A0A077ZKI3_TRITR Loading...

Orai-1 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZKI3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 244 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
1M75.1Confident81.1Confident199 Ų199100.1 Ų100.198%0.9851%0.506SS*.  0-28.20-90.4161.363.600112H3 A4M1-H3 VanDerWaalsContact C-N 3.26Å; M1-H3 PolarHBondContact O-N 3.39Å; M1-A4 PolarHBondContact O-N 3.01Å
2D78.5Confident81.4Confident90 Ų9099.9 Ų99.948%0.48151%0.506SS..Hα-helixtrans-62.6-31.9-173.7-46.3-57.8000113.4A4 L5 S6D2-A4 PolarHBondContact O-N 3.11Å; D2-L5 PolarHBondContact O-N 2.65Å; D2-S6 PolarHBondContact O-N 3.34Å
3H75.8Confident81.6Confident94 Ų9492.9 Ų92.944%0.43547%0.472SS..Hα-helixtrans-57.6-50.7177.5-121.2-65.3000113.5M1 L5 S6 L7 H107M1-H3 VanDerWaalsContact C-N 3.26Å; M1-H3 PolarHBondContact O-N 3.39Å; H3-L5 VanDerWaalsContact C-N 3.27Å; H3-L5 PolarHBondContact O-N 2.82Å; H3-S6 PolarHBondContact O-N 3.06Å; H3-S6 PolarHBondContact O-OG 2.98Å; H3-L7 PolarHBondContact O-N 3.47Å; H3-H107 AromaticContact CD2-CE1 3.75Å; H3-H107 AromaticContact CD2-NE2 3.97Å; H3-H107 AromaticContact CE1-CE1 3.05Å; H3-H107 PolarHBondContact CE1-CE1 3.38Å; H3-H107 AromaticContact CE1-ND1 3.21Å; H3-H107 PolarHBondContact CE1-ND1 3.04Å; H3-H107 AromaticContact CE1-NE2 3.96Å; H3-H107 AromaticContact NE2-CD2 3.87Å; H3-H107 AromaticContact NE2-CE1 2.77Å; H3-H107 PolarHBondContact NE2-CE1 3.37Å; H3-H107 AromaticContact NE2-CG 3.78Å; H3-H107 AromaticContact NE2-ND1 3.07Å; H3-H107 PolarHBondContact NE2-ND1 2.88Å; H3-H107 AromaticContact NE2-NE2 3.25Å; H3-H107 PolarHBondContact NE2-NE2 3.14Å
4A84.7Confident81.8Confident70 Ų7094.1 Ų94.158%0.57947%0.468SS*.Hα-helixtrans-63.2-34.6179.800000112.1M1 D2 R8M1-A4 PolarHBondContact O-N 3.01Å; D2-A4 PolarHBondContact O-N 3.11Å; A4-R8 WeakPolarHBondContact O-CB 3.21Å; A4-R8 PolarHBondContact O-N 3.43Å; A4-R8 VanDerWaalsContact O-N 3.08Å
5L83.8Confident82.2Confident99 Ų9991.5 Ų91.552%0.51847%0.467SS..Hα-helixtrans-68.5-45.7175.8-64.7178000111.4D2 H3 L7 R8 Q9D2-L5 PolarHBondContact O-N 2.65Å; H3-L5 VanDerWaalsContact C-N 3.27Å; H3-L5 PolarHBondContact O-N 2.82Å; L5-L7 PolarHBondContact O-N 2.96Å; L5-R8 PolarHBondContact O-N 2.92Å; L5-Q9 WeakPolarHBondContact O-CG 3.37Å; L5-Q9 PolarHBondContact O-N 2.85Å
6S79.2Confident82.4Confident47 Ų4791.7 Ų91.733%0.32946%0.464SS..Hα-helixtrans-61.8-43.4178.973.60000111.9D2 H3 R8 Q9 L10D2-S6 PolarHBondContact O-N 3.34Å; H3-S6 PolarHBondContact O-N 3.06Å; H3-S6 PolarHBondContact O-OG 2.98Å; S6-R8 PolarHBondContact O-N 3.24Å; S6-Q9 PolarHBondContact O-N 2.7Å; S6-L10 WeakPolarHBondContact O-CB 3.47Å; S6-L10 PolarHBondContact O-N 3.35Å
7L80.5Confident82.5Confident79 Ų7987.1 Ų87.141%0.41444%0.441SS..Hα-helixtrans-61.6-44.8175.4-174.465.4000110.9H3 L5 Q9 L10 H11H3-L7 PolarHBondContact O-N 3.47Å; L5-L7 PolarHBondContact O-N 2.96Å; L7-Q9 PolarHBondContact O-N 2.87Å; L7-L10 WeakPolarHBondContact O-CB 3.24Å; L7-L10 PolarHBondContact O-N 2.64Å; L7-H11 PolarHBondContact O-CD2 3.3Å; L7-H11 PolarHBondContact O-N 3.23Å
8R85.8Confident82.7Confident175 Ų17590.1 Ų90.166%0.6645%0.45SS*.Hα-helixtrans-61.9-43.5176.4-174.8174.7178.5172.4-0.6112.1A4 L5 S6 L10 H11 L12A4-R8 WeakPolarHBondContact O-CB 3.21Å; A4-R8 PolarHBondContact O-N 3.43Å; A4-R8 VanDerWaalsContact O-N 3.08Å; L5-R8 PolarHBondContact O-N 2.92Å; S6-R8 PolarHBondContact O-N 3.24Å; R8-L10 VanDerWaalsContact C-N 3.31Å; R8-L10 PolarHBondContact O-N 3.3Å; R8-H11 PolarHBondContact O-N 2.95Å; R8-L12 HydrophobicContact CG-CD1 4.33Å; R8-L12 VanDerWaalsContact O-CG 3.32Å; R8-L12 WeakPolarHBondContact O-CG 3.19Å; R8-L12 PolarHBondContact O-N 2.89Å
9Q82.5Confident83Confident118 Ų11887.9 Ų87.955%0.55145%0.448SS*.Hα-helixtrans-62.3-39.1176.2-73.8178.6-12.300112L5 S6 L7 L12 S13L5-Q9 WeakPolarHBondContact O-CG 3.37Å; L5-Q9 PolarHBondContact O-N 2.85Å; S6-Q9 PolarHBondContact O-N 2.7Å; L7-Q9 PolarHBondContact O-N 2.87Å; Q9-L12 PolarHBondContact O-N 3.46Å; Q9-S13 WeakPolarHBondContact O-CB 3.41Å; Q9-S13 PolarHBondContact O-N 3.27Å; Q9-S13 PolarHBondContact O-OG 2.69Å
10L80.2Confident83.1Confident22 Ų2283.8 Ų83.812%0.11543%0.427CS..Hα-helixtrans-61.8-50.6174.5-173.489.2000110.9S6 L7 R8 L12 S13 R14 M100 L104S6-L10 WeakPolarHBondContact O-CB 3.47Å; S6-L10 PolarHBondContact O-N 3.35Å; L7-L10 WeakPolarHBondContact O-CB 3.24Å; L7-L10 PolarHBondContact O-N 2.64Å; R8-L10 VanDerWaalsContact C-N 3.31Å; R8-L10 PolarHBondContact O-N 3.3Å; L10-L12 VanDerWaalsContact C-N 3.32Å; L10-L12 PolarHBondContact O-N 2.97Å; L10-S13 PolarHBondContact O-N 3.25Å; L10-S13 VanDerWaalsContact O-N 3.14Å; L10-R14 WeakPolarHBondContact O-CG 3.42Å; L10-R14 PolarHBondContact O-N 2.85Å; L10-M100 HydrophobicContact CD1-CB 3.85Å; L10-M100 HydrophobicContact CD1-CE 3.58Å; L10-M100 HydrophobicContact CG-CE 3.98Å; L10-M100 WeakPolarHBondContact O-CE 3.46Å; L10-L104 HydrophobicContact CD2-CD2 4.33Å
11H85.9Confident83.3Confident108 Ų10882.1 Ų82.150%0.542%0.423SS..Hα-helixtrans-58.7-43.2178.4-76.3-68.3000112.2L7 R8 R14 A15L7-H11 PolarHBondContact O-CD2 3.3Å; L7-H11 PolarHBondContact O-N 3.23Å; R8-H11 PolarHBondContact O-N 2.95Å; H11-R14 PolarHBondContact O-N 3.42Å; H11-A15 WeakPolarHBondContact O-CB 3.48Å; H11-A15 PolarHBondContact O-N 3.45Å
12L85Confident83.9Confident98 Ų9878.9 Ų78.951%0.51341%0.406SS..Hα-helixtrans-63.1-41.8175.8-70.8173.5000111.8R8 Q9 L10 A15 K16R8-L12 HydrophobicContact CG-CD1 4.33Å; R8-L12 VanDerWaalsContact O-CG 3.32Å; R8-L12 WeakPolarHBondContact O-CG 3.19Å; R8-L12 PolarHBondContact O-N 2.89Å; Q9-L12 PolarHBondContact O-N 3.46Å; L10-L12 VanDerWaalsContact C-N 3.32Å; L10-L12 PolarHBondContact O-N 2.97Å; L12-A15 PolarHBondContact O-N 2.94Å; L12-K16 WeakPolarHBondContact O-CB 3.18Å; L12-K16 VanDerWaalsContact O-CG 3.32Å; L12-K16 WeakPolarHBondContact O-CG 3Å; L12-K16 PolarHBondContact O-N 3.49Å
13S83.3Confident84.4Confident9 Ų977.5 Ų77.56%0.06340%0.4CS..Hα-helixtrans-68.1-38.5178.7-580000111.5Q9 L10 A15 K16 L17 M100Q9-S13 WeakPolarHBondContact O-CB 3.41Å; Q9-S13 PolarHBondContact O-N 3.27Å; Q9-S13 PolarHBondContact O-OG 2.69Å; L10-S13 PolarHBondContact O-N 3.25Å; L10-S13 VanDerWaalsContact O-N 3.14Å; S13-A15 PolarHBondContact O-N 2.98Å; S13-K16 WeakPolarHBondContact O-CB 2.61Å; S13-K16 PolarHBondContact O-N 2.76Å; S13-L17 VanDerWaalsContact O-CG 3.32Å; S13-L17 WeakPolarHBondContact O-CG 3.37Å; S13-L17 PolarHBondContact O-N 3.43Å; S13-M100 WeakPolarHBondContact CB-SD 3.19Å
14R84.6Confident85Confident109 Ų10973 Ų7341%0.41138%0.38SS..Hα-helixtrans-65-39.4171.9-70.8-17874.9161.73.5111.9L10 H11 L17 K18 L97 M100L10-R14 WeakPolarHBondContact O-CG 3.42Å; L10-R14 PolarHBondContact O-N 2.85Å; H11-R14 PolarHBondContact O-N 3.42Å; R14-L17 PolarHBondContact O-N 3.47Å; R14-K18 WeakPolarHBondContact O-CG 3.07Å; R14-K18 PolarHBondContact O-N 3.11Å; R14-L97 HydrophobicContact CG-CD1 4.49Å; R14-M100 HydrophobicContact CG-CE 3.69Å
15A88.1Confident85.2Confident55 Ų5572.7 Ų72.746%0.45538%0.377SS..Hα-helixtrans-64.5-44.4176.200000111.5H11 L12 S13 K18 A19H11-A15 WeakPolarHBondContact O-CB 3.48Å; H11-A15 PolarHBondContact O-N 3.45Å; L12-A15 PolarHBondContact O-N 2.94Å; S13-A15 PolarHBondContact O-N 2.98Å; A15-K18 PolarHBondContact O-N 3.33Å; A15-A19 WeakPolarHBondContact O-CB 3.05Å; A15-A19 PolarHBondContact O-N 2.92Å
16K85.6Confident85.4Confident95 Ų9573.7 Ų73.741%0.41338%0.382SS..Hα-helixtrans-55.4-49.6172.1-81.8176.5-180177.10111.9L12 S13 A19 S20 E125 W128L12-K16 WeakPolarHBondContact O-CB 3.18Å; L12-K16 VanDerWaalsContact O-CG 3.32Å; L12-K16 WeakPolarHBondContact O-CG 3Å; L12-K16 PolarHBondContact O-N 3.49Å; S13-K16 WeakPolarHBondContact O-CB 2.61Å; S13-K16 PolarHBondContact O-N 2.76Å; K16-A19 PolarHBondContact O-N 3.46Å; K16-S20 PolarHBondContact O-N 2.81Å; K16-E125 IonicContact NZ-OE1 2.85Å; K16-E125 PolarHBondContact NZ-OE1 3.33Å; K16-W128 HydrophobicContact CB-CH2 3.63Å; K16-W128 HydrophobicContact CB-CZ2 4.37Å; K16-W128 HydrophobicContact CB-CZ3 4.26Å; K16-W128 HydrophobicContact CD-CZ3 4.38Å; K16-W128 HydrophobicContact CG-CH2 4.33Å; K16-W128 WeakPolarHBondContact O-CZ2 3.46Å
17L83.7Confident85.8Confident14 Ų1472.4 Ų72.47%0.07337%0.371CS..Hα-helixtrans-61.6-45.2178.1-73.5-177.9000112.3S13 R14 A19 S20 S21 M96 M100 W128S13-L17 VanDerWaalsContact O-CG 3.32Å; S13-L17 WeakPolarHBondContact O-CG 3.37Å; S13-L17 PolarHBondContact O-N 3.43Å; R14-L17 PolarHBondContact O-N 3.47Å; L17-A19 PolarHBondContact O-N 3.18Å; L17-S20 PolarHBondContact O-N 3.12Å; L17-S21 PolarHBondContact O-N 3.1Å; L17-M96 HydrophobicContact CD1-CB 4.06Å; L17-M96 HydrophobicContact CD1-CG 4.14Å; L17-M96 HydrophobicContact CD1-SD 3.92Å; L17-M96 HydrophobicContact CD2-CB 4.17Å; L17-M96 HydrophobicContact CD2-CG 4.4Å; L17-M96 HydrophobicContact CD2-SD 3.51Å; L17-M96 VanDerWaalsContact CD2-SD 3.51Å; L17-M96 HydrophobicContact CG-SD 3.87Å; L17-M100 HydrophobicContact CD1-SD 3.93Å; L17-W128 HydrophobicContact CD2-CZ2 4Å
18K86.5Confident86Confident141 Ų14170.1 Ų70.161%0.61336%0.364SS*.Hα-helixtrans-61.1-45.1175.4-76-176.9177.9-174.40111.5R14 A15 S20 S21 Q22R14-K18 WeakPolarHBondContact O-CG 3.07Å; R14-K18 PolarHBondContact O-N 3.11Å; A15-K18 PolarHBondContact O-N 3.33Å; K18-S20 VanDerWaalsContact C-N 3.34Å; K18-S20 PolarHBondContact O-N 3.24Å; K18-S21 PolarHBondContact O-N 3.17Å; K18-S21 PolarHBondContact O-OG 3.15Å; K18-Q22 PolarHBondContact O-N 3.41Å
19A87.9Confident86.1Confident49 Ų4963.5 Ų63.541%0.40535%0.35SS..Hα-helixtrans-61.3-41.6176.900000112.1A15 K16 L17 Q22 T23A15-A19 WeakPolarHBondContact O-CB 3.05Å; A15-A19 PolarHBondContact O-N 2.92Å; K16-A19 PolarHBondContact O-N 3.46Å; L17-A19 PolarHBondContact O-N 3.18Å; A19-Q22 PolarHBondContact O-N 3.19Å; A19-T23 WeakPolarHBondContact O-CB 3.33Å; A19-T23 WeakPolarHBondContact O-CG2 3.21Å; A19-T23 PolarHBondContact O-N 3.41Å; A19-T23 PolarHBondContact O-OG1 2.95Å
20S85.3Confident86.4Confident4 Ų461.7 Ų61.73%0.02834%0.341CS..Hα-helixtrans-65-40.5175.1177.20000112.2K16 L17 K18 Q22 T23 S24 W128K16-S20 PolarHBondContact O-N 2.81Å; L17-S20 PolarHBondContact O-N 3.12Å; K18-S20 VanDerWaalsContact C-N 3.34Å; K18-S20 PolarHBondContact O-N 3.24Å; S20-Q22 PolarHBondContact O-N 3.38Å; S20-T23 WeakPolarHBondContact CA-OG1 3.13Å; S20-T23 PolarHBondContact O-OG1 3.28Å; S20-T23 VanDerWaalsContact O-OG1 3.04Å; S20-S24 WeakPolarHBondContact O-CB 3.2Å; S20-S24 PolarHBondContact O-N 2.81Å; S20-S24 PolarHBondContact O-OG 3.38Å; S20-W128 PolarHBondContact OG-NE1 2.79Å
21S86.6Confident86.7Confident50 Ų5060.8 Ų60.835%0.3534%0.336SS..Hα-helixtrans-63.7-42.4176.172.10000112.6L17 K18 S24 A25L17-S21 PolarHBondContact O-N 3.1Å; K18-S21 PolarHBondContact O-N 3.17Å; K18-S21 PolarHBondContact O-OG 3.15Å; S21-S24 PolarHBondContact O-N 3.46Å; S21-A25 WeakPolarHBondContact O-CB 3.49Å; S21-A25 PolarHBondContact O-N 3.34Å
22Q89.3Confident86.7Confident131 Ų13161.9 Ų61.961%0.61234%0.343SS*.Hα-helixtrans-67-46.6179-174.7-178.31.400112K18 A19 S20 S24 A25 L26K18-Q22 PolarHBondContact O-N 3.41Å; A19-Q22 PolarHBondContact O-N 3.19Å; S20-Q22 PolarHBondContact O-N 3.38Å; Q22-S24 VanDerWaalsContact C-N 3.32Å; Q22-S24 PolarHBondContact O-N 2.8Å; Q22-A25 PolarHBondContact O-N 3.04Å; Q22-L26 PolarHBondContact O-N 2.83Å; Q22-L26 VanDerWaalsContact O-N 3.08Å
23T89.2Confident86.8Confident60 Ų6062.2 Ų62.237%0.36835%0.349SS..Hα-helixtrans-63.8-39.4176.850.40000111.4A19 S20 A25 L26 L27A19-T23 WeakPolarHBondContact O-CB 3.33Å; A19-T23 WeakPolarHBondContact O-CG2 3.21Å; A19-T23 PolarHBondContact O-N 3.41Å; A19-T23 PolarHBondContact O-OG1 2.95Å; S20-T23 WeakPolarHBondContact CA-OG1 3.13Å; S20-T23 PolarHBondContact O-OG1 3.28Å; S20-T23 VanDerWaalsContact O-OG1 3.04Å; T23-A25 PolarHBondContact O-N 3.44Å; T23-L26 PolarHBondContact O-N 2.88Å; T23-L27 WeakPolarHBondContact O-CB 3.29Å; T23-L27 VanDerWaalsContact O-CG 3.24Å; T23-L27 WeakPolarHBondContact O-CG 3.3Å; T23-L27 PolarHBondContact O-N 3.41Å
24S88Confident86.9Confident1 Ų163.7 Ų63.71%0.00735%0.353CS..Hα-helixtrans-64.9-37.2174.7-59.50000112.3S20 S21 Q22 A28S20-S24 WeakPolarHBondContact O-CB 3.2Å; S20-S24 PolarHBondContact O-N 2.81Å; S20-S24 PolarHBondContact O-OG 3.38Å; S21-S24 PolarHBondContact O-N 3.46Å; Q22-S24 VanDerWaalsContact C-N 3.32Å; Q22-S24 PolarHBondContact O-N 2.8Å; S24-A28 WeakPolarHBondContact O-CB 3.05Å; S24-A28 PolarHBondContact O-N 2.85Å
25A88.7Confident86.9Confident62 Ų6261.6 Ų61.651%0.51235%0.35SS..Hα-helixtrans-65-43.6175.300000112.3S21 Q22 T23 G29S21-A25 WeakPolarHBondContact O-CB 3.49Å; S21-A25 PolarHBondContact O-N 3.34Å; Q22-A25 PolarHBondContact O-N 3.04Å; T23-A25 PolarHBondContact O-N 3.44Å; A25-G29 PolarHBondContact O-N 2.96Å
26L88.7Confident86.8Confident121 Ų12162.5 Ų62.563%0.63435%0.35SS*.Hα-helixtrans-65.2-45.2176.5-69.2176.6000111.8Q22 T23 G29 F30Q22-L26 PolarHBondContact O-N 2.83Å; Q22-L26 VanDerWaalsContact O-N 3.08Å; T23-L26 PolarHBondContact O-N 2.88Å; L26-G29 PolarHBondContact O-N 3.22Å; L26-F30 PolarHBondContact O-N 2.81Å
27L86.6Confident86.7Confident19 Ų1964.2 Ų64.210%0.09936%0.358CS..Hα-helixtrans-68.4-38.9179.5-69.7168.4000111.4T23 F30 A31 H86 L136 F139T23-L27 WeakPolarHBondContact O-CB 3.29Å; T23-L27 VanDerWaalsContact O-CG 3.24Å; T23-L27 WeakPolarHBondContact O-CG 3.3Å; T23-L27 PolarHBondContact O-N 3.41Å; L27-F30 PolarHBondContact O-N 2.93Å; L27-A31 WeakPolarHBondContact O-CB 3.46Å; L27-A31 PolarHBondContact O-N 3.23Å; L27-H86 WeakPolarHBondContact CD1-CE1 3.31Å; L27-H86 WeakPolarHBondContact CD1-NE2 3.48Å; L27-L136 HydrophobicContact CD1-CD2 4.24Å; L27-F139 HydrophobicContact CD2-CB 4.34Å; L27-F139 HydrophobicContact CD2-CD1 4.26Å; L27-F139 HydrophobicContact CD2-CD2 3.27Å; L27-F139 HydrophobicContact CD2-CE1 4.39Å; L27-F139 HydrophobicContact CD2-CE2 3.4Å; L27-F139 HydrophobicContact CD2-CG 3.71Å; L27-F139 HydrophobicContact CD2-CZ 3.99Å
28A85.4Confident86.7Confident32 Ų3265 Ų6526%0.26436%0.361SS..Hα-helixtrans-64-39.8172.600000111.9S24 A31 M32S24-A28 WeakPolarHBondContact O-CB 3.05Å; S24-A28 PolarHBondContact O-N 2.85Å; A28-A31 PolarHBondContact O-N 3.32Å; A28-M32 WeakPolarHBondContact O-CB 3.49Å; A28-M32 PolarHBondContact O-N 2.81Å
29G87.9Confident86.5Confident36 Ų3662 Ų6237%0.37135%0.353SS..Hα-helixtrans-62.4-46.7174.700000112.1A25 L26 M32 V33A25-G29 PolarHBondContact O-N 2.96Å; L26-G29 PolarHBondContact O-N 3.22Å; G29-M32 PolarHBondContact O-N 3.43Å; G29-V33 WeakPolarHBondContact O-CG2 3.28Å; G29-V33 PolarHBondContact O-N 3.49Å; G29-V33 VanDerWaalsContact O-N 3.14Å
30F88Confident86.3Confident80 Ų8064.7 Ų64.735%0.35136%0.36SS..Hα-helixtrans-65.8-40.4176-179.5-99.3000112.6L26 L27 M32 V33 R34 F139L26-F30 PolarHBondContact O-N 2.81Å; L27-F30 PolarHBondContact O-N 2.93Å; F30-M32 VanDerWaalsContact C-N 3.34Å; F30-V33 PolarHBondContact O-N 2.81Å; F30-R34 HydrophobicContact CE1-CG 4.36Å; F30-R34 PolarHBondContact O-N 3.5Å; F30-F139 HydrophobicContact CD1-CD2 4.15Å; F30-F139 AromaticContact CD1-CE2 3.42Å; F30-F139 HydrophobicContact CD1-CE2 3.42Å; F30-F139 VanDerWaalsContact CD1-CE2 3.42Å; F30-F139 HydrophobicContact CD1-CZ 4.36Å; F30-F139 HydrophobicContact CE1-CD2 4.16Å; F30-F139 AromaticContact CE1-CE2 3.4Å; F30-F139 HydrophobicContact CE1-CE2 3.4Å; F30-F139 VanDerWaalsContact CE1-CE2 3.4Å; F30-F139 HydrophobicContact CE1-CZ 4.11Å; F30-F139 HydrophobicContact CG-CE2 4.22Å; F30-F139 HydrophobicContact CZ-CE2 4.3Å
31A85.8Confident85.8Confident2 Ų268 Ų682%0.01738%0.377CS..Hα-helixtrans-64.8-37.1175.100000111.9L27 A28 R34 L35 L82 V83L27-A31 WeakPolarHBondContact O-CB 3.46Å; L27-A31 PolarHBondContact O-N 3.23Å; A28-A31 PolarHBondContact O-N 3.32Å; A31-R34 PolarHBondContact O-N 3.37Å; A31-L35 WeakPolarHBondContact O-CB 3.1Å; A31-L35 PolarHBondContact O-N 2.99Å; A31-L82 HydrophobicContact CB-CD2 3.46Å; A31-L82 VanDerWaalsContact CB-CD2 3.46Å; A31-V83 HydrophobicContact CB-CG2 3.68Å
32M86.3Confident85.3Confident132 Ų13270 Ų7065%0.6538%0.38SS*.Hα-helixtrans-64.6-43.8176.4-177.5-176.8-74.900111.4A28 G29 F30 R34 L35 T36A28-M32 WeakPolarHBondContact O-CB 3.49Å; A28-M32 PolarHBondContact O-N 2.81Å; G29-M32 PolarHBondContact O-N 3.43Å; F30-M32 VanDerWaalsContact C-N 3.34Å; M32-R34 VanDerWaalsContact C-N 3.34Å; M32-L35 PolarHBondContact O-N 3.12Å; M32-T36 WeakPolarHBondContact O-CB 3.14Å; M32-T36 PolarHBondContact O-N 3.3Å; M32-T36 PolarHBondContact O-OG1 2.91Å
33V87.9Confident84.8Confident104 Ų10470.9 Ų70.963%0.6338%0.383SS*.Hα-helixtrans-62.4-44174.4174.60000110.5G29 F30 T36 F37G29-V33 WeakPolarHBondContact O-CG2 3.28Å; G29-V33 PolarHBondContact O-N 3.49Å; G29-V33 VanDerWaalsContact O-N 3.14Å; F30-V33 PolarHBondContact O-N 2.81Å; V33-T36 PolarHBondContact O-N 3.19Å; V33-F37 PolarHBondContact O-N 3.39Å
34R84.6Confident84.1Confident40 Ų4070.9 Ų70.915%0.15139%0.385CS..Hα-helixtrans-64.7-46.4176.9-89.6-166.9170.2156.71113.1F30 A31 M32 T36 F37 F38F30-R34 HydrophobicContact CE1-CG 4.36Å; F30-R34 PolarHBondContact O-N 3.5Å; A31-R34 PolarHBondContact O-N 3.37Å; M32-R34 VanDerWaalsContact C-N 3.34Å; R34-T36 VanDerWaalsContact C-N 3.29Å; R34-T36 PolarHBondContact O-N 3.45Å; R34-F37 PolarHBondContact O-N 2.68Å; R34-F38 WeakPolarHBondContact O-CB 3.45Å; R34-F38 PolarHBondContact O-N 3.4Å
35L84.2Confident83.3Confident66 Ų6673.9 Ų73.935%0.34640%0.401SS..Hα-helixtrans-61.3-41.7177.6-174.8153.4000109.9A31 M32 F38 V39 T79 V83A31-L35 WeakPolarHBondContact O-CB 3.1Å; A31-L35 PolarHBondContact O-N 2.99Å; M32-L35 PolarHBondContact O-N 3.12Å; L35-F38 PolarHBondContact O-N 2.89Å; L35-V39 HydrophobicContact CD2-CG2 3.72Å; L35-V39 HydrophobicContact CG-CG2 4.3Å; L35-V39 VanDerWaalsContact O-CB 3.31Å; L35-V39 WeakPolarHBondContact O-CB 3.37Å; L35-V39 WeakPolarHBondContact O-CG2 3.27Å; L35-V39 PolarHBondContact O-N 2.87Å; L35-T79 HydrophobicContact CB-CG2 4.08Å; L35-V83 HydrophobicContact CD1-CG2 4.44Å
36T86.8Confident82.5Confident73 Ų7375.8 Ų75.845%0.44840%0.398SS..Hα-helixtrans-60.3-48.8175.3-57.30000110.9M32 V33 R34 F38 V39 I40M32-T36 WeakPolarHBondContact O-CB 3.14Å; M32-T36 PolarHBondContact O-N 3.3Å; M32-T36 PolarHBondContact O-OG1 2.91Å; V33-T36 PolarHBondContact O-N 3.19Å; R34-T36 VanDerWaalsContact C-N 3.29Å; R34-T36 PolarHBondContact O-N 3.45Å; T36-F38 PolarHBondContact O-N 3.43Å; T36-V39 PolarHBondContact O-N 3.44Å; T36-I40 HydrophobicContact CG2-CD1 3.93Å; T36-I40 WeakPolarHBondContact O-CD1 3.26Å; T36-I40 VanDerWaalsContact O-CG1 3.22Å; T36-I40 WeakPolarHBondContact O-CG1 3.48Å; T36-I40 PolarHBondContact O-N 2.85Å
37F84.1Confident81.6Confident132 Ų13272.5 Ų72.558%0.57939%0.388SS*.Hα-helixtrans-63.3-41177.2-175.5-103000112.4V33 R34 I40 L41V33-F37 PolarHBondContact O-N 3.39Å; R34-F37 PolarHBondContact O-N 2.68Å; F37-I40 PolarHBondContact O-N 2.93Å; F37-L41 HydrophobicContact CD1-CD1 3.83Å; F37-L41 HydrophobicContact CD1-CG 4.32Å; F37-L41 HydrophobicContact CE1-CD1 3.2Å; F37-L41 HydrophobicContact CE1-CG 3.93Å; F37-L41 HydrophobicContact CE2-CD1 4.49Å; F37-L41 HydrophobicContact CE2-CG 4.46Å; F37-L41 HydrophobicContact CZ-CD1 3.59Å; F37-L41 HydrophobicContact CZ-CD2 4.46Å; F37-L41 HydrophobicContact CZ-CG 3.99Å; F37-L41 WeakPolarHBondContact O-CB 3.35Å; F37-L41 PolarHBondContact O-N 3.47Å
38F82.3Confident80.7Confident31 Ų3177.3 Ų77.314%0.13641%0.414CS..Hα-helixtrans-63.1-46.4175.6178.5-111.9000111.6R34 L35 T36 I40 L41 H42 F75 G76R34-F38 WeakPolarHBondContact O-CB 3.45Å; R34-F38 PolarHBondContact O-N 3.4Å; L35-F38 PolarHBondContact O-N 2.89Å; T36-F38 PolarHBondContact O-N 3.43Å; F38-I40 VanDerWaalsContact C-N 3.33Å; F38-I40 PolarHBondContact O-N 3.15Å; F38-L41 CarbonylContact O-C 3.6Å; F38-L41 PolarHBondContact O-N 3.4Å; F38-H42 HydrophobicContact CE1-CB 4.38Å; F38-H42 HydrophobicContact CE2-CB 4.47Å; F38-H42 HydrophobicContact CZ-CB 4.31Å; F38-H42 AromaticContact CZ-CD2 3.93Å; F38-H42 WeakPolarHBondContact O-CA 3.3Å; F38-H42 WeakPolarHBondContact O-CB 3.32Å; F38-H42 PolarHBondContact O-N 3.47Å; F38-F75 HydrophobicContact CB-CE1 3.91Å; F38-F75 AromaticContact CD2-CD1 3.33Å; F38-F75 HydrophobicContact CD2-CD1 3.33Å; F38-F75 AromaticContact CD2-CE1 3.44Å; F38-F75 HydrophobicContact CD2-CE1 3.44Å; F38-F75 VanDerWaalsContact CD2-CE1 3.44Å; F38-F75 AromaticContact CE2-CD1 3.62Å; F38-F75 HydrophobicContact CE2-CD1 3.62Å; F38-F75 HydrophobicContact CE2-CE1 4.21Å; F38-F75 HydrophobicContact CG-CD1 4.05Å; F38-F75 AromaticContact CG-CE1 3.86Å; F38-F75 HydrophobicContact CG-CE1 3.86Å; F38-G76 VanDerWaalsContact CZ-CA 3.49Å
39V82.7Confident79.6Confident76 Ų7680.2 Ų80.246%0.46143%0.428SS..Hα-helixtrans-62.8-41.4178.21680000110.4L35 T36 H42 F43L35-V39 HydrophobicContact CD2-CG2 3.72Å; L35-V39 HydrophobicContact CG-CG2 4.3Å; L35-V39 VanDerWaalsContact O-CB 3.31Å; L35-V39 WeakPolarHBondContact O-CB 3.37Å; L35-V39 WeakPolarHBondContact O-CG2 3.27Å; L35-V39 PolarHBondContact O-N 2.87Å; T36-V39 PolarHBondContact O-N 3.44Å; V39-H42 PolarHBondContact O-N 2.89Å; V39-F43 VanDerWaalsContact O-CB 3.22Å; V39-F43 WeakPolarHBondContact O-CB 3.45Å; V39-F43 PolarHBondContact O-N 3.15Å
40I83.8Confident78.7Confident107 Ų10784.2 Ų84.255%0.54944%0.435SS..Hα-helixtrans-62.8-48.7175-67.8165.3000110.8T36 F37 F38 F43 S44T36-I40 HydrophobicContact CG2-CD1 3.93Å; T36-I40 WeakPolarHBondContact O-CD1 3.26Å; T36-I40 VanDerWaalsContact O-CG1 3.22Å; T36-I40 WeakPolarHBondContact O-CG1 3.48Å; T36-I40 PolarHBondContact O-N 2.85Å; F37-I40 PolarHBondContact O-N 2.93Å; F38-I40 VanDerWaalsContact C-N 3.33Å; F38-I40 PolarHBondContact O-N 3.15Å; I40-F43 PolarHBondContact O-N 2.93Å; I40-S44 WeakPolarHBondContact O-CB 3.38Å; I40-S44 PolarHBondContact O-N 2.82Å
41L75.8Confident77.4Confident74 Ų7482.5 Ų82.539%0.38744%0.441SS..Hα-helixtrans-64.9-40.2177.4-81-173.7000112.4F37 F38 S44 N45F37-L41 HydrophobicContact CD1-CD1 3.83Å; F37-L41 HydrophobicContact CD1-CG 4.32Å; F37-L41 HydrophobicContact CE1-CD1 3.2Å; F37-L41 HydrophobicContact CE1-CG 3.93Å; F37-L41 HydrophobicContact CE2-CD1 4.49Å; F37-L41 HydrophobicContact CE2-CG 4.46Å; F37-L41 HydrophobicContact CZ-CD1 3.59Å; F37-L41 HydrophobicContact CZ-CD2 4.46Å; F37-L41 HydrophobicContact CZ-CG 3.99Å; F37-L41 WeakPolarHBondContact O-CB 3.35Å; F37-L41 PolarHBondContact O-N 3.47Å; F38-L41 CarbonylContact O-C 3.6Å; F38-L41 PolarHBondContact O-N 3.4Å; L41-S44 PolarHBondContact O-N 2.89Å; L41-N45 VanDerWaalsContact O-CB 3.29Å; L41-N45 WeakPolarHBondContact O-CB 3.25Å; L41-N45 VanDerWaalsContact O-CG 3.23Å; L41-N45 PolarHBondContact O-N 3.21Å; L41-N45 PolarHBondContact O-ND2 3.18Å; L41-N45 VanDerWaalsContact O-ND2 3.12Å
42H76.2Confident76.3Confident90 Ų9087.3 Ų87.342%0.41746%0.458SS..Hα-helixtrans-68-42.7179.7-174.7-87.4000110.4F38 V39 N45 F46F38-H42 HydrophobicContact CE1-CB 4.38Å; F38-H42 HydrophobicContact CE2-CB 4.47Å; F38-H42 HydrophobicContact CZ-CB 4.31Å; F38-H42 AromaticContact CZ-CD2 3.93Å; F38-H42 WeakPolarHBondContact O-CA 3.3Å; F38-H42 WeakPolarHBondContact O-CB 3.32Å; F38-H42 PolarHBondContact O-N 3.47Å; V39-H42 PolarHBondContact O-N 2.89Å; H42-N45 PolarHBondContact O-N 2.97Å; H42-F46 WeakPolarHBondContact O-CA 3.4Å; H42-F46 WeakPolarHBondContact O-CB 3.23Å; H42-F46 PolarHBondContact O-N 2.94Å
43F77.3Confident75Confident151 Ų15184.6 Ų84.666%0.66245%0.453SS*.Hα-helixtrans-62-43.7173.8-172.9-97000111.3V39 I40 F46 A47V39-F43 VanDerWaalsContact O-CB 3.22Å; V39-F43 WeakPolarHBondContact O-CB 3.45Å; V39-F43 PolarHBondContact O-N 3.15Å; I40-F43 PolarHBondContact O-N 2.93Å; F43-F46 PolarHBondContact O-N 3.4Å; F43-A47 WeakPolarHBondContact O-CB 3.22Å; F43-A47 PolarHBondContact O-N 3.34Å
44S74.9Confident73.8Confident60 Ų6087.4 Ų87.442%0.4246%0.459SS..Hα-helixtrans-62-49.8175.1-173.20000112I40 L41 F46 A47 L48I40-S44 WeakPolarHBondContact O-CB 3.38Å; I40-S44 PolarHBondContact O-N 2.82Å; L41-S44 PolarHBondContact O-N 2.89Å; S44-F46 PolarHBondContact O-N 3.33Å; S44-A47 PolarHBondContact O-N 2.91Å; S44-L48 WeakPolarHBondContact O-CB 3.08Å; S44-L48 VanDerWaalsContact O-CG 3.3Å; S44-L48 WeakPolarHBondContact O-CG 3.45Å; S44-L48 PolarHBondContact O-N 2.79Å
45N71.3Confident72.4Confident64 Ų6492.2 Ų92.234%0.34249%0.487SS..Hα-helixtrans-64-39.6178.2-74.7-34.6000112.3L41 H42 L48 T49L41-N45 VanDerWaalsContact O-CB 3.29Å; L41-N45 WeakPolarHBondContact O-CB 3.25Å; L41-N45 VanDerWaalsContact O-CG 3.23Å; L41-N45 PolarHBondContact O-N 3.21Å; L41-N45 PolarHBondContact O-ND2 3.18Å; L41-N45 VanDerWaalsContact O-ND2 3.12Å; H42-N45 PolarHBondContact O-N 2.97Å; N45-L48 PolarHBondContact O-N 3.4Å; N45-T49 WeakPolarHBondContact O-CB 3.42Å; N45-T49 PolarHBondContact O-N 3.36Å; N45-T49 PolarHBondContact O-OG1 2.9Å
46F71.5Confident70.9Confident102 Ų10293.2 Ų93.245%0.44749%0.492SS..Hα-helixtrans-68.4-44.6177.7-177.2-99.7000111.3H42 F43 S44 L48 T49 F50H42-F46 WeakPolarHBondContact O-CA 3.4Å; H42-F46 WeakPolarHBondContact O-CB 3.23Å; H42-F46 PolarHBondContact O-N 2.94Å; F43-F46 PolarHBondContact O-N 3.4Å; S44-F46 PolarHBondContact O-N 3.33Å; F46-L48 VanDerWaalsContact C-N 3.33Å; F46-L48 PolarHBondContact O-N 2.84Å; F46-T49 PolarHBondContact O-N 3.33Å; F46-T49 VanDerWaalsContact O-N 3.11Å; F46-F50 HydrophobicContact CD1-CD2 4.33Å; F46-F50 HydrophobicContact CD2-CD2 4.37Å; F46-F50 AromaticContact CE1-CD2 3.66Å; F46-F50 HydrophobicContact CE1-CD2 3.66Å; F46-F50 AromaticContact CE1-CE2 3.98Å; F46-F50 HydrophobicContact CE1-CE2 3.98Å; F46-F50 AromaticContact CE2-CD2 3.71Å; F46-F50 HydrophobicContact CE2-CD2 3.71Å; F46-F50 AromaticContact CE2-CE2 3.74Å; F46-F50 HydrophobicContact CE2-CE2 3.74Å; F46-F50 AromaticContact CZ-CD2 3.31Å; F46-F50 HydrophobicContact CZ-CD2 3.31Å; F46-F50 AromaticContact CZ-CE2 3.26Å; F46-F50 HydrophobicContact CZ-CE2 3.26Å; F46-F50 HydrophobicContact CZ-CZ 4.41Å; F46-F50 PolarHBondContact O-N 3.33Å
47A69.6Low69.2Low52 Ų5297.9 Ų97.943%0.4351%0.514SS..Hα-helixtrans-61-40.9174.300000111.8F43 S44 G51F43-A47 WeakPolarHBondContact O-CB 3.22Å; F43-A47 PolarHBondContact O-N 3.34Å; S44-A47 PolarHBondContact O-N 2.91Å; A47-G51 PolarHBondContact O-N 2.83Å
48L67.7Low67.5Low120 Ų12098.1 Ų98.163%0.62852%0.521SS*.Hα-helixtrans-65.2-37.8172.4-70.9177.8000112.3S44 N45 F46 R52S44-L48 WeakPolarHBondContact O-CB 3.08Å; S44-L48 VanDerWaalsContact O-CG 3.3Å; S44-L48 WeakPolarHBondContact O-CG 3.45Å; S44-L48 PolarHBondContact O-N 2.79Å; N45-L48 PolarHBondContact O-N 3.4Å; F46-L48 VanDerWaalsContact C-N 3.33Å; F46-L48 PolarHBondContact O-N 2.84Å; L48-R52 WeakPolarHBondContact O-CB 3.42Å; L48-R52 PolarHBondContact O-N 3.38Å
49T62.7Low66Low92 Ų92100.5 Ų100.556%0.56454%0.541SS*.Hα-helixtrans-69.7-45.5179.7-56.90000111.7N45 F46 R52 S53N45-T49 WeakPolarHBondContact O-CB 3.42Å; N45-T49 PolarHBondContact O-N 3.36Å; N45-T49 PolarHBondContact O-OG1 2.9Å; F46-T49 PolarHBondContact O-N 3.33Å; F46-T49 VanDerWaalsContact O-N 3.11Å; T49-R52 PolarHBondContact O-N 3.44Å; T49-S53 PolarHBondContact O-N 3.08Å
50F68.4Low64.4Low120 Ų120101.7 Ų101.753%0.52655%0.553SS.*Hα-helixtrans-66.8-37174.2-112.6-87.2000112.1F46 R52 S53F46-F50 HydrophobicContact CD1-CD2 4.33Å; F46-F50 HydrophobicContact CD2-CD2 4.37Å; F46-F50 AromaticContact CE1-CD2 3.66Å; F46-F50 HydrophobicContact CE1-CD2 3.66Å; F46-F50 AromaticContact CE1-CE2 3.98Å; F46-F50 HydrophobicContact CE1-CE2 3.98Å; F46-F50 AromaticContact CE2-CD2 3.71Å; F46-F50 HydrophobicContact CE2-CD2 3.71Å; F46-F50 AromaticContact CE2-CE2 3.74Å; F46-F50 HydrophobicContact CE2-CE2 3.74Å; F46-F50 AromaticContact CZ-CD2 3.31Å; F46-F50 HydrophobicContact CZ-CD2 3.31Å; F46-F50 AromaticContact CZ-CE2 3.26Å; F46-F50 HydrophobicContact CZ-CE2 3.26Å; F46-F50 HydrophobicContact CZ-CZ 4.41Å; F46-F50 PolarHBondContact O-N 3.33Å; F50-R52 VanDerWaalsContact C-N 3.27Å; F50-R52 PolarHBondContact O-N 2.9Å; F50-S53 PolarHBondContact O-OG 3.39Å
51G62.6Low62.8Low45 Ų45101.7 Ų101.746%0.46456%0.563SS.*Hα-helixtrans-66.5-28.6173.400000113.1A47A47-G51 PolarHBondContact O-N 2.83Å
52R60.7Low61.4Low102 Ų102101.5 Ų101.539%0.38557%0.566SS.*Hα-helixtrans-83.1-32.9178.5-160.6171-157.3-82.4-18112.7L48 T49 F50 E54 L55 D56L48-R52 WeakPolarHBondContact O-CB 3.42Å; L48-R52 PolarHBondContact O-N 3.38Å; T49-R52 PolarHBondContact O-N 3.44Å; F50-R52 VanDerWaalsContact C-N 3.27Å; F50-R52 PolarHBondContact O-N 2.9Å; R52-E54 VanDerWaalsContact C-N 3.25Å; R52-E54 PolarHBondContact O-N 2.91Å; R52-L55 PolarHBondContact O-N 3.49Å; R52-L55 VanDerWaalsContact O-N 3.14Å; R52-D56 IonicContact CZ-OD2 3.39Å; R52-D56 IonicContact NE-OD2 2.81Å; R52-D56 IonicContact NH1-OD2 3.04Å; R52-D56 PolarHBondContact NH1-OD2 3.33Å; R52-D56 IonicContact NH2-OD1 2.65Å; R52-D56 IonicContact NH2-OD2 3.72Å; R52-D56 PolarHBondContact NH2-OD2 3.43Å; R52-D56 PolarHBondContact O-N 3.09Å; R52-D56 VanDerWaalsContact O-N 3.11Å
53S59.9Low60Low76 Ų76102 Ų10253%0.53158%0.58SS.*Hα-helixtrans-63.3-30.1178.358.30000113.4T49 F50T49-S53 PolarHBondContact O-N 3.08Å; F50-S53 PolarHBondContact O-OG 3.39Å
54E62.1Low58.5Low162 Ų162104.2 Ų104.276%0.75758%0.584SS**THydrogen-bonded Turntrans-79-15.7177.2-62.3-64.4130.200113.3R52R52-E54 VanDerWaalsContact C-N 3.25Å; R52-E54 PolarHBondContact O-N 2.91Å
55L55.1Low57.2Low141 Ų141107.5 Ų107.574%0.73859%0.592SS**THydrogen-bonded Turntrans-117.5-14.7-170.2-132.6148000114.9R52 L57R52-L55 PolarHBondContact O-N 3.49Å; R52-L55 VanDerWaalsContact O-N 3.14Å; L55-L57 VanDerWaalsContact C-N 3.27Å; L55-L57 PolarHBondContact O-N 2.96Å
56D52.8Low56.2Low87 Ų87109.5 Ų109.547%0.46561%0.609SS.*  trans-8667.4175.8-78.6-6.6000111.5R52R52-D56 IonicContact CZ-OD2 3.39Å; R52-D56 IonicContact NE-OD2 2.81Å; R52-D56 IonicContact NH1-OD2 3.04Å; R52-D56 PolarHBondContact NH1-OD2 3.33Å; R52-D56 IonicContact NH2-OD1 2.65Å; R52-D56 IonicContact NH2-OD2 3.72Å; R52-D56 PolarHBondContact NH2-OD2 3.43Å; R52-D56 PolarHBondContact O-N 3.09Å; R52-D56 VanDerWaalsContact O-N 3.11Å
57L51.6Low55.4Low172 Ų172110.7 Ų110.790%0.90162%0.618SS**  trans-10433.5161.1-111.9172.2000110.5L55L55-L57 VanDerWaalsContact C-N 3.27Å; L55-L57 PolarHBondContact O-N 2.96Å
58D49Very low55.3Low136 Ų136111.4 Ų111.473%0.72762%0.618SS**SBendtrans-160.8136.5163.3-157.510.8000113.9
59S50.9Low55.6Low81 Ų81110 Ų11057%0.56661%0.614SS**  trans60107.3151.976.90000119.6
60S48.4Very low56.3Low102 Ų102109 Ų10971%0.71361%0.609SS**SBend46.7103.4128.661.50000118.3
61S49.8Very low56.8Low107 Ų107105 Ų10575%0.74859%0.594SS**  trans81.955.7149.9-30.10000117.8S63S61-S63 PolarHBondContact O-N 2.75Å
62P47.6Very low57.5Low70 Ų70105.3 Ų105.346%0.45559%0.585SS.*  trans-76.594.7159.631.2-28.1000108.4W64P62-W64 PolarHBondContact O-N 3.47Å
63S46.4Very low58.6Low101 Ų101105.1 Ų105.171%0.70659%0.591SS**  trans-7253.2170.463.90000111.5S61S61-S63 PolarHBondContact O-N 2.75Å
64W45.6Very low59.7Low196 Ų196105.3 Ų105.374%0.74259%0.588SS**  trans-85.2109.4156.5-63.996.9000105.2P62 P66P62-W64 PolarHBondContact O-N 3.47Å; W64-P66 WeakPolarHBondContact O-CD 3.33Å
65H46.9Very low60.8Low130 Ų13098.9 Ų98.960%0.60256%0.558SS**  trans-52.6114.2-175.3-26.3-60.5000108.7I67 T68H65-I67 PolarHBondContact O-N 3.04Å; H65-T68 PolarHBondContact O-N 2.75Å
66P50.6Low62.2Low105 Ų10592.5 Ų92.568%0.68253%0.526SS*.THydrogen-bonded Turntrans-62.1-11179.322.5-32.1000112.8W64 T68 V69 P70W64-P66 WeakPolarHBondContact O-CD 3.33Å; P66-T68 VanDerWaalsContact C-N 3.26Å; P66-T68 PolarHBondContact O-N 3.37Å; P66-V69 PolarHBondContact O-N 3.32Å; P66-P70 WeakPolarHBondContact O-CD 3.4Å
67I54.7Low63.9Low127 Ų12792.9 Ų92.965%0.65153%0.528SS*.THydrogen-bonded Turntrans-63.6-23.2-177.6-60.7170.1000113.2H65 P70H65-I67 PolarHBondContact O-N 3.04Å; I67-P70 VanDerWaalsContact O-CD 3.24Å; I67-P70 WeakPolarHBondContact O-CD 3.11Å; I67-P70 WeakPolarHBondContact O-CG 3.42Å
68T68.8Low65.6Low68 Ų6885 Ų8542%0.41749%0.486SS..Hα-helixtrans-80.5-26.5-176.6-38.70000112.9H65 P66 V71 L72H65-T68 PolarHBondContact O-N 2.75Å; P66-T68 VanDerWaalsContact C-N 3.26Å; P66-T68 PolarHBondContact O-N 3.37Å; T68-V71 PolarHBondContact O-N 3.47Å; T68-L72 HydrophobicContact CG2-CD1 3.62Å; T68-L72 WeakPolarHBondContact O-CD1 3.26Å; T68-L72 PolarHBondContact O-N 3.15Å; T68-L72 VanDerWaalsContact O-N 3.12Å
69V73.7Confident67.5Low91 Ų9178.5 Ų78.555%0.55245%0.452SS*.Hα-helixtrans-56.3-50.3178.4-177.80000113P66 V71 L72 I73P66-V69 PolarHBondContact O-N 3.32Å; V69-V71 VanDerWaalsContact C-N 3.29Å; V69-V71 PolarHBondContact O-N 3.02Å; V69-L72 PolarHBondContact O-N 2.86Å; V69-I73 HydrophobicContact CG1-CD1 4.02Å; V69-I73 WeakPolarHBondContact O-CG1 3.44Å; V69-I73 PolarHBondContact O-N 3.44Å; V69-I73 VanDerWaalsContact O-N 3.1Å
70P77.4Confident69.3Low70 Ų7079.2 Ų79.246%0.45545%0.453SS..Hα-helixtrans-62.3-35.5179.223.9-35.3000112.6P66 I67 L72 I73 V74P66-P70 WeakPolarHBondContact O-CD 3.4Å; I67-P70 VanDerWaalsContact O-CD 3.24Å; I67-P70 WeakPolarHBondContact O-CD 3.11Å; I67-P70 WeakPolarHBondContact O-CG 3.42Å; P70-L72 VanDerWaalsContact C-N 3.34Å; P70-L72 PolarHBondContact O-N 3.26Å; P70-I73 PolarHBondContact O-N 2.76Å; P70-V74 WeakPolarHBondContact O-CB 3.21Å; P70-V74 VanDerWaalsContact O-CG2 3.28Å; P70-V74 WeakPolarHBondContact O-CG2 3.21Å; P70-V74 PolarHBondContact O-N 3.23Å
71V78.7Confident71.3Confident37 Ų3778.7 Ų78.722%0.22444%0.441CS..Hα-helixtrans-65-38.9177.4-179.70000111.1T68 V69 F75 I145 I149T68-V71 PolarHBondContact O-N 3.47Å; V69-V71 VanDerWaalsContact C-N 3.29Å; V69-V71 PolarHBondContact O-N 3.02Å; V71-F75 WeakPolarHBondContact O-CB 3.25Å; V71-F75 PolarHBondContact O-N 2.86Å; V71-I145 HydrophobicContact CG1-CG2 3.88Å; V71-I149 HydrophobicContact CG1-CG2 4.18Å
72L77.3Confident73.3Confident51 Ų5173.7 Ų73.727%0.26741%0.406SS..Hα-helixtrans-65.5-40.1175.1-89.879.8000112.3T68 V69 P70 F75 G76T68-L72 HydrophobicContact CG2-CD1 3.62Å; T68-L72 WeakPolarHBondContact O-CD1 3.26Å; T68-L72 PolarHBondContact O-N 3.15Å; T68-L72 VanDerWaalsContact O-N 3.12Å; V69-L72 PolarHBondContact O-N 2.86Å; P70-L72 VanDerWaalsContact C-N 3.34Å; P70-L72 PolarHBondContact O-N 3.26Å; L72-F75 PolarHBondContact O-N 3.37Å; L72-G76 PolarHBondContact O-N 3.18Å
73I82.3Confident75.3Confident98 Ų9872.2 Ų72.250%0.50340%0.396SS..Hα-helixtrans-64.8-48.5177.2-64.8168.7000109.9V69 P70 F75 G76 I77V69-I73 HydrophobicContact CG1-CD1 4.02Å; V69-I73 WeakPolarHBondContact O-CG1 3.44Å; V69-I73 PolarHBondContact O-N 3.44Å; V69-I73 VanDerWaalsContact O-N 3.1Å; P70-I73 PolarHBondContact O-N 2.76Å; I73-F75 VanDerWaalsContact C-N 3.28Å; I73-F75 PolarHBondContact O-N 3.39Å; I73-G76 PolarHBondContact O-N 2.84Å; I73-I77 HydrophobicContact CG2-CD1 3.8Å; I73-I77 HydrophobicContact CG2-CG1 4.45Å; I73-I77 WeakPolarHBondContact O-CG1 3.21Å; I73-I77 PolarHBondContact O-N 2.97Å
74V84Confident77.4Confident79 Ų7969.1 Ų69.148%0.47938%0.38SS..Hα-helixtrans-59.6-41.8177.1171.50000110.8P70 I77 C78 I145P70-V74 WeakPolarHBondContact O-CB 3.21Å; P70-V74 VanDerWaalsContact O-CG2 3.28Å; P70-V74 WeakPolarHBondContact O-CG2 3.21Å; P70-V74 PolarHBondContact O-N 3.23Å; V74-I77 PolarHBondContact O-N 3.41Å; V74-C78 WeakPolarHBondContact O-CB 3.38Å; V74-C78 PolarHBondContact O-N 2.68Å; V74-I145 HydrophobicContact CG1-CD1 4.3Å
75F84.6Confident79.5Confident27 Ų2760.9 Ų60.912%0.11835%0.351CS..Hα-helixtrans-59.9-49.4174.7-178-107.9000111.5F38 V71 L72 I73 I77 C78 T79 E142 I145 V146F38-F75 HydrophobicContact CB-CE1 3.91Å; F38-F75 AromaticContact CD2-CD1 3.33Å; F38-F75 HydrophobicContact CD2-CD1 3.33Å; F38-F75 AromaticContact CD2-CE1 3.44Å; F38-F75 HydrophobicContact CD2-CE1 3.44Å; F38-F75 VanDerWaalsContact CD2-CE1 3.44Å; F38-F75 AromaticContact CE2-CD1 3.62Å; F38-F75 HydrophobicContact CE2-CD1 3.62Å; F38-F75 HydrophobicContact CE2-CE1 4.21Å; F38-F75 HydrophobicContact CG-CD1 4.05Å; F38-F75 AromaticContact CG-CE1 3.86Å; F38-F75 HydrophobicContact CG-CE1 3.86Å; V71-F75 WeakPolarHBondContact O-CB 3.25Å; V71-F75 PolarHBondContact O-N 2.86Å; L72-F75 PolarHBondContact O-N 3.37Å; I73-F75 VanDerWaalsContact C-N 3.28Å; I73-F75 PolarHBondContact O-N 3.39Å; F75-I77 PolarHBondContact O-N 3.32Å; F75-C78 WeakPolarHBondContact O-CB 3.19Å; F75-C78 PolarHBondContact O-N 3.03Å; F75-C78 VanDerWaalsContact O-N 3.15Å; F75-T79 PolarHBondContact O-N 2.87Å; F75-T79 PolarHBondContact O-OG1 2.97Å; F75-E142 HydrophobicContact CE2-CG 3.98Å; F75-E142 WeakPolarHBondContact CE2-OE1 3.21Å; F75-E142 WeakPolarHBondContact CZ-OE1 3.45Å; F75-I145 HydrophobicContact CB-CG2 4.11Å; F75-I145 HydrophobicContact CD2-CB 4.12Å; F75-I145 HydrophobicContact CD2-CD1 4.3Å; F75-I145 HydrophobicContact CD2-CG2 3.74Å; F75-I145 HydrophobicContact CG-CG2 4.27Å; F75-V146 HydrophobicContact CE2-CG2 4.1Å
76G84.6Confident81.6Confident8 Ų854.8 Ų54.88%0.08232%0.323CS..Hα-helixtrans-61.2-40.2178.100000113.7F38 L72 I73 T80F38-G76 VanDerWaalsContact CZ-CA 3.49Å; L72-G76 PolarHBondContact O-N 3.18Å; I73-G76 PolarHBondContact O-N 2.84Å; G76-T80 WeakPolarHBondContact O-CB 3.34Å; G76-T80 PolarHBondContact O-N 3.4Å; G76-T80 PolarHBondContact O-OG1 3.43Å
77I87.8Confident83.4Confident95 Ų9554.7 Ų54.749%0.48732%0.316SS..Hα-helixtrans-64.7-45.8174-65167.6000110.1I73 V74 F75 T80 L81I73-I77 HydrophobicContact CG2-CD1 3.8Å; I73-I77 HydrophobicContact CG2-CG1 4.45Å; I73-I77 WeakPolarHBondContact O-CG1 3.21Å; I73-I77 PolarHBondContact O-N 2.97Å; V74-I77 PolarHBondContact O-N 3.41Å; F75-I77 PolarHBondContact O-N 3.32Å; I77-T80 PolarHBondContact O-N 3.44Å; I77-L81 HydrophobicContact CG2-CD1 3.83Å; I77-L81 HydrophobicContact CG2-CG 4.25Å; I77-L81 WeakPolarHBondContact O-CB 3.09Å; I77-L81 WeakPolarHBondContact O-CG 3.23Å; I77-L81 PolarHBondContact O-N 2.94Å
78C89.1Confident85.1Confident5 Ų552 Ų523%0.03430%0.303CS..Hα-helixtrans-59.8-48.1178.4-178.60000111.8V74 F75 T80 L81 L82 L141 E142 I145V74-C78 WeakPolarHBondContact O-CB 3.38Å; V74-C78 PolarHBondContact O-N 2.68Å; F75-C78 WeakPolarHBondContact O-CB 3.19Å; F75-C78 PolarHBondContact O-N 3.03Å; F75-C78 VanDerWaalsContact O-N 3.15Å; C78-T80 VanDerWaalsContact C-N 3.32Å; C78-T80 PolarHBondContact O-N 3.48Å; C78-L81 PolarHBondContact O-N 3.31Å; C78-L82 VanDerWaalsContact O-CB 3.27Å; C78-L82 WeakPolarHBondContact O-CB 3.42Å; C78-L82 PolarHBondContact O-N 3.43Å; C78-L141 HydrophobicContact CB-CD2 4.49Å; C78-E142 PolarHBondContact SG-OE2 3.23Å; C78-I145 HydrophobicContact CB-CD1 4.35Å
79T88.2Confident86.1Confident1 Ų148.8 Ų48.81%0.00628%0.283CS..Hα-helixtrans-59.8-43.6176-47.10000111.2L35 F75 L82 V83 E142L35-T79 HydrophobicContact CB-CG2 4.08Å; F75-T79 PolarHBondContact O-N 2.87Å; F75-T79 PolarHBondContact O-OG1 2.97Å; T79-L82 PolarHBondContact O-N 2.86Å; T79-V83 WeakPolarHBondContact O-CG2 3.27Å; T79-V83 PolarHBondContact O-N 3.12Å; T79-E142 PolarHBondContact N-OE2 3.11Å; T79-E142 PolarHBondContact OG1-OE1 3.08Å; T79-E142 PolarHBondContact OG1-OE2 3.29Å
80T89.4Confident86.7Confident95 Ų9547 Ų4758%0.58327%0.27SS*.Hα-helixtrans-64.7-44.4179.8-570000111.3G76 I77 C78 L82 V83 G84G76-T80 WeakPolarHBondContact O-CB 3.34Å; G76-T80 PolarHBondContact O-N 3.4Å; G76-T80 PolarHBondContact O-OG1 3.43Å; I77-T80 PolarHBondContact O-N 3.44Å; C78-T80 VanDerWaalsContact C-N 3.32Å; C78-T80 PolarHBondContact O-N 3.48Å; T80-L82 VanDerWaalsContact C-N 3.35Å; T80-V83 PolarHBondContact O-N 3.44Å; T80-G84 PolarHBondContact O-N 2.92Å
81L90.1Very high87.4Confident91 Ų9149.1 Ų49.148%0.47628%0.276SS..Hα-helixtrans-64.7-39.4175.4-72.1174.5000111.5I77 C78 G84 V85 L138I77-L81 HydrophobicContact CG2-CD1 3.83Å; I77-L81 HydrophobicContact CG2-CG 4.25Å; I77-L81 WeakPolarHBondContact O-CB 3.09Å; I77-L81 WeakPolarHBondContact O-CG 3.23Å; I77-L81 PolarHBondContact O-N 2.94Å; C78-L81 PolarHBondContact O-N 3.31Å; L81-G84 PolarHBondContact O-N 2.94Å; L81-V85 WeakPolarHBondContact O-CB 3.21Å; L81-V85 WeakPolarHBondContact O-CG2 3.46Å; L81-V85 PolarHBondContact O-N 3.45Å; L81-L138 HydrophobicContact CB-CD1 3.64Å; L81-L138 HydrophobicContact CB-CD2 4.47Å
82L90.3Very high87.9Confident2 Ų248.5 Ų48.51%0.0127%0.271CS..Hα-helixtrans-59.9-50.5178-176.1156.7000110.3A31 C78 T79 T80 G84 V85 H86 L138 F139 E142A31-L82 HydrophobicContact CB-CD2 3.46Å; A31-L82 VanDerWaalsContact CB-CD2 3.46Å; C78-L82 VanDerWaalsContact O-CB 3.27Å; C78-L82 WeakPolarHBondContact O-CB 3.42Å; C78-L82 PolarHBondContact O-N 3.43Å; T79-L82 PolarHBondContact O-N 2.86Å; T80-L82 VanDerWaalsContact C-N 3.35Å; L82-G84 PolarHBondContact O-N 3.22Å; L82-V85 PolarHBondContact O-N 3.32Å; L82-H86 PolarHBondContact O-CD2 3.07Å; L82-H86 PolarHBondContact O-N 3.42Å; L82-H86 VanDerWaalsContact O-N 3.17Å; L82-L138 HydrophobicContact CB-CB 4.03Å; L82-L138 HydrophobicContact CD1-CB 4.34Å; L82-L138 HydrophobicContact CG-CB 4.33Å; L82-F139 HydrophobicContact CD1-CB 4.03Å; L82-F139 HydrophobicContact CD1-CD2 4.33Å; L82-E142 HydrophobicContact CD1-CB 4.24Å
83V90.2Very high88.3Confident40 Ų4046.6 Ų46.624%0.24226%0.262CS..Hα-helixtrans-59.9-47.8175.9175.60000110.3A31 L35 T79 T80 V85 H86 L87A31-V83 HydrophobicContact CB-CG2 3.68Å; L35-V83 HydrophobicContact CD1-CG2 4.44Å; T79-V83 WeakPolarHBondContact O-CG2 3.27Å; T79-V83 PolarHBondContact O-N 3.12Å; T80-V83 PolarHBondContact O-N 3.44Å; V83-V85 PolarHBondContact O-N 2.89Å; V83-H86 PolarHBondContact O-N 3.36Å; V83-L87 HydrophobicContact CG1-CD1 4.04Å; V83-L87 HydrophobicContact CG1-CG 4.44Å; V83-L87 WeakPolarHBondContact O-CG 3.32Å; V83-L87 PolarHBondContact O-N 3.46Å
84G90.9Very high88.5Confident36 Ų3647 Ų4737%0.37127%0.269SS..Hα-helixtrans-59.1-45.1-179.700000113.5T80 L81 L82 H86 L87 L88T80-G84 PolarHBondContact O-N 2.92Å; L81-G84 PolarHBondContact O-N 2.94Å; L82-G84 PolarHBondContact O-N 3.22Å; G84-H86 PolarHBondContact O-N 3.25Å; G84-L87 PolarHBondContact O-N 2.81Å; G84-L88 WeakPolarHBondContact O-CB 3.38Å; G84-L88 PolarHBondContact O-N 2.81Å
85V90.8Very high88.5Confident22 Ų2247.1 Ų47.113%0.13327%0.272CS..Hα-helixtrans-66.7-37-179.21700000111.8L81 L82 V83 L88 A89 S131 L134 L138L81-V85 WeakPolarHBondContact O-CB 3.21Å; L81-V85 WeakPolarHBondContact O-CG2 3.46Å; L81-V85 PolarHBondContact O-N 3.45Å; L82-V85 PolarHBondContact O-N 3.32Å; V83-V85 PolarHBondContact O-N 2.89Å; V85-L88 PolarHBondContact O-N 3.29Å; V85-A89 PolarHBondContact O-N 3.44Å; V85-S131 WeakPolarHBondContact CG1-O 3.42Å; V85-L134 HydrophobicContact CG1-CB 4.09Å; V85-L138 HydrophobicContact CG2-CD1 4.06Å
86H89.2Confident88.5Confident3 Ų346.1 Ų46.11%0.01427%0.268CS..Hα-helixtrans-68.8-39.8174.2-75.5-55.2000113L27 L82 V83 G84 L88 A89 L90L27-H86 WeakPolarHBondContact CD1-CE1 3.31Å; L27-H86 WeakPolarHBondContact CD1-NE2 3.48Å; L82-H86 PolarHBondContact O-CD2 3.07Å; L82-H86 PolarHBondContact O-N 3.42Å; L82-H86 VanDerWaalsContact O-N 3.17Å; V83-H86 PolarHBondContact O-N 3.36Å; G84-H86 PolarHBondContact O-N 3.25Å; H86-L88 VanDerWaalsContact C-N 3.26Å; H86-L88 PolarHBondContact O-N 2.97Å; H86-A89 PolarHBondContact O-N 2.9Å; H86-L90 WeakPolarHBondContact O-CG 3.2Å; H86-L90 PolarHBondContact O-N 2.72Å
87L90.2Very high88.4Confident102 Ų10249 Ų4953%0.53428%0.281SS..Hα-helixtrans-63-37172.9-67.2177.4000111.3V83 G84 L90 M91V83-L87 HydrophobicContact CG1-CD1 4.04Å; V83-L87 HydrophobicContact CG1-CG 4.44Å; V83-L87 WeakPolarHBondContact O-CG 3.32Å; V83-L87 PolarHBondContact O-N 3.46Å; G84-L87 PolarHBondContact O-N 2.81Å; L87-L90 HydrophobicContact CD2-CD1 4.44Å; L87-L90 WeakPolarHBondContact O-CB 3.22Å; L87-L90 PolarHBondContact O-N 3.49Å; L87-M91 WeakPolarHBondContact O-CB 3.39Å; L87-M91 PolarHBondContact O-N 3.41Å
88L90.3Very high87.7Confident71 Ų7148.3 Ų48.337%0.37228%0.283SS..Hα-helixtrans-66.8-40.2175.4-173.3153000111.6G84 V85 H86 L90 M91 I92 S131G84-L88 WeakPolarHBondContact O-CB 3.38Å; G84-L88 PolarHBondContact O-N 2.81Å; V85-L88 PolarHBondContact O-N 3.29Å; H86-L88 VanDerWaalsContact C-N 3.26Å; H86-L88 PolarHBondContact O-N 2.97Å; L88-L90 VanDerWaalsContact C-N 3.31Å; L88-L90 PolarHBondContact O-N 2.8Å; L88-M91 HydrophobicContact CG-CE 4.43Å; L88-M91 PolarHBondContact O-N 3.06Å; L88-I92 HydrophobicContact CD2-CD1 3.37Å; L88-I92 HydrophobicContact CD2-CG1 4.24Å; L88-I92 HydrophobicContact CG-CD1 4.3Å; L88-I92 VanDerWaalsContact O-CG1 3.32Å; L88-I92 WeakPolarHBondContact O-CG1 3.32Å; L88-I92 PolarHBondContact O-N 3.3Å; L88-S131 VanDerWaalsContact CD2-CB 3.5Å; L88-S131 WeakPolarHBondContact CD2-OG 3.43Å
89A88.3Confident87.2Confident0 Ų049.6 Ų49.60%029%0.287CS..Hα-helixtrans-60.9-39.217300000112.3V85 H86 S93V85-A89 PolarHBondContact O-N 3.44Å; H86-A89 PolarHBondContact O-N 2.9Å; A89-S93 WeakPolarHBondContact O-CB 3.13Å; A89-S93 PolarHBondContact O-N 3.48Å; A89-S93 PolarHBondContact O-OG 3.41Å
90L88Confident86.4Confident54 Ų5449.9 Ų49.928%0.28329%0.288SS..Hα-helixtrans-67.1-42.2174.3-71.7173.9000112.7H86 L87 L88 S93 T94H86-L90 WeakPolarHBondContact O-CG 3.2Å; H86-L90 PolarHBondContact O-N 2.72Å; L87-L90 HydrophobicContact CD2-CD1 4.44Å; L87-L90 WeakPolarHBondContact O-CB 3.22Å; L87-L90 PolarHBondContact O-N 3.49Å; L88-L90 VanDerWaalsContact C-N 3.31Å; L88-L90 PolarHBondContact O-N 2.8Å; L90-S93 WeakPolarHBondContact O-CB 3.45Å; L90-S93 PolarHBondContact O-N 2.73Å; L90-T94 PolarHBondContact O-N 3.31Å; L90-T94 PolarHBondContact O-OG1 2.82Å
91M91.4Very high85.9Confident115 Ų11548.5 Ų48.557%0.56728%0.278SS*.Hα-helixtrans-60.2-49.9176.7-175.2-179.269.500110.2L87 L88 S93 T94 C95L87-M91 WeakPolarHBondContact O-CB 3.39Å; L87-M91 PolarHBondContact O-N 3.41Å; L88-M91 HydrophobicContact CG-CE 4.43Å; L88-M91 PolarHBondContact O-N 3.06Å; M91-S93 VanDerWaalsContact C-N 3.29Å; M91-S93 PolarHBondContact O-N 2.81Å; M91-T94 PolarHBondContact O-N 3.28Å; M91-C95 PolarHBondContact O-N 3.33Å; M91-C95 VanDerWaalsContact O-N 3.07Å; M91-C95 PolarHBondContact O-SG 2.93Å
92I88.3Confident85Confident24 Ų2446.7 Ų46.712%0.12327%0.273CS..Hα-helixtrans-64-37.3178.3-59.5165.9000111L88 T94 C95 M96 I124 W128L88-I92 HydrophobicContact CD2-CD1 3.37Å; L88-I92 HydrophobicContact CD2-CG1 4.24Å; L88-I92 HydrophobicContact CG-CD1 4.3Å; L88-I92 VanDerWaalsContact O-CG1 3.32Å; L88-I92 WeakPolarHBondContact O-CG1 3.32Å; L88-I92 PolarHBondContact O-N 3.3Å; I92-T94 PolarHBondContact O-N 3.02Å; I92-C95 PolarHBondContact O-N 3.32Å; I92-M96 WeakPolarHBondContact O-CB 3.33Å; I92-M96 PolarHBondContact O-N 2.93Å; I92-I124 HydrophobicContact CG2-CG2 4.13Å; I92-W128 HydrophobicContact CB-CB 4.36Å; I92-W128 HydrophobicContact CG2-CB 3.6Å; I92-W128 HydrophobicContact CG2-CG 4.12Å
93S87.4Confident83.9Confident11 Ų1150.1 Ų50.18%0.07729%0.293CS..Hα-helixtrans-61.3-44.3176.9-62.10000112.5A89 L90 M91 C95 M96 L97 W128A89-S93 WeakPolarHBondContact O-CB 3.13Å; A89-S93 PolarHBondContact O-N 3.48Å; A89-S93 PolarHBondContact O-OG 3.41Å; L90-S93 WeakPolarHBondContact O-CB 3.45Å; L90-S93 PolarHBondContact O-N 2.73Å; M91-S93 VanDerWaalsContact C-N 3.29Å; M91-S93 PolarHBondContact O-N 2.81Å; S93-C95 VanDerWaalsContact C-N 3.3Å; S93-C95 PolarHBondContact O-N 3Å; S93-M96 PolarHBondContact O-N 3.44Å; S93-L97 PolarHBondContact O-N 3.32Å; S93-W128 PolarHBondContact OG-NE1 3.07Å
94T86.4Confident82.8Confident106 Ų10651.9 Ų51.965%0.6530%0.301SS*.Hα-helixtrans-63.4-39177.4-55.20000111.2L90 M91 I92 P98L90-T94 PolarHBondContact O-N 3.31Å; L90-T94 PolarHBondContact O-OG1 2.82Å; M91-T94 PolarHBondContact O-N 3.28Å; I92-T94 PolarHBondContact O-N 3.02Å; T94-P98 VanDerWaalsContact O-CD 3.31Å; T94-P98 WeakPolarHBondContact O-CD 3.38Å
95C83.7Confident81.7Confident81 Ų8157 Ų5755%0.54732%0.32SS..Hα-helixtrans-77.9-22.7178.6-60.10000113.7M91 I92 S93 P98M91-C95 PolarHBondContact O-N 3.33Å; M91-C95 VanDerWaalsContact O-N 3.07Å; M91-C95 PolarHBondContact O-SG 2.93Å; I92-C95 PolarHBondContact O-N 3.32Å; S93-C95 VanDerWaalsContact C-N 3.3Å; S93-C95 PolarHBondContact O-N 3Å; C95-P98 WeakPolarHBondContact O-CD 3.29Å; C95-P98 WeakPolarHBondContact O-CG 3.5Å
96M83.1Confident80.4Confident7 Ų759.7 Ų59.73%0.03434%0.338CS..Hα-helixtrans-75-30.5179.7-172-173.5-174.100112.5L17 I92 S93 Y99 M100 E125L17-M96 HydrophobicContact CD1-CB 4.06Å; L17-M96 HydrophobicContact CD1-CG 4.14Å; L17-M96 HydrophobicContact CD1-SD 3.92Å; L17-M96 HydrophobicContact CD2-CB 4.17Å; L17-M96 HydrophobicContact CD2-CG 4.4Å; L17-M96 HydrophobicContact CD2-SD 3.51Å; L17-M96 VanDerWaalsContact CD2-SD 3.51Å; L17-M96 HydrophobicContact CG-SD 3.87Å; I92-M96 WeakPolarHBondContact O-CB 3.33Å; I92-M96 PolarHBondContact O-N 2.93Å; S93-M96 PolarHBondContact O-N 3.44Å; M96-Y99 WeakPolarHBondContact O-CB 3.47Å; M96-Y99 PolarHBondContact O-N 3.37Å; M96-M100 HydrophobicContact CE-CG 4.47Å; M96-M100 HydrophobicContact CE-SD 3.97Å; M96-M100 HydrophobicContact CG-CG 4.25Å; M96-M100 HydrophobicContact CG-SD 4.05Å; M96-M100 WeakPolarHBondContact O-CG 3.31Å; M96-M100 PolarHBondContact O-N 3.5Å; M96-M100 HydrophobicContact SD-SD 4.22Å; M96-E125 HydrophobicContact CE-CB 4.23Å; M96-E125 HydrophobicContact CE-CG 4.03Å
97L82.6Confident78.9Confident68 Ų6865 Ų6536%0.35636%0.363SS..Hα-helixtrans-60-53.2-177.6-169.864.7000114.3R14 S93 Y99 M100 D101R14-L97 HydrophobicContact CG-CD1 4.49Å; S93-L97 PolarHBondContact O-N 3.32Å; L97-Y99 PolarHBondContact O-N 3.23Å; L97-M100 WeakPolarHBondContact O-CB 3.49Å; L97-M100 PolarHBondContact O-N 2.93Å; L97-D101 PolarHBondContact O-N 3.5Å; L97-D101 VanDerWaalsContact O-N 3.08Å
98P74.9Confident77.3Confident81 Ų8166.5 Ų66.553%0.52637%0.372SS..Hα-helixtrans-62.9-32.1-179.825.2-35.7000112.5T94 C95 D101 S102T94-P98 VanDerWaalsContact O-CD 3.31Å; T94-P98 WeakPolarHBondContact O-CD 3.38Å; C95-P98 WeakPolarHBondContact O-CD 3.29Å; C95-P98 WeakPolarHBondContact O-CG 3.5Å; P98-D101 PolarHBondContact O-N 3.22Å; P98-S102 PolarHBondContact O-N 2.9Å
99Y76.6Confident75.5Confident32 Ų3271.9 Ų71.913%0.12539%0.388CS..Hα-helixtrans-67.7-36.6176.2-177.1-86.8000112.3M96 L97 S102 V103 H117 M120 K121M96-Y99 WeakPolarHBondContact O-CB 3.47Å; M96-Y99 PolarHBondContact O-N 3.37Å; L97-Y99 PolarHBondContact O-N 3.23Å; Y99-S102 PolarHBondContact O-OG 2.94Å; Y99-V103 WeakPolarHBondContact O-CG2 3.38Å; Y99-H117 AromaticContact CD2-CE1 3.93Å; Y99-H117 AromaticContact CE2-CE1 3.03Å; Y99-H117 WeakPolarHBondContact CE2-CE1 3.47Å; Y99-H117 AromaticContact CE2-ND1 3.86Å; Y99-H117 AromaticContact CE2-NE2 3.21Å; Y99-H117 WeakPolarHBondContact CE2-NE2 3.06Å; Y99-H117 AromaticContact CZ-CE1 3.18Å; Y99-H117 AromaticContact CZ-ND1 3.59Å; Y99-H117 AromaticContact CZ-NE2 3.79Å; Y99-H117 PolarHBondContact OH-CE1 2.74Å; Y99-H117 PolarHBondContact OH-ND1 3.26Å; Y99-H117 PolarHBondContact OH-O 3.43Å; Y99-M120 HydrophobicContact CE2-CE 4.01Å; Y99-K121 HydrophobicContact CD1-CG 4.37Å; Y99-K121 HydrophobicContact CE1-CB 3.67Å; Y99-K121 HydrophobicContact CE1-CD 3.82Å; Y99-K121 HydrophobicContact CE1-CG 3.5Å; Y99-K121 VanDerWaalsContact OH-CB 3.29Å; Y99-K121 WeakPolarHBondContact OH-CB 3.38Å
100M71.8Confident74Confident6 Ų680.4 Ų80.43%0.0343%0.428CS..Hα-helixtrans-69.3-38.2174.7-76.1177.549.100112.3L10 S13 R14 L17 M96 L97L10-M100 HydrophobicContact CD1-CB 3.85Å; L10-M100 HydrophobicContact CD1-CE 3.58Å; L10-M100 HydrophobicContact CG-CE 3.98Å; L10-M100 WeakPolarHBondContact O-CE 3.46Å; S13-M100 WeakPolarHBondContact CB-SD 3.19Å; R14-M100 HydrophobicContact CG-CE 3.69Å; L17-M100 HydrophobicContact CD1-SD 3.93Å; M96-M100 HydrophobicContact CE-CG 4.47Å; M96-M100 HydrophobicContact CE-SD 3.97Å; M96-M100 HydrophobicContact CG-CG 4.25Å; M96-M100 HydrophobicContact CG-SD 4.05Å; M96-M100 WeakPolarHBondContact O-CG 3.31Å; M96-M100 PolarHBondContact O-N 3.5Å; M96-M100 HydrophobicContact SD-SD 4.22Å; L97-M100 WeakPolarHBondContact O-CB 3.49Å; L97-M100 PolarHBondContact O-N 2.93Å
101D78.7Confident72.4Confident67 Ų6783.9 Ų83.936%0.35845%0.451SS..Hα-helixtrans-74.3-32.2-179.1-66.3-28.6000112.2L97 P98 V103 L104 N105L97-D101 PolarHBondContact O-N 3.5Å; L97-D101 VanDerWaalsContact O-N 3.08Å; P98-D101 PolarHBondContact O-N 3.22Å; D101-V103 VanDerWaalsContact C-N 3.33Å; D101-V103 PolarHBondContact O-N 3.49Å; D101-L104 WeakPolarHBondContact O-CB 3.4Å; D101-L104 PolarHBondContact O-N 2.96Å; D101-L104 VanDerWaalsContact O-N 3.16Å; D101-N105 PolarHBondContact O-N 2.87Å; D101-N105 VanDerWaalsContact O-N 3.17Å
102S71.2Confident70.4Confident53 Ų5382.5 Ų82.537%0.37145%0.445SS..Hα-helixtrans-65.2-35.2176.267.40000113P98 Y99 L104 N105 C106P98-S102 PolarHBondContact O-N 2.9Å; Y99-S102 PolarHBondContact O-OG 2.94Å; S102-L104 VanDerWaalsContact C-N 3.27Å; S102-L104 PolarHBondContact O-N 3.44Å; S102-N105 PolarHBondContact O-N 3.41Å; S102-C106 PolarHBondContact O-N 3.45Å; S102-C106 VanDerWaalsContact O-N 3.09Å
103V68.8Low68.6Low73 Ų7386.5 Ų86.544%0.44248%0.476SS..Hα-helixtrans-64.1-32.9174.2175.80000111.5Y99 D101Y99-V103 WeakPolarHBondContact O-CG2 3.38Å; D101-V103 VanDerWaalsContact C-N 3.33Å; D101-V103 PolarHBondContact O-N 3.49Å
104L65.9Low66.9Low77 Ų7794.8 Ų94.840%0.40351%0.513SS..Hα-helixtrans-72.2-36.4176.1-176.464.5000112L10 D101 S102L10-L104 HydrophobicContact CD2-CD2 4.33Å; D101-L104 WeakPolarHBondContact O-CB 3.4Å; D101-L104 PolarHBondContact O-N 2.96Å; D101-L104 VanDerWaalsContact O-N 3.16Å; S102-L104 VanDerWaalsContact C-N 3.27Å; S102-L104 PolarHBondContact O-N 3.44Å
105N67.4Low65.5Low145 Ų14592 Ų9278%0.77550%0.498SS*.Hα-helixtrans-75-27.3-179.2-161.446.7000112.8D101 S102 H107D101-N105 PolarHBondContact O-N 2.87Å; D101-N105 VanDerWaalsContact O-N 3.17Å; S102-N105 PolarHBondContact O-N 3.41Å; N105-H107 PolarHBondContact O-N 2.97Å
106C63.7Low64Low77 Ų7792.7 Ų92.752%0.5250%0.501SS..  trans-7662.6167.3-71.50000111.1S102 N108 I112S102-C106 PolarHBondContact O-N 3.45Å; S102-C106 VanDerWaalsContact O-N 3.09Å; C106-N108 PolarHBondContact O-N 2.79Å; C106-I112 HydrophobicContact CB-CD1 4.17Å
107H59Low62.9Low115 Ų11595.9 Ų95.953%0.53252%0.516SS..  trans-74.3-5.7-178.5-163.4106.2000114.1H3 N105 Y109H3-H107 AromaticContact CD2-CE1 3.75Å; H3-H107 AromaticContact CD2-NE2 3.97Å; H3-H107 AromaticContact CE1-CE1 3.05Å; H3-H107 PolarHBondContact CE1-CE1 3.38Å; H3-H107 AromaticContact CE1-ND1 3.21Å; H3-H107 PolarHBondContact CE1-ND1 3.04Å; H3-H107 AromaticContact CE1-NE2 3.96Å; H3-H107 AromaticContact NE2-CD2 3.87Å; H3-H107 AromaticContact NE2-CE1 2.77Å; H3-H107 PolarHBondContact NE2-CE1 3.37Å; H3-H107 AromaticContact NE2-CG 3.78Å; H3-H107 AromaticContact NE2-ND1 3.07Å; H3-H107 PolarHBondContact NE2-ND1 2.88Å; H3-H107 AromaticContact NE2-NE2 3.25Å; H3-H107 PolarHBondContact NE2-NE2 3.14Å; N105-H107 PolarHBondContact O-N 2.97Å; H107-Y109 PolarHBondContact O-N 3.46Å; H107-Y109 VanDerWaalsContact O-N 3.12Å
108N55.8Low61.7Low134 Ų13498 Ų9872%0.71753%0.532SS*.  trans-86.380.5174.1-78.321.1000110.3C106 E110C106-N108 PolarHBondContact O-N 2.79Å; N108-E110 PolarHBondContact O-N 3.34Å
109Y53.5Low61.1Low183 Ų183100.6 Ų100.672%0.71853%0.531SS*.THydrogen-bonded Turntrans-55.4-15.5179.9177.5-104.8000115.1H107H107-Y109 PolarHBondContact O-N 3.46Å; H107-Y109 VanDerWaalsContact O-N 3.12Å
110E55.4Low60.7Low179 Ų179104 Ų10484%0.83655%0.549SS*.THydrogen-bonded Turntrans-88.3-12.1-165.7-152.1157.2176.700115.6N108N108-E110 PolarHBondContact O-N 3.34Å
111V54.2Low60.7Low127 Ų127106.4 Ų106.477%0.7756%0.559SS**SBendtrans-124.2-6.5-174.7-171.80000114.5
112I50.7Low60.4Low86 Ų86110.3 Ų110.344%0.44157%0.569SS.*  trans-106.56.6-170.6-62.6168000113.2C106 E114 S115C106-I112 HydrophobicContact CB-CD1 4.17Å; I112-E114 PolarHBondContact O-N 3.41Å; I112-E114 VanDerWaalsContact O-N 3.14Å; I112-S115 WeakPolarHBondContact CG2-OG 3.49Å; I112-S115 PolarHBondContact O-N 2.76Å; I112-S115 PolarHBondContact O-OG 2.83Å; I112-S115 VanDerWaalsContact O-OG 3.07Å
113S50.2Low60.7Low109 Ų109113.8 Ų113.876%0.76258%0.575SS**THydrogen-bonded Turntrans-65.3-11.3177.4530000114.6
114E51.5Low61.4Low184 Ų184112.9 Ų112.986%0.8657%0.568SS**THydrogen-bonded Turntrans-95.70.9175.7-62-148.9160.900114.6I112I112-E114 PolarHBondContact O-N 3.41Å; I112-E114 VanDerWaalsContact O-N 3.14Å
115S57.4Low62.1Low49 Ų49111.1 Ų111.134%0.34356%0.557SS.*  trans-82.8129.6-171.667.80000113I112 H117I112-S115 WeakPolarHBondContact CG2-OG 3.49Å; I112-S115 PolarHBondContact O-N 2.76Å; I112-S115 PolarHBondContact O-OG 2.83Å; I112-S115 VanDerWaalsContact O-OG 3.07Å; S115-H117 PolarHBondContact O-N 2.76Å
116P52.3Low62.7Low94 Ų94104.9 Ų104.961%0.6152%0.524SS*.THydrogen-bonded Turntrans-648.3177.926.1-35.1000114.7V118 R119P116-V118 PolarHBondContact O-N 3.27Å; P116-R119 PolarHBondContact O-N 3.47Å
117H58.6Low63.7Low75 Ų75102.9 Ų102.935%0.34751%0.512SS..Hα-helixtrans-66.2-32.9-176.2-160.2-108.2000112.9Y99 S115 R119 M120 K121Y99-H117 AromaticContact CD2-CE1 3.93Å; Y99-H117 AromaticContact CE2-CE1 3.03Å; Y99-H117 WeakPolarHBondContact CE2-CE1 3.47Å; Y99-H117 AromaticContact CE2-ND1 3.86Å; Y99-H117 AromaticContact CE2-NE2 3.21Å; Y99-H117 WeakPolarHBondContact CE2-NE2 3.06Å; Y99-H117 AromaticContact CZ-CE1 3.18Å; Y99-H117 AromaticContact CZ-ND1 3.59Å; Y99-H117 AromaticContact CZ-NE2 3.79Å; Y99-H117 PolarHBondContact OH-CE1 2.74Å; Y99-H117 PolarHBondContact OH-ND1 3.26Å; Y99-H117 PolarHBondContact OH-O 3.43Å; S115-H117 PolarHBondContact O-N 2.76Å; H117-R119 VanDerWaalsContact C-N 3.3Å; H117-R119 PolarHBondContact O-N 2.89Å; H117-M120 PolarHBondContact O-N 3.48Å; H117-K121 PolarHBondContact O-N 3.01Å; H117-K121 VanDerWaalsContact O-N 3.13Å
118V59.2Low65Low112 Ų11298.4 Ų98.468%0.67949%0.491SS*.Hα-helixtrans-62.2-37.8178.8-1800000111.8P116 M120 K121 W122P116-V118 PolarHBondContact O-N 3.27Å; V118-M120 VanDerWaalsContact C-N 3.34Å; V118-M120 PolarHBondContact O-N 3.47Å; V118-K121 WeakPolarHBondContact O-CB 3.3Å; V118-K121 PolarHBondContact O-N 2.82Å; V118-W122 PolarHBondContact O-N 3.44Å
119R61.9Low66.4Low136 Ų13694.3 Ų94.351%0.51347%0.472SS..Hα-helixtrans-66.1-37.4177.8-62-163.8-63-175.3-2.3112P116 H117 Y123P116-R119 PolarHBondContact O-N 3.47Å; H117-R119 VanDerWaalsContact C-N 3.3Å; H117-R119 PolarHBondContact O-N 2.89Å; R119-Y123 PolarHBondContact O-N 2.92Å
120M68.3Low67.9Low103 Ų10388.3 Ų88.351%0.50745%0.45SS..Hα-helixtrans-67.6-40.5177.9-163.5174.981.100111.5Y99 H117 V118 W122 Y123 I124Y99-M120 HydrophobicContact CE2-CE 4.01Å; H117-M120 PolarHBondContact O-N 3.48Å; V118-M120 VanDerWaalsContact C-N 3.34Å; V118-M120 PolarHBondContact O-N 3.47Å; M120-W122 PolarHBondContact O-N 2.77Å; M120-Y123 PolarHBondContact O-N 3.42Å; M120-I124 HydrophobicContact CE-CD1 4.44Å; M120-I124 HydrophobicContact CG-CD1 4.16Å; M120-I124 WeakPolarHBondContact O-CG1 3.14Å; M120-I124 PolarHBondContact O-N 3.43Å
121K70.9Confident69.4Low56 Ų5680.3 Ų80.324%0.24341%0.414CS..Hα-helixtrans-54.4-52.6175.9-172.8176.3-178.4179.30112Y99 H117 V118 Y123 I124 E125Y99-K121 HydrophobicContact CD1-CG 4.37Å; Y99-K121 HydrophobicContact CE1-CB 3.67Å; Y99-K121 HydrophobicContact CE1-CD 3.82Å; Y99-K121 HydrophobicContact CE1-CG 3.5Å; Y99-K121 VanDerWaalsContact OH-CB 3.29Å; Y99-K121 WeakPolarHBondContact OH-CB 3.38Å; H117-K121 PolarHBondContact O-N 3.01Å; H117-K121 VanDerWaalsContact O-N 3.13Å; V118-K121 WeakPolarHBondContact O-CB 3.3Å; V118-K121 PolarHBondContact O-N 2.82Å; K121-Y123 PolarHBondContact O-N 3.04Å; K121-I124 PolarHBondContact O-N 3.41Å; K121-I124 VanDerWaalsContact O-N 3.1Å; K121-E125 PolarHBondContact O-N 3.46Å
122W72.6Confident70.9Confident149 Ų14975.7 Ų75.756%0.56439%0.386SS*.Hα-helixtrans-62-40.9-170.9-150.481.7000109.8V118 M120 I124 E125 L126V118-W122 PolarHBondContact O-N 3.44Å; M120-W122 PolarHBondContact O-N 2.77Å; W122-I124 PolarHBondContact O-N 3.49Å; W122-E125 PolarHBondContact O-N 2.92Å; W122-L126 HydrophobicContact CE3-CD1 4.12Å; W122-L126 HydrophobicContact CE3-CD2 3.76Å; W122-L126 HydrophobicContact CE3-CG 4.46Å; W122-L126 HydrophobicContact CH2-CD1 3.71Å; W122-L126 HydrophobicContact CH2-CD2 4.33Å; W122-L126 HydrophobicContact CZ2-CD1 4.31Å; W122-L126 HydrophobicContact CZ3-CD1 3.61Å; W122-L126 HydrophobicContact CZ3-CD2 3.44Å; W122-L126 VanDerWaalsContact CZ3-CD2 3.44Å; W122-L126 HydrophobicContact CZ3-CG 4.18Å; W122-L126 WeakPolarHBondContact O-CB 3.32Å; W122-L126 PolarHBondContact O-N 3.49Å
123Y78.5Confident72.7Confident126 Ų12672.6 Ų72.649%0.49437%0.371SS..Hα-helixtrans-61-41.6175.2-173.1-107000113.5R119 M120 K121 L126 A127 L185R119-Y123 PolarHBondContact O-N 2.92Å; M120-Y123 PolarHBondContact O-N 3.42Å; K121-Y123 PolarHBondContact O-N 3.04Å; Y123-L126 PolarHBondContact O-N 3.14Å; Y123-A127 WeakPolarHBondContact O-CB 3.33Å; Y123-A127 PolarHBondContact O-N 2.77Å; Y123-L185 HydrophobicContact CD2-CD2 4.47Å
124I81.7Confident74.4Confident55 Ų5569.7 Ų69.728%0.28235%0.346SS..Hα-helixtrans-66.9-45.9178.6-64.2163.9000111I92 M120 K121 W122 L126 A127 W128I92-I124 HydrophobicContact CG2-CG2 4.13Å; M120-I124 HydrophobicContact CE-CD1 4.44Å; M120-I124 HydrophobicContact CG-CD1 4.16Å; M120-I124 WeakPolarHBondContact O-CG1 3.14Å; M120-I124 PolarHBondContact O-N 3.43Å; K121-I124 PolarHBondContact O-N 3.41Å; K121-I124 VanDerWaalsContact O-N 3.1Å; W122-I124 PolarHBondContact O-N 3.49Å; I124-L126 PolarHBondContact O-N 3.34Å; I124-A127 PolarHBondContact O-N 3.17Å; I124-W128 WeakPolarHBondContact O-CB 3.38Å; I124-W128 PolarHBondContact O-N 3.44Å
125E80.6Confident76.2Confident40 Ų4060.9 Ų60.919%0.18731%0.306CS..Hα-helixtrans-63.7-34.7177.6-173.4172.4176.900111.3K16 M96 K121 W122 W128 C129K16-E125 IonicContact NZ-OE1 2.85Å; K16-E125 PolarHBondContact NZ-OE1 3.33Å; M96-E125 HydrophobicContact CE-CB 4.23Å; M96-E125 HydrophobicContact CE-CG 4.03Å; K121-E125 PolarHBondContact O-N 3.46Å; W122-E125 PolarHBondContact O-N 2.92Å; E125-W128 WeakPolarHBondContact O-CB 3.4Å; E125-W128 PolarHBondContact O-N 2.77Å; E125-C129 WeakPolarHBondContact O-CB 3.18Å; E125-C129 PolarHBondContact O-N 3.47Å
126L81.4Confident77.7Confident14 Ų1462 Ų627%0.07331%0.307CS..Hα-helixtrans-71.5-42.1177.9-156.375.1000112.4W122 Y123 I124 W128 C129 F130 F181 L185W122-L126 HydrophobicContact CE3-CD1 4.12Å; W122-L126 HydrophobicContact CE3-CD2 3.76Å; W122-L126 HydrophobicContact CE3-CG 4.46Å; W122-L126 HydrophobicContact CH2-CD1 3.71Å; W122-L126 HydrophobicContact CH2-CD2 4.33Å; W122-L126 HydrophobicContact CZ2-CD1 4.31Å; W122-L126 HydrophobicContact CZ3-CD1 3.61Å; W122-L126 HydrophobicContact CZ3-CD2 3.44Å; W122-L126 VanDerWaalsContact CZ3-CD2 3.44Å; W122-L126 HydrophobicContact CZ3-CG 4.18Å; W122-L126 WeakPolarHBondContact O-CB 3.32Å; W122-L126 PolarHBondContact O-N 3.49Å; Y123-L126 PolarHBondContact O-N 3.14Å; I124-L126 PolarHBondContact O-N 3.34Å; L126-W128 VanDerWaalsContact C-N 3.31Å; L126-C129 PolarHBondContact O-N 3.05Å; L126-F130 WeakPolarHBondContact O-CB 3.33Å; L126-F130 PolarHBondContact O-N 3.06Å; L126-F181 HydrophobicContact CB-CZ 4.3Å; L126-F181 HydrophobicContact CD1-CD2 4.36Å; L126-F181 HydrophobicContact CD1-CE1 3.97Å; L126-F181 HydrophobicContact CD1-CE2 3.19Å; L126-F181 HydrophobicContact CD1-CZ 2.98Å; L126-F181 HydrophobicContact CD2-CZ 4.27Å; L126-F181 HydrophobicContact CG-CE1 3.73Å; L126-F181 HydrophobicContact CG-CE2 3.94Å; L126-F181 HydrophobicContact CG-CZ 3.2Å; L126-L185 HydrophobicContact CD2-CD1 3.72Å; L126-L185 HydrophobicContact CD2-CD2 3.09Å; L126-L185 HydrophobicContact CD2-CG 3.35Å; L126-L185 HydrophobicContact CG-CD1 4.15Å; L126-L185 HydrophobicContact CG-CD2 4.31Å; L126-L185 HydrophobicContact CG-CG 4.25Å
127A84.2Confident79.5Confident34 Ų3458.2 Ų58.228%0.28128%0.282SS..Hα-helixtrans-61.9-40.8172.900000111.2Y123 I124 F130 S131Y123-A127 WeakPolarHBondContact O-CB 3.33Å; Y123-A127 PolarHBondContact O-N 2.77Å; I124-A127 PolarHBondContact O-N 3.17Å; A127-F130 PolarHBondContact O-N 3.33Å; A127-S131 WeakPolarHBondContact O-CB 3.27Å; A127-S131 PolarHBondContact O-N 3.42Å; A127-S131 PolarHBondContact O-OG 3.28Å
128W85.6Confident80.9Confident22 Ų2255.7 Ų55.78%0.08327%0.271CS..Hα-helixtrans-60.8-48.4173.4176.276000112.6K16 L17 S20 I92 S93 I124 E125 L126 F130 S131 T132K16-W128 HydrophobicContact CB-CH2 3.63Å; K16-W128 HydrophobicContact CB-CZ2 4.37Å; K16-W128 HydrophobicContact CB-CZ3 4.26Å; K16-W128 HydrophobicContact CD-CZ3 4.38Å; K16-W128 HydrophobicContact CG-CH2 4.33Å; K16-W128 WeakPolarHBondContact O-CZ2 3.46Å; L17-W128 HydrophobicContact CD2-CZ2 4Å; S20-W128 PolarHBondContact OG-NE1 2.79Å; I92-W128 HydrophobicContact CB-CB 4.36Å; I92-W128 HydrophobicContact CG2-CB 3.6Å; I92-W128 HydrophobicContact CG2-CG 4.12Å; S93-W128 PolarHBondContact OG-NE1 3.07Å; I124-W128 WeakPolarHBondContact O-CB 3.38Å; I124-W128 PolarHBondContact O-N 3.44Å; E125-W128 WeakPolarHBondContact O-CB 3.4Å; E125-W128 PolarHBondContact O-N 2.77Å; L126-W128 VanDerWaalsContact C-N 3.31Å; W128-F130 PolarHBondContact O-N 3.46Å; W128-S131 WeakPolarHBondContact O-CB 3.4Å; W128-S131 PolarHBondContact O-N 2.84Å; W128-T132 PolarHBondContact O-N 3.4Å; W128-T132 VanDerWaalsContact O-N 3.1Å; W128-T132 PolarHBondContact O-OG1 2.98Å
129C85.5Confident82.4Confident48 Ų4853.1 Ų53.132%0.32425%0.25SS..Hα-helixtrans-61.3-45.6178.5-171.30000111E125 L126 S131 T132 V133E125-C129 WeakPolarHBondContact O-CB 3.18Å; E125-C129 PolarHBondContact O-N 3.47Å; L126-C129 PolarHBondContact O-N 3.05Å; C129-S131 VanDerWaalsContact C-N 3.3Å; C129-S131 PolarHBondContact O-N 3.28Å; C129-T132 WeakPolarHBondContact O-CB 3.34Å; C129-T132 PolarHBondContact O-N 3.25Å; C129-T132 VanDerWaalsContact O-N 3.09Å; C129-V133 WeakPolarHBondContact O-CG2 3.22Å; C129-V133 PolarHBondContact O-N 3.02Å
130F84.6Confident83.7Confident57 Ų5747.6 Ų47.625%0.2523%0.231CC..Hα-helixtrans-58.7-41.3176.6-177.3-107.2000112.5L126 A127 W128 T132 V133 L134 T178 F181L126-F130 WeakPolarHBondContact O-CB 3.33Å; L126-F130 PolarHBondContact O-N 3.06Å; A127-F130 PolarHBondContact O-N 3.33Å; W128-F130 PolarHBondContact O-N 3.46Å; F130-T132 VanDerWaalsContact C-N 3.29Å; F130-T132 PolarHBondContact O-N 3.49Å; F130-V133 PolarHBondContact O-N 3.15Å; F130-L134 HydrophobicContact CD1-CD1 3.81Å; F130-L134 HydrophobicContact CD1-CG 4.17Å; F130-L134 HydrophobicContact CD2-CG 4.41Å; F130-L134 HydrophobicContact CE1-CD1 3.16Å; F130-L134 HydrophobicContact CE1-CG 3.81Å; F130-L134 HydrophobicContact CE2-CD1 4.23Å; F130-L134 HydrophobicContact CE2-CD2 4.24Å; F130-L134 HydrophobicContact CE2-CG 4.07Å; F130-L134 HydrophobicContact CG-CG 4.46Å; F130-L134 HydrophobicContact CZ-CD1 3.41Å; F130-L134 VanDerWaalsContact CZ-CD1 3.41Å; F130-L134 HydrophobicContact CZ-CD2 4.05Å; F130-L134 HydrophobicContact CZ-CG 3.76Å; F130-L134 WeakPolarHBondContact O-CB 3.46Å; F130-L134 WeakPolarHBondContact O-CG 3.49Å; F130-L134 PolarHBondContact O-N 3.41Å; F130-T178 HydrophobicContact CD2-CG2 4.17Å; F130-T178 HydrophobicContact CE2-CG2 3.5Å; F130-T178 HydrophobicContact CZ-CG2 4.38Å; F130-F181 HydrophobicContact CB-CE1 4.11Å; F130-F181 HydrophobicContact CD2-CD1 4.27Å; F130-F181 HydrophobicContact CD2-CE1 4.31Å
131S86.9Confident84.7Confident10 Ų1045.4 Ų45.47%0.0722%0.221CC..Hα-helixtrans-63.1-37.8176.9-53.20000111.5V85 L88 A127 W128 C129 G135V85-S131 WeakPolarHBondContact CG1-O 3.42Å; L88-S131 VanDerWaalsContact CD2-CB 3.5Å; L88-S131 WeakPolarHBondContact CD2-OG 3.43Å; A127-S131 WeakPolarHBondContact O-CB 3.27Å; A127-S131 PolarHBondContact O-N 3.42Å; A127-S131 PolarHBondContact O-OG 3.28Å; W128-S131 WeakPolarHBondContact O-CB 3.4Å; W128-S131 PolarHBondContact O-N 2.84Å; C129-S131 VanDerWaalsContact C-N 3.3Å; C129-S131 PolarHBondContact O-N 3.28Å; S131-G135 PolarHBondContact O-N 2.85Å; S131-G135 VanDerWaalsContact O-N 3.07Å
132T87.1Confident85.6Confident31 Ų3142.8 Ų42.819%0.1921%0.21CC..Hα-helixtrans-69.3-44.5175.4-540000111.5W128 C129 F130 G135 L136W128-T132 PolarHBondContact O-N 3.4Å; W128-T132 VanDerWaalsContact O-N 3.1Å; W128-T132 PolarHBondContact O-OG1 2.98Å; C129-T132 WeakPolarHBondContact O-CB 3.34Å; C129-T132 PolarHBondContact O-N 3.25Å; C129-T132 VanDerWaalsContact O-N 3.09Å; F130-T132 VanDerWaalsContact C-N 3.29Å; F130-T132 PolarHBondContact O-N 3.49Å; T132-G135 PolarHBondContact O-N 3.38Å; T132-L136 WeakPolarHBondContact O-CG 3.46Å; T132-L136 PolarHBondContact O-N 2.94Å
133V87Confident86.3Confident21 Ų2138 Ų3813%0.12720%0.195CC..Hα-helixtrans-63.9-44.1179.9174.90000111.4C129 F130 G135 L136 L137 F177 T178C129-V133 WeakPolarHBondContact O-CG2 3.22Å; C129-V133 PolarHBondContact O-N 3.02Å; F130-V133 PolarHBondContact O-N 3.15Å; V133-G135 VanDerWaalsContact C-N 3.33Å; V133-G135 PolarHBondContact O-N 3.01Å; V133-L136 PolarHBondContact O-N 3.09Å; V133-L137 PolarHBondContact O-N 2.94Å; V133-F177 HydrophobicContact CG1-CD1 4.38Å; V133-F177 HydrophobicContact CG2-CE1 4.39Å; V133-T178 VanDerWaalsContact CG1-OG1 3.31Å; V133-T178 WeakPolarHBondContact CG1-OG1 3.47Å
134L86.5Confident86.8Confident47 Ų4732.7 Ų32.725%0.24618%0.178CC..Hα-helixtrans-63.5-37.7174.6-76.1-168.7000112.4V85 F130 L136 L137 L138 T178V85-L134 HydrophobicContact CG1-CB 4.09Å; F130-L134 HydrophobicContact CD1-CD1 3.81Å; F130-L134 HydrophobicContact CD1-CG 4.17Å; F130-L134 HydrophobicContact CD2-CG 4.41Å; F130-L134 HydrophobicContact CE1-CD1 3.16Å; F130-L134 HydrophobicContact CE1-CG 3.81Å; F130-L134 HydrophobicContact CE2-CD1 4.23Å; F130-L134 HydrophobicContact CE2-CD2 4.24Å; F130-L134 HydrophobicContact CE2-CG 4.07Å; F130-L134 HydrophobicContact CG-CG 4.46Å; F130-L134 HydrophobicContact CZ-CD1 3.41Å; F130-L134 VanDerWaalsContact CZ-CD1 3.41Å; F130-L134 HydrophobicContact CZ-CD2 4.05Å; F130-L134 HydrophobicContact CZ-CG 3.76Å; F130-L134 WeakPolarHBondContact O-CB 3.46Å; F130-L134 WeakPolarHBondContact O-CG 3.49Å; F130-L134 PolarHBondContact O-N 3.41Å; L134-L136 VanDerWaalsContact C-N 3.34Å; L134-L136 PolarHBondContact O-N 3.47Å; L134-L137 PolarHBondContact O-N 3.23Å; L134-L138 WeakPolarHBondContact O-CG 3.25Å; L134-L138 PolarHBondContact O-N 2.92Å; L134-T178 HydrophobicContact CD2-CG2 3.84Å
135G89.9Confident87Confident0 Ų030.9 Ų30.90%017%0.169CC..Hα-helixtrans-61.4-43.3174.900000111.7S131 T132 V133 L137 L138 F139S131-G135 PolarHBondContact O-N 2.85Å; S131-G135 VanDerWaalsContact O-N 3.07Å; T132-G135 PolarHBondContact O-N 3.38Å; V133-G135 VanDerWaalsContact C-N 3.33Å; V133-G135 PolarHBondContact O-N 3.01Å; G135-L137 VanDerWaalsContact C-N 3.35Å; G135-L137 PolarHBondContact O-N 3.15Å; G135-L138 PolarHBondContact O-N 3.36Å; G135-F139 WeakPolarHBondContact O-CB 3.22Å; G135-F139 PolarHBondContact O-N 2.97Å
136L88.7Confident87.2Confident72 Ų7230.6 Ų30.638%0.37717%0.17SC..Hα-helixtrans-64.1-38.3174-67.3177.3000112.6L27 T132 V133 L134 F139 L140L27-L136 HydrophobicContact CD1-CD2 4.24Å; T132-L136 WeakPolarHBondContact O-CG 3.46Å; T132-L136 PolarHBondContact O-N 2.94Å; V133-L136 PolarHBondContact O-N 3.09Å; L134-L136 VanDerWaalsContact C-N 3.34Å; L134-L136 PolarHBondContact O-N 3.47Å; L136-F139 PolarHBondContact O-N 3.5Å; L136-L140 WeakPolarHBondContact O-CB 3.3Å; L136-L140 PolarHBondContact O-N 2.98Å
137L89.9Confident87.4Confident15 Ų1535.8 Ų35.88%0.07919%0.192CC..Hα-helixtrans-65-47177.1-170.2154.8000111.6V133 L134 G135 F139 L140 L141 F174 L175V133-L137 PolarHBondContact O-N 2.94Å; L134-L137 PolarHBondContact O-N 3.23Å; G135-L137 VanDerWaalsContact C-N 3.35Å; G135-L137 PolarHBondContact O-N 3.15Å; L137-F139 VanDerWaalsContact C-N 3.29Å; L137-F139 PolarHBondContact O-N 3.32Å; L137-L140 WeakPolarHBondContact O-CB 3.31Å; L137-L140 PolarHBondContact O-N 3.5Å; L137-L141 WeakPolarHBondContact O-CB 3.27Å; L137-L141 PolarHBondContact O-N 3.28Å; L137-F174 HydrophobicContact CD1-CB 4.42Å; L137-L175 HydrophobicContact CD1-CD2 3.49Å; L137-L175 VanDerWaalsContact CD1-CD2 3.49Å; L137-L175 HydrophobicContact CD1-CG 3.84Å; L137-L175 HydrophobicContact CD2-CD2 4.45Å
138L89Confident87.4Confident22 Ų2240 Ų4012%0.11520%0.201CC..Hα-helixtrans-64.1-35.9176-70.4171.8000111.4L81 L82 V85 L134 G135 L140 L141 E142L81-L138 HydrophobicContact CB-CD1 3.64Å; L81-L138 HydrophobicContact CB-CD2 4.47Å; L82-L138 HydrophobicContact CB-CB 4.03Å; L82-L138 HydrophobicContact CD1-CB 4.34Å; L82-L138 HydrophobicContact CG-CB 4.33Å; V85-L138 HydrophobicContact CG2-CD1 4.06Å; L134-L138 WeakPolarHBondContact O-CG 3.25Å; L134-L138 PolarHBondContact O-N 2.92Å; G135-L138 PolarHBondContact O-N 3.36Å; L138-L140 PolarHBondContact O-N 3.38Å; L138-L141 HydrophobicContact CD2-CD2 4.29Å; L138-L141 PolarHBondContact O-N 3.34Å; L138-E142 VanDerWaalsContact O-CB 3.29Å; L138-E142 WeakPolarHBondContact O-CB 3.2Å; L138-E142 PolarHBondContact O-N 3.35Å
139F90.1Very high87.1Confident57 Ų5742.8 Ų42.825%0.2522%0.216CC..Hα-helixtrans-62.8-42173.6-178.4-99.8000112.5L27 F30 L82 G135 L136 L137 E142 I143L27-F139 HydrophobicContact CD2-CB 4.34Å; L27-F139 HydrophobicContact CD2-CD1 4.26Å; L27-F139 HydrophobicContact CD2-CD2 3.27Å; L27-F139 HydrophobicContact CD2-CE1 4.39Å; L27-F139 HydrophobicContact CD2-CE2 3.4Å; L27-F139 HydrophobicContact CD2-CG 3.71Å; L27-F139 HydrophobicContact CD2-CZ 3.99Å; F30-F139 HydrophobicContact CD1-CD2 4.15Å; F30-F139 AromaticContact CD1-CE2 3.42Å; F30-F139 HydrophobicContact CD1-CE2 3.42Å; F30-F139 VanDerWaalsContact CD1-CE2 3.42Å; F30-F139 HydrophobicContact CD1-CZ 4.36Å; F30-F139 HydrophobicContact CE1-CD2 4.16Å; F30-F139 AromaticContact CE1-CE2 3.4Å; F30-F139 HydrophobicContact CE1-CE2 3.4Å; F30-F139 VanDerWaalsContact CE1-CE2 3.4Å; F30-F139 HydrophobicContact CE1-CZ 4.11Å; F30-F139 HydrophobicContact CG-CE2 4.22Å; F30-F139 HydrophobicContact CZ-CE2 4.3Å; L82-F139 HydrophobicContact CD1-CB 4.03Å; L82-F139 HydrophobicContact CD1-CD2 4.33Å; G135-F139 WeakPolarHBondContact O-CB 3.22Å; G135-F139 PolarHBondContact O-N 2.97Å; L136-F139 PolarHBondContact O-N 3.5Å; L137-F139 VanDerWaalsContact C-N 3.29Å; L137-F139 PolarHBondContact O-N 3.32Å; F139-E142 WeakPolarHBondContact O-CB 3.31Å; F139-E142 PolarHBondContact O-N 3.11Å; F139-I143 HydrophobicContact CE1-CG2 4.49Å; F139-I143 PolarHBondContact O-N 2.92Å; F139-I143 VanDerWaalsContact O-N 3.12Å
140L89.4Confident86.9Confident21 Ų2147.2 Ų47.211%0.1123%0.23CC..Hα-helixtrans-65.7-41.4175.1-167.778.4000111.8L136 L137 L138 E142 I143 G144 L167 I170 L171 F174L136-L140 WeakPolarHBondContact O-CB 3.3Å; L136-L140 PolarHBondContact O-N 2.98Å; L137-L140 WeakPolarHBondContact O-CB 3.31Å; L137-L140 PolarHBondContact O-N 3.5Å; L138-L140 PolarHBondContact O-N 3.38Å; L140-E142 VanDerWaalsContact C-N 3.34Å; L140-I143 HydrophobicContact CD1-CD1 4.01Å; L140-I143 WeakPolarHBondContact O-CG1 3.4Å; L140-G144 PolarHBondContact O-N 2.93Å; L140-G144 VanDerWaalsContact O-N 3.11Å; L140-L167 HydrophobicContact CD1-CD1 3.55Å; L140-L167 HydrophobicContact CD2-CD1 4.48Å; L140-L167 HydrophobicContact CG-CD1 3.77Å; L140-I170 HydrophobicContact CD1-CG2 3.94Å; L140-I170 HydrophobicContact CD2-CB 3.99Å; L140-I170 HydrophobicContact CD2-CG2 3.52Å; L140-I170 HydrophobicContact CG-CG2 4.39Å; L140-L171 HydrophobicContact CD2-CB 3.8Å; L140-L171 HydrophobicContact CD2-CG 4.45Å; L140-F174 HydrophobicContact CD2-CD2 4.01Å
141L89.2Confident86.7Confident56 Ų5645.9 Ų45.929%0.29322%0.224SC..Hα-helixtrans-62-42.9175.1-179.163.6000111C78 L137 L138 G144 I145 L171C78-L141 HydrophobicContact CB-CD2 4.49Å; L137-L141 WeakPolarHBondContact O-CB 3.27Å; L137-L141 PolarHBondContact O-N 3.28Å; L138-L141 HydrophobicContact CD2-CD2 4.29Å; L138-L141 PolarHBondContact O-N 3.34Å; L141-G144 CarbonylContact O-C 3.59Å; L141-G144 WeakPolarHBondContact O-CA 3.29Å; L141-G144 PolarHBondContact O-N 2.97Å; L141-I145 HydrophobicContact CD1-CD1 4.47Å; L141-I145 HydrophobicContact CG-CD1 4.12Å; L141-I145 WeakPolarHBondContact O-CG1 3.44Å; L141-I145 PolarHBondContact O-N 2.96Å; L141-L171 HydrophobicContact CB-CD1 4.18Å; L141-L171 HydrophobicContact CD1-CD1 3.87Å
142E88.6Confident86.1Confident2 Ų249.8 Ų49.81%0.00925%0.247CC..Hα-helixtrans-61.8-46.9179.6-167.887.7170.300111.9F75 C78 T79 L82 L138 F139 L140 G144 I145 V146F75-E142 HydrophobicContact CE2-CG 3.98Å; F75-E142 WeakPolarHBondContact CE2-OE1 3.21Å; F75-E142 WeakPolarHBondContact CZ-OE1 3.45Å; C78-E142 PolarHBondContact SG-OE2 3.23Å; T79-E142 PolarHBondContact N-OE2 3.11Å; T79-E142 PolarHBondContact OG1-OE1 3.08Å; T79-E142 PolarHBondContact OG1-OE2 3.29Å; L82-E142 HydrophobicContact CD1-CB 4.24Å; L138-E142 VanDerWaalsContact O-CB 3.29Å; L138-E142 WeakPolarHBondContact O-CB 3.2Å; L138-E142 PolarHBondContact O-N 3.35Å; F139-E142 WeakPolarHBondContact O-CB 3.31Å; F139-E142 PolarHBondContact O-N 3.11Å; L140-E142 VanDerWaalsContact C-N 3.34Å; E142-G144 PolarHBondContact O-N 2.98Å; E142-I145 PolarHBondContact O-N 3.49Å; E142-V146 WeakPolarHBondContact O-CG2 3.33Å; E142-V146 PolarHBondContact O-N 3.42Å; E142-V146 VanDerWaalsContact O-N 3.15Å
143I87.8Confident85.5Confident48 Ų4852.1 Ų52.125%0.24627%0.27CS..Hα-helixtrans-64-28.6174.365.4165.4000111.5F139 L140 V146 F147 L167F139-I143 HydrophobicContact CE1-CG2 4.49Å; F139-I143 PolarHBondContact O-N 2.92Å; F139-I143 VanDerWaalsContact O-N 3.12Å; L140-I143 HydrophobicContact CD1-CD1 4.01Å; L140-I143 WeakPolarHBondContact O-CG1 3.4Å; I143-V146 PolarHBondContact O-N 3.31Å; I143-F147 WeakPolarHBondContact O-CD2 3.29Å; I143-F147 PolarHBondContact O-N 3.27Å; I143-L167 HydrophobicContact CD1-CD1 3.95Å; I143-L167 HydrophobicContact CG1-CD1 4.17Å
144G89.2Confident84.9Confident14 Ų1456.4 Ų56.414%0.14429%0.291CS..Hα-helixtrans-70.3-44.4176.800000114.8L140 L141 E142 V146 F147 W148L140-G144 PolarHBondContact O-N 2.93Å; L140-G144 VanDerWaalsContact O-N 3.11Å; L141-G144 CarbonylContact O-C 3.59Å; L141-G144 WeakPolarHBondContact O-CA 3.29Å; L141-G144 PolarHBondContact O-N 2.97Å; E142-G144 PolarHBondContact O-N 2.98Å; G144-V146 VanDerWaalsContact C-N 3.25Å; G144-V146 PolarHBondContact O-N 3.06Å; G144-F147 PolarHBondContact O-N 3Å; G144-W148 WeakPolarHBondContact O-CB 3.22Å; G144-W148 PolarHBondContact O-N 2.93Å
145I85.9Confident83.9Confident18 Ų1863.7 Ų63.79%0.09232%0.321CS..Hα-helixtrans-61.1-41.2174.1-62.9164.9000109.6V71 V74 F75 C78 L141 E142 F147 W148 I149V71-I145 HydrophobicContact CG1-CG2 3.88Å; V74-I145 HydrophobicContact CG1-CD1 4.3Å; F75-I145 HydrophobicContact CB-CG2 4.11Å; F75-I145 HydrophobicContact CD2-CB 4.12Å; F75-I145 HydrophobicContact CD2-CD1 4.3Å; F75-I145 HydrophobicContact CD2-CG2 3.74Å; F75-I145 HydrophobicContact CG-CG2 4.27Å; C78-I145 HydrophobicContact CB-CD1 4.35Å; L141-I145 HydrophobicContact CD1-CD1 4.47Å; L141-I145 HydrophobicContact CG-CD1 4.12Å; L141-I145 WeakPolarHBondContact O-CG1 3.44Å; L141-I145 PolarHBondContact O-N 2.96Å; E142-I145 PolarHBondContact O-N 3.49Å; I145-F147 PolarHBondContact O-N 2.94Å; I145-W148 WeakPolarHBondContact O-CB 3.37Å; I145-W148 PolarHBondContact O-N 3.27Å; I145-I149 PolarHBondContact O-N 3.44Å
146V85Confident82.8Confident33 Ų3365.4 Ų65.420%0.234%0.335CS..Hα-helixtrans-62.9-41.6176.5173.30000112.3F75 E142 I143 G144 W148 I149 K150F75-V146 HydrophobicContact CE2-CG2 4.1Å; E142-V146 WeakPolarHBondContact O-CG2 3.33Å; E142-V146 PolarHBondContact O-N 3.42Å; E142-V146 VanDerWaalsContact O-N 3.15Å; I143-V146 PolarHBondContact O-N 3.31Å; G144-V146 VanDerWaalsContact C-N 3.25Å; G144-V146 PolarHBondContact O-N 3.06Å; V146-W148 VanDerWaalsContact C-N 3.34Å; V146-I149 WeakPolarHBondContact O-CG1 3.36Å; V146-K150 PolarHBondContact O-N 2.89Å
147F85.8Confident81.8Confident123 Ų12366.8 Ų66.854%0.53935%0.346SS..Hα-helixtrans-65.3-39.7173.8-101.2-91.7000111.6I143 G144 I145 K150 F151 P163I143-F147 WeakPolarHBondContact O-CD2 3.29Å; I143-F147 PolarHBondContact O-N 3.27Å; G144-F147 PolarHBondContact O-N 3Å; I145-F147 PolarHBondContact O-N 2.94Å; F147-K150 PolarHBondContact O-N 2.93Å; F147-F151 VanDerWaalsContact O-CB 3.27Å; F147-F151 WeakPolarHBondContact O-CB 3.11Å; F147-F151 PolarHBondContact O-N 3.32Å; F147-P163 HydrophobicContact CD1-CB 4.44Å
148W83.8Confident80.8Confident124 Ų12471.1 Ų71.147%0.4737%0.37SS..Hα-helixtrans-61.5-46.3178.5-173.7-97.8000112.5G144 I145 V146 F151 T152 T164G144-W148 WeakPolarHBondContact O-CB 3.22Å; G144-W148 PolarHBondContact O-N 2.93Å; I145-W148 WeakPolarHBondContact O-CB 3.37Å; I145-W148 PolarHBondContact O-N 3.27Å; V146-W148 VanDerWaalsContact C-N 3.34Å; W148-F151 PolarHBondContact O-N 2.66Å; W148-T152 WeakPolarHBondContact O-CB 3.48Å; W148-T152 PolarHBondContact O-N 2.98Å; W148-T152 PolarHBondContact O-OG1 3.47Å; W148-T164 HydrophobicContact CE3-CG2 4Å; W148-T164 HydrophobicContact CZ3-CG2 3.89Å
149I79.8Confident80.2Confident80 Ų8075.6 Ų75.641%0.4139%0.393SS..Hα-helixtrans-65.9-40.8177.962.3172.4000111.7V71 I145 V146 F151 T152 A153V71-I149 HydrophobicContact CG1-CG2 4.18Å; I145-I149 PolarHBondContact O-N 3.44Å; V146-I149 WeakPolarHBondContact O-CG1 3.36Å; I149-F151 VanDerWaalsContact C-N 3.33Å; I149-T152 PolarHBondContact O-N 3.34Å; I149-A153 PolarHBondContact O-N 2.74Å
150K80.8Confident79.3Confident141 Ų14174.1 Ų74.161%0.61339%0.388SS*.Hα-helixtrans-66.7-40178.6-82.2-166.4169.9-171.30111.1V146 F147 A153 I154V146-K150 PolarHBondContact O-N 2.89Å; F147-K150 PolarHBondContact O-N 2.93Å; K150-A153 PolarHBondContact O-N 3.46Å; K150-I154 WeakPolarHBondContact O-CG1 3.38Å; K150-I154 PolarHBondContact O-N 2.9Å
151F80.1Confident78.9Confident29 Ų2979.2 Ų79.213%0.12741%0.407CS..Hα-helixtrans-67.7-44.5177.6-157-68.1000110.9F147 W148 I149 A153 I154 A156 I159 T160F147-F151 VanDerWaalsContact O-CB 3.27Å; F147-F151 WeakPolarHBondContact O-CB 3.11Å; F147-F151 PolarHBondContact O-N 3.32Å; W148-F151 PolarHBondContact O-N 2.66Å; I149-F151 VanDerWaalsContact C-N 3.33Å; F151-A153 PolarHBondContact O-N 2.9Å; F151-A153 VanDerWaalsContact O-N 3.15Å; F151-I154 WeakPolarHBondContact CE1-O 2.87Å; F151-I154 CarbonylContact O-C 3.3Å; F151-I154 VanDerWaalsContact O-C 3.3Å; F151-I154 PolarHBondContact O-N 3.37Å; F151-A156 HydrophobicContact CE1-CB 4.36Å; F151-A156 WeakPolarHBondContact CE1-O 3.44Å; F151-A156 HydrophobicContact CZ-CB 4Å; F151-A156 WeakPolarHBondContact CZ-O 3.12Å; F151-I159 VanDerWaalsContact CE2-C 3.49Å; F151-I159 HydrophobicContact CE2-CB 4.36Å; F151-I159 HydrophobicContact CE2-CG2 4.47Å; F151-I159 VanDerWaalsContact CZ-C 3.46Å; F151-I159 HydrophobicContact CZ-CB 4.15Å; F151-T160 HydrophobicContact CB-CG2 4.02Å; F151-T160 HydrophobicContact CD1-CG2 3.06Å; F151-T160 WeakPolarHBondContact CD1-OG1 3.5Å; F151-T160 HydrophobicContact CD2-CG2 4.05Å; F151-T160 HydrophobicContact CE1-CG2 3.68Å; F151-T160 WeakPolarHBondContact CE1-OG1 3.31Å; F151-T160 HydrophobicContact CE2-CG2 4.44Å; F151-T160 VanDerWaalsContact CE2-N 3.33Å; F151-T160 HydrophobicContact CG-CG2 3.36Å; F151-T160 HydrophobicContact CZ-CG2 4.27Å; F151-T160 WeakPolarHBondContact CZ-OG1 3.41Å
152T74.5Confident78.8Confident91 Ų9181.5 Ų81.556%0.55842%0.418SS*.Hα-helixtrans-58-32.5177.8-57.90000112.1W148 I149W148-T152 WeakPolarHBondContact O-CB 3.48Å; W148-T152 PolarHBondContact O-N 2.98Å; W148-T152 PolarHBondContact O-OG1 3.47Å; I149-T152 PolarHBondContact O-N 3.34Å
153A74.2Confident78.6Confident80 Ų8083.5 Ų83.566%0.66143%0.432SS*.Hα-helixtrans-68.8-36.4174.700000113.3I149 K150 F151 K155I149-A153 PolarHBondContact O-N 2.74Å; K150-A153 PolarHBondContact O-N 3.46Å; F151-A153 PolarHBondContact O-N 2.9Å; F151-A153 VanDerWaalsContact O-N 3.15Å; A153-K155 PolarHBondContact O-N 3.49Å
154I74Confident78.5Confident112 Ų11283.2 Ų83.257%0.57443%0.432SS*.SBendtrans-90.993.9178-55.1164.2000106.3K150 F151 A156K150-I154 WeakPolarHBondContact O-CG1 3.38Å; K150-I154 PolarHBondContact O-N 2.9Å; F151-I154 WeakPolarHBondContact CE1-O 2.87Å; F151-I154 CarbonylContact O-C 3.3Å; F151-I154 VanDerWaalsContact O-C 3.3Å; F151-I154 PolarHBondContact O-N 3.37Å; I154-A156 HydrophobicContact CG2-CB 4.34Å; I154-A156 PolarHBondContact O-N 3.08Å
155K67Low78.5Confident199 Ų19984.4 Ų84.487%0.86544%0.444SS*.  trans-58.833.9-175.4-58.8-176.8178.8-178.90116.4A153 T157A153-K155 PolarHBondContact O-N 3.49Å; K155-T157 PolarHBondContact O-N 3.49Å
156A66.8Low78.8Confident36 Ų3688.4 Ų88.430%0.29847%0.465SS..  trans-88.483.1177.100000110.1F151 I154 N158 I159 T160F151-A156 HydrophobicContact CE1-CB 4.36Å; F151-A156 WeakPolarHBondContact CE1-O 3.44Å; F151-A156 HydrophobicContact CZ-CB 4Å; F151-A156 WeakPolarHBondContact CZ-O 3.12Å; I154-A156 HydrophobicContact CG2-CB 4.34Å; I154-A156 PolarHBondContact O-N 3.08Å; A156-N158 PolarHBondContact O-N 3.26Å; A156-I159 PolarHBondContact O-N 2.93Å; A156-T160 PolarHBondContact O-OG1 3.41Å
157T66.6Low78.9Confident101 Ų10188.3 Ų88.362%0.6246%0.463SS*.THydrogen-bonded Turntrans-51.6-30.5-176.472.70000113.7K155 Y161K155-T157 PolarHBondContact O-N 3.49Å; T157-Y161 WeakPolarHBondContact O-CE1 3.24Å
158N69.8Low79Confident107 Ų10785 Ų8557%0.57246%0.458SS*.THydrogen-bonded Turntrans-96.73.3-170.4-67.3-6.1000115.2A156 Y161A156-N158 PolarHBondContact O-N 3.26Å; N158-Y161 VanDerWaalsContact C-CE1 3.46Å; N158-Y161 VanDerWaalsContact C-OH 3.25Å; N158-Y161 VanDerWaalsContact CA-CZ 3.46Å; N158-Y161 WeakPolarHBondContact CA-OH 3.49Å; N158-Y161 HydrophobicContact CB-CE1 4.33Å; N158-Y161 WeakPolarHBondContact CB-OH 3.3Å; N158-Y161 WeakPolarHBondContact O-CE2 3.43Å; N158-Y161 PolarHBondContact O-OH 3.41Å
159I74.9Confident79.4Confident116 Ų11684.8 Ų84.860%0.59547%0.466SS*.THydrogen-bonded Turntrans-121-8.7-179.2-56.6174.5000111F151 A156 Y161 P163F151-I159 VanDerWaalsContact CE2-C 3.49Å; F151-I159 HydrophobicContact CE2-CB 4.36Å; F151-I159 HydrophobicContact CE2-CG2 4.47Å; F151-I159 VanDerWaalsContact CZ-C 3.46Å; F151-I159 HydrophobicContact CZ-CB 4.15Å; A156-I159 PolarHBondContact O-N 2.93Å; I159-Y161 PolarHBondContact O-N 3.32Å; I159-P163 VanDerWaalsContact O-CD 3.23Å; I159-P163 WeakPolarHBondContact O-CD 3.33Å
160T71.9Confident80Confident25 Ų2584.3 Ų84.315%0.15346%0.463CS..THydrogen-bonded Turntrans-63.4-41.8-177.1-33.90000113.7F151 A156 I162 P163 T164F151-T160 HydrophobicContact CB-CG2 4.02Å; F151-T160 HydrophobicContact CD1-CG2 3.06Å; F151-T160 WeakPolarHBondContact CD1-OG1 3.5Å; F151-T160 HydrophobicContact CD2-CG2 4.05Å; F151-T160 HydrophobicContact CE1-CG2 3.68Å; F151-T160 WeakPolarHBondContact CE1-OG1 3.31Å; F151-T160 HydrophobicContact CE2-CG2 4.44Å; F151-T160 VanDerWaalsContact CE2-N 3.33Å; F151-T160 HydrophobicContact CG-CG2 3.36Å; F151-T160 HydrophobicContact CZ-CG2 4.27Å; F151-T160 WeakPolarHBondContact CZ-OG1 3.41Å; A156-T160 PolarHBondContact O-OG1 3.41Å; T160-I162 VanDerWaalsContact C-N 3.27Å; T160-I162 PolarHBondContact O-N 2.83Å; T160-P163 VanDerWaalsContact O-CD 3.25Å; T160-P163 WeakPolarHBondContact O-CD 3.43Å; T160-P163 WeakPolarHBondContact O-CG 3.22Å; T160-T164 PolarHBondContact O-N 2.9Å; T160-T164 PolarHBondContact O-OG1 3.43Å
161Y81.5Confident80.3Confident128 Ų12879.3 Ų79.350%0.50244%0.443SS..Hα-helixtrans-71.4-26.3-164.331.1-105.7000112.1T157 N158 I159 G165T157-Y161 WeakPolarHBondContact O-CE1 3.24Å; N158-Y161 VanDerWaalsContact C-CE1 3.46Å; N158-Y161 VanDerWaalsContact C-OH 3.25Å; N158-Y161 VanDerWaalsContact CA-CZ 3.46Å; N158-Y161 WeakPolarHBondContact CA-OH 3.49Å; N158-Y161 HydrophobicContact CB-CE1 4.33Å; N158-Y161 WeakPolarHBondContact CB-OH 3.3Å; N158-Y161 WeakPolarHBondContact O-CE2 3.43Å; N158-Y161 PolarHBondContact O-OH 3.41Å; I159-Y161 PolarHBondContact O-N 3.32Å; Y161-G165 WeakPolarHBondContact O-CA 3.35Å; Y161-G165 PolarHBondContact O-N 3.28Å
162I86.7Confident80.7Confident104 Ų10480.1 Ų80.153%0.53346%0.455SS..Hα-helixtrans-66.4-59.3-179.3-52.4-59.7000111.7T160 T164 G165 I166T160-I162 VanDerWaalsContact C-N 3.27Å; T160-I162 PolarHBondContact O-N 2.83Å; I162-T164 VanDerWaalsContact C-N 3.35Å; I162-T164 PolarHBondContact O-N 2.83Å; I162-G165 PolarHBondContact O-N 2.72Å; I162-I166 HydrophobicContact CG2-CD1 4.13Å; I162-I166 WeakPolarHBondContact O-CG1 3.44Å; I162-I166 PolarHBondContact O-N 3.24Å; I162-I166 VanDerWaalsContact O-N 3.09Å
163P84.3Confident81.3Confident45 Ų4580.2 Ų80.229%0.29246%0.456SS..Hα-helixtrans-64.3-39.1179.525.4-34.6000112.3F147 I159 T160 L167F147-P163 HydrophobicContact CD1-CB 4.44Å; I159-P163 VanDerWaalsContact O-CD 3.23Å; I159-P163 WeakPolarHBondContact O-CD 3.33Å; T160-P163 VanDerWaalsContact O-CD 3.25Å; T160-P163 WeakPolarHBondContact O-CD 3.43Å; T160-P163 WeakPolarHBondContact O-CG 3.22Å; P163-L167 WeakPolarHBondContact O-CB 3.45Å; P163-L167 PolarHBondContact O-N 2.81Å; P163-L167 VanDerWaalsContact O-N 3.08Å
164T86.8Confident82Confident42 Ų4280 Ų8026%0.25844%0.44SS..Hα-helixtrans-65.1-41177.5-60.40000111.5W148 T160 I162 L167 A168W148-T164 HydrophobicContact CE3-CG2 4Å; W148-T164 HydrophobicContact CZ3-CG2 3.89Å; T160-T164 PolarHBondContact O-N 2.9Å; T160-T164 PolarHBondContact O-OG1 3.43Å; I162-T164 VanDerWaalsContact C-N 3.35Å; I162-T164 PolarHBondContact O-N 2.83Å; T164-L167 PolarHBondContact O-N 3.31Å; T164-A168 WeakPolarHBondContact O-CB 3.48Å; T164-A168 PolarHBondContact O-N 3.02Å
165G88.8Confident82.6Confident38 Ų3877 Ų7739%0.39242%0.424SS..Hα-helixtrans-65.2-43.3179.100000112.7Y161 I162 L167 A168 L169Y161-G165 WeakPolarHBondContact O-CA 3.35Å; Y161-G165 PolarHBondContact O-N 3.28Å; I162-G165 PolarHBondContact O-N 2.72Å; G165-L167 VanDerWaalsContact C-N 3.34Å; G165-L167 PolarHBondContact O-N 3.09Å; G165-A168 PolarHBondContact O-N 3.36Å; G165-L169 WeakPolarHBondContact O-CB 3.1Å; G165-L169 PolarHBondContact O-N 3.42Å
166I90.9Very high83.5Confident102 Ų10270.8 Ų70.852%0.52341%0.406SS..Hα-helixtrans-61.3-46.1175.6-66165.8000110.2I162 L169 I170I162-I166 HydrophobicContact CG2-CD1 4.13Å; I162-I166 WeakPolarHBondContact O-CG1 3.44Å; I162-I166 PolarHBondContact O-N 3.24Å; I162-I166 VanDerWaalsContact O-N 3.09Å; I166-L169 WeakPolarHBondContact O-CB 3.25Å; I166-L169 PolarHBondContact O-N 2.88Å; I166-I170 HydrophobicContact CG2-CD1 4.08Å; I166-I170 WeakPolarHBondContact O-CG1 3.35Å; I166-I170 PolarHBondContact O-N 2.89Å
167L88.7Confident84.3Confident31 Ų3174.7 Ų74.716%0.16242%0.416CS..Hα-helixtrans-66.6-41.7180-171.872.3000112.4L140 I143 P163 T164 G165 L169 I170 L171L140-L167 HydrophobicContact CD1-CD1 3.55Å; L140-L167 HydrophobicContact CD2-CD1 4.48Å; L140-L167 HydrophobicContact CG-CD1 3.77Å; I143-L167 HydrophobicContact CD1-CD1 3.95Å; I143-L167 HydrophobicContact CG1-CD1 4.17Å; P163-L167 WeakPolarHBondContact O-CB 3.45Å; P163-L167 PolarHBondContact O-N 2.81Å; P163-L167 VanDerWaalsContact O-N 3.08Å; T164-L167 PolarHBondContact O-N 3.31Å; G165-L167 VanDerWaalsContact C-N 3.34Å; G165-L167 PolarHBondContact O-N 3.09Å; L167-L169 VanDerWaalsContact C-N 3.27Å; L167-L169 PolarHBondContact O-N 3.1Å; L167-I170 PolarHBondContact O-N 2.94Å; L167-L171 WeakPolarHBondContact O-CB 2.87Å; L167-L171 PolarHBondContact O-N 3.33Å
168A87.5Confident85.1Confident54 Ų5470.5 Ų70.545%0.44639%0.39SS..Hα-helixtrans-60.1-38.8175.400000111.3T164 G165 L171 A172T164-A168 WeakPolarHBondContact O-CB 3.48Å; T164-A168 PolarHBondContact O-N 3.02Å; G165-A168 PolarHBondContact O-N 3.36Å; A168-L171 PolarHBondContact O-N 3.41Å; A168-A172 WeakPolarHBondContact O-CB 3.32Å; A168-A172 PolarHBondContact O-N 3.09Å
169L92.3Very high85.6Confident119 Ų11969 Ų6962%0.62338%0.379SS*.Hα-helixtrans-63.4-47.1175.2-175.171.5000111.7G165 I166 L167 L171 A172 V173G165-L169 WeakPolarHBondContact O-CB 3.1Å; G165-L169 PolarHBondContact O-N 3.42Å; I166-L169 WeakPolarHBondContact O-CB 3.25Å; I166-L169 PolarHBondContact O-N 2.88Å; L167-L169 VanDerWaalsContact C-N 3.27Å; L167-L169 PolarHBondContact O-N 3.1Å; L169-L171 VanDerWaalsContact C-N 3.28Å; L169-L171 PolarHBondContact O-N 3.36Å; L169-A172 PolarHBondContact O-N 2.95Å; L169-V173 WeakPolarHBondContact O-CG2 3.35Å; L169-V173 PolarHBondContact O-N 3.49Å
170I91.4Very high85.9Confident71 Ų7169 Ų6936%0.36438%0.378SS..Hα-helixtrans-60.2-44.2177.3-61.7166.5000109.4L140 I166 L167 A172 V173 F174L140-I170 HydrophobicContact CD1-CG2 3.94Å; L140-I170 HydrophobicContact CD2-CB 3.99Å; L140-I170 HydrophobicContact CD2-CG2 3.52Å; L140-I170 HydrophobicContact CG-CG2 4.39Å; I166-I170 HydrophobicContact CG2-CD1 4.08Å; I166-I170 WeakPolarHBondContact O-CG1 3.35Å; I166-I170 PolarHBondContact O-N 2.89Å; L167-I170 PolarHBondContact O-N 2.94Å; I170-A172 PolarHBondContact O-N 3.23Å; I170-V173 PolarHBondContact O-N 2.86Å; I170-F174 HydrophobicContact CG2-CD2 3.75Å; I170-F174 HydrophobicContact CG2-CE2 3.6Å; I170-F174 WeakPolarHBondContact O-CD2 3.48Å; I170-F174 PolarHBondContact O-N 3.31Å
171L88.2Confident86.3Confident35 Ų3569.9 Ų69.918%0.18338%0.38CS..Hα-helixtrans-62.3-41.7177.5-169.4152.1000111.8L140 L141 L167 A168 L169 F174 L175L140-L171 HydrophobicContact CD2-CB 3.8Å; L140-L171 HydrophobicContact CD2-CG 4.45Å; L141-L171 HydrophobicContact CB-CD1 4.18Å; L141-L171 HydrophobicContact CD1-CD1 3.87Å; L167-L171 WeakPolarHBondContact O-CB 2.87Å; L167-L171 PolarHBondContact O-N 3.33Å; A168-L171 PolarHBondContact O-N 3.41Å; L169-L171 VanDerWaalsContact C-N 3.28Å; L169-L171 PolarHBondContact O-N 3.36Å; L171-F174 PolarHBondContact O-N 3.26Å; L171-L175 HydrophobicContact CD2-CD1 3.35Å; L171-L175 HydrophobicContact CD2-CG 3.83Å; L171-L175 WeakPolarHBondContact O-CB 3.07Å; L171-L175 WeakPolarHBondContact O-CG 3.37Å; L171-L175 PolarHBondContact O-N 3.48Å
172A88Confident86.1Confident46 Ų4668.9 Ų68.938%0.3838%0.376SS..Hα-helixtrans-64.1-39.6176.900000112.2A168 L169 I170 L175 C176A168-A172 WeakPolarHBondContact O-CB 3.32Å; A168-A172 PolarHBondContact O-N 3.09Å; L169-A172 PolarHBondContact O-N 2.95Å; I170-A172 PolarHBondContact O-N 3.23Å; A172-L175 PolarHBondContact O-N 2.95Å; A172-C176 WeakPolarHBondContact O-CB 3.49Å; A172-C176 PolarHBondContact O-N 3.1Å
173V88.2Confident85.5Confident94 Ų9466 Ų6657%0.5736%0.364SS*.Hα-helixtrans-64.5-43.5174.9173.60000111L169 I170 C176 F177L169-V173 WeakPolarHBondContact O-CG2 3.35Å; L169-V173 PolarHBondContact O-N 3.49Å; I170-V173 PolarHBondContact O-N 2.86Å; V173-C176 PolarHBondContact O-N 3.46Å; V173-F177 WeakPolarHBondContact O-CB 3.48Å; V173-F177 PolarHBondContact O-N 2.82Å
174F87.4Confident85.1Confident76 Ų7670.7 Ų70.733%0.33338%0.38SS..Hα-helixtrans-66.9-41.2176.1-82.3-71.1000112.9L137 L140 I170 L171 F177 T178L137-F174 HydrophobicContact CD1-CB 4.42Å; L140-F174 HydrophobicContact CD2-CD2 4.01Å; I170-F174 HydrophobicContact CG2-CD2 3.75Å; I170-F174 HydrophobicContact CG2-CE2 3.6Å; I170-F174 WeakPolarHBondContact O-CD2 3.48Å; I170-F174 PolarHBondContact O-N 3.31Å; L171-F174 PolarHBondContact O-N 3.26Å; F174-F177 PolarHBondContact O-N 2.63Å; F174-T178 WeakPolarHBondContact O-CB 3.45Å; F174-T178 PolarHBondContact O-N 3.28Å; F174-T178 PolarHBondContact O-OG1 3.22Å
175L86.2Confident84.1Confident47 Ų4770.1 Ų70.125%0.24638%0.375CS..Hα-helixtrans-62.1-45173.2-83178.8000111L137 L171 A172 F177 T178 F179L137-L175 HydrophobicContact CD1-CD2 3.49Å; L137-L175 VanDerWaalsContact CD1-CD2 3.49Å; L137-L175 HydrophobicContact CD1-CG 3.84Å; L137-L175 HydrophobicContact CD2-CD2 4.45Å; L171-L175 HydrophobicContact CD2-CD1 3.35Å; L171-L175 HydrophobicContact CD2-CG 3.83Å; L171-L175 WeakPolarHBondContact O-CB 3.07Å; L171-L175 WeakPolarHBondContact O-CG 3.37Å; L171-L175 PolarHBondContact O-N 3.48Å; A172-L175 PolarHBondContact O-N 2.95Å; L175-F177 PolarHBondContact O-N 3.02Å; L175-T178 PolarHBondContact O-N 3.19Å; L175-F179 WeakPolarHBondContact O-CB 3.21Å; L175-F179 PolarHBondContact O-N 3.07Å
176C86.1Confident83.1Confident70 Ų7071.2 Ų71.247%0.47338%0.375SS..Hα-helixtrans-58.9-48176.9179.50000110.6A172 V173 T178 F179 M180A172-C176 WeakPolarHBondContact O-CB 3.49Å; A172-C176 PolarHBondContact O-N 3.1Å; V173-C176 PolarHBondContact O-N 3.46Å; C176-T178 PolarHBondContact O-N 3.03Å; C176-F179 PolarHBondContact O-N 3.27Å; C176-M180 WeakPolarHBondContact O-CB 3.36Å; C176-M180 VanDerWaalsContact O-CG 3.29Å; C176-M180 WeakPolarHBondContact O-CG 3.45Å; C176-M180 PolarHBondContact O-N 3.38Å
177F85Confident82.1Confident117 Ų11771.8 Ų71.851%0.51338%0.376SS..Hα-helixtrans-60.6-46.2176.2-178-100.7000112.2V133 V173 F174 L175 F179 M180 F181V133-F177 HydrophobicContact CG1-CD1 4.38Å; V133-F177 HydrophobicContact CG2-CE1 4.39Å; V173-F177 WeakPolarHBondContact O-CB 3.48Å; V173-F177 PolarHBondContact O-N 2.82Å; F174-F177 PolarHBondContact O-N 2.63Å; L175-F177 PolarHBondContact O-N 3.02Å; F177-F179 VanDerWaalsContact C-N 3.31Å; F177-F179 PolarHBondContact O-N 3.37Å; F177-M180 PolarHBondContact O-N 3.35Å; F177-F181 VanDerWaalsContact O-CB 3.25Å; F177-F181 WeakPolarHBondContact O-CB 3.49Å; F177-F181 PolarHBondContact O-N 2.96Å
178T82Confident81.2Confident13 Ų1374 Ų748%0.0839%0.386CS..Hα-helixtrans-60.2-41.7176.6-57.20000111.4F130 V133 L134 F174 L175 C176 Y182F130-T178 HydrophobicContact CD2-CG2 4.17Å; F130-T178 HydrophobicContact CE2-CG2 3.5Å; F130-T178 HydrophobicContact CZ-CG2 4.38Å; V133-T178 VanDerWaalsContact CG1-OG1 3.31Å; V133-T178 WeakPolarHBondContact CG1-OG1 3.47Å; L134-T178 HydrophobicContact CD2-CG2 3.84Å; F174-T178 WeakPolarHBondContact O-CB 3.45Å; F174-T178 PolarHBondContact O-N 3.28Å; F174-T178 PolarHBondContact O-OG1 3.22Å; L175-T178 PolarHBondContact O-N 3.19Å; C176-T178 PolarHBondContact O-N 3.03Å; T178-Y182 VanDerWaalsContact O-CB 3.27Å; T178-Y182 WeakPolarHBondContact O-CB 3.4Å; T178-Y182 PolarHBondContact O-N 3.03Å
179F81.4Confident80.2Confident77 Ų7776.8 Ų76.834%0.33839%0.388SS..Hα-helixtrans-71.8-43.2179.7180-99.4000112.4L175 C176 F177 F181 Y182 S183 V230 F234L175-F179 WeakPolarHBondContact O-CB 3.21Å; L175-F179 PolarHBondContact O-N 3.07Å; C176-F179 PolarHBondContact O-N 3.27Å; F177-F179 VanDerWaalsContact C-N 3.31Å; F177-F179 PolarHBondContact O-N 3.37Å; F179-F181 VanDerWaalsContact C-N 3.27Å; F179-F181 PolarHBondContact O-N 2.95Å; F179-Y182 PolarHBondContact O-N 2.96Å; F179-S183 VanDerWaalsContact O-CB 3.29Å; F179-S183 WeakPolarHBondContact O-CB 3.43Å; F179-S183 PolarHBondContact O-N 2.9Å; F179-S183 PolarHBondContact O-OG 3.27Å; F179-V230 HydrophobicContact CE2-CG1 3.73Å; F179-F234 AromaticContact CD2-CE2 3.87Å; F179-F234 HydrophobicContact CD2-CE2 3.87Å; F179-F234 HydrophobicContact CD2-CZ 4.29Å; F179-F234 HydrophobicContact CE2-CE2 4.12Å
180M80.9Confident78.8Confident115 Ų11574.1 Ų74.157%0.56737%0.37SS*.Hα-helixtrans-58.3-43.8173.3-76.8-174.669.100110.6C176 F177 S183 K184C176-M180 WeakPolarHBondContact O-CB 3.36Å; C176-M180 VanDerWaalsContact O-CG 3.29Å; C176-M180 WeakPolarHBondContact O-CG 3.45Å; C176-M180 PolarHBondContact O-N 3.38Å; F177-M180 PolarHBondContact O-N 3.35Å; M180-S183 WeakPolarHBondContact O-CB 3.24Å; M180-S183 PolarHBondContact O-N 3.44Å; M180-K184 WeakPolarHBondContact O-CG 3.12Å; M180-K184 PolarHBondContact O-N 3.49Å
181F79.8Confident77.9Confident44 Ų4476.7 Ų76.719%0.19338%0.381CS..Hα-helixtrans-67.5-45.2177.5-179.6-93.7000112.5L126 F130 F177 F179 S183 K184 L185L126-F181 HydrophobicContact CB-CZ 4.3Å; L126-F181 HydrophobicContact CD1-CD2 4.36Å; L126-F181 HydrophobicContact CD1-CE1 3.97Å; L126-F181 HydrophobicContact CD1-CE2 3.19Å; L126-F181 HydrophobicContact CD1-CZ 2.98Å; L126-F181 HydrophobicContact CD2-CZ 4.27Å; L126-F181 HydrophobicContact CG-CE1 3.73Å; L126-F181 HydrophobicContact CG-CE2 3.94Å; L126-F181 HydrophobicContact CG-CZ 3.2Å; F130-F181 HydrophobicContact CB-CE1 4.11Å; F130-F181 HydrophobicContact CD2-CD1 4.27Å; F130-F181 HydrophobicContact CD2-CE1 4.31Å; F177-F181 VanDerWaalsContact O-CB 3.25Å; F177-F181 WeakPolarHBondContact O-CB 3.49Å; F177-F181 PolarHBondContact O-N 2.96Å; F179-F181 VanDerWaalsContact C-N 3.27Å; F179-F181 PolarHBondContact O-N 2.95Å; F181-S183 VanDerWaalsContact C-N 3.25Å; F181-S183 PolarHBondContact O-N 2.7Å; F181-K184 PolarHBondContact O-N 2.96Å; F181-L185 HydrophobicContact CD1-CD1 4.09Å; F181-L185 HydrophobicContact CE1-CD1 3.8Å; F181-L185 PolarHBondContact O-N 2.97Å
182Y78.5Confident77.1Confident107 Ų10777.6 Ų77.642%0.4239%0.385SS..Hα-helixtrans-57.2-41.9172.6178.7-96.3000111.2T178 F179 K184 L185 T186T178-Y182 VanDerWaalsContact O-CB 3.27Å; T178-Y182 WeakPolarHBondContact O-CB 3.4Å; T178-Y182 PolarHBondContact O-N 3.03Å; F179-Y182 PolarHBondContact O-N 2.96Å; Y182-K184 PolarHBondContact O-N 2.85Å; Y182-L185 WeakPolarHBondContact O-CA 3.38Å; Y182-L185 WeakPolarHBondContact O-CB 3.49Å; Y182-L185 PolarHBondContact O-N 3.42Å; Y182-L185 VanDerWaalsContact O-N 3.11Å; Y182-T186 HydrophobicContact CE1-CG2 4.4Å; Y182-T186 PolarHBondContact O-N 2.91Å; Y182-T186 PolarHBondContact O-OG1 2.96Å
183S73.9Confident76.3Confident42 Ų4277.4 Ų77.429%0.29438%0.381SS..Hα-helixtrans-62-45.2177.4-61.60000111.6F179 M180 F181 L185 T186 M187F179-S183 VanDerWaalsContact O-CB 3.29Å; F179-S183 WeakPolarHBondContact O-CB 3.43Å; F179-S183 PolarHBondContact O-N 2.9Å; F179-S183 PolarHBondContact O-OG 3.27Å; M180-S183 WeakPolarHBondContact O-CB 3.24Å; M180-S183 PolarHBondContact O-N 3.44Å; F181-S183 VanDerWaalsContact C-N 3.25Å; F181-S183 PolarHBondContact O-N 2.7Å; S183-L185 PolarHBondContact O-N 3.24Å; S183-T186 WeakPolarHBondContact CA-OG1 3.42Å; S183-T186 PolarHBondContact O-N 3.04Å; S183-T186 PolarHBondContact O-OG1 2.81Å; S183-T186 VanDerWaalsContact O-OG1 3.04Å; S183-M187 WeakPolarHBondContact O-CB 3.46Å; S183-M187 PolarHBondContact O-N 3.46Å
184K74.3Confident75.6Confident145 Ų14575.8 Ų75.863%0.6337%0.366SS*.Hα-helixtrans-60.6-35.1174.2-69.9-67.9-179.2-176.50112.1M180 F181 Y182 M187 H188M180-K184 WeakPolarHBondContact O-CG 3.12Å; M180-K184 PolarHBondContact O-N 3.49Å; F181-K184 PolarHBondContact O-N 2.96Å; Y182-K184 PolarHBondContact O-N 2.85Å; K184-M187 PolarHBondContact O-N 3.19Å; K184-H188 PolarHBondContact O-N 3.3Å
185L67.7Low75.1Confident29 Ų2973.6 Ų73.615%0.15237%0.366CS..Hα-helixtrans-64.2-48.9174.6-103.2174.2000113.3Y123 L126 F181 Y182 S183 M187 H188 K189Y123-L185 HydrophobicContact CD2-CD2 4.47Å; L126-L185 HydrophobicContact CD2-CD1 3.72Å; L126-L185 HydrophobicContact CD2-CD2 3.09Å; L126-L185 HydrophobicContact CD2-CG 3.35Å; L126-L185 HydrophobicContact CG-CD1 4.15Å; L126-L185 HydrophobicContact CG-CD2 4.31Å; L126-L185 HydrophobicContact CG-CG 4.25Å; F181-L185 HydrophobicContact CD1-CD1 4.09Å; F181-L185 HydrophobicContact CE1-CD1 3.8Å; F181-L185 PolarHBondContact O-N 2.97Å; Y182-L185 WeakPolarHBondContact O-CA 3.38Å; Y182-L185 WeakPolarHBondContact O-CB 3.49Å; Y182-L185 PolarHBondContact O-N 3.42Å; Y182-L185 VanDerWaalsContact O-N 3.11Å; S183-L185 PolarHBondContact O-N 3.24Å; L185-M187 VanDerWaalsContact C-N 3.33Å; L185-H188 PolarHBondContact O-N 3.42Å; L185-K189 PolarHBondContact O-N 3.34Å
186T66.4Low74.6Confident62 Ų6279.3 Ų79.338%0.3838%0.384SS..Hα-helixtrans-63.8-38.4175.416.20000111.9Y182 S183 H188 K189 Y190Y182-T186 HydrophobicContact CE1-CG2 4.4Å; Y182-T186 PolarHBondContact O-N 2.91Å; Y182-T186 PolarHBondContact O-OG1 2.96Å; S183-T186 WeakPolarHBondContact CA-OG1 3.42Å; S183-T186 PolarHBondContact O-N 3.04Å; S183-T186 PolarHBondContact O-OG1 2.81Å; S183-T186 VanDerWaalsContact O-OG1 3.04Å; T186-H188 PolarHBondContact O-N 3.49Å; T186-K189 PolarHBondContact O-N 3.45Å; T186-Y190 WeakPolarHBondContact O-CB 3.4Å; T186-Y190 PolarHBondContact O-N 3.23Å
187M71.1Confident74.2Confident113 Ų11378.4 Ų78.456%0.55737%0.374SS*.Hα-helixtrans-63.5-41175.3-171.8-172.2-18000111.6S183 K184 L185 Y190 E191S183-M187 WeakPolarHBondContact O-CB 3.46Å; S183-M187 PolarHBondContact O-N 3.46Å; K184-M187 PolarHBondContact O-N 3.19Å; L185-M187 VanDerWaalsContact C-N 3.33Å; M187-Y190 VanDerWaalsContact O-CB 3.3Å; M187-Y190 WeakPolarHBondContact O-CB 3.36Å; M187-Y190 PolarHBondContact O-N 2.94Å; M187-E191 PolarHBondContact O-N 3.1Å
188H68.3Low74.1Confident78 Ų7876.4 Ų76.436%0.36137%0.369SS..Hα-helixtrans-69.3-38.4176.7-169.760.3000112.3K184 L185 T186 Y190 E191 L192K184-H188 PolarHBondContact O-N 3.3Å; L185-H188 PolarHBondContact O-N 3.42Å; T186-H188 PolarHBondContact O-N 3.49Å; H188-Y190 PolarHBondContact O-N 3.41Å; H188-E191 PolarHBondContact O-N 3.3Å; H188-L192 WeakPolarHBondContact NE2-CD1 3.28Å; H188-L192 WeakPolarHBondContact O-CB 3.49Å; H188-L192 WeakPolarHBondContact O-CG 3.47Å; H188-L192 PolarHBondContact O-N 2.88Å
189K67.8Low74.2Confident113 Ų11380.7 Ų80.749%0.49139%0.391SS..Hα-helixtrans-59-37.7170.7-77.1175.9176.5-84.90111.5L185 T186 S193L185-K189 PolarHBondContact O-N 3.34Å; T186-K189 PolarHBondContact O-N 3.45Å; K189-S193 VanDerWaalsContact O-CB 3.31Å; K189-S193 WeakPolarHBondContact O-CB 3.42Å; K189-S193 PolarHBondContact O-N 3.32Å
190Y62.6Low74.2Confident62 Ų6281.8 Ų81.824%0.24340%0.4CS..Hα-helixtrans-63.5-52.5176.4172.3-86.5000111.5T186 M187 H188 L192 S193 K194 V219T186-Y190 WeakPolarHBondContact O-CB 3.4Å; T186-Y190 PolarHBondContact O-N 3.23Å; M187-Y190 VanDerWaalsContact O-CB 3.3Å; M187-Y190 WeakPolarHBondContact O-CB 3.36Å; M187-Y190 PolarHBondContact O-N 2.94Å; H188-Y190 PolarHBondContact O-N 3.41Å; Y190-L192 VanDerWaalsContact C-N 3.31Å; Y190-L192 PolarHBondContact O-N 2.99Å; Y190-S193 PolarHBondContact O-N 3.44Å; Y190-S193 VanDerWaalsContact O-N 3.15Å; Y190-K194 WeakPolarHBondContact O-CB 3.34Å; Y190-K194 PolarHBondContact O-N 3.27Å; Y190-V219 HydrophobicContact CD2-CG1 3.36Å; Y190-V219 HydrophobicContact CE2-CB 4.02Å; Y190-V219 HydrophobicContact CE2-CG1 3.22Å
191E72.2Confident74.1Confident126 Ų12679 Ų7959%0.58939%0.385SS*.Hα-helixtrans-62.6-39.4-178.4-166.9172.3-178.300111.8M187 H188 K194 G195M187-E191 PolarHBondContact O-N 3.1Å; H188-E191 PolarHBondContact O-N 3.3Å; E191-K194 PolarHBondContact O-N 3.48Å; E191-G195 PolarHBondContact O-N 3.49Å
192L71.3Confident74.2Confident53 Ų5384.2 Ų84.228%0.27741%0.408SS..Hα-helixtrans-69.1-36.8175.1-71.5-176.3000113.4H188 Y190 R196H188-L192 WeakPolarHBondContact NE2-CD1 3.28Å; H188-L192 WeakPolarHBondContact O-CB 3.49Å; H188-L192 WeakPolarHBondContact O-CG 3.47Å; H188-L192 PolarHBondContact O-N 2.88Å; Y190-L192 VanDerWaalsContact C-N 3.31Å; Y190-L192 PolarHBondContact O-N 2.99Å; L192-R196 WeakPolarHBondContact O-CG 3.43Å; L192-R196 PolarHBondContact O-N 3.03Å
193S72.1Confident74.4Confident42 Ų4287 Ų8729%0.29442%0.419SS..Hα-helixtrans-71.2-37.9176.6-158.90000111K189 Y190 R196 L197K189-S193 VanDerWaalsContact O-CB 3.31Å; K189-S193 WeakPolarHBondContact O-CB 3.42Å; K189-S193 PolarHBondContact O-N 3.32Å; Y190-S193 PolarHBondContact O-N 3.44Å; Y190-S193 VanDerWaalsContact O-N 3.15Å; S193-R196 PolarHBondContact O-N 3.47Å; S193-L197 WeakPolarHBondContact O-CB 3.44Å; S193-L197 WeakPolarHBondContact O-CG 3.4Å; S193-L197 PolarHBondContact O-N 3.31Å
194K71.8Confident74.7Confident60 Ų6088.4 Ų88.426%0.26143%0.428SS..Hα-helixtrans-58.7-51.5173.4-171.6174-176.1174.20110.5Y190 E191 R196 L197 D198 E216Y190-K194 WeakPolarHBondContact O-CB 3.34Å; Y190-K194 PolarHBondContact O-N 3.27Å; E191-K194 PolarHBondContact O-N 3.48Å; K194-R196 VanDerWaalsContact C-N 3.33Å; K194-R196 PolarHBondContact O-N 3.4Å; K194-L197 CarbonylContact O-C 3.59Å; K194-L197 WeakPolarHBondContact O-CB 3.48Å; K194-L197 PolarHBondContact O-N 3.49Å; K194-D198 VanDerWaalsContact O-CG 3.27Å; K194-D198 PolarHBondContact O-N 3.3Å; K194-E216 IonicContact NZ-OE1 2.82Å; K194-E216 PolarHBondContact NZ-OE1 2.9Å; K194-E216 IonicContact NZ-OE2 2.92Å; K194-E216 PolarHBondContact NZ-OE2 3.29Å
195G77Confident75Confident31 Ų3184.3 Ų84.332%0.3242%0.418SS..Hα-helixtrans-57.6-41.1177.500000113.9E191 D198 D199E191-G195 PolarHBondContact O-N 3.49Å; G195-D198 PolarHBondContact O-N 2.71Å; G195-D199 VanDerWaalsContact O-CG 3.31Å; G195-D199 PolarHBondContact O-N 3.45Å
196R76.9Confident75.7Confident166 Ų16687.6 Ų87.663%0.62644%0.443SS*.Hα-helixtrans-68.6-32.8175.5-71.1-167.2-61.8169.44.3113.4L192 S193 K194 L200L192-R196 WeakPolarHBondContact O-CG 3.43Å; L192-R196 PolarHBondContact O-N 3.03Å; S193-R196 PolarHBondContact O-N 3.47Å; K194-R196 VanDerWaalsContact C-N 3.33Å; K194-R196 PolarHBondContact O-N 3.4Å; R196-L200 WeakPolarHBondContact O-CB 3.34Å; R196-L200 PolarHBondContact O-N 3.19Å; R196-L200 VanDerWaalsContact O-N 3.1Å
197L77.7Confident76.5Confident51 Ų5193.3 Ų93.327%0.26746%0.463SS..Hα-helixtrans-72.6-40.5175.9-72.2167.3000110.8S193 K194 L200 Q201 V215 V219S193-L197 WeakPolarHBondContact O-CB 3.44Å; S193-L197 WeakPolarHBondContact O-CG 3.4Å; S193-L197 PolarHBondContact O-N 3.31Å; K194-L197 CarbonylContact O-C 3.59Å; K194-L197 WeakPolarHBondContact O-CB 3.48Å; K194-L197 PolarHBondContact O-N 3.49Å; L197-L200 CarbonylContact O-C 3.59Å; L197-L200 PolarHBondContact O-N 3.42Å; L197-Q201 VanDerWaalsContact O-CB 3.24Å; L197-Q201 WeakPolarHBondContact O-CB 3.47Å; L197-Q201 PolarHBondContact O-N 2.79Å; L197-V215 HydrophobicContact CD1-CG1 3.84Å; L197-V215 HydrophobicContact CD2-CG1 4.31Å; L197-V215 HydrophobicContact CG-CG1 4.46Å; L197-V219 HydrophobicContact CD1-CG2 4.12Å
198D82.1Confident76.8Confident76 Ų7693.8 Ų93.841%0.40646%0.464SS..Hα-helixtrans-62.8-43.4175.7-64.8-15.9000110.8K194 G195 Q201 K202K194-D198 VanDerWaalsContact O-CG 3.27Å; K194-D198 PolarHBondContact O-N 3.3Å; G195-D198 PolarHBondContact O-N 2.71Å; D198-Q201 PolarHBondContact O-N 3.38Å; D198-K202 WeakPolarHBondContact O-CB 3.41Å; D198-K202 PolarHBondContact O-N 3.01Å
199D83.8Confident77.1Confident102 Ų10295 Ų9555%0.54548%0.478SS..Hα-helixtrans-58.3-49.2172.9-73.7-24.7000110.8G195 K202 Y203G195-D199 VanDerWaalsContact O-CG 3.31Å; G195-D199 PolarHBondContact O-N 3.45Å; D199-K202 WeakPolarHBondContact O-CB 3.45Å; D199-K202 PolarHBondContact O-N 3.48Å; D199-Y203 WeakPolarHBondContact O-CD2 3.44Å; D199-Y203 PolarHBondContact O-N 3.43Å
200L82Confident77.3Confident100 Ų10096.6 Ų96.652%0.52449%0.493SS..Hα-helixtrans-66.6-40.1179.8-17166.1000112.6R196 L197 K202 Y203 C204R196-L200 WeakPolarHBondContact O-CB 3.34Å; R196-L200 PolarHBondContact O-N 3.19Å; R196-L200 VanDerWaalsContact O-N 3.1Å; L197-L200 CarbonylContact O-C 3.59Å; L197-L200 PolarHBondContact O-N 3.42Å; L200-K202 VanDerWaalsContact C-N 3.27Å; L200-K202 PolarHBondContact O-N 3.35Å; L200-Y203 CarbonylContact O-C 3.59Å; L200-Y203 WeakPolarHBondContact O-CA 3.35Å; L200-Y203 WeakPolarHBondContact O-CB 2.99Å; L200-Y203 PolarHBondContact O-N 3.46Å; L200-Y203 VanDerWaalsContact O-N 3.09Å; L200-C204 PolarHBondContact O-N 3.39Å
201Q78.2Confident77.7Confident56 Ų5696.7 Ų96.726%0.26250%0.5SS..Hα-helixtrans-61.2-38.9175.7177.9172.4-2000110.1L197 D198 Y203 C204 S205 E212 V215L197-Q201 VanDerWaalsContact O-CB 3.24Å; L197-Q201 WeakPolarHBondContact O-CB 3.47Å; L197-Q201 PolarHBondContact O-N 2.79Å; D198-Q201 PolarHBondContact O-N 3.38Å; Q201-Y203 VanDerWaalsContact C-N 3.32Å; Q201-Y203 PolarHBondContact O-N 2.92Å; Q201-C204 PolarHBondContact O-N 2.87Å; Q201-S205 VanDerWaalsContact O-CB 3.28Å; Q201-S205 WeakPolarHBondContact O-CB 3.45Å; Q201-S205 PolarHBondContact O-N 2.95Å; Q201-S205 PolarHBondContact O-OG 3.5Å; Q201-E212 PolarHBondContact NE2-OE1 3.13Å; Q201-E212 VanDerWaalsContact NE2-OE1 3.09Å; Q201-V215 VanDerWaalsContact OE1-CG2 3.29Å
202K81.7Confident77.6Confident154 Ų15498.3 Ų98.367%0.6751%0.507SS*.Hα-helixtrans-63.1-36.5173.8-165.7175.1-178179.50112.4D198 D199 L200 S205 S206D198-K202 WeakPolarHBondContact O-CB 3.41Å; D198-K202 PolarHBondContact O-N 3.01Å; D199-K202 WeakPolarHBondContact O-CB 3.45Å; D199-K202 PolarHBondContact O-N 3.48Å; L200-K202 VanDerWaalsContact C-N 3.27Å; L200-K202 PolarHBondContact O-N 3.35Å; K202-S205 WeakPolarHBondContact CA-OG 3.36Å; K202-S205 PolarHBondContact O-OG 2.88Å; K202-S206 PolarHBondContact O-N 3.36Å; K202-S206 PolarHBondContact O-OG 3.04Å
203Y82.7Confident77.3Confident166 Ų166103.7 Ų103.765%0.65153%0.525SS*.Hα-helixtrans-68.7-48.4171.2-71-75.1000111.8D199 L200 Q201 S206 F207D199-Y203 WeakPolarHBondContact O-CD2 3.44Å; D199-Y203 PolarHBondContact O-N 3.43Å; L200-Y203 CarbonylContact O-C 3.59Å; L200-Y203 WeakPolarHBondContact O-CA 3.35Å; L200-Y203 WeakPolarHBondContact O-CB 2.99Å; L200-Y203 PolarHBondContact O-N 3.46Å; L200-Y203 VanDerWaalsContact O-N 3.09Å; Q201-Y203 VanDerWaalsContact C-N 3.32Å; Q201-Y203 PolarHBondContact O-N 2.92Å; Y203-S206 WeakPolarHBondContact O-CB 3.42Å; Y203-S206 PolarHBondContact O-N 2.85Å; Y203-F207 WeakPolarHBondContact O-CD2 3.41Å
204C81.4Confident77.2Confident72 Ų72106.3 Ų106.349%0.48654%0.535SS..Hα-helixtrans-65.7-42.5-178.5-72.70000113.3L200 Q201 S206 F207 E208L200-C204 PolarHBondContact O-N 3.39Å; Q201-C204 PolarHBondContact O-N 2.87Å; C204-S206 PolarHBondContact O-N 2.78Å; C204-F207 CarbonylContact O-C 3.55Å; C204-F207 WeakPolarHBondContact O-CA 3.42Å; C204-F207 PolarHBondContact O-N 2.95Å; C204-E208 PolarHBondContact O-N 3.41Å
205S81Confident76.9Confident58 Ų58105.2 Ų105.241%0.40653%0.534SS..Hα-helixtrans-65.3-25.3176.851.50000112.9Q201 K202 F207Q201-S205 VanDerWaalsContact O-CB 3.28Å; Q201-S205 WeakPolarHBondContact O-CB 3.45Å; Q201-S205 PolarHBondContact O-N 2.95Å; Q201-S205 PolarHBondContact O-OG 3.5Å; K202-S205 WeakPolarHBondContact CA-OG 3.36Å; K202-S205 PolarHBondContact O-OG 2.88Å; S205-F207 PolarHBondContact O-N 3.01Å
206S81.7Confident76.2Confident98 Ų98108.9 Ų108.969%0.68554%0.542SS*.Hα-helixtrans-66.5-23.4168.7-58.70000112.8K202 Y203 C204K202-S206 PolarHBondContact O-N 3.36Å; K202-S206 PolarHBondContact O-OG 3.04Å; Y203-S206 WeakPolarHBondContact O-CB 3.42Å; Y203-S206 PolarHBondContact O-N 2.85Å; C204-S206 PolarHBondContact O-N 2.78Å
207F83.5Confident75.9Confident182 Ų182108 Ų10880%0.79854%0.543SS*.Hα-helixtrans-98-35.2176.2-78.6-85.8000113.2Y203 C204 S205Y203-F207 WeakPolarHBondContact O-CD2 3.41Å; C204-F207 CarbonylContact O-C 3.55Å; C204-F207 WeakPolarHBondContact O-CA 3.42Å; C204-F207 PolarHBondContact O-N 2.95Å; S205-F207 PolarHBondContact O-N 3.01Å
208E77.6Confident75.5Confident123 Ų123110.7 Ų110.758%0.57556%0.561SS**  trans-13384-172.8-160.294145.800111.2C204 N210 V211C204-E208 PolarHBondContact O-N 3.41Å; E208-N210 PolarHBondContact O-N 3.08Å; E208-N210 VanDerWaalsContact O-N 3.15Å; E208-V211 HydrophobicContact CG-CG2 4.08Å
209P73.2Confident74.6Confident103 Ų103109 Ų10967%0.66955%0.554SS**THydrogen-bonded Turntrans-72.6-5.8-171.827.6-35.3000115.2
210N73.3Confident73.8Confident148 Ų148111.5 Ų111.579%0.79156%0.557SS**THydrogen-bonded Turntrans-101.7-2.1-170.4-57-45.6000114.3E208E208-N210 PolarHBondContact O-N 3.08Å; E208-N210 VanDerWaalsContact O-N 3.15Å
211V71.4Confident73.3Confident64 Ų64110.9 Ų110.939%0.38855%0.554SS.*  trans-12395.4-175.6-167.40000110.5E208 Y213E208-V211 HydrophobicContact CG-CG2 4.08Å; V211-Y213 HydrophobicContact CB-CD2 4.5Å; V211-Y213 HydrophobicContact CB-CE2 4Å; V211-Y213 HydrophobicContact CG1-CD2 3.8Å; V211-Y213 HydrophobicContact CG1-CE1 4.15Å; V211-Y213 HydrophobicContact CG1-CE2 3.27Å; V211-Y213 HydrophobicContact CG1-CG 4.45Å; V211-Y213 VanDerWaalsContact CG1-CZ 3.47Å; V211-Y213 PolarHBondContact O-N 3.07Å
212E68.6Low72.8Confident160 Ų160110 Ų11075%0.74856%0.56SS**  trans-81109.1171-167.675.3-146.100108.7Q201Q201-E212 PolarHBondContact NE2-OE1 3.13Å; Q201-E212 VanDerWaalsContact NE2-OE1 3.09Å
213Y64.8Low71.5Confident166 Ų166105.4 Ų105.465%0.65155%0.547SS*.  trans-89116.6171.2-71-84.2000109.1V211 V215V211-Y213 HydrophobicContact CB-CD2 4.5Å; V211-Y213 HydrophobicContact CB-CE2 4Å; V211-Y213 HydrophobicContact CG1-CD2 3.8Å; V211-Y213 HydrophobicContact CG1-CE1 4.15Å; V211-Y213 HydrophobicContact CG1-CE2 3.27Å; V211-Y213 HydrophobicContact CG1-CG 4.45Å; V211-Y213 VanDerWaalsContact CG1-CZ 3.47Å; V211-Y213 PolarHBondContact O-N 3.07Å; Y213-V215 WeakPolarHBondContact O-CG2 3.31Å; Y213-V215 PolarHBondContact O-N 3.25Å
214D71.8Confident70.9Confident96 Ų96101.2 Ų101.251%0.51354%0.536SS..  trans-76.673.1173.3-174-4.5000110.4E216 K217 V218D214-E216 PolarHBondContact O-N 3.07Å; D214-K217 HydrophobicContact CB-CB 4.44Å; D214-K217 VanDerWaalsContact CG-CB 3.46Å; D214-K217 PolarHBondContact O-N 2.99Å; D214-K217 WeakPolarHBondContact OD1-CB 3.03Å; D214-K217 PolarHBondContact OD1-N 2.83Å; D214-K217 VanDerWaalsContact OD2-CB 3.3Å; D214-K217 WeakPolarHBondContact OD2-CB 3.39Å; D214-V218 PolarHBondContact O-N 3.14Å
215V64.2Low70.3Confident38 Ų38105.1 Ų105.123%0.2354%0.54CS..Hα-helixtrans-64.1-32.7-179.8-134.30000110.8L197 Q201 Y213 K217 V218 V219L197-V215 HydrophobicContact CD1-CG1 3.84Å; L197-V215 HydrophobicContact CD2-CG1 4.31Å; L197-V215 HydrophobicContact CG-CG1 4.46Å; Q201-V215 VanDerWaalsContact OE1-CG2 3.29Å; Y213-V215 WeakPolarHBondContact O-CG2 3.31Å; Y213-V215 PolarHBondContact O-N 3.25Å; V215-K217 PolarHBondContact O-N 3.2Å; V215-V218 PolarHBondContact O-N 3.38Å; V215-V219 VanDerWaalsContact O-CG2 3.25Å; V215-V219 WeakPolarHBondContact O-CG2 3.49Å; V215-V219 PolarHBondContact O-N 3.26Å
216E63Low69.4Low107 Ų107105 Ų10550%0.554%0.543SS..Hα-helixtrans-60.3-44.7179.5178.5151.1-153.500111.9K194 D214 V219 Y220K194-E216 IonicContact NZ-OE1 2.82Å; K194-E216 PolarHBondContact NZ-OE1 2.9Å; K194-E216 IonicContact NZ-OE2 2.92Å; K194-E216 PolarHBondContact NZ-OE2 3.29Å; D214-E216 PolarHBondContact O-N 3.07Å; E216-V219 PolarHBondContact O-N 2.93Å; E216-Y220 VanDerWaalsContact O-CB 3.3Å; E216-Y220 WeakPolarHBondContact O-CB 3.21Å; E216-Y220 PolarHBondContact O-N 2.92Å
217K70.6Confident68.5Low149 Ų149103.9 Ų103.965%0.64854%0.535SS*.Hα-helixtrans-65.9-40.1176.6-171.7177.8-177.31790113D214 V215 Y220 D221D214-K217 HydrophobicContact CB-CB 4.44Å; D214-K217 VanDerWaalsContact CG-CB 3.46Å; D214-K217 PolarHBondContact O-N 2.99Å; D214-K217 WeakPolarHBondContact OD1-CB 3.03Å; D214-K217 PolarHBondContact OD1-N 2.83Å; D214-K217 VanDerWaalsContact OD2-CB 3.3Å; D214-K217 WeakPolarHBondContact OD2-CB 3.39Å; V215-K217 PolarHBondContact O-N 3.2Å; K217-Y220 PolarHBondContact O-N 3.39Å; K217-D221 PolarHBondContact O-N 3.48Å
218V68.6Low67.8Low106 Ų10698.4 Ų98.464%0.64251%0.513SS*.Hα-helixtrans-65.1-43.6178.6176.10000111.1D214 V215 G222D214-V218 PolarHBondContact O-N 3.14Å; V215-V218 PolarHBondContact O-N 3.38Å; V218-G222 PolarHBondContact O-N 3.47Å; V218-G222 VanDerWaalsContact O-N 3.08Å
219V64.5Low67.3Low41 Ų4196.4 Ų96.425%0.24850%0.504CS..Hα-helixtrans-70.1-37.8178.6-172.90000110.8Y190 L197 V215 E216 G222 C223Y190-V219 HydrophobicContact CD2-CG1 3.36Å; Y190-V219 HydrophobicContact CE2-CB 4.02Å; Y190-V219 HydrophobicContact CE2-CG1 3.22Å; L197-V219 HydrophobicContact CD1-CG2 4.12Å; V215-V219 VanDerWaalsContact O-CG2 3.25Å; V215-V219 WeakPolarHBondContact O-CG2 3.49Å; V215-V219 PolarHBondContact O-N 3.26Å; E216-V219 PolarHBondContact O-N 2.93Å; V219-G222 PolarHBondContact O-N 3.48Å; V219-C223 VanDerWaalsContact O-CB 3.31Å; V219-C223 WeakPolarHBondContact O-CB 3.5Å; V219-C223 PolarHBondContact O-N 2.89Å
220Y66.5Low66.8Low155 Ų15593.3 Ų93.361%0.60848%0.483SS*.Hα-helixtrans-62.7-44.9175.1-173.5-93000112.5E216 K217 C223 N224E216-Y220 VanDerWaalsContact O-CB 3.3Å; E216-Y220 WeakPolarHBondContact O-CB 3.21Å; E216-Y220 PolarHBondContact O-N 2.92Å; K217-Y220 PolarHBondContact O-N 3.39Å; Y220-C223 PolarHBondContact O-N 2.99Å; Y220-N224 WeakPolarHBondContact O-CB 3.32Å; Y220-N224 PolarHBondContact O-N 2.96Å
221D71.5Confident66.3Low86 Ų8691 Ų9146%0.4647%0.47SS..Hα-helixtrans-63.8-42.7176.7-17061.9000111.9K217 C223 R225K217-D221 PolarHBondContact O-N 3.48Å; D221-C223 VanDerWaalsContact C-N 3.33Å; D221-C223 PolarHBondContact O-N 3.34Å; D221-R225 WeakPolarHBondContact O-CB 3.29Å; D221-R225 PolarHBondContact O-N 3.09Å; D221-R225 IonicContact OD2-NH2 3.91Å
222G67Low66.1Low39 Ų3993.2 Ų93.240%0.40248%0.475SS..Hα-helixtrans-62.4-37.9175.400000113.2V218 V219 A226V218-G222 PolarHBondContact O-N 3.47Å; V218-G222 VanDerWaalsContact O-N 3.08Å; V219-G222 PolarHBondContact O-N 3.48Å; G222-A226 WeakPolarHBondContact O-CB 3.41Å; G222-A226 PolarHBondContact O-N 3.29Å
223C54.8Low65.9Low56 Ų5691.6 Ų91.638%0.37847%0.468SS..Hα-helixtrans-70.9-48.1178.2-173.40000112V219 Y220 D221 R225 A226 S227V219-C223 VanDerWaalsContact O-CB 3.31Å; V219-C223 WeakPolarHBondContact O-CB 3.5Å; V219-C223 PolarHBondContact O-N 2.89Å; Y220-C223 PolarHBondContact O-N 2.99Å; D221-C223 VanDerWaalsContact C-N 3.33Å; D221-C223 PolarHBondContact O-N 3.34Å; C223-R225 PolarHBondContact O-N 3.25Å; C223-A226 PolarHBondContact O-N 3.41Å; C223-A226 VanDerWaalsContact O-N 3.07Å; C223-S227 PolarHBondContact O-N 3.44Å; C223-S227 PolarHBondContact O-OG 3.17Å
224N69.8Low65.5Low79 Ų7987.7 Ų87.742%0.42246%0.455SS..Hα-helixtrans-61.1-38.5177.1-161.534000110.4Y220 I228Y220-N224 WeakPolarHBondContact O-CB 3.32Å; Y220-N224 PolarHBondContact O-N 2.96Å; N224-I228 VanDerWaalsContact O-CB 3.23Å; N224-I228 WeakPolarHBondContact O-CB 3.47Å; N224-I228 WeakPolarHBondContact O-CD1 3.4Å; N224-I228 WeakPolarHBondContact O-CG1 3.32Å; N224-I228 PolarHBondContact O-N 3.16Å
225R69.2Low65Low154 Ų15488.2 Ų88.258%0.58146%0.457SS*.Hα-helixtrans-60.8-48.1171.3-171179.4-62.8-101.3-0.9112D221 C223 I228 E229D221-R225 WeakPolarHBondContact O-CB 3.29Å; D221-R225 PolarHBondContact O-N 3.09Å; D221-R225 IonicContact OD2-NH2 3.91Å; C223-R225 PolarHBondContact O-N 3.25Å; R225-I228 PolarHBondContact O-N 3.14Å; R225-E229 HydrophobicContact CG-CG 4.47Å; R225-E229 WeakPolarHBondContact O-CB 3.39Å; R225-E229 VanDerWaalsContact O-CG 3.26Å; R225-E229 WeakPolarHBondContact O-CG 3.32Å; R225-E229 PolarHBondContact O-N 2.78Å
226A61.2Low64.9Low56 Ų5692.2 Ų92.246%0.46348%0.477SS..Hα-helixtrans-64.2-43.8179.100000113G222 C223 I228 E229 V230G222-A226 WeakPolarHBondContact O-CB 3.41Å; G222-A226 PolarHBondContact O-N 3.29Å; C223-A226 PolarHBondContact O-N 3.41Å; C223-A226 VanDerWaalsContact O-N 3.07Å; A226-I228 VanDerWaalsContact C-N 3.35Å; A226-E229 PolarHBondContact O-N 3.47Å; A226-V230 VanDerWaalsContact O-CG2 3.31Å; A226-V230 WeakPolarHBondContact O-CG2 3.43Å; A226-V230 PolarHBondContact O-N 3.03Å
227S64.2Low64.6Low73 Ų7392.7 Ų92.751%0.5149%0.487SS..Hα-helixtrans-62.3-41.5174.8-68.60000111.9C223 L231C223-S227 PolarHBondContact O-N 3.44Å; C223-S227 PolarHBondContact O-OG 3.17Å; S227-L231 WeakPolarHBondContact O-CB 3.45Å; S227-L231 PolarHBondContact O-N 2.99Å
228I67.9Low63.5Low68 Ų6892.6 Ų92.635%0.34949%0.489SS..Hα-helixtrans-64.9-43.1175.1-72.3167.4000111N224 R225 A226 L231 K232N224-I228 VanDerWaalsContact O-CB 3.23Å; N224-I228 WeakPolarHBondContact O-CB 3.47Å; N224-I228 WeakPolarHBondContact O-CD1 3.4Å; N224-I228 WeakPolarHBondContact O-CG1 3.32Å; N224-I228 PolarHBondContact O-N 3.16Å; R225-I228 PolarHBondContact O-N 3.14Å; A226-I228 VanDerWaalsContact C-N 3.35Å; I228-L231 PolarHBondContact O-N 3.48Å; I228-K232 HydrophobicContact CG2-CD 4.1Å; I228-K232 HydrophobicContact CG2-CG 4.33Å; I228-K232 WeakPolarHBondContact O-CB 3.33Å; I228-K232 VanDerWaalsContact O-CG 3.26Å; I228-K232 WeakPolarHBondContact O-CG 3.37Å; I228-K232 PolarHBondContact O-N 2.92Å
229E68.3Low62.4Low81 Ų8189.6 Ų89.638%0.37948%0.479SS..Hα-helixtrans-67.3-40.2179.7-71.6-5512400112.1R225 A226 K232 M233R225-E229 HydrophobicContact CG-CG 4.47Å; R225-E229 WeakPolarHBondContact O-CB 3.39Å; R225-E229 VanDerWaalsContact O-CG 3.26Å; R225-E229 WeakPolarHBondContact O-CG 3.32Å; R225-E229 PolarHBondContact O-N 2.78Å; A226-E229 PolarHBondContact O-N 3.47Å; E229-K232 PolarHBondContact O-N 3.24Å; E229-K232 IonicContact OE1-NZ 3.5Å; E229-K232 PolarHBondContact OE1-NZ 3.08Å; E229-M233 WeakPolarHBondContact O-CG 3.32Å; E229-M233 PolarHBondContact O-N 3.32Å
230V62.7Low61.6Low38 Ų3897.1 Ų97.123%0.2351%0.505CS..Hα-helixtrans-65.6-44.9173.5175.50000110.4F179 A226 K232 M233 F234F179-V230 HydrophobicContact CE2-CG1 3.73Å; A226-V230 VanDerWaalsContact O-CG2 3.31Å; A226-V230 WeakPolarHBondContact O-CG2 3.43Å; A226-V230 PolarHBondContact O-N 3.03Å; V230-K232 VanDerWaalsContact C-N 3.31Å; V230-K232 PolarHBondContact O-N 3.47Å; V230-M233 PolarHBondContact O-N 3.12Å; V230-M233 VanDerWaalsContact O-N 3.15Å; V230-F234 HydrophobicContact CG1-CD2 3.64Å; V230-F234 HydrophobicContact CG1-CE2 3.62Å; V230-F234 VanDerWaalsContact O-CD2 3.27Å; V230-F234 WeakPolarHBondContact O-CD2 3.39Å; V230-F234 PolarHBondContact O-N 3.07Å
231L62Low60.5Low99 Ų9998.2 Ų98.252%0.51852%0.521SS..Hα-helixtrans-61.3-39.6176.6-17171000111.7S227 I228 F234 L235S227-L231 WeakPolarHBondContact O-CB 3.45Å; S227-L231 PolarHBondContact O-N 2.99Å; I228-L231 PolarHBondContact O-N 3.48Å; L231-F234 PolarHBondContact O-N 3.21Å; L231-L235 HydrophobicContact CD2-CD1 4.37Å; L231-L235 HydrophobicContact CG-CD1 3.93Å; L231-L235 HydrophobicContact CG-CG 4.45Å; L231-L235 WeakPolarHBondContact O-CB 3.37Å; L231-L235 VanDerWaalsContact O-CG 3.3Å; L231-L235 WeakPolarHBondContact O-CG 3.45Å; L231-L235 PolarHBondContact O-N 3.25Å
232K67.8Low59.2Low111 Ų11197.6 Ų97.648%0.48353%0.528SS..Hα-helixtrans-63.2-43.5172.5-78.2175.4-174.1168.50111.8I228 E229 V230 F234 L235 N236I228-K232 HydrophobicContact CG2-CD 4.1Å; I228-K232 HydrophobicContact CG2-CG 4.33Å; I228-K232 WeakPolarHBondContact O-CB 3.33Å; I228-K232 VanDerWaalsContact O-CG 3.26Å; I228-K232 WeakPolarHBondContact O-CG 3.37Å; I228-K232 PolarHBondContact O-N 2.92Å; E229-K232 PolarHBondContact O-N 3.24Å; E229-K232 IonicContact OE1-NZ 3.5Å; E229-K232 PolarHBondContact OE1-NZ 3.08Å; V230-K232 VanDerWaalsContact C-N 3.31Å; V230-K232 PolarHBondContact O-N 3.47Å; K232-F234 VanDerWaalsContact C-N 3.31Å; K232-F234 PolarHBondContact O-N 3.23Å; K232-L235 PolarHBondContact O-N 2.91Å; K232-N236 WeakPolarHBondContact O-CB 3.38Å; K232-N236 PolarHBondContact O-N 3.05Å
233M64.3Low57.9Low126 Ų126103.7 Ų103.762%0.62155%0.549SS*.Hα-helixtrans-60.6-42.7174.7-72.8-173.7-158.100111.1E229 V230 V237E229-M233 WeakPolarHBondContact O-CG 3.32Å; E229-M233 PolarHBondContact O-N 3.32Å; V230-M233 PolarHBondContact O-N 3.12Å; V230-M233 VanDerWaalsContact O-N 3.15Å; M233-V237 WeakPolarHBondContact O-CB 3.49Å; M233-V237 VanDerWaalsContact O-CG2 3.25Å; M233-V237 WeakPolarHBondContact O-CG2 3.45Å; M233-V237 PolarHBondContact O-N 3.25Å
234F56.4Low57.2Low84 Ų84112.1 Ų112.137%0.36859%0.591SS.*Hα-helixtrans-66.2-43.8176.7-87.5-76.9000112.7F179 V230 L231 K232 V237 H238F179-F234 AromaticContact CD2-CE2 3.87Å; F179-F234 HydrophobicContact CD2-CE2 3.87Å; F179-F234 HydrophobicContact CD2-CZ 4.29Å; F179-F234 HydrophobicContact CE2-CE2 4.12Å; V230-F234 HydrophobicContact CG1-CD2 3.64Å; V230-F234 HydrophobicContact CG1-CE2 3.62Å; V230-F234 VanDerWaalsContact O-CD2 3.27Å; V230-F234 WeakPolarHBondContact O-CD2 3.39Å; V230-F234 PolarHBondContact O-N 3.07Å; L231-F234 PolarHBondContact O-N 3.21Å; K232-F234 VanDerWaalsContact C-N 3.31Å; K232-F234 PolarHBondContact O-N 3.23Å; F234-V237 PolarHBondContact O-N 3.34Å; F234-H238 WeakPolarHBondContact O-CB 3.38Å; F234-H238 PolarHBondContact O-N 3.05Å
235L60.6Low56.5Low106 Ų106113.8 Ų113.856%0.55560%0.599SS**Hα-helixtrans-67.1-39177.4-75.9168.2000111.9L231 K232 V237 H238 G239L231-L235 HydrophobicContact CD2-CD1 4.37Å; L231-L235 HydrophobicContact CG-CD1 3.93Å; L231-L235 HydrophobicContact CG-CG 4.45Å; L231-L235 WeakPolarHBondContact O-CB 3.37Å; L231-L235 VanDerWaalsContact O-CG 3.3Å; L231-L235 WeakPolarHBondContact O-CG 3.45Å; L231-L235 PolarHBondContact O-N 3.25Å; K232-L235 PolarHBondContact O-N 2.91Å; L235-V237 VanDerWaalsContact C-N 3.29Å; L235-V237 PolarHBondContact O-N 2.77Å; L235-H238 PolarHBondContact O-N 3.32Å; L235-G239 PolarHBondContact O-N 3.23Å
236N62.6Low55.9Low122 Ų122111.7 Ų111.765%0.65260%0.6SS**Hα-helixtrans-65.3-34.7175.8-167.437.7000111.7K232K232-N236 WeakPolarHBondContact O-CB 3.38Å; K232-N236 PolarHBondContact O-N 3.05Å
237V55.8Low55.6Low117 Ų117114.8 Ų114.871%0.70961%0.608SS**Hα-helixtrans-74-33.3173.31690000112.4M233 F234 L235M233-V237 WeakPolarHBondContact O-CB 3.49Å; M233-V237 VanDerWaalsContact O-CG2 3.25Å; M233-V237 WeakPolarHBondContact O-CG2 3.45Å; M233-V237 PolarHBondContact O-N 3.25Å; F234-V237 PolarHBondContact O-N 3.34Å; L235-V237 VanDerWaalsContact C-N 3.29Å; L235-V237 PolarHBondContact O-N 2.77Å
238H48.4Very low55.1Low147 Ų147117.2 Ų117.268%0.68161%0.614SS**Hα-helixtrans-94.1-7.7-176-96.972.8000116.3F234 L235F234-H238 WeakPolarHBondContact O-CB 3.38Å; F234-H238 PolarHBondContact O-N 3.05Å; L235-H238 PolarHBondContact O-N 3.32Å
239G46Very low54.3Low43 Ų43120.3 Ų120.344%0.44363%0.63SS.*  trans162.889.3172.100000115.6L235L235-G239 PolarHBondContact O-N 3.23Å
240Y47Very low53.3Low200 Ų200122.9 Ų122.978%0.78465%0.647SS**SBendtrans-134.149.1151.6-119-87.5000111.5
241N43Very low52.7Low177 Ų177129 Ų12995%0.94768%0.677SS**SBendtrans-124.929154.6-85.6-14.7000110
242A45Very low51.9Low73 Ų73131.3 Ų131.360%0.60369%0.689SS**  trans-128.688.4171.600000107.4
243I39.2Very low50.6Low168 Ų168133 Ų13386%0.86271%0.706SS**  trans162.2108.6139.6-78154.2000105.8
244D39.3Very low49.4Very low233 Ų233133.6 Ų133.6100%1.24671%0.714SS**  trans-49.20161-61.3-60.9000112.4

Retrieved 244 of 244 residues in 42.3 ms (Link to these results)

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