC..Hα-helixtrans-63.4-42.5170.300000111.4V87 K89 L92 L126 H131 M137 L138V87-A134 HydrophobicContact CG1-CB 4.48Å; K89-A134 HydrophobicContact CG-CB 4.4Å; L92-A134 HydrophobicContact CD2-CB 4.17Å; L126-A134 HydrophobicContact CD1-CB 4.04Å; L126-A134 HydrophobicContact CD2-CB 4.01Å; H131-A134 HydrophobicContact CB-CB 4.16Å; H131-A134 PolarHBondContact O-N 3.24Å; A134-M137 WeakPolarHBondContact O-CB 3.49Å; A134-M137 PolarHBondContact O-N 2.65Å; A134-L138 WeakPolarHBondContact O-CG 3.09Å; A134-L138 PolarHBondContact O-N 2.97Å
135I93.9Very high93.2Very high0 Ų034.3 Ų34.30%017%0.173CC..Hα-helixtrans-61.4-48.1175.7-67.6165.8000111.1Y30 L31 L34 V123 L126 H131 S132 M137 L138 I139Y30-I135 HydrophobicContact CE1-CD1 3.82Å; L31-I135 HydrophobicContact CD2-CD1 4.23Å; L31-I135 HydrophobicContact CD2-CG2 4.25Å; L34-I135 HydrophobicContact CD2-CB 3.99Å; L34-I135 HydrophobicContact CD2-CG2 3.54Å; V123-I135 HydrophobicContact CG1-CD1 4.27Å; V123-I135 HydrophobicContact CG1-CG1 4.22Å; V123-I135 HydrophobicContact CG1-CG2 3.92Å; V123-I135 HydrophobicContact CG2-CG1 4.47Å; V123-I135 HydrophobicContact CG2-CG2 4.09Å; L126-I135 HydrophobicContact CB-CD1 3.99Å; L126-I135 HydrophobicContact CB-CG1 3.7Å; L126-I135 HydrophobicContact CD1-CG1 4.1Å; H131-I135 WeakPolarHBondContact O-CG1 3.32Å; H131-I135 PolarHBondContact O-N 2.81Å; H131-I135 VanDerWaalsContact O-N 3.12Å; S132-I135 PolarHBondContact O-N 3.41Å; I135-M137 VanDerWaalsContact C-N 3.27Å; I135-M137 PolarHBondContact O-N 2.71Å; I135-L138 PolarHBondContact O-N 3.49Å; I135-I139 HydrophobicContact CG2-CD1 4.06Å; I135-I139 WeakPolarHBondContact O-CG1 3.46Å; I135-I139 PolarHBondContact O-N 3.32Å; I135-I139 VanDerWaalsContact O-N 3.08Å
136K93Very high93.6Very high85 Ų8533 Ų3337%0.3717%0.168SC..Hα-helixtrans-58.1-41.1175.9-79.5170166.9162.60111.7L34 S132 D133 K140L34-K136 HydrophobicContact CD1-CD 3.89Å; L34-K136 HydrophobicContact CD1-CG 4.08Å; L34-K136 HydrophobicContact CD2-CG 4.3Å; L34-K136 HydrophobicContact CG-CG 4.24Å; S132-K136 WeakPolarHBondContact O-CG 3.47Å; S132-K136 PolarHBondContact O-N 3.38Å; D133-K136 PolarHBondContact O-N 2.72Å; K136-K140 VanDerWaalsContact O-CB 3.32Å; K136-K140 WeakPolarHBondContact O-CB 3.36Å; K136-K140 PolarHBondContact O-N 3.01Å
137M95.1Very high93.9Very high20 Ų2034.3 Ų34.310%0.09918%0.175CC..Hα-helixtrans-62.5-47.7176170.8-83.7-7700111.5K89 L92 E93 D133 A134 I135 I139 K140 I141K89-M137 HydrophobicContact CB-CE 4.13Å; K89-M137 HydrophobicContact CG-CE 4.34Å; K89-M137 WeakPolarHBondContact O-CE 3.45Å; L92-M137 HydrophobicContact CB-CE 4.02Å; L92-M137 HydrophobicContact CD2-CE 3.74Å; L92-M137 HydrophobicContact CG-CE 3.86Å; E93-M137 HydrophobicContact CB-CE 4.3Å; E93-M137 HydrophobicContact CB-SD 4.01Å; D133-M137 WeakPolarHBondContact O-CB 3.29Å; D133-M137 PolarHBondContact O-N 3.04Å; A134-M137 WeakPolarHBondContact O-CB 3.49Å; A134-M137 PolarHBondContact O-N 2.65Å; I135-M137 VanDerWaalsContact C-N 3.27Å; I135-M137 PolarHBondContact O-N 2.71Å; M137-I139 PolarHBondContact O-N 2.94Å; M137-K140 WeakPolarHBondContact O-CB 3.37Å; M137-K140 PolarHBondContact O-N 3.14Å; M137-I141 HydrophobicContact CG-CD1 3.88Å; M137-I141 HydrophobicContact CG-CG1 4.41Å; M137-I141 WeakPolarHBondContact O-CG1 3.49Å; M137-I141 PolarHBondContact O-N 3.03Å; M137-I141 HydrophobicContact SD-CD1 3.21Å; M137-I141 WeakPolarHBondContact SD-CD1 3.44Å; M137-I141 HydrophobicContact SD-CG1 4.18Å
138L96.5Very high94.2Very high0 Ų040 Ų400%020%0.201CC..Hα-helixtrans-62.1-41.7180-71.8177.4000112.7L92 Y96 L119 L122 L126 A134 I135 T142L92-L138 HydrophobicContact CD2-CD1 4.35Å; L92-L138 HydrophobicContact CD2-CD2 4.39Å; L92-L138 HydrophobicContact CD2-CG 4.41Å; L92-L138 HydrophobicContact CG-CD2 4.25Å; Y96-L138 HydrophobicContact CD1-CD2 3.77Å; Y96-L138 HydrophobicContact CD2-CD2 3.99Å; Y96-L138 HydrophobicContact CE1-CD2 4.24Å; Y96-L138 HydrophobicContact CE2-CD2 4.45Å; Y96-L138 HydrophobicContact CG-CD2 3.63Å; L119-L138 HydrophobicContact CD1-CB 3.73Å; L122-L138 HydrophobicContact CB-CD1 3.85Å; L122-L138 HydrophobicContact CD1-CD1 4.17Å; L122-L138 HydrophobicContact CD1-CD2 4.47Å; L126-L138 HydrophobicContact CD1-CD1 3.55Å; A134-L138 WeakPolarHBondContact O-CG 3.09Å; A134-L138 PolarHBondContact O-N 2.97Å; I135-L138 PolarHBondContact O-N 3.49Å; L138-T142 WeakPolarHBondContact O-CB 3.5Å; L138-T142 PolarHBondContact O-N 3.5Å; L138-T142 PolarHBondContact O-OG1 3.31Å
139I95.6Very high94.6Very high4 Ų439.1 Ų39.12%0.02120%0.197CC..Hα-helixtrans-63.4-45.4175.6-65.7169.5000110.3C15 L19 I135 M137 T142 S143C15-I139 HydrophobicContact CB-CG2 3.86Å; L19-I139 HydrophobicContact CD1-CD1 3.67Å; L19-I139 HydrophobicContact CD1-CG1 3.84Å; I135-I139 HydrophobicContact CG2-CD1 4.06Å; I135-I139 WeakPolarHBondContact O-CG1 3.46Å; I135-I139 PolarHBondContact O-N 3.32Å; I135-I139 VanDerWaalsContact O-N 3.08Å; M137-I139 PolarHBondContact O-N 2.94Å; I139-T142 PolarHBondContact O-N 3.37Å; I139-S143 PolarHBondContact O-N 2.98Å
140K95.1Very high95Very high125 Ų12536.6 Ų36.654%0.54319%0.185SC..Hα-helixtrans-59.3-51177.8-174.5-169.1171.6-169.80111.1K136 M137 T142 S143 Q144K136-K140 VanDerWaalsContact O-CB 3.32Å; K136-K140 WeakPolarHBondContact O-CB 3.36Å; K136-K140 PolarHBondContact O-N 3.01Å; M137-K140 WeakPolarHBondContact O-CB 3.37Å; M137-K140 PolarHBondContact O-N 3.14Å; K140-T142 VanDerWaalsContact C-N 3.32Å; K140-T142 PolarHBondContact O-N 2.91Å; K140-S143 PolarHBondContact O-N 3.14Å; K140-S143 PolarHBondContact O-OG 3.14Å; K140-Q144 WeakPolarHBondContact O-CG 3.3Å; K140-Q144 PolarHBondContact O-N 3.21Å
141I97.4Very high95.5Very high7 Ų735.7 Ų35.74%0.03617%0.17CC..Hα-helixtrans-58.4-45.9177.6-68.5172.3000110.5E93 Y96 L97 M137 S143 Q144 Y145E93-I141 HydrophobicContact CB-CD1 3.64Å; E93-I141 HydrophobicContact CG-CD1 3.4Å; E93-I141 HydrophobicContact CG-CG1 4.47Å; Y96-I141 HydrophobicContact CD1-CB 4.37Å; Y96-I141 HydrophobicContact CD1-CG2 3.83Å; Y96-I141 HydrophobicContact CE1-CG2 4.11Å; L97-I141 HydrophobicContact CD2-CG2 3.59Å; L97-I141 HydrophobicContact CG-CG2 4.03Å; M137-I141 HydrophobicContact CG-CD1 3.88Å; M137-I141 HydrophobicContact CG-CG1 4.41Å; M137-I141 WeakPolarHBondContact O-CG1 3.49Å; M137-I141 PolarHBondContact O-N 3.03Å; M137-I141 HydrophobicContact SD-CD1 3.21Å; M137-I141 WeakPolarHBondContact SD-CD1 3.44Å; M137-I141 HydrophobicContact SD-CG1 4.18Å; I141-S143 VanDerWaalsContact C-N 3.29Å; I141-S143 PolarHBondContact O-N 3.23Å; I141-Q144 PolarHBondContact O-N 3.19Å; I141-Q144 VanDerWaalsContact O-N 3.17Å; I141-Y145 VanDerWaalsContact O-CB 3.28Å; I141-Y145 WeakPolarHBondContact O-CB 3.31Å; I141-Y145 PolarHBondContact O-N 3.44Å
142T97.9Very high95.7Very high0 Ų041.5 Ų41.50%020%0.202CC..Hα-helixtrans-57.8-43.8179.3-56.30000111.3Y96 M115 L119 L138 I139 K140 S146Y96-T142 WeakPolarHBondContact CE1-OG1 3.34Å; Y96-T142 PolarHBondContact OH-OG1 2.97Å; M115-T142 HydrophobicContact CE-CG2 3.73Å; M115-T142 HydrophobicContact CG-CG2 4.31Å; M115-T142 HydrophobicContact SD-CG2 3.86Å; L119-T142 HydrophobicContact CD2-CG2 4.16Å; L138-T142 WeakPolarHBondContact O-CB 3.5Å; L138-T142 PolarHBondContact O-N 3.5Å; L138-T142 PolarHBondContact O-OG1 3.31Å; I139-T142 PolarHBondContact O-N 3.37Å; K140-T142 VanDerWaalsContact C-N 3.32Å; K140-T142 PolarHBondContact O-N 2.91Å; T142-S146 VanDerWaalsContact O-CB 3.29Å; T142-S146 WeakPolarHBondContact O-CB 3.29Å; T142-S146 PolarHBondContact O-N 3.17Å; T142-S146 PolarHBondContact O-OG 2.63Å
143S96.4Very high96.1Very high7 Ų741.7 Ų41.75%0.04920%0.196CC..Hα-helixtrans-67.1-40.4177.274.10000113I139 K140 I141 S146 D147I139-S143 PolarHBondContact O-N 2.98Å; K140-S143 PolarHBondContact O-N 3.14Å; K140-S143 PolarHBondContact O-OG 3.14Å; I141-S143 VanDerWaalsContact C-N 3.29Å; I141-S143 PolarHBondContact O-N 3.23Å; S143-S146 PolarHBondContact O-N 3Å; S143-D147 PolarHBondContact O-N 3.46Å
144Q97.2Very high96.4Very high53 Ų5338.3 Ų38.325%0.24818%0.178CC..Hα-helixtrans-67.3-49178.1-71.5178.8-7200111.3K140 I141 S146 D147 E148K140-Q144 WeakPolarHBondContact O-CG 3.3Å; K140-Q144 PolarHBondContact O-N 3.21Å; I141-Q144 PolarHBondContact O-N 3.19Å; I141-Q144 VanDerWaalsContact O-N 3.17Å; Q144-S146 VanDerWaalsContact C-N 3.25Å; Q144-S146 PolarHBondContact O-N 3.4Å; Q144-D147 PolarHBondContact O-N 2.85Å; Q144-D147 VanDerWaalsContact O-N 3.14Å; Q144-E148 WeakPolarHBondContact O-CB 3.37Å; Q144-E148 WeakPolarHBondContact O-CG 3.37Å; Q144-E148 PolarHBondContact O-N 2.83Å
145Y97.9Very high96.5Very high16 Ų1641.6 Ų41.66%0.06320%0.195CC..Hα-helixtrans-56.7-43176.1-168.5-82.6000111.2L97 L100 D101 F104 I141 E148 K149 L150L97-Y145 HydrophobicContact CD2-CD2 3.81Å; L97-Y145 HydrophobicContact CD2-CE2 4.43Å; L100-Y145 HydrophobicContact CB-CD1 4.4Å; L100-Y145 HydrophobicContact CB-CD2 4.2Å; L100-Y145 HydrophobicContact CB-CE1 4.1Å; L100-Y145 HydrophobicContact CB-CE2 3.85Å; L100-Y145 HydrophobicContact CB-CG 4.46Å; L100-Y145 HydrophobicContact CD1-CD1 4.01Å; L100-Y145 HydrophobicContact CD1-CD2 3.97Å; L100-Y145 HydrophobicContact CD1-CE2 4.46Å; L100-Y145 HydrophobicContact CD1-CG 3.71Å; D101-Y145 WeakPolarHBondContact OD1-CE2 3.21Å; D101-Y145 PolarHBondContact OD1-OH 2.78Å; F104-Y145 HydrophobicContact CB-CE1 4.49Å; F104-Y145 HydrophobicContact CD2-CD1 4.38Å; F104-Y145 AromaticContact CD2-CE1 3.54Å; F104-Y145 HydrophobicContact CD2-CE1 3.54Å; F104-Y145 HydrophobicContact CE2-CE1 4.12Å; F104-Y145 HydrophobicContact CG-CE1 4.31Å; I141-Y145 VanDerWaalsContact O-CB 3.28Å; I141-Y145 WeakPolarHBondContact O-CB 3.31Å; I141-Y145 PolarHBondContact O-N 3.44Å; Y145-E148 PolarHBondContact O-N 3.04Å; Y145-K149 HydrophobicContact CD1-CB 4.1Å; Y145-K149 HydrophobicContact CD1-CG 4.24Å; Y145-K149 HydrophobicContact CD2-CG 4.28Å; Y145-K149 HydrophobicContact CE1-CB 3.76Å; Y145-K149 HydrophobicContact CE1-CG 3.95Å; Y145-K149 HydrophobicContact CE2-CG 4.02Å; Y145-K149 HydrophobicContact CG-CG 4.39Å; Y145-K149 WeakPolarHBondContact O-CB 3.39Å; Y145-K149 PolarHBondContact O-N 2.83Å; Y145-L150 HydrophobicContact CD1-CD1 4.34Å; Y145-L150 HydrophobicContact CD1-CG 4.24Å; Y145-L150 HydrophobicContact CE1-CD2 4.22Å; Y145-L150 HydrophobicContact CE1-CG 4.31Å
146S97.8Very high96.6Very high0 Ų048.1 Ų48.10%023%0.229CC..Iπ-helixtrans-63.8-43.8177.6-60.90000112.2T142 S143 Q144 E148 L150 K151T142-S146 VanDerWaalsContact O-CB 3.29Å; T142-S146 WeakPolarHBondContact O-CB 3.29Å; T142-S146 PolarHBondContact O-N 3.17Å; T142-S146 PolarHBondContact O-OG 2.63Å; S143-S146 PolarHBondContact O-N 3Å; Q144-S146 VanDerWaalsContact C-N 3.25Å; Q144-S146 PolarHBondContact O-N 3.4Å; S146-E148 VanDerWaalsContact C-N 3.34Å; S146-E148 PolarHBondContact O-N 3.06Å; S146-L150 CarbonylContact O-C 3.25Å; S146-L150 WeakPolarHBondContact O-CA 3.32Å; S146-L150 WeakPolarHBondContact O-CB 3.2Å; S146-L150 PolarHBondContact O-N 2.7Å; S146-K151 PolarHBondContact O-N 3.22Å
147D97Very high96.7Very high27 Ų2747.5 Ų47.514%0.14423%0.227CC..Iπ-helixtrans-64.1-38.5177.3-169.544.6000112.2F7 R8 S143 Q144 K151F7-D147 HydrophobicContact CD1-CB 4.34Å; R8-D147 HydrophobicContact CB-CB 3.87Å; R8-D147 HydrophobicContact CG-CB 4.23Å; S143-D147 PolarHBondContact O-N 3.46Å; Q144-D147 PolarHBondContact O-N 2.85Å; Q144-D147 VanDerWaalsContact O-N 3.14Å; D147-K151 VanDerWaalsContact O-CB 3.3Å; D147-K151 WeakPolarHBondContact O-CB 3.21Å; D147-K151 VanDerWaalsContact OD1-CD 3.31Å; D147-K151 WeakPolarHBondContact OD1-CD 3.29Å; D147-K151 IonicContact OD1-NZ 3.74Å
148E96.7Very high96.7Very high132 Ų13252.3 Ų52.362%0.61725%0.254SS*.Iπ-helixtrans-82.3-38.4-175.9-69.9175-163.900113.9Q144 Y145 S146Q144-E148 WeakPolarHBondContact O-CB 3.37Å; Q144-E148 WeakPolarHBondContact O-CG 3.37Å; Q144-E148 PolarHBondContact O-N 2.83Å; Y145-E148 PolarHBondContact O-N 3.04Å; S146-E148 VanDerWaalsContact C-N 3.34Å; S146-E148 PolarHBondContact O-N 3.06Å
149K97Very high96.6Very high121 Ų12153 Ų5353%0.52626%0.26SS..Iπ-helixtrans-114-33.7-168.8-56.4-66.1-173.8171.40113.7Y145Y145-K149 HydrophobicContact CD1-CB 4.1Å; Y145-K149 HydrophobicContact CD1-CG 4.24Å; Y145-K149 HydrophobicContact CD2-CG 4.28Å; Y145-K149 HydrophobicContact CE1-CB 3.76Å; Y145-K149 HydrophobicContact CE1-CG 3.95Å; Y145-K149 HydrophobicContact CE2-CG 4.02Å; Y145-K149 HydrophobicContact CG-CG 4.39Å; Y145-K149 WeakPolarHBondContact O-CB 3.39Å; Y145-K149 PolarHBondContact O-N 2.83Å
150L97.7Very high96.6Very high1 Ų153.1 Ų53.11%0.00526%0.26CS..Iπ-helixtrans-102.9-27.1-169.9-51.1-177000113F104 L107 M115 Y145 S146 N152 W153 I154F104-L150 HydrophobicContact CB-CD2 4.36Å; F104-L150 HydrophobicContact CD1-CD2 3.74Å; F104-L150 HydrophobicContact CD2-CD1 4.47Å; F104-L150 HydrophobicContact CD2-CD2 4.07Å; F104-L150 HydrophobicContact CE1-CD1 4.15Å; F104-L150 HydrophobicContact CE1-CD2 3.96Å; F104-L150 HydrophobicContact CE2-CD1 3.9Å; F104-L150 HydrophobicContact CE2-CD2 4.27Å; F104-L150 HydrophobicContact CG-CD2 3.8Å; F104-L150 HydrophobicContact CZ-CD1 3.71Å; F104-L150 HydrophobicContact CZ-CD2 4.21Å; L107-L150 HydrophobicContact CD2-CD2 3.57Å; M115-L150 HydrophobicContact CE-CD1 4.2Å; M115-L150 HydrophobicContact SD-CD1 4.15Å; Y145-L150 HydrophobicContact CD1-CD1 4.34Å; Y145-L150 HydrophobicContact CD1-CG 4.24Å; Y145-L150 HydrophobicContact CE1-CD2 4.22Å; Y145-L150 HydrophobicContact CE1-CG 4.31Å; S146-L150 CarbonylContact O-C 3.25Å; S146-L150 WeakPolarHBondContact O-CA 3.32Å; S146-L150 WeakPolarHBondContact O-CB 3.2Å; S146-L150 PolarHBondContact O-N 2.7Å; L150-N152 VanDerWaalsContact C-N 3.35Å; L150-N152 PolarHBondContact O-N 2.74Å; L150-W153 PolarHBondContact O-N 3.06Å; L150-W153 VanDerWaalsContact O-N 3.09Å; L150-I154 HydrophobicContact CB-CD1 3.69Å; L150-I154 HydrophobicContact CB-CG1 4.37Å; L150-I154 WeakPolarHBondContact O-CG1 3.41Å; L150-I154 PolarHBondContact O-N 2.97Å
151K97Very high96.6Very high20 Ų2048.5 Ų48.59%0.08724%0.244CC..Hα-helixtrans-51.2-47.5-171.4176.7175.1178.8177.40114S4 F7 S146 D147 W153 I154 N155S4-K151 VanDerWaalsContact CA-NZ 3.3Å; F7-K151 HydrophobicContact CB-CD 3.77Å; F7-K151 HydrophobicContact CB-CG 4.3Å; F7-K151 HydrophobicContact CD1-CB 3.78Å; F7-K151 HydrophobicContact CD1-CD 3.86Å; F7-K151 HydrophobicContact CD1-CG 3.76Å; F7-K151 HydrophobicContact CD2-CD 4.42Å; F7-K151 HydrophobicContact CD2-CG 4.03Å; F7-K151 HydrophobicContact CE1-CB 3.73Å; F7-K151 HydrophobicContact CE1-CG 4.08Å; F7-K151 HydrophobicContact CE2-CG 4.32Å; F7-K151 HydrophobicContact CG-CB 4.28Å; F7-K151 HydrophobicContact CG-CD 3.74Å; F7-K151 HydrophobicContact CG-CG 3.74Å; F7-K151 HydrophobicContact CZ-CB 4.19Å; F7-K151 HydrophobicContact CZ-CG 4.35Å; S146-K151 PolarHBondContact O-N 3.22Å; D147-K151 VanDerWaalsContact O-CB 3.3Å; D147-K151 WeakPolarHBondContact O-CB 3.21Å; D147-K151 VanDerWaalsContact OD1-CD 3.31Å; D147-K151 WeakPolarHBondContact OD1-CD 3.29Å; D147-K151 IonicContact OD1-NZ 3.74Å; K151-W153 VanDerWaalsContact C-N 3.31Å; K151-W153 PolarHBondContact O-N 2.94Å; K151-I154 PolarHBondContact O-N 2.92Å; K151-N155 WeakPolarHBondContact CE-ND2 3.41Å; K151-N155 WeakPolarHBondContact CG-ND2 3.41Å; K151-N155 WeakPolarHBondContact O-CB 3.34Å; K151-N155 VanDerWaalsContact O-CG 3.3Å; K151-N155 PolarHBondContact O-N 3.19Å; K151-N155 PolarHBondContact O-ND2 3.34Å
152N96.7Very high96.4Very high138 Ų13848.4 Ų48.474%0.73825%0.245SC*.Hα-helixtrans-62.9-41.6-177-70.8-22.9000111.5L150 L156L150-N152 VanDerWaalsContact C-N 3.35Å; L150-N152 PolarHBondContact O-N 2.74Å; N152-L156 PolarHBondContact O-N 2.77Å; N152-L156 VanDerWaalsContact O-N 3.15Å
153W97.3Very high96.2Very high49 Ų4948.5 Ų48.519%0.18625%0.245CC..Hα-helixtrans-68.7-46.5176.7-173.491.6000110.9L107 W109 I112 L150 K151 N155 L156 H157L107-W153 HydrophobicContact CB-CB 4.39Å; L107-W153 HydrophobicContact CB-CD2 3.89Å; L107-W153 HydrophobicContact CB-CG 3.69Å; L107-W153 HydrophobicContact CD1-CB 3.53Å; L107-W153 HydrophobicContact CD1-CG 3.73Å; L107-W153 HydrophobicContact CG-CG 4.36Å; W109-W153 AromaticContact CD1-CH2 3.79Å; W109-W153 AromaticContact CD2-CH2 3.93Å; W109-W153 HydrophobicContact CD2-CH2 3.93Å; W109-W153 AromaticContact CD2-CZ3 3.73Å; W109-W153 HydrophobicContact CD2-CZ3 3.73Å; W109-W153 AromaticContact CE2-CH2 3.9Å; W109-W153 AromaticContact CE2-CZ3 3.69Å; W109-W153 HydrophobicContact CE3-CZ3 4.07Å; W109-W153 AromaticContact CG-CH2 3.86Å; W109-W153 HydrophobicContact CG-CH2 3.86Å; W109-W153 HydrophobicContact CG-CZ3 4.16Å; W109-W153 HydrophobicContact CH2-CZ3 4.35Å; W109-W153 HydrophobicContact CZ2-CZ3 4.02Å; W109-W153 HydrophobicContact CZ3-CZ3 4.36Å; W109-W153 AromaticContact NE1-CH2 3.8Å; I112-W153 HydrophobicContact CD1-CE3 3.9Å; I112-W153 HydrophobicContact CD1-CZ3 3.64Å; L150-W153 PolarHBondContact O-N 3.06Å; L150-W153 VanDerWaalsContact O-N 3.09Å; K151-W153 VanDerWaalsContact C-N 3.31Å; K151-W153 PolarHBondContact O-N 2.94Å; W153-N155 VanDerWaalsContact C-N 3.33Å; W153-N155 PolarHBondContact O-N 3.17Å; W153-L156 WeakPolarHBondContact O-CB 3.32Å; W153-L156 PolarHBondContact O-N 2.81Å; W153-L156 VanDerWaalsContact O-N 3.08Å; W153-H157 AromaticContact CD2-CD2 3.62Å; W153-H157 AromaticContact CE2-CD2 3.32Å; W153-H157 AromaticContact CE2-NE2 3.41Å; W153-H157 AromaticContact CE3-CD2 3.96Å; W153-H157 AromaticContact CH2-CD2 3.72Å; W153-H157 AromaticContact CZ2-CD2 3.39Å; W153-H157 WeakPolarHBondContact CZ2-CD2 3.3Å; W153-H157 AromaticContact CZ2-NE2 3.43Å; W153-H157 WeakPolarHBondContact CZ2-NE2 3.28Å; W153-H157 AromaticContact CZ3-CD2 4Å; W153-H157 AromaticContact NE1-CD2 3.76Å; W153-H157 AromaticContact NE1-NE2 3.49Å; W153-H157 PolarHBondContact NE1-NE2 3.23Å; W153-H157 PolarHBondContact O-CD2 3.28Å; W153-H157 VanDerWaalsContact O-CD2 3.24Å; W153-H157 PolarHBondContact O-N 3.25Å
154I97.2Very high96.1Very high0 Ų050.7 Ų50.70%026%0.256CS..Hα-helixtrans-58.4-45178.5-71.6170000110.9F7 W109 I112 L150 K151 L156 H157 G159 W160F7-I154 HydrophobicContact CE2-CB 4.27Å; F7-I154 HydrophobicContact CE2-CG2 3.68Å; F7-I154 HydrophobicContact CZ-CB 4.05Å; F7-I154 HydrophobicContact CZ-CD1 3.77Å; F7-I154 HydrophobicContact CZ-CG2 3.8Å; W109-I154 HydrophobicContact CH2-CB 4.44Å; W109-I154 HydrophobicContact CH2-CG1 4.14Å; W109-I154 HydrophobicContact CH2-CG2 4Å; W109-I154 HydrophobicContact CZ3-CG1 4.23Å; I112-I154 HydrophobicContact CD1-CD1 4Å; I112-I154 HydrophobicContact CD1-CG1 3.82Å; L150-I154 HydrophobicContact CB-CD1 3.69Å; L150-I154 HydrophobicContact CB-CG1 4.37Å; L150-I154 WeakPolarHBondContact O-CG1 3.41Å; L150-I154 PolarHBondContact O-N 2.97Å; K151-I154 PolarHBondContact O-N 2.92Å; I154-L156 VanDerWaalsContact C-N 3.29Å; I154-L156 PolarHBondContact O-N 3.48Å; I154-H157 CarbonylContact O-C 3.22Å; I154-H157 VanDerWaalsContact O-C 3.25Å; I154-H157 WeakPolarHBondContact O-CA 3.45Å; I154-H157 PolarHBondContact O-N 2.9Å; I154-G159 VanDerWaalsContact O-CA 3.27Å; I154-G159 WeakPolarHBondContact O-CA 3.29Å; I154-G159 PolarHBondContact O-N 3.28Å; I154-W160 HydrophobicContact CD1-CE3 4.46Å; I154-W160 HydrophobicContact CD1-CH2 3.66Å; I154-W160 HydrophobicContact CD1-CZ2 3.77Å; I154-W160 HydrophobicContact CD1-CZ3 4.03Å; I154-W160 HydrophobicContact CG2-CD2 4.34Å; I154-W160 HydrophobicContact CG2-CG 4.49Å
155N95.6Very high95.8Very high69 Ų6954.3 Ų54.337%0.36927%0.273SS..Hα-helixtrans-67.8-26.9177.9-73.1-20.6000113.6K151 W153 H157K151-N155 WeakPolarHBondContact CE-ND2 3.41Å; K151-N155 WeakPolarHBondContact CG-ND2 3.41Å; K151-N155 WeakPolarHBondContact O-CB 3.34Å; K151-N155 VanDerWaalsContact O-CG 3.3Å; K151-N155 PolarHBondContact O-N 3.19Å; K151-N155 PolarHBondContact O-ND2 3.34Å; W153-N155 VanDerWaalsContact C-N 3.33Å; W153-N155 PolarHBondContact O-N 3.17Å; N155-H157 PolarHBondContact O-N 3.21Å
156L96.6Very high95.4Very high136 Ų13655.6 Ų55.671%0.71228%0.279SS*.Hα-helixtrans-69.9-21.1172.3-173.364.4000112N152 W153 I154N152-L156 PolarHBondContact O-N 2.77Å; N152-L156 VanDerWaalsContact O-N 3.15Å; W153-L156 WeakPolarHBondContact O-CB 3.32Å; W153-L156 PolarHBondContact O-N 2.81Å; W153-L156 VanDerWaalsContact O-N 3.08Å; I154-L156 VanDerWaalsContact C-N 3.29Å; I154-L156 PolarHBondContact O-N 3.48Å
157H95Very high94.9Very high72 Ų7256.5 Ų56.533%0.33329%0.285SS..THydrogen-bonded Turntrans-112.747.2179-68.1-77.9000111.4W109 W153 I154 N155 G159 G162W109-H157 HydrophobicContact CZ2-CB 3.9Å; W153-H157 AromaticContact CD2-CD2 3.62Å; W153-H157 AromaticContact CE2-CD2 3.32Å; W153-H157 AromaticContact CE2-NE2 3.41Å; W153-H157 AromaticContact CE3-CD2 3.96Å; W153-H157 AromaticContact CH2-CD2 3.72Å; W153-H157 AromaticContact CZ2-CD2 3.39Å; W153-H157 WeakPolarHBondContact CZ2-CD2 3.3Å; W153-H157 AromaticContact CZ2-NE2 3.43Å; W153-H157 WeakPolarHBondContact CZ2-NE2 3.28Å; W153-H157 AromaticContact CZ3-CD2 4Å; W153-H157 AromaticContact NE1-CD2 3.76Å; W153-H157 AromaticContact NE1-NE2 3.49Å; W153-H157 PolarHBondContact NE1-NE2 3.23Å; W153-H157 PolarHBondContact O-CD2 3.28Å; W153-H157 VanDerWaalsContact O-CD2 3.24Å; W153-H157 PolarHBondContact O-N 3.25Å; I154-H157 CarbonylContact O-C 3.22Å; I154-H157 VanDerWaalsContact O-C 3.25Å; I154-H157 WeakPolarHBondContact O-CA 3.45Å; I154-H157 PolarHBondContact O-N 2.9Å; N155-H157 PolarHBondContact O-N 3.21Å; H157-G159 VanDerWaalsContact C-N 3.3Å; H157-G159 PolarHBondContact O-N 3.45Å; H157-G162 WeakPolarHBondContact O-CA 3.49Å
158D94.3Very high94Very high122 Ų12258.3 Ų58.365%0.65231%0.31SS*.THydrogen-bonded Turntrans63.528.9174.7-57.2-53.5000115.5
159G94.9Very high92.8Very high13 Ų1357.8 Ų57.813%0.13431%0.308CS..G310 helixtrans66.2-156.4179.700000111.4W109 I154 H157 S161 G162W109-G159 WeakPolarHBondContact CH2-O 3.4Å; I154-G159 VanDerWaalsContact O-CA 3.27Å; I154-G159 WeakPolarHBondContact O-CA 3.29Å; I154-G159 PolarHBondContact O-N 3.28Å; H157-G159 VanDerWaalsContact C-N 3.3Å; H157-G159 PolarHBondContact O-N 3.45Å; G159-S161 PolarHBondContact O-N 3.15Å; G159-S161 VanDerWaalsContact O-N 3.14Å; G159-G162 PolarHBondContact O-N 3.1Å; G159-G162 VanDerWaalsContact O-N 3.14Å
160W96.4Very high91Very high7 Ų761.1 Ų61.13%0.02733%0.325CS..G310 helixtrans-63-19.8177.3-74.8116.1000113.6F7 T11 L14 I51 W109 I112 F116 I154 G162 L163F7-W160 HydrophobicContact CE1-CZ2 4.35Å; F7-W160 AromaticContact CE1-NE1 3.98Å; F7-W160 AromaticContact CE2-CD1 3.69Å; F7-W160 AromaticContact CE2-NE1 3.36Å; F7-W160 AromaticContact CZ-CE2 3.66Å; F7-W160 AromaticContact CZ-CZ2 3.89Å; F7-W160 HydrophobicContact CZ-CZ2 3.89Å; F7-W160 AromaticContact CZ-NE1 3.3Å; F7-W160 VanDerWaalsContact CZ-NE1 3.3Å; T11-W160 HydrophobicContact CG2-CH2 4.37Å; T11-W160 HydrophobicContact CG2-CZ2 3.61Å; T11-W160 WeakPolarHBondContact OG1-CZ2 3.43Å; T11-W160 PolarHBondContact OG1-NE1 2.84Å; T11-W160 VanDerWaalsContact OG1-NE1 3.1Å; L14-W160 HydrophobicContact CD1-CB 3.83Å; L14-W160 HydrophobicContact CD1-CD2 3.57Å; L14-W160 HydrophobicContact CD1-CE3 4.12Å; L14-W160 HydrophobicContact CD1-CG 3.43Å; L14-W160 VanDerWaalsContact CD1-CG 3.43Å; I51-W160 HydrophobicContact CD1-CB 3.84Å; W109-W160 HydrophobicContact CZ3-CE3 4.21Å; W109-W160 HydrophobicContact CZ3-CZ3 4.26Å; I112-W160 HydrophobicContact CG2-CH2 4.13Å; I112-W160 HydrophobicContact CG2-CZ3 3.74Å; F116-W160 AromaticContact CE2-CH2 3.82Å; F116-W160 HydrophobicContact CE2-CH2 3.82Å; F116-W160 AromaticContact CE2-CZ3 3.79Å; F116-W160 HydrophobicContact CE2-CZ3 3.79Å; F116-W160 AromaticContact CZ-CH2 3.99Å; F116-W160 HydrophobicContact CZ-CH2 3.99Å; F116-W160 HydrophobicContact CZ-CZ3 4.15Å; I154-W160 HydrophobicContact CD1-CE3 4.46Å; I154-W160 HydrophobicContact CD1-CH2 3.66Å; I154-W160 HydrophobicContact CD1-CZ2 3.77Å; I154-W160 HydrophobicContact CD1-CZ3 4.03Å; I154-W160 HydrophobicContact CG2-CD2 4.34Å; I154-W160 HydrophobicContact CG2-CG 4.49Å; W160-G162 PolarHBondContact O-N 3.23Å; W160-L163 HydrophobicContact CE3-CD1 3.7Å; W160-L163 HydrophobicContact CZ3-CD1 3.95Å; W160-L163 PolarHBondContact O-N 3.37Å
161S94.7Very high89.2Confident29 Ų2961.6 Ų61.620%0.20333%0.327CS..G310 helixtrans-67.5-20.9176.2-68.80000113.2N47 G159 L163 I164N47-S161 PolarHBondContact ND2-OG 3.14Å; G159-S161 PolarHBondContact O-N 3.15Å; G159-S161 VanDerWaalsContact O-N 3.14Å; S161-L163 PolarHBondContact O-N 2.75Å; S161-L163 VanDerWaalsContact O-N 3.14Å; S161-I164 VanDerWaalsContact O-CB 3.31Å; S161-I164 WeakPolarHBondContact O-CB 3.39Å; S161-I164 WeakPolarHBondContact O-CG1 3.46Å; S161-I164 PolarHBondContact O-N 3.41Å
162G93.9Very high87.3Confident5 Ų566.5 Ų66.55%0.05236%0.359CS..Hα-helixtrans-60.4-21.4174.600000114.4H157 G159 W160 I164 E165 F166H157-G162 WeakPolarHBondContact O-CA 3.49Å; G159-G162 PolarHBondContact O-N 3.1Å; G159-G162 VanDerWaalsContact O-N 3.14Å; W160-G162 PolarHBondContact O-N 3.23Å; G162-I164 PolarHBondContact O-N 3.5Å; G162-E165 PolarHBondContact O-N 3.12Å; G162-F166 WeakPolarHBondContact O-CB 3.45Å; G162-F166 PolarHBondContact O-N 2.93Å; G162-F166 VanDerWaalsContact O-N 3.08Å
163L92.9Very high85.7Confident1 Ų161 Ų611%0.00533%0.329CS..Hα-helixtrans-61.2-31.2170.7-92.8157.9000112.9I51 L55 L58 W109 V113 W160 S161 S167I51-L163 HydrophobicContact CG2-CD1 4.19Å; L55-L163 HydrophobicContact CD1-CD2 4.45Å; L58-L163 HydrophobicContact CD1-CD2 3.73Å; W109-L163 HydrophobicContact CD2-CG 4.34Å; W109-L163 HydrophobicContact CE3-CD1 4.32Å; W109-L163 HydrophobicContact CE3-CD2 4.04Å; W109-L163 HydrophobicContact CE3-CG 3.65Å; W109-L163 HydrophobicContact CH2-CG 4.36Å; W109-L163 HydrophobicContact CZ3-CD1 3.98Å; W109-L163 HydrophobicContact CZ3-CG 3.67Å; V113-L163 HydrophobicContact CG2-CD2 3.93Å; W160-L163 HydrophobicContact CE3-CD1 3.7Å; W160-L163 HydrophobicContact CZ3-CD1 3.95Å; W160-L163 PolarHBondContact O-N 3.37Å; S161-L163 PolarHBondContact O-N 2.75Å; S161-L163 VanDerWaalsContact O-N 3.14Å; L163-S167 WeakPolarHBondContact O-CB 3.32Å; L163-S167 PolarHBondContact O-N 3.4Å
164I94.1Very high84.4Confident54 Ų5461.7 Ų61.728%0.27734%0.336SS..Hα-helixtrans-66.4-51.1-178.2-57.7167.8000109N47 E50 I51 S161 G162 S167 G168N47-I164 HydrophobicContact CB-CD1 3.7Å; E50-I164 HydrophobicContact CB-CD1 3.6Å; E50-I164 HydrophobicContact CB-CG1 4.1Å; I51-I164 HydrophobicContact CG1-CD1 3.99Å; I51-I164 HydrophobicContact CG1-CG1 4.02Å; S161-I164 VanDerWaalsContact O-CB 3.31Å; S161-I164 WeakPolarHBondContact O-CB 3.39Å; S161-I164 WeakPolarHBondContact O-CG1 3.46Å; S161-I164 PolarHBondContact O-N 3.41Å; G162-I164 PolarHBondContact O-N 3.5Å; I164-S167 PolarHBondContact O-N 3.08Å; I164-S167 PolarHBondContact O-OG 2.85Å; I164-G168 PolarHBondContact O-N 3.18Å
165E90.7Very high82.6Confident128 Ų12861.7 Ų61.760%0.59834%0.336SS*.Hα-helixtrans-62.4-45.2177.2-174.5174.9-17600111.3G162 S167 G168 H169G162-E165 PolarHBondContact O-N 3.12Å; E165-S167 PolarHBondContact O-N 3.23Å; E165-G168 PolarHBondContact O-N 3.02Å; E165-H169 PolarHBondContact O-CD2 3.25Å
166F90.5Very high81.2Confident44 Ų4459 Ų5919%0.19332%0.322CS..Hα-helixtrans-57.1-37.9176.4176.6-106.8000112.8L58 W109 V113 G162 G168 H169 F171L58-F166 HydrophobicContact CD1-CD1 3.76Å; L58-F166 HydrophobicContact CD1-CE1 4.08Å; L58-F166 HydrophobicContact CD2-CD1 4.1Å; L58-F166 HydrophobicContact CD2-CE1 3.85Å; W109-F166 HydrophobicContact CB-CB 4.2Å; W109-F166 HydrophobicContact CB-CD1 3.51Å; W109-F166 HydrophobicContact CB-CD2 3.71Å; W109-F166 HydrophobicContact CB-CE1 3.66Å; W109-F166 HydrophobicContact CB-CE2 3.87Å; W109-F166 HydrophobicContact CB-CG 3.52Å; W109-F166 HydrophobicContact CB-CZ 3.83Å; W109-F166 AromaticContact CD1-CG 3.92Å; W109-F166 HydrophobicContact CG-CB 4.05Å; W109-F166 HydrophobicContact CG-CD1 4.23Å; W109-F166 HydrophobicContact CG-CD2 4.21Å; W109-F166 AromaticContact CG-CG 3.9Å; W109-F166 HydrophobicContact CG-CG 3.9Å; V113-F166 HydrophobicContact CG2-CE1 4.33Å; G162-F166 WeakPolarHBondContact O-CB 3.45Å; G162-F166 PolarHBondContact O-N 2.93Å; G162-F166 VanDerWaalsContact O-N 3.08Å; F166-G168 PolarHBondContact O-N 3.48Å; F166-H169 PolarHBondContact O-N 3.38Å; F166-H169 VanDerWaalsContact O-N 3.12Å; F166-F171 AromaticContact CE1-CD2 3.62Å; F166-F171 HydrophobicContact CE1-CD2 3.62Å; F166-F171 AromaticContact CE1-CE2 3.77Å; F166-F171 HydrophobicContact CE1-CE2 3.77Å; F166-F171 AromaticContact CZ-CD2 3.59Å; F166-F171 HydrophobicContact CZ-CD2 3.59Å; F166-F171 AromaticContact CZ-CE2 3.95Å; F166-F171 HydrophobicContact CZ-CE2 3.95Å
167S86.8Confident79.9Confident18 Ų1857.3 Ų57.313%0.12631%0.31CS..Hα-helixtrans-66.8-19.7178.673.70000114.5S54 L163 I164 E165 H169S54-S167 WeakPolarHBondContact CB-OG 3.26Å; S54-S167 PolarHBondContact OG-OG 2.9Å; L163-S167 WeakPolarHBondContact O-CB 3.32Å; L163-S167 PolarHBondContact O-N 3.4Å; I164-S167 PolarHBondContact O-N 3.08Å; I164-S167 PolarHBondContact O-OG 2.85Å; E165-S167 PolarHBondContact O-N 3.23Å; S167-H169 VanDerWaalsContact C-N 3.32Å
168G78.9Confident78.7Confident66 Ų6655.2 Ų55.268%0.6830%0.301SS*.Hα-helixtrans-77.7-15.8173.800000113.9I164 E165 F166I164-G168 PolarHBondContact O-N 3.18Å; E165-G168 PolarHBondContact O-N 3.02Å; F166-G168 PolarHBondContact O-N 3.48Å
169H70.9Confident77.5Confident121 Ų12149.4 Ų49.456%0.5627%0.27SS*.SBendtrans-98.1156.2-179.3-67-61.2000112.4E165 F166 S167 F171E165-H169 PolarHBondContact O-CD2 3.25Å; F166-H169 PolarHBondContact O-N 3.38Å; F166-H169 VanDerWaalsContact O-N 3.12Å; S167-H169 VanDerWaalsContact C-N 3.32Å; H169-F171 PolarHBondContact O-N 3.41Å
170Q58.4Low76.4Confident190 Ų19049.5 Ų49.589%0.88827%0.266SS*.  trans-64.6110.6-178.3-145.4179.110.500110.1V172Q170-V172 PolarHBondContact O-N 3.3Å; Q170-V172 VanDerWaalsContact O-N 3.11Å
171F60.5Low75.3Confident11 Ų1154.3 Ų54.35%0.04829%0.288CS..  trans-66.4106.3-175.6-177.1-115.4000112.2L58 D61 F62 R65 V113 F166 H169 N173L58-F171 HydrophobicContact CD2-CB 4.34Å; L58-F171 HydrophobicContact CD2-CD2 3.52Å; L58-F171 HydrophobicContact CD2-CE2 3.81Å; L58-F171 HydrophobicContact CD2-CG 4.07Å; D61-F171 HydrophobicContact CB-CD1 4.15Å; D61-F171 HydrophobicContact CB-CE1 4.32Å; F62-F171 HydrophobicContact CB-CE1 4.3Å; F62-F171 HydrophobicContact CB-CZ 4.39Å; R65-F171 PolarHBondContact NH1-O 2.94Å; R65-F171 PolarHBondContact NH2-O 2.72Å; V113-F171 HydrophobicContact CB-CE2 4.3Å; V113-F171 HydrophobicContact CB-CZ 4.35Å; V113-F171 HydrophobicContact CG1-CE2 4.2Å; V113-F171 HydrophobicContact CG1-CZ 3.85Å; V113-F171 HydrophobicContact CG2-CE2 4.32Å; F166-F171 AromaticContact CE1-CD2 3.62Å; F166-F171 HydrophobicContact CE1-CD2 3.62Å; F166-F171 AromaticContact CE1-CE2 3.77Å; F166-F171 HydrophobicContact CE1-CE2 3.77Å; F166-F171 AromaticContact CZ-CD2 3.59Å; F166-F171 HydrophobicContact CZ-CD2 3.59Å; F166-F171 AromaticContact CZ-CE2 3.95Å; F166-F171 HydrophobicContact CZ-CE2 3.95Å; H169-F171 PolarHBondContact O-N 3.41Å; F171-N173 HydrophobicContact CD1-CB 3.94Å; F171-N173 HydrophobicContact CE1-CB 3.45Å; F171-N173 VanDerWaalsContact CE1-CB 3.45Å; F171-N173 HydrophobicContact CE2-CB 4.15Å; F171-N173 WeakPolarHBondContact CE2-ND2 3.4Å; F171-N173 HydrophobicContact CZ-CB 3.63Å; F171-N173 WeakPolarHBondContact CZ-ND2 3.45Å
172V57.9Low74.1Confident124 Ų12453.5 Ų53.575%0.75228%0.282SS*.  trans-101.7108.5166.5-176.50000107.3Q170Q170-V172 PolarHBondContact O-N 3.3Å; Q170-V172 VanDerWaalsContact O-N 3.11Å
173N63.1Low73Confident21 Ų2153.4 Ų53.411%0.11228%0.28CS..  trans-110106.8-173.7-169.6-57.2000111.1G110 F171 G175 Q176G110-N173 PolarHBondContact O-ND2 3.23Å; F171-N173 HydrophobicContact CD1-CB 3.94Å; F171-N173 HydrophobicContact CE1-CB 3.45Å; F171-N173 VanDerWaalsContact CE1-CB 3.45Å; F171-N173 HydrophobicContact CE2-CB 4.15Å; F171-N173 WeakPolarHBondContact CE2-ND2 3.4Å; F171-N173 HydrophobicContact CZ-CB 3.63Å; F171-N173 WeakPolarHBondContact CZ-ND2 3.45Å; N173-G175 WeakPolarHBondContact OD1-CA 3.21Å; N173-G175 PolarHBondContact OD1-N 3.27Å; N173-Q176 PolarHBondContact OD1-N 2.94Å
174D68.6Low71.8Confident64 Ų6457.3 Ų57.334%0.34230%0.295SS..  trans-81.7-21.4168.267.6-36.7000112.5N108 R111 Q176 E177 L178N108-D174 PolarHBondContact ND2-OD1 3.08Å; R111-D174 IonicContact CZ-OD2 2.65Å; R111-D174 IonicContact NE-OD1 3.67Å; R111-D174 IonicContact NE-OD2 3.86Å; R111-D174 PolarHBondContact NE-OD2 3.2Å; R111-D174 IonicContact NH2-OD2 2.97Å; R111-D174 PolarHBondContact NH2-OD2 3.43Å; R111-D174 VanDerWaalsContact NH2-OD2 3.1Å; D174-Q176 VanDerWaalsContact C-N 3.28Å; D174-Q176 PolarHBondContact O-N 3.34Å; D174-E177 PolarHBondContact O-N 2.79Å; D174-L178 HydrophobicContact CB-CD1 4.37Å; D174-L178 WeakPolarHBondContact O-CD1 3.36Å; D174-L178 WeakPolarHBondContact O-CG 3.28Å; D174-L178 PolarHBondContact O-N 3.17Å
175G59.9Low70.5Confident0 Ų060.5 Ų60.50%031%0.312CS..Hα-helixtrans-55.9-33.8-179.600000114.6N173 L178 I179N173-G175 WeakPolarHBondContact OD1-CA 3.21Å; N173-G175 PolarHBondContact OD1-N 3.27Å; G175-L178 PolarHBondContact O-N 3.3Å; G175-I179 WeakPolarHBondContact O-CG1 3.33Å; G175-I179 PolarHBondContact O-N 3.34Å
176Q65.4Low68.8Low14 Ų1455.4 Ų55.47%0.06529%0.29CS..Hα-helixtrans-60.3-54.9177.2172.4178.8-16.700112.2F62 R65 F66 T69 N173 D174 L178 I179 W180F62-Q176 HydrophobicContact CD2-CB 4.41Å; F62-Q176 HydrophobicContact CE2-CB 3.69Å; F62-Q176 HydrophobicContact CZ-CB 4.11Å; R65-Q176 PolarHBondContact O-NE2 3.4Å; R65-Q176 VanDerWaalsContact O-NE2 3.09Å; F66-Q176 VanDerWaalsContact CA-NE2 3.29Å; F66-Q176 HydrophobicContact CD2-CG 3.94Å; T69-Q176 PolarHBondContact OG1-NE2 2.98Å; N173-Q176 PolarHBondContact OD1-N 2.94Å; D174-Q176 VanDerWaalsContact C-N 3.28Å; D174-Q176 PolarHBondContact O-N 3.34Å; Q176-L178 PolarHBondContact O-N 3.35Å; Q176-I179 PolarHBondContact O-N 2.97Å; Q176-W180 VanDerWaalsContact O-CD1 3.32Å; Q176-W180 PolarHBondContact O-N 2.87Å; Q176-W180 VanDerWaalsContact O-N 3.14Å
177E69.4Low67.1Low100 Ų10053.4 Ų53.447%0.46728%0.281SS..Hα-helixtrans-61.9-31.9179.7-75.5-62.7135.600111.3H70 D174 W180 K181H70-E177 IonicContact CE1-OE1 3.88Å; D174-E177 PolarHBondContact O-N 2.79Å; E177-W180 PolarHBondContact O-N 2.93Å; E177-K181 VanDerWaalsContact O-CB 3.29Å; E177-K181 WeakPolarHBondContact O-CB 3.47Å; E177-K181 PolarHBondContact O-N 3.49Å
178L71.1Confident65.4Low28 Ų2854.2 Ų54.215%0.14729%0.292CS..Hα-helixtrans-73.5-44.9178.4-69.1163000112.7L103 D174 G175 Q176 W180 K181 T182L103-L178 HydrophobicContact CD1-CB 4.31Å; D174-L178 HydrophobicContact CB-CD1 4.37Å; D174-L178 WeakPolarHBondContact O-CD1 3.36Å; D174-L178 WeakPolarHBondContact O-CG 3.28Å; D174-L178 PolarHBondContact O-N 3.17Å; G175-L178 PolarHBondContact O-N 3.3Å; Q176-L178 PolarHBondContact O-N 3.35Å; L178-W180 PolarHBondContact O-N 3.45Å; L178-K181 PolarHBondContact O-N 3.29Å; L178-K181 VanDerWaalsContact O-N 3.15Å; L178-T182 WeakPolarHBondContact O-CB 3.49Å; L178-T182 PolarHBondContact O-N 3.38Å; L178-T182 PolarHBondContact O-OG1 2.88Å
179I69.3Low63.8Low0 Ų053.3 Ų53.30%027%0.272CS..Hα-helixtrans-53.1-46.6171.8-74.6-177.5000108.9F62 L103 A114 F118 G175 Q176 T182 L183F62-I179 HydrophobicContact CZ-CD1 4.1Å; L103-I179 HydrophobicContact CD1-CD1 4.43Å; L103-I179 HydrophobicContact CD1-CG1 3.74Å; L103-I179 HydrophobicContact CD2-CD1 4.08Å; L103-I179 HydrophobicContact CD2-CG1 4Å; L103-I179 HydrophobicContact CG-CG1 4.38Å; A114-I179 HydrophobicContact CB-CD1 3.55Å; A114-I179 HydrophobicContact CB-CG1 4.35Å; A114-I179 WeakPolarHBondContact O-CD1 3.45Å; F118-I179 HydrophobicContact CB-CD1 4Å; F118-I179 HydrophobicContact CD2-CG2 4.31Å; G175-I179 WeakPolarHBondContact O-CG1 3.33Å; G175-I179 PolarHBondContact O-N 3.34Å; Q176-I179 PolarHBondContact O-N 2.97Å; I179-T182 PolarHBondContact O-N 2.95Å; I179-L183 HydrophobicContact CG2-CD1 3.52Å; I179-L183 HydrophobicContact CG2-CG 4.1Å; I179-L183 WeakPolarHBondContact O-CB 3.27Å; I179-L183 WeakPolarHBondContact O-CG 3.2Å; I179-L183 PolarHBondContact O-N 3.27Å
180W70.4Confident62.7Low14 Ų1451.5 Ų51.55%0.05328%0.278CS..Hα-helixtrans-67.9-39.7178.4-79.1115.6000114.4F66 H70 E71 V75 Q176 E177 L178 T182 L183 R184F66-W180 AromaticContact CD2-NE1 3.52Å; F66-W180 AromaticContact CE1-CE2 3.91Å; F66-W180 AromaticContact CE1-CZ2 3.46Å; F66-W180 HydrophobicContact CE1-CZ2 3.46Å; F66-W180 VanDerWaalsContact CE1-CZ2 3.46Å; F66-W180 AromaticContact CE1-NE1 3.79Å; F66-W180 AromaticContact CE2-CD1 3.74Å; F66-W180 AromaticContact CE2-CE2 3.54Å; F66-W180 AromaticContact CE2-CZ2 3.89Å; F66-W180 HydrophobicContact CE2-CZ2 3.89Å; F66-W180 AromaticContact CE2-NE1 2.9Å; F66-W180 HydrophobicContact CZ-CD2 4.46Å; F66-W180 AromaticContact CZ-CE2 3.22Å; F66-W180 HydrophobicContact CZ-CH2 4.16Å; F66-W180 AromaticContact CZ-CZ2 3.05Å; F66-W180 HydrophobicContact CZ-CZ2 3.05Å; F66-W180 AromaticContact CZ-NE1 3.09Å; H70-W180 HydrophobicContact CB-CD2 4.06Å; H70-W180 HydrophobicContact CB-CH2 4.16Å; H70-W180 HydrophobicContact CB-CZ2 3.21Å; H70-W180 AromaticContact CD2-CD1 3.25Å; H70-W180 AromaticContact CD2-CD2 3.42Å; H70-W180 VanDerWaalsContact CD2-CD2 3.42Å; H70-W180 AromaticContact CD2-CE2 3.45Å; H70-W180 VanDerWaalsContact CD2-CE2 3.45Å; H70-W180 AromaticContact CD2-CG 3.28Å; H70-W180 AromaticContact CD2-NE1 3.31Å; H70-W180 PolarHBondContact CD2-NE1 3.35Å; H70-W180 VanDerWaalsContact CD2-NE1 3.31Å; H70-W180 AromaticContact CE1-CD1 3.39Å; H70-W180 AromaticContact CE1-NE1 3.79Å; H70-W180 AromaticContact CG-CD1 3.34Å; H70-W180 AromaticContact CG-CD2 3.82Å; H70-W180 AromaticContact CG-CE2 3.31Å; H70-W180 AromaticContact CG-CG 3.82Å; H70-W180 AromaticContact CG-CZ2 3.92Å; H70-W180 AromaticContact CG-NE1 2.97Å; H70-W180 AromaticContact ND1-CD1 3.4Å; H70-W180 AromaticContact ND1-NE1 3.28Å; H70-W180 PolarHBondContact ND1-NE1 3.47Å; H70-W180 AromaticContact NE2-CD1 3.29Å; H70-W180 VanDerWaalsContact NE2-CD1 3.29Å; H70-W180 AromaticContact NE2-CG 3.44Å; H70-W180 AromaticContact NE2-NE1 3.82Å; E71-W180 WeakPolarHBondContact O-CH2 3.38Å; V75-W180 HydrophobicContact CG2-CH2 3.96Å; V75-W180 HydrophobicContact CG2-CZ3 3.75Å; Q176-W180 VanDerWaalsContact O-CD1 3.32Å; Q176-W180 PolarHBondContact O-N 2.87Å; Q176-W180 VanDerWaalsContact O-N 3.14Å; E177-W180 PolarHBondContact O-N 2.93Å; L178-W180 PolarHBondContact O-N 3.45Å; W180-T182 VanDerWaalsContact C-N 3.28Å; W180-T182 PolarHBondContact O-N 3.43Å; W180-L183 HydrophobicContact CD2-CD1 4.1Å; W180-L183 HydrophobicContact CE3-CB 4.06Å; W180-L183 HydrophobicContact CE3-CD1 3.65Å; W180-L183 HydrophobicContact CH2-CD1 4.18Å; W180-L183 HydrophobicContact CZ3-CB 4.34Å; W180-L183 HydrophobicContact CZ3-CD1 3.68Å; W180-L183 PolarHBondContact O-N 3.05Å; W180-R184 WeakPolarHBondContact O-CB 3.22Å; W180-R184 WeakPolarHBondContact O-CG 3.4Å; W180-R184 PolarHBondContact O-N 3.12Å; W180-R184 PolarHBondContact O-NE 2.86Å
181K73.7Confident62.2Low108 Ų10848.1 Ų48.147%0.4727%0.27SS..Hα-helixtrans-59.6-43.6173.1-170.8-176.4176.4-167.40110.6E177 L178 R184 N185E177-K181 VanDerWaalsContact O-CB 3.29Å; E177-K181 WeakPolarHBondContact O-CB 3.47Å; E177-K181 PolarHBondContact O-N 3.49Å; L178-K181 PolarHBondContact O-N 3.29Å; L178-K181 VanDerWaalsContact O-N 3.15Å; K181-R184 PolarHBondContact O-N 3.45Å; K181-N185 WeakPolarHBondContact O-CB 3.47Å; K181-N185 PolarHBondContact O-N 3.01Å; K181-N185 PolarHBondContact O-ND2 3.03Å; K181-N185 PolarHBondContact O-OD1 3.43Å
182T70.4Confident61.2Low13 Ų1350.4 Ų50.48%0.0830%0.297CS..Hα-helixtrans-68.1-45.4178-53.60000111.2V99 L178 I179 W180 R184 N185 V186V99-T182 HydrophobicContact CB-CG2 4.48Å; V99-T182 HydrophobicContact CG2-CG2 4.46Å; L178-T182 WeakPolarHBondContact O-CB 3.49Å; L178-T182 PolarHBondContact O-N 3.38Å; L178-T182 PolarHBondContact O-OG1 2.88Å; I179-T182 PolarHBondContact O-N 2.95Å; W180-T182 VanDerWaalsContact C-N 3.28Å; W180-T182 PolarHBondContact O-N 3.43Å; T182-R184 VanDerWaalsContact C-N 3.27Å; T182-R184 PolarHBondContact O-N 3.33Å; T182-N185 PolarHBondContact O-N 2.95Å; T182-V186 HydrophobicContact CG2-CG2 3.81Å; T182-V186 VanDerWaalsContact O-CB 3.29Å; T182-V186 WeakPolarHBondContact O-CB 3.49Å; T182-V186 VanDerWaalsContact O-CG2 3.32Å; T182-V186 WeakPolarHBondContact O-CG2 3.4Å; T182-V186 PolarHBondContact O-N 2.85Å
183L70Confident60Low3 Ų348.8 Ų48.82%0.01630%0.297CS..Hα-helixtrans-59.8-36.6174.6-71.3169.9000112.3V75 F95 V99 F118 I179 W180 G187V75-L183 HydrophobicContact CG1-CD2 3.88Å; V75-L183 HydrophobicContact CG2-CD1 3.99Å; V75-L183 HydrophobicContact CG2-CD2 4.17Å; V75-L183 HydrophobicContact CG2-CG 4.48Å; F95-L183 HydrophobicContact CE1-CD2 4.17Å; F95-L183 HydrophobicContact CE2-CD2 4.22Å; F95-L183 HydrophobicContact CZ-CD2 3.4Å; F95-L183 VanDerWaalsContact CZ-CD2 3.4Å; V99-L183 HydrophobicContact CG2-CD2 3.83Å; F118-L183 HydrophobicContact CE2-CD1 4.22Å; F118-L183 HydrophobicContact CE2-CD2 4.21Å; F118-L183 HydrophobicContact CZ-CD2 3.91Å; I179-L183 HydrophobicContact CG2-CD1 3.52Å; I179-L183 HydrophobicContact CG2-CG 4.1Å; I179-L183 WeakPolarHBondContact O-CB 3.27Å; I179-L183 WeakPolarHBondContact O-CG 3.2Å; I179-L183 PolarHBondContact O-N 3.27Å; W180-L183 HydrophobicContact CD2-CD1 4.1Å; W180-L183 HydrophobicContact CE3-CB 4.06Å; W180-L183 HydrophobicContact CE3-CD1 3.65Å; W180-L183 HydrophobicContact CH2-CD1 4.18Å; W180-L183 HydrophobicContact CZ3-CB 4.34Å; W180-L183 HydrophobicContact CZ3-CD1 3.68Å; W180-L183 PolarHBondContact O-N 3.05Å; L183-G187 WeakPolarHBondContact O-CA 3.19Å; L183-G187 PolarHBondContact O-N 3.23Å
184R68Low58.6Low83 Ų8355.7 Ų55.731%0.31334%0.339SS..Hα-helixtrans-69-37.5173.7-72.8-173-71.1177.5-7112.4W180 K181 T182 G188 L189 T191W180-R184 WeakPolarHBondContact O-CB 3.22Å; W180-R184 WeakPolarHBondContact O-CG 3.4Å; W180-R184 PolarHBondContact O-N 3.12Å; W180-R184 PolarHBondContact O-NE 2.86Å; K181-R184 PolarHBondContact O-N 3.45Å; T182-R184 VanDerWaalsContact C-N 3.27Å; T182-R184 PolarHBondContact O-N 3.33Å; R184-G188 CarbonylContact O-C 3.56Å; R184-G188 WeakPolarHBondContact O-CA 3.29Å; R184-G188 PolarHBondContact O-N 2.97Å; R184-L189 HydrophobicContact CG-CB 4.27Å; R184-L189 WeakPolarHBondContact CG-O 3.35Å; R184-L189 PolarHBondContact O-N 3.49Å; R184-T191 PolarHBondContact NH1-OG1 3.01Å
185N66.9Low57Low120 Ų12054.9 Ų54.964%0.64235%0.346SS*.Hα-helixtrans-75.1-46.1179.9-71.5-8.4000112.2K181 T182K181-N185 WeakPolarHBondContact O-CB 3.47Å; K181-N185 PolarHBondContact O-N 3.01Å; K181-N185 PolarHBondContact O-ND2 3.03Å; K181-N185 PolarHBondContact O-OD1 3.43Å; T182-N185 PolarHBondContact O-N 2.95Å
186V55.4Low55.8Low22 Ų2259.8 Ų59.813%0.13339%0.387CS..Hα-helixtrans-72.1-43.2178.6172.10000110F95 E98 T182 L202F95-V186 HydrophobicContact CD2-CG1 3.5Å; F95-V186 HydrophobicContact CE2-CG1 3.73Å; E98-V186 HydrophobicContact CB-CG1 4.23Å; E98-V186 HydrophobicContact CB-CG2 3.88Å; E98-V186 VanDerWaalsContact OE2-CG1 3.27Å; E98-V186 WeakPolarHBondContact OE2-CG1 3.27Å; T182-V186 HydrophobicContact CG2-CG2 3.81Å; T182-V186 VanDerWaalsContact O-CB 3.29Å; T182-V186 WeakPolarHBondContact O-CB 3.49Å; T182-V186 VanDerWaalsContact O-CG2 3.32Å; T182-V186 WeakPolarHBondContact O-CG2 3.4Å; T182-V186 PolarHBondContact O-N 2.85Å; V186-L202 HydrophobicContact CG1-CD1 4.45Å; V186-L202 HydrophobicContact CG1-CD2 3.56Å; V186-L202 WeakPolarHBondContact O-CD2 3.49Å
187G53.4Low54.5Low1 Ų166.2 Ų66.21%0.0142%0.421CS..SBendtrans-89.9-2-178.200000115.8L183 L189 G198 L199L183-G187 WeakPolarHBondContact O-CA 3.19Å; L183-G187 PolarHBondContact O-N 3.23Å; G187-L189 PolarHBondContact O-N 3.48Å; G187-G198 CarbonylContact O-C 3.5Å; G187-G198 WeakPolarHBondContact O-CA 3.42Å; G187-L199 VanDerWaalsContact CA-CD2 3.45Å; G187-L199 WeakPolarHBondContact O-CD1 3.47Å; G187-L199 WeakPolarHBondContact O-CG 3.42Å; G187-L199 PolarHBondContact O-N 3.02Å
188G51.3Low53.2Low35 Ų3562.3 Ų62.336%0.36141%0.407SS..  trans5624.8-175.200000114.2R184 A190R184-G188 CarbonylContact O-C 3.56Å; R184-G188 WeakPolarHBondContact O-CA 3.29Å; R184-G188 PolarHBondContact O-N 2.97Å; G188-A190 VanDerWaalsContact C-N 3.29Å; G188-A190 PolarHBondContact O-N 3.39Å
189L46.2Very low51.6Low47 Ų4761.9 Ų61.925%0.24641%0.405CS..  trans-76.381.7177.7-71.8164.9000108.8P74 V75 R184 G187 T191 L199P74-L189 HydrophobicContact CB-CD1 4.16Å; P74-L189 HydrophobicContact CB-CD2 4.02Å; V75-L189 HydrophobicContact CG2-CD1 4.24Å; R184-L189 HydrophobicContact CG-CB 4.27Å; R184-L189 WeakPolarHBondContact CG-O 3.35Å; R184-L189 PolarHBondContact O-N 3.49Å; G187-L189 PolarHBondContact O-N 3.48Å; L189-T191 PolarHBondContact O-N 3.39Å; L189-L199 HydrophobicContact CD1-CD1 4.35Å; L189-L199 HydrophobicContact CD2-CD1 4.49Å; L189-L199 HydrophobicContact CG-CD1 4.18Å
190A48.5Very low50.1Low83 Ų8365.5 Ų65.569%0.68644%0.435SS*.  trans-65127.3170.400000109G188 G192G188-A190 VanDerWaalsContact C-N 3.29Å; G188-A190 PolarHBondContact O-N 3.39Å; A190-G192 PolarHBondContact O-N 3.03Å
191T46.1Very low48.4Very low119 Ų11967.9 Ų67.973%0.7346%0.458SS*.SBendtrans-76.421.4-174.816.40000113R184 L189R184-T191 PolarHBondContact NH1-OG1 3.01Å; L189-T191 PolarHBondContact O-N 3.39Å
192G39.5Very low46.6Very low59 Ų5963.9 Ų63.961%0.60844%0.441SS*.SBendtrans-124.3102.2178.200000110.4A190A190-G192 PolarHBondContact O-N 3.03Å
193A32.8Very low45.1Very low91 Ų9166.7 Ų66.775%0.75246%0.458SS*.SBendtrans61.2109.9176.600000115.4G195A193-G195 PolarHBondContact O-N 3.38Å
194V35.4Very low43.6Very low165 Ų16568.4 Ų68.4100%148%0.476SS*.  trans-991.8161.3-173.40000113
195G34.1Very low42.1Very low48 Ų4870.8 Ų70.850%0.49549%0.486SS..  trans-13893.9-174.900000109.8A193 L197A193-G195 PolarHBondContact O-N 3.38Å; G195-L197 PolarHBondContact O-N 3.01Å
196A33.9Very low40.7Very low102 Ų10265.9 Ų65.984%0.84346%0.46SS*.THydrogen-bonded Turntrans-68.134.7-176.500000115.1
197L39.4Very low40Very low149 Ų14968.1 Ų68.178%0.7848%0.481SS*.THydrogen-bonded Turntrans-116.7-1.3-169.4-66.3174.9000115.2G195G195-L197 PolarHBondContact O-N 3.01Å
198G40.7Very low39.4Very low18 Ų1875 Ų7519%0.18652%0.518CS..SBendtrans-77.2-44.5-176.400000115.3G187 A201G187-G198 CarbonylContact O-C 3.5Å; G187-G198 WeakPolarHBondContact O-CA 3.42Å; G198-A201 PolarHBondContact O-N 2.91Å
199L38.4Very low38.8Very low20 Ų2080.7 Ų80.711%0.10553%0.532CS..Hα-helixtrans-85.5-21.7-170.9-78.2124.7000115.1S78 F95 G187 L189 A201 L202 V203S78-L199 VanDerWaalsContact OG-CD1 3.27Å; S78-L199 WeakPolarHBondContact OG-CD1 3.18Å; S78-L199 WeakPolarHBondContact OG-CD2 3.3Å; F95-L199 HydrophobicContact CD2-CD2 4.5Å; F95-L199 HydrophobicContact CE2-CD2 4.25Å; G187-L199 VanDerWaalsContact CA-CD2 3.45Å; G187-L199 WeakPolarHBondContact O-CD1 3.47Å; G187-L199 WeakPolarHBondContact O-CG 3.42Å; G187-L199 PolarHBondContact O-N 3.02Å; L189-L199 HydrophobicContact CD1-CD1 4.35Å; L189-L199 HydrophobicContact CD2-CD1 4.49Å; L189-L199 HydrophobicContact CG-CD1 4.18Å; L199-A201 PolarHBondContact O-N 3.44Å; L199-L202 HydrophobicContact CD2-CD2 4.44Å; L199-L202 PolarHBondContact O-N 2.79Å; L199-L202 VanDerWaalsContact O-N 3.12Å; L199-V203 PolarHBondContact O-N 3.22Å
200A37.3Very low38.2Very low76 Ų7686.8 Ų86.863%0.62856%0.563SS**Hα-helixtrans-60.6-29.4169.500000111.6G204A200-G204 PolarHBondContact O-N 3.08Å
201A35.7Very low37.7Very low64 Ų6487 Ų8753%0.52956%0.557SS.*Hα-helixtrans-73.8-34.8174.600000112.6G198 L199 Y205G198-A201 PolarHBondContact O-N 2.91Å; L199-A201 PolarHBondContact O-N 3.44Å; A201-Y205 WeakPolarHBondContact O-CB 3.27Å; A201-Y205 PolarHBondContact O-N 3.12Å
202L36.4Very low37.3Very low24 Ų2485.3 Ų85.313%0.12655%0.548CS..Hα-helixtrans-70.4-47.5175.5-17077.4000111.2F95 V186 L199 G204 Y205 I206F95-L202 HydrophobicContact CD2-CD2 4.02Å; V186-L202 HydrophobicContact CG1-CD1 4.45Å; V186-L202 HydrophobicContact CG1-CD2 3.56Å; V186-L202 WeakPolarHBondContact O-CD2 3.49Å; L199-L202 HydrophobicContact CD2-CD2 4.44Å; L199-L202 PolarHBondContact O-N 2.79Å; L199-L202 VanDerWaalsContact O-N 3.12Å; L202-G204 VanDerWaalsContact C-N 3.32Å; L202-G204 PolarHBondContact O-N 2.71Å; L202-Y205 PolarHBondContact O-N 2.95Å; L202-I206 HydrophobicContact CD2-CD1 4.42Å; L202-I206 HydrophobicContact CG-CD1 3.96Å; L202-I206 WeakPolarHBondContact O-CB 3.29Å; L202-I206 VanDerWaalsContact O-CG1 3.27Å; L202-I206 WeakPolarHBondContact O-CG1 3.29Å; L202-I206 PolarHBondContact O-N 3.26Å
203V37.2Very low37.2Very low71 Ų7186.7 Ų86.743%0.4354%0.544SS..Hα-helixtrans-62.3-40.9175.5177.10000110.7L199 A207L199-V203 PolarHBondContact O-N 3.22Å; V203-A207 VanDerWaalsContact O-CB 3.29Å; V203-A207 WeakPolarHBondContact O-CB 3.38Å; V203-A207 PolarHBondContact O-N 2.93Å
204G38.3Very low37.4Very low39 Ų3986.5 Ų86.540%0.40253%0.532SS..Hα-helixtrans-67.3-36.2174.100000114A200 L202 N208A200-G204 PolarHBondContact O-N 3.08Å; L202-G204 VanDerWaalsContact C-N 3.32Å; L202-G204 PolarHBondContact O-N 2.71Å; G204-N208 WeakPolarHBondContact O-CB 3.07Å; G204-N208 PolarHBondContact O-N 3.02Å
205Y37.6Very low37.6Very low133 Ų13381.6 Ų81.652%0.52250%0.503SS..Hα-helixtrans-68.2-40.2176.4178.2-99.1000111.7A201 L202 K209A201-Y205 WeakPolarHBondContact O-CB 3.27Å; A201-Y205 PolarHBondContact O-N 3.12Å; L202-Y205 PolarHBondContact O-N 2.95Å; Y205-K209 HydrophobicContact CE1-CD 4.31Å; Y205-K209 PolarHBondContact OH-NZ 3.2Å; Y205-K209 VanDerWaalsContact OH-NZ 3.08Å
206I38Very low37.8Very low18 Ų1883.8 Ų83.89%0.09250%0.504CS..Hα-helixtrans-69.4-44.8176.5-67.2165.8000110.7I94 L202 N208 K209 I210I94-I206 HydrophobicContact CB-CD1 4.05Å; I94-I206 HydrophobicContact CD1-CD1 4.37Å; I94-I206 HydrophobicContact CD1-CG1 4.49Å; I94-I206 HydrophobicContact CD1-CG2 3.45Å; I94-I206 VanDerWaalsContact CD1-CG2 3.45Å; I94-I206 HydrophobicContact CG2-CD1 3.47Å; I94-I206 VanDerWaalsContact CG2-CD1 3.47Å; I94-I206 HydrophobicContact CG2-CG1 4.07Å; L202-I206 HydrophobicContact CD2-CD1 4.42Å; L202-I206 HydrophobicContact CG-CD1 3.96Å; L202-I206 WeakPolarHBondContact O-CB 3.29Å; L202-I206 VanDerWaalsContact O-CG1 3.27Å; L202-I206 WeakPolarHBondContact O-CG1 3.29Å; L202-I206 PolarHBondContact O-N 3.26Å; I206-N208 PolarHBondContact O-N 3.21Å; I206-K209 PolarHBondContact O-N 3.1Å; I206-K209 VanDerWaalsContact O-N 3.1Å; I206-I210 HydrophobicContact CG2-CD1 4.28Å
207A41.1Very low38.1Very low68 Ų6882.5 Ų82.556%0.56248%0.479SS*.Hα-helixtrans-63.8-21.6178.200000113.7V203V203-A207 VanDerWaalsContact O-CB 3.29Å; V203-A207 WeakPolarHBondContact O-CB 3.38Å; V203-A207 PolarHBondContact O-N 2.93Å
208N39Very low38Very low147 Ų14777.4 Ų77.479%0.78646%0.456SS*.THydrogen-bonded Turntrans-92.21.6178.5-153.829.6000113.3G204 I206G204-N208 WeakPolarHBondContact O-CB 3.07Å; G204-N208 PolarHBondContact O-N 3.02Å; I206-N208 PolarHBondContact O-N 3.21Å
209K39.1Very low37.7Very low153 Ų15382.3 Ų82.367%0.66548%0.479SS*.  trans-116.21.1-177.3-130.9-178.4-178.9179.80113.8Y205 I206Y205-K209 HydrophobicContact CE1-CD 4.31Å; Y205-K209 PolarHBondContact OH-NZ 3.2Å; Y205-K209 VanDerWaalsContact OH-NZ 3.08Å; I206-K209 PolarHBondContact O-N 3.1Å; I206-K209 VanDerWaalsContact O-N 3.1Å
210I35Very low37.7Very low175 Ų17588 Ų8890%0.89751%0.513SS*.  trans-112.70172.6-49.3172.1000107.2T90 I206T90-I210 HydrophobicContact CG2-CD1 4.43Å; I206-I210 HydrophobicContact CG2-CD1 4.28Å

Retrieved 210 of 210 residues in 498.8 ms (Link to these results)

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